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