data_16108_sparta save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16108 _Entry.PDB_ID 2KDY _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 17 _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 9 9 SER H H 9 8.293 8.104 0.189 1 1 2 . 1 1 1 A 9 9 SER HA H 9 4.432 4.518 -0.086 1 1 3 . 1 1 1 A 9 9 SER N N 9 116.407 118.991 -2.584 1 1 4 . 1 1 1 A 10 10 GLY H H 10 8.472 8.159 0.313 1 1 5 . 1 1 1 A 10 10 GLY N N 10 111.611 110.472 1.139 1 1 6 . 1 1 1 A 14 14 VAL H H 14 8.009 8.336 -0.327 1 1 7 . 1 1 1 A 14 14 VAL HA H 14 4.128 4.140 -0.012 1 1 15 . 1 1 1 A 14 14 VAL CA C 14 59.473 62.015 -2.542 1 1 16 . 1 1 1 A 14 14 VAL CB C 14 30.127 32.615 -2.488 1 1 17 . 1 1 1 A 14 14 VAL N N 14 119.846 119.822 0.024 1 1 18 . 1 1 1 A 15 15 THR H H 15 8.152 8.171 -0.019 1 1 19 . 1 1 1 A 15 15 THR HA H 15 4.346 4.595 -0.249 1 1 24 . 1 1 1 A 15 15 THR N N 15 118.509 119.747 -1.238 1 1 25 . 1 1 1 A 16 16 ALA H H 16 8.207 8.680 -0.473 1 1 26 . 1 1 1 A 16 16 ALA HA H 16 4.319 4.182 0.137 1 1 30 . 1 1 1 A 16 16 ALA CA C 16 49.835 53.489 -3.654 1 1 31 . 1 1 1 A 16 16 ALA CB C 16 16.714 18.353 -1.639 1 1 32 . 1 1 1 A 16 16 ALA N N 16 126.935 126.134 0.801 1 1 33 . 1 1 1 A 17 17 ASP H H 17 8.269 7.828 0.441 1 1 34 . 1 1 1 A 17 17 ASP HA H 17 4.581 4.805 -0.224 1 1 37 . 1 1 1 A 17 17 ASP CA C 17 51.643 53.445 -1.802 1 1 38 . 1 1 1 A 17 17 ASP CB C 17 38.257 41.284 -3.027 1 1 39 . 1 1 1 A 17 17 ASP N N 17 120.379 118.366 2.013 1 1 40 . 1 1 1 A 18 18 ILE H H 18 7.979 7.856 0.123 1 1 41 . 1 1 1 A 18 18 ILE HA H 18 4.178 4.140 0.038 1 1 48 . 1 1 1 A 18 18 ILE CA C 18 58.737 63.280 -4.543 1 1 49 . 1 1 1 A 18 18 ILE CB C 18 36.077 38.281 -2.204 1 1 53 . 1 1 1 A 18 18 ILE N N 18 121.171 121.691 -0.520 1 1 54 . 1 1 1 A 19 19 GLY H H 19 8.410 8.026 0.384 1 1 55 . 1 1 1 A 19 19 GLY HA2 H 19 4.023 3.988 0.035 1 1 56 . 1 1 1 A 19 19 GLY HA3 H 19 4.023 3.991 0.032 1 1 57 . 1 1 1 A 19 19 GLY N N 19 112.246 108.375 3.871 1 1 58 . 1 1 1 A 20 20 THR H H 20 8.005 7.821 0.184 1 1 59 . 1 1 1 A 20 20 THR HA H 20 4.463 4.071 0.392 1 1 64 . 1 1 1 A 20 20 THR CB C 20 66.723 68.728 -2.005 1 1 66 . 1 1 1 A 20 20 THR N N 20 112.239 115.360 -3.121 1 1 67 . 1 1 1 A 21 21 GLY H H 21 8.500 8.491 0.009 1 1 68 . 1 1 1 A 21 21 GLY HA2 H 21 4.099 3.795 0.304 1 1 69 . 1 1 1 A 21 21 GLY HA3 H 21 3.872 3.795 0.077 1 1 70 . 1 1 1 A 21 21 GLY N N 21 111.048 111.433 -0.385 1 1 71 . 1 1 1 A 22 22 LEU H H 22 7.427 8.087 -0.660 1 1 72 . 1 1 1 A 22 22 LEU HA H 22 3.884 3.989 -0.105 1 1 84 . 1 1 1 A 22 22 LEU N N 22 118.837 122.729 -3.892 1 1 85 . 1 1 1 A 23 23 ALA H H 23 7.896 9.007 -1.111 1 1 86 . 1 1 1 A 23 23 ALA HA H 23 4.023 4.119 -0.096 1 1 90 . 1 1 1 A 23 23 ALA CA C 23 52.584 54.141 -1.557 1 1 91 . 1 1 1 A 23 23 ALA CB C 23 15.470 18.400 -2.930 1 1 92 . 1 1 1 A 23 23 ALA N N 23 119.194 120.818 -1.624 1 1 93 . 1 1 1 A 24 24 ASP H H 24 8.265 7.893 0.372 1 1 94 . 1 1 1 A 24 24 ASP HA H 24 4.337 4.507 -0.170 1 1 97 . 1 1 1 A 24 24 ASP CB C 24 37.029 41.184 -4.155 1 1 98 . 1 1 1 A 24 24 ASP N N 24 119.035 116.529 2.506 1 1 99 . 1 1 1 A 25 25 ALA H H 25 8.211 8.375 -0.164 1 1 100 . 1 1 1 A 25 25 ALA HA H 25 4.064 4.222 -0.158 1 1 104 . 1 1 1 A 25 25 ALA CA C 25 53.278 52.903 0.375 1 1 105 . 1 1 1 A 25 25 ALA CB C 25 15.760 19.158 -3.398 1 1 106 . 1 1 1 A 25 25 ALA N N 25 122.434 120.853 1.581 1 1 107 . 1 1 1 A 26 26 LEU H H 26 7.334 7.316 0.018 1 1 108 . 1 1 1 A 26 26 LEU HA H 26 4.351 4.298 0.053 1 1 117 . 1 1 1 A 26 26 LEU N N 26 114.238 115.632 -1.394 1 1 118 . 1 1 1 A 27 27 THR H H 27 7.708 7.710 -0.002 1 1 119 . 1 1 1 A 27 27 THR HA H 27 4.492 4.594 -0.102 1 1 124 . 1 1 1 A 27 27 THR CA C 27 59.438 62.232 -2.794 1 1 125 . 1 1 1 A 27 27 THR CB C 27 68.796 70.258 -1.462 1 1 127 . 1 1 1 A 27 27 THR N N 27 106.430 109.704 -3.274 1 1 128 . 1 1 1 A 28 28 ALA H H 28 8.906 7.966 0.940 1 1 129 . 1 1 1 A 28 28 ALA HA H 28 4.812 4.669 0.143 1 1 133 . 1 1 1 A 28 28 ALA CB C 28 16.724 19.313 -2.589 1 1 134 . 1 1 1 A 28 28 ALA N N 28 128.420 124.261 4.159 1 1 135 . 1 1 1 A 29 29 PRO CA C 29 59.166 62.146 -2.980 1 1 136 . 1 1 1 A 29 29 PRO CB C 29 29.865 33.103 -3.238 1 1 139 . 1 1 1 A 30 30 LEU H H 30 8.204 8.365 -0.161 1 1 140 . 1 1 1 A 30 30 LEU HA H 30 4.052 4.408 -0.356 1 1 150 . 1 1 1 A 30 30 LEU N N 30 121.970 120.032 1.938 1 1 151 . 1 1 1 A 31 31 ASP H H 31 8.720 8.611 0.109 1 1 152 . 1 1 1 A 31 31 ASP HA H 31 4.772 5.040 -0.268 1 1 155 . 1 1 1 A 31 31 ASP CA C 31 50.115 53.000 -2.885 1 1 156 . 1 1 1 A 31 31 ASP N N 31 125.105 118.752 6.353 1 1 157 . 1 1 1 A 32 32 HIS CA C 32 55.083 54.541 0.542 1 1 158 . 1 1 1 A 32 32 HIS CB C 32 25.707 29.006 -3.299 1 1 159 . 1 1 1 A 33 33 LYS H H 33 8.589 7.740 0.849 1 1 160 . 1 1 1 A 33 33 LYS HA H 33 4.112 4.425 -0.313 1 1 167 . 1 1 1 A 33 33 LYS CB C 33 29.218 33.579 -4.361 1 1 169 . 1 1 1 A 33 33 LYS N N 33 118.920 118.233 0.687 1 1 170 . 1 1 1 A 34 34 ASP H H 34 7.420 7.692 -0.272 1 1 171 . 1 1 1 A 34 34 ASP HA H 34 4.368 4.820 -0.452 1 1 174 . 1 1 1 A 34 34 ASP N N 34 120.940 120.139 0.801 1 1 175 . 1 1 1 A 35 35 LYS H H 35 8.266 8.141 0.125 1 1 176 . 1 1 1 A 35 35 LYS HA H 35 4.169 4.060 0.109 1 1 183 . 1 1 1 A 35 35 LYS N N 35 121.280 123.780 -2.500 1 1 184 . 1 1 1 A 36 36 GLY H H 36 8.716 7.670 1.046 1 1 185 . 1 1 1 A 36 36 GLY HA2 H 36 3.822 4.046 -0.224 1 1 186 . 1 1 1 A 36 36 GLY HA3 H 36 3.618 4.051 -0.433 1 1 187 . 1 1 1 A 36 36 GLY N N 36 111.002 108.268 2.734 1 1 188 . 1 1 1 A 37 37 LEU H H 37 8.032 8.306 -0.274 1 1 189 . 1 1 1 A 37 37 LEU HA H 37 4.406 4.237 0.169 1 1 198 . 1 1 1 A 37 37 LEU N N 37 127.683 117.870 9.813 1 1 199 . 1 1 1 A 38 38 LYS H H 38 9.190 8.868 0.322 1 1 200 . 1 1 1 A 38 38 LYS HA H 38 3.925 4.670 -0.745 1 1 205 . 1 1 1 A 38 38 LYS N N 38 132.634 121.232 11.402 1 1 206 . 1 1 1 A 39 39 SER H H 39 7.161 7.637 -0.476 1 1 207 . 1 1 1 A 39 39 SER HA H 39 5.097 4.613 0.484 1 1 210 . 1 1 1 A 39 39 SER CA C 39 54.451 57.672 -3.221 1 1 211 . 1 1 1 A 39 39 SER N N 39 110.262 111.543 -1.281 1 1 212 . 1 1 1 A 40 40 LEU H H 40 8.142 9.586 -1.444 1 1 213 . 1 1 1 A 40 40 LEU HA H 40 4.481 4.907 -0.426 1 1 223 . 1 1 1 A 40 40 LEU N N 40 122.761 121.312 1.449 1 1 224 . 1 1 1 A 41 41 THR H H 41 8.641 8.883 -0.242 1 1 225 . 1 1 1 A 41 41 THR HA H 41 4.141 4.510 -0.369 1 1 230 . 1 1 1 A 41 41 THR CA C 41 60.301 62.834 -2.533 1 1 231 . 1 1 1 A 41 41 THR CB C 41 65.862 69.856 -3.994 1 1 233 . 1 1 1 A 41 41 THR N N 41 124.142 120.060 4.082 1 1 234 . 1 1 1 A 42 42 LEU H H 42 8.586 8.905 -0.319 1 1 235 . 1 1 1 A 42 42 LEU HA H 42 4.337 4.821 -0.484 1 1 247 . 1 1 1 A 42 42 LEU N N 42 128.603 123.534 5.069 1 1 248 . 1 1 1 A 43 43 GLU H H 43 8.644 8.353 0.291 1 1 249 . 1 1 1 A 43 43 GLU HA H 43 4.663 4.071 0.592 1 1 253 . 1 1 1 A 43 43 GLU N N 43 124.180 120.331 3.849 1 1 254 . 1 1 1 A 44 44 ASP H H 44 10.243 7.830 2.413 1 1 255 . 1 1 1 A 44 44 ASP HA H 44 4.518 4.865 -0.347 1 1 258 . 1 1 1 A 44 44 ASP CA C 44 52.879 54.263 -1.384 1 1 259 . 1 1 1 A 44 44 ASP CB C 44 37.711 42.192 -4.481 1 1 260 . 1 1 1 A 44 44 ASP N N 44 124.177 116.754 7.423 1 1 261 . 1 1 1 A 45 45 SER H H 45 8.546 8.415 0.131 1 1 262 . 1 1 1 A 45 45 SER HA H 45 3.850 4.131 -0.281 1 1 265 . 1 1 1 A 45 45 SER CA C 45 59.588 61.416 -1.828 1 1 266 . 1 1 1 A 45 45 SER CB C 45 61.660 63.240 -1.580 1 1 267 . 1 1 1 A 45 45 SER N N 45 116.191 115.465 0.726 1 1 268 . 1 1 1 A 46 46 ILE H H 46 6.902 7.617 -0.715 1 1 269 . 1 1 1 A 46 46 ILE HA H 46 3.874 4.781 -0.907 1 1 279 . 1 1 1 A 46 46 ILE CA C 46 57.605 59.743 -2.138 1 1 280 . 1 1 1 A 46 46 ILE CB C 46 36.694 40.725 -4.031 1 1 283 . 1 1 1 A 46 46 ILE N N 46 116.189 118.426 -2.237 1 1 284 . 1 1 1 A 47 47 SER H H 47 7.804 8.796 -0.992 1 1 285 . 1 1 1 A 47 47 SER HA H 47 4.342 4.677 -0.335 1 1 288 . 1 1 1 A 47 47 SER CA C 47 55.995 58.609 -2.614 1 1 289 . 1 1 1 A 47 47 SER N N 47 118.738 118.679 0.059 1 1 290 . 1 1 1 A 48 48 GLN H H 48 8.522 8.181 0.341 1 1 291 . 1 1 1 A 48 48 GLN HA H 48 3.939 4.359 -0.420 1 1 296 . 1 1 1 A 48 48 GLN CA C 48 55.111 55.668 -0.557 1 1 298 . 1 1 1 A 48 48 GLN N N 48 119.475 118.140 1.335 1 1 299 . 1 1 1 A 49 49 ASN H H 49 8.437 7.851 0.586 1 1 300 . 1 1 1 A 49 49 ASN HA H 49 4.693 5.171 -0.478 1 1 305 . 1 1 1 A 49 49 ASN CA C 49 50.839 52.631 -1.792 1 1 306 . 1 1 1 A 49 49 ASN CB C 49 35.767 39.259 -3.492 1 1 307 . 1 1 1 A 49 49 ASN N N 49 117.233 118.153 -0.920 1 1 309 . 1 1 1 A 50 50 GLY H H 50 7.952 8.476 -0.524 1 1 310 . 1 1 1 A 50 50 GLY HA2 H 50 4.518 3.913 0.605 1 1 311 . 1 1 1 A 50 50 GLY HA3 H 50 4.054 3.916 0.138 1 1 312 . 1 1 1 A 50 50 GLY CA C 50 41.883 47.654 -5.771 1 1 313 . 1 1 1 A 50 50 GLY N N 50 108.751 108.894 -0.143 1 1 314 . 1 1 1 A 51 51 THR H H 51 8.548 7.499 1.049 1 1 315 . 1 1 1 A 51 51 THR HA H 51 5.012 4.933 0.079 1 1 320 . 1 1 1 A 51 51 THR CA C 51 57.026 60.374 -3.348 1 1 321 . 1 1 1 A 51 51 THR CB C 51 69.887 71.349 -1.462 1 1 323 . 1 1 1 A 51 51 THR N N 51 108.710 108.573 0.137 1 1 324 . 1 1 1 A 52 52 LEU H H 52 9.110 9.301 -0.191 1 1 325 . 1 1 1 A 52 52 LEU HA H 52 5.183 5.677 -0.494 1 1 333 . 1 1 1 A 52 52 LEU CA C 52 50.822 53.800 -2.978 1 1 335 . 1 1 1 A 52 52 LEU N N 52 124.606 123.049 1.557 1 1 336 . 1 1 1 A 53 53 THR H H 53 9.312 8.932 0.380 1 1 337 . 1 1 1 A 53 53 THR HA H 53 5.288 4.845 0.443 1 1 342 . 1 1 1 A 53 53 THR CA C 53 59.535 62.111 -2.576 1 1 343 . 1 1 1 A 53 53 THR CB C 53 66.838 70.449 -3.611 1 1 345 . 1 1 1 A 53 53 THR N N 53 125.445 119.445 6.000 1 1 346 . 1 1 1 A 54 54 LEU H H 54 8.992 9.099 -0.107 1 1 347 . 1 1 1 A 54 54 LEU HA H 54 5.563 6.085 -0.522 1 1 357 . 1 1 1 A 54 54 LEU N N 54 128.814 121.470 7.344 1 1 358 . 1 1 1 A 55 55 SER H H 55 9.017 9.301 -0.284 1 1 359 . 1 1 1 A 55 55 SER HA H 55 5.476 5.344 0.132 1 1 362 . 1 1 1 A 55 55 SER CA C 55 53.944 56.783 -2.839 1 1 363 . 1 1 1 A 55 55 SER CB C 55 63.384 64.761 -1.377 1 1 364 . 1 1 1 A 55 55 SER N N 55 112.964 119.088 -6.124 1 1 365 . 1 1 1 A 56 56 ALA H H 56 8.324 10.571 -2.247 1 1 366 . 1 1 1 A 56 56 ALA HA H 56 4.605 4.823 -0.218 1 1 370 . 1 1 1 A 56 56 ALA CA C 56 50.743 50.166 0.577 1 1 371 . 1 1 1 A 56 56 ALA CB C 56 21.372 20.997 0.375 1 1 372 . 1 1 1 A 56 56 ALA N N 56 123.555 127.605 -4.050 1 1 373 . 1 1 1 A 57 57 GLN H H 57 9.080 8.566 0.514 1 1 374 . 1 1 1 A 57 57 GLN HA H 57 3.884 4.514 -0.630 1 1 381 . 1 1 1 A 57 57 GLN CA C 57 53.331 55.853 -2.522 1 1 382 . 1 1 1 A 57 57 GLN CB C 57 24.659 27.533 -2.874 1 1 384 . 1 1 1 A 57 57 GLN N N 57 116.815 115.012 1.803 1 1 386 . 1 1 1 A 58 58 GLY H H 58 8.527 7.965 0.562 1 1 387 . 1 1 1 A 58 58 GLY HA2 H 58 4.168 4.061 0.107 1 1 388 . 1 1 1 A 58 58 GLY HA3 H 58 3.608 4.066 -0.458 1 1 389 . 1 1 1 A 58 58 GLY CA C 58 42.856 45.580 -2.724 1 1 390 . 1 1 1 A 58 58 GLY N N 58 105.983 107.150 -1.167 1 1 391 . 1 1 1 A 59 59 ALA H H 59 8.203 7.691 0.512 1 1 392 . 1 1 1 A 59 59 ALA HA H 59 4.811 4.602 0.209 1 1 396 . 1 1 1 A 59 59 ALA CA C 59 47.662 51.458 -3.796 1 1 397 . 1 1 1 A 59 59 ALA CB C 59 20.147 22.679 -2.532 1 1 398 . 1 1 1 A 59 59 ALA N N 59 125.153 121.185 3.968 1 1 399 . 1 1 1 A 60 60 GLU H H 60 8.154 8.996 -0.842 1 1 400 . 1 1 1 A 60 60 GLU HA H 60 5.508 5.658 -0.150 1 1 404 . 1 1 1 A 60 60 GLU CA C 60 52.179 54.148 -1.969 1 1 405 . 1 1 1 A 60 60 GLU CB C 60 30.203 34.611 -4.408 1 1 406 . 1 1 1 A 60 60 GLU N N 60 117.318 116.446 0.872 1 1 407 . 1 1 1 A 61 61 LYS H H 61 8.821 9.169 -0.348 1 1 408 . 1 1 1 A 61 61 LYS HA H 61 4.311 4.661 -0.350 1 1 413 . 1 1 1 A 61 61 LYS N N 61 123.743 120.326 3.417 1 1 414 . 1 1 1 A 62 62 THR H H 62 8.149 8.628 -0.479 1 1 415 . 1 1 1 A 62 62 THR HA H 62 4.928 4.751 0.177 1 1 420 . 1 1 1 A 62 62 THR CA C 62 59.427 61.705 -2.278 1 1 421 . 1 1 1 A 62 62 THR CB C 62 66.932 69.531 -2.599 1 1 422 . 1 1 1 A 62 62 THR N N 62 122.829 118.989 3.840 1 1 423 . 1 1 1 A 63 63 TYR H H 63 9.466 9.957 -0.491 1 1 424 . 1 1 1 A 63 63 TYR HA H 63 4.606 5.945 -1.339 1 1 431 . 1 1 1 A 63 63 TYR CA C 63 54.508 55.965 -1.457 1 1 432 . 1 1 1 A 63 63 TYR N N 63 127.472 127.109 0.363 1 1 433 . 1 1 1 A 64 64 GLY H H 64 9.253 8.444 0.809 1 1 434 . 1 1 1 A 64 64 GLY HA2 H 64 4.670 4.231 0.439 1 1 435 . 1 1 1 A 64 64 GLY HA3 H 64 3.619 4.264 -0.645 1 1 436 . 1 1 1 A 64 64 GLY CA C 64 39.885 44.957 -5.072 1 1 437 . 1 1 1 A 64 64 GLY N N 64 110.182 108.973 1.209 1 1 438 . 1 1 1 A 65 65 ASN H H 65 8.616 8.506 0.110 1 1 439 . 1 1 1 A 65 65 ASN HA H 65 4.109 4.485 -0.376 1 1 444 . 1 1 1 A 65 65 ASN CA C 65 53.691 54.878 -1.187 1 1 445 . 1 1 1 A 65 65 ASN N N 65 117.778 119.085 -1.307 1 1 447 . 1 1 1 A 66 66 GLY H H 66 9.053 8.687 0.366 1 1 448 . 1 1 1 A 66 66 GLY HA2 H 66 4.344 3.940 0.404 1 1 449 . 1 1 1 A 66 66 GLY HA3 H 66 3.359 3.943 -0.584 1 1 450 . 1 1 1 A 66 66 GLY CA C 66 42.431 44.992 -2.561 1 1 451 . 1 1 1 A 66 66 GLY N N 66 115.232 114.018 1.214 1 1 452 . 1 1 1 A 67 67 ASP H H 67 8.120 8.753 -0.633 1 1 453 . 1 1 1 A 67 67 ASP HA H 67 4.844 4.737 0.107 1 1 456 . 1 1 1 A 67 67 ASP N N 67 122.593 121.439 1.154 1 1 457 . 1 1 1 A 68 68 SER H H 68 8.500 8.438 0.062 1 1 458 . 1 1 1 A 68 68 SER HA H 68 5.088 5.311 -0.223 1 1 461 . 1 1 1 A 68 68 SER CA C 68 54.858 56.990 -2.132 1 1 462 . 1 1 1 A 68 68 SER CB C 68 62.114 67.044 -4.930 1 1 463 . 1 1 1 A 68 68 SER N N 68 113.557 111.802 1.755 1 1 464 . 1 1 1 A 69 69 LEU H H 69 8.989 8.876 0.113 1 1 465 . 1 1 1 A 69 69 LEU HA H 69 4.570 5.622 -1.052 1 1 474 . 1 1 1 A 69 69 LEU N N 69 126.836 123.246 3.590 1 1 475 . 1 1 1 A 70 70 ASN H H 70 8.491 8.853 -0.362 1 1 476 . 1 1 1 A 70 70 ASN HA H 70 4.958 5.485 -0.527 1 1 479 . 1 1 1 A 70 70 ASN CB C 70 33.265 40.972 -7.707 1 1 480 . 1 1 1 A 70 70 ASN N N 70 126.343 122.678 3.665 1 1 481 . 1 1 1 A 71 71 THR H H 71 7.831 8.431 -0.600 1 1 482 . 1 1 1 A 71 71 THR HA H 71 3.759 4.742 -0.983 1 1 487 . 1 1 1 A 71 71 THR CA C 71 61.005 60.328 0.677 1 1 488 . 1 1 1 A 71 71 THR N N 71 114.742 114.385 0.357 1 1 489 . 1 1 1 A 72 72 GLY H H 72 8.880 8.048 0.832 1 1 490 . 1 1 1 A 72 72 GLY HA2 H 72 3.907 3.943 -0.036 1 1 491 . 1 1 1 A 72 72 GLY HA3 H 72 3.907 3.943 -0.036 1 1 492 . 1 1 1 A 72 72 GLY N N 72 114.976 110.455 4.521 1 1 493 . 1 1 1 A 73 73 LYS H H 73 6.604 7.729 -1.125 1 1 494 . 1 1 1 A 73 73 LYS HA H 73 4.160 4.355 -0.195 1 1 501 . 1 1 1 A 73 73 LYS N N 73 113.898 118.567 -4.669 1 1 502 . 1 1 1 A 74 74 LEU H H 74 7.422 7.319 0.103 1 1 503 . 1 1 1 A 74 74 LEU HA H 74 4.358 4.230 0.128 1 1 513 . 1 1 1 A 74 74 LEU N N 74 117.180 121.566 -4.386 1 1 514 . 1 1 1 A 75 75 LYS H H 75 8.617 8.688 -0.071 1 1 515 . 1 1 1 A 75 75 LYS HA H 75 4.079 4.681 -0.602 1 1 518 . 1 1 1 A 75 75 LYS N N 75 121.119 121.222 -0.103 1 1 519 . 1 1 1 A 76 76 ASN H H 76 8.154 8.491 -0.337 1 1 520 . 1 1 1 A 76 76 ASN HA H 76 3.935 4.892 -0.957 1 1 525 . 1 1 1 A 76 76 ASN CB C 76 35.772 38.745 -2.973 1 1 526 . 1 1 1 A 76 76 ASN N N 76 122.761 119.126 3.635 1 1 527 . 1 1 1 A 77 77 ASP H H 77 9.227 8.137 1.090 1 1 528 . 1 1 1 A 77 77 ASP HA H 77 3.787 5.399 -1.612 1 1 531 . 1 1 1 A 77 77 ASP CA C 77 52.584 53.187 -0.603 1 1 532 . 1 1 1 A 77 77 ASP N N 77 114.129 115.719 -1.590 1 1 533 . 1 1 1 A 78 78 LYS H H 78 6.579 8.296 -1.717 1 1 534 . 1 1 1 A 78 78 LYS HA H 78 4.572 4.953 -0.381 1 1 539 . 1 1 1 A 78 78 LYS CA C 78 51.072 54.583 -3.511 1 1 540 . 1 1 1 A 78 78 LYS CB C 78 33.783 35.069 -1.286 1 1 541 . 1 1 1 A 78 78 LYS N N 78 114.135 122.197 -8.062 1 1 542 . 1 1 1 A 79 79 VAL H H 79 8.729 8.458 0.271 1 1 543 . 1 1 1 A 79 79 VAL HA H 79 4.402 4.167 0.235 1 1 551 . 1 1 1 A 79 79 VAL CA C 79 59.240 60.345 -1.105 1 1 553 . 1 1 1 A 79 79 VAL N N 79 123.191 122.328 0.863 1 1 554 . 1 1 1 A 80 80 SER H H 80 9.542 8.674 0.868 1 1 555 . 1 1 1 A 80 80 SER HA H 80 4.636 4.961 -0.325 1 1 558 . 1 1 1 A 80 80 SER CA C 80 55.978 57.066 -1.088 1 1 559 . 1 1 1 A 80 80 SER N N 80 127.445 121.179 6.266 1 1 560 . 1 1 1 A 81 81 ARG H H 81 8.093 8.778 -0.685 1 1 561 . 1 1 1 A 81 81 ARG HA H 81 5.210 5.429 -0.219 1 1 569 . 1 1 1 A 81 81 ARG N N 81 123.743 124.301 -0.558 1 1 571 . 1 1 1 A 82 82 PHE H H 82 9.312 7.781 1.531 1 1 572 . 1 1 1 A 82 82 PHE HA H 82 4.951 5.141 -0.190 1 1 577 . 1 1 1 A 82 82 PHE CA C 82 53.090 55.997 -2.907 1 1 578 . 1 1 1 A 82 82 PHE N N 82 119.529 117.636 1.893 1 1 579 . 1 1 1 A 83 83 ASP H H 83 9.122 8.684 0.438 1 1 580 . 1 1 1 A 83 83 ASP HA H 83 5.593 5.373 0.220 1 1 583 . 1 1 1 A 83 83 ASP N N 83 123.825 121.124 2.701 1 1 584 . 1 1 1 A 84 84 PHE H H 84 9.090 8.391 0.699 1 1 585 . 1 1 1 A 84 84 PHE HA H 84 6.410 5.955 0.455 1 1 592 . 1 1 1 A 84 84 PHE CA C 84 52.584 56.381 -3.797 1 1 593 . 1 1 1 A 84 84 PHE N N 84 118.862 119.812 -0.950 1 1 594 . 1 1 1 A 85 85 ILE H H 85 8.441 8.950 -0.509 1 1 595 . 1 1 1 A 85 85 ILE HA H 85 4.662 4.829 -0.167 1 1 605 . 1 1 1 A 85 85 ILE CB C 85 39.939 39.832 0.107 1 1 608 . 1 1 1 A 85 85 ILE N N 85 118.049 120.600 -2.551 1 1 609 . 1 1 1 A 86 86 ARG H H 86 8.983 9.205 -0.222 1 1 610 . 1 1 1 A 86 86 ARG HA H 86 5.591 4.875 0.716 1 1 616 . 1 1 1 A 86 86 ARG N N 86 127.006 128.075 -1.069 1 1 618 . 1 1 1 A 87 87 GLN H H 87 8.643 9.444 -0.801 1 1 619 . 1 1 1 A 87 87 GLN HA H 87 5.630 5.308 0.322 1 1 626 . 1 1 1 A 87 87 GLN CA C 87 51.512 54.389 -2.877 1 1 627 . 1 1 1 A 87 87 GLN N N 87 124.142 122.653 1.489 1 1 629 . 1 1 1 A 88 88 ILE H H 88 8.617 8.701 -0.084 1 1 630 . 1 1 1 A 88 88 ILE HA H 88 4.690 4.809 -0.119 1 1 637 . 1 1 1 A 88 88 ILE CA C 88 56.995 60.768 -3.773 1 1 638 . 1 1 1 A 88 88 ILE CB C 88 39.927 40.292 -0.365 1 1 641 . 1 1 1 A 88 88 ILE N N 88 116.353 123.732 -7.379 1 1 642 . 1 1 1 A 89 89 GLU H H 89 8.298 9.040 -0.742 1 1 643 . 1 1 1 A 89 89 GLU HA H 89 5.100 5.686 -0.586 1 1 646 . 1 1 1 A 89 89 GLU CA C 89 52.204 55.741 -3.537 1 1 647 . 1 1 1 A 89 89 GLU CB C 89 27.325 32.250 -4.925 1 1 648 . 1 1 1 A 89 89 GLU N N 89 124.458 129.815 -5.357 1 1 649 . 1 1 1 A 90 90 VAL H H 90 8.957 8.727 0.230 1 1 650 . 1 1 1 A 90 90 VAL HA H 90 4.169 4.621 -0.452 1 1 658 . 1 1 1 A 90 90 VAL CA C 90 58.664 60.531 -1.867 1 1 659 . 1 1 1 A 90 90 VAL CB C 90 31.861 32.639 -0.778 1 1 660 . 1 1 1 A 90 90 VAL N N 90 127.580 126.687 0.893 1 1 661 . 1 1 1 A 91 91 ASP H H 91 9.369 8.819 0.550 1 1 662 . 1 1 1 A 91 91 ASP HA H 91 4.287 4.455 -0.168 1 1 665 . 1 1 1 A 91 91 ASP CA C 91 52.389 53.408 -1.019 1 1 666 . 1 1 1 A 91 91 ASP CB C 91 36.409 39.526 -3.117 1 1 667 . 1 1 1 A 91 91 ASP N N 91 129.411 123.306 6.105 1 1 668 . 1 1 1 A 92 92 GLY H H 92 8.552 7.441 1.111 1 1 669 . 1 1 1 A 92 92 GLY HA2 H 92 4.090 4.100 -0.010 1 1 670 . 1 1 1 A 92 92 GLY HA3 H 92 3.618 4.101 -0.483 1 1 671 . 1 1 1 A 92 92 GLY CA C 92 42.836 45.633 -2.797 1 1 672 . 1 1 1 A 92 92 GLY N N 92 103.862 106.751 -2.889 1 1 673 . 1 1 1 A 93 93 GLN H H 93 7.808 7.611 0.197 1 1 674 . 1 1 1 A 93 93 GLN HA H 93 4.578 4.778 -0.200 1 1 679 . 1 1 1 A 93 93 GLN CA C 93 50.918 54.318 -3.400 1 1 680 . 1 1 1 A 93 93 GLN CB C 93 28.602 31.036 -2.434 1 1 682 . 1 1 1 A 93 93 GLN N N 93 120.412 118.569 1.843 1 1 683 . 1 1 1 A 94 94 LEU H H 94 8.414 8.576 -0.162 1 1 684 . 1 1 1 A 94 94 LEU HA H 94 4.704 4.293 0.411 1 1 693 . 1 1 1 A 94 94 LEU CB C 94 39.873 42.388 -2.515 1 1 696 . 1 1 1 A 94 94 LEU N N 94 125.061 122.101 2.960 1 1 697 . 1 1 1 A 95 95 ILE H H 95 9.181 8.671 0.510 1 1 698 . 1 1 1 A 95 95 ILE HA H 95 4.371 5.141 -0.770 1 1 708 . 1 1 1 A 95 95 ILE CA C 95 63.319 60.672 2.647 1 1 709 . 1 1 1 A 95 95 ILE CB C 95 37.407 40.014 -2.607 1 1 711 . 1 1 1 A 95 95 ILE N N 95 127.724 122.278 5.446 1 1 712 . 1 1 1 A 96 96 THR H H 96 8.730 8.456 0.274 1 1 713 . 1 1 1 A 96 96 THR HA H 96 4.411 4.746 -0.335 1 1 718 . 1 1 1 A 96 96 THR CA C 96 60.344 60.939 -0.595 1 1 719 . 1 1 1 A 96 96 THR CB C 96 59.719 72.349 -12.630 1 1 720 . 1 1 1 A 96 96 THR N N 96 124.240 119.441 4.799 1 1 721 . 1 1 1 A 97 97 LEU H H 97 8.790 8.467 0.323 1 1 722 . 1 1 1 A 97 97 LEU HA H 97 4.400 5.050 -0.650 1 1 732 . 1 1 1 A 97 97 LEU N N 97 126.147 123.497 2.650 1 1 733 . 1 1 1 A 98 98 GLU H H 98 7.596 8.907 -1.311 1 1 734 . 1 1 1 A 98 98 GLU HA H 98 5.102 5.051 0.051 1 1 739 . 1 1 1 A 98 98 GLU N N 98 116.937 121.922 -4.985 1 1 740 . 1 1 1 A 99 99 SER H H 99 8.906 9.073 -0.167 1 1 741 . 1 1 1 A 99 99 SER HA H 99 4.504 5.049 -0.545 1 1 744 . 1 1 1 A 99 99 SER CA C 99 54.010 56.803 -2.793 1 1 745 . 1 1 1 A 99 99 SER CB C 99 63.876 64.839 -0.963 1 1 746 . 1 1 1 A 99 99 SER N N 99 117.823 120.288 -2.465 1 1 747 . 1 1 1 A 100 100 GLY H H 100 7.250 7.699 -0.449 1 1 748 . 1 1 1 A 100 100 GLY HA2 H 100 4.872 3.897 0.975 1 1 749 . 1 1 1 A 100 100 GLY HA3 H 100 3.731 4.027 -0.296 1 1 750 . 1 1 1 A 100 100 GLY N N 100 109.436 110.760 -1.324 1 1 751 . 1 1 1 A 101 101 GLU H H 101 9.661 8.500 1.161 1 1 752 . 1 1 1 A 101 101 GLU HA H 101 5.643 5.022 0.621 1 1 757 . 1 1 1 A 101 101 GLU CA C 101 52.584 54.841 -2.257 1 1 758 . 1 1 1 A 101 101 GLU CB C 101 31.750 33.141 -1.391 1 1 759 . 1 1 1 A 101 101 GLU N N 101 126.793 120.923 5.870 1 1 760 . 1 1 1 A 102 102 PHE H H 102 10.441 8.831 1.610 1 1 761 . 1 1 1 A 102 102 PHE HA H 102 5.248 5.331 -0.083 1 1 768 . 1 1 1 A 102 102 PHE CA C 102 53.537 56.242 -2.705 1 1 769 . 1 1 1 A 102 102 PHE N N 102 131.837 125.585 6.252 1 1 770 . 1 1 1 A 103 103 GLN H H 103 9.135 9.352 -0.217 1 1 771 . 1 1 1 A 103 103 GLN HA H 103 5.205 4.881 0.324 1 1 776 . 1 1 1 A 103 103 GLN CA C 103 50.925 54.574 -3.649 1 1 777 . 1 1 1 A 103 103 GLN N N 103 127.720 125.554 2.166 1 1 778 . 1 1 1 A 104 104 VAL H H 104 8.937 9.136 -0.199 1 1 779 . 1 1 1 A 104 104 VAL HA H 104 4.780 4.769 0.011 1 1 787 . 1 1 1 A 104 104 VAL CA C 104 57.086 61.290 -4.204 1 1 789 . 1 1 1 A 104 104 VAL N N 104 120.097 125.333 -5.236 1 1 790 . 1 1 1 A 105 105 TYR H H 105 9.108 9.937 -0.829 1 1 791 . 1 1 1 A 105 105 TYR HA H 105 4.834 5.222 -0.388 1 1 798 . 1 1 1 A 105 105 TYR CA C 105 54.486 56.900 -2.414 1 1 799 . 1 1 1 A 105 105 TYR N N 105 128.426 126.489 1.937 1 1 800 . 1 1 1 A 106 106 LYS H H 106 5.945 9.683 -3.738 1 1 805 . 1 1 1 A 106 106 LYS N N 106 129.163 123.059 6.104 1 1 806 . 1 1 1 A 107 107 GLN H H 107 8.526 8.817 -0.291 1 1 807 . 1 1 1 A 107 107 GLN HA H 107 5.160 5.514 -0.354 1 1 812 . 1 1 1 A 107 107 GLN CA C 107 52.584 54.629 -2.045 1 1 813 . 1 1 1 A 107 107 GLN CB C 107 26.175 30.122 -3.947 1 1 814 . 1 1 1 A 107 107 GLN N N 107 125.978 125.989 -0.011 1 1 815 . 1 1 1 A 108 108 SER H H 108 8.621 8.774 -0.153 1 1 816 . 1 1 1 A 108 108 SER HA H 108 4.403 4.345 0.058 1 1 819 . 1 1 1 A 108 108 SER CA C 108 58.521 60.768 -2.247 1 1 820 . 1 1 1 A 108 108 SER CB C 108 60.737 63.941 -3.204 1 1 821 . 1 1 1 A 108 108 SER N N 108 117.542 119.278 -1.736 1 1 822 . 1 1 1 A 109 109 HIS H H 109 10.381 8.015 2.366 1 1 823 . 1 1 1 A 109 109 HIS HA H 109 4.594 4.751 -0.157 1 1 828 . 1 1 1 A 109 109 HIS CA C 109 51.743 56.532 -4.789 1 1 829 . 1 1 1 A 109 109 HIS CB C 109 27.174 31.939 -4.765 1 1 830 . 1 1 1 A 109 109 HIS N N 109 118.449 117.061 1.388 1 1 831 . 1 1 1 A 110 110 SER H H 110 7.366 8.016 -0.650 1 1 832 . 1 1 1 A 110 110 SER HA H 110 4.870 4.869 0.001 1 1 835 . 1 1 1 A 110 110 SER CB C 110 62.986 64.878 -1.892 1 1 836 . 1 1 1 A 110 110 SER N N 110 113.397 114.042 -0.645 1 1 837 . 1 1 1 A 111 111 ALA H H 111 8.541 8.413 0.128 1 1 838 . 1 1 1 A 111 111 ALA HA H 111 4.826 4.943 -0.117 1 1 842 . 1 1 1 A 111 111 ALA CA C 111 49.015 51.821 -2.806 1 1 843 . 1 1 1 A 111 111 ALA CB C 111 20.256 23.187 -2.931 1 1 844 . 1 1 1 A 111 111 ALA N N 111 117.786 122.877 -5.091 1 1 845 . 1 1 1 A 112 112 LEU H H 112 8.529 8.796 -0.267 1 1 846 . 1 1 1 A 112 112 LEU HA H 112 5.680 6.125 -0.445 1 1 855 . 1 1 1 A 112 112 LEU CA C 112 51.818 53.248 -1.430 1 1 856 . 1 1 1 A 112 112 LEU N N 112 116.345 115.838 0.507 1 1 857 . 1 1 1 A 113 113 THR H H 113 8.758 8.752 0.006 1 1 858 . 1 1 1 A 113 113 THR HA H 113 5.563 5.323 0.240 1 1 863 . 1 1 1 A 113 113 THR CA C 113 54.458 60.685 -6.227 1 1 864 . 1 1 1 A 113 113 THR CB C 113 68.586 72.648 -4.062 1 1 866 . 1 1 1 A 113 113 THR N N 113 110.469 118.231 -7.762 1 1 867 . 1 1 1 A 114 114 ALA H H 114 8.829 8.512 0.317 1 1 868 . 1 1 1 A 114 114 ALA HA H 114 4.466 4.819 -0.353 1 1 872 . 1 1 1 A 114 114 ALA CA C 114 48.886 51.867 -2.981 1 1 873 . 1 1 1 A 114 114 ALA CB C 114 21.583 21.696 -0.113 1 1 874 . 1 1 1 A 114 114 ALA N N 114 121.456 123.757 -2.301 1 1 875 . 1 1 1 A 115 115 LEU H H 115 8.407 9.686 -1.279 1 1 876 . 1 1 1 A 115 115 LEU HA H 115 4.814 4.681 0.133 1 1 886 . 1 1 1 A 115 115 LEU N N 115 119.223 124.093 -4.870 1 1 887 . 1 1 1 A 116 116 GLN H H 116 9.720 9.460 0.260 1 1 888 . 1 1 1 A 116 116 GLN HA H 116 5.312 5.218 0.094 1 1 893 . 1 1 1 A 116 116 GLN CA C 116 50.544 53.612 -3.068 1 1 894 . 1 1 1 A 116 116 GLN N N 116 127.827 120.739 7.088 1 1 895 . 1 1 1 A 117 117 THR H H 117 9.663 8.724 0.939 1 1 896 . 1 1 1 A 117 117 THR HA H 117 4.198 4.850 -0.652 1 1 901 . 1 1 1 A 117 117 THR CA C 117 64.037 60.694 3.343 1 1 902 . 1 1 1 A 117 117 THR CB C 117 66.868 72.695 -5.827 1 1 904 . 1 1 1 A 117 117 THR N N 117 128.929 117.062 11.867 1 1 905 . 1 1 1 A 118 118 GLU H H 118 9.486 9.010 0.476 1 1 906 . 1 1 1 A 118 118 GLU HA H 118 4.885 4.576 0.309 1 1 911 . 1 1 1 A 118 118 GLU N N 118 123.497 124.351 -0.854 1 1 912 . 1 1 1 A 119 119 GLN H H 119 8.076 7.304 0.772 1 1 913 . 1 1 1 A 119 119 GLN HA H 119 5.331 4.800 0.531 1 1 916 . 1 1 1 A 119 119 GLN CA C 119 51.858 54.687 -2.829 1 1 917 . 1 1 1 A 119 119 GLN N N 119 118.023 116.599 1.424 1 1 918 . 1 1 1 A 120 120 GLU H H 120 9.078 8.695 0.383 1 1 919 . 1 1 1 A 120 120 GLU HA H 120 5.071 4.950 0.121 1 1 924 . 1 1 1 A 120 120 GLU N N 120 118.433 121.743 -3.310 1 1 925 . 1 1 1 A 121 121 GLN H H 121 7.711 8.675 -0.964 1 1 926 . 1 1 1 A 121 121 GLN HA H 121 4.430 4.980 -0.550 1 1 933 . 1 1 1 A 121 121 GLN CA C 121 53.996 54.827 -0.831 1 1 934 . 1 1 1 A 121 121 GLN CB C 121 27.158 33.165 -6.007 1 1 936 . 1 1 1 A 121 121 GLN N N 121 122.412 119.179 3.233 1 1 938 . 1 1 1 A 122 122 ASP H H 122 8.675 9.933 -1.258 1 1 939 . 1 1 1 A 122 122 ASP HA H 122 4.632 5.292 -0.660 1 1 942 . 1 1 1 A 122 122 ASP CA C 122 48.797 50.487 -1.690 1 1 943 . 1 1 1 A 122 122 ASP CB C 122 39.852 42.577 -2.725 1 1 944 . 1 1 1 A 122 122 ASP N N 122 128.625 122.986 5.639 1 1 945 . 1 1 1 A 123 123 PRO CA C 123 61.579 62.753 -1.174 1 1 946 . 1 1 1 A 123 123 PRO CB C 123 29.597 29.776 -0.179 1 1 948 . 1 1 1 A 124 124 GLU H H 124 8.297 8.608 -0.311 1 1 949 . 1 1 1 A 124 124 GLU HA H 124 4.196 3.978 0.218 1 1 954 . 1 1 1 A 124 124 GLU CA C 124 53.025 57.609 -4.584 1 1 955 . 1 1 1 A 124 124 GLU CB C 124 27.927 30.311 -2.384 1 1 957 . 1 1 1 A 124 124 GLU N N 124 115.538 121.553 -6.015 1 1 958 . 1 1 1 A 125 125 HIS H H 125 7.419 7.271 0.148 1 1 959 . 1 1 1 A 125 125 HIS HA H 125 4.833 4.661 0.172 1 1 964 . 1 1 1 A 125 125 HIS CA C 125 51.886 56.204 -4.318 1 1 965 . 1 1 1 A 125 125 HIS CB C 125 26.387 30.889 -4.502 1 1 966 . 1 1 1 A 125 125 HIS N N 125 117.464 114.258 3.206 1 1 967 . 1 1 1 A 126 126 SER H H 126 8.441 8.589 -0.148 1 1 968 . 1 1 1 A 126 126 SER HA H 126 4.261 4.674 -0.413 1 1 971 . 1 1 1 A 126 126 SER CA C 126 57.988 57.351 0.637 1 1 972 . 1 1 1 A 126 126 SER N N 126 117.954 113.826 4.128 1 1 973 . 1 1 1 A 127 127 GLU H H 127 9.221 7.978 1.243 1 1 974 . 1 1 1 A 127 127 GLU HA H 127 4.366 4.474 -0.108 1 1 979 . 1 1 1 A 127 127 GLU CA C 127 53.707 56.119 -2.412 1 1 980 . 1 1 1 A 127 127 GLU CB C 127 25.492 30.384 -4.892 1 1 981 . 1 1 1 A 127 127 GLU N N 127 120.404 120.520 -0.116 1 1 982 . 1 1 1 A 128 128 LYS H H 128 8.262 8.109 0.153 1 1 983 . 1 1 1 A 128 128 LYS HA H 128 4.661 4.088 0.573 1 1 990 . 1 1 1 A 128 128 LYS CA C 128 52.264 57.467 -5.203 1 1 991 . 1 1 1 A 128 128 LYS CB C 128 32.404 31.631 0.773 1 1 994 . 1 1 1 A 128 128 LYS N N 128 122.166 116.955 5.211 1 1 995 . 1 1 1 A 129 129 MET H H 129 8.242 9.950 -1.708 1 1 996 . 1 1 1 A 129 129 MET HA H 129 5.012 5.197 -0.185 1 1 1001 . 1 1 1 A 129 129 MET CA C 129 50.958 53.925 -2.967 1 1 1003 . 1 1 1 A 129 129 MET N N 129 119.422 116.678 2.744 1 1 1004 . 1 1 1 A 130 130 VAL H H 130 9.200 9.511 -0.311 1 1 1005 . 1 1 1 A 130 130 VAL HA H 130 4.609 4.707 -0.098 1 1 1013 . 1 1 1 A 130 130 VAL CA C 130 56.296 60.302 -4.006 1 1 1014 . 1 1 1 A 130 130 VAL CB C 130 32.606 36.076 -3.470 1 1 1015 . 1 1 1 A 130 130 VAL N N 130 118.290 120.199 -1.909 1 1 1016 . 1 1 1 A 131 131 ALA H H 131 8.368 8.538 -0.170 1 1 1017 . 1 1 1 A 131 131 ALA HA H 131 4.654 5.118 -0.464 1 1 1021 . 1 1 1 A 131 131 ALA CA C 131 49.739 51.775 -2.036 1 1 1022 . 1 1 1 A 131 131 ALA CB C 131 15.351 21.822 -6.471 1 1 1023 . 1 1 1 A 131 131 ALA N N 131 126.734 124.852 1.882 1 1 1024 . 1 1 1 A 132 132 LYS H H 132 7.732 8.201 -0.469 1 1 1025 . 1 1 1 A 132 132 LYS HA H 132 4.171 4.926 -0.755 1 1 1028 . 1 1 1 A 132 132 LYS N N 132 127.309 119.697 7.612 1 1 1029 . 1 1 1 A 133 133 ARG H H 133 8.193 8.551 -0.358 1 1 1030 . 1 1 1 A 133 133 ARG HA H 133 5.073 5.111 -0.038 1 1 1038 . 1 1 1 A 133 133 ARG N N 133 122.190 120.490 1.700 1 1 1040 . 1 1 1 A 134 134 ARG H H 134 7.539 9.196 -1.657 1 1 1041 . 1 1 1 A 134 134 ARG HA H 134 4.667 4.959 -0.292 1 1 1049 . 1 1 1 A 134 134 ARG CA C 134 52.584 54.841 -2.257 1 1 1050 . 1 1 1 A 134 134 ARG CB C 134 31.325 31.916 -0.591 1 1 1052 . 1 1 1 A 134 134 ARG N N 134 121.632 124.251 -2.619 1 1 1054 . 1 1 1 A 135 135 PHE H H 135 8.816 9.170 -0.354 1 1 1055 . 1 1 1 A 135 135 PHE HA H 135 5.680 6.004 -0.324 1 1 1062 . 1 1 1 A 135 135 PHE N N 135 125.107 121.742 3.365 1 1 1063 . 1 1 1 A 136 136 ARG H H 136 7.741 9.474 -1.733 1 1 1064 . 1 1 1 A 136 136 ARG HA H 136 4.402 4.490 -0.088 1 1 1068 . 1 1 1 A 136 136 ARG N N 136 125.640 124.773 0.867 1 1 1070 . 1 1 1 A 137 137 ILE H H 137 8.556 8.468 0.088 1 1 1071 . 1 1 1 A 137 137 ILE HA H 137 3.912 4.068 -0.156 1 1 1076 . 1 1 1 A 137 137 ILE CA C 137 55.676 61.232 -5.556 1 1 1079 . 1 1 1 A 137 137 ILE N N 137 122.891 124.280 -1.389 1 1 1080 . 1 1 1 A 138 138 GLY H H 138 8.676 10.246 -1.570 1 1 1081 . 1 1 1 A 138 138 GLY HA2 H 138 3.740 4.210 -0.470 1 1 1082 . 1 1 1 A 138 138 GLY HA3 H 138 2.982 4.233 -1.251 1 1 1083 . 1 1 1 A 138 138 GLY CA C 138 41.908 44.687 -2.779 1 1 1084 . 1 1 1 A 138 138 GLY N N 138 117.058 109.867 7.191 1 1 1085 . 1 1 1 A 139 139 ASP H H 139 7.858 8.303 -0.445 1 1 1086 . 1 1 1 A 139 139 ASP HA H 139 4.753 4.539 0.214 1 1 1089 . 1 1 1 A 139 139 ASP CA C 139 52.584 54.799 -2.215 1 1 1090 . 1 1 1 A 139 139 ASP CB C 139 43.062 40.992 2.070 1 1 1091 . 1 1 1 A 139 139 ASP N N 139 124.516 120.857 3.659 1 1 1092 . 1 1 1 A 140 140 ILE H H 140 8.354 8.424 -0.070 1 1 1093 . 1 1 1 A 140 140 ILE HA H 140 4.473 4.175 0.298 1 1 1103 . 1 1 1 A 140 140 ILE CB C 140 36.173 38.988 -2.815 1 1 1105 . 1 1 1 A 140 140 ILE N N 140 120.679 121.388 -0.709 1 1 1106 . 1 1 1 A 141 141 ALA H H 141 8.708 7.975 0.733 1 1 1107 . 1 1 1 A 141 141 ALA HA H 141 4.862 4.221 0.641 1 1 1111 . 1 1 1 A 141 141 ALA CA C 141 47.968 50.095 -2.127 1 1 1112 . 1 1 1 A 141 141 ALA CB C 141 21.733 19.226 2.507 1 1 1113 . 1 1 1 A 141 141 ALA N N 141 130.144 123.971 6.173 1 1 1114 . 1 1 1 A 142 142 GLY H H 142 7.888 8.682 -0.794 1 1 1115 . 1 1 1 A 142 142 GLY HA2 H 142 4.519 3.904 0.615 1 1 1116 . 1 1 1 A 142 142 GLY HA3 H 142 3.634 4.021 -0.387 1 1 1117 . 1 1 1 A 142 142 GLY N N 142 102.272 106.387 -4.115 1 1 1118 . 1 1 1 A 143 143 GLU H H 143 8.068 8.229 -0.161 1 1 1119 . 1 1 1 A 143 143 GLU HA H 143 4.577 4.521 0.056 1 1 1124 . 1 1 1 A 143 143 GLU N N 143 120.569 117.998 2.571 1 1 1125 . 1 1 1 A 144 144 HIS H H 144 8.478 8.259 0.219 1 1 1126 . 1 1 1 A 144 144 HIS HA H 144 4.968 4.576 0.392 1 1 1131 . 1 1 1 A 144 144 HIS N N 144 124.275 123.993 0.282 1 1 1132 . 1 1 1 A 145 145 THR H H 145 9.031 8.572 0.459 1 1 1133 . 1 1 1 A 145 145 THR HA H 145 4.025 5.161 -1.136 1 1 1138 . 1 1 1 A 145 145 THR CA C 145 61.247 60.717 0.530 1 1 1139 . 1 1 1 A 145 145 THR CB C 145 65.181 71.134 -5.953 1 1 1141 . 1 1 1 A 145 145 THR N N 145 125.828 119.520 6.308 1 1 1142 . 1 1 1 A 146 146 SER H H 146 9.077 8.991 0.086 1 1 1143 . 1 1 1 A 146 146 SER HA H 146 4.684 4.576 0.108 1 1 1145 . 1 1 1 A 146 146 SER CA C 146 56.067 58.907 -2.840 1 1 1146 . 1 1 1 A 146 146 SER CB C 146 60.510 64.568 -4.058 1 1 1147 . 1 1 1 A 146 146 SER N N 146 124.154 123.187 0.967 1 1 1148 . 1 1 1 A 147 147 PHE H H 147 9.049 9.308 -0.259 1 1 1149 . 1 1 1 A 147 147 PHE HA H 147 4.022 4.259 -0.237 1 1 1154 . 1 1 1 A 147 147 PHE N N 147 127.670 127.236 0.434 1 1 1155 . 1 1 1 A 148 148 ASP H H 148 8.504 8.511 -0.007 1 1 1156 . 1 1 1 A 148 148 ASP HA H 148 4.422 4.556 -0.134 1 1 1158 . 1 1 1 A 148 148 ASP CA C 148 52.584 56.816 -4.232 1 1 1159 . 1 1 1 A 148 148 ASP CB C 148 37.800 41.242 -3.442 1 1 1160 . 1 1 1 A 148 148 ASP N N 148 114.377 120.571 -6.194 1 1 1161 . 1 1 1 A 149 149 LYS H H 149 7.380 8.224 -0.844 1 1 1162 . 1 1 1 A 149 149 LYS HA H 149 4.487 4.245 0.242 1 1 1171 . 1 1 1 A 149 149 LYS CA C 149 51.735 57.762 -6.027 1 1 1172 . 1 1 1 A 149 149 LYS CB C 149 30.162 32.274 -2.112 1 1 1175 . 1 1 1 A 149 149 LYS N N 149 119.137 117.126 2.011 1 1 1176 . 1 1 1 A 150 150 LEU H H 150 6.886 7.701 -0.815 1 1 1177 . 1 1 1 A 150 150 LEU HA H 150 3.996 4.604 -0.608 1 1 1186 . 1 1 1 A 150 150 LEU CA C 150 50.502 52.082 -1.580 1 1 1187 . 1 1 1 A 150 150 LEU N N 150 120.614 117.135 3.479 1 1 1188 . 1 1 1 A 151 151 PRO CB C 151 29.567 30.350 -0.783 1 1 1190 . 1 1 1 A 152 152 LYS H H 152 8.076 8.442 -0.366 1 1 1191 . 1 1 1 A 152 152 LYS HA H 152 4.346 4.422 -0.076 1 1 1195 . 1 1 1 A 152 152 LYS CA C 152 53.182 56.581 -3.399 1 1 1196 . 1 1 1 A 152 152 LYS CB C 152 31.487 34.624 -3.137 1 1 1198 . 1 1 1 A 152 152 LYS N N 152 118.133 120.625 -2.492 1 1 1199 . 1 1 1 A 153 153 ASP H H 153 7.982 7.481 0.501 1 1 1200 . 1 1 1 A 153 153 ASP HA H 153 4.402 3.718 0.684 1 1 1203 . 1 1 1 A 153 153 ASP CA C 153 52.584 52.382 0.202 1 1 1204 . 1 1 1 A 153 153 ASP CB C 153 37.762 41.232 -3.470 1 1 1205 . 1 1 1 A 153 153 ASP N N 153 115.735 114.978 0.757 1 1 1206 . 1 1 1 A 154 154 VAL H H 154 6.987 6.507 0.480 1 1 1207 . 1 1 1 A 154 154 VAL HA H 154 4.406 4.165 0.241 1 1 1215 . 1 1 1 A 154 154 VAL CA C 154 58.408 61.127 -2.719 1 1 1216 . 1 1 1 A 154 154 VAL CB C 154 32.617 32.081 0.536 1 1 1217 . 1 1 1 A 154 154 VAL N N 154 116.266 120.704 -4.438 1 1 1218 . 1 1 1 A 155 155 MET H H 155 8.444 8.766 -0.322 1 1 1219 . 1 1 1 A 155 155 MET HA H 155 5.416 4.941 0.475 1 1 1224 . 1 1 1 A 155 155 MET CA C 155 51.183 54.876 -3.693 1 1 1226 . 1 1 1 A 155 155 MET N N 155 124.950 127.061 -2.111 1 1 1227 . 1 1 1 A 156 156 ALA H H 156 9.226 9.019 0.207 1 1 1228 . 1 1 1 A 156 156 ALA HA H 156 4.693 4.991 -0.298 1 1 1232 . 1 1 1 A 156 156 ALA CA C 156 48.379 51.308 -2.929 1 1 1233 . 1 1 1 A 156 156 ALA CB C 156 21.051 20.055 0.996 1 1 1234 . 1 1 1 A 156 156 ALA N N 156 129.938 127.683 2.255 1 1 1235 . 1 1 1 A 157 157 THR H H 157 8.554 9.008 -0.454 1 1 1236 . 1 1 1 A 157 157 THR HA H 157 4.839 5.443 -0.604 1 1 1241 . 1 1 1 A 157 157 THR CA C 157 59.555 62.158 -2.603 1 1 1242 . 1 1 1 A 157 157 THR CB C 157 68.575 70.853 -2.278 1 1 1244 . 1 1 1 A 157 157 THR N N 157 118.815 119.277 -0.462 1 1 1245 . 1 1 1 A 158 158 TYR H H 158 9.974 9.400 0.574 1 1 1246 . 1 1 1 A 158 158 TYR HA H 158 4.435 5.881 -1.446 1 1 1253 . 1 1 1 A 158 158 TYR N N 158 126.958 124.512 2.446 1 1 1254 . 1 1 1 A 159 159 ARG H H 159 8.909 8.609 0.300 1 1 1255 . 1 1 1 A 159 159 ARG HA H 159 5.444 5.165 0.279 1 1 1263 . 1 1 1 A 159 159 ARG CA C 159 51.933 54.427 -2.494 1 1 1264 . 1 1 1 A 159 159 ARG N N 159 121.721 119.384 2.337 1 1 1266 . 1 1 1 A 160 160 GLY H H 160 8.910 8.469 0.441 1 1 1267 . 1 1 1 A 160 160 GLY HA2 H 160 4.904 4.262 0.642 1 1 1268 . 1 1 1 A 160 160 GLY HA3 H 160 4.484 4.385 0.099 1 1 1269 . 1 1 1 A 160 160 GLY N N 160 113.921 107.026 6.895 1 1 1270 . 1 1 1 A 161 161 THR H H 161 9.110 8.990 0.120 1 1 1271 . 1 1 1 A 161 161 THR HA H 161 4.810 5.124 -0.314 1 1 1276 . 1 1 1 A 161 161 THR CA C 161 59.603 61.028 -1.425 1 1 1277 . 1 1 1 A 161 161 THR CB C 161 69.909 72.436 -2.527 1 1 1279 . 1 1 1 A 161 161 THR N N 161 126.813 115.964 10.849 1 1 1280 . 1 1 1 A 162 162 ALA H H 162 7.137 9.918 -2.781 1 1 1281 . 1 1 1 A 162 162 ALA HA H 162 5.361 5.374 -0.013 1 1 1285 . 1 1 1 A 162 162 ALA CA C 162 46.573 50.642 -4.069 1 1 1286 . 1 1 1 A 162 162 ALA CB C 162 20.959 23.736 -2.777 1 1 1287 . 1 1 1 A 162 162 ALA N N 162 128.111 124.366 3.745 1 1 1288 . 1 1 1 A 163 163 PHE H H 163 8.587 9.080 -0.493 1 1 1289 . 1 1 1 A 163 163 PHE HA H 163 5.538 5.404 0.134 1 1 1296 . 1 1 1 A 163 163 PHE N N 163 117.349 114.205 3.144 1 1 1297 . 1 1 1 A 164 164 GLY H H 164 8.650 8.790 -0.140 1 1 1298 . 1 1 1 A 164 164 GLY HA2 H 164 4.210 3.911 0.299 1 1 1299 . 1 1 1 A 164 164 GLY HA3 H 164 3.285 4.172 -0.887 1 1 1300 . 1 1 1 A 164 164 GLY CA C 164 40.377 43.589 -3.212 1 1 1301 . 1 1 1 A 164 164 GLY N N 164 108.839 109.154 -0.315 1 1 1302 . 1 1 1 A 165 165 SER H H 165 7.684 7.998 -0.314 1 1 1303 . 1 1 1 A 165 165 SER HA H 165 3.458 4.580 -1.122 1 1 1304 . 1 1 1 A 165 165 SER N N 165 116.037 115.604 0.433 1 1 1305 . 1 1 1 A 166 166 ASP H H 166 9.718 8.187 1.531 1 1 1306 . 1 1 1 A 166 166 ASP HA H 166 4.281 4.888 -0.607 1 1 1309 . 1 1 1 A 166 166 ASP CA C 166 52.584 53.285 -0.701 1 1 1310 . 1 1 1 A 166 166 ASP N N 166 125.166 120.462 4.704 1 1 1311 . 1 1 1 A 167 167 ASP H H 167 7.655 7.960 -0.305 1 1 1312 . 1 1 1 A 167 167 ASP HA H 167 4.666 4.974 -0.308 1 1 1315 . 1 1 1 A 167 167 ASP CB C 167 38.948 44.764 -5.816 1 1 1316 . 1 1 1 A 167 167 ASP N N 167 117.491 119.060 -1.569 1 1 1317 . 1 1 1 A 168 168 ALA H H 168 8.585 8.646 -0.061 1 1 1318 . 1 1 1 A 168 168 ALA HA H 168 5.012 4.326 0.686 1 1 1322 . 1 1 1 A 168 168 ALA CA C 168 47.485 52.966 -5.481 1 1 1323 . 1 1 1 A 168 168 ALA N N 168 128.834 123.854 4.980 1 1 1324 . 1 1 1 A 169 169 GLY H H 169 8.472 8.958 -0.486 1 1 1325 . 1 1 1 A 169 169 GLY HA2 H 169 4.404 3.986 0.418 1 1 1326 . 1 1 1 A 169 169 GLY HA3 H 169 4.051 4.023 0.028 1 1 1327 . 1 1 1 A 169 169 GLY CA C 169 43.257 47.335 -4.078 1 1 1328 . 1 1 1 A 169 169 GLY N N 169 107.133 110.105 -2.972 1 1 1329 . 1 1 1 A 170 170 GLY H H 170 7.229 6.934 0.295 1 1 1330 . 1 1 1 A 170 170 GLY HA2 H 170 4.223 4.051 0.172 1 1 1331 . 1 1 1 A 170 170 GLY HA3 H 170 3.781 4.160 -0.379 1 1 1332 . 1 1 1 A 170 170 GLY CA C 170 43.310 45.516 -2.206 1 1 1333 . 1 1 1 A 170 170 GLY N N 170 107.542 107.806 -0.264 1 1 1334 . 1 1 1 A 171 171 LYS H H 171 9.641 8.384 1.257 1 1 1335 . 1 1 1 A 171 171 LYS HA H 171 5.129 4.838 0.291 1 1 1342 . 1 1 1 A 171 171 LYS CA C 171 51.355 54.699 -3.344 1 1 1343 . 1 1 1 A 171 171 LYS N N 171 124.322 120.015 4.307 1 1 1344 . 1 1 1 A 172 172 LEU H H 172 7.764 8.403 -0.639 1 1 1345 . 1 1 1 A 172 172 LEU HA H 172 4.973 4.915 0.058 1 1 1353 . 1 1 1 A 172 172 LEU CA C 172 50.348 53.431 -3.083 1 1 1354 . 1 1 1 A 172 172 LEU N N 172 126.389 120.910 5.479 1 1 1355 . 1 1 1 A 173 173 THR H H 173 8.321 7.935 0.386 1 1 1356 . 1 1 1 A 173 173 THR HA H 173 5.017 4.708 0.309 1 1 1361 . 1 1 1 A 173 173 THR CA C 173 59.149 61.011 -1.862 1 1 1362 . 1 1 1 A 173 173 THR CB C 173 67.449 71.213 -3.764 1 1 1364 . 1 1 1 A 173 173 THR N N 173 123.553 114.319 9.234 1 1 1365 . 1 1 1 A 174 174 TYR H H 174 9.367 9.432 -0.065 1 1 1366 . 1 1 1 A 174 174 TYR HA H 174 4.660 5.175 -0.515 1 1 1373 . 1 1 1 A 174 174 TYR CB C 174 41.267 43.021 -1.754 1 1 1374 . 1 1 1 A 174 174 TYR N N 174 129.583 124.765 4.818 1 1 1375 . 1 1 1 A 175 175 THR H H 175 8.529 8.660 -0.131 1 1 1376 . 1 1 1 A 175 175 THR HA H 175 5.388 5.024 0.364 1 1 1381 . 1 1 1 A 175 175 THR CA C 175 58.216 61.823 -3.607 1 1 1382 . 1 1 1 A 175 175 THR CB C 175 68.575 69.842 -1.267 1 1 1384 . 1 1 1 A 175 175 THR N N 175 125.967 115.670 10.297 1 1 1385 . 1 1 1 A 176 176 ILE H H 176 9.139 10.358 -1.219 1 1 1386 . 1 1 1 A 176 176 ILE HA H 176 4.382 5.052 -0.670 1 1 1395 . 1 1 1 A 176 176 ILE CA C 176 58.006 59.611 -1.605 1 1 1396 . 1 1 1 A 176 176 ILE CB C 176 38.881 40.481 -1.600 1 1 1400 . 1 1 1 A 176 176 ILE N N 176 123.715 127.819 -4.104 1 1 1401 . 1 1 1 A 177 177 ASP H H 177 8.501 8.894 -0.393 1 1 1402 . 1 1 1 A 177 177 ASP HA H 177 5.011 5.438 -0.427 1 1 1405 . 1 1 1 A 177 177 ASP CA C 177 49.089 52.681 -3.592 1 1 1406 . 1 1 1 A 177 177 ASP CB C 177 39.282 44.012 -4.730 1 1 1407 . 1 1 1 A 177 177 ASP N N 177 125.978 123.641 2.337 1 1 1408 . 1 1 1 A 178 178 PHE H H 178 8.913 9.245 -0.332 1 1 1409 . 1 1 1 A 178 178 PHE HA H 178 3.993 4.721 -0.728 1 1 1414 . 1 1 1 A 178 178 PHE CB C 178 34.588 40.398 -5.810 1 1 1415 . 1 1 1 A 178 178 PHE N N 178 123.522 121.438 2.084 1 1 1416 . 1 1 1 A 179 179 ALA H H 179 8.487 9.161 -0.674 1 1 1417 . 1 1 1 A 179 179 ALA HA H 179 4.528 4.144 0.384 1 1 1421 . 1 1 1 A 179 179 ALA CA C 179 52.584 55.598 -3.014 1 1 1422 . 1 1 1 A 179 179 ALA CB C 179 15.666 18.801 -3.135 1 1 1423 . 1 1 1 A 179 179 ALA N N 179 124.061 121.795 2.266 1 1 1424 . 1 1 1 A 180 180 ALA H H 180 7.162 6.230 0.932 1 1 1425 . 1 1 1 A 180 180 ALA HA H 180 4.313 4.118 0.195 1 1 1429 . 1 1 1 A 180 180 ALA CA C 180 49.006 50.916 -1.910 1 1 1430 . 1 1 1 A 180 180 ALA CB C 180 16.933 16.744 0.189 1 1 1431 . 1 1 1 A 180 180 ALA N N 180 119.710 118.060 1.650 1 1 1432 . 1 1 1 A 181 181 LYS H H 181 8.092 9.468 -1.376 1 1 1433 . 1 1 1 A 181 181 LYS HA H 181 3.457 4.830 -1.373 1 1 1440 . 1 1 1 A 181 181 LYS CA C 181 54.783 56.664 -1.881 1 1 1441 . 1 1 1 A 181 181 LYS CB C 181 27.088 31.721 -4.633 1 1 1444 . 1 1 1 A 181 181 LYS N N 181 114.996 118.253 -3.257 1 1 1445 . 1 1 1 A 182 182 GLN H H 182 7.532 7.807 -0.275 1 1 1446 . 1 1 1 A 182 182 GLN HA H 182 5.304 5.169 0.135 1 1 1453 . 1 1 1 A 182 182 GLN CA C 182 51.473 54.380 -2.907 1 1 1454 . 1 1 1 A 182 182 GLN CB C 182 31.585 31.693 -0.108 1 1 1455 . 1 1 1 A 182 182 GLN N N 182 115.064 124.473 -9.409 1 1 1457 . 1 1 1 A 183 183 GLY H H 183 9.026 9.146 -0.120 1 1 1458 . 1 1 1 A 183 183 GLY HA2 H 183 5.376 4.476 0.900 1 1 1459 . 1 1 1 A 183 183 GLY HA3 H 183 3.567 4.495 -0.928 1 1 1460 . 1 1 1 A 183 183 GLY CA C 183 42.361 45.637 -3.276 1 1 1461 . 1 1 1 A 183 183 GLY N N 183 111.505 112.602 -1.097 1 1 1462 . 1 1 1 A 184 184 HIS H H 184 7.508 8.704 -1.196 1 1 1463 . 1 1 1 A 184 184 HIS HA H 184 4.304 5.039 -0.735 1 1 1467 . 1 1 1 A 184 184 HIS CA C 184 52.793 55.721 -2.928 1 1 1468 . 1 1 1 A 184 184 HIS CB C 184 27.906 32.861 -4.955 1 1 1469 . 1 1 1 A 184 184 HIS N N 184 111.297 118.050 -6.753 1 1 1470 . 1 1 1 A 185 185 GLY H H 185 9.160 8.023 1.137 1 1 1471 . 1 1 1 A 185 185 GLY HA2 H 185 4.464 4.096 0.368 1 1 1472 . 1 1 1 A 185 185 GLY HA3 H 185 4.117 4.379 -0.262 1 1 1473 . 1 1 1 A 185 185 GLY CA C 185 44.212 45.604 -1.392 1 1 1474 . 1 1 1 A 185 185 GLY N N 185 107.398 110.428 -3.030 1 1 1475 . 1 1 1 A 186 186 LYS H H 186 9.170 8.345 0.825 1 1 1476 . 1 1 1 A 186 186 LYS HA H 186 4.925 4.940 -0.015 1 1 1481 . 1 1 1 A 186 186 LYS CB C 186 33.642 36.575 -2.933 1 1 1482 . 1 1 1 A 186 186 LYS N N 186 122.690 120.814 1.876 1 1 1483 . 1 1 1 A 187 187 ILE H H 187 8.444 8.619 -0.175 1 1 1484 . 1 1 1 A 187 187 ILE HA H 187 4.626 5.052 -0.426 1 1 1487 . 1 1 1 A 187 187 ILE N N 187 124.320 124.087 0.233 1 1 1488 . 1 1 1 A 188 188 GLU H H 188 8.590 10.054 -1.464 1 1 1489 . 1 1 1 A 188 188 GLU HA H 188 4.650 5.435 -0.785 1 1 1495 . 1 1 1 A 188 188 GLU N N 188 122.575 126.355 -3.780 1 1 1496 . 1 1 1 A 189 189 HIS H H 189 8.726 8.503 0.223 1 1 1497 . 1 1 1 A 189 189 HIS HA H 189 4.055 4.733 -0.678 1 1 1501 . 1 1 1 A 189 189 HIS CA C 189 54.623 57.018 -2.395 1 1 1502 . 1 1 1 A 189 189 HIS CB C 189 24.997 31.524 -6.527 1 1 1503 . 1 1 1 A 189 189 HIS N N 189 111.381 119.653 -8.272 1 1 1504 . 1 1 1 A 190 190 LEU H H 190 9.715 7.908 1.807 1 1 1505 . 1 1 1 A 190 190 LEU HA H 190 4.379 4.441 -0.062 1 1 1515 . 1 1 1 A 190 190 LEU N N 190 124.648 116.028 8.620 1 1 1516 . 1 1 1 A 191 191 LYS H H 191 10.099 8.228 1.871 1 1 1517 . 1 1 1 A 191 191 LYS HA H 191 3.736 4.544 -0.808 1 1 1524 . 1 1 1 A 191 191 LYS CA C 191 55.815 55.628 0.187 1 1 1525 . 1 1 1 A 191 191 LYS CB C 191 30.201 33.590 -3.389 1 1 1527 . 1 1 1 A 191 191 LYS N N 191 123.618 116.705 6.913 1 1 1528 . 1 1 1 A 192 192 SER H H 192 6.991 7.426 -0.435 1 1 1529 . 1 1 1 A 192 192 SER HA H 192 4.743 4.494 0.249 1 1 1532 . 1 1 1 A 192 192 SER CA C 192 51.974 57.409 -5.435 1 1 1533 . 1 1 1 A 192 192 SER CB C 192 60.005 63.745 -3.740 1 1 1534 . 1 1 1 A 192 192 SER N N 192 115.071 117.864 -2.793 1 1 1535 . 1 1 1 A 193 193 PRO CB C 193 29.607 31.392 -1.785 1 1 1537 . 1 1 1 A 194 194 GLU H H 194 8.213 8.182 0.031 1 1 1538 . 1 1 1 A 194 194 GLU HA H 194 3.063 4.489 -1.426 1 1 1543 . 1 1 1 A 194 194 GLU CA C 194 54.185 55.062 -0.877 1 1 1545 . 1 1 1 A 194 194 GLU N N 194 114.055 115.123 -1.068 1 1 1546 . 1 1 1 A 195 195 LEU H H 195 7.082 7.621 -0.539 1 1 1547 . 1 1 1 A 195 195 LEU HA H 195 4.027 3.810 0.217 1 1 1557 . 1 1 1 A 195 195 LEU CA C 195 51.361 57.857 -6.496 1 1 1558 . 1 1 1 A 195 195 LEU CB C 195 38.950 41.715 -2.765 1 1 1561 . 1 1 1 A 195 195 LEU N N 195 113.898 123.875 -9.977 1 1 1562 . 1 1 1 A 196 196 ASN H H 196 7.060 7.609 -0.549 1 1 1563 . 1 1 1 A 196 196 ASN HA H 196 4.638 5.636 -0.998 1 1 1567 . 1 1 1 A 196 196 ASN N N 196 119.196 114.464 4.732 1 1 1568 . 1 1 1 A 197 197 VAL H H 197 7.244 8.433 -1.189 1 1 1569 . 1 1 1 A 197 197 VAL HA H 197 4.540 4.702 -0.162 1 1 1577 . 1 1 1 A 197 197 VAL CA C 197 57.176 60.444 -3.268 1 1 1578 . 1 1 1 A 197 197 VAL N N 197 113.621 118.578 -4.957 1 1 1579 . 1 1 1 A 198 198 ASP H H 198 8.881 8.487 0.394 1 1 1580 . 1 1 1 A 198 198 ASP HA H 198 4.894 5.384 -0.490 1 1 1581 . 1 1 1 A 198 198 ASP N N 198 118.852 123.374 -4.522 1 1 1582 . 1 1 1 A 199 199 LEU H H 199 8.498 9.027 -0.529 1 1 1583 . 1 1 1 A 199 199 LEU HA H 199 4.317 5.015 -0.698 1 1 1591 . 1 1 1 A 199 199 LEU N N 199 124.078 124.111 -0.033 1 1 1592 . 1 1 1 A 200 200 ALA H H 200 8.386 8.313 0.073 1 1 1593 . 1 1 1 A 200 200 ALA HA H 200 4.295 5.168 -0.873 1 1 1597 . 1 1 1 A 200 200 ALA CA C 200 50.044 50.294 -0.250 1 1 1598 . 1 1 1 A 200 200 ALA CB C 200 17.985 21.986 -4.001 1 1 1599 . 1 1 1 A 200 200 ALA N N 200 127.315 126.624 0.691 1 1 1600 . 1 1 1 A 201 201 VAL H H 201 8.007 9.046 -1.039 1 1 1601 . 1 1 1 A 201 201 VAL HA H 201 4.577 4.616 -0.039 1 1 1609 . 1 1 1 A 201 201 VAL CA C 201 60.004 60.388 -0.384 1 1 1610 . 1 1 1 A 201 201 VAL CB C 201 28.863 36.410 -7.547 1 1 1611 . 1 1 1 A 201 201 VAL N N 201 119.409 117.871 1.538 1 1 1612 . 1 1 1 A 202 202 ALA H H 202 8.789 8.474 0.315 1 1 1613 . 1 1 1 A 202 202 ALA HA H 202 4.630 5.036 -0.406 1 1 1617 . 1 1 1 A 202 202 ALA CA C 202 48.200 51.443 -3.243 1 1 1618 . 1 1 1 A 202 202 ALA N N 202 131.745 125.529 6.216 1 1 1619 . 1 1 1 A 203 203 TYR H H 203 8.522 8.992 -0.470 1 1 1620 . 1 1 1 A 203 203 TYR HA H 203 5.391 5.280 0.111 1 1 1627 . 1 1 1 A 203 203 TYR CA C 203 54.648 57.297 -2.649 1 1 1628 . 1 1 1 A 203 203 TYR CB C 203 37.315 39.401 -2.086 1 1 1629 . 1 1 1 A 203 203 TYR N N 203 117.786 125.150 -7.364 1 1 1630 . 1 1 1 A 204 204 ILE H H 204 8.209 8.497 -0.288 1 1 1631 . 1 1 1 A 204 204 ILE HA H 204 4.393 4.715 -0.322 1 1 1641 . 1 1 1 A 204 204 ILE CB C 204 36.807 39.494 -2.687 1 1 1644 . 1 1 1 A 204 204 ILE N N 204 120.602 126.692 -6.090 1 1 1645 . 1 1 1 A 205 205 LYS H H 205 9.340 8.696 0.644 1 1 1646 . 1 1 1 A 205 205 LYS HA H 205 4.756 4.494 0.262 1 1 1651 . 1 1 1 A 205 205 LYS CA C 205 50.844 60.733 -9.889 1 1 1652 . 1 1 1 A 205 205 LYS N N 205 127.960 124.440 3.520 1 1 1653 . 1 1 1 A 207 207 ASP H H 207 8.436 8.697 -0.261 1 1 1654 . 1 1 1 A 207 207 ASP HA H 207 4.692 4.571 0.121 1 1 1657 . 1 1 1 A 207 207 ASP CA C 207 48.789 53.720 -4.931 1 1 1658 . 1 1 1 A 207 207 ASP CB C 207 38.377 41.323 -2.946 1 1 1659 . 1 1 1 A 207 207 ASP N N 207 123.098 124.937 -1.839 1 1 1660 . 1 1 1 A 208 208 GLU H H 208 8.880 8.478 0.402 1 1 1661 . 1 1 1 A 208 208 GLU HA H 208 3.994 4.045 -0.051 1 1 1666 . 1 1 1 A 208 208 GLU CA C 208 56.123 59.537 -3.414 1 1 1667 . 1 1 1 A 208 208 GLU CB C 208 25.794 29.596 -3.802 1 1 1669 . 1 1 1 A 208 208 GLU N N 208 119.042 122.295 -3.253 1 1 1670 . 1 1 1 A 209 209 LYS H H 209 7.681 7.637 0.044 1 1 1671 . 1 1 1 A 209 209 LYS HA H 209 4.141 4.411 -0.270 1 1 1680 . 1 1 1 A 209 209 LYS N N 209 119.252 115.702 3.550 1 1 1681 . 1 1 1 A 210 210 HIS H H 210 8.177 6.610 1.567 1 1 1682 . 1 1 1 A 210 210 HIS HA H 210 3.825 4.722 -0.897 1 1 1687 . 1 1 1 A 210 210 HIS CA C 210 54.205 54.219 -0.014 1 1 1688 . 1 1 1 A 210 210 HIS CB C 210 23.439 29.871 -6.432 1 1 1689 . 1 1 1 A 210 210 HIS N N 210 112.758 113.288 -0.530 1 1 1690 . 1 1 1 A 211 211 HIS H H 211 8.758 7.278 1.480 1 1 1691 . 1 1 1 A 211 211 HIS HA H 211 5.041 4.966 0.075 1 1 1695 . 1 1 1 A 211 211 HIS CA C 211 50.450 54.950 -4.500 1 1 1696 . 1 1 1 A 211 211 HIS CB C 211 25.703 33.769 -8.066 1 1 1697 . 1 1 1 A 211 211 HIS N N 211 119.552 118.425 1.127 1 1 1698 . 1 1 1 A 212 212 ALA H H 212 8.556 8.253 0.303 1 1 1699 . 1 1 1 A 212 212 ALA HA H 212 4.712 4.456 0.256 1 1 1703 . 1 1 1 A 212 212 ALA CA C 212 49.886 52.281 -2.395 1 1 1704 . 1 1 1 A 212 212 ALA CB C 212 18.860 19.021 -0.161 1 1 1705 . 1 1 1 A 212 212 ALA N N 212 123.780 123.693 0.087 1 1 1706 . 1 1 1 A 213 213 VAL H H 213 9.338 8.090 1.248 1 1 1707 . 1 1 1 A 213 213 VAL HA H 213 5.074 4.630 0.444 1 1 1715 . 1 1 1 A 213 213 VAL CA C 213 57.486 60.486 -3.000 1 1 1716 . 1 1 1 A 213 213 VAL CB C 213 33.938 34.274 -0.336 1 1 1717 . 1 1 1 A 213 213 VAL N N 213 124.742 120.602 4.140 1 1 1718 . 1 1 1 A 214 214 ILE H H 214 8.962 8.863 0.099 1 1 1719 . 1 1 1 A 214 214 ILE HA H 214 4.434 5.097 -0.663 1 1 1726 . 1 1 1 A 214 214 ILE N N 214 122.881 126.087 -3.206 1 1 1727 . 1 1 1 A 215 215 SER H H 215 8.558 8.339 0.219 1 1 1728 . 1 1 1 A 215 215 SER HA H 215 5.001 5.417 -0.416 1 1 1731 . 1 1 1 A 215 215 SER CA C 215 53.230 57.283 -4.053 1 1 1732 . 1 1 1 A 215 215 SER CB C 215 62.077 66.342 -4.265 1 1 1733 . 1 1 1 A 215 215 SER N N 215 122.891 122.943 -0.052 1 1 1734 . 1 1 1 A 216 216 GLY H H 216 7.282 9.086 -1.804 1 1 1735 . 1 1 1 A 216 216 GLY HA2 H 216 4.515 4.214 0.301 1 1 1736 . 1 1 1 A 216 216 GLY HA3 H 216 3.473 4.249 -0.776 1 1 1737 . 1 1 1 A 216 216 GLY CA C 216 42.816 45.756 -2.940 1 1 1738 . 1 1 1 A 216 216 GLY N N 216 110.899 110.965 -0.066 1 1 1739 . 1 1 1 A 217 217 SER H H 217 8.673 8.575 0.098 1 1 1740 . 1 1 1 A 217 217 SER HA H 217 5.127 5.431 -0.304 1 1 1743 . 1 1 1 A 217 217 SER CA C 217 56.266 56.561 -0.295 1 1 1744 . 1 1 1 A 217 217 SER N N 217 117.164 113.760 3.404 1 1 1745 . 1 1 1 A 218 218 VAL H H 218 7.451 8.785 -1.334 1 1 1746 . 1 1 1 A 218 218 VAL HA H 218 5.128 4.769 0.359 1 1 1754 . 1 1 1 A 218 218 VAL CA C 218 56.637 60.876 -4.239 1 1 1755 . 1 1 1 A 218 218 VAL N N 218 117.826 126.171 -8.345 1 1 1756 . 1 1 1 A 219 219 LEU H H 219 9.022 9.170 -0.148 1 1 1757 . 1 1 1 A 219 219 LEU HA H 219 5.387 4.902 0.485 1 1 1767 . 1 1 1 A 219 219 LEU CA C 219 50.450 53.880 -3.430 1 1 1768 . 1 1 1 A 219 219 LEU N N 219 124.820 127.212 -2.392 1 1 1769 . 1 1 1 A 220 220 TYR H H 220 8.816 8.997 -0.181 1 1 1770 . 1 1 1 A 220 220 TYR HA H 220 4.834 4.966 -0.132 1 1 1777 . 1 1 1 A 220 220 TYR N N 220 121.249 125.780 -4.531 1 1 1778 . 1 1 1 A 221 221 ASN H H 221 9.191 8.688 0.503 1 1 1779 . 1 1 1 A 221 221 ASN HA H 221 4.048 4.599 -0.551 1 1 1784 . 1 1 1 A 221 221 ASN CA C 221 51.647 54.767 -3.120 1 1 1785 . 1 1 1 A 221 221 ASN CB C 221 36.640 37.968 -1.328 1 1 1786 . 1 1 1 A 221 221 ASN N N 221 129.865 125.355 4.510 1 1 1788 . 1 1 1 A 222 222 GLN H H 222 8.468 7.564 0.904 1 1 1789 . 1 1 1 A 222 222 GLN HA H 222 3.671 4.227 -0.556 1 1 1794 . 1 1 1 A 222 222 GLN CA C 222 55.075 57.629 -2.554 1 1 1795 . 1 1 1 A 222 222 GLN CB C 222 24.663 30.330 -5.667 1 1 1797 . 1 1 1 A 222 222 GLN N N 222 108.367 117.928 -9.561 1 1 1798 . 1 1 1 A 223 223 ASP H H 223 7.797 7.919 -0.122 1 1 1799 . 1 1 1 A 223 223 ASP HA H 223 4.986 4.847 0.139 1 1 1802 . 1 1 1 A 223 223 ASP N N 223 120.842 118.791 2.051 1 1 1803 . 1 1 1 A 224 224 GLU H H 224 8.731 7.910 0.821 1 1 1804 . 1 1 1 A 224 224 GLU HA H 224 4.690 4.631 0.059 1 1 1809 . 1 1 1 A 224 224 GLU CA C 224 54.703 56.512 -1.809 1 1 1810 . 1 1 1 A 224 224 GLU CB C 224 26.357 31.317 -4.960 1 1 1812 . 1 1 1 A 224 224 GLU N N 224 124.249 121.234 3.015 1 1 1813 . 1 1 1 A 225 225 LYS H H 225 8.730 8.354 0.376 1 1 1814 . 1 1 1 A 225 225 LYS HA H 225 4.754 4.783 -0.029 1 1 1822 . 1 1 1 A 225 225 LYS N N 225 126.784 124.435 2.349 1 1 1823 . 1 1 1 A 226 226 GLY H H 226 7.683 8.786 -1.103 1 1 1824 . 1 1 1 A 226 226 GLY HA2 H 226 5.567 4.142 1.425 1 1 1825 . 1 1 1 A 226 226 GLY HA3 H 226 3.819 4.176 -0.357 1 1 1826 . 1 1 1 A 226 226 GLY CA C 226 42.264 44.190 -1.926 1 1 1827 . 1 1 1 A 226 226 GLY N N 226 107.140 111.312 -4.172 1 1 1828 . 1 1 1 A 227 227 SER H H 227 8.672 10.979 -2.307 1 1 1829 . 1 1 1 A 227 227 SER HA H 227 5.564 5.392 0.172 1 1 1832 . 1 1 1 A 227 227 SER CA C 227 54.373 56.691 -2.318 1 1 1833 . 1 1 1 A 227 227 SER CB C 227 63.963 66.775 -2.812 1 1 1834 . 1 1 1 A 227 227 SER N N 227 117.767 113.120 4.647 1 1 1835 . 1 1 1 A 228 228 TYR H H 228 9.073 8.686 0.387 1 1 1836 . 1 1 1 A 228 228 TYR HA H 228 5.519 4.889 0.630 1 1 1843 . 1 1 1 A 228 228 TYR N N 228 118.324 119.480 -1.156 1 1 1844 . 1 1 1 A 229 229 SER H H 229 8.929 8.267 0.662 1 1 1845 . 1 1 1 A 229 229 SER HA H 229 5.209 5.430 -0.221 1 1 1848 . 1 1 1 A 229 229 SER CA C 229 54.131 57.550 -3.419 1 1 1849 . 1 1 1 A 229 229 SER N N 229 116.118 117.404 -1.286 1 1 1850 . 1 1 1 A 230 230 LEU H H 230 9.372 9.745 -0.373 1 1 1851 . 1 1 1 A 230 230 LEU HA H 230 4.803 4.996 -0.193 1 1 1863 . 1 1 1 A 230 230 LEU N N 230 124.803 125.756 -0.953 1 1 1864 . 1 1 1 A 231 231 GLY H H 231 9.080 8.227 0.853 1 1 1865 . 1 1 1 A 231 231 GLY HA2 H 231 4.776 4.162 0.614 1 1 1866 . 1 1 1 A 231 231 GLY HA3 H 231 3.528 4.307 -0.779 1 1 1867 . 1 1 1 A 231 231 GLY CA C 231 41.468 44.416 -2.948 1 1 1868 . 1 1 1 A 231 231 GLY N N 231 109.611 108.214 1.397 1 1 1869 . 1 1 1 A 232 232 ILE H H 232 6.849 9.193 -2.344 1 1 1870 . 1 1 1 A 232 232 ILE HA H 232 4.742 4.131 0.611 1 1 1878 . 1 1 1 A 232 232 ILE N N 232 120.566 125.596 -5.030 1 1 1879 . 1 1 1 A 233 233 PHE H H 233 9.569 8.019 1.550 1 1 1880 . 1 1 1 A 233 233 PHE HA H 233 4.979 5.436 -0.457 1 1 1885 . 1 1 1 A 233 233 PHE N N 233 129.256 121.486 7.770 1 1 1886 . 1 1 1 A 234 234 GLY H H 234 8.734 8.480 0.254 1 1 1887 . 1 1 1 A 234 234 GLY HA2 H 234 4.488 4.340 0.148 1 1 1888 . 1 1 1 A 234 234 GLY HA3 H 234 3.327 4.371 -1.044 1 1 1889 . 1 1 1 A 234 234 GLY CA C 234 40.377 46.348 -5.971 1 1 1890 . 1 1 1 A 234 234 GLY N N 234 105.294 109.523 -4.229 1 1 1891 . 1 1 1 A 235 235 GLU H H 235 9.198 9.067 0.131 1 1 1892 . 1 1 1 A 235 235 GLU HA H 235 4.111 4.083 0.028 1 1 1897 . 1 1 1 A 235 235 GLU CA C 235 56.466 59.588 -3.122 1 1 1898 . 1 1 1 A 235 235 GLU CB C 235 26.256 29.654 -3.398 1 1 1900 . 1 1 1 A 235 235 GLU N N 235 125.813 122.067 3.746 1 1 1901 . 1 1 1 A 236 236 LYS H H 236 8.147 7.643 0.504 1 1 1902 . 1 1 1 A 236 236 LYS HA H 236 4.373 5.004 -0.631 1 1 1905 . 1 1 1 A 236 236 LYS N N 236 117.810 114.237 3.573 1 1 1906 . 1 1 1 A 237 237 ALA H H 237 7.685 8.017 -0.332 1 1 1907 . 1 1 1 A 237 237 ALA HA H 237 3.902 4.484 -0.582 1 1 1911 . 1 1 1 A 237 237 ALA CA C 237 49.762 51.690 -1.928 1 1 1912 . 1 1 1 A 237 237 ALA CB C 237 14.720 20.177 -5.457 1 1 1913 . 1 1 1 A 237 237 ALA N N 237 118.704 122.440 -3.736 1 1 1914 . 1 1 1 A 238 238 GLN H H 238 9.312 8.406 0.906 1 1 1915 . 1 1 1 A 238 238 GLN HA H 238 4.049 4.500 -0.451 1 1 1920 . 1 1 1 A 238 238 GLN N N 238 118.059 117.521 0.538 1 1 1921 . 1 1 1 A 239 239 GLU H H 239 8.785 7.381 1.404 1 1 1922 . 1 1 1 A 239 239 GLU HA H 239 5.531 5.022 0.509 1 1 1927 . 1 1 1 A 239 239 GLU N N 239 116.914 115.796 1.118 1 1 1928 . 1 1 1 A 240 240 VAL H H 240 8.501 9.604 -1.103 1 1 1929 . 1 1 1 A 240 240 VAL HA H 240 5.655 3.977 1.678 1 1 1937 . 1 1 1 A 240 240 VAL CA C 240 55.582 59.812 -4.230 1 1 1940 . 1 1 1 A 240 240 VAL N N 240 110.588 120.100 -9.512 1 1 1941 . 1 1 1 A 241 241 ALA H H 241 8.463 8.754 -0.291 1 1 1942 . 1 1 1 A 241 241 ALA HA H 241 5.014 5.388 -0.374 1 1 1946 . 1 1 1 A 241 241 ALA CA C 241 49.361 51.370 -2.009 1 1 1947 . 1 1 1 A 241 241 ALA CB C 241 18.196 23.867 -5.671 1 1 1948 . 1 1 1 A 241 241 ALA N N 241 121.125 129.163 -8.038 1 1 1949 . 1 1 1 A 242 242 GLY H H 242 9.421 8.746 0.675 1 1 1950 . 1 1 1 A 242 242 GLY HA2 H 242 5.161 4.308 0.853 1 1 1951 . 1 1 1 A 242 242 GLY HA3 H 242 4.076 4.358 -0.282 1 1 1952 . 1 1 1 A 242 242 GLY N N 242 112.036 107.062 4.974 1 1 1953 . 1 1 1 A 243 243 SER H H 243 8.929 8.289 0.640 1 1 1954 . 1 1 1 A 243 243 SER HA H 243 5.331 4.985 0.346 1 1 1957 . 1 1 1 A 243 243 SER N N 243 116.113 116.040 0.073 1 1 1958 . 1 1 1 A 244 244 ALA H H 244 9.218 8.515 0.703 1 1 1959 . 1 1 1 A 244 244 ALA HA H 244 5.221 4.671 0.550 1 1 1963 . 1 1 1 A 244 244 ALA CA C 244 47.883 50.750 -2.867 1 1 1964 . 1 1 1 A 244 244 ALA N N 244 120.635 121.432 -0.797 1 1 1965 . 1 1 1 A 245 245 GLU H H 245 9.194 8.049 1.145 1 1 1966 . 1 1 1 A 245 245 GLU HA H 245 4.869 5.061 -0.192 1 1 1971 . 1 1 1 A 245 245 GLU N N 245 123.487 117.954 5.533 1 1 1972 . 1 1 1 A 246 246 VAL H H 246 8.531 8.838 -0.307 1 1 1973 . 1 1 1 A 246 246 VAL HA H 246 4.518 4.479 0.039 1 1 1981 . 1 1 1 A 246 246 VAL CA C 246 58.286 61.452 -3.166 1 1 1982 . 1 1 1 A 246 246 VAL N N 246 123.347 123.008 0.339 1 1 1983 . 1 1 1 A 247 247 GLU H H 247 9.132 8.610 0.522 1 1 1984 . 1 1 1 A 247 247 GLU HA H 247 4.368 4.770 -0.402 1 1 1989 . 1 1 1 A 247 247 GLU CB C 247 26.744 31.646 -4.902 1 1 1990 . 1 1 1 A 247 247 GLU N N 247 129.243 128.352 0.891 1 1 1991 . 1 1 1 A 248 248 THR H H 248 7.827 8.318 -0.491 1 1 1992 . 1 1 1 A 248 248 THR HA H 248 4.749 4.364 0.385 1 1 1997 . 1 1 1 A 248 248 THR CA C 248 56.859 62.585 -5.726 1 1 1998 . 1 1 1 A 248 248 THR CB C 248 69.171 69.230 -0.059 1 1 2000 . 1 1 1 A 248 248 THR N N 248 114.228 120.296 -6.068 1 1 2001 . 1 1 1 A 249 249 ALA H H 249 9.148 8.015 1.133 1 1 2002 . 1 1 1 A 249 249 ALA HA H 249 4.174 4.534 -0.360 1 1 2006 . 1 1 1 A 249 249 ALA CA C 249 51.970 51.600 0.370 1 1 2007 . 1 1 1 A 249 249 ALA CB C 249 15.797 20.349 -4.552 1 1 2008 . 1 1 1 A 249 249 ALA N N 249 123.341 123.950 -0.609 1 1 2009 . 1 1 1 A 250 250 ASN H H 250 7.974 7.840 0.134 1 1 2010 . 1 1 1 A 250 250 ASN HA H 250 4.953 4.962 -0.009 1 1 2015 . 1 1 1 A 250 250 ASN CA C 250 49.198 52.671 -3.473 1 1 2016 . 1 1 1 A 250 250 ASN CB C 250 35.976 40.277 -4.301 1 1 2017 . 1 1 1 A 250 250 ASN N N 250 113.358 116.014 -2.656 1 1 2019 . 1 1 1 A 251 251 GLY H H 251 7.510 7.575 -0.065 1 1 2020 . 1 1 1 A 251 251 GLY HA2 H 251 4.492 4.072 0.420 1 1 2021 . 1 1 1 A 251 251 GLY HA3 H 251 3.853 4.143 -0.290 1 1 2022 . 1 1 1 A 251 251 GLY CA C 251 41.435 45.561 -4.126 1 1 2023 . 1 1 1 A 251 251 GLY N N 251 108.692 106.827 1.865 1 1 2024 . 1 1 1 A 252 252 ILE H H 252 8.465 8.465 0.000 1 1 2025 . 1 1 1 A 252 252 ILE HA H 252 4.521 4.524 -0.003 1 1 2035 . 1 1 1 A 252 252 ILE CB C 252 35.653 41.236 -5.583 1 1 2039 . 1 1 1 A 252 252 ILE N N 252 122.043 120.760 1.283 1 1 2040 . 1 1 1 A 253 253 HIS H H 253 9.311 8.992 0.319 1 1 2041 . 1 1 1 A 253 253 HIS HA H 253 4.861 5.422 -0.561 1 1 2046 . 1 1 1 A 253 253 HIS N N 253 126.617 125.663 0.954 1 1 2047 . 1 1 1 A 254 254 HIS H H 254 8.820 8.989 -0.169 1 1 2048 . 1 1 1 A 254 254 HIS HA H 254 5.305 5.421 -0.116 1 1 2051 . 1 1 1 A 254 254 HIS CA C 254 52.781 53.502 -0.721 1 1 2052 . 1 1 1 A 254 254 HIS N N 254 122.665 117.314 5.351 1 1 2053 . 1 1 1 A 255 255 ILE H H 255 9.047 8.630 0.417 1 1 2054 . 1 1 1 A 255 255 ILE HA H 255 4.651 4.549 0.102 1 1 2061 . 1 1 1 A 255 255 ILE N N 255 123.958 120.085 3.873 1 1 2062 . 1 1 1 A 256 256 GLY H H 256 9.339 8.857 0.482 1 1 2063 . 1 1 1 A 256 256 GLY HA2 H 256 3.816 2.183 1.633 1 1 2064 . 1 1 1 A 256 256 GLY HA3 H 256 2.267 3.459 -1.192 1 1 2065 . 1 1 1 A 256 256 GLY N N 256 115.022 111.061 3.961 1 1 2066 . 1 1 1 A 257 257 LEU H H 257 7.890 9.284 -1.394 1 1 2067 . 1 1 1 A 257 257 LEU HA H 257 4.853 5.139 -0.286 1 1 2077 . 1 1 1 A 257 257 LEU N N 257 121.441 122.393 -0.952 1 1 2078 . 1 1 1 A 258 258 ALA H H 258 7.982 9.383 -1.401 1 1 2079 . 1 1 1 A 258 258 ALA HA H 258 4.668 5.117 -0.449 1 1 2083 . 1 1 1 A 258 258 ALA CA C 258 49.678 51.803 -2.125 1 1 2084 . 1 1 1 A 258 258 ALA CB C 258 19.561 20.725 -1.164 1 1 2085 . 1 1 1 A 258 258 ALA N N 258 123.234 123.029 0.205 1 1 2086 . 1 1 1 A 259 259 ALA H H 259 9.117 9.507 -0.390 1 1 2087 . 1 1 1 A 259 259 ALA HA H 259 4.790 4.677 0.113 1 1 2091 . 1 1 1 A 259 259 ALA N N 259 123.901 124.872 -0.971 1 1 2092 . 1 1 1 A 260 260 LYS H H 260 8.452 8.108 0.344 1 1 2093 . 1 1 1 A 260 260 LYS HA H 260 5.914 4.792 1.122 1 1 2098 . 1 1 1 A 260 260 LYS CA C 260 51.818 54.469 -2.651 1 1 2099 . 1 1 1 A 260 260 LYS N N 260 116.464 116.729 -0.265 1 1 1 . 2 1 1 A 9 9 SER H H 9 8.293 8.653 -0.360 1 1 2 . 2 1 1 A 9 9 SER HA H 9 4.432 5.094 -0.662 1 1 3 . 2 1 1 A 9 9 SER N N 9 116.407 114.806 1.601 1 1 4 . 2 1 1 A 10 10 GLY H H 10 8.472 8.815 -0.343 1 1 5 . 2 1 1 A 10 10 GLY N N 10 111.611 113.594 -1.983 1 1 6 . 2 1 1 A 14 14 VAL H H 14 8.009 7.838 0.171 1 1 7 . 2 1 1 A 14 14 VAL HA H 14 4.128 4.147 -0.019 1 1 15 . 2 1 1 A 14 14 VAL CA C 14 59.473 62.636 -3.163 1 1 16 . 2 1 1 A 14 14 VAL CB C 14 30.127 32.609 -2.482 1 1 17 . 2 1 1 A 14 14 VAL N N 14 119.846 122.143 -2.297 1 1 18 . 2 1 1 A 15 15 THR H H 15 8.152 8.283 -0.131 1 1 19 . 2 1 1 A 15 15 THR HA H 15 4.346 4.526 -0.180 1 1 24 . 2 1 1 A 15 15 THR N N 15 118.509 116.886 1.623 1 1 25 . 2 1 1 A 16 16 ALA H H 16 8.207 8.604 -0.397 1 1 26 . 2 1 1 A 16 16 ALA HA H 16 4.319 4.126 0.193 1 1 30 . 2 1 1 A 16 16 ALA CA C 16 49.835 53.710 -3.875 1 1 31 . 2 1 1 A 16 16 ALA CB C 16 16.714 18.438 -1.724 1 1 32 . 2 1 1 A 16 16 ALA N N 16 126.935 127.371 -0.436 1 1 33 . 2 1 1 A 17 17 ASP H H 17 8.269 7.866 0.403 1 1 34 . 2 1 1 A 17 17 ASP HA H 17 4.581 4.983 -0.402 1 1 37 . 2 1 1 A 17 17 ASP CA C 17 51.643 53.125 -1.482 1 1 38 . 2 1 1 A 17 17 ASP CB C 17 38.257 41.283 -3.026 1 1 39 . 2 1 1 A 17 17 ASP N N 17 120.379 118.249 2.130 1 1 40 . 2 1 1 A 18 18 ILE H H 18 7.979 8.480 -0.501 1 1 41 . 2 1 1 A 18 18 ILE HA H 18 4.178 3.763 0.415 1 1 48 . 2 1 1 A 18 18 ILE CA C 18 58.737 65.053 -6.316 1 1 49 . 2 1 1 A 18 18 ILE CB C 18 36.077 37.726 -1.649 1 1 53 . 2 1 1 A 18 18 ILE N N 18 121.171 122.393 -1.222 1 1 54 . 2 1 1 A 19 19 GLY H H 19 8.410 8.142 0.268 1 1 55 . 2 1 1 A 19 19 GLY HA2 H 19 4.023 3.708 0.315 1 1 56 . 2 1 1 A 19 19 GLY HA3 H 19 4.023 3.713 0.310 1 1 57 . 2 1 1 A 19 19 GLY N N 19 112.246 108.367 3.879 1 1 58 . 2 1 1 A 20 20 THR H H 20 8.005 8.309 -0.304 1 1 59 . 2 1 1 A 20 20 THR HA H 20 4.463 4.056 0.407 1 1 64 . 2 1 1 A 20 20 THR CB C 20 66.723 68.474 -1.751 1 1 66 . 2 1 1 A 20 20 THR N N 20 112.239 117.263 -5.024 1 1 67 . 2 1 1 A 21 21 GLY H H 21 8.500 9.019 -0.519 1 1 68 . 2 1 1 A 21 21 GLY HA2 H 21 4.099 3.812 0.287 1 1 69 . 2 1 1 A 21 21 GLY HA3 H 21 3.872 3.812 0.060 1 1 70 . 2 1 1 A 21 21 GLY N N 21 111.048 113.050 -2.002 1 1 71 . 2 1 1 A 22 22 LEU H H 22 7.427 7.764 -0.337 1 1 72 . 2 1 1 A 22 22 LEU HA H 22 3.884 4.022 -0.138 1 1 84 . 2 1 1 A 22 22 LEU N N 22 118.837 120.036 -1.199 1 1 85 . 2 1 1 A 23 23 ALA H H 23 7.896 7.568 0.328 1 1 86 . 2 1 1 A 23 23 ALA HA H 23 4.023 4.110 -0.087 1 1 90 . 2 1 1 A 23 23 ALA CA C 23 52.584 54.135 -1.551 1 1 91 . 2 1 1 A 23 23 ALA CB C 23 15.470 18.391 -2.921 1 1 92 . 2 1 1 A 23 23 ALA N N 23 119.194 121.526 -2.332 1 1 93 . 2 1 1 A 24 24 ASP H H 24 8.265 7.837 0.428 1 1 94 . 2 1 1 A 24 24 ASP HA H 24 4.337 4.579 -0.242 1 1 97 . 2 1 1 A 24 24 ASP CB C 24 37.029 41.229 -4.200 1 1 98 . 2 1 1 A 24 24 ASP N N 24 119.035 116.521 2.514 1 1 99 . 2 1 1 A 25 25 ALA H H 25 8.211 8.479 -0.268 1 1 100 . 2 1 1 A 25 25 ALA HA H 25 4.064 4.081 -0.017 1 1 104 . 2 1 1 A 25 25 ALA CA C 25 53.278 54.190 -0.912 1 1 105 . 2 1 1 A 25 25 ALA CB C 25 15.760 18.254 -2.494 1 1 106 . 2 1 1 A 25 25 ALA N N 25 122.434 121.372 1.062 1 1 107 . 2 1 1 A 26 26 LEU H H 26 7.334 7.577 -0.243 1 1 108 . 2 1 1 A 26 26 LEU HA H 26 4.351 4.177 0.174 1 1 117 . 2 1 1 A 26 26 LEU N N 26 114.238 116.724 -2.486 1 1 118 . 2 1 1 A 27 27 THR H H 27 7.708 7.569 0.139 1 1 119 . 2 1 1 A 27 27 THR HA H 27 4.492 4.294 0.198 1 1 124 . 2 1 1 A 27 27 THR CA C 27 59.438 62.342 -2.904 1 1 125 . 2 1 1 A 27 27 THR CB C 27 68.796 69.038 -0.242 1 1 127 . 2 1 1 A 27 27 THR N N 27 106.430 110.883 -4.453 1 1 128 . 2 1 1 A 28 28 ALA H H 28 8.906 7.017 1.889 1 1 129 . 2 1 1 A 28 28 ALA HA H 28 4.812 4.290 0.522 1 1 133 . 2 1 1 A 28 28 ALA CB C 28 16.724 19.163 -2.439 1 1 134 . 2 1 1 A 28 28 ALA N N 28 128.420 125.254 3.166 1 1 135 . 2 1 1 A 29 29 PRO CA C 29 59.166 62.708 -3.542 1 1 136 . 2 1 1 A 29 29 PRO CB C 29 29.865 31.758 -1.893 1 1 139 . 2 1 1 A 30 30 LEU H H 30 8.204 8.271 -0.067 1 1 140 . 2 1 1 A 30 30 LEU HA H 30 4.052 4.237 -0.185 1 1 150 . 2 1 1 A 30 30 LEU N N 30 121.970 124.187 -2.217 1 1 151 . 2 1 1 A 31 31 ASP H H 31 8.720 8.926 -0.206 1 1 152 . 2 1 1 A 31 31 ASP HA H 31 4.772 5.052 -0.280 1 1 155 . 2 1 1 A 31 31 ASP CA C 31 50.115 54.063 -3.948 1 1 156 . 2 1 1 A 31 31 ASP N N 31 125.105 124.546 0.559 1 1 157 . 2 1 1 A 32 32 HIS CA C 32 55.083 58.139 -3.056 1 1 158 . 2 1 1 A 32 32 HIS CB C 32 25.707 30.626 -4.919 1 1 159 . 2 1 1 A 33 33 LYS H H 33 8.589 7.693 0.896 1 1 160 . 2 1 1 A 33 33 LYS HA H 33 4.112 4.198 -0.086 1 1 167 . 2 1 1 A 33 33 LYS CB C 33 29.218 32.297 -3.079 1 1 169 . 2 1 1 A 33 33 LYS N N 33 118.920 117.221 1.699 1 1 170 . 2 1 1 A 34 34 ASP H H 34 7.420 7.127 0.293 1 1 171 . 2 1 1 A 34 34 ASP HA H 34 4.368 4.613 -0.245 1 1 174 . 2 1 1 A 34 34 ASP N N 34 120.940 119.896 1.044 1 1 175 . 2 1 1 A 35 35 LYS H H 35 8.266 8.761 -0.495 1 1 176 . 2 1 1 A 35 35 LYS HA H 35 4.169 4.079 0.090 1 1 183 . 2 1 1 A 35 35 LYS N N 35 121.280 121.586 -0.306 1 1 184 . 2 1 1 A 36 36 GLY H H 36 8.716 7.419 1.297 1 1 185 . 2 1 1 A 36 36 GLY HA2 H 36 3.822 4.011 -0.189 1 1 186 . 2 1 1 A 36 36 GLY HA3 H 36 3.618 4.040 -0.422 1 1 187 . 2 1 1 A 36 36 GLY N N 36 111.002 107.398 3.604 1 1 188 . 2 1 1 A 37 37 LEU H H 37 8.032 8.071 -0.039 1 1 189 . 2 1 1 A 37 37 LEU HA H 37 4.406 4.227 0.179 1 1 198 . 2 1 1 A 37 37 LEU N N 37 127.683 122.565 5.118 1 1 199 . 2 1 1 A 38 38 LYS H H 38 9.190 8.967 0.223 1 1 200 . 2 1 1 A 38 38 LYS HA H 38 3.925 4.566 -0.641 1 1 205 . 2 1 1 A 38 38 LYS N N 38 132.634 121.050 11.584 1 1 206 . 2 1 1 A 39 39 SER H H 39 7.161 7.706 -0.545 1 1 207 . 2 1 1 A 39 39 SER HA H 39 5.097 4.594 0.503 1 1 210 . 2 1 1 A 39 39 SER CA C 39 54.451 57.617 -3.166 1 1 211 . 2 1 1 A 39 39 SER N N 39 110.262 109.868 0.394 1 1 212 . 2 1 1 A 40 40 LEU H H 40 8.142 8.729 -0.587 1 1 213 . 2 1 1 A 40 40 LEU HA H 40 4.481 4.869 -0.388 1 1 223 . 2 1 1 A 40 40 LEU N N 40 122.761 121.121 1.640 1 1 224 . 2 1 1 A 41 41 THR H H 41 8.641 8.731 -0.090 1 1 225 . 2 1 1 A 41 41 THR HA H 41 4.141 4.825 -0.684 1 1 230 . 2 1 1 A 41 41 THR CA C 41 60.301 61.762 -1.461 1 1 231 . 2 1 1 A 41 41 THR CB C 41 65.862 69.974 -4.112 1 1 233 . 2 1 1 A 41 41 THR N N 41 124.142 120.864 3.278 1 1 234 . 2 1 1 A 42 42 LEU H H 42 8.586 9.502 -0.916 1 1 235 . 2 1 1 A 42 42 LEU HA H 42 4.337 4.478 -0.141 1 1 247 . 2 1 1 A 42 42 LEU N N 42 128.603 127.779 0.824 1 1 248 . 2 1 1 A 43 43 GLU H H 43 8.644 8.244 0.400 1 1 249 . 2 1 1 A 43 43 GLU HA H 43 4.663 4.133 0.530 1 1 253 . 2 1 1 A 43 43 GLU N N 43 124.180 124.032 0.148 1 1 254 . 2 1 1 A 44 44 ASP H H 44 10.243 8.676 1.567 1 1 255 . 2 1 1 A 44 44 ASP HA H 44 4.518 4.669 -0.151 1 1 258 . 2 1 1 A 44 44 ASP CA C 44 52.879 52.847 0.032 1 1 259 . 2 1 1 A 44 44 ASP CB C 44 37.711 38.980 -1.269 1 1 260 . 2 1 1 A 44 44 ASP N N 44 124.177 125.638 -1.461 1 1 261 . 2 1 1 A 45 45 SER H H 45 8.546 9.539 -0.993 1 1 262 . 2 1 1 A 45 45 SER HA H 45 3.850 4.020 -0.170 1 1 265 . 2 1 1 A 45 45 SER CA C 45 59.588 61.628 -2.040 1 1 266 . 2 1 1 A 45 45 SER CB C 45 61.660 63.027 -1.367 1 1 267 . 2 1 1 A 45 45 SER N N 45 116.191 118.694 -2.503 1 1 268 . 2 1 1 A 46 46 ILE H H 46 6.902 7.600 -0.698 1 1 269 . 2 1 1 A 46 46 ILE HA H 46 3.874 4.598 -0.724 1 1 279 . 2 1 1 A 46 46 ILE CA C 46 57.605 60.370 -2.765 1 1 280 . 2 1 1 A 46 46 ILE CB C 46 36.694 39.134 -2.440 1 1 283 . 2 1 1 A 46 46 ILE N N 46 116.189 119.306 -3.117 1 1 284 . 2 1 1 A 47 47 SER H H 47 7.804 8.435 -0.631 1 1 285 . 2 1 1 A 47 47 SER HA H 47 4.342 4.846 -0.504 1 1 288 . 2 1 1 A 47 47 SER CA C 47 55.995 57.069 -1.074 1 1 289 . 2 1 1 A 47 47 SER N N 47 118.738 118.407 0.331 1 1 290 . 2 1 1 A 48 48 GLN H H 48 8.522 8.668 -0.146 1 1 291 . 2 1 1 A 48 48 GLN HA H 48 3.939 4.125 -0.186 1 1 296 . 2 1 1 A 48 48 GLN CA C 48 55.111 58.153 -3.042 1 1 298 . 2 1 1 A 48 48 GLN N N 48 119.475 121.635 -2.160 1 1 299 . 2 1 1 A 49 49 ASN H H 49 8.437 8.167 0.270 1 1 300 . 2 1 1 A 49 49 ASN HA H 49 4.693 4.739 -0.046 1 1 305 . 2 1 1 A 49 49 ASN CA C 49 50.839 52.168 -1.329 1 1 306 . 2 1 1 A 49 49 ASN CB C 49 35.767 38.091 -2.324 1 1 307 . 2 1 1 A 49 49 ASN N N 49 117.233 114.197 3.036 1 1 309 . 2 1 1 A 50 50 GLY H H 50 7.952 7.387 0.565 1 1 310 . 2 1 1 A 50 50 GLY HA2 H 50 4.518 4.123 0.395 1 1 311 . 2 1 1 A 50 50 GLY HA3 H 50 4.054 4.131 -0.077 1 1 312 . 2 1 1 A 50 50 GLY CA C 50 41.883 45.488 -3.605 1 1 313 . 2 1 1 A 50 50 GLY N N 50 108.751 107.864 0.887 1 1 314 . 2 1 1 A 51 51 THR H H 51 8.548 8.609 -0.061 1 1 315 . 2 1 1 A 51 51 THR HA H 51 5.012 5.418 -0.406 1 1 320 . 2 1 1 A 51 51 THR CA C 51 57.026 59.918 -2.892 1 1 321 . 2 1 1 A 51 51 THR CB C 51 69.887 70.727 -0.840 1 1 323 . 2 1 1 A 51 51 THR N N 51 108.710 116.508 -7.798 1 1 324 . 2 1 1 A 52 52 LEU H H 52 9.110 8.658 0.452 1 1 325 . 2 1 1 A 52 52 LEU HA H 52 5.183 5.748 -0.565 1 1 333 . 2 1 1 A 52 52 LEU CA C 52 50.822 53.876 -3.054 1 1 335 . 2 1 1 A 52 52 LEU N N 52 124.606 122.537 2.069 1 1 336 . 2 1 1 A 53 53 THR H H 53 9.312 8.609 0.703 1 1 337 . 2 1 1 A 53 53 THR HA H 53 5.288 5.240 0.048 1 1 342 . 2 1 1 A 53 53 THR CA C 53 59.535 60.984 -1.449 1 1 343 . 2 1 1 A 53 53 THR CB C 53 66.838 72.280 -5.442 1 1 345 . 2 1 1 A 53 53 THR N N 53 125.445 115.346 10.099 1 1 346 . 2 1 1 A 54 54 LEU H H 54 8.992 9.100 -0.108 1 1 347 . 2 1 1 A 54 54 LEU HA H 54 5.563 5.613 -0.050 1 1 357 . 2 1 1 A 54 54 LEU N N 54 128.814 119.855 8.959 1 1 358 . 2 1 1 A 55 55 SER H H 55 9.017 8.830 0.187 1 1 359 . 2 1 1 A 55 55 SER HA H 55 5.476 5.269 0.207 1 1 362 . 2 1 1 A 55 55 SER CA C 55 53.944 56.170 -2.226 1 1 363 . 2 1 1 A 55 55 SER CB C 55 63.384 66.205 -2.821 1 1 364 . 2 1 1 A 55 55 SER N N 55 112.964 117.370 -4.406 1 1 365 . 2 1 1 A 56 56 ALA H H 56 8.324 9.765 -1.441 1 1 366 . 2 1 1 A 56 56 ALA HA H 56 4.605 4.715 -0.110 1 1 370 . 2 1 1 A 56 56 ALA CA C 56 50.743 50.178 0.565 1 1 371 . 2 1 1 A 56 56 ALA CB C 56 21.372 21.781 -0.409 1 1 372 . 2 1 1 A 56 56 ALA N N 56 123.555 125.762 -2.207 1 1 373 . 2 1 1 A 57 57 GLN H H 57 9.080 8.601 0.479 1 1 374 . 2 1 1 A 57 57 GLN HA H 57 3.884 4.496 -0.612 1 1 381 . 2 1 1 A 57 57 GLN CA C 57 53.331 55.960 -2.629 1 1 382 . 2 1 1 A 57 57 GLN CB C 57 24.659 27.605 -2.946 1 1 384 . 2 1 1 A 57 57 GLN N N 57 116.815 114.535 2.280 1 1 386 . 2 1 1 A 58 58 GLY H H 58 8.527 7.965 0.562 1 1 387 . 2 1 1 A 58 58 GLY HA2 H 58 4.168 4.044 0.124 1 1 388 . 2 1 1 A 58 58 GLY HA3 H 58 3.608 4.048 -0.440 1 1 389 . 2 1 1 A 58 58 GLY CA C 58 42.856 45.583 -2.727 1 1 390 . 2 1 1 A 58 58 GLY N N 58 105.983 107.518 -1.535 1 1 391 . 2 1 1 A 59 59 ALA H H 59 8.203 7.677 0.526 1 1 392 . 2 1 1 A 59 59 ALA HA H 59 4.811 4.580 0.231 1 1 396 . 2 1 1 A 59 59 ALA CA C 59 47.662 51.416 -3.754 1 1 397 . 2 1 1 A 59 59 ALA CB C 59 20.147 22.756 -2.609 1 1 398 . 2 1 1 A 59 59 ALA N N 59 125.153 121.425 3.728 1 1 399 . 2 1 1 A 60 60 GLU H H 60 8.154 8.882 -0.728 1 1 400 . 2 1 1 A 60 60 GLU HA H 60 5.508 5.350 0.158 1 1 404 . 2 1 1 A 60 60 GLU CA C 60 52.179 54.237 -2.058 1 1 405 . 2 1 1 A 60 60 GLU CB C 60 30.203 34.216 -4.013 1 1 406 . 2 1 1 A 60 60 GLU N N 60 117.318 116.146 1.172 1 1 407 . 2 1 1 A 61 61 LYS H H 61 8.821 9.360 -0.539 1 1 408 . 2 1 1 A 61 61 LYS HA H 61 4.311 4.930 -0.619 1 1 413 . 2 1 1 A 61 61 LYS N N 61 123.743 120.594 3.149 1 1 414 . 2 1 1 A 62 62 THR H H 62 8.149 8.788 -0.639 1 1 415 . 2 1 1 A 62 62 THR HA H 62 4.928 4.714 0.214 1 1 420 . 2 1 1 A 62 62 THR CA C 62 59.427 60.804 -1.377 1 1 421 . 2 1 1 A 62 62 THR CB C 62 66.932 69.273 -2.341 1 1 422 . 2 1 1 A 62 62 THR N N 62 122.829 119.601 3.228 1 1 423 . 2 1 1 A 63 63 TYR H H 63 9.466 9.177 0.289 1 1 424 . 2 1 1 A 63 63 TYR HA H 63 4.606 5.145 -0.539 1 1 431 . 2 1 1 A 63 63 TYR CA C 63 54.508 56.426 -1.918 1 1 432 . 2 1 1 A 63 63 TYR N N 63 127.472 128.773 -1.301 1 1 433 . 2 1 1 A 64 64 GLY H H 64 9.253 8.198 1.055 1 1 434 . 2 1 1 A 64 64 GLY HA2 H 64 4.670 4.202 0.468 1 1 435 . 2 1 1 A 64 64 GLY HA3 H 64 3.619 4.210 -0.591 1 1 436 . 2 1 1 A 64 64 GLY CA C 64 39.885 45.298 -5.413 1 1 437 . 2 1 1 A 64 64 GLY N N 64 110.182 109.010 1.172 1 1 438 . 2 1 1 A 65 65 ASN H H 65 8.616 8.398 0.218 1 1 439 . 2 1 1 A 65 65 ASN HA H 65 4.109 4.463 -0.354 1 1 444 . 2 1 1 A 65 65 ASN CA C 65 53.691 54.827 -1.136 1 1 445 . 2 1 1 A 65 65 ASN N N 65 117.778 122.866 -5.088 1 1 447 . 2 1 1 A 66 66 GLY H H 66 9.053 8.822 0.231 1 1 448 . 2 1 1 A 66 66 GLY HA2 H 66 4.344 3.925 0.419 1 1 449 . 2 1 1 A 66 66 GLY HA3 H 66 3.359 3.929 -0.570 1 1 450 . 2 1 1 A 66 66 GLY CA C 66 42.431 44.883 -2.452 1 1 451 . 2 1 1 A 66 66 GLY N N 66 115.232 114.628 0.604 1 1 452 . 2 1 1 A 67 67 ASP H H 67 8.120 8.302 -0.182 1 1 453 . 2 1 1 A 67 67 ASP HA H 67 4.844 3.976 0.868 1 1 456 . 2 1 1 A 67 67 ASP N N 67 122.593 121.769 0.824 1 1 457 . 2 1 1 A 68 68 SER H H 68 8.500 8.525 -0.025 1 1 458 . 2 1 1 A 68 68 SER HA H 68 5.088 4.974 0.114 1 1 461 . 2 1 1 A 68 68 SER CA C 68 54.858 58.136 -3.278 1 1 462 . 2 1 1 A 68 68 SER CB C 68 62.114 64.466 -2.352 1 1 463 . 2 1 1 A 68 68 SER N N 68 113.557 121.350 -7.793 1 1 464 . 2 1 1 A 69 69 LEU H H 69 8.989 9.218 -0.229 1 1 465 . 2 1 1 A 69 69 LEU HA H 69 4.570 4.942 -0.372 1 1 474 . 2 1 1 A 69 69 LEU N N 69 126.836 127.402 -0.566 1 1 475 . 2 1 1 A 70 70 ASN H H 70 8.491 8.954 -0.463 1 1 476 . 2 1 1 A 70 70 ASN HA H 70 4.958 5.040 -0.082 1 1 479 . 2 1 1 A 70 70 ASN CB C 70 33.265 39.261 -5.996 1 1 480 . 2 1 1 A 70 70 ASN N N 70 126.343 124.598 1.745 1 1 481 . 2 1 1 A 71 71 THR H H 71 7.831 8.397 -0.566 1 1 482 . 2 1 1 A 71 71 THR HA H 71 3.759 4.745 -0.986 1 1 487 . 2 1 1 A 71 71 THR CA C 71 61.005 60.107 0.898 1 1 488 . 2 1 1 A 71 71 THR N N 71 114.742 114.483 0.259 1 1 489 . 2 1 1 A 72 72 GLY H H 72 8.880 8.460 0.420 1 1 490 . 2 1 1 A 72 72 GLY HA2 H 72 3.907 3.917 -0.010 1 1 491 . 2 1 1 A 72 72 GLY HA3 H 72 3.907 3.919 -0.012 1 1 492 . 2 1 1 A 72 72 GLY N N 72 114.976 110.623 4.353 1 1 493 . 2 1 1 A 73 73 LYS H H 73 6.604 7.703 -1.099 1 1 494 . 2 1 1 A 73 73 LYS HA H 73 4.160 4.372 -0.212 1 1 501 . 2 1 1 A 73 73 LYS N N 73 113.898 118.239 -4.341 1 1 502 . 2 1 1 A 74 74 LEU H H 74 7.422 7.555 -0.133 1 1 503 . 2 1 1 A 74 74 LEU HA H 74 4.358 4.244 0.114 1 1 513 . 2 1 1 A 74 74 LEU N N 74 117.180 121.394 -4.214 1 1 514 . 2 1 1 A 75 75 LYS H H 75 8.617 8.665 -0.048 1 1 515 . 2 1 1 A 75 75 LYS HA H 75 4.079 4.463 -0.384 1 1 518 . 2 1 1 A 75 75 LYS N N 75 121.119 122.003 -0.884 1 1 519 . 2 1 1 A 76 76 ASN H H 76 8.154 8.337 -0.183 1 1 520 . 2 1 1 A 76 76 ASN HA H 76 3.935 5.003 -1.068 1 1 525 . 2 1 1 A 76 76 ASN CB C 76 35.772 40.282 -4.510 1 1 526 . 2 1 1 A 76 76 ASN N N 76 122.761 120.358 2.403 1 1 527 . 2 1 1 A 77 77 ASP H H 77 9.227 7.811 1.416 1 1 528 . 2 1 1 A 77 77 ASP HA H 77 3.787 5.106 -1.319 1 1 531 . 2 1 1 A 77 77 ASP CA C 77 52.584 53.284 -0.700 1 1 532 . 2 1 1 A 77 77 ASP N N 77 114.129 119.010 -4.881 1 1 533 . 2 1 1 A 78 78 LYS H H 78 6.579 7.890 -1.311 1 1 534 . 2 1 1 A 78 78 LYS HA H 78 4.572 4.729 -0.157 1 1 539 . 2 1 1 A 78 78 LYS CA C 78 51.072 55.072 -4.000 1 1 540 . 2 1 1 A 78 78 LYS CB C 78 33.783 37.011 -3.228 1 1 541 . 2 1 1 A 78 78 LYS N N 78 114.135 119.976 -5.841 1 1 542 . 2 1 1 A 79 79 VAL H H 79 8.729 8.414 0.315 1 1 543 . 2 1 1 A 79 79 VAL HA H 79 4.402 4.937 -0.535 1 1 551 . 2 1 1 A 79 79 VAL CA C 79 59.240 60.110 -0.870 1 1 553 . 2 1 1 A 79 79 VAL N N 79 123.191 120.791 2.400 1 1 554 . 2 1 1 A 80 80 SER H H 80 9.542 9.546 -0.004 1 1 555 . 2 1 1 A 80 80 SER HA H 80 4.636 4.994 -0.358 1 1 558 . 2 1 1 A 80 80 SER CA C 80 55.978 57.395 -1.417 1 1 559 . 2 1 1 A 80 80 SER N N 80 127.445 120.619 6.826 1 1 560 . 2 1 1 A 81 81 ARG H H 81 8.093 8.838 -0.745 1 1 561 . 2 1 1 A 81 81 ARG HA H 81 5.210 5.507 -0.297 1 1 569 . 2 1 1 A 81 81 ARG N N 81 123.743 126.929 -3.186 1 1 571 . 2 1 1 A 82 82 PHE H H 82 9.312 8.186 1.126 1 1 572 . 2 1 1 A 82 82 PHE HA H 82 4.951 5.287 -0.336 1 1 577 . 2 1 1 A 82 82 PHE CA C 82 53.090 55.691 -2.601 1 1 578 . 2 1 1 A 82 82 PHE N N 82 119.529 119.514 0.015 1 1 579 . 2 1 1 A 83 83 ASP H H 83 9.122 8.855 0.267 1 1 580 . 2 1 1 A 83 83 ASP HA H 83 5.593 5.258 0.335 1 1 583 . 2 1 1 A 83 83 ASP N N 83 123.825 119.581 4.244 1 1 584 . 2 1 1 A 84 84 PHE H H 84 9.090 8.109 0.981 1 1 585 . 2 1 1 A 84 84 PHE HA H 84 6.410 6.128 0.282 1 1 592 . 2 1 1 A 84 84 PHE CA C 84 52.584 55.854 -3.270 1 1 593 . 2 1 1 A 84 84 PHE N N 84 118.862 116.928 1.934 1 1 594 . 2 1 1 A 85 85 ILE H H 85 8.441 9.060 -0.619 1 1 595 . 2 1 1 A 85 85 ILE HA H 85 4.662 4.917 -0.255 1 1 605 . 2 1 1 A 85 85 ILE CB C 85 39.939 41.205 -1.266 1 1 608 . 2 1 1 A 85 85 ILE N N 85 118.049 120.708 -2.659 1 1 609 . 2 1 1 A 86 86 ARG H H 86 8.983 8.646 0.337 1 1 610 . 2 1 1 A 86 86 ARG HA H 86 5.591 4.719 0.872 1 1 616 . 2 1 1 A 86 86 ARG N N 86 127.006 128.000 -0.994 1 1 618 . 2 1 1 A 87 87 GLN H H 87 8.643 9.020 -0.377 1 1 619 . 2 1 1 A 87 87 GLN HA H 87 5.630 5.063 0.567 1 1 626 . 2 1 1 A 87 87 GLN CA C 87 51.512 54.328 -2.816 1 1 627 . 