data_15063_sparta save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15063 _Entry.PDB_ID 2JMU _Entry.NMR_STAR_version 3.0.9.100 save_ save_delta_chem_shifts_single _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single _Entity_delta_chem_shifts.Conformer_type "single" _Entity_delta_chem_shifts.Conformer_count 20 _Entity_delta_chem_shifts.Best_conformer 1 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Conformer_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 1 . 1 1 1 A 2 2 ALA HA H 2 4.274 4.825 -0.551 1 1 5 . 1 1 1 A 2 2 ALA C C 2 177.828 177.147 0.681 1 1 6 . 1 1 1 A 2 2 ALA CA C 2 52.984 51.124 1.860 1 1 7 . 1 1 1 A 2 2 ALA CB C 2 19.138 19.834 -0.696 1 1 8 . 1 1 1 A 3 3 GLN H H 3 8.463 8.863 -0.400 1 1 9 . 1 1 1 A 3 3 GLN HA H 3 4.676 4.715 -0.039 1 1 12 . 1 1 1 A 3 3 GLN C C 3 176.002 176.036 -0.034 1 1 13 . 1 1 1 A 3 3 GLN CA C 3 56.258 54.672 1.586 1 1 14 . 1 1 1 A 3 3 GLN CB C 3 30.346 29.494 0.852 1 1 15 . 1 1 1 A 3 3 GLN N N 3 117.490 120.237 -2.747 1 1 16 . 1 1 1 A 4 4 GLY H H 4 8.099 8.043 0.056 1 1 17 . 1 1 1 A 4 4 GLY HA2 H 4 3.910 4.059 -0.149 1 1 18 . 1 1 1 A 4 4 GLY C C 4 173.332 173.893 -0.561 1 1 19 . 1 1 1 A 4 4 GLY CA C 4 45.333 45.115 0.218 1 1 20 . 1 1 1 A 4 4 GLY N N 4 109.423 110.435 -1.012 1 1 21 . 1 1 1 A 5 5 LEU H H 5 7.863 8.320 -0.457 1 1 22 . 1 1 1 A 5 5 LEU HA H 5 4.561 4.301 0.260 1 1 32 . 1 1 1 A 5 5 LEU C C 5 176.448 176.144 0.304 1 1 33 . 1 1 1 A 5 5 LEU CA C 5 54.713 54.565 0.148 1 1 34 . 1 1 1 A 5 5 LEU CB C 5 43.551 41.451 2.100 1 1 38 . 1 1 1 A 5 5 LEU N N 5 120.391 123.356 -2.965 1 1 39 . 1 1 1 A 6 6 ILE H H 6 8.764 9.342 -0.578 1 1 40 . 1 1 1 A 6 6 ILE HA H 6 4.087 4.220 -0.133 1 1 49 . 1 1 1 A 6 6 ILE C C 6 174.679 175.357 -0.678 1 1 50 . 1 1 1 A 6 6 ILE CA C 6 61.279 61.707 -0.428 1 1 51 . 1 1 1 A 6 6 ILE CB C 6 39.651 37.651 2.000 1 1 54 . 1 1 1 A 6 6 ILE N N 6 123.050 125.613 -2.563 1 1 55 . 1 1 1 A 7 7 GLU H H 7 8.587 8.747 -0.160 1 1 56 . 1 1 1 A 7 7 GLU HA H 7 4.917 4.869 0.048 1 1 61 . 1 1 1 A 7 7 GLU C C 7 175.978 176.128 -0.150 1 1 62 . 1 1 1 A 7 7 GLU CA C 7 56.127 56.053 0.074 1 1 63 . 1 1 1 A 7 7 GLU CB C 7 31.115 30.253 0.862 1 1 65 . 1 1 1 A 7 7 GLU N N 7 127.415 127.996 -0.581 1 1 66 . 1 1 1 A 8 8 VAL H H 8 8.986 9.160 -0.174 1 1 67 . 1 1 1 A 8 8 VAL HA H 8 4.375 4.942 -0.567 1 1 72 . 1 1 1 A 8 8 VAL C C 8 173.704 175.168 -1.464 1 1 73 . 1 1 1 A 8 8 VAL CA C 8 61.347 60.996 0.351 1 1 74 . 1 1 1 A 8 8 VAL CB C 8 33.611 33.484 0.127 1 1 76 . 1 1 1 A 8 8 VAL N N 8 126.071 119.929 6.142 1 1 77 . 1 1 1 A 9 9 GLU H H 9 8.521 9.081 -0.560 1 1 78 . 1 1 1 A 9 9 GLU HA H 9 5.837 5.728 0.109 1 1 81 . 1 1 1 A 9 9 GLU C C 9 175.939 175.147 0.792 1 1 82 . 1 1 1 A 9 9 GLU CA C 9 54.516 54.581 -0.065 1 1 83 . 1 1 1 A 9 9 GLU CB C 9 33.009 33.206 -0.197 1 1 84 . 1 1 1 A 9 9 GLU N N 9 122.857 124.370 -1.513 1 1 85 . 1 1 1 A 10 10 ARG H H 10 8.690 8.845 -0.155 1 1 86 . 1 1 1 A 10 10 ARG HA H 10 4.709 5.095 -0.386 1 1 94 . 1 1 1 A 10 10 ARG C C 10 174.826 174.113 0.713 1 1 95 . 1 1 1 A 10 10 ARG CA C 10 54.491 53.984 0.507 1 1 96 . 1 1 1 A 10 10 ARG CB C 10 35.777 34.474 1.303 1 1 98 . 1 1 1 A 10 10 ARG N N 10 120.430 121.583 -1.153 1 1 100 . 1 1 1 A 11 11 LYS H H 11 8.874 8.746 0.128 1 1 101 . 1 1 1 A 11 11 LYS HA H 11 5.530 5.347 0.183 1 1 107 . 1 1 1 A 11 11 LYS C C 11 176.919 174.820 2.099 1 1 108 . 1 1 1 A 11 11 LYS CA C 11 55.084 54.684 0.400 1 1 109 . 1 1 1 A 11 11 LYS CB C 11 35.435 35.303 0.132 1 1 113 . 1 1 1 A 11 11 LYS N N 11 121.087 123.285 -2.198 1 1 114 . 1 1 1 A 12 12 PHE H H 12 8.877 9.548 -0.671 1 1 115 . 1 1 1 A 12 12 PHE HA H 12 5.130 5.299 -0.169 1 1 120 . 1 1 1 A 12 12 PHE C C 12 171.676 173.245 -1.569 1 1 121 . 1 1 1 A 12 12 PHE CA C 12 55.869 56.455 -0.586 1 1 122 . 1 1 1 A 12 12 PHE CB C 12 42.108 43.083 -0.975 1 1 125 . 1 1 1 A 12 12 PHE N N 12 117.486 127.449 -9.963 1 1 126 . 1 1 1 A 13 13 ALA H H 13 9.134 8.529 0.605 1 1 127 . 1 1 1 A 13 13 ALA HA H 13 5.003 4.612 0.391 1 1 131 . 1 1 1 A 13 13 ALA CA C 13 48.340 48.566 -0.226 1 1 132 . 1 1 1 A 13 13 ALA CB C 13 19.191 20.010 -0.819 1 1 133 . 1 1 1 A 13 13 ALA N N 13 125.915 128.754 -2.839 1 1 134 . 1 1 1 A 14 14 PRO HA H 14 4.620 4.249 0.371 1 1 140 . 1 1 1 A 14 14 PRO C C 14 176.502 177.259 -0.757 1 1 141 . 1 1 1 A 14 14 PRO CA C 14 62.672 62.057 0.615 1 1 142 . 1 1 1 A 14 14 PRO CB C 14 33.119 32.191 0.928 1 1 145 . 1 1 1 A 15 15 GLY H H 15 8.721 8.469 0.252 1 1 146 . 1 1 1 A 15 15 GLY HA2 H 15 3.999 4.028 -0.029 1 1 147 . 1 1 1 A 15 15 GLY HA3 H 15 4.632 4.055 0.577 1 1 148 . 1 1 1 A 15 15 GLY CA C 15 44.411 43.999 0.412 1 1 149 . 1 1 1 A 15 15 GLY N N 15 109.863 107.904 1.959 1 1 150 . 1 1 1 A 16 16 PRO HA H 16 4.447 4.576 -0.129 1 1 155 . 1 1 1 A 16 16 PRO C C 16 177.053 176.016 1.037 1 1 156 . 1 1 1 A 16 16 PRO CA C 16 64.395 63.760 0.635 1 1 157 . 1 1 1 A 16 16 PRO CB C 16 31.993 32.340 -0.347 1 1 159 . 1 1 1 A 17 17 ASP H H 17 8.550 8.450 0.100 1 1 160 . 1 1 1 A 17 17 ASP HA H 17 4.950 4.842 0.108 1 1 163 . 1 1 1 A 17 17 ASP C C 17 176.800 176.508 0.292 1 1 164 . 1 1 1 A 17 17 ASP CA C 17 53.271 53.949 -0.678 1 1 165 . 1 1 1 A 17 17 ASP CB C 17 40.392 41.502 -1.110 1 1 166 . 1 1 1 A 17 17 ASP N N 17 116.060 118.726 -2.666 1 1 167 . 1 1 1 A 18 18 THR H H 18 7.664 7.575 0.089 1 1 168 . 1 1 1 A 18 18 THR HA H 18 4.120 3.689 0.431 1 1 174 . 1 1 1 A 18 18 THR C C 18 175.407 176.343 -0.936 1 1 175 . 1 1 1 A 18 18 THR CA C 18 68.718 67.212 1.506 1 1 176 . 1 1 1 A 18 18 THR CB C 18 69.179 68.519 0.660 1 1 178 . 1 1 1 A 18 18 THR N N 18 117.158 115.148 2.010 1 1 179 . 1 1 1 A 19 19 GLU H H 19 8.817 8.539 0.278 1 1 180 . 1 1 1 A 19 19 GLU HA H 19 3.510 3.384 0.126 1 1 184 . 1 1 1 A 19 19 GLU C C 19 178.345 179.243 -0.898 1 1 185 . 1 1 1 A 19 19 GLU CA C 19 61.237 59.935 1.302 1 1 186 . 1 1 1 A 19 19 GLU CB C 19 28.746 29.378 -0.632 1 1 188 . 1 1 1 A 19 19 GLU N N 19 118.802 119.144 -0.342 1 1 189 . 1 1 1 A 20 20 GLU H H 20 7.976 8.061 -0.085 1 1 190 . 1 1 1 A 20 20 GLU HA H 20 4.036 4.106 -0.070 1 1 194 . 1 1 1 A 20 20 GLU C C 20 179.451 179.169 0.282 1 1 195 . 1 1 1 A 20 20 GLU CA C 20 59.909 59.052 0.857 1 1 196 . 1 1 1 A 20 20 GLU CB C 20 28.992 29.433 -0.441 1 1 198 . 1 1 1 A 20 20 GLU N N 20 121.130 119.960 1.170 1 1 199 . 1 1 1 A 21 21 ARG H H 21 8.199 7.852 0.347 1 1 200 . 1 1 1 A 21 21 ARG HA H 21 4.061 4.004 0.057 1 1 207 . 1 1 1 A 21 21 ARG C C 21 179.087 178.865 0.222 1 1 208 . 1 1 1 A 21 21 ARG CA C 21 58.477 58.613 -0.136 1 1 209 . 1 1 1 A 21 21 ARG CB C 21 30.101 30.082 0.019 1 1 211 . 1 1 1 A 21 21 ARG N N 21 119.897 120.399 -0.502 1 1 213 . 1 1 1 A 22 22 LEU H H 22 8.154 8.363 -0.209 1 1 214 . 1 1 1 A 22 22 LEU HA H 22 3.560 3.743 -0.183 1 1 224 . 1 1 1 A 22 22 LEU C C 22 178.461 179.159 -0.698 1 1 225 . 1 1 1 A 22 22 LEU CA C 22 58.432 57.646 0.786 1 1 226 . 1 1 1 A 22 22 LEU CB C 22 40.229 40.669 -0.440 1 1 230 . 1 1 1 A 22 22 LEU N N 22 120.012 119.577 0.435 1 1 231 . 1 1 1 A 23 23 GLN H H 23 7.621 7.902 -0.281 1 1 232 . 1 1 1 A 23 23 GLN HA H 23 4.232 4.046 0.186 1 1 238 . 1 1 1 A 23 23 GLN C C 23 180.543 178.830 1.713 1 1 239 . 1 1 1 A 23 23 GLN CA C 23 59.434 59.200 0.234 1 1 240 . 1 1 1 A 23 23 GLN CB C 23 28.749 28.544 0.205 1 1 242 . 1 1 1 A 23 23 GLN N N 23 117.823 117.825 -0.002 1 1 244 . 1 1 1 A 24 24 GLU H H 24 8.165 7.994 0.171 1 1 245 . 1 1 1 A 24 24 GLU HA H 24 4.072 4.068 0.004 1 1 249 . 1 1 1 A 24 24 GLU C C 24 178.612 179.338 -0.726 1 1 250 . 1 1 1 A 24 24 GLU CA C 24 59.236 59.224 0.012 1 1 251 . 1 1 1 A 24 24 GLU CB C 24 29.606 29.239 0.367 1 1 253 . 1 1 1 A 24 24 GLU N N 24 122.589 120.095 2.494 1 1 254 . 1 1 1 A 25 25 LEU H H 25 7.911 7.687 0.224 1 1 255 . 1 1 1 A 25 25 LEU HA H 25 4.214 4.152 0.062 1 1 265 . 1 1 1 A 25 25 LEU C C 25 176.745 177.002 -0.257 1 1 266 . 1 1 1 A 25 25 LEU CA C 25 55.659 55.865 -0.206 1 1 267 . 1 1 1 A 25 25 LEU CB C 25 43.109 42.900 0.209 1 1 271 . 1 1 1 A 25 25 LEU N N 25 117.882 118.034 -0.152 1 1 272 . 1 1 1 A 26 26 GLY H H 26 7.776 7.873 -0.097 1 1 273 . 1 1 1 A 26 26 GLY HA2 H 26 4.337 4.076 0.261 1 1 274 . 1 1 1 A 26 26 GLY HA3 H 26 3.856 4.089 -0.233 1 1 275 . 1 1 1 A 26 26 GLY C C 26 175.456 174.630 0.826 1 1 276 . 1 1 1 A 26 26 GLY CA C 26 44.875 45.032 -0.157 1 1 277 . 1 1 1 A 26 26 GLY N N 26 104.938 105.499 -0.561 1 1 278 . 1 1 1 A 27 27 ALA H H 27 8.104 8.351 -0.247 1 1 279 . 1 1 1 A 27 27 ALA HA H 27 4.949 4.787 0.162 1 1 283 . 1 1 1 A 27 27 ALA C C 27 176.448 178.128 -1.680 1 1 284 . 1 1 1 A 27 27 ALA CA C 27 52.183 52.462 -0.279 1 1 285 . 1 1 1 A 27 27 ALA CB C 27 21.814 20.105 1.709 1 1 286 . 1 1 1 A 27 27 ALA N N 27 123.263 123.938 -0.675 1 1 287 . 1 1 1 A 28 28 THR H H 28 9.369 8.793 0.576 1 1 288 . 1 1 1 A 28 28 THR HA H 28 4.779 4.894 -0.115 1 1 293 . 1 1 1 A 28 28 THR C C 28 173.725 173.591 0.134 1 1 294 . 1 1 1 A 28 28 THR CA C 28 60.046 60.423 -0.377 1 1 295 . 1 1 1 A 28 28 THR CB C 28 70.592 70.275 0.317 1 1 297 . 1 1 1 A 28 28 THR N N 28 112.201 112.214 -0.013 1 1 298 . 1 1 1 A 29 29 LEU H H 29 8.518 8.481 0.037 1 1 299 . 1 1 1 A 29 29 LEU HA H 29 3.332 3.667 -0.335 1 1 309 . 1 1 1 A 29 29 LEU C C 29 176.202 175.709 0.493 1 1 310 . 1 1 1 A 29 29 LEU CA C 29 55.031 53.854 1.177 1 1 311 . 1 1 1 A 29 29 LEU CB C 29 40.624 40.887 -0.263 1 1 315 . 1 1 1 A 29 29 LEU N N 29 128.151 125.609 2.542 1 1 316 . 1 1 1 A 30 30 GLU H H 30 9.269 9.190 0.079 1 1 317 . 1 1 1 A 30 30 GLU HA H 30 4.287 4.220 0.067 1 1 321 . 1 1 1 A 30 30 GLU C C 30 176.740 176.388 0.352 1 1 322 . 1 1 1 A 30 30 GLU CA C 30 57.283 58.674 -1.391 1 1 323 . 1 1 1 A 30 30 GLU CB C 30 31.045 30.744 0.301 1 1 325 . 1 1 1 A 30 30 GLU N N 30 130.123 127.242 2.881 1 1 326 . 1 1 1 A 31 31 HIS H H 31 7.341 6.939 0.402 1 1 327 . 1 1 1 A 31 31 HIS HA H 31 4.701 4.703 -0.002 1 1 331 . 1 1 1 A 31 31 HIS C C 31 172.581 172.697 -0.116 1 1 332 . 1 1 1 A 31 31 HIS CA C 31 55.876 56.322 -0.446 1 1 333 . 1 1 1 A 31 31 HIS CB C 31 33.434 32.664 0.770 1 1 334 . 1 1 1 A 31 31 HIS N N 31 113.223 114.708 -1.485 1 1 335 . 1 1 1 A 32 32 ARG H H 32 8.196 8.557 -0.361 1 1 336 . 1 1 1 A 32 32 ARG HA H 32 5.262 5.345 -0.083 1 1 341 . 1 1 1 A 32 32 ARG C C 32 174.377 175.012 -0.635 1 1 342 . 1 1 1 A 32 32 ARG CA C 32 55.808 54.492 1.316 1 1 343 . 1 1 1 A 32 32 ARG CB C 32 33.340 33.833 -0.493 1 1 345 . 1 1 1 A 32 32 ARG N N 32 123.003 123.255 -0.252 1 1 346 . 1 1 1 A 33 33 VAL H H 33 8.956 8.868 0.088 1 1 347 . 1 1 1 A 33 33 VAL HA H 33 4.734 5.013 -0.279 1 1 355 . 1 1 1 A 33 33 VAL C C 33 172.821 175.176 -2.355 1 1 356 . 1 1 1 A 33 33 VAL CA C 33 60.197 60.046 0.151 1 1 357 . 1 1 1 A 33 33 VAL CB C 33 35.860 34.442 1.418 1 1 360 . 1 1 1 A 33 33 VAL N N 33 122.929 117.768 5.161 1 1 361 . 1 1 1 A 34 34 THR H H 34 8.250 8.870 -0.620 1 1 362 . 1 1 1 A 34 34 THR HA H 34 5.616 5.718 -0.102 1 1 367 . 1 1 1 A 34 34 THR C C 34 173.913 173.624 0.289 1 1 368 . 1 1 1 A 34 34 THR CA C 34 60.245 60.630 -0.385 1 1 369 . 1 1 1 A 34 34 THR CB C 34 71.706 71.283 0.423 1 1 371 . 1 1 1 A 34 34 THR N N 34 119.164 116.597 2.567 1 1 372 . 1 1 1 A 35 35 PHE H H 35 8.565 8.411 0.154 1 1 373 . 1 1 1 A 35 35 PHE HA H 35 5.029 5.031 -0.002 1 1 378 . 1 1 1 A 35 35 PHE C C 35 173.193 172.173 1.020 1 1 379 . 1 1 1 A 35 35 PHE CA C 35 55.687 55.886 -0.199 1 1 380 . 1 1 1 A 35 35 PHE CB C 35 40.853 41.185 -0.332 1 1 383 . 1 1 1 A 35 35 PHE N N 35 120.244 118.487 1.757 1 1 384 . 1 1 1 A 36 36 ARG H H 36 8.869 8.492 0.377 1 1 385 . 1 1 1 A 36 36 ARG HA H 36 4.982 4.773 0.209 1 1 387 . 1 1 1 A 36 36 ARG C C 36 174.743 175.217 -0.474 1 1 388 . 1 1 1 A 36 36 ARG CA C 36 55.493 55.890 -0.397 1 1 389 . 1 1 1 A 36 36 ARG CB C 36 32.228 31.538 0.690 1 1 390 . 1 1 1 A 36 36 ARG N N 36 123.893 121.338 2.555 1 1 391 . 1 1 1 A 37 37 ASP H H 37 8.402 9.372 -0.970 1 1 392 . 1 1 1 A 37 37 ASP HA H 37 5.462 5.855 -0.393 1 1 395 . 1 1 1 A 37 37 ASP C C 37 175.177 174.758 0.419 1 1 396 . 1 1 1 A 37 37 ASP CA C 37 53.942 52.683 1.259 1 1 397 . 1 1 1 A 37 37 ASP CB C 37 45.486 42.698 2.788 1 1 398 . 1 1 1 A 37 37 ASP N N 37 127.149 124.950 2.199 1 1 399 . 1 1 1 A 38 38 THR H H 38 8.151 9.594 -1.443 1 1 400 . 1 1 1 A 38 38 THR HA H 38 4.866 4.819 0.047 1 1 405 . 1 1 1 A 38 38 THR C C 38 172.792 173.717 -0.925 1 1 406 . 1 1 1 A 38 38 THR CA C 38 61.416 61.856 -0.440 1 1 407 . 1 1 1 A 38 38 THR CB C 38 71.047 69.596 1.451 1 1 409 . 1 1 1 A 38 38 THR N N 38 115.686 120.375 -4.689 1 1 410 . 1 1 1 A 39 39 TYR H H 39 9.021 9.821 -0.800 1 1 411 . 1 1 1 A 39 39 TYR HA H 39 5.544 5.813 -0.269 1 1 416 . 1 1 1 A 39 39 TYR C C 39 176.032 174.657 1.375 1 1 417 . 1 1 1 A 39 39 TYR CA C 39 57.184 56.118 1.066 1 1 418 . 1 1 1 A 39 39 TYR CB C 39 41.642 40.275 1.367 1 1 420 . 1 1 1 A 39 39 TYR N N 39 124.579 127.136 -2.557 1 1 421 . 1 1 1 A 40 40 TYR H H 40 8.487 9.150 -0.663 1 1 422 . 1 1 1 A 40 40 TYR HA H 40 5.517 5.730 -0.213 1 1 426 . 1 1 1 A 40 40 TYR C C 40 174.108 174.489 -0.381 1 1 427 . 1 1 1 A 40 40 TYR CA C 40 56.979 56.844 0.135 1 1 428 . 1 1 1 A 40 40 TYR CB C 40 44.132 42.448 1.684 1 1 431 . 1 1 1 A 40 40 TYR N N 40 119.709 122.485 -2.776 1 1 432 . 1 1 1 A 41 41 ASP H H 41 9.341 8.806 0.535 1 1 433 . 1 1 1 A 41 41 ASP HA H 41 4.866 5.105 -0.239 1 1 436 . 1 1 1 A 41 41 ASP C C 41 177.262 174.701 2.561 1 1 437 . 1 1 1 A 41 41 ASP CA C 41 53.445 53.418 0.027 1 1 438 . 1 1 1 A 41 41 ASP CB C 41 45.347 44.647 0.700 1 1 439 . 1 1 1 A 41 41 ASP N N 41 117.995 120.518 -2.523 1 1 440 . 1 1 1 A 42 42 THR H H 42 11.574 8.659 2.915 1 1 441 . 1 1 1 A 42 42 THR HA H 42 5.206 4.519 0.687 1 1 446 . 1 1 1 A 42 42 THR C C 42 177.935 176.321 1.614 1 1 447 . 1 1 1 A 42 42 THR CA C 42 60.400 61.113 -0.713 1 1 448 . 1 1 1 A 42 42 THR CB C 42 72.114 70.900 1.214 1 1 450 . 1 1 1 A 42 42 THR N N 42 114.394 114.636 -0.242 1 1 451 . 1 1 1 A 43 43 SER H H 43 9.715 8.837 0.878 1 1 452 . 1 1 1 A 43 43 SER HA H 43 4.252 4.226 0.026 1 1 455 . 1 1 1 A 43 43 SER C C 43 175.478 175.238 0.240 1 1 456 . 1 1 1 A 43 43 SER CA C 43 61.277 60.811 0.466 1 1 457 . 1 1 1 A 43 43 SER CB C 43 62.821 63.017 -0.196 1 1 458 . 1 1 1 A 43 43 SER N N 43 116.674 115.945 0.729 1 1 459 . 1 1 1 A 44 44 GLU H H 44 7.674 7.656 0.018 1 1 460 . 1 1 1 A 44 44 GLU HA H 44 4.330 4.432 -0.102 1 1 464 . 1 1 1 A 44 44 GLU C C 44 175.001 175.454 -0.453 1 1 465 . 1 1 1 A 44 44 GLU CA C 44 55.992 55.776 0.216 1 1 466 . 1 1 1 A 44 44 GLU CB C 44 29.276 29.822 -0.546 1 1 468 . 1 1 1 A 44 44 GLU N N 44 117.856 118.896 -1.040 1 1 469 . 1 1 1 A 45 45 LEU H H 45 8.222 7.669 0.553 1 1 470 . 1 1 1 A 45 45 LEU HA H 45 3.901 3.940 -0.039 1 1 480 . 1 1 1 A 45 45 LEU C C 45 175.209 176.420 -1.211 1 1 481 . 1 1 1 A 45 45 LEU CA C 45 55.548 56.137 -0.589 1 1 482 . 1 1 1 A 45 45 LEU CB C 45 38.458 39.720 -1.262 1 1 485 . 1 1 1 A 45 45 LEU N N 45 119.335 117.285 2.050 1 1 486 . 1 1 1 A 46 46 SER H H 46 7.347 7.865 -0.518 1 1 487 . 1 1 1 A 46 46 SER HA H 46 3.954 4.227 -0.273 1 1 489 . 1 1 1 A 46 46 SER C C 46 177.497 177.076 0.421 1 1 490 . 1 1 1 A 46 46 SER CA C 46 62.471 61.073 1.398 1 1 491 . 1 1 1 A 46 46 SER CB C 46 63.908 62.956 0.952 1 1 492 . 1 1 1 A 46 46 SER N N 46 111.433 113.910 -2.477 1 1 493 . 1 1 1 A 47 47 LEU H H 47 12.003 8.322 3.681 1 1 494 . 1 1 1 A 47 47 LEU HA H 47 3.959 4.153 -0.194 1 1 504 . 1 1 1 A 47 47 LEU C C 47 180.340 178.222 2.118 1 1 505 . 1 1 1 A 47 47 LEU CA C 47 58.879 57.780 1.099 1 1 506 . 1 1 1 A 47 47 LEU CB C 47 39.572 41.647 -2.075 1 1 510 . 1 1 1 A 47 47 LEU N N 47 124.605 123.135 1.470 1 1 511 . 1 1 1 A 48 48 MET H H 48 10.599 8.871 1.728 1 1 512 . 1 1 1 A 48 48 MET HA H 48 3.213 3.582 -0.369 1 1 520 . 1 1 1 A 48 48 MET C C 48 181.177 177.986 3.191 1 1 521 . 1 1 1 A 48 48 MET CA C 48 60.747 58.200 2.547 1 1 522 . 1 1 1 A 48 48 MET CB C 48 32.594 31.838 0.756 1 1 525 . 1 1 1 A 48 48 MET N N 48 126.254 118.966 7.288 1 1 526 . 1 1 1 A 49 49 LEU H H 49 8.731 7.698 1.033 1 1 527 . 1 1 1 A 49 49 LEU HA H 49 4.097 4.098 -0.001 1 1 536 . 1 1 1 A 49 49 LEU C C 49 178.144 177.368 0.776 1 1 537 . 1 1 1 A 49 49 LEU CA C 49 57.800 56.261 1.539 1 1 538 . 1 1 1 A 49 49 LEU CB C 49 41.379 41.614 -0.235 1 1 541 . 1 1 1 A 49 49 LEU N N 49 119.183 120.328 -1.145 1 1 542 . 1 1 1 A 50 50 SER H H 50 7.853 7.454 0.399 1 1 543 . 1 1 1 A 50 50 SER HA H 50 4.822 4.576 0.246 1 1 546 . 1 1 1 A 50 50 SER C C 50 174.539 173.648 0.891 1 1 547 . 1 1 1 A 50 50 SER CA C 50 57.811 58.005 -0.194 1 1 548 . 1 1 1 A 50 50 SER CB C 50 64.443 63.336 1.107 1 1 549 . 1 1 1 A 50 50 SER N N 50 114.594 113.581 1.013 1 1 550 . 1 1 1 A 51 51 ASP H H 51 8.264 7.506 0.758 1 1 551 . 1 1 1 A 51 51 ASP HA H 51 4.362 4.386 -0.024 1 1 554 . 1 1 1 A 51 51 ASP C C 51 172.921 174.953 -2.032 1 1 555 . 1 1 1 A 51 51 ASP CA C 51 55.343 55.810 -0.467 1 1 556 . 1 1 1 A 51 51 ASP CB C 51 40.583 39.702 0.881 1 1 557 . 1 1 1 A 51 51 ASP N N 51 123.003 118.848 4.155 1 1 558 . 1 1 1 A 52 52 HIS H H 52 7.869 7.502 0.367 1 1 559 . 1 1 1 A 52 52 HIS HA H 52 5.335 5.516 -0.181 1 1 564 . 1 1 1 A 52 52 HIS C C 52 173.991 174.085 -0.094 1 1 565 . 1 1 1 A 52 52 HIS CA C 52 55.889 54.765 1.124 1 1 566 . 1 1 1 A 52 52 HIS CB C 52 31.789 29.326 2.463 1 1 568 . 1 1 1 A 52 52 HIS N N 52 112.486 117.793 -5.307 1 1 569 . 1 1 1 A 53 53 TRP H H 53 8.165 9.019 -0.854 1 1 570 . 1 1 1 A 53 53 TRP HA H 53 4.926 5.371 -0.445 1 1 578 . 1 1 1 A 53 53 TRP C C 53 175.354 175.397 -0.043 1 1 579 . 1 1 1 A 53 53 TRP CA C 53 55.364 56.844 -1.480 1 1 580 . 1 1 1 A 53 53 TRP CB C 53 30.641 31.168 -0.527 1 1 585 . 1 1 1 A 53 53 TRP N N 53 117.916 125.679 -7.763 1 1 587 . 1 1 1 A 54 54 LEU H H 54 10.088 8.941 1.147 1 1 588 . 1 1 1 A 54 54 LEU HA H 54 5.497 5.281 0.216 1 1 598 . 1 1 1 A 54 54 LEU C C 54 173.337 174.885 -1.548 1 1 599 . 1 1 1 A 54 54 LEU CA C 54 54.408 53.604 0.804 1 1 600 . 1 1 1 A 54 54 LEU CB C 54 44.156 45.465 -1.309 1 1 604 . 1 1 1 A 54 54 LEU N N 54 130.826 126.048 4.778 1 1 605 . 1 1 1 A 55 55 ARG H H 55 9.289 9.177 0.112 1 1 606 . 1 1 1 A 55 55 ARG HA H 55 5.482 5.285 0.197 1 1 612 . 1 1 1 A 55 55 ARG C C 55 174.057 173.959 0.098 1 1 613 . 1 1 1 A 55 55 ARG CA C 55 53.167 54.255 -1.088 1 1 614 . 1 1 1 A 55 55 ARG CB C 55 34.270 33.595 0.675 1 1 616 . 1 1 1 A 55 55 ARG N N 55 125.089 124.432 0.657 1 1 618 . 1 1 1 A 56 56 GLN H H 56 9.092 9.180 -0.088 1 1 619 . 1 1 1 A 56 56 GLN HA H 56 3.991 4.766 -0.775 1 1 626 . 1 1 1 A 56 56 GLN C C 56 174.199 174.389 -0.190 1 1 627 . 1 1 1 A 56 56 GLN CA C 56 54.566 53.998 0.568 1 1 628 . 1 1 1 A 56 56 GLN CB C 56 29.643 31.383 -1.740 1 1 630 . 1 1 1 A 56 56 GLN N N 56 124.355 122.214 2.141 1 1 632 . 1 1 1 A 57 57 ARG H H 57 8.440 8.185 0.255 1 1 633 . 1 1 1 A 57 57 ARG HA H 57 5.316 5.102 0.214 1 1 639 . 1 1 1 A 57 57 ARG C C 57 176.188 176.142 0.046 1 1 640 . 1 1 1 A 57 57 ARG CA C 57 53.940 54.813 -0.873 1 1 641 . 1 1 1 A 57 57 ARG CB C 57 32.426 32.266 0.160 1 1 643 . 1 1 1 A 57 57 ARG N N 57 130.222 125.054 5.168 1 1 645 . 1 1 1 A 58 58 GLU H H 58 8.891 9.600 -0.709 1 1 646 . 1 1 1 A 58 58 GLU HA H 58 3.996 4.104 -0.108 1 1 649 . 1 1 1 A 58 58 GLU CA C 58 58.364 57.383 0.981 1 1 650 . 1 1 1 A 58 58 GLU CB C 58 30.875 27.468 3.407 1 1 651 . 1 1 1 A 58 58 GLU N N 58 131.208 121.783 9.425 1 1 652 . 1 1 1 A 59 59 GLY H H 59 8.367 8.515 -0.148 1 1 653 . 1 1 1 A 59 59 GLY HA2 H 59 4.334 3.806 0.528 1 1 654 . 1 1 1 A 59 59 GLY HA3 H 59 3.743 3.878 -0.135 1 1 655 . 1 1 1 A 59 59 GLY C C 59 174.194 174.939 -0.745 1 1 656 . 1 1 1 A 59 59 GLY CA C 59 45.666 46.430 -0.764 1 1 657 . 1 1 1 A 60 60 SER H H 60 8.071 8.264 -0.193 1 1 658 . 1 1 1 A 60 60 SER HA H 60 4.730 4.402 0.328 1 1 661 . 1 1 1 A 60 60 SER C C 60 173.908 173.948 -0.040 1 1 662 . 1 1 1 A 60 60 SER CA C 60 58.762 60.238 -1.476 1 1 663 . 1 1 1 A 60 60 SER CB C 60 64.497 63.653 0.844 1 1 664 . 1 1 1 A 60 60 SER N N 60 114.636 116.486 -1.850 1 1 665 . 1 1 1 A 61 61 GLY H H 61 8.401 7.439 0.962 1 1 666 . 1 1 1 A 61 61 GLY HA2 H 61 4.560 4.034 0.526 1 1 667 . 1 1 1 A 61 61 GLY HA3 H 61 3.878 4.039 -0.161 1 1 668 . 1 1 1 A 61 61 GLY C C 61 173.526 171.715 1.811 1 1 669 . 1 1 1 A 61 61 GLY CA C 61 44.906 45.397 -0.491 1 1 670 . 1 1 1 A 61 61 GLY N N 61 109.421 105.581 3.840 1 1 671 . 1 1 1 A 62 62 TRP H H 62 8.861 8.501 0.360 1 1 672 . 1 1 1 A 62 62 TRP HA H 62 5.089 5.407 -0.318 1 1 681 . 1 1 1 A 62 62 TRP C C 62 176.168 175.742 0.426 1 1 682 . 1 1 1 A 62 62 TRP CA C 62 57.459 56.388 1.071 1 1 683 . 1 1 1 A 62 62 TRP CB C 62 32.536 32.378 0.158 1 1 689 . 1 1 1 A 62 62 TRP N N 62 122.939 120.085 2.854 1 1 691 . 1 1 1 A 63 63 GLU H H 63 9.306 9.095 0.211 1 1 692 . 1 1 1 A 63 63 GLU HA H 63 4.919 5.199 -0.280 1 1 697 . 1 1 1 A 63 63 GLU C C 63 173.770 174.838 -1.068 1 1 698 . 1 1 1 A 63 63 GLU CA C 63 55.953 55.545 0.408 1 1 699 . 1 1 1 A 63 63 GLU CB C 63 35.317 33.492 1.825 1 1 701 . 1 1 1 A 63 63 GLU N N 63 120.136 120.504 -0.368 1 1 702 . 1 1 1 A 64 64 LEU H H 64 8.998 9.318 -0.320 1 1 703 . 1 1 1 A 64 64 LEU HA H 64 5.616 5.506 0.110 1 1 712 . 1 1 1 A 64 64 LEU C C 64 175.014 173.793 1.221 1 1 713 . 1 1 1 A 64 64 LEU CA C 64 52.945 53.792 -0.847 1 1 714 . 1 1 1 A 64 64 LEU CB C 64 46.904 46.486 0.418 1 1 717 . 1 1 1 A 64 64 LEU N N 64 127.321 126.583 0.738 1 1 718 . 1 1 1 A 65 65 LYS H H 65 9.322 9.709 -0.387 1 1 719 . 1 1 1 A 65 65 LYS HA H 65 5.347 5.219 0.128 1 1 727 . 1 1 1 A 65 65 LYS C C 65 175.811 175.391 0.420 1 1 728 . 1 1 1 A 65 65 LYS CA C 65 55.817 55.331 0.486 1 1 729 . 1 1 1 A 65 65 LYS CB C 65 34.521 34.432 0.089 1 1 733 . 1 1 1 A 65 65 LYS N N 65 129.874 127.941 1.933 1 1 734 . 1 1 1 A 66 66 CYS H H 66 9.129 9.051 0.078 1 1 735 . 1 1 1 A 66 66 CYS HA H 66 5.319 4.855 0.464 1 1 738 . 1 1 1 A 66 66 CYS CA C 66 54.532 56.765 -2.233 1 1 739 . 1 1 1 A 66 66 CYS CB C 66 28.813 30.651 -1.838 1 1 740 . 1 1 1 A 66 66 CYS N N 66 121.497 125.303 -3.806 1 1 741 . 1 1 1 A 67 67 PRO HA H 67 4.439 4.289 0.150 1 1 748 . 1 1 1 A 67 67 PRO C C 67 177.297 178.323 -1.026 1 1 749 . 1 1 1 A 67 67 PRO CA C 67 63.596 63.236 0.360 1 1 750 . 1 1 1 A 67 67 PRO CB C 67 32.242 31.530 0.712 1 1 752 . 1 1 1 A 68 68 GLY H H 68 8.316 8.535 -0.219 1 1 753 . 1 1 1 A 68 68 GLY HA2 H 68 3.726 3.925 -0.199 1 1 754 . 1 1 1 A 68 68 GLY HA3 H 68 4.095 3.957 0.138 1 1 755 . 1 1 1 A 68 68 GLY C C 68 173.789 173.880 -0.091 1 1 756 . 1 1 1 A 68 68 GLY CA C 68 45.227 45.766 -0.539 1 1 757 . 1 1 1 A 68 68 GLY N N 68 109.533 109.987 -0.454 1 1 758 . 1 1 1 A 69 69 VAL H H 69 8.114 8.092 0.022 1 1 759 . 1 1 1 A 69 69 VAL HA H 69 4.266 4.031 0.235 1 1 764 . 1 1 1 A 69 69 VAL C C 69 176.299 175.727 0.572 1 1 765 . 1 1 1 A 69 69 VAL CA C 69 61.945 63.016 -1.071 1 1 766 . 1 1 1 A 69 69 VAL CB C 69 33.082 31.706 1.376 1 1 768 . 1 1 1 A 69 69 VAL N N 69 118.540 120.437 -1.897 1 1 769 . 1 1 1 A 70 70 THR H H 70 8.324 8.941 -0.617 1 1 770 . 1 1 1 A 70 70 THR HA H 70 4.373 4.473 -0.100 1 1 775 . 1 1 1 A 70 70 THR C C 70 175.204 175.359 -0.155 1 1 776 . 1 1 1 A 70 70 THR CA C 70 62.309 64.759 -2.450 1 1 777 . 1 1 1 A 70 70 THR CB C 70 69.787 70.174 -0.387 1 1 779 . 1 1 1 A 70 70 THR N N 70 117.636 121.847 -4.211 1 1 780 . 1 1 1 A 71 71 GLY H H 71 8.574 7.863 0.711 1 1 781 . 1 1 1 A 71 71 GLY HA2 H 71 4.096 3.975 0.121 1 1 782 . 1 1 1 A 71 71 GLY HA3 H 71 3.975 3.985 -0.010 1 1 783 . 1 1 1 A 71 71 GLY C C 71 174.313 173.804 0.509 1 1 784 . 1 1 1 A 71 71 GLY CA C 71 45.545 46.986 -1.441 1 1 785 . 1 1 1 A 71 71 GLY N N 71 111.677 107.140 4.537 1 1 786 . 1 1 1 A 72 72 VAL H H 72 7.945 7.789 0.156 1 1 787 . 1 1 1 A 72 72 VAL HA H 72 4.258 3.925 0.333 1 1 795 . 1 1 1 A 72 72 VAL C C 72 176.162 175.982 0.180 1 1 796 . 1 1 1 A 72 72 VAL CA C 72 62.227 63.686 -1.459 1 1 797 . 1 1 1 A 72 72 VAL CB C 72 32.997 31.385 1.612 1 1 799 . 1 1 1 A 72 72 VAL N N 72 118.647 121.571 -2.924 1 1 800 . 1 1 1 A 73 73 SER H H 73 8.498 8.489 0.009 1 1 801 . 1 1 1 A 73 73 SER HA H 73 4.617 5.010 -0.393 1 1 803 . 1 1 1 A 73 73 SER C C 73 174.461 173.843 0.618 1 1 804 . 1 1 1 A 73 73 SER CA C 73 58.218 57.873 0.345 1 1 805 . 1 1 1 A 73 73 SER CB C 73 64.061 66.392 -2.331 1 1 806 . 1 1 1 A 73 73 SER N N 73 118.828 123.247 -4.419 1 1 807 . 1 1 1 A 74 74 GLY H H 74 8.247 8.315 -0.068 1 1 808 . 1 1 1 A 74 74 GLY HA2 H 74 4.101 4.073 0.028 1 1 809 . 1 1 1 A 74 74 GLY HA3 H 74 4.304 4.075 0.229 1 1 810 . 1 1 1 A 74 74 GLY CA C 74 44.896 44.209 0.687 1 1 811 . 1 1 1 A 74 74 GLY N N 74 111.138 111.764 -0.626 1 1 812 . 1 1 1 A 75 75 PRO HA H 75 4.461 4.590 -0.129 1 1 819 . 1 1 1 A 75 75 PRO C C 75 176.798 176.490 0.308 1 1 820 . 1 1 1 A 75 75 PRO CA C 75 63.466 62.308 1.158 1 1 821 . 1 1 1 A 75 75 PRO CB C 75 31.980 32.952 -0.972 1 1 824 . 1 1 1 A 76 76 HIS H H 76 8.397 8.213 0.184 1 1 825 . 1 1 1 A 76 76 HIS HA H 76 4.742 4.545 0.197 1 1 829 . 1 1 1 A 76 76 HIS C C 76 174.282 173.706 0.576 1 1 830 . 1 1 1 A 76 76 HIS CA C 76 55.579 54.865 0.714 1 1 831 . 1 1 1 A 76 76 HIS CB C 76 30.501 30.088 0.413 1 1 832 . 1 1 1 A 76 76 HIS N N 76 118.431 117.539 0.892 1 1 833 . 1 1 1 A 77 77 ASN H H 77 8.364 8.421 -0.057 1 1 834 . 1 1 1 A 77 77 ASN HA H 77 4.767 4.744 0.023 1 1 839 . 1 1 1 A 77 77 ASN C C 77 174.576 174.933 -0.357 1 1 840 . 1 1 1 A 77 77 ASN CA C 77 53.139 51.527 1.612 1 1 841 . 1 1 1 A 77 77 ASN CB C 77 39.320 37.297 2.023 1 1 842 . 1 1 1 A 77 77 ASN N N 77 119.421 124.328 -4.907 1 1 844 . 1 1 1 A 78 78 GLU H H 78 8.683 8.320 0.363 1 1 845 . 1 1 1 A 78 78 GLU HA H 78 4.409 4.353 0.056 1 1 850 . 1 1 1 A 78 78 GLU C C 78 175.791 174.357 1.434 1 1 851 . 1 1 1 A 78 78 GLU CA C 78 56.359 56.780 -0.421 1 1 852 . 1 1 1 A 78 78 GLU CB C 78 30.818 29.110 1.708 1 1 854 . 1 1 1 A 78 78 GLU N N 78 122.085 124.899 -2.814 1 1 855 . 1 1 1 A 79 79 TYR H H 79 8.341 8.631 -0.290 1 1 856 . 1 1 1 A 79 79 TYR HA H 79 4.988 5.574 -0.586 1 1 861 . 1 1 1 A 79 79 TYR C C 79 175.837 175.062 0.775 1 1 862 . 1 1 1 A 79 79 TYR CA C 79 58.028 56.585 1.443 1 1 863 . 1 1 1 A 79 79 TYR CB C 79 41.672 41.184 0.488 1 1 866 . 1 1 1 A 79 79 TYR N N 79 119.452 120.779 -1.327 1 1 867 . 1 1 1 A 80 80 VAL H H 80 9.366 9.751 -0.385 1 1 868 . 1 1 1 A 80 80 VAL HA H 80 4.370 4.968 -0.598 1 1 873 . 1 1 1 A 80 80 VAL C C 80 174.948 174.713 0.235 1 1 874 . 1 1 1 A 80 80 VAL CA C 80 61.190 60.392 0.798 1 1 875 . 1 1 1 A 80 80 VAL CB C 80 34.204 34.380 -0.176 1 1 877 . 1 1 1 A 80 80 VAL N N 80 120.567 117.886 2.681 1 1 878 . 1 1 1 A 81 81 GLU H H 81 8.570 8.995 -0.425 1 1 879 . 1 1 1 A 81 81 GLU HA H 81 4.770 5.304 -0.534 1 1 883 . 1 1 1 A 81 81 GLU C C 81 175.491 175.991 -0.500 1 1 884 . 1 1 1 A 81 81 GLU CA C 81 55.655 55.332 0.323 1 1 885 . 1 1 1 A 81 81 GLU CB C 81 30.415 31.733 -1.318 1 1 887 . 1 1 1 A 81 81 GLU N N 81 124.248 125.932 -1.684 1 1 888 . 1 1 1 A 82 82 VAL H H 82 9.189 9.066 0.123 1 1 889 . 1 1 1 A 82 82 VAL HA H 82 4.279 4.884 -0.605 1 1 894 . 1 1 1 A 82 82 VAL C C 82 176.087 175.641 0.446 1 1 895 . 1 1 1 A 82 82 VAL CA C 82 62.672 60.437 2.235 1 1 896 . 1 1 1 A 82 82 VAL CB C 82 33.121 34.297 -1.176 1 1 898 . 1 1 1 A 82 82 VAL N N 82 127.776 118.393 9.383 1 1 899 . 1 1 1 A 83 83 THR H H 83 8.590 8.599 -0.009 1 1 900 . 1 1 1 A 83 83 THR HA H 83 4.955 4.668 0.287 1 1 905 . 1 1 1 A 83 83 THR C C 83 174.688 174.855 -0.167 1 1 906 . 1 1 1 A 83 83 THR CA C 83 61.332 61.402 -0.070 1 1 907 . 1 1 1 A 83 83 THR CB C 83 70.213 70.207 0.006 1 1 909 . 1 1 1 A 83 83 THR N N 83 114.744 115.474 -0.730 1 1 910 . 1 1 1 A 84 84 SER H H 84 7.650 7.408 0.242 1 1 911 . 1 1 1 A 84 84 SER HA H 84 4.819 4.354 0.465 1 1 914 . 1 1 1 A 84 84 SER CA C 84 56.280 59.969 -3.689 1 1 915 . 1 1 1 A 84 84 SER CB C 84 63.294 63.421 -0.127 1 1 916 . 1 1 1 A 84 84 SER N N 84 118.038 118.319 -0.281 1 1 917 . 1 1 1 A 85 85 GLU H H 85 8.391 8.795 -0.404 1 1 918 . 1 1 1 A 85 85 GLU HA H 85 3.661 3.968 -0.307 1 1 923 . 1 1 1 A 85 85 GLU C C 85 177.520 178.571 -1.051 1 1 924 . 1 1 1 A 85 85 GLU CA C 85 62.429 59.631 2.798 1 1 925 . 1 1 1 A 85 85 GLU CB C 85 29.655 29.441 0.214 1 1 927 . 1 1 1 A 86 86 ALA H H 86 8.443 8.175 0.268 1 1 928 . 1 1 1 A 86 86 ALA HA H 86 4.027 4.020 0.007 1 1 932 . 1 1 1 A 86 86 ALA C C 86 180.423 179.975 0.448 1 1 933 . 1 1 1 A 86 86 ALA CA C 86 55.145 54.749 0.396 1 1 934 . 1 1 1 A 86 86 ALA CB C 86 18.165 18.101 0.064 1 1 935 . 1 1 1 A 86 86 ALA N N 86 119.636 123.028 -3.392 1 1 936 . 1 1 1 A 87 87 ALA H H 87 7.214 7.295 -0.081 1 1 937 . 1 1 1 A 87 87 ALA HA H 87 4.244 4.029 0.215 1 1 941 . 1 1 1 A 87 87 ALA C C 87 180.354 180.057 0.297 1 1 942 . 1 1 1 A 87 87 ALA CA C 87 54.378 54.682 -0.304 1 1 943 . 1 1 1 A 87 87 ALA CB C 87 18.795 18.320 0.475 1 1 944 . 1 1 1 A 87 87 ALA N N 87 121.004 120.100 0.904 1 1 945 . 1 1 1 A 88 88 ILE H H 88 8.471 7.437 1.034 1 1 946 . 1 1 1 A 88 88 ILE HA H 88 3.360 3.679 -0.319 1 1 954 . 1 1 1 A 88 88 ILE CA C 88 66.323 64.647 1.676 1 1 955 . 1 1 1 A 88 88 ILE CB C 88 37.808 37.519 0.289 1 1 958 . 1 1 1 A 88 88 ILE N N 88 120.743 119.923 0.820 1 1 959 . 1 1 1 A 89 89 VAL H H 89 8.343 8.591 -0.248 1 1 960 . 1 1 1 A 89 89 VAL HA H 89 3.061 3.418 -0.357 1 1 968 . 1 1 1 A 89 89 VAL C C 89 176.708 177.687 -0.979 1 1 969 . 1 1 1 A 89 89 VAL CA C 89 67.833 66.577 1.256 1 1 970 . 1 1 1 A 89 89 VAL CB C 89 31.509 31.366 0.143 1 1 973 . 1 1 1 A 89 89 VAL N N 89 118.049 120.128 -2.079 1 1 974 . 1 1 1 A 90 90 ALA H H 90 7.516 7.899 -0.383 1 1 975 . 1 1 1 A 90 90 ALA HA H 90 3.987 3.819 0.168 1 1 979 . 1 1 1 A 90 90 ALA C C 90 180.744 179.009 1.735 1 1 980 . 1 1 1 A 90 90 ALA CA C 90 55.481 55.494 -0.013 1 1 981 . 1 1 1 A 90 90 ALA CB C 90 17.953 17.775 0.178 1 1 982 . 1 1 1 A 90 90 ALA N N 90 118.935 121.049 -2.114 1 1 983 . 1 1 1 A 91 91 GLN H H 91 7.886 8.024 -0.138 1 1 984 . 1 1 1 A 91 91 GLN HA H 91 4.190 3.992 0.198 1 1 991 . 1 1 1 A 91 91 GLN C C 91 178.832 178.556 0.276 1 1 992 . 1 1 1 A 91 91 GLN CA C 91 58.519 58.859 -0.340 1 1 993 . 1 1 1 A 91 91 GLN CB C 91 28.091 28.361 -0.270 1 1 995 . 1 1 1 A 91 91 GLN N N 91 117.846 118.068 -0.222 1 1 997 . 1 1 1 A 92 92 LEU H H 92 8.751 8.786 -0.035 1 1 998 . 1 1 1 A 92 92 LEU HA H 92 3.903 3.954 -0.051 1 1 1007 . 1 1 1 A 92 92 LEU C C 92 178.997 179.036 -0.039 1 1 1008 . 1 1 1 A 92 92 LEU CA C 92 58.136 57.857 0.279 1 1 1009 . 1 1 1 A 92 92 LEU CB C 92 41.576 41.620 -0.044 1 1 1013 . 1 1 1 A 92 92 LEU N N 92 119.547 119.879 -0.332 1 1 1014 . 1 1 1 A 93 93 PHE H H 93 8.648 8.025 0.623 1 1 1015 . 1 1 1 A 93 93 PHE HA H 93 4.270 4.251 0.019 1 1 1020 . 1 1 1 A 93 93 PHE C C 93 179.283 178.793 0.490 1 1 1021 . 1 1 1 A 93 93 PHE CA C 93 59.860 60.285 -0.425 1 1 1022 . 1 1 1 A 93 93 PHE CB C 93 37.765 38.496 -0.731 1 1 1025 . 1 1 1 A 93 93 PHE N N 93 118.041 119.358 -1.317 1 1 1026 . 1 1 1 A 94 94 GLU H H 94 7.739 8.313 -0.574 1 1 1027 . 1 1 1 A 94 94 GLU HA H 94 4.110 4.137 -0.027 1 1 1031 . 1 1 1 A 94 94 GLU C C 94 178.629 178.804 -0.175 1 1 1032 . 1 1 1 A 94 94 GLU CA C 94 59.359 59.400 -0.041 1 1 1033 . 1 1 1 A 94 94 GLU CB C 94 29.589 29.005 0.584 1 1 1035 . 1 1 1 A 94 94 GLU N N 94 119.980 117.323 2.657 1 1 1036 . 1 1 1 A 95 95 LEU H H 95 7.999 8.486 -0.487 1 1 1037 . 1 1 1 A 95 95 LEU HA H 95 4.139 3.920 0.219 1 1 1047 . 1 1 1 A 95 95 LEU C C 95 178.965 178.475 0.490 1 1 1048 . 1 1 1 A 95 95 LEU CA C 95 57.557 57.865 -0.308 1 1 1049 . 1 1 1 A 95 95 LEU CB C 95 43.443 41.593 1.850 1 1 1053 . 1 1 1 A 95 95 LEU N N 95 118.398 121.617 -3.219 1 1 1054 . 1 1 1 A 96 96 LEU H H 96 8.363 7.914 0.449 1 1 1055 . 1 1 1 A 96 96 LEU HA H 96 4.503 4.277 0.226 1 1 1061 . 1 1 1 A 96 96 LEU C C 96 177.932 177.279 0.653 1 1 1062 . 1 1 1 A 96 96 LEU CA C 96 54.700 54.918 -0.218 1 1 1063 . 1 1 1 A 96 96 LEU CB C 96 43.048 42.342 0.706 1 1 1065 . 1 1 1 A 96 96 LEU N N 96 114.720 116.710 -1.990 1 1 1066 . 1 1 1 A 97 97 GLY H H 97 7.810 7.569 0.241 1 1 1067 . 1 1 1 A 97 97 GLY HA2 H 97 3.963 3.923 0.040 1 1 1068 . 1 1 1 A 97 97 GLY C C 97 173.535 174.611 -1.076 1 1 1069 . 1 1 1 A 97 97 GLY CA C 97 45.667 46.538 -0.871 1 1 1070 . 1 1 1 A 97 97 GLY N N 97 109.511 108.641 0.870 1 1 1071 . 1 1 1 A 98 98 SER H H 98 8.131 8.321 -0.190 1 1 1072 . 1 1 1 A 98 98 SER HA H 98 4.225 4.151 0.074 1 1 1075 . 1 1 1 A 98 98 SER C C 98 174.974 174.819 0.155 1 1 1076 . 1 1 1 A 98 98 SER CA C 98 57.960 60.257 -2.297 1 1 1077 . 1 1 1 A 98 98 SER CB C 98 63.997 63.472 0.525 1 1 1078 . 1 1 1 A 98 98 SER N N 98 113.405 115.073 -1.668 1 1 1079 . 1 1 1 A 99 99 GLY H H 99 8.052 8.255 -0.203 1 1 1080 . 1 1 1 A 99 99 GLY HA2 H 99 3.998 3.905 0.093 1 1 1081 . 1 1 1 A 99 99 GLY HA3 H 99 3.778 3.948 -0.170 1 1 1082 . 1 1 1 A 99 99 GLY C C 99 174.033 174.302 -0.269 1 1 1083 . 1 1 1 A 99 99 GLY CA C 99 45.123 45.720 -0.597 1 1 1084 . 1 1 1 A 99 99 GLY N N 99 111.534 108.558 2.976 1 1 1085 . 1 1 1 A 100 100 GLU H H 100 8.177 7.874 0.303 1 1 1086 . 1 1 1 A 100 100 GLU HA H 100 4.201 4.696 -0.495 1 1 1091 . 1 1 1 A 100 100 GLU C C 100 175.830 176.120 -0.290 1 1 1092 . 1 1 1 A 100 100 GLU CA C 100 56.442 55.822 0.620 1 1 1093 . 1 1 1 A 100 100 GLU CB C 100 30.428 31.355 -0.927 1 1 1095 . 1 1 1 A 100 100 GLU N N 100 120.463 120.201 0.262 1 1 1096 . 1 1 1 A 101 101 GLN H H 101 8.161 8.438 -0.277 1 1 1097 . 1 1 1 A 101 101 GLN HA H 101 4.098 4.222 -0.124 1 1 1103 . 1 1 1 A 101 101 GLN C C 101 175.412 175.597 -0.185 1 1 1104 . 1 1 1 A 101 101 GLN CA C 101 55.632 56.291 -0.659 1 1 1105 . 1 1 1 A 101 101 GLN CB C 101 29.569 29.064 0.505 1 1 1107 . 1 1 1 A 101 101 GLN N N 101 120.014 121.264 -1.250 1 1 1109 . 1 1 1 A 102 102 LYS H H 102 8.235 8.422 -0.187 1 1 1110 . 1 1 1 A 102 102 LYS HA H 102 4.387 3.687 0.700 1 1 1117 . 1 1 1 A 102 102 LYS CA C 102 54.116 54.556 -0.440 1 1 1118 . 1 1 1 A 102 102 LYS CB C 102 32.478 32.285 0.193 1 1 1122 . 1 1 1 A 102 102 LYS N N 102 123.399 122.715 0.684 1 1 1123 . 1 1 1 A 103 103 PRO HA H 103 4.498 4.361 0.137 1 1 1129 . 1 1 1 A 103 103 PRO C C 103 175.473 177.062 -1.589 1 1 1130 . 1 1 1 A 103 103 PRO CA C 103 62.802 65.936 -3.134 1 1 1131 . 1 1 1 A 103 103 PRO CB C 103 32.124 31.534 0.590 1 1 1134 . 1 1 1 A 104 104 ALA H H 104 8.017 7.253 0.764 1 1 1135 . 1 1 1 A 104 104 ALA HA H 104 4.318 4.376 -0.058 1 1 1139 . 1 1 1 A 104 104 ALA C C 104 176.717 176.846 -0.129 1 1 1140 . 1 1 1 A 104 104 ALA CA C 104 52.194 53.241 -1.047 1 1 1141 . 1 1 1 A 104 104 ALA CB C 104 20.113 20.563 -0.450 1 1 1142 . 1 1 1 A 104 104 ALA N N 104 122.093 118.499 3.594 1 1 1143 . 1 1 1 A 105 105 GLY H H 105 7.678 8.175 -0.497 1 1 1144 . 1 1 1 A 105 105 GLY HA2 H 105 3.851 4.137 -0.286 1 1 1145 . 1 1 1 A 105 105 GLY HA3 H 105 4.053 4.164 -0.111 1 1 1146 . 1 1 1 A 105 105 GLY C C 105 172.990 174.875 -1.885 1 1 1147 . 1 1 1 A 105 105 GLY CA C 105 44.241 43.535 0.706 1 1 1148 . 1 1 1 A 105 105 GLY N N 105 105.234 103.989 1.245 1 1 1149 . 1 1 1 A 106 106 VAL H H 106 8.409 9.137 -0.728 1 1 1150 . 1 1 1 A 106 106 VAL HA H 106 2.829 3.326 -0.497 1 1 1158 . 1 1 1 A 106 106 VAL C C 106 177.822 177.205 0.617 1 1 1159 . 1 1 1 A 106 106 VAL CA C 106 65.522 65.523 -0.001 1 1 1160 . 1 1 1 A 106 106 VAL CB C 106 30.701 30.622 0.079 1 1 1163 . 1 1 1 A 106 106 VAL N N 106 119.215 119.172 0.043 1 1 1164 . 1 1 1 A 107 107 ALA H H 107 8.707 8.425 0.282 1 1 1165 . 1 1 1 A 107 107 ALA HA H 107 3.730 3.873 -0.143 1 1 1169 . 1 1 1 A 107 107 ALA C C 107 179.661 180.337 -0.676 1 1 1170 . 1 1 1 A 107 107 ALA CA C 107 54.995 55.436 -0.441 1 1 1171 . 1 1 1 A 107 107 ALA CB C 107 17.705 17.992 -0.287 1 1 1172 . 1 1 1 A 107 107 ALA N N 107 118.672 122.104 -3.432 1 1 1173 . 1 1 1 A 108 108 ALA H H 108 7.388 7.829 -0.441 1 1 1174 . 1 1 1 A 108 108 ALA HA H 108 4.259 4.036 0.223 1 1 1178 . 1 1 1 A 108 108 ALA C C 108 179.318 179.412 -0.094 1 1 1179 . 1 1 1 A 108 108 ALA CA C 108 53.481 55.064 -1.583 1 1 1180 . 1 1 1 A 108 108 ALA CB C 108 19.367 18.479 0.888 1 1 1181 . 1 1 1 A 108 108 ALA N N 108 116.635 120.700 -4.065 1 1 1182 . 1 1 1 A 109 109 VAL H H 109 7.689 7.392 0.297 1 1 1183 . 1 1 1 A 109 109 VAL HA H 109 4.532 3.826 0.706 1 1 1191 . 1 1 1 A 109 109 VAL C C 109 176.055 177.998 -1.943 1 1 1192 . 1 1 1 A 109 109 VAL CA C 109 61.452 65.683 -4.231 1 1 1193 . 1 1 1 A 109 109 VAL CB C 109 32.728 31.312 1.416 1 1 1196 . 1 1 1 A 109 109 VAL N N 109 112.851 117.140 -4.289 1 1 1197 . 1 1 1 A 110 110 LEU H H 110 7.099 8.169 -1.070 1 1 1198 . 1 1 1 A 110 110 LEU HA H 110 3.723 3.773 -0.050 1 1 1208 . 1 1 1 A 110 110 LEU C C 110 179.040 178.800 0.240 1 1 1209 . 1 1 1 A 110 110 LEU CA C 110 58.825 57.825 1.000 1 1 1210 . 1 1 1 A 110 110 LEU CB C 110 41.242 41.757 -0.515 1 1 1214 . 1 1 1 A 110 110 LEU N N 110 119.829 124.917 -5.088 1 1 1215 . 1 1 1 A 111 111 GLY H H 111 8.435 7.925 0.510 1 1 1216 . 1 1 1 A 111 111 GLY HA2 H 111 3.970 3.807 0.163 1 1 1217 . 1 1 1 A 111 111 GLY HA3 H 111 3.885 3.810 0.075 1 1 1218 . 1 1 1 A 111 111 GLY C C 111 178.031 176.456 1.575 1 1 1219 . 1 1 1 A 111 111 GLY CA C 111 46.961 47.486 -0.525 1 1 1220 . 1 1 1 A 111 111 GLY N N 111 104.089 106.511 -2.422 1 1 1221 . 1 1 1 A 112 112 SER H H 112 8.343 7.911 0.432 1 1 1222 . 1 1 1 A 112 112 SER HA H 112 4.266 4.227 0.039 1 1 1224 . 1 1 1 A 112 112 SER C C 112 175.885 175.873 0.012 1 1 1225 . 1 1 1 A 112 112 SER CA C 112 61.304 62.374 -1.070 1 1 1226 . 1 1 1 A 112 112 SER CB C 112 62.901 63.318 -0.417 1 1 1227 . 1 1 1 A 112 112 SER N N 112 119.497 119.624 -0.127 1 1 1228 . 1 1 1 A 113 113 LEU H H 113 7.667 8.286 -0.619 1 1 1229 . 1 1 1 A 113 113 LEU HA H 113 4.343 4.125 0.218 1 1 1238 . 1 1 1 A 113 113 LEU C C 113 174.760 175.869 -1.109 1 1 1239 . 1 1 1 A 113 113 LEU CA C 113 54.228 54.847 -0.619 1 1 1240 . 1 1 1 A 113 113 LEU CB C 113 41.467 42.179 -0.712 1 1 1244 . 1 1 1 A 113 113 LEU N N 113 118.843 118.267 0.576 1 1 1245 . 1 1 1 A 114 114 LYS H H 114 7.685 7.504 0.181 1 1 1246 . 1 1 1 A 114 114 LYS HA H 114 3.958 3.899 0.059 1 1 1250 . 1 1 1 A 114 114 LYS C C 114 177.557 175.811 1.746 1 1 1251 . 1 1 1 A 114 114 LYS CA C 114 56.935 57.302 -0.367 1 1 1252 . 1 1 1 A 114 114 LYS CB C 114 28.898 29.590 -0.692 1 1 1254 . 1 1 1 A 114 114 LYS N N 114 114.072 116.734 -2.662 1 1 1255 . 1 1 1 A 115 115 LEU H H 115 8.329 7.766 0.563 1 1 1256 . 1 1 1 A 115 115 LEU HA H 115 4.315 4.365 -0.050 1 1 1265 . 1 1 1 A 115 115 LEU C C 115 175.988 176.991 -1.003 1 1 1266 . 1 1 1 A 115 115 LEU CA C 115 54.310 55.104 -0.794 1 1 1267 . 1 1 1 A 115 115 LEU CB C 115 44.163 42.577 1.586 1 1 1270 . 1 1 1 A 115 115 LEU N N 115 117.951 119.921 -1.970 1 1 1271 . 1 1 1 A 116 116 GLN H H 116 9.100 8.938 0.162 1 1 1272 . 1 1 1 A 116 116 GLN HA H 116 4.898 5.052 -0.154 1 1 1279 . 1 1 1 A 116 116 GLN CA C 116 53.467 54.678 -1.211 1 1 1280 . 1 1 1 A 116 116 GLN CB C 116 32.730 31.449 1.281 1 1 1282 . 1 1 1 A 116 116 GLN N N 116 119.994 119.457 0.537 1 1 1284 . 1 1 1 A 117 117 GLU H H 117 8.849 8.633 0.216 1 1 1285 . 1 1 1 A 117 117 GLU HA H 117 3.707 4.178 -0.471 1 1 1290 . 1 1 1 A 117 117 GLU C C 117 177.303 176.979 0.324 1 1 1291 . 1 1 1 A 117 117 GLU CA C 117 57.233 56.164 1.069 1 1 1292 . 1 1 1 A 117 117 GLU CB C 117 29.634 29.108 0.526 1 1 1294 . 1 1 1 A 117 117 GLU N N 117 121.487 124.318 -2.831 1 1 1295 . 1 1 1 A 118 118 VAL H H 118 8.983 8.649 0.334 1 1 1296 . 1 1 1 A 118 118 VAL HA H 118 4.360 4.067 0.293 1 1 1304 . 1 1 1 A 118 118 VAL C C 118 174.171 175.087 -0.916 1 1 1305 . 1 1 1 A 118 118 VAL CA C 118 61.772 63.119 -1.347 1 1 1306 . 1 1 1 A 118 118 VAL CB C 118 34.095 32.695 1.400 1 1 1309 . 1 1 1 A 118 118 VAL N N 118 122.933 128.301 -5.368 1 1 1310 . 1 1 1 A 119 119 ALA H H 119 7.023 7.055 -0.032 1 1 1311 . 1 1 1 A 119 119 ALA HA H 119 4.378 4.276 0.102 1 1 1315 . 1 1 1 A 119 119 ALA C C 119 175.493 175.052 0.441 1 1 1316 . 1 1 1 A 119 119 ALA CA C 119 51.956 51.163 0.793 1 1 1317 . 1 1 1 A 119 119 ALA CB C 119 23.957 21.244 2.713 1 1 1318 . 1 1 1 A 119 119 ALA N N 119 117.379 122.149 -4.770 1 1 1319 . 1 1 1 A 120 120 SER H H 120 6.999 8.511 -1.512 1 1 1320 . 1 1 1 A 120 120 SER HA H 120 5.208 5.703 -0.495 1 1 1323 . 1 1 1 A 120 120 SER C C 120 173.082 173.086 -0.004 1 1 1324 . 1 1 1 A 120 120 SER CA C 120 56.754 57.186 -0.432 1 1 1325 . 1 1 1 A 120 120 SER CB C 120 64.605 65.768 -1.163 1 1 1326 . 1 1 1 A 120 120 SER N N 120 113.743 116.125 -2.382 1 1 1327 . 1 1 1 A 121 121 PHE H H 121 8.244 8.951 -0.707 1 1 1328 . 1 1 1 A 121 121 PHE HA H 121 5.177 5.058 0.119 1 1 1333 . 1 1 1 A 121 121 PHE C C 121 173.569 172.014 1.555 1 1 1334 . 1 1 1 A 121 121 PHE CA C 121 55.555 55.874 -0.319 1 1 1335 . 1 1 1 A 121 121 PHE CB C 121 40.959 40.795 0.164 1 1 1338 . 1 1 1 A 121 121 PHE N N 121 120.358 118.097 2.261 1 1 1339 . 1 1 1 A 122 122 ILE H H 122 8.907 8.756 0.151 1 1 1340 . 1 1 1 A 122 122 ILE HA H 122 4.682 4.656 0.026 1 1 1348 . 1 1 1 A 122 122 ILE C C 122 176.925 174.957 1.968 1 1 1349 . 1 1 1 A 122 122 ILE CA C 122 60.740 60.116 0.624 1 1 1350 . 1 1 1 A 122 122 ILE CB C 122 39.497 39.863 -0.366 1 1 1353 . 1 1 1 A 122 122 ILE N N 122 121.282 120.246 1.036 1 1 1354 . 1 1 1 A 123 123 THR H H 123 9.022 8.991 0.031 1 1 1355 . 1 1 1 A 123 123 THR HA H 123 5.039 4.596 0.443 1 1 1360 . 1 1 1 A 123 123 THR C C 123 173.531 173.771 -0.240 1 1 1361 . 1 1 1 A 123 123 THR CA C 123 62.266 61.773 0.493 1 1 1362 . 1 1 1 A 123 123 THR CB C 123 70.677 68.771 1.906 1 1 1364 . 1 1 1 A 123 123 THR N N 123 128.965 122.867 6.098 1 1 1365 . 1 1 1 A 124 124 THR H H 124 8.961 9.404 -0.443 1 1 1366 . 1 1 1 A 124 124 THR HA H 124 5.001 4.886 0.115 1 1 1371 . 1 1 1 A 124 124 THR C C 124 173.468 172.567 0.901 1 1 1372 . 1 1 1 A 124 124 THR CA C 124 62.109 61.717 0.392 1 1 1373 . 1 1 1 A 124 124 THR CB C 124 70.450 69.706 0.744 1 1 1375 . 1 1 1 A 124 124 THR N N 124 122.176 123.650 -1.474 1 1 1376 . 1 1 1 A 125 125 ARG H H 125 9.386 9.633 -0.247 1 1 1377 . 1 1 1 A 125 125 ARG HA H 125 5.764 5.577 0.187 1 1 1384 . 1 1 1 A 125 125 ARG C C 125 175.713 174.622 1.091 1 1 1385 . 1 1 1 A 125 125 ARG CA C 125 53.991 54.167 -0.176 1 1 1386 . 1 1 1 A 125 125 ARG CB C 125 33.557 33.184 0.373 1 1 1389 . 1 1 1 A 125 125 ARG N N 125 130.004 129.143 0.861 1 1 1390 . 1 1 1 A 126 126 SER H H 126 9.172 9.139 0.033 1 1 1391 . 1 1 1 A 126 126 SER HA H 126 5.390 5.033 0.357 1 1 1394 . 1 1 1 A 126 126 SER C C 126 172.359 172.530 -0.171 1 1 1395 . 1 1 1 A 126 126 SER CA C 126 56.934 56.797 0.137 1 1 1396 . 1 1 1 A 126 126 SER CB C 126 65.827 65.069 0.758 1 1 1397 . 1 1 1 A 126 126 SER N N 126 119.906 121.424 -1.518 1 1 1398 . 1 1 1 A 127 127 SER H H 127 8.591 9.264 -0.673 1 1 1399 . 1 1 1 A 127 127 SER HA H 127 5.739 5.327 0.412 1 1 1401 . 1 1 1 A 127 127 SER C C 127 173.283 173.367 -0.084 1 1 1402 . 1 1 1 A 127 127 SER CA C 127 57.354 56.994 0.360 1 1 1403 . 1 1 1 A 127 127 SER CB C 127 65.412 64.415 0.997 1 1 1404 . 1 1 1 A 127 127 SER N N 127 117.914 123.251 -5.337 1 1 1405 . 1 1 1 A 128 128 TRP H H 128 9.866 9.884 -0.018 1 1 1406 . 1 1 1 A 128 128 TRP HA H 128 5.560 6.016 -0.456 1 1 1415 . 1 1 1 A 128 128 TRP C C 128 175.828 174.684 1.144 1 1 1416 . 1 1 1 A 128 128 TRP CA C 128 55.852 55.826 0.026 1 1 1417 . 1 1 1 A 128 128 TRP CB C 128 32.524 32.768 -0.244 1 1 1423 . 1 1 1 A 128 128 TRP N N 128 127.978 127.706 0.272 1 1 1425 . 1 1 1 A 129 129 LYS H H 129 9.424 8.924 0.500 1 1 1426 . 1 1 1 A 129 129 LYS HA H 129 5.388 5.366 0.022 1 1 1433 . 1 1 1 A 129 129 LYS C C 129 175.254 174.000 1.254 1 1 1434 . 1 1 1 A 129 129 LYS CA C 129 54.410 54.857 -0.447 1 1 1435 . 1 1 1 A 129 129 LYS CB C 129 35.734 36.014 -0.280 1 1 1439 . 1 1 1 A 129 129 LYS N N 129 121.784 122.739 -0.955 1 1 1440 . 1 1 1 A 130 130 LEU H H 130 8.933 9.597 -0.664 1 1 1441 . 1 1 1 A 130 130 LEU HA H 130 4.859 5.101 -0.242 1 1 1447 . 1 1 1 A 130 130 LEU C C 130 173.893 174.934 -1.041 1 1 1448 . 1 1 1 A 130 130 LEU CA C 130 53.848 53.751 0.097 1 1 1449 . 1 1 1 A 130 130 LEU CB C 130 46.125 45.824 0.301 1 1 1451 . 1 1 1 A 130 130 LEU N N 130 124.543 128.878 -4.335 1 1 1452 . 1 1 1 A 131 131 ALA H H 131 8.816 8.819 -0.003 1 1 1453 . 1 1 1 A 131 131 ALA HA H 131 4.776 4.948 -0.172 1 1 1457 . 1 1 1 A 131 131 ALA C C 131 176.662 177.433 -0.771 1 1 1458 . 1 1 1 A 131 131 ALA CA C 131 51.407 50.940 0.467 1 1 1459 . 1 1 1 A 131 131 ALA CB C 131 19.354 20.113 -0.759 1 1 1460 . 1 1 1 A 131 131 ALA N N 131 131.102 130.497 0.605 1 1 1461 . 1 1 1 A 132 132 LEU H H 132 8.487 8.837 -0.350 1 1 1462 . 1 1 1 A 132 132 LEU HA H 132 4.470 4.493 -0.023 1 1 1470 . 1 1 1 A 132 132 LEU C C 132 176.873 176.615 0.258 1 1 1471 . 1 1 1 A 132 132 LEU CA C 132 54.590 54.962 -0.372 1 1 1472 . 1 1 1 A 132 132 LEU CB C 132 42.974 42.642 0.332 1 1 1475 . 1 1 1 A 132 132 LEU N N 132 123.724 122.966 0.758 1 1 1476 . 1 1 1 A 133 133 SER H H 133 8.448 8.676 -0.228 1 1 1477 . 1 1 1 A 133 133 SER HA H 133 4.560 4.903 -0.343 1 1 1479 . 1 1 1 A 133 133 SER C C 133 176.043 172.773 3.270 1 1 1480 . 1 1 1 A 133 133 SER CA C 133 58.460 56.484 1.976 1 1 1481 . 1 1 1 A 133 133 SER CB C 133 63.985 64.497 -0.512 1 1 1482 . 1 1 1 A 133 133 SER N N 133 115.880 117.831 -1.951 1 1 1483 . 1 1 1 A 134 134 GLY H H 134 8.232 8.382 -0.150 1 1 1484 . 1 1 1 A 134 134 GLY HA2 H 134 4.147 4.261 -0.114 1 1 1485 . 1 1 1 A 134 134 GLY HA3 H 134 4.045 4.275 -0.230 1 1 1486 . 1 1 1 A 134 134 GLY C C 134 174.013 174.046 -0.033 1 1 1487 . 1 1 1 A 134 134 GLY CA C 134 45.337 45.022 0.315 1 1 1488 . 1 1 1 A 134 134 GLY N N 134 109.970 109.790 0.180 1 1 1489 . 1 1 1 A 135 135 ALA H H 135 8.424 8.711 -0.287 1 1 1490 . 1 1 1 A 135 135 ALA HA H 135 4.436 4.190 0.246 1 1 1494 . 1 1 1 A 135 135 ALA C C 135 177.537 179.304 -1.767 1 1 1495 . 1 1 1 A 135 135 ALA CA C 135 52.721 54.012 -1.291 1 1 1496 . 1 1 1 A 135 135 ALA CB C 135 19.265 18.565 0.700 1 1 1497 . 1 1 1 A 135 135 ALA N N 135 124.118 125.511 -1.393 1 1 1498 . 1 1 1 A 136 136 HIS H H 136 8.466 7.984 0.482 1 1 1499 . 1 1 1 A 136 136 HIS HA H 136 4.379 4.508 -0.129 1 1 1500 . 1 1 1 A 136 136 HIS C C 136 176.259 175.422 0.837 1 1 1501 . 1 1 1 A 136 136 HIS CA C 136 56.082 58.026 -1.944 1 1 1502 . 1 1 1 A 136 136 HIS CB C 136 29.619 30.705 -1.086 1 1 1503 . 1 1 1 A 136 136 HIS N N 136 119.493 118.675 0.818 1 1 1504 . 1 1 1 A 137 137 GLY H H 137 8.431 7.853 0.578 1 1 1505 . 1 1 1 A 137 137 GLY HA2 H 137 4.151 3.776 0.375 1 1 1506 . 1 1 1 A 137 137 GLY HA3 H 137 3.893 3.823 0.070 1 1 1507 . 1 1 1 A 137 137 GLY C C 137 174.039 173.865 0.174 1 1 1508 . 1 1 1 A 137 137 GLY CA C 137 45.372 46.871 -1.499 1 1 1509 . 1 1 1 A 137 137 GLY N N 137 110.442 107.589 2.853 1 1 1510 . 1 1 1 A 138 138 GLN H H 138 8.416 8.161 0.255 1 1 1511 . 1 1 1 A 138 138 GLN HA H 138 4.455 4.515 -0.060 1 1 1515 . 1 1 1 A 138 138 GLN C C 138 175.889 174.621 1.268 1 1 1516 . 1 1 1 A 138 138 GLN CA C 138 55.866 55.443 0.423 1 1 1517 . 1 1 1 A 138 138 GLN CB C 138 29.639 29.137 0.502 1 1 1518 . 1 1 1 A 138 138 GLN N N 138 119.401 125.106 -5.705 1 1 1519 . 1 1 1 A 139 139 GLU H H 139 8.446 8.800 -0.354 1 1 1520 . 1 1 1 A 139 139 GLU HA H 139 4.658 4.924 -0.266 1 1 1524 . 1 1 1 A 139 139 GLU CA C 139 54.589 53.737 0.852 1 1 1525 . 1 1 1 A 139 139 GLU CB C 139 29.733 33.757 -4.024 1 1 1527 . 1 1 1 A 139 139 GLU N N 139 123.136 127.178 -4.042 1 1 1528 . 1 1 1 A 140 140 PRO HA H 140 4.537 4.535 0.002 1 1 1533 . 1 1 1 A 140 140 PRO C C 140 176.119 176.130 -0.011 1 1 1534 . 1 1 1 A 140 140 PRO CA C 140 63.220 62.782 0.438 1 1 1535 . 1 1 1 A 140 140 PRO CB C 140 31.936 31.779 0.157 1 1 1538 . 1 1 1 A 141 141 GLN H H 141 8.506 8.500 0.006 1 1 1539 . 1 1 1 A 141 141 GLN HA H 141 4.650 4.839 -0.189 1 1 1546 . 1 1 1 A 141 141 GLN C C 141 175.811 175.824 -0.013 1 1 1547 . 1 1 1 A 141 141 GLN CA C 141 55.912 55.679 0.233 1 1 1548 . 1 1 1 A 141 141 GLN CB C 141 30.241 29.795 0.446 1 1 1550 . 1 1 1 A 141 141 GLN N N 141 120.422 121.387 -0.965 1 1 1551 . 1 1 1 A 142 142 LEU H H 142 8.842 9.395 -0.553 1 1 1552 . 1 1 1 A 142 142 LEU HA H 142 5.277 5.194 0.083 1 1 1562 . 1 1 1 A 142 142 LEU C C 142 176.839 175.416 1.423 1 1 1563 . 1 1 1 A 142 142 LEU CA C 142 53.927 52.883 1.044 1 1 1564 . 1 1 1 A 142 142 LEU CB C 142 44.527 44.819 -0.292 1 1 1568 . 1 1 1 A 142 142 LEU N N 142 123.692 120.982 2.710 1 1 1569 . 1 1 1 A 143 143 THR H H 143 9.025 9.264 -0.239 1 1 1570 . 1 1 1 A 143 143 THR HA H 143 5.262 5.095 0.167 1 1 1575 . 1 1 1 A 143 143 THR C C 143 173.753 173.738 0.015 1 1 1576 . 1 1 1 A 143 143 THR CA C 143 61.795 61.766 0.029 1 1 1577 . 1 1 1 A 143 143 THR CB C 143 70.660 70.737 -0.077 1 1 1579 . 1 1 1 A 143 143 THR N N 143 117.222 115.971 1.251 1 1 1580 . 1 1 1 A 144 144 ILE H H 144 9.353 10.171 -0.818 1 1 1581 . 1 1 1 A 144 144 ILE HA H 144 5.399 4.985 0.414 1 1 1591 . 1 1 1 A 144 144 ILE C C 144 173.931 173.664 0.267 1 1 1592 . 1 1 1 A 144 144 ILE CA C 144 60.774 60.537 0.237 1 1 1593 . 1 1 1 A 144 144 ILE CB C 144 41.111 40.338 0.773 1 1 1597 . 1 1 1 A 144 144 ILE N N 144 126.383 126.820 -0.437 1 1 1598 . 1 1 1 A 145 145 ASP H H 145 9.214 9.383 -0.169 1 1 1599 . 1 1 1 A 145 145 ASP HA H 145 5.978 5.518 0.460 1 1 1601 . 1 1 1 A 145 145 ASP C C 145 175.441 174.492 0.949 1 1 1602 . 1 1 1 A 145 145 ASP CA C 145 53.035 52.648 0.387 1 1 1603 . 1 1 1 A 145 145 ASP CB C 145 44.153 43.171 0.982 1 1 1604 . 1 1 1 A 145 145 ASP N N 145 127.981 128.874 -0.893 1 1 1605 . 1 1 1 A 146 146 LEU H H 146 9.387 9.910 -0.523 1 1 1606 . 1 1 1 A 146 146 LEU HA H 146 4.918 5.348 -0.430 1 1 1616 . 1 1 1 A 146 146 LEU C C 146 175.003 175.545 -0.542 1 1 1617 . 1 1 1 A 146 146 LEU CA C 146 53.940 53.750 0.190 1 1 1618 . 1 1 1 A 146 146 LEU CB C 146 43.902 43.808 0.094 1 1 1622 . 1 1 1 A 146 146 LEU N N 146 123.532 127.666 -4.134 1 1 1623 . 1 1 1 A 147 147 ASP H H 147 8.676 9.574 -0.898 1 1 1624 . 1 1 1 A 147 147 ASP HA H 147 5.205 5.184 0.021 1 1 1627 . 1 1 1 A 147 147 ASP C C 147 174.956 174.636 0.320 1 1 1628 . 1 1 1 A 147 147 ASP CA C 147 53.441 52.441 1.000 1 1 1629 . 1 1 1 A 147 147 ASP CB C 147 43.370 43.467 -0.097 1 1 1630 . 1 1 1 A 147 147 ASP N N 147 125.499 125.550 -0.051 1 1 1631 . 1 1 1 A 148 148 SER H H 148 8.732 9.047 -0.315 1 1 1632 . 1 1 1 A 148 148 SER HA H 148 5.365 4.604 0.761 1 1 1634 . 1 1 1 A 148 148 SER C C 148 173.217 172.927 0.290 1 1 1635 . 1 1 1 A 148 148 SER CA C 148 56.334 56.226 0.108 1 1 1636 . 1 1 1 A 148 148 SER CB C 148 65.812 66.769 -0.957 1 1 1637 . 1 1 1 A 148 148 SER N N 148 118.623 119.044 -0.421 1 1 1638 . 1 1 1 A 149 149 ALA H H 149 8.937 8.563 0.374 1 1 1639 . 1 1 1 A 149 149 ALA HA H 149 5.681 5.174 0.507 1 1 1643 . 1 1 1 A 149 149 ALA C C 149 178.894 177.405 1.489 1 1 1644 . 1 1 1 A 149 149 ALA CA C 149 49.996 50.296 -0.300 1 1 1645 . 1 1 1 A 149 149 ALA CB C 149 23.231 23.122 0.109 1 1 1646 . 1 1 1 A 149 149 ALA N N 149 123.952 121.734 2.218 1 1 1647 . 1 1 1 A 150 150 ASP H H 150 9.010 8.560 0.450 1 1 1648 . 1 1 1 A 150 150 ASP HA H 150 4.336 4.307 0.029 1 1 1651 . 1 1 1 A 150 150 ASP C C 150 176.697 176.471 0.226 1 1 1652 . 1 1 1 A 150 150 ASP CA C 150 56.543 57.240 -0.697 1 1 1653 . 1 1 1 A 150 150 ASP CB C 150 39.850 40.490 -0.640 1 1 1654 . 1 1 1 A 150 150 ASP N N 150 122.687 120.368 2.319 1 1 1655 . 1 1 1 A 151 151 PHE H H 151 7.295 7.847 -0.552 1 1 1656 . 1 1 1 A 151 151 PHE HA H 151 5.020 4.780 0.240 1 1 1661 . 1 1 1 A 151 151 PHE C C 151 174.756 175.723 -0.967 1 1 1662 . 1 1 1 A 151 151 PHE CA C 151 56.594 56.460 0.134 1 1 1663 . 1 1 1 A 151 151 PHE CB C 151 37.765 37.218 0.547 1 1 1666 . 1 1 1 A 151 151 PHE N N 151 113.928 116.140 -2.212 1 1 1667 . 1 1 1 A 152 152 GLY H H 152 7.786 8.304 -0.518 1 1 1668 . 1 1 1 A 152 152 GLY HA2 H 152 4.459 3.977 0.482 1 1 1669 . 1 1 1 A 152 152 GLY HA3 H 152 3.728 3.989 -0.261 1 1 1670 . 1 1 1 A 152 152 GLY C C 152 172.709 173.489 -0.780 1 1 1671 . 1 1 1 A 152 152 GLY CA C 152 46.106 47.237 -1.131 1 1 1672 . 1 1 1 A 152 152 GLY N N 152 110.312 109.353 0.959 1 1 1673 . 1 1 1 A 153 153 TYR H H 153 6.650 7.756 -1.106 1 1 1674 . 1 1 1 A 153 153 TYR HA H 153 4.508 4.980 -0.472 1 1 1679 . 1 1 1 A 153 153 TYR C C 153 173.092 173.076 0.016 1 1 1680 . 1 1 1 A 153 153 TYR CA C 153 57.464 57.462 0.002 1 1 1681 . 1 1 1 A 153 153 TYR CB C 153 41.962 42.203 -0.241 1 1 1684 . 1 1 1 A 153 153 TYR N N 153 121.977 119.286 2.691 1 1 1685 . 1 1 1 A 154 154 ALA H H 154 7.847 8.546 -0.699 1 1 1686 . 1 1 1 A 154 154 ALA HA H 154 5.144 4.633 0.511 1 1 1690 . 1 1 1 A 154 154 ALA C C 154 174.468 175.683 -1.215 1 1 1691 . 1 1 1 A 154 154 ALA CA C 154 51.776 51.453 0.323 1 1 1692 . 1 1 1 A 154 154 ALA CB C 154 21.747 21.802 -0.055 1 1 1693 . 1 1 1 A 154 154 ALA N N 154 130.258 130.178 0.080 1 1 1694 . 1 1 1 A 155 155 VAL H H 155 8.733 8.662 0.071 1 1 1695 . 1 1 1 A 155 155 VAL HA H 155 4.150 4.846 -0.696 1 1 1700 . 1 1 1 A 155 155 VAL C C 155 172.632 174.859 -2.227 1 1 1701 . 1 1 1 A 155 155 VAL CA C 155 61.451 60.608 0.843 1 1 1702 . 1 1 1 A 155 155 VAL CB C 155 35.883 35.950 -0.067 1 1 1704 . 1 1 1 A 155 155 VAL N N 155 119.622 122.292 -2.670 1 1 1705 . 1 1 1 A 156 156 GLY H H 156 8.146 9.481 -1.335 1 1 1706 . 1 1 1 A 156 156 GLY HA2 H 156 5.125 4.318 0.807 1 1 1707 . 1 1 1 A 156 156 GLY HA3 H 156 2.061 4.412 -2.351 1 1 1708 . 1 1 1 A 156 156 GLY C C 156 171.746 171.841 -0.095 1 1 1709 . 1 1 1 A 156 156 GLY CA C 156 43.319 44.305 -0.986 1 1 1710 . 1 1 1 A 156 156 GLY N N 156 113.332 114.734 -1.402 1 1 1711 . 1 1 1 A 157 157 GLU H H 157 8.967 8.818 0.149 1 1 1712 . 1 1 1 A 157 157 GLU HA H 157 5.217 5.037 0.180 1 1 1716 . 1 1 1 A 157 157 GLU C C 157 174.476 175.560 -1.084 1 1 1717 . 1 1 1 A 157 157 GLU CA C 157 55.390 54.981 0.409 1 1 1718 . 1 1 1 A 157 157 GLU CB C 157 34.010 32.290 1.720 1 1 1720 . 1 1 1 A 157 157 GLU N N 157 120.823 121.949 -1.126 1 1 1721 . 1 1 1 A 158 158 VAL H H 158 9.076 9.423 -0.347 1 1 1722 . 1 1 1 A 158 158 VAL HA H 158 5.206 4.919 0.287 1 1 1727 . 1 1 1 A 158 158 VAL C C 158 173.900 174.568 -0.668 1 1 1728 . 1 1 1 A 158 158 VAL CA C 158 60.813 61.602 -0.789 1 1 1729 . 1 1 1 A 158 158 VAL CB C 158 33.385 33.001 0.384 1 1 1731 . 1 1 1 A 158 158 VAL N N 158 124.349 125.688 -1.339 1 1 1732 . 1 1 1 A 159 159 GLU H H 159 9.239 9.709 -0.470 1 1 1733 . 1 1 1 A 159 159 GLU HA H 159 5.647 5.829 -0.182 1 1 1738 . 1 1 1 A 159 159 GLU C C 159 174.469 174.998 -0.529 1 1 1739 . 1 1 1 A 159 159 GLU CA C 159 54.473 54.591 -0.118 1 1 1740 . 1 1 1 A 159 159 GLU CB C 159 33.852 32.958 0.894 1 1 1742 . 1 1 1 A 159 159 GLU N N 159 125.772 128.850 -3.078 1 1 1743 . 1 1 1 A 160 160 ALA H H 160 9.250 9.256 -0.006 1 1 1744 . 1 1 1 A 160 160 ALA HA H 160 4.966 5.358 -0.392 1 1 1748 . 1 1 1 A 160 160 ALA C C 160 175.114 175.852 -0.738 1 1 1749 . 1 1 1 A 160 160 ALA CA C 160 50.644 49.990 0.654 1 1 1750 . 1 1 1 A 160 160 ALA CB C 160 23.263 23.095 0.168 1 1 1751 . 1 1 1 A 160 160 ALA N N 160 125.092 129.577 -4.485 1 1 1752 . 1 1 1 A 161 161 MET H H 161 8.559 8.850 -0.291 1 1 1753 . 1 1 1 A 161 161 MET HA H 161 5.468 5.881 -0.413 1 1 1761 . 1 1 1 A 161 161 MET C C 161 176.265 175.055 1.210 1 1 1762 . 1 1 1 A 161 161 MET CA C 161 53.818 54.062 -0.244 1 1 1763 . 1 1 1 A 161 161 MET CB C 161 34.380 34.803 -0.423 1 1 1766 . 1 1 1 A 161 161 MET N N 161 118.699 119.250 -0.551 1 1 1767 . 1 1 1 A 162 162 VAL H H 162 9.046 9.072 -0.026 1 1 1768 . 1 1 1 A 162 162 VAL HA H 162 4.841 4.891 -0.050 1 1 1776 . 1 1 1 A 162 162 VAL C C 162 174.794 175.784 -0.990 1 1 1777 . 1 1 1 A 162 162 VAL CA C 162 59.107 59.374 -0.267 1 1 1778 . 1 1 1 A 162 162 VAL CB C 162 34.018 34.891 -0.873 1 1 1781 . 1 1 1 A 162 162 VAL N N 162 116.435 117.786 -1.351 1 1 1782 . 1 1 1 A 163 163 HIS H H 163 8.793 8.666 0.127 1 1 1783 . 1 1 1 A 163 163 HIS HA H 163 4.717 4.543 0.174 1 1 1787 . 1 1 1 A 163 163 HIS C C 163 175.460 174.333 1.127 1 1 1788 . 1 1 1 A 163 163 HIS CA C 163 58.488 57.453 1.035 1 1 1789 . 1 1 1 A 163 163 HIS CB C 163 31.185 30.851 0.334 1 1 1791 . 1 1 1 A 163 163 HIS N N 163 117.838 121.246 -3.408 1 1 1792 . 1 1 1 A 164 164 GLU H H 164 8.013 7.792 0.221 1 1 1793 . 1 1 1 A 164 164 GLU HA H 164 4.814 4.582 0.232 1 1 1797 . 1 1 1 A 164 164 GLU C C 164 176.910 176.427 0.483 1 1 1798 . 1 1 1 A 164 164 GLU CA C 164 54.355 54.924 -0.569 1 1 1799 . 1 1 1 A 164 164 GLU CB C 164 32.886 32.215 0.671 1 1 1801 . 1 1 1 A 164 164 GLU N N 164 115.943 119.411 -3.468 1 1 1802 . 1 1 1 A 165 165 LYS H H 165 9.088 8.928 0.160 1 1 1803 . 1 1 1 A 165 165 LYS HA H 165 3.942 4.011 -0.069 1 1 1809 . 1 1 1 A 165 165 LYS C C 165 179.657 178.035 1.622 1 1 1810 . 1 1 1 A 165 165 LYS CA C 165 59.888 58.373 1.515 1 1 1811 . 1 1 1 A 165 165 LYS CB C 165 32.024 32.334 -0.310 1 1 1814 . 1 1 1 A 165 165 LYS N N 165 124.120 127.933 -3.813 1 1 1815 . 1 1 1 A 166 166 ALA H H 166 8.851 7.624 1.227 1 1 1816 . 1 1 1 A 166 166 ALA HA H 166 4.251 4.118 0.133 1 1 1820 . 1 1 1 A 166 166 ALA C C 166 178.920 178.304 0.616 1 1 1821 . 1 1 1 A 166 166 ALA CA C 166 54.318 54.234 0.084 1 1 1822 . 1 1 1 A 166 166 ALA CB C 166 18.810 18.186 0.624 1 1 1823 . 1 1 1 A 166 166 ALA N N 166 120.424 122.353 -1.929 1 1 1824 . 1 1 1 A 167 167 GLU H H 167 7.871 7.881 -0.010 1 1 1825 . 1 1 1 A 167 167 GLU HA H 167 4.404 4.337 0.067 1 1 1829 . 1 1 1 A 167 167 GLU C C 167 177.368 178.030 -0.662 1 1 1830 . 1 1 1 A 167 167 GLU CA C 167 56.701 56.578 0.123 1 1 1831 . 1 1 1 A 167 167 GLU CB C 167 31.208 29.707 1.501 1 1 1833 . 1 1 1 A 167 167 GLU N N 167 114.926 115.301 -0.375 1 1 1834 . 1 1 1 A 168 168 VAL H H 168 7.812 7.369 0.443 1 1 1835 . 1 1 1 A 168 168 VAL HA H 168 3.712 3.688 0.024 1 1 1843 . 1 1 1 A 168 168 VAL CA C 168 68.705 67.879 0.826 1 1 1844 . 1 1 1 A 168 168 VAL CB C 168 29.597 29.687 -0.090 1 1 1847 . 1 1 1 A 168 168 VAL N N 168 120.188 121.729 -1.541 1 1 1848 . 1 1 1 A 169 169 PRO HA H 169 4.252 4.225 0.027 1 1 1851 . 1 1 1 A 169 169 PRO C C 169 179.563 178.599 0.964 1 1 1852 . 1 1 1 A 169 169 PRO CA C 169 67.077 66.763 0.314 1 1 1853 . 1 1 1 A 170 170 ALA H H 170 8.149 8.190 -0.041 1 1 1854 . 1 1 1 A 170 170 ALA HA H 170 4.265 4.067 0.198 1 1 1858 . 1 1 1 A 170 170 ALA C C 170 180.637 179.953 0.684 1 1 1859 . 1 1 1 A 170 170 ALA CA C 170 54.823 55.354 -0.531 1 1 1860 . 1 1 1 A 170 170 ALA CB C 170 18.518 18.239 0.279 1 1 1861 . 1 1 1 A 170 170 ALA N N 170 119.210 119.277 -0.067 1 1 1862 . 1 1 1 A 171 171 ALA H H 171 7.767 8.313 -0.546 1 1 1863 . 1 1 1 A 171 171 ALA HA H 171 4.106 4.110 -0.004 1 1 1867 . 1 1 1 A 171 171 ALA C C 171 179.371 179.834 -0.463 1 1 1868 . 1 1 1 A 171 171 ALA CA C 171 55.130 54.993 0.137 1 1 1869 . 1 1 1 A 171 171 ALA CB C 171 18.291 18.278 0.013 1 1 1870 . 1 1 1 A 171 171 ALA N N 171 122.126 120.430 1.696 1 1 1871 . 1 1 1 A 172 172 LEU H H 172 8.950 8.519 0.431 1 1 1872 . 1 1 1 A 172 172 LEU HA H 172 3.987 4.084 -0.097 1 1 1878 . 1 1 1 A 172 172 LEU C C 172 178.355 178.676 -0.321 1 1 1879 . 1 1 1 A 172 172 LEU CA C 172 57.803 57.796 0.007 1 1 1880 . 1 1 1 A 172 172 LEU CB C 172 41.667 41.887 -0.220 1 1 1882 . 1 1 1 A 172 172 LEU N N 172 118.682 119.513 -0.831 1 1 1883 . 1 1 1 A 173 173 GLU H H 173 7.886 8.223 -0.337 1 1 1884 . 1 1 1 A 173 173 GLU HA H 173 4.132 3.956 0.176 1 1 1887 . 1 1 1 A 173 173 GLU C C 173 179.556 179.338 0.218 1 1 1888 . 1 1 1 A 173 173 GLU CA C 173 59.800 59.603 0.197 1 1 1889 . 1 1 1 A 173 173 GLU CB C 173 29.580 29.205 0.375 1 1 1891 . 1 1 1 A 173 173 GLU N N 173 117.561 118.953 -1.392 1 1 1892 . 1 1 1 A 174 174 LYS H H 174 7.532 7.671 -0.139 1 1 1893 . 1 1 1 A 174 174 LYS HA H 174 4.131 4.095 0.036 1 1 1901 . 1 1 1 A 174 174 LYS CA C 174 58.999 59.378 -0.379 1 1 1902 . 1 1 1 A 174 174 LYS CB C 174 32.041 32.577 -0.536 1 1 1906 . 1 1 1 A 174 174 LYS N N 174 119.085 119.559 -0.474 1 1 1907 . 1 1 1 A 175 175 ILE H H 175 8.479 8.050 0.429 1 1 1908 . 1 1 1 A 175 175 ILE HA H 175 3.583 3.625 -0.042 1 1 1918 . 1 1 1 A 175 175 ILE C C 175 179.258 178.601 0.657 1 1 1919 . 1 1 1 A 175 175 ILE CA C 175 65.769 65.591 0.178 1 1 1920 . 1 1 1 A 175 175 ILE CB C 175 37.876 38.049 -0.173 1 1 1923 . 1 1 1 A 175 175 ILE N N 175 118.828 120.113 -1.285 1 1 1924 . 1 1 1 A 176 176 ILE H H 176 8.928 8.223 0.705 1 1 1925 . 1 1 1 A 176 176 ILE HA H 176 3.600 3.643 -0.043 1 1 1935 . 1 1 1 A 176 176 ILE C C 176 178.827 178.225 0.602 1 1 1936 . 1 1 1 A 176 176 ILE CA C 176 65.640 64.688 0.952 1 1 1937 . 1 1 1 A 176 176 ILE CB C 176 37.451 37.437 0.014 1 1 1941 . 1 1 1 A 176 176 ILE N N 176 124.527 119.568 4.959 1 1 1942 . 1 1 1 A 177 177 THR H H 177 8.175 8.209 -0.034 1 1 1943 . 1 1 1 A 177 177 THR HA H 177 3.885 3.972 -0.087 1 1 1948 . 1 1 1 A 177 177 THR C C 177 176.867 176.513 0.354 1 1 1949 . 1 1 1 A 177 177 THR CA C 177 67.199 66.545 0.654 1 1 1950 . 1 1 1 A 177 177 THR CB C 177 68.377 68.159 0.218 1 1 1952 . 1 1 1 A 177 177 THR N N 177 119.412 118.801 0.611 1 1 1953 . 1 1 1 A 178 178 VAL H H 178 8.352 8.038 0.314 1 1 1954 . 1 1 1 A 178 178 VAL HA H 178 3.572 3.488 0.084 1 1 1962 . 1 1 1 A 178 178 VAL C C 178 177.664 177.948 -0.284 1 1 1963 . 1 1 1 A 178 178 VAL CA C 178 66.909 66.293 0.616 1 1 1964 . 1 1 1 A 178 178 VAL CB C 178 31.714 31.346 0.368 1 1 1967 . 1 1 1 A 178 178 VAL N N 178 121.168 121.997 -0.829 1 1 1968 . 1 1 1 A 179 179 SER H H 179 8.529 7.905 0.624 1 1 1969 . 1 1 1 A 179 179 SER HA H 179 3.099 3.334 -0.235 1 1 1972 . 1 1 1 A 179 179 SER C C 179 175.380 176.313 -0.933 1 1 1973 . 1 1 1 A 179 179 SER CA C 179 62.728 61.283 1.445 1 1 1974 . 1 1 1 A 179 179 SER CB C 179 62.802 62.196 0.606 1 1 1975 . 1 1 1 A 179 179 SER N N 179 115.226 116.242 -1.016 1 1 1976 . 1 1 1 A 180 180 SER H H 180 7.757 8.814 -1.057 1 1 1977 . 1 1 1 A 180 180 SER HA H 180 4.419 4.347 0.072 1 1 1980 . 1 1 1 A 180 180 SER C C 180 175.359 176.777 -1.418 1 1 1981 . 1 1 1 A 180 180 SER CA C 180 61.025 61.240 -0.215 1 1 1982 . 1 1 1 A 180 180 SER CB C 180 63.072 62.687 0.385 1 1 1983 . 1 1 1 A 180 180 SER N N 180 114.718 116.415 -1.697 1 1 1984 . 1 1 1 A 181 181 MET H H 181 7.497 7.604 -0.107 1 1 1985 . 1 1 1 A 181 181 MET HA H 181 4.283 4.260 0.023 1 1 1993 . 1 1 1 A 181 181 MET C C 181 177.217 178.528 -1.311 1 1 1994 . 1 1 1 A 181 181 MET CA C 181 57.539 57.949 -0.410 1 1 1995 . 1 1 1 A 181 181 MET CB C 181 33.493 32.321 1.172 1 1 1998 . 1 1 1 A 181 181 MET N N 181 119.274 120.609 -1.335 1 1 1999 . 1 1 1 A 182 182 LEU H H 182 7.163 7.833 -0.670 1 1 2000 . 1 1 1 A 182 182 LEU HA H 182 4.133 4.337 -0.204 1 1 2010 . 1 1 1 A 182 182 LEU C C 182 176.289 176.620 -0.331 1 1 2011 . 1 1 1 A 182 182 LEU CA C 182 54.750 56.628 -1.878 1 1 2012 . 1 1 1 A 182 182 LEU CB C 182 43.235 43.045 0.190 1 1 2016 . 1 1 1 A 182 182 LEU N N 182 115.869 120.115 -4.246 1 1 2017 . 1 1 1 A 183 183 GLY H H 183 7.492 7.912 -0.420 1 1 2018 . 1 1 1 A 183 183 GLY HA2 H 183 4.086 4.173 -0.087 1 1 2019 . 1 1 1 A 183 183 GLY HA3 H 183 4.425 4.231 0.194 1 1 2020 . 1 1 1 A 183 183 GLY C C 183 171.830 172.087 -0.257 1 1 2021 . 1 1 1 A 183 183 GLY CA C 183 46.035 46.261 -0.226 1 1 2022 . 1 1 1 A 183 183 GLY N N 183 107.761 107.307 0.454 1 1 2023 . 1 1 1 A 184 184 VAL H H 184 8.099 8.445 -0.346 1 1 2024 . 1 1 1 A 184 184 VAL HA H 184 4.772 5.150 -0.378 1 1 2032 . 1 1 1 A 184 184 VAL CA C 184 59.305 58.282 1.023 1 1 2033 . 1 1 1 A 184 184 VAL CB C 184 33.648 34.810 -1.162 1 1 2036 . 1 1 1 A 184 184 VAL N N 184 119.803 119.529 0.274 1 1 2037 . 1 1 1 A 185 185 PRO HA H 185 4.442 4.808 -0.366 1 1 2042 . 1 1 1 A 185 185 PRO C C 185 175.871 176.827 -0.956 1 1 2043 . 1 1 1 A 185 185 PRO CA C 185 63.886 62.875 1.011 1 1 2044 . 1 1 1 A 185 185 PRO CB C 185 32.260 32.185 0.075 1 1 2047 . 1 1 1 A 186 186 ALA H H 186 8.222 8.476 -0.254 1 1 2048 . 1 1 1 A 186 186 ALA HA H 186 4.569 4.704 -0.135 1 1 2052 . 1 1 1 A 186 186 ALA C C 186 177.481 177.131 0.350 1 1 2053 . 1 1 1 A 186 186 ALA CA C 186 51.823 50.889 0.934 1 1 2054 . 1 1 1 A 186 186 ALA CB C 186 20.233 20.539 -0.306 1 1 2055 . 1 1 1 A 186 186 ALA N N 186 125.663 123.330 2.333 1 1 2056 . 1 1 1 A 187 187 GLN H H 187 8.723 8.684 0.039 1 1 2057 . 1 1 1 A 187 187 GLN HA H 187 4.420 4.721 -0.301 1 1 2063 . 1 1 1 A 187 187 GLN C C 187 175.566 175.859 -0.293 1 1 2064 . 1 1 1 A 187 187 GLN CA C 187 56.051 55.699 0.352 1 1 2065 . 1 1 1 A 187 187 GLN CB C 187 29.812 30.482 -0.670 1 1 2067 . 1 1 1 A 187 187 GLN N N 187 120.742 116.354 4.388 1 1 2069 . 1 1 1 A 188 188 GLU H H 188 8.163 7.513 0.650 1 1 2070 . 1 1 1 A 188 188 GLU HA H 188 4.405 4.371 0.034 1 1 2074 . 1 1 1 A 188 188 GLU C C 188 176.058 176.823 -0.765 1 1 2075 . 1 1 1 A 188 188 GLU CA C 188 56.158 56.005 0.153 1 1 2076 . 1 1 1 A 188 188 GLU CB C 188 31.095 30.721 0.374 1 1 2078 . 1 1 1 A 188 188 GLU N N 188 119.177 119.477 -0.300 1 1 2079 . 1 1 1 A 189 189 GLU H H 189 8.567 8.957 -0.390 1 1 2080 . 1 1 1 A 189 189 GLU HA H 189 4.252 4.438 -0.186 1 1 2084 . 1 1 1 A 189 189 GLU C C 189 175.703 175.293 0.410 1 1 2085 . 1 1 1 A 189 189 GLU CA C 189 56.417 56.158 0.259 1 1 2086 . 1 1 1 A 189 189 GLU CB C 189 29.968 29.473 0.495 1 1 2088 . 1 1 1 A 189 189 GLU N N 189 120.920 121.149 -0.229 1 1 2089 . 1 1 1 A 190 190 ALA H H 190 8.271 8.138 0.133 1 1 2090 . 1 1 1 A 190 190 ALA HA H 190 4.626 4.195 0.431 1 1 2094 . 1 1 1 A 190 190 ALA CA C 190 50.465 52.875 -2.410 1 1 2095 . 1 1 1 A 190 190 ALA CB C 190 18.451 17.925 0.526 1 1 2096 . 1 1 1 A 190 190 ALA N N 190 128.323 120.172 8.151 1 1 2097 . 1 1 1 A 191 191 PRO HA H 191 4.493 4.578 -0.085 1 1 2103 . 1 1 1 A 191 191 PRO C C 191 175.899 176.566 -0.667 1 1 2104 . 1 1 1 A 191 191 PRO CA C 191 62.044 62.320 -0.276 1 1 2105 . 1 1 1 A 191 191 PRO CB C 191 32.184 32.588 -0.404 1 1 2108 . 1 1 1 A 192 192 ALA H H 192 8.610 8.212 0.398 1 1 2109 . 1 1 1 A 192 192 ALA HA H 192 4.280 4.463 -0.183 1 1 2113 . 1 1 1 A 192 192 ALA C C 192 178.282 178.468 -0.186 1 1 2114 . 1 1 1 A 192 192 ALA CA C 192 51.698 51.232 0.466 1 1 2115 . 1 1 1 A 192 192 ALA CB C 192 19.220 20.467 -1.247 1 1 2116 . 1 1 1 A 192 192 ALA N N 192 123.420 124.465 -1.045 1 1 2117 . 1 1 1 A 193 193 LYS H H 193 8.531 8.824 -0.293 1 1 2118 . 1 1 1 A 193 193 LYS HA H 193 3.294 3.779 -0.485 1 1 2126 . 1 1 1 A 193 193 LYS C C 193 177.640 178.293 -0.653 1 1 2127 . 1 1 1 A 193 193 LYS CA C 193 60.644 59.319 1.325 1 1 2128 . 1 1 1 A 193 193 LYS CB C 193 32.607 31.935 0.672 1 1 2132 . 1 1 1 A 193 193 LYS N N 193 122.851 119.132 3.719 1 1 2133 . 1 1 1 A 194 194 LEU H H 194 8.570 8.248 0.322 1 1 2134 . 1 1 1 A 194 194 LEU HA H 194 3.845 4.301 -0.456 1 1 2144 . 1 1 1 A 194 194 LEU C C 194 177.965 179.335 -1.370 1 1 2145 . 1 1 1 A 194 194 LEU CA C 194 57.611 57.542 0.069 1 1 2146 . 1 1 1 A 194 194 LEU CB C 194 41.776 41.120 0.656 1 1 2150 . 1 1 1 A 194 194 LEU N N 194 115.801 119.808 -4.007 1 1 2151 . 1 1 1 A 195 195 MET H H 195 6.782 7.714 -0.932 1 1 2152 . 1 1 1 A 195 195 MET HA H 195 4.487 4.271 0.216 1 1 2160 . 1 1 1 A 195 195 MET C C 195 178.280 178.247 0.033 1 1 2161 . 1 1 1 A 195 195 MET CA C 195 56.858 57.996 -1.138 1 1 2162 . 1 1 1 A 195 195 MET CB C 195 31.557 32.132 -0.575 1 1 2165 . 1 1 1 A 195 195 MET N N 195 113.898 119.087 -5.189 1 1 2166 . 1 1 1 A 196 196 VAL H H 196 7.713 7.503 0.210 1 1 2167 . 1 1 1 A 196 196 VAL HA H 196 3.501 3.488 0.013 1 1 2175 . 1 1 1 A 196 196 VAL C C 196 177.624 177.697 -0.073 1 1 2176 . 1 1 1 A 196 196 VAL CA C 196 66.318 65.908 0.410 1 1 2177 . 1 1 1 A 196 196 VAL CB C 196 31.380 31.551 -0.171 1 1 2180 . 1 1 1 A 196 196 VAL N N 196 120.413 119.790 0.623 1 1 2181 . 1 1 1 A 197 197 TYR H H 197 7.972 8.690 -0.718 1 1 2182 . 1 1 1 A 197 197 TYR HA H 197 3.145 4.214 -1.069 1 1 2187 . 1 1 1 A 197 197 TYR C C 197 177.726 177.143 0.583 1 1 2188 . 1 1 1 A 197 197 TYR CA C 197 62.253 61.706 0.547 1 1 2189 . 1 1 1 A 197 197 TYR CB C 197 37.314 38.782 -1.468 1 1 2192 . 1 1 1 A 197 197 TYR N N 197 119.543 121.059 -1.516 1 1 2193 . 1 1 1 A 198 198 LEU H H 198 8.630 8.208 0.422 1 1 2194 . 1 1 1 A 198 198 LEU HA H 198 3.923 3.623 0.300 1 1 2203 . 1 1 1 A 198 198 LEU C C 198 178.074 178.978 -0.904 1 1 2204 . 1 1 1 A 198 198 LEU CA C 198 58.294 58.024 0.270 1 1 2205 . 1 1 1 A 198 198 LEU CB C 198 42.177 41.622 0.555 1 1 2209 . 1 1 1 A 198 198 LEU N N 198 118.430 120.118 -1.688 1 1 2210 . 1 1 1 A 199 199 GLN H H 199 8.082 8.397 -0.315 1 1 2211 . 1 1 1 A 199 199 GLN HA H 199 3.054 3.786 -0.732 1 1 2216 . 1 1 1 A 199 199 GLN C C 199 176.875 178.054 -1.179 1 1 2217 . 1 1 1 A 199 199 GLN CA C 199 59.739 58.199 1.540 1 1 2218 . 1 1 1 A 199 199 GLN CB C 199 28.055 27.488 0.567 1 1 2220 . 1 1 1 A 199 199 GLN N N 199 117.926 117.401 0.525 1 1 2222 . 1 1 1 A 200 200 ARG H H 200 7.349 7.853 -0.504 1 1 2223 . 1 1 1 A 200 200 ARG HA H 200 3.798 3.839 -0.041 1 1 2231 . 1 1 1 A 200 200 ARG C C 200 178.037 177.976 0.061 1 1 2232 . 1 1 1 A 200 200 ARG CA C 200 58.260 58.742 -0.482 1 1 2233 . 1 1 1 A 200 200 ARG CB C 200 30.706 30.039 0.667 1 1 2236 . 1 1 1 A 200 200 ARG N N 200 113.772 119.766 -5.994 1 1 2238 . 1 1 1 A 201 201 PHE H H 201 8.329 7.470 0.859 1 1 2239 . 1 1 1 A 201 201 PHE HA H 201 4.630 4.431 0.199 1 1 2244 . 1 1 1 A 201 201 PHE C C 201 176.606 176.278 0.328 1 1 2245 . 1 1 1 A 201 201 PHE CA C 201 59.014 58.693 0.321 1 1 2246 . 1 1 1 A 201 201 PHE CB C 201 40.357 40.795 -0.438 1 1 2249 . 1 1 1 A 201 201 PHE N N 201 114.182 116.168 -1.986 1 1 2250 . 1 1 1 A 202 202 ARG H H 202 8.719 8.396 0.323 1 1 2251 . 1 1 1 A 202 202 ARG HA H 202 5.071 4.654 0.417 1 1 2261 . 1 1 1 A 202 202 ARG CA C 202 53.956 53.329 0.627 1 1 2262 . 1 1 1 A 202 202 ARG CB C 202 31.979 30.287 1.692 1 1 2264 . 1 1 1 A 202 202 ARG N N 202 120.115 115.526 4.589 1 1 2266 . 1 1 1 A 203 203 PRO HA H 203 4.348 4.488 -0.140 1 1 2271 . 1 1 1 A 203 203 PRO C C 203 179.736 178.295 1.441 1 1 2272 . 1 1 1 A 203 203 PRO CA C 203 65.674 65.282 0.392 1 1 2273 . 1 1 1 A 203 203 PRO CB C 203 31.717 32.236 -0.519 1 1 2275 . 1 1 1 A 204 204 LEU H H 204 8.875 7.656 1.219 1 1 2276 . 1 1 1 A 204 204 LEU HA H 204 4.291 4.044 0.247 1 1 2286 . 1 1 1 A 204 204 LEU C C 204 180.353 178.057 2.296 1 1 2287 . 1 1 1 A 204 204 LEU CA C 204 58.012 57.121 0.891 1 1 2288 . 1 1 1 A 204 204 LEU CB C 204 40.893 41.729 -0.836 1 1 2292 . 1 1 1 A 204 204 LEU N N 204 118.940 116.967 1.973 1 1 2293 . 1 1 1 A 205 205 ASP H H 205 7.541 8.296 -0.755 1 1 2294 . 1 1 1 A 205 205 ASP HA H 205 4.622 4.327 0.295 1 1 2297 . 1 1 1 A 205 205 ASP C C 205 177.602 178.145 -0.543 1 1 2298 . 1 1 1 A 205 205 ASP CA C 205 57.437 57.226 0.211 1 1 2299 . 1 1 1 A 205 205 ASP CB C 205 41.143 40.725 0.418 1 1 2300 . 1 1 1 A 205 205 ASP N N 205 120.838 119.298 1.540 1 1 2301 . 1 1 1 A 206 206 TYR H H 206 8.237 8.200 0.037 1 1 2302 . 1 1 1 A 206 206 TYR HA H 206 4.018 4.111 -0.093 1 1 2307 . 1 1 1 A 206 206 TYR C C 206 176.433 177.807 -1.374 1 1 2308 . 1 1 1 A 206 206 TYR CA C 206 62.148 62.074 0.074 1 1 2309 . 1 1 1 A 206 206 TYR CB C 206 38.305 38.748 -0.443 1 1 2312 . 1 1 1 A 206 206 TYR N N 206 119.475 120.481 -1.006 1 1 2313 . 1 1 1 A 207 207 GLN H H 207 8.124 7.961 0.163 1 1 2314 . 1 1 1 A 207 207 GLN HA H 207 3.823 3.248 0.575 1 1 2320 . 1 1 1 A 207 207 GLN C C 207 178.019 178.678 -0.659 1 1 2321 . 1 1 1 A 207 207 GLN CA C 207 58.841 59.057 -0.216 1 1 2322 . 1 1 1 A 207 207 GLN CB C 207 28.208 28.490 -0.282 1 1 2324 . 1 1 1 A 207 207 GLN N N 207 115.863 118.783 -2.920 1 1 2326 . 1 1 1 A 208 208 ARG H H 208 7.522 7.742 -0.220 1 1 2327 . 1 1 1 A 208 208 ARG HA H 208 4.127 4.044 0.083 1 1 2334 . 1 1 1 A 208 208 ARG C C 208 179.278 178.948 0.330 1 1 2335 . 1 1 1 A 208 208 ARG CA C 208 59.419 58.950 0.469 1 1 2336 . 1 1 1 A 208 208 ARG CB C 208 30.182 29.819 0.363 1 1 2338 . 1 1 1 A 208 208 ARG N N 208 118.471 119.979 -1.508 1 1 2340 . 1 1 1 A 209 209 LEU H H 209 7.869 7.648 0.221 1 1 2341 . 1 1 1 A 209 209 LEU HA H 209 4.091 4.145 -0.054 1 1 2351 . 1 1 1 A 209 209 LEU C C 209 179.715 178.183 1.532 1 1 2352 . 1 1 1 A 209 209 LEU CA C 209 57.891 58.097 -0.206 1 1 2353 . 1 1 1 A 209 209 LEU CB C 209 41.338 41.750 -0.412 1 1 2356 . 1 1 1 A 209 209 LEU N N 209 119.659 121.368 -1.709 1 1 2357 . 1 1 1 A 210 210 LEU H H 210 8.034 8.514 -0.480 1 1 2358 . 1 1 1 A 210 210 LEU HA H 210 3.977 3.999 -0.022 1 1 2367 . 1 1 1 A 210 210 LEU C C 210 180.363 178.444 1.919 1 1 2368 . 1 1 1 A 210 210 LEU CA C 210 57.459 58.530 -1.071 1 1 2369 . 1 1 1 A 210 210 LEU CB C 210 41.699 41.132 0.567 1 1 2373 . 1 1 1 A 210 210 LEU N N 210 120.967 119.630 1.337 1 1 2374 . 1 1 1 A 211 211 GLU H H 211 8.174 8.372 -0.198 1 1 2375 . 1 1 1 A 211 211 GLU HA H 211 4.075 4.006 0.069 1 1 2379 . 1 1 1 A 211 211 GLU C C 211 178.499 178.474 0.025 1 1 2380 . 1 1 1 A 211 211 GLU CA C 211 58.575 59.571 -0.996 1 1 2381 . 1 1 1 A 211 211 GLU CB C 211 29.583 29.239 0.344 1 1 2383 . 1 1 1 A 211 211 GLU N N 211 119.217 117.917 1.300 1 1 2384 . 1 1 1 A 212 212 ALA H H 212 7.723 7.834 -0.111 1 1 2385 . 1 1 1 A 212 212 ALA HA H 212 4.291 4.331 -0.040 1 1 2389 . 1 1 1 A 212 212 ALA C C 212 178.770 178.111 0.659 1 1 2390 . 1 1 1 A 212 212 ALA CA C 212 53.966 53.886 0.080 1 1 2391 . 1 1 1 A 212 212 ALA CB C 212 19.117 19.151 -0.034 1 1 2392 . 1 1 1 A 212 212 ALA N N 212 121.798 121.948 -0.150 1 1 2393 . 1 1 1 A 213 213 ALA H H 213 7.743 8.177 -0.434 1 1 2394 . 1 1 1 A 213 213 ALA HA H 213 4.406 4.606 -0.200 1 1 2398 . 1 1 1 A 213 213 ALA C C 213 178.413 177.464 0.949 1 1 2399 . 1 1 1 A 213 213 ALA CA C 213 53.129 51.556 1.573 1 1 2400 . 1 1 1 A 213 213 ALA CB C 213 18.926 18.638 0.288 1 1 2401 . 1 1 1 A 213 213 ALA N N 213 120.435 118.634 1.801 1 1 2402 . 1 1 1 A 214 214 SER H H 214 7.944 7.625 0.319 1 1 2403 . 1 1 1 A 214 214 SER HA H 214 4.559 4.626 -0.067 1 1 2406 . 1 1 1 A 214 214 SER C C 214 174.958 173.552 1.406 1 1 2407 . 1 1 1 A 214 214 SER CA C 214 58.640 57.867 0.773 1 1 2408 . 1 1 1 A 214 214 SER CB C 214 63.928 62.443 1.485 1 1 2409 . 1 1 1 A 214 214 SER N N 214 113.729 113.823 -0.094 1 1 2410 . 1 1 1 A 215 215 SER H H 215 8.255 8.426 -0.171 1 1 2411 . 1 1 1 A 215 215 SER HA H 215 4.547 5.289 -0.742 1 1 2413 . 1 1 1 A 215 215 SER C C 215 175.289 173.516 1.773 1 1 2414 . 1 1 1 A 215 215 SER CA C 215 58.833 57.483 1.350 1 1 2415 . 1 1 1 A 215 215 SER CB C 215 63.847 65.027 -1.180 1 1 2416 . 1 1 1 A 215 215 SER N N 215 117.674 120.324 -2.650 1 1 2417 . 1 1 1 A 216 216 GLY H H 216 8.431 9.294 -0.863 1 1 2418 . 1 1 1 A 216 216 GLY HA2 H 216 4.054 4.430 -0.376 1 1 2419 . 1 1 1 A 216 216 GLY C C 216 174.189 171.993 2.196 1 1 2420 . 1 1 1 A 216 216 GLY CA C 216 45.412 44.048 1.364 1 1 2421 . 1 1 1 A 216 216 GLY N N 216 110.800 113.055 -2.255 1 1 2422 . 1 1 1 A 217 217 GLU H H 217 8.267 8.394 -0.127 1 1 2423 . 1 1 1 A 217 217 GLU HA H 217 4.345 4.624 -0.279 1 1 2427 . 1 1 1 A 217 217 GLU C C 217 176.428 175.795 0.633 1 1 2428 . 1 1 1 A 217 217 GLU CA C 217 56.470 56.378 0.092 1 1 2429 . 1 1 1 A 217 217 GLU CB C 217 30.526 30.234 0.292 1 1 2430 . 1 1 1 A 217 217 GLU N N 217 120.726 120.050 0.676 1 1 2431 . 1 1 1 A 218 218 ALA H H 218 8.476 8.519 -0.043 1 1 2432 . 1 1 1 A 218 218 ALA HA H 218 4.467 4.850 -0.383 1 1 2436 . 1 1 1 A 218 218 ALA C C 218 178.015 177.072 0.943 1 1 2437 . 1 1 1 A 218 218 ALA CA C 218 52.547 52.391 0.156 1 1 2438 . 1 1 1 A 218 218 ALA CB C 218 19.242 19.645 -0.403 1 1 2439 . 1 1 1 A 218 218 ALA N N 218 125.534 126.649 -1.115 1 1 2440 . 1 1 1 A 219 219 THR H H 219 8.232 9.064 -0.832 1 1 2441 . 1 1 1 A 219 219 THR HA H 219 4.411 4.486 -0.075 1 1 2446 . 1 1 1 A 219 219 THR C C 219 175.327 174.849 0.478 1 1 2447 . 1 1 1 A 219 219 THR CA C 219 61.889 62.499 -0.610 1 1 2448 . 1 1 1 A 219 219 THR CB C 219 69.939 68.760 1.179 1 1 2449 . 1 1 1 A 219 219 THR N N 219 113.242 115.442 -2.200 1 1 2450 . 1 1 1 A 220 220 GLY H H 220 8.418 7.658 0.760 1 1 2451 . 1 1 1 A 220 220 GLY C C 220 174.037 173.678 0.359 1 1 2452 . 1 1 1 A 220 220 GLY CA C 220 45.408 45.814 -0.406 1 1 2453 . 1 1 1 A 220 220 GLY N N 220 111.031 109.436 1.595 1 1 2454 . 1 1 1 A 221 221 ASP H H 221 8.345 8.484 -0.139 1 1 2455 . 1 1 1 A 221 221 ASP HA H 221 4.700 4.820 -0.120 1 1 2458 . 1 1 1 A 221 221 ASP C C 221 176.535 175.473 1.062 1 1 2459 . 1 1 1 A 221 221 ASP CA C 221 54.402 53.183 1.219 1 1 2460 . 1 1 1 A 221 221 ASP CB C 221 41.431 42.680 -1.249 1 1 2461 . 1 1 1 A 221 221 ASP N N 221 120.795 123.323 -2.528 1 1 2462 . 1 1 1 A 222 222 SER H H 222 8.353 7.822 0.531 1 1 2463 . 1 1 1 A 222 222 SER HA H 222 4.493 4.906 -0.413 1 1 2465 . 1 1 1 A 222 222 SER C C 222 174.224 173.986 0.238 1 1 2466 . 1 1 1 A 222 222 SER CA C 222 58.427 57.617 0.810 1 1 2467 . 1 1 1 A 222 222 SER CB C 222 63.860 65.226 -1.366 1 1 2468 . 1 1 1 A 222 222 SER N N 222 116.220 114.882 1.338 1 1 2469 . 1 1 1 A 223 223 ALA H H 223 8.381 9.016 -0.635 1 1 2470 . 1 1 1 A 223 223 ALA HA H 223 4.461 4.167 0.294 1 1 2474 . 1 1 1 A 223 223 ALA C C 223 176.926 179.398 -2.472 1 1 2475 . 1 1 1 A 223 223 ALA CA C 223 52.583 55.056 -2.473 1 1 2476 . 1 1 1 A 223 223 ALA CB C 223 19.438 19.047 0.391 1 1 2477 . 1 1 1 A 223 223 ALA N N 223 126.592 128.807 -2.215 1 1 1 . 2 1 1 A 2 2 ALA HA H 2 4.274 5.172 -0.898 1 1 5 . 2 1 1 A 2 2 ALA C C 2 177.828 176.727 1.101 1 1 6 . 2 1 1 A 2 2 ALA CA C 2 52.984 49.856 3.128 1 1 7 . 2 1 1 A 2 2 ALA CB C 2 19.138 21.843 -2.705 1 1 8 . 2 1 1 A 3 3 GLN H H 3 8.463 8.714 -0.251 1 1 9 . 2 1 1 A 3 3 GLN HA H 3 4.676 4.254 0.422 1 1 12 . 2 1 1 A 3 3 GLN C C 3 176.002 176.832 -0.830 1 1 13 . 2 1 1 A 3 3 GLN CA C 3 56.258 57.464 -1.206 1 1 14 . 2 1 1 A 3 3 GLN CB C 3 30.346 28.257 2.089 1 1 15 . 2 1 1 A 3 3 GLN N N 3 117.490 120.213 -2.723 1 1 16 . 2 1 1 A 4 4 GLY H H 4 8.099 9.154 -1.055 1 1 17 . 2 1 1 A 4 4 GLY HA2 H 4 3.910 3.975 -0.065 1 1 18 . 2 1 1 A 4 4 GLY C C 4 173.332 174.190 -0.858 1 1 19 . 2 1 1 A 4 4 GLY CA C 4 45.333 46.792 -1.459 1 1 20 . 2 1 1 A 4 4 GLY N N 4 109.423 112.345 -2.922 1 1 21 . 2 1 1 A 5 5 LEU H H 5 7.863 8.638 -0.775 1 1 22 . 2 1 1 A 5 5 LEU HA H 5 4.561 4.938 -0.377 1 1 32 . 2 1 1 A 5 5 LEU C C 5 176.448 175.872 0.576 1 1 33 . 2 1 1 A 5 5 LEU CA C 5 54.713 54.747 -0.034 1 1 34 . 2 1 1 A 5 5 LEU CB C 5 43.551 41.608 1.943 1 1 38 . 2 1 1 A 5 5 LEU N N 5 120.391 126.010 -5.619 1 1 39 . 2 1 1 A 6 6 ILE H H 6 8.764 9.487 -0.723 1 1 40 . 2 1 1 A 6 6 ILE HA H 6 4.087 4.221 -0.134 1 1 49 . 2 1 1 A 6 6 ILE C C 6 174.679 175.523 -0.844 1 1 50 . 2 1 1 A 6 6 ILE CA C 6 61.279 61.566 -0.287 1 1 51 . 2 1 1 A 6 6 ILE CB C 6 39.651 38.065 1.586 1 1 54 . 2 1 1 A 6 6 ILE N N 6 123.050 125.590 -2.540 1 1 55 . 2 1 1 A 7 7 GLU H H 7 8.587 8.672 -0.085 1 1 56 . 2 1 1 A 7 7 GLU HA H 7 4.917 4.732 0.185 1 1 61 . 2 1 1 A 7 7 GLU C C 7 175.978 176.158 -0.180 1 1 62 . 2 1 1 A 7 7 GLU CA C 7 56.127 56.212 -0.085 1 1 63 . 2 1 1 A 7 7 GLU CB C 7 31.115 30.442 0.673 1 1 65 . 2 1 1 A 7 7 GLU N N 7 127.415 127.976 -0.561 1 1 66 . 2 1 1 A 8 8 VAL H H 8 8.986 9.234 -0.248 1 1 67 . 2 1 1 A 8 8 VAL HA H 8 4.375 5.001 -0.626 1 1 72 . 2 1 1 A 8 8 VAL C C 8 173.704 175.273 -1.569 1 1 73 . 2 1 1 A 8 8 VAL CA C 8 61.347 60.643 0.704 1 1 74 . 2 1 1 A 8 8 VAL CB C 8 33.611 33.727 -0.116 1 1 76 . 2 1 1 A 8 8 VAL N N 8 126.071 119.393 6.678 1 1 77 . 2 1 1 A 9 9 GLU H H 9 8.521 8.988 -0.467 1 1 78 . 2 1 1 A 9 9 GLU HA H 9 5.837 5.559 0.278 1 1 81 . 2 1 1 A 9 9 GLU C C 9 175.939 174.512 1.427 1 1 82 . 2 1 1 A 9 9 GLU CA C 9 54.516 54.703 -0.187 1 1 83 . 2 1 1 A 9 9 GLU CB C 9 33.009 33.201 -0.192 1 1 84 . 2 1 1 A 9 9 GLU N N 9 122.857 124.622 -1.765 1 1 85 . 2 1 1 A 10 10 ARG H H 10 8.690 8.945 -0.255 1 1 86 . 2 1 1 A 10 10 ARG HA H 10 4.709 5.193 -0.484 1 1 94 . 2 1 1 A 10 10 ARG C C 10 174.826 173.581 1.245 1 1 95 . 2 1 1 A 10 10 ARG CA C 10 54.491 54.320 0.171 1 1 96 . 2 1 1 A 10 10 ARG CB C 10 35.777 34.207 1.570 1 1 98 . 2 1 1 A 10 10 ARG N N 10 120.430 121.173 -0.743 1 1 100 . 2 1 1 A 11 11 LYS H H 11 8.874 8.910 -0.036 1 1 101 . 2 1 1 A 11 11 LYS HA H 11 5.530 5.468 0.062 1 1 107 . 2 1 1 A 11 11 LYS C C 11 176.919 175.023 1.896 1 1 108 . 2 1 1 A 11 11 LYS CA C 11 55.084 54.691 0.393 1 1 109 . 2 1 1 A 11 11 LYS CB C 11 35.435 36.171 -0.736 1 1 113 . 2 1 1 A 11 11 LYS N N 11 121.087 126.632 -5.545 1 1 114 . 2 1 1 A 12 12 PHE H H 12 8.877 8.968 -0.091 1 1 115 . 2 1 1 A 12 12 PHE HA H 12 5.130 5.271 -0.141 1 1 120 . 2 1 1 A 12 12 PHE C C 12 171.676 172.143 -0.467 1 1 121 . 2 1 1 A 12 12 PHE CA C 12 55.869 55.931 -0.062 1 1 122 . 2 1 1 A 12 12 PHE CB C 12 42.108 41.994 0.114 1 1 125 . 2 1 1 A 12 12 PHE N N 12 117.486 120.546 -3.060 1 1 126 . 2 1 1 A 13 13 ALA H H 13 9.134 9.398 -0.264 1 1 127 . 2 1 1 A 13 13 ALA HA H 13 5.003 4.635 0.368 1 1 131 . 2 1 1 A 13 13 ALA CA C 13 48.340 48.748 -0.408 1 1 132 . 2 1 1 A 13 13 ALA CB C 13 19.191 20.281 -1.090 1 1 133 . 2 1 1 A 13 13 ALA N N 13 125.915 122.792 3.123 1 1 134 . 2 1 1 A 14 14 PRO HA H 14 4.620 4.796 -0.176 1 1 140 . 2 1 1 A 14 14 PRO C C 14 176.502 177.283 -0.781 1 1 141 . 2 1 1 A 14 14 PRO CA C 14 62.672 62.731 -0.059 1 1 142 . 2 1 1 A 14 14 PRO CB C 14 33.119 32.201 0.918 1 1 145 . 2 1 1 A 15 15 GLY H H 15 8.721 8.712 0.009 1 1 146 . 2 1 1 A 15 15 GLY HA2 H 15 3.999 4.081 -0.082 1 1 147 . 2 1 1 A 15 15 GLY HA3 H 15 4.632 4.083 0.549 1 1 148 . 2 1 1 A 15 15 GLY CA C 15 44.411 44.110 0.301 1 1 149 . 2 1 1 A 15 15 GLY N N 15 109.863 108.417 1.446 1 1 150 . 2 1 1 A 16 16 PRO HA H 16 4.447 4.356 0.091 1 1 155 . 2 1 1 A 16 16 PRO C C 16 177.053 176.555 0.498 1 1 156 . 2 1 1 A 16 16 PRO CA C 16 64.395 64.694 -0.299 1 1 157 . 2 1 1 A 16 16 PRO CB C 16 31.993 31.901 0.092 1 1 159 . 2 1 1 A 17 17 ASP H H 17 8.550 8.433 0.117 1 1 160 . 2 1 1 A 17 17 ASP HA H 17 4.950 4.821 0.129 1 1 163 . 2 1 1 A 17 17 ASP C C 17 176.800 176.599 0.201 1 1 164 . 2 1 1 A 17 17 ASP CA C 17 53.271 54.000 -0.729 1 1 165 . 2 1 1 A 17 17 ASP CB C 17 40.392 41.545 -1.153 1 1 166 . 2 1 1 A 17 17 ASP N N 17 116.060 118.204 -2.144 1 1 167 . 2 1 1 A 18 18 THR H H 18 7.664 7.462 0.202 1 1 168 . 2 1 1 A 18 18 THR HA H 18 4.120 3.730 0.390 1 1 174 . 2 1 1 A 18 18 THR C C 18 175.407 176.078 -0.671 1 1 175 . 2 1 1 A 18 18 THR CA C 18 68.718 67.240 1.478 1 1 176 . 2 1 1 A 18 18 THR CB C 18 69.179 68.416 0.763 1 1 178 . 2 1 1 A 18 18 THR N N 18 117.158 114.900 2.258 1 1 179 . 2 1 1 A 19 19 GLU H H 19 8.817 8.573 0.244 1 1 180 . 2 1 1 A 19 19 GLU HA H 19 3.510 3.326 0.184 1 1 184 . 2 1 1 A 19 19 GLU C C 19 178.345 179.346 -1.001 1 1 185 . 2 1 1 A 19 19 GLU CA C 19 61.237 59.640 1.597 1 1 186 . 2 1 1 A 19 19 GLU CB C 19 28.746 29.278 -0.532 1 1 188 . 2 1 1 A 19 19 GLU N N 19 118.802 118.821 -0.019 1 1 189 . 2 1 1 A 20 20 GLU H H 20 7.976 8.112 -0.136 1 1 190 . 2 1 1 A 20 20 GLU HA H 20 4.036 4.125 -0.089 1 1 194 . 2 1 1 A 20 20 GLU C C 20 179.451 179.241 0.210 1 1 195 . 2 1 1 A 20 20 GLU CA C 20 59.909 58.915 0.994 1 1 196 . 2 1 1 A 20 20 GLU CB C 20 28.992 29.334 -0.342 1 1 198 . 2 1 1 A 20 20 GLU N N 20 121.130 120.297 0.833 1 1 199 . 2 1 1 A 21 21 ARG H H 21 8.199 8.208 -0.009 1 1 200 . 2 1 1 A 21 21 ARG HA H 21 4.061 4.042 0.019 1 1 207 . 2 1 1 A 21 21 ARG C C 21 179.087 178.752 0.335 1 1 208 . 2 1 1 A 21 21 ARG CA C 21 58.477 58.818 -0.341 1 1 209 . 2 1 1 A 21 21 ARG CB C 21 30.101 29.792 0.309 1 1 211 . 2 1 1 A 21 21 ARG N N 21 119.897 120.217 -0.320 1 1 213 . 2 1 1 A 22 22 LEU H H 22 8.154 8.465 -0.311 1 1 214 . 2 1 1 A 22 22 LEU HA H 22 3.560 3.729 -0.169 1 1 224 . 2 1 1 A 22 22 LEU C C 22 178.461 179.285 -0.824 1 1 225 . 2 1 1 A 22 22 LEU CA C 22 58.432 57.607 0.825 1 1 226 . 2 1 1 A 22 22 LEU CB C 22 40.229 40.919 -0.690 1 1 230 . 2 1 1 A 22 22 LEU N N 22 120.012 119.737 0.275 1 1 231 . 2 1 1 A 23 23 GLN H H 23 7.621 7.783 -0.162 1 1 232 . 2 1 1 A 23 23 GLN HA H 23 4.232 4.047 0.185 1 1 238 . 2 1 1 A 23 23 GLN C C 23 180.543 178.825 1.718 1 1 239 . 2 1 1 A 23 23 GLN CA C 23 59.434 59.254 0.180 1 1 240 . 2 1 1 A 23 23 GLN CB C 23 28.749 28.439 0.310 1 1 242 . 2 1 1 A 23 23 GLN N N 23 117.823 117.971 -0.148 1 1 244 . 2 1 1 A 24 24 GLU H H 24 8.165 7.725 0.440 1 1 245 . 2 1 1 A 24 24 GLU HA H 24 4.072 4.071 0.001 1 1 249 . 2 1 1 A 24 24 GLU C C 24 178.612 179.372 -0.760 1 1 250 . 2 1 1 A 24 24 GLU CA C 24 59.236 59.209 0.027 1 1 251 . 2 1 1 A 24 24 GLU CB C 24 29.606 29.253 0.353 1 1 253 . 2 1 1 A 24 24 GLU N N 24 122.589 119.987 2.602 1 1 254 . 2 1 1 A 25 25 LEU H H 25 7.911 7.868 0.043 1 1 255 . 2 1 1 A 25 25 LEU HA H 25 4.214 4.086 0.128 1 1 265 . 2 1 1 A 25 25 LEU C C 25 176.745 177.183 -0.438 1 1 266 . 2 1 1 A 25 25 LEU CA C 25 55.659 55.900 -0.241 1 1 267 . 2 1 1 A 25 25 LEU CB C 25 43.109 42.914 0.195 1 1 271 . 2 1 1 A 25 25 LEU N N 25 117.882 117.803 0.079 1 1 272 . 2 1 1 A 26 26 GLY H H 26 7.776 7.948 -0.172 1 1 273 . 2 1 1 A 26 26 GLY HA2 H 26 4.337 4.037 0.300 1 1 274 . 2 1 1 A 26 26 GLY HA3 H 26 3.856 4.050 -0.194 1 1 275 . 2 1 1 A 26 26 GLY C C 26 175.456 174.554 0.902 1 1 276 . 2 1 1 A 26 26 GLY CA C 26 44.875 45.073 -0.198 1 1 277 . 2 1 1 A 26 26 GLY N N 26 104.938 105.746 -0.808 1 1 278 . 2 1 1 A 27 27 ALA H H 27 8.104 8.486 -0.382 1 1 279 . 2 1 1 A 27 27 ALA HA H 27 4.949 4.681 0.268 1 1 283 . 2 1 1 A 27 27 ALA C C 27 176.448 176.899 -0.451 1 1 284 . 2 1 1 A 27 27 ALA CA C 27 52.183 52.336 -0.153 1 1 285 . 2 1 1 A 27 27 ALA CB C 27 21.814 20.084 1.730 1 1 286 . 2 1 1 A 27 27 ALA N N 27 123.263 124.381 -1.118 1 1 287 . 2 1 1 A 28 28 THR H H 28 9.369 9.221 0.148 1 1 288 . 2 1 1 A 28 28 THR HA H 28 4.779 4.889 -0.110 1 1 293 . 2 1 1 A 28 28 THR C C 28 173.725 173.689 0.036 1 1 294 . 2 1 1 A 28 28 THR CA C 28 60.046 60.775 -0.729 1 1 295 . 2 1 1 A 28 28 THR CB C 28 70.592 70.534 0.058 1 1 297 . 2 1 1 A 28 28 THR N N 28 112.201 117.243 -5.042 1 1 298 . 2 1 1 A 29 29 LEU H H 29 8.518 8.590 -0.072 1 1 299 . 2 1 1 A 29 29 LEU HA H 29 3.332 3.944 -0.612 1 1 309 . 2 1 1 A 29 29 LEU C C 29 176.202 175.665 0.537 1 1 310 . 2 1 1 A 29 29 LEU CA C 29 55.031 54.734 0.297 1 1 311 . 2 1 1 A 29 29 LEU CB C 29 40.624 41.859 -1.235 1 1 315 . 2 1 1 A 29 29 LEU N N 29 128.151 129.448 -1.297 1 1 316 . 2 1 1 A 30 30 GLU H H 30 9.269 9.290 -0.021 1 1 317 . 2 1 1 A 30 30 GLU HA H 30 4.287 4.249 0.038 1 1 321 . 2 1 1 A 30 30 GLU C C 30 176.740 176.105 0.635 1 1 322 . 2 1 1 A 30 30 GLU CA C 30 57.283 58.325 -1.042 1 1 323 . 2 1 1 A 30 30 GLU CB C 30 31.045 30.736 0.309 1 1 325 . 2 1 1 A 30 30 GLU N N 30 130.123 125.546 4.577 1 1 326 . 2 1 1 A 31 31 HIS H H 31 7.341 7.420 -0.079 1 1 327 . 2 1 1 A 31 31 HIS HA H 31 4.701 5.159 -0.458 1 1 331 . 2 1 1 A 31 31 HIS C C 31 172.581 173.453 -0.872 1 1 332 . 2 1 1 A 31 31 HIS CA C 31 55.876 54.614 1.262 1 1 333 . 2 1 1 A 31 31 HIS CB C 31 33.434 33.702 -0.268 1 1 334 . 2 1 1 A 31 31 HIS N N 31 113.223 114.159 -0.936 1 1 335 . 2 1 1 A 32 32 ARG H H 32 8.196 8.720 -0.524 1 1 336 . 2 1 1 A 32 32 ARG HA H 32 5.262 4.997 0.265 1 1 341 . 2 1 1 A 32 32 ARG C C 32 174.377 174.679 -0.302 1 1 342 . 2 1 1 A 32 32 ARG CA C 32 55.808 54.803 1.005 1 1 343 . 2 1 1 A 32 32 ARG CB C 32 33.340 33.163 0.177 1 1 345 . 2 1 1 A 32 32 ARG N N 32 123.003 122.241 0.762 1 1 346 . 2 1 1 A 33 33 VAL H H 33 8.956 9.593 -0.637 1 1 347 . 2 1 1 A 33 33 VAL HA H 33 4.734 4.960 -0.226 1 1 355 . 2 1 1 A 33 33 VAL C C 33 172.821 175.482 -2.661 1 1 356 . 2 1 1 A 33 33 VAL CA C 33 60.197 61.272 -1.075 1 1 357 . 2 1 1 A 33 33 VAL CB C 33 35.860 34.064 1.796 1 1 360 . 2 1 1 A 33 33 VAL N N 33 122.929 127.275 -4.346 1 1 361 . 2 1 1 A 34 34 THR H H 34 8.250 8.909 -0.659 1 1 362 . 2 1 1 A 34 34 THR HA H 34 5.616 5.749 -0.133 1 1 367 . 2 1 1 A 34 34 THR C C 34 173.913 173.499 0.414 1 1 368 . 2 1 1 A 34 34 THR CA C 34 60.245 60.658 -0.413 1 1 369 . 2 1 1 A 34 34 THR CB C 34 71.706 71.311 0.395 1 1 371 . 2 1 1 A 34 34 THR N N 34 119.164 118.368 0.796 1 1 372 . 2 1 1 A 35 35 PHE H H 35 8.565 8.600 -0.035 1 1 373 . 2 1 1 A 35 35 PHE HA H 35 5.029 5.122 -0.093 1 1 378 . 2 1 1 A 35 35 PHE C C 35 173.193 172.822 0.371 1 1 379 . 2 1 1 A 35 35 PHE CA C 35 55.687 56.075 -0.388 1 1 380 . 2 1 1 A 35 35 PHE CB C 35 40.853 41.107 -0.254 1 1 383 . 2 1 1 A 35 35 PHE N N 35 120.244 118.458 1.786 1 1 384 . 2 1 1 A 36 36 ARG H H 36 8.869 8.903 -0.034 1 1 385 . 2 1 1 A 36 36 ARG HA H 36 4.982 5.011 -0.029 1 1 387 . 2 1 1 A 36 36 ARG C C 36 174.743 174.489 0.254 1 1 388 . 2 1 1 A 36 36 ARG CA C 36 55.493 54.508 0.985 1 1 389 . 2 1 1 A 36 36 ARG CB C 36 32.228 33.716 -1.488 1 1 390 . 2 1 1 A 36 36 ARG N N 36 123.893 118.874 5.019 1 1 391 . 2 1 1 A 37 37 ASP H H 37 8.402 9.514 -1.112 1 1 392 . 2 1 1 A 37 37 ASP HA H 37 5.462 5.674 -0.212 1 1 395 . 2 1 1 A 37 37 ASP C C 37 175.177 175.250 -0.073 1 1 396 . 2 1 1 A 37 37 ASP CA C 37 53.942 52.806 1.136 1 1 397 . 2 1 1 A 37 37 ASP CB C 37 45.486 43.301 2.185 1 1 398 . 2 1 1 A 37 37 ASP N N 37 127.149 124.310 2.839 1 1 399 . 2 1 1 A 38 38 THR H H 38 8.151 9.029 -0.878 1 1 400 . 2 1 1 A 38 38 THR HA H 38 4.866 5.263 -0.397 1 1 405 . 2 1 1 A 38 38 THR C C 38 172.792 172.674 0.118 1 1 406 . 2 1 1 A 38 38 THR CA C 38 61.416 60.707 0.709 1 1 407 . 2 1 1 A 38 38 THR CB C 38 71.047 70.803 0.244 1 1 409 . 2 1 1 A 38 38 THR N N 38 115.686 115.624 0.062 1 1 410 . 2 1 1 A 39 39 TYR H H 39 9.021 9.412 -0.391 1 1 411 . 2 1 1 A 39 39 TYR HA H 39 5.544 5.842 -0.298 1 1 416 . 2 1 1 A 39 39 TYR C C 39 176.032 174.448 1.584 1 1 417 . 2 1 1 A 39 39 TYR CA C 39 57.184 56.005 1.179 1 1 418 . 2 1 1 A 39 39 TYR CB C 39 41.642 40.326 1.316 1 1 420 . 2 1 1 A 39 39 TYR N N 39 124.579 124.817 -0.238 1 1 421 . 2 1 1 A 40 40 TYR H H 40 8.487 9.021 -0.534 1 1 422 . 2 1 1 A 40 40 TYR HA H 40 5.517 5.919 -0.402 1 1 426 . 2 1 1 A 40 40 TYR C C 40 174.108 174.693 -0.585 1 1 427 . 2 1 1 A 40 40 TYR CA C 40 56.979 56.843 0.136 1 1 428 . 2 1 1 A 40 40 TYR CB C 40 44.132 41.933 2.199 1 1 431 . 2 1 1 A 40 40 TYR N N 40 119.709 122.752 -3.043 1 1 432 . 2 1 1 A 41 41 ASP H H 41 9.341 8.767 0.574 1 1 433 . 2 1 1 A 41 41 ASP HA H 41 4.866 5.140 -0.274 1 1 436 . 2 1 1 A 41 41 ASP C C 41 177.262 174.709 2.553 1 1 437 . 2 1 1 A 41 41 ASP CA C 41 53.445 53.427 0.018 1 1 438 . 2 1 1 A 41 41 ASP CB C 41 45.347 44.678 0.669 1 1 439 . 2 1 1 A 41 41 ASP N N 41 117.995 120.975 -2.980 1 1 440 . 2 1 1 A 42 42 THR H H 42 11.574 8.667 2.907 1 1 441 . 2 1 1 A 42 42 THR HA H 42 5.206 4.523 0.683 1 1 446 . 2 1 1 A 42 42 THR C C 42 177.935 176.320 1.615 1 1 447 . 2 1 1 A 42 42 THR CA C 42 60.400 61.177 -0.777 1 1 448 . 2 1 1 A 42 42 THR CB C 42 72.114 70.911 1.203 1 1 450 . 2 1 1 A 42 42 THR N N 42 114.394 114.667 -0.273 1 1 451 . 2 1 1 A 43 43 SER H H 43 9.715 8.869 0.846 1 1 452 . 2 1 1 A 43 43 SER HA H 43 4.252 4.252 0.000 1 1 455 . 2 1 1 A 43 43 SER C C 43 175.478 175.109 0.369 1 1 456 . 2 1 1 A 43 43 SER CA C 43 61.277 60.584 0.693 1 1 457 . 2 1 1 A 43 43 SER CB C 43 62.821 62.995 -0.174 1 1 458 . 2 1 1 A 43 43 SER N N 43 116.674 115.934 0.740 1 1 459 . 2 1 1 A 44 44 GLU H H 44 7.674 7.599 0.075 1 1 460 . 2 1 1 A 44 44 GLU HA H 44 4.330 4.451 -0.121 1 1 464 . 2 1 1 A 44 44 GLU C C 44 175.001 175.585 -0.584 1 1 465 . 2 1 1 A 44 44 GLU CA C 44 55.992 55.502 0.490 1 1 466 . 2 1 1 A 44 44 GLU CB C 44 29.276 30.902 -1.626 1 1 468 . 2 1 1 A 44 44 GLU N N 44 117.856 118.715 -0.859 1 1 469 . 2 1 1 A 45 45 LEU H H 45 8.222 7.719 0.503 1 1 470 . 2 1 1 A 45 45 LEU HA H 45 3.901 3.991 -0.090 1 1 480 . 2 1 1 A 45 45 LEU C C 45 175.209 176.493 -1.284 1 1 481 . 2 1 1 A 45 45 LEU CA C 45 55.548 56.204 -0.656 1 1 482 . 2 1 1 A 45 45 LEU CB C 45 38.458 39.540 -1.082 1 1 485 . 2 1 1 A 45 45 LEU N N 45 119.335 117.591 1.744 1 1 486 . 2 1 1 A 46 46 SER H H 46 7.347 7.967 -0.620 1 1 487 . 2 1 1 A 46 46 SER HA H 46 3.954 4.225 -0.271 1 1 489 . 2 1 1 A 46 46 SER C C 46 177.497 176.943 0.554 1 1 490 . 2 1 1 A 46 46 SER CA C 46 62.471 61.131 1.340 1 1 491 . 2 1 1 A 46 46 SER CB C 46 63.908 62.967 0.941 1 1 492 . 2 1 1 A 46 46 SER N N 46 111.433 114.089 -2.656 1 1 493 . 2 1 1 A 47 47 LEU H H 47 12.003 8.395 3.608 1 1 494 . 2 1 1 A 47 47 LEU HA H 47 3.959 4.142 -0.183 1 1 504 . 2 1 1 A 47 47 LEU C C 47 180.340 178.519 1.821 1 1 505 . 2 1 1 A 47 47 LEU CA C 47 58.879 57.941 0.938 1 1 506 . 2 1 1 A 47 47 LEU CB C 47 39.572 41.633 -2.061 1 1 510 . 2 1 1 A 47 47 LEU N N 47 124.605 123.109 1.496 1 1 511 . 2 1 1 A 48 48 MET H H 48 10.599 8.754 1.845 1 1 512 . 2 1 1 A 48 48 MET HA H 48 3.213 3.229 -0.016 1 1 520 . 2 1 1 A 48 48 MET C C 48 181.177 178.391 2.786 1 1 521 . 2 1 1 A 48 48 MET CA C 48 60.747 58.473 2.274 1 1 522 . 2 1 1 A 48 48 MET CB C 48 32.594 32.402 0.192 1 1 525 . 2 1 1 A 48 48 MET N N 48 126.254 117.010 9.244 1 1 526 . 2 1 1 A 49 49 LEU H H 49 8.731 7.741 0.990 1 1 527 . 2 1 1 A 49 49 LEU HA H 49 4.097 4.176 -0.079 1 1 536 . 2 1 1 A 49 49 LEU C C 49 178.144 177.452 0.692 1 1 537 . 2 1 1 A 49 49 LEU CA C 49 57.800 56.591 1.209 1 1 538 . 2 1 1 A 49 49 LEU CB C 49 41.379 41.597 -0.218 1 1 541 . 2 1 1 A 49 49 LEU N N 49 119.183 119.936 -0.753 1 1 542 . 2 1 1 A 50 50 SER H H 50 7.853 7.609 0.244 1 1 543 . 2 1 1 A 50 50 SER HA H 50 4.822 4.633 0.189 1 1 546 . 2 1 1 A 50 50 SER C C 50 174.539 173.676 0.863 1 1 547 . 2 1 1 A 50 50 SER CA C 50 57.811 58.047 -0.236 1 1 548 . 2 1 1 A 50 50 SER CB C 50 64.443 63.369 1.074 1 1 549 . 2 1 1 A 50 50 SER N N 50 114.594 113.768 0.826 1 1 550 . 2 1 1 A 51 51 ASP H H 51 8.264 8.096 0.168 1 1 551 . 2 1 1 A 51 51 ASP HA H 51 4.362 4.315 0.047 1 1 554 . 2 1 1 A 51 51 ASP C C 51 172.921 174.723 -1.802 1 1 555 . 2 1 1 A 51 51 ASP CA C 51 55.343 55.579 -0.236 1 1 556 . 2 1 1 A 51 51 ASP CB C 51 40.583 39.343 1.240 1 1 557 . 2 1 1 A 51 51 ASP N N 51 123.003 118.831 4.172 1 1 558 . 2 1 1 A 52 52 HIS H H 52 7.869 7.589 0.280 1 1 559 . 2 1 1 A 52 52 HIS HA H 52 5.335 5.525 -0.190 1 1 564 . 2 1 1 A 52 52 HIS C C 52 173.991 173.613 0.378 1 1 565 . 2 1 1 A 52 52 HIS CA C 52 55.889 54.141 1.748 1 1 566 . 2 1 1 A 52 52 HIS CB C 52 31.789 30.457 1.332 1 1 568 . 2 1 1 A 52 52 HIS N N 52 112.486 117.185 -4.699 1 1 569 . 2 1 1 A 53 53 TRP H H 53 8.165 8.983 -0.818 1 1 570 . 2 1 1 A 53 53 TRP HA H 53 4.926 5.352 -0.426 1 1 578 . 2 1 1 A 53 53 TRP C C 53 175.354 175.210 0.144 1 1 579 . 2 1 1 A 53 53 TRP CA C 53 55.364 55.676 -0.312 1 1 580 . 2 1 1 A 53 53 TRP CB C 53 30.641 31.675 -1.034 1 1 585 . 2 1 1 A 53 53 TRP N N 53 117.916 125.231 -7.315 1 1 587 . 2 1 1 A 54 54 LEU H H 54 10.088 8.876 1.212 1 1 588 . 2 1 1 A 54 54 LEU HA H 54 5.497 5.371 0.126 1 1 598 . 2 1 1 A 54 54 LEU C C 54 173.337 174.359 -1.022 1 1 599 . 2 1 1 A 54 54 LEU CA C 54 54.408 53.453 0.955 1 1 600 . 2 1 1 A 54 54 LEU CB C 54 44.156 45.684 -1.528 1 1 604 . 2 1 1 A 54 54 LEU N N 54 130.826 125.321 5.505 1 1 605 . 2 1 1 A 55 55 ARG H H 55 9.289 9.451 -0.162 1 1 606 . 2 1 1 A 55 55 ARG HA H 55 5.482 5.153 0.329 1 1 612 . 2 1 1 A 55 55 ARG C C 55 174.057 173.923 0.134 1 1 613 . 2 1 1 A 55 55 ARG CA C 55 53.167 54.468 -1.301 1 1 614 . 2 1 1 A 55 55 ARG CB C 55 34.270 33.625 0.645 1 1 616 . 2 1 1 A 55 55 ARG N N 55 125.089 127.356 -2.267 1 1 618 . 2 1 1 A 56 56 GLN H H 56 9.092 9.198 -0.106 1 1 619 . 2 1 1 A 56 56 GLN HA H 56 3.991 4.745 -0.754 1 1 626 . 2 1 1 A 56 56 GLN C C 56 174.199 174.940 -0.741 1 1 627 . 2 1 1 A 56 56 GLN CA C 56 54.566 54.099 0.467 1 1 628 . 2 1 1 A 56 56 GLN CB C 56 29.643 30.717 -1.074 1 1 630 . 2 1 1 A 56 56 GLN N N 56 124.355 127.725 -3.370 1 1 632 . 2 1 1 A 57 57 ARG H H 57 8.440 8.103 0.337 1 1 633 . 2 1 1 A 57 57 ARG HA H 57 5.316 5.045 0.271 1 1 639 . 2 1 1 A 57 57 ARG C C 57 176.188 176.630 -0.442 1 1 640 . 2 1 1 A 57 57 ARG CA C 57 53.940 55.762 -1.822 1 1 641 . 2 1 1 A 57 57 ARG CB C 57 32.426 30.440 1.986 1 1 643 . 2 1 1 A 57 57 ARG N N 57 130.222 125.700 4.522 1 1 645 . 2 1 1 A 58 58 GLU H H 58 8.891 9.277 -0.386 1 1 646 . 2 1 1 A 58 58 GLU HA H 58 3.996 4.224 -0.228 1 1 649 . 2 1 1 A 58 58 GLU CA C 58 58.364 58.562 -0.198 1 1 650 . 2 1 1 A 58 58 GLU CB C 58 30.875 29.188 1.687 1 1 651 . 2 1 1 A 58 58 GLU N N 58 131.208 122.475 8.733 1 1 652 . 2 1 1 A 59 59 GLY H H 59 8.367 7.940 0.427 1 1 653 . 2 1 1 A 59 59 GLY HA2 H 59 4.334 3.982 0.352 1 1 654 . 2 1 1 A 59 59 GLY HA3 H 59 3.743 4.063 -0.320 1 1 655 . 2 1 1 A 59 59 GLY C C 59 174.194 175.375 -1.181 1 1 656 . 2 1 1 A 59 59 GLY CA C 59 45.666 45.531 0.135 1 1 657 . 2 1 1 A 60 60 SER H H 60 8.071 8.467 -0.396 1 1 658 . 2 1 1 A 60 60 SER HA H 60 4.730 4.392 0.338 1 1 661 . 2 1 1 A 60 60 SER C C 60 173.908 174.486 -0.578 1 1 662 . 2 1 1 A 60 60 SER CA C 60 58.762 59.090 -0.328 1 1 663 . 2 1 1 A 60 60 SER CB C 60 64.497 64.205 0.292 1 1 664 . 2 1 1 A 60 60 SER N N 60 114.636 115.707 -1.071 1 1 665 . 2 1 1 A 61 61 GLY H H 61 8.401 7.355 1.046 1 1 666 . 2 1 1 A 61 61 GLY HA2 H 61 4.560 3.967 0.593 1 1 667 . 2 1 1 A 61 61 GLY HA3 H 61 3.878 3.987 -0.109 1 1 668 . 2 1 1 A 61 61 GLY C C 61 173.526 171.820 1.706 1 1 669 . 2 1 1 A 61 61 GLY CA C 61 44.906 45.708 -0.802 1 1 670 . 2 1 1 A 61 61 GLY N N 61 109.421 106.810 2.611 1 1 671 . 2 1 1 A 62 62 TRP H H 62 8.861 8.554 0.307 1 1 672 . 2 1 1 A 62 62 TRP HA H 62 5.089 5.014 0.075 1 1 681 . 2 1 1 A 62 62 TRP C C 62 176.168 176.164 0.004 1 1 682 . 2 1 1 A 62 62 TRP CA C 62 57.459 57.465 -0.006 1 1 683 . 2 1 1 A 62 62 TRP CB C 62 32.536 31.001 1.535 1 1 689 . 2 1 1 A 62 62 TRP N N 62 122.939 121.414 1.525 1 1 691 . 2 1 1 A 63 63 GLU H H 63 9.306 9.256 0.050 1 1 692 . 2 1 1 A 63 63 GLU HA H 63 4.919 5.310 -0.391 1 1 697 . 2 1 1 A 63 63 GLU C C 63 173.770 174.894 -1.124 1 1 698 . 2 1 1 A 63 63 GLU CA C 63 55.953 55.103 0.850 1 1 699 . 2 1 1 A 63 63 GLU CB C 63 35.317 33.070 2.247 1 1 701 . 2 1 1 A 63 63 GLU N N 63 120.136 121.885 -1.749 1 1 702 . 2 1 1 A 64 64 LEU H H 64 8.998 9.456 -0.458 1 1 703 . 2 1 1 A 64 64 LEU HA H 64 5.616 5.496 0.120 1 1 712 . 2 1 1 A 64 64 LEU C C 64 175.014 173.817 1.197 1 1 713 . 2 1 1 A 64 64 LEU CA C 64 52.945 53.710 -0.765 1 1 714 . 2 1 1 A 64 64 LEU CB C 64 46.904 46.098 0.806 1 1 717 . 2 1 1 A 64 64 LEU N N 64 127.321 126.605 0.716 1 1 718 . 2 1 1 A 65 65 LYS H H 65 9.322 10.063 -0.741 1 1 719 . 2 1 1 A 65 65 LYS HA H 65 5.347 5.376 -0.029 1 1 727 . 2 1 1 A 65 65 LYS C C 65 175.811 175.804 0.007 1 1 728 . 2 1 1 A 65 65 LYS CA C 65 55.817 55.334 0.483 1 1 729 . 2 1 1 A 65 65 LYS CB C 65 34.521 34.422 0.099 1 1 733 . 2 1 1 A 65 65 LYS N N 65 129.874 128.373 1.501 1 1 734 . 2 1 1 A 66 66 CYS H H 66 9.129 8.905 0.224 1 1 735 . 2 1 1 A 66 66 CYS HA H 66 5.319 5.127 0.192 1 1 738 . 2 1 1 A 66 66 CYS CA C 66 54.532 56.370 -1.838 1 1 739 . 2 1 1 A 66 66 CYS CB C 66 28.813 30.474 -1.661 1 1 740 . 2 1 1 A 66 66 CYS N N 66 121.497 125.691 -4.194 1 1 741 . 2 1 1 A 67 67 PRO HA H 67 4.439 4.666 -0.227 1 1 748 . 2 1 1 A 67 67 PRO C C 67 177.297 177.859 -0.562 1 1 749 . 2 1 1 A 67 67 PRO CA C 67 63.596 63.208 0.388 1 1 750 . 2 1 1 A 67 67 PRO CB C 67 32.242 31.431 0.811 1 1 752 . 2 1 1 A 68 68 GLY H H 68 8.316 8.207 0.109 1 1 753 . 2 1 1 A 68 68 GLY HA2 H 68 3.726 3.873 -0.147 1 1 754 . 2 1 1 A 68 68 GLY HA3 H 68 4.095 3.922 0.173 1 1 755 . 2 1 1 A 68 68 GLY C C 68 173.789 173.612 0.177 1 1 756 . 2 1 1 A 68 68 GLY CA C 68 45.227 45.521 -0.294 1 1 757 . 2 1 1 A 68 68 GLY N N 68 109.533 109.067 0.466 1 1 758 . 2 1 1 A 69 69 VAL H H 69 8.114 7.790 0.324 1 1 759 . 2 1 1 A 69 69 VAL HA H 69 4.266 4.428 -0.162 1 1 764 . 2 1 1 A 69 69 VAL C C 69 176.299 175.760 0.539 1 1 765 . 2 1 1 A 69 69 VAL CA C 69 61.945 61.201 0.744 1 1 766 . 2 1 1 A 69 69 VAL CB C 69 33.082 34.142 -1.060 1 1 768 . 2 1 1 A 69 69 VAL N N 69 118.540 121.869 -3.329 1 1 769 . 2 1 1 A 70 70 THR H H 70 8.324 8.827 -0.503 1 1 770 . 2 1 1 A 70 70 THR HA H 70 4.373 4.408 -0.035 1 1 775 . 2 1 1 A 70 70 THR C C 70 175.204 175.785 -0.581 1 1 776 . 2 1 1 A 70 70 THR CA C 70 62.309 64.402 -2.093 1 1 777 . 2 1 1 A 70 70 THR CB C 70 69.787 68.329 1.458 1 1 779 . 2 1 1 A 70 70 THR N N 70 117.636 119.631 -1.995 1 1 780 . 2 1 1 A 71 71 GLY H H 71 8.574 7.610 0.964 1 1 781 . 2 1 1 A 71 71 GLY HA2 H 71 4.096 4.130 -0.034 1 1 782 . 2 1 1 A 71 71 GLY HA3 H 71 3.975 4.191 -0.216 1 1 783 . 2 1 1 A 71 71 GLY C C 71 174.313 174.591 -0.278 1 1 784 . 2 1 1 A 71 71 GLY CA C 71 45.545 45.719 -0.174 1 1 785 . 2 1 1 A 71 71 GLY N N 71 111.677 108.005 3.672 1 1 786 . 2 1 1 A 72 72 VAL H H 72 7.945 7.563 0.382 1 1 787 . 2 1 1 A 72 72 VAL HA H 72 4.258 4.207 0.051 1 1 795 . 2 1 1 A 72 72 VAL C C 72 176.162 175.328 0.834 1 1 796 . 2 1 1 A 72 72 VAL CA C 72 62.227 61.812 0.415 1 1 797 . 2 1 1 A 72 72 VAL CB C 72 32.997 32.755 0.242 1 1 799 . 2 1 1 A 72 72 VAL N N 72 118.647 117.566 1.081 1 1 800 . 2 1 1 A 73 73 SER H H 73 8.498 8.061 0.437 1 1 801 . 2 1 1 A 73 73 SER HA H 73 4.617 4.215 0.402 1 1 803 . 2 1 1 A 73 73 SER C C 73 174.461 173.826 0.635 1 1 804 . 2 1 1 A 73 73 SER CA C 73 58.218 59.153 -0.935 1 1 805 . 2 1 1 A 73 73 SER CB C 73 64.061 61.731 2.330 1 1 806 . 2 1 1 A 73 73 SER N N 73 118.828 114.024 4.804 1 1 807 . 2 1 1 A 74 74 GLY H H 74 8.247 8.290 -0.043 1 1 808 . 2 1 1 A 74 74 GLY HA2 H 74 4.101 4.091 0.010 1 1 809 . 2 1 1 A 74 74 GLY HA3 H 74 4.304 4.095 0.209 1 1 810 . 2 1 1 A 74 74 GLY CA C 74 44.896 44.369 0.527 1 1 811 . 2 1 1 A 74 74 GLY N N 74 111.138 110.750 0.388 1 1 812 . 2 1 1 A 75 75 PRO HA H 75 4.461 4.587 -0.126 1 1 819 . 2 1 1 A 75 75 PRO C C 75 176.798 177.649 -0.851 1 1 820 . 2 1 1 A 75 75 PRO CA C 75 63.466 63.518 -0.052 1 1 821 . 2 1 1 A 75 75 PRO CB C 75 31.980 32.763 -0.783 1 1 824 . 2 1 1 A 76 76 HIS H H 76 8.397 8.026 0.371 1 1 825 . 2 1 1 A 76 76 HIS HA H 76 4.742 4.199 0.543 1 1 829 . 2 1 1 A 76 76 HIS C C 76 174.282 175.176 -0.894 1 1 830 . 2 1 1 A 76 76 HIS CA C 76 55.579 56.666 -1.087 1 1 831 . 2 1 1 A 76 76 HIS CB C 76 30.501 27.957 2.544 1 1 832 . 2 1 1 A 76 76 HIS N N 76 118.431 118.040 0.391 1 1 833 . 2 1 1 A 77 77 ASN H H 77 8.364 7.970 0.394 1 1 834 . 2 1 1 A 77 77 ASN HA H 77 4.767 4.761 0.006 1 1 839 . 2 1 1 A 77 77 ASN C C 77 174.576 174.709 -0.133 1 1 840 . 2 1 1 A 77 77 ASN CA C 77 53.139 51.304 1.835 1 1 841 . 2 1 1 A 77 77 ASN CB C 77 39.320 37.691 1.629 1 1 842 . 2 1 1 A 77 77 ASN N N 77 119.421 121.894 -2.473 1 1 844 . 2 1 1 A 78 78 GLU H H 78 8.683 7.978 0.705 1 1 845 . 2 1 1 A 78 78 GLU HA H 78 4.409 3.733 0.676 1 1 850 . 2 1 1 A 78 78 GLU C C 78 175.791 173.976 1.815 1 1 851 . 2 1 1 A 78 78 GLU CA C 78 56.359 58.144 -1.785 1 1 852 . 2 1 1 A 78 78 GLU CB C 78 30.818 28.074 2.744 1 1 854 . 2 1 1 A 78 78 GLU N N 78 122.085 123.861 -1.776 1 1 855 . 2 1 1 A 79 79 TYR H H 79 8.341 8.666 -0.325 1 1 856 . 2 1 1 A 79 79 TYR HA H 79 4.988 5.413 -0.425 1 1 861 . 2 1 1 A 79 79 TYR C C 79 175.837 174.777 1.060 1 1 862 . 2 1 1 A 79 79 TYR CA C 79 58.028 56.921 1.107 1 1 863 . 2 1 1 A 79 79 TYR CB C 79 41.672 42.481 -0.809 1 1 866 . 2 1 1 A 79 79 TYR N N 79 119.452 121.283 -1.831 1 1 867 . 2 1 1 A 80 80 VAL H H 80 9.366 9.758 -0.392 1 1 868 . 2 1 1 A 80 80 VAL HA H 80 4.370 5.003 -0.633 1 1 873 . 2 1 1 A 80 80 VAL C C 80 174.948 174.808 0.140 1 1 874 . 2 1 1 A 80 80 VAL CA C 80 61.190 60.697 0.493 1 1 875 . 2 1 1 A 80 80 VAL CB C 80 34.204 34.874 -0.670 1 1 877 . 2 1 1 A 80 80 VAL N N 80 120.567 122.170 -1.603 1 1 878 . 2 1 1 A 81 81 GLU H H 81 8.570 8.991 -0.421 1 1 879 . 2 1 1 A 81 81 GLU HA H 81 4.770 5.171 -0.401 1 1 883 . 2 1 1 A 81 81 GLU C C 81 175.491 175.403 0.088 1 1 884 . 2 1 1 A 81 81 GLU CA C 81 55.655 55.186 0.469 1 1 885 . 2 1 1 A 81 81 GLU CB C 81 30.415 31.071 -0.656 1 1 887 . 2 1 1 A 81 81 GLU N N 81 124.248 125.882 -1.634 1 1 888 . 2 1 1 A 82 82 VAL H H 82 9.189 9.221 -0.032 1 1 889 . 2 1 1 A 82 82 VAL HA H 82 4.279 4.152 0.127 1 1 894 . 2 1 1 A 82 82 VAL C C 82 176.087 176.640 -0.553 1 1 895 . 2 1 1 A 82 82 VAL CA C 82 62.672 63.125 -0.453 1 1 896 . 2 1 1 A 82 82 VAL CB C 82 33.121 31.328 1.793 1 1 898 . 2 1 1 A 82 82 VAL N N 82 127.776 126.364 1.412 1 1 899 . 2 1 1 A 83 83 THR H H 83 8.590 8.735 -0.145 1 1 900 . 2 1 1 A 83 83 THR HA H 83 4.955 4.625 0.330 1 1 905 . 2 1 1 A 83 83 THR C C 83 174.688 174.701 -0.013 1 1 906 . 2 1 1 A 83 83 THR CA C 83 61.332 61.538 -0.206 1 1 907 . 2 1 1 A 83 83 THR CB C 83 70.213 70.161 0.052 1 1 909 . 2 1 1 A 83 83 THR N N 83 114.744 118.608 -3.864 1 1 910 . 2 1 1 A 84 84 SER H H 84 7.650 7.411 0.239 1 1 911 . 2 1 1 A 84 84 SER HA H 84 4.819 4.423 0.396 1 1 914 . 2 1 1 A 84 84 SER CA C 84 56.280 59.678 -3.398 1 1 915 . 2 1 1 A 84 84 SER CB C 84 63.294 63.437 -0.143 1 1 916 . 2 1 1 A 84 84 SER N N 84 118.038 118.175 -0.137 1 1 917 . 2 1 1 A 85 85 GLU H H 85 8.391 8.679 -0.288 1 1 918 . 2 1 1 A 85 85 GLU HA H 85 3.661 3.928 -0.267 1 1 923 . 2 1 1 A 85 85 GLU C C 85 177.520 178.281 -0.761 1 1 924 . 2 1 1 A 85 85 GLU CA C 85 62.429 59.619 2.810 1 1 925 . 2 1 1 A 85 85 GLU CB C 85 29.655 29.413 0.242 1 1 927 . 2 1 1 A 86 86 ALA H H 86 8.443 8.044 0.399 1 1 928 . 2 1 1 A 86 86 ALA HA H 86 4.027 3.998 0.029 1 1 932 . 2 1 1 A 86 86 ALA C C 86 180.423 180.101 0.322 1 1 933 . 2 1 1 A 86 86 ALA CA C 86 55.145 54.741 0.404 1 1 934 . 2 1 1 A 86 86 ALA CB C 86 18.165 18.133 0.032 1 1 935 . 2 1 1 A 86 86 ALA N N 86 119.636 122.653 -3.017 1 1 936 . 2 1 1 A 87 87 ALA H H 87 7.214 7.498 -0.284 1 1 937 . 2 1 1 A 87 87 ALA HA H 87 4.244 4.028 0.216 1 1 941 . 2 1 1 A 87 87 ALA C C 87 180.354 180.180 0.174 1 1 942 . 2 1 1 A 87 87 ALA CA C 87 54.378 54.852 -0.474 1 1 943 . 2 1 1 A 87 87 ALA CB C 87 18.795 18.452 0.343 1 1 944 . 2 1 1 A 87 87 ALA N N 87 121.004 120.157 0.847 1 1 945 . 2 1 1 A 88 88 ILE H H 88 8.471 7.611 0.860 1 1 946 . 2 1 1 A 88 88 ILE HA H 88 3.360 3.704 -0.344 1 1 954 . 2 1 1 A 88 88 ILE CA C 88 66.323 64.694 1.629 1 1 955 . 2 1 1 A 88 88 ILE CB C 88 37.808 37.869 -0.061 1 1 958 . 2 1 1 A 88 88 ILE N N 88 120.743 119.682 1.061 1 1 959 . 2 1 1 A 89 89 VAL H H 89 8.343 8.377 -0.034 1 1 960 . 2 1 1 A 89 89 VAL HA H 89 3.061 3.517 -0.456 1 1 968 . 2 1 1 A 89 89 VAL C C 89 176.708 177.921 -1.213 1 1 969 . 2 1 1 A 89 89 VAL CA C 89 67.833 66.541 1.292 1 1 970 . 2 1 1 A 89 89 VAL CB C 89 31.509 31.375 0.134 1 1 973 . 2 1 1 A 89 89 VAL N N 89 118.049 119.422 -1.373 1 1 974 . 2 1 1 A 90 90 ALA H H 90 7.516 7.898 -0.382 1 1 975 . 2 1 1 A 90 90 ALA HA H 90 3.987 3.903 0.084 1 1 979 . 2 1 1 A 90 90 ALA C C 90 180.744 179.273 1.471 1 1 980 . 2 1 1 A 90 90 ALA CA C 90 55.481 55.669 -0.188 1 1 981 . 2 1 1 A 90 90 ALA CB C 90 17.953 17.957 -0.004 1 1 982 . 2 1 1 A 90 90 ALA N N 90 118.935 122.191 -3.256 1 1 983 . 2 1 1 A 91 91 GLN H H 91 7.886 8.073 -0.187 1 1 984 . 2 1 1 A 91 91 GLN HA H 91 4.190 3.983 0.207 1 1 991 . 2 1 1 A 91 91 GLN C C 91 178.832 178.624 0.208 1 1 992 . 2 1 1 A 91 91 GLN CA C 91 58.519 58.861 -0.342 1 1 993 . 2 1 1 A 91 91 GLN CB C 91 28.091 28.068 0.023 1 1 995 . 2 1 1 A 91 91 GLN N N 91 117.846 118.020 -0.174 1 1 997 . 2 1 1 A 92 92 LEU H H 92 8.751 8.818 -0.067 1 1 998 . 2 1 1 A 92 92 LEU HA H 92 3.903 3.929 -0.026 1 1 1007 . 2 1 1 A 92 92 LEU C C 92 178.997 178.918 0.079 1 1 1008 . 2 1 1 A 92 92 LEU CA C 92 58.136 57.944 0.192 1 1 1009 . 2 1 1 A 92 92 LEU CB C 92 41.576 41.858 -0.282 1 1 1013 . 2 1 1 A 92 92 LEU N N 92 119.547 119.735 -0.188 1 1 1014 . 2 1 1 A 93 93 PHE H H 93 8.648 8.205 0.443 1 1 1015 . 2 1 1 A 93 93 PHE HA H 93 4.270 4.539 -0.269 1 1 1020 . 2 1 1 A 93 93 PHE C C 93 179.283 178.780 0.503 1 1 1021 . 2 1 1 A 93 93 PHE CA C 93 59.860 60.292 -0.432 1 1 1022 . 2 1 1 A 93 93 PHE CB C 93 37.765 38.408 -0.643 1 1 1025 . 2 1 1 A 93 93 PHE N N 93 118.041 118.304 -0.263 1 1 1026 . 2 1 1 A 94 94 GLU H H 94 7.739 8.502 -0.763 1 1 1027 . 2 1 1 A 94 94 GLU HA H 94 4.110 4.121 -0.011 1 1 1031 . 2 1 1 A 94 94 GLU C C 94 178.629 178.719 -0.090 1 1 1032 . 2 1 1 A 94 94 GLU CA C 94 59.359 59.330 0.029 1 1 1033 . 2 1 1 A 94 94 GLU CB C 94 29.589 28.833 0.756 1 1 1035 . 2 1 1 A 94 94 GLU N N 94 119.980 117.315 2.665 1 1 1036 . 2 1 1 A 95 95 LEU H H 95 7.999 8.113 -0.114 1 1 1037 . 2 1 1 A 95 95 LEU HA H 95 4.139 3.973 0.166 1 1 1047 . 2 1 1 A 95 95 LEU C C 95 178.965 179.146 -0.181 1 1 1048 . 2 1 1 A 95 95 LEU CA C 95 57.557 57.623 -0.066 1 1 1049 . 2 1 1 A 95 95 LEU CB C 95 43.443 41.652 1.791 1 1 1053 . 2 1 1 A 95 95 LEU N N 95 118.398 121.706 -3.308 1 1 1054 . 2 1 1 A 96 96 LEU H H 96 8.363 8.003 0.360 1 1 1055 . 2 1 1 A 96 96 LEU HA H 96 4.503 4.168 0.335 1 1 1061 . 2 1 1 A 96 96 LEU C C 96 177.932 177.101 0.831 1 1 1062 . 2 1 1 A 96 96 LEU CA C 96 54.700 55.443 -0.743 1 1 1063 . 2 1 1 A 96 96 LEU CB C 96 43.048 42.625 0.423 1 1 1065 . 2 1 1 A 96 96 LEU N N 96 114.720 116.860 -2.140 1 1 1066 . 2 1 1 A 97 97 GLY H H 97 7.810 7.570 0.240 1 1 1067 . 2 1 1 A 97 97 GLY HA2 H 97 3.963 3.919 0.044 1 1 1068 . 2 1 1 A 97 97 GLY C C 97 173.535 174.882 -1.347 1 1 1069 . 2 1 1 A 97 97 GLY CA C 97 45.667 46.441 -0.774 1 1 1070 . 2 1 1 A 97 97 GLY N N 97 109.511 108.053 1.458 1 1 1071 . 2 1 1 A 98 98 SER H H 98 8.131 8.289 -0.158 1 1 1072 . 2 1 1 A 98 98 SER HA H 98 4.225 4.038 0.187 1 1 1075 . 2 1 1 A 98 98 SER C C 98 174.974 174.997 -0.023 1 1 1076 . 2 1 1 A 98 98 SER CA C 98 57.960 61.490 -3.530 1 1 1077 . 2 1 1 A 98 98 SER CB C 98 63.997 62.659 1.338 1 1 1078 . 2 1 1 A 98 98 SER N N 98 113.405 114.599 -1.194 1 1 1079 . 2 1 1 A 99 99 GLY H H 99 8.052 7.918 0.134 1 1 1080 . 2 1 1 A 99 99 GLY HA2 H 99 3.998 3.887 0.111 1 1 1081 . 2 1 1 A 99 99 GLY HA3 H 99 3.778 3.947 -0.169 1 1 1082 . 2 1 1 A 99 99 GLY C C 99 174.033 174.012 0.021 1 1 1083 . 2 1 1 A 99 99 GLY CA C 99 45.123 46.943 -1.820 1 1 1084 . 2 1 1 A 99 99 GLY N N 99 111.534 108.413 3.121 1 1 1085 . 2 1 1 A 100 100 GLU H H 100 8.177 8.174 0.003 1 1 1086 . 2 1 1 A 100 100 GLU HA H 100 4.201 4.096 0.105 1 1 1091 . 2 1 1 A 100 100 GLU C C 100 175.830 176.045 -0.215 1 1 1092 . 2 1 1 A 100 100 GLU CA C 100 56.442 58.605 -2.163 1 1 1093 . 2 1 1 A 100 100 GLU CB C 100 30.428 28.248 2.180 1 1 1095 . 2 1 1 A 100 100 GLU N N 100 120.463 122.879 -2.416 1 1 1096 . 2 1 1 A 101 101 GLN H H 101 8.161 8.414 -0.253 1 1 1097 . 2 1 1 A 101 101 GLN HA H 101 4.098 4.872 -0.774 1 1 1103 . 2 1 1 A 101 101 GLN C C 101 175.412 174.763 0.649 1 1 1104 . 2 1 1 A 101 101 GLN CA C 101 55.632 55.018 0.614 1 1 1105 . 2 1 1 A 101 101 GLN CB C 101 29.569 29.146 0.423 1 1 1107 . 2 1 1 A 101 101 GLN N N 101 120.014 119.247 0.767 1 1 1109 . 2 1 1 A 102 102 LYS H H 102 8.235 8.465 -0.230 1 1 1110 . 2 1 1 A 102 102 LYS HA H 102 4.387 4.199 0.188 1 1 1117 . 2 1 1 A 102 102 LYS CA C 102 54.116 54.170 -0.054 1 1 1118 . 2 1 1 A 102 102 LYS CB C 102 32.478 33.161 -0.683 1 1 1122 . 2 1 1 A 102 102 LYS N N 102 123.399 126.604 -3.205 1 1 1123 . 2 1 1 A 103 103 PRO HA H 103 4.498 4.365 0.133 1 1 1129 . 2 1 1 A 103 103 PRO C C 103 175.473 176.975 -1.502 1 1 1130 . 2 1 1 A 103 103 PRO CA C 103 62.802 65.947 -3.145 1 1 1131 . 2 1 1 A 103 103 PRO CB C 103 32.124 31.409 0.715 1 1 1134 . 2 1 1 A 104 104 ALA H H 104 8.017 7.264 0.753 1 1 1135 . 2 1 1 A 104 104 ALA HA H 104 4.318 4.288 0.030 1 1 1139 . 2 1 1 A 104 104 ALA C C 104 176.717 176.931 -0.214 1 1 1140 . 2 1 1 A 104 104 ALA CA C 104 52.194 53.050 -0.856 1 1 1141 . 2 1 1 A 104 104 ALA CB C 104 20.113 20.764 -0.651 1 1 1142 . 2 1 1 A 104 104 ALA N N 104 122.093 117.430 4.663 1 1 1143 . 2 1 1 A 105 105 GLY H H 105 7.678 8.145 -0.467 1 1 1144 . 2 1 1 A 105 105 GLY HA2 H 105 3.851 4.005 -0.154 1 1 1145 . 2 1 1 A 105 105 GLY HA3 H 105 4.053 4.030 0.023 1 1 1146 . 2 1 1 A 105 105 GLY C C 105 172.990 174.742 -1.752 1 1 1147 . 2 1 1 A 105 105 GLY CA C 105 44.241 43.787 0.454 1 1 1148 . 2 1 1 A 105 105 GLY N N 105 105.234 106.526 -1.292 1 1 1149 . 2 1 1 A 106 106 VAL H H 106 8.409 8.553 -0.144 1 1 1150 . 2 1 1 A 106 106 VAL HA H 106 2.829 3.317 -0.488 1 1 1158 . 2 1 1 A 106 106 VAL C C 106 177.822 177.290 0.532 1 1 1159 . 2 1 1 A 106 106 VAL CA C 106 65.522 65.575 -0.053 1 1 1160 . 2 1 1 A 106 106 VAL CB C 106 30.701 30.759 -0.058 1 1 1163 . 2 1 1 A 106 106 VAL N N 106 119.215 119.642 -0.427 1 1 1164 . 2 1 1 A 107 107 ALA H H 107 8.707 8.454 0.253 1 1 1165 . 2 1 1 A 107 107 ALA HA H 107 3.730 3.865 -0.135 1 1 1169 . 2 1 1 A 107 107 ALA C C 107 179.661 180.179 -0.518 1 1 1170 . 2 1 1 A 107 107 ALA CA C 107 54.995 55.617 -0.622 1 1 1171 . 2 1 1 A 107 107 ALA CB C 107 17.705 17.880 -0.175 1 1 1172 . 2 1 1 A 107 107 ALA N N 107 118.672 122.208 -3.536 1 1 1173 . 2 1 1 A 108 108 ALA H H 108 7.388 7.741 -0.353 1 1 1174 . 2 1 1 A 108 108 ALA HA H 108 4.259 4.025 0.234 1 1 1178 . 2 1 1 A 108 108 ALA C C 108 179.318 179.478 -0.160 1 1 1179 . 2 1 1 A 108 108 ALA CA C 108 53.481 55.053 -1.572 1 1 1180 . 2 1 1 A 108 108 ALA CB C 108 19.367 18.486 0.881 1 1 1181 . 2 1 1 A 108 108 ALA N N 108 116.635 120.908 -4.273 1 1 1182 . 2 1 1 A 109 109 VAL H H 109 7.689 7.397 0.292 1 1 1183 . 2 1 1 A 109 109 VAL HA H 109 4.532 3.803 0.729 1 1 1191 . 2 1 1 A 109 109 VAL C C 109 176.055 177.992 -1.937 1 1 1192 . 2 1 1 A 109 109 VAL CA C 109 61.452 65.836 -4.384 1 1 1193 . 2 1 1 A 109 109 VAL CB C 109 32.728 31.437 1.291 1 1 1196 . 2 1 1 A 109 109 VAL N N 109 112.851 117.157 -4.306 1 1 1197 . 2 1 1 A 110 110 LEU H H 110 7.099 8.225 -1.126 1 1 1198 . 2 1 1 A 110 110 LEU HA H 110 3.723 3.785 -0.062 1 1 1208 . 2 1 1 A 110 110 LEU C C 110 179.040 178.785 0.255 1 1 1209 . 2 1 1 A 110 110 LEU CA C 110 58.825 57.855 0.970 1 1 1210 . 2 1 1 A 110 110 LEU CB C 110 41.242 41.704 -0.462 1 1 1214 . 2 1 1 A 110 110 LEU N N 110 119.829 124.890 -5.061 1 1 1215 . 2 1 1 A 111 111 GLY H H 111 8.435 7.946 0.489 1 1 1216 . 2 1 1 A 111 111 GLY HA2 H 111 3.970 3.825 0.145 1 1 1217 . 2 1 1 A 111 111 GLY HA3 H 111 3.885 3.831 0.054 1 1 1218 . 2 1 1 A 111 111 GLY C C 111 178.031 176.482 1.549 1 1 1219 . 2 1 1 A 111 111 GLY CA C 111 46.961 47.631 -0.670 1 1 1220 . 2 1 1 A 111 111 GLY N N 111 104.089 106.500 -2.411 1 1 1221 . 2 1 1 A 112 112 SER H H 112 8.343 7.852 0.491 1 1 1222 . 2 1 1 A 112 112 SER HA H 112 4.266 4.227 0.039 1 1 1224 . 2 1 1 A 112 112 SER C C 112 175.885 175.449 0.436 1 1 1225 . 2 1 1 A 112 112 SER CA C 112 61.304 62.478 -1.174 1 1 1226 . 2 1 1 A 112 112 SER CB C 112 62.901 63.171 -0.270 1 1 1227 . 2 1 1 A 112 112 SER N N 112 119.497 119.414 0.083 1 1 1228 . 2 1 1 A 113 113 LEU H H 113 7.667 8.099 -0.432 1 1 1229 . 2 1 1 A 113 113 LEU HA H 113 4.343 4.192 0.151 1 1 1238 . 2 1 1 A 113 113 LEU C C 113 174.760 175.850 -1.090 1 1 1239 . 2 1 1 A 113 113 LEU CA C 113 54.228 54.743 -0.515 1 1 1240 . 2 1 1 A 113 113 LEU CB C 113 41.467 42.020 -0.553 1 1 1244 . 2 1 1 A 113 113 LEU N N 113 118.843 117.902 0.941 1 1 1245 . 2 1 1 A 114 114 LYS H H 114 7.685 7.527 0.158 1 1 1246 . 2 1 1 A 114 114 LYS HA H 114 3.958 3.898 0.060 1 1 1250 . 2 1 1 A 114 114 LYS C C 114 177.557 175.769 1.788 1 1 1251 . 2 1 1 A 114 114 LYS CA C 114 56.935 57.300 -0.365 1 1 1252 . 2 1 1 A 114 114 LYS CB C 114 28.898 29.091 -0.193 1 1 1254 . 2 1 1 A 114 114 LYS N N 114 114.072 116.168 -2.096 1 1 1255 . 2 1 1 A 115 115 LEU H H 115 8.329 7.881 0.448 1 1 1256 . 2 1 1 A 115 115 LEU HA H 115 4.315 4.261 0.054 1 1 1265 . 2 1 1 A 115 115 LEU C C 115 175.988 176.720 -0.732 1 1 1266 . 2 1 1 A 115 115 LEU CA C 115 54.310 55.711 -1.401 1 1 1267 . 2 1 1 A 115 115 LEU CB C 115 44.163 42.114 2.049 1 1 1270 . 2 1 1 A 115 115 LEU N N 115 117.951 120.317 -2.366 1 1 1271 . 2 1 1 A 116 116 GLN H H 116 9.100 8.333 0.767 1 1 1272 . 2 1 1 A 116 116 GLN HA H 116 4.898 5.032 -0.134 1 1 1279 . 2 1 1 A 116 116 GLN CA C 116 53.467 54.960 -1.493 1 1 1280 . 2 1 1 A 116 116 GLN CB C 116 32.730 30.756 1.974 1 1 1282 . 2 1 1 A 116 116 GLN N N 116 119.994 123.502 -3.508 1 1 1284 . 2 1 1 A 117 117 GLU H H 117 8.849 8.577 0.272 1 1 1285 . 2 1 1 A 117 117 GLU HA H 117 3.707 4.415 -0.708 1 1 1290 . 2 1 1 A 117 117 GLU C C 117 177.303 176.898 0.405 1 1 1291 . 2 1 1 A 117 117 GLU CA C 117 57.233 56.290 0.943 1 1 1292 . 2 1 1 A 117 117 GLU CB C 117 29.634 29.218 0.416 1 1 1294 . 2 1 1 A 117 117 GLU N N 117 121.487 123.483 -1.996 1 1 1295 . 2 1 1 A 118 118 VAL H H 118 8.983 8.980 0.003 1 1 1296 . 2 1 1 A 118 118 VAL HA H 118 4.360 4.057 0.303 1 1 1304 . 2 1 1 A 118 118 VAL C C 118 174.171 174.845 -0.674 1 1 1305 . 2 1 1 A 118 118 VAL CA C 118 61.772 63.180 -1.408 1 1 1306 . 2 1 1 A 118 118 VAL CB C 118 34.095 32.940 1.155 1 1 1309 . 2 1 1 A 118 118 VAL N N 118 122.933 128.418 -5.485 1 1 1310 . 2 1 1 A 119 119 ALA H H 119 7.023 7.086 -0.063 1 1 1311 . 2 1 1 A 119 119 ALA HA H 119 4.378 4.081 0.297 1 1 1315 . 2 1 1 A 119 119 ALA C C 119 175.493 174.491 1.002 1 1 1316 . 2 1 1 A 119 119 ALA CA C 119 51.956 50.808 1.148 1 1 1317 . 2 1 1 A 119 119 ALA CB C 119 23.957 21.517 2.440 1 1 1318 . 2 1 1 A 119 119 ALA N N 119 117.379 122.430 -5.051 1 1 1319 . 2 1 1 A 120 120 SER H H 120 6.999 7.999 -1.000 1 1 1320 . 2 1 1 A 120 120 SER HA H 120 5.208 5.484 -0.276 1 1 1323 . 2 1 1 A 120 120 SER C C 120 173.082 172.376 0.706 1 1 1324 . 2 1 1 A 120 120 SER CA C 120 56.754 56.130 0.624 1 1 1325 . 2 1 1 A 120 120 SER CB C 120 64.605 65.075 -0.470 1 1 1326 . 2 1 1 A 120 120 SER N N 120 113.743 116.213 -2.470 1 1 1327 . 2 1 1 A 121 121 PHE H H 121 8.244 8.812 -0.568 1 1 1328 . 2 1 1 A 121 121 PHE HA H 121 5.177 5.077 0.100 1 1 1333 . 2 1 1 A 121 121 PHE C C 121 173.569 174.838 -1.269 1 1 1334 . 2 1 1 A 121 121 PHE CA C 121 55.555 56.202 -0.647 1 1 1335 . 2 1 1 A 121 121 PHE CB C 121 40.959 43.614 -2.655 1 1 1338 . 2 1 1 A 121 121 PHE N N 121 120.358 122.919 -2.561 1 1 1339 . 2 1 1 A 122 122 ILE H H 122 8.907 9.136 -0.229 1 1 1340 . 2 1 1 A 122 122 ILE HA H 122 4.682 4.644 0.038 1 1 1348 . 2 1 1 A 122 122 ILE C C 122 176.925 174.847 2.078 1 1 1349 . 2 1 1 A 122 122 ILE CA C 122 60.740 59.980 0.760 1 1 1350 . 2 1 1 A 122 122 ILE CB C 122 39.497 39.871 -0.374 1 1 1353 . 2 1 1 A 122 122 ILE N N 122 121.282 120.768 0.514 1 1 1354 . 2 1 1 A 123 123 THR H H 123 9.022 9.049 -0.027 1 1 1355 . 2 1 1 A 123 123 THR HA H 123 5.039 4.825 0.214 1 1 1360 . 2 1 1 A 123 123 THR C C 123 173.531 173.840 -0.309 1 1 1361 . 2 1 1 A 123 123 THR CA C 123 62.266 61.860 0.406 1 1 1362 . 2 1 1 A 123 123 THR CB C 123 70.677 68.813 1.864 1 1 1364 . 2 1 1 A 123 123 THR N N 123 128.965 123.188 5.777 1 1 1365 . 2 1 1 A 124 124 THR H H 124 8.961 9.348 -0.387 1 1 1366 . 2 1 1 A 124 124 THR HA H 124 5.001 4.918 0.083 1 1 1371 . 2 1 1 A 124 124 THR C C 124 173.468 173.122 0.346 1 1 1372 . 2 1 1 A 124 124 THR CA C 124 62.109 61.767 0.342 1 1 1373 . 2 1 1 A 124 124 THR CB C 124 70.450 69.416 1.034 1 1 1375 . 2 1 1 A 124 124 THR N N 124 122.176 123.896 -1.720 1 1 1376 . 2 1 1 A 125 125 ARG H H 125 9.386 9.503 -0.117 1 1 1377 . 2 1 1 A 125 125 ARG HA H 125 5.764 5.601 0.163 1 1 1384 . 2 1 1 A 125 125 ARG C C 125 175.713 174.496 1.217 1 1 1385 . 2 1 1 A 125 125 ARG CA C 125 53.991 54.184 -0.193 1 1 1386 . 2 1 1 A 125 125 ARG CB C 125 33.557 34.130 -0.573 1 1 1389 . 2 1 1 A 125 125 ARG N N 125 130.004 128.755 1.249 1 1 1390 . 2 1 1 A 126 126 SER H H 126 9.172 9.368 -0.196 1 1 1391 . 2 1 1 A 126 126 SER HA H 126 5.390 5.379 0.011 1 1 1394 . 2 1 1 A 126 126 SER C C 126 172.359 173.269 -0.910 1 1 1395 . 2 1 1 A 126 126 SER CA C 126 56.934 56.672 0.262 1 1 1396 . 2 1 1 A 126 126 SER CB C 126 65.827 65.834 -0.007 1 1 1397 . 2 1 1 A 126 126 SER N N 126 119.906 121.426 -1.520 1 1 1398 . 2 1 1 A 127 127 SER H H 127 8.591 8.486 0.105 1 1 1399 . 2 1 1 A 127 127 SER HA H 127 5.739 5.400 0.339 1 1 1401 . 2 1 1 A 127 127 SER C C 127 173.283 172.986 0.297 1 1 1402 . 2 1 1 A 127 127 SER CA C 127 57.354 57.707 -0.353 1 1 1403 . 2 1 1 A 127 127 SER CB C 127 65.412 65.251 0.161 1 1 1404 . 2 1 1 A 127 127 SER N N 127 117.914 119.988 -2.074 1 1 1405 . 2 1 1 A 128 128 TRP H H 128 9.866 9.691 0.175 1 1 1406 . 2 1 1 A 128 128 TRP HA H 128 5.560 5.780 -0.220 1 1 1415 . 2 1 1 A 128 128 TRP C C 128 175.828 175.339 0.489 1 1 1416 . 2 1 1 A 128 128 TRP CA C 128 55.852 55.652 0.200 1 1 1417 . 2 1 1 A 128 128 TRP CB C 128 32.524 34.300 -1.776 1 1 1423 . 2 1 1 A 128 128 TRP N N 128 127.978 124.781 3.197 1 1 1425 . 2 1 1 A 129 129 LYS H H 129 9.424 8.870 0.554 1 1 1426 . 2 1 1 A 129 129 LYS HA H 129 5.388 5.363 0.025 1 1 1433 . 2 1 1 A 129 129 LYS C C 129 175.254 175.065 0.189 1 1 1434 . 2 1 1 A 129 129 LYS CA C 129 54.410 54.744 -0.334 1 1 1435 . 2 1 1 A 129 129 LYS CB C 129 35.734 36.732 -0.998 1 1 1439 . 2 1 1 A 129 129 LYS N N 129 121.784 120.516 1.268 1 1 1440 . 2 1 1 A 130 130 LEU H H 130 8.933 9.426 -0.493 1 1 1441 . 2 1 1 A 130 130 LEU HA H 130 4.859 5.091 -0.232 1 1 1447 . 2 1 1 A 130 130 LEU C C 130 173.893 174.354 -0.461 1 1 1448 . 2 1 1 A 130 130 LEU CA C 130 53.848 54.164 -0.316 1 1 1449 . 2 1 1 A 130 130 LEU CB C 130 46.125 46.051 0.074 1 1 1451 . 2 1 1 A 130 130 LEU N N 130 124.543 124.211 0.332 1 1 1452 . 2 1 1 A 131 131 ALA H H 131 8.816 8.755 0.061 1 1 1453 . 2 1 1 A 131 131 ALA HA H 131 4.776 4.779 -0.003 1 1 1457 . 2 1 1 A 131 131 ALA C C 131 176.662 176.959 -0.297 1 1 1458 . 2 1 1 A 131 131 ALA CA C 131 51.407 50.997 0.410 1 1 1459 . 2 1 1 A 131 131 ALA CB C 131 19.354 19.789 -0.435 1 1 1460 . 2 1 1 A 131 131 ALA N N 131 131.102 129.132 1.970 1 1 1461 . 2 1 1 A 132 132 LEU H H 132 8.487 8.611 -0.124 1 1 1462 . 2 1 1 A 132 132 LEU HA H 132 4.470 4.456 0.014 1 1 1470 . 2 1 1 A 132 132 LEU C C 132 176.873 176.199 0.674 1 1 1471 . 2 1 1 A 132 132 LEU CA C 132 54.590 54.877 -0.287 1 1 1472 . 2 1 1 A 132 132 LEU CB C 132 42.974 42.354 0.620 1 1 1475 . 2 1 1 A 132 132 LEU N N 132 123.724 124.914 -1.190 1 1 1476 . 2 1 1 A 133 133 SER H H 133 8.448 8.899 -0.451 1 1 1477 . 2 1 1 A 133 133 SER HA H 133 4.560 5.300 -0.740 1 1 1479 . 2 1 1 A 133 133 SER C C 133 176.043 173.742 2.301 1 1 1480 . 2 1 1 A 133 133 SER CA C 133 58.460 57.618 0.842 1 1 1481 . 2 1 1 A 133 133 SER CB C 133 63.985 65.389 -1.404 1 1 1482 . 2 1 1 A 133 133 SER N N 133 115.880 117.091 -1.211 1 1 1483 . 2 1 1 A 134 134 GLY H H 134 8.232 9.253 -1.021 1 1 1484 . 2 1 1 A 134 134 GLY HA2 H 134 4.147 4.085 0.062 1 1 1485 . 2 1 1 A 134 134 GLY HA3 H 134 4.045 4.095 -0.050 1 1 1486 . 2 1 1 A 134 134 GLY C C 134 174.013 174.702 -0.689 1 1 1487 . 2 1 1 A 134 134 GLY CA C 134 45.337 45.785 -0.448 1 1 1488 . 2 1 1 A 134 134 GLY N N 134 109.970 110.762 -0.792 1 1 1489 . 2 1 1 A 135 135 ALA H H 135 8.424 8.840 -0.416 1 1 1490 . 2 1 1 A 135 135 ALA HA H 135 4.436 4.377 0.059 1 1 1494 . 2 1 1 A 135 135 ALA C C 135 177.537 175.997 1.540 1 1 1495 . 2 1 1 A 135 135 ALA CA C 135 52.721 53.188 -0.467 1 1 1496 . 2 1 1 A 135 135 ALA CB C 135 19.265 19.528 -0.263 1 1 1497 . 2 1 1 A 135 135 ALA N N 135 124.118 120.800 3.318 1 1 1498 . 2 1 1 A 136 136 HIS H H 136 8.466 7.691 0.775 1 1 1499 . 2 1 1 A 136 136 HIS HA H 136 4.379 4.823 -0.444 1 1 1500 . 2 1 1 A 136 136 HIS C C 136 176.259 174.747 1.512 1 1 1501 . 2 1 1 A 136 136 HIS CA C 136 56.082 55.085 0.997 1 1 1502 . 2 1 1 A 136 136 HIS CB C 136 29.619 33.393 -3.774 1 1 1503 . 2 1 1 A 136 136 HIS N N 136 119.493 111.983 7.510 1 1 1504 . 2 1 1 A 137 137 GLY H H 137 8.431 8.640 -0.209 1 1 1505 . 2 1 1 A 137 137 GLY HA2 H 137 4.151 4.011 0.140 1 1 1506 . 2 1 1 A 137 137 GLY HA3 H 137 3.893 4.015 -0.122 1 1 1507 . 2 1 1 A 137 137 GLY C C 137 174.039 173.168 0.871 1 1 1508 . 2 1 1 A 137 137 GLY CA C 137 45.372 44.879 0.493 1 1 1509 . 2 1 1 A 137 137 GLY N N 137 110.442 110.091 0.351 1 1 1510 . 2 1 1 A 138 138 GLN H H 138 8.416 8.380 0.036 1 1 1511 . 2 1 1 A 138 138 GLN HA H 138 4.455 4.924 -0.469 1 1 1515 . 2 1 1 A 138 138 GLN C C 138 175.889 174.763 1.126 1 1 1516 . 2 1 1 A 138 138 GLN CA C 138 55.866 54.757 1.109 1 1 1517 . 2 1 1 A 138 138 GLN CB C 138 29.639 30.139 -0.500 1 1 1518 . 2 1 1 A 138 138 GLN N N 138 119.401 121.185 -1.784 1 1 1519 . 2 1 1 A 139 139 GLU H H 139 8.446 8.678 -0.232 1 1 1520 . 2 1 1 A 139 139 GLU HA H 139 4.658 4.758 -0.100 1 1 1524 . 2 1 1 A 139 139 GLU CA C 139 54.589 53.489 1.100 1 1 1525 . 2 1 1 A 139 139 GLU CB C 139 29.733 30.559 -0.826 1 1 1527 . 2 1 1 A 139 139 GLU N N 139 123.136 125.705 -2.569 1 1 1528 . 2 1 1 A 140 140 PRO HA H 140 4.537 4.436 0.101 1 1 1533 . 2 1 1 A 140 140 PRO C C 140 176.119 175.561 0.558 1 1 1534 . 2 1 1 A 140 140 PRO CA C 140 63.220 63.502 -0.282 1 1 1535 . 2 1 1 A 140 140 PRO CB C 140 31.936 32.044 -0.108 1 1 1538 . 2 1 1 A 141 141 GLN H H 141 8.506 8.507 -0.001 1 1 1539 . 2 1 1 A 141 141 GLN HA H 141 4.650 4.763 -0.113 1 1 1546 . 2 1 1 A 141 141 GLN C C 141 175.811 175.386 0.425 1 1 1547 . 2 1 1 A 141 141 GLN CA C 141 55.912 54.644 1.268 1 1 1548 . 2 1 1 A 141 141 GLN CB C 141 30.241 30.735 -0.494 1 1 1550 . 2 1 1 A 141 141 GLN N N 141 120.422 123.576 -3.154 1 1 1551 . 2 1 1 A 142 142 LEU H H 142 8.842 9.009 -0.167 1 1 1552 . 2 1 1 A 142 142 LEU HA H 142 5.277 5.252 0.025 1 1 1562 . 2 1 1 A 142 142 LEU C C 142 176.839 175.078 1.761 1 1 1563 . 2 1 1 A 142 142 LEU CA C 142 53.927 52.865 1.062 1 1 1564 . 2 1 1 A 142 142 LEU CB C 142 44.527 46.256 -1.729 1 1 1568 . 2 1 1 A 142 142 LEU N N 142 123.692 122.344 1.348 1 1 1569 . 2 1 1 A 143 143 THR H H 143 9.025 8.557 0.468 1 1 1570 . 2 1 1 A 143 143 THR HA H 143 5.262 5.077 0.185 1 1 1575 . 2 1 1 A 143 143 THR C C 143 173.753 173.740 0.013 1 1 1576 . 2 1 1 A 143 143 THR CA C 143 61.795 61.811 -0.016 1 1 1577 . 2 1 1 A 143 143 THR CB C 143 70.660 70.745 -0.085 1 1 1579 . 2 1 1 A 143 143 THR N N 143 117.222 115.219 2.003 1 1 1580 . 2 1 1 A 144 144 ILE H H 144 9.353 10.125 -0.772 1 1 1581 . 2 1 1 A 144 144 ILE HA H 144 5.399 5.207 0.192 1 1 1591 . 2 1 1 A 144 144 ILE C C 144 173.931 174.070 -0.139 1 1 1592 . 2 1 1 A 144 144 ILE CA C 144 60.774 59.942 0.832 1 1 1593 . 2 1 1 A 144 144 ILE CB C 144 41.111 41.355 -0.244 1 1 1597 . 2 1 1 A 144 144 ILE N N 144 126.383 126.702 -0.319 1 1 1598 . 2 1 1 A 145 145 ASP H H 145 9.214 9.439 -0.225 1 1 1599 . 2 1 1 A 145 145 ASP HA H 145 5.978 5.583 0.395 1 1 1601 . 2 1 1 A 145 145 ASP C C 145 175.441 174.606 0.835 1 1 1602 . 2 1 1 A 145 145 ASP CA C 145 53.035 52.605 0.430 1 1 1603 . 2 1 1 A 145 145 ASP CB C 145 44.153 44.839 -0.686 1 1 1604 . 2 1 1 A 145 145 ASP N N 145 127.981 128.352 -0.371 1 1 1605 . 2 1 1 A 146 146 LEU H H 146 9.387 10.033 -0.646 1 1 1606 . 2 1 1 A 146 146 LEU HA H 146 4.918 5.363 -0.445 1 1 1616 . 2 1 1 A 146 146 LEU C C 146 175.003 174.529 0.474 1 1 1617 . 2 1 1 A 146 146 LEU CA C 146 53.940 53.636 0.304 1 1 1618 . 2 1 1 A 146 146 LEU CB C 146 43.902 43.051 0.851 1 1 1622 . 2 1 1 A 146 146 LEU N N 146 123.532 126.745 -3.213 1 1 1623 . 2 1 1 A 147 147 ASP H H 147 8.676 8.849 -0.173 1 1 1624 . 2 1 1 A 147 147 ASP HA H 147 5.205 5.245 -0.040 1 1 1627 . 2 1 1 A 147 147 ASP C C 147 174.956 174.362 0.594 1 1 1628 . 2 1 1 A 147 147 ASP CA C 147 53.441 52.343 1.098 1 1 1629 . 2 1 1 A 147 147 ASP CB C 147 43.370 43.428 -0.058 1 1 1630 . 2 1 1 A 147 147 ASP N N 147 125.499 126.291 -0.792 1 1 1631 . 2 1 1 A 148 148 SER H H 148 8.732 9.167 -0.435 1 1 1632 . 2 1 1 A 148 148 SER HA H 148 5.365 5.399 -0.034 1 1 1634 . 2 1 1 A 148 148 SER C C 148 173.217 173.538 -0.321 1 1 1635 . 2 1 1 A 148 148 SER CA C 148 56.334 55.976 0.358 1 1 1636 . 2 1 1 A 148 148 SER CB C 148 65.812 66.099 -0.287 1 1 1637 . 2 1 1 A 148 148 SER N N 148 118.623 119.881 -1.258 1 1 1638 . 2 1 1 A 149 149 ALA H H 149 8.937 9.075 -0.138 1 1 1639 . 2 1 1 A 149 149 ALA HA H 149 5.681 5.375 0.306 1 1 1643 . 2 1 1 A 149 149 ALA C C 149 178.894 177.964 0.930 1 1 1644 . 2 1 1 A 149 149 ALA CA C 149 49.996 50.198 -0.202 1 1 1645 . 2 1 1 A 149 149 ALA CB C 149 23.231 22.349 0.882 1 1 1646 . 2 1 1 A 149 149 ALA N N 149 123.952 124.238 -0.286 1 1 1647 . 2 1 1 A 150 150 ASP H H 150 9.010 8.954 0.056 1 1 1648 . 2 1 1 A 150 150 ASP HA H 150 4.336 4.387 -0.051 1 1 1651 . 2 1 1 A 150 150 ASP C C 150 176.697 177.013 -0.316 1 1 1652 . 2 1 1 A 150 150 ASP CA C 150 56.543 57.041 -0.498 1 1 1653 . 2 1 1 A 150 150 ASP CB C 150 39.850 40.409 -0.559 1 1 1654 . 2 1 1 A 150 150 ASP N N 150 122.687 122.695 -0.008 1 1 1655 . 2 1 1 A 151 151 PHE H H 151 7.295 8.191 -0.896 1 1 1656 . 2 1 1 A 151 151 PHE HA H 151 5.020 4.580 0.440 1 1 1661 . 2 1 1 A 151 151 PHE C C 151 174.756 176.337 -1.581 1 1 1662 . 2 1 1 A 151 151 PHE CA C 151 56.594 56.897 -0.303 1 1 1663 . 2 1 1 A 151 151 PHE CB C 151 37.765 38.247 -0.482 1 1 1666 . 2 1 1 A 151 151 PHE N N 151 113.928 120.468 -6.540 1 1 1667 . 2 1 1 A 152 152 GLY H H 152 7.786 8.118 -0.332 1 1 1668 . 2 1 1 A 152 152 GLY HA2 H 152 4.459 3.713 0.746 1 1 1669 . 2 1 1 A 152 152 GLY HA3 H 152 3.728 3.857 -0.129 1 1 1670 . 2 1 1 A 152 152 GLY C C 152 172.709 173.529 -0.820 1 1 1671 . 2 1 1 A 152 152 GLY CA C 152 46.106 45.680 0.426 1 1 1672 . 2 1 1 A 152 152 GLY N N 152 110.312 113.688 -3.376 1 1 1673 . 2 1 1 A 153 153 TYR H H 153 6.650 8.546 -1.896 1 1 1674 . 2 1 1 A 153 153 TYR HA H 153 4.508 4.406 0.102 1 1 1679 . 2 1 1 A 153 153 TYR C C 153 173.092 175.242 -2.150 1 1 1680 . 2 1 1 A 153 153 TYR CA C 153 57.464 58.517 -1.053 1 1 1681 . 2 1 1 A 153 153 TYR CB C 153 41.962 39.010 2.952 1 1 1684 . 2 1 1 A 153 153 TYR N N 153 121.977 121.797 0.180 1 1 1685 . 2 1 1 A 154 154 ALA H H 154 7.847 8.712 -0.865 1 1 1686 . 2 1 1 A 154 154 ALA HA H 154 5.144 4.801 0.343 1 1 1690 . 2 1 1 A 154 154 ALA C C 154 174.468 174.873 -0.405 1 1 1691 . 2 1 1 A 154 154 ALA CA C 154 51.776 51.023 0.753 1 1 1692 . 2 1 1 A 154 154 ALA CB C 154 21.747 22.058 -0.311 1 1 1693 . 2 1 1 A 154 154 ALA N N 154 130.258 130.763 -0.505 1 1 1694 . 2 1 1 A 155 155 VAL H H 155 8.733 9.072 -0.339 1 1 1695 . 2 1 1 A 155 155 VAL HA H 155 4.150 4.853 -0.703 1 1 1700 . 2 1 1 A 155 155 VAL C C 155 172.632 172.933 -0.301 1 1 1701 . 2 1 1 A 155 155 VAL CA C 155 61.451 59.093 2.358 1 1 1702 . 2 1 1 A 155 155 VAL CB C 155 35.883 35.585 0.298 1 1 1704 . 2 1 1 A 155 155 VAL N N 155 119.622 122.433 -2.811 1 1 1705 . 2 1 1 A 156 156 GLY H H 156 8.146 8.187 -0.041 1 1 1706 . 2 1 1 A 156 156 GLY HA2 H 156 5.125 2.600 2.525 1 1 1707 . 2 1 1 A 156 156 GLY HA3 H 156 2.061 3.922 -1.861 1 1 1708 . 2 1 1 A 156 156 GLY C C 156 171.746 171.388 0.358 1 1 1709 . 2 1 1 A 156 156 GLY CA C 156 43.319 43.736 -0.417 1 1 1710 . 2 1 1 A 156 156 GLY N N 156 113.332 113.426 -0.094 1 1 1711 . 2 1 1 A 157 157 GLU H H 157 8.967 8.977 -0.010 1 1 1712 . 2 1 1 A 157 157 GLU HA H 157 5.217 4.972 0.245 1 1 1716 . 2 1 1 A 157 157 GLU C C 157 174.476 175.499 -1.023 1 1 1717 . 2 1 1 A 157 157 GLU CA C 157 55.390 54.948 0.442 1 1 1718 . 2 1 1 A 157 157 GLU CB C 157 34.010 32.424 1.586 1 1 1720 . 2 1 1 A 157 157 GLU N N 157 120.823 123.138 -2.315 1 1 1721 . 2 1 1 A 158 158 VAL H H 158 9.076 9.837 -0.761 1 1 1722 . 2 1 1 A 158 158 VAL HA H 158 5.206 4.828 0.378 1 1 1727 . 2 1 1 A 158 158 VAL C C 158 173.900 174.251 -0.351 1 1 1728 . 2 1 1 A 158 158 VAL CA C 158 60.813 61.595 -0.782 1 1 1729 . 2 1 1 A 158 158 VAL CB C 158 33.385 33.288 0.097 1 1 1731 . 2 1 1 A 158 158 VAL N N 158 124.349 125.716 -1.367 1 1 1732 . 2 1 1 A 159 159 GLU H H 159 9.239 9.685 -0.446 1 1 1733 . 2 1 1 A 159 159 GLU HA H 159 5.647 5.204 0.443 1 1 1738 . 2 1 1 A 159 159 GLU C C 159 174.469 175.181 -0.712 1 1 1739 . 2 1 1 A 159 159 GLU CA C 159 54.473 54.639 -0.166 1 1 1740 . 2 1 1 A 159 159 GLU CB C 159 33.852 32.879 0.973 1 1 1742 . 2 1 1 A 159 159 GLU N N 159 125.772 128.609 -2.837 1 1 1743 . 2 1 1 A 160 160 ALA H H 160 9.250 9.330 -0.080 1 1 1744 . 2 1 1 A 160 160 ALA HA H 160 4.966 5.384 -0.418 1 1 1748 . 2 1 1 A 160 160 ALA C C 160 175.114 175.540 -0.426 1 1 1749 . 2 1 1 A 160 160 ALA CA C 160 50.644 50.136 0.508 1 1 1750 . 2 1 1 A 160 160 ALA CB C 160 23.263 22.588 0.675 1 1 1751 . 2 1 1 A 160 160 ALA N N 160 125.092 129.518 -4.426 1 1 1752 . 2 1 1 A 161 161 MET H H 161 8.559 8.824 -0.265 1 1 1753 . 2 1 1 A 161 161 MET HA H 161 5.468 5.885 -0.417 1 1 1761 . 2 1 1 A 161 161 MET C C 161 176.265 175.119 1.146 1 1 1762 . 2 1 1 A 161 161 MET CA C 161 53.818 54.086 -0.268 1 1 1763 . 2 1 1 A 161 161 MET CB C 161 34.380 34.551 -0.171 1 1 1766 . 2 1 1 A 161 161 MET N N 161 118.699 119.914 -1.215 1 1 1767 . 2 1 1 A 162 162 VAL H H 162 9.046 9.042 0.004 1 1 1768 . 2 1 1 A 162 162 VAL HA H 162 4.841 4.826 0.015 1 1 1776 . 2 1 1 A 162 162 VAL C C 162 174.794 175.679 -0.885 1 1 1777 . 2 1 1 A 162 162 VAL CA C 162 59.107 59.431 -0.324 1 1 1778 . 2 1 1 A 162 162 VAL CB C 162 34.018 34.190 -0.172 1 1 1781 . 2 1 1 A 162 162 VAL N N 162 116.435 118.933 -2.498 1 1 1782 . 2 1 1 A 163 163 HIS H H 163 8.793 8.706 0.087 1 1 1783 . 2 1 1 A 163 163 HIS HA H 163 4.717 4.588 0.129 1 1 1787 . 2 1 1 A 163 163 HIS C C 163 175.460 174.857 0.603 1 1 1788 . 2 1 1 A 163 163 HIS CA C 163 58.488 56.956 1.532 1 1 1789 . 2 1 1 A 163 163 HIS CB C 163 31.185 30.852 0.333 1 1 1791 . 2 1 1 A 163 163 HIS N N 163 117.838 120.684 -2.846 1 1 1792 . 2 1 1 A 164 164 GLU H H 164 8.013 7.851 0.162 1 1 1793 . 2 1 1 A 164 164 GLU HA H 164 4.814 4.484 0.330 1 1 1797 . 2 1 1 A 164 164 GLU C C 164 176.910 176.430 0.480 1 1 1798 . 2 1 1 A 164 164 GLU CA C 164 54.355 55.063 -0.708 1 1 1799 . 2 1 1 A 164 164 GLU CB C 164 32.886 31.906 0.980 1 1 1801 . 2 1 1 A 164 164 GLU N N 164 115.943 115.114 0.829 1 1 1802 . 2 1 1 A 165 165 LYS H H 165 9.088 8.309 0.779 1 1 1803 . 2 1 1 A 165 165 LYS HA H 165 3.942 3.945 -0.003 1 1 1809 . 2 1 1 A 165 165 LYS C C 165 179.657 177.831 1.826 1 1 1810 . 2 1 1 A 165 165 LYS CA C 165 59.888 58.772 1.116 1 1 1811 . 2 1 1 A 165 165 LYS CB C 165 32.024 32.123 -0.099 1 1 1814 . 2 1 1 A 165 165 LYS N N 165 124.120 121.164 2.956 1 1 1815 . 2 1 1 A 166 166 ALA H H 166 8.851 8.096 0.755 1 1 1816 . 2 1 1 A 166 166 ALA HA H 166 4.251 4.041 0.210 1 1 1820 . 2 1 1 A 166 166 ALA C C 166 178.920 178.617 0.303 1 1 1821 . 2 1 1 A 166 166 ALA CA C 166 54.318 54.511 -0.193 1 1 1822 . 2 1 1 A 166 166 ALA CB C 166 18.810 18.177 0.633 1 1 1823 . 2 1 1 A 166 166 ALA N N 166 120.424 121.949 -1.525 1 1 1824 . 2 1 1 A 167 167 GLU H H 167 7.871 7.575 0.296 1 1 1825 . 2 1 1 A 167 167 GLU HA H 167 4.404 4.335 0.069 1 1 1829 . 2 1 1 A 167 167 GLU C C 167 177.368 178.764 -1.396 1 1 1830 . 2 1 1 A 167 167 GLU CA C 167 56.701 57.645 -0.944 1 1 1831 . 2 1 1 A 167 167 GLU CB C 167 31.208 29.980 1.228 1 1 1833 . 2 1 1 A 167 167 GLU N N 167 114.926 116.848 -1.922 1 1 1834 . 2 1 1 A 168 168 VAL H H 168 7.812 7.674 0.138 1 1 1835 . 2 1 1 A 168 168 VAL HA H 168 3.712 3.634 0.078 1 1 1843 . 2 1 1 A 168 168 VAL CA C 168 68.705 67.963 0.742 1 1 1844 . 2 1 1 A 168 168 VAL CB C 168 29.597 29.823 -0.226 1 1 1847 . 2 1 1 A 168 168 VAL N N 168 120.188 122.370 -2.182 1 1 1848 . 2 1 1 A 169 169 PRO HA H 169 4.252 4.189 0.063 1 1 1851 . 2 1 1 A 169 169 PRO C C 169 179.563 178.719 0.844 1 1 1852 . 2 1 1 A 169 169 PRO CA C 169 67.077 67.051 0.026 1 1 1853 . 2 1 1 A 170 170 ALA H H 170 8.149 8.223 -0.074 1 1 1854 . 2 1 1 A 170 170 ALA HA H 170 4.265 4.073 0.192 1 1 1858 . 2 1 1 A 170 170 ALA C C 170 180.637 179.704 0.933 1 1 1859 . 2 1 1 A 170 170 ALA CA C 170 54.823 55.341 -0.518 1 1 1860 . 2 1 1 A 170 170 ALA CB C 170 18.518 18.418 0.100 1 1 1861 . 2 1 1 A 170 170 ALA N N 170 119.210 118.981 0.229 1 1 1862 . 2 1 1 A 171 171 ALA H H 171 7.767 8.338 -0.571 1 1 1863 . 2 1 1 A 171 171 ALA HA H 171 4.106 4.088 0.018 1 1 1867 . 2 1 1 A 171 171 ALA C C 171 179.371 179.776 -0.405 1 1 1868 . 2 1 1 A 171 171 ALA CA C 171 55.130 55.063 0.067 1 1 1869 . 2 1 1 A 171 171 ALA CB C 171 18.291 18.447 -0.156 1 1 1870 . 2 1 1 A 171 171 ALA N N 171 122.126 120.277 1.849 1 1 1871 . 2 1 1 A 172 172 LEU H H 172 8.950 8.228 0.722 1 1 1872 . 2 1 1 A 172 172 LEU HA H 172 3.987 4.074 -0.087 1 1 1878 . 2 1 1 A 172 172 LEU C C 172 178.355 178.495 -0.140 1 1 1879 . 2 1 1 A 172 172 LEU CA C 172 57.803 57.445 0.358 1 1 1880 . 2 1 1 A 172 172 LEU CB C 172 41.667 41.942 -0.275 1 1 1882 . 2 1 1 A 172 172 LEU N N 172 118.682 119.115 -0.433 1 1 1883 . 2 1 1 A 173 173 GLU H H 173 7.886 7.933 -0.047 1 1 1884 . 2 1 1 A 173 173 GLU HA H 173 4.132 3.973 0.159 1 1 1887 . 2 1 1 A 173 173 GLU C C 173 179.556 179.181 0.375 1 1 1888 . 2 1 1 A 173 173 GLU CA C 173 59.800 59.470 0.330 1 1 1889 . 2 1 1 A 173 173 GLU CB C 173 29.580 29.107 0.473 1 1 1891 . 2 1 1 A 173 173 GLU N N 173 117.561 118.836 -1.275 1 1 1892 . 2 1 1 A 174 174 LYS H H 174 7.532 7.572 -0.040 1 1 1893 . 2 1 1 A 174 174 LYS HA H 174 4.131 3.992 0.139 1 1 1901 . 2 1 1 A 174 174 LYS CA C 174 58.999 59.298 -0.299 1 1 1902 . 2 1 1 A 174 174 LYS CB C 174 32.041 32.388 -0.347 1 1 1906 . 2 1 1 A 174 174 LYS N N 174 119.085 119.101 -0.016 1 1 1907 . 2 1 1 A 175 175 ILE H H 175 8.479 8.013 0.466 1 1 1908 . 2 1 1 A 175 175 ILE HA H 175 3.583 3.580 0.003 1 1 1918 . 2 1 1 A 175 175 ILE C C 175 179.258 178.378 0.880 1 1 1919 . 2 1 1 A 175 175 ILE CA C 175 65.769 65.671 0.098 1 1 1920 . 2 1 1 A 175 175 ILE CB C 175 37.876 37.865 0.011 1 1 1923 . 2 1 1 A 175 175 ILE N N 175 118.828 120.240 -1.412 1 1 1924 . 2 1 1 A 176 176 ILE H H 176 8.928 8.233 0.695 1 1 1925 . 2 1 1 A 176 176 ILE HA H 176 3.600 3.573 0.027 1 1 1935 . 2 1 1 A 176 176 ILE C C 176 178.827 178.067 0.760 1 1 1936 . 2 1 1 A 176 176 ILE CA C 176 65.640 65.126 0.514 1 1 1937 . 2 1 1 A 176 176 ILE CB C 176 37.451 37.517 -0.066 1 1 1941 . 2 1 1 A 176 176 ILE N N 176 124.527 120.024 4.503 1 1 1942 . 2 1 1 A 177 177 THR H H 177 8.175 8.010 0.165 1 1 1943 . 2 1 1 A 177 177 THR HA H 177 3.885 3.949 -0.064 1 1 1948 . 2 1 1 A 177 177 THR C C 177 176.867 176.365 0.502 1 1 1949 . 2 1 1 A 177 177 THR CA C 177 67.199 66.247 0.952 1 1 1950 . 2 1 1 A 177 177 THR CB C 177 68.377 68.847 -0.470 1 1 1952 . 2 1 1 A 177 177 THR N N 177 119.412 118.736 0.676 1 1 1953 . 2 1 1 A 178 178 VAL H H 178 8.352 8.117 0.235 1 1 1954 . 2 1 1 A 178 178 VAL HA H 178 3.572 3.441 0.131 1 1 1962 . 2 1 1 A 178 178 VAL C C 178 177.664 177.753 -0.089 1 1 1963 . 2 1 1 A 178 178 VAL CA C 178 66.909 66.621 0.288 1 1 1964 . 2 1 1 A 178 178 VAL CB C 178 31.714 31.255 0.459 1 1 1967 . 2 1 1 A 178 178 VAL N N 178 121.168 121.933 -0.765 1 1 1968 . 2 1 1 A 179 179 SER H H 179 8.529 8.254 0.275 1 1 1969 . 2 1 1 A 179 179 SER HA H 179 3.099 3.481 -0.382 1 1 1972 . 2 1 1 A 179 179 SER C C 179 175.380 175.963 -0.583 1 1 1973 . 2 1 1 A 179 179 SER CA C 179 62.728 61.772 0.956 1 1 1974 . 2 1 1 A 179 179 SER CB C 179 62.802 62.535 0.267 1 1 1975 . 2 1 1 A 179 179 SER N N 179 115.226 115.568 -0.342 1 1 1976 . 2 1 1 A 180 180 SER H H 180 7.757 8.059 -0.302 1 1 1977 . 2 1 1 A 180 180 SER HA H 180 4.419 4.192 0.227 1 1 1980 . 2 1 1 A 180 180 SER C C 180 175.359 176.313 -0.954 1 1 1981 . 2 1 1 A 180 180 SER CA C 180 61.025 61.426 -0.401 1 1 1982 . 2 1 1 A 180 180 SER CB C 180 63.072 63.118 -0.046 1 1 1983 . 2 1 1 A 180 180 SER N N 180 114.718 116.194 -1.476 1 1 1984 . 2 1 1 A 181 181 MET H H 181 7.497 7.961 -0.464 1 1 1985 . 2 1 1 A 181 181 MET HA H 181 4.283 4.261 0.022 1 1 1993 . 2 1 1 A 181 181 MET C C 181 177.217 177.576 -0.359 1 1 1994 . 2 1 1 A 181 181 MET CA C 181 57.539 57.607 -0.068 1 1 1995 . 2 1 1 A 181 181 MET CB C 181 33.493 32.627 0.866 1 1 1998 . 2 1 1 A 181 181 MET N N 181 119.274 118.605 0.669 1 1 1999 . 2 1 1 A 182 182 LEU H H 182 7.163 7.485 -0.322 1 1 2000 . 2 1 1 A 182 182 LEU HA H 182 4.133 4.194 -0.061 1 1 2010 . 2 1 1 A 182 182 LEU C C 182 176.289 176.934 -0.645 1 1 2011 . 2 1 1 A 182 182 LEU CA C 182 54.750 55.780 -1.030 1 1 2012 . 2 1 1 A 182 182 LEU CB C 182 43.235 42.766 0.469 1 1 2016 . 2 1 1 A 182 182 LEU N N 182 115.869 118.364 -2.495 1 1 2017 . 2 1 1 A 183 183 GLY H H 183 7.492 7.378 0.114 1 1 2018 . 2 1 1 A 183 183 GLY HA2 H 183 4.086 4.103 -0.017 1 1 2019 . 2 1 1 A 183 183 GLY HA3 H 183 4.425 4.151 0.274 1 1 2020 . 2 1 1 A 183 183 GLY C C 183 171.830 171.645 0.185 1 1 2021 . 2 1 1 A 183 183 GLY CA C 183 46.035 46.087 -0.052 1 1 2022 . 2 1 1 A 183 183 GLY N N 183 107.761 104.925 2.836 1 1 2023 . 2 1 1 A 184 184 VAL H H 184 8.099 8.413 -0.314 1 1 2024 . 2 1 1 A 184 184 VAL HA H 184 4.772 4.696 0.076 1 1 2032 . 2 1 1 A 184 184 VAL CA C 184 59.305 58.885 0.420 1 1 2033 . 2 1 1 A 184 184 VAL CB C 184 33.648 35.126 -1.478 1 1 2036 . 2 1 1 A 184 184 VAL N N 184 119.803 121.497 -1.694 1 1 2037 . 2 1 1 A 185 185 PRO HA H 185 4.442 4.673 -0.231 1 1 2042 . 2 1 1 A 185 185 PRO C C 185 175.871 176.032 -0.161 1 1 2043 . 2 1 1 A 185 185 PRO CA C 185 63.886 62.656 1.230 1 1 2044 . 2 1 1 A 185 185 PRO CB C 185 32.260 32.420 -0.160 1 1 2047 . 2 1 1 A 186 186 ALA H H 186 8.222 8.954 -0.732 1 1 2048 . 2 1 1 A 186 186 ALA HA H 186 4.569 4.874 -0.305 1 1 2052 . 2 1 1 A 186 186 ALA C C 186 177.481 176.302 1.179 1 1 2053 . 2 1 1 A 186 186 ALA CA C 186 51.823 50.408 1.415 1 1 2054 . 2 1 1 A 186 186 ALA CB C 186 20.233 22.854 -2.621 1 1 2055 . 2 1 1 A 186 186 ALA N N 186 125.663 122.692 2.971 1 1 2056 . 2 1 1 A 187 187 GLN H H 187 8.723 8.550 0.173 1 1 2057 . 2 1 1 A 187 187 GLN HA H 187 4.420 4.708 -0.288 1 1 2063 . 2 1 1 A 187 187 GLN C C 187 175.566 176.115 -0.549 1 1 2064 . 2 1 1 A 187 187 GLN CA C 187 56.051 55.625 0.426 1 1 2065 . 2 1 1 A 187 187 GLN CB C 187 29.812 30.878 -1.066 1 1 2067 . 2 1 1 A 187 187 GLN N N 187 120.742 117.200 3.542 1 1 2069 . 2 1 1 A 188 188 GLU H H 188 8.163 7.532 0.631 1 1 2070 . 2 1 1 A 188 188 GLU HA H 188 4.405 4.375 0.030 1 1 2074 . 2 1 1 A 188 188 GLU C C 188 176.058 176.701 -0.643 1 1 2075 . 2 1 1 A 188 188 GLU CA C 188 56.158 56.347 -0.189 1 1 2076 . 2 1 1 A 188 188 GLU CB C 188 31.095 30.288 0.807 1 1 2078 . 2 1 1 A 188 188 GLU N N 188 119.177 120.431 -1.254 1 1 2079 . 2 1 1 A 189 189 GLU H H 189 8.567 8.942 -0.375 1 1 2080 . 2 1 1 A 189 189 GLU HA H 189 4.252 4.403 -0.151 1 1 2084 . 2 1 1 A 189 189 GLU C C 189 175.703 175.268 0.435 1 1 2085 . 2 1 1 A 189 189 GLU CA C 189 56.417 56.139 0.278 1 1 2086 . 2 1 1 A 189 189 GLU CB C 189 29.968 29.523 0.445 1 1 2088 . 2 1 1 A 189 189 GLU N N 189 120.920 120.695 0.225 1 1 2089 . 2 1 1 A 190 190 ALA H H 190 8.271 8.054 0.217 1 1 2090 . 2 1 1 A 190 190 ALA HA H 190 4.626 4.140 0.486 1 1 2094 . 2 1 1 A 190 190 ALA CA C 190 50.465 52.675 -2.210 1 1 2095 . 2 1 1 A 190 190 ALA CB C 190 18.451 17.856 0.595 1 1 2096 . 2 1 1 A 190 190 ALA N N 190 128.323 120.115 8.208 1 1 2097 . 2 1 1 A 191 191 PRO HA H 191 4.493 4.626 -0.133 1 1 2103 . 2 1 1 A 191 191 PRO C C 191 175.899 176.798 -0.899 1 1 2104 . 2 1 1 A 191 191 PRO CA C 191 62.044 62.248 -0.204 1 1 2105 . 2 1 1 A 191 191 PRO CB C 191 32.184 31.486 0.698 1 1 2108 . 2 1 1 A 192 192 ALA H H 192 8.610 8.244 0.366 1 1 2109 . 2 1 1 A 192 192 ALA HA H 192 4.280 4.395 -0.115 1 1 2113 . 2 1 1 A 192 192 ALA C C 192 178.282 178.087 0.195 1 1 2114 . 2 1 1 A 192 192 ALA CA C 192 51.698 51.861 -0.163 1 1 2115 . 2 1 1 A 192 192 ALA CB C 192 19.220 19.865 -0.645 1 1 2116 . 2 1 1 A 192 192 ALA N N 192 123.420 124.024 -0.604 1 1 2117 . 2 1 1 A 193 193 LYS H H 193 8.531 8.762 -0.231 1 1 2118 . 2 1 1 A 193 193 LYS HA H 193 3.294 3.523 -0.229 1 1 2126 . 2 1 1 A 193 193 LYS C C 193 177.640 177.770 -0.130 1 1 2127 . 2 1 1 A 193 193 LYS CA C 193 60.644 58.732 1.912 1 1 2128 . 2 1 1 A 193 193 LYS CB C 193 32.607 31.363 1.244 1 1 2132 . 2 1 1 A 193 193 LYS N N 193 122.851 119.408 3.443 1 1 2133 . 2 1 1 A 194 194 LEU H H 194 8.570 7.826 0.744 1 1 2134 . 2 1 1 A 194 194 LEU HA H 194 3.845 4.108 -0.263 1 1 2144 . 2 1 1 A 194 194 LEU C C 194 177.965 179.857 -1.892 1 1 2145 . 2 1 1 A 194 194 LEU CA C 194 57.611 57.447 0.164 1 1 2146 . 2 1 1 A 194 194 LEU CB C 194 41.776 40.859 0.917 1 1 2150 . 2 1 1 A 194 194 LEU N N 194 115.801 119.453 -3.652 1 1 2151 . 2 1 1 A 195 195 MET H H 195 6.782 7.830 -1.048 1 1 2152 . 2 1 1 A 195 195 MET HA H 195 4.487 4.163 0.324 1 1 2160 . 2 1 1 A 195 195 MET C C 195 178.280 178.769 -0.489 1 1 2161 . 2 1 1 A 195 195 MET CA C 195 56.858 58.497 -1.639 1 1 2162 . 2 1 1 A 195 195 MET CB C 195 31.557 31.505 0.052 1 1 2165 . 2 1 1 A 195 195 MET N N 195 113.898 118.441 -4.543 1 1 2166 . 2 1 1 A 196 196 VAL H H 196 7.713 7.293 0.420 1 1 2167 . 2 1 1 A 196 196 VAL HA H 196 3.501 3.552 -0.051 1 1 2175 . 2 1 1 A 196 196 VAL C C 196 177.624 177.813 -0.189 1 1 2176 . 2 1 1 A 196 196 VAL CA C 196 66.318 65.956 0.362 1 1 2177 . 2 1 1 A 196 196 VAL CB C 196 31.380 31.480 -0.100 1 1 2180 . 2 1 1 A 196 196 VAL N N 196 120.413 119.577 0.836 1 1 2181 . 2 1 1 A 197 197 TYR H H 197 7.972 8.521 -0.549 1 1 2182 . 2 1 1 A 197 197 TYR HA H 197 3.145 4.518 -1.373 1 1 2187 . 2 1 1 A 197 197 TYR C C 197 177.726 177.244 0.482 1 1 2188 . 2 1 1 A 197 197 TYR CA C 197 62.253 61.876 0.377 1 1 2189 . 2 1 1 A 197 197 TYR CB C 197 37.314 38.725 -1.411 1 1 2192 . 2 1 1 A 197 197 TYR N N 197 119.543 120.938 -1.395 1 1 2193 . 2 1 1 A 198 198 LEU H H 198 8.630 8.759 -0.129 1 1 2194 . 2 1 1 A 198 198 LEU HA H 198 3.923 3.839 0.084 1 1 2203 . 2 1 1 A 198 198 LEU C C 198 178.074 178.943 -0.869 1 1 2204 . 2 1 1 A 198 198 LEU CA C 198 58.294 58.170 0.124 1 1 2205 . 2 1 1 A 198 198 LEU CB C 198 42.177 41.803 0.374 1 1 2209 . 2 1 1 A 198 198 LEU N N 198 118.430 120.028 -1.598 1 1 2210 . 2 1 1 A 199 199 GLN H H 199 8.082 8.280 -0.198 1 1 2211 . 2 1 1 A 199 199 GLN HA H 199 3.054 3.831 -0.777 1 1 2216 . 2 1 1 A 199 199 GLN C C 199 176.875 178.122 -1.247 1 1 2217 . 2 1 1 A 199 199 GLN CA C 199 59.739 58.362 1.377 1 1 2218 . 2 1 1 A 199 199 GLN CB C 199 28.055 27.898 0.157 1 1 2220 . 2 1 1 A 199 199 GLN N N 199 117.926 117.252 0.674 1 1 2222 . 2 1 1 A 200 200 ARG H H 200 7.349 7.886 -0.537 1 1 2223 . 2 1 1 A 200 200 ARG HA H 200 3.798 3.907 -0.109 1 1 2231 . 2 1 1 A 200 200 ARG C C 200 178.037 178.321 -0.284 1 1 2232 . 2 1 1 A 200 200 ARG CA C 200 58.260 58.806 -0.546 1 1 2233 . 2 1 1 A 200 200 ARG CB C 200 30.706 30.173 0.533 1 1 2236 . 2 1 1 A 200 200 ARG N N 200 113.772 119.902 -6.130 1 1 2238 . 2 1 1 A 201 201 PHE H H 201 8.329 7.687 0.642 1 1 2239 . 2 1 1 A 201 201 PHE HA H 201 4.630 4.451 0.179 1 1 2244 . 2 1 1 A 201 201 PHE C C 201 176.606 176.466 0.140 1 1 2245 . 2 1 1 A 201 201 PHE CA C 201 59.014 59.033 -0.019 1 1 2246 . 2 1 1 A 201 201 PHE CB C 201 40.357 40.634 -0.277 1 1 2249 . 2 1 1 A 201 201 PHE N N 201 114.182 116.570 -2.388 1 1 2250 . 2 1 1 A 202 202 ARG H H 202 8.719 8.541 0.178 1 1 2251 . 2 1 1 A 202 202 ARG HA H 202 5.071 4.709 0.362 1 1 2261 . 2 1 1 A 202 202 ARG CA C 202 53.956 53.542 0.414 1 1 2262 . 2 1 1 A 202 202 ARG CB C 202 31.979 30.176 1.803 1 1 2264 . 2 1 1 A 202 202 ARG N N 202 120.115 115.152 4.963 1 1 2266 . 2 1 1 A 203 203 PRO HA H 203 4.348 4.531 -0.183 1 1 2271 . 2 1 1 A 203 203 PRO C C 203 179.736 178.267 1.469 1 1 2272 . 2 1 1 A 203 203 PRO CA C 203 65.674 64.832 0.842 1 1 2273 . 2 1 1 A 203 203 PRO CB C 203 31.717 32.258 -0.541 1 1 2275 . 2 1 1 A 204 204 LEU H H 204 8.875 7.625 1.250 1 1 2276 . 2 1 1 A 204 204 LEU HA H 204 4.291 4.071 0.220 1 1 2286 . 2 1 1 A 204 204 LEU C C 204 180.353 177.947 2.406 1 1 2287 . 2 1 1 A 204 204 LEU CA C 204 58.012 57.119 0.893 1 1 2288 . 2 1 1 A 204 204 LEU CB C 204 40.893 42.317 -1.424 1 1 2292 . 2 1 1 A 204 204 LEU N N 204 118.940 118.166 0.774 1 1 2293 . 2 1 1 A 205 205 ASP H H 205 7.541 8.422 -0.881 1 1 2294 . 2 1 1 A 205 205 ASP HA H 205 4.622 4.357 0.265 1 1 2297 . 2 1 1 A 205 205 ASP C C 205 177.602 178.318 -0.716 1 1 2298 . 2 1 1 A 205 205 ASP CA C 205 57.437 57.671 -0.234 1 1 2299 . 2 1 1 A 205 205 ASP CB C 205 41.143 40.624 0.519 1 1 2300 . 2 1 1 A 205 205 ASP N N 205 120.838 118.769 2.069 1 1 2301 . 2 1 1 A 206 206 TYR H H 206 8.237 7.854 0.383 1 1 2302 . 2 1 1 A 206 206 TYR HA H 206 4.018 4.101 -0.083 1 1 2307 . 2 1 1 A 206 206 TYR C C 206 176.433 177.428 -0.995 1 1 2308 . 2 1 1 A 206 206 TYR CA C 206 62.148 62.105 0.043 1 1 2309 . 2 1 1 A 206 206 TYR CB C 206 38.305 38.753 -0.448 1 1 2312 . 2 1 1 A 206 206 TYR N N 206 119.475 120.956 -1.481 1 1 2313 . 2 1 1 A 207 207 GLN H H 207 8.124 8.217 -0.093 1 1 2314 . 2 1 1 A 207 207 GLN HA H 207 3.823 3.301 0.522 1 1 2320 . 2 1 1 A 207 207 GLN C C 207 178.019 178.207 -0.188 1 1 2321 . 2 1 1 A 207 207 GLN CA C 207 58.841 58.470 0.371 1 1 2322 . 2 1 1 A 207 207 GLN CB C 207 28.208 28.121 0.087 1 1 2324 . 2 1 1 A 207 207 GLN N N 207 115.863 118.169 -2.306 1 1 2326 . 2 1 1 A 208 208 ARG H H 208 7.522 7.715 -0.193 1 1 2327 . 2 1 1 A 208 208 ARG HA H 208 4.127 4.073 0.054 1 1 2334 . 2 1 1 A 208 208 ARG C C 208 179.278 179.014 0.264 1 1 2335 . 2 1 1 A 208 208 ARG CA C 208 59.419 58.918 0.501 1 1 2336 . 2 1 1 A 208 208 ARG CB C 208 30.182 29.748 0.434 1 1 2338 . 2 1 1 A 208 208 ARG N N 208 118.471 119.293 -0.822 1 1 2340 . 2 1 1 A 209 209 LEU H H 209 7.869 7.779 0.090 1 1 2341 . 2 1 1 A 209 209 LEU HA H 209 4.091 4.187 -0.096 1 1 2351 . 2 1 1 A 209 209 LEU C C 209 179.715 178.201 1.514 1 1 2352 . 2 1 1 A 209 209 LEU CA C 209 57.891 57.997 -0.106 1 1 2353 . 2 1 1 A 209 209 LEU CB C 209 41.338 41.799 -0.461 1 1 2356 . 2 1 1 A 209 209 LEU N N 209 119.659 121.275 -1.616 1 1 2357 . 2 1 1 A 210 210 LEU H H 210 8.034 8.614 -0.580 1 1 2358 . 2 1 1 A 210 210 LEU HA H 210 3.977 3.978 -0.001 1 1 2367 . 2 1 1 A 210 210 LEU C C 210 180.363 178.567 1.796 1 1 2368 . 2 1 1 A 210 210 LEU CA C 210 57.459 58.454 -0.995 1 1 2369 . 2 1 1 A 210 210 LEU CB C 210 41.699 41.461 0.238 1 1 2373 . 2 1 1 A 210 210 LEU N N 210 120.967 119.987 0.980 1 1 2374 . 2 1 1 A 211 211 GLU H H 211 8.174 8.554 -0.380 1 1 2375 . 2 1 1 A 211 211 GLU HA H 211 4.075 4.222 -0.147 1 1 2379 . 2 1 1 A 211 211 GLU C C 211 178.499 179.278 -0.779 1 1 2380 . 2 1 1 A 211 211 GLU CA C 211 58.575 59.414 -0.839 1 1 2381 . 2 1 1 A 211 211 GLU CB C 211 29.583 29.127 0.456 1 1 2383 . 2 1 1 A 211 211 GLU N N 211 119.217 118.005 1.212 1 1 2384 . 2 1 1 A 212 212 ALA H H 212 7.723 7.787 -0.064 1 1 2385 . 2 1 1 A 212 212 ALA HA H 212 4.291 4.224 0.067 1 1 2389 . 2 1 1 A 212 212 ALA C C 212 178.770 180.066 -1.296 1 1 2390 . 2 1 1 A 212 212 ALA CA C 212 53.966 54.879 -0.913 1 1 2391 . 2 1 1 A 212 212 ALA CB C 212 19.117 18.290 0.827 1 1 2392 . 2 1 1 A 212 212 ALA N N 212 121.798 123.084 -1.286 1 1 2393 . 2 1 1 A 213 213 ALA H H 213 7.743 7.848 -0.105 1 1 2394 . 2 1 1 A 213 213 ALA HA H 213 4.406 4.199 0.207 1 1 2398 . 2 1 1 A 213 213 ALA C C 213 178.413 179.550 -1.137 1 1 2399 . 2 1 1 A 213 213 ALA CA C 213 53.129 54.715 -1.586 1 1 2400 . 2 1 1 A 213 213 ALA CB C 213 18.926 18.404 0.522 1 1 2401 . 2 1 1 A 213 213 ALA N N 213 120.435 120.467 -0.032 1 1 2402 . 2 1 1 A 214 214 SER H H 214 7.944 8.287 -0.343 1 1 2403 . 2 1 1 A 214 214 SER HA H 214 4.559 4.267 0.292 1 1 2406 . 2 1 1 A 214 214 SER C C 214 174.958 175.465 -0.507 1 1 2407 . 2 1 1 A 214 214 SER CA C 214 58.640 61.364 -2.724 1 1 2408 . 2 1 1 A 214 214 SER CB C 214 63.928 63.032 0.896 1 1 2409 . 2 1 1 A 214 214 SER N N 214 113.729 113.552 0.177 1 1 2410 . 2 1 1 A 215 215 SER H H 215 8.255 7.569 0.686 1 1 2411 . 2 1 1 A 215 215 SER HA H 215 4.547 4.433 0.114 1 1 2413 . 2 1 1 A 215 215 SER C C 215 175.289 173.549 1.740 1 1 2414 . 2 1 1 A 215 215 SER CA C 215 58.833 57.669 1.164 1 1 2415 . 2 1 1 A 215 215 SER CB C 215 63.847 63.112 0.735 1 1 2416 . 2 1 1 A 215 215 SER N N 215 117.674 116.276 1.398 1 1 2417 . 2 1 1 A 216 216 GLY H H 216 8.431 8.198 0.233 1 1 2418 . 2 1 1 A 216 216 GLY HA2 H 216 4.054 4.441 -0.387 1 1 2419 . 2 1 1 A 216 216 GLY C C 216 174.189 172.434 1.755 1 1 2420 . 2 1 1 A 216 216 GLY CA C 216 45.412 44.461 0.951 1 1 2421 . 2 1 1 A 216 216 GLY N N 216 110.800 114.205 -3.405 1 1 2422 . 2 1 1 A 217 217 GLU H H 217 8.267 8.367 -0.100 1 1 2423 . 2 1 1 A 217 217 GLU HA H 217 4.345 4.523 -0.178 1 1 2427 . 2 1 1 A 217 217 GLU C C 217 176.428 176.590 -0.162 1 1 2428 . 2 1 1 A 217 217 GLU CA C 217 56.470 55.806 0.664 1 1 2429 . 2 1 1 A 217 217 GLU CB C 217 30.526 30.834 -0.308 1 1 2430 . 2 1 1 A 217 217 GLU N N 217 120.726 121.085 -0.359 1 1 2431 . 2 1 1 A 218 218 ALA H H 218 8.476 8.398 0.078 1 1 2432 . 2 1 1 A 218 218 ALA HA H 218 4.467 4.387 0.080 1 1 2436 . 2 1 1 A 218 218 ALA C C 218 178.015 176.776 1.239 1 1 2437 . 2 1 1 A 218 218 ALA CA C 218 52.547 52.756 -0.209 1 1 2438 . 2 1 1 A 218 218 ALA CB C 218 19.242 19.016 0.226 1 1 2439 . 2 1 1 A 218 218 ALA N N 218 125.534 126.399 -0.865 1 1 2440 . 2 1 1 A 219 219 THR H H 219 8.232 8.640 -0.408 1 1 2441 . 2 1 1 A 219 219 THR HA H 219 4.411 4.462 -0.051 1 1 2446 . 2 1 1 A 219 219 THR C C 219 175.327 174.759 0.568 1 1 2447 . 2 1 1 A 219 219 THR CA C 219 61.889 62.544 -0.655 1 1 2448 . 2 1 1 A 219 219 THR CB C 219 69.939 70.038 -0.099 1 1 2449 . 2 1 1 A 219 219 THR N N 219 113.242 119.800 -6.558 1 1 2450 . 2 1 1 A 220 220 GLY H H 220 8.418 8.812 -0.394 1 1 2451 . 2 1 1 A 220 220 GLY C C 220 174.037 173.084 0.953 1 1 2452 . 2 1 1 A 220 220 GLY CA C 220 45.408 45.776 -0.368 1 1 2453 . 2 1 1 A 220 220 GLY N N 220 111.031 115.825 -4.794 1 1 2454 . 2 1 1 A 221 221 ASP H H 221 8.345 8.006 0.339 1 1 2455 . 2 1 1 A 221 221 ASP HA H 221 4.700 5.240 -0.540 1 1 2458 . 2 1 1 A 221 221 ASP C C 221 176.535 174.300 2.235 1 1 2459 . 2 1 1 A 221 221 ASP CA C 221 54.402 54.442 -0.040 1 1 2460 . 2 1 1 A 221 221 ASP CB C 221 41.431 42.961 -1.530 1 1 2461 . 2 1 1 A 221 221 ASP N N 221 120.795 124.094 -3.299 1 1 2462 . 2 1 1 A 222 222 SER H H 222 8.353 8.941 -0.588 1 1 2463 . 2 1 1 A 222 222 SER HA H 222 4.493 4.769 -0.276 1 1 2465 . 2 1 1 A 222 222 SER C C 222 174.224 173.030 1.194 1 1 2466 . 2 1 1 A 222 222 SER CA C 222 58.427 56.776 1.651 1 1 2467 . 2 1 1 A 222 222 SER CB C 222 63.860 66.297 -2.437 1 1 2468 . 2 1 1 A 222 222 SER N N 222 116.220 119.469 -3.249 1 1 2469 . 2 1 1 A 223 223 ALA H H 223 8.381 8.500 -0.119 1 1 2470 . 2 1 1 A 223 223 ALA HA H 223 4.461 3.816 0.645 1 1 2474 . 2 1 1 A 223 223 ALA C C 223 176.926 176.039 0.887 1 1 2475 . 2 1 1 A 223 223 ALA CA C 223 52.583 52.848 -0.265 1 1 2476 . 2 1 1 A 223 223 ALA CB C 223 19.438 17.399 2.039 1 1 2477 . 2 1 1 A 223 223 ALA N N 223 126.592 126.756 -0.164 1 1 1 . 3 1 1 A 2 2 ALA HA H 2 4.274 5.094 -0.820 1 1 5 . 3 1 1 A 2 2 ALA C C 2 177.828 175.713 2.115 1 1 6 . 3 1 1 A 2 2 ALA CA C 2 52.984 51.053 1.931 1 1 7 . 3 1 1 A 2 2 ALA CB C 2 19.138 22.985 -3.847 1 1 8 . 3 1 1 A 3 3 GLN H H 3 8.463 8.680 -0.217 1 1 9 . 3 1 1 A 3 3 GLN HA H 3 4.676 4.688 -0.012 1 1 12 . 3 1 1 A 3 3 GLN C C 3 176.002 176.705 -0.703 1 1 13 . 3 1 1 A 3 3 GLN CA C 3 56.258 54.771 1.487 1 1 14 . 3 1 1 A 3 3 GLN CB C 3 30.346 31.058 -0.712 1 1 15 . 3 1 1 A 3 3 GLN N N 3 117.490 119.918 -2.428 1 1 16 . 3 1 1 A 4 4 GLY H H 4 8.099 8.551 -0.452 1 1 17 . 3 1 1 A 4 4 GLY HA2 H 4 3.910 3.863 0.047 1 1 18 . 3 1 1 A 4 4 GLY C C 4 173.332 174.260 -0.928 1 1 19 . 3 1 1 A 4 4 GLY CA C 4 45.333 47.246 -1.913 1 1 20 . 3 1 1 A 4 4 GLY N N 4 109.423 110.209 -0.786 1 1 21 . 3 1 1 A 5 5 LEU H H 5 7.863 8.107 -0.244 1 1 22 . 3 1 1 A 5 5 LEU HA H 5 4.561 4.760 -0.199 1 1 32 . 3 1 1 A 5 5 LEU C C 5 176.448 175.622 0.826 1 1 33 . 3 1 1 A 5 5 LEU CA C 5 54.713 54.145 0.568 1 1 34 . 3 1 1 A 5 5 LEU CB C 5 43.551 41.488 2.063 1 1 38 . 3 1 1 A 5 5 LEU N N 5 120.391 125.099 -4.708 1 1 39 . 3 1 1 A 6 6 ILE H H 6 8.764 9.253 -0.489 1 1 40 . 3 1 1 A 6 6 ILE HA H 6 4.087 4.259 -0.172 1 1 49 . 3 1 1 A 6 6 ILE C C 6 174.679 175.214 -0.535 1 1 50 . 3 1 1 A 6 6 ILE CA C 6 61.279 61.697 -0.418 1 1 51 . 3 1 1 A 6 6 ILE CB C 6 39.651 37.729 1.922 1 1 54 . 3 1 1 A 6 6 ILE N N 6 123.050 126.260 -3.210 1 1 55 . 3 1 1 A 7 7 GLU H H 7 8.587 8.742 -0.155 1 1 56 . 3 1 1 A 7 7 GLU HA H 7 4.917 4.696 0.221 1 1 61 . 3 1 1 A 7 7 GLU C C 7 175.978 175.891 0.087 1 1 62 . 3 1 1 A 7 7 GLU CA C 7 56.127 55.857 0.270 1 1 63 . 3 1 1 A 7 7 GLU CB C 7 31.115 30.390 0.725 1 1 65 . 3 1 1 A 7 7 GLU N N 7 127.415 128.179 -0.764 1 1 66 . 3 1 1 A 8 8 VAL H H 8 8.986 9.240 -0.254 1 1 67 . 3 1 1 A 8 8 VAL HA H 8 4.375 4.928 -0.553 1 1 72 . 3 1 1 A 8 8 VAL C C 8 173.704 175.115 -1.411 1 1 73 . 3 1 1 A 8 8 VAL CA C 8 61.347 60.352 0.995 1 1 74 . 3 1 1 A 8 8 VAL CB C 8 33.611 33.565 0.046 1 1 76 . 3 1 1 A 8 8 VAL N N 8 126.071 123.426 2.645 1 1 77 . 3 1 1 A 9 9 GLU H H 9 8.521 9.241 -0.720 1 1 78 . 3 1 1 A 9 9 GLU HA H 9 5.837 5.446 0.391 1 1 81 . 3 1 1 A 9 9 GLU C C 9 175.939 174.962 0.977 1 1 82 . 3 1 1 A 9 9 GLU CA C 9 54.516 54.550 -0.034 1 1 83 . 3 1 1 A 9 9 GLU CB C 9 33.009 33.764 -0.755 1 1 84 . 3 1 1 A 9 9 GLU N N 9 122.857 121.695 1.162 1 1 85 . 3 1 1 A 10 10 ARG H H 10 8.690 8.525 0.165 1 1 86 . 3 1 1 A 10 10 ARG HA H 10 4.709 5.034 -0.325 1 1 94 . 3 1 1 A 10 10 ARG C C 10 174.826 174.640 0.186 1 1 95 . 3 1 1 A 10 10 ARG CA C 10 54.491 54.402 0.089 1 1 96 . 3 1 1 A 10 10 ARG CB C 10 35.777 34.873 0.904 1 1 98 . 3 1 1 A 10 10 ARG N N 10 120.430 121.245 -0.815 1 1 100 . 3 1 1 A 11 11 LYS H H 11 8.874 8.738 0.136 1 1 101 . 3 1 1 A 11 11 LYS HA H 11 5.530 5.368 0.162 1 1 107 . 3 1 1 A 11 11 LYS C C 11 176.919 174.589 2.330 1 1 108 . 3 1 1 A 11 11 LYS CA C 11 55.084 54.698 0.386 1 1 109 . 3 1 1 A 11 11 LYS CB C 11 35.435 36.766 -1.331 1 1 113 . 3 1 1 A 11 11 LYS N N 11 121.087 123.383 -2.296 1 1 114 . 3 1 1 A 12 12 PHE H H 12 8.877 9.084 -0.207 1 1 115 . 3 1 1 A 12 12 PHE HA H 12 5.130 5.063 0.067 1 1 120 . 3 1 1 A 12 12 PHE C C 12 171.676 171.995 -0.319 1 1 121 . 3 1 1 A 12 12 PHE CA C 12 55.869 56.374 -0.505 1 1 122 . 3 1 1 A 12 12 PHE CB C 12 42.108 41.133 0.975 1 1 125 . 3 1 1 A 12 12 PHE N N 12 117.486 119.675 -2.189 1 1 126 . 3 1 1 A 13 13 ALA H H 13 9.134 9.373 -0.239 1 1 127 . 3 1 1 A 13 13 ALA HA H 13 5.003 4.618 0.385 1 1 131 . 3 1 1 A 13 13 ALA CA C 13 48.340 48.816 -0.476 1 1 132 . 3 1 1 A 13 13 ALA CB C 13 19.191 20.132 -0.941 1 1 133 . 3 1 1 A 13 13 ALA N N 13 125.915 122.902 3.013 1 1 134 . 3 1 1 A 14 14 PRO HA H 14 4.620 4.774 -0.154 1 1 140 . 3 1 1 A 14 14 PRO C C 14 176.502 177.352 -0.850 1 1 141 . 3 1 1 A 14 14 PRO CA C 14 62.672 62.486 0.186 1 1 142 . 3 1 1 A 14 14 PRO CB C 14 33.119 32.198 0.921 1 1 145 . 3 1 1 A 15 15 GLY H H 15 8.721 8.565 0.156 1 1 146 . 3 1 1 A 15 15 GLY HA2 H 15 3.999 4.071 -0.072 1 1 147 . 3 1 1 A 15 15 GLY HA3 H 15 4.632 4.077 0.555 1 1 148 . 3 1 1 A 15 15 GLY CA C 15 44.411 44.026 0.385 1 1 149 . 3 1 1 A 15 15 GLY N N 15 109.863 108.114 1.749 1 1 150 . 3 1 1 A 16 16 PRO HA H 16 4.447 4.502 -0.055 1 1 155 . 3 1 1 A 16 16 PRO C C 16 177.053 177.018 0.035 1 1 156 . 3 1 1 A 16 16 PRO CA C 16 64.395 64.290 0.105 1 1 157 . 3 1 1 A 16 16 PRO CB C 16 31.993 31.901 0.092 1 1 159 . 3 1 1 A 17 17 ASP H H 17 8.550 8.607 -0.057 1 1 160 . 3 1 1 A 17 17 ASP HA H 17 4.950 4.755 0.195 1 1 163 . 3 1 1 A 17 17 ASP C C 17 176.800 177.381 -0.581 1 1 164 . 3 1 1 A 17 17 ASP CA C 17 53.271 53.468 -0.197 1 1 165 . 3 1 1 A 17 17 ASP CB C 17 40.392 40.314 0.078 1 1 166 . 3 1 1 A 17 17 ASP N N 17 116.060 115.587 0.473 1 1 167 . 3 1 1 A 18 18 THR H H 18 7.664 7.605 0.059 1 1 168 . 3 1 1 A 18 18 THR HA H 18 4.120 3.736 0.384 1 1 174 . 3 1 1 A 18 18 THR C C 18 175.407 176.337 -0.930 1 1 175 . 3 1 1 A 18 18 THR CA C 18 68.718 67.087 1.631 1 1 176 . 3 1 1 A 18 18 THR CB C 18 69.179 68.675 0.504 1 1 178 . 3 1 1 A 18 18 THR N N 18 117.158 115.993 1.165 1 1 179 . 3 1 1 A 19 19 GLU H H 19 8.817 8.584 0.233 1 1 180 . 3 1 1 A 19 19 GLU HA H 19 3.510 3.324 0.186 1 1 184 . 3 1 1 A 19 19 GLU C C 19 178.345 179.429 -1.084 1 1 185 . 3 1 1 A 19 19 GLU CA C 19 61.237 59.775 1.462 1 1 186 . 3 1 1 A 19 19 GLU CB C 19 28.746 29.599 -0.853 1 1 188 . 3 1 1 A 19 19 GLU N N 19 118.802 118.638 0.164 1 1 189 . 3 1 1 A 20 20 GLU H H 20 7.976 7.879 0.097 1 1 190 . 3 1 1 A 20 20 GLU HA H 20 4.036 4.147 -0.111 1 1 194 . 3 1 1 A 20 20 GLU C C 20 179.451 179.177 0.274 1 1 195 . 3 1 1 A 20 20 GLU CA C 20 59.909 58.988 0.921 1 1 196 . 3 1 1 A 20 20 GLU CB C 20 28.992 29.401 -0.409 1 1 198 . 3 1 1 A 20 20 GLU N N 20 121.130 120.036 1.094 1 1 199 . 3 1 1 A 21 21 ARG H H 21 8.199 8.155 0.044 1 1 200 . 3 1 1 A 21 21 ARG HA H 21 4.061 4.000 0.061 1 1 207 . 3 1 1 A 21 21 ARG C C 21 179.087 178.684 0.403 1 1 208 . 3 1 1 A 21 21 ARG CA C 21 58.477 58.884 -0.407 1 1 209 . 3 1 1 A 21 21 ARG CB C 21 30.101 29.595 0.506 1 1 211 . 3 1 1 A 21 21 ARG N N 21 119.897 120.458 -0.561 1 1 213 . 3 1 1 A 22 22 LEU H H 22 8.154 8.509 -0.355 1 1 214 . 3 1 1 A 22 22 LEU HA H 22 3.560 3.731 -0.171 1 1 224 . 3 1 1 A 22 22 LEU C C 22 178.461 179.090 -0.629 1 1 225 . 3 1 1 A 22 22 LEU CA C 22 58.432 57.527 0.905 1 1 226 . 3 1 1 A 22 22 LEU CB C 22 40.229 40.892 -0.663 1 1 230 . 3 1 1 A 22 22 LEU N N 22 120.012 120.154 -0.142 1 1 231 . 3 1 1 A 23 23 GLN H H 23 7.621 7.899 -0.278 1 1 232 . 3 1 1 A 23 23 GLN HA H 23 4.232 4.134 0.098 1 1 238 . 3 1 1 A 23 23 GLN C C 23 180.543 178.063 2.480 1 1 239 . 3 1 1 A 23 23 GLN CA C 23 59.434 59.224 0.210 1 1 240 . 3 1 1 A 23 23 GLN CB C 23 28.749 28.489 0.260 1 1 242 . 3 1 1 A 23 23 GLN N N 23 117.823 117.315 0.508 1 1 244 . 3 1 1 A 24 24 GLU H H 24 8.165 7.812 0.353 1 1 245 . 3 1 1 A 24 24 GLU HA H 24 4.072 4.188 -0.116 1 1 249 . 3 1 1 A 24 24 GLU C C 24 178.612 178.882 -0.270 1 1 250 . 3 1 1 A 24 24 GLU CA C 24 59.236 58.885 0.351 1 1 251 . 3 1 1 A 24 24 GLU CB C 24 29.606 29.468 0.138 1 1 253 . 3 1 1 A 24 24 GLU N N 24 122.589 119.386 3.203 1 1 254 . 3 1 1 A 25 25 LEU H H 25 7.911 7.826 0.085 1 1 255 . 3 1 1 A 25 25 LEU HA H 25 4.214 4.152 0.062 1 1 265 . 3 1 1 A 25 25 LEU C C 25 176.745 176.897 -0.152 1 1 266 . 3 1 1 A 25 25 LEU CA C 25 55.659 55.657 0.002 1 1 267 . 3 1 1 A 25 25 LEU CB C 25 43.109 42.662 0.447 1 1 271 . 3 1 1 A 25 25 LEU N N 25 117.882 117.186 0.696 1 1 272 . 3 1 1 A 26 26 GLY H H 26 7.776 7.793 -0.017 1 1 273 . 3 1 1 A 26 26 GLY HA2 H 26 4.337 4.064 0.273 1 1 274 . 3 1 1 A 26 26 GLY HA3 H 26 3.856 4.075 -0.219 1 1 275 . 3 1 1 A 26 26 GLY C C 26 175.456 174.520 0.936 1 1 276 . 3 1 1 A 26 26 GLY CA C 26 44.875 45.064 -0.189 1 1 277 . 3 1 1 A 26 26 GLY N N 26 104.938 105.458 -0.520 1 1 278 . 3 1 1 A 27 27 ALA H H 27 8.104 8.215 -0.111 1 1 279 . 3 1 1 A 27 27 ALA HA H 27 4.949 4.530 0.419 1 1 283 . 3 1 1 A 27 27 ALA C C 27 176.448 176.505 -0.057 1 1 284 . 3 1 1 A 27 27 ALA CA C 27 52.183 52.261 -0.078 1 1 285 . 3 1 1 A 27 27 ALA CB C 27 21.814 20.035 1.779 1 1 286 . 3 1 1 A 27 27 ALA N N 27 123.263 124.016 -0.753 1 1 287 . 3 1 1 A 28 28 THR H H 28 9.369 9.157 0.212 1 1 288 . 3 1 1 A 28 28 THR HA H 28 4.779 5.092 -0.313 1 1 293 . 3 1 1 A 28 28 THR C C 28 173.725 173.392 0.333 1 1 294 . 3 1 1 A 28 28 THR CA C 28 60.046 60.239 -0.193 1 1 295 . 3 1 1 A 28 28 THR CB C 28 70.592 71.028 -0.436 1 1 297 . 3 1 1 A 28 28 THR N N 28 112.201 117.176 -4.975 1 1 298 . 3 1 1 A 29 29 LEU H H 29 8.518 8.636 -0.118 1 1 299 . 3 1 1 A 29 29 LEU HA H 29 3.332 3.813 -0.481 1 1 309 . 3 1 1 A 29 29 LEU C C 29 176.202 175.533 0.669 1 1 310 . 3 1 1 A 29 29 LEU CA C 29 55.031 54.546 0.485 1 1 311 . 3 1 1 A 29 29 LEU CB C 29 40.624 41.724 -1.100 1 1 315 . 3 1 1 A 29 29 LEU N N 29 128.151 128.103 0.048 1 1 316 . 3 1 1 A 30 30 GLU H H 30 9.269 9.303 -0.034 1 1 317 . 3 1 1 A 30 30 GLU HA H 30 4.287 4.318 -0.031 1 1 321 . 3 1 1 A 30 30 GLU C C 30 176.740 176.053 0.687 1 1 322 . 3 1 1 A 30 30 GLU CA C 30 57.283 58.350 -1.067 1 1 323 . 3 1 1 A 30 30 GLU CB C 30 31.045 30.937 0.108 1 1 325 . 3 1 1 A 30 30 GLU N N 30 130.123 125.772 4.351 1 1 326 . 3 1 1 A 31 31 HIS H H 31 7.341 7.116 0.225 1 1 327 . 3 1 1 A 31 31 HIS HA H 31 4.701 5.188 -0.487 1 1 331 . 3 1 1 A 31 31 HIS C C 31 172.581 173.434 -0.853 1 1 332 . 3 1 1 A 31 31 HIS CA C 31 55.876 54.532 1.344 1 1 333 . 3 1 1 A 31 31 HIS CB C 31 33.434 33.967 -0.533 1 1 334 . 3 1 1 A 31 31 HIS N N 31 113.223 114.604 -1.381 1 1 335 . 3 1 1 A 32 32 ARG H H 32 8.196 8.693 -0.497 1 1 336 . 3 1 1 A 32 32 ARG HA H 32 5.262 5.425 -0.163 1 1 341 . 3 1 1 A 32 32 ARG C C 32 174.377 174.517 -0.140 1 1 342 . 3 1 1 A 32 32 ARG CA C 32 55.808 55.001 0.807 1 1 343 . 3 1 1 A 32 32 ARG CB C 32 33.340 33.892 -0.552 1 1 345 . 3 1 1 A 32 32 ARG N N 32 123.003 121.696 1.307 1 1 346 . 3 1 1 A 33 33 VAL H H 33 8.956 9.361 -0.405 1 1 347 . 3 1 1 A 33 33 VAL HA H 33 4.734 4.969 -0.235 1 1 355 . 3 1 1 A 33 33 VAL C C 33 172.821 175.001 -2.180 1 1 356 . 3 1 1 A 33 33 VAL CA C 33 60.197 59.898 0.299 1 1 357 . 3 1 1 A 33 33 VAL CB C 33 35.860 34.687 1.173 1 1 360 . 3 1 1 A 33 33 VAL N N 33 122.929 120.682 2.247 1 1 361 . 3 1 1 A 34 34 THR H H 34 8.250 8.952 -0.702 1 1 362 . 3 1 1 A 34 34 THR HA H 34 5.616 5.878 -0.262 1 1 367 . 3 1 1 A 34 34 THR C C 34 173.913 173.658 0.255 1 1 368 . 3 1 1 A 34 34 THR CA C 34 60.245 60.557 -0.312 1 1 369 . 3 1 1 A 34 34 THR CB C 34 71.706 71.259 0.447 1 1 371 . 3 1 1 A 34 34 THR N N 34 119.164 116.389 2.775 1 1 372 . 3 1 1 A 35 35 PHE H H 35 8.565 8.416 0.149 1 1 373 . 3 1 1 A 35 35 PHE HA H 35 5.029 5.100 -0.071 1 1 378 . 3 1 1 A 35 35 PHE C C 35 173.193 172.162 1.031 1 1 379 . 3 1 1 A 35 35 PHE CA C 35 55.687 55.893 -0.206 1 1 380 . 3 1 1 A 35 35 PHE CB C 35 40.853 41.001 -0.148 1 1 383 . 3 1 1 A 35 35 PHE N N 35 120.244 118.569 1.675 1 1 384 . 3 1 1 A 36 36 ARG H H 36 8.869 8.676 0.193 1 1 385 . 3 1 1 A 36 36 ARG HA H 36 4.982 4.941 0.041 1 1 387 . 3 1 1 A 36 36 ARG C C 36 174.743 175.323 -0.580 1 1 388 . 3 1 1 A 36 36 ARG CA C 36 55.493 55.463 0.030 1 1 389 . 3 1 1 A 36 36 ARG CB C 36 32.228 32.148 0.080 1 1 390 . 3 1 1 A 36 36 ARG N N 36 123.893 119.699 4.194 1 1 391 . 3 1 1 A 37 37 ASP H H 37 8.402 9.349 -0.947 1 1 392 . 3 1 1 A 37 37 ASP HA H 37 5.462 5.486 -0.024 1 1 395 . 3 1 1 A 37 37 ASP C C 37 175.177 174.264 0.913 1 1 396 . 3 1 1 A 37 37 ASP CA C 37 53.942 52.471 1.471 1 1 397 . 3 1 1 A 37 37 ASP CB C 37 45.486 43.154 2.332 1 1 398 . 3 1 1 A 37 37 ASP N N 37 127.149 121.519 5.630 1 1 399 . 3 1 1 A 38 38 THR H H 38 8.151 8.545 -0.394 1 1 400 . 3 1 1 A 38 38 THR HA H 38 4.866 4.634 0.232 1 1 405 . 3 1 1 A 38 38 THR C C 38 172.792 173.150 -0.358 1 1 406 . 3 1 1 A 38 38 THR CA C 38 61.416 61.424 -0.008 1 1 407 . 3 1 1 A 38 38 THR CB C 38 71.047 69.655 1.392 1 1 409 . 3 1 1 A 38 38 THR N N 38 115.686 119.693 -4.007 1 1 410 . 3 1 1 A 39 39 TYR H H 39 9.021 9.092 -0.071 1 1 411 . 3 1 1 A 39 39 TYR HA H 39 5.544 5.804 -0.260 1 1 416 . 3 1 1 A 39 39 TYR C C 39 176.032 174.548 1.484 1 1 417 . 3 1 1 A 39 39 TYR CA C 39 57.184 56.443 0.741 1 1 418 . 3 1 1 A 39 39 TYR CB C 39 41.642 40.844 0.798 1 1 420 . 3 1 1 A 39 39 TYR N N 39 124.579 126.099 -1.520 1 1 421 . 3 1 1 A 40 40 TYR H H 40 8.487 9.046 -0.559 1 1 422 . 3 1 1 A 40 40 TYR HA H 40 5.517 5.621 -0.104 1 1 426 . 3 1 1 A 40 40 TYR C C 40 174.108 174.313 -0.205 1 1 427 . 3 1 1 A 40 40 TYR CA C 40 56.979 56.692 0.287 1 1 428 . 3 1 1 A 40 40 TYR CB C 40 44.132 43.110 1.022 1 1 431 . 3 1 1 A 40 40 TYR N N 40 119.709 121.334 -1.625 1 1 432 . 3 1 1 A 41 41 ASP H H 41 9.341 8.939 0.402 1 1 433 . 3 1 1 A 41 41 ASP HA H 41 4.866 5.105 -0.239 1 1 436 . 3 1 1 A 41 41 ASP C C 41 177.262 175.110 2.152 1 1 437 . 3 1 1 A 41 41 ASP CA C 41 53.445 53.388 0.057 1 1 438 . 3 1 1 A 41 41 ASP CB C 41 45.347 44.611 0.736 1 1 439 . 3 1 1 A 41 41 ASP N N 41 117.995 120.603 -2.608 1 1 440 . 3 1 1 A 42 42 THR H H 42 11.574 8.665 2.909 1 1 441 . 3 1 1 A 42 42 THR HA H 42 5.206 4.558 0.648 1 1 446 . 3 1 1 A 42 42 THR C C 42 177.935 176.498 1.437 1 1 447 . 3 1 1 A 42 42 THR CA C 42 60.400 62.437 -2.037 1 1 448 . 3 1 1 A 42 42 THR CB C 42 72.114 69.697 2.417 1 1 450 . 3 1 1 A 42 42 THR N N 42 114.394 117.734 -3.340 1 1 451 . 3 1 1 A 43 43 SER H H 43 9.715 8.914 0.801 1 1 452 . 3 1 1 A 43 43 SER HA H 43 4.252 4.109 0.143 1 1 455 . 3 1 1 A 43 43 SER C C 43 175.478 175.529 -0.051 1 1 456 . 3 1 1 A 43 43 SER CA C 43 61.277 61.103 0.174 1 1 457 . 3 1 1 A 43 43 SER CB C 43 62.821 62.599 0.222 1 1 458 . 3 1 1 A 43 43 SER N N 43 116.674 119.384 -2.710 1 1 459 . 3 1 1 A 44 44 GLU H H 44 7.674 7.708 -0.034 1 1 460 . 3 1 1 A 44 44 GLU HA H 44 4.330 4.446 -0.116 1 1 464 . 3 1 1 A 44 44 GLU C C 44 175.001 175.433 -0.432 1 1 465 . 3 1 1 A 44 44 GLU CA C 44 55.992 56.114 -0.122 1 1 466 . 3 1 1 A 44 44 GLU CB C 44 29.276 29.680 -0.404 1 1 468 . 3 1 1 A 44 44 GLU N N 44 117.856 118.890 -1.034 1 1 469 . 3 1 1 A 45 45 LEU H H 45 8.222 8.149 0.073 1 1 470 . 3 1 1 A 45 45 LEU HA H 45 3.901 4.043 -0.142 1 1 480 . 3 1 1 A 45 45 LEU C C 45 175.209 176.420 -1.211 1 1 481 . 3 1 1 A 45 45 LEU CA C 45 55.548 56.192 -0.644 1 1 482 . 3 1 1 A 45 45 LEU CB C 45 38.458 39.299 -0.841 1 1 485 . 3 1 1 A 45 45 LEU N N 45 119.335 117.346 1.989 1 1 486 . 3 1 1 A 46 46 SER H H 46 7.347 8.013 -0.666 1 1 487 . 3 1 1 A 46 46 SER HA H 46 3.954 4.163 -0.209 1 1 489 . 3 1 1 A 46 46 SER C C 46 177.497 176.014 1.483 1 1 490 . 3 1 1 A 46 46 SER CA C 46 62.471 62.350 0.121 1 1 491 . 3 1 1 A 46 46 SER CB C 46 63.908 62.973 0.935 1 1 492 . 3 1 1 A 46 46 SER N N 46 111.433 113.900 -2.467 1 1 493 . 3 1 1 A 47 47 LEU H H 47 12.003 8.476 3.527 1 1 494 . 3 1 1 A 47 47 LEU HA H 47 3.959 4.135 -0.176 1 1 504 . 3 1 1 A 47 47 LEU C C 47 180.340 178.245 2.095 1 1 505 . 3 1 1 A 47 47 LEU CA C 47 58.879 57.765 1.114 1 1 506 . 3 1 1 A 47 47 LEU CB C 47 39.572 41.636 -2.064 1 1 510 . 3 1 1 A 47 47 LEU N N 47 124.605 122.948 1.657 1 1 511 . 3 1 1 A 48 48 MET H H 48 10.599 8.353 2.246 1 1 512 . 3 1 1 A 48 48 MET HA H 48 3.213 3.688 -0.475 1 1 520 . 3 1 1 A 48 48 MET C C 48 181.177 178.227 2.950 1 1 521 . 3 1 1 A 48 48 MET CA C 48 60.747 58.319 2.428 1 1 522 . 3 1 1 A 48 48 MET CB C 48 32.594 32.012 0.582 1 1 525 . 3 1 1 A 48 48 MET N N 48 126.254 119.050 7.204 1 1 526 . 3 1 1 A 49 49 LEU H H 49 8.731 7.800 0.931 1 1 527 . 3 1 1 A 49 49 LEU HA H 49 4.097 4.184 -0.087 1 1 536 . 3 1 1 A 49 49 LEU C C 49 178.144 177.305 0.839 1 1 537 . 3 1 1 A 49 49 LEU CA C 49 57.800 56.576 1.224 1 1 538 . 3 1 1 A 49 49 LEU CB C 49 41.379 41.715 -0.336 1 1 541 . 3 1 1 A 49 49 LEU N N 49 119.183 120.372 -1.189 1 1 542 . 3 1 1 A 50 50 SER H H 50 7.853 7.438 0.415 1 1 543 . 3 1 1 A 50 50 SER HA H 50 4.822 4.564 0.258 1 1 546 . 3 1 1 A 50 50 SER C C 50 174.539 172.876 1.663 1 1 547 . 3 1 1 A 50 50 SER CA C 50 57.811 57.927 -0.116 1 1 548 . 3 1 1 A 50 50 SER CB C 50 64.443 63.319 1.124 1 1 549 . 3 1 1 A 50 50 SER N N 50 114.594 111.954 2.640 1 1 550 . 3 1 1 A 51 51 ASP H H 51 8.264 8.009 0.255 1 1 551 . 3 1 1 A 51 51 ASP HA H 51 4.362 3.853 0.509 1 1 554 . 3 1 1 A 51 51 ASP C C 51 172.921 174.629 -1.708 1 1 555 . 3 1 1 A 51 51 ASP CA C 51 55.343 55.212 0.131 1 1 556 . 3 1 1 A 51 51 ASP CB C 51 40.583 39.272 1.311 1 1 557 . 3 1 1 A 51 51 ASP N N 51 123.003 117.720 5.283 1 1 558 . 3 1 1 A 52 52 HIS H H 52 7.869 7.407 0.462 1 1 559 . 3 1 1 A 52 52 HIS HA H 52 5.335 5.269 0.066 1 1 564 . 3 1 1 A 52 52 HIS C C 52 173.991 173.792 0.199 1 1 565 . 3 1 1 A 52 52 HIS CA C 52 55.889 54.473 1.416 1 1 566 . 3 1 1 A 52 52 HIS CB C 52 31.789 29.878 1.911 1 1 568 . 3 1 1 A 52 52 HIS N N 52 112.486 117.555 -5.069 1 1 569 . 3 1 1 A 53 53 TRP H H 53 8.165 9.040 -0.875 1 1 570 . 3 1 1 A 53 53 TRP HA H 53 4.926 5.345 -0.419 1 1 578 . 3 1 1 A 53 53 TRP C C 53 175.354 175.503 -0.149 1 1 579 . 3 1 1 A 53 53 TRP CA C 53 55.364 56.293 -0.929 1 1 580 . 3 1 1 A 53 53 TRP CB C 53 30.641 30.814 -0.173 1 1 585 . 3 1 1 A 53 53 TRP N N 53 117.916 125.698 -7.782 1 1 587 . 3 1 1 A 54 54 LEU H H 54 10.088 9.196 0.892 1 1 588 . 3 1 1 A 54 54 LEU HA H 54 5.497 5.404 0.093 1 1 598 . 3 1 1 A 54 54 LEU C C 54 173.337 175.322 -1.985 1 1 599 . 3 1 1 A 54 54 LEU CA C 54 54.408 54.264 0.144 1 1 600 . 3 1 1 A 54 54 LEU CB C 54 44.156 44.859 -0.703 1 1 604 . 3 1 1 A 54 54 LEU N N 54 130.826 126.700 4.126 1 1 605 . 3 1 1 A 55 55 ARG H H 55 9.289 9.579 -0.290 1 1 606 . 3 1 1 A 55 55 ARG HA H 55 5.482 5.258 0.224 1 1 612 . 3 1 1 A 55 55 ARG C C 55 174.057 173.893 0.164 1 1 613 . 3 1 1 A 55 55 ARG CA C 55 53.167 54.220 -1.053 1 1 614 . 3 1 1 A 55 55 ARG CB C 55 34.270 33.926 0.344 1 1 616 . 3 1 1 A 55 55 ARG N N 55 125.089 127.967 -2.878 1 1 618 . 3 1 1 A 56 56 GLN H H 56 9.092 8.973 0.119 1 1 619 . 3 1 1 A 56 56 GLN HA H 56 3.991 4.273 -0.282 1 1 626 . 3 1 1 A 56 56 GLN C C 56 174.199 174.049 0.150 1 1 627 . 3 1 1 A 56 56 GLN CA C 56 54.566 54.098 0.468 1 1 628 . 3 1 1 A 56 56 GLN CB C 56 29.643 29.980 -0.337 1 1 630 . 3 1 1 A 56 56 GLN N N 56 124.355 126.952 -2.597 1 1 632 . 3 1 1 A 57 57 ARG H H 57 8.440 8.436 0.004 1 1 633 . 3 1 1 A 57 57 ARG HA H 57 5.316 4.491 0.825 1 1 639 . 3 1 1 A 57 57 ARG C C 57 176.188 176.293 -0.105 1 1 640 . 3 1 1 A 57 57 ARG CA C 57 53.940 55.047 -1.107 1 1 641 . 3 1 1 A 57 57 ARG CB C 57 32.426 31.507 0.919 1 1 643 . 3 1 1 A 57 57 ARG N N 57 130.222 127.723 2.499 1 1 645 . 3 1 1 A 58 58 GLU H H 58 8.891 9.457 -0.566 1 1 646 . 3 1 1 A 58 58 GLU HA H 58 3.996 4.063 -0.067 1 1 649 . 3 1 1 A 58 58 GLU CA C 58 58.364 57.332 1.032 1 1 650 . 3 1 1 A 58 58 GLU CB C 58 30.875 27.412 3.463 1 1 651 . 3 1 1 A 58 58 GLU N N 58 131.208 125.451 5.757 1 1 652 . 3 1 1 A 59 59 GLY H H 59 8.367 8.398 -0.031 1 1 653 . 3 1 1 A 59 59 GLY HA2 H 59 4.334 3.770 0.564 1 1 654 . 3 1 1 A 59 59 GLY HA3 H 59 3.743 3.855 -0.112 1 1 655 . 3 1 1 A 59 59 GLY C C 59 174.194 175.018 -0.824 1 1 656 . 3 1 1 A 59 59 GLY CA C 59 45.666 46.356 -0.690 1 1 657 . 3 1 1 A 60 60 SER H H 60 8.071 8.305 -0.234 1 1 658 . 3 1 1 A 60 60 SER HA H 60 4.730 4.269 0.461 1 1 661 . 3 1 1 A 60 60 SER C C 60 173.908 174.334 -0.426 1 1 662 . 3 1 1 A 60 60 SER CA C 60 58.762 60.069 -1.307 1 1 663 . 3 1 1 A 60 60 SER CB C 60 64.497 64.146 0.351 1 1 664 . 3 1 1 A 60 60 SER N N 60 114.636 116.801 -2.165 1 1 665 . 3 1 1 A 61 61 GLY H H 61 8.401 7.216 1.185 1 1 666 . 3 1 1 A 61 61 GLY HA2 H 61 4.560 4.026 0.534 1 1 667 . 3 1 1 A 61 61 GLY HA3 H 61 3.878 4.035 -0.157 1 1 668 . 3 1 1 A 61 61 GLY C C 61 173.526 171.387 2.139 1 1 669 . 3 1 1 A 61 61 GLY CA C 61 44.906 45.948 -1.042 1 1 670 . 3 1 1 A 61 61 GLY N N 61 109.421 105.433 3.988 1 1 671 . 3 1 1 A 62 62 TRP H H 62 8.861 8.500 0.361 1 1 672 . 3 1 1 A 62 62 TRP HA H 62 5.089 5.453 -0.364 1 1 681 . 3 1 1 A 62 62 TRP C C 62 176.168 175.761 0.407 1 1 682 . 3 1 1 A 62 62 TRP CA C 62 57.459 56.641 0.818 1 1 683 . 3 1 1 A 62 62 TRP CB C 62 32.536 32.546 -0.010 1 1 689 . 3 1 1 A 62 62 TRP N N 62 122.939 120.382 2.557 1 1 691 . 3 1 1 A 63 63 GLU H H 63 9.306 9.262 0.044 1 1 692 . 3 1 1 A 63 63 GLU HA H 63 4.919 5.268 -0.349 1 1 697 . 3 1 1 A 63 63 GLU C C 63 173.770 174.962 -1.192 1 1 698 . 3 1 1 A 63 63 GLU CA C 63 55.953 55.624 0.329 1 1 699 . 3 1 1 A 63 63 GLU CB C 63 35.317 33.889 1.428 1 1 701 . 3 1 1 A 63 63 GLU N N 63 120.136 120.040 0.096 1 1 702 . 3 1 1 A 64 64 LEU H H 64 8.998 9.407 -0.409 1 1 703 . 3 1 1 A 64 64 LEU HA H 64 5.616 5.480 0.136 1 1 712 . 3 1 1 A 64 64 LEU C C 64 175.014 173.988 1.026 1 1 713 . 3 1 1 A 64 64 LEU CA C 64 52.945 54.205 -1.260 1 1 714 . 3 1 1 A 64 64 LEU CB C 64 46.904 45.698 1.206 1 1 717 . 3 1 1 A 64 64 LEU N N 64 127.321 126.420 0.901 1 1 718 . 3 1 1 A 65 65 LYS H H 65 9.322 9.874 -0.552 1 1 719 . 3 1 1 A 65 65 LYS HA H 65 5.347 5.528 -0.181 1 1 727 . 3 1 1 A 65 65 LYS C C 65 175.811 175.198 0.613 1 1 728 . 3 1 1 A 65 65 LYS CA C 65 55.817 55.184 0.633 1 1 729 . 3 1 1 A 65 65 LYS CB C 65 34.521 34.631 -0.110 1 1 733 . 3 1 1 A 65 65 LYS N N 65 129.874 128.637 1.237 1 1 734 . 3 1 1 A 66 66 CYS H H 66 9.129 9.327 -0.198 1 1 735 . 3 1 1 A 66 66 CYS HA H 66 5.319 4.963 0.356 1 1 738 . 3 1 1 A 66 66 CYS CA C 66 54.532 56.678 -2.146 1 1 739 . 3 1 1 A 66 66 CYS CB C 66 28.813 30.255 -1.442 1 1 740 . 3 1 1 A 66 66 CYS N N 66 121.497 125.453 -3.956 1 1 741 . 3 1 1 A 67 67 PRO HA H 67 4.439 4.389 0.050 1 1 748 . 3 1 1 A 67 67 PRO C C 67 177.297 177.710 -0.413 1 1 749 . 3 1 1 A 67 67 PRO CA C 67 63.596 62.738 0.858 1 1 750 . 3 1 1 A 67 67 PRO CB C 67 32.242 29.746 2.496 1 1 752 . 3 1 1 A 68 68 GLY H H 68 8.316 9.145 -0.829 1 1 753 . 3 1 1 A 68 68 GLY HA2 H 68 3.726 3.870 -0.144 1 1 754 . 3 1 1 A 68 68 GLY HA3 H 68 4.095 3.922 0.173 1 1 755 . 3 1 1 A 68 68 GLY C C 68 173.789 173.549 0.240 1 1 756 . 3 1 1 A 68 68 GLY CA C 68 45.227 45.415 -0.188 1 1 757 . 3 1 1 A 68 68 GLY N N 68 109.533 109.735 -0.202 1 1 758 . 3 1 1 A 69 69 VAL H H 69 8.114 7.640 0.474 1 1 759 . 3 1 1 A 69 69 VAL HA H 69 4.266 4.292 -0.026 1 1 764 . 3 1 1 A 69 69 VAL C C 69 176.299 175.746 0.553 1 1 765 . 3 1 1 A 69 69 VAL CA C 69 61.945 61.558 0.387 1 1 766 . 3 1 1 A 69 69 VAL CB C 69 33.082 33.788 -0.706 1 1 768 . 3 1 1 A 69 69 VAL N N 69 118.540 120.809 -2.269 1 1 769 . 3 1 1 A 70 70 THR H H 70 8.324 8.963 -0.639 1 1 770 . 3 1 1 A 70 70 THR HA H 70 4.373 3.944 0.429 1 1 775 . 3 1 1 A 70 70 THR C C 70 175.204 177.047 -1.843 1 1 776 . 3 1 1 A 70 70 THR CA C 70 62.309 66.598 -4.289 1 1 777 . 3 1 1 A 70 70 THR CB C 70 69.787 68.505 1.282 1 1 779 . 3 1 1 A 70 70 THR N N 70 117.636 120.601 -2.965 1 1 780 . 3 1 1 A 71 71 GLY H H 71 8.574 8.037 0.537 1 1 781 . 3 1 1 A 71 71 GLY HA2 H 71 4.096 3.911 0.185 1 1 782 . 3 1 1 A 71 71 GLY HA3 H 71 3.975 3.925 0.050 1 1 783 . 3 1 1 A 71 71 GLY C C 71 174.313 173.633 0.680 1 1 784 . 3 1 1 A 71 71 GLY CA C 71 45.545 45.830 -0.285 1 1 785 . 3 1 1 A 71 71 GLY N N 71 111.677 107.983 3.694 1 1 786 . 3 1 1 A 72 72 VAL H H 72 7.945 7.855 0.090 1 1 787 . 3 1 1 A 72 72 VAL HA H 72 4.258 3.858 0.400 1 1 795 . 3 1 1 A 72 72 VAL C C 72 176.162 175.877 0.285 1 1 796 . 3 1 1 A 72 72 VAL CA C 72 62.227 62.612 -0.385 1 1 797 . 3 1 1 A 72 72 VAL CB C 72 32.997 29.981 3.016 1 1 799 . 3 1 1 A 72 72 VAL N N 72 118.647 115.320 3.327 1 1 800 . 3 1 1 A 73 73 SER H H 73 8.498 8.209 0.289 1 1 801 . 3 1 1 A 73 73 SER HA H 73 4.617 4.559 0.058 1 1 803 . 3 1 1 A 73 73 SER C C 73 174.461 174.665 -0.204 1 1 804 . 3 1 1 A 73 73 SER CA C 73 58.218 60.355 -2.137 1 1 805 . 3 1 1 A 73 73 SER CB C 73 64.061 64.161 -0.100 1 1 806 . 3 1 1 A 73 73 SER N N 73 118.828 118.337 0.491 1 1 807 . 3 1 1 A 74 74 GLY H H 74 8.247 7.307 0.940 1 1 808 . 3 1 1 A 74 74 GLY HA2 H 74 4.101 4.125 -0.024 1 1 809 . 3 1 1 A 74 74 GLY HA3 H 74 4.304 4.204 0.100 1 1 810 . 3 1 1 A 74 74 GLY CA C 74 44.896 45.421 -0.525 1 1 811 . 3 1 1 A 74 74 GLY N N 74 111.138 105.091 6.047 1 1 812 . 3 1 1 A 75 75 PRO HA H 75 4.461 4.839 -0.378 1 1 819 . 3 1 1 A 75 75 PRO C C 75 176.798 175.986 0.812 1 1 820 . 3 1 1 A 75 75 PRO CA C 75 63.466 62.874 0.592 1 1 821 . 3 1 1 A 75 75 PRO CB C 75 31.980 31.437 0.543 1 1 824 . 3 1 1 A 76 76 HIS H H 76 8.397 8.382 0.015 1 1 825 . 3 1 1 A 76 76 HIS HA H 76 4.742 5.035 -0.293 1 1 829 . 3 1 1 A 76 76 HIS C C 76 174.282 175.328 -1.046 1 1 830 . 3 1 1 A 76 76 HIS CA C 76 55.579 54.440 1.139 1 1 831 . 3 1 1 A 76 76 HIS CB C 76 30.501 33.275 -2.774 1 1 832 . 3 1 1 A 76 76 HIS N N 76 118.431 123.177 -4.746 1 1 833 . 3 1 1 A 77 77 ASN H H 77 8.364 9.395 -1.031 1 1 834 . 3 1 1 A 77 77 ASN HA H 77 4.767 4.363 0.404 1 1 839 . 3 1 1 A 77 77 ASN C C 77 174.576 174.199 0.377 1 1 840 . 3 1 1 A 77 77 ASN CA C 77 53.139 54.363 -1.224 1 1 841 . 3 1 1 A 77 77 ASN CB C 77 39.320 37.748 1.572 1 1 842 . 3 1 1 A 77 77 ASN N N 77 119.421 121.385 -1.964 1 1 844 . 3 1 1 A 78 78 GLU H H 78 8.683 8.439 0.244 1 1 845 . 3 1 1 A 78 78 GLU HA H 78 4.409 3.771 0.638 1 1 850 . 3 1 1 A 78 78 GLU C C 78 175.791 174.758 1.033 1 1 851 . 3 1 1 A 78 78 GLU CA C 78 56.359 58.668 -2.309 1 1 852 . 3 1 1 A 78 78 GLU CB C 78 30.818 28.216 2.602 1 1 854 . 3 1 1 A 78 78 GLU N N 78 122.085 112.814 9.271 1 1 855 . 3 1 1 A 79 79 TYR H H 79 8.341 8.037 0.304 1 1 856 . 3 1 1 A 79 79 TYR HA H 79 4.988 5.552 -0.564 1 1 861 . 3 1 1 A 79 79 TYR C C 79 175.837 174.018 1.819 1 1 862 . 3 1 1 A 79 79 TYR CA C 79 58.028 56.759 1.269 1 1 863 . 3 1 1 A 79 79 TYR CB C 79 41.672 42.998 -1.326 1 1 866 . 3 1 1 A 79 79 TYR N N 79 119.452 116.797 2.655 1 1 867 . 3 1 1 A 80 80 VAL H H 80 9.366 9.303 0.063 1 1 868 . 3 1 1 A 80 80 VAL HA H 80 4.370 5.024 -0.654 1 1 873 . 3 1 1 A 80 80 VAL C C 80 174.948 173.541 1.407 1 1 874 . 3 1 1 A 80 80 VAL CA C 80 61.190 59.937 1.253 1 1 875 . 3 1 1 A 80 80 VAL CB C 80 34.204 35.720 -1.516 1 1 877 . 3 1 1 A 80 80 VAL N N 80 120.567 120.059 0.508 1 1 878 . 3 1 1 A 81 81 GLU H H 81 8.570 9.211 -0.641 1 1 879 . 3 1 1 A 81 81 GLU HA H 81 4.770 5.180 -0.410 1 1 883 . 3 1 1 A 81 81 GLU C C 81 175.491 175.663 -0.172 1 1 884 . 3 1 1 A 81 81 GLU CA C 81 55.655 55.040 0.615 1 1 885 . 3 1 1 A 81 81 GLU CB C 81 30.415 31.969 -1.554 1 1 887 . 3 1 1 A 81 81 GLU N N 81 124.248 127.239 -2.991 1 1 888 . 3 1 1 A 82 82 VAL H H 82 9.189 9.234 -0.045 1 1 889 . 3 1 1 A 82 82 VAL HA H 82 4.279 4.927 -0.648 1 1 894 . 3 1 1 A 82 82 VAL C C 82 176.087 175.590 0.497 1 1 895 . 3 1 1 A 82 82 VAL CA C 82 62.672 60.656 2.016 1 1 896 . 3 1 1 A 82 82 VAL CB C 82 33.121 34.091 -0.970 1 1 898 . 3 1 1 A 82 82 VAL N N 82 127.776 120.849 6.927 1 1 899 . 3 1 1 A 83 83 THR H H 83 8.590 8.621 -0.031 1 1 900 . 3 1 1 A 83 83 THR HA H 83 4.955 4.610 0.345 1 1 905 . 3 1 1 A 83 83 THR C C 83 174.688 174.953 -0.265 1 1 906 . 3 1 1 A 83 83 THR CA C 83 61.332 61.425 -0.093 1 1 907 . 3 1 1 A 83 83 THR CB C 83 70.213 70.482 -0.269 1 1 909 . 3 1 1 A 83 83 THR N N 83 114.744 115.384 -0.640 1 1 910 . 3 1 1 A 84 84 SER H H 84 7.650 7.403 0.247 1 1 911 . 3 1 1 A 84 84 SER HA H 84 4.819 4.273 0.546 1 1 914 . 3 1 1 A 84 84 SER CA C 84 56.280 60.254 -3.974 1 1 915 . 3 1 1 A 84 84 SER CB C 84 63.294 63.426 -0.132 1 1 916 . 3 1 1 A 84 84 SER N N 84 118.038 118.872 -0.834 1 1 917 . 3 1 1 A 85 85 GLU H H 85 8.391 8.700 -0.309 1 1 918 . 3 1 1 A 85 85 GLU HA H 85 3.661 3.949 -0.288 1 1 923 . 3 1 1 A 85 85 GLU C C 85 177.520 178.285 -0.765 1 1 924 . 3 1 1 A 85 85 GLU CA C 85 62.429 59.635 2.794 1 1 925 . 3 1 1 A 85 85 GLU CB C 85 29.655 29.438 0.217 1 1 927 . 3 1 1 A 86 86 ALA H H 86 8.443 8.044 0.399 1 1 928 . 3 1 1 A 86 86 ALA HA H 86 4.027 4.024 0.003 1 1 932 . 3 1 1 A 86 86 ALA C C 86 180.423 180.017 0.406 1 1 933 . 3 1 1 A 86 86 ALA CA C 86 55.145 54.722 0.423 1 1 934 . 3 1 1 A 86 86 ALA CB C 86 18.165 18.195 -0.030 1 1 935 . 3 1 1 A 86 86 ALA N N 86 119.636 122.627 -2.991 1 1 936 . 3 1 1 A 87 87 ALA H H 87 7.214 7.480 -0.266 1 1 937 . 3 1 1 A 87 87 ALA HA H 87 4.244 4.032 0.212 1 1 941 . 3 1 1 A 87 87 ALA C C 87 180.354 180.193 0.161 1 1 942 . 3 1 1 A 87 87 ALA CA C 87 54.378 54.932 -0.554 1 1 943 . 3 1 1 A 87 87 ALA CB C 87 18.795 18.511 0.284 1 1 944 . 3 1 1 A 87 87 ALA N N 87 121.004 120.185 0.819 1 1 945 . 3 1 1 A 88 88 ILE H H 88 8.471 7.526 0.945 1 1 946 . 3 1 1 A 88 88 ILE HA H 88 3.360 3.713 -0.353 1 1 954 . 3 1 1 A 88 88 ILE CA C 88 66.323 64.524 1.799 1 1 955 . 3 1 1 A 88 88 ILE CB C 88 37.808 37.541 0.267 1 1 958 . 3 1 1 A 88 88 ILE N N 88 120.743 119.513 1.230 1 1 959 . 3 1 1 A 89 89 VAL H H 89 8.343 8.255 0.088 1 1 960 . 3 1 1 A 89 89 VAL HA H 89 3.061 3.452 -0.391 1 1 968 . 3 1 1 A 89 89 VAL C C 89 176.708 177.931 -1.223 1 1 969 . 3 1 1 A 89 89 VAL CA C 89 67.833 66.551 1.282 1 1 970 . 3 1 1 A 89 89 VAL CB C 89 31.509 31.403 0.106 1 1 973 . 3 1 1 A 89 89 VAL N N 89 118.049 120.062 -2.013 1 1 974 . 3 1 1 A 90 90 ALA H H 90 7.516 7.807 -0.291 1 1 975 . 3 1 1 A 90 90 ALA HA H 90 3.987 3.800 0.187 1 1 979 . 3 1 1 A 90 90 ALA C C 90 180.744 179.149 1.595 1 1 980 . 3 1 1 A 90 90 ALA CA C 90 55.481 55.400 0.081 1 1 981 . 3 1 1 A 90 90 ALA CB C 90 17.953 18.077 -0.124 1 1 982 . 3 1 1 A 90 90 ALA N N 90 118.935 121.294 -2.359 1 1 983 . 3 1 1 A 91 91 GLN H H 91 7.886 7.631 0.255 1 1 984 . 3 1 1 A 91 91 GLN HA H 91 4.190 4.047 0.143 1 1 991 . 3 1 1 A 91 91 GLN C C 91 178.832 178.493 0.339 1 1 992 . 3 1 1 A 91 91 GLN CA C 91 58.519 58.814 -0.295 1 1 993 . 3 1 1 A 91 91 GLN CB C 91 28.091 28.286 -0.195 1 1 995 . 3 1 1 A 91 91 GLN N N 91 117.846 118.268 -0.422 1 1 997 . 3 1 1 A 92 92 LEU H H 92 8.751 8.675 0.076 1 1 998 . 3 1 1 A 92 92 LEU HA H 92 3.903 3.928 -0.025 1 1 1007 . 3 1 1 A 92 92 LEU C C 92 178.997 178.663 0.334 1 1 1008 . 3 1 1 A 92 92 LEU CA C 92 58.136 57.807 0.329 1 1 1009 . 3 1 1 A 92 92 LEU CB C 92 41.576 41.327 0.249 1 1 1013 . 3 1 1 A 92 92 LEU N N 92 119.547 119.697 -0.150 1 1 1014 . 3 1 1 A 93 93 PHE H H 93 8.648 7.957 0.691 1 1 1015 . 3 1 1 A 93 93 PHE HA H 93 4.270 4.391 -0.121 1 1 1020 . 3 1 1 A 93 93 PHE C C 93 179.283 178.793 0.490 1 1 1021 . 3 1 1 A 93 93 PHE CA C 93 59.860 60.299 -0.439 1 1 1022 . 3 1 1 A 93 93 PHE CB C 93 37.765 38.640 -0.875 1 1 1025 . 3 1 1 A 93 93 PHE N N 93 118.041 119.830 -1.789 1 1 1026 . 3 1 1 A 94 94 GLU H H 94 7.739 8.212 -0.473 1 1 1027 . 3 1 1 A 94 94 GLU HA H 94 4.110 4.134 -0.024 1 1 1031 . 3 1 1 A 94 94 GLU C C 94 178.629 178.807 -0.178 1 1 1032 . 3 1 1 A 94 94 GLU CA C 94 59.359 59.396 -0.037 1 1 1033 . 3 1 1 A 94 94 GLU CB C 94 29.589 29.002 0.587 1 1 1035 . 3 1 1 A 94 94 GLU N N 94 119.980 117.315 2.665 1 1 1036 . 3 1 1 A 95 95 LEU H H 95 7.999 8.233 -0.234 1 1 1037 . 3 1 1 A 95 95 LEU HA H 95 4.139 3.906 0.233 1 1 1047 . 3 1 1 A 95 95 LEU C C 95 178.965 178.536 0.429 1 1 1048 . 3 1 1 A 95 95 LEU CA C 95 57.557 57.814 -0.257 1 1 1049 . 3 1 1 A 95 95 LEU CB C 95 43.443 41.484 1.959 1 1 1053 . 3 1 1 A 95 95 LEU N N 95 118.398 121.593 -3.195 1 1 1054 . 3 1 1 A 96 96 LEU H H 96 8.363 8.101 0.262 1 1 1055 . 3 1 1 A 96 96 LEU HA H 96 4.503 4.192 0.311 1 1 1061 . 3 1 1 A 96 96 LEU C C 96 177.932 177.049 0.883 1 1 1062 . 3 1 1 A 96 96 LEU CA C 96 54.700 55.048 -0.348 1 1 1063 . 3 1 1 A 96 96 LEU CB C 96 43.048 42.341 0.707 1 1 1065 . 3 1 1 A 96 96 LEU N N 96 114.720 116.815 -2.095 1 1 1066 . 3 1 1 A 97 97 GLY H H 97 7.810 7.446 0.364 1 1 1067 . 3 1 1 A 97 97 GLY HA2 H 97 3.963 3.893 0.070 1 1 1068 . 3 1 1 A 97 97 GLY C C 97 173.535 174.717 -1.182 1 1 1069 . 3 1 1 A 97 97 GLY CA C 97 45.667 46.418 -0.751 1 1 1070 . 3 1 1 A 97 97 GLY N N 97 109.511 107.460 2.051 1 1 1071 . 3 1 1 A 98 98 SER H H 98 8.131 8.427 -0.296 1 1 1072 . 3 1 1 A 98 98 SER HA H 98 4.225 4.459 -0.234 1 1 1075 . 3 1 1 A 98 98 SER C C 98 174.974 174.694 0.280 1 1 1076 . 3 1 1 A 98 98 SER CA C 98 57.960 58.727 -0.767 1 1 1077 . 3 1 1 A 98 98 SER CB C 98 63.997 63.649 0.348 1 1 1078 . 3 1 1 A 98 98 SER N N 98 113.405 116.062 -2.657 1 1 1079 . 3 1 1 A 99 99 GLY H H 99 8.052 8.511 -0.459 1 1 1080 . 3 1 1 A 99 99 GLY HA2 H 99 3.998 4.124 -0.126 1 1 1081 . 3 1 1 A 99 99 GLY HA3 H 99 3.778 4.156 -0.378 1 1 1082 . 3 1 1 A 99 99 GLY C C 99 174.033 174.091 -0.058 1 1 1083 . 3 1 1 A 99 99 GLY CA C 99 45.123 45.422 -0.299 1 1 1084 . 3 1 1 A 99 99 GLY N N 99 111.534 114.621 -3.087 1 1 1085 . 3 1 1 A 100 100 GLU H H 100 8.177 7.686 0.491 1 1 1086 . 3 1 1 A 100 100 GLU HA H 100 4.201 4.689 -0.488 1 1 1091 . 3 1 1 A 100 100 GLU C C 100 175.830 176.059 -0.229 1 1 1092 . 3 1 1 A 100 100 GLU CA C 100 56.442 55.857 0.585 1 1 1093 . 3 1 1 A 100 100 GLU CB C 100 30.428 31.522 -1.094 1 1 1095 . 3 1 1 A 100 100 GLU N N 100 120.463 119.721 0.742 1 1 1096 . 3 1 1 A 101 101 GLN H H 101 8.161 8.435 -0.274 1 1 1097 . 3 1 1 A 101 101 GLN HA H 101 4.098 4.576 -0.478 1 1 1103 . 3 1 1 A 101 101 GLN C C 101 175.412 176.013 -0.601 1 1 1104 . 3 1 1 A 101 101 GLN CA C 101 55.632 55.734 -0.102 1 1 1105 . 3 1 1 A 101 101 GLN CB C 101 29.569 29.819 -0.250 1 1 1107 . 3 1 1 A 101 101 GLN N N 101 120.014 120.755 -0.741 1 1 1109 . 3 1 1 A 102 102 LYS H H 102 8.235 8.536 -0.301 1 1 1110 . 3 1 1 A 102 102 LYS HA H 102 4.387 3.945 0.442 1 1 1117 . 3 1 1 A 102 102 LYS CA C 102 54.116 54.411 -0.295 1 1 1118 . 3 1 1 A 102 102 LYS CB C 102 32.478 32.182 0.296 1 1 1122 . 3 1 1 A 102 102 LYS N N 102 123.399 122.445 0.954 1 1 1123 . 3 1 1 A 103 103 PRO HA H 103 4.498 4.394 0.104 1 1 1129 . 3 1 1 A 103 103 PRO C C 103 175.473 177.093 -1.620 1 1 1130 . 3 1 1 A 103 103 PRO CA C 103 62.802 65.476 -2.674 1 1 1131 . 3 1 1 A 103 103 PRO CB C 103 32.124 31.629 0.495 1 1 1134 . 3 1 1 A 104 104 ALA H H 104 8.017 7.273 0.744 1 1 1135 . 3 1 1 A 104 104 ALA HA H 104 4.318 4.333 -0.015 1 1 1139 . 3 1 1 A 104 104 ALA C C 104 176.717 176.950 -0.233 1 1 1140 . 3 1 1 A 104 104 ALA CA C 104 52.194 53.244 -1.050 1 1 1141 . 3 1 1 A 104 104 ALA CB C 104 20.113 20.355 -0.242 1 1 1142 . 3 1 1 A 104 104 ALA N N 104 122.093 117.166 4.927 1 1 1143 . 3 1 1 A 105 105 GLY H H 105 7.678 8.251 -0.573 1 1 1144 . 3 1 1 A 105 105 GLY HA2 H 105 3.851 4.090 -0.239 1 1 1145 . 3 1 1 A 105 105 GLY HA3 H 105 4.053 4.120 -0.067 1 1 1146 . 3 1 1 A 105 105 GLY C C 105 172.990 174.870 -1.880 1 1 1147 . 3 1 1 A 105 105 GLY CA C 105 44.241 43.757 0.484 1 1 1148 . 3 1 1 A 105 105 GLY N N 105 105.234 104.491 0.743 1 1 1149 . 3 1 1 A 106 106 VAL H H 106 8.409 8.717 -0.308 1 1 1150 . 3 1 1 A 106 106 VAL HA H 106 2.829 3.332 -0.503 1 1 1158 . 3 1 1 A 106 106 VAL C C 106 177.822 177.139 0.683 1 1 1159 . 3 1 1 A 106 106 VAL CA C 106 65.522 65.613 -0.091 1 1 1160 . 3 1 1 A 106 106 VAL CB C 106 30.701 30.748 -0.047 1 1 1163 . 3 1 1 A 106 106 VAL N N 106 119.215 119.095 0.120 1 1 1164 . 3 1 1 A 107 107 ALA H H 107 8.707 8.330 0.377 1 1 1165 . 3 1 1 A 107 107 ALA HA H 107 3.730 3.931 -0.201 1 1 1169 . 3 1 1 A 107 107 ALA C C 107 179.661 179.481 0.180 1 1 1170 . 3 1 1 A 107 107 ALA CA C 107 54.995 55.135 -0.140 1 1 1171 . 3 1 1 A 107 107 ALA CB C 107 17.705 18.165 -0.460 1 1 1172 . 3 1 1 A 107 107 ALA N N 107 118.672 122.005 -3.333 1 1 1173 . 3 1 1 A 108 108 ALA H H 108 7.388 7.722 -0.334 1 1 1174 . 3 1 1 A 108 108 ALA HA H 108 4.259 4.091 0.168 1 1 1178 . 3 1 1 A 108 108 ALA C C 108 179.318 179.330 -0.012 1 1 1179 . 3 1 1 A 108 108 ALA CA C 108 53.481 55.060 -1.579 1 1 1180 . 3 1 1 A 108 108 ALA CB C 108 19.367 18.374 0.993 1 1 1181 . 3 1 1 A 108 108 ALA N N 108 116.635 119.862 -3.227 1 1 1182 . 3 1 1 A 109 109 VAL H H 109 7.689 7.642 0.047 1 1 1183 . 3 1 1 A 109 109 VAL HA H 109 4.532 3.816 0.716 1 1 1191 . 3 1 1 A 109 109 VAL C C 109 176.055 177.806 -1.751 1 1 1192 . 3 1 1 A 109 109 VAL CA C 109 61.452 65.692 -4.240 1 1 1193 . 3 1 1 A 109 109 VAL CB C 109 32.728 31.317 1.411 1 1 1196 . 3 1 1 A 109 109 VAL N N 109 112.851 117.048 -4.197 1 1 1197 . 3 1 1 A 110 110 LEU H H 110 7.099 8.182 -1.083 1 1 1198 . 3 1 1 A 110 110 LEU HA H 110 3.723 3.751 -0.028 1 1 1208 . 3 1 1 A 110 110 LEU C C 110 179.040 178.721 0.319 1 1 1209 . 3 1 1 A 110 110 LEU CA C 110 58.825 57.886 0.939 1 1 1210 . 3 1 1 A 110 110 LEU CB C 110 41.242 41.566 -0.324 1 1 1214 . 3 1 1 A 110 110 LEU N N 110 119.829 125.015 -5.186 1 1 1215 . 3 1 1 A 111 111 GLY H H 111 8.435 7.637 0.798 1 1 1216 . 3 1 1 A 111 111 GLY HA2 H 111 3.970 3.808 0.162 1 1 1217 . 3 1 1 A 111 111 GLY HA3 H 111 3.885 3.808 0.077 1 1 1218 . 3 1 1 A 111 111 GLY C C 111 178.031 176.686 1.345 1 1 1219 . 3 1 1 A 111 111 GLY CA C 111 46.961 47.541 -0.580 1 1 1220 . 3 1 1 A 111 111 GLY N N 111 104.089 106.561 -2.472 1 1 1221 . 3 1 1 A 112 112 SER H H 112 8.343 7.822 0.521 1 1 1222 . 3 1 1 A 112 112 SER HA H 112 4.266 4.133 0.133 1 1 1224 . 3 1 1 A 112 112 SER C C 112 175.885 175.254 0.631 1 1 1225 . 3 1 1 A 112 112 SER CA C 112 61.304 62.577 -1.273 1 1 1226 . 3 1 1 A 112 112 SER CB C 112 62.901 63.010 -0.109 1 1 1227 . 3 1 1 A 112 112 SER N N 112 119.497 119.394 0.103 1 1 1228 . 3 1 1 A 113 113 LEU H H 113 7.667 7.924 -0.257 1 1 1229 . 3 1 1 A 113 113 LEU HA H 113 4.343 4.208 0.135 1 1 1238 . 3 1 1 A 113 113 LEU C C 113 174.760 176.010 -1.250 1 1 1239 . 3 1 1 A 113 113 LEU CA C 113 54.228 54.634 -0.406 1 1 1240 . 3 1 1 A 113 113 LEU CB C 113 41.467 42.048 -0.581 1 1 1244 . 3 1 1 A 113 113 LEU N N 113 118.843 117.691 1.152 1 1 1245 . 3 1 1 A 114 114 LYS H H 114 7.685 7.497 0.188 1 1 1246 . 3 1 1 A 114 114 LYS HA H 114 3.958 3.885 0.073 1 1 1250 . 3 1 1 A 114 114 LYS C C 114 177.557 175.856 1.701 1 1 1251 . 3 1 1 A 114 114 LYS CA C 114 56.935 57.491 -0.556 1 1 1252 . 3 1 1 A 114 114 LYS CB C 114 28.898 29.471 -0.573 1 1 1254 . 3 1 1 A 114 114 LYS N N 114 114.072 116.312 -2.240 1 1 1255 . 3 1 1 A 115 115 LEU H H 115 8.329 7.954 0.375 1 1 1256 . 3 1 1 A 115 115 LEU HA H 115 4.315 4.243 0.072 1 1 1265 . 3 1 1 A 115 115 LEU C C 115 175.988 177.028 -1.040 1 1 1266 . 3 1 1 A 115 115 LEU CA C 115 54.310 55.746 -1.436 1 1 1267 . 3 1 1 A 115 115 LEU CB C 115 44.163 42.306 1.857 1 1 1270 . 3 1 1 A 115 115 LEU N N 115 117.951 119.898 -1.947 1 1 1271 . 3 1 1 A 116 116 GLN H H 116 9.100 8.264 0.836 1 1 1272 . 3 1 1 A 116 116 GLN HA H 116 4.898 4.798 0.100 1 1 1279 . 3 1 1 A 116 116 GLN CA C 116 53.467 55.251 -1.784 1 1 1280 . 3 1 1 A 116 116 GLN CB C 116 32.730 30.039 2.691 1 1 1282 . 3 1 1 A 116 116 GLN N N 116 119.994 122.554 -2.560 1 1 1284 . 3 1 1 A 117 117 GLU H H 117 8.849 8.567 0.282 1 1 1285 . 3 1 1 A 117 117 GLU HA H 117 3.707 4.064 -0.357 1 1 1290 . 3 1 1 A 117 117 GLU C C 117 177.303 176.973 0.330 1 1 1291 . 3 1 1 A 117 117 GLU CA C 117 57.233 56.052 1.181 1 1 1292 . 3 1 1 A 117 117 GLU CB C 117 29.634 29.198 0.436 1 1 1294 . 3 1 1 A 117 117 GLU N N 117 121.487 123.323 -1.836 1 1 1295 . 3 1 1 A 118 118 VAL H H 118 8.983 8.590 0.393 1 1 1296 . 3 1 1 A 118 118 VAL HA H 118 4.360 3.922 0.438 1 1 1304 . 3 1 1 A 118 118 VAL C C 118 174.171 175.285 -1.114 1 1 1305 . 3 1 1 A 118 118 VAL CA C 118 61.772 64.091 -2.319 1 1 1306 . 3 1 1 A 118 118 VAL CB C 118 34.095 32.898 1.197 1 1 1309 . 3 1 1 A 118 118 VAL N N 118 122.933 127.626 -4.693 1 1 1310 . 3 1 1 A 119 119 ALA H H 119 7.023 6.939 0.084 1 1 1311 . 3 1 1 A 119 119 ALA HA H 119 4.378 4.404 -0.026 1 1 1315 . 3 1 1 A 119 119 ALA C C 119 175.493 174.681 0.812 1 1 1316 . 3 1 1 A 119 119 ALA CA C 119 51.956 51.531 0.425 1 1 1317 . 3 1 1 A 119 119 ALA CB C 119 23.957 21.309 2.648 1 1 1318 . 3 1 1 A 119 119 ALA N N 119 117.379 121.188 -3.809 1 1 1319 . 3 1 1 A 120 120 SER H H 120 6.999 8.519 -1.520 1 1 1320 . 3 1 1 A 120 120 SER HA H 120 5.208 5.026 0.182 1 1 1323 . 3 1 1 A 120 120 SER C C 120 173.082 172.819 0.263 1 1 1324 . 3 1 1 A 120 120 SER CA C 120 56.754 56.321 0.433 1 1 1325 . 3 1 1 A 120 120 SER CB C 120 64.605 64.791 -0.186 1 1 1326 . 3 1 1 A 120 120 SER N N 120 113.743 116.796 -3.053 1 1 1327 . 3 1 1 A 121 121 PHE H H 121 8.244 8.678 -0.434 1 1 1328 . 3 1 1 A 121 121 PHE HA H 121 5.177 5.417 -0.240 1 1 1333 . 3 1 1 A 121 121 PHE C C 121 173.569 172.475 1.094 1 1 1334 . 3 1 1 A 121 121 PHE CA C 121 55.555 55.520 0.035 1 1 1335 . 3 1 1 A 121 121 PHE CB C 121 40.959 42.044 -1.085 1 1 1338 . 3 1 1 A 121 121 PHE N N 121 120.358 121.982 -1.624 1 1 1339 . 3 1 1 A 122 122 ILE H H 122 8.907 8.970 -0.063 1 1 1340 . 3 1 1 A 122 122 ILE HA H 122 4.682 4.760 -0.078 1 1 1348 . 3 1 1 A 122 122 ILE C C 122 176.925 175.050 1.875 1 1 1349 . 3 1 1 A 122 122 ILE CA C 122 60.740 59.988 0.752 1 1 1350 . 3 1 1 A 122 122 ILE CB C 122 39.497 40.160 -0.663 1 1 1353 . 3 1 1 A 122 122 ILE N N 122 121.282 120.169 1.113 1 1 1354 . 3 1 1 A 123 123 THR H H 123 9.022 8.822 0.200 1 1 1355 . 3 1 1 A 123 123 THR HA H 123 5.039 4.692 0.347 1 1 1360 . 3 1 1 A 123 123 THR C C 123 173.531 173.916 -0.385 1 1 1361 . 3 1 1 A 123 123 THR CA C 123 62.266 61.781 0.485 1 1 1362 . 3 1 1 A 123 123 THR CB C 123 70.677 68.981 1.696 1 1 1364 . 3 1 1 A 123 123 THR N N 123 128.965 123.525 5.440 1 1 1365 . 3 1 1 A 124 124 THR H H 124 8.961 9.172 -0.211 1 1 1366 . 3 1 1 A 124 124 THR HA H 124 5.001 5.109 -0.108 1 1 1371 . 3 1 1 A 124 124 THR C C 124 173.468 172.726 0.742 1 1 1372 . 3 1 1 A 124 124 THR CA C 124 62.109 61.585 0.524 1 1 1373 . 3 1 1 A 124 124 THR CB C 124 70.450 69.567 0.883 1 1 1375 . 3 1 1 A 124 124 THR N N 124 122.176 123.895 -1.719 1 1 1376 . 3 1 1 A 125 125 ARG H H 125 9.386 9.845 -0.459 1 1 1377 . 3 1 1 A 125 125 ARG HA H 125 5.764 5.177 0.587 1 1 1384 . 3 1 1 A 125 125 ARG C C 125 175.713 174.821 0.892 1 1 1385 . 3 1 1 A 125 125 ARG CA C 125 53.991 54.363 -0.372 1 1 1386 . 3 1 1 A 125 125 ARG CB C 125 33.557 32.968 0.589 1 1 1389 . 3 1 1 A 125 125 ARG N N 125 130.004 128.916 1.088 1 1 1390 . 3 1 1 A 126 126 SER H H 126 9.172 9.542 -0.370 1 1 1391 . 3 1 1 A 126 126 SER HA H 126 5.390 5.091 0.299 1 1 1394 . 3 1 1 A 126 126 SER C C 126 172.359 173.529 -1.170 1 1 1395 . 3 1 1 A 126 126 SER CA C 126 56.934 57.704 -0.770 1 1 1396 . 3 1 1 A 126 126 SER CB C 126 65.827 65.617 0.210 1 1 1397 . 3 1 1 A 126 126 SER N N 126 119.906 123.034 -3.128 1 1 1398 . 3 1 1 A 127 127 SER H H 127 8.591 9.273 -0.682 1 1 1399 . 3 1 1 A 127 127 SER HA H 127 5.739 5.345 0.394 1 1 1401 . 3 1 1 A 127 127 SER C C 127 173.283 173.019 0.264 1 1 1402 . 3 1 1 A 127 127 SER CA C 127 57.354 57.686 -0.332 1 1 1403 . 3 1 1 A 127 127 SER CB C 127 65.412 64.489 0.923 1 1 1404 . 3 1 1 A 127 127 SER N N 127 117.914 123.161 -5.247 1 1 1405 . 3 1 1 A 128 128 TRP H H 128 9.866 9.736 0.130 1 1 1406 . 3 1 1 A 128 128 TRP HA H 128 5.560 5.772 -0.212 1 1 1415 . 3 1 1 A 128 128 TRP C C 128 175.828 174.948 0.880 1 1 1416 . 3 1 1 A 128 128 TRP CA C 128 55.852 55.816 0.036 1 1 1417 . 3 1 1 A 128 128 TRP CB C 128 32.524 32.959 -0.435 1 1 1423 . 3 1 1 A 128 128 TRP N N 128 127.978 126.094 1.884 1 1 1425 . 3 1 1 A 129 129 LYS H H 129 9.424 9.157 0.267 1 1 1426 . 3 1 1 A 129 129 LYS HA H 129 5.388 5.358 0.030 1 1 1433 . 3 1 1 A 129 129 LYS C C 129 175.254 174.034 1.220 1 1 1434 . 3 1 1 A 129 129 LYS CA C 129 54.410 54.956 -0.546 1 1 1435 . 3 1 1 A 129 129 LYS CB C 129 35.734 36.133 -0.399 1 1 1439 . 3 1 1 A 129 129 LYS N N 129 121.784 122.485 -0.701 1 1 1440 . 3 1 1 A 130 130 LEU H H 130 8.933 9.518 -0.585 1 1 1441 . 3 1 1 A 130 130 LEU HA H 130 4.859 5.001 -0.142 1 1 1447 . 3 1 1 A 130 130 LEU C C 130 173.893 174.613 -0.720 1 1 1448 . 3 1 1 A 130 130 LEU CA C 130 53.848 53.924 -0.076 1 1 1449 . 3 1 1 A 130 130 LEU CB C 130 46.125 45.669 0.456 1 1 1451 . 3 1 1 A 130 130 LEU N N 130 124.543 128.381 -3.838 1 1 1452 . 3 1 1 A 131 131 ALA H H 131 8.816 8.831 -0.015 1 1 1453 . 3 1 1 A 131 131 ALA HA H 131 4.776 4.781 -0.005 1 1 1457 . 3 1 1 A 131 131 ALA C C 131 176.662 176.631 0.031 1 1 1458 . 3 1 1 A 131 131 ALA CA C 131 51.407 51.016 0.391 1 1 1459 . 3 1 1 A 131 131 ALA CB C 131 19.354 19.762 -0.408 1 1 1460 . 3 1 1 A 131 131 ALA N N 131 131.102 130.589 0.513 1 1 1461 . 3 1 1 A 132 132 LEU H H 132 8.487 8.763 -0.276 1 1 1462 . 3 1 1 A 132 132 LEU HA H 132 4.470 4.452 0.018 1 1 1470 . 3 1 1 A 132 132 LEU C C 132 176.873 177.347 -0.474 1 1 1471 . 3 1 1 A 132 132 LEU CA C 132 54.590 54.876 -0.286 1 1 1472 . 3 1 1 A 132 132 LEU CB C 132 42.974 42.805 0.169 1 1 1475 . 3 1 1 A 132 132 LEU N N 132 123.724 125.872 -2.148 1 1 1476 . 3 1 1 A 133 133 SER H H 133 8.448 8.855 -0.407 1 1 1477 . 3 1 1 A 133 133 SER HA H 133 4.560 4.595 -0.035 1 1 1479 . 3 1 1 A 133 133 SER C C 133 176.043 174.944 1.099 1 1 1480 . 3 1 1 A 133 133 SER CA C 133 58.460 58.065 0.395 1 1 1481 . 3 1 1 A 133 133 SER CB C 133 63.985 65.130 -1.145 1 1 1482 . 3 1 1 A 133 133 SER N N 133 115.880 114.124 1.756 1 1 1483 . 3 1 1 A 134 134 GLY H H 134 8.232 8.143 0.089 1 1 1484 . 3 1 1 A 134 134 GLY HA2 H 134 4.147 3.955 0.192 1 1 1485 . 3 1 1 A 134 134 GLY HA3 H 134 4.045 3.957 0.088 1 1 1486 . 3 1 1 A 134 134 GLY C C 134 174.013 174.878 -0.865 1 1 1487 . 3 1 1 A 134 134 GLY CA C 134 45.337 47.024 -1.687 1 1 1488 . 3 1 1 A 134 134 GLY N N 134 109.970 110.217 -0.247 1 1 1489 . 3 1 1 A 135 135 ALA H H 135 8.424 8.490 -0.066 1 1 1490 . 3 1 1 A 135 135 ALA HA H 135 4.436 4.344 0.092 1 1 1494 . 3 1 1 A 135 135 ALA C C 135 177.537 177.307 0.230 1 1 1495 . 3 1 1 A 135 135 ALA CA C 135 52.721 54.068 -1.347 1 1 1496 . 3 1 1 A 135 135 ALA CB C 135 19.265 19.782 -0.517 1 1 1497 . 3 1 1 A 135 135 ALA N N 135 124.118 129.226 -5.108 1 1 1498 . 3 1 1 A 136 136 HIS H H 136 8.466 7.651 0.815 1 1 1499 . 3 1 1 A 136 136 HIS HA H 136 4.379 4.848 -0.469 1 1 1500 . 3 1 1 A 136 136 HIS C C 136 176.259 173.708 2.551 1 1 1501 . 3 1 1 A 136 136 HIS CA C 136 56.082 55.599 0.483 1 1 1502 . 3 1 1 A 136 136 HIS CB C 136 29.619 32.747 -3.128 1 1 1503 . 3 1 1 A 136 136 HIS N N 136 119.493 114.895 4.598 1 1 1504 . 3 1 1 A 137 137 GLY H H 137 8.431 8.118 0.313 1 1 1505 . 3 1 1 A 137 137 GLY HA2 H 137 4.151 3.879 0.272 1 1 1506 . 3 1 1 A 137 137 GLY HA3 H 137 3.893 3.979 -0.086 1 1 1507 . 3 1 1 A 137 137 GLY C C 137 174.039 171.800 2.239 1 1 1508 . 3 1 1 A 137 137 GLY CA C 137 45.372 45.034 0.338 1 1 1509 . 3 1 1 A 137 137 GLY N N 137 110.442 111.248 -0.806 1 1 1510 . 3 1 1 A 138 138 GLN H H 138 8.416 8.179 0.237 1 1 1511 . 3 1 1 A 138 138 GLN HA H 138 4.455 4.799 -0.344 1 1 1515 . 3 1 1 A 138 138 GLN C C 138 175.889 175.007 0.882 1 1 1516 . 3 1 1 A 138 138 GLN CA C 138 55.866 54.976 0.890 1 1 1517 . 3 1 1 A 138 138 GLN CB C 138 29.639 29.698 -0.059 1 1 1518 . 3 1 1 A 138 138 GLN N N 138 119.401 119.620 -0.219 1 1 1519 . 3 1 1 A 139 139 GLU H H 139 8.446 8.647 -0.201 1 1 1520 . 3 1 1 A 139 139 GLU HA H 139 4.658 4.871 -0.213 1 1 1524 . 3 1 1 A 139 139 GLU CA C 139 54.589 53.304 1.285 1 1 1525 . 3 1 1 A 139 139 GLU CB C 139 29.733 32.773 -3.040 1 1 1527 . 3 1 1 A 139 139 GLU N N 139 123.136 123.175 -0.039 1 1 1528 . 3 1 1 A 140 140 PRO HA H 140 4.537 4.574 -0.037 1 1 1533 . 3 1 1 A 140 140 PRO C C 140 176.119 175.660 0.459 1 1 1534 . 3 1 1 A 140 140 PRO CA C 140 63.220 62.526 0.694 1 1 1535 . 3 1 1 A 140 140 PRO CB C 140 31.936 32.540 -0.604 1 1 1538 . 3 1 1 A 141 141 GLN H H 141 8.506 8.596 -0.090 1 1 1539 . 3 1 1 A 141 141 GLN HA H 141 4.650 4.593 0.057 1 1 1546 . 3 1 1 A 141 141 GLN C C 141 175.811 175.724 0.087 1 1 1547 . 3 1 1 A 141 141 GLN CA C 141 55.912 55.296 0.616 1 1 1548 . 3 1 1 A 141 141 GLN CB C 141 30.241 29.070 1.171 1 1 1550 . 3 1 1 A 141 141 GLN N N 141 120.422 121.604 -1.182 1 1 1551 . 3 1 1 A 142 142 LEU H H 142 8.842 8.935 -0.093 1 1 1552 . 3 1 1 A 142 142 LEU HA H 142 5.277 5.193 0.084 1 1 1562 . 3 1 1 A 142 142 LEU C C 142 176.839 175.443 1.396 1 1 1563 . 3 1 1 A 142 142 LEU CA C 142 53.927 52.941 0.986 1 1 1564 . 3 1 1 A 142 142 LEU CB C 142 44.527 44.273 0.254 1 1 1568 . 3 1 1 A 142 142 LEU N N 142 123.692 120.857 2.835 1 1 1569 . 3 1 1 A 143 143 THR H H 143 9.025 9.168 -0.143 1 1 1570 . 3 1 1 A 143 143 THR HA H 143 5.262 5.044 0.218 1 1 1575 . 3 1 1 A 143 143 THR C C 143 173.753 173.870 -0.117 1 1 1576 . 3 1 1 A 143 143 THR CA C 143 61.795 61.829 -0.034 1 1 1577 . 3 1 1 A 143 143 THR CB C 143 70.660 70.675 -0.015 1 1 1579 . 3 1 1 A 143 143 THR N N 143 117.222 115.568 1.654 1 1 1580 . 3 1 1 A 144 144 ILE H H 144 9.353 10.184 -0.831 1 1 1581 . 3 1 1 A 144 144 ILE HA H 144 5.399 5.056 0.343 1 1 1591 . 3 1 1 A 144 144 ILE C C 144 173.931 173.918 0.013 1 1 1592 . 3 1 1 A 144 144 ILE CA C 144 60.774 60.639 0.135 1 1 1593 . 3 1 1 A 144 144 ILE CB C 144 41.111 40.328 0.783 1 1 1597 . 3 1 1 A 144 144 ILE N N 144 126.383 126.606 -0.223 1 1 1598 . 3 1 1 A 145 145 ASP H H 145 9.214 9.477 -0.263 1 1 1599 . 3 1 1 A 145 145 ASP HA H 145 5.978 5.571 0.407 1 1 1601 . 3 1 1 A 145 145 ASP C C 145 175.441 174.737 0.704 1 1 1602 . 3 1 1 A 145 145 ASP CA C 145 53.035 52.477 0.558 1 1 1603 . 3 1 1 A 145 145 ASP CB C 145 44.153 44.617 -0.464 1 1 1604 . 3 1 1 A 145 145 ASP N N 145 127.981 128.861 -0.880 1 1 1605 . 3 1 1 A 146 146 LEU H H 146 9.387 10.008 -0.621 1 1 1606 . 3 1 1 A 146 146 LEU HA H 146 4.918 5.488 -0.570 1 1 1616 . 3 1 1 A 146 146 LEU C C 146 175.003 174.738 0.265 1 1 1617 . 3 1 1 A 146 146 LEU CA C 146 53.940 53.558 0.382 1 1 1618 . 3 1 1 A 146 146 LEU CB C 146 43.902 44.097 -0.195 1 1 1622 . 3 1 1 A 146 146 LEU N N 146 123.532 127.292 -3.760 1 1 1623 . 3 1 1 A 147 147 ASP H H 147 8.676 8.862 -0.186 1 1 1624 . 3 1 1 A 147 147 ASP HA H 147 5.205 5.606 -0.401 1 1 1627 . 3 1 1 A 147 147 ASP C C 147 174.956 174.600 0.356 1 1 1628 . 3 1 1 A 147 147 ASP CA C 147 53.441 52.589 0.852 1 1 1629 . 3 1 1 A 147 147 ASP CB C 147 43.370 44.724 -1.354 1 1 1630 . 3 1 1 A 147 147 ASP N N 147 125.499 126.330 -0.831 1 1 1631 . 3 1 1 A 148 148 SER H H 148 8.732 9.620 -0.888 1 1 1632 . 3 1 1 A 148 148 SER HA H 148 5.365 5.781 -0.416 1 1 1634 . 3 1 1 A 148 148 SER C C 148 173.217 172.476 0.741 1 1 1635 . 3 1 1 A 148 148 SER CA C 148 56.334 56.432 -0.098 1 1 1636 . 3 1 1 A 148 148 SER CB C 148 65.812 66.895 -1.083 1 1 1637 . 3 1 1 A 148 148 SER N N 148 118.623 120.226 -1.603 1 1 1638 . 3 1 1 A 149 149 ALA H H 149 8.937 8.763 0.174 1 1 1639 . 3 1 1 A 149 149 ALA HA H 149 5.681 5.434 0.247 1 1 1643 . 3 1 1 A 149 149 ALA C C 149 178.894 177.620 1.274 1 1 1644 . 3 1 1 A 149 149 ALA CA C 149 49.996 50.406 -0.410 1 1 1645 . 3 1 1 A 149 149 ALA CB C 149 23.231 23.191 0.040 1 1 1646 . 3 1 1 A 149 149 ALA N N 149 123.952 124.279 -0.327 1 1 1647 . 3 1 1 A 150 150 ASP H H 150 9.010 8.594 0.416 1 1 1648 . 3 1 1 A 150 150 ASP HA H 150 4.336 4.517 -0.181 1 1 1651 . 3 1 1 A 150 150 ASP C C 150 176.697 177.604 -0.907 1 1 1652 . 3 1 1 A 150 150 ASP CA C 150 56.543 56.948 -0.405 1 1 1653 . 3 1 1 A 150 150 ASP CB C 150 39.850 40.718 -0.868 1 1 1654 . 3 1 1 A 150 150 ASP N N 150 122.687 119.996 2.691 1 1 1655 . 3 1 1 A 151 151 PHE H H 151 7.295 8.239 -0.944 1 1 1656 . 3 1 1 A 151 151 PHE HA H 151 5.020 4.378 0.642 1 1 1661 . 3 1 1 A 151 151 PHE C C 151 174.756 175.771 -1.015 1 1 1662 . 3 1 1 A 151 151 PHE CA C 151 56.594 61.255 -4.661 1 1 1663 . 3 1 1 A 151 151 PHE CB C 151 37.765 39.895 -2.130 1 1 1666 . 3 1 1 A 151 151 PHE N N 151 113.928 120.631 -6.703 1 1 1667 . 3 1 1 A 152 152 GLY H H 152 7.786 8.046 -0.260 1 1 1668 . 3 1 1 A 152 152 GLY HA2 H 152 4.459 3.993 0.466 1 1 1669 . 3 1 1 A 152 152 GLY HA3 H 152 3.728 4.057 -0.329 1 1 1670 . 3 1 1 A 152 152 GLY C C 152 172.709 173.414 -0.705 1 1 1671 . 3 1 1 A 152 152 GLY CA C 152 46.106 45.678 0.428 1 1 1672 . 3 1 1 A 152 152 GLY N N 152 110.312 106.359 3.953 1 1 1673 . 3 1 1 A 153 153 TYR H H 153 6.650 7.790 -1.140 1 1 1674 . 3 1 1 A 153 153 TYR HA H 153 4.508 5.067 -0.559 1 1 1679 . 3 1 1 A 153 153 TYR C C 153 173.092 173.400 -0.308 1 1 1680 . 3 1 1 A 153 153 TYR CA C 153 57.464 57.421 0.043 1 1 1681 . 3 1 1 A 153 153 TYR CB C 153 41.962 42.359 -0.397 1 1 1684 . 3 1 1 A 153 153 TYR N N 153 121.977 119.969 2.008 1 1 1685 . 3 1 1 A 154 154 ALA H H 154 7.847 8.317 -0.470 1 1 1686 . 3 1 1 A 154 154 ALA HA H 154 5.144 5.062 0.082 1 1 1690 . 3 1 1 A 154 154 ALA C C 154 174.468 175.155 -0.687 1 1 1691 . 3 1 1 A 154 154 ALA CA C 154 51.776 51.394 0.382 1 1 1692 . 3 1 1 A 154 154 ALA CB C 154 21.747 20.714 1.033 1 1 1693 . 3 1 1 A 154 154 ALA N N 154 130.258 130.131 0.127 1 1 1694 . 3 1 1 A 155 155 VAL H H 155 8.733 8.940 -0.207 1 1 1695 . 3 1 1 A 155 155 VAL HA H 155 4.150 4.664 -0.514 1 1 1700 . 3 1 1 A 155 155 VAL C C 155 172.632 172.864 -0.232 1 1 1701 . 3 1 1 A 155 155 VAL CA C 155 61.451 59.491 1.960 1 1 1702 . 3 1 1 A 155 155 VAL CB C 155 35.883 34.456 1.427 1 1 1704 . 3 1 1 A 155 155 VAL N N 155 119.622 122.776 -3.154 1 1 1705 . 3 1 1 A 156 156 GLY H H 156 8.146 8.412 -0.266 1 1 1706 . 3 1 1 A 156 156 GLY HA2 H 156 5.125 2.575 2.550 1 1 1707 . 3 1 1 A 156 156 GLY HA3 H 156 2.061 3.845 -1.784 1 1 1708 . 3 1 1 A 156 156 GLY C C 156 171.746 171.565 0.181 1 1 1709 . 3 1 1 A 156 156 GLY CA C 156 43.319 43.775 -0.456 1 1 1710 . 3 1 1 A 156 156 GLY N N 156 113.332 113.869 -0.537 1 1 1711 . 3 1 1 A 157 157 GLU H H 157 8.967 8.857 0.110 1 1 1712 . 3 1 1 A 157 157 GLU HA H 157 5.217 5.001 0.216 1 1 1716 . 3 1 1 A 157 157 GLU C C 157 174.476 175.430 -0.954 1 1 1717 . 3 1 1 A 157 157 GLU CA C 157 55.390 54.892 0.498 1 1 1718 . 3 1 1 A 157 157 GLU CB C 157 34.010 32.530 1.480 1 1 1720 . 3 1 1 A 157 157 GLU N N 157 120.823 123.394 -2.571 1 1 1721 . 3 1 1 A 158 158 VAL H H 158 9.076 9.501 -0.425 1 1 1722 . 3 1 1 A 158 158 VAL HA H 158 5.206 5.046 0.160 1 1 1727 . 3 1 1 A 158 158 VAL C C 158 173.900 174.140 -0.240 1 1 1728 . 3 1 1 A 158 158 VAL CA C 158 60.813 61.343 -0.530 1 1 1729 . 3 1 1 A 158 158 VAL CB C 158 33.385 33.677 -0.292 1 1 1731 . 3 1 1 A 158 158 VAL N N 158 124.349 125.373 -1.024 1 1 1732 . 3 1 1 A 159 159 GLU H H 159 9.239 9.609 -0.370 1 1 1733 . 3 1 1 A 159 159 GLU HA H 159 5.647 5.150 0.497 1 1 1738 . 3 1 1 A 159 159 GLU C C 159 174.469 175.011 -0.542 1 1 1739 . 3 1 1 A 159 159 GLU CA C 159 54.473 54.645 -0.172 1 1 1740 . 3 1 1 A 159 159 GLU CB C 159 33.852 32.799 1.053 1 1 1742 . 3 1 1 A 159 159 GLU N N 159 125.772 128.202 -2.430 1 1 1743 . 3 1 1 A 160 160 ALA H H 160 9.250 9.227 0.023 1 1 1744 . 3 1 1 A 160 160 ALA HA H 160 4.966 5.258 -0.292 1 1 1748 . 3 1 1 A 160 160 ALA C C 160 175.114 175.695 -0.581 1 1 1749 . 3 1 1 A 160 160 ALA CA C 160 50.644 50.770 -0.126 1 1 1750 . 3 1 1 A 160 160 ALA CB C 160 23.263 21.979 1.284 1 1 1751 . 3 1 1 A 160 160 ALA N N 160 125.092 129.330 -4.238 1 1 1752 . 3 1 1 A 161 161 MET H H 161 8.559 8.878 -0.319 1 1 1753 . 3 1 1 A 161 161 MET HA H 161 5.468 6.028 -0.560 1 1 1761 . 3 1 1 A 161 161 MET C C 161 176.265 174.941 1.324 1 1 1762 . 3 1 1 A 161 161 MET CA C 161 53.818 53.834 -0.016 1 1 1763 . 3 1 1 A 161 161 MET CB C 161 34.380 34.388 -0.008 1 1 1766 . 3 1 1 A 161 161 MET N N 161 118.699 121.305 -2.606 1 1 1767 . 3 1 1 A 162 162 VAL H H 162 9.046 9.177 -0.131 1 1 1768 . 3 1 1 A 162 162 VAL HA H 162 4.841 4.822 0.019 1 1 1776 . 3 1 1 A 162 162 VAL C C 162 174.794 175.957 -1.163 1 1 1777 . 3 1 1 A 162 162 VAL CA C 162 59.107 60.069 -0.962 1 1 1778 . 3 1 1 A 162 162 VAL CB C 162 34.018 34.434 -0.416 1 1 1781 . 3 1 1 A 162 162 VAL N N 162 116.435 120.009 -3.574 1 1 1782 . 3 1 1 A 163 163 HIS H H 163 8.793 8.671 0.122 1 1 1783 . 3 1 1 A 163 163 HIS HA H 163 4.717 5.026 -0.309 1 1 1787 . 3 1 1 A 163 163 HIS C C 163 175.460 174.576 0.884 1 1 1788 . 3 1 1 A 163 163 HIS CA C 163 58.488 57.681 0.807 1 1 1789 . 3 1 1 A 163 163 HIS CB C 163 31.185 30.746 0.439 1 1 1791 . 3 1 1 A 163 163 HIS N N 163 117.838 121.728 -3.890 1 1 1792 . 3 1 1 A 164 164 GLU H H 164 8.013 7.634 0.379 1 1 1793 . 3 1 1 A 164 164 GLU HA H 164 4.814 4.621 0.193 1 1 1797 . 3 1 1 A 164 164 GLU C C 164 176.910 176.412 0.498 1 1 1798 . 3 1 1 A 164 164 GLU CA C 164 54.355 55.058 -0.703 1 1 1799 . 3 1 1 A 164 164 GLU CB C 164 32.886 32.013 0.873 1 1 1801 . 3 1 1 A 164 164 GLU N N 164 115.943 117.600 -1.657 1 1 1802 . 3 1 1 A 165 165 LYS H H 165 9.088 8.976 0.112 1 1 1803 . 3 1 1 A 165 165 LYS HA H 165 3.942 4.067 -0.125 1 1 1809 . 3 1 1 A 165 165 LYS C C 165 179.657 177.932 1.725 1 1 1810 . 3 1 1 A 165 165 LYS CA C 165 59.888 58.313 1.575 1 1 1811 . 3 1 1 A 165 165 LYS CB C 165 32.024 32.500 -0.476 1 1 1814 . 3 1 1 A 165 165 LYS N N 165 124.120 125.722 -1.602 1 1 1815 . 3 1 1 A 166 166 ALA H H 166 8.851 7.686 1.165 1 1 1816 . 3 1 1 A 166 166 ALA HA H 166 4.251 4.111 0.140 1 1 1820 . 3 1 1 A 166 166 ALA C C 166 178.920 178.189 0.731 1 1 1821 . 3 1 1 A 166 166 ALA CA C 166 54.318 54.184 0.134 1 1 1822 . 3 1 1 A 166 166 ALA CB C 166 18.810 18.228 0.582 1 1 1823 . 3 1 1 A 166 166 ALA N N 166 120.424 122.350 -1.926 1 1 1824 . 3 1 1 A 167 167 GLU H H 167 7.871 8.282 -0.411 1 1 1825 . 3 1 1 A 167 167 GLU HA H 167 4.404 4.355 0.049 1 1 1829 . 3 1 1 A 167 167 GLU C C 167 177.368 178.080 -0.712 1 1 1830 . 3 1 1 A 167 167 GLU CA C 167 56.701 56.896 -0.195 1 1 1831 . 3 1 1 A 167 167 GLU CB C 167 31.208 29.872 1.336 1 1 1833 . 3 1 1 A 167 167 GLU N N 167 114.926 115.385 -0.459 1 1 1834 . 3 1 1 A 168 168 VAL H H 168 7.812 7.268 0.544 1 1 1835 . 3 1 1 A 168 168 VAL HA H 168 3.712 3.685 0.027 1 1 1843 . 3 1 1 A 168 168 VAL CA C 168 68.705 67.866 0.839 1 1 1844 . 3 1 1 A 168 168 VAL CB C 168 29.597 29.793 -0.196 1 1 1847 . 3 1 1 A 168 168 VAL N N 168 120.188 121.747 -1.559 1 1 1848 . 3 1 1 A 169 169 PRO HA H 169 4.252 4.249 0.003 1 1 1851 . 3 1 1 A 169 169 PRO C C 169 179.563 178.549 1.014 1 1 1852 . 3 1 1 A 169 169 PRO CA C 169 67.077 66.710 0.367 1 1 1853 . 3 1 1 A 170 170 ALA H H 170 8.149 8.217 -0.068 1 1 1854 . 3 1 1 A 170 170 ALA HA H 170 4.265 4.067 0.198 1 1 1858 . 3 1 1 A 170 170 ALA C C 170 180.637 179.816 0.821 1 1 1859 . 3 1 1 A 170 170 ALA CA C 170 54.823 55.371 -0.548 1 1 1860 . 3 1 1 A 170 170 ALA CB C 170 18.518 18.200 0.318 1 1 1861 . 3 1 1 A 170 170 ALA N N 170 119.210 119.280 -0.070 1 1 1862 . 3 1 1 A 171 171 ALA H H 171 7.767 8.546 -0.779 1 1 1863 . 3 1 1 A 171 171 ALA HA H 171 4.106 4.143 -0.037 1 1 1867 . 3 1 1 A 171 171 ALA C C 171 179.371 179.996 -0.625 1 1 1868 . 3 1 1 A 171 171 ALA CA C 171 55.130 55.115 0.015 1 1 1869 . 3 1 1 A 171 171 ALA CB C 171 18.291 17.894 0.397 1 1 1870 . 3 1 1 A 171 171 ALA N N 171 122.126 120.507 1.619 1 1 1871 . 3 1 1 A 172 172 LEU H H 172 8.950 8.242 0.708 1 1 1872 . 3 1 1 A 172 172 LEU HA H 172 3.987 4.091 -0.104 1 1 1878 . 3 1 1 A 172 172 LEU C C 172 178.355 178.633 -0.278 1 1 1879 . 3 1 1 A 172 172 LEU CA C 172 57.803 58.027 -0.224 1 1 1880 . 3 1 1 A 172 172 LEU CB C 172 41.667 41.754 -0.087 1 1 1882 . 3 1 1 A 172 172 LEU N N 172 118.682 121.955 -3.273 1 1 1883 . 3 1 1 A 173 173 GLU H H 173 7.886 7.977 -0.091 1 1 1884 . 3 1 1 A 173 173 GLU HA H 173 4.132 3.951 0.181 1 1 1887 . 3 1 1 A 173 173 GLU C C 173 179.556 179.306 0.250 1 1 1888 . 3 1 1 A 173 173 GLU CA C 173 59.800 59.610 0.190 1 1 1889 . 3 1 1 A 173 173 GLU CB C 173 29.580 29.237 0.343 1 1 1891 . 3 1 1 A 173 173 GLU N N 173 117.561 118.897 -1.336 1 1 1892 . 3 1 1 A 174 174 LYS H H 174 7.532 7.804 -0.272 1 1 1893 . 3 1 1 A 174 174 LYS HA H 174 4.131 4.082 0.049 1 1 1901 . 3 1 1 A 174 174 LYS CA C 174 58.999 59.386 -0.387 1 1 1902 . 3 1 1 A 174 174 LYS CB C 174 32.041 32.525 -0.484 1 1 1906 . 3 1 1 A 174 174 LYS N N 174 119.085 119.521 -0.436 1 1 1907 . 3 1 1 A 175 175 ILE H H 175 8.479 7.967 0.512 1 1 1908 . 3 1 1 A 175 175 ILE HA H 175 3.583 3.621 -0.038 1 1 1918 . 3 1 1 A 175 175 ILE C C 175 179.258 178.199 1.059 1 1 1919 . 3 1 1 A 175 175 ILE CA C 175 65.769 65.564 0.205 1 1 1920 . 3 1 1 A 175 175 ILE CB C 175 37.876 38.023 -0.147 1 1 1923 . 3 1 1 A 175 175 ILE N N 175 118.828 120.105 -1.277 1 1 1924 . 3 1 1 A 176 176 ILE H H 176 8.928 8.118 0.810 1 1 1925 . 3 1 1 A 176 176 ILE HA H 176 3.600 3.527 0.073 1 1 1935 . 3 1 1 A 176 176 ILE C C 176 178.827 178.029 0.798 1 1 1936 . 3 1 1 A 176 176 ILE CA C 176 65.640 65.126 0.514 1 1 1937 . 3 1 1 A 176 176 ILE CB C 176 37.451 37.582 -0.131 1 1 1941 . 3 1 1 A 176 176 ILE N N 176 124.527 119.447 5.080 1 1 1942 . 3 1 1 A 177 177 THR H H 177 8.175 8.218 -0.043 1 1 1943 . 3 1 1 A 177 177 THR HA H 177 3.885 3.925 -0.040 1 1 1948 . 3 1 1 A 177 177 THR C C 177 176.867 176.370 0.497 1 1 1949 . 3 1 1 A 177 177 THR CA C 177 67.199 66.280 0.919 1 1 1950 . 3 1 1 A 177 177 THR CB C 177 68.377 68.659 -0.282 1 1 1952 . 3 1 1 A 177 177 THR N N 177 119.412 118.804 0.608 1 1 1953 . 3 1 1 A 178 178 VAL H H 178 8.352 8.046 0.306 1 1 1954 . 3 1 1 A 178 178 VAL HA H 178 3.572 3.389 0.183 1 1 1962 . 3 1 1 A 178 178 VAL C C 178 177.664 177.790 -0.126 1 1 1963 . 3 1 1 A 178 178 VAL CA C 178 66.909 66.249 0.660 1 1 1964 . 3 1 1 A 178 178 VAL CB C 178 31.714 31.307 0.407 1 1 1967 . 3 1 1 A 178 178 VAL N N 178 121.168 121.735 -0.567 1 1 1968 . 3 1 1 A 179 179 SER H H 179 8.529 8.222 0.307 1 1 1969 . 3 1 1 A 179 179 SER HA H 179 3.099 3.219 -0.120 1 1 1972 . 3 1 1 A 179 179 SER C C 179 175.380 176.265 -0.885 1 1 1973 . 3 1 1 A 179 179 SER CA C 179 62.728 61.457 1.271 1 1 1974 . 3 1 1 A 179 179 SER CB C 179 62.802 62.545 0.257 1 1 1975 . 3 1 1 A 179 179 SER N N 179 115.226 115.330 -0.104 1 1 1976 . 3 1 1 A 180 180 SER H H 180 7.757 8.147 -0.390 1 1 1977 . 3 1 1 A 180 180 SER HA H 180 4.419 4.319 0.100 1 1 1980 . 3 1 1 A 180 180 SER C C 180 175.359 176.792 -1.433 1 1 1981 . 3 1 1 A 180 180 SER CA C 180 61.025 61.413 -0.388 1 1 1982 . 3 1 1 A 180 180 SER CB C 180 63.072 63.099 -0.027 1 1 1983 . 3 1 1 A 180 180 SER N N 180 114.718 115.896 -1.178 1 1 1984 . 3 1 1 A 181 181 MET H H 181 7.497 7.830 -0.333 1 1 1985 . 3 1 1 A 181 181 MET HA H 181 4.283 4.186 0.097 1 1 1993 . 3 1 1 A 181 181 MET C C 181 177.217 177.970 -0.753 1 1 1994 . 3 1 1 A 181 181 MET CA C 181 57.539 57.972 -0.433 1 1 1995 . 3 1 1 A 181 181 MET CB C 181 33.493 32.163 1.330 1 1 1998 . 3 1 1 A 181 181 MET N N 181 119.274 120.804 -1.530 1 1 1999 . 3 1 1 A 182 182 LEU H H 182 7.163 7.476 -0.313 1 1 2000 . 3 1 1 A 182 182 LEU HA H 182 4.133 4.233 -0.100 1 1 2010 . 3 1 1 A 182 182 LEU C C 182 176.289 177.009 -0.720 1 1 2011 . 3 1 1 A 182 182 LEU CA C 182 54.750 55.734 -0.984 1 1 2012 . 3 1 1 A 182 182 LEU CB C 182 43.235 42.896 0.339 1 1 2016 . 3 1 1 A 182 182 LEU N N 182 115.869 118.601 -2.732 1 1 2017 . 3 1 1 A 183 183 GLY H H 183 7.492 7.536 -0.044 1 1 2018 . 3 1 1 A 183 183 GLY HA2 H 183 4.086 4.086 0.000 1 1 2019 . 3 1 1 A 183 183 GLY HA3 H 183 4.425 4.137 0.288 1 1 2020 . 3 1 1 A 183 183 GLY C C 183 171.830 171.667 0.163 1 1 2021 . 3 1 1 A 183 183 GLY CA C 183 46.035 46.180 -0.145 1 1 2022 . 3 1 1 A 183 183 GLY N N 183 107.761 104.616 3.145 1 1 2023 . 3 1 1 A 184 184 VAL H H 184 8.099 8.628 -0.529 1 1 2024 . 3 1 1 A 184 184 VAL HA H 184 4.772 4.740 0.032 1 1 2032 . 3 1 1 A 184 184 VAL CA C 184 59.305 58.767 0.538 1 1 2033 . 3 1 1 A 184 184 VAL CB C 184 33.648 35.116 -1.468 1 1 2036 . 3 1 1 A 184 184 VAL N N 184 119.803 121.571 -1.768 1 1 2037 . 3 1 1 A 185 185 PRO HA H 185 4.442 4.761 -0.319 1 1 2042 . 3 1 1 A 185 185 PRO C C 185 175.871 176.269 -0.398 1 1 2043 . 3 1 1 A 185 185 PRO CA C 185 63.886 62.758 1.128 1 1 2044 . 3 1 1 A 185 185 PRO CB C 185 32.260 32.466 -0.206 1 1 2047 . 3 1 1 A 186 186 ALA H H 186 8.222 9.027 -0.805 1 1 2048 . 3 1 1 A 186 186 ALA HA H 186 4.569 5.072 -0.503 1 1 2052 . 3 1 1 A 186 186 ALA C C 186 177.481 176.064 1.417 1 1 2053 . 3 1 1 A 186 186 ALA CA C 186 51.823 50.966 0.857 1 1 2054 . 3 1 1 A 186 186 ALA CB C 186 20.233 23.569 -3.336 1 1 2055 . 3 1 1 A 186 186 ALA N N 186 125.663 122.319 3.344 1 1 2056 . 3 1 1 A 187 187 GLN H H 187 8.723 8.732 -0.009 1 1 2057 . 3 1 1 A 187 187 GLN HA H 187 4.420 4.714 -0.294 1 1 2063 . 3 1 1 A 187 187 GLN C C 187 175.566 176.186 -0.620 1 1 2064 . 3 1 1 A 187 187 GLN CA C 187 56.051 55.272 0.779 1 1 2065 . 3 1 1 A 187 187 GLN CB C 187 29.812 30.051 -0.239 1 1 2067 . 3 1 1 A 187 187 GLN N N 187 120.742 116.726 4.016 1 1 2069 . 3 1 1 A 188 188 GLU H H 188 8.163 7.703 0.460 1 1 2070 . 3 1 1 A 188 188 GLU HA H 188 4.405 4.277 0.128 1 1 2074 . 3 1 1 A 188 188 GLU C C 188 176.058 176.649 -0.591 1 1 2075 . 3 1 1 A 188 188 GLU CA C 188 56.158 57.287 -1.129 1 1 2076 . 3 1 1 A 188 188 GLU CB C 188 31.095 30.221 0.874 1 1 2078 . 3 1 1 A 188 188 GLU N N 188 119.177 121.576 -2.399 1 1 2079 . 3 1 1 A 189 189 GLU H H 189 8.567 8.718 -0.151 1 1 2080 . 3 1 1 A 189 189 GLU HA H 189 4.252 4.509 -0.257 1 1 2084 . 3 1 1 A 189 189 GLU C C 189 175.703 176.241 -0.538 1 1 2085 . 3 1 1 A 189 189 GLU CA C 189 56.417 55.753 0.664 1 1 2086 . 3 1 1 A 189 189 GLU CB C 189 29.968 29.518 0.450 1 1 2088 . 3 1 1 A 189 189 GLU N N 189 120.920 122.980 -2.060 1 1 2089 . 3 1 1 A 190 190 ALA H H 190 8.271 8.070 0.201 1 1 2090 . 3 1 1 A 190 190 ALA HA H 190 4.626 4.206 0.420 1 1 2094 . 3 1 1 A 190 190 ALA CA C 190 50.465 50.490 -0.025 1 1 2095 . 3 1 1 A 190 190 ALA CB C 190 18.451 19.372 -0.921 1 1 2096 . 3 1 1 A 190 190 ALA N N 190 128.323 127.789 0.534 1 1 2097 . 3 1 1 A 191 191 PRO HA H 191 4.493 4.547 -0.054 1 1 2103 . 3 1 1 A 191 191 PRO C C 191 175.899 176.418 -0.519 1 1 2104 . 3 1 1 A 191 191 PRO CA C 191 62.044 62.297 -0.253 1 1 2105 . 3 1 1 A 191 191 PRO CB C 191 32.184 32.419 -0.235 1 1 2108 . 3 1 1 A 192 192 ALA H H 192 8.610 8.166 0.444 1 1 2109 . 3 1 1 A 192 192 ALA HA H 192 4.280 4.349 -0.069 1 1 2113 . 3 1 1 A 192 192 ALA C C 192 178.282 178.052 0.230 1 1 2114 . 3 1 1 A 192 192 ALA CA C 192 51.698 52.341 -0.643 1 1 2115 . 3 1 1 A 192 192 ALA CB C 192 19.220 18.948 0.272 1 1 2116 . 3 1 1 A 192 192 ALA N N 192 123.420 124.628 -1.208 1 1 2117 . 3 1 1 A 193 193 LYS H H 193 8.531 8.506 0.025 1 1 2118 . 3 1 1 A 193 193 LYS HA H 193 3.294 3.571 -0.277 1 1 2126 . 3 1 1 A 193 193 LYS C C 193 177.640 177.442 0.198 1 1 2127 . 3 1 1 A 193 193 LYS CA C 193 60.644 59.092 1.552 1 1 2128 . 3 1 1 A 193 193 LYS CB C 193 32.607 31.707 0.900 1 1 2132 . 3 1 1 A 193 193 LYS N N 193 122.851 122.108 0.743 1 1 2133 . 3 1 1 A 194 194 LEU H H 194 8.570 7.775 0.795 1 1 2134 . 3 1 1 A 194 194 LEU HA H 194 3.845 4.124 -0.279 1 1 2144 . 3 1 1 A 194 194 LEU C C 194 177.965 178.601 -0.636 1 1 2145 . 3 1 1 A 194 194 LEU CA C 194 57.611 57.366 0.245 1 1 2146 . 3 1 1 A 194 194 LEU CB C 194 41.776 40.591 1.185 1 1 2150 . 3 1 1 A 194 194 LEU N N 194 115.801 120.742 -4.941 1 1 2151 . 3 1 1 A 195 195 MET H H 195 6.782 7.852 -1.070 1 1 2152 . 3 1 1 A 195 195 MET HA H 195 4.487 4.244 0.243 1 1 2160 . 3 1 1 A 195 195 MET C C 195 178.280 178.279 0.001 1 1 2161 . 3 1 1 A 195 195 MET CA C 195 56.858 58.026 -1.168 1 1 2162 . 3 1 1 A 195 195 MET CB C 195 31.557 32.094 -0.537 1 1 2165 . 3 1 1 A 195 195 MET N N 195 113.898 119.035 -5.137 1 1 2166 . 3 1 1 A 196 196 VAL H H 196 7.713 7.776 -0.063 1 1 2167 . 3 1 1 A 196 196 VAL HA H 196 3.501 3.460 0.041 1 1 2175 . 3 1 1 A 196 196 VAL C C 196 177.624 177.903 -0.279 1 1 2176 . 3 1 1 A 196 196 VAL CA C 196 66.318 66.293 0.025 1 1 2177 . 3 1 1 A 196 196 VAL CB C 196 31.380 31.502 -0.122 1 1 2180 . 3 1 1 A 196 196 VAL N N 196 120.413 120.055 0.358 1 1 2181 . 3 1 1 A 197 197 TYR H H 197 7.972 7.948 0.024 1 1 2182 . 3 1 1 A 197 197 TYR HA H 197 3.145 3.634 -0.489 1 1 2187 . 3 1 1 A 197 197 TYR C C 197 177.726 176.865 0.861 1 1 2188 . 3 1 1 A 197 197 TYR CA C 197 62.253 61.549 0.704 1 1 2189 . 3 1 1 A 197 197 TYR CB C 197 37.314 38.193 -0.879 1 1 2192 . 3 1 1 A 197 197 TYR N N 197 119.543 121.242 -1.699 1 1 2193 . 3 1 1 A 198 198 LEU H H 198 8.630 8.101 0.529 1 1 2194 . 3 1 1 A 198 198 LEU HA H 198 3.923 3.545 0.378 1 1 2203 . 3 1 1 A 198 198 LEU C C 198 178.074 178.979 -0.905 1 1 2204 . 3 1 1 A 198 198 LEU CA C 198 58.294 57.711 0.583 1 1 2205 . 3 1 1 A 198 198 LEU CB C 198 42.177 41.244 0.933 1 1 2209 . 3 1 1 A 198 198 LEU N N 198 118.430 119.770 -1.340 1 1 2210 . 3 1 1 A 199 199 GLN H H 199 8.082 8.056 0.026 1 1 2211 . 3 1 1 A 199 199 GLN HA H 199 3.054 3.697 -0.643 1 1 2216 . 3 1 1 A 199 199 GLN C C 199 176.875 178.127 -1.252 1 1 2217 . 3 1 1 A 199 199 GLN CA C 199 59.739 59.044 0.695 1 1 2218 . 3 1 1 A 199 199 GLN CB C 199 28.055 27.805 0.250 1 1 2220 . 3 1 1 A 199 199 GLN N N 199 117.926 117.639 0.287 1 1 2222 . 3 1 1 A 200 200 ARG H H 200 7.349 7.850 -0.501 1 1 2223 . 3 1 1 A 200 200 ARG HA H 200 3.798 3.965 -0.167 1 1 2231 . 3 1 1 A 200 200 ARG C C 200 178.037 178.353 -0.316 1 1 2232 . 3 1 1 A 200 200 ARG CA C 200 58.260 58.936 -0.676 1 1 2233 . 3 1 1 A 200 200 ARG CB C 200 30.706 30.225 0.481 1 1 2236 . 3 1 1 A 200 200 ARG N N 200 113.772 119.942 -6.170 1 1 2238 . 3 1 1 A 201 201 PHE H H 201 8.329 7.667 0.662 1 1 2239 . 3 1 1 A 201 201 PHE HA H 201 4.630 4.583 0.047 1 1 2244 . 3 1 1 A 201 201 PHE C C 201 176.606 176.386 0.220 1 1 2245 . 3 1 1 A 201 201 PHE CA C 201 59.014 58.856 0.158 1 1 2246 . 3 1 1 A 201 201 PHE CB C 201 40.357 40.274 0.083 1 1 2249 . 3 1 1 A 201 201 PHE N N 201 114.182 116.529 -2.347 1 1 2250 . 3 1 1 A 202 202 ARG H H 202 8.719 8.271 0.448 1 1 2251 . 3 1 1 A 202 202 ARG HA H 202 5.071 4.733 0.338 1 1 2261 . 3 1 1 A 202 202 ARG CA C 202 53.956 53.561 0.395 1 1 2262 . 3 1 1 A 202 202 ARG CB C 202 31.979 30.174 1.805 1 1 2264 . 3 1 1 A 202 202 ARG N N 202 120.115 114.510 5.605 1 1 2266 . 3 1 1 A 203 203 PRO HA H 203 4.348 4.569 -0.221 1 1 2271 . 3 1 1 A 203 203 PRO C C 203 179.736 178.909 0.827 1 1 2272 . 3 1 1 A 203 203 PRO CA C 203 65.674 65.586 0.088 1 1 2273 . 3 1 1 A 203 203 PRO CB C 203 31.717 32.109 -0.392 1 1 2275 . 3 1 1 A 204 204 LEU H H 204 8.875 7.606 1.269 1 1 2276 . 3 1 1 A 204 204 LEU HA H 204 4.291 3.984 0.307 1 1 2286 . 3 1 1 A 204 204 LEU C C 204 180.353 178.259 2.094 1 1 2287 . 3 1 1 A 204 204 LEU CA C 204 58.012 57.609 0.403 1 1 2288 . 3 1 1 A 204 204 LEU CB C 204 40.893 41.331 -0.438 1 1 2292 . 3 1 1 A 204 204 LEU N N 204 118.940 116.531 2.409 1 1 2293 . 3 1 1 A 205 205 ASP H H 205 7.541 8.456 -0.915 1 1 2294 . 3 1 1 A 205 205 ASP HA H 205 4.622 4.278 0.344 1 1 2297 . 3 1 1 A 205 205 ASP C C 205 177.602 177.802 -0.200 1 1 2298 . 3 1 1 A 205 205 ASP CA C 205 57.437 57.145 0.292 1 1 2299 . 3 1 1 A 205 205 ASP CB C 205 41.143 41.602 -0.459 1 1 2300 . 3 1 1 A 205 205 ASP N N 205 120.838 119.462 1.376 1 1 2301 . 3 1 1 A 206 206 TYR H H 206 8.237 8.273 -0.036 1 1 2302 . 3 1 1 A 206 206 TYR HA H 206 4.018 4.094 -0.076 1 1 2307 . 3 1 1 A 206 206 TYR C C 206 176.433 177.621 -1.188 1 1 2308 . 3 1 1 A 206 206 TYR CA C 206 62.148 62.075 0.073 1 1 2309 . 3 1 1 A 206 206 TYR CB C 206 38.305 38.678 -0.373 1 1 2312 . 3 1 1 A 206 206 TYR N N 206 119.475 120.498 -1.023 1 1 2313 . 3 1 1 A 207 207 GLN H H 207 8.124 8.380 -0.256 1 1 2314 . 3 1 1 A 207 207 GLN HA H 207 3.823 3.222 0.601 1 1 2320 . 3 1 1 A 207 207 GLN C C 207 178.019 178.498 -0.479 1 1 2321 . 3 1 1 A 207 207 GLN CA C 207 58.841 59.102 -0.261 1 1 2322 . 3 1 1 A 207 207 GLN CB C 207 28.208 28.415 -0.207 1 1 2324 . 3 1 1 A 207 207 GLN N N 207 115.863 118.157 -2.294 1 1 2326 . 3 1 1 A 208 208 ARG H H 208 7.522 7.944 -0.422 1 1 2327 . 3 1 1 A 208 208 ARG HA H 208 4.127 4.040 0.087 1 1 2334 . 3 1 1 A 208 208 ARG C C 208 179.278 178.501 0.777 1 1 2335 . 3 1 1 A 208 208 ARG CA C 208 59.419 58.930 0.489 1 1 2336 . 3 1 1 A 208 208 ARG CB C 208 30.182 29.825 0.357 1 1 2338 . 3 1 1 A 208 208 ARG N N 208 118.471 119.781 -1.310 1 1 2340 . 3 1 1 A 209 209 LEU H H 209 7.869 7.681 0.188 1 1 2341 . 3 1 1 A 209 209 LEU HA H 209 4.091 4.071 0.020 1 1 2351 . 3 1 1 A 209 209 LEU C C 209 179.715 179.052 0.663 1 1 2352 . 3 1 1 A 209 209 LEU CA C 209 57.891 57.923 -0.032 1 1 2353 . 3 1 1 A 209 209 LEU CB C 209 41.338 41.726 -0.388 1 1 2356 . 3 1 1 A 209 209 LEU N N 209 119.659 120.156 -0.497 1 1 2357 . 3 1 1 A 210 210 LEU H H 210 8.034 8.458 -0.424 1 1 2358 . 3 1 1 A 210 210 LEU HA H 210 3.977 4.013 -0.036 1 1 2367 . 3 1 1 A 210 210 LEU C C 210 180.363 178.460 1.903 1 1 2368 . 3 1 1 A 210 210 LEU CA C 210 57.459 58.507 -1.048 1 1 2369 . 3 1 1 A 210 210 LEU CB C 210 41.699 41.306 0.393 1 1 2373 . 3 1 1 A 210 210 LEU N N 210 120.967 119.970 0.997 1 1 2374 . 3 1 1 A 211 211 GLU H H 211 8.174 8.261 -0.087 1 1 2375 . 3 1 1 A 211 211 GLU HA H 211 4.075 4.008 0.067 1 1 2379 . 3 1 1 A 211 211 GLU C C 211 178.499 178.942 -0.443 1 1 2380 . 3 1 1 A 211 211 GLU CA C 211 58.575 59.398 -0.823 1 1 2381 . 3 1 1 A 211 211 GLU CB C 211 29.583 29.000 0.583 1 1 2383 . 3 1 1 A 211 211 GLU N N 211 119.217 117.919 1.298 1 1 2384 . 3 1 1 A 212 212 ALA H H 212 7.723 7.740 -0.017 1 1 2385 . 3 1 1 A 212 212 ALA HA H 212 4.291 4.209 0.082 1 1 2389 . 3 1 1 A 212 212 ALA C C 212 178.770 178.251 0.519 1 1 2390 . 3 1 1 A 212 212 ALA CA C 212 53.966 54.702 -0.736 1 1 2391 . 3 1 1 A 212 212 ALA CB C 212 19.117 18.560 0.557 1 1 2392 . 3 1 1 A 212 212 ALA N N 212 121.798 122.192 -0.394 1 1 2393 . 3 1 1 A 213 213 ALA H H 213 7.743 7.955 -0.212 1 1 2394 . 3 1 1 A 213 213 ALA HA H 213 4.406 4.497 -0.091 1 1 2398 . 3 1 1 A 213 213 ALA C C 213 178.413 177.264 1.149 1 1 2399 . 3 1 1 A 213 213 ALA CA C 213 53.129 51.596 1.533 1 1 2400 . 3 1 1 A 213 213 ALA CB C 213 18.926 18.671 0.255 1 1 2401 . 3 1 1 A 213 213 ALA N N 213 120.435 118.561 1.874 1 1 2402 . 3 1 1 A 214 214 SER H H 214 7.944 7.677 0.267 1 1 2403 . 3 1 1 A 214 214 SER HA H 214 4.559 4.446 0.113 1 1 2406 . 3 1 1 A 214 214 SER C C 214 174.958 173.878 1.080 1 1 2407 . 3 1 1 A 214 214 SER CA C 214 58.640 57.826 0.814 1 1 2408 . 3 1 1 A 214 214 SER CB C 214 63.928 62.300 1.628 1 1 2409 . 3 1 1 A 214 214 SER N N 214 113.729 115.312 -1.583 1 1 2410 . 3 1 1 A 215 215 SER H H 215 8.255 8.605 -0.350 1 1 2411 . 3 1 1 A 215 215 SER HA H 215 4.547 4.785 -0.238 1 1 2413 . 3 1 1 A 215 215 SER C C 215 175.289 175.310 -0.021 1 1 2414 . 3 1 1 A 215 215 SER CA C 215 58.833 58.763 0.070 1 1 2415 . 3 1 1 A 215 215 SER CB C 215 63.847 65.950 -2.103 1 1 2416 . 3 1 1 A 215 215 SER N N 215 117.674 123.077 -5.403 1 1 2417 . 3 1 1 A 216 216 GLY H H 216 8.431 8.091 0.340 1 1 2418 . 3 1 1 A 216 216 GLY HA2 H 216 4.054 4.044 0.010 1 1 2419 . 3 1 1 A 216 216 GLY C C 216 174.189 173.417 0.772 1 1 2420 . 3 1 1 A 216 216 GLY CA C 216 45.412 44.869 0.543 1 1 2421 . 3 1 1 A 216 216 GLY N N 216 110.800 108.337 2.463 1 1 2422 . 3 1 1 A 217 217 GLU H H 217 8.267 9.187 -0.920 1 1 2423 . 3 1 1 A 217 217 GLU HA H 217 4.345 4.752 -0.407 1 1 2427 . 3 1 1 A 217 217 GLU C C 217 176.428 176.138 0.290 1 1 2428 . 3 1 1 A 217 217 GLU CA C 217 56.470 55.056 1.414 1 1 2429 . 3 1 1 A 217 217 GLU CB C 217 30.526 30.969 -0.443 1 1 2430 . 3 1 1 A 217 217 GLU N N 217 120.726 120.763 -0.037 1 1 2431 . 3 1 1 A 218 218 ALA H H 218 8.476 8.560 -0.084 1 1 2432 . 3 1 1 A 218 218 ALA HA H 218 4.467 4.339 0.128 1 1 2436 . 3 1 1 A 218 218 ALA C C 218 178.015 177.871 0.144 1 1 2437 . 3 1 1 A 218 218 ALA CA C 218 52.547 52.556 -0.009 1 1 2438 . 3 1 1 A 218 218 ALA CB C 218 19.242 19.245 -0.003 1 1 2439 . 3 1 1 A 218 218 ALA N N 218 125.534 130.386 -4.852 1 1 2440 . 3 1 1 A 219 219 THR H H 219 8.232 8.717 -0.485 1 1 2441 . 3 1 1 A 219 219 THR HA H 219 4.411 4.202 0.209 1 1 2446 . 3 1 1 A 219 219 THR C C 219 175.327 175.367 -0.040 1 1 2447 . 3 1 1 A 219 219 THR CA C 219 61.889 63.611 -1.722 1 1 2448 . 3 1 1 A 219 219 THR CB C 219 69.939 68.179 1.760 1 1 2449 . 3 1 1 A 219 219 THR N N 219 113.242 117.470 -4.228 1 1 2450 . 3 1 1 A 220 220 GLY H H 220 8.418 8.644 -0.226 1 1 2451 . 3 1 1 A 220 220 GLY C C 220 174.037 173.740 0.297 1 1 2452 . 3 1 1 A 220 220 GLY CA C 220 45.408 45.451 -0.043 1 1 2453 . 3 1 1 A 220 220 GLY N N 220 111.031 115.269 -4.238 1 1 2454 . 3 1 1 A 221 221 ASP H H 221 8.345 7.801 0.544 1 1 2455 . 3 1 1 A 221 221 ASP HA H 221 4.700 4.781 -0.081 1 1 2458 . 3 1 1 A 221 221 ASP C C 221 176.535 175.063 1.472 1 1 2459 . 3 1 1 A 221 221 ASP CA C 221 54.402 53.962 0.440 1 1 2460 . 3 1 1 A 221 221 ASP CB C 221 41.431 41.555 -0.124 1 1 2461 . 3 1 1 A 221 221 ASP N N 221 120.795 121.356 -0.561 1 1 2462 . 3 1 1 A 222 222 SER H H 222 8.353 8.479 -0.126 1 1 2463 . 3 1 1 A 222 222 SER HA H 222 4.493 4.964 -0.471 1 1 2465 . 3 1 1 A 222 222 SER C C 222 174.224 174.497 -0.273 1 1 2466 . 3 1 1 A 222 222 SER CA C 222 58.427 55.729 2.698 1 1 2467 . 3 1 1 A 222 222 SER CB C 222 63.860 66.163 -2.303 1 1 2468 . 3 1 1 A 222 222 SER N N 222 116.220 119.368 -3.148 1 1 2469 . 3 1 1 A 223 223 ALA H H 223 8.381 8.786 -0.405 1 1 2470 . 3 1 1 A 223 223 ALA HA H 223 4.461 4.336 0.125 1 1 2474 . 3 1 1 A 223 223 ALA C C 223 176.926 177.520 -0.594 1 1 2475 . 3 1 1 A 223 223 ALA CA C 223 52.583 54.615 -2.032 1 1 2476 . 3 1 1 A 223 223 ALA CB C 223 19.438 19.162 0.276 1 1 2477 . 3 1 1 A 223 223 ALA N N 223 126.592 126.174 0.418 1 1 1 . 4 1 1 A 2 2 ALA HA H 2 4.274 4.920 -0.646 1 1 5 . 4 1 1 A 2 2 ALA C C 2 177.828 175.959 1.869 1 1 6 . 4 1 1 A 2 2 ALA CA C 2 52.984 51.313 1.671 1 1 7 . 4 1 1 A 2 2 ALA CB C 2 19.138 20.164 -1.026 1 1 8 . 4 1 1 A 3 3 GLN H H 3 8.463 8.734 -0.271 1 1 9 . 4 1 1 A 3 3 GLN HA H 3 4.676 4.898 -0.222 1 1 12 . 4 1 1 A 3 3 GLN C C 3 176.002 175.413 0.589 1 1 13 . 4 1 1 A 3 3 GLN CA C 3 56.258 54.798 1.460 1 1 14 . 4 1 1 A 3 3 GLN CB C 3 30.346 30.408 -0.062 1 1 15 . 4 1 1 A 3 3 GLN N N 3 117.490 123.415 -5.925 1 1 16 . 4 1 1 A 4 4 GLY H H 4 8.099 8.452 -0.353 1 1 17 . 4 1 1 A 4 4 GLY HA2 H 4 3.910 4.211 -0.301 1 1 18 . 4 1 1 A 4 4 GLY C C 4 173.332 172.313 1.019 1 1 19 . 4 1 1 A 4 4 GLY CA C 4 45.333 45.562 -0.229 1 1 20 . 4 1 1 A 4 4 GLY N N 4 109.423 110.462 -1.039 1 1 21 . 4 1 1 A 5 5 LEU H H 5 7.863 8.135 -0.272 1 1 22 . 4 1 1 A 5 5 LEU HA H 5 4.561 4.952 -0.391 1 1 32 . 4 1 1 A 5 5 LEU C C 5 176.448 176.040 0.408 1 1 33 . 4 1 1 A 5 5 LEU CA C 5 54.713 54.096 0.617 1 1 34 . 4 1 1 A 5 5 LEU CB C 5 43.551 41.262 2.289 1 1 38 . 4 1 1 A 5 5 LEU N N 5 120.391 124.611 -4.220 1 1 39 . 4 1 1 A 6 6 ILE H H 6 8.764 9.319 -0.555 1 1 40 . 4 1 1 A 6 6 ILE HA H 6 4.087 4.115 -0.028 1 1 49 . 4 1 1 A 6 6 ILE C C 6 174.679 175.106 -0.427 1 1 50 . 4 1 1 A 6 6 ILE CA C 6 61.279 61.616 -0.337 1 1 51 . 4 1 1 A 6 6 ILE CB C 6 39.651 37.731 1.920 1 1 54 . 4 1 1 A 6 6 ILE N N 6 123.050 126.088 -3.038 1 1 55 . 4 1 1 A 7 7 GLU H H 7 8.587 8.801 -0.214 1 1 56 . 4 1 1 A 7 7 GLU HA H 7 4.917 4.699 0.218 1 1 61 . 4 1 1 A 7 7 GLU C C 7 175.978 176.216 -0.238 1 1 62 . 4 1 1 A 7 7 GLU CA C 7 56.127 55.977 0.150 1 1 63 . 4 1 1 A 7 7 GLU CB C 7 31.115 30.377 0.738 1 1 65 . 4 1 1 A 7 7 GLU N N 7 127.415 128.232 -0.817 1 1 66 . 4 1 1 A 8 8 VAL H H 8 8.986 9.444 -0.458 1 1 67 . 4 1 1 A 8 8 VAL HA H 8 4.375 4.976 -0.601 1 1 72 . 4 1 1 A 8 8 VAL C C 8 173.704 174.767 -1.063 1 1 73 . 4 1 1 A 8 8 VAL CA C 8 61.347 60.336 1.011 1 1 74 . 4 1 1 A 8 8 VAL CB C 8 33.611 34.181 -0.570 1 1 76 . 4 1 1 A 8 8 VAL N N 8 126.071 122.143 3.928 1 1 77 . 4 1 1 A 9 9 GLU H H 9 8.521 9.218 -0.697 1 1 78 . 4 1 1 A 9 9 GLU HA H 9 5.837 5.449 0.388 1 1 81 . 4 1 1 A 9 9 GLU C C 9 175.939 174.755 1.184 1 1 82 . 4 1 1 A 9 9 GLU CA C 9 54.516 54.590 -0.074 1 1 83 . 4 1 1 A 9 9 GLU CB C 9 33.009 34.336 -1.327 1 1 84 . 4 1 1 A 9 9 GLU N N 9 122.857 123.171 -0.314 1 1 85 . 4 1 1 A 10 10 ARG H H 10 8.690 8.680 0.010 1 1 86 . 4 1 1 A 10 10 ARG HA H 10 4.709 4.880 -0.171 1 1 94 . 4 1 1 A 10 10 ARG C C 10 174.826 175.078 -0.252 1 1 95 . 4 1 1 A 10 10 ARG CA C 10 54.491 54.401 0.090 1 1 96 . 4 1 1 A 10 10 ARG CB C 10 35.777 34.519 1.258 1 1 98 . 4 1 1 A 10 10 ARG N N 10 120.430 120.175 0.255 1 1 100 . 4 1 1 A 11 11 LYS H H 11 8.874 8.498 0.376 1 1 101 . 4 1 1 A 11 11 LYS HA H 11 5.530 5.065 0.465 1 1 107 . 4 1 1 A 11 11 LYS C C 11 176.919 176.016 0.903 1 1 108 . 4 1 1 A 11 11 LYS CA C 11 55.084 55.831 -0.747 1 1 109 . 4 1 1 A 11 11 LYS CB C 11 35.435 34.602 0.833 1 1 113 . 4 1 1 A 11 11 LYS N N 11 121.087 121.551 -0.464 1 1 114 . 4 1 1 A 12 12 PHE H H 12 8.877 8.776 0.101 1 1 115 . 4 1 1 A 12 12 PHE HA H 12 5.130 5.229 -0.099 1 1 120 . 4 1 1 A 12 12 PHE C C 12 171.676 172.135 -0.459 1 1 121 . 4 1 1 A 12 12 PHE CA C 12 55.869 56.526 -0.657 1 1 122 . 4 1 1 A 12 12 PHE CB C 12 42.108 41.734 0.374 1 1 125 . 4 1 1 A 12 12 PHE N N 12 117.486 116.871 0.615 1 1 126 . 4 1 1 A 13 13 ALA H H 13 9.134 9.315 -0.181 1 1 127 . 4 1 1 A 13 13 ALA HA H 13 5.003 4.708 0.295 1 1 131 . 4 1 1 A 13 13 ALA CA C 13 48.340 48.847 -0.507 1 1 132 . 4 1 1 A 13 13 ALA CB C 13 19.191 20.212 -1.021 1 1 133 . 4 1 1 A 13 13 ALA N N 13 125.915 123.389 2.526 1 1 134 . 4 1 1 A 14 14 PRO HA H 14 4.620 5.195 -0.575 1 1 140 . 4 1 1 A 14 14 PRO C C 14 176.502 177.220 -0.718 1 1 141 . 4 1 1 A 14 14 PRO CA C 14 62.672 62.326 0.346 1 1 142 . 4 1 1 A 14 14 PRO CB C 14 33.119 32.300 0.819 1 1 145 . 4 1 1 A 15 15 GLY H H 15 8.721 8.550 0.171 1 1 146 . 4 1 1 A 15 15 GLY HA2 H 15 3.999 4.085 -0.086 1 1 147 . 4 1 1 A 15 15 GLY HA3 H 15 4.632 4.087 0.545 1 1 148 . 4 1 1 A 15 15 GLY CA C 15 44.411 44.108 0.303 1 1 149 . 4 1 1 A 15 15 GLY N N 15 109.863 108.442 1.421 1 1 150 . 4 1 1 A 16 16 PRO HA H 16 4.447 4.540 -0.093 1 1 155 . 4 1 1 A 16 16 PRO C C 16 177.053 176.865 0.188 1 1 156 . 4 1 1 A 16 16 PRO CA C 16 64.395 64.020 0.375 1 1 157 . 4 1 1 A 16 16 PRO CB C 16 31.993 32.233 -0.240 1 1 159 . 4 1 1 A 17 17 ASP H H 17 8.550 8.556 -0.006 1 1 160 . 4 1 1 A 17 17 ASP HA H 17 4.950 4.712 0.238 1 1 163 . 4 1 1 A 17 17 ASP C C 17 176.800 177.503 -0.703 1 1 164 . 4 1 1 A 17 17 ASP CA C 17 53.271 53.581 -0.310 1 1 165 . 4 1 1 A 17 17 ASP CB C 17 40.392 40.757 -0.365 1 1 166 . 4 1 1 A 17 17 ASP N N 17 116.060 117.395 -1.335 1 1 167 . 4 1 1 A 18 18 THR H H 18 7.664 7.612 0.052 1 1 168 . 4 1 1 A 18 18 THR HA H 18 4.120 3.711 0.409 1 1 174 . 4 1 1 A 18 18 THR C C 18 175.407 176.341 -0.934 1 1 175 . 4 1 1 A 18 18 THR CA C 18 68.718 67.133 1.585 1 1 176 . 4 1 1 A 18 18 THR CB C 18 69.179 68.496 0.683 1 1 178 . 4 1 1 A 18 18 THR N N 18 117.158 115.697 1.461 1 1 179 . 4 1 1 A 19 19 GLU H H 19 8.817 8.559 0.258 1 1 180 . 4 1 1 A 19 19 GLU HA H 19 3.510 3.254 0.256 1 1 184 . 4 1 1 A 19 19 GLU C C 19 178.345 179.348 -1.003 1 1 185 . 4 1 1 A 19 19 GLU CA C 19 61.237 59.760 1.477 1 1 186 . 4 1 1 A 19 19 GLU CB C 19 28.746 29.262 -0.516 1 1 188 . 4 1 1 A 19 19 GLU N N 19 118.802 118.931 -0.129 1 1 189 . 4 1 1 A 20 20 GLU H H 20 7.976 8.014 -0.038 1 1 190 . 4 1 1 A 20 20 GLU HA H 20 4.036 4.074 -0.038 1 1 194 . 4 1 1 A 20 20 GLU C C 20 179.451 179.215 0.236 1 1 195 . 4 1 1 A 20 20 GLU CA C 20 59.909 58.871 1.038 1 1 196 . 4 1 1 A 20 20 GLU CB C 20 28.992 29.310 -0.318 1 1 198 . 4 1 1 A 20 20 GLU N N 20 121.130 119.717 1.413 1 1 199 . 4 1 1 A 21 21 ARG H H 21 8.199 8.194 0.005 1 1 200 . 4 1 1 A 21 21 ARG HA H 21 4.061 4.079 -0.018 1 1 207 . 4 1 1 A 21 21 ARG C C 21 179.087 178.937 0.150 1 1 208 . 4 1 1 A 21 21 ARG CA C 21 58.477 58.817 -0.340 1 1 209 . 4 1 1 A 21 21 ARG CB C 21 30.101 30.028 0.073 1 1 211 . 4 1 1 A 21 21 ARG N N 21 119.897 120.063 -0.166 1 1 213 . 4 1 1 A 22 22 LEU H H 22 8.154 8.574 -0.420 1 1 214 . 4 1 1 A 22 22 LEU HA H 22 3.560 3.788 -0.228 1 1 224 . 4 1 1 A 22 22 LEU C C 22 178.461 179.459 -0.998 1 1 225 . 4 1 1 A 22 22 LEU CA C 22 58.432 57.769 0.663 1 1 226 . 4 1 1 A 22 22 LEU CB C 22 40.229 41.034 -0.805 1 1 230 . 4 1 1 A 22 22 LEU N N 22 120.012 119.585 0.427 1 1 231 . 4 1 1 A 23 23 GLN H H 23 7.621 7.647 -0.026 1 1 232 . 4 1 1 A 23 23 GLN HA H 23 4.232 4.020 0.212 1 1 238 . 4 1 1 A 23 23 GLN C C 23 180.543 178.976 1.567 1 1 239 . 4 1 1 A 23 23 GLN CA C 23 59.434 59.225 0.209 1 1 240 . 4 1 1 A 23 23 GLN CB C 23 28.749 28.294 0.455 1 1 242 . 4 1 1 A 23 23 GLN N N 23 117.823 117.969 -0.146 1 1 244 . 4 1 1 A 24 24 GLU H H 24 8.165 7.749 0.416 1 1 245 . 4 1 1 A 24 24 GLU HA H 24 4.072 4.055 0.017 1 1 249 . 4 1 1 A 24 24 GLU C C 24 178.612 179.492 -0.880 1 1 250 . 4 1 1 A 24 24 GLU CA C 24 59.236 59.133 0.103 1 1 251 . 4 1 1 A 24 24 GLU CB C 24 29.606 29.712 -0.106 1 1 253 . 4 1 1 A 24 24 GLU N N 24 122.589 120.391 2.198 1 1 254 . 4 1 1 A 25 25 LEU H H 25 7.911 7.993 -0.082 1 1 255 . 4 1 1 A 25 25 LEU HA H 25 4.214 4.104 0.110 1 1 265 . 4 1 1 A 25 25 LEU C C 25 176.745 177.351 -0.606 1 1 266 . 4 1 1 A 25 25 LEU CA C 25 55.659 55.802 -0.143 1 1 267 . 4 1 1 A 25 25 LEU CB C 25 43.109 42.620 0.489 1 1 271 . 4 1 1 A 25 25 LEU N N 25 117.882 117.513 0.369 1 1 272 . 4 1 1 A 26 26 GLY H H 26 7.776 7.893 -0.117 1 1 273 . 4 1 1 A 26 26 GLY HA2 H 26 4.337 4.018 0.319 1 1 274 . 4 1 1 A 26 26 GLY HA3 H 26 3.856 4.028 -0.172 1 1 275 . 4 1 1 A 26 26 GLY C C 26 175.456 174.801 0.655 1 1 276 . 4 1 1 A 26 26 GLY CA C 26 44.875 45.216 -0.341 1 1 277 . 4 1 1 A 26 26 GLY N N 26 104.938 105.756 -0.818 1 1 278 . 4 1 1 A 27 27 ALA H H 27 8.104 8.510 -0.406 1 1 279 . 4 1 1 A 27 27 ALA HA H 27 4.949 4.598 0.351 1 1 283 . 4 1 1 A 27 27 ALA C C 27 176.448 176.739 -0.291 1 1 284 . 4 1 1 A 27 27 ALA CA C 27 52.183 52.504 -0.321 1 1 285 . 4 1 1 A 27 27 ALA CB C 27 21.814 20.166 1.648 1 1 286 . 4 1 1 A 27 27 ALA N N 27 123.263 124.448 -1.185 1 1 287 . 4 1 1 A 28 28 THR H H 28 9.369 8.943 0.426 1 1 288 . 4 1 1 A 28 28 THR HA H 28 4.779 4.960 -0.181 1 1 293 . 4 1 1 A 28 28 THR C C 28 173.725 173.597 0.128 1 1 294 . 4 1 1 A 28 28 THR CA C 28 60.046 60.737 -0.691 1 1 295 . 4 1 1 A 28 28 THR CB C 28 70.592 70.802 -0.210 1 1 297 . 4 1 1 A 28 28 THR N N 28 112.201 117.139 -4.938 1 1 298 . 4 1 1 A 29 29 LEU H H 29 8.518 8.580 -0.062 1 1 299 . 4 1 1 A 29 29 LEU HA H 29 3.332 3.928 -0.596 1 1 309 . 4 1 1 A 29 29 LEU C C 29 176.202 175.658 0.544 1 1 310 . 4 1 1 A 29 29 LEU CA C 29 55.031 54.998 0.033 1 1 311 . 4 1 1 A 29 29 LEU CB C 29 40.624 41.855 -1.231 1 1 315 . 4 1 1 A 29 29 LEU N N 29 128.151 128.789 -0.638 1 1 316 . 4 1 1 A 30 30 GLU H H 30 9.269 9.351 -0.082 1 1 317 . 4 1 1 A 30 30 GLU HA H 30 4.287 4.353 -0.066 1 1 321 . 4 1 1 A 30 30 GLU C C 30 176.740 176.343 0.397 1 1 322 . 4 1 1 A 30 30 GLU CA C 30 57.283 58.279 -0.996 1 1 323 . 4 1 1 A 30 30 GLU CB C 30 31.045 30.994 0.051 1 1 325 . 4 1 1 A 30 30 GLU N N 30 130.123 125.778 4.345 1 1 326 . 4 1 1 A 31 31 HIS H H 31 7.341 7.054 0.287 1 1 327 . 4 1 1 A 31 31 HIS HA H 31 4.701 5.146 -0.445 1 1 331 . 4 1 1 A 31 31 HIS C C 31 172.581 173.970 -1.389 1 1 332 . 4 1 1 A 31 31 HIS CA C 31 55.876 54.710 1.166 1 1 333 . 4 1 1 A 31 31 HIS CB C 31 33.434 33.992 -0.558 1 1 334 . 4 1 1 A 31 31 HIS N N 31 113.223 114.602 -1.379 1 1 335 . 4 1 1 A 32 32 ARG H H 32 8.196 8.954 -0.758 1 1 336 . 4 1 1 A 32 32 ARG HA H 32 5.262 5.331 -0.069 1 1 341 . 4 1 1 A 32 32 ARG C C 32 174.377 174.691 -0.314 1 1 342 . 4 1 1 A 32 32 ARG CA C 32 55.808 54.507 1.301 1 1 343 . 4 1 1 A 32 32 ARG CB C 32 33.340 33.791 -0.451 1 1 345 . 4 1 1 A 32 32 ARG N N 32 123.003 119.013 3.990 1 1 346 . 4 1 1 A 33 33 VAL H H 33 8.956 9.124 -0.168 1 1 347 . 4 1 1 A 33 33 VAL HA H 33 4.734 4.750 -0.016 1 1 355 . 4 1 1 A 33 33 VAL C C 33 172.821 174.536 -1.715 1 1 356 . 4 1 1 A 33 33 VAL CA C 33 60.197 59.614 0.583 1 1 357 . 4 1 1 A 33 33 VAL CB C 33 35.860 34.619 1.241 1 1 360 . 4 1 1 A 33 33 VAL N N 33 122.929 117.342 5.587 1 1 361 . 4 1 1 A 34 34 THR H H 34 8.250 8.512 -0.262 1 1 362 . 4 1 1 A 34 34 THR HA H 34 5.616 5.558 0.058 1 1 367 . 4 1 1 A 34 34 THR C C 34 173.913 173.183 0.730 1 1 368 . 4 1 1 A 34 34 THR CA C 34 60.245 60.271 -0.026 1 1 369 . 4 1 1 A 34 34 THR CB C 34 71.706 71.058 0.648 1 1 371 . 4 1 1 A 34 34 THR N N 34 119.164 116.262 2.902 1 1 372 . 4 1 1 A 35 35 PHE H H 35 8.565 8.512 0.053 1 1 373 . 4 1 1 A 35 35 PHE HA H 35 5.029 5.057 -0.028 1 1 378 . 4 1 1 A 35 35 PHE C C 35 173.193 172.173 1.020 1 1 379 . 4 1 1 A 35 35 PHE CA C 35 55.687 56.362 -0.675 1 1 380 . 4 1 1 A 35 35 PHE CB C 35 40.853 40.733 0.120 1 1 383 . 4 1 1 A 35 35 PHE N N 35 120.244 118.451 1.793 1 1 384 . 4 1 1 A 36 36 ARG H H 36 8.869 8.621 0.248 1 1 385 . 4 1 1 A 36 36 ARG HA H 36 4.982 4.787 0.195 1 1 387 . 4 1 1 A 36 36 ARG C C 36 174.743 175.095 -0.352 1 1 388 . 4 1 1 A 36 36 ARG CA C 36 55.493 55.655 -0.162 1 1 389 . 4 1 1 A 36 36 ARG CB C 36 32.228 31.684 0.544 1 1 390 . 4 1 1 A 36 36 ARG N N 36 123.893 121.291 2.602 1 1 391 . 4 1 1 A 37 37 ASP H H 37 8.402 9.315 -0.913 1 1 392 . 4 1 1 A 37 37 ASP HA H 37 5.462 5.572 -0.110 1 1 395 . 4 1 1 A 37 37 ASP C C 37 175.177 175.704 -0.527 1 1 396 . 4 1 1 A 37 37 ASP CA C 37 53.942 52.849 1.093 1 1 397 . 4 1 1 A 37 37 ASP CB C 37 45.486 43.908 1.578 1 1 398 . 4 1 1 A 37 37 ASP N N 37 127.149 125.866 1.283 1 1 399 . 4 1 1 A 38 38 THR H H 38 8.151 8.639 -0.488 1 1 400 . 4 1 1 A 38 38 THR HA H 38 4.866 5.140 -0.274 1 1 405 . 4 1 1 A 38 38 THR C C 38 172.792 172.600 0.192 1 1 406 . 4 1 1 A 38 38 THR CA C 38 61.416 60.554 0.862 1 1 407 . 4 1 1 A 38 38 THR CB C 38 71.047 71.079 -0.032 1 1 409 . 4 1 1 A 38 38 THR N N 38 115.686 114.149 1.537 1 1 410 . 4 1 1 A 39 39 TYR H H 39 9.021 9.058 -0.037 1 1 411 . 4 1 1 A 39 39 TYR HA H 39 5.544 5.773 -0.229 1 1 416 . 4 1 1 A 39 39 TYR C C 39 176.032 174.701 1.331 1 1 417 . 4 1 1 A 39 39 TYR CA C 39 57.184 56.280 0.904 1 1 418 . 4 1 1 A 39 39 TYR CB C 39 41.642 40.315 1.327 1 1 420 . 4 1 1 A 39 39 TYR N N 39 124.579 124.930 -0.351 1 1 421 . 4 1 1 A 40 40 TYR H H 40 8.487 9.030 -0.543 1 1 422 . 4 1 1 A 40 40 TYR HA H 40 5.517 5.718 -0.201 1 1 426 . 4 1 1 A 40 40 TYR C C 40 174.108 174.593 -0.485 1 1 427 . 4 1 1 A 40 40 TYR CA C 40 56.979 56.839 0.140 1 1 428 . 4 1 1 A 40 40 TYR CB C 40 44.132 42.385 1.747 1 1 431 . 4 1 1 A 40 40 TYR N N 40 119.709 122.117 -2.408 1 1 432 . 4 1 1 A 41 41 ASP H H 41 9.341 8.874 0.467 1 1 433 . 4 1 1 A 41 41 ASP HA H 41 4.866 5.112 -0.246 1 1 436 . 4 1 1 A 41 41 ASP C C 41 177.262 175.128 2.134 1 1 437 . 4 1 1 A 41 41 ASP CA C 41 53.445 53.446 -0.001 1 1 438 . 4 1 1 A 41 41 ASP CB C 41 45.347 44.653 0.694 1 1 439 . 4 1 1 A 41 41 ASP N N 41 117.995 120.744 -2.749 1 1 440 . 4 1 1 A 42 42 THR H H 42 11.574 8.679 2.895 1 1 441 . 4 1 1 A 42 42 THR HA H 42 5.206 4.571 0.635 1 1 446 . 4 1 1 A 42 42 THR C C 42 177.935 176.508 1.427 1 1 447 . 4 1 1 A 42 42 THR CA C 42 60.400 62.261 -1.861 1 1 448 . 4 1 1 A 42 42 THR CB C 42 72.114 69.795 2.319 1 1 450 . 4 1 1 A 42 42 THR N N 42 114.394 117.748 -3.354 1 1 451 . 4 1 1 A 43 43 SER H H 43 9.715 8.874 0.841 1 1 452 . 4 1 1 A 43 43 SER HA H 43 4.252 4.114 0.138 1 1 455 . 4 1 1 A 43 43 SER C C 43 175.478 175.454 0.024 1 1 456 . 4 1 1 A 43 43 SER CA C 43 61.277 61.160 0.117 1 1 457 . 4 1 1 A 43 43 SER CB C 43 62.821 62.645 0.176 1 1 458 . 4 1 1 A 43 43 SER N N 43 116.674 119.233 -2.559 1 1 459 . 4 1 1 A 44 44 GLU H H 44 7.674 7.685 -0.011 1 1 460 . 4 1 1 A 44 44 GLU HA H 44 4.330 4.458 -0.128 1 1 464 . 4 1 1 A 44 44 GLU C C 44 175.001 175.336 -0.335 1 1 465 . 4 1 1 A 44 44 GLU CA C 44 55.992 55.984 0.008 1 1 466 . 4 1 1 A 44 44 GLU CB C 44 29.276 29.719 -0.443 1 1 468 . 4 1 1 A 44 44 GLU N N 44 117.856 118.893 -1.037 1 1 469 . 4 1 1 A 45 45 LEU H H 45 8.222 8.068 0.154 1 1 470 . 4 1 1 A 45 45 LEU HA H 45 3.901 3.963 -0.062 1 1 480 . 4 1 1 A 45 45 LEU C C 45 175.209 176.489 -1.280 1 1 481 . 4 1 1 A 45 45 LEU CA C 45 55.548 56.062 -0.514 1 1 482 . 4 1 1 A 45 45 LEU CB C 45 38.458 39.956 -1.498 1 1 485 . 4 1 1 A 45 45 LEU N N 45 119.335 117.411 1.924 1 1 486 . 4 1 1 A 46 46 SER H H 46 7.347 8.003 -0.656 1 1 487 . 4 1 1 A 46 46 SER HA H 46 3.954 4.284 -0.330 1 1 489 . 4 1 1 A 46 46 SER C C 46 177.497 176.774 0.723 1 1 490 . 4 1 1 A 46 46 SER CA C 46 62.471 61.102 1.369 1 1 491 . 4 1 1 A 46 46 SER CB C 46 63.908 63.028 0.880 1 1 492 . 4 1 1 A 46 46 SER N N 46 111.433 114.217 -2.784 1 1 493 . 4 1 1 A 47 47 LEU H H 47 12.003 8.627 3.376 1 1 494 . 4 1 1 A 47 47 LEU HA H 47 3.959 4.219 -0.260 1 1 504 . 4 1 1 A 47 47 LEU C C 47 180.340 178.319 2.021 1 1 505 . 4 1 1 A 47 47 LEU CA C 47 58.879 57.899 0.980 1 1 506 . 4 1 1 A 47 47 LEU CB C 47 39.572 41.890 -2.318 1 1 510 . 4 1 1 A 47 47 LEU N N 47 124.605 123.163 1.442 1 1 511 . 4 1 1 A 48 48 MET H H 48 10.599 8.915 1.684 1 1 512 . 4 1 1 A 48 48 MET HA H 48 3.213 3.799 -0.586 1 1 520 . 4 1 1 A 48 48 MET C C 48 181.177 178.174 3.003 1 1 521 . 4 1 1 A 48 48 MET CA C 48 60.747 58.392 2.355 1 1 522 . 4 1 1 A 48 48 MET CB C 48 32.594 32.066 0.528 1 1 525 . 4 1 1 A 48 48 MET N N 48 126.254 118.792 7.462 1 1 526 . 4 1 1 A 49 49 LEU H H 49 8.731 7.767 0.964 1 1 527 . 4 1 1 A 49 49 LEU HA H 49 4.097 4.070 0.027 1 1 536 . 4 1 1 A 49 49 LEU C C 49 178.144 177.704 0.440 1 1 537 . 4 1 1 A 49 49 LEU CA C 49 57.800 57.072 0.728 1 1 538 . 4 1 1 A 49 49 LEU CB C 49 41.379 41.669 -0.290 1 1 541 . 4 1 1 A 49 49 LEU N N 49 119.183 120.854 -1.671 1 1 542 . 4 1 1 A 50 50 SER H H 50 7.853 7.394 0.459 1 1 543 . 4 1 1 A 50 50 SER HA H 50 4.822 4.573 0.249 1 1 546 . 4 1 1 A 50 50 SER C C 50 174.539 173.437 1.102 1 1 547 . 4 1 1 A 50 50 SER CA C 50 57.811 57.364 0.447 1 1 548 . 4 1 1 A 50 50 SER CB C 50 64.443 63.257 1.186 1 1 549 . 4 1 1 A 50 50 SER N N 50 114.594 113.815 0.779 1 1 550 . 4 1 1 A 51 51 ASP H H 51 8.264 7.591 0.673 1 1 551 . 4 1 1 A 51 51 ASP HA H 51 4.362 4.017 0.345 1 1 554 . 4 1 1 A 51 51 ASP C C 51 172.921 174.404 -1.483 1 1 555 . 4 1 1 A 51 51 ASP CA C 51 55.343 55.306 0.037 1 1 556 . 4 1 1 A 51 51 ASP CB C 51 40.583 39.275 1.308 1 1 557 . 4 1 1 A 51 51 ASP N N 51 123.003 118.308 4.695 1 1 558 . 4 1 1 A 52 52 HIS H H 52 7.869 7.214 0.655 1 1 559 . 4 1 1 A 52 52 HIS HA H 52 5.335 4.914 0.421 1 1 564 . 4 1 1 A 52 52 HIS C C 52 173.991 173.589 0.402 1 1 565 . 4 1 1 A 52 52 HIS CA C 52 55.889 54.051 1.838 1 1 566 . 4 1 1 A 52 52 HIS CB C 52 31.789 30.396 1.393 1 1 568 . 4 1 1 A 52 52 HIS N N 52 112.486 117.061 -4.575 1 1 569 . 4 1 1 A 53 53 TRP H H 53 8.165 9.448 -1.283 1 1 570 . 4 1 1 A 53 53 TRP HA H 53 4.926 5.458 -0.532 1 1 578 . 4 1 1 A 53 53 TRP C C 53 175.354 174.997 0.357 1 1 579 . 4 1 1 A 53 53 TRP CA C 53 55.364 55.434 -0.070 1 1 580 . 4 1 1 A 53 53 TRP CB C 53 30.641 31.930 -1.289 1 1 585 . 4 1 1 A 53 53 TRP N N 53 117.916 124.987 -7.071 1 1 587 . 4 1 1 A 54 54 LEU H H 54 10.088 8.960 1.128 1 1 588 . 4 1 1 A 54 54 LEU HA H 54 5.497 5.418 0.079 1 1 598 . 4 1 1 A 54 54 LEU C C 54 173.337 174.856 -1.519 1 1 599 . 4 1 1 A 54 54 LEU CA C 54 54.408 53.467 0.941 1 1 600 . 4 1 1 A 54 54 LEU CB C 54 44.156 45.858 -1.702 1 1 604 . 4 1 1 A 54 54 LEU N N 54 130.826 125.011 5.815 1 1 605 . 4 1 1 A 55 55 ARG H H 55 9.289 9.257 0.032 1 1 606 . 4 1 1 A 55 55 ARG HA H 55 5.482 5.454 0.028 1 1 612 . 4 1 1 A 55 55 ARG C C 55 174.057 173.959 0.098 1 1 613 . 4 1 1 A 55 55 ARG CA C 55 53.167 53.864 -0.697 1 1 614 . 4 1 1 A 55 55 ARG CB C 55 34.270 33.955 0.315 1 1 616 . 4 1 1 A 55 55 ARG N N 55 125.089 124.551 0.538 1 1 618 . 4 1 1 A 56 56 GLN H H 56 9.092 8.815 0.277 1 1 619 . 4 1 1 A 56 56 GLN HA H 56 3.991 4.460 -0.469 1 1 626 . 4 1 1 A 56 56 GLN C C 56 174.199 174.556 -0.357 1 1 627 . 4 1 1 A 56 56 GLN CA C 56 54.566 53.841 0.725 1 1 628 . 4 1 1 A 56 56 GLN CB C 56 29.643 30.372 -0.729 1 1 630 . 4 1 1 A 56 56 GLN N N 56 124.355 120.998 3.357 1 1 632 . 4 1 1 A 57 57 ARG H H 57 8.440 8.192 0.248 1 1 633 . 4 1 1 A 57 57 ARG HA H 57 5.316 4.349 0.967 1 1 639 . 4 1 1 A 57 57 ARG C C 57 176.188 176.434 -0.246 1 1 640 . 4 1 1 A 57 57 ARG CA C 57 53.940 55.828 -1.888 1 1 641 . 4 1 1 A 57 57 ARG CB C 57 32.426 29.421 3.005 1 1 643 . 4 1 1 A 57 57 ARG N N 57 130.222 125.033 5.189 1 1 645 . 4 1 1 A 58 58 GLU H H 58 8.891 9.109 -0.218 1 1 646 . 4 1 1 A 58 58 GLU HA H 58 3.996 4.157 -0.161 1 1 649 . 4 1 1 A 58 58 GLU CA C 58 58.364 58.778 -0.414 1 1 650 . 4 1 1 A 58 58 GLU CB C 58 30.875 29.411 1.464 1 1 651 . 4 1 1 A 58 58 GLU N N 58 131.208 119.930 11.278 1 1 652 . 4 1 1 A 59 59 GLY H H 59 8.367 8.069 0.298 1 1 653 . 4 1 1 A 59 59 GLY HA2 H 59 4.334 3.993 0.341 1 1 654 . 4 1 1 A 59 59 GLY HA3 H 59 3.743 4.071 -0.328 1 1 655 . 4 1 1 A 59 59 GLY C C 59 174.194 175.185 -0.991 1 1 656 . 4 1 1 A 59 59 GLY CA C 59 45.666 45.559 0.107 1 1 657 . 4 1 1 A 60 60 SER H H 60 8.071 8.211 -0.140 1 1 658 . 4 1 1 A 60 60 SER HA H 60 4.730 4.377 0.353 1 1 661 . 4 1 1 A 60 60 SER C C 60 173.908 174.521 -0.613 1 1 662 . 4 1 1 A 60 60 SER CA C 60 58.762 58.995 -0.233 1 1 663 . 4 1 1 A 60 60 SER CB C 60 64.497 64.182 0.315 1 1 664 . 4 1 1 A 60 60 SER N N 60 114.636 115.617 -0.981 1 1 665 . 4 1 1 A 61 61 GLY H H 61 8.401 7.246 1.155 1 1 666 . 4 1 1 A 61 61 GLY HA2 H 61 4.560 4.009 0.551 1 1 667 . 4 1 1 A 61 61 GLY HA3 H 61 3.878 4.023 -0.145 1 1 668 . 4 1 1 A 61 61 GLY C C 61 173.526 171.770 1.756 1 1 669 . 4 1 1 A 61 61 GLY CA C 61 44.906 45.310 -0.404 1 1 670 . 4 1 1 A 61 61 GLY N N 61 109.421 106.451 2.970 1 1 671 . 4 1 1 A 62 62 TRP H H 62 8.861 8.453 0.408 1 1 672 . 4 1 1 A 62 62 TRP HA H 62 5.089 5.238 -0.149 1 1 681 . 4 1 1 A 62 62 TRP C C 62 176.168 175.685 0.483 1 1 682 . 4 1 1 A 62 62 TRP CA C 62 57.459 57.214 0.245 1 1 683 . 4 1 1 A 62 62 TRP CB C 62 32.536 31.832 0.704 1 1 689 . 4 1 1 A 62 62 TRP N N 62 122.939 120.690 2.249 1 1 691 . 4 1 1 A 63 63 GLU H H 63 9.306 9.375 -0.069 1 1 692 . 4 1 1 A 63 63 GLU HA H 63 4.919 5.004 -0.085 1 1 697 . 4 1 1 A 63 63 GLU C C 63 173.770 174.121 -0.351 1 1 698 . 4 1 1 A 63 63 GLU CA C 63 55.953 55.439 0.514 1 1 699 . 4 1 1 A 63 63 GLU CB C 63 35.317 33.347 1.970 1 1 701 . 4 1 1 A 63 63 GLU N N 63 120.136 121.484 -1.348 1 1 702 . 4 1 1 A 64 64 LEU H H 64 8.998 9.368 -0.370 1 1 703 . 4 1 1 A 64 64 LEU HA H 64 5.616 5.526 0.090 1 1 712 . 4 1 1 A 64 64 LEU C C 64 175.014 173.979 1.035 1 1 713 . 4 1 1 A 64 64 LEU CA C 64 52.945 53.941 -0.996 1 1 714 . 4 1 1 A 64 64 LEU CB C 64 46.904 45.694 1.210 1 1 717 . 4 1 1 A 64 64 LEU N N 64 127.321 128.516 -1.195 1 1 718 . 4 1 1 A 65 65 LYS H H 65 9.322 9.988 -0.666 1 1 719 . 4 1 1 A 65 65 LYS HA H 65 5.347 5.623 -0.276 1 1 727 . 4 1 1 A 65 65 LYS C C 65 175.811 175.329 0.482 1 1 728 . 4 1 1 A 65 65 LYS CA C 65 55.817 55.233 0.584 1 1 729 . 4 1 1 A 65 65 LYS CB C 65 34.521 34.882 -0.361 1 1 733 . 4 1 1 A 65 65 LYS N N 65 129.874 128.660 1.214 1 1 734 . 4 1 1 A 66 66 CYS H H 66 9.129 9.665 -0.536 1 1 735 . 4 1 1 A 66 66 CYS HA H 66 5.319 5.191 0.128 1 1 738 . 4 1 1 A 66 66 CYS CA C 66 54.532 56.913 -2.381 1 1 739 . 4 1 1 A 66 66 CYS CB C 66 28.813 31.013 -2.200 1 1 740 . 4 1 1 A 66 66 CYS N N 66 121.497 125.393 -3.896 1 1 741 . 4 1 1 A 67 67 PRO HA H 67 4.439 4.280 0.159 1 1 748 . 4 1 1 A 67 67 PRO C C 67 177.297 177.873 -0.576 1 1 749 . 4 1 1 A 67 67 PRO CA C 67 63.596 63.629 -0.033 1 1 750 . 4 1 1 A 67 67 PRO CB C 67 32.242 31.630 0.612 1 1 752 . 4 1 1 A 68 68 GLY H H 68 8.316 8.211 0.105 1 1 753 . 4 1 1 A 68 68 GLY HA2 H 68 3.726 3.998 -0.272 1 1 754 . 4 1 1 A 68 68 GLY HA3 H 68 4.095 4.021 0.074 1 1 755 . 4 1 1 A 68 68 GLY C C 68 173.789 174.074 -0.285 1 1 756 . 4 1 1 A 68 68 GLY CA C 68 45.227 45.289 -0.062 1 1 757 . 4 1 1 A 68 68 GLY N N 68 109.533 110.212 -0.679 1 1 758 . 4 1 1 A 69 69 VAL H H 69 8.114 7.763 0.351 1 1 759 . 4 1 1 A 69 69 VAL HA H 69 4.266 4.157 0.109 1 1 764 . 4 1 1 A 69 69 VAL C C 69 176.299 175.386 0.913 1 1 765 . 4 1 1 A 69 69 VAL CA C 69 61.945 62.831 -0.886 1 1 766 . 4 1 1 A 69 69 VAL CB C 69 33.082 32.751 0.331 1 1 768 . 4 1 1 A 69 69 VAL N N 69 118.540 121.859 -3.319 1 1 769 . 4 1 1 A 70 70 THR H H 70 8.324 8.908 -0.584 1 1 770 . 4 1 1 A 70 70 THR HA H 70 4.373 4.601 -0.228 1 1 775 . 4 1 1 A 70 70 THR C C 70 175.204 173.996 1.208 1 1 776 . 4 1 1 A 70 70 THR CA C 70 62.309 61.066 1.243 1 1 777 . 4 1 1 A 70 70 THR CB C 70 69.787 70.117 -0.330 1 1 779 . 4 1 1 A 70 70 THR N N 70 117.636 119.988 -2.352 1 1 780 . 4 1 1 A 71 71 GLY H H 71 8.574 8.611 -0.037 1 1 781 . 4 1 1 A 71 71 GLY HA2 H 71 4.096 4.008 0.088 1 1 782 . 4 1 1 A 71 71 GLY HA3 H 71 3.975 4.008 -0.033 1 1 783 . 4 1 1 A 71 71 GLY C C 71 174.313 174.523 -0.210 1 1 784 . 4 1 1 A 71 71 GLY CA C 71 45.545 46.408 -0.863 1 1 785 . 4 1 1 A 71 71 GLY N N 71 111.677 116.672 -4.995 1 1 786 . 4 1 1 A 72 72 VAL H H 72 7.945 8.130 -0.185 1 1 787 . 4 1 1 A 72 72 VAL HA H 72 4.258 4.227 0.031 1 1 795 . 4 1 1 A 72 72 VAL C C 72 176.162 175.455 0.707 1 1 796 . 4 1 1 A 72 72 VAL CA C 72 62.227 63.620 -1.393 1 1 797 . 4 1 1 A 72 72 VAL CB C 72 32.997 33.087 -0.090 1 1 799 . 4 1 1 A 72 72 VAL N N 72 118.647 117.740 0.907 1 1 800 . 4 1 1 A 73 73 SER H H 73 8.498 8.092 0.406 1 1 801 . 4 1 1 A 73 73 SER HA H 73 4.617 4.244 0.373 1 1 803 . 4 1 1 A 73 73 SER C C 73 174.461 173.826 0.635 1 1 804 . 4 1 1 A 73 73 SER CA C 73 58.218 59.093 -0.875 1 1 805 . 4 1 1 A 73 73 SER CB C 73 64.061 61.945 2.116 1 1 806 . 4 1 1 A 73 73 SER N N 73 118.828 115.141 3.687 1 1 807 . 4 1 1 A 74 74 GLY H H 74 8.247 8.148 0.099 1 1 808 . 4 1 1 A 74 74 GLY HA2 H 74 4.101 4.166 -0.065 1 1 809 . 4 1 1 A 74 74 GLY HA3 H 74 4.304 4.172 0.132 1 1 810 . 4 1 1 A 74 74 GLY CA C 74 44.896 45.157 -0.261 1 1 811 . 4 1 1 A 74 74 GLY N N 74 111.138 111.470 -0.332 1 1 812 . 4 1 1 A 75 75 PRO HA H 75 4.461 4.393 0.068 1 1 819 . 4 1 1 A 75 75 PRO C C 75 176.798 176.165 0.633 1 1 820 . 4 1 1 A 75 75 PRO CA C 75 63.466 65.383 -1.917 1 1 821 . 4 1 1 A 75 75 PRO CB C 75 31.980 31.609 0.371 1 1 824 . 4 1 1 A 76 76 HIS H H 76 8.397 7.337 1.060 1 1 825 . 4 1 1 A 76 76 HIS HA H 76 4.742 4.844 -0.102 1 1 829 . 4 1 1 A 76 76 HIS C C 76 174.282 173.593 0.689 1 1 830 . 4 1 1 A 76 76 HIS CA C 76 55.579 54.454 1.125 1 1 831 . 4 1 1 A 76 76 HIS CB C 76 30.501 31.928 -1.427 1 1 832 . 4 1 1 A 76 76 HIS N N 76 118.431 111.449 6.982 1 1 833 . 4 1 1 A 77 77 ASN H H 77 8.364 9.464 -1.100 1 1 834 . 4 1 1 A 77 77 ASN HA H 77 4.767 4.967 -0.200 1 1 839 . 4 1 1 A 77 77 ASN C C 77 174.576 175.038 -0.462 1 1 840 . 4 1 1 A 77 77 ASN CA C 77 53.139 52.057 1.082 1 1 841 . 4 1 1 A 77 77 ASN CB C 77 39.320 39.527 -0.207 1 1 842 . 4 1 1 A 77 77 ASN N N 77 119.421 119.024 0.397 1 1 844 . 4 1 1 A 78 78 GLU H H 78 8.683 8.259 0.424 1 1 845 . 4 1 1 A 78 78 GLU HA H 78 4.409 4.368 0.041 1 1 850 . 4 1 1 A 78 78 GLU C C 78 175.791 175.097 0.694 1 1 851 . 4 1 1 A 78 78 GLU CA C 78 56.359 56.883 -0.524 1 1 852 . 4 1 1 A 78 78 GLU CB C 78 30.818 29.247 1.571 1 1 854 . 4 1 1 A 78 78 GLU N N 78 122.085 119.758 2.327 1 1 855 . 4 1 1 A 79 79 TYR H H 79 8.341 8.607 -0.266 1 1 856 . 4 1 1 A 79 79 TYR HA H 79 4.988 5.127 -0.139 1 1 861 . 4 1 1 A 79 79 TYR C C 79 175.837 175.936 -0.099 1 1 862 . 4 1 1 A 79 79 TYR CA C 79 58.028 59.701 -1.673 1 1 863 . 4 1 1 A 79 79 TYR CB C 79 41.672 38.982 2.690 1 1 866 . 4 1 1 A 79 79 TYR N N 79 119.452 122.315 -2.863 1 1 867 . 4 1 1 A 80 80 VAL H H 80 9.366 9.489 -0.123 1 1 868 . 4 1 1 A 80 80 VAL HA H 80 4.370 5.003 -0.633 1 1 873 . 4 1 1 A 80 80 VAL C C 80 174.948 175.119 -0.171 1 1 874 . 4 1 1 A 80 80 VAL CA C 80 61.190 59.724 1.466 1 1 875 . 4 1 1 A 80 80 VAL CB C 80 34.204 34.539 -0.335 1 1 877 . 4 1 1 A 80 80 VAL N N 80 120.567 118.504 2.063 1 1 878 . 4 1 1 A 81 81 GLU H H 81 8.570 9.221 -0.651 1 1 879 . 4 1 1 A 81 81 GLU HA H 81 4.770 5.561 -0.791 1 1 883 . 4 1 1 A 81 81 GLU C C 81 175.491 175.695 -0.204 1 1 884 . 4 1 1 A 81 81 GLU CA C 81 55.655 54.683 0.972 1 1 885 . 4 1 1 A 81 81 GLU CB C 81 30.415 32.436 -2.021 1 1 887 . 4 1 1 A 81 81 GLU N N 81 124.248 123.963 0.285 1 1 888 . 4 1 1 A 82 82 VAL H H 82 9.189 9.472 -0.283 1 1 889 . 4 1 1 A 82 82 VAL HA H 82 4.279 4.907 -0.628 1 1 894 . 4 1 1 A 82 82 VAL C C 82 176.087 175.726 0.361 1 1 895 . 4 1 1 A 82 82 VAL CA C 82 62.672 60.677 1.995 1 1 896 . 4 1 1 A 82 82 VAL CB C 82 33.121 34.052 -0.931 1 1 898 . 4 1 1 A 82 82 VAL N N 82 127.776 119.933 7.843 1 1 899 . 4 1 1 A 83 83 THR H H 83 8.590 8.601 -0.011 1 1 900 . 4 1 1 A 83 83 THR HA H 83 4.955 4.565 0.390 1 1 905 . 4 1 1 A 83 83 THR C C 83 174.688 174.983 -0.295 1 1 906 . 4 1 1 A 83 83 THR CA C 83 61.332 61.515 -0.183 1 1 907 . 4 1 1 A 83 83 THR CB C 83 70.213 70.012 0.201 1 1 909 . 4 1 1 A 83 83 THR N N 83 114.744 116.096 -1.352 1 1 910 . 4 1 1 A 84 84 SER H H 84 7.650 7.428 0.222 1 1 911 . 4 1 1 A 84 84 SER HA H 84 4.819 4.259 0.560 1 1 914 . 4 1 1 A 84 84 SER CA C 84 56.280 60.358 -4.078 1 1 915 . 4 1 1 A 84 84 SER CB C 84 63.294 63.398 -0.104 1 1 916 . 4 1 1 A 84 84 SER N N 84 118.038 118.864 -0.826 1 1 917 . 4 1 1 A 85 85 GLU H H 85 8.391 8.709 -0.318 1 1 918 . 4 1 1 A 85 85 GLU HA H 85 3.661 3.908 -0.247 1 1 923 . 4 1 1 A 85 85 GLU C C 85 177.520 178.458 -0.938 1 1 924 . 4 1 1 A 85 85 GLU CA C 85 62.429 59.595 2.834 1 1 925 . 4 1 1 A 85 85 GLU CB C 85 29.655 29.462 0.193 1 1 927 . 4 1 1 A 86 86 ALA H H 86 8.443 8.120 0.323 1 1 928 . 4 1 1 A 86 86 ALA HA H 86 4.027 3.993 0.034 1 1 932 . 4 1 1 A 86 86 ALA C C 86 180.423 180.179 0.244 1 1 933 . 4 1 1 A 86 86 ALA CA C 86 55.145 54.718 0.427 1 1 934 . 4 1 1 A 86 86 ALA CB C 86 18.165 18.204 -0.039 1 1 935 . 4 1 1 A 86 86 ALA N N 86 119.636 123.069 -3.433 1 1 936 . 4 1 1 A 87 87 ALA H H 87 7.214 7.365 -0.151 1 1 937 . 4 1 1 A 87 87 ALA HA H 87 4.244 4.050 0.194 1 1 941 . 4 1 1 A 87 87 ALA C C 87 180.354 180.102 0.252 1 1 942 . 4 1 1 A 87 87 ALA CA C 87 54.378 55.028 -0.650 1 1 943 . 4 1 1 A 87 87 ALA CB C 87 18.795 18.636 0.159 1 1 944 . 4 1 1 A 87 87 ALA N N 87 121.004 120.199 0.805 1 1 945 . 4 1 1 A 88 88 ILE H H 88 8.471 7.518 0.953 1 1 946 . 4 1 1 A 88 88 ILE HA H 88 3.360 3.703 -0.343 1 1 954 . 4 1 1 A 88 88 ILE CA C 88 66.323 64.416 1.907 1 1 955 . 4 1 1 A 88 88 ILE CB C 88 37.808 37.552 0.256 1 1 958 . 4 1 1 A 88 88 ILE N N 88 120.743 119.398 1.345 1 1 959 . 4 1 1 A 89 89 VAL H H 89 8.343 8.378 -0.035 1 1 960 . 4 1 1 A 89 89 VAL HA H 89 3.061 3.498 -0.437 1 1 968 . 4 1 1 A 89 89 VAL C C 89 176.708 178.038 -1.330 1 1 969 . 4 1 1 A 89 89 VAL CA C 89 67.833 66.439 1.394 1 1 970 . 4 1 1 A 89 89 VAL CB C 89 31.509 31.240 0.269 1 1 973 . 4 1 1 A 89 89 VAL N N 89 118.049 119.824 -1.775 1 1 974 . 4 1 1 A 90 90 ALA H H 90 7.516 7.950 -0.434 1 1 975 . 4 1 1 A 90 90 ALA HA H 90 3.987 3.887 0.100 1 1 979 . 4 1 1 A 90 90 ALA C C 90 180.744 179.313 1.431 1 1 980 . 4 1 1 A 90 90 ALA CA C 90 55.481 55.687 -0.206 1 1 981 . 4 1 1 A 90 90 ALA CB C 90 17.953 18.283 -0.330 1 1 982 . 4 1 1 A 90 90 ALA N N 90 118.935 122.007 -3.072 1 1 983 . 4 1 1 A 91 91 GLN H H 91 7.886 7.831 0.055 1 1 984 . 4 1 1 A 91 91 GLN HA H 91 4.190 3.982 0.208 1 1 991 . 4 1 1 A 91 91 GLN C C 91 178.832 178.427 0.405 1 1 992 . 4 1 1 A 91 91 GLN CA C 91 58.519 58.848 -0.329 1 1 993 . 4 1 1 A 91 91 GLN CB C 91 28.091 28.271 -0.180 1 1 995 . 4 1 1 A 91 91 GLN N N 91 117.846 117.937 -0.091 1 1 997 . 4 1 1 A 92 92 LEU H H 92 8.751 8.641 0.110 1 1 998 . 4 1 1 A 92 92 LEU HA H 92 3.903 3.934 -0.031 1 1 1007 . 4 1 1 A 92 92 LEU C C 92 178.997 178.986 0.011 1 1 1008 . 4 1 1 A 92 92 LEU CA C 92 58.136 57.819 0.317 1 1 1009 . 4 1 1 A 92 92 LEU CB C 92 41.576 41.459 0.117 1 1 1013 . 4 1 1 A 92 92 LEU N N 92 119.547 119.685 -0.138 1 1 1014 . 4 1 1 A 93 93 PHE H H 93 8.648 7.928 0.720 1 1 1015 . 4 1 1 A 93 93 PHE HA H 93 4.270 4.160 0.110 1 1 1020 . 4 1 1 A 93 93 PHE C C 93 179.283 178.769 0.514 1 1 1021 . 4 1 1 A 93 93 PHE CA C 93 59.860 60.449 -0.589 1 1 1022 . 4 1 1 A 93 93 PHE CB C 93 37.765 38.212 -0.447 1 1 1025 . 4 1 1 A 93 93 PHE N N 93 118.041 119.352 -1.311 1 1 1026 . 4 1 1 A 94 94 GLU H H 94 7.739 8.425 -0.686 1 1 1027 . 4 1 1 A 94 94 GLU HA H 94 4.110 4.122 -0.012 1 1 1031 . 4 1 1 A 94 94 GLU C C 94 178.629 178.953 -0.324 1 1 1032 . 4 1 1 A 94 94 GLU CA C 94 59.359 59.370 -0.011 1 1 1033 . 4 1 1 A 94 94 GLU CB C 94 29.589 28.692 0.897 1 1 1035 . 4 1 1 A 94 94 GLU N N 94 119.980 117.279 2.701 1 1 1036 . 4 1 1 A 95 95 LEU H H 95 7.999 8.328 -0.329 1 1 1037 . 4 1 1 A 95 95 LEU HA H 95 4.139 3.919 0.220 1 1 1047 . 4 1 1 A 95 95 LEU C C 95 178.965 178.110 0.855 1 1 1048 . 4 1 1 A 95 95 LEU CA C 95 57.557 57.793 -0.236 1 1 1049 . 4 1 1 A 95 95 LEU CB C 95 43.443 41.481 1.962 1 1 1053 . 4 1 1 A 95 95 LEU N N 95 118.398 121.544 -3.146 1 1 1054 . 4 1 1 A 96 96 LEU H H 96 8.363 7.801 0.562 1 1 1055 . 4 1 1 A 96 96 LEU HA H 96 4.503 4.345 0.158 1 1 1061 . 4 1 1 A 96 96 LEU C C 96 177.932 177.096 0.836 1 1 1062 . 4 1 1 A 96 96 LEU CA C 96 54.700 54.689 0.011 1 1 1063 . 4 1 1 A 96 96 LEU CB C 96 43.048 42.346 0.702 1 1 1065 . 4 1 1 A 96 96 LEU N N 96 114.720 115.857 -1.137 1 1 1066 . 4 1 1 A 97 97 GLY H H 97 7.810 7.561 0.249 1 1 1067 . 4 1 1 A 97 97 GLY HA2 H 97 3.963 3.971 -0.008 1 1 1068 . 4 1 1 A 97 97 GLY C C 97 173.535 174.487 -0.952 1 1 1069 . 4 1 1 A 97 97 GLY CA C 97 45.667 45.385 0.282 1 1 1070 . 4 1 1 A 97 97 GLY N N 97 109.511 107.505 2.006 1 1 1071 . 4 1 1 A 98 98 SER H H 98 8.131 8.434 -0.303 1 1 1072 . 4 1 1 A 98 98 SER HA H 98 4.225 4.018 0.207 1 1 1075 . 4 1 1 A 98 98 SER C C 98 174.974 174.319 0.655 1 1 1076 . 4 1 1 A 98 98 SER CA C 98 57.960 59.615 -1.655 1 1 1077 . 4 1 1 A 98 98 SER CB C 98 63.997 62.609 1.388 1 1 1078 . 4 1 1 A 98 98 SER N N 98 113.405 115.499 -2.094 1 1 1079 . 4 1 1 A 99 99 GLY H H 99 8.052 8.062 -0.010 1 1 1080 . 4 1 1 A 99 99 GLY HA2 H 99 3.998 3.856 0.142 1 1 1081 . 4 1 1 A 99 99 GLY HA3 H 99 3.778 3.877 -0.099 1 1 1082 . 4 1 1 A 99 99 GLY C C 99 174.033 173.785 0.248 1 1 1083 . 4 1 1 A 99 99 GLY CA C 99 45.123 45.491 -0.368 1 1 1084 . 4 1 1 A 99 99 GLY N N 99 111.534 108.438 3.096 1 1 1085 . 4 1 1 A 100 100 GLU H H 100 8.177 7.661 0.516 1 1 1086 . 4 1 1 A 100 100 GLU HA H 100 4.201 4.654 -0.453 1 1 1091 . 4 1 1 A 100 100 GLU C C 100 175.830 175.831 -0.001 1 1 1092 . 4 1 1 A 100 100 GLU CA C 100 56.442 55.133 1.309 1 1 1093 . 4 1 1 A 100 100 GLU CB C 100 30.428 31.504 -1.076 1 1 1095 . 4 1 1 A 100 100 GLU N N 100 120.463 120.000 0.463 1 1 1096 . 4 1 1 A 101 101 GLN H H 101 8.161 8.562 -0.401 1 1 1097 . 4 1 1 A 101 101 GLN HA H 101 4.098 4.780 -0.682 1 1 1103 . 4 1 1 A 101 101 GLN C C 101 175.412 176.066 -0.654 1 1 1104 . 4 1 1 A 101 101 GLN CA C 101 55.632 55.421 0.211 1 1 1105 . 4 1 1 A 101 101 GLN CB C 101 29.569 30.132 -0.563 1 1 1107 . 4 1 1 A 101 101 GLN N N 101 120.014 119.606 0.408 1 1 1109 . 4 1 1 A 102 102 LYS H H 102 8.235 8.693 -0.458 1 1 1110 . 4 1 1 A 102 102 LYS HA H 102 4.387 4.239 0.148 1 1 1117 . 4 1 1 A 102 102 LYS CA C 102 54.116 54.441 -0.325 1 1 1118 . 4 1 1 A 102 102 LYS CB C 102 32.478 31.989 0.489 1 1 1122 . 4 1 1 A 102 102 LYS N N 102 123.399 122.809 0.590 1 1 1123 . 4 1 1 A 103 103 PRO HA H 103 4.498 4.371 0.127 1 1 1129 . 4 1 1 A 103 103 PRO C C 103 175.473 176.972 -1.499 1 1 1130 . 4 1 1 A 103 103 PRO CA C 103 62.802 65.866 -3.064 1 1 1131 . 4 1 1 A 103 103 PRO CB C 103 32.124 31.567 0.557 1 1 1134 . 4 1 1 A 104 104 ALA H H 104 8.017 7.273 0.744 1 1 1135 . 4 1 1 A 104 104 ALA HA H 104 4.318 4.295 0.023 1 1 1139 . 4 1 1 A 104 104 ALA C C 104 176.717 176.929 -0.212 1 1 1140 . 4 1 1 A 104 104 ALA CA C 104 52.194 53.056 -0.862 1 1 1141 . 4 1 1 A 104 104 ALA CB C 104 20.113 20.736 -0.623 1 1 1142 . 4 1 1 A 104 104 ALA N N 104 122.093 118.150 3.943 1 1 1143 . 4 1 1 A 105 105 GLY H H 105 7.678 8.088 -0.410 1 1 1144 . 4 1 1 A 105 105 GLY HA2 H 105 3.851 4.016 -0.165 1 1 1145 . 4 1 1 A 105 105 GLY HA3 H 105 4.053 4.041 0.012 1 1 1146 . 4 1 1 A 105 105 GLY C C 105 172.990 174.827 -1.837 1 1 1147 . 4 1 1 A 105 105 GLY CA C 105 44.241 43.640 0.601 1 1 1148 . 4 1 1 A 105 105 GLY N N 105 105.234 106.541 -1.307 1 1 1149 . 4 1 1 A 106 106 VAL H H 106 8.409 8.115 0.294 1 1 1150 . 4 1 1 A 106 106 VAL HA H 106 2.829 3.322 -0.493 1 1 1158 . 4 1 1 A 106 106 VAL C C 106 177.822 177.253 0.569 1 1 1159 . 4 1 1 A 106 106 VAL CA C 106 65.522 65.540 -0.018 1 1 1160 . 4 1 1 A 106 106 VAL CB C 106 30.701 30.757 -0.056 1 1 1163 . 4 1 1 A 106 106 VAL N N 106 119.215 119.516 -0.301 1 1 1164 . 4 1 1 A 107 107 ALA H H 107 8.707 8.111 0.596 1 1 1165 . 4 1 1 A 107 107 ALA HA H 107 3.730 3.942 -0.212 1 1 1169 . 4 1 1 A 107 107 ALA C C 107 179.661 179.384 0.277 1 1 1170 . 4 1 1 A 107 107 ALA CA C 107 54.995 54.980 0.015 1 1 1171 . 4 1 1 A 107 107 ALA CB C 107 17.705 18.066 -0.361 1 1 1172 . 4 1 1 A 107 107 ALA N N 107 118.672 121.804 -3.132 1 1 1173 . 4 1 1 A 108 108 ALA H H 108 7.388 7.665 -0.277 1 1 1174 . 4 1 1 A 108 108 ALA HA H 108 4.259 4.211 0.048 1 1 1178 . 4 1 1 A 108 108 ALA C C 108 179.318 179.415 -0.097 1 1 1179 . 4 1 1 A 108 108 ALA CA C 108 53.481 54.334 -0.853 1 1 1180 . 4 1 1 A 108 108 ALA CB C 108 19.367 18.854 0.513 1 1 1181 . 4 1 1 A 108 108 ALA N N 108 116.635 119.569 -2.934 1 1 1182 . 4 1 1 A 109 109 VAL H H 109 7.689 7.382 0.307 1 1 1183 . 4 1 1 A 109 109 VAL HA H 109 4.532 3.814 0.718 1 1 1191 . 4 1 1 A 109 109 VAL C C 109 176.055 178.012 -1.957 1 1 1192 . 4 1 1 A 109 109 VAL CA C 109 61.452 65.739 -4.287 1 1 1193 . 4 1 1 A 109 109 VAL CB C 109 32.728 31.412 1.316 1 1 1196 . 4 1 1 A 109 109 VAL N N 109 112.851 117.255 -4.404 1 1 1197 . 4 1 1 A 110 110 LEU H H 110 7.099 8.251 -1.152 1 1 1198 . 4 1 1 A 110 110 LEU HA H 110 3.723 3.813 -0.090 1 1 1208 . 4 1 1 A 110 110 LEU C C 110 179.040 178.811 0.229 1 1 1209 . 4 1 1 A 110 110 LEU CA C 110 58.825 57.878 0.947 1 1 1210 . 4 1 1 A 110 110 LEU CB C 110 41.242 41.724 -0.482 1 1 1214 . 4 1 1 A 110 110 LEU N N 110 119.829 125.061 -5.232 1 1 1215 . 4 1 1 A 111 111 GLY H H 111 8.435 7.660 0.775 1 1 1216 . 4 1 1 A 111 111 GLY HA2 H 111 3.970 3.829 0.141 1 1 1217 . 4 1 1 A 111 111 GLY HA3 H 111 3.885 3.836 0.049 1 1 1218 . 4 1 1 A 111 111 GLY C C 111 178.031 176.403 1.628 1 1 1219 . 4 1 1 A 111 111 GLY CA C 111 46.961 47.614 -0.653 1 1 1220 . 4 1 1 A 111 111 GLY N N 111 104.089 106.535 -2.446 1 1 1221 . 4 1 1 A 112 112 SER H H 112 8.343 7.947 0.396 1 1 1222 . 4 1 1 A 112 112 SER HA H 112 4.266 4.217 0.049 1 1 1224 . 4 1 1 A 112 112 SER C C 112 175.885 175.246 0.639 1 1 1225 . 4 1 1 A 112 112 SER CA C 112 61.304 62.516 -1.212 1 1 1226 . 4 1 1 A 112 112 SER CB C 112 62.901 63.014 -0.113 1 1 1227 . 4 1 1 A 112 112 SER N N 112 119.497 119.463 0.034 1 1 1228 . 4 1 1 A 113 113 LEU H H 113 7.667 8.065 -0.398 1 1 1229 . 4 1 1 A 113 113 LEU HA H 113 4.343 4.195 0.148 1 1 1238 . 4 1 1 A 113 113 LEU C C 113 174.760 175.917 -1.157 1 1 1239 . 4 1 1 A 113 113 LEU CA C 113 54.228 54.660 -0.432 1 1 1240 . 4 1 1 A 113 113 LEU CB C 113 41.467 42.054 -0.587 1 1 1244 . 4 1 1 A 113 113 LEU N N 113 118.843 117.718 1.125 1 1 1245 . 4 1 1 A 114 114 LYS H H 114 7.685 7.864 -0.179 1 1 1246 . 4 1 1 A 114 114 LYS HA H 114 3.958 3.877 0.081 1 1 1250 . 4 1 1 A 114 114 LYS C C 114 177.557 175.793 1.764 1 1 1251 . 4 1 1 A 114 114 LYS CA C 114 56.935 57.331 -0.396 1 1 1252 . 4 1 1 A 114 114 LYS CB C 114 28.898 29.200 -0.302 1 1 1254 . 4 1 1 A 114 114 LYS N N 114 114.072 116.271 -2.199 1 1 1255 . 4 1 1 A 115 115 LEU H H 115 8.329 7.926 0.403 1 1 1256 . 4 1 1 A 115 115 LEU HA H 115 4.315 4.249 0.066 1 1 1265 . 4 1 1 A 115 115 LEU C C 115 175.988 176.632 -0.644 1 1 1266 . 4 1 1 A 115 115 LEU CA C 115 54.310 55.727 -1.417 1 1 1267 . 4 1 1 A 115 115 LEU CB C 115 44.163 42.340 1.823 1 1 1270 . 4 1 1 A 115 115 LEU N N 115 117.951 120.252 -2.301 1 1 1271 . 4 1 1 A 116 116 GLN H H 116 9.100 8.516 0.584 1 1 1272 . 4 1 1 A 116 116 GLN HA H 116 4.898 5.060 -0.162 1 1 1279 . 4 1 1 A 116 116 GLN CA C 116 53.467 54.651 -1.184 1 1 1280 . 4 1 1 A 116 116 GLN CB C 116 32.730 31.273 1.457 1 1 1282 . 4 1 1 A 116 116 GLN N N 116 119.994 121.684 -1.690 1 1 1284 . 4 1 1 A 117 117 GLU H H 117 8.849 8.604 0.245 1 1 1285 . 4 1 1 A 117 117 GLU HA H 117 3.707 4.124 -0.417 1 1 1290 . 4 1 1 A 117 117 GLU C C 117 177.303 177.166 0.137 1 1 1291 . 4 1 1 A 117 117 GLU CA C 117 57.233 56.314 0.919 1 1 1292 . 4 1 1 A 117 117 GLU CB C 117 29.634 29.415 0.219 1 1 1294 . 4 1 1 A 117 117 GLU N N 117 121.487 124.071 -2.584 1 1 1295 . 4 1 1 A 118 118 VAL H H 118 8.983 8.875 0.108 1 1 1296 . 4 1 1 A 118 118 VAL HA H 118 4.360 4.070 0.290 1 1 1304 . 4 1 1 A 118 118 VAL C C 118 174.171 175.098 -0.927 1 1 1305 . 4 1 1 A 118 118 VAL CA C 118 61.772 63.830 -2.058 1 1 1306 . 4 1 1 A 118 118 VAL CB C 118 34.095 32.776 1.319 1 1 1309 . 4 1 1 A 118 118 VAL N N 118 122.933 128.530 -5.597 1 1 1310 . 4 1 1 A 119 119 ALA H H 119 7.023 7.023 0.000 1 1 1311 . 4 1 1 A 119 119 ALA HA H 119 4.378 4.458 -0.080 1 1 1315 . 4 1 1 A 119 119 ALA C C 119 175.493 175.193 0.300 1 1 1316 . 4 1 1 A 119 119 ALA CA C 119 51.956 51.117 0.839 1 1 1317 . 4 1 1 A 119 119 ALA CB C 119 23.957 21.246 2.711 1 1 1318 . 4 1 1 A 119 119 ALA N N 119 117.379 122.177 -4.798 1 1 1319 . 4 1 1 A 120 120 SER H H 120 6.999 8.680 -1.681 1 1 1320 . 4 1 1 A 120 120 SER HA H 120 5.208 5.151 0.057 1 1 1323 . 4 1 1 A 120 120 SER C C 120 173.082 173.147 -0.065 1 1 1324 . 4 1 1 A 120 120 SER CA C 120 56.754 56.081 0.673 1 1 1325 . 4 1 1 A 120 120 SER CB C 120 64.605 65.537 -0.932 1 1 1326 . 4 1 1 A 120 120 SER N N 120 113.743 116.181 -2.438 1 1 1327 . 4 1 1 A 121 121 PHE H H 121 8.244 8.751 -0.507 1 1 1328 . 4 1 1 A 121 121 PHE HA H 121 5.177 4.983 0.194 1 1 1333 . 4 1 1 A 121 121 PHE C C 121 173.569 171.977 1.592 1 1 1334 . 4 1 1 A 121 121 PHE CA C 121 55.555 55.522 0.033 1 1 1335 . 4 1 1 A 121 121 PHE CB C 121 40.959 40.748 0.211 1 1 1338 . 4 1 1 A 121 121 PHE N N 121 120.358 117.544 2.814 1 1 1339 . 4 1 1 A 122 122 ILE H H 122 8.907 8.820 0.087 1 1 1340 . 4 1 1 A 122 122 ILE HA H 122 4.682 4.794 -0.112 1 1 1348 . 4 1 1 A 122 122 ILE C C 122 176.925 175.154 1.771 1 1 1349 . 4 1 1 A 122 122 ILE CA C 122 60.740 60.032 0.708 1 1 1350 . 4 1 1 A 122 122 ILE CB C 122 39.497 40.076 -0.579 1 1 1353 . 4 1 1 A 122 122 ILE N N 122 121.282 120.406 0.876 1 1 1354 . 4 1 1 A 123 123 THR H H 123 9.022 9.487 -0.465 1 1 1355 . 4 1 1 A 123 123 THR HA H 123 5.039 4.874 0.165 1 1 1360 . 4 1 1 A 123 123 THR C C 123 173.531 173.761 -0.230 1 1 1361 . 4 1 1 A 123 123 THR CA C 123 62.266 61.959 0.307 1 1 1362 . 4 1 1 A 123 123 THR CB C 123 70.677 69.516 1.161 1 1 1364 . 4 1 1 A 123 123 THR N N 123 128.965 123.564 5.401 1 1 1365 . 4 1 1 A 124 124 THR H H 124 8.961 8.942 0.019 1 1 1366 . 4 1 1 A 124 124 THR HA H 124 5.001 5.014 -0.013 1 1 1371 . 4 1 1 A 124 124 THR C C 124 173.468 172.884 0.584 1 1 1372 . 4 1 1 A 124 124 THR CA C 124 62.109 61.704 0.405 1 1 1373 . 4 1 1 A 124 124 THR CB C 124 70.450 69.949 0.501 1 1 1375 . 4 1 1 A 124 124 THR N N 124 122.176 123.826 -1.650 1 1 1376 . 4 1 1 A 125 125 ARG H H 125 9.386 9.086 0.300 1 1 1377 . 4 1 1 A 125 125 ARG HA H 125 5.764 5.512 0.252 1 1 1384 . 4 1 1 A 125 125 ARG C C 125 175.713 174.675 1.038 1 1 1385 . 4 1 1 A 125 125 ARG CA C 125 53.991 54.111 -0.120 1 1 1386 . 4 1 1 A 125 125 ARG CB C 125 33.557 33.875 -0.318 1 1 1389 . 4 1 1 A 125 125 ARG N N 125 130.004 128.733 1.271 1 1 1390 . 4 1 1 A 126 126 SER H H 126 9.172 9.022 0.150 1 1 1391 . 4 1 1 A 126 126 SER HA H 126 5.390 5.136 0.254 1 1 1394 . 4 1 1 A 126 126 SER C C 126 172.359 172.526 -0.167 1 1 1395 . 4 1 1 A 126 126 SER CA C 126 56.934 57.364 -0.430 1 1 1396 . 4 1 1 A 126 126 SER CB C 126 65.827 66.183 -0.356 1 1 1397 . 4 1 1 A 126 126 SER N N 126 119.906 121.288 -1.382 1 1 1398 . 4 1 1 A 127 127 SER H H 127 8.591 9.270 -0.679 1 1 1399 . 4 1 1 A 127 127 SER HA H 127 5.739 5.365 0.374 1 1 1401 . 4 1 1 A 127 127 SER C C 127 173.283 173.199 0.084 1 1 1402 . 4 1 1 A 127 127 SER CA C 127 57.354 56.857 0.497 1 1 1403 . 4 1 1 A 127 127 SER CB C 127 65.412 64.402 1.010 1 1 1404 . 4 1 1 A 127 127 SER N N 127 117.914 120.492 -2.578 1 1 1405 . 4 1 1 A 128 128 TRP H H 128 9.866 10.036 -0.170 1 1 1406 . 4 1 1 A 128 128 TRP HA H 128 5.560 5.582 -0.022 1 1 1415 . 4 1 1 A 128 128 TRP C C 128 175.828 174.837 0.991 1 1 1416 . 4 1 1 A 128 128 TRP CA C 128 55.852 56.090 -0.238 1 1 1417 . 4 1 1 A 128 128 TRP CB C 128 32.524 32.513 0.011 1 1 1423 . 4 1 1 A 128 128 TRP N N 128 127.978 125.858 2.120 1 1 1425 . 4 1 1 A 129 129 LYS H H 129 9.424 9.532 -0.108 1 1 1426 . 4 1 1 A 129 129 LYS HA H 129 5.388 4.978 0.410 1 1 1433 . 4 1 1 A 129 129 LYS C C 129 175.254 174.758 0.496 1 1 1434 . 4 1 1 A 129 129 LYS CA C 129 54.410 55.077 -0.667 1 1 1435 . 4 1 1 A 129 129 LYS CB C 129 35.734 35.050 0.684 1 1 1439 . 4 1 1 A 129 129 LYS N N 129 121.784 124.725 -2.941 1 1 1440 . 4 1 1 A 130 130 LEU H H 130 8.933 9.479 -0.546 1 1 1441 . 4 1 1 A 130 130 LEU HA H 130 4.859 5.172 -0.313 1 1 1447 . 4 1 1 A 130 130 LEU C C 130 173.893 174.585 -0.692 1 1 1448 . 4 1 1 A 130 130 LEU CA C 130 53.848 53.822 0.026 1 1 1449 . 4 1 1 A 130 130 LEU CB C 130 46.125 45.787 0.338 1 1 1451 . 4 1 1 A 130 130 LEU N N 130 124.543 128.664 -4.121 1 1 1452 . 4 1 1 A 131 131 ALA H H 131 8.816 8.870 -0.054 1 1 1453 . 4 1 1 A 131 131 ALA HA H 131 4.776 4.974 -0.198 1 1 1457 . 4 1 1 A 131 131 ALA C C 131 176.662 176.080 0.582 1 1 1458 . 4 1 1 A 131 131 ALA CA C 131 51.407 50.336 1.071 1 1 1459 . 4 1 1 A 131 131 ALA CB C 131 19.354 20.556 -1.202 1 1 1460 . 4 1 1 A 131 131 ALA N N 131 131.102 129.767 1.335 1 1 1461 . 4 1 1 A 132 132 LEU H H 132 8.487 8.782 -0.295 1 1 1462 . 4 1 1 A 132 132 LEU HA H 132 4.470 4.522 -0.052 1 1 1470 . 4 1 1 A 132 132 LEU C C 132 176.873 176.272 0.601 1 1 1471 . 4 1 1 A 132 132 LEU CA C 132 54.590 54.891 -0.301 1 1 1472 . 4 1 1 A 132 132 LEU CB C 132 42.974 41.576 1.398 1 1 1475 . 4 1 1 A 132 132 LEU N N 132 123.724 125.006 -1.282 1 1 1476 . 4 1 1 A 133 133 SER H H 133 8.448 9.111 -0.663 1 1 1477 . 4 1 1 A 133 133 SER HA H 133 4.560 4.533 0.027 1 1 1479 . 4 1 1 A 133 133 SER C C 133 176.043 174.893 1.150 1 1 1480 . 4 1 1 A 133 133 SER CA C 133 58.460 57.699 0.761 1 1 1481 . 4 1 1 A 133 133 SER CB C 133 63.985 61.230 2.755 1 1 1482 . 4 1 1 A 133 133 SER N N 133 115.880 122.003 -6.123 1 1 1483 . 4 1 1 A 134 134 GLY H H 134 8.232 8.620 -0.388 1 1 1484 . 4 1 1 A 134 134 GLY HA2 H 134 4.147 3.891 0.256 1 1 1485 . 4 1 1 A 134 134 GLY HA3 H 134 4.045 3.896 0.149 1 1 1486 . 4 1 1 A 134 134 GLY C C 134 174.013 175.195 -1.182 1 1 1487 . 4 1 1 A 134 134 GLY CA C 134 45.337 47.293 -1.956 1 1 1488 . 4 1 1 A 134 134 GLY N N 134 109.970 113.269 -3.299 1 1 1489 . 4 1 1 A 135 135 ALA H H 135 8.424 7.839 0.585 1 1 1490 . 4 1 1 A 135 135 ALA HA H 135 4.436 3.938 0.498 1 1 1494 . 4 1 1 A 135 135 ALA C C 135 177.537 176.691 0.846 1 1 1495 . 4 1 1 A 135 135 ALA CA C 135 52.721 55.047 -2.326 1 1 1496 . 4 1 1 A 135 135 ALA CB C 135 19.265 17.701 1.564 1 1 1497 . 4 1 1 A 135 135 ALA N N 135 124.118 119.647 4.471 1 1 1498 . 4 1 1 A 136 136 HIS H H 136 8.466 8.587 -0.121 1 1 1499 . 4 1 1 A 136 136 HIS HA H 136 4.379 4.248 0.131 1 1 1500 . 4 1 1 A 136 136 HIS C C 136 176.259 176.056 0.203 1 1 1501 . 4 1 1 A 136 136 HIS CA C 136 56.082 57.669 -1.587 1 1 1502 . 4 1 1 A 136 136 HIS CB C 136 29.619 29.721 -0.102 1 1 1503 . 4 1 1 A 136 136 HIS N N 136 119.493 117.017 2.476 1 1 1504 . 4 1 1 A 137 137 GLY H H 137 8.431 8.593 -0.162 1 1 1505 . 4 1 1 A 137 137 GLY HA2 H 137 4.151 3.784 0.367 1 1 1506 . 4 1 1 A 137 137 GLY HA3 H 137 3.893 3.859 0.034 1 1 1507 . 4 1 1 A 137 137 GLY C C 137 174.039 173.317 0.722 1 1 1508 . 4 1 1 A 137 137 GLY CA C 137 45.372 45.996 -0.624 1 1 1509 . 4 1 1 A 137 137 GLY N N 137 110.442 114.287 -3.845 1 1 1510 . 4 1 1 A 138 138 GLN H H 138 8.416 7.830 0.586 1 1 1511 . 4 1 1 A 138 138 GLN HA H 138 4.455 5.019 -0.564 1 1 1515 . 4 1 1 A 138 138 GLN C C 138 175.889 173.624 2.265 1 1 1516 . 4 1 1 A 138 138 GLN CA C 138 55.866 54.310 1.556 1 1 1517 . 4 1 1 A 138 138 GLN CB C 138 29.639 32.525 -2.886 1 1 1518 . 4 1 1 A 138 138 GLN N N 138 119.401 121.305 -1.904 1 1 1519 . 4 1 1 A 139 139 GLU H H 139 8.446 8.825 -0.379 1 1 1520 . 4 1 1 A 139 139 GLU HA H 139 4.658 4.877 -0.219 1 1 1524 . 4 1 1 A 139 139 GLU CA C 139 54.589 53.230 1.359 1 1 1525 . 4 1 1 A 139 139 GLU CB C 139 29.733 32.601 -2.868 1 1 1527 . 4 1 1 A 139 139 GLU N N 139 123.136 125.278 -2.142 1 1 1528 . 4 1 1 A 140 140 PRO HA H 140 4.537 4.961 -0.424 1 1 1533 . 4 1 1 A 140 140 PRO C C 140 176.119 176.061 0.058 1 1 1534 . 4 1 1 A 140 140 PRO CA C 140 63.220 62.260 0.960 1 1 1535 . 4 1 1 A 140 140 PRO CB C 140 31.936 31.929 0.007 1 1 1538 . 4 1 1 A 141 141 GLN H H 141 8.506 8.739 -0.233 1 1 1539 . 4 1 1 A 141 141 GLN HA H 141 4.650 4.894 -0.244 1 1 1546 . 4 1 1 A 141 141 GLN C C 141 175.811 175.585 0.226 1 1 1547 . 4 1 1 A 141 141 GLN CA C 141 55.912 55.498 0.414 1 1 1548 . 4 1 1 A 141 141 GLN CB C 141 30.241 29.959 0.282 1 1 1550 . 4 1 1 A 141 141 GLN N N 141 120.422 123.023 -2.601 1 1 1551 . 4 1 1 A 142 142 LEU H H 142 8.842 9.143 -0.301 1 1 1552 . 4 1 1 A 142 142 LEU HA H 142 5.277 5.197 0.080 1 1 1562 . 4 1 1 A 142 142 LEU C C 142 176.839 174.915 1.924 1 1 1563 . 4 1 1 A 142 142 LEU CA C 142 53.927 53.138 0.789 1 1 1564 . 4 1 1 A 142 142 LEU CB C 142 44.527 46.255 -1.728 1 1 1568 . 4 1 1 A 142 142 LEU N N 142 123.692 120.885 2.807 1 1 1569 . 4 1 1 A 143 143 THR H H 143 9.025 8.807 0.218 1 1 1570 . 4 1 1 A 143 143 THR HA H 143 5.262 4.956 0.306 1 1 1575 . 4 1 1 A 143 143 THR C C 143 173.753 174.091 -0.338 1 1 1576 . 4 1 1 A 143 143 THR CA C 143 61.795 61.770 0.025 1 1 1577 . 4 1 1 A 143 143 THR CB C 143 70.660 70.698 -0.038 1 1 1579 . 4 1 1 A 143 143 THR N N 143 117.222 115.582 1.640 1 1 1580 . 4 1 1 A 144 144 ILE H H 144 9.353 10.245 -0.892 1 1 1581 . 4 1 1 A 144 144 ILE HA H 144 5.399 5.409 -0.010 1 1 1591 . 4 1 1 A 144 144 ILE C C 144 173.931 173.709 0.222 1 1 1592 . 4 1 1 A 144 144 ILE CA C 144 60.774 60.317 0.457 1 1 1593 . 4 1 1 A 144 144 ILE CB C 144 41.111 39.646 1.465 1 1 1597 . 4 1 1 A 144 144 ILE N N 144 126.383 128.486 -2.103 1 1 1598 . 4 1 1 A 145 145 ASP H H 145 9.214 9.484 -0.270 1 1 1599 . 4 1 1 A 145 145 ASP HA H 145 5.978 5.408 0.570 1 1 1601 . 4 1 1 A 145 145 ASP C C 145 175.441 174.573 0.868 1 1 1602 . 4 1 1 A 145 145 ASP CA C 145 53.035 52.705 0.330 1 1 1603 . 4 1 1 A 145 145 ASP CB C 145 44.153 43.571 0.582 1 1 1604 . 4 1 1 A 145 145 ASP N N 145 127.981 128.736 -0.755 1 1 1605 . 4 1 1 A 146 146 LEU H H 146 9.387 9.786 -0.399 1 1 1606 . 4 1 1 A 146 146 LEU HA H 146 4.918 5.242 -0.324 1 1 1616 . 4 1 1 A 146 146 LEU C C 146 175.003 174.934 0.069 1 1 1617 . 4 1 1 A 146 146 LEU CA C 146 53.940 53.756 0.184 1 1 1618 . 4 1 1 A 146 146 LEU CB C 146 43.902 42.799 1.103 1 1 1622 . 4 1 1 A 146 146 LEU N N 146 123.532 127.862 -4.330 1 1 1623 . 4 1 1 A 147 147 ASP H H 147 8.676 9.109 -0.433 1 1 1624 . 4 1 1 A 147 147 ASP HA H 147 5.205 5.155 0.050 1 1 1627 . 4 1 1 A 147 147 ASP C C 147 174.956 174.092 0.864 1 1 1628 . 4 1 1 A 147 147 ASP CA C 147 53.441 52.265 1.176 1 1 1629 . 4 1 1 A 147 147 ASP CB C 147 43.370 42.777 0.593 1 1 1630 . 4 1 1 A 147 147 ASP N N 147 125.499 125.802 -0.303 1 1 1631 . 4 1 1 A 148 148 SER H H 148 8.732 9.056 -0.324 1 1 1632 . 4 1 1 A 148 148 SER HA H 148 5.365 5.172 0.193 1 1 1634 . 4 1 1 A 148 148 SER C C 148 173.217 172.446 0.771 1 1 1635 . 4 1 1 A 148 148 SER CA C 148 56.334 56.151 0.183 1 1 1636 . 4 1 1 A 148 148 SER CB C 148 65.812 66.190 -0.378 1 1 1637 . 4 1 1 A 148 148 SER N N 148 118.623 121.212 -2.589 1 1 1638 . 4 1 1 A 149 149 ALA H H 149 8.937 8.824 0.113 1 1 1639 . 4 1 1 A 149 149 ALA HA H 149 5.681 5.060 0.621 1 1 1643 . 4 1 1 A 149 149 ALA C C 149 178.894 177.369 1.525 1 1 1644 . 4 1 1 A 149 149 ALA CA C 149 49.996 50.404 -0.408 1 1 1645 . 4 1 1 A 149 149 ALA CB C 149 23.231 23.047 0.184 1 1 1646 . 4 1 1 A 149 149 ALA N N 149 123.952 126.277 -2.325 1 1 1647 . 4 1 1 A 150 150 ASP H H 150 9.010 8.510 0.500 1 1 1648 . 4 1 1 A 150 150 ASP HA H 150 4.336 4.351 -0.015 1 1 1651 . 4 1 1 A 150 150 ASP C C 150 176.697 176.998 -0.301 1 1 1652 . 4 1 1 A 150 150 ASP CA C 150 56.543 57.274 -0.731 1 1 1653 . 4 1 1 A 150 150 ASP CB C 150 39.850 40.598 -0.748 1 1 1654 . 4 1 1 A 150 150 ASP N N 150 122.687 120.991 1.696 1 1 1655 . 4 1 1 A 151 151 PHE H H 151 7.295 7.620 -0.325 1 1 1656 . 4 1 1 A 151 151 PHE HA H 151 5.020 4.766 0.254 1 1 1661 . 4 1 1 A 151 151 PHE C C 151 174.756 175.615 -0.859 1 1 1662 . 4 1 1 A 151 151 PHE CA C 151 56.594 56.692 -0.098 1 1 1663 . 4 1 1 A 151 151 PHE CB C 151 37.765 37.074 0.691 1 1 1666 . 4 1 1 A 151 151 PHE N N 151 113.928 116.034 -2.106 1 1 1667 . 4 1 1 A 152 152 GLY H H 152 7.786 8.504 -0.718 1 1 1668 . 4 1 1 A 152 152 GLY HA2 H 152 4.459 3.994 0.465 1 1 1669 . 4 1 1 A 152 152 GLY HA3 H 152 3.728 4.005 -0.277 1 1 1670 . 4 1 1 A 152 152 GLY C C 152 172.709 173.558 -0.849 1 1 1671 . 4 1 1 A 152 152 GLY CA C 152 46.106 47.321 -1.215 1 1 1672 . 4 1 1 A 152 152 GLY N N 152 110.312 108.140 2.172 1 1 1673 . 4 1 1 A 153 153 TYR H H 153 6.650 7.760 -1.110 1 1 1674 . 4 1 1 A 153 153 TYR HA H 153 4.508 4.982 -0.474 1 1 1679 . 4 1 1 A 153 153 TYR C C 153 173.092 173.207 -0.115 1 1 1680 . 4 1 1 A 153 153 TYR CA C 153 57.464 57.590 -0.126 1 1 1681 . 4 1 1 A 153 153 TYR CB C 153 41.962 42.111 -0.149 1 1 1684 . 4 1 1 A 153 153 TYR N N 153 121.977 119.405 2.572 1 1 1685 . 4 1 1 A 154 154 ALA H H 154 7.847 8.529 -0.682 1 1 1686 . 4 1 1 A 154 154 ALA HA H 154 5.144 4.775 0.369 1 1 1690 . 4 1 1 A 154 154 ALA C C 154 174.468 175.166 -0.698 1 1 1691 . 4 1 1 A 154 154 ALA CA C 154 51.776 51.241 0.535 1 1 1692 . 4 1 1 A 154 154 ALA CB C 154 21.747 21.271 0.476 1 1 1693 . 4 1 1 A 154 154 ALA N N 154 130.258 129.895 0.363 1 1 1694 . 4 1 1 A 155 155 VAL H H 155 8.733 9.101 -0.368 1 1 1695 . 4 1 1 A 155 155 VAL HA H 155 4.150 4.810 -0.660 1 1 1700 . 4 1 1 A 155 155 VAL C C 155 172.632 173.707 -1.075 1 1 1701 . 4 1 1 A 155 155 VAL CA C 155 61.451 59.099 2.352 1 1 1702 . 4 1 1 A 155 155 VAL CB C 155 35.883 35.355 0.528 1 1 1704 . 4 1 1 A 155 155 VAL N N 155 119.622 122.687 -3.065 1 1 1705 . 4 1 1 A 156 156 GLY H H 156 8.146 8.450 -0.304 1 1 1706 . 4 1 1 A 156 156 GLY HA2 H 156 5.125 2.858 2.267 1 1 1707 . 4 1 1 A 156 156 GLY HA3 H 156 2.061 4.053 -1.992 1 1 1708 . 4 1 1 A 156 156 GLY C C 156 171.746 171.543 0.203 1 1 1709 . 4 1 1 A 156 156 GLY CA C 156 43.319 43.554 -0.235 1 1 1710 . 4 1 1 A 156 156 GLY N N 156 113.332 113.403 -0.071 1 1 1711 . 4 1 1 A 157 157 GLU H H 157 8.967 8.804 0.163 1 1 1712 . 4 1 1 A 157 157 GLU HA H 157 5.217 5.062 0.155 1 1 1716 . 4 1 1 A 157 157 GLU C C 157 174.476 175.474 -0.998 1 1 1717 . 4 1 1 A 157 157 GLU CA C 157 55.390 54.932 0.458 1 1 1718 . 4 1 1 A 157 157 GLU CB C 157 34.010 32.596 1.414 1 1 1720 . 4 1 1 A 157 157 GLU N N 157 120.823 121.756 -0.933 1 1 1721 . 4 1 1 A 158 158 VAL H H 158 9.076 9.535 -0.459 1 1 1722 . 4 1 1 A 158 158 VAL HA H 158 5.206 4.692 0.514 1 1 1727 . 4 1 1 A 158 158 VAL C C 158 173.900 174.282 -0.382 1 1 1728 . 4 1 1 A 158 158 VAL CA C 158 60.813 61.930 -1.117 1 1 1729 . 4 1 1 A 158 158 VAL CB C 158 33.385 32.728 0.657 1 1 1731 . 4 1 1 A 158 158 VAL N N 158 124.349 125.419 -1.070 1 1 1732 . 4 1 1 A 159 159 GLU H H 159 9.239 9.584 -0.345 1 1 1733 . 4 1 1 A 159 159 GLU HA H 159 5.647 5.188 0.459 1 1 1738 . 4 1 1 A 159 159 GLU C C 159 174.469 175.237 -0.768 1 1 1739 . 4 1 1 A 159 159 GLU CA C 159 54.473 54.638 -0.165 1 1 1740 . 4 1 1 A 159 159 GLU CB C 159 33.852 32.822 1.030 1 1 1742 . 4 1 1 A 159 159 GLU N N 159 125.772 129.505 -3.733 1 1 1743 . 4 1 1 A 160 160 ALA H H 160 9.250 9.524 -0.274 1 1 1744 . 4 1 1 A 160 160 ALA HA H 160 4.966 5.409 -0.443 1 1 1748 . 4 1 1 A 160 160 ALA C C 160 175.114 175.819 -0.705 1 1 1749 . 4 1 1 A 160 160 ALA CA C 160 50.644 50.108 0.536 1 1 1750 . 4 1 1 A 160 160 ALA CB C 160 23.263 23.152 0.111 1 1 1751 . 4 1 1 A 160 160 ALA N N 160 125.092 129.656 -4.564 1 1 1752 . 4 1 1 A 161 161 MET H H 161 8.559 8.886 -0.327 1 1 1753 . 4 1 1 A 161 161 MET HA H 161 5.468 5.829 -0.361 1 1 1761 . 4 1 1 A 161 161 MET C C 161 176.265 174.966 1.299 1 1 1762 . 4 1 1 A 161 161 MET CA C 161 53.818 54.039 -0.221 1 1 1763 . 4 1 1 A 161 161 MET CB C 161 34.380 34.912 -0.532 1 1 1766 . 4 1 1 A 161 161 MET N N 161 118.699 119.589 -0.890 1 1 1767 . 4 1 1 A 162 162 VAL H H 162 9.046 9.228 -0.182 1 1 1768 . 4 1 1 A 162 162 VAL HA H 162 4.841 4.829 0.012 1 1 1776 . 4 1 1 A 162 162 VAL C C 162 174.794 175.951 -1.157 1 1 1777 . 4 1 1 A 162 162 VAL CA C 162 59.107 60.072 -0.965 1 1 1778 . 4 1 1 A 162 162 VAL CB C 162 34.018 34.374 -0.356 1 1 1781 . 4 1 1 A 162 162 VAL N N 162 116.435 118.968 -2.533 1 1 1782 . 4 1 1 A 163 163 HIS H H 163 8.793 8.789 0.004 1 1 1783 . 4 1 1 A 163 163 HIS HA H 163 4.717 4.965 -0.248 1 1 1787 . 4 1 1 A 163 163 HIS C C 163 175.460 174.762 0.698 1 1 1788 . 4 1 1 A 163 163 HIS CA C 163 58.488 57.602 0.886 1 1 1789 . 4 1 1 A 163 163 HIS CB C 163 31.185 30.473 0.712 1 1 1791 . 4 1 1 A 163 163 HIS N N 163 117.838 122.610 -4.772 1 1 1792 . 4 1 1 A 164 164 GLU H H 164 8.013 7.928 0.085 1 1 1793 . 4 1 1 A 164 164 GLU HA H 164 4.814 4.572 0.242 1 1 1797 . 4 1 1 A 164 164 GLU C C 164 176.910 176.360 0.550 1 1 1798 . 4 1 1 A 164 164 GLU CA C 164 54.355 54.998 -0.643 1 1 1799 . 4 1 1 A 164 164 GLU CB C 164 32.886 32.822 0.064 1 1 1801 . 4 1 1 A 164 164 GLU N N 164 115.943 115.495 0.448 1 1 1802 . 4 1 1 A 165 165 LYS H H 165 9.088 8.780 0.308 1 1 1803 . 4 1 1 A 165 165 LYS HA H 165 3.942 4.008 -0.066 1 1 1809 . 4 1 1 A 165 165 LYS C C 165 179.657 177.800 1.857 1 1 1810 . 4 1 1 A 165 165 LYS CA C 165 59.888 58.267 1.621 1 1 1811 . 4 1 1 A 165 165 LYS CB C 165 32.024 32.436 -0.412 1 1 1814 . 4 1 1 A 165 165 LYS N N 165 124.120 121.522 2.598 1 1 1815 . 4 1 1 A 166 166 ALA H H 166 8.851 8.033 0.818 1 1 1816 . 4 1 1 A 166 166 ALA HA H 166 4.251 4.055 0.196 1 1 1820 . 4 1 1 A 166 166 ALA C C 166 178.920 178.858 0.062 1 1 1821 . 4 1 1 A 166 166 ALA CA C 166 54.318 54.690 -0.372 1 1 1822 . 4 1 1 A 166 166 ALA CB C 166 18.810 18.230 0.580 1 1 1823 . 4 1 1 A 166 166 ALA N N 166 120.424 122.533 -2.109 1 1 1824 . 4 1 1 A 167 167 GLU H H 167 7.871 8.271 -0.400 1 1 1825 . 4 1 1 A 167 167 GLU HA H 167 4.404 4.210 0.194 1 1 1829 . 4 1 1 A 167 167 GLU C C 167 177.368 177.984 -0.616 1 1 1830 . 4 1 1 A 167 167 GLU CA C 167 56.701 57.048 -0.347 1 1 1831 . 4 1 1 A 167 167 GLU CB C 167 31.208 29.874 1.334 1 1 1833 . 4 1 1 A 167 167 GLU N N 167 114.926 115.348 -0.422 1 1 1834 . 4 1 1 A 168 168 VAL H H 168 7.812 7.428 0.384 1 1 1835 . 4 1 1 A 168 168 VAL HA H 168 3.712 3.662 0.050 1 1 1843 . 4 1 1 A 168 168 VAL CA C 168 68.705 67.920 0.785 1 1 1844 . 4 1 1 A 168 168 VAL CB C 168 29.597 29.811 -0.214 1 1 1847 . 4 1 1 A 168 168 VAL N N 168 120.188 121.749 -1.561 1 1 1848 . 4 1 1 A 169 169 PRO HA H 169 4.252 4.152 0.100 1 1 1851 . 4 1 1 A 169 169 PRO C C 169 179.563 178.865 0.698 1 1 1852 . 4 1 1 A 169 169 PRO CA C 169 67.077 66.996 0.081 1 1 1853 . 4 1 1 A 170 170 ALA H H 170 8.149 8.295 -0.146 1 1 1854 . 4 1 1 A 170 170 ALA HA H 170 4.265 4.078 0.187 1 1 1858 . 4 1 1 A 170 170 ALA C C 170 180.637 179.951 0.686 1 1 1859 . 4 1 1 A 170 170 ALA CA C 170 54.823 55.382 -0.559 1 1 1860 . 4 1 1 A 170 170 ALA CB C 170 18.518 18.297 0.221 1 1 1861 . 4 1 1 A 170 170 ALA N N 170 119.210 118.849 0.361 1 1 1862 . 4 1 1 A 171 171 ALA H H 171 7.767 8.396 -0.629 1 1 1863 . 4 1 1 A 171 171 ALA HA H 171 4.106 4.148 -0.042 1 1 1867 . 4 1 1 A 171 171 ALA C C 171 179.371 179.799 -0.428 1 1 1868 . 4 1 1 A 171 171 ALA CA C 171 55.130 55.015 0.115 1 1 1869 . 4 1 1 A 171 171 ALA CB C 171 18.291 17.952 0.339 1 1 1870 . 4 1 1 A 171 171 ALA N N 171 122.126 120.604 1.522 1 1 1871 . 4 1 1 A 172 172 LEU H H 172 8.950 8.571 0.379 1 1 1872 . 4 1 1 A 172 172 LEU HA H 172 3.987 4.078 -0.091 1 1 1878 . 4 1 1 A 172 172 LEU C C 172 178.355 178.745 -0.390 1 1 1879 . 4 1 1 A 172 172 LEU CA C 172 57.803 57.426 0.377 1 1 1880 . 4 1 1 A 172 172 LEU CB C 172 41.667 41.977 -0.310 1 1 1882 . 4 1 1 A 172 172 LEU N N 172 118.682 120.767 -2.085 1 1 1883 . 4 1 1 A 173 173 GLU H H 173 7.886 8.110 -0.224 1 1 1884 . 4 1 1 A 173 173 GLU HA H 173 4.132 3.958 0.174 1 1 1887 . 4 1 1 A 173 173 GLU C C 173 179.556 179.558 -0.002 1 1 1888 . 4 1 1 A 173 173 GLU CA C 173 59.800 59.663 0.137 1 1 1889 . 4 1 1 A 173 173 GLU CB C 173 29.580 29.112 0.468 1 1 1891 . 4 1 1 A 173 173 GLU N N 173 117.561 119.288 -1.727 1 1 1892 . 4 1 1 A 174 174 LYS H H 174 7.532 7.866 -0.334 1 1 1893 . 4 1 1 A 174 174 LYS HA H 174 4.131 4.029 0.102 1 1 1901 . 4 1 1 A 174 174 LYS CA C 174 58.999 59.476 -0.477 1 1 1902 . 4 1 1 A 174 174 LYS CB C 174 32.041 32.453 -0.412 1 1 1906 . 4 1 1 A 174 174 LYS N N 174 119.085 119.446 -0.361 1 1 1907 . 4 1 1 A 175 175 ILE H H 175 8.479 8.118 0.361 1 1 1908 . 4 1 1 A 175 175 ILE HA H 175 3.583 3.606 -0.023 1 1 1918 . 4 1 1 A 175 175 ILE C C 175 179.258 178.537 0.721 1 1 1919 . 4 1 1 A 175 175 ILE CA C 175 65.769 65.622 0.147 1 1 1920 . 4 1 1 A 175 175 ILE CB C 175 37.876 38.018 -0.142 1 1 1923 . 4 1 1 A 175 175 ILE N N 175 118.828 120.184 -1.356 1 1 1924 . 4 1 1 A 176 176 ILE H H 176 8.928 7.929 0.999 1 1 1925 . 4 1 1 A 176 176 ILE HA H 176 3.600 3.584 0.016 1 1 1935 . 4 1 1 A 176 176 ILE C C 176 178.827 178.124 0.703 1 1 1936 . 4 1 1 A 176 176 ILE CA C 176 65.640 64.963 0.677 1 1 1937 . 4 1 1 A 176 176 ILE CB C 176 37.451 37.333 0.118 1 1 1941 . 4 1 1 A 176 176 ILE N N 176 124.527 119.598 4.929 1 1 1942 . 4 1 1 A 177 177 THR H H 177 8.175 8.360 -0.185 1 1 1943 . 4 1 1 A 177 177 THR HA H 177 3.885 3.949 -0.064 1 1 1948 . 4 1 1 A 177 177 THR C C 177 176.867 176.418 0.449 1 1 1949 . 4 1 1 A 177 177 THR CA C 177 67.199 66.395 0.804 1 1 1950 . 4 1 1 A 177 177 THR CB C 177 68.377 68.812 -0.435 1 1 1952 . 4 1 1 A 177 177 THR N N 177 119.412 118.880 0.532 1 1 1953 . 4 1 1 A 178 178 VAL H H 178 8.352 8.045 0.307 1 1 1954 . 4 1 1 A 178 178 VAL HA H 178 3.572 3.446 0.126 1 1 1962 . 4 1 1 A 178 178 VAL C C 178 177.664 177.789 -0.125 1 1 1963 . 4 1 1 A 178 178 VAL CA C 178 66.909 66.519 0.390 1 1 1964 . 4 1 1 A 178 178 VAL CB C 178 31.714 31.329 0.385 1 1 1967 . 4 1 1 A 178 178 VAL N N 178 121.168 121.675 -0.507 1 1 1968 . 4 1 1 A 179 179 SER H H 179 8.529 8.110 0.419 1 1 1969 . 4 1 1 A 179 179 SER HA H 179 3.099 3.441 -0.342 1 1 1972 . 4 1 1 A 179 179 SER C C 179 175.380 175.974 -0.594 1 1 1973 . 4 1 1 A 179 179 SER CA C 179 62.728 61.760 0.968 1 1 1974 . 4 1 1 A 179 179 SER CB C 179 62.802 62.536 0.266 1 1 1975 . 4 1 1 A 179 179 SER N N 179 115.226 115.519 -0.293 1 1 1976 . 4 1 1 A 180 180 SER H H 180 7.757 8.034 -0.277 1 1 1977 . 4 1 1 A 180 180 SER HA H 180 4.419 4.277 0.142 1 1 1980 . 4 1 1 A 180 180 SER C C 180 175.359 176.420 -1.061 1 1 1981 . 4 1 1 A 180 180 SER CA C 180 61.025 61.463 -0.438 1 1 1982 . 4 1 1 A 180 180 SER CB C 180 63.072 63.089 -0.017 1 1 1983 . 4 1 1 A 180 180 SER N N 180 114.718 116.452 -1.734 1 1 1984 . 4 1 1 A 181 181 MET H H 181 7.497 7.941 -0.444 1 1 1985 . 4 1 1 A 181 181 MET HA H 181 4.283 4.299 -0.016 1 1 1993 . 4 1 1 A 181 181 MET C C 181 177.217 176.763 0.454 1 1 1994 . 4 1 1 A 181 181 MET CA C 181 57.539 57.586 -0.047 1 1 1995 . 4 1 1 A 181 181 MET CB C 181 33.493 32.729 0.764 1 1 1998 . 4 1 1 A 181 181 MET N N 181 119.274 118.586 0.688 1 1 1999 . 4 1 1 A 182 182 LEU H H 182 7.163 7.480 -0.317 1 1 2000 . 4 1 1 A 182 182 LEU HA H 182 4.133 4.401 -0.268 1 1 2010 . 4 1 1 A 182 182 LEU C C 182 176.289 176.664 -0.375 1 1 2011 . 4 1 1 A 182 182 LEU CA C 182 54.750 54.773 -0.023 1 1 2012 . 4 1 1 A 182 182 LEU CB C 182 43.235 42.734 0.501 1 1 2016 . 4 1 1 A 182 182 LEU N N 182 115.869 117.893 -2.024 1 1 2017 . 4 1 1 A 183 183 GLY H H 183 7.492 7.256 0.236 1 1 2018 . 4 1 1 A 183 183 GLY HA2 H 183 4.086 4.169 -0.083 1 1 2019 . 4 1 1 A 183 183 GLY HA3 H 183 4.425 4.231 0.194 1 1 2020 . 4 1 1 A 183 183 GLY C C 183 171.830 172.081 -0.251 1 1 2021 . 4 1 1 A 183 183 GLY CA C 183 46.035 45.924 0.111 1 1 2022 . 4 1 1 A 183 183 GLY N N 183 107.761 105.990 1.771 1 1 2023 . 4 1 1 A 184 184 VAL H H 184 8.099 8.476 -0.377 1 1 2024 . 4 1 1 A 184 184 VAL HA H 184 4.772 4.753 0.019 1 1 2032 . 4 1 1 A 184 184 VAL CA C 184 59.305 59.091 0.214 1 1 2033 . 4 1 1 A 184 184 VAL CB C 184 33.648 34.890 -1.242 1 1 2036 . 4 1 1 A 184 184 VAL N N 184 119.803 121.812 -2.009 1 1 2037 . 4 1 1 A 185 185 PRO HA H 185 4.442 4.813 -0.371 1 1 2042 . 4 1 1 A 185 185 PRO C C 185 175.871 176.651 -0.780 1 1 2043 . 4 1 1 A 185 185 PRO CA C 185 63.886 62.580 1.306 1 1 2044 . 4 1 1 A 185 185 PRO CB C 185 32.260 32.182 0.078 1 1 2047 . 4 1 1 A 186 186 ALA H H 186 8.222 8.841 -0.619 1 1 2048 . 4 1 1 A 186 186 ALA HA H 186 4.569 4.547 0.022 1 1 2052 . 4 1 1 A 186 186 ALA C C 186 177.481 176.583 0.898 1 1 2053 . 4 1 1 A 186 186 ALA CA C 186 51.823 50.398 1.425 1 1 2054 . 4 1 1 A 186 186 ALA CB C 186 20.233 20.462 -0.229 1 1 2055 . 4 1 1 A 186 186 ALA N N 186 125.663 122.818 2.845 1 1 2056 . 4 1 1 A 187 187 GLN H H 187 8.723 8.653 0.070 1 1 2057 . 4 1 1 A 187 187 GLN HA H 187 4.420 4.876 -0.456 1 1 2063 . 4 1 1 A 187 187 GLN C C 187 175.566 174.022 1.544 1 1 2064 . 4 1 1 A 187 187 GLN CA C 187 56.051 53.628 2.423 1 1 2065 . 4 1 1 A 187 187 GLN CB C 187 29.812 30.375 -0.563 1 1 2067 . 4 1 1 A 187 187 GLN N N 187 120.742 114.555 6.187 1 1 2069 . 4 1 1 A 188 188 GLU H H 188 8.163 8.490 -0.327 1 1 2070 . 4 1 1 A 188 188 GLU HA H 188 4.405 4.361 0.044 1 1 2074 . 4 1 1 A 188 188 GLU C C 188 176.058 175.290 0.768 1 1 2075 . 4 1 1 A 188 188 GLU CA C 188 56.158 55.940 0.218 1 1 2076 . 4 1 1 A 188 188 GLU CB C 188 31.095 28.171 2.924 1 1 2078 . 4 1 1 A 188 188 GLU N N 188 119.177 120.691 -1.514 1 1 2079 . 4 1 1 A 189 189 GLU H H 189 8.567 8.218 0.349 1 1 2080 . 4 1 1 A 189 189 GLU HA H 189 4.252 4.767 -0.515 1 1 2084 . 4 1 1 A 189 189 GLU C C 189 175.703 174.576 1.127 1 1 2085 . 4 1 1 A 189 189 GLU CA C 189 56.417 56.284 0.133 1 1 2086 . 4 1 1 A 189 189 GLU CB C 189 29.968 31.532 -1.564 1 1 2088 . 4 1 1 A 189 189 GLU N N 189 120.920 125.192 -4.272 1 1 2089 . 4 1 1 A 190 190 ALA H H 190 8.271 8.606 -0.335 1 1 2090 . 4 1 1 A 190 190 ALA HA H 190 4.626 4.867 -0.241 1 1 2094 . 4 1 1 A 190 190 ALA CA C 190 50.465 49.231 1.234 1 1 2095 . 4 1 1 A 190 190 ALA CB C 190 18.451 21.085 -2.634 1 1 2096 . 4 1 1 A 190 190 ALA N N 190 128.323 128.560 -0.237 1 1 2097 . 4 1 1 A 191 191 PRO HA H 191 4.493 4.567 -0.074 1 1 2103 . 4 1 1 A 191 191 PRO C C 191 175.899 176.375 -0.476 1 1 2104 . 4 1 1 A 191 191 PRO CA C 191 62.044 62.392 -0.348 1 1 2105 . 4 1 1 A 191 191 PRO CB C 191 32.184 32.565 -0.381 1 1 2108 . 4 1 1 A 192 192 ALA H H 192 8.610 8.215 0.395 1 1 2109 . 4 1 1 A 192 192 ALA HA H 192 4.280 4.556 -0.276 1 1 2113 . 4 1 1 A 192 192 ALA C C 192 178.282 178.215 0.067 1 1 2114 . 4 1 1 A 192 192 ALA CA C 192 51.698 50.978 0.720 1 1 2115 . 4 1 1 A 192 192 ALA CB C 192 19.220 20.837 -1.617 1 1 2116 . 4 1 1 A 192 192 ALA N N 192 123.420 123.030 0.390 1 1 2117 . 4 1 1 A 193 193 LYS H H 193 8.531 8.754 -0.223 1 1 2118 . 4 1 1 A 193 193 LYS HA H 193 3.294 3.739 -0.445 1 1 2126 . 4 1 1 A 193 193 LYS C C 193 177.640 178.754 -1.114 1 1 2127 . 4 1 1 A 193 193 LYS CA C 193 60.644 59.276 1.368 1 1 2128 . 4 1 1 A 193 193 LYS CB C 193 32.607 31.735 0.872 1 1 2132 . 4 1 1 A 193 193 LYS N N 193 122.851 118.662 4.189 1 1 2133 . 4 1 1 A 194 194 LEU H H 194 8.570 7.935 0.635 1 1 2134 . 4 1 1 A 194 194 LEU HA H 194 3.845 4.488 -0.643 1 1 2144 . 4 1 1 A 194 194 LEU C C 194 177.965 179.038 -1.073 1 1 2145 . 4 1 1 A 194 194 LEU CA C 194 57.611 57.605 0.006 1 1 2146 . 4 1 1 A 194 194 LEU CB C 194 41.776 40.827 0.949 1 1 2150 . 4 1 1 A 194 194 LEU N N 194 115.801 121.345 -5.544 1 1 2151 . 4 1 1 A 195 195 MET H H 195 6.782 8.046 -1.264 1 1 2152 . 4 1 1 A 195 195 MET HA H 195 4.487 4.187 0.300 1 1 2160 . 4 1 1 A 195 195 MET C C 195 178.280 178.785 -0.505 1 1 2161 . 4 1 1 A 195 195 MET CA C 195 56.858 58.338 -1.480 1 1 2162 . 4 1 1 A 195 195 MET CB C 195 31.557 31.414 0.143 1 1 2165 . 4 1 1 A 195 195 MET N N 195 113.898 117.328 -3.430 1 1 2166 . 4 1 1 A 196 196 VAL H H 196 7.713 7.605 0.108 1 1 2167 . 4 1 1 A 196 196 VAL HA H 196 3.501 3.319 0.182 1 1 2175 . 4 1 1 A 196 196 VAL C C 196 177.624 177.805 -0.181 1 1 2176 . 4 1 1 A 196 196 VAL CA C 196 66.318 66.144 0.174 1 1 2177 . 4 1 1 A 196 196 VAL CB C 196 31.380 31.266 0.114 1 1 2180 . 4 1 1 A 196 196 VAL N N 196 120.413 119.707 0.706 1 1 2181 . 4 1 1 A 197 197 TYR H H 197 7.972 8.214 -0.242 1 1 2182 . 4 1 1 A 197 197 TYR HA H 197 3.145 4.348 -1.203 1 1 2187 . 4 1 1 A 197 197 TYR C C 197 177.726 177.269 0.457 1 1 2188 . 4 1 1 A 197 197 TYR CA C 197 62.253 61.765 0.488 1 1 2189 . 4 1 1 A 197 197 TYR CB C 197 37.314 38.944 -1.630 1 1 2192 . 4 1 1 A 197 197 TYR N N 197 119.543 121.019 -1.476 1 1 2193 . 4 1 1 A 198 198 LEU H H 198 8.630 8.163 0.467 1 1 2194 . 4 1 1 A 198 198 LEU HA H 198 3.923 3.687 0.236 1 1 2203 . 4 1 1 A 198 198 LEU C C 198 178.074 178.977 -0.903 1 1 2204 . 4 1 1 A 198 198 LEU CA C 198 58.294 58.111 0.183 1 1 2205 . 4 1 1 A 198 198 LEU CB C 198 42.177 41.760 0.417 1 1 2209 . 4 1 1 A 198 198 LEU N N 198 118.430 120.093 -1.663 1 1 2210 . 4 1 1 A 199 199 GLN H H 199 8.082 8.403 -0.321 1 1 2211 . 4 1 1 A 199 199 GLN HA H 199 3.054 3.470 -0.416 1 1 2216 . 4 1 1 A 199 199 GLN C C 199 176.875 177.356 -0.481 1 1 2217 . 4 1 1 A 199 199 GLN CA C 199 59.739 57.976 1.763 1 1 2218 . 4 1 1 A 199 199 GLN CB C 199 28.055 27.480 0.575 1 1 2220 . 4 1 1 A 199 199 GLN N N 199 117.926 117.146 0.780 1 1 2222 . 4 1 1 A 200 200 ARG H H 200 7.349 7.464 -0.115 1 1 2223 . 4 1 1 A 200 200 ARG HA H 200 3.798 3.792 0.006 1 1 2231 . 4 1 1 A 200 200 ARG C C 200 178.037 177.717 0.320 1 1 2232 . 4 1 1 A 200 200 ARG CA C 200 58.260 58.896 -0.636 1 1 2233 . 4 1 1 A 200 200 ARG CB C 200 30.706 30.375 0.331 1 1 2236 . 4 1 1 A 200 200 ARG N N 200 113.772 118.896 -5.124 1 1 2238 . 4 1 1 A 201 201 PHE H H 201 8.329 7.482 0.847 1 1 2239 . 4 1 1 A 201 201 PHE HA H 201 4.630 4.462 0.168 1 1 2244 . 4 1 1 A 201 201 PHE C C 201 176.606 175.991 0.615 1 1 2245 . 4 1 1 A 201 201 PHE CA C 201 59.014 58.649 0.365 1 1 2246 . 4 1 1 A 201 201 PHE CB C 201 40.357 40.808 -0.451 1 1 2249 . 4 1 1 A 201 201 PHE N N 201 114.182 114.151 0.031 1 1 2250 . 4 1 1 A 202 202 ARG H H 202 8.719 8.432 0.287 1 1 2251 . 4 1 1 A 202 202 ARG HA H 202 5.071 4.697 0.374 1 1 2261 . 4 1 1 A 202 202 ARG CA C 202 53.956 53.349 0.607 1 1 2262 . 4 1 1 A 202 202 ARG CB C 202 31.979 30.263 1.716 1 1 2264 . 4 1 1 A 202 202 ARG N N 202 120.115 114.453 5.662 1 1 2266 . 4 1 1 A 203 203 PRO HA H 203 4.348 4.655 -0.307 1 1 2271 . 4 1 1 A 203 203 PRO C C 203 179.736 178.071 1.665 1 1 2272 . 4 1 1 A 203 203 PRO CA C 203 65.674 65.073 0.601 1 1 2273 . 4 1 1 A 203 203 PRO CB C 203 31.717 32.316 -0.599 1 1 2275 . 4 1 1 A 204 204 LEU H H 204 8.875 7.633 1.242 1 1 2276 . 4 1 1 A 204 204 LEU HA H 204 4.291 4.027 0.264 1 1 2286 . 4 1 1 A 204 204 LEU C C 204 180.353 177.821 2.532 1 1 2287 . 4 1 1 A 204 204 LEU CA C 204 58.012 57.085 0.927 1 1 2288 . 4 1 1 A 204 204 LEU CB C 204 40.893 42.323 -1.430 1 1 2292 . 4 1 1 A 204 204 LEU N N 204 118.940 117.514 1.426 1 1 2293 . 4 1 1 A 205 205 ASP H H 205 7.541 8.384 -0.843 1 1 2294 . 4 1 1 A 205 205 ASP HA H 205 4.622 4.385 0.237 1 1 2297 . 4 1 1 A 205 205 ASP C C 205 177.602 178.078 -0.476 1 1 2298 . 4 1 1 A 205 205 ASP CA C 205 57.437 57.358 0.079 1 1 2299 . 4 1 1 A 205 205 ASP CB C 205 41.143 41.658 -0.515 1 1 2300 . 4 1 1 A 205 205 ASP N N 205 120.838 119.803 1.035 1 1 2301 . 4 1 1 A 206 206 TYR H H 206 8.237 7.990 0.247 1 1 2302 . 4 1 1 A 206 206 TYR HA H 206 4.018 4.274 -0.256 1 1 2307 . 4 1 1 A 206 206 TYR C C 206 176.433 178.468 -2.035 1 1 2308 . 4 1 1 A 206 206 TYR CA C 206 62.148 60.592 1.556 1 1 2309 . 4 1 1 A 206 206 TYR CB C 206 38.305 37.392 0.913 1 1 2312 . 4 1 1 A 206 206 TYR N N 206 119.475 118.568 0.907 1 1 2313 . 4 1 1 A 207 207 GLN H H 207 8.124 7.570 0.554 1 1 2314 . 4 1 1 A 207 207 GLN HA H 207 3.823 3.398 0.425 1 1 2320 . 4 1 1 A 207 207 GLN C C 207 178.019 178.663 -0.644 1 1 2321 . 4 1 1 A 207 207 GLN CA C 207 58.841 58.940 -0.099 1 1 2322 . 4 1 1 A 207 207 GLN CB C 207 28.208 28.083 0.125 1 1 2324 . 4 1 1 A 207 207 GLN N N 207 115.863 121.249 -5.386 1 1 2326 . 4 1 1 A 208 208 ARG H H 208 7.522 7.623 -0.101 1 1 2327 . 4 1 1 A 208 208 ARG HA H 208 4.127 4.053 0.074 1 1 2334 . 4 1 1 A 208 208 ARG C C 208 179.278 178.550 0.728 1 1 2335 . 4 1 1 A 208 208 ARG CA C 208 59.419 58.965 0.454 1 1 2336 . 4 1 1 A 208 208 ARG CB C 208 30.182 29.874 0.308 1 1 2338 . 4 1 1 A 208 208 ARG N N 208 118.471 119.971 -1.500 1 1 2340 . 4 1 1 A 209 209 LEU H H 209 7.869 7.614 0.255 1 1 2341 . 4 1 1 A 209 209 LEU HA H 209 4.091 4.053 0.038 1 1 2351 . 4 1 1 A 209 209 LEU C C 209 179.715 178.876 0.839 1 1 2352 . 4 1 1 A 209 209 LEU CA C 209 57.891 57.971 -0.080 1 1 2353 . 4 1 1 A 209 209 LEU CB C 209 41.338 41.458 -0.120 1 1 2356 . 4 1 1 A 209 209 LEU N N 209 119.659 120.171 -0.512 1 1 2357 . 4 1 1 A 210 210 LEU H H 210 8.034 8.626 -0.592 1 1 2358 . 4 1 1 A 210 210 LEU HA H 210 3.977 3.960 0.017 1 1 2367 . 4 1 1 A 210 210 LEU C C 210 180.363 178.449 1.914 1 1 2368 . 4 1 1 A 210 210 LEU CA C 210 57.459 58.465 -1.006 1 1 2369 . 4 1 1 A 210 210 LEU CB C 210 41.699 41.436 0.263 1 1 2373 . 4 1 1 A 210 210 LEU N N 210 120.967 120.039 0.928 1 1 2374 . 4 1 1 A 211 211 GLU H H 211 8.174 8.660 -0.486 1 1 2375 . 4 1 1 A 211 211 GLU HA H 211 4.075 4.328 -0.253 1 1 2379 . 4 1 1 A 211 211 GLU C C 211 178.499 178.754 -0.255 1 1 2380 . 4 1 1 A 211 211 GLU CA C 211 58.575 59.360 -0.785 1 1 2381 . 4 1 1 A 211 211 GLU CB C 211 29.583 28.998 0.585 1 1 2383 . 4 1 1 A 211 211 GLU N N 211 119.217 117.606 1.611 1 1 2384 . 4 1 1 A 212 212 ALA H H 212 7.723 7.820 -0.097 1 1 2385 . 4 1 1 A 212 212 ALA HA H 212 4.291 4.194 0.097 1 1 2389 . 4 1 1 A 212 212 ALA C C 212 178.770 178.188 0.582 1 1 2390 . 4 1 1 A 212 212 ALA CA C 212 53.966 54.301 -0.335 1 1 2391 . 4 1 1 A 212 212 ALA CB C 212 19.117 18.303 0.814 1 1 2392 . 4 1 1 A 212 212 ALA N N 212 121.798 122.333 -0.535 1 1 2393 . 4 1 1 A 213 213 ALA H H 213 7.743 7.751 -0.008 1 1 2394 . 4 1 1 A 213 213 ALA HA H 213 4.406 4.417 -0.011 1 1 2398 . 4 1 1 A 213 213 ALA C C 213 178.413 177.137 1.276 1 1 2399 . 4 1 1 A 213 213 ALA CA C 213 53.129 51.470 1.659 1 1 2400 . 4 1 1 A 213 213 ALA CB C 213 18.926 19.208 -0.282 1 1 2401 . 4 1 1 A 213 213 ALA N N 213 120.435 119.191 1.244 1 1 2402 . 4 1 1 A 214 214 SER H H 214 7.944 7.571 0.373 1 1 2403 . 4 1 1 A 214 214 SER HA H 214 4.559 4.501 0.058 1 1 2406 . 4 1 1 A 214 214 SER C C 214 174.958 173.156 1.802 1 1 2407 . 4 1 1 A 214 214 SER CA C 214 58.640 58.651 -0.011 1 1 2408 . 4 1 1 A 214 214 SER CB C 214 63.928 61.790 2.138 1 1 2409 . 4 1 1 A 214 214 SER N N 214 113.729 117.313 -3.584 1 1 2410 . 4 1 1 A 215 215 SER H H 215 8.255 8.911 -0.656 1 1 2411 . 4 1 1 A 215 215 SER HA H 215 4.547 4.537 0.010 1 1 2413 . 4 1 1 A 215 215 SER C C 215 175.289 175.253 0.036 1 1 2414 . 4 1 1 A 215 215 SER CA C 215 58.833 57.302 1.531 1 1 2415 . 4 1 1 A 215 215 SER CB C 215 63.847 62.532 1.315 1 1 2416 . 4 1 1 A 215 215 SER N N 215 117.674 122.380 -4.706 1 1 2417 . 4 1 1 A 216 216 GLY H H 216 8.431 8.340 0.091 1 1 2418 . 4 1 1 A 216 216 GLY HA2 H 216 4.054 4.079 -0.025 1 1 2419 . 4 1 1 A 216 216 GLY C C 216 174.189 175.000 -0.811 1 1 2420 . 4 1 1 A 216 216 GLY CA C 216 45.412 45.322 0.090 1 1 2421 . 4 1 1 A 216 216 GLY N N 216 110.800 115.037 -4.237 1 1 2422 . 4 1 1 A 217 217 GLU H H 217 8.267 7.947 0.320 1 1 2423 . 4 1 1 A 217 217 GLU HA H 217 4.345 4.148 0.197 1 1 2427 . 4 1 1 A 217 217 GLU C C 217 176.428 176.672 -0.244 1 1 2428 . 4 1 1 A 217 217 GLU CA C 217 56.470 58.479 -2.009 1 1 2429 . 4 1 1 A 217 217 GLU CB C 217 30.526 30.068 0.458 1 1 2430 . 4 1 1 A 217 217 GLU N N 217 120.726 120.072 0.654 1 1 2431 . 4 1 1 A 218 218 ALA H H 218 8.476 7.654 0.822 1 1 2432 . 4 1 1 A 218 218 ALA HA H 218 4.467 4.618 -0.151 1 1 2436 . 4 1 1 A 218 218 ALA C C 218 178.015 176.203 1.812 1 1 2437 . 4 1 1 A 218 218 ALA CA C 218 52.547 50.564 1.983 1 1 2438 . 4 1 1 A 218 218 ALA CB C 218 19.242 19.456 -0.214 1 1 2439 . 4 1 1 A 218 218 ALA N N 218 125.534 119.872 5.662 1 1 2440 . 4 1 1 A 219 219 THR H H 219 8.232 8.899 -0.667 1 1 2441 . 4 1 1 A 219 219 THR HA H 219 4.411 4.918 -0.507 1 1 2446 . 4 1 1 A 219 219 THR C C 219 175.327 173.205 2.122 1 1 2447 . 4 1 1 A 219 219 THR CA C 219 61.889 59.275 2.614 1 1 2448 . 4 1 1 A 219 219 THR CB C 219 69.939 71.082 -1.143 1 1 2449 . 4 1 1 A 219 219 THR N N 219 113.242 116.948 -3.706 1 1 2450 . 4 1 1 A 220 220 GLY H H 220 8.418 8.473 -0.055 1 1 2451 . 4 1 1 A 220 220 GLY C C 220 174.037 171.351 2.686 1 1 2452 . 4 1 1 A 220 220 GLY CA C 220 45.408 45.977 -0.569 1 1 2453 . 4 1 1 A 220 220 GLY N N 220 111.031 109.956 1.075 1 1 2454 . 4 1 1 A 221 221 ASP H H 221 8.345 8.621 -0.276 1 1 2455 . 4 1 1 A 221 221 ASP HA H 221 4.700 5.442 -0.742 1 1 2458 . 4 1 1 A 221 221 ASP C C 221 176.535 174.871 1.664 1 1 2459 . 4 1 1 A 221 221 ASP CA C 221 54.402 53.028 1.374 1 1 2460 . 4 1 1 A 221 221 ASP CB C 221 41.431 44.653 -3.222 1 1 2461 . 4 1 1 A 221 221 ASP N N 221 120.795 121.534 -0.739 1 1 2462 . 4 1 1 A 222 222 SER H H 222 8.353 8.620 -0.267 1 1 2463 . 4 1 1 A 222 222 SER HA H 222 4.493 4.442 0.051 1 1 2465 . 4 1 1 A 222 222 SER C C 222 174.224 174.465 -0.241 1 1 2466 . 4 1 1 A 222 222 SER CA C 222 58.427 58.504 -0.077 1 1 2467 . 4 1 1 A 222 222 SER CB C 222 63.860 62.918 0.942 1 1 2468 . 4 1 1 A 222 222 SER N N 222 116.220 119.000 -2.780 1 1 2469 . 4 1 1 A 223 223 ALA H H 223 8.381 8.062 0.319 1 1 2470 . 4 1 1 A 223 223 ALA HA H 223 4.461 4.329 0.132 1 1 2474 . 4 1 1 A 223 223 ALA C C 223 176.926 177.653 -0.727 1 1 2475 . 4 1 1 A 223 223 ALA CA C 223 52.583 53.003 -0.420 1 1 2476 . 4 1 1 A 223 223 ALA CB C 223 19.438 19.110 0.328 1 1 2477 . 4 1 1 A 223 223 ALA N N 223 126.592 129.861 -3.269 1 1 1 . 5 1 1 A 2 2 ALA HA H 2 4.274 4.952 -0.678 1 1 5 . 5 1 1 A 2 2 ALA C C 2 177.828 176.316 1.512 1 1 6 . 5 1 1 A 2 2 ALA CA C 2 52.984 51.231 1.753 1 1 7 . 5 1 1 A 2 2 ALA CB C 2 19.138 23.156 -4.018 1 1 8 . 5 1 1 A 3 3 GLN H H 3 8.463 8.574 -0.111 1 1 9 . 5 1 1 A 3 3 GLN HA H 3 4.676 4.550 0.126 1 1 12 . 5 1 1 A 3 3 GLN C C 3 176.002 176.025 -0.023 1 1 13 . 5 1 1 A 3 3 GLN CA C 3 56.258 55.291 0.967 1 1 14 . 5 1 1 A 3 3 GLN CB C 3 30.346 27.271 3.075 1 1 15 . 5 1 1 A 3 3 GLN N N 3 117.490 120.738 -3.248 1 1 16 . 5 1 1 A 4 4 GLY H H 4 8.099 8.225 -0.126 1 1 17 . 5 1 1 A 4 4 GLY HA2 H 4 3.910 4.031 -0.121 1 1 18 . 5 1 1 A 4 4 GLY C C 4 173.332 174.026 -0.694 1 1 19 . 5 1 1 A 4 4 GLY CA C 4 45.333 46.203 -0.870 1 1 20 . 5 1 1 A 4 4 GLY N N 4 109.423 111.471 -2.048 1 1 21 . 5 1 1 A 5 5 LEU H H 5 7.863 7.980 -0.117 1 1 22 . 5 1 1 A 5 5 LEU HA H 5 4.561 5.026 -0.465 1 1 32 . 5 1 1 A 5 5 LEU C C 5 176.448 175.896 0.552 1 1 33 . 5 1 1 A 5 5 LEU CA C 5 54.713 54.133 0.580 1 1 34 . 5 1 1 A 5 5 LEU CB C 5 43.551 41.742 1.809 1 1 38 . 5 1 1 A 5 5 LEU N N 5 120.391 118.854 1.537 1 1 39 . 5 1 1 A 6 6 ILE H H 6 8.764 9.177 -0.413 1 1 40 . 5 1 1 A 6 6 ILE HA H 6 4.087 4.201 -0.114 1 1 49 . 5 1 1 A 6 6 ILE C C 6 174.679 175.432 -0.753 1 1 50 . 5 1 1 A 6 6 ILE CA C 6 61.279 61.718 -0.439 1 1 51 . 5 1 1 A 6 6 ILE CB C 6 39.651 37.780 1.871 1 1 54 . 5 1 1 A 6 6 ILE N N 6 123.050 126.101 -3.051 1 1 55 . 5 1 1 A 7 7 GLU H H 7 8.587 8.687 -0.100 1 1 56 . 5 1 1 A 7 7 GLU HA H 7 4.917 4.768 0.149 1 1 61 . 5 1 1 A 7 7 GLU C C 7 175.978 176.283 -0.305 1 1 62 . 5 1 1 A 7 7 GLU CA C 7 56.127 56.076 0.051 1 1 63 . 5 1 1 A 7 7 GLU CB C 7 31.115 30.299 0.816 1 1 65 . 5 1 1 A 7 7 GLU N N 7 127.415 127.770 -0.355 1 1 66 . 5 1 1 A 8 8 VAL H H 8 8.986 9.254 -0.268 1 1 67 . 5 1 1 A 8 8 VAL HA H 8 4.375 4.890 -0.515 1 1 72 . 5 1 1 A 8 8 VAL C C 8 173.704 175.233 -1.529 1 1 73 . 5 1 1 A 8 8 VAL CA C 8 61.347 60.663 0.684 1 1 74 . 5 1 1 A 8 8 VAL CB C 8 33.611 33.403 0.208 1 1 76 . 5 1 1 A 8 8 VAL N N 8 126.071 119.900 6.171 1 1 77 . 5 1 1 A 9 9 GLU H H 9 8.521 9.223 -0.702 1 1 78 . 5 1 1 A 9 9 GLU HA H 9 5.837 5.609 0.228 1 1 81 . 5 1 1 A 9 9 GLU C C 9 175.939 175.027 0.912 1 1 82 . 5 1 1 A 9 9 GLU CA C 9 54.516 54.477 0.039 1 1 83 . 5 1 1 A 9 9 GLU CB C 9 33.009 33.415 -0.406 1 1 84 . 5 1 1 A 9 9 GLU N N 9 122.857 124.407 -1.550 1 1 85 . 5 1 1 A 10 10 ARG H H 10 8.690 8.659 0.031 1 1 86 . 5 1 1 A 10 10 ARG HA H 10 4.709 5.062 -0.353 1 1 94 . 5 1 1 A 10 10 ARG C C 10 174.826 174.455 0.371 1 1 95 . 5 1 1 A 10 10 ARG CA C 10 54.491 54.375 0.116 1 1 96 . 5 1 1 A 10 10 ARG CB C 10 35.777 34.946 0.831 1 1 98 . 5 1 1 A 10 10 ARG N N 10 120.430 121.635 -1.205 1 1 100 . 5 1 1 A 11 11 LYS H H 11 8.874 8.745 0.129 1 1 101 . 5 1 1 A 11 11 LYS HA H 11 5.530 5.409 0.121 1 1 107 . 5 1 1 A 11 11 LYS C C 11 176.919 174.621 2.298 1 1 108 . 5 1 1 A 11 11 LYS CA C 11 55.084 54.864 0.220 1 1 109 . 5 1 1 A 11 11 LYS CB C 11 35.435 36.800 -1.365 1 1 113 . 5 1 1 A 11 11 LYS N N 11 121.087 122.979 -1.892 1 1 114 . 5 1 1 A 12 12 PHE H H 12 8.877 8.611 0.266 1 1 115 . 5 1 1 A 12 12 PHE HA H 12 5.130 5.181 -0.051 1 1 120 . 5 1 1 A 12 12 PHE C C 12 171.676 172.032 -0.356 1 1 121 . 5 1 1 A 12 12 PHE CA C 12 55.869 56.114 -0.245 1 1 122 . 5 1 1 A 12 12 PHE CB C 12 42.108 41.276 0.832 1 1 125 . 5 1 1 A 12 12 PHE N N 12 117.486 119.884 -2.398 1 1 126 . 5 1 1 A 13 13 ALA H H 13 9.134 9.447 -0.313 1 1 127 . 5 1 1 A 13 13 ALA HA H 13 5.003 4.668 0.335 1 1 131 . 5 1 1 A 13 13 ALA CA C 13 48.340 48.829 -0.489 1 1 132 . 5 1 1 A 13 13 ALA CB C 13 19.191 20.341 -1.150 1 1 133 . 5 1 1 A 13 13 ALA N N 13 125.915 122.639 3.276 1 1 134 . 5 1 1 A 14 14 PRO HA H 14 4.620 4.723 -0.103 1 1 140 . 5 1 1 A 14 14 PRO C C 14 176.502 177.366 -0.864 1 1 141 . 5 1 1 A 14 14 PRO CA C 14 62.672 62.955 -0.283 1 1 142 . 5 1 1 A 14 14 PRO CB C 14 33.119 31.997 1.122 1 1 145 . 5 1 1 A 15 15 GLY H H 15 8.721 8.863 -0.142 1 1 146 . 5 1 1 A 15 15 GLY HA2 H 15 3.999 4.062 -0.063 1 1 147 . 5 1 1 A 15 15 GLY HA3 H 15 4.632 4.066 0.566 1 1 148 . 5 1 1 A 15 15 GLY CA C 15 44.411 43.990 0.421 1 1 149 . 5 1 1 A 15 15 GLY N N 15 109.863 108.474 1.389 1 1 150 . 5 1 1 A 16 16 PRO HA H 16 4.447 4.437 0.010 1 1 155 . 5 1 1 A 16 16 PRO C C 16 177.053 176.862 0.191 1 1 156 . 5 1 1 A 16 16 PRO CA C 16 64.395 64.261 0.134 1 1 157 . 5 1 1 A 16 16 PRO CB C 16 31.993 31.535 0.458 1 1 159 . 5 1 1 A 17 17 ASP H H 17 8.550 8.424 0.126 1 1 160 . 5 1 1 A 17 17 ASP HA H 17 4.950 4.969 -0.019 1 1 163 . 5 1 1 A 17 17 ASP C C 17 176.800 177.171 -0.371 1 1 164 . 5 1 1 A 17 17 ASP CA C 17 53.271 53.002 0.269 1 1 165 . 5 1 1 A 17 17 ASP CB C 17 40.392 41.290 -0.898 1 1 166 . 5 1 1 A 17 17 ASP N N 17 116.060 116.192 -0.132 1 1 167 . 5 1 1 A 18 18 THR H H 18 7.664 7.219 0.445 1 1 168 . 5 1 1 A 18 18 THR HA H 18 4.120 3.739 0.381 1 1 174 . 5 1 1 A 18 18 THR C C 18 175.407 176.369 -0.962 1 1 175 . 5 1 1 A 18 18 THR CA C 18 68.718 67.065 1.653 1 1 176 . 5 1 1 A 18 18 THR CB C 18 69.179 68.406 0.773 1 1 178 . 5 1 1 A 18 18 THR N N 18 117.158 116.141 1.017 1 1 179 . 5 1 1 A 19 19 GLU H H 19 8.817 8.520 0.297 1 1 180 . 5 1 1 A 19 19 GLU HA H 19 3.510 3.351 0.159 1 1 184 . 5 1 1 A 19 19 GLU C C 19 178.345 179.228 -0.883 1 1 185 . 5 1 1 A 19 19 GLU CA C 19 61.237 59.734 1.503 1 1 186 . 5 1 1 A 19 19 GLU CB C 19 28.746 29.319 -0.573 1 1 188 . 5 1 1 A 19 19 GLU N N 19 118.802 118.587 0.215 1 1 189 . 5 1 1 A 20 20 GLU H H 20 7.976 7.811 0.165 1 1 190 . 5 1 1 A 20 20 GLU HA H 20 4.036 4.149 -0.113 1 1 194 . 5 1 1 A 20 20 GLU C C 20 179.451 179.208 0.243 1 1 195 . 5 1 1 A 20 20 GLU CA C 20 59.909 58.830 1.079 1 1 196 . 5 1 1 A 20 20 GLU CB C 20 28.992 29.283 -0.291 1 1 198 . 5 1 1 A 20 20 GLU N N 20 121.130 119.539 1.591 1 1 199 . 5 1 1 A 21 21 ARG H H 21 8.199 8.091 0.108 1 1 200 . 5 1 1 A 21 21 ARG HA H 21 4.061 4.055 0.006 1 1 207 . 5 1 1 A 21 21 ARG C C 21 179.087 178.918 0.169 1 1 208 . 5 1 1 A 21 21 ARG CA C 21 58.477 58.801 -0.324 1 1 209 . 5 1 1 A 21 21 ARG CB C 21 30.101 30.079 0.022 1 1 211 . 5 1 1 A 21 21 ARG N N 21 119.897 120.139 -0.242 1 1 213 . 5 1 1 A 22 22 LEU H H 22 8.154 8.467 -0.313 1 1 214 . 5 1 1 A 22 22 LEU HA H 22 3.560 3.760 -0.200 1 1 224 . 5 1 1 A 22 22 LEU C C 22 178.461 179.386 -0.925 1 1 225 . 5 1 1 A 22 22 LEU CA C 22 58.432 57.751 0.681 1 1 226 . 5 1 1 A 22 22 LEU CB C 22 40.229 40.669 -0.440 1 1 230 . 5 1 1 A 22 22 LEU N N 22 120.012 119.581 0.431 1 1 231 . 5 1 1 A 23 23 GLN H H 23 7.621 7.925 -0.304 1 1 232 . 5 1 1 A 23 23 GLN HA H 23 4.232 4.169 0.063 1 1 238 . 5 1 1 A 23 23 GLN C C 23 180.543 177.957 2.586 1 1 239 . 5 1 1 A 23 23 GLN CA C 23 59.434 59.243 0.191 1 1 240 . 5 1 1 A 23 23 GLN CB C 23 28.749 28.504 0.245 1 1 242 . 5 1 1 A 23 23 GLN N N 23 117.823 117.721 0.102 1 1 244 . 5 1 1 A 24 24 GLU H H 24 8.165 7.795 0.370 1 1 245 . 5 1 1 A 24 24 GLU HA H 24 4.072 4.179 -0.107 1 1 249 . 5 1 1 A 24 24 GLU C C 24 178.612 179.100 -0.488 1 1 250 . 5 1 1 A 24 24 GLU CA C 24 59.236 58.837 0.399 1 1 251 . 5 1 1 A 24 24 GLU CB C 24 29.606 29.518 0.088 1 1 253 . 5 1 1 A 24 24 GLU N N 24 122.589 119.405 3.184 1 1 254 . 5 1 1 A 25 25 LEU H H 25 7.911 7.838 0.073 1 1 255 . 5 1 1 A 25 25 LEU HA H 25 4.214 4.115 0.099 1 1 265 . 5 1 1 A 25 25 LEU C C 25 176.745 176.966 -0.221 1 1 266 . 5 1 1 A 25 25 LEU CA C 25 55.659 55.762 -0.103 1 1 267 . 5 1 1 A 25 25 LEU CB C 25 43.109 42.614 0.495 1 1 271 . 5 1 1 A 25 25 LEU N N 25 117.882 117.100 0.782 1 1 272 . 5 1 1 A 26 26 GLY H H 26 7.776 7.859 -0.083 1 1 273 . 5 1 1 A 26 26 GLY HA2 H 26 4.337 4.066 0.271 1 1 274 . 5 1 1 A 26 26 GLY HA3 H 26 3.856 4.077 -0.221 1 1 275 . 5 1 1 A 26 26 GLY C C 26 175.456 174.433 1.023 1 1 276 . 5 1 1 A 26 26 GLY CA C 26 44.875 45.082 -0.207 1 1 277 . 5 1 1 A 26 26 GLY N N 26 104.938 105.440 -0.502 1 1 278 . 5 1 1 A 27 27 ALA H H 27 8.104 8.114 -0.010 1 1 279 . 5 1 1 A 27 27 ALA HA H 27 4.949 4.732 0.217 1 1 283 . 5 1 1 A 27 27 ALA C C 27 176.448 176.472 -0.024 1 1 284 . 5 1 1 A 27 27 ALA CA C 27 52.183 52.140 0.043 1 1 285 . 5 1 1 A 27 27 ALA CB C 27 21.814 20.141 1.673 1 1 286 . 5 1 1 A 27 27 ALA N N 27 123.263 124.003 -0.740 1 1 287 . 5 1 1 A 28 28 THR H H 28 9.369 8.898 0.471 1 1 288 . 5 1 1 A 28 28 THR HA H 28 4.779 5.089 -0.310 1 1 293 . 5 1 1 A 28 28 THR C C 28 173.725 173.389 0.336 1 1 294 . 5 1 1 A 28 28 THR CA C 28 60.046 59.784 0.262 1 1 295 . 5 1 1 A 28 28 THR CB C 28 70.592 71.201 -0.609 1 1 297 . 5 1 1 A 28 28 THR N N 28 112.201 117.613 -5.412 1 1 298 . 5 1 1 A 29 29 LEU H H 29 8.518 8.608 -0.090 1 1 299 . 5 1 1 A 29 29 LEU HA H 29 3.332 3.465 -0.133 1 1 309 . 5 1 1 A 29 29 LEU C C 29 176.202 176.362 -0.160 1 1 310 . 5 1 1 A 29 29 LEU CA C 29 55.031 54.345 0.686 1 1 311 . 5 1 1 A 29 29 LEU CB C 29 40.624 41.425 -0.801 1 1 315 . 5 1 1 A 29 29 LEU N N 29 128.151 128.217 -0.066 1 1 316 . 5 1 1 A 30 30 GLU H H 30 9.269 9.063 0.206 1 1 317 . 5 1 1 A 30 30 GLU HA H 30 4.287 4.347 -0.060 1 1 321 . 5 1 1 A 30 30 GLU C C 30 176.740 176.481 0.259 1 1 322 . 5 1 1 A 30 30 GLU CA C 30 57.283 56.761 0.522 1 1 323 . 5 1 1 A 30 30 GLU CB C 30 31.045 30.835 0.210 1 1 325 . 5 1 1 A 30 30 GLU N N 30 130.123 122.582 7.541 1 1 326 . 5 1 1 A 31 31 HIS H H 31 7.341 7.078 0.263 1 1 327 . 5 1 1 A 31 31 HIS HA H 31 4.701 5.121 -0.420 1 1 331 . 5 1 1 A 31 31 HIS C C 31 172.581 173.250 -0.669 1 1 332 . 5 1 1 A 31 31 HIS CA C 31 55.876 54.788 1.088 1 1 333 . 5 1 1 A 31 31 HIS CB C 31 33.434 34.215 -0.781 1 1 334 . 5 1 1 A 31 31 HIS N N 31 113.223 116.366 -3.143 1 1 335 . 5 1 1 A 32 32 ARG H H 32 8.196 8.708 -0.512 1 1 336 . 5 1 1 A 32 32 ARG HA H 32 5.262 5.298 -0.036 1 1 341 . 5 1 1 A 32 32 ARG C C 32 174.377 174.995 -0.618 1 1 342 . 5 1 1 A 32 32 ARG CA C 32 55.808 54.974 0.834 1 1 343 . 5 1 1 A 32 32 ARG CB C 32 33.340 33.649 -0.309 1 1 345 . 5 1 1 A 32 32 ARG N N 32 123.003 122.704 0.299 1 1 346 . 5 1 1 A 33 33 VAL H H 33 8.956 9.089 -0.133 1 1 347 . 5 1 1 A 33 33 VAL HA H 33 4.734 4.944 -0.210 1 1 355 . 5 1 1 A 33 33 VAL C C 33 172.821 174.534 -1.713 1 1 356 . 5 1 1 A 33 33 VAL CA C 33 60.197 60.286 -0.089 1 1 357 . 5 1 1 A 33 33 VAL CB C 33 35.860 36.097 -0.237 1 1 360 . 5 1 1 A 33 33 VAL N N 33 122.929 126.360 -3.431 1 1 361 . 5 1 1 A 34 34 THR H H 34 8.250 8.770 -0.520 1 1 362 . 5 1 1 A 34 34 THR HA H 34 5.616 5.787 -0.171 1 1 367 . 5 1 1 A 34 34 THR C C 34 173.913 173.666 0.247 1 1 368 . 5 1 1 A 34 34 THR CA C 34 60.245 60.541 -0.296 1 1 369 . 5 1 1 A 34 34 THR CB C 34 71.706 71.268 0.438 1 1 371 . 5 1 1 A 34 34 THR N N 34 119.164 116.996 2.168 1 1 372 . 5 1 1 A 35 35 PHE H H 35 8.565 8.730 -0.165 1 1 373 . 5 1 1 A 35 35 PHE HA H 35 5.029 5.082 -0.053 1 1 378 . 5 1 1 A 35 35 PHE C C 35 173.193 172.182 1.011 1 1 379 . 5 1 1 A 35 35 PHE CA C 35 55.687 55.848 -0.161 1 1 380 . 5 1 1 A 35 35 PHE CB C 35 40.853 41.046 -0.193 1 1 383 . 5 1 1 A 35 35 PHE N N 35 120.244 118.347 1.897 1 1 384 . 5 1 1 A 36 36 ARG H H 36 8.869 8.610 0.259 1 1 385 . 5 1 1 A 36 36 ARG HA H 36 4.982 5.361 -0.379 1 1 387 . 5 1 1 A 36 36 ARG C C 36 174.743 174.716 0.027 1 1 388 . 5 1 1 A 36 36 ARG CA C 36 55.493 55.010 0.483 1 1 389 . 5 1 1 A 36 36 ARG CB C 36 32.228 32.674 -0.446 1 1 390 . 5 1 1 A 36 36 ARG N N 36 123.893 119.825 4.068 1 1 391 . 5 1 1 A 37 37 ASP H H 37 8.402 8.998 -0.596 1 1 392 . 5 1 1 A 37 37 ASP HA H 37 5.462 5.326 0.136 1 1 395 . 5 1 1 A 37 37 ASP C C 37 175.177 174.473 0.704 1 1 396 . 5 1 1 A 37 37 ASP CA C 37 53.942 53.144 0.798 1 1 397 . 5 1 1 A 37 37 ASP CB C 37 45.486 42.595 2.891 1 1 398 . 5 1 1 A 37 37 ASP N N 37 127.149 123.364 3.785 1 1 399 . 5 1 1 A 38 38 THR H H 38 8.151 8.682 -0.531 1 1 400 . 5 1 1 A 38 38 THR HA H 38 4.866 5.027 -0.161 1 1 405 . 5 1 1 A 38 38 THR C C 38 172.792 173.111 -0.319 1 1 406 . 5 1 1 A 38 38 THR CA C 38 61.416 60.752 0.664 1 1 407 . 5 1 1 A 38 38 THR CB C 38 71.047 70.132 0.915 1 1 409 . 5 1 1 A 38 38 THR N N 38 115.686 116.509 -0.823 1 1 410 . 5 1 1 A 39 39 TYR H H 39 9.021 9.351 -0.330 1 1 411 . 5 1 1 A 39 39 TYR HA H 39 5.544 5.750 -0.206 1 1 416 . 5 1 1 A 39 39 TYR C C 39 176.032 174.764 1.268 1 1 417 . 5 1 1 A 39 39 TYR CA C 39 57.184 56.092 1.092 1 1 418 . 5 1 1 A 39 39 TYR CB C 39 41.642 39.868 1.774 1 1 420 . 5 1 1 A 39 39 TYR N N 39 124.579 125.216 -0.637 1 1 421 . 5 1 1 A 40 40 TYR H H 40 8.487 9.461 -0.974 1 1 422 . 5 1 1 A 40 40 TYR HA H 40 5.517 5.601 -0.084 1 1 426 . 5 1 1 A 40 40 TYR C C 40 174.108 174.435 -0.327 1 1 427 . 5 1 1 A 40 40 TYR CA C 40 56.979 56.675 0.304 1 1 428 . 5 1 1 A 40 40 TYR CB C 40 44.132 42.549 1.583 1 1 431 . 5 1 1 A 40 40 TYR N N 40 119.709 121.944 -2.235 1 1 432 . 5 1 1 A 41 41 ASP H H 41 9.341 8.908 0.433 1 1 433 . 5 1 1 A 41 41 ASP HA H 41 4.866 5.146 -0.280 1 1 436 . 5 1 1 A 41 41 ASP C C 41 177.262 175.099 2.163 1 1 437 . 5 1 1 A 41 41 ASP CA C 41 53.445 53.368 0.077 1 1 438 . 5 1 1 A 41 41 ASP CB C 41 45.347 44.618 0.729 1 1 439 . 5 1 1 A 41 41 ASP N N 41 117.995 120.468 -2.473 1 1 440 . 5 1 1 A 42 42 THR H H 42 11.574 8.658 2.916 1 1 441 . 5 1 1 A 42 42 THR HA H 42 5.206 4.579 0.627 1 1 446 . 5 1 1 A 42 42 THR C C 42 177.935 176.305 1.630 1 1 447 . 5 1 1 A 42 42 THR CA C 42 60.400 62.184 -1.784 1 1 448 . 5 1 1 A 42 42 THR CB C 42 72.114 69.661 2.453 1 1 450 . 5 1 1 A 42 42 THR N N 42 114.394 117.540 -3.146 1 1 451 . 5 1 1 A 43 43 SER H H 43 9.715 8.886 0.829 1 1 452 . 5 1 1 A 43 43 SER HA H 43 4.252 4.229 0.023 1 1 455 . 5 1 1 A 43 43 SER C C 43 175.478 175.185 0.293 1 1 456 . 5 1 1 A 43 43 SER CA C 43 61.277 60.994 0.283 1 1 457 . 5 1 1 A 43 43 SER CB C 43 62.821 62.761 0.060 1 1 458 . 5 1 1 A 43 43 SER N N 43 116.674 119.328 -2.654 1 1 459 . 5 1 1 A 44 44 GLU H H 44 7.674 7.646 0.028 1 1 460 . 5 1 1 A 44 44 GLU HA H 44 4.330 4.449 -0.119 1 1 464 . 5 1 1 A 44 44 GLU C C 44 175.001 175.403 -0.402 1 1 465 . 5 1 1 A 44 44 GLU CA C 44 55.992 55.707 0.285 1 1 466 . 5 1 1 A 44 44 GLU CB C 44 29.276 30.423 -1.147 1 1 468 . 5 1 1 A 44 44 GLU N N 44 117.856 118.924 -1.068 1 1 469 . 5 1 1 A 45 45 LEU H H 45 8.222 8.048 0.174 1 1 470 . 5 1 1 A 45 45 LEU HA H 45 3.901 4.042 -0.141 1 1 480 . 5 1 1 A 45 45 LEU C C 45 175.209 176.501 -1.292 1 1 481 . 5 1 1 A 45 45 LEU CA C 45 55.548 56.203 -0.655 1 1 482 . 5 1 1 A 45 45 LEU CB C 45 38.458 39.310 -0.852 1 1 485 . 5 1 1 A 45 45 LEU N N 45 119.335 117.376 1.959 1 1 486 . 5 1 1 A 46 46 SER H H 46 7.347 8.086 -0.739 1 1 487 . 5 1 1 A 46 46 SER HA H 46 3.954 4.244 -0.290 1 1 489 . 5 1 1 A 46 46 SER C C 46 177.497 176.953 0.544 1 1 490 . 5 1 1 A 46 46 SER CA C 46 62.471 61.126 1.345 1 1 491 . 5 1 1 A 46 46 SER CB C 46 63.908 62.972 0.936 1 1 492 . 5 1 1 A 46 46 SER N N 46 111.433 114.171 -2.738 1 1 493 . 5 1 1 A 47 47 LEU H H 47 12.003 8.615 3.388 1 1 494 . 5 1 1 A 47 47 LEU HA H 47 3.959 4.146 -0.187 1 1 504 . 5 1 1 A 47 47 LEU C C 47 180.340 178.372 1.968 1 1 505 . 5 1 1 A 47 47 LEU CA C 47 58.879 57.871 1.008 1 1 506 . 5 1 1 A 47 47 LEU CB C 47 39.572 41.666 -2.094 1 1 510 . 5 1 1 A 47 47 LEU N N 47 124.605 123.130 1.475 1 1 511 . 5 1 1 A 48 48 MET H H 48 10.599 8.784 1.815 1 1 512 . 5 1 1 A 48 48 MET HA H 48 3.213 3.676 -0.463 1 1 520 . 5 1 1 A 48 48 MET C C 48 181.177 178.029 3.148 1 1 521 . 5 1 1 A 48 48 MET CA C 48 60.747 58.056 2.691 1 1 522 . 5 1 1 A 48 48 MET CB C 48 32.594 32.076 0.518 1 1 525 . 5 1 1 A 48 48 MET N N 48 126.254 118.983 7.271 1 1 526 . 5 1 1 A 49 49 LEU H H 49 8.731 7.949 0.782 1 1 527 . 5 1 1 A 49 49 LEU HA H 49 4.097 4.153 -0.056 1 1 536 . 5 1 1 A 49 49 LEU C C 49 178.144 177.385 0.759 1 1 537 . 5 1 1 A 49 49 LEU CA C 49 57.800 56.362 1.438 1 1 538 . 5 1 1 A 49 49 LEU CB C 49 41.379 41.613 -0.234 1 1 541 . 5 1 1 A 49 49 LEU N N 49 119.183 119.648 -0.465 1 1 542 . 5 1 1 A 50 50 SER H H 50 7.853 7.444 0.409 1 1 543 . 5 1 1 A 50 50 SER HA H 50 4.822 4.605 0.217 1 1 546 . 5 1 1 A 50 50 SER C C 50 174.539 173.663 0.876 1 1 547 . 5 1 1 A 50 50 SER CA C 50 57.811 58.172 -0.361 1 1 548 . 5 1 1 A 50 50 SER CB C 50 64.443 63.536 0.907 1 1 549 . 5 1 1 A 50 50 SER N N 50 114.594 113.599 0.995 1 1 550 . 5 1 1 A 51 51 ASP H H 51 8.264 7.803 0.461 1 1 551 . 5 1 1 A 51 51 ASP HA H 51 4.362 4.031 0.331 1 1 554 . 5 1 1 A 51 51 ASP C C 51 172.921 174.655 -1.734 1 1 555 . 5 1 1 A 51 51 ASP CA C 51 55.343 55.324 0.019 1 1 556 . 5 1 1 A 51 51 ASP CB C 51 40.583 39.333 1.250 1 1 557 . 5 1 1 A 51 51 ASP N N 51 123.003 118.756 4.247 1 1 558 . 5 1 1 A 52 52 HIS H H 52 7.869 7.416 0.453 1 1 559 . 5 1 1 A 52 52 HIS HA H 52 5.335 5.293 0.042 1 1 564 . 5 1 1 A 52 52 HIS C C 52 173.991 173.896 0.095 1 1 565 . 5 1 1 A 52 52 HIS CA C 52 55.889 54.341 1.548 1 1 566 . 5 1 1 A 52 52 HIS CB C 52 31.789 30.070 1.719 1 1 568 . 5 1 1 A 52 52 HIS N N 52 112.486 117.608 -5.122 1 1 569 . 5 1 1 A 53 53 TRP H H 53 8.165 9.504 -1.339 1 1 570 . 5 1 1 A 53 53 TRP HA H 53 4.926 5.247 -0.321 1 1 578 . 5 1 1 A 53 53 TRP C C 53 175.354 175.369 -0.015 1 1 579 . 5 1 1 A 53 53 TRP CA C 53 55.364 56.742 -1.378 1 1 580 . 5 1 1 A 53 53 TRP CB C 53 30.641 31.134 -0.493 1 1 585 . 5 1 1 A 53 53 TRP N N 53 117.916 125.754 -7.838 1 1 587 . 5 1 1 A 54 54 LEU H H 54 10.088 9.140 0.948 1 1 588 . 5 1 1 A 54 54 LEU HA H 54 5.497 5.714 -0.217 1 1 598 . 5 1 1 A 54 54 LEU C C 54 173.337 175.462 -2.125 1 1 599 . 5 1 1 A 54 54 LEU CA C 54 54.408 53.742 0.666 1 1 600 . 5 1 1 A 54 54 LEU CB C 54 44.156 45.598 -1.442 1 1 604 . 5 1 1 A 54 54 LEU N N 54 130.826 125.974 4.852 1 1 605 . 5 1 1 A 55 55 ARG H H 55 9.289 9.529 -0.240 1 1 606 . 5 1 1 A 55 55 ARG HA H 55 5.482 5.393 0.089 1 1 612 . 5 1 1 A 55 55 ARG C C 55 174.057 174.000 0.057 1 1 613 . 5 1 1 A 55 55 ARG CA C 55 53.167 53.971 -0.804 1 1 614 . 5 1 1 A 55 55 ARG CB C 55 34.270 33.856 0.414 1 1 616 . 5 1 1 A 55 55 ARG N N 55 125.089 124.848 0.241 1 1 618 . 5 1 1 A 56 56 GLN H H 56 9.092 8.786 0.306 1 1 619 . 5 1 1 A 56 56 GLN HA H 56 3.991 4.716 -0.725 1 1 626 . 5 1 1 A 56 56 GLN C C 56 174.199 174.178 0.021 1 1 627 . 5 1 1 A 56 56 GLN CA C 56 54.566 53.990 0.576 1 1 628 . 5 1 1 A 56 56 GLN CB C 56 29.643 31.339 -1.696 1 1 630 . 5 1 1 A 56 56 GLN N N 56 124.355 119.792 4.563 1 1 632 . 5 1 1 A 57 57 ARG H H 57 8.440 7.933 0.507 1 1 633 . 5 1 1 A 57 57 ARG HA H 57 5.316 4.930 0.386 1 1 639 . 5 1 1 A 57 57 ARG C C 57 176.188 176.196 -0.008 1 1 640 . 5 1 1 A 57 57 ARG CA C 57 53.940 55.561 -1.621 1 1 641 . 5 1 1 A 57 57 ARG CB C 57 32.426 30.687 1.739 1 1 643 . 5 1 1 A 57 57 ARG N N 57 130.222 125.641 4.581 1 1 645 . 5 1 1 A 58 58 GLU H H 58 8.891 8.951 -0.060 1 1 646 . 5 1 1 A 58 58 GLU HA H 58 3.996 4.038 -0.042 1 1 649 . 5 1 1 A 58 58 GLU CA C 58 58.364 57.331 1.033 1 1 650 . 5 1 1 A 58 58 GLU CB C 58 30.875 27.358 3.517 1 1 651 . 5 1 1 A 58 58 GLU N N 58 131.208 121.515 9.693 1 1 652 . 5 1 1 A 59 59 GLY H H 59 8.367 7.922 0.445 1 1 653 . 5 1 1 A 59 59 GLY HA2 H 59 4.334 3.765 0.569 1 1 654 . 5 1 1 A 59 59 GLY HA3 H 59 3.743 3.850 -0.107 1 1 655 . 5 1 1 A 59 59 GLY C C 59 174.194 174.983 -0.789 1 1 656 . 5 1 1 A 59 59 GLY CA C 59 45.666 45.650 0.016 1 1 657 . 5 1 1 A 60 60 SER H H 60 8.071 8.151 -0.080 1 1 658 . 5 1 1 A 60 60 SER HA H 60 4.730 4.343 0.387 1 1 661 . 5 1 1 A 60 60 SER C C 60 173.908 174.579 -0.671 1 1 662 . 5 1 1 A 60 60 SER CA C 60 58.762 59.244 -0.482 1 1 663 . 5 1 1 A 60 60 SER CB C 60 64.497 63.788 0.709 1 1 664 . 5 1 1 A 60 60 SER N N 60 114.636 116.900 -2.264 1 1 665 . 5 1 1 A 61 61 GLY H H 61 8.401 7.186 1.215 1 1 666 . 5 1 1 A 61 61 GLY HA2 H 61 4.560 3.979 0.581 1 1 667 . 5 1 1 A 61 61 GLY HA3 H 61 3.878 3.989 -0.111 1 1 668 . 5 1 1 A 61 61 GLY C C 61 173.526 171.954 1.572 1 1 669 . 5 1 1 A 61 61 GLY CA C 61 44.906 45.629 -0.723 1 1 670 . 5 1 1 A 61 61 GLY N N 61 109.421 106.651 2.770 1 1 671 . 5 1 1 A 62 62 TRP H H 62 8.861 8.586 0.275 1 1 672 . 5 1 1 A 62 62 TRP HA H 62 5.089 5.140 -0.051 1 1 681 . 5 1 1 A 62 62 TRP C C 62 176.168 176.050 0.118 1 1 682 . 5 1 1 A 62 62 TRP CA C 62 57.459 57.556 -0.097 1 1 683 . 5 1 1 A 62 62 TRP CB C 62 32.536 31.582 0.954 1 1 689 . 5 1 1 A 62 62 TRP N N 62 122.939 121.280 1.659 1 1 691 . 5 1 1 A 63 63 GLU H H 63 9.306 9.296 0.010 1 1 692 . 5 1 1 A 63 63 GLU HA H 63 4.919 5.016 -0.097 1 1 697 . 5 1 1 A 63 63 GLU C C 63 173.770 174.276 -0.506 1 1 698 . 5 1 1 A 63 63 GLU CA C 63 55.953 55.438 0.515 1 1 699 . 5 1 1 A 63 63 GLU CB C 63 35.317 33.360 1.957 1 1 701 . 5 1 1 A 63 63 GLU N N 63 120.136 121.525 -1.389 1 1 702 . 5 1 1 A 64 64 LEU H H 64 8.998 9.446 -0.448 1 1 703 . 5 1 1 A 64 64 LEU HA H 64 5.616 5.911 -0.295 1 1 712 . 5 1 1 A 64 64 LEU C C 64 175.014 174.095 0.919 1 1 713 . 5 1 1 A 64 64 LEU CA C 64 52.945 54.234 -1.289 1 1 714 . 5 1 1 A 64 64 LEU CB C 64 46.904 45.795 1.109 1 1 717 . 5 1 1 A 64 64 LEU N N 64 127.321 127.999 -0.678 1 1 718 . 5 1 1 A 65 65 LYS H H 65 9.322 9.934 -0.612 1 1 719 . 5 1 1 A 65 65 LYS HA H 65 5.347 5.206 0.141 1 1 727 . 5 1 1 A 65 65 LYS C C 65 175.811 175.377 0.434 1 1 728 . 5 1 1 A 65 65 LYS CA C 65 55.817 55.434 0.383 1 1 729 . 5 1 1 A 65 65 LYS CB C 65 34.521 34.726 -0.205 1 1 733 . 5 1 1 A 65 65 LYS N N 65 129.874 128.701 1.173 1 1 734 . 5 1 1 A 66 66 CYS H H 66 9.129 9.365 -0.236 1 1 735 . 5 1 1 A 66 66 CYS HA H 66 5.319 4.965 0.354 1 1 738 . 5 1 1 A 66 66 CYS CA C 66 54.532 56.849 -2.317 1 1 739 . 5 1 1 A 66 66 CYS CB C 66 28.813 29.423 -0.610 1 1 740 . 5 1 1 A 66 66 CYS N N 66 121.497 125.168 -3.671 1 1 741 . 5 1 1 A 67 67 PRO HA H 67 4.439 4.043 0.396 1 1 748 . 5 1 1 A 67 67 PRO C C 67 177.297 177.995 -0.698 1 1 749 . 5 1 1 A 67 67 PRO CA C 67 63.596 63.394 0.202 1 1 750 . 5 1 1 A 67 67 PRO CB C 67 32.242 31.746 0.496 1 1 752 . 5 1 1 A 68 68 GLY H H 68 8.316 8.275 0.041 1 1 753 . 5 1 1 A 68 68 GLY HA2 H 68 3.726 3.936 -0.210 1 1 754 . 5 1 1 A 68 68 GLY HA3 H 68 4.095 3.968 0.127 1 1 755 . 5 1 1 A 68 68 GLY C C 68 173.789 174.116 -0.327 1 1 756 . 5 1 1 A 68 68 GLY CA C 68 45.227 45.309 -0.082 1 1 757 . 5 1 1 A 68 68 GLY N N 68 109.533 109.668 -0.135 1 1 758 . 5 1 1 A 69 69 VAL H H 69 8.114 7.624 0.490 1 1 759 . 5 1 1 A 69 69 VAL HA H 69 4.266 4.045 0.221 1 1 764 . 5 1 1 A 69 69 VAL C C 69 176.299 176.449 -0.150 1 1 765 . 5 1 1 A 69 69 VAL CA C 69 61.945 63.090 -1.145 1 1 766 . 5 1 1 A 69 69 VAL CB C 69 33.082 31.831 1.251 1 1 768 . 5 1 1 A 69 69 VAL N N 69 118.540 121.739 -3.199 1 1 769 . 5 1 1 A 70 70 THR H H 70 8.324 8.962 -0.638 1 1 770 . 5 1 1 A 70 70 THR HA H 70 4.373 4.733 -0.360 1 1 775 . 5 1 1 A 70 70 THR C C 70 175.204 174.228 0.976 1 1 776 . 5 1 1 A 70 70 THR CA C 70 62.309 60.913 1.396 1 1 777 . 5 1 1 A 70 70 THR CB C 70 69.787 68.924 0.863 1 1 779 . 5 1 1 A 70 70 THR N N 70 117.636 116.305 1.331 1 1 780 . 5 1 1 A 71 71 GLY H H 71 8.574 7.885 0.689 1 1 781 . 5 1 1 A 71 71 GLY HA2 H 71 4.096 4.029 0.067 1 1 782 . 5 1 1 A 71 71 GLY HA3 H 71 3.975 4.034 -0.059 1 1 783 . 5 1 1 A 71 71 GLY C C 71 174.313 175.510 -1.197 1 1 784 . 5 1 1 A 71 71 GLY CA C 71 45.545 45.223 0.322 1 1 785 . 5 1 1 A 71 71 GLY N N 71 111.677 109.494 2.183 1 1 786 . 5 1 1 A 72 72 VAL H H 72 7.945 8.120 -0.175 1 1 787 . 5 1 1 A 72 72 VAL HA H 72 4.258 3.970 0.288 1 1 795 . 5 1 1 A 72 72 VAL C C 72 176.162 175.930 0.232 1 1 796 . 5 1 1 A 72 72 VAL CA C 72 62.227 65.400 -3.173 1 1 797 . 5 1 1 A 72 72 VAL CB C 72 32.997 31.967 1.030 1 1 799 . 5 1 1 A 72 72 VAL N N 72 118.647 119.013 -0.366 1 1 800 . 5 1 1 A 73 73 SER H H 73 8.498 8.125 0.373 1 1 801 . 5 1 1 A 73 73 SER HA H 73 4.617 4.297 0.320 1 1 803 . 5 1 1 A 73 73 SER C C 73 174.461 173.827 0.634 1 1 804 . 5 1 1 A 73 73 SER CA C 73 58.218 59.133 -0.915 1 1 805 . 5 1 1 A 73 73 SER CB C 73 64.061 61.986 2.075 1 1 806 . 5 1 1 A 73 73 SER N N 73 118.828 115.340 3.488 1 1 807 . 5 1 1 A 74 74 GLY H H 74 8.247 8.198 0.049 1 1 808 . 5 1 1 A 74 74 GLY HA2 H 74 4.101 4.185 -0.084 1 1 809 . 5 1 1 A 74 74 GLY HA3 H 74 4.304 4.186 0.118 1 1 810 . 5 1 1 A 74 74 GLY CA C 74 44.896 45.223 -0.327 1 1 811 . 5 1 1 A 74 74 GLY N N 74 111.138 111.532 -0.394 1 1 812 . 5 1 1 A 75 75 PRO HA H 75 4.461 4.319 0.142 1 1 819 . 5 1 1 A 75 75 PRO C C 75 176.798 176.463 0.335 1 1 820 . 5 1 1 A 75 75 PRO CA C 75 63.466 64.999 -1.533 1 1 821 . 5 1 1 A 75 75 PRO CB C 75 31.980 31.533 0.447 1 1 824 . 5 1 1 A 76 76 HIS H H 76 8.397 7.587 0.810 1 1 825 . 5 1 1 A 76 76 HIS HA H 76 4.742 4.751 -0.009 1 1 829 . 5 1 1 A 76 76 HIS C C 76 174.282 174.154 0.128 1 1 830 . 5 1 1 A 76 76 HIS CA C 76 55.579 54.933 0.646 1 1 831 . 5 1 1 A 76 76 HIS CB C 76 30.501 31.359 -0.858 1 1 832 . 5 1 1 A 76 76 HIS N N 76 118.431 110.329 8.102 1 1 833 . 5 1 1 A 77 77 ASN H H 77 8.364 9.323 -0.959 1 1 834 . 5 1 1 A 77 77 ASN HA H 77 4.767 4.886 -0.119 1 1 839 . 5 1 1 A 77 77 ASN C C 77 174.576 175.053 -0.477 1 1 840 . 5 1 1 A 77 77 ASN CA C 77 53.139 52.813 0.326 1 1 841 . 5 1 1 A 77 77 ASN CB C 77 39.320 38.846 0.474 1 1 842 . 5 1 1 A 77 77 ASN N N 77 119.421 117.421 2.000 1 1 844 . 5 1 1 A 78 78 GLU H H 78 8.683 8.094 0.589 1 1 845 . 5 1 1 A 78 78 GLU HA H 78 4.409 4.246 0.163 1 1 850 . 5 1 1 A 78 78 GLU C C 78 175.791 175.228 0.563 1 1 851 . 5 1 1 A 78 78 GLU CA C 78 56.359 58.505 -2.146 1 1 852 . 5 1 1 A 78 78 GLU CB C 78 30.818 28.795 2.023 1 1 854 . 5 1 1 A 78 78 GLU N N 78 122.085 115.306 6.779 1 1 855 . 5 1 1 A 79 79 TYR H H 79 8.341 8.635 -0.294 1 1 856 . 5 1 1 A 79 79 TYR HA H 79 4.988 5.195 -0.207 1 1 861 . 5 1 1 A 79 79 TYR C C 79 175.837 175.772 0.065 1 1 862 . 5 1 1 A 79 79 TYR CA C 79 58.028 59.730 -1.702 1 1 863 . 5 1 1 A 79 79 TYR CB C 79 41.672 39.300 2.372 1 1 866 . 5 1 1 A 79 79 TYR N N 79 119.452 122.959 -3.507 1 1 867 . 5 1 1 A 80 80 VAL H H 80 9.366 9.556 -0.190 1 1 868 . 5 1 1 A 80 80 VAL HA H 80 4.370 4.975 -0.605 1 1 873 . 5 1 1 A 80 80 VAL C C 80 174.948 174.377 0.571 1 1 874 . 5 1 1 A 80 80 VAL CA C 80 61.190 60.248 0.942 1 1 875 . 5 1 1 A 80 80 VAL CB C 80 34.204 34.557 -0.353 1 1 877 . 5 1 1 A 80 80 VAL N N 80 120.567 117.881 2.686 1 1 878 . 5 1 1 A 81 81 GLU H H 81 8.570 9.038 -0.468 1 1 879 . 5 1 1 A 81 81 GLU HA H 81 4.770 5.065 -0.295 1 1 883 . 5 1 1 A 81 81 GLU C C 81 175.491 175.957 -0.466 1 1 884 . 5 1 1 A 81 81 GLU CA C 81 55.655 55.434 0.221 1 1 885 . 5 1 1 A 81 81 GLU CB C 81 30.415 31.223 -0.808 1 1 887 . 5 1 1 A 81 81 GLU N N 81 124.248 125.939 -1.691 1 1 888 . 5 1 1 A 82 82 VAL H H 82 9.189 9.329 -0.140 1 1 889 . 5 1 1 A 82 82 VAL HA H 82 4.279 4.915 -0.636 1 1 894 . 5 1 1 A 82 82 VAL C C 82 176.087 175.645 0.442 1 1 895 . 5 1 1 A 82 82 VAL CA C 82 62.672 60.654 2.018 1 1 896 . 5 1 1 A 82 82 VAL CB C 82 33.121 33.793 -0.672 1 1 898 . 5 1 1 A 82 82 VAL N N 82 127.776 121.358 6.418 1 1 899 . 5 1 1 A 83 83 THR H H 83 8.590 8.623 -0.033 1 1 900 . 5 1 1 A 83 83 THR HA H 83 4.955 4.602 0.353 1 1 905 . 5 1 1 A 83 83 THR C C 83 174.688 174.948 -0.260 1 1 906 . 5 1 1 A 83 83 THR CA C 83 61.332 61.405 -0.073 1 1 907 . 5 1 1 A 83 83 THR CB C 83 70.213 70.362 -0.149 1 1 909 . 5 1 1 A 83 83 THR N N 83 114.744 115.379 -0.635 1 1 910 . 5 1 1 A 84 84 SER H H 84 7.650 7.504 0.146 1 1 911 . 5 1 1 A 84 84 SER HA H 84 4.819 4.270 0.549 1 1 914 . 5 1 1 A 84 84 SER CA C 84 56.280 60.341 -4.061 1 1 915 . 5 1 1 A 84 84 SER CB C 84 63.294 63.673 -0.379 1 1 916 . 5 1 1 A 84 84 SER N N 84 118.038 119.043 -1.005 1 1 917 . 5 1 1 A 85 85 GLU H H 85 8.391 8.744 -0.353 1 1 918 . 5 1 1 A 85 85 GLU HA H 85 3.661 3.980 -0.319 1 1 923 . 5 1 1 A 85 85 GLU C C 85 177.520 178.572 -1.052 1 1 924 . 5 1 1 A 85 85 GLU CA C 85 62.429 59.669 2.760 1 1 925 . 5 1 1 A 85 85 GLU CB C 85 29.655 29.332 0.323 1 1 927 . 5 1 1 A 86 86 ALA H H 86 8.443 8.124 0.319 1 1 928 . 5 1 1 A 86 86 ALA HA H 86 4.027 4.041 -0.014 1 1 932 . 5 1 1 A 86 86 ALA C C 86 180.423 180.075 0.348 1 1 933 . 5 1 1 A 86 86 ALA CA C 86 55.145 54.807 0.338 1 1 934 . 5 1 1 A 86 86 ALA CB C 86 18.165 18.053 0.112 1 1 935 . 5 1 1 A 86 86 ALA N N 86 119.636 123.234 -3.598 1 1 936 . 5 1 1 A 87 87 ALA H H 87 7.214 7.447 -0.233 1 1 937 . 5 1 1 A 87 87 ALA HA H 87 4.244 4.053 0.191 1 1 941 . 5 1 1 A 87 87 ALA C C 87 180.354 179.376 0.978 1 1 942 . 5 1 1 A 87 87 ALA CA C 87 54.378 55.039 -0.661 1 1 943 . 5 1 1 A 87 87 ALA CB C 87 18.795 18.324 0.471 1 1 944 . 5 1 1 A 87 87 ALA N N 87 121.004 120.400 0.604 1 1 945 . 5 1 1 A 88 88 ILE H H 88 8.471 7.729 0.742 1 1 946 . 5 1 1 A 88 88 ILE HA H 88 3.360 3.639 -0.279 1 1 954 . 5 1 1 A 88 88 ILE CA C 88 66.323 65.020 1.303 1 1 955 . 5 1 1 A 88 88 ILE CB C 88 37.808 37.779 0.029 1 1 958 . 5 1 1 A 88 88 ILE N N 88 120.743 119.069 1.674 1 1 959 . 5 1 1 A 89 89 VAL H H 89 8.343 8.437 -0.094 1 1 960 . 5 1 1 A 89 89 VAL HA H 89 3.061 3.463 -0.402 1 1 968 . 5 1 1 A 89 89 VAL C C 89 176.708 177.961 -1.253 1 1 969 . 5 1 1 A 89 89 VAL CA C 89 67.833 66.512 1.321 1 1 970 . 5 1 1 A 89 89 VAL CB C 89 31.509 31.369 0.140 1 1 973 . 5 1 1 A 89 89 VAL N N 89 118.049 119.556 -1.507 1 1 974 . 5 1 1 A 90 90 ALA H H 90 7.516 7.879 -0.363 1 1 975 . 5 1 1 A 90 90 ALA HA H 90 3.987 3.896 0.091 1 1 979 . 5 1 1 A 90 90 ALA C C 90 180.744 179.960 0.784 1 1 980 . 5 1 1 A 90 90 ALA CA C 90 55.481 55.693 -0.212 1 1 981 . 5 1 1 A 90 90 ALA CB C 90 17.953 18.278 -0.325 1 1 982 . 5 1 1 A 90 90 ALA N N 90 118.935 122.178 -3.243 1 1 983 . 5 1 1 A 91 91 GLN H H 91 7.886 8.247 -0.361 1 1 984 . 5 1 1 A 91 91 GLN HA H 91 4.190 3.912 0.278 1 1 991 . 5 1 1 A 91 91 GLN C C 91 178.832 178.640 0.192 1 1 992 . 5 1 1 A 91 91 GLN CA C 91 58.519 59.025 -0.506 1 1 993 . 5 1 1 A 91 91 GLN CB C 91 28.091 28.081 0.010 1 1 995 . 5 1 1 A 91 91 GLN N N 91 117.846 117.742 0.104 1 1 997 . 5 1 1 A 92 92 LEU H H 92 8.751 8.689 0.062 1 1 998 . 5 1 1 A 92 92 LEU HA H 92 3.903 3.960 -0.057 1 1 1007 . 5 1 1 A 92 92 LEU C C 92 178.997 179.119 -0.122 1 1 1008 . 5 1 1 A 92 92 LEU CA C 92 58.136 57.931 0.205 1 1 1009 . 5 1 1 A 92 92 LEU CB C 92 41.576 41.625 -0.049 1 1 1013 . 5 1 1 A 92 92 LEU N N 92 119.547 119.498 0.049 1 1 1014 . 5 1 1 A 93 93 PHE H H 93 8.648 7.945 0.703 1 1 1015 . 5 1 1 A 93 93 PHE HA H 93 4.270 4.187 0.083 1 1 1020 . 5 1 1 A 93 93 PHE C C 93 179.283 178.813 0.470 1 1 1021 . 5 1 1 A 93 93 PHE CA C 93 59.860 60.447 -0.587 1 1 1022 . 5 1 1 A 93 93 PHE CB C 93 37.765 38.612 -0.847 1 1 1025 . 5 1 1 A 93 93 PHE N N 93 118.041 118.832 -0.791 1 1 1026 . 5 1 1 A 94 94 GLU H H 94 7.739 8.293 -0.554 1 1 1027 . 5 1 1 A 94 94 GLU HA H 94 4.110 4.119 -0.009 1 1 1031 . 5 1 1 A 94 94 GLU C C 94 178.629 178.912 -0.283 1 1 1032 . 5 1 1 A 94 94 GLU CA C 94 59.359 59.398 -0.039 1 1 1033 . 5 1 1 A 94 94 GLU CB C 94 29.589 28.898 0.691 1 1 1035 . 5 1 1 A 94 94 GLU N N 94 119.980 117.397 2.583 1 1 1036 . 5 1 1 A 95 95 LEU H H 95 7.999 8.469 -0.470 1 1 1037 . 5 1 1 A 95 95 LEU HA H 95 4.139 3.880 0.259 1 1 1047 . 5 1 1 A 95 95 LEU C C 95 178.965 178.205 0.760 1 1 1048 . 5 1 1 A 95 95 LEU CA C 95 57.557 57.756 -0.199 1 1 1049 . 5 1 1 A 95 95 LEU CB C 95 43.443 41.645 1.798 1 1 1053 . 5 1 1 A 95 95 LEU N N 95 118.398 121.563 -3.165 1 1 1054 . 5 1 1 A 96 96 LEU H H 96 8.363 7.808 0.555 1 1 1055 . 5 1 1 A 96 96 LEU HA H 96 4.503 4.311 0.192 1 1 1061 . 5 1 1 A 96 96 LEU C C 96 177.932 176.628 1.304 1 1 1062 . 5 1 1 A 96 96 LEU CA C 96 54.700 54.824 -0.124 1 1 1063 . 5 1 1 A 96 96 LEU CB C 96 43.048 42.186 0.862 1 1 1065 . 5 1 1 A 96 96 LEU N N 96 114.720 116.718 -1.998 1 1 1066 . 5 1 1 A 97 97 GLY H H 97 7.810 7.673 0.137 1 1 1067 . 5 1 1 A 97 97 GLY HA2 H 97 3.963 3.892 0.071 1 1 1068 . 5 1 1 A 97 97 GLY C C 97 173.535 174.080 -0.545 1 1 1069 . 5 1 1 A 97 97 GLY CA C 97 45.667 46.594 -0.927 1 1 1070 . 5 1 1 A 97 97 GLY N N 97 109.511 108.093 1.418 1 1 1071 . 5 1 1 A 98 98 SER H H 98 8.131 7.959 0.172 1 1 1072 . 5 1 1 A 98 98 SER HA H 98 4.225 4.783 -0.558 1 1 1075 . 5 1 1 A 98 98 SER C C 98 174.974 174.264 0.710 1 1 1076 . 5 1 1 A 98 98 SER CA C 98 57.960 57.489 0.471 1 1 1077 . 5 1 1 A 98 98 SER CB C 98 63.997 65.861 -1.864 1 1 1078 . 5 1 1 A 98 98 SER N N 98 113.405 115.370 -1.965 1 1 1079 . 5 1 1 A 99 99 GLY H H 99 8.052 8.739 -0.687 1 1 1080 . 5 1 1 A 99 99 GLY HA2 H 99 3.998 3.909 0.089 1 1 1081 . 5 1 1 A 99 99 GLY HA3 H 99 3.778 3.956 -0.178 1 1 1082 . 5 1 1 A 99 99 GLY C C 99 174.033 174.504 -0.471 1 1 1083 . 5 1 1 A 99 99 GLY CA C 99 45.123 47.150 -2.027 1 1 1084 . 5 1 1 A 99 99 GLY N N 99 111.534 112.910 -1.376 1 1 1085 . 5 1 1 A 100 100 GLU H H 100 8.177 7.922 0.255 1 1 1086 . 5 1 1 A 100 100 GLU HA H 100 4.201 4.135 0.066 1 1 1091 . 5 1 1 A 100 100 GLU C C 100 175.830 175.817 0.013 1 1 1092 . 5 1 1 A 100 100 GLU CA C 100 56.442 58.541 -2.099 1 1 1093 . 5 1 1 A 100 100 GLU CB C 100 30.428 28.149 2.279 1 1 1095 . 5 1 1 A 100 100 GLU N N 100 120.463 117.355 3.108 1 1 1096 . 5 1 1 A 101 101 GLN H H 101 8.161 8.357 -0.196 1 1 1097 . 5 1 1 A 101 101 GLN HA H 101 4.098 4.817 -0.719 1 1 1103 . 5 1 1 A 101 101 GLN C C 101 175.412 174.977 0.435 1 1 1104 . 5 1 1 A 101 101 GLN CA C 101 55.632 55.150 0.482 1 1 1105 . 5 1 1 A 101 101 GLN CB C 101 29.569 29.392 0.177 1 1 1107 . 5 1 1 A 101 101 GLN N N 101 120.014 119.451 0.563 1 1 1109 . 5 1 1 A 102 102 LYS H H 102 8.235 8.483 -0.248 1 1 1110 . 5 1 1 A 102 102 LYS HA H 102 4.387 4.049 0.338 1 1 1117 . 5 1 1 A 102 102 LYS CA C 102 54.116 54.022 0.094 1 1 1118 . 5 1 1 A 102 102 LYS CB C 102 32.478 32.984 -0.506 1 1 1122 . 5 1 1 A 102 102 LYS N N 102 123.399 126.319 -2.920 1 1 1123 . 5 1 1 A 103 103 PRO HA H 103 4.498 4.368 0.130 1 1 1129 . 5 1 1 A 103 103 PRO C C 103 175.473 177.013 -1.540 1 1 1130 . 5 1 1 A 103 103 PRO CA C 103 62.802 65.796 -2.994 1 1 1131 . 5 1 1 A 103 103 PRO CB C 103 32.124 31.555 0.569 1 1 1134 . 5 1 1 A 104 104 ALA H H 104 8.017 7.268 0.749 1 1 1135 . 5 1 1 A 104 104 ALA HA H 104 4.318 4.286 0.032 1 1 1139 . 5 1 1 A 104 104 ALA C C 104 176.717 176.939 -0.222 1 1 1140 . 5 1 1 A 104 104 ALA CA C 104 52.194 53.175 -0.981 1 1 1141 . 5 1 1 A 104 104 ALA CB C 104 20.113 20.367 -0.254 1 1 1142 . 5 1 1 A 104 104 ALA N N 104 122.093 117.243 4.850 1 1 1143 . 5 1 1 A 105 105 GLY H H 105 7.678 8.219 -0.541 1 1 1144 . 5 1 1 A 105 105 GLY HA2 H 105 3.851 4.049 -0.198 1 1 1145 . 5 1 1 A 105 105 GLY HA3 H 105 4.053 4.075 -0.022 1 1 1146 . 5 1 1 A 105 105 GLY C C 105 172.990 174.780 -1.790 1 1 1147 . 5 1 1 A 105 105 GLY CA C 105 44.241 43.734 0.507 1 1 1148 . 5 1 1 A 105 105 GLY N N 105 105.234 106.170 -0.936 1 1 1149 . 5 1 1 A 106 106 VAL H H 106 8.409 8.495 -0.086 1 1 1150 . 5 1 1 A 106 106 VAL HA H 106 2.829 3.320 -0.491 1 1 1158 . 5 1 1 A 106 106 VAL C C 106 177.822 177.272 0.550 1 1 1159 . 5 1 1 A 106 106 VAL CA C 106 65.522 65.557 -0.035 1 1 1160 . 5 1 1 A 106 106 VAL CB C 106 30.701 30.596 0.105 1 1 1163 . 5 1 1 A 106 106 VAL N N 106 119.215 119.232 -0.017 1 1 1164 . 5 1 1 A 107 107 ALA H H 107 8.707 8.356 0.351 1 1 1165 . 5 1 1 A 107 107 ALA HA H 107 3.730 3.902 -0.172 1 1 1169 . 5 1 1 A 107 107 ALA C C 107 179.661 179.488 0.173 1 1 1170 . 5 1 1 A 107 107 ALA CA C 107 54.995 55.505 -0.510 1 1 1171 . 5 1 1 A 107 107 ALA CB C 107 17.705 17.893 -0.188 1 1 1172 . 5 1 1 A 107 107 ALA N N 107 118.672 121.823 -3.151 1 1 1173 . 5 1 1 A 108 108 ALA H H 108 7.388 7.782 -0.394 1 1 1174 . 5 1 1 A 108 108 ALA HA H 108 4.259 4.147 0.112 1 1 1178 . 5 1 1 A 108 108 ALA C C 108 179.318 179.385 -0.067 1 1 1179 . 5 1 1 A 108 108 ALA CA C 108 53.481 54.973 -1.492 1 1 1180 . 5 1 1 A 108 108 ALA CB C 108 19.367 18.595 0.772 1 1 1181 . 5 1 1 A 108 108 ALA N N 108 116.635 120.022 -3.387 1 1 1182 . 5 1 1 A 109 109 VAL H H 109 7.689 7.359 0.330 1 1 1183 . 5 1 1 A 109 109 VAL HA H 109 4.532 3.869 0.663 1 1 1191 . 5 1 1 A 109 109 VAL C C 109 176.055 177.981 -1.926 1 1 1192 . 5 1 1 A 109 109 VAL CA C 109 61.452 65.645 -4.193 1 1 1193 . 5 1 1 A 109 109 VAL CB C 109 32.728 31.369 1.359 1 1 1196 . 5 1 1 A 109 109 VAL N N 109 112.851 117.140 -4.289 1 1 1197 . 5 1 1 A 110 110 LEU H H 110 7.099 8.206 -1.107 1 1 1198 . 5 1 1 A 110 110 LEU HA H 110 3.723 3.804 -0.081 1 1 1208 . 5 1 1 A 110 110 LEU C C 110 179.040 178.834 0.206 1 1 1209 . 5 1 1 A 110 110 LEU CA C 110 58.825 57.886 0.939 1 1 1210 . 5 1 1 A 110 110 LEU CB C 110 41.242 41.771 -0.529 1 1 1214 . 5 1 1 A 110 110 LEU N N 110 119.829 125.007 -5.178 1 1 1215 . 5 1 1 A 111 111 GLY H H 111 8.435 7.684 0.751 1 1 1216 . 5 1 1 A 111 111 GLY HA2 H 111 3.970 3.814 0.156 1 1 1217 . 5 1 1 A 111 111 GLY HA3 H 111 3.885 3.821 0.064 1 1 1218 . 5 1 1 A 111 111 GLY C C 111 178.031 176.450 1.581 1 1 1219 . 5 1 1 A 111 111 GLY CA C 111 46.961 47.608 -0.647 1 1 1220 . 5 1 1 A 111 111 GLY N N 111 104.089 106.551 -2.462 1 1 1221 . 5 1 1 A 112 112 SER H H 112 8.343 8.266 0.077 1 1 1222 . 5 1 1 A 112 112 SER HA H 112 4.266 4.134 0.132 1 1 1224 . 5 1 1 A 112 112 SER C C 112 175.885 175.132 0.753 1 1 1225 . 5 1 1 A 112 112 SER CA C 112 61.304 62.568 -1.264 1 1 1226 . 5 1 1 A 112 112 SER CB C 112 62.901 62.968 -0.067 1 1 1227 . 5 1 1 A 112 112 SER N N 112 119.497 119.369 0.128 1 1 1228 . 5 1 1 A 113 113 LEU H H 113 7.667 7.937 -0.270 1 1 1229 . 5 1 1 A 113 113 LEU HA H 113 4.343 4.216 0.127 1 1 1238 . 5 1 1 A 113 113 LEU C C 113 174.760 176.093 -1.333 1 1 1239 . 5 1 1 A 113 113 LEU CA C 113 54.228 54.567 -0.339 1 1 1240 . 5 1 1 A 113 113 LEU CB C 113 41.467 41.880 -0.413 1 1 1244 . 5 1 1 A 113 113 LEU N N 113 118.843 117.661 1.182 1 1 1245 . 5 1 1 A 114 114 LYS H H 114 7.685 7.865 -0.180 1 1 1246 . 5 1 1 A 114 114 LYS HA H 114 3.958 3.896 0.062 1 1 1250 . 5 1 1 A 114 114 LYS C C 114 177.557 175.773 1.784 1 1 1251 . 5 1 1 A 114 114 LYS CA C 114 56.935 57.445 -0.510 1 1 1252 . 5 1 1 A 114 114 LYS CB C 114 28.898 29.463 -0.565 1 1 1254 . 5 1 1 A 114 114 LYS N N 114 114.072 116.401 -2.329 1 1 1255 . 5 1 1 A 115 115 LEU H H 115 8.329 8.002 0.327 1 1 1256 . 5 1 1 A 115 115 LEU HA H 115 4.315 4.258 0.057 1 1 1265 . 5 1 1 A 115 115 LEU C C 115 175.988 177.022 -1.034 1 1 1266 . 5 1 1 A 115 115 LEU CA C 115 54.310 55.720 -1.410 1 1 1267 . 5 1 1 A 115 115 LEU CB C 115 44.163 42.409 1.754 1 1 1270 . 5 1 1 A 115 115 LEU N N 115 117.951 119.963 -2.012 1 1 1271 . 5 1 1 A 116 116 GLN H H 116 9.100 8.261 0.839 1 1 1272 . 5 1 1 A 116 116 GLN HA H 116 4.898 4.864 0.034 1 1 1279 . 5 1 1 A 116 116 GLN CA C 116 53.467 55.270 -1.803 1 1 1280 . 5 1 1 A 116 116 GLN CB C 116 32.730 29.963 2.767 1 1 1282 . 5 1 1 A 116 116 GLN N N 116 119.994 122.692 -2.698 1 1 1284 . 5 1 1 A 117 117 GLU H H 117 8.849 8.577 0.272 1 1 1285 . 5 1 1 A 117 117 GLU HA H 117 3.707 4.207 -0.500 1 1 1290 . 5 1 1 A 117 117 GLU C C 117 177.303 176.474 0.829 1 1 1291 . 5 1 1 A 117 117 GLU CA C 117 57.233 55.309 1.924 1 1 1292 . 5 1 1 A 117 117 GLU CB C 117 29.634 28.533 1.101 1 1 1294 . 5 1 1 A 117 117 GLU N N 117 121.487 121.568 -0.081 1 1 1295 . 5 1 1 A 118 118 VAL H H 118 8.983 8.206 0.777 1 1 1296 . 5 1 1 A 118 118 VAL HA H 118 4.360 3.774 0.586 1 1 1304 . 5 1 1 A 118 118 VAL C C 118 174.171 175.159 -0.988 1 1 1305 . 5 1 1 A 118 118 VAL CA C 118 61.772 64.184 -2.412 1 1 1306 . 5 1 1 A 118 118 VAL CB C 118 34.095 32.273 1.822 1 1 1309 . 5 1 1 A 118 118 VAL N N 118 122.933 123.486 -0.553 1 1 1310 . 5 1 1 A 119 119 ALA H H 119 7.023 6.980 0.043 1 1 1311 . 5 1 1 A 119 119 ALA HA H 119 4.378 4.459 -0.081 1 1 1315 . 5 1 1 A 119 119 ALA C C 119 175.493 175.134 0.359 1 1 1316 . 5 1 1 A 119 119 ALA CA C 119 51.956 51.315 0.641 1 1 1317 . 5 1 1 A 119 119 ALA CB C 119 23.957 21.336 2.621 1 1 1318 . 5 1 1 A 119 119 ALA N N 119 117.379 120.710 -3.331 1 1 1319 . 5 1 1 A 120 120 SER H H 120 6.999 8.700 -1.701 1 1 1320 . 5 1 1 A 120 120 SER HA H 120 5.208 5.592 -0.384 1 1 1323 . 5 1 1 A 120 120 SER C C 120 173.082 173.474 -0.392 1 1 1324 . 5 1 1 A 120 120 SER CA C 120 56.754 56.401 0.353 1 1 1325 . 5 1 1 A 120 120 SER CB C 120 64.605 65.407 -0.802 1 1 1326 . 5 1 1 A 120 120 SER N N 120 113.743 116.803 -3.060 1 1 1327 . 5 1 1 A 121 121 PHE H H 121 8.244 8.315 -0.071 1 1 1328 . 5 1 1 A 121 121 PHE HA H 121 5.177 5.495 -0.318 1 1 1333 . 5 1 1 A 121 121 PHE C C 121 173.569 172.727 0.842 1 1 1334 . 5 1 1 A 121 121 PHE CA C 121 55.555 55.298 0.257 1 1 1335 . 5 1 1 A 121 121 PHE CB C 121 40.959 42.006 -1.047 1 1 1338 . 5 1 1 A 121 121 PHE N N 121 120.358 118.471 1.887 1 1 1339 . 5 1 1 A 122 122 ILE H H 122 8.907 9.063 -0.156 1 1 1340 . 5 1 1 A 122 122 ILE HA H 122 4.682 4.654 0.028 1 1 1348 . 5 1 1 A 122 122 ILE C C 122 176.925 175.223 1.702 1 1 1349 . 5 1 1 A 122 122 ILE CA C 122 60.740 60.561 0.179 1 1 1350 . 5 1 1 A 122 122 ILE CB C 122 39.497 38.826 0.671 1 1 1353 . 5 1 1 A 122 122 ILE N N 122 121.282 121.054 0.228 1 1 1354 . 5 1 1 A 123 123 THR H H 123 9.022 9.464 -0.442 1 1 1355 . 5 1 1 A 123 123 THR HA H 123 5.039 5.210 -0.171 1 1 1360 . 5 1 1 A 123 123 THR C C 123 173.531 173.846 -0.315 1 1 1361 . 5 1 1 A 123 123 THR CA C 123 62.266 61.645 0.621 1 1 1362 . 5 1 1 A 123 123 THR CB C 123 70.677 69.082 1.595 1 1 1364 . 5 1 1 A 123 123 THR N N 123 128.965 122.943 6.022 1 1 1365 . 5 1 1 A 124 124 THR H H 124 8.961 9.234 -0.273 1 1 1366 . 5 1 1 A 124 124 THR HA H 124 5.001 4.898 0.103 1 1 1371 . 5 1 1 A 124 124 THR C C 124 173.468 172.859 0.609 1 1 1372 . 5 1 1 A 124 124 THR CA C 124 62.109 61.628 0.481 1 1 1373 . 5 1 1 A 124 124 THR CB C 124 70.450 69.564 0.886 1 1 1375 . 5 1 1 A 124 124 THR N N 124 122.176 124.072 -1.896 1 1 1376 . 5 1 1 A 125 125 ARG H H 125 9.386 9.893 -0.507 1 1 1377 . 5 1 1 A 125 125 ARG HA H 125 5.764 5.099 0.665 1 1 1384 . 5 1 1 A 125 125 ARG C C 125 175.713 175.198 0.515 1 1 1385 . 5 1 1 A 125 125 ARG CA C 125 53.991 54.939 -0.948 1 1 1386 . 5 1 1 A 125 125 ARG CB C 125 33.557 31.550 2.007 1 1 1389 . 5 1 1 A 125 125 ARG N N 125 130.004 128.955 1.049 1 1 1390 . 5 1 1 A 126 126 SER H H 126 9.172 9.101 0.071 1 1 1391 . 5 1 1 A 126 126 SER HA H 126 5.390 5.516 -0.126 1 1 1394 . 5 1 1 A 126 126 SER C C 126 172.359 172.962 -0.603 1 1 1395 . 5 1 1 A 126 126 SER CA C 126 56.934 57.306 -0.372 1 1 1396 . 5 1 1 A 126 126 SER CB C 126 65.827 65.948 -0.121 1 1 1397 . 5 1 1 A 126 126 SER N N 126 119.906 121.163 -1.257 1 1 1398 . 5 1 1 A 127 127 SER H H 127 8.591 9.055 -0.464 1 1 1399 . 5 1 1 A 127 127 SER HA H 127 5.739 5.405 0.334 1 1 1401 . 5 1 1 A 127 127 SER C C 127 173.283 172.951 0.332 1 1 1402 . 5 1 1 A 127 127 SER CA C 127 57.354 57.721 -0.367 1 1 1403 . 5 1 1 A 127 127 SER CB C 127 65.412 65.109 0.303 1 1 1404 . 5 1 1 A 127 127 SER N N 127 117.914 120.381 -2.467 1 1 1405 . 5 1 1 A 128 128 TRP H H 128 9.866 9.396 0.470 1 1 1406 . 5 1 1 A 128 128 TRP HA H 128 5.560 5.601 -0.041 1 1 1415 . 5 1 1 A 128 128 TRP C C 128 175.828 175.174 0.654 1 1 1416 . 5 1 1 A 128 128 TRP CA C 128 55.852 55.690 0.162 1 1 1417 . 5 1 1 A 128 128 TRP CB C 128 32.524 34.092 -1.568 1 1 1423 . 5 1 1 A 128 128 TRP N N 128 127.978 124.912 3.066 1 1 1425 . 5 1 1 A 129 129 LYS H H 129 9.424 8.919 0.505 1 1 1426 . 5 1 1 A 129 129 LYS HA H 129 5.388 5.351 0.037 1 1 1433 . 5 1 1 A 129 129 LYS C C 129 175.254 174.483 0.771 1 1 1434 . 5 1 1 A 129 129 LYS CA C 129 54.410 54.612 -0.202 1 1 1435 . 5 1 1 A 129 129 LYS CB C 129 35.734 36.592 -0.858 1 1 1439 . 5 1 1 A 129 129 LYS N N 129 121.784 119.070 2.714 1 1 1440 . 5 1 1 A 130 130 LEU H H 130 8.933 9.316 -0.383 1 1 1441 . 5 1 1 A 130 130 LEU HA H 130 4.859 5.027 -0.168 1 1 1447 . 5 1 1 A 130 130 LEU C C 130 173.893 174.196 -0.303 1 1 1448 . 5 1 1 A 130 130 LEU CA C 130 53.848 54.271 -0.423 1 1 1449 . 5 1 1 A 130 130 LEU CB C 130 46.125 45.903 0.222 1 1 1451 . 5 1 1 A 130 130 LEU N N 130 124.543 122.296 2.247 1 1 1452 . 5 1 1 A 131 131 ALA H H 131 8.816 8.756 0.060 1 1 1453 . 5 1 1 A 131 131 ALA HA H 131 4.776 4.996 -0.220 1 1 1457 . 5 1 1 A 131 131 ALA C C 131 176.662 176.422 0.240 1 1 1458 . 5 1 1 A 131 131 ALA CA C 131 51.407 50.445 0.962 1 1 1459 . 5 1 1 A 131 131 ALA CB C 131 19.354 20.313 -0.959 1 1 1460 . 5 1 1 A 131 131 ALA N N 131 131.102 129.047 2.055 1 1 1461 . 5 1 1 A 132 132 LEU H H 132 8.487 8.640 -0.153 1 1 1462 . 5 1 1 A 132 132 LEU HA H 132 4.470 4.427 0.043 1 1 1470 . 5 1 1 A 132 132 LEU C C 132 176.873 175.819 1.054 1 1 1471 . 5 1 1 A 132 132 LEU CA C 132 54.590 55.241 -0.651 1 1 1472 . 5 1 1 A 132 132 LEU CB C 132 42.974 42.203 0.771 1 1 1475 . 5 1 1 A 132 132 LEU N N 132 123.724 124.721 -0.997 1 1 1476 . 5 1 1 A 133 133 SER H H 133 8.448 8.955 -0.507 1 1 1477 . 5 1 1 A 133 133 SER HA H 133 4.560 4.946 -0.386 1 1 1479 . 5 1 1 A 133 133 SER C C 133 176.043 173.718 2.325 1 1 1480 . 5 1 1 A 133 133 SER CA C 133 58.460 56.954 1.506 1 1 1481 . 5 1 1 A 133 133 SER CB C 133 63.985 63.938 0.047 1 1 1482 . 5 1 1 A 133 133 SER N N 133 115.880 121.361 -5.481 1 1 1483 . 5 1 1 A 134 134 GLY H H 134 8.232 9.257 -1.025 1 1 1484 . 5 1 1 A 134 134 GLY HA2 H 134 4.147 3.914 0.233 1 1 1485 . 5 1 1 A 134 134 GLY HA3 H 134 4.045 3.923 0.122 1 1 1486 . 5 1 1 A 134 134 GLY C C 134 174.013 174.963 -0.950 1 1 1487 . 5 1 1 A 134 134 GLY CA C 134 45.337 45.817 -0.480 1 1 1488 . 5 1 1 A 134 134 GLY N N 134 109.970 112.036 -2.066 1 1 1489 . 5 1 1 A 135 135 ALA H H 135 8.424 9.184 -0.760 1 1 1490 . 5 1 1 A 135 135 ALA HA H 135 4.436 4.057 0.379 1 1 1494 . 5 1 1 A 135 135 ALA C C 135 177.537 177.214 0.323 1 1 1495 . 5 1 1 A 135 135 ALA CA C 135 52.721 53.286 -0.565 1 1 1496 . 5 1 1 A 135 135 ALA CB C 135 19.265 17.757 1.508 1 1 1497 . 5 1 1 A 135 135 ALA N N 135 124.118 126.060 -1.942 1 1 1498 . 5 1 1 A 136 136 HIS H H 136 8.466 8.239 0.227 1 1 1499 . 5 1 1 A 136 136 HIS HA H 136 4.379 4.167 0.212 1 1 1500 . 5 1 1 A 136 136 HIS C C 136 176.259 174.324 1.935 1 1 1501 . 5 1 1 A 136 136 HIS CA C 136 56.082 56.769 -0.687 1 1 1502 . 5 1 1 A 136 136 HIS CB C 136 29.619 28.248 1.371 1 1 1503 . 5 1 1 A 136 136 HIS N N 136 119.493 114.065 5.428 1 1 1504 . 5 1 1 A 137 137 GLY H H 137 8.431 8.055 0.376 1 1 1505 . 5 1 1 A 137 137 GLY HA2 H 137 4.151 3.985 0.166 1 1 1506 . 5 1 1 A 137 137 GLY HA3 H 137 3.893 4.077 -0.184 1 1 1507 . 5 1 1 A 137 137 GLY C C 137 174.039 171.876 2.163 1 1 1508 . 5 1 1 A 137 137 GLY CA C 137 45.372 44.793 0.579 1 1 1509 . 5 1 1 A 137 137 GLY N N 137 110.442 109.855 0.587 1 1 1510 . 5 1 1 A 138 138 GLN H H 138 8.416 8.295 0.121 1 1 1511 . 5 1 1 A 138 138 GLN HA H 138 4.455 4.713 -0.258 1 1 1515 . 5 1 1 A 138 138 GLN C C 138 175.889 174.928 0.961 1 1 1516 . 5 1 1 A 138 138 GLN CA C 138 55.866 55.163 0.703 1 1 1517 . 5 1 1 A 138 138 GLN CB C 138 29.639 29.663 -0.024 1 1 1518 . 5 1 1 A 138 138 GLN N N 138 119.401 120.346 -0.945 1 1 1519 . 5 1 1 A 139 139 GLU H H 139 8.446 8.487 -0.041 1 1 1520 . 5 1 1 A 139 139 GLU HA H 139 4.658 4.792 -0.134 1 1 1524 . 5 1 1 A 139 139 GLU CA C 139 54.589 53.172 1.417 1 1 1525 . 5 1 1 A 139 139 GLU CB C 139 29.733 31.235 -1.502 1 1 1527 . 5 1 1 A 139 139 GLU N N 139 123.136 123.480 -0.344 1 1 1528 . 5 1 1 A 140 140 PRO HA H 140 4.537 4.440 0.097 1 1 1533 . 5 1 1 A 140 140 PRO C C 140 176.119 177.215 -1.096 1 1 1534 . 5 1 1 A 140 140 PRO CA C 140 63.220 63.061 0.159 1 1 1535 . 5 1 1 A 140 140 PRO CB C 140 31.936 31.773 0.163 1 1 1538 . 5 1 1 A 141 141 GLN H H 141 8.506 8.471 0.035 1 1 1539 . 5 1 1 A 141 141 GLN HA H 141 4.650 4.854 -0.204 1 1 1546 . 5 1 1 A 141 141 GLN C C 141 175.811 176.036 -0.225 1 1 1547 . 5 1 1 A 141 141 GLN CA C 141 55.912 55.620 0.292 1 1 1548 . 5 1 1 A 141 141 GLN CB C 141 30.241 30.446 -0.205 1 1 1550 . 5 1 1 A 141 141 GLN N N 141 120.422 120.489 -0.067 1 1 1551 . 5 1 1 A 142 142 LEU H H 142 8.842 9.283 -0.441 1 1 1552 . 5 1 1 A 142 142 LEU HA H 142 5.277 5.316 -0.039 1 1 1562 . 5 1 1 A 142 142 LEU C C 142 176.839 175.023 1.816 1 1 1563 . 5 1 1 A 142 142 LEU CA C 142 53.927 53.050 0.877 1 1 1564 . 5 1 1 A 142 142 LEU CB C 142 44.527 46.348 -1.821 1 1 1568 . 5 1 1 A 142 142 LEU N N 142 123.692 119.217 4.475 1 1 1569 . 5 1 1 A 143 143 THR H H 143 9.025 9.235 -0.210 1 1 1570 . 5 1 1 A 143 143 THR HA H 143 5.262 5.141 0.121 1 1 1575 . 5 1 1 A 143 143 THR C C 143 173.753 173.595 0.158 1 1 1576 . 5 1 1 A 143 143 THR CA C 143 61.795 61.745 0.050 1 1 1577 . 5 1 1 A 143 143 THR CB C 143 70.660 71.001 -0.341 1 1 1579 . 5 1 1 A 143 143 THR N N 143 117.222 115.807 1.415 1 1 1580 . 5 1 1 A 144 144 ILE H H 144 9.353 9.927 -0.574 1 1 1581 . 5 1 1 A 144 144 ILE HA H 144 5.399 5.194 0.205 1 1 1591 . 5 1 1 A 144 144 ILE C C 144 173.931 173.937 -0.006 1 1 1592 . 5 1 1 A 144 144 ILE CA C 144 60.774 60.344 0.430 1 1 1593 . 5 1 1 A 144 144 ILE CB C 144 41.111 41.161 -0.050 1 1 1597 . 5 1 1 A 144 144 ILE N N 144 126.383 126.051 0.332 1 1 1598 . 5 1 1 A 145 145 ASP H H 145 9.214 9.272 -0.058 1 1 1599 . 5 1 1 A 145 145 ASP HA H 145 5.978 5.425 0.553 1 1 1601 . 5 1 1 A 145 145 ASP C C 145 175.441 174.914 0.527 1 1 1602 . 5 1 1 A 145 145 ASP CA C 145 53.035 52.832 0.203 1 1 1603 . 5 1 1 A 145 145 ASP CB C 145 44.153 43.669 0.484 1 1 1604 . 5 1 1 A 145 145 ASP N N 145 127.981 128.341 -0.360 1 1 1605 . 5 1 1 A 146 146 LEU H H 146 9.387 9.759 -0.372 1 1 1606 . 5 1 1 A 146 146 LEU HA H 146 4.918 5.251 -0.333 1 1 1616 . 5 1 1 A 146 146 LEU C C 146 175.003 174.746 0.257 1 1 1617 . 5 1 1 A 146 146 LEU CA C 146 53.940 53.597 0.343 1 1 1618 . 5 1 1 A 146 146 LEU CB C 146 43.902 43.105 0.797 1 1 1622 . 5 1 1 A 146 146 LEU N N 146 123.532 127.871 -4.339 1 1 1623 . 5 1 1 A 147 147 ASP H H 147 8.676 9.150 -0.474 1 1 1624 . 5 1 1 A 147 147 ASP HA H 147 5.205 5.326 -0.121 1 1 1627 . 5 1 1 A 147 147 ASP C C 147 174.956 174.575 0.381 1 1 1628 . 5 1 1 A 147 147 ASP CA C 147 53.441 52.493 0.948 1 1 1629 . 5 1 1 A 147 147 ASP CB C 147 43.370 43.473 -0.103 1 1 1630 . 5 1 1 A 147 147 ASP N N 147 125.499 126.367 -0.868 1 1 1631 . 5 1 1 A 148 148 SER H H 148 8.732 9.243 -0.511 1 1 1632 . 5 1 1 A 148 148 SER HA H 148 5.365 5.344 0.021 1 1 1634 . 5 1 1 A 148 148 SER C C 148 173.217 173.519 -0.302 1 1 1635 . 5 1 1 A 148 148 SER CA C 148 56.334 55.607 0.727 1 1 1636 . 5 1 1 A 148 148 SER CB C 148 65.812 66.442 -0.630 1 1 1637 . 5 1 1 A 148 148 SER N N 148 118.623 119.368 -0.745 1 1 1638 . 5 1 1 A 149 149 ALA H H 149 8.937 8.945 -0.008 1 1 1639 . 5 1 1 A 149 149 ALA HA H 149 5.681 5.291 0.390 1 1 1643 . 5 1 1 A 149 149 ALA C C 149 178.894 177.537 1.357 1 1 1644 . 5 1 1 A 149 149 ALA CA C 149 49.996 50.235 -0.239 1 1 1645 . 5 1 1 A 149 149 ALA CB C 149 23.231 22.483 0.748 1 1 1646 . 5 1 1 A 149 149 ALA N N 149 123.952 122.054 1.898 1 1 1647 . 5 1 1 A 150 150 ASP H H 150 9.010 8.895 0.115 1 1 1648 . 5 1 1 A 150 150 ASP HA H 150 4.336 4.481 -0.145 1 1 1651 . 5 1 1 A 150 150 ASP C C 150 176.697 177.297 -0.600 1 1 1652 . 5 1 1 A 150 150 ASP CA C 150 56.543 56.115 0.428 1 1 1653 . 5 1 1 A 150 150 ASP CB C 150 39.850 40.897 -1.047 1 1 1654 . 5 1 1 A 150 150 ASP N N 150 122.687 122.346 0.341 1 1 1655 . 5 1 1 A 151 151 PHE H H 151 7.295 8.114 -0.819 1 1 1656 . 5 1 1 A 151 151 PHE HA H 151 5.020 4.584 0.436 1 1 1661 . 5 1 1 A 151 151 PHE C C 151 174.756 175.825 -1.069 1 1 1662 . 5 1 1 A 151 151 PHE CA C 151 56.594 60.820 -4.226 1 1 1663 . 5 1 1 A 151 151 PHE CB C 151 37.765 39.678 -1.913 1 1 1666 . 5 1 1 A 151 151 PHE N N 151 113.928 120.951 -7.023 1 1 1667 . 5 1 1 A 152 152 GLY H H 152 7.786 8.257 -0.471 1 1 1668 . 5 1 1 A 152 152 GLY HA2 H 152 4.459 3.934 0.525 1 1 1669 . 5 1 1 A 152 152 GLY HA3 H 152 3.728 3.991 -0.263 1 1 1670 . 5 1 1 A 152 152 GLY C C 152 172.709 173.282 -0.573 1 1 1671 . 5 1 1 A 152 152 GLY CA C 152 46.106 45.562 0.544 1 1 1672 . 5 1 1 A 152 152 GLY N N 152 110.312 107.169 3.143 1 1 1673 . 5 1 1 A 153 153 TYR H H 153 6.650 7.234 -0.584 1 1 1674 . 5 1 1 A 153 153 TYR HA H 153 4.508 4.927 -0.419 1 1 1679 . 5 1 1 A 153 153 TYR C C 153 173.092 173.230 -0.138 1 1 1680 . 5 1 1 A 153 153 TYR CA C 153 57.464 57.524 -0.060 1 1 1681 . 5 1 1 A 153 153 TYR CB C 153 41.962 42.343 -0.381 1 1 1684 . 5 1 1 A 153 153 TYR N N 153 121.977 119.432 2.545 1 1 1685 . 5 1 1 A 154 154 ALA H H 154 7.847 8.213 -0.366 1 1 1686 . 5 1 1 A 154 154 ALA HA H 154 5.144 4.812 0.332 1 1 1690 . 5 1 1 A 154 154 ALA C C 154 174.468 174.315 0.153 1 1 1691 . 5 1 1 A 154 154 ALA CA C 154 51.776 50.278 1.498 1 1 1692 . 5 1 1 A 154 154 ALA CB C 154 21.747 22.116 -0.369 1 1 1693 . 5 1 1 A 154 154 ALA N N 154 130.258 129.696 0.562 1 1 1694 . 5 1 1 A 155 155 VAL H H 155 8.733 8.988 -0.255 1 1 1695 . 5 1 1 A 155 155 VAL HA H 155 4.150 4.498 -0.348 1 1 1700 . 5 1 1 A 155 155 VAL C C 155 172.632 174.098 -1.466 1 1 1701 . 5 1 1 A 155 155 VAL CA C 155 61.451 59.607 1.844 1 1 1702 . 5 1 1 A 155 155 VAL CB C 155 35.883 33.963 1.920 1 1 1704 . 5 1 1 A 155 155 VAL N N 155 119.622 122.289 -2.667 1 1 1705 . 5 1 1 A 156 156 GLY H H 156 8.146 8.381 -0.235 1 1 1706 . 5 1 1 A 156 156 GLY HA2 H 156 5.125 2.845 2.280 1 1 1707 . 5 1 1 A 156 156 GLY HA3 H 156 2.061 3.962 -1.901 1 1 1708 . 5 1 1 A 156 156 GLY C C 156 171.746 172.125 -0.379 1 1 1709 . 5 1 1 A 156 156 GLY CA C 156 43.319 43.390 -0.071 1 1 1710 . 5 1 1 A 156 156 GLY N N 156 113.332 114.036 -0.704 1 1 1711 . 5 1 1 A 157 157 GLU H H 157 8.967 8.417 0.550 1 1 1712 . 5 1 1 A 157 157 GLU HA H 157 5.217 5.123 0.094 1 1 1716 . 5 1 1 A 157 157 GLU C C 157 174.476 175.281 -0.805 1 1 1717 . 5 1 1 A 157 157 GLU CA C 157 55.390 54.722 0.668 1 1 1718 . 5 1 1 A 157 157 GLU CB C 157 34.010 34.316 -0.306 1 1 1720 . 5 1 1 A 157 157 GLU N N 157 120.823 122.362 -1.539 1 1 1721 . 5 1 1 A 158 158 VAL H H 158 9.076 9.007 0.069 1 1 1722 . 5 1 1 A 158 158 VAL HA H 158 5.206 5.132 0.074 1 1 1727 . 5 1 1 A 158 158 VAL C C 158 173.900 174.423 -0.523 1 1 1728 . 5 1 1 A 158 158 VAL CA C 158 60.813 61.347 -0.534 1 1 1729 . 5 1 1 A 158 158 VAL CB C 158 33.385 34.554 -1.169 1 1 1731 . 5 1 1 A 158 158 VAL N N 158 124.349 122.012 2.337 1 1 1732 . 5 1 1 A 159 159 GLU H H 159 9.239 9.613 -0.374 1 1 1733 . 5 1 1 A 159 159 GLU HA H 159 5.647 5.514 0.133 1 1 1738 . 5 1 1 A 159 159 GLU C C 159 174.469 174.790 -0.321 1 1 1739 . 5 1 1 A 159 159 GLU CA C 159 54.473 54.630 -0.157 1 1 1740 . 5 1 1 A 159 159 GLU CB C 159 33.852 32.822 1.030 1 1 1742 . 5 1 1 A 159 159 GLU N N 159 125.772 129.090 -3.318 1 1 1743 . 5 1 1 A 160 160 ALA H H 160 9.250 9.266 -0.016 1 1 1744 . 5 1 1 A 160 160 ALA HA H 160 4.966 5.502 -0.536 1 1 1748 . 5 1 1 A 160 160 ALA C C 160 175.114 175.692 -0.578 1 1 1749 . 5 1 1 A 160 160 ALA CA C 160 50.644 50.067 0.577 1 1 1750 . 5 1 1 A 160 160 ALA CB C 160 23.263 22.130 1.133 1 1 1751 . 5 1 1 A 160 160 ALA N N 160 125.092 129.946 -4.854 1 1 1752 . 5 1 1 A 161 161 MET H H 161 8.559 8.547 0.012 1 1 1753 . 5 1 1 A 161 161 MET HA H 161 5.468 6.007 -0.539 1 1 1761 . 5 1 1 A 161 161 MET C C 161 176.265 174.338 1.927 1 1 1762 . 5 1 1 A 161 161 MET CA C 161 53.818 53.949 -0.131 1 1 1763 . 5 1 1 A 161 161 MET CB C 161 34.380 34.475 -0.095 1 1 1766 . 5 1 1 A 161 161 MET N N 161 118.699 120.633 -1.934 1 1 1767 . 5 1 1 A 162 162 VAL H H 162 9.046 8.758 0.288 1 1 1768 . 5 1 1 A 162 162 VAL HA H 162 4.841 4.959 -0.118 1 1 1776 . 5 1 1 A 162 162 VAL C C 162 174.794 175.871 -1.077 1 1 1777 . 5 1 1 A 162 162 VAL CA C 162 59.107 59.523 -0.416 1 1 1778 . 5 1 1 A 162 162 VAL CB C 162 34.018 34.348 -0.330 1 1 1781 . 5 1 1 A 162 162 VAL N N 162 116.435 124.833 -8.398 1 1 1782 . 5 1 1 A 163 163 HIS H H 163 8.793 8.671 0.122 1 1 1783 . 5 1 1 A 163 163 HIS HA H 163 4.717 4.900 -0.183 1 1 1787 . 5 1 1 A 163 163 HIS C C 163 175.460 174.731 0.729 1 1 1788 . 5 1 1 A 163 163 HIS CA C 163 58.488 57.724 0.764 1 1 1789 . 5 1 1 A 163 163 HIS CB C 163 31.185 31.177 0.008 1 1 1791 . 5 1 1 A 163 163 HIS N N 163 117.838 125.935 -8.097 1 1 1792 . 5 1 1 A 164 164 GLU H H 164 8.013 7.910 0.103 1 1 1793 . 5 1 1 A 164 164 GLU HA H 164 4.814 4.447 0.367 1 1 1797 . 5 1 1 A 164 164 GLU C C 164 176.910 176.177 0.733 1 1 1798 . 5 1 1 A 164 164 GLU CA C 164 54.355 55.390 -1.035 1 1 1799 . 5 1 1 A 164 164 GLU CB C 164 32.886 30.001 2.885 1 1 1801 . 5 1 1 A 164 164 GLU N N 164 115.943 116.197 -0.254 1 1 1802 . 5 1 1 A 165 165 LYS H H 165 9.088 8.783 0.305 1 1 1803 . 5 1 1 A 165 165 LYS HA H 165 3.942 3.922 0.020 1 1 1809 . 5 1 1 A 165 165 LYS C C 165 179.657 178.048 1.609 1 1 1810 . 5 1 1 A 165 165 LYS CA C 165 59.888 58.531 1.357 1 1 1811 . 5 1 1 A 165 165 LYS CB C 165 32.024 32.188 -0.164 1 1 1814 . 5 1 1 A 165 165 LYS N N 165 124.120 125.411 -1.291 1 1 1815 . 5 1 1 A 166 166 ALA H H 166 8.851 7.977 0.874 1 1 1816 . 5 1 1 A 166 166 ALA HA H 166 4.251 3.999 0.252 1 1 1820 . 5 1 1 A 166 166 ALA C C 166 178.920 179.007 -0.087 1 1 1821 . 5 1 1 A 166 166 ALA CA C 166 54.318 54.874 -0.556 1 1 1822 . 5 1 1 A 166 166 ALA CB C 166 18.810 18.811 -0.001 1 1 1823 . 5 1 1 A 166 166 ALA N N 166 120.424 121.672 -1.248 1 1 1824 . 5 1 1 A 167 167 GLU H H 167 7.871 7.888 -0.017 1 1 1825 . 5 1 1 A 167 167 GLU HA H 167 4.404 4.474 -0.070 1 1 1829 . 5 1 1 A 167 167 GLU C C 167 177.368 176.980 0.388 1 1 1830 . 5 1 1 A 167 167 GLU CA C 167 56.701 56.622 0.079 1 1 1831 . 5 1 1 A 167 167 GLU CB C 167 31.208 30.314 0.894 1 1 1833 . 5 1 1 A 167 167 GLU N N 167 114.926 115.812 -0.886 1 1 1834 . 5 1 1 A 168 168 VAL H H 168 7.812 7.617 0.195 1 1 1835 . 5 1 1 A 168 168 VAL HA H 168 3.712 3.688 0.024 1 1 1843 . 5 1 1 A 168 168 VAL CA C 168 68.705 67.874 0.831 1 1 1844 . 5 1 1 A 168 168 VAL CB C 168 29.597 29.797 -0.200 1 1 1847 . 5 1 1 A 168 168 VAL N N 168 120.188 122.393 -2.205 1 1 1848 . 5 1 1 A 169 169 PRO HA H 169 4.252 4.240 0.012 1 1 1851 . 5 1 1 A 169 169 PRO C C 169 179.563 178.626 0.937 1 1 1852 . 5 1 1 A 169 169 PRO CA C 169 67.077 66.909 0.168 1 1 1853 . 5 1 1 A 170 170 ALA H H 170 8.149 8.207 -0.058 1 1 1854 . 5 1 1 A 170 170 ALA HA H 170 4.265 4.035 0.230 1 1 1858 . 5 1 1 A 170 170 ALA C C 170 180.637 179.720 0.917 1 1 1859 . 5 1 1 A 170 170 ALA CA C 170 54.823 55.311 -0.488 1 1 1860 . 5 1 1 A 170 170 ALA CB C 170 18.518 17.967 0.551 1 1 1861 . 5 1 1 A 170 170 ALA N N 170 119.210 119.164 0.046 1 1 1862 . 5 1 1 A 171 171 ALA H H 171 7.767 8.665 -0.898 1 1 1863 . 5 1 1 A 171 171 ALA HA H 171 4.106 4.107 -0.001 1 1 1867 . 5 1 1 A 171 171 ALA C C 171 179.371 179.820 -0.449 1 1 1868 . 5 1 1 A 171 171 ALA CA C 171 55.130 55.053 0.077 1 1 1869 . 5 1 1 A 171 171 ALA CB C 171 18.291 17.948 0.343 1 1 1870 . 5 1 1 A 171 171 ALA N N 171 122.126 120.952 1.174 1 1 1871 . 5 1 1 A 172 172 LEU H H 172 8.950 8.094 0.856 1 1 1872 . 5 1 1 A 172 172 LEU HA H 172 3.987 4.073 -0.086 1 1 1878 . 5 1 1 A 172 172 LEU C C 172 178.355 178.290 0.065 1 1 1879 . 5 1 1 A 172 172 LEU CA C 172 57.803 57.568 0.235 1 1 1880 . 5 1 1 A 172 172 LEU CB C 172 41.667 42.026 -0.359 1 1 1882 . 5 1 1 A 172 172 LEU N N 172 118.682 120.361 -1.679 1 1 1883 . 5 1 1 A 173 173 GLU H H 173 7.886 8.134 -0.248 1 1 1884 . 5 1 1 A 173 173 GLU HA H 173 4.132 3.987 0.145 1 1 1887 . 5 1 1 A 173 173 GLU C C 173 179.556 178.709 0.847 1 1 1888 . 5 1 1 A 173 173 GLU CA C 173 59.800 59.221 0.579 1 1 1889 . 5 1 1 A 173 173 GLU CB C 173 29.580 29.257 0.323 1 1 1891 . 5 1 1 A 173 173 GLU N N 173 117.561 118.569 -1.008 1 1 1892 . 5 1 1 A 174 174 LYS H H 174 7.532 8.337 -0.805 1 1 1893 . 5 1 1 A 174 174 LYS HA H 174 4.131 4.104 0.027 1 1 1901 . 5 1 1 A 174 174 LYS CA C 174 58.999 58.889 0.110 1 1 1902 . 5 1 1 A 174 174 LYS CB C 174 32.041 32.315 -0.274 1 1 1906 . 5 1 1 A 174 174 LYS N N 174 119.085 119.426 -0.341 1 1 1907 . 5 1 1 A 175 175 ILE H H 175 8.479 7.819 0.660 1 1 1908 . 5 1 1 A 175 175 ILE HA H 175 3.583 3.582 0.001 1 1 1918 . 5 1 1 A 175 175 ILE C C 175 179.258 178.387 0.871 1 1 1919 . 5 1 1 A 175 175 ILE CA C 175 65.769 65.600 0.169 1 1 1920 . 5 1 1 A 175 175 ILE CB C 175 37.876 38.033 -0.157 1 1 1923 . 5 1 1 A 175 175 ILE N N 175 118.828 119.592 -0.764 1 1 1924 . 5 1 1 A 176 176 ILE H H 176 8.928 7.830 1.098 1 1 1925 . 5 1 1 A 176 176 ILE HA H 176 3.600 3.575 0.025 1 1 1935 . 5 1 1 A 176 176 ILE C C 176 178.827 178.075 0.752 1 1 1936 . 5 1 1 A 176 176 ILE CA C 176 65.640 65.053 0.587 1 1 1937 . 5 1 1 A 176 176 ILE CB C 176 37.451 37.523 -0.072 1 1 1941 . 5 1 1 A 176 176 ILE N N 176 124.527 119.695 4.832 1 1 1942 . 5 1 1 A 177 177 THR H H 177 8.175 8.259 -0.084 1 1 1943 . 5 1 1 A 177 177 THR HA H 177 3.885 3.950 -0.065 1 1 1948 . 5 1 1 A 177 177 THR C C 177 176.867 176.387 0.480 1 1 1949 . 5 1 1 A 177 177 THR CA C 177 67.199 66.385 0.814 1 1 1950 . 5 1 1 A 177 177 THR CB C 177 68.377 68.854 -0.477 1 1 1952 . 5 1 1 A 177 177 THR N N 177 119.412 118.765 0.647 1 1 1953 . 5 1 1 A 178 178 VAL H H 178 8.352 8.092 0.260 1 1 1954 . 5 1 1 A 178 178 VAL HA H 178 3.572 3.425 0.147 1 1 1962 . 5 1 1 A 178 178 VAL C C 178 177.664 177.793 -0.129 1 1 1963 . 5 1 1 A 178 178 VAL CA C 178 66.909 66.286 0.623 1 1 1964 . 5 1 1 A 178 178 VAL CB C 178 31.714 31.321 0.393 1 1 1967 . 5 1 1 A 178 178 VAL N N 178 121.168 121.739 -0.571 1 1 1968 . 5 1 1 A 179 179 SER H H 179 8.529 8.257 0.272 1 1 1969 . 5 1 1 A 179 179 SER HA H 179 3.099 3.522 -0.423 1 1 1972 . 5 1 1 A 179 179 SER C C 179 175.380 176.391 -1.011 1 1 1973 . 5 1 1 A 179 179 SER CA C 179 62.728 61.659 1.069 1 1 1974 . 5 1 1 A 179 179 SER CB C 179 62.802 62.600 0.202 1 1 1975 . 5 1 1 A 179 179 SER N N 179 115.226 115.447 -0.221 1 1 1976 . 5 1 1 A 180 180 SER H H 180 7.757 8.045 -0.288 1 1 1977 . 5 1 1 A 180 180 SER HA H 180 4.419 4.117 0.302 1 1 1980 . 5 1 1 A 180 180 SER C C 180 175.359 176.849 -1.490 1 1 1981 . 5 1 1 A 180 180 SER CA C 180 61.025 61.437 -0.412 1 1 1982 . 5 1 1 A 180 180 SER CB C 180 63.072 63.045 0.027 1 1 1983 . 5 1 1 A 180 180 SER N N 180 114.718 115.921 -1.203 1 1 1984 . 5 1 1 A 181 181 MET H H 181 7.497 7.727 -0.230 1 1 1985 . 5 1 1 A 181 181 MET HA H 181 4.283 4.238 0.045 1 1 1993 . 5 1 1 A 181 181 MET C C 181 177.217 177.190 0.027 1 1 1994 . 5 1 1 A 181 181 MET CA C 181 57.539 57.852 -0.313 1 1 1995 . 5 1 1 A 181 181 MET CB C 181 33.493 32.507 0.986 1 1 1998 . 5 1 1 A 181 181 MET N N 181 119.274 120.642 -1.368 1 1 1999 . 5 1 1 A 182 182 LEU H H 182 7.163 7.503 -0.340 1 1 2000 . 5 1 1 A 182 182 LEU HA H 182 4.133 4.342 -0.209 1 1 2010 . 5 1 1 A 182 182 LEU C C 182 176.289 176.687 -0.398 1 1 2011 . 5 1 1 A 182 182 LEU CA C 182 54.750 54.768 -0.018 1 1 2012 . 5 1 1 A 182 182 LEU CB C 182 43.235 42.504 0.731 1 1 2016 . 5 1 1 A 182 182 LEU N N 182 115.869 117.726 -1.857 1 1 2017 . 5 1 1 A 183 183 GLY H H 183 7.492 7.168 0.324 1 1 2018 . 5 1 1 A 183 183 GLY HA2 H 183 4.086 4.152 -0.066 1 1 2019 . 5 1 1 A 183 183 GLY HA3 H 183 4.425 4.184 0.241 1 1 2020 . 5 1 1 A 183 183 GLY C C 183 171.830 172.310 -0.480 1 1 2021 . 5 1 1 A 183 183 GLY CA C 183 46.035 45.765 0.270 1 1 2022 . 5 1 1 A 183 183 GLY N N 183 107.761 105.890 1.871 1 1 2023 . 5 1 1 A 184 184 VAL H H 184 8.099 8.297 -0.198 1 1 2024 . 5 1 1 A 184 184 VAL HA H 184 4.772 4.731 0.041 1 1 2032 . 5 1 1 A 184 184 VAL CA C 184 59.305 58.760 0.545 1 1 2033 . 5 1 1 A 184 184 VAL CB C 184 33.648 34.792 -1.144 1 1 2036 . 5 1 1 A 184 184 VAL N N 184 119.803 122.907 -3.104 1 1 2037 . 5 1 1 A 185 185 PRO HA H 185 4.442 4.938 -0.496 1 1 2042 . 5 1 1 A 185 185 PRO C C 185 175.871 176.296 -0.425 1 1 2043 . 5 1 1 A 185 185 PRO CA C 185 63.886 62.572 1.314 1 1 2044 . 5 1 1 A 185 185 PRO CB C 185 32.260 32.659 -0.399 1 1 2047 . 5 1 1 A 186 186 ALA H H 186 8.222 8.528 -0.306 1 1 2048 . 5 1 1 A 186 186 ALA HA H 186 4.569 4.997 -0.428 1 1 2052 . 5 1 1 A 186 186 ALA C C 186 177.481 176.221 1.260 1 1 2053 . 5 1 1 A 186 186 ALA CA C 186 51.823 50.782 1.041 1 1 2054 . 5 1 1 A 186 186 ALA CB C 186 20.233 22.513 -2.280 1 1 2055 . 5 1 1 A 186 186 ALA N N 186 125.663 120.617 5.046 1 1 2056 . 5 1 1 A 187 187 GLN H H 187 8.723 8.433 0.290 1 1 2057 . 5 1 1 A 187 187 GLN HA H 187 4.420 4.820 -0.400 1 1 2063 . 5 1 1 A 187 187 GLN C C 187 175.566 175.650 -0.084 1 1 2064 . 5 1 1 A 187 187 GLN CA C 187 56.051 53.649 2.402 1 1 2065 . 5 1 1 A 187 187 GLN CB C 187 29.812 30.648 -0.836 1 1 2067 . 5 1 1 A 187 187 GLN N N 187 120.742 115.873 4.869 1 1 2069 . 5 1 1 A 188 188 GLU H H 188 8.163 8.736 -0.573 1 1 2070 . 5 1 1 A 188 188 GLU HA H 188 4.405 4.552 -0.147 1 1 2074 . 5 1 1 A 188 188 GLU C C 188 176.058 177.036 -0.978 1 1 2075 . 5 1 1 A 188 188 GLU CA C 188 56.158 55.773 0.385 1 1 2076 . 5 1 1 A 188 188 GLU CB C 188 31.095 29.828 1.267 1 1 2078 . 5 1 1 A 188 188 GLU N N 188 119.177 120.600 -1.423 1 1 2079 . 5 1 1 A 189 189 GLU H H 189 8.567 7.836 0.731 1 1 2080 . 5 1 1 A 189 189 GLU HA H 189 4.252 4.276 -0.024 1 1 2084 . 5 1 1 A 189 189 GLU C C 189 175.703 176.073 -0.370 1 1 2085 . 5 1 1 A 189 189 GLU CA C 189 56.417 57.534 -1.117 1 1 2086 . 5 1 1 A 189 189 GLU CB C 189 29.968 30.688 -0.720 1 1 2088 . 5 1 1 A 189 189 GLU N N 189 120.920 118.578 2.342 1 1 2089 . 5 1 1 A 190 190 ALA H H 190 8.271 7.980 0.291 1 1 2090 . 5 1 1 A 190 190 ALA HA H 190 4.626 4.090 0.536 1 1 2094 . 5 1 1 A 190 190 ALA CA C 190 50.465 52.666 -2.201 1 1 2095 . 5 1 1 A 190 190 ALA CB C 190 18.451 17.833 0.618 1 1 2096 . 5 1 1 A 190 190 ALA N N 190 128.323 120.430 7.893 1 1 2097 . 5 1 1 A 191 191 PRO HA H 191 4.493 4.722 -0.229 1 1 2103 . 5 1 1 A 191 191 PRO C C 191 175.899 176.785 -0.886 1 1 2104 . 5 1 1 A 191 191 PRO CA C 191 62.044 62.349 -0.305 1 1 2105 . 5 1 1 A 191 191 PRO CB C 191 32.184 31.737 0.447 1 1 2108 . 5 1 1 A 192 192 ALA H H 192 8.610 8.317 0.293 1 1 2109 . 5 1 1 A 192 192 ALA HA H 192 4.280 4.438 -0.158 1 1 2113 . 5 1 1 A 192 192 ALA C C 192 178.282 178.268 0.014 1 1 2114 . 5 1 1 A 192 192 ALA CA C 192 51.698 52.102 -0.404 1 1 2115 . 5 1 1 A 192 192 ALA CB C 192 19.220 19.541 -0.321 1 1 2116 . 5 1 1 A 192 192 ALA N N 192 123.420 124.023 -0.603 1 1 2117 . 5 1 1 A 193 193 LYS H H 193 8.531 9.007 -0.476 1 1 2118 . 5 1 1 A 193 193 LYS HA H 193 3.294 3.926 -0.632 1 1 2126 . 5 1 1 A 193 193 LYS C C 193 177.640 178.856 -1.216 1 1 2127 . 5 1 1 A 193 193 LYS CA C 193 60.644 59.517 1.127 1 1 2128 . 5 1 1 A 193 193 LYS CB C 193 32.607 32.355 0.252 1 1 2132 . 5 1 1 A 193 193 LYS N N 193 122.851 121.320 1.531 1 1 2133 . 5 1 1 A 194 194 LEU H H 194 8.570 7.848 0.722 1 1 2134 . 5 1 1 A 194 194 LEU HA H 194 3.845 3.948 -0.103 1 1 2144 . 5 1 1 A 194 194 LEU C C 194 177.965 178.594 -0.629 1 1 2145 . 5 1 1 A 194 194 LEU CA C 194 57.611 57.111 0.500 1 1 2146 . 5 1 1 A 194 194 LEU CB C 194 41.776 40.581 1.195 1 1 2150 . 5 1 1 A 194 194 LEU N N 194 115.801 121.516 -5.715 1 1 2151 . 5 1 1 A 195 195 MET H H 195 6.782 7.892 -1.110 1 1 2152 . 5 1 1 A 195 195 MET HA H 195 4.487 4.215 0.272 1 1 2160 . 5 1 1 A 195 195 MET C C 195 178.280 178.003 0.277 1 1 2161 . 5 1 1 A 195 195 MET CA C 195 56.858 58.252 -1.394 1 1 2162 . 5 1 1 A 195 195 MET CB C 195 31.557 32.059 -0.502 1 1 2165 . 5 1 1 A 195 195 MET N N 195 113.898 119.376 -5.478 1 1 2166 . 5 1 1 A 196 196 VAL H H 196 7.713 8.277 -0.564 1 1 2167 . 5 1 1 A 196 196 VAL HA H 196 3.501 3.287 0.214 1 1 2175 . 5 1 1 A 196 196 VAL C C 196 177.624 177.854 -0.230 1 1 2176 . 5 1 1 A 196 196 VAL CA C 196 66.318 66.140 0.178 1 1 2177 . 5 1 1 A 196 196 VAL CB C 196 31.380 31.156 0.224 1 1 2180 . 5 1 1 A 196 196 VAL N N 196 120.413 119.512 0.901 1 1 2181 . 5 1 1 A 197 197 TYR H H 197 7.972 8.181 -0.209 1 1 2182 . 5 1 1 A 197 197 TYR HA H 197 3.145 3.770 -0.625 1 1 2187 . 5 1 1 A 197 197 TYR C C 197 177.726 176.811 0.915 1 1 2188 . 5 1 1 A 197 197 TYR CA C 197 62.253 61.508 0.745 1 1 2189 . 5 1 1 A 197 197 TYR CB C 197 37.314 38.198 -0.884 1 1 2192 . 5 1 1 A 197 197 TYR N N 197 119.543 121.037 -1.494 1 1 2193 . 5 1 1 A 198 198 LEU H H 198 8.630 8.162 0.468 1 1 2194 . 5 1 1 A 198 198 LEU HA H 198 3.923 3.711 0.212 1 1 2203 . 5 1 1 A 198 198 LEU C C 198 178.074 179.086 -1.012 1 1 2204 . 5 1 1 A 198 198 LEU CA C 198 58.294 58.000 0.294 1 1 2205 . 5 1 1 A 198 198 LEU CB C 198 42.177 41.315 0.862 1 1 2209 . 5 1 1 A 198 198 LEU N N 198 118.430 120.016 -1.586 1 1 2210 . 5 1 1 A 199 199 GLN H H 199 8.082 8.280 -0.198 1 1 2211 . 5 1 1 A 199 199 GLN HA H 199 3.054 3.636 -0.582 1 1 2216 . 5 1 1 A 199 199 GLN C C 199 176.875 177.961 -1.086 1 1 2217 . 5 1 1 A 199 199 GLN CA C 199 59.739 59.052 0.687 1 1 2218 . 5 1 1 A 199 199 GLN CB C 199 28.055 27.708 0.347 1 1 2220 . 5 1 1 A 199 199 GLN N N 199 117.926 116.916 1.010 1 1 2222 . 5 1 1 A 200 200 ARG H H 200 7.349 7.834 -0.485 1 1 2223 . 5 1 1 A 200 200 ARG HA H 200 3.798 3.860 -0.062 1 1 2231 . 5 1 1 A 200 200 ARG C C 200 178.037 177.775 0.262 1 1 2232 . 5 1 1 A 200 200 ARG CA C 200 58.260 58.784 -0.524 1 1 2233 . 5 1 1 A 200 200 ARG CB C 200 30.706 30.281 0.425 1 1 2236 . 5 1 1 A 200 200 ARG N N 200 113.772 119.537 -5.765 1 1 2238 . 5 1 1 A 201 201 PHE H H 201 8.329 7.647 0.682 1 1 2239 . 5 1 1 A 201 201 PHE HA H 201 4.630 4.573 0.057 1 1 2244 . 5 1 1 A 201 201 PHE C C 201 176.606 175.951 0.655 1 1 2245 . 5 1 1 A 201 201 PHE CA C 201 59.014 57.965 1.049 1 1 2246 . 5 1 1 A 201 201 PHE CB C 201 40.357 40.136 0.221 1 1 2249 . 5 1 1 A 201 201 PHE N N 201 114.182 115.738 -1.556 1 1 2250 . 5 1 1 A 202 202 ARG H H 202 8.719 8.140 0.579 1 1 2251 . 5 1 1 A 202 202 ARG HA H 202 5.071 4.713 0.358 1 1 2261 . 5 1 1 A 202 202 ARG CA C 202 53.956 53.464 0.492 1 1 2262 . 5 1 1 A 202 202 ARG CB C 202 31.979 30.163 1.816 1 1 2264 . 5 1 1 A 202 202 ARG N N 202 120.115 114.772 5.343 1 1 2266 . 5 1 1 A 203 203 PRO HA H 203 4.348 4.522 -0.174 1 1 2271 . 5 1 1 A 203 203 PRO C C 203 179.736 178.194 1.542 1 1 2272 . 5 1 1 A 203 203 PRO CA C 203 65.674 65.295 0.379 1 1 2273 . 5 1 1 A 203 203 PRO CB C 203 31.717 32.119 -0.402 1 1 2275 . 5 1 1 A 204 204 LEU H H 204 8.875 7.620 1.255 1 1 2276 . 5 1 1 A 204 204 LEU HA H 204 4.291 4.025 0.266 1 1 2286 . 5 1 1 A 204 204 LEU C C 204 180.353 178.026 2.327 1 1 2287 . 5 1 1 A 204 204 LEU CA C 204 58.012 57.093 0.919 1 1 2288 . 5 1 1 A 204 204 LEU CB C 204 40.893 42.169 -1.276 1 1 2292 . 5 1 1 A 204 204 LEU N N 204 118.940 116.862 2.078 1 1 2293 . 5 1 1 A 205 205 ASP H H 205 7.541 8.355 -0.814 1 1 2294 . 5 1 1 A 205 205 ASP HA H 205 4.622 4.322 0.300 1 1 2297 . 5 1 1 A 205 205 ASP C C 205 177.602 177.856 -0.254 1 1 2298 . 5 1 1 A 205 205 ASP CA C 205 57.437 57.492 -0.055 1 1 2299 . 5 1 1 A 205 205 ASP CB C 205 41.143 41.146 -0.003 1 1 2300 . 5 1 1 A 205 205 ASP N N 205 120.838 119.599 1.239 1 1 2301 . 5 1 1 A 206 206 TYR H H 206 8.237 8.330 -0.093 1 1 2302 . 5 1 1 A 206 206 TYR HA H 206 4.018 4.061 -0.043 1 1 2307 . 5 1 1 A 206 206 TYR C C 206 176.433 178.423 -1.990 1 1 2308 . 5 1 1 A 206 206 TYR CA C 206 62.148 62.743 -0.595 1 1 2309 . 5 1 1 A 206 206 TYR CB C 206 38.305 38.683 -0.378 1 1 2312 . 5 1 1 A 206 206 TYR N N 206 119.475 120.591 -1.116 1 1 2313 . 5 1 1 A 207 207 GLN H H 207 8.124 7.969 0.155 1 1 2314 . 5 1 1 A 207 207 GLN HA H 207 3.823 3.213 0.610 1 1 2320 . 5 1 1 A 207 207 GLN C C 207 178.019 178.618 -0.599 1 1 2321 . 5 1 1 A 207 207 GLN CA C 207 58.841 59.084 -0.243 1 1 2322 . 5 1 1 A 207 207 GLN CB C 207 28.208 28.596 -0.388 1 1 2324 . 5 1 1 A 207 207 GLN N N 207 115.863 118.308 -2.445 1 1 2326 . 5 1 1 A 208 208 ARG H H 208 7.522 7.877 -0.355 1 1 2327 . 5 1 1 A 208 208 ARG HA H 208 4.127 4.107 0.020 1 1 2334 . 5 1 1 A 208 208 ARG C C 208 179.278 178.892 0.386 1 1 2335 . 5 1 1 A 208 208 ARG CA C 208 59.419 58.979 0.440 1 1 2336 . 5 1 1 A 208 208 ARG CB C 208 30.182 29.812 0.370 1 1 2338 . 5 1 1 A 208 208 ARG N N 208 118.471 119.928 -1.457 1 1 2340 . 5 1 1 A 209 209 LEU H H 209 7.869 7.639 0.230 1 1 2341 . 5 1 1 A 209 209 LEU HA H 209 4.091 4.153 -0.062 1 1 2351 . 5 1 1 A 209 209 LEU C C 209 179.715 178.179 1.536 1 1 2352 . 5 1 1 A 209 209 LEU CA C 209 57.891 58.106 -0.215 1 1 2353 . 5 1 1 A 209 209 LEU CB C 209 41.338 41.775 -0.437 1 1 2356 . 5 1 1 A 209 209 LEU N N 209 119.659 121.316 -1.657 1 1 2357 . 5 1 1 A 210 210 LEU H H 210 8.034 8.477 -0.443 1 1 2358 . 5 1 1 A 210 210 LEU HA H 210 3.977 4.006 -0.029 1 1 2367 . 5 1 1 A 210 210 LEU C C 210 180.363 178.471 1.892 1 1 2368 . 5 1 1 A 210 210 LEU CA C 210 57.459 58.500 -1.041 1 1 2369 . 5 1 1 A 210 210 LEU CB C 210 41.699 41.438 0.261 1 1 2373 . 5 1 1 A 210 210 LEU N N 210 120.967 119.663 1.304 1 1 2374 . 5 1 1 A 211 211 GLU H H 211 8.174 8.340 -0.166 1 1 2375 . 5 1 1 A 211 211 GLU HA H 211 4.075 4.008 0.067 1 1 2379 . 5 1 1 A 211 211 GLU C C 211 178.499 178.586 -0.087 1 1 2380 . 5 1 1 A 211 211 GLU CA C 211 58.575 59.420 -0.845 1 1 2381 . 5 1 1 A 211 211 GLU CB C 211 29.583 29.322 0.261 1 1 2383 . 5 1 1 A 211 211 GLU N N 211 119.217 117.831 1.386 1 1 2384 . 5 1 1 A 212 212 ALA H H 212 7.723 7.812 -0.089 1 1 2385 . 5 1 1 A 212 212 ALA HA H 212 4.291 4.318 -0.027 1 1 2389 . 5 1 1 A 212 212 ALA C C 212 178.770 178.818 -0.048 1 1 2390 . 5 1 1 A 212 212 ALA CA C 212 53.966 54.194 -0.228 1 1 2391 . 5 1 1 A 212 212 ALA CB C 212 19.117 18.792 0.325 1 1 2392 . 5 1 1 A 212 212 ALA N N 212 121.798 122.680 -0.882 1 1 2393 . 5 1 1 A 213 213 ALA H H 213 7.743 7.975 -0.232 1 1 2394 . 5 1 1 A 213 213 ALA HA H 213 4.406 4.437 -0.031 1 1 2398 . 5 1 1 A 213 213 ALA C C 213 178.413 177.425 0.988 1 1 2399 . 5 1 1 A 213 213 ALA CA C 213 53.129 52.148 0.981 1 1 2400 . 5 1 1 A 213 213 ALA CB C 213 18.926 19.706 -0.780 1 1 2401 . 5 1 1 A 213 213 ALA N N 213 120.435 118.936 1.499 1 1 2402 . 5 1 1 A 214 214 SER H H 214 7.944 8.113 -0.169 1 1 2403 . 5 1 1 A 214 214 SER HA H 214 4.559 4.447 0.112 1 1 2406 . 5 1 1 A 214 214 SER C C 214 174.958 174.608 0.350 1 1 2407 . 5 1 1 A 214 214 SER CA C 214 58.640 57.886 0.754 1 1 2408 . 5 1 1 A 214 214 SER CB C 214 63.928 62.045 1.883 1 1 2409 . 5 1 1 A 214 214 SER N N 214 113.729 115.133 -1.404 1 1 2410 . 5 1 1 A 215 215 SER H H 215 8.255 8.933 -0.678 1 1 2411 . 5 1 1 A 215 215 SER HA H 215 4.547 4.719 -0.172 1 1 2413 . 5 1 1 A 215 215 SER C C 215 175.289 174.358 0.931 1 1 2414 . 5 1 1 A 215 215 SER CA C 215 58.833 58.078 0.755 1 1 2415 . 5 1 1 A 215 215 SER CB C 215 63.847 64.729 -0.882 1 1 2416 . 5 1 1 A 215 215 SER N N 215 117.674 124.188 -6.514 1 1 2417 . 5 1 1 A 216 216 GLY H H 216 8.431 7.538 0.893 1 1 2418 . 5 1 1 A 216 216 GLY HA2 H 216 4.054 4.063 -0.009 1 1 2419 . 5 1 1 A 216 216 GLY C C 216 174.189 173.126 1.063 1 1 2420 . 5 1 1 A 216 216 GLY CA C 216 45.412 44.114 1.298 1 1 2421 . 5 1 1 A 216 216 GLY N N 216 110.800 108.567 2.233 1 1 2422 . 5 1 1 A 217 217 GLU H H 217 8.267 8.469 -0.202 1 1 2423 . 5 1 1 A 217 217 GLU HA H 217 4.345 4.508 -0.163 1 1 2427 . 5 1 1 A 217 217 GLU C C 217 176.428 176.310 0.118 1 1 2428 . 5 1 1 A 217 217 GLU CA C 217 56.470 57.681 -1.211 1 1 2429 . 5 1 1 A 217 217 GLU CB C 217 30.526 31.530 -1.004 1 1 2430 . 5 1 1 A 217 217 GLU N N 217 120.726 119.882 0.844 1 1 2431 . 5 1 1 A 218 218 ALA H H 218 8.476 8.033 0.443 1 1 2432 . 5 1 1 A 218 218 ALA HA H 218 4.467 4.665 -0.198 1 1 2436 . 5 1 1 A 218 218 ALA C C 218 178.015 176.538 1.477 1 1 2437 . 5 1 1 A 218 218 ALA CA C 218 52.547 52.827 -0.280 1 1 2438 . 5 1 1 A 218 218 ALA CB C 218 19.242 17.607 1.635 1 1 2439 . 5 1 1 A 218 218 ALA N N 218 125.534 121.642 3.892 1 1 2440 . 5 1 1 A 219 219 THR H H 219 8.232 8.181 0.051 1 1 2441 . 5 1 1 A 219 219 THR HA H 219 4.411 4.736 -0.325 1 1 2446 . 5 1 1 A 219 219 THR C C 219 175.327 175.543 -0.216 1 1 2447 . 5 1 1 A 219 219 THR CA C 219 61.889 60.216 1.673 1 1 2448 . 5 1 1 A 219 219 THR CB C 219 69.939 68.891 1.048 1 1 2449 . 5 1 1 A 219 219 THR N N 219 113.242 111.174 2.068 1 1 2450 . 5 1 1 A 220 220 GLY H H 220 8.418 8.823 -0.405 1 1 2451 . 5 1 1 A 220 220 GLY C C 220 174.037 173.959 0.078 1 1 2452 . 5 1 1 A 220 220 GLY CA C 220 45.408 45.690 -0.282 1 1 2453 . 5 1 1 A 220 220 GLY N N 220 111.031 111.019 0.012 1 1 2454 . 5 1 1 A 221 221 ASP H H 221 8.345 7.778 0.567 1 1 2455 . 5 1 1 A 221 221 ASP HA H 221 4.700 4.854 -0.154 1 1 2458 . 5 1 1 A 221 221 ASP C C 221 176.535 175.033 1.502 1 1 2459 . 5 1 1 A 221 221 ASP CA C 221 54.402 53.340 1.062 1 1 2460 . 5 1 1 A 221 221 ASP CB C 221 41.431 40.979 0.452 1 1 2461 . 5 1 1 A 221 221 ASP N N 221 120.795 121.895 -1.100 1 1 2462 . 5 1 1 A 222 222 SER H H 222 8.353 8.324 0.029 1 1 2463 . 5 1 1 A 222 222 SER HA H 222 4.493 5.268 -0.775 1 1 2465 . 5 1 1 A 222 222 SER C C 222 174.224 173.085 1.139 1 1 2466 . 5 1 1 A 222 222 SER CA C 222 58.427 57.037 1.390 1 1 2467 . 5 1 1 A 222 222 SER CB C 222 63.860 64.144 -0.284 1 1 2468 . 5 1 1 A 222 222 SER N N 222 116.220 120.235 -4.015 1 1 2469 . 5 1 1 A 223 223 ALA H H 223 8.381 8.667 -0.286 1 1 2470 . 5 1 1 A 223 223 ALA HA H 223 4.461 5.048 -0.587 1 1 2474 . 5 1 1 A 223 223 ALA C C 223 176.926 175.710 1.216 1 1 2475 . 5 1 1 A 223 223 ALA CA C 223 52.583 51.493 1.090 1 1 2476 . 5 1 1 A 223 223 ALA CB C 223 19.438 23.015 -3.577 1 1 2477 . 5 1 1 A 223 223 ALA N N 223 126.592 127.624 -1.032 1 1 1 . 6 1 1 A 2 2 ALA HA H 2 4.274 4.791 -0.517 1 1 5 . 6 1 1 A 2 2 ALA C C 2 177.828 176.991 0.837 1 1 6 . 6 1 1 A 2 2 ALA CA C 2 52.984 51.152 1.832 1 1 7 . 6 1 1 A 2 2 ALA CB C 2 19.138 19.918 -0.780 1 1 8 . 6 1 1 A 3 3 GLN H H 3 8.463 8.571 -0.108 1 1 9 . 6 1 1 A 3 3 GLN HA H 3 4.676 4.744 -0.068 1 1 12 . 6 1 1 A 3 3 GLN C C 3 176.002 175.688 0.314 1 1 13 . 6 1 1 A 3 3 GLN CA C 3 56.258 54.717 1.541 1 1 14 . 6 1 1 A 3 3 GLN CB C 3 30.346 30.805 -0.459 1 1 15 . 6 1 1 A 3 3 GLN N N 3 117.490 121.071 -3.581 1 1 16 . 6 1 1 A 4 4 GLY H H 4 8.099 8.570 -0.471 1 1 17 . 6 1 1 A 4 4 GLY HA2 H 4 3.910 3.927 -0.017 1 1 18 . 6 1 1 A 4 4 GLY C C 4 173.332 173.871 -0.539 1 1 19 . 6 1 1 A 4 4 GLY CA C 4 45.333 46.602 -1.269 1 1 20 . 6 1 1 A 4 4 GLY N N 4 109.423 108.646 0.777 1 1 21 . 6 1 1 A 5 5 LEU H H 5 7.863 8.425 -0.562 1 1 22 . 6 1 1 A 5 5 LEU HA H 5 4.561 4.744 -0.183 1 1 32 . 6 1 1 A 5 5 LEU C C 5 176.448 176.143 0.305 1 1 33 . 6 1 1 A 5 5 LEU CA C 5 54.713 54.162 0.551 1 1 34 . 6 1 1 A 5 5 LEU CB C 5 43.551 42.289 1.262 1 1 38 . 6 1 1 A 5 5 LEU N N 5 120.391 123.959 -3.568 1 1 39 . 6 1 1 A 6 6 ILE H H 6 8.764 8.926 -0.162 1 1 40 . 6 1 1 A 6 6 ILE HA H 6 4.087 4.182 -0.095 1 1 49 . 6 1 1 A 6 6 ILE C C 6 174.679 174.937 -0.258 1 1 50 . 6 1 1 A 6 6 ILE CA C 6 61.279 61.690 -0.411 1 1 51 . 6 1 1 A 6 6 ILE CB C 6 39.651 37.343 2.308 1 1 54 . 6 1 1 A 6 6 ILE N N 6 123.050 125.149 -2.099 1 1 55 . 6 1 1 A 7 7 GLU H H 7 8.587 8.892 -0.305 1 1 56 . 6 1 1 A 7 7 GLU HA H 7 4.917 4.796 0.121 1 1 61 . 6 1 1 A 7 7 GLU C C 7 175.978 176.014 -0.036 1 1 62 . 6 1 1 A 7 7 GLU CA C 7 56.127 56.005 0.122 1 1 63 . 6 1 1 A 7 7 GLU CB C 7 31.115 30.431 0.684 1 1 65 . 6 1 1 A 7 7 GLU N N 7 127.415 128.481 -1.066 1 1 66 . 6 1 1 A 8 8 VAL H H 8 8.986 9.529 -0.543 1 1 67 . 6 1 1 A 8 8 VAL HA H 8 4.375 4.947 -0.572 1 1 72 . 6 1 1 A 8 8 VAL C C 8 173.704 175.298 -1.594 1 1 73 . 6 1 1 A 8 8 VAL CA C 8 61.347 60.621 0.726 1 1 74 . 6 1 1 A 8 8 VAL CB C 8 33.611 33.823 -0.212 1 1 76 . 6 1 1 A 8 8 VAL N N 8 126.071 122.741 3.330 1 1 77 . 6 1 1 A 9 9 GLU H H 9 8.521 9.004 -0.483 1 1 78 . 6 1 1 A 9 9 GLU HA H 9 5.837 5.668 0.169 1 1 81 . 6 1 1 A 9 9 GLU C C 9 175.939 175.230 0.709 1 1 82 . 6 1 1 A 9 9 GLU CA C 9 54.516 54.866 -0.350 1 1 83 . 6 1 1 A 9 9 GLU CB C 9 33.009 32.764 0.245 1 1 84 . 6 1 1 A 9 9 GLU N N 9 122.857 124.922 -2.065 1 1 85 . 6 1 1 A 10 10 ARG H H 10 8.690 9.271 -0.581 1 1 86 . 6 1 1 A 10 10 ARG HA H 10 4.709 5.226 -0.517 1 1 94 . 6 1 1 A 10 10 ARG C C 10 174.826 174.324 0.502 1 1 95 . 6 1 1 A 10 10 ARG CA C 10 54.491 53.667 0.824 1 1 96 . 6 1 1 A 10 10 ARG CB C 10 35.777 34.540 1.237 1 1 98 . 6 1 1 A 10 10 ARG N N 10 120.430 120.490 -0.060 1 1 100 . 6 1 1 A 11 11 LYS H H 11 8.874 8.702 0.172 1 1 101 . 6 1 1 A 11 11 LYS HA H 11 5.530 5.559 -0.029 1 1 107 . 6 1 1 A 11 11 LYS C C 11 176.919 174.655 2.264 1 1 108 . 6 1 1 A 11 11 LYS CA C 11 55.084 55.195 -0.111 1 1 109 . 6 1 1 A 11 11 LYS CB C 11 35.435 36.350 -0.915 1 1 113 . 6 1 1 A 11 11 LYS N N 11 121.087 120.704 0.383 1 1 114 . 6 1 1 A 12 12 PHE H H 12 8.877 9.344 -0.467 1 1 115 . 6 1 1 A 12 12 PHE HA H 12 5.130 5.337 -0.207 1 1 120 . 6 1 1 A 12 12 PHE C C 12 171.676 172.300 -0.624 1 1 121 . 6 1 1 A 12 12 PHE CA C 12 55.869 55.809 0.060 1 1 122 . 6 1 1 A 12 12 PHE CB C 12 42.108 42.308 -0.200 1 1 125 . 6 1 1 A 12 12 PHE N N 12 117.486 120.268 -2.782 1 1 126 . 6 1 1 A 13 13 ALA H H 13 9.134 9.621 -0.487 1 1 127 . 6 1 1 A 13 13 ALA HA H 13 5.003 4.714 0.289 1 1 131 . 6 1 1 A 13 13 ALA CA C 13 48.340 48.902 -0.562 1 1 132 . 6 1 1 A 13 13 ALA CB C 13 19.191 20.428 -1.237 1 1 133 . 6 1 1 A 13 13 ALA N N 13 125.915 123.054 2.861 1 1 134 . 6 1 1 A 14 14 PRO HA H 14 4.620 4.760 -0.140 1 1 140 . 6 1 1 A 14 14 PRO C C 14 176.502 177.643 -1.141 1 1 141 . 6 1 1 A 14 14 PRO CA C 14 62.672 63.101 -0.429 1 1 142 . 6 1 1 A 14 14 PRO CB C 14 33.119 32.050 1.069 1 1 145 . 6 1 1 A 15 15 GLY H H 15 8.721 8.405 0.316 1 1 146 . 6 1 1 A 15 15 GLY HA2 H 15 3.999 4.057 -0.058 1 1 147 . 6 1 1 A 15 15 GLY HA3 H 15 4.632 4.064 0.568 1 1 148 . 6 1 1 A 15 15 GLY CA C 15 44.411 44.187 0.224 1 1 149 . 6 1 1 A 15 15 GLY N N 15 109.863 108.296 1.567 1 1 150 . 6 1 1 A 16 16 PRO HA H 16 4.447 4.564 -0.117 1 1 155 . 6 1 1 A 16 16 PRO C C 16 177.053 176.612 0.441 1 1 156 . 6 1 1 A 16 16 PRO CA C 16 64.395 64.064 0.331 1 1 157 . 6 1 1 A 16 16 PRO CB C 16 31.993 32.094 -0.101 1 1 159 . 6 1 1 A 17 17 ASP H H 17 8.550 8.187 0.363 1 1 160 . 6 1 1 A 17 17 ASP HA H 17 4.950 5.013 -0.063 1 1 163 . 6 1 1 A 17 17 ASP C C 17 176.800 177.235 -0.435 1 1 164 . 6 1 1 A 17 17 ASP CA C 17 53.271 53.139 0.132 1 1 165 . 6 1 1 A 17 17 ASP CB C 17 40.392 41.206 -0.814 1 1 166 . 6 1 1 A 17 17 ASP N N 17 116.060 116.239 -0.179 1 1 167 . 6 1 1 A 18 18 THR H H 18 7.664 7.584 0.080 1 1 168 . 6 1 1 A 18 18 THR HA H 18 4.120 3.708 0.412 1 1 174 . 6 1 1 A 18 18 THR C C 18 175.407 176.251 -0.844 1 1 175 . 6 1 1 A 18 18 THR CA C 18 68.718 67.005 1.713 1 1 176 . 6 1 1 A 18 18 THR CB C 18 69.179 68.551 0.628 1 1 178 . 6 1 1 A 18 18 THR N N 18 117.158 116.966 0.192 1 1 179 . 6 1 1 A 19 19 GLU H H 19 8.817 8.549 0.268 1 1 180 . 6 1 1 A 19 19 GLU HA H 19 3.510 3.319 0.191 1 1 184 . 6 1 1 A 19 19 GLU C C 19 178.345 179.310 -0.965 1 1 185 . 6 1 1 A 19 19 GLU CA C 19 61.237 59.812 1.425 1 1 186 . 6 1 1 A 19 19 GLU CB C 19 28.746 29.383 -0.637 1 1 188 . 6 1 1 A 19 19 GLU N N 19 118.802 119.000 -0.198 1 1 189 . 6 1 1 A 20 20 GLU H H 20 7.976 8.119 -0.143 1 1 190 . 6 1 1 A 20 20 GLU HA H 20 4.036 4.138 -0.102 1 1 194 . 6 1 1 A 20 20 GLU C C 20 179.451 179.311 0.140 1 1 195 . 6 1 1 A 20 20 GLU CA C 20 59.909 58.765 1.144 1 1 196 . 6 1 1 A 20 20 GLU CB C 20 28.992 29.317 -0.325 1 1 198 . 6 1 1 A 20 20 GLU N N 20 121.130 119.566 1.564 1 1 199 . 6 1 1 A 21 21 ARG H H 21 8.199 8.195 0.004 1 1 200 . 6 1 1 A 21 21 ARG HA H 21 4.061 4.049 0.012 1 1 207 . 6 1 1 A 21 21 ARG C C 21 179.087 178.833 0.254 1 1 208 . 6 1 1 A 21 21 ARG CA C 21 58.477 58.871 -0.394 1 1 209 . 6 1 1 A 21 21 ARG CB C 21 30.101 30.064 0.037 1 1 211 . 6 1 1 A 21 21 ARG N N 21 119.897 120.414 -0.517 1 1 213 . 6 1 1 A 22 22 LEU H H 22 8.154 8.632 -0.478 1 1 214 . 6 1 1 A 22 22 LEU HA H 22 3.560 3.784 -0.224 1 1 224 . 6 1 1 A 22 22 LEU C C 22 178.461 179.430 -0.969 1 1 225 . 6 1 1 A 22 22 LEU CA C 22 58.432 57.820 0.612 1 1 226 . 6 1 1 A 22 22 LEU CB C 22 40.229 40.984 -0.755 1 1 230 . 6 1 1 A 22 22 LEU N N 22 120.012 119.463 0.549 1 1 231 . 6 1 1 A 23 23 GLN H H 23 7.621 7.819 -0.198 1 1 232 . 6 1 1 A 23 23 GLN HA H 23 4.232 4.164 0.068 1 1 238 . 6 1 1 A 23 23 GLN C C 23 180.543 178.989 1.554 1 1 239 . 6 1 1 A 23 23 GLN CA C 23 59.434 59.307 0.127 1 1 240 . 6 1 1 A 23 23 GLN CB C 23 28.749 28.084 0.665 1 1 242 . 6 1 1 A 23 23 GLN N N 23 117.823 118.063 -0.240 1 1 244 . 6 1 1 A 24 24 GLU H H 24 8.165 7.970 0.195 1 1 245 . 6 1 1 A 24 24 GLU HA H 24 4.072 4.082 -0.010 1 1 249 . 6 1 1 A 24 24 GLU C C 24 178.612 179.319 -0.707 1 1 250 . 6 1 1 A 24 24 GLU CA C 24 59.236 59.011 0.225 1 1 251 . 6 1 1 A 24 24 GLU CB C 24 29.606 29.979 -0.373 1 1 253 . 6 1 1 A 24 24 GLU N N 24 122.589 121.220 1.369 1 1 254 . 6 1 1 A 25 25 LEU H H 25 7.911 7.855 0.056 1 1 255 . 6 1 1 A 25 25 LEU HA H 25 4.214 4.075 0.139 1 1 265 . 6 1 1 A 25 25 LEU C C 25 176.745 177.366 -0.621 1 1 266 . 6 1 1 A 25 25 LEU CA C 25 55.659 55.897 -0.238 1 1 267 . 6 1 1 A 25 25 LEU CB C 25 43.109 42.934 0.175 1 1 271 . 6 1 1 A 25 25 LEU N N 25 117.882 117.265 0.617 1 1 272 . 6 1 1 A 26 26 GLY H H 26 7.776 8.023 -0.247 1 1 273 . 6 1 1 A 26 26 GLY HA2 H 26 4.337 4.036 0.301 1 1 274 . 6 1 1 A 26 26 GLY HA3 H 26 3.856 4.050 -0.194 1 1 275 . 6 1 1 A 26 26 GLY C C 26 175.456 174.635 0.821 1 1 276 . 6 1 1 A 26 26 GLY CA C 26 44.875 45.288 -0.413 1 1 277 . 6 1 1 A 26 26 GLY N N 26 104.938 105.797 -0.859 1 1 278 . 6 1 1 A 27 27 ALA H H 27 8.104 8.587 -0.483 1 1 279 . 6 1 1 A 27 27 ALA HA H 27 4.949 4.511 0.438 1 1 283 . 6 1 1 A 27 27 ALA C C 27 176.448 177.412 -0.964 1 1 284 . 6 1 1 A 27 27 ALA CA C 27 52.183 52.511 -0.328 1 1 285 . 6 1 1 A 27 27 ALA CB C 27 21.814 20.100 1.714 1 1 286 . 6 1 1 A 27 27 ALA N N 27 123.263 124.596 -1.333 1 1 287 . 6 1 1 A 28 28 THR H H 28 9.369 9.625 -0.256 1 1 288 . 6 1 1 A 28 28 THR HA H 28 4.779 4.687 0.092 1 1 293 . 6 1 1 A 28 28 THR C C 28 173.725 173.900 -0.175 1 1 294 . 6 1 1 A 28 28 THR CA C 28 60.046 62.685 -2.639 1 1 295 . 6 1 1 A 28 28 THR CB C 28 70.592 69.489 1.103 1 1 297 . 6 1 1 A 28 28 THR N N 28 112.201 119.289 -7.088 1 1 298 . 6 1 1 A 29 29 LEU H H 29 8.518 8.458 0.060 1 1 299 . 6 1 1 A 29 29 LEU HA H 29 3.332 3.769 -0.437 1 1 309 . 6 1 1 A 29 29 LEU C C 29 176.202 176.560 -0.358 1 1 310 . 6 1 1 A 29 29 LEU CA C 29 55.031 54.585 0.446 1 1 311 . 6 1 1 A 29 29 LEU CB C 29 40.624 41.146 -0.522 1 1 315 . 6 1 1 A 29 29 LEU N N 29 128.151 128.353 -0.202 1 1 316 . 6 1 1 A 30 30 GLU H H 30 9.269 9.064 0.205 1 1 317 . 6 1 1 A 30 30 GLU HA H 30 4.287 4.299 -0.012 1 1 321 . 6 1 1 A 30 30 GLU C C 30 176.740 175.921 0.819 1 1 322 . 6 1 1 A 30 30 GLU CA C 30 57.283 57.589 -0.306 1 1 323 . 6 1 1 A 30 30 GLU CB C 30 31.045 30.610 0.435 1 1 325 . 6 1 1 A 30 30 GLU N N 30 130.123 123.573 6.550 1 1 326 . 6 1 1 A 31 31 HIS H H 31 7.341 7.158 0.183 1 1 327 . 6 1 1 A 31 31 HIS HA H 31 4.701 5.136 -0.435 1 1 331 . 6 1 1 A 31 31 HIS C C 31 172.581 173.293 -0.712 1 1 332 . 6 1 1 A 31 31 HIS CA C 31 55.876 54.802 1.074 1 1 333 . 6 1 1 A 31 31 HIS CB C 31 33.434 34.251 -0.817 1 1 334 . 6 1 1 A 31 31 HIS N N 31 113.223 116.386 -3.163 1 1 335 . 6 1 1 A 32 32 ARG H H 32 8.196 8.617 -0.421 1 1 336 . 6 1 1 A 32 32 ARG HA H 32 5.262 5.005 0.257 1 1 341 . 6 1 1 A 32 32 ARG C C 32 174.377 174.564 -0.187 1 1 342 . 6 1 1 A 32 32 ARG CA C 32 55.808 54.961 0.847 1 1 343 . 6 1 1 A 32 32 ARG CB C 32 33.340 33.916 -0.576 1 1 345 . 6 1 1 A 32 32 ARG N N 32 123.003 122.627 0.376 1 1 346 . 6 1 1 A 33 33 VAL H H 33 8.956 9.430 -0.474 1 1 347 . 6 1 1 A 33 33 VAL HA H 33 4.734 4.965 -0.231 1 1 355 . 6 1 1 A 33 33 VAL C C 33 172.821 175.103 -2.282 1 1 356 . 6 1 1 A 33 33 VAL CA C 33 60.197 60.232 -0.035 1 1 357 . 6 1 1 A 33 33 VAL CB C 33 35.860 34.359 1.501 1 1 360 . 6 1 1 A 33 33 VAL N N 33 122.929 121.325 1.604 1 1 361 . 6 1 1 A 34 34 THR H H 34 8.250 8.908 -0.658 1 1 362 . 6 1 1 A 34 34 THR HA H 34 5.616 5.925 -0.309 1 1 367 . 6 1 1 A 34 34 THR C C 34 173.913 173.653 0.260 1 1 368 . 6 1 1 A 34 34 THR CA C 34 60.245 60.504 -0.259 1 1 369 . 6 1 1 A 34 34 THR CB C 34 71.706 71.059 0.647 1 1 371 . 6 1 1 A 34 34 THR N N 34 119.164 117.105 2.059 1 1 372 . 6 1 1 A 35 35 PHE H H 35 8.565 8.616 -0.051 1 1 373 . 6 1 1 A 35 35 PHE HA H 35 5.029 5.066 -0.037 1 1 378 . 6 1 1 A 35 35 PHE C C 35 173.193 172.213 0.980 1 1 379 . 6 1 1 A 35 35 PHE CA C 35 55.687 56.167 -0.480 1 1 380 . 6 1 1 A 35 35 PHE CB C 35 40.853 40.754 0.099 1 1 383 . 6 1 1 A 35 35 PHE N N 35 120.244 118.441 1.803 1 1 384 . 6 1 1 A 36 36 ARG H H 36 8.869 8.522 0.347 1 1 385 . 6 1 1 A 36 36 ARG HA H 36 4.982 5.179 -0.197 1 1 387 . 6 1 1 A 36 36 ARG C C 36 174.743 174.529 0.214 1 1 388 . 6 1 1 A 36 36 ARG CA C 36 55.493 54.545 0.948 1 1 389 . 6 1 1 A 36 36 ARG CB C 36 32.228 32.975 -0.747 1 1 390 . 6 1 1 A 36 36 ARG N N 36 123.893 119.374 4.519 1 1 391 . 6 1 1 A 37 37 ASP H H 37 8.402 8.641 -0.239 1 1 392 . 6 1 1 A 37 37 ASP HA H 37 5.462 5.229 0.233 1 1 395 . 6 1 1 A 37 37 ASP C C 37 175.177 175.180 -0.003 1 1 396 . 6 1 1 A 37 37 ASP CA C 37 53.942 53.164 0.778 1 1 397 . 6 1 1 A 37 37 ASP CB C 37 45.486 42.090 3.396 1 1 398 . 6 1 1 A 37 37 ASP N N 37 127.149 121.940 5.209 1 1 399 . 6 1 1 A 38 38 THR H H 38 8.151 8.940 -0.789 1 1 400 . 6 1 1 A 38 38 THR HA H 38 4.866 4.915 -0.049 1 1 405 . 6 1 1 A 38 38 THR C C 38 172.792 173.487 -0.695 1 1 406 . 6 1 1 A 38 38 THR CA C 38 61.416 61.600 -0.184 1 1 407 . 6 1 1 A 38 38 THR CB C 38 71.047 69.490 1.557 1 1 409 . 6 1 1 A 38 38 THR N N 38 115.686 120.401 -4.715 1 1 410 . 6 1 1 A 39 39 TYR H H 39 9.021 9.564 -0.543 1 1 411 . 6 1 1 A 39 39 TYR HA H 39 5.544 5.847 -0.303 1 1 416 . 6 1 1 A 39 39 TYR C C 39 176.032 174.544 1.488 1 1 417 . 6 1 1 A 39 39 TYR CA C 39 57.184 56.900 0.284 1 1 418 . 6 1 1 A 39 39 TYR CB C 39 41.642 41.285 0.357 1 1 420 . 6 1 1 A 39 39 TYR N N 39 124.579 126.551 -1.972 1 1 421 . 6 1 1 A 40 40 TYR H H 40 8.487 8.945 -0.458 1 1 422 . 6 1 1 A 40 40 TYR HA H 40 5.517 5.779 -0.262 1 1 426 . 6 1 1 A 40 40 TYR C C 40 174.108 174.418 -0.310 1 1 427 . 6 1 1 A 40 40 TYR CA C 40 56.979 56.578 0.401 1 1 428 . 6 1 1 A 40 40 TYR CB C 40 44.132 42.626 1.506 1 1 431 . 6 1 1 A 40 40 TYR N N 40 119.709 121.071 -1.362 1 1 432 . 6 1 1 A 41 41 ASP H H 41 9.341 8.825 0.516 1 1 433 . 6 1 1 A 41 41 ASP HA H 41 4.866 5.102 -0.236 1 1 436 . 6 1 1 A 41 41 ASP C C 41 177.262 174.669 2.593 1 1 437 . 6 1 1 A 41 41 ASP CA C 41 53.445 53.422 0.023 1 1 438 . 6 1 1 A 41 41 ASP CB C 41 45.347 44.611 0.736 1 1 439 . 6 1 1 A 41 41 ASP N N 41 117.995 120.672 -2.677 1 1 440 . 6 1 1 A 42 42 THR H H 42 11.574 8.676 2.898 1 1 441 . 6 1 1 A 42 42 THR HA H 42 5.206 4.468 0.738 1 1 446 . 6 1 1 A 42 42 THR C C 42 177.935 176.079 1.856 1 1 447 . 6 1 1 A 42 42 THR CA C 42 60.400 61.404 -1.004 1 1 448 . 6 1 1 A 42 42 THR CB C 42 72.114 70.503 1.611 1 1 450 . 6 1 1 A 42 42 THR N N 42 114.394 114.827 -0.433 1 1 451 . 6 1 1 A 43 43 SER H H 43 9.715 8.956 0.759 1 1 452 . 6 1 1 A 43 43 SER HA H 43 4.252 4.231 0.021 1 1 455 . 6 1 1 A 43 43 SER C C 43 175.478 174.631 0.847 1 1 456 . 6 1 1 A 43 43 SER CA C 43 61.277 60.840 0.437 1 1 457 . 6 1 1 A 43 43 SER CB C 43 62.821 62.973 -0.152 1 1 458 . 6 1 1 A 43 43 SER N N 43 116.674 116.810 -0.136 1 1 459 . 6 1 1 A 44 44 GLU H H 44 7.674 8.000 -0.326 1 1 460 . 6 1 1 A 44 44 GLU HA H 44 4.330 4.246 0.084 1 1 464 . 6 1 1 A 44 44 GLU C C 44 175.001 176.290 -1.289 1 1 465 . 6 1 1 A 44 44 GLU CA C 44 55.992 55.341 0.651 1 1 466 . 6 1 1 A 44 44 GLU CB C 44 29.276 28.845 0.431 1 1 468 . 6 1 1 A 44 44 GLU N N 44 117.856 118.336 -0.480 1 1 469 . 6 1 1 A 45 45 LEU H H 45 8.222 7.908 0.314 1 1 470 . 6 1 1 A 45 45 LEU HA H 45 3.901 4.981 -1.080 1 1 480 . 6 1 1 A 45 45 LEU C C 45 175.209 176.451 -1.242 1 1 481 . 6 1 1 A 45 45 LEU CA C 45 55.548 56.284 -0.736 1 1 482 . 6 1 1 A 45 45 LEU CB C 45 38.458 39.346 -0.888 1 1 485 . 6 1 1 A 45 45 LEU N N 45 119.335 116.459 2.876 1 1 486 . 6 1 1 A 46 46 SER H H 46 7.347 7.925 -0.578 1 1 487 . 6 1 1 A 46 46 SER HA H 46 3.954 4.198 -0.244 1 1 489 . 6 1 1 A 46 46 SER C C 46 177.497 177.335 0.162 1 1 490 . 6 1 1 A 46 46 SER CA C 46 62.471 61.328 1.143 1 1 491 . 6 1 1 A 46 46 SER CB C 46 63.908 62.819 1.089 1 1 492 . 6 1 1 A 46 46 SER N N 46 111.433 114.613 -3.180 1 1 493 . 6 1 1 A 47 47 LEU H H 47 12.003 7.918 4.085 1 1 494 . 6 1 1 A 47 47 LEU HA H 47 3.959 4.176 -0.217 1 1 504 . 6 1 1 A 47 47 LEU C C 47 180.340 178.217 2.123 1 1 505 . 6 1 1 A 47 47 LEU CA C 47 58.879 57.852 1.027 1 1 506 . 6 1 1 A 47 47 LEU CB C 47 39.572 41.595 -2.023 1 1 510 . 6 1 1 A 47 47 LEU N N 47 124.605 123.175 1.430 1 1 511 . 6 1 1 A 48 48 MET H H 48 10.599 8.402 2.197 1 1 512 . 6 1 1 A 48 48 MET HA H 48 3.213 3.740 -0.527 1 1 520 . 6 1 1 A 48 48 MET C C 48 181.177 178.090 3.087 1 1 521 . 6 1 1 A 48 48 MET CA C 48 60.747 58.187 2.560 1 1 522 . 6 1 1 A 48 48 MET CB C 48 32.594 31.983 0.611 1 1 525 . 6 1 1 A 48 48 MET N N 48 126.254 119.030 7.224 1 1 526 . 6 1 1 A 49 49 LEU H H 49 8.731 7.924 0.807 1 1 527 . 6 1 1 A 49 49 LEU HA H 49 4.097 4.143 -0.046 1 1 536 . 6 1 1 A 49 49 LEU C C 49 178.144 177.319 0.825 1 1 537 . 6 1 1 A 49 49 LEU CA C 49 57.800 56.525 1.275 1 1 538 . 6 1 1 A 49 49 LEU CB C 49 41.379 41.641 -0.262 1 1 541 . 6 1 1 A 49 49 LEU N N 49 119.183 120.291 -1.108 1 1 542 . 6 1 1 A 50 50 SER H H 50 7.853 7.357 0.496 1 1 543 . 6 1 1 A 50 50 SER HA H 50 4.822 4.530 0.292 1 1 546 . 6 1 1 A 50 50 SER C C 50 174.539 172.767 1.772 1 1 547 . 6 1 1 A 50 50 SER CA C 50 57.811 58.155 -0.344 1 1 548 . 6 1 1 A 50 50 SER CB C 50 64.443 63.423 1.020 1 1 549 . 6 1 1 A 50 50 SER N N 50 114.594 112.475 2.119 1 1 550 . 6 1 1 A 51 51 ASP H H 51 8.264 7.576 0.688 1 1 551 . 6 1 1 A 51 51 ASP HA H 51 4.362 4.246 0.116 1 1 554 . 6 1 1 A 51 51 ASP C C 51 172.921 174.665 -1.744 1 1 555 . 6 1 1 A 51 51 ASP CA C 51 55.343 55.529 -0.186 1 1 556 . 6 1 1 A 51 51 ASP CB C 51 40.583 39.578 1.005 1 1 557 . 6 1 1 A 51 51 ASP N N 51 123.003 117.411 5.592 1 1 558 . 6 1 1 A 52 52 HIS H H 52 7.869 7.049 0.820 1 1 559 . 6 1 1 A 52 52 HIS HA H 52 5.335 5.185 0.150 1 1 564 . 6 1 1 A 52 52 HIS C C 52 173.991 174.069 -0.078 1 1 565 . 6 1 1 A 52 52 HIS CA C 52 55.889 53.436 2.453 1 1 566 . 6 1 1 A 52 52 HIS CB C 52 31.789 31.382 0.407 1 1 568 . 6 1 1 A 52 52 HIS N N 52 112.486 117.264 -4.778 1 1 569 . 6 1 1 A 53 53 TRP H H 53 8.165 8.987 -0.822 1 1 570 . 6 1 1 A 53 53 TRP HA H 53 4.926 5.279 -0.353 1 1 578 . 6 1 1 A 53 53 TRP C C 53 175.354 174.966 0.388 1 1 579 . 6 1 1 A 53 53 TRP CA C 53 55.364 55.601 -0.237 1 1 580 . 6 1 1 A 53 53 TRP CB C 53 30.641 32.500 -1.859 1 1 585 . 6 1 1 A 53 53 TRP N N 53 117.916 123.065 -5.149 1 1 587 . 6 1 1 A 54 54 LEU H H 54 10.088 9.317 0.771 1 1 588 . 6 1 1 A 54 54 LEU HA H 54 5.497 5.564 -0.067 1 1 598 . 6 1 1 A 54 54 LEU C C 54 173.337 174.990 -1.653 1 1 599 . 6 1 1 A 54 54 LEU CA C 54 54.408 54.002 0.406 1 1 600 . 6 1 1 A 54 54 LEU CB C 54 44.156 45.565 -1.409 1 1 604 . 6 1 1 A 54 54 LEU N N 54 130.826 125.984 4.842 1 1 605 . 6 1 1 A 55 55 ARG H H 55 9.289 9.790 -0.501 1 1 606 . 6 1 1 A 55 55 ARG HA H 55 5.482 5.217 0.265 1 1 612 . 6 1 1 A 55 55 ARG C C 55 174.057 173.654 0.403 1 1 613 . 6 1 1 A 55 55 ARG CA C 55 53.167 54.188 -1.021 1 1 614 . 6 1 1 A 55 55 ARG CB C 55 34.270 33.787 0.483 1 1 616 . 6 1 1 A 55 55 ARG N N 55 125.089 128.014 -2.925 1 1 618 . 6 1 1 A 56 56 GLN H H 56 9.092 9.340 -0.248 1 1 619 . 6 1 1 A 56 56 GLN HA H 56 3.991 4.683 -0.692 1 1 626 . 6 1 1 A 56 56 GLN C C 56 174.199 174.507 -0.308 1 1 627 . 6 1 1 A 56 56 GLN CA C 56 54.566 53.880 0.686 1 1 628 . 6 1 1 A 56 56 GLN CB C 56 29.643 29.962 -0.319 1 1 630 . 6 1 1 A 56 56 GLN N N 56 124.355 127.170 -2.815 1 1 632 . 6 1 1 A 57 57 ARG H H 57 8.440 8.127 0.313 1 1 633 . 6 1 1 A 57 57 ARG HA H 57 5.316 4.946 0.370 1 1 639 . 6 1 1 A 57 57 ARG C C 57 176.188 176.202 -0.014 1 1 640 . 6 1 1 A 57 57 ARG CA C 57 53.940 55.011 -1.071 1 1 641 . 6 1 1 A 57 57 ARG CB C 57 32.426 32.206 0.220 1 1 643 . 6 1 1 A 57 57 ARG N N 57 130.222 126.083 4.139 1 1 645 . 6 1 1 A 58 58 GLU H H 58 8.891 9.059 -0.168 1 1 646 . 6 1 1 A 58 58 GLU HA H 58 3.996 4.101 -0.105 1 1 649 . 6 1 1 A 58 58 GLU CA C 58 58.364 57.376 0.988 1 1 650 . 6 1 1 A 58 58 GLU CB C 58 30.875 27.403 3.472 1 1 651 . 6 1 1 A 58 58 GLU N N 58 131.208 121.666 9.542 1 1 652 . 6 1 1 A 59 59 GLY H H 59 8.367 8.532 -0.165 1 1 653 . 6 1 1 A 59 59 GLY HA2 H 59 4.334 3.780 0.554 1 1 654 . 6 1 1 A 59 59 GLY HA3 H 59 3.743 3.871 -0.128 1 1 655 . 6 1 1 A 59 59 GLY C C 59 174.194 174.880 -0.686 1 1 656 . 6 1 1 A 59 59 GLY CA C 59 45.666 46.632 -0.966 1 1 657 . 6 1 1 A 60 60 SER H H 60 8.071 8.316 -0.245 1 1 658 . 6 1 1 A 60 60 SER HA H 60 4.730 4.351 0.379 1 1 661 . 6 1 1 A 60 60 SER C C 60 173.908 174.570 -0.662 1 1 662 . 6 1 1 A 60 60 SER CA C 60 58.762 59.151 -0.389 1 1 663 . 6 1 1 A 60 60 SER CB C 60 64.497 64.337 0.160 1 1 664 . 6 1 1 A 60 60 SER N N 60 114.636 116.606 -1.970 1 1 665 . 6 1 1 A 61 61 GLY H H 61 8.401 7.234 1.167 1 1 666 . 6 1 1 A 61 61 GLY HA2 H 61 4.560 4.046 0.514 1 1 667 . 6 1 1 A 61 61 GLY HA3 H 61 3.878 4.098 -0.220 1 1 668 . 6 1 1 A 61 61 GLY C C 61 173.526 171.507 2.019 1 1 669 . 6 1 1 A 61 61 GLY CA C 61 44.906 45.738 -0.832 1 1 670 . 6 1 1 A 61 61 GLY N N 61 109.421 106.380 3.041 1 1 671 . 6 1 1 A 62 62 TRP H H 62 8.861 8.653 0.208 1 1 672 . 6 1 1 A 62 62 TRP HA H 62 5.089 5.167 -0.078 1 1 681 . 6 1 1 A 62 62 TRP C C 62 176.168 176.201 -0.033 1 1 682 . 6 1 1 A 62 62 TRP CA C 62 57.459 57.113 0.346 1 1 683 . 6 1 1 A 62 62 TRP CB C 62 32.536 30.709 1.827 1 1 689 . 6 1 1 A 62 62 TRP N N 62 122.939 120.869 2.070 1 1 691 . 6 1 1 A 63 63 GLU H H 63 9.306 9.333 -0.027 1 1 692 . 6 1 1 A 63 63 GLU HA H 63 4.919 5.344 -0.425 1 1 697 . 6 1 1 A 63 63 GLU C C 63 173.770 174.849 -1.079 1 1 698 . 6 1 1 A 63 63 GLU CA C 63 55.953 55.138 0.815 1 1 699 . 6 1 1 A 63 63 GLU CB C 63 35.317 33.190 2.127 1 1 701 . 6 1 1 A 63 63 GLU N N 63 120.136 122.793 -2.657 1 1 702 . 6 1 1 A 64 64 LEU H H 64 8.998 9.247 -0.249 1 1 703 . 6 1 1 A 64 64 LEU HA H 64 5.616 5.524 0.092 1 1 712 . 6 1 1 A 64 64 LEU C C 64 175.014 173.914 1.100 1 1 713 . 6 1 1 A 64 64 LEU CA C 64 52.945 53.629 -0.684 1 1 714 . 6 1 1 A 64 64 LEU CB C 64 46.904 46.022 0.882 1 1 717 . 6 1 1 A 64 64 LEU N N 64 127.321 126.700 0.621 1 1 718 . 6 1 1 A 65 65 LYS H H 65 9.322 10.091 -0.769 1 1 719 . 6 1 1 A 65 65 LYS HA H 65 5.347 5.234 0.113 1 1 727 . 6 1 1 A 65 65 LYS C C 65 175.811 175.925 -0.114 1 1 728 . 6 1 1 A 65 65 LYS CA C 65 55.817 55.484 0.333 1 1 729 . 6 1 1 A 65 65 LYS CB C 65 34.521 34.315 0.206 1 1 733 . 6 1 1 A 65 65 LYS N N 65 129.874 128.462 1.412 1 1 734 . 6 1 1 A 66 66 CYS H H 66 9.129 8.804 0.325 1 1 735 . 6 1 1 A 66 66 CYS HA H 66 5.319 5.291 0.028 1 1 738 . 6 1 1 A 66 66 CYS CA C 66 54.532 56.764 -2.232 1 1 739 . 6 1 1 A 66 66 CYS CB C 66 28.813 30.642 -1.829 1 1 740 . 6 1 1 A 66 66 CYS N N 66 121.497 124.897 -3.400 1 1 741 . 6 1 1 A 67 67 PRO HA H 67 4.439 4.208 0.231 1 1 748 . 6 1 1 A 67 67 PRO C C 67 177.297 177.367 -0.070 1 1 749 . 6 1 1 A 67 67 PRO CA C 67 63.596 63.125 0.471 1 1 750 . 6 1 1 A 67 67 PRO CB C 67 32.242 31.054 1.188 1 1 752 . 6 1 1 A 68 68 GLY H H 68 8.316 8.531 -0.215 1 1 753 . 6 1 1 A 68 68 GLY HA2 H 68 3.726 3.934 -0.208 1 1 754 . 6 1 1 A 68 68 GLY HA3 H 68 4.095 3.968 0.127 1 1 755 . 6 1 1 A 68 68 GLY C C 68 173.789 174.493 -0.704 1 1 756 . 6 1 1 A 68 68 GLY CA C 68 45.227 45.902 -0.675 1 1 757 . 6 1 1 A 68 68 GLY N N 68 109.533 109.479 0.054 1 1 758 . 6 1 1 A 69 69 VAL H H 69 8.114 8.024 0.090 1 1 759 . 6 1 1 A 69 69 VAL HA H 69 4.266 3.995 0.271 1 1 764 . 6 1 1 A 69 69 VAL C C 69 176.299 176.925 -0.626 1 1 765 . 6 1 1 A 69 69 VAL CA C 69 61.945 63.073 -1.128 1 1 766 . 6 1 1 A 69 69 VAL CB C 69 33.082 31.575 1.507 1 1 768 . 6 1 1 A 69 69 VAL N N 69 118.540 120.585 -2.045 1 1 769 . 6 1 1 A 70 70 THR H H 70 8.324 8.984 -0.660 1 1 770 . 6 1 1 A 70 70 THR HA H 70 4.373 4.406 -0.033 1 1 775 . 6 1 1 A 70 70 THR C C 70 175.204 175.650 -0.446 1 1 776 . 6 1 1 A 70 70 THR CA C 70 62.309 63.785 -1.476 1 1 777 . 6 1 1 A 70 70 THR CB C 70 69.787 68.602 1.185 1 1 779 . 6 1 1 A 70 70 THR N N 70 117.636 119.463 -1.827 1 1 780 . 6 1 1 A 71 71 GLY H H 71 8.574 7.889 0.685 1 1 781 . 6 1 1 A 71 71 GLY HA2 H 71 4.096 4.188 -0.092 1 1 782 . 6 1 1 A 71 71 GLY HA3 H 71 3.975 4.198 -0.223 1 1 783 . 6 1 1 A 71 71 GLY C C 71 174.313 175.301 -0.988 1 1 784 . 6 1 1 A 71 71 GLY CA C 71 45.545 45.805 -0.260 1 1 785 . 