2 1 1 A 87 87 GLN N N 87 124.142 123.455 0.687 1 1 629 . 2 1 1 A 88 88 ILE H H 88 8.617 8.962 -0.345 1 1 630 . 2 1 1 A 88 88 ILE HA H 88 4.690 4.803 -0.113 1 1 637 . 2 1 1 A 88 88 ILE CA C 88 56.995 60.677 -3.682 1 1 638 . 2 1 1 A 88 88 ILE CB C 88 39.927 40.214 -0.287 1 1 641 . 2 1 1 A 88 88 ILE N N 88 116.353 122.827 -6.474 1 1 642 . 2 1 1 A 89 89 GLU H H 89 8.298 9.004 -0.706 1 1 643 . 2 1 1 A 89 89 GLU HA H 89 5.100 5.798 -0.698 1 1 646 . 2 1 1 A 89 89 GLU CA C 89 52.204 54.992 -2.788 1 1 647 . 2 1 1 A 89 89 GLU CB C 89 27.325 33.269 -5.944 1 1 648 . 2 1 1 A 89 89 GLU N N 89 124.458 129.346 -4.888 1 1 649 . 2 1 1 A 90 90 VAL H H 90 8.957 8.870 0.087 1 1 650 . 2 1 1 A 90 90 VAL HA H 90 4.169 4.591 -0.422 1 1 658 . 2 1 1 A 90 90 VAL CA C 90 58.664 60.089 -1.425 1 1 659 . 2 1 1 A 90 90 VAL CB C 90 31.861 33.136 -1.275 1 1 660 . 2 1 1 A 90 90 VAL N N 90 127.580 126.853 0.727 1 1 661 . 2 1 1 A 91 91 ASP H H 91 9.369 8.573 0.796 1 1 662 . 2 1 1 A 91 91 ASP HA H 91 4.287 4.590 -0.303 1 1 665 . 2 1 1 A 91 91 ASP CA C 91 52.389 54.800 -2.411 1 1 666 . 2 1 1 A 91 91 ASP CB C 91 36.409 40.414 -4.005 1 1 667 . 2 1 1 A 91 91 ASP N N 91 129.411 123.746 5.665 1 1 668 . 2 1 1 A 92 92 GLY H H 92 8.552 7.442 1.110 1 1 669 . 2 1 1 A 92 92 GLY HA2 H 92 4.090 4.096 -0.006 1 1 670 . 2 1 1 A 92 92 GLY HA3 H 92 3.618 4.097 -0.479 1 1 671 . 2 1 1 A 92 92 GLY CA C 92 42.836 45.595 -2.759 1 1 672 . 2 1 1 A 92 92 GLY N N 92 103.862 105.537 -1.675 1 1 673 . 2 1 1 A 93 93 GLN H H 93 7.808 7.590 0.218 1 1 674 . 2 1 1 A 93 93 GLN HA H 93 4.578 4.823 -0.245 1 1 679 . 2 1 1 A 93 93 GLN CA C 93 50.918 54.315 -3.397 1 1 680 . 2 1 1 A 93 93 GLN CB C 93 28.602 31.171 -2.569 1 1 682 . 2 1 1 A 93 93 GLN N N 93 120.412 118.750 1.662 1 1 683 . 2 1 1 A 94 94 LEU H H 94 8.414 8.506 -0.092 1 1 684 . 2 1 1 A 94 94 LEU HA H 94 4.704 4.290 0.414 1 1 693 . 2 1 1 A 94 94 LEU CB C 94 39.873 42.412 -2.539 1 1 696 . 2 1 1 A 94 94 LEU N N 94 125.061 122.386 2.675 1 1 697 . 2 1 1 A 95 95 ILE H H 95 9.181 8.487 0.694 1 1 698 . 2 1 1 A 95 95 ILE HA H 95 4.371 4.440 -0.069 1 1 708 . 2 1 1 A 95 95 ILE CA C 95 63.319 61.006 2.313 1 1 709 . 2 1 1 A 95 95 ILE CB C 95 37.407 39.441 -2.034 1 1 711 . 2 1 1 A 95 95 ILE N N 95 127.724 121.516 6.208 1 1 712 . 2 1 1 A 96 96 THR H H 96 8.730 7.127 1.603 1 1 713 . 2 1 1 A 96 96 THR HA H 96 4.411 4.332 0.079 1 1 718 . 2 1 1 A 96 96 THR CA C 96 60.344 63.201 -2.857 1 1 719 . 2 1 1 A 96 96 THR CB C 96 59.719 69.903 -10.184 1 1 720 . 2 1 1 A 96 96 THR N N 96 124.240 118.873 5.367 1 1 721 . 2 1 1 A 97 97 LEU H H 97 8.790 8.809 -0.019 1 1 722 . 2 1 1 A 97 97 LEU HA H 97 4.400 5.029 -0.629 1 1 732 . 2 1 1 A 97 97 LEU N N 97 126.147 124.880 1.267 1 1 733 . 2 1 1 A 98 98 GLU H H 98 7.596 8.543 -0.947 1 1 734 . 2 1 1 A 98 98 GLU HA H 98 5.102 5.095 0.007 1 1 739 . 2 1 1 A 98 98 GLU N N 98 116.937 123.329 -6.392 1 1 740 . 2 1 1 A 99 99 SER H H 99 8.906 9.004 -0.098 1 1 741 . 2 1 1 A 99 99 SER HA H 99 4.504 5.492 -0.988 1 1 744 . 2 1 1 A 99 99 SER CA C 99 54.010 56.261 -2.251 1 1 745 . 2 1 1 A 99 99 SER CB C 99 63.876 66.224 -2.348 1 1 746 . 2 1 1 A 99 99 SER N N 99 117.823 119.961 -2.138 1 1 747 . 2 1 1 A 100 100 GLY H H 100 7.250 8.037 -0.787 1 1 748 . 2 1 1 A 100 100 GLY HA2 H 100 4.872 4.093 0.779 1 1 749 . 2 1 1 A 100 100 GLY HA3 H 100 3.731 4.107 -0.376 1 1 750 . 2 1 1 A 100 100 GLY N N 100 109.436 109.879 -0.443 1 1 751 . 2 1 1 A 101 101 GLU H H 101 9.661 8.875 0.786 1 1 752 . 2 1 1 A 101 101 GLU HA H 101 5.643 4.623 1.020 1 1 757 . 2 1 1 A 101 101 GLU CA C 101 52.584 54.354 -1.770 1 1 758 . 2 1 1 A 101 101 GLU CB C 101 31.750 32.920 -1.170 1 1 759 . 2 1 1 A 101 101 GLU N N 101 126.793 119.611 7.182 1 1 760 . 2 1 1 A 102 102 PHE H H 102 10.441 9.341 1.100 1 1 761 . 2 1 1 A 102 102 PHE HA H 102 5.248 5.324 -0.076 1 1 768 . 2 1 1 A 102 102 PHE CA C 102 53.537 56.082 -2.545 1 1 769 . 2 1 1 A 102 102 PHE N N 102 131.837 121.591 10.246 1 1 770 . 2 1 1 A 103 103 GLN H H 103 9.135 9.231 -0.096 1 1 771 . 2 1 1 A 103 103 GLN HA H 103 5.205 4.893 0.312 1 1 776 . 2 1 1 A 103 103 GLN CA C 103 50.925 54.907 -3.982 1 1 777 . 2 1 1 A 103 103 GLN N N 103 127.720 126.096 1.624 1 1 778 . 2 1 1 A 104 104 VAL H H 104 8.937 9.167 -0.230 1 1 779 . 2 1 1 A 104 104 VAL HA H 104 4.780 4.924 -0.144 1 1 787 . 2 1 1 A 104 104 VAL CA C 104 57.086 61.369 -4.283 1 1 789 . 2 1 1 A 104 104 VAL N N 104 120.097 126.679 -6.582 1 1 790 . 2 1 1 A 105 105 TYR H H 105 9.108 10.042 -0.934 1 1 791 . 2 1 1 A 105 105 TYR HA H 105 4.834 5.407 -0.573 1 1 798 . 2 1 1 A 105 105 TYR CA C 105 54.486 56.174 -1.688 1 1 799 . 2 1 1 A 105 105 TYR N N 105 128.426 129.191 -0.765 1 1 800 . 2 1 1 A 106 106 LYS H H 106 5.945 9.328 -3.383 1 1 805 . 2 1 1 A 106 106 LYS N N 106 129.163 129.884 -0.721 1 1 806 . 2 1 1 A 107 107 GLN H H 107 8.526 8.296 0.230 1 1 807 . 2 1 1 A 107 107 GLN HA H 107 5.160 4.817 0.343 1 1 812 . 2 1 1 A 107 107 GLN CA C 107 52.584 53.834 -1.250 1 1 813 . 2 1 1 A 107 107 GLN CB C 107 26.175 29.562 -3.387 1 1 814 . 2 1 1 A 107 107 GLN N N 107 125.978 125.913 0.065 1 1 815 . 2 1 1 A 108 108 SER H H 108 8.621 8.624 -0.003 1 1 816 . 2 1 1 A 108 108 SER HA H 108 4.403 4.133 0.270 1 1 819 . 2 1 1 A 108 108 SER CA C 108 58.521 60.993 -2.472 1 1 820 . 2 1 1 A 108 108 SER CB C 108 60.737 63.278 -2.541 1 1 821 . 2 1 1 A 108 108 SER N N 108 117.542 113.487 4.055 1 1 822 . 2 1 1 A 109 109 HIS H H 109 10.381 8.119 2.262 1 1 823 . 2 1 1 A 109 109 HIS HA H 109 4.594 4.488 0.106 1 1 828 . 2 1 1 A 109 109 HIS CA C 109 51.743 57.967 -6.224 1 1 829 . 2 1 1 A 109 109 HIS CB C 109 27.174 30.390 -3.216 1 1 830 . 2 1 1 A 109 109 HIS N N 109 118.449 120.014 -1.565 1 1 831 . 2 1 1 A 110 110 SER H H 110 7.366 7.919 -0.553 1 1 832 . 2 1 1 A 110 110 SER HA H 110 4.870 4.844 0.026 1 1 835 . 2 1 1 A 110 110 SER CB C 110 62.986 65.220 -2.234 1 1 836 . 2 1 1 A 110 110 SER N N 110 113.397 113.724 -0.327 1 1 837 . 2 1 1 A 111 111 ALA H H 111 8.541 8.414 0.127 1 1 838 . 2 1 1 A 111 111 ALA HA H 111 4.826 4.918 -0.092 1 1 842 . 2 1 1 A 111 111 ALA CA C 111 49.015 51.647 -2.632 1 1 843 . 2 1 1 A 111 111 ALA CB C 111 20.256 22.864 -2.608 1 1 844 . 2 1 1 A 111 111 ALA N N 111 117.786 123.282 -5.496 1 1 845 . 2 1 1 A 112 112 LEU H H 112 8.529 9.554 -1.025 1 1 846 . 2 1 1 A 112 112 LEU HA H 112 5.680 5.227 0.453 1 1 855 . 2 1 1 A 112 112 LEU CA C 112 51.818 53.564 -1.746 1 1 856 . 2 1 1 A 112 112 LEU N N 112 116.345 115.236 1.109 1 1 857 . 2 1 1 A 113 113 THR H H 113 8.758 8.744 0.014 1 1 858 . 2 1 1 A 113 113 THR HA H 113 5.563 5.418 0.145 1 1 863 . 2 1 1 A 113 113 THR CA C 113 54.458 60.572 -6.114 1 1 864 . 2 1 1 A 113 113 THR CB C 113 68.586 72.354 -3.768 1 1 866 . 2 1 1 A 113 113 THR N N 113 110.469 118.786 -8.317 1 1 867 . 2 1 1 A 114 114 ALA H H 114 8.829 8.821 0.008 1 1 868 . 2 1 1 A 114 114 ALA HA H 114 4.466 4.788 -0.322 1 1 872 . 2 1 1 A 114 114 ALA CA C 114 48.886 51.751 -2.865 1 1 873 . 2 1 1 A 114 114 ALA CB C 114 21.583 22.039 -0.456 1 1 874 . 2 1 1 A 114 114 ALA N N 114 121.456 123.808 -2.352 1 1 875 . 2 1 1 A 115 115 LEU H H 115 8.407 8.425 -0.018 1 1 876 . 2 1 1 A 115 115 LEU HA H 115 4.814 4.854 -0.040 1 1 886 . 2 1 1 A 115 115 LEU N N 115 119.223 119.528 -0.305 1 1 887 . 2 1 1 A 116 116 GLN H H 116 9.720 9.093 0.627 1 1 888 . 2 1 1 A 116 116 GLN HA H 116 5.312 5.379 -0.067 1 1 893 . 2 1 1 A 116 116 GLN CA C 116 50.544 54.212 -3.668 1 1 894 . 2 1 1 A 116 116 GLN N N 116 127.827 120.248 7.579 1 1 895 . 2 1 1 A 117 117 THR H H 117 9.663 9.279 0.384 1 1 896 . 2 1 1 A 117 117 THR HA H 117 4.198 5.030 -0.832 1 1 901 . 2 1 1 A 117 117 THR CA C 117 64.037 60.744 3.293 1 1 902 . 2 1 1 A 117 117 THR CB C 117 66.868 72.477 -5.609 1 1 904 . 2 1 1 A 117 117 THR N N 117 128.929 119.532 9.397 1 1 905 . 2 1 1 A 118 118 GLU H H 118 9.486 9.146 0.340 1 1 906 . 2 1 1 A 118 118 GLU HA H 118 4.885 4.681 0.204 1 1 911 . 2 1 1 A 118 118 GLU N N 118 123.497 121.614 1.883 1 1 912 . 2 1 1 A 119 119 GLN H H 119 8.076 7.386 0.690 1 1 913 . 2 1 1 A 119 119 GLN HA H 119 5.331 4.906 0.425 1 1 916 . 2 1 1 A 119 119 GLN CA C 119 51.858 54.019 -2.161 1 1 917 . 2 1 1 A 119 119 GLN N N 119 118.023 119.515 -1.492 1 1 918 . 2 1 1 A 120 120 GLU H H 120 9.078 8.665 0.413 1 1 919 . 2 1 1 A 120 120 GLU HA H 120 5.071 4.893 0.178 1 1 924 . 2 1 1 A 120 120 GLU N N 120 118.433 123.668 -5.235 1 1 925 . 2 1 1 A 121 121 GLN H H 121 7.711 8.783 -1.072 1 1 926 . 2 1 1 A 121 121 GLN HA H 121 4.430 5.126 -0.696 1 1 933 . 2 1 1 A 121 121 GLN CA C 121 53.996 54.001 -0.005 1 1 934 . 2 1 1 A 121 121 GLN CB C 121 27.158 32.308 -5.150 1 1 936 . 2 1 1 A 121 121 GLN N N 121 122.412 118.057 4.355 1 1 938 . 2 1 1 A 122 122 ASP H H 122 8.675 8.751 -0.076 1 1 939 . 2 1 1 A 122 122 ASP HA H 122 4.632 5.046 -0.414 1 1 942 . 2 1 1 A 122 122 ASP CA C 122 48.797 51.828 -3.031 1 1 943 . 2 1 1 A 122 122 ASP CB C 122 39.852 43.400 -3.548 1 1 944 . 2 1 1 A 122 122 ASP N N 122 128.625 122.978 5.647 1 1 945 . 2 1 1 A 123 123 PRO CA C 123 61.579 65.702 -4.123 1 1 946 . 2 1 1 A 123 123 PRO CB C 123 29.597 31.487 -1.890 1 1 948 . 2 1 1 A 124 124 GLU H H 124 8.297 8.722 -0.425 1 1 949 . 2 1 1 A 124 124 GLU HA H 124 4.196 3.809 0.387 1 1 954 . 2 1 1 A 124 124 GLU CA C 124 53.025 59.388 -6.363 1 1 955 . 2 1 1 A 124 124 GLU CB C 124 27.927 29.550 -1.623 1 1 957 . 2 1 1 A 124 124 GLU N N 124 115.538 117.611 -2.073 1 1 958 . 2 1 1 A 125 125 HIS H H 125 7.419 8.029 -0.610 1 1 959 . 2 1 1 A 125 125 HIS HA H 125 4.833 4.975 -0.142 1 1 964 . 2 1 1 A 125 125 HIS CA C 125 51.886 54.159 -2.273 1 1 965 . 2 1 1 A 125 125 HIS CB C 125 26.387 29.310 -2.923 1 1 966 . 2 1 1 A 125 125 HIS N N 125 117.464 116.651 0.813 1 1 967 . 2 1 1 A 126 126 SER H H 126 8.441 8.426 0.015 1 1 968 . 2 1 1 A 126 126 SER HA H 126 4.261 4.827 -0.566 1 1 971 . 2 1 1 A 126 126 SER CA C 126 57.988 61.937 -3.949 1 1 972 . 2 1 1 A 126 126 SER N N 126 117.954 117.476 0.478 1 1 973 . 2 1 1 A 127 127 GLU H H 127 9.221 8.412 0.809 1 1 974 . 2 1 1 A 127 127 GLU HA H 127 4.366 4.233 0.133 1 1 979 . 2 1 1 A 127 127 GLU CA C 127 53.707 56.681 -2.974 1 1 980 . 2 1 1 A 127 127 GLU CB C 127 25.492 29.005 -3.513 1 1 981 . 2 1 1 A 127 127 GLU N N 127 120.404 117.798 2.606 1 1 982 . 2 1 1 A 128 128 LYS H H 128 8.262 9.391 -1.129 1 1 983 . 2 1 1 A 128 128 LYS HA H 128 4.661 4.474 0.187 1 1 990 . 2 1 1 A 128 128 LYS CA C 128 52.264 55.823 -3.559 1 1 991 . 2 1 1 A 128 128 LYS CB C 128 32.404 33.895 -1.491 1 1 994 . 2 1 1 A 128 128 LYS N N 128 122.166 121.296 0.870 1 1 995 . 2 1 1 A 129 129 MET H H 129 8.242 8.502 -0.260 1 1 996 . 2 1 1 A 129 129 MET HA H 129 5.012 5.636 -0.624 1 1 1001 . 2 1 1 A 129 129 MET CA C 129 50.958 53.943 -2.985 1 1 1003 . 2 1 1 A 129 129 MET N N 129 119.422 117.649 1.773 1 1 1004 . 2 1 1 A 130 130 VAL H H 130 9.200 8.683 0.517 1 1 1005 . 2 1 1 A 130 130 VAL HA H 130 4.609 4.942 -0.333 1 1 1013 . 2 1 1 A 130 130 VAL CA C 130 56.296 60.275 -3.979 1 1 1014 . 2 1 1 A 130 130 VAL CB C 130 32.606 35.200 -2.594 1 1 1015 . 2 1 1 A 130 130 VAL N N 130 118.290 119.791 -1.501 1 1 1016 . 2 1 1 A 131 131 ALA H H 131 8.368 8.886 -0.518 1 1 1017 . 2 1 1 A 131 131 ALA HA H 131 4.654 5.234 -0.580 1 1 1021 . 2 1 1 A 131 131 ALA CA C 131 49.739 50.505 -0.766 1 1 1022 . 2 1 1 A 131 131 ALA CB C 131 15.351 21.070 -5.719 1 1 1023 . 2 1 1 A 131 131 ALA N N 131 126.734 125.077 1.657 1 1 1024 . 2 1 1 A 132 132 LYS H H 132 7.732 8.545 -0.813 1 1 1025 . 2 1 1 A 132 132 LYS HA H 132 4.171 4.811 -0.640 1 1 1028 . 2 1 1 A 132 132 LYS N N 132 127.309 122.038 5.271 1 1 1029 . 2 1 1 A 133 133 ARG H H 133 8.193 8.827 -0.634 1 1 1030 . 2 1 1 A 133 133 ARG HA H 133 5.073 4.924 0.149 1 1 1038 . 2 1 1 A 133 133 ARG N N 133 122.190 122.669 -0.479 1 1 1040 . 2 1 1 A 134 134 ARG H H 134 7.539 9.196 -1.657 1 1 1041 . 2 1 1 A 134 134 ARG HA H 134 4.667 4.990 -0.323 1 1 1049 . 2 1 1 A 134 134 ARG CA C 134 52.584 55.259 -2.675 1 1 1050 . 2 1 1 A 134 134 ARG CB C 134 31.325 32.156 -0.831 1 1 1052 . 2 1 1 A 134 134 ARG N N 134 121.632 124.179 -2.547 1 1 1054 . 2 1 1 A 135 135 PHE H H 135 8.816 8.915 -0.099 1 1 1055 . 2 1 1 A 135 135 PHE HA H 135 5.680 5.805 -0.125 1 1 1062 . 2 1 1 A 135 135 PHE N N 135 125.107 120.870 4.237 1 1 1063 . 2 1 1 A 136 136 ARG H H 136 7.741 9.969 -2.228 1 1 1064 . 2 1 1 A 136 136 ARG HA H 136 4.402 4.802 -0.400 1 1 1068 . 2 1 1 A 136 136 ARG N N 136 125.640 124.352 1.288 1 1 1070 . 2 1 1 A 137 137 ILE H H 137 8.556 8.759 -0.203 1 1 1071 . 2 1 1 A 137 137 ILE HA H 137 3.912 4.521 -0.609 1 1 1076 . 2 1 1 A 137 137 ILE CA C 137 55.676 60.060 -4.384 1 1 1079 . 2 1 1 A 137 137 ILE N N 137 122.891 122.454 0.437 1 1 1080 . 2 1 1 A 138 138 GLY H H 138 8.676 9.016 -0.340 1 1 1081 . 2 1 1 A 138 138 GLY HA2 H 138 3.740 3.869 -0.129 1 1 1082 . 2 1 1 A 138 138 GLY HA3 H 138 2.982 3.886 -0.904 1 1 1083 . 2 1 1 A 138 138 GLY CA C 138 41.908 45.856 -3.948 1 1 1084 . 2 1 1 A 138 138 GLY N N 138 117.058 114.221 2.837 1 1 1085 . 2 1 1 A 139 139 ASP H H 139 7.858 7.625 0.233 1 1 1086 . 2 1 1 A 139 139 ASP HA H 139 4.753 4.580 0.173 1 1 1089 . 2 1 1 A 139 139 ASP CA C 139 52.584 55.416 -2.832 1 1 1090 . 2 1 1 A 139 139 ASP CB C 139 43.062 41.270 1.792 1 1 1091 . 2 1 1 A 139 139 ASP N N 139 124.516 119.517 4.999 1 1 1092 . 2 1 1 A 140 140 ILE H H 140 8.354 8.522 -0.168 1 1 1093 . 2 1 1 A 140 140 ILE HA H 140 4.473 4.518 -0.045 1 1 1103 . 2 1 1 A 140 140 ILE CB C 140 36.173 38.829 -2.656 1 1 1105 . 2 1 1 A 140 140 ILE N N 140 120.679 123.935 -3.256 1 1 1106 . 2 1 1 A 141 141 ALA H H 141 8.708 7.513 1.195 1 1 1107 . 2 1 1 A 141 141 ALA HA H 141 4.862 3.938 0.924 1 1 1111 . 2 1 1 A 141 141 ALA CA C 141 47.968 53.120 -5.152 1 1 1112 . 2 1 1 A 141 141 ALA CB C 141 21.733 18.955 2.778 1 1 1113 . 2 1 1 A 141 141 ALA N N 141 130.144 126.246 3.898 1 1 1114 . 2 1 1 A 142 142 GLY H H 142 7.888 8.403 -0.515 1 1 1115 . 2 1 1 A 142 142 GLY HA2 H 142 4.519 4.058 0.461 1 1 1116 . 2 1 1 A 142 142 GLY HA3 H 142 3.634 4.111 -0.477 1 1 1117 . 2 1 1 A 142 142 GLY N N 142 102.272 111.266 -8.994 1 1 1118 . 2 1 1 A 143 143 GLU H H 143 8.068 7.688 0.380 1 1 1119 . 2 1 1 A 143 143 GLU HA H 143 4.577 4.745 -0.168 1 1 1124 . 2 1 1 A 143 143 GLU N N 143 120.569 119.823 0.746 1 1 1125 . 2 1 1 A 144 144 HIS H H 144 8.478 8.759 -0.281 1 1 1126 . 2 1 1 A 144 144 HIS HA H 144 4.968 4.715 0.253 1 1 1131 . 2 1 1 A 144 144 HIS N N 144 124.275 117.375 6.900 1 1 1132 . 2 1 1 A 145 145 THR H H 145 9.031 8.162 0.869 1 1 1133 . 2 1 1 A 145 145 THR HA H 145 4.025 3.992 0.033 1 1 1138 . 2 1 1 A 145 145 THR CA C 145 61.247 65.308 -4.061 1 1 1139 . 2 1 1 A 145 145 THR CB C 145 65.181 68.623 -3.442 1 1 1141 . 2 1 1 A 145 145 THR N N 145 125.828 120.663 5.165 1 1 1142 . 2 1 1 A 146 146 SER H H 146 9.077 7.831 1.246 1 1 1143 . 2 1 1 A 146 146 SER HA H 146 4.684 5.364 -0.680 1 1 1145 . 2 1 1 A 146 146 SER CA C 146 56.067 59.177 -3.110 1 1 1146 . 2 1 1 A 146 146 SER CB C 146 60.510 63.979 -3.469 1 1 1147 . 2 1 1 A 146 146 SER N N 146 124.154 117.006 7.148 1 1 1148 . 2 1 1 A 147 147 PHE H H 147 9.049 8.688 0.361 1 1 1149 . 2 1 1 A 147 147 PHE HA H 147 4.022 4.469 -0.447 1 1 1154 . 2 1 1 A 147 147 PHE N N 147 127.670 124.303 3.367 1 1 1155 . 2 1 1 A 148 148 ASP H H 148 8.504 8.497 0.007 1 1 1156 . 2 1 1 A 148 148 ASP HA H 148 4.422 4.608 -0.186 1 1 1158 . 2 1 1 A 148 148 ASP CA C 148 52.584 57.344 -4.760 1 1 1159 . 2 1 1 A 148 148 ASP CB C 148 37.800 41.491 -3.691 1 1 1160 . 2 1 1 A 148 148 ASP N N 148 114.377 121.556 -7.179 1 1 1161 . 2 1 1 A 149 149 LYS H H 149 7.380 7.991 -0.611 1 1 1162 . 2 1 1 A 149 149 LYS HA H 149 4.487 4.404 0.083 1 1 1171 . 2 1 1 A 149 149 LYS CA C 149 51.735 56.483 -4.748 1 1 1172 . 2 1 1 A 149 149 LYS CB C 149 30.162 32.687 -2.525 1 1 1175 . 2 1 1 A 149 149 LYS N N 149 119.137 117.219 1.918 1 1 1176 . 2 1 1 A 150 150 LEU H H 150 6.886 7.576 -0.690 1 1 1177 . 2 1 1 A 150 150 LEU HA H 150 3.996 4.745 -0.749 1 1 1186 . 2 1 1 A 150 150 LEU CA C 150 50.502 52.284 -1.782 1 1 1187 . 2 1 1 A 150 150 LEU N N 150 120.614 118.246 2.368 1 1 1188 . 2 1 1 A 151 151 PRO CB C 151 29.567 31.820 -2.253 1 1 1190 . 2 1 1 A 152 152 LYS H H 152 8.076 6.381 1.695 1 1 1191 . 2 1 1 A 152 152 LYS HA H 152 4.346 4.394 -0.048 1 1 1195 . 2 1 1 A 152 152 LYS CA C 152 53.182 54.752 -1.570 1 1 1196 . 2 1 1 A 152 152 LYS CB C 152 31.487 33.507 -2.020 1 1 1198 . 2 1 1 A 152 152 LYS N N 152 118.133 116.740 1.393 1 1 1199 . 2 1 1 A 153 153 ASP H H 153 7.982 8.092 -0.110 1 1 1200 . 2 1 1 A 153 153 ASP HA H 153 4.402 4.777 -0.375 1 1 1203 . 2 1 1 A 153 153 ASP CA C 153 52.584 53.722 -1.138 1 1 1204 . 2 1 1 A 153 153 ASP CB C 153 37.762 38.832 -1.070 1 1 1205 . 2 1 1 A 153 153 ASP N N 153 115.735 125.666 -9.931 1 1 1206 . 2 1 1 A 154 154 VAL H H 154 6.987 10.438 -3.451 1 1 1207 . 2 1 1 A 154 154 VAL HA H 154 4.406 4.595 -0.189 1 1 1215 . 2 1 1 A 154 154 VAL CA C 154 58.408 59.846 -1.438 1 1 1216 . 2 1 1 A 154 154 VAL CB C 154 32.617 34.162 -1.545 1 1 1217 . 2 1 1 A 154 154 VAL N N 154 116.266 121.340 -5.074 1 1 1218 . 2 1 1 A 155 155 MET H H 155 8.444 8.625 -0.181 1 1 1219 . 2 1 1 A 155 155 MET HA H 155 5.416 4.588 0.828 1 1 1224 . 2 1 1 A 155 155 MET CA C 155 51.183 54.345 -3.162 1 1 1226 . 2 1 1 A 155 155 MET N N 155 124.950 123.421 1.529 1 1 1227 . 2 1 1 A 156 156 ALA H H 156 9.226 8.785 0.441 1 1 1228 . 2 1 1 A 156 156 ALA HA H 156 4.693 4.689 0.004 1 1 1232 . 2 1 1 A 156 156 ALA CA C 156 48.379 51.069 -2.690 1 1 1233 . 2 1 1 A 156 156 ALA CB C 156 21.051 19.868 1.183 1 1 1234 . 2 1 1 A 156 156 ALA N N 156 129.938 127.473 2.465 1 1 1235 . 2 1 1 A 157 157 THR H H 157 8.554 8.741 -0.187 1 1 1236 . 2 1 1 A 157 157 THR HA H 157 4.839 4.662 0.177 1 1 1241 . 2 1 1 A 157 157 THR CA C 157 59.555 62.221 -2.666 1 1 1242 . 2 1 1 A 157 157 THR CB C 157 68.575 70.281 -1.706 1 1 1244 . 2 1 1 A 157 157 THR N N 157 118.815 119.350 -0.535 1 1 1245 . 2 1 1 A 158 158 TYR H H 158 9.974 10.023 -0.049 1 1 1246 . 2 1 1 A 158 158 TYR HA H 158 4.435 5.287 -0.852 1 1 1253 . 2 1 1 A 158 158 TYR N N 158 126.958 122.985 3.973 1 1 1254 . 2 1 1 A 159 159 ARG H H 159 8.909 8.734 0.175 1 1 1255 . 2 1 1 A 159 159 ARG HA H 159 5.444 5.474 -0.030 1 1 1263 . 2 1 1 A 159 159 ARG CA C 159 51.933 54.601 -2.668 1 1 1264 . 2 1 1 A 159 159 ARG N N 159 121.721 119.818 1.903 1 1 1266 . 2 1 1 A 160 160 GLY H H 160 8.910 8.407 0.503 1 1 1267 . 2 1 1 A 160 160 GLY HA2 H 160 4.904 4.504 0.400 1 1 1268 . 2 1 1 A 160 160 GLY HA3 H 160 4.484 4.796 -0.312 1 1 1269 . 2 1 1 A 160 160 GLY N N 160 113.921 107.275 6.646 1 1 1270 . 2 1 1 A 161 161 THR H H 161 9.110 9.430 -0.320 1 1 1271 . 2 1 1 A 161 161 THR HA H 161 4.810 5.352 -0.542 1 1 1276 . 2 1 1 A 161 161 THR CA C 161 59.603 61.206 -1.603 1 1 1277 . 2 1 1 A 161 161 THR CB C 161 69.909 72.338 -2.429 1 1 1279 . 2 1 1 A 161 161 THR N N 161 126.813 116.084 10.729 1 1 1280 . 2 1 1 A 162 162 ALA H H 162 7.137 10.151 -3.014 1 1 1281 . 2 1 1 A 162 162 ALA HA H 162 5.361 5.479 -0.118 1 1 1285 . 2 1 1 A 162 162 ALA CA C 162 46.573 50.886 -4.313 1 1 1286 . 2 1 1 A 162 162 ALA CB C 162 20.959 23.836 -2.877 1 1 1287 . 2 1 1 A 162 162 ALA N N 162 128.111 123.903 4.208 1 1 1288 . 2 1 1 A 163 163 PHE H H 163 8.587 8.835 -0.248 1 1 1289 . 2 1 1 A 163 163 PHE HA H 163 5.538 5.113 0.425 1 1 1296 . 2 1 1 A 163 163 PHE N N 163 117.349 114.398 2.951 1 1 1297 . 2 1 1 A 164 164 GLY H H 164 8.650 8.241 0.409 1 1 1298 . 2 1 1 A 164 164 GLY HA2 H 164 4.210 3.782 0.428 1 1 1299 . 2 1 1 A 164 164 GLY HA3 H 164 3.285 3.834 -0.549 1 1 1300 . 2 1 1 A 164 164 GLY CA C 164 40.377 45.031 -4.654 1 1 1301 . 2 1 1 A 164 164 GLY N N 164 108.839 108.709 0.130 1 1 1302 . 2 1 1 A 165 165 SER H H 165 7.684 10.052 -2.368 1 1 1303 . 2 1 1 A 165 165 SER HA H 165 3.458 3.996 -0.538 1 1 1304 . 2 1 1 A 165 165 SER N N 165 116.037 117.209 -1.172 1 1 1305 . 2 1 1 A 166 166 ASP H H 166 9.718 8.523 1.195 1 1 1306 . 2 1 1 A 166 166 ASP HA H 166 4.281 4.555 -0.274 1 1 1309 . 2 1 1 A 166 166 ASP CA C 166 52.584 56.399 -3.815 1 1 1310 . 2 1 1 A 166 166 ASP N N 166 125.166 120.999 4.167 1 1 1311 . 2 1 1 A 167 167 ASP H H 167 7.655 8.164 -0.509 1 1 1312 . 2 1 1 A 167 167 ASP HA H 167 4.666 4.998 -0.332 1 1 1315 . 2 1 1 A 167 167 ASP CB C 167 38.948 42.692 -3.744 1 1 1316 . 2 1 1 A 167 167 ASP N N 167 117.491 119.193 -1.702 1 1 1317 . 2 1 1 A 168 168 ALA H H 168 8.585 8.363 0.222 1 1 1318 . 2 1 1 A 168 168 ALA HA H 168 5.012 5.538 -0.526 1 1 1322 . 2 1 1 A 168 168 ALA CA C 168 47.485 51.206 -3.721 1 1 1323 . 2 1 1 A 168 168 ALA N N 168 128.834 121.244 7.590 1 1 1324 . 2 1 1 A 169 169 GLY H H 169 8.472 7.974 0.498 1 1 1325 . 2 1 1 A 169 169 GLY HA2 H 169 4.404 4.218 0.186 1 1 1326 . 2 1 1 A 169 169 GLY HA3 H 169 4.051 4.254 -0.203 1 1 1327 . 2 1 1 A 169 169 GLY CA C 169 43.257 44.512 -1.255 1 1 1328 . 2 1 1 A 169 169 GLY N N 169 107.133 107.631 -0.498 1 1 1329 . 2 1 1 A 170 170 GLY H H 170 7.229 8.525 -1.296 1 1 1330 . 2 1 1 A 170 170 GLY HA2 H 170 4.223 4.206 0.017 1 1 1331 . 2 1 1 A 170 170 GLY HA3 H 170 3.781 4.220 -0.439 1 1 1332 . 2 1 1 A 170 170 GLY CA C 170 43.310 45.723 -2.413 1 1 1333 . 2 1 1 A 170 170 GLY N N 170 107.542 109.209 -1.667 1 1 1334 . 2 1 1 A 171 171 LYS H H 171 9.641 8.109 1.532 1 1 1335 . 2 1 1 A 171 171 LYS HA H 171 5.129 5.171 -0.042 1 1 1342 . 2 1 1 A 171 171 LYS CA C 171 51.355 54.544 -3.189 1 1 1343 . 2 1 1 A 171 171 LYS N N 171 124.322 120.022 4.300 1 1 1344 . 2 1 1 A 172 172 LEU H H 172 7.764 8.678 -0.914 1 1 1345 . 2 1 1 A 172 172 LEU HA H 172 4.973 5.247 -0.274 1 1 1353 . 2 1 1 A 172 172 LEU CA C 172 50.348 53.801 -3.453 1 1 1354 . 2 1 1 A 172 172 LEU N N 172 126.389 121.253 5.136 1 1 1355 . 2 1 1 A 173 173 THR H H 173 8.321 8.638 -0.317 1 1 1356 . 2 1 1 A 173 173 THR HA H 173 5.017 5.107 -0.090 1 1 1361 . 2 1 1 A 173 173 THR CA C 173 59.149 61.819 -2.670 1 1 1362 . 2 1 1 A 173 173 THR CB C 173 67.449 69.817 -2.368 1 1 1364 . 2 1 1 A 173 173 THR N N 173 123.553 120.363 3.190 1 1 1365 . 2 1 1 A 174 174 TYR H H 174 9.367 10.297 -0.930 1 1 1366 . 2 1 1 A 174 174 TYR HA H 174 4.660 5.011 -0.351 1 1 1373 . 2 1 1 A 174 174 TYR CB C 174 41.267 42.972 -1.705 1 1 1374 . 2 1 1 A 174 174 TYR N N 174 129.583 124.915 4.668 1 1 1375 . 2 1 1 A 175 175 THR H H 175 8.529 9.656 -1.127 1 1 1376 . 2 1 1 A 175 175 THR HA H 175 5.388 4.880 0.508 1 1 1381 . 2 1 1 A 175 175 THR CA C 175 58.216 61.616 -3.400 1 1 1382 . 2 1 1 A 175 175 THR CB C 175 68.575 69.577 -1.002 1 1 1384 . 2 1 1 A 175 175 THR N N 175 125.967 116.836 9.131 1 1 1385 . 2 1 1 A 176 176 ILE H H 176 9.139 9.178 -0.039 1 1 1386 . 2 1 1 A 176 176 ILE HA H 176 4.382 4.368 0.014 1 1 1395 . 2 1 1 A 176 176 ILE CA C 176 58.006 59.972 -1.966 1 1 1396 . 2 1 1 A 176 176 ILE CB C 176 38.881 38.871 0.010 1 1 1400 . 2 1 1 A 176 176 ILE N N 176 123.715 127.226 -3.511 1 1 1401 . 2 1 1 A 177 177 ASP H H 177 8.501 8.568 -0.067 1 1 1402 . 2 1 1 A 177 177 ASP HA H 177 5.011 4.597 0.414 1 1 1405 . 2 1 1 A 177 177 ASP CA C 177 49.089 54.084 -4.995 1 1 1406 . 2 1 1 A 177 177 ASP CB C 177 39.282 41.522 -2.240 1 1 1407 . 2 1 1 A 177 177 ASP N N 177 125.978 128.656 -2.678 1 1 1408 . 2 1 1 A 178 178 PHE H H 178 8.913 8.845 0.068 1 1 1409 . 2 1 1 A 178 178 PHE HA H 178 3.993 4.095 -0.102 1 1 1414 . 2 1 1 A 178 178 PHE CB C 178 34.588 39.677 -5.089 1 1 1415 . 2 1 1 A 178 178 PHE N N 178 123.522 122.563 0.959 1 1 1416 . 2 1 1 A 179 179 ALA H H 179 8.487 7.025 1.462 1 1 1417 . 2 1 1 A 179 179 ALA HA H 179 4.528 3.899 0.629 1 1 1421 . 2 1 1 A 179 179 ALA CA C 179 52.584 55.054 -2.470 1 1 1422 . 2 1 1 A 179 179 ALA CB C 179 15.666 17.991 -2.325 1 1 1423 . 2 1 1 A 179 179 ALA N N 179 124.061 126.321 -2.260 1 1 1424 . 2 1 1 A 180 180 ALA H H 180 7.162 7.478 -0.316 1 1 1425 . 2 1 1 A 180 180 ALA HA H 180 4.313 4.188 0.125 1 1 1429 . 2 1 1 A 180 180 ALA CA C 180 49.006 52.500 -3.494 1 1 1430 . 2 1 1 A 180 180 ALA CB C 180 16.933 17.892 -0.959 1 1 1431 . 2 1 1 A 180 180 ALA N N 180 119.710 119.619 0.091 1 1 1432 . 2 1 1 A 181 181 LYS H H 181 8.092 8.407 -0.315 1 1 1433 . 2 1 1 A 181 181 LYS HA H 181 3.457 4.624 -1.167 1 1 1440 . 2 1 1 A 181 181 LYS CA C 181 54.783 56.978 -2.195 1 1 1441 . 2 1 1 A 181 181 LYS CB C 181 27.088 34.251 -7.163 1 1 1444 . 2 1 1 A 181 181 LYS N N 181 114.996 116.435 -1.439 1 1 1445 . 2 1 1 A 182 182 GLN H H 182 7.532 7.526 0.006 1 1 1446 . 2 1 1 A 182 182 GLN HA H 182 5.304 4.794 0.510 1 1 1453 . 2 1 1 A 182 182 GLN CA C 182 51.473 55.089 -3.616 1 1 1454 . 2 1 1 A 182 182 GLN CB C 182 31.585 32.479 -0.894 1 1 1455 . 2 1 1 A 182 182 GLN N N 182 115.064 114.798 0.266 1 1 1457 . 2 1 1 A 183 183 GLY H H 183 9.026 8.202 0.824 1 1 1458 . 2 1 1 A 183 183 GLY HA2 H 183 5.376 3.876 1.500 1 1 1459 . 2 1 1 A 183 183 GLY HA3 H 183 3.567 4.188 -0.621 1 1 1460 . 2 1 1 A 183 183 GLY CA C 183 42.361 44.891 -2.530 1 1 1461 . 2 1 1 A 183 183 GLY N N 183 111.505 108.417 3.088 1 1 1462 . 2 1 1 A 184 184 HIS H H 184 7.508 8.099 -0.591 1 1 1463 . 2 1 1 A 184 184 HIS HA H 184 4.304 5.766 -1.462 1 1 1467 . 2 1 1 A 184 184 HIS CA C 184 52.793 53.679 -0.886 1 1 1468 . 2 1 1 A 184 184 HIS CB C 184 27.906 33.306 -5.400 1 1 1469 . 2 1 1 A 184 184 HIS N N 184 111.297 120.332 -9.035 1 1 1470 . 2 1 1 A 185 185 GLY H H 185 9.160 7.454 1.706 1 1 1471 . 2 1 1 A 185 185 GLY HA2 H 185 4.464 2.808 1.656 1 1 1472 . 2 1 1 A 185 185 GLY HA3 H 185 4.117 3.905 0.212 1 1 1473 . 2 1 1 A 185 185 GLY CA C 185 44.212 45.040 -0.828 1 1 1474 . 2 1 1 A 185 185 GLY N N 185 107.398 104.814 2.584 1 1 1475 . 2 1 1 A 186 186 LYS H H 186 9.170 8.148 1.022 1 1 1476 . 2 1 1 A 186 186 LYS HA H 186 4.925 4.778 0.147 1 1 1481 . 2 1 1 A 186 186 LYS CB C 186 33.642 36.340 -2.698 1 1 1482 . 2 1 1 A 186 186 LYS N N 186 122.690 120.511 2.179 1 1 1483 . 2 1 1 A 187 187 ILE H H 187 8.444 8.432 0.012 1 1 1484 . 2 1 1 A 187 187 ILE HA H 187 4.626 4.765 -0.139 1 1 1487 . 2 1 1 A 187 187 ILE N N 187 124.320 124.452 -0.132 1 1 1488 . 2 1 1 A 188 188 GLU H H 188 8.590 9.022 -0.432 1 1 1489 . 2 1 1 A 188 188 GLU HA H 188 4.650 4.596 0.054 1 1 1495 . 2 1 1 A 188 188 GLU N N 188 122.575 128.528 -5.953 1 1 1496 . 2 1 1 A 189 189 HIS H H 189 8.726 8.757 -0.031 1 1 1497 . 2 1 1 A 189 189 HIS HA H 189 4.055 5.037 -0.982 1 1 1501 . 2 1 1 A 189 189 HIS CA C 189 54.623 54.751 -0.128 1 1 1502 . 2 1 1 A 189 189 HIS CB C 189 24.997 30.414 -5.417 1 1 1503 . 2 1 1 A 189 189 HIS N N 189 111.381 123.781 -12.400 1 1 1504 . 2 1 1 A 190 190 LEU H H 190 9.715 8.761 0.954 1 1 1505 . 2 1 1 A 190 190 LEU HA H 190 4.379 3.963 0.416 1 1 1515 . 2 1 1 A 190 190 LEU N N 190 124.648 126.896 -2.248 1 1 1516 . 2 1 1 A 191 191 LYS H H 191 10.099 8.120 1.979 1 1 1517 . 2 1 1 A 191 191 LYS HA H 191 3.736 4.204 -0.468 1 1 1524 . 2 1 1 A 191 191 LYS CA C 191 55.815 57.315 -1.500 1 1 1525 . 2 1 1 A 191 191 LYS CB C 191 30.201 32.123 -1.922 1 1 1527 . 2 1 1 A 191 191 LYS N N 191 123.618 120.590 3.028 1 1 1528 . 2 1 1 A 192 192 SER H H 192 6.991 6.884 0.107 1 1 1529 . 2 1 1 A 192 192 SER HA H 192 4.743 2.642 2.101 1 1 1532 . 2 1 1 A 192 192 SER CA C 192 51.974 56.086 -4.112 1 1 1533 . 2 1 1 A 192 192 SER CB C 192 60.005 62.895 -2.890 1 1 1534 . 2 1 1 A 192 192 SER N N 192 115.071 117.119 -2.048 1 1 1535 . 2 1 1 A 193 193 PRO CB C 193 29.607 31.528 -1.921 1 1 1537 . 2 1 1 A 194 194 GLU H H 194 8.213 8.136 0.077 1 1 1538 . 2 1 1 A 194 194 GLU HA H 194 3.063 4.474 -1.411 1 1 1543 . 2 1 1 A 194 194 GLU CA C 194 54.185 57.364 -3.179 1 1 1545 . 2 1 1 A 194 194 GLU N N 194 114.055 116.514 -2.459 1 1 1546 . 2 1 1 A 195 195 LEU H H 195 7.082 7.883 -0.801 1 1 1547 . 2 1 1 A 195 195 LEU HA H 195 4.027 4.847 -0.820 1 1 1557 . 2 1 1 A 195 195 LEU CA C 195 51.361 55.330 -3.969 1 1 1558 . 2 1 1 A 195 195 LEU CB C 195 38.950 44.205 -5.255 1 1 1561 . 2 1 1 A 195 195 LEU N N 195 113.898 113.572 0.326 1 1 1562 . 2 1 1 A 196 196 ASN H H 196 7.060 7.793 -0.733 1 1 1563 . 2 1 1 A 196 196 ASN HA H 196 4.638 5.116 -0.478 1 1 1567 . 2 1 1 A 196 196 ASN N N 196 119.196 115.664 3.532 1 1 1568 . 2 1 1 A 197 197 VAL H H 197 7.244 8.128 -0.884 1 1 1569 . 2 1 1 A 197 197 VAL HA H 197 4.540 4.440 0.100 1 1 1577 . 2 1 1 A 197 197 VAL CA C 197 57.176 60.058 -2.882 1 1 1578 . 2 1 1 A 197 197 VAL N N 197 113.621 119.130 -5.509 1 1 1579 . 2 1 1 A 198 198 ASP H H 198 8.881 8.786 0.095 1 1 1580 . 2 1 1 A 198 198 ASP HA H 198 4.894 4.683 0.211 1 1 1581 . 2 1 1 A 198 198 ASP N N 198 118.852 123.868 -5.016 1 1 1582 . 2 1 1 A 199 199 LEU H H 199 8.498 8.722 -0.224 1 1 1583 . 2 1 1 A 199 199 LEU HA H 199 4.317 5.004 -0.687 1 1 1591 . 2 1 1 A 199 199 LEU N N 199 124.078 127.887 -3.809 1 1 1592 . 2 1 1 A 200 200 ALA H H 200 8.386 8.688 -0.302 1 1 1593 . 2 1 1 A 200 200 ALA HA H 200 4.295 5.184 -0.889 1 1 1597 . 2 1 1 A 200 200 ALA CA C 200 50.044 50.844 -0.800 1 1 1598 . 2 1 1 A 200 200 ALA CB C 200 17.985 22.043 -4.058 1 1 1599 . 2 1 1 A 200 200 ALA N N 200 127.315 126.365 0.950 1 1 1600 . 2 1 1 A 201 201 VAL H H 201 8.007 9.088 -1.081 1 1 1601 . 2 1 1 A 201 201 VAL HA H 201 4.577 4.836 -0.259 1 1 1609 . 2 1 1 A 201 201 VAL CA C 201 60.004 60.409 -0.405 1 1 1610 . 2 1 1 A 201 201 VAL CB C 201 28.863 36.288 -7.425 1 1 1611 . 2 1 1 A 201 201 VAL N N 201 119.409 122.202 -2.793 1 1 1612 . 2 1 1 A 202 202 ALA H H 202 8.789 8.927 -0.138 1 1 1613 . 2 1 1 A 202 202 ALA HA H 202 4.630 5.467 -0.837 1 1 1617 . 2 1 1 A 202 202 ALA CA C 202 48.200 50.046 -1.846 1 1 1618 . 2 1 1 A 202 202 ALA N N 202 131.745 127.155 4.590 1 1 1619 . 2 1 1 A 203 203 TYR H H 203 8.522 9.076 -0.554 1 1 1620 . 2 1 1 A 203 203 TYR HA H 203 5.391 5.381 0.010 1 1 1627 . 2 1 1 A 203 203 TYR CA C 203 54.648 57.385 -2.737 1 1 1628 . 2 1 1 A 203 203 TYR CB C 203 37.315 39.941 -2.626 1 1 1629 . 2 1 1 A 203 203 TYR N N 203 117.786 119.489 -1.703 1 1 1630 . 2 1 1 A 204 204 ILE H H 204 8.209 8.385 -0.176 1 1 1631 . 2 1 1 A 204 204 ILE HA H 204 4.393 4.557 -0.164 1 1 1641 . 2 1 1 A 204 204 ILE CB C 204 36.807 40.612 -3.805 1 1 1644 . 2 1 1 A 204 204 ILE N N 204 120.602 123.572 -2.970 1 1 1645 . 2 1 1 A 205 205 LYS H H 205 9.340 8.827 0.513 1 1 1646 . 2 1 1 A 205 205 LYS HA H 205 4.756 4.344 0.412 1 1 1651 . 2 1 1 A 205 205 LYS CA C 205 50.844 61.454 -10.610 1 1 1652 . 2 1 1 A 205 205 LYS N N 205 127.960 127.791 0.169 1 1 1653 . 2 1 1 A 207 207 ASP H H 207 8.436 8.405 0.031 1 1 1654 . 2 1 1 A 207 207 ASP HA H 207 4.692 4.600 0.092 1 1 1657 . 2 1 1 A 207 207 ASP CA C 207 48.789 52.733 -3.944 1 1 1658 . 2 1 1 A 207 207 ASP CB C 207 38.377 42.252 -3.875 1 1 1659 . 2 1 1 A 207 207 ASP N N 207 123.098 123.947 -0.849 1 1 1660 . 2 1 1 A 208 208 GLU H H 208 8.880 8.479 0.401 1 1 1661 . 2 1 1 A 208 208 GLU HA H 208 3.994 3.979 0.015 1 1 1666 . 2 1 1 A 208 208 GLU CA C 208 56.123 59.144 -3.021 1 1 1667 . 2 1 1 A 208 208 GLU CB C 208 25.794 29.519 -3.725 1 1 1669 . 2 1 1 A 208 208 GLU N N 208 119.042 122.571 -3.529 1 1 1670 . 2 1 1 A 209 209 LYS H H 209 7.681 7.758 -0.077 1 1 1671 . 2 1 1 A 209 209 LYS HA H 209 4.141 4.085 0.056 1 1 1680 . 2 1 1 A 209 209 LYS N N 209 119.252 116.584 2.668 1 1 1681 . 2 1 1 A 210 210 HIS H H 210 8.177 7.367 0.810 1 1 1682 . 2 1 1 A 210 210 HIS HA H 210 3.825 4.835 -1.010 1 1 1687 . 2 1 1 A 210 210 HIS CA C 210 54.205 55.115 -0.910 1 1 1688 . 2 1 1 A 210 210 HIS CB C 210 23.439 31.307 -7.868 1 1 1689 . 2 1 1 A 210 210 HIS N N 210 112.758 112.653 0.105 1 1 1690 . 2 1 1 A 211 211 HIS H H 211 8.758 7.315 1.443 1 1 1691 . 2 1 1 A 211 211 HIS HA H 211 5.041 5.228 -0.187 1 1 1695 . 2 1 1 A 211 211 HIS CA C 211 50.450 56.410 -5.960 1 1 1696 . 2 1 1 A 211 211 HIS CB C 211 25.703 30.564 -4.861 1 1 1697 . 2 1 1 A 211 211 HIS N N 211 119.552 119.864 -0.312 1 1 1698 . 2 1 1 A 212 212 ALA H H 212 8.556 8.615 -0.059 1 1 1699 . 2 1 1 A 212 212 ALA HA H 212 4.712 4.610 0.102 1 1 1703 . 2 1 1 A 212 212 ALA CA C 212 49.886 50.945 -1.059 1 1 1704 . 2 1 1 A 212 212 ALA CB C 212 18.860 19.404 -0.544 1 1 1705 . 2 1 1 A 212 212 ALA N N 212 123.780 123.927 -0.147 1 1 1706 . 2 1 1 A 213 213 VAL H H 213 9.338 8.230 1.108 1 1 1707 . 2 1 1 A 213 213 VAL HA H 213 5.074 4.668 0.406 1 1 1715 . 2 1 1 A 213 213 VAL CA C 213 57.486 60.255 -2.769 1 1 1716 . 2 1 1 A 213 213 VAL CB C 213 33.938 35.104 -1.166 1 1 1717 . 2 1 1 A 213 213 VAL N N 213 124.742 120.237 4.505 1 1 1718 . 2 1 1 A 214 214 ILE H H 214 8.962 9.372 -0.410 1 1 1719 . 2 1 1 A 214 214 ILE HA H 214 4.434 4.643 -0.209 1 1 1726 . 2 1 1 A 214 214 ILE N N 214 122.881 126.688 -3.807 1 1 1727 . 2 1 1 A 215 215 SER H H 215 8.558 8.648 -0.090 1 1 1728 . 2 1 1 A 215 215 SER HA H 215 5.001 5.410 -0.409 1 1 1731 . 2 1 1 A 215 215 SER CA C 215 53.230 57.339 -4.109 1 1 1732 . 2 1 1 A 215 215 SER CB C 215 62.077 65.033 -2.956 1 1 1733 . 2 1 1 A 215 215 SER N N 215 122.891 125.120 -2.229 1 1 1734 . 2 1 1 A 216 216 GLY H H 216 7.282 9.353 -2.071 1 1 1735 . 2 1 1 A 216 216 GLY HA2 H 216 4.515 4.473 0.042 1 1 1736 . 2 1 1 A 216 216 GLY HA3 H 216 3.473 4.521 -1.048 1 1 1737 . 2 1 1 A 216 216 GLY CA C 216 42.816 46.126 -3.310 1 1 1738 . 2 1 1 A 216 216 GLY N N 216 110.899 112.594 -1.695 1 1 1739 . 2 1 1 A 217 217 SER H H 217 8.673 8.966 -0.293 1 1 1740 . 2 1 1 A 217 217 SER HA H 217 5.127 5.260 -0.133 1 1 1743 . 2 1 1 A 217 217 SER CA C 217 56.266 57.723 -1.457 1 1 1744 . 2 1 1 A 217 217 SER N N 217 117.164 116.035 1.129 1 1 1745 . 2 1 1 A 218 218 VAL H H 218 7.451 8.854 -1.403 1 1 1746 . 2 1 1 A 218 218 VAL HA H 218 5.128 4.712 0.416 1 1 1754 . 2 1 1 A 218 218 VAL CA C 218 56.637 61.951 -5.314 1 1 1755 . 2 1 1 A 218 218 VAL N N 218 117.826 126.832 -9.006 1 1 1756 . 2 1 1 A 219 219 LEU H H 219 9.022 9.481 -0.459 1 1 1757 . 2 1 1 A 219 219 LEU HA H 219 5.387 4.882 0.505 1 1 1767 . 2 1 1 A 219 219 LEU CA C 219 50.450 53.565 -3.115 1 1 1768 . 2 1 1 A 219 219 LEU N N 219 124.820 126.664 -1.844 1 1 1769 . 2 1 1 A 220 220 TYR H H 220 8.816 8.352 0.464 1 1 1770 . 2 1 1 A 220 220 TYR HA H 220 4.834 4.934 -0.100 1 1 1777 . 2 1 1 A 220 220 TYR N N 220 121.249 122.370 -1.121 1 1 1778 . 2 1 1 A 221 221 ASN H H 221 9.191 9.074 0.117 1 1 1779 . 2 1 1 A 221 221 ASN HA H 221 4.048 4.545 -0.497 1 1 1784 . 2 1 1 A 221 221 ASN CA C 221 51.647 55.707 -4.060 1 1 1785 . 2 1 1 A 221 221 ASN CB C 221 36.640 38.501 -1.861 1 1 1786 . 2 1 1 A 221 221 ASN N N 221 129.865 123.477 6.388 1 1 1788 . 2 1 1 A 222 222 GLN H H 222 8.468 7.828 0.640 1 1 1789 . 2 1 1 A 222 222 GLN HA H 222 3.671 4.623 -0.952 1 1 1794 . 2 1 1 A 222 222 GLN CA C 222 55.075 55.269 -0.194 1 1 1795 . 2 1 1 A 222 222 GLN CB C 222 24.663 29.154 -4.491 1 1 1797 . 2 1 1 A 222 222 GLN N N 222 108.367 114.356 -5.989 1 1 1798 . 2 1 1 A 223 223 ASP H H 223 7.797 7.697 0.100 1 1 1799 . 2 1 1 A 223 223 ASP HA H 223 4.986 4.954 0.032 1 1 1802 . 2 1 1 A 223 223 ASP N N 223 120.842 119.989 0.853 1 1 1803 . 2 1 1 A 224 224 GLU H H 224 8.731 8.394 0.337 1 1 1804 . 2 1 1 A 224 224 GLU HA H 224 4.690 4.334 0.356 1 1 1809 . 2 1 1 A 224 224 GLU CA C 224 54.703 57.177 -2.474 1 1 1810 . 2 1 1 A 224 224 GLU CB C 224 26.357 30.415 -4.058 1 1 1812 . 2 1 1 A 224 224 GLU N N 224 124.249 121.756 2.493 1 1 1813 . 2 1 1 A 225 225 LYS H H 225 8.730 8.594 0.136 1 1 1814 . 2 1 1 A 225 225 LYS HA H 225 4.754 4.835 -0.081 1 1 1822 . 2 1 1 A 225 225 LYS N N 225 126.784 124.799 1.985 1 1 1823 . 2 1 1 A 226 226 GLY H H 226 7.683 9.391 -1.708 1 1 1824 . 2 1 1 A 226 226 GLY HA2 H 226 5.567 4.221 1.346 1 1 1825 . 2 1 1 A 226 226 GLY HA3 H 226 3.819 4.241 -0.422 1 1 1826 . 2 1 1 A 226 226 GLY CA C 226 42.264 44.159 -1.895 1 1 1827 . 2 1 1 A 226 226 GLY N N 226 107.140 111.389 -4.249 1 1 1828 . 2 1 1 A 227 227 SER H H 227 8.672 10.976 -2.304 1 1 1829 . 2 1 1 A 227 227 SER HA H 227 5.564 5.627 -0.063 1 1 1832 . 2 1 1 A 227 227 SER CA C 227 54.373 57.202 -2.829 1 1 1833 . 2 1 1 A 227 227 SER CB C 227 63.963 66.639 -2.676 1 1 1834 . 2 1 1 A 227 227 SER N N 227 117.767 116.182 1.585 1 1 1835 . 2 1 1 A 228 228 TYR H H 228 9.073 9.669 -0.596 1 1 1836 . 2 1 1 A 228 228 TYR HA H 228 5.519 5.385 0.134 1 1 1843 . 2 1 1 A 228 228 TYR N N 228 118.324 125.431 -7.107 1 1 1844 . 2 1 1 A 229 229 SER H H 229 8.929 8.112 0.817 1 1 1845 . 2 1 1 A 229 229 SER HA H 229 5.209 5.305 -0.096 1 1 1848 . 2 1 1 A 229 229 SER CA C 229 54.131 57.467 -3.336 1 1 1849 . 2 1 1 A 229 229 SER N N 229 116.118 123.419 -7.301 1 1 1850 . 2 1 1 A 230 230 LEU H H 230 9.372 9.737 -0.365 1 1 1851 . 2 1 1 A 230 230 LEU HA H 230 4.803 4.825 -0.022 1 1 1863 . 2 1 1 A 230 230 LEU N N 230 124.803 125.261 -0.458 1 1 1864 . 2 1 1 A 231 231 GLY H H 231 9.080 8.104 0.976 1 1 1865 . 2 1 1 A 231 231 GLY HA2 H 231 4.776 4.166 0.610 1 1 1866 . 2 1 1 A 231 231 GLY HA3 H 231 3.528 4.288 -0.760 1 1 1867 . 2 1 1 A 231 231 GLY CA C 231 41.468 44.116 -2.648 1 1 1868 . 2 1 1 A 231 231 GLY N N 231 109.611 108.212 1.399 1 1 1869 . 2 1 1 A 232 232 ILE H H 232 6.849 9.267 -2.418 1 1 1870 . 2 1 1 A 232 232 ILE HA H 232 4.742 4.536 0.206 1 1 1878 . 2 1 1 A 232 232 ILE N N 232 120.566 123.293 -2.727 1 1 1879 . 2 1 1 A 233 233 PHE H H 233 9.569 8.057 1.512 1 1 1880 . 2 1 1 A 233 233 PHE HA H 233 4.979 5.462 -0.483 1 1 1885 . 2 1 1 A 233 233 PHE N N 233 129.256 122.822 6.434 1 1 1886 . 2 1 1 A 234 234 GLY H H 234 8.734 8.082 0.652 1 1 1887 . 2 1 1 A 234 234 GLY HA2 H 234 4.488 4.313 0.175 1 1 1888 . 2 1 1 A 234 234 GLY HA3 H 234 3.327 4.326 -0.999 1 1 1889 . 2 1 1 A 234 234 GLY CA C 234 40.377 45.936 -5.559 1 1 1890 . 2 1 1 A 234 234 GLY N N 234 105.294 106.649 -1.355 1 1 1891 . 2 1 1 A 235 235 GLU H H 235 9.198 8.427 0.771 1 1 1892 . 2 1 1 A 235 235 GLU HA H 235 4.111 4.012 0.099 1 1 1897 . 2 1 1 A 235 235 GLU CA C 235 56.466 59.279 -2.813 1 1 1898 . 2 1 1 A 235 235 GLU CB C 235 26.256 29.124 -2.868 1 1 1900 . 2 1 1 A 235 235 GLU N N 235 125.813 122.217 3.596 1 1 1901 . 2 1 1 A 236 236 LYS H H 236 8.147 8.145 0.002 1 1 1902 . 2 1 1 A 236 236 LYS HA H 236 4.373 4.514 -0.141 1 1 1905 . 2 1 1 A 236 236 LYS N N 236 117.810 117.982 -0.172 1 1 1906 . 2 1 1 A 237 237 ALA H H 237 7.685 7.692 -0.007 1 1 1907 . 2 1 1 A 237 237 ALA HA H 237 3.902 4.585 -0.683 1 1 1911 . 2 1 1 A 237 237 ALA CA C 237 49.762 51.444 -1.682 1 1 1912 . 2 1 1 A 237 237 ALA CB C 237 14.720 19.147 -4.427 1 1 1913 . 2 1 1 A 237 237 ALA N N 237 118.704 122.742 -4.038 1 1 1914 . 2 1 1 A 238 238 GLN H H 238 9.312 8.557 0.755 1 1 1915 . 2 1 1 A 238 238 GLN HA H 238 4.049 4.734 -0.685 1 1 1920 . 2 1 1 A 238 238 GLN N N 238 118.059 122.086 -4.027 1 1 1921 . 2 1 1 A 239 239 GLU H H 239 8.785 10.603 -1.818 1 1 1922 . 2 1 1 A 239 239 GLU HA H 239 5.531 5.093 0.438 1 1 1927 . 2 1 1 A 239 239 GLU N N 239 116.914 121.941 -5.027 1 1 1928 . 2 1 1 A 240 240 VAL H H 240 8.501 9.147 -0.646 1 1 1929 . 2 1 1 A 240 240 VAL HA H 240 5.655 3.715 1.940 1 1 1937 . 2 1 1 A 240 240 VAL CA C 240 55.582 59.639 -4.057 1 1 1940 . 2 1 1 A 240 240 VAL N N 240 110.588 121.926 -11.338 1 1 1941 . 2 1 1 A 241 241 ALA H H 241 8.463 8.368 0.095 1 1 1942 . 2 1 1 A 241 241 ALA HA H 241 5.014 5.240 -0.226 1 1 1946 . 2 1 1 A 241 241 ALA CA C 241 49.361 51.291 -1.930 1 1 1947 . 2 1 1 A 241 241 ALA CB C 241 18.196 23.824 -5.628 1 1 1948 . 2 1 1 A 241 241 ALA N N 241 121.125 127.437 -6.312 1 1 1949 . 2 1 1 A 242 242 GLY H H 242 9.421 8.627 0.794 1 1 1950 . 2 1 1 A 242 242 GLY HA2 H 242 5.161 4.177 0.984 1 1 1951 . 2 1 1 A 242 242 GLY HA3 H 242 4.076 4.284 -0.208 1 1 1952 . 2 1 1 A 242 242 GLY N N 242 112.036 106.753 5.283 1 1 1953 . 2 1 1 A 243 243 SER H H 243 8.929 8.033 0.896 1 1 1954 . 2 1 1 A 243 243 SER HA H 243 5.331 5.163 0.168 1 1 1957 . 2 1 1 A 243 243 SER N N 243 116.113 114.743 1.370 1 1 1958 . 2 1 1 A 244 244 ALA H H 244 9.218 9.009 0.209 1 1 1959 . 2 1 1 A 244 244 ALA HA H 244 5.221 4.990 0.231 1 1 1963 . 2 1 1 A 244 244 ALA CA C 244 47.883 49.907 -2.024 1 1 1964 . 2 1 1 A 244 244 ALA N N 244 120.635 127.252 -6.617 1 1 1965 . 2 1 1 A 245 245 GLU H H 245 9.194 8.478 0.716 1 1 1966 . 2 1 1 A 245 245 GLU HA H 245 4.869 5.012 -0.143 1 1 1971 . 2 1 1 A 245 245 GLU N N 245 123.487 119.588 3.899 1 1 1972 . 2 1 1 A 246 246 VAL H H 246 8.531 9.115 -0.584 1 1 1973 . 2 1 1 A 246 246 VAL HA H 246 4.518 4.799 -0.281 1 1 1981 . 2 1 1 A 246 246 VAL CA C 246 58.286 61.176 -2.890 1 1 1982 . 2 1 1 A 246 246 VAL N N 246 123.347 122.317 1.030 1 1 1983 . 2 1 1 A 247 247 GLU H H 247 9.132 8.772 0.360 1 1 1984 . 2 1 1 A 247 247 GLU HA H 247 4.368 4.866 -0.498 1 1 1989 . 2 1 1 A 247 247 GLU CB C 247 26.744 32.938 -6.194 1 1 1990 . 2 1 1 A 247 247 GLU N N 247 129.243 126.179 3.064 1 1 1991 . 2 1 1 A 248 248 THR H H 248 7.827 8.453 -0.626 1 1 1992 . 2 1 1 A 248 248 THR HA H 248 4.749 4.794 -0.045 1 1 1997 . 2 1 1 A 248 248 THR CA C 248 56.859 60.652 -3.793 1 1 1998 . 2 1 1 A 248 248 THR CB C 248 69.171 70.911 -1.740 1 1 2000 . 2 1 1 A 248 248 THR N N 248 114.228 119.486 -5.258 1 1 2001 . 2 1 1 A 249 249 ALA H H 249 9.148 8.734 0.414 1 1 2002 . 2 1 1 A 249 249 ALA HA H 249 4.174 4.144 0.030 1 1 2006 . 2 1 1 A 249 249 ALA CA C 249 51.970 53.581 -1.611 1 1 2007 . 2 1 1 A 249 249 ALA CB C 249 15.797 18.639 -2.842 1 1 2008 . 2 1 1 A 249 249 ALA N N 249 123.341 124.466 -1.125 1 1 2009 . 2 1 1 A 250 250 ASN H H 250 7.974 7.672 0.302 1 1 2010 . 2 1 1 A 250 250 ASN HA H 250 4.953 4.855 0.098 1 1 2015 . 2 1 1 A 250 250 ASN CA C 250 49.198 52.628 -3.430 1 1 2016 . 2 1 1 A 250 250 ASN CB C 250 35.976 38.922 -2.946 1 1 2017 . 2 1 1 A 250 250 ASN N N 250 113.358 116.768 -3.410 1 1 2019 . 2 1 1 A 251 251 GLY H H 251 7.510 7.666 -0.156 1 1 2020 . 2 1 1 A 251 251 GLY HA2 H 251 4.492 4.120 0.372 1 1 2021 . 2 1 1 A 251 251 GLY HA3 H 251 3.853 4.208 -0.355 1 1 2022 . 2 1 1 A 251 251 GLY CA C 251 41.435 45.243 -3.808 1 1 2023 . 2 1 1 A 251 251 GLY N N 251 108.692 107.253 1.439 1 1 2024 . 2 1 1 A 252 252 ILE H H 252 8.465 8.930 -0.465 1 1 2025 . 2 1 1 A 252 252 ILE HA H 252 4.521 4.358 0.163 1 1 2035 . 2 1 1 A 252 252 ILE CB C 252 35.653 38.857 -3.204 1 1 2039 . 2 1 1 A 252 252 ILE N N 252 122.043 127.227 -5.184 1 1 2040 . 2 1 1 A 253 253 HIS H H 253 9.311 8.428 0.883 1 1 2041 . 2 1 1 A 253 253 HIS HA H 253 4.861 5.216 -0.355 1 1 2046 . 2 1 1 A 253 253 HIS N N 253 126.617 121.803 4.814 1 1 2047 . 2 1 1 A 254 254 HIS H H 254 8.820 9.163 -0.343 1 1 2048 . 2 1 1 A 254 254 HIS HA H 254 5.305 5.694 -0.389 1 1 2051 . 2 1 1 A 254 254 HIS CA C 254 52.781 53.856 -1.075 1 1 2052 . 2 1 1 A 254 254 HIS N N 254 122.665 116.449 6.216 1 1 2053 . 2 1 1 A 255 255 ILE H H 255 9.047 9.275 -0.228 1 1 2054 . 2 1 1 A 255 255 ILE HA H 255 4.651 4.324 0.327 1 1 2061 . 2 1 1 A 255 255 ILE N N 255 123.958 119.493 4.465 1 1 2062 . 2 1 1 A 256 256 GLY H H 256 9.339 8.520 0.819 1 1 2063 . 2 1 1 A 256 256 GLY HA2 H 256 3.816 2.529 1.287 1 1 2064 . 2 1 1 A 256 256 GLY HA3 H 256 2.267 3.511 -1.244 1 1 2065 . 2 1 1 A 256 256 GLY N N 256 115.022 113.688 1.334 1 1 2066 . 2 1 1 A 257 257 LEU H H 257 7.890 9.335 -1.445 1 1 2067 . 2 1 1 A 257 257 LEU HA H 257 4.853 5.150 -0.297 1 1 2077 . 2 1 1 A 257 257 LEU N N 257 121.441 124.226 -2.785 1 1 2078 . 2 1 1 A 258 258 ALA H H 258 7.982 9.253 -1.271 1 1 2079 . 2 1 1 A 258 258 ALA HA H 258 4.668 5.078 -0.410 1 1 2083 . 2 1 1 A 258 258 ALA CA C 258 49.678 51.823 -2.145 1 1 2084 . 2 1 1 A 258 258 ALA CB C 258 19.561 20.851 -1.290 1 1 2085 . 2 1 1 A 258 258 ALA N N 258 123.234 122.592 0.642 1 1 2086 . 2 1 1 A 259 259 ALA H H 259 9.117 9.011 0.106 1 1 2087 . 2 1 1 A 259 259 ALA HA H 259 4.790 4.711 0.079 1 1 2091 . 2 1 1 A 259 259 ALA N N 259 123.901 124.811 -0.910 1 1 2092 . 2 1 1 A 260 260 LYS H H 260 8.452 8.421 0.031 1 1 2093 . 2 1 1 A 260 260 LYS HA H 260 5.914 4.875 1.039 1 1 2098 . 2 1 1 A 260 260 LYS CA C 260 51.818 54.388 -2.570 1 1 2099 . 2 1 1 A 260 260 LYS N N 260 116.464 116.849 -0.385 1 1 1 . 3 1 1 A 9 9 SER H H 9 8.293 8.529 -0.236 1 1 2 . 3 1 1 A 9 9 SER HA H 9 4.432 5.246 -0.814 1 1 3 . 3 1 1 A 9 9 SER N N 9 116.407 116.065 0.342 1 1 4 . 3 1 1 A 10 10 GLY H H 10 8.472 8.329 0.143 1 1 5 . 3 1 1 A 10 10 GLY N N 10 111.611 108.982 2.629 1 1 6 . 3 1 1 A 14 14 VAL H H 14 8.009 7.835 0.174 1 1 7 . 3 1 1 A 14 14 VAL HA H 14 4.128 4.180 -0.052 1 1 15 . 3 1 1 A 14 14 VAL CA C 14 59.473 62.393 -2.920 1 1 16 . 3 1 1 A 14 14 VAL CB C 14 30.127 32.534 -2.407 1 1 17 . 3 1 1 A 14 14 VAL N N 14 119.846 120.368 -0.522 1 1 18 . 3 1 1 A 15 15 THR H H 15 8.152 8.235 -0.083 1 1 19 . 3 1 1 A 15 15 THR HA H 15 4.346 4.500 -0.154 1 1 24 . 3 1 1 A 15 15 THR N N 15 118.509 117.274 1.235 1 1 25 . 3 1 1 A 16 16 ALA H H 16 8.207 8.600 -0.393 1 1 26 . 3 1 1 A 16 16 ALA HA H 16 4.319 4.125 0.194 1 1 30 . 3 1 1 A 16 16 ALA CA C 16 49.835 53.736 -3.901 1 1 31 . 3 1 1 A 16 16 ALA CB C 16 16.714 18.440 -1.726 1 1 32 . 3 1 1 A 16 16 ALA N N 16 126.935 127.362 -0.427 1 1 33 . 3 1 1 A 17 17 ASP H H 17 8.269 7.868 0.401 1 1 34 . 3 1 1 A 17 17 ASP HA H 17 4.581 4.985 -0.404 1 1 37 . 3 1 1 A 17 17 ASP CA C 17 51.643 53.045 -1.402 1 1 38 . 3 1 1 A 17 17 ASP CB C 17 38.257 41.351 -3.094 1 1 39 . 3 1 1 A 17 17 ASP N N 17 120.379 118.249 2.130 1 1 40 . 3 1 1 A 18 18 ILE H H 18 7.979 8.483 -0.504 1 1 41 . 3 1 1 A 18 18 ILE HA H 18 4.178 3.768 0.410 1 1 48 . 3 1 1 A 18 18 ILE CA C 18 58.737 65.124 -6.387 1 1 49 . 3 1 1 A 18 18 ILE CB C 18 36.077 37.783 -1.706 1 1 53 . 3 1 1 A 18 18 ILE N N 18 121.171 122.368 -1.197 1 1 54 . 3 1 1 A 19 19 GLY H H 19 8.410 8.140 0.270 1 1 55 . 3 1 1 A 19 19 GLY HA2 H 19 4.023 3.673 0.350 1 1 56 . 3 1 1 A 19 19 GLY HA3 H 19 4.023 3.677 0.346 1 1 57 . 3 1 1 A 19 19 GLY N N 19 112.246 108.257 3.989 1 1 58 . 3 1 1 A 20 20 THR H H 20 8.005 8.115 -0.110 1 1 59 . 3 1 1 A 20 20 THR HA H 20 4.463 4.074 0.389 1 1 64 . 3 1 1 A 20 20 THR CB C 20 66.723 68.507 -1.784 1 1 66 . 3 1 1 A 20 20 THR N N 20 112.239 116.582 -4.343 1 1 67 . 3 1 1 A 21 21 GLY H H 21 8.500 8.478 0.022 1 1 68 . 3 1 1 A 21 21 GLY HA2 H 21 4.099 3.916 0.183 1 1 69 . 3 1 1 A 21 21 GLY HA3 H 21 3.872 3.919 -0.047 1 1 70 . 3 1 1 A 21 21 GLY N N 21 111.048 111.833 -0.785 1 1 71 . 3 1 1 A 22 22 LEU H H 22 7.427 7.473 -0.046 1 1 72 . 3 1 1 A 22 22 LEU HA H 22 3.884 4.101 -0.217 1 1 84 . 3 1 1 A 22 22 LEU N N 22 118.837 119.195 -0.358 1 1 85 . 3 1 1 A 23 23 ALA H H 23 7.896 8.086 -0.190 1 1 86 . 3 1 1 A 23 23 ALA HA H 23 4.023 4.117 -0.094 1 1 90 . 3 1 1 A 23 23 ALA CA C 23 52.584 54.159 -1.575 1 1 91 . 3 1 1 A 23 23 ALA CB C 23 15.470 18.376 -2.906 1 1 92 . 3 1 1 A 23 23 ALA N N 23 119.194 122.092 -2.898 1 1 93 . 3 1 1 A 24 24 ASP H H 24 8.265 7.503 0.762 1 1 94 . 3 1 1 A 24 24 ASP HA H 24 4.337 4.538 -0.201 1 1 97 . 3 1 1 A 24 24 ASP CB C 24 37.029 41.168 -4.139 1 1 98 . 3 1 1 A 24 24 ASP N N 24 119.035 116.470 2.565 1 1 99 . 3 1 1 A 25 25 ALA H H 25 8.211 8.410 -0.199 1 1 100 . 3 1 1 A 25 25 ALA HA H 25 4.064 4.814 -0.750 1 1 104 . 3 1 1 A 25 25 ALA CA C 25 53.278 53.485 -0.207 1 1 105 . 3 1 1 A 25 25 ALA CB C 25 15.760 18.912 -3.152 1 1 106 . 3 1 1 A 25 25 ALA N N 25 122.434 121.142 1.292 1 1 107 . 3 1 1 A 26 26 LEU H H 26 7.334 7.415 -0.081 1 1 108 . 3 1 1 A 26 26 LEU HA H 26 4.351 4.380 -0.029 1 1 117 . 3 1 1 A 26 26 LEU N N 26 114.238 115.013 -0.775 1 1 118 . 3 1 1 A 27 27 THR H H 27 7.708 7.961 -0.253 1 1 119 . 3 1 1 A 27 27 THR HA H 27 4.492 4.540 -0.048 1 1 124 . 3 1 1 A 27 27 THR CA C 27 59.438 62.351 -2.913 1 1 125 . 3 1 1 A 27 27 THR CB C 27 68.796 70.152 -1.356 1 1 127 . 3 1 1 A 27 27 THR N N 27 106.430 111.679 -5.249 1 1 128 . 3 1 1 A 28 28 ALA H H 28 8.906 7.834 1.072 1 1 129 . 3 1 1 A 28 28 ALA HA H 28 4.812 4.689 0.123 1 1 133 . 3 1 1 A 28 28 ALA CB C 28 16.724 19.512 -2.788 1 1 134 . 3 1 1 A 28 28 ALA N N 28 128.420 123.754 4.666 1 1 135 . 3 1 1 A 29 29 PRO CA C 29 59.166 62.199 -3.033 1 1 136 . 3 1 1 A 29 29 PRO CB C 29 29.865 32.928 -3.063 1 1 139 . 3 1 1 A 30 30 LEU H H 30 8.204 8.308 -0.104 1 1 140 . 3 1 1 A 30 30 LEU HA H 30 4.052 4.142 -0.090 1 1 150 . 3 1 1 A 30 30 LEU N N 30 121.970 122.334 -0.364 1 1 151 . 3 1 1 A 31 31 ASP H H 31 8.720 8.872 -0.152 1 1 152 . 3 1 1 A 31 31 ASP HA H 31 4.772 4.922 -0.150 1 1 155 . 3 1 1 A 31 31 ASP CA C 31 50.115 54.213 -4.098 1 1 156 . 3 1 1 A 31 31 ASP N N 31 125.105 126.333 -1.228 1 1 157 . 3 1 1 A 32 32 HIS CA C 32 55.083 58.403 -3.320 1 1 158 . 3 1 1 A 32 32 HIS CB C 32 25.707 30.172 -4.465 1 1 159 . 3 1 1 A 33 33 LYS H H 33 8.589 7.792 0.797 1 1 160 . 3 1 1 A 33 33 LYS HA H 33 4.112 4.208 -0.096 1 1 167 . 3 1 1 A 33 33 LYS CB C 33 29.218 32.257 -3.039 1 1 169 . 3 1 1 A 33 33 LYS N N 33 118.920 117.231 1.689 1 1 170 . 3 1 1 A 34 34 ASP H H 34 7.420 7.509 -0.089 1 1 171 . 3 1 1 A 34 34 ASP HA H 34 4.368 4.791 -0.423 1 1 174 . 3 1 1 A 34 34 ASP N N 34 120.940 119.310 1.630 1 1 175 . 3 1 1 A 35 35 LYS H H 35 8.266 8.533 -0.267 1 1 176 . 3 1 1 A 35 35 LYS HA H 35 4.169 4.655 -0.486 1 1 183 . 3 1 1 A 35 35 LYS N N 35 121.280 117.545 3.735 1 1 184 . 3 1 1 A 36 36 GLY H H 36 8.716 7.802 0.914 1 1 185 . 3 1 1 A 36 36 GLY HA2 H 36 3.822 3.991 -0.169 1 1 186 . 3 1 1 A 36 36 GLY HA3 H 36 3.618 3.997 -0.379 1 1 187 . 3 1 1 A 36 36 GLY N N 36 111.002 108.981 2.021 1 1 188 . 3 1 1 A 37 37 LEU H H 37 8.032 8.242 -0.210 1 1 189 . 3 1 1 A 37 37 LEU HA H 37 4.406 4.299 0.107 1 1 198 . 3 1 1 A 37 37 LEU N N 37 127.683 124.324 3.359 1 1 199 . 3 1 1 A 38 38 LYS H H 38 9.190 8.961 0.229 1 1 200 . 3 1 1 A 38 38 LYS HA H 38 3.925 4.465 -0.540 1 1 205 . 3 1 1 A 38 38 LYS N N 38 132.634 124.331 8.303 1 1 206 . 3 1 1 A 39 39 SER H H 39 7.161 7.693 -0.532 1 1 207 . 3 1 1 A 39 39 SER HA H 39 5.097 4.599 0.498 1 1 210 . 3 1 1 A 39 39 SER CA C 39 54.451 57.686 -3.235 1 1 211 . 3 1 1 A 39 39 SER N N 39 110.262 109.801 0.461 1 1 212 . 3 1 1 A 40 40 LEU H H 40 8.142 8.951 -0.809 1 1 213 . 3 1 1 A 40 40 LEU HA H 40 4.481 4.832 -0.351 1 1 223 . 3 1 1 A 40 40 LEU N N 40 122.761 122.042 0.719 1 1 224 . 3 1 1 A 41 41 THR H H 41 8.641 8.791 -0.150 1 1 225 . 3 1 1 A 41 41 THR HA H 41 4.141 5.200 -1.059 1 1 230 . 3 1 1 A 41 41 THR CA C 41 60.301 62.061 -1.760 1 1 231 . 3 1 1 A 41 41 THR CB C 41 65.862 69.441 -3.579 1 1 233 . 3 1 1 A 41 41 THR N N 41 124.142 120.564 3.578 1 1 234 . 3 1 1 A 42 42 LEU H H 42 8.586 8.620 -0.034 1 1 235 . 3 1 1 A 42 42 LEU HA H 42 4.337 4.651 -0.314 1 1 247 . 3 1 1 A 42 42 LEU N N 42 128.603 124.580 4.023 1 1 248 . 3 1 1 A 43 43 GLU H H 43 8.644 9.118 -0.474 1 1 249 . 3 1 1 A 43 43 GLU HA H 43 4.663 4.483 0.180 1 1 253 . 3 1 1 A 43 43 GLU N N 43 124.180 121.882 2.298 1 1 254 . 3 1 1 A 44 44 ASP H H 44 10.243 8.029 2.214 1 1 255 . 3 1 1 A 44 44 ASP HA H 44 4.518 4.873 -0.355 1 1 258 . 3 1 1 A 44 44 ASP CA C 44 52.879 53.276 -0.397 1 1 259 . 3 1 1 A 44 44 ASP CB C 44 37.711 42.023 -4.312 1 1 260 . 3 1 1 A 44 44 ASP N N 44 124.177 119.386 4.791 1 1 261 . 3 1 1 A 45 45 SER H H 45 8.546 8.152 0.394 1 1 262 . 3 1 1 A 45 45 SER HA H 45 3.850 4.175 -0.325 1 1 265 . 3 1 1 A 45 45 SER CA C 45 59.588 61.750 -2.162 1 1 266 . 3 1 1 A 45 45 SER CB C 45 61.660 63.246 -1.586 1 1 267 . 3 1 1 A 45 45 SER N N 45 116.191 115.935 0.256 1 1 268 . 3 1 1 A 46 46 ILE H H 46 6.902 7.779 -0.877 1 1 269 . 3 1 1 A 46 46 ILE HA H 46 3.874 4.660 -0.786 1 1 279 . 3 1 1 A 46 46 ILE CA C 46 57.605 60.295 -2.690 1 1 280 . 3 1 1 A 46 46 ILE CB C 46 36.694 39.397 -2.703 1 1 283 . 3 1 1 A 46 46 ILE N N 46 116.189 119.956 -3.767 1 1 284 . 3 1 1 A 47 47 SER H H 47 7.804 8.252 -0.448 1 1 285 . 3 1 1 A 47 47 SER HA H 47 4.342 4.737 -0.395 1 1 288 . 3 1 1 A 47 47 SER CA C 47 55.995 56.499 -0.504 1 1 289 . 3 1 1 A 47 47 SER N N 47 118.738 116.896 1.842 1 1 290 . 3 1 1 A 48 48 GLN H H 48 8.522 8.670 -0.148 1 1 291 . 3 1 1 A 48 48 GLN HA H 48 3.939 3.986 -0.047 1 1 296 . 3 1 1 A 48 48 GLN CA C 48 55.111 57.847 -2.736 1 1 298 . 3 1 1 A 48 48 GLN N N 48 119.475 122.634 -3.159 1 1 299 . 3 1 1 A 49 49 ASN H H 49 8.437 8.610 -0.173 1 1 300 . 3 1 1 A 49 49 ASN HA H 49 4.693 4.453 0.240 1 1 305 . 3 1 1 A 49 49 ASN CA C 49 50.839 56.075 -5.236 1 1 306 . 3 1 1 A 49 49 ASN CB C 49 35.767 38.189 -2.422 1 1 307 . 3 1 1 A 49 49 ASN N N 49 117.233 117.900 -0.667 1 1 309 . 3 1 1 A 50 50 GLY H H 50 7.952 7.539 0.413 1 1 310 . 3 1 1 A 50 50 GLY HA2 H 50 4.518 4.175 0.343 1 1 311 . 3 1 1 A 50 50 GLY HA3 H 50 4.054 4.181 -0.127 1 1 312 . 3 1 1 A 50 50 GLY CA C 50 41.883 46.148 -4.265 1 1 313 . 3 1 1 A 50 50 GLY N N 50 108.751 105.974 2.777 1 1 314 . 3 1 1 A 51 51 THR H H 51 8.548 8.204 0.344 1 1 315 . 3 1 1 A 51 51 THR HA H 51 5.012 5.151 -0.139 1 1 320 . 3 1 1 A 51 51 THR CA C 51 57.026 60.500 -3.474 1 1 321 . 3 1 1 A 51 51 THR CB C 51 69.887 72.016 -2.129 1 1 323 . 3 1 1 A 51 51 THR N N 51 108.710 113.514 -4.804 1 1 324 . 3 1 1 A 52 52 LEU H H 52 9.110 9.140 -0.030 1 1 325 . 3 1 1 A 52 52 LEU HA H 52 5.183 5.611 -0.428 1 1 333 . 3 1 1 A 52 52 LEU CA C 52 50.822 53.506 -2.684 1 1 335 . 3 1 1 A 52 52 LEU N N 52 124.606 116.528 8.078 1 1 336 . 3 1 1 A 53 53 THR H H 53 9.312 8.884 0.428 1 1 337 . 3 1 1 A 53 53 THR HA H 53 5.288 4.780 0.508 1 1 342 . 3 1 1 A 53 53 THR CA C 53 59.535 62.120 -2.585 1 1 343 . 3 1 1 A 53 53 THR CB C 53 66.838 70.343 -3.505 1 1 345 . 3 1 1 A 53 53 THR N N 53 125.445 119.555 5.890 1 1 346 . 3 1 1 A 54 54 LEU H H 54 8.992 8.891 0.101 1 1 347 . 3 1 1 A 54 54 LEU HA H 54 5.563 5.636 -0.073 1 1 357 . 3 1 1 A 54 54 LEU N N 54 128.814 121.757 7.057 1 1 358 . 3 1 1 A 55 55 SER H H 55 9.017 9.062 -0.045 1 1 359 . 3 1 1 A 55 55 SER HA H 55 5.476 5.209 0.267 1 1 362 . 3 1 1 A 55 55 SER CA C 55 53.944 57.637 -3.693 1 1 363 . 3 1 1 A 55 55 SER CB C 55 63.384 64.829 -1.445 1 1 364 . 3 1 1 A 55 55 SER N N 55 112.964 119.366 -6.402 1 1 365 . 3 1 1 A 56 56 ALA H H 56 8.324 10.608 -2.284 1 1 366 . 3 1 1 A 56 56 ALA HA H 56 4.605 4.798 -0.193 1 1 370 . 3 1 1 A 56 56 ALA CA C 56 50.743 50.045 0.698 1 1 371 . 3 1 1 A 56 56 ALA CB C 56 21.372 20.916 0.456 1 1 372 . 3 1 1 A 56 56 ALA N N 56 123.555 126.897 -3.342 1 1 373 . 3 1 1 A 57 57 GLN H H 57 9.080 8.589 0.491 1 1 374 . 3 1 1 A 57 57 GLN HA H 57 3.884 4.500 -0.616 1 1 381 . 3 1 1 A 57 57 GLN CA C 57 53.331 55.989 -2.658 1 1 382 . 3 1 1 A 57 57 GLN CB C 57 24.659 27.517 -2.858 1 1 384 . 3 1 1 A 57 57 GLN N N 57 116.815 114.973 1.842 1 1 386 . 3 1 1 A 58 58 GLY H H 58 8.527 7.964 0.563 1 1 387 . 3 1 1 A 58 58 GLY HA2 H 58 4.168 4.049 0.119 1 1 388 . 3 1 1 A 58 58 GLY HA3 H 58 3.608 4.052 -0.444 1 1 389 . 3 1 1 A 58 58 GLY CA C 58 42.856 45.577 -2.721 1 1 390 . 3 1 1 A 58 58 GLY N N 58 105.983 107.145 -1.162 1 1 391 . 3 1 1 A 59 59 ALA H H 59 8.203 7.691 0.512 1 1 392 . 3 1 1 A 59 59 ALA HA H 59 4.811 4.600 0.211 1 1 396 . 3 1 1 A 59 59 ALA CA C 59 47.662 51.457 -3.795 1 1 397 . 3 1 1 A 59 59 ALA CB C 59 20.147 22.681 -2.534 1 1 398 . 3 1 1 A 59 59 ALA N N 59 125.153 121.437 3.716 1 1 399 . 3 1 1 A 60 60 GLU H H 60 8.154 8.995 -0.841 1 1 400 . 3 1 1 A 60 60 GLU HA H 60 5.508 5.513 -0.005 1 1 404 . 3 1 1 A 60 60 GLU CA C 60 52.179 54.140 -1.961 1 1 405 . 3 1 1 A 60 60 GLU CB C 60 30.203 34.777 -4.574 1 1 406 . 3 1 1 A 60 60 GLU N N 60 117.318 116.438 0.880 1 1 407 . 3 1 1 A 61 61 LYS H H 61 8.821 9.196 -0.375 1 1 408 . 3 1 1 A 61 61 LYS HA H 61 4.311 4.635 -0.324 1 1 413 . 3 1 1 A 61 61 LYS N N 61 123.743 120.406 3.337 1 1 414 . 3 1 1 A 62 62 THR H H 62 8.149 8.620 -0.471 1 1 415 . 3 1 1 A 62 62 THR HA H 62 4.928 4.559 0.369 1 1 420 . 3 1 1 A 62 62 THR CA C 62 59.427 62.777 -3.350 1 1 421 . 3 1 1 A 62 62 THR CB C 62 66.932 69.687 -2.755 1 1 422 . 3 1 1 A 62 62 THR N N 62 122.829 119.865 2.964 1 1 423 . 3 1 1 A 63 63 TYR H H 63 9.466 8.877 0.589 1 1 424 . 3 1 1 A 63 63 TYR HA H 63 4.606 5.100 -0.494 1 1 431 . 3 1 1 A 63 63 TYR CA C 63 54.508 55.551 -1.043 1 1 432 . 3 1 1 A 63 63 TYR N N 63 127.472 125.765 1.707 1 1 433 . 3 1 1 A 64 64 GLY H H 64 9.253 8.806 0.447 1 1 434 . 3 1 1 A 64 64 GLY HA2 H 64 4.670 4.196 0.474 1 1 435 . 3 1 1 A 64 64 GLY HA3 H 64 3.619 4.232 -0.613 1 1 436 . 3 1 1 A 64 64 GLY CA C 64 39.885 43.926 -4.041 1 1 437 . 3 1 1 A 64 64 GLY N N 64 110.182 112.063 -1.881 1 1 438 . 3 1 1 A 65 65 ASN H H 65 8.616 8.625 -0.009 1 1 439 . 3 1 1 A 65 65 ASN HA H 65 4.109 4.412 -0.303 1 1 444 . 3 1 1 A 65 65 ASN CA C 65 53.691 54.899 -1.208 1 1 445 . 3 1 1 A 65 65 ASN N N 65 117.778 118.848 -1.070 1 1 447 . 3 1 1 A 66 66 GLY H H 66 9.053 8.989 0.064 1 1 448 . 3 1 1 A 66 66 GLY HA2 H 66 4.344 3.902 0.442 1 1 449 . 3 1 1 A 66 66 GLY HA3 H 66 3.359 3.915 -0.556 1 1 450 . 3 1 1 A 66 66 GLY CA C 66 42.431 44.936 -2.505 1 1 451 . 3 1 1 A 66 66 GLY N N 66 115.232 114.384 0.848 1 1 452 . 3 1 1 A 67 67 ASP H H 67 8.120 8.732 -0.612 1 1 453 . 3 1 1 A 67 67 ASP HA H 67 4.844 4.253 0.591 1 1 456 . 3 1 1 A 67 67 ASP N N 67 122.593 121.379 1.214 1 1 457 . 3 1 1 A 68 68 SER H H 68 8.500 8.363 0.137 1 1 458 . 3 1 1 A 68 68 SER HA H 68 5.088 5.194 -0.106 1 1 461 . 3 1 1 A 68 68 SER CA C 68 54.858 56.250 -1.392 1 1 462 . 3 1 1 A 68 68 SER CB C 68 62.114 67.115 -5.001 1 1 463 . 3 1 1 A 68 68 SER N N 68 113.557 117.088 -3.531 1 1 464 . 3 1 1 A 69 69 LEU H H 69 8.989 9.507 -0.518 1 1 465 . 3 1 1 A 69 69 LEU HA H 69 4.570 5.253 -0.683 1 1 474 . 3 1 1 A 69 69 LEU N N 69 126.836 123.172 3.664 1 1 475 . 3 1 1 A 70 70 ASN H H 70 8.491 8.940 -0.449 1 1 476 . 3 1 1 A 70 70 ASN HA H 70 4.958 5.483 -0.525 1 1 479 . 3 1 1 A 70 70 ASN CB C 70 33.265 40.370 -7.105 1 1 480 . 3 1 1 A 70 70 ASN N N 70 126.343 119.482 6.861 1 1 481 . 3 1 1 A 71 71 THR H H 71 7.831 8.508 -0.677 1 1 482 . 3 1 1 A 71 71 THR HA H 71 3.759 4.777 -1.018 1 1 487 . 3 1 1 A 71 71 THR CA C 71 61.005 60.085 0.920 1 1 488 . 3 1 1 A 71 71 THR N N 71 114.742 114.352 0.390 1 1 489 . 3 1 1 A 72 72 GLY H H 72 8.880 8.469 0.411 1 1 490 . 3 1 1 A 72 72 GLY HA2 H 72 3.907 3.868 0.039 1 1 491 . 3 1 1 A 72 72 GLY HA3 H 72 3.907 3.872 0.035 1 1 492 . 3 1 1 A 72 72 GLY N N 72 114.976 110.295 4.681 1 1 493 . 3 1 1 A 73 73 LYS H H 73 6.604 7.876 -1.272 1 1 494 . 3 1 1 A 73 73 LYS HA H 73 4.160 4.201 -0.041 1 1 501 . 3 1 1 A 73 73 LYS N N 73 113.898 119.468 -5.570 1 1 502 . 3 1 1 A 74 74 LEU H H 74 7.422 7.597 -0.175 1 1 503 . 3 1 1 A 74 74 LEU HA H 74 4.358 4.234 0.124 1 1 513 . 3 1 1 A 74 74 LEU N N 74 117.180 121.519 -4.339 1 1 514 . 3 1 1 A 75 75 LYS H H 75 8.617 8.618 -0.001 1 1 515 . 3 1 1 A 75 75 LYS HA H 75 4.079 4.726 -0.647 1 1 518 . 3 1 1 A 75 75 LYS N N 75 121.119 120.958 0.161 1 1 519 . 3 1 1 A 76 76 ASN H H 76 8.154 8.773 -0.619 1 1 520 . 3 1 1 A 76 76 ASN HA H 76 3.935 4.836 -0.901 1 1 525 . 3 1 1 A 76 76 ASN CB C 76 35.772 38.930 -3.158 1 1 526 . 3 1 1 A 76 76 ASN N N 76 122.761 119.182 3.579 1 1 527 . 3 1 1 A 77 77 ASP H H 77 9.227 7.822 1.405 1 1 528 . 3 1 1 A 77 77 ASP HA H 77 3.787 5.245 -1.458 1 1 531 . 3 1 1 A 77 77 ASP CA C 77 52.584 53.319 -0.735 1 1 532 . 3 1 1 A 77 77 ASP N N 77 114.129 118.419 -4.290 1 1 533 . 3 1 1 A 78 78 LYS H H 78 6.579 8.425 -1.846 1 1 534 . 3 1 1 A 78 78 LYS HA H 78 4.572 4.982 -0.410 1 1 539 . 3 1 1 A 78 78 LYS CA C 78 51.072 54.559 -3.487 1 1 540 . 3 1 1 A 78 78 LYS CB C 78 33.783 37.051 -3.268 1 1 541 . 3 1 1 A 78 78 LYS N N 78 114.135 121.765 -7.630 1 1 542 . 3 1 1 A 79 79 VAL H H 79 8.729 8.289 0.440 1 1 543 . 3 1 1 A 79 79 VAL HA H 79 4.402 4.617 -0.215 1 1 551 . 3 1 1 A 79 79 VAL CA C 79 59.240 59.896 -0.656 1 1 553 . 3 1 1 A 79 79 VAL N N 79 123.191 120.478 2.713 1 1 554 . 3 1 1 A 80 80 SER H H 80 9.542 9.814 -0.272 1 1 555 . 3 1 1 A 80 80 SER HA H 80 4.636 5.067 -0.431 1 1 558 . 3 1 1 A 80 80 SER CA C 80 55.978 57.253 -1.275 1 1 559 . 3 1 1 A 80 80 SER N N 80 127.445 121.980 5.465 1 1 560 . 3 1 1 A 81 81 ARG H H 81 8.093 8.739 -0.646 1 1 561 . 3 1 1 A 81 81 ARG HA H 81 5.210 5.699 -0.489 1 1 569 . 3 1 1 A 81 81 ARG N N 81 123.743 123.764 -0.021 1 1 571 . 3 1 1 A 82 82 PHE H H 82 9.312 8.097 1.215 1 1 572 . 3 1 1 A 82 82 PHE HA H 82 4.951 5.094 -0.143 1 1 577 . 3 1 1 A 82 82 PHE CA C 82 53.090 56.026 -2.936 1 1 578 . 3 1 1 A 82 82 PHE N N 82 119.529 116.501 3.028 1 1 579 . 3 1 1 A 83 83 ASP H H 83 9.122 8.516 0.606 1 1 580 . 3 1 1 A 83 83 ASP HA H 83 5.593 5.082 0.511 1 1 583 . 3 1 1 A 83 83 ASP N N 83 123.825 119.954 3.871 1 1 584 . 3 1 1 A 84 84 PHE H H 84 9.090 8.198 0.892 1 1 585 . 3 1 1 A 84 84 PHE HA H 84 6.410 6.354 0.056 1 1 592 . 3 1 1 A 84 84 PHE CA C 84 52.584 55.495 -2.911 1 1 593 . 3 1 1 A 84 84 PHE N N 84 118.862 119.162 -0.300 1 1 594 . 3 1 1 A 85 85 ILE H H 85 8.441 9.181 -0.740 1 1 595 . 3 1 1 A 85 85 ILE HA H 85 4.662 5.504 -0.842 1 1 605 . 3 1 1 A 85 85 ILE CB C 85 39.939 40.302 -0.363 1 1 608 . 3 1 1 A 85 85 ILE N N 85 118.049 120.713 -2.664 1 1 609 . 3 1 1 A 86 86 ARG H H 86 8.983 9.132 -0.149 1 1 610 . 3 1 1 A 86 86 ARG HA H 86 5.591 4.834 0.757 1 1 616 . 3 1 1 A 86 86 ARG N N 86 127.006 127.776 -0.770 1 1 618 . 3 1 1 A 87 87 GLN H H 87 8.643 8.533 0.110 1 1 619 . 3 1 1 A 87 87 GLN HA H 87 5.630 5.326 0.304 1 1 626 . 3 1 1 A 87 87 GLN CA C 87 51.512 54.456 -2.944 1 1 627 . 3 1 1 A 87 87 GLN N N 87 124.142 122.219 1.923 1 1 629 . 3 1 1 A 88 88 ILE H H 88 8.617 8.298 0.319 1 1 630 . 3 1 1 A 88 88 ILE HA H 88 4.690 4.914 -0.224 1 1 637 . 3 1 1 A 88 88 ILE CA C 88 56.995 59.760 -2.765 1 1 638 . 3 1 1 A 88 88 ILE CB C 88 39.927 41.866 -1.939 1 1 641 . 3 1 1 A 88 88 ILE N N 88 116.353 121.311 -4.958 1 1 642 . 3 1 1 A 89 89 GLU H H 89 8.298 8.667 -0.369 1 1 643 . 3 1 1 A 89 89 GLU HA H 89 5.100 4.971 0.129 1 1 646 . 3 1 1 A 89 89 GLU CA C 89 52.204 54.882 -2.678 1 1 647 . 3 1 1 A 89 89 GLU CB C 89 27.325 32.313 -4.988 1 1 648 . 3 1 1 A 89 89 GLU N N 89 124.458 121.819 2.639 1 1 649 . 3 1 1 A 90 90 VAL H H 90 8.957 8.748 0.209 1 1 650 . 3 1 1 A 90 90 VAL HA H 90 4.169 3.970 0.199 1 1 658 . 3 1 1 A 90 90 VAL CA C 90 58.664 63.682 -5.018 1 1 659 . 3 1 1 A 90 90 VAL CB C 90 31.861 31.959 -0.098 1 1 660 . 3 1 1 A 90 90 VAL N N 90 127.580 125.651 1.929 1 1 661 . 3 1 1 A 91 91 ASP H H 91 9.369 9.214 0.155 1 1 662 . 3 1 1 A 91 91 ASP HA H 91 4.287 4.333 -0.046 1 1 665 . 3 1 1 A 91 91 ASP CA C 91 52.389 57.228 -4.839 1 1 666 . 3 1 1 A 91 91 ASP CB C 91 36.409 40.580 -4.171 1 1 667 . 3 1 1 A 91 91 ASP N N 91 129.411 128.326 1.085 1 1 668 . 3 1 1 A 92 92 GLY H H 92 8.552 7.945 0.607 1 1 669 . 3 1 1 A 92 92 GLY HA2 H 92 4.090 4.096 -0.006 1 1 670 . 3 1 1 A 92 92 GLY HA3 H 92 3.618 4.096 -0.478 1 1 671 . 3 1 1 A 92 92 GLY CA C 92 42.836 45.344 -2.508 1 1 672 . 3 1 1 A 92 92 GLY N N 92 103.862 105.728 -1.866 1 1 673 . 3 1 1 A 93 93 GLN H H 93 7.808 9.331 -1.523 1 1 674 . 3 1 1 A 93 93 GLN HA H 93 4.578 4.755 -0.177 1 1 679 . 3 1 1 A 93 93 GLN CA C 93 50.918 54.326 -3.408 1 1 680 . 3 1 1 A 93 93 GLN CB C 93 28.602 31.978 -3.376 1 1 682 . 3 1 1 A 93 93 GLN N N 93 120.412 117.399 3.013 1 1 683 . 3 1 1 A 94 94 LEU H H 94 8.414 8.543 -0.129 1 1 684 . 3 1 1 A 94 94 LEU HA H 94 4.704 5.106 -0.402 1 1 693 . 3 1 1 A 94 94 LEU CB C 94 39.873 44.032 -4.159 1 1 696 . 3 1 1 A 94 94 LEU N N 94 125.061 118.748 6.313 1 1 697 . 3 1 1 A 95 95 ILE H H 95 9.181 8.335 0.846 1 1 698 . 3 1 1 A 95 95 ILE HA H 95 4.371 4.591 -0.220 1 1 708 . 3 1 1 A 95 95 ILE CA C 95 63.319 59.731 3.588 1 1 709 . 3 1 1 A 95 95 ILE CB C 95 37.407 42.581 -5.174 1 1 711 . 3 1 1 A 95 95 ILE N N 95 127.724 118.968 8.756 1 1 712 . 3 1 1 A 96 96 THR H H 96 8.730 8.628 0.102 1 1 713 . 3 1 1 A 96 96 THR HA H 96 4.411 4.401 0.010 1 1 718 . 3 1 1 A 96 96 THR CA C 96 60.344 63.254 -2.910 1 1 719 . 3 1 1 A 96 96 THR CB C 96 59.719 69.477 -9.758 1 1 720 . 3 1 1 A 96 96 THR N N 96 124.240 117.218 7.022 1 1 721 . 3 1 1 A 97 97 LEU H H 97 8.790 8.804 -0.014 1 1 722 . 3 1 1 A 97 97 LEU HA H 97 4.400 5.072 -0.672 1 1 732 . 3 1 1 A 97 97 LEU N N 97 126.147 123.676 2.471 1 1 733 . 3 1 1 A 98 98 GLU H H 98 7.596 9.883 -2.287 1 1 734 . 3 1 1 A 98 98 GLU HA H 98 5.102 4.949 0.153 1 1 739 . 3 1 1 A 98 98 GLU N N 98 116.937 123.299 -6.362 1 1 740 . 3 1 1 A 99 99 SER H H 99 8.906 8.179 0.727 1 1 741 . 3 1 1 A 99 99 SER HA H 99 4.504 5.424 -0.920 1 1 744 . 3 1 1 A 99 99 SER CA C 99 54.010 56.438 -2.428 1 1 745 . 3 1 1 A 99 99 SER CB C 99 63.876 65.701 -1.825 1 1 746 . 3 1 1 A 99 99 SER N N 99 117.823 117.252 0.571 1 1 747 . 3 1 1 A 100 100 GLY H H 100 7.250 8.420 -1.170 1 1 748 . 3 1 1 A 100 100 GLY HA2 H 100 4.872 4.098 0.774 1 1 749 . 3 1 1 A 100 100 GLY HA3 H 100 3.731 4.187 -0.456 1 1 750 . 3 1 1 A 100 100 GLY N N 100 109.436 112.224 -2.788 1 1 751 . 3 1 1 A 101 101 GLU H H 101 9.661 8.445 1.216 1 1 752 . 3 1 1 A 101 101 GLU HA H 101 5.643 4.765 0.878 1 1 757 . 3 1 1 A 101 101 GLU CA C 101 52.584 54.963 -2.379 1 1 758 . 3 1 1 A 101 101 GLU CB C 101 31.750 32.477 -0.727 1 1 759 . 3 1 1 A 101 101 GLU N N 101 126.793 120.488 6.305 1 1 760 . 3 1 1 A 102 102 PHE H H 102 10.441 9.364 1.077 1 1 761 . 3 1 1 A 102 102 PHE HA H 102 5.248 5.099 0.149 1 1 768 . 3 1 1 A 102 102 PHE CA C 102 53.537 56.376 -2.839 1 1 769 . 3 1 1 A 102 102 PHE N N 102 131.837 126.707 5.130 1 1 770 . 3 1 1 A 103 103 GLN H H 103 9.135 9.608 -0.473 1 1 771 . 3 1 1 A 103 103 GLN HA H 103 5.205 4.900 0.305 1 1 776 . 3 1 1 A 103 103 GLN CA C 103 50.925 54.819 -3.894 1 1 777 . 3 1 1 A 103 103 GLN N N 103 127.720 126.202 1.518 1 1 778 . 3 1 1 A 104 104 VAL H H 104 8.937 8.724 0.213 1 1 779 . 3 1 1 A 104 104 VAL HA H 104 4.780 5.157 -0.377 1 1 787 . 3 1 1 A 104 104 VAL CA C 104 57.086 60.980 -3.894 1 1 789 . 3 1 1 A 104 104 VAL N N 104 120.097 126.259 -6.162 1 1 790 . 3 1 1 A 105 105 TYR H H 105 9.108 9.676 -0.568 1 1 791 . 3 1 1 A 105 105 TYR HA H 105 4.834 5.198 -0.364 1 1 798 . 3 1 1 A 105 105 TYR CA C 105 54.486 57.690 -3.204 1 1 799 . 3 1 1 A 105 105 TYR N N 105 128.426 126.641 1.785 1 1 800 . 3 1 1 A 106 106 LYS H H 106 5.945 8.742 -2.797 1 1 805 . 3 1 1 A 106 106 LYS N N 106 129.163 124.184 4.979 1 1 806 . 3 1 1 A 107 107 GLN H H 107 8.526 7.963 0.563 1 1 807 . 3 1 1 A 107 107 GLN HA H 107 5.160 4.698 0.462 1 1 812 . 3 1 1 A 107 107 GLN CA C 107 52.584 54.742 -2.158 1 1 813 . 3 1 1 A 107 107 GLN CB C 107 26.175 29.094 -2.919 1 1 814 . 3 1 1 A 107 107 GLN N N 107 125.978 120.920 5.058 1 1 815 . 3 1 1 A 108 108 SER H H 108 8.621 8.169 0.452 1 1 816 . 3 1 1 A 108 108 SER HA H 108 4.403 4.375 0.028 1 1 819 . 3 1 1 A 108 108 SER CA C 108 58.521 58.962 -0.441 1 1 820 . 3 1 1 A 108 108 SER CB C 108 60.737 63.480 -2.743 1 1 821 . 3 1 1 A 108 108 SER N N 108 117.542 115.339 2.203 1 1 822 . 3 1 1 A 109 109 HIS H H 109 10.381 8.055 2.326 1 1 823 . 3 1 1 A 109 109 HIS HA H 109 4.594 4.754 -0.160 1 1 828 . 3 1 1 A 109 109 HIS CA C 109 51.743 55.307 -3.564 1 1 829 . 3 1 1 A 109 109 HIS CB C 109 27.174 28.980 -1.806 1 1 830 . 3 1 1 A 109 109 HIS N N 109 118.449 119.379 -0.930 1 1 831 . 3 1 1 A 110 110 SER H H 110 7.366 7.699 -0.333 1 1 832 . 3 1 1 A 110 110 SER HA H 110 4.870 4.636 0.234 1 1 835 . 3 1 1 A 110 110 SER CB C 110 62.986 64.255 -1.269 1 1 836 . 3 1 1 A 110 110 SER N N 110 113.397 113.560 -0.163 1 1 837 . 3 1 1 A 111 111 ALA H H 111 8.541 8.530 0.011 1 1 838 . 3 1 1 A 111 111 ALA HA H 111 4.826 4.936 -0.110 1 1 842 . 3 1 1 A 111 111 ALA CA C 111 49.015 51.844 -2.829 1 1 843 . 3 1 1 A 111 111 ALA CB C 111 20.256 23.127 -2.871 1 1 844 . 3 1 1 A 111 111 ALA N N 111 117.786 124.467 -6.681 1 1 845 . 3 1 1 A 112 112 LEU H H 112 8.529 9.686 -1.157 1 1 846 . 3 1 1 A 112 112 LEU HA H 112 5.680 5.260 0.420 1 1 855 . 3 1 1 A 112 112 LEU CA C 112 51.818 52.902 -1.084 1 1 856 . 3 1 1 A 112 112 LEU N N 112 116.345 116.720 -0.375 1 1 857 . 3 1 1 A 113 113 THR H H 113 8.758 8.772 -0.014 1 1 858 . 3 1 1 A 113 113 THR HA H 113 5.563 5.229 0.334 1 1 863 . 3 1 1 A 113 113 THR CA C 113 54.458 60.861 -6.403 1 1 864 . 3 1 1 A 113 113 THR CB C 113 68.586 73.476 -4.890 1 1 866 . 3 1 1 A 113 113 THR N N 113 110.469 114.652 -4.183 1 1 867 . 3 1 1 A 114 114 ALA H H 114 8.829 8.651 0.178 1 1 868 . 3 1 1 A 114 114 ALA HA H 114 4.466 4.693 -0.227 1 1 872 . 3 1 1 A 114 114 ALA CA C 114 48.886 51.818 -2.932 1 1 873 . 3 1 1 A 114 114 ALA CB C 114 21.583 21.438 0.145 1 1 874 . 3 1 1 A 114 114 ALA N N 114 121.456 123.129 -1.673 1 1 875 . 3 1 1 A 115 115 LEU H H 115 8.407 9.017 -0.610 1 1 876 . 3 1 1 A 115 115 LEU HA H 115 4.814 4.680 0.134 1 1 886 . 3 1 1 A 115 115 LEU N N 115 119.223 124.000 -4.777 1 1 887 . 3 1 1 A 116 116 GLN H H 116 9.720 9.101 0.619 1 1 888 . 3 1 1 A 116 116 GLN HA H 116 5.312 5.273 0.039 1 1 893 . 3 1 1 A 116 116 GLN CA C 116 50.544 54.007 -3.463 1 1 894 . 3 1 1 A 116 116 GLN N N 116 127.827 121.387 6.440 1 1 895 . 3 1 1 A 117 117 THR H H 117 9.663 9.110 0.553 1 1 896 . 3 1 1 A 117 117 THR HA H 117 4.198 4.842 -0.644 1 1 901 . 3 1 1 A 117 117 THR CA C 117 64.037 60.755 3.282 1 1 902 . 3 1 1 A 117 117 THR CB C 117 66.868 72.847 -5.979 1 1 904 . 3 1 1 A 117 117 THR N N 117 128.929 118.350 10.579 1 1 905 . 3 1 1 A 118 118 GLU H H 118 9.486 9.140 0.346 1 1 906 . 3 1 1 A 118 118 GLU HA H 118 4.885 4.689 0.196 1 1 911 . 3 1 1 A 118 118 GLU N N 118 123.497 121.578 1.919 1 1 912 . 3 1 1 A 119 119 GLN H H 119 8.076 7.449 0.627 1 1 913 . 3 1 1 A 119 119 GLN HA H 119 5.331 4.804 0.527 1 1 916 . 3 1 1 A 119 119 GLN CA C 119 51.858 54.358 -2.500 1 1 917 . 3 1 1 A 119 119 GLN N N 119 118.023 117.687 0.336 1 1 918 . 3 1 1 A 120 120 GLU H H 120 9.078 8.568 0.510 1 1 919 . 3 1 1 A 120 120 GLU HA H 120 5.071 5.125 -0.054 1 1 924 . 3 1 1 A 120 120 GLU N N 120 118.433 120.235 -1.802 1 1 925 . 3 1 1 A 121 121 GLN H H 121 7.711 8.856 -1.145 1 1 926 . 3 1 1 A 121 121 GLN HA H 121 4.430 5.025 -0.595 1 1 933 . 3 1 1 A 121 121 GLN CA C 121 53.996 54.499 -0.503 1 1 934 . 3 1 1 A 121 121 GLN CB C 121 27.158 33.129 -5.971 1 1 936 . 3 1 1 A 121 121 GLN N N 121 122.412 122.605 -0.193 1 1 938 . 3 1 1 A 122 122 ASP H H 122 8.675 9.579 -0.904 1 1 939 . 3 1 1 A 122 122 ASP HA H 122 4.632 5.547 -0.915 1 1 942 . 3 1 1 A 122 122 ASP CA C 122 48.797 51.603 -2.806 1 1 943 . 3 1 1 A 122 122 ASP CB C 122 39.852 43.727 -3.875 1 1 944 . 3 1 1 A 122 122 ASP N N 122 128.625 123.012 5.613 1 1 945 . 3 1 1 A 123 123 PRO CA C 123 61.579 63.681 -2.102 1 1 946 . 3 1 1 A 123 123 PRO CB C 123 29.597 32.830 -3.233 1 1 948 . 3 1 1 A 124 124 GLU H H 124 8.297 8.555 -0.258 1 1 949 . 3 1 1 A 124 124 GLU HA H 124 4.196 4.561 -0.365 1 1 954 . 3 1 1 A 124 124 GLU CA C 124 53.025 57.181 -4.156 1 1 955 . 3 1 1 A 124 124 GLU CB C 124 27.927 30.432 -2.505 1 1 957 . 3 1 1 A 124 124 GLU N N 124 115.538 117.679 -2.141 1 1 958 . 3 1 1 A 125 125 HIS H H 125 7.419 8.168 -0.749 1 1 959 . 3 1 1 A 125 125 HIS HA H 125 4.833 4.734 0.099 1 1 964 . 3 1 1 A 125 125 HIS CA C 125 51.886 55.842 -3.956 1 1 965 . 3 1 1 A 125 125 HIS CB C 125 26.387 31.934 -5.547 1 1 966 . 3 1 1 A 125 125 HIS N N 125 117.464 114.719 2.745 1 1 967 . 3 1 1 A 126 126 SER H H 126 8.441 7.587 0.854 1 1 968 . 3 1 1 A 126 126 SER HA H 126 4.261 3.798 0.463 1 1 971 . 3 1 1 A 126 126 SER CA C 126 57.988 60.838 -2.850 1 1 972 . 3 1 1 A 126 126 SER N N 126 117.954 114.685 3.269 1 1 973 . 3 1 1 A 127 127 GLU H H 127 9.221 7.605 1.616 1 1 974 . 3 1 1 A 127 127 GLU HA H 127 4.366 4.510 -0.144 1 1 979 . 3 1 1 A 127 127 GLU CA C 127 53.707 56.204 -2.497 1 1 980 . 3 1 1 A 127 127 GLU CB C 127 25.492 30.497 -5.005 1 1 981 . 3 1 1 A 127 127 GLU N N 127 120.404 118.209 2.195 1 1 982 . 3 1 1 A 128 128 LYS H H 128 8.262 8.084 0.178 1 1 983 . 3 1 1 A 128 128 LYS HA H 128 4.661 4.962 -0.301 1 1 990 . 3 1 1 A 128 128 LYS CA C 128 52.264 58.376 -6.112 1 1 991 . 3 1 1 A 128 128 LYS CB C 128 32.404 32.072 0.332 1 1 994 . 3 1 1 A 128 128 LYS N N 128 122.166 117.640 4.526 1 1 995 . 3 1 1 A 129 129 MET H H 129 8.242 7.641 0.601 1 1 996 . 3 1 1 A 129 129 MET HA H 129 5.012 4.776 0.236 1 1 1001 . 3 1 1 A 129 129 MET CA C 129 50.958 54.382 -3.424 1 1 1003 . 3 1 1 A 129 129 MET N N 129 119.422 118.219 1.203 1 1 1004 . 3 1 1 A 130 130 VAL H H 130 9.200 8.734 0.466 1 1 1005 . 3 1 1 A 130 130 VAL HA H 130 4.609 4.721 -0.112 1 1 1013 . 3 1 1 A 130 130 VAL CA C 130 56.296 60.299 -4.003 1 1 1014 . 3 1 1 A 130 130 VAL CB C 130 32.606 36.084 -3.478 1 1 1015 . 3 1 1 A 130 130 VAL N N 130 118.290 125.173 -6.883 1 1 1016 . 3 1 1 A 131 131 ALA H H 131 8.368 8.557 -0.189 1 1 1017 . 3 1 1 A 131 131 ALA HA H 131 4.654 5.061 -0.407 1 1 1021 . 3 1 1 A 131 131 ALA CA C 131 49.739 51.888 -2.149 1 1 1022 . 3 1 1 A 131 131 ALA CB C 131 15.351 20.863 -5.512 1 1 1023 . 3 1 1 A 131 131 ALA N N 131 126.734 124.983 1.751 1 1 1024 . 3 1 1 A 132 132 LYS H H 132 7.732 8.598 -0.866 1 1 1025 . 3 1 1 A 132 132 LYS HA H 132 4.171 4.693 -0.522 1 1 1028 . 3 1 1 A 132 132 LYS N N 132 127.309 122.007 5.302 1 1 1029 . 3 1 1 A 133 133 ARG H H 133 8.193 8.361 -0.168 1 1 1030 . 3 1 1 A 133 133 ARG HA H 133 5.073 5.187 -0.114 1 1 1038 . 3 1 1 A 133 133 ARG N N 133 122.190 121.066 1.124 1 1 1040 . 3 1 1 A 134 134 ARG H H 134 7.539 8.719 -1.180 1 1 1041 . 3 1 1 A 134 134 ARG HA H 134 4.667 4.811 -0.144 1 1 1049 . 3 1 1 A 134 134 ARG CA C 134 52.584 55.195 -2.611 1 1 1050 . 3 1 1 A 134 134 ARG CB C 134 31.325 33.279 -1.954 1 1 1052 . 3 1 1 A 134 134 ARG N N 134 121.632 124.092 -2.460 1 1 1054 . 3 1 1 A 135 135 PHE H H 135 8.816 8.321 0.495 1 1 1055 . 3 1 1 A 135 135 PHE HA H 135 5.680 5.859 -0.179 1 1 1062 . 3 1 1 A 135 135 PHE N N 135 125.107 121.813 3.294 1 1 1063 . 3 1 1 A 136 136 ARG H H 136 7.741 9.107 -1.366 1 1 1064 . 3 1 1 A 136 136 ARG HA H 136 4.402 4.752 -0.350 1 1 1068 . 3 1 1 A 136 136 ARG N N 136 125.640 121.997 3.643 1 1 1070 . 3 1 1 A 137 137 ILE H H 137 8.556 8.566 -0.010 1 1 1071 . 3 1 1 A 137 137 ILE HA H 137 3.912 4.704 -0.792 1 1 1076 . 3 1 1 A 137 137 ILE CA C 137 55.676 59.803 -4.127 1 1 1079 . 3 1 1 A 137 137 ILE N N 137 122.891 120.819 2.072 1 1 1080 . 3 1 1 A 138 138 GLY H H 138 8.676 8.872 -0.196 1 1 1081 . 3 1 1 A 138 138 GLY HA2 H 138 3.740 4.215 -0.475 1 1 1082 . 3 1 1 A 138 138 GLY HA3 H 138 2.982 4.230 -1.248 1 1 1083 . 3 1 1 A 138 138 GLY CA C 138 41.908 45.553 -3.645 1 1 1084 . 3 1 1 A 138 138 GLY N N 138 117.058 115.784 1.274 1 1 1085 . 3 1 1 A 139 139 ASP H H 139 7.858 7.638 0.220 1 1 1086 . 3 1 1 A 139 139 ASP HA H 139 4.753 4.598 0.155 1 1 1089 . 3 1 1 A 139 139 ASP CA C 139 52.584 54.841 -2.257 1 1 1090 . 3 1 1 A 139 139 ASP CB C 139 43.062 41.730 1.332 1 1 1091 . 3 1 1 A 139 139 ASP N N 139 124.516 121.308 3.208 1 1 1092 . 3 1 1 A 140 140 ILE H H 140 8.354 8.365 -0.011 1 1 1093 . 3 1 1 A 140 140 ILE HA H 140 4.473 4.700 -0.227 1 1 1103 . 3 1 1 A 140 140 ILE CB C 140 36.173 39.197 -3.024 1 1 1105 . 3 1 1 A 140 140 ILE N N 140 120.679 124.247 -3.568 1 1 1106 . 3 1 1 A 141 141 ALA H H 141 8.708 8.175 0.533 1 1 1107 . 3 1 1 A 141 141 ALA HA H 141 4.862 4.540 0.322 1 1 1111 . 3 1 1 A 141 141 ALA CA C 141 47.968 50.978 -3.010 1 1 1112 . 3 1 1 A 141 141 ALA CB C 141 21.733 19.938 1.795 1 1 1113 . 3 1 1 A 141 141 ALA N N 141 130.144 125.899 4.245 1 1 1114 . 3 1 1 A 142 142 GLY H H 142 7.888 7.863 0.025 1 1 1115 . 3 1 1 A 142 142 GLY HA2 H 142 4.519 3.785 0.734 1 1 1116 . 3 1 1 A 142 142 GLY HA3 H 142 3.634 3.960 -0.326 1 1 1117 . 3 1 1 A 142 142 GLY N N 142 102.272 107.014 -4.742 1 1 1118 . 3 1 1 A 143 143 GLU H H 143 8.068 7.627 0.441 1 1 1119 . 3 1 1 A 143 143 GLU HA H 143 4.577 4.068 0.509 1 1 1124 . 3 1 1 A 143 143 GLU N N 143 120.569 117.554 3.015 1 1 1125 . 3 1 1 A 144 144 HIS H H 144 8.478 8.023 0.455 1 1 1126 . 3 1 1 A 144 144 HIS HA H 144 4.968 4.321 0.647 1 1 1131 . 3 1 1 A 144 144 HIS N N 144 124.275 118.091 6.184 1 1 1132 . 3 1 1 A 145 145 THR H H 145 9.031 7.689 1.342 1 1 1133 . 3 1 1 A 145 145 THR HA H 145 4.025 4.934 -0.909 1 1 1138 . 3 1 1 A 145 145 THR CA C 145 61.247 60.428 0.819 1 1 1139 . 3 1 1 A 145 145 THR CB C 145 65.181 70.675 -5.494 1 1 1141 . 3 1 1 A 145 145 THR N N 145 125.828 115.197 10.631 1 1 1142 . 3 1 1 A 146 146 SER H H 146 9.077 9.305 -0.228 1 1 1143 . 3 1 1 A 146 146 SER HA H 146 4.684 4.612 0.072 1 1 1145 . 3 1 1 A 146 146 SER CA C 146 56.067 59.636 -3.569 1 1 1146 . 3 1 1 A 146 146 SER CB C 146 60.510 63.831 -3.321 1 1 1147 . 3 1 1 A 146 146 SER N N 146 124.154 125.290 -1.136 1 1 1148 . 3 1 1 A 147 147 PHE H H 147 9.049 8.894 0.155 1 1 1149 . 3 1 1 A 147 147 PHE HA H 147 4.022 4.260 -0.238 1 1 1154 . 3 1 1 A 147 147 PHE N N 147 127.670 124.422 3.248 1 1 1155 . 3 1 1 A 148 148 ASP H H 148 8.504 8.514 -0.010 1 1 1156 . 3 1 1 A 148 148 ASP HA H 148 4.422 4.481 -0.059 1 1 1158 . 3 1 1 A 148 148 ASP CA C 148 52.584 57.234 -4.650 1 1 1159 . 3 1 1 A 148 148 ASP CB C 148 37.800 41.297 -3.497 1 1 1160 . 3 1 1 A 148 148 ASP N N 148 114.377 120.371 -5.994 1 1 1161 . 3 1 1 A 149 149 LYS H H 149 7.380 8.562 -1.182 1 1 1162 . 3 1 1 A 149 149 LYS HA H 149 4.487 4.201 0.286 1 1 1171 . 3 1 1 A 149 149 LYS CA C 149 51.735 57.766 -6.031 1 1 1172 . 3 1 1 A 149 149 LYS CB C 149 30.162 31.647 -1.485 1 1 1175 . 3 1 1 A 149 149 LYS N N 149 119.137 114.748 4.389 1 1 1176 . 3 1 1 A 150 150 LEU H H 150 6.886 8.494 -1.608 1 1 1177 . 3 1 1 A 150 150 LEU HA H 150 3.996 4.605 -0.609 1 1 1186 . 3 1 1 A 150 150 LEU CA C 150 50.502 52.057 -1.555 1 1 1187 . 3 1 1 A 150 150 LEU N N 150 120.614 117.552 3.062 1 1 1188 . 3 1 1 A 151 151 PRO CB C 151 29.567 29.347 0.220 1 1 1190 . 3 1 1 A 152 152 LYS H H 152 8.076 8.390 -0.314 1 1 1191 . 3 1 1 A 152 152 LYS HA H 152 4.346 4.733 -0.387 1 1 1195 . 3 1 1 A 152 152 LYS CA C 152 53.182 55.113 -1.931 1 1 1196 . 3 1 1 A 152 152 LYS CB C 152 31.487 32.745 -1.258 1 1 1198 . 3 1 1 A 152 152 LYS N N 152 118.133 123.293 -5.160 1 1 1199 . 3 1 1 A 153 153 ASP H H 153 7.982 8.288 -0.306 1 1 1200 . 3 1 1 A 153 153 ASP HA H 153 4.402 4.517 -0.115 1 1 1203 . 3 1 1 A 153 153 ASP CA C 153 52.584 54.021 -1.437 1 1 1204 . 3 1 1 A 153 153 ASP CB C 153 37.762 38.925 -1.163 1 1 1205 . 3 1 1 A 153 153 ASP N N 153 115.735 123.527 -7.792 1 1 1206 . 3 1 1 A 154 154 VAL H H 154 6.987 8.640 -1.653 1 1 1207 . 3 1 1 A 154 154 VAL HA H 154 4.406 4.664 -0.258 1 1 1215 . 3 1 1 A 154 154 VAL CA C 154 58.408 60.175 -1.767 1 1 1216 . 3 1 1 A 154 154 VAL CB C 154 32.617 34.266 -1.649 1 1 1217 . 3 1 1 A 154 154 VAL N N 154 116.266 119.503 -3.237 1 1 1218 . 3 1 1 A 155 155 MET H H 155 8.444 8.656 -0.212 1 1 1219 . 3 1 1 A 155 155 MET HA H 155 5.416 4.170 1.246 1 1 1224 . 3 1 1 A 155 155 MET CA C 155 51.183 55.742 -4.559 1 1 1226 . 3 1 1 A 155 155 MET N N 155 124.950 127.217 -2.267 1 1 1227 . 3 1 1 A 156 156 ALA H H 156 9.226 8.699 0.527 1 1 1228 . 3 1 1 A 156 156 ALA HA H 156 4.693 4.995 -0.302 1 1 1232 . 3 1 1 A 156 156 ALA CA C 156 48.379 50.471 -2.092 1 1 1233 . 3 1 1 A 156 156 ALA CB C 156 21.051 21.723 -0.672 1 1 1234 . 3 1 1 A 156 156 ALA N N 156 129.938 124.268 5.670 1 1 1235 . 3 1 1 A 157 157 THR H H 157 8.554 8.766 -0.212 1 1 1236 . 3 1 1 A 157 157 THR HA H 157 4.839 4.966 -0.127 1 1 1241 . 3 1 1 A 157 157 THR CA C 157 59.555 62.213 -2.658 1 1 1242 . 3 1 1 A 157 157 THR CB C 157 68.575 69.569 -0.994 1 1 1244 . 3 1 1 A 157 157 THR N N 157 118.815 119.183 -0.368 1 1 1245 . 3 1 1 A 158 158 TYR H H 158 9.974 9.614 0.360 1 1 1246 . 3 1 1 A 158 158 TYR HA H 158 4.435 5.219 -0.784 1 1 1253 . 3 1 1 A 158 158 TYR N N 158 126.958 126.363 0.595 1 1 1254 . 3 1 1 A 159 159 ARG H H 159 8.909 8.716 0.193 1 1 1255 . 3 1 1 A 159 159 ARG HA H 159 5.444 5.450 -0.006 1 1 1263 . 3 1 1 A 159 159 ARG CA C 159 51.933 54.323 -2.390 1 1 1264 . 3 1 1 A 159 159 ARG N N 159 121.721 119.556 2.165 1 1 1266 . 3 1 1 A 160 160 GLY H H 160 8.910 8.704 0.206 1 1 1267 . 3 1 1 A 160 160 GLY HA2 H 160 4.904 4.345 0.559 1 1 1268 . 3 1 1 A 160 160 GLY HA3 H 160 4.484 4.387 0.097 1 1 1269 . 3 1 1 A 160 160 GLY N N 160 113.921 106.764 7.157 1 1 1270 . 3 1 1 A 161 161 THR H H 161 9.110 9.393 -0.283 1 1 1271 . 3 1 1 A 161 161 THR HA H 161 4.810 5.408 -0.598 1 1 1276 . 3 1 1 A 161 161 THR CA C 161 59.603 60.968 -1.365 1 1 1277 . 3 1 1 A 161 161 THR CB C 161 69.909 72.356 -2.447 1 1 1279 . 3 1 1 A 161 161 THR N N 161 126.813 115.419 11.394 1 1 1280 . 3 1 1 A 162 162 ALA H H 162 7.137 8.696 -1.559 1 1 1281 . 3 1 1 A 162 162 ALA HA H 162 5.361 5.034 0.327 1 1 1285 . 3 1 1 A 162 162 ALA CA C 162 46.573 51.085 -4.512 1 1 1286 . 3 1 1 A 162 162 ALA CB C 162 20.959 23.803 -2.844 1 1 1287 . 3 1 1 A 162 162 ALA N N 162 128.111 123.522 4.589 1 1 1288 . 3 1 1 A 163 163 PHE H H 163 8.587 8.695 -0.108 1 1 1289 . 3 1 1 A 163 163 PHE HA H 163 5.538 5.639 -0.101 1 1 1296 . 3 1 1 A 163 163 PHE N N 163 117.349 114.841 2.508 1 1 1297 . 3 1 1 A 164 164 GLY H H 164 8.650 9.114 -0.464 1 1 1298 . 3 1 1 A 164 164 GLY HA2 H 164 4.210 4.158 0.052 1 1 1299 . 3 1 1 A 164 164 GLY HA3 H 164 3.285 4.509 -1.224 1 1 1300 . 3 1 1 A 164 164 GLY CA C 164 40.377 44.097 -3.720 1 1 1301 . 3 1 1 A 164 164 GLY N N 164 108.839 108.603 0.236 1 1 1302 . 3 1 1 A 165 165 SER H H 165 7.684 9.142 -1.458 1 1 1303 . 3 1 1 A 165 165 SER HA H 165 3.458 4.386 -0.928 1 1 1304 . 3 1 1 A 165 165 SER N N 165 116.037 117.150 -1.113 1 1 1305 . 3 1 1 A 166 166 ASP H H 166 9.718 8.338 1.380 1 1 1306 . 3 1 1 A 166 166 ASP HA H 166 4.281 4.866 -0.585 1 1 1309 . 3 1 1 A 166 166 ASP CA C 166 52.584 53.711 -1.127 1 1 1310 . 3 1 1 A 166 166 ASP N N 166 125.166 119.848 5.318 1 1 1311 . 3 1 1 A 167 167 ASP H H 167 7.655 7.774 -0.119 1 1 1312 . 3 1 1 A 167 167 ASP HA H 167 4.666 4.958 -0.292 1 1 1315 . 3 1 1 A 167 167 ASP CB C 167 38.948 44.142 -5.194 1 1 1316 . 3 1 1 A 167 167 ASP N N 167 117.491 118.467 -0.976 1 1 1317 . 3 1 1 A 168 168 ALA H H 168 8.585 8.510 0.075 1 1 1318 . 3 1 1 A 168 168 ALA HA H 168 5.012 4.080 0.932 1 1 1322 . 3 1 1 A 168 168 ALA CA C 168 47.485 54.586 -7.101 1 1 1323 . 3 1 1 A 168 168 ALA N N 168 128.834 122.935 5.899 1 1 1324 . 3 1 1 A 169 169 GLY H H 169 8.472 7.549 0.923 1 1 1325 . 3 1 1 A 169 169 GLY HA2 H 169 4.404 4.145 0.259 1 1 1326 . 3 1 1 A 169 169 GLY HA3 H 169 4.051 4.156 -0.105 1 1 1327 . 3 1 1 A 169 169 GLY CA C 169 43.257 46.048 -2.791 1 1 1328 . 3 1 1 A 169 169 GLY N N 169 107.133 103.264 3.869 1 1 1329 . 3 1 1 A 170 170 GLY H H 170 7.229 7.938 -0.709 1 1 1330 . 3 1 1 A 170 170 GLY HA2 H 170 4.223 3.970 0.253 1 1 1331 . 3 1 1 A 170 170 GLY HA3 H 170 3.781 4.061 -0.280 1 1 1332 . 3 1 1 A 170 170 GLY CA C 170 43.310 45.699 -2.389 1 1 1333 . 3 1 1 A 170 170 GLY N N 170 107.542 110.037 -2.495 1 1 1334 . 3 1 1 A 171 171 LYS H H 171 9.641 8.468 1.173 1 1 1335 . 3 1 1 A 171 171 LYS HA H 171 5.129 4.711 0.418 1 1 1342 . 3 1 1 A 171 171 LYS CA C 171 51.355 56.044 -4.689 1 1 1343 . 3 1 1 A 171 171 LYS N N 171 124.322 125.609 -1.287 1 1 1344 . 3 1 1 A 172 172 LEU H H 172 7.764 8.706 -0.942 1 1 1345 . 3 1 1 A 172 172 LEU HA H 172 4.973 5.240 -0.267 1 1 1353 . 3 1 1 A 172 172 LEU CA C 172 50.348 53.031 -2.683 1 1 1354 . 3 1 1 A 172 172 LEU N N 172 126.389 120.701 5.688 1 1 1355 . 3 1 1 A 173 173 THR H H 173 8.321 8.721 -0.400 1 1 1356 . 3 1 1 A 173 173 THR HA H 173 5.017 5.589 -0.572 1 1 1361 . 3 1 1 A 173 173 THR CA C 173 59.149 61.567 -2.418 1 1 1362 . 3 1 1 A 173 173 THR CB C 173 67.449 71.059 -3.610 1 1 1364 . 3 1 1 A 173 173 THR N N 173 123.553 115.451 8.102 1 1 1365 . 3 1 1 A 174 174 TYR H H 174 9.367 8.931 0.436 1 1 1366 . 3 1 1 A 174 174 TYR HA H 174 4.660 4.980 -0.320 1 1 1373 . 3 1 1 A 174 174 TYR CB C 174 41.267 40.029 1.238 1 1 1374 . 3 1 1 A 174 174 TYR N N 174 129.583 127.049 2.534 1 1 1375 . 3 1 1 A 175 175 THR H H 175 8.529 8.133 0.396 1 1 1376 . 3 1 1 A 175 175 THR HA H 175 5.388 5.569 -0.181 1 1 1381 . 3 1 1 A 175 175 THR CA C 175 58.216 61.371 -3.155 1 1 1382 . 3 1 1 A 175 175 THR CB C 175 68.575 70.057 -1.482 1 1 1384 . 3 1 1 A 175 175 THR N N 175 125.967 118.033 7.934 1 1 1385 . 3 1 1 A 176 176 ILE H H 176 9.139 8.315 0.824 1 1 1386 . 3 1 1 A 176 176 ILE HA H 176 4.382 4.949 -0.567 1 1 1395 . 3 1 1 A 176 176 ILE CA C 176 58.006 58.837 -0.831 1 1 1396 . 3 1 1 A 176 176 ILE CB C 176 38.881 41.952 -3.071 1 1 1400 . 3 1 1 A 176 176 ILE N N 176 123.715 120.149 3.566 1 1 1401 . 3 1 1 A 177 177 ASP H H 177 8.501 9.625 -1.124 1 1 1402 . 3 1 1 A 177 177 ASP HA H 177 5.011 4.630 0.381 1 1 1405 . 3 1 1 A 177 177 ASP CA C 177 49.089 53.595 -4.506 1 1 1406 . 3 1 1 A 177 177 ASP CB C 177 39.282 41.748 -2.466 1 1 1407 . 3 1 1 A 177 177 ASP N N 177 125.978 123.825 2.153 1 1 1408 . 3 1 1 A 178 178 PHE H H 178 8.913 7.982 0.931 1 1 1409 . 3 1 1 A 178 178 PHE HA H 178 3.993 3.445 0.548 1 1 1414 . 3 1 1 A 178 178 PHE CB C 178 34.588 39.147 -4.559 1 1 1415 . 3 1 1 A 178 178 PHE N N 178 123.522 124.166 -0.644 1 1 1416 . 3 1 1 A 179 179 ALA H H 179 8.487 8.249 0.238 1 1 1417 . 3 1 1 A 179 179 ALA HA H 179 4.528 4.411 0.117 1 1 1421 . 3 1 1 A 179 179 ALA CA C 179 52.584 55.715 -3.131 1 1 1422 . 3 1 1 A 179 179 ALA CB C 179 15.666 18.576 -2.910 1 1 1423 . 3 1 1 A 179 179 ALA N N 179 124.061 125.280 -1.219 1 1 1424 . 3 1 1 A 180 180 ALA H H 180 7.162 7.852 -0.690 1 1 1425 . 3 1 1 A 180 180 ALA HA H 180 4.313 4.579 -0.266 1 1 1429 . 3 1 1 A 180 180 ALA CA C 180 49.006 51.389 -2.383 1 1 1430 . 3 1 1 A 180 180 ALA CB C 180 16.933 17.316 -0.383 1 1 1431 . 3 1 1 A 180 180 ALA N N 180 119.710 118.983 0.727 1 1 1432 . 3 1 1 A 181 181 LYS H H 181 8.092 9.068 -0.976 1 1 1433 . 3 1 1 A 181 181 LYS HA H 181 3.457 4.568 -1.111 1 1 1440 . 3 1 1 A 181 181 LYS CA C 181 54.783 57.329 -2.546 1 1 1441 . 3 1 1 A 181 181 LYS CB C 181 27.088 31.257 -4.169 1 1 1444 . 3 1 1 A 181 181 LYS N N 181 114.996 121.656 -6.660 1 1 1445 . 3 1 1 A 182 182 GLN H H 182 7.532 7.853 -0.321 1 1 1446 . 3 1 1 A 182 182 GLN HA H 182 5.304 5.000 0.304 1 1 1453 . 3 1 1 A 182 182 GLN CA C 182 51.473 55.298 -3.825 1 1 1454 . 3 1 1 A 182 182 GLN CB C 182 31.585 31.790 -0.205 1 1 1455 . 3 1 1 A 182 182 GLN N N 182 115.064 120.631 -5.567 1 1 1457 . 3 1 1 A 183 183 GLY H H 183 9.026 8.200 0.826 1 1 1458 . 3 1 1 A 183 183 GLY HA2 H 183 5.376 4.325 1.051 1 1 1459 . 3 1 1 A 183 183 GLY HA3 H 183 3.567 4.413 -0.846 1 1 1460 . 3 1 1 A 183 183 GLY CA C 183 42.361 46.192 -3.831 1 1 1461 . 3 1 1 A 183 183 GLY N N 183 111.505 112.597 -1.092 1 1 1462 . 3 1 1 A 184 184 HIS H H 184 7.508 8.442 -0.934 1 1 1463 . 3 1 1 A 184 184 HIS HA H 184 4.304 5.205 -0.901 1 1 1467 . 3 1 1 A 184 184 HIS CA C 184 52.793 53.724 -0.931 1 1 1468 . 3 1 1 A 184 184 HIS CB C 184 27.906 32.546 -4.640 1 1 1469 . 3 1 1 A 184 184 HIS N N 184 111.297 116.292 -4.995 1 1 1470 . 3 1 1 A 185 185 GLY H H 185 9.160 7.904 1.256 1 1 1471 . 3 1 1 A 185 185 GLY HA2 H 185 4.464 3.020 1.444 1 1 1472 . 3 1 1 A 185 185 GLY HA3 H 185 4.117 3.462 0.655 1 1 1473 . 3 1 1 A 185 185 GLY CA C 185 44.212 43.922 0.290 1 1 1474 . 3 1 1 A 185 185 GLY N N 185 107.398 105.688 1.710 1 1 1475 . 3 1 1 A 186 186 LYS H H 186 9.170 8.520 0.650 1 1 1476 . 3 1 1 A 186 186 LYS HA H 186 4.925 4.864 0.061 1 1 1481 . 3 1 1 A 186 186 LYS CB C 186 33.642 34.207 -0.565 1 1 1482 . 3 1 1 A 186 186 LYS N N 186 122.690 122.081 0.609 1 1 1483 . 3 1 1 A 187 187 ILE H H 187 8.444 8.618 -0.174 1 1 1484 . 3 1 1 A 187 187 ILE HA H 187 4.626 5.271 -0.645 1 1 1487 . 3 1 1 A 187 187 ILE N N 187 124.320 121.390 2.930 1 1 1488 . 3 1 1 A 188 188 GLU H H 188 8.590 9.616 -1.026 1 1 1489 . 3 1 1 A 188 188 GLU HA H 188 4.650 4.495 0.155 1 1 1495 . 3 1 1 A 188 188 GLU N N 188 122.575 122.036 0.539 1 1 1496 . 3 1 1 A 189 189 HIS H H 189 8.726 8.700 0.026 1 1 1497 . 3 1 1 A 189 189 HIS HA H 189 4.055 3.985 0.070 1 1 1501 . 3 1 1 A 189 189 HIS CA C 189 54.623 59.726 -5.103 1 1 1502 . 3 1 1 A 189 189 HIS CB C 189 24.997 30.197 -5.200 1 1 1503 . 3 1 1 A 189 189 HIS N N 189 111.381 125.756 -14.375 1 1 1504 . 3 1 1 A 190 190 LEU H H 190 9.715 7.710 2.005 1 1 1505 . 3 1 1 A 190 190 LEU HA H 190 4.379 4.461 -0.082 1 1 1515 . 3 1 1 A 190 190 LEU N N 190 124.648 117.970 6.678 1 1 1516 . 3 1 1 A 191 191 LYS H H 191 10.099 8.079 2.020 1 1 1517 . 3 1 1 A 191 191 LYS HA H 191 3.736 4.555 -0.819 1 1 1524 . 3 1 1 A 191 191 LYS CA C 191 55.815 56.602 -0.787 1 1 1525 . 3 1 1 A 191 191 LYS CB C 191 30.201 35.410 -5.209 1 1 1527 . 3 1 1 A 191 191 LYS N N 191 123.618 121.488 2.130 1 1 1528 . 3 1 1 A 192 192 SER H H 192 6.991 7.794 -0.803 1 1 1529 . 3 1 1 A 192 192 SER HA H 192 4.743 4.595 0.148 1 1 1532 . 3 1 1 A 192 192 SER CA C 192 51.974 56.138 -4.164 1 1 1533 . 3 1 1 A 192 192 SER CB C 192 60.005 64.378 -4.373 1 1 1534 . 3 1 1 A 192 192 SER N N 192 115.071 116.967 -1.896 1 1 1535 . 3 1 1 A 193 193 PRO CB C 193 29.607 29.976 -0.369 1 1 1537 . 3 1 1 A 194 194 GLU H H 194 8.213 8.841 -0.628 1 1 1538 . 3 1 1 A 194 194 GLU HA H 194 3.063 4.642 -1.579 1 1 1543 . 3 1 1 A 194 194 GLU CA C 194 54.185 57.263 -3.078 1 1 1545 . 3 1 1 A 194 194 GLU N N 194 114.055 120.311 -6.256 1 1 1546 . 3 1 1 A 195 195 LEU H H 195 7.082 7.800 -0.718 1 1 1547 . 3 1 1 A 195 195 LEU HA H 195 4.027 4.785 -0.758 1 1 1557 . 3 1 1 A 195 195 LEU CA C 195 51.361 54.460 -3.099 1 1 1558 . 3 1 1 A 195 195 LEU CB C 195 38.950 41.712 -2.762 1 1 1561 . 3 1 1 A 195 195 LEU N N 195 113.898 118.302 -4.404 1 1 1562 . 3 1 1 A 196 196 ASN H H 196 7.060 7.895 -0.835 1 1 1563 . 3 1 1 A 196 196 ASN HA H 196 4.638 4.555 0.083 1 1 1567 . 3 1 1 A 196 196 ASN N N 196 119.196 118.691 0.505 1 1 1568 . 3 1 1 A 197 197 VAL H H 197 7.244 8.770 -1.526 1 1 1569 . 3 1 1 A 197 197 VAL HA H 197 4.540 4.653 -0.113 1 1 1577 . 3 1 1 A 197 197 VAL CA C 197 57.176 61.162 -3.986 1 1 1578 . 3 1 1 A 197 197 VAL N N 197 113.621 117.878 -4.257 1 1 1579 . 3 1 1 A 198 198 ASP H H 198 8.881 8.928 -0.047 1 1 1580 . 3 1 1 A 198 198 ASP HA H 198 4.894 4.934 -0.040 1 1 1581 . 3 1 1 A 198 198 ASP N N 198 118.852 128.676 -9.824 1 1 1582 . 3 1 1 A 199 199 LEU H H 199 8.498 8.455 0.043 1 1 1583 . 3 1 1 A 199 199 LEU HA H 199 4.317 5.229 -0.912 1 1 1591 . 3 1 1 A 199 199 LEU N N 199 124.078 127.732 -3.654 1 1 1592 . 3 1 1 A 200 200 ALA H H 200 8.386 9.066 -0.680 1 1 1593 . 3 1 1 A 200 200 ALA HA H 200 4.295 5.170 -0.875 1 1 1597 . 3 1 1 A 200 200 ALA CA C 200 50.044 51.248 -1.204 1 1 1598 . 3 1 1 A 200 200 ALA CB C 200 17.985 21.961 -3.976 1 1 1599 . 3 1 1 A 200 200 ALA N N 200 127.315 124.493 2.822 1 1 1600 . 3 1 1 A 201 201 VAL H H 201 8.007 8.804 -0.797 1 1 1601 . 3 1 1 A 201 201 VAL HA H 201 4.577 4.817 -0.240 1 1 1609 . 3 1 1 A 201 201 VAL CA C 201 60.004 60.083 -0.079 1 1 1610 . 3 1 1 A 201 201 VAL CB C 201 28.863 35.816 -6.953 1 1 1611 . 3 1 1 A 201 201 VAL N N 201 119.409 121.075 -1.666 1 1 1612 . 3 1 1 A 202 202 ALA H H 202 8.789 8.638 0.151 1 1 1613 . 3 1 1 A 202 202 ALA HA H 202 4.630 5.319 -0.689 1 1 1617 . 3 1 1 A 202 202 ALA CA C 202 48.200 50.003 -1.803 1 1 1618 . 3 1 1 A 202 202 ALA N N 202 131.745 127.206 4.539 1 1 1619 . 3 1 1 A 203 203 TYR H H 203 8.522 8.982 -0.460 1 1 1620 . 3 1 1 A 203 203 TYR HA H 203 5.391 5.049 0.342 1 1 1627 . 3 1 1 A 203 203 TYR CA C 203 54.648 59.126 -4.478 1 1 1628 . 3 1 1 A 203 203 TYR CB C 203 37.315 39.591 -2.276 1 1 1629 . 3 1 1 A 203 203 TYR N N 203 117.786 122.861 -5.075 1 1 1630 . 3 1 1 A 204 204 ILE H H 204 8.209 7.919 0.290 1 1 1631 . 3 1 1 A 204 204 ILE HA H 204 4.393 4.301 0.092 1 1 1641 . 3 1 1 A 204 204 ILE CB C 204 36.807 41.394 -4.587 1 1 1644 . 3 1 1 A 204 204 ILE N N 204 120.602 123.331 -2.729 1 1 1645 . 3 1 1 A 205 205 LYS H H 205 9.340 8.491 0.849 1 1 1646 . 3 1 1 A 205 205 LYS HA H 205 4.756 5.079 -0.323 1 1 1651 . 3 1 1 A 205 205 LYS CA C 205 50.844 60.520 -9.676 1 1 1652 . 3 1 1 A 205 205 LYS N N 205 127.960 124.837 3.123 1 1 1653 . 3 1 1 A 207 207 ASP H H 207 8.436 9.073 -0.637 1 1 1654 . 3 1 1 A 207 207 ASP HA H 207 4.692 4.125 0.567 1 1 1657 . 3 1 1 A 207 207 ASP CA C 207 48.789 55.615 -6.826 1 1 1658 . 3 1 1 A 207 207 ASP CB C 207 38.377 41.038 -2.661 1 1 1659 . 3 1 1 A 207 207 ASP N N 207 123.098 125.621 -2.523 1 1 1660 . 3 1 1 A 208 208 GLU H H 208 8.880 8.265 0.615 1 1 1661 . 3 1 1 A 208 208 GLU HA H 208 3.994 4.241 -0.247 1 1 1666 . 3 1 1 A 208 208 GLU CA C 208 56.123 57.723 -1.600 1 1 1667 . 3 1 1 A 208 208 GLU CB C 208 25.794 29.637 -3.843 1 1 1669 . 3 1 1 A 208 208 GLU N N 208 119.042 121.459 -2.417 1 1 1670 . 3 1 1 A 209 209 LYS H H 209 7.681 7.459 0.222 1 1 1671 . 3 1 1 A 209 209 LYS HA H 209 4.141 4.386 -0.245 1 1 1680 . 3 1 1 A 209 209 LYS N N 209 119.252 116.824 2.428 1 1 1681 . 3 1 1 A 210 210 HIS H H 210 8.177 6.599 1.578 1 1 1682 . 3 1 1 A 210 210 HIS HA H 210 3.825 4.677 -0.852 1 1 1687 . 3 1 1 A 210 210 HIS CA C 210 54.205 54.113 0.092 1 1 1688 . 3 1 1 A 210 210 HIS CB C 210 23.439 29.777 -6.338 1 1 1689 . 3 1 1 A 210 210 HIS N N 210 112.758 112.543 0.215 1 1 1690 . 3 1 1 A 211 211 HIS H H 211 8.758 7.215 1.543 1 1 1691 . 3 1 1 A 211 211 HIS HA H 211 5.041 4.895 0.146 1 1 1695 . 3 1 1 A 211 211 HIS CA C 211 50.450 54.707 -4.257 1 1 1696 . 3 1 1 A 211 211 HIS CB C 211 25.703 34.100 -8.397 1 1 1697 . 3 1 1 A 211 211 HIS N N 211 119.552 119.200 0.352 1 1 1698 . 3 1 1 A 212 212 ALA H H 212 8.556 8.239 0.317 1 1 1699 . 3 1 1 A 212 212 ALA HA H 212 4.712 4.360 0.352 1 1 1703 . 3 1 1 A 212 212 ALA CA C 212 49.886 51.529 -1.643 1 1 1704 . 3 1 1 A 212 212 ALA CB C 212 18.860 18.580 0.280 1 1 1705 . 3 1 1 A 212 212 ALA N N 212 123.780 123.690 0.090 1 1 1706 . 3 1 1 A 213 213 VAL H H 213 9.338 8.184 1.154 1 1 1707 . 3 1 1 A 213 213 VAL HA H 213 5.074 4.894 0.180 1 1 1715 . 3 1 1 A 213 213 VAL CA C 213 57.486 59.265 -1.779 1 1 1716 . 3 1 1 A 213 213 VAL CB C 213 33.938 36.549 -2.611 1 1 1717 . 3 1 1 A 213 213 VAL N N 213 124.742 116.666 8.076 1 1 1718 . 3 1 1 A 214 214 ILE H H 214 8.962 8.617 0.345 1 1 1719 . 3 1 1 A 214 214 ILE HA H 214 4.434 5.096 -0.662 1 1 1726 . 3 1 1 A 214 214 ILE N N 214 122.881 123.985 -1.104 1 1 1727 . 3 1 1 A 215 215 SER H H 215 8.558 8.414 0.144 1 1 1728 . 3 1 1 A 215 215 SER HA H 215 5.001 5.623 -0.622 1 1 1731 . 3 1 1 A 215 215 SER CA C 215 53.230 56.805 -3.575 1 1 1732 . 3 1 1 A 215 215 SER CB C 215 62.077 66.203 -4.126 1 1 1733 . 3 1 1 A 215 215 SER N N 215 122.891 121.426 1.465 1 1 1734 . 3 1 1 A 216 216 GLY H H 216 7.282 9.326 -2.044 1 1 1735 . 3 1 1 A 216 216 GLY HA2 H 216 4.515 4.282 0.233 1 1 1736 . 3 1 1 A 216 216 GLY HA3 H 216 3.473 4.285 -0.812 1 1 1737 . 3 1 1 A 216 216 GLY CA C 216 42.816 45.840 -3.024 1 1 1738 . 3 1 1 A 216 216 GLY N N 216 110.899 112.614 -1.715 1 1 1739 . 3 1 1 A 217 217 SER H H 217 8.673 8.427 0.246 1 1 1740 . 3 1 1 A 217 217 SER HA H 217 5.127 5.384 -0.257 1 1 1743 . 3 1 1 A 217 217 SER CA C 217 56.266 57.095 -0.829 1 1 1744 . 3 1 1 A 217 217 SER N N 217 117.164 115.469 1.695 1 1 1745 . 3 1 1 A 218 218 VAL H H 218 7.451 9.610 -2.159 1 1 1746 . 3 1 1 A 218 218 VAL HA H 218 5.128 5.039 0.089 1 1 1754 . 3 1 1 A 218 218 VAL CA C 218 56.637 59.991 -3.354 1 1 1755 . 3 1 1 A 218 218 VAL N N 218 117.826 121.854 -4.028 1 1 1756 . 3 1 1 A 219 219 LEU H H 219 9.022 8.853 0.169 1 1 1757 . 3 1 1 A 219 219 LEU HA H 219 5.387 5.028 0.359 1 1 1767 . 3 1 1 A 219 219 LEU CA C 219 50.450 54.141 -3.691 1 1 1768 . 3 1 1 A 219 219 LEU N N 219 124.820 125.957 -1.137 1 1 1769 . 3 1 1 A 220 220 TYR H H 220 8.816 8.716 0.100 1 1 1770 . 3 1 1 A 220 220 TYR HA H 220 4.834 4.879 -0.045 1 1 1777 . 3 1 1 A 220 220 TYR N N 220 121.249 124.907 -3.658 1 1 1778 . 3 1 1 A 221 221 ASN H H 221 9.191 8.515 0.676 1 1 1779 . 3 1 1 A 221 221 ASN HA H 221 4.048 4.937 -0.889 1 1 1784 . 3 1 1 A 221 221 ASN CA C 221 51.647 54.665 -3.018 1 1 1785 . 3 1 1 A 221 221 ASN CB C 221 36.640 40.611 -3.971 1 1 1786 . 3 1 1 A 221 221 ASN N N 221 129.865 125.330 4.535 1 1 1788 . 3 1 1 A 222 222 GLN H H 222 8.468 7.736 0.732 1 1 1789 . 3 1 1 A 222 222 GLN HA H 222 3.671 4.374 -0.703 1 1 1794 . 3 1 1 A 222 222 GLN CA C 222 55.075 56.172 -1.097 1 1 1795 . 3 1 1 A 222 222 GLN CB C 222 24.663 30.822 -6.159 1 1 1797 . 3 1 1 A 222 222 GLN N N 222 108.367 115.075 -6.708 1 1 1798 . 3 1 1 A 223 223 ASP H H 223 7.797 7.960 -0.163 1 1 1799 . 3 1 1 A 223 223 ASP HA H 223 4.986 4.832 0.154 1 1 1802 . 3 1 1 A 223 223 ASP N N 223 120.842 120.068 0.774 1 1 1803 . 3 1 1 A 224 224 GLU H H 224 8.731 7.678 1.053 1 1 1804 . 3 1 1 A 224 224 GLU HA H 224 4.690 4.365 0.325 1 1 1809 . 3 1 1 A 224 224 GLU CA C 224 54.703 55.575 -0.872 1 1 1810 . 3 1 1 A 224 224 GLU CB C 224 26.357 31.206 -4.849 1 1 1812 . 3 1 1 A 224 224 GLU N N 224 124.249 121.095 3.154 1 1 1813 . 3 1 1 A 225 225 LYS H H 225 8.730 8.408 0.322 1 1 1814 . 3 1 1 A 225 225 LYS HA H 225 4.754 4.954 -0.200 1 1 1822 . 3 1 1 A 225 225 LYS N N 225 126.784 121.126 5.658 1 1 1823 . 3 1 1 A 226 226 GLY H H 226 7.683 9.644 -1.961 1 1 1824 . 3 1 1 A 226 226 GLY HA2 H 226 5.567 4.262 1.305 1 1 1825 . 3 1 1 A 226 226 GLY HA3 H 226 3.819 4.289 -0.470 1 1 1826 . 3 1 1 A 226 226 GLY CA C 226 42.264 44.503 -2.239 1 1 1827 . 3 1 1 A 226 226 GLY N N 226 107.140 111.977 -4.837 1 1 1828 . 3 1 1 A 227 227 SER H H 227 8.672 10.857 -2.185 1 1 1829 . 3 1 1 A 227 227 SER HA H 227 5.564 5.512 0.052 1 1 1832 . 3 1 1 A 227 227 SER CA C 227 54.373 57.116 -2.743 1 1 1833 . 3 1 1 A 227 227 SER CB C 227 63.963 66.260 -2.297 1 1 1834 . 3 1 1 A 227 227 SER N N 227 117.767 116.052 1.715 1 1 1835 . 3 1 1 A 228 228 TYR H H 228 9.073 9.411 -0.338 1 1 1836 . 3 1 1 A 228 228 TYR HA H 228 5.519 5.194 0.325 1 1 1843 . 3 1 1 A 228 228 TYR N N 228 118.324 121.343 -3.019 1 1 1844 . 3 1 1 A 229 229 SER H H 229 8.929 8.559 0.370 1 1 1845 . 3 1 1 A 229 229 SER HA H 229 5.209 5.301 -0.092 1 1 1848 . 3 1 1 A 229 229 SER CA C 229 54.131 57.668 -3.537 1 1 1849 . 3 1 1 A 229 229 SER N N 229 116.118 118.566 -2.448 1 1 1850 . 3 1 1 A 230 230 LEU H H 230 9.372 9.441 -0.069 1 1 1851 . 3 1 1 A 230 230 LEU HA H 230 4.803 5.040 -0.237 1 1 1863 . 3 1 1 A 230 230 LEU N N 230 124.803 125.642 -0.839 1 1 1864 . 3 1 1 A 231 231 GLY H H 231 9.080 8.399 0.681 1 1 1865 . 3 1 1 A 231 231 GLY HA2 H 231 4.776 4.249 0.527 1 1 1866 . 3 1 1 A 231 231 GLY HA3 H 231 3.528 4.313 -0.785 1 1 1867 . 3 1 1 A 231 231 GLY CA C 231 41.468 44.679 -3.211 1 1 1868 . 3 1 1 A 231 231 GLY N N 231 109.611 108.787 0.824 1 1 1869 . 3 1 1 A 232 232 ILE H H 232 6.849 8.954 -2.105 1 1 1870 . 3 1 1 A 232 232 ILE HA H 232 4.742 4.670 0.072 1 1 1878 . 3 1 1 A 232 232 ILE N N 232 120.566 124.816 -4.250 1 1 1879 . 3 1 1 A 233 233 PHE H H 233 9.569 8.878 0.691 1 1 1880 . 3 1 1 A 233 233 PHE HA H 233 4.979 5.222 -0.243 1 1 1885 . 3 1 1 A 233 233 PHE N N 233 129.256 122.450 6.806 1 1 1886 . 3 1 1 A 234 234 GLY H H 234 8.734 8.664 0.070 1 1 1887 . 3 1 1 A 234 234 GLY HA2 H 234 4.488 4.307 0.181 1 1 1888 . 3 1 1 A 234 234 GLY HA3 H 234 3.327 4.323 -0.996 1 1 1889 . 3 1 1 A 234 234 GLY CA C 234 40.377 45.821 -5.444 1 1 1890 . 3 1 1 A 234 234 GLY N N 234 105.294 106.725 -1.431 1 1 1891 . 3 1 1 A 235 235 GLU H H 235 9.198 8.785 0.413 1 1 1892 . 3 1 1 A 235 235 GLU HA H 235 4.111 4.118 -0.007 1 1 1897 . 3 1 1 A 235 235 GLU CA C 235 56.466 59.364 -2.898 1 1 1898 . 3 1 1 A 235 235 GLU CB C 235 26.256 29.726 -3.470 1 1 1900 . 3 1 1 A 235 235 GLU N N 235 125.813 124.195 1.618 1 1 1901 . 3 1 1 A 236 236 LYS H H 236 8.147 7.760 0.387 1 1 1902 . 3 1 1 A 236 236 LYS HA H 236 4.373 4.488 -0.115 1 1 1905 . 3 1 1 A 236 236 LYS N N 236 117.810 118.746 -0.936 1 1 1906 . 3 1 1 A 237 237 ALA H H 237 7.685 7.644 0.041 1 1 1907 . 3 1 1 A 237 237 ALA HA H 237 3.902 4.442 -0.540 1 1 1911 . 3 1 1 A 237 237 ALA CA C 237 49.762 50.957 -1.195 1 1 1912 . 3 1 1 A 237 237 ALA CB C 237 14.720 19.793 -5.073 1 1 1913 . 3 1 1 A 237 237 ALA N N 237 118.704 120.714 -2.010 1 1 1914 . 3 1 1 A 238 238 GLN H H 238 9.312 8.245 1.067 1 1 1915 . 3 1 1 A 238 238 GLN HA H 238 4.049 5.076 -1.027 1 1 1920 . 3 1 1 A 238 238 GLN N N 238 118.059 117.562 0.497 1 1 1921 . 3 1 1 A 239 239 GLU H H 239 8.785 8.681 0.104 1 1 1922 . 3 1 1 A 239 239 GLU HA H 239 5.531 4.971 0.560 1 1 1927 . 3 1 1 A 239 239 GLU N N 239 116.914 123.989 -7.075 1 1 1928 . 3 1 1 A 240 240 VAL H H 240 8.501 8.379 0.122 1 1 1929 . 3 1 1 A 240 240 VAL HA H 240 5.655 3.468 2.187 1 1 1937 . 3 1 1 A 240 240 VAL CA C 240 55.582 59.966 -4.384 1 1 1940 . 3 1 1 A 240 240 VAL N N 240 110.588 122.472 -11.884 1 1 1941 . 3 1 1 A 241 241 ALA H H 241 8.463 8.803 -0.340 1 1 1942 . 3 1 1 A 241 241 ALA HA H 241 5.014 5.277 -0.263 1 1 1946 . 3 1 1 A 241 241 ALA CA C 241 49.361 51.191 -1.830 1 1 1947 . 3 1 1 A 241 241 ALA CB C 241 18.196 23.642 -5.446 1 1 1948 . 3 1 1 A 241 241 ALA N N 241 121.125 129.101 -7.976 1 1 1949 . 3 1 1 A 242 242 GLY H H 242 9.421 8.307 1.114 1 1 1950 . 3 1 1 A 242 242 GLY HA2 H 242 5.161 4.359 0.802 1 1 1951 . 3 1 1 A 242 242 GLY HA3 H 242 4.076 4.407 -0.331 1 1 1952 . 3 1 1 A 242 242 GLY N N 242 112.036 106.787 5.249 1 1 1953 . 3 1 1 A 243 243 SER H H 243 8.929 8.263 0.666 1 1 1954 . 3 1 1 A 243 243 SER HA H 243 5.331 5.360 -0.029 1 1 1957 . 3 1 1 A 243 243 SER N N 243 116.113 114.940 1.173 1 1 1958 . 3 1 1 A 244 244 ALA H H 244 9.218 8.673 0.545 1 1 1959 . 3 1 1 A 244 244 ALA HA H 244 5.221 5.049 0.172 1 1 1963 . 3 1 1 A 244 244 ALA CA C 244 47.883 49.991 -2.108 1 1 1964 . 3 1 1 A 244 244 ALA N N 244 120.635 125.954 -5.319 1 1 1965 . 3 1 1 A 245 245 GLU H H 245 9.194 8.303 0.891 1 1 1966 . 3 1 1 A 245 245 GLU HA H 245 4.869 5.065 -0.196 1 1 1971 . 3 1 1 A 245 245 GLU N N 245 123.487 117.622 5.865 1 1 1972 . 3 1 1 A 246 246 VAL H H 246 8.531 9.759 -1.228 1 1 1973 . 3 1 1 A 246 246 VAL HA H 246 4.518 4.798 -0.280 1 1 1981 . 3 1 1 A 246 246 VAL CA C 246 58.286 61.278 -2.992 1 1 1982 . 3 1 1 A 246 246 VAL N N 246 123.347 125.873 -2.526 1 1 1983 . 3 1 1 A 247 247 GLU H H 247 9.132 8.658 0.474 1 1 1984 . 3 1 1 A 247 247 GLU HA H 247 4.368 5.192 -0.824 1 1 1989 . 3 1 1 A 247 247 GLU CB C 247 26.744 33.719 -6.975 1 1 1990 . 3 1 1 A 247 247 GLU N N 247 129.243 125.727 3.516 1 1 1991 . 3 1 1 A 248 248 THR H H 248 7.827 8.624 -0.797 1 1 1992 . 3 1 1 A 248 248 THR HA H 248 4.749 4.810 -0.061 1 1 1997 . 3 1 1 A 248 248 THR CA C 248 56.859 60.633 -3.774 1 1 1998 . 3 1 1 A 248 248 THR CB C 248 69.171 71.182 -2.011 1 1 2000 . 3 1 1 A 248 248 THR N N 248 114.228 119.357 -5.129 1 1 2001 . 3 1 1 A 249 249 ALA H H 249 9.148 8.774 0.374 1 1 2002 . 3 1 1 A 249 249 ALA HA H 249 4.174 4.143 0.031 1 1 2006 . 3 1 1 A 249 249 ALA CA C 249 51.970 53.581 -1.611 1 1 2007 . 3 1 1 A 249 249 ALA CB C 249 15.797 18.418 -2.621 1 1 2008 . 3 1 1 A 249 249 ALA N N 249 123.341 124.533 -1.192 1 1 2009 . 3 1 1 A 250 250 ASN H H 250 7.974 7.805 0.169 1 1 2010 . 3 1 1 A 250 250 ASN HA H 250 4.953 4.937 0.016 1 1 2015 . 3 1 1 A 250 250 ASN CA C 250 49.198 52.626 -3.428 1 1 2016 . 3 1 1 A 250 250 ASN CB C 250 35.976 39.736 -3.760 1 1 2017 . 3 1 1 A 250 250 ASN N N 250 113.358 116.933 -3.575 1 1 2019 . 3 1 1 A 251 251 GLY H H 251 7.510 7.581 -0.071 1 1 2020 . 3 1 1 A 251 251 GLY HA2 H 251 4.492 3.967 0.525 1 1 2021 . 3 1 1 A 251 251 GLY HA3 H 251 3.853 3.986 -0.133 1 1 2022 . 3 1 1 A 251 251 GLY CA C 251 41.435 45.448 -4.013 1 1 2023 . 3 1 1 A 251 251 GLY N N 251 108.692 107.668 1.024 1 1 2024 . 3 1 1 A 252 252 ILE H H 252 8.465 8.251 0.214 1 1 2025 . 3 1 1 A 252 252 ILE HA H 252 4.521 4.592 -0.071 1 1 2035 . 3 1 1 A 252 252 ILE CB C 252 35.653 41.470 -5.817 1 1 2039 . 3 1 1 A 252 252 ILE N N 252 122.043 120.138 1.905 1 1 2040 . 3 1 1 A 253 253 HIS H H 253 9.311 9.312 -0.001 1 1 2041 . 3 1 1 A 253 253 HIS HA H 253 4.861 5.516 -0.655 1 1 2046 . 3 1 1 A 253 253 HIS N N 253 126.617 122.311 4.306 1 1 2047 . 3 1 1 A 254 254 HIS H H 254 8.820 9.205 -0.385 1 1 2048 . 3 1 1 A 254 254 HIS HA H 254 5.305 5.683 -0.378 1 1 2051 . 3 1 1 A 254 254 HIS CA C 254 52.781 53.625 -0.844 1 1 2052 . 3 1 1 A 254 254 HIS N N 254 122.665 116.216 6.449 1 1 2053 . 3 1 1 A 255 255 ILE H H 255 9.047 8.959 0.088 1 1 2054 . 3 1 1 A 255 255 ILE HA H 255 4.651 4.302 0.349 1 1 2061 . 3 1 1 A 255 255 ILE N N 255 123.958 119.339 4.619 1 1 2062 . 3 1 1 A 256 256 GLY H H 256 9.339 8.148 1.191 1 1 2063 . 3 1 1 A 256 256 GLY HA2 H 256 3.816 2.654 1.162 1 1 2064 . 3 1 1 A 256 256 GLY HA3 H 256 2.267 3.577 -1.310 1 1 2065 . 3 1 1 A 256 256 GLY N N 256 115.022 114.929 0.093 1 1 2066 . 3 1 1 A 257 257 LEU H H 257 7.890 9.365 -1.475 1 1 2067 . 3 1 1 A 257 257 LEU HA H 257 4.853 4.995 -0.142 1 1 2077 . 3 1 1 A 257 257 LEU N N 257 121.441 125.017 -3.576 1 1 2078 . 3 1 1 A 258 258 ALA H H 258 7.982 8.910 -0.928 1 1 2079 . 3 1 1 A 258 258 ALA HA H 258 4.668 5.143 -0.475 1 1 2083 . 3 1 1 A 258 258 ALA CA C 258 49.678 51.735 -2.057 1 1 2084 . 3 1 1 A 258 258 ALA CB C 258 19.561 22.318 -2.757 1 1 2085 . 3 1 1 A 258 258 ALA N N 258 123.234 122.195 1.039 1 1 2086 . 3 1 1 A 259 259 ALA H H 259 9.117 8.856 0.261 1 1 2087 . 3 1 1 A 259 259 ALA HA H 259 4.790 4.786 0.004 1 1 2091 . 3 1 1 A 259 259 ALA N N 259 123.901 122.319 1.582 1 1 2092 . 3 1 1 A 260 260 LYS H H 260 8.452 8.590 -0.138 1 1 2093 . 3 1 1 A 260 260 LYS HA H 260 5.914 4.738 1.176 1 1 2098 . 3 1 1 A 260 260 LYS CA C 260 51.818 54.161 -2.343 1 1 2099 . 3 1 1 A 260 260 LYS N N 260 116.464 116.629 -0.165 1 1 1 . 4 1 1 A 9 9 SER H H 9 8.293 8.319 -0.026 1 1 2 . 4 1 1 A 9 9 SER HA H 9 4.432 4.577 -0.145 1 1 3 . 4 1 1 A 9 9 SER N N 9 116.407 117.329 -0.922 1 1 4 . 4 1 1 A 10 10 GLY H H 10 8.472 7.557 0.915 1 1 5 . 4 1 1 A 10 10 GLY N N 10 111.611 107.572 4.039 1 1 6 . 4 1 1 A 14 14 VAL H H 14 8.009 7.704 0.305 1 1 7 . 4 1 1 A 14 14 VAL HA H 14 4.128 4.013 0.115 1 1 15 . 4 1 1 A 14 14 VAL CA C 14 59.473 62.008 -2.535 1 1 16 . 4 1 1 A 14 14 VAL CB C 14 30.127 33.367 -3.240 1 1 17 . 4 1 1 A 14 14 VAL N N 14 119.846 119.781 0.065 1 1 18 . 4 1 1 A 15 15 THR H H 15 8.152 8.876 -0.724 1 1 19 . 4 1 1 A 15 15 THR HA H 15 4.346 4.368 -0.022 1 1 24 . 4 1 1 A 15 15 THR N N 15 118.509 117.582 0.927 1 1 25 . 4 1 1 A 16 16 ALA H H 16 8.207 7.547 0.660 1 1 26 . 4 1 1 A 16 16 ALA HA H 16 4.319 4.403 -0.084 1 1 30 . 4 1 1 A 16 16 ALA CA C 16 49.835 51.894 -2.059 1 1 31 . 4 1 1 A 16 16 ALA CB C 16 16.714 19.274 -2.560 1 1 32 . 4 1 1 A 16 16 ALA N N 16 126.935 118.318 8.617 1 1 33 . 4 1 1 A 17 17 ASP H H 17 8.269 8.577 -0.308 1 1 34 . 4 1 1 A 17 17 ASP HA H 17 4.581 4.666 -0.085 1 1 37 . 4 1 1 A 17 17 ASP CA C 17 51.643 53.153 -1.510 1 1 38 . 4 1 1 A 17 17 ASP CB C 17 38.257 40.474 -2.217 1 1 39 . 4 1 1 A 17 17 ASP N N 17 120.379 119.049 1.330 1 1 40 . 4 1 1 A 18 18 ILE H H 18 7.979 7.709 0.270 1 1 41 . 4 1 1 A 18 18 ILE HA H 18 4.178 4.123 0.055 1 1 48 . 4 1 1 A 18 18 ILE CA C 18 58.737 63.270 -4.533 1 1 49 . 4 1 1 A 18 18 ILE CB C 18 36.077 38.243 -2.166 1 1 53 . 4 1 1 A 18 18 ILE N N 18 121.171 122.585 -1.414 1 1 54 . 4 1 1 A 19 19 GLY H H 19 8.410 8.351 0.059 1 1 55 . 4 1 1 A 19 19 GLY HA2 H 19 4.023 3.695 0.328 1 1 56 . 4 1 1 A 19 19 GLY HA3 H 19 4.023 3.696 0.327 1 1 57 . 4 1 1 A 19 19 GLY N N 19 112.246 108.236 4.010 1 1 58 . 4 1 1 A 20 20 THR H H 20 8.005 8.277 -0.272 1 1 59 . 4 1 1 A 20 20 THR HA H 20 4.463 4.105 0.358 1 1 64 . 4 1 1 A 20 20 THR CB C 20 66.723 68.750 -2.027 1 1 66 . 4 1 1 A 20 20 THR N N 20 112.239 115.599 -3.360 1 1 67 . 4 1 1 A 21 21 GLY H H 21 8.500 8.493 0.007 1 1 68 . 4 1 1 A 21 21 GLY HA2 H 21 4.099 3.785 0.314 1 1 69 . 4 1 1 A 21 21 GLY HA3 H 21 3.872 3.788 0.084 1 1 70 . 4 1 1 A 21 21 GLY N N 21 111.048 112.552 -1.504 1 1 71 . 4 1 1 A 22 22 LEU H H 22 7.427 7.594 -0.167 1 1 72 . 4 1 1 A 22 22 LEU HA H 22 3.884 4.016 -0.132 1 1 84 . 4 1 1 A 22 22 LEU N N 22 118.837 120.347 -1.510 1 1 85 . 4 1 1 A 23 23 ALA H H 23 7.896 8.166 -0.270 1 1 86 . 4 1 1 A 23 23 ALA HA H 23 4.023 4.170 -0.147 1 1 90 . 4 1 1 A 23 23 ALA CA C 23 52.584 54.196 -1.612 1 1 91 . 4 1 1 A 23 23 ALA CB C 23 15.470 18.408 -2.938 1 1 92 . 4 1 1 A 23 23 ALA N N 23 119.194 121.437 -2.243 1 1 93 . 4 1 1 A 24 24 ASP H H 24 8.265 8.167 0.098 1 1 94 . 4 1 1 A 24 24 ASP HA H 24 4.337 4.611 -0.274 1 1 97 . 4 1 1 A 24 24 ASP CB C 24 37.029 41.236 -4.207 1 1 98 . 4 1 1 A 24 24 ASP N N 24 119.035 117.075 1.960 1 1 99 . 4 1 1 A 25 25 ALA H H 25 8.211 8.551 -0.340 1 1 100 . 4 1 1 A 25 25 ALA HA H 25 4.064 4.829 -0.765 1 1 104 . 4 1 1 A 25 25 ALA CA C 25 53.278 54.717 -1.439 1 1 105 . 4 1 1 A 25 25 ALA CB C 25 15.760 18.572 -2.812 1 1 106 . 4 1 1 A 25 25 ALA N N 25 122.434 121.608 0.826 1 1 107 . 4 1 1 A 26 26 LEU H H 26 7.334 7.617 -0.283 1 1 108 . 4 1 1 A 26 26 LEU HA H 26 4.351 4.258 0.093 1 1 117 . 4 1 1 A 26 26 LEU N N 26 114.238 116.202 -1.964 1 1 118 . 4 1 1 A 27 27 THR H H 27 7.708 7.513 0.195 1 1 119 . 4 1 1 A 27 27 THR HA H 27 4.492 4.250 0.242 1 1 124 . 4 1 1 A 27 27 THR CA C 27 59.438 64.743 -5.305 1 1 125 . 4 1 1 A 27 27 THR CB C 27 68.796 68.310 0.486 1 1 127 . 4 1 1 A 27 27 THR N N 27 106.430 111.771 -5.341 1 1 128 . 4 1 1 A 28 28 ALA H H 28 8.906 7.769 1.137 1 1 129 . 4 1 1 A 28 28 ALA HA H 28 4.812 4.697 0.115 1 1 133 . 4 1 1 A 28 28 ALA CB C 28 16.724 19.831 -3.107 1 1 134 . 4 1 1 A 28 28 ALA N N 28 128.420 123.602 4.818 1 1 135 . 4 1 1 A 29 29 PRO CA C 29 59.166 62.355 -3.189 1 1 136 . 4 1 1 A 29 29 PRO CB C 29 29.865 32.549 -2.684 1 1 139 . 4 1 1 A 30 30 LEU H H 30 8.204 8.302 -0.098 1 1 140 . 4 1 1 A 30 30 LEU HA H 30 4.052 4.211 -0.159 1 1 150 . 4 1 1 A 30 30 LEU N N 30 121.970 123.534 -1.564 1 1 151 . 4 1 1 A 31 31 ASP H H 31 8.720 8.774 -0.054 1 1 152 . 4 1 1 A 31 31 ASP HA H 31 4.772 5.134 -0.362 1 1 155 . 4 1 1 A 31 31 ASP CA C 31 50.115 53.866 -3.751 1 1 156 . 4 1 1 A 31 31 ASP N N 31 125.105 124.144 0.961 1 1 157 . 4 1 1 A 32 32 HIS CA C 32 55.083 55.950 -0.867 1 1 158 . 4 1 1 A 32 32 HIS CB C 32 25.707 28.586 -2.879 1 1 159 . 4 1 1 A 33 33 LYS H H 33 8.589 8.569 0.020 1 1 160 . 4 1 1 A 33 33 LYS HA H 33 4.112 4.436 -0.324 1 1 167 . 4 1 1 A 33 33 LYS CB C 33 29.218 35.634 -6.416 1 1 169 . 4 1 1 A 33 33 LYS N N 33 118.920 121.854 -2.934 1 1 170 . 4 1 1 A 34 34 ASP H H 34 7.420 8.281 -0.861 1 1 171 . 4 1 1 A 34 34 ASP HA H 34 4.368 4.954 -0.586 1 1 174 . 4 1 1 A 34 34 ASP N N 34 120.940 119.645 1.295 1 1 175 . 4 1 1 A 35 35 LYS H H 35 8.266 8.974 -0.708 1 1 176 . 4 1 1 A 35 35 LYS HA H 35 4.169 4.587 -0.418 1 1 183 . 4 1 1 A 35 35 LYS N N 35 121.280 122.891 -1.611 1 1 184 . 4 1 1 A 36 36 GLY H H 36 8.716 7.443 1.273 1 1 185 . 4 1 1 A 36 36 GLY HA2 H 36 3.822 4.107 -0.285 1 1 186 . 4 1 1 A 36 36 GLY HA3 H 36 3.618 4.107 -0.489 1 1 187 . 4 1 1 A 36 36 GLY N N 36 111.002 105.967 5.035 1 1 188 . 4 1 1 A 37 37 LEU H H 37 8.032 8.636 -0.604 1 1 189 . 4 1 1 A 37 37 LEU HA H 37 4.406 4.595 -0.189 1 1 198 . 4 1 1 A 37 37 LEU N N 37 127.683 124.007 3.676 1 1 199 . 4 1 1 A 38 38 LYS H H 38 9.190 8.643 0.547 1 1 200 . 4 1 1 A 38 38 LYS HA H 38 3.925 4.555 -0.630 1 1 205 . 4 1 1 A 38 38 LYS N N 38 132.634 117.714 14.920 1 1 206 . 4 1 1 A 39 39 SER H H 39 7.161 7.888 -0.727 1 1 207 . 4 1 1 A 39 39 SER HA H 39 5.097 5.275 -0.178 1 1 210 . 4 1 1 A 39 39 SER CA C 39 54.451 56.794 -2.343 1 1 211 . 4 1 1 A 39 39 SER N N 39 110.262 114.021 -3.759 1 1 212 . 4 1 1 A 40 40 LEU H H 40 8.142 9.390 -1.248 1 1 213 . 4 1 1 A 40 40 LEU HA H 40 4.481 4.846 -0.365 1 1 223 . 4 1 1 A 40 40 LEU N N 40 122.761 124.303 -1.542 1 1 224 . 4 1 1 A 41 41 THR H H 41 8.641 8.734 -0.093 1 1 225 . 4 1 1 A 41 41 THR HA H 41 4.141 4.890 -0.749 1 1 230 . 4 1 1 A 41 41 THR CA C 41 60.301 61.508 -1.207 1 1 231 . 4 1 1 A 41 41 THR CB C 41 65.862 70.374 -4.512 1 1 233 . 4 1 1 A 41 41 THR N N 41 124.142 119.460 4.682 1 1 234 . 4 1 1 A 42 42 LEU H H 42 8.586 8.943 -0.357 1 1 235 . 4 1 1 A 42 42 LEU HA H 42 4.337 4.368 -0.031 1 1 247 . 4 1 1 A 42 42 LEU N N 42 128.603 126.296 2.307 1 1 248 . 4 1 1 A 43 43 GLU H H 43 8.644 8.914 -0.270 1 1 249 . 4 1 1 A 43 43 GLU HA H 43 4.663 4.074 0.589 1 1 253 . 4 1 1 A 43 43 GLU N N 43 124.180 126.839 -2.659 1 1 254 . 4 1 1 A 44 44 ASP H H 44 10.243 7.790 2.453 1 1 255 . 4 1 1 A 44 44 ASP HA H 44 4.518 4.918 -0.400 1 1 258 . 4 1 1 A 44 44 ASP CA C 44 52.879 53.124 -0.245 1 1 259 . 4 1 1 A 44 44 ASP CB C 44 37.711 41.043 -3.332 1 1 260 . 4 1 1 A 44 44 ASP N N 44 124.177 115.891 8.286 1 1 261 . 4 1 1 A 45 45 SER H H 45 8.546 8.306 0.240 1 1 262 . 4 1 1 A 45 45 SER HA H 45 3.850 4.113 -0.263 1 1 265 . 4 1 1 A 45 45 SER CA C 45 59.588 61.512 -1.924 1 1 266 . 4 1 1 A 45 45 SER CB C 45 61.660 63.143 -1.483 1 1 267 . 4 1 1 A 45 45 SER N N 45 116.191 115.254 0.937 1 1 268 . 4 1 1 A 46 46 ILE H H 46 6.902 7.868 -0.966 1 1 269 . 4 1 1 A 46 46 ILE HA H 46 3.874 4.587 -0.713 1 1 279 . 4 1 1 A 46 46 ILE CA C 46 57.605 59.527 -1.922 1 1 280 . 4 1 1 A 46 46 ILE CB C 46 36.694 40.702 -4.008 1 1 283 . 4 1 1 A 46 46 ILE N N 46 116.189 119.377 -3.188 1 1 284 . 4 1 1 A 47 47 SER H H 47 7.804 8.674 -0.870 1 1 285 . 4 1 1 A 47 47 SER HA H 47 4.342 4.469 -0.127 1 1 288 . 4 1 1 A 47 47 SER CA C 47 55.995 58.356 -2.361 1 1 289 . 4 1 1 A 47 47 SER N N 47 118.738 121.251 -2.513 1 1 290 . 4 1 1 A 48 48 GLN H H 48 8.522 8.722 -0.200 1 1 291 . 4 1 1 A 48 48 GLN HA H 48 3.939 4.016 -0.077 1 1 296 . 4 1 1 A 48 48 GLN CA C 48 55.111 58.436 -3.325 1 1 298 . 4 1 1 A 48 48 GLN N N 48 119.475 123.350 -3.875 1 1 299 . 4 1 1 A 49 49 ASN H H 49 8.437 8.388 0.049 1 1 300 . 4 1 1 A 49 49 ASN HA H 49 4.693 4.670 0.023 1 1 305 . 4 1 1 A 49 49 ASN CA C 49 50.839 52.568 -1.729 1 1 306 . 4 1 1 A 49 49 ASN CB C 49 35.767 37.812 -2.045 1 1 307 . 4 1 1 A 49 49 ASN N N 49 117.233 114.551 2.682 1 1 309 . 4 1 1 A 50 50 GLY H H 50 7.952 7.437 0.515 1 1 310 . 4 1 1 A 50 50 GLY HA2 H 50 4.518 4.070 0.448 1 1 311 . 4 1 1 A 50 50 GLY HA3 H 50 4.054 4.083 -0.029 1 1 312 . 4 1 1 A 50 50 GLY CA C 50 41.883 45.394 -3.511 1 1 313 . 4 1 1 A 50 50 GLY N N 50 108.751 107.931 0.820 1 1 314 . 4 1 1 A 51 51 THR H H 51 8.548 8.353 0.195 1 1 315 . 4 1 1 A 51 51 THR HA H 51 5.012 5.229 -0.217 1 1 320 . 4 1 1 A 51 51 THR CA C 51 57.026 59.986 -2.960 1 1 321 . 4 1 1 A 51 51 THR CB C 51 69.887 70.578 -0.691 1 1 323 . 4 1 1 A 51 51 THR N N 51 108.710 115.886 -7.176 1 1 324 . 4 1 1 A 52 52 LEU H H 52 9.110 8.335 0.775 1 1 325 . 4 1 1 A 52 52 LEU HA H 52 5.183 4.962 0.221 1 1 333 . 4 1 1 A 52 52 LEU CA C 52 50.822 53.630 -2.808 1 1 335 . 4 1 1 A 52 52 LEU N N 52 124.606 122.318 2.288 1 1 336 . 4 1 1 A 53 53 THR H H 53 9.312 8.528 0.784 1 1 337 . 4 1 1 A 53 53 THR HA H 53 5.288 5.369 -0.081 1 1 342 . 4 1 1 A 53 53 THR CA C 53 59.535 61.156 -1.621 1 1 343 . 4 1 1 A 53 53 THR CB C 53 66.838 72.307 -5.469 1 1 345 . 4 1 1 A 53 53 THR N N 53 125.445 115.084 10.361 1 1 346 . 4 1 1 A 54 54 LEU H H 54 8.992 8.638 0.354 1 1 347 . 4 1 1 A 54 54 LEU HA H 54 5.563 5.568 -0.005 1 1 357 . 4 1 1 A 54 54 LEU N N 54 128.814 119.678 9.136 1 1 358 . 4 1 1 A 55 55 SER H H 55 9.017 8.865 0.152 1 1 359 . 4 1 1 A 55 55 SER HA H 55 5.476 5.424 0.052 1 1 362 . 4 1 1 A 55 55 SER CA C 55 53.944 56.578 -2.634 1 1 363 . 4 1 1 A 55 55 SER CB C 55 63.384 64.725 -1.341 1 1 364 . 4 1 1 A 55 55 SER N N 55 112.964 117.654 -4.690 1 1 365 . 4 1 1 A 56 56 ALA H H 56 8.324 9.898 -1.574 1 1 366 . 4 1 1 A 56 56 ALA HA H 56 4.605 4.781 -0.176 1 1 370 . 4 1 1 A 56 56 ALA CA C 56 50.743 51.696 -0.953 1 1 371 . 4 1 1 A 56 56 ALA CB C 56 21.372 19.989 1.383 1 1 372 . 4 1 1 A 56 56 ALA N N 56 123.555 128.700 -5.145 1 1 373 . 4 1 1 A 57 57 GLN H H 57 9.080 8.806 0.274 1 1 374 . 4 1 1 A 57 57 GLN HA H 57 3.884 4.540 -0.656 1 1 381 . 4 1 1 A 57 57 GLN CA C 57 53.331 56.015 -2.684 1 1 382 . 4 1 1 A 57 57 GLN CB C 57 24.659 27.536 -2.877 1 1 384 . 4 1 1 A 57 57 GLN N N 57 116.815 116.532 0.283 1 1 386 . 4 1 1 A 58 58 GLY H H 58 8.527 7.994 0.533 1 1 387 . 4 1 1 A 58 58 GLY HA2 H 58 4.168 4.071 0.097 1 1 388 . 4 1 1 A 58 58 GLY HA3 H 58 3.608 4.071 -0.463 1 1 389 . 4 1 1 A 58 58 GLY CA C 58 42.856 45.590 -2.734 1 1 390 . 4 1 1 A 58 58 GLY N N 58 105.983 107.168 -1.185 1 1 391 . 4 1 1 A 59 59 ALA H H 59 8.203 7.711 0.492 1 1 392 . 4 1 1 A 59 59 ALA HA H 59 4.811 4.666 0.145 1 1 396 . 4 1 1 A 59 59 ALA CA C 59 47.662 51.415 -3.753 1 1 397 . 4 1 1 A 59 59 ALA CB C 59 20.147 22.584 -2.437 1 1 398 . 4 1 1 A 59 59 ALA N N 59 125.153 121.103 4.050 1 1 399 . 4 1 1 A 60 60 GLU H H 60 8.154 8.937 -0.783 1 1 400 . 4 1 1 A 60 60 GLU HA H 60 5.508 5.537 -0.029 1 1 404 . 4 1 1 A 60 60 GLU CA C 60 52.179 54.081 -1.902 1 1 405 . 4 1 1 A 60 60 GLU CB C 60 30.203 34.821 -4.618 1 1 406 . 4 1 1 A 60 60 GLU N N 60 117.318 116.773 0.545 1 1 407 . 4 1 1 A 61 61 LYS H H 61 8.821 8.760 0.061 1 1 408 . 4 1 1 A 61 61 LYS HA H 61 4.311 4.620 -0.309 1 1 413 . 4 1 1 A 61 61 LYS N N 61 123.743 120.260 3.483 1 1 414 . 4 1 1 A 62 62 THR H H 62 8.149 8.704 -0.555 1 1 415 . 4 1 1 A 62 62 THR HA H 62 4.928 5.219 -0.291 1 1 420 . 4 1 1 A 62 62 THR CA C 62 59.427 62.986 -3.559 1 1 421 . 4 1 1 A 62 62 THR CB C 62 66.932 69.079 -2.147 1 1 422 . 4 1 1 A 62 62 THR N N 62 122.829 120.595 2.234 1 1 423 . 4 1 1 A 63 63 TYR H H 63 9.466 9.594 -0.128 1 1 424 . 4 1 1 A 63 63 TYR HA H 63 4.606 5.572 -0.966 1 1 431 . 4 1 1 A 63 63 TYR CA C 63 54.508 55.366 -0.858 1 1 432 . 4 1 1 A 63 63 TYR N N 63 127.472 122.636 4.836 1 1 433 . 4 1 1 A 64 64 GLY H H 64 9.253 8.338 0.915 1 1 434 . 4 1 1 A 64 64 GLY HA2 H 64 4.670 3.871 0.799 1 1 435 . 4 1 1 A 64 64 GLY HA3 H 64 3.619 4.028 -0.409 1 1 436 . 4 1 1 A 64 64 GLY CA C 64 39.885 45.959 -6.074 1 1 437 . 4 1 1 A 64 64 GLY N N 64 110.182 106.074 4.108 1 1 438 . 4 1 1 A 65 65 ASN H H 65 8.616 8.286 0.330 1 1 439 . 4 1 1 A 65 65 ASN HA H 65 4.109 5.105 -0.996 1 1 444 . 4 1 1 A 65 65 ASN CA C 65 53.691 54.857 -1.166 1 1 445 . 4 1 1 A 65 65 ASN N N 65 117.778 122.495 -4.717 1 1 447 . 4 1 1 A 66 66 GLY H H 66 9.053 8.999 0.054 1 1 448 . 4 1 1 A 66 66 GLY HA2 H 66 4.344 3.937 0.407 1 1 449 . 4 1 1 A 66 66 GLY HA3 H 66 3.359 3.942 -0.583 1 1 450 . 4 1 1 A 66 66 GLY CA C 66 42.431 44.952 -2.521 1 1 451 . 4 1 1 A 66 66 GLY N N 66 115.232 113.941 1.291 1 1 452 . 4 1 1 A 67 67 ASP H H 67 8.120 8.358 -0.238 1 1 453 . 4 1 1 A 67 67 ASP HA H 67 4.844 4.661 0.183 1 1 456 . 4 1 1 A 67 67 ASP N N 67 122.593 121.717 0.876 1 1 457 . 4 1 1 A 68 68 SER H H 68 8.500 8.656 -0.156 1 1 458 . 4 1 1 A 68 68 SER HA H 68 5.088 5.142 -0.054 1 1 461 . 4 1 1 A 68 68 SER CA C 68 54.858 56.791 -1.933 1 1 462 . 4 1 1 A 68 68 SER CB C 68 62.114 65.632 -3.518 1 1 463 . 4 1 1 A 68 68 SER N N 68 113.557 116.664 -3.107 1 1 464 . 4 1 1 A 69 69 LEU H H 69 8.989 9.610 -0.621 1 1 465 . 4 1 1 A 69 69 LEU HA H 69 4.570 4.914 -0.344 1 1 474 . 4 1 1 A 69 69 LEU N N 69 126.836 124.739 2.097 1 1 475 . 4 1 1 A 70 70 ASN H H 70 8.491 8.596 -0.105 1 1 476 . 4 1 1 A 70 70 ASN HA H 70 4.958 5.136 -0.178 1 1 479 . 4 1 1 A 70 70 ASN CB C 70 33.265 40.264 -6.999 1 1 480 . 4 1 1 A 70 70 ASN N N 70 126.343 125.863 0.480 1 1 481 . 4 1 1 A 71 71 THR H H 71 7.831 8.573 -0.742 1 1 482 . 4 1 1 A 71 71 THR HA H 71 3.759 4.776 -1.017 1 1 487 . 4 1 1 A 71 71 THR CA C 71 61.005 60.479 0.526 1 1 488 . 4 1 1 A 71 71 THR N N 71 114.742 115.259 -0.517 1 1 489 . 4 1 1 A 72 72 GLY H H 72 8.880 8.232 0.648 1 1 490 . 4 1 1 A 72 72 GLY HA2 H 72 3.907 3.855 0.052 1 1 491 . 4 1 1 A 72 72 GLY HA3 H 72 3.907 3.856 0.051 1 1 492 . 4 1 1 A 72 72 GLY N N 72 114.976 110.847 4.129 1 1 493 . 4 1 1 A 73 73 LYS H H 73 6.604 8.673 -2.069 1 1 494 . 4 1 1 A 73 73 LYS HA H 73 4.160 4.502 -0.342 1 1 501 . 4 1 1 A 73 73 LYS N N 73 113.898 122.652 -8.754 1 1 502 . 4 1 1 A 74 74 LEU H H 74 7.422 7.274 0.148 1 1 503 . 4 1 1 A 74 74 LEU HA H 74 4.358 4.463 -0.105 1 1 513 . 4 1 1 A 74 74 LEU N N 74 117.180 117.616 -0.436 1 1 514 . 4 1 1 A 75 75 LYS H H 75 8.617 8.605 0.012 1 1 515 . 4 1 1 A 75 75 LYS HA H 75 4.079 4.638 -0.559 1 1 518 . 4 1 1 A 75 75 LYS N N 75 121.119 119.160 1.959 1 1 519 . 4 1 1 A 76 76 ASN H H 76 8.154 8.554 -0.400 1 1 520 . 4 1 1 A 76 76 ASN HA H 76 3.935 4.599 -0.664 1 1 525 . 4 1 1 A 76 76 ASN CB C 76 35.772 38.038 -2.266 1 1 526 . 4 1 1 A 76 76 ASN N N 76 122.761 120.404 2.357 1 1 527 . 4 1 1 A 77 77 ASP H H 77 9.227 7.917 1.310 1 1 528 . 4 1 1 A 77 77 ASP HA H 77 3.787 5.221 -1.434 1 1 531 . 4 1 1 A 77 77 ASP CA C 77 52.584 53.931 -1.347 1 1 532 . 4 1 1 A 77 77 ASP N N 77 114.129 117.834 -3.705 1 1 533 . 4 1 1 A 78 78 LYS H H 78 6.579 7.482 -0.903 1 1 534 . 4 1 1 A 78 78 LYS HA H 78 4.572 4.234 0.338 1 1 539 . 4 1 1 A 78 78 LYS CA C 78 51.072 55.901 -4.829 1 1 540 . 4 1 1 A 78 78 LYS CB C 78 33.783 31.427 2.356 1 1 541 . 4 1 1 A 78 78 LYS N N 78 114.135 120.745 -6.610 1 1 542 . 4 1 1 A 79 79 VAL H H 79 8.729 8.150 0.579 1 1 543 . 4 1 1 A 79 79 VAL HA H 79 4.402 4.122 0.280 1 1 551 . 4 1 1 A 79 79 VAL CA C 79 59.240 60.857 -1.617 1 1 553 . 4 1 1 A 79 79 VAL N N 79 123.191 125.654 -2.463 1 1 554 . 4 1 1 A 80 80 SER H H 80 9.542 9.318 0.224 1 1 555 . 4 1 1 A 80 80 SER HA H 80 4.636 5.062 -0.426 1 1 558 . 4 1 1 A 80 80 SER CA C 80 55.978 57.505 -1.527 1 1 559 . 4 1 1 A 80 80 SER N N 80 127.445 121.636 5.809 1 1 560 . 4 1 1 A 81 81 ARG H H 81 8.093 8.671 -0.578 1 1 561 . 4 1 1 A 81 81 ARG HA H 81 5.210 5.398 -0.188 1 1 569 . 4 1 1 A 81 81 ARG N N 81 123.743 124.446 -0.703 1 1 571 . 4 1 1 A 82 82 PHE H H 82 9.312 8.321 0.991 1 1 572 . 4 1 1 A 82 82 PHE HA H 82 4.951 5.179 -0.228 1 1 577 . 4 1 1 A 82 82 PHE CA C 82 53.090 56.287 -3.197 1 1 578 . 4 1 1 A 82 82 PHE N N 82 119.529 119.883 -0.354 1 1 579 . 4 1 1 A 83 83 ASP H H 83 9.122 8.998 0.124 1 1 580 . 4 1 1 A 83 83 ASP HA H 83 5.593 5.331 0.262 1 1 583 . 4 1 1 A 83 83 ASP N N 83 123.825 120.909 2.916 1 1 584 . 4 1 1 A 84 84 PHE H H 84 9.090 8.389 0.701 1 1 585 . 4 1 1 A 84 84 PHE HA H 84 6.410 6.201 0.209 1 1 592 . 4 1 1 A 84 84 PHE CA C 84 52.584 55.691 -3.107 1 1 593 . 4 1 1 A 84 84 PHE N N 84 118.862 120.820 -1.958 1 1 594 . 4 1 1 A 85 85 ILE H H 85 8.441 8.834 -0.393 1 1 595 . 4 1 1 A 85 85 ILE HA H 85 4.662 4.916 -0.254 1 1 605 . 4 1 1 A 85 85 ILE CB C 85 39.939 40.971 -1.032 1 1 608 . 4 1 1 A 85 85 ILE N N 85 118.049 121.701 -3.652 1 1 609 . 4 1 1 A 86 86 ARG H H 86 8.983 9.075 -0.092 1 1 610 . 4 1 1 A 86 86 ARG HA H 86 5.591 4.505 1.086 1 1 616 . 4 1 1 A 86 86 ARG N N 86 127.006 128.472 -1.466 1 1 618 . 4 1 1 A 87 87 GLN H H 87 8.643 8.418 0.225 1 1 619 . 4 1 1 A 87 87 GLN HA H 87 5.630 4.961 0.669 1 1 626 . 4 1 1 A 87 87 GLN CA C 87 51.512 54.385 -2.873 1 1 627 . 4 1 1 A 87 87 GLN N N 87 124.142 121.055 3.087 1 1 629 . 4 1 1 A 88 88 ILE H H 88 8.617 8.514 0.103 1 1 630 . 4 1 1 A 88 88 ILE HA H 88 4.690 4.838 -0.148 1 1 637 . 4 1 1 A 88 88 ILE CA C 88 56.995 60.676 -3.681 1 1 638 . 4 1 1 A 88 88 ILE CB C 88 39.927 40.258 -0.331 1 1 641 . 4 1 1 A 88 88 ILE N N 88 116.353 122.139 -5.786 1 1 642 . 4 1 1 A 89 89 GLU H H 89 8.298 8.986 -0.688 1 1 643 . 4 1 1 A 89 89 GLU HA H 89 5.100 5.855 -0.755 1 1 646 . 4 1 1 A 89 89 GLU CA C 89 52.204 54.842 -2.638 1 1 647 . 4 1 1 A 89 89 GLU CB C 89 27.325 33.181 -5.856 1 1 648 . 4 1 1 A 89 89 GLU N N 89 124.458 129.216 -4.758 1 1 649 . 4 1 1 A 90 90 VAL H H 90 8.957 8.778 0.179 1 1 650 . 4 1 1 A 90 90 VAL HA H 90 4.169 4.624 -0.455 1 1 658 . 4 1 1 A 90 90 VAL CA C 90 58.664 59.885 -1.221 1 1 659 . 4 1 1 A 90 90 VAL CB C 90 31.861 33.621 -1.760 1 1 660 . 4 1 1 A 90 90 VAL N N 90 127.580 126.253 1.327 1 1 661 . 4 1 1 A 91 91 ASP H H 91 9.369 8.550 0.819 1 1 662 . 4 1 1 A 91 91 ASP HA H 91 4.287 4.563 -0.276 1 1 665 . 4 1 1 A 91 91 ASP CA C 91 52.389 54.877 -2.488 1 1 666 . 4 1 1 A 91 91 ASP CB C 91 36.409 40.378 -3.969 1 1 667 . 4 1 1 A 91 91 ASP N N 91 129.411 123.799 5.612 1 1 668 . 4 1 1 A 92 92 GLY H H 92 8.552 7.415 1.137 1 1 669 . 4 1 1 A 92 92 GLY HA2 H 92 4.090 4.085 0.005 1 1 670 . 4 1 1 A 92 92 GLY HA3 H 92 3.618 4.085 -0.467 1 1 671 . 4 1 1 A 92 92 GLY CA C 92 42.836 45.584 -2.748 1 1 672 . 4 1 1 A 92 92 GLY N N 92 103.862 105.497 -1.635 1 1 673 . 4 1 1 A 93 93 GLN H H 93 7.808 7.603 0.205 1 1 674 . 4 1 1 A 93 93 GLN HA H 93 4.578 4.812 -0.234 1 1 679 . 4 1 1 A 93 93 GLN CA C 93 50.918 54.295 -3.377 1 1 680 . 4 1 1 A 93 93 GLN CB C 93 28.602 31.169 -2.567 1 1 682 . 4 1 1 A 93 93 GLN N N 93 120.412 118.739 1.673 1 1 683 . 4 1 1 A 94 94 LEU H H 94 8.414 8.464 -0.050 1 1 684 . 4 1 1 A 94 94 LEU HA H 94 4.704 4.233 0.471 1 1 693 . 4 1 1 A 94 94 LEU CB C 94 39.873 42.380 -2.507 1 1 696 . 4 1 1 A 94 94 LEU N N 94 125.061 122.357 2.704 1 1 697 . 4 1 1 A 95 95 ILE H H 95 9.181 8.612 0.569 1 1 698 . 4 1 1 A 95 95 ILE HA H 95 4.371 4.974 -0.603 1 1 708 . 4 1 1 A 95 95 ILE CA C 95 63.319 60.756 2.563 1 1 709 . 4 1 1 A 95 95 ILE CB C 95 37.407 39.636 -2.229 1 1 711 . 4 1 1 A 95 95 ILE N N 95 127.724 121.808 5.916 1 1 712 . 4 1 1 A 96 96 THR H H 96 8.730 7.443 1.287 1 1 713 . 4 1 1 A 96 96 THR HA H 96 4.411 4.321 0.090 1 1 718 . 4 1 1 A 96 96 THR CA C 96 60.344 63.126 -2.782 1 1 719 . 4 1 1 A 96 96 THR CB C 96 59.719 69.255 -9.536 1 1 720 . 4 1 1 A 96 96 THR N N 96 124.240 118.920 5.320 1 1 721 . 4 1 1 A 97 97 LEU H H 97 8.790 8.734 0.056 1 1 722 . 4 1 1 A 97 97 LEU HA H 97 4.400 4.873 -0.473 1 1 732 . 4 1 1 A 97 97 LEU N N 97 126.147 124.234 1.913 1 1 733 . 4 1 1 A 98 98 GLU H H 98 7.596 8.899 -1.303 1 1 734 . 4 1 1 A 98 98 GLU HA H 98 5.102 4.796 0.306 1 1 739 . 4 1 1 A 98 98 GLU N N 98 116.937 122.510 -5.573 1 1 740 . 4 1 1 A 99 99 SER H H 99 8.906 8.886 0.020 1 1 741 . 4 1 1 A 99 99 SER HA H 99 4.504 5.447 -0.943 1 1 744 . 4 1 1 A 99 99 SER CA C 99 54.010 56.222 -2.212 1 1 745 . 4 1 1 A 99 99 SER CB C 99 63.876 66.593 -2.717 1 1 746 . 4 1 1 A 99 99 SER N N 99 117.823 118.507 -0.684 1 1 747 . 4 1 1 A 100 100 GLY H H 100 7.250 7.918 -0.668 1 1 748 . 4 1 1 A 100 100 GLY HA2 H 100 4.872 4.113 0.759 1 1 749 . 4 1 1 A 100 100 GLY HA3 H 100 3.731 4.173 -0.442 1 1 750 . 4 1 1 A 100 100 GLY N N 100 109.436 110.090 -0.654 1 1 751 . 4 1 1 A 101 101 GLU H H 101 9.661 9.476 0.185 1 1 752 . 4 1 1 A 101 101 GLU HA H 101 5.643 4.964 0.679 1 1 757 . 4 1 1 A 101 101 GLU CA C 101 52.584 54.719 -2.135 1 1 758 . 4 1 1 A 101 101 GLU CB C 101 31.750 33.061 -1.311 1 1 759 . 4 1 1 A 101 101 GLU N N 101 126.793 120.882 5.911 1 1 760 . 4 1 1 A 102 102 PHE H H 102 10.441 9.412 1.029 1 1 761 . 4 1 1 A 102 102 PHE HA H 102 5.248 5.348 -0.100 1 1 768 . 4 1 1 A 102 102 PHE CA C 102 53.537 56.253 -2.716 1 1 769 . 4 1 1 A 102 102 PHE N N 102 131.837 123.360 8.477 1 1 770 . 4 1 1 A 103 103 GLN H H 103 9.135 10.088 -0.953 1 1 771 . 4 1 1 A 103 103 GLN HA H 103 5.205 4.548 0.657 1 1 776 . 4 1 1 A 103 103 GLN CA C 103 50.925 54.699 -3.774 1 1 777 . 4 1 1 A 103 103 GLN N N 103 127.720 125.520 2.200 1 1 778 . 4 1 1 A 104 104 VAL H H 104 8.937 9.560 -0.623 1 1 779 . 4 1 1 A 104 104 VAL HA H 104 4.780 4.881 -0.101 1 1 787 . 4 1 1 A 104 104 VAL CA C 104 57.086 60.604 -3.518 1 1 789 . 4 1 1 A 104 104 VAL N N 104 120.097 125.964 -5.867 1 1 790 . 4 1 1 A 105 105 TYR H H 105 9.108 8.700 0.408 1 1 791 . 4 1 1 A 105 105 TYR HA H 105 4.834 5.513 -0.679 1 1 798 . 4 1 1 A 105 105 TYR CA C 105 54.486 57.542 -3.056 1 1 799 . 4 1 1 A 105 105 TYR N N 105 128.426 125.818 2.608 1 1 800 . 4 1 1 A 106 106 LYS H H 106 5.945 8.973 -3.028 1 1 805 . 4 1 1 A 106 106 LYS N N 106 129.163 125.238 3.925 1 1 806 . 4 1 1 A 107 107 GLN H H 107 8.526 8.666 -0.140 1 1 807 . 4 1 1 A 107 107 GLN HA H 107 5.160 5.560 -0.400 1 1 812 . 4 1 1 A 107 107 GLN CA C 107 52.584 54.708 -2.124 1 1 813 . 4 1 1 A 107 107 GLN CB C 107 26.175 30.499 -4.324 1 1 814 . 4 1 1 A 107 107 GLN N N 107 125.978 121.788 4.190 1 1 815 . 4 1 1 A 108 108 SER H H 108 8.621 8.688 -0.067 1 1 816 . 4 1 1 A 108 108 SER HA H 108 4.403 4.772 -0.369 1 1 819 . 4 1 1 A 108 108 SER CA C 108 58.521 61.623 -3.102 1 1 820 . 4 1 1 A 108 108 SER CB C 108 60.737 63.227 -2.490 1 1 821 . 4 1 1 A 108 108 SER N N 108 117.542 119.596 -2.054 1 1 822 . 4 1 1 A 109 109 HIS H H 109 10.381 8.250 2.131 1 1 823 . 4 1 1 A 109 109 HIS HA H 109 4.594 4.836 -0.242 1 1 828 . 4 1 1 A 109 109 HIS CA C 109 51.743 56.321 -4.578 1 1 829 . 4 1 1 A 109 109 HIS CB C 109 27.174 31.508 -4.334 1 1 830 . 4 1 1 A 109 109 HIS N N 109 118.449 116.448 2.001 1 1 831 . 4 1 1 A 110 110 SER H H 110 7.366 7.837 -0.471 1 1 832 . 4 1 1 A 110 110 SER HA H 110 4.870 4.879 -0.009 1 1 835 . 4 1 1 A 110 110 SER CB C 110 62.986 65.429 -2.443 1 1 836 . 4 1 1 A 110 110 SER N N 110 113.397 114.519 -1.122 1 1 837 . 4 1 1 A 111 111 ALA H H 111 8.541 8.474 0.067 1 1 838 . 4 1 1 A 111 111 ALA HA H 111 4.826 4.947 -0.121 1 1 842 . 4 1 1 A 111 111 ALA CA C 111 49.015 51.669 -2.654 1 1 843 . 4 1 1 A 111 111 ALA CB C 111 20.256 23.081 -2.825 1 1 844 . 4 1 1 A 111 111 ALA N N 111 117.786 124.162 -6.376 1 1 845 . 4 1 1 A 112 112 LEU H H 112 8.529 8.702 -0.173 1 1 846 . 4 1 1 A 112 112 LEU HA H 112 5.680 5.197 0.483 1 1 855 . 4 1 1 A 112 112 LEU CA C 112 51.818 53.756 -1.938 1 1 856 . 4 1 1 A 112 112 LEU N N 112 116.345 116.010 0.335 1 1 857 . 4 1 1 A 113 113 THR H H 113 8.758 8.398 0.360 1 1 858 . 4 1 1 A 113 113 THR HA H 113 5.563 5.302 0.261 1 1 863 . 4 1 1 A 113 113 THR CA C 113 54.458 59.783 -5.325 1 1 864 . 4 1 1 A 113 113 THR CB C 113 68.586 72.888 -4.302 1 1 866 . 4 1 1 A 113 113 THR N N 113 110.469 109.148 1.321 1 1 867 . 4 1 1 A 114 114 ALA H H 114 8.829 8.079 0.750 1 1 868 . 4 1 1 A 114 114 ALA HA H 114 4.466 5.101 -0.635 1 1 872 . 4 1 1 A 114 114 ALA CA C 114 48.886 51.621 -2.735 1 1 873 . 4 1 1 A 114 114 ALA CB C 114 21.583 22.906 -1.323 1 1 874 . 4 1 1 A 114 114 ALA N N 114 121.456 121.472 -0.016 1 1 875 . 4 1 1 A 115 115 LEU H H 115 8.407 9.150 -0.743 1 1 876 . 4 1 1 A 115 115 LEU HA H 115 4.814 5.589 -0.775 1 1 886 . 4 1 1 A 115 115 LEU N N 115 119.223 117.954 1.269 1 1 887 . 4 1 1 A 116 116 GLN H H 116 9.720 9.668 0.052 1 1 888 . 4 1 1 A 116 116 GLN HA H 116 5.312 5.046 0.266 1 1 893 . 4 1 1 A 116 116 GLN CA C 116 50.544 54.501 -3.957 1 1 894 . 4 1 1 A 116 116 GLN N N 116 127.827 120.925 6.902 1 1 895 . 4 1 1 A 117 117 THR H H 117 9.663 9.841 -0.178 1 1 896 . 4 1 1 A 117 117 THR HA H 117 4.198 4.352 -0.154 1 1 901 . 4 1 1 A 117 117 THR CA C 117 64.037 63.282 0.755 1 1 902 . 4 1 1 A 117 117 THR CB C 117 66.868 69.441 -2.573 1 1 904 . 4 1 1 A 117 117 THR N N 117 128.929 122.123 6.806 1 1 905 . 4 1 1 A 118 118 GLU H H 118 9.486 8.945 0.541 1 1 906 . 4 1 1 A 118 118 GLU HA H 118 4.885 4.720 0.165 1 1 911 . 4 1 1 A 118 118 GLU N N 118 123.497 121.749 1.748 1 1 912 . 4 1 1 A 119 119 GLN H H 119 8.076 7.587 0.489 1 1 913 . 4 1 1 A 119 119 GLN HA H 119 5.331 4.904 0.427 1 1 916 . 4 1 1 A 119 119 GLN CA C 119 51.858 54.176 -2.318 1 1 917 . 4 1 1 A 119 119 GLN N N 119 118.023 120.077 -2.054 1 1 918 . 4 1 1 A 120 120 GLU H H 120 9.078 9.384 -0.306 1 1 919 . 4 1 1 A 120 120 GLU HA H 120 5.071 4.878 0.193 1 1 924 . 4 1 1 A 120 120 GLU N N 120 118.433 124.142 -5.709 1 1 925 . 4 1 1 A 121 121 GLN H H 121 7.711 8.735 -1.024 1 1 926 . 4 1 1 A 121 121 GLN HA H 121 4.430 5.356 -0.926 1 1 933 . 4 1 1 A 121 121 GLN CA C 121 53.996 54.575 -0.579 1 1 934 . 4 1 1 A 121 121 GLN CB C 121 27.158 32.365 -5.207 1 1 936 . 4 1 1 A 121 121 GLN N N 121 122.412 120.177 2.235 1 1 938 . 4 1 1 A 122 122 ASP H H 122 8.675 9.937 -1.262 1 1 939 . 4 1 1 A 122 122 ASP HA H 122 4.632 5.085 -0.453 1 1 942 . 4 1 1 A 122 122 ASP CA C 122 48.797 51.149 -2.352 1 1 943 . 4 1 1 A 122 122 ASP CB C 122 39.852 42.151 -2.299 1 1 944 . 4 1 1 A 122 122 ASP N N 122 128.625 123.321 5.304 1 1 945 . 4 1 1 A 123 123 PRO CA C 123 61.579 65.647 -4.068 1 1 946 . 4 1 1 A 123 123 PRO CB C 123 29.597 31.488 -1.891 1 1 948 . 4 1 1 A 124 124 GLU H H 124 8.297 8.744 -0.447 1 1 949 . 4 1 1 A 124 124 GLU HA H 124 4.196 3.798 0.398 1 1 954 . 4 1 1 A 124 124 GLU CA C 124 53.025 59.469 -6.444 1 1 955 . 4 1 1 A 124 124 GLU CB C 124 27.927 29.488 -1.561 1 1 957 . 4 1 1 A 124 124 GLU N N 124 115.538 117.607 -2.069 1 1 958 . 4 1 1 A 125 125 HIS H H 125 7.419 8.016 -0.597 1 1 959 . 4 1 1 A 125 125 HIS HA H 125 4.833 4.959 -0.126 1 1 964 . 4 1 1 A 125 125 HIS CA C 125 51.886 54.123 -2.237 1 1 965 . 4 1 1 A 125 125 HIS CB C 125 26.387 29.302 -2.915 1 1 966 . 4 1 1 A 125 125 HIS N N 125 117.464 116.993 0.471 1 1 967 . 4 1 1 A 126 126 SER H H 126 8.441 8.288 0.153 1 1 968 . 4 1 1 A 126 126 SER HA H 126 4.261 4.760 -0.499 1 1 971 . 4 1 1 A 126 126 SER CA C 126 57.988 61.556 -3.568 1 1 972 . 4 1 1 A 126 126 SER N N 126 117.954 120.548 -2.594 1 1 973 . 4 1 1 A 127 127 GLU H H 127 9.221 7.897 1.324 1 1 974 . 4 1 1 A 127 127 GLU HA H 127 4.366 4.373 -0.007 1 1 979 . 4 1 1 A 127 127 GLU CA C 127 53.707 57.474 -3.767 1 1 980 . 4 1 1 A 127 127 GLU CB C 127 25.492 29.535 -4.043 1 1 981 . 4 1 1 A 127 127 GLU N N 127 120.404 117.894 2.510 1 1 982 . 4 1 1 A 128 128 LYS H H 128 8.262 9.636 -1.374 1 1 983 . 4 1 1 A 128 128 LYS HA H 128 4.661 4.403 0.258 1 1 990 . 4 1 1 A 128 128 LYS CA C 128 52.264 56.133 -3.869 1 1 991 . 4 1 1 A 128 128 LYS CB C 128 32.404 33.386 -0.982 1 1 994 . 4 1 1 A 128 128 LYS N N 128 122.166 120.959 1.207 1 1 995 . 4 1 1 A 129 129 MET H H 129 8.242 8.763 -0.521 1 1 996 . 4 1 1 A 129 129 MET HA H 129 5.012 6.096 -1.084 1 1 1001 . 4 1 1 A 129 129 MET CA C 129 50.958 53.545 -2.587 1 1 1003 . 4 1 1 A 129 129 MET N N 129 119.422 120.544 -1.122 1 1 1004 . 4 1 1 A 130 130 VAL H H 130 9.200 8.897 0.303 1 1 1005 . 4 1 1 A 130 130 VAL HA H 130 4.609 4.693 -0.084 1 1 1013 . 4 1 1 A 130 130 VAL CA C 130 56.296 60.988 -4.692 1 1 1014 . 4 1 1 A 130 130 VAL CB C 130 32.606 32.970 -0.364 1 1 1015 . 4 1 1 A 130 130 VAL N N 130 118.290 122.995 -4.705 1 1 1016 . 4 1 1 A 131 131 ALA H H 131 8.368 8.651 -0.283 1 1 1017 . 4 1 1 A 131 131 ALA HA H 131 4.654 5.202 -0.548 1 1 1021 . 4 1 1 A 131 131 ALA CA C 131 49.739 50.520 -0.781 1 1 1022 . 4 1 1 A 131 131 ALA CB C 131 15.351 21.072 -5.721 1 1 1023 . 4 1 1 A 131 131 ALA N N 131 126.734 125.148 1.586 1 1 1024 . 4 1 1 A 132 132 LYS H H 132 7.732 8.688 -0.956 1 1 1025 . 4 1 1 A 132 132 LYS HA H 132 4.171 5.004 -0.833 1 1 1028 . 4 1 1 A 132 132 LYS N N 132 127.309 121.336 5.973 1 1 1029 . 4 1 1 A 133 133 ARG H H 133 8.193 8.808 -0.615 1 1 1030 . 4 1 1 A 133 133 ARG HA H 133 5.073 5.134 -0.061 1 1 1038 . 4 1 1 A 133 133 ARG N N 133 122.190 118.178 4.012 1 1 1040 . 4 1 1 A 134 134 ARG H H 134 7.539 9.184 -1.645 1 1 1041 . 4 1 1 A 134 134 ARG HA H 134 4.667 5.044 -0.377 1 1 1049 . 4 1 1 A 134 134 ARG CA C 134 52.584 55.162 -2.578 1 1 1050 . 4 1 1 A 134 134 ARG CB C 134 31.325 32.458 -1.133 1 1 1052 . 4 1 1 A 134 134 ARG N N 134 121.632 126.502 -4.870 1 1 1054 . 4 1 1 A 135 135 PHE H H 135 8.816 8.924 -0.108 1 1 1055 . 4 1 1 A 135 135 PHE HA H 135 5.680 5.807 -0.127 1 1 1062 . 4 1 1 A 135 135 PHE N N 135 125.107 123.851 1.256 1 1 1063 . 4 1 1 A 136 136 ARG H H 136 7.741 9.972 -2.231 1 1 1064 . 4 1 1 A 136 136 ARG HA H 136 4.402 4.855 -0.453 1 1 1068 . 4 1 1 A 136 136 ARG N N 136 125.640 125.363 0.277 1 1 1070 . 4 1 1 A 137 137 ILE H H 137 8.556 8.567 -0.011 1 1 1071 . 4 1 1 A 137 137 ILE HA H 137 3.912 4.932 -1.020 1 1 1076 . 4 1 1 A 137 137 ILE CA C 137 55.676 58.903 -3.227 1 1 1079 . 4 1 1 A 137 137 ILE N N 137 122.891 122.822 0.069 1 1 1080 . 4 1 1 A 138 138 GLY H H 138 8.676 8.751 -0.075 1 1 1081 . 4 1 1 A 138 138 GLY HA2 H 138 3.740 4.181 -0.441 1 1 1082 . 4 1 1 A 138 138 GLY HA3 H 138 2.982 4.189 -1.207 1 1 1083 . 4 1 1 A 138 138 GLY CA C 138 41.908 45.827 -3.919 1 1 1084 . 4 1 1 A 138 138 GLY N N 138 117.058 113.217 3.841 1 1 1085 . 4 1 1 A 139 139 ASP H H 139 7.858 8.116 -0.258 1 1 1086 . 4 1 1 A 139 139 ASP HA H 139 4.753 4.856 -0.103 1 1 1089 . 4 1 1 A 139 139 ASP CA C 139 52.584 54.102 -1.518 1 1 1090 . 4 1 1 A 139 139 ASP CB C 139 43.062 41.578 1.484 1 1 1091 . 4 1 1 A 139 139 ASP N N 139 124.516 122.070 2.446 1 1 1092 . 4 1 1 A 140 140 ILE H H 140 8.354 9.143 -0.789 1 1 1093 . 4 1 1 A 140 140 ILE HA H 140 4.473 4.415 0.058 1 1 1103 . 4 1 1 A 140 140 ILE CB C 140 36.173 38.375 -2.202 1 1 1105 . 4 1 1 A 140 140 ILE N N 140 120.679 127.612 -6.933 1 1 1106 . 4 1 1 A 141 141 ALA H H 141 8.708 7.038 1.670 1 1 1107 . 4 1 1 A 141 141 ALA HA H 141 4.862 3.680 1.182 1 1 1111 . 4 1 1 A 141 141 ALA CA C 141 47.968 52.713 -4.745 1 1 1112 . 4 1 1 A 141 141 ALA CB C 141 21.733 17.911 3.822 1 1 1113 . 4 1 1 A 141 141 ALA N N 141 130.144 126.521 3.623 1 1 1114 . 4 1 1 A 142 142 GLY H H 142 7.888 8.287 -0.399 1 1 1115 . 4 1 1 A 142 142 GLY HA2 H 142 4.519 4.181 0.338 1 1 1116 . 4 1 1 A 142 142 GLY HA3 H 142 3.634 4.223 -0.589 1 1 1117 . 4 1 1 A 142 142 GLY N N 142 102.272 109.983 -7.711 1 1 1118 . 4 1 1 A 143 143 GLU H H 143 8.068 7.986 0.082 1 1 1119 . 4 1 1 A 143 143 GLU HA H 143 4.577 4.743 -0.166 1 1 1124 . 4 1 1 A 143 143 GLU N N 143 120.569 121.714 -1.145 1 1 1125 . 4 1 1 A 144 144 HIS H H 144 8.478 8.733 -0.255 1 1 1126 . 4 1 1 A 144 144 HIS HA H 144 4.968 4.662 0.306 1 1 1131 . 4 1 1 A 144 144 HIS N N 144 124.275 119.661 4.614 1 1 1132 . 4 1 1 A 145 145 THR H H 145 9.031 8.207 0.824 1 1 1133 . 4 1 1 A 145 145 THR HA H 145 4.025 4.458 -0.433 1 1 1138 . 4 1 1 A 145 145 THR CA C 145 61.247 60.914 0.333 1 1 1139 . 4 1 1 A 145 145 THR CB C 145 65.181 69.239 -4.058 1 1 1141 . 4 1 1 A 145 145 THR N N 145 125.828 117.576 8.252 1 1 1142 . 4 1 1 A 146 146 SER H H 146 9.077 7.748 1.329 1 1 1143 . 4 1 1 A 146 146 SER HA H 146 4.684 5.725 -1.041 1 1 1145 . 4 1 1 A 146 146 SER CA C 146 56.067 57.895 -1.828 1 1 1146 . 4 1 1 A 146 146 SER CB C 146 60.510 61.188 -0.678 1 1 1147 . 4 1 1 A 146 146 SER N N 146 124.154 117.688 6.466 1 1 1148 . 4 1 1 A 147 147 PHE H H 147 9.049 9.344 -0.295 1 1 1149 . 4 1 1 A 147 147 PHE HA H 147 4.022 4.210 -0.188 1 1 1154 . 4 1 1 A 147 147 PHE N N 147 127.670 124.430 3.240 1 1 1155 . 4 1 1 A 148 148 ASP H H 148 8.504 8.287 0.217 1 1 1156 . 4 1 1 A 148 148 ASP HA H 148 4.422 4.570 -0.148 1 1 1158 . 4 1 1 A 148 148 ASP CA C 148 52.584 56.787 -4.203 1 1 1159 . 4 1 1 A 148 148 ASP CB C 148 37.800 40.937 -3.137 1 1 1160 . 4 1 1 A 148 148 ASP N N 148 114.377 120.064 -5.687 1 1 1161 . 4 1 1 A 149 149 LYS H H 149 7.380 9.981 -2.601 1 1 1162 . 4 1 1 A 149 149 LYS HA H 149 4.487 4.228 0.259 1 1 1171 . 4 1 1 A 149 149 LYS CA C 149 51.735 57.070 -5.335 1 1 1172 . 4 1 1 A 149 149 LYS CB C 149 30.162 33.239 -3.077 1 1 1175 . 4 1 1 A 149 149 LYS N N 149 119.137 119.117 0.020 1 1 1176 . 4 1 1 A 150 150 LEU H H 150 6.886 7.730 -0.844 1 1 1177 . 4 1 1 A 150 150 LEU HA H 150 3.996 4.645 -0.649 1 1 1186 . 4 1 1 A 150 150 LEU CA C 150 50.502 52.121 -1.619 1 1 1187 . 4 1 1 A 150 150 LEU N N 150 120.614 115.581 5.033 1 1 1188 . 4 1 1 A 151 151 PRO CB C 151 29.567 31.406 -1.839 1 1 1190 . 4 1 1 A 152 152 LYS H H 152 8.076 8.650 -0.574 1 1 1191 . 4 1 1 A 152 152 LYS HA H 152 4.346 4.502 -0.156 1 1 1195 . 4 1 1 A 152 152 LYS CA C 152 53.182 56.672 -3.490 1 1 1196 . 4 1 1 A 152 152 LYS CB C 152 31.487 34.602 -3.115 1 1 1198 . 4 1 1 A 152 152 LYS N N 152 118.133 120.513 -2.380 1 1 1199 . 4 1 1 A 153 153 ASP H H 153 7.982 7.436 0.546 1 1 1200 . 4 1 1 A 153 153 ASP HA H 153 4.402 3.604 0.798 1 1 1203 . 4 1 1 A 153 153 ASP CA C 153 52.584 52.489 0.095 1 1 1204 . 4 1 1 A 153 153 ASP CB C 153 37.762 41.430 -3.668 1 1 1205 . 4 1 1 A 153 153 ASP N N 153 115.735 115.393 0.342 1 1 1206 . 4 1 1 A 154 154 VAL H H 154 6.987 6.579 0.408 1 1 1207 . 4 1 1 A 154 154 VAL HA H 154 4.406 4.226 0.180 1 1 1215 . 4 1 1 A 154 154 VAL CA C 154 58.408 61.677 -3.269 1 1 1216 . 4 1 1 A 154 154 VAL CB C 154 32.617 32.010 0.607 1 1 1217 . 4 1 1 A 154 154 VAL N N 154 116.266 120.032 -3.766 1 1 1218 . 4 1 1 A 155 155 MET H H 155 8.444 8.641 -0.197 1 1 1219 . 4 1 1 A 155 155 MET HA H 155 5.416 4.831 0.585 1 1 1224 . 4 1 1 A 155 155 MET CA C 155 51.183 54.587 -3.404 1 1 1226 . 4 1 1 A 155 155 MET N N 155 124.950 127.140 -2.190 1 1 1227 . 4 1 1 A 156 156 ALA H H 156 9.226 9.421 -0.195 1 1 1228 . 4 1 1 A 156 156 ALA HA H 156 4.693 4.968 -0.275 1 1 1232 . 4 1 1 A 156 156 ALA CA C 156 48.379 51.217 -2.838 1 1 1233 . 4 1 1 A 156 156 ALA CB C 156 21.051 19.981 1.070 1 1 1234 . 4 1 1 A 156 156 ALA N N 156 129.938 127.728 2.210 1 1 1235 . 4 1 1 A 157 157 THR H H 157 8.554 8.844 -0.290 1 1 1236 . 4 1 1 A 157 157 THR HA H 157 4.839 5.353 -0.514 1 1 1241 . 4 1 1 A 157 157 THR CA C 157 59.555 62.023 -2.468 1 1 1242 . 4 1 1 A 157 157 THR CB C 157 68.575 70.791 -2.216 1 1 1244 . 4 1 1 A 157 157 THR N N 157 118.815 119.150 -0.335 1 1 1245 . 4 1 1 A 158 158 TYR H H 158 9.974 8.982 0.992 1 1 1246 . 4 1 1 A 158 158 TYR HA H 158 4.435 5.876 -1.441 1 1 1253 . 4 1 1 A 158 158 TYR N N 158 126.958 124.386 2.572 1 1 1254 . 4 1 1 A 159 159 ARG H H 159 8.909 8.744 0.165 1 1 1255 . 4 1 1 A 159 159 ARG HA H 159 5.444 5.332 0.112 1 1 1263 . 4 1 1 A 159 159 ARG CA C 159 51.933 54.479 -2.546 1 1 1264 . 4 1 1 A 159 159 ARG N N 159 121.721 118.981 2.740 1 1 1266 . 4 1 1 A 160 160 GLY H H 160 8.910 8.360 0.550 1 1 1267 . 4 1 1 A 160 160 GLY HA2 H 160 4.904 4.428 0.476 1 1 1268 . 4 1 1 A 160 160 GLY HA3 H 160 4.484 4.508 -0.024 1 1 1269 . 4 1 1 A 160 160 GLY N N 160 113.921 106.449 7.472 1 1 1270 . 4 1 1 A 161 161 THR H H 161 9.110 8.914 0.196 1 1 1271 . 4 1 1 A 161 161 THR HA H 161 4.810 5.269 -0.459 1 1 1276 . 4 1 1 A 161 161 THR CA C 161 59.603 59.607 -0.004 1 1 1277 . 4 1 1 A 161 161 THR CB C 161 69.909 72.433 -2.524 1 1 1279 . 4 1 1 A 161 161 THR N N 161 126.813 114.765 12.048 1 1 1280 . 4 1 1 A 162 162 ALA H H 162 7.137 9.698 -2.561 1 1 1281 . 4 1 1 A 162 162 ALA HA H 162 5.361 5.475 -0.114 1 1 1285 . 4 1 1 A 162 162 ALA CA C 162 46.573 50.595 -4.022 1 1 1286 . 4 1 1 A 162 162 ALA CB C 162 20.959 23.885 -2.926 1 1 1287 . 4 1 1 A 162 162 ALA N N 162 128.111 126.365 1.746 1 1 1288 . 4 1 1 A 163 163 PHE H H 163 8.587 8.776 -0.189 1 1 1289 . 4 1 1 A 163 163 PHE HA H 163 5.538 4.800 0.738 1 1 1296 . 4 1 1 A 163 163 PHE N N 163 117.349 115.816 1.533 1 1 1297 . 4 1 1 A 164 164 GLY H H 164 8.650 8.576 0.074 1 1 1298 . 4 1 1 A 164 164 GLY HA2 H 164 4.210 4.087 0.123 1 1 1299 . 4 1 1 A 164 164 GLY HA3 H 164 3.285 4.123 -0.838 1 1 1300 . 4 1 1 A 164 164 GLY CA C 164 40.377 43.326 -2.949 1 1 1301 . 4 1 1 A 164 164 GLY N N 164 108.839 111.363 -2.524 1 1 1302 . 4 1 1 A 165 165 SER H H 165 7.684 8.781 -1.097 1 1 1303 . 4 1 1 A 165 165 SER HA H 165 3.458 4.552 -1.094 1 1 1304 . 4 1 1 A 165 165 SER N N 165 116.037 114.996 1.041 1 1 1305 . 4 1 1 A 166 166 ASP H H 166 9.718 8.279 1.439 1 1 1306 . 4 1 1 A 166 166 ASP HA H 166 4.281 4.829 -0.548 1 1 1309 . 4 1 1 A 166 166 ASP CA C 166 52.584 53.376 -0.792 1 1 1310 . 4 1 1 A 166 166 ASP N N 166 125.166 119.998 5.168 1 1 1311 . 4 1 1 A 167 167 ASP H H 167 7.655 7.891 -0.236 1 1 1312 . 4 1 1 A 167 167 ASP HA H 167 4.666 4.967 -0.301 1 1 1315 . 4 1 1 A 167 167 ASP CB C 167 38.948 44.920 -5.972 1 1 1316 . 4 1 1 A 167 167 ASP N N 167 117.491 118.989 -1.498 1 1 1317 . 4 1 1 A 168 168 ALA H H 168 8.585 8.596 -0.011 1 1 1318 . 4 1 1 A 168 168 ALA HA H 168 5.012 4.220 0.792 1 1 1322 . 4 1 1 A 168 168 ALA CA C 168 47.485 52.473 -4.988 1 1 1323 . 4 1 1 A 168 168 ALA N N 168 128.834 123.640 5.194 1 1 1324 . 4 1 1 A 169 169 GLY H H 169 8.472 8.324 0.148 1 1 1325 . 4 1 1 A 169 169 GLY HA2 H 169 4.404 1.654 2.750 1 1 1326 . 4 1 1 A 169 169 GLY HA3 H 169 4.051 2.215 1.836 1 1 1327 . 4 1 1 A 169 169 GLY CA C 169 43.257 45.788 -2.531 1 1 1328 . 4 1 1 A 169 169 GLY N N 169 107.133 108.172 -1.039 1 1 1329 . 4 1 1 A 170 170 GLY H H 170 7.229 7.298 -0.069 1 1 1330 . 4 1 1 A 170 170 GLY HA2 H 170 4.223 4.050 0.173 1 1 1331 . 4 1 1 A 170 170 GLY HA3 H 170 3.781 4.082 -0.301 1 1 1332 . 4 1 1 A 170 170 GLY CA C 170 43.310 45.595 -2.285 1 1 1333 . 4 1 1 A 170 170 GLY N N 170 107.542 107.973 -0.431 1 1 1334 . 4 1 1 A 171 171 LYS H H 171 9.641 8.919 0.722 1 1 1335 . 4 1 1 A 171 171 LYS HA H 171 5.129 5.104 0.025 1 1 1342 . 4 1 1 A 171 171 LYS CA C 171 51.355 55.479 -4.124 1 1 1343 . 4 1 1 A 171 171 LYS N N 171 124.322 120.309 4.013 1 1 1344 . 4 1 1 A 172 172 LEU H H 172 7.764 8.589 -0.825 1 1 1345 . 4 1 1 A 172 172 LEU HA H 172 4.973 4.978 -0.005 1 1 1353 . 4 1 1 A 172 172 LEU CA C 172 50.348 53.875 -3.527 1 1 1354 . 4 1 1 A 172 172 LEU N N 172 126.389 122.789 3.600 1 1 1355 . 4 1 1 A 173 173 THR H H 173 8.321 8.248 0.073 1 1 1356 . 4 1 1 A 173 173 THR HA H 173 5.017 5.285 -0.268 1 1 1361 . 4 1 1 A 173 173 THR CA C 173 59.149 60.794 -1.645 1 1 1362 . 4 1 1 A 173 173 THR CB C 173 67.449 71.515 -4.066 1 1 1364 . 4 1 1 A 173 173 THR N N 173 123.553 115.417 8.136 1 1 1365 . 4 1 1 A 174 174 TYR H H 174 9.367 9.998 -0.631 1 1 1366 . 4 1 1 A 174 174 TYR HA H 174 4.660 5.144 -0.484 1 1 1373 . 4 1 1 A 174 174 TYR CB C 174 41.267 43.874 -2.607 1 1 1374 . 4 1 1 A 174 174 TYR N N 174 129.583 125.099 4.484 1 1 1375 . 4 1 1 A 175 175 THR H H 175 8.529 9.817 -1.288 1 1 1376 . 4 1 1 A 175 175 THR HA H 175 5.388 5.065 0.323 1 1 1381 . 4 1 1 A 175 175 THR CA C 175 58.216 61.859 -3.643 1 1 1382 . 4 1 1 A 175 175 THR CB C 175 68.575 71.186 -2.611 1 1 1384 . 4 1 1 A 175 175 THR N N 175 125.967 115.175 10.792 1 1 1385 . 4 1 1 A 176 176 ILE H H 176 9.139 10.636 -1.497 1 1 1386 . 4 1 1 A 176 176 ILE HA H 176 4.382 4.759 -0.377 1 1 1395 . 4 1 1 A 176 176 ILE CA C 176 58.006 59.804 -1.798 1 1 1396 . 4 1 1 A 176 176 ILE CB C 176 38.881 40.342 -1.461 1 1 1400 . 4 1 1 A 176 176 ILE N N 176 123.715 127.685 -3.970 1 1 1401 . 4 1 1 A 177 177 ASP H H 177 8.501 9.290 -0.789 1 1 1402 . 4 1 1 A 177 177 ASP HA H 177 5.011 5.122 -0.111 1 1 1405 . 4 1 1 A 177 177 ASP CA C 177 49.089 52.313 -3.224 1 1 1406 . 4 1 1 A 177 177 ASP CB C 177 39.282 43.159 -3.877 1 1 1407 . 4 1 1 A 177 177 ASP N N 177 125.978 125.651 0.327 1 1 1408 . 4 1 1 A 178 178 PHE H H 178 8.913 9.221 -0.308 1 1 1409 . 4 1 1 A 178 178 PHE HA H 178 3.993 5.133 -1.140 1 1 1414 . 4 1 1 A 178 178 PHE CB C 178 34.588 40.809 -6.221 1 1 1415 . 4 1 1 A 178 178 PHE N N 178 123.522 122.271 1.251 1 1 1416 . 4 1 1 A 179 179 ALA H H 179 8.487 9.571 -1.084 1 1 1417 . 4 1 1 A 179 179 ALA HA H 179 4.528 4.065 0.463 1 1 1421 . 4 1 1 A 179 179 ALA CA C 179 52.584 54.574 -1.990 1 1 1422 . 4 1 1 A 179 179 ALA CB C 179 15.666 18.704 -3.038 1 1 1423 . 4 1 1 A 179 179 ALA N N 179 124.061 122.179 1.882 1 1 1424 . 4 1 1 A 180 180 ALA H H 180 7.162 6.446 0.716 1 1 1425 . 4 1 1 A 180 180 ALA HA H 180 4.313 3.900 0.413 1 1 1429 . 4 1 1 A 180 180 ALA CA C 180 49.006 54.330 -5.324 1 1 1430 . 4 1 1 A 180 180 ALA CB C 180 16.933 18.492 -1.559 1 1 1431 . 4 1 1 A 180 180 ALA N N 180 119.710 120.001 -0.291 1 1 1432 . 4 1 1 A 181 181 LYS H H 181 8.092 7.614 0.478 1 1 1433 . 4 1 1 A 181 181 LYS HA H 181 3.457 4.500 -1.043 1 1 1440 . 4 1 1 A 181 181 LYS CA C 181 54.783 55.548 -0.765 1 1 1441 . 4 1 1 A 181 181 LYS CB C 181 27.088 32.879 -5.791 1 1 1444 . 4 1 1 A 181 181 LYS N N 181 114.996 115.376 -0.380 1 1 1445 . 4 1 1 A 182 182 GLN H H 182 7.532 7.197 0.335 1 1 1446 . 4 1 1 A 182 182 GLN HA H 182 5.304 4.961 0.343 1 1 1453 . 4 1 1 A 182 182 GLN CA C 182 51.473 54.573 -3.100 1 1 1454 . 4 1 1 A 182 182 GLN CB C 182 31.585 32.619 -1.034 1 1 1455 . 4 1 1 A 182 182 GLN N N 182 115.064 122.881 -7.817 1 1 1457 . 4 1 1 A 183 183 GLY H H 183 9.026 8.344 0.682 1 1 1458 . 4 1 1 A 183 183 GLY HA2 H 183 5.376 4.221 1.155 1 1 1459 . 4 1 1 A 183 183 GLY HA3 H 183 3.567 4.330 -0.763 1 1 1460 . 4 1 1 A 183 183 GLY CA C 183 42.361 45.782 -3.421 1 1 1461 . 4 1 1 A 183 183 GLY N N 183 111.505 110.063 1.442 1 1 1462 . 4 1 1 A 184 184 HIS H H 184 7.508 8.761 -1.253 1 1 1463 . 4 1 1 A 184 184 HIS HA H 184 4.304 5.188 -0.884 1 1 1467 . 4 1 1 A 184 184 HIS CA C 184 52.793 53.804 -1.011 1 1 1468 . 4 1 1 A 184 184 HIS CB C 184 27.906 33.830 -5.924 1 1 1469 . 4 1 1 A 184 184 HIS N N 184 111.297 122.790 -11.493 1 1 1470 . 4 1 1 A 185 185 GLY H H 185 9.160 6.503 2.657 1 1 1471 . 4 1 1 A 185 185 GLY HA2 H 185 4.464 2.782 1.682 1 1 1472 . 4 1 1 A 185 185 GLY HA3 H 185 4.117 3.500 0.617 1 1 1473 . 4 1 1 A 185 185 GLY CA C 185 44.212 44.747 -0.535 1 1 1474 . 4 1 1 A 185 185 GLY N N 185 107.398 106.049 1.349 1 1 1475 . 4 1 1 A 186 186 LYS H H 186 9.170 8.367 0.803 1 1 1476 . 4 1 1 A 186 186 LYS HA H 186 4.925 4.695 0.230 1 1 1481 . 4 1 1 A 186 186 LYS CB C 186 33.642 34.605 -0.963 1 1 1482 . 4 1 1 A 186 186 LYS N N 186 122.690 119.115 3.575 1 1 1483 . 4 1 1 A 187 187 ILE H H 187 8.444 9.052 -0.608 1 1 1484 . 4 1 1 A 187 187 ILE HA H 187 4.626 5.142 -0.516 1 1 1487 . 4 1 1 A 187 187 ILE N N 187 124.320 123.983 0.337 1 1 1488 . 4 1 1 A 188 188 GLU H H 188 8.590 8.454 0.136 1 1 1489 . 4 1 1 A 188 188 GLU HA H 188 4.650 4.729 -0.079 1 1 1495 . 4 1 1 A 188 188 GLU N N 188 122.575 128.019 -5.444 1 1 1496 . 4 1 1 A 189 189 HIS H H 189 8.726 8.339 0.387 1 1 1497 . 4 1 1 A 189 189 HIS HA H 189 4.055 4.075 -0.020 1 1 1501 . 4 1 1 A 189 189 HIS CA C 189 54.623 59.316 -4.693 1 1 1502 . 4 1 1 A 189 189 HIS CB C 189 24.997 29.914 -4.917 1 1 1503 . 4 1 1 A 189 189 HIS N N 189 111.381 122.510 -11.129 1 1 1504 . 4 1 1 A 190 190 LEU H H 190 9.715 7.749 1.966 1 1 1505 . 4 1 1 A 190 190 LEU HA H 190 4.379 4.390 -0.011 1 1 1515 . 4 1 1 A 190 190 LEU N N 190 124.648 116.689 7.959 1 1 1516 . 4 1 1 A 191 191 LYS H H 191 10.099 8.018 2.081 1 1 1517 . 4 1 1 A 191 191 LYS HA H 191 3.736 4.493 -0.757 1 1 1524 . 4 1 1 A 191 191 LYS CA C 191 55.815 56.904 -1.089 1 1 1525 . 4 1 1 A 191 191 LYS CB C 191 30.201 35.359 -5.158 1 1 1527 . 4 1 1 A 191 191 LYS N N 191 123.618 120.694 2.924 1 1 1528 . 4 1 1 A 192 192 SER H H 192 6.991 7.637 -0.646 1 1 1529 . 4 1 1 A 192 192 SER HA H 192 4.743 4.493 0.250 1 1 1532 . 4 1 1 A 192 192 SER CA C 192 51.974 56.384 -4.410 1 1 1533 . 4 1 1 A 192 192 SER CB C 192 60.005 63.690 -3.685 1 1 1534 . 4 1 1 A 192 192 SER N N 192 115.071 116.905 -1.834 1 1 1535 . 4 1 1 A 193 193 PRO CB C 193 29.607 29.748 -0.141 1 1 1537 . 4 1 1 A 194 194 GLU H H 194 8.213 8.706 -0.493 1 1 1538 . 4 1 1 A 194 194 GLU HA H 194 3.063 4.630 -1.567 1 1 1543 . 4 1 1 A 194 194 GLU CA C 194 54.185 57.273 -3.088 1 1 1545 . 4 1 1 A 194 194 GLU N N 194 114.055 120.617 -6.562 1 1 1546 . 4 1 1 A 195 195 LEU H H 195 7.082 7.690 -0.608 1 1 1547 . 4 1 1 A 195 195 LEU HA H 195 4.027 4.572 -0.545 1 1 1557 . 4 1 1 A 195 195 LEU CA C 195 51.361 53.982 -2.621 1 1 1558 . 4 1 1 A 195 195 LEU CB C 195 38.950 41.084 -2.134 1 1 1561 . 4 1 1 A 195 195 LEU N N 195 113.898 117.859 -3.961 1 1 1562 . 4 1 1 A 196 196 ASN H H 196 7.060 7.658 -0.598 1 1 1563 . 4 1 1 A 196 196 ASN HA H 196 4.638 4.659 -0.021 1 1 1567 . 4 1 1 A 196 196 ASN N N 196 119.196 118.206 0.990 1 1 1568 . 4 1 1 A 197 197 VAL H H 197 7.244 9.019 -1.775 1 1 1569 . 4 1 1 A 197 197 VAL HA H 197 4.540 4.504 0.036 1 1 1577 . 4 1 1 A 197 197 VAL CA C 197 57.176 59.946 -2.770 1 1 1578 . 4 1 1 A 197 197 VAL N N 197 113.621 118.539 -4.918 1 1 1579 . 4 1 1 A 198 198 ASP H H 198 8.881 9.227 -0.346 1 1 1580 . 4 1 1 A 198 198 ASP HA H 198 4.894 5.165 -0.271 1 1 1581 . 4 1 1 A 198 198 ASP N N 198 118.852 124.670 -5.818 1 1 1582 . 4 1 1 A 199 199 LEU H H 199 8.498 8.657 -0.159 1 1 1583 . 4 1 1 A 199 199 LEU HA H 199 4.317 4.902 -0.585 1 1 1591 . 4 1 1 A 199 199 LEU N N 199 124.078 127.187 -3.109 1 1 1592 . 4 1 1 A 200 200 ALA H H 200 8.386 8.762 -0.376 1 1 1593 . 4 1 1 A 200 200 ALA HA H 200 4.295 5.550 -1.255 1 1 1597 . 4 1 1 A 200 200 ALA CA C 200 50.044 51.477 -1.433 1 1 1598 . 4 1 1 A 200 200 ALA CB C 200 17.985 22.418 -4.433 1 1 1599 . 4 1 1 A 200 200 ALA N N 200 127.315 125.692 1.623 1 1 1600 . 4 1 1 A 201 201 VAL H H 201 8.007 8.938 -0.931 1 1 1601 . 4 1 1 A 201 201 VAL HA H 201 4.577 4.864 -0.287 1 1 1609 . 4 1 1 A 201 201 VAL CA C 201 60.004 59.911 0.093 1 1 1610 . 4 1 1 A 201 201 VAL CB C 201 28.863 36.034 -7.171 1 1 1611 . 4 1 1 A 201 201 VAL N N 201 119.409 122.029 -2.620 1 1 1612 . 4 1 1 A 202 202 ALA H H 202 8.789 8.906 -0.117 1 1 1613 . 4 1 1 A 202 202 ALA HA H 202 4.630 5.283 -0.653 1 1 1617 . 4 1 1 A 202 202 ALA CA C 202 48.200 50.131 -1.931 1 1 1618 . 4 1 1 A 202 202 ALA N N 202 131.745 126.270 5.475 1 1 1619 . 4 1 1 A 203 203 TYR H H 203 8.522 8.888 -0.366 1 1 1620 . 4 1 1 A 203 203 TYR HA H 203 5.391 5.321 0.070 1 1 1627 . 4 1 1 A 203 203 TYR CA C 203 54.648 57.982 -3.334 1 1 1628 . 4 1 1 A 203 203 TYR CB C 203 37.315 40.659 -3.344 1 1 1629 . 4 1 1 A 203 203 TYR N N 203 117.786 119.481 -1.695 1 1 1630 . 4 1 1 A 204 204 ILE H H 204 8.209 8.280 -0.071 1 1 1631 . 4 1 1 A 204 204 ILE HA H 204 4.393 4.578 -0.185 1 1 1641 . 4 1 1 A 204 204 ILE CB C 204 36.807 41.401 -4.594 1 1 1644 . 4 1 1 A 204 204 ILE N N 204 120.602 125.211 -4.609 1 1 1645 . 4 1 1 A 205 205 LYS H H 205 9.340 8.945 0.395 1 1 1646 . 4 1 1 A 205 205 LYS HA H 205 4.756 4.329 0.427 1 1 1651 . 4 1 1 A 205 205 LYS CA C 205 50.844 60.915 -10.071 1 1 1652 . 4 1 1 A 205 205 LYS N N 205 127.960 127.202 0.758 1 1 1653 . 4 1 1 A 207 207 ASP H H 207 8.436 8.462 -0.026 1 1 1654 . 4 1 1 A 207 207 ASP HA H 207 4.692 4.557 0.135 1 1 1657 . 4 1 1 A 207 207 ASP CA C 207 48.789 53.096 -4.307 1 1 1658 . 4 1 1 A 207 207 ASP CB C 207 38.377 41.830 -3.453 1 1 1659 . 4 1 1 A 207 207 ASP N N 207 123.098 122.730 0.368 1 1 1660 . 4 1 1 A 208 208 GLU H H 208 8.880 8.470 0.410 1 1 1661 . 4 1 1 A 208 208 GLU HA H 208 3.994 3.875 0.119 1 1 1666 . 4 1 1 A 208 208 GLU CA C 208 56.123 59.358 -3.235 1 1 1667 . 4 1 1 A 208 208 GLU CB C 208 25.794 29.215 -3.421 1 1 1669 . 4 1 1 A 208 208 GLU N N 208 119.042 121.749 -2.707 1 1 1670 . 4 1 1 A 209 209 LYS H H 209 7.681 7.733 -0.052 1 1 1671 . 4 1 1 A 209 209 LYS HA H 209 4.141 4.232 -0.091 1 1 1680 . 4 1 1 A 209 209 LYS N N 209 119.252 116.117 3.135 1 1 1681 . 4 1 1 A 210 210 HIS H H 210 8.177 7.470 0.707 1 1 1682 . 4 1 1 A 210 210 HIS HA H 210 3.825 5.493 -1.668 1 1 1687 . 4 1 1 A 210 210 HIS CA C 210 54.205 55.294 -1.089 1 1 1688 . 4 1 1 A 210 210 HIS CB C 210 23.439 31.578 -8.139 1 1 1689 . 4 1 1 A 210 210 HIS N N 210 112.758 112.110 0.648 1 1 1690 . 4 1 1 A 211 211 HIS H H 211 8.758 7.636 1.122 1 1 1691 . 4 1 1 A 211 211 HIS HA H 211 5.041 5.371 -0.330 1 1 1695 . 4 1 1 A 211 211 HIS CA C 211 50.450 56.326 -5.876 1 1 1696 . 4 1 1 A 211 211 HIS CB C 211 25.703 30.396 -4.693 1 1 1697 . 4 1 1 A 211 211 HIS N N 211 119.552 119.658 -0.106 1 1 1698 . 4 1 1 A 212 212 ALA H H 212 8.556 8.364 0.192 1 1 1699 . 4 1 1 A 212 212 ALA HA H 212 4.712 4.238 0.474 1 1 1703 . 4 1 1 A 212 212 ALA CA C 212 49.886 50.715 -0.829 1 1 1704 . 4 1 1 A 212 212 ALA CB C 212 18.860 19.833 -0.973 1 1 1705 . 4 1 1 A 212 212 ALA N N 212 123.780 123.149 0.631 1 1 1706 . 4 1 1 A 213 213 VAL H H 213 9.338 7.894 1.444 1 1 1707 . 4 1 1 A 213 213 VAL HA H 213 5.074 4.837 0.237 1 1 1715 . 4 1 1 A 213 213 VAL CA C 213 57.486 59.741 -2.255 1 1 1716 . 4 1 1 A 213 213 VAL CB C 213 33.938 35.558 -1.620 1 1 1717 . 4 1 1 A 213 213 VAL N N 213 124.742 119.606 5.136 1 1 1718 . 4 1 1 A 214 214 ILE H H 214 8.962 8.662 0.300 1 1 1719 . 4 1 1 A 214 214 ILE HA H 214 4.434 5.146 -0.712 1 1 1726 . 4 1 1 A 214 214 ILE N N 214 122.881 125.319 -2.438 1 1 1727 . 4 1 1 A 215 215 SER H H 215 8.558 8.626 -0.068 1 1 1728 . 4 1 1 A 215 215 SER HA H 215 5.001 5.749 -0.748 1 1 1731 . 4 1 1 A 215 215 SER CA C 215 53.230 56.701 -3.471 1 1 1732 . 4 1 1 A 215 215 SER CB C 215 62.077 66.243 -4.166 1 1 1733 . 4 1 1 A 215 215 SER N N 215 122.891 121.536 1.355 1 1 1734 . 4 1 1 A 216 216 GLY H H 216 7.282 9.071 -1.789 1 1 1735 . 4 1 1 A 216 216 GLY HA2 H 216 4.515 4.365 0.150 1 1 1736 . 4 1 1 A 216 216 GLY HA3 H 216 3.473 4.389 -0.916 1 1 1737 . 4 1 1 A 216 216 GLY CA C 216 42.816 46.166 -3.350 1 1 1738 . 4 1 1 A 216 216 GLY N N 216 110.899 112.851 -1.952 1 1 1739 . 4 1 1 A 217 217 SER H H 217 8.673 8.622 0.051 1 1 1740 . 4 1 1 A 217 217 SER HA H 217 5.127 5.486 -0.359 1 1 1743 . 4 1 1 A 217 217 SER CA C 217 56.266 56.778 -0.512 1 1 1744 . 4 1 1 A 217 217 SER N N 217 117.164 117.103 0.061 1 1 1745 . 4 1 1 A 218 218 VAL H H 218 7.451 9.307 -1.856 1 1 1746 . 4 1 1 A 218 218 VAL HA H 218 5.128 4.964 0.164 1 1 1754 . 4 1 1 A 218 218 VAL CA C 218 56.637 60.638 -4.001 1 1 1755 . 4 1 1 A 218 218 VAL N N 218 117.826 119.981 -2.155 1 1 1756 . 4 1 1 A 219 219 LEU H H 219 9.022 8.708 0.314 1 1 1757 . 4 1 1 A 219 219 LEU HA H 219 5.387 5.165 0.222 1 1 1767 . 4 1 1 A 219 219 LEU CA C 219 50.450 53.978 -3.528 1 1 1768 . 4 1 1 A 219 219 LEU N N 219 124.820 125.484 -0.664 1 1 1769 . 4 1 1 A 220 220 TYR H H 220 8.816 8.363 0.453 1 1 1770 . 4 1 1 A 220 220 TYR HA H 220 4.834 5.043 -0.209 1 1 1777 . 4 1 1 A 220 220 TYR N N 220 121.249 122.700 -1.451 1 1 1778 . 4 1 1 A 221 221 ASN H H 221 9.191 7.865 1.326 1 1 1779 . 4 1 1 A 221 221 ASN HA H 221 4.048 4.572 -0.524 1 1 1784 . 4 1 1 A 221 221 ASN CA C 221 51.647 54.608 -2.961 1 1 1785 . 4 1 1 A 221 221 ASN CB C 221 36.640 37.895 -1.255 1 1 1786 . 4 1 1 A 221 221 ASN N N 221 129.865 122.138 7.727 1 1 1788 . 4 1 1 A 222 222 GLN H H 222 8.468 7.754 0.714 1 1 1789 . 4 1 1 A 222 222 GLN HA H 222 3.671 4.576 -0.905 1 1 1794 . 4 1 1 A 222 222 GLN CA C 222 55.075 55.043 0.032 1 1 1795 . 