6 1 1 A 71 71 GLY N N 71 111.677 109.228 2.449 1 1 786 . 6 1 1 A 72 72 VAL H H 72 7.945 7.990 -0.045 1 1 787 . 6 1 1 A 72 72 VAL HA H 72 4.258 3.882 0.376 1 1 795 . 6 1 1 A 72 72 VAL C C 72 176.162 176.072 0.090 1 1 796 . 6 1 1 A 72 72 VAL CA C 72 62.227 64.779 -2.552 1 1 797 . 6 1 1 A 72 72 VAL CB C 72 32.997 31.806 1.191 1 1 799 . 6 1 1 A 72 72 VAL N N 72 118.647 117.972 0.675 1 1 800 . 6 1 1 A 73 73 SER H H 73 8.498 7.620 0.878 1 1 801 . 6 1 1 A 73 73 SER HA H 73 4.617 4.763 -0.146 1 1 803 . 6 1 1 A 73 73 SER C C 73 174.461 173.598 0.863 1 1 804 . 6 1 1 A 73 73 SER CA C 73 58.218 58.264 -0.046 1 1 805 . 6 1 1 A 73 73 SER CB C 73 64.061 65.279 -1.218 1 1 806 . 6 1 1 A 73 73 SER N N 73 118.828 112.071 6.757 1 1 807 . 6 1 1 A 74 74 GLY H H 74 8.247 8.533 -0.286 1 1 808 . 6 1 1 A 74 74 GLY HA2 H 74 4.101 4.123 -0.022 1 1 809 . 6 1 1 A 74 74 GLY HA3 H 74 4.304 4.126 0.178 1 1 810 . 6 1 1 A 74 74 GLY CA C 74 44.896 44.823 0.073 1 1 811 . 6 1 1 A 74 74 GLY N N 74 111.138 116.549 -5.411 1 1 812 . 6 1 1 A 75 75 PRO HA H 75 4.461 4.897 -0.436 1 1 819 . 6 1 1 A 75 75 PRO C C 75 176.798 175.121 1.677 1 1 820 . 6 1 1 A 75 75 PRO CA C 75 63.466 62.592 0.874 1 1 821 . 6 1 1 A 75 75 PRO CB C 75 31.980 31.943 0.037 1 1 824 . 6 1 1 A 76 76 HIS H H 76 8.397 8.479 -0.082 1 1 825 . 6 1 1 A 76 76 HIS HA H 76 4.742 4.806 -0.064 1 1 829 . 6 1 1 A 76 76 HIS C C 76 174.282 174.173 0.109 1 1 830 . 6 1 1 A 76 76 HIS CA C 76 55.579 56.227 -0.648 1 1 831 . 6 1 1 A 76 76 HIS CB C 76 30.501 32.991 -2.490 1 1 832 . 6 1 1 A 76 76 HIS N N 76 118.431 122.013 -3.582 1 1 833 . 6 1 1 A 77 77 ASN H H 77 8.364 8.855 -0.491 1 1 834 . 6 1 1 A 77 77 ASN HA H 77 4.767 4.064 0.703 1 1 839 . 6 1 1 A 77 77 ASN C C 77 174.576 174.158 0.418 1 1 840 . 6 1 1 A 77 77 ASN CA C 77 53.139 54.221 -1.082 1 1 841 . 6 1 1 A 77 77 ASN CB C 77 39.320 37.696 1.624 1 1 842 . 6 1 1 A 77 77 ASN N N 77 119.421 123.778 -4.357 1 1 844 . 6 1 1 A 78 78 GLU H H 78 8.683 8.366 0.317 1 1 845 . 6 1 1 A 78 78 GLU HA H 78 4.409 4.228 0.181 1 1 850 . 6 1 1 A 78 78 GLU C C 78 175.791 174.782 1.009 1 1 851 . 6 1 1 A 78 78 GLU CA C 78 56.359 58.574 -2.215 1 1 852 . 6 1 1 A 78 78 GLU CB C 78 30.818 28.518 2.300 1 1 854 . 6 1 1 A 78 78 GLU N N 78 122.085 114.456 7.629 1 1 855 . 6 1 1 A 79 79 TYR H H 79 8.341 8.548 -0.207 1 1 856 . 6 1 1 A 79 79 TYR HA H 79 4.988 5.200 -0.212 1 1 861 . 6 1 1 A 79 79 TYR C C 79 175.837 175.482 0.355 1 1 862 . 6 1 1 A 79 79 TYR CA C 79 58.028 58.677 -0.649 1 1 863 . 6 1 1 A 79 79 TYR CB C 79 41.672 38.791 2.881 1 1 866 . 6 1 1 A 79 79 TYR N N 79 119.452 122.248 -2.796 1 1 867 . 6 1 1 A 80 80 VAL H H 80 9.366 9.196 0.170 1 1 868 . 6 1 1 A 80 80 VAL HA H 80 4.370 4.527 -0.157 1 1 873 . 6 1 1 A 80 80 VAL C C 80 174.948 175.221 -0.273 1 1 874 . 6 1 1 A 80 80 VAL CA C 80 61.190 61.646 -0.456 1 1 875 . 6 1 1 A 80 80 VAL CB C 80 34.204 32.881 1.323 1 1 877 . 6 1 1 A 80 80 VAL N N 80 120.567 124.131 -3.564 1 1 878 . 6 1 1 A 81 81 GLU H H 81 8.570 8.889 -0.319 1 1 879 . 6 1 1 A 81 81 GLU HA H 81 4.770 4.818 -0.048 1 1 883 . 6 1 1 A 81 81 GLU C C 81 175.491 175.367 0.124 1 1 884 . 6 1 1 A 81 81 GLU CA C 81 55.655 56.020 -0.365 1 1 885 . 6 1 1 A 81 81 GLU CB C 81 30.415 30.218 0.197 1 1 887 . 6 1 1 A 81 81 GLU N N 81 124.248 128.068 -3.820 1 1 888 . 6 1 1 A 82 82 VAL H H 82 9.189 9.426 -0.237 1 1 889 . 6 1 1 A 82 82 VAL HA H 82 4.279 4.160 0.119 1 1 894 . 6 1 1 A 82 82 VAL C C 82 176.087 176.560 -0.473 1 1 895 . 6 1 1 A 82 82 VAL CA C 82 62.672 63.003 -0.331 1 1 896 . 6 1 1 A 82 82 VAL CB C 82 33.121 31.312 1.809 1 1 898 . 6 1 1 A 82 82 VAL N N 82 127.776 126.224 1.552 1 1 899 . 6 1 1 A 83 83 THR H H 83 8.590 8.773 -0.183 1 1 900 . 6 1 1 A 83 83 THR HA H 83 4.955 4.677 0.278 1 1 905 . 6 1 1 A 83 83 THR C C 83 174.688 174.667 0.021 1 1 906 . 6 1 1 A 83 83 THR CA C 83 61.332 61.639 -0.307 1 1 907 . 6 1 1 A 83 83 THR CB C 83 70.213 69.971 0.242 1 1 909 . 6 1 1 A 83 83 THR N N 83 114.744 118.950 -4.206 1 1 910 . 6 1 1 A 84 84 SER H H 84 7.650 7.514 0.136 1 1 911 . 6 1 1 A 84 84 SER HA H 84 4.819 4.539 0.280 1 1 914 . 6 1 1 A 84 84 SER CA C 84 56.280 59.403 -3.123 1 1 915 . 6 1 1 A 84 84 SER CB C 84 63.294 63.476 -0.182 1 1 916 . 6 1 1 A 84 84 SER N N 84 118.038 118.151 -0.113 1 1 917 . 6 1 1 A 85 85 GLU H H 85 8.391 8.777 -0.386 1 1 918 . 6 1 1 A 85 85 GLU HA H 85 3.661 3.934 -0.273 1 1 923 . 6 1 1 A 85 85 GLU C C 85 177.520 178.421 -0.901 1 1 924 . 6 1 1 A 85 85 GLU CA C 85 62.429 59.571 2.858 1 1 925 . 6 1 1 A 85 85 GLU CB C 85 29.655 29.388 0.267 1 1 927 . 6 1 1 A 86 86 ALA H H 86 8.443 8.071 0.372 1 1 928 . 6 1 1 A 86 86 ALA HA H 86 4.027 4.003 0.024 1 1 932 . 6 1 1 A 86 86 ALA C C 86 180.423 180.044 0.379 1 1 933 . 6 1 1 A 86 86 ALA CA C 86 55.145 54.720 0.425 1 1 934 . 6 1 1 A 86 86 ALA CB C 86 18.165 18.142 0.023 1 1 935 . 6 1 1 A 86 86 ALA N N 86 119.636 122.863 -3.227 1 1 936 . 6 1 1 A 87 87 ALA H H 87 7.214 7.442 -0.228 1 1 937 . 6 1 1 A 87 87 ALA HA H 87 4.244 4.036 0.208 1 1 941 . 6 1 1 A 87 87 ALA C C 87 180.354 180.166 0.188 1 1 942 . 6 1 1 A 87 87 ALA CA C 87 54.378 54.871 -0.493 1 1 943 . 6 1 1 A 87 87 ALA CB C 87 18.795 18.497 0.298 1 1 944 . 6 1 1 A 87 87 ALA N N 87 121.004 120.155 0.849 1 1 945 . 6 1 1 A 88 88 ILE H H 88 8.471 7.503 0.968 1 1 946 . 6 1 1 A 88 88 ILE HA H 88 3.360 3.696 -0.336 1 1 954 . 6 1 1 A 88 88 ILE CA C 88 66.323 64.760 1.563 1 1 955 . 6 1 1 A 88 88 ILE CB C 88 37.808 37.758 0.050 1 1 958 . 6 1 1 A 88 88 ILE N N 88 120.743 119.924 0.819 1 1 959 . 6 1 1 A 89 89 VAL H H 89 8.343 8.192 0.151 1 1 960 . 6 1 1 A 89 89 VAL HA H 89 3.061 3.487 -0.426 1 1 968 . 6 1 1 A 89 89 VAL C C 89 176.708 177.779 -1.071 1 1 969 . 6 1 1 A 89 89 VAL CA C 89 67.833 66.662 1.171 1 1 970 . 6 1 1 A 89 89 VAL CB C 89 31.509 31.491 0.018 1 1 973 . 6 1 1 A 89 89 VAL N N 89 118.049 119.520 -1.471 1 1 974 . 6 1 1 A 90 90 ALA H H 90 7.516 7.814 -0.298 1 1 975 . 6 1 1 A 90 90 ALA HA H 90 3.987 3.865 0.122 1 1 979 . 6 1 1 A 90 90 ALA C C 90 180.744 179.182 1.562 1 1 980 . 6 1 1 A 90 90 ALA CA C 90 55.481 55.471 0.010 1 1 981 . 6 1 1 A 90 90 ALA CB C 90 17.953 17.800 0.153 1 1 982 . 6 1 1 A 90 90 ALA N N 90 118.935 121.337 -2.402 1 1 983 . 6 1 1 A 91 91 GLN H H 91 7.886 7.847 0.039 1 1 984 . 6 1 1 A 91 91 GLN HA H 91 4.190 4.061 0.129 1 1 991 . 6 1 1 A 91 91 GLN C C 91 178.832 178.514 0.318 1 1 992 . 6 1 1 A 91 91 GLN CA C 91 58.519 58.798 -0.279 1 1 993 . 6 1 1 A 91 91 GLN CB C 91 28.091 28.179 -0.088 1 1 995 . 6 1 1 A 91 91 GLN N N 91 117.846 118.345 -0.499 1 1 997 . 6 1 1 A 92 92 LEU H H 92 8.751 8.812 -0.061 1 1 998 . 6 1 1 A 92 92 LEU HA H 92 3.903 3.972 -0.069 1 1 1007 . 6 1 1 A 92 92 LEU C C 92 178.997 178.664 0.333 1 1 1008 . 6 1 1 A 92 92 LEU CA C 92 58.136 57.832 0.304 1 1 1009 . 6 1 1 A 92 92 LEU CB C 92 41.576 41.127 0.449 1 1 1013 . 6 1 1 A 92 92 LEU N N 92 119.547 119.616 -0.069 1 1 1014 . 6 1 1 A 93 93 PHE H H 93 8.648 7.916 0.732 1 1 1015 . 6 1 1 A 93 93 PHE HA H 93 4.270 4.219 0.051 1 1 1020 . 6 1 1 A 93 93 PHE C C 93 179.283 178.662 0.621 1 1 1021 . 6 1 1 A 93 93 PHE CA C 93 59.860 60.545 -0.685 1 1 1022 . 6 1 1 A 93 93 PHE CB C 93 37.765 38.577 -0.812 1 1 1025 . 6 1 1 A 93 93 PHE N N 93 118.041 119.353 -1.312 1 1 1026 . 6 1 1 A 94 94 GLU H H 94 7.739 8.254 -0.515 1 1 1027 . 6 1 1 A 94 94 GLU HA H 94 4.110 4.124 -0.014 1 1 1031 . 6 1 1 A 94 94 GLU C C 94 178.629 179.001 -0.372 1 1 1032 . 6 1 1 A 94 94 GLU CA C 94 59.359 59.319 0.040 1 1 1033 . 6 1 1 A 94 94 GLU CB C 94 29.589 29.166 0.423 1 1 1035 . 6 1 1 A 94 94 GLU N N 94 119.980 117.462 2.518 1 1 1036 . 6 1 1 A 95 95 LEU H H 95 7.999 8.114 -0.115 1 1 1037 . 6 1 1 A 95 95 LEU HA H 95 4.139 3.989 0.150 1 1 1047 . 6 1 1 A 95 95 LEU C C 95 178.965 178.097 0.868 1 1 1048 . 6 1 1 A 95 95 LEU CA C 95 57.557 57.919 -0.362 1 1 1049 . 6 1 1 A 95 95 LEU CB C 95 43.443 41.525 1.918 1 1 1053 . 6 1 1 A 95 95 LEU N N 95 118.398 121.035 -2.637 1 1 1054 . 6 1 1 A 96 96 LEU H H 96 8.363 8.065 0.298 1 1 1055 . 6 1 1 A 96 96 LEU HA H 96 4.503 4.278 0.225 1 1 1061 . 6 1 1 A 96 96 LEU C C 96 177.932 176.684 1.248 1 1 1062 . 6 1 1 A 96 96 LEU CA C 96 54.700 54.839 -0.139 1 1 1063 . 6 1 1 A 96 96 LEU CB C 96 43.048 42.284 0.764 1 1 1065 . 6 1 1 A 96 96 LEU N N 96 114.720 116.912 -2.192 1 1 1066 . 6 1 1 A 97 97 GLY H H 97 7.810 7.887 -0.077 1 1 1067 . 6 1 1 A 97 97 GLY HA2 H 97 3.963 3.891 0.072 1 1 1068 . 6 1 1 A 97 97 GLY C C 97 173.535 174.167 -0.632 1 1 1069 . 6 1 1 A 97 97 GLY CA C 97 45.667 46.616 -0.949 1 1 1070 . 6 1 1 A 97 97 GLY N N 97 109.511 108.274 1.237 1 1 1071 . 6 1 1 A 98 98 SER H H 98 8.131 7.730 0.401 1 1 1072 . 6 1 1 A 98 98 SER HA H 98 4.225 4.790 -0.565 1 1 1075 . 6 1 1 A 98 98 SER C C 98 174.974 174.046 0.928 1 1 1076 . 6 1 1 A 98 98 SER CA C 98 57.960 57.685 0.275 1 1 1077 . 6 1 1 A 98 98 SER CB C 98 63.997 65.424 -1.427 1 1 1078 . 6 1 1 A 98 98 SER N N 98 113.405 115.139 -1.734 1 1 1079 . 6 1 1 A 99 99 GLY H H 99 8.052 8.884 -0.832 1 1 1080 . 6 1 1 A 99 99 GLY HA2 H 99 3.998 3.949 0.049 1 1 1081 . 6 1 1 A 99 99 GLY HA3 H 99 3.778 3.982 -0.204 1 1 1082 . 6 1 1 A 99 99 GLY C C 99 174.033 174.110 -0.077 1 1 1083 . 6 1 1 A 99 99 GLY CA C 99 45.123 45.397 -0.274 1 1 1084 . 6 1 1 A 99 99 GLY N N 99 111.534 113.863 -2.329 1 1 1085 . 6 1 1 A 100 100 GLU H H 100 8.177 7.761 0.416 1 1 1086 . 6 1 1 A 100 100 GLU HA H 100 4.201 4.425 -0.224 1 1 1091 . 6 1 1 A 100 100 GLU C C 100 175.830 176.412 -0.582 1 1 1092 . 6 1 1 A 100 100 GLU CA C 100 56.442 56.262 0.180 1 1 1093 . 6 1 1 A 100 100 GLU CB C 100 30.428 30.791 -0.363 1 1 1095 . 6 1 1 A 100 100 GLU N N 100 120.463 120.513 -0.050 1 1 1096 . 6 1 1 A 101 101 GLN H H 101 8.161 8.431 -0.270 1 1 1097 . 6 1 1 A 101 101 GLN HA H 101 4.098 4.215 -0.117 1 1 1103 . 6 1 1 A 101 101 GLN C C 101 175.412 175.353 0.059 1 1 1104 . 6 1 1 A 101 101 GLN CA C 101 55.632 55.897 -0.265 1 1 1105 . 6 1 1 A 101 101 GLN CB C 101 29.569 29.014 0.555 1 1 1107 . 6 1 1 A 101 101 GLN N N 101 120.014 120.989 -0.975 1 1 1109 . 6 1 1 A 102 102 LYS H H 102 8.235 8.385 -0.150 1 1 1110 . 6 1 1 A 102 102 LYS HA H 102 4.387 3.715 0.672 1 1 1117 . 6 1 1 A 102 102 LYS CA C 102 54.116 54.431 -0.315 1 1 1118 . 6 1 1 A 102 102 LYS CB C 102 32.478 32.309 0.169 1 1 1122 . 6 1 1 A 102 102 LYS N N 102 123.399 122.372 1.027 1 1 1123 . 6 1 1 A 103 103 PRO HA H 103 4.498 4.363 0.135 1 1 1129 . 6 1 1 A 103 103 PRO C C 103 175.473 177.036 -1.563 1 1 1130 . 6 1 1 A 103 103 PRO CA C 103 62.802 65.602 -2.800 1 1 1131 . 6 1 1 A 103 103 PRO CB C 103 32.124 31.626 0.498 1 1 1134 . 6 1 1 A 104 104 ALA H H 104 8.017 7.264 0.753 1 1 1135 . 6 1 1 A 104 104 ALA HA H 104 4.318 4.369 -0.051 1 1 1139 . 6 1 1 A 104 104 ALA C C 104 176.717 176.925 -0.208 1 1 1140 . 6 1 1 A 104 104 ALA CA C 104 52.194 53.237 -1.043 1 1 1141 . 6 1 1 A 104 104 ALA CB C 104 20.113 20.370 -0.257 1 1 1142 . 6 1 1 A 104 104 ALA N N 104 122.093 117.562 4.531 1 1 1143 . 6 1 1 A 105 105 GLY H H 105 7.678 8.249 -0.571 1 1 1144 . 6 1 1 A 105 105 GLY HA2 H 105 3.851 4.061 -0.210 1 1 1145 . 6 1 1 A 105 105 GLY HA3 H 105 4.053 4.070 -0.017 1 1 1146 . 6 1 1 A 105 105 GLY C C 105 172.990 174.859 -1.869 1 1 1147 . 6 1 1 A 105 105 GLY CA C 105 44.241 43.488 0.753 1 1 1148 . 6 1 1 A 105 105 GLY N N 105 105.234 104.289 0.945 1 1 1149 . 6 1 1 A 106 106 VAL H H 106 8.409 8.744 -0.335 1 1 1150 . 6 1 1 A 106 106 VAL HA H 106 2.829 3.351 -0.522 1 1 1158 . 6 1 1 A 106 106 VAL C C 106 177.822 177.214 0.608 1 1 1159 . 6 1 1 A 106 106 VAL CA C 106 65.522 65.532 -0.010 1 1 1160 . 6 1 1 A 106 106 VAL CB C 106 30.701 30.668 0.033 1 1 1163 . 6 1 1 A 106 106 VAL N N 106 119.215 119.136 0.079 1 1 1164 . 6 1 1 A 107 107 ALA H H 107 8.707 8.248 0.459 1 1 1165 . 6 1 1 A 107 107 ALA HA H 107 3.730 3.785 -0.055 1 1 1169 . 6 1 1 A 107 107 ALA C C 107 179.661 180.218 -0.557 1 1 1170 . 6 1 1 A 107 107 ALA CA C 107 54.995 55.346 -0.351 1 1 1171 . 6 1 1 A 107 107 ALA CB C 107 17.705 17.980 -0.275 1 1 1172 . 6 1 1 A 107 107 ALA N N 107 118.672 121.981 -3.309 1 1 1173 . 6 1 1 A 108 108 ALA H H 108 7.388 7.831 -0.443 1 1 1174 . 6 1 1 A 108 108 ALA HA H 108 4.259 4.026 0.233 1 1 1178 . 6 1 1 A 108 108 ALA C C 108 179.318 179.417 -0.099 1 1 1179 . 6 1 1 A 108 108 ALA CA C 108 53.481 55.056 -1.575 1 1 1180 . 6 1 1 A 108 108 ALA CB C 108 19.367 18.399 0.968 1 1 1181 . 6 1 1 A 108 108 ALA N N 108 116.635 120.728 -4.093 1 1 1182 . 6 1 1 A 109 109 VAL H H 109 7.689 7.519 0.170 1 1 1183 . 6 1 1 A 109 109 VAL HA H 109 4.532 3.845 0.687 1 1 1191 . 6 1 1 A 109 109 VAL C C 109 176.055 178.005 -1.950 1 1 1192 . 6 1 1 A 109 109 VAL CA C 109 61.452 65.656 -4.204 1 1 1193 . 6 1 1 A 109 109 VAL CB C 109 32.728 31.325 1.403 1 1 1196 . 6 1 1 A 109 109 VAL N N 109 112.851 117.071 -4.220 1 1 1197 . 6 1 1 A 110 110 LEU H H 110 7.099 8.138 -1.039 1 1 1198 . 6 1 1 A 110 110 LEU HA H 110 3.723 3.843 -0.120 1 1 1208 . 6 1 1 A 110 110 LEU C C 110 179.040 178.844 0.196 1 1 1209 . 6 1 1 A 110 110 LEU CA C 110 58.825 57.925 0.900 1 1 1210 . 6 1 1 A 110 110 LEU CB C 110 41.242 41.827 -0.585 1 1 1214 . 6 1 1 A 110 110 LEU N N 110 119.829 124.960 -5.131 1 1 1215 . 6 1 1 A 111 111 GLY H H 111 8.435 7.727 0.708 1 1 1216 . 6 1 1 A 111 111 GLY HA2 H 111 3.970 3.833 0.137 1 1 1217 . 6 1 1 A 111 111 GLY HA3 H 111 3.885 3.844 0.041 1 1 1218 . 6 1 1 A 111 111 GLY C C 111 178.031 176.795 1.236 1 1 1219 . 6 1 1 A 111 111 GLY CA C 111 46.961 47.549 -0.588 1 1 1220 . 6 1 1 A 111 111 GLY N N 111 104.089 106.601 -2.512 1 1 1221 . 6 1 1 A 112 112 SER H H 112 8.343 8.011 0.332 1 1 1222 . 6 1 1 A 112 112 SER HA H 112 4.266 4.115 0.151 1 1 1224 . 6 1 1 A 112 112 SER C C 112 175.885 175.130 0.755 1 1 1225 . 6 1 1 A 112 112 SER CA C 112 61.304 62.592 -1.288 1 1 1226 . 6 1 1 A 112 112 SER CB C 112 62.901 62.954 -0.053 1 1 1227 . 6 1 1 A 112 112 SER N N 112 119.497 119.516 -0.019 1 1 1228 . 6 1 1 A 113 113 LEU H H 113 7.667 8.030 -0.363 1 1 1229 . 6 1 1 A 113 113 LEU HA H 113 4.343 4.197 0.146 1 1 1238 . 6 1 1 A 113 113 LEU C C 113 174.760 176.044 -1.284 1 1 1239 . 6 1 1 A 113 113 LEU CA C 113 54.228 54.505 -0.277 1 1 1240 . 6 1 1 A 113 113 LEU CB C 113 41.467 41.906 -0.439 1 1 1244 . 6 1 1 A 113 113 LEU N N 113 118.843 117.646 1.197 1 1 1245 . 6 1 1 A 114 114 LYS H H 114 7.685 7.870 -0.185 1 1 1246 . 6 1 1 A 114 114 LYS HA H 114 3.958 3.852 0.106 1 1 1250 . 6 1 1 A 114 114 LYS C C 114 177.557 175.489 2.068 1 1 1251 . 6 1 1 A 114 114 LYS CA C 114 56.935 57.390 -0.455 1 1 1252 . 6 1 1 A 114 114 LYS CB C 114 28.898 29.456 -0.558 1 1 1254 . 6 1 1 A 114 114 LYS N N 114 114.072 116.630 -2.558 1 1 1255 . 6 1 1 A 115 115 LEU H H 115 8.329 7.755 0.574 1 1 1256 . 6 1 1 A 115 115 LEU HA H 115 4.315 4.437 -0.122 1 1 1265 . 6 1 1 A 115 115 LEU C C 115 175.988 177.731 -1.743 1 1 1266 . 6 1 1 A 115 115 LEU CA C 115 54.310 54.439 -0.129 1 1 1267 . 6 1 1 A 115 115 LEU CB C 115 44.163 42.597 1.566 1 1 1270 . 6 1 1 A 115 115 LEU N N 115 117.951 119.407 -1.456 1 1 1271 . 6 1 1 A 116 116 GLN H H 116 9.100 8.675 0.425 1 1 1272 . 6 1 1 A 116 116 GLN HA H 116 4.898 4.957 -0.059 1 1 1279 . 6 1 1 A 116 116 GLN CA C 116 53.467 54.863 -1.396 1 1 1280 . 6 1 1 A 116 116 GLN CB C 116 32.730 30.783 1.947 1 1 1282 . 6 1 1 A 116 116 GLN N N 116 119.994 119.759 0.235 1 1 1284 . 6 1 1 A 117 117 GLU H H 117 8.849 8.447 0.402 1 1 1285 . 6 1 1 A 117 117 GLU HA H 117 3.707 3.421 0.286 1 1 1290 . 6 1 1 A 117 117 GLU C C 117 177.303 176.016 1.287 1 1 1291 . 6 1 1 A 117 117 GLU CA C 117 57.233 55.168 2.065 1 1 1292 . 6 1 1 A 117 117 GLU CB C 117 29.634 28.888 0.746 1 1 1294 . 6 1 1 A 117 117 GLU N N 117 121.487 123.487 -2.000 1 1 1295 . 6 1 1 A 118 118 VAL H H 118 8.983 8.177 0.806 1 1 1296 . 6 1 1 A 118 118 VAL HA H 118 4.360 3.760 0.600 1 1 1304 . 6 1 1 A 118 118 VAL C C 118 174.171 175.400 -1.229 1 1 1305 . 6 1 1 A 118 118 VAL CA C 118 61.772 64.156 -2.384 1 1 1306 . 6 1 1 A 118 118 VAL CB C 118 34.095 32.524 1.571 1 1 1309 . 6 1 1 A 118 118 VAL N N 118 122.933 127.260 -4.327 1 1 1310 . 6 1 1 A 119 119 ALA H H 119 7.023 7.021 0.002 1 1 1311 . 6 1 1 A 119 119 ALA HA H 119 4.378 4.444 -0.066 1 1 1315 . 6 1 1 A 119 119 ALA C C 119 175.493 174.897 0.596 1 1 1316 . 6 1 1 A 119 119 ALA CA C 119 51.956 51.411 0.545 1 1 1317 . 6 1 1 A 119 119 ALA CB C 119 23.957 21.419 2.538 1 1 1318 . 6 1 1 A 119 119 ALA N N 119 117.379 121.004 -3.625 1 1 1319 . 6 1 1 A 120 120 SER H H 120 6.999 8.577 -1.578 1 1 1320 . 6 1 1 A 120 120 SER HA H 120 5.208 5.657 -0.449 1 1 1323 . 6 1 1 A 120 120 SER C C 120 173.082 173.047 0.035 1 1 1324 . 6 1 1 A 120 120 SER CA C 120 56.754 56.560 0.194 1 1 1325 . 6 1 1 A 120 120 SER CB C 120 64.605 65.224 -0.619 1 1 1326 . 6 1 1 A 120 120 SER N N 120 113.743 117.174 -3.431 1 1 1327 . 6 1 1 A 121 121 PHE H H 121 8.244 9.020 -0.776 1 1 1328 . 6 1 1 A 121 121 PHE HA H 121 5.177 5.259 -0.082 1 1 1333 . 6 1 1 A 121 121 PHE C C 121 173.569 172.656 0.913 1 1 1334 . 6 1 1 A 121 121 PHE CA C 121 55.555 55.427 0.128 1 1 1335 . 6 1 1 A 121 121 PHE CB C 121 40.959 42.215 -1.256 1 1 1338 . 6 1 1 A 121 121 PHE N N 121 120.358 122.224 -1.866 1 1 1339 . 6 1 1 A 122 122 ILE H H 122 8.907 8.606 0.301 1 1 1340 . 6 1 1 A 122 122 ILE HA H 122 4.682 4.370 0.312 1 1 1348 . 6 1 1 A 122 122 ILE C C 122 176.925 175.281 1.644 1 1 1349 . 6 1 1 A 122 122 ILE CA C 122 60.740 61.611 -0.871 1 1 1350 . 6 1 1 A 122 122 ILE CB C 122 39.497 37.764 1.733 1 1 1353 . 6 1 1 A 122 122 ILE N N 122 121.282 121.773 -0.491 1 1 1354 . 6 1 1 A 123 123 THR H H 123 9.022 9.310 -0.288 1 1 1355 . 6 1 1 A 123 123 THR HA H 123 5.039 5.016 0.023 1 1 1360 . 6 1 1 A 123 123 THR C C 123 173.531 173.457 0.074 1 1 1361 . 6 1 1 A 123 123 THR CA C 123 62.266 61.778 0.488 1 1 1362 . 6 1 1 A 123 123 THR CB C 123 70.677 69.442 1.235 1 1 1364 . 6 1 1 A 123 123 THR N N 123 128.965 124.204 4.761 1 1 1365 . 6 1 1 A 124 124 THR H H 124 8.961 8.958 0.003 1 1 1366 . 6 1 1 A 124 124 THR HA H 124 5.001 4.983 0.018 1 1 1371 . 6 1 1 A 124 124 THR C C 124 173.468 172.584 0.884 1 1 1372 . 6 1 1 A 124 124 THR CA C 124 62.109 61.653 0.456 1 1 1373 . 6 1 1 A 124 124 THR CB C 124 70.450 69.408 1.042 1 1 1375 . 6 1 1 A 124 124 THR N N 124 122.176 123.668 -1.492 1 1 1376 . 6 1 1 A 125 125 ARG H H 125 9.386 9.553 -0.167 1 1 1377 . 6 1 1 A 125 125 ARG HA H 125 5.764 5.281 0.483 1 1 1384 . 6 1 1 A 125 125 ARG C C 125 175.713 174.678 1.035 1 1 1385 . 6 1 1 A 125 125 ARG CA C 125 53.991 54.456 -0.465 1 1 1386 . 6 1 1 A 125 125 ARG CB C 125 33.557 33.236 0.321 1 1 1389 . 6 1 1 A 125 125 ARG N N 125 130.004 128.871 1.133 1 1 1390 . 6 1 1 A 126 126 SER H H 126 9.172 9.614 -0.442 1 1 1391 . 6 1 1 A 126 126 SER HA H 126 5.390 5.556 -0.166 1 1 1394 . 6 1 1 A 126 126 SER C C 126 172.359 173.267 -0.908 1 1 1395 . 6 1 1 A 126 126 SER CA C 126 56.934 56.645 0.289 1 1 1396 . 6 1 1 A 126 126 SER CB C 126 65.827 65.560 0.267 1 1 1397 . 6 1 1 A 126 126 SER N N 126 119.906 120.976 -1.070 1 1 1398 . 6 1 1 A 127 127 SER H H 127 8.591 9.161 -0.570 1 1 1399 . 6 1 1 A 127 127 SER HA H 127 5.739 5.379 0.360 1 1 1401 . 6 1 1 A 127 127 SER C C 127 173.283 173.139 0.144 1 1 1402 . 6 1 1 A 127 127 SER CA C 127 57.354 57.680 -0.326 1 1 1403 . 6 1 1 A 127 127 SER CB C 127 65.412 64.525 0.887 1 1 1404 . 6 1 1 A 127 127 SER N N 127 117.914 120.581 -2.667 1 1 1405 . 6 1 1 A 128 128 TRP H H 128 9.866 9.627 0.239 1 1 1406 . 6 1 1 A 128 128 TRP HA H 128 5.560 5.791 -0.231 1 1 1415 . 6 1 1 A 128 128 TRP C C 128 175.828 175.453 0.375 1 1 1416 . 6 1 1 A 128 128 TRP CA C 128 55.852 55.641 0.211 1 1 1417 . 6 1 1 A 128 128 TRP CB C 128 32.524 33.137 -0.613 1 1 1423 . 6 1 1 A 128 128 TRP N N 128 127.978 126.021 1.957 1 1 1425 . 6 1 1 A 129 129 LYS H H 129 9.424 9.445 -0.021 1 1 1426 . 6 1 1 A 129 129 LYS HA H 129 5.388 5.372 0.016 1 1 1433 . 6 1 1 A 129 129 LYS C C 129 175.254 174.390 0.864 1 1 1434 . 6 1 1 A 129 129 LYS CA C 129 54.410 54.585 -0.175 1 1 1435 . 6 1 1 A 129 129 LYS CB C 129 35.734 36.932 -1.198 1 1 1439 . 6 1 1 A 129 129 LYS N N 129 121.784 118.900 2.884 1 1 1440 . 6 1 1 A 130 130 LEU H H 130 8.933 9.200 -0.267 1 1 1441 . 6 1 1 A 130 130 LEU HA H 130 4.859 4.978 -0.119 1 1 1447 . 6 1 1 A 130 130 LEU C C 130 173.893 174.173 -0.280 1 1 1448 . 6 1 1 A 130 130 LEU CA C 130 53.848 54.285 -0.437 1 1 1449 . 6 1 1 A 130 130 LEU CB C 130 46.125 45.956 0.169 1 1 1451 . 6 1 1 A 130 130 LEU N N 130 124.543 122.267 2.276 1 1 1452 . 6 1 1 A 131 131 ALA H H 131 8.816 8.796 0.020 1 1 1453 . 6 1 1 A 131 131 ALA HA H 131 4.776 5.041 -0.265 1 1 1457 . 6 1 1 A 131 131 ALA C C 131 176.662 176.078 0.584 1 1 1458 . 6 1 1 A 131 131 ALA CA C 131 51.407 50.442 0.965 1 1 1459 . 6 1 1 A 131 131 ALA CB C 131 19.354 20.279 -0.925 1 1 1460 . 6 1 1 A 131 131 ALA N N 131 131.102 128.951 2.151 1 1 1461 . 6 1 1 A 132 132 LEU H H 132 8.487 9.011 -0.524 1 1 1462 . 6 1 1 A 132 132 LEU HA H 132 4.470 4.431 0.039 1 1 1470 . 6 1 1 A 132 132 LEU C C 132 176.873 177.821 -0.948 1 1 1471 . 6 1 1 A 132 132 LEU CA C 132 54.590 55.347 -0.757 1 1 1472 . 6 1 1 A 132 132 LEU CB C 132 42.974 41.167 1.807 1 1 1475 . 6 1 1 A 132 132 LEU N N 132 123.724 125.903 -2.179 1 1 1476 . 6 1 1 A 133 133 SER H H 133 8.448 8.797 -0.349 1 1 1477 . 6 1 1 A 133 133 SER HA H 133 4.560 4.529 0.031 1 1 1479 . 6 1 1 A 133 133 SER C C 133 176.043 175.500 0.543 1 1 1480 . 6 1 1 A 133 133 SER CA C 133 58.460 58.742 -0.282 1 1 1481 . 6 1 1 A 133 133 SER CB C 133 63.985 64.211 -0.226 1 1 1482 . 6 1 1 A 133 133 SER N N 133 115.880 117.786 -1.906 1 1 1483 . 6 1 1 A 134 134 GLY H H 134 8.232 8.140 0.092 1 1 1484 . 6 1 1 A 134 134 GLY HA2 H 134 4.147 3.944 0.203 1 1 1485 . 6 1 1 A 134 134 GLY HA3 H 134 4.045 3.950 0.095 1 1 1486 . 6 1 1 A 134 134 GLY C C 134 174.013 173.770 0.243 1 1 1487 . 6 1 1 A 134 134 GLY CA C 134 45.337 45.776 -0.439 1 1 1488 . 6 1 1 A 134 134 GLY N N 134 109.970 109.501 0.469 1 1 1489 . 6 1 1 A 135 135 ALA H H 135 8.424 7.662 0.762 1 1 1490 . 6 1 1 A 135 135 ALA HA H 135 4.436 4.972 -0.536 1 1 1494 . 6 1 1 A 135 135 ALA C C 135 177.537 174.980 2.557 1 1 1495 . 6 1 1 A 135 135 ALA CA C 135 52.721 51.331 1.390 1 1 1496 . 6 1 1 A 135 135 ALA CB C 135 19.265 23.005 -3.740 1 1 1497 . 6 1 1 A 135 135 ALA N N 135 124.118 121.645 2.473 1 1 1498 . 6 1 1 A 136 136 HIS H H 136 8.466 9.087 -0.621 1 1 1499 . 6 1 1 A 136 136 HIS HA H 136 4.379 5.203 -0.824 1 1 1500 . 6 1 1 A 136 136 HIS C C 136 176.259 175.405 0.854 1 1 1501 . 6 1 1 A 136 136 HIS CA C 136 56.082 54.720 1.362 1 1 1502 . 6 1 1 A 136 136 HIS CB C 136 29.619 32.901 -3.282 1 1 1503 . 6 1 1 A 136 136 HIS N N 136 119.493 122.697 -3.204 1 1 1504 . 6 1 1 A 137 137 GLY H H 137 8.431 8.111 0.320 1 1 1505 . 6 1 1 A 137 137 GLY HA2 H 137 4.151 3.708 0.443 1 1 1506 . 6 1 1 A 137 137 GLY HA3 H 137 3.893 3.827 0.066 1 1 1507 . 6 1 1 A 137 137 GLY C C 137 174.039 174.221 -0.182 1 1 1508 . 6 1 1 A 137 137 GLY CA C 137 45.372 45.840 -0.468 1 1 1509 . 6 1 1 A 137 137 GLY N N 137 110.442 114.698 -4.256 1 1 1510 . 6 1 1 A 138 138 GLN H H 138 8.416 7.783 0.633 1 1 1511 . 6 1 1 A 138 138 GLN HA H 138 4.455 4.391 0.064 1 1 1515 . 6 1 1 A 138 138 GLN C C 138 175.889 175.032 0.857 1 1 1516 . 6 1 1 A 138 138 GLN CA C 138 55.866 55.300 0.566 1 1 1517 . 6 1 1 A 138 138 GLN CB C 138 29.639 29.155 0.484 1 1 1518 . 6 1 1 A 138 138 GLN N N 138 119.401 120.504 -1.103 1 1 1519 . 6 1 1 A 139 139 GLU H H 139 8.446 8.669 -0.223 1 1 1520 . 6 1 1 A 139 139 GLU HA H 139 4.658 4.892 -0.234 1 1 1524 . 6 1 1 A 139 139 GLU CA C 139 54.589 53.127 1.462 1 1 1525 . 6 1 1 A 139 139 GLU CB C 139 29.733 30.447 -0.714 1 1 1527 . 6 1 1 A 139 139 GLU N N 139 123.136 124.751 -1.615 1 1 1528 . 6 1 1 A 140 140 PRO HA H 140 4.537 4.902 -0.365 1 1 1533 . 6 1 1 A 140 140 PRO C C 140 176.119 175.974 0.145 1 1 1534 . 6 1 1 A 140 140 PRO CA C 140 63.220 62.411 0.809 1 1 1535 . 6 1 1 A 140 140 PRO CB C 140 31.936 31.251 0.685 1 1 1538 . 6 1 1 A 141 141 GLN H H 141 8.506 8.485 0.021 1 1 1539 . 6 1 1 A 141 141 GLN HA H 141 4.650 4.743 -0.093 1 1 1546 . 6 1 1 A 141 141 GLN C C 141 175.811 175.566 0.245 1 1 1547 . 6 1 1 A 141 141 GLN CA C 141 55.912 55.220 0.692 1 1 1548 . 6 1 1 A 141 141 GLN CB C 141 30.241 28.801 1.440 1 1 1550 . 6 1 1 A 141 141 GLN N N 141 120.422 123.934 -3.512 1 1 1551 . 6 1 1 A 142 142 LEU H H 142 8.842 8.895 -0.053 1 1 1552 . 6 1 1 A 142 142 LEU HA H 142 5.277 5.267 0.010 1 1 1562 . 6 1 1 A 142 142 LEU C C 142 176.839 175.244 1.595 1 1 1563 . 6 1 1 A 142 142 LEU CA C 142 53.927 52.918 1.009 1 1 1564 . 6 1 1 A 142 142 LEU CB C 142 44.527 44.927 -0.400 1 1 1568 . 6 1 1 A 142 142 LEU N N 142 123.692 120.215 3.477 1 1 1569 . 6 1 1 A 143 143 THR H H 143 9.025 8.777 0.248 1 1 1570 . 6 1 1 A 143 143 THR HA H 143 5.262 5.050 0.212 1 1 1575 . 6 1 1 A 143 143 THR C C 143 173.753 173.842 -0.089 1 1 1576 . 6 1 1 A 143 143 THR CA C 143 61.795 61.771 0.024 1 1 1577 . 6 1 1 A 143 143 THR CB C 143 70.660 70.749 -0.089 1 1 1579 . 6 1 1 A 143 143 THR N N 143 117.222 115.604 1.618 1 1 1580 . 6 1 1 A 144 144 ILE H H 144 9.353 10.242 -0.889 1 1 1581 . 6 1 1 A 144 144 ILE HA H 144 5.399 5.052 0.347 1 1 1591 . 6 1 1 A 144 144 ILE C C 144 173.931 173.763 0.168 1 1 1592 . 6 1 1 A 144 144 ILE CA C 144 60.774 60.379 0.395 1 1 1593 . 6 1 1 A 144 144 ILE CB C 144 41.111 39.631 1.480 1 1 1597 . 6 1 1 A 144 144 ILE N N 144 126.383 128.031 -1.648 1 1 1598 . 6 1 1 A 145 145 ASP H H 145 9.214 9.590 -0.376 1 1 1599 . 6 1 1 A 145 145 ASP HA H 145 5.978 5.424 0.554 1 1 1601 . 6 1 1 A 145 145 ASP C C 145 175.441 175.024 0.417 1 1 1602 . 6 1 1 A 145 145 ASP CA C 145 53.035 52.842 0.193 1 1 1603 . 6 1 1 A 145 145 ASP CB C 145 44.153 43.847 0.306 1 1 1604 . 6 1 1 A 145 145 ASP N N 145 127.981 128.828 -0.847 1 1 1605 . 6 1 1 A 146 146 LEU H H 146 9.387 9.877 -0.490 1 1 1606 . 6 1 1 A 146 146 LEU HA H 146 4.918 5.296 -0.378 1 1 1616 . 6 1 1 A 146 146 LEU C C 146 175.003 174.647 0.356 1 1 1617 . 6 1 1 A 146 146 LEU CA C 146 53.940 53.579 0.361 1 1 1618 . 6 1 1 A 146 146 LEU CB C 146 43.902 42.962 0.940 1 1 1622 . 6 1 1 A 146 146 LEU N N 146 123.532 126.939 -3.407 1 1 1623 . 6 1 1 A 147 147 ASP H H 147 8.676 8.916 -0.240 1 1 1624 . 6 1 1 A 147 147 ASP HA H 147 5.205 5.264 -0.059 1 1 1627 . 6 1 1 A 147 147 ASP C C 147 174.956 174.532 0.424 1 1 1628 . 6 1 1 A 147 147 ASP CA C 147 53.441 52.477 0.964 1 1 1629 . 6 1 1 A 147 147 ASP CB C 147 43.370 43.290 0.080 1 1 1630 . 6 1 1 A 147 147 ASP N N 147 125.499 126.182 -0.683 1 1 1631 . 6 1 1 A 148 148 SER H H 148 8.732 8.944 -0.212 1 1 1632 . 6 1 1 A 148 148 SER HA H 148 5.365 5.086 0.279 1 1 1634 . 6 1 1 A 148 148 SER C C 148 173.217 173.394 -0.177 1 1 1635 . 6 1 1 A 148 148 SER CA C 148 56.334 55.782 0.552 1 1 1636 . 6 1 1 A 148 148 SER CB C 148 65.812 66.548 -0.736 1 1 1637 . 6 1 1 A 148 148 SER N N 148 118.623 119.235 -0.612 1 1 1638 . 6 1 1 A 149 149 ALA H H 149 8.937 8.765 0.172 1 1 1639 . 6 1 1 A 149 149 ALA HA H 149 5.681 5.078 0.603 1 1 1643 . 6 1 1 A 149 149 ALA C C 149 178.894 177.318 1.576 1 1 1644 . 6 1 1 A 149 149 ALA CA C 149 49.996 50.493 -0.497 1 1 1645 . 6 1 1 A 149 149 ALA CB C 149 23.231 22.974 0.257 1 1 1646 . 6 1 1 A 149 149 ALA N N 149 123.952 121.152 2.800 1 1 1647 . 6 1 1 A 150 150 ASP H H 150 9.010 8.973 0.037 1 1 1648 . 6 1 1 A 150 150 ASP HA H 150 4.336 4.153 0.183 1 1 1651 . 6 1 1 A 150 150 ASP C C 150 176.697 177.396 -0.699 1 1 1652 . 6 1 1 A 150 150 ASP CA C 150 56.543 57.566 -1.023 1 1 1653 . 6 1 1 A 150 150 ASP CB C 150 39.850 40.737 -0.887 1 1 1654 . 6 1 1 A 150 150 ASP N N 150 122.687 119.904 2.783 1 1 1655 . 6 1 1 A 151 151 PHE H H 151 7.295 7.778 -0.483 1 1 1656 . 6 1 1 A 151 151 PHE HA H 151 5.020 4.700 0.320 1 1 1661 . 6 1 1 A 151 151 PHE C C 151 174.756 175.461 -0.705 1 1 1662 . 6 1 1 A 151 151 PHE CA C 151 56.594 56.937 -0.343 1 1 1663 . 6 1 1 A 151 151 PHE CB C 151 37.765 37.048 0.717 1 1 1666 . 6 1 1 A 151 151 PHE N N 151 113.928 115.755 -1.827 1 1 1667 . 6 1 1 A 152 152 GLY H H 152 7.786 8.177 -0.391 1 1 1668 . 6 1 1 A 152 152 GLY HA2 H 152 4.459 3.971 0.488 1 1 1669 . 6 1 1 A 152 152 GLY HA3 H 152 3.728 3.977 -0.249 1 1 1670 . 6 1 1 A 152 152 GLY C C 152 172.709 173.761 -1.052 1 1 1671 . 6 1 1 A 152 152 GLY CA C 152 46.106 47.226 -1.120 1 1 1672 . 6 1 1 A 152 152 GLY N N 152 110.312 107.248 3.064 1 1 1673 . 6 1 1 A 153 153 TYR H H 153 6.650 7.560 -0.910 1 1 1674 . 6 1 1 A 153 153 TYR HA H 153 4.508 4.964 -0.456 1 1 1679 . 6 1 1 A 153 153 TYR C C 153 173.092 173.973 -0.881 1 1 1680 . 6 1 1 A 153 153 TYR CA C 153 57.464 56.496 0.968 1 1 1681 . 6 1 1 A 153 153 TYR CB C 153 41.962 41.329 0.633 1 1 1684 . 6 1 1 A 153 153 TYR N N 153 121.977 119.713 2.264 1 1 1685 . 6 1 1 A 154 154 ALA H H 154 7.847 8.707 -0.860 1 1 1686 . 6 1 1 A 154 154 ALA HA H 154 5.144 4.685 0.459 1 1 1690 . 6 1 1 A 154 154 ALA C C 154 174.468 175.361 -0.893 1 1 1691 . 6 1 1 A 154 154 ALA CA C 154 51.776 51.427 0.349 1 1 1692 . 6 1 1 A 154 154 ALA CB C 154 21.747 20.720 1.027 1 1 1693 . 6 1 1 A 154 154 ALA N N 154 130.258 130.510 -0.252 1 1 1694 . 6 1 1 A 155 155 VAL H H 155 8.733 9.051 -0.318 1 1 1695 . 6 1 1 A 155 155 VAL HA H 155 4.150 4.872 -0.722 1 1 1700 . 6 1 1 A 155 155 VAL C C 155 172.632 173.511 -0.879 1 1 1701 . 6 1 1 A 155 155 VAL CA C 155 61.451 59.189 2.262 1 1 1702 . 6 1 1 A 155 155 VAL CB C 155 35.883 35.228 0.655 1 1 1704 . 6 1 1 A 155 155 VAL N N 155 119.622 122.677 -3.055 1 1 1705 . 6 1 1 A 156 156 GLY H H 156 8.146 8.287 -0.141 1 1 1706 . 6 1 1 A 156 156 GLY HA2 H 156 5.125 2.712 2.413 1 1 1707 . 6 1 1 A 156 156 GLY HA3 H 156 2.061 3.977 -1.916 1 1 1708 . 6 1 1 A 156 156 GLY C C 156 171.746 171.505 0.241 1 1 1709 . 6 1 1 A 156 156 GLY CA C 156 43.319 43.638 -0.319 1 1 1710 . 6 1 1 A 156 156 GLY N N 156 113.332 113.433 -0.101 1 1 1711 . 6 1 1 A 157 157 GLU H H 157 8.967 8.723 0.244 1 1 1712 . 6 1 1 A 157 157 GLU HA H 157 5.217 5.336 -0.119 1 1 1716 . 6 1 1 A 157 157 GLU C C 157 174.476 175.190 -0.714 1 1 1717 . 6 1 1 A 157 157 GLU CA C 157 55.390 54.869 0.521 1 1 1718 . 6 1 1 A 157 157 GLU CB C 157 34.010 33.378 0.632 1 1 1720 . 6 1 1 A 157 157 GLU N N 157 120.823 121.833 -1.010 1 1 1721 . 6 1 1 A 158 158 VAL H H 158 9.076 9.416 -0.340 1 1 1722 . 6 1 1 A 158 158 VAL HA H 158 5.206 4.824 0.382 1 1 1727 . 6 1 1 A 158 158 VAL C C 158 173.900 174.226 -0.326 1 1 1728 . 6 1 1 A 158 158 VAL CA C 158 60.813 61.696 -0.883 1 1 1729 . 6 1 1 A 158 158 VAL CB C 158 33.385 33.123 0.262 1 1 1731 . 6 1 1 A 158 158 VAL N N 158 124.349 124.897 -0.548 1 1 1732 . 6 1 1 A 159 159 GLU H H 159 9.239 9.713 -0.474 1 1 1733 . 6 1 1 A 159 159 GLU HA H 159 5.647 5.229 0.418 1 1 1738 . 6 1 1 A 159 159 GLU C C 159 174.469 175.444 -0.975 1 1 1739 . 6 1 1 A 159 159 GLU CA C 159 54.473 54.641 -0.168 1 1 1740 . 6 1 1 A 159 159 GLU CB C 159 33.852 32.776 1.076 1 1 1742 . 6 1 1 A 159 159 GLU N N 159 125.772 128.689 -2.917 1 1 1743 . 6 1 1 A 160 160 ALA H H 160 9.250 9.235 0.015 1 1 1744 . 6 1 1 A 160 160 ALA HA H 160 4.966 5.419 -0.453 1 1 1748 . 6 1 1 A 160 160 ALA C C 160 175.114 175.477 -0.363 1 1 1749 . 6 1 1 A 160 160 ALA CA C 160 50.644 50.216 0.428 1 1 1750 . 6 1 1 A 160 160 ALA CB C 160 23.263 23.705 -0.442 1 1 1751 . 6 1 1 A 160 160 ALA N N 160 125.092 129.024 -3.932 1 1 1752 . 6 1 1 A 161 161 MET H H 161 8.559 8.937 -0.378 1 1 1753 . 6 1 1 A 161 161 MET HA H 161 5.468 5.597 -0.129 1 1 1761 . 6 1 1 A 161 161 MET C C 161 176.265 174.983 1.282 1 1 1762 . 6 1 1 A 161 161 MET CA C 161 53.818 54.304 -0.486 1 1 1763 . 6 1 1 A 161 161 MET CB C 161 34.380 35.313 -0.933 1 1 1766 . 6 1 1 A 161 161 MET N N 161 118.699 119.414 -0.715 1 1 1767 . 6 1 1 A 162 162 VAL H H 162 9.046 9.354 -0.308 1 1 1768 . 6 1 1 A 162 162 VAL HA H 162 4.841 4.927 -0.086 1 1 1776 . 6 1 1 A 162 162 VAL C C 162 174.794 175.138 -0.344 1 1 1777 . 6 1 1 A 162 162 VAL CA C 162 59.107 59.377 -0.270 1 1 1778 . 6 1 1 A 162 162 VAL CB C 162 34.018 34.084 -0.066 1 1 1781 . 6 1 1 A 162 162 VAL N N 162 116.435 118.056 -1.621 1 1 1782 . 6 1 1 A 163 163 HIS H H 163 8.793 8.901 -0.108 1 1 1783 . 6 1 1 A 163 163 HIS HA H 163 4.717 4.768 -0.051 1 1 1787 . 6 1 1 A 163 163 HIS C C 163 175.460 174.812 0.648 1 1 1788 . 6 1 1 A 163 163 HIS CA C 163 58.488 56.010 2.478 1 1 1789 . 6 1 1 A 163 163 HIS CB C 163 31.185 30.492 0.693 1 1 1791 . 6 1 1 A 163 163 HIS N N 163 117.838 123.664 -5.826 1 1 1792 . 6 1 1 A 164 164 GLU H H 164 8.013 7.632 0.381 1 1 1793 . 6 1 1 A 164 164 GLU HA H 164 4.814 4.469 0.345 1 1 1797 . 6 1 1 A 164 164 GLU C C 164 176.910 176.317 0.593 1 1 1798 . 6 1 1 A 164 164 GLU CA C 164 54.355 55.083 -0.728 1 1 1799 . 6 1 1 A 164 164 GLU CB C 164 32.886 32.978 -0.092 1 1 1801 . 6 1 1 A 164 164 GLU N N 164 115.943 116.524 -0.581 1 1 1802 . 6 1 1 A 165 165 LYS H H 165 9.088 9.276 -0.188 1 1 1803 . 6 1 1 A 165 165 LYS HA H 165 3.942 3.959 -0.017 1 1 1809 . 6 1 1 A 165 165 LYS C C 165 179.657 177.838 1.819 1 1 1810 . 6 1 1 A 165 165 LYS CA C 165 59.888 58.961 0.927 1 1 1811 . 6 1 1 A 165 165 LYS CB C 165 32.024 32.061 -0.037 1 1 1814 . 6 1 1 A 165 165 LYS N N 165 124.120 121.125 2.995 1 1 1815 . 6 1 1 A 166 166 ALA H H 166 8.851 8.116 0.735 1 1 1816 . 6 1 1 A 166 166 ALA HA H 166 4.251 4.018 0.233 1 1 1820 . 6 1 1 A 166 166 ALA C C 166 178.920 179.030 -0.110 1 1 1821 . 6 1 1 A 166 166 ALA CA C 166 54.318 54.876 -0.558 1 1 1822 . 6 1 1 A 166 166 ALA CB C 166 18.810 18.372 0.438 1 1 1823 . 6 1 1 A 166 166 ALA N N 166 120.424 122.123 -1.699 1 1 1824 . 6 1 1 A 167 167 GLU H H 167 7.871 7.677 0.194 1 1 1825 . 6 1 1 A 167 167 GLU HA H 167 4.404 4.382 0.022 1 1 1829 . 6 1 1 A 167 167 GLU C C 167 177.368 178.182 -0.814 1 1 1830 . 6 1 1 A 167 167 GLU CA C 167 56.701 56.966 -0.265 1 1 1831 . 6 1 1 A 167 167 GLU CB C 167 31.208 29.902 1.306 1 1 1833 . 6 1 1 A 167 167 GLU N N 167 114.926 116.288 -1.362 1 1 1834 . 6 1 1 A 168 168 VAL H H 168 7.812 7.923 -0.111 1 1 1835 . 6 1 1 A 168 168 VAL HA H 168 3.712 3.725 -0.013 1 1 1843 . 6 1 1 A 168 168 VAL CA C 168 68.705 67.800 0.905 1 1 1844 . 6 1 1 A 168 168 VAL CB C 168 29.597 29.510 0.087 1 1 1847 . 6 1 1 A 168 168 VAL N N 168 120.188 121.898 -1.710 1 1 1848 . 6 1 1 A 169 169 PRO HA H 169 4.252 4.287 -0.035 1 1 1851 . 6 1 1 A 169 169 PRO C C 169 179.563 178.491 1.072 1 1 1852 . 6 1 1 A 169 169 PRO CA C 169 67.077 66.262 0.815 1 1 1853 . 6 1 1 A 170 170 ALA H H 170 8.149 8.056 0.093 1 1 1854 . 6 1 1 A 170 170 ALA HA H 170 4.265 4.066 0.199 1 1 1858 . 6 1 1 A 170 170 ALA C C 170 180.637 179.786 0.851 1 1 1859 . 6 1 1 A 170 170 ALA CA C 170 54.823 55.300 -0.477 1 1 1860 . 6 1 1 A 170 170 ALA CB C 170 18.518 18.432 0.086 1 1 1861 . 6 1 1 A 170 170 ALA N N 170 119.210 119.122 0.088 1 1 1862 . 6 1 1 A 171 171 ALA H H 171 7.767 8.491 -0.724 1 1 1863 . 6 1 1 A 171 171 ALA HA H 171 4.106 4.158 -0.052 1 1 1867 . 6 1 1 A 171 171 ALA C C 171 179.371 179.972 -0.601 1 1 1868 . 6 1 1 A 171 171 ALA CA C 171 55.130 55.130 0.000 1 1 1869 . 6 1 1 A 171 171 ALA CB C 171 18.291 18.205 0.086 1 1 1870 . 6 1 1 A 171 171 ALA N N 171 122.126 120.575 1.551 1 1 1871 . 6 1 1 A 172 172 LEU H H 172 8.950 8.389 0.561 1 1 1872 . 6 1 1 A 172 172 LEU HA H 172 3.987 4.091 -0.104 1 1 1878 . 6 1 1 A 172 172 LEU C C 172 178.355 178.652 -0.297 1 1 1879 . 6 1 1 A 172 172 LEU CA C 172 57.803 58.132 -0.329 1 1 1880 . 6 1 1 A 172 172 LEU CB C 172 41.667 41.489 0.178 1 1 1882 . 6 1 1 A 172 172 LEU N N 172 118.682 121.046 -2.364 1 1 1883 . 6 1 1 A 173 173 GLU H H 173 7.886 8.074 -0.188 1 1 1884 . 6 1 1 A 173 173 GLU HA H 173 4.132 3.974 0.158 1 1 1887 . 6 1 1 A 173 173 GLU C C 173 179.556 179.418 0.138 1 1 1888 . 6 1 1 A 173 173 GLU CA C 173 59.800 59.609 0.191 1 1 1889 . 6 1 1 A 173 173 GLU CB C 173 29.580 29.109 0.471 1 1 1891 . 6 1 1 A 173 173 GLU N N 173 117.561 118.061 -0.500 1 1 1892 . 6 1 1 A 174 174 LYS H H 174 7.532 7.670 -0.138 1 1 1893 . 6 1 1 A 174 174 LYS HA H 174 4.131 4.044 0.087 1 1 1901 . 6 1 1 A 174 174 LYS CA C 174 58.999 59.298 -0.299 1 1 1902 . 6 1 1 A 174 174 LYS CB C 174 32.041 32.237 -0.196 1 1 1906 . 6 1 1 A 174 174 LYS N N 174 119.085 119.661 -0.576 1 1 1907 . 6 1 1 A 175 175 ILE H H 175 8.479 7.793 0.686 1 1 1908 . 6 1 1 A 175 175 ILE HA H 175 3.583 3.808 -0.225 1 1 1918 . 6 1 1 A 175 175 ILE C C 175 179.258 177.892 1.366 1 1 1919 . 6 1 1 A 175 175 ILE CA C 175 65.769 64.491 1.278 1 1 1920 . 6 1 1 A 175 175 ILE CB C 175 37.876 37.386 0.490 1 1 1923 . 6 1 1 A 175 175 ILE N N 175 118.828 117.164 1.664 1 1 1924 . 6 1 1 A 176 176 ILE H H 176 8.928 8.401 0.527 1 1 1925 . 6 1 1 A 176 176 ILE HA H 176 3.600 3.513 0.087 1 1 1935 . 6 1 1 A 176 176 ILE C C 176 178.827 178.139 0.688 1 1 1936 . 6 1 1 A 176 176 ILE CA C 176 65.640 65.096 0.544 1 1 1937 . 6 1 1 A 176 176 ILE CB C 176 37.451 37.768 -0.317 1 1 1941 . 6 1 1 A 176 176 ILE N N 176 124.527 121.946 2.581 1 1 1942 . 6 1 1 A 177 177 THR H H 177 8.175 8.192 -0.017 1 1 1943 . 6 1 1 A 177 177 THR HA H 177 3.885 3.916 -0.031 1 1 1948 . 6 1 1 A 177 177 THR C C 177 176.867 176.364 0.503 1 1 1949 . 6 1 1 A 177 177 THR CA C 177 67.199 66.512 0.687 1 1 1950 . 6 1 1 A 177 177 THR CB C 177 68.377 68.408 -0.031 1 1 1952 . 6 1 1 A 177 177 THR N N 177 119.412 117.071 2.341 1 1 1953 . 6 1 1 A 178 178 VAL H H 178 8.352 8.071 0.281 1 1 1954 . 6 1 1 A 178 178 VAL HA H 178 3.572 3.469 0.103 1 1 1962 . 6 1 1 A 178 178 VAL C C 178 177.664 178.200 -0.536 1 1 1963 . 6 1 1 A 178 178 VAL CA C 178 66.909 66.305 0.604 1 1 1964 . 6 1 1 A 178 178 VAL CB C 178 31.714 31.321 0.393 1 1 1967 . 6 1 1 A 178 178 VAL N N 178 121.168 122.040 -0.872 1 1 1968 . 6 1 1 A 179 179 SER H H 179 8.529 7.808 0.721 1 1 1969 . 6 1 1 A 179 179 SER HA H 179 3.099 3.455 -0.356 1 1 1972 . 6 1 1 A 179 179 SER C C 179 175.380 175.796 -0.416 1 1 1973 . 6 1 1 A 179 179 SER CA C 179 62.728 61.640 1.088 1 1 1974 . 6 1 1 A 179 179 SER CB C 179 62.802 62.490 0.312 1 1 1975 . 6 1 1 A 179 179 SER N N 179 115.226 116.328 -1.102 1 1 1976 . 6 1 1 A 180 180 SER H H 180 7.757 7.623 0.134 1 1 1977 . 6 1 1 A 180 180 SER HA H 180 4.419 4.088 0.331 1 1 1980 . 6 1 1 A 180 180 SER C C 180 175.359 176.808 -1.449 1 1 1981 . 6 1 1 A 180 180 SER CA C 180 61.025 61.252 -0.227 1 1 1982 . 6 1 1 A 180 180 SER CB C 180 63.072 63.155 -0.083 1 1 1983 . 6 1 1 A 180 180 SER N N 180 114.718 116.344 -1.626 1 1 1984 . 6 1 1 A 181 181 MET H H 181 7.497 7.633 -0.136 1 1 1985 . 6 1 1 A 181 181 MET HA H 181 4.283 4.212 0.071 1 1 1993 . 6 1 1 A 181 181 MET C C 181 177.217 177.553 -0.336 1 1 1994 . 6 1 1 A 181 181 MET CA C 181 57.539 57.845 -0.306 1 1 1995 . 6 1 1 A 181 181 MET CB C 181 33.493 32.611 0.882 1 1 1998 . 6 1 1 A 181 181 MET N N 181 119.274 120.673 -1.399 1 1 1999 . 6 1 1 A 182 182 LEU H H 182 7.163 7.254 -0.091 1 1 2000 . 6 1 1 A 182 182 LEU HA H 182 4.133 4.218 -0.085 1 1 2010 . 6 1 1 A 182 182 LEU C C 182 176.289 176.934 -0.645 1 1 2011 . 6 1 1 A 182 182 LEU CA C 182 54.750 55.638 -0.888 1 1 2012 . 6 1 1 A 182 182 LEU CB C 182 43.235 42.798 0.437 1 1 2016 . 6 1 1 A 182 182 LEU N N 182 115.869 117.747 -1.878 1 1 2017 . 6 1 1 A 183 183 GLY H H 183 7.492 7.329 0.163 1 1 2018 . 6 1 1 A 183 183 GLY HA2 H 183 4.086 4.104 -0.018 1 1 2019 . 6 1 1 A 183 183 GLY HA3 H 183 4.425 4.152 0.273 1 1 2020 . 6 1 1 A 183 183 GLY C C 183 171.830 171.745 0.085 1 1 2021 . 6 1 1 A 183 183 GLY CA C 183 46.035 46.073 -0.038 1 1 2022 . 6 1 1 A 183 183 GLY N N 183 107.761 104.589 3.172 1 1 2023 . 6 1 1 A 184 184 VAL H H 184 8.099 8.618 -0.519 1 1 2024 . 6 1 1 A 184 184 VAL HA H 184 4.772 4.699 0.073 1 1 2032 . 6 1 1 A 184 184 VAL CA C 184 59.305 58.521 0.784 1 1 2033 . 6 1 1 A 184 184 VAL CB C 184 33.648 34.936 -1.288 1 1 2036 . 6 1 1 A 184 184 VAL N N 184 119.803 121.964 -2.161 1 1 2037 . 6 1 1 A 185 185 PRO HA H 185 4.442 4.759 -0.317 1 1 2042 . 6 1 1 A 185 185 PRO C C 185 175.871 176.260 -0.389 1 1 2043 . 6 1 1 A 185 185 PRO CA C 185 63.886 62.698 1.188 1 1 2044 . 6 1 1 A 185 185 PRO CB C 185 32.260 32.517 -0.257 1 1 2047 . 6 1 1 A 186 186 ALA H H 186 8.222 8.162 0.060 1 1 2048 . 6 1 1 A 186 186 ALA HA H 186 4.569 5.111 -0.542 1 1 2052 . 6 1 1 A 186 186 ALA C C 186 177.481 175.901 1.580 1 1 2053 . 6 1 1 A 186 186 ALA CA C 186 51.823 51.034 0.789 1 1 2054 . 6 1 1 A 186 186 ALA CB C 186 20.233 24.272 -4.039 1 1 2055 . 6 1 1 A 186 186 ALA N N 186 125.663 121.406 4.257 1 1 2056 . 6 1 1 A 187 187 GLN H H 187 8.723 8.759 -0.036 1 1 2057 . 6 1 1 A 187 187 GLN HA H 187 4.420 4.721 -0.301 1 1 2063 . 6 1 1 A 187 187 GLN C C 187 175.566 174.668 0.898 1 1 2064 . 6 1 1 A 187 187 GLN CA C 187 56.051 56.226 -0.175 1 1 2065 . 6 1 1 A 187 187 GLN CB C 187 29.812 30.710 -0.898 1 1 2067 . 6 1 1 A 187 187 GLN N N 187 120.742 117.712 3.030 1 1 2069 . 6 1 1 A 188 188 GLU H H 188 8.163 8.717 -0.554 1 1 2070 . 6 1 1 A 188 188 GLU HA H 188 4.405 4.619 -0.214 1 1 2074 . 6 1 1 A 188 188 GLU C C 188 176.058 176.513 -0.455 1 1 2075 . 6 1 1 A 188 188 GLU CA C 188 56.158 55.131 1.027 1 1 2076 . 6 1 1 A 188 188 GLU CB C 188 31.095 30.203 0.892 1 1 2078 . 6 1 1 A 188 188 GLU N N 188 119.177 123.138 -3.961 1 1 2079 . 6 1 1 A 189 189 GLU H H 189 8.567 8.264 0.303 1 1 2080 . 6 1 1 A 189 189 GLU HA H 189 4.252 3.988 0.264 1 1 2084 . 6 1 1 A 189 189 GLU C C 189 175.703 175.871 -0.168 1 1 2085 . 6 1 1 A 189 189 GLU CA C 189 56.417 57.858 -1.441 1 1 2086 . 6 1 1 A 189 189 GLU CB C 189 29.968 27.758 2.210 1 1 2088 . 6 1 1 A 189 189 GLU N N 189 120.920 114.782 6.138 1 1 2089 . 6 1 1 A 190 190 ALA H H 190 8.271 8.298 -0.027 1 1 2090 . 6 1 1 A 190 190 ALA HA H 190 4.626 4.236 0.390 1 1 2094 . 6 1 1 A 190 190 ALA CA C 190 50.465 52.680 -2.215 1 1 2095 . 6 1 1 A 190 190 ALA CB C 190 18.451 17.897 0.554 1 1 2096 . 6 1 1 A 190 190 ALA N N 190 128.323 116.421 11.902 1 1 2097 . 6 1 1 A 191 191 PRO HA H 191 4.493 4.459 0.034 1 1 2103 . 6 1 1 A 191 191 PRO C C 191 175.899 176.535 -0.636 1 1 2104 . 6 1 1 A 191 191 PRO CA C 191 62.044 62.406 -0.362 1 1 2105 . 6 1 1 A 191 191 PRO CB C 191 32.184 32.298 -0.114 1 1 2108 . 6 1 1 A 192 192 ALA H H 192 8.610 7.820 0.790 1 1 2109 . 6 1 1 A 192 192 ALA HA H 192 4.280 4.432 -0.152 1 1 2113 . 6 1 1 A 192 192 ALA C C 192 178.282 178.355 -0.073 1 1 2114 . 6 1 1 A 192 192 ALA CA C 192 51.698 51.660 0.038 1 1 2115 . 6 1 1 A 192 192 ALA CB C 192 19.220 19.704 -0.484 1 1 2116 . 6 1 1 A 192 192 ALA N N 192 123.420 124.954 -1.534 1 1 2117 . 6 1 1 A 193 193 LYS H H 193 8.531 9.096 -0.565 1 1 2118 . 6 1 1 A 193 193 LYS HA H 193 3.294 3.920 -0.626 1 1 2126 . 6 1 1 A 193 193 LYS C C 193 177.640 178.960 -1.320 1 1 2127 . 6 1 1 A 193 193 LYS CA C 193 60.644 59.328 1.316 1 1 2128 . 6 1 1 A 193 193 LYS CB C 193 32.607 31.955 0.652 1 1 2132 . 6 1 1 A 193 193 LYS N N 193 122.851 120.037 2.814 1 1 2133 . 6 1 1 A 194 194 LEU H H 194 8.570 7.619 0.951 1 1 2134 . 6 1 1 A 194 194 LEU HA H 194 3.845 4.216 -0.371 1 1 2144 . 6 1 1 A 194 194 LEU C C 194 177.965 178.970 -1.005 1 1 2145 . 6 1 1 A 194 194 LEU CA C 194 57.611 57.352 0.259 1 1 2146 . 6 1 1 A 194 194 LEU CB C 194 41.776 40.411 1.365 1 1 2150 . 6 1 1 A 194 194 LEU N N 194 115.801 121.324 -5.523 1 1 2151 . 6 1 1 A 195 195 MET H H 195 6.782 7.939 -1.157 1 1 2152 . 6 1 1 A 195 195 MET HA H 195 4.487 4.211 0.276 1 1 2160 . 6 1 1 A 195 195 MET C C 195 178.280 178.638 -0.358 1 1 2161 . 6 1 1 A 195 195 MET CA C 195 56.858 58.240 -1.382 1 1 2162 . 6 1 1 A 195 195 MET CB C 195 31.557 31.392 0.165 1 1 2165 . 6 1 1 A 195 195 MET N N 195 113.898 117.404 -3.506 1 1 2166 . 6 1 1 A 196 196 VAL H H 196 7.713 7.664 0.049 1 1 2167 . 6 1 1 A 196 196 VAL HA H 196 3.501 3.351 0.150 1 1 2175 . 6 1 1 A 196 196 VAL C C 196 177.624 177.770 -0.146 1 1 2176 . 6 1 1 A 196 196 VAL CA C 196 66.318 66.147 0.171 1 1 2177 . 6 1 1 A 196 196 VAL CB C 196 31.380 31.372 0.008 1 1 2180 . 6 1 1 A 196 196 VAL N N 196 120.413 119.816 0.597 1 1 2181 . 6 1 1 A 197 197 TYR H H 197 7.972 8.429 -0.457 1 1 2182 . 6 1 1 A 197 197 TYR HA H 197 3.145 4.165 -1.020 1 1 2187 . 6 1 1 A 197 197 TYR C C 197 177.726 177.223 0.503 1 1 2188 . 6 1 1 A 197 197 TYR CA C 197 62.253 61.758 0.495 1 1 2189 . 6 1 1 A 197 197 TYR CB C 197 37.314 38.664 -1.350 1 1 2192 . 6 1 1 A 197 197 TYR N N 197 119.543 121.045 -1.502 1 1 2193 . 6 1 1 A 198 198 LEU H H 198 8.630 7.998 0.632 1 1 2194 . 6 1 1 A 198 198 LEU HA H 198 3.923 3.684 0.239 1 1 2203 . 6 1 1 A 198 198 LEU C C 198 178.074 178.787 -0.713 1 1 2204 . 6 1 1 A 198 198 LEU CA C 198 58.294 58.127 0.167 1 1 2205 . 6 1 1 A 198 198 LEU CB C 198 42.177 41.800 0.377 1 1 2209 . 6 1 1 A 198 198 LEU N N 198 118.430 120.104 -1.674 1 1 2210 . 6 1 1 A 199 199 GLN H H 199 8.082 8.205 -0.123 1 1 2211 . 6 1 1 A 199 199 GLN HA H 199 3.054 3.767 -0.713 1 1 2216 . 6 1 1 A 199 199 GLN C C 199 176.875 178.055 -1.180 1 1 2217 . 6 1 1 A 199 199 GLN CA C 199 59.739 58.171 1.568 1 1 2218 . 6 1 1 A 199 199 GLN CB C 199 28.055 27.824 0.231 1 1 2220 . 6 1 1 A 199 199 GLN N N 199 117.926 117.384 0.542 1 1 2222 . 6 1 1 A 200 200 ARG H H 200 7.349 7.890 -0.541 1 1 2223 . 6 1 1 A 200 200 ARG HA H 200 3.798 3.814 -0.016 1 1 2231 . 6 1 1 A 200 200 ARG C C 200 178.037 177.976 0.061 1 1 2232 . 6 1 1 A 200 200 ARG CA C 200 58.260 58.652 -0.392 1 1 2233 . 6 1 1 A 200 200 ARG CB C 200 30.706 30.146 0.560 1 1 2236 . 6 1 1 A 200 200 ARG N N 200 113.772 119.902 -6.130 1 1 2238 . 6 1 1 A 201 201 PHE H H 201 8.329 7.517 0.812 1 1 2239 . 6 1 1 A 201 201 PHE HA H 201 4.630 4.388 0.242 1 1 2244 . 6 1 1 A 201 201 PHE C C 201 176.606 176.282 0.324 1 1 2245 . 6 1 1 A 201 201 PHE CA C 201 59.014 58.529 0.485 1 1 2246 . 6 1 1 A 201 201 PHE CB C 201 40.357 40.704 -0.347 1 1 2249 . 6 1 1 A 201 201 PHE N N 201 114.182 116.090 -1.908 1 1 2250 . 6 1 1 A 202 202 ARG H H 202 8.719 8.369 0.350 1 1 2251 . 6 1 1 A 202 202 ARG HA H 202 5.071 4.641 0.430 1 1 2261 . 6 1 1 A 202 202 ARG CA C 202 53.956 53.462 0.494 1 1 2262 . 6 1 1 A 202 202 ARG CB C 202 31.979 30.126 1.853 1 1 2264 . 6 1 1 A 202 202 ARG N N 202 120.115 115.255 4.860 1 1 2266 . 6 1 1 A 203 203 PRO HA H 203 4.348 4.432 -0.084 1 1 2271 . 6 1 1 A 203 203 PRO C C 203 179.736 178.125 1.611 1 1 2272 . 6 1 1 A 203 203 PRO CA C 203 65.674 65.095 0.579 1 1 2273 . 6 1 1 A 203 203 PRO CB C 203 31.717 32.194 -0.477 1 1 2275 . 6 1 1 A 204 204 LEU H H 204 8.875 7.741 1.134 1 1 2276 . 6 1 1 A 204 204 LEU HA H 204 4.291 4.063 0.228 1 1 2286 . 6 1 1 A 204 204 LEU C C 204 180.353 177.824 2.529 1 1 2287 . 6 1 1 A 204 204 LEU CA C 204 58.012 57.223 0.789 1 1 2288 . 6 1 1 A 204 204 LEU CB C 204 40.893 41.981 -1.088 1 1 2292 . 6 1 1 A 204 204 LEU N N 204 118.940 118.021 0.919 1 1 2293 . 6 1 1 A 205 205 ASP H H 205 7.541 8.313 -0.772 1 1 2294 . 6 1 1 A 205 205 ASP HA H 205 4.622 4.367 0.255 1 1 2297 . 6 1 1 A 205 205 ASP C C 205 177.602 178.044 -0.442 1 1 2298 . 6 1 1 A 205 205 ASP CA C 205 57.437 57.209 0.228 1 1 2299 . 6 1 1 A 205 205 ASP CB C 205 41.143 40.807 0.336 1 1 2300 . 6 1 1 A 205 205 ASP N N 205 120.838 119.096 1.742 1 1 2301 . 6 1 1 A 206 206 TYR H H 206 8.237 8.257 -0.020 1 1 2302 . 6 1 1 A 206 206 TYR HA H 206 4.018 4.082 -0.064 1 1 2307 . 6 1 1 A 206 206 TYR C C 206 176.433 177.910 -1.477 1 1 2308 . 6 1 1 A 206 206 TYR CA C 206 62.148 61.917 0.231 1 1 2309 . 6 1 1 A 206 206 TYR CB C 206 38.305 38.792 -0.487 1 1 2312 . 6 1 1 A 206 206 TYR N N 206 119.475 120.477 -1.002 1 1 2313 . 6 1 1 A 207 207 GLN H H 207 8.124 7.689 0.435 1 1 2314 . 6 1 1 A 207 207 GLN HA H 207 3.823 3.190 0.633 1 1 2320 . 6 1 1 A 207 207 GLN C C 207 178.019 178.551 -0.532 1 1 2321 . 6 1 1 A 207 207 GLN CA C 207 58.841 59.146 -0.305 1 1 2322 . 6 1 1 A 207 207 GLN CB C 207 28.208 28.598 -0.390 1 1 2324 . 6 1 1 A 207 207 GLN N N 207 115.863 118.570 -2.707 1 1 2326 . 6 1 1 A 208 208 ARG H H 208 7.522 7.662 -0.140 1 1 2327 . 6 1 1 A 208 208 ARG HA H 208 4.127 4.042 0.085 1 1 2334 . 6 1 1 A 208 208 ARG C C 208 179.278 178.930 0.348 1 1 2335 . 6 1 1 A 208 208 ARG CA C 208 59.419 58.927 0.492 1 1 2336 . 6 1 1 A 208 208 ARG CB C 208 30.182 29.829 0.353 1 1 2338 . 6 1 1 A 208 208 ARG N N 208 118.471 119.912 -1.441 1 1 2340 . 6 1 1 A 209 209 LEU H H 209 7.869 7.664 0.205 1 1 2341 . 6 1 1 A 209 209 LEU HA H 209 4.091 4.133 -0.042 1 1 2351 . 6 1 1 A 209 209 LEU C C 209 179.715 178.172 1.543 1 1 2352 . 6 1 1 A 209 209 LEU CA C 209 57.891 58.073 -0.182 1 1 2353 . 6 1 1 A 209 209 LEU CB C 209 41.338 41.739 -0.401 1 1 2356 . 6 1 1 A 209 209 LEU N N 209 119.659 121.426 -1.767 1 1 2357 . 6 1 1 A 210 210 LEU H H 210 8.034 8.391 -0.357 1 1 2358 . 6 1 1 A 210 210 LEU HA H 210 3.977 3.956 0.021 1 1 2367 . 6 1 1 A 210 210 LEU C C 210 180.363 178.459 1.904 1 1 2368 . 6 1 1 A 210 210 LEU CA C 210 57.459 58.404 -0.945 1 1 2369 . 6 1 1 A 210 210 LEU CB C 210 41.699 41.035 0.664 1 1 2373 . 6 1 1 A 210 210 LEU N N 210 120.967 119.554 1.413 1 1 2374 . 6 1 1 A 211 211 GLU H H 211 8.174 8.298 -0.124 1 1 2375 . 6 1 1 A 211 211 GLU HA H 211 4.075 4.004 0.071 1 1 2379 . 6 1 1 A 211 211 GLU C C 211 178.499 178.332 0.167 1 1 2380 . 6 1 1 A 211 211 GLU CA C 211 58.575 59.263 -0.688 1 1 2381 . 6 1 1 A 211 211 GLU CB C 211 29.583 29.032 0.551 1 1 2383 . 6 1 1 A 211 211 GLU N N 211 119.217 118.039 1.178 1 1 2384 . 6 1 1 A 212 212 ALA H H 212 7.723 7.740 -0.017 1 1 2385 . 6 1 1 A 212 212 ALA HA H 212 4.291 4.268 0.023 1 1 2389 . 6 1 1 A 212 212 ALA C C 212 178.770 177.928 0.842 1 1 2390 . 6 1 1 A 212 212 ALA CA C 212 53.966 53.527 0.439 1 1 2391 . 6 1 1 A 212 212 ALA CB C 212 19.117 19.038 0.079 1 1 2392 . 6 1 1 A 212 212 ALA N N 212 121.798 122.039 -0.241 1 1 2393 . 6 1 1 A 213 213 ALA H H 213 7.743 7.852 -0.109 1 1 2394 . 6 1 1 A 213 213 ALA HA H 213 4.406 4.560 -0.154 1 1 2398 . 6 1 1 A 213 213 ALA C C 213 178.413 177.211 1.202 1 1 2399 . 6 1 1 A 213 213 ALA CA C 213 53.129 51.468 1.661 1 1 2400 . 6 1 1 A 213 213 ALA CB C 213 18.926 18.660 0.266 1 1 2401 . 6 1 1 A 213 213 ALA N N 213 120.435 119.531 0.904 1 1 2402 . 6 1 1 A 214 214 SER H H 214 7.944 7.664 0.280 1 1 2403 . 6 1 1 A 214 214 SER HA H 214 4.559 4.416 0.143 1 1 2406 . 6 1 1 A 214 214 SER C C 214 174.958 174.929 0.029 1 1 2407 . 6 1 1 A 214 214 SER CA C 214 58.640 57.930 0.710 1 1 2408 . 6 1 1 A 214 214 SER CB C 214 63.928 62.505 1.423 1 1 2409 . 6 1 1 A 214 214 SER N N 214 113.729 115.262 -1.533 1 1 2410 . 6 1 1 A 215 215 SER H H 215 8.255 8.874 -0.619 1 1 2411 . 6 1 1 A 215 215 SER HA H 215 4.547 4.840 -0.293 1 1 2413 . 6 1 1 A 215 215 SER C C 215 175.289 174.964 0.325 1 1 2414 . 6 1 1 A 215 215 SER CA C 215 58.833 57.324 1.509 1 1 2415 . 6 1 1 A 215 215 SER CB C 215 63.847 63.655 0.192 1 1 2416 . 6 1 1 A 215 215 SER N N 215 117.674 124.539 -6.865 1 1 2417 . 6 1 1 A 216 216 GLY H H 216 8.431 8.518 -0.087 1 1 2418 . 6 1 1 A 216 216 GLY HA2 H 216 4.054 3.879 0.175 1 1 2419 . 6 1 1 A 216 216 GLY C C 216 174.189 173.523 0.666 1 1 2420 . 6 1 1 A 216 216 GLY CA C 216 45.412 47.227 -1.815 1 1 2421 . 6 1 1 A 216 216 GLY N N 216 110.800 110.275 0.525 1 1 2422 . 6 1 1 A 217 217 GLU H H 217 8.267 8.850 -0.583 1 1 2423 . 6 1 1 A 217 217 GLU HA H 217 4.345 4.776 -0.431 1 1 2427 . 6 1 1 A 217 217 GLU C C 217 176.428 176.175 0.253 1 1 2428 . 6 1 1 A 217 217 GLU CA C 217 56.470 56.280 0.190 1 1 2429 . 6 1 1 A 217 217 GLU CB C 217 30.526 31.059 -0.533 1 1 2430 . 6 1 1 A 217 217 GLU N N 217 120.726 121.989 -1.263 1 1 2431 . 6 1 1 A 218 218 ALA H H 218 8.476 8.652 -0.176 1 1 2432 . 6 1 1 A 218 218 ALA HA H 218 4.467 4.867 -0.400 1 1 2436 . 6 1 1 A 218 218 ALA C C 218 178.015 176.389 1.626 1 1 2437 . 6 1 1 A 218 218 ALA CA C 218 52.547 50.752 1.795 1 1 2438 . 6 1 1 A 218 218 ALA CB C 218 19.242 23.193 -3.951 1 1 2439 . 6 1 1 A 218 218 ALA N N 218 125.534 126.194 -0.660 1 1 2440 . 6 1 1 A 219 219 THR H H 219 8.232 8.325 -0.093 1 1 2441 . 6 1 1 A 219 219 THR HA H 219 4.411 4.011 0.400 1 1 2446 . 6 1 1 A 219 219 THR C C 219 175.327 174.440 0.887 1 1 2447 . 6 1 1 A 219 219 THR CA C 219 61.889 62.231 -0.342 1 1 2448 . 6 1 1 A 219 219 THR CB C 219 69.939 67.672 2.267 1 1 2449 . 6 1 1 A 219 219 THR N N 219 113.242 110.210 3.032 1 1 2450 . 6 1 1 A 220 220 GLY H H 220 8.418 8.528 -0.110 1 1 2451 . 6 1 1 A 220 220 GLY C C 220 174.037 171.813 2.224 1 1 2452 . 6 1 1 A 220 220 GLY CA C 220 45.408 44.142 1.266 1 1 2453 . 6 1 1 A 220 220 GLY N N 220 111.031 112.999 -1.968 1 1 2454 . 6 1 1 A 221 221 ASP H H 221 8.345 8.425 -0.080 1 1 2455 . 6 1 1 A 221 221 ASP HA H 221 4.700 4.947 -0.247 1 1 2458 . 6 1 1 A 221 221 ASP C C 221 176.535 174.644 1.891 1 1 2459 . 6 1 1 A 221 221 ASP CA C 221 54.402 53.108 1.294 1 1 2460 . 6 1 1 A 221 221 ASP CB C 221 41.431 41.304 0.127 1 1 2461 . 6 1 1 A 221 221 ASP N N 221 120.795 121.792 -0.997 1 1 2462 . 6 1 1 A 222 222 SER H H 222 8.353 8.977 -0.624 1 1 2463 . 6 1 1 A 222 222 SER HA H 222 4.493 5.084 -0.591 1 1 2465 . 6 1 1 A 222 222 SER C C 222 174.224 173.623 0.601 1 1 2466 . 6 1 1 A 222 222 SER CA C 222 58.427 56.133 2.294 1 1 2467 . 6 1 1 A 222 222 SER CB C 222 63.860 65.319 -1.459 1 1 2468 . 6 1 1 A 222 222 SER N N 222 116.220 122.641 -6.421 1 1 2469 . 6 1 1 A 223 223 ALA H H 223 8.381 8.512 -0.131 1 1 2470 . 6 1 1 A 223 223 ALA HA H 223 4.461 4.525 -0.064 1 1 2474 . 6 1 1 A 223 223 ALA C C 223 176.926 176.849 0.077 1 1 2475 . 6 1 1 A 223 223 ALA CA C 223 52.583 51.878 0.705 1 1 2476 . 6 1 1 A 223 223 ALA CB C 223 19.438 18.666 0.772 1 1 2477 . 6 1 1 A 223 223 ALA N N 223 126.592 128.071 -1.479 1 1 1 . 7 1 1 A 2 2 ALA HA H 2 4.274 4.023 0.251 1 1 5 . 7 1 1 A 2 2 ALA C C 2 177.828 175.933 1.895 1 1 6 . 7 1 1 A 2 2 ALA CA C 2 52.984 54.438 -1.454 1 1 7 . 7 1 1 A 2 2 ALA CB C 2 19.138 17.927 1.211 1 1 8 . 7 1 1 A 3 3 GLN H H 3 8.463 8.913 -0.450 1 1 9 . 7 1 1 A 3 3 GLN HA H 3 4.676 5.122 -0.446 1 1 12 . 7 1 1 A 3 3 GLN C C 3 176.002 175.175 0.827 1 1 13 . 7 1 1 A 3 3 GLN CA C 3 56.258 54.564 1.694 1 1 14 . 7 1 1 A 3 3 GLN CB C 3 30.346 31.574 -1.228 1 1 15 . 7 1 1 A 3 3 GLN N N 3 117.490 118.698 -1.208 1 1 16 . 7 1 1 A 4 4 GLY H H 4 8.099 8.452 -0.353 1 1 17 . 7 1 1 A 4 4 GLY HA2 H 4 3.910 4.237 -0.327 1 1 18 . 7 1 1 A 4 4 GLY C C 4 173.332 171.973 1.359 1 1 19 . 7 1 1 A 4 4 GLY CA C 4 45.333 45.878 -0.545 1 1 20 . 7 1 1 A 4 4 GLY N N 4 109.423 108.507 0.916 1 1 21 . 7 1 1 A 5 5 LEU H H 5 7.863 8.270 -0.407 1 1 22 . 7 1 1 A 5 5 LEU HA H 5 4.561 5.022 -0.461 1 1 32 . 7 1 1 A 5 5 LEU C C 5 176.448 176.045 0.403 1 1 33 . 7 1 1 A 5 5 LEU CA C 5 54.713 54.082 0.631 1 1 34 . 7 1 1 A 5 5 LEU CB C 5 43.551 41.232 2.319 1 1 38 . 7 1 1 A 5 5 LEU N N 5 120.391 123.038 -2.647 1 1 39 . 7 1 1 A 6 6 ILE H H 6 8.764 9.444 -0.680 1 1 40 . 7 1 1 A 6 6 ILE HA H 6 4.087 4.191 -0.104 1 1 49 . 7 1 1 A 6 6 ILE C C 6 174.679 175.633 -0.954 1 1 50 . 7 1 1 A 6 6 ILE CA C 6 61.279 61.569 -0.290 1 1 51 . 7 1 1 A 6 6 ILE CB C 6 39.651 38.143 1.508 1 1 54 . 7 1 1 A 6 6 ILE N N 6 123.050 125.924 -2.874 1 1 55 . 7 1 1 A 7 7 GLU H H 7 8.587 8.678 -0.091 1 1 56 . 7 1 1 A 7 7 GLU HA H 7 4.917 4.885 0.032 1 1 61 . 7 1 1 A 7 7 GLU C C 7 175.978 175.316 0.662 1 1 62 . 7 1 1 A 7 7 GLU CA C 7 56.127 56.060 0.067 1 1 63 . 7 1 1 A 7 7 GLU CB C 7 31.115 30.307 0.808 1 1 65 . 7 1 1 A 7 7 GLU N N 7 127.415 127.673 -0.258 1 1 66 . 7 1 1 A 8 8 VAL H H 8 8.986 9.239 -0.253 1 1 67 . 7 1 1 A 8 8 VAL HA H 8 4.375 4.779 -0.404 1 1 72 . 7 1 1 A 8 8 VAL C C 8 173.704 175.116 -1.412 1 1 73 . 7 1 1 A 8 8 VAL CA C 8 61.347 60.403 0.944 1 1 74 . 7 1 1 A 8 8 VAL CB C 8 33.611 33.577 0.034 1 1 76 . 7 1 1 A 8 8 VAL N N 8 126.071 125.174 0.897 1 1 77 . 7 1 1 A 9 9 GLU H H 9 8.521 9.061 -0.540 1 1 78 . 7 1 1 A 9 9 GLU HA H 9 5.837 5.530 0.307 1 1 81 . 7 1 1 A 9 9 GLU C C 9 175.939 174.927 1.012 1 1 82 . 7 1 1 A 9 9 GLU CA C 9 54.516 54.487 0.029 1 1 83 . 7 1 1 A 9 9 GLU CB C 9 33.009 33.771 -0.762 1 1 84 . 7 1 1 A 9 9 GLU N N 9 122.857 126.870 -4.013 1 1 85 . 7 1 1 A 10 10 ARG H H 10 8.690 8.604 0.086 1 1 86 . 7 1 1 A 10 10 ARG HA H 10 4.709 4.833 -0.124 1 1 94 . 7 1 1 A 10 10 ARG C C 10 174.826 173.645 1.181 1 1 95 . 7 1 1 A 10 10 ARG CA C 10 54.491 55.361 -0.870 1 1 96 . 7 1 1 A 10 10 ARG CB C 10 35.777 34.340 1.437 1 1 98 . 7 1 1 A 10 10 ARG N N 10 120.430 120.883 -0.453 1 1 100 . 7 1 1 A 11 11 LYS H H 11 8.874 8.884 -0.010 1 1 101 . 7 1 1 A 11 11 LYS HA H 11 5.530 5.346 0.184 1 1 107 . 7 1 1 A 11 11 LYS C C 11 176.919 175.048 1.871 1 1 108 . 7 1 1 A 11 11 LYS CA C 11 55.084 54.584 0.500 1 1 109 . 7 1 1 A 11 11 LYS CB C 11 35.435 35.984 -0.549 1 1 113 . 7 1 1 A 11 11 LYS N N 11 121.087 126.835 -5.748 1 1 114 . 7 1 1 A 12 12 PHE H H 12 8.877 9.330 -0.453 1 1 115 . 7 1 1 A 12 12 PHE HA H 12 5.130 5.506 -0.376 1 1 120 . 7 1 1 A 12 12 PHE C C 12 171.676 172.640 -0.964 1 1 121 . 7 1 1 A 12 12 PHE CA C 12 55.869 55.709 0.160 1 1 122 . 7 1 1 A 12 12 PHE CB C 12 42.108 42.302 -0.194 1 1 125 . 7 1 1 A 12 12 PHE N N 12 117.486 120.338 -2.852 1 1 126 . 7 1 1 A 13 13 ALA H H 13 9.134 9.508 -0.374 1 1 127 . 7 1 1 A 13 13 ALA HA H 13 5.003 4.922 0.081 1 1 131 . 7 1 1 A 13 13 ALA CA C 13 48.340 49.307 -0.967 1 1 132 . 7 1 1 A 13 13 ALA CB C 13 19.191 20.000 -0.809 1 1 133 . 7 1 1 A 13 13 ALA N N 13 125.915 122.648 3.267 1 1 134 . 7 1 1 A 14 14 PRO HA H 14 4.620 4.853 -0.233 1 1 140 . 7 1 1 A 14 14 PRO C C 14 176.502 177.266 -0.764 1 1 141 . 7 1 1 A 14 14 PRO CA C 14 62.672 62.296 0.376 1 1 142 . 7 1 1 A 14 14 PRO CB C 14 33.119 32.763 0.356 1 1 145 . 7 1 1 A 15 15 GLY H H 15 8.721 8.341 0.380 1 1 146 . 7 1 1 A 15 15 GLY HA2 H 15 3.999 4.080 -0.081 1 1 147 . 7 1 1 A 15 15 GLY HA3 H 15 4.632 4.082 0.550 1 1 148 . 7 1 1 A 15 15 GLY CA C 15 44.411 44.025 0.386 1 1 149 . 7 1 1 A 15 15 GLY N N 15 109.863 108.125 1.738 1 1 150 . 7 1 1 A 16 16 PRO HA H 16 4.447 4.328 0.119 1 1 155 . 7 1 1 A 16 16 PRO C C 16 177.053 176.916 0.137 1 1 156 . 7 1 1 A 16 16 PRO CA C 16 64.395 64.695 -0.300 1 1 157 . 7 1 1 A 16 16 PRO CB C 16 31.993 31.855 0.138 1 1 159 . 7 1 1 A 17 17 ASP H H 17 8.550 8.519 0.031 1 1 160 . 7 1 1 A 17 17 ASP HA H 17 4.950 4.729 0.221 1 1 163 . 7 1 1 A 17 17 ASP C C 17 176.800 176.633 0.167 1 1 164 . 7 1 1 A 17 17 ASP CA C 17 53.271 54.062 -0.791 1 1 165 . 7 1 1 A 17 17 ASP CB C 17 40.392 41.639 -1.247 1 1 166 . 7 1 1 A 17 17 ASP N N 17 116.060 118.406 -2.346 1 1 167 . 7 1 1 A 18 18 THR H H 18 7.664 7.356 0.308 1 1 168 . 7 1 1 A 18 18 THR HA H 18 4.120 3.782 0.338 1 1 174 . 7 1 1 A 18 18 THR C C 18 175.407 176.533 -1.126 1 1 175 . 7 1 1 A 18 18 THR CA C 18 68.718 67.481 1.237 1 1 176 . 7 1 1 A 18 18 THR CB C 18 69.179 68.359 0.820 1 1 178 . 7 1 1 A 18 18 THR N N 18 117.158 114.471 2.687 1 1 179 . 7 1 1 A 19 19 GLU H H 19 8.817 8.439 0.378 1 1 180 . 7 1 1 A 19 19 GLU HA H 19 3.510 3.384 0.126 1 1 184 . 7 1 1 A 19 19 GLU C C 19 178.345 179.068 -0.723 1 1 185 . 7 1 1 A 19 19 GLU CA C 19 61.237 59.725 1.512 1 1 186 . 7 1 1 A 19 19 GLU CB C 19 28.746 29.195 -0.449 1 1 188 . 7 1 1 A 19 19 GLU N N 19 118.802 119.144 -0.342 1 1 189 . 7 1 1 A 20 20 GLU H H 20 7.976 8.268 -0.292 1 1 190 . 7 1 1 A 20 20 GLU HA H 20 4.036 4.104 -0.068 1 1 194 . 7 1 1 A 20 20 GLU C C 20 179.451 179.216 0.235 1 1 195 . 7 1 1 A 20 20 GLU CA C 20 59.909 59.150 0.759 1 1 196 . 7 1 1 A 20 20 GLU CB C 20 28.992 29.184 -0.192 1 1 198 . 7 1 1 A 20 20 GLU N N 20 121.130 120.602 0.528 1 1 199 . 7 1 1 A 21 21 ARG H H 21 8.199 8.031 0.168 1 1 200 . 7 1 1 A 21 21 ARG HA H 21 4.061 4.169 -0.108 1 1 207 . 7 1 1 A 21 21 ARG C C 21 179.087 178.757 0.330 1 1 208 . 7 1 1 A 21 21 ARG CA C 21 58.477 58.326 0.151 1 1 209 . 7 1 1 A 21 21 ARG CB C 21 30.101 29.949 0.152 1 1 211 . 7 1 1 A 21 21 ARG N N 21 119.897 120.349 -0.452 1 1 213 . 7 1 1 A 22 22 LEU H H 22 8.154 8.729 -0.575 1 1 214 . 7 1 1 A 22 22 LEU HA H 22 3.560 3.755 -0.195 1 1 224 . 7 1 1 A 22 22 LEU C C 22 178.461 179.557 -1.096 1 1 225 . 7 1 1 A 22 22 LEU CA C 22 58.432 57.744 0.688 1 1 226 . 7 1 1 A 22 22 LEU CB C 22 40.229 40.996 -0.767 1 1 230 . 7 1 1 A 22 22 LEU N N 22 120.012 119.405 0.607 1 1 231 . 7 1 1 A 23 23 GLN H H 23 7.621 7.758 -0.137 1 1 232 . 7 1 1 A 23 23 GLN HA H 23 4.232 4.161 0.071 1 1 238 . 7 1 1 A 23 23 GLN C C 23 180.543 178.969 1.574 1 1 239 . 7 1 1 A 23 23 GLN CA C 23 59.434 59.273 0.161 1 1 240 . 7 1 1 A 23 23 GLN CB C 23 28.749 28.250 0.499 1 1 242 . 7 1 1 A 23 23 GLN N N 23 117.823 118.323 -0.500 1 1 244 . 7 1 1 A 24 24 GLU H H 24 8.165 7.753 0.412 1 1 245 . 7 1 1 A 24 24 GLU HA H 24 4.072 4.057 0.015 1 1 249 . 7 1 1 A 24 24 GLU C C 24 178.612 179.424 -0.812 1 1 250 . 7 1 1 A 24 24 GLU CA C 24 59.236 59.109 0.127 1 1 251 . 7 1 1 A 24 24 GLU CB C 24 29.606 29.381 0.225 1 1 253 . 7 1 1 A 24 24 GLU N N 24 122.589 121.117 1.472 1 1 254 . 7 1 1 A 25 25 LEU H H 25 7.911 7.932 -0.021 1 1 255 . 7 1 1 A 25 25 LEU HA H 25 4.214 4.099 0.115 1 1 265 . 7 1 1 A 25 25 LEU C C 25 176.745 177.067 -0.322 1 1 266 . 7 1 1 A 25 25 LEU CA C 25 55.659 55.816 -0.157 1 1 267 . 7 1 1 A 25 25 LEU CB C 25 43.109 42.771 0.338 1 1 271 . 7 1 1 A 25 25 LEU N N 25 117.882 117.167 0.715 1 1 272 . 7 1 1 A 26 26 GLY H H 26 7.776 7.947 -0.171 1 1 273 . 7 1 1 A 26 26 GLY HA2 H 26 4.337 3.992 0.345 1 1 274 . 7 1 1 A 26 26 GLY HA3 H 26 3.856 4.011 -0.155 1 1 275 . 7 1 1 A 26 26 GLY C C 26 175.456 174.867 0.589 1 1 276 . 7 1 1 A 26 26 GLY CA C 26 44.875 45.551 -0.676 1 1 277 . 7 1 1 A 26 26 GLY N N 26 104.938 106.072 -1.134 1 1 278 . 7 1 1 A 27 27 ALA H H 27 8.104 8.657 -0.553 1 1 279 . 7 1 1 A 27 27 ALA HA H 27 4.949 4.515 0.434 1 1 283 . 7 1 1 A 27 27 ALA C C 27 176.448 177.441 -0.993 1 1 284 . 7 1 1 A 27 27 ALA CA C 27 52.183 52.484 -0.301 1 1 285 . 7 1 1 A 27 27 ALA CB C 27 21.814 20.173 1.641 1 1 286 . 7 1 1 A 27 27 ALA N N 27 123.263 124.042 -0.779 1 1 287 . 7 1 1 A 28 28 THR H H 28 9.369 9.320 0.049 1 1 288 . 7 1 1 A 28 28 THR HA H 28 4.779 4.648 0.131 1 1 293 . 7 1 1 A 28 28 THR C C 28 173.725 174.090 -0.365 1 1 294 . 7 1 1 A 28 28 THR CA C 28 60.046 62.661 -2.615 1 1 295 . 7 1 1 A 28 28 THR CB C 28 70.592 69.507 1.085 1 1 297 . 7 1 1 A 28 28 THR N N 28 112.201 118.995 -6.794 1 1 298 . 7 1 1 A 29 29 LEU H H 29 8.518 8.584 -0.066 1 1 299 . 7 1 1 A 29 29 LEU HA H 29 3.332 3.778 -0.446 1 1 309 . 7 1 1 A 29 29 LEU C C 29 176.202 176.833 -0.631 1 1 310 . 7 1 1 A 29 29 LEU CA C 29 55.031 54.639 0.392 1 1 311 . 7 1 1 A 29 29 LEU CB C 29 40.624 41.638 -1.014 1 1 315 . 7 1 1 A 29 29 LEU N N 29 128.151 128.609 -0.458 1 1 316 . 7 1 1 A 30 30 GLU H H 30 9.269 8.788 0.481 1 1 317 . 7 1 1 A 30 30 GLU HA H 30 4.287 4.324 -0.037 1 1 321 . 7 1 1 A 30 30 GLU C C 30 176.740 176.422 0.318 1 1 322 . 7 1 1 A 30 30 GLU CA C 30 57.283 57.708 -0.425 1 1 323 . 7 1 1 A 30 30 GLU CB C 30 31.045 30.457 0.588 1 1 325 . 7 1 1 A 30 30 GLU N N 30 130.123 123.730 6.393 1 1 326 . 7 1 1 A 31 31 HIS H H 31 7.341 7.068 0.273 1 1 327 . 7 1 1 A 31 31 HIS HA H 31 4.701 4.642 0.059 1 1 331 . 7 1 1 A 31 31 HIS C C 31 172.581 172.686 -0.105 1 1 332 . 7 1 1 A 31 31 HIS CA C 31 55.876 56.069 -0.193 1 1 333 . 7 1 1 A 31 31 HIS CB C 31 33.434 32.679 0.755 1 1 334 . 7 1 1 A 31 31 HIS N N 31 113.223 117.974 -4.751 1 1 335 . 7 1 1 A 32 32 ARG H H 32 8.196 8.561 -0.365 1 1 336 . 7 1 1 A 32 32 ARG HA H 32 5.262 5.160 0.102 1 1 341 . 7 1 1 A 32 32 ARG C C 32 174.377 174.623 -0.246 1 1 342 . 7 1 1 A 32 32 ARG CA C 32 55.808 54.405 1.403 1 1 343 . 7 1 1 A 32 32 ARG CB C 32 33.340 34.286 -0.946 1 1 345 . 7 1 1 A 32 32 ARG N N 32 123.003 124.237 -1.234 1 1 346 . 7 1 1 A 33 33 VAL H H 33 8.956 9.400 -0.444 1 1 347 . 7 1 1 A 33 33 VAL HA H 33 4.734 4.920 -0.186 1 1 355 . 7 1 1 A 33 33 VAL C C 33 172.821 174.980 -2.159 1 1 356 . 7 1 1 A 33 33 VAL CA C 33 60.197 59.861 0.336 1 1 357 . 7 1 1 A 33 33 VAL CB C 33 35.860 35.411 0.449 1 1 360 . 7 1 1 A 33 33 VAL N N 33 122.929 116.781 6.148 1 1 361 . 7 1 1 A 34 34 THR H H 34 8.250 8.803 -0.553 1 1 362 . 7 1 1 A 34 34 THR HA H 34 5.616 5.721 -0.105 1 1 367 . 7 1 1 A 34 34 THR C C 34 173.913 173.533 0.380 1 1 368 . 7 1 1 A 34 34 THR CA C 34 60.245 60.529 -0.284 1 1 369 . 7 1 1 A 34 34 THR CB C 34 71.706 71.123 0.583 1 1 371 . 7 1 1 A 34 34 THR N N 34 119.164 116.338 2.826 1 1 372 . 7 1 1 A 35 35 PHE H H 35 8.565 8.724 -0.159 1 1 373 . 7 1 1 A 35 35 PHE HA H 35 5.029 5.071 -0.042 1 1 378 . 7 1 1 A 35 35 PHE C C 35 173.193 172.291 0.902 1 1 379 . 7 1 1 A 35 35 PHE CA C 35 55.687 56.180 -0.493 1 1 380 . 7 1 1 A 35 35 PHE CB C 35 40.853 40.829 0.024 1 1 383 . 7 1 1 A 35 35 PHE N N 35 120.244 118.378 1.866 1 1 384 . 7 1 1 A 36 36 ARG H H 36 8.869 8.587 0.282 1 1 385 . 7 1 1 A 36 36 ARG HA H 36 4.982 4.876 0.106 1 1 387 . 7 1 1 A 36 36 ARG C C 36 174.743 174.352 0.391 1 1 388 . 7 1 1 A 36 36 ARG CA C 36 55.493 54.457 1.036 1 1 389 . 7 1 1 A 36 36 ARG CB C 36 32.228 33.358 -1.130 1 1 390 . 7 1 1 A 36 36 ARG N N 36 123.893 118.866 5.027 1 1 391 . 7 1 1 A 37 37 ASP H H 37 8.402 8.891 -0.489 1 1 392 . 7 1 1 A 37 37 ASP HA H 37 5.462 5.340 0.122 1 1 395 . 7 1 1 A 37 37 ASP C C 37 175.177 175.113 0.064 1 1 396 . 7 1 1 A 37 37 ASP CA C 37 53.942 52.558 1.384 1 1 397 . 7 1 1 A 37 37 ASP CB C 37 45.486 43.355 2.131 1 1 398 . 7 1 1 A 37 37 ASP N N 37 127.149 123.122 4.027 1 1 399 . 7 1 1 A 38 38 THR H H 38 8.151 8.790 -0.639 1 1 400 . 7 1 1 A 38 38 THR HA H 38 4.866 4.927 -0.061 1 1 405 . 7 1 1 A 38 38 THR C C 38 172.792 173.291 -0.499 1 1 406 . 7 1 1 A 38 38 THR CA C 38 61.416 61.370 0.046 1 1 407 . 7 1 1 A 38 38 THR CB C 38 71.047 70.155 0.892 1 1 409 . 7 1 1 A 38 38 THR N N 38 115.686 117.473 -1.787 1 1 410 . 7 1 1 A 39 39 TYR H H 39 9.021 9.336 -0.315 1 1 411 . 7 1 1 A 39 39 TYR HA H 39 5.544 5.592 -0.048 1 1 416 . 7 1 1 A 39 39 TYR C C 39 176.032 174.643 1.389 1 1 417 . 7 1 1 A 39 39 TYR CA C 39 57.184 56.654 0.530 1 1 418 . 7 1 1 A 39 39 TYR CB C 39 41.642 40.915 0.727 1 1 420 . 7 1 1 A 39 39 TYR N N 39 124.579 126.429 -1.850 1 1 421 . 7 1 1 A 40 40 TYR H H 40 8.487 9.345 -0.858 1 1 422 . 7 1 1 A 40 40 TYR HA H 40 5.517 5.750 -0.233 1 1 426 . 7 1 1 A 40 40 TYR C C 40 174.108 174.463 -0.355 1 1 427 . 7 1 1 A 40 40 TYR CA C 40 56.979 56.778 0.201 1 1 428 . 7 1 1 A 40 40 TYR CB C 40 44.132 42.816 1.316 1 1 431 . 7 1 1 A 40 40 TYR N N 40 119.709 121.385 -1.676 1 1 432 . 7 1 1 A 41 41 ASP H H 41 9.341 9.034 0.307 1 1 433 . 7 1 1 A 41 41 ASP HA H 41 4.866 5.146 -0.280 1 1 436 . 7 1 1 A 41 41 ASP C C 41 177.262 174.706 2.556 1 1 437 . 7 1 1 A 41 41 ASP CA C 41 53.445 53.273 0.172 1 1 438 . 7 1 1 A 41 41 ASP CB C 41 45.347 44.643 0.704 1 1 439 . 7 1 1 A 41 41 ASP N N 41 117.995 120.252 -2.257 1 1 440 . 7 1 1 A 42 42 THR H H 42 11.574 8.660 2.914 1 1 441 . 7 1 1 A 42 42 THR HA H 42 5.206 4.518 0.688 1 1 446 . 7 1 1 A 42 42 THR C C 42 177.935 175.932 2.003 1 1 447 . 7 1 1 A 42 42 THR CA C 42 60.400 61.174 -0.774 1 1 448 . 7 1 1 A 42 42 THR CB C 42 72.114 70.900 1.214 1 1 450 . 7 1 1 A 42 42 THR N N 42 114.394 114.662 -0.268 1 1 451 . 7 1 1 A 43 43 SER H H 43 9.715 8.860 0.855 1 1 452 . 7 1 1 A 43 43 SER HA H 43 4.252 4.316 -0.064 1 1 455 . 7 1 1 A 43 43 SER C C 43 175.478 174.670 0.808 1 1 456 . 7 1 1 A 43 43 SER CA C 43 61.277 60.662 0.615 1 1 457 . 7 1 1 A 43 43 SER CB C 43 62.821 63.182 -0.361 1 1 458 . 7 1 1 A 43 43 SER N N 43 116.674 117.674 -1.000 1 1 459 . 7 1 1 A 44 44 GLU H H 44 7.674 7.603 0.071 1 1 460 . 7 1 1 A 44 44 GLU HA H 44 4.330 4.489 -0.159 1 1 464 . 7 1 1 A 44 44 GLU C C 44 175.001 175.331 -0.330 1 1 465 . 7 1 1 A 44 44 GLU CA C 44 55.992 55.477 0.515 1 1 466 . 7 1 1 A 44 44 GLU CB C 44 29.276 30.475 -1.199 1 1 468 . 7 1 1 A 44 44 GLU N N 44 117.856 118.350 -0.494 1 1 469 . 7 1 1 A 45 45 LEU H H 45 8.222 7.659 0.563 1 1 470 . 7 1 1 A 45 45 LEU HA H 45 3.901 4.664 -0.763 1 1 480 . 7 1 1 A 45 45 LEU C C 45 175.209 176.400 -1.191 1 1 481 . 7 1 1 A 45 45 LEU CA C 45 55.548 56.194 -0.646 1 1 482 . 7 1 1 A 45 45 LEU CB C 45 38.458 39.362 -0.904 1 1 485 . 7 1 1 A 45 45 LEU N N 45 119.335 117.407 1.928 1 1 486 . 7 1 1 A 46 46 SER H H 46 7.347 7.891 -0.544 1 1 487 . 7 1 1 A 46 46 SER HA H 46 3.954 4.102 -0.148 1 1 489 . 7 1 1 A 46 46 SER C C 46 177.497 176.289 1.208 1 1 490 . 7 1 1 A 46 46 SER CA C 46 62.471 62.318 0.153 1 1 491 . 7 1 1 A 46 46 SER CB C 46 63.908 62.902 1.006 1 1 492 . 7 1 1 A 46 46 SER N N 46 111.433 114.305 -2.872 1 1 493 . 7 1 1 A 47 47 LEU H H 47 12.003 8.274 3.729 1 1 494 . 7 1 1 A 47 47 LEU HA H 47 3.959 4.028 -0.069 1 1 504 . 7 1 1 A 47 47 LEU C C 47 180.340 178.259 2.081 1 1 505 . 7 1 1 A 47 47 LEU CA C 47 58.879 58.204 0.675 1 1 506 . 7 1 1 A 47 47 LEU CB C 47 39.572 41.844 -2.272 1 1 510 . 7 1 1 A 47 47 LEU N N 47 124.605 122.572 2.033 1 1 511 . 7 1 1 A 48 48 MET H H 48 10.599 8.934 1.665 1 1 512 . 7 1 1 A 48 48 MET HA H 48 3.213 3.632 -0.419 1 1 520 . 7 1 1 A 48 48 MET C C 48 181.177 177.815 3.362 1 1 521 . 7 1 1 A 48 48 MET CA C 48 60.747 58.214 2.533 1 1 522 . 7 1 1 A 48 48 MET CB C 48 32.594 32.129 0.465 1 1 525 . 7 1 1 A 48 48 MET N N 48 126.254 117.634 8.620 1 1 526 . 7 1 1 A 49 49 LEU H H 49 8.731 7.622 1.109 1 1 527 . 7 1 1 A 49 49 LEU HA H 49 4.097 4.102 -0.005 1 1 536 . 7 1 1 A 49 49 LEU C C 49 178.144 177.202 0.942 1 1 537 . 7 1 1 A 49 49 LEU CA C 49 57.800 56.403 1.397 1 1 538 . 7 1 1 A 49 49 LEU CB C 49 41.379 41.612 -0.233 1 1 541 . 7 1 1 A 49 49 LEU N N 49 119.183 120.985 -1.802 1 1 542 . 7 1 1 A 50 50 SER H H 50 7.853 7.582 0.271 1 1 543 . 7 1 1 A 50 50 SER HA H 50 4.822 4.548 0.274 1 1 546 . 7 1 1 A 50 50 SER C C 50 174.539 173.463 1.076 1 1 547 . 7 1 1 A 50 50 SER CA C 50 57.811 58.135 -0.324 1 1 548 . 7 1 1 A 50 50 SER CB C 50 64.443 63.327 1.116 1 1 549 . 7 1 1 A 50 50 SER N N 50 114.594 112.409 2.185 1 1 550 . 7 1 1 A 51 51 ASP H H 51 8.264 7.853 0.411 1 1 551 . 7 1 1 A 51 51 ASP HA H 51 4.362 4.025 0.337 1 1 554 . 7 1 1 A 51 51 ASP C C 51 172.921 174.382 -1.461 1 1 555 . 7 1 1 A 51 51 ASP CA C 51 55.343 55.304 0.039 1 1 556 . 7 1 1 A 51 51 ASP CB C 51 40.583 40.489 0.094 1 1 557 . 7 1 1 A 51 51 ASP N N 51 123.003 120.061 2.942 1 1 558 . 7 1 1 A 52 52 HIS H H 52 7.869 7.189 0.680 1 1 559 . 7 1 1 A 52 52 HIS HA H 52 5.335 5.540 -0.205 1 1 564 . 7 1 1 A 52 52 HIS C C 52 173.991 173.601 0.390 1 1 565 . 7 1 1 A 52 52 HIS CA C 52 55.889 53.991 1.898 1 1 566 . 7 1 1 A 52 52 HIS CB C 52 31.789 30.583 1.206 1 1 568 . 7 1 1 A 52 52 HIS N N 52 112.486 116.833 -4.347 1 1 569 . 7 1 1 A 53 53 TRP H H 53 8.165 8.968 -0.803 1 1 570 . 7 1 1 A 53 53 TRP HA H 53 4.926 5.231 -0.305 1 1 578 . 7 1 1 A 53 53 TRP C C 53 175.354 175.355 -0.001 1 1 579 . 7 1 1 A 53 53 TRP CA C 53 55.364 55.828 -0.464 1 1 580 . 7 1 1 A 53 53 TRP CB C 53 30.641 31.317 -0.676 1 1 585 . 7 1 1 A 53 53 TRP N N 53 117.916 125.233 -7.317 1 1 587 . 7 1 1 A 54 54 LEU H H 54 10.088 9.173 0.915 1 1 588 . 7 1 1 A 54 54 LEU HA H 54 5.497 5.606 -0.109 1 1 598 . 7 1 1 A 54 54 LEU C C 54 173.337 175.404 -2.067 1 1 599 . 7 1 1 A 54 54 LEU CA C 54 54.408 53.767 0.641 1 1 600 . 7 1 1 A 54 54 LEU CB C 54 44.156 46.003 -1.847 1 1 604 . 7 1 1 A 54 54 LEU N N 54 130.826 125.272 5.554 1 1 605 . 7 1 1 A 55 55 ARG H H 55 9.289 9.526 -0.237 1 1 606 . 7 1 1 A 55 55 ARG HA H 55 5.482 5.218 0.264 1 1 612 . 7 1 1 A 55 55 ARG C C 55 174.057 173.820 0.237 1 1 613 . 7 1 1 A 55 55 ARG CA C 55 53.167 54.020 -0.853 1 1 614 . 7 1 1 A 55 55 ARG CB C 55 34.270 33.873 0.397 1 1 616 . 7 1 1 A 55 55 ARG N N 55 125.089 124.940 0.149 1 1 618 . 7 1 1 A 56 56 GLN H H 56 9.092 9.094 -0.002 1 1 619 . 7 1 1 A 56 56 GLN HA H 56 3.991 4.706 -0.715 1 1 626 . 7 1 1 A 56 56 GLN C C 56 174.199 174.185 0.014 1 1 627 . 7 1 1 A 56 56 GLN CA C 56 54.566 53.816 0.750 1 1 628 . 7 1 1 A 56 56 GLN CB C 56 29.643 30.748 -1.105 1 1 630 . 7 1 1 A 56 56 GLN N N 56 124.355 120.259 4.096 1 1 632 . 7 1 1 A 57 57 ARG H H 57 8.440 8.328 0.112 1 1 633 . 7 1 1 A 57 57 ARG HA H 57 5.316 4.870 0.446 1 1 639 . 7 1 1 A 57 57 ARG C C 57 176.188 176.169 0.019 1 1 640 . 7 1 1 A 57 57 ARG CA C 57 53.940 55.006 -1.066 1 1 641 . 7 1 1 A 57 57 ARG CB C 57 32.426 32.224 0.202 1 1 643 . 7 1 1 A 57 57 ARG N N 57 130.222 125.586 4.636 1 1 645 . 7 1 1 A 58 58 GLU H H 58 8.891 8.919 -0.028 1 1 646 . 7 1 1 A 58 58 GLU HA H 58 3.996 4.065 -0.069 1 1 649 . 7 1 1 A 58 58 GLU CA C 58 58.364 57.380 0.984 1 1 650 . 7 1 1 A 58 58 GLU CB C 58 30.875 27.454 3.421 1 1 651 . 7 1 1 A 58 58 GLU N N 58 131.208 121.572 9.636 1 1 652 . 7 1 1 A 59 59 GLY H H 59 8.367 8.360 0.007 1 1 653 . 7 1 1 A 59 59 GLY HA2 H 59 4.334 3.822 0.512 1 1 654 . 7 1 1 A 59 59 GLY HA3 H 59 3.743 3.881 -0.138 1 1 655 . 7 1 1 A 59 59 GLY C C 59 174.194 175.102 -0.908 1 1 656 . 7 1 1 A 59 59 GLY CA C 59 45.666 45.920 -0.254 1 1 657 . 7 1 1 A 60 60 SER H H 60 8.071 8.432 -0.361 1 1 658 . 7 1 1 A 60 60 SER HA H 60 4.730 4.432 0.298 1 1 661 . 7 1 1 A 60 60 SER C C 60 173.908 174.043 -0.135 1 1 662 . 7 1 1 A 60 60 SER CA C 60 58.762 59.237 -0.475 1 1 663 . 7 1 1 A 60 60 SER CB C 60 64.497 63.367 1.130 1 1 664 . 7 1 1 A 60 60 SER N N 60 114.636 114.819 -0.183 1 1 665 . 7 1 1 A 61 61 GLY H H 61 8.401 7.384 1.017 1 1 666 . 7 1 1 A 61 61 GLY HA2 H 61 4.560 4.016 0.544 1 1 667 . 7 1 1 A 61 61 GLY HA3 H 61 3.878 4.038 -0.160 1 1 668 . 7 1 1 A 61 61 GLY C C 61 173.526 172.009 1.517 1 1 669 . 7 1 1 A 61 61 GLY CA C 61 44.906 45.313 -0.407 1 1 670 . 7 1 1 A 61 61 GLY N N 61 109.421 107.029 2.392 1 1 671 . 7 1 1 A 62 62 TRP H H 62 8.861 8.487 0.374 1 1 672 . 7 1 1 A 62 62 TRP HA H 62 5.089 5.313 -0.224 1 1 681 . 7 1 1 A 62 62 TRP C C 62 176.168 175.846 0.322 1 1 682 . 7 1 1 A 62 62 TRP CA C 62 57.459 57.435 0.024 1 1 683 . 7 1 1 A 62 62 TRP CB C 62 32.536 31.471 1.065 1 1 689 . 7 1 1 A 62 62 TRP N N 62 122.939 121.005 1.934 1 1 691 . 7 1 1 A 63 63 GLU H H 63 9.306 9.673 -0.367 1 1 692 . 7 1 1 A 63 63 GLU HA H 63 4.919 5.439 -0.520 1 1 697 . 7 1 1 A 63 63 GLU C C 63 173.770 174.117 -0.347 1 1 698 . 7 1 1 A 63 63 GLU CA C 63 55.953 55.197 0.756 1 1 699 . 7 1 1 A 63 63 GLU CB C 63 35.317 33.503 1.814 1 1 701 . 7 1 1 A 63 63 GLU N N 63 120.136 122.085 -1.949 1 1 702 . 7 1 1 A 64 64 LEU H H 64 8.998 9.584 -0.586 1 1 703 . 7 1 1 A 64 64 LEU HA H 64 5.616 5.584 0.032 1 1 712 . 7 1 1 A 64 64 LEU C C 64 175.014 174.146 0.868 1 1 713 . 7 1 1 A 64 64 LEU CA C 64 52.945 53.724 -0.779 1 1 714 . 7 1 1 A 64 64 LEU CB C 64 46.904 46.088 0.816 1 1 717 . 7 1 1 A 64 64 LEU N N 64 127.321 128.699 -1.378 1 1 718 . 7 1 1 A 65 65 LYS H H 65 9.322 10.111 -0.789 1 1 719 . 7 1 1 A 65 65 LYS HA H 65 5.347 5.185 0.162 1 1 727 . 7 1 1 A 65 65 LYS C C 65 175.811 175.366 0.445 1 1 728 . 7 1 1 A 65 65 LYS CA C 65 55.817 55.329 0.488 1 1 729 . 7 1 1 A 65 65 LYS CB C 65 34.521 34.789 -0.268 1 1 733 . 7 1 1 A 65 65 LYS N N 65 129.874 128.407 1.467 1 1 734 . 7 1 1 A 66 66 CYS H H 66 9.129 9.312 -0.183 1 1 735 . 7 1 1 A 66 66 CYS HA H 66 5.319 4.860 0.459 1 1 738 . 7 1 1 A 66 66 CYS CA C 66 54.532 57.003 -2.471 1 1 739 . 7 1 1 A 66 66 CYS CB C 66 28.813 29.828 -1.015 1 1 740 . 7 1 1 A 66 66 CYS N N 66 121.497 124.450 -2.953 1 1 741 . 7 1 1 A 67 67 PRO HA H 67 4.439 4.324 0.115 1 1 748 . 7 1 1 A 67 67 PRO C C 67 177.297 177.941 -0.644 1 1 749 . 7 1 1 A 67 67 PRO CA C 67 63.596 62.993 0.603 1 1 750 . 7 1 1 A 67 67 PRO CB C 67 32.242 30.621 1.621 1 1 752 . 7 1 1 A 68 68 GLY H H 68 8.316 8.334 -0.018 1 1 753 . 7 1 1 A 68 68 GLY HA2 H 68 3.726 3.926 -0.200 1 1 754 . 7 1 1 A 68 68 GLY HA3 H 68 4.095 3.953 0.142 1 1 755 . 7 1 1 A 68 68 GLY C C 68 173.789 173.730 0.059 1 1 756 . 7 1 1 A 68 68 GLY CA C 68 45.227 45.877 -0.650 1 1 757 . 7 1 1 A 68 68 GLY N N 68 109.533 108.701 0.832 1 1 758 . 7 1 1 A 69 69 VAL H H 69 8.114 7.762 0.352 1 1 759 . 7 1 1 A 69 69 VAL HA H 69 4.266 4.499 -0.233 1 1 764 . 7 1 1 A 69 69 VAL C C 69 176.299 174.961 1.338 1 1 765 . 7 1 1 A 69 69 VAL CA C 69 61.945 61.267 0.678 1 1 766 . 7 1 1 A 69 69 VAL CB C 69 33.082 34.854 -1.772 1 1 768 . 7 1 1 A 69 69 VAL N N 69 118.540 120.952 -2.412 1 1 769 . 7 1 1 A 70 70 THR H H 70 8.324 8.707 -0.383 1 1 770 . 7 1 1 A 70 70 THR HA H 70 4.373 4.564 -0.191 1 1 775 . 7 1 1 A 70 70 THR C C 70 175.204 175.631 -0.427 1 1 776 . 7 1 1 A 70 70 THR CA C 70 62.309 63.233 -0.924 1 1 777 . 7 1 1 A 70 70 THR CB C 70 69.787 71.228 -1.441 1 1 779 . 7 1 1 A 70 70 THR N N 70 117.636 121.870 -4.234 1 1 780 . 7 1 1 A 71 71 GLY H H 71 8.574 7.969 0.605 1 1 781 . 7 1 1 A 71 71 GLY HA2 H 71 4.096 4.148 -0.052 1 1 782 . 7 1 1 A 71 71 GLY HA3 H 71 3.975 4.151 -0.176 1 1 783 . 7 1 1 A 71 71 GLY C C 71 174.313 175.332 -1.019 1 1 784 . 7 1 1 A 71 71 GLY CA C 71 45.545 45.520 0.025 1 1 785 . 7 1 1 A 71 71 GLY N N 71 111.677 107.536 4.141 1 1 786 . 7 1 1 A 72 72 VAL H H 72 7.945 7.862 0.083 1 1 787 . 7 1 1 A 72 72 VAL HA H 72 4.258 3.802 0.456 1 1 795 . 7 1 1 A 72 72 VAL C C 72 176.162 177.099 -0.937 1 1 796 . 7 1 1 A 72 72 VAL CA C 72 62.227 65.511 -3.284 1 1 797 . 7 1 1 A 72 72 VAL CB C 72 32.997 32.170 0.827 1 1 799 . 7 1 1 A 72 72 VAL N N 72 118.647 120.062 -1.415 1 1 800 . 7 1 1 A 73 73 SER H H 73 8.498 7.795 0.703 1 1 801 . 7 1 1 A 73 73 SER HA H 73 4.617 4.588 0.029 1 1 803 . 7 1 1 A 73 73 SER C C 73 174.461 174.575 -0.114 1 1 804 . 7 1 1 A 73 73 SER CA C 73 58.218 58.704 -0.486 1 1 805 . 7 1 1 A 73 73 SER CB C 73 64.061 64.122 -0.061 1 1 806 . 7 1 1 A 73 73 SER N N 73 118.828 111.152 7.676 1 1 807 . 7 1 1 A 74 74 GLY H H 74 8.247 8.123 0.124 1 1 808 . 7 1 1 A 74 74 GLY HA2 H 74 4.101 4.071 0.030 1 1 809 . 7 1 1 A 74 74 GLY HA3 H 74 4.304 4.161 0.143 1 1 810 . 7 1 1 A 74 74 GLY CA C 74 44.896 44.072 0.824 1 1 811 . 7 1 1 A 74 74 GLY N N 74 111.138 108.084 3.054 1 1 812 . 7 1 1 A 75 75 PRO HA H 75 4.461 4.492 -0.031 1 1 819 . 7 1 1 A 75 75 PRO C C 75 176.798 175.256 1.542 1 1 820 . 7 1 1 A 75 75 PRO CA C 75 63.466 63.184 0.282 1 1 821 . 7 1 1 A 75 75 PRO CB C 75 31.980 31.777 0.203 1 1 824 . 7 1 1 A 76 76 HIS H H 76 8.397 8.055 0.342 1 1 825 . 7 1 1 A 76 76 HIS HA H 76 4.742 5.021 -0.279 1 1 829 . 7 1 1 A 76 76 HIS C C 76 174.282 174.879 -0.597 1 1 830 . 7 1 1 A 76 76 HIS CA C 76 55.579 54.897 0.682 1 1 831 . 7 1 1 A 76 76 HIS CB C 76 30.501 33.176 -2.675 1 1 832 . 7 1 1 A 76 76 HIS N N 76 118.431 122.048 -3.617 1 1 833 . 7 1 1 A 77 77 ASN H H 77 8.364 9.103 -0.739 1 1 834 . 7 1 1 A 77 77 ASN HA H 77 4.767 4.434 0.333 1 1 839 . 7 1 1 A 77 77 ASN C C 77 174.576 174.001 0.575 1 1 840 . 7 1 1 A 77 77 ASN CA C 77 53.139 55.319 -2.180 1 1 841 . 7 1 1 A 77 77 ASN CB C 77 39.320 38.397 0.923 1 1 842 . 7 1 1 A 77 77 ASN N N 77 119.421 119.176 0.245 1 1 844 . 7 1 1 A 78 78 GLU H H 78 8.683 7.537 1.146 1 1 845 . 7 1 1 A 78 78 GLU HA H 78 4.409 4.468 -0.059 1 1 850 . 7 1 1 A 78 78 GLU C C 78 175.791 174.047 1.744 1 1 851 . 7 1 1 A 78 78 GLU CA C 78 56.359 55.395 0.964 1 1 852 . 7 1 1 A 78 78 GLU CB C 78 30.818 31.297 -0.479 1 1 854 . 7 1 1 A 78 78 GLU N N 78 122.085 113.001 9.084 1 1 855 . 7 1 1 A 79 79 TYR H H 79 8.341 8.593 -0.252 1 1 856 . 7 1 1 A 79 79 TYR HA H 79 4.988 5.028 -0.040 1 1 861 . 7 1 1 A 79 79 TYR C C 79 175.837 175.900 -0.063 1 1 862 . 7 1 1 A 79 79 TYR CA C 79 58.028 58.492 -0.464 1 1 863 . 7 1 1 A 79 79 TYR CB C 79 41.672 39.727 1.945 1 1 866 . 7 1 1 A 79 79 TYR N N 79 119.452 121.007 -1.555 1 1 867 . 7 1 1 A 80 80 VAL H H 80 9.366 9.780 -0.414 1 1 868 . 7 1 1 A 80 80 VAL HA H 80 4.370 4.974 -0.604 1 1 873 . 7 1 1 A 80 80 VAL C C 80 174.948 174.437 0.511 1 1 874 . 7 1 1 A 80 80 VAL CA C 80 61.190 59.656 1.534 1 1 875 . 7 1 1 A 80 80 VAL CB C 80 34.204 34.212 -0.008 1 1 877 . 7 1 1 A 80 80 VAL N N 80 120.567 118.568 1.999 1 1 878 . 7 1 1 A 81 81 GLU H H 81 8.570 9.091 -0.521 1 1 879 . 7 1 1 A 81 81 GLU HA H 81 4.770 5.224 -0.454 1 1 883 . 7 1 1 A 81 81 GLU C C 81 175.491 175.322 0.169 1 1 884 . 7 1 1 A 81 81 GLU CA C 81 55.655 54.746 0.909 1 1 885 . 7 1 1 A 81 81 GLU CB C 81 30.415 33.008 -2.593 1 1 887 . 7 1 1 A 81 81 GLU N N 81 124.248 122.866 1.382 1 1 888 . 7 1 1 A 82 82 VAL H H 82 9.189 9.643 -0.454 1 1 889 . 7 1 1 A 82 82 VAL HA H 82 4.279 4.481 -0.202 1 1 894 . 7 1 1 A 82 82 VAL C C 82 176.087 176.265 -0.178 1 1 895 . 7 1 1 A 82 82 VAL CA C 82 62.672 61.985 0.687 1 1 896 . 7 1 1 A 82 82 VAL CB C 82 33.121 33.065 0.056 1 1 898 . 7 1 1 A 82 82 VAL N N 82 127.776 124.464 3.312 1 1 899 . 7 1 1 A 83 83 THR H H 83 8.590 8.723 -0.133 1 1 900 . 7 1 1 A 83 83 THR HA H 83 4.955 4.696 0.259 1 1 905 . 7 1 1 A 83 83 THR C C 83 174.688 174.548 0.140 1 1 906 . 7 1 1 A 83 83 THR CA C 83 61.332 61.733 -0.401 1 1 907 . 7 1 1 A 83 83 THR CB C 83 70.213 69.923 0.290 1 1 909 . 7 1 1 A 83 83 THR N N 83 114.744 118.526 -3.782 1 1 910 . 7 1 1 A 84 84 SER H H 84 7.650 7.550 0.100 1 1 911 . 7 1 1 A 84 84 SER HA H 84 4.819 4.633 0.186 1 1 914 . 7 1 1 A 84 84 SER CA C 84 56.280 59.092 -2.812 1 1 915 . 7 1 1 A 84 84 SER CB C 84 63.294 63.967 -0.673 1 1 916 . 7 1 1 A 84 84 SER N N 84 118.038 117.972 0.066 1 1 917 . 7 1 1 A 85 85 GLU H H 85 8.391 8.887 -0.496 1 1 918 . 7 1 1 A 85 85 GLU HA H 85 3.661 3.971 -0.310 1 1 923 . 7 1 1 A 85 85 GLU C C 85 177.520 178.623 -1.103 1 1 924 . 7 1 1 A 85 85 GLU CA C 85 62.429 59.732 2.697 1 1 925 . 7 1 1 A 85 85 GLU CB C 85 29.655 29.399 0.256 1 1 927 . 7 1 1 A 86 86 ALA H H 86 8.443 8.178 0.265 1 1 928 . 7 1 1 A 86 86 ALA HA H 86 4.027 4.014 0.013 1 1 932 . 7 1 1 A 86 86 ALA C C 86 180.423 179.908 0.515 1 1 933 . 7 1 1 A 86 86 ALA CA C 86 55.145 55.022 0.123 1 1 934 . 7 1 1 A 86 86 ALA CB C 86 18.165 18.426 -0.261 1 1 935 . 7 1 1 A 86 86 ALA N N 86 119.636 123.061 -3.425 1 1 936 . 7 1 1 A 87 87 ALA H H 87 7.214 7.418 -0.204 1 1 937 . 7 1 1 A 87 87 ALA HA H 87 4.244 4.065 0.179 1 1 941 . 7 1 1 A 87 87 ALA C C 87 180.354 180.108 0.246 1 1 942 . 7 1 1 A 87 87 ALA CA C 87 54.378 54.880 -0.502 1 1 943 . 7 1 1 A 87 87 ALA CB C 87 18.795 18.562 0.233 1 1 944 . 7 1 1 A 87 87 ALA N N 87 121.004 120.604 0.400 1 1 945 . 7 1 1 A 88 88 ILE H H 88 8.471 7.432 1.039 1 1 946 . 7 1 1 A 88 88 ILE HA H 88 3.360 3.697 -0.337 1 1 954 . 7 1 1 A 88 88 ILE CA C 88 66.323 64.712 1.611 1 1 955 . 7 1 1 A 88 88 ILE CB C 88 37.808 37.742 0.066 1 1 958 . 7 1 1 A 88 88 ILE N N 88 120.743 120.115 0.628 1 1 959 . 7 1 1 A 89 89 VAL H H 89 8.343 8.409 -0.066 1 1 960 . 7 1 1 A 89 89 VAL HA H 89 3.061 3.497 -0.436 1 1 968 . 7 1 1 A 89 89 VAL C C 89 176.708 177.911 -1.203 1 1 969 . 7 1 1 A 89 89 VAL CA C 89 67.833 66.521 1.312 1 1 970 . 7 1 1 A 89 89 VAL CB C 89 31.509 31.479 0.030 1 1 973 . 7 1 1 A 89 89 VAL N N 89 118.049 119.907 -1.858 1 1 974 . 7 1 1 A 90 90 ALA H H 90 7.516 7.845 -0.329 1 1 975 . 7 1 1 A 90 90 ALA HA H 90 3.987 3.897 0.090 1 1 979 . 7 1 1 A 90 90 ALA C C 90 180.744 179.295 1.449 1 1 980 . 7 1 1 A 90 90 ALA CA C 90 55.481 55.693 -0.212 1 1 981 . 7 1 1 A 90 90 ALA CB C 90 17.953 18.238 -0.285 1 1 982 . 7 1 1 A 90 90 ALA N N 90 118.935 122.166 -3.231 1 1 983 . 7 1 1 A 91 91 GLN H H 91 7.886 8.235 -0.349 1 1 984 . 7 1 1 A 91 91 GLN HA H 91 4.190 4.012 0.178 1 1 991 . 7 1 1 A 91 91 GLN C C 91 178.832 178.565 0.267 1 1 992 . 7 1 1 A 91 91 GLN CA C 91 58.519 58.882 -0.363 1 1 993 . 7 1 1 A 91 91 GLN CB C 91 28.091 28.039 0.052 1 1 995 . 7 1 1 A 91 91 GLN N N 91 117.846 118.045 -0.199 1 1 997 . 7 1 1 A 92 92 LEU H H 92 8.751 8.769 -0.018 1 1 998 . 7 1 1 A 92 92 LEU HA H 92 3.903 3.971 -0.068 1 1 1007 . 7 1 1 A 92 92 LEU C C 92 178.997 179.093 -0.096 1 1 1008 . 7 1 1 A 92 92 LEU CA C 92 58.136 57.932 0.204 1 1 1009 . 7 1 1 A 92 92 LEU CB C 92 41.576 41.744 -0.168 1 1 1013 . 7 1 1 A 92 92 LEU N N 92 119.547 119.842 -0.295 1 1 1014 . 7 1 1 A 93 93 PHE H H 93 8.648 8.063 0.585 1 1 1015 . 7 1 1 A 93 93 PHE HA H 93 4.270 4.265 0.005 1 1 1020 . 7 1 1 A 93 93 PHE C C 93 179.283 178.785 0.498 1 1 1021 . 7 1 1 A 93 93 PHE CA C 93 59.860 60.435 -0.575 1 1 1022 . 7 1 1 A 93 93 PHE CB C 93 37.765 38.321 -0.556 1 1 1025 . 7 1 1 A 93 93 PHE N N 93 118.041 118.519 -0.478 1 1 1026 . 7 1 1 A 94 94 GLU H H 94 7.739 8.439 -0.700 1 1 1027 . 7 1 1 A 94 94 GLU HA H 94 4.110 4.125 -0.015 1 1 1031 . 7 1 1 A 94 94 GLU C C 94 178.629 178.777 -0.148 1 1 1032 . 7 1 1 A 94 94 GLU CA C 94 59.359 59.377 -0.018 1 1 1033 . 7 1 1 A 94 94 GLU CB C 94 29.589 28.691 0.898 1 1 1035 . 7 1 1 A 94 94 GLU N N 94 119.980 117.192 2.788 1 1 1036 . 7 1 1 A 95 95 LEU H H 95 7.999 8.241 -0.242 1 1 1037 . 7 1 1 A 95 95 LEU HA H 95 4.139 3.936 0.203 1 1 1047 . 7 1 1 A 95 95 LEU C C 95 178.965 178.933 0.032 1 1 1048 . 7 1 1 A 95 95 LEU CA C 95 57.557 57.852 -0.295 1 1 1049 . 7 1 1 A 95 95 LEU CB C 95 43.443 41.482 1.961 1 1 1053 . 7 1 1 A 95 95 LEU N N 95 118.398 121.638 -3.240 1 1 1054 . 7 1 1 A 96 96 LEU H H 96 8.363 8.035 0.328 1 1 1055 . 7 1 1 A 96 96 LEU HA H 96 4.503 4.199 0.304 1 1 1061 . 7 1 1 A 96 96 LEU C C 96 177.932 177.023 0.909 1 1 1062 . 7 1 1 A 96 96 LEU CA C 96 54.700 55.106 -0.406 1 1 1063 . 7 1 1 A 96 96 LEU CB C 96 43.048 42.381 0.667 1 1 1065 . 7 1 1 A 96 96 LEU N N 96 114.720 116.888 -2.168 1 1 1066 . 7 1 1 A 97 97 GLY H H 97 7.810 7.713 0.097 1 1 1067 . 7 1 1 A 97 97 GLY HA2 H 97 3.963 3.902 0.061 1 1 1068 . 7 1 1 A 97 97 GLY C C 97 173.535 174.538 -1.003 1 1 1069 . 7 1 1 A 97 97 GLY CA C 97 45.667 46.631 -0.964 1 1 1070 . 7 1 1 A 97 97 GLY N N 97 109.511 108.756 0.755 1 1 1071 . 7 1 1 A 98 98 SER H H 98 8.131 7.890 0.241 1 1 1072 . 7 1 1 A 98 98 SER HA H 98 4.225 4.229 -0.004 1 1 1075 . 7 1 1 A 98 98 SER C C 98 174.974 174.924 0.050 1 1 1076 . 7 1 1 A 98 98 SER CA C 98 57.960 60.152 -2.192 1 1 1077 . 7 1 1 A 98 98 SER CB C 98 63.997 63.989 0.008 1 1 1078 . 7 1 1 A 98 98 SER N N 98 113.405 115.100 -1.695 1 1 1079 . 7 1 1 A 99 99 GLY H H 99 8.052 8.274 -0.222 1 1 1080 . 7 1 1 A 99 99 GLY HA2 H 99 3.998 3.933 0.065 1 1 1081 . 7 1 1 A 99 99 GLY HA3 H 99 3.778 3.964 -0.186 1 1 1082 . 7 1 1 A 99 99 GLY C C 99 174.033 174.211 -0.178 1 1 1083 . 7 1 1 A 99 99 GLY CA C 99 45.123 45.870 -0.747 1 1 1084 . 7 1 1 A 99 99 GLY N N 99 111.534 108.663 2.871 1 1 1085 . 7 1 1 A 100 100 GLU H H 100 8.177 8.138 0.039 1 1 1086 . 7 1 1 A 100 100 GLU HA H 100 4.201 4.750 -0.549 1 1 1091 . 7 1 1 A 100 100 GLU C C 100 175.830 176.572 -0.742 1 1 1092 . 7 1 1 A 100 100 GLU CA C 100 56.442 55.232 1.210 1 1 1093 . 7 1 1 A 100 100 GLU CB C 100 30.428 31.374 -0.946 1 1 1095 . 7 1 1 A 100 100 GLU N N 100 120.463 120.139 0.324 1 1 1096 . 7 1 1 A 101 101 GLN H H 101 8.161 8.431 -0.270 1 1 1097 . 7 1 1 A 101 101 GLN HA H 101 4.098 4.208 -0.110 1 1 1103 . 7 1 1 A 101 101 GLN C C 101 175.412 175.197 0.215 1 1 1104 . 7 1 1 A 101 101 GLN CA C 101 55.632 55.206 0.426 1 1 1105 . 7 1 1 A 101 101 GLN CB C 101 29.569 29.064 0.505 1 1 1107 . 7 1 1 A 101 101 GLN N N 101 120.014 121.219 -1.205 1 1 1109 . 7 1 1 A 102 102 LYS H H 102 8.235 8.339 -0.104 1 1 1110 . 7 1 1 A 102 102 LYS HA H 102 4.387 4.317 0.070 1 1 1117 . 7 1 1 A 102 102 LYS CA C 102 54.116 52.121 1.995 1 1 1118 . 7 1 1 A 102 102 LYS CB C 102 32.478 32.664 -0.186 1 1 1122 . 7 1 1 A 102 102 LYS N N 102 123.399 121.034 2.365 1 1 1123 . 7 1 1 A 103 103 PRO HA H 103 4.498 4.397 0.101 1 1 1129 . 7 1 1 A 103 103 PRO C C 103 175.473 177.049 -1.576 1 1 1130 . 7 1 1 A 103 103 PRO CA C 103 62.802 66.039 -3.237 1 1 1131 . 7 1 1 A 103 103 PRO CB C 103 32.124 31.514 0.610 1 1 1134 . 7 1 1 A 104 104 ALA H H 104 8.017 7.276 0.741 1 1 1135 . 7 1 1 A 104 104 ALA HA H 104 4.318 4.347 -0.029 1 1 1139 . 7 1 1 A 104 104 ALA C C 104 176.717 176.942 -0.225 1 1 1140 . 7 1 1 A 104 104 ALA CA C 104 52.194 53.192 -0.998 1 1 1141 . 7 1 1 A 104 104 ALA CB C 104 20.113 20.380 -0.267 1 1 1142 . 7 1 1 A 104 104 ALA N N 104 122.093 117.731 4.362 1 1 1143 . 7 1 1 A 105 105 GLY H H 105 7.678 8.208 -0.530 1 1 1144 . 7 1 1 A 105 105 GLY HA2 H 105 3.851 4.115 -0.264 1 1 1145 . 7 1 1 A 105 105 GLY HA3 H 105 4.053 4.133 -0.080 1 1 1146 . 7 1 1 A 105 105 GLY C C 105 172.990 174.803 -1.813 1 1 1147 . 7 1 1 A 105 105 GLY CA C 105 44.241 43.623 0.618 1 1 1148 . 7 1 1 A 105 105 GLY N N 105 105.234 105.240 -0.006 1 1 1149 . 7 1 1 A 106 106 VAL H H 106 8.409 8.724 -0.315 1 1 1150 . 7 1 1 A 106 106 VAL HA H 106 2.829 3.352 -0.523 1 1 1158 . 7 1 1 A 106 106 VAL C C 106 177.822 177.245 0.577 1 1 1159 . 7 1 1 A 106 106 VAL CA C 106 65.522 65.553 -0.031 1 1 1160 . 7 1 1 A 106 106 VAL CB C 106 30.701 30.689 0.012 1 1 1163 . 7 1 1 A 106 106 VAL N N 106 119.215 119.207 0.008 1 1 1164 . 7 1 1 A 107 107 ALA H H 107 8.707 8.445 0.262 1 1 1165 . 7 1 1 A 107 107 ALA HA H 107 3.730 3.815 -0.085 1 1 1169 . 7 1 1 A 107 107 ALA C C 107 179.661 180.093 -0.432 1 1 1170 . 7 1 1 A 107 107 ALA CA C 107 54.995 55.463 -0.468 1 1 1171 . 7 1 1 A 107 107 ALA CB C 107 17.705 17.923 -0.218 1 1 1172 . 7 1 1 A 107 107 ALA N N 107 118.672 121.895 -3.223 1 1 1173 . 7 1 1 A 108 108 ALA H H 108 7.388 7.776 -0.388 1 1 1174 . 7 1 1 A 108 108 ALA HA H 108 4.259 4.083 0.176 1 1 1178 . 7 1 1 A 108 108 ALA C C 108 179.318 179.601 -0.283 1 1 1179 . 7 1 1 A 108 108 ALA CA C 108 53.481 55.127 -1.646 1 1 1180 . 7 1 1 A 108 108 ALA CB C 108 19.367 18.578 0.789 1 1 1181 . 7 1 1 A 108 108 ALA N N 108 116.635 120.485 -3.850 1 1 1182 . 7 1 1 A 109 109 VAL H H 109 7.689 7.175 0.514 1 1 1183 . 7 1 1 A 109 109 VAL HA H 109 4.532 3.852 0.680 1 1 1191 . 7 1 1 A 109 109 VAL C C 109 176.055 178.024 -1.969 1 1 1192 . 7 1 1 A 109 109 VAL CA C 109 61.452 65.766 -4.314 1 1 1193 . 7 1 1 A 109 109 VAL CB C 109 32.728 31.449 1.279 1 1 1196 . 7 1 1 A 109 109 VAL N N 109 112.851 117.378 -4.527 1 1 1197 . 7 1 1 A 110 110 LEU H H 110 7.099 8.128 -1.029 1 1 1198 . 7 1 1 A 110 110 LEU HA H 110 3.723 3.785 -0.062 1 1 1208 . 7 1 1 A 110 110 LEU C C 110 179.040 178.804 0.236 1 1 1209 . 7 1 1 A 110 110 LEU CA C 110 58.825 57.875 0.950 1 1 1210 . 7 1 1 A 110 110 LEU CB C 110 41.242 41.761 -0.519 1 1 1214 . 7 1 1 A 110 110 LEU N N 110 119.829 125.070 -5.241 1 1 1215 . 7 1 1 A 111 111 GLY H H 111 8.435 7.709 0.726 1 1 1216 . 7 1 1 A 111 111 GLY HA2 H 111 3.970 3.839 0.131 1 1 1217 . 7 1 1 A 111 111 GLY HA3 H 111 3.885 3.843 0.042 1 1 1218 . 7 1 1 A 111 111 GLY C C 111 178.031 176.698 1.333 1 1 1219 . 7 1 1 A 111 111 GLY CA C 111 46.961 47.545 -0.584 1 1 1220 . 7 1 1 A 111 111 GLY N N 111 104.089 106.575 -2.486 1 1 1221 . 7 1 1 A 112 112 SER H H 112 8.343 7.999 0.344 1 1 1222 . 7 1 1 A 112 112 SER HA H 112 4.266 4.160 0.106 1 1 1224 . 7 1 1 A 112 112 SER C C 112 175.885 175.120 0.765 1 1 1225 . 7 1 1 A 112 112 SER CA C 112 61.304 62.534 -1.230 1 1 1226 . 7 1 1 A 112 112 SER CB C 112 62.901 62.938 -0.037 1 1 1227 . 7 1 1 A 112 112 SER N N 112 119.497 119.381 0.116 1 1 1228 . 7 1 1 A 113 113 LEU H H 113 7.667 7.745 -0.078 1 1 1229 . 7 1 1 A 113 113 LEU HA H 113 4.343 4.175 0.168 1 1 1238 . 7 1 1 A 113 113 LEU C C 113 174.760 176.088 -1.328 1 1 1239 . 7 1 1 A 113 113 LEU CA C 113 54.228 54.419 -0.191 1 1 1240 . 7 1 1 A 113 113 LEU CB C 113 41.467 41.674 -0.207 1 1 1244 . 7 1 1 A 113 113 LEU N N 113 118.843 117.600 1.243 1 1 1245 . 7 1 1 A 114 114 LYS H H 114 7.685 7.655 0.030 1 1 1246 . 7 1 1 A 114 114 LYS HA H 114 3.958 3.862 0.096 1 1 1250 . 7 1 1 A 114 114 LYS C C 114 177.557 175.580 1.977 1 1 1251 . 7 1 1 A 114 114 LYS CA C 114 56.935 57.391 -0.456 1 1 1252 . 7 1 1 A 114 114 LYS CB C 114 28.898 29.331 -0.433 1 1 1254 . 7 1 1 A 114 114 LYS N N 114 114.072 116.633 -2.561 1 1 1255 . 7 1 1 A 115 115 LEU H H 115 8.329 8.024 0.305 1 1 1256 . 7 1 1 A 115 115 LEU HA H 115 4.315 4.376 -0.061 1 1 1265 . 7 1 1 A 115 115 LEU C C 115 175.988 176.958 -0.970 1 1 1266 . 7 1 1 A 115 115 LEU CA C 115 54.310 55.044 -0.734 1 1 1267 . 7 1 1 A 115 115 LEU CB C 115 44.163 42.590 1.573 1 1 1270 . 7 1 1 A 115 115 LEU N N 115 117.951 119.407 -1.456 1 1 1271 . 7 1 1 A 116 116 GLN H H 116 9.100 9.350 -0.250 1 1 1272 . 7 1 1 A 116 116 GLN HA H 116 4.898 5.149 -0.251 1 1 1279 . 7 1 1 A 116 116 GLN CA C 116 53.467 54.229 -0.762 1 1 1280 . 7 1 1 A 116 116 GLN CB C 116 32.730 32.033 0.697 1 1 1282 . 7 1 1 A 116 116 GLN N N 116 119.994 119.539 0.455 1 1 1284 . 7 1 1 A 117 117 GLU H H 117 8.849 8.666 0.183 1 1 1285 . 7 1 1 A 117 117 GLU HA H 117 3.707 4.054 -0.347 1 1 1290 . 7 1 1 A 117 117 GLU C C 117 177.303 176.883 0.420 1 1 1291 . 7 1 1 A 117 117 GLU CA C 117 57.233 56.133 1.100 1 1 1292 . 7 1 1 A 117 117 GLU CB C 117 29.634 29.455 0.179 1 1 1294 . 7 1 1 A 117 117 GLU N N 117 121.487 123.539 -2.052 1 1 1295 . 7 1 1 A 118 118 VAL H H 118 8.983 8.846 0.137 1 1 1296 . 7 1 1 A 118 118 VAL HA H 118 4.360 4.009 0.351 1 1 1304 . 7 1 1 A 118 118 VAL C C 118 174.171 175.071 -0.900 1 1 1305 . 7 1 1 A 118 118 VAL CA C 118 61.772 63.850 -2.078 1 1 1306 . 7 1 1 A 118 118 VAL CB C 118 34.095 32.825 1.270 1 1 1309 . 7 1 1 A 118 118 VAL N N 118 122.933 128.048 -5.115 1 1 1310 . 7 1 1 A 119 119 ALA H H 119 7.023 6.999 0.024 1 1 1311 . 7 1 1 A 119 119 ALA HA H 119 4.378 4.343 0.035 1 1 1315 . 7 1 1 A 119 119 ALA C C 119 175.493 175.347 0.146 1 1 1316 . 7 1 1 A 119 119 ALA CA C 119 51.956 51.260 0.696 1 1 1317 . 7 1 1 A 119 119 ALA CB C 119 23.957 21.215 2.742 1 1 1318 . 7 1 1 A 119 119 ALA N N 119 117.379 121.530 -4.151 1 1 1319 . 7 1 1 A 120 120 SER H H 120 6.999 8.712 -1.713 1 1 1320 . 7 1 1 A 120 120 SER HA H 120 5.208 5.901 -0.693 1 1 1323 . 7 1 1 A 120 120 SER C C 120 173.082 173.703 -0.621 1 1 1324 . 7 1 1 A 120 120 SER CA C 120 56.754 56.655 0.099 1 1 1325 . 7 1 1 A 120 120 SER CB C 120 64.605 65.432 -0.827 1 1 1326 . 7 1 1 A 120 120 SER N N 120 113.743 116.951 -3.208 1 1 1327 . 7 1 1 A 121 121 PHE H H 121 8.244 9.156 -0.912 1 1 1328 . 7 1 1 A 121 121 PHE HA H 121 5.177 4.998 0.179 1 1 1333 . 7 1 1 A 121 121 PHE C C 121 173.569 172.459 1.110 1 1 1334 . 7 1 1 A 121 121 PHE CA C 121 55.555 55.551 0.004 1 1 1335 . 7 1 1 A 121 121 PHE CB C 121 40.959 41.023 -0.064 1 1 1338 . 7 1 1 A 121 121 PHE N N 121 120.358 118.738 1.620 1 1 1339 . 7 1 1 A 122 122 ILE H H 122 8.907 8.484 0.423 1 1 1340 . 7 1 1 A 122 122 ILE HA H 122 4.682 4.302 0.380 1 1 1348 . 7 1 1 A 122 122 ILE C C 122 176.925 175.337 1.588 1 1 1349 . 7 1 1 A 122 122 ILE CA C 122 60.740 61.534 -0.794 1 1 1350 . 7 1 1 A 122 122 ILE CB C 122 39.497 37.730 1.767 1 1 1353 . 7 1 1 A 122 122 ILE N N 122 121.282 120.843 0.439 1 1 1354 . 7 1 1 A 123 123 THR H H 123 9.022 9.161 -0.139 1 1 1355 . 7 1 1 A 123 123 THR HA H 123 5.039 4.750 0.289 1 1 1360 . 7 1 1 A 123 123 THR C C 123 173.531 173.638 -0.107 1 1 1361 . 7 1 1 A 123 123 THR CA C 123 62.266 62.048 0.218 1 1 1362 . 7 1 1 A 123 123 THR CB C 123 70.677 68.764 1.913 1 1 1364 . 7 1 1 A 123 123 THR N N 123 128.965 123.683 5.282 1 1 1365 . 7 1 1 A 124 124 THR H H 124 8.961 9.276 -0.315 1 1 1366 . 7 1 1 A 124 124 THR HA H 124 5.001 4.939 0.062 1 1 1371 . 7 1 1 A 124 124 THR C C 124 173.468 172.851 0.617 1 1 1372 . 7 1 1 A 124 124 THR CA C 124 62.109 61.899 0.210 1 1 1373 . 7 1 1 A 124 124 THR CB C 124 70.450 69.577 0.873 1 1 1375 . 7 1 1 A 124 124 THR N N 124 122.176 123.727 -1.551 1 1 1376 . 7 1 1 A 125 125 ARG H H 125 9.386 9.391 -0.005 1 1 1377 . 7 1 1 A 125 125 ARG HA H 125 5.764 5.428 0.336 1 1 1384 . 7 1 1 A 125 125 ARG C C 125 175.713 175.021 0.692 1 1 1385 . 7 1 1 A 125 125 ARG CA C 125 53.991 54.252 -0.261 1 1 1386 . 7 1 1 A 125 125 ARG CB C 125 33.557 33.411 0.146 1 1 1389 . 7 1 1 A 125 125 ARG N N 125 130.004 128.757 1.247 1 1 1390 . 7 1 1 A 126 126 SER H H 126 9.172 9.522 -0.350 1 1 1391 . 7 1 1 A 126 126 SER HA H 126 5.390 5.110 0.280 1 1 1394 . 7 1 1 A 126 126 SER C C 126 172.359 173.652 -1.293 1 1 1395 . 7 1 1 A 126 126 SER CA C 126 56.934 57.578 -0.644 1 1 1396 . 7 1 1 A 126 126 SER CB C 126 65.827 65.728 0.099 1 1 1397 . 7 1 1 A 126 126 SER N N 126 119.906 122.766 -2.860 1 1 1398 . 7 1 1 A 127 127 SER H H 127 8.591 9.208 -0.617 1 1 1399 . 7 1 1 A 127 127 SER HA H 127 5.739 5.414 0.325 1 1 1401 . 7 1 1 A 127 127 SER C C 127 173.283 173.180 0.103 1 1 1402 . 7 1 1 A 127 127 SER CA C 127 57.354 57.678 -0.324 1 1 1403 . 7 1 1 A 127 127 SER CB C 127 65.412 64.488 0.924 1 1 1404 . 7 1 1 A 127 127 SER N N 127 117.914 121.814 -3.900 1 1 1405 . 7 1 1 A 128 128 TRP H H 128 9.866 9.850 0.016 1 1 1406 . 7 1 1 A 128 128 TRP HA H 128 5.560 5.613 -0.053 1 1 1415 . 7 1 1 A 128 128 TRP C C 128 175.828 174.934 0.894 1 1 1416 . 7 1 1 A 128 128 TRP CA C 128 55.852 55.679 0.173 1 1 1417 . 7 1 1 A 128 128 TRP CB C 128 32.524 33.480 -0.956 1 1 1423 . 7 1 1 A 128 128 TRP N N 128 127.978 125.984 1.994 1 1 1425 . 7 1 1 A 129 129 LYS H H 129 9.424 9.409 0.015 1 1 1426 . 7 1 1 A 129 129 LYS HA H 129 5.388 5.520 -0.132 1 1 1433 . 7 1 1 A 129 129 LYS C C 129 175.254 174.484 0.770 1 1 1434 . 7 1 1 A 129 129 LYS CA C 129 54.410 54.600 -0.190 1 1 1435 . 7 1 1 A 129 129 LYS CB C 129 35.734 36.255 -0.521 1 1 1439 . 7 1 1 A 129 129 LYS N N 129 121.784 119.087 2.697 1 1 1440 . 7 1 1 A 130 130 LEU H H 130 8.933 9.463 -0.530 1 1 1441 . 7 1 1 A 130 130 LEU HA H 130 4.859 5.024 -0.165 1 1 1447 . 7 1 1 A 130 130 LEU C C 130 173.893 174.396 -0.503 1 1 1448 . 7 1 1 A 130 130 LEU CA C 130 53.848 54.109 -0.261 1 1 1449 . 7 1 1 A 130 130 LEU CB C 130 46.125 45.874 0.251 1 1 1451 . 7 1 1 A 130 130 LEU N N 130 124.543 123.654 0.889 1 1 1452 . 7 1 1 A 131 131 ALA H H 131 8.816 8.901 -0.085 1 1 1453 . 7 1 1 A 131 131 ALA HA H 131 4.776 4.963 -0.187 1 1 1457 . 7 1 1 A 131 131 ALA C C 131 176.662 177.009 -0.347 1 1 1458 . 7 1 1 A 131 131 ALA CA C 131 51.407 50.771 0.636 1 1 1459 . 7 1 1 A 131 131 ALA CB C 131 19.354 20.100 -0.746 1 1 1460 . 7 1 1 A 131 131 ALA N N 131 131.102 129.797 1.305 1 1 1461 . 7 1 1 A 132 132 LEU H H 132 8.487 8.847 -0.360 1 1 1462 . 7 1 1 A 132 132 LEU HA H 132 4.470 4.827 -0.357 1 1 1470 . 7 1 1 A 132 132 LEU C C 132 176.873 176.503 0.370 1 1 1471 . 7 1 1 A 132 132 LEU CA C 132 54.590 54.079 0.511 1 1 1472 . 7 1 1 A 132 132 LEU CB C 132 42.974 43.121 -0.147 1 1 1475 . 7 1 1 A 132 132 LEU N N 132 123.724 124.277 -0.553 1 1 1476 . 7 1 1 A 133 133 SER H H 133 8.448 8.739 -0.291 1 1 1477 . 7 1 1 A 133 133 SER HA H 133 4.560 5.200 -0.640 1 1 1479 . 7 1 1 A 133 133 SER C C 133 176.043 173.084 2.959 1 1 1480 . 7 1 1 A 133 133 SER CA C 133 58.460 57.519 0.941 1 1 1481 . 7 1 1 A 133 133 SER CB C 133 63.985 65.715 -1.730 1 1 1482 . 7 1 1 A 133 133 SER N N 133 115.880 118.161 -2.281 1 1 1483 . 7 1 1 A 134 134 GLY H H 134 8.232 7.839 0.393 1 1 1484 . 7 1 1 A 134 134 GLY HA2 H 134 4.147 4.088 0.059 1 1 1485 . 7 1 1 A 134 134 GLY HA3 H 134 4.045 4.114 -0.069 1 1 1486 . 7 1 1 A 134 134 GLY C C 134 174.013 173.344 0.669 1 1 1487 . 7 1 1 A 134 134 GLY CA C 134 45.337 44.931 0.406 1 1 1488 . 7 1 1 A 134 134 GLY N N 134 109.970 113.055 -3.085 1 1 1489 . 7 1 1 A 135 135 ALA H H 135 8.424 9.144 -0.720 1 1 1490 . 7 1 1 A 135 135 ALA HA H 135 4.436 4.019 0.417 1 1 1494 . 7 1 1 A 135 135 ALA C C 135 177.537 176.818 0.719 1 1 1495 . 7 1 1 A 135 135 ALA CA C 135 52.721 53.390 -0.669 1 1 1496 . 7 1 1 A 135 135 ALA CB C 135 19.265 17.830 1.435 1 1 1497 . 7 1 1 A 135 135 ALA N N 135 124.118 122.734 1.384 1 1 1498 . 7 1 1 A 136 136 HIS H H 136 8.466 8.262 0.204 1 1 1499 . 7 1 1 A 136 136 HIS HA H 136 4.379 4.210 0.169 1 1 1500 . 7 1 1 A 136 136 HIS C C 136 176.259 174.546 1.713 1 1 1501 . 7 1 1 A 136 136 HIS CA C 136 56.082 56.667 -0.585 1 1 1502 . 7 1 1 A 136 136 HIS CB C 136 29.619 27.792 1.827 1 1 1503 . 7 1 1 A 136 136 HIS N N 136 119.493 106.754 12.739 1 1 1504 . 7 1 1 A 137 137 GLY H H 137 8.431 8.065 0.366 1 1 1505 . 7 1 1 A 137 137 GLY HA2 H 137 4.151 4.039 0.112 1 1 1506 . 7 1 1 A 137 137 GLY HA3 H 137 3.893 4.041 -0.148 1 1 1507 . 7 1 1 A 137 137 GLY C C 137 174.039 171.600 2.439 1 1 1508 . 7 1 1 A 137 137 GLY CA C 137 45.372 44.764 0.608 1 1 1509 . 7 1 1 A 137 137 GLY N N 137 110.442 109.028 1.414 1 1 1510 . 7 1 1 A 138 138 GLN H H 138 8.416 8.391 0.025 1 1 1511 . 7 1 1 A 138 138 GLN HA H 138 4.455 4.919 -0.464 1 1 1515 . 7 1 1 A 138 138 GLN C C 138 175.889 175.078 0.811 1 1 1516 . 7 1 1 A 138 138 GLN CA C 138 55.866 54.614 1.252 1 1 1517 . 7 1 1 A 138 138 GLN CB C 138 29.639 30.887 -1.248 1 1 1518 . 7 1 1 A 138 138 GLN N N 138 119.401 120.300 -0.899 1 1 1519 . 7 1 1 A 139 139 GLU H H 139 8.446 8.556 -0.110 1 1 1520 . 7 1 1 A 139 139 GLU HA H 139 4.658 4.711 -0.053 1 1 1524 . 7 1 1 A 139 139 GLU CA C 139 54.589 54.174 0.415 1 1 1525 . 7 1 1 A 139 139 GLU CB C 139 29.733 28.889 0.844 1 1 1527 . 7 1 1 A 139 139 GLU N N 139 123.136 125.965 -2.829 1 1 1528 . 7 1 1 A 140 140 PRO HA H 140 4.537 4.554 -0.017 1 1 1533 . 7 1 1 A 140 140 PRO C C 140 176.119 175.606 0.513 1 1 1534 . 7 1 1 A 140 140 PRO CA C 140 63.220 62.644 0.576 1 1 1535 . 7 1 1 A 140 140 PRO CB C 140 31.936 32.258 -0.322 1 1 1538 . 7 1 1 A 141 141 GLN H H 141 8.506 8.528 -0.022 1 1 1539 . 7 1 1 A 141 141 GLN HA H 141 4.650 4.860 -0.210 1 1 1546 . 7 1 1 A 141 141 GLN C C 141 175.811 175.195 0.616 1 1 1547 . 7 1 1 A 141 141 GLN CA C 141 55.912 54.559 1.353 1 1 1548 . 7 1 1 A 141 141 GLN CB C 141 30.241 31.140 -0.899 1 1 1550 . 7 1 1 A 141 141 GLN N N 141 120.422 120.767 -0.345 1 1 1551 . 7 1 1 A 142 142 LEU H H 142 8.842 9.130 -0.288 1 1 1552 . 7 1 1 A 142 142 LEU HA H 142 5.277 5.266 0.011 1 1 1562 . 7 1 1 A 142 142 LEU C C 142 176.839 175.434 1.405 1 1 1563 . 7 1 1 A 142 142 LEU CA C 142 53.927 52.935 0.992 1 1 1564 . 7 1 1 A 142 142 LEU CB C 142 44.527 44.973 -0.446 1 1 1568 . 7 1 1 A 142 142 LEU N N 142 123.692 122.814 0.878 1 1 1569 . 7 1 1 A 143 143 THR H H 143 9.025 8.952 0.073 1 1 1570 . 7 1 1 A 143 143 THR HA H 143 5.262 5.181 0.081 1 1 1575 . 7 1 1 A 143 143 THR C C 143 173.753 173.716 0.037 1 1 1576 . 7 1 1 A 143 143 THR CA C 143 61.795 61.858 -0.063 1 1 1577 . 7 1 1 A 143 143 THR CB C 143 70.660 70.670 -0.010 1 1 1579 . 7 1 1 A 143 143 THR N N 143 117.222 115.281 1.941 1 1 1580 . 7 1 1 A 144 144 ILE H H 144 9.353 10.382 -1.029 1 1 1581 . 7 1 1 A 144 144 ILE HA H 144 5.399 5.211 0.188 1 1 1591 . 7 1 1 A 144 144 ILE C C 144 173.931 173.821 0.110 1 1 1592 . 7 1 1 A 144 144 ILE CA C 144 60.774 60.633 0.141 1 1 1593 . 7 1 1 A 144 144 ILE CB C 144 41.111 40.379 0.732 1 1 1597 . 7 1 1 A 144 144 ILE N N 144 126.383 127.098 -0.715 1 1 1598 . 7 1 1 A 145 145 ASP H H 145 9.214 9.535 -0.321 1 1 1599 . 7 1 1 A 145 145 ASP HA H 145 5.978 5.376 0.602 1 1 1601 . 7 1 1 A 145 145 ASP C C 145 175.441 174.893 0.548 1 1 1602 . 7 1 1 A 145 145 ASP CA C 145 53.035 52.997 0.038 1 1 1603 . 7 1 1 A 145 145 ASP CB C 145 44.153 42.921 1.232 1 1 1604 . 7 1 1 A 145 145 ASP N N 145 127.981 128.759 -0.778 1 1 1605 . 7 1 1 A 146 146 LEU H H 146 9.387 9.978 -0.591 1 1 1606 . 7 1 1 A 146 146 LEU HA H 146 4.918 5.357 -0.439 1 1 1616 . 7 1 1 A 146 146 LEU C C 146 175.003 174.759 0.244 1 1 1617 . 7 1 1 A 146 146 LEU CA C 146 53.940 53.544 0.396 1 1 1618 . 7 1 1 A 146 146 LEU CB C 146 43.902 43.764 0.138 1 1 1622 . 7 1 1 A 146 146 LEU N N 146 123.532 127.701 -4.169 1 1 1623 . 7 1 1 A 147 147 ASP H H 147 8.676 8.641 0.035 1 1 1624 . 7 1 1 A 147 147 ASP HA H 147 5.205 5.389 -0.184 1 1 1627 . 7 1 1 A 147 147 ASP C C 147 174.956 174.402 0.554 1 1 1628 . 7 1 1 A 147 147 ASP CA C 147 53.441 52.530 0.911 1 1 1629 . 7 1 1 A 147 147 ASP CB C 147 43.370 44.665 -1.295 1 1 1630 . 7 1 1 A 147 147 ASP N N 147 125.499 126.353 -0.854 1 1 1631 . 7 1 1 A 148 148 SER H H 148 8.732 9.350 -0.618 1 1 1632 . 7 1 1 A 148 148 SER HA H 148 5.365 5.133 0.232 1 1 1634 . 7 1 1 A 148 148 SER C C 148 173.217 173.303 -0.086 1 1 1635 . 7 1 1 A 148 148 SER CA C 148 56.334 56.267 0.067 1 1 1636 . 7 1 1 A 148 148 SER CB C 148 65.812 65.752 0.060 1 1 1637 . 7 1 1 A 148 148 SER N N 148 118.623 119.121 -0.498 1 1 1638 . 7 1 1 A 149 149 ALA H H 149 8.937 8.613 0.324 1 1 1639 . 7 1 1 A 149 149 ALA HA H 149 5.681 5.160 0.521 1 1 1643 . 7 1 1 A 149 149 ALA C C 149 178.894 177.963 0.931 1 1 1644 . 7 1 1 A 149 149 ALA CA C 149 49.996 49.921 0.075 1 1 1645 . 7 1 1 A 149 149 ALA CB C 149 23.231 22.324 0.907 1 1 1646 . 7 1 1 A 149 149 ALA N N 149 123.952 124.399 -0.447 1 1 1647 . 7 1 1 A 150 150 ASP H H 150 9.010 8.742 0.268 1 1 1648 . 7 1 1 A 150 150 ASP HA H 150 4.336 4.347 -0.011 1 1 1651 . 7 1 1 A 150 150 ASP C C 150 176.697 176.754 -0.057 1 1 1652 . 7 1 1 A 150 150 ASP CA C 150 56.543 57.068 -0.525 1 1 1653 . 7 1 1 A 150 150 ASP CB C 150 39.850 40.154 -0.304 1 1 1654 . 7 1 1 A 150 150 ASP N N 150 122.687 121.953 0.734 1 1 1655 . 7 1 1 A 151 151 PHE H H 151 7.295 7.748 -0.453 1 1 1656 . 7 1 1 A 151 151 PHE HA H 151 5.020 4.756 0.264 1 1 1661 . 7 1 1 A 151 151 PHE C C 151 174.756 175.590 -0.834 1 1 1662 . 7 1 1 A 151 151 PHE CA C 151 56.594 56.539 0.055 1 1 1663 . 7 1 1 A 151 151 PHE CB C 151 37.765 37.067 0.698 1 1 1666 . 7 1 1 A 151 151 PHE N N 151 113.928 116.098 -2.170 1 1 1667 . 7 1 1 A 152 152 GLY H H 152 7.786 8.378 -0.592 1 1 1668 . 7 1 1 A 152 152 GLY HA2 H 152 4.459 3.983 0.476 1 1 1669 . 7 1 1 A 152 152 GLY HA3 H 152 3.728 3.993 -0.265 1 1 1670 . 7 1 1 A 152 152 GLY C C 152 172.709 173.549 -0.840 1 1 1671 . 7 1 1 A 152 152 GLY CA C 152 46.106 47.304 -1.198 1 1 1672 . 7 1 1 A 152 152 GLY N N 152 110.312 108.156 2.156 1 1 1673 . 7 1 1 A 153 153 TYR H H 153 6.650 7.238 -0.588 1 1 1674 . 7 1 1 A 153 153 TYR HA H 153 4.508 4.982 -0.474 1 1 1679 . 7 1 1 A 153 153 TYR C C 153 173.092 172.969 0.123 1 1 1680 . 7 1 1 A 153 153 TYR CA C 153 57.464 57.562 -0.098 1 1 1681 . 7 1 1 A 153 153 TYR CB C 153 41.962 42.166 -0.204 1 1 1684 . 7 1 1 A 153 153 TYR N N 153 121.977 119.528 2.449 1 1 1685 . 7 1 1 A 154 154 ALA H H 154 7.847 8.514 -0.667 1 1 1686 . 7 1 1 A 154 154 ALA HA H 154 5.144 4.870 0.274 1 1 1690 . 7 1 1 A 154 154 ALA C C 154 174.468 174.659 -0.191 1 1 1691 . 7 1 1 A 154 154 ALA CA C 154 51.776 50.965 0.811 1 1 1692 . 7 1 1 A 154 154 ALA CB C 154 21.747 22.364 -0.617 1 1 1693 . 7 1 1 A 154 154 ALA N N 154 130.258 129.790 0.468 1 1 1694 . 7 1 1 A 155 155 VAL H H 155 8.733 9.076 -0.343 1 1 1695 . 7 1 1 A 155 155 VAL HA H 155 4.150 4.785 -0.635 1 1 1700 . 7 1 1 A 155 155 VAL C C 155 172.632 173.352 -0.720 1 1 1701 . 7 1 1 A 155 155 VAL CA C 155 61.451 59.163 2.288 1 1 1702 . 7 1 1 A 155 155 VAL CB C 155 35.883 35.840 0.043 1 1 1704 . 7 1 1 A 155 155 VAL N N 155 119.622 121.692 -2.070 1 1 1705 . 7 1 1 A 156 156 GLY H H 156 8.146 8.322 -0.176 1 1 1706 . 7 1 1 A 156 156 GLY HA2 H 156 5.125 2.466 2.659 1 1 1707 . 7 1 1 A 156 156 GLY HA3 H 156 2.061 3.942 -1.881 1 1 1708 . 7 1 1 A 156 156 GLY C C 156 171.746 171.666 0.080 1 1 1709 . 7 1 1 A 156 156 GLY CA C 156 43.319 43.704 -0.385 1 1 1710 . 7 1 1 A 156 156 GLY N N 156 113.332 113.026 0.306 1 1 1711 . 7 1 1 A 157 157 GLU H H 157 8.967 9.128 -0.161 1 1 1712 . 7 1 1 A 157 157 GLU HA H 157 5.217 5.077 0.140 1 1 1716 . 7 1 1 A 157 157 GLU C C 157 174.476 174.950 -0.474 1 1 1717 . 7 1 1 A 157 157 GLU CA C 157 55.390 55.057 0.333 1 1 1718 . 7 1 1 A 157 157 GLU CB C 157 34.010 32.652 1.358 1 1 1720 . 7 1 1 A 157 157 GLU N N 157 120.823 122.870 -2.047 1 1 1721 . 7 1 1 A 158 158 VAL H H 158 9.076 9.579 -0.503 1 1 1722 . 7 1 1 A 158 158 VAL HA H 158 5.206 4.841 0.365 1 1 1727 . 7 1 1 A 158 158 VAL C C 158 173.900 174.386 -0.486 1 1 1728 . 7 1 1 A 158 158 VAL CA C 158 60.813 61.841 -1.028 1 1 1729 . 7 1 1 A 158 158 VAL CB C 158 33.385 33.151 0.234 1 1 1731 . 7 1 1 A 158 158 VAL N N 158 124.349 126.964 -2.615 1 1 1732 . 7 1 1 A 159 159 GLU H H 159 9.239 9.693 -0.454 1 1 1733 . 7 1 1 A 159 159 GLU HA H 159 5.647 5.254 0.393 1 1 1738 . 7 1 1 A 159 159 GLU C C 159 174.469 175.039 -0.570 1 1 1739 . 7 1 1 A 159 159 GLU CA C 159 54.473 54.682 -0.209 1 1 1740 . 7 1 1 A 159 159 GLU CB C 159 33.852 32.740 1.112 1 1 1742 . 7 1 1 A 159 159 GLU N N 159 125.772 129.186 -3.414 1 1 1743 . 7 1 1 A 160 160 ALA H H 160 9.250 9.156 0.094 1 1 1744 . 7 1 1 A 160 160 ALA HA H 160 4.966 5.428 -0.462 1 1 1748 . 7 1 1 A 160 160 ALA C C 160 175.114 175.628 -0.514 1 1 1749 . 7 1 1 A 160 160 ALA CA C 160 50.644 50.148 0.496 1 1 1750 . 7 1 1 A 160 160 ALA CB C 160 23.263 22.750 0.513 1 1 1751 . 7 1 1 A 160 160 ALA N N 160 125.092 129.651 -4.559 1 1 1752 . 7 1 1 A 161 161 MET H H 161 8.559 8.862 -0.303 1 1 1753 . 7 1 1 A 161 161 MET HA H 161 5.468 6.006 -0.538 1 1 1761 . 7 1 1 A 161 161 MET C C 161 176.265 174.950 1.315 1 1 1762 . 7 1 1 A 161 161 MET CA C 161 53.818 54.139 -0.321 1 1 1763 . 7 1 1 A 161 161 MET CB C 161 34.380 35.129 -0.749 1 1 1766 . 7 1 1 A 161 161 MET N N 161 118.699 119.539 -0.840 1 1 1767 . 7 1 1 A 162 162 VAL H H 162 9.046 9.037 0.009 1 1 1768 . 7 1 1 A 162 162 VAL HA H 162 4.841 4.844 -0.003 1 1 1776 . 7 1 1 A 162 162 VAL C C 162 174.794 175.984 -1.190 1 1 1777 . 7 1 1 A 162 162 VAL CA C 162 59.107 59.990 -0.883 1 1 1778 . 7 1 1 A 162 162 VAL CB C 162 34.018 34.515 -0.497 1 1 1781 . 7 1 1 A 162 162 VAL N N 162 116.435 118.582 -2.147 1 1 1782 . 7 1 1 A 163 163 HIS H H 163 8.793 8.682 0.111 1 1 1783 . 7 1 1 A 163 163 HIS HA H 163 4.717 4.943 -0.226 1 1 1787 . 7 1 1 A 163 163 HIS C C 163 175.460 174.455 1.005 1 1 1788 . 7 1 1 A 163 163 HIS CA C 163 58.488 57.653 0.835 1 1 1789 . 7 1 1 A 163 163 HIS CB C 163 31.185 30.762 0.423 1 1 1791 . 7 1 1 A 163 163 HIS N N 163 117.838 121.724 -3.886 1 1 1792 . 7 1 1 A 164 164 GLU H H 164 8.013 7.655 0.358 1 1 1793 . 7 1 1 A 164 164 GLU HA H 164 4.814 4.732 0.082 1 1 1797 . 7 1 1 A 164 164 GLU C C 164 176.910 176.455 0.455 1 1 1798 . 7 1 1 A 164 164 GLU CA C 164 54.355 54.886 -0.531 1 1 1799 . 7 1 1 A 164 164 GLU CB C 164 32.886 31.994 0.892 1 1 1801 . 7 1 1 A 164 164 GLU N N 164 115.943 114.880 1.063 1 1 1802 . 7 1 1 A 165 165 LYS H H 165 9.088 9.019 0.069 1 1 1803 . 7 1 1 A 165 165 LYS HA H 165 3.942 3.941 0.001 1 1 1809 . 7 1 1 A 165 165 LYS C C 165 179.657 177.889 1.768 1 1 1810 . 7 1 1 A 165 165 LYS CA C 165 59.888 58.489 1.399 1 1 1811 . 7 1 1 A 165 165 LYS CB C 165 32.024 32.325 -0.301 1 1 1814 . 7 1 1 A 165 165 LYS N N 165 124.120 123.529 0.591 1 1 1815 . 7 1 1 A 166 166 ALA H H 166 8.851 8.112 0.739 1 1 1816 . 7 1 1 A 166 166 ALA HA H 166 4.251 4.062 0.189 1 1 1820 . 7 1 1 A 166 166 ALA C C 166 178.920 178.680 0.240 1 1 1821 . 7 1 1 A 166 166 ALA CA C 166 54.318 54.482 -0.164 1 1 1822 . 7 1 1 A 166 166 ALA CB C 166 18.810 18.157 0.653 1 1 1823 . 7 1 1 A 166 166 ALA N N 166 120.424 122.196 -1.772 1 1 1824 . 7 1 1 A 167 167 GLU H H 167 7.871 7.630 0.241 1 1 1825 . 7 1 1 A 167 167 GLU HA H 167 4.404 4.334 0.070 1 1 1829 . 7 1 1 A 167 167 GLU C C 167 177.368 178.420 -1.052 1 1 1830 . 7 1 1 A 167 167 GLU CA C 167 56.701 57.305 -0.604 1 1 1831 . 7 1 1 A 167 167 GLU CB C 167 31.208 30.130 1.078 1 1 1833 . 7 1 1 A 167 167 GLU N N 167 114.926 116.915 -1.989 1 1 1834 . 7 1 1 A 168 168 VAL H H 168 7.812 7.544 0.268 1 1 1835 . 7 1 1 A 168 168 VAL HA H 168 3.712 3.652 0.060 1 1 1843 . 7 1 1 A 168 168 VAL CA C 168 68.705 67.907 0.798 1 1 1844 . 7 1 1 A 168 168 VAL CB C 168 29.597 29.741 -0.144 1 1 1847 . 7 1 1 A 168 168 VAL N N 168 120.188 122.673 -2.485 1 1 1848 . 7 1 1 A 169 169 PRO HA H 169 4.252 4.230 0.022 1 1 1851 . 7 1 1 A 169 169 PRO C C 169 179.563 178.609 0.954 1 1 1852 . 7 1 1 A 169 169 PRO CA C 169 67.077 66.836 0.241 1 1 1853 . 7 1 1 A 170 170 ALA H H 170 8.149 8.178 -0.029 1 1 1854 . 7 1 1 A 170 170 ALA HA H 170 4.265 4.067 0.198 1 1 1858 . 7 1 1 A 170 170 ALA C C 170 180.637 179.815 0.822 1 1 1859 . 7 1 1 A 170 170 ALA CA C 170 54.823 55.280 -0.457 1 1 1860 . 7 1 1 A 170 170 ALA CB C 170 18.518 18.223 0.295 1 1 1861 . 7 1 1 A 170 170 ALA N N 170 119.210 119.311 -0.101 1 1 1862 . 7 1 1 A 171 171 ALA H H 171 7.767 8.473 -0.706 1 1 1863 . 7 1 1 A 171 171 ALA HA H 171 4.106 4.148 -0.042 1 1 1867 . 7 1 1 A 171 171 ALA C C 171 179.371 180.018 -0.647 1 1 1868 . 7 1 1 A 171 171 ALA CA C 171 55.130 54.953 0.177 1 1 1869 . 7 1 1 A 171 171 ALA CB C 171 18.291 18.038 0.253 1 1 1870 . 7 1 1 A 171 171 ALA N N 171 122.126 120.651 1.475 1 1 1871 . 7 1 1 A 172 172 LEU H H 172 8.950 8.218 0.732 1 1 1872 . 7 1 1 A 172 172 LEU HA H 172 3.987 4.085 -0.098 1 1 1878 . 7 1 1 A 172 172 LEU C C 172 178.355 178.689 -0.334 1 1 1879 . 7 1 1 A 172 172 LEU CA C 172 57.803 57.816 -0.013 1 1 1880 . 7 1 1 A 172 172 LEU CB C 172 41.667 41.646 0.021 1 1 1882 . 7 1 1 A 172 172 LEU N N 172 118.682 120.438 -1.756 1 1 1883 . 7 1 1 A 173 173 GLU H H 173 7.886 7.941 -0.055 1 1 1884 . 7 1 1 A 173 173 GLU HA H 173 4.132 3.949 0.183 1 1 1887 . 7 1 1 A 173 173 GLU C C 173 179.556 179.492 0.064 1 1 1888 . 7 1 1 A 173 173 GLU CA C 173 59.800 59.585 0.215 1 1 1889 . 7 1 1 A 173 173 GLU CB C 173 29.580 29.302 0.278 1 1 1891 . 7 1 1 A 173 173 GLU N N 173 117.561 118.985 -1.424 1 1 1892 . 7 1 1 A 174 174 LYS H H 174 7.532 7.520 0.012 1 1 1893 . 7 1 1 A 174 174 LYS HA H 174 4.131 4.036 0.095 1 1 1901 . 7 1 1 A 174 174 LYS CA C 174 58.999 59.443 -0.444 1 1 1902 . 7 1 1 A 174 174 LYS CB C 174 32.041 32.417 -0.376 1 1 1906 . 7 1 1 A 174 174 LYS N N 174 119.085 119.407 -0.322 1 1 1907 . 7 1 1 A 175 175 ILE H H 175 8.479 8.139 0.340 1 1 1908 . 7 1 1 A 175 175 ILE HA H 175 3.583 3.592 -0.009 1 1 1918 . 7 1 1 A 175 175 ILE C C 175 179.258 178.672 0.586 1 1 1919 . 7 1 1 A 175 175 ILE CA C 175 65.769 65.736 0.033 1 1 1920 . 7 1 1 A 175 175 ILE CB C 175 37.876 37.944 -0.068 1 1 1923 . 7 1 1 A 175 175 ILE N N 175 118.828 120.109 -1.281 1 1 1924 . 7 1 1 A 176 176 ILE H H 176 8.928 8.213 0.715 1 1 1925 . 7 1 1 A 176 176 ILE HA H 176 3.600 3.676 -0.076 1 1 1935 . 7 1 1 A 176 176 ILE C C 176 178.827 178.133 0.694 1 1 1936 . 7 1 1 A 176 176 ILE CA C 176 65.640 64.589 1.051 1 1 1937 . 7 1 1 A 176 176 ILE CB C 176 37.451 37.247 0.204 1 1 1941 . 7 1 1 A 176 176 ILE N N 176 124.527 120.074 4.453 1 1 1942 . 7 1 1 A 177 177 THR H H 177 8.175 8.101 0.074 1 1 1943 . 7 1 1 A 177 177 THR HA H 177 3.885 3.895 -0.010 1 1 1948 . 7 1 1 A 177 177 THR C C 177 176.867 176.533 0.334 1 1 1949 . 7 1 1 A 177 177 THR CA C 177 67.199 66.547 0.652 1 1 1950 . 7 1 1 A 177 177 THR CB C 177 68.377 68.071 0.306 1 1 1952 . 7 1 1 A 177 177 THR N N 177 119.412 118.802 0.610 1 1 1953 . 7 1 1 A 178 178 VAL H H 178 8.352 8.393 -0.041 1 1 1954 . 7 1 1 A 178 178 VAL HA H 178 3.572 3.436 0.136 1 1 1962 . 7 1 1 A 178 178 VAL C C 178 177.664 177.860 -0.196 1 1 1963 . 7 1 1 A 178 178 VAL CA C 178 66.909 66.359 0.550 1 1 1964 . 7 1 1 A 178 178 VAL CB C 178 31.714 31.310 0.404 1 1 1967 . 7 1 1 A 178 178 VAL N N 178 121.168 122.084 -0.916 1 1 1968 . 7 1 1 A 179 179 SER H H 179 8.529 8.241 0.288 1 1 1969 . 7 1 1 A 179 179 SER HA H 179 3.099 3.510 -0.411 1 1 1972 . 7 1 1 A 179 179 SER C C 179 175.380 176.220 -0.840 1 1 1973 . 7 1 1 A 179 179 SER CA C 179 62.728 61.839 0.889 1 1 1974 . 7 1 1 A 179 179 SER CB C 179 62.802 62.521 0.281 1 1 1975 . 7 1 1 A 179 179 SER N N 179 115.226 115.742 -0.516 1 1 1976 . 7 1 1 A 180 180 SER H H 180 7.757 8.207 -0.450 1 1 1977 . 7 1 1 A 180 180 SER HA H 180 4.419 4.328 0.091 1 1 1980 . 7 1 1 A 180 180 SER C C 180 175.359 177.021 -1.662 1 1 1981 . 7 1 1 A 180 180 SER CA C 180 61.025 61.265 -0.240 1 1 1982 . 7 1 1 A 180 180 SER CB C 180 63.072 63.164 -0.092 1 1 1983 . 7 1 1 A 180 180 SER N N 180 114.718 115.976 -1.258 1 1 1984 . 7 1 1 A 181 181 MET H H 181 7.497 7.633 -0.136 1 1 1985 . 7 1 1 A 181 181 MET HA H 181 4.283 4.224 0.059 1 1 1993 . 7 1 1 A 181 181 MET C C 181 177.217 177.208 0.009 1 1 1994 . 7 1 1 A 181 181 MET CA C 181 57.539 57.859 -0.320 1 1 1995 . 7 1 1 A 181 181 MET CB C 181 33.493 32.612 0.881 1 1 1998 . 7 1 1 A 181 181 MET N N 181 119.274 120.534 -1.260 1 1 1999 . 7 1 1 A 182 182 LEU H H 182 7.163 7.540 -0.377 1 1 2000 . 7 1 1 A 182 182 LEU HA H 182 4.133 4.354 -0.221 1 1 2010 . 7 1 1 A 182 182 LEU C C 182 176.289 176.742 -0.453 1 1 2011 . 7 1 1 A 182 182 LEU CA C 182 54.750 54.929 -0.179 1 1 2012 . 7 1 1 A 182 182 LEU CB C 182 43.235 42.660 0.575 1 1 2016 . 7 1 1 A 182 182 LEU N N 182 115.869 117.541 -1.672 1 1 2017 . 7 1 1 A 183 183 GLY H H 183 7.492 7.402 0.090 1 1 2018 . 7 1 1 A 183 183 GLY HA2 H 183 4.086 4.157 -0.071 1 1 2019 . 7 1 1 A 183 183 GLY HA3 H 183 4.425 4.191 0.234 1 1 2020 . 7 1 1 A 183 183 GLY C C 183 171.830 171.836 -0.006 1 1 2021 . 7 1 1 A 183 183 GLY CA C 183 46.035 45.947 0.088 1 1 2022 . 7 1 1 A 183 183 GLY N N 183 107.761 105.715 2.046 1 1 2023 . 7 1 1 A 184 184 VAL H H 184 8.099 8.617 -0.518 1 1 2024 . 7 1 1 A 184 184 VAL HA H 184 4.772 5.008 -0.236 1 1 2032 . 7 1 1 A 184 184 VAL CA C 184 59.305 58.164 1.141 1 1 2033 . 7 1 1 A 184 184 VAL CB C 184 33.648 34.461 -0.813 1 1 2036 . 7 1 1 A 184 184 VAL N N 184 119.803 120.605 -0.802 1 1 2037 . 7 1 1 A 185 185 PRO HA H 185 4.442 4.851 -0.409 1 1 2042 . 7 1 1 A 185 185 PRO C C 185 175.871 176.233 -0.362 1 1 2043 . 7 1 1 A 185 185 PRO CA C 185 63.886 62.698 1.188 1 1 2044 . 7 1 1 A 185 185 PRO CB C 185 32.260 32.985 -0.725 1 1 2047 . 7 1 1 A 186 186 ALA H H 186 8.222 9.040 -0.818 1 1 2048 . 7 1 1 A 186 186 ALA HA H 186 4.569 4.955 -0.386 1 1 2052 . 7 1 1 A 186 186 ALA C C 186 177.481 175.875 1.606 1 1 2053 . 7 1 1 A 186 186 ALA CA C 186 51.823 50.610 1.213 1 1 2054 . 7 1 1 A 186 186 ALA CB C 186 20.233 21.656 -1.423 1 1 2055 . 7 1 1 A 186 186 ALA N N 186 125.663 121.380 4.283 1 1 2056 . 7 1 1 A 187 187 GLN H H 187 8.723 8.656 0.067 1 1 2057 . 7 1 1 A 187 187 GLN HA H 187 4.420 4.813 -0.393 1 1 2063 . 7 1 1 A 187 187 GLN C C 187 175.566 176.417 -0.851 1 1 2064 . 7 1 1 A 187 187 GLN CA C 187 56.051 54.374 1.677 1 1 2065 . 7 1 1 A 187 187 GLN CB C 187 29.812 30.413 -0.601 1 1 2067 . 7 1 1 A 187 187 GLN N N 187 120.742 115.783 4.959 1 1 2069 . 7 1 1 A 188 188 GLU H H 188 8.163 9.267 -1.104 1 1 2070 . 7 1 1 A 188 188 GLU HA H 188 4.405 4.014 0.391 1 1 2074 . 7 1 1 A 188 188 GLU C C 188 176.058 178.140 -2.082 1 1 2075 . 7 1 1 A 188 188 GLU CA C 188 56.158 59.227 -3.069 1 1 2076 . 7 1 1 A 188 188 GLU CB C 188 31.095 29.749 1.346 1 1 2078 . 7 1 1 A 188 188 GLU N N 188 119.177 119.076 0.101 1 1 2079 . 7 1 1 A 189 189 GLU H H 189 8.567 8.325 0.242 1 1 2080 . 7 1 1 A 189 189 GLU HA H 189 4.252 4.075 0.177 1 1 2084 . 7 1 1 A 189 189 GLU C C 189 175.703 176.296 -0.593 1 1 2085 . 7 1 1 A 189 189 GLU CA C 189 56.417 59.887 -3.470 1 1 2086 . 7 1 1 A 189 189 GLU CB C 189 29.968 29.376 0.592 1 1 2088 . 7 1 1 A 189 189 GLU N N 189 120.920 119.516 1.404 1 1 2089 . 7 1 1 A 190 190 ALA H H 190 8.271 7.873 0.398 1 1 2090 . 7 1 1 A 190 190 ALA HA H 190 4.626 4.028 0.598 1 1 2094 . 7 1 1 A 190 190 ALA CA C 190 50.465 52.889 -2.424 1 1 2095 . 7 1 1 A 190 190 ALA CB C 190 18.451 17.506 0.945 1 1 2096 . 7 1 1 A 190 190 ALA N N 190 128.323 121.403 6.920 1 1 2097 . 7 1 1 A 191 191 PRO HA H 191 4.493 4.405 0.088 1 1 2103 . 7 1 1 A 191 191 PRO C C 191 175.899 176.834 -0.935 1 1 2104 . 7 1 1 A 191 191 PRO CA C 191 62.044 62.674 -0.630 1 1 2105 . 7 1 1 A 191 191 PRO CB C 191 32.184 32.020 0.164 1 1 2108 . 7 1 1 A 192 192 ALA H H 192 8.610 8.284 0.326 1 1 2109 . 7 1 1 A 192 192 ALA HA H 192 4.280 4.372 -0.092 1 1 2113 . 7 1 1 A 192 192 ALA C C 192 178.282 177.821 0.461 1 1 2114 . 7 1 1 A 192 192 ALA CA C 192 51.698 52.356 -0.658 1 1 2115 . 7 1 1 A 192 192 ALA CB C 192 19.220 19.119 0.101 1 1 2116 . 7 1 1 A 192 192 ALA N N 192 123.420 124.200 -0.780 1 1 2117 . 7 1 1 A 193 193 LYS H H 193 8.531 8.812 -0.281 1 1 2118 . 7 1 1 A 193 193 LYS HA H 193 3.294 3.789 -0.495 1 1 2126 . 7 1 1 A 193 193 LYS C C 193 177.640 178.042 -0.402 1 1 2127 . 7 1 1 A 193 193 LYS CA C 193 60.644 60.341 0.303 1 1 2128 . 7 1 1 A 193 193 LYS CB C 193 32.607 32.256 0.351 1 1 2132 . 7 1 1 A 193 193 LYS N N 193 122.851 121.533 1.318 1 1 2133 . 7 1 1 A 194 194 LEU H H 194 8.570 7.782 0.788 1 1 2134 . 7 1 1 A 194 194 LEU HA H 194 3.845 4.159 -0.314 1 1 2144 . 7 1 1 A 194 194 LEU C C 194 177.965 178.634 -0.669 1 1 2145 . 7 1 1 A 194 194 LEU CA C 194 57.611 57.266 0.345 1 1 2146 . 7 1 1 A 194 194 LEU CB C 194 41.776 40.476 1.300 1 1 2150 . 7 1 1 A 194 194 LEU N N 194 115.801 120.491 -4.690 1 1 2151 . 7 1 1 A 195 195 MET H H 195 6.782 7.826 -1.044 1 1 2152 . 7 1 1 A 195 195 MET HA H 195 4.487 4.177 0.310 1 1 2160 . 7 1 1 A 195 195 MET C C 195 178.280 178.236 0.044 1 1 2161 . 7 1 1 A 195 195 MET CA C 195 56.858 57.992 -1.134 1 1 2162 . 7 1 1 A 195 195 MET CB C 195 31.557 32.111 -0.554 1 1 2165 . 7 1 1 A 195 195 MET N N 195 113.898 118.978 -5.080 1 1 2166 . 7 1 1 A 196 196 VAL H H 196 7.713 7.864 -0.151 1 1 2167 . 7 1 1 A 196 196 VAL HA H 196 3.501 3.280 0.221 1 1 2175 . 7 1 1 A 196 196 VAL C C 196 177.624 177.811 -0.187 1 1 2176 . 7 1 1 A 196 196 VAL CA C 196 66.318 66.135 0.183 1 1 2177 . 7 1 1 A 196 196 VAL CB C 196 31.380 31.168 0.212 1 1 2180 . 7 1 1 A 196 196 VAL N N 196 120.413 119.618 0.795 1 1 2181 . 7 1 1 A 197 197 TYR H H 197 7.972 8.042 -0.070 1 1 2182 . 7 1 1 A 197 197 TYR HA H 197 3.145 4.205 -1.060 1 1 2187 . 7 1 1 A 197 197 TYR C C 197 177.726 177.119 0.607 1 1 2188 . 7 1 1 A 197 197 TYR CA C 197 62.253 61.747 0.506 1 1 2189 . 7 1 1 A 197 197 TYR CB C 197 37.314 38.646 -1.332 1 1 2192 . 7 1 1 A 197 197 TYR N N 197 119.543 121.149 -1.606 1 1 2193 . 7 1 1 A 198 198 LEU H H 198 8.630 8.058 0.572 1 1 2194 . 7 1 1 A 198 198 LEU HA H 198 3.923 3.672 0.251 1 1 2203 . 7 1 1 A 198 198 LEU C C 198 178.074 178.803 -0.729 1 1 2204 . 7 1 1 A 198 198 LEU CA C 198 58.294 58.032 0.262 1 1 2205 . 7 1 1 A 198 198 LEU CB C 198 42.177 41.590 0.587 1 1 2209 . 7 1 1 A 198 198 LEU N N 198 118.430 119.809 -1.379 1 1 2210 . 7 1 1 A 199 199 GLN H H 199 8.082 8.107 -0.025 1 1 2211 . 7 1 1 A 199 199 GLN HA H 199 3.054 3.597 -0.543 1 1 2216 . 7 1 1 A 199 199 GLN C C 199 176.875 177.930 -1.055 1 1 2217 . 7 1 1 A 199 199 GLN CA C 199 59.739 58.933 0.806 1 1 2218 . 7 1 1 A 199 199 GLN CB C 199 28.055 27.656 0.399 1 1 2220 . 7 1 1 A 199 199 GLN N N 199 117.926 116.582 1.344 1 1 2222 . 7 1 1 A 200 200 ARG H H 200 7.349 7.951 -0.602 1 1 2223 . 7 1 1 A 200 200 ARG HA H 200 3.798 3.851 -0.053 1 1 2231 . 7 1 1 A 200 200 ARG C C 200 178.037 177.945 0.092 1 1 2232 . 7 1 1 A 200 200 ARG CA C 200 58.260 58.649 -0.389 1 1 2233 . 7 1 1 A 200 200 ARG CB C 200 30.706 30.051 0.655 1 1 2236 . 7 1 1 A 200 200 ARG N N 200 113.772 119.610 -5.838 1 1 2238 . 7 1 1 A 201 201 PHE H H 201 8.329 7.457 0.872 1 1 2239 . 7 1 1 A 201 201 PHE HA H 201 4.630 4.438 0.192 1 1 2244 . 7 1 1 A 201 201 PHE C C 201 176.606 176.286 0.320 1 1 2245 . 7 1 1 A 201 201 PHE CA C 201 59.014 58.564 0.450 1 1 2246 . 7 1 1 A 201 201 PHE CB C 201 40.357 40.808 -0.451 1 1 2249 . 7 1 1 A 201 201 PHE N N 201 114.182 116.240 -2.058 1 1 2250 . 7 1 1 A 202 202 ARG H H 202 8.719 8.373 0.346 1 1 2251 . 7 1 1 A 202 202 ARG HA H 202 5.071 4.656 0.415 1 1 2261 . 7 1 1 A 202 202 ARG CA C 202 53.956 53.479 0.477 1 1 2262 . 7 1 1 A 202 202 ARG CB C 202 31.979 30.147 1.832 1 1 2264 . 7 1 1 A 202 202 ARG N N 202 120.115 114.622 5.493 1 1 2266 . 7 1 1 A 203 203 PRO HA H 203 4.348 4.516 -0.168 1 1 2271 . 7 1 1 A 203 203 PRO C C 203 179.736 178.622 1.114 1 1 2272 . 7 1 1 A 203 203 PRO CA C 203 65.674 65.082 0.592 1 1 2273 . 7 1 1 A 203 203 PRO CB C 203 31.717 32.269 -0.552 1 1 2275 . 7 1 1 A 204 204 LEU H H 204 8.875 7.541 1.334 1 1 2276 . 7 1 1 A 204 204 LEU HA H 204 4.291 3.993 0.298 1 1 2286 . 7 1 1 A 204 204 LEU C C 204 180.353 178.323 2.030 1 1 2287 . 7 1 1 A 204 204 LEU CA C 204 58.012 57.602 0.410 1 1 2288 . 7 1 1 A 204 204 LEU CB C 204 40.893 41.373 -0.480 1 1 2292 . 7 1 1 A 204 204 LEU N N 204 118.940 117.298 1.642 1 1 2293 . 7 1 1 A 205 205 ASP H H 205 7.541 8.414 -0.873 1 1 2294 . 7 1 1 A 205 205 ASP HA H 205 4.622 4.298 0.324 1 1 2297 . 7 1 1 A 205 205 ASP C C 205 177.602 177.788 -0.186 1 1 2298 . 7 1 1 A 205 205 ASP CA C 205 57.437 57.247 0.190 1 1 2299 . 7 1 1 A 205 205 ASP CB C 205 41.143 41.589 -0.446 1 1 2300 . 7 1 1 A 205 205 ASP N N 205 120.838 119.471 1.367 1 1 2301 . 7 1 1 A 206 206 TYR H H 206 8.237 8.105 0.132 1 1 2302 . 7 1 1 A 206 206 TYR HA H 206 4.018 4.097 -0.079 1 1 2307 . 7 1 1 A 206 206 TYR C C 206 176.433 177.891 -1.458 1 1 2308 . 7 1 1 A 206 206 TYR CA C 206 62.148 62.079 0.069 1 1 2309 . 7 1 1 A 206 206 TYR CB C 206 38.305 38.603 -0.298 1 1 2312 . 7 1 1 A 206 206 TYR N N 206 119.475 120.341 -0.866 1 1 2313 . 7 1 1 A 207 207 GLN H H 207 8.124 8.285 -0.161 1 1 2314 . 7 1 1 A 207 207 GLN HA H 207 3.823 3.144 0.679 1 1 2320 . 7 1 1 A 207 207 GLN C C 207 178.019 178.615 -0.596 1 1 2321 . 7 1 1 A 207 207 GLN CA C 207 58.841 59.010 -0.169 1 1 2322 . 7 1 1 A 207 207 GLN CB C 207 28.208 28.547 -0.339 1 1 2324 . 7 1 1 A 207 207 GLN N N 207 115.863 118.089 -2.226 1 1 2326 . 7 1 1 A 208 208 ARG H H 208 7.522 7.850 -0.328 1 1 2327 . 7 1 1 A 208 208 ARG HA H 208 4.127 4.057 0.070 1 1 2334 . 7 1 1 A 208 208 ARG C C 208 179.278 178.459 0.819 1 1 2335 . 7 1 1 A 208 208 ARG CA C 208 59.419 58.940 0.479 1 1 2336 . 7 1 1 A 208 208 ARG CB C 208 30.182 29.793 0.389 1 1 2338 . 7 1 1 A 208 208 ARG N N 208 118.471 119.887 -1.416 1 1 2340 . 7 1 1 A 209 209 LEU H H 209 7.869 7.675 0.194 1 1 2341 . 7 1 1 A 209 209 LEU HA H 209 4.091 4.088 0.003 1 1 2351 . 7 1 1 A 209 209 LEU C C 209 179.715 179.058 0.657 1 1 2352 . 7 1 1 A 209 209 LEU CA C 209 57.891 57.871 0.020 1 1 2353 . 7 1 1 A 209 209 LEU CB C 209 41.338 41.760 -0.422 1 1 2356 . 7 1 1 A 209 209 LEU N N 209 119.659 119.887 -0.228 1 1 2357 . 7 1 1 A 210 210 LEU H H 210 8.034 8.482 -0.448 1 1 2358 . 7 1 1 A 210 210 LEU HA H 210 3.977 4.010 -0.033 1 1 2367 . 7 1 1 A 210 210 LEU C C 210 180.363 178.475 1.888 1 1 2368 . 7 1 1 A 210 210 LEU CA C 210 57.459 58.483 -1.024 1 1 2369 . 7 1 1 A 210 210 LEU CB C 210 41.699 41.404 0.295 1 1 2373 . 7 1 1 A 210 210 LEU N N 210 120.967 119.877 1.090 1 1 2374 . 7 1 1 A 211 211 GLU H H 211 8.174 8.620 -0.446 1 1 2375 . 7 1 1 A 211 211 GLU HA H 211 4.075 3.980 0.095 1 1 2379 . 7 1 1 A 211 211 GLU C C 211 178.499 178.718 -0.219 1 1 2380 . 7 1 1 A 211 211 GLU CA C 211 58.575 59.328 -0.753 1 1 2381 . 7 1 1 A 211 211 GLU CB C 211 29.583 29.164 0.419 1 1 2383 . 7 1 1 A 211 211 GLU N N 211 119.217 117.793 1.424 1 1 2384 . 7 1 1 A 212 212 ALA H H 212 7.723 7.915 -0.192 1 1 2385 . 7 1 1 A 212 212 ALA HA H 212 4.291 4.240 0.051 1 1 2389 . 7 1 1 A 212 212 ALA C C 212 178.770 179.153 -0.383 1 1 2390 . 7 1 1 A 212 212 ALA CA C 212 53.966 54.321 -0.355 1 1 2391 . 7 1 1 A 212 212 ALA CB C 212 19.117 18.608 0.509 1 1 2392 . 7 1 1 A 212 212 ALA N N 212 121.798 122.929 -1.131 1 1 2393 . 7 1 1 A 213 213 ALA H H 213 7.743 7.613 0.130 1 1 2394 . 7 1 1 A 213 213 ALA HA H 213 4.406 4.369 0.037 1 1 2398 . 7 1 1 A 213 213 ALA C C 213 178.413 177.604 0.809 1 1 2399 . 7 1 1 A 213 213 ALA CA C 213 53.129 53.111 0.018 1 1 2400 . 7 1 1 A 213 213 ALA CB C 213 18.926 19.648 -0.722 1 1 2401 . 7 1 1 A 213 213 ALA N N 213 120.435 119.680 0.755 1 1 2402 . 7 1 1 A 214 214 SER H H 214 7.944 8.672 -0.728 1 1 2403 . 7 1 1 A 214 214 SER HA H 214 4.559 4.447 0.112 1 1 2406 . 7 1 1 A 214 214 SER C C 214 174.958 174.530 0.428 1 1 2407 . 7 1 1 A 214 214 SER CA C 214 58.640 57.994 0.646 1 1 2408 . 7 1 1 A 214 214 SER CB C 214 63.928 62.774 1.154 1 1 2409 . 7 1 1 A 214 214 SER N N 214 113.729 113.443 0.286 1 1 2410 . 7 1 1 A 215 215 SER H H 215 8.255 8.829 -0.574 1 1 2411 . 7 1 1 A 215 215 SER HA H 215 4.547 4.191 0.356 1 1 2413 . 7 1 1 A 215 215 SER C C 215 175.289 174.701 0.588 1 1 2414 . 7 1 1 A 215 215 SER CA C 215 58.833 59.477 -0.644 1 1 2415 . 7 1 1 A 215 215 SER CB C 215 63.847 64.167 -0.320 1 1 2416 . 7 1 1 A 215 215 SER N N 215 117.674 123.969 -6.295 1 1 2417 . 7 1 1 A 216 216 GLY H H 216 8.431 7.885 0.546 1 1 2418 . 7 1 1 A 216 216 GLY HA2 H 216 4.054 4.054 0.000 1 1 2419 . 7 1 1 A 216 216 GLY C C 216 174.189 173.279 0.910 1 1 2420 . 7 1 1 A 216 216 GLY CA C 216 45.412 44.161 1.251 1 1 2421 . 7 1 1 A 216 216 GLY N N 216 110.800 107.370 3.430 1 1 2422 . 7 1 1 A 217 217 GLU H H 217 8.267 8.478 -0.211 1 1 2423 . 7 1 1 A 217 217 GLU HA H 217 4.345 4.283 0.062 1 1 2427 . 7 1 1 A 217 217 GLU C C 217 176.428 177.494 -1.066 1 1 2428 . 7 1 1 A 217 217 GLU CA C 217 56.470 57.161 -0.691 1 1 2429 . 7 1 1 A 217 217 GLU CB C 217 30.526 30.238 0.288 1 1 2430 . 7 1 1 A 217 217 GLU N N 217 120.726 120.562 0.164 1 1 2431 . 7 1 1 A 218 218 ALA H H 218 8.476 8.716 -0.240 1 1 2432 . 7 1 1 A 218 218 ALA HA H 218 4.467 4.233 0.234 1 1 2436 . 7 1 1 A 218 218 ALA C C 218 178.015 177.784 0.231 1 1 2437 . 7 1 1 A 218 218 ALA CA C 218 52.547 53.738 -1.191 1 1 2438 . 7 1 1 A 218 218 ALA CB C 218 19.242 19.543 -0.301 1 1 2439 . 7 1 1 A 218 218 ALA N N 218 125.534 124.968 0.566 1 1 2440 . 7 1 1 A 219 219 THR H H 219 8.232 7.624 0.608 1 1 2441 . 7 1 1 A 219 219 THR HA H 219 4.411 4.296 0.115 1 1 2446 . 7 1 1 A 219 219 THR C C 219 175.327 174.825 0.502 1 1 2447 . 7 1 1 A 219 219 THR CA C 219 61.889 63.575 -1.686 1 1 2448 . 7 1 1 A 219 219 THR CB C 219 69.939 68.926 1.013 1 1 2449 . 7 1 1 A 219 219 THR N N 219 113.242 112.837 0.405 1 1 2450 . 7 1 1 A 220 220 GLY H H 220 8.418 8.794 -0.376 1 1 2451 . 7 1 1 A 220 220 GLY C C 220 174.037 174.038 -0.001 1 1 2452 . 7 1 1 A 220 220 GLY CA C 220 45.408 45.811 -0.403 1 1 2453 . 7 1 1 A 220 220 GLY N N 220 111.031 114.442 -3.411 1 1 2454 . 7 1 1 A 221 221 ASP H H 221 8.345 7.690 0.655 1 1 2455 . 7 1 1 A 221 221 ASP HA H 221 4.700 4.624 0.076 1 1 2458 . 7 1 1 A 221 221 ASP C C 221 176.535 175.928 0.607 1 1 2459 . 7 1 1 A 221 221 ASP CA C 221 54.402 54.629 -0.227 1 1 2460 . 7 1 1 A 221 221 ASP CB C 221 41.431 41.514 -0.083 1 1 2461 . 7 1 1 A 221 221 ASP N N 221 120.795 121.385 -0.590 1 1 2462 . 7 1 1 A 222 222 SER H H 222 8.353 8.614 -0.261 1 1 2463 . 7 1 1 A 222 222 SER HA H 222 4.493 5.276 -0.783 1 1 2465 . 7 1 1 A 222 222 SER C C 222 174.224 173.672 0.552 1 1 2466 . 7 1 1 A 222 222 SER CA C 222 58.427 56.810 1.617 1 1 2467 . 7 1 1 A 222 222 SER CB C 222 63.860 64.689 -0.829 1 1 2468 . 7 1 1 A 222 222 SER N N 222 116.220 119.307 -3.087 1 1 2469 . 7 1 1 A 223 223 ALA H H 223 8.381 8.943 -0.562 1 1 2470 . 7 1 1 A 223 223 ALA HA H 223 4.461 5.095 -0.634 1 1 2474 . 7 1 1 A 223 223 ALA C C 223 176.926 175.976 0.950 1 1 2475 . 7 1 1 A 223 223 ALA CA C 223 52.583 51.568 1.015 1 1 2476 . 7 1 1 A 223 223 ALA CB C 223 19.438 20.860 -1.422 1 1 2477 . 7 1 1 A 223 223 ALA N N 223 126.592 125.753 0.839 1 1 1 . 8 1 1 A 2 2 ALA HA H 2 4.274 5.035 -0.761 1 1 5 . 8 1 1 A 2 2 ALA C C 2 177.828 176.863 0.965 1 1 6 . 8 1 1 A 2 2 ALA CA C 2 52.984 50.397 2.587 1 1 7 . 8 1 1 A 2 2 ALA CB C 2 19.138 22.954 -3.816 1 1 8 . 8 1 1 A 3 3 GLN H H 3 8.463 8.396 0.067 1 1 9 . 8 1 1 A 3 3 GLN HA H 3 4.676 4.695 -0.019 1 1 12 . 8 1 1 A 3 3 GLN C C 3 176.002 176.617 -0.615 1 1 13 . 8 1 1 A 3 3 GLN CA C 3 56.258 55.337 0.921 1 1 14 . 8 1 1 A 3 3 GLN CB C 3 30.346 30.116 0.230 1 1 15 . 8 1 1 A 3 3 GLN N N 3 117.490 118.898 -1.408 1 1 16 . 8 1 1 A 4 4 GLY H H 4 8.099 7.918 0.181 1 1 17 . 8 1 1 A 4 4 GLY HA2 H 4 3.910 4.051 -0.141 1 1 18 . 8 1 1 A 4 4 GLY C C 4 173.332 173.715 -0.383 1 1 19 . 8 1 1 A 4 4 GLY CA C 4 45.333 44.808 0.525 1 1 20 . 8 1 1 A 4 4 GLY N N 4 109.423 110.141 -0.718 1 1 21 . 8 1 1 A 5 5 LEU H H 5 7.863 8.136 -0.273 1 1 22 . 8 1 1 A 5 5 LEU HA H 5 4.561 4.835 -0.274 1 1 32 . 8 1 1 A 5 5 LEU C C 5 176.448 177.276 -0.828 1 1 33 . 8 1 1 A 5 5 LEU CA C 5 54.713 53.979 0.734 1 1 34 . 8 1 1 A 5 5 LEU CB C 5 43.551 43.097 0.454 1 1 38 . 8 1 1 A 5 5 LEU N N 5 120.391 123.237 -2.846 1 1 39 . 8 1 1 A 6 6 ILE H H 6 8.764 8.737 0.027 1 1 40 . 8 1 1 A 6 6 ILE HA H 6 4.087 3.970 0.117 1 1 49 . 8 1 1 A 6 6 ILE C C 6 174.679 175.824 -1.145 1 1 50 . 8 1 1 A 6 6 ILE CA C 6 61.279 61.953 -0.674 1 1 51 . 8 1 1 A 6 6 ILE CB C 6 39.651 37.526 2.125 1 1 54 . 8 1 1 A 6 6 ILE N N 6 123.050 124.707 -1.657 1 1 55 . 8 1 1 A 7 7 GLU H H 7 8.587 8.812 -0.225 1 1 56 . 8 1 1 A 7 7 GLU HA H 7 4.917 4.714 0.203 1 1 61 . 8 1 1 A 7 7 GLU C C 7 175.978 176.329 -0.351 1 1 62 . 8 1 1 A 7 7 GLU CA C 7 56.127 56.100 0.027 1 1 63 . 8 1 1 A 7 7 GLU CB C 7 31.115 30.396 0.719 1 1 65 . 8 1 1 A 7 7 GLU N N 7 127.415 128.709 -1.294 1 1 66 . 8 1 1 A 8 8 VAL H H 8 8.986 9.593 -0.607 1 1 67 . 8 1 1 A 8 8 VAL HA H 8 4.375 4.984 -0.609 1 1 72 . 8 1 1 A 8 8 VAL C C 8 173.704 174.794 -1.090 1 1 73 . 8 1 1 A 8 8 VAL CA C 8 61.347 59.974 1.373 1 1 74 . 8 1 1 A 8 8 VAL CB C 8 33.611 34.361 -0.750 1 1 76 . 8 1 1 A 8 8 VAL N N 8 126.071 121.656 4.415 1 1 77 . 8 1 1 A 9 9 GLU H H 9 8.521 9.156 -0.635 1 1 78 . 8 1 1 A 9 9 GLU HA H 9 5.837 5.343 0.494 1 1 81 . 8 1 1 A 9 9 GLU C C 9 175.939 174.596 1.343 1 1 82 . 8 1 1 A 9 9 GLU CA C 9 54.516 54.599 -0.083 1 1 83 . 8 1 1 A 9 9 GLU CB C 9 33.009 34.389 -1.380 1 1 84 . 8 1 1 A 9 9 GLU N N 9 122.857 122.689 0.168 1 1 85 . 8 1 1 A 10 10 ARG H H 10 8.690 8.529 0.161 1 1 86 . 8 1 1 A 10 10 ARG HA H 10 4.709 4.826 -0.117 1 1 94 . 8 1 1 A 10 10 ARG C C 10 174.826 174.140 0.686 1 1 95 . 8 1 1 A 10 10 ARG CA C 10 54.491 54.720 -0.229 1 1 96 . 8 1 1 A 10 10 ARG CB C 10 35.777 34.534 1.243 1 1 98 . 8 1 1 A 10 10 ARG N N 10 120.430 120.520 -0.090 1 1 100 . 8 1 1 A 11 11 LYS H H 11 8.874 8.707 0.167 1 1 101 . 8 1 1 A 11 11 LYS HA H 11 5.530 5.481 0.049 1 1 107 . 8 1 1 A 11 11 LYS C C 11 176.919 174.700 2.219 1 1 108 . 8 1 1 A 11 11 LYS CA C 11 55.084 54.872 0.212 1 1 109 . 8 1 1 A 11 11 LYS CB C 11 35.435 36.683 -1.248 1 1 113 . 8 1 1 A 11 11 LYS N N 11 121.087 122.991 -1.904 1 1 114 . 8 1 1 A 12 12 PHE H H 12 8.877 9.166 -0.289 1 1 115 . 8 1 1 A 12 12 PHE HA H 12 5.130 5.281 -0.151 1 1 120 . 8 1 1 A 12 12 PHE C C 12 171.676 172.200 -0.524 1 1 121 . 8 1 1 A 12 12 PHE CA C 12 55.869 55.840 0.029 1 1 122 . 8 1 1 A 12 12 PHE CB C 12 42.108 42.057 0.051 1 1 125 . 8 1 1 A 12 12 PHE N N 12 117.486 119.974 -2.488 1 1 126 . 8 1 1 A 13 13 ALA H H 13 9.134 9.534 -0.400 1 1 127 . 8 1 1 A 13 13 ALA HA H 13 5.003 4.692 0.311 1 1 131 . 8 1 1 A 13 13 ALA CA C 13 48.340 48.840 -0.500 1 1 132 . 8 1 1 A 13 13 ALA CB C 13 19.191 20.270 -1.079 1 1 133 . 8 1 1 A 13 13 ALA N N 13 125.915 123.026 2.889 1 1 134 . 8 1 1 A 14 14 PRO HA H 14 4.620 4.707 -0.087 1 1 140 . 8 1 1 A 14 14 PRO C C 14 176.502 177.314 -0.812 1 1 141 . 8 1 1 A 14 14 PRO CA C 14 62.672 62.700 -0.028 1 1 142 . 8 1 1 A 14 14 PRO CB C 14 33.119 32.359 0.760 1 1 145 . 8 1 1 A 15 15 GLY H H 15 8.721 8.595 0.126 1 1 146 . 8 1 1 A 15 15 GLY HA2 H 15 3.999 4.100 -0.101 1 1 147 . 8 1 1 A 15 15 GLY HA3 H 15 4.632 4.104 0.528 1 1 148 . 8 1 1 A 15 15 GLY CA C 15 44.411 44.057 0.354 1 1 149 . 8 1 1 A 15 15 GLY N N 15 109.863 108.387 1.476 1 1 150 . 8 1 1 A 16 16 PRO HA H 16 4.447 4.377 0.070 1 1 155 . 8 1 1 A 16 16 PRO C C 16 177.053 176.891 0.162 1 1 156 . 8 1 1 A 16 16 PRO CA C 16 64.395 64.709 -0.314 1 1 157 . 8 1 1 A 16 16 PRO CB C 16 31.993 31.791 0.202 1 1 159 . 8 1 1 A 17 17 ASP H H 17 8.550 8.481 0.069 1 1 160 . 8 1 1 A 17 17 ASP HA H 17 4.950 4.755 0.195 1 1 163 . 8 1 1 A 17 17 ASP C C 17 176.800 176.543 0.257 1 1 164 . 8 1 1 A 17 17 ASP CA C 17 53.271 54.022 -0.751 1 1 165 . 8 1 1 A 17 17 ASP CB C 17 40.392 41.734 -1.342 1 1 166 . 8 1 1 A 17 17 ASP N N 17 116.060 117.002 -0.942 1 1 167 . 8 1 1 A 18 18 THR H H 18 7.664 7.240 0.424 1 1 168 . 8 1 1 A 18 18 THR HA H 18 4.120 3.674 0.446 1 1 174 . 8 1 1 A 18 18 THR C C 18 175.407 176.439 -1.032 1 1 175 . 8 1 1 A 18 18 THR CA C 18 68.718 67.312 1.406 1 1 176 . 8 1 1 A 18 18 THR CB C 18 69.179 68.620 0.559 1 1 178 . 8 1 1 A 18 18 THR N N 18 117.158 114.610 2.548 1 1 179 . 8 1 1 A 19 19 GLU H H 19 8.817 8.499 0.318 1 1 180 . 8 1 1 A 19 19 GLU HA H 19 3.510 3.187 0.323 1 1 184 . 8 1 1 A 19 19 GLU C C 19 178.345 179.210 -0.865 1 1 185 . 8 1 1 A 19 19 GLU CA C 19 61.237 59.821 1.416 1 1 186 . 8 1 1 A 19 19 GLU CB C 19 28.746 29.272 -0.526 1 1 188 . 8 1 1 A 19 19 GLU N N 19 118.802 119.104 -0.302 1 1 189 . 8 1 1 A 20 20 GLU H H 20 7.976 8.027 -0.051 1 1 190 . 8 1 1 A 20 20 GLU HA H 20 4.036 4.117 -0.081 1 1 194 . 8 1 1 A 20 20 GLU C C 20 179.451 179.400 0.051 1 1 195 . 8 1 1 A 20 20 GLU CA C 20 59.909 58.983 0.926 1 1 196 . 8 1 1 A 20 20 GLU CB C 20 28.992 29.476 -0.484 1 1 198 . 8 1 1 A 20 20 GLU N N 20 121.130 119.445 1.685 1 1 199 . 8 1 1 A 21 21 ARG H H 21 8.199 8.333 -0.134 1 1 200 . 8 1 1 A 21 21 ARG HA H 21 4.061 4.112 -0.051 1 1 207 . 8 1 1 A 21 21 ARG C C 21 179.087 178.725 0.362 1 1 208 . 8 1 1 A 21 21 ARG CA C 21 58.477 58.308 0.169 1 1 209 . 8 1 1 A 21 21 ARG CB C 21 30.101 29.851 0.250 1 1 211 . 8 1 1 A 21 21 ARG N N 21 119.897 120.396 -0.499 1 1 213 . 8 1 1 A 22 22 LEU H H 22 8.154 8.338 -0.184 1 1 214 . 8 1 1 A 22 22 LEU HA H 22 3.560 3.793 -0.233 1 1 224 . 8 1 1 A 22 22 LEU C C 22 178.461 179.338 -0.877 1 1 225 . 8 1 1 A 22 22 LEU CA C 22 58.432 57.805 0.627 1 1 226 . 8 1 1 A 22 22 LEU CB C 22 40.229 40.782 -0.553 1 1 230 . 8 1 1 A 22 22 LEU N N 22 120.012 119.739 0.273 1 1 231 . 8 1 1 A 23 23 GLN H H 23 7.621 7.873 -0.252 1 1 232 . 8 1 1 A 23 23 GLN HA H 23 4.232 4.074 0.158 1 1 238 . 8 1 1 A 23 23 GLN C C 23 180.543 178.863 1.680 1 1 239 . 8 1 1 A 23 23 GLN CA C 23 59.434 59.256 0.178 1 1 240 . 8 1 1 A 23 23 GLN CB C 23 28.749 28.548 0.201 1 1 242 . 8 1 1 A 23 23 GLN N N 23 117.823 117.949 -0.126 1 1 244 . 8 1 1 A 24 24 GLU H H 24 8.165 7.770 0.395 1 1 245 . 8 1 1 A 24 24 GLU HA H 24 4.072 4.043 0.029 1 1 249 . 8 1 1 A 24 24 GLU C C 24 178.612 179.607 -0.995 1 1 250 . 8 1 1 A 24 24 GLU CA C 24 59.236 58.904 0.332 1 1 251 . 8 1 1 A 24 24 GLU CB C 24 29.606 29.472 0.134 1 1 253 . 8 1 1 A 24 24 GLU N N 24 122.589 120.188 2.401 1 1 254 . 8 1 1 A 25 25 LEU H H 25 7.911 7.932 -0.021 1 1 255 . 8 1 1 A 25 25 LEU HA H 25 4.214 4.099 0.115 1 1 265 . 8 1 1 A 25 25 LEU C C 25 176.745 177.304 -0.559 1 1 266 . 8 1 1 A 25 25 LEU CA C 25 55.659 55.813 -0.154 1 1 267 . 8 1 1 A 25 25 LEU CB C 25 43.109 42.641 0.468 1 1 271 . 8 1 1 A 25 25 LEU N N 25 117.882 117.263 0.619 1 1 272 . 8 1 1 A 26 26 GLY H H 26 7.776 7.874 -0.098 1 1 273 . 8 1 1 A 26 26 GLY HA2 H 26 4.337 4.003 0.334 1 1 274 . 8 1 1 A 26 26 GLY HA3 H 26 3.856 4.021 -0.165 1 1 275 . 8 1 1 A 26 26 GLY C C 26 175.456 174.861 0.595 1 1 276 . 8 1 1 A 26 26 GLY CA C 26 44.875 45.358 -0.483 1 1 277 . 8 1 1 A 26 26 GLY N N 26 104.938 105.909 -0.971 1 1 278 . 8 1 1 A 27 27 ALA H H 27 8.104 8.724 -0.620 1 1 279 . 8 1 1 A 27 27 ALA HA H 27 4.949 4.473 0.476 1 1 283 . 8 1 1 A 27 27 ALA C C 27 176.448 177.425 -0.977 1 1 284 . 8 1 1 A 27 27 ALA CA C 27 52.183 52.502 -0.319 1 1 285 . 8 1 1 A 27 27 ALA CB C 27 21.814 19.681 2.133 1 1 286 . 8 1 1 A 27 27 ALA N N 27 123.263 124.573 -1.310 1 1 287 . 8 1 1 A 28 28 THR H H 28 9.369 9.435 -0.066 1 1 288 . 8 1 1 A 28 28 THR HA H 28 4.779 4.621 0.158 1 1 293 . 8 1 1 A 28 28 THR C C 28 173.725 174.317 -0.592 1 1 294 . 8 1 1 A 28 28 THR CA C 28 60.046 62.668 -2.622 1 1 295 . 8 1 1 A 28 28 THR CB C 28 70.592 69.432 1.160 1 1 297 . 8 1 1 A 28 28 THR N N 28 112.201 119.391 -7.190 1 1 298 . 8 1 1 A 29 29 LEU H H 29 8.518 8.354 0.164 1 1 299 . 8 1 1 A 29 29 LEU HA H 29 3.332 3.747 -0.415 1 1 309 . 8 1 1 A 29 29 LEU C C 29 176.202 176.615 -0.413 1 1 310 . 8 1 1 A 29 29 LEU CA C 29 55.031 55.134 -0.103 1 1 311 . 8 1 1 A 29 29 LEU CB C 29 40.624 41.646 -1.022 1 1 315 . 8 1 1 A 29 29 LEU N N 29 128.151 128.395 -0.244 1 1 316 . 8 1 1 A 30 30 GLU H H 30 9.269 9.079 0.190 1 1 317 . 8 1 1 A 30 30 GLU HA H 30 4.287 4.303 -0.016 1 1 321 . 8 1 1 A 30 30 GLU C C 30 176.740 176.362 0.378 1 1 322 . 8 1 1 A 30 30 GLU CA C 30 57.283 57.059 0.224 1 1 323 . 8 1 1 A 30 30 GLU CB C 30 31.045 30.859 0.186 1 1 325 . 8 1 1 A 30 30 GLU N N 30 130.123 123.608 6.515 1 1 326 . 8 1 1 A 31 31 HIS H H 31 7.341 7.168 0.173 1 1 327 . 8 1 1 A 31 31 HIS HA H 31 4.701 5.007 -0.306 1 1 331 . 8 1 1 A 31 31 HIS C C 31 172.581 173.879 -1.298 1 1 332 . 8 1 1 A 31 31 HIS CA C 31 55.876 54.666 1.210 1 1 333 . 8 1 1 A 31 31 HIS CB C 31 33.434 34.148 -0.714 1 1 334 . 8 1 1 A 31 31 HIS N N 31 113.223 116.334 -3.111 1 1 335 . 8 1 1 A 32 32 ARG H H 32 8.196 8.883 -0.687 1 1 336 . 8 1 1 A 32 32 ARG HA H 32 5.262 5.357 -0.095 1 1 341 . 8 1 1 A 32 32 ARG C C 32 174.377 174.969 -0.592 1 1 342 . 8 1 1 A 32 32 ARG CA C 32 55.808 54.515 1.293 1 1 343 . 8 1 1 A 32 32 ARG CB C 32 33.340 33.857 -0.517 1 1 345 . 8 1 1 A 32 32 ARG N N 32 123.003 119.763 3.240 1 1 346 . 8 1 1 A 33 33 VAL H H 33 8.956 9.217 -0.261 1 1 347 . 8 1 1 A 33 33 VAL HA H 33 4.734 4.968 -0.234 1 1 355 . 8 1 1 A 33 33 VAL C C 33 172.821 175.234 -2.413 1 1 356 . 8 1 1 A 33 33 VAL CA C 33 60.197 59.958 0.239 1 1 357 . 8 1 1 A 33 33 VAL CB C 33 35.860 35.157 0.703 1 1 360 . 8 1 1 A 33 33 VAL N N 33 122.929 117.554 5.375 1 1 361 . 8 1 1 A 34 34 THR H H 34 8.250 8.881 -0.631 1 1 362 . 8 1 1 A 34 34 THR HA H 34 5.616 5.791 -0.175 1 1 367 . 8 1 1 A 34 34 THR C C 34 173.913 173.896 0.017 1 1 368 . 8 1 1 A 34 34 THR CA C 34 60.245 60.560 -0.315 1 1 369 . 8 1 1 A 34 34 THR CB C 34 71.706 71.072 0.634 1 1 371 . 8 1 1 A 34 34 THR N N 34 119.164 118.780 0.384 1 1 372 . 8 1 1 A 35 35 PHE H H 35 8.565 8.625 -0.060 1 1 373 . 8 1 1 A 35 35 PHE HA H 35 5.029 5.392 -0.363 1 1 378 . 8 1 1 A 35 35 PHE C C 35 173.193 172.314 0.879 1 1 379 . 8 1 1 A 35 35 PHE CA C 35 55.687 55.373 0.314 1 1 380 . 8 1 1 A 35 35 PHE CB C 35 40.853 41.838 -0.985 1 1 383 . 8 1 1 A 35 35 PHE N N 35 120.244 118.931 1.313 1 1 384 . 8 1 1 A 36 36 ARG H H 36 8.869 9.013 -0.144 1 1 385 . 8 1 1 A 36 36 ARG HA H 36 4.982 4.792 0.190 1 1 387 . 8 1 1 A 36 36 ARG C C 36 174.743 174.934 -0.191 1 1 388 . 8 1 1 A 36 36 ARG CA C 36 55.493 55.849 -0.356 1 1 389 . 8 1 1 A 36 36 ARG CB C 36 32.228 31.329 0.899 1 1 390 . 8 1 1 A 36 36 ARG N N 36 123.893 120.447 3.446 1 1 391 . 8 1 1 A 37 37 ASP H H 37 8.402 9.479 -1.077 1 1 392 . 8 1 1 A 37 37 ASP HA H 37 5.462 5.603 -0.141 1 1 395 . 8 1 1 A 37 37 ASP C C 37 175.177 175.667 -0.490 1 1 396 . 8 1 1 A 37 37 ASP CA C 37 53.942 52.712 1.230 1 1 397 . 8 1 1 A 37 37 ASP CB C 37 45.486 44.155 1.331 1 1 398 . 8 1 1 A 37 37 ASP N N 37 127.149 124.940 2.209 1 1 399 . 8 1 1 A 38 38 THR H H 38 8.151 8.601 -0.450 1 1 400 . 8 1 1 A 38 38 THR HA H 38 4.866 4.994 -0.128 1 1 405 . 8 1 1 A 38 38 THR C C 38 172.792 172.314 0.478 1 1 406 . 8 1 1 A 38 38 THR CA C 38 61.416 60.299 1.117 1 1 407 . 8 1 1 A 38 38 THR CB C 38 71.047 71.211 -0.164 1 1 409 . 8 1 1 A 38 38 THR N N 38 115.686 113.620 2.066 1 1 410 . 8 1 1 A 39 39 TYR H H 39 9.021 9.066 -0.045 1 1 411 . 8 1 1 A 39 39 TYR HA H 39 5.544 5.618 -0.074 1 1 416 . 8 1 1 A 39 39 TYR C C 39 176.032 174.714 1.318 1 1 417 . 8 1 1 A 39 39 TYR CA C 39 57.184 56.205 0.979 1 1 418 . 8 1 1 A 39 39 TYR CB C 39 41.642 40.125 1.517 1 1 420 . 8 1 1 A 39 39 TYR N N 39 124.579 124.203 0.376 1 1 421 . 8 1 1 A 40 40 TYR H H 40 8.487 8.917 -0.430 1 1 422 . 8 1 1 A 40 40 TYR HA H 40 5.517 5.828 -0.311 1 1 426 . 8 1 1 A 40 40 TYR C C 40 174.108 174.525 -0.417 1 1 427 . 8 1 1 A 40 40 TYR CA C 40 56.979 56.832 0.147 1 1 428 . 8 1 1 A 40 40 TYR CB C 40 44.132 42.336 1.796 1 1 431 . 8 1 1 A 40 40 TYR N N 40 119.709 122.085 -2.376 1 1 432 . 8 1 1 A 41 41 ASP H H 41 9.341 8.721 0.620 1 1 433 . 8 1 1 A 41 41 ASP HA H 41 4.866 5.127 -0.261 1 1 436 . 8 1 1 A 41 41 ASP C C 41 177.262 175.102 2.160 1 1 437 . 8 1 1 A 41 41 ASP CA C 41 53.445 53.451 -0.006 1 1 438 . 8 1 1 A 41 41 ASP CB C 41 45.347 44.686 0.661 1 1 439 . 8 1 1 A 41 41 ASP N N 41 117.995 120.746 -2.751 1 1 440 . 8 1 1 A 42 42 THR H H 42 11.574 8.685 2.889 1 1 441 . 8 1 1 A 42 42 THR HA H 42 5.206 4.614 0.592 1 1 446 . 8 1 1 A 42 42 THR C C 42 177.935 176.437 1.498 1 1 447 . 8 1 1 A 42 42 THR CA C 42 60.400 62.169 -1.769 1 1 448 . 8 1 1 A 42 42 THR CB C 42 72.114 69.769 2.345 1 1 450 . 8 1 1 A 42 42 THR N N 42 114.394 117.398 -3.004 1 1 451 . 8 1 1 A 43 43 SER H H 43 9.715 8.782 0.933 1 1 452 . 8 1 1 A 43 43 SER HA H 43 4.252 4.088 0.164 1 1 455 . 8 1 1 A 43 43 SER C C 43 175.478 175.583 -0.105 1 1 456 . 8 1 1 A 43 43 SER CA C 43 61.277 61.101 0.176 1 1 457 . 8 1 1 A 43 43 SER CB C 43 62.821 62.560 0.261 1 1 458 . 8 1 1 A 43 43 SER N N 43 116.674 119.385 -2.711 1 1 459 . 8 1 1 A 44 44 GLU H H 44 7.674 7.698 -0.024 1 1 460 . 8 1 1 A 44 44 GLU HA H 44 4.330 4.457 -0.127 1 1 464 . 8 1 1 A 44 44 GLU C C 44 175.001 175.423 -0.422 1 1 465 . 8 1 1 A 44 44 GLU CA C 44 55.992 56.023 -0.031 1 1 466 . 8 1 1 A 44 44 GLU CB C 44 29.276 29.717 -0.441 1 1 468 . 8 1 1 A 44 44 GLU N N 44 117.856 118.869 -1.013 1 1 469 . 8 1 1 A 45 45 LEU H H 45 8.222 7.986 0.236 1 1 470 . 8 1 1 A 45 45 LEU HA H 45 3.901 4.680 -0.779 1 1 480 . 8 1 1 A 45 45 LEU C C 45 175.209 176.466 -1.257 1 1 481 . 8 1 1 A 45 45 LEU CA C 45 55.548 56.105 -0.557 1 1 482 . 8 1 1 A 45 45 LEU CB C 45 38.458 39.814 -1.356 1 1 485 . 8 1 1 A 45 45 LEU N N 45 119.335 117.413 1.922 1 1 486 . 8 1 1 A 46 46 SER H H 46 7.347 7.875 -0.528 1 1 487 . 8 1 1 A 46 46 SER HA H 46 3.954 4.189 -0.235 1 1 489 . 8 1 1 A 46 46 SER C C 46 177.497 176.361 1.136 1 1 490 . 8 1 1 A 46 46 SER CA C 46 62.471 62.345 0.126 1 1 491 . 8 1 1 A 46 46 SER CB C 46 63.908 62.825 1.083 1 1 492 . 8 1 1 A 46 46 SER N N 46 111.433 112.956 -1.523 1 1 493 . 8 1 1 A 47 47 LEU H H 47 12.003 8.508 3.495 1 1 494 . 8 1 1 A 47 47 LEU HA H 47 3.959 4.142 -0.183 1 1 504 . 8 1 1 A 47 47 LEU C C 47 180.340 178.620 1.720 1 1 505 . 8 1 1 A 47 47 LEU CA C 47 58.879 58.088 0.791 1 1 506 . 8 1 1 A 47 47 LEU CB C 47 39.572 41.881 -2.309 1 1 510 . 8 1 1 A 47 47 LEU N N 47 124.605 122.926 1.679 1 1 511 . 8 1 1 A 48 48 MET H H 48 10.599 8.910 1.689 1 1 512 . 8 1 1 A 48 48 MET HA H 48 3.213 3.394 -0.181 1 1 520 . 8 1 1 A 48 48 MET C C 48 181.177 177.675 3.502 1 1 521 . 8 1 1 A 48 48 MET CA C 48 60.747 58.583 2.164 1 1 522 . 8 1 1 A 48 48 MET CB C 48 32.594 32.351 0.243 1 1 525 . 8 1 1 A 48 48 MET N N 48 126.254 116.716 9.538 1 1 526 . 8 1 1 A 49 49 LEU H H 49 8.731 7.467 1.264 1 1 527 . 8 1 1 A 49 49 LEU HA H 49 4.097 4.241 -0.144 1 1 536 . 8 1 1 A 49 49 LEU C C 49 178.144 177.660 0.484 1 1 537 . 8 1 1 A 49 49 LEU CA C 49 57.800 57.125 0.675 1 1 538 . 8 1 1 A 49 49 LEU CB C 49 41.379 41.372 0.007 1 1 541 . 8 1 1 A 49 49 LEU N N 49 119.183 121.357 -2.174 1 1 542 . 8 1 1 A 50 50 SER H H 50 7.853 7.355 0.498 1 1 543 . 8 1 1 A 50 50 SER HA H 50 4.822 4.537 0.285 1 1 546 . 8 1 1 A 50 50 SER C C 50 174.539 172.834 1.705 1 1 547 . 8 1 1 A 50 50 SER CA C 50 57.811 57.962 -0.151 1 1 548 . 8 1 1 A 50 50 SER CB C 50 64.443 63.387 1.056 1 1 549 . 8 1 1 A 50 50 SER N N 50 114.594 112.254 2.340 1 1 550 . 8 1 1 A 51 51 ASP H H 51 8.264 8.008 0.256 1 1 551 . 8 1 1 A 51 51 ASP HA H 51 4.362 4.291 0.071 1 1 554 . 8 1 1 A 51 51 ASP C C 51 172.921 174.475 -1.554 1 1 555 . 8 1 1 A 51 51 ASP CA C 51 55.343 55.409 -0.066 1 1 556 . 8 1 1 A 51 51 ASP CB C 51 40.583 39.589 0.994 1 1 557 . 8 1 1 A 51 51 ASP N N 51 123.003 117.396 5.607 1 1 558 . 8 1 1 A 52 52 HIS H H 52 7.869 7.107 0.762 1 1 559 . 8 1 1 A 52 52 HIS HA H 52 5.335 5.299 0.036 1 1 564 . 8 1 1 A 52 52 HIS C C 52 173.991 173.598 0.393 1 1 565 . 8 1 1 A 52 52 HIS CA C 52 55.889 54.022 1.867 1 1 566 . 8 1 1 A 52 52 HIS CB C 52 31.789 30.461 1.328 1 1 568 . 8 1 1 A 52 52 HIS N N 52 112.486 116.974 -4.488 1 1 569 . 8 1 1 A 53 53 TRP H H 53 8.165 9.398 -1.233 1 1 570 . 8 1 1 A 53 53 TRP HA H 53 4.926 5.502 -0.576 1 1 578 . 8 1 1 A 53 53 TRP C C 53 175.354 175.180 0.174 1 1 579 . 8 1 1 A 53 53 TRP CA C 53 55.364 55.981 -0.617 1 1 580 . 8 1 1 A 53 53 TRP CB C 53 30.641 31.268 -0.627 1 1 585 . 8 1 1 A 53 53 TRP N N 53 117.916 125.335 -7.419 1 1 587 . 8 1 1 A 54 54 LEU H H 54 10.088 9.051 1.037 1 1 588 . 8 1 1 A 54 54 LEU HA H 54 5.497 5.544 -0.047 1 1 598 . 8 1 1 A 54 54 LEU C C 54 173.337 174.832 -1.495 1 1 599 . 8 1 1 A 54 54 LEU CA C 54 54.408 53.531 0.877 1 1 600 . 8 1 1 A 54 54 LEU CB C 54 44.156 45.537 -1.381 1 1 604 . 8 1 1 A 54 54 LEU N N 54 130.826 125.771 5.055 1 1 605 . 8 1 1 A 55 55 ARG H H 55 9.289 9.395 -0.106 1 1 606 . 8 1 1 A 55 55 ARG HA H 55 5.482 5.125 0.357 1 1 612 . 8 1 1 A 55 55 ARG C C 55 174.057 174.020 0.037 1 1 613 . 8 1 1 A 55 55 ARG CA C 55 53.167 54.117 -0.950 1 1 614 . 8 1 1 A 55 55 ARG CB C 55 34.270 33.683 0.587 1 1 616 . 8 1 1 A 55 55 ARG N N 55 125.089 124.614 0.475 1 1 618 . 8 1 1 A 56 56 GLN H H 56 9.092 9.038 0.054 1 1 619 . 8 1 1 A 56 56 GLN HA H 56 3.991 4.465 -0.474 1 1 626 . 8 1 1 A 56 56 GLN C C 56 174.199 174.422 -0.223 1 1 627 . 8 1 1 A 56 56 GLN CA C 56 54.566 53.741 0.825 1 1 628 . 8 1 1 A 56 56 GLN CB C 56 29.643 30.529 -0.886 1 1 630 . 8 1 1 A 56 56 GLN N N 56 124.355 121.975 2.380 1 1 632 . 8 1 1 A 57 57 ARG H H 57 8.440 8.239 0.201 1 1 633 . 8 1 1 A 57 57 ARG HA H 57 5.316 5.069 0.247 1 1 639 . 8 1 1 A 57 57 ARG C C 57 176.188 176.226 -0.038 1 1 640 . 8 1 1 A 57 57 ARG CA C 57 53.940 55.500 -1.560 1 1 641 . 8 1 1 A 57 57 ARG CB C 57 32.426 30.429 1.997 1 1 643 . 8 1 1 A 57 57 ARG N N 57 130.222 126.077 4.145 1 1 645 . 8 1 1 A 58 58 GLU H H 58 8.891 8.891 0.000 1 1 646 . 8 1 1 A 58 58 GLU HA H 58 3.996 4.022 -0.026 1 1 649 . 8 1 1 A 58 58 GLU CA C 58 58.364 57.232 1.132 1 1 650 . 8 1 1 A 58 58 GLU CB C 58 30.875 27.388 3.487 1 1 651 . 8 1 1 A 58 58 GLU N N 58 131.208 121.227 9.981 1 1 652 . 8 1 1 A 59 59 GLY H H 59 8.367 8.440 -0.073 1 1 653 . 8 1 1 A 59 59 GLY HA2 H 59 4.334 3.701 0.633 1 1 654 . 8 1 1 A 59 59 GLY HA3 H 59 3.743 3.821 -0.078 1 1 655 . 8 1 1 A 59 59 GLY C C 59 174.194 175.089 -0.895 1 1 656 . 8 1 1 A 59 59 GLY CA C 59 45.666 46.040 -0.374 1 1 657 . 8 1 1 A 60 60 SER H H 60 8.071 8.547 -0.476 1 1 658 . 8 1 1 A 60 60 SER HA H 60 4.730 4.551 0.179 1 1 661 . 8 1 1 A 60 60 SER C C 60 173.908 173.518 0.390 1 1 662 . 8 1 1 A 60 60 SER CA C 60 58.762 58.129 0.633 1 1 663 . 8 1 1 A 60 60 SER CB C 60 64.497 63.927 0.570 1 1 664 . 8 1 1 A 60 60 SER N N 60 114.636 114.458 0.178 1 1 665 . 8 1 1 A 61 61 GLY H H 61 8.401 7.069 1.332 1 1 666 . 8 1 1 A 61 61 GLY HA2 H 61 4.560 3.987 0.573 1 1 667 . 8 1 1 A 61 61 GLY HA3 H 61 3.878 4.021 -0.143 1 1 668 . 8 1 1 A 61 61 GLY C C 61 173.526 172.564 0.962 1 1 669 . 8 1 1 A 61 61 GLY CA C 61 44.906 45.301 -0.395 1 1 670 . 8 1 1 A 61 61 GLY N N 61 109.421 108.550 0.871 1 1 671 . 8 1 1 A 62 62 TRP H H 62 8.861 8.449 0.412 1 1 672 . 8 1 1 A 62 62 TRP HA H 62 5.089 5.158 -0.069 1 1 681 . 8 1 1 A 62 62 TRP C C 62 176.168 176.181 -0.013 1 1 682 . 8 1 1 A 62 62 TRP CA C 62 57.459 57.656 -0.197 1 1 683 . 8 1 1 A 62 62 TRP CB C 62 32.536 30.944 1.592 1 1 689 . 8 1 1 A 62 62 TRP N N 62 122.939 122.989 -0.050 1 1 691 . 8 1 1 A 63 63 GLU H H 63 9.306 9.340 -0.034 1 1 692 . 8 1 1 A 63 63 GLU HA H 63 4.919 5.251 -0.332 1 1 697 . 8 1 1 A 63 63 GLU C C 63 173.770 174.767 -0.997 1 1 698 . 8 1 1 A 63 63 GLU CA C 63 55.953 55.115 0.838 1 1 699 . 8 1 1 A 63 63 GLU CB C 63 35.317 32.854 2.463 1 1 701 . 8 1 1 A 63 63 GLU N N 63 120.136 122.373 -2.237 1 1 702 . 8 1 1 A 64 64 LEU H H 64 8.998 8.910 0.088 1 1 703 . 8 1 1 A 64 64 LEU HA H 64 5.616 5.259 0.357 1 1 712 . 8 1 1 A 64 64 LEU C C 64 175.014 174.342 0.672 1 1 713 . 8 1 1 A 64 64 LEU CA C 64 52.945 53.663 -0.718 1 1 714 . 8 1 1 A 64 64 LEU CB C 64 46.904 45.835 1.069 1 1 717 . 8 1 1 A 64 64 LEU N N 64 127.321 126.841 0.480 1 1 718 . 8 1 1 A 65 65 LYS H H 65 9.322 10.087 -0.765 1 1 719 . 8 1 1 A 65 65 LYS HA H 65 5.347 5.152 0.195 1 1 727 . 8 1 1 A 65 65 LYS C C 65 175.811 175.536 0.275 1 1 728 . 8 1 1 A 65 65 LYS CA C 65 55.817 55.403 0.414 1 1 729 . 8 1 1 A 65 65 LYS CB C 65 34.521 34.670 -0.149 1 1 733 . 8 1 1 A 65 65 LYS N N 65 129.874 128.679 1.195 1 1 734 . 8 1 1 A 66 66 CYS H H 66 9.129 9.441 -0.312 1 1 735 . 8 1 1 A 66 66 CYS HA H 66 5.319 5.204 0.115 1 1 738 . 8 1 1 A 66 66 CYS CA C 66 54.532 56.817 -2.285 1 1 739 . 8 1 1 A 66 66 CYS CB C 66 28.813 29.740 -0.927 1 1 740 . 8 1 1 A 66 66 CYS N N 66 121.497 124.944 -3.447 1 1 741 . 8 1 1 A 67 67 PRO HA H 67 4.439 3.968 0.471 1 1 748 . 8 1 1 A 67 67 PRO C C 67 177.297 177.670 -0.373 1 1 749 . 8 1 1 A 67 67 PRO CA C 67 63.596 62.968 0.628 1 1 750 . 8 1 1 A 67 67 PRO CB C 67 32.242 30.835 1.407 1 1 752 . 8 1 1 A 68 68 GLY H H 68 8.316 8.800 -0.484 1 1 753 . 8 1 1 A 68 68 GLY HA2 H 68 3.726 3.814 -0.088 1 1 754 . 8 1 1 A 68 68 GLY HA3 H 68 4.095 3.903 0.192 1 1 755 . 8 1 1 A 68 68 GLY C C 68 173.789 174.273 -0.484 1 1 756 . 8 1 1 A 68 68 GLY CA C 68 45.227 45.825 -0.598 1 1 757 . 8 1 1 A 68 68 GLY N N 68 109.533 109.542 -0.009 1 1 758 . 8 1 1 A 69 69 VAL H H 69 8.114 7.625 0.489 1 1 759 . 8 1 1 A 69 69 VAL HA H 69 4.266 4.004 0.262 1 1 764 . 8 1 1 A 69 69 VAL C C 69 176.299 175.757 0.542 1 1 765 . 8 1 1 A 69 69 VAL CA C 69 61.945 63.051 -1.106 1 1 766 . 8 1 1 A 69 69 VAL CB C 69 33.082 31.241 1.841 1 1 768 . 8 1 1 A 69 69 VAL N N 69 118.540 120.465 -1.925 1 1 769 . 8 1 1 A 70 70 THR H H 70 8.324 8.591 -0.267 1 1 770 . 8 1 1 A 70 70 THR HA H 70 4.373 3.881 0.492 1 1 775 . 8 1 1 A 70 70 THR C C 70 175.204 176.324 -1.120 1 1 776 . 8 1 1 A 70 70 THR CA C 70 62.309 66.596 -4.287 1 1 777 . 8 1 1 A 70 70 THR CB C 70 69.787 68.348 1.439 1 1 779 . 8 1 1 A 70 70 THR N N 70 117.636 121.260 -3.624 1 1 780 . 8 1 1 A 71 71 GLY H H 71 8.574 7.903 0.671 1 1 781 . 8 1 1 A 71 71 GLY HA2 H 71 4.096 3.962 0.134 1 1 782 . 8 1 1 A 71 71 GLY HA3 H 71 3.975 3.966 0.009 1 1 783 . 8 1 1 A 71 71 GLY C C 71 174.313 173.285 1.028 1 1 784 . 8 1 1 A 71 71 GLY CA C 71 45.545 45.200 0.345 1 1 785 . 8 1 1 A 71 71 GLY N N 71 111.677 108.101 3.576 1 1 786 . 8 1 1 A 72 72 VAL H H 72 7.945 7.788 0.157 1 1 787 . 8 1 1 A 72 72 VAL HA H 72 4.258 3.739 0.519 1 1 795 . 8 1 1 A 72 72 VAL C C 72 176.162 174.579 1.583 1 1 796 . 8 1 1 A 72 72 VAL CA C 72 62.227 62.736 -0.509 1 1 797 . 8 1 1 A 72 72 VAL CB C 72 32.997 30.206 2.791 1 1 799 . 8 1 1 A 72 72 VAL N N 72 118.647 117.067 1.580 1 1 800 . 8 1 1 A 73 73 SER H H 73 8.498 8.018 0.480 1 1 801 . 8 1 1 A 73 73 SER HA H 73 4.617 4.875 -0.258 1 1 803 . 8 1 1 A 73 73 SER C C 73 174.461 174.419 0.042 1 1 804 . 8 1 1 A 73 73 SER CA C 73 58.218 57.498 0.720 1 1 805 . 8 1 1 A 73 73 SER CB C 73 64.061 65.215 -1.154 1 1 806 . 8 1 1 A 73 73 SER N N 73 118.828 116.234 2.594 1 1 807 . 8 1 1 A 74 74 GLY H H 74 8.247 8.309 -0.062 1 1 808 . 8 1 1 A 74 74 GLY HA2 H 74 4.101 4.013 0.088 1 1 809 . 8 1 1 A 74 74 GLY HA3 H 74 4.304 4.014 0.290 1 1 810 . 8 1 1 A 74 74 GLY CA C 74 44.896 44.137 0.759 1 1 811 . 8 1 1 A 74 74 GLY N N 74 111.138 112.458 -1.320 1 1 812 . 8 1 1 A 75 75 PRO HA H 75 4.461 4.646 -0.185 1 1 819 . 8 1 1 A 75 75 PRO C C 75 176.798 175.918 0.880 1 1 820 . 8 1 1 A 75 75 PRO CA C 75 63.466 62.466 1.000 1 1 821 . 8 1 1 A 75 75 PRO CB C 75 31.980 33.186 -1.206 1 1 824 . 8 1 1 A 76 76 HIS H H 76 8.397 8.545 -0.148 1 1 825 . 8 1 1 A 76 76 HIS HA H 76 4.742 5.034 -0.292 1 1 829 . 8 1 1 A 76 76 HIS C C 76 174.282 173.420 0.862 1 1 830 . 8 1 1 A 76 76 HIS CA C 76 55.579 54.676 0.903 1 1 831 . 8 1 1 A 76 76 HIS CB C 76 30.501 31.780 -1.279 1 1 832 . 8 1 1 A 76 76 HIS N N 76 118.431 121.003 -2.572 1 1 833 . 8 1 1 A 77 77 ASN H H 77 8.364 8.250 0.114 1 1 834 . 8 1 1 A 77 77 ASN HA H 77 4.767 4.942 -0.175 1 1 839 . 8 1 1 A 77 77 ASN C C 77 174.576 174.840 -0.264 1 1 840 . 8 1 1 A 77 77 ASN CA C 77 53.139 51.439 1.700 1 1 841 . 8 1 1 A 77 77 ASN CB C 77 39.320 39.439 -0.119 1 1 842 . 8 1 1 A 77 77 ASN N N 77 119.421 126.572 -7.151 1 1 844 . 8 1 1 A 78 78 GLU H H 78 8.683 8.777 -0.094 1 1 845 . 8 1 1 A 78 78 GLU HA H 78 4.409 4.035 0.374 1 1 850 . 8 1 1 A 78 78 GLU C C 78 175.791 174.254 1.537 1 1 851 . 8 1 1 A 78 78 GLU CA C 78 56.359 58.447 -2.088 1 1 852 . 8 1 1 A 78 78 GLU CB C 78 30.818 28.226 2.592 1 1 854 . 8 1 1 A 78 78 GLU N N 78 122.085 124.850 -2.765 1 1 855 . 8 1 1 A 79 79 TYR H H 79 8.341 8.773 -0.432 1 1 856 . 8 1 1 A 79 79 TYR HA H 79 4.988 5.431 -0.443 1 1 861 . 8 1 1 A 79 79 TYR C C 79 175.837 175.016 0.821 1 1 862 . 8 1 1 A 79 79 TYR CA C 79 58.028 56.768 1.260 1 1 863 . 8 1 1 A 79 79 TYR CB C 79 41.672 41.060 0.612 1 1 866 . 8 1 1 A 79 79 TYR N N 79 119.452 121.689 -2.237 1 1 867 . 8 1 1 A 80 80 VAL H H 80 9.366 9.286 0.080 1 1 868 . 8 1 1 A 80 80 VAL HA H 80 4.370 5.011 -0.641 1 1 873 . 8 1 1 A 80 80 VAL C C 80 174.948 175.334 -0.386 1 1 874 . 8 1 1 A 80 80 VAL CA C 80 61.190 60.664 0.526 1 1 875 . 8 1 1 A 80 80 VAL CB C 80 34.204 34.739 -0.535 1 1 877 . 8 1 1 A 80 80 VAL N N 80 120.567 123.249 -2.682 1 1 878 . 8 1 1 A 81 81 GLU H H 81 8.570 9.169 -0.599 1 1 879 . 8 1 1 A 81 81 GLU HA H 81 4.770 5.677 -0.907 1 1 883 . 8 1 1 A 81 81 GLU C C 81 175.491 175.587 -0.096 1 1 884 . 8 1 1 A 81 81 GLU CA C 81 55.655 54.748 0.907 1 1 885 . 8 1 1 A 81 81 GLU CB C 81 30.415 32.427 -2.012 1 1 887 . 8 1 1 A 81 81 GLU N N 81 124.248 124.116 0.132 1 1 888 . 8 1 1 A 82 82 VAL H H 82 9.189 8.891 0.298 1 1 889 . 8 1 1 A 82 82 VAL HA H 82 4.279 4.809 -0.530 1 1 894 . 8 1 1 A 82 82 VAL C C 82 176.087 175.929 0.158 1 1 895 . 8 1 1 A 82 82 VAL CA C 82 62.672 61.072 1.600 1 1 896 . 8 1 1 A 82 82 VAL CB C 82 33.121 33.588 -0.467 1 1 898 . 8 1 1 A 82 82 VAL N N 82 127.776 120.019 7.757 1 1 899 . 8 1 1 A 83 83 THR H H 83 8.590 8.637 -0.047 1 1 900 . 8 1 1 A 83 83 THR HA H 83 4.955 4.597 0.358 1 1 905 . 8 1 1 A 83 83 THR C C 83 174.688 174.843 -0.155 1 1 906 . 8 1 1 A 83 83 THR CA C 83 61.332 61.449 -0.117 1 1 907 . 8 1 1 A 83 83 THR CB C 83 70.213 69.749 0.464 1 1 909 . 8 1 1 A 83 83 THR N N 83 114.744 116.651 -1.907 1 1 910 . 8 1 1 A 84 84 SER H H 84 7.650 7.411 0.239 1 1 911 . 8 1 1 A 84 84 SER HA H 84 4.819 4.271 0.548 1 1 914 . 8 1 1 A 84 84 SER CA C 84 56.280 60.127 -3.847 1 1 915 . 8 1 1 A 84 84 SER CB C 84 63.294 63.401 -0.107 1 1 916 . 8 1 1 A 84 84 SER N N 84 118.038 118.971 -0.933 1 1 917 . 8 1 1 A 85 85 GLU H H 85 8.391 8.890 -0.499 1 1 918 . 8 1 1 A 85 85 GLU HA H 85 3.661 3.954 -0.293 1 1 923 . 8 1 1 A 85 85 GLU C C 85 177.520 178.494 -0.974 1 1 924 . 8 1 1 A 85 85 GLU CA C 85 62.429 59.213 3.216 1 1 925 . 8 1 1 A 85 85 GLU CB C 85 29.655 29.523 0.132 1 1 927 . 8 1 1 A 86 86 ALA H H 86 8.443 8.127 0.316 1 1 928 . 8 1 1 A 86 86 ALA HA H 86 4.027 4.000 0.027 1 1 932 . 8 1 1 A 86 86 ALA C C 86 180.423 180.025 0.398 1 1 933 . 8 1 1 A 86 86 ALA CA C 86 55.145 54.719 0.426 1 1 934 . 8 1 1 A 86 86 ALA CB C 86 18.165 18.225 -0.060 1 1 935 . 8 1 1 A 86 86 ALA N N 86 119.636 122.907 -3.271 1 1 936 . 8 1 1 A 87 87 ALA H H 87 7.214 7.638 -0.424 1 1 937 . 8 1 1 A 87 87 ALA HA H 87 4.244 4.004 0.240 1 1 941 . 8 1 1 A 87 87 ALA C C 87 180.354 179.805 0.549 1 1 942 . 8 1 1 A 87 87 ALA CA C 87 54.378 54.923 -0.545 1 1 943 . 8 1 1 A 87 87 ALA CB C 87 18.795 18.302 0.493 1 1 944 . 8 1 1 A 87 87 ALA N N 87 121.004 120.237 0.767 1 1 945 . 8 1 1 A 88 88 ILE H H 88 8.471 7.562 0.909 1 1 946 . 8 1 1 A 88 88 ILE HA H 88 3.360 3.585 -0.225 1 1 954 . 8 1 1 A 88 88 ILE CA C 88 66.323 64.720 1.603 1 1 955 . 8 1 1 A 88 88 ILE CB C 88 37.808 37.741 0.067 1 1 958 . 8 1 1 A 88 88 ILE N N 88 120.743 119.851 0.892 1 1 959 . 8 1 1 A 89 89 VAL H H 89 8.343 8.519 -0.176 1 1 960 . 8 1 1 A 89 89 VAL HA H 89 3.061 3.419 -0.358 1 1 968 . 8 1 1 A 89 89 VAL C C 89 176.708 177.806 -1.098 1 1 969 . 8 1 1 A 89 89 VAL CA C 89 67.833 66.499 1.334 1 1 970 . 8 1 1 A 89 89 VAL CB C 89 31.509 31.465 0.044 1 1 973 . 8 1 1 A 89 89 VAL N N 89 118.049 120.024 -1.975 1 1 974 . 8 1 1 A 90 90 ALA H H 90 7.516 7.828 -0.312 1 1 975 . 8 1 1 A 90 90 ALA HA H 90 3.987 3.798 0.189 1 1 979 . 8 1 1 A 90 90 ALA C C 90 180.744 179.027 1.717 1 1 980 . 8 1 1 A 90 90 ALA CA C 90 55.481 55.428 0.053 1 1 981 . 8 1 1 A 90 90 ALA CB C 90 17.953 17.636 0.317 1 1 982 . 8 1 1 A 90 90 ALA N N 90 118.935 121.650 -2.715 1 1 983 . 8 1 1 A 91 91 GLN H H 91 7.886 8.055 -0.169 1 1 984 . 8 1 1 A 91 91 GLN HA H 91 4.190 3.997 0.193 1 1 991 . 8 1 1 A 91 91 GLN C C 91 178.832 178.424 0.408 1 1 992 . 8 1 1 A 91 91 GLN CA C 91 58.519 58.806 -0.287 1 1 993 . 8 1 1 A 91 91 GLN CB C 91 28.091 28.254 -0.163 1 1 995 . 8 1 1 A 91 91 GLN N N 91 117.846 118.042 -0.196 1 1 997 . 8 1 1 A 92 92 LEU H H 92 8.751 8.799 -0.048 1 1 998 . 8 1 1 A 92 92 LEU HA H 92 3.903 3.923 -0.020 1 1 1007 . 8 1 1 A 92 92 LEU C C 92 178.997 179.022 -0.025 1 1 1008 . 8 1 1 A 92 92 LEU CA C 92 58.136 57.806 0.330 1 1 1009 . 8 1 1 A 92 92 LEU CB C 92 41.576 41.461 0.115 1 1 1013 . 8 1 1 A 92 92 LEU N N 92 119.547 119.848 -0.301 1 1 1014 . 8 1 1 A 93 93 PHE H H 93 8.648 7.966 0.682 1 1 1015 . 8 1 1 A 93 93 PHE HA H 93 4.270 4.308 -0.038 1 1 1020 . 8 1 1 A 93 93 PHE C C 93 179.283 178.759 0.524 1 1 1021 . 8 1 1 A 93 93 PHE CA C 93 59.860 60.254 -0.394 1 1 1022 . 8 1 1 A 93 93 PHE CB C 93 37.765 38.206 -0.441 1 1 1025 . 8 1 1 A 93 93 PHE N N 93 118.041 119.026 -0.985 1 1 1026 . 8 1 1 A 94 94 GLU H H 94 7.739 8.274 -0.535 1 1 1027 . 8 1 1 A 94 94 GLU HA H 94 4.110 4.115 -0.005 1 1 1031 . 8 1 1 A 94 94 GLU C C 94 178.629 178.832 -0.203 1 1 1032 . 8 1 1 A 94 94 GLU CA C 94 59.359 59.387 -0.028 1 1 1033 . 8 1 1 A 94 94 GLU CB C 94 29.589 28.890 0.699 1 1 1035 . 8 1 1 A 94 94 GLU N N 94 119.980 117.134 2.846 1 1 1036 . 8 1 1 A 95 95 LEU H H 95 7.999 8.332 -0.333 1 1 1037 . 8 1 1 A 95 95 LEU HA H 95 4.139 3.962 0.177 1 1 1047 . 8 1 1 A 95 95 LEU C C 95 178.965 178.553 0.412 1 1 1048 . 8 1 1 A 95 95 LEU CA C 95 57.557 57.958 -0.401 1 1 1049 . 8 1 1 A 95 95 LEU CB C 95 43.443 41.387 2.056 1 1 1053 . 8 1 1 A 95 95 LEU N N 95 118.398 121.619 -3.221 1 1 1054 . 8 1 1 A 96 96 LEU H H 96 8.363 7.926 0.437 1 1 1055 . 8 1 1 A 96 96 LEU HA H 96 4.503 4.282 0.221 1 1 1061 . 8 1 1 A 96 96 LEU C C 96 177.932 177.182 0.750 1 1 1062 . 8 1 1 A 96 96 LEU CA C 96 54.700 54.970 -0.270 1 1 1063 . 8 1 1 A 96 96 LEU CB C 96 43.048 42.365 0.683 1 1 1065 . 8 1 1 A 96 96 LEU N N 96 114.720 116.497 -1.777 1 1 1066 . 8 1 1 A 97 97 GLY H H 97 7.810 7.587 0.223 1 1 1067 . 8 1 1 A 97 97 GLY HA2 H 97 3.963 3.889 0.074 1 1 1068 . 8 1 1 A 97 97 GLY C C 97 173.535 174.531 -0.996 1 1 1069 . 8 1 1 A 97 97 GLY CA C 97 45.667 46.360 -0.693 1 1 1070 . 8 1 1 A 97 97 GLY N N 97 109.511 107.369 2.142 1 1 1071 . 8 1 1 A 98 98 SER H H 98 8.131 8.380 -0.249 1 1 1072 . 8 1 1 A 98 98 SER HA H 98 4.225 4.607 -0.382 1 1 1075 . 8 1 1 A 98 98 SER C C 98 174.974 174.745 0.229 1 1 1076 . 8 1 1 A 98 98 SER CA C 98 57.960 56.858 1.102 1 1 1077 . 8 1 1 A 98 98 SER CB C 98 63.997 63.867 0.130 1 1 1078 . 8 1 1 A 98 98 SER N N 98 113.405 115.628 -2.223 1 1 1079 . 8 1 1 A 99 99 GLY H H 99 8.052 8.470 -0.418 1 1 1080 . 8 1 1 A 99 99 GLY HA2 H 99 3.998 4.208 -0.210 1 1 1081 . 8 1 1 A 99 99 GLY HA3 H 99 3.778 4.253 -0.475 1 1 1082 . 8 1 1 A 99 99 GLY C C 99 174.033 173.790 0.243 1 1 1083 . 8 1 1 A 99 99 GLY CA C 99 45.123 45.715 -0.592 1 1 1084 . 8 1 1 A 99 99 GLY N N 99 111.534 113.429 -1.895 1 1 1085 . 8 1 1 A 100 100 GLU H H 100 8.177 7.327 0.850 1 1 1086 . 8 1 1 A 100 100 GLU HA H 100 4.201 4.439 -0.238 1 1 1091 . 8 1 1 A 100 100 GLU C C 100 175.830 176.268 -0.438 1 1 1092 . 8 1 1 A 100 100 GLU CA C 100 56.442 55.145 1.297 1 1 1093 . 8 1 1 A 100 100 GLU CB C 100 30.428 31.665 -1.237 1 1 1095 . 8 1 1 A 100 100 GLU N N 100 120.463 122.086 -1.623 1 1 1096 . 8 1 1 A 101 101 GLN H H 101 8.161 8.406 -0.245 1 1 1097 . 8 1 1 A 101 101 GLN HA H 101 4.098 4.269 -0.171 1 1 1103 . 8 1 1 A 101 101 GLN C C 101 175.412 175.354 0.058 1 1 1104 . 8 1 1 A 101 101 GLN CA C 101 55.632 56.273 -0.641 1 1 1105 . 8 1 1 A 101 101 GLN CB C 101 29.569 28.963 0.606 1 1 1107 . 8 1 1 A 101 101 GLN N N 101 120.014 121.378 -1.364 1 1 1109 . 8 1 1 A 102 102 LYS H H 102 8.235 8.608 -0.373 1 1 1110 . 8 1 1 A 102 102 LYS HA H 102 4.387 3.971 0.416 1 1 1117 . 8 1 1 A 102 102 LYS CA C 102 54.116 53.906 0.210 1 1 1118 . 8 1 1 A 102 102 LYS CB C 102 32.478 32.804 -0.326 1 1 1122 . 8 1 1 A 102 102 LYS N N 102 123.399 125.996 -2.597 1 1 1123 . 8 1 1 A 103 103 PRO HA H 103 4.498 4.397 0.101 1 1 1129 . 8 1 1 A 103 103 PRO C C 103 175.473 176.989 -1.516 1 1 1130 . 8 1 1 A 103 103 PRO CA C 103 62.802 66.055 -3.253 1 1 1131 . 8 1 1 A 103 103 PRO CB C 103 32.124 31.299 0.825 1 1 1134 . 8 1 1 A 104 104 ALA H H 104 8.017 7.551 0.466 1 1 1135 . 8 1 1 A 104 104 ALA HA H 104 4.318 4.351 -0.033 1 1 1139 . 8 1 1 A 104 104 ALA C C 104 176.717 176.812 -0.095 1 1 1140 . 8 1 1 A 104 104 ALA CA C 104 52.194 53.132 -0.938 1 1 1141 . 8 1 1 A 104 104 ALA CB C 104 20.113 20.848 -0.735 1 1 1142 . 8 1 1 A 104 104 ALA N N 104 122.093 118.218 3.875 1 1 1143 . 8 1 1 A 105 105 GLY H H 105 7.678 8.109 -0.431 1 1 1144 . 8 1 1 A 105 105 GLY HA2 H 105 3.851 4.015 -0.164 1 1 1145 . 8 1 1 A 105 105 GLY HA3 H 105 4.053 4.043 0.010 1 1 1146 . 8 1 1 A 105 105 GLY C C 105 172.990 174.807 -1.817 1 1 1147 . 8 1 1 A 105 105 GLY CA C 105 44.241 43.538 0.703 1 1 1148 . 8 1 1 A 105 105 GLY N N 105 105.234 106.552 -1.318 1 1 1149 . 8 1 1 A 106 106 VAL H H 106 8.409 8.834 -0.425 1 1 1150 . 8 1 1 A 106 106 VAL HA H 106 2.829 3.282 -0.453 1 1 1158 . 8 1 1 A 106 106 VAL C C 106 177.822 177.199 0.623 1 1 1159 . 8 1 1 A 106 106 VAL CA C 106 65.522 65.435 0.087 1 1 1160 . 8 1 1 A 106 106 VAL CB C 106 30.701 30.507 0.194 1 1 1163 . 8 1 1 A 106 106 VAL N N 106 119.215 119.986 -0.771 1 1 1164 . 8 1 1 A 107 107 ALA H H 107 8.707 8.300 0.407 1 1 1165 . 8 1 1 A 107 107 ALA HA H 107 3.730 3.928 -0.198 1 1 1169 . 8 1 1 A 107 107 ALA C C 107 179.661 179.564 0.097 1 1 1170 . 8 1 1 A 107 107 ALA CA C 107 54.995 55.133 -0.138 1 1 1171 . 8 1 1 A 107 107 ALA CB C 107 17.705 18.094 -0.389 1 1 1172 . 8 1 1 A 107 107 ALA N N 107 118.672 121.806 -3.134 1 1 1173 . 8 1 1 A 108 108 ALA H H 108 7.388 7.415 -0.027 1 1 1174 . 8 1 1 A 108 108 ALA HA H 108 4.259 4.065 0.194 1 1 1178 . 8 1 1 A 108 108 ALA C C 108 179.318 179.398 -0.080 1 1 1179 . 8 1 1 A 108 108 ALA CA C 108 53.481 55.056 -1.575 1 1 1180 . 8 1 1 A 108 108 ALA CB C 108 19.367 18.460 0.907 1 1 1181 . 8 1 1 A 108 108 ALA N N 108 116.635 119.895 -3.260 1 1 1182 . 8 1 1 A 109 109 VAL H H 109 7.689 7.336 0.353 1 1 1183 . 8 1 1 A 109 109 VAL HA H 109 4.532 3.832 0.700 1 1 1191 . 8 1 1 A 109 109 VAL C C 109 176.055 177.913 -1.858 1 1 1192 . 8 1 1 A 109 109 VAL CA C 109 61.452 65.691 -4.239 1 1 1193 . 8 1 1 A 109 109 VAL CB C 109 32.728 31.292 1.436 1 1 1196 . 8 1 1 A 109 109 VAL N N 109 112.851 117.018 -4.167 1 1 1197 . 8 1 1 A 110 110 LEU H H 110 7.099 8.166 -1.067 1 1 1198 . 8 1 1 A 110 110 LEU HA H 110 3.723 3.805 -0.082 1 1 1208 . 8 1 1 A 110 110 LEU C C 110 179.040 178.866 0.174 1 1 1209 . 8 1 1 A 110 110 LEU CA C 110 58.825 57.831 0.994 1 1 1210 . 8 1 1 A 110 110 LEU CB C 110 41.242 41.712 -0.470 1 1 1214 . 8 1 1 A 110 110 LEU N N 110 119.829 125.080 -5.251 1 1 1215 . 8 1 1 A 111 111 GLY H H 111 8.435 7.772 0.663 1 1 1216 . 8 1 1 A 111 111 GLY HA2 H 111 3.970 3.821 0.149 1 1 1217 . 8 1 1 A 111 111 GLY HA3 H 111 3.885 3.828 0.057 1 1 1218 . 8 1 1 A 111 111 GLY C C 111 178.031 176.965 1.066 1 1 1219 . 8 1 1 A 111 111 GLY CA C 111 46.961 47.553 -0.592 1 1 1220 . 8 1 1 A 111 111 GLY N N 111 104.089 106.606 -2.517 1 1 1221 . 8 1 1 A 112 112 SER H H 112 8.343 7.969 0.374 1 1 1222 . 8 1 1 A 112 112 SER HA H 112 4.266 4.184 0.082 1 1 1224 . 8 1 1 A 112 112 SER C C 112 175.885 175.468 0.417 1 1 1225 . 8 1 1 A 112 112 SER CA C 112 61.304 62.574 -1.270 1 1 1226 . 8 1 1 A 112 112 SER CB C 112 62.901 63.059 -0.158 1 1 1227 . 8 1 1 A 112 112 SER N N 112 119.497 119.579 -0.082 1 1 1228 . 8 1 1 A 113 113 LEU H H 113 7.667 8.038 -0.371 1 1 1229 . 8 1 1 A 113 113 LEU HA H 113 4.343 4.204 0.139 1 1 1238 . 8 1 1 A 113 113 LEU C C 113 174.760 175.975 -1.215 1 1 1239 . 8 1 1 A 113 113 LEU CA C 113 54.228 54.701 -0.473 1 1 1240 . 8 1 1 A 113 113 LEU CB C 113 41.467 42.010 -0.543 1 1 1244 . 8 1 1 A 113 113 LEU N N 113 118.843 117.720 1.123 1 1 1245 . 8 1 1 A 114 114 LYS H H 114 7.685 7.864 -0.179 1 1 1246 . 8 1 1 A 114 114 LYS HA H 114 3.958 3.883 0.075 1 1 1250 . 8 1 1 A 114 114 LYS C C 114 177.557 175.432 2.125 1 1 1251 . 8 1 1 A 114 114 LYS CA C 114 56.935 57.461 -0.526 1 1 1252 . 8 1 1 A 114 114 LYS CB C 114 28.898 29.514 -0.616 1 1 1254 . 8 1 1 A 114 114 LYS N N 114 114.072 116.638 -2.566 1 1 1255 . 8 1 1 A 115 115 LEU H H 115 8.329 7.973 0.356 1 1 1256 . 8 1 1 A 115 115 LEU HA H 115 4.315 4.333 -0.018 1 1 1265 . 8 1 1 A 115 115 LEU C C 115 175.988 176.334 -0.346 1 1 1266 . 8 1 1 A 115 115 LEU CA C 115 54.310 54.572 -0.262 1 1 1267 . 8 1 1 A 115 115 LEU CB C 115 44.163 41.816 2.347 1 1 1270 . 8 1 1 A 115 115 LEU N N 115 117.951 120.222 -2.271 1 1 1271 . 8 1 1 A 116 116 GLN H H 116 9.100 8.397 0.703 1 1 1272 . 8 1 1 A 116 116 GLN HA H 116 4.898 4.973 -0.075 1 1 1279 . 8 1 1 A 116 116 GLN CA C 116 53.467 55.304 -1.837 1 1 1280 . 8 1 1 A 116 116 GLN CB C 116 32.730 30.105 2.625 1 1 1282 . 8 1 1 A 116 116 GLN N N 116 119.994 124.516 -4.522 1 1 1284 . 8 1 1 A 117 117 GLU H H 117 8.849 8.544 0.305 1 1 1285 . 8 1 1 A 117 117 GLU HA H 117 3.707 4.283 -0.576 1 1 1290 . 8 1 1 A 117 117 GLU C C 117 177.303 176.797 0.506 1 1 1291 . 8 1 1 A 117 117 GLU CA C 117 57.233 56.428 0.805 1 1 1292 . 8 1 1 A 117 117 GLU CB C 117 29.634 29.250 0.384 1 1 1294 . 8 1 1 A 117 117 GLU N N 117 121.487 124.010 -2.523 1 1 1295 . 8 1 1 A 118 118 VAL H H 118 8.983 9.094 -0.111 1 1 1296 . 8 1 1 A 118 118 VAL HA H 118 4.360 4.124 0.236 1 1 1304 . 8 1 1 A 118 118 VAL C C 118 174.171 175.038 -0.867 1 1 1305 . 8 1 1 A 118 118 VAL CA C 118 61.772 62.636 -0.864 1 1 1306 . 8 1 1 A 118 118 VAL CB C 118 34.095 33.147 0.948 1 1 1309 . 8 1 1 A 118 118 VAL N N 118 122.933 128.575 -5.642 1 1 1310 . 8 1 1 A 119 119 ALA H H 119 7.023 7.030 -0.007 1 1 1311 . 8 1 1 A 119 119 ALA HA H 119 4.378 4.428 -0.050 1 1 1315 . 8 1 1 A 119 119 ALA C C 119 175.493 175.259 0.234 1 1 1316 . 8 1 1 A 119 119 ALA CA C 119 51.956 51.110 0.846 1 1 1317 . 8 1 1 A 119 119 ALA CB C 119 23.957 21.437 2.520 1 1 1318 . 8 1 1 A 119 119 ALA N N 119 117.379 122.614 -5.235 1 1 1319 . 8 1 1 A 120 120 SER H H 120 6.999 8.655 -1.656 1 1 1320 . 8 1 1 A 120 120 SER HA H 120 5.208 5.205 0.003 1 1 1323 . 8 1 1 A 120 120 SER C C 120 173.082 173.358 -0.276 1 1 1324 . 8 1 1 A 120 120 SER CA C 120 56.754 55.905 0.849 1 1 1325 . 8 1 1 A 120 120 SER CB C 120 64.605 65.737 -1.132 1 1 1326 . 8 1 1 A 120 120 SER N N 120 113.743 115.617 -1.874 1 1 1327 . 8 1 1 A 121 121 PHE H H 121 8.244 8.600 -0.356 1 1 1328 . 8 1 1 A 121 121 PHE HA H 121 5.177 5.344 -0.167 1 1 1333 . 8 1 1 A 121 121 PHE C C 121 173.569 172.152 1.417 1 1 1334 . 8 1 1 A 121 121 PHE CA C 121 55.555 56.091 -0.536 1 1 1335 . 8 1 1 A 121 121 PHE CB C 121 40.959 41.093 -0.134 1 1 1338 . 8 1 1 A 121 121 PHE N N 121 120.358 117.459 2.899 1 1 1339 . 8 1 1 A 122 122 ILE H H 122 8.907 8.799 0.108 1 1 1340 . 8 1 1 A 122 122 ILE HA H 122 4.682 4.880 -0.198 1 1 1348 . 8 1 1 A 122 122 ILE C C 122 176.925 175.067 1.858 1 1 1349 . 8 1 1 A 122 122 ILE CA C 122 60.740 59.813 0.927 1 1 1350 . 8 1 1 A 122 122 ILE CB C 122 39.497 41.075 -1.578 1 1 1353 . 8 1 1 A 122 122 ILE N N 122 121.282 120.021 1.261 1 1 1354 . 8 1 1 A 123 123 THR H H 123 9.022 9.036 -0.014 1 1 1355 . 8 1 1 A 123 123 THR HA H 123 5.039 4.755 0.284 1 1 1360 . 8 1 1 A 123 123 THR C C 123 173.531 173.886 -0.355 1 1 1361 . 8 1 1 A 123 123 THR CA C 123 62.266 61.854 0.412 1 1 1362 . 8 1 1 A 123 123 THR CB C 123 70.677 68.942 1.735 1 1 1364 . 8 1 1 A 123 123 THR N N 123 128.965 123.723 5.242 1 1 1365 . 8 1 1 A 124 124 THR H H 124 8.961 8.965 -0.004 1 1 1366 . 8 1 1 A 124 124 THR HA H 124 5.001 4.862 0.139 1 1 1371 . 8 1 1 A 124 124 THR C C 124 173.468 172.621 0.847 1 1 1372 . 8 1 1 A 124 124 THR CA C 124 62.109 61.743 0.366 1 1 1373 . 8 1 1 A 124 124 THR CB C 124 70.450 69.318 1.132 1 1 1375 . 8 1 1 A 124 124 THR N N 124 122.176 123.948 -1.772 1 1 1376 . 8 1 1 A 125 125 ARG H H 125 9.386 9.151 0.235 1 1 1377 . 8 1 1 A 125 125 ARG HA H 125 5.764 5.414 0.350 1 1 1384 . 8 1 1 A 125 125 ARG C C 125 175.713 175.059 0.654 1 1 1385 . 8 1 1 A 125 125 ARG CA C 125 53.991 54.494 -0.503 1 1 1386 . 8 1 1 A 125 125 ARG CB C 125 33.557 32.977 0.580 1 1 1389 . 8 1 1 A 125 125 ARG N N 125 130.004 129.240 0.764 1 1 1390 . 8 1 1 A 126 126 SER H H 126 9.172 9.350 -0.178 1 1 1391 . 8 1 1 A 126 126 SER HA H 126 5.390 5.166 0.224 1 1 1394 . 8 1 1 A 126 126 SER C C 126 172.359 173.376 -1.017 1 1 1395 . 8 1 1 A 126 126 SER CA C 126 56.934 57.686 -0.752 1 1 1396 . 8 1 1 A 126 126 SER CB C 126 65.827 65.912 -0.085 1 1 1397 . 8 1 1 A 126 126 SER N N 126 119.906 122.945 -3.039 1 1 1398 . 8 1 1 A 127 127 SER H H 127 8.591 9.416 -0.825 1 1 1399 . 8 1 1 A 127 127 SER HA H 127 5.739 5.788 -0.049 1 1 1401 . 8 1 1 A 127 127 SER C C 127 173.283 173.544 -0.261 1 1 1402 . 8 1 1 A 127 127 SER CA C 127 57.354 56.865 0.489 1 1 1403 . 8 1 1 A 127 127 SER CB C 127 65.412 64.786 0.626 1 1 1404 . 8 1 1 A 127 127 SER N N 127 117.914 119.868 -1.954 1 1 1405 . 8 1 1 A 128 128 TRP H H 128 9.866 10.125 -0.259 1 1 1406 . 8 1 1 A 128 128 TRP HA H 128 5.560 5.460 0.100 1 1 1415 . 8 1 1 A 128 128 TRP C C 128 175.828 175.694 0.134 1 1 1416 . 8 1 1 A 128 128 TRP CA C 128 55.852 55.649 0.203 1 1 1417 . 8 1 1 A 128 128 TRP CB C 128 32.524 32.017 0.507 1 1 1423 . 8 1 1 A 128 128 TRP N N 128 127.978 124.226 3.752 1 1 1425 . 8 1 1 A 129 129 LYS H H 129 9.424 9.271 0.153 1 1 1426 . 8 1 1 A 129 129 LYS HA H 129 5.388 5.392 -0.004 1 1 1433 . 8 1 1 A 129 129 LYS C C 129 175.254 174.830 0.424 1 1 1434 . 8 1 1 A 129 129 LYS CA C 129 54.410 54.666 -0.256 1 1 1435 . 8 1 1 A 129 129 LYS CB C 129 35.734 35.298 0.436 1 1 1439 . 8 1 1 A 129 129 LYS N N 129 121.784 121.195 0.589 1 1 1440 . 8 1 1 A 130 130 LEU H H 130 8.933 9.349 -0.416 1 1 1441 . 8 1 1 A 130 130 LEU HA H 130 4.859 5.016 -0.157 1 1 1447 . 8 1 1 A 130 130 LEU C C 130 173.893 174.041 -0.148 1 1 1448 . 8 1 1 A 130 130 LEU CA C 130 53.848 54.125 -0.277 1 1 1449 . 8 1 1 A 130 130 LEU CB C 130 46.125 45.911 0.214 1 1 1451 . 8 1 1 A 130 130 LEU N N 130 124.543 122.875 1.668 1 1 1452 . 8 1 1 A 131 131 ALA H H 131 8.816 8.668 0.148 1 1 1453 . 8 1 1 A 131 131 ALA HA H 131 4.776 4.719 0.057 1 1 1457 . 8 1 1 A 131 131 ALA C C 131 176.662 176.573 0.089 1 1 1458 . 8 1 1 A 131 131 ALA CA C 131 51.407 51.385 0.022 1 1 1459 . 8 1 1 A 131 131 ALA CB C 131 19.354 19.431 -0.077 1 1 1460 . 8 1 1 A 131 131 ALA N N 131 131.102 128.865 2.237 1 1 1461 . 8 1 1 A 132 132 LEU H H 132 8.487 9.078 -0.591 1 1 1462 . 8 1 1 A 132 132 LEU HA H 132 4.470 4.447 0.023 1 1 1470 . 8 1 1 A 132 132 LEU C C 132 176.873 175.848 1.025 1 1 1471 . 8 1 1 A 132 132 LEU CA C 132 54.590 55.410 -0.820 1 1 1472 . 8 1 1 A 132 132 LEU CB C 132 42.974 42.630 0.344 1 1 1475 . 8 1 1 A 132 132 LEU N N 132 123.724 127.673 -3.949 1 1 1476 . 8 1 1 A 133 133 SER H H 133 8.448 8.511 -0.063 1 1 1477 . 8 1 1 A 133 133 SER HA H 133 4.560 4.743 -0.183 1 1 1479 . 8 1 1 A 133 133 SER C C 133 176.043 173.823 2.220 1 1 1480 . 8 1 1 A 133 133 SER CA C 133 58.460 57.069 1.391 1 1 1481 . 8 1 1 A 133 133 SER CB C 133 63.985 63.276 0.709 1 1 1482 . 8 1 1 A 133 133 SER N N 133 115.880 122.186 -6.306 1 1 1483 . 8 1 1 A 134 134 GLY H H 134 8.232 8.669 -0.437 1 1 1484 . 8 1 1 A 134 134 GLY HA2 H 134 4.147 3.922 0.225 1 1 1485 . 8 1 1 A 134 134 GLY HA3 H 134 4.045 3.927 0.118 1 1 1486 . 8 1 1 A 134 134 GLY C C 134 174.013 174.354 -0.341 1 1 1487 . 8 1 1 A 134 134 GLY CA C 134 45.337 46.612 -1.275 1 1 1488 . 8 1 1 A 134 134 GLY N N 134 109.970 114.597 -4.627 1 1 1489 . 8 1 1 A 135 135 ALA H H 135 8.424 7.597 0.827 1 1 1490 . 8 1 1 A 135 135 ALA HA H 135 4.436 4.443 -0.007 1 1 1494 . 8 1 1 A 135 135 ALA C C 135 177.537 178.041 -0.504 1 1 1495 . 8 1 1 A 135 135 ALA CA C 135 52.721 51.316 1.405 1 1 1496 . 8 1 1 A 135 135 ALA CB C 135 19.265 18.638 0.627 1 1 1497 . 8 1 1 A 135 135 ALA N N 135 124.118 121.630 2.488 1 1 1498 . 8 1 1 A 136 136 HIS H H 136 8.466 8.160 0.306 1 1 1499 . 8 1 1 A 136 136 HIS HA H 136 4.379 4.717 -0.338 1 1 1500 . 8 1 1 A 136 136 HIS C C 136 176.259 174.892 1.367 1 1 1501 . 8 1 1 A 136 136 HIS CA C 136 56.082 57.312 -1.230 1 1 1502 . 8 1 1 A 136 136 HIS CB C 136 29.619 29.426 0.193 1 1 1503 . 8 1 1 A 136 136 HIS N N 136 119.493 114.295 5.198 1 1 1504 . 8 1 1 A 137 137 GLY H H 137 8.431 8.161 0.270 1 1 1505 . 8 1 1 A 137 137 GLY HA2 H 137 4.151 3.895 0.256 1 1 1506 . 8 1 1 A 137 137 GLY HA3 H 137 3.893 3.910 -0.017 1 1 1507 . 8 1 1 A 137 137 GLY C C 137 174.039 173.037 1.002 1 1 1508 . 8 1 1 A 137 137 GLY CA C 137 45.372 45.636 -0.264 1 1 1509 . 8 1 1 A 137 137 GLY N N 137 110.442 107.277 3.165 1 1 1510 . 8 1 1 A 138 138 GLN H H 138 8.416 8.467 -0.051 1 1 1511 . 8 1 1 A 138 138 GLN HA H 138 4.455 4.618 -0.163 1 1 1515 . 8 1 1 A 138 138 GLN C C 138 175.889 175.206 0.683 1 1 1516 . 8 1 1 A 138 138 GLN CA C 138 55.866 56.127 -0.261 1 1 1517 . 8 1 1 A 138 138 GLN CB C 138 29.639 29.285 0.354 1 1 1518 . 8 1 1 A 138 138 GLN N N 138 119.401 124.310 -4.909 1 1 1519 . 8 1 1 A 139 139 GLU H H 139 8.446 8.392 0.054 1 1 1520 . 8 1 1 A 139 139 GLU HA H 139 4.658 4.530 0.128 1 1 1524 . 8 1 1 A 139 139 GLU CA C 139 54.589 57.704 -3.115 1 1 1525 . 8 1 1 A 139 139 GLU CB C 139 29.733 32.056 -2.323 1 1 1527 . 8 1 1 A 139 139 GLU N N 139 123.136 124.716 -1.580 1 1 1528 . 8 1 1 A 140 140 PRO HA H 140 4.537 4.558 -0.021 1 1 1533 . 8 1 1 A 140 140 PRO C C 140 176.119 176.231 -0.112 1 1 1534 . 8 1 1 A 140 140 PRO CA C 140 63.220 63.048 0.172 1 1 1535 . 8 1 1 A 140 140 PRO CB C 140 31.936 31.625 0.311 1 1 1538 . 8 1 1 A 141 141 GLN H H 141 8.506 8.709 -0.203 1 1 1539 . 8 1 1 A 141 141 GLN HA H 141 4.650 4.930 -0.280 1 1 1546 . 8 1 1 A 141 141 GLN C C 141 175.811 175.734 0.077 1 1 1547 . 8 1 1 A 141 141 GLN CA C 141 55.912 55.615 0.297 1 1 1548 . 8 1 1 A 141 141 GLN CB C 141 30.241 30.357 -0.116 1 1 1550 . 8 1 1 A 141 141 GLN N N 141 120.422 123.189 -2.767 1 1 1551 . 8 1 1 A 142 142 LEU H H 142 8.842 9.277 -0.435 1 1 1552 . 8 1 1 A 142 142 LEU HA H 142 5.277 5.260 0.017 1 1 1562 . 8 1 1 A 142 142 LEU C C 142 176.839 175.278 1.561 1 1 1563 . 8 1 1 A 142 142 LEU CA C 142 53.927 52.925 1.002 1 1 1564 . 8 1 1 A 142 142 LEU CB C 142 44.527 46.382 -1.855 1 1 1568 . 8 1 1 A 142 142 LEU N N 142 123.692 120.226 3.466 1 1 1569 . 8 1 1 A 143 143 THR H H 143 9.025 9.019 0.006 1 1 1570 . 8 1 1 A 143 143 THR HA H 143 5.262 5.056 0.206 1 1 1575 . 8 1 1 A 143 143 THR C C 143 173.753 173.979 -0.226 1 1 1576 . 8 1 1 A 143 143 THR CA C 143 61.795 61.892 -0.097 1 1 1577 . 8 1 1 A 143 143 THR CB C 143 70.660 70.426 0.234 1 1 1579 . 8 1 1 A 143 143 THR N N 143 117.222 115.320 1.902 1 1 1580 . 8 1 1 A 144 144 ILE H H 144 9.353 10.235 -0.882 1 1 1581 . 8 1 1 A 144 144 ILE HA H 144 5.399 5.440 -0.041 1 1 1591 . 8 1 1 A 144 144 ILE C C 144 173.931 173.674 0.257 1 1 1592 . 8 1 1 A 144 144 ILE CA C 144 60.774 60.197 0.577 1 1 1593 . 8 1 1 A 144 144 ILE CB C 144 41.111 39.575 1.536 1 1 1597 . 8 1 1 A 144 144 ILE N N 144 126.383 128.287 -1.904 1 1 1598 . 8 1 1 A 145 145 ASP H H 145 9.214 9.327 -0.113 1 1 1599 . 8 1 1 A 145 145 ASP HA H 145 5.978 5.582 0.396 1 1 1601 . 8 1 1 A 145 145 ASP C C 145 175.441 174.896 0.545 1 1 1602 . 8 1 1 A 145 145 ASP CA C 145 53.035 52.436 0.599 1 1 1603 . 8 1 1 A 145 145 ASP CB C 145 44.153 44.250 -0.097 1 1 1604 . 8 1 1 A 145 145 ASP N N 145 127.981 128.755 -0.774 1 1 1605 . 8 1 1 A 146 146 LEU H H 146 9.387 10.011 -0.624 1 1 1606 . 8 1 1 A 146 146 LEU HA H 146 4.918 5.252 -0.334 1 1 1616 . 8 1 1 A 146 146 LEU C C 146 175.003 174.841 0.162 1 1 1617 . 8 1 1 A 146 146 LEU CA C 146 53.940 53.844 0.096 1 1 1618 . 8 1 1 A 146 146 LEU CB C 146 43.902 42.686 1.216 1 1 1622 . 8 1 1 A 146 146 LEU N N 146 123.532 127.661 -4.129 1 1 1623 . 8 1 1 A 147 147 ASP H H 147 8.676 8.655 0.021 1 1 1624 . 8 1 1 A 147 147 ASP HA H 147 5.205 5.203 0.002 1 1 1627 . 8 1 1 A 147 147 ASP C C 147 174.956 174.672 0.284 1 1 1628 . 8 1 1 A 147 147 ASP CA C 147 53.441 52.331 1.110 1 1 1629 . 8 1 1 A 147 147 ASP CB C 147 43.370 43.123 0.247 1 1 1630 . 8 1 1 A 147 147 ASP N N 147 125.499 125.894 -0.395 1 1 1631 . 8 1 1 A 148 148 SER H H 148 8.732 9.275 -0.543 1 1 1632 . 8 1 1 A 148 148 SER HA H 148 5.365 4.693 0.672 1 1 1634 . 8 1 1 A 148 148 SER C C 148 173.217 172.980 0.237 1 1 1635 . 8 1 1 A 148 148 SER CA C 148 56.334 56.100 0.234 1 1 1636 . 8 1 1 A 148 148 SER CB C 148 65.812 66.629 -0.817 1 1 1637 . 8 1 1 A 148 148 SER N N 148 118.623 118.954 -0.331 1 1 1638 . 8 1 1 A 149 149 ALA H H 149 8.937 8.994 -0.057 1 1 1639 . 8 1 1 A 149 149 ALA HA H 149 5.681 5.166 0.515 1 1 1643 . 8 1 1 A 149 149 ALA C C 149 178.894 177.710 1.184 1 1 1644 . 8 1 1 A 149 149 ALA CA C 149 49.996 50.164 -0.168 1 1 1645 . 8 1 1 A 149 149 ALA CB C 149 23.231 22.749 0.482 1 1 1646 . 8 1 1 A 149 149 ALA N N 149 123.952 121.606 2.346 1 1 1647 . 8 1 1 A 150 150 ASP H H 150 9.010 8.828 0.182 1 1 1648 . 8 1 1 A 150 150 ASP HA H 150 4.336 4.408 -0.072 1 1 1651 . 8 1 1 A 150 150 ASP C C 150 176.697 176.946 -0.249 1 1 1652 . 8 1 1 A 150 150 ASP CA C 150 56.543 57.190 -0.647 1 1 1653 . 8 1 1 A 150 150 ASP CB C 150 39.850 40.402 -0.552 1 1 1654 . 8 1 1 A 150 150 ASP N N 150 122.687 122.665 0.022 1 1 1655 . 8 1 1 A 151 151 PHE H H 151 7.295 8.131 -0.836 1 1 1656 . 8 1 1 A 151 151 PHE HA H 151 5.020 4.584 0.436 1 1 1661 . 8 1 1 A 151 151 PHE C C 151 174.756 176.358 -1.602 1 1 1662 . 8 1 1 A 151 151 PHE CA C 151 56.594 57.026 -0.432 1 1 1663 . 8 1 1 A 151 151 PHE CB C 151 37.765 38.183 -0.418 1 1 1666 . 8 1 1 A 151 151 PHE N N 151 113.928 120.522 -6.594 1 1 1667 . 8 1 1 A 152 152 GLY H H 152 7.786 8.429 -0.643 1 1 1668 . 8 1 1 A 152 152 GLY HA2 H 152 4.459 3.931 0.528 1 1 1669 . 8 1 1 A 152 152 GLY HA3 H 152 3.728 3.957 -0.229 1 1 1670 . 8 1 1 A 152 152 GLY C C 152 172.709 173.727 -1.018 1 1 1671 . 8 1 1 A 152 152 GLY CA C 152 46.106 45.795 0.311 1 1 1672 . 8 1 1 A 152 152 GLY N N 152 110.312 113.893 -3.581 1 1 1673 . 8 1 1 A 153 153 TYR H H 153 6.650 8.873 -2.223 1 1 1674 . 8 1 1 A 153 153 TYR HA H 153 4.508 4.493 0.015 1 1 1679 . 8 1 1 A 153 153 TYR C C 153 173.092 175.320 -2.228 1 1 1680 . 8 1 1 A 153 153 TYR CA C 153 57.464 58.672 -1.208 1 1 1681 . 8 1 1 A 153 153 TYR CB C 153 41.962 39.127 2.835 1 1 1684 . 8 1 1 A 153 153 TYR N N 153 121.977 121.957 0.020 1 1 1685 . 8 1 1 A 154 154 ALA H H 154 7.847 8.719 -0.872 1 1 1686 . 8 1 1 A 154 154 ALA HA H 154 5.144 4.474 0.670 1 1 1690 . 8 1 1 A 154 154 ALA C C 154 174.468 174.815 -0.347 1 1 1691 . 8 1 1 A 154 154 ALA CA C 154 51.776 51.276 0.500 1 1 1692 . 8 1 1 A 154 154 ALA CB C 154 21.747 21.811 -0.064 1 1 1693 . 8 1 1 A 154 154 ALA N N 154 130.258 130.335 -0.077 1 1 1694 . 8 1 1 A 155 155 VAL H H 155 8.733 9.009 -0.276 1 1 1695 . 8 1 1 A 155 155 VAL HA H 155 4.150 4.775 -0.625 1 1 1700 . 8 1 1 A 155 155 VAL C C 155 172.632 173.143 -0.511 1 1 1701 . 8 1 1 A 155 155 VAL CA C 155 61.451 59.100 2.351 1 1 1702 . 8 1 1 A 155 155 VAL CB C 155 35.883 35.549 0.334 1 1 1704 . 8 1 1 A 155 155 VAL N N 155 119.622 122.411 -2.789 1 1 1705 . 8 1 1 A 156 156 GLY H H 156 8.146 8.350 -0.204 1 1 1706 . 8 1 1 A 156 156 GLY HA2 H 156 5.125 2.925 2.200 1 1 1707 . 8 1 1 A 156 156 GLY HA3 H 156 2.061 4.003 -1.942 1 1 1708 . 8 1 1 A 156 156 GLY C C 156 171.746 171.407 0.339 1 1 1709 . 8 1 1 A 156 156 GLY CA C 156 43.319 43.882 -0.563 1 1 1710 . 8 1 1 A 156 156 GLY N N 156 113.332 113.062 0.270 1 1 1711 . 8 1 1 A 157 157 GLU H H 157 8.967 9.273 -0.306 1 1 1712 . 8 1 1 A 157 157 GLU HA H 157 5.217 5.030 0.187 1 1 1716 . 8 1 1 A 157 157 GLU C C 157 174.476 175.565 -1.089 1 1 1717 . 8 1 1 A 157 157 GLU CA C 157 55.390 55.069 0.321 1 1 1718 . 8 1 1 A 157 157 GLU CB C 157 34.010 32.377 1.633 1 1 1720 . 8 1 1 A 157 157 GLU N N 157 120.823 123.553 -2.730 1 1 1721 . 8 1 1 A 158 158 VAL H H 158 9.076 9.388 -0.312 1 1 1722 . 8 1 1 A 158 158 VAL HA H 158 5.206 4.666 0.540 1 1 1727 . 8 1 1 A 158 158 VAL C C 158 173.900 174.202 -0.302 1 1 1728 . 8 1 1 A 158 158 VAL CA C 158 60.813 61.865 -1.052 1 1 1729 . 8 1 1 A 158 158 VAL CB C 158 33.385 32.908 0.477 1 1 1731 . 8 1 1 A 158 158 VAL N N 158 124.349 125.576 -1.227 1 1 1732 . 8 1 1 A 159 159 GLU H H 159 9.239 9.545 -0.306 1 1 1733 . 8 1 1 A 159 159 GLU HA H 159 5.647 5.044 0.603 1 1 1738 . 8 1 1 A 159 159 GLU C C 159 174.469 175.038 -0.569 1 1 1739 . 8 1 1 A 159 159 GLU CA C 159 54.473 54.765 -0.292 1 1 1740 . 8 1 1 A 159 159 GLU CB C 159 33.852 32.360 1.492 1 1 1742 . 8 1 1 A 159 159 GLU N N 159 125.772 129.244 -3.472 1 1 1743 . 8 1 1 A 160 160 ALA H H 160 9.250 9.206 0.044 1 1 1744 . 8 1 1 A 160 160 ALA HA H 160 4.966 5.234 -0.268 1 1 1748 . 8 1 1 A 160 160 ALA C C 160 175.114 175.660 -0.546 1 1 1749 . 8 1 1 A 160 160 ALA CA C 160 50.644 50.668 -0.024 1 1 1750 . 8 1 1 A 160 160 ALA CB C 160 23.263 22.111 1.152 1 1 1751 . 8 1 1 A 160 160 ALA N N 160 125.092 129.460 -4.368 1 1 1752 . 8 1 1 A 161 161 MET H H 161 8.559 8.922 -0.363 1 1 1753 . 8 1 1 A 161 161 MET HA H 161 5.468 5.925 -0.457 1 1 1761 . 8 1 1 A 161 161 MET C C 161 176.265 175.101 1.164 1 1 1762 . 8 1 1 A 161 161 MET CA C 161 53.818 54.106 -0.288 1 1 1763 . 8 1 1 A 161 161 MET CB C 161 34.380 34.175 0.205 1 1 1766 . 8 1 1 A 161 161 MET N N 161 118.699 121.045 -2.346 1 1 1767 . 8 1 1 A 162 162 VAL H H 162 9.046 9.285 -0.239 1 1 1768 . 8 1 1 A 162 162 VAL HA H 162 4.841 4.814 0.027 1 1 1776 . 8 1 1 A 162 162 VAL C C 162 174.794 176.073 -1.279 1 1 1777 . 8 1 1 A 162 162 VAL CA C 162 59.107 60.181 -1.074 1 1 1778 . 8 1 1 A 162 162 VAL CB C 162 34.018 34.444 -0.426 1 1 1781 . 8 1 1 A 162 162 VAL N N 162 116.435 118.342 -1.907 1 1 1782 . 8 1 1 A 163 163 HIS H H 163 8.793 8.756 0.037 1 1 1783 . 8 1 1 A 163 163 HIS HA H 163 4.717 4.483 0.234 1 1 1787 . 8 1 1 A 163 163 HIS C C 163 175.460 174.572 0.888 1 1 1788 . 8 1 1 A 163 163 HIS CA C 163 58.488 57.748 0.740 1 1 1789 . 8 1 1 A 163 163 HIS CB C 163 31.185 30.788 0.397 1 1 1791 . 8 1 1 A 163 163 HIS N N 163 117.838 122.099 -4.261 1 1 1792 . 8 1 1 A 164 164 GLU H H 164 8.013 7.606 0.407 1 1 1793 . 8 1 1 A 164 164 GLU HA H 164 4.814 4.557 0.257 1 1 1797 . 8 1 1 A 164 164 GLU C C 164 176.910 176.315 0.595 1 1 1798 . 8 1 1 A 164 164 GLU CA C 164 54.355 54.427 -0.072 1 1 1799 . 8 1 1 A 164 164 GLU CB C 164 32.886 32.562 0.324 1 1 1801 . 8 1 1 A 164 164 GLU N N 164 115.943 114.910 1.033 1 1 1802 . 8 1 1 A 165 165 LYS H H 165 9.088 8.816 0.272 1 1 1803 . 8 1 1 A 165 165 LYS HA H 165 3.942 3.926 0.016 1 1 1809 . 8 1 1 A 165 165 LYS C C 165 179.657 177.859 1.798 1 1 1810 . 8 1 1 A 165 165 LYS CA C 165 59.888 58.355 1.533 1 1 1811 . 8 1 1 A 165 165 LYS CB C 165 32.024 32.283 -0.259 1 1 1814 . 8 1 1 A 165 165 LYS N N 165 124.120 121.544 2.576 1 1 1815 . 8 1 1 A 166 166 ALA H H 166 8.851 8.003 0.848 1 1 1816 . 8 1 1 A 166 166 ALA HA H 166 4.251 4.081 0.170 1 1 1820 . 8 1 1 A 166 166 ALA C C 166 178.920 178.498 0.422 1 1 1821 . 8 1 1 A 166 166 ALA CA C 166 54.318 54.466 -0.148 1 1 1822 . 8 1 1 A 166 166 ALA CB C 166 18.810 18.176 0.634 1 1 1823 . 8 1 1 A 166 166 ALA N N 166 120.424 122.050 -1.626 1 1 1824 . 8 1 1 A 167 167 GLU H H 167 7.871 7.440 0.431 1 1 1825 . 8 1 1 A 167 167 GLU HA H 167 4.404 4.337 0.067 1 1 1829 . 8 1 1 A 167 167 GLU C C 167 177.368 178.389 -1.021 1 1 1830 . 8 1 1 A 167 167 GLU CA C 167 56.701 57.189 -0.488 1 1 1831 . 8 1 1 A 167 167 GLU CB C 167 31.208 30.139 1.069 1 1 1833 . 8 1 1 A 167 167 GLU N N 167 114.926 116.936 -2.010 1 1 1834 . 8 1 1 A 168 168 VAL H H 168 7.812 7.650 0.162 1 1 1835 . 8 1 1 A 168 168 VAL HA H 168 3.712 3.656 0.056 1 1 1843 . 8 1 1 A 168 168 VAL CA C 168 68.705 67.898 0.807 1 1 1844 . 8 1 1 A 168 168 VAL CB C 168 29.597 29.732 -0.135 1 1 1847 . 8 1 1 A 168 168 VAL N N 168 120.188 122.756 -2.568 1 1 1848 . 8 1 1 A 169 169 PRO HA H 169 4.252 4.263 -0.011 1 1 1851 . 8 1 1 A 169 169 PRO C C 169 179.563 178.684 0.879 1 1 1852 . 8 1 1 A 169 169 PRO CA C 169 67.077 66.651 0.426 1 1 1853 . 8 1 1 A 170 170 ALA H H 170 8.149 8.232 -0.083 1 1 1854 . 8 1 1 A 170 170 ALA HA H 170 4.265 4.064 0.201 1 1 1858 . 8 1 1 A 170 170 ALA C C 170 180.637 179.882 0.755 1 1 1859 . 8 1 1 A 170 170 ALA CA C 170 54.823 55.371 -0.548 1 1 1860 . 8 1 1 A 170 170 ALA CB C 170 18.518 18.014 0.504 1 1 1861 . 8 1 1 A 170 170 ALA N N 170 119.210 119.114 0.096 1 1 1862 . 8 1 1 A 171 171 ALA H H 171 7.767 8.434 -0.667 1 1 1863 . 8 1 1 A 171 171 ALA HA H 171 4.106 4.154 -0.048 1 1 1867 . 8 1 1 A 171 171 ALA C C 171 179.371 180.062 -0.691 1 1 1868 . 8 1 1 A 171 171 ALA CA C 171 55.130 54.932 0.198 1 1 1869 . 8 1 1 A 171 171 ALA CB C 171 18.291 18.043 0.248 1 1 1870 . 8 1 1 A 171 171 ALA N N 171 122.126 120.667 1.459 1 1 1871 . 8 1 1 A 172 172 LEU H H 172 8.950 8.062 0.888 1 1 1872 . 8 1 1 A 172 172 LEU HA H 172 3.987 4.113 -0.126 1 1 1878 . 8 1 1 A 172 172 LEU C C 172 178.355 178.723 -0.368 1 1 1879 . 8 1 1 A 172 172 LEU CA C 172 57.803 57.876 -0.073 1 1 1880 . 8 1 1 A 172 172 LEU CB C 172 41.667 41.560 0.107 1 1 1882 . 8 1 1 A 172 172 LEU N N 172 118.682 120.332 -1.650 1 1 1883 . 8 1 1 A 173 173 GLU H H 173 7.886 7.813 0.073 1 1 1884 . 8 1 1 A 173 173 GLU HA H 173 4.132 3.958 0.174 1 1 1887 . 8 1 1 A 173 173 GLU C C 173 179.556 179.601 -0.045 1 1 1888 . 8 1 1 A 173 173 GLU CA C 173 59.800 59.606 0.194 1 1 1889 . 8 1 1 A 173 173 GLU CB C 173 29.580 29.297 0.283 1 1 1891 . 8 1 1 A 173 173 GLU N N 173 117.561 118.768 -1.207 1 1 1892 . 8 1 1 A 174 174 LYS H H 174 7.532 7.730 -0.198 1 1 1893 . 8 1 1 A 174 174 LYS HA H 174 4.131 3.996 0.135 1 1 1901 . 8 1 1 A 174 174 LYS CA C 174 58.999 59.244 -0.245 1 1 1902 . 8 1 1 A 174 174 LYS CB C 174 32.041 32.241 -0.200 1 1 1906 . 8 1 1 A 174 174 LYS N N 174 119.085 119.281 -0.196 1 1 1907 . 8 1 1 A 175 175 ILE H H 175 8.479 8.285 0.194 1 1 1908 . 8 1 1 A 175 175 ILE HA H 175 3.583 3.607 -0.024 1 1 1918 . 8 1 1 A 175 175 ILE C C 175 179.258 178.504 0.754 1 1 1919 . 8 1 1 A 175 175 ILE CA C 175 65.769 65.685 0.084 1 1 1920 . 8 1 1 A 175 175 ILE CB C 175 37.876 37.963 -0.087 1 1 1923 . 8 1 1 A 175 175 ILE N N 175 118.828 120.291 -1.463 1 1 1924 . 8 1 1 A 176 176 ILE H H 176 8.928 8.045 0.883 1 1 1925 . 8 1 1 A 176 176 ILE HA H 176 3.600 3.644 -0.044 1 1 1935 . 8 1 1 A 176 176 ILE C C 176 178.827 178.402 0.425 1 1 1936 . 8 1 1 A 176 176 ILE CA C 176 65.640 64.886 0.754 1 1 1937 . 8 1 1 A 176 176 ILE CB C 176 37.451 37.173 0.278 1 1 1941 . 8 1 1 A 176 176 ILE N N 176 124.527 119.848 4.679 1 1 1942 . 8 1 1 A 177 177 THR H H 177 8.175 8.131 0.044 1 1 1943 . 8 1 1 A 177 177 THR HA H 177 3.885 3.935 -0.050 1 1 1948 . 8 1 1 A 177 177 THR C C 177 176.867 176.393 0.474 1 1 1949 . 8 1 1 A 177 177 THR CA C 177 67.199 66.325 0.874 1 1 1950 . 8 1 1 A 177 177 THR CB C 177 68.377 68.676 -0.299 1 1 1952 . 8 1 1 A 177 177 THR N N 177 119.412 118.740 0.672 1 1 1953 . 8 1 1 A 178 178 VAL H H 178 8.352 8.081 0.271 1 1 1954 . 8 1 1 A 178 178 VAL HA H 178 3.572 3.393 0.179 1 1 1962 . 8 1 1 A 178 178 VAL C C 178 177.664 177.650 0.014 1 1 1963 . 8 1 1 A 178 178 VAL CA C 178 66.909 66.276 0.633 1 1 1964 . 8 1 1 A 178 178 VAL CB C 178 31.714 31.287 0.427 1 1 1967 . 8 1 1 A 178 178 VAL N N 178 121.168 121.737 -0.569 1 1 1968 . 8 1 1 A 179 179 SER H H 179 8.529 8.250 0.279 1 1 1969 . 8 1 1 A 179 179 SER HA H 179 3.099 3.263 -0.164 1 1 1972 . 8 1 1 A 179 179 SER C C 179 175.380 176.389 -1.009 1 1 1973 . 8 1 1 A 179 179 SER CA C 179 62.728 61.525 1.203 1 1 1974 . 8 1 1 A 179 179 SER CB C 179 62.802 62.602 0.200 1 1 1975 . 8 1 1 A 179 179 SER N N 179 115.226 115.518 -0.292 1 1 1976 . 8 1 1 A 180 180 SER H H 180 7.757 8.213 -0.456 1 1 1977 . 8 1 1 A 180 180 SER HA H 180 4.419 4.282 0.137 1 1 1980 . 8 1 1 A 180 180 SER C C 180 175.359 177.124 -1.765 1 1 1981 . 8 1 1 A 180 180 SER CA C 180 61.025 61.272 -0.247 1 1 1982 . 8 1 1 A 180 180 SER CB C 180 63.072 63.152 -0.080 1 1 1983 . 8 1 1 A 180 180 SER N N 180 114.718 115.853 -1.135 1 1 1984 . 8 1 1 A 181 181 MET H H 181 7.497 7.644 -0.147 1 1 1985 . 8 1 1 A 181 181 MET HA H 181 4.283 4.219 0.064 1 1 1993 . 8 1 1 A 181 181 MET C C 181 177.217 177.211 0.006 1 1 1994 . 8 1 1 A 181 181 MET CA C 181 57.539 57.887 -0.348 1 1 1995 . 8 1 1 A 181 181 MET CB C 181 33.493 32.505 0.988 1 1 1998 . 8 1 1 A 181 181 MET N N 181 119.274 120.553 -1.279 1 1 1999 . 8 1 1 A 182 182 LEU H H 182 7.163 7.720 -0.557 1 1 2000 . 8 1 1 A 182 182 LEU HA H 182 4.133 4.346 -0.213 1 1 2010 . 8 1 1 A 182 182 LEU C C 182 176.289 176.888 -0.599 1 1 2011 . 8 1 1 A 182 182 LEU CA C 182 54.750 55.047 -0.297 1 1 2012 . 8 1 1 A 182 182 LEU CB C 182 43.235 42.983 0.252 1 1 2016 . 8 1 1 A 182 182 LEU N N 182 115.869 117.847 -1.978 1 1 2017 . 8 1 1 A 183 183 GLY H H 183 7.492 7.595 -0.103 1 1 2018 . 8 1 1 A 183 183 GLY HA2 H 183 4.086 4.121 -0.035 1 1 2019 . 8 1 1 A 183 183 GLY HA3 H 183 4.425 4.190 0.235 1 1 2020 . 8 1 1 A 183 183 GLY C C 183 171.830 171.652 0.178 1 1 2021 . 8 1 1 A 183 183 GLY CA C 183 46.035 46.163 -0.128 1 1 2022 . 8 1 1 A 183 183 GLY N N 183 107.761 105.035 2.726 1 1 2023 . 8 1 1 A 184 184 VAL H H 184 8.099 8.526 -0.427 1 1 2024 . 8 1 1 A 184 184 VAL HA H 184 4.772 4.758 0.014 1 1 2032 . 8 1 1 A 184 184 VAL CA C 184 59.305 58.805 0.500 1 1 2033 . 8 1 1 A 184 184 VAL CB C 184 33.648 35.399 -1.751 1 1 2036 . 8 1 1 A 184 184 VAL N N 184 119.803 121.373 -1.570 1 1 2037 . 8 1 1 A 185 185 PRO HA H 185 4.442 4.681 -0.239 1 1 2042 . 8 1 1 A 185 185 PRO C C 185 175.871 176.242 -0.371 1 1 2043 . 8 1 1 A 185 185 PRO CA C 185 63.886 62.788 1.098 1 1 2044 . 8 1 1 A 185 185 PRO CB C 185 32.260 32.360 -0.100 1 1 2047 . 8 1 1 A 186 186 ALA H H 186 8.222 8.999 -0.777 1 1 2048 . 8 1 1 A 186 186 ALA HA H 186 4.569 4.933 -0.364 1 1 2052 . 8 1 1 A 186 186 ALA C C 186 177.481 176.668 0.813 1 1 2053 . 8 1 1 A 186 186 ALA CA C 186 51.823 50.833 0.990 1 1 2054 . 8 1 1 A 186 186 ALA CB C 186 20.233 21.683 -1.450 1 1 2055 . 8 1 1 A 186 186 ALA N N 186 125.663 123.045 2.618 1 1 2056 . 8 1 1 A 187 187 GLN H H 187 8.723 9.050 -0.327 1 1 2057 . 8 1 1 A 187 187 GLN HA H 187 4.420 4.453 -0.033 1 1 2063 . 8 1 1 A 187 187 GLN C C 187 175.566 175.962 -0.396 1 1 2064 . 8 1 1 A 187 187 GLN CA C 187 56.051 57.422 -1.371 1 1 2065 . 8 1 1 A 187 187 GLN CB C 187 29.812 30.569 -0.757 1 1 2067 . 8 1 1 A 187 187 GLN N N 187 120.742 117.985 2.757 1 1 2069 . 8 1 1 A 188 188 GLU H H 188 8.163 7.994 0.169 1 1 2070 . 8 1 1 A 188 188 GLU HA H 188 4.405 4.065 0.340 1 1 2074 . 8 1 1 A 188 188 GLU C C 188 176.058 176.892 -0.834 1 1 2075 . 8 1 1 A 188 188 GLU CA C 188 56.158 57.333 -1.175 1 1 2076 . 8 1 1 A 188 188 GLU CB C 188 31.095 28.545 2.550 1 1 2078 . 8 1 1 A 188 188 GLU N N 188 119.177 119.633 -0.456 1 1 2079 . 8 1 1 A 189 189 GLU H H 189 8.567 8.616 -0.049 1 1 2080 . 8 1 1 A 189 189 GLU HA H 189 4.252 4.286 -0.034 1 1 2084 . 8 1 1 A 189 189 GLU C C 189 175.703 175.817 -0.114 1 1 2085 . 8 1 1 A 189 189 GLU CA C 189 56.417 55.610 0.807 1 1 2086 . 8 1 1 A 189 189 GLU CB C 189 29.968 28.828 1.140 1 1 2088 . 8 1 1 A 189 189 GLU N N 189 120.920 122.835 -1.915 1 1 2089 . 8 1 1 A 190 190 ALA H H 190 8.271 7.929 0.342 1 1 2090 . 8 1 1 A 190 190 ALA HA H 190 4.626 4.087 0.539 1 1 2094 . 8 1 1 A 190 190 ALA CA C 190 50.465 52.573 -2.108 1 1 2095 . 8 1 1 A 190 190 ALA CB C 190 18.451 17.740 0.711 1 1 2096 . 8 1 1 A 190 190 ALA N N 190 128.323 120.353 7.970 1 1 2097 . 8 1 1 A 191 191 PRO HA H 191 4.493 4.468 0.025 1 1 2103 . 8 1 1 A 191 191 PRO C C 191 175.899 176.776 -0.877 1 1 2104 . 8 1 1 A 191 191 PRO CA C 191 62.044 62.305 -0.261 1 1 2105 . 8 1 1 A 191 191 PRO CB C 191 32.184 32.148 0.036 1 1 2108 . 8 1 1 A 192 192 ALA H H 192 8.610 8.148 0.462 1 1 2109 . 8 1 1 A 192 192 ALA HA H 192 4.280 4.415 -0.135 1 1 2113 . 8 1 1 A 192 192 ALA C C 192 178.282 178.172 0.110 1 1 2114 . 8 1 1 A 192 192 ALA CA C 192 51.698 52.209 -0.511 1 1 2115 . 8 1 1 A 192 192 ALA CB C 192 19.220 19.483 -0.263 1 1 2116 . 8 1 1 A 192 192 ALA N N 192 123.420 124.257 -0.837 1 1 2117 . 8 1 1 A 193 193 LYS H H 193 8.531 8.905 -0.374 1 1 2118 . 8 1 1 A 193 193 LYS HA H 193 3.294 3.626 -0.332 1 1 2126 . 8 1 1 A 193 193 LYS C C 193 177.640 178.521 -0.881 1 1 2127 . 8 1 1 A 193 193 LYS CA C 193 60.644 59.196 1.448 1 1 2128 . 8 1 1 A 193 193 LYS CB C 193 32.607 31.657 0.950 1 1 2132 . 8 1 1 A 193 193 LYS N N 193 122.851 120.979 1.872 1 1 2133 . 8 1 1 A 194 194 LEU H H 194 8.570 7.817 0.753 1 1 2134 . 8 1 1 A 194 194 LEU HA H 194 3.845 4.170 -0.325 1 1 2144 . 8 1 1 A 194 194 LEU C C 194 177.965 178.537 -0.572 1 1 2145 . 8 1 1 A 194 194 LEU CA C 194 57.611 57.326 0.285 1 1 2146 . 8 1 1 A 194 194 LEU CB C 194 41.776 40.787 0.989 1 1 2150 . 8 1 1 A 194 194 LEU N N 194 115.801 121.415 -5.614 1 1 2151 . 8 1 1 A 195 195 MET H H 195 6.782 7.797 -1.015 1 1 2152 . 8 1 1 A 195 195 MET HA H 195 4.487 4.037 0.450 1 1 2160 . 8 1 1 A 195 195 MET C C 195 178.280 178.066 0.214 1 1 2161 . 8 1 1 A 195 195 MET CA C 195 56.858 57.910 -1.052 1 1 2162 . 8 1 1 A 195 195 MET CB C 195 31.557 32.096 -0.539 1 1 2165 . 8 1 1 A 195 195 MET N N 195 113.898 118.938 -5.040 1 1 2166 . 8 1 1 A 196 196 VAL H H 196 7.713 7.545 0.168 1 1 2167 . 8 1 1 A 196 196 VAL HA H 196 3.501 3.228 0.273 1 1 2175 . 8 1 1 A 196 196 VAL C C 196 177.624 177.528 0.096 1 1 2176 . 8 1 1 A 196 196 VAL CA C 196 66.318 66.029 0.289 1 1 2177 . 8 1 1 A 196 196 VAL CB C 196 31.380 31.263 0.117 1 1 2180 . 8 1 1 A 196 196 VAL N N 196 120.413 119.549 0.864 1 1 2181 . 8 1 1 A 197 197 TYR H H 197 7.972 7.741 0.231 1 1 2182 . 8 1 1 A 197 197 TYR HA H 197 3.145 3.288 -0.143 1 1 2187 . 8 1 1 A 197 197 TYR C C 197 177.726 176.873 0.853 1 1 2188 . 8 1 1 A 197 197 TYR CA C 197 62.253 61.431 0.822 1 1 2189 . 8 1 1 A 197 197 TYR CB C 197 37.314 38.648 -1.334 1 1 2192 . 8 1 1 A 197 197 TYR N N 197 119.543 120.508 -0.965 1 1 2193 . 8 1 1 A 198 198 LEU H H 198 8.630 7.757 0.873 1 1 2194 . 8 1 1 A 198 198 LEU HA H 198 3.923 3.794 0.129 1 1 2203 . 8 1 1 A 198 198 LEU C C 198 178.074 178.785 -0.711 1 1 2204 . 8 1 1 A 198 198 LEU CA C 198 58.294 57.708 0.586 1 1 2205 . 8 1 1 A 198 198 LEU CB C 198 42.177 41.452 0.725 1 1 2209 . 8 1 1 A 198 198 LEU N N 198 118.430 119.604 -1.174 1 1 2210 . 8 1 1 A 199 199 GLN H H 199 8.082 8.551 -0.469 1 1 2211 . 8 1 1 A 199 199 GLN HA H 199 3.054 3.730 -0.676 1 1 2216 . 8 1 1 A 199 199 GLN C C 199 176.875 178.138 -1.263 1 1 2217 . 8 1 1 A 199 199 GLN CA C 199 59.739 58.097 1.642 1 1 2218 . 8 1 1 A 199 199 GLN CB C 199 28.055 27.683 0.372 1 1 2220 . 8 1 1 A 199 199 GLN N N 199 117.926 117.114 0.812 1 1 2222 . 8 1 1 A 200 200 ARG H H 200 7.349 7.727 -0.378 1 1 2223 . 8 1 1 A 200 200 ARG HA H 200 3.798 3.912 -0.114 1 1 2231 . 8 1 1 A 200 200 ARG C C 200 178.037 178.035 0.002 1 1 2232 . 8 1 1 A 200 200 ARG CA C 200 58.260 58.708 -0.448 1 1 2233 . 8 1 1 A 200 200 ARG CB C 200 30.706 30.319 0.387 1 1 2236 . 8 1 1 A 200 200 ARG N N 200 113.772 120.026 -6.254 1 1 2238 . 8 1 1 A 201 201 PHE H H 201 8.329 7.663 0.666 1 1 2239 . 8 1 1 A 201 201 PHE HA H 201 4.630 4.498 0.132 1 1 2244 . 8 1 1 A 201 201 PHE C C 201 176.606 175.823 0.783 1 1 2245 . 8 1 1 A 201 201 PHE CA C 201 59.014 59.219 -0.205 1 1 2246 . 8 1 1 A 201 201 PHE CB C 201 40.357 40.517 -0.160 1 1 2249 . 8 1 1 A 201 201 PHE N N 201 114.182 116.510 -2.328 1 1 2250 . 8 1 1 A 202 202 ARG H H 202 8.719 7.733 0.986 1 1 2251 . 8 1 1 A 202 202 ARG HA H 202 5.071 4.788 0.283 1 1 2261 . 8 1 1 A 202 202 ARG CA C 202 53.956 54.011 -0.055 1 1 2262 . 8 1 1 A 202 202 ARG CB C 202 31.979 30.422 1.557 1 1 2264 . 8 1 1 A 202 202 ARG N N 202 120.115 118.273 1.842 1 1 2266 . 8 1 1 A 203 203 PRO HA H 203 4.348 4.504 -0.156 1 1 2271 . 8 1 1 A 203 203 PRO C C 203 179.736 178.297 1.439 1 1 2272 . 8 1 1 A 203 203 PRO CA C 203 65.674 65.077 0.597 1 1 2273 . 8 1 1 A 203 203 PRO CB C 203 31.717 32.316 -0.599 1 1 2275 . 8 1 1 A 204 204 LEU H H 204 8.875 7.604 1.271 1 1 2276 . 8 1 1 A 204 204 LEU HA H 204 4.291 4.048 0.243 1 1 2286 . 8 1 1 A 204 204 LEU C C 204 180.353 177.932 2.421 1 1 2287 . 8 1 1 A 204 204 LEU CA C 204 58.012 57.071 0.941 1 1 2288 . 8 1 1 A 204 204 LEU CB C 204 40.893 42.198 -1.305 1 1 2292 . 8 1 1 A 204 204 LEU N N 204 118.940 117.522 1.418 1 1 2293 . 8 1 1 A 205 205 ASP H H 205 7.541 8.446 -0.905 1 1 2294 . 8 1 1 A 205 205 ASP HA H 205 4.622 4.417 0.205 1 1 2297 . 8 1 1 A 205 205 ASP C C 205 177.602 177.992 -0.390 1 1 2298 . 8 1 1 A 205 205 ASP CA C 205 57.437 57.342 0.095 1 1 2299 . 8 1 1 A 205 205 ASP CB C 205 41.143 40.944 0.199 1 1 2300 . 8 1 1 A 205 205 ASP N N 205 120.838 119.428 1.410 1 1 2301 . 8 1 1 A 206 206 TYR H H 206 8.237 8.490 -0.253 1 1 2302 . 8 1 1 A 206 206 TYR HA H 206 4.018 4.077 -0.059 1 1 2307 . 8 1 1 A 206 206 TYR C C 206 176.433 177.439 -1.006 1 1 2308 . 8 1 1 A 206 206 TYR CA C 206 62.148 61.799 0.349 1 1 2309 . 8 1 1 A 206 206 TYR CB C 206 38.305 38.688 -0.383 1 1 2312 . 8 1 1 A 206 206 TYR N N 206 119.475 120.479 -1.004 1 1 2313 . 8 1 1 A 207 207 GLN H H 207 8.124 8.171 -0.047 1 1 2314 . 8 1 1 A 207 207 GLN HA H 207 3.823 3.505 0.318 1 1 2320 . 8 1 1 A 207 207 GLN C C 207 178.019 178.471 -0.452 1 1 2321 . 8 1 1 A 207 207 GLN CA C 207 58.841 58.648 0.193 1 1 2322 . 8 1 1 A 207 207 GLN CB C 207 28.208 27.994 0.214 1 1 2324 . 8 1 1 A 207 207 GLN N N 207 115.863 118.362 -2.499 1 1 2326 . 8 1 1 A 208 208 ARG H H 208 7.522 7.819 -0.297 1 1 2327 . 8 1 1 A 208 208 ARG HA H 208 4.127 4.060 0.067 1 1 2334 . 8 1 1 A 208 208 ARG C C 208 179.278 178.651 0.627 1 1 2335 . 8 1 1 A 208 208 ARG CA C 208 59.419 59.187 0.232 1 1 2336 . 8 1 1 A 208 208 ARG CB C 208 30.182 30.254 -0.072 1 1 2338 . 8 1 1 A 208 208 ARG N N 208 118.471 119.306 -0.835 1 1 2340 . 8 1 1 A 209 209 LEU H H 209 7.869 8.153 -0.284 1 1 2341 . 8 1 1 A 209 209 LEU HA H 209 4.091 4.362 -0.271 1 1 2351 . 8 1 1 A 209 209 LEU C C 209 179.715 178.339 1.376 1 1 2352 . 8 1 1 A 209 209 LEU CA C 209 57.891 58.219 -0.328 1 1 2353 . 8 1 1 A 209 209 LEU CB C 209 41.338 41.300 0.038 1 1 2356 . 8 1 1 A 209 209 LEU N N 209 119.659 121.790 -2.131 1 1 2357 . 8 1 1 A 210 210 LEU H H 210 8.034 8.479 -0.445 1 1 2358 . 8 1 1 A 210 210 LEU HA H 210 3.977 3.979 -0.002 1 1 2367 . 8 1 1 A 210 210 LEU C C 210 180.363 178.564 1.799 1 1 2368 . 8 1 1 A 210 210 LEU CA C 210 57.459 58.460 -1.001 1 1 2369 . 8 1 1 A 210 210 LEU CB C 210 41.699 41.222 0.477 1 1 2373 . 8 1 1 A 210 210 LEU N N 210 120.967 119.911 1.056 1 1 2374 . 8 1 1 A 211 211 GLU H H 211 8.174 8.170 0.004 1 1 2375 . 8 1 1 A 211 211 GLU HA H 211 4.075 3.987 0.088 1 1 2379 . 8 1 1 A 211 211 GLU C C 211 178.499 178.633 -0.134 1 1 2380 . 8 1 1 A 211 211 GLU CA C 211 58.575 59.528 -0.953 1 1 2381 . 8 1 1 A 211 211 GLU CB C 211 29.583 29.244 0.339 1 1 2383 . 8 1 1 A 211 211 GLU N N 211 119.217 118.488 0.729 1 1 2384 . 8 1 1 A 212 212 ALA H H 212 7.723 7.743 -0.020 1 1 2385 . 8 1 1 A 212 212 ALA HA H 212 4.291 4.324 -0.033 1 1 2389 . 8 1 1 A 212 212 ALA C C 212 178.770 179.202 -0.432 1 1 2390 . 8 1 1 A 212 212 ALA CA C 212 53.966 54.198 -0.232 1 1 2391 . 8 1 1 A 212 212 ALA CB C 212 19.117 18.905 0.212 1 1 2392 . 8 1 1 A 212 212 ALA N N 212 121.798 121.494 0.304 1 1 2393 . 8 1 1 A 213 213 ALA H H 213 7.743 8.504 -0.761 1 1 2394 . 8 1 1 A 213 213 ALA HA H 213 4.406 4.559 -0.153 1 1 2398 . 8 1 1 A 213 213 ALA C C 213 178.413 177.851 0.562 1 1 2399 . 8 1 1 A 213 213 ALA CA C 213 53.129 52.285 0.844 1 1 2400 . 8 1 1 A 213 213 ALA CB C 213 18.926 18.674 0.252 1 1 2401 . 8 1 1 A 213 213 ALA N N 213 120.435 120.018 0.417 1 1 2402 . 8 1 1 A 214 214 SER H H 214 7.944 8.101 -0.157 1 1 2403 . 