4 1 1 A 222 222 GLN CB C 222 24.663 29.593 -4.930 1 1 1797 . 4 1 1 A 222 222 GLN N N 222 108.367 118.212 -9.845 1 1 1798 . 4 1 1 A 223 223 ASP H H 223 7.797 8.395 -0.598 1 1 1799 . 4 1 1 A 223 223 ASP HA H 223 4.986 4.992 -0.006 1 1 1802 . 4 1 1 A 223 223 ASP N N 223 120.842 119.631 1.211 1 1 1803 . 4 1 1 A 224 224 GLU H H 224 8.731 8.032 0.699 1 1 1804 . 4 1 1 A 224 224 GLU HA H 224 4.690 4.544 0.146 1 1 1809 . 4 1 1 A 224 224 GLU CA C 224 54.703 55.607 -0.904 1 1 1810 . 4 1 1 A 224 224 GLU CB C 224 26.357 30.196 -3.839 1 1 1812 . 4 1 1 A 224 224 GLU N N 224 124.249 113.787 10.462 1 1 1813 . 4 1 1 A 225 225 LYS H H 225 8.730 8.100 0.630 1 1 1814 . 4 1 1 A 225 225 LYS HA H 225 4.754 4.935 -0.181 1 1 1822 . 4 1 1 A 225 225 LYS N N 225 126.784 119.382 7.402 1 1 1823 . 4 1 1 A 226 226 GLY H H 226 7.683 8.528 -0.845 1 1 1824 . 4 1 1 A 226 226 GLY HA2 H 226 5.567 4.157 1.410 1 1 1825 . 4 1 1 A 226 226 GLY HA3 H 226 3.819 4.192 -0.373 1 1 1826 . 4 1 1 A 226 226 GLY CA C 226 42.264 44.242 -1.978 1 1 1827 . 4 1 1 A 226 226 GLY N N 226 107.140 111.522 -4.382 1 1 1828 . 4 1 1 A 227 227 SER H H 227 8.672 9.105 -0.433 1 1 1829 . 4 1 1 A 227 227 SER HA H 227 5.564 5.175 0.389 1 1 1832 . 4 1 1 A 227 227 SER CA C 227 54.373 56.364 -1.991 1 1 1833 . 4 1 1 A 227 227 SER CB C 227 63.963 66.005 -2.042 1 1 1834 . 4 1 1 A 227 227 SER N N 227 117.767 115.451 2.316 1 1 1835 . 4 1 1 A 228 228 TYR H H 228 9.073 8.720 0.353 1 1 1836 . 4 1 1 A 228 228 TYR HA H 228 5.519 5.044 0.475 1 1 1843 . 4 1 1 A 228 228 TYR N N 228 118.324 123.865 -5.541 1 1 1844 . 4 1 1 A 229 229 SER H H 229 8.929 8.354 0.575 1 1 1845 . 4 1 1 A 229 229 SER HA H 229 5.209 5.664 -0.455 1 1 1848 . 4 1 1 A 229 229 SER CA C 229 54.131 57.679 -3.548 1 1 1849 . 4 1 1 A 229 229 SER N N 229 116.118 123.284 -7.166 1 1 1850 . 4 1 1 A 230 230 LEU H H 230 9.372 9.925 -0.553 1 1 1851 . 4 1 1 A 230 230 LEU HA H 230 4.803 4.939 -0.136 1 1 1863 . 4 1 1 A 230 230 LEU N N 230 124.803 127.545 -2.742 1 1 1864 . 4 1 1 A 231 231 GLY H H 231 9.080 8.434 0.646 1 1 1865 . 4 1 1 A 231 231 GLY HA2 H 231 4.776 4.205 0.571 1 1 1866 . 4 1 1 A 231 231 GLY HA3 H 231 3.528 4.271 -0.743 1 1 1867 . 4 1 1 A 231 231 GLY CA C 231 41.468 44.552 -3.084 1 1 1868 . 4 1 1 A 231 231 GLY N N 231 109.611 110.530 -0.919 1 1 1869 . 4 1 1 A 232 232 ILE H H 232 6.849 9.109 -2.260 1 1 1870 . 4 1 1 A 232 232 ILE HA H 232 4.742 4.774 -0.032 1 1 1878 . 4 1 1 A 232 232 ILE N N 232 120.566 124.417 -3.851 1 1 1879 . 4 1 1 A 233 233 PHE H H 233 9.569 7.884 1.685 1 1 1880 . 4 1 1 A 233 233 PHE HA H 233 4.979 6.404 -1.425 1 1 1885 . 4 1 1 A 233 233 PHE N N 233 129.256 124.338 4.918 1 1 1886 . 4 1 1 A 234 234 GLY H H 234 8.734 8.901 -0.167 1 1 1887 . 4 1 1 A 234 234 GLY HA2 H 234 4.488 4.263 0.225 1 1 1888 . 4 1 1 A 234 234 GLY HA3 H 234 3.327 4.284 -0.957 1 1 1889 . 4 1 1 A 234 234 GLY CA C 234 40.377 46.008 -5.631 1 1 1890 . 4 1 1 A 234 234 GLY N N 234 105.294 107.727 -2.433 1 1 1891 . 4 1 1 A 235 235 GLU H H 235 9.198 8.829 0.369 1 1 1892 . 4 1 1 A 235 235 GLU HA H 235 4.111 3.969 0.142 1 1 1897 . 4 1 1 A 235 235 GLU CA C 235 56.466 59.122 -2.656 1 1 1898 . 4 1 1 A 235 235 GLU CB C 235 26.256 29.775 -3.519 1 1 1900 . 4 1 1 A 235 235 GLU N N 235 125.813 124.179 1.634 1 1 1901 . 4 1 1 A 236 236 LYS H H 236 8.147 7.569 0.578 1 1 1902 . 4 1 1 A 236 236 LYS HA H 236 4.373 4.616 -0.243 1 1 1905 . 4 1 1 A 236 236 LYS N N 236 117.810 113.678 4.132 1 1 1906 . 4 1 1 A 237 237 ALA H H 237 7.685 7.864 -0.179 1 1 1907 . 4 1 1 A 237 237 ALA HA H 237 3.902 4.497 -0.595 1 1 1911 . 4 1 1 A 237 237 ALA CA C 237 49.762 51.624 -1.862 1 1 1912 . 4 1 1 A 237 237 ALA CB C 237 14.720 20.008 -5.288 1 1 1913 . 4 1 1 A 237 237 ALA N N 237 118.704 121.723 -3.019 1 1 1914 . 4 1 1 A 238 238 GLN H H 238 9.312 8.184 1.128 1 1 1915 . 4 1 1 A 238 238 GLN HA H 238 4.049 4.516 -0.467 1 1 1920 . 4 1 1 A 238 238 GLN N N 238 118.059 117.970 0.089 1 1 1921 . 4 1 1 A 239 239 GLU H H 239 8.785 7.350 1.435 1 1 1922 . 4 1 1 A 239 239 GLU HA H 239 5.531 4.712 0.819 1 1 1927 . 4 1 1 A 239 239 GLU N N 239 116.914 114.077 2.837 1 1 1928 . 4 1 1 A 240 240 VAL H H 240 8.501 9.349 -0.848 1 1 1929 . 4 1 1 A 240 240 VAL HA H 240 5.655 4.241 1.414 1 1 1937 . 4 1 1 A 240 240 VAL CA C 240 55.582 60.353 -4.771 1 1 1940 . 4 1 1 A 240 240 VAL N N 240 110.588 119.523 -8.935 1 1 1941 . 4 1 1 A 241 241 ALA H H 241 8.463 8.834 -0.371 1 1 1942 . 4 1 1 A 241 241 ALA HA H 241 5.014 5.316 -0.302 1 1 1946 . 4 1 1 A 241 241 ALA CA C 241 49.361 50.757 -1.396 1 1 1947 . 4 1 1 A 241 241 ALA CB C 241 18.196 23.258 -5.062 1 1 1948 . 4 1 1 A 241 241 ALA N N 241 121.125 130.205 -9.080 1 1 1949 . 4 1 1 A 242 242 GLY H H 242 9.421 8.413 1.008 1 1 1950 . 4 1 1 A 242 242 GLY HA2 H 242 5.161 4.264 0.897 1 1 1951 . 4 1 1 A 242 242 GLY HA3 H 242 4.076 4.296 -0.220 1 1 1952 . 4 1 1 A 242 242 GLY N N 242 112.036 107.233 4.803 1 1 1953 . 4 1 1 A 243 243 SER H H 243 8.929 8.269 0.660 1 1 1954 . 4 1 1 A 243 243 SER HA H 243 5.331 5.326 0.005 1 1 1957 . 4 1 1 A 243 243 SER N N 243 116.113 116.142 -0.029 1 1 1958 . 4 1 1 A 244 244 ALA H H 244 9.218 9.068 0.150 1 1 1959 . 4 1 1 A 244 244 ALA HA H 244 5.221 4.842 0.379 1 1 1963 . 4 1 1 A 244 244 ALA CA C 244 47.883 50.270 -2.387 1 1 1964 . 4 1 1 A 244 244 ALA N N 244 120.635 127.300 -6.665 1 1 1965 . 4 1 1 A 245 245 GLU H H 245 9.194 8.524 0.670 1 1 1966 . 4 1 1 A 245 245 GLU HA H 245 4.869 5.099 -0.230 1 1 1971 . 4 1 1 A 245 245 GLU N N 245 123.487 118.874 4.613 1 1 1972 . 4 1 1 A 246 246 VAL H H 246 8.531 8.749 -0.218 1 1 1973 . 4 1 1 A 246 246 VAL HA H 246 4.518 4.602 -0.084 1 1 1981 . 4 1 1 A 246 246 VAL CA C 246 58.286 61.795 -3.509 1 1 1982 . 4 1 1 A 246 246 VAL N N 246 123.347 121.847 1.500 1 1 1983 . 4 1 1 A 247 247 GLU H H 247 9.132 8.605 0.527 1 1 1984 . 4 1 1 A 247 247 GLU HA H 247 4.368 4.677 -0.309 1 1 1989 . 4 1 1 A 247 247 GLU CB C 247 26.744 31.145 -4.401 1 1 1990 . 4 1 1 A 247 247 GLU N N 247 129.243 126.730 2.513 1 1 1991 . 4 1 1 A 248 248 THR H H 248 7.827 8.175 -0.348 1 1 1992 . 4 1 1 A 248 248 THR HA H 248 4.749 4.512 0.237 1 1 1997 . 4 1 1 A 248 248 THR CA C 248 56.859 60.136 -3.277 1 1 1998 . 4 1 1 A 248 248 THR CB C 248 69.171 69.757 -0.586 1 1 2000 . 4 1 1 A 248 248 THR N N 248 114.228 118.263 -4.035 1 1 2001 . 4 1 1 A 249 249 ALA H H 249 9.148 8.393 0.755 1 1 2002 . 4 1 1 A 249 249 ALA HA H 249 4.174 4.465 -0.291 1 1 2006 . 4 1 1 A 249 249 ALA CA C 249 51.970 52.124 -0.154 1 1 2007 . 4 1 1 A 249 249 ALA CB C 249 15.797 20.283 -4.486 1 1 2008 . 4 1 1 A 249 249 ALA N N 249 123.341 126.245 -2.904 1 1 2009 . 4 1 1 A 250 250 ASN H H 250 7.974 7.748 0.226 1 1 2010 . 4 1 1 A 250 250 ASN HA H 250 4.953 4.901 0.052 1 1 2015 . 4 1 1 A 250 250 ASN CA C 250 49.198 52.522 -3.324 1 1 2016 . 4 1 1 A 250 250 ASN CB C 250 35.976 39.362 -3.386 1 1 2017 . 4 1 1 A 250 250 ASN N N 250 113.358 116.428 -3.070 1 1 2019 . 4 1 1 A 251 251 GLY H H 251 7.510 7.581 -0.071 1 1 2020 . 4 1 1 A 251 251 GLY HA2 H 251 4.492 4.187 0.305 1 1 2021 . 4 1 1 A 251 251 GLY HA3 H 251 3.853 4.360 -0.507 1 1 2022 . 4 1 1 A 251 251 GLY CA C 251 41.435 45.809 -4.374 1 1 2023 . 4 1 1 A 251 251 GLY N N 251 108.692 106.949 1.743 1 1 2024 . 4 1 1 A 252 252 ILE H H 252 8.465 8.902 -0.437 1 1 2025 . 4 1 1 A 252 252 ILE HA H 252 4.521 4.547 -0.026 1 1 2035 . 4 1 1 A 252 252 ILE CB C 252 35.653 38.052 -2.399 1 1 2039 . 4 1 1 A 252 252 ILE N N 252 122.043 126.104 -4.061 1 1 2040 . 4 1 1 A 253 253 HIS H H 253 9.311 10.049 -0.738 1 1 2041 . 4 1 1 A 253 253 HIS HA H 253 4.861 5.369 -0.508 1 1 2046 . 4 1 1 A 253 253 HIS N N 253 126.617 126.383 0.234 1 1 2047 . 4 1 1 A 254 254 HIS H H 254 8.820 9.256 -0.436 1 1 2048 . 4 1 1 A 254 254 HIS HA H 254 5.305 5.661 -0.356 1 1 2051 . 4 1 1 A 254 254 HIS CA C 254 52.781 53.564 -0.783 1 1 2052 . 4 1 1 A 254 254 HIS N N 254 122.665 116.764 5.901 1 1 2053 . 4 1 1 A 255 255 ILE H H 255 9.047 9.077 -0.030 1 1 2054 . 4 1 1 A 255 255 ILE HA H 255 4.651 4.829 -0.178 1 1 2061 . 4 1 1 A 255 255 ILE N N 255 123.958 121.898 2.060 1 1 2062 . 4 1 1 A 256 256 GLY H H 256 9.339 9.629 -0.290 1 1 2063 . 4 1 1 A 256 256 GLY HA2 H 256 3.816 3.960 -0.144 1 1 2064 . 4 1 1 A 256 256 GLY HA3 H 256 2.267 4.001 -1.734 1 1 2065 . 4 1 1 A 256 256 GLY N N 256 115.022 115.297 -0.275 1 1 2066 . 4 1 1 A 257 257 LEU H H 257 7.890 9.128 -1.238 1 1 2067 . 4 1 1 A 257 257 LEU HA H 257 4.853 5.130 -0.277 1 1 2077 . 4 1 1 A 257 257 LEU N N 257 121.441 125.920 -4.479 1 1 2078 . 4 1 1 A 258 258 ALA H H 258 7.982 9.398 -1.416 1 1 2079 . 4 1 1 A 258 258 ALA HA H 258 4.668 5.040 -0.372 1 1 2083 . 4 1 1 A 258 258 ALA CA C 258 49.678 51.710 -2.032 1 1 2084 . 4 1 1 A 258 258 ALA CB C 258 19.561 20.592 -1.031 1 1 2085 . 4 1 1 A 258 258 ALA N N 258 123.234 122.835 0.399 1 1 2086 . 4 1 1 A 259 259 ALA H H 259 9.117 8.922 0.195 1 1 2087 . 4 1 1 A 259 259 ALA HA H 259 4.790 4.947 -0.157 1 1 2091 . 4 1 1 A 259 259 ALA N N 259 123.901 124.945 -1.044 1 1 2092 . 4 1 1 A 260 260 LYS H H 260 8.452 8.258 0.194 1 1 2093 . 4 1 1 A 260 260 LYS HA H 260 5.914 4.744 1.170 1 1 2098 . 4 1 1 A 260 260 LYS CA C 260 51.818 54.368 -2.550 1 1 2099 . 4 1 1 A 260 260 LYS N N 260 116.464 116.431 0.033 1 1 1 . 5 1 1 A 9 9 SER H H 9 8.293 7.901 0.392 1 1 2 . 5 1 1 A 9 9 SER HA H 9 4.432 4.818 -0.386 1 1 3 . 5 1 1 A 9 9 SER N N 9 116.407 116.276 0.131 1 1 4 . 5 1 1 A 10 10 GLY H H 10 8.472 8.652 -0.180 1 1 5 . 5 1 1 A 10 10 GLY N N 10 111.611 111.105 0.506 1 1 6 . 5 1 1 A 14 14 VAL H H 14 8.009 8.206 -0.197 1 1 7 . 5 1 1 A 14 14 VAL HA H 14 4.128 4.168 -0.040 1 1 15 . 5 1 1 A 14 14 VAL CA C 14 59.473 61.977 -2.504 1 1 16 . 5 1 1 A 14 14 VAL CB C 14 30.127 32.534 -2.407 1 1 17 . 5 1 1 A 14 14 VAL N N 14 119.846 120.090 -0.244 1 1 18 . 5 1 1 A 15 15 THR H H 15 8.152 8.278 -0.126 1 1 19 . 5 1 1 A 15 15 THR HA H 15 4.346 4.647 -0.301 1 1 24 . 5 1 1 A 15 15 THR N N 15 118.509 118.207 0.302 1 1 25 . 5 1 1 A 16 16 ALA H H 16 8.207 8.667 -0.460 1 1 26 . 5 1 1 A 16 16 ALA HA H 16 4.319 4.132 0.187 1 1 30 . 5 1 1 A 16 16 ALA CA C 16 49.835 53.527 -3.692 1 1 31 . 5 1 1 A 16 16 ALA CB C 16 16.714 18.470 -1.756 1 1 32 . 5 1 1 A 16 16 ALA N N 16 126.935 126.875 0.060 1 1 33 . 5 1 1 A 17 17 ASP H H 17 8.269 7.983 0.286 1 1 34 . 5 1 1 A 17 17 ASP HA H 17 4.581 4.925 -0.344 1 1 37 . 5 1 1 A 17 17 ASP CA C 17 51.643 53.006 -1.363 1 1 38 . 5 1 1 A 17 17 ASP CB C 17 38.257 41.667 -3.410 1 1 39 . 5 1 1 A 17 17 ASP N N 17 120.379 119.290 1.089 1 1 40 . 5 1 1 A 18 18 ILE H H 18 7.979 7.816 0.163 1 1 41 . 5 1 1 A 18 18 ILE HA H 18 4.178 4.149 0.029 1 1 48 . 5 1 1 A 18 18 ILE CA C 18 58.737 63.173 -4.436 1 1 49 . 5 1 1 A 18 18 ILE CB C 18 36.077 38.580 -2.503 1 1 53 . 5 1 1 A 18 18 ILE N N 18 121.171 121.820 -0.649 1 1 54 . 5 1 1 A 19 19 GLY H H 19 8.410 8.042 0.368 1 1 55 . 5 1 1 A 19 19 GLY HA2 H 19 4.023 3.752 0.271 1 1 56 . 5 1 1 A 19 19 GLY HA3 H 19 4.023 3.760 0.263 1 1 57 . 5 1 1 A 19 19 GLY N N 19 112.246 108.693 3.553 1 1 58 . 5 1 1 A 20 20 THR H H 20 8.005 8.086 -0.081 1 1 59 . 5 1 1 A 20 20 THR HA H 20 4.463 4.150 0.313 1 1 64 . 5 1 1 A 20 20 THR CB C 20 66.723 68.585 -1.862 1 1 66 . 5 1 1 A 20 20 THR N N 20 112.239 116.003 -3.764 1 1 67 . 5 1 1 A 21 21 GLY H H 21 8.500 8.548 -0.048 1 1 68 . 5 1 1 A 21 21 GLY HA2 H 21 4.099 3.770 0.329 1 1 69 . 5 1 1 A 21 21 GLY HA3 H 21 3.872 3.772 0.100 1 1 70 . 5 1 1 A 21 21 GLY N N 21 111.048 112.742 -1.694 1 1 71 . 5 1 1 A 22 22 LEU H H 22 7.427 7.739 -0.312 1 1 72 . 5 1 1 A 22 22 LEU HA H 22 3.884 3.994 -0.110 1 1 84 . 5 1 1 A 22 22 LEU N N 22 118.837 120.350 -1.513 1 1 85 . 5 1 1 A 23 23 ALA H H 23 7.896 7.737 0.159 1 1 86 . 5 1 1 A 23 23 ALA HA H 23 4.023 4.114 -0.091 1 1 90 . 5 1 1 A 23 23 ALA CA C 23 52.584 54.145 -1.561 1 1 91 . 5 1 1 A 23 23 ALA CB C 23 15.470 18.399 -2.929 1 1 92 . 5 1 1 A 23 23 ALA N N 23 119.194 121.413 -2.219 1 1 93 . 5 1 1 A 24 24 ASP H H 24 8.265 8.250 0.015 1 1 94 . 5 1 1 A 24 24 ASP HA H 24 4.337 4.592 -0.255 1 1 97 . 5 1 1 A 24 24 ASP CB C 24 37.029 41.241 -4.212 1 1 98 . 5 1 1 A 24 24 ASP N N 24 119.035 117.127 1.908 1 1 99 . 5 1 1 A 25 25 ALA H H 25 8.211 8.323 -0.112 1 1 100 . 5 1 1 A 25 25 ALA HA H 25 4.064 4.717 -0.653 1 1 104 . 5 1 1 A 25 25 ALA CA C 25 53.278 53.867 -0.589 1 1 105 . 5 1 1 A 25 25 ALA CB C 25 15.760 18.238 -2.478 1 1 106 . 5 1 1 A 25 25 ALA N N 25 122.434 122.090 0.344 1 1 107 . 5 1 1 A 26 26 LEU H H 26 7.334 7.374 -0.040 1 1 108 . 5 1 1 A 26 26 LEU HA H 26 4.351 4.269 0.082 1 1 117 . 5 1 1 A 26 26 LEU N N 26 114.238 115.179 -0.941 1 1 118 . 5 1 1 A 27 27 THR H H 27 7.708 7.576 0.132 1 1 119 . 5 1 1 A 27 27 THR HA H 27 4.492 4.448 0.044 1 1 124 . 5 1 1 A 27 27 THR CA C 27 59.438 62.234 -2.796 1 1 125 . 5 1 1 A 27 27 THR CB C 27 68.796 69.549 -0.753 1 1 127 . 5 1 1 A 27 27 THR N N 27 106.430 109.999 -3.569 1 1 128 . 5 1 1 A 28 28 ALA H H 28 8.906 7.524 1.382 1 1 129 . 5 1 1 A 28 28 ALA HA H 28 4.812 4.648 0.164 1 1 133 . 5 1 1 A 28 28 ALA CB C 28 16.724 19.617 -2.893 1 1 134 . 5 1 1 A 28 28 ALA N N 28 128.420 124.426 3.994 1 1 135 . 5 1 1 A 29 29 PRO CA C 29 59.166 62.270 -3.104 1 1 136 . 5 1 1 A 29 29 PRO CB C 29 29.865 32.631 -2.766 1 1 139 . 5 1 1 A 30 30 LEU H H 30 8.204 8.324 -0.120 1 1 140 . 5 1 1 A 30 30 LEU HA H 30 4.052 4.218 -0.166 1 1 150 . 5 1 1 A 30 30 LEU N N 30 121.970 123.169 -1.199 1 1 151 . 5 1 1 A 31 31 ASP H H 31 8.720 8.202 0.518 1 1 152 . 5 1 1 A 31 31 ASP HA H 31 4.772 5.005 -0.233 1 1 155 . 5 1 1 A 31 31 ASP CA C 31 50.115 52.957 -2.842 1 1 156 . 5 1 1 A 31 31 ASP N N 31 125.105 124.997 0.108 1 1 157 . 5 1 1 A 32 32 HIS CA C 32 55.083 54.563 0.520 1 1 158 . 5 1 1 A 32 32 HIS CB C 32 25.707 30.273 -4.566 1 1 159 . 5 1 1 A 33 33 LYS H H 33 8.589 7.681 0.908 1 1 160 . 5 1 1 A 33 33 LYS HA H 33 4.112 4.390 -0.278 1 1 167 . 5 1 1 A 33 33 LYS CB C 33 29.218 33.497 -4.279 1 1 169 . 5 1 1 A 33 33 LYS N N 33 118.920 122.755 -3.835 1 1 170 . 5 1 1 A 34 34 ASP H H 34 7.420 7.699 -0.279 1 1 171 . 5 1 1 A 34 34 ASP HA H 34 4.368 4.565 -0.197 1 1 174 . 5 1 1 A 34 34 ASP N N 34 120.940 120.922 0.018 1 1 175 . 5 1 1 A 35 35 LYS H H 35 8.266 8.430 -0.164 1 1 176 . 5 1 1 A 35 35 LYS HA H 35 4.169 4.455 -0.286 1 1 183 . 5 1 1 A 35 35 LYS N N 35 121.280 119.872 1.408 1 1 184 . 5 1 1 A 36 36 GLY H H 36 8.716 7.789 0.927 1 1 185 . 5 1 1 A 36 36 GLY HA2 H 36 3.822 4.010 -0.188 1 1 186 . 5 1 1 A 36 36 GLY HA3 H 36 3.618 4.011 -0.393 1 1 187 . 5 1 1 A 36 36 GLY N N 36 111.002 108.749 2.253 1 1 188 . 5 1 1 A 37 37 LEU H H 37 8.032 8.397 -0.365 1 1 189 . 5 1 1 A 37 37 LEU HA H 37 4.406 4.076 0.330 1 1 198 . 5 1 1 A 37 37 LEU N N 37 127.683 123.466 4.217 1 1 199 . 5 1 1 A 38 38 LYS H H 38 9.190 8.858 0.332 1 1 200 . 5 1 1 A 38 38 LYS HA H 38 3.925 4.104 -0.179 1 1 205 . 5 1 1 A 38 38 LYS N N 38 132.634 126.241 6.393 1 1 206 . 5 1 1 A 39 39 SER H H 39 7.161 7.692 -0.531 1 1 207 . 5 1 1 A 39 39 SER HA H 39 5.097 4.660 0.437 1 1 210 . 5 1 1 A 39 39 SER CA C 39 54.451 57.646 -3.195 1 1 211 . 5 1 1 A 39 39 SER N N 39 110.262 109.235 1.027 1 1 212 . 5 1 1 A 40 40 LEU H H 40 8.142 9.231 -1.089 1 1 213 . 5 1 1 A 40 40 LEU HA H 40 4.481 5.010 -0.529 1 1 223 . 5 1 1 A 40 40 LEU N N 40 122.761 120.775 1.986 1 1 224 . 5 1 1 A 41 41 THR H H 41 8.641 8.907 -0.266 1 1 225 . 5 1 1 A 41 41 THR HA H 41 4.141 4.843 -0.702 1 1 230 . 5 1 1 A 41 41 THR CA C 41 60.301 61.553 -1.252 1 1 231 . 5 1 1 A 41 41 THR CB C 41 65.862 70.447 -4.585 1 1 233 . 5 1 1 A 41 41 THR N N 41 124.142 120.419 3.723 1 1 234 . 5 1 1 A 42 42 LEU H H 42 8.586 8.954 -0.368 1 1 235 . 5 1 1 A 42 42 LEU HA H 42 4.337 4.372 -0.035 1 1 247 . 5 1 1 A 42 42 LEU N N 42 128.603 126.672 1.931 1 1 248 . 5 1 1 A 43 43 GLU H H 43 8.644 8.712 -0.068 1 1 249 . 5 1 1 A 43 43 GLU HA H 43 4.663 3.941 0.722 1 1 253 . 5 1 1 A 43 43 GLU N N 43 124.180 126.830 -2.650 1 1 254 . 5 1 1 A 44 44 ASP H H 44 10.243 7.841 2.402 1 1 255 . 5 1 1 A 44 44 ASP HA H 44 4.518 4.931 -0.413 1 1 258 . 5 1 1 A 44 44 ASP CA C 44 52.879 52.707 0.172 1 1 259 . 5 1 1 A 44 44 ASP CB C 44 37.711 40.978 -3.267 1 1 260 . 5 1 1 A 44 44 ASP N N 44 124.177 116.884 7.293 1 1 261 . 5 1 1 A 45 45 SER H H 45 8.546 7.965 0.581 1 1 262 . 5 1 1 A 45 45 SER HA H 45 3.850 4.097 -0.247 1 1 265 . 5 1 1 A 45 45 SER CA C 45 59.588 61.619 -2.031 1 1 266 . 5 1 1 A 45 45 SER CB C 45 61.660 63.129 -1.469 1 1 267 . 5 1 1 A 45 45 SER N N 45 116.191 115.720 0.471 1 1 268 . 5 1 1 A 46 46 ILE H H 46 6.902 7.715 -0.813 1 1 269 . 5 1 1 A 46 46 ILE HA H 46 3.874 4.732 -0.858 1 1 279 . 5 1 1 A 46 46 ILE CA C 46 57.605 59.977 -2.372 1 1 280 . 5 1 1 A 46 46 ILE CB C 46 36.694 40.035 -3.341 1 1 283 . 5 1 1 A 46 46 ILE N N 46 116.189 118.325 -2.136 1 1 284 . 5 1 1 A 47 47 SER H H 47 7.804 8.558 -0.754 1 1 285 . 5 1 1 A 47 47 SER HA H 47 4.342 4.818 -0.476 1 1 288 . 5 1 1 A 47 47 SER CA C 47 55.995 57.229 -1.234 1 1 289 . 5 1 1 A 47 47 SER N N 47 118.738 118.258 0.480 1 1 290 . 5 1 1 A 48 48 GLN H H 48 8.522 8.966 -0.444 1 1 291 . 5 1 1 A 48 48 GLN HA H 48 3.939 4.127 -0.188 1 1 296 . 5 1 1 A 48 48 GLN CA C 48 55.111 57.990 -2.879 1 1 298 . 5 1 1 A 48 48 GLN N N 48 119.475 121.912 -2.437 1 1 299 . 5 1 1 A 49 49 ASN H H 49 8.437 8.218 0.219 1 1 300 . 5 1 1 A 49 49 ASN HA H 49 4.693 4.697 -0.004 1 1 305 . 5 1 1 A 49 49 ASN CA C 49 50.839 52.142 -1.303 1 1 306 . 5 1 1 A 49 49 ASN CB C 49 35.767 37.758 -1.991 1 1 307 . 5 1 1 A 49 49 ASN N N 49 117.233 115.761 1.472 1 1 309 . 5 1 1 A 50 50 GLY H H 50 7.952 7.933 0.019 1 1 310 . 5 1 1 A 50 50 GLY HA2 H 50 4.518 4.191 0.327 1 1 311 . 5 1 1 A 50 50 GLY HA3 H 50 4.054 4.196 -0.142 1 1 312 . 5 1 1 A 50 50 GLY CA C 50 41.883 45.450 -3.567 1 1 313 . 5 1 1 A 50 50 GLY N N 50 108.751 107.138 1.613 1 1 314 . 5 1 1 A 51 51 THR H H 51 8.548 8.452 0.096 1 1 315 . 5 1 1 A 51 51 THR HA H 51 5.012 5.375 -0.363 1 1 320 . 5 1 1 A 51 51 THR CA C 51 57.026 60.236 -3.210 1 1 321 . 5 1 1 A 51 51 THR CB C 51 69.887 70.700 -0.813 1 1 323 . 5 1 1 A 51 51 THR N N 51 108.710 115.643 -6.933 1 1 324 . 5 1 1 A 52 52 LEU H H 52 9.110 8.874 0.236 1 1 325 . 5 1 1 A 52 52 LEU HA H 52 5.183 5.498 -0.315 1 1 333 . 5 1 1 A 52 52 LEU CA C 52 50.822 53.891 -3.069 1 1 335 . 5 1 1 A 52 52 LEU N N 52 124.606 122.562 2.044 1 1 336 . 5 1 1 A 53 53 THR H H 53 9.312 8.610 0.702 1 1 337 . 5 1 1 A 53 53 THR HA H 53 5.288 5.239 0.049 1 1 342 . 5 1 1 A 53 53 THR CA C 53 59.535 61.258 -1.723 1 1 343 . 5 1 1 A 53 53 THR CB C 53 66.838 71.816 -4.978 1 1 345 . 5 1 1 A 53 53 THR N N 53 125.445 115.665 9.780 1 1 346 . 5 1 1 A 54 54 LEU H H 54 8.992 8.614 0.378 1 1 347 . 5 1 1 A 54 54 LEU HA H 54 5.563 5.557 0.006 1 1 357 . 5 1 1 A 54 54 LEU N N 54 128.814 120.072 8.742 1 1 358 . 5 1 1 A 55 55 SER H H 55 9.017 9.220 -0.203 1 1 359 . 5 1 1 A 55 55 SER HA H 55 5.476 5.273 0.203 1 1 362 . 5 1 1 A 55 55 SER CA C 55 53.944 56.186 -2.242 1 1 363 . 5 1 1 A 55 55 SER CB C 55 63.384 65.885 -2.501 1 1 364 . 5 1 1 A 55 55 SER N N 55 112.964 117.856 -4.892 1 1 365 . 5 1 1 A 56 56 ALA H H 56 8.324 10.147 -1.823 1 1 366 . 5 1 1 A 56 56 ALA HA H 56 4.605 4.758 -0.153 1 1 370 . 5 1 1 A 56 56 ALA CA C 56 50.743 49.910 0.833 1 1 371 . 5 1 1 A 56 56 ALA CB C 56 21.372 21.063 0.309 1 1 372 . 5 1 1 A 56 56 ALA N N 56 123.555 126.771 -3.216 1 1 373 . 5 1 1 A 57 57 GLN H H 57 9.080 8.563 0.517 1 1 374 . 5 1 1 A 57 57 GLN HA H 57 3.884 4.488 -0.604 1 1 381 . 5 1 1 A 57 57 GLN CA C 57 53.331 55.964 -2.633 1 1 382 . 5 1 1 A 57 57 GLN CB C 57 24.659 27.513 -2.854 1 1 384 . 5 1 1 A 57 57 GLN N N 57 116.815 114.933 1.882 1 1 386 . 5 1 1 A 58 58 GLY H H 58 8.527 7.977 0.550 1 1 387 . 5 1 1 A 58 58 GLY HA2 H 58 4.168 4.014 0.154 1 1 388 . 5 1 1 A 58 58 GLY HA3 H 58 3.608 4.017 -0.409 1 1 389 . 5 1 1 A 58 58 GLY CA C 58 42.856 45.570 -2.714 1 1 390 . 5 1 1 A 58 58 GLY N N 58 105.983 107.370 -1.387 1 1 391 . 5 1 1 A 59 59 ALA H H 59 8.203 7.689 0.514 1 1 392 . 5 1 1 A 59 59 ALA HA H 59 4.811 4.610 0.201 1 1 396 . 5 1 1 A 59 59 ALA CA C 59 47.662 51.466 -3.804 1 1 397 . 5 1 1 A 59 59 ALA CB C 59 20.147 22.786 -2.639 1 1 398 . 5 1 1 A 59 59 ALA N N 59 125.153 121.292 3.861 1 1 399 . 5 1 1 A 60 60 GLU H H 60 8.154 9.039 -0.885 1 1 400 . 5 1 1 A 60 60 GLU HA H 60 5.508 5.302 0.206 1 1 404 . 5 1 1 A 60 60 GLU CA C 60 52.179 54.421 -2.242 1 1 405 . 5 1 1 A 60 60 GLU CB C 60 30.203 34.010 -3.807 1 1 406 . 5 1 1 A 60 60 GLU N N 60 117.318 116.293 1.025 1 1 407 . 5 1 1 A 61 61 LYS H H 61 8.821 9.241 -0.420 1 1 408 . 5 1 1 A 61 61 LYS HA H 61 4.311 4.888 -0.577 1 1 413 . 5 1 1 A 61 61 LYS N N 61 123.743 121.345 2.398 1 1 414 . 5 1 1 A 62 62 THR H H 62 8.149 8.613 -0.464 1 1 415 . 5 1 1 A 62 62 THR HA H 62 4.928 4.558 0.370 1 1 420 . 5 1 1 A 62 62 THR CA C 62 59.427 63.066 -3.639 1 1 421 . 5 1 1 A 62 62 THR CB C 62 66.932 68.968 -2.036 1 1 422 . 5 1 1 A 62 62 THR N N 62 122.829 121.333 1.496 1 1 423 . 5 1 1 A 63 63 TYR H H 63 9.466 9.211 0.255 1 1 424 . 5 1 1 A 63 63 TYR HA H 63 4.606 5.217 -0.611 1 1 431 . 5 1 1 A 63 63 TYR CA C 63 54.508 56.668 -2.160 1 1 432 . 5 1 1 A 63 63 TYR N N 63 127.472 129.050 -1.578 1 1 433 . 5 1 1 A 64 64 GLY H H 64 9.253 8.695 0.558 1 1 434 . 5 1 1 A 64 64 GLY HA2 H 64 4.670 4.248 0.422 1 1 435 . 5 1 1 A 64 64 GLY HA3 H 64 3.619 4.262 -0.643 1 1 436 . 5 1 1 A 64 64 GLY CA C 64 39.885 44.770 -4.885 1 1 437 . 5 1 1 A 64 64 GLY N N 64 110.182 111.883 -1.701 1 1 438 . 5 1 1 A 65 65 ASN H H 65 8.616 8.503 0.113 1 1 439 . 5 1 1 A 65 65 ASN HA H 65 4.109 4.392 -0.283 1 1 444 . 5 1 1 A 65 65 ASN CA C 65 53.691 54.869 -1.178 1 1 445 . 5 1 1 A 65 65 ASN N N 65 117.778 118.740 -0.962 1 1 447 . 5 1 1 A 66 66 GLY H H 66 9.053 8.944 0.109 1 1 448 . 5 1 1 A 66 66 GLY HA2 H 66 4.344 3.881 0.463 1 1 449 . 5 1 1 A 66 66 GLY HA3 H 66 3.359 3.886 -0.527 1 1 450 . 5 1 1 A 66 66 GLY CA C 66 42.431 44.892 -2.461 1 1 451 . 5 1 1 A 66 66 GLY N N 66 115.232 114.367 0.865 1 1 452 . 5 1 1 A 67 67 ASP H H 67 8.120 8.631 -0.511 1 1 453 . 5 1 1 A 67 67 ASP HA H 67 4.844 4.105 0.739 1 1 456 . 5 1 1 A 67 67 ASP N N 67 122.593 121.327 1.266 1 1 457 . 5 1 1 A 68 68 SER H H 68 8.500 8.153 0.347 1 1 458 . 5 1 1 A 68 68 SER HA H 68 5.088 5.010 0.078 1 1 461 . 5 1 1 A 68 68 SER CA C 68 54.858 56.473 -1.615 1 1 462 . 5 1 1 A 68 68 SER CB C 68 62.114 66.243 -4.129 1 1 463 . 5 1 1 A 68 68 SER N N 68 113.557 115.253 -1.696 1 1 464 . 5 1 1 A 69 69 LEU H H 69 8.989 9.597 -0.608 1 1 465 . 5 1 1 A 69 69 LEU HA H 69 4.570 5.776 -1.206 1 1 474 . 5 1 1 A 69 69 LEU N N 69 126.836 124.266 2.570 1 1 475 . 5 1 1 A 70 70 ASN H H 70 8.491 8.689 -0.198 1 1 476 . 5 1 1 A 70 70 ASN HA H 70 4.958 5.397 -0.439 1 1 479 . 5 1 1 A 70 70 ASN CB C 70 33.265 41.059 -7.794 1 1 480 . 5 1 1 A 70 70 ASN N N 70 126.343 125.290 1.053 1 1 481 . 5 1 1 A 71 71 THR H H 71 7.831 8.448 -0.617 1 1 482 . 5 1 1 A 71 71 THR HA H 71 3.759 4.761 -1.002 1 1 487 . 5 1 1 A 71 71 THR CA C 71 61.005 60.258 0.747 1 1 488 . 5 1 1 A 71 71 THR N N 71 114.742 115.976 -1.234 1 1 489 . 5 1 1 A 72 72 GLY H H 72 8.880 8.166 0.714 1 1 490 . 5 1 1 A 72 72 GLY HA2 H 72 3.907 3.948 -0.041 1 1 491 . 5 1 1 A 72 72 GLY HA3 H 72 3.907 3.950 -0.043 1 1 492 . 5 1 1 A 72 72 GLY N N 72 114.976 110.359 4.617 1 1 493 . 5 1 1 A 73 73 LYS H H 73 6.604 7.728 -1.124 1 1 494 . 5 1 1 A 73 73 LYS HA H 73 4.160 4.355 -0.195 1 1 501 . 5 1 1 A 73 73 LYS N N 73 113.898 118.712 -4.814 1 1 502 . 5 1 1 A 74 74 LEU H H 74 7.422 7.586 -0.164 1 1 503 . 5 1 1 A 74 74 LEU HA H 74 4.358 4.234 0.124 1 1 513 . 5 1 1 A 74 74 LEU N N 74 117.180 121.442 -4.262 1 1 514 . 5 1 1 A 75 75 LYS H H 75 8.617 8.608 0.009 1 1 515 . 5 1 1 A 75 75 LYS HA H 75 4.079 4.787 -0.708 1 1 518 . 5 1 1 A 75 75 LYS N N 75 121.119 120.808 0.311 1 1 519 . 5 1 1 A 76 76 ASN H H 76 8.154 8.595 -0.441 1 1 520 . 5 1 1 A 76 76 ASN HA H 76 3.935 5.538 -1.603 1 1 525 . 5 1 1 A 76 76 ASN CB C 76 35.772 38.895 -3.123 1 1 526 . 5 1 1 A 76 76 ASN N N 76 122.761 119.304 3.457 1 1 527 . 5 1 1 A 77 77 ASP H H 77 9.227 8.127 1.100 1 1 528 . 5 1 1 A 77 77 ASP HA H 77 3.787 5.013 -1.226 1 1 531 . 5 1 1 A 77 77 ASP CA C 77 52.584 53.134 -0.550 1 1 532 . 5 1 1 A 77 77 ASP N N 77 114.129 117.491 -3.362 1 1 533 . 5 1 1 A 78 78 LYS H H 78 6.579 7.951 -1.372 1 1 534 . 5 1 1 A 78 78 LYS HA H 78 4.572 4.811 -0.239 1 1 539 . 5 1 1 A 78 78 LYS CA C 78 51.072 54.925 -3.853 1 1 540 . 5 1 1 A 78 78 LYS CB C 78 33.783 37.096 -3.313 1 1 541 . 5 1 1 A 78 78 LYS N N 78 114.135 120.039 -5.904 1 1 542 . 5 1 1 A 79 79 VAL H H 79 8.729 8.323 0.406 1 1 543 . 5 1 1 A 79 79 VAL HA H 79 4.402 4.722 -0.320 1 1 551 . 5 1 1 A 79 79 VAL CA C 79 59.240 59.803 -0.563 1 1 553 . 5 1 1 A 79 79 VAL N N 79 123.191 120.667 2.524 1 1 554 . 5 1 1 A 80 80 SER H H 80 9.542 9.398 0.144 1 1 555 . 5 1 1 A 80 80 SER HA H 80 4.636 5.231 -0.595 1 1 558 . 5 1 1 A 80 80 SER CA C 80 55.978 57.677 -1.699 1 1 559 . 5 1 1 A 80 80 SER N N 80 127.445 121.441 6.004 1 1 560 . 5 1 1 A 81 81 ARG H H 81 8.093 8.881 -0.788 1 1 561 . 5 1 1 A 81 81 ARG HA H 81 5.210 5.627 -0.417 1 1 569 . 5 1 1 A 81 81 ARG N N 81 123.743 124.798 -1.055 1 1 571 . 5 1 1 A 82 82 PHE H H 82 9.312 7.982 1.330 1 1 572 . 5 1 1 A 82 82 PHE HA H 82 4.951 5.239 -0.288 1 1 577 . 5 1 1 A 82 82 PHE CA C 82 53.090 55.778 -2.688 1 1 578 . 5 1 1 A 82 82 PHE N N 82 119.529 117.155 2.374 1 1 579 . 5 1 1 A 83 83 ASP H H 83 9.122 8.320 0.802 1 1 580 . 5 1 1 A 83 83 ASP HA H 83 5.593 5.091 0.502 1 1 583 . 5 1 1 A 83 83 ASP N N 83 123.825 120.125 3.700 1 1 584 . 5 1 1 A 84 84 PHE H H 84 9.090 8.160 0.930 1 1 585 . 5 1 1 A 84 84 PHE HA H 84 6.410 6.072 0.338 1 1 592 . 5 1 1 A 84 84 PHE CA C 84 52.584 56.035 -3.451 1 1 593 . 5 1 1 A 84 84 PHE N N 84 118.862 117.870 0.992 1 1 594 . 5 1 1 A 85 85 ILE H H 85 8.441 8.802 -0.361 1 1 595 . 5 1 1 A 85 85 ILE HA H 85 4.662 4.986 -0.324 1 1 605 . 5 1 1 A 85 85 ILE CB C 85 39.939 40.868 -0.929 1 1 608 . 5 1 1 A 85 85 ILE N N 85 118.049 121.611 -3.562 1 1 609 . 5 1 1 A 86 86 ARG H H 86 8.983 8.831 0.152 1 1 610 . 5 1 1 A 86 86 ARG HA H 86 5.591 4.792 0.799 1 1 616 . 5 1 1 A 86 86 ARG N N 86 127.006 129.309 -2.303 1 1 618 . 5 1 1 A 87 87 GLN H H 87 8.643 9.039 -0.396 1 1 619 . 5 1 1 A 87 87 GLN HA H 87 5.630 5.119 0.511 1 1 626 . 5 1 1 A 87 87 GLN CA C 87 51.512 54.320 -2.808 1 1 627 . 5 1 1 A 87 87 GLN N N 87 124.142 122.778 1.364 1 1 629 . 5 1 1 A 88 88 ILE H H 88 8.617 8.820 -0.203 1 1 630 . 5 1 1 A 88 88 ILE HA H 88 4.690 4.939 -0.249 1 1 637 . 5 1 1 A 88 88 ILE CA C 88 56.995 60.751 -3.756 1 1 638 . 5 1 1 A 88 88 ILE CB C 88 39.927 40.298 -0.371 1 1 641 . 5 1 1 A 88 88 ILE N N 88 116.353 121.836 -5.483 1 1 642 . 5 1 1 A 89 89 GLU H H 89 8.298 9.012 -0.714 1 1 643 . 5 1 1 A 89 89 GLU HA H 89 5.100 5.855 -0.755 1 1 646 . 5 1 1 A 89 89 GLU CA C 89 52.204 54.825 -2.621 1 1 647 . 5 1 1 A 89 89 GLU CB C 89 27.325 33.285 -5.960 1 1 648 . 5 1 1 A 89 89 GLU N N 89 124.458 129.234 -4.776 1 1 649 . 5 1 1 A 90 90 VAL H H 90 8.957 8.770 0.187 1 1 650 . 5 1 1 A 90 90 VAL HA H 90 4.169 4.587 -0.418 1 1 658 . 5 1 1 A 90 90 VAL CA C 90 58.664 59.964 -1.300 1 1 659 . 5 1 1 A 90 90 VAL CB C 90 31.861 33.525 -1.664 1 1 660 . 5 1 1 A 90 90 VAL N N 90 127.580 126.399 1.181 1 1 661 . 5 1 1 A 91 91 ASP H H 91 9.369 8.764 0.605 1 1 662 . 5 1 1 A 91 91 ASP HA H 91 4.287 4.552 -0.265 1 1 665 . 5 1 1 A 91 91 ASP CA C 91 52.389 54.580 -2.191 1 1 666 . 5 1 1 A 91 91 ASP CB C 91 36.409 40.658 -4.249 1 1 667 . 5 1 1 A 91 91 ASP N N 91 129.411 124.227 5.184 1 1 668 . 5 1 1 A 92 92 GLY H H 92 8.552 7.443 1.109 1 1 669 . 5 1 1 A 92 92 GLY HA2 H 92 4.090 4.092 -0.002 1 1 670 . 5 1 1 A 92 92 GLY HA3 H 92 3.618 4.092 -0.474 1 1 671 . 5 1 1 A 92 92 GLY CA C 92 42.836 45.627 -2.791 1 1 672 . 5 1 1 A 92 92 GLY N N 92 103.862 106.244 -2.382 1 1 673 . 5 1 1 A 93 93 GLN H H 93 7.808 7.663 0.145 1 1 674 . 5 1 1 A 93 93 GLN HA H 93 4.578 4.830 -0.252 1 1 679 . 5 1 1 A 93 93 GLN CA C 93 50.918 54.387 -3.469 1 1 680 . 5 1 1 A 93 93 GLN CB C 93 28.602 30.976 -2.374 1 1 682 . 5 1 1 A 93 93 GLN N N 93 120.412 118.456 1.956 1 1 683 . 5 1 1 A 94 94 LEU H H 94 8.414 8.550 -0.136 1 1 684 . 5 1 1 A 94 94 LEU HA H 94 4.704 4.310 0.394 1 1 693 . 5 1 1 A 94 94 LEU CB C 94 39.873 42.547 -2.674 1 1 696 . 5 1 1 A 94 94 LEU N N 94 125.061 122.639 2.422 1 1 697 . 5 1 1 A 95 95 ILE H H 95 9.181 8.553 0.628 1 1 698 . 5 1 1 A 95 95 ILE HA H 95 4.371 4.529 -0.158 1 1 708 . 5 1 1 A 95 95 ILE CA C 95 63.319 60.525 2.794 1 1 709 . 5 1 1 A 95 95 ILE CB C 95 37.407 39.097 -1.690 1 1 711 . 5 1 1 A 95 95 ILE N N 95 127.724 121.930 5.794 1 1 712 . 5 1 1 A 96 96 THR H H 96 8.730 7.284 1.446 1 1 713 . 5 1 1 A 96 96 THR HA H 96 4.411 4.285 0.126 1 1 718 . 5 1 1 A 96 96 THR CA C 96 60.344 63.232 -2.888 1 1 719 . 5 1 1 A 96 96 THR CB C 96 59.719 69.878 -10.159 1 1 720 . 5 1 1 A 96 96 THR N N 96 124.240 118.356 5.884 1 1 721 . 5 1 1 A 97 97 LEU H H 97 8.790 8.777 0.013 1 1 722 . 5 1 1 A 97 97 LEU HA H 97 4.400 5.047 -0.647 1 1 732 . 5 1 1 A 97 97 LEU N N 97 126.147 125.328 0.819 1 1 733 . 5 1 1 A 98 98 GLU H H 98 7.596 8.602 -1.006 1 1 734 . 5 1 1 A 98 98 GLU HA H 98 5.102 4.952 0.150 1 1 739 . 5 1 1 A 98 98 GLU N N 98 116.937 122.855 -5.918 1 1 740 . 5 1 1 A 99 99 SER H H 99 8.906 8.754 0.152 1 1 741 . 5 1 1 A 99 99 SER HA H 99 4.504 5.447 -0.943 1 1 744 . 5 1 1 A 99 99 SER CA C 99 54.010 56.211 -2.201 1 1 745 . 5 1 1 A 99 99 SER CB C 99 63.876 66.511 -2.635 1 1 746 . 5 1 1 A 99 99 SER N N 99 117.823 116.932 0.891 1 1 747 . 5 1 1 A 100 100 GLY H H 100 7.250 8.090 -0.840 1 1 748 . 5 1 1 A 100 100 GLY HA2 H 100 4.872 4.002 0.870 1 1 749 . 5 1 1 A 100 100 GLY HA3 H 100 3.731 4.047 -0.316 1 1 750 . 5 1 1 A 100 100 GLY N N 100 109.436 109.851 -0.415 1 1 751 . 5 1 1 A 101 101 GLU H H 101 9.661 8.535 1.126 1 1 752 . 5 1 1 A 101 101 GLU HA H 101 5.643 4.608 1.035 1 1 757 . 5 1 1 A 101 101 GLU CA C 101 52.584 54.691 -2.107 1 1 758 . 5 1 1 A 101 101 GLU CB C 101 31.750 32.338 -0.588 1 1 759 . 5 1 1 A 101 101 GLU N N 101 126.793 119.571 7.222 1 1 760 . 5 1 1 A 102 102 PHE H H 102 10.441 8.452 1.989 1 1 761 . 5 1 1 A 102 102 PHE HA H 102 5.248 5.373 -0.125 1 1 768 . 5 1 1 A 102 102 PHE CA C 102 53.537 56.142 -2.605 1 1 769 . 5 1 1 A 102 102 PHE N N 102 131.837 121.187 10.650 1 1 770 . 5 1 1 A 103 103 GLN H H 103 9.135 10.027 -0.892 1 1 771 . 5 1 1 A 103 103 GLN HA H 103 5.205 4.968 0.237 1 1 776 . 5 1 1 A 103 103 GLN CA C 103 50.925 54.640 -3.715 1 1 777 . 5 1 1 A 103 103 GLN N N 103 127.720 126.196 1.524 1 1 778 . 5 1 1 A 104 104 VAL H H 104 8.937 9.179 -0.242 1 1 779 . 5 1 1 A 104 104 VAL HA H 104 4.780 5.067 -0.287 1 1 787 . 5 1 1 A 104 104 VAL CA C 104 57.086 61.592 -4.506 1 1 789 . 5 1 1 A 104 104 VAL N N 104 120.097 125.714 -5.617 1 1 790 . 5 1 1 A 105 105 TYR H H 105 9.108 9.733 -0.625 1 1 791 . 5 1 1 A 105 105 TYR HA H 105 4.834 4.987 -0.153 1 1 798 . 5 1 1 A 105 105 TYR CA C 105 54.486 58.837 -4.351 1 1 799 . 5 1 1 A 105 105 TYR N N 105 128.426 129.401 -0.975 1 1 800 . 5 1 1 A 106 106 LYS H H 106 5.945 9.458 -3.513 1 1 805 . 5 1 1 A 106 106 LYS N N 106 129.163 125.767 3.396 1 1 806 . 5 1 1 A 107 107 GLN H H 107 8.526 8.249 0.277 1 1 807 . 5 1 1 A 107 107 GLN HA H 107 5.160 5.145 0.015 1 1 812 . 5 1 1 A 107 107 GLN CA C 107 52.584 54.335 -1.751 1 1 813 . 5 1 1 A 107 107 GLN CB C 107 26.175 29.352 -3.177 1 1 814 . 5 1 1 A 107 107 GLN N N 107 125.978 123.060 2.918 1 1 815 . 5 1 1 A 108 108 SER H H 108 8.621 8.698 -0.077 1 1 816 . 5 1 1 A 108 108 SER HA H 108 4.403 5.033 -0.630 1 1 819 . 5 1 1 A 108 108 SER CA C 108 58.521 61.142 -2.621 1 1 820 . 5 1 1 A 108 108 SER CB C 108 60.737 63.133 -2.396 1 1 821 . 5 1 1 A 108 108 SER N N 108 117.542 113.775 3.767 1 1 822 . 5 1 1 A 109 109 HIS H H 109 10.381 8.228 2.153 1 1 823 . 5 1 1 A 109 109 HIS HA H 109 4.594 4.592 0.002 1 1 828 . 5 1 1 A 109 109 HIS CA C 109 51.743 57.330 -5.587 1 1 829 . 5 1 1 A 109 109 HIS CB C 109 27.174 31.523 -4.349 1 1 830 . 5 1 1 A 109 109 HIS N N 109 118.449 117.906 0.543 1 1 831 . 5 1 1 A 110 110 SER H H 110 7.366 7.768 -0.402 1 1 832 . 5 1 1 A 110 110 SER HA H 110 4.870 4.796 0.074 1 1 835 . 5 1 1 A 110 110 SER CB C 110 62.986 65.451 -2.465 1 1 836 . 5 1 1 A 110 110 SER N N 110 113.397 114.099 -0.702 1 1 837 . 5 1 1 A 111 111 ALA H H 111 8.541 8.642 -0.101 1 1 838 . 5 1 1 A 111 111 ALA HA H 111 4.826 4.904 -0.078 1 1 842 . 5 1 1 A 111 111 ALA CA C 111 49.015 51.541 -2.526 1 1 843 . 5 1 1 A 111 111 ALA CB C 111 20.256 22.729 -2.473 1 1 844 . 5 1 1 A 111 111 ALA N N 111 117.786 122.725 -4.939 1 1 845 . 5 1 1 A 112 112 LEU H H 112 8.529 8.888 -0.359 1 1 846 . 5 1 1 A 112 112 LEU HA H 112 5.680 5.189 0.491 1 1 855 . 5 1 1 A 112 112 LEU CA C 112 51.818 53.795 -1.977 1 1 856 . 5 1 1 A 112 112 LEU N N 112 116.345 119.134 -2.789 1 1 857 . 5 1 1 A 113 113 THR H H 113 8.758 9.048 -0.290 1 1 858 . 5 1 1 A 113 113 THR HA H 113 5.563 5.397 0.166 1 1 863 . 5 1 1 A 113 113 THR CA C 113 54.458 61.102 -6.644 1 1 864 . 5 1 1 A 113 113 THR CB C 113 68.586 72.763 -4.177 1 1 866 . 5 1 1 A 113 113 THR N N 113 110.469 118.400 -7.931 1 1 867 . 5 1 1 A 114 114 ALA H H 114 8.829 8.813 0.016 1 1 868 . 5 1 1 A 114 114 ALA HA H 114 4.466 5.147 -0.681 1 1 872 . 5 1 1 A 114 114 ALA CA C 114 48.886 51.964 -3.078 1 1 873 . 5 1 1 A 114 114 ALA CB C 114 21.583 21.879 -0.296 1 1 874 . 5 1 1 A 114 114 ALA N N 114 121.456 124.516 -3.060 1 1 875 . 5 1 1 A 115 115 LEU H H 115 8.407 9.650 -1.243 1 1 876 . 5 1 1 A 115 115 LEU HA H 115 4.814 4.511 0.303 1 1 886 . 5 1 1 A 115 115 LEU N N 115 119.223 123.683 -4.460 1 1 887 . 5 1 1 A 116 116 GLN H H 116 9.720 9.296 0.424 1 1 888 . 5 1 1 A 116 116 GLN HA H 116 5.312 4.912 0.400 1 1 893 . 5 1 1 A 116 116 GLN CA C 116 50.544 55.239 -4.695 1 1 894 . 5 1 1 A 116 116 GLN N N 116 127.827 123.743 4.084 1 1 895 . 5 1 1 A 117 117 THR H H 117 9.663 9.306 0.357 1 1 896 . 5 1 1 A 117 117 THR HA H 117 4.198 4.904 -0.706 1 1 901 . 5 1 1 A 117 117 THR CA C 117 64.037 60.986 3.051 1 1 902 . 5 1 1 A 117 117 THR CB C 117 66.868 71.704 -4.836 1 1 904 . 5 1 1 A 117 117 THR N N 117 128.929 116.877 12.052 1 1 905 . 5 1 1 A 118 118 GLU H H 118 9.486 8.916 0.570 1 1 906 . 5 1 1 A 118 118 GLU HA H 118 4.885 4.439 0.446 1 1 911 . 5 1 1 A 118 118 GLU N N 118 123.497 122.081 1.416 1 1 912 . 5 1 1 A 119 119 GLN H H 119 8.076 8.086 -0.010 1 1 913 . 5 1 1 A 119 119 GLN HA H 119 5.331 5.072 0.259 1 1 916 . 5 1 1 A 119 119 GLN CA C 119 51.858 54.005 -2.147 1 1 917 . 5 1 1 A 119 119 GLN N N 119 118.023 115.366 2.657 1 1 918 . 5 1 1 A 120 120 GLU H H 120 9.078 8.521 0.557 1 1 919 . 5 1 1 A 120 120 GLU HA H 120 5.071 5.080 -0.009 1 1 924 . 5 1 1 A 120 120 GLU N N 120 118.433 119.773 -1.340 1 1 925 . 5 1 1 A 121 121 GLN H H 121 7.711 8.975 -1.264 1 1 926 . 5 1 1 A 121 121 GLN HA H 121 4.430 5.174 -0.744 1 1 933 . 5 1 1 A 121 121 GLN CA C 121 53.996 54.502 -0.506 1 1 934 . 5 1 1 A 121 121 GLN CB C 121 27.158 33.131 -5.973 1 1 936 . 5 1 1 A 121 121 GLN N N 121 122.412 118.074 4.338 1 1 938 . 5 1 1 A 122 122 ASP H H 122 8.675 10.294 -1.619 1 1 939 . 5 1 1 A 122 122 ASP HA H 122 4.632 5.271 -0.639 1 1 942 . 5 1 1 A 122 122 ASP CA C 122 48.797 50.511 -1.714 1 1 943 . 5 1 1 A 122 122 ASP CB C 122 39.852 42.558 -2.706 1 1 944 . 5 1 1 A 122 122 ASP N N 122 128.625 122.025 6.600 1 1 945 . 5 1 1 A 123 123 PRO CA C 123 61.579 62.722 -1.143 1 1 946 . 5 1 1 A 123 123 PRO CB C 123 29.597 29.547 0.050 1 1 948 . 5 1 1 A 124 124 GLU H H 124 8.297 8.625 -0.328 1 1 949 . 5 1 1 A 124 124 GLU HA H 124 4.196 4.020 0.176 1 1 954 . 5 1 1 A 124 124 GLU CA C 124 53.025 57.574 -4.549 1 1 955 . 5 1 1 A 124 124 GLU CB C 124 27.927 30.642 -2.715 1 1 957 . 5 1 1 A 124 124 GLU N N 124 115.538 121.455 -5.917 1 1 958 . 5 1 1 A 125 125 HIS H H 125 7.419 7.278 0.141 1 1 959 . 5 1 1 A 125 125 HIS HA H 125 4.833 4.653 0.180 1 1 964 . 5 1 1 A 125 125 HIS CA C 125 51.886 56.164 -4.278 1 1 965 . 5 1 1 A 125 125 HIS CB C 125 26.387 30.885 -4.498 1 1 966 . 5 1 1 A 125 125 HIS N N 125 117.464 114.965 2.499 1 1 967 . 5 1 1 A 126 126 SER H H 126 8.441 8.620 -0.179 1 1 968 . 5 1 1 A 126 126 SER HA H 126 4.261 4.714 -0.453 1 1 971 . 5 1 1 A 126 126 SER CA C 126 57.988 57.198 0.790 1 1 972 . 5 1 1 A 126 126 SER N N 126 117.954 113.828 4.126 1 1 973 . 5 1 1 A 127 127 GLU H H 127 9.221 7.979 1.242 1 1 974 . 5 1 1 A 127 127 GLU HA H 127 4.366 4.447 -0.081 1 1 979 . 5 1 1 A 127 127 GLU CA C 127 53.707 56.123 -2.416 1 1 980 . 5 1 1 A 127 127 GLU CB C 127 25.492 30.471 -4.979 1 1 981 . 5 1 1 A 127 127 GLU N N 127 120.404 120.453 -0.049 1 1 982 . 5 1 1 A 128 128 LYS H H 128 8.262 8.109 0.153 1 1 983 . 5 1 1 A 128 128 LYS HA H 128 4.661 4.088 0.573 1 1 990 . 5 1 1 A 128 128 LYS CA C 128 52.264 57.507 -5.243 1 1 991 . 5 1 1 A 128 128 LYS CB C 128 32.404 31.302 1.102 1 1 994 . 5 1 1 A 128 128 LYS N N 128 122.166 116.979 5.187 1 1 995 . 5 1 1 A 129 129 MET H H 129 8.242 9.746 -1.504 1 1 996 . 5 1 1 A 129 129 MET HA H 129 5.012 5.185 -0.173 1 1 1001 . 5 1 1 A 129 129 MET CA C 129 50.958 54.029 -3.071 1 1 1003 . 5 1 1 A 129 129 MET N N 129 119.422 116.998 2.424 1 1 1004 . 5 1 1 A 130 130 VAL H H 130 9.200 9.782 -0.582 1 1 1005 . 5 1 1 A 130 130 VAL HA H 130 4.609 4.734 -0.125 1 1 1013 . 5 1 1 A 130 130 VAL CA C 130 56.296 60.196 -3.900 1 1 1014 . 5 1 1 A 130 130 VAL CB C 130 32.606 36.063 -3.457 1 1 1015 . 5 1 1 A 130 130 VAL N N 130 118.290 120.290 -2.000 1 1 1016 . 5 1 1 A 131 131 ALA H H 131 8.368 8.599 -0.231 1 1 1017 . 5 1 1 A 131 131 ALA HA H 131 4.654 5.060 -0.406 1 1 1021 . 5 1 1 A 131 131 ALA CA C 131 49.739 51.922 -2.183 1 1 1022 . 5 1 1 A 131 131 ALA CB C 131 15.351 20.788 -5.437 1 1 1023 . 5 1 1 A 131 131 ALA N N 131 126.734 125.099 1.635 1 1 1024 . 5 1 1 A 132 132 LYS H H 132 7.732 8.019 -0.287 1 1 1025 . 5 1 1 A 132 132 LYS HA H 132 4.171 4.805 -0.634 1 1 1028 . 5 1 1 A 132 132 LYS N N 132 127.309 121.604 5.705 1 1 1029 . 5 1 1 A 133 133 ARG H H 133 8.193 8.589 -0.396 1 1 1030 . 5 1 1 A 133 133 ARG HA H 133 5.073 4.625 0.448 1 1 1038 . 5 1 1 A 133 133 ARG N N 133 122.190 123.279 -1.089 1 1 1040 . 5 1 1 A 134 134 ARG H H 134 7.539 8.722 -1.183 1 1 1041 . 5 1 1 A 134 134 ARG HA H 134 4.667 4.726 -0.059 1 1 1049 . 5 1 1 A 134 134 ARG CA C 134 52.584 54.277 -1.693 1 1 1050 . 5 1 1 A 134 134 ARG CB C 134 31.325 33.759 -2.434 1 1 1052 . 5 1 1 A 134 134 ARG N N 134 121.632 125.146 -3.514 1 1 1054 . 5 1 1 A 135 135 PHE H H 135 8.816 7.874 0.942 1 1 1055 . 5 1 1 A 135 135 PHE HA H 135 5.680 5.225 0.455 1 1 1062 . 5 1 1 A 135 135 PHE N N 135 125.107 119.755 5.352 1 1 1063 . 5 1 1 A 136 136 ARG H H 136 7.741 9.685 -1.944 1 1 1064 . 5 1 1 A 136 136 ARG HA H 136 4.402 4.685 -0.283 1 1 1068 . 5 1 1 A 136 136 ARG N N 136 125.640 124.799 0.841 1 1 1070 . 5 1 1 A 137 137 ILE H H 137 8.556 8.856 -0.300 1 1 1071 . 5 1 1 A 137 137 ILE HA H 137 3.912 4.538 -0.626 1 1 1076 . 5 1 1 A 137 137 ILE CA C 137 55.676 61.312 -5.636 1 1 1079 . 5 1 1 A 137 137 ILE N N 137 122.891 127.955 -5.064 1 1 1080 . 5 1 1 A 138 138 GLY H H 138 8.676 9.377 -0.701 1 1 1081 . 5 1 1 A 138 138 GLY HA2 H 138 3.740 4.165 -0.425 1 1 1082 . 5 1 1 A 138 138 GLY HA3 H 138 2.982 4.178 -1.196 1 1 1083 . 5 1 1 A 138 138 GLY CA C 138 41.908 46.057 -4.149 1 1 1084 . 5 1 1 A 138 138 GLY N N 138 117.058 115.667 1.391 1 1 1085 . 5 1 1 A 139 139 ASP H H 139 7.858 7.675 0.183 1 1 1086 . 5 1 1 A 139 139 ASP HA H 139 4.753 4.626 0.127 1 1 1089 . 5 1 1 A 139 139 ASP CA C 139 52.584 55.120 -2.536 1 1 1090 . 5 1 1 A 139 139 ASP CB C 139 43.062 41.310 1.752 1 1 1091 . 5 1 1 A 139 139 ASP N N 139 124.516 120.681 3.835 1 1 1092 . 5 1 1 A 140 140 ILE H H 140 8.354 8.937 -0.583 1 1 1093 . 5 1 1 A 140 140 ILE HA H 140 4.473 4.567 -0.094 1 1 1103 . 5 1 1 A 140 140 ILE CB C 140 36.173 38.452 -2.279 1 1 1105 . 5 1 1 A 140 140 ILE N N 140 120.679 125.420 -4.741 1 1 1106 . 5 1 1 A 141 141 ALA H H 141 8.708 8.125 0.583 1 1 1107 . 5 1 1 A 141 141 ALA HA H 141 4.862 4.790 0.072 1 1 1111 . 5 1 1 A 141 141 ALA CA C 141 47.968 50.001 -2.033 1 1 1112 . 5 1 1 A 141 141 ALA CB C 141 21.733 19.847 1.886 1 1 1113 . 5 1 1 A 141 141 ALA N N 141 130.144 130.166 -0.022 1 1 1114 . 5 1 1 A 142 142 GLY H H 142 7.888 8.839 -0.951 1 1 1115 . 5 1 1 A 142 142 GLY HA2 H 142 4.519 3.942 0.577 1 1 1116 . 5 1 1 A 142 142 GLY HA3 H 142 3.634 3.942 -0.308 1 1 1117 . 5 1 1 A 142 142 GLY N N 142 102.272 109.423 -7.151 1 1 1118 . 5 1 1 A 143 143 GLU H H 143 8.068 9.358 -1.290 1 1 1119 . 5 1 1 A 143 143 GLU HA H 143 4.577 4.280 0.297 1 1 1124 . 5 1 1 A 143 143 GLU N N 143 120.569 120.230 0.339 1 1 1125 . 5 1 1 A 144 144 HIS H H 144 8.478 8.358 0.120 1 1 1126 . 5 1 1 A 144 144 HIS HA H 144 4.968 4.645 0.323 1 1 1131 . 5 1 1 A 144 144 HIS N N 144 124.275 118.187 6.088 1 1 1132 . 5 1 1 A 145 145 THR H H 145 9.031 7.769 1.262 1 1 1133 . 5 1 1 A 145 145 THR HA H 145 4.025 4.941 -0.916 1 1 1138 . 5 1 1 A 145 145 THR CA C 145 61.247 60.430 0.817 1 1 1139 . 5 1 1 A 145 145 THR CB C 145 65.181 70.771 -5.590 1 1 1141 . 5 1 1 A 145 145 THR N N 145 125.828 115.700 10.128 1 1 1142 . 5 1 1 A 146 146 SER H H 146 9.077 9.176 -0.099 1 1 1143 . 5 1 1 A 146 146 SER HA H 146 4.684 4.666 0.018 1 1 1145 . 5 1 1 A 146 146 SER CA C 146 56.067 58.847 -2.780 1 1 1146 . 5 1 1 A 146 146 SER CB C 146 60.510 63.545 -3.035 1 1 1147 . 5 1 1 A 146 146 SER N N 146 124.154 121.985 2.169 1 1 1148 . 5 1 1 A 147 147 PHE H H 147 9.049 9.087 -0.038 1 1 1149 . 5 1 1 A 147 147 PHE HA H 147 4.022 4.124 -0.102 1 1 1154 . 5 1 1 A 147 147 PHE N N 147 127.670 125.525 2.145 1 1 1155 . 5 1 1 A 148 148 ASP H H 148 8.504 8.156 0.348 1 1 1156 . 5 1 1 A 148 148 ASP HA H 148 4.422 4.591 -0.169 1 1 1158 . 5 1 1 A 148 148 ASP CA C 148 52.584 56.857 -4.273 1 1 1159 . 5 1 1 A 148 148 ASP CB C 148 37.800 40.946 -3.146 1 1 1160 . 5 1 1 A 148 148 ASP N N 148 114.377 120.152 -5.775 1 1 1161 . 5 1 1 A 149 149 LYS H H 149 7.380 8.997 -1.617 1 1 1162 . 5 1 1 A 149 149 LYS HA H 149 4.487 4.130 0.357 1 1 1171 . 5 1 1 A 149 149 LYS CA C 149 51.735 58.905 -7.170 1 1 1172 . 5 1 1 A 149 149 LYS CB C 149 30.162 32.937 -2.775 1 1 1175 . 5 1 1 A 149 149 LYS N N 149 119.137 119.325 -0.188 1 1 1176 . 5 1 1 A 150 150 LEU H H 150 6.886 7.962 -1.076 1 1 1177 . 5 1 1 A 150 150 LEU HA H 150 3.996 4.163 -0.167 1 1 1186 . 5 1 1 A 150 150 LEU CA C 150 50.502 57.678 -7.176 1 1 1187 . 5 1 1 A 150 150 LEU N N 150 120.614 120.064 0.550 1 1 1188 . 5 1 1 A 151 151 PRO CB C 151 29.567 29.168 0.399 1 1 1190 . 5 1 1 A 152 152 LYS H H 152 8.076 8.888 -0.812 1 1 1191 . 5 1 1 A 152 152 LYS HA H 152 4.346 4.394 -0.048 1 1 1195 . 5 1 1 A 152 152 LYS CA C 152 53.182 57.778 -4.596 1 1 1196 . 5 1 1 A 152 152 LYS CB C 152 31.487 32.726 -1.239 1 1 1198 . 5 1 1 A 152 152 LYS N N 152 118.133 120.892 -2.759 1 1 1199 . 5 1 1 A 153 153 ASP H H 153 7.982 8.075 -0.093 1 1 1200 . 5 1 1 A 153 153 ASP HA H 153 4.402 4.935 -0.533 1 1 1203 . 5 1 1 A 153 153 ASP CA C 153 52.584 53.155 -0.571 1 1 1204 . 5 1 1 A 153 153 ASP CB C 153 37.762 40.887 -3.125 1 1 1205 . 5 1 1 A 153 153 ASP N N 153 115.735 114.918 0.817 1 1 1206 . 5 1 1 A 154 154 VAL H H 154 6.987 7.586 -0.599 1 1 1207 . 5 1 1 A 154 154 VAL HA H 154 4.406 4.196 0.210 1 1 1215 . 5 1 1 A 154 154 VAL CA C 154 58.408 60.884 -2.476 1 1 1216 . 5 1 1 A 154 154 VAL CB C 154 32.617 33.950 -1.333 1 1 1217 . 5 1 1 A 154 154 VAL N N 154 116.266 119.458 -3.192 1 1 1218 . 5 1 1 A 155 155 MET H H 155 8.444 8.409 0.035 1 1 1219 . 5 1 1 A 155 155 MET HA H 155 5.416 5.063 0.353 1 1 1224 . 5 1 1 A 155 155 MET CA C 155 51.183 53.993 -2.810 1 1 1226 . 5 1 1 A 155 155 MET N N 155 124.950 126.432 -1.482 1 1 1227 . 5 1 1 A 156 156 ALA H H 156 9.226 8.564 0.662 1 1 1228 . 5 1 1 A 156 156 ALA HA H 156 4.693 5.116 -0.423 1 1 1232 . 5 1 1 A 156 156 ALA CA C 156 48.379 50.714 -2.335 1 1 1233 . 5 1 1 A 156 156 ALA CB C 156 21.051 20.855 0.196 1 1 1234 . 5 1 1 A 156 156 ALA N N 156 129.938 126.395 3.543 1 1 1235 . 5 1 1 A 157 157 THR H H 157 8.554 8.567 -0.013 1 1 1236 . 5 1 1 A 157 157 THR HA H 157 4.839 4.552 0.287 1 1 1241 . 5 1 1 A 157 157 THR CA C 157 59.555 62.605 -3.050 1 1 1242 . 5 1 1 A 157 157 THR CB C 157 68.575 69.957 -1.382 1 1 1244 . 5 1 1 A 157 157 THR N N 157 118.815 117.011 1.804 1 1 1245 . 5 1 1 A 158 158 TYR H H 158 9.974 9.131 0.843 1 1 1246 . 5 1 1 A 158 158 TYR HA H 158 4.435 5.053 -0.618 1 1 1253 . 5 1 1 A 158 158 TYR N N 158 126.958 122.924 4.034 1 1 1254 . 5 1 1 A 159 159 ARG H H 159 8.909 8.522 0.387 1 1 1255 . 5 1 1 A 159 159 ARG HA H 159 5.444 5.454 -0.010 1 1 1263 . 5 1 1 A 159 159 ARG CA C 159 51.933 54.610 -2.677 1 1 1264 . 5 1 1 A 159 159 ARG N N 159 121.721 121.186 0.535 1 1 1266 . 5 1 1 A 160 160 GLY H H 160 8.910 8.950 -0.040 1 1 1267 . 5 1 1 A 160 160 GLY HA2 H 160 4.904 4.341 0.563 1 1 1268 . 5 1 1 A 160 160 GLY HA3 H 160 4.484 4.498 -0.014 1 1 1269 . 5 1 1 A 160 160 GLY N N 160 113.921 107.135 6.786 1 1 1270 . 5 1 1 A 161 161 THR H H 161 9.110 8.803 0.307 1 1 1271 . 5 1 1 A 161 161 THR HA H 161 4.810 5.314 -0.504 1 1 1276 . 5 1 1 A 161 161 THR CA C 161 59.603 60.952 -1.349 1 1 1277 . 5 1 1 A 161 161 THR CB C 161 69.909 72.535 -2.626 1 1 1279 . 5 1 1 A 161 161 THR N N 161 126.813 115.669 11.144 1 1 1280 . 5 1 1 A 162 162 ALA H H 162 7.137 8.663 -1.526 1 1 1281 . 5 1 1 A 162 162 ALA HA H 162 5.361 5.082 0.279 1 1 1285 . 5 1 1 A 162 162 ALA CA C 162 46.573 51.160 -4.587 1 1 1286 . 5 1 1 A 162 162 ALA CB C 162 20.959 23.590 -2.631 1 1 1287 . 5 1 1 A 162 162 ALA N N 162 128.111 123.400 4.711 1 1 1288 . 5 1 1 A 163 163 PHE H H 163 8.587 9.221 -0.634 1 1 1289 . 5 1 1 A 163 163 PHE HA H 163 5.538 5.732 -0.194 1 1 1296 . 5 1 1 A 163 163 PHE N N 163 117.349 114.821 2.528 1 1 1297 . 5 1 1 A 164 164 GLY H H 164 8.650 9.093 -0.443 1 1 1298 . 5 1 1 A 164 164 GLY HA2 H 164 4.210 4.328 -0.118 1 1 1299 . 5 1 1 A 164 164 GLY HA3 H 164 3.285 4.388 -1.103 1 1 1300 . 5 1 1 A 164 164 GLY CA C 164 40.377 44.108 -3.731 1 1 1301 . 5 1 1 A 164 164 GLY N N 164 108.839 108.655 0.184 1 1 1302 . 5 1 1 A 165 165 SER H H 165 7.684 9.011 -1.327 1 1 1303 . 5 1 1 A 165 165 SER HA H 165 3.458 4.637 -1.179 1 1 1304 . 5 1 1 A 165 165 SER N N 165 116.037 116.952 -0.915 1 1 1305 . 5 1 1 A 166 166 ASP H H 166 9.718 7.963 1.755 1 1 1306 . 5 1 1 A 166 166 ASP HA H 166 4.281 4.890 -0.609 1 1 1309 . 5 1 1 A 166 166 ASP CA C 166 52.584 53.949 -1.365 1 1 1310 . 5 1 1 A 166 166 ASP N N 166 125.166 119.681 5.485 1 1 1311 . 5 1 1 A 167 167 ASP H H 167 7.655 7.709 -0.054 1 1 1312 . 5 1 1 A 167 167 ASP HA H 167 4.666 4.964 -0.298 1 1 1315 . 5 1 1 A 167 167 ASP CB C 167 38.948 43.957 -5.009 1 1 1316 . 5 1 1 A 167 167 ASP N N 167 117.491 118.666 -1.175 1 1 1317 . 5 1 1 A 168 168 ALA H H 168 8.585 8.489 0.096 1 1 1318 . 5 1 1 A 168 168 ALA HA H 168 5.012 4.052 0.960 1 1 1322 . 5 1 1 A 168 168 ALA CA C 168 47.485 54.288 -6.803 1 1 1323 . 5 1 1 A 168 168 ALA N N 168 128.834 122.924 5.910 1 1 1324 . 5 1 1 A 169 169 GLY H H 169 8.472 7.232 1.240 1 1 1325 . 5 1 1 A 169 169 GLY HA2 H 169 4.404 4.131 0.273 1 1 1326 . 5 1 1 A 169 169 GLY HA3 H 169 4.051 4.166 -0.115 1 1 1327 . 5 1 1 A 169 169 GLY CA C 169 43.257 46.005 -2.748 1 1 1328 . 5 1 1 A 169 169 GLY N N 169 107.133 103.256 3.877 1 1 1329 . 5 1 1 A 170 170 GLY H H 170 7.229 7.902 -0.673 1 1 1330 . 5 1 1 A 170 170 GLY HA2 H 170 4.223 4.057 0.166 1 1 1331 . 5 1 1 A 170 170 GLY HA3 H 170 3.781 4.060 -0.279 1 1 1332 . 5 1 1 A 170 170 GLY CA C 170 43.310 45.637 -2.327 1 1 1333 . 5 1 1 A 170 170 GLY N N 170 107.542 110.134 -2.592 1 1 1334 . 5 1 1 A 171 171 LYS H H 171 9.641 9.065 0.576 1 1 1335 . 5 1 1 A 171 171 LYS HA H 171 5.129 4.999 0.130 1 1 1342 . 5 1 1 A 171 171 LYS CA C 171 51.355 55.239 -3.884 1 1 1343 . 5 1 1 A 171 171 LYS N N 171 124.322 125.731 -1.409 1 1 1344 . 5 1 1 A 172 172 LEU H H 172 7.764 8.741 -0.977 1 1 1345 . 5 1 1 A 172 172 LEU HA H 172 4.973 5.247 -0.274 1 1 1353 . 5 1 1 A 172 172 LEU CA C 172 50.348 52.917 -2.569 1 1 1354 . 5 1 1 A 172 172 LEU N N 172 126.389 123.253 3.136 1 1 1355 . 5 1 1 A 173 173 THR H H 173 8.321 8.796 -0.475 1 1 1356 . 5 1 1 A 173 173 THR HA H 173 5.017 5.176 -0.159 1 1 1361 . 5 1 1 A 173 173 THR CA C 173 59.149 61.803 -2.654 1 1 1362 . 5 1 1 A 173 173 THR CB C 173 67.449 71.064 -3.615 1 1 1364 . 5 1 1 A 173 173 THR N N 173 123.553 114.706 8.847 1 1 1365 . 5 1 1 A 174 174 TYR H H 174 9.367 9.821 -0.454 1 1 1366 . 5 1 1 A 174 174 TYR HA H 174 4.660 5.248 -0.588 1 1 1373 . 5 1 1 A 174 174 TYR CB C 174 41.267 40.353 0.914 1 1 1374 . 5 1 1 A 174 174 TYR N N 174 129.583 122.652 6.931 1 1 1375 . 5 1 1 A 175 175 THR H H 175 8.529 8.472 0.057 1 1 1376 . 5 1 1 A 175 175 THR HA H 175 5.388 4.838 0.550 1 1 1381 . 5 1 1 A 175 175 THR CA C 175 58.216 61.550 -3.334 1 1 1382 . 5 1 1 A 175 175 THR CB C 175 68.575 71.214 -2.639 1 1 1384 . 5 1 1 A 175 175 THR N N 175 125.967 115.545 10.422 1 1 1385 . 5 1 1 A 176 176 ILE H H 176 9.139 9.638 -0.499 1 1 1386 . 5 1 1 A 176 176 ILE HA H 176 4.382 5.036 -0.654 1 1 1395 . 5 1 1 A 176 176 ILE CA C 176 58.006 59.148 -1.142 1 1 1396 . 5 1 1 A 176 176 ILE CB C 176 38.881 42.151 -3.270 1 1 1400 . 5 1 1 A 176 176 ILE N N 176 123.715 117.188 6.527 1 1 1401 . 5 1 1 A 177 177 ASP H H 177 8.501 8.961 -0.460 1 1 1402 . 5 1 1 A 177 177 ASP HA H 177 5.011 4.829 0.182 1 1 1405 . 5 1 1 A 177 177 ASP CA C 177 49.089 52.251 -3.162 1 1 1406 . 5 1 1 A 177 177 ASP CB C 177 39.282 43.101 -3.819 1 1 1407 . 5 1 1 A 177 177 ASP N N 177 125.978 123.315 2.663 1 1 1408 . 5 1 1 A 178 178 PHE H H 178 8.913 7.721 1.192 1 1 1409 . 5 1 1 A 178 178 PHE HA H 178 3.993 3.828 0.165 1 1 1414 . 5 1 1 A 178 178 PHE CB C 178 34.588 39.347 -4.759 1 1 1415 . 5 1 1 A 178 178 PHE N N 178 123.522 124.268 -0.746 1 1 1416 . 5 1 1 A 179 179 ALA H H 179 8.487 9.578 -1.091 1 1 1417 . 5 1 1 A 179 179 ALA HA H 179 4.528 4.372 0.156 1 1 1421 . 5 1 1 A 179 179 ALA CA C 179 52.584 55.874 -3.290 1 1 1422 . 5 1 1 A 179 179 ALA CB C 179 15.666 18.731 -3.065 1 1 1423 . 5 1 1 A 179 179 ALA N N 179 124.061 125.208 -1.147 1 1 1424 . 5 1 1 A 180 180 ALA H H 180 7.162 7.933 -0.771 1 1 1425 . 5 1 1 A 180 180 ALA HA H 180 4.313 4.413 -0.100 1 1 1429 . 5 1 1 A 180 180 ALA CA C 180 49.006 51.426 -2.420 1 1 1430 . 5 1 1 A 180 180 ALA CB C 180 16.933 17.304 -0.371 1 1 1431 . 5 1 1 A 180 180 ALA N N 180 119.710 118.357 1.353 1 1 1432 . 5 1 1 A 181 181 LYS H H 181 8.092 9.440 -1.348 1 1 1433 . 5 1 1 A 181 181 LYS HA H 181 3.457 4.925 -1.468 1 1 1440 . 5 1 1 A 181 181 LYS CA C 181 54.783 57.251 -2.468 1 1 1441 . 5 1 1 A 181 181 LYS CB C 181 27.088 31.128 -4.040 1 1 1444 . 5 1 1 A 181 181 LYS N N 181 114.996 121.388 -6.392 1 1 1445 . 5 1 1 A 182 182 GLN H H 182 7.532 7.973 -0.441 1 1 1446 . 5 1 1 A 182 182 GLN HA H 182 5.304 5.140 0.164 1 1 1453 . 5 1 1 A 182 182 GLN CA C 182 51.473 54.815 -3.342 1 1 1454 . 5 1 1 A 182 182 GLN CB C 182 31.585 32.111 -0.526 1 1 1455 . 5 1 1 A 182 182 GLN N N 182 115.064 119.842 -4.778 1 1 1457 . 5 1 1 A 183 183 GLY H H 183 9.026 8.354 0.672 1 1 1458 . 5 1 1 A 183 183 GLY HA2 H 183 5.376 4.498 0.878 1 1 1459 . 5 1 1 A 183 183 GLY HA3 H 183 3.567 4.543 -0.976 1 1 1460 . 5 1 1 A 183 183 GLY CA C 183 42.361 45.601 -3.240 1 1 1461 . 5 1 1 A 183 183 GLY N N 183 111.505 110.801 0.704 1 1 1462 . 5 1 1 A 184 184 HIS H H 184 7.508 9.169 -1.661 1 1 1463 . 5 1 1 A 184 184 HIS HA H 184 4.304 5.067 -0.763 1 1 1467 . 5 1 1 A 184 184 HIS CA C 184 52.793 55.782 -2.989 1 1 1468 . 5 1 1 A 184 184 HIS CB C 184 27.906 32.596 -4.690 1 1 1469 . 5 1 1 A 184 184 HIS N N 184 111.297 118.751 -7.454 1 1 1470 . 5 1 1 A 185 185 GLY H H 185 9.160 7.451 1.709 1 1 1471 . 5 1 1 A 185 185 GLY HA2 H 185 4.464 4.280 0.184 1 1 1472 . 5 1 1 A 185 185 GLY HA3 H 185 4.117 4.348 -0.231 1 1 1473 . 5 1 1 A 185 185 GLY CA C 185 44.212 46.256 -2.044 1 1 1474 . 5 1 1 A 185 185 GLY N N 185 107.398 109.171 -1.773 1 1 1475 . 5 1 1 A 186 186 LYS H H 186 9.170 8.623 0.547 1 1 1476 . 5 1 1 A 186 186 LYS HA H 186 4.925 5.114 -0.189 1 1 1481 . 5 1 1 A 186 186 LYS CB C 186 33.642 36.999 -3.357 1 1 1482 . 5 1 1 A 186 186 LYS N N 186 122.690 119.565 3.125 1 1 1483 . 5 1 1 A 187 187 ILE H H 187 8.444 8.590 -0.146 1 1 1484 . 5 1 1 A 187 187 ILE HA H 187 4.626 4.942 -0.316 1 1 1487 . 5 1 1 A 187 187 ILE N N 187 124.320 120.831 3.489 1 1 1488 . 5 1 1 A 188 188 GLU H H 188 8.590 9.705 -1.115 1 1 1489 . 5 1 1 A 188 188 GLU HA H 188 4.650 4.697 -0.047 1 1 1495 . 5 1 1 A 188 188 GLU N N 188 122.575 127.539 -4.964 1 1 1496 . 5 1 1 A 189 189 HIS H H 189 8.726 8.108 0.618 1 1 1497 . 5 1 1 A 189 189 HIS HA H 189 4.055 4.133 -0.078 1 1 1501 . 5 1 1 A 189 189 HIS CA C 189 54.623 59.160 -4.537 1 1 1502 . 5 1 1 A 189 189 HIS CB C 189 24.997 29.617 -4.620 1 1 1503 . 5 1 1 A 189 189 HIS N N 189 111.381 122.449 -11.068 1 1 1504 . 5 1 1 A 190 190 LEU H H 190 9.715 7.598 2.117 1 1 1505 . 5 1 1 A 190 190 LEU HA H 190 4.379 4.400 -0.021 1 1 1515 . 5 1 1 A 190 190 LEU N N 190 124.648 116.941 7.707 1 1 1516 . 5 1 1 A 191 191 LYS H H 191 10.099 8.071 2.028 1 1 1517 . 5 1 1 A 191 191 LYS HA H 191 3.736 4.553 -0.817 1 1 1524 . 5 1 1 A 191 191 LYS CA C 191 55.815 56.809 -0.994 1 1 1525 . 5 1 1 A 191 191 LYS CB C 191 30.201 35.429 -5.228 1 1 1527 . 5 1 1 A 191 191 LYS N N 191 123.618 120.843 2.775 1 1 1528 . 5 1 1 A 192 192 SER H H 192 6.991 7.776 -0.785 1 1 1529 . 5 1 1 A 192 192 SER HA H 192 4.743 4.547 0.196 1 1 1532 . 5 1 1 A 192 192 SER CA C 192 51.974 56.255 -4.281 1 1 1533 . 5 1 1 A 192 192 SER CB C 192 60.005 64.321 -4.316 1 1 1534 . 5 1 1 A 192 192 SER N N 192 115.071 116.348 -1.277 1 1 1535 . 5 1 1 A 193 193 PRO CB C 193 29.607 30.113 -0.506 1 1 1537 . 5 1 1 A 194 194 GLU H H 194 8.213 8.709 -0.496 1 1 1538 . 5 1 1 A 194 194 GLU HA H 194 3.063 4.622 -1.559 1 1 1543 . 5 1 1 A 194 194 GLU CA C 194 54.185 57.119 -2.934 1 1 1545 . 5 1 1 A 194 194 GLU N N 194 114.055 119.758 -5.703 1 1 1546 . 5 1 1 A 195 195 LEU H H 195 7.082 7.715 -0.633 1 1 1547 . 5 1 1 A 195 195 LEU HA H 195 4.027 4.158 -0.131 1 1 1557 . 5 1 1 A 195 195 LEU CA C 195 51.361 53.937 -2.576 1 1 1558 . 5 1 1 A 195 195 LEU CB C 195 38.950 40.962 -2.012 1 1 1561 . 5 1 1 A 195 195 LEU N N 195 113.898 118.252 -4.354 1 1 1562 . 5 1 1 A 196 196 ASN H H 196 7.060 7.932 -0.872 1 1 1563 . 5 1 1 A 196 196 ASN HA H 196 4.638 4.802 -0.164 1 1 1567 . 5 1 1 A 196 196 ASN N N 196 119.196 118.630 0.566 1 1 1568 . 5 1 1 A 197 197 VAL H H 197 7.244 8.302 -1.058 1 1 1569 . 5 1 1 A 197 197 VAL HA H 197 4.540 4.856 -0.316 1 1 1577 . 5 1 1 A 197 197 VAL CA C 197 57.176 59.377 -2.201 1 1 1578 . 5 1 1 A 197 197 VAL N N 197 113.621 116.010 -2.389 1 1 1579 . 5 1 1 A 198 198 ASP H H 198 8.881 8.966 -0.085 1 1 1580 . 5 1 1 A 198 198 ASP HA H 198 4.894 4.924 -0.030 1 1 1581 . 5 1 1 A 198 198 ASP N N 198 118.852 122.548 -3.696 1 1 1582 . 5 1 1 A 199 199 LEU H H 199 8.498 8.555 -0.057 1 1 1583 . 5 1 1 A 199 199 LEU HA H 199 4.317 5.055 -0.738 1 1 1591 . 5 1 1 A 199 199 LEU N N 199 124.078 127.411 -3.333 1 1 1592 . 5 1 1 A 200 200 ALA H H 200 8.386 9.120 -0.734 1 1 1593 . 5 1 1 A 200 200 ALA HA H 200 4.295 5.072 -0.777 1 1 1597 . 5 1 1 A 200 200 ALA CA C 200 50.044 51.421 -1.377 1 1 1598 . 5 1 1 A 200 200 ALA CB C 200 17.985 22.005 -4.020 1 1 1599 . 5 1 1 A 200 200 ALA N N 200 127.315 124.946 2.369 1 1 1600 . 5 1 1 A 201 201 VAL H H 201 8.007 8.748 -0.741 1 1 1601 . 5 1 1 A 201 201 VAL HA H 201 4.577 4.897 -0.320 1 1 1609 . 5 1 1 A 201 201 VAL CA C 201 60.004 60.236 -0.232 1 1 1610 . 5 1 1 A 201 201 VAL CB C 201 28.863 35.668 -6.805 1 1 1611 . 5 1 1 A 201 201 VAL N N 201 119.409 121.924 -2.515 1 1 1612 . 5 1 1 A 202 202 ALA H H 202 8.789 8.843 -0.054 1 1 1613 . 5 1 1 A 202 202 ALA HA H 202 4.630 5.409 -0.779 1 1 1617 . 5 1 1 A 202 202 ALA CA C 202 48.200 50.116 -1.916 1 1 1618 . 5 1 1 A 202 202 ALA N N 202 131.745 130.489 1.256 1 1 1619 . 5 1 1 A 203 203 TYR H H 203 8.522 9.053 -0.531 1 1 1620 . 5 1 1 A 203 203 TYR HA H 203 5.391 5.346 0.045 1 1 1627 . 5 1 1 A 203 203 TYR CA C 203 54.648 59.272 -4.624 1 1 1628 . 5 1 1 A 203 203 TYR CB C 203 37.315 39.268 -1.953 1 1 1629 . 5 1 1 A 203 203 TYR N N 203 117.786 124.681 -6.895 1 1 1630 . 5 1 1 A 204 204 ILE H H 204 8.209 8.179 0.030 1 1 1631 . 5 1 1 A 204 204 ILE HA H 204 4.393 4.346 0.047 1 1 1641 . 5 1 1 A 204 204 ILE CB C 204 36.807 40.216 -3.409 1 1 1644 . 5 1 1 A 204 204 ILE N N 204 120.602 125.531 -4.929 1 1 1645 . 5 1 1 A 205 205 LYS H H 205 9.340 8.592 0.748 1 1 1646 . 5 1 1 A 205 205 LYS HA H 205 4.756 4.828 -0.072 1 1 1651 . 5 1 1 A 205 205 LYS CA C 205 50.844 60.579 -9.735 1 1 1652 . 5 1 1 A 205 205 LYS N N 205 127.960 124.385 3.575 1 1 1653 . 5 1 1 A 207 207 ASP H H 207 8.436 8.547 -0.111 1 1 1654 . 5 1 1 A 207 207 ASP HA H 207 4.692 4.536 0.156 1 1 1657 . 5 1 1 A 207 207 ASP CA C 207 48.789 52.978 -4.189 1 1 1658 . 5 1 1 A 207 207 ASP CB C 207 38.377 41.497 -3.120 1 1 1659 . 5 1 1 A 207 207 ASP N N 207 123.098 124.826 -1.728 1 1 1660 . 5 1 1 A 208 208 GLU H H 208 8.880 8.524 0.356 1 1 1661 . 5 1 1 A 208 208 GLU HA H 208 3.994 4.125 -0.131 1 1 1666 . 5 1 1 A 208 208 GLU CA C 208 56.123 58.531 -2.408 1 1 1667 . 5 1 1 A 208 208 GLU CB C 208 25.794 29.466 -3.672 1 1 1669 . 5 1 1 A 208 208 GLU N N 208 119.042 121.899 -2.857 1 1 1670 . 5 1 1 A 209 209 LYS H H 209 7.681 7.647 0.034 1 1 1671 . 5 1 1 A 209 209 LYS HA H 209 4.141 4.414 -0.273 1 1 1680 . 5 1 1 A 209 209 LYS N N 209 119.252 117.111 2.141 1 1 1681 . 5 1 1 A 210 210 HIS H H 210 8.177 6.625 1.552 1 1 1682 . 5 1 1 A 210 210 HIS HA H 210 3.825 4.681 -0.856 1 1 1687 . 5 1 1 A 210 210 HIS CA C 210 54.205 54.207 -0.002 1 1 1688 . 5 1 1 A 210 210 HIS CB C 210 23.439 29.884 -6.445 1 1 1689 . 5 1 1 A 210 210 HIS N N 210 112.758 111.772 0.986 1 1 1690 . 5 1 1 A 211 211 HIS H H 211 8.758 7.117 1.641 1 1 1691 . 5 1 1 A 211 211 HIS HA H 211 5.041 4.900 0.141 1 1 1695 . 5 1 1 A 211 211 HIS CA C 211 50.450 54.911 -4.461 1 1 1696 . 5 1 1 A 211 211 HIS CB C 211 25.703 33.857 -8.154 1 1 1697 . 5 1 1 A 211 211 HIS N N 211 119.552 118.370 1.182 1 1 1698 . 5 1 1 A 212 212 ALA H H 212 8.556 8.140 0.416 1 1 1699 . 5 1 1 A 212 212 ALA HA H 212 4.712 4.831 -0.119 1 1 1703 . 5 1 1 A 212 212 ALA CA C 212 49.886 50.917 -1.031 1 1 1704 . 5 1 1 A 212 212 ALA CB C 212 18.860 19.430 -0.570 1 1 1705 . 5 1 1 A 212 212 ALA N N 212 123.780 122.663 1.117 1 1 1706 . 5 1 1 A 213 213 VAL H H 213 9.338 8.093 1.245 1 1 1707 . 5 1 1 A 213 213 VAL HA H 213 5.074 4.970 0.104 1 1 1715 . 5 1 1 A 213 213 VAL CA C 213 57.486 59.751 -2.265 1 1 1716 . 5 1 1 A 213 213 VAL CB C 213 33.938 36.138 -2.200 1 1 1717 . 5 1 1 A 213 213 VAL N N 213 124.742 119.263 5.479 1 1 1718 . 5 1 1 A 214 214 ILE H H 214 8.962 8.931 0.031 1 1 1719 . 5 1 1 A 214 214 ILE HA H 214 4.434 4.901 -0.467 1 1 1726 . 5 1 1 A 214 214 ILE N N 214 122.881 124.075 -1.194 1 1 1727 . 5 1 1 A 215 215 SER H H 215 8.558 8.587 -0.029 1 1 1728 . 5 1 1 A 215 215 SER HA H 215 5.001 5.353 -0.352 1 1 1731 . 5 1 1 A 215 215 SER CA C 215 53.230 56.946 -3.716 1 1 1732 . 5 1 1 A 215 215 SER CB C 215 62.077 66.123 -4.046 1 1 1733 . 5 1 1 A 215 215 SER N N 215 122.891 121.185 1.706 1 1 1734 . 5 1 1 A 216 216 GLY H H 216 7.282 8.986 -1.704 1 1 1735 . 5 1 1 A 216 216 GLY HA2 H 216 4.515 4.321 0.194 1 1 1736 . 5 1 1 A 216 216 GLY HA3 H 216 3.473 4.323 -0.850 1 1 1737 . 5 1 1 A 216 216 GLY CA C 216 42.816 46.047 -3.231 1 1 1738 . 5 1 1 A 216 216 GLY N N 216 110.899 108.692 2.207 1 1 1739 . 5 1 1 A 217 217 SER H H 217 8.673 8.851 -0.178 1 1 1740 . 5 1 1 A 217 217 SER HA H 217 5.127 5.446 -0.319 1 1 1743 . 5 1 1 A 217 217 SER CA C 217 56.266 56.777 -0.511 1 1 1744 . 5 1 1 A 217 217 SER N N 217 117.164 116.239 0.925 1 1 1745 . 5 1 1 A 218 218 VAL H H 218 7.451 9.152 -1.701 1 1 1746 . 5 1 1 A 218 218 VAL HA H 218 5.128 4.910 0.218 1 1 1754 . 5 1 1 A 218 218 VAL CA C 218 56.637 59.866 -3.229 1 1 1755 . 5 1 1 A 218 218 VAL N N 218 117.826 120.149 -2.323 1 1 1756 . 5 1 1 A 219 219 LEU H H 219 9.022 8.864 0.158 1 1 1757 . 5 1 1 A 219 219 LEU HA H 219 5.387 4.866 0.521 1 1 1767 . 5 1 1 A 219 219 LEU CA C 219 50.450 53.928 -3.478 1 1 1768 . 5 1 1 A 219 219 LEU N N 219 124.820 125.608 -0.788 1 1 1769 . 5 1 1 A 220 220 TYR H H 220 8.816 8.987 -0.171 1 1 1770 . 5 1 1 A 220 220 TYR HA H 220 4.834 4.955 -0.121 1 1 1777 . 5 1 1 A 220 220 TYR N N 220 121.249 124.019 -2.770 1 1 1778 . 5 1 1 A 221 221 ASN H H 221 9.191 8.929 0.262 1 1 1779 . 5 1 1 A 221 221 ASN HA H 221 4.048 4.436 -0.388 1 1 1784 . 5 1 1 A 221 221 ASN CA C 221 51.647 54.937 -3.290 1 1 1785 . 5 1 1 A 221 221 ASN CB C 221 36.640 38.398 -1.758 1 1 1786 . 5 1 1 A 221 221 ASN N N 221 129.865 124.358 5.507 1 1 1788 . 5 1 1 A 222 222 GLN H H 222 8.468 6.779 1.689 1 1 1789 . 5 1 1 A 222 222 GLN HA H 222 3.671 3.953 -0.282 1 1 1794 . 5 1 1 A 222 222 GLN CA C 222 55.075 57.660 -2.585 1 1 1795 . 5 1 1 A 222 222 GLN CB C 222 24.663 29.410 -4.747 1 1 1797 . 5 1 1 A 222 222 GLN N N 222 108.367 117.970 -9.603 1 1 1798 . 5 1 1 A 223 223 ASP H H 223 7.797 7.691 0.106 1 1 1799 . 5 1 1 A 223 223 ASP HA H 223 4.986 4.886 0.100 1 1 1802 . 5 1 1 A 223 223 ASP N N 223 120.842 115.320 5.522 1 1 1803 . 5 1 1 A 224 224 GLU H H 224 8.731 7.916 0.815 1 1 1804 . 5 1 1 A 224 224 GLU HA H 224 4.690 4.668 0.022 1 1 1809 . 5 1 1 A 224 224 GLU CA C 224 54.703 56.023 -1.320 1 1 1810 . 5 1 1 A 224 224 GLU CB C 224 26.357 31.333 -4.976 1 1 1812 . 5 1 1 A 224 224 GLU N N 224 124.249 120.473 3.776 1 1 1813 . 5 1 1 A 225 225 LYS H H 225 8.730 8.826 -0.096 1 1 1814 . 5 1 1 A 225 225 LYS HA H 225 4.754 5.021 -0.267 1 1 1822 . 5 1 1 A 225 225 LYS N N 225 126.784 120.709 6.075 1 1 1823 . 5 1 1 A 226 226 GLY H H 226 7.683 8.912 -1.229 1 1 1824 . 5 1 1 A 226 226 GLY HA2 H 226 5.567 4.238 1.329 1 1 1825 . 5 1 1 A 226 226 GLY HA3 H 226 3.819 4.273 -0.454 1 1 1826 . 5 1 1 A 226 226 GLY CA C 226 42.264 44.265 -2.001 1 1 1827 . 5 1 1 A 226 226 GLY N N 226 107.140 111.089 -3.949 1 1 1828 . 5 1 1 A 227 227 SER H H 227 8.672 11.254 -2.582 1 1 1829 . 5 1 1 A 227 227 SER HA H 227 5.564 5.556 0.008 1 1 1832 . 5 1 1 A 227 227 SER CA C 227 54.373 57.250 -2.877 1 1 1833 . 5 1 1 A 227 227 SER CB C 227 63.963 66.663 -2.700 1 1 1834 . 5 1 1 A 227 227 SER N N 227 117.767 116.188 1.579 1 1 1835 . 5 1 1 A 228 228 TYR H H 228 9.073 8.681 0.392 1 1 1836 . 5 1 1 A 228 228 TYR HA H 228 5.519 5.269 0.250 1 1 1843 . 5 1 1 A 228 228 TYR N N 228 118.324 122.622 -4.298 1 1 1844 . 5 1 1 A 229 229 SER H H 229 8.929 8.276 0.653 1 1 1845 . 5 1 1 A 229 229 SER HA H 229 5.209 5.334 -0.125 1 1 1848 . 5 1 1 A 229 229 SER CA C 229 54.131 57.516 -3.385 1 1 1849 . 5 1 1 A 229 229 SER N N 229 116.118 121.370 -5.252 1 1 1850 . 5 1 1 A 230 230 LEU H H 230 9.372 9.809 -0.437 1 1 1851 . 5 1 1 A 230 230 LEU HA H 230 4.803 4.869 -0.066 1 1 1863 . 5 1 1 A 230 230 LEU N N 230 124.803 125.336 -0.533 1 1 1864 . 5 1 1 A 231 231 GLY H H 231 9.080 8.281 0.799 1 1 1865 . 5 1 1 A 231 231 GLY HA2 H 231 4.776 4.169 0.607 1 1 1866 . 5 1 1 A 231 231 GLY HA3 H 231 3.528 4.242 -0.714 1 1 1867 . 5 1 1 A 231 231 GLY CA C 231 41.468 44.560 -3.092 1 1 1868 . 5 1 1 A 231 231 GLY N N 231 109.611 108.201 1.410 1 1 1869 . 5 1 1 A 232 232 ILE H H 232 6.849 8.620 -1.771 1 1 1870 . 5 1 1 A 232 232 ILE HA H 232 4.742 4.299 0.443 1 1 1878 . 5 1 1 A 232 232 ILE N N 232 120.566 124.468 -3.902 1 1 1879 . 5 1 1 A 233 233 PHE H H 233 9.569 8.194 1.375 1 1 1880 . 5 1 1 A 233 233 PHE HA H 233 4.979 5.642 -0.663 1 1 1885 . 5 1 1 A 233 233 PHE N N 233 129.256 123.015 6.241 1 1 1886 . 5 1 1 A 234 234 GLY H H 234 8.734 8.696 0.038 1 1 1887 . 5 1 1 A 234 234 GLY HA2 H 234 4.488 4.357 0.131 1 1 1888 . 5 1 1 A 234 234 GLY HA3 H 234 3.327 4.364 -1.037 1 1 1889 . 5 1 1 A 234 234 GLY CA C 234 40.377 46.010 -5.633 1 1 1890 . 5 1 1 A 234 234 GLY N N 234 105.294 107.064 -1.770 1 1 1891 . 5 1 1 A 235 235 GLU H H 235 9.198 8.284 0.914 1 1 1892 . 5 1 1 A 235 235 GLU HA H 235 4.111 4.134 -0.023 1 1 1897 . 5 1 1 A 235 235 GLU CA C 235 56.466 58.414 -1.948 1 1 1898 . 5 1 1 A 235 235 GLU CB C 235 26.256 28.735 -2.479 1 1 1900 . 5 1 1 A 235 235 GLU N N 235 125.813 120.464 5.349 1 1 1901 . 5 1 1 A 236 236 LYS H H 236 8.147 7.695 0.452 1 1 1902 . 5 1 1 A 236 236 LYS HA H 236 4.373 4.530 -0.157 1 1 1905 . 5 1 1 A 236 236 LYS N N 236 117.810 120.136 -2.326 1 1 1906 . 5 1 1 A 237 237 ALA H H 237 7.685 7.557 0.128 1 1 1907 . 5 1 1 A 237 237 ALA HA H 237 3.902 4.474 -0.572 1 1 1911 . 5 1 1 A 237 237 ALA CA C 237 49.762 52.015 -2.253 1 1 1912 . 5 1 1 A 237 237 ALA CB C 237 14.720 19.709 -4.989 1 1 1913 . 5 1 1 A 237 237 ALA N N 237 118.704 121.884 -3.180 1 1 1914 . 5 1 1 A 238 238 GLN H H 238 9.312 8.448 0.864 1 1 1915 . 5 1 1 A 238 238 GLN HA H 238 4.049 4.657 -0.608 1 1 1920 . 5 1 1 A 238 238 GLN N N 238 118.059 122.010 -3.951 1 1 1921 . 5 1 1 A 239 239 GLU H H 239 8.785 10.513 -1.728 1 1 1922 . 5 1 1 A 239 239 GLU HA H 239 5.531 4.975 0.556 1 1 1927 . 5 1 1 A 239 239 GLU N N 239 116.914 122.002 -5.088 1 1 1928 . 5 1 1 A 240 240 VAL H H 240 8.501 9.360 -0.859 1 1 1929 . 5 1 1 A 240 240 VAL HA H 240 5.655 3.109 2.546 1 1 1937 . 5 1 1 A 240 240 VAL CA C 240 55.582 59.587 -4.005 1 1 1940 . 5 1 1 A 240 240 VAL N N 240 110.588 122.027 -11.439 1 1 1941 . 5 1 1 A 241 241 ALA H H 241 8.463 8.350 0.113 1 1 1942 . 5 1 1 A 241 241 ALA HA H 241 5.014 5.198 -0.184 1 1 1946 . 5 1 1 A 241 241 ALA CA C 241 49.361 51.319 -1.958 1 1 1947 . 5 1 1 A 241 241 ALA CB C 241 18.196 23.767 -5.571 1 1 1948 . 5 1 1 A 241 241 ALA N N 241 121.125 127.985 -6.860 1 1 1949 . 5 1 1 A 242 242 GLY H H 242 9.421 8.872 0.549 1 1 1950 . 5 1 1 A 242 242 GLY HA2 H 242 5.161 4.221 0.940 1 1 1951 . 5 1 1 A 242 242 GLY HA3 H 242 4.076 4.287 -0.211 1 1 1952 . 5 1 1 A 242 242 GLY N N 242 112.036 106.867 5.169 1 1 1953 . 5 1 1 A 243 243 SER H H 243 8.929 8.210 0.719 1 1 1954 . 5 1 1 A 243 243 SER HA H 243 5.331 5.665 -0.334 1 1 1957 . 5 1 1 A 243 243 SER N N 243 116.113 115.775 0.338 1 1 1958 . 5 1 1 A 244 244 ALA H H 244 9.218 9.085 0.133 1 1 1959 . 5 1 1 A 244 244 ALA HA H 244 5.221 5.063 0.158 1 1 1963 . 5 1 1 A 244 244 ALA CA C 244 47.883 50.381 -2.498 1 1 1964 . 5 1 1 A 244 244 ALA N N 244 120.635 125.589 -4.954 1 1 1965 . 5 1 1 A 245 245 GLU H H 245 9.194 8.372 0.822 1 1 1966 . 5 1 1 A 245 245 GLU HA H 245 4.869 5.157 -0.288 1 1 1971 . 5 1 1 A 245 245 GLU N N 245 123.487 117.599 5.888 1 1 1972 . 5 1 1 A 246 246 VAL H H 246 8.531 9.551 -1.020 1 1 1973 . 5 1 1 A 246 246 VAL HA H 246 4.518 4.805 -0.287 1 1 1981 . 5 1 1 A 246 246 VAL CA C 246 58.286 61.592 -3.306 1 1 1982 . 5 1 1 A 246 246 VAL N N 246 123.347 125.257 -1.910 1 1 1983 . 5 1 1 A 247 247 GLU H H 247 9.132 8.708 0.424 1 1 1984 . 5 1 1 A 247 247 GLU HA H 247 4.368 5.071 -0.703 1 1 1989 . 5 1 1 A 247 247 GLU CB C 247 26.744 33.217 -6.473 1 1 1990 . 5 1 1 A 247 247 GLU N N 247 129.243 127.765 1.478 1 1 1991 . 5 1 1 A 248 248 THR H H 248 7.827 8.160 -0.333 1 1 1992 . 5 1 1 A 248 248 THR HA H 248 4.749 4.558 0.191 1 1 1997 . 5 1 1 A 248 248 THR CA C 248 56.859 60.028 -3.169 1 1 1998 . 5 1 1 A 248 248 THR CB C 248 69.171 69.880 -0.709 1 1 2000 . 5 1 1 A 248 248 THR N N 248 114.228 120.391 -6.163 1 1 2001 . 5 1 1 A 249 249 ALA H H 249 9.148 8.293 0.855 1 1 2002 . 5 1 1 A 249 249 ALA HA H 249 4.174 4.552 -0.378 1 1 2006 . 5 1 1 A 249 249 ALA CA C 249 51.970 51.727 0.243 1 1 2007 . 5 1 1 A 249 249 ALA CB C 249 15.797 20.237 -4.440 1 1 2008 . 5 1 1 A 249 249 ALA N N 249 123.341 125.853 -2.512 1 1 2009 . 5 1 1 A 250 250 ASN H H 250 7.974 8.184 -0.210 1 1 2010 . 5 1 1 A 250 250 ASN HA H 250 4.953 4.867 0.086 1 1 2015 . 5 1 1 A 250 250 ASN CA C 250 49.198 52.269 -3.071 1 1 2016 . 5 1 1 A 250 250 ASN CB C 250 35.976 39.630 -3.654 1 1 2017 . 5 1 1 A 250 250 ASN N N 250 113.358 113.415 -0.057 1 1 2019 . 5 1 1 A 251 251 GLY H H 251 7.510 7.462 0.048 1 1 2020 . 5 1 1 A 251 251 GLY HA2 H 251 4.492 3.998 0.494 1 1 2021 . 5 1 1 A 251 251 GLY HA3 H 251 3.853 4.019 -0.166 1 1 2022 . 5 1 1 A 251 251 GLY CA C 251 41.435 46.033 -4.598 1 1 2023 . 5 1 1 A 251 251 GLY N N 251 108.692 107.258 1.434 1 1 2024 . 5 1 1 A 252 252 ILE H H 252 8.465 8.106 0.359 1 1 2025 . 5 1 1 A 252 252 ILE HA H 252 4.521 4.192 0.329 1 1 2035 . 5 1 1 A 252 252 ILE CB C 252 35.653 42.626 -6.973 1 1 2039 . 5 1 1 A 252 252 ILE N N 252 122.043 119.813 2.230 1 1 2040 . 5 1 1 A 253 253 HIS H H 253 9.311 8.901 0.410 1 1 2041 . 5 1 1 A 253 253 HIS HA H 253 4.861 4.899 -0.038 1 1 2046 . 5 1 1 A 253 253 HIS N N 253 126.617 120.368 6.249 1 1 2047 . 5 1 1 A 254 254 HIS H H 254 8.820 8.305 0.515 1 1 2048 . 5 1 1 A 254 254 HIS HA H 254 5.305 5.804 -0.499 1 1 2051 . 5 1 1 A 254 254 HIS CA C 254 52.781 53.562 -0.781 1 1 2052 . 5 1 1 A 254 254 HIS N N 254 122.665 116.555 6.110 1 1 2053 . 5 1 1 A 255 255 ILE H H 255 9.047 9.314 -0.267 1 1 2054 . 5 1 1 A 255 255 ILE HA H 255 4.651 4.801 -0.150 1 1 2061 . 5 1 1 A 255 255 ILE N N 255 123.958 121.084 2.874 1 1 2062 . 5 1 1 A 256 256 GLY H H 256 9.339 7.779 1.560 1 1 2063 . 5 1 1 A 256 256 GLY HA2 H 256 3.816 2.524 1.292 1 1 2064 . 5 1 1 A 256 256 GLY HA3 H 256 2.267 3.600 -1.333 1 1 2065 . 5 1 1 A 256 256 GLY N N 256 115.022 114.770 0.252 1 1 2066 . 5 1 1 A 257 257 LEU H H 257 7.890 9.362 -1.472 1 1 2067 . 5 1 1 A 257 257 LEU HA H 257 4.853 5.020 -0.167 1 1 2077 . 5 1 1 A 257 257 LEU N N 257 121.441 125.434 -3.993 1 1 2078 . 5 1 1 A 258 258 ALA H H 258 7.982 8.805 -0.823 1 1 2079 . 5 1 1 A 258 258 ALA HA H 258 4.668 5.067 -0.399 1 1 2083 . 5 1 1 A 258 258 ALA CA C 258 49.678 51.743 -2.065 1 1 2084 . 5 1 1 A 258 258 ALA CB C 258 19.561 20.624 -1.063 1 1 2085 . 5 1 1 A 258 258 ALA N N 258 123.234 122.420 0.814 1 1 2086 . 5 1 1 A 259 259 ALA H H 259 9.117 9.529 -0.412 1 1 2087 . 5 1 1 A 259 259 ALA HA H 259 4.790 4.783 0.007 1 1 2091 . 5 1 1 A 259 259 ALA N N 259 123.901 125.512 -1.611 1 1 2092 . 5 1 1 A 260 260 LYS H H 260 8.452 8.091 0.361 1 1 2093 . 5 1 1 A 260 260 LYS HA H 260 5.914 4.617 1.297 1 1 2098 . 5 1 1 A 260 260 LYS CA C 260 51.818 54.421 -2.603 1 1 2099 . 5 1 1 A 260 260 LYS N N 260 116.464 117.082 -0.618 1 1 1 . 6 1 1 A 9 9 SER H H 9 8.293 8.058 0.235 1 1 2 . 6 1 1 A 9 9 SER HA H 9 4.432 4.852 -0.420 1 1 3 . 6 1 1 A 9 9 SER N N 9 116.407 113.646 2.761 1 1 4 . 6 1 1 A 10 10 GLY H H 10 8.472 9.201 -0.729 1 1 5 . 6 1 1 A 10 10 GLY N N 10 111.611 113.935 -2.324 1 1 6 . 6 1 1 A 14 14 VAL H H 14 8.009 8.549 -0.540 1 1 7 . 6 1 1 A 14 14 VAL HA H 14 4.128 4.206 -0.078 1 1 15 . 6 1 1 A 14 14 VAL CA C 14 59.473 62.250 -2.777 1 1 16 . 6 1 1 A 14 14 VAL CB C 14 30.127 32.759 -2.632 1 1 17 . 6 1 1 A 14 14 VAL N N 14 119.846 121.385 -1.539 1 1 18 . 6 1 1 A 15 15 THR H H 15 8.152 8.630 -0.478 1 1 19 . 6 1 1 A 15 15 THR HA H 15 4.346 4.089 0.257 1 1 24 . 6 1 1 A 15 15 THR N N 15 118.509 119.104 -0.595 1 1 25 . 6 1 1 A 16 16 ALA H H 16 8.207 7.758 0.449 1 1 26 . 6 1 1 A 16 16 ALA HA H 16 4.319 4.411 -0.092 1 1 30 . 6 1 1 A 16 16 ALA CA C 16 49.835 52.789 -2.954 1 1 31 . 6 1 1 A 16 16 ALA CB C 16 16.714 20.940 -4.226 1 1 32 . 6 1 1 A 16 16 ALA N N 16 126.935 119.536 7.399 1 1 33 . 6 1 1 A 17 17 ASP H H 17 8.269 7.769 0.500 1 1 34 . 6 1 1 A 17 17 ASP HA H 17 4.581 5.651 -1.070 1 1 37 . 6 1 1 A 17 17 ASP CA C 17 51.643 53.035 -1.392 1 1 38 . 6 1 1 A 17 17 ASP CB C 17 38.257 40.997 -2.740 1 1 39 . 6 1 1 A 17 17 ASP N N 17 120.379 116.525 3.854 1 1 40 . 6 1 1 A 18 18 ILE H H 18 7.979 8.023 -0.044 1 1 41 . 6 1 1 A 18 18 ILE HA H 18 4.178 3.904 0.274 1 1 48 . 6 1 1 A 18 18 ILE CA C 18 58.737 64.867 -6.130 1 1 49 . 6 1 1 A 18 18 ILE CB C 18 36.077 37.404 -1.327 1 1 53 . 6 1 1 A 18 18 ILE N N 18 121.171 121.928 -0.757 1 1 54 . 6 1 1 A 19 19 GLY H H 19 8.410 8.375 0.035 1 1 55 . 6 1 1 A 19 19 GLY HA2 H 19 4.023 3.933 0.090 1 1 56 . 6 1 1 A 19 19 GLY HA3 H 19 4.023 3.935 0.088 1 1 57 . 6 1 1 A 19 19 GLY N N 19 112.246 108.645 3.601 1 1 58 . 6 1 1 A 20 20 THR H H 20 8.005 7.832 0.173 1 1 59 . 6 1 1 A 20 20 THR HA H 20 4.463 4.092 0.371 1 1 64 . 6 1 1 A 20 20 THR CB C 20 66.723 68.008 -1.285 1 1 66 . 6 1 1 A 20 20 THR N N 20 112.239 114.530 -2.291 1 1 67 . 6 1 1 A 21 21 GLY H H 21 8.500 8.347 0.153 1 1 68 . 6 1 1 A 21 21 GLY HA2 H 21 4.099 3.906 0.193 1 1 69 . 6 1 1 A 21 21 GLY HA3 H 21 3.872 3.908 -0.036 1 1 70 . 6 1 1 A 21 21 GLY N N 21 111.048 110.669 0.379 1 1 71 . 6 1 1 A 22 22 LEU H H 22 7.427 8.034 -0.607 1 1 72 . 6 1 1 A 22 22 LEU HA H 22 3.884 4.030 -0.146 1 1 84 . 6 1 1 A 22 22 LEU N N 22 118.837 122.837 -4.000 1 1 85 . 6 1 1 A 23 23 ALA H H 23 7.896 7.958 -0.062 1 1 86 . 6 1 1 A 23 23 ALA HA H 23 4.023 4.137 -0.114 1 1 90 . 6 1 1 A 23 23 ALA CA C 23 52.584 54.157 -1.573 1 1 91 . 6 1 1 A 23 23 ALA CB C 23 15.470 18.381 -2.911 1 1 92 . 6 1 1 A 23 23 ALA N N 23 119.194 120.648 -1.454 1 1 93 . 6 1 1 A 24 24 ASP H H 24 8.265 7.643 0.622 1 1 94 . 6 1 1 A 24 24 ASP HA H 24 4.337 4.517 -0.180 1 1 97 . 6 1 1 A 24 24 ASP CB C 24 37.029 41.179 -4.150 1 1 98 . 6 1 1 A 24 24 ASP N N 24 119.035 116.613 2.422 1 1 99 . 6 1 1 A 25 25 ALA H H 25 8.211 8.475 -0.264 1 1 100 . 6 1 1 A 25 25 ALA HA H 25 4.064 4.261 -0.197 1 1 104 . 6 1 1 A 25 25 ALA CA C 25 53.278 53.029 0.249 1 1 105 . 6 1 1 A 25 25 ALA CB C 25 15.760 19.241 -3.481 1 1 106 . 6 1 1 A 25 25 ALA N N 25 122.434 120.624 1.810 1 1 107 . 6 1 1 A 26 26 LEU H H 26 7.334 7.048 0.286 1 1 108 . 6 1 1 A 26 26 LEU HA H 26 4.351 4.373 -0.022 1 1 117 . 6 1 1 A 26 26 LEU N N 26 114.238 115.333 -1.095 1 1 118 . 6 1 1 A 27 27 THR H H 27 7.708 7.557 0.151 1 1 119 . 6 1 1 A 27 27 THR HA H 27 4.492 4.534 -0.042 1 1 124 . 6 1 1 A 27 27 THR CA C 27 59.438 62.562 -3.124 1 1 125 . 6 1 1 A 27 27 THR CB C 27 68.796 69.707 -0.911 1 1 127 . 6 1 1 A 27 27 THR N N 27 106.430 108.322 -1.892 1 1 128 . 6 1 1 A 28 28 ALA H H 28 8.906 7.461 1.445 1 1 129 . 6 1 1 A 28 28 ALA HA H 28 4.812 4.324 0.488 1 1 133 . 6 1 1 A 28 28 ALA CB C 28 16.724 19.249 -2.525 1 1 134 . 6 1 1 A 28 28 ALA N N 28 128.420 124.345 4.075 1 1 135 . 6 1 1 A 29 29 PRO CA C 29 59.166 62.399 -3.233 1 1 136 . 6 1 1 A 29 29 PRO CB C 29 29.865 33.136 -3.271 1 1 139 . 6 1 1 A 30 30 LEU H H 30 8.204 8.100 0.104 1 1 140 . 6 1 1 A 30 30 LEU HA H 30 4.052 4.536 -0.484 1 1 150 . 6 1 1 A 30 30 LEU N N 30 121.970 116.608 5.362 1 1 151 . 6 1 1 A 31 31 ASP H H 31 8.720 8.775 -0.055 1 1 152 . 6 1 1 A 31 31 ASP HA H 31 4.772 4.179 0.593 1 1 155 . 6 1 1 A 31 31 ASP CA C 31 50.115 57.476 -7.361 1 1 156 . 6 1 1 A 31 31 ASP N N 31 125.105 118.837 6.268 1 1 157 . 6 1 1 A 32 32 HIS CA C 32 55.083 56.279 -1.196 1 1 158 . 6 1 1 A 32 32 HIS CB C 32 25.707 32.001 -6.294 1 1 159 . 6 1 1 A 33 33 LYS H H 33 8.589 7.791 0.798 1 1 160 . 6 1 1 A 33 33 LYS HA H 33 4.112 4.499 -0.387 1 1 167 . 6 1 1 A 33 33 LYS CB C 33 29.218 33.354 -4.136 1 1 169 . 6 1 1 A 33 33 LYS N N 33 118.920 118.860 0.060 1 1 170 . 6 1 1 A 34 34 ASP H H 34 7.420 8.017 -0.597 1 1 171 . 6 1 1 A 34 34 ASP HA H 34 4.368 4.523 -0.155 1 1 174 . 6 1 1 A 34 34 ASP N N 34 120.940 119.663 1.277 1 1 175 . 6 1 1 A 35 35 LYS H H 35 8.266 8.533 -0.267 1 1 176 . 6 1 1 A 35 35 LYS HA H 35 4.169 4.120 0.049 1 1 183 . 6 1 1 A 35 35 LYS N N 35 121.280 124.700 -3.420 1 1 184 . 6 1 1 A 36 36 GLY H H 36 8.716 7.467 1.249 1 1 185 . 6 1 1 A 36 36 GLY HA2 H 36 3.822 4.105 -0.283 1 1 186 . 6 1 1 A 36 36 GLY HA3 H 36 3.618 4.106 -0.488 1 1 187 . 6 1 1 A 36 36 GLY N N 36 111.002 106.404 4.598 1 1 188 . 6 1 1 A 37 37 LEU H H 37 8.032 8.642 -0.610 1 1 189 . 6 1 1 A 37 37 LEU HA H 37 4.406 4.625 -0.219 1 1 198 . 6 1 1 A 37 37 LEU N N 37 127.683 125.015 2.668 1 1 199 . 6 1 1 A 38 38 LYS H H 38 9.190 8.634 0.556 1 1 200 . 6 1 1 A 38 38 LYS HA H 38 3.925 4.509 -0.584 1 1 205 . 6 1 1 A 38 38 LYS N N 38 132.634 117.924 14.710 1 1 206 . 6 1 1 A 39 39 SER H H 39 7.161 7.762 -0.601 1 1 207 . 6 1 1 A 39 39 SER HA H 39 5.097 4.825 0.272 1 1 210 . 6 1 1 A 39 39 SER CA C 39 54.451 57.096 -2.645 1 1 211 . 6 1 1 A 39 39 SER N N 39 110.262 113.264 -3.002 1 1 212 . 6 1 1 A 40 40 LEU H H 40 8.142 9.975 -1.833 1 1 213 . 6 1 1 A 40 40 LEU HA H 40 4.481 4.708 -0.227 1 1 223 . 6 1 1 A 40 40 LEU N N 40 122.761 123.316 -0.555 1 1 224 . 6 1 1 A 41 41 THR H H 41 8.641 8.819 -0.178 1 1 225 . 6 1 1 A 41 41 THR HA H 41 4.141 4.857 -0.716 1 1 230 . 6 1 1 A 41 41 THR CA C 41 60.301 61.746 -1.445 1 1 231 . 6 1 1 A 41 41 THR CB C 41 65.862 69.967 -4.105 1 1 233 . 6 1 1 A 41 41 THR N N 41 124.142 122.363 1.779 1 1 234 . 6 1 1 A 42 42 LEU H H 42 8.586 8.194 0.392 1 1 235 . 6 1 1 A 42 42 LEU HA H 42 4.337 4.737 -0.400 1 1 247 . 6 1 1 A 42 42 LEU N N 42 128.603 124.754 3.849 1 1 248 . 6 1 1 A 43 43 GLU H H 43 8.644 8.565 0.079 1 1 249 . 6 1 1 A 43 43 GLU HA H 43 4.663 4.219 0.444 1 1 253 . 6 1 1 A 43 43 GLU N N 43 124.180 118.326 5.854 1 1 254 . 6 1 1 A 44 44 ASP H H 44 10.243 8.820 1.423 1 1 255 . 6 1 1 A 44 44 ASP HA H 44 4.518 4.694 -0.176 1 1 258 . 6 1 1 A 44 44 ASP CA C 44 52.879 53.361 -0.482 1 1 259 . 6 1 1 A 44 44 ASP CB C 44 37.711 38.809 -1.098 1 1 260 . 6 1 1 A 44 44 ASP N N 44 124.177 120.671 3.506 1 1 261 . 6 1 1 A 45 45 SER H H 45 8.546 8.382 0.164 1 1 262 . 6 1 1 A 45 45 SER HA H 45 3.850 4.080 -0.230 1 1 265 . 6 1 1 A 45 45 SER CA C 45 59.588 61.382 -1.794 1 1 266 . 6 1 1 A 45 45 SER CB C 45 61.660 63.169 -1.509 1 1 267 . 6 1 1 A 45 45 SER N N 45 116.191 117.346 -1.155 1 1 268 . 6 1 1 A 46 46 ILE H H 46 6.902 7.611 -0.709 1 1 269 . 6 1 1 A 46 46 ILE HA H 46 3.874 4.695 -0.821 1 1 279 . 6 1 1 A 46 46 ILE CA C 46 57.605 59.974 -2.369 1 1 280 . 6 1 1 A 46 46 ILE CB C 46 36.694 39.966 -3.272 1 1 283 . 6 1 1 A 46 46 ILE N N 46 116.189 119.361 -3.172 1 1 284 . 6 1 1 A 47 47 SER H H 47 7.804 8.588 -0.784 1 1 285 . 6 1 1 A 47 47 SER HA H 47 4.342 4.854 -0.512 1 1 288 . 6 1 1 A 47 47 SER CA C 47 55.995 57.390 -1.395 1 1 289 . 6 1 1 A 47 47 SER N N 47 118.738 118.161 0.577 1 1 290 . 6 1 1 A 48 48 GLN H H 48 8.522 8.699 -0.177 1 1 291 . 6 1 1 A 48 48 GLN HA H 48 3.939 4.119 -0.180 1 1 296 . 6 1 1 A 48 48 GLN CA C 48 55.111 58.268 -3.157 1 1 298 . 6 1 1 A 48 48 GLN N N 48 119.475 122.006 -2.531 1 1 299 . 6 1 1 A 49 49 ASN H H 49 8.437 8.207 0.230 1 1 300 . 6 1 1 A 49 49 ASN HA H 49 4.693 4.738 -0.045 1 1 305 . 6 1 1 A 49 49 ASN CA C 49 50.839 51.919 -1.080 1 1 306 . 6 1 1 A 49 49 ASN CB C 49 35.767 37.961 -2.194 1 1 307 . 6 1 1 A 49 49 ASN N N 49 117.233 114.168 3.065 1 1 309 . 6 1 1 A 50 50 GLY H H 50 7.952 7.487 0.465 1 1 310 . 6 1 1 A 50 50 GLY HA2 H 50 4.518 4.172 0.346 1 1 311 . 6 1 1 A 50 50 GLY HA3 H 50 4.054 4.181 -0.127 1 1 312 . 6 1 1 A 50 50 GLY CA C 50 41.883 45.471 -3.588 1 1 313 . 6 1 1 A 50 50 GLY N N 50 108.751 107.848 0.903 1 1 314 . 6 1 1 A 51 51 THR H H 51 8.548 8.458 0.090 1 1 315 . 6 1 1 A 51 51 THR HA H 51 5.012 5.379 -0.367 1 1 320 . 6 1 1 A 51 51 THR CA C 51 57.026 60.126 -3.100 1 1 321 . 6 1 1 A 51 51 THR CB C 51 69.887 70.875 -0.988 1 1 323 . 6 1 1 A 51 51 THR N N 51 108.710 116.023 -7.313 1 1 324 . 6 1 1 A 52 52 LEU H H 52 9.110 8.637 0.473 1 1 325 . 6 1 1 A 52 52 LEU HA H 52 5.183 5.096 0.087 1 1 333 . 6 1 1 A 52 52 LEU CA C 52 50.822 53.938 -3.116 1 1 335 . 6 1 1 A 52 52 LEU N N 52 124.606 121.112 3.494 1 1 336 . 6 1 1 A 53 53 THR H H 53 9.312 8.641 0.671 1 1 337 . 6 1 1 A 53 53 THR HA H 53 5.288 5.220 0.068 1 1 342 . 6 1 1 A 53 53 THR CA C 53 59.535 61.135 -1.600 1 1 343 . 6 1 1 A 53 53 THR CB C 53 66.838 72.430 -5.592 1 1 345 . 6 1 1 A 53 53 THR N N 53 125.445 115.183 10.262 1 1 346 . 6 1 1 A 54 54 LEU H H 54 8.992 8.519 0.473 1 1 347 . 6 1 1 A 54 54 LEU HA H 54 5.563 5.651 -0.088 1 1 357 . 6 1 1 A 54 54 LEU N N 54 128.814 119.983 8.831 1 1 358 . 6 1 1 A 55 55 SER H H 55 9.017 9.181 -0.164 1 1 359 . 6 1 1 A 55 55 SER HA H 55 5.476 5.385 0.091 1 1 362 . 6 1 1 A 55 55 SER CA C 55 53.944 55.611 -1.667 1 1 363 . 6 1 1 A 55 55 SER CB C 55 63.384 66.132 -2.748 1 1 364 . 6 1 1 A 55 55 SER N N 55 112.964 117.499 -4.535 1 1 365 . 6 1 1 A 56 56 ALA H H 56 8.324 9.289 -0.965 1 1 366 . 6 1 1 A 56 56 ALA HA H 56 4.605 4.821 -0.216 1 1 370 . 6 1 1 A 56 56 ALA CA C 56 50.743 50.572 0.171 1 1 371 . 6 1 1 A 56 56 ALA CB C 56 21.372 22.185 -0.813 1 1 372 . 6 1 1 A 56 56 ALA N N 56 123.555 123.056 0.499 1 1 373 . 6 1 1 A 57 57 GLN H H 57 9.080 8.563 0.517 1 1 374 . 6 1 1 A 57 57 GLN HA H 57 3.884 4.428 -0.544 1 1 381 . 6 1 1 A 57 57 GLN CA C 57 53.331 55.208 -1.877 1 1 382 . 6 1 1 A 57 57 GLN CB C 57 24.659 27.712 -3.053 1 1 384 . 6 1 1 A 57 57 GLN N N 57 116.815 117.365 -0.550 1 1 386 . 6 1 1 A 58 58 GLY H H 58 8.527 7.938 0.589 1 1 387 . 6 1 1 A 58 58 GLY HA2 H 58 4.168 4.003 0.165 1 1 388 . 6 1 1 A 58 58 GLY HA3 H 58 3.608 4.005 -0.397 1 1 389 . 6 1 1 A 58 58 GLY CA C 58 42.856 45.595 -2.739 1 1 390 . 6 1 1 A 58 58 GLY N N 58 105.983 107.143 -1.160 1 1 391 . 6 1 1 A 59 59 ALA H H 59 8.203 7.720 0.483 1 1 392 . 6 1 1 A 59 59 ALA HA H 59 4.811 4.596 0.215 1 1 396 . 6 1 1 A 59 59 ALA CA C 59 47.662 51.421 -3.759 1 1 397 . 6 1 1 A 59 59 ALA CB C 59 20.147 22.743 -2.596 1 1 398 . 6 1 1 A 59 59 ALA N N 59 125.153 121.661 3.492 1 1 399 . 6 1 1 A 60 60 GLU H H 60 8.154 8.840 -0.686 1 1 400 . 6 1 1 A 60 60 GLU HA H 60 5.508 5.531 -0.023 1 1 404 . 6 1 1 A 60 60 GLU CA C 60 52.179 54.679 -2.500 1 1 405 . 6 1 1 A 60 60 GLU CB C 60 30.203 33.394 -3.191 1 1 406 . 6 1 1 A 60 60 GLU N N 60 117.318 116.912 0.406 1 1 407 . 6 1 1 A 61 61 LYS H H 61 8.821 9.040 -0.219 1 1 408 . 6 1 1 A 61 61 LYS HA H 61 4.311 4.953 -0.642 1 1 413 . 6 1 1 A 61 61 LYS N N 61 123.743 123.315 0.428 1 1 414 . 6 1 1 A 62 62 THR H H 62 8.149 8.688 -0.539 1 1 415 . 6 1 1 A 62 62 THR HA H 62 4.928 4.672 0.256 1 1 420 . 6 1 1 A 62 62 THR CA C 62 59.427 62.784 -3.357 1 1 421 . 6 1 1 A 62 62 THR CB C 62 66.932 68.914 -1.982 1 1 422 . 6 1 1 A 62 62 THR N N 62 122.829 121.734 1.095 1 1 423 . 6 1 1 A 63 63 TYR H H 63 9.466 9.126 0.340 1 1 424 . 6 1 1 A 63 63 TYR HA H 63 4.606 5.085 -0.479 1 1 431 . 6 1 1 A 63 63 TYR CA C 63 54.508 56.994 -2.486 1 1 432 . 6 1 1 A 63 63 TYR N N 63 127.472 129.878 -2.406 1 1 433 . 6 1 1 A 64 64 GLY H H 64 9.253 8.423 0.830 1 1 434 . 6 1 1 A 64 64 GLY HA2 H 64 4.670 4.165 0.505 1 1 435 . 6 1 1 A 64 64 GLY HA3 H 64 3.619 4.176 -0.557 1 1 436 . 6 1 1 A 64 64 GLY CA C 64 39.885 44.334 -4.449 1 1 437 . 6 1 1 A 64 64 GLY N N 64 110.182 111.841 -1.659 1 1 438 . 6 1 1 A 65 65 ASN H H 65 8.616 8.470 0.146 1 1 439 . 6 1 1 A 65 65 ASN HA H 65 4.109 4.366 -0.257 1 1 444 . 6 1 1 A 65 65 ASN CA C 65 53.691 54.776 -1.085 1 1 445 . 6 1 1 A 65 65 ASN N N 65 117.778 118.864 -1.086 1 1 447 . 6 1 1 A 66 66 GLY H H 66 9.053 8.770 0.283 1 1 448 . 6 1 1 A 66 66 GLY HA2 H 66 4.344 3.888 0.456 1 1 449 . 6 1 1 A 66 66 GLY HA3 H 66 3.359 3.901 -0.542 1 1 450 . 6 1 1 A 66 66 GLY CA C 66 42.431 44.850 -2.419 1 1 451 . 6 1 1 A 66 66 GLY N N 66 115.232 114.626 0.606 1 1 452 . 6 1 1 A 67 67 ASP H H 67 8.120 8.826 -0.706 1 1 453 . 6 1 1 A 67 67 ASP HA H 67 4.844 3.422 1.422 1 1 456 . 6 1 1 A 67 67 ASP N N 67 122.593 121.025 1.568 1 1 457 . 6 1 1 A 68 68 SER H H 68 8.500 8.509 -0.009 1 1 458 . 6 1 1 A 68 68 SER HA H 68 5.088 4.896 0.192 1 1 461 . 6 1 1 A 68 68 SER CA C 68 54.858 58.540 -3.682 1 1 462 . 6 1 1 A 68 68 SER CB C 68 62.114 64.246 -2.132 1 1 463 . 6 1 1 A 68 68 SER N N 68 113.557 120.751 -7.194 1 1 464 . 6 1 1 A 69 69 LEU H H 69 8.989 9.325 -0.336 1 1 465 . 6 1 1 A 69 69 LEU HA H 69 4.570 4.954 -0.384 1 1 474 . 6 1 1 A 69 69 LEU N N 69 126.836 126.754 0.082 1 1 475 . 6 1 1 A 70 70 ASN H H 70 8.491 8.418 0.073 1 1 476 . 6 1 1 A 70 70 ASN HA H 70 4.958 4.732 0.226 1 1 479 . 6 1 1 A 70 70 ASN CB C 70 33.265 36.534 -3.269 1 1 480 . 6 1 1 A 70 70 ASN N N 70 126.343 123.026 3.317 1 1 481 . 6 1 1 A 71 71 THR H H 71 7.831 8.720 -0.889 1 1 482 . 6 1 1 A 71 71 THR HA H 71 3.759 4.734 -0.975 1 1 487 . 6 1 1 A 71 71 THR CA C 71 61.005 60.272 0.733 1 1 488 . 6 1 1 A 71 71 THR N N 71 114.742 113.380 1.362 1 1 489 . 6 1 1 A 72 72 GLY H H 72 8.880 8.430 0.450 1 1 490 . 6 1 1 A 72 72 GLY HA2 H 72 3.907 3.881 0.026 1 1 491 . 6 1 1 A 72 72 GLY HA3 H 72 3.907 3.884 0.023 1 1 492 . 6 1 1 A 72 72 GLY N N 72 114.976 111.116 3.860 1 1 493 . 6 1 1 A 73 73 LYS H H 73 6.604 8.148 -1.544 1 1 494 . 6 1 1 A 73 73 LYS HA H 73 4.160 4.569 -0.409 1 1 501 . 6 1 1 A 73 73 LYS N N 73 113.898 118.135 -4.237 1 1 502 . 6 1 1 A 74 74 LEU H H 74 7.422 8.428 -1.006 1 1 503 . 6 1 1 A 74 74 LEU HA H 74 4.358 4.452 -0.094 1 1 513 . 6 1 1 A 74 74 LEU N N 74 117.180 122.812 -5.632 1 1 514 . 6 1 1 A 75 75 LYS H H 75 8.617 8.333 0.284 1 1 515 . 6 1 1 A 75 75 LYS HA H 75 4.079 4.753 -0.674 1 1 518 . 6 1 1 A 75 75 LYS N N 75 121.119 118.540 2.579 1 1 519 . 6 1 1 A 76 76 ASN H H 76 8.154 8.980 -0.826 1 1 520 . 6 1 1 A 76 76 ASN HA H 76 3.935 5.053 -1.118 1 1 525 . 6 1 1 A 76 76 ASN CB C 76 35.772 37.451 -1.679 1 1 526 . 6 1 1 A 76 76 ASN N N 76 122.761 118.898 3.863 1 1 527 . 6 1 1 A 77 77 ASP H H 77 9.227 8.063 1.164 1 1 528 . 6 1 1 A 77 77 ASP HA H 77 3.787 5.020 -1.233 1 1 531 . 6 1 1 A 77 77 ASP CA C 77 52.584 53.047 -0.463 1 1 532 . 6 1 1 A 77 77 ASP N N 77 114.129 118.703 -4.574 1 1 533 . 6 1 1 A 78 78 LYS H H 78 6.579 7.847 -1.268 1 1 534 . 6 1 1 A 78 78 LYS HA H 78 4.572 4.867 -0.295 1 1 539 . 6 1 1 A 78 78 LYS CA C 78 51.072 54.810 -3.738 1 1 540 . 6 1 1 A 78 78 LYS CB C 78 33.783 34.713 -0.930 1 1 541 . 6 1 1 A 78 78 LYS N N 78 114.135 121.117 -6.982 1 1 542 . 6 1 1 A 79 79 VAL H H 79 8.729 8.347 0.382 1 1 543 . 6 1 1 A 79 79 VAL HA H 79 4.402 4.300 0.102 1 1 551 . 6 1 1 A 79 79 VAL CA C 79 59.240 59.902 -0.662 1 1 553 . 6 1 1 A 79 79 VAL N N 79 123.191 126.047 -2.856 1 1 554 . 6 1 1 A 80 80 SER H H 80 9.542 9.187 0.355 1 1 555 . 6 1 1 A 80 80 SER HA H 80 4.636 5.177 -0.541 1 1 558 . 6 1 1 A 80 80 SER CA C 80 55.978 57.587 -1.609 1 1 559 . 6 1 1 A 80 80 SER N N 80 127.445 120.868 6.577 1 1 560 . 6 1 1 A 81 81 ARG H H 81 8.093 8.553 -0.460 1 1 561 . 6 1 1 A 81 81 ARG HA H 81 5.210 5.259 -0.049 1 1 569 . 6 1 1 A 81 81 ARG N N 81 123.743 124.104 -0.361 1 1 571 . 6 1 1 A 82 82 PHE H H 82 9.312 7.902 1.410 1 1 572 . 6 1 1 A 82 82 PHE HA H 82 4.951 5.018 -0.067 1 1 577 . 6 1 1 A 82 82 PHE CA C 82 53.090 56.599 -3.509 1 1 578 . 6 1 1 A 82 82 PHE N N 82 119.529 117.056 2.473 1 1 579 . 6 1 1 A 83 83 ASP H H 83 9.122 8.790 0.332 1 1 580 . 6 1 1 A 83 83 ASP HA H 83 5.593 5.159 0.434 1 1 583 . 6 1 1 A 83 83 ASP N N 83 123.825 120.236 3.589 1 1 584 . 6 1 1 A 84 84 PHE H H 84 9.090 8.273 0.817 1 1 585 . 6 1 1 A 84 84 PHE HA H 84 6.410 6.187 0.223 1 1 592 . 6 1 1 A 84 84 PHE CA C 84 52.584 55.983 -3.399 1 1 593 . 6 1 1 A 84 84 PHE N N 84 118.862 118.239 0.623 1 1 594 . 6 1 1 A 85 85 ILE H H 85 8.441 8.936 -0.495 1 1 595 . 6 1 1 A 85 85 ILE HA H 85 4.662 4.773 -0.111 1 1 605 . 6 1 1 A 85 85 ILE CB C 85 39.939 38.697 1.242 1 1 608 . 6 1 1 A 85 85 ILE N N 85 118.049 120.522 -2.473 1 1 609 . 6 1 1 A 86 86 ARG H H 86 8.983 8.744 0.239 1 1 610 . 6 1 1 A 86 86 ARG HA H 86 5.591 4.715 0.876 1 1 616 . 6 1 1 A 86 86 ARG N N 86 127.006 127.147 -0.141 1 1 618 . 6 1 1 A 87 87 GLN H H 87 8.643 8.600 0.043 1 1 619 . 6 1 1 A 87 87 GLN HA H 87 5.630 5.078 0.552 1 1 626 . 6 1 1 A 87 87 GLN CA C 87 51.512 54.382 -2.870 1 1 627 . 6 1 1 A 87 87 GLN N N 87 124.142 122.690 1.452 1 1 629 . 6 1 1 A 88 88 ILE H H 88 8.617 8.503 0.114 1 1 630 . 6 1 1 A 88 88 ILE HA H 88 4.690 4.863 -0.173 1 1 637 . 6 1 1 A 88 88 ILE CA C 88 56.995 60.752 -3.757 1 1 638 . 6 1 1 A 88 88 ILE CB C 88 39.927 40.285 -0.358 1 1 641 . 6 1 1 A 88 88 ILE N N 88 116.353 121.448 -5.095 1 1 642 . 6 1 1 A 89 89 GLU H H 89 8.298 9.026 -0.728 1 1 643 . 6 1 1 A 89 89 GLU HA H 89 5.100 5.858 -0.758 1 1 646 . 6 1 1 A 89 89 GLU CA C 89 52.204 54.855 -2.651 1 1 647 . 6 1 1 A 89 89 GLU CB C 89 27.325 33.142 -5.817 1 1 648 . 6 1 1 A 89 89 GLU N N 89 124.458 129.088 -4.630 1 1 649 . 6 1 1 A 90 90 VAL H H 90 8.957 8.846 0.111 1 1 650 . 6 1 1 A 90 90 VAL HA H 90 4.169 4.673 -0.504 1 1 658 . 6 1 1 A 90 90 VAL CA C 90 58.664 59.884 -1.220 1 1 659 . 6 1 1 A 90 90 VAL CB C 90 31.861 34.029 -2.168 1 1 660 . 6 1 1 A 90 90 VAL N N 90 127.580 126.305 1.275 1 1 661 . 6 1 1 A 91 91 ASP H H 91 9.369 8.561 0.808 1 1 662 . 6 1 1 A 91 91 ASP HA H 91 4.287 4.575 -0.288 1 1 665 . 6 1 1 A 91 91 ASP CA C 91 52.389 54.878 -2.489 1 1 666 . 6 1 1 A 91 91 ASP CB C 91 36.409 40.387 -3.978 1 1 667 . 6 1 1 A 91 91 ASP N N 91 129.411 123.656 5.755 1 1 668 . 6 1 1 A 92 92 GLY H H 92 8.552 7.471 1.081 1 1 669 . 6 1 1 A 92 92 GLY HA2 H 92 4.090 4.094 -0.004 1 1 670 . 6 1 1 A 92 92 GLY HA3 H 92 3.618 4.095 -0.477 1 1 671 . 6 1 1 A 92 92 GLY CA C 92 42.836 45.592 -2.756 1 1 672 . 6 1 1 A 92 92 GLY N N 92 103.862 105.526 -1.664 1 1 673 . 6 1 1 A 93 93 GLN H H 93 7.808 7.620 0.188 1 1 674 . 6 1 1 A 93 93 GLN HA H 93 4.578 4.837 -0.259 1 1 679 . 6 1 1 A 93 93 GLN CA C 93 50.918 54.305 -3.387 1 1 680 . 6 1 1 A 93 93 GLN CB C 93 28.602 31.186 -2.584 1 1 682 . 6 1 1 A 93 93 GLN N N 93 120.412 118.749 1.663 1 1 683 . 6 1 1 A 94 94 LEU H H 94 8.414 8.479 -0.065 1 1 684 . 6 1 1 A 94 94 LEU HA H 94 4.704 4.247 0.457 1 1 693 . 6 1 1 A 94 94 LEU CB C 94 39.873 42.435 -2.562 1 1 696 . 6 1 1 A 94 94 LEU N N 94 125.061 122.368 2.693 1 1 697 . 6 1 1 A 95 95 ILE H H 95 9.181 8.683 0.498 1 1 698 . 6 1 1 A 95 95 ILE HA H 95 4.371 4.900 -0.529 1 1 708 . 6 1 1 A 95 95 ILE CA C 95 63.319 60.946 2.373 1 1 709 . 6 1 1 A 95 95 ILE CB C 95 37.407 39.694 -2.287 1 1 711 . 6 1 1 A 95 95 ILE N N 95 127.724 121.787 5.937 1 1 712 . 6 1 1 A 96 96 THR H H 96 8.730 7.399 1.331 1 1 713 . 6 1 1 A 96 96 THR HA H 96 4.411 4.412 -0.001 1 1 718 . 6 1 1 A 96 96 THR CA C 96 60.344 63.017 -2.673 1 1 719 . 6 1 1 A 96 96 THR CB C 96 59.719 69.720 -10.001 1 1 720 . 6 1 1 A 96 96 THR N N 96 124.240 118.840 5.400 1 1 721 . 6 1 1 A 97 97 LEU H H 97 8.790 8.870 -0.080 1 1 722 . 6 1 1 A 97 97 LEU HA H 97 4.400 5.025 -0.625 1 1 732 . 6 1 1 A 97 97 LEU N N 97 126.147 124.799 1.348 1 1 733 . 6 1 1 A 98 98 GLU H H 98 7.596 9.131 -1.535 1 1 734 . 6 1 1 A 98 98 GLU HA H 98 5.102 5.080 0.022 1 1 739 . 6 1 1 A 98 98 GLU N N 98 116.937 123.497 -6.560 1 1 740 . 6 1 1 A 99 99 SER H H 99 8.906 8.528 0.378 1 1 741 . 6 1 1 A 99 99 SER HA H 99 4.504 5.301 -0.797 1 1 744 . 6 1 1 A 99 99 SER CA C 99 54.010 57.306 -3.296 1 1 745 . 6 1 1 A 99 99 SER CB C 99 63.876 67.221 -3.345 1 1 746 . 6 1 1 A 99 99 SER N N 99 117.823 116.164 1.659 1 1 747 . 6 1 1 A 100 100 GLY H H 100 7.250 7.803 -0.553 1 1 748 . 6 1 1 A 100 100 GLY HA2 H 100 4.872 3.965 0.907 1 1 749 . 6 1 1 A 100 100 GLY HA3 H 100 3.731 4.037 -0.306 1 1 750 . 6 1 1 A 100 100 GLY N N 100 109.436 109.031 0.405 1 1 751 . 6 1 1 A 101 101 GLU H H 101 9.661 9.220 0.441 1 1 752 . 6 1 1 A 101 101 GLU HA H 101 5.643 4.807 0.836 1 1 757 . 6 1 1 A 101 101 GLU CA C 101 52.584 54.743 -2.159 1 1 758 . 6 1 1 A 101 101 GLU CB C 101 31.750 32.406 -0.656 1 1 759 . 6 1 1 A 101 101 GLU N N 101 126.793 120.783 6.010 1 1 760 . 6 1 1 A 102 102 PHE H H 102 10.441 8.489 1.952 1 1 761 . 6 1 1 A 102 102 PHE HA H 102 5.248 5.271 -0.023 1 1 768 . 6 1 1 A 102 102 PHE CA C 102 53.537 56.408 -2.871 1 1 769 . 6 1 1 A 102 102 PHE N N 102 131.837 123.211 8.626 1 1 770 . 6 1 1 A 103 103 GLN H H 103 9.135 9.120 0.015 1 1 771 . 6 1 1 A 103 103 GLN HA H 103 5.205 5.131 0.074 1 1 776 . 6 1 1 A 103 103 GLN CA C 103 50.925 54.488 -3.563 1 1 777 . 6 1 1 A 103 103 GLN N N 103 127.720 125.597 2.123 1 1 778 . 6 1 1 A 104 104 VAL H H 104 8.937 8.581 0.356 1 1 779 . 6 1 1 A 104 104 VAL HA H 104 4.780 4.595 0.185 1 1 787 . 6 1 1 A 104 104 VAL CA C 104 57.086 61.805 -4.719 1 1 789 . 6 1 1 A 104 104 VAL N N 104 120.097 123.619 -3.522 1 1 790 . 6 1 1 A 105 105 TYR H H 105 9.108 9.877 -0.769 1 1 791 . 6 1 1 A 105 105 TYR HA H 105 4.834 5.075 -0.241 1 1 798 . 6 1 1 A 105 105 TYR CA C 105 54.486 57.115 -2.629 1 1 799 . 6 1 1 A 105 105 TYR N N 105 128.426 126.583 1.843 1 1 800 . 6 1 1 A 106 106 LYS H H 106 5.945 8.390 -2.445 1 1 805 . 6 1 1 A 106 106 LYS N N 106 129.163 121.877 7.286 1 1 806 . 6 1 1 A 107 107 GLN H H 107 8.526 8.391 0.135 1 1 807 . 6 1 1 A 107 107 GLN HA H 107 5.160 5.428 -0.268 1 1 812 . 6 1 1 A 107 107 GLN CA C 107 52.584 54.042 -1.458 1 1 813 . 6 1 1 A 107 107 GLN CB C 107 26.175 29.155 -2.980 1 1 814 . 6 1 1 A 107 107 GLN N N 107 125.978 123.325 2.653 1 1 815 . 6 1 1 A 108 108 SER H H 108 8.621 8.816 -0.195 1 1 816 . 6 1 1 A 108 108 SER HA H 108 4.403 4.310 0.093 1 1 819 . 6 1 1 A 108 108 SER CA C 108 58.521 59.861 -1.340 1 1 820 . 6 1 1 A 108 108 SER CB C 108 60.737 64.169 -3.432 1 1 821 . 6 1 1 A 108 108 SER N N 108 117.542 115.213 2.329 1 1 822 . 6 1 1 A 109 109 HIS H H 109 10.381 7.908 2.473 1 1 823 . 6 1 1 A 109 109 HIS HA H 109 4.594 4.827 -0.233 1 1 828 . 6 1 1 A 109 109 HIS CA C 109 51.743 55.843 -4.100 1 1 829 . 6 1 1 A 109 109 HIS CB C 109 27.174 30.711 -3.537 1 1 830 . 6 1 1 A 109 109 HIS N N 109 118.449 117.443 1.006 1 1 831 . 6 1 1 A 110 110 SER H H 110 7.366 7.795 -0.429 1 1 832 . 6 1 1 A 110 110 SER HA H 110 4.870 4.643 0.227 1 1 835 . 6 1 1 A 110 110 SER CB C 110 62.986 64.294 -1.308 1 1 836 . 6 1 1 A 110 110 SER N N 110 113.397 113.563 -0.166 1 1 837 . 6 1 1 A 111 111 ALA H H 111 8.541 8.584 -0.043 1 1 838 . 6 1 1 A 111 111 ALA HA H 111 4.826 5.356 -0.530 1 1 842 . 6 1 1 A 111 111 ALA CA C 111 49.015 51.847 -2.832 1 1 843 . 6 1 1 A 111 111 ALA CB C 111 20.256 23.160 -2.904 1 1 844 . 6 1 1 A 111 111 ALA N N 111 117.786 123.665 -5.879 1 1 845 . 6 1 1 A 112 112 LEU H H 112 8.529 9.190 -0.661 1 1 846 . 6 1 1 A 112 112 LEU HA H 112 5.680 5.267 0.413 1 1 855 . 6 1 1 A 112 112 LEU CA C 112 51.818 53.444 -1.626 1 1 856 . 6 1 1 A 112 112 LEU N N 112 116.345 119.183 -2.838 1 1 857 . 6 1 1 A 113 113 THR H H 113 8.758 8.859 -0.101 1 1 858 . 6 1 1 A 113 113 THR HA H 113 5.563 5.610 -0.047 1 1 863 . 6 1 1 A 113 113 THR CA C 113 54.458 59.349 -4.891 1 1 864 . 6 1 1 A 113 113 THR CB C 113 68.586 71.816 -3.230 1 1 866 . 6 1 1 A 113 113 THR N N 113 110.469 119.560 -9.091 1 1 867 . 6 1 1 A 114 114 ALA H H 114 8.829 9.975 -1.146 1 1 868 . 6 1 1 A 114 114 ALA HA H 114 4.466 5.025 -0.559 1 1 872 . 6 1 1 A 114 114 ALA CA C 114 48.886 51.865 -2.979 1 1 873 . 6 1 1 A 114 114 ALA CB C 114 21.583 21.955 -0.372 1 1 874 . 6 1 1 A 114 114 ALA N N 114 121.456 125.576 -4.120 1 1 875 . 6 1 1 A 115 115 LEU H H 115 8.407 9.995 -1.588 1 1 876 . 6 1 1 A 115 115 LEU HA H 115 4.814 4.728 0.086 1 1 886 . 6 1 1 A 115 115 LEU N N 115 119.223 124.113 -4.890 1 1 887 . 6 1 1 A 116 116 GLN H H 116 9.720 8.206 1.514 1 1 888 . 6 1 1 A 116 116 GLN HA H 116 5.312 4.800 0.512 1 1 893 . 6 1 1 A 116 116 GLN CA C 116 50.544 55.257 -4.713 1 1 894 . 6 1 1 A 116 116 GLN N N 116 127.827 122.205 5.622 1 1 895 . 6 1 1 A 117 117 THR H H 117 9.663 9.383 0.280 1 1 896 . 6 1 1 A 117 117 THR HA H 117 4.198 4.618 -0.420 1 1 901 . 6 1 1 A 117 117 THR CA C 117 64.037 61.332 2.705 1 1 902 . 6 1 1 A 117 117 THR CB C 117 66.868 69.765 -2.897 1 1 904 . 6 1 1 A 117 117 THR N N 117 128.929 122.899 6.030 1 1 905 . 6 1 1 A 118 118 GLU H H 118 9.486 8.470 1.016 1 1 906 . 6 1 1 A 118 118 GLU HA H 118 4.885 4.627 0.258 1 1 911 . 6 1 1 A 118 118 GLU N N 118 123.497 119.295 4.202 1 1 912 . 6 1 1 A 119 119 GLN H H 119 8.076 7.509 0.567 1 1 913 . 6 1 1 A 119 119 GLN HA H 119 5.331 4.834 0.497 1 1 916 . 6 1 1 A 119 119 GLN CA C 119 51.858 54.087 -2.229 1 1 917 . 6 1 1 A 119 119 GLN N N 119 118.023 119.673 -1.650 1 1 918 . 6 1 1 A 120 120 GLU H H 120 9.078 8.739 0.339 1 1 919 . 6 1 1 A 120 120 GLU HA H 120 5.071 4.865 0.206 1 1 924 . 6 1 1 A 120 120 GLU N N 120 118.433 123.888 -5.455 1 1 925 . 6 1 1 A 121 121 GLN H H 121 7.711 8.755 -1.044 1 1 926 . 6 1 1 A 121 121 GLN HA H 121 4.430 5.207 -0.777 1 1 933 . 6 1 1 A 121 121 GLN CA C 121 53.996 53.976 0.020 1 1 934 . 6 1 1 A 121 121 GLN CB C 121 27.158 32.309 -5.151 1 1 936 . 6 1 1 A 121 121 GLN N N 121 122.412 117.919 4.493 1 1 938 . 6 1 1 A 122 122 ASP H H 122 8.675 8.315 0.360 1 1 939 . 6 1 1 A 122 122 ASP HA H 122 4.632 5.060 -0.428 1 1 942 . 6 1 1 A 122 122 ASP CA C 122 48.797 51.239 -2.442 1 1 943 . 6 1 1 A 122 122 ASP CB C 122 39.852 42.445 -2.593 1 1 944 . 6 1 1 A 122 122 ASP N N 122 128.625 121.899 6.726 1 1 945 . 6 1 1 A 123 123 PRO CA C 123 61.579 65.663 -4.084 1 1 946 . 6 1 1 A 123 123 PRO CB C 123 29.597 31.456 -1.859 1 1 948 . 6 1 1 A 124 124 GLU H H 124 8.297 8.326 -0.029 1 1 949 . 6 1 1 A 124 124 GLU HA H 124 4.196 3.792 0.404 1 1 954 . 6 1 1 A 124 124 GLU CA C 124 53.025 59.092 -6.067 1 1 955 . 6 1 1 A 124 124 GLU CB C 124 27.927 28.935 -1.008 1 1 957 . 6 1 1 A 124 124 GLU N N 124 115.538 117.597 -2.059 1 1 958 . 6 1 1 A 125 125 HIS H H 125 7.419 7.701 -0.282 1 1 959 . 6 1 1 A 125 125 HIS HA H 125 4.833 4.979 -0.146 1 1 964 . 6 1 1 A 125 125 HIS CA C 125 51.886 54.205 -2.319 1 1 965 . 6 1 1 A 125 125 HIS CB C 125 26.387 29.358 -2.971 1 1 966 . 6 1 1 A 125 125 HIS N N 125 117.464 115.302 2.162 1 1 967 . 6 1 1 A 126 126 SER H H 126 8.441 8.429 0.012 1 1 968 . 6 1 1 A 126 126 SER HA H 126 4.261 4.816 -0.555 1 1 971 . 6 1 1 A 126 126 SER CA C 126 57.988 61.928 -3.940 1 1 972 . 6 1 1 A 126 126 SER N N 126 117.954 117.554 0.400 1 1 973 . 6 1 1 A 127 127 GLU H H 127 9.221 8.471 0.750 1 1 974 . 6 1 1 A 127 127 GLU HA H 127 4.366 4.258 0.108 1 1 979 . 6 1 1 A 127 127 GLU CA C 127 53.707 57.165 -3.458 1 1 980 . 6 1 1 A 127 127 GLU CB C 127 25.492 28.667 -3.175 1 1 981 . 6 1 1 A 127 127 GLU N N 127 120.404 117.791 2.613 1 1 982 . 6 1 1 A 128 128 LYS H H 128 8.262 9.311 -1.049 1 1 983 . 6 1 1 A 128 128 LYS HA H 128 4.661 4.481 0.180 1 1 990 . 6 1 1 A 128 128 LYS CA C 128 52.264 56.075 -3.811 1 1 991 . 6 1 1 A 128 128 LYS CB C 128 32.404 33.818 -1.414 1 1 994 . 6 1 1 A 128 128 LYS N N 128 122.166 121.009 1.157 1 1 995 . 6 1 1 A 129 129 MET H H 129 8.242 8.771 -0.529 1 1 996 . 6 1 1 A 129 129 MET HA H 129 5.012 5.529 -0.517 1 1 1001 . 6 1 1 A 129 129 MET CA C 129 50.958 54.645 -3.687 1 1 1003 . 6 1 1 A 129 129 MET N N 129 119.422 118.605 0.817 1 1 1004 . 6 1 1 A 130 130 VAL H H 130 9.200 9.088 0.112 1 1 1005 . 6 1 1 A 130 130 VAL HA H 130 4.609 4.731 -0.122 1 1 1013 . 6 1 1 A 130 130 VAL CA C 130 56.296 60.929 -4.633 1 1 1014 . 6 1 1 A 130 130 VAL CB C 130 32.606 32.457 0.149 1 1 1015 . 6 1 1 A 130 130 VAL N N 130 118.290 124.603 -6.313 1 1 1016 . 6 1 1 A 131 131 ALA H H 131 8.368 8.660 -0.292 1 1 1017 . 6 1 1 A 131 131 ALA HA H 131 4.654 5.183 -0.529 1 1 1021 . 6 1 1 A 131 131 ALA CA C 131 49.739 50.500 -0.761 1 1 1022 . 6 1 1 A 131 131 ALA CB C 131 15.351 21.055 -5.704 1 1 1023 . 6 1 1 A 131 131 ALA N N 131 126.734 124.367 2.367 1 1 1024 . 6 1 1 A 132 132 LYS H H 132 7.732 8.614 -0.882 1 1 1025 . 6 1 1 A 132 132 LYS HA H 132 4.171 4.824 -0.653 1 1 1028 . 6 1 1 A 132 132 LYS N N 132 127.309 122.232 5.077 1 1 1029 . 6 1 1 A 133 133 ARG H H 133 8.193 8.536 -0.343 1 1 1030 . 6 1 1 A 133 133 ARG HA H 133 5.073 5.064 0.009 1 1 1038 . 6 1 1 A 133 133 ARG N N 133 122.190 121.881 0.309 1 1 1040 . 6 1 1 A 134 134 ARG H H 134 7.539 8.863 -1.324 1 1 1041 . 6 1 1 A 134 134 ARG HA H 134 4.667 4.909 -0.242 1 1 1049 . 6 1 1 A 134 134 ARG CA C 134 52.584 55.084 -2.500 1 1 1050 . 6 1 1 A 134 134 ARG CB C 134 31.325 33.335 -2.010 1 1 1052 . 6 1 1 A 134 134 ARG N N 134 121.632 125.054 -3.422 1 1 1054 . 6 1 1 A 135 135 PHE H H 135 8.816 8.469 0.347 1 1 1055 . 6 1 1 A 135 135 PHE HA H 135 5.680 5.640 0.040 1 1 1062 . 6 1 1 A 135 135 PHE N N 135 125.107 121.705 3.402 1 1 1063 . 6 1 1 A 136 136 ARG H H 136 7.741 9.277 -1.536 1 1 1064 . 6 1 1 A 136 136 ARG HA H 136 4.402 4.662 -0.260 1 1 1068 . 6 1 1 A 136 136 ARG N N 136 125.640 121.588 4.052 1 1 1070 . 6 1 1 A 137 137 ILE H H 137 8.556 8.968 -0.412 1 1 1071 . 6 1 1 A 137 137 ILE HA H 137 3.912 4.540 -0.628 1 1 1076 . 6 1 1 A 137 137 ILE CA C 137 55.676 61.315 -5.639 1 1 1079 . 6 1 1 A 137 137 ILE N N 137 122.891 128.004 -5.113 1 1 1080 . 6 1 1 A 138 138 GLY H H 138 8.676 8.612 0.064 1 1 1081 . 6 1 1 A 138 138 GLY HA2 H 138 3.740 4.247 -0.507 1 1 1082 . 6 1 1 A 138 138 GLY HA3 H 138 2.982 4.260 -1.278 1 1 1083 . 6 1 1 A 138 138 GLY CA C 138 41.908 45.818 -3.910 1 1 1084 . 6 1 1 A 138 138 GLY N N 138 117.058 116.594 0.464 1 1 1085 . 6 1 1 A 139 139 ASP H H 139 7.858 7.958 -0.100 1 1 1086 . 6 1 1 A 139 139 ASP HA H 139 4.753 4.872 -0.119 1 1 1089 . 6 1 1 A 139 139 ASP CA C 139 52.584 53.523 -0.939 1 1 1090 . 6 1 1 A 139 139 ASP CB C 139 43.062 39.783 3.279 1 1 1091 . 6 1 1 A 139 139 ASP N N 139 124.516 118.796 5.720 1 1 1092 . 6 1 1 A 140 140 ILE H H 140 8.354 8.240 0.114 1 1 1093 . 6 1 1 A 140 140 ILE HA H 140 4.473 4.471 0.002 1 1 1103 . 6 1 1 A 140 140 ILE CB C 140 36.173 39.553 -3.380 1 1 1105 . 6 1 1 A 140 140 ILE N N 140 120.679 120.748 -0.069 1 1 1106 . 6 1 1 A 141 141 ALA H H 141 8.708 7.841 0.867 1 1 1107 . 6 1 1 A 141 141 ALA HA H 141 4.862 4.682 0.180 1 1 1111 . 6 1 1 A 141 141 ALA CA C 141 47.968 51.591 -3.623 1 1 1112 . 6 1 1 A 141 141 ALA CB C 141 21.733 21.434 0.299 1 1 1113 . 6 1 1 A 141 141 ALA N N 141 130.144 122.122 8.022 1 1 1114 . 6 1 1 A 142 142 GLY H H 142 7.888 9.026 -1.138 1 1 1115 . 6 1 1 A 142 142 GLY HA2 H 142 4.519 3.952 0.567 1 1 1116 . 6 1 1 A 142 142 GLY HA3 H 142 3.634 3.969 -0.335 1 1 1117 . 6 1 1 A 142 142 GLY N N 142 102.272 108.482 -6.210 1 1 1118 . 6 1 1 A 143 143 GLU H H 143 8.068 9.750 -1.682 1 1 1119 . 6 1 1 A 143 143 GLU HA H 143 4.577 4.235 0.342 1 1 1124 . 6 1 1 A 143 143 GLU N N 143 120.569 120.039 0.530 1 1 1125 . 6 1 1 A 144 144 HIS H H 144 8.478 9.009 -0.531 1 1 1126 . 6 1 1 A 144 144 HIS HA H 144 4.968 4.728 0.240 1 1 1131 . 6 1 1 A 144 144 HIS N N 144 124.275 118.182 6.093 1 1 1132 . 6 1 1 A 145 145 THR H H 145 9.031 7.731 1.300 1 1 1133 . 6 1 1 A 145 145 THR HA H 145 4.025 4.885 -0.860 1 1 1138 . 6 1 1 A 145 145 THR CA C 145 61.247 60.389 0.858 1 1 1139 . 6 1 1 A 145 145 THR CB C 145 65.181 70.628 -5.447 1 1 1141 . 6 1 1 A 145 145 THR N N 145 125.828 115.629 10.199 1 1 1142 . 6 1 1 A 146 146 SER H H 146 9.077 9.040 0.037 1 1 1143 . 6 1 1 A 146 146 SER HA H 146 4.684 4.624 0.060 1 1 1145 . 6 1 1 A 146 146 SER CA C 146 56.067 58.375 -2.308 1 1 1146 . 6 1 1 A 146 146 SER CB C 146 60.510 64.249 -3.739 1 1 1147 . 6 1 1 A 146 146 SER N N 146 124.154 124.313 -0.159 1 1 1148 . 6 1 1 A 147 147 PHE H H 147 9.049 9.039 0.010 1 1 1149 . 6 1 1 A 147 147 PHE HA H 147 4.022 4.538 -0.516 1 1 1154 . 6 1 1 A 147 147 PHE N N 147 127.670 127.940 -0.270 1 1 1155 . 6 1 1 A 148 148 ASP H H 148 8.504 8.210 0.294 1 1 1156 . 6 1 1 A 148 148 ASP HA H 148 4.422 4.733 -0.311 1 1 1158 . 6 1 1 A 148 148 ASP CA C 148 52.584 53.929 -1.345 1 1 1159 . 6 1 1 A 148 148 ASP CB C 148 37.800 41.531 -3.731 1 1 1160 . 6 1 1 A 148 148 ASP N N 148 114.377 120.047 -5.670 1 1 1161 . 6 1 1 A 149 149 LYS H H 149 7.380 8.149 -0.769 1 1 1162 . 6 1 1 A 149 149 LYS HA H 149 4.487 4.634 -0.147 1 1 1171 . 6 1 1 A 149 149 LYS CA C 149 51.735 56.626 -4.891 1 1 1172 . 6 1 1 A 149 149 LYS CB C 149 30.162 33.593 -3.431 1 1 1175 . 6 1 1 A 149 149 LYS N N 149 119.137 116.540 2.597 1 1 1176 . 6 1 1 A 150 150 LEU H H 150 6.886 8.069 -1.183 1 1 1177 . 6 1 1 A 150 150 LEU HA H 150 3.996 4.554 -0.558 1 1 1186 . 6 1 1 A 150 150 LEU CA C 150 50.502 56.434 -5.932 1 1 1187 . 6 1 1 A 150 150 LEU N N 150 120.614 120.279 0.335 1 1 1188 . 6 1 1 A 151 151 PRO CB C 151 29.567 31.685 -2.118 1 1 1190 . 6 1 1 A 152 152 LYS H H 152 8.076 8.453 -0.377 1 1 1191 . 6 1 1 A 152 152 LYS HA H 152 4.346 4.485 -0.139 1 1 1195 . 6 1 1 A 152 152 LYS CA C 152 53.182 56.938 -3.756 1 1 1196 . 6 1 1 A 152 152 LYS CB C 152 31.487 34.893 -3.406 1 1 1198 . 6 1 1 A 152 152 LYS N N 152 118.133 118.226 -0.093 1 1 1199 . 6 1 1 A 153 153 ASP H H 153 7.982 8.134 -0.152 1 1 1200 . 6 1 1 A 153 153 ASP HA H 153 4.402 4.999 -0.597 1 1 1203 . 6 1 1 A 153 153 ASP CA C 153 52.584 53.200 -0.616 1 1 1204 . 6 1 1 A 153 153 ASP CB C 153 37.762 41.760 -3.998 1 1 1205 . 6 1 1 A 153 153 ASP N N 153 115.735 117.204 -1.469 1 1 1206 . 6 1 1 A 154 154 VAL H H 154 6.987 7.511 -0.524 1 1 1207 . 6 1 1 A 154 154 VAL HA H 154 4.406 4.548 -0.142 1 1 1215 . 6 1 1 A 154 154 VAL CA C 154 58.408 61.054 -2.646 1 1 1216 . 6 1 1 A 154 154 VAL CB C 154 32.617 33.382 -0.765 1 1 1217 . 6 1 1 A 154 154 VAL N N 154 116.266 120.884 -4.618 1 1 1218 . 6 1 1 A 155 155 MET H H 155 8.444 8.690 -0.246 1 1 1219 . 6 1 1 A 155 155 MET HA H 155 5.416 5.043 0.373 1 1 1224 . 6 1 1 A 155 155 MET CA C 155 51.183 53.853 -2.670 1 1 1226 . 6 1 1 A 155 155 MET N N 155 124.950 121.849 3.101 1 1 1227 . 6 1 1 A 156 156 ALA H H 156 9.226 8.329 0.897 1 1 1228 . 6 1 1 A 156 156 ALA HA H 156 4.693 4.765 -0.072 1 1 1232 . 6 1 1 A 156 156 ALA CA C 156 48.379 50.112 -1.733 1 1 1233 . 6 1 1 A 156 156 ALA CB C 156 21.051 19.605 1.446 1 1 1234 . 6 1 1 A 156 156 ALA N N 156 129.938 127.811 2.127 1 1 1235 . 6 1 1 A 157 157 THR H H 157 8.554 8.484 0.070 1 1 1236 . 6 1 1 A 157 157 THR HA H 157 4.839 4.089 0.750 1 1 1241 . 6 1 1 A 157 157 THR CA C 157 59.555 61.827 -2.272 1 1 1242 . 6 1 1 A 157 157 THR CB C 157 68.575 69.503 -0.928 1 1 1244 . 6 1 1 A 157 157 THR N N 157 118.815 119.485 -0.670 1 1 1245 . 6 1 1 A 158 158 TYR H H 158 9.974 9.190 0.784 1 1 1246 . 6 1 1 A 158 158 TYR HA H 158 4.435 5.200 -0.765 1 1 1253 . 6 1 1 A 158 158 TYR N N 158 126.958 124.989 1.969 1 1 1254 . 6 1 1 A 159 159 ARG H H 159 8.909 8.621 0.288 1 1 1255 . 6 1 1 A 159 159 ARG HA H 159 5.444 5.159 0.285 1 1 1263 . 6 1 1 A 159 159 ARG CA C 159 51.933 54.296 -2.363 1 1 1264 . 6 1 1 A 159 159 ARG N N 159 121.721 119.000 2.721 1 1 1266 . 6 1 1 A 160 160 GLY H H 160 8.910 9.145 -0.235 1 1 1267 . 6 1 1 A 160 160 GLY HA2 H 160 4.904 4.067 0.837 1 1 1268 . 6 1 1 A 160 160 GLY HA3 H 160 4.484 4.322 0.162 1 1 1269 . 6 1 1 A 160 160 GLY N N 160 113.921 106.579 7.342 1 1 1270 . 6 1 1 A 161 161 THR H H 161 9.110 8.491 0.619 1 1 1271 . 6 1 1 A 161 161 THR HA H 161 4.810 5.037 -0.227 1 1 1276 . 6 1 1 A 161 161 THR CA C 161 59.603 61.241 -1.638 1 1 1277 . 6 1 1 A 161 161 THR CB C 161 69.909 71.974 -2.065 1 1 1279 . 6 1 1 A 161 161 THR N N 161 126.813 116.369 10.444 1 1 1280 . 6 1 1 A 162 162 ALA H H 162 7.137 8.952 -1.815 1 1 1281 . 6 1 1 A 162 162 ALA HA H 162 5.361 5.567 -0.206 1 1 1285 . 6 1 1 A 162 162 ALA CA C 162 46.573 49.968 -3.395 1 1 1286 . 6 1 1 A 162 162 ALA CB C 162 20.959 22.610 -1.651 1 1 1287 . 6 1 1 A 162 162 ALA N N 162 128.111 128.568 -0.457 1 1 1288 . 6 1 1 A 163 163 PHE H H 163 8.587 8.804 -0.217 1 1 1289 . 6 1 1 A 163 163 PHE HA H 163 5.538 6.112 -0.574 1 1 1296 . 6 1 1 A 163 163 PHE N N 163 117.349 115.195 2.154 1 1 1297 . 6 1 1 A 164 164 GLY H H 164 8.650 9.002 -0.352 1 1 1298 . 6 1 1 A 164 164 GLY HA2 H 164 4.210 4.233 -0.023 1 1 1299 . 6 1 1 A 164 164 GLY HA3 H 164 3.285 4.271 -0.986 1 1 1300 . 6 1 1 A 164 164 GLY CA C 164 40.377 44.383 -4.006 1 1 1301 . 6 1 1 A 164 164 GLY N N 164 108.839 108.659 0.180 1 1 1302 . 6 1 1 A 165 165 SER H H 165 7.684 9.117 -1.433 1 1 1303 . 6 1 1 A 165 165 SER HA H 165 3.458 4.404 -0.946 1 1 1304 . 6 1 1 A 165 165 SER N N 165 116.037 119.259 -3.222 1 1 1305 . 6 1 1 A 166 166 ASP H H 166 9.718 8.019 1.699 1 1 1306 . 6 1 1 A 166 166 ASP HA H 166 4.281 4.665 -0.384 1 1 1309 . 6 1 1 A 166 166 ASP CA C 166 52.584 53.735 -1.151 1 1 1310 . 6 1 1 A 166 166 ASP N N 166 125.166 120.051 5.115 1 1 1311 . 6 1 1 A 167 167 ASP H H 167 7.655 7.730 -0.075 1 1 1312 . 6 1 1 A 167 167 ASP HA H 167 4.666 5.072 -0.406 1 1 1315 . 6 1 1 A 167 167 ASP CB C 167 38.948 44.680 -5.732 1 1 1316 . 6 1 1 A 167 167 ASP N N 167 117.491 119.674 -2.183 1 1 1317 . 6 1 1 A 168 168 ALA H H 168 8.585 8.592 -0.007 1 1 1318 . 6 1 1 A 168 168 ALA HA H 168 5.012 4.315 0.697 1 1 1322 . 6 1 1 A 168 168 ALA CA C 168 47.485 52.388 -4.903 1 1 1323 . 6 1 1 A 168 168 ALA N N 168 128.834 123.139 5.695 1 1 1324 . 6 1 1 A 169 169 GLY H H 169 8.472 8.107 0.365 1 1 1325 . 6 1 1 A 169 169 GLY HA2 H 169 4.404 3.739 0.665 1 1 1326 . 6 1 1 A 169 169 GLY HA3 H 169 4.051 3.746 0.305 1 1 1327 . 6 1 1 A 169 169 GLY CA C 169 43.257 46.444 -3.187 1 1 1328 . 6 1 1 A 169 169 GLY N N 169 107.133 106.444 0.689 1 1 1329 . 6 1 1 A 170 170 GLY H H 170 7.229 8.489 -1.260 1 1 1330 . 6 1 1 A 170 170 GLY HA2 H 170 4.223 4.070 0.153 1 1 1331 . 6 1 1 A 170 170 GLY HA3 H 170 3.781 4.105 -0.324 1 1 1332 . 6 1 1 A 170 170 GLY CA C 170 43.310 46.185 -2.875 1 1 1333 . 6 1 1 A 170 170 GLY N N 170 107.542 111.255 -3.713 1 1 1334 . 6 1 1 A 171 171 LYS H H 171 9.641 7.476 2.165 1 1 1335 . 6 1 1 A 171 171 LYS HA H 171 5.129 4.753 0.376 1 1 1342 . 6 1 1 A 171 171 LYS CA C 171 51.355 54.286 -2.931 1 1 1343 . 6 1 1 A 171 171 LYS N N 171 124.322 119.143 5.179 1 1 1344 . 6 1 1 A 172 172 LEU H H 172 7.764 8.725 -0.961 1 1 1345 . 6 1 1 A 172 172 LEU HA H 172 4.973 5.247 -0.274 1 1 1353 . 6 1 1 A 172 172 LEU CA C 172 50.348 52.756 -2.408 1 1 1354 . 6 1 1 A 172 172 LEU N N 172 126.389 120.236 6.153 1 1 1355 . 6 1 1 A 173 173 THR H H 173 8.321 8.329 -0.008 1 1 1356 . 6 1 1 A 173 173 THR HA H 173 5.017 4.683 0.334 1 1 1361 . 6 1 1 A 173 173 THR CA C 173 59.149 61.364 -2.215 1 1 1362 . 6 1 1 A 173 173 THR CB C 173 67.449 70.899 -3.450 1 1 1364 . 6 1 1 A 173 173 THR N N 173 123.553 116.487 7.066 1 1 1365 . 6 1 1 A 174 174 TYR H H 174 9.367 9.732 -0.365 1 1 1366 . 6 1 1 A 174 174 TYR HA H 174 4.660 5.059 -0.399 1 1 1373 . 6 1 1 A 174 174 TYR CB C 174 41.267 42.566 -1.299 1 1 1374 . 6 1 1 A 174 174 TYR N N 174 129.583 125.571 4.012 1 1 1375 . 6 1 1 A 175 175 THR H H 175 8.529 9.513 -0.984 1 1 1376 . 6 1 1 A 175 175 THR HA H 175 5.388 4.735 0.653 1 1 1381 . 6 1 1 A 175 175 THR CA C 175 58.216 61.281 -3.065 1 1 1382 . 6 1 1 A 175 175 THR CB C 175 68.575 70.013 -1.438 1 1 1384 . 6 1 1 A 175 175 THR N N 175 125.967 115.877 10.090 1 1 1385 . 6 1 1 A 176 176 ILE H H 176 9.139 8.047 1.092 1 1 1386 . 6 1 1 A 176 176 ILE HA H 176 4.382 4.435 -0.053 1 1 1395 . 6 1 1 A 176 176 ILE CA C 176 58.006 59.863 -1.857 1 1 1396 . 6 1 1 A 176 176 ILE CB C 176 38.881 38.597 0.284 1 1 1400 . 6 1 1 A 176 176 ILE N N 176 123.715 126.940 -3.225 1 1 1401 . 6 1 1 A 177 177 ASP H H 177 8.501 8.406 0.095 1 1 1402 . 6 1 1 A 177 177 ASP HA H 177 5.011 4.439 0.572 1 1 1405 . 6 1 1 A 177 177 ASP CA C 177 49.089 54.217 -5.128 1 1 1406 . 6 1 1 A 177 177 ASP CB C 177 39.282 41.328 -2.046 1 1 1407 . 6 1 1 A 177 177 ASP N N 177 125.978 128.379 -2.401 1 1 1408 . 6 1 1 A 178 178 PHE H H 178 8.913 9.519 -0.606 1 1 1409 . 6 1 1 A 178 178 PHE HA H 178 3.993 4.888 -0.895 1 1 1414 . 6 1 1 A 178 178 PHE CB C 178 34.588 40.024 -5.436 1 1 1415 . 6 1 1 A 178 178 PHE N N 178 123.522 122.139 1.383 1 1 1416 . 6 1 1 A 179 179 ALA H H 179 8.487 9.293 -0.806 1 1 1417 . 6 1 1 A 179 179 ALA HA H 179 4.528 4.254 0.274 1 1 1421 . 6 1 1 A 179 179 ALA CA C 179 52.584 55.795 -3.211 1 1 1422 . 6 1 1 A 179 179 ALA CB C 179 15.666 18.666 -3.000 1 1 1423 . 6 1 1 A 179 179 ALA N N 179 124.061 123.844 0.217 1 1 1424 . 6 1 1 A 180 180 ALA H H 180 7.162 7.846 -0.684 1 1 1425 . 6 1 1 A 180 180 ALA HA H 180 4.313 4.256 0.057 1 1 1429 . 6 1 1 A 180 180 ALA CA C 180 49.006 53.048 -4.042 1 1 1430 . 6 1 1 A 180 180 ALA CB C 180 16.933 18.042 -1.109 1 1 1431 . 6 1 1 A 180 180 ALA N N 180 119.710 119.207 0.503 1 1 1432 . 6 1 1 A 181 181 LYS H H 181 8.092 8.378 -0.286 1 1 1433 . 6 1 1 A 181 181 LYS HA H 181 3.457 4.540 -1.083 1 1 1440 . 6 1 1 A 181 181 LYS CA C 181 54.783 57.344 -2.561 1 1 1441 . 6 1 1 A 181 181 LYS CB C 181 27.088 33.560 -6.472 1 1 1444 . 6 1 1 A 181 181 LYS N N 181 114.996 117.359 -2.363 1 1 1445 . 6 1 1 A 182 182 GLN H H 182 7.532 8.262 -0.730 1 1 1446 . 6 1 1 A 182 182 GLN HA H 182 5.304 4.717 0.587 1 1 1453 . 6 1 1 A 182 182 GLN CA C 182 51.473 54.772 -3.299 1 1 1454 . 6 1 1 A 182 182 GLN CB C 182 31.585 30.932 0.653 1 1 1455 . 6 1 1 A 182 182 GLN N N 182 115.064 115.161 -0.097 1 1 1457 . 6 1 1 A 183 183 GLY H H 183 9.026 8.195 0.831 1 1 1458 . 6 1 1 A 183 183 GLY HA2 H 183 5.376 4.066 1.310 1 1 1459 . 6 1 1 A 183 183 GLY HA3 H 183 3.567 4.276 -0.709 1 1 1460 . 6 1 1 A 183 183 GLY CA C 183 42.361 44.613 -2.252 1 1 1461 . 6 1 1 A 183 183 GLY N N 183 111.505 106.320 5.185 1 1 1462 . 6 1 1 A 184 184 HIS H H 184 7.508 8.717 -1.209 1 1 1463 . 6 1 1 A 184 184 HIS HA H 184 4.304 5.259 -0.955 1 1 1467 . 6 1 1 A 184 184 HIS CA C 184 52.793 53.778 -0.985 1 1 1468 . 6 1 1 A 184 184 HIS CB C 184 27.906 33.881 -5.975 1 1 1469 . 6 1 1 A 184 184 HIS N N 184 111.297 124.269 -12.972 1 1 1470 . 6 1 1 A 185 185 GLY H H 185 9.160 6.999 2.161 1 1 1471 . 6 1 1 A 185 185 GLY HA2 H 185 4.464 3.648 0.816 1 1 1472 . 6 1 1 A 185 185 GLY HA3 H 185 4.117 3.723 0.394 1 1 1473 . 6 1 1 A 185 185 GLY CA C 185 44.212 45.251 -1.039 1 1 1474 . 6 1 1 A 185 185 GLY N N 185 107.398 108.333 -0.935 1 1 1475 . 6 1 1 A 186 186 LYS H H 186 9.170 8.635 0.535 1 1 1476 . 6 1 1 A 186 186 LYS HA H 186 4.925 4.945 -0.020 1 1 1481 . 6 1 1 A 186 186 LYS CB C 186 33.642 36.319 -2.677 1 1 1482 . 6 1 1 A 186 186 LYS N N 186 122.690 116.145 6.545 1 1 1483 . 6 1 1 A 187 187 ILE H H 187 8.444 8.246 0.198 1 1 1484 . 6 1 1 A 187 187 ILE HA H 187 4.626 4.673 -0.047 1 1 1487 . 6 1 1 A 187 187 ILE N N 187 124.320 123.033 1.287 1 1 1488 . 6 1 1 A 188 188 GLU H H 188 8.590 9.594 -1.004 1 1 1489 . 6 1 1 A 188 188 GLU HA H 188 4.650 4.597 0.053 1 1 1495 . 6 1 1 A 188 188 GLU N N 188 122.575 130.491 -7.916 1 1 1496 . 6 1 1 A 189 189 HIS H H 189 8.726 8.446 0.280 1 1 1497 . 6 1 1 A 189 189 HIS HA H 189 4.055 4.580 -0.525 1 1 1501 . 6 1 1 A 189 189 HIS CA C 189 54.623 55.872 -1.249 1 1 1502 . 6 1 1 A 189 189 HIS CB C 189 24.997 30.764 -5.767 1 1 1503 . 6 1 1 A 189 189 HIS N N 189 111.381 121.955 -10.574 1 1 1504 . 6 1 1 A 190 190 LEU H H 190 9.715 8.739 0.976 1 1 1505 . 6 1 1 A 190 190 LEU HA H 190 4.379 4.263 0.116 1 1 1515 . 6 1 1 A 190 190 LEU N N 190 124.648 119.405 5.243 1 1 1516 . 6 1 1 A 191 191 LYS H H 191 10.099 7.997 2.102 1 1 1517 . 6 1 1 A 191 191 LYS HA H 191 3.736 4.560 -0.824 1 1 1524 . 6 1 1 A 191 191 LYS CA C 191 55.815 55.756 0.059 1 1 1525 . 6 1 1 A 191 191 LYS CB C 191 30.201 34.900 -4.699 1 1 1527 . 6 1 1 A 191 191 LYS N N 191 123.618 118.104 5.514 1 1 1528 . 6 1 1 A 192 192 SER H H 192 6.991 7.808 -0.817 1 1 1529 . 6 1 1 A 192 192 SER HA H 192 4.743 4.568 0.175 1 1 1532 . 6 1 1 A 192 192 SER CA C 192 51.974 56.581 -4.607 1 1 1533 . 6 1 1 A 192 192 SER CB C 192 60.005 66.509 -6.504 1 1 1534 . 6 1 1 A 192 192 SER N N 192 115.071 113.048 2.023 1 1 1535 . 6 1 1 A 193 193 PRO CB C 193 29.607 29.228 0.379 1 1 1537 . 6 1 1 A 194 194 GLU H H 194 8.213 8.620 -0.407 1 1 1538 . 6 1 1 A 194 194 GLU HA H 194 3.063 4.711 -1.648 1 1 1543 . 6 1 1 A 194 194 GLU CA C 194 54.185 57.380 -3.195 1 1 1545 . 6 1 1 A 194 194 GLU N N 194 114.055 121.704 -7.649 1 1 1546 . 6 1 1 A 195 195 LEU H H 195 7.082 8.080 -0.998 1 1 1547 . 6 1 1 A 195 195 LEU HA H 195 4.027 4.365 -0.338 1 1 1557 . 6 1 1 A 195 195 LEU CA C 195 51.361 54.092 -2.731 1 1 1558 . 6 1 1 A 195 195 LEU CB C 195 38.950 41.771 -2.821 1 1 1561 . 6 1 1 A 195 195 LEU N N 195 113.898 118.030 -4.132 1 1 1562 . 6 1 1 A 196 196 ASN H H 196 7.060 7.623 -0.563 1 1 1563 . 6 1 1 A 196 196 ASN HA H 196 4.638 4.547 0.091 1 1 1567 . 6 1 1 A 196 196 ASN N N 196 119.196 119.319 -0.123 1 1 1568 . 6 1 1 A 197 197 VAL H H 197 7.244 8.179 -0.935 1 1 1569 . 6 1 1 A 197 197 VAL HA H 197 4.540 4.922 -0.382 1 1 1577 . 6 1 1 A 197 197 VAL CA C 197 57.176 59.748 -2.572 1 1 1578 . 6 1 1 A 197 197 VAL N N 197 113.621 123.081 -9.460 1 1 1579 . 6 1 1 A 198 198 ASP H H 198 8.881 8.798 0.083 1 1 1580 . 6 1 1 A 198 198 ASP HA H 198 4.894 5.430 -0.536 1 1 1581 . 6 1 1 A 198 198 ASP N N 198 118.852 124.028 -5.176 1 1 1582 . 6 1 1 A 199 199 LEU H H 199 8.498 9.042 -0.544 1 1 1583 . 6 1 1 A 199 199 LEU HA H 199 4.317 5.086 -0.769 1 1 1591 . 6 1 1 A 199 199 LEU N N 199 124.078 125.669 -1.591 1 1 1592 . 6 1 1 A 200 200 ALA H H 200 8.386 8.928 -0.542 1 1 1593 . 6 1 1 A 200 200 ALA HA H 200 4.295 5.200 -0.905 1 1 1597 . 6 1 1 A 200 200 ALA CA C 200 50.044 51.106 -1.062 1 1 1598 . 6 1 1 A 200 200 ALA CB C 200 17.985 22.613 -4.628 1 1 1599 . 6 1 1 A 200 200 ALA N N 200 127.315 124.986 2.329 1 1 1600 . 6 1 1 A 201 201 VAL H H 201 8.007 8.494 -0.487 1 1 1601 . 6 1 1 A 201 201 VAL HA H 201 4.577 5.261 -0.684 1 1 1609 . 6 1 1 A 201 201 VAL CA C 201 60.004 59.111 0.893 1 1 1610 . 6 1 1 A 201 201 VAL CB C 201 28.863 36.136 -7.273 1 1 1611 . 6 1 1 A 201 201 VAL N N 201 119.409 120.055 -0.646 1 1 1612 . 6 1 1 A 202 202 ALA H H 202 8.789 9.882 -1.093 1 1 1613 . 6 1 1 A 202 202 ALA HA H 202 4.630 5.262 -0.632 1 1 1617 . 6 1 1 A 202 202 ALA CA C 202 48.200 49.917 -1.717 1 1 1618 . 6 1 1 A 202 202 ALA N N 202 131.745 124.621 7.124 1 1 1619 . 6 1 1 A 203 203 TYR H H 203 8.522 9.117 -0.595 1 1 1620 . 6 1 1 A 203 203 TYR HA H 203 5.391 4.964 0.427 1 1 1627 . 6 1 1 A 203 203 TYR CA C 203 54.648 59.216 -4.568 1 1 1628 . 6 1 1 A 203 203 TYR CB C 203 37.315 39.240 -1.925 1 1 1629 . 6 1 1 A 203 203 TYR N N 203 117.786 125.224 -7.438 1 1 1630 . 6 1 1 A 204 204 ILE H H 204 8.209 8.731 -0.522 1 1 1631 . 6 1 1 A 204 204 ILE HA H 204 4.393 4.689 -0.296 1 1 1641 . 6 1 1 A 204 204 ILE CB C 204 36.807 40.523 -3.716 1 1 1644 . 6 1 1 A 204 204 ILE N N 204 120.602 127.652 -7.050 1 1 1645 . 6 1 1 A 205 205 LYS H H 205 9.340 8.743 0.597 1 1 1646 . 6 1 1 A 205 205 LYS HA H 205 4.756 4.297 0.459 1 1 1651 . 6 1 1 A 205 205 LYS CA C 205 50.844 60.307 -9.463 1 1 1652 . 6 1 1 A 205 205 LYS N N 205 127.960 124.824 3.136 1 1 1653 . 6 1 1 A 207 207 ASP H H 207 8.436 9.201 -0.765 1 1 1654 . 6 1 1 A 207 207 ASP HA H 207 4.692 4.607 0.085 1 1 1657 . 6 1 1 A 207 207 ASP CA C 207 48.789 54.047 -5.258 1 1 1658 . 6 1 1 A 207 207 ASP CB C 207 38.377 40.997 -2.620 1 1 1659 . 6 1 1 A 207 207 ASP N N 207 123.098 124.978 -1.880 1 1 1660 . 6 1 1 A 208 208 GLU H H 208 8.880 8.373 0.507 1 1 1661 . 6 1 1 A 208 208 GLU HA H 208 3.994 4.008 -0.014 1 1 1666 . 6 1 1 A 208 208 GLU CA C 208 56.123 58.797 -2.674 1 1 1667 . 6 1 1 A 208 208 GLU CB C 208 25.794 29.691 -3.897 1 1 1669 . 6 1 1 A 208 208 GLU N N 208 119.042 122.239 -3.197 1 1 1670 . 6 1 1 A 209 209 LYS H H 209 7.681 7.598 0.083 1 1 1671 . 6 1 1 A 209 209 LYS HA H 209 4.141 4.318 -0.177 1 1 1680 . 6 1 1 A 209 209 LYS N N 209 119.252 115.636 3.616 1 1 1681 . 6 1 1 A 210 210 HIS H H 210 8.177 6.350 1.827 1 1 1682 . 6 1 1 A 210 210 HIS HA H 210 3.825 4.753 -0.928 1 1 1687 . 6 1 1 A 210 210 HIS CA C 210 54.205 54.206 -0.001 1 1 1688 . 6 1 1 A 210 210 HIS CB C 210 23.439 29.989 -6.550 1 1 1689 . 6 1 1 A 210 210 HIS N N 210 112.758 113.010 -0.252 1 1 1690 . 6 1 1 A 211 211 HIS H H 211 8.758 7.293 1.465 1 1 1691 . 6 1 1 A 211 211 HIS HA H 211 5.041 4.972 0.069 1 1 1695 . 6 1 1 A 211 211 HIS CA C 211 50.450 54.644 -4.194 1 1 1696 . 6 1 1 A 211 211 HIS CB C 211 25.703 34.173 -8.470 1 1 1697 . 6 1 1 A 211 211 HIS N N 211 119.552 119.014 0.538 1 1 1698 . 6 1 1 A 212 212 ALA H H 212 8.556 8.080 0.476 1 1 1699 . 6 1 1 A 212 212 ALA HA H 212 4.712 4.454 0.258 1 1 1703 . 6 1 1 A 212 212 ALA CA C 212 49.886 51.405 -1.519 1 1 1704 . 6 1 1 A 212 212 ALA CB C 212 18.860 19.357 -0.497 1 1 1705 . 6 1 1 A 212 212 ALA N N 212 123.780 123.856 -0.076 1 1 1706 . 6 1 1 A 213 213 VAL H H 213 9.338 8.122 1.216 1 1 1707 . 6 1 1 A 213 213 VAL HA H 213 5.074 4.929 0.145 1 1 1715 . 6 1 1 A 213 213 VAL CA C 213 57.486 59.229 -1.743 1 1 1716 . 6 1 1 A 213 213 VAL CB C 213 33.938 36.064 -2.126 1 1 1717 . 6 1 1 A 213 213 VAL N N 213 124.742 117.059 7.683 1 1 1718 . 6 1 1 A 214 214 ILE H H 214 8.962 8.522 0.440 1 1 1719 . 6 1 1 A 214 214 ILE HA H 214 4.434 5.056 -0.622 1 1 1726 . 6 1 1 A 214 214 ILE N N 214 122.881 124.079 -1.198 1 1 1727 . 6 1 1 A 215 215 SER H H 215 8.558 8.725 -0.167 1 1 1728 . 6 1 1 A 215 215 SER HA H 215 5.001 5.565 -0.564 1 1 1731 . 6 1 1 A 215 215 SER CA C 215 53.230 56.255 -3.025 1 1 1732 . 6 1 1 A 215 215 SER CB C 215 62.077 66.399 -4.322 1 1 1733 . 6 1 1 A 215 215 SER N N 215 122.891 122.884 0.007 1 1 1734 . 6 1 1 A 216 216 GLY H H 216 7.282 9.140 -1.858 1 1 1735 . 6 1 1 A 216 216 GLY HA2 H 216 4.515 4.197 0.318 1 1 1736 . 6 1 1 A 216 216 GLY HA3 H 216 3.473 4.217 -0.744 1 1 1737 . 6 1 1 A 216 216 GLY CA C 216 42.816 45.993 -3.177 1 1 1738 . 6 1 1 A 216 216 GLY N N 216 110.899 111.858 -0.959 1 1 1739 . 6 1 1 A 217 217 SER H H 217 8.673 8.435 0.238 1 1 1740 . 6 1 1 A 217 217 SER HA H 217 5.127 5.547 -0.420 1 1 1743 . 6 1 1 A 217 217 SER CA C 217 56.266 56.771 -0.505 1 1 1744 . 6 1 1 A 217 217 SER N N 217 117.164 115.152 2.012 1 1 1745 . 6 1 1 A 218 218 VAL H H 218 7.451 9.553 -2.102 1 1 1746 . 6 1 1 A 218 218 VAL HA H 218 5.128 4.939 0.189 1 1 1754 . 6 1 1 A 218 218 VAL CA C 218 56.637 59.787 -3.150 1 1 1755 . 6 1 1 A 218 218 VAL N N 218 117.826 120.637 -2.811 1 1 1756 . 6 1 1 A 219 219 LEU H H 219 9.022 9.019 0.003 1 1 1757 . 6 1 1 A 219 219 LEU HA H 219 5.387 4.897 0.490 1 1 1767 . 6 1 1 A 219 219 LEU CA C 219 50.450 53.814 -3.364 1 1 1768 . 6 1 1 A 219 219 LEU N N 219 124.820 126.132 -1.312 1 1 1769 . 6 1 1 A 220 220 TYR H H 220 8.816 9.078 -0.262 1 1 1770 . 6 1 1 A 220 220 TYR HA H 220 4.834 4.983 -0.149 1 1 1777 . 6 1 1 A 220 220 TYR N N 220 121.249 126.203 -4.954 1 1 1778 . 6 1 1 A 221 221 ASN H H 221 9.191 8.830 0.361 1 1 1779 . 6 1 1 A 221 221 ASN HA H 221 4.048 4.409 -0.361 1 1 1784 . 6 1 1 A 221 221 ASN CA C 221 51.647 54.937 -3.290 1 1 1785 . 6 1 1 A 221 221 ASN CB C 221 36.640 38.456 -1.816 1 1 1786 . 6 1 1 A 221 221 ASN N N 221 129.865 124.330 5.535 1 1 1788 . 6 1 1 A 222 222 GLN H H 222 8.468 6.961 1.507 1 1 1789 . 6 1 1 A 222 222 GLN HA H 222 3.671 3.946 -0.275 1 1 1794 . 6 1 1 A 222 222 GLN CA C 222 55.075 57.820 -2.745 1 1 1795 . 6 1 1 A 222 222 GLN CB C 222 24.663 29.458 -4.795 1 1 1797 . 6 1 1 A 222 222 GLN N N 222 108.367 117.959 -9.592 1 1 1798 . 6 1 1 A 223 223 ASP H H 223 7.797 7.900 -0.103 1 1 1799 . 6 1 1 A 223 223 ASP HA H 223 4.986 4.833 0.153 1 1 1802 . 6 1 1 A 223 223 ASP N N 223 120.842 118.344 2.498 1 1 1803 . 6 1 1 A 224 224 GLU H H 224 8.731 7.896 0.835 1 1 1804 . 6 1 1 A 224 224 GLU HA H 224 4.690 4.821 -0.131 1 1 1809 . 6 1 1 A 224 224 GLU CA C 224 54.703 56.049 -1.346 1 1 1810 . 6 1 1 A 224 224 GLU CB C 224 26.357 32.139 -5.782 1 1 1812 . 6 1 1 A 224 224 GLU N N 224 124.249 120.610 3.639 1 1 1813 . 6 1 1 A 225 225 LYS H H 225 8.730 8.420 0.310 1 1 1814 . 6 1 1 A 225 225 LYS HA H 225 4.754 4.835 -0.081 1 1 1822 . 6 1 1 A 225 225 LYS N N 225 126.784 124.619 2.165 1 1 1823 . 6 1 1 A 226 226 GLY H H 226 7.683 8.708 -1.025 1 1 1824 . 6 1 1 A 226 226 GLY HA2 H 226 5.567 4.134 1.433 1 1 1825 . 6 1 1 A 226 226 GLY HA3 H 226 3.819 4.153 -0.334 1 1 1826 . 6 1 1 A 226 226 GLY CA C 226 42.264 44.147 -1.883 1 1 1827 . 6 1 1 A 226 226 GLY N N 226 107.140 111.412 -4.272 1 1 1828 . 6 1 1 A 227 227 SER H H 227 8.672 9.215 -0.543 1 1 1829 . 6 1 1 A 227 227 SER HA H 227 5.564 5.308 0.256 1 1 1832 . 6 1 1 A 227 227 SER CA C 227 54.373 56.636 -2.263 1 1 1833 . 6 1 1 A 227 227 SER CB C 227 63.963 65.970 -2.007 1 1 1834 . 6 1 1 A 227 227 SER N N 227 117.767 115.711 2.056 1 1 1835 . 6 1 1 A 228 228 TYR H H 228 9.073 9.674 -0.601 1 1 1836 . 6 1 1 A 228 228 TYR HA H 228 5.519 5.035 0.484 1 1 1843 . 6 1 1 A 228 228 TYR N N 228 118.324 122.338 -4.014 1 1 1844 . 6 1 1 A 229 229 SER H H 229 8.929 8.510 0.419 1 1 1845 . 6 1 1 A 229 229 SER HA H 229 5.209 5.293 -0.084 1 1 1848 . 6 1 1 A 229 229 SER CA C 229 54.131 57.607 -3.476 1 1 1849 . 6 1 1 A 229 229 SER N N 229 116.118 120.035 -3.917 1 1 1850 . 6 1 1 A 230 230 LEU H H 230 9.372 9.007 0.365 1 1 1851 . 6 1 1 A 230 230 LEU HA H 230 4.803 4.889 -0.086 1 1 1863 . 6 1 1 A 230 230 LEU N N 230 124.803 122.833 1.970 1 1 1864 . 6 1 1 A 231 231 GLY H H 231 9.080 8.265 0.815 1 1 1865 . 6 1 1 A 231 231 GLY HA2 H 231 4.776 4.280 0.496 1 1 1866 . 6 1 1 A 231 231 GLY HA3 H 231 3.528 4.351 -0.823 1 1 1867 . 6 1 1 A 231 231 GLY CA C 231 41.468 44.234 -2.766 1 1 1868 . 6 1 1 A 231 231 GLY N N 231 109.611 106.186 3.425 1 1 1869 . 6 1 1 A 232 232 ILE H H 232 6.849 8.758 -1.909 1 1 1870 . 6 1 1 A 232 232 ILE HA H 232 4.742 4.429 0.313 1 1 1878 . 6 1 1 A 232 232 ILE N N 232 120.566 123.511 -2.945 1 1 1879 . 6 1 1 A 233 233 PHE H H 233 9.569 7.967 1.602 1 1 1880 . 6 1 1 A 233 233 PHE HA H 233 4.979 5.663 -0.684 1 1 1885 . 6 1 1 A 233 233 PHE N N 233 129.256 122.682 6.574 1 1 1886 . 6 1 1 A 234 234 GLY H H 234 8.734 8.774 -0.040 1 1 1887 . 6 1 1 A 234 234 GLY HA2 H 234 4.488 4.394 0.094 1 1 1888 . 6 1 1 A 234 234 GLY HA3 H 234 3.327 4.465 -1.138 1 1 1889 . 6 1 1 A 234 234 GLY CA C 234 40.377 46.048 -5.671 1 1 1890 . 6 1 1 A 234 234 GLY N N 234 105.294 107.075 -1.781 1 1 1891 . 6 1 1 A 235 235 GLU H H 235 9.198 8.265 0.933 1 1 1892 . 6 1 1 A 235 235 GLU HA H 235 4.111 4.461 -0.350 1 1 1897 . 6 1 1 A 235 235 GLU CA C 235 56.466 58.461 -1.995 1 1 1898 . 6 1 1 A 235 235 GLU CB C 235 26.256 28.874 -2.618 1 1 1900 . 6 1 1 A 235 235 GLU N N 235 125.813 120.379 5.434 1 1 1901 . 6 1 1 A 236 236 LYS H H 236 8.147 7.808 0.339 1 1 1902 . 6 1 1 A 236 236 LYS HA H 236 4.373 4.523 -0.150 1 1 1905 . 6 1 1 A 236 236 LYS N N 236 117.810 119.905 -2.095 1 1 1906 . 6 1 1 A 237 237 ALA H H 237 7.685 7.627 0.058 1 1 1907 . 6 1 1 A 237 237 ALA HA H 237 3.902 4.530 -0.628 1 1 1911 . 6 1 1 A 237 237 ALA CA C 237 49.762 52.047 -2.285 1 1 1912 . 6 1 1 A 237 237 ALA CB C 237 14.720 19.760 -5.040 1 1 1913 . 6 1 1 A 237 237 ALA N N 237 118.704 121.236 -2.532 1 1 1914 . 6 1 1 A 238 238 GLN H H 238 9.312 8.666 0.646 1 1 1915 . 6 1 1 A 238 238 GLN HA H 238 4.049 4.594 -0.545 1 1 1920 . 6 1 1 A 238 238 GLN N N 238 118.059 122.842 -4.783 1 1 1921 . 6 1 1 A 239 239 GLU H H 239 8.785 10.254 -1.469 1 1 1922 . 6 1 1 A 239 239 GLU HA H 239 5.531 4.827 0.704 1 1 1927 . 6 1 1 A 239 239 GLU N N 239 116.914 122.738 -5.824 1 1 1928 . 6 1 1 A 240 240 VAL H H 240 8.501 8.441 0.060 1 1 1929 . 6 1 1 A 240 240 VAL HA H 240 5.655 3.201 2.454 1 1 1937 . 6 1 1 A 240 240 VAL CA C 240 55.582 59.611 -4.029 1 1 1940 . 6 1 1 A 240 240 VAL N N 240 110.588 121.008 -10.420 1 1 1941 . 6 1 1 A 241 241 ALA H H 241 8.463 8.497 -0.034 1 1 1942 . 6 1 1 A 241 241 ALA HA H 241 5.014 5.211 -0.197 1 1 1946 . 6 1 1 A 241 241 ALA CA C 241 49.361 51.267 -1.906 1 1 1947 . 6 1 1 A 241 241 ALA CB C 241 18.196 24.069 -5.873 1 1 1948 . 6 1 1 A 241 241 ALA N N 241 121.125 128.888 -7.763 1 1 1949 . 6 1 1 A 242 242 GLY H H 242 9.421 9.380 0.041 1 1 1950 . 6 1 1 A 242 242 GLY HA2 H 242 5.161 4.308 0.853 1 1 1951 . 6 1 1 A 242 242 GLY HA3 H 242 4.076 4.327 -0.251 1 1 1952 . 6 1 1 A 242 242 GLY N N 242 112.036 105.999 6.037 1 1 1953 . 6 1 1 A 243 243 SER H H 243 8.929 8.306 0.623 1 1 1954 . 6 1 1 A 243 243 SER HA H 243 5.331 5.331 0.000 1 1 1957 . 6 1 1 A 243 243 SER N N 243 116.113 116.216 -0.103 1 1 1958 . 6 1 1 A 244 244 ALA H H 244 9.218 9.304 -0.086 1 1 1959 . 6 1 1 A 244 244 ALA HA H 244 5.221 4.827 0.394 1 1 1963 . 6 1 1 A 244 244 ALA CA C 244 47.883 50.224 -2.341 1 1 1964 . 6 1 1 A 244 244 ALA N N 244 120.635 127.550 -6.915 1 1 1965 . 6 1 1 A 245 245 GLU H H 245 9.194 8.440 0.754 1 1 1966 . 6 1 1 A 245 245 GLU HA H 245 4.869 4.985 -0.116 1 1 1971 . 6 1 1 A 245 245 GLU N N 245 123.487 118.055 5.432 1 1 1972 . 6 1 1 A 246 246 VAL H H 246 8.531 8.755 -0.224 1 1 1973 . 6 1 1 A 246 246 VAL HA H 246 4.518 4.686 -0.168 1 1 1981 . 6 1 1 A 246 246 VAL CA C 246 58.286 60.786 -2.500 1 1 1982 . 6 1 1 A 246 246 VAL N N 246 123.347 120.916 2.431 1 1 1983 . 6 1 1 A 247 247 GLU H H 247 9.132 8.631 0.501 1 1 1984 . 6 1 1 A 247 247 GLU HA H 247 4.368 4.858 -0.490 1 1 1989 . 6 1 1 A 247 247 GLU CB C 247 26.744 32.915 -6.171 1 1 1990 . 6 1 1 A 247 247 GLU N N 247 129.243 126.026 3.217 1 1 1991 . 6 1 1 A 248 248 THR H H 248 7.827 8.419 -0.592 1 1 1992 . 6 1 1 A 248 248 THR HA H 248 4.749 4.427 0.322 1 1 1997 . 6 1 1 A 248 248 THR CA C 248 56.859 62.207 -5.348 1 1 1998 . 6 1 1 A 248 248 THR CB C 248 69.171 69.445 -0.274 1 1 2000 . 6 1 1 A 248 248 THR N N 248 114.228 118.662 -4.434 1 1 2001 . 6 1 1 A 249 249 ALA H H 249 9.148 8.091 1.057 1 1 2002 . 6 1 1 A 249 249 ALA HA H 249 4.174 4.546 -0.372 1 1 2006 . 6 1 1 A 249 249 ALA CA C 249 51.970 51.591 0.379 1 1 2007 . 6 1 1 A 249 249 ALA CB C 249 15.797 20.334 -4.537 1 1 2008 . 6 1 1 A 249 249 ALA N N 249 123.341 124.164 -0.823 1 1 2009 . 6 1 1 A 250 250 ASN H H 250 7.974 7.849 0.125 1 1 2010 . 6 1 1 A 250 250 ASN HA H 250 4.953 5.061 -0.108 1 1 2015 . 6 1 1 A 250 250 ASN CA C 250 49.198 52.308 -3.110 1 1 2016 . 6 1 1 A 250 250 ASN CB C 250 35.976 39.725 -3.749 1 1 2017 . 6 1 1 A 250 250 ASN N N 250 113.358 116.273 -2.915 1 1 2019 . 6 1 1 A 251 251 GLY H H 251 7.510 7.588 -0.078 1 1 2020 . 6 1 1 A 251 251 GLY HA2 H 251 4.492 4.108 0.384 1 1 2021 . 6 1 1 A 251 251 GLY HA3 H 251 3.853 4.165 -0.312 1 1 2022 . 6 1 1 A 251 251 GLY CA C 251 41.435 45.877 -4.442 1 1 2023 . 6 1 1 A 251 251 GLY N N 251 108.692 109.134 -0.442 1 1 2024 . 6 1 1 A 252 252 ILE H H 252 8.465 8.473 -0.008 1 1 2025 . 6 1 1 A 252 252 ILE HA H 252 4.521 4.858 -0.337 1 1 2035 . 6 1 1 A 252 252 ILE CB C 252 35.653 41.605 -5.952 1 1 2039 . 6 1 1 A 252 252 ILE N N 252 122.043 120.335 1.708 1 1 2040 . 6 1 1 A 253 253 HIS H H 253 9.311 9.454 -0.143 1 1 2041 . 6 1 1 A 253 253 HIS HA H 253 4.861 5.152 -0.291 1 1 2046 . 6 1 1 A 253 253 HIS N N 253 126.617 125.670 0.947 1 1 2047 . 6 1 1 A 254 254 HIS H H 254 8.820 7.651 1.169 1 1 2048 . 6 1 1 A 254 254 HIS HA H 254 5.305 5.606 -0.301 1 1 2051 . 6 1 1 A 254 254 HIS CA C 254 52.781 53.623 -0.842 1 1 2052 . 6 1 1 A 254 254 HIS N N 254 122.665 116.832 5.833 1 1 2053 . 6 1 1 A 255 255 ILE H H 255 9.047 9.201 -0.154 1 1 2054 . 6 1 1 A 255 255 ILE HA H 255 4.651 5.045 -0.394 1 1 2061 . 6 1 1 A 255 255 ILE N N 255 123.958 123.803 0.155 1 1 2062 . 6 1 1 A 256 256 GLY H H 256 9.339 7.813 1.526 1 1 2063 . 6 1 1 A 256 256 GLY HA2 H 256 3.816 2.721 1.095 1 1 2064 . 6 1 1 A 256 256 GLY HA3 H 256 2.267 3.661 -1.394 1 1 2065 . 6 1 1 A 256 256 GLY N N 256 115.022 114.974 0.048 1 1 2066 . 6 1 1 A 257 257 LEU H H 257 7.890 9.299 -1.409 1 1 2067 . 6 1 1 A 257 257 LEU HA H 257 4.853 4.965 -0.112 1 1 2077 . 6 1 1 A 257 257 LEU N N 257 121.441 125.370 -3.929 1 1 2078 . 6 1 1 A 258 258 ALA H H 258 7.982 8.324 -0.342 1 1 2079 . 6 1 1 A 258 258 ALA HA H 258 4.668 4.983 -0.315 1 1 2083 . 6 1 1 A 258 258 ALA CA C 258 49.678 51.609 -1.931 1 1 2084 . 6 1 1 A 258 258 ALA CB C 258 19.561 20.458 -0.897 1 1 2085 . 6 1 1 A 258 258 ALA N N 258 123.234 123.967 -0.733 1 1 2086 . 6 1 1 A 259 259 ALA H H 259 9.117 8.754 0.363 1 1 2087 . 6 1 1 A 259 259 ALA HA H 259 4.790 4.569 0.221 1 1 2091 . 6 1 1 A 259 259 ALA N N 259 123.901 124.256 -0.355 1 1 2092 . 6 1 1 A 260 260 LYS H H 260 8.452 8.775 -0.323 1 1 2093 . 6 1 1 A 260 260 LYS HA H 260 5.914 4.856 1.058 1 1 2098 . 6 1 1 A 260 260 LYS CA C 260 51.818 54.284 -2.466 1 1 2099 . 6 1 1 A 260 260 LYS N N 260 116.464 116.284 0.180 1 1 1 . 7 1 1 A 9 9 SER H H 9 8.293 8.625 -0.332 1 1 2 . 7 1 1 A 9 9 SER HA H 9 4.432 5.199 -0.767 1 1 3 . 7 1 1 A 9 9 SER N N 9 116.407 116.277 0.130 1 1 4 . 7 1 1 A 10 10 GLY H H 10 8.472 8.369 0.103 1 1 5 . 7 1 1 A 10 10 GLY N N 10 111.611 109.994 1.617 1 1 6 . 7 1 1 A 14 14 VAL H H 14 8.009 8.682 -0.673 1 1 7 . 7 1 1 A 14 14 VAL HA H 14 4.128 4.155 -0.027 1 1 15 . 7 1 1 A 14 14 VAL CA C 14 59.473 62.778 -3.305 1 1 16 . 7 1 1 A 14 14 VAL CB C 14 30.127 32.382 -2.255 1 1 17 . 7 1 1 A 14 14 VAL N N 14 119.846 125.147 -5.301 1 1 18 . 7 1 1 A 15 15 THR H H 15 8.152 8.711 -0.559 1 1 19 . 7 1 1 A 15 15 THR HA H 15 4.346 4.576 -0.230 1 1 24 . 7 1 1 A 15 15 THR N N 15 118.509 118.712 -0.203 1 1 25 . 7 1 1 A 16 16 ALA H H 16 8.207 8.634 -0.427 1 1 26 . 7 1 1 A 16 16 ALA HA H 16 4.319 4.157 0.162 1 1 30 . 7 1 1 A 16 16 ALA CA C 16 49.835 53.541 -3.706 1 1 31 . 7 1 1 A 16 16 ALA CB C 16 16.714 18.596 -1.882 1 1 32 . 7 1 1 A 16 16 ALA N N 16 126.935 125.163 1.772 1 1 33 . 7 1 1 A 17 17 ASP H H 17 8.269 7.979 0.290 1 1 34 . 7 1 1 A 17 17 ASP HA H 17 4.581 5.298 -0.717 1 1 37 . 7 1 1 A 17 17 ASP CA C 17 51.643 53.285 -1.642 1 1 38 . 7 1 1 A 17 17 ASP CB C 17 38.257 41.563 -3.306 1 1 39 . 7 1 1 A 17 17 ASP N N 17 120.379 118.257 2.122 1 1 40 . 7 1 1 A 18 18 ILE H H 18 7.979 7.772 0.207 1 1 41 . 7 1 1 A 18 18 ILE HA H 18 4.178 4.170 0.008 1 1 48 . 7 1 1 A 18 18 ILE CA C 18 58.737 63.029 -4.292 1 1 49 . 7 1 1 A 18 18 ILE CB C 18 36.077 38.431 -2.354 1 1 53 . 7 1 1 A 18 18 ILE N N 18 121.171 119.259 1.912 1 1 54 . 7 1 1 A 19 19 GLY H H 19 8.410 8.346 0.064 1 1 55 . 7 1 1 A 19 19 GLY HA2 H 19 4.023 3.905 0.118 1 1 56 . 7 1 1 A 19 19 GLY HA3 H 19 4.023 3.908 0.115 1 1 57 . 7 1 1 A 19 19 GLY N N 19 112.246 108.119 4.127 1 1 58 . 7 1 1 A 20 20 THR H H 20 8.005 9.254 -1.249 1 1 59 . 7 1 1 A 20 20 THR HA H 20 4.463 4.033 0.430 1 1 64 . 7 1 1 A 20 20 THR CB C 20 66.723 68.701 -1.978 1 1 66 . 7 1 1 A 20 20 THR N N 20 112.239 115.109 -2.870 1 1 67 . 7 1 1 A 21 21 GLY H H 21 8.500 8.395 0.105 1 1 68 . 7 1 1 A 21 21 GLY HA2 H 21 4.099 3.827 0.272 1 1 69 . 7 1 1 A 21 21 GLY HA3 H 21 3.872 3.829 0.043 1 1 70 . 7 1 1 A 21 21 GLY N N 21 111.048 111.425 -0.377 1 1 71 . 7 1 1 A 22 22 LEU H H 22 7.427 7.977 -0.550 1 1 72 . 7 1 1 A 22 22 LEU HA H 22 3.884 4.128 -0.244 1 1 84 . 7 1 1 A 22 22 LEU N N 22 118.837 119.621 -0.784 1 1 85 . 7 1 1 A 23 23 ALA H H 23 7.896 8.223 -0.327 1 1 86 . 7 1 1 A 23 23 ALA HA H 23 4.023 4.129 -0.106 1 1 90 . 7 1 1 A 23 23 ALA CA C 23 52.584 54.170 -1.586 1 1 91 . 7 1 1 A 23 23 ALA CB C 23 15.470 18.386 -2.916 1 1 92 . 7 1 1 A 23 23 ALA N N 23 119.194 121.814 -2.620 1 1 93 . 7 1 1 A 24 24 ASP H H 24 8.265 7.645 0.620 1 1 94 . 7 1 1 A 24 24 ASP HA H 24 4.337 4.511 -0.174 1 1 97 . 7 1 1 A 24 24 ASP CB C 24 37.029 41.145 -4.116 1 1 98 . 7 1 1 A 24 24 ASP N N 24 119.035 116.753 2.282 1 1 99 . 7 1 1 A 25 25 ALA H H 25 8.211 8.457 -0.246 1 1 100 . 7 1 1 A 25 25 ALA HA H 25 4.064 4.536 -0.472 1 1 104 . 7 1 1 A 25 25 ALA CA C 25 53.278 53.113 0.165 1 1 105 . 7 1 1 A 25 25 ALA CB C 25 15.760 19.141 -3.381 1 1 106 . 7 1 1 A 25 25 ALA N N 25 122.434 121.005 1.429 1 1 107 . 7 1 1 A 26 26 LEU H H 26 7.334 7.351 -0.017 1 1 108 . 7 1 1 A 26 26 LEU HA H 26 4.351 4.214 0.137 1 1 117 . 7 1 1 A 26 26 LEU N N 26 114.238 116.015 -1.777 1 1 118 . 7 1 1 A 27 27 THR H H 27 7.708 7.275 0.433 1 1 119 . 7 1 1 A 27 27 THR HA H 27 4.492 4.591 -0.099 1 1 124 . 7 1 1 A 27 27 THR CA C 27 59.438 62.156 -2.718 1 1 125 . 7 1 1 A 27 27 THR CB C 27 68.796 70.263 -1.467 1 1 127 . 7 1 1 A 27 27 THR N N 27 106.430 107.936 -1.506 1 1 128 . 7 1 1 A 28 28 ALA H H 28 8.906 7.882 1.024 1 1 129 . 7 1 1 A 28 28 ALA HA H 28 4.812 4.744 0.068 1 1 133 . 7 1 1 A 28 28 ALA CB C 28 16.724 18.882 -2.158 1 1 134 . 7 1 1 A 28 28 ALA N N 28 128.420 124.327 4.093 1 1 135 . 7 1 1 A 29 29 PRO CA C 29 59.166 62.402 -3.236 1 1 136 . 7 1 1 A 29 29 PRO CB C 29 29.865 30.486 -0.621 1 1 139 . 7 1 1 A 30 30 LEU H H 30 8.204 7.798 0.406 1 1 140 . 7 1 1 A 30 30 LEU HA H 30 4.052 4.426 -0.374 1 1 150 . 7 1 1 A 30 30 LEU N N 30 121.970 121.643 0.327 1 1 151 . 7 1 1 A 31 31 ASP H H 31 8.720 8.731 -0.011 1 1 152 . 7 1 1 A 31 31 ASP HA H 31 4.772 5.689 -0.917 1 1 155 . 7 1 1 A 31 31 ASP CA C 31 50.115 53.443 -3.328 1 1 156 . 7 1 1 A 31 31 ASP N N 31 125.105 118.569 6.536 1 1 157 . 7 1 1 A 32 32 HIS CA C 32 55.083 57.827 -2.744 1 1 158 . 7 1 1 A 32 32 HIS CB C 32 25.707 30.069 -4.362 1 1 159 . 7 1 1 A 33 33 LYS H H 33 8.589 7.813 0.776 1 1 160 . 7 1 1 A 33 33 LYS HA H 33 4.112 4.443 -0.331 1 1 167 . 7 1 1 A 33 33 LYS CB C 33 29.218 33.923 -4.705 1 1 169 . 7 1 1 A 33 33 LYS N N 33 118.920 117.908 1.012 1 1 170 . 7 1 1 A 34 34 ASP H H 34 7.420 7.971 -0.551 1 1 171 . 7 1 1 A 34 34 ASP HA H 34 4.368 4.826 -0.458 1 1 174 . 7 1 1 A 34 34 ASP N N 34 120.940 120.752 0.188 1 1 175 . 7 1 1 A 35 35 LYS H H 35 8.266 7.910 0.356 1 1 176 . 7 1 1 A 35 35 LYS HA H 35 4.169 4.126 0.043 1 1 183 . 7 1 1 A 35 35 LYS N N 35 121.280 126.100 -4.820 1 1 184 . 7 1 1 A 36 36 GLY H H 36 8.716 7.942 0.774 1 1 185 . 7 1 1 A 36 36 GLY HA2 H 36 3.822 3.892 -0.070 1 1 186 . 7 1 1 A 36 36 GLY HA3 H 36 3.618 3.894 -0.276 1 1 187 . 7 1 1 A 36 36 GLY N N 36 111.002 107.044 3.958 1 1 188 . 7 1 1 A 37 37 LEU H H 37 8.032 7.647 0.385 1 1 189 . 7 1 1 A 37 37 LEU HA H 37 4.406 4.411 -0.005 1 1 198 . 7 1 1 A 37 37 LEU N N 37 127.683 120.655 7.028 1 1 199 . 7 1 1 A 38 38 LYS H H 38 9.190 8.950 0.240 1 1 200 . 7 1 1 A 38 38 LYS HA H 38 3.925 4.314 -0.389 1 1 205 . 7 1 1 A 38 38 LYS N N 38 132.634 125.900 6.734 1 1 206 . 7 1 1 A 39 39 SER H H 39 7.161 7.735 -0.574 1 1 207 . 7 1 1 A 39 39 SER HA H 39 5.097 4.807 0.290 1 1 210 . 7 1 1 A 39 39 SER CA C 39 54.451 57.596 -3.145 1 1 211 . 7 1 1 A 39 39 SER N N 39 110.262 111.595 -1.333 1 1 212 . 7 1 1 A 40 40 LEU H H 40 8.142 8.783 -0.641 1 1 213 . 7 1 1 A 40 40 LEU HA H 40 4.481 4.971 -0.490 1 1 223 . 7 1 1 A 40 40 LEU N N 40 122.761 120.457 2.304 1 1 224 . 7 1 1 A 41 41 THR H H 41 8.641 8.800 -0.159 1 1 225 . 7 1 1 A 41 41 THR HA H 41 4.141 4.784 -0.643 1 1 230 . 7 1 1 A 41 41 THR CA C 41 60.301 61.360 -1.059 1 1 231 . 7 1 1 A 41 41 THR CB C 41 65.862 70.844 -4.982 1 1 233 . 7 1 1 A 41 41 THR N N 41 124.142 117.470 6.672 1 1 234 . 7 1 1 A 42 42 LEU H H 42 8.586 8.191 0.395 1 1 235 . 7 1 1 A 42 42 LEU HA H 42 4.337 4.434 -0.097 1 1 247 . 7 1 1 A 42 42 LEU N N 42 128.603 127.051 1.552 1 1 248 . 7 1 1 A 43 43 GLU H H 43 8.644 8.495 0.149 1 1 249 . 7 1 1 A 43 43 GLU HA H 43 4.663 4.249 0.414 1 1 253 . 7 1 1 A 43 43 GLU N N 43 124.180 122.050 2.130 1 1 254 . 7 1 1 A 44 44 ASP H H 44 10.243 8.685 1.558 1 1 255 . 7 1 1 A 44 44 ASP HA H 44 4.518 4.721 -0.203 1 1 258 . 7 1 1 A 44 44 ASP CA C 44 52.879 52.685 0.194 1 1 259 . 7 1 1 A 44 44 ASP CB C 44 37.711 39.237 -1.526 1 1 260 . 7 1 1 A 44 44 ASP N N 44 124.177 121.039 3.138 1 1 261 . 7 1 1 A 45 45 SER H H 45 8.546 8.136 0.410 1 1 262 . 7 1 1 A 45 45 SER HA H 45 3.850 4.054 -0.204 1 1 265 . 7 1 1 A 45 45 SER CA C 45 59.588 61.619 -2.031 1 1 266 . 7 1 1 A 45 45 SER CB C 45 61.660 62.990 -1.330 1 1 267 . 7 1 1 A 45 45 SER N N 45 116.191 117.193 -1.002 1 1 268 . 7 1 1 A 46 46 ILE H H 46 6.902 7.610 -0.708 1 1 269 . 7 1 1 A 46 46 ILE HA H 46 3.874 4.484 -0.610 1 1 279 . 7 1 1 A 46 46 ILE CA C 46 57.605 60.473 -2.868 1 1 280 . 7 1 1 A 46 46 ILE CB C 46 36.694 38.951 -2.257 1 1 283 . 7 1 1 A 46 46 ILE N N 46 116.189 120.159 -3.970 1 1 284 . 7 1 1 A 47 47 SER H H 47 7.804 8.483 -0.679 1 1 285 . 7 1 1 A 47 47 SER HA H 47 4.342 4.803 -0.461 1 1 288 . 7 1 1 A 47 47 SER CA C 47 55.995 56.576 -0.581 1 1 289 . 7 1 1 A 47 47 SER N N 47 118.738 117.278 1.460 1 1 290 . 7 1 1 A 48 48 GLN H H 48 8.522 8.747 -0.225 1 1 291 . 7 1 1 A 48 48 GLN HA H 48 3.939 4.134 -0.195 1 1 296 . 7 1 1 A 48 48 GLN CA C 48 55.111 58.566 -3.455 1 1 298 . 7 1 1 A 48 48 GLN N N 48 119.475 122.425 -2.950 1 1 299 . 7 1 1 A 49 49 ASN H H 49 8.437 8.158 0.279 1 1 300 . 7 1 1 A 49 49 ASN HA H 49 4.693 4.742 -0.049 1 1 305 . 7 1 1 A 49 49 ASN CA C 49 50.839 52.178 -1.339 1 1 306 . 7 1 1 A 49 49 ASN CB C 49 35.767 38.096 -2.329 1 1 307 . 7 1 1 A 49 49 ASN N N 49 117.233 114.830 2.403 1 1 309 . 7 1 1 A 50 50 GLY H H 50 7.952 7.418 0.534 1 1 310 . 7 1 1 A 50 50 GLY HA2 H 50 4.518 4.128 0.390 1 1 311 . 7 1 1 A 50 50 GLY HA3 H 50 4.054 4.138 -0.084 1 1 312 . 7 1 1 A 50 50 GLY CA C 50 41.883 45.425 -3.542 1 1 313 . 7 1 1 A 50 50 GLY N N 50 108.751 107.869 0.882 1 1 314 . 7 1 1 A 51 51 THR H H 51 8.548 8.550 -0.002 1 1 315 . 7 1 1 A 51 51 THR HA H 51 5.012 5.406 -0.394 1 1 320 . 7 1 1 A 51 51 THR CA C 51 57.026 60.098 -3.072 1 1 321 . 7 1 1 A 51 51 THR CB C 51 69.887 70.729 -0.842 1 1 323 . 7 1 1 A 51 51 THR N N 51 108.710 116.503 -7.793 1 1 324 . 7 1 1 A 52 52 LEU H H 52 9.110 8.734 0.376 1 1 325 . 7 1 1 A 52 52 LEU HA H 52 5.183 5.290 -0.107 1 1 333 . 7 1 1 A 52 52 LEU CA C 52 50.822 53.965 -3.143 1 1 335 . 7 1 1 A 52 52 LEU N N 52 124.606 122.599 2.007 1 1 336 . 7 1 1 A 53 53 THR H H 53 9.312 8.656 0.656 1 1 337 . 7 1 1 A 53 53 THR HA H 53 5.288 5.082 0.206 1 1 342 . 7 1 1 A 53 53 THR CA C 53 59.535 61.103 -1.568 1 1 343 . 7 1 1 A 53 53 THR CB C 53 66.838 72.227 -5.389 1 1 345 . 7 1 1 A 53 53 THR N N 53 125.445 115.382 10.063 1 1 346 . 7 1 1 A 54 54 LEU H H 54 8.992 9.328 -0.336 1 1 347 . 7 1 1 A 54 54 LEU HA H 54 5.563 5.307 0.256 1 1 357 . 7 1 1 A 54 54 LEU N N 54 128.814 124.983 3.831 1 1 358 . 7 1 1 A 55 55 SER H H 55 9.017 9.272 -0.255 1 1 359 . 7 1 1 A 55 55 SER HA H 55 5.476 5.165 0.311 1 1 362 . 7 1 1 A 55 55 SER CA C 55 53.944 56.691 -2.747 1 1 363 . 7 1 1 A 55 55 SER CB C 55 63.384 65.035 -1.651 1 1 364 . 7 1 1 A 55 55 SER N N 55 112.964 119.010 -6.046 1 1 365 . 7 1 1 A 56 56 ALA H H 56 8.324 10.293 -1.969 1 1 366 . 7 1 1 A 56 56 ALA HA H 56 4.605 4.850 -0.245 1 1 370 . 7 1 1 A 56 56 ALA CA C 56 50.743 50.041 0.702 1 1 371 . 7 1 1 A 56 56 ALA CB C 56 21.372 21.233 0.139 1 1 372 . 7 1 1 A 56 56 ALA N N 56 123.555 129.882 -6.327 1 1 373 . 7 1 1 A 57 57 GLN H H 57 9.080 8.571 0.509 1 1 374 . 7 1 1 A 57 57 GLN HA H 57 3.884 4.495 -0.611 1 1 381 . 7 1 1 A 57 57 GLN CA C 57 53.331 55.845 -2.514 1 1 382 . 7 1 1 A 57 57 GLN CB C 57 24.659 27.536 -2.877 1 1 384 . 7 1 1 A 57 57 GLN N N 57 116.815 115.533 1.282 1 1 386 . 7 1 1 A 58 58 GLY H H 58 8.527 7.938 0.589 1 1 387 . 7 1 1 A 58 58 GLY HA2 H 58 4.168 4.052 0.116 1 1 388 . 7 1 1 A 58 58 GLY HA3 H 58 3.608 4.053 -0.445 1 1 389 . 7 1 1 A 58 58 GLY CA C 58 42.856 45.592 -2.736 1 1 390 . 7 1 1 A 58 58 GLY N N 58 105.983 107.134 -1.151 1 1 391 . 7 1 1 A 59 59 ALA H H 59 8.203 7.690 0.513 1 1 392 . 7 1 1 A 59 59 ALA HA H 59 4.811 4.594 0.217 1 1 396 . 7 1 1 A 59 59 ALA CA C 59 47.662 51.398 -3.736 1 1 397 . 7 1 1 A 59 59 ALA CB C 59 20.147 22.643 -2.496 1 1 398 . 7 1 1 A 59 59 ALA N N 59 125.153 121.022 4.131 1 1 399 . 7 1 1 A 60 60 GLU H H 60 8.154 8.920 -0.766 1 1 400 . 7 1 1 A 60 60 GLU HA H 60 5.508 5.745 -0.237 1 1 404 . 7 1 1 A 60 60 GLU CA C 60 52.179 53.993 -1.814 1 1 405 . 7 1 1 A 60 60 GLU CB C 60 30.203 34.593 -4.390 1 1 406 . 7 1 1 A 60 60 GLU N N 60 117.318 116.934 0.384 1 1 407 . 7 1 1 A 61 61 LYS H H 61 8.821 9.311 -0.490 1 1 408 . 7 1 1 A 61 61 LYS HA H 61 4.311 4.751 -0.440 1 1 413 . 7 1 1 A 61 61 LYS N N 61 123.743 120.668 3.075 1 1 414 . 7 1 1 A 62 62 THR H H 62 8.149 8.657 -0.508 1 1 415 . 7 1 1 A 62 62 THR HA H 62 4.928 4.334 0.594 1 1 420 . 7 1 1 A 62 62 THR CA C 62 59.427 62.995 -3.568 1 1 421 . 7 1 1 A 62 62 THR CB C 62 66.932 69.516 -2.584 1 1 422 . 7 1 1 A 62 62 THR N N 62 122.829 120.818 2.011 1 1 423 . 7 1 1 A 63 63 TYR H H 63 9.466 9.886 -0.420 1 1 424 . 7 1 1 A 63 63 TYR HA H 63 4.606 5.073 -0.467 1 1 431 . 7 1 1 A 63 63 TYR CA C 63 54.508 54.751 -0.243 1 1 432 . 7 1 1 A 63 63 TYR N N 63 127.472 127.063 0.409 1 1 433 . 7 1 1 A 64 64 GLY H H 64 9.253 8.799 0.454 1 1 434 . 7 1 1 A 64 64 GLY HA2 H 64 4.670 4.181 0.489 1 1 435 . 7 1 1 A 64 64 GLY HA3 H 64 3.619 4.200 -0.581 1 1 436 . 7 1 1 A 64 64 GLY CA C 64 39.885 44.033 -4.148 1 1 437 . 7 1 1 A 64 64 GLY N N 64 110.182 112.381 -2.199 1 1 438 . 7 1 1 A 65 65 ASN H H 65 8.616 8.532 0.084 1 1 439 . 7 1 1 A 65 65 ASN HA H 65 4.109 4.369 -0.260 1 1 444 . 7 1 1 A 65 65 ASN CA C 65 53.691 54.786 -1.095 1 1 445 . 7 1 1 A 65 65 ASN N N 65 117.778 118.473 -0.695 1 1 447 . 7 1 1 A 66 66 GLY H H 66 9.053 8.556 0.497 1 1 448 . 7 1 1 A 66 66 GLY HA2 H 66 4.344 3.871 0.473 1 1 449 . 7 1 1 A 66 66 GLY HA3 H 66 3.359 3.881 -0.522 1 1 450 . 7 1 1 A 66 66 GLY CA C 66 42.431 44.869 -2.438 1 1 451 . 7 1 1 A 66 66 GLY N N 66 115.232 113.890 1.342 1 1 452 . 7 1 1 A 67 67 ASP H H 67 8.120 8.896 -0.776 1 1 453 . 7 1 1 A 67 67 ASP HA H 67 4.844 3.935 0.909 1 1 456 . 7 1 1 A 67 67 ASP N N 67 122.593 120.238 2.355 1 1 457 . 7 1 1 A 68 68 SER H H 68 8.500 7.080 1.420 1 1 458 . 7 1 1 A 68 68 SER HA H 68 5.088 5.033 0.055 1 1 461 . 7 1 1 A 68 68 SER CA C 68 54.858 56.310 -1.452 1 1 462 . 7 1 1 A 68 68 SER CB C 68 62.114 65.926 -3.812 1 1 463 . 7 1 1 A 68 68 SER N N 68 113.557 113.164 0.393 1 1 464 . 7 1 1 A 69 69 LEU H H 69 8.989 9.155 -0.166 1 1 465 . 7 1 1 A 69 69 LEU HA H 69 4.570 4.877 -0.307 1 1 474 . 7 1 1 A 69 69 LEU N N 69 126.836 123.699 3.137 1 1 475 . 7 1 1 A 70 70 ASN H H 70 8.491 8.885 -0.394 1 1 476 . 7 1 1 A 70 70 ASN HA H 70 4.958 4.769 0.189 1 1 479 . 7 1 1 A 70 70 ASN CB C 70 33.265 37.803 -4.538 1 1 480 . 7 1 1 A 70 70 ASN N N 70 126.343 124.214 2.129 1 1 481 . 7 1 1 A 71 71 THR H H 71 7.831 8.418 -0.587 1 1 482 . 7 1 1 A 71 71 THR HA H 71 3.759 4.755 -0.996 1 1 487 . 7 1 1 A 71 71 THR CA C 71 61.005 60.213 0.792 1 1 488 . 7 1 1 A 71 71 THR N N 71 114.742 115.491 -0.749 1 1 489 . 7 1 1 A 72 72 GLY H H 72 8.880 8.492 0.388 1 1 490 . 7 1 1 A 72 72 GLY HA2 H 72 3.907 3.899 0.008 1 1 491 . 7 1 1 A 72 72 GLY HA3 H 72 3.907 3.902 0.005 1 1 492 . 7 1 1 A 72 72 GLY N N 72 114.976 111.122 3.854 1 1 493 . 7 1 1 A 73 73 LYS H H 73 6.604 7.810 -1.206 1 1 494 . 7 1 1 A 73 73 LYS HA H 73 4.160 4.664 -0.504 1 1 501 . 7 1 1 A 73 73 LYS N N 73 113.898 117.650 -3.752 1 1 502 . 7 1 1 A 74 74 LEU H H 74 7.422 8.485 -1.063 1 1 503 . 7 1 1 A 74 74 LEU HA H 74 4.358 4.699 -0.341 1 1 513 . 7 1 1 A 74 74 LEU N N 74 117.180 121.796 -4.616 1 1 514 . 7 1 1 A 75 75 LYS H H 75 8.617 7.834 0.783 1 1 515 . 7 1 1 A 75 75 LYS HA H 75 4.079 4.208 -0.129 1 1 518 . 7 1 1 A 75 75 LYS N N 75 121.119 121.813 -0.694 1 1 519 . 7 1 1 A 76 76 ASN H H 76 8.154 8.933 -0.779 1 1 520 . 7 1 1 A 76 76 ASN HA H 76 3.935 4.817 -0.882 1 1 525 . 7 1 1 A 76 76 ASN CB C 76 35.772 39.178 -3.406 1 1 526 . 7 1 1 A 76 76 ASN N N 76 122.761 120.447 2.314 1 1 527 . 7 1 1 A 77 77 ASP H H 77 9.227 7.850 1.377 1 1 528 . 7 1 1 A 77 77 ASP HA H 77 3.787 5.802 -2.015 1 1 531 . 7 1 1 A 77 77 ASP CA C 77 52.584 53.316 -0.732 1 1 532 . 7 1 1 A 77 77 ASP N N 77 114.129 119.434 -5.305 1 1 533 . 7 1 1 A 78 78 LYS H H 78 6.579 8.262 -1.683 1 1 534 . 7 1 1 A 78 78 LYS HA H 78 4.572 4.964 -0.392 1 1 539 . 7 1 1 A 78 78 LYS CA C 78 51.072 55.029 -3.957 1 1 540 . 7 1 1 A 78 78 LYS CB C 78 33.783 35.632 -1.849 1 1 541 . 7 1 1 A 78 78 LYS N N 78 114.135 123.443 -9.308 1 1 542 . 7 1 1 A 79 79 VAL H H 79 8.729 7.828 0.901 1 1 543 . 7 1 1 A 79 79 VAL HA H 79 4.402 2.710 1.692 1 1 551 . 7 1 1 A 79 79 VAL CA C 79 59.240 61.630 -2.390 1 1 553 . 7 1 1 A 79 79 VAL N N 79 123.191 126.094 -2.903 1 1 554 . 7 1 1 A 80 80 SER H H 80 9.542 8.668 0.874 1 1 555 . 7 1 1 A 80 80 SER HA H 80 4.636 5.048 -0.412 1 1 558 . 7 1 1 A 80 80 SER CA C 80 55.978 57.653 -1.675 1 1 559 . 7 1 1 A 80 80 SER N N 80 127.445 120.778 6.667 1 1 560 . 7 1 1 A 81 81 ARG H H 81 8.093 8.632 -0.539 1 1 561 . 7 1 1 A 81 81 ARG HA H 81 5.210 5.725 -0.515 1 1 569 . 7 1 1 A 81 81 ARG N N 81 123.743 122.300 1.443 1 1 571 . 7 1 1 A 82 82 PHE H H 82 9.312 8.130 1.182 1 1 572 . 7 1 1 A 82 82 PHE HA H 82 4.951 5.709 -0.758 1 1 577 . 7 1 1 A 82 82 PHE CA C 82 53.090 55.406 -2.316 1 1 578 . 7 1 1 A 82 82 PHE N N 82 119.529 117.125 2.404 1 1 579 . 7 1 1 A 83 83 ASP H H 83 9.122 8.925 0.197 1 1 580 . 7 1 1 A 83 83 ASP HA H 83 5.593 4.745 0.848 1 1 583 . 7 1 1 A 83 83 ASP N N 83 123.825 122.554 1.271 1 1 584 . 7 1 1 A 84 84 PHE H H 84 9.090 8.172 0.918 1 1 585 . 7 1 1 A 84 84 PHE HA H 84 6.410 5.799 0.611 1 1 592 . 7 1 1 A 84 84 PHE CA C 84 52.584 56.355 -3.771 1 1 593 . 7 1 1 A 84 84 PHE N N 84 118.862 119.068 -0.206 1 1 594 . 7 1 1 A 85 85 ILE H H 85 8.441 9.152 -0.711 1 1 595 . 7 1 1 A 85 85 ILE HA H 85 4.662 4.646 0.016 1 1 605 . 7 1 1 A 85 85 ILE CB C 85 39.939 39.448 0.491 1 1 608 . 7 1 1 A 85 85 ILE N N 85 118.049 120.939 -2.890 1 1 609 . 7 1 1 A 86 86 ARG H H 86 8.983 8.768 0.215 1 1 610 . 7 1 1 A 86 86 ARG HA H 86 5.591 4.748 0.843 1 1 616 . 7 1 1 A 86 86 ARG N N 86 127.006 126.945 0.061 1 1 618 . 7 1 1 A 87 87 GLN H H 87 8.643 8.879 -0.236 1 1 619 . 7 1 1 A 87 87 GLN HA H 87 5.630 4.935 0.695 1 1 626 . 7 1 1 A 87 87 GLN CA C 87 51.512 54.582 -3.070 1 1 627 . 7 1 1 A 87 87 GLN N N 87 124.142 120.918 3.224 1 1 629 . 7 1 1 A 88 88 ILE H H 88 8.617 8.817 -0.200 1 1 630 . 7 1 1 A 88 88 ILE HA H 88 4.690 4.812 -0.122 1 1 637 . 7 1 1 A 88 88 ILE CA C 88 56.995 60.453 -3.458 1 1 638 . 7 1 1 A 88 88 ILE CB C 88 39.927 39.600 0.327 1 1 641 . 7 1 1 A 88 88 ILE N N 88 116.353 124.252 -7.899 1 1 642 . 7 1 1 A 89 89 GLU H H 89 8.298 9.000 -0.702 1 1 643 . 7 1 1 A 89 89 GLU HA H 89 5.100 5.890 -0.790 1 1 646 . 7 1 1 A 89 89 GLU CA C 89 52.204 54.872 -2.668 1 1 647 . 7 1 1 A 89 89 GLU CB C 89 27.325 33.050 -5.725 1 1 648 . 7 1 1 A 89 89 GLU N N 89 124.458 129.479 -5.021 1 1 649 . 7 1 1 A 90 90 VAL H H 90 8.957 8.849 0.108 1 1 650 . 7 1 1 A 90 90 VAL HA H 90 4.169 4.669 -0.500 1 1 658 . 7 1 1 A 90 90 VAL CA C 90 58.664 59.895 -1.231 1 1 659 . 7 1 1 A 90 90 VAL CB C 90 31.861 34.021 -2.160 1 1 660 . 7 1 1 A 90 90 VAL N N 90 127.580 126.119 1.461 1 1 661 . 7 1 1 A 91 91 ASP H H 91 9.369 8.558 0.811 1 1 662 . 7 1 1 A 91 91 ASP HA H 91 4.287 4.570 -0.283 1 1 665 . 7 1 1 A 91 91 ASP CA C 91 52.389 54.872 -2.483 1 1 666 . 7 1 1 A 91 91 ASP CB C 91 36.409 40.348 -3.939 1 1 667 . 7 1 1 A 91 91 ASP N N 91 129.411 123.655 5.756 1 1 668 . 7 1 1 A 92 92 GLY H H 92 8.552 7.466 1.086 1 1 669 . 7 1 1 A 92 92 GLY HA2 H 92 4.090 4.090 0.000 1 1 670 . 7 1 1 A 92 92 GLY HA3 H 92 3.618 4.091 -0.473 1 1 671 . 7 1 1 A 92 92 GLY CA C 92 42.836 45.589 -2.753 1 1 672 . 7 1 1 A 92 92 GLY N N 92 103.862 105.511 -1.649 1 1 673 . 7 1 1 A 93 93 GLN H H 93 7.808 7.609 0.199 1 1 674 . 7 1 1 A 93 93 GLN HA H 93 4.578 4.832 -0.254 1 1 679 . 7 1 1 A 93 93 GLN CA C 93 50.918 54.300 -3.382 1 1 680 . 7 1 1 A 93 93 GLN CB C 93 28.602 31.183 -2.581 1 1 682 . 7 1 1 A 93 93 GLN N N 93 120.412 118.745 1.667 1 1 683 . 7 1 1 A 94 94 LEU H H 94 8.414 8.474 -0.060 1 1 684 . 7 1 1 A 94 94 LEU HA H 94 4.704 4.242 0.462 1 1 693 . 7 1 1 A 94 94 LEU CB C 94 39.873 42.549 -2.676 1 1 696 . 7 1 1 A 94 94 LEU N N 94 125.061 122.667 2.394 1 1 697 . 7 1 1 A 95 95 ILE H H 95 9.181 8.672 0.509 1 1 698 . 7 1 1 A 95 95 ILE HA H 95 4.371 4.896 -0.525 1 1 708 . 7 1 1 A 95 95 ILE CA C 95 63.319 60.763 2.556 1 1 709 . 7 1 1 A 95 95 ILE CB C 95 37.407 39.680 -2.273 1 1 711 . 7 1 1 A 95 95 ILE N N 95 127.724 121.668 6.056 1 1 712 . 7 1 1 A 96 96 THR H H 96 8.730 7.427 1.303 1 1 713 . 7 1 1 A 96 96 THR HA H 96 4.411 4.398 0.013 1 1 718 . 7 1 1 A 96 96 THR CA C 96 60.344 63.016 -2.672 1 1 719 . 7 1 1 A 96 96 THR CB C 96 59.719 69.724 -10.005 1 1 720 . 7 1 1 A 96 96 THR N N 96 124.240 118.753 5.487 1 1 721 . 7 1 1 A 97 97 LEU H H 97 8.790 8.783 0.007 1 1 722 . 7 1 1 A 97 97 LEU HA H 97 4.400 5.044 -0.644 1 1 732 . 7 1 1 A 97 97 LEU N N 97 126.147 124.458 1.689 1 1 733 . 7 1 1 A 98 98 GLU H H 98 7.596 9.729 -2.133 1 1 734 . 7 1 1 A 98 98 GLU HA H 98 5.102 4.983 0.119 1 1 739 . 7 1 1 A 98 98 GLU N N 98 116.937 122.337 -5.400 1 1 740 . 7 1 1 A 99 99 SER H H 99 8.906 8.541 0.365 1 1 741 . 7 1 1 A 99 99 SER HA H 99 4.504 4.959 -0.455 1 1 744 . 7 1 1 A 99 99 SER CA C 99 54.010 56.532 -2.522 1 1 745 . 7 1 1 A 99 99 SER CB C 99 63.876 65.447 -1.571 1 1 746 . 7 1 1 A 99 99 SER N N 99 117.823 117.080 0.743 1 1 747 . 7 1 1 A 100 100 GLY H H 100 7.250 7.665 -0.415 1 1 748 . 7 1 1 A 100 100 GLY HA2 H 100 4.872 3.814 1.058 1 1 749 . 7 1 1 A 100 100 GLY HA3 H 100 3.731 3.922 -0.191 1 1 750 . 7 1 1 A 100 100 GLY N N 100 109.436 109.567 -0.131 1 1 751 . 7 1 1 A 101 101 GLU H H 101 9.661 8.602 1.059 1 1 752 . 7 1 1 A 101 101 GLU HA H 101 5.643 4.789 0.854 1 1 757 . 7 1 1 A 101 101 GLU CA C 101 52.584 54.697 -2.113 1 1 758 . 7 1 1 A 101 101 GLU CB C 101 31.750 32.658 -0.908 1 1 759 . 7 1 1 A 101 101 GLU N N 101 126.793 120.266 6.527 1 1 760 . 7 1 1 A 102 102 PHE H H 102 10.441 8.748 1.693 1 1 761 . 7 1 1 A 102 102 PHE HA H 102 5.248 5.196 0.052 1 1 768 . 7 1 1 A 102 102 PHE CA C 102 53.537 56.121 -2.584 1 1 769 . 7 1 1 A 102 102 PHE N N 102 131.837 123.136 8.701 1 1 770 . 7 1 1 A 103 103 GLN H H 103 9.135 9.688 -0.553 1 1 771 . 7 1 1 A 103 103 GLN HA H 103 5.205 4.920 0.285 1 1 776 . 7 1 1 A 103 103 GLN CA C 103 50.925 54.694 -3.769 1 1 777 . 7 1 1 A 103 103 GLN N N 103 127.720 126.345 1.375 1 1 778 . 7 1 1 A 104 104 VAL H H 104 8.937 10.012 -1.075 1 1 779 . 7 1 1 A 104 104 VAL HA H 104 4.780 5.149 -0.369 1 1 787 . 7 1 1 A 104 104 VAL CA C 104 57.086 61.438 -4.352 1 1 789 . 7 1 1 A 104 104 VAL N N 104 120.097 126.672 -6.575 1 1 790 . 7 1 1 A 105 105 TYR H H 105 9.108 9.894 -0.786 1 1 791 . 7 1 1 A 105 105 TYR HA H 105 4.834 5.284 -0.450 1 1 798 . 7 1 1 A 105 105 TYR CA C 105 54.486 57.304 -2.818 1 1 799 . 7 1 1 A 105 105 TYR N N 105 128.426 128.777 -0.351 1 1 800 . 7 1 1 A 106 106 LYS H H 106 5.945 8.838 -2.893 1 1 805 . 7 1 1 A 106 106 LYS N N 106 129.163 124.250 4.913 1 1 806 . 7 1 1 A 107 107 GLN H H 107 8.526 8.313 0.213 1 1 807 . 7 1 1 A 107 107 GLN HA H 107 5.160 5.399 -0.239 1 1 812 . 7 1 1 A 107 107 GLN CA C 107 52.584 54.011 -1.427 1 1 813 . 7 1 1 A 107 107 GLN CB C 107 26.175 29.036 -2.861 1 1 814 . 7 1 1 A 107 107 GLN N N 107 125.978 125.566 0.412 1 1 815 . 7 1 1 A 108 108 SER H H 108 8.621 8.697 -0.076 1 1 816 . 7 1 1 A 108 108 SER HA H 108 4.403 4.213 0.190 1 1 819 . 7 1 1 A 108 108 SER CA C 108 58.521 60.502 -1.981 1 1 820 . 7 1 1 A 108 108 SER CB C 108 60.737 63.334 -2.597 1 1 821 . 7 1 1 A 108 108 SER N N 108 117.542 115.257 2.285 1 1 822 . 7 1 1 A 109 109 HIS H H 109 10.381 8.037 2.344 1 1 823 . 7 1 1 A 109 109 HIS HA H 109 4.594 4.582 0.012 1 1 828 . 7 1 1 A 109 109 HIS CA C 109 51.743 57.157 -5.414 1 1 829 . 7 1 1 A 109 109 HIS CB C 109 27.174 31.526 -4.352 1 1 830 . 7 1 1 A 109 109 HIS N N 109 118.449 118.046 0.403 1 1 831 . 7 1 1 A 110 110 SER H H 110 7.366 7.769 -0.403 1 1 832 . 7 1 1 A 110 110 SER HA H 110 4.870 4.893 -0.023 1 1 835 . 7 1 1 A 110 110 SER CB C 110 62.986 65.338 -2.352 1 1 836 . 7 1 1 A 110 110 SER N N 110 113.397 114.141 -0.744 1 1 837 . 7 1 1 A 111 111 ALA H H 111 8.541 8.109 0.432 1 1 838 . 7 1 1 A 111 111 ALA HA H 111 4.826 4.921 -0.095 1 1 842 . 7 1 1 A 111 111 ALA CA C 111 49.015 51.555 -2.540 1 1 843 . 7 1 1 A 111 111 ALA CB C 111 20.256 22.573 -2.317 1 1 844 . 7 1 1 A 111 111 ALA N N 111 117.786 122.610 -4.824 1 1 845 . 7 1 1 A 112 112 LEU H H 112 8.529 9.761 -1.232 1 1 846 . 7 1 1 A 112 112 LEU HA H 112 5.680 5.236 0.444 1 1 855 . 7 1 1 A 112 112 LEU CA C 112 51.818 53.792 -1.974 1 1 856 . 7 1 1 A 112 112 LEU N N 112 116.345 118.672 -2.327 1 1 857 . 7 1 1 A 113 113 THR H H 113 8.758 9.019 -0.261 1 1 858 . 7 1 1 A 113 113 THR HA H 113 5.563 5.391 0.172 1 1 863 . 7 1 1 A 113 113 THR CA C 113 54.458 60.923 -6.465 1 1 864 . 7 1 1 A 113 113 THR CB C 113 68.586 72.744 -4.158 1 1 866 . 7 1 1 A 113 113 THR N N 113 110.469 117.938 -7.469 1 1 867 . 7 1 1 A 114 114 ALA H H 114 8.829 8.516 0.313 1 1 868 . 7 1 1 A 114 114 ALA HA H 114 4.466 4.996 -0.530 1 1 872 . 7 1 1 A 114 114 ALA CA C 114 48.886 51.738 -2.852 1 1 873 . 7 1 1 A 114 114 ALA CB C 114 21.583 21.569 0.014 1 1 874 . 7 1 1 A 114 114 ALA N N 114 121.456 124.337 -2.881 1 1 875 . 7 1 1 A 115 115 LEU H H 115 8.407 9.561 -1.154 1 1 876 . 7 1 1 A 115 115 LEU HA H 115 4.814 4.428 0.386 1 1 886 . 7 1 1 A 115 115 LEU N N 115 119.223 123.527 -4.304 1 1 887 . 7 1 1 A 116 116 GLN H H 116 9.720 9.531 0.189 1 1 888 . 7 1 1 A 116 116 GLN HA H 116 5.312 4.792 0.520 1 1 893 . 7 1 1 A 116 116 GLN CA C 116 50.544 54.144 -3.600 1 1 894 . 7 1 1 A 116 116 GLN N N 116 127.827 125.951 1.876 1 1 895 . 7 1 1 A 117 117 THR H H 117 9.663 8.220 1.443 1 1 896 . 7 1 1 A 117 117 THR HA H 117 4.198 4.732 -0.534 1 1 901 . 7 1 1 A 117 117 THR CA C 117 64.037 60.677 3.360 1 1 902 . 7 1 1 A 117 117 THR CB C 117 66.868 71.852 -4.984 1 1 904 . 7 1 1 A 117 117 THR N N 117 128.929 120.325 8.604 1 1 905 . 7 1 1 A 118 118 GLU H H 118 9.486 9.297 0.189 1 1 906 . 7 1 1 A 118 118 GLU HA H 118 4.885 4.390 0.495 1 1 911 . 7 1 1 A 118 118 GLU N N 118 123.497 124.487 -0.990 1 1 912 . 7 1 1 A 119 119 GLN H H 119 8.076 7.390 0.686 1 1 913 . 7 1 1 A 119 119 GLN HA H 119 5.331 4.825 0.506 1 1 916 . 7 1 1 A 119 119 GLN CA C 119 51.858 54.292 -2.434 1 1 917 . 7 1 1 A 119 119 GLN N N 119 118.023 117.818 0.205 1 1 918 . 