8 1 1 A 214 214 SER HA H 214 4.559 4.352 0.207 1 1 2406 . 8 1 1 A 214 214 SER C C 214 174.958 174.695 0.263 1 1 2407 . 8 1 1 A 214 214 SER CA C 214 58.640 60.463 -1.823 1 1 2408 . 8 1 1 A 214 214 SER CB C 214 63.928 62.975 0.953 1 1 2409 . 8 1 1 A 214 214 SER N N 214 113.729 112.679 1.050 1 1 2410 . 8 1 1 A 215 215 SER H H 215 8.255 7.893 0.362 1 1 2411 . 8 1 1 A 215 215 SER HA H 215 4.547 4.634 -0.087 1 1 2413 . 8 1 1 A 215 215 SER C C 215 175.289 173.946 1.343 1 1 2414 . 8 1 1 A 215 215 SER CA C 215 58.833 58.091 0.742 1 1 2415 . 8 1 1 A 215 215 SER CB C 215 63.847 61.925 1.922 1 1 2416 . 8 1 1 A 215 215 SER N N 215 117.674 118.327 -0.653 1 1 2417 . 8 1 1 A 216 216 GLY H H 216 8.431 8.407 0.024 1 1 2418 . 8 1 1 A 216 216 GLY HA2 H 216 4.054 4.158 -0.104 1 1 2419 . 8 1 1 A 216 216 GLY C C 216 174.189 173.486 0.703 1 1 2420 . 8 1 1 A 216 216 GLY CA C 216 45.412 46.008 -0.596 1 1 2421 . 8 1 1 A 216 216 GLY N N 216 110.800 113.493 -2.693 1 1 2422 . 8 1 1 A 217 217 GLU H H 217 8.267 8.327 -0.060 1 1 2423 . 8 1 1 A 217 217 GLU HA H 217 4.345 4.400 -0.055 1 1 2427 . 8 1 1 A 217 217 GLU C C 217 176.428 176.436 -0.008 1 1 2428 . 8 1 1 A 217 217 GLU CA C 217 56.470 56.245 0.225 1 1 2429 . 8 1 1 A 217 217 GLU CB C 217 30.526 30.613 -0.087 1 1 2430 . 8 1 1 A 217 217 GLU N N 217 120.726 121.198 -0.472 1 1 2431 . 8 1 1 A 218 218 ALA H H 218 8.476 8.394 0.082 1 1 2432 . 8 1 1 A 218 218 ALA HA H 218 4.467 4.451 0.016 1 1 2436 . 8 1 1 A 218 218 ALA C C 218 178.015 177.616 0.399 1 1 2437 . 8 1 1 A 218 218 ALA CA C 218 52.547 52.608 -0.061 1 1 2438 . 8 1 1 A 218 218 ALA CB C 218 19.242 19.365 -0.123 1 1 2439 . 8 1 1 A 218 218 ALA N N 218 125.534 126.183 -0.649 1 1 2440 . 8 1 1 A 219 219 THR H H 219 8.232 8.683 -0.451 1 1 2441 . 8 1 1 A 219 219 THR HA H 219 4.411 5.193 -0.782 1 1 2446 . 8 1 1 A 219 219 THR C C 219 175.327 174.384 0.943 1 1 2447 . 8 1 1 A 219 219 THR CA C 219 61.889 61.013 0.876 1 1 2448 . 8 1 1 A 219 219 THR CB C 219 69.939 70.816 -0.877 1 1 2449 . 8 1 1 A 219 219 THR N N 219 113.242 116.516 -3.274 1 1 2450 . 8 1 1 A 220 220 GLY H H 220 8.418 9.180 -0.762 1 1 2451 . 8 1 1 A 220 220 GLY C C 220 174.037 173.971 0.066 1 1 2452 . 8 1 1 A 220 220 GLY CA C 220 45.408 46.671 -1.263 1 1 2453 . 8 1 1 A 220 220 GLY N N 220 111.031 113.820 -2.789 1 1 2454 . 8 1 1 A 221 221 ASP H H 221 8.345 7.526 0.819 1 1 2455 . 8 1 1 A 221 221 ASP HA H 221 4.700 4.944 -0.244 1 1 2458 . 8 1 1 A 221 221 ASP C C 221 176.535 174.290 2.245 1 1 2459 . 8 1 1 A 221 221 ASP CA C 221 54.402 53.879 0.523 1 1 2460 . 8 1 1 A 221 221 ASP CB C 221 41.431 44.761 -3.330 1 1 2461 . 8 1 1 A 221 221 ASP N N 221 120.795 118.280 2.515 1 1 2462 . 8 1 1 A 222 222 SER H H 222 8.353 8.682 -0.329 1 1 2463 . 8 1 1 A 222 222 SER HA H 222 4.493 4.458 0.035 1 1 2465 . 8 1 1 A 222 222 SER C C 222 174.224 173.514 0.710 1 1 2466 . 8 1 1 A 222 222 SER CA C 222 58.427 59.442 -1.015 1 1 2467 . 8 1 1 A 222 222 SER CB C 222 63.860 62.462 1.398 1 1 2468 . 8 1 1 A 222 222 SER N N 222 116.220 119.853 -3.633 1 1 2469 . 8 1 1 A 223 223 ALA H H 223 8.381 8.549 -0.168 1 1 2470 . 8 1 1 A 223 223 ALA HA H 223 4.461 4.441 0.020 1 1 2474 . 8 1 1 A 223 223 ALA C C 223 176.926 176.363 0.563 1 1 2475 . 8 1 1 A 223 223 ALA CA C 223 52.583 51.715 0.868 1 1 2476 . 8 1 1 A 223 223 ALA CB C 223 19.438 17.371 2.067 1 1 2477 . 8 1 1 A 223 223 ALA N N 223 126.592 130.362 -3.770 1 1 1 . 9 1 1 A 2 2 ALA HA H 2 4.274 4.359 -0.085 1 1 5 . 9 1 1 A 2 2 ALA C C 2 177.828 177.003 0.825 1 1 6 . 9 1 1 A 2 2 ALA CA C 2 52.984 51.848 1.136 1 1 7 . 9 1 1 A 2 2 ALA CB C 2 19.138 19.240 -0.102 1 1 8 . 9 1 1 A 3 3 GLN H H 3 8.463 8.418 0.045 1 1 9 . 9 1 1 A 3 3 GLN HA H 3 4.676 4.252 0.424 1 1 12 . 9 1 1 A 3 3 GLN C C 3 176.002 176.572 -0.570 1 1 13 . 9 1 1 A 3 3 GLN CA C 3 56.258 56.685 -0.427 1 1 14 . 9 1 1 A 3 3 GLN CB C 3 30.346 28.491 1.855 1 1 15 . 9 1 1 A 3 3 GLN N N 3 117.490 118.908 -1.418 1 1 16 . 9 1 1 A 4 4 GLY H H 4 8.099 8.976 -0.877 1 1 17 . 9 1 1 A 4 4 GLY HA2 H 4 3.910 3.910 0.000 1 1 18 . 9 1 1 A 4 4 GLY C C 4 173.332 174.421 -1.089 1 1 19 . 9 1 1 A 4 4 GLY CA C 4 45.333 46.777 -1.444 1 1 20 . 9 1 1 A 4 4 GLY N N 4 109.423 111.716 -2.293 1 1 21 . 9 1 1 A 5 5 LEU H H 5 7.863 7.810 0.053 1 1 22 . 9 1 1 A 5 5 LEU HA H 5 4.561 4.575 -0.014 1 1 32 . 9 1 1 A 5 5 LEU C C 5 176.448 175.493 0.955 1 1 33 . 9 1 1 A 5 5 LEU CA C 5 54.713 54.255 0.458 1 1 34 . 9 1 1 A 5 5 LEU CB C 5 43.551 41.126 2.425 1 1 38 . 9 1 1 A 5 5 LEU N N 5 120.391 121.286 -0.895 1 1 39 . 9 1 1 A 6 6 ILE H H 6 8.764 9.349 -0.585 1 1 40 . 9 1 1 A 6 6 ILE HA H 6 4.087 4.145 -0.058 1 1 49 . 9 1 1 A 6 6 ILE C C 6 174.679 175.628 -0.949 1 1 50 . 9 1 1 A 6 6 ILE CA C 6 61.279 61.478 -0.199 1 1 51 . 9 1 1 A 6 6 ILE CB C 6 39.651 37.805 1.846 1 1 54 . 9 1 1 A 6 6 ILE N N 6 123.050 125.805 -2.755 1 1 55 . 9 1 1 A 7 7 GLU H H 7 8.587 8.577 0.010 1 1 56 . 9 1 1 A 7 7 GLU HA H 7 4.917 4.929 -0.012 1 1 61 . 9 1 1 A 7 7 GLU C C 7 175.978 176.306 -0.328 1 1 62 . 9 1 1 A 7 7 GLU CA C 7 56.127 56.111 0.016 1 1 63 . 9 1 1 A 7 7 GLU CB C 7 31.115 30.656 0.459 1 1 65 . 9 1 1 A 7 7 GLU N N 7 127.415 127.569 -0.154 1 1 66 . 9 1 1 A 8 8 VAL H H 8 8.986 9.470 -0.484 1 1 67 . 9 1 1 A 8 8 VAL HA H 8 4.375 4.972 -0.597 1 1 72 . 9 1 1 A 8 8 VAL C C 8 173.704 174.568 -0.864 1 1 73 . 9 1 1 A 8 8 VAL CA C 8 61.347 59.612 1.735 1 1 74 . 9 1 1 A 8 8 VAL CB C 8 33.611 34.629 -1.018 1 1 76 . 9 1 1 A 8 8 VAL N N 8 126.071 118.732 7.339 1 1 77 . 9 1 1 A 9 9 GLU H H 9 8.521 9.072 -0.551 1 1 78 . 9 1 1 A 9 9 GLU HA H 9 5.837 5.611 0.226 1 1 81 . 9 1 1 A 9 9 GLU C C 9 175.939 174.023 1.916 1 1 82 . 9 1 1 A 9 9 GLU CA C 9 54.516 54.871 -0.355 1 1 83 . 9 1 1 A 9 9 GLU CB C 9 33.009 33.845 -0.836 1 1 84 . 9 1 1 A 9 9 GLU N N 9 122.857 121.484 1.373 1 1 85 . 9 1 1 A 10 10 ARG H H 10 8.690 8.520 0.170 1 1 86 . 9 1 1 A 10 10 ARG HA H 10 4.709 4.949 -0.240 1 1 94 . 9 1 1 A 10 10 ARG C C 10 174.826 173.575 1.251 1 1 95 . 9 1 1 A 10 10 ARG CA C 10 54.491 54.593 -0.102 1 1 96 . 9 1 1 A 10 10 ARG CB C 10 35.777 34.672 1.105 1 1 98 . 9 1 1 A 10 10 ARG N N 10 120.430 120.475 -0.045 1 1 100 . 9 1 1 A 11 11 LYS H H 11 8.874 8.765 0.109 1 1 101 . 9 1 1 A 11 11 LYS HA H 11 5.530 5.335 0.195 1 1 107 . 9 1 1 A 11 11 LYS C C 11 176.919 175.259 1.660 1 1 108 . 9 1 1 A 11 11 LYS CA C 11 55.084 54.787 0.297 1 1 109 . 9 1 1 A 11 11 LYS CB C 11 35.435 35.670 -0.235 1 1 113 . 9 1 1 A 11 11 LYS N N 11 121.087 125.188 -4.101 1 1 114 . 9 1 1 A 12 12 PHE H H 12 8.877 9.213 -0.336 1 1 115 . 9 1 1 A 12 12 PHE HA H 12 5.130 5.169 -0.039 1 1 120 . 9 1 1 A 12 12 PHE C C 12 171.676 172.082 -0.406 1 1 121 . 9 1 1 A 12 12 PHE CA C 12 55.869 56.318 -0.449 1 1 122 . 9 1 1 A 12 12 PHE CB C 12 42.108 42.082 0.026 1 1 125 . 9 1 1 A 12 12 PHE N N 12 117.486 119.952 -2.466 1 1 126 . 9 1 1 A 13 13 ALA H H 13 9.134 9.172 -0.038 1 1 127 . 9 1 1 A 13 13 ALA HA H 13 5.003 4.798 0.205 1 1 131 . 9 1 1 A 13 13 ALA CA C 13 48.340 48.988 -0.648 1 1 132 . 9 1 1 A 13 13 ALA CB C 13 19.191 20.169 -0.978 1 1 133 . 9 1 1 A 13 13 ALA N N 13 125.915 122.941 2.974 1 1 134 . 9 1 1 A 14 14 PRO HA H 14 4.620 4.835 -0.215 1 1 140 . 9 1 1 A 14 14 PRO C C 14 176.502 177.220 -0.718 1 1 141 . 9 1 1 A 14 14 PRO CA C 14 62.672 62.304 0.368 1 1 142 . 9 1 1 A 14 14 PRO CB C 14 33.119 32.770 0.349 1 1 145 . 9 1 1 A 15 15 GLY H H 15 8.721 8.534 0.187 1 1 146 . 9 1 1 A 15 15 GLY HA2 H 15 3.999 4.080 -0.081 1 1 147 . 9 1 1 A 15 15 GLY HA3 H 15 4.632 4.081 0.551 1 1 148 . 9 1 1 A 15 15 GLY CA C 15 44.411 43.999 0.412 1 1 149 . 9 1 1 A 15 15 GLY N N 15 109.863 107.951 1.912 1 1 150 . 9 1 1 A 16 16 PRO HA H 16 4.447 4.485 -0.038 1 1 155 . 9 1 1 A 16 16 PRO C C 16 177.053 177.019 0.034 1 1 156 . 9 1 1 A 16 16 PRO CA C 16 64.395 64.310 0.085 1 1 157 . 9 1 1 A 16 16 PRO CB C 16 31.993 31.740 0.253 1 1 159 . 9 1 1 A 17 17 ASP H H 17 8.550 8.524 0.026 1 1 160 . 9 1 1 A 17 17 ASP HA H 17 4.950 4.712 0.238 1 1 163 . 9 1 1 A 17 17 ASP C C 17 176.800 176.691 0.109 1 1 164 . 9 1 1 A 17 17 ASP CA C 17 53.271 54.248 -0.977 1 1 165 . 9 1 1 A 17 17 ASP CB C 17 40.392 41.439 -1.047 1 1 166 . 9 1 1 A 17 17 ASP N N 17 116.060 118.416 -2.356 1 1 167 . 9 1 1 A 18 18 THR H H 18 7.664 7.259 0.405 1 1 168 . 9 1 1 A 18 18 THR HA H 18 4.120 3.688 0.432 1 1 174 . 9 1 1 A 18 18 THR C C 18 175.407 176.361 -0.954 1 1 175 . 9 1 1 A 18 18 THR CA C 18 68.718 67.203 1.515 1 1 176 . 9 1 1 A 18 18 THR CB C 18 69.179 68.413 0.766 1 1 178 . 9 1 1 A 18 18 THR N N 18 117.158 115.608 1.550 1 1 179 . 9 1 1 A 19 19 GLU H H 19 8.817 8.537 0.280 1 1 180 . 9 1 1 A 19 19 GLU HA H 19 3.510 3.293 0.217 1 1 184 . 9 1 1 A 19 19 GLU C C 19 178.345 179.108 -0.763 1 1 185 . 9 1 1 A 19 19 GLU CA C 19 61.237 59.925 1.312 1 1 186 . 9 1 1 A 19 19 GLU CB C 19 28.746 29.469 -0.723 1 1 188 . 9 1 1 A 19 19 GLU N N 19 118.802 119.122 -0.320 1 1 189 . 9 1 1 A 20 20 GLU H H 20 7.976 8.135 -0.159 1 1 190 . 9 1 1 A 20 20 GLU HA H 20 4.036 4.117 -0.081 1 1 194 . 9 1 1 A 20 20 GLU C C 20 179.451 179.372 0.079 1 1 195 . 9 1 1 A 20 20 GLU CA C 20 59.909 59.218 0.691 1 1 196 . 9 1 1 A 20 20 GLU CB C 20 28.992 29.402 -0.410 1 1 198 . 9 1 1 A 20 20 GLU N N 20 121.130 119.657 1.473 1 1 199 . 9 1 1 A 21 21 ARG H H 21 8.199 7.976 0.223 1 1 200 . 9 1 1 A 21 21 ARG HA H 21 4.061 4.116 -0.055 1 1 207 . 9 1 1 A 21 21 ARG C C 21 179.087 178.847 0.240 1 1 208 . 9 1 1 A 21 21 ARG CA C 21 58.477 58.789 -0.312 1 1 209 . 9 1 1 A 21 21 ARG CB C 21 30.101 30.034 0.067 1 1 211 . 9 1 1 A 21 21 ARG N N 21 119.897 120.417 -0.520 1 1 213 . 9 1 1 A 22 22 LEU H H 22 8.154 8.453 -0.299 1 1 214 . 9 1 1 A 22 22 LEU HA H 22 3.560 3.772 -0.212 1 1 224 . 9 1 1 A 22 22 LEU C C 22 178.461 179.325 -0.864 1 1 225 . 9 1 1 A 22 22 LEU CA C 22 58.432 57.714 0.718 1 1 226 . 9 1 1 A 22 22 LEU CB C 22 40.229 40.966 -0.737 1 1 230 . 9 1 1 A 22 22 LEU N N 22 120.012 119.487 0.525 1 1 231 . 9 1 1 A 23 23 GLN H H 23 7.621 7.945 -0.324 1 1 232 . 9 1 1 A 23 23 GLN HA H 23 4.232 4.082 0.150 1 1 238 . 9 1 1 A 23 23 GLN C C 23 180.543 178.812 1.731 1 1 239 . 9 1 1 A 23 23 GLN CA C 23 59.434 59.286 0.148 1 1 240 . 9 1 1 A 23 23 GLN CB C 23 28.749 28.511 0.238 1 1 242 . 9 1 1 A 23 23 GLN N N 23 117.823 118.176 -0.353 1 1 244 . 9 1 1 A 24 24 GLU H H 24 8.165 7.683 0.482 1 1 245 . 9 1 1 A 24 24 GLU HA H 24 4.072 4.064 0.008 1 1 249 . 9 1 1 A 24 24 GLU C C 24 178.612 179.531 -0.919 1 1 250 . 9 1 1 A 24 24 GLU CA C 24 59.236 59.134 0.102 1 1 251 . 9 1 1 A 24 24 GLU CB C 24 29.606 29.382 0.224 1 1 253 . 9 1 1 A 24 24 GLU N N 24 122.589 120.241 2.348 1 1 254 . 9 1 1 A 25 25 LEU H H 25 7.911 7.940 -0.029 1 1 255 . 9 1 1 A 25 25 LEU HA H 25 4.214 4.092 0.122 1 1 265 . 9 1 1 A 25 25 LEU C C 25 176.745 177.152 -0.407 1 1 266 . 9 1 1 A 25 25 LEU CA C 25 55.659 55.906 -0.247 1 1 267 . 9 1 1 A 25 25 LEU CB C 25 43.109 42.784 0.325 1 1 271 . 9 1 1 A 25 25 LEU N N 25 117.882 117.737 0.145 1 1 272 . 9 1 1 A 26 26 GLY H H 26 7.776 7.838 -0.062 1 1 273 . 9 1 1 A 26 26 GLY HA2 H 26 4.337 4.057 0.280 1 1 274 . 9 1 1 A 26 26 GLY HA3 H 26 3.856 4.071 -0.215 1 1 275 . 9 1 1 A 26 26 GLY C C 26 175.456 174.538 0.918 1 1 276 . 9 1 1 A 26 26 GLY CA C 26 44.875 45.035 -0.160 1 1 277 . 9 1 1 A 26 26 GLY N N 26 104.938 105.566 -0.628 1 1 278 . 9 1 1 A 27 27 ALA H H 27 8.104 8.160 -0.056 1 1 279 . 9 1 1 A 27 27 ALA HA H 27 4.949 4.608 0.341 1 1 283 . 9 1 1 A 27 27 ALA C C 27 176.448 176.823 -0.375 1 1 284 . 9 1 1 A 27 27 ALA CA C 27 52.183 52.242 -0.059 1 1 285 . 9 1 1 A 27 27 ALA CB C 27 21.814 19.881 1.933 1 1 286 . 9 1 1 A 27 27 ALA N N 27 123.263 123.863 -0.600 1 1 287 . 9 1 1 A 28 28 THR H H 28 9.369 9.119 0.250 1 1 288 . 9 1 1 A 28 28 THR HA H 28 4.779 4.907 -0.128 1 1 293 . 9 1 1 A 28 28 THR C C 28 173.725 173.569 0.156 1 1 294 . 9 1 1 A 28 28 THR CA C 28 60.046 60.686 -0.640 1 1 295 . 9 1 1 A 28 28 THR CB C 28 70.592 70.382 0.210 1 1 297 . 9 1 1 A 28 28 THR N N 28 112.201 118.672 -6.471 1 1 298 . 9 1 1 A 29 29 LEU H H 29 8.518 8.566 -0.048 1 1 299 . 9 1 1 A 29 29 LEU HA H 29 3.332 3.780 -0.448 1 1 309 . 9 1 1 A 29 29 LEU C C 29 176.202 176.493 -0.291 1 1 310 . 9 1 1 A 29 29 LEU CA C 29 55.031 54.474 0.557 1 1 311 . 9 1 1 A 29 29 LEU CB C 29 40.624 41.583 -0.959 1 1 315 . 9 1 1 A 29 29 LEU N N 29 128.151 129.243 -1.092 1 1 316 . 9 1 1 A 30 30 GLU H H 30 9.269 9.136 0.133 1 1 317 . 9 1 1 A 30 30 GLU HA H 30 4.287 4.390 -0.103 1 1 321 . 9 1 1 A 30 30 GLU C C 30 176.740 176.180 0.560 1 1 322 . 9 1 1 A 30 30 GLU CA C 30 57.283 56.950 0.333 1 1 323 . 9 1 1 A 30 30 GLU CB C 30 31.045 30.868 0.177 1 1 325 . 9 1 1 A 30 30 GLU N N 30 130.123 122.297 7.826 1 1 326 . 9 1 1 A 31 31 HIS H H 31 7.341 7.187 0.154 1 1 327 . 9 1 1 A 31 31 HIS HA H 31 4.701 5.081 -0.380 1 1 331 . 9 1 1 A 31 31 HIS C C 31 172.581 173.921 -1.340 1 1 332 . 9 1 1 A 31 31 HIS CA C 31 55.876 54.535 1.341 1 1 333 . 9 1 1 A 31 31 HIS CB C 31 33.434 34.054 -0.620 1 1 334 . 9 1 1 A 31 31 HIS N N 31 113.223 116.131 -2.908 1 1 335 . 9 1 1 A 32 32 ARG H H 32 8.196 8.946 -0.750 1 1 336 . 9 1 1 A 32 32 ARG HA H 32 5.262 5.295 -0.033 1 1 341 . 9 1 1 A 32 32 ARG C C 32 174.377 174.809 -0.432 1 1 342 . 9 1 1 A 32 32 ARG CA C 32 55.808 54.429 1.379 1 1 343 . 9 1 1 A 32 32 ARG CB C 32 33.340 33.756 -0.416 1 1 345 . 9 1 1 A 32 32 ARG N N 32 123.003 121.065 1.938 1 1 346 . 9 1 1 A 33 33 VAL H H 33 8.956 8.796 0.160 1 1 347 . 9 1 1 A 33 33 VAL HA H 33 4.734 5.090 -0.356 1 1 355 . 9 1 1 A 33 33 VAL C C 33 172.821 174.609 -1.788 1 1 356 . 9 1 1 A 33 33 VAL CA C 33 60.197 59.545 0.652 1 1 357 . 9 1 1 A 33 33 VAL CB C 33 35.860 36.018 -0.158 1 1 360 . 9 1 1 A 33 33 VAL N N 33 122.929 117.823 5.106 1 1 361 . 9 1 1 A 34 34 THR H H 34 8.250 8.809 -0.559 1 1 362 . 9 1 1 A 34 34 THR HA H 34 5.616 5.793 -0.177 1 1 367 . 9 1 1 A 34 34 THR C C 34 173.913 173.736 0.177 1 1 368 . 9 1 1 A 34 34 THR CA C 34 60.245 60.459 -0.214 1 1 369 . 9 1 1 A 34 34 THR CB C 34 71.706 71.331 0.375 1 1 371 . 9 1 1 A 34 34 THR N N 34 119.164 115.159 4.005 1 1 372 . 9 1 1 A 35 35 PHE H H 35 8.565 8.358 0.207 1 1 373 . 9 1 1 A 35 35 PHE HA H 35 5.029 5.091 -0.062 1 1 378 . 9 1 1 A 35 35 PHE C C 35 173.193 171.980 1.213 1 1 379 . 9 1 1 A 35 35 PHE CA C 35 55.687 56.016 -0.329 1 1 380 . 9 1 1 A 35 35 PHE CB C 35 40.853 41.176 -0.323 1 1 383 . 9 1 1 A 35 35 PHE N N 35 120.244 118.430 1.814 1 1 384 . 9 1 1 A 36 36 ARG H H 36 8.869 8.826 0.043 1 1 385 . 9 1 1 A 36 36 ARG HA H 36 4.982 5.011 -0.029 1 1 387 . 9 1 1 A 36 36 ARG C C 36 174.743 174.841 -0.098 1 1 388 . 9 1 1 A 36 36 ARG CA C 36 55.493 54.575 0.918 1 1 389 . 9 1 1 A 36 36 ARG CB C 36 32.228 33.104 -0.876 1 1 390 . 9 1 1 A 36 36 ARG N N 36 123.893 120.525 3.368 1 1 391 . 9 1 1 A 37 37 ASP H H 37 8.402 9.370 -0.968 1 1 392 . 9 1 1 A 37 37 ASP HA H 37 5.462 5.566 -0.104 1 1 395 . 9 1 1 A 37 37 ASP C C 37 175.177 175.453 -0.276 1 1 396 . 9 1 1 A 37 37 ASP CA C 37 53.942 52.823 1.119 1 1 397 . 9 1 1 A 37 37 ASP CB C 37 45.486 43.418 2.068 1 1 398 . 9 1 1 A 37 37 ASP N N 37 127.149 126.458 0.691 1 1 399 . 9 1 1 A 38 38 THR H H 38 8.151 8.763 -0.612 1 1 400 . 9 1 1 A 38 38 THR HA H 38 4.866 5.397 -0.531 1 1 405 . 9 1 1 A 38 38 THR C C 38 172.792 172.897 -0.105 1 1 406 . 9 1 1 A 38 38 THR CA C 38 61.416 60.595 0.821 1 1 407 . 9 1 1 A 38 38 THR CB C 38 71.047 71.109 -0.062 1 1 409 . 9 1 1 A 38 38 THR N N 38 115.686 115.348 0.338 1 1 410 . 9 1 1 A 39 39 TYR H H 39 9.021 9.117 -0.096 1 1 411 . 9 1 1 A 39 39 TYR HA H 39 5.544 5.860 -0.316 1 1 416 . 9 1 1 A 39 39 TYR C C 39 176.032 174.849 1.183 1 1 417 . 9 1 1 A 39 39 TYR CA C 39 57.184 56.400 0.784 1 1 418 . 9 1 1 A 39 39 TYR CB C 39 41.642 40.372 1.270 1 1 420 . 9 1 1 A 39 39 TYR N N 39 124.579 125.062 -0.483 1 1 421 . 9 1 1 A 40 40 TYR H H 40 8.487 9.260 -0.773 1 1 422 . 9 1 1 A 40 40 TYR HA H 40 5.517 5.932 -0.415 1 1 426 . 9 1 1 A 40 40 TYR C C 40 174.108 174.633 -0.525 1 1 427 . 9 1 1 A 40 40 TYR CA C 40 56.979 56.764 0.215 1 1 428 . 9 1 1 A 40 40 TYR CB C 40 44.132 42.147 1.985 1 1 431 . 9 1 1 A 40 40 TYR N N 40 119.709 122.074 -2.365 1 1 432 . 9 1 1 A 41 41 ASP H H 41 9.341 8.719 0.622 1 1 433 . 9 1 1 A 41 41 ASP HA H 41 4.866 5.122 -0.256 1 1 436 . 9 1 1 A 41 41 ASP C C 41 177.262 174.694 2.568 1 1 437 . 9 1 1 A 41 41 ASP CA C 41 53.445 53.443 0.002 1 1 438 . 9 1 1 A 41 41 ASP CB C 41 45.347 44.674 0.673 1 1 439 . 9 1 1 A 41 41 ASP N N 41 117.995 120.811 -2.816 1 1 440 . 9 1 1 A 42 42 THR H H 42 11.574 8.681 2.893 1 1 441 . 9 1 1 A 42 42 THR HA H 42 5.206 4.510 0.696 1 1 446 . 9 1 1 A 42 42 THR C C 42 177.935 176.305 1.630 1 1 447 . 9 1 1 A 42 42 THR CA C 42 60.400 61.127 -0.727 1 1 448 . 9 1 1 A 42 42 THR CB C 42 72.114 70.878 1.236 1 1 450 . 9 1 1 A 42 42 THR N N 42 114.394 114.689 -0.295 1 1 451 . 9 1 1 A 43 43 SER H H 43 9.715 8.832 0.883 1 1 452 . 9 1 1 A 43 43 SER HA H 43 4.252 4.105 0.147 1 1 455 . 9 1 1 A 43 43 SER C C 43 175.478 174.859 0.619 1 1 456 . 9 1 1 A 43 43 SER CA C 43 61.277 61.148 0.129 1 1 457 . 9 1 1 A 43 43 SER CB C 43 62.821 62.609 0.212 1 1 458 . 9 1 1 A 43 43 SER N N 43 116.674 115.442 1.232 1 1 459 . 9 1 1 A 44 44 GLU H H 44 7.674 7.961 -0.287 1 1 460 . 9 1 1 A 44 44 GLU HA H 44 4.330 4.270 0.060 1 1 464 . 9 1 1 A 44 44 GLU C C 44 175.001 175.891 -0.890 1 1 465 . 9 1 1 A 44 44 GLU CA C 44 55.992 55.262 0.730 1 1 466 . 9 1 1 A 44 44 GLU CB C 44 29.276 28.731 0.545 1 1 468 . 9 1 1 A 44 44 GLU N N 44 117.856 117.383 0.473 1 1 469 . 9 1 1 A 45 45 LEU H H 45 8.222 8.000 0.222 1 1 470 . 9 1 1 A 45 45 LEU HA H 45 3.901 4.734 -0.833 1 1 480 . 9 1 1 A 45 45 LEU C C 45 175.209 176.477 -1.268 1 1 481 . 9 1 1 A 45 45 LEU CA C 45 55.548 56.014 -0.466 1 1 482 . 9 1 1 A 45 45 LEU CB C 45 38.458 39.910 -1.452 1 1 485 . 9 1 1 A 45 45 LEU N N 45 119.335 116.954 2.381 1 1 486 . 9 1 1 A 46 46 SER H H 46 7.347 8.175 -0.828 1 1 487 . 9 1 1 A 46 46 SER HA H 46 3.954 4.284 -0.330 1 1 489 . 9 1 1 A 46 46 SER C C 46 177.497 177.117 0.380 1 1 490 . 9 1 1 A 46 46 SER CA C 46 62.471 61.089 1.382 1 1 491 . 9 1 1 A 46 46 SER CB C 46 63.908 62.958 0.950 1 1 492 . 9 1 1 A 46 46 SER N N 46 111.433 114.206 -2.773 1 1 493 . 9 1 1 A 47 47 LEU H H 47 12.003 8.366 3.637 1 1 494 . 9 1 1 A 47 47 LEU HA H 47 3.959 4.024 -0.065 1 1 504 . 9 1 1 A 47 47 LEU C C 47 180.340 178.391 1.949 1 1 505 . 9 1 1 A 47 47 LEU CA C 47 58.879 58.350 0.529 1 1 506 . 9 1 1 A 47 47 LEU CB C 47 39.572 41.949 -2.377 1 1 510 . 9 1 1 A 47 47 LEU N N 47 124.605 122.866 1.739 1 1 511 . 9 1 1 A 48 48 MET H H 48 10.599 8.748 1.851 1 1 512 . 9 1 1 A 48 48 MET HA H 48 3.213 3.671 -0.458 1 1 520 . 9 1 1 A 48 48 MET C C 48 181.177 177.758 3.419 1 1 521 . 9 1 1 A 48 48 MET CA C 48 60.747 58.666 2.081 1 1 522 . 9 1 1 A 48 48 MET CB C 48 32.594 32.553 0.041 1 1 525 . 9 1 1 A 48 48 MET N N 48 126.254 116.819 9.435 1 1 526 . 9 1 1 A 49 49 LEU H H 49 8.731 7.386 1.345 1 1 527 . 9 1 1 A 49 49 LEU HA H 49 4.097 4.121 -0.024 1 1 536 . 9 1 1 A 49 49 LEU C C 49 178.144 177.821 0.323 1 1 537 . 9 1 1 A 49 49 LEU CA C 49 57.800 57.099 0.701 1 1 538 . 9 1 1 A 49 49 LEU CB C 49 41.379 41.482 -0.103 1 1 541 . 9 1 1 A 49 49 LEU N N 49 119.183 121.191 -2.008 1 1 542 . 9 1 1 A 50 50 SER H H 50 7.853 7.486 0.367 1 1 543 . 9 1 1 A 50 50 SER HA H 50 4.822 4.639 0.183 1 1 546 . 9 1 1 A 50 50 SER C C 50 174.539 173.081 1.458 1 1 547 . 9 1 1 A 50 50 SER CA C 50 57.811 58.126 -0.315 1 1 548 . 9 1 1 A 50 50 SER CB C 50 64.443 63.325 1.118 1 1 549 . 9 1 1 A 50 50 SER N N 50 114.594 112.320 2.274 1 1 550 . 9 1 1 A 51 51 ASP H H 51 8.264 8.050 0.214 1 1 551 . 9 1 1 A 51 51 ASP HA H 51 4.362 4.369 -0.007 1 1 554 . 9 1 1 A 51 51 ASP C C 51 172.921 174.402 -1.481 1 1 555 . 9 1 1 A 51 51 ASP CA C 51 55.343 55.606 -0.263 1 1 556 . 9 1 1 A 51 51 ASP CB C 51 40.583 39.444 1.139 1 1 557 . 9 1 1 A 51 51 ASP N N 51 123.003 117.711 5.292 1 1 558 . 9 1 1 A 52 52 HIS H H 52 7.869 7.231 0.638 1 1 559 . 9 1 1 A 52 52 HIS HA H 52 5.335 5.431 -0.096 1 1 564 . 9 1 1 A 52 52 HIS C C 52 173.991 173.640 0.351 1 1 565 . 9 1 1 A 52 52 HIS CA C 52 55.889 53.560 2.329 1 1 566 . 9 1 1 A 52 52 HIS CB C 52 31.789 32.486 -0.697 1 1 568 . 9 1 1 A 52 52 HIS N N 52 112.486 116.901 -4.415 1 1 569 . 9 1 1 A 53 53 TRP H H 53 8.165 9.189 -1.024 1 1 570 . 9 1 1 A 53 53 TRP HA H 53 4.926 5.447 -0.521 1 1 578 . 9 1 1 A 53 53 TRP C C 53 175.354 174.729 0.625 1 1 579 . 9 1 1 A 53 53 TRP CA C 53 55.364 55.519 -0.155 1 1 580 . 9 1 1 A 53 53 TRP CB C 53 30.641 32.940 -2.299 1 1 585 . 9 1 1 A 53 53 TRP N N 53 117.916 123.027 -5.111 1 1 587 . 9 1 1 A 54 54 LEU H H 54 10.088 9.170 0.918 1 1 588 . 9 1 1 A 54 54 LEU HA H 54 5.497 5.503 -0.006 1 1 598 . 9 1 1 A 54 54 LEU C C 54 173.337 174.945 -1.608 1 1 599 . 9 1 1 A 54 54 LEU CA C 54 54.408 53.663 0.745 1 1 600 . 9 1 1 A 54 54 LEU CB C 54 44.156 45.658 -1.502 1 1 604 . 9 1 1 A 54 54 LEU N N 54 130.826 124.676 6.150 1 1 605 . 9 1 1 A 55 55 ARG H H 55 9.289 9.381 -0.092 1 1 606 . 9 1 1 A 55 55 ARG HA H 55 5.482 5.541 -0.059 1 1 612 . 9 1 1 A 55 55 ARG C C 55 174.057 173.941 0.116 1 1 613 . 9 1 1 A 55 55 ARG CA C 55 53.167 53.995 -0.828 1 1 614 . 9 1 1 A 55 55 ARG CB C 55 34.270 33.522 0.748 1 1 616 . 9 1 1 A 55 55 ARG N N 55 125.089 124.646 0.443 1 1 618 . 9 1 1 A 56 56 GLN H H 56 9.092 8.869 0.223 1 1 619 . 9 1 1 A 56 56 GLN HA H 56 3.991 4.448 -0.457 1 1 626 . 9 1 1 A 56 56 GLN C C 56 174.199 174.670 -0.471 1 1 627 . 9 1 1 A 56 56 GLN CA C 56 54.566 53.740 0.826 1 1 628 . 9 1 1 A 56 56 GLN CB C 56 29.643 30.280 -0.637 1 1 630 . 9 1 1 A 56 56 GLN N N 56 124.355 121.728 2.627 1 1 632 . 9 1 1 A 57 57 ARG H H 57 8.440 8.308 0.132 1 1 633 . 9 1 1 A 57 57 ARG HA H 57 5.316 4.823 0.493 1 1 639 . 9 1 1 A 57 57 ARG C C 57 176.188 176.541 -0.353 1 1 640 . 9 1 1 A 57 57 ARG CA C 57 53.940 55.912 -1.972 1 1 641 . 9 1 1 A 57 57 ARG CB C 57 32.426 31.239 1.187 1 1 643 . 9 1 1 A 57 57 ARG N N 57 130.222 125.415 4.807 1 1 645 . 9 1 1 A 58 58 GLU H H 58 8.891 9.774 -0.883 1 1 646 . 9 1 1 A 58 58 GLU HA H 58 3.996 4.224 -0.228 1 1 649 . 9 1 1 A 58 58 GLU CA C 58 58.364 58.520 -0.156 1 1 650 . 9 1 1 A 58 58 GLU CB C 58 30.875 29.265 1.610 1 1 651 . 9 1 1 A 58 58 GLU N N 58 131.208 122.609 8.599 1 1 652 . 9 1 1 A 59 59 GLY H H 59 8.367 8.260 0.107 1 1 653 . 9 1 1 A 59 59 GLY HA2 H 59 4.334 3.979 0.355 1 1 654 . 9 1 1 A 59 59 GLY HA3 H 59 3.743 4.073 -0.330 1 1 655 . 9 1 1 A 59 59 GLY C C 59 174.194 175.286 -1.092 1 1 656 . 9 1 1 A 59 59 GLY CA C 59 45.666 45.558 0.108 1 1 657 . 9 1 1 A 60 60 SER H H 60 8.071 8.515 -0.444 1 1 658 . 9 1 1 A 60 60 SER HA H 60 4.730 4.325 0.405 1 1 661 . 9 1 1 A 60 60 SER C C 60 173.908 174.478 -0.570 1 1 662 . 9 1 1 A 60 60 SER CA C 60 58.762 59.161 -0.399 1 1 663 . 9 1 1 A 60 60 SER CB C 60 64.497 64.179 0.318 1 1 664 . 9 1 1 A 60 60 SER N N 60 114.636 115.473 -0.837 1 1 665 . 9 1 1 A 61 61 GLY H H 61 8.401 7.142 1.259 1 1 666 . 9 1 1 A 61 61 GLY HA2 H 61 4.560 4.002 0.558 1 1 667 . 9 1 1 A 61 61 GLY HA3 H 61 3.878 4.031 -0.153 1 1 668 . 9 1 1 A 61 61 GLY C C 61 173.526 171.809 1.717 1 1 669 . 9 1 1 A 61 61 GLY CA C 61 44.906 45.632 -0.726 1 1 670 . 9 1 1 A 61 61 GLY N N 61 109.421 106.600 2.821 1 1 671 . 9 1 1 A 62 62 TRP H H 62 8.861 8.500 0.361 1 1 672 . 9 1 1 A 62 62 TRP HA H 62 5.089 5.202 -0.113 1 1 681 . 9 1 1 A 62 62 TRP C C 62 176.168 175.829 0.339 1 1 682 . 9 1 1 A 62 62 TRP CA C 62 57.459 57.259 0.200 1 1 683 . 9 1 1 A 62 62 TRP CB C 62 32.536 31.904 0.632 1 1 689 . 9 1 1 A 62 62 TRP N N 62 122.939 120.895 2.044 1 1 691 . 9 1 1 A 63 63 GLU H H 63 9.306 9.483 -0.177 1 1 692 . 9 1 1 A 63 63 GLU HA H 63 4.919 5.032 -0.113 1 1 697 . 9 1 1 A 63 63 GLU C C 63 173.770 174.270 -0.500 1 1 698 . 9 1 1 A 63 63 GLU CA C 63 55.953 55.465 0.488 1 1 699 . 9 1 1 A 63 63 GLU CB C 63 35.317 33.386 1.931 1 1 701 . 9 1 1 A 63 63 GLU N N 63 120.136 121.530 -1.394 1 1 702 . 9 1 1 A 64 64 LEU H H 64 8.998 9.508 -0.510 1 1 703 . 9 1 1 A 64 64 LEU HA H 64 5.616 5.789 -0.173 1 1 712 . 9 1 1 A 64 64 LEU C C 64 175.014 174.115 0.899 1 1 713 . 9 1 1 A 64 64 LEU CA C 64 52.945 54.022 -1.077 1 1 714 . 9 1 1 A 64 64 LEU CB C 64 46.904 45.791 1.113 1 1 717 . 9 1 1 A 64 64 LEU N N 64 127.321 128.481 -1.160 1 1 718 . 9 1 1 A 65 65 LYS H H 65 9.322 10.096 -0.774 1 1 719 . 9 1 1 A 65 65 LYS HA H 65 5.347 5.431 -0.084 1 1 727 . 9 1 1 A 65 65 LYS C C 65 175.811 175.349 0.462 1 1 728 . 9 1 1 A 65 65 LYS CA C 65 55.817 55.407 0.410 1 1 729 . 9 1 1 A 65 65 LYS CB C 65 34.521 34.738 -0.217 1 1 733 . 9 1 1 A 65 65 LYS N N 65 129.874 128.661 1.213 1 1 734 . 9 1 1 A 66 66 CYS H H 66 9.129 9.649 -0.520 1 1 735 . 9 1 1 A 66 66 CYS HA H 66 5.319 4.864 0.455 1 1 738 . 9 1 1 A 66 66 CYS CA C 66 54.532 56.889 -2.357 1 1 739 . 9 1 1 A 66 66 CYS CB C 66 28.813 29.685 -0.872 1 1 740 . 9 1 1 A 66 66 CYS N N 66 121.497 125.255 -3.758 1 1 741 . 9 1 1 A 67 67 PRO HA H 67 4.439 4.121 0.318 1 1 748 . 9 1 1 A 67 67 PRO C C 67 177.297 177.738 -0.441 1 1 749 . 9 1 1 A 67 67 PRO CA C 67 63.596 63.261 0.335 1 1 750 . 9 1 1 A 67 67 PRO CB C 67 32.242 31.407 0.835 1 1 752 . 9 1 1 A 68 68 GLY H H 68 8.316 8.184 0.132 1 1 753 . 9 1 1 A 68 68 GLY HA2 H 68 3.726 3.950 -0.224 1 1 754 . 9 1 1 A 68 68 GLY HA3 H 68 4.095 3.975 0.120 1 1 755 . 9 1 1 A 68 68 GLY C C 68 173.789 173.928 -0.139 1 1 756 . 9 1 1 A 68 68 GLY CA C 68 45.227 45.829 -0.602 1 1 757 . 9 1 1 A 68 68 GLY N N 68 109.533 109.269 0.264 1 1 758 . 9 1 1 A 69 69 VAL H H 69 8.114 7.847 0.267 1 1 759 . 9 1 1 A 69 69 VAL HA H 69 4.266 4.584 -0.318 1 1 764 . 9 1 1 A 69 69 VAL C C 69 176.299 174.043 2.256 1 1 765 . 9 1 1 A 69 69 VAL CA C 69 61.945 61.322 0.623 1 1 766 . 9 1 1 A 69 69 VAL CB C 69 33.082 34.605 -1.523 1 1 768 . 9 1 1 A 69 69 VAL N N 69 118.540 120.577 -2.037 1 1 769 . 9 1 1 A 70 70 THR H H 70 8.324 8.782 -0.458 1 1 770 . 9 1 1 A 70 70 THR HA H 70 4.373 4.758 -0.385 1 1 775 . 9 1 1 A 70 70 THR C C 70 175.204 174.394 0.810 1 1 776 . 9 1 1 A 70 70 THR CA C 70 62.309 60.728 1.581 1 1 777 . 9 1 1 A 70 70 THR CB C 70 69.787 71.049 -1.262 1 1 779 . 9 1 1 A 70 70 THR N N 70 117.636 120.419 -2.783 1 1 780 . 9 1 1 A 71 71 GLY H H 71 8.574 8.980 -0.406 1 1 781 . 9 1 1 A 71 71 GLY HA2 H 71 4.096 4.015 0.081 1 1 782 . 9 1 1 A 71 71 GLY HA3 H 71 3.975 4.017 -0.042 1 1 783 . 9 1 1 A 71 71 GLY C C 71 174.313 175.202 -0.889 1 1 784 . 9 1 1 A 71 71 GLY CA C 71 45.545 45.564 -0.019 1 1 785 . 9 1 1 A 71 71 GLY N N 71 111.677 118.096 -6.419 1 1 786 . 9 1 1 A 72 72 VAL H H 72 7.945 8.320 -0.375 1 1 787 . 9 1 1 A 72 72 VAL HA H 72 4.258 3.848 0.410 1 1 795 . 9 1 1 A 72 72 VAL C C 72 176.162 176.386 -0.224 1 1 796 . 9 1 1 A 72 72 VAL CA C 72 62.227 65.219 -2.992 1 1 797 . 9 1 1 A 72 72 VAL CB C 72 32.997 32.723 0.274 1 1 799 . 9 1 1 A 72 72 VAL N N 72 118.647 119.878 -1.231 1 1 800 . 9 1 1 A 73 73 SER H H 73 8.498 8.029 0.469 1 1 801 . 9 1 1 A 73 73 SER HA H 73 4.617 4.178 0.439 1 1 803 . 9 1 1 A 73 73 SER C C 73 174.461 173.838 0.623 1 1 804 . 9 1 1 A 73 73 SER CA C 73 58.218 59.671 -1.453 1 1 805 . 9 1 1 A 73 73 SER CB C 73 64.061 61.427 2.634 1 1 806 . 9 1 1 A 73 73 SER N N 73 118.828 113.416 5.412 1 1 807 . 9 1 1 A 74 74 GLY H H 74 8.247 8.206 0.041 1 1 808 . 9 1 1 A 74 74 GLY HA2 H 74 4.101 4.003 0.098 1 1 809 . 9 1 1 A 74 74 GLY HA3 H 74 4.304 4.003 0.301 1 1 810 . 9 1 1 A 74 74 GLY CA C 74 44.896 44.224 0.672 1 1 811 . 9 1 1 A 74 74 GLY N N 74 111.138 108.264 2.874 1 1 812 . 9 1 1 A 75 75 PRO HA H 75 4.461 4.410 0.051 1 1 819 . 9 1 1 A 75 75 PRO C C 75 176.798 176.766 0.032 1 1 820 . 9 1 1 A 75 75 PRO CA C 75 63.466 62.620 0.846 1 1 821 . 9 1 1 A 75 75 PRO CB C 75 31.980 31.971 0.009 1 1 824 . 9 1 1 A 76 76 HIS H H 76 8.397 8.044 0.353 1 1 825 . 9 1 1 A 76 76 HIS HA H 76 4.742 4.561 0.181 1 1 829 . 9 1 1 A 76 76 HIS C C 76 174.282 175.516 -1.234 1 1 830 . 9 1 1 A 76 76 HIS CA C 76 55.579 55.624 -0.045 1 1 831 . 9 1 1 A 76 76 HIS CB C 76 30.501 30.185 0.316 1 1 832 . 9 1 1 A 76 76 HIS N N 76 118.431 118.113 0.318 1 1 833 . 9 1 1 A 77 77 ASN H H 77 8.364 9.416 -1.052 1 1 834 . 9 1 1 A 77 77 ASN HA H 77 4.767 4.941 -0.174 1 1 839 . 9 1 1 A 77 77 ASN C C 77 174.576 175.033 -0.457 1 1 840 . 9 1 1 A 77 77 ASN CA C 77 53.139 52.657 0.482 1 1 841 . 9 1 1 A 77 77 ASN CB C 77 39.320 38.608 0.712 1 1 842 . 9 1 1 A 77 77 ASN N N 77 119.421 119.798 -0.377 1 1 844 . 9 1 1 A 78 78 GLU H H 78 8.683 8.096 0.587 1 1 845 . 9 1 1 A 78 78 GLU HA H 78 4.409 4.304 0.105 1 1 850 . 9 1 1 A 78 78 GLU C C 78 175.791 175.248 0.543 1 1 851 . 9 1 1 A 78 78 GLU CA C 78 56.359 58.526 -2.167 1 1 852 . 9 1 1 A 78 78 GLU CB C 78 30.818 28.816 2.002 1 1 854 . 9 1 1 A 78 78 GLU N N 78 122.085 115.221 6.864 1 1 855 . 9 1 1 A 79 79 TYR H H 79 8.341 8.639 -0.298 1 1 856 . 9 1 1 A 79 79 TYR HA H 79 4.988 5.133 -0.145 1 1 861 . 9 1 1 A 79 79 TYR C C 79 175.837 176.014 -0.177 1 1 862 . 9 1 1 A 79 79 TYR CA C 79 58.028 59.317 -1.289 1 1 863 . 9 1 1 A 79 79 TYR CB C 79 41.672 39.557 2.115 1 1 866 . 9 1 1 A 79 79 TYR N N 79 119.452 123.029 -3.577 1 1 867 . 9 1 1 A 80 80 VAL H H 80 9.366 9.594 -0.228 1 1 868 . 9 1 1 A 80 80 VAL HA H 80 4.370 4.933 -0.563 1 1 873 . 9 1 1 A 80 80 VAL C C 80 174.948 174.165 0.783 1 1 874 . 9 1 1 A 80 80 VAL CA C 80 61.190 59.635 1.555 1 1 875 . 9 1 1 A 80 80 VAL CB C 80 34.204 35.087 -0.883 1 1 877 . 9 1 1 A 80 80 VAL N N 80 120.567 117.588 2.979 1 1 878 . 9 1 1 A 81 81 GLU H H 81 8.570 9.195 -0.625 1 1 879 . 9 1 1 A 81 81 GLU HA H 81 4.770 5.226 -0.456 1 1 883 . 9 1 1 A 81 81 GLU C C 81 175.491 175.782 -0.291 1 1 884 . 9 1 1 A 81 81 GLU CA C 81 55.655 55.101 0.554 1 1 885 . 9 1 1 A 81 81 GLU CB C 81 30.415 31.754 -1.339 1 1 887 . 9 1 1 A 81 81 GLU N N 81 124.248 123.921 0.327 1 1 888 . 9 1 1 A 82 82 VAL H H 82 9.189 9.073 0.116 1 1 889 . 9 1 1 A 82 82 VAL HA H 82 4.279 4.791 -0.512 1 1 894 . 9 1 1 A 82 82 VAL C C 82 176.087 175.282 0.805 1 1 895 . 9 1 1 A 82 82 VAL CA C 82 62.672 61.292 1.380 1 1 896 . 9 1 1 A 82 82 VAL CB C 82 33.121 33.378 -0.257 1 1 898 . 9 1 1 A 82 82 VAL N N 82 127.776 122.925 4.851 1 1 899 . 9 1 1 A 83 83 THR H H 83 8.590 8.756 -0.166 1 1 900 . 9 1 1 A 83 83 THR HA H 83 4.955 4.702 0.253 1 1 905 . 9 1 1 A 83 83 THR C C 83 174.688 174.551 0.137 1 1 906 . 9 1 1 A 83 83 THR CA C 83 61.332 62.410 -1.078 1 1 907 . 9 1 1 A 83 83 THR CB C 83 70.213 70.737 -0.524 1 1 909 . 9 1 1 A 83 83 THR N N 83 114.744 119.567 -4.823 1 1 910 . 9 1 1 A 84 84 SER H H 84 7.650 7.473 0.177 1 1 911 . 9 1 1 A 84 84 SER HA H 84 4.819 4.280 0.539 1 1 914 . 9 1 1 A 84 84 SER CA C 84 56.280 60.220 -3.940 1 1 915 . 9 1 1 A 84 84 SER CB C 84 63.294 63.418 -0.124 1 1 916 . 9 1 1 A 84 84 SER N N 84 118.038 118.012 0.026 1 1 917 . 9 1 1 A 85 85 GLU H H 85 8.391 8.708 -0.317 1 1 918 . 9 1 1 A 85 85 GLU HA H 85 3.661 3.909 -0.248 1 1 923 . 9 1 1 A 85 85 GLU C C 85 177.520 178.383 -0.863 1 1 924 . 9 1 1 A 85 85 GLU CA C 85 62.429 59.618 2.811 1 1 925 . 9 1 1 A 85 85 GLU CB C 85 29.655 29.427 0.228 1 1 927 . 9 1 1 A 86 86 ALA H H 86 8.443 8.067 0.376 1 1 928 . 9 1 1 A 86 86 ALA HA H 86 4.027 4.023 0.004 1 1 932 . 9 1 1 A 86 86 ALA C C 86 180.423 180.100 0.323 1 1 933 . 9 1 1 A 86 86 ALA CA C 86 55.145 54.783 0.362 1 1 934 . 9 1 1 A 86 86 ALA CB C 86 18.165 18.269 -0.104 1 1 935 . 9 1 1 A 86 86 ALA N N 86 119.636 122.761 -3.125 1 1 936 . 9 1 1 A 87 87 ALA H H 87 7.214 7.802 -0.588 1 1 937 . 9 1 1 A 87 87 ALA HA H 87 4.244 4.035 0.209 1 1 941 . 9 1 1 A 87 87 ALA C C 87 180.354 180.174 0.180 1 1 942 . 9 1 1 A 87 87 ALA CA C 87 54.378 55.031 -0.653 1 1 943 . 9 1 1 A 87 87 ALA CB C 87 18.795 18.572 0.223 1 1 944 . 9 1 1 A 87 87 ALA N N 87 121.004 120.684 0.320 1 1 945 . 9 1 1 A 88 88 ILE H H 88 8.471 7.736 0.735 1 1 946 . 9 1 1 A 88 88 ILE HA H 88 3.360 3.744 -0.384 1 1 954 . 9 1 1 A 88 88 ILE CA C 88 66.323 64.502 1.821 1 1 955 . 9 1 1 A 88 88 ILE CB C 88 37.808 37.619 0.189 1 1 958 . 9 1 1 A 88 88 ILE N N 88 120.743 119.467 1.276 1 1 959 . 9 1 1 A 89 89 VAL H H 89 8.343 8.448 -0.105 1 1 960 . 9 1 1 A 89 89 VAL HA H 89 3.061 3.497 -0.436 1 1 968 . 9 1 1 A 89 89 VAL C C 89 176.708 178.085 -1.377 1 1 969 . 9 1 1 A 89 89 VAL CA C 89 67.833 66.480 1.353 1 1 970 . 9 1 1 A 89 89 VAL CB C 89 31.509 31.323 0.186 1 1 973 . 9 1 1 A 89 89 VAL N N 89 118.049 119.980 -1.931 1 1 974 . 9 1 1 A 90 90 ALA H H 90 7.516 8.059 -0.543 1 1 975 . 9 1 1 A 90 90 ALA HA H 90 3.987 3.842 0.145 1 1 979 . 9 1 1 A 90 90 ALA C C 90 180.744 179.223 1.521 1 1 980 . 9 1 1 A 90 90 ALA CA C 90 55.481 55.764 -0.283 1 1 981 . 9 1 1 A 90 90 ALA CB C 90 17.953 18.253 -0.300 1 1 982 . 9 1 1 A 90 90 ALA N N 90 118.935 122.100 -3.165 1 1 983 . 9 1 1 A 91 91 GLN H H 91 7.886 7.956 -0.070 1 1 984 . 9 1 1 A 91 91 GLN HA H 91 4.190 4.074 0.116 1 1 991 . 9 1 1 A 91 91 GLN C C 91 178.832 178.427 0.405 1 1 992 . 9 1 1 A 91 91 GLN CA C 91 58.519 58.817 -0.298 1 1 993 . 9 1 1 A 91 91 GLN CB C 91 28.091 28.170 -0.079 1 1 995 . 9 1 1 A 91 91 GLN N N 91 117.846 117.902 -0.056 1 1 997 . 9 1 1 A 92 92 LEU H H 92 8.751 8.805 -0.054 1 1 998 . 9 1 1 A 92 92 LEU HA H 92 3.903 4.047 -0.144 1 1 1007 . 9 1 1 A 92 92 LEU C C 92 178.997 179.058 -0.061 1 1 1008 . 9 1 1 A 92 92 LEU CA C 92 58.136 57.782 0.354 1 1 1009 . 9 1 1 A 92 92 LEU CB C 92 41.576 41.275 0.301 1 1 1013 . 9 1 1 A 92 92 LEU N N 92 119.547 119.573 -0.026 1 1 1014 . 9 1 1 A 93 93 PHE H H 93 8.648 8.074 0.574 1 1 1015 . 9 1 1 A 93 93 PHE HA H 93 4.270 4.761 -0.491 1 1 1020 . 9 1 1 A 93 93 PHE C C 93 179.283 178.784 0.499 1 1 1021 . 9 1 1 A 93 93 PHE CA C 93 59.860 60.441 -0.581 1 1 1022 . 9 1 1 A 93 93 PHE CB C 93 37.765 38.296 -0.531 1 1 1025 . 9 1 1 A 93 93 PHE N N 93 118.041 118.642 -0.601 1 1 1026 . 9 1 1 A 94 94 GLU H H 94 7.739 8.288 -0.549 1 1 1027 . 9 1 1 A 94 94 GLU HA H 94 4.110 4.137 -0.027 1 1 1031 . 9 1 1 A 94 94 GLU C C 94 178.629 178.879 -0.250 1 1 1032 . 9 1 1 A 94 94 GLU CA C 94 59.359 59.380 -0.021 1 1 1033 . 9 1 1 A 94 94 GLU CB C 94 29.589 28.815 0.774 1 1 1035 . 9 1 1 A 94 94 GLU N N 94 119.980 117.219 2.761 1 1 1036 . 9 1 1 A 95 95 LEU H H 95 7.999 8.155 -0.156 1 1 1037 . 9 1 1 A 95 95 LEU HA H 95 4.139 3.913 0.226 1 1 1047 . 9 1 1 A 95 95 LEU C C 95 178.965 178.167 0.798 1 1 1048 . 9 1 1 A 95 95 LEU CA C 95 57.557 57.813 -0.256 1 1 1049 . 9 1 1 A 95 95 LEU CB C 95 43.443 41.672 1.771 1 1 1053 . 9 1 1 A 95 95 LEU N N 95 118.398 121.587 -3.189 1 1 1054 . 9 1 1 A 96 96 LEU H H 96 8.363 8.201 0.162 1 1 1055 . 9 1 1 A 96 96 LEU HA H 96 4.503 4.382 0.121 1 1 1061 . 9 1 1 A 96 96 LEU C C 96 177.932 177.029 0.903 1 1 1062 . 9 1 1 A 96 96 LEU CA C 96 54.700 55.542 -0.842 1 1 1063 . 9 1 1 A 96 96 LEU CB C 96 43.048 43.096 -0.048 1 1 1065 . 9 1 1 A 96 96 LEU N N 96 114.720 117.814 -3.094 1 1 1066 . 9 1 1 A 97 97 GLY H H 97 7.810 7.626 0.184 1 1 1067 . 9 1 1 A 97 97 GLY HA2 H 97 3.963 3.898 0.065 1 1 1068 . 9 1 1 A 97 97 GLY C C 97 173.535 175.074 -1.539 1 1 1069 . 9 1 1 A 97 97 GLY CA C 97 45.667 46.624 -0.957 1 1 1070 . 9 1 1 A 97 97 GLY N N 97 109.511 107.712 1.799 1 1 1071 . 9 1 1 A 98 98 SER H H 98 8.131 7.996 0.135 1 1 1072 . 9 1 1 A 98 98 SER HA H 98 4.225 4.025 0.200 1 1 1075 . 9 1 1 A 98 98 SER C C 98 174.974 175.000 -0.026 1 1 1076 . 9 1 1 A 98 98 SER CA C 98 57.960 60.839 -2.879 1 1 1077 . 9 1 1 A 98 98 SER CB C 98 63.997 62.780 1.217 1 1 1078 . 9 1 1 A 98 98 SER N N 98 113.405 113.491 -0.086 1 1 1079 . 9 1 1 A 99 99 GLY H H 99 8.052 7.886 0.166 1 1 1080 . 9 1 1 A 99 99 GLY HA2 H 99 3.998 3.879 0.119 1 1 1081 . 9 1 1 A 99 99 GLY HA3 H 99 3.778 3.928 -0.150 1 1 1082 . 9 1 1 A 99 99 GLY C C 99 174.033 173.781 0.252 1 1 1083 . 9 1 1 A 99 99 GLY CA C 99 45.123 46.724 -1.601 1 1 1084 . 9 1 1 A 99 99 GLY N N 99 111.534 108.242 3.292 1 1 1085 . 9 1 1 A 100 100 GLU H H 100 8.177 8.569 -0.392 1 1 1086 . 9 1 1 A 100 100 GLU HA H 100 4.201 4.115 0.086 1 1 1091 . 9 1 1 A 100 100 GLU C C 100 175.830 175.987 -0.157 1 1 1092 . 9 1 1 A 100 100 GLU CA C 100 56.442 58.579 -2.137 1 1 1093 . 9 1 1 A 100 100 GLU CB C 100 30.428 28.228 2.200 1 1 1095 . 9 1 1 A 100 100 GLU N N 100 120.463 122.258 -1.795 1 1 1096 . 9 1 1 A 101 101 GLN H H 101 8.161 8.330 -0.169 1 1 1097 . 9 1 1 A 101 101 GLN HA H 101 4.098 4.995 -0.897 1 1 1103 . 9 1 1 A 101 101 GLN C C 101 175.412 175.359 0.053 1 1 1104 . 9 1 1 A 101 101 GLN CA C 101 55.632 54.721 0.911 1 1 1105 . 9 1 1 A 101 101 GLN CB C 101 29.569 31.430 -1.861 1 1 1107 . 9 1 1 A 101 101 GLN N N 101 120.014 118.300 1.714 1 1 1109 . 9 1 1 A 102 102 LYS H H 102 8.235 8.718 -0.483 1 1 1110 . 9 1 1 A 102 102 LYS HA H 102 4.387 4.192 0.195 1 1 1117 . 9 1 1 A 102 102 LYS CA C 102 54.116 54.133 -0.017 1 1 1118 . 9 1 1 A 102 102 LYS CB C 102 32.478 32.133 0.345 1 1 1122 . 9 1 1 A 102 102 LYS N N 102 123.399 122.480 0.919 1 1 1123 . 9 1 1 A 103 103 PRO HA H 103 4.498 4.490 0.008 1 1 1129 . 9 1 1 A 103 103 PRO C C 103 175.473 176.568 -1.095 1 1 1130 . 9 1 1 A 103 103 PRO CA C 103 62.802 63.888 -1.086 1 1 1131 . 9 1 1 A 103 103 PRO CB C 103 32.124 32.029 0.095 1 1 1134 . 9 1 1 A 104 104 ALA H H 104 8.017 7.795 0.222 1 1 1135 . 9 1 1 A 104 104 ALA HA H 104 4.318 3.877 0.441 1 1 1139 . 9 1 1 A 104 104 ALA C C 104 176.717 176.534 0.183 1 1 1140 . 9 1 1 A 104 104 ALA CA C 104 52.194 54.212 -2.018 1 1 1141 . 9 1 1 A 104 104 ALA CB C 104 20.113 17.709 2.404 1 1 1142 . 9 1 1 A 104 104 ALA N N 104 122.093 119.757 2.336 1 1 1143 . 9 1 1 A 105 105 GLY H H 105 7.678 7.928 -0.250 1 1 1144 . 9 1 1 A 105 105 GLY HA2 H 105 3.851 3.984 -0.133 1 1 1145 . 9 1 1 A 105 105 GLY HA3 H 105 4.053 4.000 0.053 1 1 1146 . 9 1 1 A 105 105 GLY C C 105 172.990 174.714 -1.724 1 1 1147 . 9 1 1 A 105 105 GLY CA C 105 44.241 44.026 0.215 1 1 1148 . 9 1 1 A 105 105 GLY N N 105 105.234 106.269 -1.035 1 1 1149 . 9 1 1 A 106 106 VAL H H 106 8.409 8.449 -0.040 1 1 1150 . 9 1 1 A 106 106 VAL HA H 106 2.829 3.276 -0.447 1 1 1158 . 9 1 1 A 106 106 VAL C C 106 177.822 177.206 0.616 1 1 1159 . 9 1 1 A 106 106 VAL CA C 106 65.522 65.615 -0.093 1 1 1160 . 9 1 1 A 106 106 VAL CB C 106 30.701 30.934 -0.233 1 1 1163 . 9 1 1 A 106 106 VAL N N 106 119.215 122.949 -3.734 1 1 1164 . 9 1 1 A 107 107 ALA H H 107 8.707 8.289 0.418 1 1 1165 . 9 1 1 A 107 107 ALA HA H 107 3.730 3.792 -0.062 1 1 1169 . 9 1 1 A 107 107 ALA C C 107 179.661 179.902 -0.241 1 1 1170 . 9 1 1 A 107 107 ALA CA C 107 54.995 55.274 -0.279 1 1 1171 . 9 1 1 A 107 107 ALA CB C 107 17.705 18.089 -0.384 1 1 1172 . 9 1 1 A 107 107 ALA N N 107 118.672 121.881 -3.209 1 1 1173 . 9 1 1 A 108 108 ALA H H 108 7.388 7.912 -0.524 1 1 1174 . 9 1 1 A 108 108 ALA HA H 108 4.259 4.027 0.232 1 1 1178 . 9 1 1 A 108 108 ALA C C 108 179.318 179.344 -0.026 1 1 1179 . 9 1 1 A 108 108 ALA CA C 108 53.481 55.065 -1.584 1 1 1180 . 9 1 1 A 108 108 ALA CB C 108 19.367 18.540 0.827 1 1 1181 . 9 1 1 A 108 108 ALA N N 108 116.635 120.635 -4.000 1 1 1182 . 9 1 1 A 109 109 VAL H H 109 7.689 7.785 -0.096 1 1 1183 . 9 1 1 A 109 109 VAL HA H 109 4.532 3.773 0.759 1 1 1191 . 9 1 1 A 109 109 VAL C C 109 176.055 177.960 -1.905 1 1 1192 . 9 1 1 A 109 109 VAL CA C 109 61.452 65.684 -4.232 1 1 1193 . 9 1 1 A 109 109 VAL CB C 109 32.728 31.331 1.397 1 1 1196 . 9 1 1 A 109 109 VAL N N 109 112.851 116.834 -3.983 1 1 1197 . 9 1 1 A 110 110 LEU H H 110 7.099 8.262 -1.163 1 1 1198 . 9 1 1 A 110 110 LEU HA H 110 3.723 3.786 -0.063 1 1 1208 . 9 1 1 A 110 110 LEU C C 110 179.040 178.784 0.256 1 1 1209 . 9 1 1 A 110 110 LEU CA C 110 58.825 57.869 0.956 1 1 1210 . 9 1 1 A 110 110 LEU CB C 110 41.242 41.737 -0.495 1 1 1214 . 9 1 1 A 110 110 LEU N N 110 119.829 124.994 -5.165 1 1 1215 . 9 1 1 A 111 111 GLY H H 111 8.435 7.943 0.492 1 1 1216 . 9 1 1 A 111 111 GLY HA2 H 111 3.970 3.820 0.150 1 1 1217 . 9 1 1 A 111 111 GLY HA3 H 111 3.885 3.829 0.056 1 1 1218 . 9 1 1 A 111 111 GLY C C 111 178.031 176.510 1.521 1 1 1219 . 9 1 1 A 111 111 GLY CA C 111 46.961 47.221 -0.260 1 1 1220 . 9 1 1 A 111 111 GLY N N 111 104.089 106.489 -2.400 1 1 1221 . 9 1 1 A 112 112 SER H H 112 8.343 7.859 0.484 1 1 1222 . 9 1 1 A 112 112 SER HA H 112 4.266 4.236 0.030 1 1 1224 . 9 1 1 A 112 112 SER C C 112 175.885 175.803 0.082 1 1 1225 . 9 1 1 A 112 112 SER CA C 112 61.304 62.359 -1.055 1 1 1226 . 9 1 1 A 112 112 SER CB C 112 62.901 63.265 -0.364 1 1 1227 . 9 1 1 A 112 112 SER N N 112 119.497 119.788 -0.291 1 1 1228 . 9 1 1 A 113 113 LEU H H 113 7.667 8.194 -0.527 1 1 1229 . 9 1 1 A 113 113 LEU HA H 113 4.343 4.184 0.159 1 1 1238 . 9 1 1 A 113 113 LEU C C 113 174.760 175.908 -1.148 1 1 1239 . 9 1 1 A 113 113 LEU CA C 113 54.228 54.821 -0.593 1 1 1240 . 9 1 1 A 113 113 LEU CB C 113 41.467 42.385 -0.918 1 1 1244 . 9 1 1 A 113 113 LEU N N 113 118.843 118.020 0.823 1 1 1245 . 9 1 1 A 114 114 LYS H H 114 7.685 7.678 0.007 1 1 1246 . 9 1 1 A 114 114 LYS HA H 114 3.958 3.883 0.075 1 1 1250 . 9 1 1 A 114 114 LYS C C 114 177.557 175.759 1.798 1 1 1251 . 9 1 1 A 114 114 LYS CA C 114 56.935 57.444 -0.509 1 1 1252 . 9 1 1 A 114 114 LYS CB C 114 28.898 29.415 -0.517 1 1 1254 . 9 1 1 A 114 114 LYS N N 114 114.072 116.312 -2.240 1 1 1255 . 9 1 1 A 115 115 LEU H H 115 8.329 7.881 0.448 1 1 1256 . 9 1 1 A 115 115 LEU HA H 115 4.315 4.321 -0.006 1 1 1265 . 9 1 1 A 115 115 LEU C C 115 175.988 176.949 -0.961 1 1 1266 . 9 1 1 A 115 115 LEU CA C 115 54.310 55.208 -0.898 1 1 1267 . 9 1 1 A 115 115 LEU CB C 115 44.163 42.025 2.138 1 1 1270 . 9 1 1 A 115 115 LEU N N 115 117.951 119.944 -1.993 1 1 1271 . 9 1 1 A 116 116 GLN H H 116 9.100 8.330 0.770 1 1 1272 . 9 1 1 A 116 116 GLN HA H 116 4.898 4.503 0.395 1 1 1279 . 9 1 1 A 116 116 GLN CA C 116 53.467 55.589 -2.122 1 1 1280 . 9 1 1 A 116 116 GLN CB C 116 32.730 29.714 3.016 1 1 1282 . 9 1 1 A 116 116 GLN N N 116 119.994 122.909 -2.915 1 1 1284 . 9 1 1 A 117 117 GLU H H 117 8.849 8.529 0.320 1 1 1285 . 9 1 1 A 117 117 GLU HA H 117 3.707 3.737 -0.030 1 1 1290 . 9 1 1 A 117 117 GLU C C 117 177.303 176.446 0.857 1 1 1291 . 9 1 1 A 117 117 GLU CA C 117 57.233 55.179 2.054 1 1 1292 . 9 1 1 A 117 117 GLU CB C 117 29.634 28.773 0.861 1 1 1294 . 9 1 1 A 117 117 GLU N N 117 121.487 123.265 -1.778 1 1 1295 . 9 1 1 A 118 118 VAL H H 118 8.983 8.490 0.493 1 1 1296 . 9 1 1 A 118 118 VAL HA H 118 4.360 4.003 0.357 1 1 1304 . 9 1 1 A 118 118 VAL C C 118 174.171 175.195 -1.024 1 1 1305 . 9 1 1 A 118 118 VAL CA C 118 61.772 64.137 -2.365 1 1 1306 . 9 1 1 A 118 118 VAL CB C 118 34.095 32.829 1.266 1 1 1309 . 9 1 1 A 118 118 VAL N N 118 122.933 127.465 -4.532 1 1 1310 . 9 1 1 A 119 119 ALA H H 119 7.023 7.103 -0.080 1 1 1311 . 9 1 1 A 119 119 ALA HA H 119 4.378 4.410 -0.032 1 1 1315 . 9 1 1 A 119 119 ALA C C 119 175.493 175.298 0.195 1 1 1316 . 9 1 1 A 119 119 ALA CA C 119 51.956 50.665 1.291 1 1 1317 . 9 1 1 A 119 119 ALA CB C 119 23.957 21.641 2.316 1 1 1318 . 9 1 1 A 119 119 ALA N N 119 117.379 121.360 -3.981 1 1 1319 . 9 1 1 A 120 120 SER H H 120 6.999 8.775 -1.776 1 1 1320 . 9 1 1 A 120 120 SER HA H 120 5.208 5.397 -0.189 1 1 1323 . 9 1 1 A 120 120 SER C C 120 173.082 173.136 -0.054 1 1 1324 . 9 1 1 A 120 120 SER CA C 120 56.754 56.476 0.278 1 1 1325 . 9 1 1 A 120 120 SER CB C 120 64.605 65.656 -1.051 1 1 1326 . 9 1 1 A 120 120 SER N N 120 113.743 116.751 -3.008 1 1 1327 . 9 1 1 A 121 121 PHE H H 121 8.244 9.008 -0.764 1 1 1328 . 9 1 1 A 121 121 PHE HA H 121 5.177 5.012 0.165 1 1 1333 . 9 1 1 A 121 121 PHE C C 121 173.569 172.258 1.311 1 1 1334 . 9 1 1 A 121 121 PHE CA C 121 55.555 55.396 0.159 1 1 1335 . 9 1 1 A 121 121 PHE CB C 121 40.959 41.532 -0.573 1 1 1338 . 9 1 1 A 121 121 PHE N N 121 120.358 118.346 2.012 1 1 1339 . 9 1 1 A 122 122 ILE H H 122 8.907 8.577 0.330 1 1 1340 . 9 1 1 A 122 122 ILE HA H 122 4.682 4.785 -0.103 1 1 1348 . 9 1 1 A 122 122 ILE C C 122 176.925 175.050 1.875 1 1 1349 . 9 1 1 A 122 122 ILE CA C 122 60.740 59.616 1.124 1 1 1350 . 9 1 1 A 122 122 ILE CB C 122 39.497 41.059 -1.562 1 1 1353 . 9 1 1 A 122 122 ILE N N 122 121.282 119.434 1.848 1 1 1354 . 9 1 1 A 123 123 THR H H 123 9.022 8.769 0.253 1 1 1355 . 9 1 1 A 123 123 THR HA H 123 5.039 4.508 0.531 1 1 1360 . 9 1 1 A 123 123 THR C C 123 173.531 173.828 -0.297 1 1 1361 . 9 1 1 A 123 123 THR CA C 123 62.266 61.803 0.463 1 1 1362 . 9 1 1 A 123 123 THR CB C 123 70.677 68.585 2.092 1 1 1364 . 9 1 1 A 123 123 THR N N 123 128.965 123.291 5.674 1 1 1365 . 9 1 1 A 124 124 THR H H 124 8.961 9.197 -0.236 1 1 1366 . 9 1 1 A 124 124 THR HA H 124 5.001 4.838 0.163 1 1 1371 . 9 1 1 A 124 124 THR C C 124 173.468 172.765 0.703 1 1 1372 . 9 1 1 A 124 124 THR CA C 124 62.109 61.565 0.544 1 1 1373 . 9 1 1 A 124 124 THR CB C 124 70.450 69.344 1.106 1 1 1375 . 9 1 1 A 124 124 THR N N 124 122.176 123.596 -1.420 1 1 1376 . 9 1 1 A 125 125 ARG H H 125 9.386 9.475 -0.089 1 1 1377 . 9 1 1 A 125 125 ARG HA H 125 5.764 5.154 0.610 1 1 1384 . 9 1 1 A 125 125 ARG C C 125 175.713 174.837 0.876 1 1 1385 . 9 1 1 A 125 125 ARG CA C 125 53.991 54.184 -0.193 1 1 1386 . 9 1 1 A 125 125 ARG CB C 125 33.557 32.909 0.648 1 1 1389 . 9 1 1 A 125 125 ARG N N 125 130.004 128.897 1.107 1 1 1390 . 9 1 1 A 126 126 SER H H 126 9.172 9.109 0.063 1 1 1391 . 9 1 1 A 126 126 SER HA H 126 5.390 5.100 0.290 1 1 1394 . 9 1 1 A 126 126 SER C C 126 172.359 172.768 -0.409 1 1 1395 . 9 1 1 A 126 126 SER CA C 126 56.934 57.010 -0.076 1 1 1396 . 9 1 1 A 126 126 SER CB C 126 65.827 65.411 0.416 1 1 1397 . 9 1 1 A 126 126 SER N N 126 119.906 121.153 -1.247 1 1 1398 . 9 1 1 A 127 127 SER H H 127 8.591 9.274 -0.683 1 1 1399 . 9 1 1 A 127 127 SER HA H 127 5.739 5.624 0.115 1 1 1401 . 9 1 1 A 127 127 SER C C 127 173.283 173.465 -0.182 1 1 1402 . 9 1 1 A 127 127 SER CA C 127 57.354 56.498 0.856 1 1 1403 . 9 1 1 A 127 127 SER CB C 127 65.412 65.106 0.306 1 1 1404 . 9 1 1 A 127 127 SER N N 127 117.914 119.752 -1.838 1 1 1405 . 9 1 1 A 128 128 TRP H H 128 9.866 9.370 0.496 1 1 1406 . 9 1 1 A 128 128 TRP HA H 128 5.560 5.534 0.026 1 1 1415 . 9 1 1 A 128 128 TRP C C 128 175.828 175.369 0.459 1 1 1416 . 9 1 1 A 128 128 TRP CA C 128 55.852 55.584 0.268 1 1 1417 . 9 1 1 A 128 128 TRP CB C 128 32.524 33.656 -1.132 1 1 1423 . 9 1 1 A 128 128 TRP N N 128 127.978 123.379 4.599 1 1 1425 . 9 1 1 A 129 129 LYS H H 129 9.424 9.273 0.151 1 1 1426 . 9 1 1 A 129 129 LYS HA H 129 5.388 5.188 0.200 1 1 1433 . 9 1 1 A 129 129 LYS C C 129 175.254 174.432 0.822 1 1 1434 . 9 1 1 A 129 129 LYS CA C 129 54.410 54.641 -0.231 1 1 1435 . 9 1 1 A 129 129 LYS CB C 129 35.734 37.425 -1.691 1 1 1439 . 9 1 1 A 129 129 LYS N N 129 121.784 118.966 2.818 1 1 1440 . 9 1 1 A 130 130 LEU H H 130 8.933 8.988 -0.055 1 1 1441 . 9 1 1 A 130 130 LEU HA H 130 4.859 4.852 0.007 1 1 1447 . 9 1 1 A 130 130 LEU C C 130 173.893 174.275 -0.382 1 1 1448 . 9 1 1 A 130 130 LEU CA C 130 53.848 54.436 -0.588 1 1 1449 . 9 1 1 A 130 130 LEU CB C 130 46.125 46.155 -0.030 1 1 1451 . 9 1 1 A 130 130 LEU N N 130 124.543 121.943 2.600 1 1 1452 . 9 1 1 A 131 131 ALA H H 131 8.816 8.823 -0.007 1 1 1453 . 9 1 1 A 131 131 ALA HA H 131 4.776 4.870 -0.094 1 1 1457 . 9 1 1 A 131 131 ALA C C 131 176.662 176.817 -0.155 1 1 1458 . 9 1 1 A 131 131 ALA CA C 131 51.407 50.801 0.606 1 1 1459 . 9 1 1 A 131 131 ALA CB C 131 19.354 20.199 -0.845 1 1 1460 . 9 1 1 A 131 131 ALA N N 131 131.102 129.181 1.921 1 1 1461 . 9 1 1 A 132 132 LEU H H 132 8.487 8.778 -0.291 1 1 1462 . 9 1 1 A 132 132 LEU HA H 132 4.470 4.570 -0.100 1 1 1470 . 9 1 1 A 132 132 LEU C C 132 176.873 176.370 0.503 1 1 1471 . 9 1 1 A 132 132 LEU CA C 132 54.590 54.353 0.237 1 1 1472 . 9 1 1 A 132 132 LEU CB C 132 42.974 42.884 0.090 1 1 1475 . 9 1 1 A 132 132 LEU N N 132 123.724 125.902 -2.178 1 1 1476 . 9 1 1 A 133 133 SER H H 133 8.448 8.847 -0.399 1 1 1477 . 9 1 1 A 133 133 SER HA H 133 4.560 4.761 -0.201 1 1 1479 . 9 1 1 A 133 133 SER C C 133 176.043 175.524 0.519 1 1 1480 . 9 1 1 A 133 133 SER CA C 133 58.460 58.778 -0.318 1 1 1481 . 9 1 1 A 133 133 SER CB C 133 63.985 65.846 -1.861 1 1 1482 . 9 1 1 A 133 133 SER N N 133 115.880 117.268 -1.388 1 1 1483 . 9 1 1 A 134 134 GLY H H 134 8.232 7.987 0.245 1 1 1484 . 9 1 1 A 134 134 GLY HA2 H 134 4.147 3.856 0.291 1 1 1485 . 9 1 1 A 134 134 GLY HA3 H 134 4.045 3.860 0.185 1 1 1486 . 9 1 1 A 134 134 GLY C C 134 174.013 174.594 -0.581 1 1 1487 . 9 1 1 A 134 134 GLY CA C 134 45.337 47.083 -1.746 1 1 1488 . 9 1 1 A 134 134 GLY N N 134 109.970 109.466 0.504 1 1 1489 . 9 1 1 A 135 135 ALA H H 135 8.424 8.453 -0.029 1 1 1490 . 9 1 1 A 135 135 ALA HA H 135 4.436 4.357 0.079 1 1 1494 . 9 1 1 A 135 135 ALA C C 135 177.537 176.083 1.454 1 1 1495 . 9 1 1 A 135 135 ALA CA C 135 52.721 53.304 -0.583 1 1 1496 . 9 1 1 A 135 135 ALA CB C 135 19.265 20.346 -1.081 1 1 1497 . 9 1 1 A 135 135 ALA N N 135 124.118 128.997 -4.879 1 1 1498 . 9 1 1 A 136 136 HIS H H 136 8.466 7.807 0.659 1 1 1499 . 9 1 1 A 136 136 HIS HA H 136 4.379 4.957 -0.578 1 1 1500 . 9 1 1 A 136 136 HIS C C 136 176.259 173.920 2.339 1 1 1501 . 9 1 1 A 136 136 HIS CA C 136 56.082 54.958 1.124 1 1 1502 . 9 1 1 A 136 136 HIS CB C 136 29.619 33.692 -4.073 1 1 1503 . 9 1 1 A 136 136 HIS N N 136 119.493 112.613 6.880 1 1 1504 . 9 1 1 A 137 137 GLY H H 137 8.431 8.527 -0.096 1 1 1505 . 9 1 1 A 137 137 GLY HA2 H 137 4.151 4.056 0.095 1 1 1506 . 9 1 1 A 137 137 GLY HA3 H 137 3.893 4.058 -0.165 1 1 1507 . 9 1 1 A 137 137 GLY C C 137 174.039 173.166 0.873 1 1 1508 . 9 1 1 A 137 137 GLY CA C 137 45.372 44.016 1.356 1 1 1509 . 9 1 1 A 137 137 GLY N N 137 110.442 109.017 1.425 1 1 1510 . 9 1 1 A 138 138 GLN H H 138 8.416 8.280 0.136 1 1 1511 . 9 1 1 A 138 138 GLN HA H 138 4.455 4.514 -0.059 1 1 1515 . 9 1 1 A 138 138 GLN C C 138 175.889 175.112 0.777 1 1 1516 . 9 1 1 A 138 138 GLN CA C 138 55.866 55.836 0.030 1 1 1517 . 9 1 1 A 138 138 GLN CB C 138 29.639 30.145 -0.506 1 1 1518 . 9 1 1 A 138 138 GLN N N 138 119.401 120.484 -1.083 1 1 1519 . 9 1 1 A 139 139 GLU H H 139 8.446 9.075 -0.629 1 1 1520 . 9 1 1 A 139 139 GLU HA H 139 4.658 5.238 -0.580 1 1 1524 . 9 1 1 A 139 139 GLU CA C 139 54.589 53.394 1.195 1 1 1525 . 9 1 1 A 139 139 GLU CB C 139 29.733 30.923 -1.190 1 1 1527 . 9 1 1 A 139 139 GLU N N 139 123.136 118.289 4.847 1 1 1528 . 9 1 1 A 140 140 PRO HA H 140 4.537 4.833 -0.296 1 1 1533 . 9 1 1 A 140 140 PRO C C 140 176.119 175.970 0.149 1 1 1534 . 9 1 1 A 140 140 PRO CA C 140 63.220 62.326 0.894 1 1 1535 . 9 1 1 A 140 140 PRO CB C 140 31.936 31.858 0.078 1 1 1538 . 9 1 1 A 141 141 GLN H H 141 8.506 8.508 -0.002 1 1 1539 . 9 1 1 A 141 141 GLN HA H 141 4.650 4.972 -0.322 1 1 1546 . 9 1 1 A 141 141 GLN C C 141 175.811 175.889 -0.078 1 1 1547 . 9 1 1 A 141 141 GLN CA C 141 55.912 54.988 0.924 1 1 1548 . 9 1 1 A 141 141 GLN CB C 141 30.241 30.377 -0.136 1 1 1550 . 9 1 1 A 141 141 GLN N N 141 120.422 122.476 -2.054 1 1 1551 . 9 1 1 A 142 142 LEU H H 142 8.842 9.165 -0.323 1 1 1552 . 9 1 1 A 142 142 LEU HA H 142 5.277 5.232 0.045 1 1 1562 . 9 1 1 A 142 142 LEU C C 142 176.839 175.233 1.606 1 1 1563 . 9 1 1 A 142 142 LEU CA C 142 53.927 52.928 0.999 1 1 1564 . 9 1 1 A 142 142 LEU CB C 142 44.527 44.461 0.066 1 1 1568 . 9 1 1 A 142 142 LEU N N 142 123.692 122.366 1.326 1 1 1569 . 9 1 1 A 143 143 THR H H 143 9.025 9.204 -0.179 1 1 1570 . 9 1 1 A 143 143 THR HA H 143 5.262 5.106 0.156 1 1 1575 . 9 1 1 A 143 143 THR C C 143 173.753 173.589 0.164 1 1 1576 . 9 1 1 A 143 143 THR CA C 143 61.795 61.741 0.054 1 1 1577 . 9 1 1 A 143 143 THR CB C 143 70.660 70.869 -0.209 1 1 1579 . 9 1 1 A 143 143 THR N N 143 117.222 115.222 2.000 1 1 1580 . 9 1 1 A 144 144 ILE H H 144 9.353 10.174 -0.821 1 1 1581 . 9 1 1 A 144 144 ILE HA H 144 5.399 5.093 0.306 1 1 1591 . 9 1 1 A 144 144 ILE C C 144 173.931 173.752 0.179 1 1 1592 . 9 1 1 A 144 144 ILE CA C 144 60.774 60.469 0.305 1 1 1593 . 9 1 1 A 144 144 ILE CB C 144 41.111 39.789 1.322 1 1 1597 . 9 1 1 A 144 144 ILE N N 144 126.383 127.631 -1.248 1 1 1598 . 9 1 1 A 145 145 ASP H H 145 9.214 9.436 -0.222 1 1 1599 . 9 1 1 A 145 145 ASP HA H 145 5.978 5.312 0.666 1 1 1601 . 9 1 1 A 145 145 ASP C C 145 175.441 174.997 0.444 1 1 1602 . 9 1 1 A 145 145 ASP CA C 145 53.035 52.982 0.053 1 1 1603 . 9 1 1 A 145 145 ASP CB C 145 44.153 42.611 1.542 1 1 1604 . 9 1 1 A 145 145 ASP N N 145 127.981 128.630 -0.649 1 1 1605 . 9 1 1 A 146 146 LEU H H 146 9.387 9.597 -0.210 1 1 1606 . 9 1 1 A 146 146 LEU HA H 146 4.918 5.373 -0.455 1 1 1616 . 9 1 1 A 146 146 LEU C C 146 175.003 174.588 0.415 1 1 1617 . 9 1 1 A 146 146 LEU CA C 146 53.940 53.499 0.441 1 1 1618 . 9 1 1 A 146 146 LEU CB C 146 43.902 43.262 0.640 1 1 1622 . 9 1 1 A 146 146 LEU N N 146 123.532 127.702 -4.170 1 1 1623 . 9 1 1 A 147 147 ASP H H 147 8.676 8.854 -0.178 1 1 1624 . 9 1 1 A 147 147 ASP HA H 147 5.205 5.238 -0.033 1 1 1627 . 9 1 1 A 147 147 ASP C C 147 174.956 174.148 0.808 1 1 1628 . 9 1 1 A 147 147 ASP CA C 147 53.441 52.465 0.976 1 1 1629 . 9 1 1 A 147 147 ASP CB C 147 43.370 43.325 0.045 1 1 1630 . 9 1 1 A 147 147 ASP N N 147 125.499 126.051 -0.552 1 1 1631 . 9 1 1 A 148 148 SER H H 148 8.732 9.204 -0.472 1 1 1632 . 9 1 1 A 148 148 SER HA H 148 5.365 5.180 0.185 1 1 1634 . 9 1 1 A 148 148 SER C C 148 173.217 172.437 0.780 1 1 1635 . 9 1 1 A 148 148 SER CA C 148 56.334 56.126 0.208 1 1 1636 . 9 1 1 A 148 148 SER CB C 148 65.812 66.167 -0.355 1 1 1637 . 9 1 1 A 148 148 SER N N 148 118.623 121.127 -2.504 1 1 1638 . 9 1 1 A 149 149 ALA H H 149 8.937 8.793 0.144 1 1 1639 . 9 1 1 A 149 149 ALA HA H 149 5.681 4.903 0.778 1 1 1643 . 9 1 1 A 149 149 ALA C C 149 178.894 177.823 1.071 1 1 1644 . 9 1 1 A 149 149 ALA CA C 149 49.996 49.881 0.115 1 1 1645 . 9 1 1 A 149 149 ALA CB C 149 23.231 22.744 0.487 1 1 1646 . 9 1 1 A 149 149 ALA N N 149 123.952 126.174 -2.222 1 1 1647 . 9 1 1 A 150 150 ASP H H 150 9.010 8.545 0.465 1 1 1648 . 9 1 1 A 150 150 ASP HA H 150 4.336 4.310 0.026 1 1 1651 . 9 1 1 A 150 150 ASP C C 150 176.697 177.073 -0.376 1 1 1652 . 9 1 1 A 150 150 ASP CA C 150 56.543 57.218 -0.675 1 1 1653 . 9 1 1 A 150 150 ASP CB C 150 39.850 40.490 -0.640 1 1 1654 . 9 1 1 A 150 150 ASP N N 150 122.687 121.502 1.185 1 1 1655 . 9 1 1 A 151 151 PHE H H 151 7.295 7.617 -0.322 1 1 1656 . 9 1 1 A 151 151 PHE HA H 151 5.020 4.704 0.316 1 1 1661 . 9 1 1 A 151 151 PHE C C 151 174.756 175.522 -0.766 1 1 1662 . 9 1 1 A 151 151 PHE CA C 151 56.594 56.959 -0.365 1 1 1663 . 9 1 1 A 151 151 PHE CB C 151 37.765 37.003 0.762 1 1 1666 . 9 1 1 A 151 151 PHE N N 151 113.928 115.573 -1.645 1 1 1667 . 9 1 1 A 152 152 GLY H H 152 7.786 8.194 -0.408 1 1 1668 . 9 1 1 A 152 152 GLY HA2 H 152 4.459 3.995 0.464 1 1 1669 . 9 1 1 A 152 152 GLY HA3 H 152 3.728 4.012 -0.284 1 1 1670 . 9 1 1 A 152 152 GLY C C 152 172.709 173.541 -0.832 1 1 1671 . 9 1 1 A 152 152 GLY CA C 152 46.106 47.211 -1.105 1 1 1672 . 9 1 1 A 152 152 GLY N N 152 110.312 108.076 2.236 1 1 1673 . 9 1 1 A 153 153 TYR H H 153 6.650 7.248 -0.598 1 1 1674 . 9 1 1 A 153 153 TYR HA H 153 4.508 4.989 -0.481 1 1 1679 . 9 1 1 A 153 153 TYR C C 153 173.092 173.174 -0.082 1 1 1680 . 9 1 1 A 153 153 TYR CA C 153 57.464 57.437 0.027 1 1 1681 . 9 1 1 A 153 153 TYR CB C 153 41.962 42.177 -0.215 1 1 1684 . 9 1 1 A 153 153 TYR N N 153 121.977 119.270 2.707 1 1 1685 . 9 1 1 A 154 154 ALA H H 154 7.847 8.518 -0.671 1 1 1686 . 9 1 1 A 154 154 ALA HA H 154 5.144 4.669 0.475 1 1 1690 . 9 1 1 A 154 154 ALA C C 154 174.468 175.140 -0.672 1 1 1691 . 9 1 1 A 154 154 ALA CA C 154 51.776 51.303 0.473 1 1 1692 . 9 1 1 A 154 154 ALA CB C 154 21.747 20.780 0.967 1 1 1693 . 9 1 1 A 154 154 ALA N N 154 130.258 129.959 0.299 1 1 1694 . 9 1 1 A 155 155 VAL H H 155 8.733 8.816 -0.083 1 1 1695 . 9 1 1 A 155 155 VAL HA H 155 4.150 4.780 -0.630 1 1 1700 . 9 1 1 A 155 155 VAL C C 155 172.632 173.741 -1.109 1 1 1701 . 9 1 1 A 155 155 VAL CA C 155 61.451 59.334 2.117 1 1 1702 . 9 1 1 A 155 155 VAL CB C 155 35.883 35.019 0.864 1 1 1704 . 9 1 1 A 155 155 VAL N N 155 119.622 122.774 -3.152 1 1 1705 . 9 1 1 A 156 156 GLY H H 156 8.146 8.163 -0.017 1 1 1706 . 9 1 1 A 156 156 GLY HA2 H 156 5.125 2.912 2.213 1 1 1707 . 9 1 1 A 156 156 GLY HA3 H 156 2.061 4.032 -1.971 1 1 1708 . 9 1 1 A 156 156 GLY C C 156 171.746 171.445 0.301 1 1 1709 . 9 1 1 A 156 156 GLY CA C 156 43.319 43.742 -0.423 1 1 1710 . 9 1 1 A 156 156 GLY N N 156 113.332 113.210 0.122 1 1 1711 . 9 1 1 A 157 157 GLU H H 157 8.967 8.896 0.071 1 1 1712 . 9 1 1 A 157 157 GLU HA H 157 5.217 5.129 0.088 1 1 1716 . 9 1 1 A 157 157 GLU C C 157 174.476 175.444 -0.968 1 1 1717 . 9 1 1 A 157 157 GLU CA C 157 55.390 54.918 0.472 1 1 1718 . 9 1 1 A 157 157 GLU CB C 157 34.010 33.313 0.697 1 1 1720 . 9 1 1 A 157 157 GLU N N 157 120.823 122.021 -1.198 1 1 1721 . 9 1 1 A 158 158 VAL H H 158 9.076 9.664 -0.588 1 1 1722 . 9 1 1 A 158 158 VAL HA H 158 5.206 4.827 0.379 1 1 1727 . 9 1 1 A 158 158 VAL C C 158 173.900 174.192 -0.292 1 1 1728 . 9 1 1 A 158 158 VAL CA C 158 60.813 61.870 -1.057 1 1 1729 . 9 1 1 A 158 158 VAL CB C 158 33.385 32.861 0.524 1 1 1731 . 9 1 1 A 158 158 VAL N N 158 124.349 124.974 -0.625 1 1 1732 . 9 1 1 A 159 159 GLU H H 159 9.239 9.716 -0.477 1 1 1733 . 9 1 1 A 159 159 GLU HA H 159 5.647 5.110 0.537 1 1 1738 . 9 1 1 A 159 159 GLU C C 159 174.469 175.155 -0.686 1 1 1739 . 9 1 1 A 159 159 GLU CA C 159 54.473 54.793 -0.320 1 1 1740 . 9 1 1 A 159 159 GLU CB C 159 33.852 32.348 1.504 1 1 1742 . 9 1 1 A 159 159 GLU N N 159 125.772 129.161 -3.389 1 1 1743 . 9 1 1 A 160 160 ALA H H 160 9.250 9.651 -0.401 1 1 1744 . 9 1 1 A 160 160 ALA HA H 160 4.966 5.439 -0.473 1 1 1748 . 9 1 1 A 160 160 ALA C C 160 175.114 175.752 -0.638 1 1 1749 . 9 1 1 A 160 160 ALA CA C 160 50.644 49.957 0.687 1 1 1750 . 9 1 1 A 160 160 ALA CB C 160 23.263 23.048 0.215 1 1 1751 . 9 1 1 A 160 160 ALA N N 160 125.092 129.601 -4.509 1 1 1752 . 9 1 1 A 161 161 MET H H 161 8.559 8.817 -0.258 1 1 1753 . 9 1 1 A 161 161 MET HA H 161 5.468 5.912 -0.444 1 1 1761 . 9 1 1 A 161 161 MET C C 161 176.265 174.946 1.319 1 1 1762 . 9 1 1 A 161 161 MET CA C 161 53.818 54.083 -0.265 1 1 1763 . 9 1 1 A 161 161 MET CB C 161 34.380 34.837 -0.457 1 1 1766 . 9 1 1 A 161 161 MET N N 161 118.699 119.694 -0.995 1 1 1767 . 9 1 1 A 162 162 VAL H H 162 9.046 9.088 -0.042 1 1 1768 . 9 1 1 A 162 162 VAL HA H 162 4.841 4.856 -0.015 1 1 1776 . 9 1 1 A 162 162 VAL C C 162 174.794 175.827 -1.033 1 1 1777 . 9 1 1 A 162 162 VAL CA C 162 59.107 59.561 -0.454 1 1 1778 . 9 1 1 A 162 162 VAL CB C 162 34.018 34.237 -0.219 1 1 1781 . 9 1 1 A 162 162 VAL N N 162 116.435 119.009 -2.574 1 1 1782 . 9 1 1 A 163 163 HIS H H 163 8.793 8.350 0.443 1 1 1783 . 9 1 1 A 163 163 HIS HA H 163 4.717 4.519 0.198 1 1 1787 . 9 1 1 A 163 163 HIS C C 163 175.460 174.203 1.257 1 1 1788 . 9 1 1 A 163 163 HIS CA C 163 58.488 57.642 0.846 1 1 1789 . 9 1 1 A 163 163 HIS CB C 163 31.185 30.834 0.351 1 1 1791 . 9 1 1 A 163 163 HIS N N 163 117.838 120.958 -3.120 1 1 1792 . 9 1 1 A 164 164 GLU H H 164 8.013 7.967 0.046 1 1 1793 . 9 1 1 A 164 164 GLU HA H 164 4.814 4.596 0.218 1 1 1797 . 9 1 1 A 164 164 GLU C C 164 176.910 176.397 0.513 1 1 1798 . 9 1 1 A 164 164 GLU CA C 164 54.355 54.827 -0.472 1 1 1799 . 9 1 1 A 164 164 GLU CB C 164 32.886 32.231 0.655 1 1 1801 . 9 1 1 A 164 164 GLU N N 164 115.943 118.618 -2.675 1 1 1802 . 9 1 1 A 165 165 LYS H H 165 9.088 8.958 0.130 1 1 1803 . 9 1 1 A 165 165 LYS HA H 165 3.942 3.950 -0.008 1 1 1809 . 9 1 1 A 165 165 LYS C C 165 179.657 177.963 1.694 1 1 1810 . 9 1 1 A 165 165 LYS CA C 165 59.888 58.392 1.496 1 1 1811 . 9 1 1 A 165 165 LYS CB C 165 32.024 32.319 -0.295 1 1 1814 . 9 1 1 A 165 165 LYS N N 165 124.120 127.281 -3.161 1 1 1815 . 9 1 1 A 166 166 ALA H H 166 8.851 8.182 0.669 1 1 1816 . 9 1 1 A 166 166 ALA HA H 166 4.251 4.086 0.165 1 1 1820 . 9 1 1 A 166 166 ALA C C 166 178.920 178.518 0.402 1 1 1821 . 9 1 1 A 166 166 ALA CA C 166 54.318 54.395 -0.077 1 1 1822 . 9 1 1 A 166 166 ALA CB C 166 18.810 18.192 0.618 1 1 1823 . 9 1 1 A 166 166 ALA N N 166 120.424 122.108 -1.684 1 1 1824 . 9 1 1 A 167 167 GLU H H 167 7.871 7.570 0.301 1 1 1825 . 9 1 1 A 167 167 GLU HA H 167 4.404 4.310 0.094 1 1 1829 . 9 1 1 A 167 167 GLU C C 167 177.368 178.783 -1.415 1 1 1830 . 9 1 1 A 167 167 GLU CA C 167 56.701 58.113 -1.412 1 1 1831 . 9 1 1 A 167 167 GLU CB C 167 31.208 29.753 1.455 1 1 1833 . 9 1 1 A 167 167 GLU N N 167 114.926 117.501 -2.575 1 1 1834 . 9 1 1 A 168 168 VAL H H 168 7.812 7.685 0.127 1 1 1835 . 9 1 1 A 168 168 VAL HA H 168 3.712 3.661 0.051 1 1 1843 . 9 1 1 A 168 168 VAL CA C 168 68.705 67.936 0.769 1 1 1844 . 9 1 1 A 168 168 VAL CB C 168 29.597 29.817 -0.220 1 1 1847 . 9 1 1 A 168 168 VAL N N 168 120.188 122.351 -2.163 1 1 1848 . 9 1 1 A 169 169 PRO HA H 169 4.252 4.212 0.040 1 1 1851 . 9 1 1 A 169 169 PRO C C 169 179.563 178.653 0.910 1 1 1852 . 9 1 1 A 169 169 PRO CA C 169 67.077 67.038 0.039 1 1 1853 . 9 1 1 A 170 170 ALA H H 170 8.149 8.229 -0.080 1 1 1854 . 9 1 1 A 170 170 ALA HA H 170 4.265 4.037 0.228 1 1 1858 . 9 1 1 A 170 170 ALA C C 170 180.637 179.783 0.854 1 1 1859 . 9 1 1 A 170 170 ALA CA C 170 54.823 55.332 -0.509 1 1 1860 . 9 1 1 A 170 170 ALA CB C 170 18.518 17.808 0.710 1 1 1861 . 9 1 1 A 170 170 ALA N N 170 119.210 119.030 0.180 1 1 1862 . 9 1 1 A 171 171 ALA H H 171 7.767 8.358 -0.591 1 1 1863 . 9 1 1 A 171 171 ALA HA H 171 4.106 4.199 -0.093 1 1 1867 . 9 1 1 A 171 171 ALA C C 171 179.371 180.079 -0.708 1 1 1868 . 9 1 1 A 171 171 ALA CA C 171 55.130 54.835 0.295 1 1 1869 . 9 1 1 A 171 171 ALA CB C 171 18.291 18.180 0.111 1 1 1870 . 9 1 1 A 171 171 ALA N N 171 122.126 121.002 1.124 1 1 1871 . 9 1 1 A 172 172 LEU H H 172 8.950 8.388 0.562 1 1 1872 . 9 1 1 A 172 172 LEU HA H 172 3.987 4.098 -0.111 1 1 1878 . 9 1 1 A 172 172 LEU C C 172 178.355 178.703 -0.348 1 1 1879 . 9 1 1 A 172 172 LEU CA C 172 57.803 58.265 -0.462 1 1 1880 . 9 1 1 A 172 172 LEU CB C 172 41.667 41.689 -0.022 1 1 1882 . 9 1 1 A 172 172 LEU N N 172 118.682 120.188 -1.506 1 1 1883 . 9 1 1 A 173 173 GLU H H 173 7.886 7.972 -0.086 1 1 1884 . 9 1 1 A 173 173 GLU HA H 173 4.132 3.954 0.178 1 1 1887 . 9 1 1 A 173 173 GLU C C 173 179.556 179.537 0.019 1 1 1888 . 9 1 1 A 173 173 GLU CA C 173 59.800 59.585 0.215 1 1 1889 . 9 1 1 A 173 173 GLU CB C 173 29.580 29.224 0.356 1 1 1891 . 9 1 1 A 173 173 GLU N N 173 117.561 118.739 -1.178 1 1 1892 . 9 1 1 A 174 174 LYS H H 174 7.532 7.991 -0.459 1 1 1893 . 9 1 1 A 174 174 LYS HA H 174 4.131 4.063 0.068 1 1 1901 . 9 1 1 A 174 174 LYS CA C 174 58.999 59.228 -0.229 1 1 1902 . 9 1 1 A 174 174 LYS CB C 174 32.041 32.286 -0.245 1 1 1906 . 9 1 1 A 174 174 LYS N N 174 119.085 121.189 -2.104 1 1 1907 . 9 1 1 A 175 175 ILE H H 175 8.479 8.094 0.385 1 1 1908 . 9 1 1 A 175 175 ILE HA H 175 3.583 3.620 -0.037 1 1 1918 . 9 1 1 A 175 175 ILE C C 175 179.258 178.314 0.944 1 1 1919 . 9 1 1 A 175 175 ILE CA C 175 65.769 65.589 0.180 1 1 1920 . 9 1 1 A 175 175 ILE CB C 175 37.876 38.020 -0.144 1 1 1923 . 9 1 1 A 175 175 ILE N N 175 118.828 119.191 -0.363 1 1 1924 . 9 1 1 A 176 176 ILE H H 176 8.928 8.027 0.901 1 1 1925 . 9 1 1 A 176 176 ILE HA H 176 3.600 3.569 0.031 1 1 1935 . 9 1 1 A 176 176 ILE C C 176 178.827 178.082 0.745 1 1 1936 . 9 1 1 A 176 176 ILE CA C 176 65.640 65.142 0.498 1 1 1937 . 9 1 1 A 176 176 ILE CB C 176 37.451 37.597 -0.146 1 1 1941 . 9 1 1 A 176 176 ILE N N 176 124.527 119.451 5.076 1 1 1942 . 9 1 1 A 177 177 THR H H 177 8.175 8.052 0.123 1 1 1943 . 9 1 1 A 177 177 THR HA H 177 3.885 3.929 -0.044 1 1 1948 . 9 1 1 A 177 177 THR C C 177 176.867 176.397 0.470 1 1 1949 . 9 1 1 A 177 177 THR CA C 177 67.199 66.273 0.926 1 1 1950 . 9 1 1 A 177 177 THR CB C 177 68.377 68.772 -0.395 1 1 1952 . 9 1 1 A 177 177 THR N N 177 119.412 118.575 0.837 1 1 1953 . 9 1 1 A 178 178 VAL H H 178 8.352 7.888 0.464 1 1 1954 . 9 1 1 A 178 178 VAL HA H 178 3.572 3.437 0.135 1 1 1962 . 9 1 1 A 178 178 VAL C C 178 177.664 177.973 -0.309 1 1 1963 . 9 1 1 A 178 178 VAL CA C 178 66.909 66.228 0.681 1 1 1964 . 9 1 1 A 178 178 VAL CB C 178 31.714 31.251 0.463 1 1 1967 . 9 1 1 A 178 178 VAL N N 178 121.168 121.693 -0.525 1 1 1968 . 9 1 1 A 179 179 SER H H 179 8.529 8.230 0.299 1 1 1969 . 9 1 1 A 179 179 SER HA H 179 3.099 3.482 -0.383 1 1 1972 . 9 1 1 A 179 179 SER C C 179 175.380 176.242 -0.862 1 1 1973 . 9 1 1 A 179 179 SER CA C 179 62.728 61.822 0.906 1 1 1974 . 9 1 1 A 179 179 SER CB C 179 62.802 62.547 0.255 1 1 1975 . 9 1 1 A 179 179 SER N N 179 115.226 115.928 -0.702 1 1 1976 . 9 1 1 A 180 180 SER H H 180 7.757 8.105 -0.348 1 1 1977 . 9 1 1 A 180 180 SER HA H 180 4.419 4.425 -0.006 1 1 1980 . 9 1 1 A 180 180 SER C C 180 175.359 176.984 -1.625 1 1 1981 . 9 1 1 A 180 180 SER CA C 180 61.025 61.411 -0.386 1 1 1982 . 9 1 1 A 180 180 SER CB C 180 63.072 63.125 -0.053 1 1 1983 . 9 1 1 A 180 180 SER N N 180 114.718 116.028 -1.310 1 1 1984 . 9 1 1 A 181 181 MET H H 181 7.497 7.674 -0.177 1 1 1985 . 9 1 1 A 181 181 MET HA H 181 4.283 4.218 0.065 1 1 1993 . 9 1 1 A 181 181 MET C C 181 177.217 177.169 0.048 1 1 1994 . 9 1 1 A 181 181 MET CA C 181 57.539 57.910 -0.371 1 1 1995 . 9 1 1 A 181 181 MET CB C 181 33.493 32.545 0.948 1 1 1998 . 9 1 1 A 181 181 MET N N 181 119.274 120.567 -1.293 1 1 1999 . 9 1 1 A 182 182 LEU H H 182 7.163 7.466 -0.303 1 1 2000 . 9 1 1 A 182 182 LEU HA H 182 4.133 4.380 -0.247 1 1 2010 . 9 1 1 A 182 182 LEU C C 182 176.289 176.609 -0.320 1 1 2011 . 9 1 1 A 182 182 LEU CA C 182 54.750 54.807 -0.057 1 1 2012 . 9 1 1 A 182 182 LEU CB C 182 43.235 42.699 0.536 1 1 2016 . 9 1 1 A 182 182 LEU N N 182 115.869 117.760 -1.891 1 1 2017 . 9 1 1 A 183 183 GLY H H 183 7.492 7.302 0.190 1 1 2018 . 9 1 1 A 183 183 GLY HA2 H 183 4.086 4.157 -0.071 1 1 2019 . 9 1 1 A 183 183 GLY HA3 H 183 4.425 4.201 0.224 1 1 2020 . 9 1 1 A 183 183 GLY C C 183 171.830 172.073 -0.243 1 1 2021 . 9 1 1 A 183 183 GLY CA C 183 46.035 45.908 0.127 1 1 2022 . 9 1 1 A 183 183 GLY N N 183 107.761 106.014 1.747 1 1 2023 . 9 1 1 A 184 184 VAL H H 184 8.099 8.410 -0.311 1 1 2024 . 9 1 1 A 184 184 VAL HA H 184 4.772 4.792 -0.020 1 1 2032 . 9 1 1 A 184 184 VAL CA C 184 59.305 58.788 0.517 1 1 2033 . 9 1 1 A 184 184 VAL CB C 184 33.648 35.161 -1.513 1 1 2036 . 9 1 1 A 184 184 VAL N N 184 119.803 121.815 -2.012 1 1 2037 . 9 1 1 A 185 185 PRO HA H 185 4.442 4.747 -0.305 1 1 2042 . 9 1 1 A 185 185 PRO C C 185 175.871 176.490 -0.619 1 1 2043 . 9 1 1 A 185 185 PRO CA C 185 63.886 62.711 1.175 1 1 2044 . 9 1 1 A 185 185 PRO CB C 185 32.260 32.158 0.102 1 1 2047 . 9 1 1 A 186 186 ALA H H 186 8.222 8.861 -0.639 1 1 2048 . 9 1 1 A 186 186 ALA HA H 186 4.569 4.639 -0.070 1 1 2052 . 9 1 1 A 186 186 ALA C C 186 177.481 176.009 1.472 1 1 2053 . 9 1 1 A 186 186 ALA CA C 186 51.823 50.429 1.394 1 1 2054 . 9 1 1 A 186 186 ALA CB C 186 20.233 20.775 -0.542 1 1 2055 . 9 1 1 A 186 186 ALA N N 186 125.663 123.279 2.384 1 1 2056 . 9 1 1 A 187 187 GLN H H 187 8.723 8.918 -0.195 1 1 2057 . 9 1 1 A 187 187 GLN HA H 187 4.420 4.986 -0.566 1 1 2063 . 9 1 1 A 187 187 GLN C C 187 175.566 174.661 0.905 1 1 2064 . 9 1 1 A 187 187 GLN CA C 187 56.051 54.348 1.703 1 1 2065 . 9 1 1 A 187 187 GLN CB C 187 29.812 30.811 -0.999 1 1 2067 . 9 1 1 A 187 187 GLN N N 187 120.742 115.477 5.265 1 1 2069 . 9 1 1 A 188 188 GLU H H 188 8.163 8.277 -0.114 1 1 2070 . 9 1 1 A 188 188 GLU HA H 188 4.405 4.444 -0.039 1 1 2074 . 9 1 1 A 188 188 GLU C C 188 176.058 175.587 0.471 1 1 2075 . 9 1 1 A 188 188 GLU CA C 188 56.158 56.206 -0.048 1 1 2076 . 9 1 1 A 188 188 GLU CB C 188 31.095 28.591 2.504 1 1 2078 . 9 1 1 A 188 188 GLU N N 188 119.177 118.619 0.558 1 1 2079 . 9 1 1 A 189 189 GLU H H 189 8.567 8.187 0.380 1 1 2080 . 9 1 1 A 189 189 GLU HA H 189 4.252 4.792 -0.540 1 1 2084 . 9 1 1 A 189 189 GLU C C 189 175.703 174.934 0.769 1 1 2085 . 9 1 1 A 189 189 GLU CA C 189 56.417 56.050 0.367 1 1 2086 . 9 1 1 A 189 189 GLU CB C 189 29.968 31.694 -1.726 1 1 2088 . 9 1 1 A 189 189 GLU N N 189 120.920 125.460 -4.540 1 1 2089 . 9 1 1 A 190 190 ALA H H 190 8.271 8.794 -0.523 1 1 2090 . 9 1 1 A 190 190 ALA HA H 190 4.626 4.881 -0.255 1 1 2094 . 9 1 1 A 190 190 ALA CA C 190 50.465 49.052 1.413 1 1 2095 . 9 1 1 A 190 190 ALA CB C 190 18.451 20.367 -1.916 1 1 2096 . 9 1 1 A 190 190 ALA N N 190 128.323 128.685 -0.362 1 1 2097 . 9 1 1 A 191 191 PRO HA H 191 4.493 4.647 -0.154 1 1 2103 . 9 1 1 A 191 191 PRO C C 191 175.899 176.736 -0.837 1 1 2104 . 9 1 1 A 191 191 PRO CA C 191 62.044 62.348 -0.304 1 1 2105 . 9 1 1 A 191 191 PRO CB C 191 32.184 32.168 0.016 1 1 2108 . 9 1 1 A 192 192 ALA H H 192 8.610 7.916 0.694 1 1 2109 . 9 1 1 A 192 192 ALA HA H 192 4.280 4.450 -0.170 1 1 2113 . 9 1 1 A 192 192 ALA C C 192 178.282 178.446 -0.164 1 1 2114 . 9 1 1 A 192 192 ALA CA C 192 51.698 51.340 0.358 1 1 2115 . 9 1 1 A 192 192 ALA CB C 192 19.220 20.471 -1.251 1 1 2116 . 9 1 1 A 192 192 ALA N N 192 123.420 124.671 -1.251 1 1 2117 . 9 1 1 A 193 193 LYS H H 193 8.531 8.783 -0.252 1 1 2118 . 9 1 1 A 193 193 LYS HA H 193 3.294 3.738 -0.444 1 1 2126 . 9 1 1 A 193 193 LYS C C 193 177.640 179.007 -1.367 1 1 2127 . 9 1 1 A 193 193 LYS CA C 193 60.644 59.297 1.347 1 1 2128 . 9 1 1 A 193 193 LYS CB C 193 32.607 31.814 0.793 1 1 2132 . 9 1 1 A 193 193 LYS N N 193 122.851 118.986 3.865 1 1 2133 . 9 1 1 A 194 194 LEU H H 194 8.570 7.946 0.624 1 1 2134 . 9 1 1 A 194 194 LEU HA H 194 3.845 4.458 -0.613 1 1 2144 . 9 1 1 A 194 194 LEU C C 194 177.965 179.034 -1.069 1 1 2145 . 9 1 1 A 194 194 LEU CA C 194 57.611 57.548 0.063 1 1 2146 . 9 1 1 A 194 194 LEU CB C 194 41.776 40.871 0.905 1 1 2150 . 9 1 1 A 194 194 LEU N N 194 115.801 121.516 -5.715 1 1 2151 . 9 1 1 A 195 195 MET H H 195 6.782 8.048 -1.266 1 1 2152 . 9 1 1 A 195 195 MET HA H 195 4.487 4.154 0.333 1 1 2160 . 9 1 1 A 195 195 MET C C 195 178.280 178.741 -0.461 1 1 2161 . 9 1 1 A 195 195 MET CA C 195 56.858 58.286 -1.428 1 1 2162 . 9 1 1 A 195 195 MET CB C 195 31.557 31.392 0.165 1 1 2165 . 9 1 1 A 195 195 MET N N 195 113.898 117.448 -3.550 1 1 2166 . 9 1 1 A 196 196 VAL H H 196 7.713 7.565 0.148 1 1 2167 . 9 1 1 A 196 196 VAL HA H 196 3.501 3.287 0.214 1 1 2175 . 9 1 1 A 196 196 VAL C C 196 177.624 177.801 -0.177 1 1 2176 . 9 1 1 A 196 196 VAL CA C 196 66.318 66.141 0.177 1 1 2177 . 9 1 1 A 196 196 VAL CB C 196 31.380 31.260 0.120 1 1 2180 . 9 1 1 A 196 196 VAL N N 196 120.413 119.474 0.939 1 1 2181 . 9 1 1 A 197 197 TYR H H 197 7.972 8.196 -0.224 1 1 2182 . 9 1 1 A 197 197 TYR HA H 197 3.145 4.312 -1.167 1 1 2187 . 9 1 1 A 197 197 TYR C C 197 177.726 176.894 0.832 1 1 2188 . 9 1 1 A 197 197 TYR CA C 197 62.253 61.898 0.355 1 1 2189 . 9 1 1 A 197 197 TYR CB C 197 37.314 38.924 -1.610 1 1 2192 . 9 1 1 A 197 197 TYR N N 197 119.543 121.228 -1.685 1 1 2193 . 9 1 1 A 198 198 LEU H H 198 8.630 8.007 0.623 1 1 2194 . 9 1 1 A 198 198 LEU HA H 198 3.923 3.816 0.107 1 1 2203 . 9 1 1 A 198 198 LEU C C 198 178.074 178.802 -0.728 1 1 2204 . 9 1 1 A 198 198 LEU CA C 198 58.294 57.709 0.585 1 1 2205 . 9 1 1 A 198 198 LEU CB C 198 42.177 41.642 0.535 1 1 2209 . 9 1 1 A 198 198 LEU N N 198 118.430 119.447 -1.017 1 1 2210 . 9 1 1 A 199 199 GLN H H 199 8.082 8.414 -0.332 1 1 2211 . 9 1 1 A 199 199 GLN HA H 199 3.054 3.473 -0.419 1 1 2216 . 9 1 1 A 199 199 GLN C C 199 176.875 178.677 -1.802 1 1 2217 . 9 1 1 A 199 199 GLN CA C 199 59.739 59.023 0.716 1 1 2218 . 9 1 1 A 199 199 GLN CB C 199 28.055 27.706 0.349 1 1 2220 . 9 1 1 A 199 199 GLN N N 199 117.926 117.188 0.738 1 1 2222 . 9 1 1 A 200 200 ARG H H 200 7.349 7.718 -0.369 1 1 2223 . 9 1 1 A 200 200 ARG HA H 200 3.798 3.815 -0.017 1 1 2231 . 9 1 1 A 200 200 ARG C C 200 178.037 177.667 0.370 1 1 2232 . 9 1 1 A 200 200 ARG CA C 200 58.260 58.886 -0.626 1 1 2233 . 9 1 1 A 200 200 ARG CB C 200 30.706 30.359 0.347 1 1 2236 . 9 1 1 A 200 200 ARG N N 200 113.772 118.813 -5.041 1 1 2238 . 9 1 1 A 201 201 PHE H H 201 8.329 7.769 0.560 1 1 2239 . 9 1 1 A 201 201 PHE HA H 201 4.630 4.448 0.182 1 1 2244 . 9 1 1 A 201 201 PHE C C 201 176.606 175.937 0.669 1 1 2245 . 9 1 1 A 201 201 PHE CA C 201 59.014 58.502 0.512 1 1 2246 . 9 1 1 A 201 201 PHE CB C 201 40.357 40.731 -0.374 1 1 2249 . 9 1 1 A 201 201 PHE N N 201 114.182 114.305 -0.123 1 1 2250 . 9 1 1 A 202 202 ARG H H 202 8.719 8.295 0.424 1 1 2251 . 9 1 1 A 202 202 ARG HA H 202 5.071 4.834 0.237 1 1 2261 . 9 1 1 A 202 202 ARG CA C 202 53.956 53.761 0.195 1 1 2262 . 9 1 1 A 202 202 ARG CB C 202 31.979 30.630 1.349 1 1 2264 . 9 1 1 A 202 202 ARG N N 202 120.115 118.484 1.631 1 1 2266 . 9 1 1 A 203 203 PRO HA H 203 4.348 4.484 -0.136 1 1 2271 . 9 1 1 A 203 203 PRO C C 203 179.736 178.233 1.503 1 1 2272 . 9 1 1 A 203 203 PRO CA C 203 65.674 65.225 0.449 1 1 2273 . 9 1 1 A 203 203 PRO CB C 203 31.717 32.188 -0.471 1 1 2275 . 9 1 1 A 204 204 LEU H H 204 8.875 7.598 1.277 1 1 2276 . 9 1 1 A 204 204 LEU HA H 204 4.291 4.041 0.250 1 1 2286 . 9 1 1 A 204 204 LEU C C 204 180.353 177.979 2.374 1 1 2287 . 9 1 1 A 204 204 LEU CA C 204 58.012 57.075 0.937 1 1 2288 . 9 1 1 A 204 204 LEU CB C 204 40.893 42.191 -1.298 1 1 2292 . 9 1 1 A 204 204 LEU N N 204 118.940 117.004 1.936 1 1 2293 . 9 1 1 A 205 205 ASP H H 205 7.541 8.391 -0.850 1 1 2294 . 9 1 1 A 205 205 ASP HA H 205 4.622 4.423 0.199 1 1 2297 . 9 1 1 A 205 205 ASP C C 205 177.602 178.081 -0.479 1 1 2298 . 9 1 1 A 205 205 ASP CA C 205 57.437 57.360 0.077 1 1 2299 . 9 1 1 A 205 205 ASP CB C 205 41.143 40.963 0.180 1 1 2300 . 9 1 1 A 205 205 ASP N N 205 120.838 119.372 1.466 1 1 2301 . 9 1 1 A 206 206 TYR H H 206 8.237 8.723 -0.486 1 1 2302 . 9 1 1 A 206 206 TYR HA H 206 4.018 4.150 -0.132 1 1 2307 . 9 1 1 A 206 206 TYR C C 206 176.433 177.305 -0.872 1 1 2308 . 9 1 1 A 206 206 TYR CA C 206 62.148 62.072 0.076 1 1 2309 . 9 1 1 A 206 206 TYR CB C 206 38.305 38.685 -0.380 1 1 2312 . 9 1 1 A 206 206 TYR N N 206 119.475 120.664 -1.189 1 1 2313 . 9 1 1 A 207 207 GLN H H 207 8.124 8.313 -0.189 1 1 2314 . 9 1 1 A 207 207 GLN HA H 207 3.823 3.501 0.322 1 1 2320 . 9 1 1 A 207 207 GLN C C 207 178.019 178.648 -0.629 1 1 2321 . 9 1 1 A 207 207 GLN CA C 207 58.841 59.042 -0.201 1 1 2322 . 9 1 1 A 207 207 GLN CB C 207 28.208 28.111 0.097 1 1 2324 . 9 1 1 A 207 207 GLN N N 207 115.863 117.924 -2.061 1 1 2326 . 9 1 1 A 208 208 ARG H H 208 7.522 7.814 -0.292 1 1 2327 . 9 1 1 A 208 208 ARG HA H 208 4.127 4.069 0.058 1 1 2334 . 9 1 1 A 208 208 ARG C C 208 179.278 178.818 0.460 1 1 2335 . 9 1 1 A 208 208 ARG CA C 208 59.419 58.925 0.494 1 1 2336 . 9 1 1 A 208 208 ARG CB C 208 30.182 29.916 0.266 1 1 2338 . 9 1 1 A 208 208 ARG N N 208 118.471 120.028 -1.557 1 1 2340 . 9 1 1 A 209 209 LEU H H 209 7.869 7.717 0.152 1 1 2341 . 9 1 1 A 209 209 LEU HA H 209 4.091 4.089 0.002 1 1 2351 . 9 1 1 A 209 209 LEU C C 209 179.715 179.106 0.609 1 1 2352 . 9 1 1 A 209 209 LEU CA C 209 57.891 57.889 0.002 1 1 2353 . 9 1 1 A 209 209 LEU CB C 209 41.338 41.531 -0.193 1 1 2356 . 9 1 1 A 209 209 LEU N N 209 119.659 120.033 -0.374 1 1 2357 . 9 1 1 A 210 210 LEU H H 210 8.034 8.454 -0.420 1 1 2358 . 9 1 1 A 210 210 LEU HA H 210 3.977 3.978 -0.001 1 1 2367 . 9 1 1 A 210 210 LEU C C 210 180.363 178.449 1.914 1 1 2368 . 9 1 1 A 210 210 LEU CA C 210 57.459 58.486 -1.027 1 1 2369 . 9 1 1 A 210 210 LEU CB C 210 41.699 41.227 0.472 1 1 2373 . 9 1 1 A 210 210 LEU N N 210 120.967 120.204 0.763 1 1 2374 . 9 1 1 A 211 211 GLU H H 211 8.174 8.569 -0.395 1 1 2375 . 9 1 1 A 211 211 GLU HA H 211 4.075 4.048 0.027 1 1 2379 . 9 1 1 A 211 211 GLU C C 211 178.499 178.770 -0.271 1 1 2380 . 9 1 1 A 211 211 GLU CA C 211 58.575 59.395 -0.820 1 1 2381 . 9 1 1 A 211 211 GLU CB C 211 29.583 29.226 0.357 1 1 2383 . 9 1 1 A 211 211 GLU N N 211 119.217 117.870 1.347 1 1 2384 . 9 1 1 A 212 212 ALA H H 212 7.723 7.781 -0.058 1 1 2385 . 9 1 1 A 212 212 ALA HA H 212 4.291 4.247 0.044 1 1 2389 . 9 1 1 A 212 212 ALA C C 212 178.770 179.111 -0.341 1 1 2390 . 9 1 1 A 212 212 ALA CA C 212 53.966 54.534 -0.568 1 1 2391 . 9 1 1 A 212 212 ALA CB C 212 19.117 18.440 0.677 1 1 2392 . 9 1 1 A 212 212 ALA N N 212 121.798 122.325 -0.527 1 1 2393 . 9 1 1 A 213 213 ALA H H 213 7.743 7.708 0.035 1 1 2394 . 9 1 1 A 213 213 ALA HA H 213 4.406 4.423 -0.017 1 1 2398 . 9 1 1 A 213 213 ALA C C 213 178.413 177.522 0.891 1 1 2399 . 9 1 1 A 213 213 ALA CA C 213 53.129 51.925 1.204 1 1 2400 . 9 1 1 A 213 213 ALA CB C 213 18.926 19.270 -0.344 1 1 2401 . 9 1 1 A 213 213 ALA N N 213 120.435 118.886 1.549 1 1 2402 . 9 1 1 A 214 214 SER H H 214 7.944 7.357 0.587 1 1 2403 . 9 1 1 A 214 214 SER HA H 214 4.559 4.645 -0.086 1 1 2406 . 9 1 1 A 214 214 SER C C 214 174.958 175.236 -0.278 1 1 2407 . 9 1 1 A 214 214 SER CA C 214 58.640 57.819 0.821 1 1 2408 . 9 1 1 A 214 214 SER CB C 214 63.928 61.058 2.870 1 1 2409 . 9 1 1 A 214 214 SER N N 214 113.729 115.925 -2.196 1 1 2410 . 9 1 1 A 215 215 SER H H 215 8.255 8.775 -0.520 1 1 2411 . 9 1 1 A 215 215 SER HA H 215 4.547 4.279 0.268 1 1 2413 . 9 1 1 A 215 215 SER C C 215 175.289 174.606 0.683 1 1 2414 . 9 1 1 A 215 215 SER CA C 215 58.833 60.431 -1.598 1 1 2415 . 9 1 1 A 215 215 SER CB C 215 63.847 63.413 0.434 1 1 2416 . 9 1 1 A 215 215 SER N N 215 117.674 119.067 -1.393 1 1 2417 . 9 1 1 A 216 216 GLY H H 216 8.431 7.689 0.742 1 1 2418 . 9 1 1 A 216 216 GLY HA2 H 216 4.054 4.027 0.027 1 1 2419 . 9 1 1 A 216 216 GLY C C 216 174.189 172.478 1.711 1 1 2420 . 9 1 1 A 216 216 GLY CA C 216 45.412 45.782 -0.370 1 1 2421 . 9 1 1 A 216 216 GLY N N 216 110.800 108.551 2.249 1 1 2422 . 9 1 1 A 217 217 GLU H H 217 8.267 8.533 -0.266 1 1 2423 . 9 1 1 A 217 217 GLU HA H 217 4.345 4.307 0.038 1 1 2427 . 9 1 1 A 217 217 GLU C C 217 176.428 176.239 0.189 1 1 2428 . 9 1 1 A 217 217 GLU CA C 217 56.470 57.365 -0.895 1 1 2429 . 9 1 1 A 217 217 GLU CB C 217 30.526 30.271 0.255 1 1 2430 . 9 1 1 A 217 217 GLU N N 217 120.726 123.741 -3.015 1 1 2431 . 9 1 1 A 218 218 ALA H H 218 8.476 8.610 -0.134 1 1 2432 . 9 1 1 A 218 218 ALA HA H 218 4.467 4.581 -0.114 1 1 2436 . 9 1 1 A 218 218 ALA C C 218 178.015 175.992 2.023 1 1 2437 . 9 1 1 A 218 218 ALA CA C 218 52.547 51.228 1.319 1 1 2438 . 9 1 1 A 218 218 ALA CB C 218 19.242 18.101 1.141 1 1 2439 . 9 1 1 A 218 218 ALA N N 218 125.534 127.581 -2.047 1 1 2440 . 9 1 1 A 219 219 THR H H 219 8.232 8.344 -0.112 1 1 2441 . 9 1 1 A 219 219 THR HA H 219 4.411 5.088 -0.677 1 1 2446 . 9 1 1 A 219 219 THR C C 219 175.327 173.399 1.928 1 1 2447 . 9 1 1 A 219 219 THR CA C 219 61.889 60.966 0.923 1 1 2448 . 9 1 1 A 219 219 THR CB C 219 69.939 71.841 -1.902 1 1 2449 . 9 1 1 A 219 219 THR N N 219 113.242 115.695 -2.453 1 1 2450 . 9 1 1 A 220 220 GLY H H 220 8.418 8.415 0.003 1 1 2451 . 9 1 1 A 220 220 GLY C C 220 174.037 170.826 3.211 1 1 2452 . 9 1 1 A 220 220 GLY CA C 220 45.408 44.751 0.657 1 1 2453 . 9 1 1 A 220 220 GLY N N 220 111.031 111.134 -0.103 1 1 2454 . 9 1 1 A 221 221 ASP H H 221 8.345 9.178 -0.833 1 1 2455 . 9 1 1 A 221 221 ASP HA H 221 4.700 5.343 -0.643 1 1 2458 . 9 1 1 A 221 221 ASP C C 221 176.535 176.146 0.389 1 1 2459 . 9 1 1 A 221 221 ASP CA C 221 54.402 53.147 1.255 1 1 2460 . 9 1 1 A 221 221 ASP CB C 221 41.431 43.584 -2.153 1 1 2461 . 9 1 1 A 221 221 ASP N N 221 120.795 120.559 0.236 1 1 2462 . 9 1 1 A 222 222 SER H H 222 8.353 8.882 -0.529 1 1 2463 . 9 1 1 A 222 222 SER HA H 222 4.493 4.156 0.337 1 1 2465 . 9 1 1 A 222 222 SER C C 222 174.224 174.919 -0.695 1 1 2466 . 9 1 1 A 222 222 SER CA C 222 58.427 62.208 -3.781 1 1 2467 . 9 1 1 A 222 222 SER CB C 222 63.860 63.244 0.616 1 1 2468 . 9 1 1 A 222 222 SER N N 222 116.220 122.227 -6.007 1 1 2469 . 9 1 1 A 223 223 ALA H H 223 8.381 7.843 0.538 1 1 2470 . 9 1 1 A 223 223 ALA HA H 223 4.461 3.947 0.514 1 1 2474 . 9 1 1 A 223 223 ALA C C 223 176.926 176.801 0.125 1 1 2475 . 9 1 1 A 223 223 ALA CA C 223 52.583 54.752 -2.169 1 1 2476 . 9 1 1 A 223 223 ALA CB C 223 19.438 17.817 1.621 1 1 2477 . 9 1 1 A 223 223 ALA N N 223 126.592 121.421 5.171 1 1 1 . 10 1 1 A 2 2 ALA HA H 2 4.274 4.844 -0.570 1 1 5 . 10 1 1 A 2 2 ALA C C 2 177.828 176.389 1.439 1 1 6 . 10 1 1 A 2 2 ALA CA C 2 52.984 50.662 2.322 1 1 7 . 10 1 1 A 2 2 ALA CB C 2 19.138 19.678 -0.540 1 1 8 . 10 1 1 A 3 3 GLN H H 3 8.463 8.527 -0.064 1 1 9 . 10 1 1 A 3 3 GLN HA H 3 4.676 4.860 -0.184 1 1 12 . 10 1 1 A 3 3 GLN C C 3 176.002 175.446 0.556 1 1 13 . 10 1 1 A 3 3 GLN CA C 3 56.258 54.643 1.615 1 1 14 . 10 1 1 A 3 3 GLN CB C 3 30.346 31.637 -1.291 1 1 15 . 10 1 1 A 3 3 GLN N N 3 117.490 120.819 -3.329 1 1 16 . 10 1 1 A 4 4 GLY H H 4 8.099 8.421 -0.322 1 1 17 . 10 1 1 A 4 4 GLY HA2 H 4 3.910 4.075 -0.165 1 1 18 . 10 1 1 A 4 4 GLY C C 4 173.332 173.256 0.076 1 1 19 . 10 1 1 A 4 4 GLY CA C 4 45.333 45.540 -0.207 1 1 20 . 10 1 1 A 4 4 GLY N N 4 109.423 108.241 1.182 1 1 21 . 10 1 1 A 5 5 LEU H H 5 7.863 8.216 -0.353 1 1 22 . 10 1 1 A 5 5 LEU HA H 5 4.561 5.225 -0.664 1 1 32 . 10 1 1 A 5 5 LEU C C 5 176.448 176.403 0.045 1 1 33 . 10 1 1 A 5 5 LEU CA C 5 54.713 53.549 1.164 1 1 34 . 10 1 1 A 5 5 LEU CB C 5 43.551 43.027 0.524 1 1 38 . 10 1 1 A 5 5 LEU N N 5 120.391 124.515 -4.124 1 1 39 . 10 1 1 A 6 6 ILE H H 6 8.764 9.098 -0.334 1 1 40 . 10 1 1 A 6 6 ILE HA H 6 4.087 3.992 0.095 1 1 49 . 10 1 1 A 6 6 ILE C C 6 174.679 175.628 -0.949 1 1 50 . 10 1 1 A 6 6 ILE CA C 6 61.279 61.998 -0.719 1 1 51 . 10 1 1 A 6 6 ILE CB C 6 39.651 38.012 1.639 1 1 54 . 10 1 1 A 6 6 ILE N N 6 123.050 125.221 -2.171 1 1 55 . 10 1 1 A 7 7 GLU H H 7 8.587 8.527 0.060 1 1 56 . 10 1 1 A 7 7 GLU HA H 7 4.917 4.734 0.183 1 1 61 . 10 1 1 A 7 7 GLU C C 7 175.978 175.243 0.735 1 1 62 . 10 1 1 A 7 7 GLU CA C 7 56.127 56.095 0.032 1 1 63 . 10 1 1 A 7 7 GLU CB C 7 31.115 30.418 0.697 1 1 65 . 10 1 1 A 7 7 GLU N N 7 127.415 128.092 -0.677 1 1 66 . 10 1 1 A 8 8 VAL H H 8 8.986 9.182 -0.196 1 1 67 . 10 1 1 A 8 8 VAL HA H 8 4.375 4.817 -0.442 1 1 72 . 10 1 1 A 8 8 VAL C C 8 173.704 174.904 -1.200 1 1 73 . 10 1 1 A 8 8 VAL CA C 8 61.347 60.131 1.216 1 1 74 . 10 1 1 A 8 8 VAL CB C 8 33.611 33.915 -0.304 1 1 76 . 10 1 1 A 8 8 VAL N N 8 126.071 124.862 1.209 1 1 77 . 10 1 1 A 9 9 GLU H H 9 8.521 9.194 -0.673 1 1 78 . 10 1 1 A 9 9 GLU HA H 9 5.837 5.602 0.235 1 1 81 . 10 1 1 A 9 9 GLU C C 9 175.939 174.196 1.743 1 1 82 . 10 1 1 A 9 9 GLU CA C 9 54.516 54.460 0.056 1 1 83 . 10 1 1 A 9 9 GLU CB C 9 33.009 34.105 -1.096 1 1 84 . 10 1 1 A 9 9 GLU N N 9 122.857 126.308 -3.451 1 1 85 . 10 1 1 A 10 10 ARG H H 10 8.690 8.470 0.220 1 1 86 . 10 1 1 A 10 10 ARG HA H 10 4.709 4.842 -0.133 1 1 94 . 10 1 1 A 10 10 ARG C C 10 174.826 173.518 1.308 1 1 95 . 10 1 1 A 10 10 ARG CA C 10 54.491 55.147 -0.656 1 1 96 . 10 1 1 A 10 10 ARG CB C 10 35.777 34.583 1.194 1 1 98 . 10 1 1 A 10 10 ARG N N 10 120.430 120.440 -0.010 1 1 100 . 10 1 1 A 11 11 LYS H H 11 8.874 8.734 0.140 1 1 101 . 10 1 1 A 11 11 LYS HA H 11 5.530 5.278 0.252 1 1 107 . 10 1 1 A 11 11 LYS C C 11 176.919 175.516 1.403 1 1 108 . 10 1 1 A 11 11 LYS CA C 11 55.084 54.677 0.407 1 1 109 . 10 1 1 A 11 11 LYS CB C 11 35.435 35.197 0.238 1 1 113 . 10 1 1 A 11 11 LYS N N 11 121.087 126.320 -5.233 1 1 114 . 10 1 1 A 12 12 PHE H H 12 8.877 9.263 -0.386 1 1 115 . 10 1 1 A 12 12 PHE HA H 12 5.130 5.380 -0.250 1 1 120 . 10 1 1 A 12 12 PHE C C 12 171.676 172.472 -0.796 1 1 121 . 10 1 1 A 12 12 PHE CA C 12 55.869 55.771 0.098 1 1 122 . 10 1 1 A 12 12 PHE CB C 12 42.108 42.404 -0.296 1 1 125 . 10 1 1 A 12 12 PHE N N 12 117.486 120.476 -2.990 1 1 126 . 10 1 1 A 13 13 ALA H H 13 9.134 9.613 -0.479 1 1 127 . 10 1 1 A 13 13 ALA HA H 13 5.003 4.859 0.144 1 1 131 . 10 1 1 A 13 13 ALA CA C 13 48.340 49.030 -0.690 1 1 132 . 10 1 1 A 13 13 ALA CB C 13 19.191 20.307 -1.116 1 1 133 . 10 1 1 A 13 13 ALA N N 13 125.915 122.727 3.188 1 1 134 . 10 1 1 A 14 14 PRO HA H 14 4.620 5.010 -0.390 1 1 140 . 10 1 1 A 14 14 PRO C C 14 176.502 177.333 -0.831 1 1 141 . 10 1 1 A 14 14 PRO CA C 14 62.672 62.358 0.314 1 1 142 . 10 1 1 A 14 14 PRO CB C 14 33.119 32.312 0.807 1 1 145 . 10 1 1 A 15 15 GLY H H 15 8.721 8.667 0.054 1 1 146 . 10 1 1 A 15 15 GLY HA2 H 15 3.999 4.078 -0.079 1 1 147 . 10 1 1 A 15 15 GLY HA3 H 15 4.632 4.079 0.553 1 1 148 . 10 1 1 A 15 15 GLY CA C 15 44.411 44.015 0.396 1 1 149 . 10 1 1 A 15 15 GLY N N 15 109.863 108.179 1.684 1 1 150 . 10 1 1 A 16 16 PRO HA H 16 4.447 4.397 0.050 1 1 155 . 10 1 1 A 16 16 PRO C C 16 177.053 177.050 0.003 1 1 156 . 10 1 1 A 16 16 PRO CA C 16 64.395 64.553 -0.158 1 1 157 . 10 1 1 A 16 16 PRO CB C 16 31.993 32.029 -0.036 1 1 159 . 10 1 1 A 17 17 ASP H H 17 8.550 8.745 -0.195 1 1 160 . 10 1 1 A 17 17 ASP HA H 17 4.950 4.627 0.323 1 1 163 . 10 1 1 A 17 17 ASP C C 17 176.800 176.910 -0.110 1 1 164 . 10 1 1 A 17 17 ASP CA C 17 53.271 53.580 -0.309 1 1 165 . 10 1 1 A 17 17 ASP CB C 17 40.392 39.978 0.414 1 1 166 . 10 1 1 A 17 17 ASP N N 17 116.060 115.793 0.267 1 1 167 . 10 1 1 A 18 18 THR H H 18 7.664 7.641 0.023 1 1 168 . 10 1 1 A 18 18 THR HA H 18 4.120 3.652 0.468 1 1 174 . 10 1 1 A 18 18 THR C C 18 175.407 176.462 -1.055 1 1 175 . 10 1 1 A 18 18 THR CA C 18 68.718 67.311 1.407 1 1 176 . 10 1 1 A 18 18 THR CB C 18 69.179 68.228 0.951 1 1 178 . 10 1 1 A 18 18 THR N N 18 117.158 115.987 1.171 1 1 179 . 10 1 1 A 19 19 GLU H H 19 8.817 8.510 0.307 1 1 180 . 10 1 1 A 19 19 GLU HA H 19 3.510 3.271 0.239 1 1 184 . 10 1 1 A 19 19 GLU C C 19 178.345 178.828 -0.483 1 1 185 . 10 1 1 A 19 19 GLU CA C 19 61.237 59.876 1.361 1 1 186 . 10 1 1 A 19 19 GLU CB C 19 28.746 29.464 -0.718 1 1 188 . 10 1 1 A 19 19 GLU N N 19 118.802 118.982 -0.180 1 1 189 . 10 1 1 A 20 20 GLU H H 20 7.976 8.107 -0.131 1 1 190 . 10 1 1 A 20 20 GLU HA H 20 4.036 4.084 -0.048 1 1 194 . 10 1 1 A 20 20 GLU C C 20 179.451 179.172 0.279 1 1 195 . 10 1 1 A 20 20 GLU CA C 20 59.909 59.123 0.786 1 1 196 . 10 1 1 A 20 20 GLU CB C 20 28.992 29.169 -0.177 1 1 198 . 10 1 1 A 20 20 GLU N N 20 121.130 119.858 1.272 1 1 199 . 10 1 1 A 21 21 ARG H H 21 8.199 8.009 0.190 1 1 200 . 10 1 1 A 21 21 ARG HA H 21 4.061 4.171 -0.110 1 1 207 . 10 1 1 A 21 21 ARG C C 21 179.087 178.882 0.205 1 1 208 . 10 1 1 A 21 21 ARG CA C 21 58.477 58.444 0.033 1 1 209 . 10 1 1 A 21 21 ARG CB C 21 30.101 30.355 -0.254 1 1 211 . 10 1 1 A 21 21 ARG N N 21 119.897 120.361 -0.464 1 1 213 . 10 1 1 A 22 22 LEU H H 22 8.154 8.518 -0.364 1 1 214 . 10 1 1 A 22 22 LEU HA H 22 3.560 3.765 -0.205 1 1 224 . 10 1 1 A 22 22 LEU C C 22 178.461 179.317 -0.856 1 1 225 . 10 1 1 A 22 22 LEU CA C 22 58.432 57.727 0.705 1 1 226 . 10 1 1 A 22 22 LEU CB C 22 40.229 40.817 -0.588 1 1 230 . 10 1 1 A 22 22 LEU N N 22 120.012 119.551 0.461 1 1 231 . 10 1 1 A 23 23 GLN H H 23 7.621 8.003 -0.382 1 1 232 . 10 1 1 A 23 23 GLN HA H 23 4.232 4.064 0.168 1 1 238 . 10 1 1 A 23 23 GLN C C 23 180.543 178.852 1.691 1 1 239 . 10 1 1 A 23 23 GLN CA C 23 59.434 59.288 0.146 1 1 240 . 10 1 1 A 23 23 GLN CB C 23 28.749 28.470 0.279 1 1 242 . 10 1 1 A 23 23 GLN N N 23 117.823 117.911 -0.088 1 1 244 . 10 1 1 A 24 24 GLU H H 24 8.165 7.745 0.420 1 1 245 . 10 1 1 A 24 24 GLU HA H 24 4.072 4.067 0.005 1 1 249 . 10 1 1 A 24 24 GLU C C 24 178.612 179.478 -0.866 1 1 250 . 10 1 1 A 24 24 GLU CA C 24 59.236 59.143 0.093 1 1 251 . 10 1 1 A 24 24 GLU CB C 24 29.606 29.341 0.265 1 1 253 . 10 1 1 A 24 24 GLU N N 24 122.589 119.873 2.716 1 1 254 . 10 1 1 A 25 25 LEU H H 25 7.911 7.943 -0.032 1 1 255 . 10 1 1 A 25 25 LEU HA H 25 4.214 4.084 0.130 1 1 265 . 10 1 1 A 25 25 LEU C C 25 176.745 177.346 -0.601 1 1 266 . 10 1 1 A 25 25 LEU CA C 25 55.659 55.844 -0.185 1 1 267 . 10 1 1 A 25 25 LEU CB C 25 43.109 42.795 0.314 1 1 271 . 10 1 1 A 25 25 LEU N N 25 117.882 117.570 0.312 1 1 272 . 10 1 1 A 26 26 GLY H H 26 7.776 8.027 -0.251 1 1 273 . 10 1 1 A 26 26 GLY HA2 H 26 4.337 4.013 0.324 1 1 274 . 10 1 1 A 26 26 GLY HA3 H 26 3.856 4.028 -0.172 1 1 275 . 10 1 1 A 26 26 GLY C C 26 175.456 174.880 0.576 1 1 276 . 10 1 1 A 26 26 GLY CA C 26 44.875 45.324 -0.449 1 1 277 . 10 1 1 A 26 26 GLY N N 26 104.938 105.899 -0.961 1 1 278 . 10 1 1 A 27 27 ALA H H 27 8.104 8.541 -0.437 1 1 279 . 10 1 1 A 27 27 ALA HA H 27 4.949 4.467 0.482 1 1 283 . 10 1 1 A 27 27 ALA C C 27 176.448 177.416 -0.968 1 1 284 . 10 1 1 A 27 27 ALA CA C 27 52.183 52.507 -0.324 1 1 285 . 10 1 1 A 27 27 ALA CB C 27 21.814 19.773 2.041 1 1 286 . 10 1 1 A 27 27 ALA N N 27 123.263 124.466 -1.203 1 1 287 . 10 1 1 A 28 28 THR H H 28 9.369 9.386 -0.017 1 1 288 . 10 1 1 A 28 28 THR HA H 28 4.779 4.584 0.195 1 1 293 . 10 1 1 A 28 28 THR C C 28 173.725 173.752 -0.027 1 1 294 . 10 1 1 A 28 28 THR CA C 28 60.046 63.234 -3.188 1 1 295 . 10 1 1 A 28 28 THR CB C 28 70.592 69.715 0.877 1 1 297 . 10 1 1 A 28 28 THR N N 28 112.201 119.259 -7.058 1 1 298 . 10 1 1 A 29 29 LEU H H 29 8.518 8.417 0.101 1 1 299 . 10 1 1 A 29 29 LEU HA H 29 3.332 4.039 -0.707 1 1 309 . 10 1 1 A 29 29 LEU C C 29 176.202 175.425 0.777 1 1 310 . 10 1 1 A 29 29 LEU CA C 29 55.031 54.559 0.472 1 1 311 . 10 1 1 A 29 29 LEU CB C 29 40.624 41.465 -0.841 1 1 315 . 10 1 1 A 29 29 LEU N N 29 128.151 127.673 0.478 1 1 316 . 10 1 1 A 30 30 GLU H H 30 9.269 9.304 -0.035 1 1 317 . 10 1 1 A 30 30 GLU HA H 30 4.287 4.165 0.122 1 1 321 . 10 1 1 A 30 30 GLU C C 30 176.740 176.392 0.348 1 1 322 . 10 1 1 A 30 30 GLU CA C 30 57.283 58.319 -1.036 1 1 323 . 10 1 1 A 30 30 GLU CB C 30 31.045 30.556 0.489 1 1 325 . 10 1 1 A 30 30 GLU N N 30 130.123 126.386 3.737 1 1 326 . 10 1 1 A 31 31 HIS H H 31 7.341 7.339 0.002 1 1 327 . 10 1 1 A 31 31 HIS HA H 31 4.701 5.220 -0.519 1 1 331 . 10 1 1 A 31 31 HIS C C 31 172.581 173.513 -0.932 1 1 332 . 10 1 1 A 31 31 HIS CA C 31 55.876 54.586 1.290 1 1 333 . 10 1 1 A 31 31 HIS CB C 31 33.434 33.850 -0.416 1 1 334 . 10 1 1 A 31 31 HIS N N 31 113.223 114.545 -1.322 1 1 335 . 10 1 1 A 32 32 ARG H H 32 8.196 8.617 -0.421 1 1 336 . 10 1 1 A 32 32 ARG HA H 32 5.262 5.226 0.036 1 1 341 . 10 1 1 A 32 32 ARG C C 32 174.377 174.491 -0.114 1 1 342 . 10 1 1 A 32 32 ARG CA C 32 55.808 55.025 0.783 1 1 343 . 10 1 1 A 32 32 ARG CB C 32 33.340 33.797 -0.457 1 1 345 . 10 1 1 A 32 32 ARG N N 32 123.003 121.718 1.285 1 1 346 . 10 1 1 A 33 33 VAL H H 33 8.956 9.264 -0.308 1 1 347 . 10 1 1 A 33 33 VAL HA H 33 4.734 4.942 -0.208 1 1 355 . 10 1 1 A 33 33 VAL C C 33 172.821 174.986 -2.165 1 1 356 . 10 1 1 A 33 33 VAL CA C 33 60.197 60.081 0.116 1 1 357 . 10 1 1 A 33 33 VAL CB C 33 35.860 34.921 0.939 1 1 360 . 10 1 1 A 33 33 VAL N N 33 122.929 121.064 1.865 1 1 361 . 10 1 1 A 34 34 THR H H 34 8.250 8.844 -0.594 1 1 362 . 10 1 1 A 34 34 THR HA H 34 5.616 5.656 -0.040 1 1 367 . 10 1 1 A 34 34 THR C C 34 173.913 173.564 0.349 1 1 368 . 10 1 1 A 34 34 THR CA C 34 60.245 60.602 -0.357 1 1 369 . 10 1 1 A 34 34 THR CB C 34 71.706 71.279 0.427 1 1 371 . 10 1 1 A 34 34 THR N N 34 119.164 116.162 3.002 1 1 372 . 10 1 1 A 35 35 PHE H H 35 8.565 8.698 -0.133 1 1 373 . 10 1 1 A 35 35 PHE HA H 35 5.029 5.115 -0.086 1 1 378 . 10 1 1 A 35 35 PHE C C 35 173.193 172.795 0.398 1 1 379 . 10 1 1 A 35 35 PHE CA C 35 55.687 56.166 -0.479 1 1 380 . 10 1 1 A 35 35 PHE CB C 35 40.853 40.956 -0.103 1 1 383 . 10 1 1 A 35 35 PHE N N 35 120.244 118.485 1.759 1 1 384 . 10 1 1 A 36 36 ARG H H 36 8.869 8.893 -0.024 1 1 385 . 10 1 1 A 36 36 ARG HA H 36 4.982 4.983 -0.001 1 1 387 . 10 1 1 A 36 36 ARG C C 36 174.743 174.040 0.703 1 1 388 . 10 1 1 A 36 36 ARG CA C 36 55.493 54.721 0.772 1 1 389 . 10 1 1 A 36 36 ARG CB C 36 32.228 33.490 -1.262 1 1 390 . 10 1 1 A 36 36 ARG N N 36 123.893 119.004 4.889 1 1 391 . 10 1 1 A 37 37 ASP H H 37 8.402 9.413 -1.011 1 1 392 . 10 1 1 A 37 37 ASP HA H 37 5.462 5.486 -0.024 1 1 395 . 10 1 1 A 37 37 ASP C C 37 175.177 174.653 0.524 1 1 396 . 10 1 1 A 37 37 ASP CA C 37 53.942 52.968 0.974 1 1 397 . 10 1 1 A 37 37 ASP CB C 37 45.486 45.043 0.443 1 1 398 . 10 1 1 A 37 37 ASP N N 37 127.149 123.303 3.846 1 1 399 . 10 1 1 A 38 38 THR H H 38 8.151 9.319 -1.168 1 1 400 . 10 1 1 A 38 38 THR HA H 38 4.866 5.223 -0.357 1 1 405 . 10 1 1 A 38 38 THR C C 38 172.792 172.773 0.019 1 1 406 . 10 1 1 A 38 38 THR CA C 38 61.416 60.354 1.062 1 1 407 . 10 1 1 A 38 38 THR CB C 38 71.047 70.907 0.140 1 1 409 . 10 1 1 A 38 38 THR N N 38 115.686 115.869 -0.183 1 1 410 . 10 1 1 A 39 39 TYR H H 39 9.021 9.299 -0.278 1 1 411 . 10 1 1 A 39 39 TYR HA H 39 5.544 5.700 -0.156 1 1 416 . 10 1 1 A 39 39 TYR C C 39 176.032 174.714 1.318 1 1 417 . 10 1 1 A 39 39 TYR CA C 39 57.184 56.146 1.038 1 1 418 . 10 1 1 A 39 39 TYR CB C 39 41.642 40.114 1.528 1 1 420 . 10 1 1 A 39 39 TYR N N 39 124.579 124.426 0.153 1 1 421 . 10 1 1 A 40 40 TYR H H 40 8.487 9.245 -0.758 1 1 422 . 10 1 1 A 40 40 TYR HA H 40 5.517 5.846 -0.329 1 1 426 . 10 1 1 A 40 40 TYR C C 40 174.108 174.517 -0.409 1 1 427 . 10 1 1 A 40 40 TYR CA C 40 56.979 56.858 0.121 1 1 428 . 10 1 1 A 40 40 TYR CB C 40 44.132 42.488 1.644 1 1 431 . 10 1 1 A 40 40 TYR N N 40 119.709 122.136 -2.427 1 1 432 . 10 1 1 A 41 41 ASP H H 41 9.341 8.812 0.529 1 1 433 . 10 1 1 A 41 41 ASP HA H 41 4.866 5.159 -0.293 1 1 436 . 10 1 1 A 41 41 ASP C C 41 177.262 174.726 2.536 1 1 437 . 10 1 1 A 41 41 ASP CA C 41 53.445 53.434 0.011 1 1 438 . 10 1 1 A 41 41 ASP CB C 41 45.347 44.667 0.680 1 1 439 . 10 1 1 A 41 41 ASP N N 41 117.995 120.535 -2.540 1 1 440 . 10 1 1 A 42 42 THR H H 42 11.574 8.681 2.893 1 1 441 . 10 1 1 A 42 42 THR HA H 42 5.206 4.530 0.676 1 1 446 . 10 1 1 A 42 42 THR C C 42 177.935 175.438 2.497 1 1 447 . 10 1 1 A 42 42 THR CA C 42 60.400 61.193 -0.793 1 1 448 . 10 1 1 A 42 42 THR CB C 42 72.114 70.913 1.201 1 1 450 . 10 1 1 A 42 42 THR N N 42 114.394 114.664 -0.270 1 1 451 . 10 1 1 A 43 43 SER H H 43 9.715 8.861 0.854 1 1 452 . 10 1 1 A 43 43 SER HA H 43 4.252 4.228 0.024 1 1 455 . 10 1 1 A 43 43 SER C C 43 175.478 174.813 0.665 1 1 456 . 10 1 1 A 43 43 SER CA C 43 61.277 60.549 0.728 1 1 457 . 10 1 1 A 43 43 SER CB C 43 62.821 62.917 -0.096 1 1 458 . 10 1 1 A 43 43 SER N N 43 116.674 117.511 -0.837 1 1 459 . 10 1 1 A 44 44 GLU H H 44 7.674 7.599 0.075 1 1 460 . 10 1 1 A 44 44 GLU HA H 44 4.330 4.478 -0.148 1 1 464 . 10 1 1 A 44 44 GLU C C 44 175.001 175.273 -0.272 1 1 465 . 10 1 1 A 44 44 GLU CA C 44 55.992 55.556 0.436 1 1 466 . 10 1 1 A 44 44 GLU CB C 44 29.276 29.898 -0.622 1 1 468 . 10 1 1 A 44 44 GLU N N 44 117.856 118.164 -0.308 1 1 469 . 10 1 1 A 45 45 LEU H H 45 8.222 7.689 0.533 1 1 470 . 10 1 1 A 45 45 LEU HA H 45 3.901 4.620 -0.719 1 1 480 . 10 1 1 A 45 45 LEU C C 45 175.209 176.422 -1.213 1 1 481 . 10 1 1 A 45 45 LEU CA C 45 55.548 56.124 -0.576 1 1 482 . 10 1 1 A 45 45 LEU CB C 45 38.458 39.706 -1.248 1 1 485 . 10 1 1 A 45 45 LEU N N 45 119.335 117.495 1.840 1 1 486 . 10 1 1 A 46 46 SER H H 46 7.347 7.799 -0.452 1 1 487 . 10 1 1 A 46 46 SER HA H 46 3.954 4.148 -0.194 1 1 489 . 10 1 1 A 46 46 SER C C 46 177.497 176.311 1.186 1 1 490 . 10 1 1 A 46 46 SER CA C 46 62.471 62.324 0.147 1 1 491 . 10 1 1 A 46 46 SER CB C 46 63.908 62.847 1.061 1 1 492 . 10 1 1 A 46 46 SER N N 46 111.433 113.261 -1.828 1 1 493 . 10 1 1 A 47 47 LEU H H 47 12.003 8.160 3.843 1 1 494 . 10 1 1 A 47 47 LEU HA H 47 3.959 4.148 -0.189 1 1 504 . 10 1 1 A 47 47 LEU C C 47 180.340 178.212 2.128 1 1 505 . 10 1 1 A 47 47 LEU CA C 47 58.879 58.126 0.753 1 1 506 . 10 1 1 A 47 47 LEU CB C 47 39.572 41.840 -2.268 1 1 510 . 10 1 1 A 47 47 LEU N N 47 124.605 123.053 1.552 1 1 511 . 10 1 1 A 48 48 MET H H 48 10.599 8.974 1.625 1 1 512 . 10 1 1 A 48 48 MET HA H 48 3.213 3.760 -0.547 1 1 520 . 10 1 1 A 48 48 MET C C 48 181.177 177.941 3.236 1 1 521 . 10 1 1 A 48 48 MET CA C 48 60.747 58.152 2.595 1 1 522 . 10 1 1 A 48 48 MET CB C 48 32.594 31.973 0.621 1 1 525 . 10 1 1 A 48 48 MET N N 48 126.254 118.738 7.516 1 1 526 . 10 1 1 A 49 49 LEU H H 49 8.731 7.670 1.061 1 1 527 . 10 1 1 A 49 49 LEU HA H 49 4.097 4.500 -0.403 1 1 536 . 10 1 1 A 49 49 LEU C C 49 178.144 177.710 0.434 1 1 537 . 10 1 1 A 49 49 LEU CA C 49 57.800 57.028 0.772 1 1 538 . 10 1 1 A 49 49 LEU CB C 49 41.379 41.414 -0.035 1 1 541 . 10 1 1 A 49 49 LEU N N 49 119.183 120.853 -1.670 1 1 542 . 10 1 1 A 50 50 SER H H 50 7.853 7.299 0.554 1 1 543 . 10 1 1 A 50 50 SER HA H 50 4.822 4.469 0.353 1 1 546 . 10 1 1 A 50 50 SER C C 50 174.539 173.255 1.284 1 1 547 . 10 1 1 A 50 50 SER CA C 50 57.811 57.279 0.532 1 1 548 . 10 1 1 A 50 50 SER CB C 50 64.443 62.741 1.702 1 1 549 . 10 1 1 A 50 50 SER N N 50 114.594 113.803 0.791 1 1 550 . 10 1 1 A 51 51 ASP H H 51 8.264 7.674 0.590 1 1 551 . 10 1 1 A 51 51 ASP HA H 51 4.362 4.285 0.077 1 1 554 . 10 1 1 A 51 51 ASP C C 51 172.921 174.667 -1.746 1 1 555 . 10 1 1 A 51 51 ASP CA C 51 55.343 55.503 -0.160 1 1 556 . 10 1 1 A 51 51 ASP CB C 51 40.583 39.519 1.064 1 1 557 . 10 1 1 A 51 51 ASP N N 51 123.003 118.323 4.680 1 1 558 . 10 1 1 A 52 52 HIS H H 52 7.869 6.973 0.896 1 1 559 . 10 1 1 A 52 52 HIS HA H 52 5.335 5.111 0.224 1 1 564 . 10 1 1 A 52 52 HIS C C 52 173.991 173.528 0.463 1 1 565 . 10 1 1 A 52 52 HIS CA C 52 55.889 53.690 2.199 1 1 566 . 10 1 1 A 52 52 HIS CB C 52 31.789 30.634 1.155 1 1 568 . 10 1 1 A 52 52 HIS N N 52 112.486 117.006 -4.520 1 1 569 . 10 1 1 A 53 53 TRP H H 53 8.165 8.953 -0.788 1 1 570 . 10 1 1 A 53 53 TRP HA H 53 4.926 5.451 -0.525 1 1 578 . 10 1 1 A 53 53 TRP C C 53 175.354 175.106 0.248 1 1 579 . 10 1 1 A 53 53 TRP CA C 53 55.364 55.409 -0.045 1 1 580 . 10 1 1 A 53 53 TRP CB C 53 30.641 31.942 -1.301 1 1 585 . 10 1 1 A 53 53 TRP N N 53 117.916 124.292 -6.376 1 1 587 . 10 1 1 A 54 54 LEU H H 54 10.088 9.224 0.864 1 1 588 . 10 1 1 A 54 54 LEU HA H 54 5.497 5.317 0.180 1 1 598 . 10 1 1 A 54 54 LEU C C 54 173.337 174.802 -1.465 1 1 599 . 10 1 1 A 54 54 LEU CA C 54 54.408 53.538 0.870 1 1 600 . 10 1 1 A 54 54 LEU CB C 54 44.156 45.408 -1.252 1 1 604 . 10 1 1 A 54 54 LEU N N 54 130.826 125.604 5.222 1 1 605 . 10 1 1 A 55 55 ARG H H 55 9.289 9.295 -0.006 1 1 606 . 10 1 1 A 55 55 ARG HA H 55 5.482 4.989 0.493 1 1 612 . 10 1 1 A 55 55 ARG C C 55 174.057 174.062 -0.005 1 1 613 . 10 1 1 A 55 55 ARG CA C 55 53.167 54.365 -1.198 1 1 614 . 10 1 1 A 55 55 ARG CB C 55 34.270 32.880 1.390 1 1 616 . 10 1 1 A 55 55 ARG N N 55 125.089 124.272 0.817 1 1 618 . 10 1 1 A 56 56 GLN H H 56 9.092 9.470 -0.378 1 1 619 . 10 1 1 A 56 56 GLN HA H 56 3.991 4.935 -0.944 1 1 626 . 10 1 1 A 56 56 GLN C C 56 174.199 174.144 0.055 1 1 627 . 10 1 1 A 56 56 GLN CA C 56 54.566 54.011 0.555 1 1 628 . 10 1 1 A 56 56 GLN CB C 56 29.643 31.620 -1.977 1 1 630 . 10 1 1 A 56 56 GLN N N 56 124.355 123.630 0.725 1 1 632 . 10 1 1 A 57 57 ARG H H 57 8.440 8.180 0.260 1 1 633 . 10 1 1 A 57 57 ARG HA H 57 5.316 5.027 0.289 1 1 639 . 10 1 1 A 57 57 ARG C C 57 176.188 176.178 0.010 1 1 640 . 10 1 1 A 57 57 ARG CA C 57 53.940 55.397 -1.457 1 1 641 . 10 1 1 A 57 57 ARG CB C 57 32.426 31.220 1.206 1 1 643 . 10 1 1 A 57 57 ARG N N 57 130.222 125.890 4.332 1 1 645 . 10 1 1 A 58 58 GLU H H 58 8.891 9.029 -0.138 1 1 646 . 10 1 1 A 58 58 GLU HA H 58 3.996 4.043 -0.047 1 1 649 . 10 1 1 A 58 58 GLU CA C 58 58.364 57.534 0.830 1 1 650 . 10 1 1 A 58 58 GLU CB C 58 30.875 28.945 1.930 1 1 651 . 10 1 1 A 58 58 GLU N N 58 131.208 119.679 11.529 1 1 652 . 10 1 1 A 59 59 GLY H H 59 8.367 8.355 0.012 1 1 653 . 10 1 1 A 59 59 GLY HA2 H 59 4.334 3.726 0.608 1 1 654 . 10 1 1 A 59 59 GLY HA3 H 59 3.743 3.833 -0.090 1 1 655 . 10 1 1 A 59 59 GLY C C 59 174.194 175.133 -0.939 1 1 656 . 10 1 1 A 59 59 GLY CA C 59 45.666 45.676 -0.010 1 1 657 . 10 1 1 A 60 60 SER H H 60 8.071 8.130 -0.059 1 1 658 . 10 1 1 A 60 60 SER HA H 60 4.730 4.384 0.346 1 1 661 . 10 1 1 A 60 60 SER C C 60 173.908 174.036 -0.128 1 1 662 . 10 1 1 A 60 60 SER CA C 60 58.762 59.252 -0.490 1 1 663 . 10 1 1 A 60 60 SER CB C 60 64.497 63.141 1.356 1 1 664 . 10 1 1 A 60 60 SER N N 60 114.636 114.781 -0.145 1 1 665 . 10 1 1 A 61 61 GLY H H 61 8.401 7.559 0.842 1 1 666 . 10 1 1 A 61 61 GLY HA2 H 61 4.560 3.988 0.572 1 1 667 . 10 1 1 A 61 61 GLY HA3 H 61 3.878 4.008 -0.130 1 1 668 . 10 1 1 A 61 61 GLY C C 61 173.526 171.741 1.785 1 1 669 . 10 1 1 A 61 61 GLY CA C 61 44.906 45.667 -0.761 1 1 670 . 10 1 1 A 61 61 GLY N N 61 109.421 105.888 3.533 1 1 671 . 10 1 1 A 62 62 TRP H H 62 8.861 8.499 0.362 1 1 672 . 10 1 1 A 62 62 TRP HA H 62 5.089 5.102 -0.013 1 1 681 . 10 1 1 A 62 62 TRP C C 62 176.168 176.421 -0.253 1 1 682 . 10 1 1 A 62 62 TRP CA C 62 57.459 57.438 0.021 1 1 683 . 10 1 1 A 62 62 TRP CB C 62 32.536 30.567 1.969 1 1 689 . 10 1 1 A 62 62 TRP N N 62 122.939 121.799 1.140 1 1 691 . 10 1 1 A 63 63 GLU H H 63 9.306 9.117 0.189 1 1 692 . 10 1 1 A 63 63 GLU HA H 63 4.919 5.182 -0.263 1 1 697 . 10 1 1 A 63 63 GLU C C 63 173.770 175.033 -1.263 1 1 698 . 10 1 1 A 63 63 GLU CA C 63 55.953 55.093 0.860 1 1 699 . 10 1 1 A 63 63 GLU CB C 63 35.317 32.937 2.380 1 1 701 . 10 1 1 A 63 63 GLU N N 63 120.136 122.720 -2.584 1 1 702 . 10 1 1 A 64 64 LEU H H 64 8.998 9.428 -0.430 1 1 703 . 10 1 1 A 64 64 LEU HA H 64 5.616 5.433 0.183 1 1 712 . 10 1 1 A 64 64 LEU C C 64 175.014 173.963 1.051 1 1 713 . 10 1 1 A 64 64 LEU CA C 64 52.945 53.816 -0.871 1 1 714 . 10 1 1 A 64 64 LEU CB C 64 46.904 46.317 0.587 1 1 717 . 10 1 1 A 64 64 LEU N N 64 127.321 126.428 0.893 1 1 718 . 10 1 1 A 65 65 LYS H H 65 9.322 9.847 -0.525 1 1 719 . 10 1 1 A 65 65 LYS HA H 65 5.347 5.176 0.171 1 1 727 . 10 1 1 A 65 65 LYS C C 65 175.811 175.545 0.266 1 1 728 . 10 1 1 A 65 65 LYS CA C 65 55.817 55.328 0.489 1 1 729 . 10 1 1 A 65 65 LYS CB C 65 34.521 35.000 -0.479 1 1 733 . 10 1 1 A 65 65 LYS N N 65 129.874 128.433 1.441 1 1 734 . 10 1 1 A 66 66 CYS H H 66 9.129 9.390 -0.261 1 1 735 . 10 1 1 A 66 66 CYS HA H 66 5.319 5.148 0.171 1 1 738 . 10 1 1 A 66 66 CYS CA C 66 54.532 57.511 -2.979 1 1 739 . 10 1 1 A 66 66 CYS CB C 66 28.813 29.199 -0.386 1 1 740 . 10 1 1 A 66 66 CYS N N 66 121.497 125.968 -4.471 1 1 741 . 10 1 1 A 67 67 PRO HA H 67 4.439 4.514 -0.075 1 1 748 . 10 1 1 A 67 67 PRO C C 67 177.297 177.869 -0.572 1 1 749 . 10 1 1 A 67 67 PRO CA C 67 63.596 63.654 -0.058 1 1 750 . 10 1 1 A 67 67 PRO CB C 67 32.242 32.237 0.005 1 1 752 . 10 1 1 A 68 68 GLY H H 68 8.316 8.187 0.129 1 1 753 . 10 1 1 A 68 68 GLY HA2 H 68 3.726 3.972 -0.246 1 1 754 . 10 1 1 A 68 68 GLY HA3 H 68 4.095 3.996 0.099 1 1 755 . 10 1 1 A 68 68 GLY C C 68 173.789 174.176 -0.387 1 1 756 . 10 1 1 A 68 68 GLY CA C 68 45.227 45.425 -0.198 1 1 757 . 10 1 1 A 68 68 GLY N N 68 109.533 109.583 -0.050 1 1 758 . 10 1 1 A 69 69 VAL H H 69 8.114 7.952 0.162 1 1 759 . 10 1 1 A 69 69 VAL HA H 69 4.266 4.147 0.119 1 1 764 . 10 1 1 A 69 69 VAL C C 69 176.299 174.963 1.336 1 1 765 . 10 1 1 A 69 69 VAL CA C 69 61.945 62.557 -0.612 1 1 766 . 10 1 1 A 69 69 VAL CB C 69 33.082 32.815 0.267 1 1 768 . 10 1 1 A 69 69 VAL N N 69 118.540 122.931 -4.391 1 1 769 . 10 1 1 A 70 70 THR H H 70 8.324 8.568 -0.244 1 1 770 . 10 1 1 A 70 70 THR HA H 70 4.373 4.964 -0.591 1 1 775 . 10 1 1 A 70 70 THR C C 70 175.204 174.193 1.011 1 1 776 . 10 1 1 A 70 70 THR CA C 70 62.309 60.252 2.057 1 1 777 . 10 1 1 A 70 70 THR CB C 70 69.787 70.346 -0.559 1 1 779 . 10 1 1 A 70 70 THR N N 70 117.636 117.938 -0.302 1 1 780 . 10 1 1 A 71 71 GLY H H 71 8.574 9.483 -0.909 1 1 781 . 10 1 1 A 71 71 GLY HA2 H 71 4.096 3.974 0.122 1 1 782 . 10 1 1 A 71 71 GLY HA3 H 71 3.975 3.975 0.000 1 1 783 . 10 1 1 A 71 71 GLY C C 71 174.313 174.498 -0.185 1 1 784 . 10 1 1 A 71 71 GLY CA C 71 45.545 46.319 -0.774 1 1 785 . 10 1 1 A 71 71 GLY N N 71 111.677 114.260 -2.583 1 1 786 . 10 1 1 A 72 72 VAL H H 72 7.945 8.072 -0.127 1 1 787 . 10 1 1 A 72 72 VAL HA H 72 4.258 4.072 0.186 1 1 795 . 10 1 1 A 72 72 VAL C C 72 176.162 176.271 -0.109 1 1 796 . 10 1 1 A 72 72 VAL CA C 72 62.227 64.883 -2.656 1 1 797 . 10 1 1 A 72 72 VAL CB C 72 32.997 32.400 0.597 1 1 799 . 10 1 1 A 72 72 VAL N N 72 118.647 118.441 0.206 1 1 800 . 10 1 1 A 73 73 SER H H 73 8.498 8.243 0.255 1 1 801 . 10 1 1 A 73 73 SER HA H 73 4.617 4.138 0.479 1 1 803 . 10 1 1 A 73 73 SER C C 73 174.461 173.157 1.304 1 1 804 . 10 1 1 A 73 73 SER CA C 73 58.218 59.136 -0.918 1 1 805 . 10 1 1 A 73 73 SER CB C 73 64.061 62.187 1.874 1 1 806 . 10 1 1 A 73 73 SER N N 73 118.828 116.965 1.863 1 1 807 . 10 1 1 A 74 74 GLY H H 74 8.247 8.320 -0.073 1 1 808 . 10 1 1 A 74 74 GLY HA2 H 74 4.101 4.169 -0.068 1 1 809 . 10 1 1 A 74 74 GLY HA3 H 74 4.304 4.172 0.132 1 1 810 . 10 1 1 A 74 74 GLY CA C 74 44.896 45.291 -0.395 1 1 811 . 10 1 1 A 74 74 GLY N N 74 111.138 113.523 -2.385 1 1 812 . 10 1 1 A 75 75 PRO HA H 75 4.461 4.502 -0.041 1 1 819 . 10 1 1 A 75 75 PRO C C 75 176.798 176.635 0.163 1 1 820 . 10 1 1 A 75 75 PRO CA C 75 63.466 62.411 1.055 1 1 821 . 10 1 1 A 75 75 PRO CB C 75 31.980 32.775 -0.795 1 1 824 . 10 1 1 A 76 76 HIS H H 76 8.397 8.077 0.320 1 1 825 . 10 1 1 A 76 76 HIS HA H 76 4.742 4.756 -0.014 1 1 829 . 10 1 1 A 76 76 HIS C C 76 174.282 175.639 -1.357 1 1 830 . 10 1 1 A 76 76 HIS CA C 76 55.579 54.848 0.731 1 1 831 . 10 1 1 A 76 76 HIS CB C 76 30.501 30.689 -0.188 1 1 832 . 10 1 1 A 76 76 HIS N N 76 118.431 118.075 0.356 1 1 833 . 10 1 1 A 77 77 ASN H H 77 8.364 9.438 -1.074 1 1 834 . 10 1 1 A 77 77 ASN HA H 77 4.767 4.917 -0.150 1 1 839 . 10 1 1 A 77 77 ASN C C 77 174.576 174.878 -0.302 1 1 840 . 10 1 1 A 77 77 ASN CA C 77 53.139 52.787 0.352 1 1 841 . 10 1 1 A 77 77 ASN CB C 77 39.320 38.609 0.711 1 1 842 . 10 1 1 A 77 77 ASN N N 77 119.421 118.875 0.546 1 1 844 . 10 1 1 A 78 78 GLU H H 78 8.683 8.046 0.637 1 1 845 . 10 1 1 A 78 78 GLU HA H 78 4.409 4.207 0.202 1 1 850 . 10 1 1 A 78 78 GLU C C 78 175.791 174.773 1.018 1 1 851 . 10 1 1 A 78 78 GLU CA C 78 56.359 56.778 -0.419 1 1 852 . 10 1 1 A 78 78 GLU CB C 78 30.818 29.274 1.544 1 1 854 . 10 1 1 A 78 78 GLU N N 78 122.085 118.036 4.049 1 1 855 . 10 1 1 A 79 79 TYR H H 79 8.341 8.610 -0.269 1 1 856 . 10 1 1 A 79 79 TYR HA H 79 4.988 5.210 -0.222 1 1 861 . 10 1 1 A 79 79 TYR C C 79 175.837 176.154 -0.317 1 1 862 . 10 1 1 A 79 79 TYR CA C 79 58.028 58.190 -0.162 1 1 863 . 10 1 1 A 79 79 TYR CB C 79 41.672 39.597 2.075 1 1 866 . 10 1 1 A 79 79 TYR N N 79 119.452 121.440 -1.988 1 1 867 . 10 1 1 A 80 80 VAL H H 80 9.366 9.452 -0.086 1 1 868 . 10 1 1 A 80 80 VAL HA H 80 4.370 5.000 -0.630 1 1 873 . 10 1 1 A 80 80 VAL C C 80 174.948 174.454 0.494 1 1 874 . 10 1 1 A 80 80 VAL CA C 80 61.190 59.374 1.816 1 1 875 . 10 1 1 A 80 80 VAL CB C 80 34.204 34.424 -0.220 1 1 877 . 10 1 1 A 80 80 VAL N N 80 120.567 118.275 2.292 1 1 878 . 10 1 1 A 81 81 GLU H H 81 8.570 9.035 -0.465 1 1 879 . 10 1 1 A 81 81 GLU HA H 81 4.770 5.286 -0.516 1 1 883 . 10 1 1 A 81 81 GLU C C 81 175.491 175.616 -0.125 1 1 884 . 10 1 1 A 81 81 GLU CA C 81 55.655 54.980 0.675 1 1 885 . 10 1 1 A 81 81 GLU CB C 81 30.415 31.853 -1.438 1 1 887 . 10 1 1 A 81 81 GLU N N 81 124.248 122.499 1.749 1 1 888 . 10 1 1 A 82 82 VAL H H 82 9.189 8.992 0.197 1 1 889 . 10 1 1 A 82 82 VAL HA H 82 4.279 4.903 -0.624 1 1 894 . 10 1 1 A 82 82 VAL C C 82 176.087 175.727 0.360 1 1 895 . 10 1 1 A 82 82 VAL CA C 82 62.672 60.727 1.945 1 1 896 . 10 1 1 A 82 82 VAL CB C 82 33.121 33.751 -0.630 1 1 898 . 10 1 1 A 82 82 VAL N N 82 127.776 120.575 7.201 1 1 899 . 10 1 1 A 83 83 THR H H 83 8.590 8.629 -0.039 1 1 900 . 10 1 1 A 83 83 THR HA H 83 4.955 4.752 0.203 1 1 905 . 10 1 1 A 83 83 THR C C 83 174.688 174.003 0.685 1 1 906 . 10 1 1 A 83 83 THR CA C 83 61.332 61.041 0.291 1 1 907 . 10 1 1 A 83 83 THR CB C 83 70.213 70.421 -0.208 1 1 909 . 10 1 1 A 83 83 THR N N 83 114.744 115.792 -1.048 1 1 910 . 10 1 1 A 84 84 SER H H 84 7.650 7.660 -0.010 1 1 911 . 10 1 1 A 84 84 SER HA H 84 4.819 4.651 0.168 1 1 914 . 10 1 1 A 84 84 SER CA C 84 56.280 58.698 -2.418 1 1 915 . 10 1 1 A 84 84 SER CB C 84 63.294 63.978 -0.684 1 1 916 . 10 1 1 A 84 84 SER N N 84 118.038 117.823 0.215 1 1 917 . 10 1 1 A 85 85 GLU H H 85 8.391 8.952 -0.561 1 1 918 . 10 1 1 A 85 85 GLU HA H 85 3.661 3.946 -0.285 1 1 923 . 10 1 1 A 85 85 GLU C C 85 177.520 178.583 -1.063 1 1 924 . 10 1 1 A 85 85 GLU CA C 85 62.429 59.706 2.723 1 1 925 . 10 1 1 A 85 85 GLU CB C 85 29.655 29.277 0.378 1 1 927 . 10 1 1 A 86 86 ALA H H 86 8.443 8.128 0.315 1 1 928 . 10 1 1 A 86 86 ALA HA H 86 4.027 4.033 -0.006 1 1 932 . 10 1 1 A 86 86 ALA C C 86 180.423 180.062 0.361 1 1 933 . 10 1 1 A 86 86 ALA CA C 86 55.145 54.821 0.324 1 1 934 . 10 1 1 A 86 86 ALA CB C 86 18.165 18.121 0.044 1 1 935 . 10 1 1 A 86 86 ALA N N 86 119.636 123.133 -3.497 1 1 936 . 10 1 1 A 87 87 ALA H H 87 7.214 7.450 -0.236 1 1 937 . 10 1 1 A 87 87 ALA HA H 87 4.244 4.032 0.212 1 1 941 . 10 1 1 A 87 87 ALA C C 87 180.354 179.662 0.692 1 1 942 . 10 1 1 A 87 87 ALA CA C 87 54.378 54.748 -0.370 1 1 943 . 10 1 1 A 87 87 ALA CB C 87 18.795 18.294 0.501 1 1 944 . 10 1 1 A 87 87 ALA N N 87 121.004 120.323 0.681 1 1 945 . 10 1 1 A 88 88 ILE H H 88 8.471 7.774 0.697 1 1 946 . 10 1 1 A 88 88 ILE HA H 88 3.360 3.596 -0.236 1 1 954 . 10 1 1 A 88 88 ILE CA C 88 66.323 64.999 1.324 1 1 955 . 10 1 1 A 88 88 ILE CB C 88 37.808 37.751 0.057 1 1 958 . 10 1 1 A 88 88 ILE N N 88 120.743 119.896 0.847 1 1 959 . 10 1 1 A 89 89 VAL H H 89 8.343 8.453 -0.110 1 1 960 . 10 1 1 A 89 89 VAL HA H 89 3.061 3.479 -0.418 1 1 968 . 10 1 1 A 89 89 VAL C C 89 176.708 177.766 -1.058 1 1 969 . 10 1 1 A 89 89 VAL CA C 89 67.833 66.539 1.294 1 1 970 . 10 1 1 A 89 89 VAL CB C 89 31.509 31.443 0.066 1 1 973 . 10 1 1 A 89 89 VAL N N 89 118.049 119.766 -1.717 1 1 974 . 10 1 1 A 90 90 ALA H H 90 7.516 8.020 -0.504 1 1 975 . 10 1 1 A 90 90 ALA HA H 90 3.987 3.827 0.160 1 1 979 . 10 1 1 A 90 90 ALA C C 90 180.744 179.852 0.892 1 1 980 . 10 1 1 A 90 90 ALA CA C 90 55.481 55.750 -0.269 1 1 981 . 10 1 1 A 90 90 ALA CB C 90 17.953 18.629 -0.676 1 1 982 . 10 1 1 A 90 90 ALA N N 90 118.935 121.702 -2.767 1 1 983 . 10 1 1 A 91 91 GLN H H 91 7.886 8.134 -0.248 1 1 984 . 10 1 1 A 91 91 GLN HA H 91 4.190 3.954 0.236 1 1 991 . 10 1 1 A 91 91 GLN C C 91 178.832 178.759 0.073 1 1 992 . 10 1 1 A 91 91 GLN CA C 91 58.519 59.056 -0.537 1 1 993 . 10 1 1 A 91 91 GLN CB C 91 28.091 28.321 -0.230 1 1 995 . 10 1 1 A 91 91 GLN N N 91 117.846 118.251 -0.405 1 1 997 . 10 1 1 A 92 92 LEU H H 92 8.751 8.672 0.079 1 1 998 . 10 1 1 A 92 92 LEU HA H 92 3.903 3.997 -0.094 1 1 1007 . 10 1 1 A 92 92 LEU C C 92 178.997 179.283 -0.286 1 1 1008 . 10 1 1 A 92 92 LEU CA C 92 58.136 57.929 0.207 1 1 1009 . 10 1 1 A 92 92 LEU CB C 92 41.576 41.667 -0.091 1 1 1013 . 10 1 1 A 92 92 LEU N N 92 119.547 119.450 0.097 1 1 1014 . 10 1 1 A 93 93 PHE H H 93 8.648 7.980 0.668 1 1 1015 . 10 1 1 A 93 93 PHE HA H 93 4.270 4.880 -0.610 1 1 1020 . 10 1 1 A 93 93 PHE C C 93 179.283 178.844 0.439 1 1 1021 . 10 1 1 A 93 93 PHE CA C 93 59.860 60.468 -0.608 1 1 1022 . 10 1 1 A 93 93 PHE CB C 93 37.765 38.287 -0.522 1 1 1025 . 10 1 1 A 93 93 PHE N N 93 118.041 118.976 -0.935 1 1 1026 . 10 1 1 A 94 94 GLU H H 94 7.739 8.272 -0.533 1 1 1027 . 10 1 1 A 94 94 GLU HA H 94 4.110 4.135 -0.025 1 1 1031 . 10 1 1 A 94 94 GLU C C 94 178.629 178.960 -0.331 1 1 1032 . 10 1 1 A 94 94 GLU CA C 94 59.359 59.406 -0.047 1 1 1033 . 10 1 1 A 94 94 GLU CB C 94 29.589 28.899 0.690 1 1 1035 . 10 1 1 A 94 94 GLU N N 94 119.980 117.208 2.772 1 1 1036 . 10 1 1 A 95 95 LEU H H 95 7.999 8.421 -0.422 1 1 1037 . 10 1 1 A 95 95 LEU HA H 95 4.139 4.009 0.130 1 1 1047 . 10 1 1 A 95 95 LEU C C 95 178.965 178.869 0.096 1 1 1048 . 10 1 1 A 95 95 LEU CA C 95 57.557 57.883 -0.326 1 1 1049 . 10 1 1 A 95 95 LEU CB C 95 43.443 41.468 1.975 1 1 1053 . 10 1 1 A 95 95 LEU N N 95 118.398 121.634 -3.236 1 1 1054 . 10 1 1 A 96 96 LEU H H 96 8.363 7.947 0.416 1 1 1055 . 10 1 1 A 96 96 LEU HA H 96 4.503 4.292 0.211 1 1 1061 . 10 1 1 A 96 96 LEU C C 96 177.932 177.219 0.713 1 1 1062 . 10 1 1 A 96 96 LEU CA C 96 54.700 55.366 -0.666 1 1 1063 . 10 1 1 A 96 96 LEU CB C 96 43.048 42.732 0.316 1 1 1065 . 10 1 1 A 96 96 LEU N N 96 114.720 116.811 -2.091 1 1 1066 . 10 1 1 A 97 97 GLY H H 97 7.810 7.882 -0.072 1 1 1067 . 10 1 1 A 97 97 GLY HA2 H 97 3.963 3.918 0.045 1 1 1068 . 10 1 1 A 97 97 GLY C C 97 173.535 175.003 -1.468 1 1 1069 . 10 1 1 A 97 97 GLY CA C 97 45.667 46.615 -0.948 1 1 1070 . 10 1 1 A 97 97 GLY N N 97 109.511 108.354 1.157 1 1 1071 . 10 1 1 A 98 98 SER H H 98 8.131 8.137 -0.006 1 1 1072 . 10 1 1 A 98 98 SER HA H 98 4.225 4.063 0.162 1 1 1075 . 10 1 1 A 98 98 SER C C 98 174.974 175.136 -0.162 1 1 1076 . 10 1 1 A 98 98 SER CA C 98 57.960 61.647 -3.687 1 1 1077 . 10 1 1 A 98 98 SER CB C 98 63.997 62.621 1.376 1 1 1078 . 10 1 1 A 98 98 SER N N 98 113.405 113.238 0.167 1 1 1079 . 10 1 1 A 99 99 GLY H H 99 8.052 8.169 -0.117 1 1 1080 . 10 1 1 A 99 99 GLY HA2 H 99 3.998 3.901 0.097 1 1 1081 . 10 1 1 A 99 99 GLY HA3 H 99 3.778 3.946 -0.168 1 1 1082 . 10 1 1 A 99 99 GLY C C 99 174.033 174.330 -0.297 1 1 1083 . 10 1 1 A 99 99 GLY CA C 99 45.123 45.826 -0.703 1 1 1084 . 10 1 1 A 99 99 GLY N N 99 111.534 108.638 2.896 1 1 1085 . 10 1 1 A 100 100 GLU H H 100 8.177 7.777 0.400 1 1 1086 . 10 1 1 A 100 100 GLU HA H 100 4.201 4.633 -0.432 1 1 1091 . 10 1 1 A 100 100 GLU C C 100 175.830 176.261 -0.431 1 1 1092 . 10 1 1 A 100 100 GLU CA C 100 56.442 55.663 0.779 1 1 1093 . 10 1 1 A 100 100 GLU CB C 100 30.428 31.203 -0.775 1 1 1095 . 10 1 1 A 100 100 GLU N N 100 120.463 119.900 0.563 1 1 1096 . 10 1 1 A 101 101 GLN H H 101 8.161 8.363 -0.202 1 1 1097 . 10 1 1 A 101 101 GLN HA H 101 4.098 4.253 -0.155 1 1 1103 . 10 1 1 A 101 101 GLN C C 101 175.412 175.760 -0.348 1 1 1104 . 10 1 1 A 101 101 GLN CA C 101 55.632 56.365 -0.733 1 1 1105 . 10 1 1 A 101 101 GLN CB C 101 29.569 28.991 0.578 1 1 1107 . 10 1 1 A 101 101 GLN N N 101 120.014 121.224 -1.210 1 1 1109 . 10 1 1 A 102 102 LYS H H 102 8.235 8.526 -0.291 1 1 1110 . 10 1 1 A 102 102 LYS HA H 102 4.387 4.112 0.275 1 1 1117 . 10 1 1 A 102 102 LYS CA C 102 54.116 54.326 -0.210 1 1 1118 . 10 1 1 A 102 102 LYS CB C 102 32.478 32.482 -0.004 1 1 1122 . 10 1 1 A 102 102 LYS N N 102 123.399 123.452 -0.053 1 1 1123 . 10 1 1 A 103 103 PRO HA H 103 4.498 4.726 -0.228 1 1 1129 . 10 1 1 A 103 103 PRO C C 103 175.473 175.982 -0.509 1 1 1130 . 10 1 1 A 103 103 PRO CA C 103 62.802 62.200 0.602 1 1 1131 . 10 1 1 A 103 103 PRO CB C 103 32.124 33.090 -0.966 1 1 1134 . 10 1 1 A 104 104 ALA H H 104 8.017 8.165 -0.148 1 1 1135 . 10 1 1 A 104 104 ALA HA H 104 4.318 4.427 -0.109 1 1 1139 . 10 1 1 A 104 104 ALA C C 104 176.717 176.807 -0.090 1 1 1140 . 10 1 1 A 104 104 ALA CA C 104 52.194 51.650 0.544 1 1 1141 . 10 1 1 A 104 104 ALA CB C 104 20.113 21.234 -1.121 1 1 1142 . 10 1 1 A 104 104 ALA N N 104 122.093 119.254 2.839 1 1 1143 . 10 1 1 A 105 105 GLY H H 105 7.678 8.320 -0.642 1 1 1144 . 10 1 1 A 105 105 GLY HA2 H 105 3.851 4.085 -0.234 1 1 1145 . 10 1 1 A 105 105 GLY HA3 H 105 4.053 4.102 -0.049 1 1 1146 . 10 1 1 A 105 105 GLY C C 105 172.990 174.826 -1.836 1 1 1147 . 10 1 1 A 105 105 GLY CA C 105 44.241 43.578 0.663 1 1 1148 . 10 1 1 A 105 105 GLY N N 105 105.234 107.105 -1.871 1 1 1149 . 10 1 1 A 106 106 VAL H H 106 8.409 8.623 -0.214 1 1 1150 . 10 1 1 A 106 106 VAL HA H 106 2.829 3.317 -0.488 1 1 1158 . 10 1 1 A 106 106 VAL C C 106 177.822 177.375 0.447 1 1 1159 . 10 1 1 A 106 106 VAL CA C 106 65.522 65.572 -0.050 1 1 1160 . 10 1 1 A 106 106 VAL CB C 106 30.701 30.665 0.036 1 1 1163 . 10 1 1 A 106 106 VAL N N 106 119.215 121.681 -2.466 1 1 1164 . 10 1 1 A 107 107 ALA H H 107 8.707 8.419 0.288 1 1 1165 . 10 1 1 A 107 107 ALA HA H 107 3.730 3.822 -0.092 1 1 1169 . 10 1 1 A 107 107 ALA C C 107 179.661 180.058 -0.397 1 1 1170 . 10 1 1 A 107 107 ALA CA C 107 54.995 55.469 -0.474 1 1 1171 . 10 1 1 A 107 107 ALA CB C 107 17.705 17.923 -0.218 1 1 1172 . 10 1 1 A 107 107 ALA N N 107 118.672 121.935 -3.263 1 1 1173 . 10 1 1 A 108 108 ALA H H 108 7.388 7.739 -0.351 1 1 1174 . 10 1 1 A 108 108 ALA HA H 108 4.259 4.035 0.224 1 1 1178 . 10 1 1 A 108 108 ALA C C 108 179.318 179.466 -0.148 1 1 1179 . 10 1 1 A 108 108 ALA CA C 108 53.481 55.083 -1.602 1 1 1180 . 10 1 1 A 108 108 ALA CB C 108 19.367 18.561 0.806 1 1 1181 . 10 1 1 A 108 108 ALA N N 108 116.635 120.756 -4.121 1 1 1182 . 10 1 1 A 109 109 VAL H H 109 7.689 7.725 -0.036 1 1 1183 . 10 1 1 A 109 109 VAL HA H 109 4.532 3.797 0.735 1 1 1191 . 10 1 1 A 109 109 VAL C C 109 176.055 178.007 -1.952 1 1 1192 . 10 1 1 A 109 109 VAL CA C 109 61.452 65.769 -4.317 1 1 1193 . 10 1 1 A 109 109 VAL CB C 109 32.728 31.418 1.310 1 1 1196 . 10 1 1 A 109 109 VAL N N 109 112.851 117.230 -4.379 1 1 1197 . 10 1 1 A 110 110 LEU H H 110 7.099 8.331 -1.232 1 1 1198 . 10 1 1 A 110 110 LEU HA H 110 3.723 3.814 -0.091 1 1 1208 . 10 1 1 A 110 110 LEU C C 110 179.040 178.837 0.203 1 1 1209 . 10 1 1 A 110 110 LEU CA C 110 58.825 57.872 0.953 1 1 1210 . 10 1 1 A 110 110 LEU CB C 110 41.242 41.750 -0.508 1 1 1214 . 10 1 1 A 110 110 LEU N N 110 119.829 125.016 -5.187 1 1 1215 . 10 1 1 A 111 111 GLY H H 111 8.435 7.953 0.482 1 1 1216 . 10 1 1 A 111 111 GLY HA2 H 111 3.970 3.816 0.154 1 1 1217 . 10 1 1 A 111 111 GLY HA3 H 111 3.885 3.824 0.061 1 1 1218 . 10 1 1 A 111 111 GLY C C 111 178.031 176.784 1.247 1 1 1219 . 10 1 1 A 111 111 GLY CA C 111 46.961 47.547 -0.586 1 1 1220 . 10 1 1 A 111 111 GLY N N 111 104.089 106.583 -2.494 1 1 1221 . 10 1 1 A 112 112 SER H H 112 8.343 8.156 0.187 1 1 1222 . 10 1 1 A 112 112 SER HA H 112 4.266 4.174 0.092 1 1 1224 . 10 1 1 A 112 112 SER C C 112 175.885 174.875 1.010 1 1 1225 . 10 1 1 A 112 112 SER CA C 112 61.304 62.451 -1.147 1 1 1226 . 10 1 1 A 112 112 SER CB C 112 62.901 62.994 -0.093 1 1 1227 . 10 1 1 A 112 112 SER N N 112 119.497 119.421 0.076 1 1 1228 . 10 1 1 A 113 113 LEU H H 113 7.667 7.653 0.014 1 1 1229 . 10 1 1 A 113 113 LEU HA H 113 4.343 4.241 0.102 1 1 1238 . 10 1 1 A 113 113 LEU C C 113 174.760 176.174 -1.414 1 1 1239 . 10 1 1 A 113 113 LEU CA C 113 54.228 54.413 -0.185 1 1 1240 . 10 1 1 A 113 113 LEU CB C 113 41.467 41.955 -0.488 1 1 1244 . 10 1 1 A 113 113 LEU N N 113 118.843 117.686 1.157 1 1 1245 . 10 1 1 A 114 114 LYS H H 114 7.685 7.893 -0.208 1 1 1246 . 10 1 1 A 114 114 LYS HA H 114 3.958 3.889 0.069 1 1 1250 . 10 1 1 A 114 114 LYS C C 114 177.557 175.815 1.742 1 1 1251 . 10 1 1 A 114 114 LYS CA C 114 56.935 57.495 -0.560 1 1 1252 . 10 1 1 A 114 114 LYS CB C 114 28.898 29.510 -0.612 1 1 1254 . 10 1 1 A 114 114 LYS N N 114 114.072 116.475 -2.403 1 1 1255 . 10 1 1 A 115 115 LEU H H 115 8.329 8.140 0.189 1 1 1256 . 10 1 1 A 115 115 LEU HA H 115 4.315 4.350 -0.035 1 1 1265 . 10 1 1 A 115 115 LEU C C 115 175.988 176.696 -0.708 1 1 1266 . 10 1 1 A 115 115 LEU CA C 115 54.310 55.496 -1.186 1 1 1267 . 10 1 1 A 115 115 LEU CB C 115 44.163 42.531 1.632 1 1 1270 . 10 1 1 A 115 115 LEU N N 115 117.951 119.649 -1.698 1 1 1271 . 10 1 1 A 116 116 GLN H H 116 9.100 9.310 -0.210 1 1 1272 . 10 1 1 A 116 116 GLN HA H 116 4.898 5.135 -0.237 1 1 1279 . 10 1 1 A 116 116 GLN CA C 116 53.467 53.969 -0.502 1 1 1280 . 10 1 1 A 116 116 GLN CB C 116 32.730 32.441 0.289 1 1 1282 . 10 1 1 A 116 116 GLN N N 116 119.994 120.069 -0.075 1 1 1284 . 10 1 1 A 117 117 GLU H H 117 8.849 8.607 0.242 1 1 1285 . 10 1 1 A 117 117 GLU HA H 117 3.707 4.079 -0.372 1 1 1290 . 10 1 1 A 117 117 GLU C C 117 177.303 176.608 0.695 1 1 1291 . 10 1 1 A 117 117 GLU CA C 117 57.233 55.785 1.448 1 1 1292 . 10 1 1 A 117 117 GLU CB C 117 29.634 29.035 0.599 1 1 1294 . 10 1 1 A 117 117 GLU N N 117 121.487 123.117 -1.630 1 1 1295 . 10 1 1 A 118 118 VAL H H 118 8.983 8.707 0.276 1 1 1296 . 10 1 1 A 118 118 VAL HA H 118 4.360 4.039 0.321 1 1 1304 . 10 1 1 A 118 118 VAL C C 118 174.171 175.250 -1.079 1 1 1305 . 10 1 1 A 118 118 VAL CA C 118 61.772 63.993 -2.221 1 1 1306 . 10 1 1 A 118 118 VAL CB C 118 34.095 32.969 1.126 1 1 1309 . 10 1 1 A 118 118 VAL N N 118 122.933 128.410 -5.477 1 1 1310 . 10 1 1 A 119 119 ALA H H 119 7.023 7.056 -0.033 1 1 1311 . 10 1 1 A 119 119 ALA HA H 119 4.378 4.379 -0.001 1 1 1315 . 10 1 1 A 119 119 ALA C C 119 175.493 175.130 0.363 1 1 1316 . 10 1 1 A 119 119 ALA CA C 119 51.956 50.936 1.020 1 1 1317 . 10 1 1 A 119 119 ALA CB C 119 23.957 21.534 2.423 1 1 1318 . 10 1 1 A 119 119 ALA N N 119 117.379 121.660 -4.281 1 1 1319 . 10 1 1 A 120 120 SER H H 120 6.999 8.602 -1.603 1 1 1320 . 10 1 1 A 120 120 SER HA H 120 5.208 5.209 -0.001 1 1 1323 . 10 1 1 A 120 120 SER C C 120 173.082 173.526 -0.444 1 1 1324 . 10 1 1 A 120 120 SER CA C 120 56.754 56.355 0.399 1 1 1325 . 10 1 1 A 120 120 SER CB C 120 64.605 65.834 -1.229 1 1 1326 . 10 1 1 A 120 120 SER N N 120 113.743 116.497 -2.754 1 1 1327 . 10 1 1 A 121 121 PHE H H 121 8.244 8.746 -0.502 1 1 1328 . 10 1 1 A 121 121 PHE HA H 121 5.177 5.358 -0.181 1 1 1333 . 10 1 1 A 121 121 PHE C C 121 173.569 172.590 0.979 1 1 1334 . 10 1 1 A 121 121 PHE CA C 121 55.555 55.500 0.055 1 1 1335 . 10 1 1 A 121 121 PHE CB C 121 40.959 42.193 -1.234 1 1 1338 . 10 1 1 A 121 121 PHE N N 121 120.358 118.323 2.035 1 1 1339 . 10 1 1 A 122 122 ILE H H 122 8.907 8.763 0.144 1 1 1340 . 10 1 1 A 122 122 ILE HA H 122 4.682 4.546 0.136 1 1 1348 . 10 1 1 A 122 122 ILE C C 122 176.925 175.592 1.333 1 1 1349 . 10 1 1 A 122 122 ILE CA C 122 60.740 61.267 -0.527 1 1 1350 . 10 1 1 A 122 122 ILE CB C 122 39.497 37.749 1.748 1 1 1353 . 10 1 1 A 122 122 ILE N N 122 121.282 121.667 -0.385 1 1 1354 . 10 1 1 A 123 123 THR H H 123 9.022 9.249 -0.227 1 1 1355 . 10 1 1 A 123 123 THR HA H 123 5.039 4.964 0.075 1 1 1360 . 10 1 1 A 123 123 THR C C 123 173.531 173.672 -0.141 1 1 1361 . 10 1 1 A 123 123 THR CA C 123 62.266 62.128 0.138 1 1 1362 . 10 1 1 A 123 123 THR CB C 123 70.677 68.803 1.874 1 1 1364 . 10 1 1 A 123 123 THR N N 123 128.965 123.695 5.270 1 1 1365 . 10 1 1 A 124 124 THR H H 124 8.961 9.196 -0.235 1 1 1366 . 10 1 1 A 124 124 THR HA H 124 5.001 5.047 -0.046 1 1 1371 . 10 1 1 A 124 124 THR C C 124 173.468 172.542 0.926 1 1 1372 . 10 1 1 A 124 124 THR CA C 124 62.109 61.686 0.423 1 1 1373 . 10 1 1 A 124 124 THR CB C 124 70.450 69.702 0.748 1 1 1375 . 10 1 1 A 124 124 THR N N 124 122.176 123.673 -1.497 1 1 1376 . 10 1 1 A 125 125 ARG H H 125 9.386 9.877 -0.491 1 1 1377 . 10 1 1 A 125 125 ARG HA H 125 5.764 5.264 0.500 1 1 1384 . 10 1 1 A 125 125 ARG C C 125 175.713 175.121 0.592 1 1 1385 . 10 1 1 A 125 125 ARG CA C 125 53.991 54.231 -0.240 1 1 1386 . 10 1 1 A 125 125 ARG CB C 125 33.557 32.442 1.115 1 1 1389 . 10 1 1 A 125 125 ARG N N 125 130.004 129.298 0.706 1 1 1390 . 10 1 1 A 126 126 SER H H 126 9.172 9.507 -0.335 1 1 1391 . 10 1 1 A 126 126 SER HA H 126 5.390 5.379 0.011 1 1 1394 . 10 1 1 A 126 126 SER C C 126 172.359 172.932 -0.573 1 1 1395 . 10 1 1 A 126 126 SER CA C 126 56.934 57.023 -0.089 1 1 1396 . 10 1 1 A 126 126 SER CB C 126 65.827 65.967 -0.140 1 1 1397 . 10 1 1 A 126 126 SER N N 126 119.906 120.768 -0.862 1 1 1398 . 10 1 1 A 127 127 SER H H 127 8.591 9.105 -0.514 1 1 1399 . 10 1 1 A 127 127 SER HA H 127 5.739 5.355 0.384 1 1 1401 . 10 1 1 A 127 127 SER C C 127 173.283 172.923 0.360 1 1 1402 . 10 1 1 A 127 127 SER CA C 127 57.354 57.783 -0.429 1 1 1403 . 10 1 1 A 127 127 SER CB C 127 65.412 64.968 0.444 1 1 1404 . 10 1 1 A 127 127 SER N N 127 117.914 120.349 -2.435 1 1 1405 . 10 1 1 A 128 128 TRP H H 128 9.866 9.550 0.316 1 1 1406 . 10 1 1 A 128 128 TRP HA H 128 5.560 5.818 -0.258 1 1 1415 . 10 1 1 A 128 128 TRP C C 128 175.828 174.791 1.037 1 1 1416 . 10 1 1 A 128 128 TRP CA C 128 55.852 55.654 0.198 1 1 1417 . 10 1 1 A 128 128 TRP CB C 128 32.524 34.097 -1.573 1 1 1423 . 10 1 1 A 128 128 TRP N N 128 127.978 125.092 2.886 1 1 1425 . 10 1 1 A 129 129 LYS H H 129 9.424 9.228 0.196 1 1 1426 . 10 1 1 A 129 129 LYS HA H 129 5.388 5.462 -0.074 1 1 1433 . 10 1 1 A 129 129 LYS C C 129 175.254 174.155 1.099 1 1 1434 . 10 1 1 A 129 129 LYS CA C 129 54.410 54.623 -0.213 1 1 1435 . 10 1 1 A 129 129 LYS CB C 129 35.734 36.202 -0.468 1 1 1439 . 10 1 1 A 129 129 LYS N N 129 121.784 119.089 2.695 1 1 1440 . 10 1 1 A 130 130 LEU H H 130 8.933 9.322 -0.389 1 1 1441 . 10 1 1 A 130 130 LEU HA H 130 4.859 5.179 -0.320 1 1 1447 . 10 1 1 A 130 130 LEU C C 130 173.893 174.042 -0.149 1 1 1448 . 10 1 1 A 130 130 LEU CA C 130 53.848 53.757 0.091 1 1 1449 . 10 1 1 A 130 130 LEU CB C 130 46.125 46.249 -0.124 1 1 1451 . 10 1 1 A 130 130 LEU N N 130 124.543 123.961 0.582 1 1 1452 . 10 1 1 A 131 131 ALA H H 131 8.816 8.919 -0.103 1 1 1453 . 10 1 1 A 131 131 ALA HA H 131 4.776 5.133 -0.357 1 1 1457 . 10 1 1 A 131 131 ALA C C 131 176.662 176.486 0.176 1 1 1458 . 10 1 1 A 131 131 ALA CA C 131 51.407 50.285 1.122 1 1 1459 . 10 1 1 A 131 131 ALA CB C 131 19.354 20.604 -1.250 1 1 1460 . 10 1 1 A 131 131 ALA N N 131 131.102 129.525 1.577 1 1 1461 . 10 1 1 A 132 132 LEU H H 132 8.487 8.713 -0.226 1 1 1462 . 10 1 1 A 132 132 LEU HA H 132 4.470 4.677 -0.207 1 1 1470 . 10 1 1 A 132 132 LEU C C 132 176.873 175.876 0.997 1 1 1471 . 10 1 1 A 132 132 LEU CA C 132 54.590 54.256 0.334 1 1 1472 . 10 1 1 A 132 132 LEU CB C 132 42.974 42.778 0.196 1 1 1475 . 10 1 1 A 132 132 LEU N N 132 123.724 123.922 -0.198 1 1 1476 . 10 1 1 A 133 133 SER H H 133 8.448 8.822 -0.374 1 1 1477 . 10 1 1 A 133 133 SER HA H 133 4.560 4.995 -0.435 1 1 1479 . 10 1 1 A 133 133 SER C C 133 176.043 172.975 3.068 1 1 1480 . 10 1 1 A 133 133 SER CA C 133 58.460 57.240 1.220 1 1 1481 . 10 1 1 A 133 133 SER CB C 133 63.985 66.036 -2.051 1 1 1482 . 10 1 1 A 133 133 SER N N 133 115.880 117.241 -1.361 1 1 1483 . 10 1 1 A 134 134 GLY H H 134 8.232 8.873 -0.641 1 1 1484 . 10 1 1 A 134 134 GLY HA2 H 134 4.147 4.233 -0.086 1 1 1485 . 10 1 1 A 134 134 GLY HA3 H 134 4.045 4.236 -0.191 1 1 1486 . 10 1 1 A 134 134 GLY C C 134 174.013 174.479 -0.466 1 1 1487 . 10 1 1 A 134 134 GLY CA C 134 45.337 46.068 -0.731 1 1 1488 . 10 1 1 A 134 134 GLY N N 134 109.970 108.681 1.289 1 1 1489 . 10 1 1 A 135 135 ALA H H 135 8.424 8.421 0.003 1 1 1490 . 10 1 1 A 135 135 ALA HA H 135 4.436 3.918 0.518 1 1 1494 . 10 1 1 A 135 135 ALA C C 135 177.537 177.480 0.057 1 1 1495 . 10 1 1 A 135 135 ALA CA C 135 52.721 54.792 -2.071 1 1 1496 . 10 1 1 A 135 135 ALA CB C 135 19.265 17.935 1.330 1 1 1497 . 10 1 1 A 135 135 ALA N N 135 124.118 126.421 -2.303 1 1 1498 . 10 1 1 A 136 136 HIS H H 136 8.466 8.389 0.077 1 1 1499 . 10 1 1 A 136 136 HIS HA H 136 4.379 4.584 -0.205 1 1 1500 . 10 1 1 A 136 136 HIS C C 136 176.259 175.688 0.571 1 1 1501 . 10 1 1 A 136 136 HIS CA C 136 56.082 57.231 -1.149 1 1 1502 . 10 1 1 A 136 136 HIS CB C 136 29.619 31.542 -1.923 1 1 1503 . 10 1 1 A 136 136 HIS N N 136 119.493 117.840 1.653 1 1 1504 . 10 1 1 A 137 137 GLY H H 137 8.431 7.839 0.592 1 1 1505 . 10 1 1 A 137 137 GLY HA2 H 137 4.151 3.968 0.183 1 1 1506 . 10 1 1 A 137 137 GLY HA3 H 137 3.893 3.973 -0.080 1 1 1507 . 10 1 1 A 137 137 GLY C C 137 174.039 172.760 1.279 1 1 1508 . 10 1 1 A 137 137 GLY CA C 137 45.372 44.981 0.391 1 1 1509 . 10 1 1 A 137 137 GLY N N 137 110.442 108.044 2.398 1 1 1510 . 10 1 1 A 138 138 GLN H H 138 8.416 8.493 -0.077 1 1 1511 . 10 1 1 A 138 138 GLN HA H 138 4.455 5.011 -0.556 1 1 1515 . 10 1 1 A 138 138 GLN C C 138 175.889 174.781 1.108 1 1 1516 . 10 1 1 A 138 138 GLN CA C 138 55.866 54.261 1.605 1 1 1517 . 10 1 1 A 138 138 GLN CB C 138 29.639 31.705 -2.066 1 1 1518 . 10 1 1 A 138 138 GLN N N 138 119.401 120.231 -0.830 1 1 1519 . 10 1 1 A 139 139 GLU H H 139 8.446 8.799 -0.353 1 1 1520 . 10 1 1 A 139 139 GLU HA H 139 4.658 4.757 -0.099 1 1 1524 . 10 1 1 A 139 139 GLU CA C 139 54.589 53.335 1.254 1 1 1525 . 10 1 1 A 139 139 GLU CB C 139 29.733 30.405 -0.672 1 1 1527 . 10 1 1 A 139 139 GLU N N 139 123.136 123.853 -0.717 1 1 1528 . 10 1 1 A 140 140 PRO HA H 140 4.537 4.492 0.045 1 1 1533 . 10 1 1 A 140 140 PRO C C 140 176.119 175.860 0.259 1 1 1534 . 10 1 1 A 140 140 PRO CA C 140 63.220 62.870 0.350 1 1 1535 . 10 1 1 A 140 140 PRO CB C 140 31.936 32.220 -0.284 1 1 1538 . 10 1 1 A 141 141 GLN H H 141 8.506 8.576 -0.070 1 1 1539 . 10 1 1 A 141 141 GLN HA H 141 4.650 5.081 -0.431 1 1 1546 . 10 1 1 A 141 141 GLN C C 141 175.811 175.762 0.049 1 1 1547 . 10 1 1 A 141 141 GLN CA C 141 55.912 55.578 0.334 1 1 1548 . 10 1 1 A 141 141 GLN CB C 141 30.241 29.953 0.288 1 1 1550 . 10 1 1 A 141 141 GLN N N 141 120.422 120.695 -0.273 1 1 1551 . 10 1 1 A 142 142 LEU H H 142 8.842 9.111 -0.269 1 1 1552 . 10 1 1 A 142 142 LEU HA H 142 5.277 5.250 0.027 1 1 1562 . 10 1 1 A 142 142 LEU C C 142 176.839 175.260 1.579 1 1 1563 . 10 1 1 A 142 142 LEU CA C 142 53.927 52.947 0.980 1 1 1564 . 10 1 1 A 142 142 LEU CB C 142 44.527 44.983 -0.456 1 1 1568 . 10 1 1 A 142 142 LEU N N 142 123.692 121.292 2.400 1 1 1569 . 10 1 1 A 143 143 THR H H 143 9.025 8.989 0.036 1 1 1570 . 10 1 1 A 143 143 THR HA H 143 5.262 5.029 0.233 1 1 1575 . 10 1 1 A 143 143 THR C C 143 173.753 174.034 -0.281 1 1 1576 . 10 1 1 A 143 143 THR CA C 143 61.795 61.879 -0.084 1 1 1577 . 10 1 1 A 143 143 THR CB C 143 70.660 70.453 0.207 1 1 1579 . 10 1 1 A 143 143 THR N N 143 117.222 117.223 -0.001 1 1 1580 . 10 1 1 A 144 144 ILE H H 144 9.353 10.275 -0.922 1 1 1581 . 10 1 1 A 144 144 ILE HA H 144 5.399 5.363 0.036 1 1 1591 . 10 1 1 A 144 144 ILE C C 144 173.931 173.655 0.276 1 1 1592 . 10 1 1 A 144 144 ILE CA C 144 60.774 60.340 0.434 1 1 1593 . 10 1 1 A 144 144 ILE CB C 144 41.111 39.571 1.540 1 1 1597 . 10 1 1 A 144 144 ILE N N 144 126.383 128.630 -2.247 1 1 1598 . 10 1 1 A 145 145 ASP H H 145 9.214 9.798 -0.584 1 1 1599 . 10 1 1 A 145 145 ASP HA H 145 5.978 5.516 0.462 1 1 1601 . 10 1 1 A 145 145 ASP C C 145 175.441 174.794 0.647 1 1 1602 . 10 1 1 A 145 145 ASP CA C 145 53.035 52.691 0.344 1 1 1603 . 10 1 1 A 145 145 ASP CB C 145 44.153 43.353 0.800 1 1 1604 . 10 1 1 A 145 145 ASP N N 145 127.981 128.865 -0.884 1 1 1605 . 10 1 1 A 146 146 LEU H H 146 9.387 9.792 -0.405 1 1 1606 . 10 1 1 A 146 146 LEU HA H 146 4.918 5.522 -0.604 1 1 1616 . 10 1 1 A 146 146 LEU C C 146 175.003 174.825 0.178 1 1 1617 . 10 1 1 A 146 146 LEU CA C 146 53.940 53.497 0.443 1 1 1618 . 10 1 1 A 146 146 LEU CB C 146 43.902 44.012 -0.110 1 1 1622 . 10 1 1 A 146 146 LEU N N 146 123.532 127.501 -3.969 1 1 1623 . 10 1 1 A 147 147 ASP H H 147 8.676 8.584 0.092 1 1 1624 . 10 1 1 A 147 147 ASP HA H 147 5.205 5.567 -0.362 1 1 1627 . 10 1 1 A 147 147 ASP C C 147 174.956 174.268 0.688 1 1 1628 . 10 1 1 A 147 147 ASP CA C 147 53.441 52.634 0.807 1 1 1629 . 10 1 1 A 147 147 ASP CB C 147 43.370 44.795 -1.425 1 1 1630 . 10 1 1 A 147 147 ASP N N 147 125.499 126.380 -0.881 1 1 1631 . 10 1 1 A 148 148 SER H H 148 8.732 8.799 -0.067 1 1 1632 . 10 1 1 A 148 148 SER HA H 148 5.365 5.051 0.314 1 1 1634 . 10 1 1 A 148 148 SER C C 148 173.217 172.897 0.320 1 1 1635 . 10 1 1 A 148 148 SER CA C 148 56.334 56.434 -0.100 1 1 1636 . 10 1 1 A 148 148 SER CB C 148 65.812 66.734 -0.922 1 1 1637 . 10 1 1 A 148 148 SER N N 148 118.623 117.332 1.291 1 1 1638 . 10 1 1 A 149 149 ALA H H 149 8.937 8.862 0.075 1 1 1639 . 10 1 1 A 149 149 ALA HA H 149 5.681 5.803 -0.122 1 1 1643 . 10 1 1 A 149 149 ALA C C 149 178.894 177.708 1.186 1 1 1644 . 10 1 1 A 149 149 ALA CA C 149 49.996 50.343 -0.347 1 1 1645 . 10 1 1 A 149 149 ALA CB C 149 23.231 22.630 0.601 1 1 1646 . 10 1 1 A 149 149 ALA N N 149 123.952 121.525 2.427 1 1 1647 . 10 1 1 A 150 150 ASP H H 150 9.010 8.773 0.237 1 1 1648 . 10 1 1 A 150 150 ASP HA H 150 4.336 4.360 -0.024 1 1 1651 . 10 1 1 A 150 150 ASP C C 150 176.697 177.218 -0.521 1 1 1652 . 10 1 1 A 150 150 ASP CA C 150 56.543 57.539 -0.996 1 1 1653 . 10 1 1 A 150 150 ASP CB C 150 39.850 40.747 -0.897 1 1 1654 . 10 1 1 A 150 150 ASP N N 150 122.687 122.653 0.034 1 1 1655 . 10 1 1 A 151 151 PHE H H 151 7.295 8.114 -0.819 1 1 1656 . 10 1 1 A 151 151 PHE HA H 151 5.020 4.626 0.394 1 1 1661 . 10 1 1 A 151 151 PHE C C 151 174.756 175.439 -0.683 1 1 1662 . 10 1 1 A 151 151 PHE CA C 151 56.594 56.611 -0.017 1 1 1663 . 10 1 1 A 151 151 PHE CB C 151 37.765 37.692 0.073 1 1 1666 . 10 1 1 A 151 151 PHE N N 151 113.928 120.444 -6.516 1 1 1667 . 10 1 1 A 152 152 GLY H H 152 7.786 8.207 -0.421 1 1 1668 . 10 1 1 A 152 152 GLY HA2 H 152 4.459 3.949 0.510 1 1 1669 . 10 1 1 A 152 152 GLY HA3 H 152 3.728 3.956 -0.228 1 1 1670 . 10 1 1 A 152 152 GLY C C 152 172.709 173.546 -0.837 1 1 1671 . 10 1 1 A 152 152 GLY CA C 152 46.106 47.300 -1.194 1 1 1672 . 10 1 1 A 152 152 GLY N N 152 110.312 111.105 -0.793 1 1 1673 . 10 1 1 A 153 153 TYR H H 153 6.650 7.342 -0.692 1 1 1674 . 10 1 1 A 153 153 TYR HA H 153 4.508 5.005 -0.497 1 1 1679 . 10 1 1 A 153 153 TYR C C 153 173.092 172.955 0.137 1 1 1680 . 10 1 1 A 153 153 TYR CA C 153 57.464 57.492 -0.028 1 1 1681 . 10 1 1 A 153 153 TYR CB C 153 41.962 42.264 -0.302 1 1 1684 . 10 1 1 A 153 153 TYR N N 153 121.977 119.428 2.549 1 1 1685 . 10 1 1 A 154 154 ALA H H 154 7.847 8.531 -0.684 1 1 1686 . 10 1 1 A 154 154 ALA HA H 154 5.144 4.876 0.268 1 1 1690 . 10 1 1 A 154 154 ALA C C 154 174.468 174.873 -0.405 1 1 1691 . 10 1 1 A 154 154 ALA CA C 154 51.776 51.062 0.714 1 1 1692 . 10 1 1 A 154 154 ALA CB C 154 21.747 22.212 -0.465 1 1 1693 . 10 1 1 A 154 154 ALA N N 154 130.258 129.951 0.307 1 1 1694 . 10 1 1 A 155 155 VAL H H 155 8.733 9.122 -0.389 1 1 1695 . 10 1 1 A 155 155 VAL HA H 155 4.150 4.835 -0.685 1 1 1700 . 10 1 1 A 155 155 VAL C C 155 172.632 173.334 -0.702 1 1 1701 . 10 1 1 A 155 155 VAL CA C 155 61.451 59.051 2.400 1 1 1702 . 10 1 1 A 155 155 VAL CB C 155 35.883 35.577 0.306 1 1 1704 . 10 1 1 A 155 155 VAL N N 155 119.622 122.011 -2.389 1 1 1705 . 10 1 1 A 156 156 GLY H H 156 8.146 8.448 -0.302 1 1 1706 . 10 1 1 A 156 156 GLY HA2 H 156 5.125 2.745 2.380 1 1 1707 . 10 1 1 A 156 156 GLY HA3 H 156 2.061 4.041 -1.980 1 1 1708 . 10 1 1 A 156 156 GLY C C 156 171.746 171.875 -0.129 1 1 1709 . 10 1 1 A 156 156 GLY CA C 156 43.319 43.753 -0.434 1 1 1710 . 10 1 1 A 156 156 GLY N N 156 113.332 113.021 0.311 1 1 1711 . 10 1 1 A 157 157 GLU H H 157 8.967 8.685 0.282 1 1 1712 . 10 1 1 A 157 157 GLU HA H 157 5.217 5.138 0.079 1 1 1716 . 10 1 1 A 157 157 GLU C C 157 174.476 174.852 -0.376 1 1 1717 . 10 1 1 A 157 157 GLU CA C 157 55.390 55.274 0.116 1 1 1718 . 10 1 1 A 157 157 GLU CB C 157 34.010 33.126 0.884 1 1 1720 . 10 1 1 A 157 157 GLU N N 157 120.823 121.255 -0.432 1 1 1721 . 10 1 1 A 158 158 VAL H H 158 9.076 9.490 -0.414 1 1 1722 . 10 1 1 A 158 158 VAL HA H 158 5.206 5.213 -0.007 1 1 1727 . 10 1 1 A 158 158 VAL C C 158 173.900 174.037 -0.137 1 1 1728 . 10 1 1 A 158 158 VAL CA C 158 60.813 61.233 -0.420 1 1 1729 . 10 1 1 A 158 158 VAL CB C 158 33.385 34.442 -1.057 1 1 1731 . 10 1 1 A 158 158 VAL N N 158 124.349 126.091 -1.742 1 1 1732 . 10 1 1 A 159 159 GLU H H 159 9.239 9.688 -0.449 1 1 1733 . 10 1 1 A 159 159 GLU HA H 159 5.647 5.030 0.617 1 1 1738 . 10 1 1 A 159 159 GLU C C 159 174.469 175.044 -0.575 1 1 1739 . 10 1 1 A 159 159 GLU CA C 159 54.473 54.956 -0.483 1 1 1740 . 10 1 1 A 159 159 GLU CB C 159 33.852 32.583 1.269 1 1 1742 . 10 1 1 A 159 159 GLU N N 159 125.772 129.154 -3.382 1 1 1743 . 10 1 1 A 160 160 ALA H H 160 9.250 9.154 0.096 1 1 1744 . 10 1 1 A 160 160 ALA HA H 160 4.966 5.225 -0.259 1 1 1748 . 10 1 1 A 160 160 ALA C C 160 175.114 175.644 -0.530 1 1 1749 . 10 1 1 A 160 160 ALA CA C 160 50.644 50.602 0.042 1 1 1750 . 10 1 1 A 160 160 ALA CB C 160 23.263 22.403 0.860 1 1 1751 . 10 1 1 A 160 160 ALA N N 160 125.092 129.416 -4.324 1 1 1752 . 10 1 1 A 161 161 MET H H 161 8.559 8.894 -0.335 1 1 1753 . 10 1 1 A 161 161 MET HA H 161 5.468 5.880 -0.412 1 1 1761 . 10 1 1 A 161 161 MET C C 161 176.265 175.061 1.204 1 1 1762 . 10 1 1 A 161 161 MET CA C 161 53.818 53.966 -0.148 1 1 1763 . 10 1 1 A 161 161 MET CB C 161 34.380 34.391 -0.011 1 1 1766 . 10 1 1 A 161 161 MET N N 161 118.699 120.614 -1.915 1 1 1767 . 10 1 1 A 162 162 VAL H H 162 9.046 9.207 -0.161 1 1 1768 . 10 1 1 A 162 162 VAL HA H 162 4.841 4.881 -0.040 1 1 1776 . 10 1 1 A 162 162 VAL C C 162 174.794 175.864 -1.070 1 1 1777 . 10 1 1 A 162 162 VAL CA C 162 59.107 60.170 -1.063 1 1 1778 . 10 1 1 A 162 162 VAL CB C 162 34.018 34.440 -0.422 1 1 1781 . 10 1 1 A 162 162 VAL N N 162 116.435 119.108 -2.673 1 1 1782 . 10 1 1 A 163 163 HIS H H 163 8.793 8.776 0.017 1 1 1783 . 10 1 1 A 163 163 HIS HA H 163 4.717 4.569 0.148 1 1 1787 . 10 1 1 A 163 163 HIS C C 163 175.460 174.650 0.810 1 1 1788 . 10 1 1 A 163 163 HIS CA C 163 58.488 57.404 1.084 1 1 1789 . 10 1 1 A 163 163 HIS CB C 163 31.185 30.676 0.509 1 1 1791 . 10 1 1 A 163 163 HIS N N 163 117.838 122.685 -4.847 1 1 1792 . 10 1 1 A 164 164 GLU H H 164 8.013 7.688 0.325 1 1 1793 . 10 1 1 A 164 164 GLU HA H 164 4.814 4.576 0.238 1 1 1797 . 10 1 1 A 164 164 GLU C C 164 176.910 176.490 0.420 1 1 1798 . 10 1 1 A 164 164 GLU CA C 164 54.355 54.688 -0.333 1 1 1799 . 10 1 1 A 164 164 GLU CB C 164 32.886 32.737 0.149 1 1 1801 . 10 1 1 A 164 164 GLU N N 164 115.943 115.517 0.426 1 1 1802 . 10 1 1 A 165 165 LYS H H 165 9.088 8.822 0.266 1 1 1803 . 10 1 1 A 165 165 LYS HA H 165 3.942 3.939 0.003 1 1 1809 . 10 1 1 A 165 165 LYS C C 165 179.657 177.853 1.804 1 1 1810 . 10 1 1 A 165 165 LYS CA C 165 59.888 58.353 1.535 1 1 1811 . 10 1 1 A 165 165 LYS CB C 165 32.024 32.301 -0.277 1 1 1814 . 10 1 1 A 165 165 LYS N N 165 124.120 121.463 2.657 1 1 1815 . 10 1 1 A 166 166 ALA H H 166 8.851 7.870 0.981 1 1 1816 . 10 1 1 A 166 166 ALA HA H 166 4.251 4.054 0.197 1 1 1820 . 10 1 1 A 166 166 ALA C C 166 178.920 178.445 0.475 1 1 1821 . 10 1 1 A 166 166 ALA CA C 166 54.318 54.753 -0.435 1 1 1822 . 10 1 1 A 166 166 ALA CB C 166 18.810 18.617 0.193 1 1 1823 . 10 1 1 A 166 166 ALA N N 166 120.424 122.132 -1.708 1 1 1824 . 10 1 1 A 167 167 GLU H H 167 7.871 8.280 -0.409 1 1 1825 . 10 1 1 A 167 167 GLU HA H 167 4.404 4.437 -0.033 1 1 1829 . 10 1 1 A 167 167 GLU C C 167 177.368 177.643 -0.275 1 1 1830 . 10 1 1 A 167 167 GLU CA C 167 56.701 56.101 0.600 1 1 1831 . 10 1 1 A 167 167 GLU CB C 167 31.208 29.226 1.982 1 1 1833 . 10 1 1 A 167 167 GLU N N 167 114.926 114.556 0.370 1 1 1834 . 10 1 1 A 168 168 VAL H H 168 7.812 7.547 0.265 1 1 1835 . 10 1 1 A 168 168 VAL HA H 168 3.712 3.729 -0.017 1 1 1843 . 10 1 1 A 168 168 VAL CA C 168 68.705 67.799 0.906 1 1 1844 . 10 1 1 A 168 168 VAL CB C 168 29.597 29.652 -0.055 1 1 1847 . 10 1 1 A 168 168 VAL N N 168 120.188 121.537 -1.349 1 1 1848 . 10 1 1 A 169 169 PRO HA H 169 4.252 4.224 0.028 1 1 1851 . 10 1 1 A 169 169 PRO C C 169 179.563 178.698 0.865 1 1 1852 . 10 1 1 A 169 169 PRO CA C 169 67.077 66.894 0.183 1 1 1853 . 10 1 1 A 170 170 ALA H H 170 8.149 8.335 -0.186 1 1 1854 . 10 1 1 A 170 170 ALA HA H 170 4.265 4.069 0.196 1 1 1858 . 10 1 1 A 170 170 ALA C C 170 180.637 180.057 0.580 1 1 1859 . 10 1 1 A 170 170 ALA CA C 170 54.823 55.387 -0.564 1 1 1860 . 10 1 1 A 170 170 ALA CB C 170 18.518 18.206 0.312 1 1 1861 . 10 1 1 A 170 170 ALA N N 170 119.210 119.108 0.102 1 1 1862 . 10 1 1 A 171 171 ALA H H 171 7.767 8.182 -0.415 1 1 1863 . 10 1 1 A 171 171 ALA HA H 171 4.106 4.247 -0.141 1 1 1867 . 10 1 1 A 171 171 ALA C C 171 179.371 180.117 -0.746 1 1 1868 . 10 1 1 A 171 171 ALA CA C 171 55.130 54.992 0.138 1 1 1869 . 10 1 1 A 171 171 ALA CB C 171 18.291 18.063 0.228 1 1 1870 . 10 1 1 A 171 171 ALA N N 171 122.126 120.584 1.542 1 1 1871 . 10 1 1 A 172 172 LEU H H 172 8.950 8.245 0.705 1 1 1872 . 10 1 1 A 172 172 LEU HA H 172 3.987 4.100 -0.113 1 1 1878 . 10 1 1 A 172 172 LEU C C 172 178.355 178.614 -0.259 1 1 1879 . 10 1 1 A 172 172 LEU CA C 172 57.803 57.905 -0.102 1 1 1880 . 10 1 1 A 172 172 LEU CB C 172 41.667 41.550 0.117 1 1 1882 . 10 1 1 A 172 172 LEU N N 172 118.682 120.843 -2.161 1 1 1883 . 10 1 1 A 173 173 GLU H H 173 7.886 8.171 -0.285 1 1 1884 . 10 1 1 A 173 173 GLU HA H 173 4.132 3.941 0.191 1 1 1887 . 10 1 1 A 173 173 GLU C C 173 179.556 179.387 0.169 1 1 1888 . 10 1 1 A 173 173 GLU CA C 173 59.800 59.544 0.256 1 1 1889 . 10 1 1 A 173 173 GLU CB C 173 29.580 29.191 0.389 1 1 1891 . 10 1 1 A 173 173 GLU N N 173 117.561 118.207 -0.646 1 1 1892 . 10 1 1 A 174 174 LYS H H 174 7.532 7.839 -0.307 1 1 1893 . 10 1 1 A 174 174 LYS HA H 174 4.131 3.996 0.135 1 1 1901 . 10 1 1 A 174 174 LYS CA C 174 58.999 59.652 -0.653 1 1 1902 . 10 1 1 A 174 174 LYS CB C 174 32.041 32.605 -0.564 1 1 1906 . 10 1 1 A 174 174 LYS N N 174 119.085 121.123 -2.038 1 1 1907 . 10 1 1 A 175 175 ILE H H 175 8.479 8.243 0.236 1 1 1908 . 10 1 1 A 175 175 ILE HA H 175 3.583 3.544 0.039 1 1 1918 . 10 1 1 A 175 175 ILE C C 175 179.258 178.524 0.734 1 1 1919 . 10 1 1 A 175 175 ILE CA C 175 65.769 65.733 0.036 1 1 1920 . 10 1 1 A 175 175 ILE CB C 175 37.876 37.933 -0.057 1 1 1923 . 10 1 1 A 175 175 ILE N N 175 118.828 118.922 -0.094 1 1 1924 . 10 1 1 A 176 176 ILE H H 176 8.928 8.135 0.793 1 1 1925 . 10 1 1 A 176 176 ILE HA H 176 3.600 3.690 -0.090 1 1 1935 . 10 1 1 A 176 176 ILE C C 176 178.827 178.321 0.506 1 1 1936 . 10 1 1 A 176 176 ILE CA C 176 65.640 64.572 1.068 1 1 1937 . 10 1 1 A 176 176 ILE CB C 176 37.451 36.834 0.617 1 1 1941 . 10 1 1 A 176 176 ILE N N 176 124.527 120.318 4.209 1 1 1942 . 10 1 1 A 177 177 THR H H 177 8.175 8.046 0.129 1 1 1943 . 10 1 1 A 177 177 THR HA H 177 3.885 3.936 -0.051 1 1 1948 . 10 1 1 A 177 177 THR C C 177 176.867 176.397 0.470 1 1 1949 . 10 1 1 A 177 177 THR CA C 177 67.199 66.579 0.620 1 1 1950 . 10 1 1 A 177 177 THR CB C 177 68.377 68.141 0.236 1 1 1952 . 10 1 1 A 177 177 THR N N 177 119.412 118.606 0.806 1 1 1953 . 10 1 1 A 178 178 VAL H H 178 8.352 8.102 0.250 1 1 1954 . 10 1 1 A 178 178 VAL HA H 178 3.572 3.430 0.142 1 1 1962 . 10 1 1 A 178 178 VAL C C 178 177.664 177.911 -0.247 1 1 1963 . 10 1 1 A 178 178 VAL CA C 178 66.909 66.450 0.459 1 1 1964 . 10 1 1 A 178 178 VAL CB C 178 31.714 31.388 0.326 1 1 1967 . 10 1 1 A 178 178 VAL N N 178 121.168 121.979 -0.811 1 1 1968 . 10 1 1 A 179 179 SER H H 179 8.529 8.262 0.267 1 1 1969 . 10 1 1 A 179 179 SER HA H 179 3.099 3.470 -0.371 1 1 1972 . 10 1 1 A 179 179 SER C C 179 175.380 176.180 -0.800 1 1 1973 . 10 1 1 A 179 179 SER CA C 179 62.728 61.896 0.832 1 1 1974 . 10 1 1 A 179 179 SER CB C 179 62.802 62.572 0.230 1 1 1975 . 10 1 1 A 179 179 SER N N 179 115.226 115.630 -0.404 1 1 1976 . 10 1 1 A 180 180 SER H H 180 7.757 7.918 -0.161 1 1 1977 . 10 1 1 A 180 180 SER HA H 180 4.419 4.275 0.144 1 1 1980 . 10 1 1 A 180 180 SER C C 180 175.359 176.462 -1.103 1 1 1981 . 10 1 1 A 180 180 SER CA C 180 61.025 61.447 -0.422 1 1 1982 . 10 1 1 A 180 180 SER CB C 180 63.072 63.064 0.008 1 1 1983 . 10 1 1 A 180 180 SER N N 180 114.718 116.184 -1.466 1 1 1984 . 10 1 1 A 181 181 MET H H 181 7.497 8.012 -0.515 1 1 1985 . 10 1 1 A 181 181 MET HA H 181 4.283 4.286 -0.003 1 1 1993 . 10 1 1 A 181 181 MET C C 181 177.217 176.789 0.428 1 1 1994 . 10 1 1 A 181 181 MET CA C 181 57.539 57.658 -0.119 1 1 1995 . 10 1 1 A 181 181 MET CB C 181 33.493 32.609 0.884 1 1 1998 . 10 1 1 A 181 181 MET N N 181 119.274 118.468 0.806 1 1 1999 . 10 1 1 A 182 182 LEU H H 182 7.163 7.421 -0.258 1 1 2000 . 10 1 1 A 182 182 LEU HA H 182 4.133 4.388 -0.255 1 1 2010 . 10 1 1 A 182 182 LEU C C 182 176.289 176.624 -0.335 1 1 2011 . 10 1 1 A 182 182 LEU CA C 182 54.750 54.829 -0.079 1 1 2012 . 10 1 1 A 182 182 LEU CB C 182 43.235 42.663 0.572 1 1 2016 . 10 1 1 A 182 182 LEU N N 182 115.869 117.886 -2.017 1 1 2017 . 10 1 1 A 183 183 GLY H H 183 7.492 7.244 0.248 1 1 2018 . 10 1 1 A 183 183 GLY HA2 H 183 4.086 4.161 -0.075 1 1 2019 . 10 1 1 A 183 183 GLY HA3 H 183 4.425 4.208 0.217 1 1 2020 . 10 1 1 A 183 183 GLY C C 183 171.830 171.949 -0.119 1 1 2021 . 10 1 1 A 183 183 GLY CA C 183 46.035 45.925 0.110 1 1 2022 . 10 1 1 A 183 183 GLY N N 183 107.761 105.993 1.768 1 1 2023 . 10 1 1 A 184 184 VAL H H 184 8.099 8.562 -0.463 1 1 2024 . 10 1 1 A 184 184 VAL HA H 184 4.772 4.787 -0.015 1 1 2032 . 10 1 1 A 184 184 VAL CA C 184 59.305 58.772 0.533 1 1 2033 . 10 1 1 A 184 184 VAL CB C 184 33.648 35.234 -1.586 1 1 2036 . 10 1 1 A 184 184 VAL N N 184 119.803 121.733 -1.930 1 1 2037 . 10 1 1 A 185 185 PRO HA H 185 4.442 4.710 -0.268 1 1 2042 . 10 1 1 A 185 185 PRO C C 185 175.871 176.618 -0.747 1 1 2043 . 10 1 1 A 185 185 PRO CA C 185 63.886 62.683 1.203 1 1 2044 . 10 1 1 A 185 185 PRO CB C 185 32.260 32.142 0.118 1 1 2047 . 10 1 1 A 186 186 ALA H H 186 8.222 8.768 -0.546 1 1 2048 . 10 1 1 A 186 186 ALA HA H 186 4.569 4.621 -0.052 1 1 2052 . 10 1 1 A 186 186 ALA C C 186 177.481 176.096 1.385 1 1 2053 . 10 1 1 A 186 186 ALA CA C 186 51.823 50.402 1.421 1 1 2054 . 10 1 1 A 186 186 ALA CB C 186 20.233 20.619 -0.386 1 1 2055 . 10 1 1 A 186 186 ALA N N 186 125.663 121.733 3.930 1 1 2056 . 10 1 1 A 187 187 GLN H H 187 8.723 8.790 -0.067 1 1 2057 . 10 1 1 A 187 187 GLN HA H 187 4.420 5.079 -0.659 1 1 2063 . 10 1 1 A 187 187 GLN C C 187 175.566 173.790 1.776 1 1 2064 . 10 1 1 A 187 187 GLN CA C 187 56.051 53.595 2.456 1 1 2065 . 10 1 1 A 187 187 GLN CB C 187 29.812 31.790 -1.978 1 1 2067 . 10 1 1 A 187 187 GLN N N 187 120.742 114.851 5.891 1 1 2069 . 10 1 1 A 188 188 GLU H H 188 8.163 8.670 -0.507 1 1 2070 . 10 1 1 A 188 188 GLU HA H 188 4.405 4.343 0.062 1 1 2074 . 10 1 1 A 188 188 GLU C C 188 176.058 176.023 0.035 1 1 2075 . 10 1 1 A 188 188 GLU CA C 188 56.158 56.292 -0.134 1 1 2076 . 10 1 1 A 188 188 GLU CB C 188 31.095 29.606 1.489 1 1 2078 . 10 1 1 A 188 188 GLU N N 188 119.177 121.997 -2.820 1 1 2079 . 10 1 1 A 189 189 GLU H H 189 8.567 8.897 -0.330 1 1 2080 . 10 1 1 A 189 189 GLU HA H 189 4.252 4.553 -0.301 1 1 2084 . 10 1 1 A 189 189 GLU C C 189 175.703 176.407 -0.704 1 1 2085 . 10 1 1 A 189 189 GLU CA C 189 56.417 57.898 -1.481 1 1 2086 . 10 1 1 A 189 189 GLU CB C 189 29.968 31.627 -1.659 1 1 2088 . 10 1 1 A 189 189 GLU N N 189 120.920 127.815 -6.895 1 1 2089 . 10 1 1 A 190 190 ALA H H 190 8.271 7.935 0.336 1 1 2090 . 10 1 1 A 190 190 ALA HA H 190 4.626 3.961 0.665 1 1 2094 . 10 1 1 A 190 190 ALA CA C 190 50.465 52.676 -2.211 1 1 2095 . 10 1 1 A 190 190 ALA CB C 190 18.451 17.753 0.698 1 1 2096 . 10 1 1 A 190 190 ALA N N 190 128.323 121.523 6.800 1 1 2097 . 10 1 1 A 191 191 PRO HA H 191 4.493 4.231 0.262 1 1 2103 . 10 1 1 A 191 191 PRO C C 191 175.899 176.906 -1.007 1 1 2104 . 10 1 1 A 191 191 PRO CA C 191 62.044 62.637 -0.593 1 1 2105 . 10 1 1 A 191 191 PRO CB C 191 32.184 31.278 0.906 1 1 2108 . 10 1 1 A 192 192 ALA H H 192 8.610 8.253 0.357 1 1 2109 . 10 1 1 A 192 192 ALA HA H 192 4.280 4.358 -0.078 1 1 2113 . 10 1 1 A 192 192 ALA C C 192 178.282 177.887 0.395 1 1 2114 . 10 1 1 A 192 192 ALA CA C 192 51.698 51.876 -0.178 1 1 2115 . 10 1 1 A 192 192 ALA CB C 192 19.220 20.123 -0.903 1 1 2116 . 10 1 1 A 192 192 ALA N N 192 123.420 124.042 -0.622 1 1 2117 . 10 1 1 A 193 193 LYS H H 193 8.531 8.915 -0.384 1 1 2118 . 10 1 1 A 193 193 LYS HA H 193 3.294 3.514 -0.220 1 1 2126 . 10 1 1 A 193 193 LYS C C 193 177.640 178.009 -0.369 1 1 2127 . 10 1 1 A 193 193 LYS CA C 193 60.644 59.110 1.534 1 1 2128 . 10 1 1 A 193 193 LYS CB C 193 32.607 31.674 0.933 1 1 2132 . 10 1 1 A 193 193 LYS N N 193 122.851 119.487 3.364 1 1 2133 . 10 1 1 A 194 194 LEU H H 194 8.570 8.066 0.504 1 1 2134 . 10 1 1 A 194 194 LEU HA H 194 3.845 4.068 -0.223 1 1 2144 . 10 1 1 A 194 194 LEU C C 194 177.965 179.241 -1.276 1 1 2145 . 10 1 1 A 194 194 LEU CA C 194 57.611 57.396 0.215 1 1 2146 . 10 1 1 A 194 194 LEU CB C 194 41.776 40.773 1.003 1 1 2150 . 10 1 1 A 194 194 LEU N N 194 115.801 119.467 -3.666 1 1 2151 . 10 1 1 A 195 195 MET H H 195 6.782 8.021 -1.239 1 1 2152 . 10 1 1 A 195 195 MET HA H 195 4.487 4.099 0.388 1 1 2160 . 10 1 1 A 195 195 MET C C 195 178.280 178.048 0.232 1 1 2161 . 10 1 1 A 195 195 MET CA C 195 56.858 58.477 -1.619 1 1 2162 . 10 1 1 A 195 195 MET CB C 195 31.557 31.850 -0.293 1 1 2165 . 10 1 1 A 195 195 MET N N 195 113.898 119.012 -5.114 1 1 2166 . 10 1 1 A 196 196 VAL H H 196 7.713 7.615 0.098 1 1 2167 . 10 1 1 A 196 196 VAL HA H 196 3.501 3.310 0.191 1 1 2175 . 10 1 1 A 196 196 VAL C C 196 177.624 177.752 -0.128 1 1 2176 . 10 1 1 A 196 196 VAL CA C 196 66.318 65.899 0.419 1 1 2177 . 10 1 1 A 196 196 VAL CB C 196 31.380 31.333 0.047 1 1 2180 . 10 1 1 A 196 196 VAL N N 196 120.413 119.675 0.738 1 1 2181 . 10 1 1 A 197 197 TYR H H 197 7.972 7.847 0.125 1 1 2182 . 10 1 1 A 197 197 TYR HA H 197 3.145 3.305 -0.160 1 1 2187 . 10 1 1 A 197 197 TYR C C 197 177.726 176.832 0.894 1 1 2188 . 10 1 1 A 197 197 TYR CA C 197 62.253 61.106 1.147 1 1 2189 . 10 1 1 A 197 197 TYR CB C 197 37.314 38.188 -0.874 1 1 2192 . 10 1 1 A 197 197 TYR N N 197 119.543 120.597 -1.054 1 1 2193 . 10 1 1 A 198 198 LEU H H 198 8.630 8.575 0.055 1 1 2194 . 10 1 1 A 198 198 LEU HA H 198 3.923 3.839 0.084 1 1 2203 . 10 1 1 A 198 198 LEU C C 198 178.074 179.015 -0.941 1 1 2204 . 10 1 1 A 198 198 LEU CA C 198 58.294 57.637 0.657 1 1 2205 . 10 1 1 A 198 198 LEU CB C 198 42.177 41.301 0.876 1 1 2209 . 10 1 1 A 198 198 LEU N N 198 118.430 118.914 -0.484 1 1 2210 . 10 1 1 A 199 199 GLN H H 199 8.082 8.591 -0.509 1 1 2211 . 10 1 1 A 199 199 GLN HA H 199 3.054 3.746 -0.692 1 1 2216 . 10 1 1 A 199 199 GLN C C 199 176.875 178.040 -1.165 1 1 2217 . 10 1 1 A 199 199 GLN CA C 199 59.739 59.158 0.581 1 1 2218 . 10 1 1 A 199 199 GLN CB C 199 28.055 27.930 0.125 1 1 2220 . 10 1 1 A 199 199 GLN N N 199 117.926 118.696 -0.770 1 1 2222 . 10 1 1 A 200 200 ARG H H 200 7.349 7.801 -0.452 1 1 2223 . 10 1 1 A 200 200 ARG HA H 200 3.798 3.944 -0.146 1 1 2231 . 10 1 1 A 200 200 ARG C C 200 178.037 178.366 -0.329 1 1 2232 . 10 1 1 A 200 200 ARG CA C 200 58.260 58.839 -0.579 1 1 2233 . 10 1 1 A 200 200 ARG CB C 200 30.706 30.113 0.593 1 1 2236 . 10 1 1 A 200 200 ARG N N 200 113.772 119.882 -6.110 1 1 2238 . 10 1 1 A 201 201 PHE H H 201 8.329 8.046 0.283 1 1 2239 . 10 1 1 A 201 201 PHE HA H 201 4.630 4.440 0.190 1 1 2244 . 10 1 1 A 201 201 PHE C C 201 176.606 175.826 0.780 1 1 2245 . 10 1 1 A 201 201 PHE CA C 201 59.014 59.199 -0.185 1 1 2246 . 10 1 1 A 201 201 PHE CB C 201 40.357 40.406 -0.049 1 1 2249 . 10 1 1 A 201 201 PHE N N 201 114.182 116.705 -2.523 1 1 2250 . 10 1 1 A 202 202 ARG H H 202 8.719 8.190 0.529 1 1 2251 . 10 1 1 A 202 202 ARG HA H 202 5.071 4.815 0.256 1 1 2261 . 10 1 1 A 202 202 ARG CA C 202 53.956 53.821 0.135 1 1 2262 . 10 1 1 A 202 202 ARG CB C 202 31.979 30.363 1.616 1 1 2264 . 10 1 1 A 202 202 ARG N N 202 120.115 118.323 1.792 1 1 2266 . 10 1 1 A 203 203 PRO HA H 203 4.348 4.402 -0.054 1 1 2271 . 10 1 1 A 203 203 PRO C C 203 179.736 177.769 1.967 1 1 2272 . 10 1 1 A 203 203 PRO CA C 203 65.674 65.376 0.298 1 1 2273 . 10 1 1 A 203 203 PRO CB C 203 31.717 32.078 -0.361 1 1 2275 . 10 1 1 A 204 204 LEU H H 204 8.875 7.452 1.423 1 1 2276 . 10 1 1 A 204 204 LEU HA H 204 4.291 3.875 0.416 1 1 2286 . 10 1 1 A 204 204 LEU C C 204 180.353 177.861 2.492 1 1 2287 . 10 1 1 A 204 204 LEU CA C 204 58.012 56.910 1.102 1 1 2288 . 10 1 1 A 204 204 LEU CB C 204 40.893 42.136 -1.243 1 1 2292 . 10 1 1 A 204 204 LEU N N 204 118.940 116.364 2.576 1 1 2293 . 10 1 1 A 205 205 ASP H H 205 7.541 8.356 -0.815 1 1 2294 . 10 1 1 A 205 205 ASP HA H 205 4.622 4.400 0.222 1 1 2297 . 10 1 1 A 205 205 ASP C C 205 177.602 178.132 -0.530 1 1 2298 . 10 1 1 A 205 205 ASP CA C 205 57.437 57.317 0.120 1 1 2299 . 10 1 1 A 205 205 ASP CB C 205 41.143 40.839 0.304 1 1 2300 . 10 1 1 A 205 205 ASP N N 205 120.838 119.297 1.541 1 1 2301 . 10 1 1 A 206 206 TYR H H 206 8.237 8.108 0.129 1 1 2302 . 10 1 1 A 206 206 TYR HA H 206 4.018 4.246 -0.228 1 1 2307 . 10 1 1 A 206 206 TYR C C 206 176.433 178.500 -2.067 1 1 2308 . 10 1 1 A 206 206 TYR CA C 206 62.148 60.941 1.207 1 1 2309 . 10 1 1 A 206 206 TYR CB C 206 38.305 37.218 1.087 1 1 2312 . 10 1 1 A 206 206 TYR N N 206 119.475 118.544 0.931 1 1 2313 . 10 1 1 A 207 207 GLN H H 207 8.124 7.755 0.369 1 1 2314 . 10 1 1 A 207 207 GLN HA H 207 3.823 3.708 0.115 1 1 2320 . 10 1 1 A 207 207 GLN C C 207 178.019 178.858 -0.839 1 1 2321 . 10 1 1 A 207 207 GLN CA C 207 58.841 59.569 -0.728 1 1 2322 . 10 1 1 A 207 207 GLN CB C 207 28.208 28.827 -0.619 1 1 2324 . 10 1 1 A 207 207 GLN N N 207 115.863 121.526 -5.663 1 1 2326 . 10 1 1 A 208 208 ARG H H 208 7.522 7.701 -0.179 1 1 2327 . 10 1 1 A 208 208 ARG HA H 208 4.127 4.267 -0.140 1 1 2334 . 10 1 1 A 208 208 ARG C C 208 179.278 179.157 0.121 1 1 2335 . 10 1 1 A 208 208 ARG CA C 208 59.419 59.138 0.281 1 1 2336 . 10 1 1 A 208 208 ARG CB C 208 30.182 29.903 0.279 1 1 2338 . 10 1 1 A 208 208 ARG N N 208 118.471 120.075 -1.604 1 1 2340 . 10 1 1 A 209 209 LEU H H 209 7.869 7.796 0.073 1 1 2341 . 10 1 1 A 209 209 LEU HA H 209 4.091 4.477 -0.386 1 1 2351 . 10 1 1 A 209 209 LEU C C 209 179.715 178.210 1.505 1 1 2352 . 10 1 1 A 209 209 LEU CA C 209 57.891 58.174 -0.283 1 1 2353 . 10 1 1 A 209 209 LEU CB C 209 41.338 41.584 -0.246 1 1 2356 . 10 1 1 A 209 209 LEU N N 209 119.659 121.543 -1.884 1 1 2357 . 10 1 1 A 210 210 LEU H H 210 8.034 8.808 -0.774 1 1 2358 . 10 1 1 A 210 210 LEU HA H 210 3.977 3.993 -0.016 1 1 2367 . 10 1 1 A 210 210 LEU C C 210 180.363 178.599 1.764 1 1 2368 . 10 1 1 A 210 210 LEU CA C 210 57.459 58.524 -1.065 1 1 2369 . 10 1 1 A 210 210 LEU CB C 210 41.699 41.868 -0.169 1 1 2373 . 10 1 1 A 210 210 LEU N N 210 120.967 119.784 1.183 1 1 2374 . 10 1 1 A 211 211 GLU H H 211 8.174 8.808 -0.634 1 1 2375 . 10 1 1 A 211 211 GLU HA H 211 4.075 4.123 -0.048 1 1 2379 . 10 1 1 A 211 211 GLU C C 211 178.499 178.981 -0.482 1 1 2380 . 10 1 1 A 211 211 GLU CA C 211 58.575 59.465 -0.890 1 1 2381 . 10 1 1 A 211 211 GLU CB C 211 29.583 29.337 0.246 1 1 2383 . 10 1 1 A 211 211 GLU N N 211 119.217 118.019 1.198 1 1 2384 . 10 1 1 A 212 212 ALA H H 212 7.723 8.078 -0.355 1 1 2385 . 10 1 1 A 212 212 ALA HA H 212 4.291 4.282 0.009 1 1 2389 . 10 1 1 A 212 212 ALA C C 212 178.770 179.677 -0.907 1 1 2390 . 10 1 1 A 212 212 ALA CA C 212 53.966 54.748 -0.782 1 1 2391 . 10 1 1 A 212 212 ALA CB C 212 19.117 18.420 0.697 1 1 2392 . 10 1 1 A 212 212 ALA N N 212 121.798 122.897 -1.099 1 1 2393 . 10 1 1 A 213 213 ALA H H 213 7.743 8.016 -0.273 1 1 2394 . 10 1 1 A 213 213 ALA HA H 213 4.406 4.244 0.162 1 1 2398 . 10 1 1 A 213 213 ALA C C 213 178.413 178.213 0.200 1 1 2399 . 10 1 1 A 213 213 ALA CA C 213 53.129 53.019 0.110 1 1 2400 . 10 1 1 A 213 213 ALA CB C 213 18.926 18.717 0.209 1 1 2401 . 10 1 1 A 213 213 ALA N N 213 120.435 120.482 -0.047 1 1 2402 . 10 1 1 A 214 214 SER H H 214 7.944 7.692 0.252 1 1 2403 . 10 1 1 A 214 214 SER HA H 214 4.559 4.320 0.239 1 1 2406 . 10 1 1 A 214 214 SER C C 214 174.958 174.727 0.231 1 1 2407 . 10 1 1 A 214 214 SER CA C 214 58.640 60.491 -1.851 1 1 2408 . 10 1 1 A 214 214 SER CB C 214 63.928 63.207 0.721 1 1 2409 . 10 1 1 A 214 214 SER N N 214 113.729 113.403 0.326 1 1 2410 . 10 1 1 A 215 215 SER H H 215 8.255 7.729 0.526 1 1 2411 . 10 1 1 A 215 215 SER HA H 215 4.547 4.544 0.003 1 1 2413 . 10 1 1 A 215 215 SER C C 215 175.289 174.300 0.989 1 1 2414 . 10 1 1 A 215 215 SER CA C 215 58.833 57.867 0.966 1 1 2415 . 10 1 1 A 215 215 SER CB C 215 63.847 63.150 0.697 1 1 2416 . 10 1 1 A 215 215 SER N N 215 117.674 116.508 1.166 1 1 2417 . 10 1 1 A 216 216 GLY H H 216 8.431 8.200 0.231 1 1 2418 . 10 1 1 A 216 216 GLY HA2 H 216 4.054 4.044 0.010 1 1 2419 . 10 1 1 A 216 216 GLY C C 216 174.189 171.370 2.819 1 1 2420 . 10 1 1 A 216 216 GLY CA C 216 45.412 44.095 1.317 1 1 2421 . 10 1 1 A 216 216 GLY N N 216 110.800 115.936 -5.136 1 1 2422 . 10 1 1 A 217 217 GLU H H 217 8.267 8.429 -0.162 1 1 2423 . 10 1 1 A 217 217 GLU HA H 217 4.345 4.884 -0.539 1 1 2427 . 10 1 1 A 217 217 GLU C C 217 176.428 174.506 1.922 1 1 2428 . 10 1 1 A 217 217 GLU CA C 217 56.470 55.959 0.511 1 1 2429 . 10 1 1 A 217 217 GLU CB C 217 30.526 33.560 -3.034 1 1 2430 . 10 1 1 A 217 217 GLU N N 217 120.726 119.713 1.013 1 1 2431 . 10 1 1 A 218 218 ALA H H 218 8.476 8.614 -0.138 1 1 2432 . 10 1 1 A 218 218 ALA HA H 218 4.467 4.694 -0.227 1 1 2436 . 10 1 1 A 218 218 ALA C C 218 178.015 176.626 1.389 1 1 2437 . 10 1 1 A 218 218 ALA CA C 218 52.547 50.943 1.604 1 1 2438 . 10 1 1 A 218 218 ALA CB C 218 19.242 19.627 -0.385 1 1 2439 . 10 1 1 A 218 218 ALA N N 218 125.534 126.000 -0.466 1 1 2440 . 10 1 1 A 219 219 THR H H 219 8.232 8.628 -0.396 1 1 2441 . 10 1 1 A 219 219 THR HA H 219 4.411 4.406 0.005 1 1 2446 . 10 1 1 A 219 219 THR C C 219 175.327 175.736 -0.409 1 1 2447 . 10 1 1 A 219 219 THR CA C 219 61.889 62.002 -0.113 1 1 2448 . 10 1 1 A 219 219 THR CB C 219 69.939 69.487 0.452 1 1 2449 . 10 1 1 A 219 219 THR N N 219 113.242 120.470 -7.228 1 1 2450 . 10 1 1 A 220 220 GLY H H 220 8.418 9.316 -0.898 1 1 2451 . 10 1 1 A 220 220 GLY C C 220 174.037 174.922 -0.885 1 1 2452 . 10 1 1 A 220 220 GLY CA C 220 45.408 47.321 -1.913 1 1 2453 . 10 1 1 A 220 220 GLY N N 220 111.031 112.783 -1.752 1 1 2454 . 10 1 1 A 221 221 ASP H H 221 8.345 8.257 0.088 1 1 2455 . 10 1 1 A 221 221 ASP HA H 221 4.700 4.461 0.239 1 1 2458 . 10 1 1 A 221 221 ASP C C 221 176.535 176.313 0.222 1 1 2459 . 10 1 1 A 221 221 ASP CA C 221 54.402 55.288 -0.886 1 1 2460 . 10 1 1 A 221 221 ASP CB C 221 41.431 40.629 0.802 1 1 2461 . 10 1 1 A 221 221 ASP N N 221 120.795 120.223 0.572 1 1 2462 . 10 1 1 A 222 222 SER H H 222 8.353 7.874 0.479 1 1 2463 . 10 1 1 A 222 222 SER HA H 222 4.493 4.399 0.094 1 1 2465 . 10 1 1 A 222 222 SER C C 222 174.224 174.343 -0.119 1 1 2466 . 10 1 1 A 222 222 SER CA C 222 58.427 60.684 -2.257 1 1 2467 . 10 1 1 A 222 222 SER CB C 222 63.860 63.268 0.592 1 1 2468 . 10 1 1 A 222 222 SER N N 222 116.220 113.749 2.471 1 1 2469 . 10 1 1 A 223 223 ALA H H 223 8.381 7.433 0.948 1 1 2470 . 10 1 1 A 223 223 ALA HA H 223 4.461 4.273 0.188 1 1 2474 . 10 1 1 A 223 223 ALA C C 223 176.926 177.695 -0.769 1 1 2475 . 10 1 1 A 223 223 ALA CA C 223 52.583 51.481 1.102 1 1 2476 . 10 1 1 A 223 223 ALA CB C 223 19.438 19.698 -0.260 1 1 2477 . 10 1 1 A 223 223 ALA N N 223 126.592 124.115 2.477 1 1 1 . 11 1 1 A 2 2 ALA HA H 2 4.274 5.228 -0.954 1 1 5 . 11 1 1 A 2 2 ALA C C 2 177.828 175.274 2.554 1 1 6 . 11 1 1 A 2 2 ALA CA C 2 52.984 51.020 1.964 1 1 7 . 11 1 1 A 2 2 ALA CB C 2 19.138 23.714 -4.576 1 1 8 . 11 1 1 A 3 3 GLN H H 3 8.463 8.654 -0.191 1 1 9 . 11 1 1 A 3 3 GLN HA H 3 4.676 5.016 -0.340 1 1 12 . 11 1 1 A 3 3 GLN C C 3 176.002 175.939 0.063 1 1 13 . 11 1 1 A 3 3 GLN CA C 3 56.258 55.128 1.130 1 1 14 . 11 1 1 A 3 3 GLN CB C 3 30.346 31.814 -1.468 1 1 15 . 11 1 1 A 3 3 GLN N N 3 117.490 121.570 -4.080 1 1 16 . 11 1 1 A 4 4 GLY H H 4 8.099 8.937 -0.838 1 1 17 . 11 1 1 A 4 4 GLY HA2 H 4 3.910 3.882 0.028 1 1 18 . 11 1 1 A 4 4 GLY C C 4 173.332 174.335 -1.003 1 1 19 . 11 1 1 A 4 4 GLY CA C 4 45.333 47.257 -1.924 1 1 20 . 11 1 1 A 4 4 GLY N N 4 109.423 115.422 -5.999 1 1 21 . 11 1 1 A 5 5 LEU H H 5 7.863 8.008 -0.145 1 1 22 . 11 1 1 A 5 5 LEU HA H 5 4.561 4.758 -0.197 1 1 32 . 11 1 1 A 5 5 LEU C C 5 176.448 175.598 0.850 1 1 33 . 11 1 1 A 5 5 LEU CA C 5 54.713 54.036 0.677 1 1 34 . 11 1 1 A 5 5 LEU CB C 5 43.551 41.494 2.057 1 1 38 . 11 1 1 A 5 5 LEU N N 5 120.391 123.273 -2.882 1 1 39 . 11 1 1 A 6 6 ILE H H 6 8.764 9.332 -0.568 1 1 40 . 11 1 1 A 6 6 ILE HA H 6 4.087 4.095 -0.008 1 1 49 . 11 1 1 A 6 6 ILE C C 6 174.679 175.549 -0.870 1 1 50 . 11 1 1 A 6 6 ILE CA C 6 61.279 61.610 -0.331 1 1 51 . 11 1 1 A 6 6 ILE CB C 6 39.651 37.989 1.662 1 1 54 . 11 1 1 A 6 6 ILE N N 6 123.050 126.027 -2.977 1 1 55 . 11 1 1 A 7 7 GLU H H 7 8.587 8.660 -0.073 1 1 56 . 11 1 1 A 7 7 GLU HA H 7 4.917 4.698 0.219 1 1 61 . 11 1 1 A 7 7 GLU C C 7 175.978 176.117 -0.139 1 1 62 . 11 1 1 A 7 7 GLU CA C 7 56.127 56.196 -0.069 1 1 63 . 11 1 1 A 7 7 GLU CB C 7 31.115 30.139 0.976 1 1 65 . 11 1 1 A 7 7 GLU N N 7 127.415 127.958 -0.543 1 1 66 . 11 1 1 A 8 8 VAL H H 8 8.986 9.285 -0.299 1 1 67 . 11 1 1 A 8 8 VAL HA H 8 4.375 4.998 -0.623 1 1 72 . 11 1 1 A 8 8 VAL C C 8 173.704 174.962 -1.258 1 1 73 . 11 1 1 A 8 8 VAL CA C 8 61.347 60.577 0.770 1 1 74 . 11 1 1 A 8 8 VAL CB C 8 33.611 33.967 -0.356 1 1 76 . 11 1 1 A 8 8 VAL N N 8 126.071 118.360 7.711 1 1 77 . 11 1 1 A 9 9 GLU H H 9 8.521 9.142 -0.621 1 1 78 . 11 1 1 A 9 9 GLU HA H 9 5.837 5.493 0.344 1 1 81 . 11 1 1 A 9 9 GLU C C 9 175.939 174.146 1.793 1 1 82 . 11 1 1 A 9 9 GLU CA C 9 54.516 54.225 0.291 1 1 83 . 11 1 1 A 9 9 GLU CB C 9 33.009 34.419 -1.410 1 1 84 . 11 1 1 A 9 9 GLU N N 9 122.857 124.242 -1.385 1 1 85 . 11 1 1 A 10 10 ARG H H 10 8.690 8.617 0.073 1 1 86 . 11 1 1 A 10 10 ARG HA H 10 4.709 4.966 -0.257 1 1 94 . 11 1 1 A 10 10 ARG C C 10 174.826 173.777 1.049 1 1 95 . 11 1 1 A 10 10 ARG CA C 10 54.491 54.648 -0.157 1 1 96 . 11 1 1 A 10 10 ARG CB C 10 35.777 34.695 1.082 1 1 98 . 11 1 1 A 10 10 ARG N N 10 120.430 120.479 -0.049 1 1 100 . 11 1 1 A 11 11 LYS H H 11 8.874 8.444 0.430 1 1 101 . 11 1 1 A 11 11 LYS HA H 11 5.530 5.198 0.332 1 1 107 . 11 1 1 A 11 11 LYS C C 11 176.919 175.033 1.886 1 1 108 . 11 1 1 A 11 11 LYS CA C 11 55.084 55.019 0.065 1 1 109 . 11 1 1 A 11 11 LYS CB C 11 35.435 35.184 0.251 1 1 113 . 11 1 1 A 11 11 LYS N N 11 121.087 124.497 -3.410 1 1 114 . 11 1 1 A 12 12 PHE H H 12 8.877 8.737 0.140 1 1 115 . 11 1 1 A 12 12 PHE HA H 12 5.130 5.086 0.044 1 1 120 . 11 1 1 A 12 12 PHE C C 12 171.676 172.024 -0.348 1 1 121 . 11 1 1 A 12 12 PHE CA C 12 55.869 56.496 -0.627 1 1 122 . 11 1 1 A 12 12 PHE CB C 12 42.108 41.783 0.325 1 1 125 . 11 1 1 A 12 12 PHE N N 12 117.486 119.510 -2.024 1 1 126 . 11 1 1 A 13 13 ALA H H 13 9.134 9.335 -0.201 1 1 127 . 11 1 1 A 13 13 ALA HA H 13 5.003 4.635 0.368 1 1 131 . 11 1 1 A 13 13 ALA CA C 13 48.340 48.834 -0.494 1 1 132 . 11 1 1 A 13 13 ALA CB C 13 19.191 20.280 -1.089 1 1 133 . 11 1 1 A 13 13 ALA N N 13 125.915 123.559 2.356 1 1 134 . 11 1 1 A 14 14 PRO HA H 14 4.620 5.076 -0.456 1 1 140 . 11 1 1 A 14 14 PRO C C 14 176.502 177.364 -0.862 1 1 141 . 11 1 1 A 14 14 PRO CA C 14 62.672 62.394 0.278 1 1 142 . 11 1 1 A 14 14 PRO CB C 14 33.119 32.253 0.866 1 1 145 . 11 1 1 A 15 15 GLY H H 15 8.721 8.634 0.087 1 1 146 . 11 1 1 A 15 15 GLY HA2 H 15 3.999 4.074 -0.075 1 1 147 . 11 1 1 A 15 15 GLY HA3 H 15 4.632 4.080 0.552 1 1 148 . 11 1 1 A 15 15 GLY CA C 15 44.411 44.033 0.378 1 1 149 . 11 1 1 A 15 15 GLY N N 15 109.863 108.109 1.754 1 1 150 . 11 1 1 A 16 16 PRO HA H 16 4.447 4.374 0.073 1 1 155 . 11 1 1 A 16 16 PRO C C 16 177.053 177.229 -0.176 1 1 156 . 11 1 1 A 16 16 PRO CA C 16 64.395 64.865 -0.470 1 1 157 . 11 1 1 A 16 16 PRO CB C 16 31.993 31.901 0.092 1 1 159 . 11 1 1 A 17 17 ASP H H 17 8.550 8.645 -0.095 1 1 160 . 11 1 1 A 17 17 ASP HA H 17 4.950 4.651 0.299 1 1 163 . 11 1 1 A 17 17 ASP C C 17 176.800 177.116 -0.316 1 1 164 . 11 1 1 A 17 17 ASP CA C 17 53.271 53.366 -0.095 1 1 165 . 11 1 1 A 17 17 ASP CB C 17 40.392 39.980 0.412 1 1 166 . 11 1 1 A 17 17 ASP N N 17 116.060 116.003 0.057 1 1 167 . 11 1 1 A 18 18 THR H H 18 7.664 7.593 0.071 1 1 168 . 11 1 1 A 18 18 THR HA H 18 4.120 3.690 0.430 1 1 174 . 11 1 1 A 18 18 THR C C 18 175.407 176.341 -0.934 1 1 175 . 11 1 1 A 18 18 THR CA C 18 68.718 67.236 1.482 1 1 176 . 11 1 1 A 18 18 THR CB C 18 69.179 68.612 0.567 1 1 178 . 11 1 1 A 18 18 THR N N 18 117.158 116.457 0.701 1 1 179 . 11 1 1 A 19 19 GLU H H 19 8.817 8.544 0.273 1 1 180 . 11 1 1 A 19 19 GLU HA H 19 3.510 3.279 0.231 1 1 184 . 11 1 1 A 19 19 GLU C C 19 178.345 179.252 -0.907 1 1 185 . 11 1 1 A 19 19 GLU CA C 19 61.237 59.798 1.439 1 1 186 . 11 1 1 A 19 19 GLU CB C 19 28.746 29.350 -0.604 1 1 188 . 11 1 1 A 19 19 GLU N N 19 118.802 119.024 -0.222 1 1 189 . 11 1 1 A 20 20 GLU H H 20 7.976 8.047 -0.071 1 1 190 . 11 1 1 A 20 20 GLU HA H 20 4.036 4.129 -0.093 1 1 194 . 11 1 1 A 20 20 GLU C C 20 179.451 179.958 -0.507 1 1 195 . 11 1 1 A 20 20 GLU CA C 20 59.909 58.710 1.199 1 1 196 . 11 1 1 A 20 20 GLU CB C 20 28.992 29.276 -0.284 1 1 198 . 11 1 1 A 20 20 GLU N N 20 121.130 119.381 1.749 1 1 199 . 11 1 1 A 21 21 ARG H H 21 8.199 8.370 -0.171 1 1 200 . 11 1 1 A 21 21 ARG HA H 21 4.061 4.114 -0.053 1 1 207 . 11 1 1 A 21 21 ARG C C 21 179.087 178.645 0.442 1 1 208 . 11 1 1 A 21 21 ARG CA C 21 58.477 58.353 0.124 1 1 209 . 11 1 1 A 21 21 ARG CB C 21 30.101 29.586 0.515 1 1 211 . 11 1 1 A 21 21 ARG N N 21 119.897 120.871 -0.974 1 1 213 . 11 1 1 A 22 22 LEU H H 22 8.154 8.225 -0.071 1 1 214 . 11 1 1 A 22 22 LEU HA H 22 3.560 3.745 -0.185 1 1 224 . 11 1 1 A 22 22 LEU C C 22 178.461 179.287 -0.826 1 1 225 . 11 1 1 A 22 22 LEU CA C 22 58.432 57.812 0.620 1 1 226 . 11 1 1 A 22 22 LEU CB C 22 40.229 40.677 -0.448 1 1 230 . 11 1 1 A 22 22 LEU N N 22 120.012 119.888 0.124 1 1 231 . 11 1 1 A 23 23 GLN H H 23 7.621 7.856 -0.235 1 1 232 . 11 1 1 A 23 23 GLN HA H 23 4.232 4.062 0.170 1 1 238 . 11 1 1 A 23 23 GLN C C 23 180.543 178.534 2.009 1 1 239 . 11 1 1 A 23 23 GLN CA C 23 59.434 59.390 0.044 1 1 240 . 11 1 1 A 23 23 GLN CB C 23 28.749 28.442 0.307 1 1 242 . 11 1 1 A 23 23 GLN N N 23 117.823 117.962 -0.139 1 1 244 . 11 1 1 A 24 24 GLU H H 24 8.165 7.726 0.439 1 1 245 . 11 1 1 A 24 24 GLU HA H 24 4.072 4.146 -0.074 1 1 249 . 11 1 1 A 24 24 GLU C C 24 178.612 179.208 -0.596 1 1 250 . 11 1 1 A 24 24 GLU CA C 24 59.236 58.929 0.307 1 1 251 . 11 1 1 A 24 24 GLU CB C 24 29.606 29.460 0.146 1 1 253 . 11 1 1 A 24 24 GLU N N 24 122.589 120.151 2.438 1 1 254 . 11 1 1 A 25 25 LEU H H 25 7.911 7.863 0.048 1 1 255 . 11 1 1 A 25 25 LEU HA H 25 4.214 4.076 0.138 1 1 265 . 11 1 1 A 25 25 LEU C C 25 176.745 177.385 -0.640 1 1 266 . 11 1 1 A 25 25 LEU CA C 25 55.659 55.915 -0.256 1 1 267 . 11 1 1 A 25 25 LEU CB C 25 43.109 42.789 0.320 1 1 271 . 11 1 1 A 25 25 LEU N N 25 117.882 116.962 0.920 1 1 272 . 11 1 1 A 26 26 GLY H H 26 7.776 8.006 -0.230 1 1 273 . 11 1 1 A 26 26 GLY HA2 H 26 4.337 4.028 0.309 1 1 274 . 11 1 1 A 26 26 GLY HA3 H 26 3.856 4.045 -0.189 1 1 275 . 11 1 1 A 26 26 GLY C C 26 175.456 174.484 0.972 1 1 276 . 11 1 1 A 26 26 GLY CA C 26 44.875 45.363 -0.488 1 1 277 . 11 1 1 A 26 26 GLY N N 26 104.938 105.775 -0.837 1 1 278 . 11 1 1 A 27 27 ALA H H 27 8.104 8.491 -0.387 1 1 279 . 11 1 1 A 27 27 ALA HA H 27 4.949 4.586 0.363 1 1 283 . 11 1 1 A 27 27 ALA C C 27 176.448 176.953 -0.505 1 1 284 . 11 1 1 A 27 27 ALA CA C 27 52.183 52.013 0.170 1 1 285 . 11 1 1 A 27 27 ALA CB C 27 21.814 19.965 1.849 1 1 286 . 11 1 1 A 27 27 ALA N N 27 123.263 124.190 -0.927 1 1 287 . 11 1 1 A 28 28 THR H H 28 9.369 9.357 0.012 1 1 288 . 11 1 1 A 28 28 THR HA H 28 4.779 4.779 0.000 1 1 293 . 11 1 1 A 28 28 THR C C 28 173.725 173.765 -0.040 1 1 294 . 11 1 1 A 28 28 THR CA C 28 60.046 60.873 -0.827 1 1 295 . 11 1 1 A 28 28 THR CB C 28 70.592 69.849 0.743 1 1 297 . 11 1 1 A 28 28 THR N N 28 112.201 118.852 -6.651 1 1 298 . 11 1 1 A 29 29 LEU H H 29 8.518 8.528 -0.010 1 1 299 . 11 1 1 A 29 29 LEU HA H 29 3.332 3.792 -0.460 1 1 309 . 11 1 1 A 29 29 LEU C C 29 176.202 176.547 -0.345 1 1 310 . 11 1 1 A 29 29 LEU CA C 29 55.031 54.650 0.381 1 1 311 . 11 1 1 A 29 29 LEU CB C 29 40.624 41.434 -0.810 1 1 315 . 11 1 1 A 29 29 LEU N N 29 128.151 129.627 -1.476 1 1 316 . 11 1 1 A 30 30 GLU H H 30 9.269 9.039 0.230 1 1 317 . 11 1 1 A 30 30 GLU HA H 30 4.287 4.527 -0.240 1 1 321 . 11 1 1 A 30 30 GLU C C 30 176.740 176.367 0.373 1 1 322 . 11 1 1 A 30 30 GLU CA C 30 57.283 56.912 0.371 1 1 323 . 11 1 1 A 30 30 GLU CB C 30 31.045 30.981 0.064 1 1 325 . 11 1 1 A 30 30 GLU N N 30 130.123 122.579 7.544 1 1 326 . 11 1 1 A 31 31 HIS H H 31 7.341 7.105 0.236 1 1 327 . 11 1 1 A 31 31 HIS HA H 31 4.701 4.742 -0.041 1 1 331 . 11 1 1 A 31 31 HIS C C 31 172.581 172.421 0.160 1 1 332 . 11 1 1 A 31 31 HIS CA C 31 55.876 55.944 -0.068 1 1 333 . 11 1 1 A 31 31 HIS CB C 31 33.434 32.809 0.625 1 1 334 . 11 1 1 A 31 31 HIS N N 31 113.223 118.313 -5.090 1 1 335 . 11 1 1 A 32 32 ARG H H 32 8.196 8.654 -0.458 1 1 336 . 11 1 1 A 32 32 ARG HA H 32 5.262 5.008 0.254 1 1 341 . 11 1 1 A 32 32 ARG C C 32 174.377 174.645 -0.268 1 1 342 . 11 1 1 A 32 32 ARG CA C 32 55.808 54.683 1.125 1 1 343 . 11 1 1 A 32 32 ARG CB C 32 33.340 33.212 0.128 1 1 345 . 11 1 1 A 32 32 ARG N N 32 123.003 126.667 -3.664 1 1 346 . 11 1 1 A 33 33 VAL H H 33 8.956 9.414 -0.458 1 1 347 . 11 1 1 A 33 33 VAL HA H 33 4.734 4.841 -0.107 1 1 355 . 11 1 1 A 33 33 VAL C C 33 172.821 175.011 -2.190 1 1 356 . 11 1 1 A 33 33 VAL CA C 33 60.197 60.453 -0.256 1 1 357 . 11 1 1 A 33 33 VAL CB C 33 35.860 35.709 0.151 1 1 360 . 11 1 1 A 33 33 VAL N N 33 122.929 126.283 -3.354 1 1 361 . 11 1 1 A 34 34 THR H H 34 8.250 8.798 -0.548 1 1 362 . 11 1 1 A 34 34 THR HA H 34 5.616 5.377 0.239 1 1 367 . 11 1 1 A 34 34 THR C C 34 173.913 173.612 0.301 1 1 368 . 11 1 1 A 34 34 THR CA C 34 60.245 59.998 0.247 1 1 369 . 11 1 1 A 34 34 THR CB C 34 71.706 71.340 0.366 1 1 371 . 11 1 1 A 34 34 THR N N 34 119.164 118.035 1.129 1 1 372 . 11 1 1 A 35 35 PHE H H 35 8.565 8.901 -0.336 1 1 373 . 11 1 1 A 35 35 PHE HA H 35 5.029 5.591 -0.562 1 1 378 . 11 1 1 A 35 35 PHE C C 35 173.193 172.375 0.818 1 1 379 . 11 1 1 A 35 35 PHE CA C 35 55.687 55.557 0.130 1 1 380 . 11 1 1 A 35 35 PHE CB C 35 40.853 41.781 -0.928 1 1 383 . 11 1 1 A 35 35 PHE N N 35 120.244 118.140 2.104 1 1 384 . 11 1 1 A 36 36 ARG H H 36 8.869 8.177 0.692 1 1 385 . 11 1 1 A 36 36 ARG HA H 36 4.982 4.533 0.449 1 1 387 . 11 1 1 A 36 36 ARG C C 36 174.743 174.769 -0.026 1 1 388 . 11 1 1 A 36 36 ARG CA C 36 55.493 56.429 -0.936 1 1 389 . 11 1 1 A 36 36 ARG CB C 36 32.228 30.825 1.403 1 1 390 . 11 1 1 A 36 36 ARG N N 36 123.893 122.040 1.853 1 1 391 . 11 1 1 A 37 37 ASP H H 37 8.402 9.468 -1.066 1 1 392 . 11 1 1 A 37 37 ASP HA H 37 5.462 5.590 -0.128 1 1 395 . 11 1 1 A 37 37 ASP C C 37 175.177 174.800 0.377 1 1 396 . 11 1 1 A 37 37 ASP CA C 37 53.942 53.354 0.588 1 1 397 . 11 1 1 A 37 37 ASP CB C 37 45.486 44.600 0.886 1 1 398 . 11 1 1 A 37 37 ASP N N 37 127.149 127.739 -0.590 1 1 399 . 11 1 1 A 38 38 THR H H 38 8.151 8.723 -0.572 1 1 400 . 11 1 1 A 38 38 THR HA H 38 4.866 4.926 -0.060 1 1 405 . 11 1 1 A 38 38 THR C C 38 172.792 173.015 -0.223 1 1 406 . 11 1 1 A 38 38 THR CA C 38 61.416 61.308 0.108 1 1 407 . 11 1 1 A 38 38 THR CB C 38 71.047 71.222 -0.175 1 1 409 . 11 1 1 A 38 38 THR N N 38 115.686 120.423 -4.737 1 1 410 . 11 1 1 A 39 39 TYR H H 39 9.021 8.981 0.040 1 1 411 . 11 1 1 A 39 39 TYR HA H 39 5.544 5.846 -0.302 1 1 416 . 11 1 1 A 39 39 TYR C C 39 176.032 174.815 1.217 1 1 417 . 11 1 1 A 39 39 TYR CA C 39 57.184 56.416 0.768 1 1 418 . 11 1 1 A 39 39 TYR CB C 39 41.642 40.452 1.190 1 1 420 . 11 1 1 A 39 39 TYR N N 39 124.579 125.780 -1.201 1 1 421 . 11 1 1 A 40 40 TYR H H 40 8.487 8.934 -0.447 1 1 422 . 11 1 1 A 40 40 TYR HA H 40 5.517 5.868 -0.351 1 1 426 . 11 1 1 A 40 40 TYR C C 40 174.108 174.426 -0.318 1 1 427 . 11 1 1 A 40 40 TYR CA C 40 56.979 56.835 0.144 1 1 428 . 11 1 1 A 40 40 TYR CB C 40 44.132 42.660 1.472 1 1 431 . 11 1 1 A 40 40 TYR N N 40 119.709 121.513 -1.804 1 1 432 . 11 1 1 A 41 41 ASP H H 41 9.341 8.648 0.693 1 1 433 . 11 1 1 A 41 41 ASP HA H 41 4.866 5.109 -0.243 1 1 436 . 11 1 1 A 41 41 ASP C C 41 177.262 175.120 2.142 1 1 437 . 11 1 1 A 41 41 ASP CA C 41 53.445 53.423 0.022 1 1 438 . 11 1 1 A 41 41 ASP CB C 41 45.347 44.645 0.702 1 1 439 . 11 1 1 A 41 41 ASP N N 41 117.995 120.227 -2.232 1 1 440 . 11 1 1 A 42 42 THR H H 42 11.574 8.676 2.898 1 1 441 . 11 1 1 A 42 42 THR HA H 42 5.206 4.571 0.635 1 1 446 . 11 1 1 A 42 42 THR C C 42 177.935 176.466 1.469 1 1 447 . 11 1 1 A 42 42 THR CA C 42 60.400 62.291 -1.891 1 1 448 . 11 1 1 A 42 42 THR CB C 42 72.114 69.707 2.407 1 1 450 . 11 1 1 A 42 42 THR N N 42 114.394 117.407 -3.013 1 1 451 . 11 1 1 A 43 43 SER H H 43 9.715 8.852 0.863 1 1 452 . 11 1 1 A 43 43 SER HA H 43 4.252 4.080 0.172 1 1 455 . 11 1 1 A 43 43 SER C C 43 175.478 174.878 0.600 1 1 456 . 11 1 1 A 43 43 SER CA C 43 61.277 61.063 0.214 1 1 457 . 11 1 1 A 43 43 SER CB C 43 62.821 62.526 0.295 1 1 458 . 11 1 1 A 43 43 SER N N 43 116.674 119.270 -2.596 1 1 459 . 11 1 1 A 44 44 GLU H H 44 7.674 8.005 -0.331 1 1 460 . 11 1 1 A 44 44 GLU HA H 44 4.330 4.241 0.089 1 1 464 . 11 1 1 A 44 44 GLU C C 44 175.001 175.856 -0.855 1 1 465 . 11 1 1 A 44 44 GLU CA C 44 55.992 55.272 0.720 1 1 466 . 11 1 1 A 44 44 GLU CB C 44 29.276 28.657 0.619 1 1 468 . 11 1 1 A 44 44 GLU N N 44 117.856 117.166 0.690 1 1 469 . 11 1 1 A 45 45 LEU H H 45 8.222 8.040 0.182 1 1 470 . 11 1 1 A 45 45 LEU HA H 45 3.901 4.771 -0.870 1 1 480 . 11 1 1 A 45 45 LEU C C 45 175.209 176.432 -1.223 1 1 481 . 11 1 1 A 45 45 LEU CA C 45 55.548 56.068 -0.520 1 1 482 . 11 1 1 A 45 45 LEU CB C 45 38.458 39.950 -1.492 1 1 485 . 11 1 1 A 45 45 LEU N N 45 119.335 116.709 2.626 1 1 486 . 11 1 1 A 46 46 SER H H 46 7.347 7.976 -0.629 1 1 487 . 11 1 1 A 46 46 SER HA H 46 3.954 4.260 -0.306 1 1 489 . 11 1 1 A 46 46 SER C C 46 177.497 176.961 0.536 1 1 490 . 11 1 1 A 46 46 SER CA C 46 62.471 61.082 1.389 1 1 491 . 11 1 1 A 46 46 SER CB C 46 63.908 63.021 0.887 1 1 492 . 11 1 1 A 46 46 SER N N 46 111.433 113.991 -2.558 1 1 493 . 11 1 1 A 47 47 LEU H H 47 12.003 8.448 3.555 1 1 494 . 11 1 1 A 47 47 LEU HA H 47 3.959 4.203 -0.244 1 1 504 . 11 1 1 A 47 47 LEU C C 47 180.340 178.262 2.078 1 1 505 . 11 1 1 A 47 47 LEU CA C 47 58.879 57.932 0.947 1 1 506 . 11 1 1 A 47 47 LEU CB C 47 39.572 41.772 -2.200 1 1 510 . 11 1 1 A 47 47 LEU N N 47 124.605 123.133 1.472 1 1 511 . 11 1 1 A 48 48 MET H H 48 10.599 8.739 1.860 1 1 512 . 11 1 1 A 48 48 MET HA H 48 3.213 3.724 -0.511 1 1 520 . 11 1 1 A 48 48 MET C C 48 181.177 177.924 3.253 1 1 521 . 11 1 1 A 48 48 MET CA C 48 60.747 58.159 2.588 1 1 522 . 11 1 1 A 48 48 MET CB C 48 32.594 31.887 0.707 1 1 525 . 11 1 1 A 48 48 MET N N 48 126.254 118.790 7.464 1 1 526 . 11 1 1 A 49 49 LEU H H 49 8.731 7.901 0.830 1 1 527 . 11 1 1 A 49 49 LEU HA H 49 4.097 4.117 -0.020 1 1 536 . 11 1 1 A 49 49 LEU C C 49 178.144 177.407 0.737 1 1 537 . 11 1 1 A 49 49 LEU CA C 49 57.800 56.302 1.498 1 1 538 . 11 1 1 A 49 49 LEU CB C 49 41.379 41.715 -0.336 1 1 541 . 11 1 1 A 49 49 LEU N N 49 119.183 119.299 -0.116 1 1 542 . 11 1 1 A 50 50 SER H H 50 7.853 7.558 0.295 1 1 543 . 11 1 1 A 50 50 SER HA H 50 4.822 4.557 0.265 1 1 546 . 11 1 1 A 50 50 SER C C 50 174.539 173.366 1.173 1 1 547 . 11 1 1 A 50 50 SER CA C 50 57.811 57.502 0.309 1 1 548 . 11 1 1 A 50 50 SER CB C 50 64.443 63.044 1.399 1 1 549 . 11 1 1 A 50 50 SER N N 50 114.594 113.457 1.137 1 1 550 . 11 1 1 A 51 51 ASP H H 51 8.264 7.610 0.654 1 1 551 . 11 1 1 A 51 51 ASP HA H 51 4.362 4.226 0.136 1 1 554 . 11 1 1 A 51 51 ASP C C 51 172.921 174.725 -1.804 1 1 555 . 11 1 1 A 51 51 ASP CA C 51 55.343 55.428 -0.085 1 1 556 . 11 1 1 A 51 51 ASP CB C 51 40.583 39.478 1.105 1 1 557 . 11 1 1 A 51 51 ASP N N 51 123.003 117.877 5.126 1 1 558 . 11 1 1 A 52 52 HIS H H 52 7.869 7.304 0.565 1 1 559 . 11 1 1 A 52 52 HIS HA H 52 5.335 5.574 -0.239 1 1 564 . 11 1 1 A 52 52 HIS C C 52 173.991 174.022 -0.031 1 1 565 . 11 1 1 A 52 52 HIS CA C 52 55.889 54.480 1.409 1 1 566 . 11 1 1 A 52 52 HIS CB C 52 31.789 30.022 1.767 1 1 568 . 11 1 1 A 52 52 HIS N N 52 112.486 117.503 -5.017 1 1 569 . 11 1 1 A 53 53 TRP H H 53 8.165 9.292 -1.127 1 1 570 . 11 1 1 A 53 53 TRP HA H 53 4.926 5.468 -0.542 1 1 578 . 11 1 1 A 53 53 TRP C C 53 175.354 175.355 -0.001 1 1 579 . 11 1 1 A 53 53 TRP CA C 53 55.364 56.848 -1.484 1 1 580 . 11 1 1 A 53 53 TRP CB C 53 30.641 31.321 -0.680 1 1 585 . 11 1 1 A 53 53 TRP N N 53 117.916 125.820 -7.904 1 1 587 . 11 1 1 A 54 54 LEU H H 54 10.088 8.984 1.104 1 1 588 . 11 1 1 A 54 54 LEU HA H 54 5.497 5.609 -0.112 1 1 598 . 11 1 1 A 54 54 LEU C C 54 173.337 174.898 -1.561 1 1 599 . 11 1 1 A 54 54 LEU CA C 54 54.408 53.522 0.886 1 1 600 . 11 1 1 A 54 54 LEU CB C 54 44.156 45.500 -1.344 1 1 604 . 11 1 1 A 54 54 LEU N N 54 130.826 125.940 4.886 1 1 605 . 11 1 1 A 55 55 ARG H H 55 9.289 9.377 -0.088 1 1 606 . 11 1 1 A 55 55 ARG HA H 55 5.482 5.470 0.012 1 1 612 . 11 1 1 A 55 55 ARG C C 55 174.057 173.841 0.216 1 1 613 . 11 1 1 A 55 55 ARG CA C 55 53.167 53.992 -0.825 1 1 614 . 11 1 1 A 55 55 ARG CB C 55 34.270 33.552 0.718 1 1 616 . 11 1 1 A 55 55 ARG N N 55 125.089 124.562 0.527 1 1 618 . 11 1 1 A 56 56 GLN H H 56 9.092 9.096 -0.004 1 1 619 . 11 1 1 A 56 56 GLN HA H 56 3.991 4.589 -0.598 1 1 626 . 11 1 1 A 56 56 GLN C C 56 174.199 174.126 0.073 1 1 627 . 11 1 1 A 56 56 GLN CA C 56 54.566 53.689 0.877 1 1 628 . 11 1 1 A 56 56 GLN CB C 56 29.643 31.361 -1.718 1 1 630 . 11 1 1 A 56 56 GLN N N 56 124.355 121.565 2.790 1 1 632 . 11 1 1 A 57 57 ARG H H 57 8.440 8.233 0.207 1 1 633 . 11 1 1 A 57 57 ARG HA H 57 5.316 5.608 -0.292 1 1 639 . 11 1 1 A 57 57 ARG C C 57 176.188 176.239 -0.051 1 1 640 . 11 1 1 A 57 57 ARG CA C 57 53.940 55.406 -1.466 1 1 641 . 11 1 1 A 57 57 ARG CB C 57 32.426 30.866 1.560 1 1 643 . 11 1 1 A 57 57 ARG N N 57 130.222 125.787 4.435 1 1 645 . 11 1 1 A 58 58 GLU H H 58 8.891 8.688 0.203 1 1 646 . 11 1 1 A 58 58 GLU HA H 58 3.996 4.033 -0.037 1 1 649 . 11 1 1 A 58 58 GLU CA C 58 58.364 57.360 1.004 1 1 650 . 11 1 1 A 58 58 GLU CB C 58 30.875 27.465 3.410 1 1 651 . 11 1 1 A 58 58 GLU N N 58 131.208 120.607 10.601 1 1 652 . 11 1 1 A 59 59 GLY H H 59 8.367 8.361 0.006 1 1 653 . 11 1 1 A 59 59 GLY HA2 H 59 4.334 3.733 0.601 1 1 654 . 11 1 1 A 59 59 GLY HA3 H 59 3.743 3.836 -0.093 1 1 655 . 11 1 1 A 59 59 GLY C C 59 174.194 175.124 -0.930 1 1 656 . 11 1 1 A 59 59 GLY CA C 59 45.666 45.876 -0.210 1 1 657 . 11 1 1 A 60 60 SER H H 60 8.071 8.663 -0.592 1 1 658 . 11 1 1 A 60 60 SER HA H 60 4.730 4.542 0.188 1 1 661 . 11 1 1 A 60 60 SER C C 60 173.908 173.657 0.251 1 1 662 . 11 1 1 A 60 60 SER CA C 60 58.762 58.114 0.648 1 1 663 . 11 1 1 A 60 60 SER CB C 60 64.497 63.738 0.759 1 1 664 . 11 1 1 A 60 60 SER N N 60 114.636 114.424 0.212 1 1 665 . 11 1 1 A 61 61 GLY H H 61 8.401 7.084 1.317 1 1 666 . 11 1 1 A 61 61 GLY HA2 H 61 4.560 3.980 0.580 1 1 667 . 11 1 1 A 61 61 GLY HA3 H 61 3.878 4.020 -0.142 1 1 668 . 11 1 1 A 61 61 GLY C C 61 173.526 172.637 0.889 1 1 669 . 11 1 1 A 61 61 GLY CA C 61 44.906 45.257 -0.351 1 1 670 . 11 1 1 A 61 61 GLY N N 61 109.421 108.622 0.799 1 1 671 . 11 1 1 A 62 62 TRP H H 62 8.861 8.475 0.386 1 1 672 . 11 1 1 A 62 62 TRP HA H 62 5.089 5.111 -0.022 1 1 681 . 11 1 1 A 62 62 TRP C C 62 176.168 175.974 0.194 1 1 682 . 11 1 1 A 62 62 TRP CA C 62 57.459 57.322 0.137 1 1 683 . 11 1 1 A 62 62 TRP CB C 62 32.536 31.498 1.038 1 1 689 . 11 1 1 A 62 62 TRP N N 62 122.939 122.225 0.714 1 1 691 . 11 1 1 A 63 63 GLU H H 63 9.306 9.257 0.049 1 1 692 . 11 1 1 A 63 63 GLU HA H 63 4.919 5.257 -0.338 1 1 697 . 11 1 1 A 63 63 GLU C C 63 173.770 174.817 -1.047 1 1 698 . 11 1 1 A 63 63 GLU CA C 63 55.953 55.533 0.420 1 1 699 . 11 1 1 A 63 63 GLU CB C 63 35.317 33.232 2.085 1 1 701 . 11 1 1 A 63 63 GLU N N 63 120.136 121.113 -0.977 1 1 702 . 11 1 1 A 64 64 LEU H H 64 8.998 9.131 -0.133 1 1 703 . 11 1 1 A 64 64 LEU HA H 64 5.616 5.515 0.101 1 1 712 . 11 1 1 A 64 64 LEU C C 64 175.014 174.068 0.946 1 1 713 . 11 1 1 A 64 64 LEU CA C 64 52.945 54.131 -1.186 1 1 714 . 11 1 1 A 64 64 LEU CB C 64 46.904 45.797 1.107 1 1 717 . 11 1 1 A 64 64 LEU N N 64 127.321 126.553 0.768 1 1 718 . 11 1 1 A 65 65 LYS H H 65 9.322 9.995 -0.673 1 1 719 . 11 1 1 A 65 65 LYS HA H 65 5.347 5.256 0.091 1 1 727 . 11 1 1 A 65 65 LYS C C 65 175.811 175.459 0.352 1 1 728 . 11 1 1 A 65 65 LYS CA C 65 55.817 55.475 0.342 1 1 729 . 11 1 1 A 65 65 LYS CB C 65 34.521 34.530 -0.009 1 1 733 . 11 1 1 A 65 65 LYS N N 65 129.874 128.671 1.203 1 1 734 . 11 1 1 A 66 66 CYS H H 66 9.129 9.568 -0.439 1 1 735 . 11 1 1 A 66 66 CYS HA H 66 5.319 5.258 0.061 1 1 738 . 11 1 1 A 66 66 CYS CA C 66 54.532 56.982 -2.450 1 1 739 . 11 1 1 A 66 66 CYS CB C 66 28.813 31.287 -2.474 1 1 740 . 11 1 1 A 66 66 CYS N N 66 121.497 125.614 -4.117 1 1 741 . 11 1 1 A 67 67 PRO HA H 67 4.439 3.768 0.671 1 1 748 . 11 1 1 A 67 67 PRO C C 67 177.297 178.045 -0.748 1 1 749 . 11 1 1 A 67 67 PRO CA C 67 63.596 63.349 0.247 1 1 750 . 11 1 1 A 67 67 PRO CB C 67 32.242 31.757 0.485 1 1 752 . 11 1 1 A 68 68 GLY H H 68 8.316 8.360 -0.044 1 1 753 . 11 1 1 A 68 68 GLY HA2 H 68 3.726 3.940 -0.214 1 1 754 . 11 1 1 A 68 68 GLY HA3 H 68 4.095 3.978 0.117 1 1 755 . 11 1 1 A 68 68 GLY C C 68 173.789 174.521 -0.732 1 1 756 . 11 1 1 A 68 68 GLY CA C 68 45.227 45.304 -0.077 1 1 757 . 11 1 1 A 68 68 GLY N N 68 109.533 110.304 -0.771 1 1 758 . 11 1 1 A 69 69 VAL H H 69 8.114 7.564 0.550 1 1 759 . 11 1 1 A 69 69 VAL HA H 69 4.266 3.976 0.290 1 1 764 . 11 1 1 A 69 69 VAL C C 69 176.299 175.524 0.775 1 1 765 . 11 1 1 A 69 69 VAL CA C 69 61.945 63.175 -1.230 1 1 766 . 11 1 1 A 69 69 VAL CB C 69 33.082 31.425 1.657 1 1 768 . 11 1 1 A 69 69 VAL N N 69 118.540 121.180 -2.640 1 1 769 . 11 1 1 A 70 70 THR H H 70 8.324 8.931 -0.607 1 1 770 . 11 1 1 A 70 70 THR HA H 70 4.373 4.281 0.092 1 1 775 . 11 1 1 A 70 70 THR C C 70 175.204 176.190 -0.986 1 1 776 . 11 1 1 A 70 70 THR CA C 70 62.309 64.941 -2.632 1 1 777 . 11 1 1 A 70 70 THR CB C 70 69.787 69.406 0.381 1 1 779 . 11 1 1 A 70 70 THR N N 70 117.636 121.800 -4.164 1 1 780 . 11 1 1 A 71 71 GLY H H 71 8.574 7.720 0.854 1 1 781 . 11 1 1 A 71 71 GLY HA2 H 71 4.096 4.164 -0.068 1 1 782 . 11 1 1 A 71 71 GLY HA3 H 71 3.975 4.175 -0.200 1 1 783 . 11 1 1 A 71 71 GLY C C 71 174.313 175.211 -0.898 1 1 784 . 11 1 1 A 71 71 GLY CA C 71 45.545 45.705 -0.160 1 1 785 . 11 1 1 A 71 71 GLY N N 71 111.677 106.905 4.772 1 1 786 . 11 1 1 A 72 72 VAL H H 72 7.945 7.669 0.276 1 1 787 . 11 1 1 A 72 72 VAL HA H 72 4.258 4.111 0.147 1 1 795 . 11 1 1 A 72 72 VAL C C 72 176.162 175.452 0.710 1 1 796 . 11 1 1 A 72 72 VAL CA C 72 62.227 64.544 -2.317 1 1 797 . 11 1 1 A 72 72 VAL CB C 72 32.997 32.087 0.910 1 1 799 . 11 1 1 A 72 72 VAL N N 72 118.647 117.877 0.770 1 1 800 . 11 1 1 A 73 73 SER H H 73 8.498 8.096 0.402 1 1 801 . 11 1 1 A 73 73 SER HA H 73 4.617 4.268 0.349 1 1 803 . 11 1 1 A 73 73 SER C C 73 174.461 173.798 0.663 1 1 804 . 11 1 1 A 73 73 SER CA C 73 58.218 59.068 -0.850 1 1 805 . 11 1 1 A 73 73 SER CB C 73 64.061 61.851 2.210 1 1 806 . 11 1 1 A 73 73 SER N N 73 118.828 115.488 3.340 1 1 807 . 11 1 1 A 74 74 GLY H H 74 8.247 8.158 0.089 1 1 808 . 11 1 1 A 74 74 GLY HA2 H 74 4.101 4.156 -0.055 1 1 809 . 11 1 1 A 74 74 GLY HA3 H 74 4.304 4.158 0.146 1 1 810 . 11 1 1 A 74 74 GLY CA C 74 44.896 45.347 -0.451 1 1 811 . 11 1 1 A 74 74 GLY N N 74 111.138 111.341 -0.203 1 1 812 . 11 1 1 A 75 75 PRO HA H 75 4.461 4.312 0.149 1 1 819 . 11 1 1 A 75 75 PRO C C 75 176.798 176.457 0.341 1 1 820 . 11 1 1 A 75 75 PRO CA C 75 63.466 65.352 -1.886 1 1 821 . 11 1 1 A 75 75 PRO CB C 75 31.980 31.475 0.505 1 1 824 . 11 1 1 A 76 76 HIS H H 76 8.397 7.431 0.966 1 1 825 . 11 1 1 A 76 76 HIS HA H 76 4.742 4.823 -0.081 1 1 829 . 11 1 1 A 76 76 HIS C C 76 174.282 173.360 0.922 1 1 830 . 11 1 1 A 76 76 HIS CA C 76 55.579 54.643 0.936 1 1 831 . 11 1 1 A 76 76 HIS CB C 76 30.501 30.993 -0.492 1 1 832 . 11 1 1 A 76 76 HIS N N 76 118.431 110.075 8.356 1 1 833 . 11 1 1 A 77 77 ASN H H 77 8.364 8.728 -0.364 1 1 834 . 11 1 1 A 77 77 ASN HA H 77 4.767 5.051 -0.284 1 1 839 . 11 1 1 A 77 77 ASN C C 77 174.576 175.099 -0.523 1 1 840 . 11 1 1 A 77 77 ASN CA C 77 53.139 52.185 0.954 1 1 841 . 11 1 1 A 77 77 ASN CB C 77 39.320 38.590 0.730 1 1 842 . 11 1 1 A 77 77 ASN N N 77 119.421 117.003 2.418 1 1 844 . 11 1 1 A 78 78 GLU H H 78 8.683 8.309 0.374 1 1 845 . 11 1 1 A 78 78 GLU HA H 78 4.409 4.191 0.218 1 1 850 . 11 1 1 A 78 78 GLU C C 78 175.791 175.192 0.599 1 1 851 . 11 1 1 A 78 78 GLU CA C 78 56.359 57.305 -0.946 1 1 852 . 11 1 1 A 78 78 GLU CB C 78 30.818 28.509 2.309 1 1 854 . 11 1 1 A 78 78 GLU N N 78 122.085 118.074 4.011 1 1 855 . 11 1 1 A 79 79 TYR H H 79 8.341 8.639 -0.298 1 1 856 . 11 1 1 A 79 79 TYR HA H 79 4.988 4.978 0.010 1 1 861 . 11 1 1 A 79 79 TYR C C 79 175.837 175.875 -0.038 1 1 862 . 11 1 1 A 79 79 TYR CA C 79 58.028 59.572 -1.544 1 1 863 . 11 1 1 A 79 79 TYR CB C 79 41.672 38.928 2.744 1 1 866 . 11 1 1 A 79 79 TYR N N 79 119.452 124.762 -5.310 1 1 867 . 11 1 1 A 80 80 VAL H H 80 9.366 9.231 0.135 1 1 868 . 11 1 1 A 80 80 VAL HA H 80 4.370 4.979 -0.609 1 1 873 . 11 1 1 A 80 80 VAL C C 80 174.948 175.166 -0.218 1 1 874 . 11 1 1 A 80 80 VAL CA C 80 61.190 59.866 1.324 1 1 875 . 11 1 1 A 80 80 VAL CB C 80 34.204 34.070 0.134 1 1 877 . 11 1 1 A 80 80 VAL N N 80 120.567 119.222 1.345 1 1 878 . 11 1 1 A 81 81 GLU H H 81 8.570 9.259 -0.689 1 1 879 . 11 1 1 A 81 81 GLU HA H 81 4.770 5.593 -0.823 1 1 883 . 11 1 1 A 81 81 GLU C C 81 175.491 175.823 -0.332 1 1 884 . 11 1 1 A 81 81 GLU CA C 81 55.655 54.745 0.910 1 1 885 . 11 1 1 A 81 81 GLU CB C 81 30.415 32.612 -2.197 1 1 887 . 11 1 1 A 81 81 GLU N N 81 124.248 123.809 0.439 1 1 888 . 11 1 1 A 82 82 VAL H H 82 9.189 9.245 -0.056 1 1 889 . 11 1 1 A 82 82 VAL HA H 82 4.279 4.851 -0.572 1 1 894 . 11 1 1 A 82 82 VAL C C 82 176.087 175.495 0.592 1 1 895 . 11 1 1 A 82 82 VAL CA C 82 62.672 60.222 2.450 1 1 896 . 11 1 1 A 82 82 VAL CB C 82 33.121 34.172 -1.051 1 1 898 . 11 1 1 A 82 82 VAL N N 82 127.776 119.000 8.776 1 1 899 . 11 1 1 A 83 83 THR H H 83 8.590 8.565 0.025 1 1 900 . 11 1 1 A 83 83 THR HA H 83 4.955 4.761 0.194 1 1 905 . 11 1 1 A 83 83 THR C C 83 174.688 175.082 -0.394 1 1 906 . 11 1 1 A 83 83 THR CA C 83 61.332 61.615 -0.283 1 1 907 . 11 1 1 A 83 83 THR CB C 83 70.213 70.484 -0.271 1 1 909 . 11 1 1 A 83 83 THR N N 83 114.744 115.296 -0.552 1 1 910 . 11 1 1 A 84 84 SER H H 84 7.650 7.398 0.252 1 1 911 . 11 1 1 A 84 84 SER HA H 84 4.819 4.277 0.542 1 1 914 . 11 1 1 A 84 84 SER CA C 84 56.280 60.423 -4.143 1 1 915 . 11 1 1 A 84 84 SER CB C 84 63.294 63.409 -0.115 1 1 916 . 11 1 1 A 84 84 SER N N 84 118.038 119.008 -0.970 1 1 917 . 11 1 1 A 85 85 GLU H H 85 8.391 8.698 -0.307 1 1 918 . 11 1 1 A 85 85 GLU HA H 85 3.661 3.918 -0.257 1 1 923 . 11 1 1 A 85 85 GLU C C 85 177.520 178.358 -0.838 1 1 924 . 11 1 1 A 85 85 GLU CA C 85 62.429 59.657 2.772 1 1 925 . 11 1 1 A 85 85 GLU CB C 85 29.655 29.414 0.241 1 1 927 . 11 1 1 A 86 86 ALA H H 86 8.443 8.138 0.305 1 1 928 . 11 1 1 A 86 86 ALA HA H 86 4.027 4.030 -0.003 1 1 932 . 11 1 1 A 86 86 ALA C C 86 180.423 180.020 0.403 1 1 933 . 11 1 1 A 86 86 ALA CA C 86 55.145 54.839 0.306 1 1 934 . 11 1 1 A 86 86 ALA CB C 86 18.165 18.107 0.058 1 1 935 . 11 1 1 A 86 86 ALA N N 86 119.636 122.746 -3.110 1 1 936 . 11 1 1 A 87 87 ALA H H 87 7.214 7.495 -0.281 1 1 937 . 11 1 1 A 87 87 ALA HA H 87 4.244 4.051 0.193 1 1 941 . 11 1 1 A 87 87 ALA C C 87 180.354 180.154 0.200 1 1 942 . 11 1 1 A 87 87 ALA CA C 87 54.378 54.898 -0.520 1 1 943 . 11 1 1 A 87 87 ALA CB C 87 18.795 18.681 0.114 1 1 944 . 11 1 1 A 87 87 ALA N N 87 121.004 120.282 0.722 1 1 945 . 11 1 1 A 88 88 ILE H H 88 8.471 7.564 0.907 1 1 946 . 11 1 1 A 88 88 ILE HA H 88 3.360 3.681 -0.321 1 1 954 . 11 1 1 A 88 88 ILE CA C 88 66.323 64.612 1.711 1 1 955 . 11 1 1 A 88 88 ILE CB C 88 37.808 37.411 0.397 1 1 958 . 11 1 1 A 88 88 ILE N N 88 120.743 119.751 0.992 1 1 959 . 11 1 1 A 89 89 VAL H H 89 8.343 8.460 -0.117 1 1 960 . 11 1 1 A 89 89 VAL HA H 89 3.061 3.456 -0.395 1 1 968 . 11 1 1 A 89 89 VAL C C 89 176.708 177.805 -1.097 1 1 969 . 11 1 1 A 89 89 VAL CA C 89 67.833 66.491 1.342 1 1 970 . 11 1 1 A 89 89 VAL CB C 89 31.509 31.422 0.087 1 1 973 . 11 1 1 A 89 89 VAL N N 89 118.049 120.209 -2.160 1 1 974 . 11 1 1 A 90 90 ALA H H 90 7.516 7.777 -0.261 1 1 975 . 11 1 1 A 90 90 ALA HA H 90 3.987 3.871 0.116 1 1 979 . 11 1 1 A 90 90 ALA C C 90 180.744 179.213 1.531 1 1 980 . 11 1 1 A 90 90 ALA CA C 90 55.481 55.716 -0.235 1 1 981 . 11 1 1 A 90 90 ALA CB C 90 17.953 18.017 -0.064 1 1 982 . 11 1 1 A 90 90 ALA N N 90 118.935 121.879 -2.944 1 1 983 . 11 1 1 A 91 91 GLN H H 91 7.886 7.984 -0.098 1 1 984 . 11 1 1 A 91 91 GLN HA H 91 4.190 3.999 0.191 1 1 991 . 11 1 1 A 91 91 GLN C C 91 178.832 178.488 0.344 1 1 992 . 11 1 1 A 91 91 GLN CA C 91 58.519 58.816 -0.297 1 1 993 . 11 1 1 A 91 91 GLN CB C 91 28.091 28.274 -0.183 1 1 995 . 11 1 1 A 91 91 GLN N N 91 117.846 118.065 -0.219 1 1 997 . 11 1 1 A 92 92 LEU H H 92 8.751 8.830 -0.079 1 1 998 . 11 1 1 A 92 92 LEU HA H 92 3.903 3.944 -0.041 1 1 1007 . 11 1 1 A 92 92 LEU C C 92 178.997 179.039 -0.042 1 1 1008 . 11 1 1 A 92 92 LEU CA C 92 58.136 57.848 0.288 1 1 1009 . 11 1 1 A 92 92 LEU CB C 92 41.576 41.562 0.014 1 1 1013 . 11 1 1 A 92 92 LEU N N 92 119.547 119.867 -0.320 1 1 1014 . 11 1 1 A 93 93 PHE H H 93 8.648 8.027 0.621 1 1 1015 . 11 1 1 A 93 93 PHE HA H 93 4.270 4.256 0.014 1 1 1020 . 11 1 1 A 93 93 PHE C C 93 179.283 178.943 0.340 1 1 1021 . 11 1 1 A 93 93 PHE CA C 93 59.860 60.307 -0.447 1 1 1022 . 11 1 1 A 93 93 PHE CB C 93 37.765 38.555 -0.790 1 1 1025 . 11 1 1 A 93 93 PHE N N 93 118.041 119.369 -1.328 1 1 1026 . 11 1 1 A 94 94 GLU H H 94 7.739 8.221 -0.482 1 1 1027 . 11 1 1 A 94 94 GLU HA H 94 4.110 4.143 -0.033 1 1 1031 . 11 1 1 A 94 94 GLU C C 94 178.629 178.792 -0.163 1 1 1032 . 11 1 1 A 94 94 GLU CA C 94 59.359 59.347 0.012 1 1 1033 . 11 1 1 A 94 94 GLU CB C 94 29.589 29.150 0.439 1 1 1035 . 11 1 1 A 94 94 GLU N N 94 119.980 117.323 2.657 1 1 1036 . 11 1 1 A 95 95 LEU H H 95 7.999 8.458 -0.459 1 1 1037 . 11 1 1 A 95 95 LEU HA H 95 4.139 3.987 0.152 1 1 1047 . 11 1 1 A 95 95 LEU C C 95 178.965 179.038 -0.073 1 1 1048 . 11 1 1 A 95 95 LEU CA C 95 57.557 57.913 -0.356 1 1 1049 . 11 1 1 A 95 95 LEU CB C 95 43.443 41.543 1.900 1 1 1053 . 11 1 1 A 95 95 LEU N N 95 118.398 121.568 -3.170 1 1 1054 . 11 1 1 A 96 96 LEU H H 96 8.363 8.050 0.313 1 1 1055 . 11 1 1 A 96 96 LEU HA H 96 4.503 4.209 0.294 1 1 1061 . 11 1 1 A 96 96 LEU C C 96 177.932 177.142 0.790 1 1 1062 . 11 1 1 A 96 96 LEU CA C 96 54.700 55.163 -0.463 1 1 1063 . 11 1 1 A 96 96 LEU CB C 96 43.048 42.413 0.635 1 1 1065 . 11 1 1 A 96 96 LEU N N 96 114.720 116.863 -2.143 1 1 1066 . 11 1 1 A 97 97 GLY H H 97 7.810 7.794 0.016 1 1 1067 . 11 1 1 A 97 97 GLY HA2 H 97 3.963 3.902 0.061 1 1 1068 . 11 1 1 A 97 97 GLY C C 97 173.535 174.227 -0.692 1 1 1069 . 11 1 1 A 97 97 GLY CA C 97 45.667 46.388 -0.721 1 1 1070 . 11 1 1 A 97 97 GLY N N 97 109.511 106.786 2.725 1 1 1071 . 11 1 1 A 98 98 SER H H 98 8.131 8.213 -0.082 1 1 1072 . 11 1 1 A 98 98 SER HA H 98 4.225 4.673 -0.448 1 1 1075 . 11 1 1 A 98 98 SER C C 98 174.974 174.024 0.950 1 1 1076 . 11 1 1 A 98 98 SER CA C 98 57.960 57.775 0.185 1 1 1077 . 11 1 1 A 98 98 SER CB C 98 63.997 65.143 -1.146 1 1 1078 . 11 1 1 A 98 98 SER N N 98 113.405 115.188 -1.783 1 1 1079 . 11 1 1 A 99 99 GLY H H 99 8.052 8.615 -0.563 1 1 1080 . 11 1 1 A 99 99 GLY HA2 H 99 3.998 4.116 -0.118 1 1 1081 . 11 1 1 A 99 99 GLY HA3 H 99 3.778 4.161 -0.383 1 1 1082 . 11 1 1 A 99 99 GLY C C 99 174.033 174.394 -0.361 1 1 1083 . 11 1 1 A 99 99 GLY CA C 99 45.123 45.376 -0.253 1 1 1084 . 11 1 1 A 99 99 GLY N N 99 111.534 114.346 -2.812 1 1 1085 . 11 1 1 A 100 100 GLU H H 100 8.177 7.703 0.474 1 1 1086 . 11 1 1 A 100 100 GLU HA H 100 4.201 4.507 -0.306 1 1 1091 . 11 1 1 A 100 100 GLU C C 100 175.830 176.118 -0.288 1 1 1092 . 11 1 1 A 100 100 GLU CA C 100 56.442 56.310 0.132 1 1 1093 . 11 1 1 A 100 100 GLU CB C 100 30.428 31.010 -0.582 1 1 1095 . 11 1 1 A 100 100 GLU N N 100 120.463 120.533 -0.070 1 1 1096 . 11 1 1 A 101 101 GLN H H 101 8.161 8.496 -0.335 1 1 1097 . 11 1 1 A 101 101 GLN HA H 101 4.098 4.221 -0.123 1 1 1103 . 11 1 1 A 101 101 GLN C C 101 175.412 175.589 -0.177 1 1 1104 . 11 1 1 A 101 101 GLN CA C 101 55.632 56.193 -0.561 1 1 1105 . 11 1 1 A 101 101 GLN CB C 101 29.569 29.018 0.551 1 1 1107 . 11 1 1 A 101 101 GLN N N 101 120.014 121.180 -1.166 1 1 1109 . 11 1 1 A 102 102 LYS H H 102 8.235 8.660 -0.425 1 1 1110 . 11 1 1 A 102 102 LYS HA H 102 4.387 4.056 0.331 1 1 1117 . 11 1 1 A 102 102 LYS CA C 102 54.116 53.529 0.587 1 1 1118 . 11 1 1 A 102 102 LYS CB C 102 32.478 32.149 0.329 1 1 1122 . 11 1 1 A 102 102 LYS N N 102 123.399 122.472 0.927 1 1 1123 . 11 1 1 A 103 103 PRO HA H 103 4.498 4.358 0.140 1 1 1129 . 11 1 1 A 103 103 PRO C C 103 175.473 177.153 -1.680 1 1 1130 . 11 1 1 A 103 103 PRO CA C 103 62.802 66.050 -3.248 1 1 1131 . 11 1 1 A 103 103 PRO CB C 103 32.124 31.473 0.651 1 1 1134 . 11 1 1 A 104 104 ALA H H 104 8.017 7.265 0.752 1 1 1135 . 11 1 1 A 104 104 ALA HA H 104 4.318 4.360 -0.042 1 1 1139 . 11 1 1 A 104 104 ALA C C 104 176.717 176.981 -0.264 1 1 1140 . 11 1 1 A 104 104 ALA CA C 104 52.194 53.237 -1.043 1 1 1141 . 11 1 1 A 104 104 ALA CB C 104 20.113 20.364 -0.251 1 1 1142 . 11 1 1 A 104 104 ALA N N 104 122.093 118.380 3.713 1 1 1143 . 11 1 1 A 105 105 GLY H H 105 7.678 8.151 -0.473 1 1 1144 . 11 1 1 A 105 105 GLY HA2 H 105 3.851 4.112 -0.261 1 1 1145 . 11 1 1 A 105 105 GLY HA3 H 105 4.053 4.139 -0.086 1 1 1146 . 11 1 1 A 105 105 GLY C C 105 172.990 174.876 -1.886 1 1 1147 . 11 1 1 A 105 105 GLY CA C 105 44.241 43.556 0.685 1 1 1148 . 11 1 1 A 105 105 GLY N N 105 105.234 104.572 0.662 1 1 1149 . 11 1 1 A 106 106 VAL H H 106 8.409 8.741 -0.332 1 1 1150 . 11 1 1 A 106 106 VAL HA H 106 2.829 3.326 -0.497 1 1 1158 . 11 1 1 A 106 106 VAL C C 106 177.822 177.355 0.467 1 1 1159 . 11 1 1 A 106 106 VAL CA C 106 65.522 65.504 0.018 1 1 1160 . 11 1 1 A 106 106 VAL CB C 106 30.701 30.564 0.137 1 1 1163 . 11 1 1 A 106 106 VAL N N 106 119.215 119.127 0.088 1 1 1164 . 11 1 1 A 107 107 ALA H H 107 8.707 8.226 0.481 1 1 1165 . 11 1 1 A 107 107 ALA HA H 107 3.730 3.912 -0.182 1 1 1169 . 11 1 1 A 107 107 ALA C C 107 179.661 179.434 0.227 1 1 1170 . 11 1 1 A 107 107 ALA CA C 107 54.995 55.481 -0.486 1 1 1171 . 11 1 1 A 107 107 ALA CB C 107 17.705 17.934 -0.229 1 1 1172 . 11 1 1 A 107 107 ALA N N 107 118.672 121.919 -3.247 1 1 1173 . 11 1 1 A 108 108 ALA H H 108 7.388 7.395 -0.007 1 1 1174 . 11 1 1 A 108 108 ALA HA H 108 4.259 4.105 0.154 1 1 1178 . 11 1 1 A 108 108 ALA C C 108 179.318 179.360 -0.042 1 1 1179 . 11 1 1 A 108 108 ALA CA C 108 53.481 54.950 -1.469 1 1 1180 . 11 1 1 A 108 108 ALA CB C 108 19.367 18.470 0.897 1 1 1181 . 11 1 1 A 108 108 ALA N N 108 116.635 119.972 -3.337 1 1 1182 . 11 1 1 A 109 109 VAL H H 109 7.689 7.551 0.138 1 1 1183 . 11 1 1 A 109 109 VAL HA H 109 4.532 3.862 0.670 1 1 1191 . 11 1 1 A 109 109 VAL C C 109 176.055 177.977 -1.922 1 1 1192 . 11 1 1 A 109 109 VAL CA C 109 61.452 65.547 -4.095 1 1 1193 . 11 1 1 A 109 109 VAL CB C 109 32.728 31.448 1.280 1 1 1196 . 11 1 1 A 109 109 VAL N N 109 112.851 116.985 -4.134 1 1 1197 . 11 1 1 A 110 110 LEU H H 110 7.099 8.229 -1.130 1 1 1198 . 11 1 1 A 110 110 LEU HA H 110 3.723 3.767 -0.044 1 1 1208 . 11 1 1 A 110 110 LEU C C 110 179.040 178.793 0.247 1 1 1209 . 11 1 1 A 110 110 LEU CA C 110 58.825 57.880 0.945 1 1 1210 . 11 1 1 A 110 110 LEU CB C 110 41.242 41.731 -0.489 1 1 1214 . 11 1 1 A 110 110 LEU N N 110 119.829 125.095 -5.266 1 1 1215 . 11 1 1 A 111 111 GLY H H 111 8.435 7.600 0.835 1 1 1216 . 11 1 1 A 111 111 GLY HA2 H 111 3.970 3.821 0.149 1 1 1217 . 11 1 1 A 111 111 GLY HA3 H 111 3.885 3.826 0.059 1 1 1218 . 11 1 1 A 111 111 GLY C C 111 178.031 176.557 1.474 1 1 1219 . 11 1 1 A 111 111 GLY CA C 111 46.961 47.547 -0.586 1 1 1220 . 11 1 1 A 111 111 GLY N N 111 104.089 106.566 -2.477 1 1 1221 . 11 1 1 A 112 112 SER H H 112 8.343 8.315 0.028 1 1 1222 . 11 1 1 A 112 112 SER HA H 112 4.266 4.133 0.133 1 1 1224 . 11 1 1 A 112 112 SER C C 112 175.885 175.372 0.513 1 1 1225 . 11 1 1 A 112 112 SER CA C 112 61.304 62.569 -1.265 1 1 1226 . 11 1 1 A 112 112 SER CB C 112 62.901 62.958 -0.057 1 1 1227 . 11 1 1 A 112 112 SER N N 112 119.497 119.510 -0.013 1 1 1228 . 11 1 1 A 113 113 LEU H H 113 7.667 8.095 -0.428 1 1 1229 . 11 1 1 A 113 113 LEU HA H 113 4.343 4.162 0.181 1 1 1238 . 11 1 1 A 113 113 LEU C C 113 174.760 175.902 -1.142 1 1 1239 . 11 1 1 A 113 113 LEU CA C 113 54.228 54.692 -0.464 1 1 1240 . 11 1 1 A 113 113 LEU CB C 113 41.467 42.208 -0.741 1 1 1244 . 11 1 1 A 113 113 LEU N N 113 118.843 117.751 1.092 1 1 1245 . 11 1 1 A 114 114 LYS H H 114 7.685 7.879 -0.194 1 1 1246 . 11 1 1 A 114 114 LYS HA H 114 3.958 3.838 0.120 1 1 1250 . 11 1 1 A 114 114 LYS C C 114 177.557 175.614 1.943 1 1 1251 . 11 1 1 A 114 114 LYS CA C 114 56.935 57.377 -0.442 1 1 1252 . 11 1 1 A 114 114 LYS CB C 114 28.898 29.503 -0.605 1 1 1254 . 11 1 1 A 114 114 LYS N N 114 114.072 116.561 -2.489 1 1 1255 . 11 1 1 A 115 115 LEU H H 115 8.329 7.848 0.481 1 1 1256 . 11 1 1 A 115 115 LEU HA H 115 4.315 4.417 -0.102 1 1 1265 . 11 1 1 A 115 115 LEU C C 115 175.988 177.109 -1.121 1 1 1266 . 11 1 1 A 115 115 LEU CA C 115 54.310 54.752 -0.442 1 1 1267 . 11 1 1 A 115 115 LEU CB C 115 44.163 42.635 1.528 1 1 1270 . 11 1 1 A 115 115 LEU N N 115 117.951 119.467 -1.516 1 1 1271 . 11 1 1 A 116 116 GLN H H 116 9.100 9.044 0.056 1 1 1272 . 11 1 1 A 116 116 GLN HA H 116 4.898 5.029 -0.131 1 1 1279 . 11 1 1 A 116 116 GLN CA C 116 53.467 54.340 -0.873 1 1 1280 . 11 1 1 A 116 116 GLN CB C 116 32.730 31.863 0.867 1 1 1282 . 11 1 1 A 116 116 GLN N N 116 119.994 118.996 0.998 1 1 1284 . 11 1 1 A 117 117 GLU H H 117 8.849 8.552 0.297 1 1 1285 . 11 1 1 A 117 117 GLU HA H 117 3.707 3.628 0.079 1 1 1290 . 11 1 1 A 117 117 GLU C C 117 177.303 176.275 1.028 1 1 1291 . 11 1 1 A 117 117 GLU CA C 117 57.233 55.161 2.072 1 1 1292 . 11 1 1 A 117 117 GLU CB C 117 29.634 28.837 0.797 1 1 1294 . 11 1 1 A 117 117 GLU N N 117 121.487 123.164 -1.677 1 1 1295 . 11 1 1 A 118 118 VAL H H 118 8.983 8.336 0.647 1 1 1296 . 11 1 1 A 118 118 VAL HA H 118 4.360 3.903 0.457 1 1 1304 . 11 1 1 A 118 118 VAL C C 118 174.171 175.459 -1.288 1 1 1305 . 11 1 1 A 118 118 VAL CA C 118 61.772 64.171 -2.399 1 1 1306 . 11 1 1 A 118 118 VAL CB C 118 34.095 32.840 1.255 1 1 1309 . 11 1 1 A 118 118 VAL N N 118 122.933 127.134 -4.201 1 1 1310 . 11 1 1 A 119 119 ALA H H 119 7.023 7.014 0.009 1 1 1311 . 11 1 1 A 119 119 ALA HA H 119 4.378 4.332 0.046 1 1 1315 . 11 1 1 A 119 119 ALA C C 119 175.493 174.829 0.664 1 1 1316 . 11 1 1 A 119 119 ALA CA C 119 51.956 50.799 1.157 1 1 1317 . 11 1 1 A 119 119 ALA CB C 119 23.957 21.613 2.344 1 1 1318 . 11 1 1 A 119 119 ALA N N 119 117.379 121.462 -4.083 1 1 1319 . 11 1 1 A 120 120 SER H H 120 6.999 8.348 -1.349 1 1 1320 . 11 1 1 A 120 120 SER HA H 120 5.208 5.291 -0.083 1 1 1323 . 11 1 1 A 120 120 SER C C 120 173.082 173.083 -0.001 1 1 1324 . 11 1 1 A 120 120 SER CA C 120 56.754 57.162 -0.408 1 1 1325 . 11 1 1 A 120 120 SER CB C 120 64.605 65.436 -0.831 1 1 1326 . 11 1 1 A 120 120 SER N N 120 113.743 114.900 -1.157 1 1 1327 . 11 1 1 A 121 121 PHE H H 121 8.244 8.974 -0.730 1 1 1328 . 11 1 1 A 121 121 PHE HA H 121 5.177 5.320 -0.143 1 1 1333 . 11 1 1 A 121 121 PHE C C 121 173.569 172.098 1.471 1 1 1334 . 11 1 1 A 121 121 PHE CA C 121 55.555 55.694 -0.139 1 1 1335 . 11 1 1 A 121 121 PHE CB C 121 40.959 41.766 -0.807 1 1 1338 . 11 1 1 A 121 121 PHE N N 121 120.358 118.742 1.616 1 1 1339 . 11 1 1 A 122 122 ILE H H 122 8.907 8.816 0.091 1 1 1340 . 11 1 1 A 122 122 ILE HA H 122 4.682 4.752 -0.070 1 1 1348 . 11 1 1 A 122 122 ILE C C 122 176.925 173.870 3.055 1 1 1349 . 11 1 1 A 122 122 ILE CA C 122 60.740 59.941 0.799 1 1 1350 . 11 1 1 A 122 122 ILE CB C 122 39.497 40.752 -1.255 1 1 1353 . 11 1 1 A 122 122 ILE N N 122 121.282 121.918 -0.636 1 1 1354 . 11 1 1 A 123 123 THR H H 123 9.022 9.017 0.005 1 1 1355 . 11 1 1 A 123 123 THR HA H 123 5.039 5.030 0.009 1 1 1360 . 11 1 1 A 123 123 THR C C 123 173.531 173.542 -0.011 1 1 1361 . 11 1 1 A 123 123 THR CA C 123 62.266 61.517 0.749 1 1 1362 . 11 1 1 A 123 123 THR CB C 123 70.677 68.977 1.700 1 1 1364 . 11 1 1 A 123 123 THR N N 123 128.965 125.059 3.906 1 1 1365 . 11 1 1 A 124 124 THR H H 124 8.961 9.495 -0.534 1 1 1366 . 11 1 1 A 124 124 THR HA H 124 5.001 4.838 0.163 1 1 1371 . 11 1 1 A 124 124 THR C C 124 173.468 172.750 0.718 1 1 1372 . 11 1 1 A 124 124 THR CA C 124 62.109 61.445 0.664 1 1 1373 . 11 1 1 A 124 124 THR CB C 124 70.450 69.518 0.932 1 1 1375 . 11 1 1 A 124 124 THR N N 124 122.176 123.736 -1.560 1 1 1376 . 11 1 1 A 125 125 ARG H H 125 9.386 9.393 -0.007 1 1 1377 . 11 1 1 A 125 125 ARG HA H 125 5.764 5.010 0.754 1 1 1384 . 11 1 1 A 125 125 ARG C C 125 175.713 174.851 0.862 1 1 1385 . 11 1 1 A 125 125 ARG CA C 125 53.991 54.845 -0.854 1 1 1386 . 11 1 1 A 125 125 ARG CB C 125 33.557 31.642 1.915 1 1 1389 . 11 1 1 A 125 125 ARG N N 125 130.004 128.909 1.095 1 1 1390 . 11 1 1 A 126 126 SER H H 126 9.172 9.152 0.020 1 1 1391 . 11 1 1 A 126 126 SER HA H 126 5.390 5.117 0.273 1 1 1394 . 11 1 1 A 126 126 SER C C 126 172.359 172.911 -0.552 1 1 1395 . 11 1 1 A 126 126 SER CA C 126 56.934 56.886 0.048 1 1 1396 . 11 1 1 A 126 126 SER CB C 126 65.827 65.410 0.417 1 1 1397 . 11 1 1 A 126 126 SER N N 126 119.906 121.542 -1.636 1 1 1398 . 11 1 1 A 127 127 SER H H 127 8.591 9.261 -0.670 1 1 1399 . 11 1 1 A 127 127 SER HA H 127 5.739 5.379 0.360 1 1 1401 . 11 1 1 A 127 127 SER C C 127 173.283 173.197 0.086 1 1 1402 . 11 1 1 A 127 127 SER CA C 127 57.354 57.803 -0.449 1 1 1403 . 11 1 1 A 127 127 SER CB C 127 65.412 64.663 0.749 1 1 1404 . 11 1 1 A 127 127 SER N N 127 117.914 123.906 -5.992 1 1 1405 . 11 1 1 A 128 128 TRP H H 128 9.866 9.783 0.083 1 1 1406 . 11 1 1 A 128 128 TRP HA H 128 5.560 5.640 -0.080 1 1 1415 . 11 1 1 A 128 128 TRP C C 128 175.828 175.132 0.696 1 1 1416 . 11 1 1 A 128 128 TRP CA C 128 55.852 55.783 0.069 1 1 1417 . 11 1 1 A 128 128 TRP CB C 128 32.524 32.766 -0.242 1 1 1423 . 11 1 1 A 128 128 TRP N N 128 127.978 126.116 1.862 1 1 1425 . 11 1 1 A 129 129 LYS H H 129 9.424 9.532 -0.108 1 1 1426 . 11 1 1 A 129 129 LYS HA H 129 5.388 5.502 -0.114 1 1 1433 . 11 1 1 A 129 129 LYS C C 129 175.254 174.359 0.895 1 1 1434 . 11 1 1 A 129 129 LYS CA C 129 54.410 54.576 -0.166 1 1 1435 . 11 1 1 A 129 129 LYS CB C 129 35.734 36.417 -0.683 1 1 1439 . 11 1 1 A 129 129 LYS N N 129 121.784 118.958 2.826 1 1 1440 . 11 1 1 A 130 130 LEU H H 130 8.933 9.345 -0.412 1 1 1441 . 11 1 1 A 130 130 LEU HA H 130 4.859 5.128 -0.269 1 1 1447 . 11 1 1 A 130 130 LEU C C 130 173.893 174.098 -0.205 1 1 1448 . 11 1 1 A 130 130 LEU CA C 130 53.848 53.919 -0.071 1 1 1449 . 11 1 1 A 130 130 LEU CB C 130 46.125 46.266 -0.141 1 1 1451 . 11 1 1 A 130 130 LEU N N 130 124.543 122.904 1.639 1 1 1452 . 11 1 1 A 131 131 ALA H H 131 8.816 8.855 -0.039 1 1 1453 . 11 1 1 A 131 131 ALA HA H 131 4.776 4.993 -0.217 1 1 1457 . 11 1 1 A 131 131 ALA C C 131 176.662 176.678 -0.016 1 1 1458 . 11 1 1 A 131 131 ALA CA C 131 51.407 50.700 0.707 1 1 1459 . 11 1 1 A 131 131 ALA CB C 131 19.354 20.157 -0.803 1 1 1460 . 11 1 1 A 131 131 ALA N N 131 131.102 128.964 2.138 1 1 1461 . 11 1 1 A 132 132 LEU H H 132 8.487 8.650 -0.163 1 1 1462 . 11 1 1 A 132 132 LEU HA H 132 4.470 4.782 -0.312 1 1 1470 . 11 1 1 A 132 132 LEU C C 132 176.873 175.875 0.998 1 1 1471 . 11 1 1 A 132 132 LEU CA C 132 54.590 53.917 0.673 1 1 1472 . 11 1 1 A 132 132 LEU CB C 132 42.974 43.385 -0.411 1 1 1475 . 11 1 1 A 132 132 LEU N N 132 123.724 124.381 -0.657 1 1 1476 . 11 1 1 A 133 133 SER H H 133 8.448 8.995 -0.547 1 1 1477 . 11 1 1 A 133 133 SER HA H 133 4.560 5.068 -0.508 1 1 1479 . 11 1 1 A 133 133 SER C C 133 176.043 174.369 1.674 1 1 1480 . 11 1 1 A 133 133 SER CA C 133 58.460 57.290 1.170 1 1 1481 . 