7 1 1 A 120 120 GLU H H 120 9.078 8.444 0.634 1 1 919 . 7 1 1 A 120 120 GLU HA H 120 5.071 5.018 0.053 1 1 924 . 7 1 1 A 120 120 GLU N N 120 118.433 123.509 -5.076 1 1 925 . 7 1 1 A 121 121 GLN H H 121 7.711 8.916 -1.205 1 1 926 . 7 1 1 A 121 121 GLN HA H 121 4.430 5.129 -0.699 1 1 933 . 7 1 1 A 121 121 GLN CA C 121 53.996 54.656 -0.660 1 1 934 . 7 1 1 A 121 121 GLN CB C 121 27.158 32.915 -5.757 1 1 936 . 7 1 1 A 121 121 GLN N N 121 122.412 117.885 4.527 1 1 938 . 7 1 1 A 122 122 ASP H H 122 8.675 10.258 -1.583 1 1 939 . 7 1 1 A 122 122 ASP HA H 122 4.632 5.290 -0.658 1 1 942 . 7 1 1 A 122 122 ASP CA C 122 48.797 50.497 -1.700 1 1 943 . 7 1 1 A 122 122 ASP CB C 122 39.852 42.535 -2.683 1 1 944 . 7 1 1 A 122 122 ASP N N 122 128.625 121.626 6.999 1 1 945 . 7 1 1 A 123 123 PRO CA C 123 61.579 62.716 -1.137 1 1 946 . 7 1 1 A 123 123 PRO CB C 123 29.597 29.537 0.060 1 1 948 . 7 1 1 A 124 124 GLU H H 124 8.297 8.616 -0.319 1 1 949 . 7 1 1 A 124 124 GLU HA H 124 4.196 4.038 0.158 1 1 954 . 7 1 1 A 124 124 GLU CA C 124 53.025 57.548 -4.523 1 1 955 . 7 1 1 A 124 124 GLU CB C 124 27.927 30.772 -2.845 1 1 957 . 7 1 1 A 124 124 GLU N N 124 115.538 121.452 -5.914 1 1 958 . 7 1 1 A 125 125 HIS H H 125 7.419 7.271 0.148 1 1 959 . 7 1 1 A 125 125 HIS HA H 125 4.833 4.651 0.182 1 1 964 . 7 1 1 A 125 125 HIS CA C 125 51.886 56.162 -4.276 1 1 965 . 7 1 1 A 125 125 HIS CB C 125 26.387 30.883 -4.496 1 1 966 . 7 1 1 A 125 125 HIS N N 125 117.464 114.487 2.977 1 1 967 . 7 1 1 A 126 126 SER H H 126 8.441 8.618 -0.177 1 1 968 . 7 1 1 A 126 126 SER HA H 126 4.261 4.708 -0.447 1 1 971 . 7 1 1 A 126 126 SER CA C 126 57.988 57.250 0.738 1 1 972 . 7 1 1 A 126 126 SER N N 126 117.954 113.823 4.131 1 1 973 . 7 1 1 A 127 127 GLU H H 127 9.221 7.973 1.248 1 1 974 . 7 1 1 A 127 127 GLU HA H 127 4.366 4.442 -0.076 1 1 979 . 7 1 1 A 127 127 GLU CA C 127 53.707 56.117 -2.410 1 1 980 . 7 1 1 A 127 127 GLU CB C 127 25.492 30.466 -4.974 1 1 981 . 7 1 1 A 127 127 GLU N N 127 120.404 120.544 -0.140 1 1 982 . 7 1 1 A 128 128 LYS H H 128 8.262 8.103 0.159 1 1 983 . 7 1 1 A 128 128 LYS HA H 128 4.661 4.083 0.578 1 1 990 . 7 1 1 A 128 128 LYS CA C 128 52.264 57.463 -5.199 1 1 991 . 7 1 1 A 128 128 LYS CB C 128 32.404 31.530 0.874 1 1 994 . 7 1 1 A 128 128 LYS N N 128 122.166 116.972 5.194 1 1 995 . 7 1 1 A 129 129 MET H H 129 8.242 9.749 -1.507 1 1 996 . 7 1 1 A 129 129 MET HA H 129 5.012 4.932 0.080 1 1 1001 . 7 1 1 A 129 129 MET CA C 129 50.958 54.351 -3.393 1 1 1003 . 7 1 1 A 129 129 MET N N 129 119.422 116.705 2.717 1 1 1004 . 7 1 1 A 130 130 VAL H H 130 9.200 9.787 -0.587 1 1 1005 . 7 1 1 A 130 130 VAL HA H 130 4.609 4.698 -0.089 1 1 1013 . 7 1 1 A 130 130 VAL CA C 130 56.296 60.122 -3.826 1 1 1014 . 7 1 1 A 130 130 VAL CB C 130 32.606 36.457 -3.851 1 1 1015 . 7 1 1 A 130 130 VAL N N 130 118.290 123.834 -5.544 1 1 1016 . 7 1 1 A 131 131 ALA H H 131 8.368 8.605 -0.237 1 1 1017 . 7 1 1 A 131 131 ALA HA H 131 4.654 5.037 -0.383 1 1 1021 . 7 1 1 A 131 131 ALA CA C 131 49.739 51.834 -2.095 1 1 1022 . 7 1 1 A 131 131 ALA CB C 131 15.351 20.802 -5.451 1 1 1023 . 7 1 1 A 131 131 ALA N N 131 126.734 124.702 2.032 1 1 1024 . 7 1 1 A 132 132 LYS H H 132 7.732 8.371 -0.639 1 1 1025 . 7 1 1 A 132 132 LYS HA H 132 4.171 4.719 -0.548 1 1 1028 . 7 1 1 A 132 132 LYS N N 132 127.309 120.806 6.503 1 1 1029 . 7 1 1 A 133 133 ARG H H 133 8.193 8.442 -0.249 1 1 1030 . 7 1 1 A 133 133 ARG HA H 133 5.073 4.614 0.459 1 1 1038 . 7 1 1 A 133 133 ARG N N 133 122.190 122.330 -0.140 1 1 1040 . 7 1 1 A 134 134 ARG H H 134 7.539 8.738 -1.199 1 1 1041 . 7 1 1 A 134 134 ARG HA H 134 4.667 4.767 -0.100 1 1 1049 . 7 1 1 A 134 134 ARG CA C 134 52.584 54.746 -2.162 1 1 1050 . 7 1 1 A 134 134 ARG CB C 134 31.325 31.449 -0.124 1 1 1052 . 7 1 1 A 134 134 ARG N N 134 121.632 123.625 -1.993 1 1 1054 . 7 1 1 A 135 135 PHE H H 135 8.816 9.233 -0.417 1 1 1055 . 7 1 1 A 135 135 PHE HA H 135 5.680 5.316 0.364 1 1 1062 . 7 1 1 A 135 135 PHE N N 135 125.107 124.297 0.810 1 1 1063 . 7 1 1 A 136 136 ARG H H 136 7.741 9.729 -1.988 1 1 1064 . 7 1 1 A 136 136 ARG HA H 136 4.402 4.791 -0.389 1 1 1068 . 7 1 1 A 136 136 ARG N N 136 125.640 125.196 0.444 1 1 1070 . 7 1 1 A 137 137 ILE H H 137 8.556 8.762 -0.206 1 1 1071 . 7 1 1 A 137 137 ILE HA H 137 3.912 4.311 -0.399 1 1 1076 . 7 1 1 A 137 137 ILE CA C 137 55.676 61.412 -5.736 1 1 1079 . 7 1 1 A 137 137 ILE N N 137 122.891 127.930 -5.039 1 1 1080 . 7 1 1 A 138 138 GLY H H 138 8.676 9.624 -0.948 1 1 1081 . 7 1 1 A 138 138 GLY HA2 H 138 3.740 4.125 -0.385 1 1 1082 . 7 1 1 A 138 138 GLY HA3 H 138 2.982 4.138 -1.156 1 1 1083 . 7 1 1 A 138 138 GLY CA C 138 41.908 46.042 -4.134 1 1 1084 . 7 1 1 A 138 138 GLY N N 138 117.058 116.010 1.048 1 1 1085 . 7 1 1 A 139 139 ASP H H 139 7.858 7.577 0.281 1 1 1086 . 7 1 1 A 139 139 ASP HA H 139 4.753 4.621 0.132 1 1 1089 . 7 1 1 A 139 139 ASP CA C 139 52.584 54.902 -2.318 1 1 1090 . 7 1 1 A 139 139 ASP CB C 139 43.062 41.509 1.553 1 1 1091 . 7 1 1 A 139 139 ASP N N 139 124.516 120.444 4.072 1 1 1092 . 7 1 1 A 140 140 ILE H H 140 8.354 8.957 -0.603 1 1 1093 . 7 1 1 A 140 140 ILE HA H 140 4.473 4.584 -0.111 1 1 1103 . 7 1 1 A 140 140 ILE CB C 140 36.173 38.392 -2.219 1 1 1105 . 7 1 1 A 140 140 ILE N N 140 120.679 125.716 -5.037 1 1 1106 . 7 1 1 A 141 141 ALA H H 141 8.708 8.063 0.645 1 1 1107 . 7 1 1 A 141 141 ALA HA H 141 4.862 4.283 0.579 1 1 1111 . 7 1 1 A 141 141 ALA CA C 141 47.968 52.347 -4.379 1 1 1112 . 7 1 1 A 141 141 ALA CB C 141 21.733 18.963 2.770 1 1 1113 . 7 1 1 A 141 141 ALA N N 141 130.144 130.276 -0.132 1 1 1114 . 7 1 1 A 142 142 GLY H H 142 7.888 8.153 -0.265 1 1 1115 . 7 1 1 A 142 142 GLY HA2 H 142 4.519 3.875 0.644 1 1 1116 . 7 1 1 A 142 142 GLY HA3 H 142 3.634 3.919 -0.285 1 1 1117 . 7 1 1 A 142 142 GLY N N 142 102.272 108.517 -6.245 1 1 1118 . 7 1 1 A 143 143 GLU H H 143 8.068 7.942 0.126 1 1 1119 . 7 1 1 A 143 143 GLU HA H 143 4.577 4.766 -0.189 1 1 1124 . 7 1 1 A 143 143 GLU N N 143 120.569 118.288 2.281 1 1 1125 . 7 1 1 A 144 144 HIS H H 144 8.478 8.978 -0.500 1 1 1126 . 7 1 1 A 144 144 HIS HA H 144 4.968 4.746 0.222 1 1 1131 . 7 1 1 A 144 144 HIS N N 144 124.275 124.772 -0.497 1 1 1132 . 7 1 1 A 145 145 THR H H 145 9.031 9.293 -0.262 1 1 1133 . 7 1 1 A 145 145 THR HA H 145 4.025 4.528 -0.503 1 1 1138 . 7 1 1 A 145 145 THR CA C 145 61.247 61.755 -0.508 1 1 1139 . 7 1 1 A 145 145 THR CB C 145 65.181 69.256 -4.075 1 1 1141 . 7 1 1 A 145 145 THR N N 145 125.828 120.410 5.418 1 1 1142 . 7 1 1 A 146 146 SER H H 146 9.077 8.920 0.157 1 1 1143 . 7 1 1 A 146 146 SER HA H 146 4.684 4.652 0.032 1 1 1145 . 7 1 1 A 146 146 SER CA C 146 56.067 59.366 -3.299 1 1 1146 . 7 1 1 A 146 146 SER CB C 146 60.510 63.030 -2.520 1 1 1147 . 7 1 1 A 146 146 SER N N 146 124.154 125.034 -0.880 1 1 1148 . 7 1 1 A 147 147 PHE H H 147 9.049 8.838 0.211 1 1 1149 . 7 1 1 A 147 147 PHE HA H 147 4.022 4.601 -0.579 1 1 1154 . 7 1 1 A 147 147 PHE N N 147 127.670 125.126 2.544 1 1 1155 . 7 1 1 A 148 148 ASP H H 148 8.504 8.511 -0.007 1 1 1156 . 7 1 1 A 148 148 ASP HA H 148 4.422 4.590 -0.168 1 1 1158 . 7 1 1 A 148 148 ASP CA C 148 52.584 56.707 -4.123 1 1 1159 . 7 1 1 A 148 148 ASP CB C 148 37.800 40.919 -3.119 1 1 1160 . 7 1 1 A 148 148 ASP N N 148 114.377 120.741 -6.364 1 1 1161 . 7 1 1 A 149 149 LYS H H 149 7.380 8.629 -1.249 1 1 1162 . 7 1 1 A 149 149 LYS HA H 149 4.487 4.215 0.272 1 1 1171 . 7 1 1 A 149 149 LYS CA C 149 51.735 57.995 -6.260 1 1 1172 . 7 1 1 A 149 149 LYS CB C 149 30.162 32.387 -2.225 1 1 1175 . 7 1 1 A 149 149 LYS N N 149 119.137 115.912 3.225 1 1 1176 . 7 1 1 A 150 150 LEU H H 150 6.886 7.913 -1.027 1 1 1177 . 7 1 1 A 150 150 LEU HA H 150 3.996 4.657 -0.661 1 1 1186 . 7 1 1 A 150 150 LEU CA C 150 50.502 52.158 -1.656 1 1 1187 . 7 1 1 A 150 150 LEU N N 150 120.614 117.424 3.190 1 1 1188 . 7 1 1 A 151 151 PRO CB C 151 29.567 31.383 -1.816 1 1 1190 . 7 1 1 A 152 152 LYS H H 152 8.076 8.852 -0.776 1 1 1191 . 7 1 1 A 152 152 LYS HA H 152 4.346 4.541 -0.195 1 1 1195 . 7 1 1 A 152 152 LYS CA C 152 53.182 56.941 -3.759 1 1 1196 . 7 1 1 A 152 152 LYS CB C 152 31.487 34.401 -2.914 1 1 1198 . 7 1 1 A 152 152 LYS N N 152 118.133 120.805 -2.672 1 1 1199 . 7 1 1 A 153 153 ASP H H 153 7.982 7.949 0.033 1 1 1200 . 7 1 1 A 153 153 ASP HA H 153 4.402 4.968 -0.566 1 1 1203 . 7 1 1 A 153 153 ASP CA C 153 52.584 53.141 -0.557 1 1 1204 . 7 1 1 A 153 153 ASP CB C 153 37.762 40.816 -3.054 1 1 1205 . 7 1 1 A 153 153 ASP N N 153 115.735 114.020 1.715 1 1 1206 . 7 1 1 A 154 154 VAL H H 154 6.987 7.549 -0.562 1 1 1207 . 7 1 1 A 154 154 VAL HA H 154 4.406 4.207 0.199 1 1 1215 . 7 1 1 A 154 154 VAL CA C 154 58.408 61.513 -3.105 1 1 1216 . 7 1 1 A 154 154 VAL CB C 154 32.617 31.642 0.975 1 1 1217 . 7 1 1 A 154 154 VAL N N 154 116.266 120.346 -4.080 1 1 1218 . 7 1 1 A 155 155 MET H H 155 8.444 8.467 -0.023 1 1 1219 . 7 1 1 A 155 155 MET HA H 155 5.416 4.775 0.641 1 1 1224 . 7 1 1 A 155 155 MET CA C 155 51.183 54.310 -3.127 1 1 1226 . 7 1 1 A 155 155 MET N N 155 124.950 127.125 -2.175 1 1 1227 . 7 1 1 A 156 156 ALA H H 156 9.226 8.790 0.436 1 1 1228 . 7 1 1 A 156 156 ALA HA H 156 4.693 5.067 -0.374 1 1 1232 . 7 1 1 A 156 156 ALA CA C 156 48.379 51.029 -2.650 1 1 1233 . 7 1 1 A 156 156 ALA CB C 156 21.051 20.805 0.246 1 1 1234 . 7 1 1 A 156 156 ALA N N 156 129.938 128.036 1.902 1 1 1235 . 7 1 1 A 157 157 THR H H 157 8.554 8.686 -0.132 1 1 1236 . 7 1 1 A 157 157 THR HA H 157 4.839 5.561 -0.722 1 1 1241 . 7 1 1 A 157 157 THR CA C 157 59.555 61.484 -1.929 1 1 1242 . 7 1 1 A 157 157 THR CB C 157 68.575 71.093 -2.518 1 1 1244 . 7 1 1 A 157 157 THR N N 157 118.815 117.942 0.873 1 1 1245 . 7 1 1 A 158 158 TYR H H 158 9.974 10.114 -0.140 1 1 1246 . 7 1 1 A 158 158 TYR HA H 158 4.435 5.807 -1.372 1 1 1253 . 7 1 1 A 158 158 TYR N N 158 126.958 123.099 3.859 1 1 1254 . 7 1 1 A 159 159 ARG H H 159 8.909 8.629 0.280 1 1 1255 . 7 1 1 A 159 159 ARG HA H 159 5.444 5.397 0.047 1 1 1263 . 7 1 1 A 159 159 ARG CA C 159 51.933 54.569 -2.636 1 1 1264 . 7 1 1 A 159 159 ARG N N 159 121.721 118.948 2.773 1 1 1266 . 7 1 1 A 160 160 GLY H H 160 8.910 8.466 0.444 1 1 1267 . 7 1 1 A 160 160 GLY HA2 H 160 4.904 4.386 0.518 1 1 1268 . 7 1 1 A 160 160 GLY HA3 H 160 4.484 4.545 -0.061 1 1 1269 . 7 1 1 A 160 160 GLY N N 160 113.921 106.891 7.030 1 1 1270 . 7 1 1 A 161 161 THR H H 161 9.110 9.386 -0.276 1 1 1271 . 7 1 1 A 161 161 THR HA H 161 4.810 5.191 -0.381 1 1 1276 . 7 1 1 A 161 161 THR CA C 161 59.603 61.026 -1.423 1 1 1277 . 7 1 1 A 161 161 THR CB C 161 69.909 72.494 -2.585 1 1 1279 . 7 1 1 A 161 161 THR N N 161 126.813 115.766 11.047 1 1 1280 . 7 1 1 A 162 162 ALA H H 162 7.137 9.823 -2.686 1 1 1281 . 7 1 1 A 162 162 ALA HA H 162 5.361 4.304 1.057 1 1 1285 . 7 1 1 A 162 162 ALA CA C 162 46.573 50.209 -3.636 1 1 1286 . 7 1 1 A 162 162 ALA CB C 162 20.959 23.360 -2.401 1 1 1287 . 7 1 1 A 162 162 ALA N N 162 128.111 123.793 4.318 1 1 1288 . 7 1 1 A 163 163 PHE H H 163 8.587 8.643 -0.056 1 1 1289 . 7 1 1 A 163 163 PHE HA H 163 5.538 4.980 0.558 1 1 1296 . 7 1 1 A 163 163 PHE N N 163 117.349 116.218 1.131 1 1 1297 . 7 1 1 A 164 164 GLY H H 164 8.650 9.043 -0.393 1 1 1298 . 7 1 1 A 164 164 GLY HA2 H 164 4.210 4.153 0.057 1 1 1299 . 7 1 1 A 164 164 GLY HA3 H 164 3.285 4.241 -0.956 1 1 1300 . 7 1 1 A 164 164 GLY CA C 164 40.377 44.307 -3.930 1 1 1301 . 7 1 1 A 164 164 GLY N N 164 108.839 112.232 -3.393 1 1 1302 . 7 1 1 A 165 165 SER H H 165 7.684 9.241 -1.557 1 1 1303 . 7 1 1 A 165 165 SER HA H 165 3.458 4.117 -0.659 1 1 1304 . 7 1 1 A 165 165 SER N N 165 116.037 117.972 -1.935 1 1 1305 . 7 1 1 A 166 166 ASP H H 166 9.718 7.987 1.731 1 1 1306 . 7 1 1 A 166 166 ASP HA H 166 4.281 4.870 -0.589 1 1 1309 . 7 1 1 A 166 166 ASP CA C 166 52.584 53.905 -1.321 1 1 1310 . 7 1 1 A 166 166 ASP N N 166 125.166 119.446 5.720 1 1 1311 . 7 1 1 A 167 167 ASP H H 167 7.655 7.568 0.087 1 1 1312 . 7 1 1 A 167 167 ASP HA H 167 4.666 5.018 -0.352 1 1 1315 . 7 1 1 A 167 167 ASP CB C 167 38.948 44.269 -5.321 1 1 1316 . 7 1 1 A 167 167 ASP N N 167 117.491 118.753 -1.262 1 1 1317 . 7 1 1 A 168 168 ALA H H 168 8.585 8.496 0.089 1 1 1318 . 7 1 1 A 168 168 ALA HA H 168 5.012 4.161 0.851 1 1 1322 . 7 1 1 A 168 168 ALA CA C 168 47.485 55.055 -7.570 1 1 1323 . 7 1 1 A 168 168 ALA N N 168 128.834 122.998 5.836 1 1 1324 . 7 1 1 A 169 169 GLY H H 169 8.472 7.720 0.752 1 1 1325 . 7 1 1 A 169 169 GLY HA2 H 169 4.404 4.108 0.296 1 1 1326 . 7 1 1 A 169 169 GLY HA3 H 169 4.051 4.146 -0.095 1 1 1327 . 7 1 1 A 169 169 GLY CA C 169 43.257 46.044 -2.787 1 1 1328 . 7 1 1 A 169 169 GLY N N 169 107.133 102.993 4.140 1 1 1329 . 7 1 1 A 170 170 GLY H H 170 7.229 6.837 0.392 1 1 1330 . 7 1 1 A 170 170 GLY HA2 H 170 4.223 3.900 0.323 1 1 1331 . 7 1 1 A 170 170 GLY HA3 H 170 3.781 4.109 -0.328 1 1 1332 . 7 1 1 A 170 170 GLY CA C 170 43.310 45.613 -2.303 1 1 1333 . 7 1 1 A 170 170 GLY N N 170 107.542 109.292 -1.750 1 1 1334 . 7 1 1 A 171 171 LYS H H 171 9.641 8.667 0.974 1 1 1335 . 7 1 1 A 171 171 LYS HA H 171 5.129 4.997 0.132 1 1 1342 . 7 1 1 A 171 171 LYS CA C 171 51.355 55.053 -3.698 1 1 1343 . 7 1 1 A 171 171 LYS N N 171 124.322 120.623 3.699 1 1 1344 . 7 1 1 A 172 172 LEU H H 172 7.764 8.552 -0.788 1 1 1345 . 7 1 1 A 172 172 LEU HA H 172 4.973 5.052 -0.079 1 1 1353 . 7 1 1 A 172 172 LEU CA C 172 50.348 53.728 -3.380 1 1 1354 . 7 1 1 A 172 172 LEU N N 172 126.389 122.034 4.355 1 1 1355 . 7 1 1 A 173 173 THR H H 173 8.321 8.604 -0.283 1 1 1356 . 7 1 1 A 173 173 THR HA H 173 5.017 5.430 -0.413 1 1 1361 . 7 1 1 A 173 173 THR CA C 173 59.149 61.486 -2.337 1 1 1362 . 7 1 1 A 173 173 THR CB C 173 67.449 70.960 -3.511 1 1 1364 . 7 1 1 A 173 173 THR N N 173 123.553 115.512 8.041 1 1 1365 . 7 1 1 A 174 174 TYR H H 174 9.367 9.896 -0.529 1 1 1366 . 7 1 1 A 174 174 TYR HA H 174 4.660 5.293 -0.633 1 1 1373 . 7 1 1 A 174 174 TYR CB C 174 41.267 42.137 -0.870 1 1 1374 . 7 1 1 A 174 174 TYR N N 174 129.583 125.661 3.922 1 1 1375 . 7 1 1 A 175 175 THR H H 175 8.529 8.513 0.016 1 1 1376 . 7 1 1 A 175 175 THR HA H 175 5.388 5.291 0.097 1 1 1381 . 7 1 1 A 175 175 THR CA C 175 58.216 61.783 -3.567 1 1 1382 . 7 1 1 A 175 175 THR CB C 175 68.575 71.223 -2.648 1 1 1384 . 7 1 1 A 175 175 THR N N 175 125.967 115.439 10.528 1 1 1385 . 7 1 1 A 176 176 ILE H H 176 9.139 9.274 -0.135 1 1 1386 . 7 1 1 A 176 176 ILE HA H 176 4.382 5.010 -0.628 1 1 1395 . 7 1 1 A 176 176 ILE CA C 176 58.006 60.111 -2.105 1 1 1396 . 7 1 1 A 176 176 ILE CB C 176 38.881 42.446 -3.565 1 1 1400 . 7 1 1 A 176 176 ILE N N 176 123.715 125.945 -2.230 1 1 1401 . 7 1 1 A 177 177 ASP H H 177 8.501 9.893 -1.392 1 1 1402 . 7 1 1 A 177 177 ASP HA H 177 5.011 4.987 0.024 1 1 1405 . 7 1 1 A 177 177 ASP CA C 177 49.089 53.768 -4.679 1 1 1406 . 7 1 1 A 177 177 ASP CB C 177 39.282 42.580 -3.298 1 1 1407 . 7 1 1 A 177 177 ASP N N 177 125.978 123.616 2.362 1 1 1408 . 7 1 1 A 178 178 PHE H H 178 8.913 8.965 -0.052 1 1 1409 . 7 1 1 A 178 178 PHE HA H 178 3.993 3.886 0.107 1 1 1414 . 7 1 1 A 178 178 PHE CB C 178 34.588 38.821 -4.233 1 1 1415 . 7 1 1 A 178 178 PHE N N 178 123.522 127.448 -3.926 1 1 1416 . 7 1 1 A 179 179 ALA H H 179 8.487 8.814 -0.327 1 1 1417 . 7 1 1 A 179 179 ALA HA H 179 4.528 4.104 0.424 1 1 1421 . 7 1 1 A 179 179 ALA CA C 179 52.584 55.725 -3.141 1 1 1422 . 7 1 1 A 179 179 ALA CB C 179 15.666 18.791 -3.125 1 1 1423 . 7 1 1 A 179 179 ALA N N 179 124.061 125.795 -1.734 1 1 1424 . 7 1 1 A 180 180 ALA H H 180 7.162 7.930 -0.768 1 1 1425 . 7 1 1 A 180 180 ALA HA H 180 4.313 4.395 -0.082 1 1 1429 . 7 1 1 A 180 180 ALA CA C 180 49.006 51.469 -2.463 1 1 1430 . 7 1 1 A 180 180 ALA CB C 180 16.933 17.407 -0.474 1 1 1431 . 7 1 1 A 180 180 ALA N N 180 119.710 118.480 1.230 1 1 1432 . 7 1 1 A 181 181 LYS H H 181 8.092 9.500 -1.408 1 1 1433 . 7 1 1 A 181 181 LYS HA H 181 3.457 4.361 -0.904 1 1 1440 . 7 1 1 A 181 181 LYS CA C 181 54.783 56.793 -2.010 1 1 1441 . 7 1 1 A 181 181 LYS CB C 181 27.088 31.722 -4.634 1 1 1444 . 7 1 1 A 181 181 LYS N N 181 114.996 118.264 -3.268 1 1 1445 . 7 1 1 A 182 182 GLN H H 182 7.532 7.971 -0.439 1 1 1446 . 7 1 1 A 182 182 GLN HA H 182 5.304 5.150 0.154 1 1 1453 . 7 1 1 A 182 182 GLN CA C 182 51.473 54.802 -3.329 1 1 1454 . 7 1 1 A 182 182 GLN CB C 182 31.585 31.831 -0.246 1 1 1455 . 7 1 1 A 182 182 GLN N N 182 115.064 124.407 -9.343 1 1 1457 . 7 1 1 A 183 183 GLY H H 183 9.026 8.408 0.618 1 1 1458 . 7 1 1 A 183 183 GLY HA2 H 183 5.376 4.363 1.013 1 1 1459 . 7 1 1 A 183 183 GLY HA3 H 183 3.567 4.391 -0.824 1 1 1460 . 7 1 1 A 183 183 GLY CA C 183 42.361 46.123 -3.762 1 1 1461 . 7 1 1 A 183 183 GLY N N 183 111.505 113.163 -1.658 1 1 1462 . 7 1 1 A 184 184 HIS H H 184 7.508 8.218 -0.710 1 1 1463 . 7 1 1 A 184 184 HIS HA H 184 4.304 4.950 -0.646 1 1 1467 . 7 1 1 A 184 184 HIS CA C 184 52.793 55.511 -2.718 1 1 1468 . 7 1 1 A 184 184 HIS CB C 184 27.906 32.337 -4.431 1 1 1469 . 7 1 1 A 184 184 HIS N N 184 111.297 118.520 -7.223 1 1 1470 . 7 1 1 A 185 185 GLY H H 185 9.160 7.801 1.359 1 1 1471 . 7 1 1 A 185 185 GLY HA2 H 185 4.464 1.454 3.010 1 1 1472 . 7 1 1 A 185 185 GLY HA3 H 185 4.117 3.651 0.466 1 1 1473 . 7 1 1 A 185 185 GLY CA C 185 44.212 42.974 1.238 1 1 1474 . 7 1 1 A 185 185 GLY N N 185 107.398 109.247 -1.849 1 1 1475 . 7 1 1 A 186 186 LYS H H 186 9.170 8.142 1.028 1 1 1476 . 7 1 1 A 186 186 LYS HA H 186 4.925 4.933 -0.008 1 1 1481 . 7 1 1 A 186 186 LYS CB C 186 33.642 35.863 -2.221 1 1 1482 . 7 1 1 A 186 186 LYS N N 186 122.690 116.446 6.244 1 1 1483 . 7 1 1 A 187 187 ILE H H 187 8.444 9.220 -0.776 1 1 1484 . 7 1 1 A 187 187 ILE HA H 187 4.626 5.177 -0.551 1 1 1487 . 7 1 1 A 187 187 ILE N N 187 124.320 123.839 0.481 1 1 1488 . 7 1 1 A 188 188 GLU H H 188 8.590 9.390 -0.800 1 1 1489 . 7 1 1 A 188 188 GLU HA H 188 4.650 5.251 -0.601 1 1 1495 . 7 1 1 A 188 188 GLU N N 188 122.575 126.291 -3.716 1 1 1496 . 7 1 1 A 189 189 HIS H H 189 8.726 8.880 -0.154 1 1 1497 . 7 1 1 A 189 189 HIS HA H 189 4.055 4.742 -0.687 1 1 1501 . 7 1 1 A 189 189 HIS CA C 189 54.623 57.022 -2.399 1 1 1502 . 7 1 1 A 189 189 HIS CB C 189 24.997 31.838 -6.841 1 1 1503 . 7 1 1 A 189 189 HIS N N 189 111.381 121.453 -10.072 1 1 1504 . 7 1 1 A 190 190 LEU H H 190 9.715 7.713 2.002 1 1 1505 . 7 1 1 A 190 190 LEU HA H 190 4.379 4.197 0.182 1 1 1515 . 7 1 1 A 190 190 LEU N N 190 124.648 118.678 5.970 1 1 1516 . 7 1 1 A 191 191 LYS H H 191 10.099 8.694 1.405 1 1 1517 . 7 1 1 A 191 191 LYS HA H 191 3.736 3.999 -0.263 1 1 1524 . 7 1 1 A 191 191 LYS CA C 191 55.815 58.406 -2.591 1 1 1525 . 7 1 1 A 191 191 LYS CB C 191 30.201 32.651 -2.450 1 1 1527 . 7 1 1 A 191 191 LYS N N 191 123.618 120.373 3.245 1 1 1528 . 7 1 1 A 192 192 SER H H 192 6.991 7.568 -0.577 1 1 1529 . 7 1 1 A 192 192 SER HA H 192 4.743 4.842 -0.099 1 1 1532 . 7 1 1 A 192 192 SER CA C 192 51.974 55.367 -3.393 1 1 1533 . 7 1 1 A 192 192 SER CB C 192 60.005 65.476 -5.471 1 1 1534 . 7 1 1 A 192 192 SER N N 192 115.071 114.703 0.368 1 1 1535 . 7 1 1 A 193 193 PRO CB C 193 29.607 31.980 -2.373 1 1 1537 . 7 1 1 A 194 194 GLU H H 194 8.213 8.212 0.001 1 1 1538 . 7 1 1 A 194 194 GLU HA H 194 3.063 4.464 -1.401 1 1 1543 . 7 1 1 A 194 194 GLU CA C 194 54.185 57.310 -3.125 1 1 1545 . 7 1 1 A 194 194 GLU N N 194 114.055 117.868 -3.813 1 1 1546 . 7 1 1 A 195 195 LEU H H 195 7.082 7.170 -0.088 1 1 1547 . 7 1 1 A 195 195 LEU HA H 195 4.027 5.153 -1.126 1 1 1557 . 7 1 1 A 195 195 LEU CA C 195 51.361 54.434 -3.073 1 1 1558 . 7 1 1 A 195 195 LEU CB C 195 38.950 41.378 -2.428 1 1 1561 . 7 1 1 A 195 195 LEU N N 195 113.898 118.056 -4.158 1 1 1562 . 7 1 1 A 196 196 ASN H H 196 7.060 8.022 -0.962 1 1 1563 . 7 1 1 A 196 196 ASN HA H 196 4.638 4.848 -0.210 1 1 1567 . 7 1 1 A 196 196 ASN N N 196 119.196 118.142 1.054 1 1 1568 . 7 1 1 A 197 197 VAL H H 197 7.244 7.995 -0.751 1 1 1569 . 7 1 1 A 197 197 VAL HA H 197 4.540 4.759 -0.219 1 1 1577 . 7 1 1 A 197 197 VAL CA C 197 57.176 60.408 -3.232 1 1 1578 . 7 1 1 A 197 197 VAL N N 197 113.621 118.297 -4.676 1 1 1579 . 7 1 1 A 198 198 ASP H H 198 8.881 8.568 0.313 1 1 1580 . 7 1 1 A 198 198 ASP HA H 198 4.894 5.389 -0.495 1 1 1581 . 7 1 1 A 198 198 ASP N N 198 118.852 124.029 -5.177 1 1 1582 . 7 1 1 A 199 199 LEU H H 199 8.498 8.539 -0.041 1 1 1583 . 7 1 1 A 199 199 LEU HA H 199 4.317 5.266 -0.949 1 1 1591 . 7 1 1 A 199 199 LEU N N 199 124.078 119.646 4.432 1 1 1592 . 7 1 1 A 200 200 ALA H H 200 8.386 8.479 -0.093 1 1 1593 . 7 1 1 A 200 200 ALA HA H 200 4.295 4.717 -0.422 1 1 1597 . 7 1 1 A 200 200 ALA CA C 200 50.044 51.532 -1.488 1 1 1598 . 7 1 1 A 200 200 ALA CB C 200 17.985 20.539 -2.554 1 1 1599 . 7 1 1 A 200 200 ALA N N 200 127.315 122.826 4.489 1 1 1600 . 7 1 1 A 201 201 VAL H H 201 8.007 8.738 -0.731 1 1 1601 . 7 1 1 A 201 201 VAL HA H 201 4.577 4.674 -0.097 1 1 1609 . 7 1 1 A 201 201 VAL CA C 201 60.004 61.235 -1.231 1 1 1610 . 7 1 1 A 201 201 VAL CB C 201 28.863 35.797 -6.934 1 1 1611 . 7 1 1 A 201 201 VAL N N 201 119.409 118.111 1.298 1 1 1612 . 7 1 1 A 202 202 ALA H H 202 8.789 9.299 -0.510 1 1 1613 . 7 1 1 A 202 202 ALA HA H 202 4.630 5.281 -0.651 1 1 1617 . 7 1 1 A 202 202 ALA CA C 202 48.200 49.866 -1.666 1 1 1618 . 7 1 1 A 202 202 ALA N N 202 131.745 129.185 2.560 1 1 1619 . 7 1 1 A 203 203 TYR H H 203 8.522 9.173 -0.651 1 1 1620 . 7 1 1 A 203 203 TYR HA H 203 5.391 5.273 0.118 1 1 1627 . 7 1 1 A 203 203 TYR CA C 203 54.648 57.042 -2.394 1 1 1628 . 7 1 1 A 203 203 TYR CB C 203 37.315 38.398 -1.083 1 1 1629 . 7 1 1 A 203 203 TYR N N 203 117.786 124.221 -6.435 1 1 1630 . 7 1 1 A 204 204 ILE H H 204 8.209 8.618 -0.409 1 1 1631 . 7 1 1 A 204 204 ILE HA H 204 4.393 4.682 -0.289 1 1 1641 . 7 1 1 A 204 204 ILE CB C 204 36.807 39.411 -2.604 1 1 1644 . 7 1 1 A 204 204 ILE N N 204 120.602 124.906 -4.304 1 1 1645 . 7 1 1 A 205 205 LYS H H 205 9.340 8.590 0.750 1 1 1646 . 7 1 1 A 205 205 LYS HA H 205 4.756 4.336 0.420 1 1 1651 . 7 1 1 A 205 205 LYS CA C 205 50.844 60.756 -9.912 1 1 1652 . 7 1 1 A 205 205 LYS N N 205 127.960 124.143 3.817 1 1 1653 . 7 1 1 A 207 207 ASP H H 207 8.436 8.202 0.234 1 1 1654 . 7 1 1 A 207 207 ASP HA H 207 4.692 4.545 0.147 1 1 1657 . 7 1 1 A 207 207 ASP CA C 207 48.789 54.033 -5.244 1 1 1658 . 7 1 1 A 207 207 ASP CB C 207 38.377 40.239 -1.862 1 1 1659 . 7 1 1 A 207 207 ASP N N 207 123.098 125.206 -2.108 1 1 1660 . 7 1 1 A 208 208 GLU H H 208 8.880 8.115 0.765 1 1 1661 . 7 1 1 A 208 208 GLU HA H 208 3.994 4.206 -0.212 1 1 1666 . 7 1 1 A 208 208 GLU CA C 208 56.123 58.443 -2.320 1 1 1667 . 7 1 1 A 208 208 GLU CB C 208 25.794 30.476 -4.682 1 1 1669 . 7 1 1 A 208 208 GLU N N 208 119.042 121.357 -2.315 1 1 1670 . 7 1 1 A 209 209 LYS H H 209 7.681 7.981 -0.300 1 1 1671 . 7 1 1 A 209 209 LYS HA H 209 4.141 4.108 0.033 1 1 1680 . 7 1 1 A 209 209 LYS N N 209 119.252 115.378 3.874 1 1 1681 . 7 1 1 A 210 210 HIS H H 210 8.177 8.157 0.020 1 1 1682 . 7 1 1 A 210 210 HIS HA H 210 3.825 4.789 -0.964 1 1 1687 . 7 1 1 A 210 210 HIS CA C 210 54.205 54.716 -0.511 1 1 1688 . 7 1 1 A 210 210 HIS CB C 210 23.439 30.673 -7.234 1 1 1689 . 7 1 1 A 210 210 HIS N N 210 112.758 114.051 -1.293 1 1 1690 . 7 1 1 A 211 211 HIS H H 211 8.758 7.149 1.609 1 1 1691 . 7 1 1 A 211 211 HIS HA H 211 5.041 5.935 -0.894 1 1 1695 . 7 1 1 A 211 211 HIS CA C 211 50.450 53.464 -3.014 1 1 1696 . 7 1 1 A 211 211 HIS CB C 211 25.703 33.015 -7.312 1 1 1697 . 7 1 1 A 211 211 HIS N N 211 119.552 114.555 4.997 1 1 1698 . 7 1 1 A 212 212 ALA H H 212 8.556 8.014 0.542 1 1 1699 . 7 1 1 A 212 212 ALA HA H 212 4.712 3.764 0.948 1 1 1703 . 7 1 1 A 212 212 ALA CA C 212 49.886 51.604 -1.718 1 1 1704 . 7 1 1 A 212 212 ALA CB C 212 18.860 17.595 1.265 1 1 1705 . 7 1 1 A 212 212 ALA N N 212 123.780 121.259 2.521 1 1 1706 . 7 1 1 A 213 213 VAL H H 213 9.338 8.104 1.234 1 1 1707 . 7 1 1 A 213 213 VAL HA H 213 5.074 5.016 0.058 1 1 1715 . 7 1 1 A 213 213 VAL CA C 213 57.486 60.725 -3.239 1 1 1716 . 7 1 1 A 213 213 VAL CB C 213 33.938 34.694 -0.756 1 1 1717 . 7 1 1 A 213 213 VAL N N 213 124.742 119.632 5.110 1 1 1718 . 7 1 1 A 214 214 ILE H H 214 8.962 8.605 0.357 1 1 1719 . 7 1 1 A 214 214 ILE HA H 214 4.434 4.763 -0.329 1 1 1726 . 7 1 1 A 214 214 ILE N N 214 122.881 126.901 -4.020 1 1 1727 . 7 1 1 A 215 215 SER H H 215 8.558 8.570 -0.012 1 1 1728 . 7 1 1 A 215 215 SER HA H 215 5.001 5.546 -0.545 1 1 1731 . 7 1 1 A 215 215 SER CA C 215 53.230 56.154 -2.924 1 1 1732 . 7 1 1 A 215 215 SER CB C 215 62.077 65.687 -3.610 1 1 1733 . 7 1 1 A 215 215 SER N N 215 122.891 121.525 1.366 1 1 1734 . 7 1 1 A 216 216 GLY H H 216 7.282 8.999 -1.717 1 1 1735 . 7 1 1 A 216 216 GLY HA2 H 216 4.515 4.237 0.278 1 1 1736 . 7 1 1 A 216 216 GLY HA3 H 216 3.473 4.245 -0.772 1 1 1737 . 7 1 1 A 216 216 GLY CA C 216 42.816 45.578 -2.762 1 1 1738 . 7 1 1 A 216 216 GLY N N 216 110.899 109.390 1.509 1 1 1739 . 7 1 1 A 217 217 SER H H 217 8.673 8.844 -0.171 1 1 1740 . 7 1 1 A 217 217 SER HA H 217 5.127 5.168 -0.041 1 1 1743 . 7 1 1 A 217 217 SER CA C 217 56.266 56.924 -0.658 1 1 1744 . 7 1 1 A 217 217 SER N N 217 117.164 112.740 4.424 1 1 1745 . 7 1 1 A 218 218 VAL H H 218 7.451 8.863 -1.412 1 1 1746 . 7 1 1 A 218 218 VAL HA H 218 5.128 4.560 0.568 1 1 1754 . 7 1 1 A 218 218 VAL CA C 218 56.637 61.603 -4.966 1 1 1755 . 7 1 1 A 218 218 VAL N N 218 117.826 124.893 -7.067 1 1 1756 . 7 1 1 A 219 219 LEU H H 219 9.022 8.775 0.247 1 1 1757 . 7 1 1 A 219 219 LEU HA H 219 5.387 5.081 0.306 1 1 1767 . 7 1 1 A 219 219 LEU CA C 219 50.450 54.178 -3.728 1 1 1768 . 7 1 1 A 219 219 LEU N N 219 124.820 127.001 -2.181 1 1 1769 . 7 1 1 A 220 220 TYR H H 220 8.816 9.156 -0.340 1 1 1770 . 7 1 1 A 220 220 TYR HA H 220 4.834 4.965 -0.131 1 1 1777 . 7 1 1 A 220 220 TYR N N 220 121.249 125.676 -4.427 1 1 1778 . 7 1 1 A 221 221 ASN H H 221 9.191 8.628 0.563 1 1 1779 . 7 1 1 A 221 221 ASN HA H 221 4.048 4.458 -0.410 1 1 1784 . 7 1 1 A 221 221 ASN CA C 221 51.647 55.130 -3.483 1 1 1785 . 7 1 1 A 221 221 ASN CB C 221 36.640 38.214 -1.574 1 1 1786 . 7 1 1 A 221 221 ASN N N 221 129.865 125.142 4.723 1 1 1788 . 7 1 1 A 222 222 GLN H H 222 8.468 6.524 1.944 1 1 1789 . 7 1 1 A 222 222 GLN HA H 222 3.671 3.957 -0.286 1 1 1794 . 7 1 1 A 222 222 GLN CA C 222 55.075 57.842 -2.767 1 1 1795 . 7 1 1 A 222 222 GLN CB C 222 24.663 29.467 -4.804 1 1 1797 . 7 1 1 A 222 222 GLN N N 222 108.367 118.172 -9.805 1 1 1798 . 7 1 1 A 223 223 ASP H H 223 7.797 7.954 -0.157 1 1 1799 . 7 1 1 A 223 223 ASP HA H 223 4.986 4.897 0.089 1 1 1802 . 7 1 1 A 223 223 ASP N N 223 120.842 118.147 2.695 1 1 1803 . 7 1 1 A 224 224 GLU H H 224 8.731 8.000 0.731 1 1 1804 . 7 1 1 A 224 224 GLU HA H 224 4.690 4.555 0.135 1 1 1809 . 7 1 1 A 224 224 GLU CA C 224 54.703 56.358 -1.655 1 1 1810 . 7 1 1 A 224 224 GLU CB C 224 26.357 31.259 -4.902 1 1 1812 . 7 1 1 A 224 224 GLU N N 224 124.249 121.419 2.830 1 1 1813 . 7 1 1 A 225 225 LYS H H 225 8.730 8.360 0.370 1 1 1814 . 7 1 1 A 225 225 LYS HA H 225 4.754 4.891 -0.137 1 1 1822 . 7 1 1 A 225 225 LYS N N 225 126.784 122.552 4.232 1 1 1823 . 7 1 1 A 226 226 GLY H H 226 7.683 8.686 -1.003 1 1 1824 . 7 1 1 A 226 226 GLY HA2 H 226 5.567 4.225 1.342 1 1 1825 . 7 1 1 A 226 226 GLY HA3 H 226 3.819 4.236 -0.417 1 1 1826 . 7 1 1 A 226 226 GLY CA C 226 42.264 44.294 -2.030 1 1 1827 . 7 1 1 A 226 226 GLY N N 226 107.140 111.493 -4.353 1 1 1828 . 7 1 1 A 227 227 SER H H 227 8.672 9.900 -1.228 1 1 1829 . 7 1 1 A 227 227 SER HA H 227 5.564 5.621 -0.057 1 1 1832 . 7 1 1 A 227 227 SER CA C 227 54.373 56.971 -2.598 1 1 1833 . 7 1 1 A 227 227 SER CB C 227 63.963 66.627 -2.664 1 1 1834 . 7 1 1 A 227 227 SER N N 227 117.767 116.149 1.618 1 1 1835 . 7 1 1 A 228 228 TYR H H 228 9.073 9.234 -0.161 1 1 1836 . 7 1 1 A 228 228 TYR HA H 228 5.519 5.188 0.331 1 1 1843 . 7 1 1 A 228 228 TYR N N 228 118.324 125.064 -6.740 1 1 1844 . 7 1 1 A 229 229 SER H H 229 8.929 7.644 1.285 1 1 1845 . 7 1 1 A 229 229 SER HA H 229 5.209 5.237 -0.028 1 1 1848 . 7 1 1 A 229 229 SER CA C 229 54.131 57.353 -3.222 1 1 1849 . 7 1 1 A 229 229 SER N N 229 116.118 122.934 -6.816 1 1 1850 . 7 1 1 A 230 230 LEU H H 230 9.372 9.436 -0.064 1 1 1851 . 7 1 1 A 230 230 LEU HA H 230 4.803 4.691 0.112 1 1 1863 . 7 1 1 A 230 230 LEU N N 230 124.803 126.150 -1.347 1 1 1864 . 7 1 1 A 231 231 GLY H H 231 9.080 8.274 0.806 1 1 1865 . 7 1 1 A 231 231 GLY HA2 H 231 4.776 4.336 0.440 1 1 1866 . 7 1 1 A 231 231 GLY HA3 H 231 3.528 4.465 -0.937 1 1 1867 . 7 1 1 A 231 231 GLY CA C 231 41.468 44.495 -3.027 1 1 1868 . 7 1 1 A 231 231 GLY N N 231 109.611 109.907 -0.296 1 1 1869 . 7 1 1 A 232 232 ILE H H 232 6.849 9.100 -2.251 1 1 1870 . 7 1 1 A 232 232 ILE HA H 232 4.742 4.699 0.043 1 1 1878 . 7 1 1 A 232 232 ILE N N 232 120.566 124.226 -3.660 1 1 1879 . 7 1 1 A 233 233 PHE H H 233 9.569 7.776 1.793 1 1 1880 . 7 1 1 A 233 233 PHE HA H 233 4.979 5.652 -0.673 1 1 1885 . 7 1 1 A 233 233 PHE N N 233 129.256 124.454 4.802 1 1 1886 . 7 1 1 A 234 234 GLY H H 234 8.734 8.500 0.234 1 1 1887 . 7 1 1 A 234 234 GLY HA2 H 234 4.488 4.287 0.201 1 1 1888 . 7 1 1 A 234 234 GLY HA3 H 234 3.327 4.288 -0.961 1 1 1889 . 7 1 1 A 234 234 GLY CA C 234 40.377 46.062 -5.685 1 1 1890 . 7 1 1 A 234 234 GLY N N 234 105.294 108.722 -3.428 1 1 1891 . 7 1 1 A 235 235 GLU H H 235 9.198 9.065 0.133 1 1 1892 . 7 1 1 A 235 235 GLU HA H 235 4.111 4.250 -0.139 1 1 1897 . 7 1 1 A 235 235 GLU CA C 235 56.466 59.845 -3.379 1 1 1898 . 7 1 1 A 235 235 GLU CB C 235 26.256 29.530 -3.274 1 1 1900 . 7 1 1 A 235 235 GLU N N 235 125.813 124.362 1.451 1 1 1901 . 7 1 1 A 236 236 LYS H H 236 8.147 7.620 0.527 1 1 1902 . 7 1 1 A 236 236 LYS HA H 236 4.373 4.621 -0.248 1 1 1905 . 7 1 1 A 236 236 LYS N N 236 117.810 114.879 2.931 1 1 1906 . 7 1 1 A 237 237 ALA H H 237 7.685 7.933 -0.248 1 1 1907 . 7 1 1 A 237 237 ALA HA H 237 3.902 4.488 -0.586 1 1 1911 . 7 1 1 A 237 237 ALA CA C 237 49.762 51.693 -1.931 1 1 1912 . 7 1 1 A 237 237 ALA CB C 237 14.720 20.173 -5.453 1 1 1913 . 7 1 1 A 237 237 ALA N N 237 118.704 122.380 -3.676 1 1 1914 . 7 1 1 A 238 238 GLN H H 238 9.312 8.218 1.094 1 1 1915 . 7 1 1 A 238 238 GLN HA H 238 4.049 4.503 -0.454 1 1 1920 . 7 1 1 A 238 238 GLN N N 238 118.059 118.742 -0.683 1 1 1921 . 7 1 1 A 239 239 GLU H H 239 8.785 7.339 1.446 1 1 1922 . 7 1 1 A 239 239 GLU HA H 239 5.531 4.655 0.876 1 1 1927 . 7 1 1 A 239 239 GLU N N 239 116.914 114.073 2.841 1 1 1928 . 7 1 1 A 240 240 VAL H H 240 8.501 9.397 -0.896 1 1 1929 . 7 1 1 A 240 240 VAL HA H 240 5.655 4.015 1.640 1 1 1937 . 7 1 1 A 240 240 VAL CA C 240 55.582 60.245 -4.663 1 1 1940 . 7 1 1 A 240 240 VAL N N 240 110.588 119.289 -8.701 1 1 1941 . 7 1 1 A 241 241 ALA H H 241 8.463 8.788 -0.325 1 1 1942 . 7 1 1 A 241 241 ALA HA H 241 5.014 5.301 -0.287 1 1 1946 . 7 1 1 A 241 241 ALA CA C 241 49.361 50.921 -1.560 1 1 1947 . 7 1 1 A 241 241 ALA CB C 241 18.196 23.587 -5.391 1 1 1948 . 7 1 1 A 241 241 ALA N N 241 121.125 130.153 -9.028 1 1 1949 . 7 1 1 A 242 242 GLY H H 242 9.421 8.251 1.170 1 1 1950 . 7 1 1 A 242 242 GLY HA2 H 242 5.161 4.168 0.993 1 1 1951 . 7 1 1 A 242 242 GLY HA3 H 242 4.076 4.259 -0.183 1 1 1952 . 7 1 1 A 242 242 GLY N N 242 112.036 107.066 4.970 1 1 1953 . 7 1 1 A 243 243 SER H H 243 8.929 8.055 0.874 1 1 1954 . 7 1 1 A 243 243 SER HA H 243 5.331 4.885 0.446 1 1 1957 . 7 1 1 A 243 243 SER N N 243 116.113 115.838 0.275 1 1 1958 . 7 1 1 A 244 244 ALA H H 244 9.218 8.282 0.936 1 1 1959 . 7 1 1 A 244 244 ALA HA H 244 5.221 4.700 0.521 1 1 1963 . 7 1 1 A 244 244 ALA CA C 244 47.883 50.978 -3.095 1 1 1964 . 7 1 1 A 244 244 ALA N N 244 120.635 122.878 -2.243 1 1 1965 . 7 1 1 A 245 245 GLU H H 245 9.194 8.137 1.057 1 1 1966 . 7 1 1 A 245 245 GLU HA H 245 4.869 5.174 -0.305 1 1 1971 . 7 1 1 A 245 245 GLU N N 245 123.487 117.557 5.930 1 1 1972 . 7 1 1 A 246 246 VAL H H 246 8.531 8.990 -0.459 1 1 1973 . 7 1 1 A 246 246 VAL HA H 246 4.518 4.811 -0.293 1 1 1981 . 7 1 1 A 246 246 VAL CA C 246 58.286 60.779 -2.493 1 1 1982 . 7 1 1 A 246 246 VAL N N 246 123.347 123.043 0.304 1 1 1983 . 7 1 1 A 247 247 GLU H H 247 9.132 8.679 0.453 1 1 1984 . 7 1 1 A 247 247 GLU HA H 247 4.368 4.792 -0.424 1 1 1989 . 7 1 1 A 247 247 GLU CB C 247 26.744 32.474 -5.730 1 1 1990 . 7 1 1 A 247 247 GLU N N 247 129.243 126.482 2.761 1 1 1991 . 7 1 1 A 248 248 THR H H 248 7.827 8.379 -0.552 1 1 1992 . 7 1 1 A 248 248 THR HA H 248 4.749 4.776 -0.027 1 1 1997 . 7 1 1 A 248 248 THR CA C 248 56.859 60.840 -3.981 1 1 1998 . 7 1 1 A 248 248 THR CB C 248 69.171 70.192 -1.021 1 1 2000 . 7 1 1 A 248 248 THR N N 248 114.228 119.273 -5.045 1 1 2001 . 7 1 1 A 249 249 ALA H H 249 9.148 8.680 0.468 1 1 2002 . 7 1 1 A 249 249 ALA HA H 249 4.174 4.157 0.017 1 1 2006 . 7 1 1 A 249 249 ALA CA C 249 51.970 53.736 -1.766 1 1 2007 . 7 1 1 A 249 249 ALA CB C 249 15.797 18.940 -3.143 1 1 2008 . 7 1 1 A 249 249 ALA N N 249 123.341 124.397 -1.056 1 1 2009 . 7 1 1 A 250 250 ASN H H 250 7.974 7.753 0.221 1 1 2010 . 7 1 1 A 250 250 ASN HA H 250 4.953 4.887 0.066 1 1 2015 . 7 1 1 A 250 250 ASN CA C 250 49.198 52.608 -3.410 1 1 2016 . 7 1 1 A 250 250 ASN CB C 250 35.976 38.940 -2.964 1 1 2017 . 7 1 1 A 250 250 ASN N N 250 113.358 116.378 -3.020 1 1 2019 . 7 1 1 A 251 251 GLY H H 251 7.510 7.594 -0.084 1 1 2020 . 7 1 1 A 251 251 GLY HA2 H 251 4.492 4.144 0.348 1 1 2021 . 7 1 1 A 251 251 GLY HA3 H 251 3.853 4.248 -0.395 1 1 2022 . 7 1 1 A 251 251 GLY CA C 251 41.435 45.819 -4.384 1 1 2023 . 7 1 1 A 251 251 GLY N N 251 108.692 107.485 1.207 1 1 2024 . 7 1 1 A 252 252 ILE H H 252 8.465 8.851 -0.386 1 1 2025 . 7 1 1 A 252 252 ILE HA H 252 4.521 4.548 -0.027 1 1 2035 . 7 1 1 A 252 252 ILE CB C 252 35.653 38.188 -2.535 1 1 2039 . 7 1 1 A 252 252 ILE N N 252 122.043 127.281 -5.238 1 1 2040 . 7 1 1 A 253 253 HIS H H 253 9.311 9.767 -0.456 1 1 2041 . 7 1 1 A 253 253 HIS HA H 253 4.861 5.301 -0.440 1 1 2046 . 7 1 1 A 253 253 HIS N N 253 126.617 125.970 0.647 1 1 2047 . 7 1 1 A 254 254 HIS H H 254 8.820 8.909 -0.089 1 1 2048 . 7 1 1 A 254 254 HIS HA H 254 5.305 5.292 0.013 1 1 2051 . 7 1 1 A 254 254 HIS CA C 254 52.781 54.134 -1.353 1 1 2052 . 7 1 1 A 254 254 HIS N N 254 122.665 120.539 2.126 1 1 2053 . 7 1 1 A 255 255 ILE H H 255 9.047 8.617 0.430 1 1 2054 . 7 1 1 A 255 255 ILE HA H 255 4.651 5.015 -0.364 1 1 2061 . 7 1 1 A 255 255 ILE N N 255 123.958 122.736 1.222 1 1 2062 . 7 1 1 A 256 256 GLY H H 256 9.339 9.671 -0.332 1 1 2063 . 7 1 1 A 256 256 GLY HA2 H 256 3.816 3.811 0.005 1 1 2064 . 7 1 1 A 256 256 GLY HA3 H 256 2.267 3.948 -1.681 1 1 2065 . 7 1 1 A 256 256 GLY N N 256 115.022 110.890 4.132 1 1 2066 . 7 1 1 A 257 257 LEU H H 257 7.890 8.566 -0.676 1 1 2067 . 7 1 1 A 257 257 LEU HA H 257 4.853 4.501 0.352 1 1 2077 . 7 1 1 A 257 257 LEU N N 257 121.441 122.188 -0.747 1 1 2078 . 7 1 1 A 258 258 ALA H H 258 7.982 8.973 -0.991 1 1 2079 . 7 1 1 A 258 258 ALA HA H 258 4.668 5.128 -0.460 1 1 2083 . 7 1 1 A 258 258 ALA CA C 258 49.678 51.801 -2.123 1 1 2084 . 7 1 1 A 258 258 ALA CB C 258 19.561 21.143 -1.582 1 1 2085 . 7 1 1 A 258 258 ALA N N 258 123.234 122.922 0.312 1 1 2086 . 7 1 1 A 259 259 ALA H H 259 9.117 8.732 0.385 1 1 2087 . 7 1 1 A 259 259 ALA HA H 259 4.790 4.727 0.063 1 1 2091 . 7 1 1 A 259 259 ALA N N 259 123.901 124.794 -0.893 1 1 2092 . 7 1 1 A 260 260 LYS H H 260 8.452 8.068 0.384 1 1 2093 . 7 1 1 A 260 260 LYS HA H 260 5.914 4.496 1.418 1 1 2098 . 7 1 1 A 260 260 LYS CA C 260 51.818 54.433 -2.615 1 1 2099 . 7 1 1 A 260 260 LYS N N 260 116.464 116.955 -0.491 1 1 1 . 8 1 1 A 9 9 SER H H 9 8.293 8.574 -0.281 1 1 2 . 8 1 1 A 9 9 SER HA H 9 4.432 5.082 -0.650 1 1 3 . 8 1 1 A 9 9 SER N N 9 116.407 115.763 0.644 1 1 4 . 8 1 1 A 10 10 GLY H H 10 8.472 8.416 0.056 1 1 5 . 8 1 1 A 10 10 GLY N N 10 111.611 109.610 2.001 1 1 6 . 8 1 1 A 14 14 VAL H H 14 8.009 8.477 -0.468 1 1 7 . 8 1 1 A 14 14 VAL HA H 14 4.128 4.106 0.022 1 1 15 . 8 1 1 A 14 14 VAL CA C 14 59.473 61.892 -2.419 1 1 16 . 8 1 1 A 14 14 VAL CB C 14 30.127 32.803 -2.676 1 1 17 . 8 1 1 A 14 14 VAL N N 14 119.846 119.060 0.786 1 1 18 . 8 1 1 A 15 15 THR H H 15 8.152 8.337 -0.185 1 1 19 . 8 1 1 A 15 15 THR HA H 15 4.346 4.646 -0.300 1 1 24 . 8 1 1 A 15 15 THR N N 15 118.509 118.306 0.203 1 1 25 . 8 1 1 A 16 16 ALA H H 16 8.207 8.675 -0.468 1 1 26 . 8 1 1 A 16 16 ALA HA H 16 4.319 4.136 0.183 1 1 30 . 8 1 1 A 16 16 ALA CA C 16 49.835 53.532 -3.697 1 1 31 . 8 1 1 A 16 16 ALA CB C 16 16.714 18.458 -1.744 1 1 32 . 8 1 1 A 16 16 ALA N N 16 126.935 126.879 0.056 1 1 33 . 8 1 1 A 17 17 ASP H H 17 8.269 7.988 0.281 1 1 34 . 8 1 1 A 17 17 ASP HA H 17 4.581 4.929 -0.348 1 1 37 . 8 1 1 A 17 17 ASP CA C 17 51.643 53.068 -1.425 1 1 38 . 8 1 1 A 17 17 ASP CB C 17 38.257 41.757 -3.500 1 1 39 . 8 1 1 A 17 17 ASP N N 17 120.379 119.291 1.088 1 1 40 . 8 1 1 A 18 18 ILE H H 18 7.979 7.777 0.202 1 1 41 . 8 1 1 A 18 18 ILE HA H 18 4.178 4.137 0.041 1 1 48 . 8 1 1 A 18 18 ILE CA C 18 58.737 63.192 -4.455 1 1 49 . 8 1 1 A 18 18 ILE CB C 18 36.077 38.511 -2.434 1 1 53 . 8 1 1 A 18 18 ILE N N 18 121.171 121.698 -0.527 1 1 54 . 8 1 1 A 19 19 GLY H H 19 8.410 7.927 0.483 1 1 55 . 8 1 1 A 19 19 GLY HA2 H 19 4.023 3.941 0.082 1 1 56 . 8 1 1 A 19 19 GLY HA3 H 19 4.023 3.946 0.077 1 1 57 . 8 1 1 A 19 19 GLY N N 19 112.246 108.800 3.446 1 1 58 . 8 1 1 A 20 20 THR H H 20 8.005 7.915 0.090 1 1 59 . 8 1 1 A 20 20 THR HA H 20 4.463 4.062 0.401 1 1 64 . 8 1 1 A 20 20 THR CB C 20 66.723 68.269 -1.546 1 1 66 . 8 1 1 A 20 20 THR N N 20 112.239 116.225 -3.986 1 1 67 . 8 1 1 A 21 21 GLY H H 21 8.500 8.607 -0.107 1 1 68 . 8 1 1 A 21 21 GLY HA2 H 21 4.099 3.797 0.302 1 1 69 . 8 1 1 A 21 21 GLY HA3 H 21 3.872 3.799 0.073 1 1 70 . 8 1 1 A 21 21 GLY N N 21 111.048 112.930 -1.882 1 1 71 . 8 1 1 A 22 22 LEU H H 22 7.427 7.736 -0.309 1 1 72 . 8 1 1 A 22 22 LEU HA H 22 3.884 4.003 -0.119 1 1 84 . 8 1 1 A 22 22 LEU N N 22 118.837 120.347 -1.510 1 1 85 . 8 1 1 A 23 23 ALA H H 23 7.896 7.663 0.233 1 1 86 . 8 1 1 A 23 23 ALA HA H 23 4.023 4.136 -0.113 1 1 90 . 8 1 1 A 23 23 ALA CA C 23 52.584 54.056 -1.472 1 1 91 . 8 1 1 A 23 23 ALA CB C 23 15.470 18.413 -2.943 1 1 92 . 8 1 1 A 23 23 ALA N N 23 119.194 121.422 -2.228 1 1 93 . 8 1 1 A 24 24 ASP H H 24 8.265 8.603 -0.338 1 1 94 . 8 1 1 A 24 24 ASP HA H 24 4.337 4.578 -0.241 1 1 97 . 8 1 1 A 24 24 ASP CB C 24 37.029 41.163 -4.134 1 1 98 . 8 1 1 A 24 24 ASP N N 24 119.035 116.889 2.146 1 1 99 . 8 1 1 A 25 25 ALA H H 25 8.211 8.354 -0.143 1 1 100 . 8 1 1 A 25 25 ALA HA H 25 4.064 4.265 -0.201 1 1 104 . 8 1 1 A 25 25 ALA CA C 25 53.278 54.192 -0.914 1 1 105 . 8 1 1 A 25 25 ALA CB C 25 15.760 18.258 -2.498 1 1 106 . 8 1 1 A 25 25 ALA N N 25 122.434 121.281 1.153 1 1 107 . 8 1 1 A 26 26 LEU H H 26 7.334 7.463 -0.129 1 1 108 . 8 1 1 A 26 26 LEU HA H 26 4.351 4.286 0.065 1 1 117 . 8 1 1 A 26 26 LEU N N 26 114.238 115.470 -1.232 1 1 118 . 8 1 1 A 27 27 THR H H 27 7.708 7.213 0.495 1 1 119 . 8 1 1 A 27 27 THR HA H 27 4.492 4.306 0.186 1 1 124 . 8 1 1 A 27 27 THR CA C 27 59.438 63.107 -3.669 1 1 125 . 8 1 1 A 27 27 THR CB C 27 68.796 68.864 -0.068 1 1 127 . 8 1 1 A 27 27 THR N N 27 106.430 111.497 -5.067 1 1 128 . 8 1 1 A 28 28 ALA H H 28 8.906 7.811 1.095 1 1 129 . 8 1 1 A 28 28 ALA HA H 28 4.812 4.722 0.090 1 1 133 . 8 1 1 A 28 28 ALA CB C 28 16.724 20.122 -3.398 1 1 134 . 8 1 1 A 28 28 ALA N N 28 128.420 123.662 4.758 1 1 135 . 8 1 1 A 29 29 PRO CA C 29 59.166 62.230 -3.064 1 1 136 . 8 1 1 A 29 29 PRO CB C 29 29.865 32.935 -3.070 1 1 139 . 8 1 1 A 30 30 LEU H H 30 8.204 8.320 -0.116 1 1 140 . 8 1 1 A 30 30 LEU HA H 30 4.052 4.183 -0.131 1 1 150 . 8 1 1 A 30 30 LEU N N 30 121.970 122.487 -0.517 1 1 151 . 8 1 1 A 31 31 ASP H H 31 8.720 8.734 -0.014 1 1 152 . 8 1 1 A 31 31 ASP HA H 31 4.772 5.066 -0.294 1 1 155 . 8 1 1 A 31 31 ASP CA C 31 50.115 53.205 -3.090 1 1 156 . 8 1 1 A 31 31 ASP N N 31 125.105 126.114 -1.009 1 1 157 . 8 1 1 A 32 32 HIS CA C 32 55.083 54.970 0.113 1 1 158 . 8 1 1 A 32 32 HIS CB C 32 25.707 28.239 -2.532 1 1 159 . 8 1 1 A 33 33 LYS H H 33 8.589 9.566 -0.977 1 1 160 . 8 1 1 A 33 33 LYS HA H 33 4.112 4.449 -0.337 1 1 167 . 8 1 1 A 33 33 LYS CB C 33 29.218 33.867 -4.649 1 1 169 . 8 1 1 A 33 33 LYS N N 33 118.920 122.162 -3.242 1 1 170 . 8 1 1 A 34 34 ASP H H 34 7.420 7.255 0.165 1 1 171 . 8 1 1 A 34 34 ASP HA H 34 4.368 4.650 -0.282 1 1 174 . 8 1 1 A 34 34 ASP N N 34 120.940 120.808 0.132 1 1 175 . 8 1 1 A 35 35 LYS H H 35 8.266 8.854 -0.588 1 1 176 . 8 1 1 A 35 35 LYS HA H 35 4.169 4.023 0.146 1 1 183 . 8 1 1 A 35 35 LYS N N 35 121.280 123.365 -2.085 1 1 184 . 8 1 1 A 36 36 GLY H H 36 8.716 7.842 0.874 1 1 185 . 8 1 1 A 36 36 GLY HA2 H 36 3.822 3.809 0.013 1 1 186 . 8 1 1 A 36 36 GLY HA3 H 36 3.618 3.813 -0.195 1 1 187 . 8 1 1 A 36 36 GLY N N 36 111.002 107.740 3.262 1 1 188 . 8 1 1 A 37 37 LEU H H 37 8.032 7.845 0.187 1 1 189 . 8 1 1 A 37 37 LEU HA H 37 4.406 4.420 -0.014 1 1 198 . 8 1 1 A 37 37 LEU N N 37 127.683 120.008 7.675 1 1 199 . 8 1 1 A 38 38 LYS H H 38 9.190 8.924 0.266 1 1 200 . 8 1 1 A 38 38 LYS HA H 38 3.925 4.456 -0.531 1 1 205 . 8 1 1 A 38 38 LYS N N 38 132.634 124.581 8.053 1 1 206 . 8 1 1 A 39 39 SER H H 39 7.161 7.452 -0.291 1 1 207 . 8 1 1 A 39 39 SER HA H 39 5.097 4.609 0.488 1 1 210 . 8 1 1 A 39 39 SER CA C 39 54.451 57.034 -2.583 1 1 211 . 8 1 1 A 39 39 SER N N 39 110.262 109.416 0.846 1 1 212 . 8 1 1 A 40 40 LEU H H 40 8.142 9.564 -1.422 1 1 213 . 8 1 1 A 40 40 LEU HA H 40 4.481 4.922 -0.441 1 1 223 . 8 1 1 A 40 40 LEU N N 40 122.761 123.492 -0.731 1 1 224 . 8 1 1 A 41 41 THR H H 41 8.641 8.804 -0.163 1 1 225 . 8 1 1 A 41 41 THR HA H 41 4.141 4.518 -0.377 1 1 230 . 8 1 1 A 41 41 THR CA C 41 60.301 61.928 -1.627 1 1 231 . 8 1 1 A 41 41 THR CB C 41 65.862 69.824 -3.962 1 1 233 . 8 1 1 A 41 41 THR N N 41 124.142 119.989 4.153 1 1 234 . 8 1 1 A 42 42 LEU H H 42 8.586 8.478 0.108 1 1 235 . 8 1 1 A 42 42 LEU HA H 42 4.337 4.822 -0.485 1 1 247 . 8 1 1 A 42 42 LEU N N 42 128.603 124.963 3.640 1 1 248 . 8 1 1 A 43 43 GLU H H 43 8.644 8.634 0.010 1 1 249 . 8 1 1 A 43 43 GLU HA H 43 4.663 4.356 0.307 1 1 253 . 8 1 1 A 43 43 GLU N N 43 124.180 123.212 0.968 1 1 254 . 8 1 1 A 44 44 ASP H H 44 10.243 8.784 1.459 1 1 255 . 8 1 1 A 44 44 ASP HA H 44 4.518 4.736 -0.218 1 1 258 . 8 1 1 A 44 44 ASP CA C 44 52.879 53.730 -0.851 1 1 259 . 8 1 1 A 44 44 ASP CB C 44 37.711 38.495 -0.784 1 1 260 . 8 1 1 A 44 44 ASP N N 44 124.177 119.415 4.762 1 1 261 . 8 1 1 A 45 45 SER H H 45 8.546 9.983 -1.437 1 1 262 . 8 1 1 A 45 45 SER HA H 45 3.850 4.202 -0.352 1 1 265 . 8 1 1 A 45 45 SER CA C 45 59.588 61.466 -1.878 1 1 266 . 8 1 1 A 45 45 SER CB C 45 61.660 62.937 -1.277 1 1 267 . 8 1 1 A 45 45 SER N N 45 116.191 116.498 -0.307 1 1 268 . 8 1 1 A 46 46 ILE H H 46 6.902 7.690 -0.788 1 1 269 . 8 1 1 A 46 46 ILE HA H 46 3.874 4.701 -0.827 1 1 279 . 8 1 1 A 46 46 ILE CA C 46 57.605 60.006 -2.401 1 1 280 . 8 1 1 A 46 46 ILE CB C 46 36.694 39.916 -3.222 1 1 283 . 8 1 1 A 46 46 ILE N N 46 116.189 119.541 -3.352 1 1 284 . 8 1 1 A 47 47 SER H H 47 7.804 8.476 -0.672 1 1 285 . 8 1 1 A 47 47 SER HA H 47 4.342 4.813 -0.471 1 1 288 . 8 1 1 A 47 47 SER CA C 47 55.995 56.560 -0.565 1 1 289 . 8 1 1 A 47 47 SER N N 47 118.738 116.995 1.743 1 1 290 . 8 1 1 A 48 48 GLN H H 48 8.522 8.716 -0.194 1 1 291 . 8 1 1 A 48 48 GLN HA H 48 3.939 4.111 -0.172 1 1 296 . 8 1 1 A 48 48 GLN CA C 48 55.111 58.343 -3.232 1 1 298 . 8 1 1 A 48 48 GLN N N 48 119.475 122.953 -3.478 1 1 299 . 8 1 1 A 49 49 ASN H H 49 8.437 8.246 0.191 1 1 300 . 8 1 1 A 49 49 ASN HA H 49 4.693 4.738 -0.045 1 1 305 . 8 1 1 A 49 49 ASN CA C 49 50.839 52.016 -1.177 1 1 306 . 8 1 1 A 49 49 ASN CB C 49 35.767 37.850 -2.083 1 1 307 . 8 1 1 A 49 49 ASN N N 49 117.233 114.460 2.773 1 1 309 . 8 1 1 A 50 50 GLY H H 50 7.952 7.787 0.165 1 1 310 . 8 1 1 A 50 50 GLY HA2 H 50 4.518 4.220 0.298 1 1 311 . 8 1 1 A 50 50 GLY HA3 H 50 4.054 4.225 -0.171 1 1 312 . 8 1 1 A 50 50 GLY CA C 50 41.883 45.521 -3.638 1 1 313 . 8 1 1 A 50 50 GLY N N 50 108.751 107.507 1.244 1 1 314 . 8 1 1 A 51 51 THR H H 51 8.548 8.460 0.088 1 1 315 . 8 1 1 A 51 51 THR HA H 51 5.012 5.393 -0.381 1 1 320 . 8 1 1 A 51 51 THR CA C 51 57.026 60.211 -3.185 1 1 321 . 8 1 1 A 51 51 THR CB C 51 69.887 70.885 -0.998 1 1 323 . 8 1 1 A 51 51 THR N N 51 108.710 115.918 -7.208 1 1 324 . 8 1 1 A 52 52 LEU H H 52 9.110 9.144 -0.034 1 1 325 . 8 1 1 A 52 52 LEU HA H 52 5.183 5.271 -0.088 1 1 333 . 8 1 1 A 52 52 LEU CA C 52 50.822 53.975 -3.153 1 1 335 . 8 1 1 A 52 52 LEU N N 52 124.606 121.056 3.550 1 1 336 . 8 1 1 A 53 53 THR H H 53 9.312 8.677 0.635 1 1 337 . 8 1 1 A 53 53 THR HA H 53 5.288 5.168 0.120 1 1 342 . 8 1 1 A 53 53 THR CA C 53 59.535 61.181 -1.646 1 1 343 . 8 1 1 A 53 53 THR CB C 53 66.838 72.129 -5.291 1 1 345 . 8 1 1 A 53 53 THR N N 53 125.445 115.414 10.031 1 1 346 . 8 1 1 A 54 54 LEU H H 54 8.992 9.567 -0.575 1 1 347 . 8 1 1 A 54 54 LEU HA H 54 5.563 5.420 0.143 1 1 357 . 8 1 1 A 54 54 LEU N N 54 128.814 125.357 3.457 1 1 358 . 8 1 1 A 55 55 SER H H 55 9.017 9.339 -0.322 1 1 359 . 8 1 1 A 55 55 SER HA H 55 5.476 5.234 0.242 1 1 362 . 8 1 1 A 55 55 SER CA C 55 53.944 56.943 -2.999 1 1 363 . 8 1 1 A 55 55 SER CB C 55 63.384 65.003 -1.619 1 1 364 . 8 1 1 A 55 55 SER N N 55 112.964 118.719 -5.755 1 1 365 . 8 1 1 A 56 56 ALA H H 56 8.324 9.466 -1.142 1 1 366 . 8 1 1 A 56 56 ALA HA H 56 4.605 4.769 -0.164 1 1 370 . 8 1 1 A 56 56 ALA CA C 56 50.743 50.034 0.709 1 1 371 . 8 1 1 A 56 56 ALA CB C 56 21.372 21.441 -0.069 1 1 372 . 8 1 1 A 56 56 ALA N N 56 123.555 129.538 -5.983 1 1 373 . 8 1 1 A 57 57 GLN H H 57 9.080 8.612 0.468 1 1 374 . 8 1 1 A 57 57 GLN HA H 57 3.884 4.483 -0.599 1 1 381 . 8 1 1 A 57 57 GLN CA C 57 53.331 56.018 -2.687 1 1 382 . 8 1 1 A 57 57 GLN CB C 57 24.659 27.703 -3.044 1 1 384 . 8 1 1 A 57 57 GLN N N 57 116.815 114.949 1.866 1 1 386 . 8 1 1 A 58 58 GLY H H 58 8.527 7.966 0.561 1 1 387 . 8 1 1 A 58 58 GLY HA2 H 58 4.168 4.069 0.099 1 1 388 . 8 1 1 A 58 58 GLY HA3 H 58 3.608 4.070 -0.462 1 1 389 . 8 1 1 A 58 58 GLY CA C 58 42.856 45.822 -2.966 1 1 390 . 8 1 1 A 58 58 GLY N N 58 105.983 107.721 -1.738 1 1 391 . 8 1 1 A 59 59 ALA H H 59 8.203 7.735 0.468 1 1 392 . 8 1 1 A 59 59 ALA HA H 59 4.811 4.557 0.254 1 1 396 . 8 1 1 A 59 59 ALA CA C 59 47.662 51.444 -3.782 1 1 397 . 8 1 1 A 59 59 ALA CB C 59 20.147 22.778 -2.631 1 1 398 . 8 1 1 A 59 59 ALA N N 59 125.153 121.339 3.814 1 1 399 . 8 1 1 A 60 60 GLU H H 60 8.154 8.799 -0.645 1 1 400 . 8 1 1 A 60 60 GLU HA H 60 5.508 5.811 -0.303 1 1 404 . 8 1 1 A 60 60 GLU CA C 60 52.179 54.004 -1.825 1 1 405 . 8 1 1 A 60 60 GLU CB C 60 30.203 34.431 -4.228 1 1 406 . 8 1 1 A 60 60 GLU N N 60 117.318 116.963 0.355 1 1 407 . 8 1 1 A 61 61 LYS H H 61 8.821 9.465 -0.644 1 1 408 . 8 1 1 A 61 61 LYS HA H 61 4.311 4.876 -0.565 1 1 413 . 8 1 1 A 61 61 LYS N N 61 123.743 120.779 2.964 1 1 414 . 8 1 1 A 62 62 THR H H 62 8.149 8.714 -0.565 1 1 415 . 8 1 1 A 62 62 THR HA H 62 4.928 4.580 0.348 1 1 420 . 8 1 1 A 62 62 THR CA C 62 59.427 63.083 -3.656 1 1 421 . 8 1 1 A 62 62 THR CB C 62 66.932 68.924 -1.992 1 1 422 . 8 1 1 A 62 62 THR N N 62 122.829 120.754 2.075 1 1 423 . 8 1 1 A 63 63 TYR H H 63 9.466 9.947 -0.481 1 1 424 . 8 1 1 A 63 63 TYR HA H 63 4.606 5.303 -0.697 1 1 431 . 8 1 1 A 63 63 TYR CA C 63 54.508 55.882 -1.374 1 1 432 . 8 1 1 A 63 63 TYR N N 63 127.472 128.010 -0.538 1 1 433 . 8 1 1 A 64 64 GLY H H 64 9.253 8.748 0.505 1 1 434 . 8 1 1 A 64 64 GLY HA2 H 64 4.670 4.256 0.414 1 1 435 . 8 1 1 A 64 64 GLY HA3 H 64 3.619 4.281 -0.662 1 1 436 . 8 1 1 A 64 64 GLY CA C 64 39.885 44.851 -4.966 1 1 437 . 8 1 1 A 64 64 GLY N N 64 110.182 111.678 -1.496 1 1 438 . 8 1 1 A 65 65 ASN H H 65 8.616 8.515 0.101 1 1 439 . 8 1 1 A 65 65 ASN HA H 65 4.109 4.412 -0.303 1 1 444 . 8 1 1 A 65 65 ASN CA C 65 53.691 54.886 -1.195 1 1 445 . 8 1 1 A 65 65 ASN N N 65 117.778 118.829 -1.051 1 1 447 . 8 1 1 A 66 66 GLY H H 66 9.053 8.985 0.068 1 1 448 . 8 1 1 A 66 66 GLY HA2 H 66 4.344 3.870 0.474 1 1 449 . 8 1 1 A 66 66 GLY HA3 H 66 3.359 3.879 -0.520 1 1 450 . 8 1 1 A 66 66 GLY CA C 66 42.431 44.921 -2.490 1 1 451 . 8 1 1 A 66 66 GLY N N 66 115.232 114.079 1.153 1 1 452 . 8 1 1 A 67 67 ASP H H 67 8.120 8.716 -0.596 1 1 453 . 8 1 1 A 67 67 ASP HA H 67 4.844 4.116 0.728 1 1 456 . 8 1 1 A 67 67 ASP N N 67 122.593 121.297 1.296 1 1 457 . 8 1 1 A 68 68 SER H H 68 8.500 8.177 0.323 1 1 458 . 8 1 1 A 68 68 SER HA H 68 5.088 5.122 -0.034 1 1 461 . 8 1 1 A 68 68 SER CA C 68 54.858 56.160 -1.302 1 1 462 . 8 1 1 A 68 68 SER CB C 68 62.114 66.172 -4.058 1 1 463 . 8 1 1 A 68 68 SER N N 68 113.557 116.162 -2.605 1 1 464 . 8 1 1 A 69 69 LEU H H 69 8.989 9.180 -0.191 1 1 465 . 8 1 1 A 69 69 LEU HA H 69 4.570 5.625 -1.055 1 1 474 . 8 1 1 A 69 69 LEU N N 69 126.836 121.628 5.208 1 1 475 . 8 1 1 A 70 70 ASN H H 70 8.491 8.640 -0.149 1 1 476 . 8 1 1 A 70 70 ASN HA H 70 4.958 5.197 -0.239 1 1 479 . 8 1 1 A 70 70 ASN CB C 70 33.265 39.244 -5.979 1 1 480 . 8 1 1 A 70 70 ASN N N 70 126.343 120.889 5.454 1 1 481 . 8 1 1 A 71 71 THR H H 71 7.831 8.287 -0.456 1 1 482 . 8 1 1 A 71 71 THR HA H 71 3.759 4.595 -0.836 1 1 487 . 8 1 1 A 71 71 THR CA C 71 61.005 60.716 0.289 1 1 488 . 8 1 1 A 71 71 THR N N 71 114.742 113.392 1.350 1 1 489 . 8 1 1 A 72 72 GLY H H 72 8.880 8.443 0.437 1 1 490 . 8 1 1 A 72 72 GLY HA2 H 72 3.907 3.947 -0.040 1 1 491 . 8 1 1 A 72 72 GLY HA3 H 72 3.907 3.948 -0.041 1 1 492 . 8 1 1 A 72 72 GLY N N 72 114.976 110.973 4.003 1 1 493 . 8 1 1 A 73 73 LYS H H 73 6.604 7.740 -1.136 1 1 494 . 8 1 1 A 73 73 LYS HA H 73 4.160 4.396 -0.236 1 1 501 . 8 1 1 A 73 73 LYS N N 73 113.898 118.361 -4.463 1 1 502 . 8 1 1 A 74 74 LEU H H 74 7.422 7.516 -0.094 1 1 503 . 8 1 1 A 74 74 LEU HA H 74 4.358 4.233 0.125 1 1 513 . 8 1 1 A 74 74 LEU N N 74 117.180 121.823 -4.643 1 1 514 . 8 1 1 A 75 75 LYS H H 75 8.617 8.637 -0.020 1 1 515 . 8 1 1 A 75 75 LYS HA H 75 4.079 4.839 -0.760 1 1 518 . 8 1 1 A 75 75 LYS N N 75 121.119 118.989 2.130 1 1 519 . 8 1 1 A 76 76 ASN H H 76 8.154 8.599 -0.445 1 1 520 . 8 1 1 A 76 76 ASN HA H 76 3.935 5.559 -1.624 1 1 525 . 8 1 1 A 76 76 ASN CB C 76 35.772 39.015 -3.243 1 1 526 . 8 1 1 A 76 76 ASN N N 76 122.761 115.245 7.516 1 1 527 . 8 1 1 A 77 77 ASP H H 77 9.227 7.734 1.493 1 1 528 . 8 1 1 A 77 77 ASP HA H 77 3.787 5.149 -1.362 1 1 531 . 8 1 1 A 77 77 ASP CA C 77 52.584 53.437 -0.853 1 1 532 . 8 1 1 A 77 77 ASP N N 77 114.129 118.087 -3.958 1 1 533 . 8 1 1 A 78 78 LYS H H 78 6.579 8.246 -1.667 1 1 534 . 8 1 1 A 78 78 LYS HA H 78 4.572 4.772 -0.200 1 1 539 . 8 1 1 A 78 78 LYS CA C 78 51.072 55.313 -4.241 1 1 540 . 8 1 1 A 78 78 LYS CB C 78 33.783 36.935 -3.152 1 1 541 . 8 1 1 A 78 78 LYS N N 78 114.135 121.915 -7.780 1 1 542 . 8 1 1 A 79 79 VAL H H 79 8.729 8.578 0.151 1 1 543 . 8 1 1 A 79 79 VAL HA H 79 4.402 4.546 -0.144 1 1 551 . 8 1 1 A 79 79 VAL CA C 79 59.240 60.537 -1.297 1 1 553 . 8 1 1 A 79 79 VAL N N 79 123.191 121.252 1.939 1 1 554 . 8 1 1 A 80 80 SER H H 80 9.542 9.493 0.049 1 1 555 . 8 1 1 A 80 80 SER HA H 80 4.636 4.936 -0.300 1 1 558 . 8 1 1 A 80 80 SER CA C 80 55.978 57.476 -1.498 1 1 559 . 8 1 1 A 80 80 SER N N 80 127.445 122.054 5.391 1 1 560 . 8 1 1 A 81 81 ARG H H 81 8.093 8.534 -0.441 1 1 561 . 8 1 1 A 81 81 ARG HA H 81 5.210 5.659 -0.449 1 1 569 . 8 1 1 A 81 81 ARG N N 81 123.743 124.342 -0.599 1 1 571 . 8 1 1 A 82 82 PHE H H 82 9.312 8.068 1.244 1 1 572 . 8 1 1 A 82 82 PHE HA H 82 4.951 5.298 -0.347 1 1 577 . 8 1 1 A 82 82 PHE CA C 82 53.090 56.100 -3.010 1 1 578 . 8 1 1 A 82 82 PHE N N 82 119.529 117.097 2.432 1 1 579 . 8 1 1 A 83 83 ASP H H 83 9.122 10.330 -1.208 1 1 580 . 8 1 1 A 83 83 ASP HA H 83 5.593 5.103 0.490 1 1 583 . 8 1 1 A 83 83 ASP N N 83 123.825 120.038 3.787 1 1 584 . 8 1 1 A 84 84 PHE H H 84 9.090 8.225 0.865 1 1 585 . 8 1 1 A 84 84 PHE HA H 84 6.410 5.907 0.503 1 1 592 . 8 1 1 A 84 84 PHE CA C 84 52.584 56.539 -3.955 1 1 593 . 8 1 1 A 84 84 PHE N N 84 118.862 117.817 1.045 1 1 594 . 8 1 1 A 85 85 ILE H H 85 8.441 9.361 -0.920 1 1 595 . 8 1 1 A 85 85 ILE HA H 85 4.662 4.902 -0.240 1 1 605 . 8 1 1 A 85 85 ILE CB C 85 39.939 39.807 0.132 1 1 608 . 8 1 1 A 85 85 ILE N N 85 118.049 121.555 -3.506 1 1 609 . 8 1 1 A 86 86 ARG H H 86 8.983 8.833 0.150 1 1 610 . 8 1 1 A 86 86 ARG HA H 86 5.591 4.798 0.793 1 1 616 . 8 1 1 A 86 86 ARG N N 86 127.006 128.160 -1.154 1 1 618 . 8 1 1 A 87 87 GLN H H 87 8.643 9.435 -0.792 1 1 619 . 8 1 1 A 87 87 GLN HA H 87 5.630 5.214 0.416 1 1 626 . 8 1 1 A 87 87 GLN CA C 87 51.512 54.443 -2.931 1 1 627 . 8 1 1 A 87 87 GLN N N 87 124.142 122.773 1.369 1 1 629 . 8 1 1 A 88 88 ILE H H 88 8.617 8.702 -0.085 1 1 630 . 8 1 1 A 88 88 ILE HA H 88 4.690 4.899 -0.209 1 1 637 . 8 1 1 A 88 88 ILE CA C 88 56.995 60.704 -3.709 1 1 638 . 8 1 1 A 88 88 ILE CB C 88 39.927 40.289 -0.362 1 1 641 . 8 1 1 A 88 88 ILE N N 88 116.353 123.080 -6.727 1 1 642 . 8 1 1 A 89 89 GLU H H 89 8.298 9.021 -0.723 1 1 643 . 8 1 1 A 89 89 GLU HA H 89 5.100 5.780 -0.680 1 1 646 . 8 1 1 A 89 89 GLU CA C 89 52.204 55.009 -2.805 1 1 647 . 8 1 1 A 89 89 GLU CB C 89 27.325 33.340 -6.015 1 1 648 . 8 1 1 A 89 89 GLU N N 89 124.458 129.216 -4.758 1 1 649 . 8 1 1 A 90 90 VAL H H 90 8.957 8.930 0.027 1 1 650 . 8 1 1 A 90 90 VAL HA H 90 4.169 4.616 -0.447 1 1 658 . 8 1 1 A 90 90 VAL CA C 90 58.664 60.265 -1.601 1 1 659 . 8 1 1 A 90 90 VAL CB C 90 31.861 32.898 -1.037 1 1 660 . 8 1 1 A 90 90 VAL N N 90 127.580 127.080 0.500 1 1 661 . 8 1 1 A 91 91 ASP H H 91 9.369 8.663 0.706 1 1 662 . 8 1 1 A 91 91 ASP HA H 91 4.287 4.584 -0.297 1 1 665 . 8 1 1 A 91 91 ASP CA C 91 52.389 54.760 -2.371 1 1 666 . 8 1 1 A 91 91 ASP CB C 91 36.409 40.386 -3.977 1 1 667 . 8 1 1 A 91 91 ASP N N 91 129.411 123.741 5.670 1 1 668 . 8 1 1 A 92 92 GLY H H 92 8.552 7.470 1.082 1 1 669 . 8 1 1 A 92 92 GLY HA2 H 92 4.090 4.093 -0.003 1 1 670 . 8 1 1 A 92 92 GLY HA3 H 92 3.618 4.094 -0.476 1 1 671 . 8 1 1 A 92 92 GLY CA C 92 42.836 45.591 -2.755 1 1 672 . 8 1 1 A 92 92 GLY N N 92 103.862 105.531 -1.669 1 1 673 . 8 1 1 A 93 93 GLN H H 93 7.808 7.619 0.189 1 1 674 . 8 1 1 A 93 93 GLN HA H 93 4.578 4.835 -0.257 1 1 679 . 8 1 1 A 93 93 GLN CA C 93 50.918 54.307 -3.389 1 1 680 . 8 1 1 A 93 93 GLN CB C 93 28.602 31.177 -2.575 1 1 682 . 8 1 1 A 93 93 GLN N N 93 120.412 118.747 1.665 1 1 683 . 8 1 1 A 94 94 LEU H H 94 8.414 8.477 -0.063 1 1 684 . 8 1 1 A 94 94 LEU HA H 94 4.704 4.246 0.458 1 1 693 . 8 1 1 A 94 94 LEU CB C 94 39.873 42.551 -2.678 1 1 696 . 8 1 1 A 94 94 LEU N N 94 125.061 122.676 2.385 1 1 697 . 8 1 1 A 95 95 ILE H H 95 9.181 8.623 0.558 1 1 698 . 8 1 1 A 95 95 ILE HA H 95 4.371 4.905 -0.534 1 1 708 . 8 1 1 A 95 95 ILE CA C 95 63.319 60.769 2.550 1 1 709 . 8 1 1 A 95 95 ILE CB C 95 37.407 39.645 -2.238 1 1 711 . 8 1 1 A 95 95 ILE N N 95 127.724 121.691 6.033 1 1 712 . 8 1 1 A 96 96 THR H H 96 8.730 7.383 1.347 1 1 713 . 8 1 1 A 96 96 THR HA H 96 4.411 4.359 0.052 1 1 718 . 8 1 1 A 96 96 THR CA C 96 60.344 63.003 -2.659 1 1 719 . 8 1 1 A 96 96 THR CB C 96 59.719 69.587 -9.868 1 1 720 . 8 1 1 A 96 96 THR N N 96 124.240 118.525 5.715 1 1 721 . 8 1 1 A 97 97 LEU H H 97 8.790 8.766 0.024 1 1 722 . 8 1 1 A 97 97 LEU HA H 97 4.400 4.987 -0.587 1 1 732 . 8 1 1 A 97 97 LEU N N 97 126.147 124.598 1.549 1 1 733 . 8 1 1 A 98 98 GLU H H 98 7.596 8.873 -1.277 1 1 734 . 8 1 1 A 98 98 GLU HA H 98 5.102 5.048 0.054 1 1 739 . 8 1 1 A 98 98 GLU N N 98 116.937 122.726 -5.789 1 1 740 . 8 1 1 A 99 99 SER H H 99 8.906 8.470 0.436 1 1 741 . 8 1 1 A 99 99 SER HA H 99 4.504 5.421 -0.917 1 1 744 . 8 1 1 A 99 99 SER CA C 99 54.010 56.793 -2.783 1 1 745 . 8 1 1 A 99 99 SER CB C 99 63.876 66.700 -2.824 1 1 746 . 8 1 1 A 99 99 SER N N 99 117.823 116.901 0.922 1 1 747 . 8 1 1 A 100 100 GLY H H 100 7.250 7.786 -0.536 1 1 748 . 8 1 1 A 100 100 GLY HA2 H 100 4.872 3.846 1.026 1 1 749 . 8 1 1 A 100 100 GLY HA3 H 100 3.731 3.951 -0.220 1 1 750 . 8 1 1 A 100 100 GLY N N 100 109.436 109.485 -0.049 1 1 751 . 8 1 1 A 101 101 GLU H H 101 9.661 8.161 1.500 1 1 752 . 8 1 1 A 101 101 GLU HA H 101 5.643 4.410 1.233 1 1 757 . 8 1 1 A 101 101 GLU CA C 101 52.584 55.335 -2.751 1 1 758 . 8 1 1 A 101 101 GLU CB C 101 31.750 31.997 -0.247 1 1 759 . 8 1 1 A 101 101 GLU N N 101 126.793 119.707 7.086 1 1 760 . 8 1 1 A 102 102 PHE H H 102 10.441 8.673 1.768 1 1 761 . 8 1 1 A 102 102 PHE HA H 102 5.248 5.197 0.051 1 1 768 . 8 1 1 A 102 102 PHE CA C 102 53.537 56.161 -2.624 1 1 769 . 8 1 1 A 102 102 PHE N N 102 131.837 121.831 10.006 1 1 770 . 8 1 1 A 103 103 GLN H H 103 9.135 9.956 -0.821 1 1 771 . 8 1 1 A 103 103 GLN HA H 103 5.205 5.026 0.179 1 1 776 . 8 1 1 A 103 103 GLN CA C 103 50.925 54.806 -3.881 1 1 777 . 8 1 1 A 103 103 GLN N N 103 127.720 126.121 1.599 1 1 778 . 8 1 1 A 104 104 VAL H H 104 8.937 8.995 -0.058 1 1 779 . 8 1 1 A 104 104 VAL HA H 104 4.780 5.162 -0.382 1 1 787 . 8 1 1 A 104 104 VAL CA C 104 57.086 61.675 -4.589 1 1 789 . 8 1 1 A 104 104 VAL N N 104 120.097 125.371 -5.274 1 1 790 . 8 1 1 A 105 105 TYR H H 105 9.108 9.249 -0.141 1 1 791 . 8 1 1 A 105 105 TYR HA H 105 4.834 4.900 -0.066 1 1 798 . 8 1 1 A 105 105 TYR CA C 105 54.486 58.973 -4.487 1 1 799 . 8 1 1 A 105 105 TYR N N 105 128.426 129.558 -1.132 1 1 800 . 8 1 1 A 106 106 LYS H H 106 5.945 8.929 -2.984 1 1 805 . 8 1 1 A 106 106 LYS N N 106 129.163 126.188 2.975 1 1 806 . 8 1 1 A 107 107 GLN H H 107 8.526 9.193 -0.667 1 1 807 . 8 1 1 A 107 107 GLN HA H 107 5.160 4.821 0.339 1 1 812 . 8 1 1 A 107 107 GLN CA C 107 52.584 54.980 -2.396 1 1 813 . 8 1 1 A 107 107 GLN CB C 107 26.175 30.490 -4.315 1 1 814 . 8 1 1 A 107 107 GLN N N 107 125.978 125.956 0.022 1 1 815 . 8 1 1 A 108 108 SER H H 108 8.621 8.461 0.160 1 1 816 . 8 1 1 A 108 108 SER HA H 108 4.403 4.741 -0.338 1 1 819 . 8 1 1 A 108 108 SER CA C 108 58.521 61.717 -3.196 1 1 820 . 8 1 1 A 108 108 SER CB C 108 60.737 63.774 -3.037 1 1 821 . 8 1 1 A 108 108 SER N N 108 117.542 116.192 1.350 1 1 822 . 8 1 1 A 109 109 HIS H H 109 10.381 8.070 2.311 1 1 823 . 8 1 1 A 109 109 HIS HA H 109 4.594 4.837 -0.243 1 1 828 . 8 1 1 A 109 109 HIS CA C 109 51.743 55.950 -4.207 1 1 829 . 8 1 1 A 109 109 HIS CB C 109 27.174 31.398 -4.224 1 1 830 . 8 1 1 A 109 109 HIS N N 109 118.449 114.225 4.224 1 1 831 . 8 1 1 A 110 110 SER H H 110 7.366 8.001 -0.635 1 1 832 . 8 1 1 A 110 110 SER HA H 110 4.870 4.841 0.029 1 1 835 . 8 1 1 A 110 110 SER CB C 110 62.986 66.399 -3.413 1 1 836 . 8 1 1 A 110 110 SER N N 110 113.397 113.097 0.300 1 1 837 . 8 1 1 A 111 111 ALA H H 111 8.541 8.618 -0.077 1 1 838 . 8 1 1 A 111 111 ALA HA H 111 4.826 4.973 -0.147 1 1 842 . 8 1 1 A 111 111 ALA CA C 111 49.015 51.847 -2.832 1 1 843 . 8 1 1 A 111 111 ALA CB C 111 20.256 23.003 -2.747 1 1 844 . 8 1 1 A 111 111 ALA N N 111 117.786 121.144 -3.358 1 1 845 . 8 1 1 A 112 112 LEU H H 112 8.529 9.095 -0.566 1 1 846 . 8 1 1 A 112 112 LEU HA H 112 5.680 5.123 0.557 1 1 855 . 8 1 1 A 112 112 LEU CA C 112 51.818 53.620 -1.802 1 1 856 . 8 1 1 A 112 112 LEU N N 112 116.345 120.850 -4.505 1 1 857 . 8 1 1 A 113 113 THR H H 113 8.758 8.988 -0.230 1 1 858 . 8 1 1 A 113 113 THR HA H 113 5.563 5.394 0.169 1 1 863 . 8 1 1 A 113 113 THR CA C 113 54.458 61.098 -6.640 1 1 864 . 8 1 1 A 113 113 THR CB C 113 68.586 73.223 -4.637 1 1 866 . 8 1 1 A 113 113 THR N N 113 110.469 116.531 -6.062 1 1 867 . 8 1 1 A 114 114 ALA H H 114 8.829 8.735 0.094 1 1 868 . 8 1 1 A 114 114 ALA HA H 114 4.466 4.984 -0.518 1 1 872 . 8 1 1 A 114 114 ALA CA C 114 48.886 52.078 -3.192 1 1 873 . 8 1 1 A 114 114 ALA CB C 114 21.583 21.832 -0.249 1 1 874 . 8 1 1 A 114 114 ALA N N 114 121.456 123.629 -2.173 1 1 875 . 8 1 1 A 115 115 LEU H H 115 8.407 8.733 -0.326 1 1 876 . 8 1 1 A 115 115 LEU HA H 115 4.814 4.814 0.000 1 1 886 . 8 1 1 A 115 115 LEU N N 115 119.223 123.869 -4.646 1 1 887 . 8 1 1 A 116 116 GLN H H 116 9.720 8.541 1.179 1 1 888 . 8 1 1 A 116 116 GLN HA H 116 5.312 5.002 0.310 1 1 893 . 8 1 1 A 116 116 GLN CA C 116 50.544 54.412 -3.868 1 1 894 . 8 1 1 A 116 116 GLN N N 116 127.827 121.908 5.919 1 1 895 . 8 1 1 A 117 117 THR H H 117 9.663 8.758 0.905 1 1 896 . 8 1 1 A 117 117 THR HA H 117 4.198 4.819 -0.621 1 1 901 . 8 1 1 A 117 117 THR CA C 117 64.037 60.809 3.228 1 1 902 . 8 1 1 A 117 117 THR CB C 117 66.868 72.891 -6.023 1 1 904 . 8 1 1 A 117 117 THR N N 117 128.929 119.014 9.915 1 1 905 . 8 1 1 A 118 118 GLU H H 118 9.486 8.484 1.002 1 1 906 . 8 1 1 A 118 118 GLU HA H 118 4.885 4.647 0.238 1 1 911 . 8 1 1 A 118 118 GLU N N 118 123.497 119.623 3.874 1 1 912 . 8 1 1 A 119 119 GLN H H 119 8.076 7.629 0.447 1 1 913 . 8 1 1 A 119 119 GLN HA H 119 5.331 4.809 0.522 1 1 916 . 8 1 1 A 119 119 GLN CA C 119 51.858 54.737 -2.879 1 1 917 . 8 1 1 A 119 119 GLN N N 119 118.023 118.873 -0.850 1 1 918 . 8 1 1 A 120 120 GLU H H 120 9.078 9.246 -0.168 1 1 919 . 8 1 1 A 120 120 GLU HA H 120 5.071 5.168 -0.097 1 1 924 . 8 1 1 A 120 120 GLU N N 120 118.433 123.452 -5.019 1 1 925 . 8 1 1 A 121 121 GLN H H 121 7.711 8.845 -1.134 1 1 926 . 8 1 1 A 121 121 GLN HA H 121 4.430 5.200 -0.770 1 1 933 . 8 1 1 A 121 121 GLN CA C 121 53.996 54.488 -0.492 1 1 934 . 8 1 1 A 121 121 GLN CB C 121 27.158 32.939 -5.781 1 1 936 . 8 1 1 A 121 121 GLN N N 121 122.412 118.459 3.953 1 1 938 . 8 1 1 A 122 122 ASP H H 122 8.675 9.482 -0.807 1 1 939 . 8 1 1 A 122 122 ASP HA H 122 4.632 5.181 -0.549 1 1 942 . 8 1 1 A 122 122 ASP CA C 122 48.797 51.564 -2.767 1 1 943 . 8 1 1 A 122 122 ASP CB C 122 39.852 43.624 -3.772 1 1 944 . 8 1 1 A 122 122 ASP N N 122 128.625 122.277 6.348 1 1 945 . 8 1 1 A 123 123 PRO CA C 123 61.579 63.838 -2.259 1 1 946 . 8 1 1 A 123 123 PRO CB C 123 29.597 32.873 -3.276 1 1 948 . 8 1 1 A 124 124 GLU H H 124 8.297 8.280 0.017 1 1 949 . 8 1 1 A 124 124 GLU HA H 124 4.196 4.613 -0.417 1 1 954 . 8 1 1 A 124 124 GLU CA C 124 53.025 56.549 -3.524 1 1 955 . 8 1 1 A 124 124 GLU CB C 124 27.927 30.511 -2.584 1 1 957 . 8 1 1 A 124 124 GLU N N 124 115.538 117.581 -2.043 1 1 958 . 8 1 1 A 125 125 HIS H H 125 7.419 8.003 -0.584 1 1 959 . 8 1 1 A 125 125 HIS HA H 125 4.833 4.732 0.101 1 1 964 . 8 1 1 A 125 125 HIS CA C 125 51.886 55.816 -3.930 1 1 965 . 8 1 1 A 125 125 HIS CB C 125 26.387 32.010 -5.623 1 1 966 . 8 1 1 A 125 125 HIS N N 125 117.464 114.780 2.684 1 1 967 . 8 1 1 A 126 126 SER H H 126 8.441 7.559 0.882 1 1 968 . 8 1 1 A 126 126 SER HA H 126 4.261 4.381 -0.120 1 1 971 . 8 1 1 A 126 126 SER CA C 126 57.988 61.146 -3.158 1 1 972 . 8 1 1 A 126 126 SER N N 126 117.954 115.020 2.934 1 1 973 . 8 1 1 A 127 127 GLU H H 127 9.221 7.658 1.563 1 1 974 . 8 1 1 A 127 127 GLU HA H 127 4.366 4.581 -0.215 1 1 979 . 8 1 1 A 127 127 GLU CA C 127 53.707 56.226 -2.519 1 1 980 . 8 1 1 A 127 127 GLU CB C 127 25.492 30.545 -5.053 1 1 981 . 8 1 1 A 127 127 GLU N N 127 120.404 118.016 2.388 1 1 982 . 8 1 1 A 128 128 LYS H H 128 8.262 8.044 0.218 1 1 983 . 8 1 1 A 128 128 LYS HA H 128 4.661 4.970 -0.309 1 1 990 . 8 1 1 A 128 128 LYS CA C 128 52.264 58.385 -6.121 1 1 991 . 8 1 1 A 128 128 LYS CB C 128 32.404 31.883 0.521 1 1 994 . 8 1 1 A 128 128 LYS N N 128 122.166 117.847 4.319 1 1 995 . 8 1 1 A 129 129 MET H H 129 8.242 7.669 0.573 1 1 996 . 8 1 1 A 129 129 MET HA H 129 5.012 4.912 0.100 1 1 1001 . 8 1 1 A 129 129 MET CA C 129 50.958 54.952 -3.994 1 1 1003 . 8 1 1 A 129 129 MET N N 129 119.422 118.067 1.355 1 1 1004 . 8 1 1 A 130 130 VAL H H 130 9.200 9.847 -0.647 1 1 1005 . 8 1 1 A 130 130 VAL HA H 130 4.609 4.781 -0.172 1 1 1013 . 8 1 1 A 130 130 VAL CA C 130 56.296 60.331 -4.035 1 1 1014 . 8 1 1 A 130 130 VAL CB C 130 32.606 36.567 -3.961 1 1 1015 . 8 1 1 A 130 130 VAL N N 130 118.290 122.017 -3.727 1 1 1016 . 8 1 1 A 131 131 ALA H H 131 8.368 8.511 -0.143 1 1 1017 . 8 1 1 A 131 131 ALA HA H 131 4.654 5.016 -0.362 1 1 1021 . 8 1 1 A 131 131 ALA CA C 131 49.739 51.879 -2.140 1 1 1022 . 8 1 1 A 131 131 ALA CB C 131 15.351 20.831 -5.480 1 1 1023 . 8 1 1 A 131 131 ALA N N 131 126.734 125.741 0.993 1 1 1024 . 8 1 1 A 132 132 LYS H H 132 7.732 8.576 -0.844 1 1 1025 . 8 1 1 A 132 132 LYS HA H 132 4.171 4.669 -0.498 1 1 1028 . 8 1 1 A 132 132 LYS N N 132 127.309 122.342 4.967 1 1 1029 . 8 1 1 A 133 133 ARG H H 133 8.193 8.374 -0.181 1 1 1030 . 8 1 1 A 133 133 ARG HA H 133 5.073 4.966 0.107 1 1 1038 . 8 1 1 A 133 133 ARG N N 133 122.190 120.875 1.315 1 1 1040 . 8 1 1 A 134 134 ARG H H 134 7.539 8.826 -1.287 1 1 1041 . 8 1 1 A 134 134 ARG HA H 134 4.667 4.572 0.095 1 1 1049 . 8 1 1 A 134 134 ARG CA C 134 52.584 54.769 -2.185 1 1 1050 . 8 1 1 A 134 134 ARG CB C 134 31.325 32.713 -1.388 1 1 1052 . 8 1 1 A 134 134 ARG N N 134 121.632 124.625 -2.993 1 1 1054 . 8 1 1 A 135 135 PHE H H 135 8.816 7.608 1.208 1 1 1055 . 8 1 1 A 135 135 PHE HA H 135 5.680 5.501 0.179 1 1 1062 . 8 1 1 A 135 135 PHE N N 135 125.107 121.429 3.678 1 1 1063 . 8 1 1 A 136 136 ARG H H 136 7.741 9.225 -1.484 1 1 1064 . 8 1 1 A 136 136 ARG HA H 136 4.402 4.927 -0.525 1 1 1068 . 8 1 1 A 136 136 ARG N N 136 125.640 120.833 4.807 1 1 1070 . 8 1 1 A 137 137 ILE H H 137 8.556 8.901 -0.345 1 1 1071 . 8 1 1 A 137 137 ILE HA H 137 3.912 4.898 -0.986 1 1 1076 . 8 1 1 A 137 137 ILE CA C 137 55.676 60.403 -4.727 1 1 1079 . 8 1 1 A 137 137 ILE N N 137 122.891 122.198 0.693 1 1 1080 . 8 1 1 A 138 138 GLY H H 138 8.676 9.232 -0.556 1 1 1081 . 8 1 1 A 138 138 GLY HA2 H 138 3.740 4.155 -0.415 1 1 1082 . 8 1 1 A 138 138 GLY HA3 H 138 2.982 4.178 -1.196 1 1 1083 . 8 1 1 A 138 138 GLY CA C 138 41.908 45.615 -3.707 1 1 1084 . 8 1 1 A 138 138 GLY N N 138 117.058 117.130 -0.072 1 1 1085 . 8 1 1 A 139 139 ASP H H 139 7.858 8.775 -0.917 1 1 1086 . 8 1 1 A 139 139 ASP HA H 139 4.753 4.827 -0.074 1 1 1089 . 8 1 1 A 139 139 ASP CA C 139 52.584 53.940 -1.356 1 1 1090 . 8 1 1 A 139 139 ASP CB C 139 43.062 41.638 1.424 1 1 1091 . 8 1 1 A 139 139 ASP N N 139 124.516 125.630 -1.114 1 1 1092 . 8 1 1 A 140 140 ILE H H 140 8.354 8.333 0.021 1 1 1093 . 8 1 1 A 140 140 ILE HA H 140 4.473 4.869 -0.396 1 1 1103 . 8 1 1 A 140 140 ILE CB C 140 36.173 38.471 -2.298 1 1 1105 . 8 1 1 A 140 140 ILE N N 140 120.679 124.259 -3.580 1 1 1106 . 8 1 1 A 141 141 ALA H H 141 8.708 8.506 0.202 1 1 1107 . 8 1 1 A 141 141 ALA HA H 141 4.862 4.699 0.163 1 1 1111 . 8 1 1 A 141 141 ALA CA C 141 47.968 51.522 -3.554 1 1 1112 . 8 1 1 A 141 141 ALA CB C 141 21.733 19.814 1.919 1 1 1113 . 8 1 1 A 141 141 ALA N N 141 130.144 126.407 3.737 1 1 1114 . 8 1 1 A 142 142 GLY H H 142 7.888 8.014 -0.126 1 1 1115 . 8 1 1 A 142 142 GLY HA2 H 142 4.519 3.663 0.856 1 1 1116 . 8 1 1 A 142 142 GLY HA3 H 142 3.634 3.698 -0.064 1 1 1117 . 8 1 1 A 142 142 GLY N N 142 102.272 107.076 -4.804 1 1 1118 . 8 1 1 A 143 143 GLU H H 143 8.068 7.587 0.481 1 1 1119 . 8 1 1 A 143 143 GLU HA H 143 4.577 4.516 0.061 1 1 1124 . 8 1 1 A 143 143 GLU N N 143 120.569 117.527 3.042 1 1 1125 . 8 1 1 A 144 144 HIS H H 144 8.478 8.367 0.111 1 1 1126 . 8 1 1 A 144 144 HIS HA H 144 4.968 4.393 0.575 1 1 1131 . 8 1 1 A 144 144 HIS N N 144 124.275 125.119 -0.844 1 1 1132 . 8 1 1 A 145 145 THR H H 145 9.031 8.502 0.529 1 1 1133 . 8 1 1 A 145 145 THR HA H 145 4.025 5.324 -1.299 1 1 1138 . 8 1 1 A 145 145 THR CA C 145 61.247 60.034 1.213 1 1 1139 . 8 1 1 A 145 145 THR CB C 145 65.181 71.299 -6.118 1 1 1141 . 8 1 1 A 145 145 THR N N 145 125.828 119.629 6.199 1 1 1142 . 8 1 1 A 146 146 SER H H 146 9.077 8.922 0.155 1 1 1143 . 8 1 1 A 146 146 SER HA H 146 4.684 4.701 -0.017 1 1 1145 . 8 1 1 A 146 146 SER CA C 146 56.067 58.461 -2.394 1 1 1146 . 8 1 1 A 146 146 SER CB C 146 60.510 64.011 -3.501 1 1 1147 . 8 1 1 A 146 146 SER N N 146 124.154 120.084 4.070 1 1 1148 . 8 1 1 A 147 147 PHE H H 147 9.049 9.280 -0.231 1 1 1149 . 8 1 1 A 147 147 PHE HA H 147 4.022 4.069 -0.047 1 1 1154 . 8 1 1 A 147 147 PHE N N 147 127.670 124.083 3.587 1 1 1155 . 8 1 1 A 148 148 ASP H H 148 8.504 8.400 0.104 1 1 1156 . 8 1 1 A 148 148 ASP HA H 148 4.422 4.355 0.067 1 1 1158 . 8 1 1 A 148 148 ASP CA C 148 52.584 57.500 -4.916 1 1 1159 . 8 1 1 A 148 148 ASP CB C 148 37.800 40.689 -2.889 1 1 1160 . 8 1 1 A 148 148 ASP N N 148 114.377 119.081 -4.704 1 1 1161 . 8 1 1 A 149 149 LYS H H 149 7.380 7.961 -0.581 1 1 1162 . 8 1 1 A 149 149 LYS HA H 149 4.487 4.075 0.412 1 1 1171 . 8 1 1 A 149 149 LYS CA C 149 51.735 58.133 -6.398 1 1 1172 . 8 1 1 A 149 149 LYS CB C 149 30.162 32.305 -2.143 1 1 1175 . 8 1 1 A 149 149 LYS N N 149 119.137 118.744 0.393 1 1 1176 . 8 1 1 A 150 150 LEU H H 150 6.886 9.692 -2.806 1 1 1177 . 8 1 1 A 150 150 LEU HA H 150 3.996 4.523 -0.527 1 1 1186 . 8 1 1 A 150 150 LEU CA C 150 50.502 56.123 -5.621 1 1 1187 . 8 1 1 A 150 150 LEU N N 150 120.614 119.453 1.161 1 1 1188 . 8 1 1 A 151 151 PRO CB C 151 29.567 32.421 -2.854 1 1 1190 . 8 1 1 A 152 152 LYS H H 152 8.076 9.135 -1.059 1 1 1191 . 8 1 1 A 152 152 LYS HA H 152 4.346 4.586 -0.240 1 1 1195 . 8 1 1 A 152 152 LYS CA C 152 53.182 57.071 -3.889 1 1 1196 . 8 1 1 A 152 152 LYS CB C 152 31.487 35.007 -3.520 1 1 1198 . 8 1 1 A 152 152 LYS N N 152 118.133 118.672 -0.539 1 1 1199 . 8 1 1 A 153 153 ASP H H 153 7.982 8.452 -0.470 1 1 1200 . 8 1 1 A 153 153 ASP HA H 153 4.402 4.915 -0.513 1 1 1203 . 8 1 1 A 153 153 ASP CA C 153 52.584 53.365 -0.781 1 1 1204 . 8 1 1 A 153 153 ASP CB C 153 37.762 41.675 -3.913 1 1 1205 . 8 1 1 A 153 153 ASP N N 153 115.735 117.897 -2.162 1 1 1206 . 8 1 1 A 154 154 VAL H H 154 6.987 7.725 -0.738 1 1 1207 . 8 1 1 A 154 154 VAL HA H 154 4.406 4.325 0.081 1 1 1215 . 8 1 1 A 154 154 VAL CA C 154 58.408 59.659 -1.251 1 1 1216 . 8 1 1 A 154 154 VAL CB C 154 32.617 33.166 -0.549 1 1 1217 . 8 1 1 A 154 154 VAL N N 154 116.266 119.725 -3.459 1 1 1218 . 8 1 1 A 155 155 MET H H 155 8.444 8.314 0.130 1 1 1219 . 8 1 1 A 155 155 MET HA H 155 5.416 4.888 0.528 1 1 1224 . 8 1 1 A 155 155 MET CA C 155 51.183 53.552 -2.369 1 1 1226 . 8 1 1 A 155 155 MET N N 155 124.950 121.329 3.621 1 1 1227 . 8 1 1 A 156 156 ALA H H 156 9.226 8.667 0.559 1 1 1228 . 8 1 1 A 156 156 ALA HA H 156 4.693 5.063 -0.370 1 1 1232 . 8 1 1 A 156 156 ALA CA C 156 48.379 51.143 -2.764 1 1 1233 . 8 1 1 A 156 156 ALA CB C 156 21.051 23.080 -2.029 1 1 1234 . 8 1 1 A 156 156 ALA N N 156 129.938 122.478 7.460 1 1 1235 . 8 1 1 A 157 157 THR H H 157 8.554 8.473 0.081 1 1 1236 . 8 1 1 A 157 157 THR HA H 157 4.839 5.264 -0.425 1 1 1241 . 8 1 1 A 157 157 THR CA C 157 59.555 61.117 -1.562 1 1 1242 . 8 1 1 A 157 157 THR CB C 157 68.575 71.273 -2.698 1 1 1244 . 8 1 1 A 157 157 THR N N 157 118.815 118.000 0.815 1 1 1245 . 8 1 1 A 158 158 TYR H H 158 9.974 9.768 0.206 1 1 1246 . 8 1 1 A 158 158 TYR HA H 158 4.435 5.215 -0.780 1 1 1253 . 8 1 1 A 158 158 TYR N N 158 126.958 123.267 3.691 1 1 1254 . 8 1 1 A 159 159 ARG H H 159 8.909 8.719 0.190 1 1 1255 . 8 1 1 A 159 159 ARG HA H 159 5.444 5.297 0.147 1 1 1263 . 8 1 1 A 159 159 ARG CA C 159 51.933 54.589 -2.656 1 1 1264 . 8 1 1 A 159 159 ARG N N 159 121.721 118.880 2.841 1 1 1266 . 8 1 1 A 160 160 GLY H H 160 8.910 8.513 0.397 1 1 1267 . 8 1 1 A 160 160 GLY HA2 H 160 4.904 4.306 0.598 1 1 1268 . 8 1 1 A 160 160 GLY HA3 H 160 4.484 4.441 0.043 1 1 1269 . 8 1 1 A 160 160 GLY N N 160 113.921 106.629 7.292 1 1 1270 . 8 1 1 A 161 161 THR H H 161 9.110 9.671 -0.561 1 1 1271 . 8 1 1 A 161 161 THR HA H 161 4.810 5.427 -0.617 1 1 1276 . 8 1 1 A 161 161 THR CA C 161 59.603 61.222 -1.619 1 1 1277 . 8 1 1 A 161 161 THR CB C 161 69.909 72.331 -2.422 1 1 1279 . 8 1 1 A 161 161 THR N N 161 126.813 115.582 11.231 1 1 1280 . 8 1 1 A 162 162 ALA H H 162 7.137 9.859 -2.722 1 1 1281 . 8 1 1 A 162 162 ALA HA H 162 5.361 5.171 0.190 1 1 1285 . 8 1 1 A 162 162 ALA CA C 162 46.573 50.805 -4.232 1 1 1286 . 8 1 1 A 162 162 ALA CB C 162 20.959 23.889 -2.930 1 1 1287 . 8 1 1 A 162 162 ALA N N 162 128.111 123.841 4.270 1 1 1288 . 8 1 1 A 163 163 PHE H H 163 8.587 9.326 -0.739 1 1 1289 . 8 1 1 A 163 163 PHE HA H 163 5.538 5.628 -0.090 1 1 1296 . 8 1 1 A 163 163 PHE N N 163 117.349 114.668 2.681 1 1 1297 . 8 1 1 A 164 164 GLY H H 164 8.650 9.051 -0.401 1 1 1298 . 8 1 1 A 164 164 GLY HA2 H 164 4.210 3.995 0.215 1 1 1299 . 8 1 1 A 164 164 GLY HA3 H 164 3.285 4.182 -0.897 1 1 1300 . 8 1 1 A 164 164 GLY CA C 164 40.377 43.772 -3.395 1 1 1301 . 8 1 1 A 164 164 GLY N N 164 108.839 108.544 0.295 1 1 1302 . 8 1 1 A 165 165 SER H H 165 7.684 8.634 -0.950 1 1 1303 . 8 1 1 A 165 165 SER HA H 165 3.458 4.637 -1.179 1 1 1304 . 8 1 1 A 165 165 SER N N 165 116.037 116.937 -0.900 1 1 1305 . 8 1 1 A 166 166 ASP H H 166 9.718 8.268 1.450 1 1 1306 . 8 1 1 A 166 166 ASP HA H 166 4.281 4.830 -0.549 1 1 1309 . 8 1 1 A 166 166 ASP CA C 166 52.584 53.626 -1.042 1 1 1310 . 8 1 1 A 166 166 ASP N N 166 125.166 120.465 4.701 1 1 1311 . 8 1 1 A 167 167 ASP H H 167 7.655 7.624 0.031 1 1 1312 . 8 1 1 A 167 167 ASP HA H 167 4.666 5.010 -0.344 1 1 1315 . 8 1 1 A 167 167 ASP CB C 167 38.948 44.133 -5.185 1 1 1316 . 8 1 1 A 167 167 ASP N N 167 117.491 118.632 -1.141 1 1 1317 . 8 1 1 A 168 168 ALA H H 168 8.585 8.526 0.059 1 1 1318 . 8 1 1 A 168 168 ALA HA H 168 5.012 4.039 0.973 1 1 1322 . 8 1 1 A 168 168 ALA CA C 168 47.485 54.609 -7.124 1 1 1323 . 8 1 1 A 168 168 ALA N N 168 128.834 122.942 5.892 1 1 1324 . 8 1 1 A 169 169 GLY H H 169 8.472 7.517 0.955 1 1 1325 . 8 1 1 A 169 169 GLY HA2 H 169 4.404 4.150 0.254 1 1 1326 . 8 1 1 A 169 169 GLY HA3 H 169 4.051 4.171 -0.120 1 1 1327 . 8 1 1 A 169 169 GLY CA C 169 43.257 46.022 -2.765 1 1 1328 . 8 1 1 A 169 169 GLY N N 169 107.133 103.244 3.889 1 1 1329 . 8 1 1 A 170 170 GLY H H 170 7.229 8.044 -0.815 1 1 1330 . 8 1 1 A 170 170 GLY HA2 H 170 4.223 4.173 0.050 1 1 1331 . 8 1 1 A 170 170 GLY HA3 H 170 3.781 4.215 -0.434 1 1 1332 . 8 1 1 A 170 170 GLY CA C 170 43.310 45.859 -2.549 1 1 1333 . 8 1 1 A 170 170 GLY N N 170 107.542 109.695 -2.153 1 1 1334 . 8 1 1 A 171 171 LYS H H 171 9.641 8.442 1.199 1 1 1335 . 8 1 1 A 171 171 LYS HA H 171 5.129 5.131 -0.002 1 1 1342 . 8 1 1 A 171 171 LYS CA C 171 51.355 55.422 -4.067 1 1 1343 . 8 1 1 A 171 171 LYS N N 171 124.322 120.806 3.516 1 1 1344 . 8 1 1 A 172 172 LEU H H 172 7.764 8.649 -0.885 1 1 1345 . 8 1 1 A 172 172 LEU HA H 172 4.973 4.971 0.002 1 1 1353 . 8 1 1 A 172 172 LEU CA C 172 50.348 53.805 -3.457 1 1 1354 . 8 1 1 A 172 172 LEU N N 172 126.389 122.988 3.401 1 1 1355 . 8 1 1 A 173 173 THR H H 173 8.321 8.667 -0.346 1 1 1356 . 8 1 1 A 173 173 THR HA H 173 5.017 5.086 -0.069 1 1 1361 . 8 1 1 A 173 173 THR CA C 173 59.149 61.361 -2.212 1 1 1362 . 8 1 1 A 173 173 THR CB C 173 67.449 70.563 -3.114 1 1 1364 . 8 1 1 A 173 173 THR N N 173 123.553 115.670 7.883 1 1 1365 . 8 1 1 A 174 174 TYR H H 174 9.367 9.264 0.103 1 1 1366 . 8 1 1 A 174 174 TYR HA H 174 4.660 5.174 -0.514 1 1 1373 . 8 1 1 A 174 174 TYR CB C 174 41.267 41.244 0.023 1 1 1374 . 8 1 1 A 174 174 TYR N N 174 129.583 125.630 3.953 1 1 1375 . 8 1 1 A 175 175 THR H H 175 8.529 9.717 -1.188 1 1 1376 . 8 1 1 A 175 175 THR HA H 175 5.388 4.850 0.538 1 1 1381 . 8 1 1 A 175 175 THR CA C 175 58.216 61.756 -3.540 1 1 1382 . 8 1 1 A 175 175 THR CB C 175 68.575 68.986 -0.411 1 1 1384 . 8 1 1 A 175 175 THR N N 175 125.967 118.345 7.622 1 1 1385 . 8 1 1 A 176 176 ILE H H 176 9.139 9.145 -0.006 1 1 1386 . 8 1 1 A 176 176 ILE HA H 176 4.382 4.800 -0.418 1 1 1395 . 8 1 1 A 176 176 ILE CA C 176 58.006 60.181 -2.175 1 1 1396 . 8 1 1 A 176 176 ILE CB C 176 38.881 38.912 -0.031 1 1 1400 . 8 1 1 A 176 176 ILE N N 176 123.715 127.241 -3.526 1 1 1401 . 8 1 1 A 177 177 ASP H H 177 8.501 8.603 -0.102 1 1 1402 . 8 1 1 A 177 177 ASP HA H 177 5.011 4.553 0.458 1 1 1405 . 8 1 1 A 177 177 ASP CA C 177 49.089 54.532 -5.443 1 1 1406 . 8 1 1 A 177 177 ASP CB C 177 39.282 41.026 -1.744 1 1 1407 . 8 1 1 A 177 177 ASP N N 177 125.978 128.726 -2.748 1 1 1408 . 8 1 1 A 178 178 PHE H H 178 8.913 10.327 -1.414 1 1 1409 . 8 1 1 A 178 178 PHE HA H 178 3.993 4.561 -0.568 1 1 1414 . 8 1 1 A 178 178 PHE CB C 178 34.588 39.710 -5.122 1 1 1415 . 8 1 1 A 178 178 PHE N N 178 123.522 120.759 2.763 1 1 1416 . 8 1 1 A 179 179 ALA H H 179 8.487 8.969 -0.482 1 1 1417 . 8 1 1 A 179 179 ALA HA H 179 4.528 4.401 0.127 1 1 1421 . 8 1 1 A 179 179 ALA CA C 179 52.584 55.854 -3.270 1 1 1422 . 8 1 1 A 179 179 ALA CB C 179 15.666 18.774 -3.108 1 1 1423 . 8 1 1 A 179 179 ALA N N 179 124.061 123.824 0.237 1 1 1424 . 8 1 1 A 180 180 ALA H H 180 7.162 7.862 -0.700 1 1 1425 . 8 1 1 A 180 180 ALA HA H 180 4.313 4.335 -0.022 1 1 1429 . 8 1 1 A 180 180 ALA CA C 180 49.006 52.686 -3.680 1 1 1430 . 8 1 1 A 180 180 ALA CB C 180 16.933 17.972 -1.039 1 1 1431 . 8 1 1 A 180 180 ALA N N 180 119.710 119.487 0.223 1 1 1432 . 8 1 1 A 181 181 LYS H H 181 8.092 8.551 -0.459 1 1 1433 . 8 1 1 A 181 181 LYS HA H 181 3.457 4.668 -1.211 1 1 1440 . 8 1 1 A 181 181 LYS CA C 181 54.783 56.818 -2.035 1 1 1441 . 8 1 1 A 181 181 LYS CB C 181 27.088 34.101 -7.013 1 1 1444 . 8 1 1 A 181 181 LYS N N 181 114.996 116.192 -1.196 1 1 1445 . 8 1 1 A 182 182 GLN H H 182 7.532 8.154 -0.622 1 1 1446 . 8 1 1 A 182 182 GLN HA H 182 5.304 4.731 0.573 1 1 1453 . 8 1 1 A 182 182 GLN CA C 182 51.473 54.833 -3.360 1 1 1454 . 8 1 1 A 182 182 GLN CB C 182 31.585 31.075 0.510 1 1 1455 . 8 1 1 A 182 182 GLN N N 182 115.064 113.574 1.490 1 1 1457 . 8 1 1 A 183 183 GLY H H 183 9.026 8.276 0.750 1 1 1458 . 8 1 1 A 183 183 GLY HA2 H 183 5.376 4.162 1.214 1 1 1459 . 8 1 1 A 183 183 GLY HA3 H 183 3.567 4.374 -0.807 1 1 1460 . 8 1 1 A 183 183 GLY CA C 183 42.361 44.837 -2.476 1 1 1461 . 8 1 1 A 183 183 GLY N N 183 111.505 106.570 4.935 1 1 1462 . 8 1 1 A 184 184 HIS H H 184 7.508 8.659 -1.151 1 1 1463 . 8 1 1 A 184 184 HIS HA H 184 4.304 5.451 -1.147 1 1 1467 . 8 1 1 A 184 184 HIS CA C 184 52.793 53.773 -0.980 1 1 1468 . 8 1 1 A 184 184 HIS CB C 184 27.906 32.797 -4.891 1 1 1469 . 8 1 1 A 184 184 HIS N N 184 111.297 119.735 -8.438 1 1 1470 . 8 1 1 A 185 185 GLY H H 185 9.160 7.611 1.549 1 1 1471 . 8 1 1 A 185 185 GLY HA2 H 185 4.464 3.611 0.853 1 1 1472 . 8 1 1 A 185 185 GLY HA3 H 185 4.117 4.029 0.088 1 1 1473 . 8 1 1 A 185 185 GLY CA C 185 44.212 45.796 -1.584 1 1 1474 . 8 1 1 A 185 185 GLY N N 185 107.398 105.337 2.061 1 1 1475 . 8 1 1 A 186 186 LYS H H 186 9.170 8.112 1.058 1 1 1476 . 8 1 1 A 186 186 LYS HA H 186 4.925 5.107 -0.182 1 1 1481 . 8 1 1 A 186 186 LYS CB C 186 33.642 36.586 -2.944 1 1 1482 . 8 1 1 A 186 186 LYS N N 186 122.690 120.820 1.870 1 1 1483 . 8 1 1 A 187 187 ILE H H 187 8.444 8.454 -0.010 1 1 1484 . 8 1 1 A 187 187 ILE HA H 187 4.626 4.951 -0.325 1 1 1487 . 8 1 1 A 187 187 ILE N N 187 124.320 122.426 1.894 1 1 1488 . 8 1 1 A 188 188 GLU H H 188 8.590 8.513 0.077 1 1 1489 . 8 1 1 A 188 188 GLU HA H 188 4.650 4.692 -0.042 1 1 1495 . 8 1 1 A 188 188 GLU N N 188 122.575 127.562 -4.987 1 1 1496 . 8 1 1 A 189 189 HIS H H 189 8.726 7.721 1.005 1 1 1497 . 8 1 1 A 189 189 HIS HA H 189 4.055 4.207 -0.152 1 1 1501 . 8 1 1 A 189 189 HIS CA C 189 54.623 59.341 -4.718 1 1 1502 . 8 1 1 A 189 189 HIS CB C 189 24.997 30.009 -5.012 1 1 1503 . 8 1 1 A 189 189 HIS N N 189 111.381 124.085 -12.704 1 1 1504 . 8 1 1 A 190 190 LEU H H 190 9.715 7.766 1.949 1 1 1505 . 8 1 1 A 190 190 LEU HA H 190 4.379 4.324 0.055 1 1 1515 . 8 1 1 A 190 190 LEU N N 190 124.648 116.153 8.495 1 1 1516 . 8 1 1 A 191 191 LYS H H 191 10.099 8.079 2.020 1 1 1517 . 8 1 1 A 191 191 LYS HA H 191 3.736 4.512 -0.776 1 1 1524 . 8 1 1 A 191 191 LYS CA C 191 55.815 56.634 -0.819 1 1 1525 . 8 1 1 A 191 191 LYS CB C 191 30.201 35.243 -5.042 1 1 1527 . 8 1 1 A 191 191 LYS N N 191 123.618 120.045 3.573 1 1 1528 . 8 1 1 A 192 192 SER H H 192 6.991 7.845 -0.854 1 1 1529 . 8 1 1 A 192 192 SER HA H 192 4.743 4.470 0.273 1 1 1532 . 8 1 1 A 192 192 SER CA C 192 51.974 57.612 -5.638 1 1 1533 . 8 1 1 A 192 192 SER CB C 192 60.005 63.781 -3.776 1 1 1534 . 8 1 1 A 192 192 SER N N 192 115.071 117.026 -1.955 1 1 1535 . 8 1 1 A 193 193 PRO CB C 193 29.607 30.177 -0.570 1 1 1537 . 8 1 1 A 194 194 GLU H H 194 8.213 8.625 -0.412 1 1 1538 . 8 1 1 A 194 194 GLU HA H 194 3.063 4.823 -1.760 1 1 1543 . 8 1 1 A 194 194 GLU CA C 194 54.185 57.377 -3.192 1 1 1545 . 8 1 1 A 194 194 GLU N N 194 114.055 118.941 -4.886 1 1 1546 . 8 1 1 A 195 195 LEU H H 195 7.082 7.706 -0.624 1 1 1547 . 8 1 1 A 195 195 LEU HA H 195 4.027 4.349 -0.322 1 1 1557 . 8 1 1 A 195 195 LEU CA C 195 51.361 54.280 -2.919 1 1 1558 . 8 1 1 A 195 195 LEU CB C 195 38.950 41.321 -2.371 1 1 1561 . 8 1 1 A 195 195 LEU N N 195 113.898 118.622 -4.724 1 1 1562 . 8 1 1 A 196 196 ASN H H 196 7.060 7.697 -0.637 1 1 1563 . 8 1 1 A 196 196 ASN HA H 196 4.638 5.119 -0.481 1 1 1567 . 8 1 1 A 196 196 ASN N N 196 119.196 116.719 2.477 1 1 1568 . 8 1 1 A 197 197 VAL H H 197 7.244 8.116 -0.872 1 1 1569 . 8 1 1 A 197 197 VAL HA H 197 4.540 4.283 0.257 1 1 1577 . 8 1 1 A 197 197 VAL CA C 197 57.176 59.940 -2.764 1 1 1578 . 8 1 1 A 197 197 VAL N N 197 113.621 118.326 -4.705 1 1 1579 . 8 1 1 A 198 198 ASP H H 198 8.881 9.311 -0.430 1 1 1580 . 8 1 1 A 198 198 ASP HA H 198 4.894 4.626 0.268 1 1 1581 . 8 1 1 A 198 198 ASP N N 198 118.852 125.700 -6.848 1 1 1582 . 8 1 1 A 199 199 LEU H H 199 8.498 8.038 0.460 1 1 1583 . 8 1 1 A 199 199 LEU HA H 199 4.317 4.290 0.027 1 1 1591 . 8 1 1 A 199 199 LEU N N 199 124.078 126.267 -2.189 1 1 1592 . 8 1 1 A 200 200 ALA H H 200 8.386 8.613 -0.227 1 1 1593 . 8 1 1 A 200 200 ALA HA H 200 4.295 5.179 -0.884 1 1 1597 . 8 1 1 A 200 200 ALA CA C 200 50.044 51.005 -0.961 1 1 1598 . 8 1 1 A 200 200 ALA CB C 200 17.985 22.229 -4.244 1 1 1599 . 8 1 1 A 200 200 ALA N N 200 127.315 125.048 2.267 1 1 1600 . 8 1 1 A 201 201 VAL H H 201 8.007 9.066 -1.059 1 1 1601 . 8 1 1 A 201 201 VAL HA H 201 4.577 4.799 -0.222 1 1 1609 . 8 1 1 A 201 201 VAL CA C 201 60.004 60.160 -0.156 1 1 1610 . 8 1 1 A 201 201 VAL CB C 201 28.863 36.047 -7.184 1 1 1611 . 8 1 1 A 201 201 VAL N N 201 119.409 121.965 -2.556 1 1 1612 . 8 1 1 A 202 202 ALA H H 202 8.789 9.141 -0.352 1 1 1613 . 8 1 1 A 202 202 ALA HA H 202 4.630 5.466 -0.836 1 1 1617 . 8 1 1 A 202 202 ALA CA C 202 48.200 49.907 -1.707 1 1 1618 . 8 1 1 A 202 202 ALA N N 202 131.745 126.287 5.458 1 1 1619 . 8 1 1 A 203 203 TYR H H 203 8.522 9.002 -0.480 1 1 1620 . 8 1 1 A 203 203 TYR HA H 203 5.391 5.321 0.070 1 1 1627 . 8 1 1 A 203 203 TYR CA C 203 54.648 57.225 -2.577 1 1 1628 . 8 1 1 A 203 203 TYR CB C 203 37.315 41.256 -3.941 1 1 1629 . 8 1 1 A 203 203 TYR N N 203 117.786 123.240 -5.454 1 1 1630 . 8 1 1 A 204 204 ILE H H 204 8.209 7.879 0.330 1 1 1631 . 8 1 1 A 204 204 ILE HA H 204 4.393 4.691 -0.298 1 1 1641 . 8 1 1 A 204 204 ILE CB C 204 36.807 40.874 -4.067 1 1 1644 . 8 1 1 A 204 204 ILE N N 204 120.602 126.563 -5.961 1 1 1645 . 8 1 1 A 205 205 LYS H H 205 9.340 8.866 0.474 1 1 1646 . 8 1 1 A 205 205 LYS HA H 205 4.756 4.321 0.435 1 1 1651 . 8 1 1 A 205 205 LYS CA C 205 50.844 60.551 -9.707 1 1 1652 . 8 1 1 A 205 205 LYS N N 205 127.960 123.982 3.978 1 1 1653 . 8 1 1 A 207 207 ASP H H 207 8.436 9.962 -1.526 1 1 1654 . 8 1 1 A 207 207 ASP HA H 207 4.692 4.168 0.524 1 1 1657 . 8 1 1 A 207 207 ASP CA C 207 48.789 54.817 -6.028 1 1 1658 . 8 1 1 A 207 207 ASP CB C 207 38.377 40.930 -2.553 1 1 1659 . 8 1 1 A 207 207 ASP N N 207 123.098 125.341 -2.243 1 1 1660 . 8 1 1 A 208 208 GLU H H 208 8.880 8.204 0.676 1 1 1661 . 8 1 1 A 208 208 GLU HA H 208 3.994 4.039 -0.045 1 1 1666 . 8 1 1 A 208 208 GLU CA C 208 56.123 58.928 -2.805 1 1 1667 . 8 1 1 A 208 208 GLU CB C 208 25.794 29.606 -3.812 1 1 1669 . 8 1 1 A 208 208 GLU N N 208 119.042 121.416 -2.374 1 1 1670 . 8 1 1 A 209 209 LYS H H 209 7.681 7.628 0.053 1 1 1671 . 8 1 1 A 209 209 LYS HA H 209 4.141 4.384 -0.243 1 1 1680 . 8 1 1 A 209 209 LYS N N 209 119.252 116.224 3.028 1 1 1681 . 8 1 1 A 210 210 HIS H H 210 8.177 6.700 1.477 1 1 1682 . 8 1 1 A 210 210 HIS HA H 210 3.825 4.717 -0.892 1 1 1687 . 8 1 1 A 210 210 HIS CA C 210 54.205 54.881 -0.676 1 1 1688 . 8 1 1 A 210 210 HIS CB C 210 23.439 30.727 -7.288 1 1 1689 . 8 1 1 A 210 210 HIS N N 210 112.758 112.267 0.491 1 1 1690 . 8 1 1 A 211 211 HIS H H 211 8.758 7.094 1.664 1 1 1691 . 8 1 1 A 211 211 HIS HA H 211 5.041 4.799 0.242 1 1 1695 . 8 1 1 A 211 211 HIS CA C 211 50.450 54.819 -4.369 1 1 1696 . 8 1 1 A 211 211 HIS CB C 211 25.703 33.386 -7.683 1 1 1697 . 8 1 1 A 211 211 HIS N N 211 119.552 118.507 1.045 1 1 1698 . 8 1 1 A 212 212 ALA H H 212 8.556 8.131 0.425 1 1 1699 . 8 1 1 A 212 212 ALA HA H 212 4.712 4.116 0.596 1 1 1703 . 8 1 1 A 212 212 ALA CA C 212 49.886 51.831 -1.945 1 1 1704 . 8 1 1 A 212 212 ALA CB C 212 18.860 19.113 -0.253 1 1 1705 . 8 1 1 A 212 212 ALA N N 212 123.780 123.798 -0.018 1 1 1706 . 8 1 1 A 213 213 VAL H H 213 9.338 7.510 1.828 1 1 1707 . 8 1 1 A 213 213 VAL HA H 213 5.074 4.789 0.285 1 1 1715 . 8 1 1 A 213 213 VAL CA C 213 57.486 60.318 -2.832 1 1 1716 . 8 1 1 A 213 213 VAL CB C 213 33.938 35.639 -1.701 1 1 1717 . 8 1 1 A 213 213 VAL N N 213 124.742 119.166 5.576 1 1 1718 . 8 1 1 A 214 214 ILE H H 214 8.962 8.387 0.575 1 1 1719 . 8 1 1 A 214 214 ILE HA H 214 4.434 4.880 -0.446 1 1 1726 . 8 1 1 A 214 214 ILE N N 214 122.881 126.980 -4.099 1 1 1727 . 8 1 1 A 215 215 SER H H 215 8.558 8.611 -0.053 1 1 1728 . 8 1 1 A 215 215 SER HA H 215 5.001 5.478 -0.477 1 1 1731 . 8 1 1 A 215 215 SER CA C 215 53.230 56.617 -3.387 1 1 1732 . 8 1 1 A 215 215 SER CB C 215 62.077 66.066 -3.989 1 1 1733 . 8 1 1 A 215 215 SER N N 215 122.891 121.396 1.495 1 1 1734 . 8 1 1 A 216 216 GLY H H 216 7.282 8.957 -1.675 1 1 1735 . 8 1 1 A 216 216 GLY HA2 H 216 4.515 4.382 0.133 1 1 1736 . 8 1 1 A 216 216 GLY HA3 H 216 3.473 4.420 -0.947 1 1 1737 . 8 1 1 A 216 216 GLY CA C 216 42.816 46.220 -3.404 1 1 1738 . 8 1 1 A 216 216 GLY N N 216 110.899 113.218 -2.319 1 1 1739 . 8 1 1 A 217 217 SER H H 217 8.673 9.109 -0.436 1 1 1740 . 8 1 1 A 217 217 SER HA H 217 5.127 5.482 -0.355 1 1 1743 . 8 1 1 A 217 217 SER CA C 217 56.266 56.758 -0.492 1 1 1744 . 8 1 1 A 217 217 SER N N 217 117.164 117.029 0.135 1 1 1745 . 8 1 1 A 218 218 VAL H H 218 7.451 9.288 -1.837 1 1 1746 . 8 1 1 A 218 218 VAL HA H 218 5.128 4.803 0.325 1 1 1754 . 8 1 1 A 218 218 VAL CA C 218 56.637 61.270 -4.633 1 1 1755 . 8 1 1 A 218 218 VAL N N 218 117.826 119.803 -1.977 1 1 1756 . 8 1 1 A 219 219 LEU H H 219 9.022 8.621 0.401 1 1 1757 . 8 1 1 A 219 219 LEU HA H 219 5.387 5.123 0.264 1 1 1767 . 8 1 1 A 219 219 LEU CA C 219 50.450 54.016 -3.566 1 1 1768 . 8 1 1 A 219 219 LEU N N 219 124.820 127.087 -2.267 1 1 1769 . 8 1 1 A 220 220 TYR H H 220 8.816 9.037 -0.221 1 1 1770 . 8 1 1 A 220 220 TYR HA H 220 4.834 5.040 -0.206 1 1 1777 . 8 1 1 A 220 220 TYR N N 220 121.249 126.269 -5.020 1 1 1778 . 8 1 1 A 221 221 ASN H H 221 9.191 8.090 1.101 1 1 1779 . 8 1 1 A 221 221 ASN HA H 221 4.048 4.602 -0.554 1 1 1784 . 8 1 1 A 221 221 ASN CA C 221 51.647 54.991 -3.344 1 1 1785 . 8 1 1 A 221 221 ASN CB C 221 36.640 37.851 -1.211 1 1 1786 . 8 1 1 A 221 221 ASN N N 221 129.865 123.577 6.288 1 1 1788 . 8 1 1 A 222 222 GLN H H 222 8.468 7.824 0.644 1 1 1789 . 8 1 1 A 222 222 GLN HA H 222 3.671 4.514 -0.843 1 1 1794 . 8 1 1 A 222 222 GLN CA C 222 55.075 54.951 0.124 1 1 1795 . 8 1 1 A 222 222 GLN CB C 222 24.663 29.637 -4.974 1 1 1797 . 8 1 1 A 222 222 GLN N N 222 108.367 118.265 -9.898 1 1 1798 . 8 1 1 A 223 223 ASP H H 223 7.797 8.062 -0.265 1 1 1799 . 8 1 1 A 223 223 ASP HA H 223 4.986 5.001 -0.015 1 1 1802 . 8 1 1 A 223 223 ASP N N 223 120.842 120.242 0.600 1 1 1803 . 8 1 1 A 224 224 GLU H H 224 8.731 8.282 0.449 1 1 1804 . 8 1 1 A 224 224 GLU HA H 224 4.690 4.689 0.001 1 1 1809 . 8 1 1 A 224 224 GLU CA C 224 54.703 55.395 -0.692 1 1 1810 . 8 1 1 A 224 224 GLU CB C 224 26.357 30.535 -4.178 1 1 1812 . 8 1 1 A 224 224 GLU N N 224 124.249 115.655 8.594 1 1 1813 . 8 1 1 A 225 225 LYS H H 225 8.730 8.153 0.577 1 1 1814 . 8 1 1 A 225 225 LYS HA H 225 4.754 4.741 0.013 1 1 1822 . 8 1 1 A 225 225 LYS N N 225 126.784 119.305 7.479 1 1 1823 . 8 1 1 A 226 226 GLY H H 226 7.683 8.583 -0.900 1 1 1824 . 8 1 1 A 226 226 GLY HA2 H 226 5.567 4.181 1.386 1 1 1825 . 8 1 1 A 226 226 GLY HA3 H 226 3.819 4.219 -0.400 1 1 1826 . 8 1 1 A 226 226 GLY CA C 226 42.264 44.359 -2.095 1 1 1827 . 8 1 1 A 226 226 GLY N N 226 107.140 111.272 -4.132 1 1 1828 . 8 1 1 A 227 227 SER H H 227 8.672 11.216 -2.544 1 1 1829 . 8 1 1 A 227 227 SER HA H 227 5.564 5.660 -0.096 1 1 1832 . 8 1 1 A 227 227 SER CA C 227 54.373 57.094 -2.721 1 1 1833 . 8 1 1 A 227 227 SER CB C 227 63.963 67.076 -3.113 1 1 1834 . 8 1 1 A 227 227 SER N N 227 117.767 115.767 2.000 1 1 1835 . 8 1 1 A 228 228 TYR H H 228 9.073 8.467 0.606 1 1 1836 . 8 1 1 A 228 228 TYR HA H 228 5.519 5.104 0.415 1 1 1843 . 8 1 1 A 228 228 TYR N N 228 118.324 123.368 -5.044 1 1 1844 . 8 1 1 A 229 229 SER H H 229 8.929 7.870 1.059 1 1 1845 . 8 1 1 A 229 229 SER HA H 229 5.209 5.267 -0.058 1 1 1848 . 8 1 1 A 229 229 SER CA C 229 54.131 57.497 -3.366 1 1 1849 . 8 1 1 A 229 229 SER N N 229 116.118 120.890 -4.772 1 1 1850 . 8 1 1 A 230 230 LEU H H 230 9.372 9.041 0.331 1 1 1851 . 8 1 1 A 230 230 LEU HA H 230 4.803 4.836 -0.033 1 1 1863 . 8 1 1 A 230 230 LEU N N 230 124.803 125.307 -0.504 1 1 1864 . 8 1 1 A 231 231 GLY H H 231 9.080 8.225 0.855 1 1 1865 . 8 1 1 A 231 231 GLY HA2 H 231 4.776 4.083 0.693 1 1 1866 . 8 1 1 A 231 231 GLY HA3 H 231 3.528 4.203 -0.675 1 1 1867 . 8 1 1 A 231 231 GLY CA C 231 41.468 44.504 -3.036 1 1 1868 . 8 1 1 A 231 231 GLY N N 231 109.611 108.476 1.135 1 1 1869 . 8 1 1 A 232 232 ILE H H 232 6.849 8.591 -1.742 1 1 1870 . 8 1 1 A 232 232 ILE HA H 232 4.742 4.164 0.578 1 1 1878 . 8 1 1 A 232 232 ILE N N 232 120.566 124.362 -3.796 1 1 1879 . 8 1 1 A 233 233 PHE H H 233 9.569 8.978 0.591 1 1 1880 . 8 1 1 A 233 233 PHE HA H 233 4.979 5.443 -0.464 1 1 1885 . 8 1 1 A 233 233 PHE N N 233 129.256 122.766 6.490 1 1 1886 . 8 1 1 A 234 234 GLY H H 234 8.734 8.621 0.113 1 1 1887 . 8 1 1 A 234 234 GLY HA2 H 234 4.488 4.354 0.134 1 1 1888 . 8 1 1 A 234 234 GLY HA3 H 234 3.327 4.415 -1.088 1 1 1889 . 8 1 1 A 234 234 GLY CA C 234 40.377 45.851 -5.474 1 1 1890 . 8 1 1 A 234 234 GLY N N 234 105.294 106.462 -1.168 1 1 1891 . 8 1 1 A 235 235 GLU H H 235 9.198 8.706 0.492 1 1 1892 . 8 1 1 A 235 235 GLU HA H 235 4.111 4.042 0.069 1 1 1897 . 8 1 1 A 235 235 GLU CA C 235 56.466 59.270 -2.804 1 1 1898 . 8 1 1 A 235 235 GLU CB C 235 26.256 29.671 -3.415 1 1 1900 . 8 1 1 A 235 235 GLU N N 235 125.813 124.717 1.096 1 1 1901 . 8 1 1 A 236 236 LYS H H 236 8.147 7.728 0.419 1 1 1902 . 8 1 1 A 236 236 LYS HA H 236 4.373 4.436 -0.063 1 1 1905 . 8 1 1 A 236 236 LYS N N 236 117.810 118.705 -0.895 1 1 1906 . 8 1 1 A 237 237 ALA H H 237 7.685 7.676 0.009 1 1 1907 . 8 1 1 A 237 237 ALA HA H 237 3.902 4.488 -0.586 1 1 1911 . 8 1 1 A 237 237 ALA CA C 237 49.762 51.014 -1.252 1 1 1912 . 8 1 1 A 237 237 ALA CB C 237 14.720 20.000 -5.280 1 1 1913 . 8 1 1 A 237 237 ALA N N 237 118.704 120.611 -1.907 1 1 1914 . 8 1 1 A 238 238 GLN H H 238 9.312 8.419 0.893 1 1 1915 . 8 1 1 A 238 238 GLN HA H 238 4.049 5.141 -1.092 1 1 1920 . 8 1 1 A 238 238 GLN N N 238 118.059 117.423 0.636 1 1 1921 . 8 1 1 A 239 239 GLU H H 239 8.785 8.595 0.190 1 1 1922 . 8 1 1 A 239 239 GLU HA H 239 5.531 5.489 0.042 1 1 1927 . 8 1 1 A 239 239 GLU N N 239 116.914 120.963 -4.049 1 1 1928 . 8 1 1 A 240 240 VAL H H 240 8.501 8.676 -0.175 1 1 1929 . 8 1 1 A 240 240 VAL HA H 240 5.655 3.206 2.449 1 1 1937 . 8 1 1 A 240 240 VAL CA C 240 55.582 59.534 -3.952 1 1 1940 . 8 1 1 A 240 240 VAL N N 240 110.588 120.395 -9.807 1 1 1941 . 8 1 1 A 241 241 ALA H H 241 8.463 8.138 0.325 1 1 1942 . 8 1 1 A 241 241 ALA HA H 241 5.014 5.267 -0.253 1 1 1946 . 8 1 1 A 241 241 ALA CA C 241 49.361 51.123 -1.762 1 1 1947 . 8 1 1 A 241 241 ALA CB C 241 18.196 23.791 -5.595 1 1 1948 . 8 1 1 A 241 241 ALA N N 241 121.125 128.419 -7.294 1 1 1949 . 8 1 1 A 242 242 GLY H H 242 9.421 8.419 1.002 1 1 1950 . 8 1 1 A 242 242 GLY HA2 H 242 5.161 4.226 0.935 1 1 1951 . 8 1 1 A 242 242 GLY HA3 H 242 4.076 4.305 -0.229 1 1 1952 . 8 1 1 A 242 242 GLY N N 242 112.036 106.643 5.393 1 1 1953 . 8 1 1 A 243 243 SER H H 243 8.929 8.230 0.699 1 1 1954 . 8 1 1 A 243 243 SER HA H 243 5.331 5.019 0.312 1 1 1957 . 8 1 1 A 243 243 SER N N 243 116.113 115.820 0.293 1 1 1958 . 8 1 1 A 244 244 ALA H H 244 9.218 8.837 0.381 1 1 1959 . 8 1 1 A 244 244 ALA HA H 244 5.221 4.995 0.226 1 1 1963 . 8 1 1 A 244 244 ALA CA C 244 47.883 49.898 -2.015 1 1 1964 . 8 1 1 A 244 244 ALA N N 244 120.635 124.324 -3.689 1 1 1965 . 8 1 1 A 245 245 GLU H H 245 9.194 8.277 0.917 1 1 1966 . 8 1 1 A 245 245 GLU HA H 245 4.869 5.080 -0.211 1 1 1971 . 8 1 1 A 245 245 GLU N N 245 123.487 117.328 6.159 1 1 1972 . 8 1 1 A 246 246 VAL H H 246 8.531 9.176 -0.645 1 1 1973 . 8 1 1 A 246 246 VAL HA H 246 4.518 4.657 -0.139 1 1 1981 . 8 1 1 A 246 246 VAL CA C 246 58.286 61.162 -2.876 1 1 1982 . 8 1 1 A 246 246 VAL N N 246 123.347 123.829 -0.482 1 1 1983 . 8 1 1 A 247 247 GLU H H 247 9.132 8.652 0.480 1 1 1984 . 8 1 1 A 247 247 GLU HA H 247 4.368 4.701 -0.333 1 1 1989 . 8 1 1 A 247 247 GLU CB C 247 26.744 31.489 -4.745 1 1 1990 . 8 1 1 A 247 247 GLU N N 247 129.243 126.918 2.325 1 1 1991 . 8 1 1 A 248 248 THR H H 248 7.827 8.431 -0.604 1 1 1992 . 8 1 1 A 248 248 THR HA H 248 4.749 4.682 0.067 1 1 1997 . 8 1 1 A 248 248 THR CA C 248 56.859 61.488 -4.629 1 1 1998 . 8 1 1 A 248 248 THR CB C 248 69.171 69.774 -0.603 1 1 2000 . 8 1 1 A 248 248 THR N N 248 114.228 118.518 -4.290 1 1 2001 . 8 1 1 A 249 249 ALA H H 249 9.148 8.156 0.992 1 1 2002 . 8 1 1 A 249 249 ALA HA H 249 4.174 4.541 -0.367 1 1 2006 . 8 1 1 A 249 249 ALA CA C 249 51.970 51.498 0.472 1 1 2007 . 8 1 1 A 249 249 ALA CB C 249 15.797 20.293 -4.496 1 1 2008 . 8 1 1 A 249 249 ALA N N 249 123.341 125.813 -2.472 1 1 2009 . 8 1 1 A 250 250 ASN H H 250 7.974 7.887 0.087 1 1 2010 . 8 1 1 A 250 250 ASN HA H 250 4.953 4.973 -0.020 1 1 2015 . 8 1 1 A 250 250 ASN CA C 250 49.198 52.626 -3.428 1 1 2016 . 8 1 1 A 250 250 ASN CB C 250 35.976 40.277 -4.301 1 1 2017 . 8 1 1 A 250 250 ASN N N 250 113.358 115.721 -2.363 1 1 2019 . 8 1 1 A 251 251 GLY H H 251 7.510 7.557 -0.047 1 1 2020 . 8 1 1 A 251 251 GLY HA2 H 251 4.492 4.145 0.347 1 1 2021 . 8 1 1 A 251 251 GLY HA3 H 251 3.853 4.190 -0.337 1 1 2022 . 8 1 1 A 251 251 GLY CA C 251 41.435 46.050 -4.615 1 1 2023 . 8 1 1 A 251 251 GLY N N 251 108.692 105.689 3.003 1 1 2024 . 8 1 1 A 252 252 ILE H H 252 8.465 8.458 0.007 1 1 2025 . 8 1 1 A 252 252 ILE HA H 252 4.521 4.632 -0.111 1 1 2035 . 8 1 1 A 252 252 ILE CB C 252 35.653 42.341 -6.688 1 1 2039 . 8 1 1 A 252 252 ILE N N 252 122.043 120.756 1.287 1 1 2040 . 8 1 1 A 253 253 HIS H H 253 9.311 9.313 -0.002 1 1 2041 . 8 1 1 A 253 253 HIS HA H 253 4.861 5.441 -0.580 1 1 2046 . 8 1 1 A 253 253 HIS N N 253 126.617 124.797 1.820 1 1 2047 . 8 1 1 A 254 254 HIS H H 254 8.820 8.933 -0.113 1 1 2048 . 8 1 1 A 254 254 HIS HA H 254 5.305 5.192 0.113 1 1 2051 . 8 1 1 A 254 254 HIS CA C 254 52.781 53.999 -1.218 1 1 2052 . 8 1 1 A 254 254 HIS N N 254 122.665 119.166 3.499 1 1 2053 . 8 1 1 A 255 255 ILE H H 255 9.047 8.416 0.631 1 1 2054 . 8 1 1 A 255 255 ILE HA H 255 4.651 4.434 0.217 1 1 2061 . 8 1 1 A 255 255 ILE N N 255 123.958 121.385 2.573 1 1 2062 . 8 1 1 A 256 256 GLY H H 256 9.339 7.549 1.790 1 1 2063 . 8 1 1 A 256 256 GLY HA2 H 256 3.816 3.358 0.458 1 1 2064 . 8 1 1 A 256 256 GLY HA3 H 256 2.267 3.629 -1.362 1 1 2065 . 8 1 1 A 256 256 GLY N N 256 115.022 110.380 4.642 1 1 2066 . 8 1 1 A 257 257 LEU H H 257 7.890 9.338 -1.448 1 1 2067 . 8 1 1 A 257 257 LEU HA H 257 4.853 5.030 -0.177 1 1 2077 . 8 1 1 A 257 257 LEU N N 257 121.441 122.836 -1.395 1 1 2078 . 8 1 1 A 258 258 ALA H H 258 7.982 9.002 -1.020 1 1 2079 . 8 1 1 A 258 258 ALA HA H 258 4.668 5.100 -0.432 1 1 2083 . 8 1 1 A 258 258 ALA CA C 258 49.678 51.750 -2.072 1 1 2084 . 8 1 1 A 258 258 ALA CB C 258 19.561 22.020 -2.459 1 1 2085 . 8 1 1 A 258 258 ALA N N 258 123.234 122.851 0.383 1 1 2086 . 8 1 1 A 259 259 ALA H H 259 9.117 9.137 -0.020 1 1 2087 . 8 1 1 A 259 259 ALA HA H 259 4.790 4.604 0.186 1 1 2091 . 8 1 1 A 259 259 ALA N N 259 123.901 122.953 0.948 1 1 2092 . 8 1 1 A 260 260 LYS H H 260 8.452 8.691 -0.239 1 1 2093 . 8 1 1 A 260 260 LYS HA H 260 5.914 5.610 0.304 1 1 2098 . 8 1 1 A 260 260 LYS CA C 260 51.818 54.026 -2.208 1 1 2099 . 8 1 1 A 260 260 LYS N N 260 116.464 116.280 0.184 1 1 1 . 9 1 1 A 9 9 SER H H 9 8.293 8.848 -0.555 1 1 2 . 9 1 1 A 9 9 SER HA H 9 4.432 5.295 -0.863 1 1 3 . 9 1 1 A 9 9 SER N N 9 116.407 113.522 2.885 1 1 4 . 9 1 1 A 10 10 GLY H H 10 8.472 9.095 -0.623 1 1 5 . 9 1 1 A 10 10 GLY N N 10 111.611 111.123 0.488 1 1 6 . 9 1 1 A 14 14 VAL H H 14 8.009 8.354 -0.345 1 1 7 . 9 1 1 A 14 14 VAL HA H 14 4.128 4.064 0.064 1 1 15 . 9 1 1 A 14 14 VAL CA C 14 59.473 62.753 -3.280 1 1 16 . 9 1 1 A 14 14 VAL CB C 14 30.127 32.582 -2.455 1 1 17 . 9 1 1 A 14 14 VAL N N 14 119.846 119.676 0.170 1 1 18 . 9 1 1 A 15 15 THR H H 15 8.152 8.222 -0.070 1 1 19 . 9 1 1 A 15 15 THR HA H 15 4.346 4.419 -0.073 1 1 24 . 9 1 1 A 15 15 THR N N 15 118.509 117.869 0.640 1 1 25 . 9 1 1 A 16 16 ALA H H 16 8.207 8.538 -0.331 1 1 26 . 9 1 1 A 16 16 ALA HA H 16 4.319 4.126 0.193 1 1 30 . 9 1 1 A 16 16 ALA CA C 16 49.835 53.711 -3.876 1 1 31 . 9 1 1 A 16 16 ALA CB C 16 16.714 18.480 -1.766 1 1 32 . 9 1 1 A 16 16 ALA N N 16 126.935 127.428 -0.493 1 1 33 . 9 1 1 A 17 17 ASP H H 17 8.269 7.757 0.512 1 1 34 . 9 1 1 A 17 17 ASP HA H 17 4.581 4.950 -0.369 1 1 37 . 9 1 1 A 17 17 ASP CA C 17 51.643 52.798 -1.155 1 1 38 . 9 1 1 A 17 17 ASP CB C 17 38.257 40.566 -2.309 1 1 39 . 9 1 1 A 17 17 ASP N N 17 120.379 115.807 4.572 1 1 40 . 9 1 1 A 18 18 ILE H H 18 7.979 8.450 -0.471 1 1 41 . 9 1 1 A 18 18 ILE HA H 18 4.178 3.659 0.519 1 1 48 . 9 1 1 A 18 18 ILE CA C 18 58.737 65.140 -6.403 1 1 49 . 9 1 1 A 18 18 ILE CB C 18 36.077 37.865 -1.788 1 1 53 . 9 1 1 A 18 18 ILE N N 18 121.171 123.298 -2.127 1 1 54 . 9 1 1 A 19 19 GLY H H 19 8.410 8.371 0.039 1 1 55 . 9 1 1 A 19 19 GLY HA2 H 19 4.023 3.804 0.219 1 1 56 . 9 1 1 A 19 19 GLY HA3 H 19 4.023 3.806 0.217 1 1 57 . 9 1 1 A 19 19 GLY N N 19 112.246 108.556 3.690 1 1 58 . 9 1 1 A 20 20 THR H H 20 8.005 8.263 -0.258 1 1 59 . 9 1 1 A 20 20 THR HA H 20 4.463 4.092 0.371 1 1 64 . 9 1 1 A 20 20 THR CB C 20 66.723 68.755 -2.032 1 1 66 . 9 1 1 A 20 20 THR N N 20 112.239 115.577 -3.338 1 1 67 . 9 1 1 A 21 21 GLY H H 21 8.500 8.435 0.065 1 1 68 . 9 1 1 A 21 21 GLY HA2 H 21 4.099 3.797 0.302 1 1 69 . 9 1 1 A 21 21 GLY HA3 H 21 3.872 3.800 0.072 1 1 70 . 9 1 1 A 21 21 GLY N N 21 111.048 112.738 -1.690 1 1 71 . 9 1 1 A 22 22 LEU H H 22 7.427 7.672 -0.245 1 1 72 . 9 1 1 A 22 22 LEU HA H 22 3.884 3.981 -0.097 1 1 84 . 9 1 1 A 22 22 LEU N N 22 118.837 120.221 -1.384 1 1 85 . 9 1 1 A 23 23 ALA H H 23 7.896 7.861 0.035 1 1 86 . 9 1 1 A 23 23 ALA HA H 23 4.023 4.121 -0.098 1 1 90 . 9 1 1 A 23 23 ALA CA C 23 52.584 54.142 -1.558 1 1 91 . 9 1 1 A 23 23 ALA CB C 23 15.470 18.400 -2.930 1 1 92 . 9 1 1 A 23 23 ALA N N 23 119.194 121.655 -2.461 1 1 93 . 9 1 1 A 24 24 ASP H H 24 8.265 7.760 0.505 1 1 94 . 9 1 1 A 24 24 ASP HA H 24 4.337 4.594 -0.257 1 1 97 . 9 1 1 A 24 24 ASP CB C 24 37.029 41.447 -4.418 1 1 98 . 9 1 1 A 24 24 ASP N N 24 119.035 116.962 2.073 1 1 99 . 9 1 1 A 25 25 ALA H H 25 8.211 8.593 -0.382 1 1 100 . 9 1 1 A 25 25 ALA HA H 25 4.064 4.061 0.003 1 1 104 . 9 1 1 A 25 25 ALA CA C 25 53.278 54.754 -1.476 1 1 105 . 9 1 1 A 25 25 ALA CB C 25 15.760 18.608 -2.848 1 1 106 . 9 1 1 A 25 25 ALA N N 25 122.434 121.536 0.898 1 1 107 . 9 1 1 A 26 26 LEU H H 26 7.334 7.578 -0.244 1 1 108 . 9 1 1 A 26 26 LEU HA H 26 4.351 4.214 0.137 1 1 117 . 9 1 1 A 26 26 LEU N N 26 114.238 119.685 -5.447 1 1 118 . 9 1 1 A 27 27 THR H H 27 7.708 7.903 -0.195 1 1 119 . 9 1 1 A 27 27 THR HA H 27 4.492 4.254 0.238 1 1 124 . 9 1 1 A 27 27 THR CA C 27 59.438 64.444 -5.006 1 1 125 . 9 1 1 A 27 27 THR CB C 27 68.796 68.391 0.405 1 1 127 . 9 1 1 A 27 27 THR N N 27 106.430 111.918 -5.488 1 1 128 . 9 1 1 A 28 28 ALA H H 28 8.906 7.765 1.141 1 1 129 . 9 1 1 A 28 28 ALA HA H 28 4.812 4.693 0.119 1 1 133 . 9 1 1 A 28 28 ALA CB C 28 16.724 20.097 -3.373 1 1 134 . 9 1 1 A 28 28 ALA N N 28 128.420 123.666 4.754 1 1 135 . 9 1 1 A 29 29 PRO CA C 29 59.166 62.235 -3.069 1 1 136 . 9 1 1 A 29 29 PRO CB C 29 29.865 32.850 -2.985 1 1 139 . 9 1 1 A 30 30 LEU H H 30 8.204 8.292 -0.088 1 1 140 . 9 1 1 A 30 30 LEU HA H 30 4.052 4.175 -0.123 1 1 150 . 9 1 1 A 30 30 LEU N N 30 121.970 123.113 -1.143 1 1 151 . 9 1 1 A 31 31 ASP H H 31 8.720 8.842 -0.122 1 1 152 . 9 1 1 A 31 31 ASP HA H 31 4.772 4.949 -0.177 1 1 155 . 9 1 1 A 31 31 ASP CA C 31 50.115 54.150 -4.035 1 1 156 . 9 1 1 A 31 31 ASP N N 31 125.105 125.698 -0.593 1 1 157 . 9 1 1 A 32 32 HIS CA C 32 55.083 58.208 -3.125 1 1 158 . 9 1 1 A 32 32 HIS CB C 32 25.707 30.364 -4.657 1 1 159 . 9 1 1 A 33 33 LYS H H 33 8.589 8.629 -0.040 1 1 160 . 9 1 1 A 33 33 LYS HA H 33 4.112 4.051 0.061 1 1 167 . 9 1 1 A 33 33 LYS CB C 33 29.218 31.549 -2.331 1 1 169 . 9 1 1 A 33 33 LYS N N 33 118.920 116.296 2.624 1 1 170 . 9 1 1 A 34 34 ASP H H 34 7.420 7.456 -0.036 1 1 171 . 9 1 1 A 34 34 ASP HA H 34 4.368 4.965 -0.597 1 1 174 . 9 1 1 A 34 34 ASP N N 34 120.940 119.452 1.488 1 1 175 . 9 1 1 A 35 35 LYS H H 35 8.266 8.519 -0.253 1 1 176 . 9 1 1 A 35 35 LYS HA H 35 4.169 4.468 -0.299 1 1 183 . 9 1 1 A 35 35 LYS N N 35 121.280 119.089 2.191 1 1 184 . 9 1 1 A 36 36 GLY H H 36 8.716 7.999 0.717 1 1 185 . 9 1 1 A 36 36 GLY HA2 H 36 3.822 3.829 -0.007 1 1 186 . 9 1 1 A 36 36 GLY HA3 H 36 3.618 3.834 -0.216 1 1 187 . 9 1 1 A 36 36 GLY N N 36 111.002 108.740 2.262 1 1 188 . 9 1 1 A 37 37 LEU H H 37 8.032 8.169 -0.137 1 1 189 . 9 1 1 A 37 37 LEU HA H 37 4.406 4.597 -0.191 1 1 198 . 9 1 1 A 37 37 LEU N N 37 127.683 123.943 3.740 1 1 199 . 9 1 1 A 38 38 LYS H H 38 9.190 8.936 0.254 1 1 200 . 9 1 1 A 38 38 LYS HA H 38 3.925 4.063 -0.138 1 1 205 . 9 1 1 A 38 38 LYS N N 38 132.634 125.863 6.771 1 1 206 . 9 1 1 A 39 39 SER H H 39 7.161 7.671 -0.510 1 1 207 . 9 1 1 A 39 39 SER HA H 39 5.097 4.643 0.454 1 1 210 . 9 1 1 A 39 39 SER CA C 39 54.451 57.632 -3.181 1 1 211 . 9 1 1 A 39 39 SER N N 39 110.262 109.504 0.758 1 1 212 . 9 1 1 A 40 40 LEU H H 40 8.142 8.974 -0.832 1 1 213 . 9 1 1 A 40 40 LEU HA H 40 4.481 4.904 -0.423 1 1 223 . 9 1 1 A 40 40 LEU N N 40 122.761 121.858 0.903 1 1 224 . 9 1 1 A 41 41 THR H H 41 8.641 8.662 -0.021 1 1 225 . 9 1 1 A 41 41 THR HA H 41 4.141 5.165 -1.024 1 1 230 . 9 1 1 A 41 41 THR CA C 41 60.301 62.415 -2.114 1 1 231 . 9 1 1 A 41 41 THR CB C 41 65.862 69.663 -3.801 1 1 233 . 9 1 1 A 41 41 THR N N 41 124.142 121.855 2.287 1 1 234 . 9 1 1 A 42 42 LEU H H 42 8.586 8.632 -0.046 1 1 235 . 9 1 1 A 42 42 LEU HA H 42 4.337 4.803 -0.466 1 1 247 . 9 1 1 A 42 42 LEU N N 42 128.603 125.349 3.254 1 1 248 . 9 1 1 A 43 43 GLU H H 43 8.644 8.611 0.033 1 1 249 . 9 1 1 A 43 43 GLU HA H 43 4.663 4.350 0.313 1 1 253 . 9 1 1 A 43 43 GLU N N 43 124.180 123.123 1.057 1 1 254 . 9 1 1 A 44 44 ASP H H 44 10.243 8.896 1.347 1 1 255 . 9 1 1 A 44 44 ASP HA H 44 4.518 4.478 0.040 1 1 258 . 9 1 1 A 44 44 ASP CA C 44 52.879 54.340 -1.461 1 1 259 . 9 1 1 A 44 44 ASP CB C 44 37.711 39.755 -2.044 1 1 260 . 9 1 1 A 44 44 ASP N N 44 124.177 119.324 4.853 1 1 261 . 9 1 1 A 45 45 SER H H 45 8.546 10.066 -1.520 1 1 262 . 9 1 1 A 45 45 SER HA H 45 3.850 4.149 -0.299 1 1 265 . 9 1 1 A 45 45 SER CA C 45 59.588 61.782 -2.194 1 1 266 . 9 1 1 A 45 45 SER CB C 45 61.660 62.526 -0.866 1 1 267 . 9 1 1 A 45 45 SER N N 45 116.191 114.956 1.235 1 1 268 . 9 1 1 A 46 46 ILE H H 46 6.902 7.675 -0.773 1 1 269 . 9 1 1 A 46 46 ILE HA H 46 3.874 4.693 -0.819 1 1 279 . 9 1 1 A 46 46 ILE CA C 46 57.605 60.074 -2.469 1 1 280 . 9 1 1 A 46 46 ILE CB C 46 36.694 39.820 -3.126 1 1 283 . 9 1 1 A 46 46 ILE N N 46 116.189 119.982 -3.793 1 1 284 . 9 1 1 A 47 47 SER H H 47 7.804 8.550 -0.746 1 1 285 . 9 1 1 A 47 47 SER HA H 47 4.342 4.842 -0.500 1 1 288 . 9 1 1 A 47 47 SER CA C 47 55.995 57.442 -1.447 1 1 289 . 9 1 1 A 47 47 SER N N 47 118.738 118.253 0.485 1 1 290 . 9 1 1 A 48 48 GLN H H 48 8.522 8.833 -0.311 1 1 291 . 9 1 1 A 48 48 GLN HA H 48 3.939 3.990 -0.051 1 1 296 . 9 1 1 A 48 48 GLN CA C 48 55.111 58.283 -3.172 1 1 298 . 9 1 1 A 48 48 GLN N N 48 119.475 122.644 -3.169 1 1 299 . 9 1 1 A 49 49 ASN H H 49 8.437 8.228 0.209 1 1 300 . 9 1 1 A 49 49 ASN HA H 49 4.693 4.689 0.004 1 1 305 . 9 1 1 A 49 49 ASN CA C 49 50.839 52.159 -1.320 1 1 306 . 9 1 1 A 49 49 ASN CB C 49 35.767 37.868 -2.101 1 1 307 . 9 1 1 A 49 49 ASN N N 49 117.233 114.177 3.056 1 1 309 . 9 1 1 A 50 50 GLY H H 50 7.952 7.861 0.091 1 1 310 . 9 1 1 A 50 50 GLY HA2 H 50 4.518 4.200 0.318 1 1 311 . 9 1 1 A 50 50 GLY HA3 H 50 4.054 4.207 -0.153 1 1 312 . 9 1 1 A 50 50 GLY CA C 50 41.883 45.462 -3.579 1 1 313 . 9 1 1 A 50 50 GLY N N 50 108.751 107.009 1.742 1 1 314 . 9 1 1 A 51 51 THR H H 51 8.548 8.405 0.143 1 1 315 . 9 1 1 A 51 51 THR HA H 51 5.012 5.404 -0.392 1 1 320 . 9 1 1 A 51 51 THR CA C 51 57.026 60.174 -3.148 1 1 321 . 9 1 1 A 51 51 THR CB C 51 69.887 70.823 -0.936 1 1 323 . 9 1 1 A 51 51 THR N N 51 108.710 115.624 -6.914 1 1 324 . 9 1 1 A 52 52 LEU H H 52 9.110 9.127 -0.017 1 1 325 . 9 1 1 A 52 52 LEU HA H 52 5.183 5.141 0.042 1 1 333 . 9 1 1 A 52 52 LEU CA C 52 50.822 53.897 -3.075 1 1 335 . 9 1 1 A 52 52 LEU N N 52 124.606 121.696 2.910 1 1 336 . 9 1 1 A 53 53 THR H H 53 9.312 8.613 0.699 1 1 337 . 9 1 1 A 53 53 THR HA H 53 5.288 5.137 0.151 1 1 342 . 9 1 1 A 53 53 THR CA C 53 59.535 61.148 -1.613 1 1 343 . 9 1 1 A 53 53 THR CB C 53 66.838 72.006 -5.168 1 1 345 . 9 1 1 A 53 53 THR N N 53 125.445 115.650 9.795 1 1 346 . 9 1 1 A 54 54 LEU H H 54 8.992 9.568 -0.576 1 1 347 . 9 1 1 A 54 54 LEU HA H 54 5.563 5.425 0.138 1 1 357 . 9 1 1 A 54 54 LEU N N 54 128.814 125.108 3.706 1 1 358 . 9 1 1 A 55 55 SER H H 55 9.017 9.285 -0.268 1 1 359 . 9 1 1 A 55 55 SER HA H 55 5.476 5.232 0.244 1 1 362 . 9 1 1 A 55 55 SER CA C 55 53.944 56.915 -2.971 1 1 363 . 9 1 1 A 55 55 SER CB C 55 63.384 64.957 -1.573 1 1 364 . 9 1 1 A 55 55 SER N N 55 112.964 118.702 -5.738 1 1 365 . 9 1 1 A 56 56 ALA H H 56 8.324 9.580 -1.256 1 1 366 . 9 1 1 A 56 56 ALA HA H 56 4.605 4.761 -0.156 1 1 370 . 9 1 1 A 56 56 ALA CA C 56 50.743 49.998 0.745 1 1 371 . 9 1 1 A 56 56 ALA CB C 56 21.372 21.404 -0.032 1 1 372 . 9 1 1 A 56 56 ALA N N 56 123.555 129.512 -5.957 1 1 373 . 9 1 1 A 57 57 GLN H H 57 9.080 8.605 0.475 1 1 374 . 9 1 1 A 57 57 GLN HA H 57 3.884 4.480 -0.596 1 1 381 . 9 1 1 A 57 57 GLN CA C 57 53.331 55.990 -2.659 1 1 382 . 9 1 1 A 57 57 GLN CB C 57 24.659 27.611 -2.952 1 1 384 . 9 1 1 A 57 57 GLN N N 57 116.815 115.467 1.348 1 1 386 . 9 1 1 A 58 58 GLY H H 58 8.527 7.968 0.559 1 1 387 . 9 1 1 A 58 58 GLY HA2 H 58 4.168 4.060 0.108 1 1 388 . 9 1 1 A 58 58 GLY HA3 H 58 3.608 4.064 -0.456 1 1 389 . 9 1 1 A 58 58 GLY CA C 58 42.856 45.695 -2.839 1 1 390 . 9 1 1 A 58 58 GLY N N 58 105.983 107.613 -1.630 1 1 391 . 9 1 1 A 59 59 ALA H H 59 8.203 7.703 0.500 1 1 392 . 9 1 1 A 59 59 ALA HA H 59 4.811 4.552 0.259 1 1 396 . 9 1 1 A 59 59 ALA CA C 59 47.662 51.436 -3.774 1 1 397 . 9 1 1 A 59 59 ALA CB C 59 20.147 22.780 -2.633 1 1 398 . 9 1 1 A 59 59 ALA N N 59 125.153 121.346 3.807 1 1 399 . 9 1 1 A 60 60 GLU H H 60 8.154 8.858 -0.704 1 1 400 . 9 1 1 A 60 60 GLU HA H 60 5.508 5.825 -0.317 1 1 404 . 9 1 1 A 60 60 GLU CA C 60 52.179 54.043 -1.864 1 1 405 . 9 1 1 A 60 60 GLU CB C 60 30.203 34.441 -4.238 1 1 406 . 9 1 1 A 60 60 GLU N N 60 117.318 116.966 0.352 1 1 407 . 9 1 1 A 61 61 LYS H H 61 8.821 9.257 -0.436 1 1 408 . 9 1 1 A 61 61 LYS HA H 61 4.311 4.888 -0.577 1 1 413 . 9 1 1 A 61 61 LYS N N 61 123.743 118.795 4.948 1 1 414 . 9 1 1 A 62 62 THR H H 62 8.149 8.703 -0.554 1 1 415 . 9 1 1 A 62 62 THR HA H 62 4.928 4.707 0.221 1 1 420 . 9 1 1 A 62 62 THR CA C 62 59.427 62.876 -3.449 1 1 421 . 9 1 1 A 62 62 THR CB C 62 66.932 69.100 -2.168 1 1 422 . 9 1 1 A 62 62 THR N N 62 122.829 119.582 3.247 1 1 423 . 9 1 1 A 63 63 TYR H H 63 9.466 9.827 -0.361 1 1 424 . 9 1 1 A 63 63 TYR HA H 63 4.606 5.300 -0.694 1 1 431 . 9 1 1 A 63 63 TYR CA C 63 54.508 55.716 -1.208 1 1 432 . 9 1 1 A 63 63 TYR N N 63 127.472 128.428 -0.956 1 1 433 . 9 1 1 A 64 64 GLY H H 64 9.253 8.737 0.516 1 1 434 . 9 1 1 A 64 64 GLY HA2 H 64 4.670 4.208 0.462 1 1 435 . 9 1 1 A 64 64 GLY HA3 H 64 3.619 4.229 -0.610 1 1 436 . 9 1 1 A 64 64 GLY CA C 64 39.885 44.869 -4.984 1 1 437 . 9 1 1 A 64 64 GLY N N 64 110.182 111.541 -1.359 1 1 438 . 9 1 1 A 65 65 ASN H H 65 8.616 8.518 0.098 1 1 439 . 9 1 1 A 65 65 ASN HA H 65 4.109 4.419 -0.310 1 1 444 . 9 1 1 A 65 65 ASN CA C 65 53.691 54.892 -1.201 1 1 445 . 9 1 1 A 65 65 ASN N N 65 117.778 119.084 -1.306 1 1 447 . 9 1 1 A 66 66 GLY H H 66 9.053 8.982 0.071 1 1 448 . 9 1 1 A 66 66 GLY HA2 H 66 4.344 3.889 0.455 1 1 449 . 9 1 1 A 66 66 GLY HA3 H 66 3.359 3.899 -0.540 1 1 450 . 9 1 1 A 66 66 GLY CA C 66 42.431 44.964 -2.533 1 1 451 . 9 1 1 A 66 66 GLY N N 66 115.232 114.301 0.931 1 1 452 . 9 1 1 A 67 67 ASP H H 67 8.120 8.708 -0.588 1 1 453 . 9 1 1 A 67 67 ASP HA H 67 4.844 4.259 0.585 1 1 456 . 9 1 1 A 67 67 ASP N N 67 122.593 121.407 1.186 1 1 457 . 9 1 1 A 68 68 SER H H 68 8.500 7.982 0.518 1 1 458 . 9 1 1 A 68 68 SER HA H 68 5.088 5.202 -0.114 1 1 461 . 9 1 1 A 68 68 SER CA C 68 54.858 56.172 -1.314 1 1 462 . 9 1 1 A 68 68 SER CB C 68 62.114 66.815 -4.701 1 1 463 . 9 1 1 A 68 68 SER N N 68 113.557 116.687 -3.130 1 1 464 . 9 1 1 A 69 69 LEU H H 69 8.989 9.155 -0.166 1 1 465 . 9 1 1 A 69 69 LEU HA H 69 4.570 5.096 -0.526 1 1 474 . 9 1 1 A 69 69 LEU N N 69 126.836 123.218 3.618 1 1 475 . 9 1 1 A 70 70 ASN H H 70 8.491 9.042 -0.551 1 1 476 . 9 1 1 A 70 70 ASN HA H 70 4.958 5.327 -0.369 1 1 479 . 9 1 1 A 70 70 ASN CB C 70 33.265 40.059 -6.794 1 1 480 . 9 1 1 A 70 70 ASN N N 70 126.343 123.548 2.795 1 1 481 . 9 1 1 A 71 71 THR H H 71 7.831 8.336 -0.505 1 1 482 . 9 1 1 A 71 71 THR HA H 71 3.759 4.644 -0.885 1 1 487 . 9 1 1 A 71 71 THR CA C 71 61.005 60.599 0.406 1 1 488 . 9 1 1 A 71 71 THR N N 71 114.742 113.937 0.805 1 1 489 . 9 1 1 A 72 72 GLY H H 72 8.880 7.987 0.893 1 1 490 . 9 1 1 A 72 72 GLY HA2 H 72 3.907 3.920 -0.013 1 1 491 . 9 1 1 A 72 72 GLY HA3 H 72 3.907 3.923 -0.016 1 1 492 . 9 1 1 A 72 72 GLY N N 72 114.976 110.597 4.379 1 1 493 . 9 1 1 A 73 73 LYS H H 73 6.604 7.624 -1.020 1 1 494 . 9 1 1 A 73 73 LYS HA H 73 4.160 4.282 -0.122 1 1 501 . 9 1 1 A 73 73 LYS N N 73 113.898 118.764 -4.866 1 1 502 . 9 1 1 A 74 74 LEU H H 74 7.422 7.511 -0.089 1 1 503 . 9 1 1 A 74 74 LEU HA H 74 4.358 4.853 -0.495 1 1 513 . 9 1 1 A 74 74 LEU N N 74 117.180 116.025 1.155 1 1 514 . 9 1 1 A 75 75 LYS H H 75 8.617 8.451 0.166 1 1 515 . 9 1 1 A 75 75 LYS HA H 75 4.079 4.571 -0.492 1 1 518 . 9 1 1 A 75 75 LYS N N 75 121.119 121.898 -0.779 1 1 519 . 9 1 1 A 76 76 ASN H H 76 8.154 8.264 -0.110 1 1 520 . 9 1 1 A 76 76 ASN HA H 76 3.935 5.044 -1.109 1 1 525 . 9 1 1 A 76 76 ASN CB C 76 35.772 39.751 -3.979 1 1 526 . 9 1 1 A 76 76 ASN N N 76 122.761 118.509 4.252 1 1 527 . 9 1 1 A 77 77 ASP H H 77 9.227 8.206 1.021 1 1 528 . 9 1 1 A 77 77 ASP HA H 77 3.787 5.833 -2.046 1 1 531 . 9 1 1 A 77 77 ASP CA C 77 52.584 53.295 -0.711 1 1 532 . 9 1 1 A 77 77 ASP N N 77 114.129 119.316 -5.187 1 1 533 . 9 1 1 A 78 78 LYS H H 78 6.579 7.511 -0.932 1 1 534 . 9 1 1 A 78 78 LYS HA H 78 4.572 4.598 -0.026 1 1 539 . 9 1 1 A 78 78 LYS CA C 78 51.072 54.081 -3.009 1 1 540 . 9 1 1 A 78 78 LYS CB C 78 33.783 33.985 -0.202 1 1 541 . 9 1 1 A 78 78 LYS N N 78 114.135 119.457 -5.322 1 1 542 . 9 1 1 A 79 79 VAL H H 79 8.729 7.985 0.744 1 1 543 . 9 1 1 A 79 79 VAL HA H 79 4.402 4.295 0.107 1 1 551 . 9 1 1 A 79 79 VAL CA C 79 59.240 60.557 -1.317 1 1 553 . 9 1 1 A 79 79 VAL N N 79 123.191 120.195 2.996 1 1 554 . 9 1 1 A 80 80 SER H H 80 9.542 8.777 0.765 1 1 555 . 9 1 1 A 80 80 SER HA H 80 4.636 5.138 -0.502 1 1 558 . 9 1 1 A 80 80 SER CA C 80 55.978 57.658 -1.680 1 1 559 . 9 1 1 A 80 80 SER N N 80 127.445 122.272 5.173 1 1 560 . 9 1 1 A 81 81 ARG H H 81 8.093 8.948 -0.855 1 1 561 . 9 1 1 A 81 81 ARG HA H 81 5.210 5.854 -0.644 1 1 569 . 9 1 1 A 81 81 ARG N N 81 123.743 125.157 -1.414 1 1 571 . 9 1 1 A 82 82 PHE H H 82 9.312 8.363 0.949 1 1 572 . 9 1 1 A 82 82 PHE HA H 82 4.951 5.162 -0.211 1 1 577 . 9 1 1 A 82 82 PHE CA C 82 53.090 55.959 -2.869 1 1 578 . 9 1 1 A 82 82 PHE N N 82 119.529 117.411 2.118 1 1 579 . 9 1 1 A 83 83 ASP H H 83 9.122 9.176 -0.054 1 1 580 . 9 1 1 A 83 83 ASP HA H 83 5.593 5.110 0.483 1 1 583 . 9 1 1 A 83 83 ASP N N 83 123.825 120.127 3.698 1 1 584 . 9 1 1 A 84 84 PHE H H 84 9.090 8.131 0.959 1 1 585 . 9 1 1 A 84 84 PHE HA H 84 6.410 5.465 0.945 1 1 592 . 9 1 1 A 84 84 PHE CA C 84 52.584 56.582 -3.998 1 1 593 . 9 1 1 A 84 84 PHE N N 84 118.862 117.414 1.448 1 1 594 . 9 1 1 A 85 85 ILE H H 85 8.441 9.131 -0.690 1 1 595 . 9 1 1 A 85 85 ILE HA H 85 4.662 4.734 -0.072 1 1 605 . 9 1 1 A 85 85 ILE CB C 85 39.939 40.402 -0.463 1 1 608 . 9 1 1 A 85 85 ILE N N 85 118.049 121.650 -3.601 1 1 609 . 9 1 1 A 86 86 ARG H H 86 8.983 8.761 0.222 1 1 610 . 9 1 1 A 86 86 ARG HA H 86 5.591 4.799 0.792 1 1 616 . 9 1 1 A 86 86 ARG N N 86 127.006 128.012 -1.006 1 1 618 . 9 1 1 A 87 87 GLN H H 87 8.643 9.578 -0.935 1 1 619 . 9 1 1 A 87 87 GLN HA H 87 5.630 5.146 0.484 1 1 626 . 9 1 1 A 87 87 GLN CA C 87 51.512 54.324 -2.812 1 1 627 . 9 1 1 A 87 87 GLN N N 87 124.142 122.797 1.345 1 1 629 . 9 1 1 A 88 88 ILE H H 88 8.617 8.797 -0.180 1 1 630 . 9 1 1 A 88 88 ILE HA H 88 4.690 4.911 -0.221 1 1 637 . 9 1 1 A 88 88 ILE CA C 88 56.995 60.707 -3.712 1 1 638 . 9 1 1 A 88 88 ILE CB C 88 39.927 40.293 -0.366 1 1 641 . 9 1 1 A 88 88 ILE N N 88 116.353 123.547 -7.194 1 1 642 . 9 1 1 A 89 89 GLU H H 89 8.298 9.020 -0.722 1 1 643 . 9 1 1 A 89 89 GLU HA H 89 5.100 5.808 -0.708 1 1 646 . 9 1 1 A 89 89 GLU CA C 89 52.204 54.937 -2.733 1 1 647 . 9 1 1 A 89 89 GLU CB C 89 27.325 33.340 -6.015 1 1 648 . 9 1 1 A 89 89 GLU N N 89 124.458 129.199 -4.741 1 1 649 . 9 1 1 A 90 90 VAL H H 90 8.957 8.883 0.074 1 1 650 . 9 1 1 A 90 90 VAL HA H 90 4.169 4.592 -0.423 1 1 658 . 9 1 1 A 90 90 VAL CA C 90 58.664 60.268 -1.604 1 1 659 . 9 1 1 A 90 90 VAL CB C 90 31.861 32.959 -1.098 1 1 660 . 9 1 1 A 90 90 VAL N N 90 127.580 127.003 0.577 1 1 661 . 9 1 1 A 91 91 ASP H H 91 9.369 8.624 0.745 1 1 662 . 9 1 1 A 91 91 ASP HA H 91 4.287 4.581 -0.294 1 1 665 . 9 1 1 A 91 91 ASP CA C 91 52.389 54.776 -2.387 1 1 666 . 9 1 1 A 91 91 ASP CB C 91 36.409 40.382 -3.973 1 1 667 . 9 1 1 A 91 91 ASP N N 91 129.411 123.742 5.669 1 1 668 . 9 1 1 A 92 92 GLY H H 92 8.552 7.468 1.084 1 1 669 . 9 1 1 A 92 92 GLY HA2 H 92 4.090 4.091 -0.001 1 1 670 . 9 1 1 A 92 92 GLY HA3 H 92 3.618 4.091 -0.473 1 1 671 . 9 1 1 A 92 92 GLY CA C 92 42.836 45.590 -2.754 1 1 672 . 9 1 1 A 92 92 GLY N N 92 103.862 105.519 -1.657 1 1 673 . 9 1 1 A 93 93 GLN H H 93 7.808 7.611 0.197 1 1 674 . 9 1 1 A 93 93 GLN HA H 93 4.578 4.834 -0.256 1 1 679 . 9 1 1 A 93 93 GLN CA C 93 50.918 54.304 -3.386 1 1 680 . 9 1 1 A 93 93 GLN CB C 93 28.602 31.178 -2.576 1 1 682 . 9 1 1 A 93 93 GLN N N 93 120.412 118.747 1.665 1 1 683 . 9 1 1 A 94 94 LEU H H 94 8.414 8.477 -0.063 1 1 684 . 9 1 1 A 94 94 LEU HA H 94 4.704 4.249 0.455 1 1 693 . 9 1 1 A 94 94 LEU CB C 94 39.873 42.553 -2.680 1 1 696 . 9 1 1 A 94 94 LEU N N 94 125.061 122.674 2.387 1 1 697 . 9 1 1 A 95 95 ILE H H 95 9.181 8.627 0.554 1 1 698 . 9 1 1 A 95 95 ILE HA H 95 4.371 4.946 -0.575 1 1 708 . 9 1 1 A 95 95 ILE CA C 95 63.319 60.773 2.546 1 1 709 . 9 1 1 A 95 95 ILE CB C 95 37.407 39.648 -2.241 1 1 711 . 9 1 1 A 95 95 ILE N N 95 127.724 121.693 6.031 1 1 712 . 9 1 1 A 96 96 THR H H 96 8.730 7.385 1.345 1 1 713 . 9 1 1 A 96 96 THR HA H 96 4.411 4.406 0.005 1 1 718 . 9 1 1 A 96 96 THR CA C 96 60.344 63.012 -2.668 1 1 719 . 9 1 1 A 96 96 THR CB C 96 59.719 69.781 -10.062 1 1 720 . 9 1 1 A 96 96 THR N N 96 124.240 118.611 5.629 1 1 721 . 9 1 1 A 97 97 LEU H H 97 8.790 8.815 -0.025 1 1 722 . 9 1 1 A 97 97 LEU HA H 97 4.400 4.992 -0.592 1 1 732 . 9 1 1 A 97 97 LEU N N 97 126.147 124.692 1.455 1 1 733 . 9 1 1 A 98 98 GLU H H 98 7.596 9.033 -1.437 1 1 734 . 9 1 1 A 98 98 GLU HA H 98 5.102 5.170 -0.068 1 1 739 . 9 1 1 A 98 98 GLU N N 98 116.937 127.425 -10.488 1 1 740 . 9 1 1 A 99 99 SER H H 99 8.906 8.478 0.428 1 1 741 . 9 1 1 A 99 99 SER HA H 99 4.504 5.289 -0.785 1 1 744 . 9 1 1 A 99 99 SER CA C 99 54.010 56.209 -2.199 1 1 745 . 9 1 1 A 99 99 SER CB C 99 63.876 65.835 -1.959 1 1 746 . 9 1 1 A 99 99 SER N N 99 117.823 116.218 1.605 1 1 747 . 9 1 1 A 100 100 GLY H H 100 7.250 7.834 -0.584 1 1 748 . 9 1 1 A 100 100 GLY HA2 H 100 4.872 3.860 1.012 1 1 749 . 9 1 1 A 100 100 GLY HA3 H 100 3.731 3.975 -0.244 1 1 750 . 9 1 1 A 100 100 GLY N N 100 109.436 107.163 2.273 1 1 751 . 9 1 1 A 101 101 GLU H H 101 9.661 8.197 1.464 1 1 752 . 9 1 1 A 101 101 GLU HA H 101 5.643 4.485 1.158 1 1 757 . 9 1 1 A 101 101 GLU CA C 101 52.584 55.237 -2.653 1 1 758 . 9 1 1 A 101 101 GLU CB C 101 31.750 31.840 -0.090 1 1 759 . 9 1 1 A 101 101 GLU N N 101 126.793 120.099 6.694 1 1 760 . 9 1 1 A 102 102 PHE H H 102 10.441 8.355 2.086 1 1 761 . 9 1 1 A 102 102 PHE HA H 102 5.248 5.177 0.071 1 1 768 . 9 1 1 A 102 102 PHE CA C 102 53.537 56.017 -2.480 1 1 769 . 9 1 1 A 102 102 PHE N N 102 131.837 123.057 8.780 1 1 770 . 9 1 1 A 103 103 GLN H H 103 9.135 9.844 -0.709 1 1 771 . 9 1 1 A 103 103 GLN HA H 103 5.205 5.027 0.178 1 1 776 . 9 1 1 A 103 103 GLN CA C 103 50.925 54.625 -3.700 1 1 777 . 9 1 1 A 103 103 GLN N N 103 127.720 125.836 1.884 1 1 778 . 9 1 1 A 104 104 VAL H H 104 8.937 9.789 -0.852 1 1 779 . 9 1 1 A 104 104 VAL HA H 104 4.780 5.111 -0.331 1 1 787 . 9 1 1 A 104 104 VAL CA C 104 57.086 61.525 -4.439 1 1 789 . 9 1 1 A 104 104 VAL N N 104 120.097 124.728 -4.631 1 1 790 . 9 1 1 A 105 105 TYR H H 105 9.108 9.702 -0.594 1 1 791 . 9 1 1 A 105 105 TYR HA H 105 4.834 5.177 -0.343 1 1 798 . 9 1 1 A 105 105 TYR CA C 105 54.486 57.666 -3.180 1 1 799 . 9 1 1 A 105 105 TYR N N 105 128.426 129.504 -1.078 1 1 800 . 9 1 1 A 106 106 LYS H H 106 5.945 9.123 -3.178 1 1 805 . 9 1 1 A 106 106 LYS N N 106 129.163 125.937 3.226 1 1 806 . 9 1 1 A 107 107 GLN H H 107 8.526 8.125 0.401 1 1 807 . 9 1 1 A 107 107 GLN HA H 107 5.160 5.488 -0.328 1 1 812 . 9 1 1 A 107 107 GLN CA C 107 52.584 53.798 -1.214 1 1 813 . 9 1 1 A 107 107 GLN CB C 107 26.175 29.294 -3.119 1 1 814 . 9 1 1 A 107 107 GLN N N 107 125.978 124.366 1.612 1 1 815 . 9 1 1 A 108 108 SER H H 108 8.621 9.865 -1.244 1 1 816 . 9 1 1 A 108 108 SER HA H 108 4.403 4.193 0.210 1 1 819 . 9 1 1 A 108 108 SER CA C 108 58.521 61.428 -2.907 1 1 820 . 9 1 1 A 108 108 SER CB C 108 60.737 63.306 -2.569 1 1 821 . 9 1 1 A 108 108 SER N N 108 117.542 113.585 3.957 1 1 822 . 9 1 1 A 109 109 HIS H H 109 10.381 7.740 2.641 1 1 823 . 9 1 1 A 109 109 HIS HA H 109 4.594 4.667 -0.073 1 1 828 . 9 1 1 A 109 109 HIS CA C 109 51.743 57.199 -5.456 1 1 829 . 9 1 1 A 109 109 HIS CB C 109 27.174 31.248 -4.074 1 1 830 . 9 1 1 A 109 109 HIS N N 109 118.449 116.436 2.013 1 1 831 . 9 1 1 A 110 110 SER H H 110 7.366 7.812 -0.446 1 1 832 . 9 1 1 A 110 110 SER HA H 110 4.870 4.831 0.039 1 1 835 . 9 1 1 A 110 110 SER CB C 110 62.986 65.442 -2.456 1 1 836 . 9 1 1 A 110 110 SER N N 110 113.397 114.284 -0.887 1 1 837 . 9 1 1 A 111 111 ALA H H 111 8.541 8.821 -0.280 1 1 838 . 9 1 1 A 111 111 ALA HA H 111 4.826 4.831 -0.005 1 1 842 . 9 1 1 A 111 111 ALA CA C 111 49.015 51.490 -2.475 1 1 843 . 9 1 1 A 111 111 ALA CB C 111 20.256 22.747 -2.491 1 1 844 . 9 1 1 A 111 111 ALA N N 111 117.786 122.609 -4.823 1 1 845 . 9 1 1 A 112 112 LEU H H 112 8.529 8.994 -0.465 1 1 846 . 9 1 1 A 112 112 LEU HA H 112 5.680 4.906 0.774 1 1 855 . 9 1 1 A 112 112 LEU CA C 112 51.818 53.627 -1.809 1 1 856 . 9 1 1 A 112 112 LEU N N 112 116.345 119.187 -2.842 1 1 857 . 9 1 1 A 113 113 THR H H 113 8.758 8.821 -0.063 1 1 858 . 9 1 1 A 113 113 THR HA H 113 5.563 5.304 0.259 1 1 863 . 9 1 1 A 113 113 THR CA C 113 54.458 60.955 -6.497 1 1 864 . 9 1 1 A 113 113 THR CB C 113 68.586 73.167 -4.581 1 1 866 . 9 1 1 A 113 113 THR N N 113 110.469 118.100 -7.631 1 1 867 . 9 1 1 A 114 114 ALA H H 114 8.829 8.650 0.179 1 1 868 . 9 1 1 A 114 114 ALA HA H 114 4.466 5.042 -0.576 1 1 872 . 9 1 1 A 114 114 ALA CA C 114 48.886 51.967 -3.081 1 1 873 . 9 1 1 A 114 114 ALA CB C 114 21.583 21.642 -0.059 1 1 874 . 9 1 1 A 114 114 ALA N N 114 121.456 123.920 -2.464 1 1 875 . 9 1 1 A 115 115 LEU H H 115 8.407 8.628 -0.221 1 1 876 . 9 1 1 A 115 115 LEU HA H 115 4.814 4.751 0.063 1 1 886 . 9 1 1 A 115 115 LEU N N 115 119.223 120.357 -1.134 1 1 887 . 9 1 1 A 116 116 GLN H H 116 9.720 9.395 0.325 1 1 888 . 9 1 1 A 116 116 GLN HA H 116 5.312 5.339 -0.027 1 1 893 . 9 1 1 A 116 116 GLN CA C 116 50.544 54.100 -3.556 1 1 894 . 9 1 1 A 116 116 GLN N N 116 127.827 120.176 7.651 1 1 895 . 9 1 1 A 117 117 THR H H 117 9.663 8.808 0.855 1 1 896 . 9 1 1 A 117 117 THR HA H 117 4.198 5.159 -0.961 1 1 901 . 9 1 1 A 117 117 THR CA C 117 64.037 60.810 3.227 1 1 902 . 9 1 1 A 117 117 THR CB C 117 66.868 72.930 -6.062 1 1 904 . 9 1 1 A 117 117 THR N N 117 128.929 118.688 10.241 1 1 905 . 9 1 1 A 118 118 GLU H H 118 9.486 9.083 0.403 1 1 906 . 9 1 1 A 118 118 GLU HA H 118 4.885 4.577 0.308 1 1 911 . 9 1 1 A 118 118 GLU N N 118 123.497 121.696 1.801 1 1 912 . 9 1 1 A 119 119 GLN H H 119 8.076 7.948 0.128 1 1 913 . 9 1 1 A 119 119 GLN HA H 119 5.331 4.712 0.619 1 1 916 . 9 1 1 A 119 119 GLN CA C 119 51.858 54.618 -2.760 1 1 917 . 9 1 1 A 119 119 GLN N N 119 118.023 116.668 1.355 1 1 918 . 9 1 1 A 120 120 GLU H H 120 9.078 9.208 -0.130 1 1 919 . 9 1 1 A 120 120 GLU HA H 120 5.071 4.792 0.279 1 1 924 . 9 1 1 A 120 120 GLU N N 120 118.433 121.252 -2.819 1 1 925 . 9 1 1 A 121 121 GLN H H 121 7.711 8.640 -0.929 1 1 926 . 9 1 1 A 121 121 GLN HA H 121 4.430 5.354 -0.924 1 1 933 . 9 1 1 A 121 121 GLN CA C 121 53.996 54.550 -0.554 1 1 934 . 9 1 1 A 121 121 GLN CB C 121 27.158 32.532 -5.374 1 1 936 . 9 1 1 A 121 121 GLN N N 121 122.412 119.918 2.494 1 1 938 . 9 1 1 A 122 122 ASP H H 122 8.675 9.854 -1.179 1 1 939 . 9 1 1 A 122 122 ASP HA H 122 4.632 5.090 -0.458 1 1 942 . 9 1 1 A 122 122 ASP CA C 122 48.797 51.157 -2.360 1 1 943 . 9 1 1 A 122 122 ASP CB C 122 39.852 42.158 -2.306 1 1 944 . 9 1 1 A 122 122 ASP N N 122 128.625 124.147 4.478 1 1 945 . 9 1 1 A 123 123 PRO CA C 123 61.579 65.594 -4.015 1 1 946 . 9 1 1 A 123 123 PRO CB C 123 29.597 31.494 -1.897 1 1 948 . 9 1 1 A 124 124 GLU H H 124 8.297 8.750 -0.453 1 1 949 . 9 1 1 A 124 124 GLU HA H 124 4.196 3.773 0.423 1 1 954 . 9 1 1 A 124 124 GLU CA C 124 53.025 59.546 -6.521 1 1 955 . 9 1 1 A 124 124 GLU CB C 124 27.927 29.491 -1.564 1 1 957 . 9 1 1 A 124 124 GLU N N 124 115.538 117.610 -2.072 1 1 958 . 9 1 1 A 125 125 HIS H H 125 7.419 8.058 -0.639 1 1 959 . 9 1 1 A 125 125 HIS HA H 125 4.833 4.977 -0.144 1 1 964 . 9 1 1 A 125 125 HIS CA C 125 51.886 54.149 -2.263 1 1 965 . 9 1 1 A 125 125 HIS CB C 125 26.387 29.314 -2.927 1 1 966 . 9 1 1 A 125 125 HIS N N 125 117.464 116.885 0.579 1 1 967 . 9 1 1 A 126 126 SER H H 126 8.441 8.273 0.168 1 1 968 . 9 1 1 A 126 126 SER HA H 126 4.261 4.767 -0.506 1 1 971 . 9 1 1 A 126 126 SER CA C 126 57.988 61.563 -3.575 1 1 972 . 9 1 1 A 126 126 SER N N 126 117.954 120.552 -2.598 1 1 973 . 9 1 1 A 127 127 GLU H H 127 9.221 8.696 0.525 1 1 974 . 9 1 1 A 127 127 GLU HA H 127 4.366 4.225 0.141 1 1 979 . 9 1 1 A 127 127 GLU CA C 127 53.707 57.512 -3.805 1 1 980 . 9 1 1 A 127 127 GLU CB C 127 25.492 28.754 -3.262 1 1 981 . 9 1 1 A 127 127 GLU N N 127 120.404 117.030 3.374 1 1 982 . 9 1 1 A 128 128 LYS H H 128 8.262 9.334 -1.072 1 1 983 . 9 1 1 A 128 128 LYS HA H 128 4.661 4.404 0.257 1 1 990 . 9 1 1 A 128 128 LYS CA C 128 52.264 56.066 -3.802 1 1 991 . 9 1 1 A 128 128 LYS CB C 128 32.404 33.477 -1.073 1 1 994 . 9 1 1 A 128 128 LYS N N 128 122.166 120.838 1.328 1 1 995 . 9 1 1 A 129 129 MET H H 129 8.242 8.795 -0.553 1 1 996 . 9 1 1 A 129 129 MET HA H 129 5.012 6.159 -1.147 1 1 1001 . 9 1 1 A 129 129 MET CA C 129 50.958 53.449 -2.491 1 1 1003 . 9 1 1 A 129 129 MET N N 129 119.422 120.759 -1.337 1 1 1004 . 9 1 1 A 130 130 VAL H H 130 9.200 8.803 0.397 1 1 1005 . 9 1 1 A 130 130 VAL HA H 130 4.609 4.704 -0.095 1 1 1013 . 9 1 1 A 130 130 VAL CA C 130 56.296 60.601 -4.305 1 1 1014 . 9 1 1 A 130 130 VAL CB C 130 32.606 32.709 -0.103 1 1 1015 . 9 1 1 A 130 130 VAL N N 130 118.290 122.301 -4.011 1 1 1016 . 9 1 1 A 131 131 ALA H H 131 8.368 8.653 -0.285 1 1 1017 . 9 1 1 A 131 131 ALA HA H 131 4.654 5.224 -0.570 1 1 1021 . 9 1 1 A 131 131 ALA CA C 131 49.739 50.575 -0.836 1 1 1022 . 9 1 1 A 131 131 ALA CB C 131 15.351 21.261 -5.910 1 1 1023 . 9 1 1 A 131 131 ALA N N 131 126.734 125.080 1.654 1 1 1024 . 9 1 1 A 132 132 LYS H H 132 7.732 8.088 -0.356 1 1 1025 . 9 1 1 A 132 132 LYS HA H 132 4.171 4.889 -0.718 1 1 1028 . 9 1 1 A 132 132 LYS N N 132 127.309 122.404 4.905 1 1 1029 . 9 1 1 A 133 133 ARG H H 133 8.193 8.666 -0.473 1 1 1030 . 9 1 1 A 133 133 ARG HA H 133 5.073 4.703 0.370 1 1 1038 . 9 1 1 A 133 133 ARG N N 133 122.190 122.656 -0.466 1 1 1040 . 9 1 1 A 134 134 ARG H H 134 7.539 9.043 -1.504 1 1 1041 . 9 1 1 A 134 134 ARG HA H 134 4.667 4.961 -0.294 1 1 1049 . 9 1 1 A 134 134 ARG CA C 134 52.584 54.861 -2.277 1 1 1050 . 9 1 1 A 134 134 ARG CB C 134 31.325 31.996 -0.671 1 1 1052 . 9 1 1 A 134 134 ARG N N 134 121.632 125.713 -4.081 1 1 1054 . 9 1 1 A 135 135 PHE H H 135 8.816 8.898 -0.082 1 1 1055 . 9 1 1 A 135 135 PHE HA H 135 5.680 5.868 -0.188 1 1 1062 . 9 1 1 A 135 135 PHE N N 135 125.107 120.748 4.359 1 1 1063 . 9 1 1 A 136 136 ARG H H 136 7.741 9.743 -2.002 1 1 1064 . 9 1 1 A 136 136 ARG HA H 136 4.402 4.735 -0.333 1 1 1068 . 9 1 1 A 136 136 ARG N N 136 125.640 125.071 0.569 1 1 1070 . 9 1 1 A 137 137 ILE H H 137 8.556 8.675 -0.119 1 1 1071 . 9 1 1 A 137 137 ILE HA H 137 3.912 4.891 -0.979 1 1 1076 . 9 1 1 A 137 137 ILE CA C 137 55.676 59.782 -4.106 1 1 1079 . 9 1 1 A 137 137 ILE N N 137 122.891 122.040 0.851 1 1 1080 . 9 1 1 A 138 138 GLY H H 138 8.676 9.420 -0.744 1 1 1081 . 9 1 1 A 138 138 GLY HA2 H 138 3.740 4.083 -0.343 1 1 1082 . 9 1 1 A 138 138 GLY HA3 H 138 2.982 4.107 -1.125 1 1 1083 . 9 1 1 A 138 138 GLY CA C 138 41.908 46.027 -4.119 1 1 1084 . 9 1 1 A 138 138 GLY N N 138 117.058 116.393 0.665 1 1 1085 . 9 1 1 A 139 139 ASP H H 139 7.858 7.521 0.337 1 1 1086 . 9 1 1 A 139 139 ASP HA H 139 4.753 4.543 0.210 1 1 1089 . 9 1 1 A 139 139 ASP CA C 139 52.584 55.019 -2.435 1 1 1090 . 9 1 1 A 139 139 ASP CB C 139 43.062 41.349 1.713 1 1 1091 . 9 1 1 A 139 139 ASP N N 139 124.516 120.212 4.304 1 1 1092 . 9 1 1 A 140 140 ILE H H 140 8.354 8.762 -0.408 1 1 1093 . 9 1 1 A 140 140 ILE HA H 140 4.473 4.669 -0.196 1 1 1103 . 9 1 1 A 140 140 ILE CB C 140 36.173 38.482 -2.309 1 1 1105 . 9 1 1 A 140 140 ILE N N 140 120.679 125.429 -4.750 1 1 1106 . 9 1 1 A 141 141 ALA H H 141 8.708 8.447 0.261 1 1 1107 . 9 1 1 A 141 141 ALA HA H 141 4.862 5.959 -1.097 1 1 1111 . 9 1 1 A 141 141 ALA CA C 141 47.968 50.312 -2.344 1 1 1112 . 9 1 1 A 141 141 ALA CB C 141 21.733 21.888 -0.155 1 1 1113 . 9 1 1 A 141 141 ALA N N 141 130.144 128.711 1.433 1 1 1114 . 9 1 1 A 142 142 GLY H H 142 7.888 8.686 -0.798 1 1 1115 . 9 1 1 A 142 142 GLY HA2 H 142 4.519 3.827 0.692 1 1 1116 . 9 1 1 A 142 142 GLY HA3 H 142 3.634 4.452 -0.818 1 1 1117 . 9 1 1 A 142 142 GLY N N 142 102.272 110.642 -8.370 1 1 1118 . 9 1 1 A 143 143 GLU H H 143 8.068 8.099 -0.031 1 1 1119 . 9 1 1 A 143 143 GLU HA H 143 4.577 4.708 -0.131 1 1 1124 . 9 1 1 A 143 143 GLU N N 143 120.569 121.177 -0.608 1 1 1125 . 9 1 1 A 144 144 HIS H H 144 8.478 8.695 -0.217 1 1 1126 . 9 1 1 A 144 144 HIS HA H 144 4.968 4.845 0.123 1 1 1131 . 9 1 1 A 144 144 HIS N N 144 124.275 120.153 4.122 1 1 1132 . 9 1 1 A 145 145 THR H H 145 9.031 8.343 0.688 1 1 1133 . 9 1 1 A 145 145 THR HA H 145 4.025 4.368 -0.343 1 1 1138 . 9 1 1 A 145 145 THR CA C 145 61.247 62.548 -1.301 1 1 1139 . 9 1 1 A 145 145 THR CB C 145 65.181 69.066 -3.885 1 1 1141 . 9 1 1 A 145 145 THR N N 145 125.828 112.528 13.300 1 1 1142 . 9 1 1 A 146 146 SER H H 146 9.077 7.728 1.349 1 1 1143 . 9 1 1 A 146 146 SER HA H 146 4.684 4.405 0.279 1 1 1145 . 9 1 1 A 146 146 SER CA C 146 56.067 59.624 -3.557 1 1 1146 . 9 1 1 A 146 146 SER CB C 146 60.510 62.549 -2.039 1 1 1147 . 9 1 1 A 146 146 SER N N 146 124.154 119.911 4.243 1 1 1148 . 9 1 1 A 147 147 PHE H H 147 9.049 8.707 0.342 1 1 1149 . 9 1 1 A 147 147 PHE HA H 147 4.022 4.078 -0.056 1 1 1154 . 9 1 1 A 147 147 PHE N N 147 127.670 126.128 1.542 1 1 1155 . 9 1 1 A 148 148 ASP H H 148 8.504 8.255 0.249 1 1 1156 . 9 1 1 A 148 148 ASP HA H 148 4.422 4.585 -0.163 1 1 1158 . 9 1 1 A 148 148 ASP CA C 148 52.584 55.293 -2.709 1 1 1159 . 9 1 1 A 148 148 ASP CB C 148 37.800 40.518 -2.718 1 1 1160 . 9 1 1 A 148 148 ASP N N 148 114.377 119.373 -4.996 1 1 1161 . 9 1 1 A 149 149 LYS H H 149 7.380 8.826 -1.446 1 1 1162 . 9 1 1 A 149 149 LYS HA H 149 4.487 4.540 -0.053 1 1 1171 . 9 1 1 A 149 149 LYS CA C 149 51.735 56.791 -5.056 1 1 1172 . 9 1 1 A 149 149 LYS CB C 149 30.162 33.325 -3.163 1 1 1175 . 9 1 1 A 149 149 LYS N N 149 119.137 116.482 2.655 1 1 1176 . 9 1 1 A 150 150 LEU H H 150 6.886 7.401 -0.515 1 1 1177 . 9 1 1 A 150 150 LEU HA H 150 3.996 4.526 -0.530 1 1 1186 . 9 1 1 A 150 150 LEU CA C 150 50.502 55.992 -5.490 1 1 1187 . 9 1 1 A 150 150 LEU N N 150 120.614 119.639 0.975 1 1 1188 . 9 1 1 A 151 151 PRO CB C 151 29.567 27.818 1.749 1 1 1190 . 9 1 1 A 152 152 LYS H H 152 8.076 8.532 -0.456 1 1 1191 . 9 1 1 A 152 152 LYS HA H 152 4.346 4.269 0.077 1 1 1195 . 9 1 1 A 152 152 LYS CA C 152 53.182 58.584 -5.402 1 1 1196 . 9 1 1 A 152 152 LYS CB C 152 31.487 32.591 -1.104 1 1 1198 . 9 1 1 A 152 152 LYS N N 152 118.133 122.370 -4.237 1 1 1199 . 9 1 1 A 153 153 ASP H H 153 7.982 8.323 -0.341 1 1 1200 . 9 1 1 A 153 153 ASP HA H 153 4.402 4.967 -0.565 1 1 1203 . 9 1 1 A 153 153 ASP CA C 153 52.584 52.822 -0.238 1 1 1204 . 9 1 1 A 153 153 ASP CB C 153 37.762 41.827 -4.065 1 1 1205 . 9 1 1 A 153 153 ASP N N 153 115.735 116.566 -0.831 1 1 1206 . 9 1 1 A 154 154 VAL H H 154 6.987 7.082 -0.095 1 1 1207 . 9 1 1 A 154 154 VAL HA H 154 4.406 4.341 0.065 1 1 1215 . 9 1 1 A 154 154 VAL CA C 154 58.408 59.354 -0.946 1 1 1216 . 9 1 1 A 154 154 VAL CB C 154 32.617 33.799 -1.182 1 1 1217 . 9 1 1 A 154 154 VAL N N 154 116.266 120.673 -4.407 1 1 1218 . 9 1 1 A 155 155 MET H H 155 8.444 8.367 0.077 1 1 1219 . 9 1 1 A 155 155 MET HA H 155 5.416 4.957 0.459 1 1 1224 . 9 1 1 A 155 155 MET CA C 155 51.183 53.928 -2.745 1 1 1226 . 9 1 1 A 155 155 MET N N 155 124.950 122.870 2.080 1 1 1227 . 9 1 1 A 156 156 ALA H H 156 9.226 9.539 -0.313 1 1 1228 . 9 1 1 A 156 156 ALA HA H 156 4.693 5.195 -0.502 1 1 1232 . 9 1 1 A 156 156 ALA CA C 156 48.379 50.566 -2.187 1 1 1233 . 9 1 1 A 156 156 ALA CB C 156 21.051 22.024 -0.973 1 1 1234 . 9 1 1 A 156 156 ALA N N 156 129.938 126.478 3.460 1 1 1235 . 9 1 1 A 157 157 THR H H 157 8.554 8.777 -0.223 1 1 1236 . 9 1 1 A 157 157 THR HA H 157 4.839 4.798 0.041 1 1 1241 . 9 1 1 A 157 157 THR CA C 157 59.555 62.454 -2.899 1 1 1242 . 9 1 1 A 157 157 THR CB C 157 68.575 69.985 -1.410 1 1 1244 . 9 1 1 A 157 157 THR N N 157 118.815 118.804 0.011 1 1 1245 . 9 1 1 A 158 158 TYR H H 158 9.974 9.669 0.305 1 1 1246 . 9 1 1 A 158 158 TYR HA H 158 4.435 5.302 -0.867 1 1 1253 . 9 1 1 A 158 158 TYR N N 158 126.958 125.637 1.321 1 1 1254 . 9 1 1 A 159 159 ARG H H 159 8.909 9.055 -0.146 1 1 1255 . 9 1 1 A 159 159 ARG HA H 159 5.444 5.425 0.019 1 1 1263 . 9 1 1 A 159 159 ARG CA C 159 51.933 54.631 -2.698 1 1 1264 . 9 1 1 A 159 159 ARG N N 159 121.721 121.211 0.510 1 1 1266 . 9 1 1 A 160 160 GLY H H 160 8.910 8.289 0.621 1 1 1267 . 9 1 1 A 160 160 GLY HA2 H 160 4.904 4.418 0.486 1 1 1268 . 9 1 1 A 160 160 GLY HA3 H 160 4.484 4.503 -0.019 1 1 1269 . 9 1 1 A 160 160 GLY N N 160 113.921 107.130 6.791 1 1 1270 . 9 1 1 A 161 161 THR H H 161 9.110 9.589 -0.479 1 1 1271 . 9 1 1 A 161 161 THR HA H 161 4.810 5.402 -0.592 1 1 1276 . 9 1 1 A 161 161 THR CA C 161 59.603 61.246 -1.643 1 1 1277 . 9 1 1 A 161 161 THR CB C 161 69.909 72.274 -2.365 1 1 1279 . 9 1 1 A 161 161 THR N N 161 126.813 115.550 11.263 1 1 1280 . 9 1 1 A 162 162 ALA H H 162 7.137 10.063 -2.926 1 1 1281 . 9 1 1 A 162 162 ALA HA H 162 5.361 5.245 0.116 1 1 1285 . 9 1 1 A 162 162 ALA CA C 162 46.573 50.844 -4.271 1 1 1286 . 9 1 1 A 162 162 ALA CB C 162 20.959 23.763 -2.804 1 1 1287 . 9 1 1 A 162 162 ALA N N 162 128.111 124.055 4.056 1 1 1288 . 9 1 1 A 163 163 PHE H H 163 8.587 8.580 0.007 1 1 1289 . 9 1 1 A 163 163 PHE HA H 163 5.538 5.085 0.453 1 1 1296 . 9 1 1 A 163 163 PHE N N 163 117.349 114.420 2.929 1 1 1297 . 9 1 1 A 164 164 GLY H H 164 8.650 8.407 0.243 1 1 1298 . 9 1 1 A 164 164 GLY HA2 H 164 4.210 3.931 0.279 1 1 1299 . 9 1 1 A 164 164 GLY HA3 H 164 3.285 4.008 -0.723 1 1 1300 . 9 1 1 A 164 164 GLY CA C 164 40.377 44.966 -4.589 1 1 1301 . 9 1 1 A 164 164 GLY N N 164 108.839 109.035 -0.196 1 1 1302 . 9 1 1 A 165 165 SER H H 165 7.684 9.338 -1.654 1 1 1303 . 9 1 1 A 165 165 SER HA H 165 3.458 3.646 -0.188 1 1 1304 . 9 1 1 A 165 165 SER N N 165 116.037 116.909 -0.872 1 1 1305 . 9 1 1 A 166 166 ASP H H 166 9.718 8.397 1.321 1 1 1306 . 9 1 1 A 166 166 ASP HA H 166 4.281 4.492 -0.211 1 1 1309 . 9 1 1 A 166 166 ASP CA C 166 52.584 56.187 -3.603 1 1 1310 . 9 1 1 A 166 166 ASP N N 166 125.166 120.576 4.590 1 1 1311 . 9 1 1 A 167 167 ASP H H 167 7.655 7.844 -0.189 1 1 1312 . 9 1 1 A 167 167 ASP HA H 167 4.666 5.000 -0.334 1 1 1315 . 9 1 1 A 167 167 ASP CB C 167 38.948 42.887 -3.939 1 1 1316 . 9 1 1 A 167 167 ASP N N 167 117.491 119.428 -1.937 1 1 1317 . 9 1 1 A 168 168 ALA H H 168 8.585 8.375 0.210 1 1 1318 . 9 1 1 A 168 168 ALA HA H 168 5.012 4.805 0.207 1 1 1322 . 9 1 1 A 168 168 ALA CA C 168 47.485 51.218 -3.733 1 1 1323 . 9 1 1 A 168 168 ALA N N 168 128.834 121.327 7.507 1 1 1324 . 9 1 1 A 169 169 GLY H H 169 8.472 8.035 0.437 1 1 1325 . 9 1 1 A 169 169 GLY HA2 H 169 4.404 4.076 0.328 1 1 1326 . 9 1 1 A 169 169 GLY HA3 H 169 4.051 4.368 -0.317 1 1 1327 . 9 1 1 A 169 169 GLY CA C 169 43.257 44.334 -1.077 1 1 1328 . 9 1 1 A 169 169 GLY N N 169 107.133 107.465 -0.332 1 1 1329 . 9 1 1 A 170 170 GLY H H 170 7.229 6.985 0.244 1 1 1330 . 9 1 1 A 170 170 GLY HA2 H 170 4.223 4.098 0.125 1 1 1331 . 9 1 1 A 170 170 GLY HA3 H 170 3.781 4.099 -0.318 1 1 1332 . 9 1 1 A 170 170 GLY CA C 170 43.310 45.127 -1.817 1 1 1333 . 9 1 1 A 170 170 GLY N N 170 107.542 108.020 -0.478 1 1 1334 . 9 1 1 A 171 171 LYS H H 171 9.641 8.671 0.970 1 1 1335 . 9 1 1 A 171 171 LYS HA H 171 5.129 5.152 -0.023 1 1 1342 . 9 1 1 A 171 171 LYS CA C 171 51.355 54.972 -3.617 1 1 1343 . 9 1 1 A 171 171 LYS N N 171 124.322 120.630 3.692 1 1 1344 . 9 1 1 A 172 172 LEU H H 172 7.764 8.615 -0.851 1 1 1345 . 9 1 1 A 172 172 LEU HA H 172 4.973 5.623 -0.650 1 1 1353 . 9 1 1 A 172 172 LEU CA C 172 50.348 53.465 -3.117 1 1 1354 . 9 1 1 A 172 172 LEU N N 172 126.389 120.669 5.720 1 1 1355 . 9 1 1 A 173 173 THR H H 173 8.321 8.590 -0.269 1 1 1356 . 9 1 1 A 173 173 THR HA H 173 5.017 4.911 0.106 1 1 1361 . 9 1 1 A 173 173 THR CA C 173 59.149 62.191 -3.042 1 1 1362 . 9 1 1 A 173 173 THR CB C 173 67.449 69.733 -2.284 1 1 1364 . 9 1 1 A 173 173 THR N N 173 123.553 118.961 4.592 1 1 1365 . 9 1 1 A 174 174 TYR H H 174 9.367 10.048 -0.681 1 1 1366 . 9 1 1 A 174 174 TYR HA H 174 4.660 5.259 -0.599 1 1 1373 . 9 1 1 A 174 174 TYR CB C 174 41.267 41.564 -0.297 1 1 1374 . 9 1 1 A 174 174 TYR N N 174 129.583 126.834 2.749 1 1 1375 . 9 1 1 A 175 175 THR H H 175 8.529 8.596 -0.067 1 1 1376 . 9 1 1 A 175 175 THR HA H 175 5.388 5.158 0.230 1 1 1381 . 9 1 1 A 175 175 THR CA C 175 58.216 61.722 -3.506 1 1 1382 . 9 1 1 A 175 175 THR CB C 175 68.575 71.182 -2.607 1 1 1384 . 9 1 1 A 175 175 THR N N 175 125.967 115.298 10.669 1 1 1385 . 9 1 1 A 176 176 ILE H H 176 9.139 8.837 0.302 1 1 1386 . 9 1 1 A 176 176 ILE HA H 176 4.382 5.217 -0.835 1 1 1395 . 9 1 1 A 176 176 ILE CA C 176 58.006 58.985 -0.979 1 1 1396 . 9 1 1 A 176 176 ILE CB C 176 38.881 42.082 -3.201 1 1 1400 . 9 1 1 A 176 176 ILE N N 176 123.715 120.324 3.391 1 1 1401 . 9 1 1 A 177 177 ASP H H 177 8.501 9.509 -1.008 1 1 1402 . 9 1 1 A 177 177 ASP HA H 177 5.011 5.442 -0.431 1 1 1405 . 9 1 1 A 177 177 ASP CA C 177 49.089 52.928 -3.839 1 1 1406 . 9 1 1 A 177 177 ASP CB C 177 39.282 42.661 -3.379 1 1 1407 . 9 1 1 A 177 177 ASP N N 177 125.978 121.420 4.558 1 1 1408 . 9 1 1 A 178 178 PHE H H 178 8.913 9.938 -1.025 1 1 1409 . 9 1 1 A 178 178 PHE HA H 178 3.993 4.097 -0.104 1 1 1414 . 9 1 1 A 178 178 PHE CB C 178 34.588 39.438 -4.850 1 1 1415 . 9 1 1 A 178 178 PHE N N 178 123.522 121.350 2.172 1 1 1416 . 9 1 1 A 179 179 ALA H H 179 8.487 8.223 0.264 1 1 1417 . 9 1 1 A 179 179 ALA HA H 179 4.528 4.400 0.128 1 1 1421 . 9 1 1 A 179 179 ALA CA C 179 52.584 55.665 -3.081 1 1 1422 . 9 1 1 A 179 179 ALA CB C 179 15.666 18.743 -3.077 1 1 1423 . 9 1 1 A 179 179 ALA N N 179 124.061 123.568 0.493 1 1 1424 . 9 1 1 A 180 180 ALA H H 180 7.162 8.129 -0.967 1 1 1425 . 9 1 1 A 180 180 ALA HA H 180 4.313 4.294 0.019 1 1 1429 . 9 1 1 A 180 180 ALA CA C 180 49.006 52.696 -3.690 1 1 1430 . 9 1 1 A 180 180 ALA CB C 180 16.933 17.762 -0.829 1 1 1431 . 9 1 1 A 180 180 ALA N N 180 119.710 119.298 0.412 1 1 1432 . 9 1 1 A 181 181 LYS H H 181 8.092 8.634 -0.542 1 1 1433 . 9 1 1 A 181 181 LYS HA H 181 3.457 4.729 -1.272 1 1 1440 . 9 1 1 A 181 181 LYS CA C 181 54.783 56.127 -1.344 1 1 1441 . 9 1 1 A 181 181 LYS CB C 181 27.088 34.139 -7.051 1 1 1444 . 9 1 1 A 181 181 LYS N N 181 114.996 115.741 -0.745 1 1 1445 . 9 1 1 A 182 182 GLN H H 182 7.532 8.126 -0.594 1 1 1446 . 9 1 1 A 182 182 GLN HA H 182 5.304 4.804 0.500 1 1 1453 . 9 1 1 A 182 182 GLN CA C 182 51.473 55.202 -3.729 1 1 1454 . 9 1 1 A 182 182 GLN CB C 182 31.585 32.745 -1.160 1 1 1455 . 9 1 1 A 182 182 GLN N N 182 115.064 117.378 -2.314 1 1 1457 . 9 1 1 A 183 183 GLY H H 183 9.026 8.216 0.810 1 1 1458 . 9 1 1 A 183 183 GLY HA2 H 183 5.376 4.524 0.852 1 1 1459 . 9 1 1 A 183 183 GLY HA3 H 183 3.567 4.886 -1.319 1 1 1460 . 9 1 1 A 183 183 GLY CA C 183 42.361 44.684 -2.323 1 1 1461 . 9 1 1 A 183 183 GLY N N 183 111.505 109.327 2.178 1 1 1462 . 9 1 1 A 184 184 HIS H H 184 7.508 8.448 -0.940 1 1 1463 . 9 1 1 A 184 184 HIS HA H 184 4.304 5.009 -0.705 1 1 1467 . 9 1 1 A 184 184 HIS CA C 184 52.793 55.657 -2.864 1 1 1468 . 9 1 1 A 184 184 HIS CB C 184 27.906 33.271 -5.365 1 1 1469 . 9 1 1 A 184 184 HIS N N 184 111.297 119.337 -8.040 1 1 1470 . 9 1 1 A 185 185 GLY H H 185 9.160 8.067 1.093 1 1 1471 . 9 1 1 A 185 185 GLY HA2 H 185 4.464 3.478 0.986 1 1 1472 . 9 1 1 A 185 185 GLY HA3 H 185 4.117 4.078 0.039 1 1 1473 . 9 1 1 A 185 185 GLY CA C 185 44.212 44.761 -0.549 1 1 1474 . 9 1 1 A 185 185 GLY N N 185 107.398 111.657 -4.259 1 1 1475 . 9 1 1 A 186 186 LYS H H 186 9.170 8.753 0.417 1 1 1476 . 9 1 1 A 186 186 LYS HA H 186 4.925 4.983 -0.058 1 1 1481 . 9 1 1 A 186 186 LYS CB C 186 33.642 35.884 -2.242 1 1 1482 . 9 1 1 A 186 186 LYS N N 186 122.690 116.493 6.197 1 1 1483 . 9 1 1 A 187 187 ILE H H 187 8.444 8.488 -0.044 1 1 1484 . 9 1 1 A 187 187 ILE HA H 187 4.626 4.877 -0.251 1 1 1487 . 9 1 1 A 187 187 ILE N N 187 124.320 124.872 -0.552 1 1 1488 . 9 1 1 A 188 188 GLU H H 188 8.590 10.005 -1.415 1 1 1489 . 9 1 1 A 188 188 GLU HA H 188 4.650 5.481 -0.831 1 1 1495 . 9 1 1 A 188 188 GLU N N 188 122.575 127.059 -4.484 1 1 1496 . 9 1 1 A 189 189 HIS H H 189 8.726 8.574 0.152 1 1 1497 . 9 1 1 A 189 189 HIS HA H 189 4.055 4.750 -0.695 1 1 1501 . 9 1 1 A 189 189 HIS CA C 189 54.623 57.023 -2.400 1 1 1502 . 9 1 1 A 189 189 HIS CB C 189 24.997 31.497 -6.500 1 1 1503 . 9 1 1 A 189 189 HIS N N 189 111.381 119.998 -8.617 1 1 1504 . 9 1 1 A 190 190 LEU H H 190 9.715 7.977 1.738 1 1 1505 . 9 1 1 A 190 190 LEU HA H 190 4.379 4.496 -0.117 1 1 1515 . 9 1 1 A 190 190 LEU N N 190 124.648 116.099 8.549 1 1 1516 . 9 1 1 A 191 191 LYS H H 191 10.099 8.413 1.686 1 1 1517 . 9 1 1 A 191 191 LYS HA H 191 3.736 4.539 -0.803 1 1 1524 . 9 1 1 A 191 191 LYS CA C 191 55.815 55.526 0.289 1 1 1525 . 9 1 1 A 191 191 LYS CB C 191 30.201 33.397 -3.196 1 1 1527 . 9 1 1 A 191 191 LYS N N 191 123.618 116.714 6.904 1 1 1528 . 9 1 1 A 192 192 SER H H 192 6.991 7.417 -0.426 1 1 1529 . 9 1 1 A 192 192 SER HA H 192 4.743 4.501 0.242 1 1 1532 . 9 1 1 A 192 192 SER CA C 192 51.974 57.337 -5.363 1 1 1533 . 9 1 1 A 192 192 SER CB C 192 60.005 63.678 -3.673 1 1 1534 . 9 1 1 A 192 192 SER N N 192 115.071 117.865 -2.794 1 1 1535 . 9 1 1 A 193 193 PRO CB C 193 29.607 31.404 -1.797 1 1 1537 . 9 1 1 A 194 194 GLU H H 194 8.213 8.038 0.175 1 1 1538 . 9 1 1 A 194 194 GLU HA H 194 3.063 4.509 -1.446 1 1 1543 . 9 1 1 A 194 194 GLU CA C 194 54.185 55.341 -1.156 1 1 1545 . 9 1 1 A 194 194 GLU N N 194 114.055 118.071 -4.016 1 1 1546 . 9 1 1 A 195 195 LEU H H 195 7.082 7.582 -0.500 1 1 1547 . 9 1 1 A 195 195 LEU HA H 195 4.027 4.059 -0.032 1 1 1557 . 9 1 1 A 195 195 LEU CA C 195 51.361 57.861 -6.500 1 1 1558 . 9 1 1 A 195 195 LEU CB C 195 38.950 41.803 -2.853 1 1 1561 . 9 1 1 A 195 195 LEU N N 195 113.898 121.395 -7.497 1 1 1562 . 9 1 1 A 196 196 ASN H H 196 7.060 7.600 -0.540 1 1 1563 . 9 1 1 A 196 196 ASN HA H 196 4.638 5.571 -0.933 1 1 1567 . 9 1 1 A 196 196 ASN N N 196 119.196 114.533 4.663 1 1 1568 . 9 1 1 A 197 197 VAL H H 197 7.244 9.032 -1.788 1 1 1569 . 9 1 1 A 197 197 VAL HA H 197 4.540 4.742 -0.202 1 1 1577 . 9 1 1 A 197 197 VAL CA C 197 57.176 60.165 -2.989 1 1 1578 . 9 1 1 A 197 197 VAL N N 197 113.621 120.032 -6.411 1 1 1579 . 9 1 1 A 198 198 ASP H H 198 8.881 9.181 -0.300 1 1 1580 . 9 1 1 A 198 198 ASP HA H 198 4.894 4.934 -0.040 1 1 1581 . 9 1 1 A 198 198 ASP N N 198 118.852 124.471 -5.619 1 1 1582 . 9 1 1 A 199 199 LEU H H 199 8.498 8.436 0.062 1 1 1583 . 9 1 1 A 199 199 LEU HA H 199 4.317 4.169 0.148 1 1 1591 . 9 1 1 A 199 199 LEU N N 199 124.078 125.632 -1.554 1 1 1592 . 9 1 1 A 200 200 ALA H H 200 8.386 7.994 0.392 1 1 1593 . 9 1 1 A 200 200 ALA HA H 200 4.295 4.267 0.028 1 1 1597 . 9 1 1 A 200 200 ALA CA C 200 50.044 50.624 -0.580 1 1 1598 . 9 1 1 A 200 200 ALA CB C 200 17.985 22.011 -4.026 1 1 1599 . 9 1 1 A 200 200 ALA N N 200 127.315 124.520 2.795 1 1 1600 . 9 1 1 A 201 201 VAL H H 201 8.007 8.621 -0.614 1 1 1601 . 9 1 1 A 201 201 VAL HA H 201 4.577 4.784 -0.207 1 1 1609 . 9 1 1 A 201 201 VAL CA C 201 60.004 60.481 -0.477 1 1 1610 . 9 1 1 A 201 201 VAL CB C 201 28.863 36.193 -7.330 1 1 1611 . 9 1 1 A 201 201 VAL N N 201 119.409 121.899 -2.490 1 1 1612 . 9 1 1 A 202 202 ALA H H 202 8.789 9.255 -0.466 1 1 1613 . 9 1 1 A 202 202 ALA HA H 202 4.630 5.553 -0.923 1 1 1617 . 9 1 1 A 202 202 ALA CA C 202 48.200 50.178 -1.978 1 1 1618 . 9 1 1 A 202 202 ALA N N 202 131.745 127.187 4.558 1 1 1619 . 9 1 1 A 203 203 TYR H H 203 8.522 9.267 -0.745 1 1 1620 . 9 1 1 A 203 203 TYR HA H 203 5.391 5.704 -0.313 1 1 1627 . 9 1 1 A 203 203 TYR CA C 203 54.648 57.487 -2.839 1 1 1628 . 9 1 1 A 203 203 TYR CB C 203 37.315 40.072 -2.757 1 1 1629 . 9 1 1 A 203 203 TYR N N 203 117.786 122.174 -4.388 1 1 1630 . 9 1 1 A 204 204 ILE H H 204 8.209 8.323 -0.114 1 1 1631 . 9 1 1 A 204 204 ILE HA H 204 4.393 4.813 -0.420 1 1 1641 . 9 1 1 A 204 204 ILE CB C 204 36.807 40.403 -3.596 1 1 1644 . 9 1 1 A 204 204 ILE N N 204 120.602 123.289 -2.687 1 1 1645 . 9 1 1 A 205 205 LYS H H 205 9.340 8.818 0.522 1 1 1646 . 9 1 1 A 205 205 LYS HA H 205 4.756 4.523 0.233 1 1 1651 . 9 1 1 A 205 205 LYS CA C 205 50.844 60.885 -10.041 1 1 1652 . 9 1 1 A 205 205 LYS N N 205 127.960 124.594 3.366 1 1 1653 . 9 1 1 A 207 207 ASP H H 207 8.436 8.614 -0.178 1 1 1654 . 9 1 1 A 207 207 ASP HA H 207 4.692 4.568 0.124 1 1 1657 . 9 1 1 A 207 207 ASP CA C 207 48.789 54.412 -5.623 1 1 1658 . 9 1 1 A 207 207 ASP CB C 207 38.377 40.779 -2.402 1 1 1659 . 9 1 1 A 207 207 ASP N N 207 123.098 125.487 -2.389 1 1 1660 . 9 1 1 A 208 208 GLU H H 208 8.880 8.736 0.144 1 1 1661 . 9 1 1 A 208 208 GLU HA H 208 3.994 4.160 -0.166 1 1 1666 . 9 1 1 A 208 208 GLU CA C 208 56.123 57.204 -1.081 1 1 1667 . 9 1 1 A 208 208 GLU CB C 208 25.794 29.579 -3.785 1 1 1669 . 9 1 1 A 208 208 GLU N N 208 119.042 119.739 -0.697 1 1 1670 . 9 1 1 A 209 209 LYS H H 209 7.681 7.758 -0.077 1 1 1671 . 9 1 1 A 209 209 LYS HA H 209 4.141 4.396 -0.255 1 1 1680 . 9 1 1 A 209 209 LYS N N 209 119.252 118.276 0.976 1 1 1681 . 9 1 1 A 210 210 HIS H H 210 8.177 7.208 0.969 1 1 1682 . 9 1 1 A 210 210 HIS HA H 210 3.825 4.620 -0.795 1 1 1687 . 9 1 1 A 210 210 HIS CA C 210 54.205 54.701 -0.496 1 1 1688 . 9 1 1 A 210 210 HIS CB C 210 23.439 30.629 -7.190 1 1 1689 . 9 1 1 A 210 210 HIS N N 210 112.758 112.979 -0.221 1 1 1690 . 9 1 1 A 211 211 HIS H H 211 8.758 7.314 1.444 1 1 1691 . 9 1 1 A 211 211 HIS HA H 211 5.041 4.897 0.144 1 1 1695 . 9 1 1 A 211 211 HIS CA C 211 50.450 54.555 -4.105 1 1 1696 . 9 1 1 A 211 211 HIS CB C 211 25.703 33.321 -7.618 1 1 1697 . 9 1 1 A 211 211 HIS N N 211 119.552 118.386 1.166 1 1 1698 . 9 1 1 A 212 212 ALA H H 212 8.556 7.891 0.665 1 1 1699 . 9 1 1 A 212 212 ALA HA H 212 4.712 4.550 0.162 1 1 1703 . 9 1 1 A 212 212 ALA CA C 212 49.886 51.020 -1.134 1 1 1704 . 9 1 1 A 212 212 ALA CB C 212 18.860 19.547 -0.687 1 1 1705 . 9 1 1 A 212 212 ALA N N 212 123.780 122.835 0.945 1 1 1706 . 9 1 1 A 213 213 VAL H H 213 9.338 7.854 1.484 1 1 1707 . 9 1 1 A 213 213 VAL HA H 213 5.074 4.907 0.167 1 1 1715 . 9 1 1 A 213 213 VAL CA C 213 57.486 60.656 -3.170 1 1 1716 . 9 1 1 A 213 213 VAL CB C 213 33.938 34.811 -0.873 1 1 1717 . 9 1 1 A 213 213 VAL N N 213 124.742 119.570 5.172 1 1 1718 . 9 1 1 A 214 214 ILE H H 214 8.962 9.045 -0.083 1 1 1719 . 9 1 1 A 214 214 ILE HA H 214 4.434 4.128 0.306 1 1 1726 . 9 1 1 A 214 214 ILE N N 214 122.881 126.562 -3.681 1 1 1727 . 9 1 1 A 215 215 SER H H 215 8.558 8.462 0.096 1 1 1728 . 9 1 1 A 215 215 SER HA H 215 5.001 5.343 -0.342 1 1 1731 . 9 1 1 A 215 215 SER CA C 215 53.230 57.212 -3.982 1 1 1732 . 9 1 1 A 215 215 SER CB C 215 62.077 64.977 -2.900 1 1 1733 . 9 1 1 A 215 215 SER N N 215 122.891 124.690 -1.799 1 1 1734 . 9 1 1 A 216 216 GLY H H 216 7.282 9.461 -2.179 1 1 1735 . 9 1 1 A 216 216 GLY HA2 H 216 4.515 4.365 0.150 1 1 1736 . 9 1 1 A 216 216 GLY HA3 H 216 3.473 4.388 -0.915 1 1 1737 . 9 1 1 A 216 216 GLY CA C 216 42.816 45.951 -3.135 1 1 1738 . 9 1 1 A 216 216 GLY N N 216 110.899 112.140 -1.241 1 1 1739 . 9 1 1 A 217 217 SER H H 217 8.673 8.711 -0.038 1 1 1740 . 9 1 1 A 217 217 SER HA H 217 5.127 5.314 -0.187 1 1 1743 . 9 1 1 A 217 217 SER CA C 217 56.266 56.707 -0.441 1 1 1744 . 9 1 1 A 217 217 SER N N 217 117.164 114.589 2.575 1 1 1745 . 9 1 1 A 218 218 VAL H H 218 7.451 8.699 -1.248 1 1 1746 . 9 1 1 A 218 218 VAL HA H 218 5.128 4.354 0.774 1 1 1754 . 9 1 1 A 218 218 VAL CA C 218 56.637 61.906 -5.269 1 1 1755 . 9 1 1 A 218 218 VAL N N 218 117.826 123.963 -6.137 1 1 1756 . 9 1 1 A 219 219 LEU H H 219 9.022 8.932 0.090 1 1 1757 . 9 1 1 A 219 219 LEU HA H 219 5.387 5.035 0.352 1 1 1767 . 9 1 1 A 219 219 LEU CA C 219 50.450 53.716 -3.266 1 1 1768 . 9 1 1 A 219 219 LEU N N 219 124.820 127.300 -2.480 1 1 1769 . 9 1 1 A 220 220 TYR H H 220 8.816 9.184 -0.368 1 1 1770 . 9 1 1 A 220 220 TYR HA H 220 4.834 5.429 -0.595 1 1 1777 . 9 1 1 A 220 220 TYR N N 220 121.249 126.000 -4.751 1 1 1778 . 9 1 1 A 221 221 ASN H H 221 9.191 8.640 0.551 1 1 1779 . 9 1 1 A 221 221 ASN HA H 221 4.048 4.701 -0.653 1 1 1784 . 9 1 1 A 221 221 ASN CA C 221 51.647 54.409 -2.762 1 1 1785 . 9 1 1 A 221 221 ASN CB C 221 36.640 38.010 -1.370 1 1 1786 . 9 1 1 A 221 221 ASN N N 221 129.865 124.779 5.086 1 1 1788 . 9 1 1 A 222 222 GLN H H 222 8.468 7.749 0.719 1 1 1789 . 9 1 1 A 222 222 GLN HA H 222 3.671 4.342 -0.671 1 1 1794 . 9 1 1 A 222 222 GLN CA C 222 55.075 57.518 -2.443 1 1 1795 . 9 1 1 A 222 222 GLN CB C 222 24.663 30.388 -5.725 1 1 1797 . 9 1 1 A 222 222 GLN N N 222 108.367 117.933 -9.566 1 1 1798 . 9 1 1 A 223 223 ASP H H 223 7.797 7.914 -0.117 1 1 1799 . 9 1 1 A 223 223 ASP HA H 223 4.986 4.832 0.154 1 1 1802 . 9 1 1 A 223 223 ASP N N 223 120.842 118.590 2.252 1 1 1803 . 9 1 1 A 224 224 GLU H H 224 8.731 7.996 0.735 1 1 1804 . 9 1 1 A 224 224 GLU HA H 224 4.690 4.452 0.238 1 1 1809 . 9 1 1 A 224 224 GLU CA C 224 54.703 56.587 -1.884 1 1 1810 . 9 1 1 A 224 224 GLU CB C 224 26.357 31.210 -4.853 1 1 1812 . 9 1 1 A 224 224 GLU N N 224 124.249 120.793 3.456 1 1 1813 . 9 1 1 A 225 225 LYS H H 225 8.730 8.343 0.387 1 1 1814 . 9 1 1 A 225 225 LYS HA H 225 4.754 4.804 -0.050 1 1 1822 . 9 1 1 A 225 225 LYS N N 225 126.784 124.618 2.166 1 1 1823 . 9 1 1 A 226 226 GLY H H 226 7.683 9.623 -1.940 1 1 1824 . 9 1 1 A 226 226 GLY HA2 H 226 5.567 4.120 1.447 1 1 1825 . 9 1 1 A 226 226 GLY HA3 H 226 3.819 4.152 -0.333 1 1 1826 . 9 1 1 A 226 226 GLY CA C 226 42.264 44.066 -1.802 1 1 1827 . 9 1 1 A 226 226 GLY N N 226 107.140 111.343 -4.203 1 1 1828 . 9 1 1 A 227 227 SER H H 227 8.672 10.893 -2.221 1 1 1829 . 9 1 1 A 227 227 SER HA H 227 5.564 5.995 -0.431 1 1 1832 . 9 1 1 A 227 227 SER CA C 227 54.373 55.977 -1.604 1 1 1833 . 9 1 1 A 227 227 SER CB C 227 63.963 66.130 -2.167 1 1 1834 . 9 1 1 A 227 227 SER N N 227 117.767 113.004 4.763 1 1 1835 . 9 1 1 A 228 228 TYR H H 228 9.073 9.762 -0.689 1 1 1836 . 9 1 1 A 228 228 TYR HA H 228 5.519 5.097 0.422 1 1 1843 . 9 1 1 A 228 228 TYR N N 228 118.324 122.431 -4.107 1 1 1844 . 9 1 1 A 229 229 SER H H 229 8.929 8.127 0.802 1 1 1845 . 9 1 1 A 229 229 SER HA H 229 5.209 5.442 -0.233 1 1 1848 . 9 1 1 A 229 229 SER CA C 229 54.131 57.570 -3.439 1 1 1849 . 9 1 1 A 229 229 SER N N 229 116.118 120.551 -4.433 1 1 1850 . 9 1 1 A 230 230 LEU H H 230 9.372 9.864 -0.492 1 1 1851 . 9 1 1 A 230 230 LEU HA H 230 4.803 4.917 -0.114 1 1 1863 . 9 1 1 A 230 230 LEU N N 230 124.803 126.056 -1.253 1 1 1864 . 9 1 1 A 231 231 GLY H H 231 9.080 8.331 0.749 1 1 1865 . 9 1 1 A 231 231 GLY HA2 H 231 4.776 4.102 0.674 1 1 1866 . 9 1 1 A 231 231 GLY HA3 H 231 3.528 4.264 -0.736 1 1 1867 . 9 1 1 A 231 231 GLY CA C 231 41.468 44.556 -3.088 1 1 1868 . 9 1 1 A 231 231 GLY N N 231 109.611 108.485 1.126 1 1 1869 . 9 1 1 A 232 232 ILE H H 232 6.849 8.534 -1.685 1 1 1870 . 9 1 1 A 232 232 ILE HA H 232 4.742 4.840 -0.098 1 1 1878 . 9 1 1 A 232 232 ILE N N 232 120.566 124.378 -3.812 1 1 1879 . 9 1 1 A 233 233 PHE H H 233 9.569 9.943 -0.374 1 1 1880 . 9 1 1 A 233 233 PHE HA H 233 4.979 5.158 -0.179 1 1 1885 . 9 1 1 A 233 233 PHE N N 233 129.256 126.894 2.362 1 1 1886 . 9 1 1 A 234 234 GLY H H 234 8.734 9.174 -0.440 1 1 1887 . 9 1 1 A 234 234 GLY HA2 H 234 4.488 3.945 0.543 1 1 1888 . 9 1 1 A 234 234 GLY HA3 H 234 3.327 3.957 -0.630 1 1 1889 . 9 1 1 A 234 234 GLY CA C 234 40.377 47.337 -6.960 1 1 1890 . 9 1 1 A 234 234 GLY N N 234 105.294 111.710 -6.416 1 1 1891 . 9 1 1 A 235 235 GLU H H 235 9.198 8.959 0.239 1 1 1892 . 9 1 1 A 235 235 GLU HA H 235 4.111 4.801 -0.690 1 1 1897 . 9 1 1 A 235 235 GLU CA C 235 56.466 60.148 -3.682 1 1 1898 . 9 1 1 A 235 235 GLU CB C 235 26.256 30.066 -3.810 1 1 1900 . 9 1 1 A 235 235 GLU N N 235 125.813 125.186 0.627 1 1 1901 . 9 1 1 A 236 236 LYS H H 236 8.147 7.812 0.335 1 1 1902 . 9 1 1 A 236 236 LYS HA H 236 4.373 4.247 0.126 1 1 1905 . 9 1 1 A 236 236 LYS N N 236 117.810 119.747 -1.937 1 1 1906 . 9 1 1 A 237 237 ALA H H 237 7.685 8.075 -0.390 1 1 1907 . 9 1 1 A 237 237 ALA HA H 237 3.902 4.648 -0.746 1 1 1911 . 9 1 1 A 237 237 ALA CA C 237 49.762 52.535 -2.773 1 1 1912 . 9 1 1 A 237 237 ALA CB C 237 14.720 21.959 -7.239 1 1 1913 . 9 1 1 A 237 237 ALA N N 237 118.704 122.051 -3.347 1 1 1914 . 9 1 1 A 238 238 GLN H H 238 9.312 9.486 -0.174 1 1 1915 . 9 1 1 A 238 238 GLN HA H 238 4.049 4.739 -0.690 1 1 1920 . 9 1 1 A 238 238 GLN N N 238 118.059 116.775 1.284 1 1 1921 . 9 1 1 A 239 239 GLU H H 239 8.785 8.216 0.569 1 1 1922 . 9 1 1 A 239 239 GLU HA H 239 5.531 5.028 0.503 1 1 1927 . 9 1 1 A 239 239 GLU N N 239 116.914 115.105 1.809 1 1 1928 . 9 1 1 A 240 240 VAL H H 240 8.501 9.499 -0.998 1 1 1929 . 9 1 1 A 240 240 VAL HA H 240 5.655 4.673 0.982 1 1 1937 . 9 1 1 A 240 240 VAL CA C 240 55.582 60.557 -4.975 1 1 1940 . 9 1 1 A 240 240 VAL N N 240 110.588 119.947 -9.359 1 1 1941 . 9 1 1 A 241 241 ALA H H 241 8.463 8.363 0.100 1 1 1942 . 9 1 1 A 241 241 ALA HA H 241 5.014 4.964 0.050 1 1 1946 . 9 1 1 A 241 241 ALA CA C 241 49.361 51.001 -1.640 1 1 1947 . 9 1 1 A 241 241 ALA CB C 241 18.196 23.517 -5.321 1 1 1948 . 9 1 1 A 241 241 ALA N N 241 121.125 129.612 -8.487 1 1 1949 . 9 1 1 A 242 242 GLY H H 242 9.421 8.197 1.224 1 1 1950 . 9 1 1 A 242 242 GLY HA2 H 242 5.161 4.149 1.012 1 1 1951 . 9 1 1 A 242 242 GLY HA3 H 242 4.076 4.220 -0.144 1 1 1952 . 9 1 1 A 242 242 GLY N N 242 112.036 105.874 6.162 1 1 1953 . 9 1 1 A 243 243 SER H H 243 8.929 8.245 0.684 1 1 1954 . 9 1 1 A 243 243 SER HA H 243 5.331 5.022 0.309 1 1 1957 . 9 1 1 A 243 243 SER N N 243 116.113 116.171 -0.058 1 1 1958 . 9 1 1 A 244 244 ALA H H 244 9.218 8.241 0.977 1 1 1959 . 9 1 1 A 244 244 ALA HA H 244 5.221 4.768 0.453 1 1 1963 . 9 1 1 A 244 244 ALA CA C 244 47.883 50.993 -3.110 1 1 1964 . 9 1 1 A 244 244 ALA N N 244 120.635 122.948 -2.313 1 1 1965 . 9 1 1 A 245 245 GLU H H 245 9.194 8.346 0.848 1 1 1966 . 9 1 1 A 245 245 GLU HA H 245 4.869 5.296 -0.427 1 1 1971 . 9 1 1 A 245 245 GLU N N 245 123.487 117.658 5.829 1 1 1972 . 9 1 1 A 246 246 VAL H H 246 8.531 9.323 -0.792 1 1 1973 . 9 1 1 A 246 246 VAL HA H 246 4.518 4.543 -0.025 1 1 1981 . 9 1 1 A 246 246 VAL CA C 246 58.286 60.966 -2.680 1 1 1982 . 9 1 1 A 246 246 VAL N N 246 123.347 125.291 -1.944 1 1 1983 . 9 1 1 A 247 247 GLU H H 247 9.132 8.691 0.441 1 1 1984 . 9 1 1 A 247 247 GLU HA H 247 4.368 5.043 -0.675 1 1 1989 . 9 1 1 A 247 247 GLU CB C 247 26.744 33.209 -6.465 1 1 1990 . 9 1 1 A 247 247 GLU N N 247 129.243 127.027 2.216 1 1 1991 . 9 1 1 A 248 248 THR H H 248 7.827 8.205 -0.378 1 1 1992 . 9 1 1 A 248 248 THR HA H 248 4.749 4.715 0.034 1 1 1997 . 9 1 1 A 248 248 THR CA C 248 56.859 60.519 -3.660 1 1 1998 . 9 1 1 A 248 248 THR CB C 248 69.171 70.789 -1.618 1 1 2000 . 9 1 1 A 248 248 THR N N 248 114.228 121.517 -7.289 1 1 2001 . 9 1 1 A 249 249 ALA H H 249 9.148 8.639 0.509 1 1 2002 . 9 1 1 A 249 249 ALA HA H 249 4.174 4.166 0.008 1 1 2006 . 9 1 1 A 249 249 ALA CA C 249 51.970 54.014 -2.044 1 1 2007 . 9 1 1 A 249 249 ALA CB C 249 15.797 18.716 -2.919 1 1 2008 . 9 1 1 A 249 249 ALA N N 249 123.341 124.396 -1.055 1 1 2009 . 9 1 1 A 250 250 ASN H H 250 7.974 7.688 0.286 1 1 2010 . 9 1 1 A 250 250 ASN HA H 250 4.953 4.866 0.087 1 1 2015 . 9 1 1 A 250 250 ASN CA C 250 49.198 52.707 -3.509 1 1 2016 . 9 1 1 A 250 250 ASN CB C 250 35.976 38.622 -2.646 1 1 2017 . 9 1 1 A 250 250 ASN N N 250 113.358 116.076 -2.718 1 1 2019 . 9 1 1 A 251 251 GLY H H 251 7.510 7.915 -0.405 1 1 2020 . 9 1 1 A 251 251 GLY HA2 H 251 4.492 4.122 0.370 1 1 2021 . 9 1 1 A 251 251 GLY HA3 H 251 3.853 4.255 -0.402 1 1 2022 . 9 1 1 A 251 251 GLY CA C 251 41.435 45.791 -4.356 1 1 2023 . 9 1 1 A 251 251 GLY N N 251 108.692 108.663 0.029 1 1 2024 . 9 1 1 A 252 252 ILE H H 252 8.465 8.822 -0.357 1 1 2025 . 9 1 1 A 252 252 ILE HA H 252 4.521 4.565 -0.044 1 1 2035 . 9 1 1 A 252 252 ILE CB C 252 35.653 37.624 -1.971 1 1 2039 . 9 1 1 A 252 252 ILE N N 252 122.043 127.196 -5.153 1 1 2040 . 9 1 1 A 253 253 HIS H H 253 9.311 9.715 -0.404 1 1 2041 . 9 1 1 A 253 253 HIS HA H 253 4.861 4.909 -0.048 1 1 2046 . 9 1 1 A 253 253 HIS N N 253 126.617 126.430 0.187 1 1 2047 . 9 1 1 A 254 254 HIS H H 254 8.820 8.893 -0.073 1 1 2048 . 9 1 1 A 254 254 HIS HA H 254 5.305 4.900 0.405 1 1 2051 . 9 1 1 A 254 254 HIS CA C 254 52.781 54.518 -1.737 1 1 2052 . 9 1 1 A 254 254 HIS N N 254 122.665 117.499 5.166 1 1 2053 . 9 1 1 A 255 255 ILE H H 255 9.047 8.736 0.311 1 1 2054 . 9 1 1 A 255 255 ILE HA H 255 4.651 4.782 -0.131 1 1 2061 . 9 1 1 A 255 255 ILE N N 255 123.958 119.586 4.372 1 1 2062 . 9 1 1 A 256 256 GLY H H 256 9.339 8.642 0.697 1 1 2063 . 