11 1 1 A 133 133 SER CB C 133 63.985 64.537 -0.552 1 1 1482 . 11 1 1 A 133 133 SER N N 133 115.880 120.907 -5.027 1 1 1483 . 11 1 1 A 134 134 GLY H H 134 8.232 9.080 -0.848 1 1 1484 . 11 1 1 A 134 134 GLY HA2 H 134 4.147 3.835 0.312 1 1 1485 . 11 1 1 A 134 134 GLY HA3 H 134 4.045 3.890 0.155 1 1 1486 . 11 1 1 A 134 134 GLY C C 134 174.013 173.881 0.132 1 1 1487 . 11 1 1 A 134 134 GLY CA C 134 45.337 45.423 -0.086 1 1 1488 . 11 1 1 A 134 134 GLY N N 134 109.970 112.917 -2.947 1 1 1489 . 11 1 1 A 135 135 ALA H H 135 8.424 8.439 -0.015 1 1 1490 . 11 1 1 A 135 135 ALA HA H 135 4.436 4.034 0.402 1 1 1494 . 11 1 1 A 135 135 ALA C C 135 177.537 177.436 0.101 1 1 1495 . 11 1 1 A 135 135 ALA CA C 135 52.721 52.772 -0.051 1 1 1496 . 11 1 1 A 135 135 ALA CB C 135 19.265 17.325 1.940 1 1 1497 . 11 1 1 A 135 135 ALA N N 135 124.118 120.410 3.708 1 1 1498 . 11 1 1 A 136 136 HIS H H 136 8.466 8.466 0.000 1 1 1499 . 11 1 1 A 136 136 HIS HA H 136 4.379 4.656 -0.277 1 1 1500 . 11 1 1 A 136 136 HIS C C 136 176.259 175.711 0.548 1 1 1501 . 11 1 1 A 136 136 HIS CA C 136 56.082 58.489 -2.407 1 1 1502 . 11 1 1 A 136 136 HIS CB C 136 29.619 31.166 -1.547 1 1 1503 . 11 1 1 A 136 136 HIS N N 136 119.493 115.842 3.651 1 1 1504 . 11 1 1 A 137 137 GLY H H 137 8.431 7.346 1.085 1 1 1505 . 11 1 1 A 137 137 GLY HA2 H 137 4.151 4.011 0.140 1 1 1506 . 11 1 1 A 137 137 GLY HA3 H 137 3.893 4.024 -0.131 1 1 1507 . 11 1 1 A 137 137 GLY C C 137 174.039 172.044 1.995 1 1 1508 . 11 1 1 A 137 137 GLY CA C 137 45.372 46.117 -0.745 1 1 1509 . 11 1 1 A 137 137 GLY N N 137 110.442 104.357 6.085 1 1 1510 . 11 1 1 A 138 138 GLN H H 138 8.416 7.973 0.443 1 1 1511 . 11 1 1 A 138 138 GLN HA H 138 4.455 4.782 -0.327 1 1 1515 . 11 1 1 A 138 138 GLN C C 138 175.889 174.706 1.183 1 1 1516 . 11 1 1 A 138 138 GLN CA C 138 55.866 54.463 1.403 1 1 1517 . 11 1 1 A 138 138 GLN CB C 138 29.639 31.407 -1.768 1 1 1518 . 11 1 1 A 138 138 GLN N N 138 119.401 117.627 1.774 1 1 1519 . 11 1 1 A 139 139 GLU H H 139 8.446 8.609 -0.163 1 1 1520 . 11 1 1 A 139 139 GLU HA H 139 4.658 4.724 -0.066 1 1 1524 . 11 1 1 A 139 139 GLU CA C 139 54.589 54.950 -0.361 1 1 1525 . 11 1 1 A 139 139 GLU CB C 139 29.733 28.767 0.966 1 1 1527 . 11 1 1 A 139 139 GLU N N 139 123.136 124.383 -1.247 1 1 1528 . 11 1 1 A 140 140 PRO HA H 140 4.537 4.566 -0.029 1 1 1533 . 11 1 1 A 140 140 PRO C C 140 176.119 175.782 0.337 1 1 1534 . 11 1 1 A 140 140 PRO CA C 140 63.220 62.500 0.720 1 1 1535 . 11 1 1 A 140 140 PRO CB C 140 31.936 32.380 -0.444 1 1 1538 . 11 1 1 A 141 141 GLN H H 141 8.506 8.518 -0.012 1 1 1539 . 11 1 1 A 141 141 GLN HA H 141 4.650 4.936 -0.286 1 1 1546 . 11 1 1 A 141 141 GLN C C 141 175.811 176.024 -0.213 1 1 1547 . 11 1 1 A 141 141 GLN CA C 141 55.912 55.554 0.358 1 1 1548 . 11 1 1 A 141 141 GLN CB C 141 30.241 30.174 0.067 1 1 1550 . 11 1 1 A 141 141 GLN N N 141 120.422 120.231 0.191 1 1 1551 . 11 1 1 A 142 142 LEU H H 142 8.842 9.091 -0.249 1 1 1552 . 11 1 1 A 142 142 LEU HA H 142 5.277 5.205 0.072 1 1 1562 . 11 1 1 A 142 142 LEU C C 142 176.839 175.528 1.311 1 1 1563 . 11 1 1 A 142 142 LEU CA C 142 53.927 52.934 0.993 1 1 1564 . 11 1 1 A 142 142 LEU CB C 142 44.527 44.339 0.188 1 1 1568 . 11 1 1 A 142 142 LEU N N 142 123.692 121.543 2.149 1 1 1569 . 11 1 1 A 143 143 THR H H 143 9.025 9.026 -0.001 1 1 1570 . 11 1 1 A 143 143 THR HA H 143 5.262 5.141 0.121 1 1 1575 . 11 1 1 A 143 143 THR C C 143 173.753 173.938 -0.185 1 1 1576 . 11 1 1 A 143 143 THR CA C 143 61.795 61.861 -0.066 1 1 1577 . 11 1 1 A 143 143 THR CB C 143 70.660 70.599 0.061 1 1 1579 . 11 1 1 A 143 143 THR N N 143 117.222 115.331 1.891 1 1 1580 . 11 1 1 A 144 144 ILE H H 144 9.353 10.313 -0.960 1 1 1581 . 11 1 1 A 144 144 ILE HA H 144 5.399 5.176 0.223 1 1 1591 . 11 1 1 A 144 144 ILE C C 144 173.931 173.894 0.037 1 1 1592 . 11 1 1 A 144 144 ILE CA C 144 60.774 60.339 0.435 1 1 1593 . 11 1 1 A 144 144 ILE CB C 144 41.111 39.424 1.687 1 1 1597 . 11 1 1 A 144 144 ILE N N 144 126.383 128.457 -2.074 1 1 1598 . 11 1 1 A 145 145 ASP H H 145 9.214 9.588 -0.374 1 1 1599 . 11 1 1 A 145 145 ASP HA H 145 5.978 5.532 0.446 1 1 1601 . 11 1 1 A 145 145 ASP C C 145 175.441 174.680 0.761 1 1 1602 . 11 1 1 A 145 145 ASP CA C 145 53.035 52.696 0.339 1 1 1603 . 11 1 1 A 145 145 ASP CB C 145 44.153 44.670 -0.517 1 1 1604 . 11 1 1 A 145 145 ASP N N 145 127.981 128.853 -0.872 1 1 1605 . 11 1 1 A 146 146 LEU H H 146 9.387 9.893 -0.506 1 1 1606 . 11 1 1 A 146 146 LEU HA H 146 4.918 5.467 -0.549 1 1 1616 . 11 1 1 A 146 146 LEU C C 146 175.003 174.809 0.194 1 1 1617 . 11 1 1 A 146 146 LEU CA C 146 53.940 53.515 0.425 1 1 1618 . 11 1 1 A 146 146 LEU CB C 146 43.902 44.285 -0.383 1 1 1622 . 11 1 1 A 146 146 LEU N N 146 123.532 126.492 -2.960 1 1 1623 . 11 1 1 A 147 147 ASP H H 147 8.676 8.802 -0.126 1 1 1624 . 11 1 1 A 147 147 ASP HA H 147 5.205 5.548 -0.343 1 1 1627 . 11 1 1 A 147 147 ASP C C 147 174.956 174.630 0.326 1 1 1628 . 11 1 1 A 147 147 ASP CA C 147 53.441 52.490 0.951 1 1 1629 . 11 1 1 A 147 147 ASP CB C 147 43.370 43.448 -0.078 1 1 1630 . 11 1 1 A 147 147 ASP N N 147 125.499 125.856 -0.357 1 1 1631 . 11 1 1 A 148 148 SER H H 148 8.732 9.312 -0.580 1 1 1632 . 11 1 1 A 148 148 SER HA H 148 5.365 5.385 -0.020 1 1 1634 . 11 1 1 A 148 148 SER C C 148 173.217 173.521 -0.304 1 1 1635 . 11 1 1 A 148 148 SER CA C 148 56.334 55.416 0.918 1 1 1636 . 11 1 1 A 148 148 SER CB C 148 65.812 66.430 -0.618 1 1 1637 . 11 1 1 A 148 148 SER N N 148 118.623 119.423 -0.800 1 1 1638 . 11 1 1 A 149 149 ALA H H 149 8.937 8.996 -0.059 1 1 1639 . 11 1 1 A 149 149 ALA HA H 149 5.681 4.825 0.856 1 1 1643 . 11 1 1 A 149 149 ALA C C 149 178.894 177.888 1.006 1 1 1644 . 11 1 1 A 149 149 ALA CA C 149 49.996 50.263 -0.267 1 1 1645 . 11 1 1 A 149 149 ALA CB C 149 23.231 21.271 1.960 1 1 1646 . 11 1 1 A 149 149 ALA N N 149 123.952 123.114 0.838 1 1 1647 . 11 1 1 A 150 150 ASP H H 150 9.010 8.899 0.111 1 1 1648 . 11 1 1 A 150 150 ASP HA H 150 4.336 4.297 0.039 1 1 1651 . 11 1 1 A 150 150 ASP C C 150 176.697 177.498 -0.801 1 1 1652 . 11 1 1 A 150 150 ASP CA C 150 56.543 57.238 -0.695 1 1 1653 . 11 1 1 A 150 150 ASP CB C 150 39.850 40.311 -0.461 1 1 1654 . 11 1 1 A 150 150 ASP N N 150 122.687 125.388 -2.701 1 1 1655 . 11 1 1 A 151 151 PHE H H 151 7.295 8.290 -0.995 1 1 1656 . 11 1 1 A 151 151 PHE HA H 151 5.020 4.542 0.478 1 1 1661 . 11 1 1 A 151 151 PHE C C 151 174.756 175.774 -1.018 1 1 1662 . 11 1 1 A 151 151 PHE CA C 151 56.594 60.869 -4.275 1 1 1663 . 11 1 1 A 151 151 PHE CB C 151 37.765 39.599 -1.834 1 1 1666 . 11 1 1 A 151 151 PHE N N 151 113.928 121.138 -7.210 1 1 1667 . 11 1 1 A 152 152 GLY H H 152 7.786 8.631 -0.845 1 1 1668 . 11 1 1 A 152 152 GLY HA2 H 152 4.459 4.032 0.427 1 1 1669 . 11 1 1 A 152 152 GLY HA3 H 152 3.728 4.053 -0.325 1 1 1670 . 11 1 1 A 152 152 GLY C C 152 172.709 173.404 -0.695 1 1 1671 . 11 1 1 A 152 152 GLY CA C 152 46.106 45.922 0.184 1 1 1672 . 11 1 1 A 152 152 GLY N N 152 110.312 107.196 3.116 1 1 1673 . 11 1 1 A 153 153 TYR H H 153 6.650 7.301 -0.651 1 1 1674 . 11 1 1 A 153 153 TYR HA H 153 4.508 5.004 -0.496 1 1 1679 . 11 1 1 A 153 153 TYR C C 153 173.092 173.296 -0.204 1 1 1680 . 11 1 1 A 153 153 TYR CA C 153 57.464 57.495 -0.031 1 1 1681 . 11 1 1 A 153 153 TYR CB C 153 41.962 42.187 -0.225 1 1 1684 . 11 1 1 A 153 153 TYR N N 153 121.977 119.479 2.498 1 1 1685 . 11 1 1 A 154 154 ALA H H 154 7.847 7.912 -0.065 1 1 1686 . 11 1 1 A 154 154 ALA HA H 154 5.144 4.609 0.535 1 1 1690 . 11 1 1 A 154 154 ALA C C 154 174.468 174.295 0.173 1 1 1691 . 11 1 1 A 154 154 ALA CA C 154 51.776 50.503 1.273 1 1 1692 . 11 1 1 A 154 154 ALA CB C 154 21.747 22.489 -0.742 1 1 1693 . 11 1 1 A 154 154 ALA N N 154 130.258 129.072 1.186 1 1 1694 . 11 1 1 A 155 155 VAL H H 155 8.733 8.729 0.004 1 1 1695 . 11 1 1 A 155 155 VAL HA H 155 4.150 4.649 -0.499 1 1 1700 . 11 1 1 A 155 155 VAL C C 155 172.632 173.798 -1.166 1 1 1701 . 11 1 1 A 155 155 VAL CA C 155 61.451 59.352 2.099 1 1 1702 . 11 1 1 A 155 155 VAL CB C 155 35.883 34.903 0.980 1 1 1704 . 11 1 1 A 155 155 VAL N N 155 119.622 120.909 -1.287 1 1 1705 . 11 1 1 A 156 156 GLY H H 156 8.146 8.140 0.006 1 1 1706 . 11 1 1 A 156 156 GLY HA2 H 156 5.125 2.766 2.359 1 1 1707 . 11 1 1 A 156 156 GLY HA3 H 156 2.061 4.022 -1.961 1 1 1708 . 11 1 1 A 156 156 GLY C C 156 171.746 171.562 0.184 1 1 1709 . 11 1 1 A 156 156 GLY CA C 156 43.319 43.616 -0.297 1 1 1710 . 11 1 1 A 156 156 GLY N N 156 113.332 113.470 -0.138 1 1 1711 . 11 1 1 A 157 157 GLU H H 157 8.967 8.908 0.059 1 1 1712 . 11 1 1 A 157 157 GLU HA H 157 5.217 5.123 0.094 1 1 1716 . 11 1 1 A 157 157 GLU C C 157 174.476 175.474 -0.998 1 1 1717 . 11 1 1 A 157 157 GLU CA C 157 55.390 54.961 0.429 1 1 1718 . 11 1 1 A 157 157 GLU CB C 157 34.010 33.257 0.753 1 1 1720 . 11 1 1 A 157 157 GLU N N 157 120.823 121.754 -0.931 1 1 1721 . 11 1 1 A 158 158 VAL H H 158 9.076 9.160 -0.084 1 1 1722 . 11 1 1 A 158 158 VAL HA H 158 5.206 4.700 0.506 1 1 1727 . 11 1 1 A 158 158 VAL C C 158 173.900 174.354 -0.454 1 1 1728 . 11 1 1 A 158 158 VAL CA C 158 60.813 61.928 -1.115 1 1 1729 . 11 1 1 A 158 158 VAL CB C 158 33.385 32.716 0.669 1 1 1731 . 11 1 1 A 158 158 VAL N N 158 124.349 125.390 -1.041 1 1 1732 . 11 1 1 A 159 159 GLU H H 159 9.239 9.802 -0.563 1 1 1733 . 11 1 1 A 159 159 GLU HA H 159 5.647 5.243 0.404 1 1 1738 . 11 1 1 A 159 159 GLU C C 159 174.469 175.330 -0.861 1 1 1739 . 11 1 1 A 159 159 GLU CA C 159 54.473 54.655 -0.182 1 1 1740 . 11 1 1 A 159 159 GLU CB C 159 33.852 32.977 0.875 1 1 1742 . 11 1 1 A 159 159 GLU N N 159 125.772 129.397 -3.625 1 1 1743 . 11 1 1 A 160 160 ALA H H 160 9.250 9.513 -0.263 1 1 1744 . 11 1 1 A 160 160 ALA HA H 160 4.966 5.403 -0.437 1 1 1748 . 11 1 1 A 160 160 ALA C C 160 175.114 175.685 -0.571 1 1 1749 . 11 1 1 A 160 160 ALA CA C 160 50.644 50.096 0.548 1 1 1750 . 11 1 1 A 160 160 ALA CB C 160 23.263 23.364 -0.101 1 1 1751 . 11 1 1 A 160 160 ALA N N 160 125.092 129.559 -4.467 1 1 1752 . 11 1 1 A 161 161 MET H H 161 8.559 8.965 -0.406 1 1 1753 . 11 1 1 A 161 161 MET HA H 161 5.468 5.835 -0.367 1 1 1761 . 11 1 1 A 161 161 MET C C 161 176.265 174.877 1.388 1 1 1762 . 11 1 1 A 161 161 MET CA C 161 53.818 54.294 -0.476 1 1 1763 . 11 1 1 A 161 161 MET CB C 161 34.380 35.620 -1.240 1 1 1766 . 11 1 1 A 161 161 MET N N 161 118.699 119.469 -0.770 1 1 1767 . 11 1 1 A 162 162 VAL H H 162 9.046 8.998 0.048 1 1 1768 . 11 1 1 A 162 162 VAL HA H 162 4.841 4.905 -0.064 1 1 1776 . 11 1 1 A 162 162 VAL C C 162 174.794 175.789 -0.995 1 1 1777 . 11 1 1 A 162 162 VAL CA C 162 59.107 59.824 -0.717 1 1 1778 . 11 1 1 A 162 162 VAL CB C 162 34.018 34.219 -0.201 1 1 1781 . 11 1 1 A 162 162 VAL N N 162 116.435 118.875 -2.440 1 1 1782 . 11 1 1 A 163 163 HIS H H 163 8.793 8.725 0.068 1 1 1783 . 11 1 1 A 163 163 HIS HA H 163 4.717 5.012 -0.295 1 1 1787 . 11 1 1 A 163 163 HIS C C 163 175.460 174.316 1.144 1 1 1788 . 11 1 1 A 163 163 HIS CA C 163 58.488 57.455 1.033 1 1 1789 . 11 1 1 A 163 163 HIS CB C 163 31.185 30.984 0.201 1 1 1791 . 11 1 1 A 163 163 HIS N N 163 117.838 121.391 -3.553 1 1 1792 . 11 1 1 A 164 164 GLU H H 164 8.013 7.783 0.230 1 1 1793 . 11 1 1 A 164 164 GLU HA H 164 4.814 4.445 0.369 1 1 1797 . 11 1 1 A 164 164 GLU C C 164 176.910 176.448 0.462 1 1 1798 . 11 1 1 A 164 164 GLU CA C 164 54.355 54.859 -0.504 1 1 1799 . 11 1 1 A 164 164 GLU CB C 164 32.886 31.142 1.744 1 1 1801 . 11 1 1 A 164 164 GLU N N 164 115.943 119.036 -3.093 1 1 1802 . 11 1 1 A 165 165 LYS H H 165 9.088 8.853 0.235 1 1 1803 . 11 1 1 A 165 165 LYS HA H 165 3.942 3.968 -0.026 1 1 1809 . 11 1 1 A 165 165 LYS C C 165 179.657 177.957 1.700 1 1 1810 . 11 1 1 A 165 165 LYS CA C 165 59.888 58.829 1.059 1 1 1811 . 11 1 1 A 165 165 LYS CB C 165 32.024 32.215 -0.191 1 1 1814 . 11 1 1 A 165 165 LYS N N 165 124.120 128.102 -3.982 1 1 1815 . 11 1 1 A 166 166 ALA H H 166 8.851 7.869 0.982 1 1 1816 . 11 1 1 A 166 166 ALA HA H 166 4.251 4.115 0.136 1 1 1820 . 11 1 1 A 166 166 ALA C C 166 178.920 178.111 0.809 1 1 1821 . 11 1 1 A 166 166 ALA CA C 166 54.318 54.265 0.053 1 1 1822 . 11 1 1 A 166 166 ALA CB C 166 18.810 18.075 0.735 1 1 1823 . 11 1 1 A 166 166 ALA N N 166 120.424 121.959 -1.535 1 1 1824 . 11 1 1 A 167 167 GLU H H 167 7.871 7.946 -0.075 1 1 1825 . 11 1 1 A 167 167 GLU HA H 167 4.404 4.344 0.060 1 1 1829 . 11 1 1 A 167 167 GLU C C 167 177.368 178.065 -0.697 1 1 1830 . 11 1 1 A 167 167 GLU CA C 167 56.701 56.604 0.097 1 1 1831 . 11 1 1 A 167 167 GLU CB C 167 31.208 29.825 1.383 1 1 1833 . 11 1 1 A 167 167 GLU N N 167 114.926 115.281 -0.355 1 1 1834 . 11 1 1 A 168 168 VAL H H 168 7.812 7.551 0.261 1 1 1835 . 11 1 1 A 168 168 VAL HA H 168 3.712 3.684 0.028 1 1 1843 . 11 1 1 A 168 168 VAL CA C 168 68.705 67.910 0.795 1 1 1844 . 11 1 1 A 168 168 VAL CB C 168 29.597 29.829 -0.232 1 1 1847 . 11 1 1 A 168 168 VAL N N 168 120.188 121.744 -1.556 1 1 1848 . 11 1 1 A 169 169 PRO HA H 169 4.252 4.249 0.003 1 1 1851 . 11 1 1 A 169 169 PRO C C 169 179.563 178.733 0.830 1 1 1852 . 11 1 1 A 169 169 PRO CA C 169 67.077 66.867 0.210 1 1 1853 . 11 1 1 A 170 170 ALA H H 170 8.149 8.350 -0.201 1 1 1854 . 11 1 1 A 170 170 ALA HA H 170 4.265 4.096 0.169 1 1 1858 . 11 1 1 A 170 170 ALA C C 170 180.637 179.909 0.728 1 1 1859 . 11 1 1 A 170 170 ALA CA C 170 54.823 55.443 -0.620 1 1 1860 . 11 1 1 A 170 170 ALA CB C 170 18.518 18.253 0.265 1 1 1861 . 11 1 1 A 170 170 ALA N N 170 119.210 119.019 0.191 1 1 1862 . 11 1 1 A 171 171 ALA H H 171 7.767 8.530 -0.763 1 1 1863 . 11 1 1 A 171 171 ALA HA H 171 4.106 4.113 -0.007 1 1 1867 . 11 1 1 A 171 171 ALA C C 171 179.371 179.937 -0.566 1 1 1868 . 11 1 1 A 171 171 ALA CA C 171 55.130 54.998 0.132 1 1 1869 . 11 1 1 A 171 171 ALA CB C 171 18.291 18.298 -0.007 1 1 1870 . 11 1 1 A 171 171 ALA N N 171 122.126 120.428 1.698 1 1 1871 . 11 1 1 A 172 172 LEU H H 172 8.950 8.180 0.770 1 1 1872 . 11 1 1 A 172 172 LEU HA H 172 3.987 4.086 -0.099 1 1 1878 . 11 1 1 A 172 172 LEU C C 172 178.355 178.791 -0.436 1 1 1879 . 11 1 1 A 172 172 LEU CA C 172 57.803 57.795 0.008 1 1 1880 . 11 1 1 A 172 172 LEU CB C 172 41.667 41.708 -0.041 1 1 1882 . 11 1 1 A 172 172 LEU N N 172 118.682 119.516 -0.834 1 1 1883 . 11 1 1 A 173 173 GLU H H 173 7.886 8.455 -0.569 1 1 1884 . 11 1 1 A 173 173 GLU HA H 173 4.132 3.967 0.165 1 1 1887 . 11 1 1 A 173 173 GLU C C 173 179.556 179.592 -0.036 1 1 1888 . 11 1 1 A 173 173 GLU CA C 173 59.800 59.694 0.106 1 1 1889 . 11 1 1 A 173 173 GLU CB C 173 29.580 29.292 0.288 1 1 1891 . 11 1 1 A 173 173 GLU N N 173 117.561 119.070 -1.509 1 1 1892 . 11 1 1 A 174 174 LYS H H 174 7.532 7.599 -0.067 1 1 1893 . 11 1 1 A 174 174 LYS HA H 174 4.131 4.005 0.126 1 1 1901 . 11 1 1 A 174 174 LYS CA C 174 58.999 59.349 -0.350 1 1 1902 . 11 1 1 A 174 174 LYS CB C 174 32.041 32.451 -0.410 1 1 1906 . 11 1 1 A 174 174 LYS N N 174 119.085 119.446 -0.361 1 1 1907 . 11 1 1 A 175 175 ILE H H 175 8.479 8.155 0.324 1 1 1908 . 11 1 1 A 175 175 ILE HA H 175 3.583 3.541 0.042 1 1 1918 . 11 1 1 A 175 175 ILE C C 175 179.258 178.587 0.671 1 1 1919 . 11 1 1 A 175 175 ILE CA C 175 65.769 65.802 -0.033 1 1 1920 . 11 1 1 A 175 175 ILE CB C 175 37.876 37.900 -0.024 1 1 1923 . 11 1 1 A 175 175 ILE N N 175 118.828 120.000 -1.172 1 1 1924 . 11 1 1 A 176 176 ILE H H 176 8.928 8.175 0.753 1 1 1925 . 11 1 1 A 176 176 ILE HA H 176 3.600 3.623 -0.023 1 1 1935 . 11 1 1 A 176 176 ILE C C 176 178.827 178.007 0.820 1 1 1936 . 11 1 1 A 176 176 ILE CA C 176 65.640 64.838 0.802 1 1 1937 . 11 1 1 A 176 176 ILE CB C 176 37.451 37.267 0.184 1 1 1941 . 11 1 1 A 176 176 ILE N N 176 124.527 120.455 4.072 1 1 1942 . 11 1 1 A 177 177 THR H H 177 8.175 8.069 0.106 1 1 1943 . 11 1 1 A 177 177 THR HA H 177 3.885 3.959 -0.074 1 1 1948 . 11 1 1 A 177 177 THR C C 177 176.867 176.429 0.438 1 1 1949 . 11 1 1 A 177 177 THR CA C 177 67.199 66.153 1.046 1 1 1950 . 11 1 1 A 177 177 THR CB C 177 68.377 68.860 -0.483 1 1 1952 . 11 1 1 A 177 177 THR N N 177 119.412 118.686 0.726 1 1 1953 . 11 1 1 A 178 178 VAL H H 178 8.352 8.161 0.191 1 1 1954 . 11 1 1 A 178 178 VAL HA H 178 3.572 3.426 0.146 1 1 1962 . 11 1 1 A 178 178 VAL C C 178 177.664 177.988 -0.324 1 1 1963 . 11 1 1 A 178 178 VAL CA C 178 66.909 66.622 0.287 1 1 1964 . 11 1 1 A 178 178 VAL CB C 178 31.714 31.298 0.416 1 1 1967 . 11 1 1 A 178 178 VAL N N 178 121.168 122.034 -0.866 1 1 1968 . 11 1 1 A 179 179 SER H H 179 8.529 8.272 0.257 1 1 1969 . 11 1 1 A 179 179 SER HA H 179 3.099 3.555 -0.456 1 1 1972 . 11 1 1 A 179 179 SER C C 179 175.380 176.181 -0.801 1 1 1973 . 11 1 1 A 179 179 SER CA C 179 62.728 61.995 0.733 1 1 1974 . 11 1 1 A 179 179 SER CB C 179 62.802 62.553 0.249 1 1 1975 . 11 1 1 A 179 179 SER N N 179 115.226 115.419 -0.193 1 1 1976 . 11 1 1 A 180 180 SER H H 180 7.757 8.318 -0.561 1 1 1977 . 11 1 1 A 180 180 SER HA H 180 4.419 4.274 0.145 1 1 1980 . 11 1 1 A 180 180 SER C C 180 175.359 176.463 -1.104 1 1 1981 . 11 1 1 A 180 180 SER CA C 180 61.025 61.421 -0.396 1 1 1982 . 11 1 1 A 180 180 SER CB C 180 63.072 63.065 0.007 1 1 1983 . 11 1 1 A 180 180 SER N N 180 114.718 116.041 -1.323 1 1 1984 . 11 1 1 A 181 181 MET H H 181 7.497 8.179 -0.682 1 1 1985 . 11 1 1 A 181 181 MET HA H 181 4.283 4.308 -0.025 1 1 1993 . 11 1 1 A 181 181 MET C C 181 177.217 176.785 0.432 1 1 1994 . 11 1 1 A 181 181 MET CA C 181 57.539 57.501 0.038 1 1 1995 . 11 1 1 A 181 181 MET CB C 181 33.493 32.561 0.932 1 1 1998 . 11 1 1 A 181 181 MET N N 181 119.274 118.594 0.680 1 1 1999 . 11 1 1 A 182 182 LEU H H 182 7.163 7.702 -0.539 1 1 2000 . 11 1 1 A 182 182 LEU HA H 182 4.133 4.385 -0.252 1 1 2010 . 11 1 1 A 182 182 LEU C C 182 176.289 176.628 -0.339 1 1 2011 . 11 1 1 A 182 182 LEU CA C 182 54.750 54.727 0.023 1 1 2012 . 11 1 1 A 182 182 LEU CB C 182 43.235 42.645 0.590 1 1 2016 . 11 1 1 A 182 182 LEU N N 182 115.869 117.981 -2.112 1 1 2017 . 11 1 1 A 183 183 GLY H H 183 7.492 7.225 0.267 1 1 2018 . 11 1 1 A 183 183 GLY HA2 H 183 4.086 4.161 -0.075 1 1 2019 . 11 1 1 A 183 183 GLY HA3 H 183 4.425 4.212 0.213 1 1 2020 . 11 1 1 A 183 183 GLY C C 183 171.830 172.016 -0.186 1 1 2021 . 11 1 1 A 183 183 GLY CA C 183 46.035 45.893 0.142 1 1 2022 . 11 1 1 A 183 183 GLY N N 183 107.761 106.062 1.699 1 1 2023 . 11 1 1 A 184 184 VAL H H 184 8.099 8.650 -0.551 1 1 2024 . 11 1 1 A 184 184 VAL HA H 184 4.772 4.769 0.003 1 1 2032 . 11 1 1 A 184 184 VAL CA C 184 59.305 58.834 0.471 1 1 2033 . 11 1 1 A 184 184 VAL CB C 184 33.648 35.239 -1.591 1 1 2036 . 11 1 1 A 184 184 VAL N N 184 119.803 121.792 -1.989 1 1 2037 . 11 1 1 A 185 185 PRO HA H 185 4.442 4.688 -0.246 1 1 2042 . 11 1 1 A 185 185 PRO C C 185 175.871 176.189 -0.318 1 1 2043 . 11 1 1 A 185 185 PRO CA C 185 63.886 62.814 1.072 1 1 2044 . 11 1 1 A 185 185 PRO CB C 185 32.260 32.547 -0.287 1 1 2047 . 11 1 1 A 186 186 ALA H H 186 8.222 8.683 -0.461 1 1 2048 . 11 1 1 A 186 186 ALA HA H 186 4.569 4.931 -0.362 1 1 2052 . 11 1 1 A 186 186 ALA C C 186 177.481 177.059 0.422 1 1 2053 . 11 1 1 A 186 186 ALA CA C 186 51.823 50.736 1.087 1 1 2054 . 11 1 1 A 186 186 ALA CB C 186 20.233 22.316 -2.083 1 1 2055 . 11 1 1 A 186 186 ALA N N 186 125.663 122.285 3.378 1 1 2056 . 11 1 1 A 187 187 GLN H H 187 8.723 8.884 -0.161 1 1 2057 . 11 1 1 A 187 187 GLN HA H 187 4.420 4.397 0.023 1 1 2063 . 11 1 1 A 187 187 GLN C C 187 175.566 176.013 -0.447 1 1 2064 . 11 1 1 A 187 187 GLN CA C 187 56.051 57.237 -1.186 1 1 2065 . 11 1 1 A 187 187 GLN CB C 187 29.812 28.801 1.011 1 1 2067 . 11 1 1 A 187 187 GLN N N 187 120.742 115.927 4.815 1 1 2069 . 11 1 1 A 188 188 GLU H H 188 8.163 7.875 0.288 1 1 2070 . 11 1 1 A 188 188 GLU HA H 188 4.405 4.618 -0.213 1 1 2074 . 11 1 1 A 188 188 GLU C C 188 176.058 176.493 -0.435 1 1 2075 . 11 1 1 A 188 188 GLU CA C 188 56.158 55.741 0.417 1 1 2076 . 11 1 1 A 188 188 GLU CB C 188 31.095 31.263 -0.168 1 1 2078 . 11 1 1 A 188 188 GLU N N 188 119.177 119.045 0.132 1 1 2079 . 11 1 1 A 189 189 GLU H H 189 8.567 8.010 0.557 1 1 2080 . 11 1 1 A 189 189 GLU HA H 189 4.252 4.201 0.051 1 1 2084 . 11 1 1 A 189 189 GLU C C 189 175.703 176.367 -0.664 1 1 2085 . 11 1 1 A 189 189 GLU CA C 189 56.417 58.680 -2.263 1 1 2086 . 11 1 1 A 189 189 GLU CB C 189 29.968 29.906 0.062 1 1 2088 . 11 1 1 A 189 189 GLU N N 189 120.920 120.999 -0.079 1 1 2089 . 11 1 1 A 190 190 ALA H H 190 8.271 7.895 0.376 1 1 2090 . 11 1 1 A 190 190 ALA HA H 190 4.626 3.939 0.687 1 1 2094 . 11 1 1 A 190 190 ALA CA C 190 50.465 52.759 -2.294 1 1 2095 . 11 1 1 A 190 190 ALA CB C 190 18.451 17.505 0.946 1 1 2096 . 11 1 1 A 190 190 ALA N N 190 128.323 120.394 7.929 1 1 2097 . 11 1 1 A 191 191 PRO HA H 191 4.493 4.611 -0.118 1 1 2103 . 11 1 1 A 191 191 PRO C C 191 175.899 176.777 -0.878 1 1 2104 . 11 1 1 A 191 191 PRO CA C 191 62.044 62.274 -0.230 1 1 2105 . 11 1 1 A 191 191 PRO CB C 191 32.184 31.962 0.222 1 1 2108 . 11 1 1 A 192 192 ALA H H 192 8.610 8.388 0.222 1 1 2109 . 11 1 1 A 192 192 ALA HA H 192 4.280 4.355 -0.075 1 1 2113 . 11 1 1 A 192 192 ALA C C 192 178.282 178.155 0.127 1 1 2114 . 11 1 1 A 192 192 ALA CA C 192 51.698 52.705 -1.007 1 1 2115 . 11 1 1 A 192 192 ALA CB C 192 19.220 19.276 -0.056 1 1 2116 . 11 1 1 A 192 192 ALA N N 192 123.420 124.285 -0.865 1 1 2117 . 11 1 1 A 193 193 LYS H H 193 8.531 8.944 -0.413 1 1 2118 . 11 1 1 A 193 193 LYS HA H 193 3.294 3.902 -0.608 1 1 2126 . 11 1 1 A 193 193 LYS C C 193 177.640 178.911 -1.271 1 1 2127 . 11 1 1 A 193 193 LYS CA C 193 60.644 59.138 1.506 1 1 2128 . 11 1 1 A 193 193 LYS CB C 193 32.607 31.823 0.784 1 1 2132 . 11 1 1 A 193 193 LYS N N 193 122.851 122.222 0.629 1 1 2133 . 11 1 1 A 194 194 LEU H H 194 8.570 7.958 0.612 1 1 2134 . 11 1 1 A 194 194 LEU HA H 194 3.845 4.300 -0.455 1 1 2144 . 11 1 1 A 194 194 LEU C C 194 177.965 179.157 -1.192 1 1 2145 . 11 1 1 A 194 194 LEU CA C 194 57.611 57.812 -0.201 1 1 2146 . 11 1 1 A 194 194 LEU CB C 194 41.776 40.797 0.979 1 1 2150 . 11 1 1 A 194 194 LEU N N 194 115.801 121.426 -5.625 1 1 2151 . 11 1 1 A 195 195 MET H H 195 6.782 7.956 -1.174 1 1 2152 . 11 1 1 A 195 195 MET HA H 195 4.487 4.155 0.332 1 1 2160 . 11 1 1 A 195 195 MET C C 195 178.280 178.890 -0.610 1 1 2161 . 11 1 1 A 195 195 MET CA C 195 56.858 58.418 -1.560 1 1 2162 . 11 1 1 A 195 195 MET CB C 195 31.557 31.523 0.034 1 1 2165 . 11 1 1 A 195 195 MET N N 195 113.898 117.380 -3.482 1 1 2166 . 11 1 1 A 196 196 VAL H H 196 7.713 7.367 0.346 1 1 2167 . 11 1 1 A 196 196 VAL HA H 196 3.501 3.253 0.248 1 1 2175 . 11 1 1 A 196 196 VAL C C 196 177.624 177.418 0.206 1 1 2176 . 11 1 1 A 196 196 VAL CA C 196 66.318 65.805 0.513 1 1 2177 . 11 1 1 A 196 196 VAL CB C 196 31.380 31.179 0.201 1 1 2180 . 11 1 1 A 196 196 VAL N N 196 120.413 119.775 0.638 1 1 2181 . 11 1 1 A 197 197 TYR H H 197 7.972 8.008 -0.036 1 1 2182 . 11 1 1 A 197 197 TYR HA H 197 3.145 3.671 -0.526 1 1 2187 . 11 1 1 A 197 197 TYR C C 197 177.726 176.797 0.929 1 1 2188 . 11 1 1 A 197 197 TYR CA C 197 62.253 61.473 0.780 1 1 2189 . 11 1 1 A 197 197 TYR CB C 197 37.314 38.602 -1.288 1 1 2192 . 11 1 1 A 197 197 TYR N N 197 119.543 121.206 -1.663 1 1 2193 . 11 1 1 A 198 198 LEU H H 198 8.630 7.994 0.636 1 1 2194 . 11 1 1 A 198 198 LEU HA H 198 3.923 3.595 0.328 1 1 2203 . 11 1 1 A 198 198 LEU C C 198 178.074 178.992 -0.918 1 1 2204 . 11 1 1 A 198 198 LEU CA C 198 58.294 57.884 0.410 1 1 2205 . 11 1 1 A 198 198 LEU CB C 198 42.177 41.256 0.921 1 1 2209 . 11 1 1 A 198 198 LEU N N 198 118.430 119.665 -1.235 1 1 2210 . 11 1 1 A 199 199 GLN H H 199 8.082 7.913 0.169 1 1 2211 . 11 1 1 A 199 199 GLN HA H 199 3.054 3.582 -0.528 1 1 2216 . 11 1 1 A 199 199 GLN C C 199 176.875 178.717 -1.842 1 1 2217 . 11 1 1 A 199 199 GLN CA C 199 59.739 58.944 0.795 1 1 2218 . 11 1 1 A 199 199 GLN CB C 199 28.055 27.695 0.360 1 1 2220 . 11 1 1 A 199 199 GLN N N 199 117.926 116.781 1.145 1 1 2222 . 11 1 1 A 200 200 ARG H H 200 7.349 7.694 -0.345 1 1 2223 . 11 1 1 A 200 200 ARG HA H 200 3.798 3.927 -0.129 1 1 2231 . 11 1 1 A 200 200 ARG C C 200 178.037 177.796 0.241 1 1 2232 . 11 1 1 A 200 200 ARG CA C 200 58.260 59.120 -0.860 1 1 2233 . 11 1 1 A 200 200 ARG CB C 200 30.706 30.376 0.330 1 1 2236 . 11 1 1 A 200 200 ARG N N 200 113.772 118.879 -5.107 1 1 2238 . 11 1 1 A 201 201 PHE H H 201 8.329 7.631 0.698 1 1 2239 . 11 1 1 A 201 201 PHE HA H 201 4.630 4.517 0.113 1 1 2244 . 11 1 1 A 201 201 PHE C C 201 176.606 176.334 0.272 1 1 2245 . 11 1 1 A 201 201 PHE CA C 201 59.014 58.685 0.329 1 1 2246 . 11 1 1 A 201 201 PHE CB C 201 40.357 40.362 -0.005 1 1 2249 . 11 1 1 A 201 201 PHE N N 201 114.182 114.405 -0.223 1 1 2250 . 11 1 1 A 202 202 ARG H H 202 8.719 8.177 0.542 1 1 2251 . 11 1 1 A 202 202 ARG HA H 202 5.071 4.687 0.384 1 1 2261 . 11 1 1 A 202 202 ARG CA C 202 53.956 53.505 0.451 1 1 2262 . 11 1 1 A 202 202 ARG CB C 202 31.979 30.125 1.854 1 1 2264 . 11 1 1 A 202 202 ARG N N 202 120.115 114.428 5.687 1 1 2266 . 11 1 1 A 203 203 PRO HA H 203 4.348 4.523 -0.175 1 1 2271 . 11 1 1 A 203 203 PRO C C 203 179.736 178.869 0.867 1 1 2272 . 11 1 1 A 203 203 PRO CA C 203 65.674 65.618 0.056 1 1 2273 . 11 1 1 A 203 203 PRO CB C 203 31.717 32.039 -0.322 1 1 2275 . 11 1 1 A 204 204 LEU H H 204 8.875 7.569 1.306 1 1 2276 . 11 1 1 A 204 204 LEU HA H 204 4.291 3.966 0.325 1 1 2286 . 11 1 1 A 204 204 LEU C C 204 180.353 178.295 2.058 1 1 2287 . 11 1 1 A 204 204 LEU CA C 204 58.012 57.572 0.440 1 1 2288 . 11 1 1 A 204 204 LEU CB C 204 40.893 41.291 -0.398 1 1 2292 . 11 1 1 A 204 204 LEU N N 204 118.940 116.475 2.465 1 1 2293 . 11 1 1 A 205 205 ASP H H 205 7.541 8.430 -0.889 1 1 2294 . 11 1 1 A 205 205 ASP HA H 205 4.622 4.299 0.323 1 1 2297 . 11 1 1 A 205 205 ASP C C 205 177.602 177.754 -0.152 1 1 2298 . 11 1 1 A 205 205 ASP CA C 205 57.437 57.333 0.104 1 1 2299 . 11 1 1 A 205 205 ASP CB C 205 41.143 41.502 -0.359 1 1 2300 . 11 1 1 A 205 205 ASP N N 205 120.838 119.466 1.372 1 1 2301 . 11 1 1 A 206 206 TYR H H 206 8.237 8.256 -0.019 1 1 2302 . 11 1 1 A 206 206 TYR HA H 206 4.018 4.061 -0.043 1 1 2307 . 11 1 1 A 206 206 TYR C C 206 176.433 177.615 -1.182 1 1 2308 . 11 1 1 A 206 206 TYR CA C 206 62.148 61.581 0.567 1 1 2309 . 11 1 1 A 206 206 TYR CB C 206 38.305 38.502 -0.197 1 1 2312 . 11 1 1 A 206 206 TYR N N 206 119.475 120.269 -0.794 1 1 2313 . 11 1 1 A 207 207 GLN H H 207 8.124 8.480 -0.356 1 1 2314 . 11 1 1 A 207 207 GLN HA H 207 3.823 3.200 0.623 1 1 2320 . 11 1 1 A 207 207 GLN C C 207 178.019 178.716 -0.697 1 1 2321 . 11 1 1 A 207 207 GLN CA C 207 58.841 58.952 -0.111 1 1 2322 . 11 1 1 A 207 207 GLN CB C 207 28.208 28.259 -0.051 1 1 2324 . 11 1 1 A 207 207 GLN N N 207 115.863 117.992 -2.129 1 1 2326 . 11 1 1 A 208 208 ARG H H 208 7.522 8.051 -0.529 1 1 2327 . 11 1 1 A 208 208 ARG HA H 208 4.127 4.082 0.045 1 1 2334 . 11 1 1 A 208 208 ARG C C 208 179.278 178.589 0.689 1 1 2335 . 11 1 1 A 208 208 ARG CA C 208 59.419 58.944 0.475 1 1 2336 . 11 1 1 A 208 208 ARG CB C 208 30.182 29.791 0.391 1 1 2338 . 11 1 1 A 208 208 ARG N N 208 118.471 119.906 -1.435 1 1 2340 . 11 1 1 A 209 209 LEU H H 209 7.869 7.735 0.134 1 1 2341 . 11 1 1 A 209 209 LEU HA H 209 4.091 4.105 -0.014 1 1 2351 . 11 1 1 A 209 209 LEU C C 209 179.715 178.963 0.752 1 1 2352 . 11 1 1 A 209 209 LEU CA C 209 57.891 57.924 -0.033 1 1 2353 . 11 1 1 A 209 209 LEU CB C 209 41.338 41.632 -0.294 1 1 2356 . 11 1 1 A 209 209 LEU N N 209 119.659 119.752 -0.093 1 1 2357 . 11 1 1 A 210 210 LEU H H 210 8.034 8.550 -0.516 1 1 2358 . 11 1 1 A 210 210 LEU HA H 210 3.977 4.006 -0.029 1 1 2367 . 11 1 1 A 210 210 LEU C C 210 180.363 178.623 1.740 1 1 2368 . 11 1 1 A 210 210 LEU CA C 210 57.459 58.487 -1.028 1 1 2369 . 11 1 1 A 210 210 LEU CB C 210 41.699 41.452 0.247 1 1 2373 . 11 1 1 A 210 210 LEU N N 210 120.967 120.222 0.745 1 1 2374 . 11 1 1 A 211 211 GLU H H 211 8.174 8.727 -0.553 1 1 2375 . 11 1 1 A 211 211 GLU HA H 211 4.075 3.979 0.096 1 1 2379 . 11 1 1 A 211 211 GLU C C 211 178.499 178.809 -0.310 1 1 2380 . 11 1 1 A 211 211 GLU CA C 211 58.575 59.555 -0.980 1 1 2381 . 11 1 1 A 211 211 GLU CB C 211 29.583 29.112 0.471 1 1 2383 . 11 1 1 A 211 211 GLU N N 211 119.217 118.107 1.110 1 1 2384 . 11 1 1 A 212 212 ALA H H 212 7.723 7.733 -0.010 1 1 2385 . 11 1 1 A 212 212 ALA HA H 212 4.291 4.293 -0.002 1 1 2389 . 11 1 1 A 212 212 ALA C C 212 178.770 177.994 0.776 1 1 2390 . 11 1 1 A 212 212 ALA CA C 212 53.966 54.276 -0.310 1 1 2391 . 11 1 1 A 212 212 ALA CB C 212 19.117 18.907 0.210 1 1 2392 . 11 1 1 A 212 212 ALA N N 212 121.798 121.957 -0.159 1 1 2393 . 11 1 1 A 213 213 ALA H H 213 7.743 7.597 0.146 1 1 2394 . 11 1 1 A 213 213 ALA HA H 213 4.406 4.705 -0.299 1 1 2398 . 11 1 1 A 213 213 ALA C C 213 178.413 178.174 0.239 1 1 2399 . 11 1 1 A 213 213 ALA CA C 213 53.129 51.486 1.643 1 1 2400 . 11 1 1 A 213 213 ALA CB C 213 18.926 19.221 -0.295 1 1 2401 . 11 1 1 A 213 213 ALA N N 213 120.435 119.707 0.728 1 1 2402 . 11 1 1 A 214 214 SER H H 214 7.944 7.838 0.106 1 1 2403 . 11 1 1 A 214 214 SER HA H 214 4.559 4.195 0.364 1 1 2406 . 11 1 1 A 214 214 SER C C 214 174.958 174.205 0.753 1 1 2407 . 11 1 1 A 214 214 SER CA C 214 58.640 61.243 -2.603 1 1 2408 . 11 1 1 A 214 214 SER CB C 214 63.928 63.217 0.711 1 1 2409 . 11 1 1 A 214 214 SER N N 214 113.729 115.102 -1.373 1 1 2410 . 11 1 1 A 215 215 SER H H 215 8.255 8.017 0.238 1 1 2411 . 11 1 1 A 215 215 SER HA H 215 4.547 4.278 0.269 1 1 2413 . 11 1 1 A 215 215 SER C C 215 175.289 174.375 0.914 1 1 2414 . 11 1 1 A 215 215 SER CA C 215 58.833 59.556 -0.723 1 1 2415 . 11 1 1 A 215 215 SER CB C 215 63.847 61.286 2.561 1 1 2416 . 11 1 1 A 215 215 SER N N 215 117.674 114.679 2.995 1 1 2417 . 11 1 1 A 216 216 GLY H H 216 8.431 8.154 0.277 1 1 2418 . 11 1 1 A 216 216 GLY HA2 H 216 4.054 3.911 0.143 1 1 2419 . 11 1 1 A 216 216 GLY C C 216 174.189 173.324 0.865 1 1 2420 . 11 1 1 A 216 216 GLY CA C 216 45.412 46.563 -1.151 1 1 2421 . 11 1 1 A 216 216 GLY N N 216 110.800 107.484 3.316 1 1 2422 . 11 1 1 A 217 217 GLU H H 217 8.267 7.995 0.272 1 1 2423 . 11 1 1 A 217 217 GLU HA H 217 4.345 4.931 -0.586 1 1 2427 . 11 1 1 A 217 217 GLU C C 217 176.428 175.529 0.899 1 1 2428 . 11 1 1 A 217 217 GLU CA C 217 56.470 54.331 2.139 1 1 2429 . 11 1 1 A 217 217 GLU CB C 217 30.526 33.189 -2.663 1 1 2430 . 11 1 1 A 217 217 GLU N N 217 120.726 122.918 -2.192 1 1 2431 . 11 1 1 A 218 218 ALA H H 218 8.476 8.500 -0.024 1 1 2432 . 11 1 1 A 218 218 ALA HA H 218 4.467 4.702 -0.235 1 1 2436 . 11 1 1 A 218 218 ALA C C 218 178.015 177.413 0.602 1 1 2437 . 11 1 1 A 218 218 ALA CA C 218 52.547 51.638 0.909 1 1 2438 . 11 1 1 A 218 218 ALA CB C 218 19.242 19.831 -0.589 1 1 2439 . 11 1 1 A 218 218 ALA N N 218 125.534 126.339 -0.805 1 1 2440 . 11 1 1 A 219 219 THR H H 219 8.232 8.584 -0.352 1 1 2441 . 11 1 1 A 219 219 THR HA H 219 4.411 5.278 -0.867 1 1 2446 . 11 1 1 A 219 219 THR C C 219 175.327 174.074 1.253 1 1 2447 . 11 1 1 A 219 219 THR CA C 219 61.889 59.618 2.271 1 1 2448 . 11 1 1 A 219 219 THR CB C 219 69.939 71.119 -1.180 1 1 2449 . 11 1 1 A 219 219 THR N N 219 113.242 114.599 -1.357 1 1 2450 . 11 1 1 A 220 220 GLY H H 220 8.418 8.549 -0.131 1 1 2451 . 11 1 1 A 220 220 GLY C C 220 174.037 173.681 0.356 1 1 2452 . 11 1 1 A 220 220 GLY CA C 220 45.408 45.277 0.131 1 1 2453 . 11 1 1 A 220 220 GLY N N 220 111.031 111.610 -0.579 1 1 2454 . 11 1 1 A 221 221 ASP H H 221 8.345 7.993 0.352 1 1 2455 . 11 1 1 A 221 221 ASP HA H 221 4.700 5.162 -0.462 1 1 2458 . 11 1 1 A 221 221 ASP C C 221 176.535 174.934 1.601 1 1 2459 . 11 1 1 A 221 221 ASP CA C 221 54.402 52.746 1.656 1 1 2460 . 11 1 1 A 221 221 ASP CB C 221 41.431 43.989 -2.558 1 1 2461 . 11 1 1 A 221 221 ASP N N 221 120.795 120.755 0.040 1 1 2462 . 11 1 1 A 222 222 SER H H 222 8.353 8.588 -0.235 1 1 2463 . 11 1 1 A 222 222 SER HA H 222 4.493 5.051 -0.558 1 1 2465 . 11 1 1 A 222 222 SER C C 222 174.224 172.283 1.941 1 1 2466 . 11 1 1 A 222 222 SER CA C 222 58.427 57.219 1.208 1 1 2467 . 11 1 1 A 222 222 SER CB C 222 63.860 65.136 -1.276 1 1 2468 . 11 1 1 A 222 222 SER N N 222 116.220 116.349 -0.129 1 1 2469 . 11 1 1 A 223 223 ALA H H 223 8.381 8.660 -0.279 1 1 2470 . 11 1 1 A 223 223 ALA HA H 223 4.461 4.823 -0.362 1 1 2474 . 11 1 1 A 223 223 ALA C C 223 176.926 176.400 0.526 1 1 2475 . 11 1 1 A 223 223 ALA CA C 223 52.583 50.715 1.868 1 1 2476 . 11 1 1 A 223 223 ALA CB C 223 19.438 19.425 0.013 1 1 2477 . 11 1 1 A 223 223 ALA N N 223 126.592 126.894 -0.302 1 1 1 . 12 1 1 A 2 2 ALA HA H 2 4.274 4.459 -0.185 1 1 5 . 12 1 1 A 2 2 ALA C C 2 177.828 176.786 1.042 1 1 6 . 12 1 1 A 2 2 ALA CA C 2 52.984 50.985 1.999 1 1 7 . 12 1 1 A 2 2 ALA CB C 2 19.138 20.263 -1.125 1 1 8 . 12 1 1 A 3 3 GLN H H 3 8.463 9.141 -0.678 1 1 9 . 12 1 1 A 3 3 GLN HA H 3 4.676 4.491 0.185 1 1 12 . 12 1 1 A 3 3 GLN C C 3 176.002 177.251 -1.249 1 1 13 . 12 1 1 A 3 3 GLN CA C 3 56.258 57.381 -1.123 1 1 14 . 12 1 1 A 3 3 GLN CB C 3 30.346 31.138 -0.792 1 1 15 . 12 1 1 A 3 3 GLN N N 3 117.490 123.862 -6.372 1 1 16 . 12 1 1 A 4 4 GLY H H 4 8.099 7.779 0.320 1 1 17 . 12 1 1 A 4 4 GLY HA2 H 4 3.910 4.075 -0.165 1 1 18 . 12 1 1 A 4 4 GLY C C 4 173.332 174.442 -1.110 1 1 19 . 12 1 1 A 4 4 GLY CA C 4 45.333 46.051 -0.718 1 1 20 . 12 1 1 A 4 4 GLY N N 4 109.423 107.506 1.917 1 1 21 . 12 1 1 A 5 5 LEU H H 5 7.863 7.781 0.082 1 1 22 . 12 1 1 A 5 5 LEU HA H 5 4.561 4.805 -0.244 1 1 32 . 12 1 1 A 5 5 LEU C C 5 176.448 176.112 0.336 1 1 33 . 12 1 1 A 5 5 LEU CA C 5 54.713 54.061 0.652 1 1 34 . 12 1 1 A 5 5 LEU CB C 5 43.551 41.386 2.165 1 1 38 . 12 1 1 A 5 5 LEU N N 5 120.391 118.475 1.916 1 1 39 . 12 1 1 A 6 6 ILE H H 6 8.764 9.278 -0.514 1 1 40 . 12 1 1 A 6 6 ILE HA H 6 4.087 4.153 -0.066 1 1 49 . 12 1 1 A 6 6 ILE C C 6 174.679 175.571 -0.892 1 1 50 . 12 1 1 A 6 6 ILE CA C 6 61.279 61.693 -0.414 1 1 51 . 12 1 1 A 6 6 ILE CB C 6 39.651 37.734 1.917 1 1 54 . 12 1 1 A 6 6 ILE N N 6 123.050 126.214 -3.164 1 1 55 . 12 1 1 A 7 7 GLU H H 7 8.587 8.687 -0.100 1 1 56 . 12 1 1 A 7 7 GLU HA H 7 4.917 4.912 0.005 1 1 61 . 12 1 1 A 7 7 GLU C C 7 175.978 175.216 0.762 1 1 62 . 12 1 1 A 7 7 GLU CA C 7 56.127 56.068 0.059 1 1 63 . 12 1 1 A 7 7 GLU CB C 7 31.115 30.404 0.711 1 1 65 . 12 1 1 A 7 7 GLU N N 7 127.415 128.186 -0.771 1 1 66 . 12 1 1 A 8 8 VAL H H 8 8.986 9.015 -0.029 1 1 67 . 12 1 1 A 8 8 VAL HA H 8 4.375 4.970 -0.595 1 1 72 . 12 1 1 A 8 8 VAL C C 8 173.704 174.762 -1.058 1 1 73 . 12 1 1 A 8 8 VAL CA C 8 61.347 59.946 1.401 1 1 74 . 12 1 1 A 8 8 VAL CB C 8 33.611 34.110 -0.499 1 1 76 . 12 1 1 A 8 8 VAL N N 8 126.071 124.343 1.728 1 1 77 . 12 1 1 A 9 9 GLU H H 9 8.521 9.180 -0.659 1 1 78 . 12 1 1 A 9 9 GLU HA H 9 5.837 5.403 0.434 1 1 81 . 12 1 1 A 9 9 GLU C C 9 175.939 174.840 1.099 1 1 82 . 12 1 1 A 9 9 GLU CA C 9 54.516 54.208 0.308 1 1 83 . 12 1 1 A 9 9 GLU CB C 9 33.009 34.712 -1.703 1 1 84 . 12 1 1 A 9 9 GLU N N 9 122.857 126.415 -3.558 1 1 85 . 12 1 1 A 10 10 ARG H H 10 8.690 8.624 0.066 1 1 86 . 12 1 1 A 10 10 ARG HA H 10 4.709 4.698 0.011 1 1 94 . 12 1 1 A 10 10 ARG C C 10 174.826 173.915 0.911 1 1 95 . 12 1 1 A 10 10 ARG CA C 10 54.491 55.066 -0.575 1 1 96 . 12 1 1 A 10 10 ARG CB C 10 35.777 34.368 1.409 1 1 98 . 12 1 1 A 10 10 ARG N N 10 120.430 120.094 0.336 1 1 100 . 12 1 1 A 11 11 LYS H H 11 8.874 8.703 0.171 1 1 101 . 12 1 1 A 11 11 LYS HA H 11 5.530 5.228 0.302 1 1 107 . 12 1 1 A 11 11 LYS C C 11 176.919 175.576 1.343 1 1 108 . 12 1 1 A 11 11 LYS CA C 11 55.084 54.845 0.239 1 1 109 . 12 1 1 A 11 11 LYS CB C 11 35.435 34.659 0.776 1 1 113 . 12 1 1 A 11 11 LYS N N 11 121.087 123.707 -2.620 1 1 114 . 12 1 1 A 12 12 PHE H H 12 8.877 8.853 0.024 1 1 115 . 12 1 1 A 12 12 PHE HA H 12 5.130 5.261 -0.131 1 1 120 . 12 1 1 A 12 12 PHE C C 12 171.676 172.363 -0.687 1 1 121 . 12 1 1 A 12 12 PHE CA C 12 55.869 55.941 -0.072 1 1 122 . 12 1 1 A 12 12 PHE CB C 12 42.108 42.176 -0.068 1 1 125 . 12 1 1 A 12 12 PHE N N 12 117.486 120.173 -2.687 1 1 126 . 12 1 1 A 13 13 ALA H H 13 9.134 9.497 -0.363 1 1 127 . 12 1 1 A 13 13 ALA HA H 13 5.003 4.856 0.147 1 1 131 . 12 1 1 A 13 13 ALA CA C 13 48.340 49.038 -0.698 1 1 132 . 12 1 1 A 13 13 ALA CB C 13 19.191 20.292 -1.101 1 1 133 . 12 1 1 A 13 13 ALA N N 13 125.915 122.827 3.088 1 1 134 . 12 1 1 A 14 14 PRO HA H 14 4.620 4.806 -0.186 1 1 140 . 12 1 1 A 14 14 PRO C C 14 176.502 177.270 -0.768 1 1 141 . 12 1 1 A 14 14 PRO CA C 14 62.672 62.364 0.308 1 1 142 . 12 1 1 A 14 14 PRO CB C 14 33.119 32.403 0.716 1 1 145 . 12 1 1 A 15 15 GLY H H 15 8.721 8.614 0.107 1 1 146 . 12 1 1 A 15 15 GLY HA2 H 15 3.999 4.084 -0.085 1 1 147 . 12 1 1 A 15 15 GLY HA3 H 15 4.632 4.085 0.547 1 1 148 . 12 1 1 A 15 15 GLY CA C 15 44.411 43.986 0.425 1 1 149 . 12 1 1 A 15 15 GLY N N 15 109.863 107.898 1.965 1 1 150 . 12 1 1 A 16 16 PRO HA H 16 4.447 4.506 -0.059 1 1 155 . 12 1 1 A 16 16 PRO C C 16 177.053 176.147 0.906 1 1 156 . 12 1 1 A 16 16 PRO CA C 16 64.395 64.150 0.245 1 1 157 . 12 1 1 A 16 16 PRO CB C 16 31.993 31.656 0.337 1 1 159 . 12 1 1 A 17 17 ASP H H 17 8.550 8.432 0.118 1 1 160 . 12 1 1 A 17 17 ASP HA H 17 4.950 5.371 -0.421 1 1 163 . 12 1 1 A 17 17 ASP C C 17 176.800 176.671 0.129 1 1 164 . 12 1 1 A 17 17 ASP CA C 17 53.271 54.088 -0.817 1 1 165 . 12 1 1 A 17 17 ASP CB C 17 40.392 41.458 -1.066 1 1 166 . 12 1 1 A 17 17 ASP N N 17 116.060 118.571 -2.511 1 1 167 . 12 1 1 A 18 18 THR H H 18 7.664 7.224 0.440 1 1 168 . 12 1 1 A 18 18 THR HA H 18 4.120 3.728 0.392 1 1 174 . 12 1 1 A 18 18 THR C C 18 175.407 176.424 -1.017 1 1 175 . 12 1 1 A 18 18 THR CA C 18 68.718 67.231 1.487 1 1 176 . 12 1 1 A 18 18 THR CB C 18 69.179 68.379 0.800 1 1 178 . 12 1 1 A 18 18 THR N N 18 117.158 115.311 1.847 1 1 179 . 12 1 1 A 19 19 GLU H H 19 8.817 8.244 0.573 1 1 180 . 12 1 1 A 19 19 GLU HA H 19 3.510 3.365 0.145 1 1 184 . 12 1 1 A 19 19 GLU C C 19 178.345 179.126 -0.781 1 1 185 . 12 1 1 A 19 19 GLU CA C 19 61.237 59.555 1.682 1 1 186 . 12 1 1 A 19 19 GLU CB C 19 28.746 29.317 -0.571 1 1 188 . 12 1 1 A 19 19 GLU N N 19 118.802 118.638 0.164 1 1 189 . 12 1 1 A 20 20 GLU H H 20 7.976 8.144 -0.168 1 1 190 . 12 1 1 A 20 20 GLU HA H 20 4.036 4.106 -0.070 1 1 194 . 12 1 1 A 20 20 GLU C C 20 179.451 179.171 0.280 1 1 195 . 12 1 1 A 20 20 GLU CA C 20 59.909 59.233 0.676 1 1 196 . 12 1 1 A 20 20 GLU CB C 20 28.992 29.515 -0.523 1 1 198 . 12 1 1 A 20 20 GLU N N 20 121.130 120.462 0.668 1 1 199 . 12 1 1 A 21 21 ARG H H 21 8.199 7.323 0.876 1 1 200 . 12 1 1 A 21 21 ARG HA H 21 4.061 4.004 0.057 1 1 207 . 12 1 1 A 21 21 ARG C C 21 179.087 178.703 0.384 1 1 208 . 12 1 1 A 21 21 ARG CA C 21 58.477 58.751 -0.274 1 1 209 . 12 1 1 A 21 21 ARG CB C 21 30.101 29.716 0.385 1 1 211 . 12 1 1 A 21 21 ARG N N 21 119.897 120.434 -0.537 1 1 213 . 12 1 1 A 22 22 LEU H H 22 8.154 8.461 -0.307 1 1 214 . 12 1 1 A 22 22 LEU HA H 22 3.560 3.726 -0.166 1 1 224 . 12 1 1 A 22 22 LEU C C 22 178.461 179.301 -0.840 1 1 225 . 12 1 1 A 22 22 LEU CA C 22 58.432 57.613 0.819 1 1 226 . 12 1 1 A 22 22 LEU CB C 22 40.229 40.862 -0.633 1 1 230 . 12 1 1 A 22 22 LEU N N 22 120.012 119.769 0.243 1 1 231 . 12 1 1 A 23 23 GLN H H 23 7.621 7.942 -0.321 1 1 232 . 12 1 1 A 23 23 GLN HA H 23 4.232 4.053 0.179 1 1 238 . 12 1 1 A 23 23 GLN C C 23 180.543 178.181 2.362 1 1 239 . 12 1 1 A 23 23 GLN CA C 23 59.434 59.280 0.154 1 1 240 . 12 1 1 A 23 23 GLN CB C 23 28.749 28.406 0.343 1 1 242 . 12 1 1 A 23 23 GLN N N 23 117.823 117.865 -0.042 1 1 244 . 12 1 1 A 24 24 GLU H H 24 8.165 7.788 0.377 1 1 245 . 12 1 1 A 24 24 GLU HA H 24 4.072 4.187 -0.115 1 1 249 . 12 1 1 A 24 24 GLU C C 24 178.612 179.048 -0.436 1 1 250 . 12 1 1 A 24 24 GLU CA C 24 59.236 58.890 0.346 1 1 251 . 12 1 1 A 24 24 GLU CB C 24 29.606 29.507 0.099 1 1 253 . 12 1 1 A 24 24 GLU N N 24 122.589 119.468 3.121 1 1 254 . 12 1 1 A 25 25 LEU H H 25 7.911 7.993 -0.082 1 1 255 . 12 1 1 A 25 25 LEU HA H 25 4.214 4.085 0.129 1 1 265 . 12 1 1 A 25 25 LEU C C 25 176.745 177.411 -0.666 1 1 266 . 12 1 1 A 25 25 LEU CA C 25 55.659 55.892 -0.233 1 1 267 . 12 1 1 A 25 25 LEU CB C 25 43.109 42.707 0.402 1 1 271 . 12 1 1 A 25 25 LEU N N 25 117.882 116.889 0.993 1 1 272 . 12 1 1 A 26 26 GLY H H 26 7.776 7.922 -0.146 1 1 273 . 12 1 1 A 26 26 GLY HA2 H 26 4.337 4.005 0.332 1 1 274 . 12 1 1 A 26 26 GLY HA3 H 26 3.856 4.021 -0.165 1 1 275 . 12 1 1 A 26 26 GLY C C 26 175.456 174.866 0.590 1 1 276 . 12 1 1 A 26 26 GLY CA C 26 44.875 45.162 -0.287 1 1 277 . 12 1 1 A 26 26 GLY N N 26 104.938 105.777 -0.839 1 1 278 . 12 1 1 A 27 27 ALA H H 27 8.104 8.418 -0.314 1 1 279 . 12 1 1 A 27 27 ALA HA H 27 4.949 4.472 0.477 1 1 283 . 12 1 1 A 27 27 ALA C C 27 176.448 177.333 -0.885 1 1 284 . 12 1 1 A 27 27 ALA CA C 27 52.183 52.517 -0.334 1 1 285 . 12 1 1 A 27 27 ALA CB C 27 21.814 19.915 1.899 1 1 286 . 12 1 1 A 27 27 ALA N N 27 123.263 124.162 -0.899 1 1 287 . 12 1 1 A 28 28 THR H H 28 9.369 9.338 0.031 1 1 288 . 12 1 1 A 28 28 THR HA H 28 4.779 4.639 0.140 1 1 293 . 12 1 1 A 28 28 THR C C 28 173.725 174.017 -0.292 1 1 294 . 12 1 1 A 28 28 THR CA C 28 60.046 62.844 -2.798 1 1 295 . 12 1 1 A 28 28 THR CB C 28 70.592 69.658 0.934 1 1 297 . 12 1 1 A 28 28 THR N N 28 112.201 119.415 -7.214 1 1 298 . 12 1 1 A 29 29 LEU H H 29 8.518 8.443 0.075 1 1 299 . 12 1 1 A 29 29 LEU HA H 29 3.332 3.762 -0.430 1 1 309 . 12 1 1 A 29 29 LEU C C 29 176.202 175.757 0.445 1 1 310 . 12 1 1 A 29 29 LEU CA C 29 55.031 54.988 0.043 1 1 311 . 12 1 1 A 29 29 LEU CB C 29 40.624 41.889 -1.265 1 1 315 . 12 1 1 A 29 29 LEU N N 29 128.151 128.248 -0.097 1 1 316 . 12 1 1 A 30 30 GLU H H 30 9.269 9.171 0.098 1 1 317 . 12 1 1 A 30 30 GLU HA H 30 4.287 4.203 0.084 1 1 321 . 12 1 1 A 30 30 GLU C C 30 176.740 175.958 0.782 1 1 322 . 12 1 1 A 30 30 GLU CA C 30 57.283 58.255 -0.972 1 1 323 . 12 1 1 A 30 30 GLU CB C 30 31.045 30.674 0.371 1 1 325 . 12 1 1 A 30 30 GLU N N 30 130.123 125.510 4.613 1 1 326 . 12 1 1 A 31 31 HIS H H 31 7.341 6.851 0.490 1 1 327 . 12 1 1 A 31 31 HIS HA H 31 4.701 5.043 -0.342 1 1 331 . 12 1 1 A 31 31 HIS C C 31 172.581 173.207 -0.626 1 1 332 . 12 1 1 A 31 31 HIS CA C 31 55.876 54.560 1.316 1 1 333 . 12 1 1 A 31 31 HIS CB C 31 33.434 33.789 -0.355 1 1 334 . 12 1 1 A 31 31 HIS N N 31 113.223 114.135 -0.912 1 1 335 . 12 1 1 A 32 32 ARG H H 32 8.196 8.618 -0.422 1 1 336 . 12 1 1 A 32 32 ARG HA H 32 5.262 4.946 0.316 1 1 341 . 12 1 1 A 32 32 ARG C C 32 174.377 174.585 -0.208 1 1 342 . 12 1 1 A 32 32 ARG CA C 32 55.808 54.653 1.155 1 1 343 . 12 1 1 A 32 32 ARG CB C 32 33.340 33.752 -0.412 1 1 345 . 12 1 1 A 32 32 ARG N N 32 123.003 121.950 1.053 1 1 346 . 12 1 1 A 33 33 VAL H H 33 8.956 9.332 -0.376 1 1 347 . 12 1 1 A 33 33 VAL HA H 33 4.734 4.781 -0.047 1 1 355 . 12 1 1 A 33 33 VAL C C 33 172.821 174.941 -2.120 1 1 356 . 12 1 1 A 33 33 VAL CA C 33 60.197 60.004 0.193 1 1 357 . 12 1 1 A 33 33 VAL CB C 33 35.860 33.705 2.155 1 1 360 . 12 1 1 A 33 33 VAL N N 33 122.929 121.014 1.915 1 1 361 . 12 1 1 A 34 34 THR H H 34 8.250 8.561 -0.311 1 1 362 . 12 1 1 A 34 34 THR HA H 34 5.616 5.559 0.057 1 1 367 . 12 1 1 A 34 34 THR C C 34 173.913 173.527 0.386 1 1 368 . 12 1 1 A 34 34 THR CA C 34 60.245 60.243 0.002 1 1 369 . 12 1 1 A 34 34 THR CB C 34 71.706 70.920 0.786 1 1 371 . 12 1 1 A 34 34 THR N N 34 119.164 117.747 1.417 1 1 372 . 12 1 1 A 35 35 PHE H H 35 8.565 8.936 -0.371 1 1 373 . 12 1 1 A 35 35 PHE HA H 35 5.029 5.306 -0.277 1 1 378 . 12 1 1 A 35 35 PHE C C 35 173.193 172.142 1.051 1 1 379 . 12 1 1 A 35 35 PHE CA C 35 55.687 55.733 -0.046 1 1 380 . 12 1 1 A 35 35 PHE CB C 35 40.853 41.645 -0.792 1 1 383 . 12 1 1 A 35 35 PHE N N 35 120.244 118.669 1.575 1 1 384 . 12 1 1 A 36 36 ARG H H 36 8.869 9.373 -0.504 1 1 385 . 12 1 1 A 36 36 ARG HA H 36 4.982 5.147 -0.165 1 1 387 . 12 1 1 A 36 36 ARG C C 36 174.743 174.935 -0.192 1 1 388 . 12 1 1 A 36 36 ARG CA C 36 55.493 55.426 0.067 1 1 389 . 12 1 1 A 36 36 ARG CB C 36 32.228 32.024 0.204 1 1 390 . 12 1 1 A 36 36 ARG N N 36 123.893 120.469 3.424 1 1 391 . 12 1 1 A 37 37 ASP H H 37 8.402 9.037 -0.635 1 1 392 . 12 1 1 A 37 37 ASP HA H 37 5.462 5.299 0.163 1 1 395 . 12 1 1 A 37 37 ASP C C 37 175.177 175.086 0.091 1 1 396 . 12 1 1 A 37 37 ASP CA C 37 53.942 53.318 0.624 1 1 397 . 12 1 1 A 37 37 ASP CB C 37 45.486 42.735 2.751 1 1 398 . 12 1 1 A 37 37 ASP N N 37 127.149 122.615 4.534 1 1 399 . 12 1 1 A 38 38 THR H H 38 8.151 9.002 -0.851 1 1 400 . 12 1 1 A 38 38 THR HA H 38 4.866 5.074 -0.208 1 1 405 . 12 1 1 A 38 38 THR C C 38 172.792 172.944 -0.152 1 1 406 . 12 1 1 A 38 38 THR CA C 38 61.416 61.079 0.337 1 1 407 . 12 1 1 A 38 38 THR CB C 38 71.047 70.106 0.941 1 1 409 . 12 1 1 A 38 38 THR N N 38 115.686 116.721 -1.035 1 1 410 . 12 1 1 A 39 39 TYR H H 39 9.021 9.420 -0.399 1 1 411 . 12 1 1 A 39 39 TYR HA H 39 5.544 5.378 0.166 1 1 416 . 12 1 1 A 39 39 TYR C C 39 176.032 173.372 2.660 1 1 417 . 12 1 1 A 39 39 TYR CA C 39 57.184 56.348 0.836 1 1 418 . 12 1 1 A 39 39 TYR CB C 39 41.642 41.736 -0.094 1 1 420 . 12 1 1 A 39 39 TYR N N 39 124.579 127.409 -2.830 1 1 421 . 12 1 1 A 40 40 TYR H H 40 8.487 8.740 -0.253 1 1 422 . 12 1 1 A 40 40 TYR HA H 40 5.517 5.726 -0.209 1 1 426 . 12 1 1 A 40 40 TYR C C 40 174.108 174.413 -0.305 1 1 427 . 12 1 1 A 40 40 TYR CA C 40 56.979 56.693 0.286 1 1 428 . 12 1 1 A 40 40 TYR CB C 40 44.132 42.459 1.673 1 1 431 . 12 1 1 A 40 40 TYR N N 40 119.709 126.072 -6.363 1 1 432 . 12 1 1 A 41 41 ASP H H 41 9.341 8.773 0.568 1 1 433 . 12 1 1 A 41 41 ASP HA H 41 4.866 5.097 -0.231 1 1 436 . 12 1 1 A 41 41 ASP C C 41 177.262 174.728 2.534 1 1 437 . 12 1 1 A 41 41 ASP CA C 41 53.445 53.422 0.023 1 1 438 . 12 1 1 A 41 41 ASP CB C 41 45.347 44.683 0.664 1 1 439 . 12 1 1 A 41 41 ASP N N 41 117.995 120.784 -2.789 1 1 440 . 12 1 1 A 42 42 THR H H 42 11.574 8.680 2.894 1 1 441 . 12 1 1 A 42 42 THR HA H 42 5.206 4.515 0.691 1 1 446 . 12 1 1 A 42 42 THR C C 42 177.935 176.303 1.632 1 1 447 . 12 1 1 A 42 42 THR CA C 42 60.400 61.094 -0.694 1 1 448 . 12 1 1 A 42 42 THR CB C 42 72.114 70.897 1.217 1 1 450 . 12 1 1 A 42 42 THR N N 42 114.394 114.676 -0.282 1 1 451 . 12 1 1 A 43 43 SER H H 43 9.715 8.800 0.915 1 1 452 . 12 1 1 A 43 43 SER HA H 43 4.252 4.099 0.153 1 1 455 . 12 1 1 A 43 43 SER C C 43 175.478 174.891 0.587 1 1 456 . 12 1 1 A 43 43 SER CA C 43 61.277 61.157 0.120 1 1 457 . 12 1 1 A 43 43 SER CB C 43 62.821 62.607 0.214 1 1 458 . 12 1 1 A 43 43 SER N N 43 116.674 115.466 1.208 1 1 459 . 12 1 1 A 44 44 GLU H H 44 7.674 8.020 -0.346 1 1 460 . 12 1 1 A 44 44 GLU HA H 44 4.330 4.243 0.087 1 1 464 . 12 1 1 A 44 44 GLU C C 44 175.001 175.904 -0.903 1 1 465 . 12 1 1 A 44 44 GLU CA C 44 55.992 55.316 0.676 1 1 466 . 12 1 1 A 44 44 GLU CB C 44 29.276 28.566 0.710 1 1 468 . 12 1 1 A 44 44 GLU N N 44 117.856 117.150 0.706 1 1 469 . 12 1 1 A 45 45 LEU H H 45 8.222 7.799 0.423 1 1 470 . 12 1 1 A 45 45 LEU HA H 45 3.901 3.972 -0.071 1 1 480 . 12 1 1 A 45 45 LEU C C 45 175.209 176.498 -1.289 1 1 481 . 12 1 1 A 45 45 LEU CA C 45 55.548 56.107 -0.559 1 1 482 . 12 1 1 A 45 45 LEU CB C 45 38.458 39.774 -1.316 1 1 485 . 12 1 1 A 45 45 LEU N N 45 119.335 116.785 2.550 1 1 486 . 12 1 1 A 46 46 SER H H 46 7.347 7.963 -0.616 1 1 487 . 12 1 1 A 46 46 SER HA H 46 3.954 4.232 -0.278 1 1 489 . 12 1 1 A 46 46 SER C C 46 177.497 177.128 0.369 1 1 490 . 12 1 1 A 46 46 SER CA C 46 62.471 61.084 1.387 1 1 491 . 12 1 1 A 46 46 SER CB C 46 63.908 62.973 0.935 1 1 492 . 12 1 1 A 46 46 SER N N 46 111.433 114.074 -2.641 1 1 493 . 12 1 1 A 47 47 LEU H H 47 12.003 8.220 3.783 1 1 494 . 12 1 1 A 47 47 LEU HA H 47 3.959 4.148 -0.189 1 1 504 . 12 1 1 A 47 47 LEU C C 47 180.340 178.164 2.176 1 1 505 . 12 1 1 A 47 47 LEU CA C 47 58.879 57.952 0.927 1 1 506 . 12 1 1 A 47 47 LEU CB C 47 39.572 41.693 -2.121 1 1 510 . 12 1 1 A 47 47 LEU N N 47 124.605 123.195 1.410 1 1 511 . 12 1 1 A 48 48 MET H H 48 10.599 8.810 1.789 1 1 512 . 12 1 1 A 48 48 MET HA H 48 3.213 3.704 -0.491 1 1 520 . 12 1 1 A 48 48 MET C C 48 181.177 178.306 2.871 1 1 521 . 12 1 1 A 48 48 MET CA C 48 60.747 58.312 2.435 1 1 522 . 12 1 1 A 48 48 MET CB C 48 32.594 32.014 0.580 1 1 525 . 12 1 1 A 48 48 MET N N 48 126.254 119.001 7.253 1 1 526 . 12 1 1 A 49 49 LEU H H 49 8.731 7.776 0.955 1 1 527 . 12 1 1 A 49 49 LEU HA H 49 4.097 4.125 -0.028 1 1 536 . 12 1 1 A 49 49 LEU C C 49 178.144 177.227 0.917 1 1 537 . 12 1 1 A 49 49 LEU CA C 49 57.800 56.390 1.410 1 1 538 . 12 1 1 A 49 49 LEU CB C 49 41.379 41.772 -0.393 1 1 541 . 12 1 1 A 49 49 LEU N N 49 119.183 120.249 -1.066 1 1 542 . 12 1 1 A 50 50 SER H H 50 7.853 7.338 0.515 1 1 543 . 12 1 1 A 50 50 SER HA H 50 4.822 4.417 0.405 1 1 546 . 12 1 1 A 50 50 SER C C 50 174.539 172.551 1.988 1 1 547 . 12 1 1 A 50 50 SER CA C 50 57.811 57.976 -0.165 1 1 548 . 12 1 1 A 50 50 SER CB C 50 64.443 63.215 1.228 1 1 549 . 12 1 1 A 50 50 SER N N 50 114.594 112.400 2.194 1 1 550 . 12 1 1 A 51 51 ASP H H 51 8.264 7.549 0.715 1 1 551 . 12 1 1 A 51 51 ASP HA H 51 4.362 3.995 0.367 1 1 554 . 12 1 1 A 51 51 ASP C C 51 172.921 174.699 -1.778 1 1 555 . 12 1 1 A 51 51 ASP CA C 51 55.343 55.235 0.108 1 1 556 . 12 1 1 A 51 51 ASP CB C 51 40.583 39.407 1.176 1 1 557 . 12 1 1 A 51 51 ASP N N 51 123.003 117.586 5.417 1 1 558 . 12 1 1 A 52 52 HIS H H 52 7.869 7.440 0.429 1 1 559 . 12 1 1 A 52 52 HIS HA H 52 5.335 4.990 0.345 1 1 564 . 12 1 1 A 52 52 HIS C C 52 173.991 173.747 0.244 1 1 565 . 12 1 1 A 52 52 HIS CA C 52 55.889 54.599 1.290 1 1 566 . 12 1 1 A 52 52 HIS CB C 52 31.789 29.579 2.210 1 1 568 . 12 1 1 A 52 52 HIS N N 52 112.486 117.352 -4.866 1 1 569 . 12 1 1 A 53 53 TRP H H 53 8.165 9.564 -1.399 1 1 570 . 12 1 1 A 53 53 TRP HA H 53 4.926 5.198 -0.272 1 1 578 . 12 1 1 A 53 53 TRP C C 53 175.354 175.265 0.089 1 1 579 . 12 1 1 A 53 53 TRP CA C 53 55.364 56.361 -0.997 1 1 580 . 12 1 1 A 53 53 TRP CB C 53 30.641 29.283 1.358 1 1 585 . 12 1 1 A 53 53 TRP N N 53 117.916 126.190 -8.274 1 1 587 . 12 1 1 A 54 54 LEU H H 54 10.088 8.840 1.248 1 1 588 . 12 1 1 A 54 54 LEU HA H 54 5.497 5.408 0.089 1 1 598 . 12 1 1 A 54 54 LEU C C 54 173.337 175.211 -1.874 1 1 599 . 12 1 1 A 54 54 LEU CA C 54 54.408 54.029 0.379 1 1 600 . 12 1 1 A 54 54 LEU CB C 54 44.156 44.122 0.034 1 1 604 . 12 1 1 A 54 54 LEU N N 54 130.826 127.096 3.730 1 1 605 . 12 1 1 A 55 55 ARG H H 55 9.289 9.463 -0.174 1 1 606 . 12 1 1 A 55 55 ARG HA H 55 5.482 5.147 0.335 1 1 612 . 12 1 1 A 55 55 ARG C C 55 174.057 174.129 -0.072 1 1 613 . 12 1 1 A 55 55 ARG CA C 55 53.167 54.118 -0.951 1 1 614 . 12 1 1 A 55 55 ARG CB C 55 34.270 34.347 -0.077 1 1 616 . 12 1 1 A 55 55 ARG N N 55 125.089 124.659 0.430 1 1 618 . 12 1 1 A 56 56 GLN H H 56 9.092 9.211 -0.119 1 1 619 . 12 1 1 A 56 56 GLN HA H 56 3.991 4.638 -0.647 1 1 626 . 12 1 1 A 56 56 GLN C C 56 174.199 174.404 -0.205 1 1 627 . 12 1 1 A 56 56 GLN CA C 56 54.566 53.990 0.576 1 1 628 . 12 1 1 A 56 56 GLN CB C 56 29.643 30.782 -1.139 1 1 630 . 12 1 1 A 56 56 GLN N N 56 124.355 120.720 3.635 1 1 632 . 12 1 1 A 57 57 ARG H H 57 8.440 7.920 0.520 1 1 633 . 12 1 1 A 57 57 ARG HA H 57 5.316 4.628 0.688 1 1 639 . 12 1 1 A 57 57 ARG C C 57 176.188 176.181 0.007 1 1 640 . 12 1 1 A 57 57 ARG CA C 57 53.940 55.760 -1.820 1 1 641 . 12 1 1 A 57 57 ARG CB C 57 32.426 29.117 3.309 1 1 643 . 12 1 1 A 57 57 ARG N N 57 130.222 125.229 4.993 1 1 645 . 12 1 1 A 58 58 GLU H H 58 8.891 8.204 0.687 1 1 646 . 12 1 1 A 58 58 GLU HA H 58 3.996 4.052 -0.056 1 1 649 . 12 1 1 A 58 58 GLU CA C 58 58.364 57.018 1.346 1 1 650 . 12 1 1 A 58 58 GLU CB C 58 30.875 27.339 3.536 1 1 651 . 12 1 1 A 58 58 GLU N N 58 131.208 118.358 12.850 1 1 652 . 12 1 1 A 59 59 GLY H H 59 8.367 8.458 -0.091 1 1 653 . 12 1 1 A 59 59 GLY HA2 H 59 4.334 3.790 0.544 1 1 654 . 12 1 1 A 59 59 GLY HA3 H 59 3.743 3.855 -0.112 1 1 655 . 12 1 1 A 59 59 GLY C C 59 174.194 174.475 -0.281 1 1 656 . 12 1 1 A 59 59 GLY CA C 59 45.666 46.792 -1.126 1 1 657 . 12 1 1 A 60 60 SER H H 60 8.071 7.816 0.255 1 1 658 . 12 1 1 A 60 60 SER HA H 60 4.730 4.564 0.166 1 1 661 . 12 1 1 A 60 60 SER C C 60 173.908 174.212 -0.304 1 1 662 . 12 1 1 A 60 60 SER CA C 60 58.762 58.936 -0.174 1 1 663 . 12 1 1 A 60 60 SER CB C 60 64.497 65.031 -0.534 1 1 664 . 12 1 1 A 60 60 SER N N 60 114.636 115.834 -1.198 1 1 665 . 12 1 1 A 61 61 GLY H H 61 8.401 7.451 0.950 1 1 666 . 12 1 1 A 61 61 GLY HA2 H 61 4.560 3.950 0.610 1 1 667 . 12 1 1 A 61 61 GLY HA3 H 61 3.878 3.973 -0.095 1 1 668 . 12 1 1 A 61 61 GLY C C 61 173.526 171.814 1.712 1 1 669 . 12 1 1 A 61 61 GLY CA C 61 44.906 45.722 -0.816 1 1 670 . 12 1 1 A 61 61 GLY N N 61 109.421 106.920 2.501 1 1 671 . 12 1 1 A 62 62 TRP H H 62 8.861 8.574 0.287 1 1 672 . 12 1 1 A 62 62 TRP HA H 62 5.089 5.133 -0.044 1 1 681 . 12 1 1 A 62 62 TRP C C 62 176.168 175.981 0.187 1 1 682 . 12 1 1 A 62 62 TRP CA C 62 57.459 57.404 0.055 1 1 683 . 12 1 1 A 62 62 TRP CB C 62 32.536 31.668 0.868 1 1 689 . 12 1 1 A 62 62 TRP N N 62 122.939 121.616 1.323 1 1 691 . 12 1 1 A 63 63 GLU H H 63 9.306 9.275 0.031 1 1 692 . 12 1 1 A 63 63 GLU HA H 63 4.919 5.241 -0.322 1 1 697 . 12 1 1 A 63 63 GLU C C 63 173.770 174.856 -1.086 1 1 698 . 12 1 1 A 63 63 GLU CA C 63 55.953 55.650 0.303 1 1 699 . 12 1 1 A 63 63 GLU CB C 63 35.317 33.391 1.926 1 1 701 . 12 1 1 A 63 63 GLU N N 63 120.136 120.992 -0.856 1 1 702 . 12 1 1 A 64 64 LEU H H 64 8.998 9.023 -0.025 1 1 703 . 12 1 1 A 64 64 LEU HA H 64 5.616 5.789 -0.173 1 1 712 . 12 1 1 A 64 64 LEU C C 64 175.014 173.973 1.041 1 1 713 . 12 1 1 A 64 64 LEU CA C 64 52.945 54.194 -1.249 1 1 714 . 12 1 1 A 64 64 LEU CB C 64 46.904 45.666 1.238 1 1 717 . 12 1 1 A 64 64 LEU N N 64 127.321 126.303 1.018 1 1 718 . 12 1 1 A 65 65 LYS H H 65 9.322 9.898 -0.576 1 1 719 . 12 1 1 A 65 65 LYS HA H 65 5.347 5.506 -0.159 1 1 727 . 12 1 1 A 65 65 LYS C C 65 175.811 175.398 0.413 1 1 728 . 12 1 1 A 65 65 LYS CA C 65 55.817 55.315 0.502 1 1 729 . 12 1 1 A 65 65 LYS CB C 65 34.521 34.388 0.133 1 1 733 . 12 1 1 A 65 65 LYS N N 65 129.874 128.632 1.242 1 1 734 . 12 1 1 A 66 66 CYS H H 66 9.129 9.545 -0.416 1 1 735 . 12 1 1 A 66 66 CYS HA H 66 5.319 5.392 -0.073 1 1 738 . 12 1 1 A 66 66 CYS CA C 66 54.532 56.960 -2.428 1 1 739 . 12 1 1 A 66 66 CYS CB C 66 28.813 31.602 -2.789 1 1 740 . 12 1 1 A 66 66 CYS N N 66 121.497 124.887 -3.390 1 1 741 . 12 1 1 A 67 67 PRO HA H 67 4.439 4.378 0.061 1 1 748 . 12 1 1 A 67 67 PRO C C 67 177.297 178.145 -0.848 1 1 749 . 12 1 1 A 67 67 PRO CA C 67 63.596 63.343 0.253 1 1 750 . 12 1 1 A 67 67 PRO CB C 67 32.242 31.575 0.667 1 1 752 . 12 1 1 A 68 68 GLY H H 68 8.316 8.534 -0.218 1 1 753 . 12 1 1 A 68 68 GLY HA2 H 68 3.726 3.980 -0.254 1 1 754 . 12 1 1 A 68 68 GLY HA3 H 68 4.095 4.008 0.087 1 1 755 . 12 1 1 A 68 68 GLY C C 68 173.789 173.511 0.278 1 1 756 . 12 1 1 A 68 68 GLY CA C 68 45.227 45.378 -0.151 1 1 757 . 12 1 1 A 68 68 GLY N N 68 109.533 109.722 -0.189 1 1 758 . 12 1 1 A 69 69 VAL H H 69 8.114 7.912 0.202 1 1 759 . 12 1 1 A 69 69 VAL HA H 69 4.266 4.311 -0.045 1 1 764 . 12 1 1 A 69 69 VAL C C 69 176.299 175.688 0.611 1 1 765 . 12 1 1 A 69 69 VAL CA C 69 61.945 61.504 0.441 1 1 766 . 12 1 1 A 69 69 VAL CB C 69 33.082 33.710 -0.628 1 1 768 . 12 1 1 A 69 69 VAL N N 69 118.540 121.848 -3.308 1 1 769 . 12 1 1 A 70 70 THR H H 70 8.324 8.862 -0.538 1 1 770 . 12 1 1 A 70 70 THR HA H 70 4.373 4.466 -0.093 1 1 775 . 12 1 1 A 70 70 THR C C 70 175.204 175.798 -0.594 1 1 776 . 12 1 1 A 70 70 THR CA C 70 62.309 63.259 -0.950 1 1 777 . 12 1 1 A 70 70 THR CB C 70 69.787 68.896 0.891 1 1 779 . 12 1 1 A 70 70 THR N N 70 117.636 118.914 -1.278 1 1 780 . 12 1 1 A 71 71 GLY H H 71 8.574 7.930 0.644 1 1 781 . 12 1 1 A 71 71 GLY HA2 H 71 4.096 4.159 -0.063 1 1 782 . 12 1 1 A 71 71 GLY HA3 H 71 3.975 4.166 -0.191 1 1 783 . 12 1 1 A 71 71 GLY C C 71 174.313 174.829 -0.516 1 1 784 . 12 1 1 A 71 71 GLY CA C 71 45.545 45.879 -0.334 1 1 785 . 12 1 1 A 71 71 GLY N N 71 111.677 109.668 2.009 1 1 786 . 12 1 1 A 72 72 VAL H H 72 7.945 7.537 0.408 1 1 787 . 12 1 1 A 72 72 VAL HA H 72 4.258 4.191 0.067 1 1 795 . 12 1 1 A 72 72 VAL C C 72 176.162 175.415 0.747 1 1 796 . 12 1 1 A 72 72 VAL CA C 72 62.227 62.892 -0.665 1 1 797 . 12 1 1 A 72 72 VAL CB C 72 32.997 32.108 0.889 1 1 799 . 12 1 1 A 72 72 VAL N N 72 118.647 117.996 0.651 1 1 800 . 12 1 1 A 73 73 SER H H 73 8.498 8.052 0.446 1 1 801 . 12 1 1 A 73 73 SER HA H 73 4.617 4.197 0.420 1 1 803 . 12 1 1 A 73 73 SER C C 73 174.461 173.918 0.543 1 1 804 . 12 1 1 A 73 73 SER CA C 73 58.218 59.859 -1.641 1 1 805 . 12 1 1 A 73 73 SER CB C 73 64.061 61.365 2.696 1 1 806 . 12 1 1 A 73 73 SER N N 73 118.828 114.739 4.089 1 1 807 . 12 1 1 A 74 74 GLY H H 74 8.247 8.041 0.206 1 1 808 . 12 1 1 A 74 74 GLY HA2 H 74 4.101 4.065 0.036 1 1 809 . 12 1 1 A 74 74 GLY HA3 H 74 4.304 4.067 0.237 1 1 810 . 12 1 1 A 74 74 GLY CA C 74 44.896 44.319 0.577 1 1 811 . 12 1 1 A 74 74 GLY N N 74 111.138 108.488 2.650 1 1 812 . 12 1 1 A 75 75 PRO HA H 75 4.461 4.385 0.076 1 1 819 . 12 1 1 A 75 75 PRO C C 75 176.798 176.213 0.585 1 1 820 . 12 1 1 A 75 75 PRO CA C 75 63.466 65.207 -1.741 1 1 821 . 12 1 1 A 75 75 PRO CB C 75 31.980 31.617 0.363 1 1 824 . 12 1 1 A 76 76 HIS H H 76 8.397 7.405 0.992 1 1 825 . 12 1 1 A 76 76 HIS HA H 76 4.742 5.061 -0.319 1 1 829 . 12 1 1 A 76 76 HIS C C 76 174.282 172.946 1.336 1 1 830 . 12 1 1 A 76 76 HIS CA C 76 55.579 54.527 1.052 1 1 831 . 12 1 1 A 76 76 HIS CB C 76 30.501 31.426 -0.925 1 1 832 . 12 1 1 A 76 76 HIS N N 76 118.431 109.849 8.582 1 1 833 . 12 1 1 A 77 77 ASN H H 77 8.364 9.387 -1.023 1 1 834 . 12 1 1 A 77 77 ASN HA H 77 4.767 4.938 -0.171 1 1 839 . 12 1 1 A 77 77 ASN C C 77 174.576 175.014 -0.438 1 1 840 . 12 1 1 A 77 77 ASN CA C 77 53.139 52.165 0.974 1 1 841 . 12 1 1 A 77 77 ASN CB C 77 39.320 38.816 0.504 1 1 842 . 12 1 1 A 77 77 ASN N N 77 119.421 119.429 -0.008 1 1 844 . 12 1 1 A 78 78 GLU H H 78 8.683 8.640 0.043 1 1 845 . 12 1 1 A 78 78 GLU HA H 78 4.409 4.240 0.169 1 1 850 . 12 1 1 A 78 78 GLU C C 78 175.791 174.482 1.309 1 1 851 . 12 1 1 A 78 78 GLU CA C 78 56.359 57.182 -0.823 1 1 852 . 12 1 1 A 78 78 GLU CB C 78 30.818 29.321 1.497 1 1 854 . 12 1 1 A 78 78 GLU N N 78 122.085 126.507 -4.422 1 1 855 . 12 1 1 A 79 79 TYR H H 79 8.341 8.587 -0.246 1 1 856 . 12 1 1 A 79 79 TYR HA H 79 4.988 5.454 -0.466 1 1 861 . 12 1 1 A 79 79 TYR C C 79 175.837 175.661 0.176 1 1 862 . 12 1 1 A 79 79 TYR CA C 79 58.028 56.961 1.067 1 1 863 . 12 1 1 A 79 79 TYR CB C 79 41.672 40.174 1.498 1 1 866 . 12 1 1 A 79 79 TYR N N 79 119.452 121.686 -2.234 1 1 867 . 12 1 1 A 80 80 VAL H H 80 9.366 9.183 0.183 1 1 868 . 12 1 1 A 80 80 VAL HA H 80 4.370 4.991 -0.621 1 1 873 . 12 1 1 A 80 80 VAL C C 80 174.948 174.835 0.113 1 1 874 . 12 1 1 A 80 80 VAL CA C 80 61.190 60.015 1.175 1 1 875 . 12 1 1 A 80 80 VAL CB C 80 34.204 33.674 0.530 1 1 877 . 12 1 1 A 80 80 VAL N N 80 120.567 118.608 1.959 1 1 878 . 12 1 1 A 81 81 GLU H H 81 8.570 8.980 -0.410 1 1 879 . 12 1 1 A 81 81 GLU HA H 81 4.770 5.206 -0.436 1 1 883 . 12 1 1 A 81 81 GLU C C 81 175.491 175.698 -0.207 1 1 884 . 12 1 1 A 81 81 GLU CA C 81 55.655 55.015 0.640 1 1 885 . 12 1 1 A 81 81 GLU CB C 81 30.415 31.804 -1.389 1 1 887 . 12 1 1 A 81 81 GLU N N 81 124.248 123.692 0.556 1 1 888 . 12 1 1 A 82 82 VAL H H 82 9.189 8.948 0.241 1 1 889 . 12 1 1 A 82 82 VAL HA H 82 4.279 4.578 -0.299 1 1 894 . 12 1 1 A 82 82 VAL C C 82 176.087 176.045 0.042 1 1 895 . 12 1 1 A 82 82 VAL CA C 82 62.672 61.434 1.238 1 1 896 . 12 1 1 A 82 82 VAL CB C 82 33.121 33.168 -0.047 1 1 898 . 12 1 1 A 82 82 VAL N N 82 127.776 124.223 3.553 1 1 899 . 12 1 1 A 83 83 THR H H 83 8.590 8.626 -0.036 1 1 900 . 12 1 1 A 83 83 THR HA H 83 4.955 4.554 0.401 1 1 905 . 12 1 1 A 83 83 THR C C 83 174.688 174.985 -0.297 1 1 906 . 12 1 1 A 83 83 THR CA C 83 61.332 61.715 -0.383 1 1 907 . 12 1 1 A 83 83 THR CB C 83 70.213 70.095 0.118 1 1 909 . 12 1 1 A 83 83 THR N N 83 114.744 116.442 -1.698 1 1 910 . 12 1 1 A 84 84 SER H H 84 7.650 7.384 0.266 1 1 911 . 12 1 1 A 84 84 SER HA H 84 4.819 4.293 0.526 1 1 914 . 12 1 1 A 84 84 SER CA C 84 56.280 59.860 -3.580 1 1 915 . 12 1 1 A 84 84 SER CB C 84 63.294 63.427 -0.133 1 1 916 . 12 1 1 A 84 84 SER N N 84 118.038 118.348 -0.310 1 1 917 . 12 1 1 A 85 85 GLU H H 85 8.391 8.775 -0.384 1 1 918 . 12 1 1 A 85 85 GLU HA H 85 3.661 3.956 -0.295 1 1 923 . 12 1 1 A 85 85 GLU C C 85 177.520 178.534 -1.014 1 1 924 . 12 1 1 A 85 85 GLU CA C 85 62.429 59.676 2.753 1 1 925 . 12 1 1 A 85 85 GLU CB C 85 29.655 29.402 0.253 1 1 927 . 12 1 1 A 86 86 ALA H H 86 8.443 8.140 0.303 1 1 928 . 12 1 1 A 86 86 ALA HA H 86 4.027 4.015 0.012 1 1 932 . 12 1 1 A 86 86 ALA C C 86 180.423 179.776 0.647 1 1 933 . 12 1 1 A 86 86 ALA CA C 86 55.145 54.901 0.244 1 1 934 . 12 1 1 A 86 86 ALA CB C 86 18.165 18.183 -0.018 1 1 935 . 12 1 1 A 86 86 ALA N N 86 119.636 122.971 -3.335 1 1 936 . 12 1 1 A 87 87 ALA H H 87 7.214 7.581 -0.367 1 1 937 . 12 1 1 A 87 87 ALA HA H 87 4.244 4.045 0.199 1 1 941 . 12 1 1 A 87 87 ALA C C 87 180.354 179.813 0.541 1 1 942 . 12 1 1 A 87 87 ALA CA C 87 54.378 55.014 -0.636 1 1 943 . 12 1 1 A 87 87 ALA CB C 87 18.795 18.405 0.390 1 1 944 . 12 1 1 A 87 87 ALA N N 87 121.004 120.688 0.316 1 1 945 . 12 1 1 A 88 88 ILE H H 88 8.471 7.666 0.805 1 1 946 . 12 1 1 A 88 88 ILE HA H 88 3.360 3.613 -0.253 1 1 954 . 12 1 1 A 88 88 ILE CA C 88 66.323 64.785 1.538 1 1 955 . 12 1 1 A 88 88 ILE CB C 88 37.808 37.838 -0.030 1 1 958 . 12 1 1 A 88 88 ILE N N 88 120.743 119.077 1.666 1 1 959 . 12 1 1 A 89 89 VAL H H 89 8.343 8.620 -0.277 1 1 960 . 12 1 1 A 89 89 VAL HA H 89 3.061 3.415 -0.354 1 1 968 . 12 1 1 A 89 89 VAL C C 89 176.708 177.670 -0.962 1 1 969 . 12 1 1 A 89 89 VAL CA C 89 67.833 66.540 1.293 1 1 970 . 12 1 1 A 89 89 VAL CB C 89 31.509 31.394 0.115 1 1 973 . 12 1 1 A 89 89 VAL N N 89 118.049 120.179 -2.130 1 1 974 . 12 1 1 A 90 90 ALA H H 90 7.516 7.721 -0.205 1 1 975 . 12 1 1 A 90 90 ALA HA H 90 3.987 3.825 0.162 1 1 979 . 12 1 1 A 90 90 ALA C C 90 180.744 179.043 1.701 1 1 980 . 12 1 1 A 90 90 ALA CA C 90 55.481 55.428 0.053 1 1 981 . 12 1 1 A 90 90 ALA CB C 90 17.953 17.648 0.305 1 1 982 . 12 1 1 A 90 90 ALA N N 90 118.935 121.209 -2.274 1 1 983 . 12 1 1 A 91 91 GLN H H 91 7.886 8.197 -0.311 1 1 984 . 12 1 1 A 91 91 GLN HA H 91 4.190 3.972 0.218 1 1 991 . 12 1 1 A 91 91 GLN C C 91 178.832 178.567 0.265 1 1 992 . 12 1 1 A 91 91 GLN CA C 91 58.519 58.789 -0.270 1 1 993 . 12 1 1 A 91 91 GLN CB C 91 28.091 28.347 -0.256 1 1 995 . 12 1 1 A 91 91 GLN N N 91 117.846 118.051 -0.205 1 1 997 . 12 1 1 A 92 92 LEU H H 92 8.751 8.833 -0.082 1 1 998 . 12 1 1 A 92 92 LEU HA H 92 3.903 3.955 -0.052 1 1 1007 . 12 1 1 A 92 92 LEU C C 92 178.997 179.182 -0.185 1 1 1008 . 12 1 1 A 92 92 LEU CA C 92 58.136 58.008 0.128 1 1 1009 . 12 1 1 A 92 92 LEU CB C 92 41.576 41.645 -0.069 1 1 1013 . 12 1 1 A 92 92 LEU N N 92 119.547 119.940 -0.393 1 1 1014 . 12 1 1 A 93 93 PHE H H 93 8.648 7.993 0.655 1 1 1015 . 12 1 1 A 93 93 PHE HA H 93 4.270 4.306 -0.036 1 1 1020 . 12 1 1 A 93 93 PHE C C 93 179.283 178.765 0.518 1 1 1021 . 12 1 1 A 93 93 PHE CA C 93 59.860 60.600 -0.740 1 1 1022 . 12 1 1 A 93 93 PHE CB C 93 37.765 38.352 -0.587 1 1 1025 . 12 1 1 A 93 93 PHE N N 93 118.041 118.145 -0.104 1 1 1026 . 12 1 1 A 94 94 GLU H H 94 7.739 8.337 -0.598 1 1 1027 . 12 1 1 A 94 94 GLU HA H 94 4.110 4.122 -0.012 1 1 1031 . 12 1 1 A 94 94 GLU C C 94 178.629 178.758 -0.129 1 1 1032 . 12 1 1 A 94 94 GLU CA C 94 59.359 59.364 -0.005 1 1 1033 . 12 1 1 A 94 94 GLU CB C 94 29.589 28.644 0.945 1 1 1035 . 12 1 1 A 94 94 GLU N N 94 119.980 117.230 2.750 1 1 1036 . 12 1 1 A 95 95 LEU H H 95 7.999 7.997 0.002 1 1 1037 . 12 1 1 A 95 95 LEU HA H 95 4.139 3.991 0.148 1 1 1047 . 12 1 1 A 95 95 LEU C C 95 178.965 178.064 0.901 1 1 1048 . 12 1 1 A 95 95 LEU CA C 95 57.557 57.755 -0.198 1 1 1049 . 12 1 1 A 95 95 LEU CB C 95 43.443 41.487 1.956 1 1 1053 . 12 1 1 A 95 95 LEU N N 95 118.398 121.575 -3.177 1 1 1054 . 12 1 1 A 96 96 LEU H H 96 8.363 7.952 0.411 1 1 1055 . 12 1 1 A 96 96 LEU HA H 96 4.503 4.353 0.150 1 1 1061 . 12 1 1 A 96 96 LEU C C 96 177.932 176.873 1.059 1 1 1062 . 12 1 1 A 96 96 LEU CA C 96 54.700 54.728 -0.028 1 1 1063 . 12 1 1 A 96 96 LEU CB C 96 43.048 42.133 0.915 1 1 1065 . 12 1 1 A 96 96 LEU N N 96 114.720 116.791 -2.071 1 1 1066 . 12 1 1 A 97 97 GLY H H 97 7.810 7.729 0.081 1 1 1067 . 12 1 1 A 97 97 GLY HA2 H 97 3.963 3.897 0.066 1 1 1068 . 12 1 1 A 97 97 GLY C C 97 173.535 174.350 -0.815 1 1 1069 . 12 1 1 A 97 97 GLY CA C 97 45.667 46.717 -1.050 1 1 1070 . 12 1 1 A 97 97 GLY N N 97 109.511 108.694 0.817 1 1 1071 . 12 1 1 A 98 98 SER H H 98 8.131 7.652 0.479 1 1 1072 . 12 1 1 A 98 98 SER HA H 98 4.225 4.339 -0.114 1 1 1075 . 12 1 1 A 98 98 SER C C 98 174.974 174.804 0.170 1 1 1076 . 12 1 1 A 98 98 SER CA C 98 57.960 59.850 -1.890 1 1 1077 . 12 1 1 A 98 98 SER CB C 98 63.997 64.033 -0.036 1 1 1078 . 12 1 1 A 98 98 SER N N 98 113.405 115.147 -1.742 1 1 1079 . 12 1 1 A 99 99 GLY H H 99 8.052 8.210 -0.158 1 1 1080 . 12 1 1 A 99 99 GLY HA2 H 99 3.998 3.915 0.083 1 1 1081 . 12 1 1 A 99 99 GLY HA3 H 99 3.778 3.950 -0.172 1 1 1082 . 12 1 1 A 99 99 GLY C C 99 174.033 174.118 -0.085 1 1 1083 . 12 1 1 A 99 99 GLY CA C 99 45.123 45.415 -0.292 1 1 1084 . 12 1 1 A 99 99 GLY N N 99 111.534 108.653 2.881 1 1 1085 . 12 1 1 A 100 100 GLU H H 100 8.177 7.895 0.282 1 1 1086 . 12 1 1 A 100 100 GLU HA H 100 4.201 4.591 -0.390 1 1 1091 . 12 1 1 A 100 100 GLU C C 100 175.830 176.644 -0.814 1 1 1092 . 12 1 1 A 100 100 GLU CA C 100 56.442 55.619 0.823 1 1 1093 . 12 1 1 A 100 100 GLU CB C 100 30.428 31.151 -0.723 1 1 1095 . 12 1 1 A 100 100 GLU N N 100 120.463 120.354 0.109 1 1 1096 . 12 1 1 A 101 101 GLN H H 101 8.161 8.453 -0.292 1 1 1097 . 12 1 1 A 101 101 GLN HA H 101 4.098 4.219 -0.121 1 1 1103 . 12 1 1 A 101 101 GLN C C 101 175.412 175.366 0.046 1 1 1104 . 12 1 1 A 101 101 GLN CA C 101 55.632 55.749 -0.117 1 1 1105 . 12 1 1 A 101 101 GLN CB C 101 29.569 29.009 0.560 1 1 1107 . 12 1 1 A 101 101 GLN N N 101 120.014 121.109 -1.095 1 1 1109 . 12 1 1 A 102 102 LYS H H 102 8.235 8.558 -0.323 1 1 1110 . 12 1 1 A 102 102 LYS HA H 102 4.387 4.232 0.155 1 1 1117 . 12 1 1 A 102 102 LYS CA C 102 54.116 53.182 0.934 1 1 1118 . 12 1 1 A 102 102 LYS CB C 102 32.478 32.363 0.115 1 1 1122 . 12 1 1 A 102 102 LYS N N 102 123.399 122.011 1.388 1 1 1123 . 12 1 1 A 103 103 PRO HA H 103 4.498 4.569 -0.071 1 1 1129 . 12 1 1 A 103 103 PRO C C 103 175.473 177.172 -1.699 1 1 1130 . 12 1 1 A 103 103 PRO CA C 103 62.802 65.937 -3.135 1 1 1131 . 12 1 1 A 103 103 PRO CB C 103 32.124 31.507 0.617 1 1 1134 . 12 1 1 A 104 104 ALA H H 104 8.017 7.243 0.774 1 1 1135 . 12 1 1 A 104 104 ALA HA H 104 4.318 4.365 -0.047 1 1 1139 . 12 1 1 A 104 104 ALA C C 104 176.717 176.861 -0.144 1 1 1140 . 12 1 1 A 104 104 ALA CA C 104 52.194 53.240 -1.046 1 1 1141 . 12 1 1 A 104 104 ALA CB C 104 20.113 20.367 -0.254 1 1 1142 . 12 1 1 A 104 104 ALA N N 104 122.093 117.715 4.378 1 1 1143 . 12 1 1 A 105 105 GLY H H 105 7.678 8.255 -0.577 1 1 1144 . 12 1 1 A 105 105 GLY HA2 H 105 3.851 4.092 -0.241 1 1 1145 . 12 1 1 A 105 105 GLY HA3 H 105 4.053 4.117 -0.064 1 1 1146 . 12 1 1 A 105 105 GLY C C 105 172.990 174.865 -1.875 1 1 1147 . 12 1 1 A 105 105 GLY CA C 105 44.241 43.558 0.683 1 1 1148 . 12 1 1 A 105 105 GLY N N 105 105.234 104.136 1.098 1 1 1149 . 12 1 1 A 106 106 VAL H H 106 8.409 8.793 -0.384 1 1 1150 . 12 1 1 A 106 106 VAL HA H 106 2.829 3.325 -0.496 1 1 1158 . 12 1 1 A 106 106 VAL C C 106 177.822 177.204 0.618 1 1 1159 . 12 1 1 A 106 106 VAL CA C 106 65.522 65.483 0.039 1 1 1160 . 12 1 1 A 106 106 VAL CB C 106 30.701 30.564 0.137 1 1 1163 . 12 1 1 A 106 106 VAL N N 106 119.215 119.170 0.045 1 1 1164 . 12 1 1 A 107 107 ALA H H 107 8.707 8.464 0.243 1 1 1165 . 12 1 1 A 107 107 ALA HA H 107 3.730 3.879 -0.149 1 1 1169 . 12 1 1 A 107 107 ALA C C 107 179.661 179.798 -0.137 1 1 1170 . 12 1 1 A 107 107 ALA CA C 107 54.995 55.568 -0.573 1 1 1171 . 12 1 1 A 107 107 ALA CB C 107 17.705 17.826 -0.121 1 1 1172 . 12 1 1 A 107 107 ALA N N 107 118.672 122.033 -3.361 1 1 1173 . 12 1 1 A 108 108 ALA H H 108 7.388 7.824 -0.436 1 1 1174 . 12 1 1 A 108 108 ALA HA H 108 4.259 4.051 0.208 1 1 1178 . 12 1 1 A 108 108 ALA C C 108 179.318 179.392 -0.074 1 1 1179 . 12 1 1 A 108 108 ALA CA C 108 53.481 55.057 -1.576 1 1 1180 . 12 1 1 A 108 108 ALA CB C 108 19.367 18.393 0.974 1 1 1181 . 12 1 1 A 108 108 ALA N N 108 116.635 120.915 -4.280 1 1 1182 . 12 1 1 A 109 109 VAL H H 109 7.689 7.347 0.342 1 1 1183 . 12 1 1 A 109 109 VAL HA H 109 4.532 3.897 0.635 1 1 1191 . 12 1 1 A 109 109 VAL C C 109 176.055 178.000 -1.945 1 1 1192 . 12 1 1 A 109 109 VAL CA C 109 61.452 65.641 -4.189 1 1 1193 . 12 1 1 A 109 109 VAL CB C 109 32.728 31.343 1.385 1 1 1196 . 12 1 1 A 109 109 VAL N N 109 112.851 117.042 -4.191 1 1 1197 . 12 1 1 A 110 110 LEU H H 110 7.099 8.134 -1.035 1 1 1198 . 12 1 1 A 110 110 LEU HA H 110 3.723 3.773 -0.050 1 1 1208 . 12 1 1 A 110 110 LEU C C 110 179.040 178.830 0.210 1 1 1209 . 12 1 1 A 110 110 LEU CA C 110 58.825 57.808 1.017 1 1 1210 . 12 1 1 A 110 110 LEU CB C 110 41.242 41.787 -0.545 1 1 1214 . 12 1 1 A 110 110 LEU N N 110 119.829 124.946 -5.117 1 1 1215 . 12 1 1 A 111 111 GLY H H 111 8.435 7.789 0.646 1 1 1216 . 12 1 1 A 111 111 GLY HA2 H 111 3.970 3.833 0.137 1 1 1217 . 12 1 1 A 111 111 GLY HA3 H 111 3.885 3.835 0.050 1 1 1218 . 12 1 1 A 111 111 GLY C C 111 178.031 176.315 1.716 1 1 1219 . 12 1 1 A 111 111 GLY CA C 111 46.961 47.526 -0.565 1 1 1220 . 12 1 1 A 111 111 GLY N N 111 104.089 106.577 -2.488 1 1 1221 . 12 1 1 A 112 112 SER H H 112 8.343 8.360 -0.017 1 1 1222 . 12 1 1 A 112 112 SER HA H 112 4.266 4.218 0.048 1 1 1224 . 12 1 1 A 112 112 SER C C 112 175.885 174.751 1.134 1 1 1225 . 12 1 1 A 112 112 SER CA C 112 61.304 62.433 -1.129 1 1 1226 . 12 1 1 A 112 112 SER CB C 112 62.901 63.056 -0.155 1 1 1227 . 12 1 1 A 112 112 SER N N 112 119.497 119.405 0.092 1 1 1228 . 12 1 1 A 113 113 LEU H H 113 7.667 7.359 0.308 1 1 1229 . 12 1 1 A 113 113 LEU HA H 113 4.343 4.210 0.133 1 1 1238 . 12 1 1 A 113 113 LEU C C 113 174.760 176.128 -1.368 1 1 1239 . 12 1 1 A 113 113 LEU CA C 113 54.228 54.388 -0.160 1 1 1240 . 12 1 1 A 113 113 LEU CB C 113 41.467 42.035 -0.568 1 1 1244 . 12 1 1 A 113 113 LEU N N 113 118.843 117.642 1.201 1 1 1245 . 12 1 1 A 114 114 LYS H H 114 7.685 7.853 -0.168 1 1 1246 . 12 1 1 A 114 114 LYS HA H 114 3.958 3.882 0.076 1 1 1250 . 12 1 1 A 114 114 LYS C C 114 177.557 175.915 1.642 1 1 1251 . 12 1 1 A 114 114 LYS CA C 114 56.935 57.426 -0.491 1 1 1252 . 12 1 1 A 114 114 LYS CB C 114 28.898 29.413 -0.515 1 1 1254 . 12 1 1 A 114 114 LYS N N 114 114.072 116.396 -2.324 1 1 1255 . 12 1 1 A 115 115 LEU H H 115 8.329 7.946 0.383 1 1 1256 . 12 1 1 A 115 115 LEU HA H 115 4.315 4.265 0.050 1 1 1265 . 12 1 1 A 115 115 LEU C C 115 175.988 177.031 -1.043 1 1 1266 . 12 1 1 A 115 115 LEU CA C 115 54.310 55.781 -1.471 1 1 1267 . 12 1 1 A 115 115 LEU CB C 115 44.163 42.452 1.711 1 1 1270 . 12 1 1 A 115 115 LEU N N 115 117.951 120.054 -2.103 1 1 1271 . 12 1 1 A 116 116 GLN H H 116 9.100 8.443 0.657 1 1 1272 . 12 1 1 A 116 116 GLN HA H 116 4.898 5.109 -0.211 1 1 1279 . 12 1 1 A 116 116 GLN CA C 116 53.467 54.925 -1.458 1 1 1280 . 12 1 1 A 116 116 GLN CB C 116 32.730 30.825 1.905 1 1 1282 . 12 1 1 A 116 116 GLN N N 116 119.994 122.154 -2.160 1 1 1284 . 12 1 1 A 117 117 GLU H H 117 8.849 8.680 0.169 1 1 1285 . 12 1 1 A 117 117 GLU HA H 117 3.707 4.411 -0.704 1 1 1290 . 12 1 1 A 117 117 GLU C C 117 177.303 177.103 0.200 1 1 1291 . 12 1 1 A 117 117 GLU CA C 117 57.233 56.207 1.026 1 1 1292 . 12 1 1 A 117 117 GLU CB C 117 29.634 29.304 0.330 1 1 1294 . 12 1 1 A 117 117 GLU N N 117 121.487 123.794 -2.307 1 1 1295 . 12 1 1 A 118 118 VAL H H 118 8.983 8.855 0.128 1 1 1296 . 12 1 1 A 118 118 VAL HA H 118 4.360 4.110 0.250 1 1 1304 . 12 1 1 A 118 118 VAL C C 118 174.171 175.334 -1.163 1 1 1305 . 12 1 1 A 118 118 VAL CA C 118 61.772 63.830 -2.058 1 1 1306 . 12 1 1 A 118 118 VAL CB C 118 34.095 32.785 1.310 1 1 1309 . 12 1 1 A 118 118 VAL N N 118 122.933 128.480 -5.547 1 1 1310 . 12 1 1 A 119 119 ALA H H 119 7.023 7.182 -0.159 1 1 1311 . 12 1 1 A 119 119 ALA HA H 119 4.378 4.435 -0.057 1 1 1315 . 12 1 1 A 119 119 ALA C C 119 175.493 175.088 0.405 1 1 1316 . 12 1 1 A 119 119 ALA CA C 119 51.956 51.034 0.922 1 1 1317 . 12 1 1 A 119 119 ALA CB C 119 23.957 22.021 1.936 1 1 1318 . 12 1 1 A 119 119 ALA N N 119 117.379 121.603 -4.224 1 1 1319 . 12 1 1 A 120 120 SER H H 120 6.999 8.617 -1.618 1 1 1320 . 12 1 1 A 120 120 SER HA H 120 5.208 6.030 -0.822 1 1 1323 . 12 1 1 A 120 120 SER C C 120 173.082 172.717 0.365 1 1 1324 . 12 1 1 A 120 120 SER CA C 120 56.754 57.335 -0.581 1 1 1325 . 12 1 1 A 120 120 SER CB C 120 64.605 65.384 -0.779 1 1 1326 . 12 1 1 A 120 120 SER N N 120 113.743 115.447 -1.704 1 1 1327 . 12 1 1 A 121 121 PHE H H 121 8.244 8.874 -0.630 1 1 1328 . 12 1 1 A 121 121 PHE HA H 121 5.177 5.065 0.112 1 1 1333 . 12 1 1 A 121 121 PHE C C 121 173.569 172.538 1.031 1 1 1334 . 12 1 1 A 121 121 PHE CA C 121 55.555 55.592 -0.037 1 1 1335 . 12 1 1 A 121 121 PHE CB C 121 40.959 41.245 -0.286 1 1 1338 . 12 1 1 A 121 121 PHE N N 121 120.358 121.440 -1.082 1 1 1339 . 12 1 1 A 122 122 ILE H H 122 8.907 8.870 0.037 1 1 1340 . 12 1 1 A 122 122 ILE HA H 122 4.682 4.372 0.310 1 1 1348 . 12 1 1 A 122 122 ILE C C 122 176.925 175.602 1.323 1 1 1349 . 12 1 1 A 122 122 ILE CA C 122 60.740 61.361 -0.621 1 1 1350 . 12 1 1 A 122 122 ILE CB C 122 39.497 37.831 1.666 1 1 1353 . 12 1 1 A 122 122 ILE N N 122 121.282 121.485 -0.203 1 1 1354 . 12 1 1 A 123 123 THR H H 123 9.022 9.426 -0.404 1 1 1355 . 12 1 1 A 123 123 THR HA H 123 5.039 4.831 0.208 1 1 1360 . 12 1 1 A 123 123 THR C C 123 173.531 173.948 -0.417 1 1 1361 . 12 1 1 A 123 123 THR CA C 123 62.266 62.070 0.196 1 1 1362 . 12 1 1 A 123 123 THR CB C 123 70.677 69.206 1.471 1 1 1364 . 12 1 1 A 123 123 THR N N 123 128.965 123.392 5.573 1 1 1365 . 12 1 1 A 124 124 THR H H 124 8.961 9.614 -0.653 1 1 1366 . 12 1 1 A 124 124 THR HA H 124 5.001 5.001 0.000 1 1 1371 . 12 1 1 A 124 124 THR C C 124 173.468 172.518 0.950 1 1 1372 . 12 1 1 A 124 124 THR CA C 124 62.109 61.786 0.323 1 1 1373 . 12 1 1 A 124 124 THR CB C 124 70.450 69.561 0.889 1 1 1375 . 12 1 1 A 124 124 THR N N 124 122.176 124.020 -1.844 1 1 1376 . 12 1 1 A 125 125 ARG H H 125 9.386 9.189 0.197 1 1 1377 . 12 1 1 A 125 125 ARG HA H 125 5.764 5.388 0.376 1 1 1384 . 12 1 1 A 125 125 ARG C C 125 175.713 174.387 1.326 1 1 1385 . 12 1 1 A 125 125 ARG CA C 125 53.991 54.339 -0.348 1 1 1386 . 12 1 1 A 125 125 ARG CB C 125 33.557 33.158 0.399 1 1 1389 . 12 1 1 A 125 125 ARG N N 125 130.004 128.739 1.265 1 1 1390 . 12 1 1 A 126 126 SER H H 126 9.172 9.427 -0.255 1 1 1391 . 12 1 1 A 126 126 SER HA H 126 5.390 5.121 0.269 1 1 1394 . 12 1 1 A 126 126 SER C C 126 172.359 172.407 -0.048 1 1 1395 . 12 1 1 A 126 126 SER CA C 126 56.934 56.568 0.366 1 1 1396 . 12 1 1 A 126 126 SER CB C 126 65.827 65.010 0.817 1 1 1397 . 12 1 1 A 126 126 SER N N 126 119.906 122.366 -2.460 1 1 1398 . 12 1 1 A 127 127 SER H H 127 8.591 8.829 -0.238 1 1 1399 . 12 1 1 A 127 127 SER HA H 127 5.739 5.269 0.470 1 1 1401 . 12 1 1 A 127 127 SER C C 127 173.283 173.407 -0.124 1 1 1402 . 12 1 1 A 127 127 SER CA C 127 57.354 57.018 0.336 1 1 1403 . 12 1 1 A 127 127 SER CB C 127 65.412 64.657 0.755 1 1 1404 . 12 1 1 A 127 127 SER N N 127 117.914 122.780 -4.866 1 1 1405 . 12 1 1 A 128 128 TRP H H 128 9.866 9.562 0.304 1 1 1406 . 12 1 1 A 128 128 TRP HA H 128 5.560 5.593 -0.033 1 1 1415 . 12 1 1 A 128 128 TRP C C 128 175.828 175.437 0.391 1 1 1416 . 12 1 1 A 128 128 TRP CA C 128 55.852 55.775 0.077 1 1 1417 . 12 1 1 A 128 128 TRP CB C 128 32.524 34.031 -1.507 1 1 1423 . 12 1 1 A 128 128 TRP N N 128 127.978 126.971 1.007 1 1 1425 . 12 1 1 A 129 129 LYS H H 129 9.424 8.996 0.428 1 1 1426 . 12 1 1 A 129 129 LYS HA H 129 5.388 5.268 0.120 1 1 1433 . 12 1 1 A 129 129 LYS C C 129 175.254 174.892 0.362 1 1 1434 . 12 1 1 A 129 129 LYS CA C 129 54.410 54.711 -0.301 1 1 1435 . 12 1 1 A 129 129 LYS CB C 129 35.734 36.631 -0.897 1 1 1439 . 12 1 1 A 129 129 LYS N N 129 121.784 120.268 1.516 1 1 1440 . 12 1 1 A 130 130 LEU H H 130 8.933 9.592 -0.659 1 1 1441 . 12 1 1 A 130 130 LEU HA H 130 4.859 4.976 -0.117 1 1 1447 . 12 1 1 A 130 130 LEU C C 130 173.893 174.446 -0.553 1 1 1448 . 12 1 1 A 130 130 LEU CA C 130 53.848 54.014 -0.166 1 1 1449 . 12 1 1 A 130 130 LEU CB C 130 46.125 45.530 0.595 1 1 1451 . 12 1 1 A 130 130 LEU N N 130 124.543 124.326 0.217 1 1 1452 . 12 1 1 A 131 131 ALA H H 131 8.816 8.804 0.012 1 1 1453 . 12 1 1 A 131 131 ALA HA H 131 4.776 4.769 0.007 1 1 1457 . 12 1 1 A 131 131 ALA C C 131 176.662 176.354 0.308 1 1 1458 . 12 1 1 A 131 131 ALA CA C 131 51.407 51.124 0.283 1 1 1459 . 12 1 1 A 131 131 ALA CB C 131 19.354 19.786 -0.432 1 1 1460 . 12 1 1 A 131 131 ALA N N 131 131.102 130.337 0.765 1 1 1461 . 12 1 1 A 132 132 LEU H H 132 8.487 8.492 -0.005 1 1 1462 . 12 1 1 A 132 132 LEU HA H 132 4.470 4.601 -0.131 1 1 1470 . 12 1 1 A 132 132 LEU C C 132 176.873 176.737 0.136 1 1 1471 . 12 1 1 A 132 132 LEU CA C 132 54.590 54.790 -0.200 1 1 1472 . 12 1 1 A 132 132 LEU CB C 132 42.974 42.084 0.890 1 1 1475 . 12 1 1 A 132 132 LEU N N 132 123.724 124.633 -0.909 1 1 1476 . 12 1 1 A 133 133 SER H H 133 8.448 8.385 0.063 1 1 1477 . 12 1 1 A 133 133 SER HA H 133 4.560 5.338 -0.778 1 1 1479 . 12 1 1 A 133 133 SER C C 133 176.043 174.646 1.397 1 1 1480 . 12 1 1 A 133 133 SER CA C 133 58.460 57.421 1.039 1 1 1481 . 12 1 1 A 133 133 SER CB C 133 63.985 66.050 -2.065 1 1 1482 . 12 1 1 A 133 133 SER N N 133 115.880 117.400 -1.520 1 1 1483 . 12 1 1 A 134 134 GLY H H 134 8.232 9.421 -1.189 1 1 1484 . 12 1 1 A 134 134 GLY HA2 H 134 4.147 3.781 0.366 1 1 1485 . 12 1 1 A 134 134 GLY HA3 H 134 4.045 3.789 0.256 1 1 1486 . 12 1 1 A 134 134 GLY C C 134 174.013 174.517 -0.504 1 1 1487 . 12 1 1 A 134 134 GLY CA C 134 45.337 47.465 -2.128 1 1 1488 . 12 1 1 A 134 134 GLY N N 134 109.970 114.596 -4.626 1 1 1489 . 12 1 1 A 135 135 ALA H H 135 8.424 7.881 0.543 1 1 1490 . 12 1 1 A 135 135 ALA HA H 135 4.436 4.485 -0.049 1 1 1494 . 12 1 1 A 135 135 ALA C C 135 177.537 177.644 -0.107 1 1 1495 . 12 1 1 A 135 135 ALA CA C 135 52.721 52.954 -0.233 1 1 1496 . 12 1 1 A 135 135 ALA CB C 135 19.265 20.059 -0.794 1 1 1497 . 12 1 1 A 135 135 ALA N N 135 124.118 118.914 5.204 1 1 1498 . 12 1 1 A 136 136 HIS H H 136 8.466 7.929 0.537 1 1 1499 . 12 1 1 A 136 136 HIS HA H 136 4.379 4.903 -0.524 1 1 1500 . 12 1 1 A 136 136 HIS C C 136 176.259 175.113 1.146 1 1 1501 . 12 1 1 A 136 136 HIS CA C 136 56.082 55.742 0.340 1 1 1502 . 12 1 1 A 136 136 HIS CB C 136 29.619 30.848 -1.229 1 1 1503 . 12 1 1 A 136 136 HIS N N 136 119.493 111.283 8.210 1 1 1504 . 12 1 1 A 137 137 GLY H H 137 8.431 8.172 0.259 1 1 1505 . 12 1 1 A 137 137 GLY HA2 H 137 4.151 4.015 0.136 1 1 1506 . 12 1 1 A 137 137 GLY HA3 H 137 3.893 4.031 -0.138 1 1 1507 . 12 1 1 A 137 137 GLY C C 137 174.039 173.015 1.024 1 1 1508 . 12 1 1 A 137 137 GLY CA C 137 45.372 44.582 0.790 1 1 1509 . 12 1 1 A 137 137 GLY N N 137 110.442 107.889 2.553 1 1 1510 . 12 1 1 A 138 138 GLN H H 138 8.416 8.336 0.080 1 1 1511 . 12 1 1 A 138 138 GLN HA H 138 4.455 4.538 -0.083 1 1 1515 . 12 1 1 A 138 138 GLN C C 138 175.889 175.976 -0.087 1 1 1516 . 12 1 1 A 138 138 GLN CA C 138 55.866 56.030 -0.164 1 1 1517 . 12 1 1 A 138 138 GLN CB C 138 29.639 29.144 0.495 1 1 1518 . 12 1 1 A 138 138 GLN N N 138 119.401 118.846 0.555 1 1 1519 . 12 1 1 A 139 139 GLU H H 139 8.446 8.664 -0.218 1 1 1520 . 12 1 1 A 139 139 GLU HA H 139 4.658 4.870 -0.212 1 1 1524 . 12 1 1 A 139 139 GLU CA C 139 54.589 53.289 1.300 1 1 1525 . 12 1 1 A 139 139 GLU CB C 139 29.733 33.590 -3.857 1 1 1527 . 12 1 1 A 139 139 GLU N N 139 123.136 123.912 -0.776 1 1 1528 . 12 1 1 A 140 140 PRO HA H 140 4.537 4.860 -0.323 1 1 1533 . 12 1 1 A 140 140 PRO C C 140 176.119 176.123 -0.004 1 1 1534 . 12 1 1 A 140 140 PRO CA C 140 63.220 62.434 0.786 1 1 1535 . 12 1 1 A 140 140 PRO CB C 140 31.936 32.242 -0.306 1 1 1538 . 12 1 1 A 141 141 GLN H H 141 8.506 8.629 -0.123 1 1 1539 . 12 1 1 A 141 141 GLN HA H 141 4.650 4.818 -0.168 1 1 1546 . 12 1 1 A 141 141 GLN C C 141 175.811 175.661 0.150 1 1 1547 . 12 1 1 A 141 141 GLN CA C 141 55.912 55.514 0.398 1 1 1548 . 12 1 1 A 141 141 GLN CB C 141 30.241 29.836 0.405 1 1 1550 . 12 1 1 A 141 141 GLN N N 141 120.422 121.435 -1.013 1 1 1551 . 12 1 1 A 142 142 LEU H H 142 8.842 9.162 -0.320 1 1 1552 . 12 1 1 A 142 142 LEU HA H 142 5.277 5.321 -0.044 1 1 1562 . 12 1 1 A 142 142 LEU C C 142 176.839 175.452 1.387 1 1 1563 . 12 1 1 A 142 142 LEU CA C 142 53.927 52.788 1.139 1 1 1564 . 12 1 1 A 142 142 LEU CB C 142 44.527 45.928 -1.401 1 1 1568 . 12 1 1 A 142 142 LEU N N 142 123.692 120.838 2.854 1 1 1569 . 12 1 1 A 143 143 THR H H 143 9.025 9.098 -0.073 1 1 1570 . 12 1 1 A 143 143 THR HA H 143 5.262 5.201 0.061 1 1 1575 . 12 1 1 A 143 143 THR C C 143 173.753 173.341 0.412 1 1 1576 . 12 1 1 A 143 143 THR CA C 143 61.795 61.615 0.180 1 1 1577 . 12 1 1 A 143 143 THR CB C 143 70.660 71.494 -0.834 1 1 1579 . 12 1 1 A 143 143 THR N N 143 117.222 114.995 2.227 1 1 1580 . 12 1 1 A 144 144 ILE H H 144 9.353 9.850 -0.497 1 1 1581 . 12 1 1 A 144 144 ILE HA H 144 5.399 5.360 0.039 1 1 1591 . 12 1 1 A 144 144 ILE C C 144 173.931 174.039 -0.108 1 1 1592 . 12 1 1 A 144 144 ILE CA C 144 60.774 60.440 0.334 1 1 1593 . 12 1 1 A 144 144 ILE CB C 144 41.111 40.943 0.168 1 1 1597 . 12 1 1 A 144 144 ILE N N 144 126.383 125.365 1.018 1 1 1598 . 12 1 1 A 145 145 ASP H H 145 9.214 9.506 -0.292 1 1 1599 . 12 1 1 A 145 145 ASP HA H 145 5.978 5.558 0.420 1 1 1601 . 12 1 1 A 145 145 ASP C C 145 175.441 174.690 0.751 1 1 1602 . 12 1 1 A 145 145 ASP CA C 145 53.035 52.641 0.394 1 1 1603 . 12 1 1 A 145 145 ASP CB C 145 44.153 44.082 0.071 1 1 1604 . 12 1 1 A 145 145 ASP N N 145 127.981 128.569 -0.588 1 1 1605 . 12 1 1 A 146 146 LEU H H 146 9.387 9.727 -0.340 1 1 1606 . 12 1 1 A 146 146 LEU HA H 146 4.918 5.450 -0.532 1 1 1616 . 12 1 1 A 146 146 LEU C C 146 175.003 174.688 0.315 1 1 1617 . 12 1 1 A 146 146 LEU CA C 146 53.940 53.487 0.453 1 1 1618 . 12 1 1 A 146 146 LEU CB C 146 43.902 44.094 -0.192 1 1 1622 . 12 1 1 A 146 146 LEU N N 146 123.532 127.706 -4.174 1 1 1623 . 12 1 1 A 147 147 ASP H H 147 8.676 8.593 0.083 1 1 1624 . 12 1 1 A 147 147 ASP HA H 147 5.205 5.451 -0.246 1 1 1627 . 12 1 1 A 147 147 ASP C C 147 174.956 174.089 0.867 1 1 1628 . 12 1 1 A 147 147 ASP CA C 147 53.441 52.334 1.107 1 1 1629 . 12 1 1 A 147 147 ASP CB C 147 43.370 44.053 -0.683 1 1 1630 . 12 1 1 A 147 147 ASP N N 147 125.499 125.217 0.282 1 1 1631 . 12 1 1 A 148 148 SER H H 148 8.732 9.403 -0.671 1 1 1632 . 12 1 1 A 148 148 SER HA H 148 5.365 5.353 0.012 1 1 1634 . 12 1 1 A 148 148 SER C C 148 173.217 173.048 0.169 1 1 1635 . 12 1 1 A 148 148 SER CA C 148 56.334 56.286 0.048 1 1 1636 . 12 1 1 A 148 148 SER CB C 148 65.812 65.962 -0.150 1 1 1637 . 12 1 1 A 148 148 SER N N 148 118.623 120.943 -2.320 1 1 1638 . 12 1 1 A 149 149 ALA H H 149 8.937 8.594 0.343 1 1 1639 . 12 1 1 A 149 149 ALA HA H 149 5.681 5.407 0.274 1 1 1643 . 12 1 1 A 149 149 ALA C C 149 178.894 177.915 0.979 1 1 1644 . 12 1 1 A 149 149 ALA CA C 149 49.996 50.365 -0.369 1 1 1645 . 12 1 1 A 149 149 ALA CB C 149 23.231 22.642 0.589 1 1 1646 . 12 1 1 A 149 149 ALA N N 149 123.952 126.955 -3.003 1 1 1647 . 12 1 1 A 150 150 ASP H H 150 9.010 8.820 0.190 1 1 1648 . 12 1 1 A 150 150 ASP HA H 150 4.336 4.284 0.052 1 1 1651 . 12 1 1 A 150 150 ASP C C 150 176.697 177.739 -1.042 1 1 1652 . 12 1 1 A 150 150 ASP CA C 150 56.543 57.163 -0.620 1 1 1653 . 12 1 1 A 150 150 ASP CB C 150 39.850 40.279 -0.429 1 1 1654 . 12 1 1 A 150 150 ASP N N 150 122.687 122.403 0.284 1 1 1655 . 12 1 1 A 151 151 PHE H H 151 7.295 7.910 -0.615 1 1 1656 . 12 1 1 A 151 151 PHE HA H 151 5.020 4.691 0.329 1 1 1661 . 12 1 1 A 151 151 PHE C C 151 174.756 175.670 -0.914 1 1 1662 . 12 1 1 A 151 151 PHE CA C 151 56.594 58.077 -1.483 1 1 1663 . 12 1 1 A 151 151 PHE CB C 151 37.765 39.283 -1.518 1 1 1666 . 12 1 1 A 151 151 PHE N N 151 113.928 115.528 -1.600 1 1 1667 . 12 1 1 A 152 152 GLY H H 152 7.786 8.406 -0.620 1 1 1668 . 12 1 1 A 152 152 GLY HA2 H 152 4.459 4.039 0.420 1 1 1669 . 12 1 1 A 152 152 GLY HA3 H 152 3.728 4.044 -0.316 1 1 1670 . 12 1 1 A 152 152 GLY C C 152 172.709 173.435 -0.726 1 1 1671 . 12 1 1 A 152 152 GLY CA C 152 46.106 46.628 -0.522 1 1 1672 . 12 1 1 A 152 152 GLY N N 152 110.312 108.415 1.897 1 1 1673 . 12 1 1 A 153 153 TYR H H 153 6.650 7.413 -0.763 1 1 1674 . 12 1 1 A 153 153 TYR HA H 153 4.508 5.152 -0.644 1 1 1679 . 12 1 1 A 153 153 TYR C C 153 173.092 173.548 -0.456 1 1 1680 . 12 1 1 A 153 153 TYR CA C 153 57.464 57.463 0.001 1 1 1681 . 12 1 1 A 153 153 TYR CB C 153 41.962 42.503 -0.541 1 1 1684 . 12 1 1 A 153 153 TYR N N 153 121.977 119.037 2.940 1 1 1685 . 12 1 1 A 154 154 ALA H H 154 7.847 8.568 -0.721 1 1 1686 . 12 1 1 A 154 154 ALA HA H 154 5.144 4.879 0.265 1 1 1690 . 12 1 1 A 154 154 ALA C C 154 174.468 175.152 -0.684 1 1 1691 . 12 1 1 A 154 154 ALA CA C 154 51.776 51.366 0.410 1 1 1692 . 12 1 1 A 154 154 ALA CB C 154 21.747 21.062 0.685 1 1 1693 . 12 1 1 A 154 154 ALA N N 154 130.258 129.905 0.353 1 1 1694 . 12 1 1 A 155 155 VAL H H 155 8.733 8.955 -0.222 1 1 1695 . 12 1 1 A 155 155 VAL HA H 155 4.150 4.800 -0.650 1 1 1700 . 12 1 1 A 155 155 VAL C C 155 172.632 174.114 -1.482 1 1 1701 . 12 1 1 A 155 155 VAL CA C 155 61.451 59.295 2.156 1 1 1702 . 12 1 1 A 155 155 VAL CB C 155 35.883 34.746 1.137 1 1 1704 . 12 1 1 A 155 155 VAL N N 155 119.622 122.808 -3.186 1 1 1705 . 12 1 1 A 156 156 GLY H H 156 8.146 8.528 -0.382 1 1 1706 . 12 1 1 A 156 156 GLY HA2 H 156 5.125 2.412 2.713 1 1 1707 . 12 1 1 A 156 156 GLY HA3 H 156 2.061 3.869 -1.808 1 1 1708 . 12 1 1 A 156 156 GLY C C 156 171.746 171.955 -0.209 1 1 1709 . 12 1 1 A 156 156 GLY CA C 156 43.319 43.319 0.000 1 1 1710 . 12 1 1 A 156 156 GLY N N 156 113.332 113.598 -0.266 1 1 1711 . 12 1 1 A 157 157 GLU H H 157 8.967 8.657 0.310 1 1 1712 . 12 1 1 A 157 157 GLU HA H 157 5.217 5.154 0.063 1 1 1716 . 12 1 1 A 157 157 GLU C C 157 174.476 174.723 -0.247 1 1 1717 . 12 1 1 A 157 157 GLU CA C 157 55.390 55.306 0.084 1 1 1718 . 12 1 1 A 157 157 GLU CB C 157 34.010 32.963 1.047 1 1 1720 . 12 1 1 A 157 157 GLU N N 157 120.823 121.983 -1.160 1 1 1721 . 12 1 1 A 158 158 VAL H H 158 9.076 9.326 -0.250 1 1 1722 . 12 1 1 A 158 158 VAL HA H 158 5.206 4.808 0.398 1 1 1727 . 12 1 1 A 158 158 VAL C C 158 173.900 174.028 -0.128 1 1 1728 . 12 1 1 A 158 158 VAL CA C 158 60.813 61.613 -0.800 1 1 1729 . 12 1 1 A 158 158 VAL CB C 158 33.385 33.525 -0.140 1 1 1731 . 12 1 1 A 158 158 VAL N N 158 124.349 126.173 -1.824 1 1 1732 . 12 1 1 A 159 159 GLU H H 159 9.239 9.653 -0.414 1 1 1733 . 12 1 1 A 159 159 GLU HA H 159 5.647 5.044 0.603 1 1 1738 . 12 1 1 A 159 159 GLU C C 159 174.469 174.992 -0.523 1 1 1739 . 12 1 1 A 159 159 GLU CA C 159 54.473 54.654 -0.181 1 1 1740 . 12 1 1 A 159 159 GLU CB C 159 33.852 32.551 1.301 1 1 1742 . 12 1 1 A 159 159 GLU N N 159 125.772 129.069 -3.297 1 1 1743 . 12 1 1 A 160 160 ALA H H 160 9.250 9.212 0.038 1 1 1744 . 12 1 1 A 160 160 ALA HA H 160 4.966 5.536 -0.570 1 1 1748 . 12 1 1 A 160 160 ALA C C 160 175.114 175.737 -0.623 1 1 1749 . 12 1 1 A 160 160 ALA CA C 160 50.644 49.911 0.733 1 1 1750 . 12 1 1 A 160 160 ALA CB C 160 23.263 23.045 0.218 1 1 1751 . 12 1 1 A 160 160 ALA N N 160 125.092 129.289 -4.197 1 1 1752 . 12 1 1 A 161 161 MET H H 161 8.559 8.799 -0.240 1 1 1753 . 12 1 1 A 161 161 MET HA H 161 5.468 5.811 -0.343 1 1 1761 . 12 1 1 A 161 161 MET C C 161 176.265 174.885 1.380 1 1 1762 . 12 1 1 A 161 161 MET CA C 161 53.818 54.289 -0.471 1 1 1763 . 12 1 1 A 161 161 MET CB C 161 34.380 35.714 -1.334 1 1 1766 . 12 1 1 A 161 161 MET N N 161 118.699 119.741 -1.042 1 1 1767 . 12 1 1 A 162 162 VAL H H 162 9.046 9.053 -0.007 1 1 1768 . 12 1 1 A 162 162 VAL HA H 162 4.841 4.847 -0.006 1 1 1776 . 12 1 1 A 162 162 VAL C C 162 174.794 175.766 -0.972 1 1 1777 . 12 1 1 A 162 162 VAL CA C 162 59.107 59.410 -0.303 1 1 1778 . 12 1 1 A 162 162 VAL CB C 162 34.018 34.264 -0.246 1 1 1781 . 12 1 1 A 162 162 VAL N N 162 116.435 119.067 -2.632 1 1 1782 . 12 1 1 A 163 163 HIS H H 163 8.793 8.710 0.083 1 1 1783 . 12 1 1 A 163 163 HIS HA H 163 4.717 4.628 0.089 1 1 1787 . 12 1 1 A 163 163 HIS C C 163 175.460 174.536 0.924 1 1 1788 . 12 1 1 A 163 163 HIS CA C 163 58.488 57.623 0.865 1 1 1789 . 12 1 1 A 163 163 HIS CB C 163 31.185 31.103 0.082 1 1 1791 . 12 1 1 A 163 163 HIS N N 163 117.838 120.786 -2.948 1 1 1792 . 12 1 1 A 164 164 GLU H H 164 8.013 7.726 0.287 1 1 1793 . 12 1 1 A 164 164 GLU HA H 164 4.814 4.656 0.158 1 1 1797 . 12 1 1 A 164 164 GLU C C 164 176.910 176.372 0.538 1 1 1798 . 12 1 1 A 164 164 GLU CA C 164 54.355 54.795 -0.440 1 1 1799 . 12 1 1 A 164 164 GLU CB C 164 32.886 31.674 1.212 1 1 1801 . 12 1 1 A 164 164 GLU N N 164 115.943 114.634 1.309 1 1 1802 . 12 1 1 A 165 165 LYS H H 165 9.088 8.945 0.143 1 1 1803 . 12 1 1 A 165 165 LYS HA H 165 3.942 3.975 -0.033 1 1 1809 . 12 1 1 A 165 165 LYS C C 165 179.657 177.922 1.735 1 1 1810 . 12 1 1 A 165 165 LYS CA C 165 59.888 58.382 1.506 1 1 1811 . 12 1 1 A 165 165 LYS CB C 165 32.024 32.405 -0.381 1 1 1814 . 12 1 1 A 165 165 LYS N N 165 124.120 123.636 0.484 1 1 1815 . 12 1 1 A 166 166 ALA H H 166 8.851 8.169 0.682 1 1 1816 . 12 1 1 A 166 166 ALA HA H 166 4.251 4.057 0.194 1 1 1820 . 12 1 1 A 166 166 ALA C C 166 178.920 178.988 -0.068 1 1 1821 . 12 1 1 A 166 166 ALA CA C 166 54.318 54.528 -0.210 1 1 1822 . 12 1 1 A 166 166 ALA CB C 166 18.810 18.164 0.646 1 1 1823 . 12 1 1 A 166 166 ALA N N 166 120.424 122.486 -2.062 1 1 1824 . 12 1 1 A 167 167 GLU H H 167 7.871 7.459 0.412 1 1 1825 . 12 1 1 A 167 167 GLU HA H 167 4.404 4.325 0.079 1 1 1829 . 12 1 1 A 167 167 GLU C C 167 177.368 178.318 -0.950 1 1 1830 . 12 1 1 A 167 167 GLU CA C 167 56.701 57.267 -0.566 1 1 1831 . 12 1 1 A 167 167 GLU CB C 167 31.208 30.007 1.201 1 1 1833 . 12 1 1 A 167 167 GLU N N 167 114.926 116.704 -1.778 1 1 1834 . 12 1 1 A 168 168 VAL H H 168 7.812 7.437 0.375 1 1 1835 . 12 1 1 A 168 168 VAL HA H 168 3.712 3.631 0.081 1 1 1843 . 12 1 1 A 168 168 VAL CA C 168 68.705 67.948 0.757 1 1 1844 . 12 1 1 A 168 168 VAL CB C 168 29.597 29.794 -0.197 1 1 1847 . 12 1 1 A 168 168 VAL N N 168 120.188 122.635 -2.447 1 1 1848 . 12 1 1 A 169 169 PRO HA H 169 4.252 4.237 0.015 1 1 1851 . 12 1 1 A 169 169 PRO C C 169 179.563 178.561 1.002 1 1 1852 . 12 1 1 A 169 169 PRO CA C 169 67.077 66.917 0.160 1 1 1853 . 12 1 1 A 170 170 ALA H H 170 8.149 8.275 -0.126 1 1 1854 . 12 1 1 A 170 170 ALA HA H 170 4.265 4.045 0.220 1 1 1858 . 12 1 1 A 170 170 ALA C C 170 180.637 179.740 0.897 1 1 1859 . 12 1 1 A 170 170 ALA CA C 170 54.823 55.370 -0.547 1 1 1860 . 12 1 1 A 170 170 ALA CB C 170 18.518 17.584 0.934 1 1 1861 . 12 1 1 A 170 170 ALA N N 170 119.210 119.089 0.121 1 1 1862 . 12 1 1 A 171 171 ALA H H 171 7.767 8.157 -0.390 1 1 1863 . 12 1 1 A 171 171 ALA HA H 171 4.106 4.276 -0.170 1 1 1867 . 12 1 1 A 171 171 ALA C C 171 179.371 180.085 -0.714 1 1 1868 . 12 1 1 A 171 171 ALA CA C 171 55.130 54.920 0.210 1 1 1869 . 12 1 1 A 171 171 ALA CB C 171 18.291 18.652 -0.361 1 1 1870 . 12 1 1 A 171 171 ALA N N 171 122.126 121.218 0.908 1 1 1871 . 12 1 1 A 172 172 LEU H H 172 8.950 8.257 0.693 1 1 1872 . 12 1 1 A 172 172 LEU HA H 172 3.987 4.090 -0.103 1 1 1878 . 12 1 1 A 172 172 LEU C C 172 178.355 178.464 -0.109 1 1 1879 . 12 1 1 A 172 172 LEU CA C 172 57.803 57.956 -0.153 1 1 1880 . 12 1 1 A 172 172 LEU CB C 172 41.667 41.639 0.028 1 1 1882 . 12 1 1 A 172 172 LEU N N 172 118.682 120.517 -1.835 1 1 1883 . 12 1 1 A 173 173 GLU H H 173 7.886 8.019 -0.133 1 1 1884 . 12 1 1 A 173 173 GLU HA H 173 4.132 3.978 0.154 1 1 1887 . 12 1 1 A 173 173 GLU C C 173 179.556 178.479 1.077 1 1 1888 . 12 1 1 A 173 173 GLU CA C 173 59.800 59.252 0.548 1 1 1889 . 12 1 1 A 173 173 GLU CB C 173 29.580 29.251 0.329 1 1 1891 . 12 1 1 A 173 173 GLU N N 173 117.561 118.618 -1.057 1 1 1892 . 12 1 1 A 174 174 LYS H H 174 7.532 7.827 -0.295 1 1 1893 . 12 1 1 A 174 174 LYS HA H 174 4.131 4.074 0.057 1 1 1901 . 12 1 1 A 174 174 LYS CA C 174 58.999 59.080 -0.081 1 1 1902 . 12 1 1 A 174 174 LYS CB C 174 32.041 32.192 -0.151 1 1 1906 . 12 1 1 A 174 174 LYS N N 174 119.085 119.563 -0.478 1 1 1907 . 12 1 1 A 175 175 ILE H H 175 8.479 7.848 0.631 1 1 1908 . 12 1 1 A 175 175 ILE HA H 175 3.583 3.587 -0.004 1 1 1918 . 12 1 1 A 175 175 ILE C C 175 179.258 178.151 1.107 1 1 1919 . 12 1 1 A 175 175 ILE CA C 175 65.769 65.564 0.205 1 1 1920 . 12 1 1 A 175 175 ILE CB C 175 37.876 38.011 -0.135 1 1 1923 . 12 1 1 A 175 175 ILE N N 175 118.828 119.038 -0.210 1 1 1924 . 12 1 1 A 176 176 ILE H H 176 8.928 7.933 0.995 1 1 1925 . 12 1 1 A 176 176 ILE HA H 176 3.600 3.504 0.096 1 1 1935 . 12 1 1 A 176 176 ILE C C 176 178.827 177.912 0.915 1 1 1936 . 12 1 1 A 176 176 ILE CA C 176 65.640 65.078 0.562 1 1 1937 . 12 1 1 A 176 176 ILE CB C 176 37.451 37.609 -0.158 1 1 1941 . 12 1 1 A 176 176 ILE N N 176 124.527 119.696 4.831 1 1 1942 . 12 1 1 A 177 177 THR H H 177 8.175 8.246 -0.071 1 1 1943 . 12 1 1 A 177 177 THR HA H 177 3.885 4.024 -0.139 1 1 1948 . 12 1 1 A 177 177 THR C C 177 176.867 176.746 0.121 1 1 1949 . 12 1 1 A 177 177 THR CA C 177 67.199 66.465 0.734 1 1 1950 . 12 1 1 A 177 177 THR CB C 177 68.377 68.008 0.369 1 1 1952 . 12 1 1 A 177 177 THR N N 177 119.412 117.409 2.003 1 1 1953 . 12 1 1 A 178 178 VAL H H 178 8.352 7.824 0.528 1 1 1954 . 12 1 1 A 178 178 VAL HA H 178 3.572 3.453 0.119 1 1 1962 . 12 1 1 A 178 178 VAL C C 178 177.664 177.558 0.106 1 1 1963 . 12 1 1 A 178 178 VAL CA C 178 66.909 66.262 0.647 1 1 1964 . 12 1 1 A 178 178 VAL CB C 178 31.714 31.294 0.420 1 1 1967 . 12 1 1 A 178 178 VAL N N 178 121.168 122.219 -1.051 1 1 1968 . 12 1 1 A 179 179 SER H H 179 8.529 8.319 0.210 1 1 1969 . 12 1 1 A 179 179 SER HA H 179 3.099 3.504 -0.405 1 1 1972 . 12 1 1 A 179 179 SER C C 179 175.380 176.617 -1.237 1 1 1973 . 12 1 1 A 179 179 SER CA C 179 62.728 61.670 1.058 1 1 1974 . 12 1 1 A 179 179 SER CB C 179 62.802 62.600 0.202 1 1 1975 . 12 1 1 A 179 179 SER N N 179 115.226 115.779 -0.553 1 1 1976 . 12 1 1 A 180 180 SER H H 180 7.757 8.687 -0.930 1 1 1977 . 12 1 1 A 180 180 SER HA H 180 4.419 4.360 0.059 1 1 1980 . 12 1 1 A 180 180 SER C C 180 175.359 176.791 -1.432 1 1 1981 . 12 1 1 A 180 180 SER CA C 180 61.025 61.260 -0.235 1 1 1982 . 12 1 1 A 180 180 SER CB C 180 63.072 62.498 0.574 1 1 1983 . 12 1 1 A 180 180 SER N N 180 114.718 116.159 -1.441 1 1 1984 . 12 1 1 A 181 181 MET H H 181 7.497 7.502 -0.005 1 1 1985 . 12 1 1 A 181 181 MET HA H 181 4.283 4.214 0.069 1 1 1993 . 12 1 1 A 181 181 MET C C 181 177.217 177.735 -0.518 1 1 1994 . 12 1 1 A 181 181 MET CA C 181 57.539 57.907 -0.368 1 1 1995 . 12 1 1 A 181 181 MET CB C 181 33.493 32.204 1.289 1 1 1998 . 12 1 1 A 181 181 MET N N 181 119.274 120.657 -1.383 1 1 1999 . 12 1 1 A 182 182 LEU H H 182 7.163 7.527 -0.364 1 1 2000 . 12 1 1 A 182 182 LEU HA H 182 4.133 4.278 -0.145 1 1 2010 . 12 1 1 A 182 182 LEU C C 182 176.289 176.923 -0.634 1 1 2011 . 12 1 1 A 182 182 LEU CA C 182 54.750 55.358 -0.608 1 1 2012 . 12 1 1 A 182 182 LEU CB C 182 43.235 42.912 0.323 1 1 2016 . 12 1 1 A 182 182 LEU N N 182 115.869 118.055 -2.186 1 1 2017 . 12 1 1 A 183 183 GLY H H 183 7.492 7.458 0.034 1 1 2018 . 12 1 1 A 183 183 GLY HA2 H 183 4.086 4.115 -0.029 1 1 2019 . 12 1 1 A 183 183 GLY HA3 H 183 4.425 4.159 0.266 1 1 2020 . 12 1 1 A 183 183 GLY C C 183 171.830 171.866 -0.036 1 1 2021 . 12 1 1 A 183 183 GLY CA C 183 46.035 46.207 -0.172 1 1 2022 . 12 1 1 A 183 183 GLY N N 183 107.761 105.529 2.232 1 1 2023 . 12 1 1 A 184 184 VAL H H 184 8.099 8.676 -0.577 1 1 2024 . 12 1 1 A 184 184 VAL HA H 184 4.772 4.776 -0.004 1 1 2032 . 12 1 1 A 184 184 VAL CA C 184 59.305 58.808 0.497 1 1 2033 . 12 1 1 A 184 184 VAL CB C 184 33.648 35.230 -1.582 1 1 2036 . 12 1 1 A 184 184 VAL N N 184 119.803 121.881 -2.078 1 1 2037 . 12 1 1 A 185 185 PRO HA H 185 4.442 4.629 -0.187 1 1 2042 . 12 1 1 A 185 185 PRO C C 185 175.871 176.388 -0.517 1 1 2043 . 12 1 1 A 185 185 PRO CA C 185 63.886 62.686 1.200 1 1 2044 . 12 1 1 A 185 185 PRO CB C 185 32.260 32.197 0.063 1 1 2047 . 12 1 1 A 186 186 ALA H H 186 8.222 8.716 -0.494 1 1 2048 . 12 1 1 A 186 186 ALA HA H 186 4.569 4.709 -0.140 1 1 2052 . 12 1 1 A 186 186 ALA C C 186 177.481 175.787 1.694 1 1 2053 . 12 1 1 A 186 186 ALA CA C 186 51.823 50.587 1.236 1 1 2054 . 12 1 1 A 186 186 ALA CB C 186 20.233 21.119 -0.886 1 1 2055 . 12 1 1 A 186 186 ALA N N 186 125.663 122.428 3.235 1 1 2056 . 12 1 1 A 187 187 GLN H H 187 8.723 8.765 -0.042 1 1 2057 . 12 1 1 A 187 187 GLN HA H 187 4.420 4.963 -0.543 1 1 2063 . 12 1 1 A 187 187 GLN C C 187 175.566 174.555 1.011 1 1 2064 . 12 1 1 A 187 187 GLN CA C 187 56.051 54.557 1.494 1 1 2065 . 12 1 1 A 187 187 GLN CB C 187 29.812 30.265 -0.453 1 1 2067 . 12 1 1 A 187 187 GLN N N 187 120.742 115.580 5.162 1 1 2069 . 12 1 1 A 188 188 GLU H H 188 8.163 8.488 -0.325 1 1 2070 . 12 1 1 A 188 188 GLU HA H 188 4.405 4.439 -0.034 1 1 2074 . 12 1 1 A 188 188 GLU C C 188 176.058 175.357 0.701 1 1 2075 . 12 1 1 A 188 188 GLU CA C 188 56.158 56.171 -0.013 1 1 2076 . 12 1 1 A 188 188 GLU CB C 188 31.095 28.074 3.021 1 1 2078 . 12 1 1 A 188 188 GLU N N 188 119.177 118.049 1.128 1 1 2079 . 12 1 1 A 189 189 GLU H H 189 8.567 8.295 0.272 1 1 2080 . 12 1 1 A 189 189 GLU HA H 189 4.252 4.766 -0.514 1 1 2084 . 12 1 1 A 189 189 GLU C C 189 175.703 174.955 0.748 1 1 2085 . 12 1 1 A 189 189 GLU CA C 189 56.417 55.760 0.657 1 1 2086 . 12 1 1 A 189 189 GLU CB C 189 29.968 31.286 -1.318 1 1 2088 . 12 1 1 A 189 189 GLU N N 189 120.920 125.207 -4.287 1 1 2089 . 12 1 1 A 190 190 ALA H H 190 8.271 8.771 -0.500 1 1 2090 . 12 1 1 A 190 190 ALA HA H 190 4.626 4.814 -0.188 1 1 2094 . 12 1 1 A 190 190 ALA CA C 190 50.465 48.988 1.477 1 1 2095 . 12 1 1 A 190 190 ALA CB C 190 18.451 20.119 -1.668 1 1 2096 . 12 1 1 A 190 190 ALA N N 190 128.323 128.842 -0.519 1 1 2097 . 12 1 1 A 191 191 PRO HA H 191 4.493 4.523 -0.030 1 1 2103 . 12 1 1 A 191 191 PRO C C 191 175.899 177.021 -1.122 1 1 2104 . 12 1 1 A 191 191 PRO CA C 191 62.044 62.461 -0.417 1 1 2105 . 12 1 1 A 191 191 PRO CB C 191 32.184 32.439 -0.255 1 1 2108 . 12 1 1 A 192 192 ALA H H 192 8.610 8.224 0.386 1 1 2109 . 12 1 1 A 192 192 ALA HA H 192 4.280 4.465 -0.185 1 1 2113 . 12 1 1 A 192 192 ALA C C 192 178.282 177.955 0.327 1 1 2114 . 12 1 1 A 192 192 ALA CA C 192 51.698 51.905 -0.207 1 1 2115 . 12 1 1 A 192 192 ALA CB C 192 19.220 19.690 -0.470 1 1 2116 . 12 1 1 A 192 192 ALA N N 192 123.420 124.676 -1.256 1 1 2117 . 12 1 1 A 193 193 LYS H H 193 8.531 8.817 -0.286 1 1 2118 . 12 1 1 A 193 193 LYS HA H 193 3.294 3.931 -0.637 1 1 2126 . 12 1 1 A 193 193 LYS C C 193 177.640 178.110 -0.470 1 1 2127 . 12 1 1 A 193 193 LYS CA C 193 60.644 60.095 0.549 1 1 2128 . 12 1 1 A 193 193 LYS CB C 193 32.607 32.029 0.578 1 1 2132 . 12 1 1 A 193 193 LYS N N 193 122.851 121.544 1.307 1 1 2133 . 12 1 1 A 194 194 LEU H H 194 8.570 8.230 0.340 1 1 2134 . 12 1 1 A 194 194 LEU HA H 194 3.845 4.259 -0.414 1 1 2144 . 12 1 1 A 194 194 LEU C C 194 177.965 179.362 -1.397 1 1 2145 . 12 1 1 A 194 194 LEU CA C 194 57.611 57.750 -0.139 1 1 2146 . 12 1 1 A 194 194 LEU CB C 194 41.776 41.079 0.697 1 1 2150 . 12 1 1 A 194 194 LEU N N 194 115.801 119.861 -4.060 1 1 2151 . 12 1 1 A 195 195 MET H H 195 6.782 8.178 -1.396 1 1 2152 . 12 1 1 A 195 195 MET HA H 195 4.487 4.262 0.225 1 1 2160 . 12 1 1 A 195 195 MET C C 195 178.280 178.267 0.013 1 1 2161 . 12 1 1 A 195 195 MET CA C 195 56.858 58.376 -1.518 1 1 2162 . 12 1 1 A 195 195 MET CB C 195 31.557 32.175 -0.618 1 1 2165 . 12 1 1 A 195 195 MET N N 195 113.898 119.493 -5.595 1 1 2166 . 12 1 1 A 196 196 VAL H H 196 7.713 8.292 -0.579 1 1 2167 . 12 1 1 A 196 196 VAL HA H 196 3.501 3.445 0.056 1 1 2175 . 12 1 1 A 196 196 VAL C C 196 177.624 177.514 0.110 1 1 2176 . 12 1 1 A 196 196 VAL CA C 196 66.318 65.075 1.243 1 1 2177 . 12 1 1 A 196 196 VAL CB C 196 31.380 30.987 0.393 1 1 2180 . 12 1 1 A 196 196 VAL N N 196 120.413 118.824 1.589 1 1 2181 . 12 1 1 A 197 197 TYR H H 197 7.972 8.053 -0.081 1 1 2182 . 12 1 1 A 197 197 TYR HA H 197 3.145 4.098 -0.953 1 1 2187 . 12 1 1 A 197 197 TYR C C 197 177.726 176.972 0.754 1 1 2188 . 12 1 1 A 197 197 TYR CA C 197 62.253 61.677 0.576 1 1 2189 . 12 1 1 A 197 197 TYR CB C 197 37.314 38.728 -1.414 1 1 2192 . 12 1 1 A 197 197 TYR N N 197 119.543 122.779 -3.236 1 1 2193 . 12 1 1 A 198 198 LEU H H 198 8.630 8.099 0.531 1 1 2194 . 12 1 1 A 198 198 LEU HA H 198 3.923 3.639 0.284 1 1 2203 . 12 1 1 A 198 198 LEU C C 198 178.074 178.954 -0.880 1 1 2204 . 12 1 1 A 198 198 LEU CA C 198 58.294 57.949 0.345 1 1 2205 . 12 1 1 A 198 198 LEU CB C 198 42.177 41.657 0.520 1 1 2209 . 12 1 1 A 198 198 LEU N N 198 118.430 119.859 -1.429 1 1 2210 . 12 1 1 A 199 199 GLN H H 199 8.082 8.172 -0.090 1 1 2211 . 12 1 1 A 199 199 GLN HA H 199 3.054 3.762 -0.708 1 1 2216 . 12 1 1 A 199 199 GLN C C 199 176.875 178.026 -1.151 1 1 2217 . 12 1 1 A 199 199 GLN CA C 199 59.739 58.089 1.650 1 1 2218 . 12 1 1 A 199 199 GLN CB C 199 28.055 27.473 0.582 1 1 2220 . 12 1 1 A 199 199 GLN N N 199 117.926 117.246 0.680 1 1 2222 . 12 1 1 A 200 200 ARG H H 200 7.349 7.646 -0.297 1 1 2223 . 12 1 1 A 200 200 ARG HA H 200 3.798 3.781 0.017 1 1 2231 . 12 1 1 A 200 200 ARG C C 200 178.037 177.949 0.088 1 1 2232 . 12 1 1 A 200 200 ARG CA C 200 58.260 58.600 -0.340 1 1 2233 . 12 1 1 A 200 200 ARG CB C 200 30.706 30.067 0.639 1 1 2236 . 12 1 1 A 200 200 ARG N N 200 113.772 119.966 -6.194 1 1 2238 . 12 1 1 A 201 201 PHE H H 201 8.329 7.436 0.893 1 1 2239 . 12 1 1 A 201 201 PHE HA H 201 4.630 4.442 0.188 1 1 2244 . 12 1 1 A 201 201 PHE C C 201 176.606 176.106 0.500 1 1 2245 . 12 1 1 A 201 201 PHE CA C 201 59.014 58.568 0.446 1 1 2246 . 12 1 1 A 201 201 PHE CB C 201 40.357 40.779 -0.422 1 1 2249 . 12 1 1 A 201 201 PHE N N 201 114.182 116.123 -1.941 1 1 2250 . 12 1 1 A 202 202 ARG H H 202 8.719 8.352 0.367 1 1 2251 . 12 1 1 A 202 202 ARG HA H 202 5.071 4.653 0.418 1 1 2261 . 12 1 1 A 202 202 ARG CA C 202 53.956 53.449 0.507 1 1 2262 . 12 1 1 A 202 202 ARG CB C 202 31.979 30.265 1.714 1 1 2264 . 12 1 1 A 202 202 ARG N N 202 120.115 115.022 5.093 1 1 2266 . 12 1 1 A 203 203 PRO HA H 203 4.348 4.496 -0.148 1 1 2271 . 12 1 1 A 203 203 PRO C C 203 179.736 178.811 0.925 1 1 2272 . 12 1 1 A 203 203 PRO CA C 203 65.674 65.625 0.049 1 1 2273 . 12 1 1 A 203 203 PRO CB C 203 31.717 32.036 -0.319 1 1 2275 . 12 1 1 A 204 204 LEU H H 204 8.875 7.554 1.321 1 1 2276 . 12 1 1 A 204 204 LEU HA H 204 4.291 4.004 0.287 1 1 2286 . 12 1 1 A 204 204 LEU C C 204 180.353 178.510 1.843 1 1 2287 . 12 1 1 A 204 204 LEU CA C 204 58.012 57.404 0.608 1 1 2288 . 12 1 1 A 204 204 LEU CB C 204 40.893 41.296 -0.403 1 1 2292 . 12 1 1 A 204 204 LEU N N 204 118.940 116.499 2.441 1 1 2293 . 12 1 1 A 205 205 ASP H H 205 7.541 8.318 -0.777 1 1 2294 . 12 1 1 A 205 205 ASP HA H 205 4.622 4.326 0.296 1 1 2297 . 12 1 1 A 205 205 ASP C C 205 177.602 177.842 -0.240 1 1 2298 . 12 1 1 A 205 205 ASP CA C 205 57.437 57.326 0.111 1 1 2299 . 12 1 1 A 205 205 ASP CB C 205 41.143 41.308 -0.165 1 1 2300 . 12 1 1 A 205 205 ASP N N 205 120.838 119.798 1.040 1 1 2301 . 12 1 1 A 206 206 TYR H H 206 8.237 8.177 0.060 1 1 2302 . 12 1 1 A 206 206 TYR HA H 206 4.018 4.055 -0.037 1 1 2307 . 12 1 1 A 206 206 TYR C C 206 176.433 177.590 -1.157 1 1 2308 . 12 1 1 A 206 206 TYR CA C 206 62.148 61.752 0.396 1 1 2309 . 12 1 1 A 206 206 TYR CB C 206 38.305 38.720 -0.415 1 1 2312 . 12 1 1 A 206 206 TYR N N 206 119.475 120.201 -0.726 1 1 2313 . 12 1 1 A 207 207 GLN H H 207 8.124 8.508 -0.384 1 1 2314 . 12 1 1 A 207 207 GLN HA H 207 3.823 3.150 0.673 1 1 2320 . 12 1 1 A 207 207 GLN C C 207 178.019 178.718 -0.699 1 1 2321 . 12 1 1 A 207 207 GLN CA C 207 58.841 58.949 -0.108 1 1 2322 . 12 1 1 A 207 207 GLN CB C 207 28.208 28.177 0.031 1 1 2324 . 12 1 1 A 207 207 GLN N N 207 115.863 118.093 -2.230 1 1 2326 . 12 1 1 A 208 208 ARG H H 208 7.522 7.917 -0.395 1 1 2327 . 12 1 1 A 208 208 ARG HA H 208 4.127 4.050 0.077 1 1 2334 . 12 1 1 A 208 208 ARG C C 208 179.278 178.669 0.609 1 1 2335 . 12 1 1 A 208 208 ARG CA C 208 59.419 59.033 0.386 1 1 2336 . 12 1 1 A 208 208 ARG CB C 208 30.182 30.022 0.160 1 1 2338 . 12 1 1 A 208 208 ARG N N 208 118.471 119.735 -1.264 1 1 2340 . 12 1 1 A 209 209 LEU H H 209 7.869 7.728 0.141 1 1 2341 . 12 1 1 A 209 209 LEU HA H 209 4.091 4.075 0.016 1 1 2351 . 12 1 1 A 209 209 LEU C C 209 179.715 179.023 0.692 1 1 2352 . 12 1 1 A 209 209 LEU CA C 209 57.891 57.903 -0.012 1 1 2353 . 12 1 1 A 209 209 LEU CB C 209 41.338 41.944 -0.606 1 1 2356 . 12 1 1 A 209 209 LEU N N 209 119.659 119.785 -0.126 1 1 2357 . 12 1 1 A 210 210 LEU H H 210 8.034 8.526 -0.492 1 1 2358 . 12 1 1 A 210 210 LEU HA H 210 3.977 3.972 0.005 1 1 2367 . 12 1 1 A 210 210 LEU C C 210 180.363 178.390 1.973 1 1 2368 . 12 1 1 A 210 210 LEU CA C 210 57.459 58.451 -0.992 1 1 2369 . 12 1 1 A 210 210 LEU CB C 210 41.699 41.461 0.238 1 1 2373 . 12 1 1 A 210 210 LEU N N 210 120.967 119.803 1.164 1 1 2374 . 12 1 1 A 211 211 GLU H H 211 8.174 8.733 -0.559 1 1 2375 . 12 1 1 A 211 211 GLU HA H 211 4.075 4.030 0.045 1 1 2379 . 12 1 1 A 211 211 GLU C C 211 178.499 178.471 0.028 1 1 2380 . 12 1 1 A 211 211 GLU CA C 211 58.575 59.425 -0.850 1 1 2381 . 12 1 1 A 211 211 GLU CB C 211 29.583 29.231 0.352 1 1 2383 . 12 1 1 A 211 211 GLU N N 211 119.217 118.093 1.124 1 1 2384 . 12 1 1 A 212 212 ALA H H 212 7.723 7.855 -0.132 1 1 2385 . 12 1 1 A 212 212 ALA HA H 212 4.291 4.251 0.040 1 1 2389 . 12 1 1 A 212 212 ALA C C 212 178.770 178.965 -0.195 1 1 2390 . 12 1 1 A 212 212 ALA CA C 212 53.966 54.060 -0.094 1 1 2391 . 12 1 1 A 212 212 ALA CB C 212 19.117 18.729 0.388 1 1 2392 . 12 1 1 A 212 212 ALA N N 212 121.798 122.775 -0.977 1 1 2393 . 12 1 1 A 213 213 ALA H H 213 7.743 7.713 0.030 1 1 2394 . 12 1 1 A 213 213 ALA HA H 213 4.406 4.252 0.154 1 1 2398 . 12 1 1 A 213 213 ALA C C 213 178.413 178.430 -0.017 1 1 2399 . 12 1 1 A 213 213 ALA CA C 213 53.129 52.664 0.465 1 1 2400 . 12 1 1 A 213 213 ALA CB C 213 18.926 19.668 -0.742 1 1 2401 . 12 1 1 A 213 213 ALA N N 213 120.435 119.837 0.598 1 1 2402 . 12 1 1 A 214 214 SER H H 214 7.944 8.002 -0.058 1 1 2403 . 12 1 1 A 214 214 SER HA H 214 4.559 4.457 0.102 1 1 2406 . 12 1 1 A 214 214 SER C C 214 174.958 174.554 0.404 1 1 2407 . 12 1 1 A 214 214 SER CA C 214 58.640 58.679 -0.039 1 1 2408 . 12 1 1 A 214 214 SER CB C 214 63.928 62.759 1.169 1 1 2409 . 12 1 1 A 214 214 SER N N 214 113.729 111.070 2.659 1 1 2410 . 12 1 1 A 215 215 SER H H 215 8.255 7.365 0.890 1 1 2411 . 12 1 1 A 215 215 SER HA H 215 4.547 4.598 -0.051 1 1 2413 . 12 1 1 A 215 215 SER C C 215 175.289 173.605 1.684 1 1 2414 . 12 1 1 A 215 215 SER CA C 215 58.833 57.588 1.245 1 1 2415 . 12 1 1 A 215 215 SER CB C 215 63.847 62.943 0.904 1 1 2416 . 12 1 1 A 215 215 SER N N 215 117.674 117.975 -0.301 1 1 2417 . 12 1 1 A 216 216 GLY H H 216 8.431 7.897 0.534 1 1 2418 . 12 1 1 A 216 216 GLY HA2 H 216 4.054 4.239 -0.185 1 1 2419 . 12 1 1 A 216 216 GLY C C 216 174.189 173.284 0.905 1 1 2420 . 12 1 1 A 216 216 GLY CA C 216 45.412 45.930 -0.518 1 1 2421 . 12 1 1 A 216 216 GLY N N 216 110.800 114.168 -3.368 1 1 2422 . 12 1 1 A 217 217 GLU H H 217 8.267 8.721 -0.454 1 1 2423 . 12 1 1 A 217 217 GLU HA H 217 4.345 4.568 -0.223 1 1 2427 . 12 1 1 A 217 217 GLU C C 217 176.428 177.289 -0.861 1 1 2428 . 12 1 1 A 217 217 GLU CA C 217 56.470 56.985 -0.515 1 1 2429 . 12 1 1 A 217 217 GLU CB C 217 30.526 31.361 -0.835 1 1 2430 . 12 1 1 A 217 217 GLU N N 217 120.726 118.921 1.805 1 1 2431 . 12 1 1 A 218 218 ALA H H 218 8.476 8.035 0.441 1 1 2432 . 12 1 1 A 218 218 ALA HA H 218 4.467 3.917 0.550 1 1 2436 . 12 1 1 A 218 218 ALA C C 218 178.015 176.434 1.581 1 1 2437 . 12 1 1 A 218 218 ALA CA C 218 52.547 54.886 -2.339 1 1 2438 . 12 1 1 A 218 218 ALA CB C 218 19.242 17.940 1.302 1 1 2439 . 12 1 1 A 218 218 ALA N N 218 125.534 120.921 4.613 1 1 2440 . 12 1 1 A 219 219 THR H H 219 8.232 7.734 0.498 1 1 2441 . 12 1 1 A 219 219 THR HA H 219 4.411 4.725 -0.314 1 1 2446 . 12 1 1 A 219 219 THR C C 219 175.327 174.466 0.861 1 1 2447 . 12 1 1 A 219 219 THR CA C 219 61.889 59.916 1.973 1 1 2448 . 12 1 1 A 219 219 THR CB C 219 69.939 72.278 -2.339 1 1 2449 . 12 1 1 A 219 219 THR N N 219 113.242 108.129 5.113 1 1 2450 . 12 1 1 A 220 220 GLY H H 220 8.418 8.696 -0.278 1 1 2451 . 12 1 1 A 220 220 GLY C C 220 174.037 173.097 0.940 1 1 2452 . 12 1 1 A 220 220 GLY CA C 220 45.408 45.591 -0.183 1 1 2453 . 12 1 1 A 220 220 GLY N N 220 111.031 110.172 0.859 1 1 2454 . 12 1 1 A 221 221 ASP H H 221 8.345 7.665 0.680 1 1 2455 . 12 1 1 A 221 221 ASP HA H 221 4.700 5.257 -0.557 1 1 2458 . 12 1 1 A 221 221 ASP C C 221 176.535 175.040 1.495 1 1 2459 . 12 1 1 A 221 221 ASP CA C 221 54.402 53.196 1.206 1 1 2460 . 12 1 1 A 221 221 ASP CB C 221 41.431 43.870 -2.439 1 1 2461 . 12 1 1 A 221 221 ASP N N 221 120.795 120.661 0.134 1 1 2462 . 12 1 1 A 222 222 SER H H 222 8.353 8.861 -0.508 1 1 2463 . 12 1 1 A 222 222 SER HA H 222 4.493 4.659 -0.166 1 1 2465 . 12 1 1 A 222 222 SER C C 222 174.224 173.388 0.836 1 1 2466 . 12 1 1 A 222 222 SER CA C 222 58.427 57.743 0.684 1 1 2467 . 12 1 1 A 222 222 SER CB C 222 63.860 63.397 0.463 1 1 2468 . 12 1 1 A 222 222 SER N N 222 116.220 118.953 -2.733 1 1 2469 . 12 1 1 A 223 223 ALA H H 223 8.381 8.190 0.191 1 1 2470 . 12 1 1 A 223 223 ALA HA H 223 4.461 4.046 0.415 1 1 2474 . 12 1 1 A 223 223 ALA C C 223 176.926 176.458 0.468 1 1 2475 . 12 1 1 A 223 223 ALA CA C 223 52.583 52.926 -0.343 1 1 2476 . 12 1 1 A 223 223 ALA CB C 223 19.438 17.705 1.733 1 1 2477 . 12 1 1 A 223 223 ALA N N 223 126.592 122.405 4.187 1 1 1 . 13 1 1 A 2 2 ALA HA H 2 4.274 4.755 -0.481 1 1 5 . 13 1 1 A 2 2 ALA C C 2 177.828 176.772 1.056 1 1 6 . 13 1 1 A 2 2 ALA CA C 2 52.984 51.283 1.701 1 1 7 . 13 1 1 A 2 2 ALA CB C 2 19.138 19.870 -0.732 1 1 8 . 13 1 1 A 3 3 GLN H H 3 8.463 8.650 -0.187 1 1 9 . 13 1 1 A 3 3 GLN HA H 3 4.676 4.806 -0.130 1 1 12 . 13 1 1 A 3 3 GLN C C 3 176.002 176.573 -0.571 1 1 13 . 13 1 1 A 3 3 GLN CA C 3 56.258 54.417 1.841 1 1 14 . 13 1 1 A 3 3 GLN CB C 3 30.346 31.646 -1.300 1 1 15 . 13 1 1 A 3 3 GLN N N 3 117.490 122.374 -4.884 1 1 16 . 13 1 1 A 4 4 GLY H H 4 8.099 8.603 -0.504 1 1 17 . 13 1 1 A 4 4 GLY HA2 H 4 3.910 3.842 0.068 1 1 18 . 13 1 1 A 4 4 GLY C C 4 173.332 174.078 -0.746 1 1 19 . 13 1 1 A 4 4 GLY CA C 4 45.333 47.308 -1.975 1 1 20 . 13 1 1 A 4 4 GLY N N 4 109.423 110.463 -1.040 1 1 21 . 13 1 1 A 5 5 LEU H H 5 7.863 8.422 -0.559 1 1 22 . 13 1 1 A 5 5 LEU HA H 5 4.561 4.796 -0.235 1 1 32 . 13 1 1 A 5 5 LEU C C 5 176.448 175.660 0.788 1 1 33 . 13 1 1 A 5 5 LEU CA C 5 54.713 54.239 0.474 1 1 34 . 13 1 1 A 5 5 LEU CB C 5 43.551 41.217 2.334 1 1 38 . 13 1 1 A 5 5 LEU N N 5 120.391 125.628 -5.237 1 1 39 . 13 1 1 A 6 6 ILE H H 6 8.764 9.356 -0.592 1 1 40 . 13 1 1 A 6 6 ILE HA H 6 4.087 4.140 -0.053 1 1 49 . 13 1 1 A 6 6 ILE C C 6 174.679 175.441 -0.762 1 1 50 . 13 1 1 A 6 6 ILE CA C 6 61.279 61.735 -0.456 1 1 51 . 13 1 1 A 6 6 ILE CB C 6 39.651 37.892 1.759 1 1 54 . 13 1 1 A 6 6 ILE N N 6 123.050 125.484 -2.434 1 1 55 . 13 1 1 A 7 7 GLU H H 7 8.587 8.679 -0.092 1 1 56 . 13 1 1 A 7 7 GLU HA H 7 4.917 4.819 0.098 1 1 61 . 13 1 1 A 7 7 GLU C C 7 175.978 176.324 -0.346 1 1 62 . 13 1 1 A 7 7 GLU CA C 7 56.127 56.074 0.053 1 1 63 . 13 1 1 A 7 7 GLU CB C 7 31.115 30.381 0.734 1 1 65 . 13 1 1 A 7 7 GLU N N 7 127.415 127.829 -0.414 1 1 66 . 13 1 1 A 8 8 VAL H H 8 8.986 9.206 -0.220 1 1 67 . 13 1 1 A 8 8 VAL HA H 8 4.375 4.908 -0.533 1 1 72 . 13 1 1 A 8 8 VAL C C 8 173.704 175.280 -1.576 1 1 73 . 13 1 1 A 8 8 VAL CA C 8 61.347 60.688 0.659 1 1 74 . 13 1 1 A 8 8 VAL CB C 8 33.611 33.403 0.208 1 1 76 . 13 1 1 A 8 8 VAL N N 8 126.071 120.226 5.845 1 1 77 . 13 1 1 A 9 9 GLU H H 9 8.521 9.172 -0.651 1 1 78 . 13 1 1 A 9 9 GLU HA H 9 5.837 5.535 0.302 1 1 81 . 13 1 1 A 9 9 GLU C C 9 175.939 174.816 1.123 1 1 82 . 13 1 1 A 9 9 GLU CA C 9 54.516 54.546 -0.030 1 1 83 . 13 1 1 A 9 9 GLU CB C 9 33.009 33.738 -0.729 1 1 84 . 13 1 1 A 9 9 GLU N N 9 122.857 122.490 0.367 1 1 85 . 13 1 1 A 10 10 ARG H H 10 8.690 8.552 0.138 1 1 86 . 13 1 1 A 10 10 ARG HA H 10 4.709 4.883 -0.174 1 1 94 . 13 1 1 A 10 10 ARG C C 10 174.826 174.654 0.172 1 1 95 . 13 1 1 A 10 10 ARG CA C 10 54.491 54.383 0.108 1 1 96 . 13 1 1 A 10 10 ARG CB C 10 35.777 34.656 1.121 1 1 98 . 13 1 1 A 10 10 ARG N N 10 120.430 120.987 -0.557 1 1 100 . 13 1 1 A 11 11 LYS H H 11 8.874 8.752 0.122 1 1 101 . 13 1 1 A 11 11 LYS HA H 11 5.530 5.375 0.155 1 1 107 . 13 1 1 A 11 11 LYS C C 11 176.919 174.615 2.304 1 1 108 . 13 1 1 A 11 11 LYS CA C 11 55.084 55.083 0.001 1 1 109 . 13 1 1 A 11 11 LYS CB C 11 35.435 36.931 -1.496 1 1 113 . 13 1 1 A 11 11 LYS N N 11 121.087 122.575 -1.488 1 1 114 . 13 1 1 A 12 12 PHE H H 12 8.877 9.235 -0.358 1 1 115 . 13 1 1 A 12 12 PHE HA H 12 5.130 5.096 0.034 1 1 120 . 13 1 1 A 12 12 PHE C C 12 171.676 172.033 -0.357 1 1 121 . 13 1 1 A 12 12 PHE CA C 12 55.869 56.286 -0.417 1 1 122 . 13 1 1 A 12 12 PHE CB C 12 42.108 41.231 0.877 1 1 125 . 13 1 1 A 12 12 PHE N N 12 117.486 119.624 -2.138 1 1 126 . 13 1 1 A 13 13 ALA H H 13 9.134 9.311 -0.177 1 1 127 . 13 1 1 A 13 13 ALA HA H 13 5.003 4.717 0.286 1 1 131 . 13 1 1 A 13 13 ALA CA C 13 48.340 48.795 -0.455 1 1 132 . 13 1 1 A 13 13 ALA CB C 13 19.191 20.270 -1.079 1 1 133 . 13 1 1 A 13 13 ALA N N 13 125.915 123.060 2.855 1 1 134 . 13 1 1 A 14 14 PRO HA H 14 4.620 5.023 -0.403 1 1 140 . 13 1 1 A 14 14 PRO C C 14 176.502 177.298 -0.796 1 1 141 . 13 1 1 A 14 14 PRO CA C 14 62.672 62.396 0.276 1 1 142 . 13 1 1 A 14 14 PRO CB C 14 33.119 32.260 0.859 1 1 145 . 13 1 1 A 15 15 GLY H H 15 8.721 8.475 0.246 1 1 146 . 13 1 1 A 15 15 GLY HA2 H 15 3.999 4.082 -0.083 1 1 147 . 13 1 1 A 15 15 GLY HA3 H 15 4.632 4.083 0.549 1 1 148 . 13 1 1 A 15 15 GLY CA C 15 44.411 44.009 0.402 1 1 149 . 13 1 1 A 15 15 GLY N N 15 109.863 108.087 1.776 1 1 150 . 13 1 1 A 16 16 PRO HA H 16 4.447 4.542 -0.095 1 1 155 . 13 1 1 A 16 16 PRO C C 16 177.053 176.773 0.280 1 1 156 . 13 1 1 A 16 16 PRO CA C 16 64.395 64.144 0.251 1 1 157 . 13 1 1 A 16 16 PRO CB C 16 31.993 31.888 0.105 1 1 159 . 13 1 1 A 17 17 ASP H H 17 8.550 8.498 0.052 1 1 160 . 13 1 1 A 17 17 ASP HA H 17 4.950 4.829 0.121 1 1 163 . 13 1 1 A 17 17 ASP C C 17 176.800 177.208 -0.408 1 1 164 . 13 1 1 A 17 17 ASP CA C 17 53.271 53.324 -0.053 1 1 165 . 13 1 1 A 17 17 ASP CB C 17 40.392 40.835 -0.443 1 1 166 . 13 1 1 A 17 17 ASP N N 17 116.060 117.222 -1.162 1 1 167 . 13 1 1 A 18 18 THR H H 18 7.664 7.205 0.459 1 1 168 . 13 1 1 A 18 18 THR HA H 18 4.120 3.744 0.376 1 1 174 . 13 1 1 A 18 18 THR C C 18 175.407 176.325 -0.918 1 1 175 . 13 1 1 A 18 18 THR CA C 18 68.718 67.010 1.708 1 1 176 . 13 1 1 A 18 18 THR CB C 18 69.179 68.546 0.633 1 1 178 . 13 1 1 A 18 18 THR N N 18 117.158 115.972 1.186 1 1 179 . 13 1 1 A 19 19 GLU H H 19 8.817 8.486 0.331 1 1 180 . 13 1 1 A 19 19 GLU HA H 19 3.510 3.096 0.414 1 1 184 . 13 1 1 A 19 19 GLU C C 19 178.345 178.986 -0.641 1 1 185 . 13 1 1 A 19 19 GLU CA C 19 61.237 59.680 1.557 1 1 186 . 13 1 1 A 19 19 GLU CB C 19 28.746 29.296 -0.550 1 1 188 . 13 1 1 A 19 19 GLU N N 19 118.802 118.532 0.270 1 1 189 . 13 1 1 A 20 20 GLU H H 20 7.976 7.897 0.079 1 1 190 . 13 1 1 A 20 20 GLU HA H 20 4.036 4.095 -0.059 1 1 194 . 13 1 1 A 20 20 GLU C C 20 179.451 179.015 0.436 1 1 195 . 13 1 1 A 20 20 GLU CA C 20 59.909 58.932 0.977 1 1 196 . 13 1 1 A 20 20 GLU CB C 20 28.992 29.369 -0.377 1 1 198 . 13 1 1 A 20 20 GLU N N 20 121.130 119.286 1.844 1 1 199 . 13 1 1 A 21 21 ARG H H 21 8.199 7.903 0.296 1 1 200 . 13 1 1 A 21 21 ARG HA H 21 4.061 3.983 0.078 1 1 207 . 13 1 1 A 21 21 ARG C C 21 179.087 178.659 0.428 1 1 208 . 13 1 1 A 21 21 ARG CA C 21 58.477 58.800 -0.323 1 1 209 . 13 1 1 A 21 21 ARG CB C 21 30.101 29.754 0.347 1 1 211 . 13 1 1 A 21 21 ARG N N 21 119.897 120.414 -0.517 1 1 213 . 13 1 1 A 22 22 LEU H H 22 8.154 8.507 -0.353 1 1 214 . 13 1 1 A 22 22 LEU HA H 22 3.560 3.795 -0.235 1 1 224 . 13 1 1 A 22 22 LEU C C 22 178.461 179.239 -0.778 1 1 225 . 13 1 1 A 22 22 LEU CA C 22 58.432 57.697 0.735 1 1 226 . 13 1 1 A 22 22 LEU CB C 22 40.229 41.029 -0.800 1 1 230 . 13 1 1 A 22 22 LEU N N 22 120.012 119.689 0.323 1 1 231 . 13 1 1 A 23 23 GLN H H 23 7.621 7.899 -0.278 1 1 232 . 13 1 1 A 23 23 GLN HA H 23 4.232 4.043 0.189 1 1 238 . 13 1 1 A 23 23 GLN C C 23 180.543 178.187 2.356 1 1 239 . 13 1 1 A 23 23 GLN CA C 23 59.434 59.175 0.259 1 1 240 . 13 1 1 A 23 23 GLN CB C 23 28.749 28.275 0.474 1 1 242 . 13 1 1 A 23 23 GLN N N 23 117.823 117.859 -0.036 1 1 244 . 13 1 1 A 24 24 GLU H H 24 8.165 7.690 0.475 1 1 245 . 13 1 1 A 24 24 GLU HA H 24 4.072 4.200 -0.128 1 1 249 . 13 1 1 A 24 24 GLU C C 24 178.612 179.006 -0.394 1 1 250 . 13 1 1 A 24 24 GLU CA C 24 59.236 58.989 0.247 1 1 251 . 13 1 1 A 24 24 GLU CB C 24 29.606 29.434 0.172 1 1 253 . 13 1 1 A 24 24 GLU N N 24 122.589 119.520 3.069 1 1 254 . 13 1 1 A 25 25 LEU H H 25 7.911 7.901 0.010 1 1 255 . 13 1 1 A 25 25 LEU HA H 25 4.214 4.114 0.100 1 1 265 . 13 1 1 A 25 25 LEU C C 25 176.745 177.219 -0.474 1 1 266 . 13 1 1 A 25 25 LEU CA C 25 55.659 55.864 -0.205 1 1 267 . 13 1 1 A 25 25 LEU CB C 25 43.109 42.662 0.447 1 1 271 . 13 1 1 A 25 25 LEU N N 25 117.882 117.008 0.874 1 1 272 . 13 1 1 A 26 26 GLY H H 26 7.776 7.884 -0.108 1 1 273 . 13 1 1 A 26 26 GLY HA2 H 26 4.337 4.043 0.294 1 1 274 . 13 1 1 A 26 26 GLY HA3 H 26 3.856 4.055 -0.199 1 1 275 . 13 1 1 A 26 26 GLY C C 26 175.456 174.532 0.924 1 1 276 . 13 1 1 A 26 26 GLY CA C 26 44.875 44.998 -0.123 1 1 277 . 13 1 1 A 26 26 GLY N N 26 104.938 105.651 -0.713 1 1 278 . 13 1 1 A 27 27 ALA H H 27 8.104 8.451 -0.347 1 1 279 . 13 1 1 A 27 27 ALA HA H 27 4.949 4.481 0.468 1 1 283 . 13 1 1 A 27 27 ALA C C 27 176.448 176.846 -0.398 1 1 284 . 13 1 1 A 27 27 ALA CA C 27 52.183 52.172 0.011 1 1 285 . 13 1 1 A 27 27 ALA CB C 27 21.814 19.786 2.028 1 1 286 . 13 1 1 A 27 27 ALA N N 27 123.263 123.976 -0.713 1 1 287 . 13 1 1 A 28 28 THR H H 28 9.369 9.227 0.142 1 1 288 . 13 1 1 A 28 28 THR HA H 28 4.779 4.812 -0.033 1 1 293 . 13 1 1 A 28 28 THR C C 28 173.725 173.928 -0.203 1 1 294 . 13 1 1 A 28 28 THR CA C 28 60.046 60.646 -0.600 1 1 295 . 13 1 1 A 28 28 THR CB C 28 70.592 70.151 0.441 1 1 297 . 13 1 1 A 28 28 THR N N 28 112.201 118.941 -6.740 1 1 298 . 13 1 1 A 29 29 LEU H H 29 8.518 8.464 0.054 1 1 299 . 13 1 1 A 29 29 LEU HA H 29 3.332 3.798 -0.466 1 1 309 . 13 1 1 A 29 29 LEU C C 29 176.202 176.793 -0.591 1 1 310 . 13 1 1 A 29 29 LEU CA C 29 55.031 54.717 0.314 1 1 311 . 13 1 1 A 29 29 LEU CB C 29 40.624 41.426 -0.802 1 1 315 . 13 1 1 A 29 29 LEU N N 29 128.151 128.818 -0.667 1 1 316 . 13 1 1 A 30 30 GLU H H 30 9.269 9.116 0.153 1 1 317 . 13 1 1 A 30 30 GLU HA H 30 4.287 4.255 0.032 1 1 321 . 13 1 1 A 30 30 GLU C C 30 176.740 175.982 0.758 1 1 322 . 13 1 1 A 30 30 GLU CA C 30 57.283 57.780 -0.497 1 1 323 . 13 1 1 A 30 30 GLU CB C 30 31.045 30.235 0.810 1 1 325 . 13 1 1 A 30 30 GLU N N 30 130.123 123.388 6.735 1 1 326 . 13 1 1 A 31 31 HIS H H 31 7.341 7.080 0.261 1 1 327 . 13 1 1 A 31 31 HIS HA H 31 4.701 5.096 -0.395 1 1 331 . 13 1 1 A 31 31 HIS C C 31 172.581 173.904 -1.323 1 1 332 . 13 1 1 A 31 31 HIS CA C 31 55.876 54.588 1.288 1 1 333 . 13 1 1 A 31 31 HIS CB C 31 33.434 34.198 -0.764 1 1 334 . 13 1 1 A 31 31 HIS N N 31 113.223 115.990 -2.767 1 1 335 . 13 1 1 A 32 32 ARG H H 32 8.196 8.802 -0.606 1 1 336 . 13 1 1 A 32 32 ARG HA H 32 5.262 5.421 -0.159 1 1 341 . 13 1 1 A 32 32 ARG C C 32 174.377 174.623 -0.246 1 1 342 . 13 1 1 A 32 32 ARG CA C 32 55.808 54.413 1.395 1 1 343 . 13 1 1 A 32 32 ARG CB C 32 33.340 33.887 -0.547 1 1 345 . 13 1 1 A 32 32 ARG N N 32 123.003 119.432 3.571 1 1 346 . 13 1 1 A 33 33 VAL H H 33 8.956 9.269 -0.313 1 1 347 . 13 1 1 A 33 33 VAL HA H 33 4.734 4.768 -0.034 1 1 355 . 13 1 1 A 33 33 VAL C C 33 172.821 174.672 -1.851 1 1 356 . 13 1 1 A 33 33 VAL CA C 33 60.197 59.791 0.406 1 1 357 . 13 1 1 A 33 33 VAL CB C 33 35.860 34.161 1.699 1 1 360 . 13 1 1 A 33 33 VAL N N 33 122.929 117.814 5.115 1 1 361 . 13 1 1 A 34 34 THR H H 34 8.250 8.371 -0.121 1 1 362 . 13 1 1 A 34 34 THR HA H 34 5.616 5.662 -0.046 1 1 367 . 13 1 1 A 34 34 THR C C 34 173.913 173.160 0.753 1 1 368 . 13 1 1 A 34 34 THR CA C 34 60.245 60.199 0.046 1 1 369 . 13 1 1 A 34 34 THR CB C 34 71.706 71.150 0.556 1 1 371 . 13 1 1 A 34 34 THR N N 34 119.164 115.779 3.385 1 1 372 . 13 1 1 A 35 35 PHE H H 35 8.565 8.824 -0.259 1 1 373 . 13 1 1 A 35 35 PHE HA H 35 5.029 5.005 0.024 1 1 378 . 13 1 1 A 35 35 PHE C C 35 173.193 174.420 -1.227 1 1 379 . 13 1 1 A 35 35 PHE CA C 35 55.687 56.199 -0.512 1 1 380 . 13 1 1 A 35 35 PHE CB C 35 40.853 43.504 -2.651 1 1 383 . 13 1 1 A 35 35 PHE N N 35 120.244 120.789 -0.545 1 1 384 . 13 1 1 A 36 36 ARG H H 36 8.869 8.965 -0.096 1 1 385 . 13 1 1 A 36 36 ARG HA H 36 4.982 4.871 0.111 1 1 387 . 13 1 1 A 36 36 ARG C C 36 174.743 174.657 0.086 1 1 388 . 13 1 1 A 36 36 ARG CA C 36 55.493 55.480 0.013 1 1 389 . 13 1 1 A 36 36 ARG CB C 36 32.228 31.915 0.313 1 1 390 . 13 1 1 A 36 36 ARG N N 36 123.893 123.539 0.354 1 1 391 . 13 1 1 A 37 37 ASP H H 37 8.402 9.810 -1.408 1 1 392 . 13 1 1 A 37 37 ASP HA H 37 5.462 5.456 0.006 1 1 395 . 13 1 1 A 37 37 ASP C C 37 175.177 174.783 0.394 1 1 396 . 13 1 1 A 37 37 ASP CA C 37 53.942 53.384 0.558 1 1 397 . 13 1 1 A 37 37 ASP CB C 37 45.486 42.815 2.671 1 1 398 . 13 1 1 A 37 37 ASP N N 37 127.149 128.037 -0.888 1 1 399 . 13 1 1 A 38 38 THR H H 38 8.151 8.518 -0.367 1 1 400 . 13 1 1 A 38 38 THR HA H 38 4.866 5.192 -0.326 1 1 405 . 13 1 1 A 38 38 THR C C 38 172.792 173.329 -0.537 1 1 406 . 13 1 1 A 38 38 THR CA C 38 61.416 60.878 0.538 1 1 407 . 13 1 1 A 38 38 THR CB C 38 71.047 70.189 0.858 1 1 409 . 13 1 1 A 38 38 THR N N 38 115.686 116.167 -0.481 1 1 410 . 13 1 1 A 39 39 TYR H H 39 9.021 9.502 -0.481 1 1 411 . 13 1 1 A 39 39 TYR HA H 39 5.544 5.524 0.020 1 1 416 . 13 1 1 A 39 39 TYR C C 39 176.032 174.583 1.449 1 1 417 . 13 1 1 A 39 39 TYR CA C 39 57.184 56.024 1.160 1 1 418 . 13 1 1 A 39 39 TYR CB C 39 41.642 40.183 1.459 1 1 420 . 13 1 1 A 39 39 TYR N N 39 124.579 124.647 -0.068 1 1 421 . 13 1 1 A 40 40 TYR H H 40 8.487 9.313 -0.826 1 1 422 . 13 1 1 A 40 40 TYR HA H 40 5.517 5.718 -0.201 1 1 426 . 13 1 1 A 40 40 TYR C C 40 174.108 174.548 -0.440 1 1 427 . 13 1 1 A 40 40 TYR CA C 40 56.979 56.858 0.121 1 1 428 . 13 1 1 A 40 40 TYR CB C 40 44.132 42.569 1.563 1 1 431 . 13 1 1 A 40 40 TYR N N 40 119.709 122.503 -2.794 1 1 432 . 13 1 1 A 41 41 ASP H H 41 9.341 8.706 0.635 1 1 433 . 13 1 1 A 41 41 ASP HA H 41 4.866 5.148 -0.282 1 1 436 . 13 1 1 A 41 41 ASP C C 41 177.262 174.831 2.431 1 1 437 . 13 1 1 A 41 41 ASP CA C 41 53.445 53.297 0.148 1 1 438 . 13 1 1 A 41 41 ASP CB C 41 45.347 44.662 0.685 1 1 439 . 13 1 1 A 41 41 ASP N N 41 117.995 120.518 -2.523 1 1 440 . 13 1 1 A 42 42 THR H H 42 11.574 8.690 2.884 1 1 441 . 13 1 1 A 42 42 THR HA H 42 5.206 4.476 0.730 1 1 446 . 13 1 1 A 42 42 THR C C 42 177.935 176.308 1.627 1 1 447 . 13 1 1 A 42 42 THR CA C 42 60.400 61.126 -0.726 1 1 448 . 13 1 1 A 42 42 THR CB C 42 72.114 70.757 1.357 1 1 450 . 13 1 1 A 42 42 THR N N 42 114.394 114.759 -0.365 1 1 451 . 13 1 1 A 43 43 SER H H 43 9.715 8.925 0.790 1 1 452 . 13 1 1 A 43 43 SER HA H 43 4.252 4.125 0.127 1 1 455 . 13 1 1 A 43 43 SER C C 43 175.478 175.131 0.347 1 1 456 . 13 1 1 A 43 43 SER CA C 43 61.277 62.055 -0.778 1 1 457 . 13 1 1 A 43 43 SER CB C 43 62.821 62.986 -0.165 1 1 458 . 13 1 1 A 43 43 SER N N 43 116.674 118.306 -1.632 1 1 459 . 13 1 1 A 44 44 GLU H H 44 7.674 8.068 -0.394 1 1 460 . 13 1 1 A 44 44 GLU HA H 44 4.330 4.238 0.092 1 1 464 . 13 1 1 A 44 44 GLU C C 44 175.001 175.843 -0.842 1 1 465 . 13 1 1 A 44 44 GLU CA C 44 55.992 55.362 0.630 1 1 466 . 13 1 1 A 44 44 GLU CB C 44 29.276 28.597 0.679 1 1 468 . 13 1 1 A 44 44 GLU N N 44 117.856 117.200 0.656 1 1 469 . 13 1 1 A 45 45 LEU H H 45 8.222 7.993 0.229 1 1 470 . 13 1 1 A 45 45 LEU HA H 45 3.901 4.603 -0.702 1 1 480 . 13 1 1 A 45 45 LEU C C 45 175.209 176.491 -1.282 1 1 481 . 13 1 1 A 45 45 LEU CA C 45 55.548 56.106 -0.558 1 1 482 . 13 1 1 A 45 45 LEU CB C 45 38.458 39.860 -1.402 1 1 485 . 13 1 1 A 45 45 LEU N N 45 119.335 116.730 2.605 1 1 486 . 13 1 1 A 46 46 SER H H 46 7.347 7.961 -0.614 1 1 487 . 13 1 1 A 46 46 SER HA H 46 3.954 4.132 -0.178 1 1 489 . 13 1 1 A 46 46 SER C C 46 177.497 176.410 1.087 1 1 490 . 13 1 1 A 46 46 SER CA C 46 62.471 62.136 0.335 1 1 491 . 13 1 1 A 46 46 SER CB C 46 63.908 63.127 0.781 1 1 492 . 13 1 1 A 46 46 SER N N 46 111.433 112.673 -1.240 1 1 493 . 13 1 1 A 47 47 LEU H H 47 12.003 8.266 3.737 1 1 494 . 13 1 1 A 47 47 LEU HA H 47 3.959 4.080 -0.121 1 1 504 . 13 1 1 A 47 47 LEU C C 47 180.340 178.283 2.057 1 1 505 . 13 1 1 A 47 47 LEU CA C 47 58.879 58.137 0.742 1 1 506 . 13 1 1 A 47 47 LEU CB C 47 39.572 41.886 -2.314 1 1 510 . 13 1 1 A 47 47 LEU N N 47 124.605 122.855 1.750 1 1 511 . 13 1 1 A 48 48 MET H H 48 10.599 8.945 1.654 1 1 512 . 13 1 1 A 48 48 MET HA H 48 3.213 3.592 -0.379 1 1 520 . 13 1 1 A 48 48 MET C C 48 181.177 177.944 3.233 1 1 521 . 13 1 1 A 48 48 MET CA C 48 60.747 58.161 2.586 1 1 522 . 13 1 1 A 48 48 MET CB C 48 32.594 31.877 0.717 1 1 525 . 13 1 1 A 48 48 MET N N 48 126.254 118.727 7.527 1 1 526 . 13 1 1 A 49 49 LEU H H 49 8.731 7.462 1.269 1 1 527 . 13 1 1 A 49 49 LEU HA H 49 4.097 4.116 -0.019 1 1 536 . 13 1 1 A 49 49 LEU C C 49 178.144 177.398 0.746 1 1 537 . 13 1 1 A 49 49 LEU CA C 49 57.800 56.228 1.572 1 1 538 . 13 1 1 A 49 49 LEU CB C 49 41.379 41.551 -0.172 1 1 541 . 13 1 1 A 49 49 LEU N N 49 119.183 119.359 -0.176 1 1 542 . 13 1 1 A 50 50 SER H H 50 7.853 7.558 0.295 1 1 543 . 13 1 1 A 50 50 SER HA H 50 4.822 4.556 0.266 1 1 546 . 13 1 1 A 50 50 SER C C 50 174.539 173.612 0.927 1 1 547 . 13 1 1 A 50 50 SER CA C 50 57.811 57.810 0.001 1 1 548 . 13 1 1 A 50 50 SER CB C 50 64.443 63.143 1.300 1 1 549 . 13 1 1 A 50 50 SER N N 50 114.594 113.726 0.868 1 1 550 . 13 1 1 A 51 51 ASP H H 51 8.264 7.657 0.607 1 1 551 . 13 1 1 A 51 51 ASP HA H 51 4.362 4.229 0.133 1 1 554 . 13 1 1 A 51 51 ASP C C 51 172.921 174.387 -1.466 1 1 555 . 13 1 1 A 51 51 ASP CA C 51 55.343 55.679 -0.336 1 1 556 . 13 1 1 A 51 51 ASP CB C 51 40.583 39.816 0.767 1 1 557 . 13 1 1 A 51 51 ASP N N 51 123.003 118.657 4.346 1 1 558 . 13 1 1 A 52 52 HIS H H 52 7.869 7.396 0.473 1 1 559 . 13 1 1 A 52 52 HIS HA H 52 5.335 5.598 -0.263 1 1 564 . 13 1 1 A 52 52 HIS C C 52 173.991 173.545 0.446 1 1 565 . 13 1 1 A 52 52 HIS CA C 52 55.889 53.663 2.226 1 1 566 . 13 1 1 A 52 52 HIS CB C 52 31.789 31.504 0.285 1 1 568 . 13 1 1 A 52 52 HIS N N 52 112.486 118.162 -5.676 1 1 569 . 13 1 1 A 53 53 TRP H H 53 8.165 8.931 -0.766 1 1 570 . 13 1 1 A 53 53 TRP HA H 53 4.926 5.371 -0.445 1 1 578 . 13 1 1 A 53 53 TRP C C 53 175.354 175.594 -0.240 1 1 579 . 13 1 1 A 53 53 TRP CA C 53 55.364 56.615 -1.251 1 1 580 . 13 1 1 A 53 53 TRP CB C 53 30.641 31.848 -1.207 1 1 585 . 13 1 1 A 53 53 TRP N N 53 117.916 128.256 -10.340 1 1 587 . 13 1 1 A 54 54 LEU H H 54 10.088 9.237 0.851 1 1 588 . 13 1 1 A 54 54 LEU HA H 54 5.497 5.327 0.170 1 1 598 . 13 1 1 A 54 54 LEU C C 54 173.337 174.946 -1.609 1 1 599 . 13 1 1 A 54 54 LEU CA C 54 54.408 54.554 -0.146 1 1 600 . 13 1 1 A 54 54 LEU CB C 54 44.156 46.098 -1.942 1 1 604 . 13 1 1 A 54 54 LEU N N 54 130.826 123.693 7.133 1 1 605 . 13 1 1 A 55 55 ARG H H 55 9.289 9.145 0.144 1 1 606 . 13 1 1 A 55 55 ARG HA H 55 5.482 4.979 0.503 1 1 612 . 13 1 1 A 55 55 ARG C C 55 174.057 173.864 0.193 1 1 613 . 13 1 1 A 55 55 ARG CA C 55 53.167 53.934 -0.767 1 1 614 . 13 1 1 A 55 55 ARG CB C 55 34.270 33.458 0.812 1 1 616 . 13 1 1 A 55 55 ARG N N 55 125.089 124.496 0.593 1 1 618 . 13 1 1 A 56 56 GLN H H 56 9.092 8.764 0.328 1 1 619 . 13 1 1 A 56 56 GLN HA H 56 3.991 4.442 -0.451 1 1 626 . 13 1 1 A 56 56 GLN C C 56 174.199 174.435 -0.236 1 1 627 . 13 1 1 A 56 56 GLN CA C 56 54.566 53.742 0.824 1 1 628 . 13 1 1 A 56 56 GLN CB C 56 29.643 30.425 -0.782 1 1 630 . 13 1 1 A 56 56 GLN N N 56 124.355 121.458 2.897 1 1 632 . 13 1 1 A 57 57 ARG H H 57 8.440 8.506 -0.066 1 1 633 . 13 1 1 A 57 57 ARG HA H 57 5.316 4.413 0.903 1 1 639 . 13 1 1 A 57 57 ARG C C 57 176.188 176.942 -0.754 1 1 640 . 13 1 1 A 57 57 ARG CA C 57 53.940 55.082 -1.142 1 1 641 . 13 1 1 A 57 57 ARG CB C 57 32.426 29.721 2.705 1 1 643 . 13 1 1 A 57 57 ARG N N 57 130.222 126.727 3.495 1 1 645 . 13 1 1 A 58 58 GLU H H 58 8.891 9.358 -0.467 1 1 646 . 13 1 1 A 58 58 GLU HA H 58 3.996 4.023 -0.027 1 1 649 . 13 1 1 A 58 58 GLU CA C 58 58.364 57.124 1.240 1 1 650 . 13 1 1 A 58 58 GLU CB C 58 30.875 27.374 3.501 1 1 651 . 13 1 1 A 58 58 GLU N N 58 131.208 124.776 6.432 1 1 652 . 13 1 1 A 59 59 GLY H H 59 8.367 8.455 -0.088 1 1 653 . 13 1 1 A 59 59 GLY HA2 H 59 4.334 3.771 0.563 1 1 654 . 13 1 1 A 59 59 GLY HA3 H 59 3.743 3.862 -0.119 1 1 655 . 13 1 1 A 59 59 GLY C C 59 174.194 175.164 -0.970 1 1 656 . 13 1 1 A 59 59 GLY CA C 59 45.666 46.591 -0.925 1 1 657 . 13 1 1 A 60 60 SER H H 60 8.071 8.818 -0.747 1 1 658 . 13 1 1 A 60 60 SER HA H 60 4.730 4.675 0.055 1 1 661 . 13 1 1 A 60 60 SER C C 60 173.908 173.472 0.436 1 1 662 . 13 1 1 A 60 60 SER CA C 60 58.762 57.833 0.929 1 1 663 . 13 1 1 A 60 60 SER CB C 60 64.497 64.217 0.280 1 1 664 . 13 1 1 A 60 60 SER N N 60 114.636 113.611 1.025 1 1 665 . 13 1 1 A 61 61 GLY H H 61 8.401 7.097 1.304 1 1 666 . 13 1 1 A 61 61 GLY HA2 H 61 4.560 4.014 0.546 1 1 667 . 13 1 1 A 61 61 GLY HA3 H 61 3.878 4.068 -0.190 1 1 668 . 13 1 1 A 61 61 GLY C C 61 173.526 172.693 0.833 1 1 669 . 13 1 1 A 61 61 GLY CA C 61 44.906 45.118 -0.212 1 1 670 . 13 1 1 A 61 61 GLY N N 61 109.421 108.623 0.798 1 1 671 . 13 1 1 A 62 62 TRP H H 62 8.861 8.533 0.328 1 1 672 . 13 1 1 A 62 62 TRP HA H 62 5.089 5.067 0.022 1 1 681 . 13 1 1 A 62 62 TRP C C 62 176.168 175.890 0.278 1 1 682 . 13 1 1 A 62 62 TRP CA C 62 57.459 57.746 -0.287 1 1 683 . 13 1 1 A 62 62 TRP CB C 62 32.536 31.102 1.434 1 1 689 . 13 1 1 A 62 62 TRP N N 62 122.939 123.708 -0.769 1 1 691 . 13 1 1 A 63 63 GLU H H 63 9.306 9.406 -0.100 1 1 692 . 13 1 1 A 63 63 GLU HA H 63 4.919 5.257 -0.338 1 1 697 . 13 1 1 A 63 63 GLU C C 63 173.770 174.916 -1.146 1 1 698 . 13 1 1 A 63 63 GLU CA C 63 55.953 54.972 0.981 1 1 699 . 13 1 1 A 63 63 GLU CB C 63 35.317 33.289 2.028 1 1 701 . 13 1 1 A 63 63 GLU N N 63 120.136 123.127 -2.991 1 1 702 . 13 1 1 A 64 64 LEU H H 64 8.998 9.071 -0.073 1 1 703 . 13 1 1 A 64 64 LEU HA H 64 5.616 5.470 0.146 1 1 712 . 13 1 1 A 64 64 LEU C C 64 175.014 174.667 0.347 1 1 713 . 13 1 1 A 64 64 LEU CA C 64 52.945 52.889 0.056 1 1 714 . 13 1 1 A 64 64 LEU CB C 64 46.904 45.214 1.690 1 1 717 . 13 1 1 A 64 64 LEU N N 64 127.321 123.144 4.177 1 1 718 . 13 1 1 A 65 65 LYS H H 65 9.322 9.300 0.022 1 1 719 . 13 1 1 A 65 65 LYS HA H 65 5.347 5.198 0.149 1 1 727 . 13 1 1 A 65 65 LYS C C 65 175.811 175.081 0.730 1 1 728 . 13 1 1 A 65 65 LYS CA C 65 55.817 54.618 1.199 1 1 729 . 13 1 1 A 65 65 LYS CB C 65 34.521 35.776 -1.255 1 1 733 . 13 1 1 A 65 65 LYS N N 65 129.874 121.647 8.227 1 1 734 . 13 1 1 A 66 66 CYS H H 66 9.129 9.483 -0.354 1 1 735 . 13 1 1 A 66 66 CYS HA H 66 5.319 5.093 0.226 1 1 738 . 13 1 1 A 66 66 CYS CA C 66 54.532 57.018 -2.486 1 1 739 . 13 1 1 A 66 66 CYS CB C 66 28.813 29.323 -0.510 1 1 740 . 13 1 1 A 66 66 CYS N N 66 121.497 124.850 -3.353 1 1 741 . 13 1 1 A 67 67 PRO HA H 67 4.439 4.719 -0.280 1 1 748 . 13 1 1 A 67 67 PRO C C 67 177.297 178.171 -0.874 1 1 749 . 13 1 1 A 67 67 PRO CA C 67 63.596 63.399 0.197 1 1 750 . 13 1 1 A 67 67 PRO CB C 67 32.242 31.673 0.569 1 1 752 . 13 1 1 A 68 68 GLY H H 68 8.316 8.479 -0.163 1 1 753 . 13 1 1 A 68 68 GLY HA2 H 68 3.726 3.895 -0.169 1 1 754 . 13 1 1 A 68 68 GLY HA3 H 68 4.095 3.948 0.147 1 1 755 . 13 1 1 A 68 68 GLY C C 68 173.789 174.271 -0.482 1 1 756 . 13 1 1 A 68 68 GLY CA C 68 45.227 45.523 -0.296 1 1 757 . 13 1 1 A 68 68 GLY N N 68 109.533 109.724 -0.191 1 1 758 . 13 1 1 A 69 69 VAL H H 69 8.114 7.682 0.432 1 1 759 . 13 1 1 A 69 69 VAL HA H 69 4.266 3.983 0.283 1 1 764 . 13 1 1 A 69 69 VAL C C 69 176.299 176.261 0.038 1 1 765 . 13 1 1 A 69 69 VAL CA C 69 61.945 63.093 -1.148 1 1 766 . 13 1 1 A 69 69 VAL CB C 69 33.082 31.450 1.632 1 1 768 . 13 1 1 A 69 69 VAL N N 69 118.540 120.748 -2.208 1 1 769 . 13 1 1 A 70 70 THR H H 70 8.324 9.052 -0.728 1 1 770 . 13 1 1 A 70 70 THR HA H 70 4.373 4.556 -0.183 1 1 775 . 13 1 1 A 70 70 THR C C 70 175.204 176.057 -0.853 1 1 776 . 13 1 1 A 70 70 THR CA C 70 62.309 63.023 -0.714 1 1 777 . 13 1 1 A 70 70 THR CB C 70 69.787 69.344 0.443 1 1 779 . 13 1 1 A 70 70 THR N N 70 117.636 118.594 -0.958 1 1 780 . 13 1 1 A 71 71 GLY H H 71 8.574 7.937 0.637 1 1 781 . 13 1 1 A 71 71 GLY HA2 H 71 4.096 4.175 -0.079 1 1 782 . 13 1 1 A 71 71 GLY HA3 H 71 3.975 4.176 -0.201 1 1 783 . 13 1 1 A 71 71 GLY C C 71 174.313 174.622 -0.309 1 1 784 . 13 1 1 A 71 71 GLY CA C 71 45.545 45.672 -0.127 1 1 785 . 13 1 1 A 71 71 GLY N N 71 111.677 108.761 2.916 1 1 786 . 13 1 1 A 72 72 VAL H H 72 7.945 7.625 0.320 1 1 787 . 13 1 1 A 72 72 VAL HA H 72 4.258 4.248 0.010 1 1 795 . 13 1 1 A 72 72 VAL C C 72 176.162 175.326 0.836 1 1 796 . 13 1 1 A 72 72 VAL CA C 72 62.227 61.462 0.765 1 1 797 . 13 1 1 A 72 72 VAL CB C 72 32.997 31.657 1.340 1 1 799 . 13 1 1 A 72 72 VAL N N 72 118.647 117.809 0.838 1 1 800 . 13 1 1 A 73 73 SER H H 73 8.498 8.067 0.431 1 1 801 . 13 1 1 A 73 73 SER HA H 73 4.617 4.154 0.463 1 1 803 . 13 1 1 A 73 73 SER C C 73 174.461 173.794 0.667 1 1 804 . 13 1 1 A 73 73 SER CA C 73 58.218 59.711 -1.493 1 1 805 . 13 1 1 A 73 73 SER CB C 73 64.061 61.334 2.727 1 1 806 . 13 1 1 A 73 73 SER N N 73 118.828 113.840 4.988 1 1 807 . 13 1 1 A 74 74 GLY H H 74 8.247 8.156 0.091 1 1 808 . 13 1 1 A 74 74 GLY HA2 H 74 4.101 4.046 0.055 1 1 809 . 13 1 1 A 74 74 GLY HA3 H 74 4.304 4.047 0.257 1 1 810 . 13 1 1 A 74 74 GLY CA C 74 44.896 44.160 0.736 1 1 811 . 13 1 1 A 74 74 GLY N N 74 111.138 108.603 2.535 1 1 812 . 13 1 1 A 75 75 PRO HA H 75 4.461 4.590 -0.129 1 1 819 . 13 1 1 A 75 75 PRO C C 75 176.798 176.380 0.418 1 1 820 . 13 1 1 A 75 75 PRO CA C 75 63.466 62.376 1.090 1 1 821 . 13 1 1 A 75 75 PRO CB C 75 31.980 32.666 -0.686 1 1 824 . 13 1 1 A 76 76 HIS H H 76 8.397 8.537 -0.140 1 1 825 . 13 1 1 A 76 76 HIS HA H 76 4.742 4.411 0.331 1 1 829 . 13 1 1 A 76 76 HIS C C 76 174.282 175.490 -1.208 1 1 830 . 13 1 1 A 76 76 HIS CA C 76 55.579 56.701 -1.122 1 1 831 . 13 1 1 A 76 76 HIS CB C 76 30.501 30.389 0.112 1 1 832 . 13 1 1 A 76 76 HIS N N 76 118.431 121.042 -2.611 1 1 833 . 13 1 1 A 77 77 ASN H H 77 8.364 9.046 -0.682 1 1 834 . 13 1 1 A 77 77 ASN HA H 77 4.767 4.595 0.172 1 1 839 . 13 1 1 A 77 77 ASN C C 77 174.576 174.391 0.185 1 1 840 . 13 1 1 A 77 77 ASN CA C 77 53.139 54.024 -0.885 1 1 841 . 13 1 1 A 77 77 ASN CB C 77 39.320 40.660 -1.340 1 1 842 . 13 1 1 A 77 77 ASN N N 77 119.421 126.851 -7.430 1 1 844 . 13 1 1 A 78 78 GLU H H 78 8.683 6.971 1.712 1 1 845 . 13 1 1 A 78 78 GLU HA H 78 4.409 4.367 0.042 1 1 850 . 13 1 1 A 78 78 GLU C C 78 175.791 173.371 2.420 1 1 851 . 13 1 1 A 78 78 GLU CA C 78 56.359 55.522 0.837 1 1 852 . 13 1 1 A 78 78 GLU CB C 78 30.818 32.392 -1.574 1 1 854 . 13 1 1 A 78 78 GLU N N 78 122.085 116.581 5.504 1 1 855 . 13 1 1 A 79 79 TYR H H 79 8.341 8.424 -0.083 1 1 856 . 13 1 1 A 79 79 TYR HA H 79 4.988 5.802 -0.814 1 1 861 . 13 1 1 A 79 79 TYR C C 79 175.837 175.002 0.835 1 1 862 . 13 1 1 A 79 79 TYR CA C 79 58.028 56.931 1.097 1 1 863 . 13 1 1 A 79 79 TYR CB C 79 41.672 41.847 -0.175 1 1 866 . 13 1 1 A 79 79 TYR N N 79 119.452 119.825 -0.373 1 1 867 . 13 1 1 A 80 80 VAL H H 80 9.366 9.511 -0.145 1 1 868 . 13 1 1 A 80 80 VAL HA H 80 4.370 5.026 -0.656 1 1 873 . 13 1 1 A 80 80 VAL C C 80 174.948 174.987 -0.039 1 1 874 . 13 1 1 A 80 80 VAL CA C 80 61.190 59.769 1.421 1 1 875 . 13 1 1 A 80 80 VAL CB C 80 34.204 34.771 -0.567 1 1 877 . 13 1 1 A 80 80 VAL N N 80 120.567 117.419 3.148 1 1 878 . 13 1 1 A 81 81 GLU H H 81 8.570 9.105 -0.535 1 1 879 . 13 1 1 A 81 81 GLU HA H 81 4.770 5.376 -0.606 1 1 883 . 13 1 1 A 81 81 GLU C C 81 175.491 175.741 -0.250 1 1 884 . 13 1 1 A 81 81 GLU CA C 81 55.655 54.823 0.832 1 1 885 . 13 1 1 A 81 81 GLU CB C 81 30.415 32.959 -2.544 1 1 887 . 13 1 1 A 81 81 GLU N N 81 124.248 124.013 0.235 1 1 888 . 13 1 1 A 82 82 VAL H H 82 9.189 8.879 0.310 1 1 889 . 13 1 1 A 82 82 VAL HA H 82 4.279 4.888 -0.609 1 1 894 . 13 1 1 A 82 82 VAL C C 82 176.087 175.482 0.605 1 1 895 . 13 1 1 A 82 82 VAL CA C 82 62.672 59.943 2.729 1 1 896 . 13 1 1 A 82 82 VAL CB C 82 33.121 34.849 -1.728 1 1 898 . 13 1 1 A 82 82 VAL N N 82 127.776 117.226 10.550 1 1 899 . 13 1 1 A 83 83 THR H H 83 8.590 8.558 0.032 1 1 900 . 13 1 1 A 83 83 THR HA H 83 4.955 4.734 0.221 1 1 905 . 13 1 1 A 83 83 THR C C 83 174.688 174.773 -0.085 1 1 906 . 13 1 1 A 83 83 THR CA C 83 61.332 61.380 -0.048 1 1 907 . 13 1 1 A 83 83 THR CB C 83 70.213 69.820 0.393 1 1 909 . 13 1 1 A 83 83 THR N N 83 114.744 115.866 -1.122 1 1 910 . 13 1 1 A 84 84 SER H H 84 7.650 7.505 0.145 1 1 911 . 13 1 1 A 84 84 SER HA H 84 4.819 4.290 0.529 1 1 914 . 13 1 1 A 84 84 SER CA C 84 56.280 60.049 -3.769 1 1 915 . 13 1 1 A 84 84 SER CB C 84 63.294 63.280 0.014 1 1 916 . 13 1 1 A 84 84 SER N N 84 118.038 118.578 -0.540 1 1 917 . 13 1 1 A 85 85 GLU H H 85 8.391 8.713 -0.322 1 1 918 . 13 1 1 A 85 85 GLU HA H 85 3.661 3.967 -0.306 1 1 923 . 13 1 1 A 85 85 GLU C C 85 177.520 178.599 -1.079 1 1 924 . 13 1 1 A 85 85 GLU CA C 85 62.429 59.685 2.744 1 1 925 . 13 1 1 A 85 85 GLU CB C 85 29.655 29.368 0.287 1 1 927 . 13 1 1 A 86 86 ALA H H 86 8.443 8.188 0.255 1 1 928 . 13 1 1 A 86 86 ALA HA H 86 4.027 4.053 -0.026 1 1 932 . 13 1 1 A 86 86 ALA C C 86 180.423 179.962 0.461 1 1 933 . 13 1 1 A 86 86 ALA CA C 86 55.145 54.916 0.229 1 1 934 . 13 1 1 A 86 86 ALA CB C 86 18.165 18.012 0.153 1 1 935 . 13 1 1 A 86 86 ALA N N 86 119.636 123.142 -3.506 1 1 936 . 13 1 1 A 87 87 ALA H H 87 7.214 7.488 -0.274 1 1 937 . 13 1 1 A 87 87 ALA HA H 87 4.244 4.078 0.166 1 1 941 . 13 1 1 A 87 87 ALA C C 87 180.354 180.117 0.237 1 1 942 . 13 1 1 A 87 87 ALA CA C 87 54.378 55.048 -0.670 1 1 943 . 13 1 1 A 87 87 ALA CB C 87 18.795 18.659 0.136 1 1 944 . 13 1 1 A 87 87 ALA N N 87 121.004 120.773 0.231 1 1 945 . 13 1 1 A 88 88 ILE H H 88 8.471 7.509 0.962 1 1 946 . 13 1 1 A 88 88 ILE HA H 88 3.360 3.736 -0.376 1 1 954 . 13 1 1 A 88 88 ILE CA C 88 66.323 64.632 1.691 1 1 955 . 13 1 1 A 88 88 ILE CB C 88 37.808 37.949 -0.141 1 1 958 . 13 1 1 A 88 88 ILE N N 88 120.743 119.692 1.051 1 1 959 . 13 1 1 A 89 89 VAL H H 89 8.343 8.312 0.031 1 1 960 . 13 1 1 A 89 89 VAL HA H 89 3.061 3.453 -0.392 1 1 968 . 13 1 1 A 89 89 VAL C C 89 176.708 177.871 -1.163 1 1 969 . 13 1 1 A 89 89 VAL CA C 89 67.833 66.500 1.333 1 1 970 . 13 1 1 A 89 89 VAL CB C 89 31.509 31.474 0.035 1 1 973 . 13 1 1 A 89 89 VAL N N 89 118.049 119.743 -1.694 1 1 974 . 13 1 1 A 90 90 ALA H H 90 7.516 7.776 -0.260 1 1 975 . 13 1 1 A 90 90 ALA HA H 90 3.987 3.860 0.127 1 1 979 . 13 1 1 A 90 90 ALA C C 90 180.744 179.398 1.346 1 1 980 . 13 1 1 A 90 90 ALA CA C 90 55.481 55.586 -0.105 1 1 981 . 13 1 1 A 90 90 ALA CB C 90 17.953 17.858 0.095 1 1 982 . 13 1 1 A 90 90 ALA N N 90 118.935 122.030 -3.095 1 1 983 . 13 1 1 A 91 91 GLN H H 91 7.886 8.002 -0.116 1 1 984 . 13 1 1 A 91 91 GLN HA H 91 4.190 4.021 0.169 1 1 991 . 13 1 1 A 91 91 GLN C C 91 178.832 178.683 0.149 1 1 992 . 13 1 1 A 91 91 GLN CA C 91 58.519 58.845 -0.326 1 1 993 . 13 1 1 A 91 91 GLN CB C 91 28.091 28.411 -0.320 1 1 995 . 13 1 1 A 91 91 GLN N N 91 117.846 117.952 -0.106 1 1 997 . 13 1 1 A 92 92 LEU H H 92 8.751 8.665 0.086 1 1 998 . 13 1 1 A 92 92 LEU HA H 92 3.903 3.922 -0.019 1 1 1007 . 13 1 1 A 92 92 LEU C C 92 178.997 179.101 -0.104 1 1 1008 . 13 1 1 A 92 92 LEU CA C 92 58.136 57.906 0.230 1 1 1009 . 13 1 1 A 92 92 LEU CB C 92 41.576 41.732 -0.156 1 1 1013 . 13 1 1 A 92 92 LEU N N 92 119.547 119.784 -0.237 1 1 1014 . 13 1 1 A 93 93 PHE H H 93 8.648 7.962 0.686 1 1 1015 . 13 1 1 A 93 93 PHE HA H 93 4.270 4.197 0.073 1 1 1020 . 13 1 1 A 93 93 PHE C C 93 179.283 178.788 0.495 1 1 1021 . 13 1 1 A 93 93 PHE CA C 93 59.860 60.548 -0.688 1 1 1022 . 13 1 1 A 93 93 PHE CB C 93 37.765 38.239 -0.474 1 1 1025 . 13 1 1 A 93 93 PHE N N 93 118.041 118.846 -0.805 1 1 1026 . 13 1 1 A 94 94 GLU H H 94 7.739 8.490 -0.751 1 1 1027 . 13 1 1 A 94 94 GLU HA H 94 4.110 4.135 -0.025 1 1 1031 . 13 1 1 A 94 94 GLU C C 94 178.629 178.903 -0.274 1 1 1032 . 13 1 1 A 94 94 GLU CA C 94 59.359 59.388 -0.029 1 1 1033 . 13 1 1 A 94 94 GLU CB C 94 29.589 28.706 0.883 1 1 1035 . 13 1 1 A 94 94 GLU N N 94 119.980 117.219 2.761 1 1 1036 . 13 1 1 A 95 95 LEU H H 95 7.999 8.270 -0.271 1 1 1037 . 13 1 1 A 95 95 LEU HA H 95 4.139 3.939 0.200 1 1 1047 . 13 1 1 A 95 95 LEU C C 95 178.965 178.635 0.330 1 1 1048 . 13 1 1 A 95 95 LEU CA C 95 57.557 57.865 -0.308 1 1 1049 . 13 1 1 A 95 95 LEU CB C 95 43.443 41.603 1.840 1 1 1053 . 13 1 1 A 95 95 LEU N N 95 118.398 121.564 -3.166 1 1 1054 . 13 1 1 A 96 96 LEU H H 96 8.363 7.763 0.600 1 1 1055 . 13 1 1 A 96 96 LEU HA H 96 4.503 4.188 0.315 1 1 1061 . 13 1 1 A 96 96 LEU C C 96 177.932 177.192 0.740 1 1 1062 . 13 1 1 A 96 96 LEU CA C 96 54.700 55.251 -0.551 1 1 1063 . 13 1 1 A 96 96 LEU CB C 96 43.048 42.598 0.450 1 1 1065 . 13 1 1 A 96 96 LEU N N 96 114.720 116.690 -1.970 1 1 1066 . 13 1 1 A 97 97 GLY H H 97 7.810 8.180 -0.370 1 1 1067 . 13 1 1 A 97 97 GLY HA2 H 97 3.963 3.901 0.062 1 1 1068 . 13 1 1 A 97 97 GLY C C 97 173.535 174.297 -0.762 1 1 1069 . 13 1 1 A 97 97 GLY CA C 97 45.667 46.471 -0.804 1 1 1070 . 13 1 1 A 97 97 GLY N N 97 109.511 106.778 2.733 1 1 1071 . 13 1 1 A 98 98 SER H H 98 8.131 8.080 0.051 1 1 1072 . 13 1 1 A 98 98 SER HA H 98 4.225 4.658 -0.433 1 1 1075 . 13 1 1 A 98 98 SER C C 98 174.974 174.114 0.860 1 1 1076 . 13 1 1 A 98 98 SER CA C 98 57.960 57.493 0.467 1 1 1077 . 13 1 1 A 98 98 SER CB C 98 63.997 64.654 -0.657 1 1 1078 . 13 1 1 A 98 98 SER N N 98 113.405 115.226 -1.821 1 1 1079 . 13 1 1 A 99 99 GLY H H 99 8.052 8.899 -0.847 1 1 1080 . 13 1 1 A 99 99 GLY HA2 H 99 3.998 3.963 0.035 1 1 1081 . 13 1 1 A 99 99 GLY HA3 H 99 3.778 4.014 -0.236 1 1 1082 . 13 1 1 A 99 99 GLY C C 99 174.033 174.257 -0.224 1 1 1083 . 13 1 1 A 99 99 GLY CA C 99 45.123 45.370 -0.247 1 1 1084 . 13 1 1 A 99 99 GLY N N 99 111.534 113.445 -1.911 1 1 1085 . 13 1 1 A 100 100 GLU H H 100 8.177 7.628 0.549 1 1 1086 . 13 1 1 A 100 100 GLU HA H 100 4.201 4.355 -0.154 1 1 1091 . 13 1 1 A 100 100 GLU C C 100 175.830 176.155 -0.325 1 1 1092 . 13 1 1 A 100 100 GLU CA C 100 56.442 56.738 -0.296 1 1 1093 . 13 1 1 A 100 100 GLU CB C 100 30.428 30.501 -0.073 1 1 1095 . 13 1 1 A 100 100 GLU N N 100 120.463 120.505 -0.042 1 1 1096 . 13 1 1 A 101 101 GLN H H 101 8.161 8.512 -0.351 1 1 1097 . 13 1 1 A 101 101 GLN HA H 101 4.098 4.211 -0.113 1 1 1103 . 13 1 1 A 101 101 GLN C C 101 175.412 175.803 -0.391 1 1 1104 . 13 1 1 A 101 101 GLN CA C 101 55.632 56.350 -0.718 1 1 1105 . 13 1 1 A 101 101 GLN CB C 101 29.569 29.006 0.563 1 1 1107 . 13 1 1 A 101 101 GLN N N 101 120.014 121.151 -1.137 1 1 1109 . 13 1 1 A 102 102 LYS H H 102 8.235 8.472 -0.237 1 1 1110 . 13 1 1 A 102 102 LYS HA H 102 4.387 3.987 0.400 1 1 1117 . 13 1 1 A 102 102 LYS CA C 102 54.116 54.583 -0.467 1 1 1118 . 13 1 1 A 102 102 LYS CB C 102 32.478 32.285 0.193 1 1 1122 . 13 1 1 A 102 102 LYS N N 102 123.399 122.837 0.562 1 1 1123 . 13 1 1 A 103 103 PRO HA H 103 4.498 4.396 0.102 1 1 1129 . 13 1 1 A 103 103 PRO C C 103 175.473 176.906 -1.433 1 1 1130 . 13 1 1 A 103 103 PRO CA C 103 62.802 65.557 -2.755 1 1 1131 . 13 1 1 A 103 103 PRO CB C 103 32.124 31.612 0.512 1 1 1134 . 13 1 1 A 104 104 ALA H H 104 8.017 7.265 0.752 1 1 1135 . 13 1 1 A 104 104 ALA HA H 104 4.318 4.355 -0.037 1 1 1139 . 13 1 1 A 104 104 ALA C C 104 176.717 176.915 -0.198 1 1 1140 . 13 1 1 A 104 104 ALA CA C 104 52.194 53.344 -1.150 1 1 1141 . 13 1 1 A 104 104 ALA CB C 104 20.113 20.323 -0.210 1 1 1142 . 13 1 1 A 104 104 ALA N N 104 122.093 117.322 4.771 1 1 1143 . 13 1 1 A 105 105 GLY H H 105 7.678 8.293 -0.615 1 1 1144 . 13 1 1 A 105 105 GLY HA2 H 105 3.851 4.068 -0.217 1 1 1145 . 13 1 1 A 105 105 GLY HA3 H 105 4.053 4.090 -0.037 1 1 1146 . 13 1 1 A 105 105 GLY C C 105 172.990 174.835 -1.845 1 1 1147 . 13 1 1 A 105 105 GLY CA C 105 44.241 43.870 0.371 1 1 1148 . 13 1 1 A 105 105 GLY N N 105 105.234 104.386 0.848 1 1 1149 . 13 1 1 A 106 106 VAL H H 106 8.409 8.668 -0.259 1 1 1150 . 13 1 1 A 106 106 VAL HA H 106 2.829 3.337 -0.508 1 1 1158 . 13 1 1 A 106 106 VAL C C 106 177.822 177.261 0.561 1 1 1159 . 13 1 1 A 106 106 VAL CA C 106 65.522 65.615 -0.093 1 1 1160 . 13 1 1 A 106 106 VAL CB C 106 30.701 30.811 -0.110 1 1 1163 . 13 1 1 A 106 106 VAL N N 106 119.215 118.053 1.162 1 1 1164 . 13 1 1 A 107 107 ALA H H 107 8.707 8.359 0.348 1 1 1165 . 13 1 1 A 107 107 ALA HA H 107 3.730 3.847 -0.117 1 1 1169 . 13 1 1 A 107 107 ALA C C 107 179.661 180.140 -0.479 1 1 1170 . 13 1 1 A 107 107 ALA CA C 107 54.995 55.387 -0.392 1 1 1171 . 13 1 1 A 107 107 ALA CB C 107 17.705 18.011 -0.306 1 1 1172 . 13 1 1 A 107 107 ALA N N 107 118.672 121.985 -3.313 1 1 1173 . 13 1 1 A 108 108 ALA H H 108 7.388 7.822 -0.434 1 1 1174 . 13 1 1 A 108 108 ALA HA H 108 4.259 4.040 0.219 1 1 1178 . 13 1 1 A 108 108 ALA C C 108 179.318 179.447 -0.129 1 1 1179 . 13 1 1 A 108 108 ALA CA C 108 53.481 55.058 -1.577 1 1 1180 . 13 1 1 A 108 108 ALA CB C 108 19.367 18.524 0.843 1 1 1181 . 13 1 1 A 108 108 ALA N N 108 116.635 120.487 -3.852 1 1 1182 . 13 1 1 A 109 109 VAL H H 109 7.689 7.675 0.014 1 1 1183 . 13 1 1 A 109 109 VAL HA H 109 4.532 3.855 0.677 1 1 1191 . 13 1 1 A 109 109 VAL C C 109 176.055 178.011 -1.956 1 1 1192 . 13 1 1 A 109 109 VAL CA C 109 61.452 65.677 -4.225 1 1 1193 . 13 1 1 A 109 109 VAL CB C 109 32.728 31.295 1.433 1 1 1196 . 13 1 1 A 109 109 VAL N N 109 112.851 117.148 -4.297 1 1 1197 . 13 1 1 A 110 110 LEU H H 110 7.099 8.123 -1.024 1 1 1198 . 13 1 1 A 110 110 LEU HA H 110 3.723 3.781 -0.058 1 1 1208 . 13 1 1 A 110 110 LEU C C 110 179.040 178.775 0.265 1 1 1209 . 13 1 1 A 110 110 LEU CA C 110 58.825 57.899 0.926 1 1 1210 . 13 1 1 A 110 110 LEU CB C 110 41.242 41.737 -0.495 1 1 1214 . 13 1 1 A 110 110 LEU N N 110 119.829 124.657 -4.828 1 1 1215 . 13 1 1 A 111 111 GLY H H 111 8.435 7.664 0.771 1 1 1216 . 13 1 1 A 111 111 GLY HA2 H 111 3.970 3.801 0.169 1 1 1217 . 13 1 1 A 111 111 GLY HA3 H 111 3.885 3.804 0.081 1 1 1218 . 13 1 1 A 111 111 GLY C C 111 178.031 176.485 1.546 1 1 1219 . 13 1 1 A 111 111 GLY CA C 111 46.961 47.619 -0.658 1 1 1220 . 13 1 1 A 111 111 GLY N N 111 104.089 106.529 -2.440 1 1 1221 . 13 1 1 A 112 112 SER H H 112 8.343 7.854 0.489 1 1 1222 . 13 1 1 A 112 112 SER HA H 112 4.266 4.189 0.077 1 1 1224 . 13 1 1 A 112 112 SER C C 112 175.885 175.418 0.467 1 1 1225 . 13 1 1 A 112 112 SER CA C 112 61.304 62.476 -1.172 1 1 1226 . 13 1 1 A 112 112 SER CB C 112 62.901 63.063 -0.162 1 1 1227 . 13 1 1 A 112 112 SER N N 112 119.497 119.384 0.113 1 1 1228 . 13 1 1 A 113 113 LEU H H 113 7.667 8.164 -0.497 1 1 1229 . 13 1 1 A 113 113 LEU HA H 113 4.343 4.178 0.165 1 1 1238 . 13 1 1 A 113 113 LEU C C 113 174.760 175.963 -1.203 1 1 1239 . 13 1 1 A 113 113 LEU CA C 113 54.228 54.693 -0.465 1 1 1240 . 13 1 1 A 113 113 LEU CB C 113 41.467 42.247 -0.780 1 1 1244 . 13 1 1 A 113 113 LEU N N 113 118.843 117.828 1.015 1 1 1245 . 13 1 1 A 114 114 LYS H H 114 7.685 7.520 0.165 1 1 1246 . 13 1 1 A 114 114 LYS HA H 114 3.958 3.840 0.118 1 1 1250 . 13 1 1 A 114 114 LYS C C 114 177.557 175.564 1.993 1 1 1251 . 13 1 1 A 114 114 LYS CA C 114 56.935 57.376 -0.441 1 1 1252 . 13 1 1 A 114 114 LYS CB C 114 28.898 29.459 -0.561 1 1 1254 . 13 1 1 A 114 114 LYS N N 114 114.072 116.523 -2.451 1 1 1255 . 13 1 1 A 115 115 LEU H H 115 8.329 8.195 0.134 1 1 1256 . 13 1 1 A 115 115 LEU HA H 115 4.315 4.391 -0.076 1 1 1265 . 13 1 1 A 115 115 LEU C C 115 175.988 176.709 -0.721 1 1 1266 . 13 1 1 A 115 115 LEU CA C 115 54.310 55.064 -0.754 1 1 1267 . 13 1 1 A 115 115 LEU CB C 115 44.163 42.589 1.574 1 1 1270 . 13 1 1 A 115 115 LEU N N 115 117.951 119.758 -1.807 1 1 1271 . 13 1 1 A 116 116 GLN H H 116 9.100 9.074 0.026 1 1 1272 . 13 1 1 A 116 116 GLN HA H 116 4.898 5.130 -0.232 1 1 1279 . 13 1 1 A 116 116 GLN CA C 116 53.467 53.988 -0.521 1 1 1280 . 13 1 1 A 116 116 GLN CB C 116 32.730 32.293 0.437 1 1 1282 . 13 1 1 A 116 116 GLN N N 116 119.994 120.394 -0.400 1 1 1284 . 13 1 1 A 117 117 GLU H H 117 8.849 8.702 0.147 1 1 1285 . 13 1 1 A 117 117 GLU HA H 117 3.707 4.324 -0.617 1 1 1290 . 13 1 1 A 117 117 GLU C C 117 177.303 177.135 0.168 1 1 1291 . 13 1 1 A 117 117 GLU CA C 117 57.233 56.362 0.871 1 1 1292 . 13 1 1 A 117 117 GLU CB C 117 29.634 29.382 0.252 1 1 1294 . 13 1 1 A 117 117 GLU N N 117 121.487 124.170 -2.683 1 1 1295 . 13 1 1 A 118 118 VAL H H 118 8.983 8.848 0.135 1 1 1296 . 13 1 1 A 118 118 VAL HA H 118 4.360 4.058 0.302 1 1 1304 . 13 1 1 A 118 118 VAL C C 118 174.171 175.122 -0.951 1 1 1305 . 13 1 1 A 118 118 VAL CA C 118 61.772 63.507 -1.735 1 1 1306 . 13 1 1 A 118 118 VAL CB C 118 34.095 32.733 1.362 1 1 1309 . 13 1 1 A 118 118 VAL N N 118 122.933 128.593 -5.660 1 1 1310 . 13 1 1 A 119 119 ALA H H 119 7.023 7.027 -0.004 1 1 1311 . 13 1 1 A 119 119 ALA HA H 119 4.378 4.376 0.002 1 1 1315 . 13 1 1 A 119 119 ALA C C 119 175.493 174.793 0.700 1 1 1316 . 13 1 1 A 119 119 ALA CA C 119 51.956 51.061 0.895 1 1 1317 . 13 1 1 A 119 119 ALA CB C 119 23.957 21.581 2.376 1 1 1318 . 13 1 1 A 119 119 ALA N N 119 117.379 121.726 -4.347 1 1 1319 . 13 1 1 A 120 120 SER H H 120 6.999 8.338 -1.339 1 1 1320 . 13 1 1 A 120 120 SER HA H 120 5.208 5.336 -0.128 1 1 1323 . 13 1 1 A 120 120 SER C C 120 173.082 172.516 0.566 1 1 1324 . 13 1 1 A 120 120 SER CA C 120 56.754 56.237 0.517 1 1 1325 . 13 1 1 A 120 120 SER CB C 120 64.605 65.074 -0.469 1 1 1326 . 13 1 1 A 120 120 SER N N 120 113.743 116.757 -3.014 1 1 1327 . 13 1 1 A 121 121 PHE H H 121 8.244 9.149 -0.905 1 1 1328 . 13 1 1 A 121 121 PHE HA H 121 5.177 5.335 -0.158 1 1 1333 . 13 1 1 A 121 121 PHE C C 121 173.569 172.255 1.314 1 1 1334 . 13 1 1 A 121 121 PHE CA C 121 55.555 55.790 -0.235 1 1 1335 . 13 1 1 A 121 121 PHE CB C 121 40.959 41.732 -0.773 1 1 1338 . 13 1 1 A 121 121 PHE N N 121 120.358 121.918 -1.560 1 1 1339 . 13 1 1 A 122 122 ILE H H 122 8.907 8.857 0.050 1 1 1340 . 13 1 1 A 122 122 ILE HA H 122 4.682 5.140 -0.458 1 1 1348 . 13 1 1 A 122 122 ILE C C 122 176.925 175.241 1.684 1 1 1349 . 13 1 1 A 122 122 ILE CA C 122 60.740 60.117 0.623 1 1 1350 . 13 1 1 A 122 122 ILE CB C 122 39.497 40.602 -1.105 1 1 1353 . 13 1 1 A 122 122 ILE N N 122 121.282 119.944 1.338 1 1 1354 . 13 1 1 A 123 123 THR H H 123 9.022 9.044 -0.022 1 1 1355 . 13 1 1 A 123 123 THR HA H 123 5.039 4.782 0.257 1 1 1360 . 13 1 1 A 123 123 THR C C 123 173.531 174.097 -0.566 1 1 1361 . 13 1 1 A 123 123 THR CA C 123 62.266 62.368 -0.102 1 1 1362 . 13 1 1 A 123 123 THR CB C 123 70.677 69.089 1.588 1 1 1364 . 13 1 1 A 123 123 THR N N 123 128.965 123.581 5.384 1 1 1365 . 13 1 1 A 124 124 THR H H 124 8.961 9.049 -0.088 1 1 1366 . 13 1 1 A 124 124 THR HA H 124 5.001 4.994 0.007 1 1 1371 . 13 1 1 A 124 124 THR C C 124 173.468 172.667 0.801 1 1 1372 . 13 1 1 A 124 124 THR CA C 124 62.109 61.937 0.172 1 1 1373 . 13 1 1 A 124 124 THR CB C 124 70.450 69.511 0.939 1 1 1375 . 13 1 1 A 124 124 THR N N 124 122.176 123.977 -1.801 1 1 1376 . 13 1 1 A 125 125 ARG H H 125 9.386 9.400 -0.014 1 1 1377 . 13 1 1 A 125 125 ARG HA H 125 5.764 5.336 0.428 1 1 1384 . 13 1 1 A 125 125 ARG C C 125 175.713 174.492 1.221 1 1 1385 . 13 1 1 A 125 125 ARG CA C 125 53.991 54.565 -0.574 1 1 1386 . 13 1 1 A 125 125 ARG CB C 125 33.557 32.882 0.675 1 1 1389 . 13 1 1 A 125 125 ARG N N 125 130.004 129.205 0.799 1 1 1390 . 13 1 1 A 126 126 SER H H 126 9.172 9.647 -0.475 1 1 1391 . 13 1 1 A 126 126 SER HA H 126 5.390 5.191 0.199 1 1 1394 . 13 1 1 A 126 126 SER C C 126 172.359 172.815 -0.456 1 1 1395 . 13 1 1 A 126 126 SER CA C 126 56.934 56.764 0.170 1 1 1396 . 13 1 1 A 126 126 SER CB C 126 65.827 64.987 0.840 1 1 1397 . 13 1 1 A 126 126 SER N N 126 119.906 122.283 -2.377 1 1 1398 . 13 1 1 A 127 127 SER H H 127 8.591 9.379 -0.788 1 1 1399 . 13 1 1 A 127 127 SER HA H 127 5.739 5.283 0.456 1 1 1401 . 13 1 1 A 127 127 SER C C 127 173.283 173.556 -0.273 1 1 1402 . 13 1 1 A 127 127 SER CA C 127 57.354 57.597 -0.243 1 1 1403 . 13 1 1 A 127 127 SER CB C 127 65.412 64.261 1.151 1 1 1404 . 13 1 1 A 127 127 SER N N 127 117.914 123.723 -5.809 1 1 1405 . 13 1 1 A 128 128 TRP H H 128 9.866 10.042 -0.176 1 1 1406 . 13 1 1 A 128 128 TRP HA H 128 5.560 5.433 0.127 1 1 1415 . 13 1 1 A 128 128 TRP C C 128 175.828 174.780 1.048 1 1 1416 . 13 1 1 A 128 128 TRP CA C 128 55.852 55.554 0.298 1 1 1417 . 13 1 1 A 128 128 TRP CB C 128 32.524 32.077 0.447 1 1 1423 . 13 1 1 A 128 128 TRP N N 128 127.978 126.631 1.347 1 1 1425 . 13 1 1 A 129 129 LYS H H 129 9.424 9.452 -0.028 1 1 1426 . 13 1 1 A 129 129 LYS HA H 129 5.388 5.272 0.116 1 1 1433 . 13 1 1 A 129 129 LYS C C 129 175.254 174.224 1.030 1 1 1434 . 13 1 1 A 129 129 LYS CA C 129 54.410 54.822 -0.412 1 1 1435 . 13 1 1 A 129 129 LYS CB C 129 35.734 35.694 0.040 1 1 1439 . 13 1 1 A 129 129 LYS N N 129 121.784 125.352 -3.568 1 1 1440 . 13 1 1 A 130 130 LEU H H 130 8.933 9.454 -0.521 1 1 1441 . 13 1 1 A 130 130 LEU HA H 130 4.859 5.194 -0.335 1 1 1447 . 13 1 1 A 130 130 LEU C C 130 173.893 174.841 -0.948 1 1 1448 . 13 1 1 A 130 130 LEU CA C 130 53.848 53.666 0.182 1 1 1449 . 13 1 1 A 130 130 LEU CB C 130 46.125 45.834 0.291 1 1 1451 . 13 1 1 A 130 130 LEU N N 130 124.543 128.366 -3.823 1 1 1452 . 13 1 1 A 131 131 ALA H H 131 8.816 8.859 -0.043 1 1 1453 . 13 1 1 A 131 131 ALA HA H 131 4.776 4.879 -0.103 1 1 1457 . 13 1 1 A 131 131 ALA C C 131 176.662 176.975 -0.313 1 1 1458 . 13 1 1 A 131 131 ALA CA C 131 51.407 50.643 0.764 1 1 1459 . 13 1 1 A 131 131 ALA CB C 131 19.354 20.276 -0.922 1 1 1460 . 13 1 1 A 131 131 ALA N N 131 131.102 129.898 1.204 1 1 1461 . 13 1 1 A 132 132 LEU H H 132 8.487 8.840 -0.353 1 1 1462 . 13 1 1 A 132 132 LEU HA H 132 4.470 4.643 -0.173 1 1 1470 . 13 1 1 A 132 132 LEU C C 132 176.873 176.755 0.118 1 1 1471 . 13 1 1 A 132 132 LEU CA C 132 54.590 54.144 0.446 1 1 1472 . 13 1 1 A 132 132 LEU CB C 132 42.974 42.938 0.036 1 1 1475 . 13 1 1 A 132 132 LEU N N 132 123.724 123.953 -0.229 1 1 1476 . 13 1 1 A 133 133 SER H H 133 8.448 8.708 -0.260 1 1 1477 . 13 1 1 A 133 133 SER HA H 133 4.560 5.258 -0.698 1 1 1479 . 13 1 1 A 133 133 SER C C 133 176.043 174.635 1.408 1 1 1480 . 13 1 1 A 133 133 SER CA C 133 58.460 57.816 0.644 1 1 1481 . 13 1 1 A 133 133 SER CB C 133 63.985 65.000 -1.015 1 1 1482 . 13 1 1 A 133 133 SER N N 133 115.880 118.309 -2.429 1 1 1483 . 13 1 1 A 134 134 GLY H H 134 8.232 8.942 -0.710 1 1 1484 . 13 1 1 A 134 134 GLY HA2 H 134 4.147 4.254 -0.107 1 1 1485 . 13 1 1 A 134 134 GLY HA3 H 134 4.045 4.257 -0.212 1 1 1486 . 13 1 1 A 134 134 GLY C C 134 174.013 174.801 -0.788 1 1 1487 . 13 1 1 A 134 134 GLY CA C 134 45.337 45.663 -0.326 1 1 1488 . 13 1 1 A 134 134 GLY N N 134 109.970 113.056 -3.086 1 1 1489 . 13 1 1 A 135 135 ALA H H 135 8.424 8.126 0.298 1 1 1490 . 13 1 1 A 135 135 ALA HA H 135 4.436 3.944 0.492 1 1 1494 . 13 1 1 A 135 135 ALA C C 135 177.537 175.995 1.542 1 1 1495 . 13 1 1 A 135 135 ALA CA C 135 52.721 54.775 -2.054 1 1 1496 . 13 1 1 A 135 135 ALA CB C 135 19.265 18.116 1.149 1 1 1497 . 13 1 1 A 135 135 ALA N N 135 124.118 118.182 5.936 1 1 1498 . 13 1 1 A 136 136 HIS H H 136 8.466 7.746 0.720 1 1 1499 . 13 1 1 A 136 136 HIS HA H 136 4.379 4.829 -0.450 1 1 1500 . 13 1 1 A 136 136 HIS C C 136 176.259 173.982 2.277 1 1 1501 . 13 1 1 A 136 136 HIS CA C 136 56.082 55.399 0.683 1 1 1502 . 13 1 1 A 136 136 HIS CB C 136 29.619 33.028 -3.409 1 1 1503 . 13 1 1 A 136 136 HIS N N 136 119.493 114.031 5.462 1 1 1504 . 13 1 1 A 137 137 GLY H H 137 8.431 8.120 0.311 1 1 1505 . 13 1 1 A 137 137 GLY HA2 H 137 4.151 3.838 0.313 1 1 1506 . 13 1 1 A 137 137 GLY HA3 H 137 3.893 3.977 -0.084 1 1 1507 . 13 1 1 A 137 137 GLY C C 137 174.039 172.163 1.876 1 1 1508 . 13 1 1 A 137 137 GLY CA C 137 45.372 45.434 -0.062 1 1 1509 . 13 1 1 A 137 137 GLY N N 137 110.442 111.675 -1.233 1 1 1510 . 13 1 1 A 138 138 GLN H H 138 8.416 8.466 -0.050 1 1 1511 . 13 1 1 A 138 138 GLN HA H 138 4.455 4.761 -0.306 1 1 1515 . 13 1 1 A 138 138 GLN C C 138 175.889 174.772 1.117 1 1 1516 . 13 1 1 A 138 138 GLN CA C 138 55.866 54.575 1.291 1 1 1517 . 13 1 1 A 138 138 GLN CB C 138 29.639 30.911 -1.272 1 1 1518 . 13 1 1 A 138 138 GLN N N 138 119.401 124.724 -5.323 1 1 1519 . 13 1 1 A 139 139 GLU H H 139 8.446 8.778 -0.332 1 1 1520 . 13 1 1 A 139 139 GLU HA H 139 4.658 4.939 -0.281 1 1 1524 . 13 1 1 A 139 139 GLU CA C 139 54.589 53.676 0.913 1 1 1525 . 13 1 1 A 139 139 GLU CB C 139 29.733 30.627 -0.894 1 1 1527 . 13 1 1 A 139 139 GLU N N 139 123.136 124.784 -1.648 1 1 1528 . 13 1 1 A 140 140 PRO HA H 140 4.537 4.715 -0.178 1 1 1533 . 13 1 1 A 140 140 PRO C C 140 176.119 176.057 0.062 1 1 1534 . 13 1 1 A 140 140 PRO CA C 140 63.220 62.730 0.490 1 1 1535 . 13 1 1 A 140 140 PRO CB C 140 31.936 32.053 -0.117 1 1 1538 . 13 1 1 A 141 141 GLN H H 141 8.506 8.687 -0.181 1 1 1539 . 13 1 1 A 141 141 GLN HA H 141 4.650 4.844 -0.194 1 1 1546 . 13 1 1 A 141 141 GLN C C 141 175.811 175.709 0.102 1 1 1547 . 13 1 1 A 141 141 GLN CA C 141 55.912 55.162 0.750 1 1 1548 . 13 1 1 A 141 141 GLN CB C 141 30.241 28.979 1.262 1 1 1550 . 13 1 1 A 141 141 GLN N N 141 120.422 122.099 -1.677 1 1 1551 . 13 1 1 A 142 142 LEU H H 142 8.842 8.803 0.039 1 1 1552 . 13 1 1 A 142 142 LEU HA H 142 5.277 5.096 0.181 1 1 1562 . 13 1 1 A 142 142 LEU C C 142 176.839 175.542 1.297 1 1 1563 . 13 1 1 A 142 142 LEU CA C 142 53.927 53.067 0.860 1 1 1564 . 13 1 1 A 142 142 LEU CB C 142 44.527 44.093 0.434 1 1 1568 . 13 1 1 A 142 142 LEU N N 142 123.692 121.222 2.470 1 1 1569 . 13 1 1 A 143 143 THR H H 143 9.025 9.154 -0.129 1 1 1570 . 13 1 1 A 143 143 THR HA H 143 5.262 4.935 0.327 1 1 1575 . 13 1 1 A 143 143 THR C C 143 173.753 173.766 -0.013 1 1 1576 . 13 1 1 A 143 143 THR CA C 143 61.795 61.780 0.015 1 1 1577 . 13 1 1 A 143 143 THR CB C 143 70.660 70.545 0.115 1 1 1579 . 13 1 1 A 143 143 THR N N 143 117.222 116.655 0.567 1 1 1580 . 13 1 1 A 144 144 ILE H H 144 9.353 10.134 -0.781 1 1 1581 . 13 1 1 A 144 144 ILE HA H 144 5.399 5.284 0.115 1 1 1591 . 13 1 1 A 144 144 ILE C C 144 173.931 173.700 0.231 1 1 1592 . 13 1 1 A 144 144 ILE CA C 144 60.774 60.643 0.131 1 1 1593 . 13 1 1 A 144 144 ILE CB C 144 41.111 40.219 0.892 1 1 1597 . 13 1 1 A 144 144 ILE N N 144 126.383 127.670 -1.287 1 1 1598 . 13 1 1 A 145 145 ASP H H 145 9.214 9.547 -0.333 1 1 1599 . 13 1 1 A 145 145 ASP HA H 145 5.978 5.365 0.613 1 1 1601 . 13 1 1 A 145 145 ASP C C 145 175.441 174.848 0.593 1 1 1602 . 13 1 1 A 145 145 ASP CA C 145 53.035 52.790 0.245 1 1 1603 . 13 1 1 A 145 145 ASP CB C 145 44.153 43.819 0.334 1 1 1604 . 13 1 1 A 145 145 ASP N N 145 127.981 128.756 -0.775 1 1 1605 . 13 1 1 A 146 146 LEU H H 146 9.387 10.021 -0.634 1 1 1606 . 13 1 1 A 146 146 LEU HA H 146 4.918 5.653 -0.735 1 1 1616 . 13 1 1 A 146 146 LEU C C 146 175.003 174.603 0.400 1 1 1617 . 13 1 1 A 146 146 LEU CA C 146 53.940 53.606 0.334 1 1 1618 . 13 1 1 A 146 146 LEU CB C 146 43.902 42.720 1.182 1 1 1622 . 13 1 1 A 146 146 LEU N N 146 123.532 127.783 -4.251 1 1 1623 . 13 1 1 A 147 147 ASP H H 147 8.676 8.678 -0.002 1 1 1624 . 13 1 1 A 147 147 ASP HA H 147 5.205 5.228 -0.023 1 1 1627 . 13 1 1 A 147 147 ASP C C 147 174.956 174.554 0.402 1 1 1628 . 13 1 1 A 147 147 ASP CA C 147 53.441 52.335 1.106 1 1 1629 . 13 1 1 A 147 147 ASP CB C 147 43.370 42.984 0.386 1 1 1630 . 13 1 1 A 147 147 ASP N N 147 125.499 125.896 -0.397 1 1 1631 . 13 1 1 A 148 148 SER H H 148 8.732 9.543 -0.811 1 1 1632 . 13 1 1 A 148 148 SER HA H 148 5.365 4.969 0.396 1 1 1634 . 13 1 1 A 148 148 SER C C 148 173.217 173.431 -0.214 1 1 1635 . 13 1 1 A 148 148 SER CA C 148 56.334 55.774 0.560 1 1 1636 . 13 1 1 A 148 148 SER CB C 148 65.812 66.214 -0.402 1 1 1637 . 13 1 1 A 148 148 SER N N 148 118.623 119.701 -1.078 1 1 1638 . 13 1 1 A 149 149 ALA H H 149 8.937 9.013 -0.076 1 1 1639 . 13 1 1 A 149 149 ALA HA H 149 5.681 5.152 0.529 1 1 1643 . 13 1 1 A 149 149 ALA C C 149 178.894 177.655 1.239 1 1 1644 . 13 1 1 A 149 149 ALA CA C 149 49.996 50.426 -0.430 1 1 1645 . 13 1 1 A 149 149 ALA CB C 149 23.231 22.097 1.134 1 1 1646 . 13 1 1 A 149 149 ALA N N 149 123.952 122.971 0.981 1 1 1647 . 13 1 1 A 150 150 ASP H H 150 9.010 9.054 -0.044 1 1 1648 . 13 1 1 A 150 150 ASP HA H 150 4.336 4.348 -0.012 1 1 1651 . 13 1 1 A 150 150 ASP C C 150 176.697 177.669 -0.972 1 1 1652 . 13 1 1 A 150 150 ASP CA C 150 56.543 57.223 -0.680 1 1 1653 . 13 1 1 A 150 150 ASP CB C 150 39.850 40.285 -0.435 1 1 1654 . 13 1 1 A 150 150 ASP N N 150 122.687 126.425 -3.738 1 1 1655 . 13 1 1 A 151 151 PHE H H 151 7.295 8.338 -1.043 1 1 1656 . 13 1 1 A 151 151 PHE HA H 151 5.020 4.383 0.637 1 1 1661 . 13 1 1 A 151 151 PHE C C 151 174.756 175.898 -1.142 1 1 1662 . 13 1 1 A 151 151 PHE CA C 151 56.594 61.416 -4.822 1 1 1663 . 13 1 1 A 151 151 PHE CB C 151 37.765 40.011 -2.246 1 1 1666 . 13 1 1 A 151 151 PHE N N 151 113.928 120.733 -6.805 1 1 1667 . 13 1 1 A 152 152 GLY H H 152 7.786 7.997 -0.211 1 1 1668 . 13 1 1 A 152 152 GLY HA2 H 152 4.459 4.175 0.284 1 1 1669 . 13 1 1 A 152 152 GLY HA3 H 152 3.728 4.180 -0.452 1 1 1670 . 13 1 1 A 152 152 GLY C C 152 172.709 173.425 -0.716 1 1 1671 . 13 1 1 A 152 152 GLY CA C 152 46.106 45.468 0.638 1 1 1672 . 13 1 1 A 152 152 GLY N N 152 110.312 106.801 3.511 1 1 1673 . 13 1 1 A 153 153 TYR H H 153 6.650 7.750 -1.100 1 1 1674 . 13 1 1 A 153 153 TYR HA H 153 4.508 4.992 -0.484 1 1 1679 . 13 1 1 A 153 153 TYR C C 153 173.092 173.345 -0.253 1 1 1680 . 13 1 1 A 153 153 TYR CA C 153 57.464 57.454 0.010 1 1 1681 . 13 1 1 A 153 153 TYR CB C 153 41.962 42.304 -0.342 1 1 1684 . 13 1 1 A 153 153 TYR N N 153 121.977 119.927 2.050 1 1 1685 . 13 1 1 A 154 154 ALA H H 154 7.847 8.380 -0.533 1 1 1686 . 13 1 1 A 154 154 ALA HA H 154 5.144 4.520 0.624 1 1 1690 . 13 1 1 A 154 154 ALA C C 154 174.468 174.905 -0.437 1 1 1691 . 13 1 1 A 154 154 ALA CA C 154 51.776 51.062 0.714 1 1 1692 . 13 1 1 A 154 154 ALA CB C 154 21.747 22.533 -0.786 1 1 1693 . 13 1 1 A 154 154 ALA N N 154 130.258 129.336 0.922 1 1 1694 . 13 1 1 A 155 155 VAL H H 155 8.733 8.691 0.042 1 1 1695 . 13 1 1 A 155 155 VAL HA H 155 4.150 4.837 -0.687 1 1 1700 . 13 1 1 A 155 155 VAL C C 155 172.632 173.103 -0.471 1 1 1701 . 13 1 1 A 155 155 VAL CA C 155 61.451 59.131 2.320 1 1 1702 . 13 1 1 A 155 155 VAL CB C 155 35.883 35.253 0.630 1 1 1704 . 13 1 1 A 155 155 VAL N N 155 119.622 120.659 -1.037 1 1 1705 . 13 1 1 A 156 156 GLY H H 156 8.146 8.440 -0.294 1 1 1706 . 13 1 1 A 156 156 GLY HA2 H 156 5.125 2.546 2.579 1 1 1707 . 13 1 1 A 156 156 GLY HA3 H 156 2.061 3.843 -1.782 1 1 1708 . 13 1 1 A 156 156 GLY C C 156 171.746 171.502 0.244 1 1 1709 . 13 1 1 A 156 156 GLY CA C 156 43.319 43.882 -0.563 1 1 1710 . 13 1 1 A 156 156 GLY N N 156 113.332 113.661 -0.329 1 1 1711 . 13 1 1 A 157 157 GLU H H 157 8.967 9.294 -0.327 1 1 1712 . 13 1 1 A 157 157 GLU HA H 157 5.217 4.984 0.233 1 1 1716 . 13 1 1 A 157 157 GLU C C 157 174.476 175.370 -0.894 1 1 1717 . 13 1 1 A 157 157 GLU CA C 157 55.390 54.933 0.457 1 1 1718 . 13 1 1 A 157 157 GLU CB C 157 34.010 32.908 1.102 1 1 1720 . 13 1 1 A 157 157 GLU N N 157 120.823 124.128 -3.305 1 1 1721 . 13 1 1 A 158 158 VAL H H 158 9.076 9.194 -0.118 1 1 1722 . 13 1 1 A 158 158 VAL HA H 158 5.206 5.106 0.100 1 1 1727 . 13 1 1 A 158 158 VAL C C 158 173.900 174.276 -0.376 1 1 1728 . 13 1 1 A 158 158 VAL CA C 158 60.813 61.278 -0.465 1 1 1729 . 13 1 1 A 158 158 VAL CB C 158 33.385 34.366 -0.981 1 1 1731 . 13 1 1 A 158 158 VAL N N 158 124.349 123.958 0.391 1 1 1732 . 13 1 1 A 159 159 GLU H H 159 9.239 9.601 -0.362 1 1 1733 . 13 1 1 A 159 159 GLU HA H 159 5.647 5.164 0.483 1 1 1738 . 13 1 1 A 159 159 GLU C C 159 174.469 175.311 -0.842 1 1 1739 . 13 1 1 A 159 159 GLU CA C 159 54.473 54.652 -0.179 1 1 1740 . 13 1 1 A 159 159 GLU CB C 159 33.852 32.753 1.099 1 1 1742 . 13 1 1 A 159 159 GLU N N 159 125.772 128.842 -3.070 1 1 1743 . 13 1 1 A 160 160 ALA H H 160 9.250 9.232 0.018 1 1 1744 . 13 1 1 A 160 160 ALA HA H 160 4.966 5.352 -0.386 1 1 1748 . 13 1 1 A 160 160 ALA C C 160 175.114 175.781 -0.667 1 1 1749 . 13 1 1 A 160 160 ALA CA C 160 50.644 50.218 0.426 1 1 1750 . 13 1 1 A 160 160 ALA CB C 160 23.263 23.064 0.199 1 1 1751 . 13 1 1 A 160 160 ALA N N 160 125.092 129.489 -4.397 1 1 1752 . 13 1 1 A 161 161 MET H H 161 8.559 8.913 -0.354 1 1 1753 . 13 1 1 A 161 161 MET HA H 161 5.468 5.776 -0.308 1 1 1761 . 13 1 1 A 161 161 MET C C 161 176.265 174.988 1.277 1 1 1762 . 13 1 1 A 161 161 MET CA C 161 53.818 54.275 -0.457 1 1 1763 . 13 1 1 A 161 161 MET CB C 161 34.380 35.573 -1.193 1 1 1766 . 13 1 1 A 161 161 MET N N 161 118.699 119.541 -0.842 1 1 1767 . 13 1 1 A 162 162 VAL H H 162 9.046 8.957 0.089 1 1 1768 . 13 1 1 A 162 162 VAL HA H 162 4.841 4.833 0.008 1 1 1776 . 13 1 1 A 162 162 VAL C C 162 174.794 175.724 -0.930 1 1 1777 . 13 1 1 A 162 162 VAL CA C 162 59.107 59.411 -0.304 1 1 1778 . 13 1 1 A 162 162 VAL CB C 162 34.018 34.169 -0.151 1 1 1781 . 13 1 1 A 162 162 VAL N N 162 116.435 118.894 -2.459 1 1 1782 . 13 1 1 A 163 163 HIS H H 163 8.793 8.343 0.450 1 1 1783 . 13 1 1 A 163 163 HIS HA H 163 4.717 4.653 0.064 1 1 1787 . 13 1 1 A 163 163 HIS C C 163 175.460 174.662 0.798 1 1 1788 . 13 1 1 A 163 163 HIS CA C 163 58.488 57.539 0.949 1 1 1789 . 13 1 1 A 163 163 HIS CB C 163 31.185 30.930 0.255 1 1 1791 . 13 1 1 A 163 163 HIS N N 163 117.838 120.480 -2.642 1 1 1792 . 13 1 1 A 164 164 GLU H H 164 8.013 7.457 0.556 1 1 1793 . 13 1 1 A 164 164 GLU HA H 164 4.814 4.640 0.174 1 1 1797 . 13 1 1 A 164 164 GLU C C 164 176.910 176.396 0.514 1 1 1798 . 13 1 1 A 164 164 GLU CA C 164 54.355 54.742 -0.387 1 1 1799 . 13 1 1 A 164 164 GLU CB C 164 32.886 31.961 0.925 1 1 1801 . 13 1 1 A 164 164 GLU N N 164 115.943 117.475 -1.532 1 1 1802 . 13 1 1 A 165 165 LYS H H 165 9.088 8.948 0.140 1 1 1803 . 13 1 1 A 165 165 LYS HA H 165 3.942 4.045 -0.103 1 1 1809 . 13 1 1 A 165 165 LYS C C 165 179.657 177.783 1.874 1 1 1810 . 13 1 1 A 165 165 LYS CA C 165 59.888 58.259 1.629 1 1 1811 . 13 1 1 A 165 165 LYS CB C 165 32.024 32.488 -0.464 1 1 1814 . 13 1 1 A 165 165 LYS N N 165 124.120 124.920 -0.800 1 1 1815 . 13 1 1 A 166 166 ALA H H 166 8.851 7.619 1.232 1 1 1816 . 13 1 1 A 166 166 ALA HA H 166 4.251 4.128 0.123 1 1 1820 . 13 1 1 A 166 166 ALA C C 166 178.920 177.963 0.957 1 1 1821 . 13 1 1 A 166 166 ALA CA C 166 54.318 53.947 0.371 1 1 1822 . 13 1 1 A 166 166 ALA CB C 166 18.810 18.309 0.501 1 1 1823 . 13 1 1 A 166 166 ALA N N 166 120.424 122.338 -1.914 1 1 1824 . 13 1 1 A 167 167 GLU H H 167 7.871 8.222 -0.351 1 1 1825 . 13 1 1 A 167 167 GLU HA H 167 4.404 4.427 -0.023 1 1 1829 . 13 1 1 A 167 167 GLU C C 167 177.368 177.821 -0.453 1 1 1830 . 13 1 1 A 167 167 GLU CA C 167 56.701 56.224 0.477 1 1 1831 . 13 1 1 A 167 167 GLU CB C 167 31.208 29.528 1.680 1 1 1833 . 13 1 1 A 167 167 GLU N N 167 114.926 115.108 -0.182 1 1 1834 . 13 1 1 A 168 168 VAL H H 168 7.812 7.412 0.400 1 1 1835 . 13 1 1 A 168 168 VAL HA H 168 3.712 3.689 0.023 1 1 1843 . 13 1 1 A 168 168 VAL CA C 168 68.705 67.841 0.864 1 1 1844 . 13 1 1 A 168 168 VAL CB C 168 29.597 29.616 -0.019 1 1 1847 . 13 1 1 A 168 168 VAL N N 168 120.188 121.641 -1.453 1 1 1848 . 13 1 1 A 169 169 PRO HA H 169 4.252 4.243 0.009 1 1 1851 . 13 1 1 A 169 169 PRO C C 169 179.563 178.607 0.956 1 1 1852 . 13 1 1 A 169 169 PRO CA C 169 67.077 66.800 0.277 1 1 1853 . 13 1 1 A 170 170 ALA H H 170 8.149 8.205 -0.056 1 1 1854 . 13 1 1 A 170 170 ALA HA H 170 4.265 4.045 0.220 1 1 1858 . 13 1 1 A 170 170 ALA C C 170 180.637 179.798 0.839 1 1 1859 . 13 1 1 A 170 170 ALA CA C 170 54.823 55.335 -0.512 1 1 1860 . 13 1 1 A 170 170 ALA CB C 170 18.518 17.851 0.667 1 1 1861 . 13 1 1 A 170 170 ALA N N 170 119.210 119.454 -0.244 1 1 1862 . 13 1 1 A 171 171 ALA H H 171 7.767 7.914 -0.147 1 1 1863 . 13 1 1 A 171 171 ALA HA H 171 4.106 4.121 -0.015 1 1 1867 . 13 1 1 A 171 171 ALA C C 171 179.371 180.101 -0.730 1 1 1868 . 13 1 1 A 171 171 ALA CA C 171 55.130 55.178 -0.048 1 1 1869 . 13 1 1 A 171 171 ALA CB C 171 18.291 17.912 0.379 1 1 1870 . 13 1 1 A 171 171 ALA N N 171 122.126 121.074 1.052 1 1 1871 . 13 1 1 A 172 172 LEU H H 172 8.950 8.423 0.527 1 1 1872 . 13 1 1 A 172 172 LEU HA H 172 3.987 4.101 -0.114 1 1 1878 . 13 1 1 A 172 172 LEU C C 172 178.355 178.633 -0.278 1 1 1879 . 13 1 1 A 172 172 LEU CA C 172 57.803 58.099 -0.296 1 1 1880 . 13 1 1 A 172 172 LEU CB C 172 41.667 41.734 -0.067 1 1 1882 . 13 1 1 A 172 172 LEU N N 172 118.682 123.177 -4.495 1 1 1883 . 13 1 1 A 173 173 GLU H H 173 7.886 7.812 0.074 1 1 1884 . 13 1 1 A 173 173 GLU HA H 173 4.132 3.964 0.168 1 1 1887 . 13 1 1 A 173 173 GLU C C 173 179.556 179.521 0.035 1 1 1888 . 13 1 1 A 173 173 GLU CA C 173 59.800 59.596 0.204 1 1 1889 . 13 1 1 A 173 173 GLU CB C 173 29.580 29.265 0.315 1 1 1891 . 13 1 1 A 173 173 GLU N N 173 117.561 118.616 -1.055 1 1 1892 . 13 1 1 A 174 174 LYS H H 174 7.532 7.772 -0.240 1 1 1893 . 13 1 1 A 174 174 LYS HA H 174 4.131 4.069 0.062 1 1 1901 . 13 1 1 A 174 174 LYS CA C 174 58.999 59.136 -0.137 1 1 1902 . 13 1 1 A 174 174 LYS CB C 174 32.041 32.173 -0.132 1 1 1906 . 13 1 1 A 174 174 LYS N N 174 119.085 121.253 -2.168 1 1 1907 . 13 1 1 A 175 175 ILE H H 175 8.479 7.806 0.673 1 1 1908 . 13 1 1 A 175 175 ILE HA H 175 3.583 3.603 -0.020 1 1 1918 . 13 1 1 A 175 175 ILE C C 175 179.258 178.517 0.741 1 1 1919 . 13 1 1 A 175 175 ILE CA C 175 65.769 65.614 0.155 1 1 1920 . 13 1 1 A 175 175 ILE CB C 175 37.876 38.087 -0.211 1 1 1923 . 13 1 1 A 175 175 ILE N N 175 118.828 119.226 -0.398 1 1 1924 . 13 1 1 A 176 176 ILE H H 176 8.928 7.791 1.137 1 1 1925 . 13 1 1 A 176 176 ILE HA H 176 3.600 3.582 0.018 1 1 1935 . 13 1 1 A 176 176 ILE C C 176 178.827 178.137 0.690 1 1 1936 . 13 1 1 A 176 176 ILE CA C 176 65.640 65.071 0.569 1 1 1937 . 13 1 1 A 176 176 ILE CB C 176 37.451 37.607 -0.156 1 1 1941 . 13 1 1 A 176 176 ILE N N 176 124.527 119.588 4.939 1 1 1942 . 13 1 1 A 177 177 THR H H 177 8.175 8.226 -0.051 1 1 1943 . 13 1 1 A 177 177 THR HA H 177 3.885 3.905 -0.020 1 1 1948 . 13 1 1 A 177 177 THR C C 177 176.867 176.449 0.418 1 1 1949 . 13 1 1 A 177 177 THR CA C 177 67.199 66.633 0.566 1 1 1950 . 13 1 1 A 177 177 THR CB C 177 68.377 67.948 0.429 1 1 1952 . 13 1 1 A 177 177 THR N N 177 119.412 118.682 0.730 1 1 1953 . 13 1 1 A 178 178 VAL H H 178 8.352 7.940 0.412 1 1 1954 . 13 1 1 A 178 178 VAL HA H 178 3.572 3.419 0.153 1 1 1962 . 13 1 1 A 178 178 VAL C C 178 177.664 177.932 -0.268 1 1 1963 . 13 1 1 A 178 178 VAL CA C 178 66.909 66.410 0.499 1 1 1964 . 13 1 1 A 178 178 VAL CB C 178 31.714 31.439 0.275 1 1 1967 . 13 1 1 A 178 178 VAL N N 178 121.168 121.970 -0.802 1 1 1968 . 13 1 1 A 179 179 SER H H 179 8.529 8.172 0.357 1 1 1969 . 13 1 1 A 179 179 SER HA H 179 3.099 3.246 -0.147 1 1 1972 . 13 1 1 A 179 179 SER C C 179 175.380 176.189 -0.809 1 1 1973 . 13 1 1 A 179 179 SER CA C 179 62.728 61.809 0.919 1 1 1974 . 13 1 1 A 179 179 SER CB C 179 62.802 62.488 0.314 1 1 1975 . 13 1 1 A 179 179 SER N N 179 115.226 115.625 -0.399 1 1 1976 . 13 1 1 A 180 180 SER H H 180 7.757 7.932 -0.175 1 1 1977 . 13 1 1 A 180 180 SER HA H 180 4.419 4.232 0.187 1 1 1980 . 13 1 1 A 180 180 SER C C 180 175.359 176.507 -1.148 1 1 1981 . 13 1 1 A 180 180 SER CA C 180 61.025 61.268 -0.243 1 1 1982 . 13 1 1 A 180 180 SER CB C 180 63.072 63.130 -0.058 1 1 1983 . 13 1 1 A 180 180 SER N N 180 114.718 115.952 -1.234 1 1 1984 . 13 1 1 A 181 181 MET H H 181 7.497 7.916 -0.419 1 1 1985 . 13 1 1 A 181 181 MET HA H 181 4.283 4.288 -0.005 1 1 1993 . 13 1 1 A 181 181 MET C C 181 177.217 176.739 0.478 1 1 1994 . 13 1 1 A 181 181 MET CA C 181 57.539 57.476 0.063 1 1 1995 . 13 1 1 A 181 181 MET CB C 181 33.493 32.623 0.870 1 1 1998 . 13 1 1 A 181 181 MET N N 181 119.274 118.556 0.718 1 1 1999 . 13 1 1 A 182 182 LEU H H 182 7.163 7.307 -0.144 1 1 2000 . 13 1 1 A 182 182 LEU HA H 182 4.133 4.373 -0.240 1 1 2010 . 13 1 1 A 182 182 LEU C C 182 176.289 176.664 -0.375 1 1 2011 . 13 1 1 A 182 182 LEU CA C 182 54.750 54.723 0.027 1 1 2012 . 13 1 1 A 182 182 LEU CB C 182 43.235 42.558 0.677 1 1 2016 . 13 1 1 A 182 182 LEU N N 182 115.869 117.835 -1.966 1 1 2017 . 13 1 1 A 183 183 GLY H H 183 7.492 7.199 0.293 1 1 2018 . 13 1 1 A 183 183 GLY HA2 H 183 4.086 4.167 -0.081 1 1 2019 . 13 1 1 A 183 183 GLY HA3 H 183 4.425 4.220 0.205 1 1 2020 . 13 1 1 A 183 183 GLY C C 183 171.830 172.063 -0.233 1 1 2021 . 13 1 1 A 183 183 GLY CA C 183 46.035 45.816 0.219 1 1 2022 . 13 1 1 A 183 183 GLY N N 183 107.761 106.275 1.486 1 1 2023 . 13 1 1 A 184 184 VAL H H 184 8.099 8.383 -0.284 1 1 2024 . 13 1 1 A 184 184 VAL HA H 184 4.772 4.784 -0.012 1 1 2032 . 13 1 1 A 184 184 VAL CA C 184 59.305 58.809 0.496 1 1 2033 . 13 1 1 A 184 184 VAL CB C 184 33.648 35.198 -1.550 1 1 2036 . 13 1 1 A 184 184 VAL N N 184 119.803 121.743 -1.940 1 1 2037 . 13 1 1 A 185 185 PRO HA H 185 4.442 4.767 -0.325 1 1 2042 . 13 1 1 A 185 185 PRO C C 185 175.871 176.337 -0.466 1 1 2043 . 13 1 1 A 185 185 PRO CA C 185 63.886 62.615 1.271 1 1 2044 . 13 1 1 A 185 185 PRO CB C 185 32.260 32.307 -0.047 1 1 2047 . 13 1 1 A 186 186 ALA H H 186 8.222 9.015 -0.793 1 1 2048 . 13 1 1 A 186 186 ALA HA H 186 4.569 4.967 -0.398 1 1 2052 . 13 1 1 A 186 186 ALA C C 186 177.481 175.996 1.485 1 1 2053 . 13 1 1 A 186 186 ALA CA C 186 51.823 50.529 1.294 1 1 2054 . 13 1 1 A 186 186 ALA CB C 186 20.233 21.516 -1.283 1 1 2055 . 13 1 1 A 186 186 ALA N N 186 125.663 121.773 3.890 1 1 2056 . 13 1 1 A 187 187 GLN H H 187 8.723 8.622 0.101 1 1 2057 . 13 1 1 A 187 187 GLN HA H 187 4.420 4.819 -0.399 1 1 2063 . 13 1 1 A 187 187 GLN C C 187 175.566 176.409 -0.843 1 1 2064 . 13 1 1 A 187 187 GLN CA C 187 56.051 54.262 1.789 1 1 2065 . 13 1 1 A 187 187 GLN CB C 187 29.812 30.728 -0.916 1 1 2067 . 13 1 1 A 187 187 GLN N N 187 120.742 115.536 5.206 1 1 2069 . 13 1 1 A 188 188 GLU H H 188 8.163 9.009 -0.846 1 1 2070 . 13 1 1 A 188 188 GLU HA H 188 4.405 4.009 0.396 1 1 2074 . 13 1 1 A 188 188 GLU C C 188 176.058 179.196 -3.138 1 1 2075 . 13 1 1 A 188 188 GLU CA C 188 56.158 59.420 -3.262 1 1 2076 . 13 1 1 A 188 188 GLU CB C 188 31.095 29.275 1.820 1 1 2078 . 13 1 1 A 188 188 GLU N N 188 119.177 119.459 -0.282 1 1 2079 . 13 1 1 A 189 189 GLU H H 189 8.567 8.190 0.377 1 1 2080 . 13 1 1 A 189 189 GLU HA H 189 4.252 4.072 0.180 1 1 2084 . 13 1 1 A 189 189 GLU C C 189 175.703 176.619 -0.916 1 1 2085 . 13 1 1 A 189 189 GLU CA C 189 56.417 59.331 -2.914 1 1 2086 . 13 1 1 A 189 189 GLU CB C 189 29.968 30.035 -0.067 1 1 2088 . 13 1 1 A 189 189 GLU N N 189 120.920 120.181 0.739 1 1 2089 . 13 1 1 A 190 190 ALA H H 190 8.271 7.932 0.339 1 1 2090 . 13 1 1 A 190 190 ALA HA H 190 4.626 3.991 0.635 1 1 2094 . 13 1 1 A 190 190 ALA CA C 190 50.465 52.794 -2.329 1 1 2095 . 13 1 1 A 190 190 ALA CB C 190 18.451 17.524 0.927 1 1 2096 . 13 1 1 A 190 190 ALA N N 190 128.323 120.219 8.104 1 1 2097 . 13 1 1 A 191 191 PRO HA H 191 4.493 4.483 0.010 1 1 2103 . 13 1 1 A 191 191 PRO C C 191 175.899 176.885 -0.986 1 1 2104 . 13 1 1 A 191 191 PRO CA C 191 62.044 62.608 -0.564 1 1 2105 . 13 1 1 A 191 191 PRO CB C 191 32.184 32.112 0.072 1 1 2108 . 13 1 1 A 192 192 ALA H H 192 8.610 8.208 0.402 1 1 2109 . 13 1 1 A 192 192 ALA HA H 192 4.280 4.385 -0.105 1 1 2113 . 13 1 1 A 192 192 ALA C C 192 178.282 178.148 0.134 1 1 2114 . 13 1 1 A 192 192 ALA CA C 192 51.698 52.136 -0.438 1 1 2115 . 13 1 1 A 192 192 ALA CB C 192 19.220 19.316 -0.096 1 1 2116 . 13 1 1 A 192 192 ALA N N 192 123.420 124.280 -0.860 1 1 2117 . 13 1 1 A 193 193 LYS H H 193 8.531 8.923 -0.392 1 1 2118 . 13 1 1 A 193 193 LYS HA H 193 3.294 3.880 -0.586 1 1 2126 . 13 1 1 A 193 193 LYS C C 193 177.640 178.307 -0.667 1 1 2127 . 13 1 1 A 193 193 LYS CA C 193 60.644 59.484 1.160 1 1 2128 . 13 1 1 A 193 193 LYS CB C 193 32.607 32.285 0.322 1 1 2132 . 13 1 1 A 193 193 LYS N N 193 122.851 121.251 1.600 1 1 2133 . 13 1 1 A 194 194 LEU H H 194 8.570 8.050 0.520 1 1 2134 . 13 1 1 A 194 194 LEU HA H 194 3.845 4.243 -0.398 1 1 2144 . 13 1 1 A 194 194 LEU C C 194 177.965 179.508 -1.543 1 1 2145 . 13 1 1 A 194 194 LEU CA C 194 57.611 57.452 0.159 1 1 2146 . 13 1 1 A 194 194 LEU CB C 194 41.776 40.920 0.856 1 1 2150 . 13 1 1 A 194 194 LEU N N 194 115.801 119.801 -4.000 1 1 2151 . 13 1 1 A 195 195 MET H H 195 6.782 8.039 -1.257 1 1 2152 . 13 1 1 A 195 195 MET HA H 195 4.487 4.316 0.171 1 1 2160 . 13 1 1 A 195 195 MET C C 195 178.280 178.199 0.081 1 1 2161 . 13 1 1 A 195 195 MET CA C 195 56.858 58.427 -1.569 1 1 2162 . 13 1 1 A 195 195 MET CB C 195 31.557 32.263 -0.706 1 1 2165 . 13 1 1 A 195 195 MET N N 195 113.898 119.426 -5.528 1 1 2166 . 13 1 1 A 196 196 VAL H H 196 7.713 7.420 0.293 1 1 2167 . 13 1 1 A 196 196 VAL HA H 196 3.501 3.407 0.094 1 1 2175 . 13 1 1 A 196 196 VAL C C 196 177.624 177.561 0.063 1 1 2176 . 13 1 1 A 196 196 VAL CA C 196 66.318 65.723 0.595 1 1 2177 . 13 1 1 A 196 196 VAL CB C 196 31.380 31.186 0.194 1 1 2180 . 13 1 1 A 196 196 VAL N N 196 120.413 119.544 0.869 1 1 2181 . 13 1 1 A 197 197 TYR H H 197 7.972 8.042 -0.070 1 1 2182 . 13 1 1 A 197 197 TYR HA H 197 3.145 4.117 -0.972 1 1 2187 . 13 1 1 A 197 197 TYR C C 197 177.726 176.989 0.737 1 1 2188 . 13 1 1 A 197 197 TYR CA C 197 62.253 61.871 0.382 1 1 2189 . 13 1 1 A 197 197 TYR CB C 197 37.314 38.835 -1.521 1 1 2192 . 13 1 1 A 197 197 TYR N N 197 119.543 121.279 -1.736 1 1 2193 . 13 1 1 A 198 198 LEU H H 198 8.630 8.365 0.265 1 1 2194 . 13 1 1 A 198 198 LEU HA H 198 3.923 3.745 0.178 1 1 2203 . 13 1 1 A 198 198 LEU C C 198 178.074 178.746 -0.672 1 1 2204 . 13 1 1 A 198 198 LEU CA C 198 58.294 57.947 0.347 1 1 2205 . 13 1 1 A 198 198 LEU CB C 198 42.177 41.599 0.578 1 1 2209 . 13 1 1 A 198 198 LEU N N 198 118.430 119.815 -1.385 1 1 2210 . 13 1 1 A 199 199 GLN H H 199 8.082 8.148 -0.066 1 1 2211 . 13 1 1 A 199 199 GLN HA H 199 3.054 3.552 -0.498 1 1 2216 . 13 1 1 A 199 199 GLN C C 199 176.875 177.923 -1.048 1 1 2217 . 13 1 1 A 199 199 GLN CA C 199 59.739 58.938 0.801 1 1 2218 . 13 1 1 A 199 199 GLN CB C 199 28.055 27.804 0.251 1 1 2220 . 13 1 1 A 199 199 GLN N N 199 117.926 116.792 1.134 1 1 2222 . 13 1 1 A 200 200 ARG H H 200 7.349 8.115 -0.766 1 1 2223 . 13 1 1 A 200 200 ARG HA H 200 3.798 3.779 0.019 1 1 2231 . 13 1 1 A 200 200 ARG C C 200 178.037 177.901 0.136 1 1 2232 . 13 1 1 A 200 200 ARG CA C 200 58.260 58.642 -0.382 1 1 2233 . 13 1 1 A 200 200 ARG CB C 200 30.706 29.926 0.780 1 1 2236 . 13 1 1 A 200 200 ARG N N 200 113.772 119.664 -5.892 1 1 2238 . 13 1 1 A 201 201 PHE H H 201 8.329 7.580 0.749 1 1 2239 . 13 1 1 A 201 201 PHE HA H 201 4.630 4.457 0.173 1 1 2244 . 13 1 1 A 201 201 PHE C C 201 176.606 176.337 0.269 1 1 2245 . 13 1 1 A 201 201 PHE CA C 201 59.014 58.836 0.178 1 1 2246 . 13 1 1 A 201 201 PHE CB C 201 40.357 40.814 -0.457 1 1 2249 . 13 1 1 A 201 201 PHE N N 201 114.182 116.164 -1.982 1 1 2250 . 13 1 1 A 202 202 ARG H H 202 8.719 8.269 0.450 1 1 2251 . 13 1 1 A 202 202 ARG HA H 202 5.071 4.653 0.418 1 1 2261 . 13 1 1 A 202 202 ARG CA C 202 53.956 53.478 0.478 1 1 2262 . 13 1 1 A 202 202 ARG CB C 202 31.979 30.193 1.786 1 1 2264 . 13 1 1 A 202 202 ARG N N 202 120.115 115.587 4.528 1 1 2266 . 13 1 1 A 203 203 PRO HA H 203 4.348 4.507 -0.159 1 1 2271 . 13 1 1 A 203 203 PRO C C 203 179.736 178.216 1.520 1 1 2272 . 13 1 1 A 203 203 PRO CA C 203 65.674 64.714 0.960 1 1 2273 . 13 1 1 A 203 203 PRO CB C 203 31.717 32.121 -0.404 1 1 2275 . 13 1 1 A 204 204 LEU H H 204 8.875 7.645 1.230 1 1 2276 . 13 1 1 A 204 204 LEU HA H 204 4.291 4.041 0.250 1 1 2286 . 13 1 1 A 204 204 LEU C C 204 180.353 177.986 2.367 1 1 2287 . 13 1 1 A 204 204 LEU CA C 204 58.012 57.134 0.878 1 1 2288 . 13 1 1 A 204 204 LEU CB C 204 40.893 41.764 -0.871 1 1 2292 . 13 1 1 A 204 204 LEU N N 204 118.940 118.033 0.907 1 1 2293 . 13 1 1 A 205 205 ASP H H 205 7.541 8.267 -0.726 1 1 2294 . 13 1 1 A 205 205 ASP HA H 205 4.622 4.318 0.304 1 1 2297 . 13 1 1 A 205 205 ASP C C 205 177.602 178.268 -0.666 1 1 2298 . 13 1 1 A 205 205 ASP CA C 205 57.437 57.287 0.150 1 1 2299 . 13 1 1 A 205 205 ASP CB C 205 41.143 39.908 1.235 1 1 2300 . 13 1 1 A 205 205 ASP N N 205 120.838 118.857 1.981 1 1 2301 . 13 1 1 A 206 206 TYR H H 206 8.237 7.712 0.525 1 1 2302 . 13 1 1 A 206 206 TYR HA H 206 4.018 4.135 -0.117 1 1 2307 . 13 1 1 A 206 206 TYR C C 206 176.433 177.749 -1.316 1 1 2308 . 13 1 1 A 206 206 TYR CA C 206 62.148 61.660 0.488 1 1 2309 . 13 1 1 A 206 206 TYR CB C 206 38.305 38.866 -0.561 1 1 2312 . 13 1 1 A 206 206 TYR N N 206 119.475 121.874 -2.399 1 1 2313 . 13 1 1 A 207 207 GLN H H 207 8.124 7.895 0.229 1 1 2314 . 13 1 1 A 207 207 GLN HA H 207 3.823 3.323 0.500 1 1 2320 . 13 1 1 A 207 207 GLN C C 207 178.019 178.654 -0.635 1 1 2321 . 13 1 1 A 207 207 GLN CA C 207 58.841 58.970 -0.129 1 1 2322 . 13 1 1 A 207 207 GLN CB C 207 28.208 27.984 0.224 1 1 2324 . 13 1 1 A 207 207 GLN N N 207 115.863 118.576 -2.713 1 1 2326 . 13 1 1 A 208 208 ARG H H 208 7.522 7.587 -0.065 1 1 2327 . 13 1 1 A 208 208 ARG HA H 208 4.127 4.000 0.127 1 1 2334 . 13 1 1 A 208 208 ARG C C 208 179.278 178.850 0.428 1 1 2335 . 13 1 1 A 208 208 ARG CA C 208 59.419 58.848 0.571 1 1 2336 . 13 1 1 A 208 208 ARG CB C 208 30.182 29.855 0.327 1 1 2338 . 13 1 1 A 208 208 ARG N N 208 118.471 119.961 -1.490 1 1 2340 . 13 1 1 A 209 209 LEU H H 209 7.869 7.641 0.228 1 1 2341 . 13 1 1 A 209 209 LEU HA H 209 4.091 4.022 0.069 1 1 2351 . 13 1 1 A 209 209 LEU C C 209 179.715 178.970 0.745 1 1 2352 . 13 1 1 A 209 209 LEU CA C 209 57.891 57.820 0.071 1 1 2353 . 13 1 1 A 209 209 LEU CB C 209 41.338 41.631 -0.293 1 1 2356 . 13 1 1 A 209 209 LEU N N 209 119.659 119.806 -0.147 1 1 2357 . 13 1 1 A 210 210 LEU H H 210 8.034 8.432 -0.398 1 1 2358 . 13 1 1 A 210 210 LEU HA H 210 3.977 4.016 -0.039 1 1 2367 . 13 1 1 A 210 210 LEU C C 210 180.363 178.498 1.865 1 1 2368 . 13 1 1 A 210 210 LEU CA C 210 57.459 58.501 -1.042 1 1 2369 . 13 1 1 A 210 210 LEU CB C 210 41.699 41.567 0.132 1 1 2373 . 13 1 1 A 210 210 LEU N N 210 120.967 120.283 0.684 1 1 2374 . 13 1 1 A 211 211 GLU H H 211 8.174 8.437 -0.263 1 1 2375 . 13 1 1 A 211 211 GLU HA H 211 4.075 3.999 0.076 1 1 2379 . 13 1 1 A 211 211 GLU C C 211 178.499 178.880 -0.381 1 1 2380 . 13 1 1 A 211 211 GLU CA C 211 58.575 59.547 -0.972 1 1 2381 . 13 1 1 A 211 211 GLU CB C 211 29.583 29.147 0.436 1 1 2383 . 13 1 1 A 211 211 GLU N N 211 119.217 117.862 1.355 1 1 2384 . 13 1 1 A 212 212 ALA H H 212 7.723 7.773 -0.050 1 1 2385 . 13 1 1 A 212 212 ALA HA H 212 4.291 4.278 0.013 1 1 2389 . 13 1 1 A 212 212 ALA C C 212 178.770 178.975 -0.205 1 1 2390 . 13 1 1 A 212 212 ALA CA C 212 53.966 54.663 -0.697 1 1 2391 . 13 1 1 A 212 212 ALA CB C 212 19.117 18.577 0.540 1 1 2392 . 13 1 1 A 212 212 ALA N N 212 121.798 122.197 -0.399 1 1 2393 . 13 1 1 A 213 213 ALA H H 213 7.743 8.098 -0.355 1 1 2394 . 13 1 1 A 213 213 ALA HA H 213 4.406 4.759 -0.353 1 1 2398 . 13 1 1 A 213 213 ALA C C 213 178.413 177.846 0.567 1 1 2399 . 13 1 1 A 213 213 ALA CA C 213 53.129 51.941 1.188 1 1 2400 . 13 1 1 A 213 213 ALA CB C 213 18.926 19.183 -0.257 1 1 2401 . 13 1 1 A 213 213 ALA N N 213 120.435 119.890 0.545 1 1 2402 . 13 1 1 A 214 214 SER H H 214 7.944 8.109 -0.165 1 1 2403 . 13 1 1 A 214 214 SER HA H 214 4.559 4.295 0.264 1 1 2406 . 13 1 1 A 214 214 SER C C 214 174.958 175.704 -0.746 1 1 2407 . 13 1 1 A 214 214 SER CA C 214 58.640 61.148 -2.508 1 1 2408 . 13 1 1 A 214 214 SER CB C 214 63.928 62.971 0.957 1 1 2409 . 13 1 1 A 214 214 SER N N 214 113.729 115.258 -1.529 1 1 2410 . 13 1 1 A 215 215 SER H H 215 8.255 7.825 0.430 1 1 2411 . 13 1 1 A 215 215 SER HA H 215 4.547 4.728 -0.181 1 1 2413 . 13 1 1 A 215 215 SER C C 215 175.289 174.684 0.605 1 1 2414 . 13 1 1 A 215 215 SER CA C 215 58.833 58.219 0.614 1 1 2415 . 13 1 1 A 215 215 SER CB C 215 63.847 63.383 0.464 1 1 2416 . 13 1 1 A 215 215 SER N N 215 117.674 114.200 3.474 1 1 2417 . 13 1 1 A 216 216 GLY H H 216 8.431 8.048 0.383 1 1 2418 . 13 1 1 A 216 216 GLY HA2 H 216 4.054 4.086 -0.032 1 1 2419 . 13 1 1 A 216 216 GLY C C 216 174.189 172.321 1.868 1 1 2420 . 13 1 1 A 216 216 GLY CA C 216 45.412 45.639 -0.227 1 1 2421 . 13 1 1 A 216 216 GLY N N 216 110.800 109.613 1.187 1 1 2422 . 13 1 1 A 217 217 GLU H H 217 8.267 8.712 -0.445 1 1 2423 . 13 1 1 A 217 217 GLU HA H 217 4.345 5.348 -1.003 1 1 2427 . 13 1 1 A 217 217 GLU C C 217 176.428 175.099 1.329 1 1 2428 . 13 1 1 A 217 217 GLU CA C 217 56.470 55.373 1.097 1 1 2429 . 13 1 1 A 217 217 GLU CB C 217 30.526 32.896 -2.370 1 1 2430 . 13 1 1 A 217 217 GLU N N 217 120.726 123.590 -2.864 1 1 2431 . 13 1 1 A 218 218 ALA H H 218 8.476 8.832 -0.356 1 1 2432 . 13 1 1 A 218 218 ALA HA H 218 4.467 4.997 -0.530 1 1 2436 . 13 1 1 A 218 218 ALA C C 218 178.015 175.359 2.656 1 1 2437 . 13 1 1 A 218 218 ALA CA C 218 52.547 52.022 0.525 1 1 2438 . 13 1 1 A 218 218 ALA CB C 218 19.242 21.655 -2.413 1 1 2439 . 13 1 1 A 218 218 ALA N N 218 125.534 128.283 -2.749 1 1 2440 . 13 1 1 A 219 219 THR H H 219 8.232 8.673 -0.441 1 1 2441 . 13 1 1 A 219 219 THR HA H 219 4.411 5.049 -0.638 1 1 2446 . 13 1 1 A 219 219 THR C C 219 175.327 174.561 0.766 1 1 2447 . 13 1 1 A 219 219 THR CA C 219 61.889 60.442 1.447 1 1 2448 . 13 1 1 A 219 219 THR CB C 219 69.939 70.188 -0.249 1 1 2449 . 13 1 1 A 219 219 THR N N 219 113.242 118.092 -4.850 1 1 2450 . 13 1 1 A 220 220 GLY H H 220 8.418 8.927 -0.509 1 1 2451 . 13 1 1 A 220 220 GLY C C 220 174.037 172.925 1.112 1 1 2452 . 13 1 1 A 220 220 GLY CA C 220 45.408 46.866 -1.458 1 1 2453 . 13 1 1 A 220 220 GLY N N 220 111.031 115.927 -4.896 1 1 2454 . 13 1 1 A 221 221 ASP H H 221 8.345 8.290 0.055 1 1 2455 . 13 1 1 A 221 221 ASP HA H 221 4.700 5.090 -0.390 1 1 2458 . 13 1 1 A 221 221 ASP C C 221 176.535 173.864 2.671 1 1 2459 . 13 1 1 A 221 221 ASP CA C 221 54.402 53.290 1.112 1 1 2460 . 13 1 1 A 221 221 ASP CB C 221 41.431 42.991 -1.560 1 1 2461 . 13 1 1 A 221 221 ASP N N 221 120.795 117.755 3.040 1 1 2462 . 13 1 1 A 222 222 SER H H 222 8.353 8.517 -0.164 1 1 2463 . 13 1 1 A 222 222 SER HA H 222 4.493 5.673 -1.180 1 1 2465 . 13 1 1 A 222 222 SER C C 222 174.224 173.342 0.882 1 1 2466 . 13 1 1 A 222 222 SER CA C 222 58.427 57.324 1.103 1 1 2467 . 13 1 1 A 222 222 SER CB C 222 63.860 66.272 -2.412 1 1 2468 . 13 1 1 A 222 222 SER N N 222 116.220 113.221 2.999 1 1 2469 . 13 1 1 A 223 223 ALA H H 223 8.381 8.893 -0.512 1 1 2470 . 13 1 1 A 223 223 ALA HA H 223 4.461 4.864 -0.403 1 1 2474 . 13 1 1 A 223 223 ALA C C 223 176.926 175.117 1.809 1 1 2475 . 13 1 1 A 223 223 ALA CA C 223 52.583 51.252 1.331 1 1 2476 . 13 1 1 A 223 223 ALA CB C 223 19.438 23.488 -4.050 1 1 2477 . 13 1 1 A 223 223 ALA N N 223 126.592 122.848 3.744 1 1 1 . 14 1 1 A 2 2 ALA HA H 2 4.274 4.939 -0.665 1 1 5 . 14 1 1 A 2 2 ALA C C 2 177.828 175.114 2.714 1 1 6 . 14 1 1 A 2 2 ALA CA C 2 52.984 51.561 1.423 1 1 7 . 14 1 1 A 2 2 ALA CB C 2 19.138 23.218 -4.080 1 1 8 . 14 1 1 A 3 3 GLN H H 3 8.463 8.682 -0.219 1 1 9 . 14 1 1 A 3 3 GLN HA H 3 4.676 4.667 0.009 1 1 12 . 14 1 1 A 3 3 GLN C C 3 176.002 175.828 0.174 1 1 13 . 14 1 1 A 3 3 GLN CA C 3 56.258 55.451 0.807 1 1 14 . 14 1 1 A 3 3 GLN CB C 3 30.346 31.582 -1.236 1 1 15 . 14 1 1 A 3 3 GLN N N 3 117.490 121.190 -3.700 1 1 16 . 14 1 1 A 4 4 GLY H H 4 8.099 8.836 -0.737 1 1 17 . 14 1 1 A 4 4 GLY HA2 H 4 3.910 3.834 0.076 1 1 18 . 14 1 1 A 4 4 GLY C C 4 173.332 174.258 -0.926 1 1 19 . 14 1 1 A 4 4 GLY CA C 4 45.333 47.374 -2.041 1 1 20 . 14 1 1 A 4 4 GLY N N 4 109.423 114.966 -5.543 1 1 21 . 14 1 1 A 5 5 LEU H H 5 7.863 8.504 -0.641 1 1 22 . 14 1 1 A 5 5 LEU HA H 5 4.561 4.633 -0.072 1 1 32 . 14 1 1 A 5 5 LEU C C 5 176.448 175.646 0.802 1 1 33 . 14 1 1 A 5 5 LEU CA C 5 54.713 54.115 0.598 1 1 34 . 14 1 1 A 5 5 LEU CB C 5 43.551 41.161 2.390 1 1 38 . 14 1 1 A 5 5 LEU N N 5 120.391 126.026 -5.635 1 1 39 . 14 1 1 A 6 6 ILE H H 6 8.764 9.375 -0.611 1 1 40 . 14 1 1 A 6 6 ILE HA H 6 4.087 4.117 -0.030 1 1 49 . 14 1 1 A 6 6 ILE C C 6 174.679 175.689 -1.010 1 1 50 . 14 1 1 A 6 6 ILE CA C 6 61.279 61.844 -0.565 1 1 51 . 14 1 1 A 6 6 ILE CB C 6 39.651 37.689 1.962 1 1 54 . 14 1 1 A 6 6 ILE N N 6 123.050 126.195 -3.145 1 1 55 . 14 1 1 A 7 7 GLU H H 7 8.587 8.592 -0.005 1 1 56 . 14 1 1 A 7 7 GLU HA H 7 4.917 4.785 0.132 1 1 61 . 14 1 1 A 7 7 GLU C C 7 175.978 175.616 0.362 1 1 62 . 14 1 1 A 7 7 GLU CA C 7 56.127 56.306 -0.179 1 1 63 . 14 1 1 A 7 7 GLU CB C 7 31.115 30.432 0.683 1 1 65 . 14 1 1 A 7 7 GLU N N 7 127.415 127.735 -0.320 1 1 66 . 14 1 1 A 8 8 VAL H H 8 8.986 8.828 0.158 1 1 67 . 14 1 1 A 8 8 VAL HA H 8 4.375 4.902 -0.527 1 1 72 . 14 1 1 A 8 8 VAL C C 8 173.704 174.042 -0.338 1 1 73 . 14 1 1 A 8 8 VAL CA C 8 61.347 59.698 1.649 1 1 74 . 14 1 1 A 8 8 VAL CB C 8 33.611 35.346 -1.735 1 1 76 . 14 1 1 A 8 8 VAL N N 8 126.071 122.090 3.981 1 1 77 . 14 1 1 A 9 9 GLU H H 9 8.521 9.160 -0.639 1 1 78 . 14 1 1 A 9 9 GLU HA H 9 5.837 5.425 0.412 1 1 81 . 14 1 1 A 9 9 GLU C C 9 175.939 174.975 0.964 1 1 82 . 14 1 1 A 9 9 GLU CA C 9 54.516 54.536 -0.020 1 1 83 . 14 1 1 A 9 9 GLU CB C 9 33.009 33.727 -0.718 1 1 84 . 14 1 1 A 9 9 GLU N N 9 122.857 126.664 -3.807 1 1 85 . 14 1 1 A 10 10 ARG H H 10 8.690 8.534 0.156 1 1 86 . 14 1 1 A 10 10 ARG HA H 10 4.709 5.138 -0.429 1 1 94 . 14 1 1 A 10 10 ARG C C 10 174.826 174.644 0.182 1 1 95 . 14 1 1 A 10 10 ARG CA C 10 54.491 54.321 0.170 1 1 96 . 14 1 1 A 10 10 ARG CB C 10 35.777 34.837 0.940 1 1 98 . 14 1 1 A 10 10 ARG N N 10 120.430 121.160 -0.730 1 1 100 . 14 1 1 A 11 11 LYS H H 11 8.874 8.778 0.096 1 1 101 . 14 1 1 A 11 11 LYS HA H 11 5.530 5.310 0.220 1 1 107 . 14 1 1 A 11 11 LYS C C 11 176.919 174.543 2.376 1 1 108 . 14 1 1 A 11 11 LYS CA C 11 55.084 55.336 -0.252 1 1 109 . 14 1 1 A 11 11 LYS CB C 11 35.435 36.783 -1.348 1 1 113 . 14 1 1 A 11 11 LYS N N 11 121.087 123.134 -2.047 1 1 114 . 14 1 1 A 12 12 PHE H H 12 8.877 9.221 -0.344 1 1 115 . 14 1 1 A 12 12 PHE HA H 12 5.130 5.056 0.074 1 1 120 . 14 1 1 A 12 12 PHE C C 12 171.676 171.976 -0.300 1 1 121 . 14 1 1 A 12 12 PHE CA C 12 55.869 56.443 -0.574 1 1 122 . 14 1 1 A 12 12 PHE CB C 12 42.108 41.553 0.555 1 1 125 . 14 1 1 A 12 12 PHE N N 12 117.486 119.188 -1.702 1 1 126 . 14 1 1 A 13 13 ALA H H 13 9.134 9.162 -0.028 1 1 127 . 14 1 1 A 13 13 ALA HA H 13 5.003 4.685 0.318 1 1 131 . 14 1 1 A 13 13 ALA CA C 13 48.340 48.840 -0.500 1 1 132 . 14 1 1 A 13 13 ALA CB C 13 19.191 20.272 -1.081 1 1 133 . 14 1 1 A 13 13 ALA N N 13 125.915 123.066 2.849 1 1 134 . 14 1 1 A 14 14 PRO HA H 14 4.620 4.937 -0.317 1 1 140 . 14 1 1 A 14 14 PRO C C 14 176.502 177.211 -0.709 1 1 141 . 14 1 1 A 14 14 PRO CA C 14 62.672 62.340 0.332 1 1 142 . 14 1 1 A 14 14 PRO CB C 14 33.119 32.237 0.882 1 1 145 . 14 1 1 A 15 15 GLY H H 15 8.721 8.718 0.003 1 1 146 . 14 1 1 A 15 15 GLY HA2 H 15 3.999 4.065 -0.066 1 1 147 . 14 1 1 A 15 15 GLY HA3 H 15 4.632 4.065 0.567 1 1 148 . 14 1 1 A 15 15 GLY CA C 15 44.411 44.026 0.385 1 1 149 . 14 1 1 A 15 15 GLY N N 15 109.863 108.432 1.431 1 1 150 . 14 1 1 A 16 16 PRO HA H 16 4.447 4.528 -0.081 1 1 155 . 14 1 1 A 16 16 PRO C C 16 177.053 176.141 0.912 1 1 156 . 14 1 1 A 16 16 PRO CA C 16 64.395 64.060 0.335 1 1 157 . 14 1 1 A 16 16 PRO CB C 16 31.993 31.727 0.266 1 1 159 . 14 1 1 A 17 17 ASP H H 17 8.550 8.298 0.252 1 1 160 . 14 1 1 A 17 17 ASP HA H 17 4.950 4.963 -0.013 1 1 163 . 14 1 1 A 17 17 ASP C C 17 176.800 176.457 0.343 1 1 164 . 14 1 1 A 17 17 ASP CA C 17 53.271 53.492 -0.221 1 1 165 . 14 1 1 A 17 17 ASP CB C 17 40.392 41.944 -1.552 1 1 166 . 14 1 1 A 17 17 ASP N N 17 116.060 118.705 -2.645 1 1 167 . 14 1 1 A 18 18 THR H H 18 7.664 7.557 0.107 1 1 168 . 14 1 1 A 18 18 THR HA H 18 4.120 3.690 0.430 1 1 174 . 14 1 1 A 18 18 THR C C 18 175.407 176.362 -0.955 1 1 175 . 14 1 1 A 18 18 THR CA C 18 68.718 67.155 1.563 1 1 176 . 14 1 1 A 18 18 THR CB C 18 69.179 68.440 0.739 1 1 178 . 14 1 1 A 18 18 THR N N 18 117.158 114.526 2.632 1 1 179 . 14 1 1 A 19 19 GLU H H 19 8.817 8.434 0.383 1 1 180 . 14 1 1 A 19 19 GLU HA H 19 3.510 3.119 0.391 1 1 184 . 14 1 1 A 19 19 GLU C C 19 178.345 178.878 -0.533 1 1 185 . 14 1 1 A 19 19 GLU CA C 19 61.237 59.695 1.542 1 1 186 . 14 1 1 A 19 19 GLU CB C 19 28.746 29.237 -0.491 1 1 188 . 14 1 1 A 19 19 GLU N N 19 118.802 118.614 0.188 1 1 189 . 14 1 1 A 20 20 GLU H H 20 7.976 8.024 -0.048 1 1 190 . 14 1 1 A 20 20 GLU HA H 20 4.036 4.067 -0.031 1 1 194 . 14 1 1 A 20 20 GLU C C 20 179.451 179.144 0.307 1 1 195 . 14 1 1 A 20 20 GLU CA C 20 59.909 59.138 0.771 1 1 196 . 14 1 1 A 20 20 GLU CB C 20 28.992 29.287 -0.295 1 1 198 . 14 1 1 A 20 20 GLU N N 20 121.130 119.934 1.196 1 1 199 . 14 1 1 A 21 21 ARG H H 21 8.199 7.830 0.369 1 1 200 . 14 1 1 A 21 21 ARG HA H 21 4.061 3.991 0.070 1 1 207 . 14 1 1 A 21 21 ARG C C 21 179.087 178.747 0.340 1 1 208 . 14 1 1 A 21 21 ARG CA C 21 58.477 58.380 0.097 1 1 209 . 14 1 1 A 21 21 ARG CB C 21 30.101 30.396 -0.295 1 1 211 . 14 1 1 A 21 21 ARG N N 21 119.897 120.408 -0.511 1 1 213 . 14 1 1 A 22 22 LEU H H 22 8.154 8.506 -0.352 1 1 214 . 14 1 1 A 22 22 LEU HA H 22 3.560 3.790 -0.230 1 1 224 . 14 1 1 A 22 22 LEU C C 22 178.461 179.276 -0.815 1 1 225 . 14 1 1 A 22 22 LEU CA C 22 58.432 57.687 0.745 1 1 226 . 14 1 1 A 22 22 LEU CB C 22 40.229 41.016 -0.787 1 1 230 . 14 1 1 A 22 22 LEU N N 22 120.012 119.562 0.450 1 1 231 . 14 1 1 A 23 23 GLN H H 23 7.621 7.995 -0.374 1 1 232 . 14 1 1 A 23 23 GLN HA H 23 4.232 4.066 0.166 1 1 238 . 14 1 1 A 23 23 GLN C C 23 180.543 178.789 1.754 1 1 239 . 14 1 1 A 23 23 GLN CA C 23 59.434 59.148 0.286 1 1 240 . 14 1 1 A 23 23 GLN CB C 23 28.749 28.374 0.375 1 1 242 . 14 1 1 A 23 23 GLN N N 23 117.823 117.783 0.040 1 1 244 . 14 1 1 A 24 24 GLU H H 24 8.165 7.742 0.423 1 1 245 . 14 1 1 A 24 24 GLU HA H 24 4.072 4.090 -0.018 1 1 249 . 14 1 1 A 24 24 GLU C C 24 178.612 179.373 -0.761 1 1 250 . 14 1 1 A 24 24 GLU CA C 24 59.236 59.289 -0.053 1 1 251 . 14 1 1 A 24 24 GLU CB C 24 29.606 29.169 0.437 1 1 253 . 14 1 1 A 24 24 GLU N N 24 122.589 119.768 2.821 1 1 254 . 14 1 1 A 25 25 LEU H H 25 7.911 7.942 -0.031 1 1 255 . 14 1 1 A 25 25 LEU HA H 25 4.214 4.094 0.120 1 1 265 . 14 1 1 A 25 25 LEU C C 25 176.745 177.353 -0.608 1 1 266 . 14 1 1 A 25 25 LEU CA C 25 55.659 55.843 -0.184 1 1 267 . 14 1 1 A 25 25 LEU CB C 25 43.109 42.776 0.333 1 1 271 . 14 1 1 A 25 25 LEU N N 25 117.882 118.062 -0.180 1 1 272 . 14 1 1 A 26 26 GLY H H 26 7.776 7.928 -0.152 1 1 273 . 14 1 1 A 26 26 GLY HA2 H 26 4.337 4.026 0.311 1 1 274 . 14 1 1 A 26 26 GLY HA3 H 26 3.856 4.039 -0.183 1 1 275 . 14 1 1 A 26 26 GLY C C 26 175.456 174.477 0.979 1 1 276 . 14 1 1 A 26 26 GLY CA C 26 44.875 45.116 -0.241 1 1 277 . 14 1 1 A 26 26 GLY N N 26 104.938 105.723 -0.785 1 1 278 . 14 1 1 A 27 27 ALA H H 27 8.104 8.351 -0.247 1 1 279 . 14 1 1 A 27 27 ALA HA H 27 4.949 4.560 0.389 1 1 283 . 14 1 1 A 27 27 ALA C C 27 176.448 176.908 -0.460 1 1 284 . 14 1 1 A 27 27 ALA CA C 27 52.183 52.221 -0.038 1 1 285 . 14 1 1 A 27 27 ALA CB C 27 21.814 19.758 2.056 1 1 286 . 14 1 1 A 27 27 ALA N N 27 123.263 124.032 -0.769 1 1 287 . 14 1 1 A 28 28 THR H H 28 9.369 8.968 0.401 1 1 288 . 14 1 1 A 28 28 THR HA H 28 4.779 4.684 0.095 1 1 293 . 14 1 1 A 28 28 THR C C 28 173.725 173.706 0.019 1 1 294 . 14 1 1 A 28 28 THR CA C 28 60.046 60.947 -0.901 1 1 295 . 14 1 1 A 28 28 THR CB C 28 70.592 69.756 0.836 1 1 297 . 14 1 1 A 28 28 THR N N 28 112.201 118.846 -6.645 1 1 298 . 14 1 1 A 29 29 LEU H H 29 8.518 8.413 0.105 1 1 299 . 14 1 1 A 29 29 LEU HA H 29 3.332 3.918 -0.586 1 1 309 . 14 1 1 A 29 29 LEU C C 29 176.202 175.477 0.725 1 1 310 . 14 1 1 A 29 29 LEU CA C 29 55.031 54.742 0.289 1 1 311 . 14 1 1 A 29 29 LEU CB C 29 40.624 41.410 -0.786 1 1 315 . 14 1 1 A 29 29 LEU N N 29 128.151 129.860 -1.709 1 1 316 . 14 1 1 A 30 30 GLU H H 30 9.269 9.227 0.042 1 1 317 . 14 1 1 A 30 30 GLU HA H 30 4.287 4.193 0.094 1 1 321 . 14 1 1 A 30 30 GLU C C 30 176.740 176.390 0.350 1 1 322 . 14 1 1 A 30 30 GLU CA C 30 57.283 58.198 -0.915 1 1 323 . 14 1 1 A 30 30 GLU CB C 30 31.045 30.895 0.150 1 1 325 . 14 1 1 A 30 30 GLU N N 30 130.123 126.125 3.998 1 1 326 . 14 1 1 A 31 31 HIS H H 31 7.341 7.334 0.007 1 1 327 . 14 1 1 A 31 31 HIS HA H 31 4.701 5.060 -0.359 1 1 331 . 14 1 1 A 31 31 HIS C C 31 172.581 174.067 -1.486 1 1 332 . 14 1 1 A 31 31 HIS CA C 31 55.876 54.641 1.235 1 1 333 . 14 1 1 A 31 31 HIS CB C 31 33.434 34.233 -0.799 1 1 334 . 14 1 1 A 31 31 HIS N N 31 113.223 114.611 -1.388 1 1 335 . 14 1 1 A 32 32 ARG H H 32 8.196 8.866 -0.670 1 1 336 . 14 1 1 A 32 32 ARG HA H 32 5.262 5.297 -0.035 1 1 341 . 14 1 1 A 32 32 ARG C C 32 174.377 174.102 0.275 1 1 342 . 14 1 1 A 32 32 ARG CA C 32 55.808 54.446 1.362 1 1 343 . 14 1 1 A 32 32 ARG CB C 32 33.340 33.761 -0.421 1 1 345 . 14 1 1 A 32 32 ARG N N 32 123.003 118.805 4.198 1 1 346 . 14 1 1 A 33 33 VAL H H 33 8.956 9.512 -0.556 1 1 347 . 14 1 1 A 33 33 VAL HA H 33 4.734 4.916 -0.182 1 1 355 . 14 1 1 A 33 33 VAL C C 33 172.821 175.264 -2.443 1 1 356 . 14 1 1 A 33 33 VAL CA C 33 60.197 61.371 -1.174 1 1 357 . 14 1 1 A 33 33 VAL CB C 33 35.860 34.077 1.783 1 1 360 . 14 1 1 A 33 33 VAL N N 33 122.929 123.055 -0.126 1 1 361 . 14 1 1 A 34 34 THR H H 34 8.250 8.860 -0.610 1 1 362 . 14 1 1 A 34 34 THR HA H 34 5.616 5.665 -0.049 1 1 367 . 14 1 1 A 34 34 THR C C 34 173.913 173.575 0.338 1 1 368 . 14 1 1 A 34 34 THR CA C 34 60.245 60.400 -0.155 1 1 369 . 14 1 1 A 34 34 THR CB C 34 71.706 71.191 0.515 1 1 371 . 14 1 1 A 34 34 THR N N 34 119.164 118.988 0.176 1 1 372 . 14 1 1 A 35 35 PHE H H 35 8.565 8.561 0.004 1 1 373 . 14 1 1 A 35 35 PHE HA H 35 5.029 5.064 -0.035 1 1 378 . 14 1 1 A 35 35 PHE C C 35 173.193 171.995 1.198 1 1 379 . 14 1 1 A 35 35 PHE CA C 35 55.687 55.995 -0.308 1 1 380 . 14 1 1 A 35 35 PHE CB C 35 40.853 41.060 -0.207 1 1 383 . 14 1 1 A 35 35 PHE N N 35 120.244 118.531 1.713 1 1 384 . 14 1 1 A 36 36 ARG H H 36 8.869 8.799 0.070 1 1 385 . 14 1 1 A 36 36 ARG HA H 36 4.982 4.994 -0.012 1 1 387 . 14 1 1 A 36 36 ARG C C 36 174.743 173.998 0.745 1 1 388 . 14 1 1 A 36 36 ARG CA C 36 55.493 54.537 0.956 1 1 389 . 14 1 1 A 36 36 ARG CB C 36 32.228 32.678 -0.450 1 1 390 . 14 1 1 A 36 36 ARG N N 36 123.893 120.536 3.357 1 1 391 . 14 1 1 A 37 37 ASP H H 37 8.402 9.256 -0.854 1 1 392 . 14 1 1 A 37 37 ASP HA H 37 5.462 5.453 0.009 1 1 395 . 14 1 1 A 37 37 ASP C C 37 175.177 175.203 -0.026 1 1 396 . 14 1 1 A 37 37 ASP CA C 37 53.942 53.174 0.768 1 1 397 . 14 1 1 A 37 37 ASP CB C 37 45.486 43.525 1.961 1 1 398 . 14 1 1 A 37 37 ASP N N 37 127.149 127.401 -0.252 1 1 399 . 14 1 1 A 38 38 THR H H 38 8.151 8.883 -0.732 1 1 400 . 14 1 1 A 38 38 THR HA H 38 4.866 4.746 0.120 1 1 405 . 14 1 1 A 38 38 THR C C 38 172.792 173.679 -0.887 1 1 406 . 14 1 1 A 38 38 THR CA C 38 61.416 61.209 0.207 1 1 407 . 14 1 1 A 38 38 THR CB C 38 71.047 70.137 0.910 1 1 409 . 14 1 1 A 38 38 THR N N 38 115.686 121.529 -5.843 1 1 410 . 14 1 1 A 39 39 TYR H H 39 9.021 9.353 -0.332 1 1 411 . 14 1 1 A 39 39 TYR HA H 39 5.544 5.803 -0.259 1 1 416 . 14 1 1 A 39 39 TYR C C 39 176.032 174.924 1.108 1 1 417 . 14 1 1 A 39 39 TYR CA C 39 57.184 56.361 0.823 1 1 418 . 14 1 1 A 39 39 TYR CB C 39 41.642 40.390 1.252 1 1 420 . 14 1 1 A 39 39 TYR N N 39 124.579 126.580 -2.001 1 1 421 . 14 1 1 A 40 40 TYR H H 40 8.487 8.919 -0.432 1 1 422 . 14 1 1 A 40 40 TYR HA H 40 5.517 5.745 -0.228 1 1 426 . 14 1 1 A 40 40 TYR C C 40 174.108 174.447 -0.339 1 1 427 . 14 1 1 A 40 40 TYR CA C 40 56.979 56.824 0.155 1 1 428 . 14 1 1 A 40 40 TYR CB C 40 44.132 42.804 1.328 1 1 431 . 14 1 1 A 40 40 TYR N N 40 119.709 121.551 -1.842 1 1 432 . 14 1 1 A 41 41 ASP H H 41 9.341 8.786 0.555 1 1 433 . 14 1 1 A 41 41 ASP HA H 41 4.866 5.152 -0.286 1 1 436 . 14 1 1 A 41 41 ASP C C 41 177.262 174.748 2.514 1 1 437 . 14 1 1 A 41 41 ASP CA C 41 53.445 53.447 -0.002 1 1 438 . 14 1 1 A 41 41 ASP CB C 41 45.347 44.641 0.706 1 1 439 . 14 1 1 A 41 41 ASP N N 41 117.995 120.777 -2.782 1 1 440 . 14 1 1 A 42 42 THR H H 42 11.574 8.678 2.896 1 1 441 . 14 1 1 A 42 42 THR HA H 42 5.206 4.465 0.741 1 1 446 . 14 1 1 A 42 42 THR C C 42 177.935 176.307 1.628 1 1 447 . 14 1 1 A 42 42 THR CA C 42 60.400 61.076 -0.676 1 1 448 . 14 1 1 A 42 42 THR CB C 42 72.114 70.843 1.271 1 1 450 . 14 1 1 A 42 42 THR N N 42 114.394 114.765 -0.371 1 1 451 . 14 1 1 A 43 43 SER H H 43 9.715 8.884 0.831 1 1 452 . 14 1 1 A 43 43 SER HA H 43 4.252 4.239 0.013 1 1 455 . 14 1 1 A 43 43 SER C C 43 175.478 175.229 0.249 1 1 456 . 14 1 1 A 43 43 SER CA C 43 61.277 60.974 0.303 1 1 457 . 14 1 1 A 43 43 SER CB C 43 62.821 62.924 -0.103 1 1 458 . 14 1 1 A 43 43 SER N N 43 116.674 116.132 0.542 1 1 459 . 14 1 1 A 44 44 GLU H H 44 7.674 7.682 -0.008 1 1 460 . 14 1 1 A 44 44 GLU HA H 44 4.330 4.452 -0.122 1 1 464 . 14 1 1 A 44 44 GLU C C 44 175.001 175.447 -0.446 1 1 465 . 14 1 1 A 44 44 GLU CA C 44 55.992 55.854 0.138 1 1 466 . 14 1 1 A 44 44 GLU CB C 44 29.276 29.945 -0.669 1 1 468 . 14 1 1 A 44 44 GLU N N 44 117.856 119.016 -1.160 1 1 469 . 14 1 1 A 45 45 LEU H H 45 8.222 7.832 0.390 1 1 470 . 14 1 1 A 45 45 LEU HA H 45 3.901 4.037 -0.136 1 1 480 . 14 1 1 A 45 45 LEU C C 45 175.209 176.421 -1.212 1 1 481 . 14 1 1 A 45 45 LEU CA C 45 55.548 56.298 -0.750 1 1 482 . 14 1 1 A 45 45 LEU CB C 45 38.458 39.466 -1.008 1 1 485 . 14 1 1 A 45 45 LEU N N 45 119.335 117.310 2.025 1 1 486 . 14 1 1 A 46 46 SER H H 46 7.347 8.142 -0.795 1 1 487 . 14 1 1 A 46 46 SER HA H 46 3.954 4.165 -0.211 1 1 489 . 14 1 1 A 46 46 SER C C 46 177.497 176.196 1.301 1 1 490 . 14 1 1 A 46 46 SER CA C 46 62.471 62.359 0.112 1 1 491 . 14 1 1 A 46 46 SER CB C 46 63.908 62.778 1.130 1 1 492 . 14 1 1 A 46 46 SER N N 46 111.433 113.946 -2.513 1 1 493 . 14 1 1 A 47 47 LEU H H 47 12.003 8.132 3.871 1 1 494 . 14 1 1 A 47 47 LEU HA H 47 3.959 4.097 -0.138 1 1 504 . 14 1 1 A 47 47 LEU C C 47 180.340 178.229 2.111 1 1 505 . 14 1 1 A 47 47 LEU CA C 47 58.879 58.017 0.862 1 1 506 . 14 1 1 A 47 47 LEU CB C 47 39.572 41.691 -2.119 1 1 510 . 14 1 1 A 47 47 LEU N N 47 124.605 122.819 1.786 1 1 511 . 14 1 1 A 48 48 MET H H 48 10.599 8.240 2.359 1 1 512 . 14 1 1 A 48 48 MET HA H 48 3.213 3.927 -0.714 1 1 520 . 14 1 1 A 48 48 MET C C 48 181.177 178.253 2.924 1 1 521 . 14 1 1 A 48 48 MET CA C 48 60.747 58.448 2.299 1 1 522 . 14 1 1 A 48 48 MET CB C 48 32.594 32.164 0.430 1 1 525 . 14 1 1 A 48 48 MET N N 48 126.254 119.035 7.219 1 1 526 . 14 1 1 A 49 49 LEU H H 49 8.731 7.658 1.073 1 1 527 . 14 1 1 A 49 49 LEU HA H 49 4.097 4.189 -0.092 1 1 536 . 14 1 1 A 49 49 LEU C C 49 178.144 177.132 1.012 1 1 537 . 14 1 1 A 49 49 LEU CA C 49 57.800 56.575 1.225 1 1 538 . 14 1 1 A 49 49 LEU CB C 49 41.379 41.727 -0.348 1 1 541 . 14 1 1 A 49 49 LEU N N 49 119.183 120.305 -1.122 1 1 542 . 14 1 1 A 50 50 SER H H 50 7.853 7.441 0.412 1 1 543 . 14 1 1 A 50 50 SER HA H 50 4.822 4.529 0.293 1 1 546 . 14 1 1 A 50 50 SER C C 50 174.539 172.781 1.758 1 1 547 . 14 1 1 A 50 50 SER CA C 50 57.811 57.918 -0.107 1 1 548 . 14 1 1 A 50 50 SER CB C 50 64.443 63.395 1.048 1 1 549 . 14 1 1 A 50 50 SER N N 50 114.594 112.080 2.514 1 1 550 . 14 1 1 A 51 51 ASP H H 51 8.264 7.460 0.804 1 1 551 . 14 1 1 A 51 51 ASP HA H 51 4.362 3.873 0.489 1 1 554 . 14 1 1 A 51 51 ASP C C 51 172.921 174.423 -1.502 1 1 555 . 14 1 1 A 51 51 ASP CA C 51 55.343 55.259 0.084 1 1 556 . 14 1 1 A 51 51 ASP CB C 51 40.583 39.535 1.048 1 1 557 . 14 1 1 A 51 51 ASP N N 51 123.003 117.288 5.715 1 1 558 . 14 1 1 A 52 52 HIS H H 52 7.869 7.070 0.799 1 1 559 . 14 1 1 A 52 52 HIS HA H 52 5.335 5.023 0.312 1 1 564 . 14 1 1 A 52 52 HIS C C 52 173.991 173.872 0.119 1 1 565 . 14 1 1 A 52 52 HIS CA C 52 55.889 54.369 1.520 1 1 566 . 14 1 1 A 52 52 HIS CB C 52 31.789 29.273 2.516 1 1 568 . 14 1 1 A 52 52 HIS N N 52 112.486 117.261 -4.775 1 1 569 . 14 1 1 A 53 53 TRP H H 53 8.165 8.729 -0.564 1 1 570 . 14 1 1 A 53 53 TRP HA H 53 4.926 5.315 -0.389 1 1 578 . 14 1 1 A 53 53 TRP C C 53 175.354 175.209 0.145 1 1 579 . 14 1 1 A 53 53 TRP CA C 53 55.364 56.733 -1.369 1 1 580 . 14 1 1 A 53 53 TRP CB C 53 30.641 31.219 -0.578 1 1 585 . 14 1 1 A 53 53 TRP N N 53 117.916 125.860 -7.944 1 1 587 . 14 1 1 A 54 54 LEU H H 54 10.088 8.788 1.300 1 1 588 . 14 1 1 A 54 54 LEU HA H 54 5.497 5.461 0.036 1 1 598 . 14 1 1 A 54 54 LEU C C 54 173.337 174.950 -1.613 1 1 599 . 14 1 1 A 54 54 LEU CA C 54 54.408 53.426 0.982 1 1 600 . 14 1 1 A 54 54 LEU CB C 54 44.156 45.597 -1.441 1 1 604 . 14 1 1 A 54 54 LEU N N 54 130.826 125.680 5.146 1 1 605 . 14 1 1 A 55 55 ARG H H 55 9.289 9.320 -0.031 1 1 606 . 14 1 1 A 55 55 ARG HA H 55 5.482 5.596 -0.114 1 1 612 . 14 1 1 A 55 55 ARG C C 55 174.057 173.964 0.093 1 1 613 . 14 1 1 A 55 55 ARG CA C 55 53.167 54.006 -0.839 1 1 614 . 14 1 1 A 55 55 ARG CB C 55 34.270 34.222 0.048 1 1 616 . 14 1 1 A 55 55 ARG N N 55 125.089 124.628 0.461 1 1 618 . 14 1 1 A 56 56 GLN H H 56 9.092 8.925 0.167 1 1 619 . 14 1 1 A 56 56 GLN HA H 56 3.991 4.613 -0.622 1 1 626 . 14 1 1 A 56 56 GLN C C 56 174.199 174.402 -0.203 1 1 627 . 14 1 1 A 56 56 GLN CA C 56 54.566 53.958 0.608 1 1 628 . 14 1 1 A 56 56 GLN CB C 56 29.643 30.722 -1.079 1 1 630 . 14 1 1 A 56 56 GLN N N 56 124.355 120.408 3.947 1 1 632 . 14 1 1 A 57 57 ARG H H 57 8.440 8.173 0.267 1 1 633 . 14 1 1 A 57 57 ARG HA H 57 5.316 5.123 0.193 1 1 639 . 14 1 1 A 57 57 ARG C C 57 176.188 176.353 -0.165 1 1 640 . 14 1 1 A 57 57 ARG CA C 57 53.940 55.803 -1.863 1 1 641 . 14 1 1 A 57 57 ARG CB C 57 32.426 29.920 2.506 1 1 643 . 14 1 1 A 57 57 ARG N N 57 130.222 125.329 4.893 1 1 645 . 14 1 1 A 58 58 GLU H H 58 8.891 9.163 -0.272 1 1 646 . 14 1 1 A 58 58 GLU HA H 58 3.996 4.087 -0.091 1 1 649 . 14 1 1 A 58 58 GLU CA C 58 58.364 57.659 0.705 1 1 650 . 14 1 1 A 58 58 GLU CB C 58 30.875 29.206 1.669 1 1 651 . 14 1 1 A 58 58 GLU N N 58 131.208 119.294 11.914 1 1 652 . 14 1 1 A 59 59 GLY H H 59 8.367 8.238 0.129 1 1 653 . 14 1 1 A 59 59 GLY HA2 H 59 4.334 3.887 0.447 1 1 654 . 14 1 1 A 59 59 GLY HA3 H 59 3.743 3.967 -0.224 1 1 655 . 14 1 1 A 59 59 GLY C C 59 174.194 175.045 -0.851 1 1 656 . 14 1 1 A 59 59 GLY CA C 59 45.666 45.172 0.494 1 1 657 . 14 1 1 A 60 60 SER H H 60 8.071 8.131 -0.060 1 1 658 . 14 1 1 A 60 60 SER HA H 60 4.730 4.310 0.420 1 1 661 . 14 1 1 A 60 60 SER C C 60 173.908 174.550 -0.642 1 1 662 . 14 1 1 A 60 60 SER CA C 60 58.762 59.243 -0.481 1 1 663 . 14 1 1 A 60 60 SER CB C 60 64.497 64.095 0.402 1 1 664 . 14 1 1 A 60 60 SER N N 60 114.636 116.901 -2.265 1 1 665 . 14 1 1 A 61 61 GLY H H 61 8.401 7.129 1.272 1 1 666 . 14 1 1 A 61 61 GLY HA2 H 61 4.560 4.010 0.550 1 1 667 . 14 1 1 A 61 61 GLY HA3 H 61 3.878 4.017 -0.139 1 1 668 . 14 1 1 A 61 61 GLY C C 61 173.526 171.931 1.595 1 1 669 . 14 1 1 A 61 61 GLY CA C 61 44.906 45.596 -0.690 1 1 670 . 14 1 1 A 61 61 GLY N N 61 109.421 106.585 2.836 1 1 671 . 14 1 1 A 62 62 TRP H H 62 8.861 8.559 0.302 1 1 672 . 14 1 1 A 62 62 TRP HA H 62 5.089 5.191 -0.102 1 1 681 . 14 1 1 A 62 62 TRP C C 62 176.168 176.063 0.105 1 1 682 . 14 1 1 A 62 62 TRP CA C 62 57.459 57.479 -0.020 1 1 683 . 14 1 1 A 62 62 TRP CB C 62 32.536 31.608 0.928 1 1 689 . 14 1 1 A 62 62 TRP N N 62 122.939 121.108 1.831 1 1 691 . 14 1 1 A 63 63 GLU H H 63 9.306 9.241 0.065 1 1 692 . 14 1 1 A 63 63 GLU HA H 63 4.919 5.018 -0.099 1 1 697 . 14 1 1 A 63 63 GLU C C 63 173.770 174.172 -0.402 1 1 698 . 14 1 1 A 63 63 GLU CA C 63 55.953 55.470 0.483 1 1 699 . 14 1 1 A 63 63 GLU CB C 63 35.317 33.322 1.995 1 1 701 . 14 1 1 A 63 63 GLU N N 63 120.136 121.518 -1.382 1 1 702 . 14 1 1 A 64 64 LEU H H 64 8.998 9.486 -0.488 1 1 703 . 14 1 1 A 64 64 LEU HA H 64 5.616 5.548 0.068 1 1 712 . 14 1 1 A 64 64 LEU C C 64 175.014 174.041 0.973 1 1 713 . 14 1 1 A 64 64 LEU CA C 64 52.945 53.562 -0.617 1 1 714 . 14 1 1 A 64 64 LEU CB C 64 46.904 45.923 0.981 1 1 717 . 14 1 1 A 64 64 LEU N N 64 127.321 128.876 -1.555 1 1 718 . 14 1 1 A 65 65 LYS H H 65 9.322 10.013 -0.691 1 1 719 . 14 1 1 A 65 65 LYS HA H 65 5.347 5.420 -0.073 1 1 727 . 14 1 1 A 65 65 LYS C C 65 175.811 175.327 0.484 1 1 728 . 14 1 1 A 65 65 LYS CA C 65 55.817 55.344 0.473 1 1 729 . 14 1 1 A 65 65 LYS CB C 65 34.521 34.788 -0.267 1 1 733 . 14 1 1 A 65 65 LYS N N 65 129.874 128.490 1.384 1 1 734 . 14 1 1 A 66 66 CYS H H 66 9.129 8.917 0.212 1 1 735 . 14 1 1 A 66 66 CYS HA H 66 5.319 5.150 0.169 1 1 738 . 14 1 1 A 66 66 CYS CA C 66 54.532 56.949 -2.417 1 1 739 . 14 1 1 A 66 66 CYS CB C 66 28.813 29.922 -1.109 1 1 740 . 14 1 1 A 66 66 CYS N N 66 121.497 125.130 -3.633 1 1 741 . 14 1 1 A 67 67 PRO HA H 67 4.439 4.014 0.425 1 1 748 . 14 1 1 A 67 67 PRO C C 67 177.297 176.961 0.336 1 1 749 . 14 1 1 A 67 67 PRO CA C 67 63.596 64.862 -1.266 1 1 750 . 14 1 1 A 67 67 PRO CB C 67 32.242 31.792 0.450 1 1 752 . 14 1 1 A 68 68 GLY H H 68 8.316 7.876 0.440 1 1 753 . 14 1 1 A 68 68 GLY HA2 H 68 3.726 4.075 -0.349 1 1 754 . 14 1 1 A 68 68 GLY HA3 H 68 4.095 4.111 -0.016 1 1 755 . 14 1 1 A 68 68 GLY C C 68 173.789 174.175 -0.386 1 1 756 . 14 1 1 A 68 68 GLY CA C 68 45.227 45.254 -0.027 1 1 757 . 14 1 1 A 68 68 GLY N N 68 109.533 105.368 4.165 1 1 758 . 14 1 1 A 69 69 VAL H H 69 8.114 7.819 0.295 1 1 759 . 14 1 1 A 69 69 VAL HA H 69 4.266 4.305 -0.039 1 1 764 . 14 1 1 A 69 69 VAL C C 69 176.299 174.499 1.800 1 1 765 . 14 1 1 A 69 69 VAL CA C 69 61.945 61.629 0.316 1 1 766 . 14 1 1 A 69 69 VAL CB C 69 33.082 33.770 -0.688 1 1 768 . 14 1 1 A 69 69 VAL N N 69 118.540 121.814 -3.274 1 1 769 . 14 1 1 A 70 70 THR H H 70 8.324 8.629 -0.305 1 1 770 . 14 1 1 A 70 70 THR HA H 70 4.373 4.821 -0.448 1 1 775 . 14 1 1 A 70 70 THR C C 70 175.204 174.920 0.284 1 1 776 . 14 1 1 A 70 70 THR CA C 70 62.309 60.832 1.477 1 1 777 . 14 1 1 A 70 70 THR CB C 70 69.787 68.952 0.835 1 1 779 . 14 1 1 A 70 70 THR N N 70 117.636 118.451 -0.815 1 1 780 . 14 1 1 A 71 71 GLY H H 71 8.574 8.873 -0.299 1 1 781 . 14 1 1 A 71 71 GLY HA2 H 71 4.096 3.993 0.103 1 1 782 . 14 1 1 A 71 71 GLY HA3 H 71 3.975 4.003 -0.028 1 1 783 . 14 1 1 A 71 71 GLY C C 71 174.313 174.874 -0.561 1 1 784 . 14 1 1 A 71 71 GLY CA C 71 45.545 46.486 -0.941 1 1 785 . 14 1 1 A 71 71 GLY N N 71 111.677 113.116 -1.439 1 1 786 . 14 1 1 A 72 72 VAL H H 72 7.945 8.160 -0.215 1 1 787 . 14 1 1 A 72 72 VAL HA H 72 4.258 4.219 0.039 1 1 795 . 14 1 1 A 72 72 VAL C C 72 176.162 175.881 0.281 1 1 796 . 14 1 1 A 72 72 VAL CA C 72 62.227 63.018 -0.791 1 1 797 . 14 1 1 A 72 72 VAL CB C 72 32.997 33.155 -0.158 1 1 799 . 14 1 1 A 72 72 VAL N N 72 118.647 117.670 0.977 1 1 800 . 14 1 1 A 73 73 SER H H 73 8.498 8.062 0.436 1 1 801 . 14 1 1 A 73 73 SER HA H 73 4.617 4.406 0.211 1 1 803 . 14 1 1 A 73 73 SER C C 73 174.461 173.901 0.560 1 1 804 . 14 1 1 A 73 73 SER CA C 73 58.218 59.311 -1.093 1 1 805 . 14 1 1 A 73 73 SER CB C 73 64.061 62.074 1.987 1 1 806 . 14 1 1 A 73 73 SER N N 73 118.828 115.506 3.322 1 1 807 . 14 1 1 A 74 74 GLY H H 74 8.247 8.403 -0.156 1 1 808 . 14 1 1 A 74 74 GLY HA2 H 74 4.101 4.155 -0.054 1 1 809 . 14 1 1 A 74 74 GLY HA3 H 74 4.304 4.158 0.146 1 1 810 . 14 1 1 A 74 74 GLY CA C 74 44.896 44.776 0.120 1 1 811 . 14 1 1 A 74 74 GLY N N 74 111.138 110.374 0.764 1 1 812 . 14 1 1 A 75 75 PRO HA H 75 4.461 4.485 -0.024 1 1 819 . 14 1 1 A 75 75 PRO C C 75 176.798 177.588 -0.790 1 1 820 . 14 1 1 A 75 75 PRO CA C 75 63.466 63.132 0.334 1 1 821 . 14 1 1 A 75 75 PRO CB C 75 31.980 31.898 0.082 1 1 824 . 14 1 1 A 76 76 HIS H H 76 8.397 8.767 -0.370 1 1 825 . 14 1 1 A 76 76 HIS HA H 76 4.742 4.120 0.622 1 1 829 . 14 1 1 A 76 76 HIS C C 76 174.282 175.857 -1.575 1 1 830 . 14 1 1 A 76 76 HIS CA C 76 55.579 58.763 -3.184 1 1 831 . 14 1 1 A 76 76 HIS CB C 76 30.501 30.299 0.202 1 1 832 . 14 1 1 A 76 76 HIS N N 76 118.431 123.448 -5.017 1 1 833 . 14 1 1 A 77 77 ASN H H 77 8.364 7.967 0.397 1 1 834 . 14 1 1 A 77 77 ASN HA H 77 4.767 4.422 0.345 1 1 839 . 14 1 1 A 77 77 ASN C C 77 174.576 173.789 0.787 1 1 840 . 14 1 1 A 77 77 ASN CA C 77 53.139 54.925 -1.786 1 1 841 . 14 1 1 A 77 77 ASN CB C 77 39.320 38.381 0.939 1 1 842 . 14 1 1 A 77 77 ASN N N 77 119.421 118.373 1.048 1 1 844 . 14 1 1 A 78 78 GLU H H 78 8.683 8.106 0.577 1 1 845 . 14 1 1 A 78 78 GLU HA H 78 4.409 4.639 -0.230 1 1 850 . 14 1 1 A 78 78 GLU C C 78 175.791 174.264 1.527 1 1 851 . 14 1 1 A 78 78 GLU CA C 78 56.359 56.066 0.293 1 1 852 . 14 1 1 A 78 78 GLU CB C 78 30.818 33.443 -2.625 1 1 854 . 14 1 1 A 78 78 GLU N N 78 122.085 118.617 3.468 1 1 855 . 14 1 1 A 79 79 TYR H H 79 8.341 8.710 -0.369 1 1 856 . 14 1 1 A 79 79 TYR HA H 79 4.988 4.932 0.056 1 1 861 . 14 1 1 A 79 79 TYR C C 79 175.837 175.910 -0.073 1 1 862 . 14 1 1 A 79 79 TYR CA C 79 58.028 59.712 -1.684 1 1 863 . 14 1 1 A 79 79 TYR CB C 79 41.672 39.145 2.527 1 1 866 . 14 1 1 A 79 79 TYR N N 79 119.452 124.250 -4.798 1 1 867 . 14 1 1 A 80 80 VAL H H 80 9.366 9.068 0.298 1 1 868 . 14 1 1 A 80 80 VAL HA H 80 4.370 4.909 -0.539 1 1 873 . 14 1 1 A 80 80 VAL C C 80 174.948 174.742 0.206 1 1 874 . 14 1 1 A 80 80 VAL CA C 80 61.190 60.784 0.406 1 1 875 . 14 1 1 A 80 80 VAL CB C 80 34.204 33.442 0.762 1 1 877 . 14 1 1 A 80 80 VAL N N 80 120.567 118.958 1.609 1 1 878 . 14 1 1 A 81 81 GLU H H 81 8.570 8.864 -0.294 1 1 879 . 14 1 1 A 81 81 GLU HA H 81 4.770 4.973 -0.203 1 1 883 . 14 1 1 A 81 81 GLU C C 81 175.491 175.365 0.126 1 1 884 . 14 1 1 A 81 81 GLU CA C 81 55.655 55.381 0.274 1 1 885 . 14 1 1 A 81 81 GLU CB C 81 30.415 30.841 -0.426 1 1 887 . 14 1 1 A 81 81 GLU N N 81 124.248 124.194 0.054 1 1 888 . 14 1 1 A 82 82 VAL H H 82 9.189 9.014 0.175 1 1 889 . 14 1 1 A 82 82 VAL HA H 82 4.279 4.840 -0.561 1 1 894 . 14 1 1 A 82 82 VAL C C 82 176.087 175.865 0.222 1 1 895 . 14 1 1 A 82 82 VAL CA C 82 62.672 61.013 1.659 1 1 896 . 14 1 1 A 82 82 VAL CB C 82 33.121 33.458 -0.337 1 1 898 . 14 1 1 A 82 82 VAL N N 82 127.776 122.324 5.452 1 1 899 . 14 1 1 A 83 83 THR H H 83 8.590 8.609 -0.019 1 1 900 . 14 1 1 A 83 83 THR HA H 83 4.955 4.688 0.267 1 1 905 . 14 1 1 A 83 83 THR C C 83 174.688 174.999 -0.311 1 1 906 . 14 1 1 A 83 83 THR CA C 83 61.332 61.452 -0.120 1 1 907 . 14 1 1 A 83 83 THR CB C 83 70.213 70.224 -0.011 1 1 909 . 14 1 1 A 83 83 THR N N 83 114.744 116.614 -1.870 1 1 910 . 14 1 1 A 84 84 SER H H 84 7.650 7.437 0.213 1 1 911 . 14 1 1 A 84 84 SER HA H 84 4.819 4.269 0.550 1 1 914 . 14 1 1 A 84 84 SER CA C 84 56.280 60.453 -4.173 1 1 915 . 14 1 1 A 84 84 SER CB C 84 63.294 63.535 -0.241 1 1 916 . 14 1 1 A 84 84 SER N N 84 118.038 118.859 -0.821 1 1 917 . 14 1 1 A 85 85 GLU H H 85 8.391 8.753 -0.362 1 1 918 . 14 1 1 A 85 85 GLU HA H 85 3.661 3.981 -0.320 1 1 923 . 14 1 1 A 85 85 GLU C C 85 177.520 178.638 -1.118 1 1 924 . 14 1 1 A 85 85 GLU CA C 85 62.429 59.705 2.724 1 1 925 . 14 1 1 A 85 85 GLU CB C 85 29.655 29.308 0.347 1 1 927 . 14 1 1 A 86 86 ALA H H 86 8.443 8.112 0.331 1 1 928 . 14 1 1 A 86 86 ALA HA H 86 4.027 4.037 -0.010 1 1 932 . 14 1 1 A 86 86 ALA C C 86 180.423 180.074 0.349 1 1 933 . 14 1 1 A 86 86 ALA CA C 86 55.145 54.825 0.320 1 1 934 . 14 1 1 A 86 86 ALA CB C 86 18.165 18.067 0.098 1 1 935 . 14 1 1 A 86 86 ALA N N 86 119.636 123.173 -3.537 1 1 936 . 14 1 1 A 87 87 ALA H H 87 7.214 7.490 -0.276 1 1 937 . 14 1 1 A 87 87 ALA HA H 87 4.244 4.043 0.201 1 1 941 . 14 1 1 A 87 87 ALA C C 87 180.354 179.782 0.572 1 1 942 . 14 1 1 A 87 87 ALA CA C 87 54.378 54.908 -0.530 1 1 943 . 14 1 1 A 87 87 ALA CB C 87 18.795 18.591 0.204 1 1 944 . 14 1 1 A 87 87 ALA N N 87 121.004 120.313 0.691 1 1 945 . 14 1 1 A 88 88 ILE H H 88 8.471 7.603 0.868 1 1 946 . 14 1 1 A 88 88 ILE HA H 88 3.360 3.576 -0.216 1 1 954 . 14 1 1 A 88 88 ILE CA C 88 66.323 64.866 1.457 1 1 955 . 14 1 1 A 88 88 ILE CB C 88 37.808 37.670 0.138 1 1 958 . 14 1 1 A 88 88 ILE N N 88 120.743 119.885 0.858 1 1 959 . 14 1 1 A 89 89 VAL H H 89 8.343 8.361 -0.018 1 1 960 . 14 1 1 A 89 89 VAL HA H 89 3.061 3.473 -0.412 1 1 968 . 14 1 1 A 89 89 VAL C C 89 176.708 177.759 -1.051 1 1 969 . 14 1 1 A 89 89 VAL CA C 89 67.833 66.512 1.321 1 1 970 . 14 1 1 A 89 89 VAL CB C 89 31.509 31.488 0.021 1 1 973 . 14 1 1 A 89 89 VAL N N 89 118.049 119.757 -1.708 1 1 974 . 14 1 1 A 90 90 ALA H H 90 7.516 7.933 -0.417 1 1 975 . 14 1 1 A 90 90 ALA HA H 90 3.987 3.839 0.148 1 1 979 . 14 1 1 A 90 90 ALA C C 90 180.744 180.038 0.706 1 1 980 . 14 1 1 A 90 90 ALA CA C 90 55.481 55.748 -0.267 1 1 981 . 14 1 1 A 90 90 ALA CB C 90 17.953 18.229 -0.276 1 1 982 . 14 1 1 A 90 90 ALA N N 90 118.935 121.954 -3.019 1 1 983 . 14 1 1 A 91 91 GLN H H 91 7.886 8.289 -0.403 1 1 984 . 14 1 1 A 91 91 GLN HA H 91 4.190 3.946 0.244 1 1 991 . 14 1 1 A 91 91 GLN C C 91 178.832 178.681 0.151 1 1 992 . 14 1 1 A 91 91 GLN CA C 91 58.519 58.989 -0.470 1 1 993 . 14 1 1 A 91 91 GLN CB C 91 28.091 28.113 -0.022 1 1 995 . 14 1 1 A 91 91 GLN N N 91 117.846 117.605 0.241 1 1 997 . 14 1 1 A 92 92 LEU H H 92 8.751 8.735 0.016 1 1 998 . 14 1 1 A 92 92 LEU HA H 92 3.903 3.933 -0.030 1 1 1007 . 14 1 1 A 92 92 LEU C C 92 178.997 178.981 0.016 1 1 1008 . 14 1 1 A 92 92 LEU CA C 92 58.136 57.796 0.340 1 1 1009 . 14 1 1 A 92 92 LEU CB C 92 41.576 41.154 0.422 1 1 1013 . 14 1 1 A 92 92 LEU N N 92 119.547 119.177 0.370 1 1 1014 . 14 1 1 A 93 93 PHE H H 93 8.648 7.954 0.694 1 1 1015 . 14 1 1 A 93 93 PHE HA H 93 4.270 4.192 0.078 1 1 1020 . 14 1 1 A 93 93 PHE C C 93 179.283 178.751 0.532 1 1 1021 . 14 1 1 A 93 93 PHE CA C 93 59.860 60.279 -0.419 1 1 1022 . 14 1 1 A 93 93 PHE CB C 93 37.765 38.837 -1.072 1 1 1025 . 14 1 1 A 93 93 PHE N N 93 118.041 119.294 -1.253 1 1 1026 . 14 1 1 A 94 94 GLU H H 94 7.739 8.171 -0.432 1 1 1027 . 14 1 1 A 94 94 GLU HA H 94 4.110 4.129 -0.019 1 1 1031 . 14 1 1 A 94 94 GLU C C 94 178.629 178.929 -0.300 1 1 1032 . 14 1 1 A 94 94 GLU CA C 94 59.359 59.364 -0.005 1 1 1033 . 14 1 1 A 94 94 GLU CB C 94 29.589 29.010 0.579 1 1 1035 . 14 1 1 A 94 94 GLU N N 94 119.980 117.366 2.614 1 1 1036 . 14 1 1 A 95 95 LEU H H 95 7.999 8.216 -0.217 1 1 1037 . 14 1 1 A 95 95 LEU HA H 95 4.139 3.975 0.164 1 1 1047 . 14 1 1 A 95 95 LEU C C 95 178.965 178.587 0.378 1 1 1048 . 14 1 1 A 95 95 LEU CA C 95 57.557 57.689 -0.132 1 1 1049 . 14 1 1 A 95 95 LEU CB C 95 43.443 41.505 1.938 1 1 1053 . 14 1 1 A 95 95 LEU N N 95 118.398 121.464 -3.066 1 1 1054 . 14 1 1 A 96 96 LEU H H 96 8.363 7.973 0.390 1 1 1055 . 14 1 1 A 96 96 LEU HA H 96 4.503 4.261 0.242 1 1 1061 . 14 1 1 A 96 96 LEU C C 96 177.932 177.166 0.766 1 1 1062 . 14 1 1 A 96 96 LEU CA C 96 54.700 55.080 -0.380 1 1 1063 . 14 1 1 A 96 96 LEU CB C 96 43.048 42.501 0.547 1 1 1065 . 14 1 1 A 96 96 LEU N N 96 114.720 116.817 -2.097 1 1 1066 . 14 1 1 A 97 97 GLY H H 97 7.810 7.660 0.150 1 1 1067 . 14 1 1 A 97 97 GLY HA2 H 97 3.963 3.887 0.076 1 1 1068 . 14 1 1 A 97 97 GLY C C 97 173.535 174.463 -0.928 1 1 1069 . 14 1 1 A 97 97 GLY CA C 97 45.667 46.526 -0.859 1 1 1070 . 14 1 1 A 97 97 GLY N N 97 109.511 107.861 1.650 1 1 1071 . 14 1 1 A 98 98 SER H H 98 8.131 7.985 0.146 1 1 1072 . 14 1 1 A 98 98 SER HA H 98 4.225 4.728 -0.503 1 1 1075 . 14 1 1 A 98 98 SER C C 98 174.974 174.953 0.021 1 1 1076 . 14 1 1 A 98 98 SER CA C 98 57.960 56.867 1.093 1 1 1077 . 14 1 1 A 98 98 SER CB C 98 63.997 63.926 0.071 1 1 1078 . 14 1 1 A 98 98 SER N N 98 113.405 114.957 -1.552 1 1 1079 . 14 1 1 A 99 99 GLY H H 99 8.052 8.694 -0.642 1 1 1080 . 14 1 1 A 99 99 GLY HA2 H 99 3.998 3.944 0.054 1 1 1081 . 14 1 1 A 99 99 GLY HA3 H 99 3.778 3.977 -0.199 1 1 1082 . 14 1 1 A 99 99 GLY C C 99 174.033 174.064 -0.031 1 1 1083 . 14 1 1 A 99 99 GLY CA C 99 45.123 45.316 -0.193 1 1 1084 . 14 1 1 A 99 99 GLY N N 99 111.534 115.102 -3.568 1 1 1085 . 14 1 1 A 100 100 GLU H H 100 8.177 7.220 0.957 1 1 1086 . 14 1 1 A 100 100 GLU HA H 100 4.201 4.416 -0.215 1 1 1091 . 14 1 1 A 100 100 GLU C C 100 175.830 176.078 -0.248 1 1 1092 . 14 1 1 A 100 100 GLU CA C 100 56.442 56.029 0.413 1 1 1093 . 14 1 1 A 100 100 GLU CB C 100 30.428 30.906 -0.478 1 1 1095 . 14 1 1 A 100 100 GLU N N 100 120.463 120.306 0.157 1 1 1096 . 14 1 1 A 101 101 GLN H H 101 8.161 8.469 -0.308 1 1 1097 . 14 1 1 A 101 101 GLN HA H 101 4.098 4.236 -0.138 1 1 1103 . 14 1 1 A 101 101 GLN C C 101 175.412 175.836 -0.424 1 1 1104 . 14 1 1 A 101 101 GLN CA C 101 55.632 56.344 -0.712 1 1 1105 . 14 1 1 A 101 101 GLN CB C 101 29.569 29.082 0.487 1 1 1107 . 14 1 1 A 101 101 GLN N N 101 120.014 121.114 -1.100 1 1 1109 . 14 1 1 A 102 102 LYS H H 102 8.235 8.437 -0.202 1 1 1110 . 14 1 1 A 102 102 LYS HA H 102 4.387 4.022 0.365 1 1 1117 . 14 1 1 A 102 102 LYS CA C 102 54.116 54.581 -0.465 1 1 1118 . 14 1 1 A 102 102 LYS CB C 102 32.478 32.224 0.254 1 1 1122 . 14 1 1 A 102 102 LYS N N 102 123.399 123.451 -0.052 1 1 1123 . 14 1 1 A 103 103 PRO HA H 103 4.498 4.706 -0.208 1 1 1129 . 14 1 1 A 103 103 PRO C C 103 175.473 175.775 -0.302 1 1 1130 . 14 1 1 A 103 103 PRO CA C 103 62.802 62.204 0.598 1 1 1131 . 14 1 1 A 103 103 PRO CB C 103 32.124 32.974 -0.850 1 1 1134 . 14 1 1 A 104 104 ALA H H 104 8.017 8.166 -0.149 1 1 1135 . 14 1 1 A 104 104 ALA HA H 104 4.318 4.422 -0.104 1 1 1139 . 14 1 1 A 104 104 ALA C C 104 176.717 176.944 -0.227 1 1 1140 . 14 1 1 A 104 104 ALA CA C 104 52.194 51.932 0.262 1 1 1141 . 14 1 1 A 104 104 ALA CB C 104 20.113 21.433 -1.320 1 1 1142 . 14 1 1 A 104 104 ALA N N 104 122.093 119.276 2.817 1 1 1143 . 14 1 1 A 105 105 GLY H H 105 7.678 8.182 -0.504 1 1 1144 . 14 1 1 A 105 105 GLY HA2 H 105 3.851 3.990 -0.139 1 1 1145 . 14 1 1 A 105 105 GLY HA3 H 105 4.053 4.008 0.045 1 1 1146 . 14 1 1 A 105 105 GLY C C 105 172.990 174.736 -1.746 1 1 1147 . 14 1 1 A 105 105 GLY CA C 105 44.241 43.675 0.566 1 1 1148 . 14 1 1 A 105 105 GLY N N 105 105.234 107.102 -1.868 1 1 1149 . 14 1 1 A 106 106 VAL H H 106 8.409 8.747 -0.338 1 1 1150 . 14 1 1 A 106 106 VAL HA H 106 2.829 3.317 -0.488 1 1 1158 . 14 1 1 A 106 106 VAL C C 106 177.822 177.307 0.515 1 1 1159 . 14 1 1 A 106 106 VAL CA C 106 65.522 65.596 -0.074 1 1 1160 . 14 1 1 A 106 106 VAL CB C 106 30.701 30.691 0.010 1 1 1163 . 14 1 1 A 106 106 VAL N N 106 119.215 121.130 -1.915 1 1 1164 . 14 1 1 A 107 107 ALA H H 107 8.707 8.497 0.210 1 1 1165 . 14 1 1 A 107 107 ALA HA H 107 3.730 3.864 -0.134 1 1 1169 . 14 1 1 A 107 107 ALA C C 107 179.661 179.778 -0.117 1 1 1170 . 14 1 1 A 107 107 ALA CA C 107 54.995 55.493 -0.498 1 1 1171 . 14 1 1 A 107 107 ALA CB C 107 17.705 17.896 -0.191 1 1 1172 . 14 1 1 A 107 107 ALA N N 107 118.672 122.119 -3.447 1 1 1173 . 14 1 1 A 108 108 ALA H H 108 7.388 7.883 -0.495 1 1 1174 . 14 1 1 A 108 108 ALA HA H 108 4.259 4.038 0.221 1 1 1178 . 14 1 1 A 108 108 ALA C C 108 179.318 179.332 -0.014 1 1 1179 . 14 1 1 A 108 108 ALA CA C 108 53.481 55.071 -1.590 1 1 1180 . 14 1 1 A 108 108 ALA CB C 108 19.367 18.413 0.954 1 1 1181 . 14 1 1 A 108 108 ALA N N 108 116.635 121.180 -4.545 1 1 1182 . 14 1 1 A 109 109 VAL H H 109 7.689 7.356 0.333 1 1 1183 . 14 1 1 A 109 109 VAL HA H 109 4.532 3.753 0.779 1 1 1191 . 14 1 1 A 109 109 VAL C C 109 176.055 177.950 -1.895 1 1 1192 . 14 1 1 A 109 109 VAL CA C 109 61.452 65.819 -4.367 1 1 1193 . 14 1 1 A 109 109 VAL CB C 109 32.728 31.455 1.273 1 1 1196 . 14 1 1 A 109 109 VAL N N 109 112.851 116.896 -4.045 1 1 1197 . 14 1 1 A 110 110 LEU H H 110 7.099 8.366 -1.267 1 1 1198 . 14 1 1 A 110 110 LEU HA H 110 3.723 3.761 -0.038 1 1 1208 . 14 1 1 A 110 110 LEU C C 110 179.040 178.837 0.203 1 1 1209 . 14 1 1 A 110 110 LEU CA C 110 58.825 57.806 1.019 1 1 1210 . 14 1 1 A 110 110 LEU CB C 110 41.242 41.635 -0.393 1 1 1214 . 14 1 1 A 110 110 LEU N N 110 119.829 124.922 -5.093 1 1 1215 . 14 1 1 A 111 111 GLY H H 111 8.435 7.814 0.621 1 1 1216 . 14 1 1 A 111 111 GLY HA2 H 111 3.970 3.836 0.134 1 1 1217 . 14 1 1 A 111 111 GLY HA3 H 111 3.885 3.842 0.043 1 1 1218 . 14 1 1 A 111 111 GLY C C 111 178.031 176.714 1.317 1 1 1219 . 14 1 1 A 111 111 GLY CA C 111 46.961 47.542 -0.581 1 1 1220 . 14 1 1 A 111 111 GLY N N 111 104.089 106.581 -2.492 1 1 1221 . 14 1 1 A 112 112 SER H H 112 8.343 8.001 0.342 1 1 1222 . 14 1 1 A 112 112 SER HA H 112 4.266 4.137 0.129 1 1 1224 . 14 1 1 A 112 112 SER C C 112 175.885 175.438 0.447 1 1 1225 . 14 1 1 A 112 112 SER CA C 112 61.304 62.561 -1.257 1 1 1226 . 14 1 1 A 112 112 SER CB C 112 62.901 62.938 -0.037 1 1 1227 . 14 1 1 A 112 112 SER N N 112 119.497 119.706 -0.209 1 1 1228 . 14 1 1 A 113 113 LEU H H 113 7.667 8.114 -0.447 1 1 1229 . 14 1 1 A 113 113 LEU HA H 113 4.343 4.172 0.171 1 1 1238 . 14 1 1 A 113 113 LEU C C 113 174.760 175.832 -1.072 1 1 1239 . 14 1 1 A 113 113 LEU CA C 113 54.228 54.729 -0.501 1 1 1240 . 14 1 1 A 113 113 LEU CB C 113 41.467 42.228 -0.761 1 1 1244 . 14 1 1 A 113 113 LEU N N 113 118.843 117.860 0.983 1 1 1245 . 14 1 1 A 114 114 LYS H H 114 7.685 7.857 -0.172 1 1 1246 . 14 1 1 A 114 114 LYS HA H 114 3.958 3.897 0.061 1 1 1250 . 14 1 1 A 114 114 LYS C C 114 177.557 175.609 1.948 1 1 1251 . 14 1 1 A 114 114 LYS CA C 114 56.935 57.531 -0.596 1 1 1252 . 14 1 1 A 114 114 LYS CB C 114 28.898 29.487 -0.589 1 1 1254 . 14 1 1 A 114 114 LYS N N 114 114.072 116.342 -2.270 1 1 1255 . 14 1 1 A 115 115 LEU H H 115 8.329 7.848 0.481 1 1 1256 . 14 1 1 A 115 115 LEU HA H 115 4.315 4.319 -0.004 1 1 1265 . 14 1 1 A 115 115 LEU C C 115 175.988 176.750 -0.762 1 1 1266 . 14 1 1 A 115 115 LEU CA C 115 54.310 55.027 -0.717 1 1 1267 . 14 1 1 A 115 115 LEU CB C 115 44.163 41.529 2.634 1 1 1270 . 14 1 1 A 115 115 LEU N N 115 117.951 120.131 -2.180 1 1 1271 . 14 1 1 A 116 116 GLN H H 116 9.100 8.258 0.842 1 1 1272 . 14 1 1 A 116 116 GLN HA H 116 4.898 4.944 -0.046 1 1 1279 . 14 1 1 A 116 116 GLN CA C 116 53.467 55.280 -1.813 1 1 1280 . 14 1 1 A 116 116 GLN CB C 116 32.730 30.154 2.576 1 1 1282 . 14 1 1 A 116 116 GLN N N 116 119.994 124.274 -4.280 1 1 1284 . 14 1 1 A 117 117 GLU H H 117 8.849 8.583 0.266 1 1 1285 . 14 1 1 A 117 117 GLU HA H 117 3.707 4.112 -0.405 1 1 1290 . 14 1 1 A 117 117 GLU C C 117 177.303 177.051 0.252 1 1 1291 . 14 1 1 A 117 117 GLU CA C 117 57.233 56.432 0.801 1 1 1292 . 14 1 1 A 117 117 GLU CB C 117 29.634 29.351 0.283 1 1 1294 . 14 1 1 A 117 117 GLU N N 117 121.487 124.248 -2.761 1 1 1295 . 14 1 1 A 118 118 VAL H H 118 8.983 8.780 0.203 1 1 1296 . 14 1 1 A 118 118 VAL HA H 118 4.360 4.120 0.240 1 1 1304 . 14 1 1 A 118 118 VAL C C 118 174.171 175.361 -1.190 1 1 1305 . 14 1 1 A 118 118 VAL CA C 118 61.772 63.518 -1.746 1 1 1306 . 14 1 1 A 118 118 VAL CB C 118 34.095 32.908 1.187 1 1 1309 . 14 1 1 A 118 118 VAL N N 118 122.933 128.571 -5.638 1 1 1310 . 14 1 1 A 119 119 ALA H H 119 7.023 7.103 -0.080 1 1 1311 . 14 1 1 A 119 119 ALA HA H 119 4.378 4.488 -0.110 1 1 1315 . 14 1 1 A 119 119 ALA C C 119 175.493 174.852 0.641 1 1 1316 . 14 1 1 A 119 119 ALA CA C 119 51.956 51.285 0.671 1 1 1317 . 14 1 1 A 119 119 ALA CB C 119 23.957 21.080 2.877 1 1 1318 . 14 1 1 A 119 119 ALA N N 119 117.379 122.104 -4.725 1 1 1319 . 14 1 1 A 120 120 SER H H 120 6.999 8.481 -1.482 1 1 1320 . 14 1 1 A 120 120 SER HA H 120 5.208 5.332 -0.124 1 1 1323 . 14 1 1 A 120 120 SER C C 120 173.082 173.185 -0.103 1 1 1324 . 14 1 1 A 120 120 SER CA C 120 56.754 56.837 -0.083 1 1 1325 . 14 1 1 A 120 120 SER CB C 120 64.605 65.845 -1.240 1 1 1326 . 14 1 1 A 120 120 SER N N 120 113.743 115.833 -2.090 1 1 1327 . 14 1 1 A 121 121 PHE H H 121 8.244 8.497 -0.253 1 1 1328 . 14 1 1 A 121 121 PHE HA H 121 5.177 5.088 0.089 1 1 1333 . 14 1 1 A 121 121 PHE C C 121 173.569 172.826 0.743 1 1 1334 . 14 1 1 A 121 121 PHE CA C 121 55.555 54.801 0.754 1 1 1335 . 14 1 1 A 121 121 PHE CB C 121 40.959 41.901 -0.942 1 1 1338 . 14 1 1 A 121 121 PHE N N 121 120.358 117.904 2.454 1 1 1339 . 14 1 1 A 122 122 ILE H H 122 8.907 8.734 0.173 1 1 1340 . 14 1 1 A 122 122 ILE HA H 122 4.682 4.379 0.303 1 1 1348 . 14 1 1 A 122 122 ILE C C 122 176.925 175.273 1.652 1 1 1349 . 14 1 1 A 122 122 ILE CA C 122 60.740 61.168 -0.428 1 1 1350 . 14 1 1 A 122 122 ILE CB C 122 39.497 37.655 1.842 1 1 1353 . 14 1 1 A 122 122 ILE N N 122 121.282 121.182 0.100 1 1 1354 . 14 1 1 A 123 123 THR H H 123 9.022 9.100 -0.078 1 1 1355 . 14 1 1 A 123 123 THR HA H 123 5.039 4.759 0.280 1 1 1360 . 14 1 1 A 123 123 THR C C 123 173.531 173.664 -0.133 1 1 1361 . 14 1 1 A 123 123 THR CA C 123 62.266 61.704 0.562 1 1 1362 . 14 1 1 A 123 123 THR CB C 123 70.677 68.987 1.690 1 1 1364 . 14 1 1 A 123 123 THR N N 123 128.965 122.840 6.125 1 1 1365 . 14 1 1 A 124 124 THR H H 124 8.961 9.635 -0.674 1 1 1366 . 14 1 1 A 124 124 THR HA H 124 5.001 5.000 0.001 1 1 1371 . 14 1 1 A 124 124 THR C C 124 173.468 173.593 -0.125 1 1 1372 . 14 1 1 A 124 124 THR CA C 124 62.109 61.630 0.479 1 1 1373 . 14 1 1 A 124 124 THR CB C 124 70.450 69.497 0.953 1 1 1375 . 14 1 1 A 124 124 THR N N 124 122.176 123.701 -1.525 1 1 1376 . 14 1 1 A 125 125 ARG H H 125 9.386 9.577 -0.191 1 1 1377 . 14 1 1 A 125 125 ARG HA H 125 5.764 5.328 0.436 1 1 1384 . 14 1 1 A 125 125 ARG C C 125 175.713 175.593 0.120 1 1 1385 . 14 1 1 A 125 125 ARG CA C 125 53.991 55.209 -1.218 1 1 1386 . 14 1 1 A 125 125 ARG CB C 125 33.557 32.425 1.132 1 1 1389 . 14 1 1 A 125 125 ARG N N 125 130.004 127.242 2.762 1 1 1390 . 14 1 1 A 126 126 SER H H 126 9.172 9.321 -0.149 1 1 1391 . 14 1 1 A 126 126 SER HA H 126 5.390 5.151 0.239 1 1 1394 . 14 1 1 A 126 126 SER C C 126 172.359 173.336 -0.977 1 1 1395 . 14 1 1 A 126 126 SER CA C 126 56.934 57.764 -0.830 1 1 1396 . 14 1 1 A 126 126 SER CB C 126 65.827 65.808 0.019 1 1 1397 . 14 1 1 A 126 126 SER N N 126 119.906 119.177 0.729 1 1 1398 . 14 1 1 A 127 127 SER H H 127 8.591 8.895 -0.304 1 1 1399 . 14 1 1 A 127 127 SER HA H 127 5.739 5.336 0.403 1 1 1401 . 14 1 1 A 127 127 SER C C 127 173.283 173.488 -0.205 1 1 1402 . 14 1 1 A 127 127 SER CA C 127 57.354 57.512 -0.158 1 1 1403 . 14 1 1 A 127 127 SER CB C 127 65.412 64.531 0.881 1 1 1404 . 14 1 1 A 127 127 SER N N 127 117.914 122.285 -4.371 1 1 1405 . 14 1 1 A 128 128 TRP H H 128 9.866 9.960 -0.094 1 1 1406 . 14 1 1 A 128 128 TRP HA H 128 5.560 5.609 -0.049 1 1 1415 . 14 1 1 A 128 128 TRP C C 128 175.828 175.024 0.804 1 1 1416 . 14 1 1 A 128 128 TRP CA C 128 55.852 55.491 0.361 1 1 1417 . 14 1 1 A 128 128 TRP CB C 128 32.524 32.127 0.397 1 1 1423 . 14 1 1 A 128 128 TRP N N 128 127.978 126.611 1.367 1 1 1425 . 14 1 1 A 129 129 LYS H H 129 9.424 9.456 -0.032 1 1 1426 . 14 1 1 A 129 129 LYS HA H 129 5.388 5.151 0.237 1 1 1433 . 14 1 1 A 129 129 LYS C C 129 175.254 174.600 0.654 1 1 1434 . 14 1 1 A 129 129 LYS CA C 129 54.410 55.031 -0.621 1 1 1435 . 14 1 1 A 129 129 LYS CB C 129 35.734 35.169 0.565 1 1 1439 . 14 1 1 A 129 129 LYS N N 129 121.784 125.511 -3.727 1 1 1440 . 14 1 1 A 130 130 LEU H H 130 8.933 9.581 -0.648 1 1 1441 . 14 1 1 A 130 130 LEU HA H 130 4.859 5.183 -0.324 1 1 1447 . 14 1 1 A 130 130 LEU C C 130 173.893 174.617 -0.724 1 1 1448 . 14 1 1 A 130 130 LEU CA C 130 53.848 53.712 0.136 1 1 1449 . 14 1 1 A 130 130 LEU CB C 130 46.125 45.669 0.456 1 1 1451 . 14 1 1 A 130 130 LEU N N 130 124.543 128.599 -4.056 1 1 1452 . 14 1 1 A 131 131 ALA H H 131 8.816 9.036 -0.220 1 1 1453 . 14 1 1 A 131 131 ALA HA H 131 4.776 5.089 -0.313 1 1 1457 . 14 1 1 A 131 131 ALA C C 131 176.662 176.617 0.045 1 1 1458 . 14 1 1 A 131 131 ALA CA C 131 51.407 50.450 0.957 1 1 1459 . 14 1 1 A 131 131 ALA CB C 131 19.354 20.472 -1.118 1 1 1460 . 14 1 1 A 131 131 ALA N N 131 131.102 130.086 1.016 1 1 1461 . 14 1 1 A 132 132 LEU H H 132 8.487 8.851 -0.364 1 1 1462 . 14 1 1 A 132 132 LEU HA H 132 4.470 5.002 -0.532 1 1 1470 . 14 1 1 A 132 132 LEU C C 132 176.873 176.361 0.512 1 1 1471 . 14 1 1 A 132 132 LEU CA C 132 54.590 53.395 1.195 1 1 1472 . 14 1 1 A 132 132 LEU CB C 132 42.974 44.509 -1.535 1 1 1475 . 14 1 1 A 132 132 LEU N N 132 123.724 123.936 -0.212 1 1 1476 . 14 1 1 A 133 133 SER H H 133 8.448 8.419 0.029 1 1 1477 . 14 1 1 A 133 133 SER HA H 133 4.560 5.239 -0.679 1 1 1479 . 14 1 1 A 133 133 SER C C 133 176.043 174.575 1.468 1 1 1480 . 14 1 1 A 133 133 SER CA C 133 58.460 56.665 1.795 1 1 1481 . 14 1 1 A 133 133 SER CB C 133 63.985 64.740 -0.755 1 1 1482 . 14 1 1 A 133 133 SER N N 133 115.880 114.370 1.510 1 1 1483 . 14 1 1 A 134 134 GLY H H 134 8.232 8.715 -0.483 1 1 1484 . 14 1 1 A 134 134 GLY HA2 H 134 4.147 3.846 0.301 1 1 1485 . 14 1 1 A 134 134 GLY HA3 H 134 4.045 3.853 0.192 1 1 1486 . 14 1 1 A 134 134 GLY C C 134 174.013 173.875 0.138 1 1 1487 . 14 1 1 A 134 134 GLY CA C 134 45.337 46.932 -1.595 1 1 1488 . 14 1 1 A 134 134 GLY N N 134 109.970 112.252 -2.282 1 1 1489 . 14 1 1 A 135 135 ALA H H 135 8.424 7.012 1.412 1 1 1490 . 14 1 1 A 135 135 ALA HA H 135 4.436 4.293 0.143 1 1 1494 . 14 1 1 A 135 135 ALA C C 135 177.537 175.269 2.268 1 1 1495 . 14 1 1 A 135 135 ALA CA C 135 52.721 51.568 1.153 1 1 1496 . 14 1 1 A 135 135 ALA CB C 135 19.265 21.638 -2.373 1 1 1497 . 14 1 1 A 135 135 ALA N N 135 124.118 118.026 6.092 1 1 1498 . 14 1 1 A 136 136 HIS H H 136 8.466 8.576 -0.110 1 1 1499 . 14 1 1 A 136 136 HIS HA H 136 4.379 4.852 -0.473 1 1 1500 . 14 1 1 A 136 136 HIS C C 136 176.259 175.569 0.690 1 1 1501 . 14 1 1 A 136 136 HIS CA C 136 56.082 55.381 0.701 1 1 1502 . 14 1 1 A 136 136 HIS CB C 136 29.619 28.462 1.157 1 1 1503 . 14 1 1 A 136 136 HIS N N 136 119.493 117.750 1.743 1 1 1504 . 14 1 1 A 137 137 GLY H H 137 8.431 8.205 0.226 1 1 1505 . 14 1 1 A 137 137 GLY HA2 H 137 4.151 3.974 0.177 1 1 1506 . 14 1 1 A 137 137 GLY HA3 H 137 3.893 3.993 -0.100 1 1 1507 . 14 1 1 A 137 137 GLY C C 137 174.039 173.628 0.411 1 1 1508 . 14 1 1 A 137 137 GLY CA C 137 45.372 46.119 -0.747 1 1 1509 . 14 1 1 A 137 137 GLY N N 137 110.442 110.453 -0.011 1 1 1510 . 14 1 1 A 138 138 GLN H H 138 8.416 8.187 0.229 1 1 1511 . 14 1 1 A 138 138 GLN HA H 138 4.455 4.681 -0.226 1 1 1515 . 14 1 1 A 138 138 GLN C C 138 175.889 175.091 0.798 1 1 1516 . 14 1 1 A 138 138 GLN CA C 138 55.866 55.099 0.767 1 1 1517 . 14 1 1 A 138 138 GLN CB C 138 29.639 29.771 -0.132 1 1 1518 . 14 1 1 A 138 138 GLN N N 138 119.401 119.248 0.153 1 1 1519 . 14 1 1 A 139 139 GLU H H 139 8.446 8.775 -0.329 1 1 1520 . 14 1 1 A 139 139 GLU HA H 139 4.658 4.852 -0.194 1 1 1524 . 14 1 1 A 139 139 GLU CA C 139 54.589 53.285 1.304 1 1 1525 . 14 1 1 A 139 139 GLU CB C 139 29.733 30.834 -1.101 1 1 1527 . 14 1 1 A 139 139 GLU N N 139 123.136 124.750 -1.614 1 1 1528 . 14 1 1 A 140 140 PRO HA H 140 4.537 4.919 -0.382 1 1 1533 . 14 1 1 A 140 140 PRO C C 140 176.119 176.203 -0.084 1 1 1534 . 14 1 1 A 140 140 PRO CA C 140 63.220 62.423 0.797 1 1 1535 . 14 1 1 A 140 140 PRO CB C 140 31.936 31.607 0.329 1 1 1538 . 14 1 1 A 141 141 GLN H H 141 8.506 8.417 0.089 1 1 1539 . 14 1 1 A 141 141 GLN HA H 141 4.650 4.638 0.012 1 1 1546 . 14 1 1 A 141 141 GLN C C 141 175.811 175.671 0.140 1 1 1547 . 14 1 1 A 141 141 GLN CA C 141 55.912 55.700 0.212 1 1 1548 . 14 1 1 A 141 141 GLN CB C 141 30.241 29.003 1.238 1 1 1550 . 14 1 1 A 141 141 GLN N N 141 120.422 123.117 -2.695 1 1 1551 . 14 1 1 A 142 142 LEU H H 142 8.842 9.200 -0.358 1 1 1552 . 14 1 1 A 142 142 LEU HA H 142 5.277 5.092 0.185 1 1 1562 . 14 1 1 A 142 142 LEU C C 142 176.839 175.523 1.316 1 1 1563 . 14 1 1 A 142 142 LEU CA C 142 53.927 53.069 0.858 1 1 1564 . 14 1 1 A 142 142 LEU CB C 142 44.527 44.098 0.429 1 1 1568 . 14 1 1 A 142 142 LEU N N 142 123.692 121.023 2.669 1 1 1569 . 14 1 1 A 143 143 THR H H 143 9.025 8.724 0.301 1 1 1570 . 14 1 1 A 143 143 THR HA H 143 5.262 4.916 0.346 1 1 1575 . 14 1 1 A 143 143 THR C C 143 173.753 174.137 -0.384 1 1 1576 . 14 1 1 A 143 143 THR CA C 143 61.795 61.893 -0.098 1 1 1577 . 14 1 1 A 143 143 THR CB C 143 70.660 70.615 0.045 1 1 1579 . 14 1 1 A 143 143 THR N N 143 117.222 117.165 0.057 1 1 1580 . 14 1 1 A 144 144 ILE H H 144 9.353 10.151 -0.798 1 1 1581 . 14 1 1 A 144 144 ILE HA H 144 5.399 5.108 0.291 1 1 1591 . 14 1 1 A 144 144 ILE C C 144 173.931 173.809 0.122 1 1 1592 . 14 1 1 A 144 144 ILE CA C 144 60.774 60.348 0.426 1 1 1593 . 14 1 1 A 144 144 ILE CB C 144 41.111 39.416 1.695 1 1 1597 . 14 1 1 A 144 144 ILE N N 144 126.383 128.399 -2.016 1 1 1598 . 14 1 1 A 145 145 ASP H H 145 9.214 9.403 -0.189 1 1 1599 . 14 1 1 A 145 145 ASP HA H 145 5.978 5.360 0.618 1 1 1601 . 14 1 1 A 145 145 ASP C C 145 175.441 174.925 0.516 1 1 1602 . 14 1 1 A 145 145 ASP CA C 145 53.035 52.809 0.226 1 1 1603 . 14 1 1 A 145 145 ASP CB C 145 44.153 43.708 0.445 1 1 1604 . 14 1 1 A 145 145 ASP N N 145 127.981 128.806 -0.825 1 1 1605 . 14 1 1 A 146 146 LEU H H 146 9.387 9.934 -0.547 1 1 1606 . 14 1 1 A 146 146 LEU HA H 146 4.918 5.451 -0.533 1 1 1616 . 14 1 1 A 146 146 LEU C C 146 175.003 174.742 0.261 1 1 1617 . 14 1 1 A 146 146 LEU CA C 146 53.940 53.630 0.310 1 1 1618 . 14 1 1 A 146 146 LEU CB C 146 43.902 42.847 1.055 1 1 1622 . 14 1 1 A 146 146 LEU N N 146 123.532 127.398 -3.866 1 1 1623 . 14 1 1 A 147 147 ASP H H 147 8.676 8.932 -0.256 1 1 1624 . 14 1 1 A 147 147 ASP HA H 147 5.205 5.237 -0.032 1 1 1627 . 14 1 1 A 147 147 ASP C C 147 174.956 174.872 0.084 1 1 1628 . 14 1 1 A 147 147 ASP CA C 147 53.441 52.490 0.951 1 1 1629 . 14 1 1 A 147 147 ASP CB C 147 43.370 43.413 -0.043 1 1 1630 . 14 1 1 A 147 147 ASP N N 147 125.499 125.974 -0.475 1 1 1631 . 14 1 1 A 148 148 SER H H 148 8.732 9.212 -0.480 1 1 1632 . 14 1 1 A 148 148 SER HA H 148 5.365 5.371 -0.006 1 1 1634 . 14 1 1 A 148 148 SER C C 148 173.217 173.296 -0.079 1 1 1635 . 14 1 1 A 148 148 SER CA C 148 56.334 56.071 0.263 1 1 1636 . 14 1 1 A 148 148 SER CB C 148 65.812 66.564 -0.752 1 1 1637 . 14 1 1 A 148 148 SER N N 148 118.623 118.673 -0.050 1 1 1638 . 14 1 1 A 149 149 ALA H H 149 8.937 8.582 0.355 1 1 1639 . 14 1 1 A 149 149 ALA HA H 149 5.681 5.160 0.521 1 1 1643 . 14 1 1 A 149 149 ALA C C 149 178.894 177.232 1.662 1 1 1644 . 14 1 1 A 149 149 ALA CA C 149 49.996 50.245 -0.249 1 1 1645 . 14 1 1 A 149 149 ALA CB C 149 23.231 22.603 0.628 1 1 1646 . 14 1 1 A 149 149 ALA N N 149 123.952 121.028 2.924 1 1 1647 . 14 1 1 A 150 150 ASP H H 150 9.010 8.477 0.533 1 1 1648 . 14 1 1 A 150 150 ASP HA H 150 4.336 4.214 0.122 1 1 1651 . 14 1 1 A 150 150 ASP C C 150 176.697 177.940 -1.243 1 1 1652 . 14 1 1 A 150 150 ASP CA C 150 56.543 56.979 -0.436 1 1 1653 . 14 1 1 A 150 150 ASP CB C 150 39.850 40.143 -0.293 1 1 1654 . 14 1 1 A 150 150 ASP N N 150 122.687 120.258 2.429 1 1 1655 . 14 1 1 A 151 151 PHE H H 151 7.295 7.552 -0.257 1 1 1656 . 14 1 1 A 151 151 PHE HA H 151 5.020 4.636 0.384 1 1 1661 . 14 1 1 A 151 151 PHE C C 151 174.756 175.610 -0.854 1 1 1662 . 14 1 1 A 151 151 PHE CA C 151 56.594 58.138 -1.544 1 1 1663 . 14 1 1 A 151 151 PHE CB C 151 37.765 39.265 -1.500 1 1 1666 . 14 1 1 A 151 151 PHE N N 151 113.928 115.338 -1.410 1 1 1667 . 14 1 1 A 152 152 GLY H H 152 7.786 7.897 -0.111 1 1 1668 . 14 1 1 A 152 152 GLY HA2 H 152 4.459 4.014 0.445 1 1 1669 . 14 1 1 A 152 152 GLY HA3 H 152 3.728 4.050 -0.322 1 1 1670 . 14 1 1 A 152 152 GLY C C 152 172.709 173.317 -0.608 1 1 1671 . 14 1 1 A 152 152 GLY CA C 152 46.106 46.690 -0.584 1 1 1672 . 14 1 1 A 152 152 GLY N N 152 110.312 108.456 1.856 1 1 1673 . 14 1 1 A 153 153 TYR H H 153 6.650 7.166 -0.516 1 1 1674 . 14 1 1 A 153 153 TYR HA H 153 4.508 4.964 -0.456 1 1 1679 . 14 1 1 A 153 153 TYR C C 153 173.092 173.334 -0.242 1 1 1680 . 14 1 1 A 153 153 TYR CA C 153 57.464 57.481 -0.017 1 1 1681 . 14 1 1 A 153 153 TYR CB C 153 41.962 42.228 -0.266 1 1 1684 . 14 1 1 A 153 153 TYR N N 153 121.977 119.272 2.705 1 1 1685 . 14 1 1 A 154 154 ALA H H 154 7.847 7.860 -0.013 1 1 1686 . 14 1 1 A 154 154 ALA HA H 154 5.144 5.163 -0.019 1 1 1690 . 14 1 1 A 154 154 ALA C C 154 174.468 174.729 -0.261 1 1 1691 . 14 1 1 A 154 154 ALA CA C 154 51.776 50.520 1.256 1 1 1692 . 14 1 1 A 154 154 ALA CB C 154 21.747 23.348 -1.601 1 1 1693 . 14 1 1 A 154 154 ALA N N 154 130.258 128.354 1.904 1 1 1694 . 14 1 1 A 155 155 VAL H H 155 8.733 8.975 -0.242 1 1 1695 . 14 1 1 A 155 155 VAL HA H 155 4.150 4.599 -0.449 1 1 1700 . 14 1 1 A 155 155 VAL C C 155 172.632 172.745 -0.113 1 1 1701 . 14 1 1 A 155 155 VAL CA C 155 61.451 59.416 2.035 1 1 1702 . 14 1 1 A 155 155 VAL CB C 155 35.883 35.952 -0.069 1 1 1704 . 14 1 1 A 155 155 VAL N N 155 119.622 117.826 1.796 1 1 1705 . 14 1 1 A 156 156 GLY H H 156 8.146 8.460 -0.314 1 1 1706 . 14 1 1 A 156 156 GLY HA2 H 156 5.125 2.971 2.154 1 1 1707 . 14 1 1 A 156 156 GLY HA3 H 156 2.061 3.961 -1.900 1 1 1708 . 14 1 1 A 156 156 GLY C C 156 171.746 171.512 0.234 1 1 1709 . 14 1 1 A 156 156 GLY CA C 156 43.319 43.599 -0.280 1 1 1710 . 14 1 1 A 156 156 GLY N N 156 113.332 113.395 -0.063 1 1 1711 . 14 1 1 A 157 157 GLU H H 157 8.967 8.703 0.264 1 1 1712 . 14 1 1 A 157 157 GLU HA H 157 5.217 5.139 0.078 1 1 1716 . 14 1 1 A 157 157 GLU C C 157 174.476 175.265 -0.789 1 1 1717 . 14 1 1 A 157 157 GLU CA C 157 55.390 54.837 0.553 1 1 1718 . 14 1 1 A 157 157 GLU CB C 157 34.010 33.370 0.640 1 1 1720 . 14 1 1 A 157 157 GLU N N 157 120.823 121.831 -1.008 1 1 1721 . 14 1 1 A 158 158 VAL H H 158 9.076 9.688 -0.612 1 1 1722 . 14 1 1 A 158 158 VAL HA H 158 5.206 4.811 0.395 1 1 1727 . 14 1 1 A 158 158 VAL C C 158 173.900 174.254 -0.354 1 1 1728 . 14 1 1 A 158 158 VAL CA C 158 60.813 61.667 -0.854 1 1 1729 . 14 1 1 A 158 158 VAL CB C 158 33.385 33.286 0.099 1 1 1731 . 14 1 1 A 158 158 VAL N N 158 124.349 124.759 -0.410 1 1 1732 . 14 1 1 A 159 159 GLU H H 159 9.239 9.609 -0.370 1 1 1733 . 14 1 1 A 159 159 GLU HA H 159 5.647 5.015 0.632 1 1 1738 . 14 1 1 A 159 159 GLU C C 159 174.469 175.291 -0.822 1 1 1739 . 14 1 1 A 159 159 GLU CA C 159 54.473 54.907 -0.434 1 1 1740 . 14 1 1 A 159 159 GLU CB C 159 33.852 32.142 1.710 1 1 1742 . 14 1 1 A 159 159 GLU N N 159 125.772 128.837 -3.065 1 1 1743 . 14 1 1 A 160 160 ALA H H 160 9.250 9.076 0.174 1 1 1744 . 14 1 1 A 160 160 ALA HA H 160 4.966 5.298 -0.332 1 1 1748 . 14 1 1 A 160 160 ALA C C 160 175.114 175.716 -0.602 1 1 1749 . 14 1 1 A 160 160 ALA CA C 160 50.644 50.224 0.420 1 1 1750 . 14 1 1 A 160 160 ALA CB C 160 23.263 22.823 0.440 1 1 1751 . 14 1 1 A 160 160 ALA N N 160 125.092 129.261 -4.169 1 1 1752 . 14 1 1 A 161 161 MET H H 161 8.559 8.852 -0.293 1 1 1753 . 14 1 1 A 161 161 MET HA H 161 5.468 5.909 -0.441 1 1 1761 . 14 1 1 A 161 161 MET C C 161 176.265 174.833 1.432 1 1 1762 . 14 1 1 A 161 161 MET CA C 161 53.818 54.292 -0.474 1 1 1763 . 14 1 1 A 161 161 MET CB C 161 34.380 35.687 -1.307 1 1 1766 . 14 1 1 A 161 161 MET N N 161 118.699 119.870 -1.171 1 1 1767 . 14 1 1 A 162 162 VAL H H 162 9.046 9.066 -0.020 1 1 1768 . 14 1 1 A 162 162 VAL HA H 162 4.841 4.886 -0.045 1 1 1776 . 14 1 1 A 162 162 VAL C C 162 174.794 175.875 -1.081 1 1 1777 . 14 1 1 A 162 162 VAL CA C 162 59.107 59.814 -0.707 1 1 1778 . 14 1 1 A 162 162 VAL CB C 162 34.018 34.276 -0.258 1 1 1781 . 14 1 1 A 162 162 VAL N N 162 116.435 119.526 -3.091 1 1 1782 . 14 1 1 A 163 163 HIS H H 163 8.793 8.686 0.107 1 1 1783 . 14 1 1 A 163 163 HIS HA H 163 4.717 4.786 -0.069 1 1 1787 . 14 1 1 A 163 163 HIS C C 163 175.460 174.367 1.093 1 1 1788 . 14 1 1 A 163 163 HIS CA C 163 58.488 57.410 1.078 1 1 1789 . 14 1 1 A 163 163 HIS CB C 163 31.185 30.451 0.734 1 1 1791 . 14 1 1 A 163 163 HIS N N 163 117.838 121.760 -3.922 1 1 1792 . 14 1 1 A 164 164 GLU H H 164 8.013 7.759 0.254 1 1 1793 . 14 1 1 A 164 164 GLU HA H 164 4.814 4.694 0.120 1 1 1797 . 14 1 1 A 164 164 GLU C C 164 176.910 176.407 0.503 1 1 1798 . 14 1 1 A 164 164 GLU CA C 164 54.355 55.319 -0.964 1 1 1799 . 14 1 1 A 164 164 GLU CB C 164 32.886 32.499 0.387 1 1 1801 . 14 1 1 A 164 164 GLU N N 164 115.943 119.477 -3.534 1 1 1802 . 14 1 1 A 165 165 LYS H H 165 9.088 8.878 0.210 1 1 1803 . 14 1 1 A 165 165 LYS HA H 165 3.942 4.077 -0.135 1 1 1809 . 14 1 1 A 165 165 LYS C C 165 179.657 177.833 1.824 1 1 1810 . 14 1 1 A 165 165 LYS CA C 165 59.888 58.292 1.596 1 1 1811 . 14 1 1 A 165 165 LYS CB C 165 32.024 32.510 -0.486 1 1 1814 . 14 1 1 A 165 165 LYS N N 165 124.120 127.704 -3.584 1 1 1815 . 14 1 1 A 166 166 ALA H H 166 8.851 7.769 1.082 1 1 1816 . 14 1 1 A 166 166 ALA HA H 166 4.251 4.084 0.167 1 1 1820 . 14 1 1 A 166 166 ALA C C 166 178.920 178.456 0.464 1 1 1821 . 14 1 1 A 166 166 ALA CA C 166 54.318 54.515 -0.197 1 1 1822 . 14 1 1 A 166 166 ALA CB C 166 18.810 18.294 0.516 1 1 1823 . 14 1 1 A 166 166 ALA N N 166 120.424 122.466 -2.042 1 1 1824 . 14 1 1 A 167 167 GLU H H 167 7.871 8.271 -0.400 1 1 1825 . 14 1 1 A 167 167 GLU HA H 167 4.404 4.338 0.066 1 1 1829 . 14 1 1 A 167 167 GLU C C 167 177.368 177.809 -0.441 1 1 1830 . 14 1 1 A 167 167 GLU CA C 167 56.701 56.541 0.160 1 1 1831 . 14 1 1 A 167 167 GLU CB C 167 31.208 29.659 1.549 1 1 1833 . 14 1 1 A 167 167 GLU N N 167 114.926 114.991 -0.065 1 1 1834 . 14 1 1 A 168 168 VAL H H 168 7.812 7.391 0.421 1 1 1835 . 14 1 1 A 168 168 VAL HA H 168 3.712 3.693 0.019 1 1 1843 . 14 1 1 A 168 168 VAL CA C 168 68.705 67.916 0.789 1 1 1844 . 14 1 1 A 168 168 VAL CB C 168 29.597 29.826 -0.229 1 1 1847 . 14 1 1 A 168 168 VAL N N 168 120.188 121.653 -1.465 1 1 1848 . 14 1 1 A 169 169 PRO HA H 169 4.252 4.218 0.034 1 1 1851 . 14 1 1 A 169 169 PRO C C 169 179.563 178.793 0.770 1 1 1852 . 14 1 1 A 169 169 PRO CA C 169 67.077 66.753 0.324 1 1 1853 . 14 1 1 A 170 170 ALA H H 170 8.149 8.180 -0.031 1 1 1854 . 14 1 1 A 170 170 ALA HA H 170 4.265 4.062 0.203 1 1 1858 . 14 1 1 A 170 170 ALA C C 170 180.637 179.672 0.965 1 1 1859 . 14 1 1 A 170 170 ALA CA C 170 54.823 55.269 -0.446 1 1 1860 . 14 1 1 A 170 170 ALA CB C 170 18.518 18.258 0.260 1 1 1861 . 14 1 1 A 170 170 ALA N N 170 119.210 119.292 -0.082 1 1 1862 . 14 1 1 A 171 171 ALA H H 171 7.767 8.164 -0.397 1 1 1863 . 14 1 1 A 171 171 ALA HA H 171 4.106 4.147 -0.041 1 1 1867 . 14 1 1 A 171 171 ALA C C 171 179.371 180.070 -0.699 1 1 1868 . 14 1 1 A 171 171 ALA CA C 171 55.130 55.104 0.026 1 1 1869 . 14 1 1 A 171 171 ALA CB C 171 18.291 18.113 0.178 1 1 1870 . 14 1 1 A 171 171 ALA N N 171 122.126 120.677 1.449 1 1 1871 . 14 1 1 A 172 172 LEU H H 172 8.950 8.485 0.465 1 1 1872 . 14 1 1 A 172 172 LEU HA H 172 3.987 4.094 -0.107 1 1 1878 . 14 1 1 A 172 172 LEU C C 172 178.355 178.327 0.028 1 1 1879 . 14 1 1 A 172 172 LEU CA C 172 57.803 57.827 -0.024 1 1 1880 . 14 1 1 A 172 172 LEU CB C 172 41.667 41.620 0.047 1 1 1882 . 14 1 1 A 172 172 LEU N N 172 118.682 121.282 -2.600 1 1 1883 . 14 1 1 A 173 173 GLU H H 173 7.886 7.917 -0.031 1 1 1884 . 14 1 1 A 173 173 GLU HA H 173 4.132 4.038 0.094 1 1 1887 . 14 1 1 A 173 173 GLU C C 173 179.556 179.092 0.464 1 1 1888 . 14 1 1 A 173 173 GLU CA C 173 59.800 59.197 0.603 1 1 1889 . 14 1 1 A 173 173 GLU CB C 173 29.580 29.106 0.474 1 1 1891 . 14 1 1 A 173 173 GLU N N 173 117.561 118.365 -0.804 1 1 1892 . 14 1 1 A 174 174 LYS H H 174 7.532 7.771 -0.239 1 1 1893 . 14 1 1 A 174 174 LYS HA H 174 4.131 4.089 0.042 1 1 1901 . 14 1 1 A 174 174 LYS CA C 174 58.999 59.361 -0.362 1 1 1902 . 14 1 1 A 174 174 LYS CB C 174 32.041 32.587 -0.546 1 1 1906 . 14 1 1 A 174 174 LYS N N 174 119.085 119.051 0.034 1 1 1907 . 14 1 1 A 175 175 ILE H H 175 8.479 8.028 0.451 1 1 1908 . 14 1 1 A 175 175 ILE HA H 175 3.583 3.580 0.003 1 1 1918 . 14 1 1 A 175 175 ILE C C 175 179.258 178.327 0.931 1 1 1919 . 14 1 1 A 175 175 ILE CA C 175 65.769 65.664 0.105 1 1 1920 . 14 1 1 A 175 175 ILE CB C 175 37.876 37.916 -0.040 1 1 1923 . 14 1 1 A 175 175 ILE N N 175 118.828 120.093 -1.265 1 1 1924 . 14 1 1 A 176 176 ILE H H 176 8.928 7.981 0.947 1 1 1925 . 14 1 1 A 176 176 ILE HA H 176 3.600 3.599 0.001 1 1 1935 . 14 1 1 A 176 176 ILE C C 176 178.827 178.094 0.733 1 1 1936 . 14 1 1 A 176 176 ILE CA C 176 65.640 65.070 0.570 1 1 1937 . 14 1 1 A 176 176 ILE CB C 176 37.451 37.403 0.048 1 1 1941 . 14 1 1 A 176 176 ILE N N 176 124.527 119.972 4.555 1 1 1942 . 14 1 1 A 177 177 THR H H 177 8.175 8.199 -0.024 1 1 1943 . 14 1 1 A 177 177 THR HA H 177 3.885 3.966 -0.081 1 1 1948 . 14 1 1 A 177 177 THR C C 177 176.867 176.332 0.535 1 1 1949 . 14 1 1 A 177 177 THR CA C 177 67.199 66.463 0.736 1 1 1950 . 14 1 1 A 177 177 THR CB C 177 68.377 68.724 -0.347 1 1 1952 . 14 1 1 A 177 177 THR N N 177 119.412 118.596 0.816 1 1 1953 . 14 1 1 A 178 178 VAL H H 178 8.352 7.982 0.370 1 1 1954 . 14 1 1 A 178 178 VAL HA H 178 3.572 3.435 0.137 1 1 1962 . 14 1 1 A 178 178 VAL C C 178 177.664 177.877 -0.213 1 1 1963 . 14 1 1 A 178 178 VAL CA C 178 66.909 66.445 0.464 1 1 1964 . 14 1 1 A 178 178 VAL CB C 178 31.714 31.306 0.408 1 1 1967 . 14 1 1 A 178 178 VAL N N 178 121.168 121.881 -0.713 1 1 1968 . 14 1 1 A 179 179 SER H H 179 8.529 8.059 0.470 1 1 1969 . 14 1 1 A 179 179 SER HA H 179 3.099 3.271 -0.172 1 1 1972 . 14 1 1 A 179 179 SER C C 179 175.380 176.596 -1.216 1 1 1973 . 14 1 1 A 179 179 SER CA C 179 62.728 61.660 1.068 1 1 1974 . 14 1 1 A 179 179 SER CB C 179 62.802 62.532 0.270 1 1 1975 . 14 1 1 A 179 179 SER N N 179 115.226 115.564 -0.338 1 1 1976 . 14 1 1 A 180 180 SER H H 180 7.757 8.662 -0.905 1 1 1977 . 14 1 1 A 180 180 SER HA H 180 4.419 4.327 0.092 1 1 1980 . 14 1 1 A 180 180 SER C C 180 175.359 175.894 -0.535 1 1 1981 . 14 1 1 A 180 180 SER CA C 180 61.025 61.209 -0.184 1 1 1982 . 14 1 1 A 180 180 SER CB C 180 63.072 62.528 0.544 1 1 1983 . 14 1 1 A 180 180 SER N N 180 114.718 116.105 -1.387 1 1 1984 . 14 1 1 A 181 181 MET H H 181 7.497 7.967 -0.470 1 1 1985 . 14 1 1 A 181 181 MET HA H 181 4.283 4.209 0.074 1 1 1993 . 14 1 1 A 181 181 MET C C 181 177.217 177.648 -0.431 1 1 1994 . 14 1 1 A 181 181 MET CA C 181 57.539 58.005 -0.466 1 1 1995 . 14 1 1 A 181 181 MET CB C 181 33.493 32.349 1.144 1 1 1998 . 14 1 1 A 181 181 MET N N 181 119.274 118.930 0.344 1 1 1999 . 14 1 1 A 182 182 LEU H H 182 7.163 7.514 -0.351 1 1 2000 . 14 1 1 A 182 182 LEU HA H 182 4.133 4.292 -0.159 1 1 2010 . 14 1 1 A 182 182 LEU C C 182 176.289 176.900 -0.611 1 1 2011 . 14 1 1 A 182 182 LEU CA C 182 54.750 55.127 -0.377 1 1 2012 . 14 1 1 A 182 182 LEU CB C 182 43.235 42.577 0.658 1 1 2016 . 14 1 1 A 182 182 LEU N N 182 115.869 118.395 -2.526 1 1 2017 . 14 1 1 A 183 183 GLY H H 183 7.492 7.354 0.138 1 1 2018 . 14 1 1 A 183 183 GLY HA2 H 183 4.086 4.161 -0.075 1 1 2019 . 14 1 1 A 183 183 GLY HA3 H 183 4.425 4.214 0.211 1 1 2020 . 14 1 1 A 183 183 GLY C C 183 171.830 172.066 -0.236 1 1 2021 . 14 1 1 A 183 183 GLY CA C 183 46.035 45.916 0.119 1 1 2022 . 14 1 1 A 183 183 GLY N N 183 107.761 105.693 2.068 1 1 2023 . 14 1 1 A 184 184 VAL H H 184 8.099 8.601 -0.502 1 1 2024 . 14 1 1 A 184 184 VAL HA H 184 4.772 4.769 0.003 1 1 2032 . 14 1 1 A 184 184 VAL CA C 184 59.305 58.823 0.482 1 1 2033 . 14 1 1 A 184 184 VAL CB C 184 33.648 35.108 -1.460 1 1 2036 . 14 1 1 A 184 184 VAL N N 184 119.803 121.957 -2.154 1 1 2037 . 14 1 1 A 185 185 PRO HA H 185 4.442 4.768 -0.326 1 1 2042 . 14 1 1 A 185 185 PRO C C 185 175.871 177.103 -1.232 1 1 2043 . 14 1 1 A 185 185 PRO CA C 185 63.886 62.329 1.557 1 1 2044 . 14 1 1 A 185 185 PRO CB C 185 32.260 32.410 -0.150 1 1 2047 . 14 1 1 A 186 186 ALA H H 186 8.222 9.012 -0.790 1 1 2048 . 14 1 1 A 186 186 ALA HA H 186 4.569 4.565 0.004 1 1 2052 . 14 1 1 A 186 186 ALA C C 186 177.481 176.065 1.416 1 1 2053 . 14 1 1 A 186 186 ALA CA C 186 51.823 50.551 1.272 1 1 2054 . 14 1 1 A 186 186 ALA CB C 186 20.233 19.631 0.602 1 1 2055 . 14 1 1 A 186 186 ALA N N 186 125.663 123.114 2.549 1 1 2056 . 14 1 1 A 187 187 GLN H H 187 8.723 8.787 -0.064 1 1 2057 . 14 1 1 A 187 187 GLN HA H 187 4.420 4.776 -0.356 1 1 2063 . 14 1 1 A 187 187 GLN C C 187 175.566 176.090 -0.524 1 1 2064 . 14 1 1 A 187 187 GLN CA C 187 56.051 54.779 1.272 1 1 2065 . 14 1 1 A 187 187 GLN CB C 187 29.812 29.134 0.678 1 1 2067 . 14 1 1 A 187 187 GLN N N 187 120.742 113.690 7.052 1 1 2069 . 14 1 1 A 188 188 GLU H H 188 8.163 8.844 -0.681 1 1 2070 . 14 1 1 A 188 188 GLU HA H 188 4.405 4.140 0.265 1 1 2074 . 14 1 1 A 188 188 GLU C C 188 176.058 177.312 -1.254 1 1 2075 . 14 1 1 A 188 188 GLU CA C 188 56.158 58.971 -2.813 1 1 2076 . 14 1 1 A 188 188 GLU CB C 188 31.095 29.627 1.468 1 1 2078 . 14 1 1 A 188 188 GLU N N 188 119.177 118.263 0.914 1 1 2079 . 14 1 1 A 189 189 GLU H H 189 8.567 8.043 0.524 1 1 2080 . 14 1 1 A 189 189 GLU HA H 189 4.252 4.215 0.037 1 1 2084 . 14 1 1 A 189 189 GLU C C 189 175.703 176.113 -0.410 1 1 2085 . 14 1 1 A 189 189 GLU CA C 189 56.417 59.090 -2.673 1 1 2086 . 14 1 1 A 189 189 GLU CB C 189 29.968 29.328 0.640 1 1 2088 . 14 1 1 A 189 189 GLU N N 189 120.920 120.055 0.865 1 1 2089 . 14 1 1 A 190 190 ALA H H 190 8.271 8.378 -0.107 1 1 2090 . 14 1 1 A 190 190 ALA HA H 190 4.626 4.031 0.595 1 1 2094 . 14 1 1 A 190 190 ALA CA C 190 50.465 52.588 -2.123 1 1 2095 . 14 1 1 A 190 190 ALA CB C 190 18.451 17.688 0.763 1 1 2096 . 14 1 1 A 190 190 ALA N N 190 128.323 119.542 8.781 1 1 2097 . 14 1 1 A 191 191 PRO HA H 191 4.493 4.656 -0.163 1 1 2103 . 14 1 1 A 191 191 PRO C C 191 175.899 176.286 -0.387 1 1 2104 . 14 1 1 A 191 191 PRO CA C 191 62.044 62.223 -0.179 1 1 2105 . 14 1 1 A 191 191 PRO CB C 191 32.184 29.530 2.654 1 1 2108 . 14 1 1 A 192 192 ALA H H 192 8.610 8.529 0.081 1 1 2109 . 14 1 1 A 192 192 ALA HA H 192 4.280 4.391 -0.111 1 1 2113 . 14 1 1 A 192 192 ALA C C 192 178.282 178.113 0.169 1 1 2114 . 14 1 1 A 192 192 ALA CA C 192 51.698 52.785 -1.087 1 1 2115 . 14 1 1 A 192 192 ALA CB C 192 19.220 19.709 -0.489 1 1 2116 . 14 1 1 A 192 192 ALA N N 192 123.420 124.686 -1.266 1 1 2117 . 14 1 1 A 193 193 LYS H H 193 8.531 9.018 -0.487 1 1 2118 . 14 1 1 A 193 193 LYS HA H 193 3.294 3.956 -0.662 1 1 2126 . 14 1 1 A 193 193 LYS C C 193 177.640 179.091 -1.451 1 1 2127 . 14 1 1 A 193 193 LYS CA C 193 60.644 59.332 1.312 1 1 2128 . 14 1 1 A 193 193 LYS CB C 193 32.607 32.006 0.601 1 1 2132 . 14 1 1 A 193 193 LYS N N 193 122.851 121.362 1.489 1 1 2133 . 14 1 1 A 194 194 LEU H H 194 8.570 8.073 0.497 1 1 2134 . 14 1 1 A 194 194 LEU HA H 194 3.845 4.388 -0.543 1 1 2144 . 14 1 1 A 194 194 LEU C C 194 177.965 178.719 -0.754 1 1 2145 . 14 1 1 A 194 194 LEU CA C 194 57.611 57.759 -0.148 1 1 2146 . 14 1 1 A 194 194 LEU CB C 194 41.776 40.869 0.907 1 1 2150 . 14 1 1 A 194 194 LEU N N 194 115.801 121.549 -5.748 1 1 2151 . 14 1 1 A 195 195 MET H H 195 6.782 8.212 -1.430 1 1 2152 . 14 1 1 A 195 195 MET HA H 195 4.487 4.142 0.345 1 1 2160 . 14 1 1 A 195 195 MET C C 195 178.280 178.253 0.027 1 1 2161 . 14 1 1 A 195 195 MET CA C 195 56.858 58.428 -1.570 1 1 2162 . 14 1 1 A 195 195 MET CB C 195 31.557 31.918 -0.361 1 1 2165 . 14 1 1 A 195 195 MET N N 195 113.898 119.507 -5.609 1 1 2166 . 14 1 1 A 196 196 VAL H H 196 7.713 8.036 -0.323 1 1 2167 . 14 1 1 A 196 196 VAL HA H 196 3.501 3.376 0.125 1 1 2175 . 14 1 1 A 196 196 VAL C C 196 177.624 177.764 -0.140 1 1 2176 . 14 1 1 A 196 196 VAL CA C 196 66.318 66.029 0.289 1 1 2177 . 14 1 1 A 196 196 VAL CB C 196 31.380 31.373 0.007 1 1 2180 . 14 1 1 A 196 196 VAL N N 196 120.413 119.818 0.595 1 1 2181 . 14 1 1 A 197 197 TYR H H 197 7.972 8.803 -0.831 1 1 2182 . 14 1 1 A 197 197 TYR HA H 197 3.145 4.256 -1.111 1 1 2187 . 14 1 1 A 197 197 TYR C C 197 177.726 176.910 0.816 1 1 2188 . 14 1 1 A 197 197 TYR CA C 197 62.253 61.902 0.351 1 1 2189 . 14 1 1 A 197 197 TYR CB C 197 37.314 38.687 -1.373 1 1 2192 . 14 1 1 A 197 197 TYR N N 197 119.543 121.456 -1.913 1 1 2193 . 14 1 1 A 198 198 LEU H H 198 8.630 8.277 0.353 1 1 2194 . 14 1 1 A 198 198 LEU HA H 198 3.923 3.608 0.315 1 1 2203 . 14 1 1 A 198 198 LEU C C 198 178.074 179.088 -1.014 1 1 2204 . 14 1 1 A 198 198 LEU CA C 198 58.294 57.670 0.624 1 1 2205 . 14 1 1 A 198 198 LEU CB C 198 42.177 41.296 0.881 1 1 2209 . 14 1 1 A 198 198 LEU N N 198 118.430 119.274 -0.844 1 1 2210 . 14 1 1 A 199 199 GLN H H 199 8.082 8.755 -0.673 1 1 2211 . 14 1 1 A 199 199 GLN HA H 199 3.054 3.479 -0.425 1 1 2216 . 14 1 1 A 199 199 GLN C C 199 176.875 178.386 -1.511 1 1 2217 . 14 1 1 A 199 199 GLN CA C 199 59.739 58.938 0.801 1 1 2218 . 14 1 1 A 199 199 GLN CB C 199 28.055 27.661 0.394 1 1 2220 . 14 1 1 A 199 199 GLN N N 199 117.926 117.980 -0.054 1 1 2222 . 14 1 1 A 200 200 ARG H H 200 7.349 8.283 -0.934 1 1 2223 . 14 1 1 A 200 200 ARG HA H 200 3.798 3.838 -0.040 1 1 2231 . 14 1 1 A 200 200 ARG C C 200 178.037 178.128 -0.091 1 1 2232 . 14 1 1 A 200 200 ARG CA C 200 58.260 58.707 -0.447 1 1 2233 . 14 1 1 A 200 200 ARG CB C 200 30.706 29.843 0.863 1 1 2236 . 14 1 1 A 200 200 ARG N N 200 113.772 119.748 -5.976 1 1 2238 . 14 1 1 A 201 201 PHE H H 201 8.329 7.700 0.629 1 1 2239 . 14 1 1 A 201 201 PHE HA H 201 4.630 4.465 0.165 1 1 2244 . 14 1 1 A 201 201 PHE C C 201 176.606 175.726 0.880 1 1 2245 . 14 1 1 A 201 201 PHE CA C 201 59.014 59.017 -0.003 1 1 2246 . 14 1 1 A 201 201 PHE CB C 201 40.357 40.661 -0.304 1 1 2249 . 14 1 1 A 201 201 PHE N N 201 114.182 115.945 -1.763 1 1 2250 . 14 1 1 A 202 202 ARG H H 202 8.719 8.430 0.289 1 1 2251 . 14 1 1 A 202 202 ARG HA H 202 5.071 4.761 0.310 1 1 2261 . 14 1 1 A 202 202 ARG CA C 202 53.956 53.073 0.883 1 1 2262 . 14 1 1 A 202 202 ARG CB C 202 31.979 30.981 0.998 1 1 2264 . 14 1 1 A 202 202 ARG N N 202 120.115 118.497 1.618 1 1 2266 . 14 1 1 A 203 203 PRO HA H 203 4.348 4.555 -0.207 1 1 2271 . 14 1 1 A 203 203 PRO C C 203 179.736 177.922 1.814 1 1 2272 . 14 1 1 A 203 203 PRO CA C 203 65.674 65.086 0.588 1 1 2273 . 14 1 1 A 203 203 PRO CB C 203 31.717 32.304 -0.587 1 1 2275 . 14 1 1 A 204 204 LEU H H 204 8.875 7.531 1.344 1 1 2276 . 14 1 1 A 204 204 LEU HA H 204 4.291 3.927 0.364 1 1 2286 . 14 1 1 A 204 204 LEU C C 204 180.353 177.715 2.638 1 1 2287 . 14 1 1 A 204 204 LEU CA C 204 58.012 57.137 0.875 1 1 2288 . 14 1 1 A 204 204 LEU CB C 204 40.893 42.075 -1.182 1 1 2292 . 14 1 1 A 204 204 LEU N N 204 118.940 117.380 1.560 1 1 2293 . 14 1 1 A 205 205 ASP H H 205 7.541 8.288 -0.747 1 1 2294 . 14 1 1 A 205 205 ASP HA H 205 4.622 4.391 0.231 1 1 2297 . 14 1 1 A 205 205 ASP C C 205 177.602 177.782 -0.180 1 1 2298 . 14 1 1 A 205 205 ASP CA C 205 57.437 57.240 0.197 1 1 2299 . 14 1 1 A 205 205 ASP CB C 205 41.143 41.061 0.082 1 1 2300 . 14 1 1 A 205 205 ASP N N 205 120.838 119.074 1.764 1 1 2301 . 14 1 1 A 206 206 TYR H H 206 8.237 7.989 0.248 1 1 2302 . 14 1 1 A 206 206 TYR HA H 206 4.018 4.226 -0.208 1 1 2307 . 14 1 1 A 206 206 TYR C C 206 176.433 177.531 -1.098 1 1 2308 . 14 1 1 A 206 206 TYR CA C 206 62.148 60.666 1.482 1 1 2309 . 14 1 1 A 206 206 TYR CB C 206 38.305 37.283 1.022 1 1 2312 . 14 1 1 A 206 206 TYR N N 206 119.475 118.437 1.038 1 1 2313 . 14 1 1 A 207 207 GLN H H 207 8.124 7.532 0.592 1 1 2314 . 14 1 1 A 207 207 GLN HA H 207 3.823 3.735 0.088 1 1 2320 . 14 1 1 A 207 207 GLN C C 207 178.019 177.823 0.196 1 1 2321 . 14 1 1 A 207 207 GLN CA C 207 58.841 58.349 0.492 1 1 2322 . 14 1 1 A 207 207 GLN CB C 207 28.208 28.288 -0.080 1 1 2324 . 14 1 1 A 207 207 GLN N N 207 115.863 122.191 -6.328 1 1 2326 . 14 1 1 A 208 208 ARG H H 208 7.522 8.309 -0.787 1 1 2327 . 14 1 1 A 208 208 ARG HA H 208 4.127 4.065 0.062 1 1 2334 . 14 1 1 A 208 208 ARG C C 208 179.278 178.504 0.774 1 1 2335 . 14 1 1 A 208 208 ARG CA C 208 59.419 58.788 0.631 1 1 2336 . 14 1 1 A 208 208 ARG CB C 208 30.182 30.483 -0.301 1 1 2338 . 14 1 1 A 208 208 ARG N N 208 118.471 118.050 0.421 1 1 2340 . 14 1 1 A 209 209 LEU H H 209 7.869 7.629 0.240 1 1 2341 . 14 1 1 A 209 209 LEU HA H 209 4.091 4.229 -0.138 1 1 2351 . 14 1 1 A 209 209 LEU C C 209 179.715 178.410 1.305 1 1 2352 . 14 1 1 A 209 209 LEU CA C 209 57.891 58.020 -0.129 1 1 2353 . 14 1 1 A 209 209 LEU CB C 209 41.338 41.359 -0.021 1 1 2356 . 14 1 1 A 209 209 LEU N N 209 119.659 122.048 -2.389 1 1 2357 . 14 1 1 A 210 210 LEU H H 210 8.034 8.076 -0.042 1 1 2358 . 14 1 1 A 210 210 LEU HA H 210 3.977 4.012 -0.035 1 1 2367 . 14 1 1 A 210 210 LEU C C 210 180.363 178.565 1.798 1 1 2368 . 14 1 1 A 210 210 LEU CA C 210 57.459 58.513 -1.054 1 1 2369 . 14 1 1 A 210 210 LEU CB C 210 41.699 41.357 0.342 1 1 2373 . 14 1 1 A 210 210 LEU N N 210 120.967 119.792 1.175 1 1 2374 . 14 1 1 A 211 211 GLU H H 211 8.174 8.736 -0.562 1 1 2375 . 14 1 1 A 211 211 GLU HA H 211 4.075 4.075 0.000 1 1 2379 . 14 1 1 A 211 211 GLU C C 211 178.499 178.061 0.438 1 1 2380 . 14 1 1 A 211 211 GLU CA C 211 58.575 59.533 -0.958 1 1 2381 . 14 1 1 A 211 211 GLU CB C 211 29.583 29.165 0.418 1 1 2383 . 14 1 1 A 211 211 GLU N N 211 119.217 118.327 0.890 1 1 2384 . 14 1 1 A 212 212 ALA H H 212 7.723 7.778 -0.055 1 1 2385 . 14 1 1 A 212 212 ALA HA H 212 4.291 4.334 -0.043 1 1 2389 . 14 1 1 A 212 212 ALA C C 212 178.770 177.800 0.970 1 1 2390 . 14 1 1 A 212 212 ALA CA C 212 53.966 53.304 0.662 1 1 2391 . 14 1 1 A 212 212 ALA CB C 212 19.117 19.364 -0.247 1 1 2392 . 14 1 1 A 212 212 ALA N N 212 121.798 121.800 -0.002 1 1 2393 . 14 1 1 A 213 213 ALA H H 213 7.743 7.578 0.165 1 1 2394 . 14 1 1 A 213 213 ALA HA H 213 4.406 4.789 -0.383 1 1 2398 . 14 1 1 A 213 213 ALA C C 213 178.413 178.167 0.246 1 1 2399 . 14 1 1 A 213 213 ALA CA C 213 53.129 50.888 2.241 1 1 2400 . 14 1 1 A 213 213 ALA CB C 213 18.926 19.889 -0.963 1 1 2401 . 14 1 1 A 213 213 ALA N N 213 120.435 121.064 -0.629 1 1 2402 . 14 1 1 A 214 214 SER H H 214 7.944 8.282 -0.338 1 1 2403 . 14 1 1 A 214 214 SER HA H 214 4.559 4.399 0.160 1 1 2406 . 14 1 1 A 214 214 SER C C 214 174.958 174.934 0.024 1 1 2407 . 14 1 1 A 214 214 SER CA C 214 58.640 60.618 -1.978 1 1 2408 . 14 1 1 A 214 214 SER CB C 214 63.928 63.322 0.606 1 1 2409 . 14 1 1 A 214 214 SER N N 214 113.729 114.086 -0.357 1 1 2410 . 14 1 1 A 215 215 SER H H 215 8.255 7.823 0.432 1 1 2411 . 14 1 1 A 215 215 SER HA H 215 4.547 4.706 -0.159 1 1 2413 . 14 1 1 A 215 215 SER C C 215 175.289 173.065 2.224 1 1 2414 . 14 1 1 A 215 215 SER CA C 215 58.833 56.586 2.247 1 1 2415 . 14 1 1 A 215 215 SER CB C 215 63.847 63.560 0.287 1 1 2416 . 14 1 1 A 215 215 SER N N 215 117.674 113.159 4.515 1 1 2417 . 14 1 1 A 216 216 GLY H H 216 8.431 8.954 -0.523 1 1 2418 . 14 1 1 A 216 216 GLY HA2 H 216 4.054 3.939 0.115 1 1 2419 . 14 1 1 A 216 216 GLY C C 216 174.189 173.304 0.885 1 1 2420 . 14 1 1 A 216 216 GLY CA C 216 45.412 47.135 -1.723 1 1 2421 . 14 1 1 A 216 216 GLY N N 216 110.800 112.366 -1.566 1 1 2422 . 14 1 1 A 217 217 GLU H H 217 8.267 8.587 -0.320 1 1 2423 . 14 1 1 A 217 217 GLU HA H 217 4.345 4.696 -0.351 1 1 2427 . 14 1 1 A 217 217 GLU C C 217 176.428 175.835 0.593 1 1 2428 . 14 1 1 A 217 217 GLU CA C 217 56.470 56.223 0.247 1 1 2429 . 14 1 1 A 217 217 GLU CB C 217 30.526 30.753 -0.227 1 1 2430 . 14 1 1 A 217 217 GLU N N 217 120.726 123.995 -3.269 1 1 2431 . 14 1 1 A 218 218 ALA H H 218 8.476 8.746 -0.270 1 1 2432 . 14 1 1 A 218 218 ALA HA H 218 4.467 4.773 -0.306 1 1 2436 . 14 1 1 A 218 218 ALA C C 218 178.015 177.197 0.818 1 1 2437 . 14 1 1 A 218 218 ALA CA C 218 52.547 51.002 1.545 1 1 2438 . 14 1 1 A 218 218 ALA CB C 218 19.242 20.148 -0.906 1 1 2439 . 14 1 1 A 218 218 ALA N N 218 125.534 127.924 -2.390 1 1 2440 . 14 1 1 A 219 219 THR H H 219 8.232 8.681 -0.449 1 1 2441 . 14 1 1 A 219 219 THR HA H 219 4.411 4.210 0.201 1 1 2446 . 14 1 1 A 219 219 THR C C 219 175.327 174.800 0.527 1 1 2447 . 14 1 1 A 219 219 THR CA C 219 61.889 63.358 -1.469 1 1 2448 . 14 1 1 A 219 219 THR CB C 219 69.939 69.344 0.595 1 1 2449 . 14 1 1 A 219 219 THR N N 219 113.242 118.644 -5.402 1 1 2450 . 14 1 1 A 220 220 GLY H H 220 8.418 8.682 -0.264 1 1 2451 . 14 1 1 A 220 220 GLY C C 220 174.037 172.711 1.326 1 1 2452 . 14 1 1 A 220 220 GLY CA C 220 45.408 46.284 -0.876 1 1 2453 . 14 1 1 A 220 220 GLY N N 220 111.031 113.981 -2.950 1 1 2454 . 14 1 1 A 221 221 ASP H H 221 8.345 9.147 -0.802 1 1 2455 . 14 1 1 A 221 221 ASP HA H 221 4.700 5.065 -0.365 1 1 2458 . 14 1 1 A 221 221 ASP C C 221 176.535 175.084 1.451 1 1 2459 . 14 1 1 A 221 221 ASP CA C 221 54.402 53.071 1.331 1 1 2460 . 14 1 1 A 221 221 ASP CB C 221 41.431 43.167 -1.736 1 1 2461 . 14 1 1 A 221 221 ASP N N 221 120.795 125.818 -5.023 1 1 2462 . 14 1 1 A 222 222 SER H H 222 8.353 8.619 -0.266 1 1 2463 . 14 1 1 A 222 222 SER HA H 222 4.493 4.361 0.132 1 1 2465 . 14 1 1 A 222 222 SER C C 222 174.224 175.680 -1.456 1 1 2466 . 14 1 1 A 222 222 SER CA C 222 58.427 58.329 0.098 1 1 2467 . 14 1 1 A 222 222 SER CB C 222 63.860 64.294 -0.434 1 1 2468 . 14 1 1 A 222 222 SER N N 222 116.220 121.754 -5.534 1 1 2469 . 14 1 1 A 223 223 ALA H H 223 8.381 8.795 -0.414 1 1 2470 . 14 1 1 A 223 223 ALA HA H 223 4.461 4.117 0.344 1 1 2474 . 14 1 1 A 223 223 ALA C C 223 176.926 177.335 -0.409 1 1 2475 . 14 1 1 A 223 223 ALA CA C 223 52.583 54.428 -1.845 1 1 2476 . 14 1 1 A 223 223 ALA CB C 223 19.438 19.001 0.437 1 1 2477 . 14 1 1 A 223 223 ALA N N 223 126.592 130.848 -4.256 1 1 1 . 15 1 1 A 2 2 ALA HA H 2 4.274 4.677 -0.403 1 1 5 . 15 1 1 A 2 2 ALA C C 2 177.828 177.274 0.554 1 1 6 . 15 1 1 A 2 2 ALA CA C 2 52.984 51.350 1.634 1 1 7 . 15 1 1 A 2 2 ALA CB C 2 19.138 19.883 -0.745 1 1 8 . 15 1 1 A 3 3 GLN H H 3 8.463 8.573 -0.110 1 1 9 . 15 1 1 A 3 3 GLN HA H 3 4.676 4.897 -0.221 1 1 12 . 15 1 1 A 3 3 GLN C C 3 176.002 176.044 -0.042 1 1 13 . 15 1 1 A 3 3 GLN CA C 3 56.258 54.456 1.802 1 1 14 . 15 1 1 A 3 3 GLN CB C 3 30.346 32.387 -2.041 1 1 15 . 15 1 1 A 3 3 GLN N N 3 117.490 120.634 -3.144 1 1 16 . 15 1 1 A 4 4 GLY H H 4 8.099 8.442 -0.343 1 1 17 . 15 1 1 A 4 4 GLY HA2 H 4 3.910 3.877 0.033 1 1 18 . 15 1 1 A 4 4 GLY C C 4 173.332 174.209 -0.877 1 1 19 . 15 1 1 A 4 4 GLY CA C 4 45.333 47.245 -1.912 1 1 20 . 15 1 1 A 4 4 GLY N N 4 109.423 109.727 -0.304 1 1 21 . 15 1 1 A 5 5 LEU H H 5 7.863 8.491 -0.628 1 1 22 . 15 1 1 A 5 5 LEU HA H 5 4.561 4.882 -0.321 1 1 32 . 15 1 1 A 5 5 LEU C C 5 176.448 175.598 0.850 1 1 33 . 15 1 1 A 5 5 LEU CA C 5 54.713 54.143 0.570 1 1 34 . 15 1 1 A 5 5 LEU CB C 5 43.551 41.611 1.940 1 1 38 . 15 1 1 A 5 5 LEU N N 5 120.391 125.797 -5.406 1 1 39 . 15 1 1 A 6 6 ILE H H 6 8.764 9.395 -0.631 1 1 40 . 15 1 1 A 6 6 ILE HA H 6 4.087 4.109 -0.022 1 1 49 . 15 1 1 A 6 6 ILE C C 6 174.679 175.665 -0.986 1 1 50 . 15 1 1 A 6 6 ILE CA C 6 61.279 61.659 -0.380 1 1 51 . 15 1 1 A 6 6 ILE CB C 6 39.651 37.916 1.735 1 1 54 . 15 1 1 A 6 6 ILE N N 6 123.050 126.209 -3.159 1 1 55 . 15 1 1 A 7 7 GLU H H 7 8.587 8.590 -0.003 1 1 56 . 15 1 1 A 7 7 GLU HA H 7 4.917 4.905 0.012 1 1 61 . 15 1 1 A 7 7 GLU C C 7 175.978 176.008 -0.030 1 1 62 . 15 1 1 A 7 7 GLU CA C 7 56.127 56.448 -0.321 1 1 63 . 15 1 1 A 7 7 GLU CB C 7 31.115 30.296 0.819 1 1 65 . 15 1 1 A 7 7 GLU N N 7 127.415 127.817 -0.402 1 1 66 . 15 1 1 A 8 8 VAL H H 8 8.986 9.369 -0.383 1 1 67 . 15 1 1 A 8 8 VAL HA H 8 4.375 4.970 -0.595 1 1 72 . 15 1 1 A 8 8 VAL C C 8 173.704 174.865 -1.161 1 1 73 . 15 1 1 A 8 8 VAL CA C 8 61.347 60.639 0.708 1 1 74 . 15 1 1 A 8 8 VAL CB C 8 33.611 33.726 -0.115 1 1 76 . 15 1 1 A 8 8 VAL N N 8 126.071 120.098 5.973 1 1 77 . 15 1 1 A 9 9 GLU H H 9 8.521 8.944 -0.423 1 1 78 . 15 1 1 A 9 9 GLU HA H 9 5.837 5.373 0.464 1 1 81 . 15 1 1 A 9 9 GLU C C 9 175.939 175.410 0.529 1 1 82 . 15 1 1 A 9 9 GLU CA C 9 54.516 54.796 -0.280 1 1 83 . 15 1 1 A 9 9 GLU CB C 9 33.009 32.746 0.263 1 1 84 . 15 1 1 A 9 9 GLU N N 9 122.857 126.449 -3.592 1 1 85 . 15 1 1 A 10 10 ARG H H 10 8.690 8.663 0.027 1 1 86 . 15 1 1 A 10 10 ARG HA H 10 4.709 5.009 -0.300 1 1 94 . 15 1 1 A 10 10 ARG C C 10 174.826 174.536 0.290 1 1 95 . 15 1 1 A 10 10 ARG CA C 10 54.491 54.390 0.101 1 1 96 . 15 1 1 A 10 10 ARG CB C 10 35.777 34.840 0.937 1 1 98 . 15 1 1 A 10 10 ARG N N 10 120.430 123.417 -2.987 1 1 100 . 15 1 1 A 11 11 LYS H H 11 8.874 8.878 -0.004 1 1 101 . 15 1 1 A 11 11 LYS HA H 11 5.530 5.485 0.045 1 1 107 . 15 1 1 A 11 11 LYS C C 11 176.919 174.697 2.222 1 1 108 . 15 1 1 A 11 11 LYS CA C 11 55.084 54.458 0.626 1 1 109 . 15 1 1 A 11 11 LYS CB C 11 35.435 36.570 -1.135 1 1 113 . 15 1 1 A 11 11 LYS N N 11 121.087 123.247 -2.160 1 1 114 . 15 1 1 A 12 12 PHE H H 12 8.877 9.095 -0.218 1 1 115 . 15 1 1 A 12 12 PHE HA H 12 5.130 5.085 0.045 1 1 120 . 15 1 1 A 12 12 PHE C C 12 171.676 172.057 -0.381 1 1 121 . 15 1 1 A 12 12 PHE CA C 12 55.869 56.360 -0.491 1 1 122 . 15 1 1 A 12 12 PHE CB C 12 42.108 41.586 0.522 1 1 125 . 15 1 1 A 12 12 PHE N N 12 117.486 119.739 -2.253 1 1 126 . 15 1 1 A 13 13 ALA H H 13 9.134 9.316 -0.182 1 1 127 . 15 1 1 A 13 13 ALA HA H 13 5.003 4.684 0.319 1 1 131 . 15 1 1 A 13 13 ALA CA C 13 48.340 48.827 -0.487 1 1 132 . 15 1 1 A 13 13 ALA CB C 13 19.191 20.282 -1.091 1 1 133 . 15 1 1 A 13 13 ALA N N 13 125.915 122.947 2.968 1 1 134 . 15 1 1 A 14 14 PRO HA H 14 4.620 5.219 -0.599 1 1 140 . 15 1 1 A 14 14 PRO C C 14 176.502 177.297 -0.795 1 1 141 . 15 1 1 A 14 14 PRO CA C 14 62.672 62.464 0.208 1 1 142 . 15 1 1 A 14 14 PRO CB C 14 33.119 32.188 0.931 1 1 145 . 15 1 1 A 15 15 GLY H H 15 8.721 8.562 0.159 1 1 146 . 15 1 1 A 15 15 GLY HA2 H 15 3.999 4.081 -0.082 1 1 147 . 15 1 1 A 15 15 GLY HA3 H 15 4.632 4.081 0.551 1 1 148 . 15 1 1 A 15 15 GLY CA C 15 44.411 43.953 0.458 1 1 149 . 15 1 1 A 15 15 GLY N N 15 109.863 107.898 1.965 1 1 150 . 15 1 1 A 16 16 PRO HA H 16 4.447 4.522 -0.075 1 1 155 . 15 1 1 A 16 16 PRO C C 16 177.053 176.823 0.230 1 1 156 . 15 1 1 A 16 16 PRO CA C 16 64.395 64.055 0.340 1 1 157 . 15 1 1 A 16 16 PRO CB C 16 31.993 31.678 0.315 1 1 159 . 15 1 1 A 17 17 ASP H H 17 8.550 8.546 0.004 1 1 160 . 15 1 1 A 17 17 ASP HA H 17 4.950 4.913 0.037 1 1 163 . 15 1 1 A 17 17 ASP C C 17 176.800 177.202 -0.402 1 1 164 . 15 1 1 A 17 17 ASP CA C 17 53.271 53.160 0.111 1 1 165 . 15 1 1 A 17 17 ASP CB C 17 40.392 41.008 -0.616 1 1 166 . 15 1 1 A 17 17 ASP N N 17 116.060 116.032 0.028 1 1 167 . 15 1 1 A 18 18 THR H H 18 7.664 7.139 0.525 1 1 168 . 15 1 1 A 18 18 THR HA H 18 4.120 3.726 0.394 1 1 174 . 15 1 1 A 18 18 THR C C 18 175.407 176.322 -0.915 1 1 175 . 15 1 1 A 18 18 THR CA C 18 68.718 67.201 1.517 1 1 176 . 15 1 1 A 18 18 THR CB C 18 69.179 68.547 0.632 1 1 178 . 15 1 1 A 18 18 THR N N 18 117.158 116.012 1.146 1 1 179 . 15 1 1 A 19 19 GLU H H 19 8.817 8.496 0.321 1 1 180 . 15 1 1 A 19 19 GLU HA H 19 3.510 3.232 0.278 1 1 184 . 15 1 1 A 19 19 GLU C C 19 178.345 179.123 -0.778 1 1 185 . 15 1 1 A 19 19 GLU CA C 19 61.237 59.709 1.528 1 1 186 . 15 1 1 A 19 19 GLU CB C 19 28.746 29.309 -0.563 1 1 188 . 15 1 1 A 19 19 GLU N N 19 118.802 118.654 0.148 1 1 189 . 15 1 1 A 20 20 GLU H H 20 7.976 8.190 -0.214 1 1 190 . 15 1 1 A 20 20 GLU HA H 20 4.036 4.097 -0.061 1 1 194 . 15 1 1 A 20 20 GLU C C 20 179.451 179.387 0.064 1 1 195 . 15 1 1 A 20 20 GLU CA C 20 59.909 59.048 0.861 1 1 196 . 15 1 1 A 20 20 GLU CB C 20 28.992 29.366 -0.374 1 1 198 . 15 1 1 A 20 20 GLU N N 20 121.130 118.921 2.209 1 1 199 . 15 1 1 A 21 21 ARG H H 21 8.199 8.061 0.138 1 1 200 . 15 1 1 A 21 21 ARG HA H 21 4.061 4.143 -0.082 1 1 207 . 15 1 1 A 21 21 ARG C C 21 179.087 178.867 0.220 1 1 208 . 15 1 1 A 21 21 ARG CA C 21 58.477 58.643 -0.166 1 1 209 . 15 1 1 A 21 21 ARG CB C 21 30.101 29.942 0.159 1 1 211 . 15 1 1 A 21 21 ARG N N 21 119.897 120.100 -0.203 1 1 213 . 15 1 1 A 22 22 LEU H H 22 8.154 8.502 -0.348 1 1 214 . 15 1 1 A 22 22 LEU HA H 22 3.560 3.800 -0.240 1 1 224 . 15 1 1 A 22 22 LEU C C 22 178.461 179.452 -0.991 1 1 225 . 15 1 1 A 22 22 LEU CA C 22 58.432 57.803 0.629 1 1 226 . 15 1 1 A 22 22 LEU CB C 22 40.229 40.983 -0.754 1 1 230 . 15 1 1 A 22 22 LEU N N 22 120.012 119.575 0.437 1 1 231 . 15 1 1 A 23 23 GLN H H 23 7.621 7.800 -0.179 1 1 232 . 15 1 1 A 23 23 GLN HA H 23 4.232 4.110 0.122 1 1 238 . 15 1 1 A 23 23 GLN C C 23 180.543 178.161 2.382 1 1 239 . 15 1 1 A 23 23 GLN CA C 23 59.434 59.288 0.146 1 1 240 . 15 1 1 A 23 23 GLN CB C 23 28.749 28.367 0.382 1 1 242 . 15 1 1 A 23 23 GLN N N 23 117.823 118.094 -0.271 1 1 244 . 15 1 1 A 24 24 GLU H H 24 8.165 7.747 0.418 1 1 245 . 15 1 1 A 24 24 GLU HA H 24 4.072 4.180 -0.108 1 1 249 . 15 1 1 A 24 24 GLU C C 24 178.612 179.068 -0.456 1 1 250 . 15 1 1 A 24 24 GLU CA C 24 59.236 58.809 0.427 1 1 251 . 15 1 1 A 24 24 GLU CB C 24 29.606 29.509 0.097 1 1 253 . 15 1 1 A 24 24 GLU N N 24 122.589 119.766 2.823 1 1 254 . 15 1 1 A 25 25 LEU H H 25 7.911 7.983 -0.072 1 1 255 . 15 1 1 A 25 25 LEU HA H 25 4.214 4.100 0.114 1 1 265 . 15 1 1 A 25 25 LEU C C 25 176.745 177.364 -0.619 1 1 266 . 15 1 1 A 25 25 LEU CA C 25 55.659 55.834 -0.175 1 1 267 . 15 1 1 A 25 25 LEU CB C 25 43.109 42.695 0.414 1 1 271 . 15 1 1 A 25 25 LEU N N 25 117.882 116.981 0.901 1 1 272 . 15 1 1 A 26 26 GLY H H 26 7.776 7.957 -0.181 1 1 273 . 15 1 1 A 26 26 GLY HA2 H 26 4.337 4.021 0.316 1 1 274 . 15 1 1 A 26 26 GLY HA3 H 26 3.856 4.037 -0.181 1 1 275 . 15 1 1 A 26 26 GLY C C 26 175.456 174.850 0.606 1 1 276 . 15 1 1 A 26 26 GLY CA C 26 44.875 45.348 -0.473 1 1 277 . 15 1 1 A 26 26 GLY N N 26 104.938 105.923 -0.985 1 1 278 . 15 1 1 A 27 27 ALA H H 27 8.104 8.533 -0.429 1 1 279 . 15 1 1 A 27 27 ALA HA H 27 4.949 4.496 0.453 1 1 283 . 15 1 1 A 27 27 ALA C C 27 176.448 177.412 -0.964 1 1 284 . 15 1 1 A 27 27 ALA CA C 27 52.183 52.487 -0.304 1 1 285 . 15 1 1 A 27 27 ALA CB C 27 21.814 19.935 1.879 1 1 286 . 15 1 1 A 27 27 ALA N N 27 123.263 124.600 -1.337 1 1 287 . 15 1 1 A 28 28 THR H H 28 9.369 9.577 -0.208 1 1 288 . 15 1 1 A 28 28 THR HA H 28 4.779 4.617 0.162 1 1 293 . 15 1 1 A 28 28 THR C C 28 173.725 174.219 -0.494 1 1 294 . 15 1 1 A 28 28 THR CA C 28 60.046 62.679 -2.633 1 1 295 . 15 1 1 A 28 28 THR CB C 28 70.592 69.437 1.155 1 1 297 . 15 1 1 A 28 28 THR N N 28 112.201 119.365 -7.164 1 1 298 . 15 1 1 A 29 29 LEU H H 29 8.518 8.448 0.070 1 1 299 . 15 1 1 A 29 29 LEU HA H 29 3.332 3.797 -0.465 1 1 309 . 15 1 1 A 29 29 LEU C C 29 176.202 176.471 -0.269 1 1 310 . 15 1 1 A 29 29 LEU CA C 29 55.031 54.929 0.102 1 1 311 . 15 1 1 A 29 29 LEU CB C 29 40.624 41.593 -0.969 1 1 315 . 15 1 1 A 29 29 LEU N N 29 128.151 128.475 -0.324 1 1 316 . 15 1 1 A 30 30 GLU H H 30 9.269 9.039 0.230 1 1 317 . 15 1 1 A 30 30 GLU HA H 30 4.287 4.285 0.002 1 1 321 . 15 1 1 A 30 30 GLU C C 30 176.740 175.925 0.815 1 1 322 . 15 1 1 A 30 30 GLU CA C 30 57.283 56.890 0.393 1 1 323 . 15 1 1 A 30 30 GLU CB C 30 31.045 30.579 0.466 1 1 325 . 15 1 1 A 30 30 GLU N N 30 130.123 123.637 6.486 1 1 326 . 15 1 1 A 31 31 HIS H H 31 7.341 7.148 0.193 1 1 327 . 15 1 1 A 31 31 HIS HA H 31 4.701 5.142 -0.441 1 1 331 . 15 1 1 A 31 31 HIS C C 31 172.581 173.803 -1.222 1 1 332 . 15 1 1 A 31 31 HIS CA C 31 55.876 54.656 1.220 1 1 333 . 15 1 1 A 31 31 HIS CB C 31 33.434 34.107 -0.673 1 1 334 . 15 1 1 A 31 31 HIS N N 31 113.223 116.398 -3.175 1 1 335 . 15 1 1 A 32 32 ARG H H 32 8.196 8.967 -0.771 1 1 336 . 15 1 1 A 32 32 ARG HA H 32 5.262 5.315 -0.053 1 1 341 . 15 1 1 A 32 32 ARG C C 32 174.377 174.808 -0.431 1 1 342 . 15 1 1 A 32 32 ARG CA C 32 55.808 54.536 1.272 1 1 343 . 15 1 1 A 32 32 ARG CB C 32 33.340 33.849 -0.509 1 1 345 . 15 1 1 A 32 32 ARG N N 32 123.003 119.465 3.538 1 1 346 . 15 1 1 A 33 33 VAL H H 33 8.956 9.310 -0.354 1 1 347 . 15 1 1 A 33 33 VAL HA H 33 4.734 4.943 -0.209 1 1 355 . 15 1 1 A 33 33 VAL C C 33 172.821 174.972 -2.151 1 1 356 . 15 1 1 A 33 33 VAL CA C 33 60.197 59.840 0.357 1 1 357 . 15 1 1 A 33 33 VAL CB C 33 35.860 34.942 0.918 1 1 360 . 15 1 1 A 33 33 VAL N N 33 122.929 117.600 5.329 1 1 361 . 15 1 1 A 34 34 THR H H 34 8.250 8.884 -0.634 1 1 362 . 15 1 1 A 34 34 THR HA H 34 5.616 5.703 -0.087 1 1 367 . 15 1 1 A 34 34 THR C C 34 173.913 173.662 0.251 1 1 368 . 15 1 1 A 34 34 THR CA C 34 60.245 60.594 -0.349 1 1 369 . 15 1 1 A 34 34 THR CB C 34 71.706 71.299 0.407 1 1 371 . 15 1 1 A 34 34 THR N N 34 119.164 116.342 2.822 1 1 372 . 15 1 1 A 35 35 PHE H H 35 8.565 8.491 0.074 1 1 373 . 15 1 1 A 35 35 PHE HA H 35 5.029 5.035 -0.006 1 1 378 . 15 1 1 A 35 35 PHE C C 35 173.193 172.266 0.927 1 1 379 . 15 1 1 A 35 35 PHE CA C 35 55.687 55.679 0.008 1 1 380 . 15 1 1 A 35 35 PHE CB C 35 40.853 41.099 -0.246 1 1 383 . 15 1 1 A 35 35 PHE N N 35 120.244 118.456 1.788 1 1 384 . 15 1 1 A 36 36 ARG H H 36 8.869 8.562 0.307 1 1 385 . 15 1 1 A 36 36 ARG HA H 36 4.982 4.579 0.403 1 1 387 . 15 1 1 A 36 36 ARG C C 36 174.743 174.776 -0.033 1 1 388 . 15 1 1 A 36 36 ARG CA C 36 55.493 55.534 -0.041 1 1 389 . 15 1 1 A 36 36 ARG CB C 36 32.228 31.634 0.594 1 1 390 . 15 1 1 A 36 36 ARG N N 36 123.893 121.088 2.805 1 1 391 . 15 1 1 A 37 37 ASP H H 37 8.402 9.357 -0.955 1 1 392 . 15 1 1 A 37 37 ASP HA H 37 5.462 5.561 -0.099 1 1 395 . 15 1 1 A 37 37 ASP C C 37 175.177 175.101 0.076 1 1 396 . 15 1 1 A 37 37 ASP CA C 37 53.942 53.073 0.869 1 1 397 . 15 1 1 A 37 37 ASP CB C 37 45.486 42.983 2.503 1 1 398 . 15 1 1 A 37 37 ASP N N 37 127.149 125.965 1.184 1 1 399 . 15 1 1 A 38 38 THR H H 38 8.151 8.708 -0.557 1 1 400 . 15 1 1 A 38 38 THR HA H 38 4.866 5.470 -0.604 1 1 405 . 15 1 1 A 38 38 THR C C 38 172.792 172.913 -0.121 1 1 406 . 15 1 1 A 38 38 THR CA C 38 61.416 60.578 0.838 1 1 407 . 15 1 1 A 38 38 THR CB C 38 71.047 70.862 0.185 1 1 409 . 15 1 1 A 38 38 THR N N 38 115.686 115.958 -0.272 1 1 410 . 15 1 1 A 39 39 TYR H H 39 9.021 9.400 -0.379 1 1 411 . 15 1 1 A 39 39 TYR HA H 39 5.544 5.708 -0.164 1 1 416 . 15 1 1 A 39 39 TYR C C 39 176.032 174.718 1.314 1 1 417 . 15 1 1 A 39 39 TYR CA C 39 57.184 56.481 0.703 1 1 418 . 15 1 1 A 39 39 TYR CB C 39 41.642 40.572 1.070 1 1 420 . 15 1 1 A 39 39 TYR N N 39 124.579 124.886 -0.307 1 1 421 . 15 1 1 A 40 40 TYR H H 40 8.487 9.188 -0.701 1 1 422 . 15 1 1 A 40 40 TYR HA H 40 5.517 5.999 -0.482 1 1 426 . 15 1 1 A 40 40 TYR C C 40 174.108 174.474 -0.366 1 1 427 . 15 1 1 A 40 40 TYR CA C 40 56.979 56.781 0.198 1 1 428 . 15 1 1 A 40 40 TYR CB C 40 44.132 42.586 1.546 1 1 431 . 15 1 1 A 40 40 TYR N N 40 119.709 121.385 -1.676 1 1 432 . 15 1 1 A 41 41 ASP H H 41 9.341 8.703 0.638 1 1 433 . 15 1 1 A 41 41 ASP HA H 41 4.866 5.214 -0.348 1 1 436 . 15 1 1 A 41 41 ASP C C 41 177.262 175.172 2.090 1 1 437 . 15 1 1 A 41 41 ASP CA C 41 53.445 53.469 -0.024 1 1 438 . 15 1 1 A 41 41 ASP CB C 41 45.347 44.676 0.671 1 1 439 . 15 1 1 A 41 41 ASP N N 41 117.995 120.401 -2.406 1 1 440 . 15 1 1 A 42 42 THR H H 42 11.574 8.701 2.873 1 1 441 . 15 1 1 A 42 42 THR HA H 42 5.206 4.619 0.587 1 1 446 . 15 1 1 A 42 42 THR C C 42 177.935 176.411 1.524 1 1 447 . 15 1 1 A 42 42 THR CA C 42 60.400 62.055 -1.655 1 1 448 . 15 1 1 A 42 42 THR CB C 42 72.114 69.736 2.378 1 1 450 . 15 1 1 A 42 42 THR N N 42 114.394 117.374 -2.980 1 1 451 . 15 1 1 A 43 43 SER H H 43 9.715 8.820 0.895 1 1 452 . 15 1 1 A 43 43 SER HA H 43 4.252 4.177 0.075 1 1 455 . 15 1 1 A 43 43 SER C C 43 175.478 174.724 0.754 1 1 456 . 15 1 1 A 43 43 SER CA C 43 61.277 61.100 0.177 1 1 457 . 15 1 1 A 43 43 SER CB C 43 62.821 62.876 -0.055 1 1 458 . 15 1 1 A 43 43 SER N N 43 116.674 118.266 -1.592 1 1 459 . 15 1 1 A 44 44 GLU H H 44 7.674 7.956 -0.282 1 1 460 . 15 1 1 A 44 44 GLU HA H 44 4.330 4.297 0.033 1 1 464 . 15 1 1 A 44 44 GLU C C 44 175.001 176.063 -1.062 1 1 465 . 15 1 1 A 44 44 GLU CA C 44 55.992 55.235 0.757 1 1 466 . 15 1 1 A 44 44 GLU CB C 44 29.276 29.164 0.112 1 1 468 . 15 1 1 A 44 44 GLU N N 44 117.856 117.927 -0.071 1 1 469 . 15 1 1 A 45 45 LEU H H 45 8.222 7.797 0.425 1 1 470 . 15 1 1 A 45 45 LEU HA H 45 3.901 4.784 -0.883 1 1 480 . 15 1 1 A 45 45 LEU C C 45 175.209 176.449 -1.240 1 1 481 . 15 1 1 A 45 45 LEU CA C 45 55.548 56.109 -0.561 1 1 482 . 15 1 1 A 45 45 LEU CB C 45 38.458 39.739 -1.281 1 1 485 . 15 1 1 A 45 45 LEU N N 45 119.335 116.680 2.655 1 1 486 . 15 1 1 A 46 46 SER H H 46 7.347 7.740 -0.393 1 1 487 . 15 1 1 A 46 46 SER HA H 46 3.954 4.264 -0.310 1 1 489 . 15 1 1 A 46 46 SER C C 46 177.497 177.170 0.327 1 1 490 . 15 1 1 A 46 46 SER CA C 46 62.471 61.092 1.379 1 1 491 . 15 1 1 A 46 46 SER CB C 46 63.908 62.964 0.944 1 1 492 . 15 1 1 A 46 46 SER N N 46 111.433 114.002 -2.569 1 1 493 . 15 1 1 A 47 47 LEU H H 47 12.003 8.348 3.655 1 1 494 . 15 1 1 A 47 47 LEU HA H 47 3.959 4.113 -0.154 1 1 504 . 15 1 1 A 47 47 LEU C C 47 180.340 178.397 1.943 1 1 505 . 15 1 1 A 47 47 LEU CA C 47 58.879 58.270 0.609 1 1 506 . 15 1 1 A 47 47 LEU CB C 47 39.572 42.024 -2.452 1 1 510 . 15 1 1 A 47 47 LEU N N 47 124.605 122.981 1.624 1 1 511 . 15 1 1 A 48 48 MET H H 48 10.599 8.942 1.657 1 1 512 . 15 1 1 A 48 48 MET HA H 48 3.213 4.028 -0.815 1 1 520 . 15 1 1 A 48 48 MET C C 48 181.177 178.243 2.934 1 1 521 . 15 1 1 A 48 48 MET CA C 48 60.747 57.866 2.881 1 1 522 . 15 1 1 A 48 48 MET CB C 48 32.594 32.288 0.306 1 1 525 . 15 1 1 A 48 48 MET N N 48 126.254 118.745 7.509 1 1 526 . 15 1 1 A 49 49 LEU H H 49 8.731 7.978 0.753 1 1 527 . 15 1 1 A 49 49 LEU HA H 49 4.097 4.071 0.026 1 1 536 . 15 1 1 A 49 49 LEU C C 49 178.144 177.696 0.448 1 1 537 . 15 1 1 A 49 49 LEU CA C 49 57.800 56.908 0.892 1 1 538 . 15 1 1 A 49 49 LEU CB C 49 41.379 41.917 -0.538 1 1 541 . 15 1 1 A 49 49 LEU N N 49 119.183 120.934 -1.751 1 1 542 . 15 1 1 A 50 50 SER H H 50 7.853 7.578 0.275 1 1 543 . 15 1 1 A 50 50 SER HA H 50 4.822 4.639 0.183 1 1 546 . 15 1 1 A 50 50 SER C C 50 174.539 173.767 0.772 1 1 547 . 15 1 1 A 50 50 SER CA C 50 57.811 57.571 0.240 1 1 548 . 15 1 1 A 50 50 SER CB C 50 64.443 63.100 1.343 1 1 549 . 15 1 1 A 50 50 SER N N 50 114.594 114.021 0.573 1 1 550 . 15 1 1 A 51 51 ASP H H 51 8.264 7.653 0.611 1 1 551 . 15 1 1 A 51 51 ASP HA H 51 4.362 4.319 0.043 1 1 554 . 15 1 1 A 51 51 ASP C C 51 172.921 174.321 -1.400 1 1 555 . 15 1 1 A 51 51 ASP CA C 51 55.343 55.652 -0.309 1 1 556 . 15 1 1 A 51 51 ASP CB C 51 40.583 39.593 0.990 1 1 557 . 15 1 1 A 51 51 ASP N N 51 123.003 118.588 4.415 1 1 558 . 15 1 1 A 52 52 HIS H H 52 7.869 7.296 0.573 1 1 559 . 15 1 1 A 52 52 HIS HA H 52 5.335 5.192 0.143 1 1 564 . 15 1 1 A 52 52 HIS C C 52 173.991 173.366 0.625 1 1 565 . 15 1 1 A 52 52 HIS CA C 52 55.889 54.416 1.473 1 1 566 . 15 1 1 A 52 52 HIS CB C 52 31.789 32.079 -0.290 1 1 568 . 15 1 1 A 52 52 HIS N N 52 112.486 118.507 -6.021 1 1 569 . 15 1 1 A 53 53 TRP H H 53 8.165 9.452 -1.287 1 1 570 . 15 1 1 A 53 53 TRP HA H 53 4.926 5.461 -0.535 1 1 578 . 15 1 1 A 53 53 TRP C C 53 175.354 174.726 0.628 1 1 579 . 15 1 1 A 53 53 TRP CA C 53 55.364 55.334 0.030 1 1 580 . 15 1 1 A 53 53 TRP CB C 53 30.641 32.083 -1.442 1 1 585 . 15 1 1 A 53 53 TRP N N 53 117.916 127.583 -9.667 1 1 587 . 15 1 1 A 54 54 LEU H H 54 10.088 8.925 1.163 1 1 588 . 15 1 1 A 54 54 LEU HA H 54 5.497 5.118 0.379 1 1 598 . 15 1 1 A 54 54 LEU C C 54 173.337 174.651 -1.314 1 1 599 . 15 1 1 A 54 54 LEU CA C 54 54.408 54.205 0.203 1 1 600 . 15 1 1 A 54 54 LEU CB C 54 44.156 46.088 -1.932 1 1 604 . 15 1 1 A 54 54 LEU N N 54 130.826 123.902 6.924 1 1 605 . 15 1 1 A 55 55 ARG H H 55 9.289 9.463 -0.174 1 1 606 . 15 1 1 A 55 55 ARG HA H 55 5.482 5.389 0.093 1 1 612 . 15 1 1 A 55 55 ARG C C 55 174.057 174.071 -0.014 1 1 613 . 15 1 1 A 55 55 ARG CA C 55 53.167 54.132 -0.965 1 1 614 . 15 1 1 A 55 55 ARG CB C 55 34.270 33.489 0.781 1 1 616 . 15 1 1 A 55 55 ARG N N 55 125.089 124.747 0.342 1 1 618 . 15 1 1 A 56 56 GLN H H 56 9.092 8.645 0.447 1 1 619 . 15 1 1 A 56 56 GLN HA H 56 3.991 4.154 -0.163 1 1 626 . 15 1 1 A 56 56 GLN C C 56 174.199 174.754 -0.555 1 1 627 . 15 1 1 A 56 56 GLN CA C 56 54.566 54.470 0.096 1 1 628 . 15 1 1 A 56 56 GLN CB C 56 29.643 29.473 0.170 1 1 630 . 15 1 1 A 56 56 GLN N N 56 124.355 123.198 1.157 1 1 632 . 15 1 1 A 57 57 ARG H H 57 8.440 8.208 0.232 1 1 633 . 15 1 1 A 57 57 ARG HA H 57 5.316 4.867 0.449 1 1 639 . 15 1 1 A 57 57 ARG C C 57 176.188 176.717 -0.529 1 1 640 . 15 1 1 A 57 57 ARG CA C 57 53.940 55.972 -2.032 1 1 641 . 15 1 1 A 57 57 ARG CB C 57 32.426 30.164 2.262 1 1 643 . 15 1 1 A 57 57 ARG N N 57 130.222 125.617 4.605 1 1 645 . 15 1 1 A 58 58 GLU H H 58 8.891 9.734 -0.843 1 1 646 . 15 1 1 A 58 58 GLU HA H 58 3.996 4.223 -0.227 1 1 649 . 15 1 1 A 58 58 GLU CA C 58 58.364 58.646 -0.282 1 1 650 . 15 1 1 A 58 58 GLU CB C 58 30.875 29.713 1.162 1 1 651 . 15 1 1 A 58 58 GLU N N 58 131.208 120.131 11.077 1 1 652 . 15 1 1 A 59 59 GLY H H 59 8.367 7.972 0.395 1 1 653 . 15 1 1 A 59 59 GLY HA2 H 59 4.334 3.976 0.358 1 1 654 . 15 1 1 A 59 59 GLY HA3 H 59 3.743 4.044 -0.301 1 1 655 . 15 1 1 A 59 59 GLY C C 59 174.194 174.981 -0.787 1 1 656 . 15 1 1 A 59 59 GLY CA C 59 45.666 45.521 0.145 1 1 657 . 15 1 1 A 60 60 SER H H 60 8.071 8.352 -0.281 1 1 658 . 15 1 1 A 60 60 SER HA H 60 4.730 4.542 0.188 1 1 661 . 15 1 1 A 60 60 SER C C 60 173.908 174.527 -0.619 1 1 662 . 15 1 1 A 60 60 SER CA C 60 58.762 58.089 0.673 1 1 663 . 15 1 1 A 60 60 SER CB C 60 64.497 63.428 1.069 1 1 664 . 15 1 1 A 60 60 SER N N 60 114.636 116.298 -1.662 1 1 665 . 15 1 1 A 61 61 GLY H H 61 8.401 7.193 1.208 1 1 666 . 15 1 1 A 61 61 GLY HA2 H 61 4.560 4.052 0.508 1 1 667 . 15 1 1 A 61 61 GLY HA3 H 61 3.878 4.102 -0.224 1 1 668 . 15 1 1 A 61 61 GLY C C 61 173.526 172.733 0.793 1 1 669 . 15 1 1 A 61 61 GLY CA C 61 44.906 44.370 0.536 1 1 670 . 15 1 1 A 61 61 GLY N N 61 109.421 108.348 1.073 1 1 671 . 15 1 1 A 62 62 TRP H H 62 8.861 8.434 0.427 1 1 672 . 15 1 1 A 62 62 TRP HA H 62 5.089 5.040 0.049 1 1 681 . 15 1 1 A 62 62 TRP C C 62 176.168 175.654 0.514 1 1 682 . 15 1 1 A 62 62 TRP CA C 62 57.459 57.352 0.107 1 1 683 . 15 1 1 A 62 62 TRP CB C 62 32.536 31.638 0.898 1 1 689 . 15 1 1 A 62 62 TRP N N 62 122.939 121.027 1.912 1 1 691 . 15 1 1 A 63 63 GLU H H 63 9.306 9.609 -0.303 1 1 692 . 15 1 1 A 63 63 GLU HA H 63 4.919 5.746 -0.827 1 1 697 . 15 1 1 A 63 63 GLU C C 63 173.770 175.011 -1.241 1 1 698 . 15 1 1 A 63 63 GLU CA C 63 55.953 55.152 0.801 1 1 699 . 15 1 1 A 63 63 GLU CB C 63 35.317 33.611 1.706 1 1 701 . 15 1 1 A 63 63 GLU N N 63 120.136 122.023 -1.887 1 1 702 . 15 1 1 A 64 64 LEU H H 64 8.998 9.106 -0.108 1 1 703 . 15 1 1 A 64 64 LEU HA H 64 5.616 5.464 0.152 1 1 712 . 15 1 1 A 64 64 LEU C C 64 175.014 174.703 0.311 1 1 713 . 15 1 1 A 64 64 LEU CA C 64 52.945 52.977 -0.032 1 1 714 . 15 1 1 A 64 64 LEU CB C 64 46.904 45.837 1.067 1 1 717 . 15 1 1 A 64 64 LEU N N 64 127.321 122.104 5.217 1 1 718 . 15 1 1 A 65 65 LYS H H 65 9.322 9.225 0.097 1 1 719 . 15 1 1 A 65 65 LYS HA H 65 5.347 5.857 -0.510 1 1 727 . 15 1 1 A 65 65 LYS C C 65 175.811 175.218 0.593 1 1 728 . 15 1 1 A 65 65 LYS CA C 65 55.817 54.947 0.870 1 1 729 . 15 1 1 A 65 65 LYS CB C 65 34.521 34.883 -0.362 1 1 733 . 15 1 1 A 65 65 LYS N N 65 129.874 121.787 8.087 1 1 734 . 15 1 1 A 66 66 CYS H H 66 9.129 9.067 0.062 1 1 735 . 15 1 1 A 66 66 CYS HA H 66 5.319 5.337 -0.018 1 1 738 . 15 1 1 A 66 66 CYS CA C 66 54.532 56.665 -2.133 1 1 739 . 15 1 1 A 66 66 CYS CB C 66 28.813 31.405 -2.592 1 1 740 . 15 1 1 A 66 66 CYS N N 66 121.497 125.114 -3.617 1 1 741 . 15 1 1 A 67 67 PRO HA H 67 4.439 3.994 0.445 1 1 748 . 15 1 1 A 67 67 PRO C C 67 177.297 178.102 -0.805 1 1 749 . 15 1 1 A 67 67 PRO CA C 67 63.596 63.468 0.128 1 1 750 . 15 1 1 A 67 67 PRO CB C 67 32.242 31.542 0.700 1 1 752 . 15 1 1 A 68 68 GLY H H 68 8.316 8.393 -0.077 1 1 753 . 15 1 1 A 68 68 GLY HA2 H 68 3.726 3.985 -0.259 1 1 754 . 15 1 1 A 68 68 GLY HA3 H 68 4.095 4.021 0.074 1 1 755 . 15 1 1 A 68 68 GLY C C 68 173.789 174.188 -0.399 1 1 756 . 15 1 1 A 68 68 GLY CA C 68 45.227 45.304 -0.077 1 1 757 . 15 1 1 A 68 68 GLY N N 68 109.533 109.782 -0.249 1 1 758 . 15 1 1 A 69 69 VAL H H 69 8.114 7.661 0.453 1 1 759 . 15 1 1 A 69 69 VAL HA H 69 4.266 4.052 0.214 1 1 764 . 15 1 1 A 69 69 VAL C C 69 176.299 175.802 0.497 1 1 765 . 15 1 1 A 69 69 VAL CA C 69 61.945 62.916 -0.971 1 1 766 . 15 1 1 A 69 69 VAL CB C 69 33.082 31.739 1.343 1 1 768 . 15 1 1 A 69 69 VAL N N 69 118.540 121.879 -3.339 1 1 769 . 15 1 1 A 70 70 THR H H 70 8.324 8.699 -0.375 1 1 770 . 15 1 1 A 70 70 THR HA H 70 4.373 4.598 -0.225 1 1 775 . 15 1 1 A 70 70 THR C C 70 175.204 174.523 0.681 1 1 776 . 15 1 1 A 70 70 THR CA C 70 62.309 61.102 1.207 1 1 777 . 15 1 1 A 70 70 THR CB C 70 69.787 70.170 -0.383 1 1 779 . 15 1 1 A 70 70 THR N N 70 117.636 120.627 -2.991 1 1 780 . 15 1 1 A 71 71 GLY H H 71 8.574 9.059 -0.485 1 1 781 . 15 1 1 A 71 71 GLY HA2 H 71 4.096 3.969 0.127 1 1 782 . 15 1 1 A 71 71 GLY HA3 H 71 3.975 3.970 0.005 1 1 783 . 15 1 1 A 71 71 GLY C C 71 174.313 174.446 -0.133 1 1 784 . 15 1 1 A 71 71 GLY CA C 71 45.545 45.624 -0.079 1 1 785 . 15 1 1 A 71 71 GLY N N 71 111.677 116.755 -5.078 1 1 786 . 15 1 1 A 72 72 VAL H H 72 7.945 7.808 0.137 1 1 787 . 15 1 1 A 72 72 VAL HA H 72 4.258 4.205 0.053 1 1 795 . 15 1 1 A 72 72 VAL C C 72 176.162 175.612 0.550 1 1 796 . 15 1 1 A 72 72 VAL CA C 72 62.227 61.789 0.438 1 1 797 . 15 1 1 A 72 72 VAL CB C 72 32.997 31.282 1.715 1 1 799 . 15 1 1 A 72 72 VAL N N 72 118.647 119.679 -1.032 1 1 800 . 15 1 1 A 73 73 SER H H 73 8.498 8.701 -0.203 1 1 801 . 15 1 1 A 73 73 SER HA H 73 4.617 4.604 0.013 1 1 803 . 15 1 1 A 73 73 SER C C 73 174.461 173.785 0.676 1 1 804 . 15 1 1 A 73 73 SER CA C 73 58.218 57.934 0.284 1 1 805 . 15 1 1 A 73 73 SER CB C 73 64.061 61.195 2.866 1 1 806 . 15 1 1 A 73 73 SER N N 73 118.828 124.403 -5.575 1 1 807 . 15 1 1 A 74 74 GLY H H 74 8.247 8.564 -0.317 1 1 808 . 15 1 1 A 74 74 GLY HA2 H 74 4.101 4.089 0.012 1 1 809 . 15 1 1 A 74 74 GLY HA3 H 74 4.304 4.094 0.210 1 1 810 . 15 1 1 A 74 74 GLY CA C 74 44.896 44.257 0.639 1 1 811 . 15 1 1 A 74 74 GLY N N 74 111.138 109.824 1.314 1 1 812 . 15 1 1 A 75 75 PRO HA H 75 4.461 4.660 -0.199 1 1 819 . 15 1 1 A 75 75 PRO C C 75 176.798 177.191 -0.393 1 1 820 . 15 1 1 A 75 75 PRO CA C 75 63.466 62.351 1.115 1 1 821 . 15 1 1 A 75 75 PRO CB C 75 31.980 29.502 2.478 1 1 824 . 15 1 1 A 76 76 HIS H H 76 8.397 8.492 -0.095 1 1 825 . 15 1 1 A 76 76 HIS HA H 76 4.742 4.506 0.236 1 1 829 . 15 1 1 A 76 76 HIS C C 76 174.282 173.695 0.587 1 1 830 . 15 1 1 A 76 76 HIS CA C 76 55.579 56.114 -0.535 1 1 831 . 15 1 1 A 76 76 HIS CB C 76 30.501 28.743 1.758 1 1 832 . 15 1 1 A 76 76 HIS N N 76 118.431 120.485 -2.054 1 1 833 . 15 1 1 A 77 77 ASN H H 77 8.364 9.273 -0.909 1 1 834 . 15 1 1 A 77 77 ASN HA H 77 4.767 4.825 -0.058 1 1 839 . 15 1 1 A 77 77 ASN C C 77 174.576 174.886 -0.310 1 1 840 . 15 1 1 A 77 77 ASN CA C 77 53.139 52.168 0.971 1 1 841 . 15 1 1 A 77 77 ASN CB C 77 39.320 39.152 0.168 1 1 842 . 15 1 1 A 77 77 ASN N N 77 119.421 119.968 -0.547 1 1 844 . 15 1 1 A 78 78 GLU H H 78 8.683 8.104 0.579 1 1 845 . 15 1 1 A 78 78 GLU HA H 78 4.409 4.474 -0.065 1 1 850 . 15 1 1 A 78 78 GLU C C 78 175.791 175.087 0.704 1 1 851 . 15 1 1 A 78 78 GLU CA C 78 56.359 57.191 -0.832 1 1 852 . 15 1 1 A 78 78 GLU CB C 78 30.818 28.900 1.918 1 1 854 . 15 1 1 A 78 78 GLU N N 78 122.085 119.672 2.413 1 1 855 . 15 1 1 A 79 79 TYR H H 79 8.341 8.776 -0.435 1 1 856 . 15 1 1 A 79 79 TYR HA H 79 4.988 5.195 -0.207 1 1 861 . 15 1 1 A 79 79 TYR C C 79 175.837 175.907 -0.070 1 1 862 . 15 1 1 A 79 79 TYR CA C 79 58.028 59.624 -1.596 1 1 863 . 15 1 1 A 79 79 TYR CB C 79 41.672 38.967 2.705 1 1 866 . 15 1 1 A 79 79 TYR N N 79 119.452 123.385 -3.933 1 1 867 . 15 1 1 A 80 80 VAL H H 80 9.366 9.295 0.071 1 1 868 . 15 1 1 A 80 80 VAL HA H 80 4.370 4.969 -0.599 1 1 873 . 15 1 1 A 80 80 VAL C C 80 174.948 174.905 0.043 1 1 874 . 15 1 1 A 80 80 VAL CA C 80 61.190 60.089 1.101 1 1 875 . 15 1 1 A 80 80 VAL CB C 80 34.204 33.629 0.575 1 1 877 . 15 1 1 A 80 80 VAL N N 80 120.567 119.268 1.299 1 1 878 . 15 1 1 A 81 81 GLU H H 81 8.570 8.997 -0.427 1 1 879 . 15 1 1 A 81 81 GLU HA H 81 4.770 5.414 -0.644 1 1 883 . 15 1 1 A 81 81 GLU C C 81 175.491 175.494 -0.003 1 1 884 . 15 1 1 A 81 81 GLU CA C 81 55.655 55.102 0.553 1 1 885 . 15 1 1 A 81 81 GLU CB C 81 30.415 31.678 -1.263 1 1 887 . 15 1 1 A 81 81 GLU N N 81 124.248 123.415 0.833 1 1 888 . 15 1 1 A 82 82 VAL H H 82 9.189 8.929 0.260 1 1 889 . 15 1 1 A 82 82 VAL HA H 82 4.279 4.840 -0.561 1 1 894 . 15 1 1 A 82 82 VAL C C 82 176.087 175.864 0.223 1 1 895 . 15 1 1 A 82 82 VAL CA C 82 62.672 61.132 1.540 1 1 896 . 15 1 1 A 82 82 VAL CB C 82 33.121 33.519 -0.398 1 1 898 . 15 1 1 A 82 82 VAL N N 82 127.776 122.234 5.542 1 1 899 . 15 1 1 A 83 83 THR H H 83 8.590 8.771 -0.181 1 1 900 . 15 1 1 A 83 83 THR HA H 83 4.955 4.892 0.063 1 1 905 . 15 1 1 A 83 83 THR C C 83 174.688 173.800 0.888 1 1 906 . 15 1 1 A 83 83 THR CA C 83 61.332 61.358 -0.026 1 1 907 . 15 1 1 A 83 83 THR CB C 83 70.213 69.527 0.686 1 1 909 . 15 1 1 A 83 83 THR N N 83 114.744 116.151 -1.407 1 1 910 . 15 1 1 A 84 84 SER H H 84 7.650 7.637 0.013 1 1 911 . 15 1 1 A 84 84 SER HA H 84 4.819 4.797 0.022 1 1 914 . 15 1 1 A 84 84 SER CA C 84 56.280 57.796 -1.516 1 1 915 . 15 1 1 A 84 84 SER CB C 84 63.294 64.517 -1.223 1 1 916 . 15 1 1 A 84 84 SER N N 84 118.038 117.811 0.227 1 1 917 . 15 1 1 A 85 85 GLU H H 85 8.391 9.048 -0.657 1 1 918 . 15 1 1 A 85 85 GLU HA H 85 3.661 3.954 -0.293 1 1 923 . 15 1 1 A 85 85 GLU C C 85 177.520 178.631 -1.111 1 1 924 . 15 1 1 A 85 85 GLU CA C 85 62.429 59.766 2.663 1 1 925 . 15 1 1 A 85 85 GLU CB C 85 29.655 29.275 0.380 1 1 927 . 15 1 1 A 86 86 ALA H H 86 8.443 8.208 0.235 1 1 928 . 15 1 1 A 86 86 ALA HA H 86 4.027 4.059 -0.032 1 1 932 . 15 1 1 A 86 86 ALA C C 86 180.423 179.946 0.477 1 1 933 . 15 1 1 A 86 86 ALA CA C 86 55.145 54.951 0.194 1 1 934 . 15 1 1 A 86 86 ALA CB C 86 18.165 18.015 0.150 1 1 935 . 15 1 1 A 86 86 ALA N N 86 119.636 123.217 -3.581 1 1 936 . 15 1 1 A 87 87 ALA H H 87 7.214 7.540 -0.326 1 1 937 . 15 1 1 A 87 87 ALA HA H 87 4.244 4.069 0.175 1 1 941 . 15 1 1 A 87 87 ALA C C 87 180.354 179.633 0.721 1 1 942 . 15 1 1 A 87 87 ALA CA C 87 54.378 54.881 -0.503 1 1 943 . 15 1 1 A 87 87 ALA CB C 87 18.795 18.540 0.255 1 1 944 . 15 1 1 A 87 87 ALA N N 87 121.004 120.911 0.093 1 1 945 . 15 1 1 A 88 88 ILE H H 88 8.471 7.716 0.755 1 1 946 . 15 1 1 A 88 88 ILE HA H 88 3.360 3.656 -0.296 1 1 954 . 15 1 1 A 88 88 ILE CA C 88 66.323 65.102 1.221 1 1 955 . 15 1 1 A 88 88 ILE CB C 88 37.808 37.827 -0.019 1 1 958 . 15 1 1 A 88 88 ILE N N 88 120.743 119.828 0.915 1 1 959 . 15 1 1 A 89 89 VAL H H 89 8.343 8.322 0.021 1 1 960 . 15 1 1 A 89 89 VAL HA H 89 3.061 3.505 -0.444 1 1 968 . 15 1 1 A 89 89 VAL C C 89 176.708 178.081 -1.373 1 1 969 . 15 1 1 A 89 89 VAL CA C 89 67.833 66.542 1.291 1 1 970 . 15 1 1 A 89 89 VAL CB C 89 31.509 31.361 0.148 1 1 973 . 15 1 1 A 89 89 VAL N N 89 118.049 119.439 -1.390 1 1 974 . 15 1 1 A 90 90 ALA H H 90 7.516 7.958 -0.442 1 1 975 . 15 1 1 A 90 90 ALA HA H 90 3.987 3.924 0.063 1 1 979 . 15 1 1 A 90 90 ALA C C 90 180.744 179.791 0.953 1 1 980 . 15 1 1 A 90 90 ALA CA C 90 55.481 55.780 -0.299 1 1 981 . 15 1 1 A 90 90 ALA CB C 90 17.953 18.205 -0.252 1 1 982 . 15 1 1 A 90 90 ALA N N 90 118.935 122.125 -3.190 1 1 983 . 15 1 1 A 91 91 GLN H H 91 7.886 8.197 -0.311 1 1 984 . 15 1 1 A 91 91 GLN HA H 91 4.190 3.993 0.197 1 1 991 . 15 1 1 A 91 91 GLN C C 91 178.832 178.748 0.084 1 1 992 . 15 1 1 A 91 91 GLN CA C 91 58.519 59.094 -0.575 1 1 993 . 15 1 1 A 91 91 GLN CB C 91 28.091 28.332 -0.241 1 1 995 . 15 1 1 A 91 91 GLN N N 91 117.846 118.247 -0.401 1 1 997 . 15 1 1 A 92 92 LEU H H 92 8.751 8.657 0.094 1 1 998 . 15 1 1 A 92 92 LEU HA H 92 3.903 3.937 -0.034 1 1 1007 . 15 1 1 A 92 92 LEU C C 92 178.997 179.111 -0.114 1 1 1008 . 15 1 1 A 92 92 LEU CA C 92 58.136 57.851 0.285 1 1 1009 . 15 1 1 A 92 92 LEU CB C 92 41.576 41.501 0.075 1 1 1013 . 15 1 1 A 92 92 LEU N N 92 119.547 119.309 0.238 1 1 1014 . 15 1 1 A 93 93 PHE H H 93 8.648 8.049 0.599 1 1 1015 . 15 1 1 A 93 93 PHE HA H 93 4.270 4.186 0.084 1 1 1020 . 15 1 1 A 93 93 PHE C C 93 179.283 178.837 0.446 1 1 1021 . 15 1 1 A 93 93 PHE CA C 93 59.860 60.516 -0.656 1 1 1022 . 15 1 1 A 93 93 PHE CB C 93 37.765 38.174 -0.409 1 1 1025 . 15 1 1 A 93 93 PHE N N 93 118.041 119.239 -1.198 1 1 1026 . 15 1 1 A 94 94 GLU H H 94 7.739 8.294 -0.555 1 1 1027 . 15 1 1 A 94 94 GLU HA H 94 4.110 4.141 -0.031 1 1 1031 . 15 1 1 A 94 94 GLU C C 94 178.629 178.972 -0.343 1 1 1032 . 15 1 1 A 94 94 GLU CA C 94 59.359 59.383 -0.024 1 1 1033 . 15 1 1 A 94 94 GLU CB C 94 29.589 28.941 0.648 1 1 1035 . 15 1 1 A 94 94 GLU N N 94 119.980 117.359 2.621 1 1 1036 . 15 1 1 A 95 95 LEU H H 95 7.999 8.383 -0.384 1 1 1037 . 15 1 1 A 95 95 LEU HA H 95 4.139 4.006 0.133 1 1 1047 . 15 1 1 A 95 95 LEU C C 95 178.965 178.227 0.738 1 1 1048 . 15 1 1 A 95 95 LEU CA C 95 57.557 57.762 -0.205 1 1 1049 . 15 1 1 A 95 95 LEU CB C 95 43.443 41.486 1.957 1 1 1053 . 15 1 1 A 95 95 LEU N N 95 118.398 121.656 -3.258 1 1 1054 . 15 1 1 A 96 96 LEU H H 96 8.363 7.702 0.661 1 1 1055 . 15 1 1 A 96 96 LEU HA H 96 4.503 4.311 0.192 1 1 1061 . 15 1 1 A 96 96 LEU C C 96 177.932 177.040 0.892 1 1 1062 . 15 1 1 A 96 96 LEU CA C 96 54.700 54.817 -0.117 1 1 1063 . 15 1 1 A 96 96 LEU CB C 96 43.048 42.333 0.715 1 1 1065 . 15 1 1 A 96 96 LEU N N 96 114.720 116.309 -1.589 1 1 1066 . 15 1 1 A 97 97 GLY H H 97 7.810 7.543 0.267 1 1 1067 . 15 1 1 A 97 97 GLY HA2 H 97 3.963 3.959 0.004 1 1 1068 . 15 1 1 A 97 97 GLY C C 97 173.535 174.312 -0.777 1 1 1069 . 15 1 1 A 97 97 GLY CA C 97 45.667 45.444 0.223 1 1 1070 . 15 1 1 A 97 97 GLY N N 97 109.511 107.599 1.912 1 1 1071 . 15 1 1 A 98 98 SER H H 98 8.131 8.543 -0.412 1 1 1072 . 15 1 1 A 98 98 SER HA H 98 4.225 4.041 0.184 1 1 1075 . 15 1 1 A 98 98 SER C C 98 174.974 174.286 0.688 1 1 1076 . 15 1 1 A 98 98 SER CA C 98 57.960 59.714 -1.754 1 1 1077 . 15 1 1 A 98 98 SER CB C 98 63.997 62.430 1.567 1 1 1078 . 15 1 1 A 98 98 SER N N 98 113.405 115.354 -1.949 1 1 1079 . 15 1 1 A 99 99 GLY H H 99 8.052 8.138 -0.086 1 1 1080 . 15 1 1 A 99 99 GLY HA2 H 99 3.998 3.870 0.128 1 1 1081 . 15 1 1 A 99 99 GLY HA3 H 99 3.778 3.890 -0.112 1 1 1082 . 15 1 1 A 99 99 GLY C C 99 174.033 174.040 -0.007 1 1 1083 . 15 1 1 A 99 99 GLY CA C 99 45.123 45.530 -0.407 1 1 1084 . 15 1 1 A 99 99 GLY N N 99 111.534 108.421 3.113 1 1 1085 . 15 1 1 A 100 100 GLU H H 100 8.177 7.470 0.707 1 1 1086 . 15 1 1 A 100 100 GLU HA H 100 4.201 4.616 -0.415 1 1 1091 . 15 1 1 A 100 100 GLU C C 100 175.830 176.001 -0.171 1 1 1092 . 15 1 1 A 100 100 GLU CA C 100 56.442 55.658 0.784 1 1 1093 . 15 1 1 A 100 100 GLU CB C 100 30.428 31.260 -0.832 1 1 1095 . 15 1 1 A 100 100 GLU N N 100 120.463 119.960 0.503 1 1 1096 . 15 1 1 A 101 101 GLN H H 101 8.161 8.302 -0.141 1 1 1097 . 15 1 1 A 101 101 GLN HA H 101 4.098 4.491 -0.393 1 1 1103 . 15 1 1 A 101 101 GLN C C 101 175.412 175.192 0.220 1 1 1104 . 15 1 1 A 101 101 GLN CA C 101 55.632 55.824 -0.192 1 1 1105 . 15 1 1 A 101 101 GLN CB C 101 29.569 29.326 0.243 1 1 1107 . 15 1 1 A 101 101 GLN N N 101 120.014 121.074 -1.060 1 1 1109 . 15 1 1 A 102 102 LYS H H 102 8.235 8.561 -0.326 1 1 1110 . 15 1 1 A 102 102 LYS HA H 102 4.387 4.178 0.209 1 1 1117 . 15 1 1 A 102 102 LYS CA C 102 54.116 53.775 0.341 1 1 1118 . 15 1 1 A 102 102 LYS CB C 102 32.478 32.738 -0.260 1 1 1122 . 15 1 1 A 102 102 LYS N N 102 123.399 125.570 -2.171 1 1 1123 . 15 1 1 A 103 103 PRO HA H 103 4.498 4.467 0.031 1 1 1129 . 15 1 1 A 103 103 PRO C C 103 175.473 176.709 -1.236 1 1 1130 . 15 1 1 A 103 103 PRO CA C 103 62.802 64.023 -1.221 1 1 1131 . 15 1 1 A 103 103 PRO CB C 103 32.124 32.031 0.093 1 1 1134 . 15 1 1 A 104 104 ALA H H 104 8.017 7.814 0.203 1 1 1135 . 15 1 1 A 104 104 ALA HA H 104 4.318 3.857 0.461 1 1 1139 . 15 1 1 A 104 104 ALA C C 104 176.717 176.327 0.390 1 1 1140 . 15 1 1 A 104 104 ALA CA C 104 52.194 53.740 -1.546 1 1 1141 . 15 1 1 A 104 104 ALA CB C 104 20.113 18.056 2.057 1 1 1142 . 15 1 1 A 104 104 ALA N N 104 122.093 119.753 2.340 1 1 1143 . 15 1 1 A 105 105 GLY H H 105 7.678 7.826 -0.148 1 1 1144 . 15 1 1 A 105 105 GLY HA2 H 105 3.851 4.163 -0.312 1 1 1145 . 15 1 1 A 105 105 GLY HA3 H 105 4.053 4.179 -0.126 1 1 1146 . 15 1 1 A 105 105 GLY C C 105 172.990 174.761 -1.771 1 1 1147 . 15 1 1 A 105 105 GLY CA C 105 44.241 44.088 0.153 1 1 1148 . 15 1 1 A 105 105 GLY N N 105 105.234 105.305 -0.071 1 1 1149 . 15 1 1 A 106 106 VAL H H 106 8.409 8.903 -0.494 1 1 1150 . 15 1 1 A 106 106 VAL HA H 106 2.829 3.309 -0.480 1 1 1158 . 15 1 1 A 106 106 VAL C C 106 177.822 177.235 0.587 1 1 1159 . 15 1 1 A 106 106 VAL CA C 106 65.522 65.596 -0.074 1 1 1160 . 15 1 1 A 106 106 VAL CB C 106 30.701 31.052 -0.351 1 1 1163 . 15 1 1 A 106 106 VAL N N 106 119.215 121.862 -2.647 1 1 1164 . 15 1 1 A 107 107 ALA H H 107 8.707 8.342 0.365 1 1 1165 . 15 1 1 A 107 107 ALA HA H 107 3.730 3.755 -0.025 1 1 1169 . 15 1 1 A 107 107 ALA C C 107 179.661 179.860 -0.199 1 1 1170 . 15 1 1 A 107 107 ALA CA C 107 54.995 55.447 -0.452 1 1 1171 . 15 1 1 A 107 107 ALA CB C 107 17.705 17.857 -0.152 1 1 1172 . 15 1 1 A 107 107 ALA N N 107 118.672 121.961 -3.289 1 1 1173 . 15 1 1 A 108 108 ALA H H 108 7.388 7.658 -0.270 1 1 1174 . 15 1 1 A 108 108 ALA HA H 108 4.259 4.048 0.211 1 1 1178 . 15 1 1 A 108 108 ALA C C 108 179.318 179.487 -0.169 1 1 1179 . 15 1 1 A 108 108 ALA CA C 108 53.481 55.029 -1.548 1 1 1180 . 15 1 1 A 108 108 ALA CB C 108 19.367 18.505 0.862 1 1 1181 . 15 1 1 A 108 108 ALA N N 108 116.635 120.334 -3.699 1 1 1182 . 15 1 1 A 109 109 VAL H H 109 7.689 7.613 0.076 1 1 1183 . 15 1 1 A 109 109 VAL HA H 109 4.532 3.846 0.686 1 1 1191 . 15 1 1 A 109 109 VAL C C 109 176.055 177.942 -1.887 1 1 1192 . 15 1 1 A 109 109 VAL CA C 109 61.452 65.640 -4.188 1 1 1193 . 15 1 1 A 109 109 VAL CB C 109 32.728 31.356 1.372 1 1 1196 . 15 1 1 A 109 109 VAL N N 109 112.851 117.013 -4.162 1 1 1197 . 15 1 1 A 110 110 LEU H H 110 7.099 8.318 -1.219 1 1 1198 . 15 1 1 A 110 110 LEU HA H 110 3.723 3.787 -0.064 1 1 1208 . 15 1 1 A 110 110 LEU C C 110 179.040 178.817 0.223 1 1 1209 . 15 1 1 A 110 110 LEU CA C 110 58.825 57.885 0.940 1 1 1210 . 15 1 1 A 110 110 LEU CB C 110 41.242 41.733 -0.491 1 1 1214 . 15 1 1 A 110 110 LEU N N 110 119.829 124.942 -5.113 1 1 1215 . 15 1 1 A 111 111 GLY H H 111 8.435 7.742 0.693 1 1 1216 . 15 1 1 A 111 111 GLY HA2 H 111 3.970 3.810 0.160 1 1 1217 . 15 1 1 A 111 111 GLY HA3 H 111 3.885 3.820 0.065 1 1 1218 . 15 1 1 A 111 111 GLY C C 111 178.031 176.454 1.577 1 1 1219 . 15 1 1 A 111 111 GLY CA C 111 46.961 47.624 -0.663 1 1 1220 . 15 1 1 A 111 111 GLY N N 111 104.089 106.537 -2.448 1 1 1221 . 15 1 1 A 112 112 SER H H 112 8.343 8.109 0.234 1 1 1222 . 15 1 1 A 112 112 SER HA H 112 4.266 4.137 0.129 1 1 1224 . 15 1 1 A 112 112 SER C C 112 175.885 175.175 0.710 1 1 1225 . 15 1 1 A 112 112 SER CA C 112 61.304 62.580 -1.276 1 1 1226 . 15 1 1 A 112 112 SER CB C 112 62.901 62.956 -0.055 1 1 1227 . 15 1 1 A 112 112 SER N N 112 119.497 119.381 0.116 1 1 1228 . 15 1 1 A 113 113 LEU H H 113 7.667 7.870 -0.203 1 1 1229 . 15 1 1 A 113 113 LEU HA H 113 4.343 4.246 0.097 1 1 1238 . 15 1 1 A 113 113 LEU C C 113 174.760 176.053 -1.293 1 1 1239 . 15 1 1 A 113 113 LEU CA C 113 54.228 54.660 -0.432 1 1 1240 . 15 1 1 A 113 113 LEU CB C 113 41.467 42.178 -0.711 1 1 1244 . 15 1 1 A 113 113 LEU N N 113 118.843 117.694 1.149 1 1 1245 . 15 1 1 A 114 114 LYS H H 114 7.685 7.567 0.118 1 1 1246 . 15 1 1 A 114 114 LYS HA H 114 3.958 3.864 0.094 1 1 1250 . 15 1 1 A 114 114 LYS C C 114 177.557 175.545 2.012 1 1 1251 . 15 1 1 A 114 114 LYS CA C 114 56.935 57.428 -0.493 1 1 1252 . 15 1 1 A 114 114 LYS CB C 114 28.898 29.491 -0.593 1 1 1254 . 15 1 1 A 114 114 LYS N N 114 114.072 116.276 -2.204 1 1 1255 . 15 1 1 A 115 115 LEU H H 115 8.329 8.123 0.206 1 1 1256 . 15 1 1 A 115 115 LEU HA H 115 4.315 4.387 -0.072 1 1 1265 . 15 1 1 A 115 115 LEU C C 115 175.988 176.714 -0.726 1 1 1266 . 15 1 1 A 115 115 LEU CA C 115 54.310 54.441 -0.131 1 1 1267 . 15 1 1 A 115 115 LEU CB C 115 44.163 42.125 2.038 1 1 1270 . 15 1 1 A 115 115 LEU N N 115 117.951 120.123 -2.172 1 1 1271 . 15 1 1 A 116 116 GLN H H 116 9.100 8.457 0.643 1 1 1272 . 15 1 1 A 116 116 GLN HA H 116 4.898 4.837 0.061 1 1 1279 . 15 1 1 A 116 116 GLN CA C 116 53.467 55.273 -1.806 1 1 1280 . 15 1 1 A 116 116 GLN CB C 116 32.730 29.989 2.741 1 1 1282 . 15 1 1 A 116 116 GLN N N 116 119.994 122.898 -2.904 1 1 1284 . 15 1 1 A 117 117 GLU H H 117 8.849 8.575 0.274 1 1 1285 . 15 1 1 A 117 117 GLU HA H 117 3.707 3.910 -0.203 1 1 1290 . 15 1 1 A 117 117 GLU C C 117 177.303 176.542 0.761 1 1 1291 . 15 1 1 A 117 117 GLU CA C 117 57.233 55.386 1.847 1 1 1292 . 15 1 1 A 117 117 GLU CB C 117 29.634 28.724 0.910 1 1 1294 . 15 1 1 A 117 117 GLU N N 117 121.487 123.024 -1.537 1 1 1295 . 15 1 1 A 118 118 VAL H H 118 8.983 8.662 0.321 1 1 1296 . 15 1 1 A 118 118 VAL HA H 118 4.360 3.996 0.364 1 1 1304 . 15 1 1 A 118 118 VAL C C 118 174.171 175.300 -1.129 1 1 1305 . 15 1 1 A 118 118 VAL CA C 118 61.772 63.907 -2.135 1 1 1306 . 15 1 1 A 118 118 VAL CB C 118 34.095 32.640 1.455 1 1 1309 . 15 1 1 A 118 118 VAL N N 118 122.933 128.044 -5.111 1 1 1310 . 15 1 1 A 119 119 ALA H H 119 7.023 7.056 -0.033 1 1 1311 . 15 1 1 A 119 119 ALA HA H 119 4.378 4.381 -0.003 1 1 1315 . 15 1 1 A 119 119 ALA C C 119 175.493 174.552 0.941 1 1 1316 . 15 1 1 A 119 119 ALA CA C 119 51.956 51.054 0.902 1 1 1317 . 15 1 1 A 119 119 ALA CB C 119 23.957 21.469 2.488 1 1 1318 . 15 1 1 A 119 119 ALA N N 119 117.379 121.635 -4.256 1 1 1319 . 15 1 1 A 120 120 SER H H 120 6.999 8.534 -1.535 1 1 1320 . 15 1 1 A 120 120 SER HA H 120 5.208 5.256 -0.048 1 1 1323 . 15 1 1 A 120 120 SER C C 120 173.082 172.329 0.753 1 1 1324 . 15 1 1 A 120 120 SER CA C 120 56.754 56.350 0.404 1 1 1325 . 15 1 1 A 120 120 SER CB C 120 64.605 65.122 -0.517 1 1 1326 . 15 1 1 A 120 120 SER N N 120 113.743 116.825 -3.082 1 1 1327 . 15 1 1 A 121 121 PHE H H 121 8.244 8.990 -0.746 1 1 1328 . 15 1 1 A 121 121 PHE HA H 121 5.177 5.085 0.092 1 1 1333 . 15 1 1 A 121 121 PHE C C 121 173.569 172.226 1.343 1 1 1334 . 15 1 1 A 121 121 PHE CA C 121 55.555 55.463 0.092 1 1 1335 . 15 1 1 A 121 121 PHE CB C 121 40.959 41.462 -0.503 1 1 1338 . 15 1 1 A 121 121 PHE N N 121 120.358 121.290 -0.932 1 1 1339 . 15 1 1 A 122 122 ILE H H 122 8.907 8.617 0.290 1 1 1340 . 15 1 1 A 122 122 ILE HA H 122 4.682 4.634 0.048 1 1 1348 . 15 1 1 A 122 122 ILE C C 122 176.925 174.907 2.018 1 1 1349 . 15 1 1 A 122 122 ILE CA C 122 60.740 59.543 1.197 1 1 1350 . 15 1 1 A 122 122 ILE CB C 122 39.497 41.317 -1.820 1 1 1353 . 15 1 1 A 122 122 ILE N N 122 121.282 119.654 1.628 1 1 1354 . 15 1 1 A 123 123 THR H H 123 9.022 9.011 0.011 1 1 1355 . 15 1 1 A 123 123 THR HA H 123 5.039 4.710 0.329 1 1 1360 . 15 1 1 A 123 123 THR C C 123 173.531 173.846 -0.315 1 1 1361 . 15 1 1 A 123 123 THR CA C 123 62.266 61.832 0.434 1 1 1362 . 15 1 1 A 123 123 THR CB C 123 70.677 68.919 1.758 1 1 1364 . 15 1 1 A 123 123 THR N N 123 128.965 123.372 5.593 1 1 1365 . 15 1 1 A 124 124 THR H H 124 8.961 8.854 0.107 1 1 1366 . 15 1 1 A 124 124 THR HA H 124 5.001 4.892 0.109 1 1 1371 . 15 1 1 A 124 124 THR C C 124 173.468 173.074 0.394 1 1 1372 . 15 1 1 A 124 124 THR CA C 124 62.109 61.860 0.249 1 1 1373 . 15 1 1 A 124 124 THR CB C 124 70.450 69.430 1.020 1 1 1375 . 15 1 1 A 124 124 THR N N 124 122.176 123.678 -1.502 1 1 1376 . 15 1 1 A 125 125 ARG H H 125 9.386 9.207 0.179 1 1 1377 . 15 1 1 A 125 125 ARG HA H 125 5.764 5.570 0.194 1 1 1384 . 15 1 1 A 125 125 ARG C C 125 175.713 174.793 0.920 1 1 1385 . 15 1 1 A 125 125 ARG CA C 125 53.991 54.120 -0.129 1 1 1386 . 15 1 1 A 125 125 ARG CB C 125 33.557 33.994 -0.437 1 1 1389 . 15 1 1 A 125 125 ARG N N 125 130.004 128.535 1.469 1 1 1390 . 15 1 1 A 126 126 SER H H 126 9.172 9.300 -0.128 1 1 1391 . 15 1 1 A 126 126 SER HA H 126 5.390 5.177 0.213 1 1 1394 . 15 1 1 A 126 126 SER C C 126 172.359 173.360 -1.001 1 1 1395 . 15 1 1 A 126 126 SER CA C 126 56.934 57.449 -0.515 1 1 1396 . 15 1 1 A 126 126 SER CB C 126 65.827 66.277 -0.450 1 1 1397 . 15 1 1 A 126 126 SER N N 126 119.906 121.952 -2.046 1 1 1398 . 15 1 1 A 127 127 SER H H 127 8.591 9.283 -0.692 1 1 1399 . 15 1 1 A 127 127 SER HA H 127 5.739 5.491 0.248 1 1 1401 . 15 1 1 A 127 127 SER C C 127 173.283 173.430 -0.147 1 1 1402 . 15 1 1 A 127 127 SER CA C 127 57.354 57.813 -0.459 1 1 1403 . 15 1 1 A 127 127 SER CB C 127 65.412 64.561 0.851 1 1 1404 . 15 1 1 A 127 127 SER N N 127 117.914 121.560 -3.646 1 1 1405 . 15 1 1 A 128 128 TRP H H 128 9.866 10.082 -0.216 1 1 1406 . 15 1 1 A 128 128 TRP HA H 128 5.560 5.599 -0.039 1 1 1415 . 15 1 1 A 128 128 TRP C C 128 175.828 175.831 -0.003 1 1 1416 . 15 1 1 A 128 128 TRP CA C 128 55.852 55.958 -0.106 1 1 1417 . 15 1 1 A 128 128 TRP CB C 128 32.524 32.038 0.486 1 1 1423 . 15 1 1 A 128 128 TRP N N 128 127.978 126.124 1.854 1 1 1425 . 15 1 1 A 129 129 LYS H H 129 9.424 9.337 0.087 1 1 1426 . 15 1 1 A 129 129 LYS HA H 129 5.388 5.417 -0.029 1 1 1433 . 15 1 1 A 129 129 LYS C C 129 175.254 174.618 0.636 1 1 1434 . 15 1 1 A 129 129 LYS CA C 129 54.410 54.705 -0.295 1 1 1435 . 15 1 1 A 129 129 LYS CB C 129 35.734 35.750 -0.016 1 1 1439 . 15 1 1 A 129 129 LYS N N 129 121.784 121.002 0.782 1 1 1440 . 15 1 1 A 130 130 LEU H H 130 8.933 8.988 -0.055 1 1 1441 . 15 1 1 A 130 130 LEU HA H 130 4.859 5.009 -0.150 1 1 1447 . 15 1 1 A 130 130 LEU C C 130 173.893 174.040 -0.147 1 1 1448 . 15 1 1 A 130 130 LEU CA C 130 53.848 53.848 0.000 1 1 1449 . 15 1 1 A 130 130 LEU CB C 130 46.125 46.135 -0.010 1 1 1451 . 15 1 1 A 130 130 LEU N N 130 124.543 122.233 2.310 1 1 1452 . 15 1 1 A 131 131 ALA H H 131 8.816 8.797 0.019 1 1 1453 . 15 1 1 A 131 131 ALA HA H 131 4.776 4.847 -0.071 1 1 1457 . 15 1 1 A 131 131 ALA C C 131 176.662 176.699 -0.037 1 1 1458 . 15 1 1 A 131 131 ALA CA C 131 51.407 50.860 0.547 1 1 1459 . 15 1 1 A 131 131 ALA CB C 131 19.354 20.077 -0.723 1 1 1460 . 15 1 1 A 131 131 ALA N N 131 131.102 128.718 2.384 1 1 1461 . 15 1 1 A 132 132 LEU H H 132 8.487 8.632 -0.145 1 1 1462 . 15 1 1 A 132 132 LEU HA H 132 4.470 4.650 -0.180 1 1 1470 . 15 1 1 A 132 132 LEU C C 132 176.873 176.519 0.354 1 1 1471 . 15 1 1 A 132 132 LEU CA C 132 54.590 54.311 0.279 1 1 1472 . 15 1 1 A 132 132 LEU CB C 132 42.974 42.837 0.137 1 1 1475 . 15 1 1 A 132 132 LEU N N 132 123.724 124.732 -1.008 1 1 1476 . 15 1 1 A 133 133 SER H H 133 8.448 8.630 -0.182 1 1 1477 . 15 1 1 A 133 133 SER HA H 133 4.560 4.849 -0.289 1 1 1479 . 15 1 1 A 133 133 SER C C 133 176.043 173.269 2.774 1 1 1480 . 15 1 1 A 133 133 SER CA C 133 58.460 57.917 0.543 1 1 1481 . 15 1 1 A 133 133 SER CB C 133 63.985 63.290 0.695 1 1 1482 . 15 1 1 A 133 133 SER N N 133 115.880 117.515 -1.635 1 1 1483 . 15 1 1 A 134 134 GLY H H 134 8.232 8.890 -0.658 1 1 1484 . 15 1 1 A 134 134 GLY HA2 H 134 4.147 3.794 0.353 1 1 1485 . 15 1 1 A 134 134 GLY HA3 H 134 4.045 3.821 0.224 1 1 1486 . 15 1 1 A 134 134 GLY C C 134 174.013 174.932 -0.919 1 1 1487 . 15 1 1 A 134 134 GLY CA C 134 45.337 46.785 -1.448 1 1 1488 . 15 1 1 A 134 134 GLY N N 134 109.970 114.287 -4.317 1 1 1489 . 15 1 1 A 135 135 ALA H H 135 8.424 8.458 -0.034 1 1 1490 . 15 1 1 A 135 135 ALA HA H 135 4.436 3.891 0.545 1 1 1494 . 15 1 1 A 135 135 ALA C C 135 177.537 176.189 1.348 1 1 1495 . 15 1 1 A 135 135 ALA CA C 135 52.721 55.055 -2.334 1 1 1496 . 15 1 1 A 135 135 ALA CB C 135 19.265 17.718 1.547 1 1 1497 . 15 1 1 A 135 135 ALA N N 135 124.118 122.311 1.807 1 1 1498 . 15 1 1 A 136 136 HIS H H 136 8.466 7.662 0.804 1 1 1499 . 15 1 1 A 136 136 HIS HA H 136 4.379 5.080 -0.701 1 1 1500 . 15 1 1 A 136 136 HIS C C 136 176.259 174.050 2.209 1 1 1501 . 15 1 1 A 136 136 HIS CA C 136 56.082 54.241 1.841 1 1 1502 . 15 1 1 A 136 136 HIS CB C 136 29.619 32.259 -2.640 1 1 1503 . 15 1 1 A 136 136 HIS N N 136 119.493 110.911 8.582 1 1 1504 . 15 1 1 A 137 137 GLY H H 137 8.431 8.584 -0.153 1 1 1505 . 15 1 1 A 137 137 GLY HA2 H 137 4.151 4.084 0.067 1 1 1506 . 15 1 1 A 137 137 GLY HA3 H 137 3.893 4.085 -0.192 1 1 1507 . 15 1 1 A 137 137 GLY C C 137 174.039 173.122 0.917 1 1 1508 . 15 1 1 A 137 137 GLY CA C 137 45.372 44.694 0.678 1 1 1509 . 15 1 1 A 137 137 GLY N N 137 110.442 108.687 1.755 1 1 1510 . 15 1 1 A 138 138 GLN H H 138 8.416 8.451 -0.035 1 1 1511 . 15 1 1 A 138 138 GLN HA H 138 4.455 4.646 -0.191 1 1 1515 . 15 1 1 A 138 138 GLN C C 138 175.889 175.313 0.576 1 1 1516 . 15 1 1 A 138 138 GLN CA C 138 55.866 55.532 0.334 1 1 1517 . 15 1 1 A 138 138 GLN CB C 138 29.639 30.019 -0.380 1 1 1518 . 15 1 1 A 138 138 GLN N N 138 119.401 119.799 -0.398 1 1 1519 . 15 1 1 A 139 139 GLU H H 139 8.446 8.606 -0.160 1 1 1520 . 15 1 1 A 139 139 GLU HA H 139 4.658 4.754 -0.096 1 1 1524 . 15 1 1 A 139 139 GLU CA C 139 54.589 53.548 1.041 1 1 1525 . 15 1 1 A 139 139 GLU CB C 139 29.733 30.242 -0.509 1 1 1527 . 15 1 1 A 139 139 GLU N N 139 123.136 123.269 -0.133 1 1 1528 . 15 1 1 A 140 140 PRO HA H 140 4.537 4.549 -0.012 1 1 1533 . 15 1 1 A 140 140 PRO C C 140 176.119 175.874 0.245 1 1 1534 . 15 1 1 A 140 140 PRO CA C 140 63.220 62.788 0.432 1 1 1535 . 15 1 1 A 140 140 PRO CB C 140 31.936 32.014 -0.078 1 1 1538 . 15 1 1 A 141 141 GLN H H 141 8.506 8.589 -0.083 1 1 1539 . 15 1 1 A 141 141 GLN HA H 141 4.650 4.730 -0.080 1 1 1546 . 15 1 1 A 141 141 GLN C C 141 175.811 175.669 0.142 1 1 1547 . 15 1 1 A 141 141 GLN CA C 141 55.912 55.336 0.576 1 1 1548 . 15 1 1 A 141 141 GLN CB C 141 30.241 29.116 1.125 1 1 1550 . 15 1 1 A 141 141 GLN N N 141 120.422 121.278 -0.856 1 1 1551 . 15 1 1 A 142 142 LEU H H 142 8.842 8.728 0.114 1 1 1552 . 15 1 1 A 142 142 LEU HA H 142 5.277 5.243 0.034 1 1 1562 . 15 1 1 A 142 142 LEU C C 142 176.839 175.319 1.520 1 1 1563 . 15 1 1 A 142 142 LEU CA C 142 53.927 52.873 1.054 1 1 1564 . 15 1 1 A 142 142 LEU CB C 142 44.527 44.611 -0.084 1 1 1568 . 15 1 1 A 142 142 LEU N N 142 123.692 120.778 2.914 1 1 1569 . 15 1 1 A 143 143 THR H H 143 9.025 8.852 0.173 1 1 1570 . 15 1 1 A 143 143 THR HA H 143 5.262 5.035 0.227 1 1 1575 . 15 1 1 A 143 143 THR C C 143 173.753 174.118 -0.365 1 1 1576 . 15 1 1 A 143 143 THR CA C 143 61.795 61.956 -0.161 1 1 1577 . 15 1 1 A 143 143 THR CB C 143 70.660 70.437 0.223 1 1 1579 . 15 1 1 A 143 143 THR N N 143 117.222 115.284 1.938 1 1 1580 . 15 1 1 A 144 144 ILE H H 144 9.353 10.194 -0.841 1 1 1581 . 15 1 1 A 144 144 ILE HA H 144 5.399 5.242 0.157 1 1 1591 . 15 1 1 A 144 144 ILE C C 144 173.931 173.715 0.216 1 1 1592 . 15 1 1 A 144 144 ILE CA C 144 60.774 60.349 0.425 1 1 1593 . 15 1 1 A 144 144 ILE CB C 144 41.111 39.433 1.678 1 1 1597 . 15 1 1 A 144 144 ILE N N 144 126.383 128.340 -1.957 1 1 1598 . 15 1 1 A 145 145 ASP H H 145 9.214 9.308 -0.094 1 1 1599 . 15 1 1 A 145 145 ASP HA H 145 5.978 5.359 0.619 1 1 1601 . 15 1 1 A 145 145 ASP C C 145 175.441 174.814 0.627 1 1 1602 . 15 1 1 A 145 145 ASP CA C 145 53.035 52.956 0.079 1 1 1603 . 15 1 1 A 145 145 ASP CB C 145 44.153 43.595 0.558 1 1 1604 . 15 1 1 A 145 145 ASP N N 145 127.981 128.758 -0.777 1 1 1605 . 15 1 1 A 146 146 LEU H H 146 9.387 9.893 -0.506 1 1 1606 . 15 1 1 A 146 146 LEU HA H 146 4.918 5.393 -0.475 1 1 1616 . 15 1 1 A 146 146 LEU C C 146 175.003 174.796 0.207 1 1 1617 . 15 1 1 A 146 146 LEU CA C 146 53.940 53.717 0.223 1 1 1618 . 15 1 1 A 146 146 LEU CB C 146 43.902 43.432 0.470 1 1 1622 . 15 1 1 A 146 146 LEU N N 146 123.532 127.996 -4.464 1 1 1623 . 15 1 1 A 147 147 ASP H H 147 8.676 9.033 -0.357 1 1 1624 . 15 1 1 A 147 147 ASP HA H 147 5.205 5.341 -0.136 1 1 1627 . 15 1 1 A 147 147 ASP C C 147 174.956 174.517 0.439 1 1 1628 . 15 1 1 A 147 147 ASP CA C 147 53.441 52.583 0.858 1 1 1629 . 15 1 1 A 147 147 ASP CB C 147 43.370 44.779 -1.409 1 1 1630 . 15 1 1 A 147 147 ASP N N 147 125.499 126.454 -0.955 1 1 1631 . 15 1 1 A 148 148 SER H H 148 8.732 8.760 -0.028 1 1 1632 . 15 1 1 A 148 148 SER HA H 148 5.365 5.081 0.284 1 1 1634 . 15 1 1 A 148 148 SER C C 148 173.217 173.213 0.004 1 1 1635 . 15 1 1 A 148 148 SER CA C 148 56.334 56.678 -0.344 1 1 1636 . 15 1 1 A 148 148 SER CB C 148 65.812 66.478 -0.666 1 1 1637 . 15 1 1 A 148 148 SER N N 148 118.623 118.032 0.591 1 1 1638 . 15 1 1 A 149 149 ALA H H 149 8.937 8.902 0.035 1 1 1639 . 15 1 1 A 149 149 ALA HA H 149 5.681 4.947 0.734 1 1 1643 . 15 1 1 A 149 149 ALA C C 149 178.894 177.796 1.098 1 1 1644 . 15 1 1 A 149 149 ALA CA C 149 49.996 50.320 -0.324 1 1 1645 . 15 1 1 A 149 149 ALA CB C 149 23.231 21.594 1.637 1 1 1646 . 15 1 1 A 149 149 ALA N N 149 123.952 122.803 1.149 1 1 1647 . 15 1 1 A 150 150 ASP H H 150 9.010 8.642 0.368 1 1 1648 . 15 1 1 A 150 150 ASP HA H 150 4.336 4.174 0.162 1 1 1651 . 15 1 1 A 150 150 ASP C C 150 176.697 177.610 -0.913 1 1 1652 . 15 1 1 A 150 150 ASP CA C 150 56.543 57.385 -0.842 1 1 1653 . 15 1 1 A 150 150 ASP CB C 150 39.850 40.822 -0.972 1 1 1654 . 15 1 1 A 150 150 ASP N N 150 122.687 124.912 -2.225 1 1 1655 . 15 1 1 A 151 151 PHE H H 151 7.295 7.655 -0.360 1 1 1656 . 15 1 1 A 151 151 PHE HA H 151 5.020 4.596 0.424 1 1 1661 . 15 1 1 A 151 151 PHE C C 151 174.756 175.798 -1.042 1 1 1662 . 15 1 1 A 151 151 PHE CA C 151 56.594 58.123 -1.529 1 1 1663 . 15 1 1 A 151 151 PHE CB C 151 37.765 39.359 -1.594 1 1 1666 . 15 1 1 A 151 151 PHE N N 151 113.928 115.705 -1.777 1 1 1667 . 15 1 1 A 152 152 GLY H H 152 7.786 8.198 -0.412 1 1 1668 . 15 1 1 A 152 152 GLY HA2 H 152 4.459 4.053 0.406 1 1 1669 . 15 1 1 A 152 152 GLY HA3 H 152 3.728 4.081 -0.353 1 1 1670 . 15 1 1 A 152 152 GLY C C 152 172.709 173.377 -0.668 1 1 1671 . 15 1 1 A 152 152 GLY CA C 152 46.106 46.068 0.038 1 1 1672 . 15 1 1 A 152 152 GLY N N 152 110.312 107.553 2.759 1 1 1673 . 15 1 1 A 153 153 TYR H H 153 6.650 7.330 -0.680 1 1 1674 . 15 1 1 A 153 153 TYR HA H 153 4.508 5.067 -0.559 1 1 1679 . 15 1 1 A 153 153 TYR C C 153 173.092 173.352 -0.260 1 1 1680 . 15 1 1 A 153 153 TYR CA C 153 57.464 57.450 0.014 1 1 1681 . 15 1 1 A 153 153 TYR CB C 153 41.962 42.378 -0.416 1 1 1684 . 15 1 1 A 153 153 TYR N N 153 121.977 119.527 2.450 1 1 1685 . 15 1 1 A 154 154 ALA H H 154 7.847 8.439 -0.592 1 1 1686 . 15 1 1 A 154 154 ALA HA H 154 5.144 4.973 0.171 1 1 1690 . 15 1 1 A 154 154 ALA C C 154 174.468 174.828 -0.360 1 1 1691 . 15 1 1 A 154 154 ALA CA C 154 51.776 50.987 0.789 1 1 1692 . 15 1 1 A 154 154 ALA CB C 154 21.747 22.743 -0.996 1 1 1693 . 15 1 1 A 154 154 ALA N N 154 130.258 129.641 0.617 1 1 1694 . 15 1 1 A 155 155 VAL H H 155 8.733 8.871 -0.138 1 1 1695 . 15 1 1 A 155 155 VAL HA H 155 4.150 4.654 -0.504 1 1 1700 . 15 1 1 A 155 155 VAL C C 155 172.632 172.635 -0.003 1 1 1701 . 15 1 1 A 155 155 VAL CA C 155 61.451 59.402 2.049 1 1 1702 . 15 1 1 A 155 155 VAL CB C 155 35.883 35.948 -0.065 1 1 1704 . 15 1 1 A 155 155 VAL N N 155 119.622 118.863 0.759 1 1 1705 . 15 1 1 A 156 156 GLY H H 156 8.146 8.350 -0.204 1 1 1706 . 15 1 1 A 156 156 GLY HA2 H 156 5.125 3.042 2.083 1 1 1707 . 15 1 1 A 156 156 GLY HA3 H 156 2.061 4.026 -1.965 1 1 1708 . 15 1 1 A 156 156 GLY C C 156 171.746 171.426 0.320 1 1 1709 . 15 1 1 A 156 156 GLY CA C 156 43.319 43.795 -0.476 1 1 1710 . 15 1 1 A 156 156 GLY N N 156 113.332 113.137 0.195 1 1 1711 . 15 1 1 A 157 157 GLU H H 157 8.967 8.892 0.075 1 1 1712 . 15 1 1 A 157 157 GLU HA H 157 5.217 4.994 0.223 1 1 1716 . 15 1 1 A 157 157 GLU C C 157 174.476 175.473 -0.997 1 1 1717 . 15 1 1 A 157 157 GLU CA C 157 55.390 54.884 0.506 1 1 1718 . 15 1 1 A 157 157 GLU CB C 157 34.010 32.526 1.484 1 1 1720 . 15 1 1 A 157 157 GLU N N 157 120.823 122.927 -2.104 1 1 1721 . 15 1 1 A 158 158 VAL H H 158 9.076 9.547 -0.471 1 1 1722 . 15 1 1 A 158 158 VAL HA H 158 5.206 4.736 0.470 1 1 1727 . 15 1 1 A 158 158 VAL C C 158 173.900 174.151 -0.251 1 1 1728 . 15 1 1 A 158 158 VAL CA C 158 60.813 61.878 -1.065 1 1 1729 . 15 1 1 A 158 158 VAL CB C 158 33.385 33.040 0.345 1 1 1731 . 15 1 1 A 158 158 VAL N N 158 124.349 125.547 -1.198 1 1 1732 . 15 1 1 A 159 159 GLU H H 159 9.239 9.537 -0.298 1 1 1733 . 15 1 1 A 159 159 GLU HA H 159 5.647 5.155 0.492 1 1 1738 . 15 1 1 A 159 159 GLU C C 159 174.469 175.256 -0.787 1 1 1739 . 15 1 1 A 159 159 GLU CA C 159 54.473 54.700 -0.227 1 1 1740 . 15 1 1 A 159 159 GLU CB C 159 33.852 32.697 1.155 1 1 1742 . 15 1 1 A 159 159 GLU N N 159 125.772 129.408 -3.636 1 1 1743 . 15 1 1 A 160 160 ALA H H 160 9.250 9.074 0.176 1 1 1744 . 15 1 1 A 160 160 ALA HA H 160 4.966 5.353 -0.387 1 1 1748 . 15 1 1 A 160 160 ALA C C 160 175.114 175.662 -0.548 1 1 1749 . 15 1 1 A 160 160 ALA CA C 160 50.644 50.270 0.374 1 1 1750 . 15 1 1 A 160 160 ALA CB C 160 23.263 23.065 0.198 1 1 1751 . 15 1 1 A 160 160 ALA N N 160 125.092 129.290 -4.198 1 1 1752 . 15 1 1 A 161 161 MET H H 161 8.559 8.873 -0.314 1 1 1753 . 15 1 1 A 161 161 MET HA H 161 5.468 5.926 -0.458 1 1 1761 . 15 1 1 A 161 161 MET C C 161 176.265 174.901 1.364 1 1 1762 . 15 1 1 A 161 161 MET CA C 161 53.818 54.327 -0.509 1 1 1763 . 15 1 1 A 161 161 MET CB C 161 34.380 35.627 -1.247 1 1 1766 . 15 1 1 A 161 161 MET N N 161 118.699 119.584 -0.885 1 1 1767 . 15 1 1 A 162 162 VAL H H 162 9.046 9.014 0.032 1 1 1768 . 15 1 1 A 162 162 VAL HA H 162 4.841 4.853 -0.012 1 1 1776 . 15 1 1 A 162 162 VAL C C 162 174.794 175.889 -1.095 1 1 1777 . 15 1 1 A 162 162 VAL CA C 162 59.107 59.766 -0.659 1 1 1778 . 15 1 1 A 162 162 VAL CB C 162 34.018 34.309 -0.291 1 1 1781 . 15 1 1 A 162 162 VAL N N 162 116.435 118.621 -2.186 1 1 1782 . 15 1 1 A 163 163 HIS H H 163 8.793 8.655 0.138 1 1 1783 . 15 1 1 A 163 163 HIS HA H 163 4.717 5.110 -0.393 1 1 1787 . 15 1 1 A 163 163 HIS C C 163 175.460 174.589 0.871 1 1 1788 . 15 1 1 A 163 163 HIS CA C 163 58.488 57.603 0.885 1 1 1789 . 15 1 1 A 163 163 HIS CB C 163 31.185 30.858 0.327 1 1 1791 . 15 1 1 A 163 163 HIS N N 163 117.838 121.348 -3.510 1 1 1792 . 15 1 1 A 164 164 GLU H H 164 8.013 7.789 0.224 1 1 1793 . 15 1 1 A 164 164 GLU HA H 164 4.814 4.730 0.084 1 1 1797 . 15 1 1 A 164 164 GLU C C 164 176.910 176.462 0.448 1 1 1798 . 15 1 1 A 164 164 GLU CA C 164 54.355 54.812 -0.457 1 1 1799 . 15 1 1 A 164 164 GLU CB C 164 32.886 32.482 0.404 1 1 1801 . 15 1 1 A 164 164 GLU N N 164 115.943 116.937 -0.994 1 1 1802 . 15 1 1 A 165 165 LYS H H 165 9.088 8.938 0.150 1 1 1803 . 15 1 1 A 165 165 LYS HA H 165 3.942 4.013 -0.071 1 1 1809 . 15 1 1 A 165 165 LYS C C 165 179.657 178.041 1.616 1 1 1810 . 15 1 1 A 165 165 LYS CA C 165 59.888 58.274 1.614 1 1 1811 . 15 1 1 A 165 165 LYS CB C 165 32.024 32.570 -0.546 1 1 1814 . 15 1 1 A 165 165 LYS N N 165 124.120 124.922 -0.802 1 1 1815 . 15 1 1 A 166 166 ALA H H 166 8.851 7.802 1.049 1 1 1816 . 15 1 1 A 166 166 ALA HA H 166 4.251 4.104 0.147 1 1 1820 . 15 1 1 A 166 166 ALA C C 166 178.920 178.446 0.474 1 1 1821 . 15 1 1 A 166 166 ALA CA C 166 54.318 54.322 -0.004 1 1 1822 . 15 1 1 A 166 166 ALA CB C 166 18.810 18.153 0.657 1 1 1823 . 15 1 1 A 166 166 ALA N N 166 120.424 122.454 -2.030 1 1 1824 . 15 1 1 A 167 167 GLU H H 167 7.871 8.278 -0.407 1 1 1825 . 15 1 1 A 167 167 GLU HA H 167 4.404 4.319 0.085 1 1 1829 . 15 1 1 A 167 167 GLU C C 167 177.368 178.064 -0.696 1 1 1830 . 15 1 1 A 167 167 GLU CA C 167 56.701 56.658 0.043 1 1 1831 . 15 1 1 A 167 167 GLU CB C 167 31.208 29.999 1.209 1 1 1833 . 15 1 1 A 167 167 GLU N N 167 114.926 115.237 -0.311 1 1 1834 . 15 1 1 A 168 168 VAL H H 168 7.812 7.440 0.372 1 1 1835 . 15 1 1 A 168 168 VAL HA H 168 3.712 3.641 0.071 1 1 1843 . 15 1 1 A 168 168 VAL CA C 168 68.705 67.949 0.756 1 1 1844 . 15 1 1 A 168 168 VAL CB C 168 29.597 29.888 -0.291 1 1 1847 . 15 1 1 A 168 168 VAL N N 168 120.188 121.749 -1.561 1 1 1848 . 15 1 1 A 169 169 PRO HA H 169 4.252 4.227 0.025 1 1 1851 . 15 1 1 A 169 169 PRO C C 169 179.563 178.698 0.865 1 1 1852 . 15 1 1 A 169 169 PRO CA C 169 67.077 66.858 0.219 1 1 1853 . 15 1 1 A 170 170 ALA H H 170 8.149 8.138 0.011 1 1 1854 . 15 1 1 A 170 170 ALA HA H 170 4.265 4.057 0.208 1 1 1858 . 15 1 1 A 170 170 ALA C C 170 180.637 179.774 0.863 1 1 1859 . 15 1 1 A 170 170 ALA CA C 170 54.823 55.255 -0.432 1 1 1860 . 15 1 1 A 170 170 ALA CB C 170 18.518 18.224 0.294 1 1 1861 . 15 1 1 A 170 170 ALA N N 170 119.210 119.293 -0.083 1 1 1862 . 15 1 1 A 171 171 ALA H H 171 7.767 8.222 -0.455 1 1 1863 . 15 1 1 A 171 171 ALA HA H 171 4.106 4.125 -0.019 1 1 1867 . 15 1 1 A 171 171 ALA C C 171 179.371 180.027 -0.656 1 1 1868 . 15 1 1 A 171 171 ALA CA C 171 55.130 54.949 0.181 1 1 1869 . 15 1 1 A 171 171 ALA CB C 171 18.291 18.128 0.163 1 1 1870 . 15 1 1 A 171 171 ALA N N 171 122.126 120.727 1.399 1 1 1871 . 15 1 1 A 172 172 LEU H H 172 8.950 8.262 0.688 1 1 1872 . 15 1 1 A 172 172 LEU HA H 172 3.987 4.101 -0.114 1 1 1878 . 15 1 1 A 172 172 LEU C C 172 178.355 178.557 -0.202 1 1 1879 . 15 1 1 A 172 172 LEU CA C 172 57.803 58.146 -0.343 1 1 1880 . 15 1 1 A 172 172 LEU CB C 172 41.667 41.502 0.165 1 1 1882 . 15 1 1 A 172 172 LEU N N 172 118.682 120.020 -1.338 1 1 1883 . 15 1 1 A 173 173 GLU H H 173 7.886 7.760 0.126 1 1 1884 . 15 1 1 A 173 173 GLU HA H 173 4.132 3.962 0.170 1 1 1887 . 15 1 1 A 173 173 GLU C C 173 179.556 179.566 -0.010 1 1 1888 . 15 1 1 A 173 173 GLU CA C 173 59.800 59.542 0.258 1 1 1889 . 15 1 1 A 173 173 GLU CB C 173 29.580 29.098 0.482 1 1 1891 . 15 1 1 A 173 173 GLU N N 173 117.561 118.337 -0.776 1 1 1892 . 15 1 1 A 174 174 LYS H H 174 7.532 7.764 -0.232 1 1 1893 . 15 1 1 A 174 174 LYS HA H 174 4.131 4.092 0.039 1 1 1901 . 15 1 1 A 174 174 LYS CA C 174 58.999 58.956 0.043 1 1 1902 . 15 1 1 A 174 174 LYS CB C 174 32.041 32.285 -0.244 1 1 1906 . 15 1 1 A 174 174 LYS N N 174 119.085 121.285 -2.200 1 1 1907 . 15 1 1 A 175 175 ILE H H 175 8.479 8.236 0.243 1 1 1908 . 15 1 1 A 175 175 ILE HA H 175 3.583 3.609 -0.026 1 1 1918 . 15 1 1 A 175 175 ILE C C 175 179.258 178.473 0.785 1 1 1919 . 15 1 1 A 175 175 ILE CA C 175 65.769 65.644 0.125 1 1 1920 . 15 1 1 A 175 175 ILE CB C 175 37.876 38.001 -0.125 1 1 1923 . 15 1 1 A 175 175 ILE N N 175 118.828 119.536 -0.708 1 1 1924 . 15 1 1 A 176 176 ILE H H 176 8.928 8.020 0.908 1 1 1925 . 15 1 1 A 176 176 ILE HA H 176 3.600 3.646 -0.046 1 1 1935 . 15 1 1 A 176 176 ILE C C 176 178.827 178.555 0.272 1 1 1936 . 15 1 1 A 176 176 ILE CA C 176 65.640 64.620 1.020 1 1 1937 . 15 1 1 A 176 176 ILE CB C 176 37.451 36.961 0.490 1 1 1941 . 15 1 1 A 176 176 ILE N N 176 124.527 119.748 4.779 1 1 1942 . 15 1 1 A 177 177 THR H H 177 8.175 8.334 -0.159 1 1 1943 . 15 1 1 A 177 177 THR HA H 177 3.885 3.941 -0.056 1 1 1948 . 15 1 1 A 177 177 THR C C 177 176.867 176.421 0.446 1 1 1949 . 15 1 1 A 177 177 THR CA C 177 67.199 66.512 0.687 1 1 1950 . 15 1 1 A 177 177 THR CB C 177 68.377 68.420 -0.043 1 1 1952 . 15 1 1 A 177 177 THR N N 177 119.412 118.691 0.721 1 1 1953 . 15 1 1 A 178 178 VAL H H 178 8.352 8.047 0.305 1 1 1954 . 15 1 1 A 178 178 VAL HA H 178 3.572 3.427 0.145 1 1 1962 . 15 1 1 A 178 178 VAL C C 178 177.664 178.062 -0.398 1 1 1963 . 15 1 1 A 178 178 VAL CA C 178 66.909 66.290 0.619 1 1 1964 . 15 1 1 A 178 178 VAL CB C 178 31.714 31.342 0.372 1 1 1967 . 15 1 1 A 178 178 VAL N N 178 121.168 121.846 -0.678 1 1 1968 . 15 1 1 A 179 179 SER H H 179 8.529 8.267 0.262 1 1 1969 . 15 1 1 A 179 179 SER HA H 179 3.099 3.342 -0.243 1 1 1972 . 15 1 1 A 179 179 SER C C 179 175.380 175.938 -0.558 1 1 1973 . 15 1 1 A 179 179 SER CA C 179 62.728 61.683 1.045 1 1 1974 . 15 1 1 A 179 179 SER CB C 179 62.802 62.563 0.239 1 1 1975 . 15 1 1 A 179 179 SER N N 179 115.226 115.722 -0.496 1 1 1976 . 15 1 1 A 180 180 SER H H 180 7.757 8.031 -0.274 1 1 1977 . 15 1 1 A 180 180 SER HA H 180 4.419 4.295 0.124 1 1 1980 . 15 1 1 A 180 180 SER C C 180 175.359 176.884 -1.525 1 1 1981 . 15 1 1 A 180 180 SER CA C 180 61.025 61.466 -0.441 1 1 1982 . 15 1 1 A 180 180 SER CB C 180 63.072 63.087 -0.015 1 1 1983 . 15 1 1 A 180 180 SER N N 180 114.718 116.220 -1.502 1 1 1984 . 15 1 1 A 181 181 MET H H 181 7.497 7.759 -0.262 1 1 1985 . 15 1 1 A 181 181 MET HA H 181 4.283 4.223 0.060 1 1 1993 . 15 1 1 A 181 181 MET C C 181 177.217 177.233 -0.016 1 1 1994 . 15 1 1 A 181 181 MET CA C 181 57.539 57.868 -0.329 1 1 1995 . 15 1 1 A 181 181 MET CB C 181 33.493 32.594 0.899 1 1 1998 . 15 1 1 A 181 181 MET N N 181 119.274 120.626 -1.352 1 1 1999 . 15 1 1 A 182 182 LEU H H 182 7.163 7.567 -0.404 1 1 2000 . 15 1 1 A 182 182 LEU HA H 182 4.133 4.386 -0.253 1 1 2010 . 15 1 1 A 182 182 LEU C C 182 176.289 176.592 -0.303 1 1 2011 . 15 1 1 A 182 182 LEU CA C 182 54.750 54.685 0.065 1 1 2012 . 15 1 1 A 182 182 LEU CB C 182 43.235 42.369 0.866 1 1 2016 . 15 1 1 A 182 182 LEU N N 182 115.869 117.299 -1.430 1 1 2017 . 15 1 1 A 183 183 GLY H H 183 7.492 7.548 -0.056 1 1 2018 . 15 1 1 A 183 183 GLY HA2 H 183 4.086 4.191 -0.105 1 1 2019 . 15 1 1 A 183 183 GLY HA3 H 183 4.425 4.254 0.171 1 1 2020 . 15 1 1 A 183 183 GLY C C 183 171.830 171.515 0.315 1 1 2021 . 15 1 1 A 183 183 GLY CA C 183 46.035 45.779 0.256 1 1 2022 . 15 1 1 A 183 183 GLY N N 183 107.761 106.559 1.202 1 1 2023 . 15 1 1 A 184 184 VAL H H 184 8.099 8.639 -0.540 1 1 2024 . 15 1 1 A 184 184 VAL HA H 184 4.772 4.891 -0.119 1 1 2032 . 15 1 1 A 184 184 VAL CA C 184 59.305 58.258 1.047 1 1 2033 . 15 1 1 A 184 184 VAL CB C 184 33.648 35.686 -2.038 1 1 2036 . 15 1 1 A 184 184 VAL N N 184 119.803 121.358 -1.555 1 1 2037 . 15 1 1 A 185 185 PRO HA H 185 4.442 4.679 -0.237 1 1 2042 . 15 1 1 A 185 185 PRO C C 185 175.871 176.136 -0.265 1 1 2043 . 15 1 1 A 185 185 PRO CA C 185 63.886 62.704 1.182 1 1 2044 . 15 1 1 A 185 185 PRO CB C 185 32.260 32.455 -0.195 1 1 2047 . 15 1 1 A 186 186 ALA H H 186 8.222 9.052 -0.830 1 1 2048 . 15 1 1 A 186 186 ALA HA H 186 4.569 4.914 -0.345 1 1 2052 . 15 1 1 A 186 186 ALA C C 186 177.481 176.209 1.272 1 1 2053 . 15 1 1 A 186 186 ALA CA C 186 51.823 50.704 1.119 1 1 2054 . 15 1 1 A 186 186 ALA CB C 186 20.233 21.860 -1.627 1 1 2055 . 15 1 1 A 186 186 ALA N N 186 125.663 122.799 2.864 1 1 2056 . 15 1 1 A 187 187 GLN H H 187 8.723 8.683 0.040 1 1 2057 . 15 1 1 A 187 187 GLN HA H 187 4.420 4.688 -0.268 1 1 2063 . 15 1 1 A 187 187 GLN C C 187 175.566 175.855 -0.289 1 1 2064 . 15 1 1 A 187 187 GLN CA C 187 56.051 55.927 0.124 1 1 2065 . 15 1 1 A 187 187 GLN CB C 187 29.812 30.988 -1.176 1 1 2067 . 15 1 1 A 187 187 GLN N N 187 120.742 116.364 4.378 1 1 2069 . 15 1 1 A 188 188 GLU H H 188 8.163 7.493 0.670 1 1 2070 . 15 1 1 A 188 188 GLU HA H 188 4.405 4.379 0.026 1 1 2074 . 15 1 1 A 188 188 GLU C C 188 176.058 176.938 -0.880 1 1 2075 . 15 1 1 A 188 188 GLU CA C 188 56.158 55.987 0.171 1 1 2076 . 15 1 1 A 188 188 GLU CB C 188 31.095 30.363 0.732 1 1 2078 . 15 1 1 A 188 188 GLU N N 188 119.177 120.932 -1.755 1 1 2079 . 15 1 1 A 189 189 GLU H H 189 8.567 8.965 -0.398 1 1 2080 . 15 1 1 A 189 189 GLU HA H 189 4.252 4.263 -0.011 1 1 2084 . 15 1 1 A 189 189 GLU C C 189 175.703 175.653 0.050 1 1 2085 . 15 1 1 A 189 189 GLU CA C 189 56.417 56.378 0.039 1 1 2086 . 15 1 1 A 189 189 GLU CB C 189 29.968 29.666 0.302 1 1 2088 . 15 1 1 A 189 189 GLU N N 189 120.920 119.752 1.168 1 1 2089 . 15 1 1 A 190 190 ALA H H 190 8.271 7.924 0.347 1 1 2090 . 15 1 1 A 190 190 ALA HA H 190 4.626 4.178 0.448 1 1 2094 . 15 1 1 A 190 190 ALA CA C 190 50.465 52.818 -2.353 1 1 2095 . 15 1 1 A 190 190 ALA CB C 190 18.451 18.060 0.391 1 1 2096 . 15 1 1 A 190 190 ALA N N 190 128.323 120.972 7.351 1 1 2097 . 15 1 1 A 191 191 PRO HA H 191 4.493 4.470 0.023 1 1 2103 . 15 1 1 A 191 191 PRO C C 191 175.899 176.387 -0.488 1 1 2104 . 15 1 1 A 191 191 PRO CA C 191 62.044 62.344 -0.300 1 1 2105 . 15 1 1 A 191 191 PRO CB C 191 32.184 31.848 0.336 1 1 2108 . 15 1 1 A 192 192 ALA H H 192 8.610 8.106 0.504 1 1 2109 . 15 1 1 A 192 192 ALA HA H 192 4.280 4.419 -0.139 1 1 2113 . 15 1 1 A 192 192 ALA C C 192 178.282 178.393 -0.111 1 1 2114 . 15 1 1 A 192 192 ALA CA C 192 51.698 51.469 0.229 1 1 2115 . 15 1 1 A 192 192 ALA CB C 192 19.220 20.060 -0.840 1 1 2116 . 15 1 1 A 192 192 ALA N N 192 123.420 124.803 -1.383 1 1 2117 . 15 1 1 A 193 193 LYS H H 193 8.531 8.861 -0.330 1 1 2118 . 15 1 1 A 193 193 LYS HA H 193 3.294 3.709 -0.415 1 1 2126 . 15 1 1 A 193 193 LYS C C 193 177.640 178.696 -1.056 1 1 2127 . 15 1 1 A 193 193 LYS CA C 193 60.644 59.265 1.379 1 1 2128 . 15 1 1 A 193 193 LYS CB C 193 32.607 31.728 0.879 1 1 2132 . 15 1 1 A 193 193 LYS N N 193 122.851 119.604 3.247 1 1 2133 . 15 1 1 A 194 194 LEU H H 194 8.570 7.911 0.659 1 1 2134 . 15 1 1 A 194 194 LEU HA H 194 3.845 4.469 -0.624 1 1 2144 . 15 1 1 A 194 194 LEU C C 194 177.965 179.062 -1.097 1 1 2145 . 15 1 1 A 194 194 LEU CA C 194 57.611 57.537 0.074 1 1 2146 . 15 1 1 A 194 194 LEU CB C 194 41.776 40.746 1.030 1 1 2150 . 15 1 1 A 194 194 LEU N N 194 115.801 121.576 -5.775 1 1 2151 . 15 1 1 A 195 195 MET H H 195 6.782 7.850 -1.068 1 1 2152 . 15 1 1 A 195 195 MET HA H 195 4.487 4.262 0.225 1 1 2160 . 15 1 1 A 195 195 MET C C 195 178.280 178.736 -0.456 1 1 2161 . 15 1 1 A 195 195 MET CA C 195 56.858 58.223 -1.365 1 1 2162 . 15 1 1 A 195 195 MET CB C 195 31.557 31.191 0.366 1 1 2165 . 15 1 1 A 195 195 MET N N 195 113.898 117.580 -3.682 1 1 2166 . 15 1 1 A 196 196 VAL H H 196 7.713 7.543 0.170 1 1 2167 . 15 1 1 A 196 196 VAL HA H 196 3.501 3.277 0.224 1 1 2175 . 15 1 1 A 196 196 VAL C C 196 177.624 177.699 -0.075 1 1 2176 . 15 1 1 A 196 196 VAL CA C 196 66.318 66.117 0.201 1 1 2177 . 15 1 1 A 196 196 VAL CB C 196 31.380 31.245 0.135 1 1 2180 . 15 1 1 A 196 196 VAL N N 196 120.413 119.730 0.683 1 1 2181 . 15 1 1 A 197 197 TYR H H 197 7.972 8.121 -0.149 1 1 2182 . 15 1 1 A 197 197 TYR HA H 197 3.145 4.370 -1.225 1 1 2187 . 15 1 1 A 197 197 TYR C C 197 177.726 177.036 0.690 1 1 2188 . 15 1 1 A 197 197 TYR CA C 197 62.253 62.054 0.199 1 1 2189 . 15 1 1 A 197 197 TYR CB C 197 37.314 39.000 -1.686 1 1 2192 . 15 1 1 A 197 197 TYR N N 197 119.543 121.222 -1.679 1 1 2193 . 15 1 1 A 198 198 LEU H H 198 8.630 8.045 0.585 1 1 2194 . 15 1 1 A 198 198 LEU HA H 198 3.923 3.742 0.181 1 1 2203 . 15 1 1 A 198 198 LEU C C 198 178.074 178.790 -0.716 1 1 2204 . 15 1 1 A 198 198 LEU CA C 198 58.294 57.944 0.350 1 1 2205 . 15 1 1 A 198 198 LEU CB C 198 42.177 41.556 0.621 1 1 2209 . 15 1 1 A 198 198 LEU N N 198 118.430 119.822 -1.392 1 1 2210 . 15 1 1 A 199 199 GLN H H 199 8.082 8.347 -0.265 1 1 2211 . 15 1 1 A 199 199 GLN HA H 199 3.054 3.620 -0.566 1 1 2216 . 15 1 1 A 199 199 GLN C C 199 176.875 177.933 -1.058 1 1 2217 . 15 1 1 A 199 199 GLN CA C 199 59.739 59.000 0.739 1 1 2218 . 15 1 1 A 199 199 GLN CB C 199 28.055 27.715 0.340 1 1 2220 . 15 1 1 A 199 199 GLN N N 199 117.926 116.714 1.212 1 1 2222 . 15 1 1 A 200 200 ARG H H 200 7.349 8.106 -0.757 1 1 2223 . 15 1 1 A 200 200 ARG HA H 200 3.798 3.834 -0.036 1 1 2231 . 15 1 1 A 200 200 ARG C C 200 178.037 177.989 0.048 1 1 2232 . 15 1 1 A 200 200 ARG CA C 200 58.260 58.663 -0.403 1 1 2233 . 15 1 1 A 200 200 ARG CB C 200 30.706 30.139 0.567 1 1 2236 . 15 1 1 A 200 200 ARG N N 200 113.772 119.488 -5.716 1 1 2238 . 15 1 1 A 201 201 PHE H H 201 8.329 7.753 0.576 1 1 2239 . 15 1 1 A 201 201 PHE HA H 201 4.630 4.450 0.180 1 1 2244 . 15 1 1 A 201 201 PHE C C 201 176.606 176.087 0.519 1 1 2245 . 15 1 1 A 201 201 PHE CA C 201 59.014 58.615 0.399 1 1 2246 . 15 1 1 A 201 201 PHE CB C 201 40.357 40.692 -0.335 1 1 2249 . 15 1 1 A 201 201 PHE N N 201 114.182 116.317 -2.135 1 1 2250 . 15 1 1 A 202 202 ARG H H 202 8.719 8.304 0.415 1 1 2251 . 15 1 1 A 202 202 ARG HA H 202 5.071 4.841 0.230 1 1 2261 . 15 1 1 A 202 202 ARG CA C 202 53.956 53.760 0.196 1 1 2262 . 15 1 1 A 202 202 ARG CB C 202 31.979 30.894 1.085 1 1 2264 . 15 1 1 A 202 202 ARG N N 202 120.115 118.029 2.086 1 1 2266 . 15 1 1 A 203 203 PRO HA H 203 4.348 4.511 -0.163 1 1 2271 . 15 1 1 A 203 203 PRO C C 203 179.736 178.914 0.822 1 1 2272 . 15 1 1 A 203 203 PRO CA C 203 65.674 65.706 -0.032 1 1 2273 . 15 1 1 A 203 203 PRO CB C 203 31.717 32.042 -0.325 1 1 2275 . 15 1 1 A 204 204 LEU H H 204 8.875 7.561 1.314 1 1 2276 . 15 1 1 A 204 204 LEU HA H 204 4.291 4.005 0.286 1 1 2286 . 15 1 1 A 204 204 LEU C C 204 180.353 178.677 1.676 1 1 2287 . 15 1 1 A 204 204 LEU CA C 204 58.012 57.521 0.491 1 1 2288 . 15 1 1 A 204 204 LEU CB C 204 40.893 41.144 -0.251 1 1 2292 . 15 1 1 A 204 204 LEU N N 204 118.940 116.490 2.450 1 1 2293 . 15 1 1 A 205 205 ASP H H 205 7.541 8.321 -0.780 1 1 2294 . 15 1 1 A 205 205 ASP HA H 205 4.622 4.314 0.308 1 1 2297 . 15 1 1 A 205 205 ASP C C 205 177.602 178.208 -0.606 1 1 2298 . 15 1 1 A 205 205 ASP CA C 205 57.437 57.373 0.064 1 1 2299 . 15 1 1 A 205 205 ASP CB C 205 41.143 39.824 1.319 1 1 2300 . 15 1 1 A 205 205 ASP N N 205 120.838 120.765 0.073 1 1 2301 . 15 1 1 A 206 206 TYR H H 206 8.237 8.680 -0.443 1 1 2302 . 15 1 1 A 206 206 TYR HA H 206 4.018 4.142 -0.124 1 1 2307 . 15 1 1 A 206 206 TYR C C 206 176.433 177.831 -1.398 1 1 2308 . 15 1 1 A 206 206 TYR CA C 206 62.148 61.491 0.657 1 1 2309 . 15 1 1 A 206 206 TYR CB C 206 38.305 38.602 -0.297 1 1 2312 . 15 1 1 A 206 206 TYR N N 206 119.475 122.660 -3.185 1 1 2313 . 15 1 1 A 207 207 GLN H H 207 8.124 8.345 -0.221 1 1 2314 . 15 1 1 A 207 207 GLN HA H 207 3.823 3.217 0.606 1 1 2320 . 15 1 1 A 207 207 GLN C C 207 178.019 178.623 -0.604 1 1 2321 . 15 1 1 A 207 207 GLN CA C 207 58.841 59.080 -0.239 1 1 2322 . 15 1 1 A 207 207 GLN CB C 207 28.208 28.614 -0.406 1 1 2324 . 15 1 1 A 207 207 GLN N N 207 115.863 118.194 -2.331 1 1 2326 . 15 1 1 A 208 208 ARG H H 208 7.522 8.271 -0.749 1 1 2327 . 15 1 1 A 208 208 ARG HA H 208 4.127 4.061 0.066 1 1 2334 . 15 1 1 A 208 208 ARG C C 208 179.278 178.556 0.722 1 1 2335 . 15 1 1 A 208 208 ARG CA C 208 59.419 59.002 0.417 1 1 2336 . 15 1 1 A 208 208 ARG CB C 208 30.182 29.778 0.404 1 1 2338 . 15 1 1 A 208 208 ARG N N 208 118.471 119.896 -1.425 1 1 2340 . 15 1 1 A 209 209 LEU H H 209 7.869 7.777 0.092 1 1 2341 . 15 1 1 A 209 209 LEU HA H 209 4.091 4.096 -0.005 1 1 2351 . 15 1 1 A 209 209 LEU C C 209 179.715 179.059 0.656 1 1 2352 . 15 1 1 A 209 209 LEU CA C 209 57.891 57.921 -0.030 1 1 2353 . 15 1 1 A 209 209 LEU CB C 209 41.338 41.841 -0.503 1 1 2356 . 15 1 1 A 209 209 LEU N N 209 119.659 120.093 -0.434 1 1 2357 . 15 1 1 A 210 210 LEU H H 210 8.034 8.620 -0.586 1 1 2358 . 15 1 1 A 210 210 LEU HA H 210 3.977 4.017 -0.040 1 1 2367 . 15 1 1 A 210 210 LEU C C 210 180.363 178.485 1.878 1 1 2368 . 15 1 1 A 210 210 LEU CA C 210 57.459 58.486 -1.027 1 1 2369 . 15 1 1 A 210 210 LEU CB C 210 41.699 41.462 0.237 1 1 2373 . 15 1 1 A 210 210 LEU N N 210 120.967 119.810 1.157 1 1 2374 . 15 1 1 A 211 211 GLU H H 211 8.174 8.574 -0.400 1 1 2375 . 15 1 1 A 211 211 GLU HA H 211 4.075 4.056 0.019 1 1 2379 . 15 1 1 A 211 211 GLU C C 211 178.499 179.236 -0.737 1 1 2380 . 15 1 1 A 211 211 GLU CA C 211 58.575 59.248 -0.673 1 1 2381 . 15 1 1 A 211 211 GLU CB C 211 29.583 28.647 0.936 1 1 2383 . 15 1 1 A 211 211 GLU N N 211 119.217 117.818 1.399 1 1 2384 . 15 1 1 A 212 212 ALA H H 212 7.723 7.955 -0.232 1 1 2385 . 15 1 1 A 212 212 ALA HA H 212 4.291 4.154 0.137 1 1 2389 . 15 1 1 A 212 212 ALA C C 212 178.770 179.544 -0.774 1 1 2390 . 15 1 1 A 212 212 ALA CA C 212 53.966 54.823 -0.857 1 1 2391 . 15 1 1 A 212 212 ALA CB C 212 19.117 18.139 0.978 1 1 2392 . 15 1 1 A 212 212 ALA N N 212 121.798 123.019 -1.221 1 1 2393 . 15 1 1 A 213 213 ALA H H 213 7.743 7.283 0.460 1 1 2394 . 15 1 1 A 213 213 ALA HA H 213 4.406 4.280 0.126 1 1 2398 . 15 1 1 A 213 213 ALA C C 213 178.413 178.376 0.037 1 1 2399 . 15 1 1 A 213 213 ALA CA C 213 53.129 54.623 -1.494 1 1 2400 . 15 1 1 A 213 213 ALA CB C 213 18.926 19.821 -0.895 1 1 2401 . 15 1 1 A 213 213 ALA N N 213 120.435 120.740 -0.305 1 1 2402 . 15 1 1 A 214 214 SER H H 214 7.944 8.990 -1.046 1 1 2403 . 15 1 1 A 214 214 SER HA H 214 4.559 4.295 0.264 1 1 2406 . 15 1 1 A 214 214 SER C C 214 174.958 174.104 0.854 1 1 2407 . 15 1 1 A 214 214 SER CA C 214 58.640 60.110 -1.470 1 1 2408 . 15 1 1 A 214 214 SER CB C 214 63.928 63.179 0.749 1 1 2409 . 15 1 1 A 214 214 SER N N 214 113.729 113.789 -0.060 1 1 2410 . 15 1 1 A 215 215 SER H H 215 8.255 8.325 -0.070 1 1 2411 . 15 1 1 A 215 215 SER HA H 215 4.547 4.339 0.208 1 1 2413 . 15 1 1 A 215 215 SER C C 215 175.289 174.395 0.894 1 1 2414 . 15 1 1 A 215 215 SER CA C 215 58.833 59.984 -1.151 1 1 2415 . 15 1 1 A 215 215 SER CB C 215 63.847 62.884 0.963 1 1 2416 . 15 1 1 A 215 215 SER N N 215 117.674 115.614 2.060 1 1 2417 . 15 1 1 A 216 216 GLY H H 216 8.431 8.999 -0.568 1 1 2418 . 15 1 1 A 216 216 GLY HA2 H 216 4.054 3.934 0.120 1 1 2419 . 15 1 1 A 216 216 GLY C C 216 174.189 174.243 -0.054 1 1 2420 . 15 1 1 A 216 216 GLY CA C 216 45.412 47.091 -1.679 1 1 2421 . 15 1 1 A 216 216 GLY N N 216 110.800 107.192 3.608 1 1 2422 . 15 1 1 A 217 217 GLU H H 217 8.267 8.382 -0.115 1 1 2423 . 15 1 1 A 217 217 GLU HA H 217 4.345 4.652 -0.307 1 1 2427 . 15 1 1 A 217 217 GLU C C 217 176.428 175.265 1.163 1 1 2428 . 15 1 1 A 217 217 GLU CA C 217 56.470 55.449 1.021 1 1 2429 . 15 1 1 A 217 217 GLU CB C 217 30.526 29.791 0.735 1 1 2430 . 15 1 1 A 217 217 GLU N N 217 120.726 121.707 -0.981 1 1 2431 . 15 1 1 A 218 218 ALA H H 218 8.476 8.188 0.288 1 1 2432 . 15 1 1 A 218 218 ALA HA H 218 4.467 4.571 -0.104 1 1 2436 . 15 1 1 A 218 218 ALA C C 218 178.015 176.505 1.510 1 1 2437 . 15 1 1 A 218 218 ALA CA C 218 52.547 51.793 0.754 1 1 2438 . 15 1 1 A 218 218 ALA CB C 218 19.242 18.650 0.592 1 1 2439 . 15 1 1 A 218 218 ALA N N 218 125.534 126.392 -0.858 1 1 2440 . 15 1 1 A 219 219 THR H H 219 8.232 8.170 0.062 1 1 2441 . 15 1 1 A 219 219 THR HA H 219 4.411 4.738 -0.327 1 1 2446 . 15 1 1 A 219 219 THR C C 219 175.327 172.754 2.573 1 1 2447 . 15 1 1 A 219 219 THR CA C 219 61.889 60.185 1.704 1 1 2448 . 15 1 1 A 219 219 THR CB C 219 69.939 69.826 0.113 1 1 2449 . 15 1 1 A 219 219 THR N N 219 113.242 116.825 -3.583 1 1 2450 . 15 1 1 A 220 220 GLY H H 220 8.418 8.335 0.083 1 1 2451 . 15 1 1 A 220 220 GLY C C 220 174.037 174.737 -0.700 1 1 2452 . 15 1 1 A 220 220 GLY CA C 220 45.408 45.386 0.022 1 1 2453 . 15 1 1 A 220 220 GLY N N 220 111.031 111.423 -0.392 1 1 2454 . 15 1 1 A 221 221 ASP H H 221 8.345 8.094 0.251 1 1 2455 . 15 1 1 A 221 221 ASP HA H 221 4.700 4.323 0.377 1 1 2458 . 15 1 1 A 221 221 ASP C C 221 176.535 174.815 1.720 1 1 2459 . 15 1 1 A 221 221 ASP CA C 221 54.402 54.676 -0.274 1 1 2460 . 15 1 1 A 221 221 ASP CB C 221 41.431 39.617 1.814 1 1 2461 . 15 1 1 A 221 221 ASP N N 221 120.795 116.457 4.338 1 1 2462 . 15 1 1 A 222 222 SER H H 222 8.353 8.104 0.249 1 1 2463 . 15 1 1 A 222 222 SER HA H 222 4.493 4.773 -0.280 1 1 2465 . 15 1 1 A 222 222 SER C C 222 174.224 174.227 -0.003 1 1 2466 . 15 1 1 A 222 222 SER CA C 222 58.427 57.579 0.848 1 1 2467 . 15 1 1 A 222 222 SER CB C 222 63.860 62.637 1.223 1 1 2468 . 15 1 1 A 222 222 SER N N 222 116.220 116.264 -0.044 1 1 2469 . 15 1 1 A 223 223 ALA H H 223 8.381 7.864 0.517 1 1 2470 . 15 1 1 A 223 223 ALA HA H 223 4.461 4.463 -0.002 1 1 2474 . 15 1 1 A 223 223 ALA C C 223 176.926 176.467 0.459 1 1 2475 . 15 1 1 A 223 223 ALA CA C 223 52.583 53.406 -0.823 1 1 2476 . 15 1 1 A 223 223 ALA CB C 223 19.438 20.404 -0.966 1 1 2477 . 15 1 1 A 223 223 ALA N N 223 126.592 126.163 0.429 1 1 1 . 16 1 1 A 2 2 ALA HA H 2 4.274 4.538 -0.264 1 1 5 . 16 1 1 A 2 2 ALA C C 2 177.828 177.443 0.385 1 1 6 . 16 1 1 A 2 2 ALA CA C 2 52.984 52.125 0.859 1 1 7 . 16 1 1 A 2 2 ALA CB C 2 19.138 21.311 -2.173 1 1 8 . 16 1 1 A 3 3 GLN H H 3 8.463 7.843 0.620 1 1 9 . 16 1 1 A 3 3 GLN HA H 3 4.676 4.492 0.184 1 1 12 . 16 1 1 A 3 3 GLN C C 3 176.002 175.980 0.022 1 1 13 . 16 1 1 A 3 3 GLN CA C 3 56.258 55.636 0.622 1 1 14 . 16 1 1 A 3 3 GLN CB C 3 30.346 27.645 2.701 1 1 15 . 16 1 1 A 3 3 GLN N N 3 117.490 117.285 0.205 1 1 16 . 16 1 1 A 4 4 GLY H H 4 8.099 7.909 0.190 1 1 17 . 16 1 1 A 4 4 GLY HA2 H 4 3.910 4.283 -0.373 1 1 18 . 16 1 1 A 4 4 GLY C C 4 173.332 171.674 1.658 1 1 19 . 16 1 1 A 4 4 GLY CA C 4 45.333 45.815 -0.482 1 1 20 . 16 1 1 A 4 4 GLY N N 4 109.423 110.792 -1.369 1 1 21 . 16 1 1 A 5 5 LEU H H 5 7.863 8.375 -0.512 1 1 22 . 16 1 1 A 5 5 LEU HA H 5 4.561 5.138 -0.577 1 1 32 . 16 1 1 A 5 5 LEU C C 5 176.448 176.297 0.151 1 1 33 . 16 1 1 A 5 5 LEU CA C 5 54.713 54.109 0.604 1 1 34 . 16 1 1 A 5 5 LEU CB C 5 43.551 41.575 1.976 1 1 38 . 16 1 1 A 5 5 LEU N N 5 120.391 122.426 -2.035 1 1 39 . 16 1 1 A 6 6 ILE H H 6 8.764 9.406 -0.642 1 1 40 . 16 1 1 A 6 6 ILE HA H 6 4.087 4.132 -0.045 1 1 49 . 16 1 1 A 6 6 ILE C C 6 174.679 175.652 -0.973 1 1 50 . 16 1 1 A 6 6 ILE CA C 6 61.279 61.544 -0.265 1 1 51 . 16 1 1 A 6 6 ILE CB C 6 39.651 38.009 1.642 1 1 54 . 16 1 1 A 6 6 ILE N N 6 123.050 125.957 -2.907 1 1 55 . 16 1 1 A 7 7 GLU H H 7 8.587 8.578 0.009 1 1 56 . 16 1 1 A 7 7 GLU HA H 7 4.917 4.727 0.190 1 1 61 . 16 1 1 A 7 7 GLU C C 7 175.978 176.162 -0.184 1 1 62 . 16 1 1 A 7 7 GLU CA C 7 56.127 56.456 -0.329 1 1 63 . 16 1 1 A 7 7 GLU CB C 7 31.115 30.353 0.762 1 1 65 . 16 1 1 A 7 7 GLU N N 7 127.415 127.915 -0.500 1 1 66 . 16 1 1 A 8 8 VAL H H 8 8.986 9.362 -0.376 1 1 67 . 16 1 1 A 8 8 VAL HA H 8 4.375 5.039 -0.664 1 1 72 . 16 1 1 A 8 8 VAL C C 8 173.704 175.153 -1.449 1 1 73 . 16 1 1 A 8 8 VAL CA C 8 61.347 60.631 0.716 1 1 74 . 16 1 1 A 8 8 VAL CB C 8 33.611 33.469 0.142 1 1 76 . 16 1 1 A 8 8 VAL N N 8 126.071 120.180 5.891 1 1 77 . 16 1 1 A 9 9 GLU H H 9 8.521 9.096 -0.575 1 1 78 . 16 1 1 A 9 9 GLU HA H 9 5.837 5.962 -0.125 1 1 81 . 16 1 1 A 9 9 GLU C C 9 175.939 174.229 1.710 1 1 82 . 16 1 1 A 9 9 GLU CA C 9 54.516 54.393 0.123 1 1 83 . 16 1 1 A 9 9 GLU CB C 9 33.009 34.106 -1.097 1 1 84 . 16 1 1 A 9 9 GLU N N 9 122.857 124.195 -1.338 1 1 85 . 16 1 1 A 10 10 ARG H H 10 8.690 8.401 0.289 1 1 86 . 16 1 1 A 10 10 ARG HA H 10 4.709 4.835 -0.126 1 1 94 . 16 1 1 A 10 10 ARG C C 10 174.826 173.644 1.182 1 1 95 . 16 1 1 A 10 10 ARG CA C 10 54.491 55.016 -0.525 1 1 96 . 16 1 1 A 10 10 ARG CB C 10 35.777 34.383 1.394 1 1 98 . 16 1 1 A 10 10 ARG N N 10 120.430 120.502 -0.072 1 1 100 . 16 1 1 A 11 11 LYS H H 11 8.874 8.338 0.536 1 1 101 . 16 1 1 A 11 11 LYS HA H 11 5.530 5.372 0.158 1 1 107 . 16 1 1 A 11 11 LYS C C 11 176.919 175.444 1.475 1 1 108 . 16 1 1 A 11 11 LYS CA C 11 55.084 54.733 0.351 1 1 109 . 16 1 1 A 11 11 LYS CB C 11 35.435 35.369 0.066 1 1 113 . 16 1 1 A 11 11 LYS N N 11 121.087 124.224 -3.137 1 1 114 . 16 1 1 A 12 12 PHE H H 12 8.877 8.907 -0.030 1 1 115 . 16 1 1 A 12 12 PHE HA H 12 5.130 5.388 -0.258 1 1 120 . 16 1 1 A 12 12 PHE C C 12 171.676 172.454 -0.778 1 1 121 . 16 1 1 A 12 12 PHE CA C 12 55.869 55.913 -0.044 1 1 122 . 16 1 1 A 12 12 PHE CB C 12 42.108 42.424 -0.316 1 1 125 . 16 1 1 A 12 12 PHE N N 12 117.486 120.595 -3.109 1 1 126 . 16 1 1 A 13 13 ALA H H 13 9.134 9.230 -0.096 1 1 127 . 16 1 1 A 13 13 ALA HA H 13 5.003 4.868 0.135 1 1 131 . 16 1 1 A 13 13 ALA CA C 13 48.340 49.064 -0.724 1 1 132 . 16 1 1 A 13 13 ALA CB C 13 19.191 20.354 -1.163 1 1 133 . 16 1 1 A 13 13 ALA N N 13 125.915 123.306 2.609 1 1 134 . 16 1 1 A 14 14 PRO HA H 14 4.620 4.995 -0.375 1 1 140 . 16 1 1 A 14 14 PRO C C 14 176.502 177.169 -0.667 1 1 141 . 16 1 1 A 14 14 PRO CA C 14 62.672 62.222 0.450 1 1 142 . 16 1 1 A 14 14 PRO CB C 14 33.119 32.849 0.270 1 1 145 . 16 1 1 A 15 15 GLY H H 15 8.721 8.177 0.544 1 1 146 . 16 1 1 A 15 15 GLY HA2 H 15 3.999 4.084 -0.085 1 1 147 . 16 1 1 A 15 15 GLY HA3 H 15 4.632 4.087 0.545 1 1 148 . 16 1 1 A 15 15 GLY CA C 15 44.411 44.326 0.085 1 1 149 . 16 1 1 A 15 15 GLY N N 15 109.863 108.538 1.325 1 1 150 . 16 1 1 A 16 16 PRO HA H 16 4.447 4.236 0.211 1 1 155 . 16 1 1 A 16 16 PRO C C 16 177.053 177.203 -0.150 1 1 156 . 16 1 1 A 16 16 PRO CA C 16 64.395 65.349 -0.954 1 1 157 . 16 1 1 A 16 16 PRO CB C 16 31.993 32.031 -0.038 1 1 159 . 16 1 1 A 17 17 ASP H H 17 8.550 8.899 -0.349 1 1 160 . 16 1 1 A 17 17 ASP HA H 17 4.950 4.529 0.421 1 1 163 . 16 1 1 A 17 17 ASP C C 17 176.800 176.604 0.196 1 1 164 . 16 1 1 A 17 17 ASP CA C 17 53.271 53.623 -0.352 1 1 165 . 16 1 1 A 17 17 ASP CB C 17 40.392 40.110 0.282 1 1 166 . 16 1 1 A 17 17 ASP N N 17 116.060 116.265 -0.205 1 1 167 . 16 1 1 A 18 18 THR H H 18 7.664 7.717 -0.053 1 1 168 . 16 1 1 A 18 18 THR HA H 18 4.120 3.745 0.375 1 1 174 . 16 1 1 A 18 18 THR C C 18 175.407 176.485 -1.078 1 1 175 . 16 1 1 A 18 18 THR CA C 18 68.718 67.469 1.249 1 1 176 . 16 1 1 A 18 18 THR CB C 18 69.179 68.353 0.826 1 1 178 . 16 1 1 A 18 18 THR N N 18 117.158 116.036 1.122 1 1 179 . 16 1 1 A 19 19 GLU H H 19 8.817 8.502 0.315 1 1 180 . 16 1 1 A 19 19 GLU HA H 19 3.510 3.301 0.209 1 1 184 . 16 1 1 A 19 19 GLU C C 19 178.345 179.235 -0.890 1 1 185 . 16 1 1 A 19 19 GLU CA C 19 61.237 59.864 1.373 1 1 186 . 16 1 1 A 19 19 GLU CB C 19 28.746 29.487 -0.741 1 1 188 . 16 1 1 A 19 19 GLU N N 19 118.802 119.205 -0.403 1 1 189 . 16 1 1 A 20 20 GLU H H 20 7.976 8.175 -0.199 1 1 190 . 16 1 1 A 20 20 GLU HA H 20 4.036 4.096 -0.060 1 1 194 . 16 1 1 A 20 20 GLU C C 20 179.451 179.408 0.043 1 1 195 . 16 1 1 A 20 20 GLU CA C 20 59.909 59.010 0.899 1 1 196 . 16 1 1 A 20 20 GLU CB C 20 28.992 29.475 -0.483 1 1 198 . 16 1 1 A 20 20 GLU N N 20 121.130 119.851 1.279 1 1 199 . 16 1 1 A 21 21 ARG H H 21 8.199 7.747 0.452 1 1 200 . 16 1 1 A 21 21 ARG HA H 21 4.061 4.129 -0.068 1 1 207 . 16 1 1 A 21 21 ARG C C 21 179.087 178.850 0.237 1 1 208 . 16 1 1 A 21 21 ARG CA C 21 58.477 58.611 -0.134 1 1 209 . 16 1 1 A 21 21 ARG CB C 21 30.101 29.983 0.118 1 1 211 . 16 1 1 A 21 21 ARG N N 21 119.897 120.246 -0.349 1 1 213 . 16 1 1 A 22 22 LEU H H 22 8.154 8.356 -0.202 1 1 214 . 16 1 1 A 22 22 LEU HA H 22 3.560 3.747 -0.187 1 1 224 . 16 1 1 A 22 22 LEU C C 22 178.461 179.241 -0.780 1 1 225 . 16 1 1 A 22 22 LEU CA C 22 58.432 57.674 0.758 1 1 226 . 16 1 1 A 22 22 LEU CB C 22 40.229 40.853 -0.624 1 1 230 . 16 1 1 A 22 22 LEU N N 22 120.012 119.431 0.581 1 1 231 . 16 1 1 A 23 23 GLN H H 23 7.621 8.065 -0.444 1 1 232 . 16 1 1 A 23 23 GLN HA H 23 4.232 4.012 0.220 1 1 238 . 16 1 1 A 23 23 GLN C C 23 180.543 178.862 1.681 1 1 239 . 16 1 1 A 23 23 GLN CA C 23 59.434 59.154 0.280 1 1 240 . 16 1 1 A 23 23 GLN CB C 23 28.749 28.546 0.203 1 1 242 . 16 1 1 A 23 23 GLN N N 23 117.823 117.733 0.090 1 1 244 . 16 1 1 A 24 24 GLU H H 24 8.165 7.736 0.429 1 1 245 . 16 1 1 A 24 24 GLU HA H 24 4.072 4.068 0.004 1 1 249 . 16 1 1 A 24 24 GLU C C 24 178.612 179.441 -0.829 1 1 250 . 16 1 1 A 24 24 GLU CA C 24 59.236 59.142 0.094 1 1 251 . 16 1 1 A 24 24 GLU CB C 24 29.606 29.279 0.327 1 1 253 . 16 1 1 A 24 24 GLU N N 24 122.589 120.069 2.520 1 1 254 . 16 1 1 A 25 25 LEU H H 25 7.911 8.014 -0.103 1 1 255 . 16 1 1 A 25 25 LEU HA H 25 4.214 4.082 0.132 1 1 265 . 16 1 1 A 25 25 LEU C C 25 176.745 177.107 -0.362 1 1 266 . 16 1 1 A 25 25 LEU CA C 25 55.659 55.918 -0.259 1 1 267 . 16 1 1 A 25 25 LEU CB C 25 43.109 42.943 0.166 1 1 271 . 16 1 1 A 25 25 LEU N N 25 117.882 117.715 0.167 1 1 272 . 16 1 1 A 26 26 GLY H H 26 7.776 7.940 -0.164 1 1 273 . 16 1 1 A 26 26 GLY HA2 H 26 4.337 4.068 0.269 1 1 274 . 16 1 1 A 26 26 GLY HA3 H 26 3.856 4.081 -0.225 1 1 275 . 16 1 1 A 26 26 GLY C C 26 175.456 174.443 1.013 1 1 276 . 16 1 1 A 26 26 GLY CA C 26 44.875 45.023 -0.148 1 1 277 . 16 1 1 A 26 26 GLY N N 26 104.938 105.605 -0.667 1 1 278 . 16 1 1 A 27 27 ALA H H 27 8.104 8.289 -0.185 1 1 279 . 16 1 1 A 27 27 ALA HA H 27 4.949 4.597 0.352 1 1 283 . 16 1 1 A 27 27 ALA C C 27 176.448 178.303 -1.855 1 1 284 . 16 1 1 A 27 27 ALA CA C 27 52.183 52.362 -0.179 1 1 285 . 16 1 1 A 27 27 ALA CB C 27 21.814 20.259 1.555 1 1 286 . 16 1 1 A 27 27 ALA N N 27 123.263 124.250 -0.987 1 1 287 . 16 1 1 A 28 28 THR H H 28 9.369 9.405 -0.036 1 1 288 . 16 1 1 A 28 28 THR HA H 28 4.779 5.053 -0.274 1 1 293 . 16 1 1 A 28 28 THR C C 28 173.725 173.192 0.533 1 1 294 . 16 1 1 A 28 28 THR CA C 28 60.046 60.053 -0.007 1 1 295 . 16 1 1 A 28 28 THR CB C 28 70.592 71.080 -0.488 1 1 297 . 16 1 1 A 28 28 THR N N 28 112.201 111.886 0.315 1 1 298 . 16 1 1 A 29 29 LEU H H 29 8.518 8.664 -0.146 1 1 299 . 16 1 1 A 29 29 LEU HA H 29 3.332 3.980 -0.648 1 1 309 . 16 1 1 A 29 29 LEU C C 29 176.202 176.411 -0.209 1 1 310 . 16 1 1 A 29 29 LEU CA C 29 55.031 53.760 1.271 1 1 311 . 16 1 1 A 29 29 LEU CB C 29 40.624 42.842 -2.218 1 1 315 . 16 1 1 A 29 29 LEU N N 29 128.151 124.752 3.399 1 1 316 . 16 1 1 A 30 30 GLU H H 30 9.269 9.109 0.160 1 1 317 . 16 1 1 A 30 30 GLU HA H 30 4.287 4.414 -0.127 1 1 321 . 16 1 1 A 30 30 GLU C C 30 176.740 176.530 0.210 1 1 322 . 16 1 1 A 30 30 GLU CA C 30 57.283 56.611 0.672 1 1 323 . 16 1 1 A 30 30 GLU CB C 30 31.045 31.054 -0.009 1 1 325 . 16 1 1 A 30 30 GLU N N 30 130.123 122.194 7.929 1 1 326 . 16 1 1 A 31 31 HIS H H 31 7.341 7.348 -0.007 1 1 327 . 16 1 1 A 31 31 HIS HA H 31 4.701 5.130 -0.429 1 1 331 . 16 1 1 A 31 31 HIS C C 31 172.581 173.874 -1.293 1 1 332 . 16 1 1 A 31 31 HIS CA C 31 55.876 54.550 1.326 1 1 333 . 16 1 1 A 31 31 HIS CB C 31 33.434 34.054 -0.620 1 1 334 . 16 1 1 A 31 31 HIS N N 31 113.223 116.877 -3.654 1 1 335 . 16 1 1 A 32 32 ARG H H 32 8.196 8.733 -0.537 1 1 336 . 16 1 1 A 32 32 ARG HA H 32 5.262 5.134 0.128 1 1 341 . 16 1 1 A 32 32 ARG C C 32 174.377 174.468 -0.091 1 1 342 . 16 1 1 A 32 32 ARG CA C 32 55.808 54.638 1.170 1 1 343 . 16 1 1 A 32 32 ARG CB C 32 33.340 33.518 -0.178 1 1 345 . 16 1 1 A 32 32 ARG N N 32 123.003 120.292 2.711 1 1 346 . 16 1 1 A 33 33 VAL H H 33 8.956 9.206 -0.250 1 1 347 . 16 1 1 A 33 33 VAL HA H 33 4.734 4.815 -0.081 1 1 355 . 16 1 1 A 33 33 VAL C C 33 172.821 174.345 -1.524 1 1 356 . 16 1 1 A 33 33 VAL CA C 33 60.197 59.477 0.720 1 1 357 . 16 1 1 A 33 33 VAL CB C 33 35.860 35.818 0.042 1 1 360 . 16 1 1 A 33 33 VAL N N 33 122.929 117.297 5.632 1 1 361 . 16 1 1 A 34 34 THR H H 34 8.250 8.241 0.009 1 1 362 . 16 1 1 A 34 34 THR HA H 34 5.616 5.738 -0.122 1 1 367 . 16 1 1 A 34 34 THR C C 34 173.913 172.784 1.129 1 1 368 . 16 1 1 A 34 34 THR CA C 34 60.245 60.112 0.133 1 1 369 . 16 1 1 A 34 34 THR CB C 34 71.706 71.241 0.465 1 1 371 . 16 1 1 A 34 34 THR N N 34 119.164 115.110 4.054 1 1 372 . 16 1 1 A 35 35 PHE H H 35 8.565 8.887 -0.322 1 1 373 . 16 1 1 A 35 35 PHE HA H 35 5.029 5.174 -0.145 1 1 378 . 16 1 1 A 35 35 PHE C C 35 173.193 174.244 -1.051 1 1 379 . 16 1 1 A 35 35 PHE CA C 35 55.687 56.368 -0.681 1 1 380 . 16 1 1 A 35 35 PHE CB C 35 40.853 44.792 -3.939 1 1 383 . 16 1 1 A 35 35 PHE N N 35 120.244 120.052 0.192 1 1 384 . 16 1 1 A 36 36 ARG H H 36 8.869 8.791 0.078 1 1 385 . 16 1 1 A 36 36 ARG HA H 36 4.982 5.346 -0.364 1 1 387 . 16 1 1 A 36 36 ARG C C 36 174.743 174.500 0.243 1 1 388 . 16 1 1 A 36 36 ARG CA C 36 55.493 54.230 1.263 1 1 389 . 16 1 1 A 36 36 ARG CB C 36 32.228 33.721 -1.493 1 1 390 . 16 1 1 A 36 36 ARG N N 36 123.893 121.465 2.428 1 1 391 . 16 1 1 A 37 37 ASP H H 37 8.402 9.762 -1.360 1 1 392 . 16 1 1 A 37 37 ASP HA H 37 5.462 5.359 0.103 1 1 395 . 16 1 1 A 37 37 ASP C C 37 175.177 174.907 0.270 1 1 396 . 16 1 1 A 37 37 ASP CA C 37 53.942 53.390 0.552 1 1 397 . 16 1 1 A 37 37 ASP CB C 37 45.486 42.556 2.930 1 1 398 . 16 1 1 A 37 37 ASP N N 37 127.149 126.510 0.639 1 1 399 . 16 1 1 A 38 38 THR H H 38 8.151 8.838 -0.687 1 1 400 . 16 1 1 A 38 38 THR HA H 38 4.866 5.397 -0.531 1 1 405 . 16 1 1 A 38 38 THR C C 38 172.792 173.198 -0.406 1 1 406 . 16 1 1 A 38 38 THR CA C 38 61.416 60.853 0.563 1 1 407 . 16 1 1 A 38 38 THR CB C 38 71.047 70.551 0.496 1 1 409 . 16 1 1 A 38 38 THR N N 38 115.686 116.283 -0.597 1 1 410 . 16 1 1 A 39 39 TYR H H 39 9.021 9.570 -0.549 1 1 411 . 16 1 1 A 39 39 TYR HA H 39 5.544 5.837 -0.293 1 1 416 . 16 1 1 A 39 39 TYR C C 39 176.032 174.700 1.332 1 1 417 . 16 1 1 A 39 39 TYR CA C 39 57.184 56.212 0.972 1 1 418 . 16 1 1 A 39 39 TYR CB C 39 41.642 40.211 1.431 1 1 420 . 16 1 1 A 39 39 TYR N N 39 124.579 125.168 -0.589 1 1 421 . 16 1 1 A 40 40 TYR H H 40 8.487 9.152 -0.665 1 1 422 . 16 1 1 A 40 40 TYR HA H 40 5.517 5.837 -0.320 1 1 426 . 16 1 1 A 40 40 TYR C C 40 174.108 174.528 -0.420 1 1 427 . 16 1 1 A 40 40 TYR CA C 40 56.979 56.882 0.097 1 1 428 . 16 1 1 A 40 40 TYR CB C 40 44.132 42.452 1.680 1 1 431 . 16 1 1 A 40 40 TYR N N 40 119.709 122.267 -2.558 1 1 432 . 16 1 1 A 41 41 ASP H H 41 9.341 8.643 0.698 1 1 433 . 16 1 1 A 41 41 ASP HA H 41 4.866 5.161 -0.295 1 1 436 . 16 1 1 A 41 41 ASP C C 41 177.262 174.774 2.488 1 1 437 . 16 1 1 A 41 41 ASP CA C 41 53.445 53.435 0.010 1 1 438 . 16 1 1 A 41 41 ASP CB C 41 45.347 44.661 0.686 1 1 439 . 16 1 1 A 41 41 ASP N N 41 117.995 120.546 -2.551 1 1 440 . 16 1 1 A 42 42 THR H H 42 11.574 8.666 2.908 1 1 441 . 16 1 1 A 42 42 THR HA H 42 5.206 4.547 0.659 1 1 446 . 16 1 1 A 42 42 THR C C 42 177.935 176.341 1.594 1 1 447 . 16 1 1 A 42 42 THR CA C 42 60.400 60.958 -0.558 1 1 448 . 16 1 1 A 42 42 THR CB C 42 72.114 70.971 1.143 1 1 450 . 16 1 1 A 42 42 THR N N 42 114.394 114.637 -0.243 1 1 451 . 16 1 1 A 43 43 SER H H 43 9.715 8.860 0.855 1 1 452 . 16 1 1 A 43 43 SER HA H 43 4.252 4.214 0.038 1 1 455 . 16 1 1 A 43 43 SER C C 43 175.478 175.217 0.261 1 1 456 . 16 1 1 A 43 43 SER CA C 43 61.277 60.787 0.490 1 1 457 . 16 1 1 A 43 43 SER CB C 43 62.821 62.924 -0.103 1 1 458 . 16 1 1 A 43 43 SER N N 43 116.674 115.830 0.844 1 1 459 . 16 1 1 A 44 44 GLU H H 44 7.674 7.331 0.343 1 1 460 . 16 1 1 A 44 44 GLU HA H 44 4.330 4.451 -0.121 1 1 464 . 16 1 1 A 44 44 GLU C C 44 175.001 175.422 -0.421 1 1 465 . 16 1 1 A 44 44 GLU CA C 44 55.992 55.676 0.316 1 1 466 . 16 1 1 A 44 44 GLU CB C 44 29.276 30.379 -1.103 1 1 468 . 16 1 1 A 44 44 GLU N N 44 117.856 118.852 -0.996 1 1 469 . 16 1 1 A 45 45 LEU H H 45 8.222 7.731 0.491 1 1 470 . 16 1 1 A 45 45 LEU HA H 45 3.901 3.871 0.030 1 1 480 . 16 1 1 A 45 45 LEU C C 45 175.209 176.511 -1.302 1 1 481 . 16 1 1 A 45 45 LEU CA C 45 55.548 56.041 -0.493 1 1 482 . 16 1 1 A 45 45 LEU CB C 45 38.458 39.876 -1.418 1 1 485 . 16 1 1 A 45 45 LEU N N 45 119.335 117.379 1.956 1 1 486 . 16 1 1 A 46 46 SER H H 46 7.347 7.914 -0.567 1 1 487 . 16 1 1 A 46 46 SER HA H 46 3.954 4.157 -0.203 1 1 489 . 16 1 1 A 46 46 SER C C 46 177.497 176.376 1.121 1 1 490 . 16 1 1 A 46 46 SER CA C 46 62.471 61.972 0.499 1 1 491 . 16 1 1 A 46 46 SER CB C 46 63.908 63.123 0.785 1 1 492 . 16 1 1 A 46 46 SER N N 46 111.433 112.586 -1.153 1 1 493 . 16 1 1 A 47 47 LEU H H 47 12.003 8.521 3.482 1 1 494 . 16 1 1 A 47 47 LEU HA H 47 3.959 4.175 -0.216 1 1 504 . 16 1 1 A 47 47 LEU C C 47 180.340 178.196 2.144 1 1 505 . 16 1 1 A 47 47 LEU CA C 47 58.879 57.886 0.993 1 1 506 . 16 1 1 A 47 47 LEU CB C 47 39.572 41.838 -2.266 1 1 510 . 16 1 1 A 47 47 LEU N N 47 124.605 122.617 1.988 1 1 511 . 16 1 1 A 48 48 MET H H 48 10.599 8.854 1.745 1 1 512 . 16 1 1 A 48 48 MET HA H 48 3.213 3.610 -0.397 1 1 520 . 16 1 1 A 48 48 MET C C 48 181.177 177.550 3.627 1 1 521 . 16 1 1 A 48 48 MET CA C 48 60.747 58.130 2.617 1 1 522 . 16 1 1 A 48 48 MET CB C 48 32.594 32.087 0.507 1 1 525 . 16 1 1 A 48 48 MET N N 48 126.254 118.763 7.491 1 1 526 . 16 1 1 A 49 49 LEU H H 49 8.731 7.742 0.989 1 1 527 . 16 1 1 A 49 49 LEU HA H 49 4.097 4.124 -0.027 1 1 536 . 16 1 1 A 49 49 LEU C C 49 178.144 177.297 0.847 1 1 537 . 16 1 1 A 49 49 LEU CA C 49 57.800 55.879 1.921 1 1 538 . 16 1 1 A 49 49 LEU CB C 49 41.379 41.778 -0.399 1 1 541 . 16 1 1 A 49 49 LEU N N 49 119.183 118.684 0.499 1 1 542 . 16 1 1 A 50 50 SER H H 50 7.853 7.664 0.189 1 1 543 . 16 1 1 A 50 50 SER HA H 50 4.822 4.592 0.230 1 1 546 . 16 1 1 A 50 50 SER C C 50 174.539 173.041 1.498 1 1 547 . 16 1 1 A 50 50 SER CA C 50 57.811 58.138 -0.327 1 1 548 . 16 1 1 A 50 50 SER CB C 50 64.443 63.491 0.952 1 1 549 . 16 1 1 A 50 50 SER N N 50 114.594 112.099 2.495 1 1 550 . 16 1 1 A 51 51 ASP H H 51 8.264 7.898 0.366 1 1 551 . 16 1 1 A 51 51 ASP HA H 51 4.362 4.250 0.112 1 1 554 . 16 1 1 A 51 51 ASP C C 51 172.921 174.786 -1.865 1 1 555 . 16 1 1 A 51 51 ASP CA C 51 55.343 55.596 -0.253 1 1 556 . 16 1 1 A 51 51 ASP CB C 51 40.583 39.688 0.895 1 1 557 . 16 1 1 A 51 51 ASP N N 51 123.003 117.474 5.529 1 1 558 . 16 1 1 A 52 52 HIS H H 52 7.869 7.414 0.455 1 1 559 . 16 1 1 A 52 52 HIS HA H 52 5.335 5.525 -0.190 1 1 564 . 16 1 1 A 52 52 HIS C C 52 173.991 173.963 0.028 1 1 565 . 16 1 1 A 52 52 HIS CA C 52 55.889 54.413 1.476 1 1 566 . 16 1 1 A 52 52 HIS CB C 52 31.789 30.026 1.763 1 1 568 . 16 1 1 A 52 52 HIS N N 52 112.486 117.710 -5.224 1 1 569 . 16 1 1 A 53 53 TRP H H 53 8.165 8.979 -0.814 1 1 570 . 16 1 1 A 53 53 TRP HA H 53 4.926 5.338 -0.412 1 1 578 . 16 1 1 A 53 53 TRP C C 53 175.354 175.295 0.059 1 1 579 . 16 1 1 A 53 53 TRP CA C 53 55.364 56.188 -0.824 1 1 580 . 16 1 1 A 53 53 TRP CB C 53 30.641 31.069 -0.428 1 1 585 . 16 1 1 A 53 53 TRP N N 53 117.916 125.698 -7.782 1 1 587 . 16 1 1 A 54 54 LEU H H 54 10.088 9.216 0.872 1 1 588 . 16 1 1 A 54 54 LEU HA H 54 5.497 5.509 -0.012 1 1 598 . 16 1 1 A 54 54 LEU C C 54 173.337 174.791 -1.454 1 1 599 . 16 1 1 A 54 54 LEU CA C 54 54.408 53.854 0.554 1 1 600 . 16 1 1 A 54 54 LEU CB C 54 44.156 45.368 -1.212 1 1 604 . 16 1 1 A 54 54 LEU N N 54 130.826 125.077 5.749 1 1 605 . 16 1 1 A 55 55 ARG H H 55 9.289 9.108 0.181 1 1 606 . 16 1 1 A 55 55 ARG HA H 55 5.482 5.096 0.386 1 1 612 . 16 1 1 A 55 55 ARG C C 55 174.057 174.087 -0.030 1 1 613 . 16 1 1 A 55 55 ARG CA C 55 53.167 54.140 -0.973 1 1 614 . 16 1 1 A 55 55 ARG CB C 55 34.270 33.144 1.126 1 1 616 . 16 1 1 A 55 55 ARG N N 55 125.089 124.450 0.639 1 1 618 . 16 1 1 A 56 56 GLN H H 56 9.092 9.238 -0.146 1 1 619 . 16 1 1 A 56 56 GLN HA H 56 3.991 4.719 -0.728 1 1 626 . 16 1 1 A 56 56 GLN C C 56 174.199 174.657 -0.458 1 1 627 . 16 1 1 A 56 56 GLN CA C 56 54.566 53.758 0.808 1 1 628 . 16 1 1 A 56 56 GLN CB C 56 29.643 30.449 -0.806 1 1 630 . 16 1 1 A 56 56 GLN N N 56 124.355 123.259 1.096 1 1 632 . 16 1 1 A 57 57 ARG H H 57 8.440 8.086 0.354 1 1 633 . 16 1 1 A 57 57 ARG HA H 57 5.316 5.053 0.263 1 1 639 . 16 1 1 A 57 57 ARG C C 57 176.188 176.184 0.004 1 1 640 . 16 1 1 A 57 57 ARG CA C 57 53.940 55.503 -1.563 1 1 641 . 16 1 1 A 57 57 ARG CB C 57 32.426 30.449 1.977 1 1 643 . 16 1 1 A 57 57 ARG N N 57 130.222 125.960 4.262 1 1 645 . 16 1 1 A 58 58 GLU H H 58 8.891 9.326 -0.435 1 1 646 . 16 1 1 A 58 58 GLU HA H 58 3.996 4.042 -0.046 1 1 649 . 16 1 1 A 58 58 GLU CA C 58 58.364 57.373 0.991 1 1 650 . 16 1 1 A 58 58 GLU CB C 58 30.875 27.485 3.390 1 1 651 . 16 1 1 A 58 58 GLU N N 58 131.208 121.142 10.066 1 1 652 . 16 1 1 A 59 59 GLY H H 59 8.367 8.331 0.036 1 1 653 . 16 1 1 A 59 59 GLY HA2 H 59 4.334 3.715 0.619 1 1 654 . 16 1 1 A 59 59 GLY HA3 H 59 3.743 3.834 -0.091 1 1 655 . 16 1 1 A 59 59 GLY C C 59 174.194 175.062 -0.868 1 1 656 . 16 1 1 A 59 59 GLY CA C 59 45.666 45.983 -0.317 1 1 657 . 16 1 1 A 60 60 SER H H 60 8.071 8.554 -0.483 1 1 658 . 16 1 1 A 60 60 SER HA H 60 4.730 4.500 0.230 1 1 661 . 16 1 1 A 60 60 SER C C 60 173.908 173.553 0.355 1 1 662 . 16 1 1 A 60 60 SER CA C 60 58.762 58.814 -0.052 1 1 663 . 16 1 1 A 60 60 SER CB C 60 64.497 64.286 0.211 1 1 664 . 16 1 1 A 60 60 SER N N 60 114.636 114.136 0.500 1 1 665 . 16 1 1 A 61 61 GLY H H 61 8.401 7.366 1.035 1 1 666 . 16 1 1 A 61 61 GLY HA2 H 61 4.560 3.994 0.566 1 1 667 . 16 1 1 A 61 61 GLY HA3 H 61 3.878 4.025 -0.147 1 1 668 . 16 1 1 A 61 61 GLY C C 61 173.526 172.461 1.065 1 1 669 . 16 1 1 A 61 61 GLY CA C 61 44.906 45.727 -0.821 1 1 670 . 16 1 1 A 61 61 GLY N N 61 109.421 107.868 1.553 1 1 671 . 16 1 1 A 62 62 TRP H H 62 8.861 8.545 0.316 1 1 672 . 16 1 1 A 62 62 TRP HA H 62 5.089 4.869 0.220 1 1 681 . 16 1 1 A 62 62 TRP C C 62 176.168 175.641 0.527 1 1 682 . 16 1 1 A 62 62 TRP CA C 62 57.459 58.100 -0.641 1 1 683 . 16 1 1 A 62 62 TRP CB C 62 32.536 29.810 2.726 1 1 689 . 16 1 1 A 62 62 TRP N N 62 122.939 123.863 -0.924 1 1 691 . 16 1 1 A 63 63 GLU H H 63 9.306 9.489 -0.183 1 1 692 . 16 1 1 A 63 63 GLU HA H 63 4.919 5.093 -0.174 1 1 697 . 16 1 1 A 63 63 GLU C C 63 173.770 174.555 -0.785 1 1 698 . 16 1 1 A 63 63 GLU CA C 63 55.953 55.107 0.846 1 1 699 . 16 1 1 A 63 63 GLU CB C 63 35.317 33.029 2.288 1 1 701 . 16 1 1 A 63 63 GLU N N 63 120.136 125.416 -5.280 1 1 702 . 16 1 1 A 64 64 LEU H H 64 8.998 9.463 -0.465 1 1 703 . 16 1 1 A 64 64 LEU HA H 64 5.616 5.623 -0.007 1 1 712 . 16 1 1 A 64 64 LEU C C 64 175.014 173.973 1.041 1 1 713 . 16 1 1 A 64 64 LEU CA C 64 52.945 53.579 -0.634 1 1 714 . 16 1 1 A 64 64 LEU CB C 64 46.904 45.906 0.998 1 1 717 . 16 1 1 A 64 64 LEU N N 64 127.321 129.003 -1.682 1 1 718 . 16 1 1 A 65 65 LYS H H 65 9.322 10.141 -0.819 1 1 719 . 16 1 1 A 65 65 LYS HA H 65 5.347 5.256 0.091 1 1 727 . 16 1 1 A 65 65 LYS C C 65 175.811 175.419 0.392 1 1 728 . 16 1 1 A 65 65 LYS CA C 65 55.817 55.460 0.357 1 1 729 . 16 1 1 A 65 65 LYS CB C 65 34.521 34.572 -0.051 1 1 733 . 16 1 1 A 65 65 LYS N N 65 129.874 128.469 1.405 1 1 734 . 16 1 1 A 66 66 CYS H H 66 9.129 8.811 0.318 1 1 735 . 16 1 1 A 66 66 CYS HA H 66 5.319 4.989 0.330 1 1 738 . 16 1 1 A 66 66 CYS CA C 66 54.532 56.934 -2.402 1 1 739 . 16 1 1 A 66 66 CYS CB C 66 28.813 30.987 -2.174 1 1 740 . 16 1 1 A 66 66 CYS N N 66 121.497 125.333 -3.836 1 1 741 . 16 1 1 A 67 67 PRO HA H 67 4.439 4.029 0.410 1 1 748 . 16 1 1 A 67 67 PRO C C 67 177.297 178.173 -0.876 1 1 749 . 16 1 1 A 67 67 PRO CA C 67 63.596 63.109 0.487 1 1 750 . 16 1 1 A 67 67 PRO CB C 67 32.242 31.083 1.159 1 1 752 . 16 1 1 A 68 68 GLY H H 68 8.316 8.705 -0.389 1 1 753 . 16 1 1 A 68 68 GLY HA2 H 68 3.726 3.905 -0.179 1 1 754 . 16 1 1 A 68 68 GLY HA3 H 68 4.095 3.938 0.157 1 1 755 . 16 1 1 A 68 68 GLY C C 68 173.789 174.247 -0.458 1 1 756 . 16 1 1 A 68 68 GLY CA C 68 45.227 46.013 -0.786 1 1 757 . 16 1 1 A 68 68 GLY N N 68 109.533 109.899 -0.366 1 1 758 . 16 1 1 A 69 69 VAL H H 69 8.114 7.720 0.394 1 1 759 . 16 1 1 A 69 69 VAL HA H 69 4.266 4.415 -0.149 1 1 764 . 16 1 1 A 69 69 VAL C C 69 176.299 175.883 0.416 1 1 765 . 16 1 1 A 69 69 VAL CA C 69 61.945 60.672 1.273 1 1 766 . 16 1 1 A 69 69 VAL CB C 69 33.082 32.865 0.217 1 1 768 . 16 1 1 A 69 69 VAL N N 69 118.540 118.124 0.416 1 1 769 . 16 1 1 A 70 70 THR H H 70 8.324 8.934 -0.610 1 1 770 . 16 1 1 A 70 70 THR HA H 70 4.373 4.311 0.062 1 1 775 . 16 1 1 A 70 70 THR C C 70 175.204 177.225 -2.021 1 1 776 . 16 1 1 A 70 70 THR CA C 70 62.309 65.582 -3.273 1 1 777 . 16 1 1 A 70 70 THR CB C 70 69.787 69.355 0.432 1 1 779 . 16 1 1 A 70 70 THR N N 70 117.636 120.860 -3.224 1 1 780 . 16 1 1 A 71 71 GLY H H 71 8.574 8.525 0.049 1 1 781 . 16 1 1 A 71 71 GLY HA2 H 71 4.096 3.963 0.133 1 1 782 . 16 1 1 A 71 71 GLY HA3 H 71 3.975 3.983 -0.008 1 1 783 . 16 1 1 A 71 71 GLY C C 71 174.313 174.775 -0.462 1 1 784 . 16 1 1 A 71 71 GLY CA C 71 45.545 45.875 -0.330 1 1 785 . 16 1 1 A 71 71 GLY N N 71 111.677 108.095 3.582 1 1 786 . 16 1 1 A 72 72 VAL H H 72 7.945 7.554 0.391 1 1 787 . 16 1 1 A 72 72 VAL HA H 72 4.258 4.197 0.061 1 1 795 . 16 1 1 A 72 72 VAL C C 72 176.162 176.064 0.098 1 1 796 . 16 1 1 A 72 72 VAL CA C 72 62.227 64.703 -2.476 1 1 797 . 16 1 1 A 72 72 VAL CB C 72 32.997 32.513 0.484 1 1 799 . 16 1 1 A 72 72 VAL N N 72 118.647 118.353 0.294 1 1 800 . 16 1 1 A 73 73 SER H H 73 8.498 8.183 0.315 1 1 801 . 16 1 1 A 73 73 SER HA H 73 4.617 4.188 0.429 1 1 803 . 16 1 1 A 73 73 SER C C 73 174.461 173.615 0.846 1 1 804 . 16 1 1 A 73 73 SER CA C 73 58.218 58.943 -0.725 1 1 805 . 16 1 1 A 73 73 SER CB C 73 64.061 60.767 3.294 1 1 806 . 16 1 1 A 73 73 SER N N 73 118.828 116.592 2.236 1 1 807 . 16 1 1 A 74 74 GLY H H 74 8.247 8.121 0.126 1 1 808 . 16 1 1 A 74 74 GLY HA2 H 74 4.101 4.056 0.045 1 1 809 . 16 1 1 A 74 74 GLY HA3 H 74 4.304 4.123 0.181 1 1 810 . 16 1 1 A 74 74 GLY CA C 74 44.896 45.512 -0.616 1 1 811 . 16 1 1 A 74 74 GLY N N 74 111.138 109.879 1.259 1 1 812 . 16 1 1 A 75 75 PRO HA H 75 4.461 4.129 0.332 1 1 819 . 16 1 1 A 75 75 PRO C C 75 176.798 176.667 0.131 1 1 820 . 16 1 1 A 75 75 PRO CA C 75 63.466 63.180 0.286 1 1 821 . 16 1 1 A 75 75 PRO CB C 75 31.980 30.399 1.581 1 1 824 . 16 1 1 A 76 76 HIS H H 76 8.397 8.797 -0.400 1 1 825 . 16 1 1 A 76 76 HIS HA H 76 4.742 4.303 0.439 1 1 829 . 16 1 1 A 76 76 HIS C C 76 174.282 175.402 -1.120 1 1 830 . 16 1 1 A 76 76 HIS CA C 76 55.579 58.306 -2.727 1 1 831 . 16 1 1 A 76 76 HIS CB C 76 30.501 29.426 1.075 1 1 832 . 16 1 1 A 76 76 HIS N N 76 118.431 119.302 -0.871 1 1 833 . 16 1 1 A 77 77 ASN H H 77 8.364 7.925 0.439 1 1 834 . 16 1 1 A 77 77 ASN HA H 77 4.767 4.855 -0.088 1 1 839 . 16 1 1 A 77 77 ASN C C 77 174.576 174.879 -0.303 1 1 840 . 16 1 1 A 77 77 ASN CA C 77 53.139 51.875 1.264 1 1 841 . 16 1 1 A 77 77 ASN CB C 77 39.320 38.787 0.533 1 1 842 . 16 1 1 A 77 77 ASN N N 77 119.421 116.145 3.276 1 1 844 . 16 1 1 A 78 78 GLU H H 78 8.683 7.902 0.781 1 1 845 . 16 1 1 A 78 78 GLU HA H 78 4.409 4.338 0.071 1 1 850 . 16 1 1 A 78 78 GLU C C 78 175.791 174.758 1.033 1 1 851 . 16 1 1 A 78 78 GLU CA C 78 56.359 56.871 -0.512 1 1 852 . 16 1 1 A 78 78 GLU CB C 78 30.818 29.109 1.709 1 1 854 . 16 1 1 A 78 78 GLU N N 78 122.085 118.539 3.546 1 1 855 . 16 1 1 A 79 79 TYR H H 79 8.341 8.757 -0.416 1 1 856 . 16 1 1 A 79 79 TYR HA H 79 4.988 5.138 -0.150 1 1 861 . 16 1 1 A 79 79 TYR C C 79 175.837 175.430 0.407 1 1 862 . 16 1 1 A 79 79 TYR CA C 79 58.028 58.361 -0.333 1 1 863 . 16 1 1 A 79 79 TYR CB C 79 41.672 38.869 2.803 1 1 866 . 16 1 1 A 79 79 TYR N N 79 119.452 121.186 -1.734 1 1 867 . 16 1 1 A 80 80 VAL H H 80 9.366 9.078 0.288 1 1 868 . 16 1 1 A 80 80 VAL HA H 80 4.370 4.585 -0.215 1 1 873 . 16 1 1 A 80 80 VAL C C 80 174.948 175.223 -0.275 1 1 874 . 16 1 1 A 80 80 VAL CA C 80 61.190 61.768 -0.578 1 1 875 . 16 1 1 A 80 80 VAL CB C 80 34.204 32.648 1.556 1 1 877 . 16 1 1 A 80 80 VAL N N 80 120.567 124.416 -3.849 1 1 878 . 16 1 1 A 81 81 GLU H H 81 8.570 8.974 -0.404 1 1 879 . 16 1 1 A 81 81 GLU HA H 81 4.770 4.772 -0.002 1 1 883 . 16 1 1 A 81 81 GLU C C 81 175.491 176.335 -0.844 1 1 884 . 16 1 1 A 81 81 GLU CA C 81 55.655 56.020 -0.365 1 1 885 . 16 1 1 A 81 81 GLU CB C 81 30.415 30.418 -0.003 1 1 887 . 16 1 1 A 81 81 GLU N N 81 124.248 128.151 -3.903 1 1 888 . 16 1 1 A 82 82 VAL H H 82 9.189 8.821 0.368 1 1 889 . 16 1 1 A 82 82 VAL HA H 82 4.279 4.871 -0.592 1 1 894 . 16 1 1 A 82 82 VAL C C 82 176.087 175.856 0.231 1 1 895 . 16 1 1 A 82 82 VAL CA C 82 62.672 60.971 1.701 1 1 896 . 16 1 1 A 82 82 VAL CB C 82 33.121 33.481 -0.360 1 1 898 . 16 1 1 A 82 82 VAL N N 82 127.776 121.855 5.921 1 1 899 . 16 1 1 A 83 83 THR H H 83 8.590 8.649 -0.059 1 1 900 . 16 1 1 A 83 83 THR HA H 83 4.955 5.092 -0.137 1 1 905 . 16 1 1 A 83 83 THR C C 83 174.688 174.591 0.097 1 1 906 . 16 1 1 A 83 83 THR CA C 83 61.332 61.095 0.237 1 1 907 . 16 1 1 A 83 83 THR CB C 83 70.213 70.205 0.008 1 1 909 . 16 1 1 A 83 83 THR N N 83 114.744 115.971 -1.227 1 1 910 . 16 1 1 A 84 84 SER H H 84 7.650 7.461 0.189 1 1 911 . 16 1 1 A 84 84 SER HA H 84 4.819 4.347 0.472 1 1 914 . 16 1 1 A 84 84 SER CA C 84 56.280 59.912 -3.632 1 1 915 . 16 1 1 A 84 84 SER CB C 84 63.294 63.437 -0.143 1 1 916 . 16 1 1 A 84 84 SER N N 84 118.038 118.554 -0.516 1 1 917 . 16 1 1 A 85 85 GLU H H 85 8.391 8.702 -0.311 1 1 918 . 16 1 1 A 85 85 GLU HA H 85 3.661 3.996 -0.335 1 1 923 . 16 1 1 A 85 85 GLU C C 85 177.520 178.475 -0.955 1 1 924 . 16 1 1 A 85 85 GLU CA C 85 62.429 59.723 2.706 1 1 925 . 16 1 1 A 85 85 GLU CB C 85 29.655 29.359 0.296 1 1 927 . 16 1 1 A 86 86 ALA H H 86 8.443 8.184 0.259 1 1 928 . 16 1 1 A 86 86 ALA HA H 86 4.027 4.007 0.020 1 1 932 . 16 1 1 A 86 86 ALA C C 86 180.423 179.830 0.593 1 1 933 . 16 1 1 A 86 86 ALA CA C 86 55.145 54.772 0.373 1 1 934 . 16 1 1 A 86 86 ALA CB C 86 18.165 18.103 0.062 1 1 935 . 16 1 1 A 86 86 ALA N N 86 119.636 122.961 -3.325 1 1 936 . 16 1 1 A 87 87 ALA H H 87 7.214 7.637 -0.423 1 1 937 . 16 1 1 A 87 87 ALA HA H 87 4.244 4.073 0.171 1 1 941 . 16 1 1 A 87 87 ALA C C 87 180.354 179.701 0.653 1 1 942 . 16 1 1 A 87 87 ALA CA C 87 54.378 54.982 -0.604 1 1 943 . 16 1 1 A 87 87 ALA CB C 87 18.795 18.673 0.122 1 1 944 . 16 1 1 A 87 87 ALA N N 87 121.004 120.190 0.814 1 1 945 . 16 1 1 A 88 88 ILE H H 88 8.471 7.783 0.688 1 1 946 . 16 1 1 A 88 88 ILE HA H 88 3.360 3.608 -0.248 1 1 954 . 16 1 1 A 88 88 ILE CA C 88 66.323 65.073 1.250 1 1 955 . 16 1 1 A 88 88 ILE CB C 88 37.808 37.801 0.007 1 1 958 . 16 1 1 A 88 88 ILE N N 88 120.743 119.865 0.878 1 1 959 . 16 1 1 A 89 89 VAL H H 89 8.343 8.399 -0.056 1 1 960 . 16 1 1 A 89 89 VAL HA H 89 3.061 3.469 -0.408 1 1 968 . 16 1 1 A 89 89 VAL C C 89 176.708 178.163 -1.455 1 1 969 . 16 1 1 A 89 89 VAL CA C 89 67.833 66.519 1.314 1 1 970 . 16 1 1 A 89 89 VAL CB C 89 31.509 31.352 0.157 1 1 973 . 16 1 1 A 89 89 VAL N N 89 118.049 119.580 -1.531 1 1 974 . 16 1 1 A 90 90 ALA H H 90 7.516 7.964 -0.448 1 1 975 . 16 1 1 A 90 90 ALA HA H 90 3.987 3.921 0.066 1 1 979 . 16 1 1 A 90 90 ALA C C 90 180.744 180.088 0.656 1 1 980 . 16 1 1 A 90 90 ALA CA C 90 55.481 55.790 -0.309 1 1 981 . 16 1 1 A 90 90 ALA CB C 90 17.953 18.144 -0.191 1 1 982 . 16 1 1 A 90 90 ALA N N 90 118.935 122.191 -3.256 1 1 983 . 16 1 1 A 91 91 GLN H H 91 7.886 8.323 -0.437 1 1 984 . 16 1 1 A 91 91 GLN HA H 91 4.190 3.907 0.283 1 1 991 . 16 1 1 A 91 91 GLN C C 91 178.832 178.655 0.177 1 1 992 . 16 1 1 A 91 91 GLN CA C 91 58.519 59.016 -0.497 1 1 993 . 16 1 1 A 91 91 GLN CB C 91 28.091 28.076 0.015 1 1 995 . 16 1 1 A 91 91 GLN N N 91 117.846 117.423 0.423 1 1 997 . 16 1 1 A 92 92 LEU H H 92 8.751 8.860 -0.109 1 1 998 . 16 1 1 A 92 92 LEU HA H 92 3.903 3.958 -0.055 1 1 1007 . 16 1 1 A 92 92 LEU C C 92 178.997 179.021 -0.024 1 1 1008 . 16 1 1 A 92 92 LEU CA C 92 58.136 58.003 0.133 1 1 1009 . 16 1 1 A 92 92 LEU CB C 92 41.576 41.639 -0.063 1 1 1013 . 16 1 1 A 92 92 LEU N N 92 119.547 119.446 0.101 1 1 1014 . 16 1 1 A 93 93 PHE H H 93 8.648 8.340 0.308 1 1 1015 . 16 1 1 A 93 93 PHE HA H 93 4.270 4.224 0.046 1 1 1020 . 16 1 1 A 93 93 PHE C C 93 179.283 178.789 0.494 1 1 1021 . 16 1 1 A 93 93 PHE CA C 93 59.860 60.311 -0.451 1 1 1022 . 16 1 1 A 93 93 PHE CB C 93 37.765 38.474 -0.709 1 1 1025 . 16 1 1 A 93 93 PHE N N 93 118.041 118.277 -0.236 1 1 1026 . 16 1 1 A 94 94 GLU H H 94 7.739 8.280 -0.541 1 1 1027 . 16 1 1 A 94 94 GLU HA H 94 4.110 4.140 -0.030 1 1 1031 . 16 1 1 A 94 94 GLU C C 94 178.629 178.803 -0.174 1 1 1032 . 16 1 1 A 94 94 GLU CA C 94 59.359 59.384 -0.025 1 1 1033 . 16 1 1 A 94 94 GLU CB C 94 29.589 29.242 0.347 1 1 1035 . 16 1 1 A 94 94 GLU N N 94 119.980 117.311 2.669 1 1 1036 . 16 1 1 A 95 95 LEU H H 95 7.999 8.591 -0.592 1 1 1037 . 16 1 1 A 95 95 LEU HA H 95 4.139 3.976 0.163 1 1 1047 . 16 1 1 A 95 95 LEU C C 95 178.965 178.549 0.416 1 1 1048 . 16 1 1 A 95 95 LEU CA C 95 57.557 57.962 -0.405 1 1 1049 . 16 1 1 A 95 95 LEU CB C 95 43.443 41.412 2.031 1 1 1053 . 16 1 1 A 95 95 LEU N N 95 118.398 121.570 -3.172 1 1 1054 . 16 1 1 A 96 96 LEU H H 96 8.363 7.823 0.540 1 1 1055 . 16 1 1 A 96 96 LEU HA H 96 4.503 4.298 0.205 1 1 1061 . 16 1 1 A 96 96 LEU C C 96 177.932 177.105 0.827 1 1 1062 . 16 1 1 A 96 96 LEU CA C 96 54.700 54.944 -0.244 1 1 1063 . 16 1 1 A 96 96 LEU CB C 96 43.048 42.389 0.659 1 1 1065 . 16 1 1 A 96 96 LEU N N 96 114.720 116.790 -2.070 1 1 1066 . 16 1 1 A 97 97 GLY H H 97 7.810 7.684 0.126 1 1 1067 . 16 1 1 A 97 97 GLY HA2 H 97 3.963 3.883 0.080 1 1 1068 . 16 1 1 A 97 97 GLY C C 97 173.535 174.705 -1.170 1 1 1069 . 16 1 1 A 97 97 GLY CA C 97 45.667 46.569 -0.902 1 1 1070 . 16 1 1 A 97 97 GLY N N 97 109.511 108.906 0.605 1 1 1071 . 16 1 1 A 98 98 SER H H 98 8.131 8.088 0.043 1 1 1072 . 16 1 1 A 98 98 SER HA H 98 4.225 3.965 0.260 1 1 1075 . 16 1 1 A 98 98 SER C C 98 174.974 174.723 0.251 1 1 1076 . 16 1 1 A 98 98 SER CA C 98 57.960 60.521 -2.561 1 1 1077 . 16 1 1 A 98 98 SER CB C 98 63.997 63.341 0.656 1 1 1078 . 16 1 1 A 98 98 SER N N 98 113.405 115.261 -1.856 1 1 1079 . 16 1 1 A 99 99 GLY H H 99 8.052 8.068 -0.016 1 1 1080 . 16 1 1 A 99 99 GLY HA2 H 99 3.998 3.910 0.088 1 1 1081 . 16 1 1 A 99 99 GLY HA3 H 99 3.778 3.976 -0.198 1 1 1082 . 16 1 1 A 99 99 GLY C C 99 174.033 174.319 -0.286 1 1 1083 . 16 1 1 A 99 99 GLY CA C 99 45.123 45.742 -0.619 1 1 1084 . 16 1 1 A 99 99 GLY N N 99 111.534 108.499 3.035 1 1 1085 . 16 1 1 A 100 100 GLU H H 100 8.177 7.395 0.782 1 1 1086 . 16 1 1 A 100 100 GLU HA H 100 4.201 4.532 -0.331 1 1 1091 . 16 1 1 A 100 100 GLU C C 100 175.830 176.065 -0.235 1 1 1092 . 16 1 1 A 100 100 GLU CA C 100 56.442 55.879 0.563 1 1 1093 . 16 1 1 A 100 100 GLU CB C 100 30.428 31.085 -0.657 1 1 1095 . 16 1 1 A 100 100 GLU N N 100 120.463 119.842 0.621 1 1 1096 . 16 1 1 A 101 101 GLN H H 101 8.161 8.521 -0.360 1 1 1097 . 16 1 1 A 101 101 GLN HA H 101 4.098 4.278 -0.180 1 1 1103 . 16 1 1 A 101 101 GLN C C 101 175.412 175.273 0.139 1 1 1104 . 16 1 1 A 101 101 GLN CA C 101 55.632 56.286 -0.654 1 1 1105 . 16 1 1 A 101 101 GLN CB C 101 29.569 28.736 0.833 1 1 1107 . 16 1 1 A 101 101 GLN N N 101 120.014 121.245 -1.231 1 1 1109 . 16 1 1 A 102 102 LYS H H 102 8.235 8.463 -0.228 1 1 1110 . 16 1 1 A 102 102 LYS HA H 102 4.387 4.130 0.257 1 1 1117 . 16 1 1 A 102 102 LYS CA C 102 54.116 53.736 0.380 1 1 1118 . 16 1 1 A 102 102 LYS CB C 102 32.478 32.909 -0.431 1 1 1122 . 16 1 1 A 102 102 LYS N N 102 123.399 125.733 -2.334 1 1 1123 . 16 1 1 A 103 103 PRO HA H 103 4.498 4.424 0.074 1 1 1129 . 16 1 1 A 103 103 PRO C C 103 175.473 176.844 -1.371 1 1 1130 . 16 1 1 A 103 103 PRO CA C 103 62.802 64.156 -1.354 1 1 1131 . 16 1 1 A 103 103 PRO CB C 103 32.124 32.031 0.093 1 1 1134 . 16 1 1 A 104 104 ALA H H 104 8.017 7.739 0.278 1 1 1135 . 16 1 1 A 104 104 ALA HA H 104 4.318 3.845 0.473 1 1 1139 . 16 1 1 A 104 104 ALA C C 104 176.717 176.435 0.282 1 1 1140 . 16 1 1 A 104 104 ALA CA C 104 52.194 54.055 -1.861 1 1 1141 . 16 1 1 A 104 104 ALA CB C 104 20.113 17.985 2.128 1 1 1142 . 16 1 1 A 104 104 ALA N N 104 122.093 119.744 2.349 1 1 1143 . 16 1 1 A 105 105 GLY H H 105 7.678 7.866 -0.188 1 1 1144 . 16 1 1 A 105 105 GLY HA2 H 105 3.851 4.078 -0.227 1 1 1145 . 16 1 1 A 105 105 GLY HA3 H 105 4.053 4.090 -0.037 1 1 1146 . 16 1 1 A 105 105 GLY C C 105 172.990 174.639 -1.649 1 1 1147 . 16 1 1 A 105 105 GLY CA C 105 44.241 43.824 0.417 1 1 1148 . 16 1 1 A 105 105 GLY N N 105 105.234 105.702 -0.468 1 1 1149 . 16 1 1 A 106 106 VAL H H 106 8.409 8.308 0.101 1 1 1150 . 16 1 1 A 106 106 VAL HA H 106 2.829 3.265 -0.436 1 1 1158 . 16 1 1 A 106 106 VAL C C 106 177.822 177.178 0.644 1 1 1159 . 16 1 1 A 106 106 VAL CA C 106 65.522 65.451 0.071 1 1 1160 . 16 1 1 A 106 106 VAL CB C 106 30.701 30.725 -0.024 1 1 1163 . 16 1 1 A 106 106 VAL N N 106 119.215 122.545 -3.330 1 1 1164 . 16 1 1 A 107 107 ALA H H 107 8.707 8.264 0.443 1 1 1165 . 16 1 1 A 107 107 ALA HA H 107 3.730 3.788 -0.058 1 1 1169 . 16 1 1 A 107 107 ALA C C 107 179.661 179.607 0.054 1 1 1170 . 16 1 1 A 107 107 ALA CA C 107 54.995 55.357 -0.362 1 1 1171 . 16 1 1 A 107 107 ALA CB C 107 17.705 17.941 -0.236 1 1 1172 . 16 1 1 A 107 107 ALA N N 107 118.672 121.743 -3.071 1 1 1173 . 16 1 1 A 108 108 ALA H H 108 7.388 7.757 -0.369 1 1 1174 . 16 1 1 A 108 108 ALA HA H 108 4.259 4.127 0.132 1 1 1178 . 16 1 1 A 108 108 ALA C C 108 179.318 179.335 -0.017 1 1 1179 . 16 1 1 A 108 108 ALA CA C 108 53.481 54.940 -1.459 1 1 1180 . 16 1 1 A 108 108 ALA CB C 108 19.367 18.576 0.791 1 1 1181 . 16 1 1 A 108 108 ALA N N 108 116.635 120.015 -3.380 1 1 1182 . 16 1 1 A 109 109 VAL H H 109 7.689 7.353 0.336 1 1 1183 . 16 1 1 A 109 109 VAL HA H 109 4.532 3.853 0.679 1 1 1191 . 16 1 1 A 109 109 VAL C C 109 176.055 177.955 -1.900 1 1 1192 . 16 1 1 A 109 109 VAL CA C 109 61.452 65.633 -4.181 1 1 1193 . 16 1 1 A 109 109 VAL CB C 109 32.728 31.296 1.432 1 1 1196 . 16 1 1 A 109 109 VAL N N 109 112.851 117.057 -4.206 1 1 1197 . 16 1 1 A 110 110 LEU H H 110 7.099 8.096 -0.997 1 1 1198 . 16 1 1 A 110 110 LEU HA H 110 3.723 3.718 0.005 1 1 1208 . 16 1 1 A 110 110 LEU C C 110 179.040 178.754 0.286 1 1 1209 . 16 1 1 A 110 110 LEU CA C 110 58.825 57.833 0.992 1 1 1210 . 16 1 1 A 110 110 LEU CB C 110 41.242 41.676 -0.434 1 1 1214 . 16 1 1 A 110 110 LEU N N 110 119.829 124.972 -5.143 1 1 1215 . 16 1 1 A 111 111 GLY H H 111 8.435 7.651 0.784 1 1 1216 . 16 1 1 A 111 111 GLY HA2 H 111 3.970 3.800 0.170 1 1 1217 . 16 1 1 A 111 111 GLY HA3 H 111 3.885 3.806 0.079 1 1 1218 . 16 1 1 A 111 111 GLY C C 111 178.031 176.210 1.821 1 1 1219 . 16 1 1 A 111 111 GLY CA C 111 46.961 47.569 -0.608 1 1 1220 . 16 1 1 A 111 111 GLY N N 111 104.089 106.503 -2.414 1 1 1221 . 16 1 1 A 112 112 SER H H 112 8.343 8.091 0.252 1 1 1222 . 16 1 1 A 112 112 SER HA H 112 4.266 4.176 0.090 1 1 1224 . 16 1 1 A 112 112 SER C C 112 175.885 176.000 -0.115 1 1 1225 . 16 1 1 A 112 112 SER CA C 112 61.304 61.083 0.221 1 1 1226 . 16 1 1 A 112 112 SER CB C 112 62.901 62.876 0.025 1 1 1227 . 16 1 1 A 112 112 SER N N 112 119.497 117.483 2.014 1 1 1228 . 16 1 1 A 113 113 LEU H H 113 7.667 8.045 -0.378 1 1 1229 . 16 1 1 A 113 113 LEU HA H 113 4.343 4.175 0.168 1 1 1238 . 16 1 1 A 113 113 LEU C C 113 174.760 176.215 -1.455 1 1 1239 . 16 1 1 A 113 113 LEU CA C 113 54.228 54.807 -0.579 1 1 1240 . 16 1 1 A 113 113 LEU CB C 113 41.467 42.494 -1.027 1 1 1244 . 16 1 1 A 113 113 LEU N N 113 118.843 118.885 -0.042 1 1 1245 . 16 1 1 A 114 114 LYS H H 114 7.685 7.628 0.057 1 1 1246 . 16 1 1 A 114 114 LYS HA H 114 3.958 3.978 -0.020 1 1 1250 . 16 1 1 A 114 114 LYS C C 114 177.557 175.305 2.252 1 1 1251 . 16 1 1 A 114 114 LYS CA C 114 56.935 57.167 -0.232 1 1 1252 . 16 1 1 A 114 114 LYS CB C 114 28.898 30.745 -1.847 1 1 1254 . 16 1 1 A 114 114 LYS N N 114 114.072 119.144 -5.072 1 1 1255 . 16 1 1 A 115 115 LEU H H 115 8.329 7.819 0.510 1 1 1256 . 16 1 1 A 115 115 LEU HA H 115 4.315 4.343 -0.028 1 1 1265 . 16 1 1 A 115 115 LEU C C 115 175.988 177.305 -1.317 1 1 1266 . 16 1 1 A 115 115 LEU CA C 115 54.310 54.702 -0.392 1 1 1267 . 16 1 1 A 115 115 LEU CB C 115 44.163 42.211 1.952 1 1 1270 . 16 1 1 A 115 115 LEU N N 115 117.951 120.034 -2.083 1 1 1271 . 16 1 1 A 116 116 GLN H H 116 9.100 8.450 0.650 1 1 1272 . 16 1 1 A 116 116 GLN HA H 116 4.898 4.755 0.143 1 1 1279 . 16 1 1 A 116 116 GLN CA C 116 53.467 55.481 -2.014 1 1 1280 . 16 1 1 A 116 116 GLN CB C 116 32.730 29.834 2.896 1 1 1282 . 16 1 1 A 116 116 GLN N N 116 119.994 121.091 -1.097 1 1 1284 . 16 1 1 A 117 117 GLU H H 117 8.849 8.592 0.257 1 1 1285 . 16 1 1 A 117 117 GLU HA H 117 3.707 3.811 -0.104 1 1 1290 . 16 1 1 A 117 117 GLU C C 117 177.303 176.422 0.881 1 1 1291 . 16 1 1 A 117 117 GLU CA C 117 57.233 55.167 2.066 1 1 1292 . 16 1 1 A 117 117 GLU CB C 117 29.634 28.708 0.926 1 1 1294 . 16 1 1 A 117 117 GLU N N 117 121.487 123.551 -2.064 1 1 1295 . 16 1 1 A 118 118 VAL H H 118 8.983 8.339 0.644 1 1 1296 . 16 1 1 A 118 118 VAL HA H 118 4.360 3.890 0.470 1 1 1304 . 16 1 1 A 118 118 VAL C C 118 174.171 175.312 -1.141 1 1 1305 . 16 1 1 A 118 118 VAL CA C 118 61.772 64.181 -2.409 1 1 1306 . 16 1 1 A 118 118 VAL CB C 118 34.095 32.520 1.575 1 1 1309 . 16 1 1 A 118 118 VAL N N 118 122.933 127.261 -4.328 1 1 1310 . 16 1 1 A 119 119 ALA H H 119 7.023 7.087 -0.064 1 1 1311 . 16 1 1 A 119 119 ALA HA H 119 4.378 4.471 -0.093 1 1 1315 . 16 1 1 A 119 119 ALA C C 119 175.493 175.173 0.320 1 1 1316 . 16 1 1 A 119 119 ALA CA C 119 51.956 51.175 0.781 1 1 1317 . 16 1 1 A 119 119 ALA CB C 119 23.957 21.681 2.276 1 1 1318 . 16 1 1 A 119 119 ALA N N 119 117.379 121.390 -4.011 1 1 1319 . 16 1 1 A 120 120 SER H H 120 6.999 8.592 -1.593 1 1 1320 . 16 1 1 A 120 120 SER HA H 120 5.208 5.815 -0.607 1 1 1323 . 16 1 1 A 120 120 SER C C 120 173.082 172.923 0.159 1 1 1324 . 16 1 1 A 120 120 SER CA C 120 56.754 56.320 0.434 1 1 1325 . 16 1 1 A 120 120 SER CB C 120 64.605 65.385 -0.780 1 1 1326 . 16 1 1 A 120 120 SER N N 120 113.743 116.456 -2.713 1 1 1327 . 16 1 1 A 121 121 PHE H H 121 8.244 9.727 -1.483 1 1 1328 . 16 1 1 A 121 121 PHE HA H 121 5.177 5.100 0.077 1 1 1333 . 16 1 1 A 121 121 PHE C C 121 173.569 175.228 -1.659 1 1 1334 . 16 1 1 A 121 121 PHE CA C 121 55.555 56.458 -0.903 1 1 1335 . 16 1 1 A 121 121 PHE CB C 121 40.959 43.537 -2.578 1 1 1338 . 16 1 1 A 121 121 PHE N N 121 120.358 121.725 -1.367 1 1 1339 . 16 1 1 A 122 122 ILE H H 122 8.907 8.988 -0.081 1 1 1340 . 16 1 1 A 122 122 ILE HA H 122 4.682 5.074 -0.392 1 1 1348 . 16 1 1 A 122 122 ILE C C 122 176.925 174.216 2.709 1 1 1349 . 16 1 1 A 122 122 ILE CA C 122 60.740 59.856 0.884 1 1 1350 . 16 1 1 A 122 122 ILE CB C 122 39.497 40.644 -1.147 1 1 1353 . 16 1 1 A 122 122 ILE N N 122 121.282 120.092 1.190 1 1 1354 . 16 1 1 A 123 123 THR H H 123 9.022 9.319 -0.297 1 1 1355 . 16 1 1 A 123 123 THR HA H 123 5.039 6.121 -1.082 1 1 1360 . 16 1 1 A 123 123 THR C C 123 173.531 172.752 0.779 1 1 1361 . 16 1 1 A 123 123 THR CA C 123 62.266 59.961 2.305 1 1 1362 . 16 1 1 A 123 123 THR CB C 123 70.677 71.489 -0.812 1 1 1364 . 16 1 1 A 123 123 THR N N 123 128.965 123.313 5.652 1 1 1365 . 16 1 1 A 124 124 THR H H 124 8.961 9.188 -0.227 1 1 1366 . 16 1 1 A 124 124 THR HA H 124 5.001 4.887 0.114 1 1 1371 . 16 1 1 A 124 124 THR C C 124 173.468 172.635 0.833 1 1 1372 . 16 1 1 A 124 124 THR CA C 124 62.109 62.005 0.104 1 1 1373 . 16 1 1 A 124 124 THR CB C 124 70.450 69.800 0.650 1 1 1375 . 16 1 1 A 124 124 THR N N 124 122.176 123.366 -1.190 1 1 1376 . 16 1 1 A 125 125 ARG H H 125 9.386 9.608 -0.222 1 1 1377 . 16 1 1 A 125 125 ARG HA H 125 5.764 5.649 0.115 1 1 1384 . 16 1 1 A 125 125 ARG C C 125 175.713 174.812 0.901 1 1 1385 . 16 1 1 A 125 125 ARG CA C 125 53.991 54.220 -0.229 1 1 1386 . 16 1 1 A 125 125 ARG CB C 125 33.557 33.573 -0.016 1 1 1389 . 16 1 1 A 125 125 ARG N N 125 130.004 128.396 1.608 1 1 1390 . 16 1 1 A 126 126 SER H H 126 9.172 9.386 -0.214 1 1 1391 . 16 1 1 A 126 126 SER HA H 126 5.390 5.513 -0.123 1 1 1394 . 16 1 1 A 126 126 SER C C 126 172.359 173.252 -0.893 1 1 1395 . 16 1 1 A 126 126 SER CA C 126 56.934 56.874 0.060 1 1 1396 . 16 1 1 A 126 126 SER CB C 126 65.827 65.880 -0.053 1 1 1397 . 16 1 1 A 126 126 SER N N 126 119.906 120.984 -1.078 1 1 1398 . 16 1 1 A 127 127 SER H H 127 8.591 8.873 -0.282 1 1 1399 . 16 1 1 A 127 127 SER HA H 127 5.739 5.398 0.341 1 1 1401 . 16 1 1 A 127 127 SER C C 127 173.283 173.193 0.090 1 1 1402 . 16 1 1 A 127 127 SER CA C 127 57.354 57.861 -0.507 1 1 1403 . 16 1 1 A 127 127 SER CB C 127 65.412 64.823 0.589 1 1 1404 . 16 1 1 A 127 127 SER N N 127 117.914 119.504 -1.590 1 1 1405 . 16 1 1 A 128 128 TRP H H 128 9.866 9.787 0.079 1 1 1406 . 16 1 1 A 128 128 TRP HA H 128 5.560 5.778 -0.218 1 1 1415 . 16 1 1 A 128 128 TRP C C 128 175.828 175.032 0.796 1 1 1416 . 16 1 1 A 128 128 TRP CA C 128 55.852 55.826 0.026 1 1 1417 . 16 1 1 A 128 128 TRP CB C 128 32.524 32.675 -0.151 1 1 1423 . 16 1 1 A 128 128 TRP N N 128 127.978 126.123 1.855 1 1 1425 . 16 1 1 A 129 129 LYS H H 129 9.424 9.608 -0.184 1 1 1426 . 16 1 1 A 129 129 LYS HA H 129 5.388 5.554 -0.166 1 1 1433 . 16 1 1 A 129 129 LYS C C 129 175.254 174.540 0.714 1 1 1434 . 16 1 1 A 129 129 LYS CA C 129 54.410 54.625 -0.215 1 1 1435 . 16 1 1 A 129 129 LYS CB C 129 35.734 36.394 -0.660 1 1 1439 . 16 1 1 A 129 129 LYS N N 129 121.784 119.042 2.742 1 1 1440 . 16 1 1 A 130 130 LEU H H 130 8.933 9.349 -0.416 1 1 1441 . 16 1 1 A 130 130 LEU HA H 130 4.859 4.932 -0.073 1 1 1447 . 16 1 1 A 130 130 LEU C C 130 173.893 174.400 -0.507 1 1 1448 . 16 1 1 A 130 130 LEU CA C 130 53.848 54.367 -0.519 1 1 1449 . 16 1 1 A 130 130 LEU CB C 130 46.125 45.548 0.577 1 1 1451 . 16 1 1 A 130 130 LEU N N 130 124.543 122.796 1.747 1 1 1452 . 16 1 1 A 131 131 ALA H H 131 8.816 8.845 -0.029 1 1 1453 . 16 1 1 A 131 131 ALA HA H 131 4.776 4.774 0.002 1 1 1457 . 16 1 1 A 131 131 ALA C C 131 176.662 176.410 0.252 1 1 1458 . 16 1 1 A 131 131 ALA CA C 131 51.407 51.324 0.083 1 1 1459 . 16 1 1 A 131 131 ALA CB C 131 19.354 19.776 -0.422 1 1 1460 . 16 1 1 A 131 131 ALA N N 131 131.102 129.755 1.347 1 1 1461 . 16 1 1 A 132 132 LEU H H 132 8.487 8.502 -0.015 1 1 1462 . 16 1 1 A 132 132 LEU HA H 132 4.470 4.869 -0.399 1 1 1470 . 16 1 1 A 132 132 LEU C C 132 176.873 175.073 1.800 1 1 1471 . 16 1 1 A 132 132 LEU CA C 132 54.590 54.160 0.430 1 1 1472 . 16 1 1 A 132 132 LEU CB C 132 42.974 43.805 -0.831 1 1 1475 . 16 1 1 A 132 132 LEU N N 132 123.724 126.895 -3.171 1 1 1476 . 16 1 1 A 133 133 SER H H 133 8.448 9.001 -0.553 1 1 1477 . 16 1 1 A 133 133 SER HA H 133 4.560 5.161 -0.601 1 1 1479 . 16 1 1 A 133 133 SER C C 133 176.043 173.312 2.731 1 1 1480 . 16 1 1 A 133 133 SER CA C 133 58.460 57.650 0.810 1 1 1481 . 16 1 1 A 133 133 SER CB C 133 63.985 64.787 -0.802 1 1 1482 . 16 1 1 A 133 133 SER N N 133 115.880 121.756 -5.876 1 1 1483 . 16 1 1 A 134 134 GLY H H 134 8.232 9.142 -0.910 1 1 1484 . 16 1 1 A 134 134 GLY HA2 H 134 4.147 4.328 -0.181 1 1 1485 . 16 1 1 A 134 134 GLY HA3 H 134 4.045 4.330 -0.285 1 1 1486 . 16 1 1 A 134 134 GLY C C 134 174.013 174.149 -0.136 1 1 1487 . 16 1 1 A 134 134 GLY CA C 134 45.337 44.809 0.528 1 1 1488 . 16 1 1 A 134 134 GLY N N 134 109.970 112.620 -2.650 1 1 1489 . 16 1 1 A 135 135 ALA H H 135 8.424 8.726 -0.302 1 1 1490 . 16 1 1 A 135 135 ALA HA H 135 4.436 3.954 0.482 1 1 1494 . 16 1 1 A 135 135 ALA C C 135 177.537 177.258 0.279 1 1 1495 . 16 1 1 A 135 135 ALA CA C 135 52.721 53.895 -1.174 1 1 1496 . 16 1 1 A 135 135 ALA CB C 135 19.265 17.895 1.370 1 1 1497 . 16 1 1 A 135 135 ALA N N 135 124.118 125.231 -1.113 1 1 1498 . 16 1 1 A 136 136 HIS H H 136 8.466 8.279 0.187 1 1 1499 . 16 1 1 A 136 136 HIS HA H 136 4.379 4.713 -0.334 1 1 1500 . 16 1 1 A 136 136 HIS C C 136 176.259 175.593 0.666 1 1 1501 . 16 1 1 A 136 136 HIS CA C 136 56.082 56.161 -0.079 1 1 1502 . 16 1 1 A 136 136 HIS CB C 136 29.619 31.298 -1.679 1 1 1503 . 16 1 1 A 136 136 HIS N N 136 119.493 114.568 4.925 1 1 1504 . 16 1 1 A 137 137 GLY H H 137 8.431 8.698 -0.267 1 1 1505 . 16 1 1 A 137 137 GLY HA2 H 137 4.151 3.894 0.257 1 1 1506 . 16 1 1 A 137 137 GLY HA3 H 137 3.893 3.906 -0.013 1 1 1507 . 16 1 1 A 137 137 GLY C C 137 174.039 173.228 0.811 1 1 1508 . 16 1 1 A 137 137 GLY CA C 137 45.372 46.150 -0.778 1 1 1509 . 16 1 1 A 137 137 GLY N N 137 110.442 108.080 2.362 1 1 1510 . 16 1 1 A 138 138 GLN H H 138 8.416 7.975 0.441 1 1 1511 . 16 1 1 A 138 138 GLN HA H 138 4.455 4.903 -0.448 1 1 1515 . 16 1 1 A 138 138 GLN C C 138 175.889 174.225 1.664 1 1 1516 . 16 1 1 A 138 138 GLN CA C 138 55.866 54.810 1.056 1 1 1517 . 16 1 1 A 138 138 GLN CB C 138 29.639 32.166 -2.527 1 1 1518 . 16 1 1 A 138 138 GLN N N 138 119.401 120.870 -1.469 1 1 1519 . 16 1 1 A 139 139 GLU H H 139 8.446 8.587 -0.141 1 1 1520 . 16 1 1 A 139 139 GLU HA H 139 4.658 4.813 -0.155 1 1 1524 . 16 1 1 A 139 139 GLU CA C 139 54.589 53.348 1.241 1 1 1525 . 16 1 1 A 139 139 GLU CB C 139 29.733 31.791 -2.058 1 1 1527 . 16 1 1 A 139 139 GLU N N 139 123.136 125.130 -1.994 1 1 1528 . 16 1 1 A 140 140 PRO HA H 140 4.537 4.546 -0.009 1 1 1533 . 16 1 1 A 140 140 PRO C C 140 176.119 176.002 0.117 1 1 1534 . 16 1 1 A 140 140 PRO CA C 140 63.220 62.977 0.243 1 1 1535 . 16 1 1 A 140 140 PRO CB C 140 31.936 32.065 -0.129 1 1 1538 . 16 1 1 A 141 141 GLN H H 141 8.506 8.419 0.087 1 1 1539 . 16 1 1 A 141 141 GLN HA H 141 4.650 4.666 -0.016 1 1 1546 . 16 1 1 A 141 141 GLN C C 141 175.811 176.043 -0.232 1 1 1547 . 16 1 1 A 141 141 GLN CA C 141 55.912 55.235 0.677 1 1 1548 . 16 1 1 A 141 141 GLN CB C 141 30.241 29.648 0.593 1 1 1550 . 16 1 1 A 141 141 GLN N N 141 120.422 121.872 -1.450 1 1 1551 . 16 1 1 A 142 142 LEU H H 142 8.842 9.041 -0.199 1 1 1552 . 16 1 1 A 142 142 LEU HA H 142 5.277 5.264 0.013 1 1 1562 . 16 1 1 A 142 142 LEU C C 142 176.839 175.273 1.566 1 1 1563 . 16 1 1 A 142 142 LEU CA C 142 53.927 52.945 0.982 1 1 1564 . 16 1 1 A 142 142 LEU CB C 142 44.527 45.273 -0.746 1 1 1568 . 16 1 1 A 142 142 LEU N N 142 123.692 122.298 1.394 1 1 1569 . 16 1 1 A 143 143 THR H H 143 9.025 8.585 0.440 1 1 1570 . 16 1 1 A 143 143 THR HA H 143 5.262 5.267 -0.005 1 1 1575 . 16 1 1 A 143 143 THR C C 143 173.753 173.878 -0.125 1 1 1576 . 16 1 1 A 143 143 THR CA C 143 61.795 61.895 -0.100 1 1 1577 . 16 1 1 A 143 143 THR CB C 143 70.660 70.663 -0.003 1 1 1579 . 16 1 1 A 143 143 THR N N 143 117.222 115.765 1.457 1 1 1580 . 16 1 1 A 144 144 ILE H H 144 9.353 10.252 -0.899 1 1 1581 . 16 1 1 A 144 144 ILE HA H 144 5.399 5.297 0.102 1 1 1591 . 16 1 1 A 144 144 ILE C C 144 173.931 173.805 0.126 1 1 1592 . 16 1 1 A 144 144 ILE CA C 144 60.774 60.387 0.387 1 1 1593 . 16 1 1 A 144 144 ILE CB C 144 41.111 39.477 1.634 1 1 1597 . 16 1 1 A 144 144 ILE N N 144 126.383 128.273 -1.890 1 1 1598 . 16 1 1 A 145 145 ASP H H 145 9.214 9.605 -0.391 1 1 1599 . 16 1 1 A 145 145 ASP HA H 145 5.978 5.448 0.530 1 1 1601 . 16 1 1 A 145 145 ASP C C 145 175.441 174.747 0.694 1 1 1602 . 16 1 1 A 145 145 ASP CA C 145 53.035 52.823 0.212 1 1 1603 . 16 1 1 A 145 145 ASP CB C 145 44.153 43.981 0.172 1 1 1604 . 16 1 1 A 145 145 ASP N N 145 127.981 128.741 -0.760 1 1 1605 . 16 1 1 A 146 146 LEU H H 146 9.387 9.831 -0.444 1 1 1606 . 16 1 1 A 146 146 LEU HA H 146 4.918 5.578 -0.660 1 1 1616 . 16 1 1 A 146 146 LEU C C 146 175.003 174.636 0.367 1 1 1617 . 16 1 1 A 146 146 LEU CA C 146 53.940 53.502 0.438 1 1 1618 . 16 1 1 A 146 146 LEU CB C 146 43.902 44.227 -0.325 1 1 1622 . 16 1 1 A 146 146 LEU N N 146 123.532 126.642 -3.110 1 1 1623 . 16 1 1 A 147 147 ASP H H 147 8.676 8.559 0.117 1 1 1624 . 16 1 1 A 147 147 ASP HA H 147 5.205 5.398 -0.193 1 1 1627 . 16 1 1 A 147 147 ASP C C 147 174.956 174.228 0.728 1 1 1628 . 16 1 1 A 147 147 ASP CA C 147 53.441 52.587 0.854 1 1 1629 . 16 1 1 A 147 147 ASP CB C 147 43.370 44.370 -1.000 1 1 1630 . 16 1 1 A 147 147 ASP N N 147 125.499 126.130 -0.631 1 1 1631 . 16 1 1 A 148 148 SER H H 148 8.732 8.881 -0.149 1 1 1632 . 16 1 1 A 148 148 SER HA H 148 5.365 5.703 -0.338 1 1 1634 . 16 1 1 A 148 148 SER C C 148 173.217 173.309 -0.092 1 1 1635 . 16 1 1 A 148 148 SER CA C 148 56.334 56.190 0.144 1 1 1636 . 16 1 1 A 148 148 SER CB C 148 65.812 65.391 0.421 1 1 1637 . 16 1 1 A 148 148 SER N N 148 118.623 120.351 -1.728 1 1 1638 . 16 1 1 A 149 149 ALA H H 149 8.937 8.936 0.001 1 1 1639 . 16 1 1 A 149 149 ALA HA H 149 5.681 5.166 0.515 1 1 1643 . 16 1 1 A 149 149 ALA C C 149 178.894 177.858 1.036 1 1 1644 . 16 1 1 A 149 149 ALA CA C 149 49.996 50.575 -0.579 1 1 1645 . 16 1 1 A 149 149 ALA CB C 149 23.231 21.081 2.150 1 1 1646 . 16 1 1 A 149 149 ALA N N 149 123.952 127.283 -3.331 1 1 1647 . 16 1 1 A 150 150 ASP H H 150 9.010 9.006 0.004 1 1 1648 . 16 1 1 A 150 150 ASP HA H 150 4.336 4.264 0.072 1 1 1651 . 16 1 1 A 150 150 ASP C C 150 176.697 177.948 -1.251 1 1 1652 . 16 1 1 A 150 150 ASP CA C 150 56.543 57.510 -0.967 1 1 1653 . 16 1 1 A 150 150 ASP CB C 150 39.850 40.810 -0.960 1 1 1654 . 16 1 1 A 150 150 ASP N N 150 122.687 124.135 -1.448 1 1 1655 . 16 1 1 A 151 151 PHE H H 151 7.295 7.876 -0.581 1 1 1656 . 16 1 1 A 151 151 PHE HA H 151 5.020 4.656 0.364 1 1 1661 . 16 1 1 A 151 151 PHE C C 151 174.756 175.791 -1.035 1 1 1662 . 16 1 1 A 151 151 PHE CA C 151 56.594 58.196 -1.602 1 1 1663 . 16 1 1 A 151 151 PHE CB C 151 37.765 39.312 -1.547 1 1 1666 . 16 1 1 A 151 151 PHE N N 151 113.928 115.856 -1.928 1 1 1667 . 16 1 1 A 152 152 GLY H H 152 7.786 7.938 -0.152 1 1 1668 . 16 1 1 A 152 152 GLY HA2 H 152 4.459 4.028 0.431 1 1 1669 . 16 1 1 A 152 152 GLY HA3 H 152 3.728 4.048 -0.320 1 1 1670 . 16 1 1 A 152 152 GLY C C 152 172.709 173.689 -0.980 1 1 1671 . 16 1 1 A 152 152 GLY CA C 152 46.106 46.706 -0.600 1 1 1672 . 16 1 1 A 152 152 GLY N N 152 110.312 108.298 2.014 1 1 1673 . 16 1 1 A 153 153 TYR H H 153 6.650 7.552 -0.902 1 1 1674 . 16 1 1 A 153 153 TYR HA H 153 4.508 5.123 -0.615 1 1 1679 . 16 1 1 A 153 153 TYR C C 153 173.092 173.460 -0.368 1 1 1680 . 16 1 1 A 153 153 TYR CA C 153 57.464 56.557 0.907 1 1 1681 . 16 1 1 A 153 153 TYR CB C 153 41.962 41.900 0.062 1 1 1684 . 16 1 1 A 153 153 TYR N N 153 121.977 119.584 2.393 1 1 1685 . 16 1 1 A 154 154 ALA H H 154 7.847 8.816 -0.969 1 1 1686 . 16 1 1 A 154 154 ALA HA H 154 5.144 4.956 0.188 1 1 1690 . 16 1 1 A 154 154 ALA C C 154 174.468 174.936 -0.468 1 1 1691 . 16 1 1 A 154 154 ALA CA C 154 51.776 50.476 1.300 1 1 1692 . 16 1 1 A 154 154 ALA CB C 154 21.747 21.941 -0.194 1 1 1693 . 16 1 1 A 154 154 ALA N N 154 130.258 130.564 -0.306 1 1 1694 . 16 1 1 A 155 155 VAL H H 155 8.733 8.947 -0.214 1 1 1695 . 16 1 1 A 155 155 VAL HA H 155 4.150 4.761 -0.611 1 1 1700 . 16 1 1 A 155 155 VAL C C 155 172.632 173.528 -0.896 1 1 1701 . 16 1 1 A 155 155 VAL CA C 155 61.451 59.297 2.154 1 1 1702 . 16 1 1 A 155 155 VAL CB C 155 35.883 34.686 1.197 1 1 1704 . 16 1 1 A 155 155 VAL N N 155 119.622 122.638 -3.016 1 1 1705 . 16 1 1 A 156 156 GLY H H 156 8.146 8.236 -0.090 1 1 1706 . 16 1 1 A 156 156 GLY HA2 H 156 5.125 2.593 2.532 1 1 1707 . 16 1 1 A 156 156 GLY HA3 H 156 2.061 3.913 -1.852 1 1 1708 . 16 1 1 A 156 156 GLY C C 156 171.746 171.515 0.231 1 1 1709 . 16 1 1 A 156 156 GLY CA C 156 43.319 43.728 -0.409 1 1 1710 . 16 1 1 A 156 156 GLY N N 156 113.332 113.715 -0.383 1 1 1711 . 16 1 1 A 157 157 GLU H H 157 8.967 9.065 -0.098 1 1 1712 . 16 1 1 A 157 157 GLU HA H 157 5.217 5.160 0.057 1 1 1716 . 16 1 1 A 157 157 GLU C C 157 174.476 175.520 -1.044 1 1 1717 . 16 1 1 A 157 157 GLU CA C 157 55.390 54.935 0.455 1 1 1718 . 16 1 1 A 157 157 GLU CB C 157 34.010 32.421 1.589 1 1 1720 . 16 1 1 A 157 157 GLU N N 157 120.823 122.914 -2.091 1 1 1721 . 16 1 1 A 158 158 VAL H H 158 9.076 9.229 -0.153 1 1 1722 . 16 1 1 A 158 158 VAL HA H 158 5.206 4.747 0.459 1 1 1727 . 16 1 1 A 158 158 VAL C C 158 173.900 174.208 -0.308 1 1 1728 . 16 1 1 A 158 158 VAL CA C 158 60.813 61.885 -1.072 1 1 1729 . 16 1 1 A 158 158 VAL CB C 158 33.385 33.011 0.374 1 1 1731 . 16 1 1 A 158 158 VAL N N 158 124.349 125.695 -1.346 1 1 1732 . 16 1 1 A 159 159 GLU H H 159 9.239 9.638 -0.399 1 1 1733 . 16 1 1 A 159 159 GLU HA H 159 5.647 5.180 0.467 1 1 1738 . 16 1 1 A 159 159 GLU C C 159 174.469 175.405 -0.936 1 1 1739 . 16 1 1 A 159 159 GLU CA C 159 54.473 54.645 -0.172 1 1 1740 . 16 1 1 A 159 159 GLU CB C 159 33.852 32.816 1.036 1 1 1742 . 16 1 1 A 159 159 GLU N N 159 125.772 129.389 -3.617 1 1 1743 . 16 1 1 A 160 160 ALA H H 160 9.250 9.365 -0.115 1 1 1744 . 16 1 1 A 160 160 ALA HA H 160 4.966 5.349 -0.383 1 1 1748 . 16 1 1 A 160 160 ALA C C 160 175.114 175.648 -0.534 1 1 1749 . 16 1 1 A 160 160 ALA CA C 160 50.644 50.097 0.547 1 1 1750 . 16 1 1 A 160 160 ALA CB C 160 23.263 23.359 -0.096 1 1 1751 . 16 1 1 A 160 160 ALA N N 160 125.092 129.487 -4.395 1 1 1752 . 16 1 1 A 161 161 MET H H 161 8.559 8.919 -0.360 1 1 1753 . 16 1 1 A 161 161 MET HA H 161 5.468 5.795 -0.327 1 1 1761 . 16 1 1 A 161 161 MET C C 161 176.265 174.922 1.343 1 1 1762 . 16 1 1 A 161 161 MET CA C 161 53.818 54.110 -0.292 1 1 1763 . 16 1 1 A 161 161 MET CB C 161 34.380 34.876 -0.496 1 1 1766 . 16 1 1 A 161 161 MET N N 161 118.699 119.503 -0.804 1 1 1767 . 16 1 1 A 162 162 VAL H H 162 9.046 9.166 -0.120 1 1 1768 . 16 1 1 A 162 162 VAL HA H 162 4.841 4.854 -0.013 1 1 1776 . 16 1 1 A 162 162 VAL C C 162 174.794 175.745 -0.951 1 1 1777 . 16 1 1 A 162 162 VAL CA C 162 59.107 59.811 -0.704 1 1 1778 . 16 1 1 A 162 162 VAL CB C 162 34.018 34.385 -0.367 1 1 1781 . 16 1 1 A 162 162 VAL N N 162 116.435 118.366 -1.931 1 1 1782 . 16 1 1 A 163 163 HIS H H 163 8.793 8.769 0.024 1 1 1783 . 16 1 1 A 163 163 HIS HA H 163 4.717 4.900 -0.183 1 1 1787 . 16 1 1 A 163 163 HIS C C 163 175.460 174.810 0.650 1 1 1788 . 16 1 1 A 163 163 HIS CA C 163 58.488 57.242 1.246 1 1 1789 . 16 1 1 A 163 163 HIS CB C 163 31.185 30.540 0.645 1 1 1791 . 16 1 1 A 163 163 HIS N N 163 117.838 122.402 -4.564 1 1 1792 . 16 1 1 A 164 164 GLU H H 164 8.013 7.833 0.180 1 1 1793 . 16 1 1 A 164 164 GLU HA H 164 4.814 4.513 0.301 1 1 1797 . 16 1 1 A 164 164 GLU C C 164 176.910 176.449 0.461 1 1 1798 . 16 1 1 A 164 164 GLU CA C 164 54.355 54.824 -0.469 1 1 1799 . 16 1 1 A 164 164 GLU CB C 164 32.886 32.864 0.022 1 1 1801 . 16 1 1 A 164 164 GLU N N 164 115.943 115.509 0.434 1 1 1802 . 16 1 1 A 165 165 LYS H H 165 9.088 8.762 0.326 1 1 1803 . 16 1 1 A 165 165 LYS HA H 165 3.942 4.011 -0.069 1 1 1809 . 16 1 1 A 165 165 LYS C C 165 179.657 177.830 1.827 1 1 1810 . 16 1 1 A 165 165 LYS CA C 165 59.888 58.294 1.594 1 1 1811 . 16 1 1 A 165 165 LYS CB C 165 32.024 32.428 -0.404 1 1 1814 . 16 1 1 A 165 165 LYS N N 165 124.120 121.329 2.791 1 1 1815 . 16 1 1 A 166 166 ALA H H 166 8.851 8.059 0.792 1 1 1816 . 16 1 1 A 166 166 ALA HA H 166 4.251 3.997 0.254 1 1 1820 . 16 1 1 A 166 166 ALA C C 166 178.920 179.073 -0.153 1 1 1821 . 16 1 1 A 166 166 ALA CA C 166 54.318 54.720 -0.402 1 1 1822 . 16 1 1 A 166 166 ALA CB C 166 18.810 18.221 0.589 1 1 1823 . 16 1 1 A 166 166 ALA N N 166 120.424 122.494 -2.070 1 1 1824 . 16 1 1 A 167 167 GLU H H 167 7.871 8.243 -0.372 1 1 1825 . 16 1 1 A 167 167 GLU HA H 167 4.404 4.172 0.232 1 1 1829 . 16 1 1 A 167 167 GLU C C 167 177.368 178.051 -0.683 1 1 1830 . 16 1 1 A 167 167 GLU CA C 167 56.701 56.700 0.001 1 1 1831 . 16 1 1 A 167 167 GLU CB C 167 31.208 29.822 1.386 1 1 1833 . 16 1 1 A 167 167 GLU N N 167 114.926 115.401 -0.475 1 1 1834 . 16 1 1 A 168 168 VAL H H 168 7.812 7.515 0.297 1 1 1835 . 16 1 1 A 168 168 VAL HA H 168 3.712 3.675 0.037 1 1 1843 . 16 1 1 A 168 168 VAL CA C 168 68.705 67.854 0.851 1 1 1844 . 16 1 1 A 168 168 VAL CB C 168 29.597 29.690 -0.093 1 1 1847 . 16 1 1 A 168 168 VAL N N 168 120.188 121.736 -1.548 1 1 1848 . 16 1 1 A 169 169 PRO HA H 169 4.252 4.242 0.010 1 1 1851 . 16 1 1 A 169 169 PRO C C 169 179.563 178.592 0.971 1 1 1852 . 16 1 1 A 169 169 PRO CA C 169 67.077 66.828 0.249 1 1 1853 . 16 1 1 A 170 170 ALA H H 170 8.149 8.245 -0.096 1 1 1854 . 16 1 1 A 170 170 ALA HA H 170 4.265 4.123 0.142 1 1 1858 . 16 1 1 A 170 170 ALA C C 170 180.637 179.910 0.727 1 1 1859 . 16 1 1 A 170 170 ALA CA C 170 54.823 55.416 -0.593 1 1 1860 . 16 1 1 A 170 170 ALA CB C 170 18.518 18.341 0.177 1 1 1861 . 16 1 1 A 170 170 ALA N N 170 119.210 119.212 -0.002 1 1 1862 . 16 1 1 A 171 171 ALA H H 171 7.767 8.360 -0.593 1 1 1863 . 16 1 1 A 171 171 ALA HA H 171 4.106 4.102 0.004 1 1 1867 . 16 1 1 A 171 171 ALA C C 171 179.371 179.738 -0.367 1 1 1868 . 16 1 1 A 171 171 ALA CA C 171 55.130 55.072 0.058 1 1 1869 . 16 1 1 A 171 171 ALA CB C 171 18.291 18.477 -0.186 1 1 1870 . 16 1 1 A 171 171 ALA N N 171 122.126 120.360 1.766 1 1 1871 . 16 1 1 A 172 172 LEU H H 172 8.950 8.476 0.474 1 1 1872 . 16 1 1 A 172 172 LEU HA H 172 3.987 4.130 -0.143 1 1 1878 . 16 1 1 A 172 172 LEU C C 172 178.355 178.733 -0.378 1 1 1879 . 16 1 1 A 172 172 LEU CA C 172 57.803 57.946 -0.143 1 1 1880 . 16 1 1 A 172 172 LEU CB C 172 41.667 41.625 0.042 1 1 1882 . 16 1 1 A 172 172 LEU N N 172 118.682 119.482 -0.800 1 1 1883 . 16 1 1 A 173 173 GLU H H 173 7.886 8.186 -0.300 1 1 1884 . 16 1 1 A 173 173 GLU HA H 173 4.132 3.969 0.163 1 1 1887 . 16 1 1 A 173 173 GLU C C 173 179.556 179.458 0.098 1 1 1888 . 16 1 1 A 173 173 GLU CA C 173 59.800 59.572 0.228 1 1 1889 . 16 1 1 A 173 173 GLU CB C 173 29.580 29.253 0.327 1 1 1891 . 16 1 1 A 173 173 GLU N N 173 117.561 118.775 -1.214 1 1 1892 . 16 1 1 A 174 174 LYS H H 174 7.532 7.469 0.063 1 1 1893 . 16 1 1 A 174 174 LYS HA H 174 4.131 4.021 0.110 1 1 1901 . 16 1 1 A 174 174 LYS CA C 174 58.999 59.275 -0.276 1 1 1902 . 16 1 1 A 174 174 LYS CB C 174 32.041 32.441 -0.400 1 1 1906 . 16 1 1 A 174 174 LYS N N 174 119.085 119.554 -0.469 1 1 1907 . 16 1 1 A 175 175 ILE H H 175 8.479 8.048 0.431 1 1 1908 . 16 1 1 A 175 175 ILE HA H 175 3.583 3.609 -0.026 1 1 1918 . 16 1 1 A 175 175 ILE C C 175 179.258 178.541 0.717 1 1 1919 . 16 1 1 A 175 175 ILE CA C 175 65.769 65.694 0.075 1 1 1920 . 16 1 1 A 175 175 ILE CB C 175 37.876 38.000 -0.124 1 1 1923 . 16 1 1 A 175 175 ILE N N 175 118.828 120.049 -1.221 1 1 1924 . 16 1 1 A 176 176 ILE H H 176 8.928 8.318 0.610 1 1 1925 . 16 1 1 A 176 176 ILE HA H 176 3.600 3.656 -0.056 1 1 1935 . 16 1 1 A 176 176 ILE C C 176 178.827 178.509 0.318 1 1 1936 . 16 1 1 A 176 176 ILE CA C 176 65.640 64.790 0.850 1 1 1937 . 16 1 1 A 176 176 ILE CB C 176 37.451 36.994 0.457 1 1 1941 . 16 1 1 A 176 176 ILE N N 176 124.527 119.821 4.706 1 1 1942 . 16 1 1 A 177 177 THR H H 177 8.175 8.047 0.128 1 1 1943 . 16 1 1 A 177 177 THR HA H 177 3.885 3.933 -0.048 1 1 1948 . 16 1 1 A 177 177 THR C C 177 176.867 176.509 0.358 1 1 1949 . 16 1 1 A 177 177 THR CA C 177 67.199 66.522 0.677 1 1 1950 . 16 1 1 A 177 177 THR CB C 177 68.377 68.172 0.205 1 1 1952 . 16 1 1 A 177 177 THR N N 177 119.412 118.626 0.786 1 1 1953 . 16 1 1 A 178 178 VAL H H 178 8.352 8.064 0.288 1 1 1954 . 16 1 1 A 178 178 VAL HA H 178 3.572 3.431 0.141 1 1 1962 . 16 1 1 A 178 178 VAL C C 178 177.664 177.778 -0.114 1 1 1963 . 16 1 1 A 178 178 VAL CA C 178 66.909 66.561 0.348 1 1 1964 . 16 1 1 A 178 178 VAL CB C 178 31.714 31.356 0.358 1 1 1967 . 16 1 1 A 178 178 VAL N N 178 121.168 121.955 -0.787 1 1 1968 . 16 1 1 A 179 179 SER H H 179 8.529 8.196 0.333 1 1 1969 . 16 1 1 A 179 179 SER HA H 179 3.099 3.595 -0.496 1 1 1972 . 16 1 1 A 179 179 SER C C 179 175.380 175.995 -0.615 1 1 1973 . 16 1 1 A 179 179 SER CA C 179 62.728 61.818 0.910 1 1 1974 . 16 1 1 A 179 179 SER CB C 179 62.802 62.538 0.264 1 1 1975 . 16 1 1 A 179 179 SER N N 179 115.226 115.393 -0.167 1 1 1976 . 16 1 1 A 180 180 SER H H 180 7.757 8.049 -0.292 1 1 1977 . 16 1 1 A 180 180 SER HA H 180 4.419 4.285 0.134 1 1 1980 . 16 1 1 A 180 180 SER C C 180 175.359 176.220 -0.861 1 1 1981 . 16 1 1 A 180 180 SER CA C 180 61.025 61.470 -0.445 1 1 1982 . 16 1 1 A 180 180 SER CB C 180 63.072 63.100 -0.028 1 1 1983 . 16 1 1 A 180 180 SER N N 180 114.718 116.460 -1.742 1 1 1984 . 16 1 1 A 181 181 MET H H 181 7.497 7.857 -0.360 1 1 1985 . 16 1 1 A 181 181 MET HA H 181 4.283 4.307 -0.024 1 1 1993 . 16 1 1 A 181 181 MET C C 181 177.217 177.728 -0.511 1 1 1994 . 16 1 1 A 181 181 MET CA C 181 57.539 57.525 0.014 1 1 1995 . 16 1 1 A 181 181 MET CB C 181 33.493 32.748 0.745 1 1 1998 . 16 1 1 A 181 181 MET N N 181 119.274 118.614 0.660 1 1 1999 . 16 1 1 A 182 182 LEU H H 182 7.163 7.681 -0.518 1 1 2000 . 16 1 1 A 182 182 LEU HA H 182 4.133 4.340 -0.207 1 1 2010 . 16 1 1 A 182 182 LEU C C 182 176.289 176.467 -0.178 1 1 2011 . 16 1 1 A 182 182 LEU CA C 182 54.750 55.573 -0.823 1 1 2012 . 16 1 1 A 182 182 LEU CB C 182 43.235 43.107 0.128 1 1 2016 . 16 1 1 A 182 182 LEU N N 182 115.869 121.280 -5.411 1 1 2017 . 16 1 1 A 183 183 GLY H H 183 7.492 7.275 0.217 1 1 2018 . 16 1 1 A 183 183 GLY HA2 H 183 4.086 4.158 -0.072 1 1 2019 . 16 1 1 A 183 183 GLY HA3 H 183 4.425 4.210 0.215 1 1 2020 . 16 1 1 A 183 183 GLY C C 183 171.830 171.988 -0.158 1 1 2021 . 16 1 1 A 183 183 GLY CA C 183 46.035 45.994 0.041 1 1 2022 . 16 1 1 A 183 183 GLY N N 183 107.761 107.198 0.563 1 1 2023 . 16 1 1 A 184 184 VAL H H 184 8.099 8.506 -0.407 1 1 2024 . 16 1 1 A 184 184 VAL HA H 184 4.772 4.708 0.064 1 1 2032 . 16 1 1 A 184 184 VAL CA C 184 59.305 58.797 0.508 1 1 2033 . 16 1 1 A 184 184 VAL CB C 184 33.648 34.744 -1.096 1 1 2036 . 16 1 1 A 184 184 VAL N N 184 119.803 121.800 -1.997 1 1 2037 . 16 1 1 A 185 185 PRO HA H 185 4.442 4.891 -0.449 1 1 2042 . 16 1 1 A 185 185 PRO C C 185 175.871 176.501 -0.630 1 1 2043 . 16 1 1 A 185 185 PRO CA C 185 63.886 62.566 1.320 1 1 2044 . 16 1 1 A 185 185 PRO CB C 185 32.260 32.360 -0.100 1 1 2047 . 16 1 1 A 186 186 ALA H H 186 8.222 8.665 -0.443 1 1 2048 . 16 1 1 A 186 186 ALA HA H 186 4.569 5.042 -0.473 1 1 2052 . 16 1 1 A 186 186 ALA C C 186 177.481 175.940 1.541 1 1 2053 . 16 1 1 A 186 186 ALA CA C 186 51.823 50.725 1.098 1 1 2054 . 16 1 1 A 186 186 ALA CB C 186 20.233 24.148 -3.915 1 1 2055 . 16 1 1 A 186 186 ALA N N 186 125.663 122.026 3.637 1 1 2056 . 16 1 1 A 187 187 GLN H H 187 8.723 8.219 0.504 1 1 2057 . 16 1 1 A 187 187 GLN HA H 187 4.420 4.571 -0.151 1 1 2063 . 16 1 1 A 187 187 GLN C C 187 175.566 175.090 0.476 1 1 2064 . 16 1 1 A 187 187 GLN CA C 187 56.051 54.623 1.428 1 1 2065 . 16 1 1 A 187 187 GLN CB C 187 29.812 29.926 -0.114 1 1 2067 . 16 1 1 A 187 187 GLN N N 187 120.742 117.562 3.180 1 1 2069 . 16 1 1 A 188 188 GLU H H 188 8.163 8.606 -0.443 1 1 2070 . 16 1 1 A 188 188 GLU HA H 188 4.405 4.331 0.074 1 1 2074 . 16 1 1 A 188 188 GLU C C 188 176.058 176.724 -0.666 1 1 2075 . 16 1 1 A 188 188 GLU CA C 188 56.158 55.958 0.200 1 1 2076 . 16 1 1 A 188 188 GLU CB C 188 31.095 28.580 2.515 1 1 2078 . 16 1 1 A 188 188 GLU N N 188 119.177 122.410 -3.233 1 1 2079 . 16 1 1 A 189 189 GLU H H 189 8.567 8.587 -0.020 1 1 2080 . 16 1 1 A 189 189 GLU HA H 189 4.252 4.735 -0.483 1 1 2084 . 16 1 1 A 189 189 GLU C C 189 175.703 175.960 -0.257 1 1 2085 . 16 1 1 A 189 189 GLU CA C 189 56.417 55.330 1.087 1 1 2086 . 16 1 1 A 189 189 GLU CB C 189 29.968 29.245 0.723 1 1 2088 . 16 1 1 A 189 189 GLU N N 189 120.920 122.964 -2.044 1 1 2089 . 16 1 1 A 190 190 ALA H H 190 8.271 7.542 0.729 1 1 2090 . 16 1 1 A 190 190 ALA HA H 190 4.626 3.972 0.654 1 1 2094 . 16 1 1 A 190 190 ALA CA C 190 50.465 52.818 -2.353 1 1 2095 . 16 1 1 A 190 190 ALA CB C 190 18.451 17.748 0.703 1 1 2096 . 16 1 1 A 190 190 ALA N N 190 128.323 121.175 7.148 1 1 2097 . 16 1 1 A 191 191 PRO HA H 191 4.493 4.587 -0.094 1 1 2103 . 16 1 1 A 191 191 PRO C C 191 175.899 176.571 -0.672 1 1 2104 . 16 1 1 A 191 191 PRO CA C 191 62.044 62.267 -0.223 1 1 2105 . 16 1 1 A 191 191 PRO CB C 191 32.184 31.137 1.047 1 1 2108 . 16 1 1 A 192 192 ALA H H 192 8.610 7.964 0.646 1 1 2109 . 16 1 1 A 192 192 ALA HA H 192 4.280 4.338 -0.058 1 1 2113 . 16 1 1 A 192 192 ALA C C 192 178.282 178.283 -0.001 1 1 2114 . 16 1 1 A 192 192 ALA CA C 192 51.698 51.772 -0.074 1 1 2115 . 16 1 1 A 192 192 ALA CB C 192 19.220 19.802 -0.582 1 1 2116 . 16 1 1 A 192 192 ALA N N 192 123.420 124.169 -0.749 1 1 2117 . 16 1 1 A 193 193 LYS H H 193 8.531 8.881 -0.350 1 1 2118 . 16 1 1 A 193 193 LYS HA H 193 3.294 3.582 -0.288 1 1 2126 . 16 1 1 A 193 193 LYS C C 193 177.640 177.858 -0.218 1 1 2127 . 16 1 1 A 193 193 LYS CA C 193 60.644 59.172 1.472 1 1 2128 . 16 1 1 A 193 193 LYS CB C 193 32.607 31.746 0.861 1 1 2132 . 16 1 1 A 193 193 LYS N N 193 122.851 119.603 3.248 1 1 2133 . 16 1 1 A 194 194 LEU H H 194 8.570 7.885 0.685 1 1 2134 . 16 1 1 A 194 194 LEU HA H 194 3.845 4.199 -0.354 1 1 2144 . 16 1 1 A 194 194 LEU C C 194 177.965 179.968 -2.003 1 1 2145 . 16 1 1 A 194 194 LEU CA C 194 57.611 57.426 0.185 1 1 2146 . 16 1 1 A 194 194 LEU CB C 194 41.776 41.133 0.643 1 1 2150 . 16 1 1 A 194 194 LEU N N 194 115.801 119.391 -3.590 1 1 2151 . 16 1 1 A 195 195 MET H H 195 6.782 7.897 -1.115 1 1 2152 . 16 1 1 A 195 195 MET HA H 195 4.487 4.200 0.287 1 1 2160 . 16 1 1 A 195 195 MET C C 195 178.280 178.837 -0.557 1 1 2161 . 16 1 1 A 195 195 MET CA C 195 56.858 58.470 -1.612 1 1 2162 . 16 1 1 A 195 195 MET CB C 195 31.557 31.592 -0.035 1 1 2165 . 16 1 1 A 195 195 MET N N 195 113.898 118.659 -4.761 1 1 2166 . 16 1 1 A 196 196 VAL H H 196 7.713 7.434 0.279 1 1 2167 . 16 1 1 A 196 196 VAL HA H 196 3.501 3.435 0.066 1 1 2175 . 16 1 1 A 196 196 VAL C C 196 177.624 177.779 -0.155 1 1 2176 . 16 1 1 A 196 196 VAL CA C 196 66.318 65.947 0.371 1 1 2177 . 16 1 1 A 196 196 VAL CB C 196 31.380 31.528 -0.148 1 1 2180 . 16 1 1 A 196 196 VAL N N 196 120.413 119.490 0.923 1 1 2181 . 16 1 1 A 197 197 TYR H H 197 7.972 8.403 -0.431 1 1 2182 . 16 1 1 A 197 197 TYR HA H 197 3.145 4.235 -1.090 1 1 2187 . 16 1 1 A 197 197 TYR C C 197 177.726 176.981 0.745 1 1 2188 . 16 1 1 A 197 197 TYR CA C 197 62.253 61.595 0.658 1 1 2189 . 16 1 1 A 197 197 TYR CB C 197 37.314 38.546 -1.232 1 1 2192 . 16 1 1 A 197 197 TYR N N 197 119.543 121.076 -1.533 1 1 2193 . 16 1 1 A 198 198 LEU H H 198 8.630 8.911 -0.281 1 1 2194 . 16 1 1 A 198 198 LEU HA H 198 3.923 3.724 0.199 1 1 2203 . 16 1 1 A 198 198 LEU C C 198 178.074 179.007 -0.933 1 1 2204 . 16 1 1 A 198 198 LEU CA C 198 58.294 57.958 0.336 1 1 2205 . 16 1 1 A 198 198 LEU CB C 198 42.177 41.516 0.661 1 1 2209 . 16 1 1 A 198 198 LEU N N 198 118.430 119.992 -1.562 1 1 2210 . 16 1 1 A 199 199 GLN H H 199 8.082 8.195 -0.113 1 1 2211 . 16 1 1 A 199 199 GLN HA H 199 3.054 3.711 -0.657 1 1 2216 . 16 1 1 A 199 199 GLN C C 199 176.875 178.055 -1.180 1 1 2217 . 16 1 1 A 199 199 GLN CA C 199 59.739 58.181 1.558 1 1 2218 . 16 1 1 A 199 199 GLN CB C 199 28.055 27.836 0.219 1 1 2220 . 16 1 1 A 199 199 GLN N N 199 117.926 117.121 0.805 1 1 2222 . 16 1 1 A 200 200 ARG H H 200 7.349 7.815 -0.466 1 1 2223 . 16 1 1 A 200 200 ARG HA H 200 3.798 3.813 -0.015 1 1 2231 . 16 1 1 A 200 200 ARG C C 200 178.037 178.093 -0.056 1 1 2232 . 16 1 1 A 200 200 ARG CA C 200 58.260 58.717 -0.457 1 1 2233 . 16 1 1 A 200 200 ARG CB C 200 30.706 29.940 0.766 1 1 2236 . 16 1 1 A 200 200 ARG N N 200 113.772 119.850 -6.078 1 1 2238 . 16 1 1 A 201 201 PHE H H 201 8.329 7.707 0.622 1 1 2239 . 16 1 1 A 201 201 PHE HA H 201 4.630 4.388 0.242 1 1 2244 . 16 1 1 A 201 201 PHE C C 201 176.606 176.189 0.417 1 1 2245 . 16 1 1 A 201 201 PHE CA C 201 59.014 58.636 0.378 1 1 2246 . 16 1 1 A 201 201 PHE CB C 201 40.357 40.384 -0.027 1 1 2249 . 16 1 1 A 201 201 PHE N N 201 114.182 116.175 -1.993 1 1 2250 . 16 1 1 A 202 202 ARG H H 202 8.719 8.244 0.475 1 1 2251 . 16 1 1 A 202 202 ARG HA H 202 5.071 4.658 0.413 1 1 2261 . 16 1 1 A 202 202 ARG CA C 202 53.956 53.824 0.132 1 1 2262 . 16 1 1 A 202 202 ARG CB C 202 31.979 30.096 1.883 1 1 2264 . 16 1 1 A 202 202 ARG N N 202 120.115 114.365 5.750 1 1 2266 . 16 1 1 A 203 203 PRO HA H 203 4.348 4.475 -0.127 1 1 2271 . 16 1 1 A 203 203 PRO C C 203 179.736 178.922 0.814 1 1 2272 . 16 1 1 A 203 203 PRO CA C 203 65.674 65.873 -0.199 1 1 2273 . 16 1 1 A 203 203 PRO CB C 203 31.717 31.956 -0.239 1 1 2275 . 16 1 1 A 204 204 LEU H H 204 8.875 7.612 1.263 1 1 2276 . 16 1 1 A 204 204 LEU HA H 204 4.291 3.998 0.293 1 1 2286 . 16 1 1 A 204 204 LEU C C 204 180.353 178.212 2.141 1 1 2287 . 16 1 1 A 204 204 LEU CA C 204 58.012 57.618 0.394 1 1 2288 . 16 1 1 A 204 204 LEU CB C 204 40.893 41.369 -0.476 1 1 2292 . 16 1 1 A 204 204 LEU N N 204 118.940 116.511 2.429 1 1 2293 . 16 1 1 A 205 205 ASP H H 205 7.541 8.453 -0.912 1 1 2294 . 16 1 1 A 205 205 ASP HA H 205 4.622 4.303 0.319 1 1 2297 . 16 1 1 A 205 205 ASP C C 205 177.602 177.767 -0.165 1 1 2298 . 16 1 1 A 205 205 ASP CA C 205 57.437 57.711 -0.274 1 1 2299 . 16 1 1 A 205 205 ASP CB C 205 41.143 41.515 -0.372 1 1 2300 . 16 1 1 A 205 205 ASP N N 205 120.838 119.433 1.405 1 1 2301 . 16 1 1 A 206 206 TYR H H 206 8.237 8.348 -0.111 1 1 2302 . 16 1 1 A 206 206 TYR HA H 206 4.018 4.132 -0.114 1 1 2307 . 16 1 1 A 206 206 TYR C C 206 176.433 177.635 -1.202 1 1 2308 . 16 1 1 A 206 206 TYR CA C 206 62.148 61.800 0.348 1 1 2309 . 16 1 1 A 206 206 TYR CB C 206 38.305 38.716 -0.411 1 1 2312 . 16 1 1 A 206 206 TYR N N 206 119.475 120.318 -0.843 1 1 2313 . 16 1 1 A 207 207 GLN H H 207 8.124 8.250 -0.126 1 1 2314 . 16 1 1 A 207 207 GLN HA H 207 3.823 3.233 0.590 1 1 2320 . 16 1 1 A 207 207 GLN C C 207 178.019 178.632 -0.613 1 1 2321 . 16 1 1 A 207 207 GLN CA C 207 58.841 59.214 -0.373 1 1 2322 . 16 1 1 A 207 207 GLN CB C 207 28.208 28.642 -0.434 1 1 2324 . 16 1 1 A 207 207 GLN N N 207 115.863 118.201 -2.338 1 1 2326 . 16 1 1 A 208 208 ARG H H 208 7.522 8.121 -0.599 1 1 2327 . 16 1 1 A 208 208 ARG HA H 208 4.127 4.067 0.060 1 1 2334 . 16 1 1 A 208 208 ARG C C 208 179.278 178.567 0.711 1 1 2335 . 16 1 1 A 208 208 ARG CA C 208 59.419 58.969 0.450 1 1 2336 . 16 1 1 A 208 208 ARG CB C 208 30.182 29.772 0.410 1 1 2338 . 16 1 1 A 208 208 ARG N N 208 118.471 119.797 -1.326 1 1 2340 . 16 1 1 A 209 209 LEU H H 209 7.869 7.759 0.110 1 1 2341 . 16 1 1 A 209 209 LEU HA H 209 4.091 4.043 0.048 1 1 2351 . 16 1 1 A 209 209 LEU C C 209 179.715 179.010 0.705 1 1 2352 . 16 1 1 A 209 209 LEU CA C 209 57.891 57.889 0.002 1 1 2353 . 16 1 1 A 209 209 LEU CB C 209 41.338 41.796 -0.458 1 1 2356 . 16 1 1 A 209 209 LEU N N 209 119.659 120.045 -0.386 1 1 2357 . 16 1 1 A 210 210 LEU H H 210 8.034 8.509 -0.475 1 1 2358 . 16 1 1 A 210 210 LEU HA H 210 3.977 4.042 -0.065 1 1 2367 . 16 1 1 A 210 210 LEU C C 210 180.363 178.649 1.714 1 1 2368 . 16 1 1 A 210 210 LEU CA C 210 57.459 58.413 -0.954 1 1 2369 . 16 1 1 A 210 210 LEU CB C 210 41.699 41.343 0.356 1 1 2373 . 16 1 1 A 210 210 LEU N N 210 120.967 119.703 1.264 1 1 2374 . 16 1 1 A 211 211 GLU H H 211 8.174 8.600 -0.426 1 1 2375 . 16 1 1 A 211 211 GLU HA H 211 4.075 3.967 0.108 1 1 2379 . 16 1 1 A 211 211 GLU C C 211 178.499 178.746 -0.247 1 1 2380 . 16 1 1 A 211 211 GLU CA C 211 58.575 59.273 -0.698 1 1 2381 . 16 1 1 A 211 211 GLU CB C 211 29.583 29.221 0.362 1 1 2383 . 16 1 1 A 211 211 GLU N N 211 119.217 118.353 0.864 1 1 2384 . 16 1 1 A 212 212 ALA H H 212 7.723 7.363 0.360 1 1 2385 . 16 1 1 A 212 212 ALA HA H 212 4.291 4.336 -0.045 1 1 2389 . 16 1 1 A 212 212 ALA C C 212 178.770 177.574 1.196 1 1 2390 . 16 1 1 A 212 212 ALA CA C 212 53.966 54.627 -0.661 1 1 2391 . 16 1 1 A 212 212 ALA CB C 212 19.117 19.257 -0.140 1 1 2392 . 16 1 1 A 212 212 ALA N N 212 121.798 122.359 -0.561 1 1 2393 . 16 1 1 A 213 213 ALA H H 213 7.743 8.253 -0.510 1 1 2394 . 16 1 1 A 213 213 ALA HA H 213 4.406 4.446 -0.040 1 1 2398 . 16 1 1 A 213 213 ALA C C 213 178.413 177.251 1.162 1 1 2399 . 16 1 1 A 213 213 ALA CA C 213 53.129 51.132 1.997 1 1 2400 . 16 1 1 A 213 213 ALA CB C 213 18.926 17.881 1.045 1 1 2401 . 16 1 1 A 213 213 ALA N N 213 120.435 120.357 0.078 1 1 2402 . 16 1 1 A 214 214 SER H H 214 7.944 8.538 -0.594 1 1 2403 . 16 1 1 A 214 214 SER HA H 214 4.559 4.436 0.123 1 1 2406 . 16 1 1 A 214 214 SER C C 214 174.958 174.379 0.579 1 1 2407 . 16 1 1 A 214 214 SER CA C 214 58.640 58.643 -0.003 1 1 2408 . 16 1 1 A 214 214 SER CB C 214 63.928 63.880 0.048 1 1 2409 . 16 1 1 A 214 214 SER N N 214 113.729 120.033 -6.304 1 1 2410 . 16 1 1 A 215 215 SER H H 215 8.255 8.229 0.026 1 1 2411 . 16 1 1 A 215 215 SER HA H 215 4.547 4.403 0.144 1 1 2413 . 16 1 1 A 215 215 SER C C 215 175.289 174.286 1.003 1 1 2414 . 16 1 1 A 215 215 SER CA C 215 58.833 60.273 -1.440 1 1 2415 . 16 1 1 A 215 215 SER CB C 215 63.847 62.821 1.026 1 1 2416 . 16 1 1 A 215 215 SER N N 215 117.674 116.641 1.033 1 1 2417 . 16 1 1 A 216 216 GLY H H 216 8.431 8.247 0.184 1 1 2418 . 16 1 1 A 216 216 GLY HA2 H 216 4.054 4.039 0.015 1 1 2419 . 16 1 1 A 216 216 GLY C C 216 174.189 172.252 1.937 1 1 2420 . 16 1 1 A 216 216 GLY CA C 216 45.412 44.545 0.867 1 1 2421 . 16 1 1 A 216 216 GLY N N 216 110.800 109.709 1.091 1 1 2422 . 16 1 1 A 217 217 GLU H H 217 8.267 8.515 -0.248 1 1 2423 . 16 1 1 A 217 217 GLU HA H 217 4.345 4.806 -0.461 1 1 2427 . 16 1 1 A 217 217 GLU C C 217 176.428 176.919 -0.491 1 1 2428 . 16 1 1 A 217 217 GLU CA C 217 56.470 55.096 1.374 1 1 2429 . 16 1 1 A 217 217 GLU CB C 217 30.526 31.558 -1.032 1 1 2430 . 16 1 1 A 217 217 GLU N N 217 120.726 120.291 0.435 1 1 2431 . 16 1 1 A 218 218 ALA H H 218 8.476 8.673 -0.197 1 1 2432 . 16 1 1 A 218 218 ALA HA H 218 4.467 4.114 0.353 1 1 2436 . 16 1 1 A 218 218 ALA C C 218 178.015 177.303 0.712 1 1 2437 . 16 1 1 A 218 218 ALA CA C 218 52.547 54.556 -2.009 1 1 2438 . 16 1 1 A 218 218 ALA CB C 218 19.242 19.112 0.130 1 1 2439 . 16 1 1 A 218 218 ALA N N 218 125.534 128.888 -3.354 1 1 2440 . 16 1 1 A 219 219 THR H H 219 8.232 7.648 0.584 1 1 2441 . 16 1 1 A 219 219 THR HA H 219 4.411 4.688 -0.277 1 1 2446 . 16 1 1 A 219 219 THR C C 219 175.327 172.219 3.108 1 1 2447 . 16 1 1 A 219 219 THR CA C 219 61.889 61.085 0.804 1 1 2448 . 16 1 1 A 219 219 THR CB C 219 69.939 70.572 -0.633 1 1 2449 . 16 1 1 A 219 219 THR N N 219 113.242 109.955 3.287 1 1 2450 . 16 1 1 A 220 220 GLY H H 220 8.418 8.827 -0.409 1 1 2451 . 16 1 1 A 220 220 GLY C C 220 174.037 173.943 0.094 1 1 2452 . 16 1 1 A 220 220 GLY CA C 220 45.408 44.995 0.413 1 1 2453 . 16 1 1 A 220 220 GLY N N 220 111.031 115.678 -4.647 1 1 2454 . 16 1 1 A 221 221 ASP H H 221 8.345 8.947 -0.602 1 1 2455 . 16 1 1 A 221 221 ASP HA H 221 4.700 4.477 0.223 1 1 2458 . 16 1 1 A 221 221 ASP C C 221 176.535 176.138 0.397 1 1 2459 . 16 1 1 A 221 221 ASP CA C 221 54.402 56.994 -2.592 1 1 2460 . 16 1 1 A 221 221 ASP CB C 221 41.431 40.801 0.630 1 1 2461 . 16 1 1 A 221 221 ASP N N 221 120.795 126.780 -5.985 1 1 2462 . 16 1 1 A 222 222 SER H H 222 8.353 8.083 0.270 1 1 2463 . 16 1 1 A 222 222 SER HA H 222 4.493 4.172 0.321 1 1 2465 . 16 1 1 A 222 222 SER C C 222 174.224 173.026 1.198 1 1 2466 . 16 1 1 A 222 222 SER CA C 222 58.427 59.126 -0.699 1 1 2467 . 16 1 1 A 222 222 SER CB C 222 63.860 61.788 2.072 1 1 2468 . 16 1 1 A 222 222 SER N N 222 116.220 113.760 2.460 1 1 2469 . 16 1 1 A 223 223 ALA H H 223 8.381 8.671 -0.290 1 1 2470 . 16 1 1 A 223 223 ALA HA H 223 4.461 5.108 -0.647 1 1 2474 . 16 1 1 A 223 223 ALA C C 223 176.926 176.159 0.767 1 1 2475 . 16 1 1 A 223 223 ALA CA C 223 52.583 51.016 1.567 1 1 2476 . 16 1 1 A 223 223 ALA CB C 223 19.438 22.151 -2.713 1 1 2477 . 16 1 1 A 223 223 ALA N N 223 126.592 129.786 -3.194 1 1 1 . 17 1 1 A 2 2 ALA HA H 2 4.274 3.966 0.308 1 1 5 . 17 1 1 A 2 2 ALA C C 2 177.828 176.193 1.635 1 1 6 . 17 1 1 A 2 2 ALA CA C 2 52.984 53.806 -0.822 1 1 7 . 17 1 1 A 2 2 ALA CB C 2 19.138 17.857 1.281 1 1 8 . 17 1 1 A 3 3 GLN H H 3 8.463 7.987 0.476 1 1 9 . 17 1 1 A 3 3 GLN HA H 3 4.676 4.645 0.031 1 1 12 . 17 1 1 A 3 3 GLN C C 3 176.002 176.330 -0.328 1 1 13 . 17 1 1 A 3 3 GLN CA C 3 56.258 54.677 1.581 1 1 14 . 17 1 1 A 3 3 GLN CB C 3 30.346 30.794 -0.448 1 1 15 . 17 1 1 A 3 3 GLN N N 3 117.490 117.015 0.475 1 1 16 . 17 1 1 A 4 4 GLY H H 4 8.099 8.774 -0.675 1 1 17 . 17 1 1 A 4 4 GLY HA2 H 4 3.910 3.927 -0.017 1 1 18 . 17 1 1 A 4 4 GLY C C 4 173.332 174.200 -0.868 1 1 19 . 17 1 1 A 4 4 GLY CA C 4 45.333 47.143 -1.810 1 1 20 . 17 1 1 A 4 4 GLY N N 4 109.423 113.454 -4.031 1 1 21 . 17 1 1 A 5 5 LEU H H 5 7.863 8.514 -0.651 1 1 22 . 17 1 1 A 5 5 LEU HA H 5 4.561 4.653 -0.092 1 1 32 . 17 1 1 A 5 5 LEU C C 5 176.448 175.833 0.615 1 1 33 . 17 1 1 A 5 5 LEU CA C 5 54.713 54.325 0.388 1 1 34 . 17 1 1 A 5 5 LEU CB C 5 43.551 41.090 2.461 1 1 38 . 17 1 1 A 5 5 LEU N N 5 120.391 125.598 -5.207 1 1 39 . 17 1 1 A 6 6 ILE H H 6 8.764 9.313 -0.549 1 1 40 . 17 1 1 A 6 6 ILE HA H 6 4.087 4.155 -0.068 1 1 49 . 17 1 1 A 6 6 ILE C C 6 174.679 175.569 -0.890 1 1 50 . 17 1 1 A 6 6 ILE CA C 6 61.279 61.704 -0.425 1 1 51 . 17 1 1 A 6 6 ILE CB C 6 39.651 37.781 1.870 1 1 54 . 17 1 1 A 6 6 ILE N N 6 123.050 126.090 -3.040 1 1 55 . 17 1 1 A 7 7 GLU H H 7 8.587 8.592 -0.005 1 1 56 . 17 1 1 A 7 7 GLU HA H 7 4.917 4.740 0.177 1 1 61 . 17 1 1 A 7 7 GLU C C 7 175.978 176.088 -0.110 1 1 62 . 17 1 1 A 7 7 GLU CA C 7 56.127 56.074 0.053 1 1 63 . 17 1 1 A 7 7 GLU CB C 7 31.115 30.310 0.805 1 1 65 . 17 1 1 A 7 7 GLU N N 7 127.415 128.106 -0.691 1 1 66 . 17 1 1 A 8 8 VAL H H 8 8.986 9.105 -0.119 1 1 67 . 17 1 1 A 8 8 VAL HA H 8 4.375 4.899 -0.524 1 1 72 . 17 1 1 A 8 8 VAL C C 8 173.704 175.088 -1.384 1 1 73 . 17 1 1 A 8 8 VAL CA C 8 61.347 60.929 0.418 1 1 74 . 17 1 1 A 8 8 VAL CB C 8 33.611 33.295 0.316 1 1 76 . 17 1 1 A 8 8 VAL N N 8 126.071 120.232 5.839 1 1 77 . 17 1 1 A 9 9 GLU H H 9 8.521 9.034 -0.513 1 1 78 . 17 1 1 A 9 9 GLU HA H 9 5.837 5.482 0.355 1 1 81 . 17 1 1 A 9 9 GLU C C 9 175.939 174.956 0.983 1 1 82 . 17 1 1 A 9 9 GLU CA C 9 54.516 54.456 0.060 1 1 83 . 17 1 1 A 9 9 GLU CB C 9 33.009 33.229 -0.220 1 1 84 . 17 1 1 A 9 9 GLU N N 9 122.857 124.062 -1.205 1 1 85 . 17 1 1 A 10 10 ARG H H 10 8.690 8.625 0.065 1 1 86 . 17 1 1 A 10 10 ARG HA H 10 4.709 5.244 -0.535 1 1 94 . 17 1 1 A 10 10 ARG C C 10 174.826 174.252 0.574 1 1 95 . 17 1 1 A 10 10 ARG CA C 10 54.491 54.325 0.166 1 1 96 . 17 1 1 A 10 10 ARG CB C 10 35.777 34.502 1.275 1 1 98 . 17 1 1 A 10 10 ARG N N 10 120.430 122.212 -1.782 1 1 100 . 17 1 1 A 11 11 LYS H H 11 8.874 8.837 0.037 1 1 101 . 17 1 1 A 11 11 LYS HA H 11 5.530 5.418 0.112 1 1 107 . 17 1 1 A 11 11 LYS C C 11 176.919 175.036 1.883 1 1 108 . 17 1 1 A 11 11 LYS CA C 11 55.084 54.594 0.490 1 1 109 . 17 1 1 A 11 11 LYS CB C 11 35.435 36.198 -0.763 1 1 113 . 17 1 1 A 11 11 LYS N N 11 121.087 123.030 -1.943 1 1 114 . 17 1 1 A 12 12 PHE H H 12 8.877 9.110 -0.233 1 1 115 . 17 1 1 A 12 12 PHE HA H 12 5.130 5.140 -0.010 1 1 120 . 17 1 1 A 12 12 PHE C C 12 171.676 172.149 -0.473 1 1 121 . 17 1 1 A 12 12 PHE CA C 12 55.869 56.291 -0.422 1 1 122 . 17 1 1 A 12 12 PHE CB C 12 42.108 41.844 0.264 1 1 125 . 17 1 1 A 12 12 PHE N N 12 117.486 120.021 -2.535 1 1 126 . 17 1 1 A 13 13 ALA H H 13 9.134 9.364 -0.230 1 1 127 . 17 1 1 A 13 13 ALA HA H 13 5.003 4.775 0.228 1 1 131 . 17 1 1 A 13 13 ALA CA C 13 48.340 49.001 -0.661 1 1 132 . 17 1 1 A 13 13 ALA CB C 13 19.191 20.171 -0.980 1 1 133 . 17 1 1 A 13 13 ALA N N 13 125.915 122.902 3.013 1 1 134 . 17 1 1 A 14 14 PRO HA H 14 4.620 4.986 -0.366 1 1 140 . 17 1 1 A 14 14 PRO C C 14 176.502 177.145 -0.643 1 1 141 . 17 1 1 A 14 14 PRO CA C 14 62.672 62.154 0.518 1 1 142 . 17 1 1 A 14 14 PRO CB C 14 33.119 32.835 0.284 1 1 145 . 17 1 1 A 15 15 GLY H H 15 8.721 8.220 0.501 1 1 146 . 17 1 1 A 15 15 GLY HA2 H 15 3.999 4.072 -0.073 1 1 147 . 17 1 1 A 15 15 GLY HA3 H 15 4.632 4.078 0.554 1 1 148 . 17 1 1 A 15 15 GLY CA C 15 44.411 43.965 0.446 1 1 149 . 17 1 1 A 15 15 GLY N N 15 109.863 108.248 1.615 1 1 150 . 17 1 1 A 16 16 PRO HA H 16 4.447 4.299 0.148 1 1 155 . 17 1 1 A 16 16 PRO C C 16 177.053 177.566 -0.513 1 1 156 . 17 1 1 A 16 16 PRO CA C 16 64.395 64.944 -0.549 1 1 157 . 17 1 1 A 16 16 PRO CB C 16 31.993 31.828 0.165 1 1 159 . 17 1 1 A 17 17 ASP H H 17 8.550 8.855 -0.305 1 1 160 . 17 1 1 A 17 17 ASP HA H 17 4.950 4.413 0.537 1 1 163 . 17 1 1 A 17 17 ASP C C 17 176.800 177.846 -1.046 1 1 164 . 17 1 1 A 17 17 ASP CA C 17 53.271 55.855 -2.584 1 1 165 . 17 1 1 A 17 17 ASP CB C 17 40.392 39.206 1.186 1 1 166 . 17 1 1 A 17 17 ASP N N 17 116.060 116.845 -0.785 1 1 167 . 17 1 1 A 18 18 THR H H 18 7.664 7.564 0.100 1 1 168 . 17 1 1 A 18 18 THR HA H 18 4.120 3.741 0.379 1 1 174 . 17 1 1 A 18 18 THR C C 18 175.407 176.002 -0.595 1 1 175 . 17 1 1 A 18 18 THR CA C 18 68.718 67.248 1.470 1 1 176 . 17 1 1 A 18 18 THR CB C 18 69.179 68.937 0.242 1 1 178 . 17 1 1 A 18 18 THR N N 18 117.158 115.765 1.393 1 1 179 . 17 1 1 A 19 19 GLU H H 19 8.817 7.774 1.043 1 1 180 . 17 1 1 A 19 19 GLU HA H 19 3.510 3.529 -0.019 1 1 184 . 17 1 1 A 19 19 GLU C C 19 178.345 178.978 -0.633 1 1 185 . 17 1 1 A 19 19 GLU CA C 19 61.237 58.959 2.278 1 1 186 . 17 1 1 A 19 19 GLU CB C 19 28.746 29.208 -0.462 1 1 188 . 17 1 1 A 19 19 GLU N N 19 118.802 120.853 -2.051 1 1 189 . 17 1 1 A 20 20 GLU H H 20 7.976 8.096 -0.120 1 1 190 . 17 1 1 A 20 20 GLU HA H 20 4.036 4.060 -0.024 1 1 194 . 17 1 1 A 20 20 GLU C C 20 179.451 179.098 0.353 1 1 195 . 17 1 1 A 20 20 GLU CA C 20 59.909 58.955 0.954 1 1 196 . 17 1 1 A 20 20 GLU CB C 20 28.992 29.372 -0.380 1 1 198 . 17 1 1 A 20 20 GLU N N 20 121.130 119.389 1.741 1 1 199 . 17 1 1 A 21 21 ARG H H 21 8.199 7.839 0.360 1 1 200 . 17 1 1 A 21 21 ARG HA H 21 4.061 3.981 0.080 1 1 207 . 17 1 1 A 21 21 ARG C C 21 179.087 178.691 0.396 1 1 208 . 17 1 1 A 21 21 ARG CA C 21 58.477 58.408 0.069 1 1 209 . 17 1 1 A 21 21 ARG CB C 21 30.101 30.321 -0.220 1 1 211 . 17 1 1 A 21 21 ARG N N 21 119.897 120.326 -0.429 1 1 213 . 17 1 1 A 22 22 LEU H H 22 8.154 8.418 -0.264 1 1 214 . 17 1 1 A 22 22 LEU HA H 22 3.560 3.742 -0.182 1 1 224 . 17 1 1 A 22 22 LEU C C 22 178.461 179.133 -0.672 1 1 225 . 17 1 1 A 22 22 LEU CA C 22 58.432 57.632 0.800 1 1 226 . 17 1 1 A 22 22 LEU CB C 22 40.229 40.913 -0.684 1 1 230 . 17 1 1 A 22 22 LEU N N 22 120.012 119.569 0.443 1 1 231 . 17 1 1 A 23 23 GLN H H 23 7.621 7.715 -0.094 1 1 232 . 17 1 1 A 23 23 GLN HA H 23 4.232 3.954 0.278 1 1 238 . 17 1 1 A 23 23 GLN C C 23 180.543 178.778 1.765 1 1 239 . 17 1 1 A 23 23 GLN CA C 23 59.434 59.030 0.404 1 1 240 . 17 1 1 A 23 23 GLN CB C 23 28.749 28.408 0.341 1 1 242 . 17 1 1 A 23 23 GLN N N 23 117.823 117.686 0.137 1 1 244 . 17 1 1 A 24 24 GLU H H 24 8.165 7.772 0.393 1 1 245 . 17 1 1 A 24 24 GLU HA H 24 4.072 4.065 0.007 1 1 249 . 17 1 1 A 24 24 GLU C C 24 178.612 178.598 0.014 1 1 250 . 17 1 1 A 24 24 GLU CA C 24 59.236 59.172 0.064 1 1 251 . 17 1 1 A 24 24 GLU CB C 24 29.606 29.076 0.530 1 1 253 . 17 1 1 A 24 24 GLU N N 24 122.589 119.819 2.770 1 1 254 . 17 1 1 A 25 25 LEU H H 25 7.911 7.778 0.133 1 1 255 . 17 1 1 A 25 25 LEU HA H 25 4.214 4.166 0.048 1 1 265 . 17 1 1 A 25 25 LEU C C 25 176.745 177.054 -0.309 1 1 266 . 17 1 1 A 25 25 LEU CA C 25 55.659 55.734 -0.075 1 1 267 . 17 1 1 A 25 25 LEU CB C 25 43.109 42.733 0.376 1 1 271 . 17 1 1 A 25 25 LEU N N 25 117.882 118.141 -0.259 1 1 272 . 17 1 1 A 26 26 GLY H H 26 7.776 7.906 -0.130 1 1 273 . 17 1 1 A 26 26 GLY HA2 H 26 4.337 4.032 0.305 1 1 274 . 17 1 1 A 26 26 GLY HA3 H 26 3.856 4.043 -0.187 1 1 275 . 17 1 1 A 26 26 GLY C C 26 175.456 174.515 0.941 1 1 276 . 17 1 1 A 26 26 GLY CA C 26 44.875 45.190 -0.315 1 1 277 . 17 1 1 A 26 26 GLY N N 26 104.938 105.755 -0.817 1 1 278 . 17 1 1 A 27 27 ALA H H 27 8.104 8.420 -0.316 1 1 279 . 17 1 1 A 27 27 ALA HA H 27 4.949 4.589 0.360 1 1 283 . 17 1 1 A 27 27 ALA C C 27 176.448 176.594 -0.146 1 1 284 . 17 1 1 A 27 27 ALA CA C 27 52.183 52.337 -0.154 1 1 285 . 17 1 1 A 27 27 ALA CB C 27 21.814 20.287 1.527 1 1 286 . 17 1 1 A 27 27 ALA N N 27 123.263 124.346 -1.083 1 1 287 . 17 1 1 A 28 28 THR H H 28 9.369 9.134 0.235 1 1 288 . 17 1 1 A 28 28 THR HA H 28 4.779 4.977 -0.198 1 1 293 . 17 1 1 A 28 28 THR C C 28 173.725 173.497 0.228 1 1 294 . 17 1 1 A 28 28 THR CA C 28 60.046 60.500 -0.454 1 1 295 . 17 1 1 A 28 28 THR CB C 28 70.592 71.110 -0.518 1 1 297 . 17 1 1 A 28 28 THR N N 28 112.201 116.878 -4.677 1 1 298 . 17 1 1 A 29 29 LEU H H 29 8.518 8.504 0.014 1 1 299 . 17 1 1 A 29 29 LEU HA H 29 3.332 3.634 -0.302 1 1 309 . 17 1 1 A 29 29 LEU C C 29 176.202 175.504 0.698 1 1 310 . 17 1 1 A 29 29 LEU CA C 29 55.031 54.226 0.805 1 1 311 . 17 1 1 A 29 29 LEU CB C 29 40.624 41.373 -0.749 1 1 315 . 17 1 1 A 29 29 LEU N N 29 128.151 129.032 -0.881 1 1 316 . 17 1 1 A 30 30 GLU H H 30 9.269 8.937 0.332 1 1 317 . 17 1 1 A 30 30 GLU HA H 30 4.287 4.064 0.223 1 1 321 . 17 1 1 A 30 30 GLU C C 30 176.740 175.995 0.745 1 1 322 . 17 1 1 A 30 30 GLU CA C 30 57.283 58.239 -0.956 1 1 323 . 17 1 1 A 30 30 GLU CB C 30 31.045 30.555 0.490 1 1 325 . 17 1 1 A 30 30 GLU N N 30 130.123 126.668 3.455 1 1 326 . 17 1 1 A 31 31 HIS H H 31 7.341 7.320 0.021 1 1 327 . 17 1 1 A 31 31 HIS HA H 31 4.701 5.060 -0.359 1 1 331 . 17 1 1 A 31 31 HIS C C 31 172.581 174.020 -1.439 1 1 332 . 17 1 1 A 31 31 HIS CA C 31 55.876 54.528 1.348 1 1 333 . 17 1 1 A 31 31 HIS CB C 31 33.434 33.944 -0.510 1 1 334 . 17 1 1 A 31 31 HIS N N 31 113.223 114.162 -0.939 1 1 335 . 17 1 1 A 32 32 ARG H H 32 8.196 8.891 -0.695 1 1 336 . 17 1 1 A 32 32 ARG HA H 32 5.262 5.415 -0.153 1 1 341 . 17 1 1 A 32 32 ARG C C 32 174.377 174.800 -0.423 1 1 342 . 17 1 1 A 32 32 ARG CA C 32 55.808 54.493 1.315 1 1 343 . 17 1 1 A 32 32 ARG CB C 32 33.340 33.859 -0.519 1 1 345 . 17 1 1 A 32 32 ARG N N 32 123.003 119.228 3.775 1 1 346 . 17 1 1 A 33 33 VAL H H 33 8.956 9.360 -0.404 1 1 347 . 17 1 1 A 33 33 VAL HA H 33 4.734 4.949 -0.215 1 1 355 . 17 1 1 A 33 33 VAL C C 33 172.821 175.136 -2.315 1 1 356 . 17 1 1 A 33 33 VAL CA C 33 60.197 59.996 0.201 1 1 357 . 17 1 1 A 33 33 VAL CB C 33 35.860 34.652 1.208 1 1 360 . 17 1 1 A 33 33 VAL N N 33 122.929 117.326 5.603 1 1 361 . 17 1 1 A 34 34 THR H H 34 8.250 8.853 -0.603 1 1 362 . 17 1 1 A 34 34 THR HA H 34 5.616 5.793 -0.177 1 1 367 . 17 1 1 A 34 34 THR C C 34 173.913 173.702 0.211 1 1 368 . 17 1 1 A 34 34 THR CA C 34 60.245 60.524 -0.279 1 1 369 . 17 1 1 A 34 34 THR CB C 34 71.706 70.983 0.723 1 1 371 . 17 1 1 A 34 34 THR N N 34 119.164 117.566 1.598 1 1 372 . 17 1 1 A 35 35 PHE H H 35 8.565 8.737 -0.172 1 1 373 . 17 1 1 A 35 35 PHE HA H 35 5.029 5.604 -0.575 1 1 378 . 17 1 1 A 35 35 PHE C C 35 173.193 172.182 1.011 1 1 379 . 17 1 1 A 35 35 PHE CA C 35 55.687 56.019 -0.332 1 1 380 . 17 1 1 A 35 35 PHE CB C 35 40.853 41.003 -0.150 1 1 383 . 17 1 1 A 35 35 PHE N N 35 120.244 118.552 1.692 1 1 384 . 17 1 1 A 36 36 ARG H H 36 8.869 8.354 0.515 1 1 385 . 17 1 1 A 36 36 ARG HA H 36 4.982 4.843 0.139 1 1 387 . 17 1 1 A 36 36 ARG C C 36 174.743 174.590 0.153 1 1 388 . 17 1 1 A 36 36 ARG CA C 36 55.493 54.725 0.768 1 1 389 . 17 1 1 A 36 36 ARG CB C 36 32.228 32.895 -0.667 1 1 390 . 17 1 1 A 36 36 ARG N N 36 123.893 119.300 4.593 1 1 391 . 17 1 1 A 37 37 ASP H H 37 8.402 9.013 -0.611 1 1 392 . 17 1 1 A 37 37 ASP HA H 37 5.462 5.249 0.213 1 1 395 . 17 1 1 A 37 37 ASP C C 37 175.177 175.194 -0.017 1 1 396 . 17 1 1 A 37 37 ASP CA C 37 53.942 53.119 0.823 1 1 397 . 17 1 1 A 37 37 ASP CB C 37 45.486 42.156 3.330 1 1 398 . 17 1 1 A 37 37 ASP N N 37 127.149 123.343 3.806 1 1 399 . 17 1 1 A 38 38 THR H H 38 8.151 8.841 -0.690 1 1 400 . 17 1 1 A 38 38 THR HA H 38 4.866 4.981 -0.115 1 1 405 . 17 1 1 A 38 38 THR C C 38 172.792 173.565 -0.773 1 1 406 . 17 1 1 A 38 38 THR CA C 38 61.416 61.595 -0.179 1 1 407 . 17 1 1 A 38 38 THR CB C 38 71.047 69.455 1.592 1 1 409 . 17 1 1 A 38 38 THR N N 38 115.686 120.388 -4.702 1 1 410 . 17 1 1 A 39 39 TYR H H 39 9.021 9.724 -0.703 1 1 411 . 17 1 1 A 39 39 TYR HA H 39 5.544 5.962 -0.418 1 1 416 . 17 1 1 A 39 39 TYR C C 39 176.032 174.699 1.333 1 1 417 . 17 1 1 A 39 39 TYR CA C 39 57.184 56.837 0.347 1 1 418 . 17 1 1 A 39 39 TYR CB C 39 41.642 41.126 0.516 1 1 420 . 17 1 1 A 39 39 TYR N N 39 124.579 126.528 -1.949 1 1 421 . 17 1 1 A 40 40 TYR H H 40 8.487 9.283 -0.796 1 1 422 . 17 1 1 A 40 40 TYR HA H 40 5.517 5.737 -0.220 1 1 426 . 17 1 1 A 40 40 TYR C C 40 174.108 174.161 -0.053 1 1 427 . 17 1 1 A 40 40 TYR CA C 40 56.979 56.567 0.412 1 1 428 . 17 1 1 A 40 40 TYR CB C 40 44.132 43.758 0.374 1 1 431 . 17 1 1 A 40 40 TYR N N 40 119.709 120.875 -1.166 1 1 432 . 17 1 1 A 41 41 ASP H H 41 9.341 8.887 0.454 1 1 433 . 17 1 1 A 41 41 ASP HA H 41 4.866 5.183 -0.317 1 1 436 . 17 1 1 A 41 41 ASP C C 41 177.262 174.706 2.556 1 1 437 . 17 1 1 A 41 41 ASP CA C 41 53.445 53.239 0.206 1 1 438 . 17 1 1 A 41 41 ASP CB C 41 45.347 44.667 0.680 1 1 439 . 17 1 1 A 41 41 ASP N N 41 117.995 120.916 -2.921 1 1 440 . 17 1 1 A 42 42 THR H H 42 11.574 8.675 2.899 1 1 441 . 17 1 1 A 42 42 THR HA H 42 5.206 4.464 0.742 1 1 446 . 17 1 1 A 42 42 THR C C 42 177.935 176.134 1.801 1 1 447 . 17 1 1 A 42 42 THR CA C 42 60.400 61.196 -0.796 1 1 448 . 17 1 1 A 42 42 THR CB C 42 72.114 70.714 1.400 1 1 450 . 17 1 1 A 42 42 THR N N 42 114.394 114.753 -0.359 1 1 451 . 17 1 1 A 43 43 SER H H 43 9.715 8.960 0.755 1 1 452 . 17 1 1 A 43 43 SER HA H 43 4.252 4.218 0.034 1 1 455 . 17 1 1 A 43 43 SER C C 43 175.478 175.638 -0.160 1 1 456 . 17 1 1 A 43 43 SER CA C 43 61.277 61.078 0.199 1 1 457 . 17 1 1 A 43 43 SER CB C 43 62.821 63.202 -0.381 1 1 458 . 17 1 1 A 43 43 SER N N 43 116.674 116.553 0.121 1 1 459 . 17 1 1 A 44 44 GLU H H 44 7.674 7.806 -0.132 1 1 460 . 17 1 1 A 44 44 GLU HA H 44 4.330 4.331 -0.001 1 1 464 . 17 1 1 A 44 44 GLU C C 44 175.001 176.063 -1.062 1 1 465 . 17 1 1 A 44 44 GLU CA C 44 55.992 56.446 -0.454 1 1 466 . 17 1 1 A 44 44 GLU CB C 44 29.276 30.068 -0.792 1 1 468 . 17 1 1 A 44 44 GLU N N 44 117.856 119.301 -1.445 1 1 469 . 17 1 1 A 45 45 LEU H H 45 8.222 7.829 0.393 1 1 470 . 17 1 1 A 45 45 LEU HA H 45 3.901 4.535 -0.634 1 1 480 . 17 1 1 A 45 45 LEU C C 45 175.209 176.862 -1.653 1 1 481 . 17 1 1 A 45 45 LEU CA C 45 55.548 56.226 -0.678 1 1 482 . 17 1 1 A 45 45 LEU CB C 45 38.458 41.782 -3.324 1 1 485 . 17 1 1 A 45 45 LEU N N 45 119.335 120.087 -0.752 1 1 486 . 17 1 1 A 46 46 SER H H 46 7.347 7.902 -0.555 1 1 487 . 17 1 1 A 46 46 SER HA H 46 3.954 4.063 -0.109 1 1 489 . 17 1 1 A 46 46 SER C C 46 177.497 176.166 1.331 1 1 490 . 17 1 1 A 46 46 SER CA C 46 62.471 62.519 -0.048 1 1 491 . 17 1 1 A 46 46 SER CB C 46 63.908 63.050 0.858 1 1 492 . 17 1 1 A 46 46 SER N N 46 111.433 113.963 -2.530 1 1 493 . 17 1 1 A 47 47 LEU H H 47 12.003 7.845 4.158 1 1 494 . 17 1 1 A 47 47 LEU HA H 47 3.959 4.081 -0.122 1 1 504 . 17 1 1 A 47 47 LEU C C 47 180.340 178.241 2.099 1 1 505 . 17 1 1 A 47 47 LEU CA C 47 58.879 57.816 1.063 1 1 506 . 17 1 1 A 47 47 LEU CB C 47 39.572 41.523 -1.951 1 1 510 . 17 1 1 A 47 47 LEU N N 47 124.605 122.367 2.238 1 1 511 . 17 1 1 A 48 48 MET H H 48 10.599 8.553 2.046 1 1 512 . 17 1 1 A 48 48 MET HA H 48 3.213 3.826 -0.613 1 1 520 . 17 1 1 A 48 48 MET C C 48 181.177 178.276 2.901 1 1 521 . 17 1 1 A 48 48 MET CA C 48 60.747 58.145 2.602 1 1 522 . 17 1 1 A 48 48 MET CB C 48 32.594 32.005 0.589 1 1 525 . 17 1 1 A 48 48 MET N N 48 126.254 119.103 7.151 1 1 526 . 17 1 1 A 49 49 LEU H H 49 8.731 7.629 1.102 1 1 527 . 17 1 1 A 49 49 LEU HA H 49 4.097 4.117 -0.020 1 1 536 . 17 1 1 A 49 49 LEU C C 49 178.144 177.271 0.873 1 1 537 . 17 1 1 A 49 49 LEU CA C 49 57.800 56.628 1.172 1 1 538 . 17 1 1 A 49 49 LEU CB C 49 41.379 41.710 -0.331 1 1 541 . 17 1 1 A 49 49 LEU N N 49 119.183 120.302 -1.119 1 1 542 . 17 1 1 A 50 50 SER H H 50 7.853 7.288 0.565 1 1 543 . 17 1 1 A 50 50 SER HA H 50 4.822 4.576 0.246 1 1 546 . 17 1 1 A 50 50 SER C C 50 174.539 173.400 1.139 1 1 547 . 17 1 1 A 50 50 SER CA C 50 57.811 58.221 -0.410 1 1 548 . 17 1 1 A 50 50 SER CB C 50 64.443 63.326 1.117 1 1 549 . 17 1 1 A 50 50 SER N N 50 114.594 112.562 2.032 1 1 550 . 17 1 1 A 51 51 ASP H H 51 8.264 7.848 0.416 1 1 551 . 17 1 1 A 51 51 ASP HA H 51 4.362 4.021 0.341 1 1 554 . 17 1 1 A 51 51 ASP C C 51 172.921 174.323 -1.402 1 1 555 . 17 1 1 A 51 51 ASP CA C 51 55.343 55.295 0.048 1 1 556 . 17 1 1 A 51 51 ASP CB C 51 40.583 40.434 0.149 1 1 557 . 17 1 1 A 51 51 ASP N N 51 123.003 119.830 3.173 1 1 558 . 17 1 1 A 52 52 HIS H H 52 7.869 7.324 0.545 1 1 559 . 17 1 1 A 52 52 HIS HA H 52 5.335 5.314 0.021 1 1 564 . 17 1 1 A 52 52 HIS C C 52 173.991 173.557 0.434 1 1 565 . 17 1 1 A 52 52 HIS CA C 52 55.889 53.540 2.349 1 1 566 . 17 1 1 A 52 52 HIS CB C 52 31.789 31.949 -0.160 1 1 568 . 17 1 1 A 52 52 HIS N N 52 112.486 117.389 -4.903 1 1 569 . 17 1 1 A 53 53 TRP H H 53 8.165 9.151 -0.986 1 1 570 . 17 1 1 A 53 53 TRP HA H 53 4.926 5.254 -0.328 1 1 578 . 17 1 1 A 53 53 TRP C C 53 175.354 175.000 0.354 1 1 579 . 17 1 1 A 53 53 TRP CA C 53 55.364 55.485 -0.121 1 1 580 . 17 1 1 A 53 53 TRP CB C 53 30.641 32.516 -1.875 1 1 585 . 17 1 1 A 53 53 TRP N N 53 117.916 121.787 -3.871 1 1 587 . 17 1 1 A 54 54 LEU H H 54 10.088 9.299 0.789 1 1 588 . 17 1 1 A 54 54 LEU HA H 54 5.497 5.360 0.137 1 1 598 . 17 1 1 A 54 54 LEU C C 54 173.337 175.354 -2.017 1 1 599 . 17 1 1 A 54 54 LEU CA C 54 54.408 54.235 0.173 1 1 600 . 17 1 1 A 54 54 LEU CB C 54 44.156 45.201 -1.045 1 1 604 . 17 1 1 A 54 54 LEU N N 54 130.826 126.503 4.323 1 1 605 . 17 1 1 A 55 55 ARG H H 55 9.289 9.546 -0.257 1 1 606 . 17 1 1 A 55 55 ARG HA H 55 5.482 5.548 -0.066 1 1 612 . 17 1 1 A 55 55 ARG C C 55 174.057 173.477 0.580 1 1 613 . 17 1 1 A 55 55 ARG CA C 55 53.167 54.164 -0.997 1 1 614 . 17 1 1 A 55 55 ARG CB C 55 34.270 34.126 0.144 1 1 616 . 17 1 1 A 55 55 ARG N N 55 125.089 127.936 -2.847 1 1 618 . 17 1 1 A 56 56 GLN H H 56 9.092 9.379 -0.287 1 1 619 . 17 1 1 A 56 56 GLN HA H 56 3.991 4.603 -0.612 1 1 626 . 17 1 1 A 56 56 GLN C C 56 174.199 174.251 -0.052 1 1 627 . 17 1 1 A 56 56 GLN CA C 56 54.566 53.718 0.848 1 1 628 . 17 1 1 A 56 56 GLN CB C 56 29.643 30.670 -1.027 1 1 630 . 17 1 1 A 56 56 GLN N N 56 124.355 125.965 -1.610 1 1 632 . 17 1 1 A 57 57 ARG H H 57 8.440 8.729 -0.289 1 1 633 . 17 1 1 A 57 57 ARG HA H 57 5.316 4.972 0.344 1 1 639 . 17 1 1 A 57 57 ARG C C 57 176.188 176.834 -0.646 1 1 640 . 17 1 1 A 57 57 ARG CA C 57 53.940 54.418 -0.478 1 1 641 . 17 1 1 A 57 57 ARG CB C 57 32.426 29.366 3.060 1 1 643 . 17 1 1 A 57 57 ARG N N 57 130.222 126.452 3.770 1 1 645 . 17 1 1 A 58 58 GLU H H 58 8.891 8.214 0.677 1 1 646 . 17 1 1 A 58 58 GLU HA H 58 3.996 3.989 0.007 1 1 649 . 17 1 1 A 58 58 GLU CA C 58 58.364 57.310 1.054 1 1 650 . 17 1 1 A 58 58 GLU CB C 58 30.875 27.313 3.562 1 1 651 . 17 1 1 A 58 58 GLU N N 58 131.208 123.643 7.565 1 1 652 . 17 1 1 A 59 59 GLY H H 59 8.367 8.353 0.014 1 1 653 . 17 1 1 A 59 59 GLY HA2 H 59 4.334 3.695 0.639 1 1 654 . 17 1 1 A 59 59 GLY HA3 H 59 3.743 3.792 -0.049 1 1 655 . 17 1 1 A 59 59 GLY C C 59 174.194 175.075 -0.881 1 1 656 . 17 1 1 A 59 59 GLY CA C 59 45.666 45.715 -0.049 1 1 657 . 17 1 1 A 60 60 SER H H 60 8.071 8.861 -0.790 1 1 658 . 17 1 1 A 60 60 SER HA H 60 4.730 4.536 0.194 1 1 661 . 17 1 1 A 60 60 SER C C 60 173.908 173.569 0.339 1 1 662 . 17 1 1 A 60 60 SER CA C 60 58.762 58.148 0.614 1 1 663 . 17 1 1 A 60 60 SER CB C 60 64.497 63.893 0.604 1 1 664 . 17 1 1 A 60 60 SER N N 60 114.636 114.431 0.205 1 1 665 . 17 1 1 A 61 61 GLY H H 61 8.401 7.071 1.330 1 1 666 . 17 1 1 A 61 61 GLY HA2 H 61 4.560 3.963 0.597 1 1 667 . 17 1 1 A 61 61 GLY HA3 H 61 3.878 4.012 -0.134 1 1 668 . 17 1 1 A 61 61 GLY C C 61 173.526 172.253 1.273 1 1 669 . 17 1 1 A 61 61 GLY CA C 61 44.906 45.260 -0.354 1 1 670 . 17 1 1 A 61 61 GLY N N 61 109.421 108.469 0.952 1 1 671 . 17 1 1 A 62 62 TRP H H 62 8.861 8.386 0.475 1 1 672 . 17 1 1 A 62 62 TRP HA H 62 5.089 5.499 -0.410 1 1 681 . 17 1 1 A 62 62 TRP C C 62 176.168 175.770 0.398 1 1 682 . 17 1 1 A 62 62 TRP CA C 62 57.459 56.965 0.494 1 1 683 . 17 1 1 A 62 62 TRP CB C 62 32.536 31.442 1.094 1 1 689 . 17 1 1 A 62 62 TRP N N 62 122.939 121.434 1.505 1 1 691 . 17 1 1 A 63 63 GLU H H 63 9.306 9.580 -0.274 1 1 692 . 17 1 1 A 63 63 GLU HA H 63 4.919 5.706 -0.787 1 1 697 . 17 1 1 A 63 63 GLU C C 63 173.770 175.074 -1.304 1 1 698 . 17 1 1 A 63 63 GLU CA C 63 55.953 55.170 0.783 1 1 699 . 17 1 1 A 63 63 GLU CB C 63 35.317 34.066 1.251 1 1 701 . 17 1 1 A 63 63 GLU N N 63 120.136 121.775 -1.639 1 1 702 . 17 1 1 A 64 64 LEU H H 64 8.998 9.111 -0.113 1 1 703 . 17 1 1 A 64 64 LEU HA H 64 5.616 5.466 0.150 1 1 712 . 17 1 1 A 64 64 LEU C C 64 175.014 174.009 1.005 1 1 713 . 17 1 1 A 64 64 LEU CA C 64 52.945 53.747 -0.802 1 1 714 . 17 1 1 A 64 64 LEU CB C 64 46.904 46.037 0.867 1 1 717 . 17 1 1 A 64 64 LEU N N 64 127.321 126.064 1.257 1 1 718 . 17 1 1 A 65 65 LYS H H 65 9.322 10.233 -0.911 1 1 719 . 17 1 1 A 65 65 LYS HA H 65 5.347 5.252 0.095 1 1 727 . 17 1 1 A 65 65 LYS C C 65 175.811 175.431 0.380 1 1 728 . 17 1 1 A 65 65 LYS CA C 65 55.817 55.595 0.222 1 1 729 . 17 1 1 A 65 65 LYS CB C 65 34.521 34.769 -0.248 1 1 733 . 17 1 1 A 65 65 LYS N N 65 129.874 128.539 1.335 1 1 734 . 17 1 1 A 66 66 CYS H H 66 9.129 8.929 0.200 1 1 735 . 17 1 1 A 66 66 CYS HA H 66 5.319 4.882 0.437 1 1 738 . 17 1 1 A 66 66 CYS CA C 66 54.532 56.540 -2.008 1 1 739 . 17 1 1 A 66 66 CYS CB C 66 28.813 30.042 -1.229 1 1 740 . 17 1 1 A 66 66 CYS N N 66 121.497 124.734 -3.237 1 1 741 . 17 1 1 A 67 67 PRO HA H 67 4.439 3.992 0.447 1 1 748 . 17 1 1 A 67 67 PRO C C 67 177.297 177.134 0.163 1 1 749 . 17 1 1 A 67 67 PRO CA C 67 63.596 64.665 -1.069 1 1 750 . 17 1 1 A 67 67 PRO CB C 67 32.242 31.700 0.542 1 1 752 . 17 1 1 A 68 68 GLY H H 68 8.316 7.743 0.573 1 1 753 . 17 1 1 A 68 68 GLY HA2 H 68 3.726 3.978 -0.252 1 1 754 . 17 1 1 A 68 68 GLY HA3 H 68 4.095 4.026 0.069 1 1 755 . 17 1 1 A 68 68 GLY C C 68 173.789 174.601 -0.812 1 1 756 . 17 1 1 A 68 68 GLY CA C 68 45.227 45.414 -0.187 1 1 757 . 17 1 1 A 68 68 GLY N N 68 109.533 108.398 1.135 1 1 758 . 17 1 1 A 69 69 VAL H H 69 8.114 7.717 0.397 1 1 759 . 17 1 1 A 69 69 VAL HA H 69 4.266 4.219 0.047 1 1 764 . 17 1 1 A 69 69 VAL C C 69 176.299 176.274 0.025 1 1 765 . 17 1 1 A 69 69 VAL CA C 69 61.945 61.489 0.456 1 1 766 . 17 1 1 A 69 69 VAL CB C 69 33.082 32.453 0.629 1 1 768 . 17 1 1 A 69 69 VAL N N 69 118.540 119.445 -0.905 1 1 769 . 17 1 1 A 70 70 THR H H 70 8.324 8.637 -0.313 1 1 770 . 17 1 1 A 70 70 THR HA H 70 4.373 3.928 0.445 1 1 775 . 17 1 1 A 70 70 THR C C 70 175.204 176.979 -1.775 1 1 776 . 17 1 1 A 70 70 THR CA C 70 62.309 66.368 -4.059 1 1 777 . 17 1 1 A 70 70 THR CB C 70 69.787 68.854 0.933 1 1 779 . 17 1 1 A 70 70 THR N N 70 117.636 119.250 -1.614 1 1 780 . 17 1 1 A 71 71 GLY H H 71 8.574 7.997 0.577 1 1 781 . 17 1 1 A 71 71 GLY HA2 H 71 4.096 3.948 0.148 1 1 782 . 17 1 1 A 71 71 GLY HA3 H 71 3.975 3.963 0.012 1 1 783 . 17 1 1 A 71 71 GLY C C 71 174.313 173.593 0.720 1 1 784 . 17 1 1 A 71 71 GLY CA C 71 45.545 45.322 0.223 1 1 785 . 17 1 1 A 71 71 GLY N N 71 111.677 108.137 3.540 1 1 786 . 17 1 1 A 72 72 VAL H H 72 7.945 7.913 0.032 1 1 787 . 17 1 1 A 72 72 VAL HA H 72 4.258 3.860 0.398 1 1 795 . 17 1 1 A 72 72 VAL C C 72 176.162 175.862 0.300 1 1 796 . 17 1 1 A 72 72 VAL CA C 72 62.227 62.530 -0.303 1 1 797 . 17 1 1 A 72 72 VAL CB C 72 32.997 30.026 2.971 1 1 799 . 17 1 1 A 72 72 VAL N N 72 118.647 115.828 2.819 1 1 800 . 17 1 1 A 73 73 SER H H 73 8.498 8.265 0.233 1 1 801 . 17 1 1 A 73 73 SER HA H 73 4.617 4.620 -0.003 1 1 803 . 17 1 1 A 73 73 SER C C 73 174.461 174.445 0.016 1 1 804 . 17 1 1 A 73 73 SER CA C 73 58.218 59.484 -1.266 1 1 805 . 17 1 1 A 73 73 SER CB C 73 64.061 63.735 0.326 1 1 806 . 17 1 1 A 73 73 SER N N 73 118.828 118.656 0.172 1 1 807 . 17 1 1 A 74 74 GLY H H 74 8.247 7.363 0.884 1 1 808 . 17 1 1 A 74 74 GLY HA2 H 74 4.101 4.114 -0.013 1 1 809 . 17 1 1 A 74 74 GLY HA3 H 74 4.304 4.124 0.180 1 1 810 . 17 1 1 A 74 74 GLY CA C 74 44.896 45.218 -0.322 1 1 811 . 17 1 1 A 74 74 GLY N N 74 111.138 106.471 4.667 1 1 812 . 17 1 1 A 75 75 PRO HA H 75 4.461 4.375 0.086 1 1 819 . 17 1 1 A 75 75 PRO C C 75 176.798 176.461 0.337 1 1 820 . 17 1 1 A 75 75 PRO CA C 75 63.466 62.403 1.063 1 1 821 . 17 1 1 A 75 75 PRO CB C 75 31.980 32.471 -0.491 1 1 824 . 17 1 1 A 76 76 HIS H H 76 8.397 8.425 -0.028 1 1 825 . 17 1 1 A 76 76 HIS HA H 76 4.742 3.975 0.767 1 1 829 . 17 1 1 A 76 76 HIS C C 76 174.282 173.505 0.777 1 1 830 . 17 1 1 A 76 76 HIS CA C 76 55.579 57.114 -1.535 1 1 831 . 17 1 1 A 76 76 HIS CB C 76 30.501 26.797 3.704 1 1 832 . 17 1 1 A 76 76 HIS N N 76 118.431 115.012 3.419 1 1 833 . 17 1 1 A 77 77 ASN H H 77 8.364 7.898 0.466 1 1 834 . 17 1 1 A 77 77 ASN HA H 77 4.767 5.173 -0.406 1 1 839 . 17 1 1 A 77 77 ASN C C 77 174.576 173.451 1.125 1 1 840 . 17 1 1 A 77 77 ASN CA C 77 53.139 51.322 1.817 1 1 841 . 17 1 1 A 77 77 ASN CB C 77 39.320 40.195 -0.875 1 1 842 . 17 1 1 A 77 77 ASN N N 77 119.421 115.380 4.041 1 1 844 . 17 1 1 A 78 78 GLU H H 78 8.683 8.893 -0.210 1 1 845 . 17 1 1 A 78 78 GLU HA H 78 4.409 4.791 -0.382 1 1 850 . 17 1 1 A 78 78 GLU C C 78 175.791 176.299 -0.508 1 1 851 . 17 1 1 A 78 78 GLU CA C 78 56.359 55.112 1.247 1 1 852 . 17 1 1 A 78 78 GLU CB C 78 30.818 31.418 -0.600 1 1 854 . 17 1 1 A 78 78 GLU N N 78 122.085 124.129 -2.044 1 1 855 . 17 1 1 A 79 79 TYR H H 79 8.341 8.732 -0.391 1 1 856 . 17 1 1 A 79 79 TYR HA H 79 4.988 4.760 0.228 1 1 861 . 17 1 1 A 79 79 TYR C C 79 175.837 175.821 0.016 1 1 862 . 17 1 1 A 79 79 TYR CA C 79 58.028 59.444 -1.416 1 1 863 . 17 1 1 A 79 79 TYR CB C 79 41.672 38.814 2.858 1 1 866 . 17 1 1 A 79 79 TYR N N 79 119.452 121.766 -2.314 1 1 867 . 17 1 1 A 80 80 VAL H H 80 9.366 8.995 0.371 1 1 868 . 17 1 1 A 80 80 VAL HA H 80 4.370 4.956 -0.586 1 1 873 . 17 1 1 A 80 80 VAL C C 80 174.948 174.893 0.055 1 1 874 . 17 1 1 A 80 80 VAL CA C 80 61.190 60.526 0.664 1 1 875 . 17 1 1 A 80 80 VAL CB C 80 34.204 33.532 0.672 1 1 877 . 17 1 1 A 80 80 VAL N N 80 120.567 119.420 1.147 1 1 878 . 17 1 1 A 81 81 GLU H H 81 8.570 9.040 -0.470 1 1 879 . 17 1 1 A 81 81 GLU HA H 81 4.770 5.382 -0.612 1 1 883 . 17 1 1 A 81 81 GLU C C 81 175.491 175.488 0.003 1 1 884 . 17 1 1 A 81 81 GLU CA C 81 55.655 54.991 0.664 1 1 885 . 17 1 1 A 81 81 GLU CB C 81 30.415 31.892 -1.477 1 1 887 . 17 1 1 A 81 81 GLU N N 81 124.248 125.208 -0.960 1 1 888 . 17 1 1 A 82 82 VAL H H 82 9.189 9.218 -0.029 1 1 889 . 17 1 1 A 82 82 VAL HA H 82 4.279 4.165 0.114 1 1 894 . 17 1 1 A 82 82 VAL C C 82 176.087 176.662 -0.575 1 1 895 . 17 1 1 A 82 82 VAL CA C 82 62.672 63.238 -0.566 1 1 896 . 17 1 1 A 82 82 VAL CB C 82 33.121 31.654 1.467 1 1 898 . 17 1 1 A 82 82 VAL N N 82 127.776 125.524 2.252 1 1 899 . 17 1 1 A 83 83 THR H H 83 8.590 8.713 -0.123 1 1 900 . 17 1 1 A 83 83 THR HA H 83 4.955 4.607 0.348 1 1 905 . 17 1 1 A 83 83 THR C C 83 174.688 174.958 -0.270 1 1 906 . 17 1 1 A 83 83 THR CA C 83 61.332 61.800 -0.468 1 1 907 . 17 1 1 A 83 83 THR CB C 83 70.213 70.075 0.138 1 1 909 . 17 1 1 A 83 83 THR N N 83 114.744 118.816 -4.072 1 1 910 . 17 1 1 A 84 84 SER H H 84 7.650 7.886 -0.236 1 1 911 . 17 1 1 A 84 84 SER HA H 84 4.819 4.450 0.369 1 1 914 . 17 1 1 A 84 84 SER CA C 84 56.280 57.681 -1.401 1 1 915 . 17 1 1 A 84 84 SER CB C 84 63.294 63.929 -0.635 1 1 916 . 17 1 1 A 84 84 SER N N 84 118.038 117.800 0.238 1 1 917 . 17 1 1 A 85 85 GLU H H 85 8.391 8.903 -0.512 1 1 918 . 17 1 1 A 85 85 GLU HA H 85 3.661 4.012 -0.351 1 1 923 . 17 1 1 A 85 85 GLU C C 85 177.520 178.631 -1.111 1 1 924 . 17 1 1 A 85 85 GLU CA C 85 62.429 59.758 2.671 1 1 925 . 17 1 1 A 85 85 GLU CB C 85 29.655 29.351 0.304 1 1 927 . 17 1 1 A 86 86 ALA H H 86 8.443 8.181 0.262 1 1 928 . 17 1 1 A 86 86 ALA HA H 86 4.027 4.060 -0.033 1 1 932 . 17 1 1 A 86 86 ALA C C 86 180.423 180.019 0.404 1 1 933 . 17 1 1 A 86 86 ALA CA C 86 55.145 54.904 0.241 1 1 934 . 17 1 1 A 86 86 ALA CB C 86 18.165 18.094 0.071 1 1 935 . 17 1 1 A 86 86 ALA N N 86 119.636 123.317 -3.681 1 1 936 . 17 1 1 A 87 87 ALA H H 87 7.214 7.404 -0.190 1 1 937 . 17 1 1 A 87 87 ALA HA H 87 4.244 4.048 0.196 1 1 941 . 17 1 1 A 87 87 ALA C C 87 180.354 179.699 0.655 1 1 942 . 17 1 1 A 87 87 ALA CA C 87 54.378 54.875 -0.497 1 1 943 . 17 1 1 A 87 87 ALA CB C 87 18.795 18.471 0.324 1 1 944 . 17 1 1 A 87 87 ALA N N 87 121.004 120.593 0.411 1 1 945 . 17 1 1 A 88 88 ILE H H 88 8.471 7.586 0.885 1 1 946 . 17 1 1 A 88 88 ILE HA H 88 3.360 3.621 -0.261 1 1 954 . 17 1 1 A 88 88 ILE CA C 88 66.323 64.972 1.351 1 1 955 . 17 1 1 A 88 88 ILE CB C 88 37.808 37.724 0.084 1 1 958 . 17 1 1 A 88 88 ILE N N 88 120.743 120.044 0.699 1 1 959 . 17 1 1 A 89 89 VAL H H 89 8.343 8.333 0.010 1 1 960 . 17 1 1 A 89 89 VAL HA H 89 3.061 3.506 -0.445 1 1 968 . 17 1 1 A 89 89 VAL C C 89 176.708 177.989 -1.281 1 1 969 . 17 1 1 A 89 89 VAL CA C 89 67.833 66.546 1.287 1 1 970 . 17 1 1 A 89 89 VAL CB C 89 31.509 31.377 0.132 1 1 973 . 17 1 1 A 89 89 VAL N N 89 118.049 119.617 -1.568 1 1 974 . 17 1 1 A 90 90 ALA H H 90 7.516 8.047 -0.531 1 1 975 . 17 1 1 A 90 90 ALA HA H 90 3.987 3.905 0.082 1 1 979 . 17 1 1 A 90 90 ALA C C 90 180.744 179.965 0.779 1 1 980 . 17 1 1 A 90 90 ALA CA C 90 55.481 55.707 -0.226 1 1 981 . 17 1 1 A 90 90 ALA CB C 90 17.953 18.248 -0.295 1 1 982 . 17 1 1 A 90 90 ALA N N 90 118.935 122.193 -3.258 1 1 983 . 17 1 1 A 91 91 GLN H H 91 7.886 8.449 -0.563 1 1 984 . 17 1 1 A 91 91 GLN HA H 91 4.190 3.956 0.234 1 1 991 . 17 1 1 A 91 91 GLN C C 91 178.832 178.682 0.150 1 1 992 . 17 1 1 A 91 91 GLN CA C 91 58.519 59.044 -0.525 1 1 993 . 17 1 1 A 91 91 GLN CB C 91 28.091 28.089 0.002 1 1 995 . 17 1 1 A 91 91 GLN N N 91 117.846 117.670 0.176 1 1 997 . 17 1 1 A 92 92 LEU H H 92 8.751 8.747 0.004 1 1 998 . 17 1 1 A 92 92 LEU HA H 92 3.903 3.988 -0.085 1 1 1007 . 17 1 1 A 92 92 LEU C C 92 178.997 179.149 -0.152 1 1 1008 . 17 1 1 A 92 92 LEU CA C 92 58.136 57.959 0.177 1 1 1009 . 17 1 1 A 92 92 LEU CB C 92 41.576 41.700 -0.124 1 1 1013 . 17 1 1 A 92 92 LEU N N 92 119.547 119.258 0.289 1 1 1014 . 17 1 1 A 93 93 PHE H H 93 8.648 8.046 0.602 1 1 1015 . 17 1 1 A 93 93 PHE HA H 93 4.270 4.189 0.081 1 1 1020 . 17 1 1 A 93 93 PHE C C 93 179.283 178.744 0.539 1 1 1021 . 17 1 1 A 93 93 PHE CA C 93 59.860 60.447 -0.587 1 1 1022 . 17 1 1 A 93 93 PHE CB C 93 37.765 38.696 -0.931 1 1 1025 . 17 1 1 A 93 93 PHE N N 93 118.041 118.765 -0.724 1 1 1026 . 17 1 1 A 94 94 GLU H H 94 7.739 8.376 -0.637 1 1 1027 . 17 1 1 A 94 94 GLU HA H 94 4.110 4.132 -0.022 1 1 1031 . 17 1 1 A 94 94 GLU C C 94 178.629 179.035 -0.406 1 1 1032 . 17 1 1 A 94 94 GLU CA C 94 59.359 59.361 -0.002 1 1 1033 . 17 1 1 A 94 94 GLU CB C 94 29.589 29.178 0.411 1 1 1035 . 17 1 1 A 94 94 GLU N N 94 119.980 117.453 2.527 1 1 1036 . 17 1 1 A 95 95 LEU H H 95 7.999 8.639 -0.640 1 1 1037 . 17 1 1 A 95 95 LEU HA H 95 4.139 3.909 0.230 1 1 1047 . 17 1 1 A 95 95 LEU C C 95 178.965 178.568 0.397 1 1 1048 . 17 1 1 A 95 95 LEU CA C 95 57.557 57.816 -0.259 1 1 1049 . 17 1 1 A 95 95 LEU CB C 95 43.443 41.575 1.868 1 1 1053 . 17 1 1 A 95 95 LEU N N 95 118.398 121.301 -2.903 1 1 1054 . 17 1 1 A 96 96 LEU H H 96 8.363 7.933 0.430 1 1 1055 . 17 1 1 A 96 96 LEU HA H 96 4.503 4.242 0.261 1 1 1061 . 17 1 1 A 96 96 LEU C C 96 177.932 177.169 0.763 1 1 1062 . 17 1 1 A 96 96 LEU CA C 96 54.700 55.038 -0.338 1 1 1063 . 17 1 1 A 96 96 LEU CB C 96 43.048 42.453 0.595 1 1 1065 . 17 1 1 A 96 96 LEU N N 96 114.720 116.510 -1.790 1 1 1066 . 17 1 1 A 97 97 GLY H H 97 7.810 7.899 -0.089 1 1 1067 . 17 1 1 A 97 97 GLY HA2 H 97 3.963 3.887 0.076 1 1 1068 . 17 1 1 A 97 97 GLY C C 97 173.535 174.257 -0.722 1 1 1069 . 17 1 1 A 97 97 GLY CA C 97 45.667 46.416 -0.749 1 1 1070 . 17 1 1 A 97 97 GLY N N 97 109.511 106.803 2.708 1 1 1071 . 17 1 1 A 98 98 SER H H 98 8.131 7.908 0.223 1 1 1072 . 17 1 1 A 98 98 SER HA H 98 4.225 4.621 -0.396 1 1 1075 . 17 1 1 A 98 98 SER C C 98 174.974 174.273 0.701 1 1 1076 . 17 1 1 A 98 98 SER CA C 98 57.960 57.678 0.282 1 1 1077 . 17 1 1 A 98 98 SER CB C 98 63.997 64.559 -0.562 1 1 1078 . 17 1 1 A 98 98 SER N N 98 113.405 114.970 -1.565 1 1 1079 . 17 1 1 A 99 99 GLY H H 99 8.052 9.062 -1.010 1 1 1080 . 17 1 1 A 99 99 GLY HA2 H 99 3.998 3.932 0.066 1 1 1081 . 17 1 1 A 99 99 GLY HA3 H 99 3.778 3.964 -0.186 1 1 1082 . 17 1 1 A 99 99 GLY C C 99 174.033 173.271 0.762 1 1 1083 . 17 1 1 A 99 99 GLY CA C 99 45.123 46.360 -1.237 1 1 1084 . 17 1 1 A 99 99 GLY N N 99 111.534 113.945 -2.411 1 1 1085 . 17 1 1 A 100 100 GLU H H 100 8.177 7.878 0.299 1 1 1086 . 17 1 1 A 100 100 GLU HA H 100 4.201 4.825 -0.624 1 1 1091 . 17 1 1 A 100 100 GLU C C 100 175.830 176.101 -0.271 1 1 1092 . 17 1 1 A 100 100 GLU CA C 100 56.442 54.596 1.846 1 1 1093 . 17 1 1 A 100 100 GLU CB C 100 30.428 32.017 -1.589 1 1 1095 . 17 1 1 A 100 100 GLU N N 100 120.463 118.174 2.289 1 1 1096 . 17 1 1 A 101 101 GLN H H 101 8.161 8.384 -0.223 1 1 1097 . 17 1 1 A 101 101 GLN HA H 101 4.098 4.213 -0.115 1 1 1103 . 17 1 1 A 101 101 GLN C C 101 175.412 175.446 -0.034 1 1 1104 . 17 1 1 A 101 101 GLN CA C 101 55.632 55.909 -0.277 1 1 1105 . 17 1 1 A 101 101 GLN CB C 101 29.569 28.979 0.590 1 1 1107 . 17 1 1 A 101 101 GLN N N 101 120.014 121.225 -1.211 1 1 1109 . 17 1 1 A 102 102 LYS H H 102 8.235 8.471 -0.236 1 1 1110 . 17 1 1 A 102 102 LYS HA H 102 4.387 3.801 0.586 1 1 1117 . 17 1 1 A 102 102 LYS CA C 102 54.116 54.345 -0.229 1 1 1118 . 17 1 1 A 102 102 LYS CB C 102 32.478 32.257 0.221 1 1 1122 . 17 1 1 A 102 102 LYS N N 102 123.399 122.385 1.014 1 1 1123 . 17 1 1 A 103 103 PRO HA H 103 4.498 4.351 0.147 1 1 1129 . 17 1 1 A 103 103 PRO C C 103 175.473 177.178 -1.705 1 1 1130 . 17 1 1 A 103 103 PRO CA C 103 62.802 66.062 -3.260 1 1 1131 . 17 1 1 A 103 103 PRO CB C 103 32.124 31.544 0.580 1 1 1134 . 17 1 1 A 104 104 ALA H H 104 8.017 7.314 0.703 1 1 1135 . 17 1 1 A 104 104 ALA HA H 104 4.318 4.389 -0.071 1 1 1139 . 17 1 1 A 104 104 ALA C C 104 176.717 176.819 -0.102 1 1 1140 . 17 1 1 A 104 104 ALA CA C 104 52.194 53.343 -1.149 1 1 1141 . 17 1 1 A 104 104 ALA CB C 104 20.113 20.516 -0.403 1 1 1142 . 17 1 1 A 104 104 ALA N N 104 122.093 118.692 3.401 1 1 1143 . 17 1 1 A 105 105 GLY H H 105 7.678 8.081 -0.403 1 1 1144 . 17 1 1 A 105 105 GLY HA2 H 105 3.851 4.132 -0.281 1 1 1145 . 17 1 1 A 105 105 GLY HA3 H 105 4.053 4.156 -0.103 1 1 1146 . 17 1 1 A 105 105 GLY C C 105 172.990 174.858 -1.868 1 1 1147 . 17 1 1 A 105 105 GLY CA C 105 44.241 43.612 0.629 1 1 1148 . 17 1 1 A 105 105 GLY N N 105 105.234 103.881 1.353 1 1 1149 . 17 1 1 A 106 106 VAL H H 106 8.409 8.852 -0.443 1 1 1150 . 17 1 1 A 106 106 VAL HA H 106 2.829 3.329 -0.500 1 1 1158 . 17 1 1 A 106 106 VAL C C 106 177.822 177.158 0.664 1 1 1159 . 17 1 1 A 106 106 VAL CA C 106 65.522 65.466 0.056 1 1 1160 . 17 1 1 A 106 106 VAL CB C 106 30.701 30.537 0.164 1 1 1163 . 17 1 1 A 106 106 VAL N N 106 119.215 119.163 0.052 1 1 1164 . 17 1 1 A 107 107 ALA H H 107 8.707 8.415 0.292 1 1 1165 . 17 1 1 A 107 107 ALA HA H 107 3.730 3.893 -0.163 1 1 1169 . 17 1 1 A 107 107 ALA C C 107 179.661 180.073 -0.412 1 1 1170 . 17 1 1 A 107 107 ALA CA C 107 54.995 55.567 -0.572 1 1 1171 . 17 1 1 A 107 107 ALA CB C 107 17.705 17.940 -0.235 1 1 1172 . 17 1 1 A 107 107 ALA N N 107 118.672 122.142 -3.470 1 1 1173 . 17 1 1 A 108 108 ALA H H 108 7.388 7.793 -0.405 1 1 1174 . 17 1 1 A 108 108 ALA HA H 108 4.259 4.027 0.232 1 1 1178 . 17 1 1 A 108 108 ALA C C 108 179.318 179.347 -0.029 1 1 1179 . 17 1 1 A 108 108 ALA CA C 108 53.481 55.078 -1.597 1 1 1180 . 17 1 1 A 108 108 ALA CB C 108 19.367 18.599 0.768 1 1 1181 . 17 1 1 A 108 108 ALA N N 108 116.635 121.184 -4.549 1 1 1182 . 17 1 1 A 109 109 VAL H H 109 7.689 7.618 0.071 1 1 1183 . 17 1 1 A 109 109 VAL HA H 109 4.532 3.826 0.706 1 1 1191 . 17 1 1 A 109 109 VAL C C 109 176.055 177.980 -1.925 1 1 1192 . 17 1 1 A 109 109 VAL CA C 109 61.452 65.682 -4.230 1 1 1193 . 17 1 1 A 109 109 VAL CB C 109 32.728 31.327 1.401 1 1 1196 . 17 1 1 A 109 109 VAL N N 109 112.851 117.124 -4.273 1 1 1197 . 17 1 1 A 110 110 LEU H H 110 7.099 8.282 -1.183 1 1 1198 . 17 1 1 A 110 110 LEU HA H 110 3.723 3.799 -0.076 1 1 1208 . 17 1 1 A 110 110 LEU C C 110 179.040 178.840 0.200 1 1 1209 . 17 1 1 A 110 110 LEU CA C 110 58.825 57.865 0.960 1 1 1210 . 17 1 1 A 110 110 LEU CB C 110 41.242 41.760 -0.518 1 1 1214 . 17 1 1 A 110 110 LEU N N 110 119.829 125.000 -5.171 1 1 1215 . 17 1 1 A 111 111 GLY H H 111 8.435 7.827 0.608 1 1 1216 . 17 1 1 A 111 111 GLY HA2 H 111 3.970 3.846 0.124 1 1 1217 . 17 1 1 A 111 111 GLY HA3 H 111 3.885 3.853 0.032 1 1 1218 . 17 1 1 A 111 111 GLY C C 111 178.031 176.584 1.447 1 1 1219 . 17 1 1 A 111 111 GLY CA C 111 46.961 47.551 -0.590 1 1 1220 . 17 1 1 A 111 111 GLY N N 111 104.089 106.575 -2.486 1 1 1221 . 17 1 1 A 112 112 SER H H 112 8.343 8.265 0.078 1 1 1222 . 17 1 1 A 112 112 SER HA H 112 4.266 4.163 0.103 1 1 1224 . 17 1 1 A 112 112 SER C C 112 175.885 175.651 0.234 1 1 1225 . 17 1 1 A 112 112 SER CA C 112 61.304 62.582 -1.278 1 1 1226 . 17 1 1 A 112 112 SER CB C 112 62.901 63.084 -0.183 1 1 1227 . 17 1 1 A 112 112 SER N N 112 119.497 119.582 -0.085 1 1 1228 . 17 1 1 A 113 113 LEU H H 113 7.667 8.236 -0.569 1 1 1229 . 17 1 1 A 113 113 LEU HA H 113 4.343 4.155 0.188 1 1 1238 . 17 1 1 A 113 113 LEU C C 113 174.760 175.870 -1.110 1 1 1239 . 17 1 1 A 113 113 LEU CA C 113 54.228 54.765 -0.537 1 1 1240 . 17 1 1 A 113 113 LEU CB C 113 41.467 42.309 -0.842 1 1 1244 . 17 1 1 A 113 113 LEU N N 113 118.843 118.022 0.821 1 1 1245 . 17 1 1 A 114 114 LYS H H 114 7.685 7.888 -0.203 1 1 1246 . 17 1 1 A 114 114 LYS HA H 114 3.958 3.825 0.133 1 1 1250 . 17 1 1 A 114 114 LYS C C 114 177.557 175.738 1.819 1 1 1251 . 17 1 1 A 114 114 LYS CA C 114 56.935 57.297 -0.362 1 1 1252 . 17 1 1 A 114 114 LYS CB C 114 28.898 29.527 -0.629 1 1 1254 . 17 1 1 A 114 114 LYS N N 114 114.072 116.602 -2.530 1 1 1255 . 17 1 1 A 115 115 LEU H H 115 8.329 7.664 0.665 1 1 1256 . 17 1 1 A 115 115 LEU HA H 115 4.315 4.479 -0.164 1 1 1265 . 17 1 1 A 115 115 LEU C C 115 175.988 176.508 -0.520 1 1 1266 . 17 1 1 A 115 115 LEU CA C 115 54.310 54.571 -0.261 1 1 1267 . 17 1 1 A 115 115 LEU CB C 115 44.163 42.536 1.627 1 1 1270 . 17 1 1 A 115 115 LEU N N 115 117.951 119.376 -1.425 1 1 1271 . 17 1 1 A 116 116 GLN H H 116 9.100 9.534 -0.434 1 1 1272 . 17 1 1 A 116 116 GLN HA H 116 4.898 5.029 -0.131 1 1 1279 . 17 1 1 A 116 116 GLN CA C 116 53.467 53.933 -0.466 1 1 1280 . 17 1 1 A 116 116 GLN CB C 116 32.730 32.268 0.462 1 1 1282 . 17 1 1 A 116 116 GLN N N 116 119.994 117.575 2.419 1 1 1284 . 17 1 1 A 117 117 GLU H H 117 8.849 8.604 0.245 1 1 1285 . 17 1 1 A 117 117 GLU HA H 117 3.707 3.639 0.068 1 1 1290 . 17 1 1 A 117 117 GLU C C 117 177.303 176.701 0.602 1 1 1291 . 17 1 1 A 117 117 GLU CA C 117 57.233 55.794 1.439 1 1 1292 . 17 1 1 A 117 117 GLU CB C 117 29.634 28.708 0.926 1 1 1294 . 17 1 1 A 117 117 GLU N N 117 121.487 123.421 -1.934 1 1 1295 . 17 1 1 A 118 118 VAL H H 118 8.983 8.307 0.676 1 1 1296 . 17 1 1 A 118 118 VAL HA H 118 4.360 3.991 0.369 1 1 1304 . 17 1 1 A 118 118 VAL C C 118 174.171 175.604 -1.433 1 1 1305 . 17 1 1 A 118 118 VAL CA C 118 61.772 62.992 -1.220 1 1 1306 . 17 1 1 A 118 118 VAL CB C 118 34.095 32.092 2.003 1 1 1309 . 17 1 1 A 118 118 VAL N N 118 122.933 121.816 1.117 1 1 1310 . 17 1 1 A 119 119 ALA H H 119 7.023 7.092 -0.069 1 1 1311 . 17 1 1 A 119 119 ALA HA H 119 4.378 4.483 -0.105 1 1 1315 . 17 1 1 A 119 119 ALA C C 119 175.493 174.912 0.581 1 1 1316 . 17 1 1 A 119 119 ALA CA C 119 51.956 51.245 0.711 1 1 1317 . 17 1 1 A 119 119 ALA CB C 119 23.957 21.723 2.234 1 1 1318 . 17 1 1 A 119 119 ALA N N 119 117.379 121.553 -4.174 1 1 1319 . 17 1 1 A 120 120 SER H H 120 6.999 8.664 -1.665 1 1 1320 . 17 1 1 A 120 120 SER HA H 120 5.208 5.735 -0.527 1 1 1323 . 17 1 1 A 120 120 SER C C 120 173.082 172.925 0.157 1 1 1324 . 17 1 1 A 120 120 SER CA C 120 56.754 56.871 -0.117 1 1 1325 . 17 1 1 A 120 120 SER CB C 120 64.605 65.210 -0.605 1 1 1326 . 17 1 1 A 120 120 SER N N 120 113.743 115.920 -2.177 1 1 1327 . 17 1 1 A 121 121 PHE H H 121 8.244 9.207 -0.963 1 1 1328 . 17 1 1 A 121 121 PHE HA H 121 5.177 5.141 0.036 1 1 1333 . 17 1 1 A 121 121 PHE C C 121 173.569 172.508 1.061 1 1 1334 . 17 1 1 A 121 121 PHE CA C 121 55.555 55.524 0.031 1 1 1335 . 17 1 1 A 121 121 PHE CB C 121 40.959 41.922 -0.963 1 1 1338 . 17 1 1 A 121 121 PHE N N 121 120.358 121.952 -1.594 1 1 1339 . 17 1 1 A 122 122 ILE H H 122 8.907 8.593 0.314 1 1 1340 . 17 1 1 A 122 122 ILE HA H 122 4.682 4.406 0.276 1 1 1348 . 17 1 1 A 122 122 ILE C C 122 176.925 175.251 1.674 1 1 1349 . 17 1 1 A 122 122 ILE CA C 122 60.740 61.327 -0.587 1 1 1350 . 17 1 1 A 122 122 ILE CB C 122 39.497 37.746 1.751 1 1 1353 . 17 1 1 A 122 122 ILE N N 122 121.282 121.459 -0.177 1 1 1354 . 17 1 1 A 123 123 THR H H 123 9.022 9.057 -0.035 1 1 1355 . 17 1 1 A 123 123 THR HA H 123 5.039 5.400 -0.361 1 1 1360 . 17 1 1 A 123 123 THR C C 123 173.531 173.416 0.115 1 1 1361 . 17 1 1 A 123 123 THR CA C 123 62.266 61.343 0.923 1 1 1362 . 17 1 1 A 123 123 THR CB C 123 70.677 69.938 0.739 1 1 1364 . 17 1 1 A 123 123 THR N N 123 128.965 123.538 5.427 1 1 1365 . 17 1 1 A 124 124 THR H H 124 8.961 8.965 -0.004 1 1 1366 . 17 1 1 A 124 124 THR HA H 124 5.001 4.950 0.051 1 1 1371 . 17 1 1 A 124 124 THR C C 124 173.468 172.537 0.931 1 1 1372 . 17 1 1 A 124 124 THR CA C 124 62.109 61.628 0.481 1 1 1373 . 17 1 1 A 124 124 THR CB C 124 70.450 70.042 0.408 1 1 1375 . 17 1 1 A 124 124 THR N N 124 122.176 123.086 -0.910 1 1 1376 . 17 1 1 A 125 125 ARG H H 125 9.386 9.881 -0.495 1 1 1377 . 17 1 1 A 125 125 ARG HA H 125 5.764 5.406 0.358 1 1 1384 . 17 1 1 A 125 125 ARG C C 125 175.713 174.986 0.727 1 1 1385 . 17 1 1 A 125 125 ARG CA C 125 53.991 54.474 -0.483 1 1 1386 . 17 1 1 A 125 125 ARG CB C 125 33.557 32.985 0.572 1 1 1389 . 17 1 1 A 125 125 ARG N N 125 130.004 129.175 0.829 1 1 1390 . 17 1 1 A 126 126 SER H H 126 9.172 9.550 -0.378 1 1 1391 . 17 1 1 A 126 126 SER HA H 126 5.390 5.017 0.373 1 1 1394 . 17 1 1 A 126 126 SER C C 126 172.359 173.516 -1.157 1 1 1395 . 17 1 1 A 126 126 SER CA C 126 56.934 57.618 -0.684 1 1 1396 . 17 1 1 A 126 126 SER CB C 126 65.827 65.820 0.007 1 1 1397 . 17 1 1 A 126 126 SER N N 126 119.906 122.988 -3.082 1 1 1398 . 17 1 1 A 127 127 SER H H 127 8.591 9.057 -0.466 1 1 1399 . 17 1 1 A 127 127 SER HA H 127 5.739 5.478 0.261 1 1 1401 . 17 1 1 A 127 127 SER C C 127 173.283 173.418 -0.135 1 1 1402 . 17 1 1 A 127 127 SER CA C 127 57.354 57.718 -0.364 1 1 1403 . 17 1 1 A 127 127 SER CB C 127 65.412 64.807 0.605 1 1 1404 . 17 1 1 A 127 127 SER N N 127 117.914 122.219 -4.305 1 1 1405 . 17 1 1 A 128 128 TRP H H 128 9.866 10.066 -0.200 1 1 1406 . 17 1 1 A 128 128 TRP HA H 128 5.560 5.579 -0.019 1 1 1415 . 17 1 1 A 128 128 TRP C C 128 175.828 174.939 0.889 1 1 1416 . 17 1 1 A 128 128 TRP CA C 128 55.852 55.949 -0.097 1 1 1417 . 17 1 1 A 128 128 TRP CB C 128 32.524 32.123 0.401 1 1 1423 . 17 1 1 A 128 128 TRP N N 128 127.978 126.020 1.958 1 1 1425 . 17 1 1 A 129 129 LYS H H 129 9.424 9.210 0.214 1 1 1426 . 17 1 1 A 129 129 LYS HA H 129 5.388 5.222 0.166 1 1 1433 . 17 1 1 A 129 129 LYS C C 129 175.254 174.938 0.316 1 1 1434 . 17 1 1 A 129 129 LYS CA C 129 54.410 55.189 -0.779 1 1 1435 . 17 1 1 A 129 129 LYS CB C 129 35.734 34.607 1.127 1 1 1439 . 17 1 1 A 129 129 LYS N N 129 121.784 125.662 -3.878 1 1 1440 . 17 1 1 A 130 130 LEU H H 130 8.933 9.432 -0.499 1 1 1441 . 17 1 1 A 130 130 LEU HA H 130 4.859 4.912 -0.053 1 1 1447 . 17 1 1 A 130 130 LEU C C 130 173.893 174.480 -0.587 1 1 1448 . 17 1 1 A 130 130 LEU CA C 130 53.848 54.302 -0.454 1 1 1449 . 17 1 1 A 130 130 LEU CB C 130 46.125 45.505 0.620 1 1 1451 . 17 1 1 A 130 130 LEU N N 130 124.543 126.924 -2.381 1 1 1452 . 17 1 1 A 131 131 ALA H H 131 8.816 8.740 0.076 1 1 1453 . 17 1 1 A 131 131 ALA HA H 131 4.776 4.628 0.148 1 1 1457 . 17 1 1 A 131 131 ALA C C 131 176.662 176.603 0.059 1 1 1458 . 17 1 1 A 131 131 ALA CA C 131 51.407 51.568 -0.161 1 1 1459 . 17 1 1 A 131 131 ALA CB C 131 19.354 19.128 0.226 1 1 1460 . 17 1 1 A 131 131 ALA N N 131 131.102 129.446 1.656 1 1 1461 . 17 1 1 A 132 132 LEU H H 132 8.487 9.014 -0.527 1 1 1462 . 17 1 1 A 132 132 LEU HA H 132 4.470 4.496 -0.026 1 1 1470 . 17 1 1 A 132 132 LEU C C 132 176.873 176.650 0.223 1 1 1471 . 17 1 1 A 132 132 LEU CA C 132 54.590 55.236 -0.646 1 1 1472 . 17 1 1 A 132 132 LEU CB C 132 42.974 42.958 0.016 1 1 1475 . 17 1 1 A 132 132 LEU N N 132 123.724 127.591 -3.867 1 1 1476 . 17 1 1 A 133 133 SER H H 133 8.448 8.718 -0.270 1 1 1477 . 17 1 1 A 133 133 SER HA H 133 4.560 4.401 0.159 1 1 1479 . 17 1 1 A 133 133 SER C C 133 176.043 174.631 1.412 1 1 1480 . 17 1 1 A 133 133 SER CA C 133 58.460 59.621 -1.161 1 1 1481 . 17 1 1 A 133 133 SER CB C 133 63.985 62.945 1.040 1 1 1482 . 17 1 1 A 133 133 SER N N 133 115.880 121.724 -5.844 1 1 1483 . 17 1 1 A 134 134 GLY H H 134 8.232 8.861 -0.629 1 1 1484 . 17 1 1 A 134 134 GLY HA2 H 134 4.147 3.840 0.307 1 1 1485 . 17 1 1 A 134 134 GLY HA3 H 134 4.045 3.868 0.177 1 1 1486 . 17 1 1 A 134 134 GLY C C 134 174.013 174.480 -0.467 1 1 1487 . 17 1 1 A 134 134 GLY CA C 134 45.337 47.341 -2.004 1 1 1488 . 17 1 1 A 134 134 GLY N N 134 109.970 113.569 -3.599 1 1 1489 . 17 1 1 A 135 135 ALA H H 135 8.424 8.103 0.321 1 1 1490 . 17 1 1 A 135 135 ALA HA H 135 4.436 4.095 0.341 1 1 1494 . 17 1 1 A 135 135 ALA C C 135 177.537 177.027 0.510 1 1 1495 . 17 1 1 A 135 135 ALA CA C 135 52.721 53.509 -0.788 1 1 1496 . 17 1 1 A 135 135 ALA CB C 135 19.265 17.785 1.480 1 1 1497 . 17 1 1 A 135 135 ALA N N 135 124.118 119.867 4.251 1 1 1498 . 17 1 1 A 136 136 HIS H H 136 8.466 8.015 0.451 1 1 1499 . 17 1 1 A 136 136 HIS HA H 136 4.379 4.802 -0.423 1 1 1500 . 17 1 1 A 136 136 HIS C C 136 176.259 175.513 0.746 1 1 1501 . 17 1 1 A 136 136 HIS CA C 136 56.082 55.559 0.523 1 1 1502 . 17 1 1 A 136 136 HIS CB C 136 29.619 31.192 -1.573 1 1 1503 . 17 1 1 A 136 136 HIS N N 136 119.493 115.896 3.597 1 1 1504 . 17 1 1 A 137 137 GLY H H 137 8.431 8.588 -0.157 1 1 1505 . 17 1 1 A 137 137 GLY HA2 H 137 4.151 3.829 0.322 1 1 1506 . 17 1 1 A 137 137 GLY HA3 H 137 3.893 3.850 0.043 1 1 1507 . 17 1 1 A 137 137 GLY C C 137 174.039 173.664 0.375 1 1 1508 . 17 1 1 A 137 137 GLY CA C 137 45.372 45.698 -0.326 1 1 1509 . 17 1 1 A 137 137 GLY N N 137 110.442 108.645 1.797 1 1 1510 . 17 1 1 A 138 138 GLN H H 138 8.416 7.852 0.564 1 1 1511 . 17 1 1 A 138 138 GLN HA H 138 4.455 4.887 -0.432 1 1 1515 . 17 1 1 A 138 138 GLN C C 138 175.889 174.085 1.804 1 1 1516 . 17 1 1 A 138 138 GLN CA C 138 55.866 55.293 0.573 1 1 1517 . 17 1 1 A 138 138 GLN CB C 138 29.639 31.717 -2.078 1 1 1518 . 17 1 1 A 138 138 GLN N N 138 119.401 119.891 -0.490 1 1 1519 . 17 1 1 A 139 139 GLU H H 139 8.446 8.964 -0.518 1 1 1520 . 17 1 1 A 139 139 GLU HA H 139 4.658 4.878 -0.220 1 1 1524 . 17 1 1 A 139 139 GLU CA C 139 54.589 52.737 1.852 1 1 1525 . 17 1 1 A 139 139 GLU CB C 139 29.733 30.372 -0.639 1 1 1527 . 17 1 1 A 139 139 GLU N N 139 123.136 125.081 -1.945 1 1 1528 . 17 1 1 A 140 140 PRO HA H 140 4.537 4.875 -0.338 1 1 1533 . 17 1 1 A 140 140 PRO C C 140 176.119 176.328 -0.209 1 1 1534 . 17 1 1 A 140 140 PRO CA C 140 63.220 62.360 0.860 1 1 1535 . 17 1 1 A 140 140 PRO CB C 140 31.936 31.855 0.081 1 1 1538 . 17 1 1 A 141 141 GLN H H 141 8.506 8.507 -0.001 1 1 1539 . 17 1 1 A 141 141 GLN HA H 141 4.650 4.664 -0.014 1 1 1546 . 17 1 1 A 141 141 GLN C C 141 175.811 175.752 0.059 1 1 1547 . 17 1 1 A 141 141 GLN CA C 141 55.912 55.736 0.176 1 1 1548 . 17 1 1 A 141 141 GLN CB C 141 30.241 29.222 1.019 1 1 1550 . 17 1 1 A 141 141 GLN N N 141 120.422 123.069 -2.647 1 1 1551 . 17 1 1 A 142 142 LEU H H 142 8.842 8.990 -0.148 1 1 1552 . 17 1 1 A 142 142 LEU HA H 142 5.277 5.166 0.111 1 1 1562 . 17 1 1 A 142 142 LEU C C 142 176.839 175.312 1.527 1 1 1563 . 17 1 1 A 142 142 LEU CA C 142 53.927 52.901 1.026 1 1 1564 . 17 1 1 A 142 142 LEU CB C 142 44.527 44.204 0.323 1 1 1568 . 17 1 1 A 142 142 LEU N N 142 123.692 120.716 2.976 1 1 1569 . 17 1 1 A 143 143 THR H H 143 9.025 8.751 0.274 1 1 1570 . 17 1 1 A 143 143 THR HA H 143 5.262 4.950 0.312 1 1 1575 . 17 1 1 A 143 143 THR C C 143 173.753 173.947 -0.194 1 1 1576 . 17 1 1 A 143 143 THR CA C 143 61.795 61.881 -0.086 1 1 1577 . 17 1 1 A 143 143 THR CB C 143 70.660 70.776 -0.116 1 1 1579 . 17 1 1 A 143 143 THR N N 143 117.222 116.093 1.129 1 1 1580 . 17 1 1 A 144 144 ILE H H 144 9.353 10.069 -0.716 1 1 1581 . 17 1 1 A 144 144 ILE HA H 144 5.399 5.296 0.103 1 1 1591 . 17 1 1 A 144 144 ILE C C 144 173.931 174.259 -0.328 1 1 1592 . 17 1 1 A 144 144 ILE CA C 144 60.774 59.849 0.925 1 1 1593 . 17 1 1 A 144 144 ILE CB C 144 41.111 40.536 0.575 1 1 1597 . 17 1 1 A 144 144 ILE N N 144 126.383 127.542 -1.159 1 1 1598 . 17 1 1 A 145 145 ASP H H 145 9.214 9.225 -0.011 1 1 1599 . 17 1 1 A 145 145 ASP HA H 145 5.978 5.452 0.526 1 1 1601 . 17 1 1 A 145 145 ASP C C 145 175.441 174.481 0.960 1 1 1602 . 17 1 1 A 145 145 ASP CA C 145 53.035 52.822 0.213 1 1 1603 . 17 1 1 A 145 145 ASP CB C 145 44.153 44.526 -0.373 1 1 1604 . 17 1 1 A 145 145 ASP N N 145 127.981 127.425 0.556 1 1 1605 . 17 1 1 A 146 146 LEU H H 146 9.387 9.859 -0.472 1 1 1606 . 17 1 1 A 146 146 LEU HA H 146 4.918 5.553 -0.635 1 1 1616 . 17 1 1 A 146 146 LEU C C 146 175.003 174.574 0.429 1 1 1617 . 17 1 1 A 146 146 LEU CA C 146 53.940 53.418 0.522 1 1 1618 . 17 1 1 A 146 146 LEU CB C 146 43.902 43.805 0.097 1 1 1622 . 17 1 1 A 146 146 LEU N N 146 123.532 126.830 -3.298 1 1 1623 . 17 1 1 A 147 147 ASP H H 147 8.676 8.666 0.010 1 1 1624 . 17 1 1 A 147 147 ASP HA H 147 5.205 5.356 -0.151 1 1 1627 . 17 1 1 A 147 147 ASP C C 147 174.956 174.628 0.328 1 1 1628 . 17 1 1 A 147 147 ASP CA C 147 53.441 52.395 1.046 1 1 1629 . 17 1 1 A 147 147 ASP CB C 147 43.370 43.351 0.019 1 1 1630 . 17 1 1 A 147 147 ASP N N 147 125.499 125.792 -0.293 1 1 1631 . 17 1 1 A 148 148 SER H H 148 8.732 9.048 -0.316 1 1 1632 . 17 1 1 A 148 148 SER HA H 148 5.365 4.993 0.372 1 1 1634 . 17 1 1 A 148 148 SER C C 148 173.217 173.847 -0.630 1 1 1635 . 17 1 1 A 148 148 SER CA C 148 56.334 55.725 0.609 1 1 1636 . 17 1 1 A 148 148 SER CB C 148 65.812 65.949 -0.137 1 1 1637 . 17 1 1 A 148 148 SER N N 148 118.623 118.722 -0.099 1 1 1638 . 17 1 1 A 149 149 ALA H H 149 8.937 8.855 0.082 1 1 1639 . 17 1 1 A 149 149 ALA HA H 149 5.681 5.426 0.255 1 1 1643 . 17 1 1 A 149 149 ALA C C 149 178.894 177.477 1.417 1 1 1644 . 17 1 1 A 149 149 ALA CA C 149 49.996 50.580 -0.584 1 1 1645 . 17 1 1 A 149 149 ALA CB C 149 23.231 22.789 0.442 1 1 1646 . 17 1 1 A 149 149 ALA N N 149 123.952 121.198 2.754 1 1 1647 . 17 1 1 A 150 150 ASP H H 150 9.010 8.771 0.239 1 1 1648 . 17 1 1 A 150 150 ASP HA H 150 4.336 4.209 0.127 1 1 1651 . 17 1 1 A 150 150 ASP C C 150 176.697 176.660 0.037 1 1 1652 . 17 1 1 A 150 150 ASP CA C 150 56.543 57.423 -0.880 1 1 1653 . 17 1 1 A 150 150 ASP CB C 150 39.850 40.458 -0.608 1 1 1654 . 17 1 1 A 150 150 ASP N N 150 122.687 122.256 0.431 1 1 1655 . 17 1 1 A 151 151 PHE H H 151 7.295 7.887 -0.592 1 1 1656 . 17 1 1 A 151 151 PHE HA H 151 5.020 4.739 0.281 1 1 1661 . 17 1 1 A 151 151 PHE C C 151 174.756 175.592 -0.836 1 1 1662 . 17 1 1 A 151 151 PHE CA C 151 56.594 56.534 0.060 1 1 1663 . 17 1 1 A 151 151 PHE CB C 151 37.765 37.040 0.725 1 1 1666 . 17 1 1 A 151 151 PHE N N 151 113.928 116.065 -2.137 1 1 1667 . 17 1 1 A 152 152 GLY H H 152 7.786 8.231 -0.445 1 1 1668 . 17 1 1 A 152 152 GLY HA2 H 152 4.459 3.976 0.483 1 1 1669 . 17 1 1 A 152 152 GLY HA3 H 152 3.728 3.986 -0.258 1 1 1670 . 17 1 1 A 152 152 GLY C C 152 172.709 173.543 -0.834 1 1 1671 . 17 1 1 A 152 152 GLY CA C 152 46.106 47.292 -1.186 1 1 1672 . 17 1 1 A 152 152 GLY N N 152 110.312 108.302 2.010 1 1 1673 . 17 1 1 A 153 153 TYR H H 153 6.650 7.347 -0.697 1 1 1674 . 17 1 1 A 153 153 TYR HA H 153 4.508 4.974 -0.466 1 1 1679 . 17 1 1 A 153 153 TYR C C 153 173.092 173.067 0.025 1 1 1680 . 17 1 1 A 153 153 TYR CA C 153 57.464 57.528 -0.064 1 1 1681 . 17 1 1 A 153 153 TYR CB C 153 41.962 42.310 -0.348 1 1 1684 . 17 1 1 A 153 153 TYR N N 153 121.977 119.309 2.668 1 1 1685 . 17 1 1 A 154 154 ALA H H 154 7.847 8.532 -0.685 1 1 1686 . 17 1 1 A 154 154 ALA HA H 154 5.144 4.634 0.510 1 1 1690 . 17 1 1 A 154 154 ALA C C 154 174.468 174.899 -0.431 1 1 1691 . 17 1 1 A 154 154 ALA CA C 154 51.776 51.239 0.537 1 1 1692 . 17 1 1 A 154 154 ALA CB C 154 21.747 21.803 -0.056 1 1 1693 . 17 1 1 A 154 154 ALA N N 154 130.258 129.924 0.334 1 1 1694 . 17 1 1 A 155 155 VAL H H 155 8.733 8.663 0.070 1 1 1695 . 17 1 1 A 155 155 VAL HA H 155 4.150 4.799 -0.649 1 1 1700 . 17 1 1 A 155 155 VAL C C 155 172.632 173.661 -1.029 1 1 1701 . 17 1 1 A 155 155 VAL CA C 155 61.451 59.190 2.261 1 1 1702 . 17 1 1 A 155 155 VAL CB C 155 35.883 34.714 1.169 1 1 1704 . 17 1 1 A 155 155 VAL N N 155 119.622 122.862 -3.240 1 1 1705 . 17 1 1 A 156 156 GLY H H 156 8.146 8.341 -0.195 1 1 1706 . 17 1 1 A 156 156 GLY HA2 H 156 5.125 2.671 2.454 1 1 1707 . 17 1 1 A 156 156 GLY HA3 H 156 2.061 3.922 -1.861 1 1 1708 . 17 1 1 A 156 156 GLY C C 156 171.746 171.381 0.365 1 1 1709 . 17 1 1 A 156 156 GLY CA C 156 43.319 43.653 -0.334 1 1 1710 . 17 1 1 A 156 156 GLY N N 156 113.332 113.508 -0.176 1 1 1711 . 17 1 1 A 157 157 GLU H H 157 8.967 8.840 0.127 1 1 1712 . 17 1 1 A 157 157 GLU HA H 157 5.217 5.083 0.134 1 1 1716 . 17 1 1 A 157 157 GLU C C 157 174.476 175.526 -1.050 1 1 1717 . 17 1 1 A 157 157 GLU CA C 157 55.390 55.002 0.388 1 1 1718 . 17 1 1 A 157 157 GLU CB C 157 34.010 32.911 1.099 1 1 1720 . 17 1 1 A 157 157 GLU N N 157 120.823 122.858 -2.035 1 1 1721 . 17 1 1 A 158 158 VAL H H 158 9.076 9.367 -0.291 1 1 1722 . 17 1 1 A 158 158 VAL HA H 158 5.206 4.746 0.460 1 1 1727 . 17 1 1 A 158 158 VAL C C 158 173.900 174.346 -0.446 1 1 1728 . 17 1 1 A 158 158 VAL CA C 158 60.813 61.846 -1.033 1 1 1729 . 17 1 1 A 158 158 VAL CB C 158 33.385 33.090 0.295 1 1 1731 . 17 1 1 A 158 158 VAL N N 158 124.349 125.666 -1.317 1 1 1732 . 17 1 1 A 159 159 GLU H H 159 9.239 9.775 -0.536 1 1 1733 . 17 1 1 A 159 159 GLU HA H 159 5.647 5.189 0.458 1 1 1738 . 17 1 1 A 159 159 GLU C C 159 174.469 175.194 -0.725 1 1 1739 . 17 1 1 A 159 159 GLU CA C 159 54.473 54.690 -0.217 1 1 1740 . 17 1 1 A 159 159 GLU CB C 159 33.852 32.814 1.038 1 1 1742 . 17 1 1 A 159 159 GLU N N 159 125.772 129.336 -3.564 1 1 1743 . 17 1 1 A 160 160 ALA H H 160 9.250 9.249 0.001 1 1 1744 . 17 1 1 A 160 160 ALA HA H 160 4.966 5.333 -0.367 1 1 1748 . 17 1 1 A 160 160 ALA C C 160 175.114 175.558 -0.444 1 1 1749 . 17 1 1 A 160 160 ALA CA C 160 50.644 50.145 0.499 1 1 1750 . 17 1 1 A 160 160 ALA CB C 160 23.263 22.728 0.535 1 1 1751 . 17 1 1 A 160 160 ALA N N 160 125.092 129.382 -4.290 1 1 1752 . 17 1 1 A 161 161 MET H H 161 8.559 8.824 -0.265 1 1 1753 . 17 1 1 A 161 161 MET HA H 161 5.468 5.893 -0.425 1 1 1761 . 17 1 1 A 161 161 MET C C 161 176.265 175.078 1.187 1 1 1762 . 17 1 1 A 161 161 MET CA C 161 53.818 54.086 -0.268 1 1 1763 . 17 1 1 A 161 161 MET CB C 161 34.380 34.778 -0.398 1 1 1766 . 17 1 1 A 161 161 MET N N 161 118.699 119.887 -1.188 1 1 1767 . 17 1 1 A 162 162 VAL H H 162 9.046 9.131 -0.085 1 1 1768 . 17 1 1 A 162 162 VAL HA H 162 4.841 4.823 0.018 1 1 1776 . 17 1 1 A 162 162 VAL C C 162 174.794 175.854 -1.060 1 1 1777 . 17 1 1 A 162 162 VAL CA C 162 59.107 60.068 -0.961 1 1 1778 . 17 1 1 A 162 162 VAL CB C 162 34.018 34.281 -0.263 1 1 1781 . 17 1 1 A 162 162 VAL N N 162 116.435 119.497 -3.062 1 1 1782 . 17 1 1 A 163 163 HIS H H 163 8.793 8.748 0.045 1 1 1783 . 17 1 1 A 163 163 HIS HA H 163 4.717 4.539 0.178 1 1 1787 . 17 1 1 A 163 163 HIS C C 163 175.460 174.592 0.868 1 1 1788 . 17 1 1 A 163 163 HIS CA C 163 58.488 57.454 1.034 1 1 1789 . 17 1 1 A 163 163 HIS CB C 163 31.185 30.868 0.317 1 1 1791 . 17 1 1 A 163 163 HIS N N 163 117.838 121.759 -3.921 1 1 1792 . 17 1 1 A 164 164 GLU H H 164 8.013 7.724 0.289 1 1 1793 . 17 1 1 A 164 164 GLU HA H 164 4.814 4.568 0.246 1 1 1797 . 17 1 1 A 164 164 GLU C C 164 176.910 176.096 0.814 1 1 1798 . 17 1 1 A 164 164 GLU CA C 164 54.355 54.985 -0.630 1 1 1799 . 17 1 1 A 164 164 GLU CB C 164 32.886 31.421 1.465 1 1 1801 . 17 1 1 A 164 164 GLU N N 164 115.943 114.637 1.306 1 1 1802 . 17 1 1 A 165 165 LYS H H 165 9.088 8.859 0.229 1 1 1803 . 17 1 1 A 165 165 LYS HA H 165 3.942 3.910 0.032 1 1 1809 . 17 1 1 A 165 165 LYS C C 165 179.657 178.009 1.648 1 1 1810 . 17 1 1 A 165 165 LYS CA C 165 59.888 58.415 1.473 1 1 1811 . 17 1 1 A 165 165 LYS CB C 165 32.024 32.247 -0.223 1 1 1814 . 17 1 1 A 165 165 LYS N N 165 124.120 123.883 0.237 1 1 1815 . 17 1 1 A 166 166 ALA H H 166 8.851 7.938 0.913 1 1 1816 . 17 1 1 A 166 166 ALA HA H 166 4.251 4.092 0.159 1 1 1820 . 17 1 1 A 166 166 ALA C C 166 178.920 177.808 1.112 1 1 1821 . 17 1 1 A 166 166 ALA CA C 166 54.318 54.519 -0.201 1 1 1822 . 17 1 1 A 166 166 ALA CB C 166 18.810 18.617 0.193 1 1 1823 . 17 1 1 A 166 166 ALA N N 166 120.424 121.738 -1.314 1 1 1824 . 17 1 1 A 167 167 GLU H H 167 7.871 7.773 0.098 1 1 1825 . 17 1 1 A 167 167 GLU HA H 167 4.404 4.498 -0.094 1 1 1829 . 17 1 1 A 167 167 GLU C C 167 177.368 177.625 -0.257 1 1 1830 . 17 1 1 A 167 167 GLU CA C 167 56.701 55.620 1.081 1 1 1831 . 17 1 1 A 167 167 GLU CB C 167 31.208 29.468 1.740 1 1 1833 . 17 1 1 A 167 167 GLU N N 167 114.926 114.441 0.485 1 1 1834 . 17 1 1 A 168 168 VAL H H 168 7.812 7.607 0.205 1 1 1835 . 17 1 1 A 168 168 VAL HA H 168 3.712 3.715 -0.003 1 1 1843 . 17 1 1 A 168 168 VAL CA C 168 68.705 67.811 0.894 1 1 1844 . 17 1 1 A 168 168 VAL CB C 168 29.597 29.796 -0.199 1 1 1847 . 17 1 1 A 168 168 VAL N N 168 120.188 121.697 -1.509 1 1 1848 . 17 1 1 A 169 169 PRO HA H 169 4.252 4.244 0.008 1 1 1851 . 17 1 1 A 169 169 PRO C C 169 179.563 178.662 0.901 1 1 1852 . 17 1 1 A 169 169 PRO CA C 169 67.077 66.534 0.543 1 1 1853 . 17 1 1 A 170 170 ALA H H 170 8.149 8.113 0.036 1 1 1854 . 17 1 1 A 170 170 ALA HA H 170 4.265 4.041 0.224 1 1 1858 . 17 1 1 A 170 170 ALA C C 170 180.637 179.688 0.949 1 1 1859 . 17 1 1 A 170 170 ALA CA C 170 54.823 55.238 -0.415 1 1 1860 . 17 1 1 A 170 170 ALA CB C 170 18.518 18.156 0.362 1 1 1861 . 17 1 1 A 170 170 ALA N N 170 119.210 119.423 -0.213 1 1 1862 . 17 1 1 A 171 171 ALA H H 171 7.767 8.137 -0.370 1 1 1863 . 17 1 1 A 171 171 ALA HA H 171 4.106 4.064 0.042 1 1 1867 . 17 1 1 A 171 171 ALA C C 171 179.371 179.681 -0.310 1 1 1868 . 17 1 1 A 171 171 ALA CA C 171 55.130 54.904 0.226 1 1 1869 . 17 1 1 A 171 171 ALA CB C 171 18.291 17.970 0.321 1 1 1870 . 17 1 1 A 171 171 ALA N N 171 122.126 120.653 1.473 1 1 1871 . 17 1 1 A 172 172 LEU H H 172 8.950 8.014 0.936 1 1 1872 . 17 1 1 A 172 172 LEU HA H 172 3.987 4.055 -0.068 1 1 1878 . 17 1 1 A 172 172 LEU C C 172 178.355 178.434 -0.079 1 1 1879 . 17 1 1 A 172 172 LEU CA C 172 57.803 57.343 0.460 1 1 1880 . 17 1 1 A 172 172 LEU CB C 172 41.667 41.552 0.115 1 1 1882 . 17 1 1 A 172 172 LEU N N 172 118.682 120.237 -1.555 1 1 1883 . 17 1 1 A 173 173 GLU H H 173 7.886 8.142 -0.256 1 1 1884 . 17 1 1 A 173 173 GLU HA H 173 4.132 3.920 0.212 1 1 1887 . 17 1 1 A 173 173 GLU C C 173 179.556 179.188 0.368 1 1 1888 . 17 1 1 A 173 173 GLU CA C 173 59.800 59.791 0.009 1 1 1889 . 17 1 1 A 173 173 GLU CB C 173 29.580 28.954 0.626 1 1 1891 . 17 1 1 A 173 173 GLU N N 173 117.561 119.060 -1.499 1 1 1892 . 17 1 1 A 174 174 LYS H H 174 7.532 7.444 0.088 1 1 1893 . 17 1 1 A 174 174 LYS HA H 174 4.131 3.996 0.135 1 1 1901 . 17 1 1 A 174 174 LYS CA C 174 58.999 59.297 -0.298 1 1 1902 . 17 1 1 A 174 174 LYS CB C 174 32.041 32.451 -0.410 1 1 1906 . 17 1 1 A 174 174 LYS N N 174 119.085 119.012 0.073 1 1 1907 . 17 1 1 A 175 175 ILE H H 175 8.479 7.713 0.766 1 1 1908 . 17 1 1 A 175 175 ILE HA H 175 3.583 3.561 0.022 1 1 1918 . 17 1 1 A 175 175 ILE C C 175 179.258 178.344 0.914 1 1 1919 . 17 1 1 A 175 175 ILE CA C 175 65.769 65.743 0.026 1 1 1920 . 17 1 1 A 175 175 ILE CB C 175 37.876 37.839 0.037 1 1 1923 . 17 1 1 A 175 175 ILE N N 175 118.828 120.282 -1.454 1 1 1924 . 17 1 1 A 176 176 ILE H H 176 8.928 8.066 0.862 1 1 1925 . 17 1 1 A 176 176 ILE HA H 176 3.600 3.548 0.052 1 1 1935 . 17 1 1 A 176 176 ILE C C 176 178.827 178.099 0.728 1 1 1936 . 17 1 1 A 176 176 ILE CA C 176 65.640 65.144 0.496 1 1 1937 . 17 1 1 A 176 176 ILE CB C 176 37.451 37.716 -0.265 1 1 1941 . 17 1 1 A 176 176 ILE N N 176 124.527 120.460 4.067 1 1 1942 . 17 1 1 A 177 177 THR H H 177 8.175 7.928 0.247 1 1 1943 . 17 1 1 A 177 177 THR HA H 177 3.885 3.903 -0.018 1 1 1948 . 17 1 1 A 177 177 THR C C 177 176.867 176.289 0.578 1 1 1949 . 17 1 1 A 177 177 THR CA C 177 67.199 66.305 0.894 1 1 1950 . 17 1 1 A 177 177 THR CB C 177 68.377 68.492 -0.115 1 1 1952 . 17 1 1 A 177 177 THR N N 177 119.412 118.650 0.762 1 1 1953 . 17 1 1 A 178 178 VAL H H 178 8.352 8.044 0.308 1 1 1954 . 17 1 1 A 178 178 VAL HA H 178 3.572 3.399 0.173 1 1 1962 . 17 1 1 A 178 178 VAL C C 178 177.664 177.906 -0.242 1 1 1963 . 17 1 1 A 178 178 VAL CA C 178 66.909 66.564 0.345 1 1 1964 . 17 1 1 A 178 178 VAL CB C 178 31.714 31.167 0.547 1 1 1967 . 17 1 1 A 178 178 VAL N N 178 121.168 121.754 -0.586 1 1 1968 . 17 1 1 A 179 179 SER H H 179 8.529 8.276 0.253 1 1 1969 . 17 1 1 A 179 179 SER HA H 179 3.099 3.316 -0.217 1 1 1972 . 17 1 1 A 179 179 SER C C 179 175.380 176.327 -0.947 1 1 1973 . 17 1 1 A 179 179 SER CA C 179 62.728 61.519 1.209 1 1 1974 . 17 1 1 A 179 179 SER CB C 179 62.802 62.599 0.203 1 1 1975 . 17 1 1 A 179 179 SER N N 179 115.226 115.622 -0.396 1 1 1976 . 17 1 1 A 180 180 SER H H 180 7.757 8.114 -0.357 1 1 1977 . 17 1 1 A 180 180 SER HA H 180 4.419 4.372 0.047 1 1 1980 . 17 1 1 A 180 180 SER C C 180 175.359 177.133 -1.774 1 1 1981 . 17 1 1 A 180 180 SER CA C 180 61.025 61.475 -0.450 1 1 1982 . 17 1 1 A 180 180 SER CB C 180 63.072 62.960 0.112 1 1 1983 . 17 1 1 A 180 180 SER N N 180 114.718 115.904 -1.186 1 1 1984 . 17 1 1 A 181 181 MET H H 181 7.497 7.945 -0.448 1 1 1985 . 17 1 1 A 181 181 MET HA H 181 4.283 4.247 0.036 1 1 1993 . 17 1 1 A 181 181 MET C C 181 177.217 177.115 0.102 1 1 1994 . 17 1 1 A 181 181 MET CA C 181 57.539 57.822 -0.283 1 1 1995 . 17 1 1 A 181 181 MET CB C 181 33.493 31.916 1.577 1 1 1998 . 17 1 1 A 181 181 MET N N 181 119.274 119.545 -0.271 1 1 1999 . 17 1 1 A 182 182 LEU H H 182 7.163 7.452 -0.289 1 1 2000 . 17 1 1 A 182 182 LEU HA H 182 4.133 4.362 -0.229 1 1 2010 . 17 1 1 A 182 182 LEU C C 182 176.289 176.786 -0.497 1 1 2011 . 17 1 1 A 182 182 LEU CA C 182 54.750 55.093 -0.343 1 1 2012 . 17 1 1 A 182 182 LEU CB C 182 43.235 42.913 0.322 1 1 2016 . 17 1 1 A 182 182 LEU N N 182 115.869 116.829 -0.960 1 1 2017 . 17 1 1 A 183 183 GLY H H 183 7.492 7.519 -0.027 1 1 2018 . 17 1 1 A 183 183 GLY HA2 H 183 4.086 4.143 -0.057 1 1 2019 . 17 1 1 A 183 183 GLY HA3 H 183 4.425 4.196 0.229 1 1 2020 . 17 1 1 A 183 183 GLY C C 183 171.830 171.852 -0.022 1 1 2021 . 17 1 1 A 183 183 GLY CA C 183 46.035 46.109 -0.074 1 1 2022 . 17 1 1 A 183 183 GLY N N 183 107.761 105.422 2.339 1 1 2023 . 17 1 1 A 184 184 VAL H H 184 8.099 8.517 -0.418 1 1 2024 . 17 1 1 A 184 184 VAL HA H 184 4.772 4.767 0.005 1 1 2032 . 17 1 1 A 184 184 VAL CA C 184 59.305 58.766 0.539 1 1 2033 . 17 1 1 A 184 184 VAL CB C 184 33.648 35.196 -1.548 1 1 2036 . 17 1 1 A 184 184 VAL N N 184 119.803 121.612 -1.809 1 1 2037 . 17 1 1 A 185 185 PRO HA H 185 4.442 4.632 -0.190 1 1 2042 . 17 1 1 A 185 185 PRO C C 185 175.871 176.331 -0.460 1 1 2043 . 17 1 1 A 185 185 PRO CA C 185 63.886 62.744 1.142 1 1 2044 . 17 1 1 A 185 185 PRO CB C 185 32.260 32.098 0.162 1 1 2047 . 17 1 1 A 186 186 ALA H H 186 8.222 9.100 -0.878 1 1 2048 . 17 1 1 A 186 186 ALA HA H 186 4.569 4.696 -0.127 1 1 2052 . 17 1 1 A 186 186 ALA C C 186 177.481 176.755 0.726 1 1 2053 . 17 1 1 A 186 186 ALA CA C 186 51.823 50.578 1.245 1 1 2054 . 17 1 1 A 186 186 ALA CB C 186 20.233 21.217 -0.984 1 1 2055 . 17 1 1 A 186 186 ALA N N 186 125.663 123.540 2.123 1 1 2056 . 17 1 1 A 187 187 GLN H H 187 8.723 8.634 0.089 1 1 2057 . 17 1 1 A 187 187 GLN HA H 187 4.420 4.666 -0.246 1 1 2063 . 17 1 1 A 187 187 GLN C C 187 175.566 175.855 -0.289 1 1 2064 . 17 1 1 A 187 187 GLN CA C 187 56.051 55.880 0.171 1 1 2065 . 17 1 1 A 187 187 GLN CB C 187 29.812 30.925 -1.113 1 1 2067 . 17 1 1 A 187 187 GLN N N 187 120.742 116.280 4.462 1 1 2069 . 17 1 1 A 188 188 GLU H H 188 8.163 7.550 0.613 1 1 2070 . 17 1 1 A 188 188 GLU HA H 188 4.405 4.386 0.019 1 1 2074 . 17 1 1 A 188 188 GLU C C 188 176.058 177.568 -1.510 1 1 2075 . 17 1 1 A 188 188 GLU CA C 188 56.158 55.701 0.457 1 1 2076 . 17 1 1 A 188 188 GLU CB C 188 31.095 30.403 0.692 1 1 2078 . 17 1 1 A 188 188 GLU N N 188 119.177 120.613 -1.436 1 1 2079 . 17 1 1 A 189 189 GLU H H 189 8.567 8.514 0.053 1 1 2080 . 17 1 1 A 189 189 GLU HA H 189 4.252 4.443 -0.191 1 1 2084 . 17 1 1 A 189 189 GLU C C 189 175.703 175.637 0.066 1 1 2085 . 17 1 1 A 189 189 GLU CA C 189 56.417 55.565 0.852 1 1 2086 . 17 1 1 A 189 189 GLU CB C 189 29.968 28.785 1.183 1 1 2088 . 17 1 1 A 189 189 GLU N N 189 120.920 118.510 2.410 1 1 2089 . 17 1 1 A 190 190 ALA H H 190 8.271 7.970 0.301 1 1 2090 . 17 1 1 A 190 190 ALA HA H 190 4.626 4.218 0.408 1 1 2094 . 17 1 1 A 190 190 ALA CA C 190 50.465 52.941 -2.476 1 1 2095 . 17 1 1 A 190 190 ALA CB C 190 18.451 18.088 0.363 1 1 2096 . 17 1 1 A 190 190 ALA N N 190 128.323 120.448 7.875 1 1 2097 . 17 1 1 A 191 191 PRO HA H 191 4.493 4.623 -0.130 1 1 2103 . 17 1 1 A 191 191 PRO C C 191 175.899 176.706 -0.807 1 1 2104 . 17 1 1 A 191 191 PRO CA C 191 62.044 62.362 -0.318 1 1 2105 . 17 1 1 A 191 191 PRO CB C 191 32.184 31.602 0.582 1 1 2108 . 17 1 1 A 192 192 ALA H H 192 8.610 8.348 0.262 1 1 2109 . 17 1 1 A 192 192 ALA HA H 192 4.280 4.414 -0.134 1 1 2113 . 17 1 1 A 192 192 ALA C C 192 178.282 177.911 0.371 1 1 2114 . 17 1 1 A 192 192 ALA CA C 192 51.698 52.267 -0.569 1 1 2115 . 17 1 1 A 192 192 ALA CB C 192 19.220 19.684 -0.464 1 1 2116 . 17 1 1 A 192 192 ALA N N 192 123.420 124.181 -0.761 1 1 2117 . 17 1 1 A 193 193 LYS H H 193 8.531 8.770 -0.239 1 1 2118 . 17 1 1 A 193 193 LYS HA H 193 3.294 3.907 -0.613 1 1 2126 . 17 1 1 A 193 193 LYS C C 193 177.640 178.418 -0.778 1 1 2127 . 17 1 1 A 193 193 LYS CA C 193 60.644 60.052 0.592 1 1 2128 . 17 1 1 A 193 193 LYS CB C 193 32.607 32.182 0.425 1 1 2132 . 17 1 1 A 193 193 LYS N N 193 122.851 121.623 1.228 1 1 2133 . 17 1 1 A 194 194 LEU H H 194 8.570 7.981 0.589 1 1 2134 . 17 1 1 A 194 194 LEU HA H 194 3.845 4.126 -0.281 1 1 2144 . 17 1 1 A 194 194 LEU C C 194 177.965 179.332 -1.367 1 1 2145 . 17 1 1 A 194 194 LEU CA C 194 57.611 57.356 0.255 1 1 2146 . 17 1 1 A 194 194 LEU CB C 194 41.776 40.556 1.220 1 1 2150 . 17 1 1 A 194 194 LEU N N 194 115.801 119.390 -3.589 1 1 2151 . 17 1 1 A 195 195 MET H H 195 6.782 7.995 -1.213 1 1 2152 . 17 1 1 A 195 195 MET HA H 195 4.487 4.120 0.367 1 1 2160 . 17 1 1 A 195 195 MET C C 195 178.280 178.082 0.198 1 1 2161 . 17 1 1 A 195 195 MET CA C 195 56.858 58.314 -1.456 1 1 2162 . 17 1 1 A 195 195 MET CB C 195 31.557 32.209 -0.652 1 1 2165 . 17 1 1 A 195 195 MET N N 195 113.898 119.320 -5.422 1 1 2166 . 17 1 1 A 196 196 VAL H H 196 7.713 7.673 0.040 1 1 2167 . 17 1 1 A 196 196 VAL HA H 196 3.501 3.352 0.149 1 1 2175 . 17 1 1 A 196 196 VAL C C 196 177.624 177.671 -0.047 1 1 2176 . 17 1 1 A 196 196 VAL CA C 196 66.318 66.001 0.317 1 1 2177 . 17 1 1 A 196 196 VAL CB C 196 31.380 31.488 -0.108 1 1 2180 . 17 1 1 A 196 196 VAL N N 196 120.413 119.659 0.754 1 1 2181 . 17 1 1 A 197 197 TYR H H 197 7.972 8.148 -0.176 1 1 2182 . 17 1 1 A 197 197 TYR HA H 197 3.145 4.066 -0.921 1 1 2187 . 17 1 1 A 197 197 TYR C C 197 177.726 176.819 0.907 1 1 2188 . 17 1 1 A 197 197 TYR CA C 197 62.253 61.540 0.713 1 1 2189 . 17 1 1 A 197 197 TYR CB C 197 37.314 38.480 -1.166 1 1 2192 . 17 1 1 A 197 197 TYR N N 197 119.543 121.213 -1.670 1 1 2193 . 17 1 1 A 198 198 LEU H H 198 8.630 8.503 0.127 1 1 2194 . 17 1 1 A 198 198 LEU HA H 198 3.923 3.706 0.217 1 1 2203 . 17 1 1 A 198 198 LEU C C 198 178.074 178.851 -0.777 1 1 2204 . 17 1 1 A 198 198 LEU CA C 198 58.294 57.885 0.409 1 1 2205 . 17 1 1 A 198 198 LEU CB C 198 42.177 41.445 0.732 1 1 2209 . 17 1 1 A 198 198 LEU N N 198 118.430 119.740 -1.310 1 1 2210 . 17 1 1 A 199 199 GLN H H 199 8.082 8.222 -0.140 1 1 2211 . 17 1 1 A 199 199 GLN HA H 199 3.054 3.580 -0.526 1 1 2216 . 17 1 1 A 199 199 GLN C C 199 176.875 178.649 -1.774 1 1 2217 . 17 1 1 A 199 199 GLN CA C 199 59.739 58.964 0.775 1 1 2218 . 17 1 1 A 199 199 GLN CB C 199 28.055 27.699 0.356 1 1 2220 . 17 1 1 A 199 199 GLN N N 199 117.926 116.900 1.026 1 1 2222 . 17 1 1 A 200 200 ARG H H 200 7.349 7.775 -0.426 1 1 2223 . 17 1 1 A 200 200 ARG HA H 200 3.798 3.835 -0.037 1 1 2231 . 17 1 1 A 200 200 ARG C C 200 178.037 177.710 0.327 1 1 2232 . 17 1 1 A 200 200 ARG CA C 200 58.260 58.966 -0.706 1 1 2233 . 17 1 1 A 200 200 ARG CB C 200 30.706 30.249 0.457 1 1 2236 . 17 1 1 A 200 200 ARG N N 200 113.772 118.964 -5.192 1 1 2238 . 17 1 1 A 201 201 PHE H H 201 8.329 7.636 0.693 1 1 2239 . 17 1 1 A 201 201 PHE HA H 201 4.630 4.390 0.240 1 1 2244 . 17 1 1 A 201 201 PHE C C 201 176.606 176.189 0.417 1 1 2245 . 17 1 1 A 201 201 PHE CA C 201 59.014 58.561 0.453 1 1 2246 . 17 1 1 A 201 201 PHE CB C 201 40.357 40.108 0.249 1 1 2249 . 17 1 1 A 201 201 PHE N N 201 114.182 114.679 -0.497 1 1 2250 . 17 1 1 A 202 202 ARG H H 202 8.719 8.197 0.522 1 1 2251 . 17 1 1 A 202 202 ARG HA H 202 5.071 4.655 0.416 1 1 2261 . 17 1 1 A 202 202 ARG CA C 202 53.956 53.581 0.375 1 1 2262 . 17 1 1 A 202 202 ARG CB C 202 31.979 30.068 1.911 1 1 2264 . 17 1 1 A 202 202 ARG N N 202 120.115 114.528 5.587 1 1 2266 . 17 1 1 A 203 203 PRO HA H 203 4.348 4.507 -0.159 1 1 2271 . 17 1 1 A 203 203 PRO C C 203 179.736 178.848 0.888 1 1 2272 . 17 1 1 A 203 203 PRO CA C 203 65.674 65.381 0.293 1 1 2273 . 17 1 1 A 203 203 PRO CB C 203 31.717 32.052 -0.335 1 1 2275 . 17 1 1 A 204 204 LEU H H 204 8.875 7.540 1.335 1 1 2276 . 17 1 1 A 204 204 LEU HA H 204 4.291 3.997 0.294 1 1 2286 . 17 1 1 A 204 204 LEU C C 204 180.353 178.453 1.900 1 1 2287 . 17 1 1 A 204 204 LEU CA C 204 58.012 57.568 0.444 1 1 2288 . 17 1 1 A 204 204 LEU CB C 204 40.893 41.297 -0.404 1 1 2292 . 17 1 1 A 204 204 LEU N N 204 118.940 116.637 2.303 1 1 2293 . 17 1 1 A 205 205 ASP H H 205 7.541 8.320 -0.779 1 1 2294 . 17 1 1 A 205 205 ASP HA H 205 4.622 4.328 0.294 1 1 2297 . 17 1 1 A 205 205 ASP C C 205 177.602 177.873 -0.271 1 1 2298 . 17 1 1 A 205 205 ASP CA C 205 57.437 57.344 0.093 1 1 2299 . 17 1 1 A 205 205 ASP CB C 205 41.143 40.811 0.332 1 1 2300 . 17 1 1 A 205 205 ASP N N 205 120.838 119.498 1.340 1 1 2301 . 17 1 1 A 206 206 TYR H H 206 8.237 8.314 -0.077 1 1 2302 . 17 1 1 A 206 206 TYR HA H 206 4.018 4.115 -0.097 1 1 2307 . 17 1 1 A 206 206 TYR C C 206 176.433 178.003 -1.570 1 1 2308 . 17 1 1 A 206 206 TYR CA C 206 62.148 61.108 1.040 1 1 2309 . 17 1 1 A 206 206 TYR CB C 206 38.305 38.497 -0.192 1 1 2312 . 17 1 1 A 206 206 TYR N N 206 119.475 120.084 -0.609 1 1 2313 . 17 1 1 A 207 207 GLN H H 207 8.124 8.377 -0.253 1 1 2314 . 17 1 1 A 207 207 GLN HA H 207 3.823 3.119 0.704 1 1 2320 . 17 1 1 A 207 207 GLN C C 207 178.019 178.764 -0.745 1 1 2321 . 17 1 1 A 207 207 GLN CA C 207 58.841 59.002 -0.161 1 1 2322 . 17 1 1 A 207 207 GLN CB C 207 28.208 28.721 -0.513 1 1 2324 . 17 1 1 A 207 207 GLN N N 207 115.863 118.223 -2.360 1 1 2326 . 17 1 1 A 208 208 ARG H H 208 7.522 7.891 -0.369 1 1 2327 . 17 1 1 A 208 208 ARG HA H 208 4.127 4.048 0.079 1 1 2334 . 17 1 1 A 208 208 ARG C C 208 179.278 178.830 0.448 1 1 2335 . 17 1 1 A 208 208 ARG CA C 208 59.419 58.999 0.420 1 1 2336 . 17 1 1 A 208 208 ARG CB C 208 30.182 30.078 0.104 1 1 2338 . 17 1 1 A 208 208 ARG N N 208 118.471 119.628 -1.157 1 1 2340 . 17 1 1 A 209 209 LEU H H 209 7.869 7.579 0.290 1 1 2341 . 17 1 1 A 209 209 LEU HA H 209 4.091 4.093 -0.002 1 1 2351 . 17 1 1 A 209 209 LEU C C 209 179.715 178.150 1.565 1 1 2352 . 17 1 1 A 209 209 LEU CA C 209 57.891 58.072 -0.181 1 1 2353 . 17 1 1 A 209 209 LEU CB C 209 41.338 41.808 -0.470 1 1 2356 . 17 1 1 A 209 209 LEU N N 209 119.659 121.735 -2.076 1 1 2357 . 17 1 1 A 210 210 LEU H H 210 8.034 8.523 -0.489 1 1 2358 . 17 1 1 A 210 210 LEU HA H 210 3.977 3.990 -0.013 1 1 2367 . 17 1 1 A 210 210 LEU C C 210 180.363 178.425 1.938 1 1 2368 . 17 1 1 A 210 210 LEU CA C 210 57.459 58.459 -1.000 1 1 2369 . 17 1 1 A 210 210 LEU CB C 210 41.699 41.412 0.287 1 1 2373 . 17 1 1 A 210 210 LEU N N 210 120.967 119.549 1.418 1 1 2374 . 17 1 1 A 211 211 GLU H H 211 8.174 8.481 -0.307 1 1 2375 . 17 1 1 A 211 211 GLU HA H 211 4.075 4.023 0.052 1 1 2379 . 17 1 1 A 211 211 GLU C C 211 178.499 178.074 0.425 1 1 2380 . 17 1 1 A 211 211 GLU CA C 211 58.575 59.505 -0.930 1 1 2381 . 17 1 1 A 211 211 GLU CB C 211 29.583 29.061 0.522 1 1 2383 . 17 1 1 A 211 211 GLU N N 211 119.217 117.638 1.579 1 1 2384 . 17 1 1 A 212 212 ALA H H 212 7.723 7.934 -0.211 1 1 2385 . 17 1 1 A 212 212 ALA HA H 212 4.291 4.161 0.130 1 1 2389 . 17 1 1 A 212 212 ALA C C 212 178.770 178.616 0.154 1 1 2390 . 17 1 1 A 212 212 ALA CA C 212 53.966 53.189 0.777 1 1 2391 . 17 1 1 A 212 212 ALA CB C 212 19.117 18.898 0.219 1 1 2392 . 17 1 1 A 212 212 ALA N N 212 121.798 122.418 -0.620 1 1 2393 . 17 1 1 A 213 213 ALA H H 213 7.743 7.438 0.305 1 1 2394 . 17 1 1 A 213 213 ALA HA H 213 4.406 4.431 -0.025 1 1 2398 . 17 1 1 A 213 213 ALA C C 213 178.413 178.274 0.139 1 1 2399 . 17 1 1 A 213 213 ALA CA C 213 53.129 54.562 -1.433 1 1 2400 . 17 1 1 A 213 213 ALA CB C 213 18.926 20.111 -1.185 1 1 2401 . 17 1 1 A 213 213 ALA N N 213 120.435 120.193 0.242 1 1 2402 . 17 1 1 A 214 214 SER H H 214 7.944 8.268 -0.324 1 1 2403 . 17 1 1 A 214 214 SER HA H 214 4.559 4.301 0.258 1 1 2406 . 17 1 1 A 214 214 SER C C 214 174.958 174.078 0.880 1 1 2407 . 17 1 1 A 214 214 SER CA C 214 58.640 60.344 -1.704 1 1 2408 . 17 1 1 A 214 214 SER CB C 214 63.928 63.110 0.818 1 1 2409 . 17 1 1 A 214 214 SER N N 214 113.729 114.149 -0.420 1 1 2410 . 17 1 1 A 215 215 SER H H 215 8.255 8.446 -0.191 1 1 2411 . 17 1 1 A 215 215 SER HA H 215 4.547 4.090 0.457 1 1 2413 . 17 1 1 A 215 215 SER C C 215 175.289 173.375 1.914 1 1 2414 . 17 1 1 A 215 215 SER CA C 215 58.833 59.092 -0.259 1 1 2415 . 17 1 1 A 215 215 SER CB C 215 63.847 61.750 2.097 1 1 2416 . 17 1 1 A 215 215 SER N N 215 117.674 116.032 1.642 1 1 2417 . 17 1 1 A 216 216 GLY H H 216 8.431 8.008 0.423 1 1 2418 . 17 1 1 A 216 216 GLY HA2 H 216 4.054 4.202 -0.148 1 1 2419 . 17 1 1 A 216 216 GLY C C 216 174.189 171.821 2.368 1 1 2420 . 17 1 1 A 216 216 GLY CA C 216 45.412 45.441 -0.029 1 1 2421 . 17 1 1 A 216 216 GLY N N 216 110.800 109.548 1.252 1 1 2422 . 17 1 1 A 217 217 GLU H H 217 8.267 8.638 -0.371 1 1 2423 . 17 1 1 A 217 217 GLU HA H 217 4.345 5.145 -0.800 1 1 2427 . 17 1 1 A 217 217 GLU C C 217 176.428 174.706 1.722 1 1 2428 . 17 1 1 A 217 217 GLU CA C 217 56.470 55.257 1.213 1 1 2429 . 17 1 1 A 217 217 GLU CB C 217 30.526 33.720 -3.194 1 1 2430 . 17 1 1 A 217 217 GLU N N 217 120.726 119.578 1.148 1 1 2431 . 17 1 1 A 218 218 ALA H H 218 8.476 8.626 -0.150 1 1 2432 . 17 1 1 A 218 218 ALA HA H 218 4.467 4.879 -0.412 1 1 2436 . 17 1 1 A 218 218 ALA C C 218 178.015 176.329 1.686 1 1 2437 . 17 1 1 A 218 218 ALA CA C 218 52.547 50.794 1.753 1 1 2438 . 17 1 1 A 218 218 ALA CB C 218 19.242 22.301 -3.059 1 1 2439 . 17 1 1 A 218 218 ALA N N 218 125.534 125.448 0.086 1 1 2440 . 17 1 1 A 219 219 THR H H 219 8.232 8.559 -0.327 1 1 2441 . 17 1 1 A 219 219 THR HA H 219 4.411 4.061 0.350 1 1 2446 . 17 1 1 A 219 219 THR C C 219 175.327 174.583 0.744 1 1 2447 . 17 1 1 A 219 219 THR CA C 219 61.889 62.527 -0.638 1 1 2448 . 17 1 1 A 219 219 THR CB C 219 69.939 67.621 2.318 1 1 2449 . 17 1 1 A 219 219 THR N N 219 113.242 108.914 4.328 1 1 2450 . 17 1 1 A 220 220 GLY H H 220 8.418 8.838 -0.420 1 1 2451 . 17 1 1 A 220 220 GLY C C 220 174.037 172.971 1.066 1 1 2452 . 17 1 1 A 220 220 GLY CA C 220 45.408 46.569 -1.161 1 1 2453 . 17 1 1 A 220 220 GLY N N 220 111.031 113.727 -2.696 1 1 2454 . 17 1 1 A 221 221 ASP H H 221 8.345 7.714 0.631 1 1 2455 . 17 1 1 A 221 221 ASP HA H 221 4.700 5.181 -0.481 1 1 2458 . 17 1 1 A 221 221 ASP C C 221 176.535 175.339 1.196 1 1 2459 . 17 1 1 A 221 221 ASP CA C 221 54.402 52.959 1.443 1 1 2460 . 17 1 1 A 221 221 ASP CB C 221 41.431 44.224 -2.793 1 1 2461 . 17 1 1 A 221 221 ASP N N 221 120.795 121.471 -0.676 1 1 2462 . 17 1 1 A 222 222 SER H H 222 8.353 9.225 -0.872 1 1 2463 . 17 1 1 A 222 222 SER HA H 222 4.493 4.603 -0.110 1 1 2465 . 17 1 1 A 222 222 SER C C 222 174.224 173.271 0.953 1 1 2466 . 17 1 1 A 222 222 SER CA C 222 58.427 59.871 -1.444 1 1 2467 . 17 1 1 A 222 222 SER CB C 222 63.860 64.947 -1.087 1 1 2468 . 17 1 1 A 222 222 SER N N 222 116.220 118.617 -2.397 1 1 2469 . 17 1 1 A 223 223 ALA H H 223 8.381 7.655 0.726 1 1 2470 . 17 1 1 A 223 223 ALA HA H 223 4.461 4.562 -0.101 1 1 2474 . 17 1 1 A 223 223 ALA C C 223 176.926 175.578 1.348 1 1 2475 . 17 1 1 A 223 223 ALA CA C 223 52.583 51.450 1.133 1 1 2476 . 17 1 1 A 223 223 ALA CB C 223 19.438 22.239 -2.801 1 1 2477 . 17 1 1 A 223 223 ALA N N 223 126.592 119.811 6.781 1 1 1 . 18 1 1 A 2 2 ALA HA H 2 4.274 3.872 0.402 1 1 5 . 18 1 1 A 2 2 ALA C C 2 177.828 176.724 1.104 1 1 6 . 18 1 1 A 2 2 ALA CA C 2 52.984 54.936 -1.952 1 1 7 . 18 1 1 A 2 2 ALA CB C 2 19.138 17.858 1.280 1 1 8 . 18 1 1 A 3 3 GLN H H 3 8.463 8.333 0.130 1 1 9 . 18 1 1 A 3 3 GLN HA H 3 4.676 4.342 0.334 1 1 12 . 18 1 1 A 3 3 GLN C C 3 176.002 176.890 -0.888 1 1 13 . 18 1 1 A 3 3 GLN CA C 3 56.258 57.106 -0.848 1 1 14 . 18 1 1 A 3 3 GLN CB C 3 30.346 29.213 1.133 1 1 15 . 18 1 1 A 3 3 GLN N N 3 117.490 117.256 0.234 1 1 16 . 18 1 1 A 4 4 GLY H H 4 8.099 8.751 -0.652 1 1 17 . 18 1 1 A 4 4 GLY HA2 H 4 3.910 3.851 0.059 1 1 18 . 18 1 1 A 4 4 GLY C C 4 173.332 173.799 -0.467 1 1 19 . 18 1 1 A 4 4 GLY CA C 4 45.333 47.218 -1.885 1 1 20 . 18 1 1 A 4 4 GLY N N 4 109.423 110.844 -1.421 1 1 21 . 18 1 1 A 5 5 LEU H H 5 7.863 8.536 -0.673 1 1 22 . 18 1 1 A 5 5 LEU HA H 5 4.561 4.480 0.081 1 1 32 . 18 1 1 A 5 5 LEU C C 5 176.448 175.689 0.759 1 1 33 . 18 1 1 A 5 5 LEU CA C 5 54.713 54.497 0.216 1 1 34 . 18 1 1 A 5 5 LEU CB C 5 43.551 41.338 2.213 1 1 38 . 18 1 1 A 5 5 LEU N N 5 120.391 125.650 -5.259 1 1 39 . 18 1 1 A 6 6 ILE H H 6 8.764 9.468 -0.704 1 1 40 . 18 1 1 A 6 6 ILE HA H 6 4.087 4.335 -0.248 1 1 49 . 18 1 1 A 6 6 ILE C C 6 174.679 175.427 -0.748 1 1 50 . 18 1 1 A 6 6 ILE CA C 6 61.279 61.176 0.103 1 1 51 . 18 1 1 A 6 6 ILE CB C 6 39.651 37.706 1.945 1 1 54 . 18 1 1 A 6 6 ILE N N 6 123.050 125.305 -2.255 1 1 55 . 18 1 1 A 7 7 GLU H H 7 8.587 8.716 -0.129 1 1 56 . 18 1 1 A 7 7 GLU HA H 7 4.917 4.883 0.034 1 1 61 . 18 1 1 A 7 7 GLU C C 7 175.978 176.125 -0.147 1 1 62 . 18 1 1 A 7 7 GLU CA C 7 56.127 55.899 0.228 1 1 63 . 18 1 1 A 7 7 GLU CB C 7 31.115 30.162 0.953 1 1 65 . 18 1 1 A 7 7 GLU N N 7 127.415 127.834 -0.419 1 1 66 . 18 1 1 A 8 8 VAL H H 8 8.986 9.159 -0.173 1 1 67 . 18 1 1 A 8 8 VAL HA H 8 4.375 4.921 -0.546 1 1 72 . 18 1 1 A 8 8 VAL C C 8 173.704 175.346 -1.642 1 1 73 . 18 1 1 A 8 8 VAL CA C 8 61.347 60.960 0.387 1 1 74 . 18 1 1 A 8 8 VAL CB C 8 33.611 33.430 0.181 1 1 76 . 18 1 1 A 8 8 VAL N N 8 126.071 119.941 6.130 1 1 77 . 18 1 1 A 9 9 GLU H H 9 8.521 9.148 -0.627 1 1 78 . 18 1 1 A 9 9 GLU HA H 9 5.837 5.458 0.379 1 1 81 . 18 1 1 A 9 9 GLU C C 9 175.939 175.214 0.725 1 1 82 . 18 1 1 A 9 9 GLU CA C 9 54.516 54.692 -0.176 1 1 83 . 18 1 1 A 9 9 GLU CB C 9 33.009 33.112 -0.103 1 1 84 . 18 1 1 A 9 9 GLU N N 9 122.857 124.245 -1.388 1 1 85 . 18 1 1 A 10 10 ARG H H 10 8.690 8.722 -0.032 1 1 86 . 18 1 1 A 10 10 ARG HA H 10 4.709 5.138 -0.429 1 1 94 . 18 1 1 A 10 10 ARG C C 10 174.826 174.725 0.101 1 1 95 . 18 1 1 A 10 10 ARG CA C 10 54.491 54.183 0.308 1 1 96 . 18 1 1 A 10 10 ARG CB C 10 35.777 35.107 0.670 1 1 98 . 18 1 1 A 10 10 ARG N N 10 120.430 121.846 -1.416 1 1 100 . 18 1 1 A 11 11 LYS H H 11 8.874 8.771 0.103 1 1 101 . 18 1 1 A 11 11 LYS HA H 11 5.530 5.285 0.245 1 1 107 . 18 1 1 A 11 11 LYS C C 11 176.919 174.632 2.287 1 1 108 . 18 1 1 A 11 11 LYS CA C 11 55.084 55.113 -0.029 1 1 109 . 18 1 1 A 11 11 LYS CB C 11 35.435 36.936 -1.501 1 1 113 . 18 1 1 A 11 11 LYS N N 11 121.087 123.302 -2.215 1 1 114 . 18 1 1 A 12 12 PHE H H 12 8.877 8.881 -0.004 1 1 115 . 18 1 1 A 12 12 PHE HA H 12 5.130 5.100 0.030 1 1 120 . 18 1 1 A 12 12 PHE C C 12 171.676 172.097 -0.421 1 1 121 . 18 1 1 A 12 12 PHE CA C 12 55.869 56.397 -0.528 1 1 122 . 18 1 1 A 12 12 PHE CB C 12 42.108 41.641 0.467 1 1 125 . 18 1 1 A 12 12 PHE N N 12 117.486 119.676 -2.190 1 1 126 . 18 1 1 A 13 13 ALA H H 13 9.134 9.262 -0.128 1 1 127 . 18 1 1 A 13 13 ALA HA H 13 5.003 4.700 0.303 1 1 131 . 18 1 1 A 13 13 ALA CA C 13 48.340 48.879 -0.539 1 1 132 . 18 1 1 A 13 13 ALA CB C 13 19.191 20.225 -1.034 1 1 133 . 18 1 1 A 13 13 ALA N N 13 125.915 122.922 2.993 1 1 134 . 18 1 1 A 14 14 PRO HA H 14 4.620 4.993 -0.373 1 1 140 . 18 1 1 A 14 14 PRO C C 14 176.502 177.284 -0.782 1 1 141 . 18 1 1 A 14 14 PRO CA C 14 62.672 62.347 0.325 1 1 142 . 18 1 1 A 14 14 PRO CB C 14 33.119 32.521 0.598 1 1 145 . 18 1 1 A 15 15 GLY H H 15 8.721 8.440 0.281 1 1 146 . 18 1 1 A 15 15 GLY HA2 H 15 3.999 4.103 -0.104 1 1 147 . 18 1 1 A 15 15 GLY HA3 H 15 4.632 4.105 0.527 1 1 148 . 18 1 1 A 15 15 GLY CA C 15 44.411 44.000 0.411 1 1 149 . 18 1 1 A 15 15 GLY N N 15 109.863 107.927 1.936 1 1 150 . 18 1 1 A 16 16 PRO HA H 16 4.447 4.508 -0.061 1 1 155 . 18 1 1 A 16 16 PRO C C 16 177.053 176.853 0.200 1 1 156 . 18 1 1 A 16 16 PRO CA C 16 64.395 64.165 0.230 1 1 157 . 18 1 1 A 16 16 PRO CB C 16 31.993 31.486 0.507 1 1 159 . 18 1 1 A 17 17 ASP H H 17 8.550 8.512 0.038 1 1 160 . 18 1 1 A 17 17 ASP HA H 17 4.950 4.902 0.048 1 1 163 . 18 1 1 A 17 17 ASP C C 17 176.800 177.213 -0.413 1 1 164 . 18 1 1 A 17 17 ASP CA C 17 53.271 53.215 0.056 1 1 165 . 18 1 1 A 17 17 ASP CB C 17 40.392 40.961 -0.569 1 1 166 . 18 1 1 A 17 17 ASP N N 17 116.060 116.186 -0.126 1 1 167 . 18 1 1 A 18 18 THR H H 18 7.664 7.297 0.367 1 1 168 . 18 1 1 A 18 18 THR HA H 18 4.120 3.740 0.380 1 1 174 . 18 1 1 A 18 18 THR C C 18 175.407 176.476 -1.069 1 1 175 . 18 1 1 A 18 18 THR CA C 18 68.718 67.222 1.496 1 1 176 . 18 1 1 A 18 18 THR CB C 18 69.179 68.493 0.686 1 1 178 . 18 1 1 A 18 18 THR N N 18 117.158 115.944 1.214 1 1 179 . 18 1 1 A 19 19 GLU H H 19 8.817 8.541 0.276 1 1 180 . 18 1 1 A 19 19 GLU HA H 19 3.510 3.383 0.127 1 1 184 . 18 1 1 A 19 19 GLU C C 19 178.345 179.338 -0.993 1 1 185 . 18 1 1 A 19 19 GLU CA C 19 61.237 59.867 1.370 1 1 186 . 18 1 1 A 19 19 GLU CB C 19 28.746 29.381 -0.635 1 1 188 . 18 1 1 A 19 19 GLU N N 19 118.802 118.724 0.078 1 1 189 . 18 1 1 A 20 20 GLU H H 20 7.976 8.092 -0.116 1 1 190 . 18 1 1 A 20 20 GLU HA H 20 4.036 4.127 -0.091 1 1 194 . 18 1 1 A 20 20 GLU C C 20 179.451 179.016 0.435 1 1 195 . 18 1 1 A 20 20 GLU CA C 20 59.909 59.060 0.849 1 1 196 . 18 1 1 A 20 20 GLU CB C 20 28.992 29.404 -0.412 1 1 198 . 18 1 1 A 20 20 GLU N N 20 121.130 119.908 1.222 1 1 199 . 18 1 1 A 21 21 ARG H H 21 8.199 7.973 0.226 1 1 200 . 18 1 1 A 21 21 ARG HA H 21 4.061 3.988 0.073 1 1 207 . 18 1 1 A 21 21 ARG C C 21 179.087 178.664 0.423 1 1 208 . 18 1 1 A 21 21 ARG CA C 21 58.477 58.822 -0.345 1 1 209 . 18 1 1 A 21 21 ARG CB C 21 30.101 29.778 0.323 1 1 211 . 18 1 1 A 21 21 ARG N N 21 119.897 120.509 -0.612 1 1 213 . 18 1 1 A 22 22 LEU H H 22 8.154 8.581 -0.427 1 1 214 . 18 1 1 A 22 22 LEU HA H 22 3.560 3.739 -0.179 1 1 224 . 18 1 1 A 22 22 LEU C C 22 178.461 179.053 -0.592 1 1 225 . 18 1 1 A 22 22 LEU CA C 22 58.432 57.552 0.880 1 1 226 . 18 1 1 A 22 22 LEU CB C 22 40.229 40.826 -0.597 1 1 230 . 18 1 1 A 22 22 LEU N N 22 120.012 119.731 0.281 1 1 231 . 18 1 1 A 23 23 GLN H H 23 7.621 7.808 -0.187 1 1 232 . 18 1 1 A 23 23 GLN HA H 23 4.232 4.022 0.210 1 1 238 . 18 1 1 A 23 23 GLN C C 23 180.543 177.838 2.705 1 1 239 . 18 1 1 A 23 23 GLN CA C 23 59.434 59.201 0.233 1 1 240 . 18 1 1 A 23 23 GLN CB C 23 28.749 28.469 0.280 1 1 242 . 18 1 1 A 23 23 GLN N N 23 117.823 117.501 0.322 1 1 244 . 18 1 1 A 24 24 GLU H H 24 8.165 7.812 0.353 1 1 245 . 18 1 1 A 24 24 GLU HA H 24 4.072 4.179 -0.107 1 1 249 . 18 1 1 A 24 24 GLU C C 24 178.612 179.153 -0.541 1 1 250 . 18 1 1 A 24 24 GLU CA C 24 59.236 58.870 0.366 1 1 251 . 18 1 1 A 24 24 GLU CB C 24 29.606 29.457 0.149 1 1 253 . 18 1 1 A 24 24 GLU N N 24 122.589 119.504 3.085 1 1 254 . 18 1 1 A 25 25 LEU H H 25 7.911 8.060 -0.149 1 1 255 . 18 1 1 A 25 25 LEU HA H 25 4.214 4.107 0.107 1 1 265 . 18 1 1 A 25 25 LEU C C 25 176.745 177.358 -0.613 1 1 266 . 18 1 1 A 25 25 LEU CA C 25 55.659 55.834 -0.175 1 1 267 . 18 1 1 A 25 25 LEU CB C 25 43.109 42.642 0.467 1 1 271 . 18 1 1 A 25 25 LEU N N 25 117.882 117.061 0.821 1 1 272 . 18 1 1 A 26 26 GLY H H 26 7.776 7.908 -0.132 1 1 273 . 18 1 1 A 26 26 GLY HA2 H 26 4.337 4.028 0.309 1 1 274 . 18 1 1 A 26 26 GLY HA3 H 26 3.856 4.042 -0.186 1 1 275 . 18 1 1 A 26 26 GLY C C 26 175.456 174.588 0.868 1 1 276 . 18 1 1 A 26 26 GLY CA C 26 44.875 45.244 -0.369 1 1 277 . 18 1 1 A 26 26 GLY N N 26 104.938 105.767 -0.829 1 1 278 . 18 1 1 A 27 27 ALA H H 27 8.104 8.450 -0.346 1 1 279 . 18 1 1 A 27 27 ALA HA H 27 4.949 4.534 0.415 1 1 283 . 18 1 1 A 27 27 ALA C C 27 176.448 178.123 -1.675 1 1 284 . 18 1 1 A 27 27 ALA CA C 27 52.183 52.396 -0.213 1 1 285 . 18 1 1 A 27 27 ALA CB C 27 21.814 20.151 1.663 1 1 286 . 18 1 1 A 27 27 ALA N N 27 123.263 124.453 -1.190 1 1 287 . 18 1 1 A 28 28 THR H H 28 9.369 9.103 0.266 1 1 288 . 18 1 1 A 28 28 THR HA H 28 4.779 5.031 -0.252 1 1 293 . 18 1 1 A 28 28 THR C C 28 173.725 173.746 -0.021 1 1 294 . 18 1 1 A 28 28 THR CA C 28 60.046 60.330 -0.284 1 1 295 . 18 1 1 A 28 28 THR CB C 28 70.592 70.401 0.191 1 1 297 . 18 1 1 A 28 28 THR N N 28 112.201 111.237 0.964 1 1 298 . 18 1 1 A 29 29 LEU H H 29 8.518 8.675 -0.157 1 1 299 . 18 1 1 A 29 29 LEU HA H 29 3.332 3.990 -0.658 1 1 309 . 18 1 1 A 29 29 LEU C C 29 176.202 176.487 -0.285 1 1 310 . 18 1 1 A 29 29 LEU CA C 29 55.031 54.168 0.863 1 1 311 . 18 1 1 A 29 29 LEU CB C 29 40.624 41.501 -0.877 1 1 315 . 18 1 1 A 29 29 LEU N N 29 128.151 126.117 2.034 1 1 316 . 18 1 1 A 30 30 GLU H H 30 9.269 8.988 0.281 1 1 317 . 18 1 1 A 30 30 GLU HA H 30 4.287 4.275 0.012 1 1 321 . 18 1 1 A 30 30 GLU C C 30 176.740 175.866 0.874 1 1 322 . 18 1 1 A 30 30 GLU CA C 30 57.283 57.375 -0.092 1 1 323 . 18 1 1 A 30 30 GLU CB C 30 31.045 30.461 0.584 1 1 325 . 18 1 1 A 30 30 GLU N N 30 130.123 122.797 7.326 1 1 326 . 18 1 1 A 31 31 HIS H H 31 7.341 7.330 0.011 1 1 327 . 18 1 1 A 31 31 HIS HA H 31 4.701 5.144 -0.443 1 1 331 . 18 1 1 A 31 31 HIS C C 31 172.581 173.243 -0.662 1 1 332 . 18 1 1 A 31 31 HIS CA C 31 55.876 54.605 1.271 1 1 333 . 18 1 1 A 31 31 HIS CB C 31 33.434 34.033 -0.599 1 1 334 . 18 1 1 A 31 31 HIS N N 31 113.223 116.326 -3.103 1 1 335 . 18 1 1 A 32 32 ARG H H 32 8.196 8.650 -0.454 1 1 336 . 18 1 1 A 32 32 ARG HA H 32 5.262 4.868 0.394 1 1 341 . 18 1 1 A 32 32 ARG C C 32 174.377 174.183 0.194 1 1 342 . 18 1 1 A 32 32 ARG CA C 32 55.808 55.049 0.759 1 1 343 . 18 1 1 A 32 32 ARG CB C 32 33.340 33.859 -0.519 1 1 345 . 18 1 1 A 32 32 ARG N N 32 123.003 122.540 0.463 1 1 346 . 18 1 1 A 33 33 VAL H H 33 8.956 9.435 -0.479 1 1 347 . 18 1 1 A 33 33 VAL HA H 33 4.734 4.997 -0.263 1 1 355 . 18 1 1 A 33 33 VAL C C 33 172.821 175.076 -2.255 1 1 356 . 18 1 1 A 33 33 VAL CA C 33 60.197 61.127 -0.930 1 1 357 . 18 1 1 A 33 33 VAL CB C 33 35.860 34.630 1.230 1 1 360 . 18 1 1 A 33 33 VAL N N 33 122.929 126.471 -3.542 1 1 361 . 18 1 1 A 34 34 THR H H 34 8.250 8.770 -0.520 1 1 362 . 18 1 1 A 34 34 THR HA H 34 5.616 5.742 -0.126 1 1 367 . 18 1 1 A 34 34 THR C C 34 173.913 173.503 0.410 1 1 368 . 18 1 1 A 34 34 THR CA C 34 60.245 60.454 -0.209 1 1 369 . 18 1 1 A 34 34 THR CB C 34 71.706 71.138 0.568 1 1 371 . 18 1 1 A 34 34 THR N N 34 119.164 119.751 -0.587 1 1 372 . 18 1 1 A 35 35 PHE H H 35 8.565 8.777 -0.212 1 1 373 . 18 1 1 A 35 35 PHE HA H 35 5.029 5.042 -0.013 1 1 378 . 18 1 1 A 35 35 PHE C C 35 173.193 171.856 1.337 1 1 379 . 18 1 1 A 35 35 PHE CA C 35 55.687 56.174 -0.487 1 1 380 . 18 1 1 A 35 35 PHE CB C 35 40.853 40.682 0.171 1 1 383 . 18 1 1 A 35 35 PHE N N 35 120.244 118.310 1.934 1 1 384 . 18 1 1 A 36 36 ARG H H 36 8.869 8.701 0.168 1 1 385 . 18 1 1 A 36 36 ARG HA H 36 4.982 4.846 0.136 1 1 387 . 18 1 1 A 36 36 ARG C C 36 174.743 174.299 0.444 1 1 388 . 18 1 1 A 36 36 ARG CA C 36 55.493 53.519 1.974 1 1 389 . 18 1 1 A 36 36 ARG CB C 36 32.228 33.680 -1.452 1 1 390 . 18 1 1 A 36 36 ARG N N 36 123.893 120.118 3.775 1 1 391 . 18 1 1 A 37 37 ASP H H 37 8.402 8.721 -0.319 1 1 392 . 18 1 1 A 37 37 ASP HA H 37 5.462 5.183 0.279 1 1 395 . 18 1 1 A 37 37 ASP C C 37 175.177 174.730 0.447 1 1 396 . 18 1 1 A 37 37 ASP CA C 37 53.942 52.979 0.963 1 1 397 . 18 1 1 A 37 37 ASP CB C 37 45.486 42.434 3.052 1 1 398 . 18 1 1 A 37 37 ASP N N 37 127.149 125.729 1.420 1 1 399 . 18 1 1 A 38 38 THR H H 38 8.151 8.334 -0.183 1 1 400 . 18 1 1 A 38 38 THR HA H 38 4.866 5.449 -0.583 1 1 405 . 18 1 1 A 38 38 THR C C 38 172.792 173.289 -0.497 1 1 406 . 18 1 1 A 38 38 THR CA C 38 61.416 60.776 0.640 1 1 407 . 18 1 1 A 38 38 THR CB C 38 71.047 70.510 0.537 1 1 409 . 18 1 1 A 38 38 THR N N 38 115.686 116.162 -0.476 1 1 410 . 18 1 1 A 39 39 TYR H H 39 9.021 9.595 -0.574 1 1 411 . 18 1 1 A 39 39 TYR HA H 39 5.544 5.973 -0.429 1 1 416 . 18 1 1 A 39 39 TYR C C 39 176.032 174.765 1.267 1 1 417 . 18 1 1 A 39 39 TYR CA C 39 57.184 56.854 0.330 1 1 418 . 18 1 1 A 39 39 TYR CB C 39 41.642 41.142 0.500 1 1 420 . 18 1 1 A 39 39 TYR N N 39 124.579 124.870 -0.291 1 1 421 . 18 1 1 A 40 40 TYR H H 40 8.487 9.135 -0.648 1 1 422 . 18 1 1 A 40 40 TYR HA H 40 5.517 5.857 -0.340 1 1 426 . 18 1 1 A 40 40 TYR C C 40 174.108 174.233 -0.125 1 1 427 . 18 1 1 A 40 40 TYR CA C 40 56.979 56.673 0.306 1 1 428 . 18 1 1 A 40 40 TYR CB C 40 44.132 43.667 0.465 1 1 431 . 18 1 1 A 40 40 TYR N N 40 119.709 120.975 -1.266 1 1 432 . 18 1 1 A 41 41 ASP H H 41 9.341 8.620 0.721 1 1 433 . 18 1 1 A 41 41 ASP HA H 41 4.866 5.176 -0.310 1 1 436 . 18 1 1 A 41 41 ASP C C 41 177.262 175.155 2.107 1 1 437 . 18 1 1 A 41 41 ASP CA C 41 53.445 53.422 0.023 1 1 438 . 18 1 1 A 41 41 ASP CB C 41 45.347 44.760 0.587 1 1 439 . 18 1 1 A 41 41 ASP N N 41 117.995 120.287 -2.292 1 1 440 . 18 1 1 A 42 42 THR H H 42 11.574 8.690 2.884 1 1 441 . 18 1 1 A 42 42 THR HA H 42 5.206 4.621 0.585 1 1 446 . 18 1 1 A 42 42 THR C C 42 177.935 176.056 1.879 1 1 447 . 18 1 1 A 42 42 THR CA C 42 60.400 62.067 -1.667 1 1 448 . 18 1 1 A 42 42 THR CB C 42 72.114 69.708 2.406 1 1 450 . 18 1 1 A 42 42 THR N N 42 114.394 117.230 -2.836 1 1 451 . 18 1 1 A 43 43 SER H H 43 9.715 9.047 0.668 1 1 452 . 18 1 1 A 43 43 SER HA H 43 4.252 4.149 0.103 1 1 455 . 18 1 1 A 43 43 SER C C 43 175.478 174.896 0.582 1 1 456 . 18 1 1 A 43 43 SER CA C 43 61.277 60.761 0.516 1 1 457 . 18 1 1 A 43 43 SER CB C 43 62.821 62.639 0.182 1 1 458 . 18 1 1 A 43 43 SER N N 43 116.674 119.272 -2.598 1 1 459 . 18 1 1 A 44 44 GLU H H 44 7.674 7.963 -0.289 1 1 460 . 18 1 1 A 44 44 GLU HA H 44 4.330 4.301 0.029 1 1 464 . 18 1 1 A 44 44 GLU C C 44 175.001 175.977 -0.976 1 1 465 . 18 1 1 A 44 44 GLU CA C 44 55.992 55.247 0.745 1 1 466 . 18 1 1 A 44 44 GLU CB C 44 29.276 29.042 0.234 1 1 468 . 18 1 1 A 44 44 GLU N N 44 117.856 116.514 1.342 1 1 469 . 18 1 1 A 45 45 LEU H H 45 8.222 8.004 0.218 1 1 470 . 18 1 1 A 45 45 LEU HA H 45 3.901 4.738 -0.837 1 1 480 . 18 1 1 A 45 45 LEU C C 45 175.209 176.528 -1.319 1 1 481 . 18 1 1 A 45 45 LEU CA C 45 55.548 56.011 -0.463 1 1 482 . 18 1 1 A 45 45 LEU CB C 45 38.458 39.858 -1.400 1 1 485 . 18 1 1 A 45 45 LEU N N 45 119.335 116.947 2.388 1 1 486 . 18 1 1 A 46 46 SER H H 46 7.347 7.519 -0.172 1 1 487 . 18 1 1 A 46 46 SER HA H 46 3.954 4.179 -0.225 1 1 489 . 18 1 1 A 46 46 SER C C 46 177.497 176.523 0.974 1 1 490 . 18 1 1 A 46 46 SER CA C 46 62.471 62.150 0.321 1 1 491 . 18 1 1 A 46 46 SER CB C 46 63.908 63.258 0.650 1 1 492 . 18 1 1 A 46 46 SER N N 46 111.433 112.584 -1.151 1 1 493 . 18 1 1 A 47 47 LEU H H 47 12.003 8.488 3.515 1 1 494 . 18 1 1 A 47 47 LEU HA H 47 3.959 4.147 -0.188 1 1 504 . 18 1 1 A 47 47 LEU C C 47 180.340 178.305 2.035 1 1 505 . 18 1 1 A 47 47 LEU CA C 47 58.879 57.927 0.952 1 1 506 . 18 1 1 A 47 47 LEU CB C 47 39.572 41.864 -2.292 1 1 510 . 18 1 1 A 47 47 LEU N N 47 124.605 122.932 1.673 1 1 511 . 18 1 1 A 48 48 MET H H 48 10.599 8.505 2.094 1 1 512 . 18 1 1 A 48 48 MET HA H 48 3.213 3.867 -0.654 1 1 520 . 18 1 1 A 48 48 MET C C 48 181.177 178.295 2.882 1 1 521 . 18 1 1 A 48 48 MET CA C 48 60.747 58.631 2.116 1 1 522 . 18 1 1 A 48 48 MET CB C 48 32.594 32.171 0.423 1 1 525 . 18 1 1 A 48 48 MET N N 48 126.254 116.706 9.548 1 1 526 . 18 1 1 A 49 49 LEU H H 49 8.731 7.858 0.873 1 1 527 . 18 1 1 A 49 49 LEU HA H 49 4.097 4.159 -0.062 1 1 536 . 18 1 1 A 49 49 LEU C C 49 178.144 177.176 0.968 1 1 537 . 18 1 1 A 49 49 LEU CA C 49 57.800 56.528 1.272 1 1 538 . 18 1 1 A 49 49 LEU CB C 49 41.379 41.672 -0.293 1 1 541 . 18 1 1 A 49 49 LEU N N 49 119.183 121.369 -2.186 1 1 542 . 18 1 1 A 50 50 SER H H 50 7.853 7.265 0.588 1 1 543 . 18 1 1 A 50 50 SER HA H 50 4.822 4.536 0.286 1 1 546 . 18 1 1 A 50 50 SER C C 50 174.539 172.748 1.791 1 1 547 . 18 1 1 A 50 50 SER CA C 50 57.811 58.139 -0.328 1 1 548 . 18 1 1 A 50 50 SER CB C 50 64.443 63.398 1.045 1 1 549 . 18 1 1 A 50 50 SER N N 50 114.594 112.497 2.097 1 1 550 . 18 1 1 A 51 51 ASP H H 51 8.264 7.840 0.424 1 1 551 . 18 1 1 A 51 51 ASP HA H 51 4.362 3.751 0.611 1 1 554 . 18 1 1 A 51 51 ASP C C 51 172.921 174.348 -1.427 1 1 555 . 18 1 1 A 51 51 ASP CA C 51 55.343 55.163 0.180 1 1 556 . 18 1 1 A 51 51 ASP CB C 51 40.583 39.272 1.311 1 1 557 . 18 1 1 A 51 51 ASP N N 51 123.003 117.491 5.512 1 1 558 . 18 1 1 A 52 52 HIS H H 52 7.869 7.083 0.786 1 1 559 . 18 1 1 A 52 52 HIS HA H 52 5.335 5.277 0.058 1 1 564 . 18 1 1 A 52 52 HIS C C 52 173.991 173.762 0.229 1 1 565 . 18 1 1 A 52 52 HIS CA C 52 55.889 54.384 1.505 1 1 566 . 18 1 1 A 52 52 HIS CB C 52 31.789 29.868 1.921 1 1 568 . 18 1 1 A 52 52 HIS N N 52 112.486 117.157 -4.671 1 1 569 . 18 1 1 A 53 53 TRP H H 53 8.165 8.899 -0.734 1 1 570 . 18 1 1 A 53 53 TRP HA H 53 4.926 5.294 -0.368 1 1 578 . 18 1 1 A 53 53 TRP C C 53 175.354 175.520 -0.166 1 1 579 . 18 1 1 A 53 53 TRP CA C 53 55.364 56.267 -0.903 1 1 580 . 18 1 1 A 53 53 TRP CB C 53 30.641 30.830 -0.189 1 1 585 . 18 1 1 A 53 53 TRP N N 53 117.916 125.596 -7.680 1 1 587 . 18 1 1 A 54 54 LEU H H 54 10.088 9.216 0.872 1 1 588 . 18 1 1 A 54 54 LEU HA H 54 5.497 5.584 -0.087 1 1 598 . 18 1 1 A 54 54 LEU C C 54 173.337 175.528 -2.191 1 1 599 . 18 1 1 A 54 54 LEU CA C 54 54.408 54.458 -0.050 1 1 600 . 18 1 1 A 54 54 LEU CB C 54 44.156 44.323 -0.167 1 1 604 . 18 1 1 A 54 54 LEU N N 54 130.826 127.214 3.612 1 1 605 . 18 1 1 A 55 55 ARG H H 55 9.289 9.544 -0.255 1 1 606 . 18 1 1 A 55 55 ARG HA H 55 5.482 5.393 0.089 1 1 612 . 18 1 1 A 55 55 ARG C C 55 174.057 173.415 0.642 1 1 613 . 18 1 1 A 55 55 ARG CA C 55 53.167 54.105 -0.938 1 1 614 . 18 1 1 A 55 55 ARG CB C 55 34.270 34.231 0.039 1 1 616 . 18 1 1 A 55 55 ARG N N 55 125.089 128.125 -3.036 1 1 618 . 18 1 1 A 56 56 GLN H H 56 9.092 8.591 0.501 1 1 619 . 18 1 1 A 56 56 GLN HA H 56 3.991 4.705 -0.714 1 1 626 . 18 1 1 A 56 56 GLN C C 56 174.199 174.148 0.051 1 1 627 . 18 1 1 A 56 56 GLN CA C 56 54.566 53.770 0.796 1 1 628 . 18 1 1 A 56 56 GLN CB C 56 29.643 30.425 -0.782 1 1 630 . 18 1 1 A 56 56 GLN N N 56 124.355 125.078 -0.723 1 1 632 . 18 1 1 A 57 57 ARG H H 57 8.440 8.650 -0.210 1 1 633 . 18 1 1 A 57 57 ARG HA H 57 5.316 4.451 0.865 1 1 639 . 18 1 1 A 57 57 ARG C C 57 176.188 176.440 -0.252 1 1 640 . 18 1 1 A 57 57 ARG CA C 57 53.940 55.775 -1.835 1 1 641 . 18 1 1 A 57 57 ARG CB C 57 32.426 30.285 2.141 1 1 643 . 18 1 1 A 57 57 ARG N N 57 130.222 127.333 2.889 1 1 645 . 18 1 1 A 58 58 GLU H H 58 8.891 9.214 -0.323 1 1 646 . 18 1 1 A 58 58 GLU HA H 58 3.996 4.192 -0.196 1 1 649 . 18 1 1 A 58 58 GLU CA C 58 58.364 58.523 -0.159 1 1 650 . 18 1 1 A 58 58 GLU CB C 58 30.875 29.247 1.628 1 1 651 . 18 1 1 A 58 58 GLU N N 58 131.208 125.407 5.801 1 1 652 . 18 1 1 A 59 59 GLY H H 59 8.367 8.270 0.097 1 1 653 . 18 1 1 A 59 59 GLY HA2 H 59 4.334 3.994 0.340 1 1 654 . 18 1 1 A 59 59 GLY HA3 H 59 3.743 4.088 -0.345 1 1 655 . 18 1 1 A 59 59 GLY C C 59 174.194 175.437 -1.243 1 1 656 . 18 1 1 A 59 59 GLY CA C 59 45.666 45.556 0.110 1 1 657 . 18 1 1 A 60 60 SER H H 60 8.071 8.835 -0.764 1 1 658 . 18 1 1 A 60 60 SER HA H 60 4.730 4.414 0.316 1 1 661 . 18 1 1 A 60 60 SER C C 60 173.908 174.339 -0.431 1 1 662 . 18 1 1 A 60 60 SER CA C 60 58.762 59.744 -0.982 1 1 663 . 18 1 1 A 60 60 SER CB C 60 64.497 64.124 0.373 1 1 664 . 18 1 1 A 60 60 SER N N 60 114.636 113.539 1.097 1 1 665 . 18 1 1 A 61 61 GLY H H 61 8.401 6.717 1.684 1 1 666 . 18 1 1 A 61 61 GLY HA2 H 61 4.560 4.006 0.554 1 1 667 . 18 1 1 A 61 61 GLY HA3 H 61 3.878 4.037 -0.159 1 1 668 . 18 1 1 A 61 61 GLY C C 61 173.526 171.535 1.991 1 1 669 . 18 1 1 A 61 61 GLY CA C 61 44.906 45.981 -1.075 1 1 670 . 18 1 1 A 61 61 GLY N N 61 109.421 104.302 5.119 1 1 671 . 18 1 1 A 62 62 TRP H H 62 8.861 8.549 0.312 1 1 672 . 18 1 1 A 62 62 TRP HA H 62 5.089 5.356 -0.267 1 1 681 . 18 1 1 A 62 62 TRP C C 62 176.168 175.951 0.217 1 1 682 . 18 1 1 A 62 62 TRP CA C 62 57.459 57.224 0.235 1 1 683 . 18 1 1 A 62 62 TRP CB C 62 32.536 31.399 1.137 1 1 689 . 18 1 1 A 62 62 TRP N N 62 122.939 122.548 0.391 1 1 691 . 18 1 1 A 63 63 GLU H H 63 9.306 9.496 -0.190 1 1 692 . 18 1 1 A 63 63 GLU HA H 63 4.919 5.567 -0.648 1 1 697 . 18 1 1 A 63 63 GLU C C 63 173.770 175.215 -1.445 1 1 698 . 18 1 1 A 63 63 GLU CA C 63 55.953 55.363 0.590 1 1 699 . 18 1 1 A 63 63 GLU CB C 63 35.317 33.838 1.479 1 1 701 . 18 1 1 A 63 63 GLU N N 63 120.136 121.741 -1.605 1 1 702 . 18 1 1 A 64 64 LEU H H 64 8.998 9.032 -0.034 1 1 703 . 18 1 1 A 64 64 LEU HA H 64 5.616 5.617 -0.001 1 1 712 . 18 1 1 A 64 64 LEU C C 64 175.014 174.020 0.994 1 1 713 . 18 1 1 A 64 64 LEU CA C 64 52.945 54.270 -1.325 1 1 714 . 18 1 1 A 64 64 LEU CB C 64 46.904 45.827 1.077 1 1 717 . 18 1 1 A 64 64 LEU N N 64 127.321 126.303 1.018 1 1 718 . 18 1 1 A 65 65 LYS H H 65 9.322 9.832 -0.510 1 1 719 . 18 1 1 A 65 65 LYS HA H 65 5.347 5.384 -0.037 1 1 727 . 18 1 1 A 65 65 LYS C C 65 175.811 175.323 0.488 1 1 728 . 18 1 1 A 65 65 LYS CA C 65 55.817 55.291 0.526 1 1 729 . 18 1 1 A 65 65 LYS CB C 65 34.521 34.457 0.064 1 1 733 . 18 1 1 A 65 65 LYS N N 65 129.874 128.674 1.200 1 1 734 . 18 1 1 A 66 66 CYS H H 66 9.129 9.219 -0.090 1 1 735 . 18 1 1 A 66 66 CYS HA H 66 5.319 4.964 0.355 1 1 738 . 18 1 1 A 66 66 CYS CA C 66 54.532 56.866 -2.334 1 1 739 . 18 1 1 A 66 66 CYS CB C 66 28.813 31.178 -2.365 1 1 740 . 18 1 1 A 66 66 CYS N N 66 121.497 125.663 -4.166 1 1 741 . 18 1 1 A 67 67 PRO HA H 67 4.439 4.506 -0.067 1 1 748 . 18 1 1 A 67 67 PRO C C 67 177.297 177.299 -0.002 1 1 749 . 18 1 1 A 67 67 PRO CA C 67 63.596 63.339 0.257 1 1 750 . 18 1 1 A 67 67 PRO CB C 67 32.242 31.539 0.703 1 1 752 . 18 1 1 A 68 68 GLY H H 68 8.316 8.672 -0.356 1 1 753 . 18 1 1 A 68 68 GLY HA2 H 68 3.726 3.911 -0.185 1 1 754 . 18 1 1 A 68 68 GLY HA3 H 68 4.095 3.973 0.122 1 1 755 . 18 1 1 A 68 68 GLY C C 68 173.789 174.180 -0.391 1 1 756 . 18 1 1 A 68 68 GLY CA C 68 45.227 45.859 -0.632 1 1 757 . 18 1 1 A 68 68 GLY N N 68 109.533 109.484 0.049 1 1 758 . 18 1 1 A 69 69 VAL H H 69 8.114 7.907 0.207 1 1 759 . 18 1 1 A 69 69 VAL HA H 69 4.266 4.050 0.216 1 1 764 . 18 1 1 A 69 69 VAL C C 69 176.299 176.654 -0.355 1 1 765 . 18 1 1 A 69 69 VAL CA C 69 61.945 63.206 -1.261 1 1 766 . 18 1 1 A 69 69 VAL CB C 69 33.082 31.258 1.824 1 1 768 . 18 1 1 A 69 69 VAL N N 69 118.540 120.161 -1.621 1 1 769 . 18 1 1 A 70 70 THR H H 70 8.324 8.991 -0.667 1 1 770 . 18 1 1 A 70 70 THR HA H 70 4.373 4.411 -0.038 1 1 775 . 18 1 1 A 70 70 THR C C 70 175.204 175.498 -0.294 1 1 776 . 18 1 1 A 70 70 THR CA C 70 62.309 63.664 -1.355 1 1 777 . 18 1 1 A 70 70 THR CB C 70 69.787 68.698 1.089 1 1 779 . 18 1 1 A 70 70 THR N N 70 117.636 119.151 -1.515 1 1 780 . 18 1 1 A 71 71 GLY H H 71 8.574 7.790 0.784 1 1 781 . 18 1 1 A 71 71 GLY HA2 H 71 4.096 4.126 -0.030 1 1 782 . 18 1 1 A 71 71 GLY HA3 H 71 3.975 4.131 -0.156 1 1 783 . 18 1 1 A 71 71 GLY C C 71 174.313 174.848 -0.535 1 1 784 . 18 1 1 A 71 71 GLY CA C 71 45.545 45.984 -0.439 1 1 785 . 18 1 1 A 71 71 GLY N N 71 111.677 108.282 3.395 1 1 786 . 18 1 1 A 72 72 VAL H H 72 7.945 8.364 -0.419 1 1 787 . 18 1 1 A 72 72 VAL HA H 72 4.258 4.233 0.025 1 1 795 . 18 1 1 A 72 72 VAL C C 72 176.162 176.761 -0.599 1 1 796 . 18 1 1 A 72 72 VAL CA C 72 62.227 63.546 -1.319 1 1 797 . 18 1 1 A 72 72 VAL CB C 72 32.997 32.472 0.525 1 1 799 . 18 1 1 A 72 72 VAL N N 72 118.647 120.074 -1.427 1 1 800 . 18 1 1 A 73 73 SER H H 73 8.498 7.807 0.691 1 1 801 . 18 1 1 A 73 73 SER HA H 73 4.617 4.711 -0.094 1 1 803 . 18 1 1 A 73 73 SER C C 73 174.461 173.941 0.520 1 1 804 . 18 1 1 A 73 73 SER CA C 73 58.218 59.049 -0.831 1 1 805 . 18 1 1 A 73 73 SER CB C 73 64.061 65.328 -1.267 1 1 806 . 18 1 1 A 73 73 SER N N 73 118.828 111.948 6.880 1 1 807 . 18 1 1 A 74 74 GLY H H 74 8.247 8.130 0.117 1 1 808 . 18 1 1 A 74 74 GLY HA2 H 74 4.101 3.999 0.102 1 1 809 . 18 1 1 A 74 74 GLY HA3 H 74 4.304 4.050 0.254 1 1 810 . 18 1 1 A 74 74 GLY CA C 74 44.896 43.860 1.036 1 1 811 . 18 1 1 A 74 74 GLY N N 74 111.138 104.897 6.241 1 1 812 . 18 1 1 A 75 75 PRO HA H 75 4.461 4.654 -0.193 1 1 819 . 18 1 1 A 75 75 PRO C C 75 176.798 175.819 0.979 1 1 820 . 18 1 1 A 75 75 PRO CA C 75 63.466 62.653 0.813 1 1 821 . 18 1 1 A 75 75 PRO CB C 75 31.980 31.966 0.014 1 1 824 . 18 1 1 A 76 76 HIS H H 76 8.397 8.790 -0.393 1 1 825 . 18 1 1 A 76 76 HIS HA H 76 4.742 4.743 -0.001 1 1 829 . 18 1 1 A 76 76 HIS C C 76 174.282 174.743 -0.461 1 1 830 . 18 1 1 A 76 76 HIS CA C 76 55.579 56.995 -1.416 1 1 831 . 18 1 1 A 76 76 HIS CB C 76 30.501 31.990 -1.489 1 1 832 . 18 1 1 A 76 76 HIS N N 76 118.431 118.651 -0.220 1 1 833 . 18 1 1 A 77 77 ASN H H 77 8.364 7.940 0.424 1 1 834 . 18 1 1 A 77 77 ASN HA H 77 4.767 4.690 0.077 1 1 839 . 18 1 1 A 77 77 ASN C C 77 174.576 176.068 -1.492 1 1 840 . 18 1 1 A 77 77 ASN CA C 77 53.139 53.282 -0.143 1 1 841 . 18 1 1 A 77 77 ASN CB C 77 39.320 38.840 0.480 1 1 842 . 18 1 1 A 77 77 ASN N N 77 119.421 116.349 3.072 1 1 844 . 18 1 1 A 78 78 GLU H H 78 8.683 8.874 -0.191 1 1 845 . 18 1 1 A 78 78 GLU HA H 78 4.409 3.784 0.625 1 1 850 . 18 1 1 A 78 78 GLU C C 78 175.791 174.725 1.066 1 1 851 . 18 1 1 A 78 78 GLU CA C 78 56.359 59.621 -3.262 1 1 852 . 18 1 1 A 78 78 GLU CB C 78 30.818 30.093 0.725 1 1 854 . 18 1 1 A 78 78 GLU N N 78 122.085 126.299 -4.214 1 1 855 . 18 1 1 A 79 79 TYR H H 79 8.341 7.758 0.583 1 1 856 . 18 1 1 A 79 79 TYR HA H 79 4.988 5.510 -0.522 1 1 861 . 18 1 1 A 79 79 TYR C C 79 175.837 174.184 1.653 1 1 862 . 18 1 1 A 79 79 TYR CA C 79 58.028 56.860 1.168 1 1 863 . 18 1 1 A 79 79 TYR CB C 79 41.672 43.265 -1.593 1 1 866 . 18 1 1 A 79 79 TYR N N 79 119.452 115.344 4.108 1 1 867 . 18 1 1 A 80 80 VAL H H 80 9.366 9.391 -0.025 1 1 868 . 18 1 1 A 80 80 VAL HA H 80 4.370 5.007 -0.637 1 1 873 . 18 1 1 A 80 80 VAL C C 80 174.948 175.148 -0.200 1 1 874 . 18 1 1 A 80 80 VAL CA C 80 61.190 60.394 0.796 1 1 875 . 18 1 1 A 80 80 VAL CB C 80 34.204 34.069 0.135 1 1 877 . 18 1 1 A 80 80 VAL N N 80 120.567 117.488 3.079 1 1 878 . 18 1 1 A 81 81 GLU H H 81 8.570 9.105 -0.535 1 1 879 . 18 1 1 A 81 81 GLU HA H 81 4.770 5.642 -0.872 1 1 883 . 18 1 1 A 81 81 GLU C C 81 175.491 175.597 -0.106 1 1 884 . 18 1 1 A 81 81 GLU CA C 81 55.655 55.098 0.557 1 1 885 . 18 1 1 A 81 81 GLU CB C 81 30.415 31.315 -0.900 1 1 887 . 18 1 1 A 81 81 GLU N N 81 124.248 125.852 -1.604 1 1 888 . 18 1 1 A 82 82 VAL H H 82 9.189 8.551 0.638 1 1 889 . 18 1 1 A 82 82 VAL HA H 82 4.279 4.687 -0.408 1 1 894 . 18 1 1 A 82 82 VAL C C 82 176.087 175.893 0.194 1 1 895 . 18 1 1 A 82 82 VAL CA C 82 62.672 61.380 1.292 1 1 896 . 18 1 1 A 82 82 VAL CB C 82 33.121 33.269 -0.148 1 1 898 . 18 1 1 A 82 82 VAL N N 82 127.776 121.065 6.711 1 1 899 . 18 1 1 A 83 83 THR H H 83 8.590 8.698 -0.108 1 1 900 . 18 1 1 A 83 83 THR HA H 83 4.955 4.956 -0.001 1 1 905 . 18 1 1 A 83 83 THR C C 83 174.688 174.933 -0.245 1 1 906 . 18 1 1 A 83 83 THR CA C 83 61.332 61.460 -0.128 1 1 907 . 18 1 1 A 83 83 THR CB C 83 70.213 70.075 0.138 1 1 909 . 18 1 1 A 83 83 THR N N 83 114.744 115.717 -0.973 1 1 910 . 18 1 1 A 84 84 SER H H 84 7.650 7.411 0.239 1 1 911 . 18 1 1 A 84 84 SER HA H 84 4.819 4.272 0.547 1 1 914 . 18 1 1 A 84 84 SER CA C 84 56.280 60.316 -4.036 1 1 915 . 18 1 1 A 84 84 SER CB C 84 63.294 63.425 -0.131 1 1 916 . 18 1 1 A 84 84 SER N N 84 118.038 118.842 -0.804 1 1 917 . 18 1 1 A 85 85 GLU H H 85 8.391 8.756 -0.365 1 1 918 . 18 1 1 A 85 85 GLU HA H 85 3.661 3.987 -0.326 1 1 923 . 18 1 1 A 85 85 GLU C C 85 177.520 178.539 -1.019 1 1 924 . 18 1 1 A 85 85 GLU CA C 85 62.429 59.642 2.787 1 1 925 . 18 1 1 A 85 85 GLU CB C 85 29.655 29.437 0.218 1 1 927 . 18 1 1 A 86 86 ALA H H 86 8.443 8.149 0.294 1 1 928 . 18 1 1 A 86 86 ALA HA H 86 4.027 4.017 0.010 1 1 932 . 18 1 1 A 86 86 ALA C C 86 180.423 180.055 0.368 1 1 933 . 18 1 1 A 86 86 ALA CA C 86 55.145 54.747 0.398 1 1 934 . 18 1 1 A 86 86 ALA CB C 86 18.165 18.237 -0.072 1 1 935 . 18 1 1 A 86 86 ALA N N 86 119.636 123.080 -3.444 1 1 936 . 18 1 1 A 87 87 ALA H H 87 7.214 7.420 -0.206 1 1 937 . 18 1 1 A 87 87 ALA HA H 87 4.244 4.023 0.221 1 1 941 . 18 1 1 A 87 87 ALA C C 87 180.354 179.581 0.773 1 1 942 . 18 1 1 A 87 87 ALA CA C 87 54.378 54.791 -0.413 1 1 943 . 18 1 1 A 87 87 ALA CB C 87 18.795 18.258 0.537 1 1 944 . 18 1 1 A 87 87 ALA N N 87 121.004 120.220 0.784 1 1 945 . 18 1 1 A 88 88 ILE H H 88 8.471 7.806 0.665 1 1 946 . 18 1 1 A 88 88 ILE HA H 88 3.360 3.608 -0.248 1 1 954 . 18 1 1 A 88 88 ILE CA C 88 66.323 64.973 1.350 1 1 955 . 18 1 1 A 88 88 ILE CB C 88 37.808 37.715 0.093 1 1 958 . 18 1 1 A 88 88 ILE N N 88 120.743 119.918 0.825 1 1 959 . 18 1 1 A 89 89 VAL H H 89 8.343 8.355 -0.012 1 1 960 . 18 1 1 A 89 89 VAL HA H 89 3.061 3.499 -0.438 1 1 968 . 18 1 1 A 89 89 VAL C C 89 176.708 177.852 -1.144 1 1 969 . 18 1 1 A 89 89 VAL CA C 89 67.833 66.573 1.260 1 1 970 . 18 1 1 A 89 89 VAL CB C 89 31.509 31.478 0.031 1 1 973 . 18 1 1 A 89 89 VAL N N 89 118.049 119.709 -1.660 1 1 974 . 18 1 1 A 90 90 ALA H H 90 7.516 8.033 -0.517 1 1 975 . 18 1 1 A 90 90 ALA HA H 90 3.987 3.866 0.121 1 1 979 . 18 1 1 A 90 90 ALA C C 90 180.744 179.646 1.098 1 1 980 . 18 1 1 A 90 90 ALA CA C 90 55.481 55.728 -0.247 1 1 981 . 18 1 1 A 90 90 ALA CB C 90 17.953 18.019 -0.066 1 1 982 . 18 1 1 A 90 90 ALA N N 90 118.935 121.989 -3.054 1 1 983 . 18 1 1 A 91 91 GLN H H 91 7.886 7.914 -0.028 1 1 984 . 18 1 1 A 91 91 GLN HA H 91 4.190 3.965 0.225 1 1 991 . 18 1 1 A 91 91 GLN C C 91 178.832 178.754 0.078 1 1 992 . 18 1 1 A 91 91 GLN CA C 91 58.519 59.031 -0.512 1 1 993 . 18 1 1 A 91 91 GLN CB C 91 28.091 28.308 -0.217 1 1 995 . 18 1 1 A 91 91 GLN N N 91 117.846 118.371 -0.525 1 1 997 . 18 1 1 A 92 92 LEU H H 92 8.751 8.697 0.054 1 1 998 . 18 1 1 A 92 92 LEU HA H 92 3.903 3.963 -0.060 1 1 1007 . 18 1 1 A 92 92 LEU C C 92 178.997 179.270 -0.273 1 1 1008 . 18 1 1 A 92 92 LEU CA C 92 58.136 57.973 0.163 1 1 1009 . 18 1 1 A 92 92 LEU CB C 92 41.576 41.558 0.018 1 1 1013 . 18 1 1 A 92 92 LEU N N 92 119.547 119.419 0.128 1 1 1014 . 18 1 1 A 93 93 PHE H H 93 8.648 7.976 0.672 1 1 1015 . 18 1 1 A 93 93 PHE HA H 93 4.270 4.834 -0.564 1 1 1020 . 18 1 1 A 93 93 PHE C C 93 179.283 178.836 0.447 1 1 1021 . 18 1 1 A 93 93 PHE CA C 93 59.860 60.689 -0.829 1 1 1022 . 18 1 1 A 93 93 PHE CB C 93 37.765 38.448 -0.683 1 1 1025 . 18 1 1 A 93 93 PHE N N 93 118.041 118.719 -0.678 1 1 1026 . 18 1 1 A 94 94 GLU H H 94 7.739 8.306 -0.567 1 1 1027 . 18 1 1 A 94 94 GLU HA H 94 4.110 4.127 -0.017 1 1 1031 . 18 1 1 A 94 94 GLU C C 94 178.629 178.787 -0.158 1 1 1032 . 18 1 1 A 94 94 GLU CA C 94 59.359 59.380 -0.021 1 1 1033 . 18 1 1 A 94 94 GLU CB C 94 29.589 28.808 0.781 1 1 1035 . 18 1 1 A 94 94 GLU N N 94 119.980 117.168 2.812 1 1 1036 . 18 1 1 A 95 95 LEU H H 95 7.999 8.395 -0.396 1 1 1037 . 18 1 1 A 95 95 LEU HA H 95 4.139 3.974 0.165 1 1 1047 . 18 1 1 A 95 95 LEU C C 95 178.965 179.398 -0.433 1 1 1048 . 18 1 1 A 95 95 LEU CA C 95 57.557 57.742 -0.185 1 1 1049 . 18 1 1 A 95 95 LEU CB C 95 43.443 41.897 1.546 1 1 1053 . 18 1 1 A 95 95 LEU N N 95 118.398 121.834 -3.436 1 1 1054 . 18 1 1 A 96 96 LEU H H 96 8.363 7.816 0.547 1 1 1055 . 18 1 1 A 96 96 LEU HA H 96 4.503 4.331 0.172 1 1 1061 . 18 1 1 A 96 96 LEU C C 96 177.932 177.003 0.929 1 1 1062 . 18 1 1 A 96 96 LEU CA C 96 54.700 55.971 -1.271 1 1 1063 . 18 1 1 A 96 96 LEU CB C 96 43.048 43.216 -0.168 1 1 1065 . 18 1 1 A 96 96 LEU N N 96 114.720 118.010 -3.290 1 1 1066 . 18 1 1 A 97 97 GLY H H 97 7.810 7.820 -0.010 1 1 1067 . 18 1 1 A 97 97 GLY HA2 H 97 3.963 3.914 0.049 1 1 1068 . 18 1 1 A 97 97 GLY C C 97 173.535 174.963 -1.428 1 1 1069 . 18 1 1 A 97 97 GLY CA C 97 45.667 46.449 -0.782 1 1 1070 . 18 1 1 A 97 97 GLY N N 97 109.511 107.553 1.958 1 1 1071 . 18 1 1 A 98 98 SER H H 98 8.131 7.880 0.251 1 1 1072 . 18 1 1 A 98 98 SER HA H 98 4.225 3.926 0.299 1 1 1075 . 18 1 1 A 98 98 SER C C 98 174.974 174.987 -0.013 1 1 1076 . 18 1 1 A 98 98 SER CA C 98 57.960 61.825 -3.865 1 1 1077 . 18 1 1 A 98 98 SER CB C 98 63.997 62.398 1.599 1 1 1078 . 18 1 1 A 98 98 SER N N 98 113.405 113.270 0.135 1 1 1079 . 18 1 1 A 99 99 GLY H H 99 8.052 8.517 -0.465 1 1 1080 . 18 1 1 A 99 99 GLY HA2 H 99 3.998 3.874 0.124 1 1 1081 . 18 1 1 A 99 99 GLY HA3 H 99 3.778 3.899 -0.121 1 1 1082 . 18 1 1 A 99 99 GLY C C 99 174.033 173.763 0.270 1 1 1083 . 18 1 1 A 99 99 GLY CA C 99 45.123 46.230 -1.107 1 1 1084 . 18 1 1 A 99 99 GLY N N 99 111.534 109.069 2.465 1 1 1085 . 18 1 1 A 100 100 GLU H H 100 8.177 7.816 0.361 1 1 1086 . 18 1 1 A 100 100 GLU HA H 100 4.201 4.885 -0.684 1 1 1091 . 18 1 1 A 100 100 GLU C C 100 175.830 175.476 0.354 1 1 1092 . 18 1 1 A 100 100 GLU CA C 100 56.442 54.341 2.101 1 1 1093 . 18 1 1 A 100 100 GLU CB C 100 30.428 33.614 -3.186 1 1 1095 . 18 1 1 A 100 100 GLU N N 100 120.463 118.865 1.598 1 1 1096 . 18 1 1 A 101 101 GLN H H 101 8.161 8.206 -0.045 1 1 1097 . 18 1 1 A 101 101 GLN HA H 101 4.098 4.474 -0.376 1 1 1103 . 18 1 1 A 101 101 GLN C C 101 175.412 175.875 -0.463 1 1 1104 . 18 1 1 A 101 101 GLN CA C 101 55.632 55.907 -0.275 1 1 1105 . 18 1 1 A 101 101 GLN CB C 101 29.569 29.406 0.163 1 1 1107 . 18 1 1 A 101 101 GLN N N 101 120.014 121.155 -1.141 1 1 1109 . 18 1 1 A 102 102 LYS H H 102 8.235 8.543 -0.308 1 1 1110 . 18 1 1 A 102 102 LYS HA H 102 4.387 4.018 0.369 1 1 1117 . 18 1 1 A 102 102 LYS CA C 102 54.116 54.770 -0.654 1 1 1118 . 18 1 1 A 102 102 LYS CB C 102 32.478 32.251 0.227 1 1 1122 . 18 1 1 A 102 102 LYS N N 102 123.399 122.942 0.457 1 1 1123 . 18 1 1 A 103 103 PRO HA H 103 4.498 4.351 0.147 1 1 1129 . 18 1 1 A 103 103 PRO C C 103 175.473 176.976 -1.503 1 1 1130 . 18 1 1 A 103 103 PRO CA C 103 62.802 65.654 -2.852 1 1 1131 . 18 1 1 A 103 103 PRO CB C 103 32.124 31.581 0.543 1 1 1134 . 18 1 1 A 104 104 ALA H H 104 8.017 7.270 0.747 1 1 1135 . 18 1 1 A 104 104 ALA HA H 104 4.318 4.318 0.000 1 1 1139 . 18 1 1 A 104 104 ALA C C 104 176.717 176.927 -0.210 1 1 1140 . 18 1 1 A 104 104 ALA CA C 104 52.194 53.239 -1.045 1 1 1141 . 18 1 1 A 104 104 ALA CB C 104 20.113 20.323 -0.210 1 1 1142 . 18 1 1 A 104 104 ALA N N 104 122.093 116.620 5.473 1 1 1143 . 18 1 1 A 105 105 GLY H H 105 7.678 8.267 -0.589 1 1 1144 . 18 1 1 A 105 105 GLY HA2 H 105 3.851 4.069 -0.218 1 1 1145 . 18 1 1 A 105 105 GLY HA3 H 105 4.053 4.087 -0.034 1 1 1146 . 18 1 1 A 105 105 GLY C C 105 172.990 174.872 -1.882 1 1 1147 . 18 1 1 A 105 105 GLY CA C 105 44.241 43.813 0.428 1 1 1148 . 18 1 1 A 105 105 GLY N N 105 105.234 104.568 0.666 1 1 1149 . 18 1 1 A 106 106 VAL H H 106 8.409 8.738 -0.329 1 1 1150 . 18 1 1 A 106 106 VAL HA H 106 2.829 3.365 -0.536 1 1 1158 . 18 1 1 A 106 106 VAL C C 106 177.822 177.308 0.514 1 1 1159 . 18 1 1 A 106 106 VAL CA C 106 65.522 65.682 -0.160 1 1 1160 . 18 1 1 A 106 106 VAL CB C 106 30.701 30.902 -0.201 1 1 1163 . 18 1 1 A 106 106 VAL N N 106 119.215 118.772 0.443 1 1 1164 . 18 1 1 A 107 107 ALA H H 107 8.707 8.307 0.400 1 1 1165 . 18 1 1 A 107 107 ALA HA H 107 3.730 3.775 -0.045 1 1 1169 . 18 1 1 A 107 107 ALA C C 107 179.661 179.707 -0.046 1 1 1170 . 18 1 1 A 107 107 ALA CA C 107 54.995 55.381 -0.386 1 1 1171 . 18 1 1 A 107 107 ALA CB C 107 17.705 17.947 -0.242 1 1 1172 . 18 1 1 A 107 107 ALA N N 107 118.672 122.196 -3.524 1 1 1173 . 18 1 1 A 108 108 ALA H H 108 7.388 7.739 -0.351 1 1 1174 . 18 1 1 A 108 108 ALA HA H 108 4.259 4.040 0.219 1 1 1178 . 18 1 1 A 108 108 ALA C C 108 179.318 179.507 -0.189 1 1 1179 . 18 1 1 A 108 108 ALA CA C 108 53.481 54.990 -1.509 1 1 1180 . 18 1 1 A 108 108 ALA CB C 108 19.367 18.264 1.103 1 1 1181 . 18 1 1 A 108 108 ALA N N 108 116.635 120.782 -4.147 1 1 1182 . 18 1 1 A 109 109 VAL H H 109 7.689 7.677 0.012 1 1 1183 . 18 1 1 A 109 109 VAL HA H 109 4.532 3.822 0.710 1 1 1191 . 18 1 1 A 109 109 VAL C C 109 176.055 177.990 -1.935 1 1 1192 . 18 1 1 A 109 109 VAL CA C 109 61.452 65.731 -4.279 1 1 1193 . 18 1 1 A 109 109 VAL CB C 109 32.728 31.315 1.413 1 1 1196 . 18 1 1 A 109 109 VAL N N 109 112.851 116.512 -3.661 1 1 1197 . 18 1 1 A 110 110 LEU H H 110 7.099 8.471 -1.372 1 1 1198 . 18 1 1 A 110 110 LEU HA H 110 3.723 3.785 -0.062 1 1 1208 . 18 1 1 A 110 110 LEU C C 110 179.040 178.816 0.224 1 1 1209 . 18 1 1 A 110 110 LEU CA C 110 58.825 57.822 1.003 1 1 1210 . 18 1 1 A 110 110 LEU CB C 110 41.242 41.746 -0.504 1 1 1214 . 18 1 1 A 110 110 LEU N N 110 119.829 124.990 -5.161 1 1 1215 . 18 1 1 A 111 111 GLY H H 111 8.435 7.868 0.567 1 1 1216 . 18 1 1 A 111 111 GLY HA2 H 111 3.970 3.801 0.169 1 1 1217 . 18 1 1 A 111 111 GLY HA3 H 111 3.885 3.810 0.075 1 1 1218 . 18 1 1 A 111 111 GLY C C 111 178.031 176.303 1.728 1 1 1219 . 18 1 1 A 111 111 GLY CA C 111 46.961 47.609 -0.648 1 1 1220 . 18 1 1 A 111 111 GLY N N 111 104.089 106.512 -2.423 1 1 1221 . 18 1 1 A 112 112 SER H H 112 8.343 8.289 0.054 1 1 1222 . 18 1 1 A 112 112 SER HA H 112 4.266 4.203 0.063 1 1 1224 . 18 1 1 A 112 112 SER C C 112 175.885 175.952 -0.067 1 1 1225 . 18 1 1 A 112 112 SER CA C 112 61.304 62.557 -1.253 1 1 1226 . 18 1 1 A 112 112 SER CB C 112 62.901 63.025 -0.124 1 1 1227 . 18 1 1 A 112 112 SER N N 112 119.497 119.409 0.088 1 1 1228 . 18 1 1 A 113 113 LEU H H 113 7.667 8.133 -0.466 1 1 1229 . 18 1 1 A 113 113 LEU HA H 113 4.343 4.174 0.169 1 1 1238 . 18 1 1 A 113 113 LEU C C 113 174.760 175.809 -1.049 1 1 1239 . 18 1 1 A 113 113 LEU CA C 113 54.228 54.853 -0.625 1 1 1240 . 18 1 1 A 113 113 LEU CB C 113 41.467 42.165 -0.698 1 1 1244 . 18 1 1 A 113 113 LEU N N 113 118.843 118.295 0.548 1 1 1245 . 18 1 1 A 114 114 LYS H H 114 7.685 7.872 -0.187 1 1 1246 . 18 1 1 A 114 114 LYS HA H 114 3.958 3.864 0.094 1 1 1250 . 18 1 1 A 114 114 LYS C C 114 177.557 175.660 1.897 1 1 1251 . 18 1 1 A 114 114 LYS CA C 114 56.935 57.421 -0.486 1 1 1252 . 18 1 1 A 114 114 LYS CB C 114 28.898 29.496 -0.598 1 1 1254 . 18 1 1 A 114 114 LYS N N 114 114.072 116.264 -2.192 1 1 1255 . 18 1 1 A 115 115 LEU H H 115 8.329 7.880 0.449 1 1 1256 . 18 1 1 A 115 115 LEU HA H 115 4.315 4.365 -0.050 1 1 1265 . 18 1 1 A 115 115 LEU C C 115 175.988 177.046 -1.058 1 1 1266 . 18 1 1 A 115 115 LEU CA C 115 54.310 54.936 -0.626 1 1 1267 . 18 1 1 A 115 115 LEU CB C 115 44.163 42.271 1.892 1 1 1270 . 18 1 1 A 115 115 LEU N N 115 117.951 120.063 -2.112 1 1 1271 . 18 1 1 A 116 116 GLN H H 116 9.100 8.454 0.646 1 1 1272 . 18 1 1 A 116 116 GLN HA H 116 4.898 4.656 0.242 1 1 1279 . 18 1 1 A 116 116 GLN CA C 116 53.467 55.480 -2.013 1 1 1280 . 18 1 1 A 116 116 GLN CB C 116 32.730 29.751 2.979 1 1 1282 . 18 1 1 A 116 116 GLN N N 116 119.994 121.787 -1.793 1 1 1284 . 18 1 1 A 117 117 GLU H H 117 8.849 8.548 0.301 1 1 1285 . 18 1 1 A 117 117 GLU HA H 117 3.707 3.660 0.047 1 1 1290 . 18 1 1 A 117 117 GLU C C 117 177.303 176.835 0.468 1 1 1291 . 18 1 1 A 117 117 GLU CA C 117 57.233 55.480 1.753 1 1 1292 . 18 1 1 A 117 117 GLU CB C 117 29.634 28.822 0.812 1 1 1294 . 18 1 1 A 117 117 GLU N N 117 121.487 123.316 -1.829 1 1 1295 . 18 1 1 A 118 118 VAL H H 118 8.983 8.601 0.382 1 1 1296 . 18 1 1 A 118 118 VAL HA H 118 4.360 4.070 0.290 1 1 1304 . 18 1 1 A 118 118 VAL C C 118 174.171 175.232 -1.061 1 1 1305 . 18 1 1 A 118 118 VAL CA C 118 61.772 63.731 -1.959 1 1 1306 . 18 1 1 A 118 118 VAL CB C 118 34.095 32.728 1.367 1 1 1309 . 18 1 1 A 118 118 VAL N N 118 122.933 128.063 -5.130 1 1 1310 . 18 1 1 A 119 119 ALA H H 119 7.023 7.132 -0.109 1 1 1311 . 18 1 1 A 119 119 ALA HA H 119 4.378 4.365 0.013 1 1 1315 . 18 1 1 A 119 119 ALA C C 119 175.493 174.869 0.624 1 1 1316 . 18 1 1 A 119 119 ALA CA C 119 51.956 51.263 0.693 1 1 1317 . 18 1 1 A 119 119 ALA CB C 119 23.957 21.430 2.527 1 1 1318 . 18 1 1 A 119 119 ALA N N 119 117.379 121.929 -4.550 1 1 1319 . 18 1 1 A 120 120 SER H H 120 6.999 8.306 -1.307 1 1 1320 . 18 1 1 A 120 120 SER HA H 120 5.208 5.377 -0.169 1 1 1323 . 18 1 1 A 120 120 SER C C 120 173.082 172.680 0.402 1 1 1324 . 18 1 1 A 120 120 SER CA C 120 56.754 56.983 -0.229 1 1 1325 . 18 1 1 A 120 120 SER CB C 120 64.605 65.514 -0.909 1 1 1326 . 18 1 1 A 120 120 SER N N 120 113.743 116.062 -2.319 1 1 1327 . 18 1 1 A 121 121 PHE H H 121 8.244 8.931 -0.687 1 1 1328 . 18 1 1 A 121 121 PHE HA H 121 5.177 5.131 0.046 1 1 1333 . 18 1 1 A 121 121 PHE C C 121 173.569 172.189 1.380 1 1 1334 . 18 1 1 A 121 121 PHE CA C 121 55.555 55.891 -0.336 1 1 1335 . 18 1 1 A 121 121 PHE CB C 121 40.959 41.817 -0.858 1 1 1338 . 18 1 1 A 121 121 PHE N N 121 120.358 121.849 -1.491 1 1 1339 . 18 1 1 A 122 122 ILE H H 122 8.907 8.711 0.196 1 1 1340 . 18 1 1 A 122 122 ILE HA H 122 4.682 4.392 0.290 1 1 1348 . 18 1 1 A 122 122 ILE C C 122 176.925 175.282 1.643 1 1 1349 . 18 1 1 A 122 122 ILE CA C 122 60.740 61.220 -0.480 1 1 1350 . 18 1 1 A 122 122 ILE CB C 122 39.497 37.814 1.683 1 1 1353 . 18 1 1 A 122 122 ILE N N 122 121.282 122.227 -0.945 1 1 1354 . 18 1 1 A 123 123 THR H H 123 9.022 9.167 -0.145 1 1 1355 . 18 1 1 A 123 123 THR HA H 123 5.039 5.101 -0.062 1 1 1360 . 18 1 1 A 123 123 THR C C 123 173.531 173.191 0.340 1 1 1361 . 18 1 1 A 123 123 THR CA C 123 62.266 61.444 0.822 1 1 1362 . 18 1 1 A 123 123 THR CB C 123 70.677 69.544 1.133 1 1 1364 . 18 1 1 A 123 123 THR N N 123 128.965 123.866 5.099 1 1 1365 . 18 1 1 A 124 124 THR H H 124 8.961 9.432 -0.471 1 1 1366 . 18 1 1 A 124 124 THR HA H 124 5.001 4.845 0.156 1 1 1371 . 18 1 1 A 124 124 THR C C 124 173.468 172.538 0.930 1 1 1372 . 18 1 1 A 124 124 THR CA C 124 62.109 61.870 0.239 1 1 1373 . 18 1 1 A 124 124 THR CB C 124 70.450 69.805 0.645 1 1 1375 . 18 1 1 A 124 124 THR N N 124 122.176 123.418 -1.242 1 1 1376 . 18 1 1 A 125 125 ARG H H 125 9.386 9.868 -0.482 1 1 1377 . 18 1 1 A 125 125 ARG HA H 125 5.764 5.370 0.394 1 1 1384 . 18 1 1 A 125 125 ARG C C 125 175.713 174.525 1.188 1 1 1385 . 18 1 1 A 125 125 ARG CA C 125 53.991 54.220 -0.229 1 1 1386 . 18 1 1 A 125 125 ARG CB C 125 33.557 33.490 0.067 1 1 1389 . 18 1 1 A 125 125 ARG N N 125 130.004 129.038 0.966 1 1 1390 . 18 1 1 A 126 126 SER H H 126 9.172 9.610 -0.438 1 1 1391 . 18 1 1 A 126 126 SER HA H 126 5.390 5.122 0.268 1 1 1394 . 18 1 1 A 126 126 SER C C 126 172.359 172.760 -0.401 1 1 1395 . 18 1 1 A 126 126 SER CA C 126 56.934 56.806 0.128 1 1 1396 . 18 1 1 A 126 126 SER CB C 126 65.827 65.203 0.624 1 1 1397 . 18 1 1 A 126 126 SER N N 126 119.906 121.462 -1.556 1 1 1398 . 18 1 1 A 127 127 SER H H 127 8.591 9.457 -0.866 1 1 1399 . 18 1 1 A 127 127 SER HA H 127 5.739 5.388 0.351 1 1 1401 . 18 1 1 A 127 127 SER C C 127 173.283 173.011 0.272 1 1 1402 . 18 1 1 A 127 127 SER CA C 127 57.354 57.745 -0.391 1 1 1403 . 18 1 1 A 127 127 SER CB C 127 65.412 64.713 0.699 1 1 1404 . 18 1 1 A 127 127 SER N N 127 117.914 123.267 -5.353 1 1 1405 . 18 1 1 A 128 128 TRP H H 128 9.866 9.822 0.044 1 1 1406 . 18 1 1 A 128 128 TRP HA H 128 5.560 5.592 -0.032 1 1 1415 . 18 1 1 A 128 128 TRP C C 128 175.828 174.892 0.936 1 1 1416 . 18 1 1 A 128 128 TRP CA C 128 55.852 55.703 0.149 1 1 1417 . 18 1 1 A 128 128 TRP CB C 128 32.524 33.838 -1.314 1 1 1423 . 18 1 1 A 128 128 TRP N N 128 127.978 125.772 2.206 1 1 1425 . 18 1 1 A 129 129 LYS H H 129 9.424 9.691 -0.267 1 1 1426 . 18 1 1 A 129 129 LYS HA H 129 5.388 5.508 -0.120 1 1 1433 . 18 1 1 A 129 129 LYS C C 129 175.254 174.354 0.900 1 1 1434 . 18 1 1 A 129 129 LYS CA C 129 54.410 54.652 -0.242 1 1 1435 . 18 1 1 A 129 129 LYS CB C 129 35.734 36.222 -0.488 1 1 1439 . 18 1 1 A 129 129 LYS N N 129 121.784 119.040 2.744 1 1 1440 . 18 1 1 A 130 130 LEU H H 130 8.933 9.721 -0.788 1 1 1441 . 18 1 1 A 130 130 LEU HA H 130 4.859 5.139 -0.280 1 1 1447 . 18 1 1 A 130 130 LEU C C 130 173.893 174.863 -0.970 1 1 1448 . 18 1 1 A 130 130 LEU CA C 130 53.848 53.836 0.012 1 1 1449 . 18 1 1 A 130 130 LEU CB C 130 46.125 45.655 0.470 1 1 1451 . 18 1 1 A 130 130 LEU N N 130 124.543 123.793 0.750 1 1 1452 . 18 1 1 A 131 131 ALA H H 131 8.816 9.127 -0.311 1 1 1453 . 18 1 1 A 131 131 ALA HA H 131 4.776 5.437 -0.661 1 1 1457 . 18 1 1 A 131 131 ALA C C 131 176.662 175.696 0.966 1 1 1458 . 18 1 1 A 131 131 ALA CA C 131 51.407 49.940 1.467 1 1 1459 . 18 1 1 A 131 131 ALA CB C 131 19.354 22.391 -3.037 1 1 1460 . 18 1 1 A 131 131 ALA N N 131 131.102 128.993 2.109 1 1 1461 . 18 1 1 A 132 132 LEU H H 132 8.487 8.906 -0.419 1 1 1462 . 18 1 1 A 132 132 LEU HA H 132 4.470 4.969 -0.499 1 1 1470 . 18 1 1 A 132 132 LEU C C 132 176.873 175.360 1.513 1 1 1471 . 18 1 1 A 132 132 LEU CA C 132 54.590 53.465 1.125 1 1 1472 . 18 1 1 A 132 132 LEU CB C 132 42.974 42.536 0.438 1 1 1475 . 18 1 1 A 132 132 LEU N N 132 123.724 122.248 1.476 1 1 1476 . 18 1 1 A 133 133 SER H H 133 8.448 8.867 -0.419 1 1 1477 . 18 1 1 A 133 133 SER HA H 133 4.560 4.784 -0.224 1 1 1479 . 18 1 1 A 133 133 SER C C 133 176.043 175.171 0.872 1 1 1480 . 18 1 1 A 133 133 SER CA C 133 58.460 57.161 1.299 1 1 1481 . 18 1 1 A 133 133 SER CB C 133 63.985 62.555 1.430 1 1 1482 . 18 1 1 A 133 133 SER N N 133 115.880 119.487 -3.607 1 1 1483 . 18 1 1 A 134 134 GLY H H 134 8.232 8.607 -0.375 1 1 1484 . 18 1 1 A 134 134 GLY HA2 H 134 4.147 3.900 0.247 1 1 1485 . 18 1 1 A 134 134 GLY HA3 H 134 4.045 3.920 0.125 1 1 1486 . 18 1 1 A 134 134 GLY C C 134 174.013 173.366 0.647 1 1 1487 . 18 1 1 A 134 134 GLY CA C 134 45.337 45.157 0.180 1 1 1488 . 18 1 1 A 134 134 GLY N N 134 109.970 111.905 -1.935 1 1 1489 . 18 1 1 A 135 135 ALA H H 135 8.424 7.477 0.947 1 1 1490 . 18 1 1 A 135 135 ALA HA H 135 4.436 4.508 -0.072 1 1 1494 . 18 1 1 A 135 135 ALA C C 135 177.537 174.866 2.671 1 1 1495 . 18 1 1 A 135 135 ALA CA C 135 52.721 51.422 1.299 1 1 1496 . 18 1 1 A 135 135 ALA CB C 135 19.265 22.221 -2.956 1 1 1497 . 18 1 1 A 135 135 ALA N N 135 124.118 119.995 4.123 1 1 1498 . 18 1 1 A 136 136 HIS H H 136 8.466 8.404 0.062 1 1 1499 . 18 1 1 A 136 136 HIS HA H 136 4.379 5.114 -0.735 1 1 1500 . 18 1 1 A 136 136 HIS C C 136 176.259 174.948 1.311 1 1 1501 . 18 1 1 A 136 136 HIS CA C 136 56.082 54.282 1.800 1 1 1502 . 18 1 1 A 136 136 HIS CB C 136 29.619 31.105 -1.486 1 1 1503 . 18 1 1 A 136 136 HIS N N 136 119.493 115.984 3.509 1 1 1504 . 18 1 1 A 137 137 GLY H H 137 8.431 8.961 -0.530 1 1 1505 . 18 1 1 A 137 137 GLY HA2 H 137 4.151 4.075 0.076 1 1 1506 . 18 1 1 A 137 137 GLY HA3 H 137 3.893 4.082 -0.189 1 1 1507 . 18 1 1 A 137 137 GLY C C 137 174.039 172.994 1.045 1 1 1508 . 18 1 1 A 137 137 GLY CA C 137 45.372 46.196 -0.824 1 1 1509 . 18 1 1 A 137 137 GLY N N 137 110.442 110.459 -0.017 1 1 1510 . 18 1 1 A 138 138 GLN H H 138 8.416 8.178 0.238 1 1 1511 . 18 1 1 A 138 138 GLN HA H 138 4.455 4.896 -0.441 1 1 1515 . 18 1 1 A 138 138 GLN C C 138 175.889 174.933 0.956 1 1 1516 . 18 1 1 A 138 138 GLN CA C 138 55.866 54.663 1.203 1 1 1517 . 18 1 1 A 138 138 GLN CB C 138 29.639 31.124 -1.485 1 1 1518 . 18 1 1 A 138 138 GLN N N 138 119.401 119.178 0.223 1 1 1519 . 18 1 1 A 139 139 GLU H H 139 8.446 8.969 -0.523 1 1 1520 . 18 1 1 A 139 139 GLU HA H 139 4.658 4.757 -0.099 1 1 1524 . 18 1 1 A 139 139 GLU CA C 139 54.589 53.278 1.311 1 1 1525 . 18 1 1 A 139 139 GLU CB C 139 29.733 30.643 -0.910 1 1 1527 . 18 1 1 A 139 139 GLU N N 139 123.136 124.239 -1.103 1 1 1528 . 18 1 1 A 140 140 PRO HA H 140 4.537 4.846 -0.309 1 1 1533 . 18 1 1 A 140 140 PRO C C 140 176.119 175.832 0.287 1 1 1534 . 18 1 1 A 140 140 PRO CA C 140 63.220 62.387 0.833 1 1 1535 . 18 1 1 A 140 140 PRO CB C 140 31.936 31.773 0.163 1 1 1538 . 18 1 1 A 141 141 GLN H H 141 8.506 8.777 -0.271 1 1 1539 . 18 1 1 A 141 141 GLN HA H 141 4.650 4.904 -0.254 1 1 1546 . 18 1 1 A 141 141 GLN C C 141 175.811 175.618 0.193 1 1 1547 . 18 1 1 A 141 141 GLN CA C 141 55.912 55.003 0.909 1 1 1548 . 18 1 1 A 141 141 GLN CB C 141 30.241 30.547 -0.306 1 1 1550 . 18 1 1 A 141 141 GLN N N 141 120.422 123.344 -2.922 1 1 1551 . 18 1 1 A 142 142 LEU H H 142 8.842 9.417 -0.575 1 1 1552 . 18 1 1 A 142 142 LEU HA H 142 5.277 5.128 0.149 1 1 1562 . 18 1 1 A 142 142 LEU C C 142 176.839 175.130 1.709 1 1 1563 . 18 1 1 A 142 142 LEU CA C 142 53.927 52.902 1.025 1 1 1564 . 18 1 1 A 142 142 LEU CB C 142 44.527 45.363 -0.836 1 1 1568 . 18 1 1 A 142 142 LEU N N 142 123.692 121.143 2.549 1 1 1569 . 18 1 1 A 143 143 THR H H 143 9.025 9.062 -0.037 1 1 1570 . 18 1 1 A 143 143 THR HA H 143 5.262 5.192 0.070 1 1 1575 . 18 1 1 A 143 143 THR C C 143 173.753 174.011 -0.258 1 1 1576 . 18 1 1 A 143 143 THR CA C 143 61.795 61.907 -0.112 1 1 1577 . 18 1 1 A 143 143 THR CB C 143 70.660 70.715 -0.055 1 1 1579 . 18 1 1 A 143 143 THR N N 143 117.222 118.090 -0.868 1 1 1580 . 18 1 1 A 144 144 ILE H H 144 9.353 10.340 -0.987 1 1 1581 . 18 1 1 A 144 144 ILE HA H 144 5.399 5.358 0.041 1 1 1591 . 18 1 1 A 144 144 ILE C C 144 173.931 173.738 0.193 1 1 1592 . 18 1 1 A 144 144 ILE CA C 144 60.774 60.418 0.356 1 1 1593 . 18 1 1 A 144 144 ILE CB C 144 41.111 39.763 1.348 1 1 1597 . 18 1 1 A 144 144 ILE N N 144 126.383 127.993 -1.610 1 1 1598 . 18 1 1 A 145 145 ASP H H 145 9.214 9.395 -0.181 1 1 1599 . 18 1 1 A 145 145 ASP HA H 145 5.978 5.465 0.513 1 1 1601 . 18 1 1 A 145 145 ASP C C 145 175.441 174.817 0.624 1 1 1602 . 18 1 1 A 145 145 ASP CA C 145 53.035 52.841 0.194 1 1 1603 . 18 1 1 A 145 145 ASP CB C 145 44.153 43.925 0.228 1 1 1604 . 18 1 1 A 145 145 ASP N N 145 127.981 128.640 -0.659 1 1 1605 . 18 1 1 A 146 146 LEU H H 146 9.387 9.888 -0.501 1 1 1606 . 18 1 1 A 146 146 LEU HA H 146 4.918 5.415 -0.497 1 1 1616 . 18 1 1 A 146 146 LEU C C 146 175.003 174.800 0.203 1 1 1617 . 18 1 1 A 146 146 LEU CA C 146 53.940 53.584 0.356 1 1 1618 . 18 1 1 A 146 146 LEU CB C 146 43.902 44.385 -0.483 1 1 1622 . 18 1 1 A 146 146 LEU N N 146 123.532 127.653 -4.121 1 1 1623 . 18 1 1 A 147 147 ASP H H 147 8.676 9.274 -0.598 1 1 1624 . 18 1 1 A 147 147 ASP HA H 147 5.205 5.386 -0.181 1 1 1627 . 18 1 1 A 147 147 ASP C C 147 174.956 174.075 0.881 1 1 1628 . 18 1 1 A 147 147 ASP CA C 147 53.441 52.717 0.724 1 1 1629 . 18 1 1 A 147 147 ASP CB C 147 43.370 44.845 -1.475 1 1 1630 . 18 1 1 A 147 147 ASP N N 147 125.499 125.742 -0.243 1 1 1631 . 18 1 1 A 148 148 SER H H 148 8.732 8.694 0.038 1 1 1632 . 18 1 1 A 148 148 SER HA H 148 5.365 5.290 0.075 1 1 1634 . 18 1 1 A 148 148 SER C C 148 173.217 172.952 0.265 1 1 1635 . 18 1 1 A 148 148 SER CA C 148 56.334 56.750 -0.416 1 1 1636 . 18 1 1 A 148 148 SER CB C 148 65.812 65.000 0.812 1 1 1637 . 18 1 1 A 148 148 SER N N 148 118.623 118.693 -0.070 1 1 1638 . 18 1 1 A 149 149 ALA H H 149 8.937 8.519 0.418 1 1 1639 . 18 1 1 A 149 149 ALA HA H 149 5.681 5.085 0.596 1 1 1643 . 18 1 1 A 149 149 ALA C C 149 178.894 177.530 1.364 1 1 1644 . 18 1 1 A 149 149 ALA CA C 149 49.996 50.216 -0.220 1 1 1645 . 18 1 1 A 149 149 ALA CB C 149 23.231 20.785 2.446 1 1 1646 . 18 1 1 A 149 149 ALA N N 149 123.952 129.124 -5.172 1 1 1647 . 18 1 1 A 150 150 ASP H H 150 9.010 9.147 -0.137 1 1 1648 . 18 1 1 A 150 150 ASP HA H 150 4.336 4.371 -0.035 1 1 1651 . 18 1 1 A 150 150 ASP C C 150 176.697 177.276 -0.579 1 1 1652 . 18 1 1 A 150 150 ASP CA C 150 56.543 56.203 0.340 1 1 1653 . 18 1 1 A 150 150 ASP CB C 150 39.850 40.765 -0.915 1 1 1654 . 18 1 1 A 150 150 ASP N N 150 122.687 125.188 -2.501 1 1 1655 . 18 1 1 A 151 151 PHE H H 151 7.295 8.080 -0.785 1 1 1656 . 18 1 1 A 151 151 PHE HA H 151 5.020 4.576 0.444 1 1 1661 . 18 1 1 A 151 151 PHE C C 151 174.756 175.874 -1.118 1 1 1662 . 18 1 1 A 151 151 PHE CA C 151 56.594 60.875 -4.281 1 1 1663 . 18 1 1 A 151 151 PHE CB C 151 37.765 39.738 -1.973 1 1 1666 . 18 1 1 A 151 151 PHE N N 151 113.928 120.657 -6.729 1 1 1667 . 18 1 1 A 152 152 GLY H H 152 7.786 8.421 -0.635 1 1 1668 . 18 1 1 A 152 152 GLY HA2 H 152 4.459 4.082 0.377 1 1 1669 . 18 1 1 A 152 152 GLY HA3 H 152 3.728 4.118 -0.390 1 1 1670 . 18 1 1 A 152 152 GLY C C 152 172.709 173.379 -0.670 1 1 1671 . 18 1 1 A 152 152 GLY CA C 152 46.106 45.511 0.595 1 1 1672 . 18 1 1 A 152 152 GLY N N 152 110.312 107.464 2.848 1 1 1673 . 18 1 1 A 153 153 TYR H H 153 6.650 7.267 -0.617 1 1 1674 . 18 1 1 A 153 153 TYR HA H 153 4.508 5.224 -0.716 1 1 1679 . 18 1 1 A 153 153 TYR C C 153 173.092 172.815 0.277 1 1 1680 . 18 1 1 A 153 153 TYR CA C 153 57.464 56.308 1.156 1 1 1681 . 18 1 1 A 153 153 TYR CB C 153 41.962 41.302 0.660 1 1 1684 . 18 1 1 A 153 153 TYR N N 153 121.977 115.627 6.350 1 1 1685 . 18 1 1 A 154 154 ALA H H 154 7.847 8.850 -1.003 1 1 1686 . 18 1 1 A 154 154 ALA HA H 154 5.144 5.766 -0.622 1 1 1690 . 18 1 1 A 154 154 ALA C C 154 174.468 175.101 -0.633 1 1 1691 . 18 1 1 A 154 154 ALA CA C 154 51.776 50.543 1.233 1 1 1692 . 18 1 1 A 154 154 ALA CB C 154 21.747 22.401 -0.654 1 1 1693 . 18 1 1 A 154 154 ALA N N 154 130.258 122.682 7.576 1 1 1694 . 18 1 1 A 155 155 VAL H H 155 8.733 9.252 -0.519 1 1 1695 . 18 1 1 A 155 155 VAL HA H 155 4.150 4.920 -0.770 1 1 1700 . 18 1 1 A 155 155 VAL C C 155 172.632 173.641 -1.009 1 1 1701 . 18 1 1 A 155 155 VAL CA C 155 61.451 59.788 1.663 1 1 1702 . 18 1 1 A 155 155 VAL CB C 155 35.883 34.742 1.141 1 1 1704 . 18 1 1 A 155 155 VAL N N 155 119.622 121.347 -1.725 1 1 1705 . 18 1 1 A 156 156 GLY H H 156 8.146 8.347 -0.201 1 1 1706 . 18 1 1 A 156 156 GLY HA2 H 156 5.125 2.985 2.140 1 1 1707 . 18 1 1 A 156 156 GLY HA3 H 156 2.061 4.037 -1.976 1 1 1708 . 18 1 1 A 156 156 GLY C C 156 171.746 171.891 -0.145 1 1 1709 . 18 1 1 A 156 156 GLY CA C 156 43.319 43.510 -0.191 1 1 1710 . 18 1 1 A 156 156 GLY N N 156 113.332 113.931 -0.599 1 1 1711 . 18 1 1 A 157 157 GLU H H 157 8.967 8.640 0.327 1 1 1712 . 18 1 1 A 157 157 GLU HA H 157 5.217 5.147 0.070 1 1 1716 . 18 1 1 A 157 157 GLU C C 157 174.476 175.002 -0.526 1 1 1717 . 18 1 1 A 157 157 GLU CA C 157 55.390 54.728 0.662 1 1 1718 . 18 1 1 A 157 157 GLU CB C 157 34.010 34.543 -0.533 1 1 1720 . 18 1 1 A 157 157 GLU N N 157 120.823 121.968 -1.145 1 1 1721 . 18 1 1 A 158 158 VAL H H 158 9.076 9.348 -0.272 1 1 1722 . 18 1 1 A 158 158 VAL HA H 158 5.206 5.161 0.045 1 1 1727 . 18 1 1 A 158 158 VAL C C 158 173.900 174.827 -0.927 1 1 1728 . 18 1 1 A 158 158 VAL CA C 158 60.813 61.170 -0.357 1 1 1729 . 18 1 1 A 158 158 VAL CB C 158 33.385 34.397 -1.012 1 1 1731 . 18 1 1 A 158 158 VAL N N 158 124.349 122.870 1.479 1 1 1732 . 18 1 1 A 159 159 GLU H H 159 9.239 9.585 -0.346 1 1 1733 . 18 1 1 A 159 159 GLU HA H 159 5.647 5.553 0.094 1 1 1738 . 18 1 1 A 159 159 GLU C C 159 174.469 174.918 -0.449 1 1 1739 . 18 1 1 A 159 159 GLU CA C 159 54.473 54.672 -0.199 1 1 1740 . 18 1 1 A 159 159 GLU CB C 159 33.852 32.959 0.893 1 1 1742 . 18 1 1 A 159 159 GLU N N 159 125.772 127.843 -2.071 1 1 1743 . 18 1 1 A 160 160 ALA H H 160 9.250 9.126 0.124 1 1 1744 . 18 1 1 A 160 160 ALA HA H 160 4.966 5.463 -0.497 1 1 1748 . 18 1 1 A 160 160 ALA C C 160 175.114 175.736 -0.622 1 1 1749 . 18 1 1 A 160 160 ALA CA C 160 50.644 50.038 0.606 1 1 1750 . 18 1 1 A 160 160 ALA CB C 160 23.263 23.033 0.230 1 1 1751 . 18 1 1 A 160 160 ALA N N 160 125.092 129.516 -4.424 1 1 1752 . 18 1 1 A 161 161 MET H H 161 8.559 8.761 -0.202 1 1 1753 . 18 1 1 A 161 161 MET HA H 161 5.468 5.880 -0.412 1 1 1761 . 18 1 1 A 161 161 MET C C 161 176.265 174.944 1.321 1 1 1762 . 18 1 1 A 161 161 MET CA C 161 53.818 53.944 -0.126 1 1 1763 . 18 1 1 A 161 161 MET CB C 161 34.380 34.664 -0.284 1 1 1766 . 18 1 1 A 161 161 MET N N 161 118.699 119.701 -1.002 1 1 1767 . 18 1 1 A 162 162 VAL H H 162 9.046 9.136 -0.090 1 1 1768 . 18 1 1 A 162 162 VAL HA H 162 4.841 4.845 -0.004 1 1 1776 . 18 1 1 A 162 162 VAL C C 162 174.794 175.764 -0.970 1 1 1777 . 18 1 1 A 162 162 VAL CA C 162 59.107 59.659 -0.552 1 1 1778 . 18 1 1 A 162 162 VAL CB C 162 34.018 34.258 -0.240 1 1 1781 . 18 1 1 A 162 162 VAL N N 162 116.435 120.183 -3.748 1 1 1782 . 18 1 1 A 163 163 HIS H H 163 8.793 8.688 0.105 1 1 1783 . 18 1 1 A 163 163 HIS HA H 163 4.717 4.534 0.183 1 1 1787 . 18 1 1 A 163 163 HIS C C 163 175.460 174.896 0.564 1 1 1788 . 18 1 1 A 163 163 HIS CA C 163 58.488 57.586 0.902 1 1 1789 . 18 1 1 A 163 163 HIS CB C 163 31.185 30.850 0.335 1 1 1791 . 18 1 1 A 163 163 HIS N N 163 117.838 120.796 -2.958 1 1 1792 . 18 1 1 A 164 164 GLU H H 164 8.013 7.737 0.276 1 1 1793 . 18 1 1 A 164 164 GLU HA H 164 4.814 4.596 0.218 1 1 1797 . 18 1 1 A 164 164 GLU C C 164 176.910 176.344 0.566 1 1 1798 . 18 1 1 A 164 164 GLU CA C 164 54.355 55.123 -0.768 1 1 1799 . 18 1 1 A 164 164 GLU CB C 164 32.886 31.552 1.334 1 1 1801 . 18 1 1 A 164 164 GLU N N 164 115.943 118.139 -2.196 1 1 1802 . 18 1 1 A 165 165 LYS H H 165 9.088 8.918 0.170 1 1 1803 . 18 1 1 A 165 165 LYS HA H 165 3.942 4.069 -0.127 1 1 1809 . 18 1 1 A 165 165 LYS C C 165 179.657 177.834 1.823 1 1 1810 . 18 1 1 A 165 165 LYS CA C 165 59.888 58.324 1.564 1 1 1811 . 18 1 1 A 165 165 LYS CB C 165 32.024 32.497 -0.473 1 1 1814 . 18 1 1 A 165 165 LYS N N 165 124.120 125.953 -1.833 1 1 1815 . 18 1 1 A 166 166 ALA H H 166 8.851 7.731 1.120 1 1 1816 . 18 1 1 A 166 166 ALA HA H 166 4.251 4.070 0.181 1 1 1820 . 18 1 1 A 166 166 ALA C C 166 178.920 178.617 0.303 1 1 1821 . 18 1 1 A 166 166 ALA CA C 166 54.318 54.692 -0.374 1 1 1822 . 18 1 1 A 166 166 ALA CB C 166 18.810 18.293 0.517 1 1 1823 . 18 1 1 A 166 166 ALA N N 166 120.424 122.746 -2.322 1 1 1824 . 18 1 1 A 167 167 GLU H H 167 7.871 8.225 -0.354 1 1 1825 . 18 1 1 A 167 167 GLU HA H 167 4.404 4.262 0.142 1 1 1829 . 18 1 1 A 167 167 GLU C C 167 177.368 178.050 -0.682 1 1 1830 . 18 1 1 A 167 167 GLU CA C 167 56.701 56.636 0.065 1 1 1831 . 18 1 1 A 167 167 GLU CB C 167 31.208 29.868 1.340 1 1 1833 . 18 1 1 A 167 167 GLU N N 167 114.926 115.279 -0.353 1 1 1834 . 18 1 1 A 168 168 VAL H H 168 7.812 7.601 0.211 1 1 1835 . 18 1 1 A 168 168 VAL HA H 168 3.712 3.670 0.042 1 1 1843 . 18 1 1 A 168 168 VAL CA C 168 68.705 67.889 0.816 1 1 1844 . 18 1 1 A 168 168 VAL CB C 168 29.597 29.732 -0.135 1 1 1847 . 18 1 1 A 168 168 VAL N N 168 120.188 121.735 -1.547 1 1 1848 . 18 1 1 A 169 169 PRO HA H 169 4.252 4.285 -0.033 1 1 1851 . 18 1 1 A 169 169 PRO C C 169 179.563 178.516 1.047 1 1 1852 . 18 1 1 A 169 169 PRO CA C 169 67.077 66.419 0.658 1 1 1853 . 18 1 1 A 170 170 ALA H H 170 8.149 8.102 0.047 1 1 1854 . 18 1 1 A 170 170 ALA HA H 170 4.265 4.060 0.205 1 1 1858 . 18 1 1 A 170 170 ALA C C 170 180.637 179.734 0.903 1 1 1859 . 18 1 1 A 170 170 ALA CA C 170 54.823 55.272 -0.449 1 1 1860 . 18 1 1 A 170 170 ALA CB C 170 18.518 18.261 0.257 1 1 1861 . 18 1 1 A 170 170 ALA N N 170 119.210 119.317 -0.107 1 1 1862 . 18 1 1 A 171 171 ALA H H 171 7.767 8.422 -0.655 1 1 1863 . 18 1 1 A 171 171 ALA HA H 171 4.106 4.148 -0.042 1 1 1867 . 18 1 1 A 171 171 ALA C C 171 179.371 179.995 -0.624 1 1 1868 . 18 1 1 A 171 171 ALA CA C 171 55.130 55.116 0.014 1 1 1869 . 18 1 1 A 171 171 ALA CB C 171 18.291 18.024 0.267 1 1 1870 . 18 1 1 A 171 171 ALA N N 171 122.126 120.781 1.345 1 1 1871 . 18 1 1 A 172 172 LEU H H 172 8.950 8.187 0.763 1 1 1872 . 18 1 1 A 172 172 LEU HA H 172 3.987 4.088 -0.101 1 1 1878 . 18 1 1 A 172 172 LEU C C 172 178.355 178.660 -0.305 1 1 1879 . 18 1 1 A 172 172 LEU CA C 172 57.803 57.771 0.032 1 1 1880 . 18 1 1 A 172 172 LEU CB C 172 41.667 41.629 0.038 1 1 1882 . 18 1 1 A 172 172 LEU N N 172 118.682 121.275 -2.593 1 1 1883 . 18 1 1 A 173 173 GLU H H 173 7.886 7.808 0.078 1 1 1884 . 18 1 1 A 173 173 GLU HA H 173 4.132 3.940 0.192 1 1 1887 . 18 1 1 A 173 173 GLU C C 173 179.556 179.556 0.000 1 1 1888 . 18 1 1 A 173 173 GLU CA C 173 59.800 59.658 0.142 1 1 1889 . 18 1 1 A 173 173 GLU CB C 173 29.580 29.158 0.422 1 1 1891 . 18 1 1 A 173 173 GLU N N 173 117.561 118.949 -1.388 1 1 1892 . 18 1 1 A 174 174 LYS H H 174 7.532 7.542 -0.010 1 1 1893 . 18 1 1 A 174 174 LYS HA H 174 4.131 4.041 0.090 1 1 1901 . 18 1 1 A 174 174 LYS CA C 174 58.999 59.554 -0.555 1 1 1902 . 18 1 1 A 174 174 LYS CB C 174 32.041 32.524 -0.483 1 1 1906 . 18 1 1 A 174 174 LYS N N 174 119.085 119.526 -0.441 1 1 1907 . 18 1 1 A 175 175 ILE H H 175 8.479 7.915 0.564 1 1 1908 . 18 1 1 A 175 175 ILE HA H 175 3.583 3.607 -0.024 1 1 1918 . 18 1 1 A 175 175 ILE C C 175 179.258 178.556 0.702 1 1 1919 . 18 1 1 A 175 175 ILE CA C 175 65.769 65.683 0.086 1 1 1920 . 18 1 1 A 175 175 ILE CB C 175 37.876 38.018 -0.142 1 1 1923 . 18 1 1 A 175 175 ILE N N 175 118.828 119.988 -1.160 1 1 1924 . 18 1 1 A 176 176 ILE H H 176 8.928 7.938 0.990 1 1 1925 . 18 1 1 A 176 176 ILE HA H 176 3.600 3.583 0.017 1 1 1935 . 18 1 1 A 176 176 ILE C C 176 178.827 178.042 0.785 1 1 1936 . 18 1 1 A 176 176 ILE CA C 176 65.640 64.976 0.664 1 1 1937 . 18 1 1 A 176 176 ILE CB C 176 37.451 37.422 0.029 1 1 1941 . 18 1 1 A 176 176 ILE N N 176 124.527 119.832 4.695 1 1 1942 . 18 1 1 A 177 177 THR H H 177 8.175 8.118 0.057 1 1 1943 . 18 1 1 A 177 177 THR HA H 177 3.885 3.958 -0.073 1 1 1948 . 18 1 1 A 177 177 THR C C 177 176.867 176.346 0.521 1 1 1949 . 18 1 1 A 177 177 THR CA C 177 67.199 66.116 1.083 1 1 1950 . 18 1 1 A 177 177 THR CB C 177 68.377 68.859 -0.482 1 1 1952 . 18 1 1 A 177 177 THR N N 177 119.412 118.741 0.671 1 1 1953 . 18 1 1 A 178 178 VAL H H 178 8.352 8.107 0.245 1 1 1954 . 18 1 1 A 178 178 VAL HA H 178 3.572 3.444 0.128 1 1 1962 . 18 1 1 A 178 178 VAL C C 178 177.664 177.975 -0.311 1 1 1963 . 18 1 1 A 178 178 VAL CA C 178 66.909 66.548 0.361 1 1 1964 . 18 1 1 A 178 178 VAL CB C 178 31.714 31.274 0.440 1 1 1967 . 18 1 1 A 178 178 VAL N N 178 121.168 122.024 -0.856 1 1 1968 . 18 1 1 A 179 179 SER H H 179 8.529 8.115 0.414 1 1 1969 . 18 1 1 A 179 179 SER HA H 179 3.099 3.424 -0.325 1 1 1972 . 18 1 1 A 179 179 SER C C 179 175.380 176.353 -0.973 1 1 1973 . 18 1 1 A 179 179 SER CA C 179 62.728 61.937 0.791 1 1 1974 . 18 1 1 A 179 179 SER CB C 179 62.802 62.535 0.267 1 1 1975 . 18 1 1 A 179 179 SER N N 179 115.226 115.661 -0.435 1 1 1976 . 18 1 1 A 180 180 SER H H 180 7.757 8.191 -0.434 1 1 1977 . 18 1 1 A 180 180 SER HA H 180 4.419 4.191 0.228 1 1 1980 . 18 1 1 A 180 180 SER C C 180 175.359 176.571 -1.212 1 1 1981 . 18 1 1 A 180 180 SER CA C 180 61.025 61.468 -0.443 1 1 1982 . 18 1 1 A 180 180 SER CB C 180 63.072 63.014 0.058 1 1 1983 . 18 1 1 A 180 180 SER N N 180 114.718 116.124 -1.406 1 1 1984 . 18 1 1 A 181 181 MET H H 181 7.497 8.064 -0.567 1 1 1985 . 18 1 1 A 181 181 MET HA H 181 4.283 4.301 -0.018 1 1 1993 . 18 1 1 A 181 181 MET C C 181 177.217 176.776 0.441 1 1 1994 . 18 1 1 A 181 181 MET CA C 181 57.539 57.611 -0.072 1 1 1995 . 18 1 1 A 181 181 MET CB C 181 33.493 32.486 1.007 1 1 1998 . 18 1 1 A 181 181 MET N N 181 119.274 118.489 0.785 1 1 1999 . 18 1 1 A 182 182 LEU H H 182 7.163 7.534 -0.371 1 1 2000 . 18 1 1 A 182 182 LEU HA H 182 4.133 4.368 -0.235 1 1 2010 . 18 1 1 A 182 182 LEU C C 182 176.289 176.760 -0.471 1 1 2011 . 18 1 1 A 182 182 LEU CA C 182 54.750 54.948 -0.198 1 1 2012 . 18 1 1 A 182 182 LEU CB C 182 43.235 42.685 0.550 1 1 2016 . 18 1 1 A 182 182 LEU N N 182 115.869 117.810 -1.941 1 1 2017 . 18 1 1 A 183 183 GLY H H 183 7.492 7.260 0.232 1 1 2018 . 18 1 1 A 183 183 GLY HA2 H 183 4.086 4.178 -0.092 1 1 2019 . 18 1 1 A 183 183 GLY HA3 H 183 4.425 4.230 0.195 1 1 2020 . 18 1 1 A 183 183 GLY C C 183 171.830 172.036 -0.206 1 1 2021 . 18 1 1 A 183 183 GLY CA C 183 46.035 45.930 0.105 1 1 2022 . 18 1 1 A 183 183 GLY N N 183 107.761 105.933 1.828 1 1 2023 . 18 1 1 A 184 184 VAL H H 184 8.099 8.469 -0.370 1 1 2024 . 18 1 1 A 184 184 VAL HA H 184 4.772 4.727 0.045 1 1 2032 . 18 1 1 A 184 184 VAL CA C 184 59.305 58.916 0.389 1 1 2033 . 18 1 1 A 184 184 VAL CB C 184 33.648 35.184 -1.536 1 1 2036 . 18 1 1 A 184 184 VAL N N 184 119.803 121.814 -2.011 1 1 2037 . 18 1 1 A 185 185 PRO HA H 185 4.442 4.566 -0.124 1 1 2042 . 18 1 1 A 185 185 PRO C C 185 175.871 176.265 -0.394 1 1 2043 . 18 1 1 A 185 185 PRO CA C 185 63.886 62.694 1.192 1 1 2044 . 18 1 1 A 185 185 PRO CB C 185 32.260 32.188 0.072 1 1 2047 . 18 1 1 A 186 186 ALA H H 186 8.222 9.016 -0.794 1 1 2048 . 18 1 1 A 186 186 ALA HA H 186 4.569 4.675 -0.106 1 1 2052 . 18 1 1 A 186 186 ALA C C 186 177.481 176.743 0.738 1 1 2053 . 18 1 1 A 186 186 ALA CA C 186 51.823 50.648 1.175 1 1 2054 . 18 1 1 A 186 186 ALA CB C 186 20.233 21.425 -1.192 1 1 2055 . 18 1 1 A 186 186 ALA N N 186 125.663 122.772 2.891 1 1 2056 . 18 1 1 A 187 187 GLN H H 187 8.723 8.709 0.014 1 1 2057 . 18 1 1 A 187 187 GLN HA H 187 4.420 4.746 -0.326 1 1 2063 . 18 1 1 A 187 187 GLN C C 187 175.566 175.586 -0.020 1 1 2064 . 18 1 1 A 187 187 GLN CA C 187 56.051 55.560 0.491 1 1 2065 . 18 1 1 A 187 187 GLN CB C 187 29.812 30.407 -0.595 1 1 2067 . 18 1 1 A 187 187 GLN N N 187 120.742 116.604 4.138 1 1 2069 . 18 1 1 A 188 188 GLU H H 188 8.163 7.666 0.497 1 1 2070 . 18 1 1 A 188 188 GLU HA H 188 4.405 4.753 -0.348 1 1 2074 . 18 1 1 A 188 188 GLU C C 188 176.058 176.099 -0.041 1 1 2075 . 18 1 1 A 188 188 GLU CA C 188 56.158 54.382 1.776 1 1 2076 . 18 1 1 A 188 188 GLU CB C 188 31.095 30.992 0.103 1 1 2078 . 18 1 1 A 188 188 GLU N N 188 119.177 118.472 0.705 1 1 2079 . 18 1 1 A 189 189 GLU H H 189 8.567 8.365 0.202 1 1 2080 . 18 1 1 A 189 189 GLU HA H 189 4.252 4.306 -0.054 1 1 2084 . 18 1 1 A 189 189 GLU C C 189 175.703 176.278 -0.575 1 1 2085 . 18 1 1 A 189 189 GLU CA C 189 56.417 56.406 0.011 1 1 2086 . 18 1 1 A 189 189 GLU CB C 189 29.968 30.372 -0.404 1 1 2088 . 18 1 1 A 189 189 GLU N N 189 120.920 119.414 1.506 1 1 2089 . 18 1 1 A 190 190 ALA H H 190 8.271 8.469 -0.198 1 1 2090 . 18 1 1 A 190 190 ALA HA H 190 4.626 4.259 0.367 1 1 2094 . 18 1 1 A 190 190 ALA CA C 190 50.465 50.535 -0.070 1 1 2095 . 18 1 1 A 190 190 ALA CB C 190 18.451 19.547 -1.096 1 1 2096 . 18 1 1 A 190 190 ALA N N 190 128.323 125.119 3.204 1 1 2097 . 18 1 1 A 191 191 PRO HA H 191 4.493 4.747 -0.254 1 1 2103 . 18 1 1 A 191 191 PRO C C 191 175.899 177.057 -1.158 1 1 2104 . 18 1 1 A 191 191 PRO CA C 191 62.044 62.287 -0.243 1 1 2105 . 18 1 1 A 191 191 PRO CB C 191 32.184 31.496 0.688 1 1 2108 . 18 1 1 A 192 192 ALA H H 192 8.610 8.347 0.263 1 1 2109 . 18 1 1 A 192 192 ALA HA H 192 4.280 4.449 -0.169 1 1 2113 . 18 1 1 A 192 192 ALA C C 192 178.282 178.630 -0.348 1 1 2114 . 18 1 1 A 192 192 ALA CA C 192 51.698 51.758 -0.060 1 1 2115 . 18 1 1 A 192 192 ALA CB C 192 19.220 19.911 -0.691 1 1 2116 . 18 1 1 A 192 192 ALA N N 192 123.420 124.537 -1.117 1 1 2117 . 18 1 1 A 193 193 LYS H H 193 8.531 8.782 -0.251 1 1 2118 . 18 1 1 A 193 193 LYS HA H 193 3.294 4.423 -1.129 1 1 2126 . 18 1 1 A 193 193 LYS C C 193 177.640 178.431 -0.791 1 1 2127 . 18 1 1 A 193 193 LYS CA C 193 60.644 59.645 0.999 1 1 2128 . 18 1 1 A 193 193 LYS CB C 193 32.607 32.323 0.284 1 1 2132 . 18 1 1 A 193 193 LYS N N 193 122.851 117.868 4.983 1 1 2133 . 18 1 1 A 194 194 LEU H H 194 8.570 7.863 0.707 1 1 2134 . 18 1 1 A 194 194 LEU HA H 194 3.845 3.990 -0.145 1 1 2144 . 18 1 1 A 194 194 LEU C C 194 177.965 179.457 -1.492 1 1 2145 . 18 1 1 A 194 194 LEU CA C 194 57.611 57.355 0.256 1 1 2146 . 18 1 1 A 194 194 LEU CB C 194 41.776 40.676 1.100 1 1 2150 . 18 1 1 A 194 194 LEU N N 194 115.801 119.560 -3.759 1 1 2151 . 18 1 1 A 195 195 MET H H 195 6.782 7.987 -1.205 1 1 2152 . 18 1 1 A 195 195 MET HA H 195 4.487 3.971 0.516 1 1 2160 . 18 1 1 A 195 195 MET C C 195 178.280 178.807 -0.527 1 1 2161 . 18 1 1 A 195 195 MET CA C 195 56.858 58.867 -2.009 1 1 2162 . 18 1 1 A 195 195 MET CB C 195 31.557 32.486 -0.929 1 1 2165 . 18 1 1 A 195 195 MET N N 195 113.898 118.685 -4.787 1 1 2166 . 18 1 1 A 196 196 VAL H H 196 7.713 7.561 0.152 1 1 2167 . 18 1 1 A 196 196 VAL HA H 196 3.501 3.434 0.067 1 1 2175 . 18 1 1 A 196 196 VAL C C 196 177.624 177.487 0.137 1 1 2176 . 18 1 1 A 196 196 VAL CA C 196 66.318 65.625 0.693 1 1 2177 . 18 1 1 A 196 196 VAL CB C 196 31.380 30.928 0.452 1 1 2180 . 18 1 1 A 196 196 VAL N N 196 120.413 118.916 1.497 1 1 2181 . 18 1 1 A 197 197 TYR H H 197 7.972 7.856 0.116 1 1 2182 . 18 1 1 A 197 197 TYR HA H 197 3.145 3.602 -0.457 1 1 2187 . 18 1 1 A 197 197 TYR C C 197 177.726 176.765 0.961 1 1 2188 . 18 1 1 A 197 197 TYR CA C 197 62.253 61.385 0.868 1 1 2189 . 18 1 1 A 197 197 TYR CB C 197 37.314 37.995 -0.681 1 1 2192 . 18 1 1 A 197 197 TYR N N 197 119.543 121.108 -1.565 1 1 2193 . 18 1 1 A 198 198 LEU H H 198 8.630 8.800 -0.170 1 1 2194 . 18 1 1 A 198 198 LEU HA H 198 3.923 3.686 0.237 1 1 2203 . 18 1 1 A 198 198 LEU C C 198 178.074 179.014 -0.940 1 1 2204 . 18 1 1 A 198 198 LEU CA C 198 58.294 57.761 0.533 1 1 2205 . 18 1 1 A 198 198 LEU CB C 198 42.177 41.386 0.791 1 1 2209 . 18 1 1 A 198 198 LEU N N 198 118.430 119.728 -1.298 1 1 2210 . 18 1 1 A 199 199 GLN H H 199 8.082 8.034 0.048 1 1 2211 . 18 1 1 A 199 199 GLN HA H 199 3.054 3.478 -0.424 1 1 2216 . 18 1 1 A 199 199 GLN C C 199 176.875 178.713 -1.838 1 1 2217 . 18 1 1 A 199 199 GLN CA C 199 59.739 59.067 0.672 1 1 2218 . 18 1 1 A 199 199 GLN CB C 199 28.055 27.697 0.358 1 1 2220 . 18 1 1 A 199 199 GLN N N 199 117.926 117.258 0.668 1 1 2222 . 18 1 1 A 200 200 ARG H H 200 7.349 7.863 -0.514 1 1 2223 . 18 1 1 A 200 200 ARG HA H 200 3.798 3.986 -0.188 1 1 2231 . 18 1 1 A 200 200 ARG C C 200 178.037 178.704 -0.667 1 1 2232 . 18 1 1 A 200 200 ARG CA C 200 58.260 59.188 -0.928 1 1 2233 . 18 1 1 A 200 200 ARG CB C 200 30.706 30.696 0.010 1 1 2236 . 18 1 1 A 200 200 ARG N N 200 113.772 118.861 -5.089 1 1 2238 . 18 1 1 A 201 201 PHE H H 201 8.329 7.805 0.524 1 1 2239 . 18 1 1 A 201 201 PHE HA H 201 4.630 4.357 0.273 1 1 2244 . 18 1 1 A 201 201 PHE C C 201 176.606 175.996 0.610 1 1 2245 . 18 1 1 A 201 201 PHE CA C 201 59.014 59.779 -0.765 1 1 2246 . 18 1 1 A 201 201 PHE CB C 201 40.357 40.239 0.118 1 1 2249 . 18 1 1 A 201 201 PHE N N 201 114.182 117.028 -2.846 1 1 2250 . 18 1 1 A 202 202 ARG H H 202 8.719 7.930 0.789 1 1 2251 . 18 1 1 A 202 202 ARG HA H 202 5.071 4.810 0.261 1 1 2261 . 18 1 1 A 202 202 ARG CA C 202 53.956 53.826 0.130 1 1 2262 . 18 1 1 A 202 202 ARG CB C 202 31.979 30.585 1.394 1 1 2264 . 18 1 1 A 202 202 ARG N N 202 120.115 118.228 1.887 1 1 2266 . 18 1 1 A 203 203 PRO HA H 203 4.348 4.499 -0.151 1 1 2271 . 18 1 1 A 203 203 PRO C C 203 179.736 178.140 1.596 1 1 2272 . 18 1 1 A 203 203 PRO CA C 203 65.674 65.533 0.141 1 1 2273 . 18 1 1 A 203 203 PRO CB C 203 31.717 32.108 -0.391 1 1 2275 . 18 1 1 A 204 204 LEU H H 204 8.875 7.515 1.360 1 1 2276 . 18 1 1 A 204 204 LEU HA H 204 4.291 4.044 0.247 1 1 2286 . 18 1 1 A 204 204 LEU C C 204 180.353 177.907 2.446 1 1 2287 . 18 1 1 A 204 204 LEU CA C 204 58.012 57.068 0.944 1 1 2288 . 18 1 1 A 204 204 LEU CB C 204 40.893 42.185 -1.292 1 1 2292 . 18 1 1 A 204 204 LEU N N 204 118.940 116.671 2.269 1 1 2293 . 18 1 1 A 205 205 ASP H H 205 7.541 8.337 -0.796 1 1 2294 . 18 1 1 A 205 205 ASP HA H 205 4.622 4.314 0.308 1 1 2297 . 18 1 1 A 205 205 ASP C C 205 177.602 178.097 -0.495 1 1 2298 . 18 1 1 A 205 205 ASP CA C 205 57.437 57.311 0.126 1 1 2299 . 18 1 1 A 205 205 ASP CB C 205 41.143 40.160 0.983 1 1 2300 . 18 1 1 A 205 205 ASP N N 205 120.838 119.045 1.793 1 1 2301 . 18 1 1 A 206 206 TYR H H 206 8.237 8.531 -0.294 1 1 2302 . 18 1 1 A 206 206 TYR HA H 206 4.018 4.135 -0.117 1 1 2307 . 18 1 1 A 206 206 TYR C C 206 176.433 177.747 -1.314 1 1 2308 . 18 1 1 A 206 206 TYR CA C 206 62.148 61.903 0.245 1 1 2309 . 18 1 1 A 206 206 TYR CB C 206 38.305 38.618 -0.313 1 1 2312 . 18 1 1 A 206 206 TYR N N 206 119.475 123.012 -3.537 1 1 2313 . 18 1 1 A 207 207 GLN H H 207 8.124 8.003 0.121 1 1 2314 . 18 1 1 A 207 207 GLN HA H 207 3.823 3.232 0.591 1 1 2320 . 18 1 1 A 207 207 GLN C C 207 178.019 178.608 -0.589 1 1 2321 . 18 1 1 A 207 207 GLN CA C 207 58.841 59.014 -0.173 1 1 2322 . 18 1 1 A 207 207 GLN CB C 207 28.208 28.409 -0.201 1 1 2324 . 18 1 1 A 207 207 GLN N N 207 115.863 118.136 -2.273 1 1 2326 . 18 1 1 A 208 208 ARG H H 208 7.522 7.984 -0.462 1 1 2327 . 18 1 1 A 208 208 ARG HA H 208 4.127 4.051 0.076 1 1 2334 . 18 1 1 A 208 208 ARG C C 208 179.278 178.997 0.281 1 1 2335 . 18 1 1 A 208 208 ARG CA C 208 59.419 58.972 0.447 1 1 2336 . 18 1 1 A 208 208 ARG CB C 208 30.182 29.787 0.395 1 1 2338 . 18 1 1 A 208 208 ARG N N 208 118.471 119.950 -1.479 1 1 2340 . 18 1 1 A 209 209 LEU H H 209 7.869 7.863 0.006 1 1 2341 . 18 1 1 A 209 209 LEU HA H 209 4.091 4.167 -0.076 1 1 2351 . 18 1 1 A 209 209 LEU C C 209 179.715 178.209 1.506 1 1 2352 . 18 1 1 A 209 209 LEU CA C 209 57.891 57.986 -0.095 1 1 2353 . 18 1 1 A 209 209 LEU CB C 209 41.338 41.704 -0.366 1 1 2356 . 18 1 1 A 209 209 LEU N N 209 119.659 121.325 -1.666 1 1 2357 . 18 1 1 A 210 210 LEU H H 210 8.034 8.702 -0.668 1 1 2358 . 18 1 1 A 210 210 LEU HA H 210 3.977 4.023 -0.046 1 1 2367 . 18 1 1 A 210 210 LEU C C 210 180.363 178.583 1.780 1 1 2368 . 18 1 1 A 210 210 LEU CA C 210 57.459 58.423 -0.964 1 1 2369 . 18 1 1 A 210 210 LEU CB C 210 41.699 41.688 0.011 1 1 2373 . 18 1 1 A 210 210 LEU N N 210 120.967 119.872 1.095 1 1 2374 . 18 1 1 A 211 211 GLU H H 211 8.174 8.713 -0.539 1 1 2375 . 18 1 1 A 211 211 GLU HA H 211 4.075 4.012 0.063 1 1 2379 . 18 1 1 A 211 211 GLU C C 211 178.499 178.956 -0.457 1 1 2380 . 18 1 1 A 211 211 GLU CA C 211 58.575 59.409 -0.834 1 1 2381 . 18 1 1 A 211 211 GLU CB C 211 29.583 29.135 0.448 1 1 2383 . 18 1 1 A 211 211 GLU N N 211 119.217 117.911 1.306 1 1 2384 . 18 1 1 A 212 212 ALA H H 212 7.723 7.791 -0.068 1 1 2385 . 18 1 1 A 212 212 ALA HA H 212 4.291 4.233 0.058 1 1 2389 . 18 1 1 A 212 212 ALA C C 212 178.770 178.913 -0.143 1 1 2390 . 18 1 1 A 212 212 ALA CA C 212 53.966 54.819 -0.853 1 1 2391 . 18 1 1 A 212 212 ALA CB C 212 19.117 18.569 0.548 1 1 2392 . 18 1 1 A 212 212 ALA N N 212 121.798 122.397 -0.599 1 1 2393 . 18 1 1 A 213 213 ALA H H 213 7.743 7.754 -0.011 1 1 2394 . 18 1 1 A 213 213 ALA HA H 213 4.406 4.560 -0.154 1 1 2398 . 18 1 1 A 213 213 ALA C C 213 178.413 177.414 0.999 1 1 2399 . 18 1 1 A 213 213 ALA CA C 213 53.129 51.607 1.522 1 1 2400 . 18 1 1 A 213 213 ALA CB C 213 18.926 18.889 0.037 1 1 2401 . 18 1 1 A 213 213 ALA N N 213 120.435 118.077 2.358 1 1 2402 . 18 1 1 A 214 214 SER H H 214 7.944 7.727 0.217 1 1 2403 . 18 1 1 A 214 214 SER HA H 214 4.559 4.403 0.156 1 1 2406 . 18 1 1 A 214 214 SER C C 214 174.958 174.113 0.845 1 1 2407 . 18 1 1 A 214 214 SER CA C 214 58.640 57.764 0.876 1 1 2408 . 18 1 1 A 214 214 SER CB C 214 63.928 62.176 1.752 1 1 2409 . 18 1 1 A 214 214 SER N N 214 113.729 115.859 -2.130 1 1 2410 . 18 1 1 A 215 215 SER H H 215 8.255 8.800 -0.545 1 1 2411 . 18 1 1 A 215 215 SER HA H 215 4.547 4.596 -0.049 1 1 2413 . 18 1 1 A 215 215 SER C C 215 175.289 174.385 0.904 1 1 2414 . 18 1 1 A 215 215 SER CA C 215 58.833 58.319 0.514 1 1 2415 . 18 1 1 A 215 215 SER CB C 215 63.847 64.898 -1.051 1 1 2416 . 18 1 1 A 215 215 SER N N 215 117.674 121.030 -3.356 1 1 2417 . 18 1 1 A 216 216 GLY H H 216 8.431 8.341 0.090 1 1 2418 . 18 1 1 A 216 216 GLY HA2 H 216 4.054 4.029 0.025 1 1 2419 . 18 1 1 A 216 216 GLY C C 216 174.189 174.328 -0.139 1 1 2420 . 18 1 1 A 216 216 GLY CA C 216 45.412 44.936 0.476 1 1 2421 . 18 1 1 A 216 216 GLY N N 216 110.800 109.908 0.892 1 1 2422 . 18 1 1 A 217 217 GLU H H 217 8.267 8.645 -0.378 1 1 2423 . 18 1 1 A 217 217 GLU HA H 217 4.345 4.582 -0.237 1 1 2427 . 18 1 1 A 217 217 GLU C C 217 176.428 175.636 0.792 1 1 2428 . 18 1 1 A 217 217 GLU CA C 217 56.470 55.755 0.715 1 1 2429 . 18 1 1 A 217 217 GLU CB C 217 30.526 28.765 1.761 1 1 2430 . 18 1 1 A 217 217 GLU N N 217 120.726 120.174 0.552 1 1 2431 . 18 1 1 A 218 218 ALA H H 218 8.476 8.255 0.221 1 1 2432 . 18 1 1 A 218 218 ALA HA H 218 4.467 4.678 -0.211 1 1 2436 . 18 1 1 A 218 218 ALA C C 218 178.015 176.551 1.464 1 1 2437 . 18 1 1 A 218 218 ALA CA C 218 52.547 51.022 1.525 1 1 2438 . 18 1 1 A 218 218 ALA CB C 218 19.242 19.570 -0.328 1 1 2439 . 18 1 1 A 218 218 ALA N N 218 125.534 124.756 0.778 1 1 2440 . 18 1 1 A 219 219 THR H H 219 8.232 8.486 -0.254 1 1 2441 . 18 1 1 A 219 219 THR HA H 219 4.411 4.765 -0.354 1 1 2446 . 18 1 1 A 219 219 THR C C 219 175.327 173.803 1.524 1 1 2447 . 18 1 1 A 219 219 THR CA C 219 61.889 61.089 0.800 1 1 2448 . 18 1 1 A 219 219 THR CB C 219 69.939 68.779 1.160 1 1 2449 . 18 1 1 A 219 219 THR N N 219 113.242 115.439 -2.197 1 1 2450 . 18 1 1 A 220 220 GLY H H 220 8.418 8.960 -0.542 1 1 2451 . 18 1 1 A 220 220 GLY C C 220 174.037 172.750 1.287 1 1 2452 . 18 1 1 A 220 220 GLY CA C 220 45.408 46.598 -1.190 1 1 2453 . 18 1 1 A 220 220 GLY N N 220 111.031 111.730 -0.699 1 1 2454 . 18 1 1 A 221 221 ASP H H 221 8.345 8.338 0.007 1 1 2455 . 18 1 1 A 221 221 ASP HA H 221 4.700 4.772 -0.072 1 1 2458 . 18 1 1 A 221 221 ASP C C 221 176.535 177.026 -0.491 1 1 2459 . 18 1 1 A 221 221 ASP CA C 221 54.402 54.140 0.262 1 1 2460 . 18 1 1 A 221 221 ASP CB C 221 41.431 42.397 -0.966 1 1 2461 . 18 1 1 A 221 221 ASP N N 221 120.795 125.781 -4.986 1 1 2462 . 18 1 1 A 222 222 SER H H 222 8.353 8.765 -0.412 1 1 2463 . 18 1 1 A 222 222 SER HA H 222 4.493 4.417 0.076 1 1 2465 . 18 1 1 A 222 222 SER C C 222 174.224 173.574 0.650 1 1 2466 . 18 1 1 A 222 222 SER CA C 222 58.427 58.267 0.160 1 1 2467 . 18 1 1 A 222 222 SER CB C 222 63.860 63.458 0.402 1 1 2468 . 18 1 1 A 222 222 SER N N 222 116.220 117.889 -1.669 1 1 2469 . 18 1 1 A 223 223 ALA H H 223 8.381 7.956 0.425 1 1 2470 . 18 1 1 A 223 223 ALA HA H 223 4.461 4.057 0.404 1 1 2474 . 18 1 1 A 223 223 ALA C C 223 176.926 176.176 0.750 1 1 2475 . 18 1 1 A 223 223 ALA CA C 223 52.583 52.730 -0.147 1 1 2476 . 18 1 1 A 223 223 ALA CB C 223 19.438 17.717 1.721 1 1 2477 . 18 1 1 A 223 223 ALA N N 223 126.592 123.339 3.253 1 1 1 . 19 1 1 A 2 2 ALA HA H 2 4.274 4.655 -0.381 1 1 5 . 19 1 1 A 2 2 ALA C C 2 177.828 176.673 1.155 1 1 6 . 19 1 1 A 2 2 ALA CA C 2 52.984 50.669 2.315 1 1 7 . 19 1 1 A 2 2 ALA CB C 2 19.138 21.814 -2.676 1 1 8 . 19 1 1 A 3 3 GLN H H 3 8.463 8.830 -0.367 1 1 9 . 19 1 1 A 3 3 GLN HA H 3 4.676 4.600 0.076 1 1 12 . 19 1 1 A 3 3 GLN C C 3 176.002 176.892 -0.890 1 1 13 . 19 1 1 A 3 3 GLN CA C 3 56.258 55.994 0.264 1 1 14 . 19 1 1 A 3 3 GLN CB C 3 30.346 30.133 0.213 1 1 15 . 19 1 1 A 3 3 GLN N N 3 117.490 117.169 0.321 1 1 16 . 19 1 1 A 4 4 GLY H H 4 8.099 8.154 -0.055 1 1 17 . 19 1 1 A 4 4 GLY HA2 H 4 3.910 4.033 -0.123 1 1 18 . 19 1 1 A 4 4 GLY C C 4 173.332 174.196 -0.864 1 1 19 . 19 1 1 A 4 4 GLY CA C 4 45.333 47.037 -1.704 1 1 20 . 19 1 1 A 4 4 GLY N N 4 109.423 107.466 1.957 1 1 21 . 19 1 1 A 5 5 LEU H H 5 7.863 8.572 -0.709 1 1 22 . 19 1 1 A 5 5 LEU HA H 5 4.561 4.486 0.075 1 1 32 . 19 1 1 A 5 5 LEU C C 5 176.448 176.170 0.278 1 1 33 . 19 1 1 A 5 5 LEU CA C 5 54.713 54.367 0.346 1 1 34 . 19 1 1 A 5 5 LEU CB C 5 43.551 41.793 1.758 1 1 38 . 19 1 1 A 5 5 LEU N N 5 120.391 125.717 -5.326 1 1 39 . 19 1 1 A 6 6 ILE H H 6 8.764 8.790 -0.026 1 1 40 . 19 1 1 A 6 6 ILE HA H 6 4.087 4.082 0.005 1 1 49 . 19 1 1 A 6 6 ILE C C 6 174.679 175.842 -1.163 1 1 50 . 19 1 1 A 6 6 ILE CA C 6 61.279 61.749 -0.470 1 1 51 . 19 1 1 A 6 6 ILE CB C 6 39.651 37.173 2.478 1 1 54 . 19 1 1 A 6 6 ILE N N 6 123.050 124.750 -1.700 1 1 55 . 19 1 1 A 7 7 GLU H H 7 8.587 8.442 0.145 1 1 56 . 19 1 1 A 7 7 GLU HA H 7 4.917 4.797 0.120 1 1 61 . 19 1 1 A 7 7 GLU C C 7 175.978 176.042 -0.064 1 1 62 . 19 1 1 A 7 7 GLU CA C 7 56.127 56.221 -0.094 1 1 63 . 19 1 1 A 7 7 GLU CB C 7 31.115 30.127 0.988 1 1 65 . 19 1 1 A 7 7 GLU N N 7 127.415 128.381 -0.966 1 1 66 . 19 1 1 A 8 8 VAL H H 8 8.986 9.411 -0.425 1 1 67 . 19 1 1 A 8 8 VAL HA H 8 4.375 4.933 -0.558 1 1 72 . 19 1 1 A 8 8 VAL C C 8 173.704 174.418 -0.714 1 1 73 . 19 1 1 A 8 8 VAL CA C 8 61.347 59.336 2.011 1 1 74 . 19 1 1 A 8 8 VAL CB C 8 33.611 35.933 -2.322 1 1 76 . 19 1 1 A 8 8 VAL N N 8 126.071 119.203 6.868 1 1 77 . 19 1 1 A 9 9 GLU H H 9 8.521 9.122 -0.601 1 1 78 . 19 1 1 A 9 9 GLU HA H 9 5.837 5.399 0.438 1 1 81 . 19 1 1 A 9 9 GLU C C 9 175.939 174.708 1.231 1 1 82 . 19 1 1 A 9 9 GLU CA C 9 54.516 54.344 0.172 1 1 83 . 19 1 1 A 9 9 GLU CB C 9 33.009 34.354 -1.345 1 1 84 . 19 1 1 A 9 9 GLU N N 9 122.857 121.641 1.216 1 1 85 . 19 1 1 A 10 10 ARG H H 10 8.690 8.743 -0.053 1 1 86 . 19 1 1 A 10 10 ARG HA H 10 4.709 5.019 -0.310 1 1 94 . 19 1 1 A 10 10 ARG C C 10 174.826 174.529 0.297 1 1 95 . 19 1 1 A 10 10 ARG CA C 10 54.491 54.624 -0.133 1 1 96 . 19 1 1 A 10 10 ARG CB C 10 35.777 34.829 0.948 1 1 98 . 19 1 1 A 10 10 ARG N N 10 120.430 120.293 0.137 1 1 100 . 19 1 1 A 11 11 LYS H H 11 8.874 8.798 0.076 1 1 101 . 19 1 1 A 11 11 LYS HA H 11 5.530 5.348 0.182 1 1 107 . 19 1 1 A 11 11 LYS C C 11 176.919 174.614 2.305 1 1 108 . 19 1 1 A 11 11 LYS CA C 11 55.084 54.535 0.549 1 1 109 . 19 1 1 A 11 11 LYS CB C 11 35.435 36.706 -1.271 1 1 113 . 19 1 1 A 11 11 LYS N N 11 121.087 123.329 -2.242 1 1 114 . 19 1 1 A 12 12 PHE H H 12 8.877 9.235 -0.358 1 1 115 . 19 1 1 A 12 12 PHE HA H 12 5.130 5.073 0.057 1 1 120 . 19 1 1 A 12 12 PHE C C 12 171.676 172.039 -0.363 1 1 121 . 19 1 1 A 12 12 PHE CA C 12 55.869 56.249 -0.380 1 1 122 . 19 1 1 A 12 12 PHE CB C 12 42.108 41.263 0.845 1 1 125 . 19 1 1 A 12 12 PHE N N 12 117.486 119.795 -2.309 1 1 126 . 19 1 1 A 13 13 ALA H H 13 9.134 9.416 -0.282 1 1 127 . 19 1 1 A 13 13 ALA HA H 13 5.003 4.670 0.333 1 1 131 . 19 1 1 A 13 13 ALA CA C 13 48.340 48.807 -0.467 1 1 132 . 19 1 1 A 13 13 ALA CB C 13 19.191 20.408 -1.217 1 1 133 . 19 1 1 A 13 13 ALA N N 13 125.915 122.771 3.144 1 1 134 . 19 1 1 A 14 14 PRO HA H 14 4.620 4.710 -0.090 1 1 140 . 19 1 1 A 14 14 PRO C C 14 176.502 177.468 -0.966 1 1 141 . 19 1 1 A 14 14 PRO CA C 14 62.672 63.136 -0.464 1 1 142 . 19 1 1 A 14 14 PRO CB C 14 33.119 31.863 1.256 1 1 145 . 19 1 1 A 15 15 GLY H H 15 8.721 8.437 0.284 1 1 146 . 19 1 1 A 15 15 GLY HA2 H 15 3.999 4.101 -0.102 1 1 147 . 19 1 1 A 15 15 GLY HA3 H 15 4.632 4.104 0.528 1 1 148 . 19 1 1 A 15 15 GLY CA C 15 44.411 44.195 0.216 1 1 149 . 19 1 1 A 15 15 GLY N N 15 109.863 108.452 1.411 1 1 150 . 19 1 1 A 16 16 PRO HA H 16 4.447 4.395 0.052 1 1 155 . 19 1 1 A 16 16 PRO C C 16 177.053 176.722 0.331 1 1 156 . 19 1 1 A 16 16 PRO CA C 16 64.395 65.123 -0.728 1 1 157 . 19 1 1 A 16 16 PRO CB C 16 31.993 31.776 0.217 1 1 159 . 19 1 1 A 17 17 ASP H H 17 8.550 8.086 0.464 1 1 160 . 19 1 1 A 17 17 ASP HA H 17 4.950 4.944 0.006 1 1 163 . 19 1 1 A 17 17 ASP C C 17 176.800 176.199 0.601 1 1 164 . 19 1 1 A 17 17 ASP CA C 17 53.271 53.284 -0.013 1 1 165 . 19 1 1 A 17 17 ASP CB C 17 40.392 41.472 -1.080 1 1 166 . 19 1 1 A 17 17 ASP N N 17 116.060 116.881 -0.821 1 1 167 . 19 1 1 A 18 18 THR H H 18 7.664 8.278 -0.614 1 1 168 . 19 1 1 A 18 18 THR HA H 18 4.120 3.761 0.359 1 1 174 . 19 1 1 A 18 18 THR C C 18 175.407 176.420 -1.013 1 1 175 . 19 1 1 A 18 18 THR CA C 18 68.718 66.998 1.720 1 1 176 . 19 1 1 A 18 18 THR CB C 18 69.179 68.664 0.515 1 1 178 . 19 1 1 A 18 18 THR N N 18 117.158 116.511 0.647 1 1 179 . 19 1 1 A 19 19 GLU H H 19 8.817 8.323 0.494 1 1 180 . 19 1 1 A 19 19 GLU HA H 19 3.510 3.352 0.158 1 1 184 . 19 1 1 A 19 19 GLU C C 19 178.345 179.341 -0.996 1 1 185 . 19 1 1 A 19 19 GLU CA C 19 61.237 59.788 1.449 1 1 186 . 19 1 1 A 19 19 GLU CB C 19 28.746 29.389 -0.643 1 1 188 . 19 1 1 A 19 19 GLU N N 19 118.802 118.765 0.037 1 1 189 . 19 1 1 A 20 20 GLU H H 20 7.976 8.177 -0.201 1 1 190 . 19 1 1 A 20 20 GLU HA H 20 4.036 4.145 -0.109 1 1 194 . 19 1 1 A 20 20 GLU C C 20 179.451 179.452 -0.001 1 1 195 . 19 1 1 A 20 20 GLU CA C 20 59.909 59.024 0.885 1 1 196 . 19 1 1 A 20 20 GLU CB C 20 28.992 29.455 -0.463 1 1 198 . 19 1 1 A 20 20 GLU N N 20 121.130 120.139 0.991 1 1 199 . 19 1 1 A 21 21 ARG H H 21 8.199 7.919 0.280 1 1 200 . 19 1 1 A 21 21 ARG HA H 21 4.061 4.143 -0.082 1 1 207 . 19 1 1 A 21 21 ARG C C 21 179.087 178.863 0.224 1 1 208 . 19 1 1 A 21 21 ARG CA C 21 58.477 58.541 -0.064 1 1 209 . 19 1 1 A 21 21 ARG CB C 21 30.101 29.959 0.142 1 1 211 . 19 1 1 A 21 21 ARG N N 21 119.897 120.354 -0.457 1 1 213 . 19 1 1 A 22 22 LEU H H 22 8.154 8.492 -0.338 1 1 214 . 19 1 1 A 22 22 LEU HA H 22 3.560 3.742 -0.182 1 1 224 . 19 1 1 A 22 22 LEU C C 22 178.461 179.140 -0.679 1 1 225 . 19 1 1 A 22 22 LEU CA C 22 58.432 57.642 0.790 1 1 226 . 19 1 1 A 22 22 LEU CB C 22 40.229 40.865 -0.636 1 1 230 . 19 1 1 A 22 22 LEU N N 22 120.012 119.494 0.518 1 1 231 . 19 1 1 A 23 23 GLN H H 23 7.621 8.156 -0.535 1 1 232 . 19 1 1 A 23 23 GLN HA H 23 4.232 4.113 0.119 1 1 238 . 19 1 1 A 23 23 GLN C C 23 180.543 178.108 2.435 1 1 239 . 19 1 1 A 23 23 GLN CA C 23 59.434 59.322 0.112 1 1 240 . 19 1 1 A 23 23 GLN CB C 23 28.749 28.506 0.243 1 1 242 . 19 1 1 A 23 23 GLN N N 23 117.823 117.720 0.103 1 1 244 . 19 1 1 A 24 24 GLU H H 24 8.165 7.880 0.285 1 1 245 . 19 1 1 A 24 24 GLU HA H 24 4.072 4.162 -0.090 1 1 249 . 19 1 1 A 24 24 GLU C C 24 178.612 179.130 -0.518 1 1 250 . 19 1 1 A 24 24 GLU CA C 24 59.236 58.892 0.344 1 1 251 . 19 1 1 A 24 24 GLU CB C 24 29.606 29.402 0.204 1 1 253 . 19 1 1 A 24 24 GLU N N 24 122.589 120.135 2.454 1 1 254 . 19 1 1 A 25 25 LEU H H 25 7.911 8.005 -0.094 1 1 255 . 19 1 1 A 25 25 LEU HA H 25 4.214 4.091 0.123 1 1 265 . 19 1 1 A 25 25 LEU C C 25 176.745 177.353 -0.608 1 1 266 . 19 1 1 A 25 25 LEU CA C 25 55.659 55.909 -0.250 1 1 267 . 19 1 1 A 25 25 LEU CB C 25 43.109 42.771 0.338 1 1 271 . 19 1 1 A 25 25 LEU N N 25 117.882 117.204 0.678 1 1 272 . 19 1 1 A 26 26 GLY H H 26 7.776 7.994 -0.218 1 1 273 . 19 1 1 A 26 26 GLY HA2 H 26 4.337 4.042 0.295 1 1 274 . 19 1 1 A 26 26 GLY HA3 H 26 3.856 4.058 -0.202 1 1 275 . 19 1 1 A 26 26 GLY C C 26 175.456 174.577 0.879 1 1 276 . 19 1 1 A 26 26 GLY CA C 26 44.875 45.207 -0.332 1 1 277 . 19 1 1 A 26 26 GLY N N 26 104.938 105.786 -0.848 1 1 278 . 19 1 1 A 27 27 ALA H H 27 8.104 8.518 -0.414 1 1 279 . 19 1 1 A 27 27 ALA HA H 27 4.949 4.534 0.415 1 1 283 . 19 1 1 A 27 27 ALA C C 27 176.448 177.397 -0.949 1 1 284 . 19 1 1 A 27 27 ALA CA C 27 52.183 52.479 -0.296 1 1 285 . 19 1 1 A 27 27 ALA CB C 27 21.814 20.085 1.729 1 1 286 . 19 1 1 A 27 27 ALA N N 27 123.263 124.451 -1.188 1 1 287 . 19 1 1 A 28 28 THR H H 28 9.369 9.424 -0.055 1 1 288 . 19 1 1 A 28 28 THR HA H 28 4.779 4.614 0.165 1 1 293 . 19 1 1 A 28 28 THR C C 28 173.725 173.603 0.122 1 1 294 . 19 1 1 A 28 28 THR CA C 28 60.046 62.662 -2.616 1 1 295 . 19 1 1 A 28 28 THR CB C 28 70.592 69.449 1.143 1 1 297 . 19 1 1 A 28 28 THR N N 28 112.201 119.280 -7.079 1 1 298 . 19 1 1 A 29 29 LEU H H 29 8.518 8.502 0.016 1 1 299 . 19 1 1 A 29 29 LEU HA H 29 3.332 3.851 -0.519 1 1 309 . 19 1 1 A 29 29 LEU C C 29 176.202 176.563 -0.361 1 1 310 . 19 1 1 A 29 29 LEU CA C 29 55.031 54.231 0.800 1 1 311 . 19 1 1 A 29 29 LEU CB C 29 40.624 40.994 -0.370 1 1 315 . 19 1 1 A 29 29 LEU N N 29 128.151 128.279 -0.128 1 1 316 . 19 1 1 A 30 30 GLU H H 30 9.269 8.868 0.401 1 1 317 . 19 1 1 A 30 30 GLU HA H 30 4.287 4.208 0.079 1 1 321 . 19 1 1 A 30 30 GLU C C 30 176.740 175.763 0.977 1 1 322 . 19 1 1 A 30 30 GLU CA C 30 57.283 57.609 -0.326 1 1 323 . 19 1 1 A 30 30 GLU CB C 30 31.045 30.401 0.644 1 1 325 . 19 1 1 A 30 30 GLU N N 30 130.123 123.609 6.514 1 1 326 . 19 1 1 A 31 31 HIS H H 31 7.341 7.150 0.191 1 1 327 . 19 1 1 A 31 31 HIS HA H 31 4.701 5.141 -0.440 1 1 331 . 19 1 1 A 31 31 HIS C C 31 172.581 173.895 -1.314 1 1 332 . 19 1 1 A 31 31 HIS CA C 31 55.876 54.667 1.209 1 1 333 . 19 1 1 A 31 31 HIS CB C 31 33.434 34.409 -0.975 1 1 334 . 19 1 1 A 31 31 HIS N N 31 113.223 116.268 -3.045 1 1 335 . 19 1 1 A 32 32 ARG H H 32 8.196 8.948 -0.752 1 1 336 . 19 1 1 A 32 32 ARG HA H 32 5.262 5.412 -0.150 1 1 341 . 19 1 1 A 32 32 ARG C C 32 174.377 174.855 -0.478 1 1 342 . 19 1 1 A 32 32 ARG CA C 32 55.808 54.461 1.347 1 1 343 . 19 1 1 A 32 32 ARG CB C 32 33.340 33.810 -0.470 1 1 345 . 19 1 1 A 32 32 ARG N N 32 123.003 120.087 2.916 1 1 346 . 19 1 1 A 33 33 VAL H H 33 8.956 8.747 0.209 1 1 347 . 19 1 1 A 33 33 VAL HA H 33 4.734 4.980 -0.246 1 1 355 . 19 1 1 A 33 33 VAL C C 33 172.821 174.905 -2.084 1 1 356 . 19 1 1 A 33 33 VAL CA C 33 60.197 60.058 0.139 1 1 357 . 19 1 1 A 33 33 VAL CB C 33 35.860 35.309 0.551 1 1 360 . 19 1 1 A 33 33 VAL N N 33 122.929 117.661 5.268 1 1 361 . 19 1 1 A 34 34 THR H H 34 8.250 8.829 -0.579 1 1 362 . 19 1 1 A 34 34 THR HA H 34 5.616 5.824 -0.208 1 1 367 . 19 1 1 A 34 34 THR C C 34 173.913 173.456 0.457 1 1 368 . 19 1 1 A 34 34 THR CA C 34 60.245 60.340 -0.095 1 1 369 . 19 1 1 A 34 34 THR CB C 34 71.706 71.325 0.381 1 1 371 . 19 1 1 A 34 34 THR N N 34 119.164 116.001 3.163 1 1 372 . 19 1 1 A 35 35 PHE H H 35 8.565 8.619 -0.054 1 1 373 . 19 1 1 A 35 35 PHE HA H 35 5.029 5.102 -0.073 1 1 378 . 19 1 1 A 35 35 PHE C C 35 173.193 171.976 1.217 1 1 379 . 19 1 1 A 35 35 PHE CA C 35 55.687 56.185 -0.498 1 1 380 . 19 1 1 A 35 35 PHE CB C 35 40.853 40.842 0.011 1 1 383 . 19 1 1 A 35 35 PHE N N 35 120.244 118.121 2.123 1 1 384 . 19 1 1 A 36 36 ARG H H 36 8.869 8.786 0.083 1 1 385 . 19 1 1 A 36 36 ARG HA H 36 4.982 5.143 -0.161 1 1 387 . 19 1 1 A 36 36 ARG C C 36 174.743 174.572 0.171 1 1 388 . 19 1 1 A 36 36 ARG CA C 36 55.493 54.282 1.211 1 1 389 . 19 1 1 A 36 36 ARG CB C 36 32.228 33.224 -0.996 1 1 390 . 19 1 1 A 36 36 ARG N N 36 123.893 120.479 3.414 1 1 391 . 19 1 1 A 37 37 ASP H H 37 8.402 8.982 -0.580 1 1 392 . 19 1 1 A 37 37 ASP HA H 37 5.462 5.414 0.048 1 1 395 . 19 1 1 A 37 37 ASP C C 37 175.177 174.887 0.290 1 1 396 . 19 1 1 A 37 37 ASP CA C 37 53.942 53.138 0.804 1 1 397 . 19 1 1 A 37 37 ASP CB C 37 45.486 42.520 2.966 1 1 398 . 19 1 1 A 37 37 ASP N N 37 127.149 125.938 1.211 1 1 399 . 19 1 1 A 38 38 THR H H 38 8.151 9.285 -1.134 1 1 400 . 19 1 1 A 38 38 THR HA H 38 4.866 4.451 0.415 1 1 405 . 19 1 1 A 38 38 THR C C 38 172.792 173.373 -0.581 1 1 406 . 19 1 1 A 38 38 THR CA C 38 61.416 61.481 -0.065 1 1 407 . 19 1 1 A 38 38 THR CB C 38 71.047 69.181 1.866 1 1 409 . 19 1 1 A 38 38 THR N N 38 115.686 120.597 -4.911 1 1 410 . 19 1 1 A 39 39 TYR H H 39 9.021 9.112 -0.091 1 1 411 . 19 1 1 A 39 39 TYR HA H 39 5.544 5.724 -0.180 1 1 416 . 19 1 1 A 39 39 TYR C C 39 176.032 174.937 1.095 1 1 417 . 19 1 1 A 39 39 TYR CA C 39 57.184 56.347 0.837 1 1 418 . 19 1 1 A 39 39 TYR CB C 39 41.642 40.377 1.265 1 1 420 . 19 1 1 A 39 39 TYR N N 39 124.579 126.864 -2.285 1 1 421 . 19 1 1 A 40 40 TYR H H 40 8.487 9.457 -0.970 1 1 422 . 19 1 1 A 40 40 TYR HA H 40 5.517 5.681 -0.164 1 1 426 . 19 1 1 A 40 40 TYR C C 40 174.108 174.263 -0.155 1 1 427 . 19 1 1 A 40 40 TYR CA C 40 56.979 56.739 0.240 1 1 428 . 19 1 1 A 40 40 TYR CB C 40 44.132 43.206 0.926 1 1 431 . 19 1 1 A 40 40 TYR N N 40 119.709 121.436 -1.727 1 1 432 . 19 1 1 A 41 41 ASP H H 41 9.341 8.868 0.473 1 1 433 . 19 1 1 A 41 41 ASP HA H 41 4.866 5.167 -0.301 1 1 436 . 19 1 1 A 41 41 ASP C C 41 177.262 174.741 2.521 1 1 437 . 19 1 1 A 41 41 ASP CA C 41 53.445 53.398 0.047 1 1 438 . 19 1 1 A 41 41 ASP CB C 41 45.347 44.648 0.699 1 1 439 . 19 1 1 A 41 41 ASP N N 41 117.995 120.643 -2.648 1 1 440 . 19 1 1 A 42 42 THR H H 42 11.574 8.669 2.905 1 1 441 . 19 1 1 A 42 42 THR HA H 42 5.206 4.527 0.679 1 1 446 . 19 1 1 A 42 42 THR C C 42 177.935 176.241 1.694 1 1 447 . 19 1 1 A 42 42 THR CA C 42 60.400 61.187 -0.787 1 1 448 . 19 1 1 A 42 42 THR CB C 42 72.114 70.901 1.213 1 1 450 . 19 1 1 A 42 42 THR N N 42 114.394 114.637 -0.243 1 1 451 . 19 1 1 A 43 43 SER H H 43 9.715 8.827 0.888 1 1 452 . 19 1 1 A 43 43 SER HA H 43 4.252 4.210 0.042 1 1 455 . 19 1 1 A 43 43 SER C C 43 175.478 175.390 0.088 1 1 456 . 19 1 1 A 43 43 SER CA C 43 61.277 60.804 0.473 1 1 457 . 19 1 1 A 43 43 SER CB C 43 62.821 63.080 -0.259 1 1 458 . 19 1 1 A 43 43 SER N N 43 116.674 115.922 0.752 1 1 459 . 19 1 1 A 44 44 GLU H H 44 7.674 7.611 0.063 1 1 460 . 19 1 1 A 44 44 GLU HA H 44 4.330 4.469 -0.139 1 1 464 . 19 1 1 A 44 44 GLU C C 44 175.001 175.401 -0.400 1 1 465 . 19 1 1 A 44 44 GLU CA C 44 55.992 55.594 0.398 1 1 466 . 19 1 1 A 44 44 GLU CB C 44 29.276 29.707 -0.431 1 1 468 . 19 1 1 A 44 44 GLU N N 44 117.856 118.896 -1.040 1 1 469 . 19 1 1 A 45 45 LEU H H 45 8.222 7.644 0.578 1 1 470 . 19 1 1 A 45 45 LEU HA H 45 3.901 3.958 -0.057 1 1 480 . 19 1 1 A 45 45 LEU C C 45 175.209 176.401 -1.192 1 1 481 . 19 1 1 A 45 45 LEU CA C 45 55.548 56.172 -0.624 1 1 482 . 19 1 1 A 45 45 LEU CB C 45 38.458 39.186 -0.728 1 1 485 . 19 1 1 A 45 45 LEU N N 45 119.335 117.501 1.834 1 1 486 . 19 1 1 A 46 46 SER H H 46 7.347 8.032 -0.685 1 1 487 . 19 1 1 A 46 46 SER HA H 46 3.954 4.129 -0.175 1 1 489 . 19 1 1 A 46 46 SER C C 46 177.497 176.305 1.192 1 1 490 . 19 1 1 A 46 46 SER CA C 46 62.471 62.320 0.151 1 1 491 . 19 1 1 A 46 46 SER CB C 46 63.908 62.865 1.043 1 1 492 . 19 1 1 A 46 46 SER N N 46 111.433 114.021 -2.588 1 1 493 . 19 1 1 A 47 47 LEU H H 47 12.003 8.100 3.903 1 1 494 . 19 1 1 A 47 47 LEU HA H 47 3.959 4.065 -0.106 1 1 504 . 19 1 1 A 47 47 LEU C C 47 180.340 178.268 2.072 1 1 505 . 19 1 1 A 47 47 LEU CA C 47 58.879 58.217 0.662 1 1 506 . 19 1 1 A 47 47 LEU CB C 47 39.572 41.882 -2.310 1 1 510 . 19 1 1 A 47 47 LEU N N 47 124.605 122.690 1.915 1 1 511 . 19 1 1 A 48 48 MET H H 48 10.599 8.676 1.923 1 1 512 . 19 1 1 A 48 48 MET HA H 48 3.213 3.567 -0.354 1 1 520 . 19 1 1 A 48 48 MET C C 48 181.177 178.173 3.004 1 1 521 . 19 1 1 A 48 48 MET CA C 48 60.747 58.157 2.590 1 1 522 . 19 1 1 A 48 48 MET CB C 48 32.594 31.727 0.867 1 1 525 . 19 1 1 A 48 48 MET N N 48 126.254 118.710 7.544 1 1 526 . 19 1 1 A 49 49 LEU H H 49 8.731 7.893 0.838 1 1 527 . 19 1 1 A 49 49 LEU HA H 49 4.097 4.126 -0.029 1 1 536 . 19 1 1 A 49 49 LEU C C 49 178.144 177.479 0.665 1 1 537 . 19 1 1 A 49 49 LEU CA C 49 57.800 56.567 1.233 1 1 538 . 19 1 1 A 49 49 LEU CB C 49 41.379 41.602 -0.223 1 1 541 . 19 1 1 A 49 49 LEU N N 49 119.183 120.081 -0.898 1 1 542 . 19 1 1 A 50 50 SER H H 50 7.853 7.561 0.292 1 1 543 . 19 1 1 A 50 50 SER HA H 50 4.822 4.623 0.199 1 1 546 . 19 1 1 A 50 50 SER C C 50 174.539 173.606 0.933 1 1 547 . 19 1 1 A 50 50 SER CA C 50 57.811 57.903 -0.092 1 1 548 . 19 1 1 A 50 50 SER CB C 50 64.443 63.387 1.056 1 1 549 . 19 1 1 A 50 50 SER N N 50 114.594 113.601 0.993 1 1 550 . 19 1 1 A 51 51 ASP H H 51 8.264 7.995 0.269 1 1 551 . 19 1 1 A 51 51 ASP HA H 51 4.362 4.279 0.083 1 1 554 . 19 1 1 A 51 51 ASP C C 51 172.921 174.766 -1.845 1 1 555 . 19 1 1 A 51 51 ASP CA C 51 55.343 55.514 -0.171 1 1 556 . 19 1 1 A 51 51 ASP CB C 51 40.583 39.368 1.215 1 1 557 . 19 1 1 A 51 51 ASP N N 51 123.003 118.822 4.181 1 1 558 . 19 1 1 A 52 52 HIS H H 52 7.869 7.291 0.578 1 1 559 . 19 1 1 A 52 52 HIS HA H 52 5.335 5.482 -0.147 1 1 564 . 19 1 1 A 52 52 HIS C C 52 173.991 173.723 0.268 1 1 565 . 19 1 1 A 52 52 HIS CA C 52 55.889 54.218 1.671 1 1 566 . 19 1 1 A 52 52 HIS CB C 52 31.789 30.535 1.254 1 1 568 . 19 1 1 A 52 52 HIS N N 52 112.486 117.347 -4.861 1 1 569 . 19 1 1 A 53 53 TRP H H 53 8.165 9.647 -1.482 1 1 570 . 19 1 1 A 53 53 TRP HA H 53 4.926 5.216 -0.290 1 1 578 . 19 1 1 A 53 53 TRP C C 53 175.354 175.408 -0.054 1 1 579 . 19 1 1 A 53 53 TRP CA C 53 55.364 56.099 -0.735 1 1 580 . 19 1 1 A 53 53 TRP CB C 53 30.641 31.663 -1.022 1 1 585 . 19 1 1 A 53 53 TRP N N 53 117.916 125.202 -7.286 1 1 587 . 19 1 1 A 54 54 LEU H H 54 10.088 9.158 0.930 1 1 588 . 19 1 1 A 54 54 LEU HA H 54 5.497 5.499 -0.002 1 1 598 . 19 1 1 A 54 54 LEU C C 54 173.337 175.310 -1.973 1 1 599 . 19 1 1 A 54 54 LEU CA C 54 54.408 54.196 0.212 1 1 600 . 19 1 1 A 54 54 LEU CB C 54 44.156 46.282 -2.126 1 1 604 . 19 1 1 A 54 54 LEU N N 54 130.826 124.205 6.621 1 1 605 . 19 1 1 A 55 55 ARG H H 55 9.289 9.766 -0.477 1 1 606 . 19 1 1 A 55 55 ARG HA H 55 5.482 5.413 0.069 1 1 612 . 19 1 1 A 55 55 ARG C C 55 174.057 173.902 0.155 1 1 613 . 19 1 1 A 55 55 ARG CA C 55 53.167 54.099 -0.932 1 1 614 . 19 1 1 A 55 55 ARG CB C 55 34.270 33.665 0.605 1 1 616 . 19 1 1 A 55 55 ARG N N 55 125.089 125.199 -0.110 1 1 618 . 19 1 1 A 56 56 GLN H H 56 9.092 9.157 -0.065 1 1 619 . 19 1 1 A 56 56 GLN HA H 56 3.991 4.684 -0.693 1 1 626 . 19 1 1 A 56 56 GLN C C 56 174.199 175.212 -1.013 1 1 627 . 19 1 1 A 56 56 GLN CA C 56 54.566 53.458 1.108 1 1 628 . 19 1 1 A 56 56 GLN CB C 56 29.643 31.311 -1.668 1 1 630 . 19 1 1 A 56 56 GLN N N 56 124.355 121.105 3.250 1 1 632 . 19 1 1 A 57 57 ARG H H 57 8.440 8.418 0.022 1 1 633 . 19 1 1 A 57 57 ARG HA H 57 5.316 4.470 0.846 1 1 639 . 19 1 1 A 57 57 ARG C C 57 176.188 177.627 -1.439 1 1 640 . 19 1 1 A 57 57 ARG CA C 57 53.940 55.387 -1.447 1 1 641 . 19 1 1 A 57 57 ARG CB C 57 32.426 31.122 1.304 1 1 643 . 19 1 1 A 57 57 ARG N N 57 130.222 125.183 5.039 1 1 645 . 19 1 1 A 58 58 GLU H H 58 8.891 8.519 0.372 1 1 646 . 19 1 1 A 58 58 GLU HA H 58 3.996 4.278 -0.282 1 1 649 . 19 1 1 A 58 58 GLU CA C 58 58.364 55.706 2.658 1 1 650 . 19 1 1 A 58 58 GLU CB C 58 30.875 28.553 2.322 1 1 651 . 19 1 1 A 58 58 GLU N N 58 131.208 121.046 10.162 1 1 652 . 19 1 1 A 59 59 GLY H H 59 8.367 8.815 -0.448 1 1 653 . 19 1 1 A 59 59 GLY HA2 H 59 4.334 3.887 0.447 1 1 654 . 19 1 1 A 59 59 GLY HA3 H 59 3.743 3.928 -0.185 1 1 655 . 19 1 1 A 59 59 GLY C C 59 174.194 174.589 -0.395 1 1 656 . 19 1 1 A 59 59 GLY CA C 59 45.666 45.439 0.227 1 1 657 . 19 1 1 A 60 60 SER H H 60 8.071 7.884 0.187 1 1 658 . 19 1 1 A 60 60 SER HA H 60 4.730 4.457 0.273 1 1 661 . 19 1 1 A 60 60 SER C C 60 173.908 174.350 -0.442 1 1 662 . 19 1 1 A 60 60 SER CA C 60 58.762 58.097 0.665 1 1 663 . 19 1 1 A 60 60 SER CB C 60 64.497 63.236 1.261 1 1 664 . 19 1 1 A 60 60 SER N N 60 114.636 117.166 -2.530 1 1 665 . 19 1 1 A 61 61 GLY H H 61 8.401 7.389 1.012 1 1 666 . 19 1 1 A 61 61 GLY HA2 H 61 4.560 4.061 0.499 1 1 667 . 19 1 1 A 61 61 GLY HA3 H 61 3.878 4.076 -0.198 1 1 668 . 19 1 1 A 61 61 GLY C C 61 173.526 172.684 0.842 1 1 669 . 19 1 1 A 61 61 GLY CA C 61 44.906 43.975 0.931 1 1 670 . 19 1 1 A 61 61 GLY N N 61 109.421 108.664 0.757 1 1 671 . 19 1 1 A 62 62 TRP H H 62 8.861 8.396 0.465 1 1 672 . 19 1 1 A 62 62 TRP HA H 62 5.089 5.471 -0.382 1 1 681 . 19 1 1 A 62 62 TRP C C 62 176.168 175.565 0.603 1 1 682 . 19 1 1 A 62 62 TRP CA C 62 57.459 56.213 1.246 1 1 683 . 19 1 1 A 62 62 TRP CB C 62 32.536 33.358 -0.822 1 1 689 . 19 1 1 A 62 62 TRP N N 62 122.939 121.250 1.689 1 1 691 . 19 1 1 A 63 63 GLU H H 63 9.306 9.180 0.126 1 1 692 . 19 1 1 A 63 63 GLU HA H 63 4.919 5.258 -0.339 1 1 697 . 19 1 1 A 63 63 GLU C C 63 173.770 174.927 -1.157 1 1 698 . 19 1 1 A 63 63 GLU CA C 63 55.953 55.697 0.256 1 1 699 . 19 1 1 A 63 63 GLU CB C 63 35.317 33.592 1.725 1 1 701 . 19 1 1 A 63 63 GLU N N 63 120.136 119.950 0.186 1 1 702 . 19 1 1 A 64 64 LEU H H 64 8.998 9.115 -0.117 1 1 703 . 19 1 1 A 64 64 LEU HA H 64 5.616 5.701 -0.085 1 1 712 . 19 1 1 A 64 64 LEU C C 64 175.014 173.912 1.102 1 1 713 . 19 1 1 A 64 64 LEU CA C 64 52.945 54.257 -1.312 1 1 714 . 19 1 1 A 64 64 LEU CB C 64 46.904 46.147 0.757 1 1 717 . 19 1 1 A 64 64 LEU N N 64 127.321 126.184 1.137 1 1 718 . 19 1 1 A 65 65 LYS H H 65 9.322 9.845 -0.523 1 1 719 . 19 1 1 A 65 65 LYS HA H 65 5.347 5.249 0.098 1 1 727 . 19 1 1 A 65 65 LYS C C 65 175.811 176.102 -0.291 1 1 728 . 19 1 1 A 65 65 LYS CA C 65 55.817 55.350 0.467 1 1 729 . 19 1 1 A 65 65 LYS CB C 65 34.521 35.071 -0.550 1 1 733 . 19 1 1 A 65 65 LYS N N 65 129.874 128.774 1.100 1 1 734 . 19 1 1 A 66 66 CYS H H 66 9.129 9.072 0.057 1 1 735 . 19 1 1 A 66 66 CYS HA H 66 5.319 5.019 0.300 1 1 738 . 19 1 1 A 66 66 CYS CA C 66 54.532 56.387 -1.855 1 1 739 . 19 1 1 A 66 66 CYS CB C 66 28.813 29.873 -1.060 1 1 740 . 19 1 1 A 66 66 CYS N N 66 121.497 125.763 -4.266 1 1 741 . 19 1 1 A 67 67 PRO HA H 67 4.439 4.130 0.309 1 1 748 . 19 1 1 A 67 67 PRO C C 67 177.297 177.776 -0.479 1 1 749 . 19 1 1 A 67 67 PRO CA C 67 63.596 63.243 0.353 1 1 750 . 19 1 1 A 67 67 PRO CB C 67 32.242 31.570 0.672 1 1 752 . 19 1 1 A 68 68 GLY H H 68 8.316 8.239 0.077 1 1 753 . 19 1 1 A 68 68 GLY HA2 H 68 3.726 3.959 -0.233 1 1 754 . 19 1 1 A 68 68 GLY HA3 H 68 4.095 3.992 0.103 1 1 755 . 19 1 1 A 68 68 GLY C C 68 173.789 173.643 0.146 1 1 756 . 19 1 1 A 68 68 GLY CA C 68 45.227 45.345 -0.118 1 1 757 . 19 1 1 A 68 68 GLY N N 68 109.533 109.848 -0.315 1 1 758 . 19 1 1 A 69 69 VAL H H 69 8.114 7.895 0.219 1 1 759 . 19 1 1 A 69 69 VAL HA H 69 4.266 4.336 -0.070 1 1 764 . 19 1 1 A 69 69 VAL C C 69 176.299 175.020 1.279 1 1 765 . 19 1 1 A 69 69 VAL CA C 69 61.945 61.634 0.311 1 1 766 . 19 1 1 A 69 69 VAL CB C 69 33.082 33.870 -0.788 1 1 768 . 19 1 1 A 69 69 VAL N N 69 118.540 122.416 -3.876 1 1 769 . 19 1 1 A 70 70 THR H H 70 8.324 8.999 -0.675 1 1 770 . 19 1 1 A 70 70 THR HA H 70 4.373 4.433 -0.060 1 1 775 . 19 1 1 A 70 70 THR C C 70 175.204 175.711 -0.507 1 1 776 . 19 1 1 A 70 70 THR CA C 70 62.309 64.307 -1.998 1 1 777 . 19 1 1 A 70 70 THR CB C 70 69.787 69.927 -0.140 1 1 779 . 19 1 1 A 70 70 THR N N 70 117.636 120.284 -2.648 1 1 780 . 19 1 1 A 71 71 GLY H H 71 8.574 7.986 0.588 1 1 781 . 19 1 1 A 71 71 GLY HA2 H 71 4.096 4.139 -0.043 1 1 782 . 19 1 1 A 71 71 GLY HA3 H 71 3.975 4.145 -0.170 1 1 783 . 19 1 1 A 71 71 GLY C C 71 174.313 174.138 0.175 1 1 784 . 19 1 1 A 71 71 GLY CA C 71 45.545 46.530 -0.985 1 1 785 . 19 1 1 A 71 71 GLY N N 71 111.677 108.656 3.021 1 1 786 . 19 1 1 A 72 72 VAL H H 72 7.945 8.261 -0.316 1 1 787 . 19 1 1 A 72 72 VAL HA H 72 4.258 4.332 -0.074 1 1 795 . 19 1 1 A 72 72 VAL C C 72 176.162 176.190 -0.028 1 1 796 . 19 1 1 A 72 72 VAL CA C 72 62.227 63.697 -1.470 1 1 797 . 19 1 1 A 72 72 VAL CB C 72 32.997 32.373 0.624 1 1 799 . 19 1 1 A 72 72 VAL N N 72 118.647 119.946 -1.299 1 1 800 . 19 1 1 A 73 73 SER H H 73 8.498 7.913 0.585 1 1 801 . 19 1 1 A 73 73 SER HA H 73 4.617 4.648 -0.031 1 1 803 . 19 1 1 A 73 73 SER C C 73 174.461 174.532 -0.071 1 1 804 . 19 1 1 A 73 73 SER CA C 73 58.218 58.727 -0.509 1 1 805 . 19 1 1 A 73 73 SER CB C 73 64.061 64.108 -0.047 1 1 806 . 19 1 1 A 73 73 SER N N 73 118.828 111.572 7.256 1 1 807 . 19 1 1 A 74 74 GLY H H 74 8.247 8.276 -0.029 1 1 808 . 19 1 1 A 74 74 GLY HA2 H 74 4.101 4.173 -0.072 1 1 809 . 19 1 1 A 74 74 GLY HA3 H 74 4.304 4.186 0.118 1 1 810 . 19 1 1 A 74 74 GLY CA C 74 44.896 44.668 0.228 1 1 811 . 19 1 1 A 74 74 GLY N N 74 111.138 108.038 3.100 1 1 812 . 19 1 1 A 75 75 PRO HA H 75 4.461 4.492 -0.031 1 1 819 . 19 1 1 A 75 75 PRO C C 75 176.798 175.675 1.123 1 1 820 . 19 1 1 A 75 75 PRO CA C 75 63.466 63.157 0.309 1 1 821 . 19 1 1 A 75 75 PRO CB C 75 31.980 31.677 0.303 1 1 824 . 19 1 1 A 76 76 HIS H H 76 8.397 8.732 -0.335 1 1 825 . 19 1 1 A 76 76 HIS HA H 76 4.742 4.986 -0.244 1 1 829 . 19 1 1 A 76 76 HIS C C 76 174.282 174.951 -0.669 1 1 830 . 19 1 1 A 76 76 HIS CA C 76 55.579 54.462 1.117 1 1 831 . 19 1 1 A 76 76 HIS CB C 76 30.501 34.192 -3.691 1 1 832 . 19 1 1 A 76 76 HIS N N 76 118.431 122.660 -4.229 1 1 833 . 19 1 1 A 77 77 ASN H H 77 8.364 9.351 -0.987 1 1 834 . 19 1 1 A 77 77 ASN HA H 77 4.767 4.564 0.203 1 1 839 . 19 1 1 A 77 77 ASN C C 77 174.576 174.410 0.166 1 1 840 . 19 1 1 A 77 77 ASN CA C 77 53.139 54.478 -1.339 1 1 841 . 19 1 1 A 77 77 ASN CB C 77 39.320 38.019 1.301 1 1 842 . 19 1 1 A 77 77 ASN N N 77 119.421 121.112 -1.691 1 1 844 . 19 1 1 A 78 78 GLU H H 78 8.683 8.425 0.258 1 1 845 . 19 1 1 A 78 78 GLU HA H 78 4.409 4.278 0.131 1 1 850 . 19 1 1 A 78 78 GLU C C 78 175.791 175.093 0.698 1 1 851 . 19 1 1 A 78 78 GLU CA C 78 56.359 58.550 -2.191 1 1 852 . 19 1 1 A 78 78 GLU CB C 78 30.818 28.489 2.329 1 1 854 . 19 1 1 A 78 78 GLU N N 78 122.085 116.691 5.394 1 1 855 . 19 1 1 A 79 79 TYR H H 79 8.341 8.489 -0.148 1 1 856 . 19 1 1 A 79 79 TYR HA H 79 4.988 5.205 -0.217 1 1 861 . 19 1 1 A 79 79 TYR C C 79 175.837 176.106 -0.269 1 1 862 . 19 1 1 A 79 79 TYR CA C 79 58.028 59.486 -1.458 1 1 863 . 19 1 1 A 79 79 TYR CB C 79 41.672 39.562 2.110 1 1 866 . 19 1 1 A 79 79 TYR N N 79 119.452 122.258 -2.806 1 1 867 . 19 1 1 A 80 80 VAL H H 80 9.366 9.341 0.025 1 1 868 . 19 1 1 A 80 80 VAL HA H 80 4.370 4.858 -0.488 1 1 873 . 19 1 1 A 80 80 VAL C C 80 174.948 174.647 0.301 1 1 874 . 19 1 1 A 80 80 VAL CA C 80 61.190 60.821 0.369 1 1 875 . 19 1 1 A 80 80 VAL CB C 80 34.204 35.295 -1.091 1 1 877 . 19 1 1 A 80 80 VAL N N 80 120.567 122.247 -1.680 1 1 878 . 19 1 1 A 81 81 GLU H H 81 8.570 8.919 -0.349 1 1 879 . 19 1 1 A 81 81 GLU HA H 81 4.770 4.893 -0.123 1 1 883 . 19 1 1 A 81 81 GLU C C 81 175.491 176.453 -0.962 1 1 884 . 19 1 1 A 81 81 GLU CA C 81 55.655 55.803 -0.148 1 1 885 . 19 1 1 A 81 81 GLU CB C 81 30.415 30.554 -0.139 1 1 887 . 19 1 1 A 81 81 GLU N N 81 124.248 127.658 -3.410 1 1 888 . 19 1 1 A 82 82 VAL H H 82 9.189 8.920 0.269 1 1 889 . 19 1 1 A 82 82 VAL HA H 82 4.279 4.596 -0.317 1 1 894 . 19 1 1 A 82 82 VAL C C 82 176.087 176.013 0.074 1 1 895 . 19 1 1 A 82 82 VAL CA C 82 62.672 61.853 0.819 1 1 896 . 19 1 1 A 82 82 VAL CB C 82 33.121 33.185 -0.064 1 1 898 . 19 1 1 A 82 82 VAL N N 82 127.776 124.092 3.684 1 1 899 . 19 1 1 A 83 83 THR H H 83 8.590 8.729 -0.139 1 1 900 . 19 1 1 A 83 83 THR HA H 83 4.955 4.607 0.348 1 1 905 . 19 1 1 A 83 83 THR C C 83 174.688 174.936 -0.248 1 1 906 . 19 1 1 A 83 83 THR CA C 83 61.332 61.427 -0.095 1 1 907 . 19 1 1 A 83 83 THR CB C 83 70.213 70.461 -0.248 1 1 909 . 19 1 1 A 83 83 THR N N 83 114.744 115.739 -0.995 1 1 910 . 19 1 1 A 84 84 SER H H 84 7.650 7.504 0.146 1 1 911 . 19 1 1 A 84 84 SER HA H 84 4.819 4.279 0.540 1 1 914 . 19 1 1 A 84 84 SER CA C 84 56.280 60.125 -3.845 1 1 915 . 19 1 1 A 84 84 SER CB C 84 63.294 63.608 -0.314 1 1 916 . 19 1 1 A 84 84 SER N N 84 118.038 118.853 -0.815 1 1 917 . 19 1 1 A 85 85 GLU H H 85 8.391 8.723 -0.332 1 1 918 . 19 1 1 A 85 85 GLU HA H 85 3.661 3.929 -0.268 1 1 923 . 19 1 1 A 85 85 GLU C C 85 177.520 178.476 -0.956 1 1 924 . 19 1 1 A 85 85 GLU CA C 85 62.429 59.697 2.732 1 1 925 . 19 1 1 A 85 85 GLU CB C 85 29.655 29.481 0.174 1 1 927 . 19 1 1 A 86 86 ALA H H 86 8.443 8.099 0.344 1 1 928 . 19 1 1 A 86 86 ALA HA H 86 4.027 4.029 -0.002 1 1 932 . 19 1 1 A 86 86 ALA C C 86 180.423 180.067 0.356 1 1 933 . 19 1 1 A 86 86 ALA CA C 86 55.145 54.747 0.398 1 1 934 . 19 1 1 A 86 86 ALA CB C 86 18.165 18.279 -0.114 1 1 935 . 19 1 1 A 86 86 ALA N N 86 119.636 122.962 -3.326 1 1 936 . 19 1 1 A 87 87 ALA H H 87 7.214 7.438 -0.224 1 1 937 . 19 1 1 A 87 87 ALA HA H 87 4.244 4.016 0.228 1 1 941 . 19 1 1 A 87 87 ALA C C 87 180.354 179.514 0.840 1 1 942 . 19 1 1 A 87 87 ALA CA C 87 54.378 55.080 -0.702 1 1 943 . 19 1 1 A 87 87 ALA CB C 87 18.795 18.374 0.421 1 1 944 . 19 1 1 A 87 87 ALA N N 87 121.004 120.349 0.655 1 1 945 . 19 1 1 A 88 88 ILE H H 88 8.471 7.754 0.717 1 1 946 . 19 1 1 A 88 88 ILE HA H 88 3.360 3.608 -0.248 1 1 954 . 19 1 1 A 88 88 ILE CA C 88 66.323 65.047 1.276 1 1 955 . 19 1 1 A 88 88 ILE CB C 88 37.808 37.682 0.126 1 1 958 . 19 1 1 A 88 88 ILE N N 88 120.743 119.908 0.835 1 1 959 . 19 1 1 A 89 89 VAL H H 89 8.343 8.284 0.059 1 1 960 . 19 1 1 A 89 89 VAL HA H 89 3.061 3.422 -0.361 1 1 968 . 19 1 1 A 89 89 VAL C C 89 176.708 177.715 -1.007 1 1 969 . 19 1 1 A 89 89 VAL CA C 89 67.833 66.604 1.229 1 1 970 . 19 1 1 A 89 89 VAL CB C 89 31.509 31.397 0.112 1 1 973 . 19 1 1 A 89 89 VAL N N 89 118.049 119.742 -1.693 1 1 974 . 19 1 1 A 90 90 ALA H H 90 7.516 8.228 -0.712 1 1 975 . 19 1 1 A 90 90 ALA HA H 90 3.987 3.810 0.177 1 1 979 . 19 1 1 A 90 90 ALA C C 90 180.744 179.969 0.775 1 1 980 . 19 1 1 A 90 90 ALA CA C 90 55.481 55.736 -0.255 1 1 981 . 19 1 1 A 90 90 ALA CB C 90 17.953 18.469 -0.516 1 1 982 . 19 1 1 A 90 90 ALA N N 90 118.935 121.444 -2.509 1 1 983 . 19 1 1 A 91 91 GLN H H 91 7.886 8.017 -0.131 1 1 984 . 19 1 1 A 91 91 GLN HA H 91 4.190 3.948 0.242 1 1 991 . 19 1 1 A 91 91 GLN C C 91 178.832 178.645 0.187 1 1 992 . 19 1 1 A 91 91 GLN CA C 91 58.519 59.035 -0.516 1 1 993 . 19 1 1 A 91 91 GLN CB C 91 28.091 28.181 -0.090 1 1 995 . 19 1 1 A 91 91 GLN N N 91 117.846 118.328 -0.482 1 1 997 . 19 1 1 A 92 92 LEU H H 92 8.751 8.345 0.406 1 1 998 . 19 1 1 A 92 92 LEU HA H 92 3.903 3.984 -0.081 1 1 1007 . 19 1 1 A 92 92 LEU C C 92 178.997 179.375 -0.378 1 1 1008 . 19 1 1 A 92 92 LEU CA C 92 58.136 57.974 0.162 1 1 1009 . 19 1 1 A 92 92 LEU CB C 92 41.576 41.694 -0.118 1 1 1013 . 19 1 1 A 92 92 LEU N N 92 119.547 119.440 0.107 1 1 1014 . 19 1 1 A 93 93 PHE H H 93 8.648 7.937 0.711 1 1 1015 . 19 1 1 A 93 93 PHE HA H 93 4.270 4.153 0.117 1 1 1020 . 19 1 1 A 93 93 PHE C C 93 179.283 178.874 0.409 1 1 1021 . 19 1 1 A 93 93 PHE CA C 93 59.860 60.554 -0.694 1 1 1022 . 19 1 1 A 93 93 PHE CB C 93 37.765 38.178 -0.413 1 1 1025 . 19 1 1 A 93 93 PHE N N 93 118.041 118.613 -0.572 1 1 1026 . 19 1 1 A 94 94 GLU H H 94 7.739 8.454 -0.715 1 1 1027 . 19 1 1 A 94 94 GLU HA H 94 4.110 4.105 0.005 1 1 1031 . 19 1 1 A 94 94 GLU C C 94 178.629 178.679 -0.050 1 1 1032 . 19 1 1 A 94 94 GLU CA C 94 59.359 59.353 0.006 1 1 1033 . 19 1 1 A 94 94 GLU CB C 94 29.589 28.660 0.929 1 1 1035 . 19 1 1 A 94 94 GLU N N 94 119.980 117.227 2.753 1 1 1036 . 19 1 1 A 95 95 LEU H H 95 7.999 8.144 -0.145 1 1 1037 . 19 1 1 A 95 95 LEU HA H 95 4.139 4.033 0.106 1 1 1047 . 19 1 1 A 95 95 LEU C C 95 178.965 179.038 -0.073 1 1 1048 . 19 1 1 A 95 95 LEU CA C 95 57.557 57.372 0.185 1 1 1049 . 19 1 1 A 95 95 LEU CB C 95 43.443 41.985 1.458 1 1 1053 . 19 1 1 A 95 95 LEU N N 95 118.398 121.675 -3.277 1 1 1054 . 19 1 1 A 96 96 LEU H H 96 8.363 8.033 0.330 1 1 1055 . 19 1 1 A 96 96 LEU HA H 96 4.503 4.314 0.189 1 1 1061 . 19 1 1 A 96 96 LEU C C 96 177.932 176.788 1.144 1 1 1062 . 19 1 1 A 96 96 LEU CA C 96 54.700 55.787 -1.087 1 1 1063 . 19 1 1 A 96 96 LEU CB C 96 43.048 42.966 0.082 1 1 1065 . 19 1 1 A 96 96 LEU N N 96 114.720 118.265 -3.545 1 1 1066 . 19 1 1 A 97 97 GLY H H 97 7.810 7.733 0.077 1 1 1067 . 19 1 1 A 97 97 GLY HA2 H 97 3.963 3.997 -0.034 1 1 1068 . 19 1 1 A 97 97 GLY C C 97 173.535 174.035 -0.500 1 1 1069 . 19 1 1 A 97 97 GLY CA C 97 45.667 45.087 0.580 1 1 1070 . 19 1 1 A 97 97 GLY N N 97 109.511 107.746 1.765 1 1 1071 . 19 1 1 A 98 98 SER H H 98 8.131 8.153 -0.022 1 1 1072 . 19 1 1 A 98 98 SER HA H 98 4.225 4.498 -0.273 1 1 1075 . 19 1 1 A 98 98 SER C C 98 174.974 174.274 0.700 1 1 1076 . 19 1 1 A 98 98 SER CA C 98 57.960 58.358 -0.398 1 1 1077 . 19 1 1 A 98 98 SER CB C 98 63.997 63.512 0.485 1 1 1078 . 19 1 1 A 98 98 SER N N 98 113.405 116.367 -2.962 1 1 1079 . 19 1 1 A 99 99 GLY H H 99 8.052 8.645 -0.593 1 1 1080 . 19 1 1 A 99 99 GLY HA2 H 99 3.998 4.012 -0.014 1 1 1081 . 19 1 1 A 99 99 GLY HA3 H 99 3.778 4.043 -0.265 1 1 1082 . 19 1 1 A 99 99 GLY C C 99 174.033 174.099 -0.066 1 1 1083 . 19 1 1 A 99 99 GLY CA C 99 45.123 45.351 -0.228 1 1 1084 . 19 1 1 A 99 99 GLY N N 99 111.534 114.548 -3.014 1 1 1085 . 19 1 1 A 100 100 GLU H H 100 8.177 7.647 0.530 1 1 1086 . 19 1 1 A 100 100 GLU HA H 100 4.201 4.536 -0.335 1 1 1091 . 19 1 1 A 100 100 GLU C C 100 175.830 176.293 -0.463 1 1 1092 . 19 1 1 A 100 100 GLU CA C 100 56.442 56.042 0.400 1 1 1093 . 19 1 1 A 100 100 GLU CB C 100 30.428 31.109 -0.681 1 1 1095 . 19 1 1 A 100 100 GLU N N 100 120.463 120.400 0.063 1 1 1096 . 19 1 1 A 101 101 GLN H H 101 8.161 8.409 -0.248 1 1 1097 . 19 1 1 A 101 101 GLN HA H 101 4.098 4.311 -0.213 1 1 1103 . 19 1 1 A 101 101 GLN C C 101 175.412 175.438 -0.026 1 1 1104 . 19 1 1 A 101 101 GLN CA C 101 55.632 55.789 -0.157 1 1 1105 . 19 1 1 A 101 101 GLN CB C 101 29.569 29.332 0.237 1 1 1107 . 19 1 1 A 101 101 GLN N N 101 120.014 121.138 -1.124 1 1 1109 . 19 1 1 A 102 102 LYS H H 102 8.235 8.493 -0.258 1 1 1110 . 19 1 1 A 102 102 LYS HA H 102 4.387 3.815 0.572 1 1 1117 . 19 1 1 A 102 102 LYS CA C 102 54.116 54.578 -0.462 1 1 1118 . 19 1 1 A 102 102 LYS CB C 102 32.478 32.389 0.089 1 1 1122 . 19 1 1 A 102 102 LYS N N 102 123.399 121.764 1.635 1 1 1123 . 19 1 1 A 103 103 PRO HA H 103 4.498 4.390 0.108 1 1 1129 . 19 1 1 A 103 103 PRO C C 103 175.473 177.081 -1.608 1 1 1130 . 19 1 1 A 103 103 PRO CA C 103 62.802 65.389 -2.587 1 1 1131 . 19 1 1 A 103 103 PRO CB C 103 32.124 31.677 0.447 1 1 1134 . 19 1 1 A 104 104 ALA H H 104 8.017 7.229 0.788 1 1 1135 . 19 1 1 A 104 104 ALA HA H 104 4.318 4.359 -0.041 1 1 1139 . 19 1 1 A 104 104 ALA C C 104 176.717 176.811 -0.094 1 1 1140 . 19 1 1 A 104 104 ALA CA C 104 52.194 53.245 -1.051 1 1 1141 . 19 1 1 A 104 104 ALA CB C 104 20.113 20.360 -0.247 1 1 1142 . 19 1 1 A 104 104 ALA N N 104 122.093 117.378 4.715 1 1 1143 . 19 1 1 A 105 105 GLY H H 105 7.678 8.077 -0.399 1 1 1144 . 19 1 1 A 105 105 GLY HA2 H 105 3.851 4.124 -0.273 1 1 1145 . 19 1 1 A 105 105 GLY HA3 H 105 4.053 4.149 -0.096 1 1 1146 . 19 1 1 A 105 105 GLY C C 105 172.990 174.754 -1.764 1 1 1147 . 19 1 1 A 105 105 GLY CA C 105 44.241 43.852 0.389 1 1 1148 . 19 1 1 A 105 105 GLY N N 105 105.234 103.728 1.506 1 1 1149 . 19 1 1 A 106 106 VAL H H 106 8.409 8.876 -0.467 1 1 1150 . 19 1 1 A 106 106 VAL HA H 106 2.829 3.343 -0.514 1 1 1158 . 19 1 1 A 106 106 VAL C C 106 177.822 177.364 0.458 1 1 1159 . 19 1 1 A 106 106 VAL CA C 106 65.522 65.577 -0.055 1 1 1160 . 19 1 1 A 106 106 VAL CB C 106 30.701 30.592 0.109 1 1 1163 . 19 1 1 A 106 106 VAL N N 106 119.215 118.409 0.806 1 1 1164 . 19 1 1 A 107 107 ALA H H 107 8.707 8.471 0.236 1 1 1165 . 19 1 1 A 107 107 ALA HA H 107 3.730 3.879 -0.149 1 1 1169 . 19 1 1 A 107 107 ALA C C 107 179.661 180.201 -0.540 1 1 1170 . 19 1 1 A 107 107 ALA CA C 107 54.995 55.548 -0.553 1 1 1171 . 19 1 1 A 107 107 ALA CB C 107 17.705 17.919 -0.214 1 1 1172 . 19 1 1 A 107 107 ALA N N 107 118.672 122.252 -3.580 1 1 1173 . 19 1 1 A 108 108 ALA H H 108 7.388 7.842 -0.454 1 1 1174 . 19 1 1 A 108 108 ALA HA H 108 4.259 4.011 0.248 1 1 1178 . 19 1 1 A 108 108 ALA C C 108 179.318 179.436 -0.118 1 1 1179 . 19 1 1 A 108 108 ALA CA C 108 53.481 55.101 -1.620 1 1 1180 . 19 1 1 A 108 108 ALA CB C 108 19.367 18.617 0.750 1 1 1181 . 19 1 1 A 108 108 ALA N N 108 116.635 121.001 -4.366 1 1 1182 . 19 1 1 A 109 109 VAL H H 109 7.689 7.510 0.179 1 1 1183 . 19 1 1 A 109 109 VAL HA H 109 4.532 3.843 0.689 1 1 1191 . 19 1 1 A 109 109 VAL C C 109 176.055 177.987 -1.932 1 1 1192 . 19 1 1 A 109 109 VAL CA C 109 61.452 65.825 -4.373 1 1 1193 . 19 1 1 A 109 109 VAL CB C 109 32.728 31.557 1.171 1 1 1196 . 19 1 1 A 109 109 VAL N N 109 112.851 117.198 -4.347 1 1 1197 . 19 1 1 A 110 110 LEU H H 110 7.099 8.261 -1.162 1 1 1198 . 19 1 1 A 110 110 LEU HA H 110 3.723 3.762 -0.039 1 1 1208 . 19 1 1 A 110 110 LEU C C 110 179.040 178.817 0.223 1 1 1209 . 19 1 1 A 110 110 LEU CA C 110 58.825 57.881 0.944 1 1 1210 . 19 1 1 A 110 110 LEU CB C 110 41.242 41.779 -0.537 1 1 1214 . 19 1 1 A 110 110 LEU N N 110 119.829 124.955 -5.126 1 1 1215 . 19 1 1 A 111 111 GLY H H 111 8.435 7.926 0.509 1 1 1216 . 19 1 1 A 111 111 GLY HA2 H 111 3.970 3.830 0.140 1 1 1217 . 19 1 1 A 111 111 GLY HA3 H 111 3.885 3.838 0.047 1 1 1218 . 19 1 1 A 111 111 GLY C C 111 178.031 176.850 1.181 1 1 1219 . 19 1 1 A 111 111 GLY CA C 111 46.961 47.554 -0.593 1 1 1220 . 19 1 1 A 111 111 GLY N N 111 104.089 106.578 -2.489 1 1 1221 . 19 1 1 A 112 112 SER H H 112 8.343 7.966 0.377 1 1 1222 . 19 1 1 A 112 112 SER HA H 112 4.266 4.116 0.150 1 1 1224 . 19 1 1 A 112 112 SER C C 112 175.885 175.310 0.575 1 1 1225 . 19 1 1 A 112 112 SER CA C 112 61.304 62.623 -1.319 1 1 1226 . 19 1 1 A 112 112 SER CB C 112 62.901 62.986 -0.085 1 1 1227 . 19 1 1 A 112 112 SER N N 112 119.497 119.363 0.134 1 1 1228 . 19 1 1 A 113 113 LEU H H 113 7.667 8.016 -0.349 1 1 1229 . 19 1 1 A 113 113 LEU HA H 113 4.343 4.213 0.130 1 1 1238 . 19 1 1 A 113 113 LEU C C 113 174.760 176.019 -1.259 1 1 1239 . 19 1 1 A 113 113 LEU CA C 113 54.228 54.649 -0.421 1 1 1240 . 19 1 1 A 113 113 LEU CB C 113 41.467 41.757 -0.290 1 1 1244 . 19 1 1 A 113 113 LEU N N 113 118.843 117.825 1.018 1 1 1245 . 19 1 1 A 114 114 LYS H H 114 7.685 7.899 -0.214 1 1 1246 . 19 1 1 A 114 114 LYS HA H 114 3.958 3.902 0.056 1 1 1250 . 19 1 1 A 114 114 LYS C C 114 177.557 175.954 1.603 1 1 1251 . 19 1 1 A 114 114 LYS CA C 114 56.935 57.438 -0.503 1 1 1252 . 19 1 1 A 114 114 LYS CB C 114 28.898 29.416 -0.518 1 1 1254 . 19 1 1 A 114 114 LYS N N 114 114.072 116.558 -2.486 1 1 1255 . 19 1 1 A 115 115 LEU H H 115 8.329 7.801 0.528 1 1 1256 . 19 1 1 A 115 115 LEU HA H 115 4.315 4.300 0.015 1 1 1265 . 19 1 1 A 115 115 LEU C C 115 175.988 177.021 -1.033 1 1 1266 . 19 1 1 A 115 115 LEU CA C 115 54.310 55.801 -1.491 1 1 1267 . 19 1 1 A 115 115 LEU CB C 115 44.163 42.483 1.680 1 1 1270 . 19 1 1 A 115 115 LEU N N 115 117.951 120.056 -2.105 1 1 1271 . 19 1 1 A 116 116 GLN H H 116 9.100 8.544 0.556 1 1 1272 . 19 1 1 A 116 116 GLN HA H 116 4.898 5.093 -0.195 1 1 1279 . 19 1 1 A 116 116 GLN CA C 116 53.467 54.875 -1.408 1 1 1280 . 19 1 1 A 116 116 GLN CB C 116 32.730 30.863 1.867 1 1 1282 . 19 1 1 A 116 116 GLN N N 116 119.994 121.088 -1.094 1 1 1284 . 19 1 1 A 117 117 GLU H H 117 8.849 8.524 0.325 1 1 1285 . 19 1 1 A 117 117 GLU HA H 117 3.707 4.048 -0.341 1 1 1290 . 19 1 1 A 117 117 GLU C C 117 177.303 176.568 0.735 1 1 1291 . 19 1 1 A 117 117 GLU CA C 117 57.233 55.476 1.757 1 1 1292 . 19 1 1 A 117 117 GLU CB C 117 29.634 28.192 1.442 1 1 1294 . 19 1 1 A 117 117 GLU N N 117 121.487 121.579 -0.092 1 1 1295 . 19 1 1 A 118 118 VAL H H 118 8.983 8.206 0.777 1 1 1296 . 19 1 1 A 118 118 VAL HA H 118 4.360 3.866 0.494 1 1 1304 . 19 1 1 A 118 118 VAL C C 118 174.171 175.532 -1.361 1 1 1305 . 19 1 1 A 118 118 VAL CA C 118 61.772 64.352 -2.580 1 1 1306 . 19 1 1 A 118 118 VAL CB C 118 34.095 32.414 1.681 1 1 1309 . 19 1 1 A 118 118 VAL N N 118 122.933 123.778 -0.845 1 1 1310 . 19 1 1 A 119 119 ALA H H 119 7.023 7.189 -0.166 1 1 1311 . 19 1 1 A 119 119 ALA HA H 119 4.378 4.647 -0.269 1 1 1315 . 19 1 1 A 119 119 ALA C C 119 175.493 174.916 0.577 1 1 1316 . 19 1 1 A 119 119 ALA CA C 119 51.956 51.867 0.089 1 1 1317 . 19 1 1 A 119 119 ALA CB C 119 23.957 21.745 2.212 1 1 1318 . 19 1 1 A 119 119 ALA N N 119 117.379 121.127 -3.748 1 1 1319 . 19 1 1 A 120 120 SER H H 120 6.999 8.634 -1.635 1 1 1320 . 19 1 1 A 120 120 SER HA H 120 5.208 5.484 -0.276 1 1 1323 . 19 1 1 A 120 120 SER C C 120 173.082 173.408 -0.326 1 1 1324 . 19 1 1 A 120 120 SER CA C 120 56.754 57.063 -0.309 1 1 1325 . 19 1 1 A 120 120 SER CB C 120 64.605 65.052 -0.447 1 1 1326 . 19 1 1 A 120 120 SER N N 120 113.743 119.237 -5.494 1 1 1327 . 19 1 1 A 121 121 PHE H H 121 8.244 8.590 -0.346 1 1 1328 . 19 1 1 A 121 121 PHE HA H 121 5.177 4.829 0.348 1 1 1333 . 19 1 1 A 121 121 PHE C C 121 173.569 172.420 1.149 1 1 1334 . 19 1 1 A 121 121 PHE CA C 121 55.555 54.922 0.633 1 1 1335 . 19 1 1 A 121 121 PHE CB C 121 40.959 41.491 -0.532 1 1 1338 . 19 1 1 A 121 121 PHE N N 121 120.358 119.899 0.459 1 1 1339 . 19 1 1 A 122 122 ILE H H 122 8.907 8.761 0.146 1 1 1340 . 19 1 1 A 122 122 ILE HA H 122 4.682 4.550 0.132 1 1 1348 . 19 1 1 A 122 122 ILE C C 122 176.925 175.246 1.679 1 1 1349 . 19 1 1 A 122 122 ILE CA C 122 60.740 60.874 -0.134 1 1 1350 . 19 1 1 A 122 122 ILE CB C 122 39.497 38.263 1.234 1 1 1353 . 19 1 1 A 122 122 ILE N N 122 121.282 120.871 0.411 1 1 1354 . 19 1 1 A 123 123 THR H H 123 9.022 9.283 -0.261 1 1 1355 . 19 1 1 A 123 123 THR HA H 123 5.039 4.482 0.557 1 1 1360 . 19 1 1 A 123 123 THR C C 123 173.531 173.741 -0.210 1 1 1361 . 19 1 1 A 123 123 THR CA C 123 62.266 61.832 0.434 1 1 1362 . 19 1 1 A 123 123 THR CB C 123 70.677 68.698 1.979 1 1 1364 . 19 1 1 A 123 123 THR N N 123 128.965 123.246 5.719 1 1 1365 . 19 1 1 A 124 124 THR H H 124 8.961 9.018 -0.057 1 1 1366 . 19 1 1 A 124 124 THR HA H 124 5.001 5.127 -0.126 1 1 1371 . 19 1 1 A 124 124 THR C C 124 173.468 172.490 0.978 1 1 1372 . 19 1 1 A 124 124 THR CA C 124 62.109 61.102 1.007 1 1 1373 . 19 1 1 A 124 124 THR CB C 124 70.450 70.537 -0.087 1 1 1375 . 19 1 1 A 124 124 THR N N 124 122.176 123.264 -1.088 1 1 1376 . 19 1 1 A 125 125 ARG H H 125 9.386 9.577 -0.191 1 1 1377 . 19 1 1 A 125 125 ARG HA H 125 5.764 5.149 0.615 1 1 1384 . 19 1 1 A 125 125 ARG C C 125 175.713 174.173 1.540 1 1 1385 . 19 1 1 A 125 125 ARG CA C 125 53.991 54.089 -0.098 1 1 1386 . 19 1 1 A 125 125 ARG CB C 125 33.557 33.606 -0.049 1 1 1389 . 19 1 1 A 125 125 ARG N N 125 130.004 128.776 1.228 1 1 1390 . 19 1 1 A 126 126 SER H H 126 9.172 9.271 -0.099 1 1 1391 . 19 1 1 A 126 126 SER HA H 126 5.390 4.820 0.570 1 1 1394 . 19 1 1 A 126 126 SER C C 126 172.359 172.994 -0.635 1 1 1395 . 19 1 1 A 126 126 SER CA C 126 56.934 56.806 0.128 1 1 1396 . 19 1 1 A 126 126 SER CB C 126 65.827 64.374 1.453 1 1 1397 . 19 1 1 A 126 126 SER N N 126 119.906 121.480 -1.574 1 1 1398 . 19 1 1 A 127 127 SER H H 127 8.591 9.261 -0.670 1 1 1399 . 19 1 1 A 127 127 SER HA H 127 5.739 5.325 0.414 1 1 1401 . 19 1 1 A 127 127 SER C C 127 173.283 173.175 0.108 1 1 1402 . 19 1 1 A 127 127 SER CA C 127 57.354 57.686 -0.332 1 1 1403 . 19 1 1 A 127 127 SER CB C 127 65.412 64.492 0.920 1 1 1404 . 19 1 1 A 127 127 SER N N 127 117.914 124.401 -6.487 1 1 1405 . 19 1 1 A 128 128 TRP H H 128 9.866 9.704 0.162 1 1 1406 . 19 1 1 A 128 128 TRP HA H 128 5.560 5.760 -0.200 1 1 1415 . 19 1 1 A 128 128 TRP C C 128 175.828 175.139 0.689 1 1 1416 . 19 1 1 A 128 128 TRP CA C 128 55.852 55.692 0.160 1 1 1417 . 19 1 1 A 128 128 TRP CB C 128 32.524 33.234 -0.710 1 1 1423 . 19 1 1 A 128 128 TRP N N 128 127.978 126.162 1.816 1 1 1425 . 19 1 1 A 129 129 LYS H H 129 9.424 9.408 0.016 1 1 1426 . 19 1 1 A 129 129 LYS HA H 129 5.388 5.445 -0.057 1 1 1433 . 19 1 1 A 129 129 LYS C C 129 175.254 174.175 1.079 1 1 1434 . 19 1 1 A 129 129 LYS CA C 129 54.410 54.659 -0.249 1 1 1435 . 19 1 1 A 129 129 LYS CB C 129 35.734 36.324 -0.590 1 1 1439 . 19 1 1 A 129 129 LYS N N 129 121.784 118.925 2.859 1 1 1440 . 19 1 1 A 130 130 LEU H H 130 8.933 9.319 -0.386 1 1 1441 . 19 1 1 A 130 130 LEU HA H 130 4.859 5.189 -0.330 1 1 1447 . 19 1 1 A 130 130 LEU C C 130 173.893 174.321 -0.428 1 1 1448 . 19 1 1 A 130 130 LEU CA C 130 53.848 53.730 0.118 1 1 1449 . 19 1 1 A 130 130 LEU CB C 130 46.125 46.449 -0.324 1 1 1451 . 19 1 1 A 130 130 LEU N N 130 124.543 123.240 1.303 1 1 1452 . 19 1 1 A 131 131 ALA H H 131 8.816 8.896 -0.080 1 1 1453 . 19 1 1 A 131 131 ALA HA H 131 4.776 4.869 -0.093 1 1 1457 . 19 1 1 A 131 131 ALA C C 131 176.662 177.044 -0.382 1 1 1458 . 19 1 1 A 131 131 ALA CA C 131 51.407 50.893 0.514 1 1 1459 . 19 1 1 A 131 131 ALA CB C 131 19.354 20.120 -0.766 1 1 1460 . 19 1 1 A 131 131 ALA N N 131 131.102 129.022 2.080 1 1 1461 . 19 1 1 A 132 132 LEU H H 132 8.487 8.867 -0.380 1 1 1462 . 19 1 1 A 132 132 LEU HA H 132 4.470 5.023 -0.553 1 1 1470 . 19 1 1 A 132 132 LEU C C 132 176.873 176.259 0.614 1 1 1471 . 19 1 1 A 132 132 LEU CA C 132 54.590 53.475 1.115 1 1 1472 . 19 1 1 A 132 132 LEU CB C 132 42.974 44.390 -1.416 1 1 1475 . 19 1 1 A 132 132 LEU N N 132 123.724 124.043 -0.319 1 1 1476 . 19 1 1 A 133 133 SER H H 133 8.448 8.671 -0.223 1 1 1477 . 19 1 1 A 133 133 SER HA H 133 4.560 4.883 -0.323 1 1 1479 . 19 1 1 A 133 133 SER C C 133 176.043 173.531 2.512 1 1 1480 . 19 1 1 A 133 133 SER CA C 133 58.460 56.927 1.533 1 1 1481 . 19 1 1 A 133 133 SER CB C 133 63.985 64.733 -0.748 1 1 1482 . 19 1 1 A 133 133 SER N N 133 115.880 117.392 -1.512 1 1 1483 . 19 1 1 A 134 134 GLY H H 134 8.232 9.289 -1.057 1 1 1484 . 19 1 1 A 134 134 GLY HA2 H 134 4.147 4.067 0.080 1 1 1485 . 19 1 1 A 134 134 GLY HA3 H 134 4.045 4.081 -0.036 1 1 1486 . 19 1 1 A 134 134 GLY C C 134 174.013 172.907 1.106 1 1 1487 . 19 1 1 A 134 134 GLY CA C 134 45.337 45.382 -0.045 1 1 1488 . 19 1 1 A 134 134 GLY N N 134 109.970 115.358 -5.388 1 1 1489 . 19 1 1 A 135 135 ALA H H 135 8.424 8.512 -0.088 1 1 1490 . 19 1 1 A 135 135 ALA HA H 135 4.436 4.417 0.019 1 1 1494 . 19 1 1 A 135 135 ALA C C 135 177.537 177.408 0.129 1 1 1495 . 19 1 1 A 135 135 ALA CA C 135 52.721 51.983 0.738 1 1 1496 . 19 1 1 A 135 135 ALA CB C 135 19.265 18.171 1.094 1 1 1497 . 19 1 1 A 135 135 ALA N N 135 124.118 126.377 -2.259 1 1 1498 . 19 1 1 A 136 136 HIS H H 136 8.466 8.454 0.012 1 1 1499 . 19 1 1 A 136 136 HIS HA H 136 4.379 4.790 -0.411 1 1 1500 . 19 1 1 A 136 136 HIS C C 136 176.259 175.777 0.482 1 1 1501 . 19 1 1 A 136 136 HIS CA C 136 56.082 56.341 -0.259 1 1 1502 . 19 1 1 A 136 136 HIS CB C 136 29.619 32.845 -3.226 1 1 1503 . 19 1 1 A 136 136 HIS N N 136 119.493 123.763 -4.270 1 1 1504 . 19 1 1 A 137 137 GLY H H 137 8.431 8.097 0.334 1 1 1505 . 19 1 1 A 137 137 GLY HA2 H 137 4.151 3.894 0.257 1 1 1506 . 19 1 1 A 137 137 GLY HA3 H 137 3.893 3.955 -0.062 1 1 1507 . 19 1 1 A 137 137 GLY C C 137 174.039 173.555 0.484 1 1 1508 . 19 1 1 A 137 137 GLY CA C 137 45.372 45.279 0.093 1 1 1509 . 19 1 1 A 137 137 GLY N N 137 110.442 107.046 3.396 1 1 1510 . 19 1 1 A 138 138 GLN H H 138 8.416 7.287 1.129 1 1 1511 . 19 1 1 A 138 138 GLN HA H 138 4.455 4.959 -0.504 1 1 1515 . 19 1 1 A 138 138 GLN C C 138 175.889 173.703 2.186 1 1 1516 . 19 1 1 A 138 138 GLN CA C 138 55.866 54.828 1.038 1 1 1517 . 19 1 1 A 138 138 GLN CB C 138 29.639 32.549 -2.910 1 1 1518 . 19 1 1 A 138 138 GLN N N 138 119.401 118.811 0.590 1 1 1519 . 19 1 1 A 139 139 GLU H H 139 8.446 8.935 -0.489 1 1 1520 . 19 1 1 A 139 139 GLU HA H 139 4.658 4.977 -0.319 1 1 1524 . 19 1 1 A 139 139 GLU CA C 139 54.589 53.341 1.248 1 1 1525 . 19 1 1 A 139 139 GLU CB C 139 29.733 30.590 -0.857 1 1 1527 . 19 1 1 A 139 139 GLU N N 139 123.136 124.959 -1.823 1 1 1528 . 19 1 1 A 140 140 PRO HA H 140 4.537 4.964 -0.427 1 1 1533 . 19 1 1 A 140 140 PRO C C 140 176.119 176.040 0.079 1 1 1534 . 19 1 1 A 140 140 PRO CA C 140 63.220 62.256 0.964 1 1 1535 . 19 1 1 A 140 140 PRO CB C 140 31.936 31.894 0.042 1 1 1538 . 19 1 1 A 141 141 GLN H H 141 8.506 9.143 -0.637 1 1 1539 . 19 1 1 A 141 141 GLN HA H 141 4.650 4.796 -0.146 1 1 1546 . 19 1 1 A 141 141 GLN C C 141 175.811 175.730 0.081 1 1 1547 . 19 1 1 A 141 141 GLN CA C 141 55.912 55.352 0.560 1 1 1548 . 19 1 1 A 141 141 GLN CB C 141 30.241 29.221 1.020 1 1 1550 . 19 1 1 A 141 141 GLN N N 141 120.422 123.436 -3.014 1 1 1551 . 19 1 1 A 142 142 LEU H H 142 8.842 8.680 0.162 1 1 1552 . 19 1 1 A 142 142 LEU HA H 142 5.277 5.105 0.172 1 1 1562 . 19 1 1 A 142 142 LEU C C 142 176.839 175.554 1.285 1 1 1563 . 19 1 1 A 142 142 LEU CA C 142 53.927 53.012 0.915 1 1 1564 . 19 1 1 A 142 142 LEU CB C 142 44.527 44.148 0.379 1 1 1568 . 19 1 1 A 142 142 LEU N N 142 123.692 120.936 2.756 1 1 1569 . 19 1 1 A 143 143 THR H H 143 9.025 8.652 0.373 1 1 1570 . 19 1 1 A 143 143 THR HA H 143 5.262 4.954 0.308 1 1 1575 . 19 1 1 A 143 143 THR C C 143 173.753 173.845 -0.092 1 1 1576 . 19 1 1 A 143 143 THR CA C 143 61.795 61.821 -0.026 1 1 1577 . 19 1 1 A 143 143 THR CB C 143 70.660 70.533 0.127 1 1 1579 . 19 1 1 A 143 143 THR N N 143 117.222 117.166 0.056 1 1 1580 . 19 1 1 A 144 144 ILE H H 144 9.353 10.329 -0.976 1 1 1581 . 19 1 1 A 144 144 ILE HA H 144 5.399 5.124 0.275 1 1 1591 . 19 1 1 A 144 144 ILE C C 144 173.931 173.668 0.263 1 1 1592 . 19 1 1 A 144 144 ILE CA C 144 60.774 60.545 0.229 1 1 1593 . 19 1 1 A 144 144 ILE CB C 144 41.111 39.896 1.215 1 1 1597 . 19 1 1 A 144 144 ILE N N 144 126.383 127.747 -1.364 1 1 1598 . 19 1 1 A 145 145 ASP H H 145 9.214 9.636 -0.422 1 1 1599 . 19 1 1 A 145 145 ASP HA H 145 5.978 5.435 0.543 1 1 1601 . 19 1 1 A 145 145 ASP C C 145 175.441 174.805 0.636 1 1 1602 . 19 1 1 A 145 145 ASP CA C 145 53.035 52.706 0.329 1 1 1603 . 19 1 1 A 145 145 ASP CB C 145 44.153 44.201 -0.048 1 1 1604 . 19 1 1 A 145 145 ASP N N 145 127.981 128.791 -0.810 1 1 1605 . 19 1 1 A 146 146 LEU H H 146 9.387 10.011 -0.624 1 1 1606 . 19 1 1 A 146 146 LEU HA H 146 4.918 5.500 -0.582 1 1 1616 . 19 1 1 A 146 146 LEU C C 146 175.003 174.722 0.281 1 1 1617 . 19 1 1 A 146 146 LEU CA C 146 53.940 53.681 0.259 1 1 1618 . 19 1 1 A 146 146 LEU CB C 146 43.902 42.669 1.233 1 1 1622 . 19 1 1 A 146 146 LEU N N 146 123.532 127.201 -3.669 1 1 1623 . 19 1 1 A 147 147 ASP H H 147 8.676 8.659 0.017 1 1 1624 . 19 1 1 A 147 147 ASP HA H 147 5.205 5.169 0.036 1 1 1627 . 19 1 1 A 147 147 ASP C C 147 174.956 174.444 0.512 1 1 1628 . 19 1 1 A 147 147 ASP CA C 147 53.441 52.260 1.181 1 1 1629 . 19 1 1 A 147 147 ASP CB C 147 43.370 43.016 0.354 1 1 1630 . 19 1 1 A 147 147 ASP N N 147 125.499 125.691 -0.192 1 1 1631 . 19 1 1 A 148 148 SER H H 148 8.732 8.979 -0.247 1 1 1632 . 19 1 1 A 148 148 SER HA H 148 5.365 5.151 0.214 1 1 1634 . 19 1 1 A 148 148 SER C C 148 173.217 173.099 0.118 1 1 1635 . 19 1 1 A 148 148 SER CA C 148 56.334 55.887 0.447 1 1 1636 . 19 1 1 A 148 148 SER CB C 148 65.812 66.549 -0.737 1 1 1637 . 19 1 1 A 148 148 SER N N 148 118.623 118.972 -0.349 1 1 1638 . 19 1 1 A 149 149 ALA H H 149 8.937 8.663 0.274 1 1 1639 . 19 1 1 A 149 149 ALA HA H 149 5.681 4.633 1.048 1 1 1643 . 19 1 1 A 149 149 ALA C C 149 178.894 177.131 1.763 1 1 1644 . 19 1 1 A 149 149 ALA CA C 149 49.996 50.248 -0.252 1 1 1645 . 19 1 1 A 149 149 ALA CB C 149 23.231 22.750 0.481 1 1 1646 . 19 1 1 A 149 149 ALA N N 149 123.952 121.512 2.440 1 1 1647 . 19 1 1 A 150 150 ASP H H 150 9.010 8.654 0.356 1 1 1648 . 19 1 1 A 150 150 ASP HA H 150 4.336 4.335 0.001 1 1 1651 . 19 1 1 A 150 150 ASP C C 150 176.697 176.552 0.145 1 1 1652 . 19 1 1 A 150 150 ASP CA C 150 56.543 57.120 -0.577 1 1 1653 . 19 1 1 A 150 150 ASP CB C 150 39.850 40.420 -0.570 1 1 1654 . 19 1 1 A 150 150 ASP N N 150 122.687 121.436 1.251 1 1 1655 . 19 1 1 A 151 151 PHE H H 151 7.295 7.580 -0.285 1 1 1656 . 19 1 1 A 151 151 PHE HA H 151 5.020 4.794 0.226 1 1 1661 . 19 1 1 A 151 151 PHE C C 151 174.756 175.705 -0.949 1 1 1662 . 19 1 1 A 151 151 PHE CA C 151 56.594 56.530 0.064 1 1 1663 . 19 1 1 A 151 151 PHE CB C 151 37.765 37.212 0.553 1 1 1666 . 19 1 1 A 151 151 PHE N N 151 113.928 115.949 -2.021 1 1 1667 . 19 1 1 A 152 152 GLY H H 152 7.786 8.348 -0.562 1 1 1668 . 19 1 1 A 152 152 GLY HA2 H 152 4.459 3.995 0.464 1 1 1669 . 19 1 1 A 152 152 GLY HA3 H 152 3.728 4.017 -0.289 1 1 1670 . 19 1 1 A 152 152 GLY C C 152 172.709 173.680 -0.971 1 1 1671 . 19 1 1 A 152 152 GLY CA C 152 46.106 47.354 -1.248 1 1 1672 . 19 1 1 A 152 152 GLY N N 152 110.312 108.833 1.479 1 1 1673 . 19 1 1 A 153 153 TYR H H 153 6.650 7.306 -0.656 1 1 1674 . 19 1 1 A 153 153 TYR HA H 153 4.508 4.898 -0.390 1 1 1679 . 19 1 1 A 153 153 TYR C C 153 173.092 173.371 -0.279 1 1 1680 . 19 1 1 A 153 153 TYR CA C 153 57.464 57.034 0.430 1 1 1681 . 19 1 1 A 153 153 TYR CB C 153 41.962 42.240 -0.278 1 1 1684 . 19 1 1 A 153 153 TYR N N 153 121.977 119.499 2.478 1 1 1685 . 19 1 1 A 154 154 ALA H H 154 7.847 8.594 -0.747 1 1 1686 . 19 1 1 A 154 154 ALA HA H 154 5.144 4.764 0.380 1 1 1690 . 19 1 1 A 154 154 ALA C C 154 174.468 175.305 -0.837 1 1 1691 . 19 1 1 A 154 154 ALA CA C 154 51.776 51.432 0.344 1 1 1692 . 19 1 1 A 154 154 ALA CB C 154 21.747 20.903 0.844 1 1 1693 . 19 1 1 A 154 154 ALA N N 154 130.258 130.319 -0.061 1 1 1694 . 19 1 1 A 155 155 VAL H H 155 8.733 8.815 -0.082 1 1 1695 . 19 1 1 A 155 155 VAL HA H 155 4.150 4.882 -0.732 1 1 1700 . 19 1 1 A 155 155 VAL C C 155 172.632 173.113 -0.481 1 1 1701 . 19 1 1 A 155 155 VAL CA C 155 61.451 59.157 2.294 1 1 1702 . 19 1 1 A 155 155 VAL CB C 155 35.883 35.385 0.498 1 1 1704 . 19 1 1 A 155 155 VAL N N 155 119.622 122.447 -2.825 1 1 1705 . 19 1 1 A 156 156 GLY H H 156 8.146 8.464 -0.318 1 1 1706 . 19 1 1 A 156 156 GLY HA2 H 156 5.125 2.732 2.393 1 1 1707 . 19 1 1 A 156 156 GLY HA3 H 156 2.061 3.889 -1.828 1 1 1708 . 19 1 1 A 156 156 GLY C C 156 171.746 171.391 0.355 1 1 1709 . 19 1 1 A 156 156 GLY CA C 156 43.319 43.725 -0.406 1 1 1710 . 19 1 1 A 156 156 GLY N N 156 113.332 113.444 -0.112 1 1 1711 . 19 1 1 A 157 157 GLU H H 157 8.967 9.011 -0.044 1 1 1712 . 19 1 1 A 157 157 GLU HA H 157 5.217 4.996 0.221 1 1 1716 . 19 1 1 A 157 157 GLU C C 157 174.476 175.393 -0.917 1 1 1717 . 19 1 1 A 157 157 GLU CA C 157 55.390 54.948 0.442 1 1 1718 . 19 1 1 A 157 157 GLU CB C 157 34.010 32.618 1.392 1 1 1720 . 19 1 1 A 157 157 GLU N N 157 120.823 123.300 -2.477 1 1 1721 . 19 1 1 A 158 158 VAL H H 158 9.076 9.637 -0.561 1 1 1722 . 19 1 1 A 158 158 VAL HA H 158 5.206 4.869 0.337 1 1 1727 . 19 1 1 A 158 158 VAL C C 158 173.900 174.469 -0.569 1 1 1728 . 19 1 1 A 158 158 VAL CA C 158 60.813 61.497 -0.684 1 1 1729 . 19 1 1 A 158 158 VAL CB C 158 33.385 33.288 0.097 1 1 1731 . 19 1 1 A 158 158 VAL N N 158 124.349 125.596 -1.247 1 1 1732 . 19 1 1 A 159 159 GLU H H 159 9.239 9.555 -0.316 1 1 1733 . 19 1 1 A 159 159 GLU HA H 159 5.647 5.335 0.312 1 1 1738 . 19 1 1 A 159 159 GLU C C 159 174.469 175.187 -0.718 1 1 1739 . 19 1 1 A 159 159 GLU CA C 159 54.473 54.691 -0.218 1 1 1740 . 19 1 1 A 159 159 GLU CB C 159 33.852 32.881 0.971 1 1 1742 . 19 1 1 A 159 159 GLU N N 159 125.772 128.072 -2.300 1 1 1743 . 19 1 1 A 160 160 ALA H H 160 9.250 9.284 -0.034 1 1 1744 . 19 1 1 A 160 160 ALA HA H 160 4.966 5.327 -0.361 1 1 1748 . 19 1 1 A 160 160 ALA C C 160 175.114 175.659 -0.545 1 1 1749 . 19 1 1 A 160 160 ALA CA C 160 50.644 50.433 0.211 1 1 1750 . 19 1 1 A 160 160 ALA CB C 160 23.263 23.155 0.108 1 1 1751 . 19 1 1 A 160 160 ALA N N 160 125.092 129.087 -3.995 1 1 1752 . 19 1 1 A 161 161 MET H H 161 8.559 8.956 -0.397 1 1 1753 . 19 1 1 A 161 161 MET HA H 161 5.468 5.492 -0.024 1 1 1761 . 19 1 1 A 161 161 MET C C 161 176.265 174.498 1.767 1 1 1762 . 19 1 1 A 161 161 MET CA C 161 53.818 54.170 -0.352 1 1 1763 . 19 1 1 A 161 161 MET CB C 161 34.380 35.175 -0.795 1 1 1766 . 19 1 1 A 161 161 MET N N 161 118.699 119.752 -1.053 1 1 1767 . 19 1 1 A 162 162 VAL H H 162 9.046 9.479 -0.433 1 1 1768 . 19 1 1 A 162 162 VAL HA H 162 4.841 4.508 0.333 1 1 1776 . 19 1 1 A 162 162 VAL C C 162 174.794 176.182 -1.388 1 1 1777 . 19 1 1 A 162 162 VAL CA C 162 59.107 61.109 -2.002 1 1 1778 . 19 1 1 A 162 162 VAL CB C 162 34.018 33.820 0.198 1 1 1781 . 19 1 1 A 162 162 VAL N N 162 116.435 124.220 -7.785 1 1 1782 . 19 1 1 A 163 163 HIS H H 163 8.793 8.784 0.009 1 1 1783 . 19 1 1 A 163 163 HIS HA H 163 4.717 4.478 0.239 1 1 1787 . 19 1 1 A 163 163 HIS C C 163 175.460 174.524 0.936 1 1 1788 . 19 1 1 A 163 163 HIS CA C 163 58.488 58.377 0.111 1 1 1789 . 19 1 1 A 163 163 HIS CB C 163 31.185 30.637 0.548 1 1 1791 . 19 1 1 A 163 163 HIS N N 163 117.838 127.229 -9.391 1 1 1792 . 19 1 1 A 164 164 GLU H H 164 8.013 7.633 0.380 1 1 1793 . 19 1 1 A 164 164 GLU HA H 164 4.814 4.603 0.211 1 1 1797 . 19 1 1 A 164 164 GLU C C 164 176.910 176.678 0.232 1 1 1798 . 19 1 1 A 164 164 GLU CA C 164 54.355 54.695 -0.340 1 1 1799 . 19 1 1 A 164 164 GLU CB C 164 32.886 32.391 0.495 1 1 1801 . 19 1 1 A 164 164 GLU N N 164 115.943 114.896 1.047 1 1 1802 . 19 1 1 A 165 165 LYS H H 165 9.088 8.833 0.255 1 1 1803 . 19 1 1 A 165 165 LYS HA H 165 3.942 4.020 -0.078 1 1 1809 . 19 1 1 A 165 165 LYS C C 165 179.657 177.906 1.751 1 1 1810 . 19 1 1 A 165 165 LYS CA C 165 59.888 58.214 1.674 1 1 1811 . 19 1 1 A 165 165 LYS CB C 165 32.024 32.421 -0.397 1 1 1814 . 19 1 1 A 165 165 LYS N N 165 124.120 121.148 2.972 1 1 1815 . 19 1 1 A 166 166 ALA H H 166 8.851 7.878 0.973 1 1 1816 . 19 1 1 A 166 166 ALA HA H 166 4.251 4.074 0.177 1 1 1820 . 19 1 1 A 166 166 ALA C C 166 178.920 178.747 0.173 1 1 1821 . 19 1 1 A 166 166 ALA CA C 166 54.318 54.556 -0.238 1 1 1822 . 19 1 1 A 166 166 ALA CB C 166 18.810 18.351 0.459 1 1 1823 . 19 1 1 A 166 166 ALA N N 166 120.424 122.544 -2.120 1 1 1824 . 19 1 1 A 167 167 GLU H H 167 7.871 7.722 0.149 1 1 1825 . 19 1 1 A 167 167 GLU HA H 167 4.404 4.532 -0.128 1 1 1829 . 19 1 1 A 167 167 GLU C C 167 177.368 176.938 0.430 1 1 1830 . 19 1 1 A 167 167 GLU CA C 167 56.701 56.516 0.185 1 1 1831 . 19 1 1 A 167 167 GLU CB C 167 31.208 30.581 0.627 1 1 1833 . 19 1 1 A 167 167 GLU N N 167 114.926 115.613 -0.687 1 1 1834 . 19 1 1 A 168 168 VAL H H 168 7.812 7.508 0.304 1 1 1835 . 19 1 1 A 168 168 VAL HA H 168 3.712 3.694 0.018 1 1 1843 . 19 1 1 A 168 168 VAL CA C 168 68.705 67.842 0.863 1 1 1844 . 19 1 1 A 168 168 VAL CB C 168 29.597 29.674 -0.077 1 1 1847 . 19 1 1 A 168 168 VAL N N 168 120.188 122.230 -2.042 1 1 1848 . 19 1 1 A 169 169 PRO HA H 169 4.252 4.242 0.010 1 1 1851 . 19 1 1 A 169 169 PRO C C 169 179.563 178.645 0.918 1 1 1852 . 19 1 1 A 169 169 PRO CA C 169 67.077 66.778 0.299 1 1 1853 . 19 1 1 A 170 170 ALA H H 170 8.149 8.273 -0.124 1 1 1854 . 19 1 1 A 170 170 ALA HA H 170 4.265 4.058 0.207 1 1 1858 . 19 1 1 A 170 170 ALA C C 170 180.637 179.981 0.656 1 1 1859 . 19 1 1 A 170 170 ALA CA C 170 54.823 55.376 -0.553 1 1 1860 . 19 1 1 A 170 170 ALA CB C 170 18.518 18.167 0.351 1 1 1861 . 19 1 1 A 170 170 ALA N N 170 119.210 119.175 0.035 1 1 1862 . 19 1 1 A 171 171 ALA H H 171 7.767 8.310 -0.543 1 1 1863 . 19 1 1 A 171 171 ALA HA H 171 4.106 4.165 -0.059 1 1 1867 . 19 1 1 A 171 171 ALA C C 171 179.371 180.060 -0.689 1 1 1868 . 19 1 1 A 171 171 ALA CA C 171 55.130 54.917 0.213 1 1 1869 . 19 1 1 A 171 171 ALA CB C 171 18.291 18.208 0.083 1 1 1870 . 19 1 1 A 171 171 ALA N N 171 122.126 120.418 1.708 1 1 1871 . 19 1 1 A 172 172 LEU H H 172 8.950 8.342 0.608 1 1 1872 . 19 1 1 A 172 172 LEU HA H 172 3.987 4.116 -0.129 1 1 1878 . 19 1 1 A 172 172 LEU C C 172 178.355 178.587 -0.232 1 1 1879 . 19 1 1 A 172 172 LEU CA C 172 57.803 57.866 -0.063 1 1 1880 . 19 1 1 A 172 172 LEU CB C 172 41.667 41.434 0.233 1 1 1882 . 19 1 1 A 172 172 LEU N N 172 118.682 119.851 -1.169 1 1 1883 . 19 1 1 A 173 173 GLU H H 173 7.886 8.096 -0.210 1 1 1884 . 19 1 1 A 173 173 GLU HA H 173 4.132 3.952 0.180 1 1 1887 . 19 1 1 A 173 173 GLU C C 173 179.556 179.593 -0.037 1 1 1888 . 19 1 1 A 173 173 GLU CA C 173 59.800 59.602 0.198 1 1 1889 . 19 1 1 A 173 173 GLU CB C 173 29.580 29.185 0.395 1 1 1891 . 19 1 1 A 173 173 GLU N N 173 117.561 118.622 -1.061 1 1 1892 . 19 1 1 A 174 174 LYS H H 174 7.532 7.952 -0.420 1 1 1893 . 19 1 1 A 174 174 LYS HA H 174 4.131 4.091 0.040 1 1 1901 . 19 1 1 A 174 174 LYS CA C 174 58.999 59.052 -0.053 1 1 1902 . 19 1 1 A 174 174 LYS CB C 174 32.041 32.209 -0.168 1 1 1906 . 19 1 1 A 174 174 LYS N N 174 119.085 121.266 -2.181 1 1 1907 . 19 1 1 A 175 175 ILE H H 175 8.479 8.033 0.446 1 1 1908 . 19 1 1 A 175 175 ILE HA H 175 3.583 3.599 -0.016 1 1 1918 . 19 1 1 A 175 175 ILE C C 175 179.258 178.505 0.753 1 1 1919 . 19 1 1 A 175 175 ILE CA C 175 65.769 65.596 0.173 1 1 1920 . 19 1 1 A 175 175 ILE CB C 175 37.876 38.066 -0.190 1 1 1923 . 19 1 1 A 175 175 ILE N N 175 118.828 119.510 -0.682 1 1 1924 . 19 1 1 A 176 176 ILE H H 176 8.928 7.899 1.029 1 1 1925 . 19 1 1 A 176 176 ILE HA H 176 3.600 3.612 -0.012 1 1 1935 . 19 1 1 A 176 176 ILE C C 176 178.827 178.092 0.735 1 1 1936 . 19 1 1 A 176 176 ILE CA C 176 65.640 65.030 0.610 1 1 1937 . 19 1 1 A 176 176 ILE CB C 176 37.451 37.393 0.058 1 1 1941 . 19 1 1 A 176 176 ILE N N 176 124.527 119.644 4.883 1 1 1942 . 19 1 1 A 177 177 THR H H 177 8.175 8.417 -0.242 1 1 1943 . 19 1 1 A 177 177 THR HA H 177 3.885 3.926 -0.041 1 1 1948 . 19 1 1 A 177 177 THR C C 177 176.867 176.373 0.494 1 1 1949 . 19 1 1 A 177 177 THR CA C 177 67.199 66.492 0.707 1 1 1950 . 19 1 1 A 177 177 THR CB C 177 68.377 68.703 -0.326 1 1 1952 . 19 1 1 A 177 177 THR N N 177 119.412 118.810 0.602 1 1 1953 . 19 1 1 A 178 178 VAL H H 178 8.352 8.125 0.227 1 1 1954 . 19 1 1 A 178 178 VAL HA H 178 3.572 3.395 0.177 1 1 1962 . 19 1 1 A 178 178 VAL C C 178 177.664 177.783 -0.119 1 1 1963 . 19 1 1 A 178 178 VAL CA C 178 66.909 66.259 0.650 1 1 1964 . 19 1 1 A 178 178 VAL CB C 178 31.714 31.287 0.427 1 1 1967 . 19 1 1 A 178 178 VAL N N 178 121.168 121.883 -0.715 1 1 1968 . 19 1 1 A 179 179 SER H H 179 8.529 8.222 0.307 1 1 1969 . 19 1 1 A 179 179 SER HA H 179 3.099 3.235 -0.136 1 1 1972 . 19 1 1 A 179 179 SER C C 179 175.380 176.271 -0.891 1 1 1973 . 19 1 1 A 179 179 SER CA C 179 62.728 61.498 1.230 1 1 1974 . 19 1 1 A 179 179 SER CB C 179 62.802 62.601 0.201 1 1 1975 . 19 1 1 A 179 179 SER N N 179 115.226 115.327 -0.101 1 1 1976 . 19 1 1 A 180 180 SER H H 180 7.757 8.163 -0.406 1 1 1977 . 19 1 1 A 180 180 SER HA H 180 4.419 4.326 0.093 1 1 1980 . 19 1 1 A 180 180 SER C C 180 175.359 177.024 -1.665 1 1 1981 . 19 1 1 A 180 180 SER CA C 180 61.025 61.261 -0.236 1 1 1982 . 19 1 1 A 180 180 SER CB C 180 63.072 63.120 -0.048 1 1 1983 . 19 1 1 A 180 180 SER N N 180 114.718 115.858 -1.140 1 1 1984 . 19 1 1 A 181 181 MET H H 181 7.497 7.751 -0.254 1 1 1985 . 19 1 1 A 181 181 MET HA H 181 4.283 4.197 0.086 1 1 1993 . 19 1 1 A 181 181 MET C C 181 177.217 177.673 -0.456 1 1 1994 . 19 1 1 A 181 181 MET CA C 181 57.539 57.862 -0.323 1 1 1995 . 19 1 1 A 181 181 MET CB C 181 33.493 32.444 1.049 1 1 1998 . 19 1 1 A 181 181 MET N N 181 119.274 120.675 -1.401 1 1 1999 . 19 1 1 A 182 182 LEU H H 182 7.163 7.647 -0.484 1 1 2000 . 19 1 1 A 182 182 LEU HA H 182 4.133 4.228 -0.095 1 1 2010 . 19 1 1 A 182 182 LEU C C 182 176.289 176.892 -0.603 1 1 2011 . 19 1 1 A 182 182 LEU CA C 182 54.750 55.615 -0.865 1 1 2012 . 19 1 1 A 182 182 LEU CB C 182 43.235 42.796 0.439 1 1 2016 . 19 1 1 A 182 182 LEU N N 182 115.869 117.836 -1.967 1 1 2017 . 19 1 1 A 183 183 GLY H H 183 7.492 7.651 -0.159 1 1 2018 . 19 1 1 A 183 183 GLY HA2 H 183 4.086 4.089 -0.003 1 1 2019 . 19 1 1 A 183 183 GLY HA3 H 183 4.425 4.144 0.281 1 1 2020 . 19 1 1 A 183 183 GLY C C 183 171.830 171.681 0.149 1 1 2021 . 19 1 1 A 183 183 GLY CA C 183 46.035 46.208 -0.173 1 1 2022 . 19 1 1 A 183 183 GLY N N 183 107.761 104.534 3.227 1 1 2023 . 19 1 1 A 184 184 VAL H H 184 8.099 8.476 -0.377 1 1 2024 . 19 1 1 A 184 184 VAL HA H 184 4.772 4.788 -0.016 1 1 2032 . 19 1 1 A 184 184 VAL CA C 184 59.305 58.789 0.516 1 1 2033 . 19 1 1 A 184 184 VAL CB C 184 33.648 35.235 -1.587 1 1 2036 . 19 1 1 A 184 184 VAL N N 184 119.803 121.587 -1.784 1 1 2037 . 19 1 1 A 185 185 PRO HA H 185 4.442 4.723 -0.281 1 1 2042 . 19 1 1 A 185 185 PRO C C 185 175.871 176.319 -0.448 1 1 2043 . 19 1 1 A 185 185 PRO CA C 185 63.886 62.761 1.125 1 1 2044 . 19 1 1 A 185 185 PRO CB C 185 32.260 32.277 -0.017 1 1 2047 . 19 1 1 A 186 186 ALA H H 186 8.222 9.092 -0.870 1 1 2048 . 19 1 1 A 186 186 ALA HA H 186 4.569 5.057 -0.488 1 1 2052 . 19 1 1 A 186 186 ALA C C 186 177.481 175.878 1.603 1 1 2053 . 19 1 1 A 186 186 ALA CA C 186 51.823 50.803 1.020 1 1 2054 . 19 1 1 A 186 186 ALA CB C 186 20.233 21.954 -1.721 1 1 2055 . 19 1 1 A 186 186 ALA N N 186 125.663 121.553 4.110 1 1 2056 . 19 1 1 A 187 187 GLN H H 187 8.723 8.748 -0.025 1 1 2057 . 19 1 1 A 187 187 GLN HA H 187 4.420 4.876 -0.456 1 1 2063 . 19 1 1 A 187 187 GLN C C 187 175.566 175.914 -0.348 1 1 2064 . 19 1 1 A 187 187 GLN CA C 187 56.051 54.430 1.621 1 1 2065 . 19 1 1 A 187 187 GLN CB C 187 29.812 30.584 -0.772 1 1 2067 . 19 1 1 A 187 187 GLN N N 187 120.742 115.433 5.309 1 1 2069 . 19 1 1 A 188 188 GLU H H 188 8.163 8.634 -0.471 1 1 2070 . 19 1 1 A 188 188 GLU HA H 188 4.405 4.375 0.030 1 1 2074 . 19 1 1 A 188 188 GLU C C 188 176.058 177.143 -1.085 1 1 2075 . 19 1 1 A 188 188 GLU CA C 188 56.158 57.700 -1.542 1 1 2076 . 19 1 1 A 188 188 GLU CB C 188 31.095 29.548 1.547 1 1 2078 . 19 1 1 A 188 188 GLU N N 188 119.177 116.957 2.220 1 1 2079 . 19 1 1 A 189 189 GLU H H 189 8.567 8.524 0.043 1 1 2080 . 19 1 1 A 189 189 GLU HA H 189 4.252 4.418 -0.166 1 1 2084 . 19 1 1 A 189 189 GLU C C 189 175.703 176.476 -0.773 1 1 2085 . 19 1 1 A 189 189 GLU CA C 189 56.417 56.058 0.359 1 1 2086 . 19 1 1 A 189 189 GLU CB C 189 29.968 29.046 0.922 1 1 2088 . 19 1 1 A 189 189 GLU N N 189 120.920 117.407 3.513 1 1 2089 . 19 1 1 A 190 190 ALA H H 190 8.271 7.176 1.095 1 1 2090 . 19 1 1 A 190 190 ALA HA H 190 4.626 4.350 0.276 1 1 2094 . 19 1 1 A 190 190 ALA CA C 190 50.465 50.610 -0.145 1 1 2095 . 19 1 1 A 190 190 ALA CB C 190 18.451 19.875 -1.424 1 1 2096 . 19 1 1 A 190 190 ALA N N 190 128.323 123.415 4.908 1 1 2097 . 19 1 1 A 191 191 PRO HA H 191 4.493 4.604 -0.111 1 1 2103 . 19 1 1 A 191 191 PRO C C 191 175.899 176.204 -0.305 1 1 2104 . 19 1 1 A 191 191 PRO CA C 191 62.044 62.241 -0.197 1 1 2105 . 19 1 1 A 191 191 PRO CB C 191 32.184 32.051 0.133 1 1 2108 . 19 1 1 A 192 192 ALA H H 192 8.610 8.262 0.348 1 1 2109 . 19 1 1 A 192 192 ALA HA H 192 4.280 4.435 -0.155 1 1 2113 . 19 1 1 A 192 192 ALA C C 192 178.282 178.060 0.222 1 1 2114 . 19 1 1 A 192 192 ALA CA C 192 51.698 52.443 -0.745 1 1 2115 . 19 1 1 A 192 192 ALA CB C 192 19.220 19.250 -0.030 1 1 2116 . 19 1 1 A 192 192 ALA N N 192 123.420 124.691 -1.271 1 1 2117 . 19 1 1 A 193 193 LYS H H 193 8.531 8.852 -0.321 1 1 2118 . 19 1 1 A 193 193 LYS HA H 193 3.294 3.845 -0.551 1 1 2126 . 19 1 1 A 193 193 LYS C C 193 177.640 177.887 -0.247 1 1 2127 . 19 1 1 A 193 193 LYS CA C 193 60.644 60.299 0.345 1 1 2128 . 19 1 1 A 193 193 LYS CB C 193 32.607 32.236 0.371 1 1 2132 . 19 1 1 A 193 193 LYS N N 193 122.851 122.840 0.011 1 1 2133 . 19 1 1 A 194 194 LEU H H 194 8.570 7.964 0.606 1 1 2134 . 19 1 1 A 194 194 LEU HA H 194 3.845 4.298 -0.453 1 1 2144 . 19 1 1 A 194 194 LEU C C 194 177.965 178.670 -0.705 1 1 2145 . 19 1 1 A 194 194 LEU CA C 194 57.611 57.485 0.126 1 1 2146 . 19 1 1 A 194 194 LEU CB C 194 41.776 40.505 1.271 1 1 2150 . 19 1 1 A 194 194 LEU N N 194 115.801 120.766 -4.965 1 1 2151 . 19 1 1 A 195 195 MET H H 195 6.782 7.941 -1.159 1 1 2152 . 19 1 1 A 195 195 MET HA H 195 4.487 4.233 0.254 1 1 2160 . 19 1 1 A 195 195 MET C C 195 178.280 178.237 0.043 1 1 2161 . 19 1 1 A 195 195 MET CA C 195 56.858 58.023 -1.165 1 1 2162 . 19 1 1 A 195 195 MET CB C 195 31.557 32.160 -0.603 1 1 2165 . 19 1 1 A 195 195 MET N N 195 113.898 119.079 -5.181 1 1 2166 . 19 1 1 A 196 196 VAL H H 196 7.713 7.760 -0.047 1 1 2167 . 19 1 1 A 196 196 VAL HA H 196 3.501 3.247 0.254 1 1 2175 . 19 1 1 A 196 196 VAL C C 196 177.624 177.618 0.006 1 1 2176 . 19 1 1 A 196 196 VAL CA C 196 66.318 66.069 0.249 1 1 2177 . 19 1 1 A 196 196 VAL CB C 196 31.380 31.029 0.351 1 1 2180 . 19 1 1 A 196 196 VAL N N 196 120.413 119.771 0.642 1 1 2181 . 19 1 1 A 197 197 TYR H H 197 7.972 8.054 -0.082 1 1 2182 . 19 1 1 A 197 197 TYR HA H 197 3.145 4.247 -1.102 1 1 2187 . 19 1 1 A 197 197 TYR C C 197 177.726 177.287 0.439 1 1 2188 . 19 1 1 A 197 197 TYR CA C 197 62.253 61.502 0.751 1 1 2189 . 19 1 1 A 197 197 TYR CB C 197 37.314 38.950 -1.636 1 1 2192 . 19 1 1 A 197 197 TYR N N 197 119.543 120.906 -1.363 1 1 2193 . 19 1 1 A 198 198 LEU H H 198 8.630 8.033 0.597 1 1 2194 . 19 1 1 A 198 198 LEU HA H 198 3.923 3.918 0.005 1 1 2203 . 19 1 1 A 198 198 LEU C C 198 178.074 178.944 -0.870 1 1 2204 . 19 1 1 A 198 198 LEU CA C 198 58.294 57.624 0.670 1 1 2205 . 19 1 1 A 198 198 LEU CB C 198 42.177 41.341 0.836 1 1 2209 . 19 1 1 A 198 198 LEU N N 198 118.430 119.563 -1.133 1 1 2210 . 19 1 1 A 199 199 GLN H H 199 8.082 8.605 -0.523 1 1 2211 . 19 1 1 A 199 199 GLN HA H 199 3.054 3.593 -0.539 1 1 2216 . 19 1 1 A 199 199 GLN C C 199 176.875 178.603 -1.728 1 1 2217 . 19 1 1 A 199 199 GLN CA C 199 59.739 58.997 0.742 1 1 2218 . 19 1 1 A 199 199 GLN CB C 199 28.055 27.771 0.284 1 1 2220 . 19 1 1 A 199 199 GLN N N 199 117.926 118.804 -0.878 1 1 2222 . 19 1 1 A 200 200 ARG H H 200 7.349 7.329 0.020 1 1 2223 . 19 1 1 A 200 200 ARG HA H 200 3.798 3.791 0.007 1 1 2231 . 19 1 1 A 200 200 ARG C C 200 178.037 177.649 0.388 1 1 2232 . 19 1 1 A 200 200 ARG CA C 200 58.260 58.933 -0.673 1 1 2233 . 19 1 1 A 200 200 ARG CB C 200 30.706 30.168 0.538 1 1 2236 . 19 1 1 A 200 200 ARG N N 200 113.772 118.852 -5.080 1 1 2238 . 19 1 1 A 201 201 PHE H H 201 8.329 7.612 0.717 1 1 2239 . 19 1 1 A 201 201 PHE HA H 201 4.630 4.431 0.199 1 1 2244 . 19 1 1 A 201 201 PHE C C 201 176.606 176.249 0.357 1 1 2245 . 19 1 1 A 201 201 PHE CA C 201 59.014 58.756 0.258 1 1 2246 . 19 1 1 A 201 201 PHE CB C 201 40.357 40.656 -0.299 1 1 2249 . 19 1 1 A 201 201 PHE N N 201 114.182 114.710 -0.528 1 1 2250 . 19 1 1 A 202 202 ARG H H 202 8.719 8.548 0.171 1 1 2251 . 19 1 1 A 202 202 ARG HA H 202 5.071 4.714 0.357 1 1 2261 . 19 1 1 A 202 202 ARG CA C 202 53.956 53.646 0.310 1 1 2262 . 19 1 1 A 202 202 ARG CB C 202 31.979 30.127 1.852 1 1 2264 . 19 1 1 A 202 202 ARG N N 202 120.115 114.591 5.524 1 1 2266 . 19 1 1 A 203 203 PRO HA H 203 4.348 4.530 -0.182 1 1 2271 . 19 1 1 A 203 203 PRO C C 203 179.736 178.050 1.686 1 1 2272 . 19 1 1 A 203 203 PRO CA C 203 65.674 64.893 0.781 1 1 2273 . 19 1 1 A 203 203 PRO CB C 203 31.717 32.181 -0.464 1 1 2275 . 19 1 1 A 204 204 LEU H H 204 8.875 7.656 1.219 1 1 2276 . 19 1 1 A 204 204 LEU HA H 204 4.291 4.060 0.231 1 1 2286 . 19 1 1 A 204 204 LEU C C 204 180.353 177.931 2.422 1 1 2287 . 19 1 1 A 204 204 LEU CA C 204 58.012 57.117 0.895 1 1 2288 . 19 1 1 A 204 204 LEU CB C 204 40.893 42.161 -1.268 1 1 2292 . 19 1 1 A 204 204 LEU N N 204 118.940 118.075 0.865 1 1 2293 . 19 1 1 A 205 205 ASP H H 205 7.541 8.456 -0.915 1 1 2294 . 19 1 1 A 205 205 ASP HA H 205 4.622 4.344 0.278 1 1 2297 . 19 1 1 A 205 205 ASP C C 205 177.602 178.257 -0.655 1 1 2298 . 19 1 1 A 205 205 ASP CA C 205 57.437 57.614 -0.177 1 1 2299 . 19 1 1 A 205 205 ASP CB C 205 41.143 39.858 1.285 1 1 2300 . 19 1 1 A 205 205 ASP N N 205 120.838 118.669 2.169 1 1 2301 . 19 1 1 A 206 206 TYR H H 206 8.237 8.035 0.202 1 1 2302 . 19 1 1 A 206 206 TYR HA H 206 4.018 4.098 -0.080 1 1 2307 . 19 1 1 A 206 206 TYR C C 206 176.433 177.742 -1.309 1 1 2308 . 19 1 1 A 206 206 TYR CA C 206 62.148 61.814 0.334 1 1 2309 . 19 1 1 A 206 206 TYR CB C 206 38.305 38.717 -0.412 1 1 2312 . 19 1 1 A 206 206 TYR N N 206 119.475 122.321 -2.846 1 1 2313 . 19 1 1 A 207 207 GLN H H 207 8.124 8.084 0.040 1 1 2314 . 19 1 1 A 207 207 GLN HA H 207 3.823 3.140 0.683 1 1 2320 . 19 1 1 A 207 207 GLN C C 207 178.019 178.679 -0.660 1 1 2321 . 19 1 1 A 207 207 GLN CA C 207 58.841 58.931 -0.090 1 1 2322 . 19 1 1 A 207 207 GLN CB C 207 28.208 28.044 0.164 1 1 2324 . 19 1 1 A 207 207 GLN N N 207 115.863 118.153 -2.290 1 1 2326 . 19 1 1 A 208 208 ARG H H 208 7.522 7.727 -0.205 1 1 2327 . 19 1 1 A 208 208 ARG HA H 208 4.127 4.356 -0.229 1 1 2334 . 19 1 1 A 208 208 ARG C C 208 179.278 178.969 0.309 1 1 2335 . 19 1 1 A 208 208 ARG CA C 208 59.419 58.993 0.426 1 1 2336 . 19 1 1 A 208 208 ARG CB C 208 30.182 29.837 0.345 1 1 2338 . 19 1 1 A 208 208 ARG N N 208 118.471 119.929 -1.458 1 1 2340 . 19 1 1 A 209 209 LEU H H 209 7.869 7.675 0.194 1 1 2341 . 19 1 1 A 209 209 LEU HA H 209 4.091 4.232 -0.141 1 1 2351 . 19 1 1 A 209 209 LEU C C 209 179.715 178.340 1.375 1 1 2352 . 19 1 1 A 209 209 LEU CA C 209 57.891 57.907 -0.016 1 1 2353 . 19 1 1 A 209 209 LEU CB C 209 41.338 41.819 -0.481 1 1 2356 . 19 1 1 A 209 209 LEU N N 209 119.659 121.197 -1.538 1 1 2357 . 19 1 1 A 210 210 LEU H H 210 8.034 8.613 -0.579 1 1 2358 . 19 1 1 A 210 210 LEU HA H 210 3.977 4.027 -0.050 1 1 2367 . 19 1 1 A 210 210 LEU C C 210 180.363 178.628 1.735 1 1 2368 . 19 1 1 A 210 210 LEU CA C 210 57.459 58.412 -0.953 1 1 2369 . 19 1 1 A 210 210 LEU CB C 210 41.699 41.395 0.304 1 1 2373 . 19 1 1 A 210 210 LEU N N 210 120.967 119.985 0.982 1 1 2374 . 19 1 1 A 211 211 GLU H H 211 8.174 8.874 -0.700 1 1 2375 . 19 1 1 A 211 211 GLU HA H 211 4.075 4.002 0.073 1 1 2379 . 19 1 1 A 211 211 GLU C C 211 178.499 179.214 -0.715 1 1 2380 . 19 1 1 A 211 211 GLU CA C 211 58.575 59.624 -1.049 1 1 2381 . 19 1 1 A 211 211 GLU CB C 211 29.583 29.093 0.490 1 1 2383 . 19 1 1 A 211 211 GLU N N 211 119.217 118.410 0.807 1 1 2384 . 19 1 1 A 212 212 ALA H H 212 7.723 8.135 -0.412 1 1 2385 . 19 1 1 A 212 212 ALA HA H 212 4.291 4.190 0.101 1 1 2389 . 19 1 1 A 212 212 ALA C C 212 178.770 179.591 -0.821 1 1 2390 . 19 1 1 A 212 212 ALA CA C 212 53.966 54.892 -0.926 1 1 2391 . 19 1 1 A 212 212 ALA CB C 212 19.117 18.469 0.648 1 1 2392 . 19 1 1 A 212 212 ALA N N 212 121.798 122.985 -1.187 1 1 2393 . 19 1 1 A 213 213 ALA H H 213 7.743 8.185 -0.442 1 1 2394 . 19 1 1 A 213 213 ALA HA H 213 4.406 4.117 0.289 1 1 2398 . 19 1 1 A 213 213 ALA C C 213 178.413 179.314 -0.901 1 1 2399 . 19 1 1 A 213 213 ALA CA C 213 53.129 55.238 -2.109 1 1 2400 . 19 1 1 A 213 213 ALA CB C 213 18.926 18.186 0.740 1 1 2401 . 19 1 1 A 213 213 ALA N N 213 120.435 120.739 -0.304 1 1 2402 . 19 1 1 A 214 214 SER H H 214 7.944 8.813 -0.869 1 1 2403 . 19 1 1 A 214 214 SER HA H 214 4.559 4.101 0.458 1 1 2406 . 19 1 1 A 214 214 SER C C 214 174.958 176.129 -1.171 1 1 2407 . 19 1 1 A 214 214 SER CA C 214 58.640 61.273 -2.633 1 1 2408 . 19 1 1 A 214 214 SER CB C 214 63.928 63.096 0.832 1 1 2409 . 19 1 1 A 214 214 SER N N 214 113.729 113.658 0.071 1 1 2410 . 19 1 1 A 215 215 SER H H 215 8.255 7.672 0.583 1 1 2411 . 19 1 1 A 215 215 SER HA H 215 4.547 4.527 0.020 1 1 2413 . 19 1 1 A 215 215 SER C C 215 175.289 173.690 1.599 1 1 2414 . 19 1 1 A 215 215 SER CA C 215 58.833 58.896 -0.063 1 1 2415 . 19 1 1 A 215 215 SER CB C 215 63.847 63.978 -0.131 1 1 2416 . 19 1 1 A 215 215 SER N N 215 117.674 114.039 3.635 1 1 2417 . 19 1 1 A 216 216 GLY H H 216 8.431 8.043 0.388 1 1 2418 . 19 1 1 A 216 216 GLY HA2 H 216 4.054 4.137 -0.083 1 1 2419 . 19 1 1 A 216 216 GLY C C 216 174.189 172.814 1.375 1 1 2420 . 19 1 1 A 216 216 GLY CA C 216 45.412 45.325 0.087 1 1 2421 . 19 1 1 A 216 216 GLY N N 216 110.800 108.931 1.869 1 1 2422 . 19 1 1 A 217 217 GLU H H 217 8.267 8.880 -0.613 1 1 2423 . 19 1 1 A 217 217 GLU HA H 217 4.345 4.417 -0.072 1 1 2427 . 19 1 1 A 217 217 GLU C C 217 176.428 175.633 0.795 1 1 2428 . 19 1 1 A 217 217 GLU CA C 217 56.470 57.471 -1.001 1 1 2429 . 19 1 1 A 217 217 GLU CB C 217 30.526 30.153 0.373 1 1 2430 . 19 1 1 A 217 217 GLU N N 217 120.726 126.734 -6.008 1 1 2431 . 19 1 1 A 218 218 ALA H H 218 8.476 8.671 -0.195 1 1 2432 . 19 1 1 A 218 218 ALA HA H 218 4.467 4.843 -0.376 1 1 2436 . 19 1 1 A 218 218 ALA C C 218 178.015 176.520 1.495 1 1 2437 . 19 1 1 A 218 218 ALA CA C 218 52.547 50.682 1.865 1 1 2438 . 19 1 1 A 218 218 ALA CB C 218 19.242 19.610 -0.368 1 1 2439 . 19 1 1 A 218 218 ALA N N 218 125.534 130.333 -4.799 1 1 2440 . 19 1 1 A 219 219 THR H H 219 8.232 8.903 -0.671 1 1 2441 . 19 1 1 A 219 219 THR HA H 219 4.411 5.211 -0.800 1 1 2446 . 19 1 1 A 219 219 THR C C 219 175.327 173.766 1.561 1 1 2447 . 19 1 1 A 219 219 THR CA C 219 61.889 59.739 2.150 1 1 2448 . 19 1 1 A 219 219 THR CB C 219 69.939 72.248 -2.309 1 1 2449 . 19 1 1 A 219 219 THR N N 219 113.242 113.309 -0.067 1 1 2450 . 19 1 1 A 220 220 GLY H H 220 8.418 9.431 -1.013 1 1 2451 . 19 1 1 A 220 220 GLY C C 220 174.037 172.036 2.001 1 1 2452 . 19 1 1 A 220 220 GLY CA C 220 45.408 44.081 1.327 1 1 2453 . 19 1 1 A 220 220 GLY N N 220 111.031 109.123 1.908 1 1 2454 . 19 1 1 A 221 221 ASP H H 221 8.345 8.603 -0.258 1 1 2455 . 19 1 1 A 221 221 ASP HA H 221 4.700 5.111 -0.411 1 1 2458 . 19 1 1 A 221 221 ASP C C 221 176.535 174.620 1.915 1 1 2459 . 19 1 1 A 221 221 ASP CA C 221 54.402 52.921 1.481 1 1 2460 . 19 1 1 A 221 221 ASP CB C 221 41.431 42.063 -0.632 1 1 2461 . 19 1 1 A 221 221 ASP N N 221 120.795 121.724 -0.929 1 1 2462 . 19 1 1 A 222 222 SER H H 222 8.353 8.554 -0.201 1 1 2463 . 19 1 1 A 222 222 SER HA H 222 4.493 4.807 -0.314 1 1 2465 . 19 1 1 A 222 222 SER C C 222 174.224 174.355 -0.131 1 1 2466 . 19 1 1 A 222 222 SER CA C 222 58.427 57.441 0.986 1 1 2467 . 19 1 1 A 222 222 SER CB C 222 63.860 64.804 -0.944 1 1 2468 . 19 1 1 A 222 222 SER N N 222 116.220 120.155 -3.935 1 1 2469 . 19 1 1 A 223 223 ALA H H 223 8.381 8.748 -0.367 1 1 2470 . 19 1 1 A 223 223 ALA HA H 223 4.461 4.703 -0.242 1 1 2474 . 19 1 1 A 223 223 ALA C C 223 176.926 177.454 -0.528 1 1 2475 . 19 1 1 A 223 223 ALA CA C 223 52.583 54.447 -1.864 1 1 2476 . 19 1 1 A 223 223 ALA CB C 223 19.438 18.896 0.542 1 1 2477 . 19 1 1 A 223 223 ALA N N 223 126.592 130.177 -3.585 1 1 1 . 20 1 1 A 2 2 ALA HA H 2 4.274 4.480 -0.206 1 1 5 . 20 1 1 A 2 2 ALA C C 2 177.828 176.869 0.959 1 1 6 . 20 1 1 A 2 2 ALA CA C 2 52.984 52.313 0.671 1 1 7 . 20 1 1 A 2 2 ALA CB C 2 19.138 19.861 -0.723 1 1 8 . 20 1 1 A 3 3 GLN H H 3 8.463 7.611 0.852 1 1 9 . 20 1 1 A 3 3 GLN HA H 3 4.676 4.655 0.021 1 1 12 . 20 1 1 A 3 3 GLN C C 3 176.002 176.557 -0.555 1 1 13 . 20 1 1 A 3 3 GLN CA C 3 56.258 54.687 1.571 1 1 14 . 20 1 1 A 3 3 GLN CB C 3 30.346 31.226 -0.880 1 1 15 . 20 1 1 A 3 3 GLN N N 3 117.490 118.151 -0.661 1 1 16 . 20 1 1 A 4 4 GLY H H 4 8.099 8.441 -0.342 1 1 17 . 20 1 1 A 4 4 GLY HA2 H 4 3.910 3.985 -0.075 1 1 18 . 20 1 1 A 4 4 GLY C C 4 173.332 173.656 -0.324 1 1 19 . 20 1 1 A 4 4 GLY CA C 4 45.333 46.674 -1.341 1 1 20 . 20 1 1 A 4 4 GLY N N 4 109.423 110.770 -1.347 1 1 21 . 20 1 1 A 5 5 LEU H H 5 7.863 8.426 -0.563 1 1 22 . 20 1 1 A 5 5 LEU HA H 5 4.561 5.383 -0.822 1 1 32 . 20 1 1 A 5 5 LEU C C 5 176.448 176.103 0.345 1 1 33 . 20 1 1 A 5 5 LEU CA C 5 54.713 54.019 0.694 1 1 34 . 20 1 1 A 5 5 LEU CB C 5 43.551 43.353 0.198 1 1 38 . 20 1 1 A 5 5 LEU N N 5 120.391 125.255 -4.864 1 1 39 . 20 1 1 A 6 6 ILE H H 6 8.764 9.130 -0.366 1 1 40 . 20 1 1 A 6 6 ILE HA H 6 4.087 4.094 -0.007 1 1 49 . 20 1 1 A 6 6 ILE C C 6 174.679 175.764 -1.085 1 1 50 . 20 1 1 A 6 6 ILE CA C 6 61.279 61.841 -0.562 1 1 51 . 20 1 1 A 6 6 ILE CB C 6 39.651 38.071 1.580 1 1 54 . 20 1 1 A 6 6 ILE N N 6 123.050 125.811 -2.761 1 1 55 . 20 1 1 A 7 7 GLU H H 7 8.587 8.645 -0.058 1 1 56 . 20 1 1 A 7 7 GLU HA H 7 4.917 4.682 0.235 1 1 61 . 20 1 1 A 7 7 GLU C C 7 175.978 175.472 0.506 1 1 62 . 20 1 1 A 7 7 GLU CA C 7 56.127 56.212 -0.085 1 1 63 . 20 1 1 A 7 7 GLU CB C 7 31.115 30.276 0.839 1 1 65 . 20 1 1 A 7 7 GLU N N 7 127.415 127.713 -0.298 1 1 66 . 20 1 1 A 8 8 VAL H H 8 8.986 8.883 0.103 1 1 67 . 20 1 1 A 8 8 VAL HA H 8 4.375 4.892 -0.517 1 1 72 . 20 1 1 A 8 8 VAL C C 8 173.704 173.619 0.085 1 1 73 . 20 1 1 A 8 8 VAL CA C 8 61.347 59.967 1.380 1 1 74 . 20 1 1 A 8 8 VAL CB C 8 33.611 35.149 -1.538 1 1 76 . 20 1 1 A 8 8 VAL N N 8 126.071 121.092 4.979 1 1 77 . 20 1 1 A 9 9 GLU H H 9 8.521 9.138 -0.617 1 1 78 . 20 1 1 A 9 9 GLU HA H 9 5.837 5.379 0.458 1 1 81 . 20 1 1 A 9 9 GLU C C 9 175.939 174.889 1.050 1 1 82 . 20 1 1 A 9 9 GLU CA C 9 54.516 54.474 0.042 1 1 83 . 20 1 1 A 9 9 GLU CB C 9 33.009 33.953 -0.944 1 1 84 . 20 1 1 A 9 9 GLU N N 9 122.857 126.612 -3.755 1 1 85 . 20 1 1 A 10 10 ARG H H 10 8.690 8.694 -0.004 1 1 86 . 20 1 1 A 10 10 ARG HA H 10 4.709 5.185 -0.476 1 1 94 . 20 1 1 A 10 10 ARG C C 10 174.826 174.659 0.167 1 1 95 . 20 1 1 A 10 10 ARG CA C 10 54.491 54.271 0.220 1 1 96 . 20 1 1 A 10 10 ARG CB C 10 35.777 34.960 0.817 1 1 98 . 20 1 1 A 10 10 ARG N N 10 120.430 120.768 -0.338 1 1 100 . 20 1 1 A 11 11 LYS H H 11 8.874 8.757 0.117 1 1 101 . 20 1 1 A 11 11 LYS HA H 11 5.530 5.223 0.307 1 1 107 . 20 1 1 A 11 11 LYS C C 11 176.919 174.629 2.290 1 1 108 . 20 1 1 A 11 11 LYS CA C 11 55.084 55.424 -0.340 1 1 109 . 20 1 1 A 11 11 LYS CB C 11 35.435 36.642 -1.207 1 1 113 . 20 1 1 A 11 11 LYS N N 11 121.087 123.293 -2.206 1 1 114 . 20 1 1 A 12 12 PHE H H 12 8.877 9.216 -0.339 1 1 115 . 20 1 1 A 12 12 PHE HA H 12 5.130 5.224 -0.094 1 1 120 . 20 1 1 A 12 12 PHE C C 12 171.676 172.121 -0.445 1 1 121 . 20 1 1 A 12 12 PHE CA C 12 55.869 56.080 -0.211 1 1 122 . 20 1 1 A 12 12 PHE CB C 12 42.108 42.076 0.032 1 1 125 . 20 1 1 A 12 12 PHE N N 12 117.486 119.756 -2.270 1 1 126 . 20 1 1 A 13 13 ALA H H 13 9.134 9.415 -0.281 1 1 127 . 20 1 1 A 13 13 ALA HA H 13 5.003 4.826 0.177 1 1 131 . 20 1 1 A 13 13 ALA CA C 13 48.340 48.929 -0.589 1 1 132 . 20 1 1 A 13 13 ALA CB C 13 19.191 20.132 -0.941 1 1 133 . 20 1 1 A 13 13 ALA N N 13 125.915 122.883 3.032 1 1 134 . 20 1 1 A 14 14 PRO HA H 14 4.620 5.022 -0.402 1 1 140 . 20 1 1 A 14 14 PRO C C 14 176.502 177.316 -0.814 1 1 141 . 20 1 1 A 14 14 PRO CA C 14 62.672 62.359 0.313 1 1 142 . 20 1 1 A 14 14 PRO CB C 14 33.119 32.524 0.595 1 1 145 . 20 1 1 A 15 15 GLY H H 15 8.721 8.696 0.025 1 1 146 . 20 1 1 A 15 15 GLY HA2 H 15 3.999 4.093 -0.094 1 1 147 . 20 1 1 A 15 15 GLY HA3 H 15 4.632 4.094 0.538 1 1 148 . 20 1 1 A 15 15 GLY CA C 15 44.411 44.082 0.329 1 1 149 . 20 1 1 A 15 15 GLY N N 15 109.863 108.131 1.732 1 1 150 . 20 1 1 A 16 16 PRO HA H 16 4.447 4.497 -0.050 1 1 155 . 20 1 1 A 16 16 PRO C C 16 177.053 176.941 0.112 1 1 156 . 20 1 1 A 16 16 PRO CA C 16 64.395 64.077 0.318 1 1 157 . 20 1 1 A 16 16 PRO CB C 16 31.993 31.857 0.136 1 1 159 . 20 1 1 A 17 17 ASP H H 17 8.550 8.497 0.053 1 1 160 . 20 1 1 A 17 17 ASP HA H 17 4.950 4.675 0.275 1 1 163 . 20 1 1 A 17 17 ASP C C 17 176.800 176.942 -0.142 1 1 164 . 20 1 1 A 17 17 ASP CA C 17 53.271 54.246 -0.975 1 1 165 . 20 1 1 A 17 17 ASP CB C 17 40.392 41.413 -1.021 1 1 166 . 20 1 1 A 17 17 ASP N N 17 116.060 118.181 -2.121 1 1 167 . 20 1 1 A 18 18 THR H H 18 7.664 7.751 -0.087 1 1 168 . 20 1 1 A 18 18 THR HA H 18 4.120 3.711 0.409 1 1 174 . 20 1 1 A 18 18 THR C C 18 175.407 176.328 -0.921 1 1 175 . 20 1 1 A 18 18 THR CA C 18 68.718 67.162 1.556 1 1 176 . 20 1 1 A 18 18 THR CB C 18 69.179 68.651 0.528 1 1 178 . 20 1 1 A 18 18 THR N N 18 117.158 116.051 1.107 1 1 179 . 20 1 1 A 19 19 GLU H H 19 8.817 8.556 0.261 1 1 180 . 20 1 1 A 19 19 GLU HA H 19 3.510 3.323 0.187 1 1 184 . 20 1 1 A 19 19 GLU C C 19 178.345 179.256 -0.911 1 1 185 . 20 1 1 A 19 19 GLU CA C 19 61.237 59.842 1.395 1 1 186 . 20 1 1 A 19 19 GLU CB C 19 28.746 29.378 -0.632 1 1 188 . 20 1 1 A 19 19 GLU N N 19 118.802 119.089 -0.287 1 1 189 . 20 1 1 A 20 20 GLU H H 20 7.976 7.999 -0.023 1 1 190 . 20 1 1 A 20 20 GLU HA H 20 4.036 4.116 -0.080 1 1 194 . 20 1 1 A 20 20 GLU C C 20 179.451 179.443 0.008 1 1 195 . 20 1 1 A 20 20 GLU CA C 20 59.909 58.807 1.102 1 1 196 . 20 1 1 A 20 20 GLU CB C 20 28.992 29.346 -0.354 1 1 198 . 20 1 1 A 20 20 GLU N N 20 121.130 119.351 1.779 1 1 199 . 20 1 1 A 21 21 ARG H H 21 8.199 8.270 -0.071 1 1 200 . 20 1 1 A 21 21 ARG HA H 21 4.061 4.129 -0.068 1 1 207 . 20 1 1 A 21 21 ARG C C 21 179.087 178.861 0.226 1 1 208 . 20 1 1 A 21 21 ARG CA C 21 58.477 58.582 -0.105 1 1 209 . 20 1 1 A 21 21 ARG CB C 21 30.101 29.897 0.204 1 1 211 . 20 1 1 A 21 21 ARG N N 21 119.897 120.392 -0.495 1 1 213 . 20 1 1 A 22 22 LEU H H 22 8.154 8.542 -0.388 1 1 214 . 20 1 1 A 22 22 LEU HA H 22 3.560 3.769 -0.209 1 1 224 . 20 1 1 A 22 22 LEU C C 22 178.461 179.247 -0.786 1 1 225 . 20 1 1 A 22 22 LEU CA C 22 58.432 57.743 0.689 1 1 226 . 20 1 1 A 22 22 LEU CB C 22 40.229 40.963 -0.734 1 1 230 . 20 1 1 A 22 22 LEU N N 22 120.012 119.541 0.471 1 1 231 . 20 1 1 A 23 23 GLN H H 23 7.621 7.901 -0.280 1 1 232 . 20 1 1 A 23 23 GLN HA H 23 4.232 4.019 0.213 1 1 238 . 20 1 1 A 23 23 GLN C C 23 180.543 179.020 1.523 1 1 239 . 20 1 1 A 23 23 GLN CA C 23 59.434 59.132 0.302 1 1 240 . 20 1 1 A 23 23 GLN CB C 23 28.749 28.386 0.363 1 1 242 . 20 1 1 A 23 23 GLN N N 23 117.823 117.830 -0.007 1 1 244 . 20 1 1 A 24 24 GLU H H 24 8.165 7.937 0.228 1 1 245 . 20 1 1 A 24 24 GLU HA H 24 4.072 4.125 -0.053 1 1 249 . 20 1 1 A 24 24 GLU C C 24 178.612 178.360 0.252 1 1 250 . 20 1 1 A 24 24 GLU CA C 24 59.236 59.243 -0.007 1 1 251 . 20 1 1 A 24 24 GLU CB C 24 29.606 28.872 0.734 1 1 253 . 20 1 1 A 24 24 GLU N N 24 122.589 118.756 3.833 1 1 254 . 20 1 1 A 25 25 LEU H H 25 7.911 7.848 0.063 1 1 255 . 20 1 1 A 25 25 LEU HA H 25 4.214 4.102 0.112 1 1 265 . 20 1 1 A 25 25 LEU C C 25 176.745 176.864 -0.119 1 1 266 . 20 1 1 A 25 25 LEU CA C 25 55.659 55.889 -0.230 1 1 267 . 20 1 1 A 25 25 LEU CB C 25 43.109 42.784 0.325 1 1 271 . 20 1 1 A 25 25 LEU N N 25 117.882 119.410 -1.528 1 1 272 . 20 1 1 A 26 26 GLY H H 26 7.776 7.728 0.048 1 1 273 . 20 1 1 A 26 26 GLY HA2 H 26 4.337 4.073 0.264 1 1 274 . 20 1 1 A 26 26 GLY HA3 H 26 3.856 4.082 -0.226 1 1 275 . 20 1 1 A 26 26 GLY C C 26 175.456 174.600 0.856 1 1 276 . 20 1 1 A 26 26 GLY CA C 26 44.875 45.071 -0.196 1 1 277 . 20 1 1 A 26 26 GLY N N 26 104.938 105.349 -0.411 1 1 278 . 20 1 1 A 27 27 ALA H H 27 8.104 8.022 0.082 1 1 279 . 20 1 1 A 27 27 ALA HA H 27 4.949 4.707 0.242 1 1 283 . 20 1 1 A 27 27 ALA C C 27 176.448 176.764 -0.316 1 1 284 . 20 1 1 A 27 27 ALA CA C 27 52.183 52.398 -0.215 1 1 285 . 20 1 1 A 27 27 ALA CB C 27 21.814 19.564 2.250 1 1 286 . 20 1 1 A 27 27 ALA N N 27 123.263 124.099 -0.836 1 1 287 . 20 1 1 A 28 28 THR H H 28 9.369 8.976 0.393 1 1 288 . 20 1 1 A 28 28 THR HA H 28 4.779 5.102 -0.323 1 1 293 . 20 1 1 A 28 28 THR C C 28 173.725 173.902 -0.177 1 1 294 . 20 1 1 A 28 28 THR CA C 28 60.046 60.638 -0.592 1 1 295 . 20 1 1 A 28 28 THR CB C 28 70.592 70.966 -0.374 1 1 297 . 20 1 1 A 28 28 THR N N 28 112.201 118.572 -6.371 1 1 298 . 20 1 1 A 29 29 LEU H H 29 8.518 8.552 -0.034 1 1 299 . 20 1 1 A 29 29 LEU HA H 29 3.332 3.725 -0.393 1 1 309 . 20 1 1 A 29 29 LEU C C 29 176.202 175.658 0.544 1 1 310 . 20 1 1 A 29 29 LEU CA C 29 55.031 55.031 0.000 1 1 311 . 20 1 1 A 29 29 LEU CB C 29 40.624 41.742 -1.118 1 1 315 . 20 1 1 A 29 29 LEU N N 29 128.151 127.608 0.543 1 1 316 . 20 1 1 A 30 30 GLU H H 30 9.269 9.266 0.003 1 1 317 . 20 1 1 A 30 30 GLU HA H 30 4.287 4.417 -0.130 1 1 321 . 20 1 1 A 30 30 GLU C C 30 176.740 176.445 0.295 1 1 322 . 20 1 1 A 30 30 GLU CA C 30 57.283 58.166 -0.883 1 1 323 . 20 1 1 A 30 30 GLU CB C 30 31.045 31.006 0.039 1 1 325 . 20 1 1 A 30 30 GLU N N 30 130.123 125.679 4.444 1 1 326 . 20 1 1 A 31 31 HIS H H 31 7.341 7.134 0.207 1 1 327 . 20 1 1 A 31 31 HIS HA H 31 4.701 4.763 -0.062 1 1 331 . 20 1 1 A 31 31 HIS C C 31 172.581 172.839 -0.258 1 1 332 . 20 1 1 A 31 31 HIS CA C 31 55.876 55.605 0.271 1 1 333 . 20 1 1 A 31 31 HIS CB C 31 33.434 33.036 0.398 1 1 334 . 20 1 1 A 31 31 HIS N N 31 113.223 116.533 -3.310 1 1 335 . 20 1 1 A 32 32 ARG H H 32 8.196 8.197 -0.001 1 1 336 . 20 1 1 A 32 32 ARG HA H 32 5.262 4.793 0.469 1 1 341 . 20 1 1 A 32 32 ARG C C 32 174.377 174.279 0.098 1 1 342 . 20 1 1 A 32 32 ARG CA C 32 55.808 54.801 1.007 1 1 343 . 20 1 1 A 32 32 ARG CB C 32 33.340 33.777 -0.437 1 1 345 . 20 1 1 A 32 32 ARG N N 32 123.003 126.249 -3.246 1 1 346 . 20 1 1 A 33 33 VAL H H 33 8.956 9.280 -0.324 1 1 347 . 20 1 1 A 33 33 VAL HA H 33 4.734 4.687 0.047 1 1 355 . 20 1 1 A 33 33 VAL C C 33 172.821 174.603 -1.782 1 1 356 . 20 1 1 A 33 33 VAL CA C 33 60.197 59.649 0.548 1 1 357 . 20 1 1 A 33 33 VAL CB C 33 35.860 34.008 1.852 1 1 360 . 20 1 1 A 33 33 VAL N N 33 122.929 121.099 1.830 1 1 361 . 20 1 1 A 34 34 THR H H 34 8.250 8.405 -0.155 1 1 362 . 20 1 1 A 34 34 THR HA H 34 5.616 4.998 0.618 1 1 367 . 20 1 1 A 34 34 THR C C 34 173.913 172.973 0.940 1 1 368 . 20 1 1 A 34 34 THR CA C 34 60.245 60.194 0.051 1 1 369 . 20 1 1 A 34 34 THR CB C 34 71.706 71.125 0.581 1 1 371 . 20 1 1 A 34 34 THR N N 34 119.164 115.570 3.594 1 1 372 . 20 1 1 A 35 35 PHE H H 35 8.565 8.358 0.207 1 1 373 . 20 1 1 A 35 35 PHE HA H 35 5.029 5.059 -0.030 1 1 378 . 20 1 1 A 35 35 PHE C C 35 173.193 172.839 0.354 1 1 379 . 20 1 1 A 35 35 PHE CA C 35 55.687 56.163 -0.476 1 1 380 . 20 1 1 A 35 35 PHE CB C 35 40.853 40.815 0.038 1 1 383 . 20 1 1 A 35 35 PHE N N 35 120.244 118.372 1.872 1 1 384 . 20 1 1 A 36 36 ARG H H 36 8.869 8.783 0.086 1 1 385 . 20 1 1 A 36 36 ARG HA H 36 4.982 5.111 -0.129 1 1 387 . 20 1 1 A 36 36 ARG C C 36 174.743 174.282 0.461 1 1 388 . 20 1 1 A 36 36 ARG CA C 36 55.493 54.472 1.021 1 1 389 . 20 1 1 A 36 36 ARG CB C 36 32.228 33.593 -1.365 1 1 390 . 20 1 1 A 36 36 ARG N N 36 123.893 118.893 5.000 1 1 391 . 20 1 1 A 37 37 ASP H H 37 8.402 9.069 -0.667 1 1 392 . 20 1 1 A 37 37 ASP HA H 37 5.462 5.343 0.119 1 1 395 . 20 1 1 A 37 37 ASP C C 37 175.177 174.879 0.298 1 1 396 . 20 1 1 A 37 37 ASP CA C 37 53.942 52.892 1.050 1 1 397 . 20 1 1 A 37 37 ASP CB C 37 45.486 43.184 2.302 1 1 398 . 20 1 1 A 37 37 ASP N N 37 127.149 124.566 2.583 1 1 399 . 20 1 1 A 38 38 THR H H 38 8.151 9.104 -0.953 1 1 400 . 20 1 1 A 38 38 THR HA H 38 4.866 5.413 -0.547 1 1 405 . 20 1 1 A 38 38 THR C C 38 172.792 173.427 -0.635 1 1 406 . 20 1 1 A 38 38 THR CA C 38 61.416 60.831 0.585 1 1 407 . 20 1 1 A 38 38 THR CB C 38 71.047 70.268 0.779 1 1 409 . 20 1 1 A 38 38 THR N N 38 115.686 115.953 -0.267 1 1 410 . 20 1 1 A 39 39 TYR H H 39 9.021 9.770 -0.749 1 1 411 . 20 1 1 A 39 39 TYR HA H 39 5.544 5.678 -0.134 1 1 416 . 20 1 1 A 39 39 TYR C C 39 176.032 174.635 1.397 1 1 417 . 20 1 1 A 39 39 TYR CA C 39 57.184 56.666 0.518 1 1 418 . 20 1 1 A 39 39 TYR CB C 39 41.642 41.258 0.384 1 1 420 . 20 1 1 A 39 39 TYR N N 39 124.579 124.373 0.206 1 1 421 . 20 1 1 A 40 40 TYR H H 40 8.487 9.318 -0.831 1 1 422 . 20 1 1 A 40 40 TYR HA H 40 5.517 5.851 -0.334 1 1 426 . 20 1 1 A 40 40 TYR C C 40 174.108 174.184 -0.076 1 1 427 . 20 1 1 A 40 40 TYR CA C 40 56.979 56.524 0.455 1 1 428 . 20 1 1 A 40 40 TYR CB C 40 44.132 43.725 0.407 1 1 431 . 20 1 1 A 40 40 TYR N N 40 119.709 120.879 -1.170 1 1 432 . 20 1 1 A 41 41 ASP H H 41 9.341 8.708 0.633 1 1 433 . 20 1 1 A 41 41 ASP HA H 41 4.866 5.165 -0.299 1 1 436 . 20 1 1 A 41 41 ASP C C 41 177.262 174.804 2.458 1 1 437 . 20 1 1 A 41 41 ASP CA C 41 53.445 53.430 0.015 1 1 438 . 20 1 1 A 41 41 ASP CB C 41 45.347 44.628 0.719 1 1 439 . 20 1 1 A 41 41 ASP N N 41 117.995 120.287 -2.292 1 1 440 . 20 1 1 A 42 42 THR H H 42 11.574 8.672 2.902 1 1 441 . 20 1 1 A 42 42 THR HA H 42 5.206 4.492 0.714 1 1 446 . 20 1 1 A 42 42 THR C C 42 177.935 176.282 1.653 1 1 447 . 20 1 1 A 42 42 THR CA C 42 60.400 61.148 -0.748 1 1 448 . 20 1 1 A 42 42 THR CB C 42 72.114 70.910 1.204 1 1 450 . 20 1 1 A 42 42 THR N N 42 114.394 114.686 -0.292 1 1 451 . 20 1 1 A 43 43 SER H H 43 9.715 8.842 0.873 1 1 452 . 20 1 1 A 43 43 SER HA H 43 4.252 4.229 0.023 1 1 455 . 20 1 1 A 43 43 SER C C 43 175.478 174.638 0.840 1 1 456 . 20 1 1 A 43 43 SER CA C 43 61.277 60.717 0.560 1 1 457 . 20 1 1 A 43 43 SER CB C 43 62.821 62.951 -0.130 1 1 458 . 20 1 1 A 43 43 SER N N 43 116.674 116.251 0.423 1 1 459 . 20 1 1 A 44 44 GLU H H 44 7.674 7.892 -0.218 1 1 460 . 20 1 1 A 44 44 GLU HA H 44 4.330 4.400 -0.070 1 1 464 . 20 1 1 A 44 44 GLU C C 44 175.001 176.128 -1.127 1 1 465 . 20 1 1 A 44 44 GLU CA C 44 55.992 55.208 0.784 1 1 466 . 20 1 1 A 44 44 GLU CB C 44 29.276 29.297 -0.021 1 1 468 . 20 1 1 A 44 44 GLU N N 44 117.856 118.350 -0.494 1 1 469 . 20 1 1 A 45 45 LEU H H 45 8.222 8.033 0.189 1 1 470 . 20 1 1 A 45 45 LEU HA H 45 3.901 4.067 -0.166 1 1 480 . 20 1 1 A 45 45 LEU C C 45 175.209 176.401 -1.192 1 1 481 . 20 1 1 A 45 45 LEU CA C 45 55.548 56.368 -0.820 1 1 482 . 20 1 1 A 45 45 LEU CB C 45 38.458 39.449 -0.991 1 1 485 . 20 1 1 A 45 45 LEU N N 45 119.335 116.423 2.912 1 1 486 . 20 1 1 A 46 46 SER H H 46 7.347 7.967 -0.620 1 1 487 . 20 1 1 A 46 46 SER HA H 46 3.954 4.127 -0.173 1 1 489 . 20 1 1 A 46 46 SER C C 46 177.497 176.109 1.388 1 1 490 . 20 1 1 A 46 46 SER CA C 46 62.471 62.328 0.143 1 1 491 . 20 1 1 A 46 46 SER CB C 46 63.908 62.866 1.042 1 1 492 . 20 1 1 A 46 46 SER N N 46 111.433 114.233 -2.800 1 1 493 . 20 1 1 A 47 47 LEU H H 47 12.003 8.235 3.768 1 1 494 . 20 1 1 A 47 47 LEU HA H 47 3.959 4.111 -0.152 1 1 504 . 20 1 1 A 47 47 LEU C C 47 180.340 178.198 2.142 1 1 505 . 20 1 1 A 47 47 LEU CA C 47 58.879 58.122 0.757 1 1 506 . 20 1 1 A 47 47 LEU CB C 47 39.572 41.922 -2.350 1 1 510 . 20 1 1 A 47 47 LEU N N 47 124.605 122.594 2.011 1 1 511 . 20 1 1 A 48 48 MET H H 48 10.599 8.097 2.502 1 1 512 . 20 1 1 A 48 48 MET HA H 48 3.213 3.997 -0.784 1 1 520 . 20 1 1 A 48 48 MET C C 48 181.177 178.492 2.685 1 1 521 . 20 1 1 A 48 48 MET CA C 48 60.747 58.352 2.395 1 1 522 . 20 1 1 A 48 48 MET CB C 48 32.594 31.526 1.068 1 1 525 . 20 1 1 A 48 48 MET N N 48 126.254 116.766 9.488 1 1 526 . 20 1 1 A 49 49 LEU H H 49 8.731 7.868 0.863 1 1 527 . 20 1 1 A 49 49 LEU HA H 49 4.097 3.974 0.123 1 1 536 . 20 1 1 A 49 49 LEU C C 49 178.144 177.478 0.666 1 1 537 . 20 1 1 A 49 49 LEU CA C 49 57.800 57.349 0.451 1 1 538 . 20 1 1 A 49 49 LEU CB C 49 41.379 41.424 -0.045 1 1 541 . 20 1 1 A 49 49 LEU N N 49 119.183 121.175 -1.992 1 1 542 . 20 1 1 A 50 50 SER H H 50 7.853 7.191 0.662 1 1 543 . 20 1 1 A 50 50 SER HA H 50 4.822 4.542 0.280 1 1 546 . 20 1 1 A 50 50 SER C C 50 174.539 172.780 1.759 1 1 547 . 20 1 1 A 50 50 SER CA C 50 57.811 58.233 -0.422 1 1 548 . 20 1 1 A 50 50 SER CB C 50 64.443 63.329 1.114 1 1 549 . 20 1 1 A 50 50 SER N N 50 114.594 112.354 2.240 1 1 550 . 20 1 1 A 51 51 ASP H H 51 8.264 7.761 0.503 1 1 551 . 20 1 1 A 51 51 ASP HA H 51 4.362 4.170 0.192 1 1 554 . 20 1 1 A 51 51 ASP C C 51 172.921 174.676 -1.755 1 1 555 . 20 1 1 A 51 51 ASP CA C 51 55.343 55.444 -0.101 1 1 556 . 20 1 1 A 51 51 ASP CB C 51 40.583 39.522 1.061 1 1 557 . 20 1 1 A 51 51 ASP N N 51 123.003 117.375 5.628 1 1 558 . 20 1 1 A 52 52 HIS H H 52 7.869 7.249 0.620 1 1 559 . 20 1 1 A 52 52 HIS HA H 52 5.335 5.552 -0.217 1 1 564 . 20 1 1 A 52 52 HIS C C 52 173.991 173.739 0.252 1 1 565 . 20 1 1 A 52 52 HIS CA C 52 55.889 54.293 1.596 1 1 566 . 20 1 1 A 52 52 HIS CB C 52 31.789 30.239 1.550 1 1 568 . 20 1 1 A 52 52 HIS N N 52 112.486 117.352 -4.866 1 1 569 . 20 1 1 A 53 53 TRP H H 53 8.165 8.720 -0.555 1 1 570 . 20 1 1 A 53 53 TRP HA H 53 4.926 5.309 -0.383 1 1 578 . 20 1 1 A 53 53 TRP C C 53 175.354 175.552 -0.198 1 1 579 . 20 1 1 A 53 53 TRP CA C 53 55.364 56.124 -0.760 1 1 580 . 20 1 1 A 53 53 TRP CB C 53 30.641 30.825 -0.184 1 1 585 . 20 1 1 A 53 53 TRP N N 53 117.916 125.340 -7.424 1 1 587 . 20 1 1 A 54 54 LEU H H 54 10.088 9.247 0.841 1 1 588 . 20 1 1 A 54 54 LEU HA H 54 5.497 5.363 0.134 1 1 598 . 20 1 1 A 54 54 LEU C C 54 173.337 175.802 -2.465 1 1 599 . 20 1 1 A 54 54 LEU CA C 54 54.408 54.321 0.087 1 1 600 . 20 1 1 A 54 54 LEU CB C 54 44.156 44.837 -0.681 1 1 604 . 20 1 1 A 54 54 LEU N N 54 130.826 126.872 3.954 1 1 605 . 20 1 1 A 55 55 ARG H H 55 9.289 9.580 -0.291 1 1 606 . 20 1 1 A 55 55 ARG HA H 55 5.482 5.177 0.305 1 1 612 . 20 1 1 A 55 55 ARG C C 55 174.057 174.178 -0.121 1 1 613 . 20 1 1 A 55 55 ARG CA C 55 53.167 53.846 -0.679 1 1 614 . 20 1 1 A 55 55 ARG CB C 55 34.270 34.129 0.141 1 1 616 . 20 1 1 A 55 55 ARG N N 55 125.089 124.755 0.334 1 1 618 . 20 1 1 A 56 56 GLN H H 56 9.092 8.739 0.353 1 1 619 . 20 1 1 A 56 56 GLN HA H 56 3.991 4.689 -0.698 1 1 626 . 20 1 1 A 56 56 GLN C C 56 174.199 174.212 -0.013 1 1 627 . 20 1 1 A 56 56 GLN CA C 56 54.566 54.392 0.174 1 1 628 . 20 1 1 A 56 56 GLN CB C 56 29.643 31.669 -2.026 1 1 630 . 20 1 1 A 56 56 GLN N N 56 124.355 119.082 5.273 1 1 632 . 20 1 1 A 57 57 ARG H H 57 8.440 8.014 0.426 1 1 633 . 20 1 1 A 57 57 ARG HA H 57 5.316 4.318 0.998 1 1 639 . 20 1 1 A 57 57 ARG C C 57 176.188 176.408 -0.220 1 1 640 . 20 1 1 A 57 57 ARG CA C 57 53.940 55.846 -1.906 1 1 641 . 20 1 1 A 57 57 ARG CB C 57 32.426 29.059 3.367 1 1 643 . 20 1 1 A 57 57 ARG N N 57 130.222 124.903 5.319 1 1 645 . 20 1 1 A 58 58 GLU H H 58 8.891 8.716 0.175 1 1 646 . 20 1 1 A 58 58 GLU HA H 58 3.996 4.138 -0.142 1 1 649 . 20 1 1 A 58 58 GLU CA C 58 58.364 58.462 -0.098 1 1 650 . 20 1 1 A 58 58 GLU CB C 58 30.875 29.158 1.717 1 1 651 . 20 1 1 A 58 58 GLU N N 58 131.208 121.903 9.305 1 1 652 . 20 1 1 A 59 59 GLY H H 59 8.367 7.983 0.384 1 1 653 . 20 1 1 A 59 59 GLY HA2 H 59 4.334 3.957 0.377 1 1 654 . 20 1 1 A 59 59 GLY HA3 H 59 3.743 4.053 -0.310 1 1 655 . 20 1 1 A 59 59 GLY C C 59 174.194 175.013 -0.819 1 1 656 . 20 1 1 A 59 59 GLY CA C 59 45.666 45.519 0.147 1 1 657 . 20 1 1 A 60 60 SER H H 60 8.071 8.210 -0.139 1 1 658 . 20 1 1 A 60 60 SER HA H 60 4.730 4.403 0.327 1 1 661 . 20 1 1 A 60 60 SER C C 60 173.908 174.337 -0.429 1 1 662 . 20 1 1 A 60 60 SER CA C 60 58.762 59.011 -0.249 1 1 663 . 20 1 1 A 60 60 SER CB C 60 64.497 64.314 0.183 1 1 664 . 20 1 1 A 60 60 SER N N 60 114.636 115.398 -0.762 1 1 665 . 20 1 1 A 61 61 GLY H H 61 8.401 7.555 0.846 1 1 666 . 20 1 1 A 61 61 GLY HA2 H 61 4.560 3.969 0.591 1 1 667 . 20 1 1 A 61 61 GLY HA3 H 61 3.878 4.005 -0.127 1 1 668 . 20 1 1 A 61 61 GLY C C 61 173.526 171.678 1.848 1 1 669 . 20 1 1 A 61 61 GLY CA C 61 44.906 45.890 -0.984 1 1 670 . 20 1 1 A 61 61 GLY N N 61 109.421 106.638 2.783 1 1 671 . 20 1 1 A 62 62 TRP H H 62 8.861 8.580 0.281 1 1 672 . 20 1 1 A 62 62 TRP HA H 62 5.089 5.178 -0.089 1 1 681 . 20 1 1 A 62 62 TRP C C 62 176.168 176.011 0.157 1 1 682 . 20 1 1 A 62 62 TRP CA C 62 57.459 57.383 0.076 1 1 683 . 20 1 1 A 62 62 TRP CB C 62 32.536 31.660 0.876 1 1 689 . 20 1 1 A 62 62 TRP N N 62 122.939 122.772 0.167 1 1 691 . 20 1 1 A 63 63 GLU H H 63 9.306 9.308 -0.002 1 1 692 . 20 1 1 A 63 63 GLU HA H 63 4.919 5.080 -0.161 1 1 697 . 20 1 1 A 63 63 GLU C C 63 173.770 174.249 -0.479 1 1 698 . 20 1 1 A 63 63 GLU CA C 63 55.953 55.527 0.426 1 1 699 . 20 1 1 A 63 63 GLU CB C 63 35.317 33.386 1.931 1 1 701 . 20 1 1 A 63 63 GLU N N 63 120.136 121.758 -1.622 1 1 702 . 20 1 1 A 64 64 LEU H H 64 8.998 9.590 -0.592 1 1 703 . 20 1 1 A 64 64 LEU HA H 64 5.616 5.527 0.089 1 1 712 . 20 1 1 A 64 64 LEU C C 64 175.014 173.906 1.108 1 1 713 . 20 1 1 A 64 64 LEU CA C 64 52.945 53.656 -0.711 1 1 714 . 20 1 1 A 64 64 LEU CB C 64 46.904 46.088 0.816 1 1 717 . 20 1 1 A 64 64 LEU N N 64 127.321 128.711 -1.390 1 1 718 . 20 1 1 A 65 65 LYS H H 65 9.322 9.782 -0.460 1 1 719 . 20 1 1 A 65 65 LYS HA H 65 5.347 5.257 0.090 1 1 727 . 20 1 1 A 65 65 LYS C C 65 175.811 175.280 0.531 1 1 728 . 20 1 1 A 65 65 LYS CA C 65 55.817 55.394 0.423 1 1 729 . 20 1 1 A 65 65 LYS CB C 65 34.521 34.341 0.180 1 1 733 . 20 1 1 A 65 65 LYS N N 65 129.874 128.459 1.415 1 1 734 . 20 1 1 A 66 66 CYS H H 66 9.129 9.291 -0.162 1 1 735 . 20 1 1 A 66 66 CYS HA H 66 5.319 4.888 0.431 1 1 738 . 20 1 1 A 66 66 CYS CA C 66 54.532 56.959 -2.427 1 1 739 . 20 1 1 A 66 66 CYS CB C 66 28.813 30.954 -2.141 1 1 740 . 20 1 1 A 66 66 CYS N N 66 121.497 124.919 -3.422 1 1 741 . 20 1 1 A 67 67 PRO HA H 67 4.439 4.049 0.390 1 1 748 . 20 1 1 A 67 67 PRO C C 67 177.297 177.801 -0.504 1 1 749 . 20 1 1 A 67 67 PRO CA C 67 63.596 63.267 0.329 1 1 750 . 20 1 1 A 67 67 PRO CB C 67 32.242 31.833 0.409 1 1 752 . 20 1 1 A 68 68 GLY H H 68 8.316 8.200 0.116 1 1 753 . 20 1 1 A 68 68 GLY HA2 H 68 3.726 3.935 -0.209 1 1 754 . 20 1 1 A 68 68 GLY HA3 H 68 4.095 3.964 0.131 1 1 755 . 20 1 1 A 68 68 GLY C C 68 173.789 173.534 0.255 1 1 756 . 20 1 1 A 68 68 GLY CA C 68 45.227 45.330 -0.103 1 1 757 . 20 1 1 A 68 68 GLY N N 68 109.533 110.371 -0.838 1 1 758 . 20 1 1 A 69 69 VAL H H 69 8.114 7.807 0.307 1 1 759 . 20 1 1 A 69 69 VAL HA H 69 4.266 4.311 -0.045 1 1 764 . 20 1 1 A 69 69 VAL C C 69 176.299 175.646 0.653 1 1 765 . 20 1 1 A 69 69 VAL CA C 69 61.945 61.234 0.711 1 1 766 . 20 1 1 A 69 69 VAL CB C 69 33.082 34.095 -1.013 1 1 768 . 20 1 1 A 69 69 VAL N N 69 118.540 121.682 -3.142 1 1 769 . 20 1 1 A 70 70 THR H H 70 8.324 8.959 -0.635 1 1 770 . 20 1 1 A 70 70 THR HA H 70 4.373 4.271 0.102 1 1 775 . 20 1 1 A 70 70 THR C C 70 175.204 175.331 -0.127 1 1 776 . 20 1 1 A 70 70 THR CA C 70 62.309 65.825 -3.516 1 1 777 . 20 1 1 A 70 70 THR CB C 70 69.787 68.995 0.792 1 1 779 . 20 1 1 A 70 70 THR N N 70 117.636 121.579 -3.943 1 1 780 . 20 1 1 A 71 71 GLY H H 71 8.574 7.470 1.104 1 1 781 . 20 1 1 A 71 71 GLY HA2 H 71 4.096 4.136 -0.040 1 1 782 . 20 1 1 A 71 71 GLY HA3 H 71 3.975 4.168 -0.193 1 1 783 . 20 1 1 A 71 71 GLY C C 71 174.313 175.474 -1.161 1 1 784 . 20 1 1 A 71 71 GLY CA C 71 45.545 45.344 0.201 1 1 785 . 20 1 1 A 71 71 GLY N N 71 111.677 107.169 4.508 1 1 786 . 20 1 1 A 72 72 VAL H H 72 7.945 8.072 -0.127 1 1 787 . 20 1 1 A 72 72 VAL HA H 72 4.258 4.162 0.096 1 1 795 . 20 1 1 A 72 72 VAL C C 72 176.162 176.314 -0.152 1 1 796 . 20 1 1 A 72 72 VAL CA C 72 62.227 63.361 -1.134 1 1 797 . 20 1 1 A 72 72 VAL CB C 72 32.997 33.083 -0.086 1 1 799 . 20 1 1 A 72 72 VAL N N 72 118.647 116.896 1.751 1 1 800 . 20 1 1 A 73 73 SER H H 73 8.498 8.169 0.329 1 1 801 . 20 1 1 A 73 73 SER HA H 73 4.617 4.513 0.104 1 1 803 . 20 1 1 A 73 73 SER C C 73 174.461 174.181 0.280 1 1 804 . 20 1 1 A 73 73 SER CA C 73 58.218 59.716 -1.498 1 1 805 . 20 1 1 A 73 73 SER CB C 73 64.061 62.222 1.839 1 1 806 . 20 1 1 A 73 73 SER N N 73 118.828 115.067 3.761 1 1 807 . 20 1 1 A 74 74 GLY H H 74 8.247 8.349 -0.102 1 1 808 . 20 1 1 A 74 74 GLY HA2 H 74 4.101 4.144 -0.043 1 1 809 . 20 1 1 A 74 74 GLY HA3 H 74 4.304 4.146 0.158 1 1 810 . 20 1 1 A 74 74 GLY CA C 74 44.896 45.263 -0.367 1 1 811 . 20 1 1 A 74 74 GLY N N 74 111.138 109.867 1.271 1 1 812 . 20 1 1 A 75 75 PRO HA H 75 4.461 4.584 -0.123 1 1 819 . 20 1 1 A 75 75 PRO C C 75 176.798 176.131 0.667 1 1 820 . 20 1 1 A 75 75 PRO CA C 75 63.466 62.375 1.091 1 1 821 . 20 1 1 A 75 75 PRO CB C 75 31.980 33.040 -1.060 1 1 824 . 20 1 1 A 76 76 HIS H H 76 8.397 8.359 0.038 1 1 825 . 20 1 1 A 76 76 HIS HA H 76 4.742 5.387 -0.645 1 1 829 . 20 1 1 A 76 76 HIS C C 76 174.282 175.535 -1.253 1 1 830 . 20 1 1 A 76 76 HIS CA C 76 55.579 53.317 2.262 1 1 831 . 20 1 1 A 76 76 HIS CB C 76 30.501 32.293 -1.792 1 1 832 . 20 1 1 A 76 76 HIS N N 76 118.431 116.610 1.821 1 1 833 . 20 1 1 A 77 77 ASN H H 77 8.364 8.809 -0.445 1 1 834 . 20 1 1 A 77 77 ASN HA H 77 4.767 4.758 0.009 1 1 839 . 20 1 1 A 77 77 ASN C C 77 174.576 175.106 -0.530 1 1 840 . 20 1 1 A 77 77 ASN CA C 77 53.139 52.863 0.276 1 1 841 . 20 1 1 A 77 77 ASN CB C 77 39.320 38.439 0.881 1 1 842 . 20 1 1 A 77 77 ASN N N 77 119.421 120.343 -0.922 1 1 844 . 20 1 1 A 78 78 GLU H H 78 8.683 8.135 0.548 1 1 845 . 20 1 1 A 78 78 GLU HA H 78 4.409 4.379 0.030 1 1 850 . 20 1 1 A 78 78 GLU C C 78 175.791 175.099 0.692 1 1 851 . 20 1 1 A 78 78 GLU CA C 78 56.359 58.607 -2.248 1 1 852 . 20 1 1 A 78 78 GLU CB C 78 30.818 28.804 2.014 1 1 854 . 20 1 1 A 78 78 GLU N N 78 122.085 115.245 6.840 1 1 855 . 20 1 1 A 79 79 TYR H H 79 8.341 8.704 -0.363 1 1 856 . 20 1 1 A 79 79 TYR HA H 79 4.988 5.330 -0.342 1 1 861 . 20 1 1 A 79 79 TYR C C 79 175.837 175.895 -0.058 1 1 862 . 20 1 1 A 79 79 TYR CA C 79 58.028 59.628 -1.600 1 1 863 . 20 1 1 A 79 79 TYR CB C 79 41.672 38.967 2.705 1 1 866 . 20 1 1 A 79 79 TYR N N 79 119.452 122.990 -3.538 1 1 867 . 20 1 1 A 80 80 VAL H H 80 9.366 9.526 -0.160 1 1 868 . 20 1 1 A 80 80 VAL HA H 80 4.370 4.957 -0.587 1 1 873 . 20 1 1 A 80 80 VAL C C 80 174.948 174.556 0.392 1 1 874 . 20 1 1 A 80 80 VAL CA C 80 61.190 59.604 1.586 1 1 875 . 20 1 1 A 80 80 VAL CB C 80 34.204 34.184 0.020 1 1 877 . 20 1 1 A 80 80 VAL N N 80 120.567 119.215 1.352 1 1 878 . 20 1 1 A 81 81 GLU H H 81 8.570 9.012 -0.442 1 1 879 . 20 1 1 A 81 81 GLU HA H 81 4.770 5.226 -0.456 1 1 883 . 20 1 1 A 81 81 GLU C C 81 175.491 175.399 0.092 1 1 884 . 20 1 1 A 81 81 GLU CA C 81 55.655 54.793 0.862 1 1 885 . 20 1 1 A 81 81 GLU CB C 81 30.415 32.769 -2.354 1 1 887 . 20 1 1 A 81 81 GLU N N 81 124.248 122.045 2.203 1 1 888 . 20 1 1 A 82 82 VAL H H 82 9.189 9.587 -0.398 1 1 889 . 20 1 1 A 82 82 VAL HA H 82 4.279 4.403 -0.124 1 1 894 . 20 1 1 A 82 82 VAL C C 82 176.087 176.265 -0.178 1 1 895 . 20 1 1 A 82 82 VAL CA C 82 62.672 62.000 0.672 1 1 896 . 20 1 1 A 82 82 VAL CB C 82 33.121 32.700 0.421 1 1 898 . 20 1 1 A 82 82 VAL N N 82 127.776 124.716 3.060 1 1 899 . 20 1 1 A 83 83 THR H H 83 8.590 8.660 -0.070 1 1 900 . 20 1 1 A 83 83 THR HA H 83 4.955 4.544 0.411 1 1 905 . 20 1 1 A 83 83 THR C C 83 174.688 174.671 0.017 1 1 906 . 20 1 1 A 83 83 THR CA C 83 61.332 61.548 -0.216 1 1 907 . 20 1 1 A 83 83 THR CB C 83 70.213 69.975 0.238 1 1 909 . 20 1 1 A 83 83 THR N N 83 114.744 118.400 -3.656 1 1 910 . 20 1 1 A 84 84 SER H H 84 7.650 7.475 0.175 1 1 911 . 20 1 1 A 84 84 SER HA H 84 4.819 4.456 0.363 1 1 914 . 20 1 1 A 84 84 SER CA C 84 56.280 59.643 -3.363 1 1 915 . 20 1 1 A 84 84 SER CB C 84 63.294 63.513 -0.219 1 1 916 . 20 1 1 A 84 84 SER N N 84 118.038 118.231 -0.193 1 1 917 . 20 1 1 A 85 85 GLU H H 85 8.391 8.762 -0.371 1 1 918 . 20 1 1 A 85 85 GLU HA H 85 3.661 3.924 -0.263 1 1 923 . 20 1 1 A 85 85 GLU C C 85 177.520 178.420 -0.900 1 1 924 . 20 1 1 A 85 85 GLU CA C 85 62.429 59.584 2.845 1 1 925 . 20 1 1 A 85 85 GLU CB C 85 29.655 29.399 0.256 1 1 927 . 20 1 1 A 86 86 ALA H H 86 8.443 8.159 0.284 1 1 928 . 20 1 1 A 86 86 ALA HA H 86 4.027 4.033 -0.006 1 1 932 . 20 1 1 A 86 86 ALA C C 86 180.423 180.032 0.391 1 1 933 . 20 1 1 A 86 86 ALA CA C 86 55.145 54.819 0.326 1 1 934 . 20 1 1 A 86 86 ALA CB C 86 18.165 18.113 0.052 1 1 935 . 20 1 1 A 86 86 ALA N N 86 119.636 122.917 -3.281 1 1 936 . 20 1 1 A 87 87 ALA H H 87 7.214 7.395 -0.181 1 1 937 . 20 1 1 A 87 87 ALA HA H 87 4.244 4.040 0.204 1 1 941 . 20 1 1 A 87 87 ALA C C 87 180.354 179.701 0.653 1 1 942 . 20 1 1 A 87 87 ALA CA C 87 54.378 55.019 -0.641 1 1 943 . 20 1 1 A 87 87 ALA CB C 87 18.795 18.713 0.082 1 1 944 . 20 1 1 A 87 87 ALA N N 87 121.004 120.366 0.638 1 1 945 . 20 1 1 A 88 88 ILE H H 88 8.471 7.592 0.879 1 1 946 . 20 1 1 A 88 88 ILE HA H 88 3.360 3.570 -0.210 1 1 954 . 20 1 1 A 88 88 ILE CA C 88 66.323 64.468 1.855 1 1 955 . 20 1 1 A 88 88 ILE CB C 88 37.808 37.840 -0.032 1 1 958 . 20 1 1 A 88 88 ILE N N 88 120.743 120.076 0.667 1 1 959 . 20 1 1 A 89 89 VAL H H 89 8.343 8.261 0.082 1 1 960 . 20 1 1 A 89 89 VAL HA H 89 3.061 3.443 -0.382 1 1 968 . 20 1 1 A 89 89 VAL C C 89 176.708 177.643 -0.935 1 1 969 . 20 1 1 A 89 89 VAL CA C 89 67.833 66.560 1.273 1 1 970 . 20 1 1 A 89 89 VAL CB C 89 31.509 31.331 0.178 1 1 973 . 20 1 1 A 89 89 VAL N N 89 118.049 119.946 -1.897 1 1 974 . 20 1 1 A 90 90 ALA H H 90 7.516 7.853 -0.337 1 1 975 . 20 1 1 A 90 90 ALA HA H 90 3.987 3.769 0.218 1 1 979 . 20 1 1 A 90 90 ALA C C 90 180.744 179.057 1.687 1 1 980 . 20 1 1 A 90 90 ALA CA C 90 55.481 55.397 0.084 1 1 981 . 20 1 1 A 90 90 ALA CB C 90 17.953 17.727 0.226 1 1 982 . 20 1 1 A 90 90 ALA N N 90 118.935 120.977 -2.042 1 1 983 . 20 1 1 A 91 91 GLN H H 91 7.886 8.190 -0.304 1 1 984 . 20 1 1 A 91 91 GLN HA H 91 4.190 3.993 0.197 1 1 991 . 20 1 1 A 91 91 GLN C C 91 178.832 178.403 0.429 1 1 992 . 20 1 1 A 91 91 GLN CA C 91 58.519 58.788 -0.269 1 1 993 . 20 1 1 A 91 91 GLN CB C 91 28.091 28.507 -0.416 1 1 995 . 20 1 1 A 91 91 GLN N N 91 117.846 118.042 -0.196 1 1 997 . 20 1 1 A 92 92 LEU H H 92 8.751 8.677 0.074 1 1 998 . 20 1 1 A 92 92 LEU HA H 92 3.903 3.936 -0.033 1 1 1007 . 20 1 1 A 92 92 LEU C C 92 178.997 179.144 -0.147 1 1 1008 . 20 1 1 A 92 92 LEU CA C 92 58.136 57.825 0.311 1 1 1009 . 20 1 1 A 92 92 LEU CB C 92 41.576 41.434 0.142 1 1 1013 . 20 1 1 A 92 92 LEU N N 92 119.547 119.933 -0.386 1 1 1014 . 20 1 1 A 93 93 PHE H H 93 8.648 7.962 0.686 1 1 1015 . 20 1 1 A 93 93 PHE HA H 93 4.270 4.177 0.093 1 1 1020 . 20 1 1 A 93 93 PHE C C 93 179.283 178.806 0.477 1 1 1021 . 20 1 1 A 93 93 PHE CA C 93 59.860 60.508 -0.648 1 1 1022 . 20 1 1 A 93 93 PHE CB C 93 37.765 38.414 -0.649 1 1 1025 . 20 1 1 A 93 93 PHE N N 93 118.041 119.188 -1.147 1 1 1026 . 20 1 1 A 94 94 GLU H H 94 7.739 8.343 -0.604 1 1 1027 . 20 1 1 A 94 94 GLU HA H 94 4.110 4.126 -0.016 1 1 1031 . 20 1 1 A 94 94 GLU C C 94 178.629 178.792 -0.163 1 1 1032 . 20 1 1 A 94 94 GLU CA C 94 59.359 59.340 0.019 1 1 1033 . 20 1 1 A 94 94 GLU CB C 94 29.589 28.911 0.678 1 1 1035 . 20 1 1 A 94 94 GLU N N 94 119.980 117.175 2.805 1 1 1036 . 20 1 1 A 95 95 LEU H H 95 7.999 8.160 -0.161 1 1 1037 . 20 1 1 A 95 95 LEU HA H 95 4.139 3.932 0.207 1 1 1047 . 20 1 1 A 95 95 LEU C C 95 178.965 178.905 0.060 1 1 1048 . 20 1 1 A 95 95 LEU CA C 95 57.557 57.869 -0.312 1 1 1049 . 20 1 1 A 95 95 LEU CB C 95 43.443 41.586 1.857 1 1 1053 . 20 1 1 A 95 95 LEU N N 95 118.398 121.773 -3.375 1 1 1054 . 20 1 1 A 96 96 LEU H H 96 8.363 8.072 0.291 1 1 1055 . 20 1 1 A 96 96 LEU HA H 96 4.503 4.368 0.135 1 1 1061 . 20 1 1 A 96 96 LEU C C 96 177.932 176.940 0.992 1 1 1062 . 20 1 1 A 96 96 LEU CA C 96 54.700 55.725 -1.025 1 1 1063 . 20 1 1 A 96 96 LEU CB C 96 43.048 43.234 -0.186 1 1 1065 . 20 1 1 A 96 96 LEU N N 96 114.720 118.264 -3.544 1 1 1066 . 20 1 1 A 97 97 GLY H H 97 7.810 7.909 -0.099 1 1 1067 . 20 1 1 A 97 97 GLY HA2 H 97 3.963 3.942 0.021 1 1 1068 . 20 1 1 A 97 97 GLY C C 97 173.535 174.313 -0.778 1 1 1069 . 20 1 1 A 97 97 GLY CA C 97 45.667 45.317 0.350 1 1 1070 . 20 1 1 A 97 97 GLY N N 97 109.511 108.113 1.398 1 1 1071 . 20 1 1 A 98 98 SER H H 98 8.131 8.549 -0.418 1 1 1072 . 20 1 1 A 98 98 SER HA H 98 4.225 4.023 0.202 1 1 1075 . 20 1 1 A 98 98 SER C C 98 174.974 174.424 0.550 1 1 1076 . 20 1 1 A 98 98 SER CA C 98 57.960 59.697 -1.737 1 1 1077 . 20 1 1 A 98 98 SER CB C 98 63.997 62.455 1.542 1 1 1078 . 20 1 1 A 98 98 SER N N 98 113.405 115.971 -2.566 1 1 1079 . 20 1 1 A 99 99 GLY H H 99 8.052 7.895 0.157 1 1 1080 . 20 1 1 A 99 99 GLY HA2 H 99 3.998 3.821 0.177 1 1 1081 . 20 1 1 A 99 99 GLY HA3 H 99 3.778 3.846 -0.068 1 1 1082 . 20 1 1 A 99 99 GLY C C 99 174.033 173.813 0.220 1 1 1083 . 20 1 1 A 99 99 GLY CA C 99 45.123 45.358 -0.235 1 1 1084 . 20 1 1 A 99 99 GLY N N 99 111.534 108.178 3.356 1 1 1085 . 20 1 1 A 100 100 GLU H H 100 8.177 7.593 0.584 1 1 1086 . 20 1 1 A 100 100 GLU HA H 100 4.201 4.654 -0.453 1 1 1091 . 20 1 1 A 100 100 GLU C C 100 175.830 176.370 -0.540 1 1 1092 . 20 1 1 A 100 100 GLU CA C 100 56.442 55.165 1.277 1 1 1093 . 20 1 1 A 100 100 GLU CB C 100 30.428 31.054 -0.626 1 1 1095 . 20 1 1 A 100 100 GLU N N 100 120.463 120.009 0.454 1 1 1096 . 20 1 1 A 101 101 GLN H H 101 8.161 8.387 -0.226 1 1 1097 . 20 1 1 A 101 101 GLN HA H 101 4.098 4.331 -0.233 1 1 1103 . 20 1 1 A 101 101 GLN C C 101 175.412 175.559 -0.147 1 1 1104 . 20 1 1 A 101 101 GLN CA C 101 55.632 55.633 -0.001 1 1 1105 . 20 1 1 A 101 101 GLN CB C 101 29.569 29.167 0.402 1 1 1107 . 20 1 1 A 101 101 GLN N N 101 120.014 121.107 -1.093 1 1 1109 . 20 1 1 A 102 102 LYS H H 102 8.235 8.486 -0.251 1 1 1110 . 20 1 1 A 102 102 LYS HA H 102 4.387 4.511 -0.124 1 1 1117 . 20 1 1 A 102 102 LYS CA C 102 54.116 52.833 1.283 1 1 1118 . 20 1 1 A 102 102 LYS CB C 102 32.478 32.679 -0.201 1 1 1122 . 20 1 1 A 102 102 LYS N N 102 123.399 121.541 1.858 1 1 1123 . 20 1 1 A 103 103 PRO HA H 103 4.498 4.726 -0.228 1 1 1129 . 20 1 1 A 103 103 PRO C C 103 175.473 175.992 -0.519 1 1 1130 . 20 1 1 A 103 103 PRO CA C 103 62.802 62.201 0.601 1 1 1131 . 20 1 1 A 103 103 PRO CB C 103 32.124 33.090 -0.966 1 1 1134 . 20 1 1 A 104 104 ALA H H 104 8.017 8.161 -0.144 1 1 1135 . 20 1 1 A 104 104 ALA HA H 104 4.318 4.487 -0.169 1 1 1139 . 20 1 1 A 104 104 ALA C C 104 176.717 176.742 -0.025 1 1 1140 . 20 1 1 A 104 104 ALA CA C 104 52.194 51.610 0.584 1 1 1141 . 20 1 1 A 104 104 ALA CB C 104 20.113 21.169 -1.056 1 1 1142 . 20 1 1 A 104 104 ALA N N 104 122.093 119.336 2.757 1 1 1143 . 20 1 1 A 105 105 GLY H H 105 7.678 8.334 -0.656 1 1 1144 . 20 1 1 A 105 105 GLY HA2 H 105 3.851 4.120 -0.269 1 1 1145 . 20 1 1 A 105 105 GLY HA3 H 105 4.053 4.138 -0.085 1 1 1146 . 20 1 1 A 105 105 GLY C C 105 172.990 174.827 -1.837 1 1 1147 . 20 1 1 A 105 105 GLY CA C 105 44.241 43.667 0.574 1 1 1148 . 20 1 1 A 105 105 GLY N N 105 105.234 107.256 -2.022 1 1 1149 . 20 1 1 A 106 106 VAL H H 106 8.409 8.568 -0.159 1 1 1150 . 20 1 1 A 106 106 VAL HA H 106 2.829 3.319 -0.490 1 1 1158 . 20 1 1 A 106 106 VAL C C 106 177.822 177.357 0.465 1 1 1159 . 20 1 1 A 106 106 VAL CA C 106 65.522 65.475 0.047 1 1 1160 . 20 1 1 A 106 106 VAL CB C 106 30.701 30.666 0.035 1 1 1163 . 20 1 1 A 106 106 VAL N N 106 119.215 121.856 -2.641 1 1 1164 . 20 1 1 A 107 107 ALA H H 107 8.707 8.454 0.253 1 1 1165 . 20 1 1 A 107 107 ALA HA H 107 3.730 3.874 -0.144 1 1 1169 . 20 1 1 A 107 107 ALA C C 107 179.661 179.556 0.105 1 1 1170 . 20 1 1 A 107 107 ALA CA C 107 54.995 55.706 -0.711 1 1 1171 . 20 1 1 A 107 107 ALA CB C 107 17.705 17.831 -0.126 1 1 1172 . 20 1 1 A 107 107 ALA N N 107 118.672 122.285 -3.613 1 1 1173 . 20 1 1 A 108 108 ALA H H 108 7.388 7.906 -0.518 1 1 1174 . 20 1 1 A 108 108 ALA HA H 108 4.259 4.074 0.185 1 1 1178 . 20 1 1 A 108 108 ALA C C 108 179.318 179.334 -0.016 1 1 1179 . 20 1 1 A 108 108 ALA CA C 108 53.481 55.053 -1.572 1 1 1180 . 20 1 1 A 108 108 ALA CB C 108 19.367 18.310 1.057 1 1 1181 . 20 1 1 A 108 108 ALA N N 108 116.635 121.274 -4.639 1 1 1182 . 20 1 1 A 109 109 VAL H H 109 7.689 7.562 0.127 1 1 1183 . 20 1 1 A 109 109 VAL HA H 109 4.532 3.857 0.675 1 1 1191 . 20 1 1 A 109 109 VAL C C 109 176.055 177.938 -1.883 1 1 1192 . 20 1 1 A 109 109 VAL CA C 109 61.452 65.764 -4.312 1 1 1193 . 20 1 1 A 109 109 VAL CB C 109 32.728 31.499 1.229 1 1 1196 . 20 1 1 A 109 109 VAL N N 109 112.851 116.817 -3.966 1 1 1197 . 20 1 1 A 110 110 LEU H H 110 7.099 8.222 -1.123 1 1 1198 . 20 1 1 A 110 110 LEU HA H 110 3.723 3.794 -0.071 1 1 1208 . 20 1 1 A 110 110 LEU C C 110 179.040 178.838 0.202 1 1 1209 . 20 1 1 A 110 110 LEU CA C 110 58.825 57.869 0.956 1 1 1210 . 20 1 1 A 110 110 LEU CB C 110 41.242 41.713 -0.471 1 1 1214 . 20 1 1 A 110 110 LEU N N 110 119.829 124.959 -5.130 1 1 1215 . 20 1 1 A 111 111 GLY H H 111 8.435 7.839 0.596 1 1 1216 . 20 1 1 A 111 111 GLY HA2 H 111 3.970 3.823 0.147 1 1 1217 . 20 1 1 A 111 111 GLY HA3 H 111 3.885 3.833 0.052 1 1 1218 . 20 1 1 A 111 111 GLY C C 111 178.031 176.788 1.243 1 1 1219 . 20 1 1 A 111 111 GLY CA C 111 46.961 47.557 -0.596 1 1 1220 . 20 1 1 A 111 111 GLY N N 111 104.089 106.582 -2.493 1 1 1221 . 20 1 1 A 112 112 SER H H 112 8.343 8.106 0.237 1 1 1222 . 20 1 1 A 112 112 SER HA H 112 4.266 4.154 0.112 1 1 1224 . 20 1 1 A 112 112 SER C C 112 175.885 175.251 0.634 1 1 1225 . 20 1 1 A 112 112 SER CA C 112 61.304 62.510 -1.206 1 1 1226 . 20 1 1 A 112 112 SER CB C 112 62.901 62.900 0.001 1 1 1227 . 20 1 1 A 112 112 SER N N 112 119.497 119.397 0.100 1 1 1228 . 20 1 1 A 113 113 LEU H H 113 7.667 7.817 -0.150 1 1 1229 . 20 1 1 A 113 113 LEU HA H 113 4.343 4.201 0.142 1 1 1238 . 20 1 1 A 113 113 LEU C C 113 174.760 175.920 -1.160 1 1 1239 . 20 1 1 A 113 113 LEU CA C 113 54.228 54.739 -0.511 1 1 1240 . 20 1 1 A 113 113 LEU CB C 113 41.467 42.309 -0.842 1 1 1244 . 20 1 1 A 113 113 LEU N N 113 118.843 117.732 1.111 1 1 1245 . 20 1 1 A 114 114 LYS H H 114 7.685 7.850 -0.165 1 1 1246 . 20 1 1 A 114 114 LYS HA H 114 3.958 3.917 0.041 1 1 1250 . 20 1 1 A 114 114 LYS C C 114 177.557 175.913 1.644 1 1 1251 . 20 1 1 A 114 114 LYS CA C 114 56.935 57.508 -0.573 1 1 1252 . 20 1 1 A 114 114 LYS CB C 114 28.898 29.509 -0.611 1 1 1254 . 20 1 1 A 114 114 LYS N N 114 114.072 116.246 -2.174 1 1 1255 . 20 1 1 A 115 115 LEU H H 115 8.329 7.908 0.421 1 1 1256 . 20 1 1 A 115 115 LEU HA H 115 4.315 4.310 0.005 1 1 1265 . 20 1 1 A 115 115 LEU C C 115 175.988 177.104 -1.116 1 1 1266 . 20 1 1 A 115 115 LEU CA C 115 54.310 55.724 -1.414 1 1 1267 . 20 1 1 A 115 115 LEU CB C 115 44.163 42.479 1.684 1 1 1270 . 20 1 1 A 115 115 LEU N N 115 117.951 120.092 -2.141 1 1 1271 . 20 1 1 A 116 116 GLN H H 116 9.100 8.617 0.483 1 1 1272 . 20 1 1 A 116 116 GLN HA H 116 4.898 5.084 -0.186 1 1 1279 . 20 1 1 A 116 116 GLN CA C 116 53.467 55.050 -1.583 1 1 1280 . 20 1 1 A 116 116 GLN CB C 116 32.730 30.396 2.334 1 1 1282 . 20 1 1 A 116 116 GLN N N 116 119.994 121.639 -1.645 1 1 1284 . 20 1 1 A 117 117 GLU H H 117 8.849 8.527 0.322 1 1 1285 . 20 1 1 A 117 117 GLU HA H 117 3.707 3.866 -0.159 1 1 1290 . 20 1 1 A 117 117 GLU C C 117 177.303 176.649 0.654 1 1 1291 . 20 1 1 A 117 117 GLU CA C 117 57.233 55.554 1.679 1 1 1292 . 20 1 1 A 117 117 GLU CB C 117 29.634 28.773 0.861 1 1 1294 . 20 1 1 A 117 117 GLU N N 117 121.487 123.642 -2.155 1 1 1295 . 20 1 1 A 118 118 VAL H H 118 8.983 8.014 0.969 1 1 1296 . 20 1 1 A 118 118 VAL HA H 118 4.360 3.986 0.374 1 1 1304 . 20 1 1 A 118 118 VAL C C 118 174.171 175.843 -1.672 1 1 1305 . 20 1 1 A 118 118 VAL CA C 118 61.772 63.681 -1.909 1 1 1306 . 20 1 1 A 118 118 VAL CB C 118 34.095 32.082 2.013 1 1 1309 . 20 1 1 A 118 118 VAL N N 118 122.933 122.098 0.835 1 1 1310 . 20 1 1 A 119 119 ALA H H 119 7.023 7.117 -0.094 1 1 1311 . 20 1 1 A 119 119 ALA HA H 119 4.378 4.665 -0.287 1 1 1315 . 20 1 1 A 119 119 ALA C C 119 175.493 175.166 0.327 1 1 1316 . 20 1 1 A 119 119 ALA CA C 119 51.956 50.464 1.492 1 1 1317 . 20 1 1 A 119 119 ALA CB C 119 23.957 21.912 2.045 1 1 1318 . 20 1 1 A 119 119 ALA N N 119 117.379 122.487 -5.108 1 1 1319 . 20 1 1 A 120 120 SER H H 120 6.999 8.660 -1.661 1 1 1320 . 20 1 1 A 120 120 SER HA H 120 5.208 5.603 -0.395 1 1 1323 . 20 1 1 A 120 120 SER C C 120 173.082 172.653 0.429 1 1 1324 . 20 1 1 A 120 120 SER CA C 120 56.754 57.128 -0.374 1 1 1325 . 20 1 1 A 120 120 SER CB C 120 64.605 65.656 -1.051 1 1 1326 . 20 1 1 A 120 120 SER N N 120 113.743 115.056 -1.313 1 1 1327 . 20 1 1 A 121 121 PHE H H 121 8.244 8.951 -0.707 1 1 1328 . 20 1 1 A 121 121 PHE HA H 121 5.177 4.942 0.235 1 1 1333 . 20 1 1 A 121 121 PHE C C 121 173.569 172.481 1.088 1 1 1334 . 20 1 1 A 121 121 PHE CA C 121 55.555 55.466 0.089 1 1 1335 . 20 1 1 A 121 121 PHE CB C 121 40.959 41.381 -0.422 1 1 1338 . 20 1 1 A 121 121 PHE N N 121 120.358 121.775 -1.417 1 1 1339 . 20 1 1 A 122 122 ILE H H 122 8.907 8.595 0.312 1 1 1340 . 20 1 1 A 122 122 ILE HA H 122 4.682 4.384 0.298 1 1 1348 . 20 1 1 A 122 122 ILE C C 122 176.925 175.439 1.486 1 1 1349 . 20 1 1 A 122 122 ILE CA C 122 60.740 61.631 -0.891 1 1 1350 . 20 1 1 A 122 122 ILE CB C 122 39.497 37.833 1.664 1 1 1353 . 20 1 1 A 122 122 ILE N N 122 121.282 121.680 -0.398 1 1 1354 . 20 1 1 A 123 123 THR H H 123 9.022 9.618 -0.596 1 1 1355 . 20 1 1 A 123 123 THR HA H 123 5.039 5.146 -0.107 1 1 1360 . 20 1 1 A 123 123 THR C C 123 173.531 173.764 -0.233 1 1 1361 . 20 1 1 A 123 123 THR CA C 123 62.266 60.676 1.590 1 1 1362 . 20 1 1 A 123 123 THR CB C 123 70.677 70.202 0.475 1 1 1364 . 20 1 1 A 123 123 THR N N 123 128.965 120.266 8.699 1 1 1365 . 20 1 1 A 124 124 THR H H 124 8.961 8.636 0.325 1 1 1366 . 20 1 1 A 124 124 THR HA H 124 5.001 5.111 -0.110 1 1 1371 . 20 1 1 A 124 124 THR C C 124 173.468 173.106 0.362 1 1 1372 . 20 1 1 A 124 124 THR CA C 124 62.109 60.424 1.685 1 1 1373 . 20 1 1 A 124 124 THR CB C 124 70.450 70.367 0.083 1 1 1375 . 20 1 1 A 124 124 THR N N 124 122.176 117.573 4.603 1 1 1376 . 20 1 1 A 125 125 ARG H H 125 9.386 8.845 0.541 1 1 1377 . 20 1 1 A 125 125 ARG HA H 125 5.764 5.409 0.355 1 1 1384 . 20 1 1 A 125 125 ARG C C 125 175.713 174.361 1.352 1 1 1385 . 20 1 1 A 125 125 ARG CA C 125 53.991 54.203 -0.212 1 1 1386 . 20 1 1 A 125 125 ARG CB C 125 33.557 33.935 -0.378 1 1 1389 . 20 1 1 A 125 125 ARG N N 125 130.004 127.367 2.637 1 1 1390 . 20 1 1 A 126 126 SER H H 126 9.172 9.429 -0.257 1 1 1391 . 20 1 1 A 126 126 SER HA H 126 5.390 5.413 -0.023 1 1 1394 . 20 1 1 A 126 126 SER C C 126 172.359 173.146 -0.787 1 1 1395 . 20 1 1 A 126 126 SER CA C 126 56.934 56.716 0.218 1 1 1396 . 20 1 1 A 126 126 SER CB C 126 65.827 65.877 -0.050 1 1 1397 . 20 1 1 A 126 126 SER N N 126 119.906 121.512 -1.606 1 1 1398 . 20 1 1 A 127 127 SER H H 127 8.591 9.167 -0.576 1 1 1399 . 20 1 1 A 127 127 SER HA H 127 5.739 5.324 0.415 1 1 1401 . 20 1 1 A 127 127 SER C C 127 173.283 173.089 0.194 1 1 1402 . 20 1 1 A 127 127 SER CA C 127 57.354 57.678 -0.324 1 1 1403 . 20 1 1 A 127 127 SER CB C 127 65.412 64.773 0.639 1 1 1404 . 20 1 1 A 127 127 SER N N 127 117.914 120.382 -2.468 1 1 1405 . 20 1 1 A 128 128 TRP H H 128 9.866 9.745 0.121 1 1 1406 . 20 1 1 A 128 128 TRP HA H 128 5.560 5.657 -0.097 1 1 1415 . 20 1 1 A 128 128 TRP C C 128 175.828 174.961 0.867 1 1 1416 . 20 1 1 A 128 128 TRP CA C 128 55.852 55.765 0.087 1 1 1417 . 20 1 1 A 128 128 TRP CB C 128 32.524 32.638 -0.114 1 1 1423 . 20 1 1 A 128 128 TRP N N 128 127.978 126.095 1.883 1 1 1425 . 20 1 1 A 129 129 LYS H H 129 9.424 9.160 0.264 1 1 1426 . 20 1 1 A 129 129 LYS HA H 129 5.388 5.391 -0.003 1 1 1433 . 20 1 1 A 129 129 LYS C C 129 175.254 174.444 0.810 1 1 1434 . 20 1 1 A 129 129 LYS CA C 129 54.410 55.019 -0.609 1 1 1435 . 20 1 1 A 129 129 LYS CB C 129 35.734 36.148 -0.414 1 1 1439 . 20 1 1 A 129 129 LYS N N 129 121.784 122.478 -0.694 1 1 1440 . 20 1 1 A 130 130 LEU H H 130 8.933 9.417 -0.484 1 1 1441 . 20 1 1 A 130 130 LEU HA H 130 4.859 5.065 -0.206 1 1 1447 . 20 1 1 A 130 130 LEU C C 130 173.893 174.166 -0.273 1 1 1448 . 20 1 1 A 130 130 LEU CA C 130 53.848 54.334 -0.486 1 1 1449 . 20 1 1 A 130 130 LEU CB C 130 46.125 45.966 0.159 1 1 1451 . 20 1 1 A 130 130 LEU N N 130 124.543 126.528 -1.985 1 1 1452 . 20 1 1 A 131 131 ALA H H 131 8.816 8.724 0.092 1 1 1453 . 20 1 1 A 131 131 ALA HA H 131 4.776 4.724 0.052 1 1 1457 . 20 1 1 A 131 131 ALA C C 131 176.662 176.766 -0.104 1 1 1458 . 20 1 1 A 131 131 ALA CA C 131 51.407 51.304 0.103 1 1 1459 . 20 1 1 A 131 131 ALA CB C 131 19.354 19.512 -0.158 1 1 1460 . 20 1 1 A 131 131 ALA N N 131 131.102 128.915 2.187 1 1 1461 . 20 1 1 A 132 132 LEU H H 132 8.487 8.933 -0.446 1 1 1462 . 20 1 1 A 132 132 LEU HA H 132 4.470 4.470 0.000 1 1 1470 . 20 1 1 A 132 132 LEU C C 132 176.873 175.244 1.629 1 1 1471 . 20 1 1 A 132 132 LEU CA C 132 54.590 55.928 -1.338 1 1 1472 . 20 1 1 A 132 132 LEU CB C 132 42.974 42.064 0.910 1 1 1475 . 20 1 1 A 132 132 LEU N N 132 123.724 127.591 -3.867 1 1 1476 . 20 1 1 A 133 133 SER H H 133 8.448 8.918 -0.470 1 1 1477 . 20 1 1 A 133 133 SER HA H 133 4.560 4.670 -0.110 1 1 1479 . 20 1 1 A 133 133 SER C C 133 176.043 174.561 1.482 1 1 1480 . 20 1 1 A 133 133 SER CA C 133 58.460 58.122 0.338 1 1 1481 . 20 1 1 A 133 133 SER CB C 133 63.985 63.071 0.914 1 1 1482 . 20 1 1 A 133 133 SER N N 133 115.880 123.859 -7.979 1 1 1483 . 20 1 1 A 134 134 GLY H H 134 8.232 9.177 -0.945 1 1 1484 . 20 1 1 A 134 134 GLY HA2 H 134 4.147 3.910 0.237 1 1 1485 . 20 1 1 A 134 134 GLY HA3 H 134 4.045 3.911 0.134 1 1 1486 . 20 1 1 A 134 134 GLY C C 134 174.013 174.278 -0.265 1 1 1487 . 20 1 1 A 134 134 GLY CA C 134 45.337 46.578 -1.241 1 1 1488 . 20 1 1 A 134 134 GLY N N 134 109.970 113.682 -3.712 1 1 1489 . 20 1 1 A 135 135 ALA H H 135 8.424 7.898 0.526 1 1 1490 . 20 1 1 A 135 135 ALA HA H 135 4.436 4.645 -0.209 1 1 1494 . 20 1 1 A 135 135 ALA C C 135 177.537 176.909 0.628 1 1 1495 . 20 1 1 A 135 135 ALA CA C 135 52.721 52.016 0.705 1 1 1496 . 20 1 1 A 135 135 ALA CB C 135 19.265 19.783 -0.518 1 1 1497 . 20 1 1 A 135 135 ALA N N 135 124.118 119.000 5.118 1 1 1498 . 20 1 1 A 136 136 HIS H H 136 8.466 7.709 0.757 1 1 1499 . 20 1 1 A 136 136 HIS HA H 136 4.379 4.914 -0.535 1 1 1500 . 20 1 1 A 136 136 HIS C C 136 176.259 174.885 1.374 1 1 1501 . 20 1 1 A 136 136 HIS CA C 136 56.082 55.712 0.370 1 1 1502 . 20 1 1 A 136 136 HIS CB C 136 29.619 32.282 -2.663 1 1 1503 . 20 1 1 A 136 136 HIS N N 136 119.493 114.112 5.381 1 1 1504 . 20 1 1 A 137 137 GLY H H 137 8.431 8.952 -0.521 1 1 1505 . 20 1 1 A 137 137 GLY HA2 H 137 4.151 3.882 0.269 1 1 1506 . 20 1 1 A 137 137 GLY HA3 H 137 3.893 3.929 -0.036 1 1 1507 . 20 1 1 A 137 137 GLY C C 137 174.039 173.537 0.502 1 1 1508 . 20 1 1 A 137 137 GLY CA C 137 45.372 45.906 -0.534 1 1 1509 . 20 1 1 A 137 137 GLY N N 137 110.442 112.163 -1.721 1 1 1510 . 20 1 1 A 138 138 GLN H H 138 8.416 7.711 0.705 1 1 1511 . 20 1 1 A 138 138 GLN HA H 138 4.455 4.703 -0.248 1 1 1515 . 20 1 1 A 138 138 GLN C C 138 175.889 174.750 1.139 1 1 1516 . 20 1 1 A 138 138 GLN CA C 138 55.866 54.257 1.609 1 1 1517 . 20 1 1 A 138 138 GLN CB C 138 29.639 31.154 -1.515 1 1 1518 . 20 1 1 A 138 138 GLN N N 138 119.401 117.451 1.950 1 1 1519 . 20 1 1 A 139 139 GLU H H 139 8.446 8.824 -0.378 1 1 1520 . 20 1 1 A 139 139 GLU HA H 139 4.658 4.783 -0.125 1 1 1524 . 20 1 1 A 139 139 GLU CA C 139 54.589 53.639 0.950 1 1 1525 . 20 1 1 A 139 139 GLU CB C 139 29.733 30.051 -0.318 1 1 1527 . 20 1 1 A 139 139 GLU N N 139 123.136 124.366 -1.230 1 1 1528 . 20 1 1 A 140 140 PRO HA H 140 4.537 4.778 -0.241 1 1 1533 . 20 1 1 A 140 140 PRO C C 140 176.119 176.116 0.003 1 1 1534 . 20 1 1 A 140 140 PRO CA C 140 63.220 62.552 0.668 1 1 1535 . 20 1 1 A 140 140 PRO CB C 140 31.936 30.377 1.559 1 1 1538 . 20 1 1 A 141 141 GLN H H 141 8.506 8.267 0.239 1 1 1539 . 20 1 1 A 141 141 GLN HA H 141 4.650 4.625 0.025 1 1 1546 . 20 1 1 A 141 141 GLN C C 141 175.811 175.812 -0.001 1 1 1547 . 20 1 1 A 141 141 GLN CA C 141 55.912 55.429 0.483 1 1 1548 . 20 1 1 A 141 141 GLN CB C 141 30.241 29.201 1.040 1 1 1550 . 20 1 1 A 141 141 GLN N N 141 120.422 122.463 -2.041 1 1 1551 . 20 1 1 A 142 142 LEU H H 142 8.842 9.190 -0.348 1 1 1552 . 20 1 1 A 142 142 LEU HA H 142 5.277 5.263 0.014 1 1 1562 . 20 1 1 A 142 142 LEU C C 142 176.839 175.462 1.377 1 1 1563 . 20 1 1 A 142 142 LEU CA C 142 53.927 52.979 0.948 1 1 1564 . 20 1 1 A 142 142 LEU CB C 142 44.527 44.772 -0.245 1 1 1568 . 20 1 1 A 142 142 LEU N N 142 123.692 122.403 1.289 1 1 1569 . 20 1 1 A 143 143 THR H H 143 9.025 8.861 0.164 1 1 1570 . 20 1 1 A 143 143 THR HA H 143 5.262 5.027 0.235 1 1 1575 . 20 1 1 A 143 143 THR C C 143 173.753 173.751 0.002 1 1 1576 . 20 1 1 A 143 143 THR CA C 143 61.795 61.851 -0.056 1 1 1577 . 20 1 1 A 143 143 THR CB C 143 70.660 70.824 -0.164 1 1 1579 . 20 1 1 A 143 143 THR N N 143 117.222 115.391 1.831 1 1 1580 . 20 1 1 A 144 144 ILE H H 144 9.353 10.026 -0.673 1 1 1581 . 20 1 1 A 144 144 ILE HA H 144 5.399 5.352 0.047 1 1 1591 . 20 1 1 A 144 144 ILE C C 144 173.931 173.765 0.166 1 1 1592 . 20 1 1 A 144 144 ILE CA C 144 60.774 60.614 0.160 1 1 1593 . 20 1 1 A 144 144 ILE CB C 144 41.111 40.436 0.675 1 1 1597 . 20 1 1 A 144 144 ILE N N 144 126.383 125.739 0.644 1 1 1598 . 20 1 1 A 145 145 ASP H H 145 9.214 9.416 -0.202 1 1 1599 . 20 1 1 A 145 145 ASP HA H 145 5.978 5.474 0.504 1 1 1601 . 20 1 1 A 145 145 ASP C C 145 175.441 174.895 0.546 1 1 1602 . 20 1 1 A 145 145 ASP CA C 145 53.035 52.723 0.312 1 1 1603 . 20 1 1 A 145 145 ASP CB C 145 44.153 44.346 -0.193 1 1 1604 . 20 1 1 A 145 145 ASP N N 145 127.981 128.763 -0.782 1 1 1605 . 20 1 1 A 146 146 LEU H H 146 9.387 10.024 -0.637 1 1 1606 . 20 1 1 A 146 146 LEU HA H 146 4.918 5.414 -0.496 1 1 1616 . 20 1 1 A 146 146 LEU C C 146 175.003 174.673 0.330 1 1 1617 . 20 1 1 A 146 146 LEU CA C 146 53.940 53.620 0.320 1 1 1618 . 20 1 1 A 146 146 LEU CB C 146 43.902 42.953 0.949 1 1 1622 . 20 1 1 A 146 146 LEU N N 146 123.532 126.404 -2.872 1 1 1623 . 20 1 1 A 147 147 ASP H H 147 8.676 8.567 0.109 1 1 1624 . 20 1 1 A 147 147 ASP HA H 147 5.205 5.309 -0.104 1 1 1627 . 20 1 1 A 147 147 ASP C C 147 174.956 174.623 0.333 1 1 1628 . 20 1 1 A 147 147 ASP CA C 147 53.441 52.520 0.921 1 1 1629 . 20 1 1 A 147 147 ASP CB C 147 43.370 44.794 -1.424 1 1 1630 . 20 1 1 A 147 147 ASP N N 147 125.499 126.269 -0.770 1 1 1631 . 20 1 1 A 148 148 SER H H 148 8.732 8.964 -0.232 1 1 1632 . 20 1 1 A 148 148 SER HA H 148 5.365 4.631 0.734 1 1 1634 . 20 1 1 A 148 148 SER C C 148 173.217 172.826 0.391 1 1 1635 . 20 1 1 A 148 148 SER CA C 148 56.334 56.449 -0.115 1 1 1636 . 20 1 1 A 148 148 SER CB C 148 65.812 66.889 -1.077 1 1 1637 . 20 1 1 A 148 148 SER N N 148 118.623 118.424 0.199 1 1 1638 . 20 1 1 A 149 149 ALA H H 149 8.937 8.794 0.143 1 1 1639 . 20 1 1 A 149 149 ALA HA H 149 5.681 5.073 0.608 1 1 1643 . 20 1 1 A 149 149 ALA C C 149 178.894 177.340 1.554 1 1 1644 . 20 1 1 A 149 149 ALA CA C 149 49.996 50.729 -0.733 1 1 1645 . 20 1 1 A 149 149 ALA CB C 149 23.231 23.449 -0.218 1 1 1646 . 20 1 1 A 149 149 ALA N N 149 123.952 121.719 2.233 1 1 1647 . 20 1 1 A 150 150 ASP H H 150 9.010 8.759 0.251 1 1 1648 . 20 1 1 A 150 150 ASP HA H 150 4.336 4.483 -0.147 1 1 1651 . 20 1 1 A 150 150 ASP C C 150 176.697 177.568 -0.871 1 1 1652 . 20 1 1 A 150 150 ASP CA C 150 56.543 56.798 -0.255 1 1 1653 . 20 1 1 A 150 150 ASP CB C 150 39.850 40.368 -0.518 1 1 1654 . 20 1 1 A 150 150 ASP N N 150 122.687 122.186 0.501 1 1 1655 . 20 1 1 A 151 151 PHE H H 151 7.295 7.815 -0.520 1 1 1656 . 20 1 1 A 151 151 PHE HA H 151 5.020 4.701 0.319 1 1 1661 . 20 1 1 A 151 151 PHE C C 151 174.756 175.393 -0.637 1 1 1662 . 20 1 1 A 151 151 PHE CA C 151 56.594 58.220 -1.626 1 1 1663 . 20 1 1 A 151 151 PHE CB C 151 37.765 39.286 -1.521 1 1 1666 . 20 1 1 A 151 151 PHE N N 151 113.928 115.553 -1.625 1 1 1667 . 20 1 1 A 152 152 GLY H H 152 7.786 8.120 -0.334 1 1 1668 . 20 1 1 A 152 152 GLY HA2 H 152 4.459 4.048 0.411 1 1 1669 . 20 1 1 A 152 152 GLY HA3 H 152 3.728 4.058 -0.330 1 1 1670 . 20 1 1 A 152 152 GLY C C 152 172.709 173.515 -0.806 1 1 1671 . 20 1 1 A 152 152 GLY CA C 152 46.106 46.976 -0.870 1 1 1672 . 20 1 1 A 152 152 GLY N N 152 110.312 108.772 1.540 1 1 1673 . 20 1 1 A 153 153 TYR H H 153 6.650 7.484 -0.834 1 1 1674 . 20 1 1 A 153 153 TYR HA H 153 4.508 5.079 -0.571 1 1 1679 . 20 1 1 A 153 153 TYR C C 153 173.092 173.261 -0.169 1 1 1680 . 20 1 1 A 153 153 TYR CA C 153 57.464 57.398 0.066 1 1 1681 . 20 1 1 A 153 153 TYR CB C 153 41.962 42.412 -0.450 1 1 1684 . 20 1 1 A 153 153 TYR N N 153 121.977 119.044 2.933 1 1 1685 . 20 1 1 A 154 154 ALA H H 154 7.847 8.511 -0.664 1 1 1686 . 20 1 1 A 154 154 ALA HA H 154 5.144 4.616 0.528 1 1 1690 . 20 1 1 A 154 154 ALA C C 154 174.468 175.003 -0.535 1 1 1691 . 20 1 1 A 154 154 ALA CA C 154 51.776 51.249 0.527 1 1 1692 . 20 1 1 A 154 154 ALA CB C 154 21.747 22.288 -0.541 1 1 1693 . 20 1 1 A 154 154 ALA N N 154 130.258 129.941 0.317 1 1 1694 . 20 1 1 A 155 155 VAL H H 155 8.733 8.934 -0.201 1 1 1695 . 20 1 1 A 155 155 VAL HA H 155 4.150 4.813 -0.663 1 1 1700 . 20 1 1 A 155 155 VAL C C 155 172.632 173.124 -0.492 1 1 1701 . 20 1 1 A 155 155 VAL CA C 155 61.451 59.327 2.124 1 1 1702 . 20 1 1 A 155 155 VAL CB C 155 35.883 35.848 0.035 1 1 1704 . 20 1 1 A 155 155 VAL N N 155 119.622 121.860 -2.238 1 1 1705 . 20 1 1 A 156 156 GLY H H 156 8.146 8.354 -0.208 1 1 1706 . 20 1 1 A 156 156 GLY HA2 H 156 5.125 2.772 2.353 1 1 1707 . 20 1 1 A 156 156 GLY HA3 H 156 2.061 3.990 -1.929 1 1 1708 . 20 1 1 A 156 156 GLY C C 156 171.746 171.368 0.378 1 1 1709 . 20 1 1 A 156 156 GLY CA C 156 43.319 43.806 -0.487 1 1 1710 . 20 1 1 A 156 156 GLY N N 156 113.332 113.045 0.287 1 1 1711 . 20 1 1 A 157 157 GLU H H 157 8.967 8.903 0.064 1 1 1712 . 20 1 1 A 157 157 GLU HA H 157 5.217 5.021 0.196 1 1 1716 . 20 1 1 A 157 157 GLU C C 157 174.476 175.547 -1.071 1 1 1717 . 20 1 1 A 157 157 GLU CA C 157 55.390 54.962 0.428 1 1 1718 . 20 1 1 A 157 157 GLU CB C 157 34.010 32.461 1.549 1 1 1720 . 20 1 1 A 157 157 GLU N N 157 120.823 123.082 -2.259 1 1 1721 . 20 1 1 A 158 158 VAL H H 158 9.076 9.399 -0.323 1 1 1722 . 20 1 1 A 158 158 VAL HA H 158 5.206 4.852 0.354 1 1 1727 . 20 1 1 A 158 158 VAL C C 158 173.900 174.100 -0.200 1 1 1728 . 20 1 1 A 158 158 VAL CA C 158 60.813 61.910 -1.097 1 1 1729 . 20 1 1 A 158 158 VAL CB C 158 33.385 32.840 0.545 1 1 1731 . 20 1 1 A 158 158 VAL N N 158 124.349 125.709 -1.360 1 1 1732 . 20 1 1 A 159 159 GLU H H 159 9.239 9.795 -0.556 1 1 1733 . 20 1 1 A 159 159 GLU HA H 159 5.647 5.171 0.476 1 1 1738 . 20 1 1 A 159 159 GLU C C 159 174.469 174.937 -0.468 1 1 1739 . 20 1 1 A 159 159 GLU CA C 159 54.473 54.631 -0.158 1 1 1740 . 20 1 1 A 159 159 GLU CB C 159 33.852 32.655 1.197 1 1 1742 . 20 1 1 A 159 159 GLU N N 159 125.772 129.538 -3.766 1 1 1743 . 20 1 1 A 160 160 ALA H H 160 9.250 9.468 -0.218 1 1 1744 . 20 1 1 A 160 160 ALA HA H 160 4.966 5.474 -0.508 1 1 1748 . 20 1 1 A 160 160 ALA C C 160 175.114 175.628 -0.514 1 1 1749 . 20 1 1 A 160 160 ALA CA C 160 50.644 50.136 0.508 1 1 1750 . 20 1 1 A 160 160 ALA CB C 160 23.263 22.579 0.684 1 1 1751 . 20 1 1 A 160 160 ALA N N 160 125.092 129.540 -4.448 1 1 1752 . 20 1 1 A 161 161 MET H H 161 8.559 8.813 -0.254 1 1 1753 . 20 1 1 A 161 161 MET HA H 161 5.468 6.037 -0.569 1 1 1761 . 20 1 1 A 161 161 MET C C 161 176.265 174.652 1.613 1 1 1762 . 20 1 1 A 161 161 MET CA C 161 53.818 54.065 -0.247 1 1 1763 . 20 1 1 A 161 161 MET CB C 161 34.380 34.381 -0.001 1 1 1766 . 20 1 1 A 161 161 MET N N 161 118.699 119.929 -1.230 1 1 1767 . 20 1 1 A 162 162 VAL H H 162 9.046 9.194 -0.148 1 1 1768 . 20 1 1 A 162 162 VAL HA H 162 4.841 4.558 0.283 1 1 1776 . 20 1 1 A 162 162 VAL C C 162 174.794 176.138 -1.344 1 1 1777 . 20 1 1 A 162 162 VAL CA C 162 59.107 61.089 -1.982 1 1 1778 . 20 1 1 A 162 162 VAL CB C 162 34.018 34.091 -0.073 1 1 1781 . 20 1 1 A 162 162 VAL N N 162 116.435 124.105 -7.670 1 1 1782 . 20 1 1 A 163 163 HIS H H 163 8.793 8.757 0.036 1 1 1783 . 20 1 1 A 163 163 HIS HA H 163 4.717 4.583 0.134 1 1 1787 . 20 1 1 A 163 163 HIS C C 163 175.460 174.641 0.819 1 1 1788 . 20 1 1 A 163 163 HIS CA C 163 58.488 57.479 1.009 1 1 1789 . 20 1 1 A 163 163 HIS CB C 163 31.185 30.692 0.493 1 1 1791 . 20 1 1 A 163 163 HIS N N 163 117.838 126.964 -9.126 1 1 1792 . 20 1 1 A 164 164 GLU H H 164 8.013 7.611 0.402 1 1 1793 . 20 1 1 A 164 164 GLU HA H 164 4.814 4.595 0.219 1 1 1797 . 20 1 1 A 164 164 GLU C C 164 176.910 176.232 0.678 1 1 1798 . 20 1 1 A 164 164 GLU CA C 164 54.355 54.550 -0.195 1 1 1799 . 20 1 1 A 164 164 GLU CB C 164 32.886 32.286 0.600 1 1 1801 . 20 1 1 A 164 164 GLU N N 164 115.943 114.912 1.031 1 1 1802 . 20 1 1 A 165 165 LYS H H 165 9.088 8.859 0.229 1 1 1803 . 20 1 1 A 165 165 LYS HA H 165 3.942 3.907 0.035 1 1 1809 . 20 1 1 A 165 165 LYS C C 165 179.657 177.793 1.864 1 1 1810 . 20 1 1 A 165 165 LYS CA C 165 59.888 58.899 0.989 1 1 1811 . 20 1 1 A 165 165 LYS CB C 165 32.024 32.150 -0.126 1 1 1814 . 20 1 1 A 165 165 LYS N N 165 124.120 122.659 1.461 1 1 1815 . 20 1 1 A 166 166 ALA H H 166 8.851 7.923 0.928 1 1 1816 . 20 1 1 A 166 166 ALA HA H 166 4.251 4.019 0.232 1 1 1820 . 20 1 1 A 166 166 ALA C C 166 178.920 179.035 -0.115 1 1 1821 . 20 1 1 A 166 166 ALA CA C 166 54.318 54.727 -0.409 1 1 1822 . 20 1 1 A 166 166 ALA CB C 166 18.810 18.295 0.515 1 1 1823 . 20 1 1 A 166 166 ALA N N 166 120.424 122.164 -1.740 1 1 1824 . 20 1 1 A 167 167 GLU H H 167 7.871 7.561 0.310 1 1 1825 . 20 1 1 A 167 167 GLU HA H 167 4.404 4.370 0.034 1 1 1829 . 20 1 1 A 167 167 GLU C C 167 177.368 177.913 -0.545 1 1 1830 . 20 1 1 A 167 167 GLU CA C 167 56.701 56.927 -0.226 1 1 1831 . 20 1 1 A 167 167 GLU CB C 167 31.208 30.240 0.968 1 1 1833 . 20 1 1 A 167 167 GLU N N 167 114.926 116.365 -1.439 1 1 1834 . 20 1 1 A 168 168 VAL H H 168 7.812 7.293 0.519 1 1 1835 . 20 1 1 A 168 168 VAL HA H 168 3.712 3.642 0.070 1 1 1843 . 20 1 1 A 168 168 VAL CA C 168 68.705 67.933 0.772 1 1 1844 . 20 1 1 A 168 168 VAL CB C 168 29.597 29.777 -0.180 1 1 1847 . 20 1 1 A 168 168 VAL N N 168 120.188 122.459 -2.271 1 1 1848 . 20 1 1 A 169 169 PRO HA H 169 4.252 4.299 -0.047 1 1 1851 . 20 1 1 A 169 169 PRO C C 169 179.563 178.374 1.189 1 1 1852 . 20 1 1 A 169 169 PRO CA C 169 67.077 66.084 0.993 1 1 1853 . 20 1 1 A 170 170 ALA H H 170 8.149 7.974 0.175 1 1 1854 . 20 1 1 A 170 170 ALA HA H 170 4.265 4.069 0.196 1 1 1858 . 20 1 1 A 170 170 ALA C C 170 180.637 179.722 0.915 1 1 1859 . 20 1 1 A 170 170 ALA CA C 170 54.823 55.307 -0.484 1 1 1860 . 20 1 1 A 170 170 ALA CB C 170 18.518 18.254 0.264 1 1 1861 . 20 1 1 A 170 170 ALA N N 170 119.210 118.743 0.467 1 1 1862 . 20 1 1 A 171 171 ALA H H 171 7.767 8.508 -0.741 1 1 1863 . 20 1 1 A 171 171 ALA HA H 171 4.106 4.151 -0.045 1 1 1867 . 20 1 1 A 171 171 ALA C C 171 179.371 179.989 -0.618 1 1 1868 . 20 1 1 A 171 171 ALA CA C 171 55.130 55.006 0.124 1 1 1869 . 20 1 1 A 171 171 ALA CB C 171 18.291 18.161 0.130 1 1 1870 . 20 1 1 A 171 171 ALA N N 171 122.126 120.633 1.493 1 1 1871 . 20 1 1 A 172 172 LEU H H 172 8.950 8.004 0.946 1 1 1872 . 20 1 1 A 172 172 LEU HA H 172 3.987 4.110 -0.123 1 1 1878 . 20 1 1 A 172 172 LEU C C 172 178.355 178.459 -0.104 1 1 1879 . 20 1 1 A 172 172 LEU CA C 172 57.803 58.083 -0.280 1 1 1880 . 20 1 1 A 172 172 LEU CB C 172 41.667 41.390 0.277 1 1 1882 . 20 1 1 A 172 172 LEU N N 172 118.682 120.517 -1.835 1 1 1883 . 20 1 1 A 173 173 GLU H H 173 7.886 7.715 0.171 1 1 1884 . 20 1 1 A 173 173 GLU HA H 173 4.132 3.959 0.173 1 1 1887 . 20 1 1 A 173 173 GLU C C 173 179.556 179.349 0.207 1 1 1888 . 20 1 1 A 173 173 GLU CA C 173 59.800 59.616 0.184 1 1 1889 . 20 1 1 A 173 173 GLU CB C 173 29.580 29.209 0.371 1 1 1891 . 20 1 1 A 173 173 GLU N N 173 117.561 118.626 -1.065 1 1 1892 . 20 1 1 A 174 174 LYS H H 174 7.532 7.721 -0.189 1 1 1893 . 20 1 1 A 174 174 LYS HA H 174 4.131 4.075 0.056 1 1 1901 . 20 1 1 A 174 174 LYS CA C 174 58.999 59.439 -0.440 1 1 1902 . 20 1 1 A 174 174 LYS CB C 174 32.041 32.538 -0.497 1 1 1906 . 20 1 1 A 174 174 LYS N N 174 119.085 119.417 -0.332 1 1 1907 . 20 1 1 A 175 175 ILE H H 175 8.479 8.156 0.323 1 1 1908 . 20 1 1 A 175 175 ILE HA H 175 3.583 3.637 -0.054 1 1 1918 . 20 1 1 A 175 175 ILE C C 175 179.258 178.306 0.952 1 1 1919 . 20 1 1 A 175 175 ILE CA C 175 65.769 65.592 0.177 1 1 1920 . 20 1 1 A 175 175 ILE CB C 175 37.876 38.031 -0.155 1 1 1923 . 20 1 1 A 175 175 ILE N N 175 118.828 120.121 -1.293 1 1 1924 . 20 1 1 A 176 176 ILE H H 176 8.928 7.993 0.935 1 1 1925 . 20 1 1 A 176 176 ILE HA H 176 3.600 3.544 0.056 1 1 1935 . 20 1 1 A 176 176 ILE C C 176 178.827 178.142 0.685 1 1 1936 . 20 1 1 A 176 176 ILE CA C 176 65.640 65.123 0.517 1 1 1937 . 20 1 1 A 176 176 ILE CB C 176 37.451 37.621 -0.170 1 1 1941 . 20 1 1 A 176 176 ILE N N 176 124.527 119.369 5.158 1 1 1942 . 20 1 1 A 177 177 THR H H 177 8.175 8.095 0.080 1 1 1943 . 20 1 1 A 177 177 THR HA H 177 3.885 3.918 -0.033 1 1 1948 . 20 1 1 A 177 177 THR C C 177 176.867 176.393 0.474 1 1 1949 . 20 1 1 A 177 177 THR CA C 177 67.199 66.412 0.787 1 1 1950 . 20 1 1 A 177 177 THR CB C 177 68.377 68.426 -0.049 1 1 1952 . 20 1 1 A 177 177 THR N N 177 119.412 118.830 0.582 1 1 1953 . 20 1 1 A 178 178 VAL H H 178 8.352 8.189 0.163 1 1 1954 . 20 1 1 A 178 178 VAL HA H 178 3.572 3.434 0.138 1 1 1962 . 20 1 1 A 178 178 VAL C C 178 177.664 177.883 -0.219 1 1 1963 . 20 1 1 A 178 178 VAL CA C 178 66.909 66.443 0.466 1 1 1964 . 20 1 1 A 178 178 VAL CB C 178 31.714 31.349 0.365 1 1 1967 . 20 1 1 A 178 178 VAL N N 178 121.168 121.834 -0.666 1 1 1968 . 20 1 1 A 179 179 SER H H 179 8.529 8.238 0.291 1 1 1969 . 20 1 1 A 179 179 SER HA H 179 3.099 3.113 -0.014 1 1 1972 . 20 1 1 A 179 179 SER C C 179 175.380 176.250 -0.870 1 1 1973 . 20 1 1 A 179 179 SER CA C 179 62.728 61.678 1.050 1 1 1974 . 20 1 1 A 179 179 SER CB C 179 62.802 62.434 0.368 1 1 1975 . 20 1 1 A 179 179 SER N N 179 115.226 115.522 -0.296 1 1 1976 . 20 1 1 A 180 180 SER H H 180 7.757 8.047 -0.290 1 1 1977 . 20 1 1 A 180 180 SER HA H 180 4.419 4.116 0.303 1 1 1980 . 20 1 1 A 180 180 SER C C 180 175.359 176.720 -1.361 1 1 1981 . 20 1 1 A 180 180 SER CA C 180 61.025 61.503 -0.478 1 1 1982 . 20 1 1 A 180 180 SER CB C 180 63.072 62.831 0.241 1 1 1983 . 20 1 1 A 180 180 SER N N 180 114.718 115.901 -1.183 1 1 1984 . 20 1 1 A 181 181 MET H H 181 7.497 8.081 -0.584 1 1 1985 . 20 1 1 A 181 181 MET HA H 181 4.283 4.272 0.011 1 1 1993 . 20 1 1 A 181 181 MET C C 181 177.217 176.805 0.412 1 1 1994 . 20 1 1 A 181 181 MET CA C 181 57.539 57.697 -0.158 1 1 1995 . 20 1 1 A 181 181 MET CB C 181 33.493 32.328 1.165 1 1 1998 . 20 1 1 A 181 181 MET N N 181 119.274 118.870 0.404 1 1 1999 . 20 1 1 A 182 182 LEU H H 182 7.163 7.304 -0.141 1 1 2000 . 20 1 1 A 182 182 LEU HA H 182 4.133 4.354 -0.221 1 1 2010 . 20 1 1 A 182 182 LEU C C 182 176.289 176.711 -0.422 1 1 2011 . 20 1 1 A 182 182 LEU CA C 182 54.750 54.894 -0.144 1 1 2012 . 20 1 1 A 182 182 LEU CB C 182 43.235 42.626 0.609 1 1 2016 . 20 1 1 A 182 182 LEU N N 182 115.869 117.790 -1.921 1 1 2017 . 20 1 1 A 183 183 GLY H H 183 7.492 7.162 0.330 1 1 2018 . 20 1 1 A 183 183 GLY HA2 H 183 4.086 4.166 -0.080 1 1 2019 . 20 1 1 A 183 183 GLY HA3 H 183 4.425 4.215 0.210 1 1 2020 . 20 1 1 A 183 183 GLY C C 183 171.830 171.998 -0.168 1 1 2021 . 20 1 1 A 183 183 GLY CA C 183 46.035 45.913 0.122 1 1 2022 . 20 1 1 A 183 183 GLY N N 183 107.761 106.059 1.702 1 1 2023 . 20 1 1 A 184 184 VAL H H 184 8.099 8.447 -0.348 1 1 2024 . 20 1 1 A 184 184 VAL HA H 184 4.772 4.709 0.063 1 1 2032 . 20 1 1 A 184 184 VAL CA C 184 59.305 59.018 0.287 1 1 2033 . 20 1 1 A 184 184 VAL CB C 184 33.648 35.211 -1.563 1 1 2036 . 20 1 1 A 184 184 VAL N N 184 119.803 121.865 -2.062 1 1 2037 . 20 1 1 A 185 185 PRO HA H 185 4.442 4.732 -0.290 1 1 2042 . 20 1 1 A 185 185 PRO C C 185 175.871 176.254 -0.383 1 1 2043 . 20 1 1 A 185 185 PRO CA C 185 63.886 62.728 1.158 1 1 2044 . 20 1 1 A 185 185 PRO CB C 185 32.260 32.353 -0.093 1 1 2047 . 20 1 1 A 186 186 ALA H H 186 8.222 9.093 -0.871 1 1 2048 . 20 1 1 A 186 186 ALA HA H 186 4.569 4.403 0.166 1 1 2052 . 20 1 1 A 186 186 ALA C C 186 177.481 176.919 0.562 1 1 2053 . 20 1 1 A 186 186 ALA CA C 186 51.823 53.298 -1.475 1 1 2054 . 20 1 1 A 186 186 ALA CB C 186 20.233 19.162 1.071 1 1 2055 . 20 1 1 A 186 186 ALA N N 186 125.663 124.389 1.274 1 1 2056 . 20 1 1 A 187 187 GLN H H 187 8.723 8.116 0.607 1 1 2057 . 20 1 1 A 187 187 GLN HA H 187 4.420 4.468 -0.048 1 1 2063 . 20 1 1 A 187 187 GLN C C 187 175.566 175.437 0.129 1 1 2064 . 20 1 1 A 187 187 GLN CA C 187 56.051 56.252 -0.201 1 1 2065 . 20 1 1 A 187 187 GLN CB C 187 29.812 29.525 0.287 1 1 2067 . 20 1 1 A 187 187 GLN N N 187 120.742 112.799 7.943 1 1 2069 . 20 1 1 A 188 188 GLU H H 188 8.163 8.005 0.158 1 1 2070 . 20 1 1 A 188 188 GLU HA H 188 4.405 4.645 -0.240 1 1 2074 . 20 1 1 A 188 188 GLU C C 188 176.058 177.818 -1.760 1 1 2075 . 20 1 1 A 188 188 GLU CA C 188 56.158 57.043 -0.885 1 1 2076 . 20 1 1 A 188 188 GLU CB C 188 31.095 33.001 -1.906 1 1 2078 . 20 1 1 A 188 188 GLU N N 188 119.177 118.771 0.406 1 1 2079 . 20 1 1 A 189 189 GLU H H 189 8.567 8.373 0.194 1 1 2080 . 20 1 1 A 189 189 GLU HA H 189 4.252 4.121 0.131 1 1 2084 . 20 1 1 A 189 189 GLU C C 189 175.703 176.515 -0.812 1 1 2085 . 20 1 1 A 189 189 GLU CA C 189 56.417 58.982 -2.565 1 1 2086 . 20 1 1 A 189 189 GLU CB C 189 29.968 29.554 0.414 1 1 2088 . 20 1 1 A 189 189 GLU N N 189 120.920 119.434 1.486 1 1 2089 . 20 1 1 A 190 190 ALA H H 190 8.271 7.897 0.374 1 1 2090 . 20 1 1 A 190 190 ALA HA H 190 4.626 4.149 0.477 1 1 2094 . 20 1 1 A 190 190 ALA CA C 190 50.465 52.847 -2.382 1 1 2095 . 20 1 1 A 190 190 ALA CB C 190 18.451 17.917 0.534 1 1 2096 . 20 1 1 A 190 190 ALA N N 190 128.323 120.964 7.359 1 1 2097 . 20 1 1 A 191 191 PRO HA H 191 4.493 4.546 -0.053 1 1 2103 . 20 1 1 A 191 191 PRO C C 191 175.899 176.841 -0.942 1 1 2104 . 20 1 1 A 191 191 PRO CA C 191 62.044 62.455 -0.411 1 1 2105 . 20 1 1 A 191 191 PRO CB C 191 32.184 31.923 0.261 1 1 2108 . 20 1 1 A 192 192 ALA H H 192 8.610 8.261 0.349 1 1 2109 . 20 1 1 A 192 192 ALA HA H 192 4.280 4.484 -0.204 1 1 2113 . 20 1 1 A 192 192 ALA C C 192 178.282 177.899 0.383 1 1 2114 . 20 1 1 A 192 192 ALA CA C 192 51.698 52.248 -0.550 1 1 2115 . 20 1 1 A 192 192 ALA CB C 192 19.220 19.653 -0.433 1 1 2116 . 20 1 1 A 192 192 ALA N N 192 123.420 124.290 -0.870 1 1 2117 . 20 1 1 A 193 193 LYS H H 193 8.531 8.867 -0.336 1 1 2118 . 20 1 1 A 193 193 LYS HA H 193 3.294 3.974 -0.680 1 1 2126 . 20 1 1 A 193 193 LYS C C 193 177.640 178.434 -0.794 1 1 2127 . 20 1 1 A 193 193 LYS CA C 193 60.644 60.124 0.520 1 1 2128 . 20 1 1 A 193 193 LYS CB C 193 32.607 32.188 0.419 1 1 2132 . 20 1 1 A 193 193 LYS N N 193 122.851 121.709 1.142 1 1 2133 . 20 1 1 A 194 194 LEU H H 194 8.570 8.179 0.391 1 1 2134 . 20 1 1 A 194 194 LEU HA H 194 3.845 4.103 -0.258 1 1 2144 . 20 1 1 A 194 194 LEU C C 194 177.965 179.160 -1.195 1 1 2145 . 20 1 1 A 194 194 LEU CA C 194 57.611 57.295 0.316 1 1 2146 . 20 1 1 A 194 194 LEU CB C 194 41.776 40.724 1.052 1 1 2150 . 20 1 1 A 194 194 LEU N N 194 115.801 119.497 -3.696 1 1 2151 . 20 1 1 A 195 195 MET H H 195 6.782 8.073 -1.291 1 1 2152 . 20 1 1 A 195 195 MET HA H 195 4.487 4.127 0.360 1 1 2160 . 20 1 1 A 195 195 MET C C 195 178.280 178.255 0.025 1 1 2161 . 20 1 1 A 195 195 MET CA C 195 56.858 58.229 -1.371 1 1 2162 . 20 1 1 A 195 195 MET CB C 195 31.557 32.162 -0.605 1 1 2165 . 20 1 1 A 195 195 MET N N 195 113.898 119.362 -5.464 1 1 2166 . 20 1 1 A 196 196 VAL H H 196 7.713 7.467 0.246 1 1 2167 . 20 1 1 A 196 196 VAL HA H 196 3.501 3.419 0.082 1 1 2175 . 20 1 1 A 196 196 VAL C C 196 177.624 177.705 -0.081 1 1 2176 . 20 1 1 A 196 196 VAL CA C 196 66.318 65.959 0.359 1 1 2177 . 20 1 1 A 196 196 VAL CB C 196 31.380 31.556 -0.176 1 1 2180 . 20 1 1 A 196 196 VAL N N 196 120.413 119.733 0.680 1 1 2181 . 20 1 1 A 197 197 TYR H H 197 7.972 8.070 -0.098 1 1 2182 . 20 1 1 A 197 197 TYR HA H 197 3.145 4.075 -0.930 1 1 2187 . 20 1 1 A 197 197 TYR C C 197 177.726 177.141 0.585 1 1 2188 . 20 1 1 A 197 197 TYR CA C 197 62.253 61.536 0.717 1 1 2189 . 20 1 1 A 197 197 TYR CB C 197 37.314 38.453 -1.139 1 1 2192 . 20 1 1 A 197 197 TYR N N 197 119.543 120.839 -1.296 1 1 2193 . 20 1 1 A 198 198 LEU H H 198 8.630 8.573 0.057 1 1 2194 . 20 1 1 A 198 198 LEU HA H 198 3.923 3.645 0.278 1 1 2203 . 20 1 1 A 198 198 LEU C C 198 178.074 178.752 -0.678 1 1 2204 . 20 1 1 A 198 198 LEU CA C 198 58.294 58.074 0.220 1 1 2205 . 20 1 1 A 198 198 LEU CB C 198 42.177 41.735 0.442 1 1 2209 . 20 1 1 A 198 198 LEU N N 198 118.430 120.040 -1.610 1 1 2210 . 20 1 1 A 199 199 GLN H H 199 8.082 8.323 -0.241 1 1 2211 . 20 1 1 A 199 199 GLN HA H 199 3.054 3.753 -0.699 1 1 2216 . 20 1 1 A 199 199 GLN C C 199 176.875 177.466 -0.591 1 1 2217 . 20 1 1 A 199 199 GLN CA C 199 59.739 58.161 1.578 1 1 2218 . 20 1 1 A 199 199 GLN CB C 199 28.055 27.683 0.372 1 1 2220 . 20 1 1 A 199 199 GLN N N 199 117.926 117.290 0.636 1 1 2222 . 20 1 1 A 200 200 ARG H H 200 7.349 7.705 -0.356 1 1 2223 . 20 1 1 A 200 200 ARG HA H 200 3.798 3.790 0.008 1 1 2231 . 20 1 1 A 200 200 ARG C C 200 178.037 177.700 0.337 1 1 2232 . 20 1 1 A 200 200 ARG CA C 200 58.260 58.865 -0.605 1 1 2233 . 20 1 1 A 200 200 ARG CB C 200 30.706 30.429 0.277 1 1 2236 . 20 1 1 A 200 200 ARG N N 200 113.772 118.952 -5.180 1 1 2238 . 20 1 1 A 201 201 PHE H H 201 8.329 7.898 0.431 1 1 2239 . 20 1 1 A 201 201 PHE HA H 201 4.630 4.353 0.277 1 1 2244 . 20 1 1 A 201 201 PHE C C 201 176.606 176.017 0.589 1 1 2245 . 20 1 1 A 201 201 PHE CA C 201 59.014 58.963 0.051 1 1 2246 . 20 1 1 A 201 201 PHE CB C 201 40.357 40.453 -0.096 1 1 2249 . 20 1 1 A 201 201 PHE N N 201 114.182 114.714 -0.532 1 1 2250 . 20 1 1 A 202 202 ARG H H 202 8.719 7.755 0.964 1 1 2251 . 20 1 1 A 202 202 ARG HA H 202 5.071 4.763 0.308 1 1 2261 . 20 1 1 A 202 202 ARG CA C 202 53.956 53.889 0.067 1 1 2262 . 20 1 1 A 202 202 ARG CB C 202 31.979 30.622 1.357 1 1 2264 . 20 1 1 A 202 202 ARG N N 202 120.115 117.660 2.455 1 1 2266 . 20 1 1 A 203 203 PRO HA H 203 4.348 4.442 -0.094 1 1 2271 . 20 1 1 A 203 203 PRO C C 203 179.736 178.746 0.990 1 1 2272 . 20 1 1 A 203 203 PRO CA C 203 65.674 65.083 0.591 1 1 2273 . 20 1 1 A 203 203 PRO CB C 203 31.717 32.226 -0.509 1 1 2275 . 20 1 1 A 204 204 LEU H H 204 8.875 7.561 1.314 1 1 2276 . 20 1 1 A 204 204 LEU HA H 204 4.291 4.017 0.274 1 1 2286 . 20 1 1 A 204 204 LEU C C 204 180.353 178.331 2.022 1 1 2287 . 20 1 1 A 204 204 LEU CA C 204 58.012 57.584 0.428 1 1 2288 . 20 1 1 A 204 204 LEU CB C 204 40.893 41.316 -0.423 1 1 2292 . 20 1 1 A 204 204 LEU N N 204 118.940 117.399 1.541 1 1 2293 . 20 1 1 A 205 205 ASP H H 205 7.541 8.400 -0.859 1 1 2294 . 20 1 1 A 205 205 ASP HA H 205 4.622 4.333 0.289 1 1 2297 . 20 1 1 A 205 205 ASP C C 205 177.602 178.400 -0.798 1 1 2298 . 20 1 1 A 205 205 ASP CA C 205 57.437 57.633 -0.196 1 1 2299 . 20 1 1 A 205 205 ASP CB C 205 41.143 40.456 0.687 1 1 2300 . 20 1 1 A 205 205 ASP N N 205 120.838 120.449 0.389 1 1 2301 . 20 1 1 A 206 206 TYR H H 206 8.237 8.360 -0.123 1 1 2302 . 20 1 1 A 206 206 TYR HA H 206 4.018 4.112 -0.094 1 1 2307 . 20 1 1 A 206 206 TYR C C 206 176.433 177.767 -1.334 1 1 2308 . 20 1 1 A 206 206 TYR CA C 206 62.148 62.074 0.074 1 1 2309 . 20 1 1 A 206 206 TYR CB C 206 38.305 38.668 -0.363 1 1 2312 . 20 1 1 A 206 206 TYR N N 206 119.475 121.008 -1.533 1 1 2313 . 20 1 1 A 207 207 GLN H H 207 8.124 8.360 -0.236 1 1 2314 . 20 1 1 A 207 207 GLN HA H 207 3.823 3.207 0.616 1 1 2320 . 20 1 1 A 207 207 GLN C C 207 178.019 178.639 -0.620 1 1 2321 . 20 1 1 A 207 207 GLN CA C 207 58.841 59.033 -0.192 1 1 2322 . 20 1 1 A 207 207 GLN CB C 207 28.208 28.721 -0.513 1 1 2324 . 20 1 1 A 207 207 GLN N N 207 115.863 118.161 -2.298 1 1 2326 . 20 1 1 A 208 208 ARG H H 208 7.522 7.885 -0.363 1 1 2327 . 20 1 1 A 208 208 ARG HA H 208 4.127 4.063 0.064 1 1 2334 . 20 1 1 A 208 208 ARG C C 208 179.278 178.710 0.568 1 1 2335 . 20 1 1 A 208 208 ARG CA C 208 59.419 59.003 0.416 1 1 2336 . 20 1 1 A 208 208 ARG CB C 208 30.182 29.961 0.221 1 1 2338 . 20 1 1 A 208 208 ARG N N 208 118.471 119.663 -1.192 1 1 2340 . 20 1 1 A 209 209 LEU H H 209 7.869 7.986 -0.117 1 1 2341 . 20 1 1 A 209 209 LEU HA H 209 4.091 4.028 0.063 1 1 2351 . 20 1 1 A 209 209 LEU C C 209 179.715 178.915 0.800 1 1 2352 . 20 1 1 A 209 209 LEU CA C 209 57.891 57.980 -0.089 1 1 2353 . 20 1 1 A 209 209 LEU CB C 209 41.338 41.608 -0.270 1 1 2356 . 20 1 1 A 209 209 LEU N N 209 119.659 120.096 -0.437 1 1 2357 . 20 1 1 A 210 210 LEU H H 210 8.034 8.517 -0.483 1 1 2358 . 20 1 1 A 210 210 LEU HA H 210 3.977 3.958 0.019 1 1 2367 . 20 1 1 A 210 210 LEU C C 210 180.363 178.450 1.913 1 1 2368 . 20 1 1 A 210 210 LEU CA C 210 57.459 58.469 -1.010 1 1 2369 . 20 1 1 A 210 210 LEU CB C 210 41.699 41.546 0.153 1 1 2373 . 20 1 1 A 210 210 LEU N N 210 120.967 120.015 0.952 1 1 2374 . 20 1 1 A 211 211 GLU H H 211 8.174 8.735 -0.561 1 1 2375 . 20 1 1 A 211 211 GLU HA H 211 4.075 3.978 0.097 1 1 2379 . 20 1 1 A 211 211 GLU C C 211 178.499 178.227 0.272 1 1 2380 . 20 1 1 A 211 211 GLU CA C 211 58.575 59.547 -0.972 1 1 2381 . 20 1 1 A 211 211 GLU CB C 211 29.583 29.295 0.288 1 1 2383 . 20 1 1 A 211 211 GLU N N 211 119.217 118.126 1.091 1 1 2384 . 20 1 1 A 212 212 ALA H H 212 7.723 7.819 -0.096 1 1 2385 . 20 1 1 A 212 212 ALA HA H 212 4.291 4.256 0.035 1 1 2389 . 20 1 1 A 212 212 ALA C C 212 178.770 177.910 0.860 1 1 2390 . 20 1 1 A 212 212 ALA CA C 212 53.966 53.432 0.534 1 1 2391 . 20 1 1 A 212 212 ALA CB C 212 19.117 18.865 0.252 1 1 2392 . 20 1 1 A 212 212 ALA N N 212 121.798 122.206 -0.408 1 1 2393 . 20 1 1 A 213 213 ALA H H 213 7.743 7.690 0.053 1 1 2394 . 20 1 1 A 213 213 ALA HA H 213 4.406 4.401 0.005 1 1 2398 . 20 1 1 A 213 213 ALA C C 213 178.413 177.450 0.963 1 1 2399 . 20 1 1 A 213 213 ALA CA C 213 53.129 52.021 1.108 1 1 2400 . 20 1 1 A 213 213 ALA CB C 213 18.926 20.258 -1.332 1 1 2401 . 20 1 1 A 213 213 ALA N N 213 120.435 119.833 0.602 1 1 2402 . 20 1 1 A 214 214 SER H H 214 7.944 8.399 -0.455 1 1 2403 . 20 1 1 A 214 214 SER HA H 214 4.559 4.431 0.128 1 1 2406 . 20 1 1 A 214 214 SER C C 214 174.958 174.445 0.513 1 1 2407 . 20 1 1 A 214 214 SER CA C 214 58.640 58.063 0.577 1 1 2408 . 20 1 1 A 214 214 SER CB C 214 63.928 62.726 1.202 1 1 2409 . 20 1 1 A 214 214 SER N N 214 113.729 114.453 -0.724 1 1 2410 . 20 1 1 A 215 215 SER H H 215 8.255 8.675 -0.420 1 1 2411 . 20 1 1 A 215 215 SER HA H 215 4.547 4.741 -0.194 1 1 2413 . 20 1 1 A 215 215 SER C C 215 175.289 174.918 0.371 1 1 2414 . 20 1 1 A 215 215 SER CA C 215 58.833 58.269 0.564 1 1 2415 . 20 1 1 A 215 215 SER CB C 215 63.847 64.944 -1.097 1 1 2416 . 20 1 1 A 215 215 SER N N 215 117.674 124.921 -7.247 1 1 2417 . 20 1 1 A 216 216 GLY H H 216 8.431 8.109 0.322 1 1 2418 . 20 1 1 A 216 216 GLY HA2 H 216 4.054 3.969 0.085 1 1 2419 . 20 1 1 A 216 216 GLY C C 216 174.189 174.652 -0.463 1 1 2420 . 20 1 1 A 216 216 GLY CA C 216 45.412 46.606 -1.194 1 1 2421 . 20 1 1 A 216 216 GLY N N 216 110.800 109.574 1.226 1 1 2422 . 20 1 1 A 217 217 GLU H H 217 8.267 8.129 0.138 1 1 2423 . 20 1 1 A 217 217 GLU HA H 217 4.345 4.503 -0.158 1 1 2427 . 20 1 1 A 217 217 GLU C C 217 176.428 175.483 0.945 1 1 2428 . 20 1 1 A 217 217 GLU CA C 217 56.470 55.643 0.827 1 1 2429 . 20 1 1 A 217 217 GLU CB C 217 30.526 29.122 1.404 1 1 2430 . 20 1 1 A 217 217 GLU N N 217 120.726 120.800 -0.074 1 1 2431 . 20 1 1 A 218 218 ALA H H 218 8.476 8.545 -0.069 1 1 2432 . 20 1 1 A 218 218 ALA HA H 218 4.467 4.885 -0.418 1 1 2436 . 20 1 1 A 218 218 ALA C C 218 178.015 176.539 1.476 1 1 2437 . 20 1 1 A 218 218 ALA CA C 218 52.547 50.645 1.902 1 1 2438 . 20 1 1 A 218 218 ALA CB C 218 19.242 19.728 -0.486 1 1 2439 . 20 1 1 A 218 218 ALA N N 218 125.534 129.952 -4.418 1 1 2440 . 20 1 1 A 219 219 THR H H 219 8.232 8.745 -0.513 1 1 2441 . 20 1 1 A 219 219 THR HA H 219 4.411 4.984 -0.573 1 1 2446 . 20 1 1 A 219 219 THR C C 219 175.327 172.610 2.717 1 1 2447 . 20 1 1 A 219 219 THR CA C 219 61.889 60.008 1.881 1 1 2448 . 20 1 1 A 219 219 THR CB C 219 69.939 70.722 -0.783 1 1 2449 . 20 1 1 A 219 219 THR N N 219 113.242 117.207 -3.965 1 1 2450 . 20 1 1 A 220 220 GLY H H 220 8.418 8.363 0.055 1 1 2451 . 20 1 1 A 220 220 GLY C C 220 174.037 174.134 -0.097 1 1 2452 . 20 1 1 A 220 220 GLY CA C 220 45.408 45.545 -0.137 1 1 2453 . 20 1 1 A 220 220 GLY N N 220 111.031 112.307 -1.276 1 1 2454 . 20 1 1 A 221 221 ASP H H 221 8.345 8.675 -0.330 1 1 2455 . 20 1 1 A 221 221 ASP HA H 221 4.700 4.668 0.032 1 1 2458 . 20 1 1 A 221 221 ASP C C 221 176.535 175.324 1.211 1 1 2459 . 20 1 1 A 221 221 ASP CA C 221 54.402 54.864 -0.462 1 1 2460 . 20 1 1 A 221 221 ASP CB C 221 41.431 39.544 1.887 1 1 2461 . 20 1 1 A 221 221 ASP N N 221 120.795 120.660 0.135 1 1 2462 . 20 1 1 A 222 222 SER H H 222 8.353 8.396 -0.043 1 1 2463 . 20 1 1 A 222 222 SER HA H 222 4.493 4.416 0.077 1 1 2465 . 20 1 1 A 222 222 SER C C 222 174.224 174.265 -0.041 1 1 2466 . 20 1 1 A 222 222 SER CA C 222 58.427 60.597 -2.170 1 1 2467 . 20 1 1 A 222 222 SER CB C 222 63.860 63.559 0.301 1 1 2468 . 20 1 1 A 222 222 SER N N 222 116.220 120.572 -4.352 1 1 2469 . 20 1 1 A 223 223 ALA H H 223 8.381 8.597 -0.216 1 1 2470 . 20 1 1 A 223 223 ALA HA H 223 4.461 4.437 0.024 1 1 2474 . 20 1 1 A 223 223 ALA C C 223 176.926 176.378 0.548 1 1 2475 . 20 1 1 A 223 223 ALA CA C 223 52.583 51.396 1.187 1 1 2476 . 20 1 1 A 223 223 ALA CB C 223 19.438 17.366 2.072 1 1 2477 . 20 1 1 A 223 223 ALA N N 223 126.592 130.219 -3.627 1 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Assigned_chem_shift_list_ID _SPARTA_output.Conformer_ID _SPARTA_output.Entity_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Entity_delta_chem_shifts_ID 1 1 1 1 "RMS(OBS, PRED)" C 207 1.012 1 2 1 1 1 "RMS(OBS, PRED)" CA 222 1.004 1 3 1 1 1 "RMS(OBS, PRED)" CB 202 0.979 1 4 1 1 1 "RMS(OBS, PRED)" H 211 0.603 1 5 1 1 1 "RMS(OBS, PRED)" HA 236 0.332 1 6 1 1 1 "RMS(OBS, PRED)" N 209 2.894 1 7 1 2 1 "RMS(OBS, PRED)" C 207 0.989 1 8 1 2 1 "RMS(OBS, PRED)" CA 222 1.030 1 9 1 2 1 "RMS(OBS, PRED)" CB 202 1.107 1 10 1 2 1 "RMS(OBS, PRED)" H 211 0.590 1 11 1 2 1 "RMS(OBS, PRED)" HA 236 0.313 1 12 1 2 1 "RMS(OBS, PRED)" N 209 2.872 1 13 1 3 1 "RMS(OBS, PRED)" C 207 0.978 1 14 1 3 1 "RMS(OBS, PRED)" CA 222 1.078 1 15 1 3 1 "RMS(OBS, PRED)" CB 202 1.124 1 16 1 3 1 "RMS(OBS, PRED)" H 211 0.588 1 17 1 3 1 "RMS(OBS, PRED)" HA 236 0.308 1 18 1 3 1 "RMS(OBS, PRED)" N 209 2.894 1 19 1 4 1 "RMS(OBS, PRED)" C 207 0.966 1 20 1 4 1 "RMS(OBS, PRED)" CA 222 1.050 1 21 1 4 1 "RMS(OBS, PRED)" CB 202 1.086 1 22 1 4 1 "RMS(OBS, PRED)" H 211 0.584 1 23 1 4 1 "RMS(OBS, PRED)" HA 236 0.318 1 24 1 4 1 "RMS(OBS, PRED)" N 209 2.957 1 25 1 5 1 "RMS(OBS, PRED)" C 207 0.966 1 26 1 5 1 "RMS(OBS, PRED)" CA 222 1.070 1 27 1 5 1 "RMS(OBS, PRED)" CB 202 1.143 1 28 1 5 1 "RMS(OBS, PRED)" H 211 0.585 1 29 1 5 1 "RMS(OBS, PRED)" HA 236 0.299 1 30 1 5 1 "RMS(OBS, PRED)" N 209 3.060 1 31 1 6 1 "RMS(OBS, PRED)" C 207 0.991 1 32 1 6 1 "RMS(OBS, PRED)" CA 222 1.017 1 33 1 6 1 "RMS(OBS, PRED)" CB 202 1.150 1 34 1 6 1 "RMS(OBS, PRED)" H 211 0.598 1 35 1 6 1 "RMS(OBS, PRED)" HA 236 0.316 1 36 1 6 1 "RMS(OBS, PRED)" N 209 2.987 1 37 1 7 1 "RMS(OBS, PRED)" C 207 0.975 1 38 1 7 1 "RMS(OBS, PRED)" CA 222 1.029 1 39 1 7 1 "RMS(OBS, PRED)" CB 202 0.953 1 40 1 7 1 "RMS(OBS, PRED)" H 211 0.589 1 41 1 7 1 "RMS(OBS, PRED)" HA 236 0.305 1 42 1 7 1 "RMS(OBS, PRED)" N 209 3.027 1 43 1 8 1 "RMS(OBS, PRED)" C 207 0.952 1 44 1 8 1 "RMS(OBS, PRED)" CA 222 1.053 1 45 1 8 1 "RMS(OBS, PRED)" CB 202 1.119 1 46 1 8 1 "RMS(OBS, PRED)" H 211 0.603 1 47 1 8 1 "RMS(OBS, PRED)" HA 236 0.302 1 48 1 8 1 "RMS(OBS, PRED)" N 209 2.982 1 49 1 9 1 "RMS(OBS, PRED)" C 207 0.996 1 50 1 9 1 "RMS(OBS, PRED)" CA 222 1.068 1 51 1 9 1 "RMS(OBS, PRED)" CB 202 1.097 1 52 1 9 1 "RMS(OBS, PRED)" H 211 0.589 1 53 1 9 1 "RMS(OBS, PRED)" HA 236 0.320 1 54 1 9 1 "RMS(OBS, PRED)" N 209 2.921 1 55 1 10 1 "RMS(OBS, PRED)" C 207 0.988 1 56 1 10 1 "RMS(OBS, PRED)" CA 222 1.056 1 57 1 10 1 "RMS(OBS, PRED)" CB 202 0.981 1 58 1 10 1 "RMS(OBS, PRED)" H 211 0.579 1 59 1 10 1 "RMS(OBS, PRED)" HA 236 0.308 1 60 1 10 1 "RMS(OBS, PRED)" N 209 2.825 1 61 1 11 1 "RMS(OBS, PRED)" C 207 0.959 1 62 1 11 1 "RMS(OBS, PRED)" CA 222 1.113 1 63 1 11 1 "RMS(OBS, PRED)" CB 202 1.104 1 64 1 11 1 "RMS(OBS, PRED)" H 211 0.589 1 65 1 11 1 "RMS(OBS, PRED)" HA 236 0.329 1 66 1 11 1 "RMS(OBS, PRED)" N 209 3.005 1 67 1 12 1 "RMS(OBS, PRED)" C 207 0.962 1 68 1 12 1 "RMS(OBS, PRED)" CA 222 0.989 1 69 1 12 1 "RMS(OBS, PRED)" CB 202 1.104 1 70 1 12 1 "RMS(OBS, PRED)" H 211 0.604 1 71 1 12 1 "RMS(OBS, PRED)" HA 236 0.307 1 72 1 12 1 "RMS(OBS, PRED)" N 209 2.959 1 73 1 13 1 "RMS(OBS, PRED)" C 207 1.035 1 74 1 13 1 "RMS(OBS, PRED)" CA 222 1.082 1 75 1 13 1 "RMS(OBS, PRED)" CB 202 1.125 1 76 1 13 1 "RMS(OBS, PRED)" H 211 0.606 1 77 1 13 1 "RMS(OBS, PRED)" HA 236 0.339 1 78 1 13 1 "RMS(OBS, PRED)" N 209 3.150 1 79 1 14 1 "RMS(OBS, PRED)" C 207 0.972 1 80 1 14 1 "RMS(OBS, PRED)" CA 222 1.068 1 81 1 14 1 "RMS(OBS, PRED)" CB 202 1.072 1 82 1 14 1 "RMS(OBS, PRED)" H 211 0.616 1 83 1 14 1 "RMS(OBS, PRED)" HA 236 0.308 1 84 1 14 1 "RMS(OBS, PRED)" N 209 3.070 1 85 1 15 1 "RMS(OBS, PRED)" C 207 0.930 1 86 1 15 1 "RMS(OBS, PRED)" CA 222 0.949 1 87 1 15 1 "RMS(OBS, PRED)" CB 202 1.072 1 88 1 15 1 "RMS(OBS, PRED)" H 211 0.579 1 89 1 15 1 "RMS(OBS, PRED)" HA 236 0.316 1 90 1 15 1 "RMS(OBS, PRED)" N 209 2.989 1 91 1 16 1 "RMS(OBS, PRED)" C 207 1.012 1 92 1 16 1 "RMS(OBS, PRED)" CA 222 1.046 1 93 1 16 1 "RMS(OBS, PRED)" CB 202 1.199 1 94 1 16 1 "RMS(OBS, PRED)" H 211 0.580 1 95 1 16 1 "RMS(OBS, PRED)" HA 236 0.317 1 96 1 16 1 "RMS(OBS, PRED)" N 209 2.890 1 97 1 17 1 "RMS(OBS, PRED)" C 207 0.978 1 98 1 17 1 "RMS(OBS, PRED)" CA 222 1.005 1 99 1 17 1 "RMS(OBS, PRED)" CB 202 1.130 1 100 1 17 1 "RMS(OBS, PRED)" H 211 0.621 1 101 1 17 1 "RMS(OBS, PRED)" HA 236 0.321 1 102 1 17 1 "RMS(OBS, PRED)" N 209 2.703 1 103 1 18 1 "RMS(OBS, PRED)" C 207 1.009 1 104 1 18 1 "RMS(OBS, PRED)" CA 222 1.078 1 105 1 18 1 "RMS(OBS, PRED)" CB 202 1.055 1 106 1 18 1 "RMS(OBS, PRED)" H 211 0.596 1 107 1 18 1 "RMS(OBS, PRED)" HA 236 0.331 1 108 1 18 1 "RMS(OBS, PRED)" N 209 2.896 1 109 1 19 1 "RMS(OBS, PRED)" C 207 0.997 1 110 1 19 1 "RMS(OBS, PRED)" CA 222 1.047 1 111 1 19 1 "RMS(OBS, PRED)" CB 202 1.061 1 112 1 19 1 "RMS(OBS, PRED)" H 211 0.620 1 113 1 19 1 "RMS(OBS, PRED)" HA 236 0.315 1 114 1 19 1 "RMS(OBS, PRED)" N 209 3.062 1 115 1 20 1 "RMS(OBS, PRED)" C 207 0.928 1 116 1 20 1 "RMS(OBS, PRED)" CA 222 1.031 1 117 1 20 1 "RMS(OBS, PRED)" CB 202 1.004 1 118 1 20 1 "RMS(OBS, PRED)" H 211 0.599 1 119 1 20 1 "RMS(OBS, PRED)" HA 236 0.314 1 120 1 20 1 "RMS(OBS, PRED)" N 209 3.083 1 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Conformer_type "average" _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 1 . 1 1 A 2 2 ALA HA H 2 4.274 4.679 -0.405 2 1 5 . 1 1 A 2 2 ALA C C 2 177.828 176.508 1.320 2 1 6 . 1 1 A 2 2 ALA CA C 2 52.984 51.656 1.328 2 1 7 . 1 1 A 2 2 ALA CB C 2 19.138 20.667 -1.529 2 1 8 . 1 1 A 3 3 GLN H H 3 8.463 8.535 -0.072 2 1 9 . 1 1 A 3 3 GLN HA H 3 4.676 4.669 0.007 2 1 12 . 1 1 A 3 3 GLN C C 3 176.002 176.240 -0.238 2 1 13 . 1 1 A 3 3 GLN CA C 3 56.258 55.394 0.864 2 1 14 . 1 1 A 3 3 GLN CB C 3 30.346 30.334 0.012 2 1 15 . 1 1 A 3 3 GLN N N 3 117.490 119.971 -2.481 2 1 16 . 1 1 A 4 4 GLY H H 4 8.099 8.469 -0.370 2 1 17 . 1 1 A 4 4 GLY HA2 H 4 3.910 3.996 -0.086 2 1 18 . 1 1 A 4 4 GLY C C 4 173.332 173.738 -0.406 2 1 19 . 1 1 A 4 4 GLY CA C 4 45.333 46.482 -1.149 2 1 20 . 1 1 A 4 4 GLY N N 4 109.423 110.679 -1.256 2 1 21 . 1 1 A 5 5 LEU H H 5 7.863 8.283 -0.420 2 1 22 . 1 1 A 5 5 LEU HA H 5 4.561 4.820 -0.259 2 1 32 . 1 1 A 5 5 LEU C C 5 176.448 175.982 0.466 2 1 33 . 1 1 A 5 5 LEU CA C 5 54.713 54.181 0.532 2 1 34 . 1 1 A 5 5 LEU CB C 5 43.551 41.717 1.834 2 1 38 . 1 1 A 5 5 LEU N N 5 120.391 123.891 -3.499 2 1 39 . 1 1 A 6 6 ILE H H 6 8.764 9.249 -0.485 2 1 40 . 1 1 A 6 6 ILE HA H 6 4.087 4.145 -0.058 2 1 49 . 1 1 A 6 6 ILE C C 6 174.679 175.523 -0.844 2 1 50 . 1 1 A 6 6 ILE CA C 6 61.279 61.677 -0.398 2 1 51 . 1 1 A 6 6 ILE CB C 6 39.651 37.787 1.864 2 1 54 . 1 1 A 6 6 ILE N N 6 123.050 125.725 -2.675 2 1 55 . 1 1 A 7 7 GLU H H 7 8.587 8.666 -0.079 2 1 56 . 1 1 A 7 7 GLU HA H 7 4.917 4.788 0.129 2 1 61 . 1 1 A 7 7 GLU C C 7 175.978 175.953 0.025 2 1 62 . 1 1 A 7 7 GLU CA C 7 56.127 56.125 0.002 2 1 63 . 1 1 A 7 7 GLU CB C 7 31.115 30.342 0.773 2 1 65 . 1 1 A 7 7 GLU N N 7 127.415 128.008 -0.593 2 1 66 . 1 1 A 8 8 VAL H H 8 8.986 9.248 -0.262 2 1 67 . 1 1 A 8 8 VAL HA H 8 4.375 4.933 -0.558 2 1 72 . 1 1 A 8 8 VAL C C 8 173.704 174.889 -1.185 2 1 73 . 1 1 A 8 8 VAL CA C 8 61.347 60.355 0.992 2 1 74 . 1 1 A 8 8 VAL CB C 8 33.611 34.025 -0.414 2 1 76 . 1 1 A 8 8 VAL N N 8 126.071 121.186 4.885 2 1 77 . 1 1 A 9 9 GLU H H 9 8.521 9.119 -0.598 2 1 78 . 1 1 A 9 9 GLU HA H 9 5.837 5.523 0.314 2 1 81 . 1 1 A 9 9 GLU C C 9 175.939 174.778 1.161 2 1 82 . 1 1 A 9 9 GLU CA C 9 54.516 54.543 -0.027 2 1 83 . 1 1 A 9 9 GLU CB C 9 33.009 33.745 -0.736 2 1 84 . 1 1 A 9 9 GLU N N 9 122.857 124.378 -1.521 2 1 85 . 1 1 A 10 10 ARG H H 10 8.690 8.661 0.029 2 1 86 . 1 1 A 10 10 ARG HA H 10 4.709 5.003 -0.294 2 1 94 . 1 1 A 10 10 ARG C C 10 174.826 174.220 0.606 2 1 95 . 1 1 A 10 10 ARG CA C 10 54.491 54.510 -0.019 2 1 96 . 1 1 A 10 10 ARG CB C 10 35.777 34.643 1.134 2 1 98 . 1 1 A 10 10 ARG N N 10 120.430 121.019 -0.589 2 1 100 . 1 1 A 11 11 LYS H H 11 8.874 8.724 0.150 2 1 101 . 1 1 A 11 11 LYS HA H 11 5.530 5.345 0.185 2 1 107 . 1 1 A 11 11 LYS C C 11 176.919 174.953 1.966 2 1 108 . 1 1 A 11 11 LYS CA C 11 55.084 54.901 0.183 2 1 109 . 1 1 A 11 11 LYS CB C 11 35.435 36.075 -0.640 2 1 113 . 1 1 A 11 11 LYS N N 11 121.087 123.710 -2.623 2 1 114 . 1 1 A 12 12 PHE H H 12 8.877 9.090 -0.213 2 1 115 . 1 1 A 12 12 PHE HA H 12 5.130 5.211 -0.081 2 1 120 . 1 1 A 12 12 PHE C C 12 171.676 172.228 -0.552 2 1 121 . 1 1 A 12 12 PHE CA C 12 55.869 56.165 -0.296 2 1 122 . 1 1 A 12 12 PHE CB C 12 42.108 41.898 0.210 2 1 125 . 1 1 A 12 12 PHE N N 12 117.486 120.175 -2.690 2 1 126 . 1 1 A 13 13 ALA H H 13 9.134 9.341 -0.207 2 1 127 . 1 1 A 13 13 ALA HA H 13 5.003 4.732 0.271 2 1 131 . 1 1 A 13 13 ALA CA C 13 48.340 48.894 -0.554 2 1 132 . 1 1 A 13 13 ALA CB C 13 19.191 20.242 -1.051 2 1 133 . 1 1 A 13 13 ALA N N 13 125.915 123.256 2.659 2 1 134 . 1 1 A 14 14 PRO HA H 14 4.620 4.883 -0.263 2 1 140 . 1 1 A 14 14 PRO C C 14 176.502 177.304 -0.802 2 1 141 . 1 1 A 14 14 PRO CA C 14 62.672 62.474 0.198 2 1 142 . 1 1 A 14 14 PRO CB C 14 33.119 32.354 0.765 2 1 145 . 1 1 A 15 15 GLY H H 15 8.721 8.534 0.187 2 1 146 . 1 1 A 15 15 GLY HA2 H 15 3.999 4.078 -0.079 2 1 147 . 1 1 A 15 15 GLY HA3 H 15 4.632 4.082 0.550 2 1 148 . 1 1 A 15 15 GLY CA C 15 44.411 44.055 0.356 2 1 149 . 1 1 A 15 15 GLY N N 15 109.863 108.200 1.663 2 1 150 . 1 1 A 16 16 PRO HA H 16 4.447 4.448 -0.001 2 1 155 . 1 1 A 16 16 PRO C C 16 177.053 176.810 0.243 2 1 156 . 1 1 A 16 16 PRO CA C 16 64.395 64.414 -0.019 2 1 157 . 1 1 A 16 16 PRO CB C 16 31.993 31.862 0.131 2 1 159 . 1 1 A 17 17 ASP H H 17 8.550 8.510 0.040 2 1 160 . 1 1 A 17 17 ASP HA H 17 4.950 4.806 0.144 2 1 163 . 1 1 A 17 17 ASP C C 17 176.800 176.932 -0.132 2 1 164 . 1 1 A 17 17 ASP CA C 17 53.271 53.735 -0.464 2 1 165 . 1 1 A 17 17 ASP CB C 17 40.392 40.990 -0.598 2 1 166 . 1 1 A 17 17 ASP N N 17 116.060 117.143 -1.083 2 1 167 . 1 1 A 18 18 THR H H 18 7.664 7.494 0.170 2 1 168 . 1 1 A 18 18 THR HA H 18 4.120 3.719 0.401 2 1 174 . 1 1 A 18 18 THR C C 18 175.407 176.350 -0.943 2 1 175 . 1 1 A 18 18 THR CA C 18 68.718 67.199 1.519 2 1 176 . 1 1 A 18 18 THR CB C 18 69.179 68.515 0.664 2 1 178 . 1 1 A 18 18 THR N N 18 117.158 115.705 1.453 2 1 179 . 1 1 A 19 19 GLU H H 19 8.817 8.460 0.357 2 1 180 . 1 1 A 19 19 GLU HA H 19 3.510 3.304 0.206 2 1 184 . 1 1 A 19 19 GLU C C 19 178.345 179.182 -0.837 2 1 185 . 1 1 A 19 19 GLU CA C 19 61.237 59.738 1.499 2 1 186 . 1 1 A 19 19 GLU CB C 19 28.746 29.349 -0.603 2 1 188 . 1 1 A 19 19 GLU N N 19 118.802 118.979 -0.177 2 1 189 . 1 1 A 20 20 GLU H H 20 7.976 8.069 -0.093 2 1 190 . 1 1 A 20 20 GLU HA H 20 4.036 4.110 -0.074 2 1 194 . 1 1 A 20 20 GLU C C 20 179.451 179.279 0.172 2 1 195 . 1 1 A 20 20 GLU CA C 20 59.909 58.991 0.918 2 1 196 . 1 1 A 20 20 GLU CB C 20 28.992 29.359 -0.367 2 1 198 . 1 1 A 20 20 GLU N N 20 121.130 119.765 1.365 2 1 199 . 1 1 A 21 21 ARG H H 21 8.199 8.014 0.185 2 1 200 . 1 1 A 21 21 ARG HA H 21 4.061 4.070 -0.009 2 1 207 . 1 1 A 21 21 ARG C C 21 179.087 178.787 0.300 2 1 208 . 1 1 A 21 21 ARG CA C 21 58.477 58.628 -0.151 2 1 209 . 1 1 A 21 21 ARG CB C 21 30.101 29.958 0.143 2 1 211 . 1 1 A 21 21 ARG N N 21 119.897 120.363 -0.466 2 1 213 . 1 1 A 22 22 LEU H H 22 8.154 8.482 -0.328 2 1 214 . 1 1 A 22 22 LEU HA H 22 3.560 3.761 -0.201 2 1 224 . 1 1 A 22 22 LEU C C 22 178.461 179.286 -0.825 2 1 225 . 1 1 A 22 22 LEU CA C 22 58.432 57.698 0.734 2 1 226 . 1 1 A 22 22 LEU CB C 22 40.229 40.886 -0.657 2 1 230 . 1 1 A 22 22 LEU N N 22 120.012 119.626 0.386 2 1 231 . 1 1 A 23 23 GLN H H 23 7.621 7.885 -0.264 2 1 232 . 1 1 A 23 23 GLN HA H 23 4.232 4.071 0.161 2 1 238 . 1 1 A 23 23 GLN C C 23 180.543 178.580 1.963 2 1 239 . 1 1 A 23 23 GLN CA C 23 59.434 59.234 0.200 2 1 240 . 1 1 A 23 23 GLN CB C 23 28.749 28.416 0.333 2 1 242 . 1 1 A 23 23 GLN N N 23 117.823 117.863 -0.040 2 1 244 . 1 1 A 24 24 GLU H H 24 8.165 7.791 0.374 2 1 245 . 1 1 A 24 24 GLU HA H 24 4.072 4.114 -0.042 2 1 249 . 1 1 A 24 24 GLU C C 24 178.612 179.196 -0.584 2 1 250 . 1 1 A 24 24 GLU CA C 24 59.236 59.041 0.195 2 1 251 . 1 1 A 24 24 GLU CB C 24 29.606 29.395 0.210 2 1 253 . 1 1 A 24 24 GLU N N 24 122.589 119.943 2.646 2 1 254 . 1 1 A 25 25 LEU H H 25 7.911 7.910 0.001 2 1 255 . 1 1 A 25 25 LEU HA H 25 4.214 4.104 0.110 2 1 265 . 1 1 A 25 25 LEU C C 25 176.745 177.205 -0.460 2 1 266 . 1 1 A 25 25 LEU CA C 25 55.659 55.845 -0.186 2 1 267 . 1 1 A 25 25 LEU CB C 25 43.109 42.757 0.352 2 1 271 . 1 1 A 25 25 LEU N N 25 117.882 117.504 0.378 2 1 272 . 1 1 A 26 26 GLY H H 26 7.776 7.912 -0.136 2 1 273 . 1 1 A 26 26 GLY HA2 H 26 4.337 4.036 0.301 2 1 274 . 1 1 A 26 26 GLY HA3 H 26 3.856 4.050 -0.194 2 1 275 . 1 1 A 26 26 GLY C C 26 175.456 174.633 0.823 2 1 276 . 1 1 A 26 26 GLY CA C 26 44.875 45.187 -0.312 2 1 277 . 1 1 A 26 26 GLY N N 26 104.938 105.713 -0.775 2 1 278 . 1 1 A 27 27 ALA H H 27 8.104 8.414 -0.310 2 1 279 . 1 1 A 27 27 ALA HA H 27 4.949 4.573 0.376 2 1 283 . 1 1 A 27 27 ALA C C 27 176.448 177.195 -0.747 2 1 284 . 1 1 A 27 27 ALA CA C 27 52.183 52.367 -0.184 2 1 285 . 1 1 A 27 27 ALA CB C 27 21.814 19.992 1.822 2 1 286 . 1 1 A 27 27 ALA N N 27 123.263 124.244 -0.981 2 1 287 . 1 1 A 28 28 THR H H 28 9.369 9.220 0.149 2 1 288 . 1 1 A 28 28 THR HA H 28 4.779 4.834 -0.055 2 1 293 . 1 1 A 28 28 THR C C 28 173.725 173.743 -0.018 2 1 294 . 1 1 A 28 28 THR CA C 28 60.046 61.303 -1.257 2 1 295 . 1 1 A 28 28 THR CB C 28 70.592 70.211 0.381 2 1 297 . 1 1 A 28 28 THR N N 28 112.201 117.513 -5.312 2 1 298 . 1 1 A 29 29 LEU H H 29 8.518 8.523 -0.005 2 1 299 . 1 1 A 29 29 LEU HA H 29 3.332 3.809 -0.477 2 1 309 . 1 1 A 29 29 LEU C C 29 176.202 176.126 0.076 2 1 310 . 1 1 A 29 29 LEU CA C 29 55.031 54.566 0.466 2 1 311 . 1 1 A 29 29 LEU CB C 29 40.624 41.572 -0.948 2 1 315 . 1 1 A 29 29 LEU N N 29 128.151 128.163 -0.012 2 1 316 . 1 1 A 30 30 GLU H H 30 9.269 9.116 0.153 2 1 317 . 1 1 A 30 30 GLU HA H 30 4.287 4.290 -0.003 2 1 321 . 1 1 A 30 30 GLU C C 30 176.740 176.193 0.547 2 1 322 . 1 1 A 30 30 GLU CA C 30 57.283 57.702 -0.419 2 1 323 . 1 1 A 30 30 GLU CB C 30 31.045 30.722 0.323 2 1 325 . 1 1 A 30 30 GLU N N 30 130.123 124.435 5.688 2 1 326 . 1 1 A 31 31 HIS H H 31 7.341 7.166 0.175 2 1 327 . 1 1 A 31 31 HIS HA H 31 4.701 5.036 -0.335 2 1 331 . 1 1 A 31 31 HIS C C 31 172.581 173.468 -0.887 2 1 332 . 1 1 A 31 31 HIS CA C 31 55.876 54.898 0.978 2 1 333 . 1 1 A 31 31 HIS CB C 31 33.434 33.807 -0.373 2 1 334 . 1 1 A 31 31 HIS N N 31 113.223 115.771 -2.548 2 1 335 . 1 1 A 32 32 ARG H H 32 8.196 8.729 -0.533 2 1 336 . 1 1 A 32 32 ARG HA H 32 5.262 5.202 0.060 2 1 341 . 1 1 A 32 32 ARG C C 32 174.377 174.635 -0.258 2 1 342 . 1 1 A 32 32 ARG CA C 32 55.808 54.664 1.144 2 1 343 . 1 1 A 32 32 ARG CB C 32 33.340 33.761 -0.421 2 1 345 . 1 1 A 32 32 ARG N N 32 123.003 121.652 1.351 2 1 346 . 1 1 A 33 33 VAL H H 33 8.956 9.250 -0.294 2 1 347 . 1 1 A 33 33 VAL HA H 33 4.734 4.910 -0.176 2 1 355 . 1 1 A 33 33 VAL C C 33 172.821 174.928 -2.107 2 1 356 . 1 1 A 33 33 VAL CA C 33 60.197 60.128 0.069 2 1 357 . 1 1 A 33 33 VAL CB C 33 35.860 34.839 1.021 2 1 360 . 1 1 A 33 33 VAL N N 33 122.929 120.480 2.449 2 1 361 . 1 1 A 34 34 THR H H 34 8.250 8.742 -0.491 2 1 362 . 1 1 A 34 34 THR HA H 34 5.616 5.682 -0.066 2 1 367 . 1 1 A 34 34 THR C C 34 173.913 173.498 0.415 2 1 368 . 1 1 A 34 34 THR CA C 34 60.245 60.418 -0.173 2 1 369 . 1 1 A 34 34 THR CB C 34 71.706 71.188 0.518 2 1 371 . 1 1 A 34 34 THR N N 34 119.164 116.952 2.212 2 1 372 . 1 1 A 35 35 PHE H H 35 8.565 8.639 -0.074 2 1 373 . 1 1 A 35 35 PHE HA H 35 5.029 5.155 -0.126 2 1 378 . 1 1 A 35 35 PHE C C 35 173.193 172.470 0.723 2 1 379 . 1 1 A 35 35 PHE CA C 35 55.687 56.002 -0.315 2 1 380 . 1 1 A 35 35 PHE CB C 35 40.853 41.392 -0.539 2 1 383 . 1 1 A 35 35 PHE N N 35 120.244 118.648 1.596 2 1 384 . 1 1 A 36 36 ARG H H 36 8.869 8.722 0.147 2 1 385 . 1 1 A 36 36 ARG HA H 36 4.982 4.956 0.026 2 1 387 . 1 1 A 36 36 ARG C C 36 174.743 174.646 0.097 2 1 388 . 1 1 A 36 36 ARG CA C 36 55.493 54.965 0.528 2 1 389 . 1 1 A 36 36 ARG CB C 36 32.228 32.610 -0.382 2 1 390 . 1 1 A 36 36 ARG N N 36 123.893 120.359 3.535 2 1 391 . 1 1 A 37 37 ASP H H 37 8.402 9.241 -0.839 2 1 392 . 1 1 A 37 37 ASP HA H 37 5.462 5.452 0.010 2 1 395 . 1 1 A 37 37 ASP C C 37 175.177 175.004 0.173 2 1 396 . 1 1 A 37 37 ASP CA C 37 53.942 53.000 0.942 2 1 397 . 1 1 A 37 37 ASP CB C 37 45.486 43.161 2.325 2 1 398 . 1 1 A 37 37 ASP N N 37 127.149 124.881 2.268 2 1 399 . 1 1 A 38 38 THR H H 38 8.151 8.857 -0.706 2 1 400 . 1 1 A 38 38 THR HA H 38 4.866 5.072 -0.206 2 1 405 . 1 1 A 38 38 THR C C 38 172.792 173.137 -0.345 2 1 406 . 1 1 A 38 38 THR CA C 38 61.416 61.005 0.411 2 1 407 . 1 1 A 38 38 THR CB C 38 71.047 70.331 0.716 2 1 409 . 1 1 A 38 38 THR N N 38 115.686 117.462 -1.776 2 1 410 . 1 1 A 39 39 TYR H H 39 9.021 9.377 -0.356 2 1 411 . 1 1 A 39 39 TYR HA H 39 5.544 5.752 -0.208 2 1 416 . 1 1 A 39 39 TYR C C 39 176.032 174.637 1.396 2 1 417 . 1 1 A 39 39 TYR CA C 39 57.184 56.389 0.795 2 1 418 . 1 1 A 39 39 TYR CB C 39 41.642 40.594 1.048 2 1 420 . 1 1 A 39 39 TYR N N 39 124.579 125.599 -1.020 2 1 421 . 1 1 A 40 40 TYR H H 40 8.487 9.143 -0.656 2 1 422 . 1 1 A 40 40 TYR HA H 40 5.517 5.787 -0.270 2 1 426 . 1 1 A 40 40 TYR C C 40 174.108 174.438 -0.330 2 1 427 . 1 1 A 40 40 TYR CA C 40 56.979 56.754 0.225 2 1 428 . 1 1 A 40 40 TYR CB C 40 44.132 42.736 1.396 2 1 431 . 1 1 A 40 40 TYR N N 40 119.709 121.942 -2.233 2 1 432 . 1 1 A 41 41 ASP H H 41 9.341 8.787 0.554 2 1 433 . 1 1 A 41 41 ASP HA H 41 4.866 5.142 -0.276 2 1 436 . 1 1 A 41 41 ASP C C 41 177.262 174.871 2.391 2 1 437 . 1 1 A 41 41 ASP CA C 41 53.445 53.403 0.042 2 1 438 . 1 1 A 41 41 ASP CB C 41 45.347 44.658 0.689 2 1 439 . 1 1 A 41 41 ASP N N 41 117.995 120.585 -2.590 2 1 440 . 1 1 A 42 42 THR H H 42 11.574 8.675 2.899 2 1 441 . 1 1 A 42 42 THR HA H 42 5.206 4.534 0.672 2 1 446 . 1 1 A 42 42 THR C C 42 177.935 176.250 1.685 2 1 447 . 1 1 A 42 42 THR CA C 42 60.400 61.522 -1.122 2 1 448 . 1 1 A 42 42 THR CB C 42 72.114 70.454 1.660 2 1 450 . 1 1 A 42 42 THR N N 42 114.394 115.674 -1.280 2 1 451 . 1 1 A 43 43 SER H H 43 9.715 8.874 0.841 2 1 452 . 1 1 A 43 43 SER HA H 43 4.252 4.182 0.070 2 1 455 . 1 1 A 43 43 SER C C 43 175.478 175.085 0.393 2 1 456 . 1 1 A 43 43 SER CA C 43 61.277 60.972 0.305 2 1 457 . 1 1 A 43 43 SER CB C 43 62.821 62.849 -0.028 2 1 458 . 1 1 A 43 43 SER N N 43 116.674 117.396 -0.722 2 1 459 . 1 1 A 44 44 GLU H H 44 7.674 7.774 -0.100 2 1 460 . 1 1 A 44 44 GLU HA H 44 4.330 4.380 -0.050 2 1 464 . 1 1 A 44 44 GLU C C 44 175.001 175.676 -0.675 2 1 465 . 1 1 A 44 44 GLU CA C 44 55.992 55.598 0.394 2 1 466 . 1 1 A 44 44 GLU CB C 44 29.276 29.582 -0.306 2 1 468 . 1 1 A 44 44 GLU N N 44 117.856 118.290 -0.434 2 1 469 . 1 1 A 45 45 LEU H H 45 8.222 7.880 0.342 2 1 470 . 1 1 A 45 45 LEU HA H 45 3.901 4.350 -0.449 2 1 480 . 1 1 A 45 45 LEU C C 45 175.209 176.477 -1.268 2 1 481 . 1 1 A 45 45 LEU CA C 45 55.548 56.151 -0.603 2 1 482 . 1 1 A 45 45 LEU CB C 45 38.458 39.745 -1.287 2 1 485 . 1 1 A 45 45 LEU N N 45 119.335 117.264 2.071 2 1 486 . 1 1 A 46 46 SER H H 46 7.347 7.936 -0.589 2 1 487 . 1 1 A 46 46 SER HA H 46 3.954 4.189 -0.235 2 1 489 . 1 1 A 46 46 SER C C 46 177.497 176.626 0.871 2 1 490 . 1 1 A 46 46 SER CA C 46 62.471 61.761 0.710 2 1 491 . 1 1 A 46 46 SER CB C 46 63.908 62.964 0.944 2 1 492 . 1 1 A 46 46 SER N N 46 111.433 113.785 -2.352 2 1 493 . 1 1 A 47 47 LEU H H 47 12.003 8.313 3.690 2 1 494 . 1 1 A 47 47 LEU HA H 47 3.959 4.127 -0.168 2 1 504 . 1 1 A 47 47 LEU C C 47 180.340 178.296 2.044 2 1 505 . 1 1 A 47 47 LEU CA C 47 58.879 58.008 0.871 2 1 506 . 1 1 A 47 47 LEU CB C 47 39.572 41.784 -2.212 2 1 510 . 1 1 A 47 47 LEU N N 47 124.605 122.913 1.692 2 1 511 . 1 1 A 48 48 MET H H 48 10.599 8.700 1.899 2 1 512 . 1 1 A 48 48 MET HA H 48 3.213 3.701 -0.488 2 1 520 . 1 1 A 48 48 MET C C 48 181.177 178.077 3.100 2 1 521 . 1 1 A 48 48 MET CA C 48 60.747 58.280 2.467 2 1 522 . 1 1 A 48 48 MET CB C 48 32.594 32.056 0.538 2 1 525 . 1 1 A 48 48 MET N N 48 126.254 118.304 7.950 2 1 526 . 1 1 A 49 49 LEU H H 49 8.731 7.739 0.992 2 1 527 . 1 1 A 49 49 LEU HA H 49 4.097 4.145 -0.048 2 1 536 . 1 1 A 49 49 LEU C C 49 178.144 177.424 0.720 2 1 537 . 1 1 A 49 49 LEU CA C 49 57.800 56.620 1.180 2 1 538 . 1 1 A 49 49 LEU CB C 49 41.379 41.630 -0.251 2 1 541 . 1 1 A 49 49 LEU N N 49 119.183 120.379 -1.196 2 1 542 . 1 1 A 50 50 SER H H 50 7.853 7.443 0.410 2 1 543 . 1 1 A 50 50 SER HA H 50 4.822 4.562 0.260 2 1 546 . 1 1 A 50 50 SER C C 50 174.539 173.218 1.321 2 1 547 . 1 1 A 50 50 SER CA C 50 57.811 57.929 -0.118 2 1 548 . 1 1 A 50 50 SER CB C 50 64.443 63.292 1.151 2 1 549 . 1 1 A 50 50 SER N N 50 114.594 112.939 1.655 2 1 550 . 1 1 A 51 51 ASP H H 51 8.264 7.772 0.492 2 1 551 . 1 1 A 51 51 ASP HA H 51 4.362 4.147 0.215 2 1 554 . 1 1 A 51 51 ASP C C 51 172.921 174.570 -1.649 2 1 555 . 1 1 A 51 51 ASP CA C 51 55.343 55.442 -0.099 2 1 556 . 1 1 A 51 51 ASP CB C 51 40.583 39.583 1.000 2 1 557 . 1 1 A 51 51 ASP N N 51 123.003 118.218 4.785 2 1 558 . 1 1 A 52 52 HIS H H 52 7.869 7.277 0.592 2 1 559 . 1 1 A 52 52 HIS HA H 52 5.335 5.330 0.004 2 1 564 . 1 1 A 52 52 HIS C C 52 173.991 173.735 0.256 2 1 565 . 1 1 A 52 52 HIS CA C 52 55.889 54.142 1.747 2 1 566 . 1 1 A 52 52 HIS CB C 52 31.789 30.537 1.252 2 1 568 . 1 1 A 52 52 HIS N N 52 112.486 117.396 -4.910 2 1 569 . 1 1 A 53 53 TRP H H 53 8.165 9.143 -0.978 2 1 570 . 1 1 A 53 53 TRP HA H 53 4.926 5.345 -0.419 2 1 578 . 1 1 A 53 53 TRP C C 53 175.354 175.237 0.117 2 1 579 . 1 1 A 53 53 TRP CA C 53 55.364 56.069 -0.705 2 1 580 . 1 1 A 53 53 TRP CB C 53 30.641 31.467 -0.826 2 1 585 . 1 1 A 53 53 TRP N N 53 117.916 125.282 -7.366 2 1 587 . 1 1 A 54 54 LEU H H 54 10.088 9.098 0.990 2 1 588 . 1 1 A 54 54 LEU HA H 54 5.497 5.448 0.049 2 1 598 . 1 1 A 54 54 LEU C C 54 173.337 175.065 -1.728 2 1 599 . 1 1 A 54 54 LEU CA C 54 54.408 53.892 0.516 2 1 600 . 1 1 A 54 54 LEU CB C 54 44.156 45.453 -1.297 2 1 604 . 1 1 A 54 54 LEU N N 54 130.826 125.627 5.199 2 1 605 . 1 1 A 55 55 ARG H H 55 9.289 9.435 -0.146 2 1 606 . 1 1 A 55 55 ARG HA H 55 5.482 5.292 0.190 2 1 612 . 1 1 A 55 55 ARG C C 55 174.057 173.908 0.149 2 1 613 . 1 1 A 55 55 ARG CA C 55 53.167 54.100 -0.933 2 1 614 . 1 1 A 55 55 ARG CB C 55 34.270 33.753 0.517 2 1 616 . 1 1 A 55 55 ARG N N 55 125.089 125.460 -0.371 2 1 618 . 1 1 A 56 56 GLN H H 56 9.092 9.025 0.067 2 1 619 . 1 1 A 56 56 GLN HA H 56 3.991 4.602 -0.611 2 1 626 . 1 1 A 56 56 GLN C C 56 174.199 174.432 -0.233 2 1 627 . 1 1 A 56 56 GLN CA C 56 54.566 53.908 0.658 2 1 628 . 1 1 A 56 56 GLN CB C 56 29.643 30.711 -1.068 2 1 630 . 1 1 A 56 56 GLN N N 56 124.355 122.714 1.641 2 1 632 . 1 1 A 57 57 ARG H H 57 8.440 8.248 0.192 2 1 633 . 1 1 A 57 57 ARG HA H 57 5.316 4.828 0.488 2 1 639 . 1 1 A 57 57 ARG C C 57 176.188 176.447 -0.259 2 1 640 . 1 1 A 57 57 ARG CA C 57 53.940 55.439 -1.499 2 1 641 . 1 1 A 57 57 ARG CB C 57 32.426 30.585 1.841 2 1 643 . 1 1 A 57 57 ARG N N 57 130.222 125.836 4.386 2 1 645 . 1 1 A 58 58 GLU H H 58 8.891 9.060 -0.169 2 1 646 . 1 1 A 58 58 GLU HA H 58 3.996 4.105 -0.109 2 1 649 . 1 1 A 58 58 GLU CA C 58 58.364 57.630 0.734 2 1 650 . 1 1 A 58 58 GLU CB C 58 30.875 28.207 2.668 2 1 651 . 1 1 A 58 58 GLU N N 58 131.208 121.711 9.497 2 1 652 . 1 1 A 59 59 GLY H H 59 8.367 8.301 0.066 2 1 653 . 1 1 A 59 59 GLY HA2 H 59 4.334 3.836 0.498 2 1 654 . 1 1 A 59 59 GLY HA3 H 59 3.743 3.923 -0.180 2 1 655 . 1 1 A 59 59 GLY C C 59 174.194 175.048 -0.854 2 1 656 . 1 1 A 59 59 GLY CA C 59 45.666 45.876 -0.210 2 1 657 . 1 1 A 60 60 SER H H 60 8.071 8.373 -0.302 2 1 658 . 1 1 A 60 60 SER HA H 60 4.730 4.438 0.292 2 1 661 . 1 1 A 60 60 SER C C 60 173.908 174.154 -0.246 2 1 662 . 1 1 A 60 60 SER CA C 60 58.762 58.930 -0.168 2 1 663 . 1 1 A 60 60 SER CB C 60 64.497 63.964 0.533 2 1 664 . 1 1 A 60 60 SER N N 60 114.636 115.469 -0.833 2 1 665 . 1 1 A 61 61 GLY H H 61 8.401 7.244 1.157 2 1 666 . 1 1 A 61 61 GLY HA2 H 61 4.560 4.003 0.557 2 1 667 . 1 1 A 61 61 GLY HA3 H 61 3.878 4.030 -0.152 2 1 668 . 1 1 A 61 61 GLY C C 61 173.526 172.035 1.491 2 1 669 . 1 1 A 61 61 GLY CA C 61 44.906 45.427 -0.521 2 1 670 . 1 1 A 61 61 GLY N N 61 109.421 107.021 2.400 2 1 671 . 1 1 A 62 62 TRP H H 62 8.861 8.511 0.350 2 1 672 . 1 1 A 62 62 TRP HA H 62 5.089 5.205 -0.116 2 1 681 . 1 1 A 62 62 TRP C C 62 176.168 175.919 0.249 2 1 682 . 1 1 A 62 62 TRP CA C 62 57.459 57.268 0.191 2 1 683 . 1 1 A 62 62 TRP CB C 62 32.536 31.506 1.030 2 1 689 . 1 1 A 62 62 TRP N N 62 122.939 121.648 1.291 2 1 691 . 1 1 A 63 63 GLU H H 63 9.306 9.354 -0.048 2 1 692 . 1 1 A 63 63 GLU HA H 63 4.919 5.263 -0.344 2 1 697 . 1 1 A 63 63 GLU C C 63 173.770 174.696 -0.926 2 1 698 . 1 1 A 63 63 GLU CA C 63 55.953 55.340 0.613 2 1 699 . 1 1 A 63 63 GLU CB C 63 35.317 33.389 1.928 2 1 701 . 1 1 A 63 63 GLU N N 63 120.136 121.818 -1.682 2 1 702 . 1 1 A 64 64 LEU H H 64 8.998 9.290 -0.292 2 1 703 . 1 1 A 64 64 LEU HA H 64 5.616 5.561 0.055 2 1 712 . 1 1 A 64 64 LEU C C 64 175.014 174.071 0.943 2 1 713 . 1 1 A 64 64 LEU CA C 64 52.945 53.800 -0.855 2 1 714 . 1 1 A 64 64 LEU CB C 64 46.904 45.913 0.991 2 1 717 . 1 1 A 64 64 LEU N N 64 127.321 126.826 0.495 2 1 718 . 1 1 A 65 65 LYS H H 65 9.322 9.903 -0.581 2 1 719 . 1 1 A 65 65 LYS HA H 65 5.347 5.338 0.009 2 1 727 . 1 1 A 65 65 LYS C C 65 175.811 175.443 0.368 2 1 728 . 1 1 A 65 65 LYS CA C 65 55.817 55.313 0.504 2 1 729 . 1 1 A 65 65 LYS CB C 65 34.521 34.709 -0.188 2 1 733 . 1 1 A 65 65 LYS N N 65 129.874 127.855 2.019 2 1 734 . 1 1 A 66 66 CYS H H 66 9.129 9.241 -0.112 2 1 735 . 1 1 A 66 66 CYS HA H 66 5.319 5.072 0.247 2 1 738 . 1 1 A 66 66 CYS CA C 66 54.532 56.841 -2.309 2 1 739 . 1 1 A 66 66 CYS CB C 66 28.813 30.374 -1.561 2 1 740 . 1 1 A 66 66 CYS N N 66 121.497 125.226 -3.729 2 1 741 . 1 1 A 67 67 PRO HA H 67 4.439 4.219 0.220 2 1 748 . 1 1 A 67 67 PRO C C 67 177.297 177.798 -0.501 2 1 749 . 1 1 A 67 67 PRO CA C 67 63.596 63.413 0.183 2 1 750 . 1 1 A 67 67 PRO CB C 67 32.242 31.415 0.827 2 1 752 . 1 1 A 68 68 GLY H H 68 8.316 8.380 -0.064 2 1 753 . 1 1 A 68 68 GLY HA2 H 68 3.726 3.938 -0.212 2 1 754 . 1 1 A 68 68 GLY HA3 H 68 4.095 3.977 0.118 2 1 755 . 1 1 A 68 68 GLY C C 68 173.789 174.035 -0.246 2 1 756 . 1 1 A 68 68 GLY CA C 68 45.227 45.544 -0.317 2 1 757 . 1 1 A 68 68 GLY N N 68 109.533 109.407 0.126 2 1 758 . 1 1 A 69 69 VAL H H 69 8.114 7.790 0.324 2 1 759 . 1 1 A 69 69 VAL HA H 69 4.266 4.207 0.059 2 1 764 . 1 1 A 69 69 VAL C C 69 176.299 175.648 0.651 2 1 765 . 1 1 A 69 69 VAL CA C 69 61.945 62.176 -0.231 2 1 766 . 1 1 A 69 69 VAL CB C 69 33.082 32.797 0.285 2 1 768 . 1 1 A 69 69 VAL N N 69 118.540 121.076 -2.536 2 1 769 . 1 1 A 70 70 THR H H 70 8.324 8.846 -0.522 2 1 770 . 1 1 A 70 70 THR HA H 70 4.373 4.440 -0.067 2 1 775 . 1 1 A 70 70 THR C C 70 175.204 175.542 -0.338 2 1 776 . 1 1 A 70 70 THR CA C 70 62.309 63.562 -1.253 2 1 777 . 1 1 A 70 70 THR CB C 70 69.787 69.411 0.376 2 1 779 . 1 1 A 70 70 THR N N 70 117.636 119.942 -2.306 2 1 780 . 1 1 A 71 71 GLY H H 71 8.574 8.176 0.398 2 1 781 . 1 1 A 71 71 GLY HA2 H 71 4.096 4.056 0.040 2 1 782 . 1 1 A 71 71 GLY HA3 H 71 3.975 4.066 -0.091 2 1 783 . 1 1 A 71 71 GLY C C 71 174.313 174.624 -0.311 2 1 784 . 1 1 A 71 71 GLY CA C 71 45.545 45.850 -0.305 2 1 785 . 1 1 A 71 71 GLY N N 71 111.677 110.103 1.574 2 1 786 . 1 1 A 72 72 VAL H H 72 7.945 7.923 0.022 2 1 787 . 1 1 A 72 72 VAL HA H 72 4.258 4.064 0.194 2 1 795 . 1 1 A 72 72 VAL C C 72 176.162 175.893 0.269 2 1 796 . 1 1 A 72 72 VAL CA C 72 62.227 63.590 -1.363 2 1 797 . 1 1 A 72 72 VAL CB C 72 32.997 31.962 1.035 2 1 799 . 1 1 A 72 72 VAL N N 72 118.647 118.338 0.309 2 1 800 . 1 1 A 73 73 SER H H 73 8.498 8.100 0.398 2 1 801 . 1 1 A 73 73 SER HA H 73 4.617 4.459 0.158 2 1 803 . 1 1 A 73 73 SER C C 73 174.461 173.974 0.487 2 1 804 . 1 1 A 73 73 SER CA C 73 58.218 59.034 -0.816 2 1 805 . 1 1 A 73 73 SER CB C 73 64.061 62.921 1.140 2 1 806 . 1 1 A 73 73 SER N N 73 118.828 115.687 3.141 2 1 807 . 1 1 A 74 74 GLY H H 74 8.247 8.165 0.082 2 1 808 . 1 1 A 74 74 GLY HA2 H 74 4.101 4.101 0.000 2 1 809 . 1 1 A 74 74 GLY HA3 H 74 4.304 4.118 0.186 2 1 810 . 1 1 A 74 74 GLY CA C 74 44.896 44.715 0.181 2 1 811 . 1 1 A 74 74 GLY N N 74 111.138 109.863 1.275 2 1 812 . 1 1 A 75 75 PRO HA H 75 4.461 4.517 -0.056 2 1 819 . 1 1 A 75 75 PRO C C 75 176.798 176.352 0.446 2 1 820 . 1 1 A 75 75 PRO CA C 75 63.466 63.227 0.239 2 1 821 . 1 1 A 75 75 PRO CB C 75 31.980 31.933 0.047 2 1 824 . 1 1 A 76 76 HIS H H 76 8.397 8.224 0.173 2 1 825 . 1 1 A 76 76 HIS HA H 76 4.742 4.693 0.049 2 1 829 . 1 1 A 76 76 HIS C C 76 174.282 174.553 -0.271 2 1 830 . 1 1 A 76 76 HIS CA C 76 55.579 55.629 -0.050 2 1 831 . 1 1 A 76 76 HIS CB C 76 30.501 30.999 -0.498 2 1 832 . 1 1 A 76 76 HIS N N 76 118.431 117.946 0.485 2 1 833 . 1 1 A 77 77 ASN H H 77 8.364 8.798 -0.434 2 1 834 . 1 1 A 77 77 ASN HA H 77 4.767 4.745 0.022 2 1 839 . 1 1 A 77 77 ASN C C 77 174.576 174.697 -0.121 2 1 840 . 1 1 A 77 77 ASN CA C 77 53.139 52.889 0.250 2 1 841 . 1 1 A 77 77 ASN CB C 77 39.320 38.687 0.633 2 1 842 . 1 1 A 77 77 ASN N N 77 119.421 120.160 -0.739 2 1 844 . 1 1 A 78 78 GLU H H 78 8.683 8.214 0.469 2 1 845 . 1 1 A 78 78 GLU HA H 78 4.409 4.260 0.149 2 1 850 . 1 1 A 78 78 GLU C C 78 175.791 174.744 1.047 2 1 851 . 1 1 A 78 78 GLU CA C 78 56.359 57.436 -1.077 2 1 852 . 1 1 A 78 78 GLU CB C 78 30.818 29.503 1.315 2 1 854 . 1 1 A 78 78 GLU N N 78 122.085 119.128 2.957 2 1 855 . 1 1 A 79 79 TYR H H 79 8.341 8.566 -0.225 2 1 856 . 1 1 A 79 79 TYR HA H 79 4.988 5.258 -0.270 2 1 861 . 1 1 A 79 79 TYR C C 79 175.837 175.496 0.341 2 1 862 . 1 1 A 79 79 TYR CA C 79 58.028 58.386 -0.358 2 1 863 . 1 1 A 79 79 TYR CB C 79 41.672 40.111 1.561 2 1 866 . 1 1 A 79 79 TYR N N 79 119.452 121.550 -2.098 2 1 867 . 1 1 A 80 80 VAL H H 80 9.366 9.389 -0.023 2 1 868 . 1 1 A 80 80 VAL HA H 80 4.370 4.933 -0.563 2 1 873 . 1 1 A 80 80 VAL C C 80 174.948 174.764 0.184 2 1 874 . 1 1 A 80 80 VAL CA C 80 61.190 60.280 0.910 2 1 875 . 1 1 A 80 80 VAL CB C 80 34.204 34.236 -0.032 2 1 877 . 1 1 A 80 80 VAL N N 80 120.567 119.729 0.838 2 1 878 . 1 1 A 81 81 GLU H H 81 8.570 9.055 -0.484 2 1 879 . 1 1 A 81 81 GLU HA H 81 4.770 5.249 -0.479 2 1 883 . 1 1 A 81 81 GLU C C 81 175.491 175.689 -0.198 2 1 884 . 1 1 A 81 81 GLU CA C 81 55.655 55.152 0.503 2 1 885 . 1 1 A 81 81 GLU CB C 81 30.415 31.727 -1.312 2 1 887 . 1 1 A 81 81 GLU N N 81 124.248 124.923 -0.675 2 1 888 . 1 1 A 82 82 VAL H H 82 9.189 9.123 0.066 2 1 889 . 1 1 A 82 82 VAL HA H 82 4.279 4.682 -0.403 2 1 894 . 1 1 A 82 82 VAL C C 82 176.087 175.922 0.165 2 1 895 . 1 1 A 82 82 VAL CA C 82 62.672 61.341 1.331 2 1 896 . 1 1 A 82 82 VAL CB C 82 33.121 33.306 -0.185 2 1 898 . 1 1 A 82 82 VAL N N 82 127.776 122.168 5.608 2 1 899 . 1 1 A 83 83 THR H H 83 8.590 8.664 -0.074 2 1 900 . 1 1 A 83 83 THR HA H 83 4.955 4.696 0.259 2 1 905 . 1 1 A 83 83 THR C C 83 174.688 174.739 -0.051 2 1 906 . 1 1 A 83 83 THR CA C 83 61.332 61.520 -0.188 2 1 907 . 1 1 A 83 83 THR CB C 83 70.213 70.148 0.065 2 1 909 . 1 1 A 83 83 THR N N 83 114.744 116.772 -2.028 2 1 910 . 1 1 A 84 84 SER H H 84 7.650 7.493 0.157 2 1 911 . 1 1 A 84 84 SER HA H 84 4.819 4.384 0.435 2 1 914 . 1 1 A 84 84 SER CA C 84 56.280 59.720 -3.440 2 1 915 . 1 1 A 84 84 SER CB C 84 63.294 63.584 -0.290 2 1 916 . 1 1 A 84 84 SER N N 84 118.038 118.454 -0.416 2 1 917 . 1 1 A 85 85 GLU H H 85 8.391 8.784 -0.393 2 1 918 . 1 1 A 85 85 GLU HA H 85 3.661 3.954 -0.293 2 1 923 . 1 1 A 85 85 GLU C C 85 177.520 178.499 -0.979 2 1 924 . 1 1 A 85 85 GLU CA C 85 62.429 59.644 2.785 2 1 925 . 1 1 A 85 85 GLU CB C 85 29.655 29.395 0.260 2 1 927 . 1 1 A 86 86 ALA H H 86 8.443 8.132 0.311 2 1 928 . 1 1 A 86 86 ALA HA H 86 4.027 4.024 0.003 2 1 932 . 1 1 A 86 86 ALA C C 86 180.423 180.013 0.410 2 1 933 . 1 1 A 86 86 ALA CA C 86 55.145 54.811 0.334 2 1 934 . 1 1 A 86 86 ALA CB C 86 18.165 18.154 0.011 2 1 935 . 1 1 A 86 86 ALA N N 86 119.636 122.991 -3.355 2 1 936 . 1 1 A 87 87 ALA H H 87 7.214 7.486 -0.272 2 1 937 . 1 1 A 87 87 ALA HA H 87 4.244 4.043 0.201 2 1 941 . 1 1 A 87 87 ALA C C 87 180.354 179.876 0.478 2 1 942 . 1 1 A 87 87 ALA CA C 87 54.378 54.924 -0.546 2 1 943 . 1 1 A 87 87 ALA CB C 87 18.795 18.492 0.303 2 1 944 . 1 1 A 87 87 ALA N N 87 121.004 120.386 0.618 2 1 945 . 1 1 A 88 88 ILE H H 88 8.471 7.620 0.851 2 1 946 . 1 1 A 88 88 ILE HA H 88 3.360 3.652 -0.292 2 1 954 . 1 1 A 88 88 ILE CA C 88 66.323 64.776 1.547 2 1 955 . 1 1 A 88 88 ILE CB C 88 37.808 37.716 0.092 2 1 958 . 1 1 A 88 88 ILE N N 88 120.743 119.744 0.999 2 1 959 . 1 1 A 89 89 VAL H H 89 8.343 8.388 -0.045 2 1 960 . 1 1 A 89 89 VAL HA H 89 3.061 3.468 -0.407 2 1 968 . 1 1 A 89 89 VAL C C 89 176.708 177.872 -1.164 2 1 969 . 1 1 A 89 89 VAL CA C 89 67.833 66.535 1.298 2 1 970 . 1 1 A 89 89 VAL CB C 89 31.509 31.401 0.108 2 1 973 . 1 1 A 89 89 VAL N N 89 118.049 119.805 -1.756 2 1 974 . 1 1 A 90 90 ALA H H 90 7.516 7.914 -0.398 2 1 975 . 1 1 A 90 90 ALA HA H 90 3.987 3.856 0.131 2 1 979 . 1 1 A 90 90 ALA C C 90 180.744 179.475 1.269 2 1 980 . 1 1 A 90 90 ALA CA C 90 55.481 55.633 -0.152 2 1 981 . 1 1 A 90 90 ALA CB C 90 17.953 18.075 -0.121 2 1 982 . 1 1 A 90 90 ALA N N 90 118.935 121.783 -2.848 2 1 983 . 1 1 A 91 91 GLN H H 91 7.886 8.080 -0.194 2 1 984 . 1 1 A 91 91 GLN HA H 91 4.190 3.986 0.204 2 1 991 . 1 1 A 91 91 GLN C C 91 178.832 178.587 0.245 2 1 992 . 1 1 A 91 91 GLN CA C 91 58.519 58.911 -0.392 2 1 993 . 1 1 A 91 91 GLN CB C 91 28.091 28.233 -0.142 2 1 995 . 1 1 A 91 91 GLN N N 91 117.846 118.019 -0.173 2 1 997 . 1 1 A 92 92 LEU H H 92 8.751 8.726 0.025 2 1 998 . 1 1 A 92 92 LEU HA H 92 3.903 3.957 -0.054 2 1 1007 . 1 1 A 92 92 LEU C C 92 178.997 179.061 -0.064 2 1 1008 . 1 1 A 92 92 LEU CA C 92 58.136 57.889 0.247 2 1 1009 . 1 1 A 92 92 LEU CB C 92 41.576 41.539 0.037 2 1 1013 . 1 1 A 92 92 LEU N N 92 119.547 119.620 -0.073 2 1 1014 . 1 1 A 93 93 PHE H H 93 8.648 8.015 0.633 2 1 1015 . 1 1 A 93 93 PHE HA H 93 4.270 4.334 -0.064 2 1 1020 . 1 1 A 93 93 PHE C C 93 179.283 178.796 0.487 2 1 1021 . 1 1 A 93 93 PHE CA C 93 59.860 60.434 -0.574 2 1 1022 . 1 1 A 93 93 PHE CB C 93 37.765 38.421 -0.656 2 1 1025 . 1 1 A 93 93 PHE N N 93 118.041 118.932 -0.891 2 1 1026 . 1 1 A 94 94 GLU H H 94 7.739 8.327 -0.588 2 1 1027 . 1 1 A 94 94 GLU HA H 94 4.110 4.128 -0.018 2 1 1031 . 1 1 A 94 94 GLU C C 94 178.629 178.855 -0.226 2 1 1032 . 1 1 A 94 94 GLU CA C 94 59.359 59.371 -0.012 2 1 1033 . 1 1 A 94 94 GLU CB C 94 29.589 28.907 0.682 2 1 1035 . 1 1 A 94 94 GLU N N 94 119.980 117.284 2.696 2 1 1036 . 1 1 A 95 95 LEU H H 95 7.999 8.307 -0.308 2 1 1037 . 1 1 A 95 95 LEU HA H 95 4.139 3.956 0.183 2 1 1047 . 1 1 A 95 95 LEU C C 95 178.965 178.605 0.360 2 1 1048 . 1 1 A 95 95 LEU CA C 95 57.557 57.801 -0.244 2 1 1049 . 1 1 A 95 95 LEU CB C 95 43.443 41.573 1.870 2 1 1053 . 1 1 A 95 95 LEU N N 95 118.398 121.576 -3.178 2 1 1054 . 1 1 A 96 96 LEU H H 96 8.363 7.946 0.417 2 1 1055 . 1 1 A 96 96 LEU HA H 96 4.503 4.280 0.223 2 1 1061 . 1 1 A 96 96 LEU C C 96 177.932 177.035 0.897 2 1 1062 . 1 1 A 96 96 LEU CA C 96 54.700 55.162 -0.462 2 1 1063 . 1 1 A 96 96 LEU CB C 96 43.048 42.547 0.501 2 1 1065 . 1 1 A 96 96 LEU N N 96 114.720 116.960 -2.240 2 1 1066 . 1 1 A 97 97 GLY H H 97 7.810 7.723 0.087 2 1 1067 . 1 1 A 97 97 GLY HA2 H 97 3.963 3.913 0.050 2 1 1068 . 1 1 A 97 97 GLY C C 97 173.535 174.501 -0.966 2 1 1069 . 1 1 A 97 97 GLY CA C 97 45.667 46.280 -0.613 2 1 1070 . 1 1 A 97 97 GLY N N 97 109.511 107.853 1.658 2 1 1071 . 1 1 A 98 98 SER H H 98 8.131 8.131 0.000 2 1 1072 . 1 1 A 98 98 SER HA H 98 4.225 4.332 -0.107 2 1 1075 . 1 1 A 98 98 SER C C 98 174.974 174.590 0.384 2 1 1076 . 1 1 A 98 98 SER CA C 98 57.960 59.227 -1.267 2 1 1077 . 1 1 A 98 98 SER CB C 98 63.997 63.669 0.328 2 1 1078 . 1 1 A 98 98 SER N N 98 113.405 115.046 -1.641 2 1 1079 . 1 1 A 99 99 GLY H H 99 8.052 8.396 -0.344 2 1 1080 . 1 1 A 99 99 GLY HA2 H 99 3.998 3.945 0.053 2 1 1081 . 1 1 A 99 99 GLY HA3 H 99 3.778 3.984 -0.206 2 1 1082 . 1 1 A 99 99 GLY C C 99 174.033 174.053 -0.020 2 1 1083 . 1 1 A 99 99 GLY CA C 99 45.123 45.815 -0.692 2 1 1084 . 1 1 A 99 99 GLY N N 99 111.534 110.999 0.535 2 1 1085 . 1 1 A 100 100 GLU H H 100 8.177 7.757 0.420 2 1 1086 . 1 1 A 100 100 GLU HA H 100 4.201 4.527 -0.326 2 1 1091 . 1 1 A 100 100 GLU C C 100 175.830 176.134 -0.304 2 1 1092 . 1 1 A 100 100 GLU CA C 100 56.442 56.061 0.381 2 1 1093 . 1 1 A 100 100 GLU CB C 100 30.428 30.887 -0.459 2 1 1095 . 1 1 A 100 100 GLU N N 100 120.463 120.200 0.263 2 1 1096 . 1 1 A 101 101 GLN H H 101 8.161 8.415 -0.254 2 1 1097 . 1 1 A 101 101 GLN HA H 101 4.098 4.410 -0.312 2 1 1103 . 1 1 A 101 101 GLN C C 101 175.412 175.491 -0.079 2 1 1104 . 1 1 A 101 101 GLN CA C 101 55.632 55.803 -0.171 2 1 1105 . 1 1 A 101 101 GLN CB C 101 29.569 29.304 0.265 2 1 1107 . 1 1 A 101 101 GLN N N 101 120.014 120.747 -0.733 2 1 1109 . 1 1 A 102 102 LYS H H 102 8.235 8.516 -0.281 2 1 1110 . 1 1 A 102 102 LYS HA H 102 4.387 4.059 0.328 2 1 1117 . 1 1 A 102 102 LYS CA C 102 54.116 54.021 0.095 2 1 1118 . 1 1 A 102 102 LYS CB C 102 32.478 32.462 0.016 2 1 1122 . 1 1 A 102 102 LYS N N 102 123.399 123.347 0.052 2 1 1123 . 1 1 A 103 103 PRO HA H 103 4.498 4.449 0.049 2 1 1129 . 1 1 A 103 103 PRO C C 103 175.473 176.826 -1.353 2 1 1130 . 1 1 A 103 103 PRO CA C 103 62.802 65.002 -2.200 2 1 1131 . 1 1 A 103 103 PRO CB C 103 32.124 31.839 0.285 2 1 1134 . 1 1 A 104 104 ALA H H 104 8.017 7.492 0.525 2 1 1135 . 1 1 A 104 104 ALA HA H 104 4.318 4.285 0.033 2 1 1139 . 1 1 A 104 104 ALA C C 104 176.717 176.819 -0.102 2 1 1140 . 1 1 A 104 104 ALA CA C 104 52.194 53.109 -0.915 2 1 1141 . 1 1 A 104 104 ALA CB C 104 20.113 20.211 -0.098 2 1 1142 . 1 1 A 104 104 ALA N N 104 122.093 118.261 3.832 2 1 1143 . 1 1 A 105 105 GLY H H 105 7.678 8.151 -0.473 2 1 1144 . 1 1 A 105 105 GLY HA2 H 105 3.851 4.075 -0.224 2 1 1145 . 1 1 A 105 105 GLY HA3 H 105 4.053 4.097 -0.044 2 1 1146 . 1 1 A 105 105 GLY C C 105 172.990 174.806 -1.816 2 1 1147 . 1 1 A 105 105 GLY CA C 105 44.241 43.711 0.530 2 1 1148 . 1 1 A 105 105 GLY N N 105 105.234 105.390 -0.156 2 1 1149 . 1 1 A 106 106 VAL H H 106 8.409 8.679 -0.270 2 1 1150 . 1 1 A 106 106 VAL HA H 106 2.829 3.321 -0.492 2 1 1158 . 1 1 A 106 106 VAL C C 106 177.822 177.256 0.566 2 1 1159 . 1 1 A 106 106 VAL CA C 106 65.522 65.548 -0.026 2 1 1160 . 1 1 A 106 106 VAL CB C 106 30.701 30.702 -0.001 2 1 1163 . 1 1 A 106 106 VAL N N 106 119.215 119.985 -0.770 2 1 1164 . 1 1 A 107 107 ALA H H 107 8.707 8.359 0.348 2 1 1165 . 1 1 A 107 107 ALA HA H 107 3.730 3.856 -0.126 2 1 1169 . 1 1 A 107 107 ALA C C 107 179.661 179.843 -0.182 2 1 1170 . 1 1 A 107 107 ALA CA C 107 54.995 55.415 -0.420 2 1 1171 . 1 1 A 107 107 ALA CB C 107 17.705 17.955 -0.250 2 1 1172 . 1 1 A 107 107 ALA N N 107 118.672 122.004 -3.332 2 1 1173 . 1 1 A 108 108 ALA H H 108 7.388 7.752 -0.364 2 1 1174 . 1 1 A 108 108 ALA HA H 108 4.259 4.065 0.194 2 1 1178 . 1 1 A 108 108 ALA C C 108 179.318 179.411 -0.093 2 1 1179 . 1 1 A 108 108 ALA CA C 108 53.481 55.010 -1.529 2 1 1180 . 1 1 A 108 108 ALA CB C 108 19.367 18.500 0.867 2 1 1181 . 1 1 A 108 108 ALA N N 108 116.635 120.535 -3.900 2 1 1182 . 1 1 A 109 109 VAL H H 109 7.689 7.499 0.190 2 1 1183 . 1 1 A 109 109 VAL HA H 109 4.532 3.832 0.700 2 1 1191 . 1 1 A 109 109 VAL C C 109 176.055 177.971 -1.916 2 1 1192 . 1 1 A 109 109 VAL CA C 109 61.452 65.706 -4.254 2 1 1193 . 1 1 A 109 109 VAL CB C 109 32.728 31.378 1.350 2 1 1196 . 1 1 A 109 109 VAL N N 109 112.851 117.053 -4.202 2 1 1197 . 1 1 A 110 110 LEU H H 110 7.099 8.228 -1.129 2 1 1198 . 1 1 A 110 110 LEU HA H 110 3.723 3.784 -0.061 2 1 1208 . 1 1 A 110 110 LEU C C 110 179.040 178.810 0.230 2 1 1209 . 1 1 A 110 110 LEU CA C 110 58.825 57.862 0.963 2 1 1210 . 1 1 A 110 110 LEU CB C 110 41.242 41.730 -0.488 2 1 1214 . 1 1 A 110 110 LEU N N 110 119.829 124.972 -5.143 2 1 1215 . 1 1 A 111 111 GLY H H 111 8.435 7.784 0.651 2 1 1216 . 1 1 A 111 111 GLY HA2 H 111 3.970 3.821 0.149 2 1 1217 . 1 1 A 111 111 GLY HA3 H 111 3.885 3.827 0.058 2 1 1218 . 1 1 A 111 111 GLY C C 111 178.031 176.574 1.457 2 1 1219 . 1 1 A 111 111 GLY CA C 111 46.961 47.550 -0.589 2 1 1220 . 1 1 A 111 111 GLY N N 111 104.089 106.553 -2.464 2 1 1221 . 1 1 A 112 112 SER H H 112 8.343 8.057 0.286 2 1 1222 . 1 1 A 112 112 SER HA H 112 4.266 4.172 0.094 2 1 1224 . 1 1 A 112 112 SER C C 112 175.885 175.383 0.502 2 1 1225 . 1 1 A 112 112 SER CA C 112 61.304 62.450 -1.146 2 1 1226 . 1 1 A 112 112 SER CB C 112 62.901 63.027 -0.126 2 1 1227 . 1 1 A 112 112 SER N N 112 119.497 119.378 0.119 2 1 1228 . 1 1 A 113 113 LEU H H 113 7.667 7.991 -0.324 2 1 1229 . 1 1 A 113 113 LEU HA H 113 4.343 4.191 0.152 2 1 1238 . 1 1 A 113 113 LEU C C 113 174.760 175.982 -1.222 2 1 1239 . 1 1 A 113 113 LEU CA C 113 54.228 54.664 -0.436 2 1 1240 . 1 1 A 113 113 LEU CB C 113 41.467 42.102 -0.635 2 1 1244 . 1 1 A 113 113 LEU N N 113 118.843 117.872 0.971 2 1 1245 . 1 1 A 114 114 LYS H H 114 7.685 7.752 -0.067 2 1 1246 . 1 1 A 114 114 LYS HA H 114 3.958 3.882 0.076 2 1 1250 . 1 1 A 114 114 LYS C C 114 177.557 175.695 1.862 2 1 1251 . 1 1 A 114 114 LYS CA C 114 56.935 57.401 -0.466 2 1 1252 . 1 1 A 114 114 LYS CB C 114 28.898 29.504 -0.606 2 1 1254 . 1 1 A 114 114 LYS N N 114 114.072 116.574 -2.502 2 1 1255 . 1 1 A 115 115 LEU H H 115 8.329 7.917 0.412 2 1 1256 . 1 1 A 115 115 LEU HA H 115 4.315 4.338 -0.023 2 1 1265 . 1 1 A 115 115 LEU C C 115 175.988 176.918 -0.930 2 1 1266 . 1 1 A 115 115 LEU CA C 115 54.310 55.178 -0.868 2 1 1267 . 1 1 A 115 115 LEU CB C 115 44.163 42.331 1.832 2 1 1270 . 1 1 A 115 115 LEU N N 115 117.951 119.907 -1.956 2 1 1271 . 1 1 A 116 116 GLN H H 116 9.100 8.662 0.438 2 1 1272 . 1 1 A 116 116 GLN HA H 116 4.898 4.959 -0.061 2 1 1279 . 1 1 A 116 116 GLN CA C 116 53.467 54.869 -1.402 2 1 1280 . 1 1 A 116 116 GLN CB C 116 32.730 30.840 1.890 2 1 1282 . 1 1 A 116 116 GLN N N 116 119.994 121.429 -1.435 2 1 1284 . 1 1 A 117 117 GLU H H 117 8.849 8.582 0.267 2 1 1285 . 1 1 A 117 117 GLU HA H 117 3.707 3.999 -0.292 2 1 1290 . 1 1 A 117 117 GLU C C 117 177.303 176.726 0.577 2 1 1291 . 1 1 A 117 117 GLU CA C 117 57.233 55.792 1.441 2 1 1292 . 1 1 A 117 117 GLU CB C 117 29.634 28.984 0.650 2 1 1294 . 1 1 A 117 117 GLU N N 117 121.487 123.404 -1.917 2 1 1295 . 1 1 A 118 118 VAL H H 118 8.983 8.578 0.405 2 1 1296 . 1 1 A 118 118 VAL HA H 118 4.360 3.991 0.369 2 1 1304 . 1 1 A 118 118 VAL C C 118 174.171 175.276 -1.105 2 1 1305 . 1 1 A 118 118 VAL CA C 118 61.772 63.752 -1.980 2 1 1306 . 1 1 A 118 118 VAL CB C 118 34.095 32.681 1.414 2 1 1309 . 1 1 A 118 118 VAL N N 118 122.933 126.998 -4.065 2 1 1310 . 1 1 A 119 119 ALA H H 119 7.023 7.065 -0.042 2 1 1311 . 1 1 A 119 119 ALA HA H 119 4.378 4.416 -0.038 2 1 1315 . 1 1 A 119 119 ALA C C 119 175.493 174.982 0.511 2 1 1316 . 1 1 A 119 119 ALA CA C 119 51.956 51.128 0.828 2 1 1317 . 1 1 A 119 119 ALA CB C 119 23.957 21.508 2.449 2 1 1318 . 1 1 A 119 119 ALA N N 119 117.379 121.692 -4.313 2 1 1319 . 1 1 A 120 120 SER H H 120 6.999 8.545 -1.546 2 1 1320 . 1 1 A 120 120 SER HA H 120 5.208 5.479 -0.271 2 1 1323 . 1 1 A 120 120 SER C C 120 173.082 173.005 0.077 2 1 1324 . 1 1 A 120 120 SER CA C 120 56.754 56.618 0.136 2 1 1325 . 1 1 A 120 120 SER CB C 120 64.605 65.407 -0.802 2 1 1326 . 1 1 A 120 120 SER N N 120 113.743 116.380 -2.637 2 1 1327 . 1 1 A 121 121 PHE H H 121 8.244 8.896 -0.652 2 1 1328 . 1 1 A 121 121 PHE HA H 121 5.177 5.152 0.025 2 1 1333 . 1 1 A 121 121 PHE C C 121 173.569 172.646 0.923 2 1 1334 . 1 1 A 121 121 PHE CA C 121 55.555 55.599 -0.044 2 1 1335 . 1 1 A 121 121 PHE CB C 121 40.959 41.776 -0.817 2 1 1338 . 1 1 A 121 121 PHE N N 121 120.358 120.130 0.228 2 1 1339 . 1 1 A 122 122 ILE H H 122 8.907 8.776 0.131 2 1 1340 . 1 1 A 122 122 ILE HA H 122 4.682 4.624 0.058 2 1 1348 . 1 1 A 122 122 ILE C C 122 176.925 175.094 1.831 2 1 1349 . 1 1 A 122 122 ILE CA C 122 60.740 60.578 0.162 2 1 1350 . 1 1 A 122 122 ILE CB C 122 39.497 39.231 0.266 2 1 1353 . 1 1 A 122 122 ILE N N 122 121.282 120.845 0.437 2 1 1354 . 1 1 A 123 123 THR H H 123 9.022 9.169 -0.147 2 1 1355 . 1 1 A 123 123 THR HA H 123 5.039 4.928 0.111 2 1 1360 . 1 1 A 123 123 THR C C 123 173.531 173.679 -0.148 2 1 1361 . 1 1 A 123 123 THR CA C 123 62.266 61.669 0.597 2 1 1362 . 1 1 A 123 123 THR CB C 123 70.677 69.237 1.440 2 1 1364 . 1 1 A 123 123 THR N N 123 128.965 123.358 5.607 2 1 1365 . 1 1 A 124 124 THR H H 124 8.961 9.179 -0.218 2 1 1366 . 1 1 A 124 124 THR HA H 124 5.001 4.957 0.044 2 1 1371 . 1 1 A 124 124 THR C C 124 173.468 172.771 0.697 2 1 1372 . 1 1 A 124 124 THR CA C 124 62.109 61.632 0.477 2 1 1373 . 1 1 A 124 124 THR CB C 124 70.450 69.681 0.769 2 1 1375 . 1 1 A 124 124 THR N N 124 122.176 123.388 -1.212 2 1 1376 . 1 1 A 125 125 ARG H H 125 9.386 9.498 -0.112 2 1 1377 . 1 1 A 125 125 ARG HA H 125 5.764 5.356 0.408 2 1 1384 . 1 1 A 125 125 ARG C C 125 175.713 174.775 0.938 2 1 1385 . 1 1 A 125 125 ARG CA C 125 53.991 54.383 -0.392 2 1 1386 . 1 1 A 125 125 ARG CB C 125 33.557 33.119 0.438 2 1 1389 . 1 1 A 125 125 ARG N N 125 130.004 128.747 1.257 2 1 1390 . 1 1 A 126 126 SER H H 126 9.172 9.368 -0.196 2 1 1391 . 1 1 A 126 126 SER HA H 126 5.390 5.205 0.185 2 1 1394 . 1 1 A 126 126 SER C C 126 172.359 173.065 -0.706 2 1 1395 . 1 1 A 126 126 SER CA C 126 56.934 57.102 -0.168 2 1 1396 . 1 1 A 126 126 SER CB C 126 65.827 65.594 0.233 2 1 1397 . 1 1 A 126 126 SER N N 126 119.906 121.634 -1.728 2 1 1398 . 1 1 A 127 127 SER H H 127 8.591 9.149 -0.558 2 1 1399 . 1 1 A 127 127 SER HA H 127 5.739 5.404 0.335 2 1 1401 . 1 1 A 127 127 SER C C 127 173.283 173.237 0.046 2 1 1402 . 1 1 A 127 127 SER CA C 127 57.354 57.495 -0.141 2 1 1403 . 1 1 A 127 127 SER CB C 127 65.412 64.691 0.721 2 1 1404 . 1 1 A 127 127 SER N N 127 117.914 121.683 -3.769 2 1 1405 . 1 1 A 128 128 TRP H H 128 9.866 9.791 0.075 2 1 1406 . 1 1 A 128 128 TRP HA H 128 5.560 5.660 -0.100 2 1 1415 . 1 1 A 128 128 TRP C C 128 175.828 175.119 0.708 2 1 1416 . 1 1 A 128 128 TRP CA C 128 55.852 55.739 0.113 2 1 1417 . 1 1 A 128 128 TRP CB C 128 32.524 33.028 -0.504 2 1 1423 . 1 1 A 128 128 TRP N N 128 127.978 125.834 2.144 2 1 1425 . 1 1 A 129 129 LYS H H 129 9.424 9.294 0.130 2 1 1426 . 1 1 A 129 129 LYS HA H 129 5.388 5.354 0.034 2 1 1433 . 1 1 A 129 129 LYS C C 129 175.254 174.489 0.765 2 1 1434 . 1 1 A 129 129 LYS CA C 129 54.410 54.767 -0.358 2 1 1435 . 1 1 A 129 129 LYS CB C 129 35.734 36.099 -0.365 2 1 1439 . 1 1 A 129 129 LYS N N 129 121.784 121.150 0.633 2 1 1440 . 1 1 A 130 130 LEU H H 130 8.933 9.393 -0.460 2 1 1441 . 1 1 A 130 130 LEU HA H 130 4.859 5.058 -0.199 2 1 1447 . 1 1 A 130 130 LEU C C 130 173.893 174.394 -0.501 2 1 1448 . 1 1 A 130 130 LEU CA C 130 53.848 54.019 -0.171 2 1 1449 . 1 1 A 130 130 LEU CB C 130 46.125 45.897 0.228 2 1 1451 . 1 1 A 130 130 LEU N N 130 124.543 124.842 -0.299 2 1 1452 . 1 1 A 131 131 ALA H H 131 8.816 8.841 -0.025 2 1 1453 . 1 1 A 131 131 ALA HA H 131 4.776 4.911 -0.135 2 1 1457 . 1 1 A 131 131 ALA C C 131 176.662 176.617 0.046 2 1 1458 . 1 1 A 131 131 ALA CA C 131 51.407 50.811 0.596 2 1 1459 . 1 1 A 131 131 ALA CB C 131 19.354 20.142 -0.788 2 1 1460 . 1 1 A 131 131 ALA N N 131 131.102 129.474 1.628 2 1 1461 . 1 1 A 132 132 LEU H H 132 8.487 8.787 -0.300 2 1 1462 . 1 1 A 132 132 LEU HA H 132 4.470 4.640 -0.170 2 1 1470 . 1 1 A 132 132 LEU C C 132 176.873 176.275 0.598 2 1 1471 . 1 1 A 132 132 LEU CA C 132 54.590 54.556 0.034 2 1 1472 . 1 1 A 132 132 LEU CB C 132 42.974 42.783 0.191 2 1 1475 . 1 1 A 132 132 LEU N N 132 123.724 125.058 -1.334 2 1 1476 . 1 1 A 133 133 SER H H 133 8.448 8.776 -0.328 2 1 1477 . 1 1 A 133 133 SER HA H 133 4.560 4.908 -0.348 2 1 1479 . 1 1 A 133 133 SER C C 133 176.043 174.184 1.859 2 1 1480 . 1 1 A 133 133 SER CA C 133 58.460 57.638 0.822 2 1 1481 . 1 1 A 133 133 SER CB C 133 63.985 64.349 -0.364 2 1 1482 . 1 1 A 133 133 SER N N 133 115.880 118.889 -3.009 2 1 1483 . 1 1 A 134 134 GLY H H 134 8.232 8.764 -0.532 2 1 1484 . 1 1 A 134 134 GLY HA2 H 134 4.147 3.985 0.162 2 1 1485 . 1 1 A 134 134 GLY HA3 H 134 4.045 3.998 0.047 2 1 1486 . 1 1 A 134 134 GLY C C 134 174.013 174.276 -0.263 2 1 1487 . 1 1 A 134 134 GLY CA C 134 45.337 46.147 -0.810 2 1 1488 . 1 1 A 134 134 GLY N N 134 109.970 112.281 -2.311 2 1 1489 . 1 1 A 135 135 ALA H H 135 8.424 8.249 0.175 2 1 1490 . 1 1 A 135 135 ALA HA H 135 4.436 4.244 0.192 2 1 1494 . 1 1 A 135 135 ALA C C 135 177.537 176.796 0.741 2 1 1495 . 1 1 A 135 135 ALA CA C 135 52.721 53.184 -0.463 2 1 1496 . 1 1 A 135 135 ALA CB C 135 19.265 19.090 0.175 2 1 1497 . 1 1 A 135 135 ALA N N 135 124.118 122.549 1.569 2 1 1498 . 1 1 A 136 136 HIS H H 136 8.466 8.155 0.311 2 1 1499 . 1 1 A 136 136 HIS HA H 136 4.379 4.746 -0.367 2 1 1500 . 1 1 A 136 136 HIS C C 136 176.259 174.992 1.267 2 1 1501 . 1 1 A 136 136 HIS CA C 136 56.082 56.067 0.015 2 1 1502 . 1 1 A 136 136 HIS CB C 136 29.619 31.233 -1.614 2 1 1503 . 1 1 A 136 136 HIS N N 136 119.493 115.249 4.244 2 1 1504 . 1 1 A 137 137 GLY H H 137 8.431 8.284 0.147 2 1 1505 . 1 1 A 137 137 GLY HA2 H 137 4.151 3.930 0.221 2 1 1506 . 1 1 A 137 137 GLY HA3 H 137 3.893 3.970 -0.077 2 1 1507 . 1 1 A 137 137 GLY C C 137 174.039 172.988 1.051 2 1 1508 . 1 1 A 137 137 GLY CA C 137 45.372 45.449 -0.077 2 1 1509 . 1 1 A 137 137 GLY N N 137 110.442 109.529 0.913 2 1 1510 . 1 1 A 138 138 GLN H H 138 8.416 8.134 0.282 2 1 1511 . 1 1 A 138 138 GLN HA H 138 4.455 4.759 -0.304 2 1 1515 . 1 1 A 138 138 GLN C C 138 175.889 174.785 1.104 2 1 1516 . 1 1 A 138 138 GLN CA C 138 55.866 55.017 0.849 2 1 1517 . 1 1 A 138 138 GLN CB C 138 29.639 30.615 -0.976 2 1 1518 . 1 1 A 138 138 GLN N N 138 119.401 120.492 -1.091 2 1 1519 . 1 1 A 139 139 GLU H H 139 8.446 8.732 -0.286 2 1 1520 . 1 1 A 139 139 GLU HA H 139 4.658 4.835 -0.177 2 1 1524 . 1 1 A 139 139 GLU CA C 139 54.589 53.688 0.901 2 1 1525 . 1 1 A 139 139 GLU CB C 139 29.733 31.058 -1.325 2 1 1527 . 1 1 A 139 139 GLU N N 139 123.136 124.363 -1.227 2 1 1528 . 1 1 A 140 140 PRO HA H 140 4.537 4.695 -0.158 2 1 1533 . 1 1 A 140 140 PRO C C 140 176.119 176.031 0.088 2 1 1534 . 1 1 A 140 140 PRO CA C 140 63.220 62.642 0.578 2 1 1535 . 1 1 A 140 140 PRO CB C 140 31.936 31.877 0.059 2 1 1538 . 1 1 A 141 141 GLN H H 141 8.506 8.579 -0.073 2 1 1539 . 1 1 A 141 141 GLN HA H 141 4.650 4.808 -0.158 2 1 1546 . 1 1 A 141 141 GLN C C 141 175.811 175.720 0.092 2 1 1547 . 1 1 A 141 141 GLN CA C 141 55.912 55.336 0.576 2 1 1548 . 1 1 A 141 141 GLN CB C 141 30.241 29.779 0.462 2 1 1550 . 1 1 A 141 141 GLN N N 141 120.422 122.174 -1.752 2 1 1551 . 1 1 A 142 142 LEU H H 142 8.842 9.082 -0.240 2 1 1552 . 1 1 A 142 142 LEU HA H 142 5.277 5.215 0.062 2 1 1562 . 1 1 A 142 142 LEU C C 142 176.839 175.321 1.518 2 1 1563 . 1 1 A 142 142 LEU CA C 142 53.927 52.950 0.977 2 1 1564 . 1 1 A 142 142 LEU CB C 142 44.527 45.025 -0.498 2 1 1568 . 1 1 A 142 142 LEU N N 142 123.692 121.205 2.487 2 1 1569 . 1 1 A 143 143 THR H H 143 9.025 8.937 0.088 2 1 1570 . 1 1 A 143 143 THR HA H 143 5.262 5.068 0.194 2 1 1575 . 1 1 A 143 143 THR C C 143 173.753 173.846 -0.093 2 1 1576 . 1 1 A 143 143 THR CA C 143 61.795 61.826 -0.031 2 1 1577 . 1 1 A 143 143 THR CB C 143 70.660 70.711 -0.051 2 1 1579 . 1 1 A 143 143 THR N N 143 117.222 115.937 1.285 2 1 1580 . 1 1 A 144 144 ILE H H 144 9.353 10.181 -0.828 2 1 1581 . 1 1 A 144 144 ILE HA H 144 5.399 5.230 0.169 2 1 1591 . 1 1 A 144 144 ILE C C 144 173.931 173.818 0.113 2 1 1592 . 1 1 A 144 144 ILE CA C 144 60.774 60.386 0.388 2 1 1593 . 1 1 A 144 144 ILE CB C 144 41.111 40.066 1.045 2 1 1597 . 1 1 A 144 144 ILE N N 144 126.383 127.493 -1.110 2 1 1598 . 1 1 A 145 145 ASP H H 145 9.214 9.469 -0.254 2 1 1599 . 1 1 A 145 145 ASP HA H 145 5.978 5.458 0.520 2 1 1601 . 1 1 A 145 145 ASP C C 145 175.441 174.781 0.660 2 1 1602 . 1 1 A 145 145 ASP CA C 145 53.035 52.751 0.284 2 1 1603 . 1 1 A 145 145 ASP CB C 145 44.153 43.885 0.268 2 1 1604 . 1 1 A 145 145 ASP N N 145 127.981 128.655 -0.674 2 1 1605 . 1 1 A 146 146 LEU H H 146 9.387 9.892 -0.505 2 1 1606 . 1 1 A 146 146 LEU HA H 146 4.918 5.418 -0.500 2 1 1616 . 1 1 A 146 146 LEU C C 146 175.003 174.760 0.243 2 1 1617 . 1 1 A 146 146 LEU CA C 146 53.940 53.601 0.339 2 1 1618 . 1 1 A 146 146 LEU CB C 146 43.902 43.448 0.454 2 1 1622 . 1 1 A 146 146 LEU N N 146 123.532 127.352 -3.820 2 1 1623 . 1 1 A 147 147 ASP H H 147 8.676 8.848 -0.172 2 1 1624 . 1 1 A 147 147 ASP HA H 147 5.205 5.330 -0.125 2 1 1627 . 1 1 A 147 147 ASP C C 147 174.956 174.447 0.509 2 1 1628 . 1 1 A 147 147 ASP CA C 147 53.441 52.464 0.977 2 1 1629 . 1 1 A 147 147 ASP CB C 147 43.370 43.806 -0.436 2 1 1630 . 1 1 A 147 147 ASP N N 147 125.499 126.011 -0.512 2 1 1631 . 1 1 A 148 148 SER H H 148 8.732 9.125 -0.393 2 1 1632 . 1 1 A 148 148 SER HA H 148 5.365 5.168 0.197 2 1 1634 . 1 1 A 148 148 SER C C 148 173.217 173.123 0.094 2 1 1635 . 1 1 A 148 148 SER CA C 148 56.334 56.116 0.218 2 1 1636 . 1 1 A 148 148 SER CB C 148 65.812 66.283 -0.471 2 1 1637 . 1 1 A 148 148 SER N N 148 118.623 119.372 -0.749 2 1 1638 . 1 1 A 149 149 ALA H H 149 8.937 8.803 0.134 2 1 1639 . 1 1 A 149 149 ALA HA H 149 5.681 5.166 0.515 2 1 1643 . 1 1 A 149 149 ALA C C 149 178.894 177.612 1.282 2 1 1644 . 1 1 A 149 149 ALA CA C 149 49.996 50.315 -0.319 2 1 1645 . 1 1 A 149 149 ALA CB C 149 23.231 22.434 0.797 2 1 1646 . 1 1 A 149 149 ALA N N 149 123.952 123.557 0.395 2 1 1647 . 1 1 A 150 150 ASP H H 150 9.010 8.780 0.230 2 1 1648 . 1 1 A 150 150 ASP HA H 150 4.336 4.330 0.006 2 1 1651 . 1 1 A 150 150 ASP C C 150 176.697 177.262 -0.565 2 1 1652 . 1 1 A 150 150 ASP CA C 150 56.543 57.112 -0.569 2 1 1653 . 1 1 A 150 150 ASP CB C 150 39.850 40.515 -0.665 2 1 1654 . 1 1 A 150 150 ASP N N 150 122.687 122.483 0.204 2 1 1655 . 1 1 A 151 151 PHE H H 151 7.295 7.919 -0.624 2 1 1656 . 1 1 A 151 151 PHE HA H 151 5.020 4.639 0.381 2 1 1661 . 1 1 A 151 151 PHE C C 151 174.756 175.737 -0.981 2 1 1662 . 1 1 A 151 151 PHE CA C 151 56.594 58.159 -1.565 2 1 1663 . 1 1 A 151 151 PHE CB C 151 37.765 38.461 -0.696 2 1 1666 . 1 1 A 151 151 PHE N N 151 113.928 117.757 -3.829 2 1 1667 . 1 1 A 152 152 GLY H H 152 7.786 8.240 -0.454 2 1 1668 . 1 1 A 152 152 GLY HA2 H 152 4.459 3.994 0.465 2 1 1669 . 1 1 A 152 152 GLY HA3 H 152 3.728 4.021 -0.293 2 1 1670 . 1 1 A 152 152 GLY C C 152 172.709 173.508 -0.799 2 1 1671 . 1 1 A 152 152 GLY CA C 152 46.106 46.546 -0.440 2 1 1672 . 1 1 A 152 152 GLY N N 152 110.312 108.664 1.648 2 1 1673 . 1 1 A 153 153 TYR H H 153 6.650 7.563 -0.913 2 1 1674 . 1 1 A 153 153 TYR HA H 153 4.508 4.964 -0.456 2 1 1679 . 1 1 A 153 153 TYR C C 153 173.092 173.470 -0.378 2 1 1680 . 1 1 A 153 153 TYR CA C 153 57.464 57.417 0.047 2 1 1681 . 1 1 A 153 153 TYR CB C 153 41.962 41.843 0.119 2 1 1684 . 1 1 A 153 153 TYR N N 153 121.977 119.504 2.473 2 1 1685 . 1 1 A 154 154 ALA H H 154 7.847 8.488 -0.641 2 1 1686 . 1 1 A 154 154 ALA HA H 154 5.144 4.827 0.317 2 1 1690 . 1 1 A 154 154 ALA C C 154 174.468 174.960 -0.492 2 1 1691 . 1 1 A 154 154 ALA CA C 154 51.776 51.040 0.736 2 1 1692 . 1 1 A 154 154 ALA CB C 154 21.747 21.868 -0.121 2 1 1693 . 1 1 A 154 154 ALA N N 154 130.258 129.547 0.711 2 1 1694 . 1 1 A 155 155 VAL H H 155 8.733 8.933 -0.200 2 1 1695 . 1 1 A 155 155 VAL HA H 155 4.150 4.772 -0.622 2 1 1700 . 1 1 A 155 155 VAL C C 155 172.632 173.450 -0.818 2 1 1701 . 1 1 A 155 155 VAL CA C 155 61.451 59.355 2.096 2 1 1702 . 1 1 A 155 155 VAL CB C 155 35.883 35.235 0.648 2 1 1704 . 1 1 A 155 155 VAL N N 155 119.622 121.813 -2.191 2 1 1705 . 1 1 A 156 156 GLY H H 156 8.146 8.407 -0.261 2 1 1706 . 1 1 A 156 156 GLY HA2 H 156 5.125 2.822 2.303 2 1 1707 . 1 1 A 156 156 GLY HA3 H 156 2.061 3.983 -1.922 2 1 1708 . 1 1 A 156 156 GLY C C 156 171.746 171.593 0.153 2 1 1709 . 1 1 A 156 156 GLY CA C 156 43.319 43.706 -0.387 2 1 1710 . 1 1 A 156 156 GLY N N 156 113.332 113.506 -0.174 2 1 1711 . 1 1 A 157 157 GLU H H 157 8.967 8.875 0.092 2 1 1712 . 1 1 A 157 157 GLU HA H 157 5.217 5.085 0.132 2 1 1716 . 1 1 A 157 157 GLU C C 157 174.476 175.327 -0.851 2 1 1717 . 1 1 A 157 157 GLU CA C 157 55.390 54.958 0.432 2 1 1718 . 1 1 A 157 157 GLU CB C 157 34.010 32.949 1.061 2 1 1720 . 1 1 A 157 157 GLU N N 157 120.823 122.544 -1.721 2 1 1721 . 1 1 A 158 158 VAL H H 158 9.076 9.437 -0.361 2 1 1722 . 1 1 A 158 158 VAL HA H 158 5.206 4.876 0.330 2 1 1727 . 1 1 A 158 158 VAL C C 158 173.900 174.286 -0.386 2 1 1728 . 1 1 A 158 158 VAL CA C 158 60.813 61.650 -0.837 2 1 1729 . 1 1 A 158 158 VAL CB C 158 33.385 33.365 0.020 2 1 1731 . 1 1 A 158 158 VAL N N 158 124.349 125.204 -0.855 2 1 1732 . 1 1 A 159 159 GLU H H 159 9.239 9.655 -0.416 2 1 1733 . 1 1 A 159 159 GLU HA H 159 5.647 5.230 0.417 2 1 1738 . 1 1 A 159 159 GLU C C 159 174.469 175.138 -0.669 2 1 1739 . 1 1 A 159 159 GLU CA C 159 54.473 54.694 -0.221 2 1 1740 . 1 1 A 159 159 GLU CB C 159 33.852 32.717 1.135 2 1 1742 . 1 1 A 159 159 GLU N N 159 125.772 128.971 -3.199 2 1 1743 . 1 1 A 160 160 ALA H H 160 9.250 9.280 -0.030 2 1 1744 . 1 1 A 160 160 ALA HA H 160 4.966 5.377 -0.411 2 1 1748 . 1 1 A 160 160 ALA C C 160 175.114 175.678 -0.564 2 1 1749 . 1 1 A 160 160 ALA CA C 160 50.644 50.212 0.432 2 1 1750 . 1 1 A 160 160 ALA CB C 160 23.263 22.859 0.404 2 1 1751 . 1 1 A 160 160 ALA N N 160 125.092 129.454 -4.362 2 1 1752 . 1 1 A 161 161 MET H H 161 8.559 8.855 -0.296 2 1 1753 . 1 1 A 161 161 MET HA H 161 5.468 5.865 -0.397 2 1 1761 . 1 1 A 161 161 MET C C 161 176.265 174.902 1.363 2 1 1762 . 1 1 A 161 161 MET CA C 161 53.818 54.121 -0.303 2 1 1763 . 1 1 A 161 161 MET CB C 161 34.380 34.953 -0.573 2 1 1766 . 1 1 A 161 161 MET N N 161 118.699 119.899 -1.200 2 1 1767 . 1 1 A 162 162 VAL H H 162 9.046 9.122 -0.076 2 1 1768 . 1 1 A 162 162 VAL HA H 162 4.841 4.828 0.013 2 1 1776 . 1 1 A 162 162 VAL C C 162 174.794 175.843 -1.049 2 1 1777 . 1 1 A 162 162 VAL CA C 162 59.107 59.885 -0.778 2 1 1778 . 1 1 A 162 162 VAL CB C 162 34.018 34.301 -0.283 2 1 1781 . 1 1 A 162 162 VAL N N 162 116.435 119.749 -3.314 2 1 1782 . 1 1 A 163 163 HIS H H 163 8.793 8.692 0.101 2 1 1783 . 1 1 A 163 163 HIS HA H 163 4.717 4.726 -0.009 2 1 1787 . 1 1 A 163 163 HIS C C 163 175.460 174.594 0.866 2 1 1788 . 1 1 A 163 163 HIS CA C 163 58.488 57.482 1.006 2 1 1789 . 1 1 A 163 163 HIS CB C 163 31.185 30.778 0.407 2 1 1791 . 1 1 A 163 163 HIS N N 163 117.838 122.412 -4.574 2 1 1792 . 1 1 A 164 164 GLU H H 164 8.013 7.736 0.277 2 1 1793 . 1 1 A 164 164 GLU HA H 164 4.814 4.584 0.230 2 1 1797 . 1 1 A 164 164 GLU C C 164 176.910 176.383 0.527 2 1 1798 . 1 1 A 164 164 GLU CA C 164 54.355 54.902 -0.547 2 1 1799 . 1 1 A 164 164 GLU CB C 164 32.886 32.087 0.799 2 1 1801 . 1 1 A 164 164 GLU N N 164 115.943 116.496 -0.553 2 1 1802 . 1 1 A 165 165 LYS H H 165 9.088 8.873 0.215 2 1 1803 . 1 1 A 165 165 LYS HA H 165 3.942 3.983 -0.041 2 1 1809 . 1 1 A 165 165 LYS C C 165 179.657 177.898 1.759 2 1 1810 . 1 1 A 165 165 LYS CA C 165 59.888 58.449 1.439 2 1 1811 . 1 1 A 165 165 LYS CB C 165 32.024 32.340 -0.316 2 1 1814 . 1 1 A 165 165 LYS N N 165 124.120 124.047 0.072 2 1 1815 . 1 1 A 166 166 ALA H H 166 8.851 7.923 0.928 2 1 1816 . 1 1 A 166 166 ALA HA H 166 4.251 4.068 0.183 2 1 1820 . 1 1 A 166 166 ALA C C 166 178.920 178.570 0.350 2 1 1821 . 1 1 A 166 166 ALA CA C 166 54.318 54.513 -0.195 2 1 1822 . 1 1 A 166 166 ALA CB C 166 18.810 18.296 0.514 2 1 1823 . 1 1 A 166 166 ALA N N 166 120.424 122.243 -1.819 2 1 1824 . 1 1 A 167 167 GLU H H 167 7.871 7.910 -0.039 2 1 1825 . 1 1 A 167 167 GLU HA H 167 4.404 4.355 0.049 2 1 1829 . 1 1 A 167 167 GLU C C 167 177.368 177.995 -0.627 2 1 1830 . 1 1 A 167 167 GLU CA C 167 56.701 56.808 -0.107 2 1 1831 . 1 1 A 167 167 GLU CB C 167 31.208 29.895 1.313 2 1 1833 . 1 1 A 167 167 GLU N N 167 114.926 115.766 -0.840 2 1 1834 . 1 1 A 168 168 VAL H H 168 7.812 7.523 0.289 2 1 1835 . 1 1 A 168 168 VAL HA H 168 3.712 3.676 0.036 2 1 1843 . 1 1 A 168 168 VAL CA C 168 68.705 67.887 0.818 2 1 1844 . 1 1 A 168 168 VAL CB C 168 29.597 29.749 -0.152 2 1 1847 . 1 1 A 168 168 VAL N N 168 120.188 122.024 -1.836 2 1 1848 . 1 1 A 169 169 PRO HA H 169 4.252 4.238 0.014 2 1 1851 . 1 1 A 169 169 PRO C C 169 179.563 178.634 0.929 2 1 1852 . 1 1 A 169 169 PRO CA C 169 67.077 66.747 0.330 2 1 1853 . 1 1 A 170 170 ALA H H 170 8.149 8.201 -0.052 2 1 1854 . 1 1 A 170 170 ALA HA H 170 4.265 4.064 0.201 2 1 1858 . 1 1 A 170 170 ALA C C 170 180.637 179.820 0.817 2 1 1859 . 1 1 A 170 170 ALA CA C 170 54.823 55.336 -0.513 2 1 1860 . 1 1 A 170 170 ALA CB C 170 18.518 18.158 0.360 2 1 1861 . 1 1 A 170 170 ALA N N 170 119.210 119.163 0.047 2 1 1862 . 1 1 A 171 171 ALA H H 171 7.767 8.346 -0.579 2 1 1863 . 1 1 A 171 171 ALA HA H 171 4.106 4.146 -0.040 2 1 1867 . 1 1 A 171 171 ALA C C 171 179.371 179.958 -0.587 2 1 1868 . 1 1 A 171 171 ALA CA C 171 55.130 55.012 0.118 2 1 1869 . 1 1 A 171 171 ALA CB C 171 18.291 18.150 0.141 2 1 1870 . 1 1 A 171 171 ALA N N 171 122.126 120.661 1.465 2 1 1871 . 1 1 A 172 172 LEU H H 172 8.950 8.279 0.671 2 1 1872 . 1 1 A 172 172 LEU HA H 172 3.987 4.093 -0.106 2 1 1878 . 1 1 A 172 172 LEU C C 172 178.355 178.593 -0.238 2 1 1879 . 1 1 A 172 172 LEU CA C 172 57.803 57.854 -0.051 2 1 1880 . 1 1 A 172 172 LEU CB C 172 41.667 41.668 -0.001 2 1 1882 . 1 1 A 172 172 LEU N N 172 118.682 120.522 -1.840 2 1 1883 . 1 1 A 173 173 GLU H H 173 7.886 8.013 -0.127 2 1 1884 . 1 1 A 173 173 GLU HA H 173 4.132 3.962 0.170 2 1 1887 . 1 1 A 173 173 GLU C C 173 179.556 179.346 0.210 2 1 1888 . 1 1 A 173 173 GLU CA C 173 59.800 59.551 0.249 2 1 1889 . 1 1 A 173 173 GLU CB C 173 29.580 29.191 0.389 2 1 1891 . 1 1 A 173 173 GLU N N 173 117.561 118.717 -1.156 2 1 1892 . 1 1 A 174 174 LYS H H 174 7.532 7.743 -0.211 2 1 1893 . 1 1 A 174 174 LYS HA H 174 4.131 4.050 0.082 2 1 1901 . 1 1 A 174 174 LYS CA C 174 58.999 59.290 -0.291 2 1 1902 . 1 1 A 174 174 LYS CB C 174 32.041 32.395 -0.354 2 1 1906 . 1 1 A 174 174 LYS N N 174 119.085 119.854 -0.769 2 1 1907 . 1 1 A 175 175 ILE H H 175 8.479 8.023 0.456 2 1 1908 . 1 1 A 175 175 ILE HA H 175 3.583 3.606 -0.023 2 1 1918 . 1 1 A 175 175 ILE C C 175 179.258 178.416 0.842 2 1 1919 . 1 1 A 175 175 ILE CA C 175 65.769 65.594 0.175 2 1 1920 . 1 1 A 175 175 ILE CB C 175 37.876 37.955 -0.079 2 1 1923 . 1 1 A 175 175 ILE N N 175 118.828 119.688 -0.860 2 1 1924 . 1 1 A 176 176 ILE H H 176 8.928 8.063 0.865 2 1 1925 . 1 1 A 176 176 ILE HA H 176 3.600 3.595 0.005 2 1 1935 . 1 1 A 176 176 ILE C C 176 178.827 178.159 0.668 2 1 1936 . 1 1 A 176 176 ILE CA C 176 65.640 64.949 0.691 2 1 1937 . 1 1 A 176 176 ILE CB C 176 37.451 37.400 0.051 2 1 1941 . 1 1 A 176 176 ILE N N 176 124.527 119.928 4.599 2 1 1942 . 1 1 A 177 177 THR H H 177 8.175 8.163 0.012 2 1 1943 . 1 1 A 177 177 THR HA H 177 3.885 3.939 -0.054 2 1 1948 . 1 1 A 177 177 THR C C 177 176.867 176.421 0.446 2 1 1949 . 1 1 A 177 177 THR CA C 177 67.199 66.408 0.791 2 1 1950 . 1 1 A 177 177 THR CB C 177 68.377 68.501 -0.124 2 1 1952 . 1 1 A 177 177 THR N N 177 119.412 118.575 0.837 2 1 1953 . 1 1 A 178 178 VAL H H 178 8.352 8.068 0.284 2 1 1954 . 1 1 A 178 178 VAL HA H 178 3.572 3.431 0.141 2 1 1962 . 1 1 A 178 178 VAL C C 178 177.664 177.870 -0.206 2 1 1963 . 1 1 A 178 178 VAL CA C 178 66.909 66.400 0.510 2 1 1964 . 1 1 A 178 178 VAL CB C 178 31.714 31.311 0.403 2 1 1967 . 1 1 A 178 178 VAL N N 178 121.168 121.901 -0.733 2 1 1968 . 1 1 A 179 179 SER H H 179 8.529 8.184 0.345 2 1 1969 . 1 1 A 179 179 SER HA H 179 3.099 3.389 -0.290 2 1 1972 . 1 1 A 179 179 SER C C 179 175.380 176.222 -0.843 2 1 1973 . 1 1 A 179 179 SER CA C 179 62.728 61.696 1.032 2 1 1974 . 1 1 A 179 179 SER CB C 179 62.802 62.529 0.273 2 1 1975 . 1 1 A 179 179 SER N N 179 115.226 115.644 -0.418 2 1 1976 . 1 1 A 180 180 SER H H 180 7.757 8.168 -0.411 2 1 1977 . 1 1 A 180 180 SER HA H 180 4.419 4.271 0.148 2 1 1980 . 1 1 A 180 180 SER C C 180 175.359 176.688 -1.329 2 1 1981 . 1 1 A 180 180 SER CA C 180 61.025 61.371 -0.346 2 1 1982 . 1 1 A 180 180 SER CB C 180 63.072 63.002 0.070 2 1 1983 . 1 1 A 180 180 SER N N 180 114.718 116.099 -1.381 2 1 1984 . 1 1 A 181 181 MET H H 181 7.497 7.834 -0.337 2 1 1985 . 1 1 A 181 181 MET HA H 181 4.283 4.248 0.035 2 1 1993 . 1 1 A 181 181 MET C C 181 177.217 177.310 -0.093 2 1 1994 . 1 1 A 181 181 MET CA C 181 57.539 57.770 -0.231 2 1 1995 . 1 1 A 181 181 MET CB C 181 33.493 32.474 1.019 2 1 1998 . 1 1 A 181 181 MET N N 181 119.274 119.680 -0.406 2 1 1999 . 1 1 A 182 182 LEU H H 182 7.163 7.521 -0.358 2 1 2000 . 1 1 A 182 182 LEU HA H 182 4.133 4.328 -0.195 2 1 2010 . 1 1 A 182 182 LEU C C 182 176.289 176.752 -0.463 2 1 2011 . 1 1 A 182 182 LEU CA C 182 54.750 55.184 -0.434 2 1 2012 . 1 1 A 182 182 LEU CB C 182 43.235 42.747 0.488 2 1 2016 . 1 1 A 182 182 LEU N N 182 115.869 118.129 -2.260 2 1 2017 . 1 1 A 183 183 GLY H H 183 7.492 7.389 0.103 2 1 2018 . 1 1 A 183 183 GLY HA2 H 183 4.086 4.146 -0.060 2 1 2019 . 1 1 A 183 183 GLY HA3 H 183 4.425 4.197 0.229 2 1 2020 . 1 1 A 183 183 GLY C C 183 171.830 171.906 -0.076 2 1 2021 . 1 1 A 183 183 GLY CA C 183 46.035 46.000 0.035 2 1 2022 . 1 1 A 183 183 GLY N N 183 107.761 105.767 1.994 2 1 2023 . 1 1 A 184 184 VAL H H 184 8.099 8.518 -0.419 2 1 2024 . 1 1 A 184 184 VAL HA H 184 4.772 4.790 -0.018 2 1 2032 . 1 1 A 184 184 VAL CA C 184 59.305 58.733 0.572 2 1 2033 . 1 1 A 184 184 VAL CB C 184 33.648 35.098 -1.450 2 1 2036 . 1 1 A 184 184 VAL N N 184 119.803 121.611 -1.808 2 1 2037 . 1 1 A 185 185 PRO HA H 185 4.442 4.741 -0.299 2 1 2042 . 1 1 A 185 185 PRO C C 185 175.871 176.387 -0.516 2 1 2043 . 1 1 A 185 185 PRO CA C 185 63.886 62.683 1.203 2 1 2044 . 1 1 A 185 185 PRO CB C 185 32.260 32.363 -0.103 2 1 2047 . 1 1 A 186 186 ALA H H 186 8.222 8.855 -0.633 2 1 2048 . 1 1 A 186 186 ALA HA H 186 4.569 4.821 -0.252 2 1 2052 . 1 1 A 186 186 ALA C C 186 177.481 176.310 1.171 2 1 2053 . 1 1 A 186 186 ALA CA C 186 51.823 50.795 1.028 2 1 2054 . 1 1 A 186 186 ALA CB C 186 20.233 21.665 -1.431 2 1 2055 . 1 1 A 186 186 ALA N N 186 125.663 122.465 3.198 2 1 2056 . 1 1 A 187 187 GLN H H 187 8.723 8.670 0.053 2 1 2057 . 1 1 A 187 187 GLN HA H 187 4.420 4.743 -0.323 2 1 2063 . 1 1 A 187 187 GLN C C 187 175.566 175.507 0.059 2 1 2064 . 1 1 A 187 187 GLN CA C 187 56.051 55.167 0.884 2 1 2065 . 1 1 A 187 187 GLN CB C 187 29.812 30.401 -0.589 2 1 2067 . 1 1 A 187 187 GLN N N 187 120.742 115.915 4.827 2 1 2069 . 1 1 A 188 188 GLU H H 188 8.163 8.253 -0.090 2 1 2070 . 1 1 A 188 188 GLU HA H 188 4.405 4.375 0.030 2 1 2074 . 1 1 A 188 188 GLU C C 188 176.058 176.815 -0.757 2 1 2075 . 1 1 A 188 188 GLU CA C 188 56.158 56.631 -0.473 2 1 2076 . 1 1 A 188 188 GLU CB C 188 31.095 29.852 1.243 2 1 2078 . 1 1 A 188 188 GLU N N 188 119.177 119.910 -0.733 2 1 2079 . 1 1 A 189 189 GLU H H 189 8.567 8.441 0.126 2 1 2080 . 1 1 A 189 189 GLU HA H 189 4.252 4.381 -0.129 2 1 2084 . 1 1 A 189 189 GLU C C 189 175.703 175.867 -0.164 2 1 2085 . 1 1 A 189 189 GLU CA C 189 56.417 57.038 -0.621 2 1 2086 . 1 1 A 189 189 GLU CB C 189 29.968 29.862 0.106 2 1 2088 . 1 1 A 189 189 GLU N N 189 120.920 121.146 -0.226 2 1 2089 . 1 1 A 190 190 ALA H H 190 8.271 8.082 0.189 2 1 2090 . 1 1 A 190 190 ALA HA H 190 4.626 4.230 0.396 2 1 2094 . 1 1 A 190 190 ALA CA C 190 50.465 51.875 -1.410 2 1 2095 . 1 1 A 190 190 ALA CB C 190 18.451 18.470 -0.019 2 1 2096 . 1 1 A 190 190 ALA N N 190 128.323 122.327 5.996 2 1 2097 . 1 1 A 191 191 PRO HA H 191 4.493 4.555 -0.062 2 1 2103 . 1 1 A 191 191 PRO C C 191 175.899 176.673 -0.774 2 1 2104 . 1 1 A 191 191 PRO CA C 191 62.044 62.375 -0.331 2 1 2105 . 1 1 A 191 191 PRO CB C 191 32.184 31.840 0.344 2 1 2108 . 1 1 A 192 192 ALA H H 192 8.610 8.211 0.399 2 1 2109 . 1 1 A 192 192 ALA HA H 192 4.280 4.418 -0.138 2 1 2113 . 1 1 A 192 192 ALA C C 192 178.282 178.166 0.116 2 1 2114 . 1 1 A 192 192 ALA CA C 192 51.698 51.972 -0.274 2 1 2115 . 1 1 A 192 192 ALA CB C 192 19.220 19.745 -0.525 2 1 2116 . 1 1 A 192 192 ALA N N 192 123.420 124.345 -0.925 2 1 2117 . 1 1 A 193 193 LYS H H 193 8.531 8.854 -0.323 2 1 2118 . 1 1 A 193 193 LYS HA H 193 3.294 3.812 -0.518 2 1 2126 . 1 1 A 193 193 LYS C C 193 177.640 178.390 -0.750 2 1 2127 . 1 1 A 193 193 LYS CA C 193 60.644 59.491 1.153 2 1 2128 . 1 1 A 193 193 LYS CB C 193 32.607 31.950 0.657 2 1 2132 . 1 1 A 193 193 LYS N N 193 122.851 120.564 2.287 2 1 2133 . 1 1 A 194 194 LEU H H 194 8.570 7.948 0.622 2 1 2134 . 1 1 A 194 194 LEU HA H 194 3.845 4.221 -0.376 2 1 2144 . 1 1 A 194 194 LEU C C 194 177.965 179.112 -1.147 2 1 2145 . 1 1 A 194 194 LEU CA C 194 57.611 57.459 0.152 2 1 2146 . 1 1 A 194 194 LEU CB C 194 41.776 40.765 1.011 2 1 2150 . 1 1 A 194 194 LEU N N 194 115.801 120.495 -4.694 2 1 2151 . 1 1 A 195 195 MET H H 195 6.782 7.955 -1.173 2 1 2152 . 1 1 A 195 195 MET HA H 195 4.487 4.177 0.310 2 1 2160 . 1 1 A 195 195 MET C C 195 178.280 178.419 -0.139 2 1 2161 . 1 1 A 195 195 MET CA C 195 56.858 58.289 -1.431 2 1 2162 . 1 1 A 195 195 MET CB C 195 31.557 31.886 -0.329 2 1 2165 . 1 1 A 195 195 MET N N 195 113.898 118.677 -4.779 2 1 2166 . 1 1 A 196 196 VAL H H 196 7.713 7.663 0.050 2 1 2167 . 1 1 A 196 196 VAL HA H 196 3.501 3.360 0.141 2 1 2175 . 1 1 A 196 196 VAL C C 196 177.624 177.697 -0.074 2 1 2176 . 1 1 A 196 196 VAL CA C 196 66.318 65.957 0.361 2 1 2177 . 1 1 A 196 196 VAL CB C 196 31.380 31.293 0.087 2 1 2180 . 1 1 A 196 196 VAL N N 196 120.413 119.602 0.811 2 1 2181 . 1 1 A 197 197 TYR H H 197 7.972 8.168 -0.196 2 1 2182 . 1 1 A 197 197 TYR HA H 197 3.145 4.025 -0.880 2 1 2187 . 1 1 A 197 197 TYR C C 197 177.726 176.999 0.727 2 1 2188 . 1 1 A 197 197 TYR CA C 197 62.253 61.644 0.609 2 1 2189 . 1 1 A 197 197 TYR CB C 197 37.314 38.609 -1.295 2 1 2192 . 1 1 A 197 197 TYR N N 197 119.543 121.145 -1.602 2 1 2193 . 1 1 A 198 198 LEU H H 198 8.630 8.269 0.361 2 1 2194 . 1 1 A 198 198 LEU HA H 198 3.923 3.711 0.212 2 1 2203 . 1 1 A 198 198 LEU C C 198 178.074 178.915 -0.841 2 1 2204 . 1 1 A 198 198 LEU CA C 198 58.294 57.896 0.398 2 1 2205 . 1 1 A 198 198 LEU CB C 198 42.177 41.516 0.661 2 1 2209 . 1 1 A 198 198 LEU N N 198 118.430 119.770 -1.340 2 1 2210 . 1 1 A 199 199 GLN H H 199 8.082 8.300 -0.218 2 1 2211 . 1 1 A 199 199 GLN HA H 199 3.054 3.642 -0.588 2 1 2216 . 1 1 A 199 199 GLN C C 199 176.875 178.147 -1.272 2 1 2217 . 1 1 A 199 199 GLN CA C 199 59.739 58.665 1.074 2 1 2218 . 1 1 A 199 199 GLN CB C 199 28.055 27.711 0.344 2 1 2220 . 1 1 A 199 199 GLN N N 199 117.926 117.310 0.616 2 1 2222 . 1 1 A 200 200 ARG H H 200 7.349 7.815 -0.466 2 1 2223 . 1 1 A 200 200 ARG HA H 200 3.798 3.854 -0.056 2 1 2231 . 1 1 A 200 200 ARG C C 200 178.037 177.988 0.050 2 1 2232 . 1 1 A 200 200 ARG CA C 200 58.260 58.815 -0.555 2 1 2233 . 1 1 A 200 200 ARG CB C 200 30.706 30.196 0.510 2 1 2236 . 1 1 A 200 200 ARG N N 200 113.772 119.475 -5.703 2 1 2238 . 1 1 A 201 201 PHE H H 201 8.329 7.658 0.671 2 1 2239 . 1 1 A 201 201 PHE HA H 201 4.630 4.448 0.182 2 1 2244 . 1 1 A 201 201 PHE C C 201 176.606 176.123 0.483 2 1 2245 . 1 1 A 201 201 PHE CA C 201 59.014 58.781 0.233 2 1 2246 . 1 1 A 201 201 PHE CB C 201 40.357 40.548 -0.191 2 1 2249 . 1 1 A 201 201 PHE N N 201 114.182 115.763 -1.581 2 1 2250 . 1 1 A 202 202 ARG H H 202 8.719 8.247 0.472 2 1 2251 . 1 1 A 202 202 ARG HA H 202 5.071 4.722 0.349 2 1 2261 . 1 1 A 202 202 ARG CA C 202 53.956 53.590 0.366 2 1 2262 . 1 1 A 202 202 ARG CB C 202 31.979 30.335 1.644 2 1 2264 . 1 1 A 202 202 ARG N N 202 120.115 116.015 4.100 2 1 2266 . 1 1 A 203 203 PRO HA H 203 4.348 4.507 -0.159 2 1 2271 . 1 1 A 203 203 PRO C C 203 179.736 178.411 1.325 2 1 2272 . 1 1 A 203 203 PRO CA C 203 65.674 65.272 0.402 2 1 2273 . 1 1 A 203 203 PRO CB C 203 31.717 32.157 -0.440 2 1 2275 . 1 1 A 204 204 LEU H H 204 8.875 7.591 1.284 2 1 2276 . 1 1 A 204 204 LEU HA H 204 4.291 4.011 0.280 2 1 2286 . 1 1 A 204 204 LEU C C 204 180.353 178.102 2.251 2 1 2287 . 1 1 A 204 204 LEU CA C 204 58.012 57.282 0.730 2 1 2288 . 1 1 A 204 204 LEU CB C 204 40.893 41.782 -0.889 2 1 2292 . 1 1 A 204 204 LEU N N 204 118.940 117.121 1.819 2 1 2293 . 1 1 A 205 205 ASP H H 205 7.541 8.371 -0.830 2 1 2294 . 1 1 A 205 205 ASP HA H 205 4.622 4.342 0.280 2 1 2297 . 1 1 A 205 205 ASP C C 205 177.602 178.024 -0.422 2 1 2298 . 1 1 A 205 205 ASP CA C 205 57.437 57.377 0.060 2 1 2299 . 1 1 A 205 205 ASP CB C 205 41.143 40.865 0.278 2 1 2300 . 1 1 A 205 205 ASP N N 205 120.838 119.432 1.406 2 1 2301 . 1 1 A 206 206 TYR H H 206 8.237 8.237 0.000 2 1 2302 . 1 1 A 206 206 TYR HA H 206 4.018 4.125 -0.107 2 1 2307 . 1 1 A 206 206 TYR C C 206 176.433 177.800 -1.367 2 1 2308 . 1 1 A 206 206 TYR CA C 206 62.148 61.712 0.436 2 1 2309 . 1 1 A 206 206 TYR CB C 206 38.305 38.471 -0.166 2 1 2312 . 1 1 A 206 206 TYR N N 206 119.475 120.589 -1.114 2 1 2313 . 1 1 A 207 207 GLN H H 207 8.124 8.107 0.017 2 1 2314 . 1 1 A 207 207 GLN HA H 207 3.823 3.299 0.524 2 1 2320 . 1 1 A 207 207 GLN C C 207 178.019 178.583 -0.564 2 1 2321 . 1 1 A 207 207 GLN CA C 207 58.841 58.978 -0.137 2 1 2322 . 1 1 A 207 207 GLN CB C 207 28.208 28.382 -0.174 2 1 2324 . 1 1 A 207 207 GLN N N 207 115.863 118.753 -2.890 2 1 2326 . 1 1 A 208 208 ARG H H 208 7.522 7.875 -0.352 2 1 2327 . 1 1 A 208 208 ARG HA H 208 4.127 4.083 0.044 2 1 2334 . 1 1 A 208 208 ARG C C 208 179.278 178.758 0.520 2 1 2335 . 1 1 A 208 208 ARG CA C 208 59.419 58.971 0.449 2 1 2336 . 1 1 A 208 208 ARG CB C 208 30.182 29.907 0.275 2 1 2338 . 1 1 A 208 208 ARG N N 208 118.471 119.734 -1.263 2 1 2340 . 1 1 A 209 209 LEU H H 209 7.869 7.737 0.132 2 1 2341 . 1 1 A 209 209 LEU HA H 209 4.091 4.142 -0.051 2 1 2351 . 1 1 A 209 209 LEU C C 209 179.715 178.621 1.094 2 1 2352 . 1 1 A 209 209 LEU CA C 209 57.891 57.987 -0.096 2 1 2353 . 1 1 A 209 209 LEU CB C 209 41.338 41.678 -0.340 2 1 2356 . 1 1 A 209 209 LEU N N 209 119.659 120.742 -1.083 2 1 2357 . 1 1 A 210 210 LEU H H 210 8.034 8.519 -0.485 2 1 2358 . 1 1 A 210 210 LEU HA H 210 3.977 3.997 -0.020 2 1 2367 . 1 1 A 210 210 LEU C C 210 180.363 178.512 1.851 2 1 2368 . 1 1 A 210 210 LEU CA C 210 57.459 58.471 -1.012 2 1 2369 . 1 1 A 210 210 LEU CB C 210 41.699 41.411 0.288 2 1 2373 . 1 1 A 210 210 LEU N N 210 120.967 119.883 1.084 2 1 2374 . 1 1 A 211 211 GLU H H 211 8.174 8.563 -0.389 2 1 2375 . 1 1 A 211 211 GLU HA H 211 4.075 4.042 0.033 2 1 2379 . 1 1 A 211 211 GLU C C 211 178.499 178.707 -0.208 2 1 2380 . 1 1 A 211 211 GLU CA C 211 58.575 59.440 -0.865 2 1 2381 . 1 1 A 211 211 GLU CB C 211 29.583 29.140 0.443 2 1 2383 . 1 1 A 211 211 GLU N N 211 119.217 118.007 1.210 2 1 2384 . 1 1 A 212 212 ALA H H 212 7.723 7.819 -0.096 2 1 2385 . 1 1 A 212 212 ALA HA H 212 4.291 4.256 0.035 2 1 2389 . 1 1 A 212 212 ALA C C 212 178.770 178.719 0.051 2 1 2390 . 1 1 A 212 212 ALA CA C 212 53.966 54.269 -0.303 2 1 2391 . 1 1 A 212 212 ALA CB C 212 19.117 18.714 0.403 2 1 2392 . 1 1 A 212 212 ALA N N 212 121.798 122.402 -0.604 2 1 2393 . 1 1 A 213 213 ALA H H 213 7.743 7.849 -0.106 2 1 2394 . 1 1 A 213 213 ALA HA H 213 4.406 4.453 -0.047 2 1 2398 . 1 1 A 213 213 ALA C C 213 178.413 177.897 0.516 2 1 2399 . 1 1 A 213 213 ALA CA C 213 53.129 52.473 0.656 2 1 2400 . 1 1 A 213 213 ALA CB C 213 18.926 19.135 -0.209 2 1 2401 . 1 1 A 213 213 ALA N N 213 120.435 119.741 0.694 2 1 2402 . 1 1 A 214 214 SER H H 214 7.944 8.086 -0.142 2 1 2403 . 1 1 A 214 214 SER HA H 214 4.559 4.389 0.170 2 1 2406 . 1 1 A 214 214 SER C C 214 174.958 174.571 0.387 2 1 2407 . 1 1 A 214 214 SER CA C 214 58.640 59.309 -0.669 2 1 2408 . 1 1 A 214 214 SER CB C 214 63.928 62.728 1.200 2 1 2409 . 1 1 A 214 214 SER N N 214 113.729 114.665 -0.936 2 1 2410 . 1 1 A 215 215 SER H H 215 8.255 8.286 -0.031 2 1 2411 . 1 1 A 215 215 SER HA H 215 4.547 4.563 -0.016 2 1 2413 . 1 1 A 215 215 SER C C 215 175.289 174.264 1.025 2 1 2414 . 1 1 A 215 215 SER CA C 215 58.833 58.463 0.370 2 1 2415 . 1 1 A 215 215 SER CB C 215 63.847 63.505 0.342 2 1 2416 . 1 1 A 215 215 SER N N 215 117.674 118.847 -1.173 2 1 2417 . 1 1 A 216 216 GLY H H 216 8.431 8.248 0.183 2 1 2418 . 1 1 A 216 216 GLY HA2 H 216 4.054 4.085 -0.031 2 1 2419 . 1 1 A 216 216 GLY C C 216 174.189 173.122 1.067 2 1 2420 . 1 1 A 216 216 GLY CA C 216 45.412 45.465 -0.053 2 1 2421 . 1 1 A 216 216 GLY N N 216 110.800 110.666 0.134 2 1 2422 . 1 1 A 217 217 GLU H H 217 8.267 8.509 -0.242 2 1 2423 . 1 1 A 217 217 GLU HA H 217 4.345 4.643 -0.298 2 1 2427 . 1 1 A 217 217 GLU C C 217 176.428 175.987 0.441 2 1 2428 . 1 1 A 217 217 GLU CA C 217 56.470 56.200 0.270 2 1 2429 . 1 1 A 217 217 GLU CB C 217 30.526 31.034 -0.508 2 1 2430 . 1 1 A 217 217 GLU N N 217 120.726 121.388 -0.662 2 1 2431 . 1 1 A 218 218 ALA H H 218 8.476 8.461 0.015 2 1 2432 . 1 1 A 218 218 ALA HA H 218 4.467 4.602 -0.135 2 1 2436 . 1 1 A 218 218 ALA C C 218 178.015 176.751 1.264 2 1 2437 . 1 1 A 218 218 ALA CA C 218 52.547 51.970 0.577 2 1 2438 . 1 1 A 218 218 ALA CB C 218 19.242 19.667 -0.425 2 1 2439 . 1 1 A 218 218 ALA N N 218 125.534 126.255 -0.721 2 1 2440 . 1 1 A 219 219 THR H H 219 8.232 8.464 -0.232 2 1 2441 . 1 1 A 219 219 THR HA H 219 4.411 4.675 -0.264 2 1 2446 . 1 1 A 219 219 THR C C 219 175.327 174.207 1.120 2 1 2447 . 1 1 A 219 219 THR CA C 219 61.889 61.295 0.594 2 1 2448 . 1 1 A 219 219 THR CB C 219 69.939 69.919 0.020 2 1 2449 . 1 1 A 219 219 THR N N 219 113.242 114.884 -1.642 2 1 2450 . 1 1 A 220 220 GLY H H 220 8.418 8.713 -0.295 2 1 2451 . 1 1 A 220 220 GLY C C 220 174.037 173.218 0.819 2 1 2452 . 1 1 A 220 220 GLY CA C 220 45.408 45.730 -0.322 2 1 2453 . 1 1 A 220 220 GLY N N 220 111.031 112.618 -1.587 2 1 2454 . 1 1 A 221 221 ASP H H 221 8.345 8.262 0.083 2 1 2455 . 1 1 A 221 221 ASP HA H 221 4.700 4.928 -0.228 2 1 2458 . 1 1 A 221 221 ASP C C 221 176.535 175.212 1.323 2 1 2459 . 1 1 A 221 221 ASP CA C 221 54.402 53.843 0.559 2 1 2460 . 1 1 A 221 221 ASP CB C 221 41.431 42.364 -0.933 2 1 2461 . 1 1 A 221 221 ASP N N 221 120.795 121.615 -0.820 2 1 2462 . 1 1 A 222 222 SER H H 222 8.353 8.546 -0.193 2 1 2463 . 1 1 A 222 222 SER HA H 222 4.493 4.733 -0.240 2 1 2465 . 1 1 A 222 222 SER C C 222 174.224 173.827 0.397 2 1 2466 . 1 1 A 222 222 SER CA C 222 58.427 58.222 0.205 2 1 2467 . 1 1 A 222 222 SER CB C 222 63.860 64.201 -0.341 2 1 2468 . 1 1 A 222 222 SER N N 222 116.220 118.413 -2.193 2 1 2469 . 1 1 A 223 223 ALA H H 223 8.381 8.417 -0.036 2 1 2470 . 1 1 A 223 223 ALA HA H 223 4.461 4.458 0.003 2 1 2474 . 1 1 A 223 223 ALA C C 223 176.926 176.676 0.250 2 1 2475 . 1 1 A 223 223 ALA CA C 223 52.583 52.609 -0.026 2 1 2476 . 1 1 A 223 223 ALA CB C 223 19.438 19.527 -0.089 2 1 2477 . 1 1 A 223 223 ALA N N 223 126.592 126.572 0.020 2 stop_ save_