9 1 1 A 256 256 GLY HA2 H 256 3.816 2.780 1.036 1 1 2064 . 9 1 1 A 256 256 GLY HA3 H 256 2.267 3.688 -1.421 1 1 2065 . 9 1 1 A 256 256 GLY N N 256 115.022 111.347 3.675 1 1 2066 . 9 1 1 A 257 257 LEU H H 257 7.890 8.447 -0.557 1 1 2067 . 9 1 1 A 257 257 LEU HA H 257 4.853 5.154 -0.301 1 1 2077 . 9 1 1 A 257 257 LEU N N 257 121.441 123.226 -1.785 1 1 2078 . 9 1 1 A 258 258 ALA H H 258 7.982 9.047 -1.065 1 1 2079 . 9 1 1 A 258 258 ALA HA H 258 4.668 4.987 -0.319 1 1 2083 . 9 1 1 A 258 258 ALA CA C 258 49.678 51.727 -2.049 1 1 2084 . 9 1 1 A 258 258 ALA CB C 258 19.561 21.347 -1.786 1 1 2085 . 9 1 1 A 258 258 ALA N N 258 123.234 122.393 0.841 1 1 2086 . 9 1 1 A 259 259 ALA H H 259 9.117 8.706 0.411 1 1 2087 . 9 1 1 A 259 259 ALA HA H 259 4.790 5.120 -0.330 1 1 2091 . 9 1 1 A 259 259 ALA N N 259 123.901 124.141 -0.240 1 1 2092 . 9 1 1 A 260 260 LYS H H 260 8.452 9.083 -0.631 1 1 2093 . 9 1 1 A 260 260 LYS HA H 260 5.914 5.057 0.857 1 1 2098 . 9 1 1 A 260 260 LYS CA C 260 51.818 54.435 -2.617 1 1 2099 . 9 1 1 A 260 260 LYS N N 260 116.464 116.616 -0.152 1 1 1 . 10 1 1 A 9 9 SER H H 9 8.293 8.715 -0.422 1 1 2 . 10 1 1 A 9 9 SER HA H 9 4.432 5.050 -0.618 1 1 3 . 10 1 1 A 9 9 SER N N 9 116.407 114.253 2.154 1 1 4 . 10 1 1 A 10 10 GLY H H 10 8.472 8.425 0.047 1 1 5 . 10 1 1 A 10 10 GLY N N 10 111.611 107.425 4.186 1 1 6 . 10 1 1 A 14 14 VAL H H 14 8.009 8.718 -0.709 1 1 7 . 10 1 1 A 14 14 VAL HA H 14 4.128 4.162 -0.034 1 1 15 . 10 1 1 A 14 14 VAL CA C 14 59.473 62.755 -3.282 1 1 16 . 10 1 1 A 14 14 VAL CB C 14 30.127 32.397 -2.270 1 1 17 . 10 1 1 A 14 14 VAL N N 14 119.846 120.146 -0.300 1 1 18 . 10 1 1 A 15 15 THR H H 15 8.152 8.689 -0.537 1 1 19 . 10 1 1 A 15 15 THR HA H 15 4.346 4.854 -0.508 1 1 24 . 10 1 1 A 15 15 THR N N 15 118.509 118.246 0.263 1 1 25 . 10 1 1 A 16 16 ALA H H 16 8.207 8.786 -0.579 1 1 26 . 10 1 1 A 16 16 ALA HA H 16 4.319 4.284 0.035 1 1 30 . 10 1 1 A 16 16 ALA CA C 16 49.835 53.396 -3.561 1 1 31 . 10 1 1 A 16 16 ALA CB C 16 16.714 19.009 -2.295 1 1 32 . 10 1 1 A 16 16 ALA N N 16 126.935 125.172 1.763 1 1 33 . 10 1 1 A 17 17 ASP H H 17 8.269 7.973 0.296 1 1 34 . 10 1 1 A 17 17 ASP HA H 17 4.581 4.929 -0.348 1 1 37 . 10 1 1 A 17 17 ASP CA C 17 51.643 53.209 -1.566 1 1 38 . 10 1 1 A 17 17 ASP CB C 17 38.257 41.543 -3.286 1 1 39 . 10 1 1 A 17 17 ASP N N 17 120.379 118.283 2.096 1 1 40 . 10 1 1 A 18 18 ILE H H 18 7.979 7.898 0.081 1 1 41 . 10 1 1 A 18 18 ILE HA H 18 4.178 4.068 0.110 1 1 48 . 10 1 1 A 18 18 ILE CA C 18 58.737 63.431 -4.694 1 1 49 . 10 1 1 A 18 18 ILE CB C 18 36.077 38.039 -1.962 1 1 53 . 10 1 1 A 18 18 ILE N N 18 121.171 120.393 0.778 1 1 54 . 10 1 1 A 19 19 GLY H H 19 8.410 8.080 0.330 1 1 55 . 10 1 1 A 19 19 GLY HA2 H 19 4.023 3.789 0.234 1 1 56 . 10 1 1 A 19 19 GLY HA3 H 19 4.023 3.795 0.228 1 1 57 . 10 1 1 A 19 19 GLY N N 19 112.246 108.446 3.800 1 1 58 . 10 1 1 A 20 20 THR H H 20 8.005 8.275 -0.270 1 1 59 . 10 1 1 A 20 20 THR HA H 20 4.463 4.172 0.291 1 1 64 . 10 1 1 A 20 20 THR CB C 20 66.723 68.652 -1.929 1 1 66 . 10 1 1 A 20 20 THR N N 20 112.239 115.342 -3.103 1 1 67 . 10 1 1 A 21 21 GLY H H 21 8.500 8.351 0.149 1 1 68 . 10 1 1 A 21 21 GLY HA2 H 21 4.099 3.810 0.289 1 1 69 . 10 1 1 A 21 21 GLY HA3 H 21 3.872 3.812 0.060 1 1 70 . 10 1 1 A 21 21 GLY N N 21 111.048 112.171 -1.123 1 1 71 . 10 1 1 A 22 22 LEU H H 22 7.427 7.654 -0.227 1 1 72 . 10 1 1 A 22 22 LEU HA H 22 3.884 4.015 -0.131 1 1 84 . 10 1 1 A 22 22 LEU N N 22 118.837 120.524 -1.687 1 1 85 . 10 1 1 A 23 23 ALA H H 23 7.896 8.135 -0.239 1 1 86 . 10 1 1 A 23 23 ALA HA H 23 4.023 4.110 -0.087 1 1 90 . 10 1 1 A 23 23 ALA CA C 23 52.584 54.031 -1.447 1 1 91 . 10 1 1 A 23 23 ALA CB C 23 15.470 18.393 -2.923 1 1 92 . 10 1 1 A 23 23 ALA N N 23 119.194 121.458 -2.264 1 1 93 . 10 1 1 A 24 24 ASP H H 24 8.265 8.678 -0.413 1 1 94 . 10 1 1 A 24 24 ASP HA H 24 4.337 4.680 -0.343 1 1 97 . 10 1 1 A 24 24 ASP CB C 24 37.029 41.292 -4.263 1 1 98 . 10 1 1 A 24 24 ASP N N 24 119.035 116.534 2.501 1 1 99 . 10 1 1 A 25 25 ALA H H 25 8.211 8.506 -0.295 1 1 100 . 10 1 1 A 25 25 ALA HA H 25 4.064 4.143 -0.079 1 1 104 . 10 1 1 A 25 25 ALA CA C 25 53.278 54.261 -0.983 1 1 105 . 10 1 1 A 25 25 ALA CB C 25 15.760 18.485 -2.725 1 1 106 . 10 1 1 A 25 25 ALA N N 25 122.434 121.344 1.090 1 1 107 . 10 1 1 A 26 26 LEU H H 26 7.334 7.715 -0.381 1 1 108 . 10 1 1 A 26 26 LEU HA H 26 4.351 4.240 0.111 1 1 117 . 10 1 1 A 26 26 LEU N N 26 114.238 118.400 -4.162 1 1 118 . 10 1 1 A 27 27 THR H H 27 7.708 7.510 0.198 1 1 119 . 10 1 1 A 27 27 THR HA H 27 4.492 4.539 -0.047 1 1 124 . 10 1 1 A 27 27 THR CA C 27 59.438 62.464 -3.026 1 1 125 . 10 1 1 A 27 27 THR CB C 27 68.796 69.702 -0.906 1 1 127 . 10 1 1 A 27 27 THR N N 27 106.430 107.629 -1.199 1 1 128 . 10 1 1 A 28 28 ALA H H 28 8.906 7.839 1.067 1 1 129 . 10 1 1 A 28 28 ALA HA H 28 4.812 4.326 0.486 1 1 133 . 10 1 1 A 28 28 ALA CB C 28 16.724 19.181 -2.457 1 1 134 . 10 1 1 A 28 28 ALA N N 28 128.420 124.804 3.616 1 1 135 . 10 1 1 A 29 29 PRO CA C 29 59.166 62.246 -3.080 1 1 136 . 10 1 1 A 29 29 PRO CB C 29 29.865 32.567 -2.702 1 1 139 . 10 1 1 A 30 30 LEU H H 30 8.204 8.188 0.016 1 1 140 . 10 1 1 A 30 30 LEU HA H 30 4.052 4.225 -0.173 1 1 150 . 10 1 1 A 30 30 LEU N N 30 121.970 123.498 -1.528 1 1 151 . 10 1 1 A 31 31 ASP H H 31 8.720 8.720 0.000 1 1 152 . 10 1 1 A 31 31 ASP HA H 31 4.772 4.942 -0.170 1 1 155 . 10 1 1 A 31 31 ASP CA C 31 50.115 54.107 -3.992 1 1 156 . 10 1 1 A 31 31 ASP N N 31 125.105 120.259 4.846 1 1 157 . 10 1 1 A 32 32 HIS CA C 32 55.083 54.944 0.139 1 1 158 . 10 1 1 A 32 32 HIS CB C 32 25.707 28.256 -2.549 1 1 159 . 10 1 1 A 33 33 LYS H H 33 8.589 9.400 -0.811 1 1 160 . 10 1 1 A 33 33 LYS HA H 33 4.112 4.392 -0.280 1 1 167 . 10 1 1 A 33 33 LYS CB C 33 29.218 33.806 -4.588 1 1 169 . 10 1 1 A 33 33 LYS N N 33 118.920 122.111 -3.191 1 1 170 . 10 1 1 A 34 34 ASP H H 34 7.420 7.326 0.094 1 1 171 . 10 1 1 A 34 34 ASP HA H 34 4.368 4.547 -0.179 1 1 174 . 10 1 1 A 34 34 ASP N N 34 120.940 119.748 1.192 1 1 175 . 10 1 1 A 35 35 LYS H H 35 8.266 8.399 -0.133 1 1 176 . 10 1 1 A 35 35 LYS HA H 35 4.169 4.276 -0.107 1 1 183 . 10 1 1 A 35 35 LYS N N 35 121.280 121.498 -0.218 1 1 184 . 10 1 1 A 36 36 GLY H H 36 8.716 7.828 0.888 1 1 185 . 10 1 1 A 36 36 GLY HA2 H 36 3.822 4.066 -0.244 1 1 186 . 10 1 1 A 36 36 GLY HA3 H 36 3.618 4.077 -0.459 1 1 187 . 10 1 1 A 36 36 GLY N N 36 111.002 107.392 3.610 1 1 188 . 10 1 1 A 37 37 LEU H H 37 8.032 8.422 -0.390 1 1 189 . 10 1 1 A 37 37 LEU HA H 37 4.406 4.165 0.241 1 1 198 . 10 1 1 A 37 37 LEU N N 37 127.683 122.814 4.869 1 1 199 . 10 1 1 A 38 38 LYS H H 38 9.190 8.847 0.343 1 1 200 . 10 1 1 A 38 38 LYS HA H 38 3.925 4.093 -0.168 1 1 205 . 10 1 1 A 38 38 LYS N N 38 132.634 125.436 7.198 1 1 206 . 10 1 1 A 39 39 SER H H 39 7.161 7.471 -0.310 1 1 207 . 10 1 1 A 39 39 SER HA H 39 5.097 4.614 0.483 1 1 210 . 10 1 1 A 39 39 SER CA C 39 54.451 56.927 -2.476 1 1 211 . 10 1 1 A 39 39 SER N N 39 110.262 109.262 1.000 1 1 212 . 10 1 1 A 40 40 LEU H H 40 8.142 9.426 -1.284 1 1 213 . 10 1 1 A 40 40 LEU HA H 40 4.481 4.912 -0.431 1 1 223 . 10 1 1 A 40 40 LEU N N 40 122.761 123.534 -0.773 1 1 224 . 10 1 1 A 41 41 THR H H 41 8.641 8.698 -0.057 1 1 225 . 10 1 1 A 41 41 THR HA H 41 4.141 4.424 -0.283 1 1 230 . 10 1 1 A 41 41 THR CA C 41 60.301 62.170 -1.869 1 1 231 . 10 1 1 A 41 41 THR CB C 41 65.862 69.901 -4.039 1 1 233 . 10 1 1 A 41 41 THR N N 41 124.142 120.854 3.288 1 1 234 . 10 1 1 A 42 42 LEU H H 42 8.586 8.633 -0.047 1 1 235 . 10 1 1 A 42 42 LEU HA H 42 4.337 4.832 -0.495 1 1 247 . 10 1 1 A 42 42 LEU N N 42 128.603 124.823 3.780 1 1 248 . 10 1 1 A 43 43 GLU H H 43 8.644 8.620 0.024 1 1 249 . 10 1 1 A 43 43 GLU HA H 43 4.663 4.391 0.272 1 1 253 . 10 1 1 A 43 43 GLU N N 43 124.180 123.869 0.311 1 1 254 . 10 1 1 A 44 44 ASP H H 44 10.243 8.684 1.559 1 1 255 . 10 1 1 A 44 44 ASP HA H 44 4.518 4.741 -0.223 1 1 258 . 10 1 1 A 44 44 ASP CA C 44 52.879 53.599 -0.720 1 1 259 . 10 1 1 A 44 44 ASP CB C 44 37.711 38.484 -0.773 1 1 260 . 10 1 1 A 44 44 ASP N N 44 124.177 119.396 4.781 1 1 261 . 10 1 1 A 45 45 SER H H 45 8.546 10.010 -1.464 1 1 262 . 10 1 1 A 45 45 SER HA H 45 3.850 4.197 -0.347 1 1 265 . 10 1 1 A 45 45 SER CA C 45 59.588 61.444 -1.856 1 1 266 . 10 1 1 A 45 45 SER CB C 45 61.660 62.861 -1.201 1 1 267 . 10 1 1 A 45 45 SER N N 45 116.191 116.481 -0.290 1 1 268 . 10 1 1 A 46 46 ILE H H 46 6.902 7.623 -0.721 1 1 269 . 10 1 1 A 46 46 ILE HA H 46 3.874 4.667 -0.793 1 1 279 . 10 1 1 A 46 46 ILE CA C 46 57.605 60.057 -2.452 1 1 280 . 10 1 1 A 46 46 ILE CB C 46 36.694 39.741 -3.047 1 1 283 . 10 1 1 A 46 46 ILE N N 46 116.189 119.275 -3.086 1 1 284 . 10 1 1 A 47 47 SER H H 47 7.804 8.470 -0.666 1 1 285 . 10 1 1 A 47 47 SER HA H 47 4.342 4.763 -0.421 1 1 288 . 10 1 1 A 47 47 SER CA C 47 55.995 56.525 -0.530 1 1 289 . 10 1 1 A 47 47 SER N N 47 118.738 116.971 1.767 1 1 290 . 10 1 1 A 48 48 GLN H H 48 8.522 8.724 -0.202 1 1 291 . 10 1 1 A 48 48 GLN HA H 48 3.939 4.105 -0.166 1 1 296 . 10 1 1 A 48 48 GLN CA C 48 55.111 58.319 -3.208 1 1 298 . 10 1 1 A 48 48 GLN N N 48 119.475 122.290 -2.815 1 1 299 . 10 1 1 A 49 49 ASN H H 49 8.437 8.197 0.240 1 1 300 . 10 1 1 A 49 49 ASN HA H 49 4.693 4.744 -0.051 1 1 305 . 10 1 1 A 49 49 ASN CA C 49 50.839 52.143 -1.304 1 1 306 . 10 1 1 A 49 49 ASN CB C 49 35.767 37.782 -2.015 1 1 307 . 10 1 1 A 49 49 ASN N N 49 117.233 114.945 2.288 1 1 309 . 10 1 1 A 50 50 GLY H H 50 7.952 8.429 -0.477 1 1 310 . 10 1 1 A 50 50 GLY HA2 H 50 4.518 4.142 0.376 1 1 311 . 10 1 1 A 50 50 GLY HA3 H 50 4.054 4.149 -0.095 1 1 312 . 10 1 1 A 50 50 GLY CA C 50 41.883 45.601 -3.718 1 1 313 . 10 1 1 A 50 50 GLY N N 50 108.751 106.969 1.782 1 1 314 . 10 1 1 A 51 51 THR H H 51 8.548 8.271 0.277 1 1 315 . 10 1 1 A 51 51 THR HA H 51 5.012 5.413 -0.401 1 1 320 . 10 1 1 A 51 51 THR CA C 51 57.026 60.088 -3.062 1 1 321 . 10 1 1 A 51 51 THR CB C 51 69.887 70.707 -0.820 1 1 323 . 10 1 1 A 51 51 THR N N 51 108.710 115.270 -6.560 1 1 324 . 10 1 1 A 52 52 LEU H H 52 9.110 8.803 0.307 1 1 325 . 10 1 1 A 52 52 LEU HA H 52 5.183 5.340 -0.157 1 1 333 . 10 1 1 A 52 52 LEU CA C 52 50.822 53.911 -3.089 1 1 335 . 10 1 1 A 52 52 LEU N N 52 124.606 122.645 1.961 1 1 336 . 10 1 1 A 53 53 THR H H 53 9.312 8.616 0.696 1 1 337 . 10 1 1 A 53 53 THR HA H 53 5.288 5.176 0.112 1 1 342 . 10 1 1 A 53 53 THR CA C 53 59.535 61.572 -2.037 1 1 343 . 10 1 1 A 53 53 THR CB C 53 66.838 71.231 -4.393 1 1 345 . 10 1 1 A 53 53 THR N N 53 125.445 115.519 9.926 1 1 346 . 10 1 1 A 54 54 LEU H H 54 8.992 8.797 0.195 1 1 347 . 10 1 1 A 54 54 LEU HA H 54 5.563 5.369 0.194 1 1 357 . 10 1 1 A 54 54 LEU N N 54 128.814 123.880 4.934 1 1 358 . 10 1 1 A 55 55 SER H H 55 9.017 8.943 0.074 1 1 359 . 10 1 1 A 55 55 SER HA H 55 5.476 5.157 0.319 1 1 362 . 10 1 1 A 55 55 SER CA C 55 53.944 56.459 -2.515 1 1 363 . 10 1 1 A 55 55 SER CB C 55 63.384 64.908 -1.524 1 1 364 . 10 1 1 A 55 55 SER N N 55 112.964 119.060 -6.096 1 1 365 . 10 1 1 A 56 56 ALA H H 56 8.324 9.670 -1.346 1 1 366 . 10 1 1 A 56 56 ALA HA H 56 4.605 4.692 -0.087 1 1 370 . 10 1 1 A 56 56 ALA CA C 56 50.743 50.160 0.583 1 1 371 . 10 1 1 A 56 56 ALA CB C 56 21.372 20.863 0.509 1 1 372 . 10 1 1 A 56 56 ALA N N 56 123.555 128.352 -4.797 1 1 373 . 10 1 1 A 57 57 GLN H H 57 9.080 8.590 0.490 1 1 374 . 10 1 1 A 57 57 GLN HA H 57 3.884 4.506 -0.622 1 1 381 . 10 1 1 A 57 57 GLN CA C 57 53.331 55.971 -2.640 1 1 382 . 10 1 1 A 57 57 GLN CB C 57 24.659 27.520 -2.861 1 1 384 . 10 1 1 A 57 57 GLN N N 57 116.815 115.107 1.708 1 1 386 . 10 1 1 A 58 58 GLY H H 58 8.527 7.977 0.550 1 1 387 . 10 1 1 A 58 58 GLY HA2 H 58 4.168 4.055 0.113 1 1 388 . 10 1 1 A 58 58 GLY HA3 H 58 3.608 4.059 -0.451 1 1 389 . 10 1 1 A 58 58 GLY CA C 58 42.856 45.588 -2.732 1 1 390 . 10 1 1 A 58 58 GLY N N 58 105.983 107.405 -1.422 1 1 391 . 10 1 1 A 59 59 ALA H H 59 8.203 7.670 0.533 1 1 392 . 10 1 1 A 59 59 ALA HA H 59 4.811 4.707 0.104 1 1 396 . 10 1 1 A 59 59 ALA CA C 59 47.662 51.442 -3.780 1 1 397 . 10 1 1 A 59 59 ALA CB C 59 20.147 22.485 -2.338 1 1 398 . 10 1 1 A 59 59 ALA N N 59 125.153 121.540 3.613 1 1 399 . 10 1 1 A 60 60 GLU H H 60 8.154 8.714 -0.560 1 1 400 . 10 1 1 A 60 60 GLU HA H 60 5.508 5.478 0.030 1 1 404 . 10 1 1 A 60 60 GLU CA C 60 52.179 53.988 -1.809 1 1 405 . 10 1 1 A 60 60 GLU CB C 60 30.203 34.424 -4.221 1 1 406 . 10 1 1 A 60 60 GLU N N 60 117.318 117.195 0.123 1 1 407 . 10 1 1 A 61 61 LYS H H 61 8.821 9.213 -0.392 1 1 408 . 10 1 1 A 61 61 LYS HA H 61 4.311 4.686 -0.375 1 1 413 . 10 1 1 A 61 61 LYS N N 61 123.743 120.670 3.073 1 1 414 . 10 1 1 A 62 62 THR H H 62 8.149 8.752 -0.603 1 1 415 . 10 1 1 A 62 62 THR HA H 62 4.928 4.421 0.507 1 1 420 . 10 1 1 A 62 62 THR CA C 62 59.427 62.803 -3.376 1 1 421 . 10 1 1 A 62 62 THR CB C 62 66.932 68.864 -1.932 1 1 422 . 10 1 1 A 62 62 THR N N 62 122.829 121.298 1.531 1 1 423 . 10 1 1 A 63 63 TYR H H 63 9.466 9.341 0.125 1 1 424 . 10 1 1 A 63 63 TYR HA H 63 4.606 5.205 -0.599 1 1 431 . 10 1 1 A 63 63 TYR CA C 63 54.508 56.696 -2.188 1 1 432 . 10 1 1 A 63 63 TYR N N 63 127.472 129.047 -1.575 1 1 433 . 10 1 1 A 64 64 GLY H H 64 9.253 8.744 0.509 1 1 434 . 10 1 1 A 64 64 GLY HA2 H 64 4.670 4.290 0.380 1 1 435 . 10 1 1 A 64 64 GLY HA3 H 64 3.619 4.296 -0.677 1 1 436 . 10 1 1 A 64 64 GLY CA C 64 39.885 45.025 -5.140 1 1 437 . 10 1 1 A 64 64 GLY N N 64 110.182 111.120 -0.938 1 1 438 . 10 1 1 A 65 65 ASN H H 65 8.616 8.534 0.082 1 1 439 . 10 1 1 A 65 65 ASN HA H 65 4.109 4.396 -0.287 1 1 444 . 10 1 1 A 65 65 ASN CA C 65 53.691 54.838 -1.147 1 1 445 . 10 1 1 A 65 65 ASN N N 65 117.778 118.989 -1.211 1 1 447 . 10 1 1 A 66 66 GLY H H 66 9.053 8.955 0.098 1 1 448 . 10 1 1 A 66 66 GLY HA2 H 66 4.344 3.897 0.447 1 1 449 . 10 1 1 A 66 66 GLY HA3 H 66 3.359 3.902 -0.543 1 1 450 . 10 1 1 A 66 66 GLY CA C 66 42.431 44.910 -2.479 1 1 451 . 10 1 1 A 66 66 GLY N N 66 115.232 114.385 0.847 1 1 452 . 10 1 1 A 67 67 ASP H H 67 8.120 8.663 -0.543 1 1 453 . 10 1 1 A 67 67 ASP HA H 67 4.844 4.310 0.534 1 1 456 . 10 1 1 A 67 67 ASP N N 67 122.593 121.394 1.199 1 1 457 . 10 1 1 A 68 68 SER H H 68 8.500 8.320 0.180 1 1 458 . 10 1 1 A 68 68 SER HA H 68 5.088 5.021 0.067 1 1 461 . 10 1 1 A 68 68 SER CA C 68 54.858 56.308 -1.450 1 1 462 . 10 1 1 A 68 68 SER CB C 68 62.114 66.723 -4.609 1 1 463 . 10 1 1 A 68 68 SER N N 68 113.557 116.710 -3.153 1 1 464 . 10 1 1 A 69 69 LEU H H 69 8.989 8.376 0.613 1 1 465 . 10 1 1 A 69 69 LEU HA H 69 4.570 4.947 -0.377 1 1 474 . 10 1 1 A 69 69 LEU N N 69 126.836 124.120 2.716 1 1 475 . 10 1 1 A 70 70 ASN H H 70 8.491 8.713 -0.222 1 1 476 . 10 1 1 A 70 70 ASN HA H 70 4.958 5.404 -0.446 1 1 479 . 10 1 1 A 70 70 ASN CB C 70 33.265 41.600 -8.335 1 1 480 . 10 1 1 A 70 70 ASN N N 70 126.343 124.256 2.087 1 1 481 . 10 1 1 A 71 71 THR H H 71 7.831 8.364 -0.533 1 1 482 . 10 1 1 A 71 71 THR HA H 71 3.759 4.753 -0.994 1 1 487 . 10 1 1 A 71 71 THR CA C 71 61.005 60.770 0.235 1 1 488 . 10 1 1 A 71 71 THR N N 71 114.742 112.762 1.980 1 1 489 . 10 1 1 A 72 72 GLY H H 72 8.880 8.051 0.829 1 1 490 . 10 1 1 A 72 72 GLY HA2 H 72 3.907 3.930 -0.023 1 1 491 . 10 1 1 A 72 72 GLY HA3 H 72 3.907 3.933 -0.026 1 1 492 . 10 1 1 A 72 72 GLY N N 72 114.976 111.277 3.699 1 1 493 . 10 1 1 A 73 73 LYS H H 73 6.604 7.733 -1.129 1 1 494 . 10 1 1 A 73 73 LYS HA H 73 4.160 4.283 -0.123 1 1 501 . 10 1 1 A 73 73 LYS N N 73 113.898 118.655 -4.757 1 1 502 . 10 1 1 A 74 74 LEU H H 74 7.422 8.045 -0.623 1 1 503 . 10 1 1 A 74 74 LEU HA H 74 4.358 4.924 -0.566 1 1 513 . 10 1 1 A 74 74 LEU N N 74 117.180 115.112 2.068 1 1 514 . 10 1 1 A 75 75 LYS H H 75 8.617 8.475 0.142 1 1 515 . 10 1 1 A 75 75 LYS HA H 75 4.079 4.547 -0.468 1 1 518 . 10 1 1 A 75 75 LYS N N 75 121.119 121.793 -0.674 1 1 519 . 10 1 1 A 76 76 ASN H H 76 8.154 8.179 -0.025 1 1 520 . 10 1 1 A 76 76 ASN HA H 76 3.935 4.995 -1.060 1 1 525 . 10 1 1 A 76 76 ASN CB C 76 35.772 38.852 -3.080 1 1 526 . 10 1 1 A 76 76 ASN N N 76 122.761 118.183 4.578 1 1 527 . 10 1 1 A 77 77 ASP H H 77 9.227 8.219 1.008 1 1 528 . 10 1 1 A 77 77 ASP HA H 77 3.787 5.650 -1.863 1 1 531 . 10 1 1 A 77 77 ASP CA C 77 52.584 53.191 -0.607 1 1 532 . 10 1 1 A 77 77 ASP N N 77 114.129 121.081 -6.952 1 1 533 . 10 1 1 A 78 78 LYS H H 78 6.579 7.683 -1.104 1 1 534 . 10 1 1 A 78 78 LYS HA H 78 4.572 4.652 -0.080 1 1 539 . 10 1 1 A 78 78 LYS CA C 78 51.072 55.533 -4.461 1 1 540 . 10 1 1 A 78 78 LYS CB C 78 33.783 32.754 1.029 1 1 541 . 10 1 1 A 78 78 LYS N N 78 114.135 122.544 -8.409 1 1 542 . 10 1 1 A 79 79 VAL H H 79 8.729 8.413 0.316 1 1 543 . 10 1 1 A 79 79 VAL HA H 79 4.402 3.122 1.280 1 1 551 . 10 1 1 A 79 79 VAL CA C 79 59.240 62.027 -2.787 1 1 553 . 10 1 1 A 79 79 VAL N N 79 123.191 127.500 -4.309 1 1 554 . 10 1 1 A 80 80 SER H H 80 9.542 8.579 0.963 1 1 555 . 10 1 1 A 80 80 SER HA H 80 4.636 5.079 -0.443 1 1 558 . 10 1 1 A 80 80 SER CA C 80 55.978 57.644 -1.666 1 1 559 . 10 1 1 A 80 80 SER N N 80 127.445 120.672 6.773 1 1 560 . 10 1 1 A 81 81 ARG H H 81 8.093 8.767 -0.674 1 1 561 . 10 1 1 A 81 81 ARG HA H 81 5.210 5.552 -0.342 1 1 569 . 10 1 1 A 81 81 ARG N N 81 123.743 122.845 0.898 1 1 571 . 10 1 1 A 82 82 PHE H H 82 9.312 9.253 0.059 1 1 572 . 10 1 1 A 82 82 PHE HA H 82 4.951 5.178 -0.227 1 1 577 . 10 1 1 A 82 82 PHE CA C 82 53.090 56.284 -3.194 1 1 578 . 10 1 1 A 82 82 PHE N N 82 119.529 116.200 3.329 1 1 579 . 10 1 1 A 83 83 ASP H H 83 9.122 8.561 0.561 1 1 580 . 10 1 1 A 83 83 ASP HA H 83 5.593 5.477 0.116 1 1 583 . 10 1 1 A 83 83 ASP N N 83 123.825 120.383 3.442 1 1 584 . 10 1 1 A 84 84 PHE H H 84 9.090 8.218 0.872 1 1 585 . 10 1 1 A 84 84 PHE HA H 84 6.410 6.170 0.240 1 1 592 . 10 1 1 A 84 84 PHE CA C 84 52.584 55.624 -3.040 1 1 593 . 10 1 1 A 84 84 PHE N N 84 118.862 120.707 -1.845 1 1 594 . 10 1 1 A 85 85 ILE H H 85 8.441 8.674 -0.233 1 1 595 . 10 1 1 A 85 85 ILE HA H 85 4.662 4.924 -0.262 1 1 605 . 10 1 1 A 85 85 ILE CB C 85 39.939 40.425 -0.486 1 1 608 . 10 1 1 A 85 85 ILE N N 85 118.049 119.705 -1.656 1 1 609 . 10 1 1 A 86 86 ARG H H 86 8.983 9.536 -0.553 1 1 610 . 10 1 1 A 86 86 ARG HA H 86 5.591 4.798 0.793 1 1 616 . 10 1 1 A 86 86 ARG N N 86 127.006 129.231 -2.225 1 1 618 . 10 1 1 A 87 87 GLN H H 87 8.643 9.009 -0.366 1 1 619 . 10 1 1 A 87 87 GLN HA H 87 5.630 5.184 0.446 1 1 626 . 10 1 1 A 87 87 GLN CA C 87 51.512 54.223 -2.711 1 1 627 . 10 1 1 A 87 87 GLN N N 87 124.142 125.332 -1.190 1 1 629 . 10 1 1 A 88 88 ILE H H 88 8.617 8.892 -0.275 1 1 630 . 10 1 1 A 88 88 ILE HA H 88 4.690 4.930 -0.240 1 1 637 . 10 1 1 A 88 88 ILE CA C 88 56.995 60.217 -3.222 1 1 638 . 10 1 1 A 88 88 ILE CB C 88 39.927 40.437 -0.510 1 1 641 . 10 1 1 A 88 88 ILE N N 88 116.353 125.183 -8.830 1 1 642 . 10 1 1 A 89 89 GLU H H 89 8.298 8.917 -0.619 1 1 643 . 10 1 1 A 89 89 GLU HA H 89 5.100 5.685 -0.585 1 1 646 . 10 1 1 A 89 89 GLU CA C 89 52.204 54.948 -2.744 1 1 647 . 10 1 1 A 89 89 GLU CB C 89 27.325 33.247 -5.922 1 1 648 . 10 1 1 A 89 89 GLU N N 89 124.458 129.349 -4.891 1 1 649 . 10 1 1 A 90 90 VAL H H 90 8.957 8.717 0.240 1 1 650 . 10 1 1 A 90 90 VAL HA H 90 4.169 4.674 -0.505 1 1 658 . 10 1 1 A 90 90 VAL CA C 90 58.664 59.798 -1.134 1 1 659 . 10 1 1 A 90 90 VAL CB C 90 31.861 34.287 -2.426 1 1 660 . 10 1 1 A 90 90 VAL N N 90 127.580 126.343 1.237 1 1 661 . 10 1 1 A 91 91 ASP H H 91 9.369 8.800 0.569 1 1 662 . 10 1 1 A 91 91 ASP HA H 91 4.287 4.427 -0.140 1 1 665 . 10 1 1 A 91 91 ASP CA C 91 52.389 55.113 -2.724 1 1 666 . 10 1 1 A 91 91 ASP CB C 91 36.409 40.469 -4.060 1 1 667 . 10 1 1 A 91 91 ASP N N 91 129.411 124.186 5.225 1 1 668 . 10 1 1 A 92 92 GLY H H 92 8.552 7.444 1.108 1 1 669 . 10 1 1 A 92 92 GLY HA2 H 92 4.090 4.131 -0.041 1 1 670 . 10 1 1 A 92 92 GLY HA3 H 92 3.618 4.132 -0.514 1 1 671 . 10 1 1 A 92 92 GLY CA C 92 42.836 45.674 -2.838 1 1 672 . 10 1 1 A 92 92 GLY N N 92 103.862 106.361 -2.499 1 1 673 . 10 1 1 A 93 93 GLN H H 93 7.808 7.707 0.101 1 1 674 . 10 1 1 A 93 93 GLN HA H 93 4.578 4.814 -0.236 1 1 679 . 10 1 1 A 93 93 GLN CA C 93 50.918 54.304 -3.386 1 1 680 . 10 1 1 A 93 93 GLN CB C 93 28.602 31.123 -2.521 1 1 682 . 10 1 1 A 93 93 GLN N N 93 120.412 118.888 1.524 1 1 683 . 10 1 1 A 94 94 LEU H H 94 8.414 8.475 -0.061 1 1 684 . 10 1 1 A 94 94 LEU HA H 94 4.704 4.248 0.456 1 1 693 . 10 1 1 A 94 94 LEU CB C 94 39.873 42.547 -2.674 1 1 696 . 10 1 1 A 94 94 LEU N N 94 125.061 122.687 2.374 1 1 697 . 10 1 1 A 95 95 ILE H H 95 9.181 8.609 0.572 1 1 698 . 10 1 1 A 95 95 ILE HA H 95 4.371 5.174 -0.803 1 1 708 . 10 1 1 A 95 95 ILE CA C 95 63.319 60.627 2.692 1 1 709 . 10 1 1 A 95 95 ILE CB C 95 37.407 39.310 -1.903 1 1 711 . 10 1 1 A 95 95 ILE N N 95 127.724 121.761 5.963 1 1 712 . 10 1 1 A 96 96 THR H H 96 8.730 7.381 1.349 1 1 713 . 10 1 1 A 96 96 THR HA H 96 4.411 4.413 -0.002 1 1 718 . 10 1 1 A 96 96 THR CA C 96 60.344 63.078 -2.734 1 1 719 . 10 1 1 A 96 96 THR CB C 96 59.719 69.551 -9.832 1 1 720 . 10 1 1 A 96 96 THR N N 96 124.240 118.550 5.690 1 1 721 . 10 1 1 A 97 97 LEU H H 97 8.790 8.785 0.005 1 1 722 . 10 1 1 A 97 97 LEU HA H 97 4.400 5.139 -0.739 1 1 732 . 10 1 1 A 97 97 LEU N N 97 126.147 124.254 1.893 1 1 733 . 10 1 1 A 98 98 GLU H H 98 7.596 10.050 -2.454 1 1 734 . 10 1 1 A 98 98 GLU HA H 98 5.102 5.073 0.029 1 1 739 . 10 1 1 A 98 98 GLU N N 98 116.937 124.279 -7.342 1 1 740 . 10 1 1 A 99 99 SER H H 99 8.906 8.684 0.222 1 1 741 . 10 1 1 A 99 99 SER HA H 99 4.504 5.356 -0.852 1 1 744 . 10 1 1 A 99 99 SER CA C 99 54.010 56.076 -2.066 1 1 745 . 10 1 1 A 99 99 SER CB C 99 63.876 66.001 -2.125 1 1 746 . 10 1 1 A 99 99 SER N N 99 117.823 115.251 2.572 1 1 747 . 10 1 1 A 100 100 GLY H H 100 7.250 7.891 -0.641 1 1 748 . 10 1 1 A 100 100 GLY HA2 H 100 4.872 4.039 0.833 1 1 749 . 10 1 1 A 100 100 GLY HA3 H 100 3.731 4.150 -0.419 1 1 750 . 10 1 1 A 100 100 GLY N N 100 109.436 107.701 1.735 1 1 751 . 10 1 1 A 101 101 GLU H H 101 9.661 9.196 0.465 1 1 752 . 10 1 1 A 101 101 GLU HA H 101 5.643 4.833 0.810 1 1 757 . 10 1 1 A 101 101 GLU CA C 101 52.584 54.796 -2.212 1 1 758 . 10 1 1 A 101 101 GLU CB C 101 31.750 33.037 -1.287 1 1 759 . 10 1 1 A 101 101 GLU N N 101 126.793 120.845 5.948 1 1 760 . 10 1 1 A 102 102 PHE H H 102 10.441 9.652 0.789 1 1 761 . 10 1 1 A 102 102 PHE HA H 102 5.248 4.938 0.310 1 1 768 . 10 1 1 A 102 102 PHE CA C 102 53.537 56.151 -2.614 1 1 769 . 10 1 1 A 102 102 PHE N N 102 131.837 125.562 6.275 1 1 770 . 10 1 1 A 103 103 GLN H H 103 9.135 8.944 0.191 1 1 771 . 10 1 1 A 103 103 GLN HA H 103 5.205 5.031 0.174 1 1 776 . 10 1 1 A 103 103 GLN CA C 103 50.925 54.547 -3.622 1 1 777 . 10 1 1 A 103 103 GLN N N 103 127.720 125.069 2.651 1 1 778 . 10 1 1 A 104 104 VAL H H 104 8.937 8.866 0.071 1 1 779 . 10 1 1 A 104 104 VAL HA H 104 4.780 4.511 0.269 1 1 787 . 10 1 1 A 104 104 VAL CA C 104 57.086 61.877 -4.791 1 1 789 . 10 1 1 A 104 104 VAL N N 104 120.097 123.541 -3.444 1 1 790 . 10 1 1 A 105 105 TYR H H 105 9.108 10.046 -0.938 1 1 791 . 10 1 1 A 105 105 TYR HA H 105 4.834 5.103 -0.269 1 1 798 . 10 1 1 A 105 105 TYR CA C 105 54.486 56.997 -2.511 1 1 799 . 10 1 1 A 105 105 TYR N N 105 128.426 125.940 2.486 1 1 800 . 10 1 1 A 106 106 LYS H H 106 5.945 8.748 -2.803 1 1 805 . 10 1 1 A 106 106 LYS N N 106 129.163 121.746 7.417 1 1 806 . 10 1 1 A 107 107 GLN H H 107 8.526 8.323 0.203 1 1 807 . 10 1 1 A 107 107 GLN HA H 107 5.160 5.406 -0.246 1 1 812 . 10 1 1 A 107 107 GLN CA C 107 52.584 54.048 -1.464 1 1 813 . 10 1 1 A 107 107 GLN CB C 107 26.175 29.549 -3.374 1 1 814 . 10 1 1 A 107 107 GLN N N 107 125.978 125.023 0.955 1 1 815 . 10 1 1 A 108 108 SER H H 108 8.621 8.633 -0.012 1 1 816 . 10 1 1 A 108 108 SER HA H 108 4.403 4.330 0.073 1 1 819 . 10 1 1 A 108 108 SER CA C 108 58.521 61.991 -3.470 1 1 820 . 10 1 1 A 108 108 SER CB C 108 60.737 63.089 -2.352 1 1 821 . 10 1 1 A 108 108 SER N N 108 117.542 113.622 3.920 1 1 822 . 10 1 1 A 109 109 HIS H H 109 10.381 9.109 1.272 1 1 823 . 10 1 1 A 109 109 HIS HA H 109 4.594 4.794 -0.200 1 1 828 . 10 1 1 A 109 109 HIS CA C 109 51.743 55.117 -3.374 1 1 829 . 10 1 1 A 109 109 HIS CB C 109 27.174 29.124 -1.950 1 1 830 . 10 1 1 A 109 109 HIS N N 109 118.449 114.228 4.221 1 1 831 . 10 1 1 A 110 110 SER H H 110 7.366 7.731 -0.365 1 1 832 . 10 1 1 A 110 110 SER HA H 110 4.870 4.690 0.180 1 1 835 . 10 1 1 A 110 110 SER CB C 110 62.986 65.803 -2.817 1 1 836 . 10 1 1 A 110 110 SER N N 110 113.397 113.449 -0.052 1 1 837 . 10 1 1 A 111 111 ALA H H 111 8.541 8.266 0.275 1 1 838 . 10 1 1 A 111 111 ALA HA H 111 4.826 5.147 -0.321 1 1 842 . 10 1 1 A 111 111 ALA CA C 111 49.015 51.746 -2.731 1 1 843 . 10 1 1 A 111 111 ALA CB C 111 20.256 23.032 -2.776 1 1 844 . 10 1 1 A 111 111 ALA N N 111 117.786 122.775 -4.989 1 1 845 . 10 1 1 A 112 112 LEU H H 112 8.529 9.030 -0.501 1 1 846 . 10 1 1 A 112 112 LEU HA H 112 5.680 5.237 0.443 1 1 855 . 10 1 1 A 112 112 LEU CA C 112 51.818 53.089 -1.271 1 1 856 . 10 1 1 A 112 112 LEU N N 112 116.345 118.520 -2.175 1 1 857 . 10 1 1 A 113 113 THR H H 113 8.758 8.752 0.006 1 1 858 . 10 1 1 A 113 113 THR HA H 113 5.563 5.083 0.480 1 1 863 . 10 1 1 A 113 113 THR CA C 113 54.458 59.465 -5.007 1 1 864 . 10 1 1 A 113 113 THR CB C 113 68.586 71.271 -2.685 1 1 866 . 10 1 1 A 113 113 THR N N 113 110.469 118.958 -8.489 1 1 867 . 10 1 1 A 114 114 ALA H H 114 8.829 9.829 -1.000 1 1 868 . 10 1 1 A 114 114 ALA HA H 114 4.466 4.983 -0.517 1 1 872 . 10 1 1 A 114 114 ALA CA C 114 48.886 51.674 -2.788 1 1 873 . 10 1 1 A 114 114 ALA CB C 114 21.583 22.857 -1.274 1 1 874 . 10 1 1 A 114 114 ALA N N 114 121.456 124.977 -3.521 1 1 875 . 10 1 1 A 115 115 LEU H H 115 8.407 8.434 -0.027 1 1 876 . 10 1 1 A 115 115 LEU HA H 115 4.814 4.440 0.374 1 1 886 . 10 1 1 A 115 115 LEU N N 115 119.223 123.197 -3.974 1 1 887 . 10 1 1 A 116 116 GLN H H 116 9.720 8.203 1.517 1 1 888 . 10 1 1 A 116 116 GLN HA H 116 5.312 4.441 0.871 1 1 893 . 10 1 1 A 116 116 GLN CA C 116 50.544 54.701 -4.157 1 1 894 . 10 1 1 A 116 116 GLN N N 116 127.827 121.902 5.925 1 1 895 . 10 1 1 A 117 117 THR H H 117 9.663 9.935 -0.272 1 1 896 . 10 1 1 A 117 117 THR HA H 117 4.198 4.486 -0.288 1 1 901 . 10 1 1 A 117 117 THR CA C 117 64.037 61.847 2.190 1 1 902 . 10 1 1 A 117 117 THR CB C 117 66.868 69.364 -2.496 1 1 904 . 10 1 1 A 117 117 THR N N 117 128.929 122.526 6.403 1 1 905 . 10 1 1 A 118 118 GLU H H 118 9.486 8.580 0.906 1 1 906 . 10 1 1 A 118 118 GLU HA H 118 4.885 4.602 0.283 1 1 911 . 10 1 1 A 118 118 GLU N N 118 123.497 123.393 0.104 1 1 912 . 10 1 1 A 119 119 GLN H H 119 8.076 7.892 0.184 1 1 913 . 10 1 1 A 119 119 GLN HA H 119 5.331 4.829 0.502 1 1 916 . 10 1 1 A 119 119 GLN CA C 119 51.858 54.350 -2.492 1 1 917 . 10 1 1 A 119 119 GLN N N 119 118.023 117.706 0.317 1 1 918 . 10 1 1 A 120 120 GLU H H 120 9.078 9.055 0.023 1 1 919 . 10 1 1 A 120 120 GLU HA H 120 5.071 4.898 0.173 1 1 924 . 10 1 1 A 120 120 GLU N N 120 118.433 121.273 -2.840 1 1 925 . 10 1 1 A 121 121 GLN H H 121 7.711 8.708 -0.997 1 1 926 . 10 1 1 A 121 121 GLN HA H 121 4.430 5.331 -0.901 1 1 933 . 10 1 1 A 121 121 GLN CA C 121 53.996 54.550 -0.554 1 1 934 . 10 1 1 A 121 121 GLN CB C 121 27.158 32.393 -5.235 1 1 936 . 10 1 1 A 121 121 GLN N N 121 122.412 120.281 2.131 1 1 938 . 10 1 1 A 122 122 ASP H H 122 8.675 9.757 -1.082 1 1 939 . 10 1 1 A 122 122 ASP HA H 122 4.632 5.093 -0.461 1 1 942 . 10 1 1 A 122 122 ASP CA C 122 48.797 51.160 -2.363 1 1 943 . 10 1 1 A 122 122 ASP CB C 122 39.852 42.209 -2.357 1 1 944 . 10 1 1 A 122 122 ASP N N 122 128.625 123.491 5.134 1 1 945 . 10 1 1 A 123 123 PRO CA C 123 61.579 65.601 -4.022 1 1 946 . 10 1 1 A 123 123 PRO CB C 123 29.597 31.500 -1.903 1 1 948 . 10 1 1 A 124 124 GLU H H 124 8.297 8.764 -0.467 1 1 949 . 10 1 1 A 124 124 GLU HA H 124 4.196 3.787 0.409 1 1 954 . 10 1 1 A 124 124 GLU CA C 124 53.025 59.520 -6.495 1 1 955 . 10 1 1 A 124 124 GLU CB C 124 27.927 29.536 -1.609 1 1 957 . 10 1 1 A 124 124 GLU N N 124 115.538 117.627 -2.089 1 1 958 . 10 1 1 A 125 125 HIS H H 125 7.419 8.105 -0.686 1 1 959 . 10 1 1 A 125 125 HIS HA H 125 4.833 4.969 -0.136 1 1 964 . 10 1 1 A 125 125 HIS CA C 125 51.886 54.148 -2.262 1 1 965 . 10 1 1 A 125 125 HIS CB C 125 26.387 29.286 -2.899 1 1 966 . 10 1 1 A 125 125 HIS N N 125 117.464 116.885 0.579 1 1 967 . 10 1 1 A 126 126 SER H H 126 8.441 8.379 0.062 1 1 968 . 10 1 1 A 126 126 SER HA H 126 4.261 4.846 -0.585 1 1 971 . 10 1 1 A 126 126 SER CA C 126 57.988 61.949 -3.961 1 1 972 . 10 1 1 A 126 126 SER N N 126 117.954 117.488 0.466 1 1 973 . 10 1 1 A 127 127 GLU H H 127 9.221 8.611 0.610 1 1 974 . 10 1 1 A 127 127 GLU HA H 127 4.366 4.249 0.117 1 1 979 . 10 1 1 A 127 127 GLU CA C 127 53.707 57.501 -3.794 1 1 980 . 10 1 1 A 127 127 GLU CB C 127 25.492 28.732 -3.240 1 1 981 . 10 1 1 A 127 127 GLU N N 127 120.404 117.305 3.099 1 1 982 . 10 1 1 A 128 128 LYS H H 128 8.262 9.343 -1.081 1 1 983 . 10 1 1 A 128 128 LYS HA H 128 4.661 4.398 0.263 1 1 990 . 10 1 1 A 128 128 LYS CA C 128 52.264 56.062 -3.798 1 1 991 . 10 1 1 A 128 128 LYS CB C 128 32.404 33.336 -0.932 1 1 994 . 10 1 1 A 128 128 LYS N N 128 122.166 120.829 1.337 1 1 995 . 10 1 1 A 129 129 MET H H 129 8.242 8.832 -0.590 1 1 996 . 10 1 1 A 129 129 MET HA H 129 5.012 6.158 -1.146 1 1 1001 . 10 1 1 A 129 129 MET CA C 129 50.958 53.599 -2.641 1 1 1003 . 10 1 1 A 129 129 MET N N 129 119.422 120.829 -1.407 1 1 1004 . 10 1 1 A 130 130 VAL H H 130 9.200 8.969 0.231 1 1 1005 . 10 1 1 A 130 130 VAL HA H 130 4.609 4.646 -0.037 1 1 1013 . 10 1 1 A 130 130 VAL CA C 130 56.296 60.658 -4.362 1 1 1014 . 10 1 1 A 130 130 VAL CB C 130 32.606 32.301 0.305 1 1 1015 . 10 1 1 A 130 130 VAL N N 130 118.290 122.796 -4.506 1 1 1016 . 10 1 1 A 131 131 ALA H H 131 8.368 8.615 -0.247 1 1 1017 . 10 1 1 A 131 131 ALA HA H 131 4.654 5.177 -0.523 1 1 1021 . 10 1 1 A 131 131 ALA CA C 131 49.739 50.549 -0.810 1 1 1022 . 10 1 1 A 131 131 ALA CB C 131 15.351 21.184 -5.833 1 1 1023 . 10 1 1 A 131 131 ALA N N 131 126.734 124.446 2.288 1 1 1024 . 10 1 1 A 132 132 LYS H H 132 7.732 8.981 -1.249 1 1 1025 . 10 1 1 A 132 132 LYS HA H 132 4.171 4.954 -0.783 1 1 1028 . 10 1 1 A 132 132 LYS N N 132 127.309 121.819 5.490 1 1 1029 . 10 1 1 A 133 133 ARG H H 133 8.193 8.738 -0.545 1 1 1030 . 10 1 1 A 133 133 ARG HA H 133 5.073 5.115 -0.042 1 1 1038 . 10 1 1 A 133 133 ARG N N 133 122.190 118.363 3.827 1 1 1040 . 10 1 1 A 134 134 ARG H H 134 7.539 9.087 -1.548 1 1 1041 . 10 1 1 A 134 134 ARG HA H 134 4.667 5.034 -0.367 1 1 1049 . 10 1 1 A 134 134 ARG CA C 134 52.584 54.648 -2.064 1 1 1050 . 10 1 1 A 134 134 ARG CB C 134 31.325 32.569 -1.244 1 1 1052 . 10 1 1 A 134 134 ARG N N 134 121.632 125.273 -3.641 1 1 1054 . 10 1 1 A 135 135 PHE H H 135 8.816 8.963 -0.147 1 1 1055 . 10 1 1 A 135 135 PHE HA H 135 5.680 5.703 -0.023 1 1 1062 . 10 1 1 A 135 135 PHE N N 135 125.107 125.829 -0.722 1 1 1063 . 10 1 1 A 136 136 ARG H H 136 7.741 9.189 -1.448 1 1 1064 . 10 1 1 A 136 136 ARG HA H 136 4.402 5.088 -0.686 1 1 1068 . 10 1 1 A 136 136 ARG N N 136 125.640 128.187 -2.547 1 1 1070 . 10 1 1 A 137 137 ILE H H 137 8.556 8.671 -0.115 1 1 1071 . 10 1 1 A 137 137 ILE HA H 137 3.912 5.065 -1.153 1 1 1076 . 10 1 1 A 137 137 ILE CA C 137 55.676 60.077 -4.401 1 1 1079 . 10 1 1 A 137 137 ILE N N 137 122.891 121.650 1.241 1 1 1080 . 10 1 1 A 138 138 GLY H H 138 8.676 8.456 0.220 1 1 1081 . 10 1 1 A 138 138 GLY HA2 H 138 3.740 4.211 -0.471 1 1 1082 . 10 1 1 A 138 138 GLY HA3 H 138 2.982 4.234 -1.252 1 1 1083 . 10 1 1 A 138 138 GLY CA C 138 41.908 45.139 -3.231 1 1 1084 . 10 1 1 A 138 138 GLY N N 138 117.058 115.220 1.838 1 1 1085 . 10 1 1 A 139 139 ASP H H 139 7.858 9.027 -1.169 1 1 1086 . 10 1 1 A 139 139 ASP HA H 139 4.753 5.425 -0.672 1 1 1089 . 10 1 1 A 139 139 ASP CA C 139 52.584 52.685 -0.101 1 1 1090 . 10 1 1 A 139 139 ASP CB C 139 43.062 44.195 -1.133 1 1 1091 . 10 1 1 A 139 139 ASP N N 139 124.516 125.345 -0.829 1 1 1092 . 10 1 1 A 140 140 ILE H H 140 8.354 9.108 -0.754 1 1 1093 . 10 1 1 A 140 140 ILE HA H 140 4.473 4.599 -0.126 1 1 1103 . 10 1 1 A 140 140 ILE CB C 140 36.173 38.755 -2.582 1 1 1105 . 10 1 1 A 140 140 ILE N N 140 120.679 122.715 -2.036 1 1 1106 . 10 1 1 A 141 141 ALA H H 141 8.708 8.283 0.425 1 1 1107 . 10 1 1 A 141 141 ALA HA H 141 4.862 4.082 0.780 1 1 1111 . 10 1 1 A 141 141 ALA CA C 141 47.968 52.102 -4.134 1 1 1112 . 10 1 1 A 141 141 ALA CB C 141 21.733 19.424 2.309 1 1 1113 . 10 1 1 A 141 141 ALA N N 141 130.144 130.865 -0.721 1 1 1114 . 10 1 1 A 142 142 GLY H H 142 7.888 8.496 -0.608 1 1 1115 . 10 1 1 A 142 142 GLY HA2 H 142 4.519 3.793 0.726 1 1 1116 . 10 1 1 A 142 142 GLY HA3 H 142 3.634 3.848 -0.214 1 1 1117 . 10 1 1 A 142 142 GLY N N 142 102.272 107.571 -5.299 1 1 1118 . 10 1 1 A 143 143 GLU H H 143 8.068 8.042 0.026 1 1 1119 . 10 1 1 A 143 143 GLU HA H 143 4.577 4.747 -0.170 1 1 1124 . 10 1 1 A 143 143 GLU N N 143 120.569 115.030 5.539 1 1 1125 . 10 1 1 A 144 144 HIS H H 144 8.478 7.372 1.106 1 1 1126 . 10 1 1 A 144 144 HIS HA H 144 4.968 4.757 0.211 1 1 1131 . 10 1 1 A 144 144 HIS N N 144 124.275 118.633 5.642 1 1 1132 . 10 1 1 A 145 145 THR H H 145 9.031 8.502 0.529 1 1 1133 . 10 1 1 A 145 145 THR HA H 145 4.025 5.241 -1.216 1 1 1138 . 10 1 1 A 145 145 THR CA C 145 61.247 60.347 0.900 1 1 1139 . 10 1 1 A 145 145 THR CB C 145 65.181 71.387 -6.206 1 1 1141 . 10 1 1 A 145 145 THR N N 145 125.828 116.259 9.569 1 1 1142 . 10 1 1 A 146 146 SER H H 146 9.077 8.605 0.472 1 1 1143 . 10 1 1 A 146 146 SER HA H 146 4.684 4.698 -0.014 1 1 1145 . 10 1 1 A 146 146 SER CA C 146 56.067 58.310 -2.243 1 1 1146 . 10 1 1 A 146 146 SER CB C 146 60.510 64.342 -3.832 1 1 1147 . 10 1 1 A 146 146 SER N N 146 124.154 117.025 7.129 1 1 1148 . 10 1 1 A 147 147 PHE H H 147 9.049 8.934 0.115 1 1 1149 . 10 1 1 A 147 147 PHE HA H 147 4.022 4.348 -0.326 1 1 1154 . 10 1 1 A 147 147 PHE N N 147 127.670 125.310 2.360 1 1 1155 . 10 1 1 A 148 148 ASP H H 148 8.504 8.382 0.122 1 1 1156 . 10 1 1 A 148 148 ASP HA H 148 4.422 4.502 -0.080 1 1 1158 . 10 1 1 A 148 148 ASP CA C 148 52.584 56.880 -4.296 1 1 1159 . 10 1 1 A 148 148 ASP CB C 148 37.800 41.357 -3.557 1 1 1160 . 10 1 1 A 148 148 ASP N N 148 114.377 120.731 -6.354 1 1 1161 . 10 1 1 A 149 149 LYS H H 149 7.380 7.947 -0.567 1 1 1162 . 10 1 1 A 149 149 LYS HA H 149 4.487 4.229 0.258 1 1 1171 . 10 1 1 A 149 149 LYS CA C 149 51.735 57.880 -6.145 1 1 1172 . 10 1 1 A 149 149 LYS CB C 149 30.162 32.179 -2.017 1 1 1175 . 10 1 1 A 149 149 LYS N N 149 119.137 117.046 2.091 1 1 1176 . 10 1 1 A 150 150 LEU H H 150 6.886 7.930 -1.044 1 1 1177 . 10 1 1 A 150 150 LEU HA H 150 3.996 4.665 -0.669 1 1 1186 . 10 1 1 A 150 150 LEU CA C 150 50.502 52.152 -1.650 1 1 1187 . 10 1 1 A 150 150 LEU N N 150 120.614 117.210 3.404 1 1 1188 . 10 1 1 A 151 151 PRO CB C 151 29.567 30.379 -0.812 1 1 1190 . 10 1 1 A 152 152 LYS H H 152 8.076 8.862 -0.786 1 1 1191 . 10 1 1 A 152 152 LYS HA H 152 4.346 4.496 -0.150 1 1 1195 . 10 1 1 A 152 152 LYS CA C 152 53.182 56.779 -3.597 1 1 1196 . 10 1 1 A 152 152 LYS CB C 152 31.487 34.696 -3.209 1 1 1198 . 10 1 1 A 152 152 LYS N N 152 118.133 120.822 -2.689 1 1 1199 . 10 1 1 A 153 153 ASP H H 153 7.982 7.636 0.346 1 1 1200 . 10 1 1 A 153 153 ASP HA H 153 4.402 0.993 3.409 1 1 1203 . 10 1 1 A 153 153 ASP CA C 153 52.584 51.647 0.937 1 1 1204 . 10 1 1 A 153 153 ASP CB C 153 37.762 40.373 -2.611 1 1 1205 . 10 1 1 A 153 153 ASP N N 153 115.735 113.202 2.533 1 1 1206 . 10 1 1 A 154 154 VAL H H 154 6.987 7.345 -0.358 1 1 1207 . 10 1 1 A 154 154 VAL HA H 154 4.406 4.244 0.162 1 1 1215 . 10 1 1 A 154 154 VAL CA C 154 58.408 61.862 -3.454 1 1 1216 . 10 1 1 A 154 154 VAL CB C 154 32.617 32.023 0.594 1 1 1217 . 10 1 1 A 154 154 VAL N N 154 116.266 120.813 -4.547 1 1 1218 . 10 1 1 A 155 155 MET H H 155 8.444 8.636 -0.192 1 1 1219 . 10 1 1 A 155 155 MET HA H 155 5.416 4.853 0.563 1 1 1224 . 10 1 1 A 155 155 MET CA C 155 51.183 54.900 -3.717 1 1 1226 . 10 1 1 A 155 155 MET N N 155 124.950 127.018 -2.068 1 1 1227 . 10 1 1 A 156 156 ALA H H 156 9.226 8.821 0.405 1 1 1228 . 10 1 1 A 156 156 ALA HA H 156 4.693 4.828 -0.135 1 1 1232 . 10 1 1 A 156 156 ALA CA C 156 48.379 50.685 -2.306 1 1 1233 . 10 1 1 A 156 156 ALA CB C 156 21.051 20.755 0.296 1 1 1234 . 10 1 1 A 156 156 ALA N N 156 129.938 125.313 4.625 1 1 1235 . 10 1 1 A 157 157 THR H H 157 8.554 8.569 -0.015 1 1 1236 . 10 1 1 A 157 157 THR HA H 157 4.839 4.629 0.210 1 1 1241 . 10 1 1 A 157 157 THR CA C 157 59.555 61.156 -1.601 1 1 1242 . 10 1 1 A 157 157 THR CB C 157 68.575 70.233 -1.658 1 1 1244 . 10 1 1 A 157 157 THR N N 157 118.815 118.626 0.189 1 1 1245 . 10 1 1 A 158 158 TYR H H 158 9.974 9.910 0.064 1 1 1246 . 10 1 1 A 158 158 TYR HA H 158 4.435 5.175 -0.740 1 1 1253 . 10 1 1 A 158 158 TYR N N 158 126.958 123.975 2.983 1 1 1254 . 10 1 1 A 159 159 ARG H H 159 8.909 8.755 0.154 1 1 1255 . 10 1 1 A 159 159 ARG HA H 159 5.444 5.366 0.078 1 1 1263 . 10 1 1 A 159 159 ARG CA C 159 51.933 54.601 -2.668 1 1 1264 . 10 1 1 A 159 159 ARG N N 159 121.721 118.962 2.759 1 1 1266 . 10 1 1 A 160 160 GLY H H 160 8.910 8.403 0.507 1 1 1267 . 10 1 1 A 160 160 GLY HA2 H 160 4.904 4.482 0.422 1 1 1268 . 10 1 1 A 160 160 GLY HA3 H 160 4.484 4.526 -0.042 1 1 1269 . 10 1 1 A 160 160 GLY N N 160 113.921 106.959 6.962 1 1 1270 . 10 1 1 A 161 161 THR H H 161 9.110 9.293 -0.183 1 1 1271 . 10 1 1 A 161 161 THR HA H 161 4.810 5.340 -0.530 1 1 1276 . 10 1 1 A 161 161 THR CA C 161 59.603 61.235 -1.632 1 1 1277 . 10 1 1 A 161 161 THR CB C 161 69.909 72.395 -2.486 1 1 1279 . 10 1 1 A 161 161 THR N N 161 126.813 115.973 10.840 1 1 1280 . 10 1 1 A 162 162 ALA H H 162 7.137 10.114 -2.977 1 1 1281 . 10 1 1 A 162 162 ALA HA H 162 5.361 5.184 0.177 1 1 1285 . 10 1 1 A 162 162 ALA CA C 162 46.573 50.778 -4.205 1 1 1286 . 10 1 1 A 162 162 ALA CB C 162 20.959 23.836 -2.877 1 1 1287 . 10 1 1 A 162 162 ALA N N 162 128.111 124.797 3.314 1 1 1288 . 10 1 1 A 163 163 PHE H H 163 8.587 9.412 -0.825 1 1 1289 . 10 1 1 A 163 163 PHE HA H 163 5.538 4.852 0.686 1 1 1296 . 10 1 1 A 163 163 PHE N N 163 117.349 116.023 1.326 1 1 1297 . 10 1 1 A 164 164 GLY H H 164 8.650 8.327 0.323 1 1 1298 . 10 1 1 A 164 164 GLY HA2 H 164 4.210 3.723 0.487 1 1 1299 . 10 1 1 A 164 164 GLY HA3 H 164 3.285 3.730 -0.445 1 1 1300 . 10 1 1 A 164 164 GLY CA C 164 40.377 45.376 -4.999 1 1 1301 . 10 1 1 A 164 164 GLY N N 164 108.839 111.555 -2.716 1 1 1302 . 10 1 1 A 165 165 SER H H 165 7.684 10.140 -2.456 1 1 1303 . 10 1 1 A 165 165 SER HA H 165 3.458 4.273 -0.815 1 1 1304 . 10 1 1 A 165 165 SER N N 165 116.037 119.595 -3.558 1 1 1305 . 10 1 1 A 166 166 ASP H H 166 9.718 8.675 1.043 1 1 1306 . 10 1 1 A 166 166 ASP HA H 166 4.281 4.495 -0.214 1 1 1309 . 10 1 1 A 166 166 ASP CA C 166 52.584 55.454 -2.870 1 1 1310 . 10 1 1 A 166 166 ASP N N 166 125.166 120.506 4.660 1 1 1311 . 10 1 1 A 167 167 ASP H H 167 7.655 8.266 -0.611 1 1 1312 . 10 1 1 A 167 167 ASP HA H 167 4.666 4.872 -0.206 1 1 1315 . 10 1 1 A 167 167 ASP CB C 167 38.948 43.376 -4.428 1 1 1316 . 10 1 1 A 167 167 ASP N N 167 117.491 120.662 -3.171 1 1 1317 . 10 1 1 A 168 168 ALA H H 168 8.585 8.345 0.240 1 1 1318 . 10 1 1 A 168 168 ALA HA H 168 5.012 4.881 0.131 1 1 1322 . 10 1 1 A 168 168 ALA CA C 168 47.485 50.890 -3.405 1 1 1323 . 10 1 1 A 168 168 ALA N N 168 128.834 123.682 5.152 1 1 1324 . 10 1 1 A 169 169 GLY H H 169 8.472 7.239 1.233 1 1 1325 . 10 1 1 A 169 169 GLY HA2 H 169 4.404 3.397 1.007 1 1 1326 . 10 1 1 A 169 169 GLY HA3 H 169 4.051 3.910 0.141 1 1 1327 . 10 1 1 A 169 169 GLY CA C 169 43.257 44.592 -1.335 1 1 1328 . 10 1 1 A 169 169 GLY N N 169 107.133 106.657 0.476 1 1 1329 . 10 1 1 A 170 170 GLY H H 170 7.229 8.350 -1.121 1 1 1330 . 10 1 1 A 170 170 GLY HA2 H 170 4.223 4.251 -0.028 1 1 1331 . 10 1 1 A 170 170 GLY HA3 H 170 3.781 4.274 -0.493 1 1 1332 . 10 1 1 A 170 170 GLY CA C 170 43.310 45.434 -2.124 1 1 1333 . 10 1 1 A 170 170 GLY N N 170 107.542 108.636 -1.094 1 1 1334 . 10 1 1 A 171 171 LYS H H 171 9.641 8.734 0.907 1 1 1335 . 10 1 1 A 171 171 LYS HA H 171 5.129 5.173 -0.044 1 1 1342 . 10 1 1 A 171 171 LYS CA C 171 51.355 55.562 -4.207 1 1 1343 . 10 1 1 A 171 171 LYS N N 171 124.322 121.164 3.158 1 1 1344 . 10 1 1 A 172 172 LEU H H 172 7.764 8.542 -0.778 1 1 1345 . 10 1 1 A 172 172 LEU HA H 172 4.973 5.652 -0.679 1 1 1353 . 10 1 1 A 172 172 LEU CA C 172 50.348 53.835 -3.487 1 1 1354 . 10 1 1 A 172 172 LEU N N 172 126.389 122.295 4.094 1 1 1355 . 10 1 1 A 173 173 THR H H 173 8.321 8.477 -0.156 1 1 1356 . 10 1 1 A 173 173 THR HA H 173 5.017 5.048 -0.031 1 1 1361 . 10 1 1 A 173 173 THR CA C 173 59.149 61.408 -2.259 1 1 1362 . 10 1 1 A 173 173 THR CB C 173 67.449 70.353 -2.904 1 1 1364 . 10 1 1 A 173 173 THR N N 173 123.553 115.754 7.799 1 1 1365 . 10 1 1 A 174 174 TYR H H 174 9.367 10.107 -0.740 1 1 1366 . 10 1 1 A 174 174 TYR HA H 174 4.660 5.200 -0.540 1 1 1373 . 10 1 1 A 174 174 TYR CB C 174 41.267 41.192 0.075 1 1 1374 . 10 1 1 A 174 174 TYR N N 174 129.583 125.804 3.779 1 1 1375 . 10 1 1 A 175 175 THR H H 175 8.529 9.641 -1.112 1 1 1376 . 10 1 1 A 175 175 THR HA H 175 5.388 4.947 0.441 1 1 1381 . 10 1 1 A 175 175 THR CA C 175 58.216 61.634 -3.418 1 1 1382 . 10 1 1 A 175 175 THR CB C 175 68.575 70.909 -2.334 1 1 1384 . 10 1 1 A 175 175 THR N N 175 125.967 115.261 10.706 1 1 1385 . 10 1 1 A 176 176 ILE H H 176 9.139 8.885 0.254 1 1 1386 . 10 1 1 A 176 176 ILE HA H 176 4.382 4.373 0.009 1 1 1395 . 10 1 1 A 176 176 ILE CA C 176 58.006 60.177 -2.171 1 1 1396 . 10 1 1 A 176 176 ILE CB C 176 38.881 39.472 -0.591 1 1 1400 . 10 1 1 A 176 176 ILE N N 176 123.715 127.067 -3.352 1 1 1401 . 10 1 1 A 177 177 ASP H H 177 8.501 8.512 -0.011 1 1 1402 . 10 1 1 A 177 177 ASP HA H 177 5.011 4.540 0.471 1 1 1405 . 10 1 1 A 177 177 ASP CA C 177 49.089 53.699 -4.610 1 1 1406 . 10 1 1 A 177 177 ASP CB C 177 39.282 40.840 -1.558 1 1 1407 . 10 1 1 A 177 177 ASP N N 177 125.978 128.570 -2.592 1 1 1408 . 10 1 1 A 178 178 PHE H H 178 8.913 8.421 0.492 1 1 1409 . 10 1 1 A 178 178 PHE HA H 178 3.993 4.711 -0.718 1 1 1414 . 10 1 1 A 178 178 PHE CB C 178 34.588 39.916 -5.328 1 1 1415 . 10 1 1 A 178 178 PHE N N 178 123.522 120.254 3.268 1 1 1416 . 10 1 1 A 179 179 ALA H H 179 8.487 9.435 -0.948 1 1 1417 . 10 1 1 A 179 179 ALA HA H 179 4.528 4.356 0.172 1 1 1421 . 10 1 1 A 179 179 ALA CA C 179 52.584 55.705 -3.121 1 1 1422 . 10 1 1 A 179 179 ALA CB C 179 15.666 18.664 -2.998 1 1 1423 . 10 1 1 A 179 179 ALA N N 179 124.061 123.893 0.168 1 1 1424 . 10 1 1 A 180 180 ALA H H 180 7.162 8.470 -1.308 1 1 1425 . 10 1 1 A 180 180 ALA HA H 180 4.313 4.329 -0.016 1 1 1429 . 10 1 1 A 180 180 ALA CA C 180 49.006 53.770 -4.764 1 1 1430 . 10 1 1 A 180 180 ALA CB C 180 16.933 18.668 -1.735 1 1 1431 . 10 1 1 A 180 180 ALA N N 180 119.710 120.026 -0.316 1 1 1432 . 10 1 1 A 181 181 LYS H H 181 8.092 9.549 -1.457 1 1 1433 . 10 1 1 A 181 181 LYS HA H 181 3.457 4.490 -1.033 1 1 1440 . 10 1 1 A 181 181 LYS CA C 181 54.783 57.385 -2.602 1 1 1441 . 10 1 1 A 181 181 LYS CB C 181 27.088 33.444 -6.356 1 1 1444 . 10 1 1 A 181 181 LYS N N 181 114.996 118.031 -3.035 1 1 1445 . 10 1 1 A 182 182 GLN H H 182 7.532 7.640 -0.108 1 1 1446 . 10 1 1 A 182 182 GLN HA H 182 5.304 4.729 0.575 1 1 1453 . 10 1 1 A 182 182 GLN CA C 182 51.473 54.751 -3.278 1 1 1454 . 10 1 1 A 182 182 GLN CB C 182 31.585 30.940 0.645 1 1 1455 . 10 1 1 A 182 182 GLN N N 182 115.064 113.770 1.294 1 1 1457 . 10 1 1 A 183 183 GLY H H 183 9.026 8.332 0.694 1 1 1458 . 10 1 1 A 183 183 GLY HA2 H 183 5.376 4.178 1.198 1 1 1459 . 10 1 1 A 183 183 GLY HA3 H 183 3.567 4.383 -0.816 1 1 1460 . 10 1 1 A 183 183 GLY CA C 183 42.361 44.615 -2.254 1 1 1461 . 10 1 1 A 183 183 GLY N N 183 111.505 106.565 4.940 1 1 1462 . 10 1 1 A 184 184 HIS H H 184 7.508 8.581 -1.073 1 1 1463 . 10 1 1 A 184 184 HIS HA H 184 4.304 5.415 -1.111 1 1 1467 . 10 1 1 A 184 184 HIS CA C 184 52.793 53.952 -1.159 1 1 1468 . 10 1 1 A 184 184 HIS CB C 184 27.906 32.792 -4.886 1 1 1469 . 10 1 1 A 184 184 HIS N N 184 111.297 118.931 -7.634 1 1 1470 . 10 1 1 A 185 185 GLY H H 185 9.160 7.829 1.331 1 1 1471 . 10 1 1 A 185 185 GLY HA2 H 185 4.464 3.634 0.830 1 1 1472 . 10 1 1 A 185 185 GLY HA3 H 185 4.117 3.952 0.165 1 1 1473 . 10 1 1 A 185 185 GLY CA C 185 44.212 45.829 -1.617 1 1 1474 . 10 1 1 A 185 185 GLY N N 185 107.398 105.497 1.901 1 1 1475 . 10 1 1 A 186 186 LYS H H 186 9.170 8.491 0.679 1 1 1476 . 10 1 1 A 186 186 LYS HA H 186 4.925 4.832 0.093 1 1 1481 . 10 1 1 A 186 186 LYS CB C 186 33.642 36.024 -2.382 1 1 1482 . 10 1 1 A 186 186 LYS N N 186 122.690 120.378 2.312 1 1 1483 . 10 1 1 A 187 187 ILE H H 187 8.444 8.979 -0.535 1 1 1484 . 10 1 1 A 187 187 ILE HA H 187 4.626 5.182 -0.556 1 1 1487 . 10 1 1 A 187 187 ILE N N 187 124.320 123.490 0.830 1 1 1488 . 10 1 1 A 188 188 GLU H H 188 8.590 9.409 -0.819 1 1 1489 . 10 1 1 A 188 188 GLU HA H 188 4.650 4.770 -0.120 1 1 1495 . 10 1 1 A 188 188 GLU N N 188 122.575 128.205 -5.630 1 1 1496 . 10 1 1 A 189 189 HIS H H 189 8.726 8.561 0.165 1 1 1497 . 10 1 1 A 189 189 HIS HA H 189 4.055 4.042 0.013 1 1 1501 . 10 1 1 A 189 189 HIS CA C 189 54.623 58.813 -4.190 1 1 1502 . 10 1 1 A 189 189 HIS CB C 189 24.997 29.765 -4.768 1 1 1503 . 10 1 1 A 189 189 HIS N N 189 111.381 123.488 -12.107 1 1 1504 . 10 1 1 A 190 190 LEU H H 190 9.715 7.439 2.276 1 1 1505 . 10 1 1 A 190 190 LEU HA H 190 4.379 4.522 -0.143 1 1 1515 . 10 1 1 A 190 190 LEU N N 190 124.648 116.286 8.362 1 1 1516 . 10 1 1 A 191 191 LYS H H 191 10.099 8.491 1.608 1 1 1517 . 10 1 1 A 191 191 LYS HA H 191 3.736 4.035 -0.299 1 1 1524 . 10 1 1 A 191 191 LYS CA C 191 55.815 59.127 -3.312 1 1 1525 . 10 1 1 A 191 191 LYS CB C 191 30.201 31.925 -1.724 1 1 1527 . 10 1 1 A 191 191 LYS N N 191 123.618 118.533 5.085 1 1 1528 . 10 1 1 A 192 192 SER H H 192 6.991 8.167 -1.176 1 1 1529 . 10 1 1 A 192 192 SER HA H 192 4.743 4.394 0.349 1 1 1532 . 10 1 1 A 192 192 SER CA C 192 51.974 57.220 -5.246 1 1 1533 . 10 1 1 A 192 192 SER CB C 192 60.005 62.971 -2.966 1 1 1534 . 10 1 1 A 192 192 SER N N 192 115.071 114.702 0.369 1 1 1535 . 10 1 1 A 193 193 PRO CB C 193 29.607 31.548 -1.941 1 1 1537 . 10 1 1 A 194 194 GLU H H 194 8.213 8.171 0.042 1 1 1538 . 10 1 1 A 194 194 GLU HA H 194 3.063 4.923 -1.860 1 1 1543 . 10 1 1 A 194 194 GLU CA C 194 54.185 56.330 -2.145 1 1 1545 . 10 1 1 A 194 194 GLU N N 194 114.055 117.312 -3.257 1 1 1546 . 10 1 1 A 195 195 LEU H H 195 7.082 7.737 -0.655 1 1 1547 . 10 1 1 A 195 195 LEU HA H 195 4.027 4.415 -0.388 1 1 1557 . 10 1 1 A 195 195 LEU CA C 195 51.361 53.949 -2.588 1 1 1558 . 10 1 1 A 195 195 LEU CB C 195 38.950 41.736 -2.786 1 1 1561 . 10 1 1 A 195 195 LEU N N 195 113.898 119.035 -5.137 1 1 1562 . 10 1 1 A 196 196 ASN H H 196 7.060 7.137 -0.077 1 1 1563 . 10 1 1 A 196 196 ASN HA H 196 4.638 4.781 -0.143 1 1 1567 . 10 1 1 A 196 196 ASN N N 196 119.196 116.892 2.304 1 1 1568 . 10 1 1 A 197 197 VAL H H 197 7.244 8.984 -1.740 1 1 1569 . 10 1 1 A 197 197 VAL HA H 197 4.540 4.595 -0.055 1 1 1577 . 10 1 1 A 197 197 VAL CA C 197 57.176 60.548 -3.372 1 1 1578 . 10 1 1 A 197 197 VAL N N 197 113.621 118.549 -4.928 1 1 1579 . 10 1 1 A 198 198 ASP H H 198 8.881 9.318 -0.437 1 1 1580 . 10 1 1 A 198 198 ASP HA H 198 4.894 4.758 0.136 1 1 1581 . 10 1 1 A 198 198 ASP N N 198 118.852 127.564 -8.712 1 1 1582 . 10 1 1 A 199 199 LEU H H 199 8.498 8.577 -0.079 1 1 1583 . 10 1 1 A 199 199 LEU HA H 199 4.317 4.724 -0.407 1 1 1591 . 10 1 1 A 199 199 LEU N N 199 124.078 127.153 -3.075 1 1 1592 . 10 1 1 A 200 200 ALA H H 200 8.386 9.156 -0.770 1 1 1593 . 10 1 1 A 200 200 ALA HA H 200 4.295 5.236 -0.941 1 1 1597 . 10 1 1 A 200 200 ALA CA C 200 50.044 50.555 -0.511 1 1 1598 . 10 1 1 A 200 200 ALA CB C 200 17.985 24.300 -6.315 1 1 1599 . 10 1 1 A 200 200 ALA N N 200 127.315 125.078 2.237 1 1 1600 . 10 1 1 A 201 201 VAL H H 201 8.007 8.734 -0.727 1 1 1601 . 10 1 1 A 201 201 VAL HA H 201 4.577 4.736 -0.159 1 1 1609 . 10 1 1 A 201 201 VAL CA C 201 60.004 60.533 -0.529 1 1 1610 . 10 1 1 A 201 201 VAL CB C 201 28.863 36.181 -7.318 1 1 1611 . 10 1 1 A 201 201 VAL N N 201 119.409 119.082 0.327 1 1 1612 . 10 1 1 A 202 202 ALA H H 202 8.789 9.485 -0.696 1 1 1613 . 10 1 1 A 202 202 ALA HA H 202 4.630 5.423 -0.793 1 1 1617 . 10 1 1 A 202 202 ALA CA C 202 48.200 50.043 -1.843 1 1 1618 . 10 1 1 A 202 202 ALA N N 202 131.745 126.405 5.340 1 1 1619 . 10 1 1 A 203 203 TYR H H 203 8.522 9.004 -0.482 1 1 1620 . 10 1 1 A 203 203 TYR HA H 203 5.391 5.303 0.088 1 1 1627 . 10 1 1 A 203 203 TYR CA C 203 54.648 57.132 -2.484 1 1 1628 . 10 1 1 A 203 203 TYR CB C 203 37.315 39.545 -2.230 1 1 1629 . 10 1 1 A 203 203 TYR N N 203 117.786 124.959 -7.173 1 1 1630 . 10 1 1 A 204 204 ILE H H 204 8.209 8.269 -0.060 1 1 1631 . 10 1 1 A 204 204 ILE HA H 204 4.393 4.665 -0.272 1 1 1641 . 10 1 1 A 204 204 ILE CB C 204 36.807 40.430 -3.623 1 1 1644 . 10 1 1 A 204 204 ILE N N 204 120.602 127.966 -7.364 1 1 1645 . 10 1 1 A 205 205 LYS H H 205 9.340 8.717 0.623 1 1 1646 . 10 1 1 A 205 205 LYS HA H 205 4.756 4.308 0.448 1 1 1651 . 10 1 1 A 205 205 LYS CA C 205 50.844 60.282 -9.438 1 1 1652 . 10 1 1 A 205 205 LYS N N 205 127.960 123.104 4.856 1 1 1653 . 10 1 1 A 207 207 ASP H H 207 8.436 8.675 -0.239 1 1 1654 . 10 1 1 A 207 207 ASP HA H 207 4.692 4.432 0.260 1 1 1657 . 10 1 1 A 207 207 ASP CA C 207 48.789 54.509 -5.720 1 1 1658 . 10 1 1 A 207 207 ASP CB C 207 38.377 40.338 -1.961 1 1 1659 . 10 1 1 A 207 207 ASP N N 207 123.098 125.168 -2.070 1 1 1660 . 10 1 1 A 208 208 GLU H H 208 8.880 7.721 1.159 1 1 1661 . 10 1 1 A 208 208 GLU HA H 208 3.994 4.204 -0.210 1 1 1666 . 10 1 1 A 208 208 GLU CA C 208 56.123 58.414 -2.291 1 1 1667 . 10 1 1 A 208 208 GLU CB C 208 25.794 30.541 -4.747 1 1 1669 . 10 1 1 A 208 208 GLU N N 208 119.042 121.011 -1.969 1 1 1670 . 10 1 1 A 209 209 LYS H H 209 7.681 7.823 -0.142 1 1 1671 . 10 1 1 A 209 209 LYS HA H 209 4.141 4.452 -0.311 1 1 1680 . 10 1 1 A 209 209 LYS N N 209 119.252 115.522 3.730 1 1 1681 . 10 1 1 A 210 210 HIS H H 210 8.177 7.697 0.480 1 1 1682 . 10 1 1 A 210 210 HIS HA H 210 3.825 4.734 -0.909 1 1 1687 . 10 1 1 A 210 210 HIS CA C 210 54.205 55.178 -0.973 1 1 1688 . 10 1 1 A 210 210 HIS CB C 210 23.439 31.154 -7.715 1 1 1689 . 10 1 1 A 210 210 HIS N N 210 112.758 113.283 -0.525 1 1 1690 . 10 1 1 A 211 211 HIS H H 211 8.758 6.789 1.969 1 1 1691 . 10 1 1 A 211 211 HIS HA H 211 5.041 5.950 -0.909 1 1 1695 . 10 1 1 A 211 211 HIS CA C 211 50.450 53.209 -2.759 1 1 1696 . 10 1 1 A 211 211 HIS CB C 211 25.703 32.469 -6.766 1 1 1697 . 10 1 1 A 211 211 HIS N N 211 119.552 114.703 4.849 1 1 1698 . 10 1 1 A 212 212 ALA H H 212 8.556 8.249 0.307 1 1 1699 . 10 1 1 A 212 212 ALA HA H 212 4.712 4.065 0.647 1 1 1703 . 10 1 1 A 212 212 ALA CA C 212 49.886 52.079 -2.193 1 1 1704 . 10 1 1 A 212 212 ALA CB C 212 18.860 18.622 0.238 1 1 1705 . 10 1 1 A 212 212 ALA N N 212 123.780 121.621 2.159 1 1 1706 . 10 1 1 A 213 213 VAL H H 213 9.338 8.238 1.100 1 1 1707 . 10 1 1 A 213 213 VAL HA H 213 5.074 4.801 0.273 1 1 1715 . 10 1 1 A 213 213 VAL CA C 213 57.486 59.150 -1.664 1 1 1716 . 10 1 1 A 213 213 VAL CB C 213 33.938 34.054 -0.116 1 1 1717 . 10 1 1 A 213 213 VAL N N 213 124.742 116.428 8.314 1 1 1718 . 10 1 1 A 214 214 ILE H H 214 8.962 8.529 0.433 1 1 1719 . 10 1 1 A 214 214 ILE HA H 214 4.434 5.083 -0.649 1 1 1726 . 10 1 1 A 214 214 ILE N N 214 122.881 123.145 -0.264 1 1 1727 . 10 1 1 A 215 215 SER H H 215 8.558 8.681 -0.123 1 1 1728 . 10 1 1 A 215 215 SER HA H 215 5.001 5.557 -0.556 1 1 1731 . 10 1 1 A 215 215 SER CA C 215 53.230 56.700 -3.470 1 1 1732 . 10 1 1 A 215 215 SER CB C 215 62.077 66.166 -4.089 1 1 1733 . 10 1 1 A 215 215 SER N N 215 122.891 121.199 1.692 1 1 1734 . 10 1 1 A 216 216 GLY H H 216 7.282 9.020 -1.738 1 1 1735 . 10 1 1 A 216 216 GLY HA2 H 216 4.515 4.377 0.138 1 1 1736 . 10 1 1 A 216 216 GLY HA3 H 216 3.473 4.406 -0.933 1 1 1737 . 10 1 1 A 216 216 GLY CA C 216 42.816 46.243 -3.427 1 1 1738 . 10 1 1 A 216 216 GLY N N 216 110.899 113.005 -2.106 1 1 1739 . 10 1 1 A 217 217 SER H H 217 8.673 8.682 -0.009 1 1 1740 . 10 1 1 A 217 217 SER HA H 217 5.127 5.506 -0.379 1 1 1743 . 10 1 1 A 217 217 SER CA C 217 56.266 57.450 -1.184 1 1 1744 . 10 1 1 A 217 217 SER N N 217 117.164 116.764 0.400 1 1 1745 . 10 1 1 A 218 218 VAL H H 218 7.451 9.440 -1.989 1 1 1746 . 10 1 1 A 218 218 VAL HA H 218 5.128 5.157 -0.029 1 1 1754 . 10 1 1 A 218 218 VAL CA C 218 56.637 60.013 -3.376 1 1 1755 . 10 1 1 A 218 218 VAL N N 218 117.826 120.773 -2.947 1 1 1756 . 10 1 1 A 219 219 LEU H H 219 9.022 9.537 -0.515 1 1 1757 . 10 1 1 A 219 219 LEU HA H 219 5.387 4.839 0.548 1 1 1767 . 10 1 1 A 219 219 LEU CA C 219 50.450 53.932 -3.482 1 1 1768 . 10 1 1 A 219 219 LEU N N 219 124.820 127.513 -2.693 1 1 1769 . 10 1 1 A 220 220 TYR H H 220 8.816 8.922 -0.106 1 1 1770 . 10 1 1 A 220 220 TYR HA H 220 4.834 4.919 -0.085 1 1 1777 . 10 1 1 A 220 220 TYR N N 220 121.249 124.828 -3.579 1 1 1778 . 10 1 1 A 221 221 ASN H H 221 9.191 8.710 0.481 1 1 1779 . 10 1 1 A 221 221 ASN HA H 221 4.048 4.273 -0.225 1 1 1784 . 10 1 1 A 221 221 ASN CA C 221 51.647 55.690 -4.043 1 1 1785 . 10 1 1 A 221 221 ASN CB C 221 36.640 38.281 -1.641 1 1 1786 . 10 1 1 A 221 221 ASN N N 221 129.865 123.600 6.265 1 1 1788 . 10 1 1 A 222 222 GLN H H 222 8.468 6.686 1.782 1 1 1789 . 10 1 1 A 222 222 GLN HA H 222 3.671 3.992 -0.321 1 1 1794 . 10 1 1 A 222 222 GLN CA C 222 55.075 57.705 -2.630 1 1 1795 . 10 1 1 A 222 222 GLN CB C 222 24.663 28.994 -4.331 1 1 1797 . 10 1 1 A 222 222 GLN N N 222 108.367 117.014 -8.647 1 1 1798 . 10 1 1 A 223 223 ASP H H 223 7.797 7.651 0.146 1 1 1799 . 10 1 1 A 223 223 ASP HA H 223 4.986 4.871 0.115 1 1 1802 . 10 1 1 A 223 223 ASP N N 223 120.842 113.561 7.281 1 1 1803 . 10 1 1 A 224 224 GLU H H 224 8.731 7.843 0.888 1 1 1804 . 10 1 1 A 224 224 GLU HA H 224 4.690 4.675 0.015 1 1 1809 . 10 1 1 A 224 224 GLU CA C 224 54.703 56.401 -1.698 1 1 1810 . 10 1 1 A 224 224 GLU CB C 224 26.357 31.252 -4.895 1 1 1812 . 10 1 1 A 224 224 GLU N N 224 124.249 120.476 3.773 1 1 1813 . 10 1 1 A 225 225 LYS H H 225 8.730 8.362 0.368 1 1 1814 . 10 1 1 A 225 225 LYS HA H 225 4.754 4.887 -0.133 1 1 1822 . 10 1 1 A 225 225 LYS N N 225 126.784 123.406 3.378 1 1 1823 . 10 1 1 A 226 226 GLY H H 226 7.683 9.268 -1.585 1 1 1824 . 10 1 1 A 226 226 GLY HA2 H 226 5.567 4.274 1.293 1 1 1825 . 10 1 1 A 226 226 GLY HA3 H 226 3.819 4.323 -0.504 1 1 1826 . 10 1 1 A 226 226 GLY CA C 226 42.264 44.273 -2.009 1 1 1827 . 10 1 1 A 226 226 GLY N N 226 107.140 111.491 -4.351 1 1 1828 . 10 1 1 A 227 227 SER H H 227 8.672 10.148 -1.476 1 1 1829 . 10 1 1 A 227 227 SER HA H 227 5.564 5.624 -0.060 1 1 1832 . 10 1 1 A 227 227 SER CA C 227 54.373 56.982 -2.609 1 1 1833 . 10 1 1 A 227 227 SER CB C 227 63.963 66.752 -2.789 1 1 1834 . 10 1 1 A 227 227 SER N N 227 117.767 115.979 1.788 1 1 1835 . 10 1 1 A 228 228 TYR H H 228 9.073 8.472 0.601 1 1 1836 . 10 1 1 A 228 228 TYR HA H 228 5.519 5.049 0.470 1 1 1843 . 10 1 1 A 228 228 TYR N N 228 118.324 121.526 -3.202 1 1 1844 . 10 1 1 A 229 229 SER H H 229 8.929 8.421 0.508 1 1 1845 . 10 1 1 A 229 229 SER HA H 229 5.209 5.689 -0.480 1 1 1848 . 10 1 1 A 229 229 SER CA C 229 54.131 56.952 -2.821 1 1 1849 . 10 1 1 A 229 229 SER N N 229 116.118 117.269 -1.151 1 1 1850 . 10 1 1 A 230 230 LEU H H 230 9.372 9.720 -0.348 1 1 1851 . 10 1 1 A 230 230 LEU HA H 230 4.803 4.983 -0.180 1 1 1863 . 10 1 1 A 230 230 LEU N N 230 124.803 124.488 0.315 1 1 1864 . 10 1 1 A 231 231 GLY H H 231 9.080 8.331 0.749 1 1 1865 . 10 1 1 A 231 231 GLY HA2 H 231 4.776 4.330 0.446 1 1 1866 . 10 1 1 A 231 231 GLY HA3 H 231 3.528 4.381 -0.853 1 1 1867 . 10 1 1 A 231 231 GLY CA C 231 41.468 44.437 -2.969 1 1 1868 . 10 1 1 A 231 231 GLY N N 231 109.611 108.074 1.537 1 1 1869 . 10 1 1 A 232 232 ILE H H 232 6.849 8.947 -2.098 1 1 1870 . 10 1 1 A 232 232 ILE HA H 232 4.742 4.870 -0.128 1 1 1878 . 10 1 1 A 232 232 ILE N N 232 120.566 123.808 -3.242 1 1 1879 . 10 1 1 A 233 233 PHE H H 233 9.569 7.822 1.747 1 1 1880 . 10 1 1 A 233 233 PHE HA H 233 4.979 5.919 -0.940 1 1 1885 . 10 1 1 A 233 233 PHE N N 233 129.256 122.879 6.377 1 1 1886 . 10 1 1 A 234 234 GLY H H 234 8.734 9.101 -0.367 1 1 1887 . 10 1 1 A 234 234 GLY HA2 H 234 4.488 4.341 0.147 1 1 1888 . 10 1 1 A 234 234 GLY HA3 H 234 3.327 4.344 -1.017 1 1 1889 . 10 1 1 A 234 234 GLY CA C 234 40.377 45.608 -5.231 1 1 1890 . 10 1 1 A 234 234 GLY N N 234 105.294 108.670 -3.376 1 1 1891 . 10 1 1 A 235 235 GLU H H 235 9.198 8.320 0.878 1 1 1892 . 10 1 1 A 235 235 GLU HA H 235 4.111 4.053 0.058 1 1 1897 . 10 1 1 A 235 235 GLU CA C 235 56.466 59.282 -2.816 1 1 1898 . 10 1 1 A 235 235 GLU CB C 235 26.256 29.806 -3.550 1 1 1900 . 10 1 1 A 235 235 GLU N N 235 125.813 121.096 4.717 1 1 1901 . 10 1 1 A 236 236 LYS H H 236 8.147 7.761 0.386 1 1 1902 . 10 1 1 A 236 236 LYS HA H 236 4.373 4.497 -0.124 1 1 1905 . 10 1 1 A 236 236 LYS N N 236 117.810 119.184 -1.374 1 1 1906 . 10 1 1 A 237 237 ALA H H 237 7.685 7.640 0.045 1 1 1907 . 10 1 1 A 237 237 ALA HA H 237 3.902 4.535 -0.633 1 1 1911 . 10 1 1 A 237 237 ALA CA C 237 49.762 51.981 -2.219 1 1 1912 . 10 1 1 A 237 237 ALA CB C 237 14.720 19.270 -4.550 1 1 1913 . 10 1 1 A 237 237 ALA N N 237 118.704 122.816 -4.112 1 1 1914 . 10 1 1 A 238 238 GLN H H 238 9.312 8.603 0.709 1 1 1915 . 10 1 1 A 238 238 GLN HA H 238 4.049 4.687 -0.638 1 1 1920 . 10 1 1 A 238 238 GLN N N 238 118.059 122.613 -4.554 1 1 1921 . 10 1 1 A 239 239 GLU H H 239 8.785 10.117 -1.332 1 1 1922 . 10 1 1 A 239 239 GLU HA H 239 5.531 4.970 0.561 1 1 1927 . 10 1 1 A 239 239 GLU N N 239 116.914 121.582 -4.668 1 1 1928 . 10 1 1 A 240 240 VAL H H 240 8.501 9.377 -0.876 1 1 1929 . 10 1 1 A 240 240 VAL HA H 240 5.655 4.112 1.543 1 1 1937 . 10 1 1 A 240 240 VAL CA C 240 55.582 59.679 -4.097 1 1 1940 . 10 1 1 A 240 240 VAL N N 240 110.588 121.446 -10.858 1 1 1941 . 10 1 1 A 241 241 ALA H H 241 8.463 8.623 -0.160 1 1 1942 . 10 1 1 A 241 241 ALA HA H 241 5.014 5.303 -0.289 1 1 1946 . 10 1 1 A 241 241 ALA CA C 241 49.361 51.175 -1.814 1 1 1947 . 10 1 1 A 241 241 ALA CB C 241 18.196 23.381 -5.185 1 1 1948 . 10 1 1 A 241 241 ALA N N 241 121.125 129.444 -8.319 1 1 1949 . 10 1 1 A 242 242 GLY H H 242 9.421 8.348 1.073 1 1 1950 . 10 1 1 A 242 242 GLY HA2 H 242 5.161 4.277 0.884 1 1 1951 . 10 1 1 A 242 242 GLY HA3 H 242 4.076 4.290 -0.214 1 1 1952 . 10 1 1 A 242 242 GLY N N 242 112.036 107.792 4.244 1 1 1953 . 10 1 1 A 243 243 SER H H 243 8.929 8.204 0.725 1 1 1954 . 10 1 1 A 243 243 SER HA H 243 5.331 5.142 0.189 1 1 1957 . 10 1 1 A 243 243 SER N N 243 116.113 115.407 0.706 1 1 1958 . 10 1 1 A 244 244 ALA H H 244 9.218 8.277 0.941 1 1 1959 . 10 1 1 A 244 244 ALA HA H 244 5.221 4.685 0.536 1 1 1963 . 10 1 1 A 244 244 ALA CA C 244 47.883 50.805 -2.922 1 1 1964 . 10 1 1 A 244 244 ALA N N 244 120.635 121.401 -0.766 1 1 1965 . 10 1 1 A 245 245 GLU H H 245 9.194 8.187 1.007 1 1 1966 . 10 1 1 A 245 245 GLU HA H 245 4.869 5.165 -0.296 1 1 1971 . 10 1 1 A 245 245 GLU N N 245 123.487 118.067 5.420 1 1 1972 . 10 1 1 A 246 246 VAL H H 246 8.531 9.226 -0.695 1 1 1973 . 10 1 1 A 246 246 VAL HA H 246 4.518 4.627 -0.109 1 1 1981 . 10 1 1 A 246 246 VAL CA C 246 58.286 61.355 -3.069 1 1 1982 . 10 1 1 A 246 246 VAL N N 246 123.347 122.347 1.000 1 1 1983 . 10 1 1 A 247 247 GLU H H 247 9.132 8.650 0.482 1 1 1984 . 10 1 1 A 247 247 GLU HA H 247 4.368 4.750 -0.382 1 1 1989 . 10 1 1 A 247 247 GLU CB C 247 26.744 32.709 -5.965 1 1 1990 . 10 1 1 A 247 247 GLU N N 247 129.243 127.800 1.443 1 1 1991 . 10 1 1 A 248 248 THR H H 248 7.827 8.098 -0.271 1 1 1992 . 10 1 1 A 248 248 THR HA H 248 4.749 4.516 0.233 1 1 1997 . 10 1 1 A 248 248 THR CA C 248 56.859 63.621 -6.762 1 1 1998 . 10 1 1 A 248 248 THR CB C 248 69.171 69.035 0.136 1 1 2000 . 10 1 1 A 248 248 THR N N 248 114.228 119.873 -5.645 1 1 2001 . 10 1 1 A 249 249 ALA H H 249 9.148 8.073 1.075 1 1 2002 . 10 1 1 A 249 249 ALA HA H 249 4.174 4.468 -0.294 1 1 2006 . 10 1 1 A 249 249 ALA CA C 249 51.970 51.818 0.152 1 1 2007 . 10 1 1 A 249 249 ALA CB C 249 15.797 20.366 -4.569 1 1 2008 . 10 1 1 A 249 249 ALA N N 249 123.341 125.098 -1.757 1 1 2009 . 10 1 1 A 250 250 ASN H H 250 7.974 7.813 0.161 1 1 2010 . 10 1 1 A 250 250 ASN HA H 250 4.953 4.877 0.076 1 1 2015 . 10 1 1 A 250 250 ASN CA C 250 49.198 52.431 -3.233 1 1 2016 . 10 1 1 A 250 250 ASN CB C 250 35.976 38.962 -2.986 1 1 2017 . 10 1 1 A 250 250 ASN N N 250 113.358 114.082 -0.724 1 1 2019 . 10 1 1 A 251 251 GLY H H 251 7.510 7.570 -0.060 1 1 2020 . 10 1 1 A 251 251 GLY HA2 H 251 4.492 4.090 0.402 1 1 2021 . 10 1 1 A 251 251 GLY HA3 H 251 3.853 4.193 -0.340 1 1 2022 . 10 1 1 A 251 251 GLY CA C 251 41.435 45.820 -4.385 1 1 2023 . 10 1 1 A 251 251 GLY N N 251 108.692 107.848 0.844 1 1 2024 . 10 1 1 A 252 252 ILE H H 252 8.465 8.734 -0.269 1 1 2025 . 10 1 1 A 252 252 ILE HA H 252 4.521 4.168 0.353 1 1 2035 . 10 1 1 A 252 252 ILE CB C 252 35.653 38.121 -2.468 1 1 2039 . 10 1 1 A 252 252 ILE N N 252 122.043 126.254 -4.211 1 1 2040 . 10 1 1 A 253 253 HIS H H 253 9.311 9.757 -0.446 1 1 2041 . 10 1 1 A 253 253 HIS HA H 253 4.861 5.292 -0.431 1 1 2046 . 10 1 1 A 253 253 HIS N N 253 126.617 124.723 1.894 1 1 2047 . 10 1 1 A 254 254 HIS H H 254 8.820 8.875 -0.055 1 1 2048 . 10 1 1 A 254 254 HIS HA H 254 5.305 5.332 -0.027 1 1 2051 . 10 1 1 A 254 254 HIS CA C 254 52.781 54.125 -1.344 1 1 2052 . 10 1 1 A 254 254 HIS N N 254 122.665 120.904 1.761 1 1 2053 . 10 1 1 A 255 255 ILE H H 255 9.047 8.683 0.364 1 1 2054 . 10 1 1 A 255 255 ILE HA H 255 4.651 4.610 0.041 1 1 2061 . 10 1 1 A 255 255 ILE N N 255 123.958 125.056 -1.098 1 1 2062 . 10 1 1 A 256 256 GLY H H 256 9.339 9.684 -0.345 1 1 2063 . 10 1 1 A 256 256 GLY HA2 H 256 3.816 3.575 0.241 1 1 2064 . 10 1 1 A 256 256 GLY HA3 H 256 2.267 3.697 -1.430 1 1 2065 . 10 1 1 A 256 256 GLY N N 256 115.022 112.447 2.575 1 1 2066 . 10 1 1 A 257 257 LEU H H 257 7.890 9.162 -1.272 1 1 2067 . 10 1 1 A 257 257 LEU HA H 257 4.853 5.029 -0.176 1 1 2077 . 10 1 1 A 257 257 LEU N N 257 121.441 122.798 -1.357 1 1 2078 . 10 1 1 A 258 258 ALA H H 258 7.982 9.226 -1.244 1 1 2079 . 10 1 1 A 258 258 ALA HA H 258 4.668 4.972 -0.304 1 1 2083 . 10 1 1 A 258 258 ALA CA C 258 49.678 51.564 -1.886 1 1 2084 . 10 1 1 A 258 258 ALA CB C 258 19.561 20.771 -1.210 1 1 2085 . 10 1 1 A 258 258 ALA N N 258 123.234 123.014 0.220 1 1 2086 . 10 1 1 A 259 259 ALA H H 259 9.117 9.184 -0.067 1 1 2087 . 10 1 1 A 259 259 ALA HA H 259 4.790 5.157 -0.367 1 1 2091 . 10 1 1 A 259 259 ALA N N 259 123.901 124.306 -0.405 1 1 2092 . 10 1 1 A 260 260 LYS H H 260 8.452 8.432 0.020 1 1 2093 . 10 1 1 A 260 260 LYS HA H 260 5.914 4.934 0.980 1 1 2098 . 10 1 1 A 260 260 LYS CA C 260 51.818 54.442 -2.624 1 1 2099 . 10 1 1 A 260 260 LYS N N 260 116.464 117.162 -0.698 1 1 1 . 11 1 1 A 9 9 SER H H 9 8.293 8.811 -0.518 1 1 2 . 11 1 1 A 9 9 SER HA H 9 4.432 4.692 -0.260 1 1 3 . 11 1 1 A 9 9 SER N N 9 116.407 115.485 0.922 1 1 4 . 11 1 1 A 10 10 GLY H H 10 8.472 8.087 0.385 1 1 5 . 11 1 1 A 10 10 GLY N N 10 111.611 108.053 3.558 1 1 6 . 11 1 1 A 14 14 VAL H H 14 8.009 8.491 -0.482 1 1 7 . 11 1 1 A 14 14 VAL HA H 14 4.128 4.149 -0.021 1 1 15 . 11 1 1 A 14 14 VAL CA C 14 59.473 63.066 -3.593 1 1 16 . 11 1 1 A 14 14 VAL CB C 14 30.127 32.555 -2.428 1 1 17 . 11 1 1 A 14 14 VAL N N 14 119.846 120.925 -1.079 1 1 18 . 11 1 1 A 15 15 THR H H 15 8.152 8.947 -0.795 1 1 19 . 11 1 1 A 15 15 THR HA H 15 4.346 4.460 -0.114 1 1 24 . 11 1 1 A 15 15 THR N N 15 118.509 119.964 -1.455 1 1 25 . 11 1 1 A 16 16 ALA H H 16 8.207 7.534 0.673 1 1 26 . 11 1 1 A 16 16 ALA HA H 16 4.319 4.379 -0.060 1 1 30 . 11 1 1 A 16 16 ALA CA C 16 49.835 51.873 -2.038 1 1 31 . 11 1 1 A 16 16 ALA CB C 16 16.714 19.275 -2.561 1 1 32 . 11 1 1 A 16 16 ALA N N 16 126.935 119.696 7.239 1 1 33 . 11 1 1 A 17 17 ASP H H 17 8.269 8.619 -0.350 1 1 34 . 11 1 1 A 17 17 ASP HA H 17 4.581 4.749 -0.168 1 1 37 . 11 1 1 A 17 17 ASP CA C 17 51.643 53.065 -1.422 1 1 38 . 11 1 1 A 17 17 ASP CB C 17 38.257 40.803 -2.546 1 1 39 . 11 1 1 A 17 17 ASP N N 17 120.379 118.768 1.611 1 1 40 . 11 1 1 A 18 18 ILE H H 18 7.979 7.618 0.361 1 1 41 . 11 1 1 A 18 18 ILE HA H 18 4.178 4.121 0.057 1 1 48 . 11 1 1 A 18 18 ILE CA C 18 58.737 63.382 -4.645 1 1 49 . 11 1 1 A 18 18 ILE CB C 18 36.077 38.190 -2.113 1 1 53 . 11 1 1 A 18 18 ILE N N 18 121.171 121.684 -0.513 1 1 54 . 11 1 1 A 19 19 GLY H H 19 8.410 8.455 -0.045 1 1 55 . 11 1 1 A 19 19 GLY HA2 H 19 4.023 4.106 -0.083 1 1 56 . 11 1 1 A 19 19 GLY HA3 H 19 4.023 4.108 -0.085 1 1 57 . 11 1 1 A 19 19 GLY N N 19 112.246 108.784 3.462 1 1 58 . 11 1 1 A 20 20 THR H H 20 8.005 8.731 -0.726 1 1 59 . 11 1 1 A 20 20 THR HA H 20 4.463 4.058 0.405 1 1 64 . 11 1 1 A 20 20 THR CB C 20 66.723 68.887 -2.164 1 1 66 . 11 1 1 A 20 20 THR N N 20 112.239 114.230 -1.991 1 1 67 . 11 1 1 A 21 21 GLY H H 21 8.500 8.393 0.107 1 1 68 . 11 1 1 A 21 21 GLY HA2 H 21 4.099 3.777 0.322 1 1 69 . 11 1 1 A 21 21 GLY HA3 H 21 3.872 3.777 0.095 1 1 70 . 11 1 1 A 21 21 GLY N N 21 111.048 112.499 -1.451 1 1 71 . 11 1 1 A 22 22 LEU H H 22 7.427 7.577 -0.150 1 1 72 . 11 1 1 A 22 22 LEU HA H 22 3.884 4.010 -0.126 1 1 84 . 11 1 1 A 22 22 LEU N N 22 118.837 120.257 -1.420 1 1 85 . 11 1 1 A 23 23 ALA H H 23 7.896 8.025 -0.129 1 1 86 . 11 1 1 A 23 23 ALA HA H 23 4.023 4.111 -0.088 1 1 90 . 11 1 1 A 23 23 ALA CA C 23 52.584 54.245 -1.661 1 1 91 . 11 1 1 A 23 23 ALA CB C 23 15.470 18.492 -3.022 1 1 92 . 11 1 1 A 23 23 ALA N N 23 119.194 121.650 -2.456 1 1 93 . 11 1 1 A 24 24 ASP H H 24 8.265 7.831 0.434 1 1 94 . 11 1 1 A 24 24 ASP HA H 24 4.337 4.511 -0.174 1 1 97 . 11 1 1 A 24 24 ASP CB C 24 37.029 41.114 -4.085 1 1 98 . 11 1 1 A 24 24 ASP N N 24 119.035 116.918 2.117 1 1 99 . 11 1 1 A 25 25 ALA H H 25 8.211 8.548 -0.337 1 1 100 . 11 1 1 A 25 25 ALA HA H 25 4.064 4.135 -0.071 1 1 104 . 11 1 1 A 25 25 ALA CA C 25 53.278 53.754 -0.476 1 1 105 . 11 1 1 A 25 25 ALA CB C 25 15.760 18.604 -2.844 1 1 106 . 11 1 1 A 25 25 ALA N N 25 122.434 121.189 1.245 1 1 107 . 11 1 1 A 26 26 LEU H H 26 7.334 7.470 -0.136 1 1 108 . 11 1 1 A 26 26 LEU HA H 26 4.351 4.257 0.094 1 1 117 . 11 1 1 A 26 26 LEU N N 26 114.238 114.939 -0.701 1 1 118 . 11 1 1 A 27 27 THR H H 27 7.708 7.266 0.442 1 1 119 . 11 1 1 A 27 27 THR HA H 27 4.492 4.309 0.183 1 1 124 . 11 1 1 A 27 27 THR CA C 27 59.438 62.978 -3.540 1 1 125 . 11 1 1 A 27 27 THR CB C 27 68.796 69.182 -0.386 1 1 127 . 11 1 1 A 27 27 THR N N 27 106.430 111.597 -5.167 1 1 128 . 11 1 1 A 28 28 ALA H H 28 8.906 7.747 1.159 1 1 129 . 11 1 1 A 28 28 ALA HA H 28 4.812 4.598 0.214 1 1 133 . 11 1 1 A 28 28 ALA CB C 28 16.724 19.697 -2.973 1 1 134 . 11 1 1 A 28 28 ALA N N 28 128.420 123.699 4.721 1 1 135 . 11 1 1 A 29 29 PRO CA C 29 59.166 62.285 -3.119 1 1 136 . 11 1 1 A 29 29 PRO CB C 29 29.865 32.700 -2.835 1 1 139 . 11 1 1 A 30 30 LEU H H 30 8.204 8.324 -0.120 1 1 140 . 11 1 1 A 30 30 LEU HA H 30 4.052 4.127 -0.075 1 1 150 . 11 1 1 A 30 30 LEU N N 30 121.970 122.586 -0.616 1 1 151 . 11 1 1 A 31 31 ASP H H 31 8.720 8.784 -0.064 1 1 152 . 11 1 1 A 31 31 ASP HA H 31 4.772 4.908 -0.136 1 1 155 . 11 1 1 A 31 31 ASP CA C 31 50.115 54.077 -3.962 1 1 156 . 11 1 1 A 31 31 ASP N N 31 125.105 126.928 -1.823 1 1 157 . 11 1 1 A 32 32 HIS CA C 32 55.083 58.360 -3.277 1 1 158 . 11 1 1 A 32 32 HIS CB C 32 25.707 29.179 -3.472 1 1 159 . 11 1 1 A 33 33 LYS H H 33 8.589 7.774 0.815 1 1 160 . 11 1 1 A 33 33 LYS HA H 33 4.112 4.212 -0.100 1 1 167 . 11 1 1 A 33 33 LYS CB C 33 29.218 32.201 -2.983 1 1 169 . 11 1 1 A 33 33 LYS N N 33 118.920 116.881 2.039 1 1 170 . 11 1 1 A 34 34 ASP H H 34 7.420 7.319 0.101 1 1 171 . 11 1 1 A 34 34 ASP HA H 34 4.368 4.654 -0.286 1 1 174 . 11 1 1 A 34 34 ASP N N 34 120.940 119.672 1.268 1 1 175 . 11 1 1 A 35 35 LYS H H 35 8.266 8.887 -0.621 1 1 176 . 11 1 1 A 35 35 LYS HA H 35 4.169 4.029 0.140 1 1 183 . 11 1 1 A 35 35 LYS N N 35 121.280 121.556 -0.276 1 1 184 . 11 1 1 A 36 36 GLY H H 36 8.716 7.851 0.865 1 1 185 . 11 1 1 A 36 36 GLY HA2 H 36 3.822 4.062 -0.240 1 1 186 . 11 1 1 A 36 36 GLY HA3 H 36 3.618 4.064 -0.446 1 1 187 . 11 1 1 A 36 36 GLY N N 36 111.002 106.598 4.404 1 1 188 . 11 1 1 A 37 37 LEU H H 37 8.032 7.860 0.172 1 1 189 . 11 1 1 A 37 37 LEU HA H 37 4.406 4.594 -0.188 1 1 198 . 11 1 1 A 37 37 LEU N N 37 127.683 119.111 8.572 1 1 199 . 11 1 1 A 38 38 LYS H H 38 9.190 8.832 0.358 1 1 200 . 11 1 1 A 38 38 LYS HA H 38 3.925 4.524 -0.599 1 1 205 . 11 1 1 A 38 38 LYS N N 38 132.634 119.048 13.586 1 1 206 . 11 1 1 A 39 39 SER H H 39 7.161 7.621 -0.460 1 1 207 . 11 1 1 A 39 39 SER HA H 39 5.097 4.560 0.537 1 1 210 . 11 1 1 A 39 39 SER CA C 39 54.451 57.601 -3.150 1 1 211 . 11 1 1 A 39 39 SER N N 39 110.262 111.537 -1.275 1 1 212 . 11 1 1 A 40 40 LEU H H 40 8.142 9.595 -1.453 1 1 213 . 11 1 1 A 40 40 LEU HA H 40 4.481 4.881 -0.400 1 1 223 . 11 1 1 A 40 40 LEU N N 40 122.761 121.792 0.969 1 1 224 . 11 1 1 A 41 41 THR H H 41 8.641 8.771 -0.130 1 1 225 . 11 1 1 A 41 41 THR HA H 41 4.141 4.807 -0.666 1 1 230 . 11 1 1 A 41 41 THR CA C 41 60.301 62.056 -1.755 1 1 231 . 11 1 1 A 41 41 THR CB C 41 65.862 70.204 -4.342 1 1 233 . 11 1 1 A 41 41 THR N N 41 124.142 120.764 3.378 1 1 234 . 11 1 1 A 42 42 LEU H H 42 8.586 8.343 0.243 1 1 235 . 11 1 1 A 42 42 LEU HA H 42 4.337 4.444 -0.107 1 1 247 . 11 1 1 A 42 42 LEU N N 42 128.603 125.927 2.676 1 1 248 . 11 1 1 A 43 43 GLU H H 43 8.644 8.535 0.109 1 1 249 . 11 1 1 A 43 43 GLU HA H 43 4.663 4.252 0.411 1 1 253 . 11 1 1 A 43 43 GLU N N 43 124.180 118.585 5.595 1 1 254 . 11 1 1 A 44 44 ASP H H 44 10.243 8.782 1.461 1 1 255 . 11 1 1 A 44 44 ASP HA H 44 4.518 4.590 -0.072 1 1 258 . 11 1 1 A 44 44 ASP CA C 44 52.879 53.585 -0.706 1 1 259 . 11 1 1 A 44 44 ASP CB C 44 37.711 40.131 -2.420 1 1 260 . 11 1 1 A 44 44 ASP N N 44 124.177 119.084 5.093 1 1 261 . 11 1 1 A 45 45 SER H H 45 8.546 8.204 0.342 1 1 262 . 11 1 1 A 45 45 SER HA H 45 3.850 4.161 -0.311 1 1 265 . 11 1 1 A 45 45 SER CA C 45 59.588 62.285 -2.697 1 1 266 . 11 1 1 A 45 45 SER CB C 45 61.660 62.910 -1.250 1 1 267 . 11 1 1 A 45 45 SER N N 45 116.191 115.284 0.907 1 1 268 . 11 1 1 A 46 46 ILE H H 46 6.902 7.709 -0.807 1 1 269 . 11 1 1 A 46 46 ILE HA H 46 3.874 4.690 -0.816 1 1 279 . 11 1 1 A 46 46 ILE CA C 46 57.605 60.073 -2.468 1 1 280 . 11 1 1 A 46 46 ILE CB C 46 36.694 39.803 -3.109 1 1 283 . 11 1 1 A 46 46 ILE N N 46 116.189 120.113 -3.924 1 1 284 . 11 1 1 A 47 47 SER H H 47 7.804 8.428 -0.624 1 1 285 . 11 1 1 A 47 47 SER HA H 47 4.342 4.768 -0.426 1 1 288 . 11 1 1 A 47 47 SER CA C 47 55.995 56.352 -0.357 1 1 289 . 11 1 1 A 47 47 SER N N 47 118.738 116.684 2.054 1 1 290 . 11 1 1 A 48 48 GLN H H 48 8.522 8.662 -0.140 1 1 291 . 11 1 1 A 48 48 GLN HA H 48 3.939 4.102 -0.163 1 1 296 . 11 1 1 A 48 48 GLN CA C 48 55.111 58.447 -3.336 1 1 298 . 11 1 1 A 48 48 GLN N N 48 119.475 122.345 -2.870 1 1 299 . 11 1 1 A 49 49 ASN H H 49 8.437 8.153 0.284 1 1 300 . 11 1 1 A 49 49 ASN HA H 49 4.693 4.728 -0.035 1 1 305 . 11 1 1 A 49 49 ASN CA C 49 50.839 52.157 -1.318 1 1 306 . 11 1 1 A 49 49 ASN CB C 49 35.767 38.087 -2.320 1 1 307 . 11 1 1 A 49 49 ASN N N 49 117.233 113.983 3.250 1 1 309 . 11 1 1 A 50 50 GLY H H 50 7.952 7.375 0.577 1 1 310 . 11 1 1 A 50 50 GLY HA2 H 50 4.518 4.115 0.403 1 1 311 . 11 1 1 A 50 50 GLY HA3 H 50 4.054 4.125 -0.071 1 1 312 . 11 1 1 A 50 50 GLY CA C 50 41.883 45.480 -3.597 1 1 313 . 11 1 1 A 50 50 GLY N N 50 108.751 107.858 0.893 1 1 314 . 11 1 1 A 51 51 THR H H 51 8.548 8.595 -0.047 1 1 315 . 11 1 1 A 51 51 THR HA H 51 5.012 5.396 -0.384 1 1 320 . 11 1 1 A 51 51 THR CA C 51 57.026 59.910 -2.884 1 1 321 . 11 1 1 A 51 51 THR CB C 51 69.887 70.701 -0.814 1 1 323 . 11 1 1 A 51 51 THR N N 51 108.710 116.487 -7.777 1 1 324 . 11 1 1 A 52 52 LEU H H 52 9.110 8.662 0.448 1 1 325 . 11 1 1 A 52 52 LEU HA H 52 5.183 4.982 0.201 1 1 333 . 11 1 1 A 52 52 LEU CA C 52 50.822 53.934 -3.112 1 1 335 . 11 1 1 A 52 52 LEU N N 52 124.606 122.456 2.150 1 1 336 . 11 1 1 A 53 53 THR H H 53 9.312 8.590 0.722 1 1 337 . 11 1 1 A 53 53 THR HA H 53 5.288 5.193 0.095 1 1 342 . 11 1 1 A 53 53 THR CA C 53 59.535 61.112 -1.577 1 1 343 . 11 1 1 A 53 53 THR CB C 53 66.838 72.258 -5.420 1 1 345 . 11 1 1 A 53 53 THR N N 53 125.445 115.223 10.222 1 1 346 . 11 1 1 A 54 54 LEU H H 54 8.992 8.589 0.403 1 1 347 . 11 1 1 A 54 54 LEU HA H 54 5.563 5.963 -0.400 1 1 357 . 11 1 1 A 54 54 LEU N N 54 128.814 119.610 9.204 1 1 358 . 11 1 1 A 55 55 SER H H 55 9.017 9.368 -0.351 1 1 359 . 11 1 1 A 55 55 SER HA H 55 5.476 5.271 0.205 1 1 362 . 11 1 1 A 55 55 SER CA C 55 53.944 56.228 -2.284 1 1 363 . 11 1 1 A 55 55 SER CB C 55 63.384 65.722 -2.338 1 1 364 . 11 1 1 A 55 55 SER N N 55 112.964 117.959 -4.995 1 1 365 . 11 1 1 A 56 56 ALA H H 56 8.324 10.192 -1.868 1 1 366 . 11 1 1 A 56 56 ALA HA H 56 4.605 4.722 -0.117 1 1 370 . 11 1 1 A 56 56 ALA CA C 56 50.743 49.899 0.844 1 1 371 . 11 1 1 A 56 56 ALA CB C 56 21.372 21.197 0.175 1 1 372 . 11 1 1 A 56 56 ALA N N 56 123.555 126.301 -2.746 1 1 373 . 11 1 1 A 57 57 GLN H H 57 9.080 8.608 0.472 1 1 374 . 11 1 1 A 57 57 GLN HA H 57 3.884 4.427 -0.543 1 1 381 . 11 1 1 A 57 57 GLN CA C 57 53.331 55.204 -1.873 1 1 382 . 11 1 1 A 57 57 GLN CB C 57 24.659 27.713 -3.054 1 1 384 . 11 1 1 A 57 57 GLN N N 57 116.815 118.306 -1.491 1 1 386 . 11 1 1 A 58 58 GLY H H 58 8.527 7.935 0.592 1 1 387 . 11 1 1 A 58 58 GLY HA2 H 58 4.168 4.041 0.127 1 1 388 . 11 1 1 A 58 58 GLY HA3 H 58 3.608 4.044 -0.436 1 1 389 . 11 1 1 A 58 58 GLY CA C 58 42.856 45.573 -2.717 1 1 390 . 11 1 1 A 58 58 GLY N N 58 105.983 107.274 -1.291 1 1 391 . 11 1 1 A 59 59 ALA H H 59 8.203 7.691 0.512 1 1 392 . 11 1 1 A 59 59 ALA HA H 59 4.811 4.596 0.215 1 1 396 . 11 1 1 A 59 59 ALA CA C 59 47.662 51.424 -3.762 1 1 397 . 11 1 1 A 59 59 ALA CB C 59 20.147 22.643 -2.496 1 1 398 . 11 1 1 A 59 59 ALA N N 59 125.153 121.501 3.652 1 1 399 . 11 1 1 A 60 60 GLU H H 60 8.154 8.952 -0.798 1 1 400 . 11 1 1 A 60 60 GLU HA H 60 5.508 5.485 0.023 1 1 404 . 11 1 1 A 60 60 GLU CA C 60 52.179 54.184 -2.005 1 1 405 . 11 1 1 A 60 60 GLU CB C 60 30.203 34.247 -4.044 1 1 406 . 11 1 1 A 60 60 GLU N N 60 117.318 116.903 0.415 1 1 407 . 11 1 1 A 61 61 LYS H H 61 8.821 9.339 -0.518 1 1 408 . 11 1 1 A 61 61 LYS HA H 61 4.311 4.947 -0.636 1 1 413 . 11 1 1 A 61 61 LYS N N 61 123.743 121.013 2.730 1 1 414 . 11 1 1 A 62 62 THR H H 62 8.149 8.691 -0.542 1 1 415 . 11 1 1 A 62 62 THR HA H 62 4.928 4.445 0.483 1 1 420 . 11 1 1 A 62 62 THR CA C 62 59.427 62.941 -3.514 1 1 421 . 11 1 1 A 62 62 THR CB C 62 66.932 69.307 -2.375 1 1 422 . 11 1 1 A 62 62 THR N N 62 122.829 120.754 2.075 1 1 423 . 11 1 1 A 63 63 TYR H H 63 9.466 9.686 -0.220 1 1 424 . 11 1 1 A 63 63 TYR HA H 63 4.606 5.241 -0.635 1 1 431 . 11 1 1 A 63 63 TYR CA C 63 54.508 55.143 -0.635 1 1 432 . 11 1 1 A 63 63 TYR N N 63 127.472 127.833 -0.361 1 1 433 . 11 1 1 A 64 64 GLY H H 64 9.253 8.589 0.664 1 1 434 . 11 1 1 A 64 64 GLY HA2 H 64 4.670 4.160 0.510 1 1 435 . 11 1 1 A 64 64 GLY HA3 H 64 3.619 4.174 -0.555 1 1 436 . 11 1 1 A 64 64 GLY CA C 64 39.885 44.309 -4.424 1 1 437 . 11 1 1 A 64 64 GLY N N 64 110.182 112.096 -1.914 1 1 438 . 11 1 1 A 65 65 ASN H H 65 8.616 8.468 0.148 1 1 439 . 11 1 1 A 65 65 ASN HA H 65 4.109 4.364 -0.255 1 1 444 . 11 1 1 A 65 65 ASN CA C 65 53.691 54.774 -1.083 1 1 445 . 11 1 1 A 65 65 ASN N N 65 117.778 118.853 -1.075 1 1 447 . 11 1 1 A 66 66 GLY H H 66 9.053 8.784 0.269 1 1 448 . 11 1 1 A 66 66 GLY HA2 H 66 4.344 3.890 0.454 1 1 449 . 11 1 1 A 66 66 GLY HA3 H 66 3.359 3.910 -0.551 1 1 450 . 11 1 1 A 66 66 GLY CA C 66 42.431 44.840 -2.409 1 1 451 . 11 1 1 A 66 66 GLY N N 66 115.232 114.555 0.677 1 1 452 . 11 1 1 A 67 67 ASP H H 67 8.120 8.774 -0.654 1 1 453 . 11 1 1 A 67 67 ASP HA H 67 4.844 3.432 1.412 1 1 456 . 11 1 1 A 67 67 ASP N N 67 122.593 121.368 1.225 1 1 457 . 11 1 1 A 68 68 SER H H 68 8.500 7.971 0.529 1 1 458 . 11 1 1 A 68 68 SER HA H 68 5.088 4.842 0.246 1 1 461 . 11 1 1 A 68 68 SER CA C 68 54.858 57.232 -2.374 1 1 462 . 11 1 1 A 68 68 SER CB C 68 62.114 64.136 -2.022 1 1 463 . 11 1 1 A 68 68 SER N N 68 113.557 117.486 -3.929 1 1 464 . 11 1 1 A 69 69 LEU H H 69 8.989 9.911 -0.922 1 1 465 . 11 1 1 A 69 69 LEU HA H 69 4.570 5.310 -0.740 1 1 474 . 11 1 1 A 69 69 LEU N N 69 126.836 128.857 -2.021 1 1 475 . 11 1 1 A 70 70 ASN H H 70 8.491 8.634 -0.143 1 1 476 . 11 1 1 A 70 70 ASN HA H 70 4.958 5.450 -0.492 1 1 479 . 11 1 1 A 70 70 ASN CB C 70 33.265 40.430 -7.165 1 1 480 . 11 1 1 A 70 70 ASN N N 70 126.343 124.511 1.832 1 1 481 . 11 1 1 A 71 71 THR H H 71 7.831 8.707 -0.876 1 1 482 . 11 1 1 A 71 71 THR HA H 71 3.759 4.625 -0.866 1 1 487 . 11 1 1 A 71 71 THR CA C 71 61.005 60.484 0.521 1 1 488 . 11 1 1 A 71 71 THR N N 71 114.742 114.654 0.088 1 1 489 . 11 1 1 A 72 72 GLY H H 72 8.880 8.057 0.823 1 1 490 . 11 1 1 A 72 72 GLY HA2 H 72 3.907 3.852 0.055 1 1 491 . 11 1 1 A 72 72 GLY HA3 H 72 3.907 3.855 0.052 1 1 492 . 11 1 1 A 72 72 GLY N N 72 114.976 110.696 4.280 1 1 493 . 11 1 1 A 73 73 LYS H H 73 6.604 9.299 -2.695 1 1 494 . 11 1 1 A 73 73 LYS HA H 73 4.160 4.499 -0.339 1 1 501 . 11 1 1 A 73 73 LYS N N 73 113.898 119.427 -5.529 1 1 502 . 11 1 1 A 74 74 LEU H H 74 7.422 7.669 -0.247 1 1 503 . 11 1 1 A 74 74 LEU HA H 74 4.358 4.211 0.147 1 1 513 . 11 1 1 A 74 74 LEU N N 74 117.180 121.680 -4.500 1 1 514 . 11 1 1 A 75 75 LYS H H 75 8.617 8.520 0.097 1 1 515 . 11 1 1 A 75 75 LYS HA H 75 4.079 4.494 -0.415 1 1 518 . 11 1 1 A 75 75 LYS N N 75 121.119 121.374 -0.255 1 1 519 . 11 1 1 A 76 76 ASN H H 76 8.154 8.357 -0.203 1 1 520 . 11 1 1 A 76 76 ASN HA H 76 3.935 4.749 -0.814 1 1 525 . 11 1 1 A 76 76 ASN CB C 76 35.772 39.693 -3.921 1 1 526 . 11 1 1 A 76 76 ASN N N 76 122.761 120.042 2.719 1 1 527 . 11 1 1 A 77 77 ASP H H 77 9.227 8.974 0.253 1 1 528 . 11 1 1 A 77 77 ASP HA H 77 3.787 4.450 -0.663 1 1 531 . 11 1 1 A 77 77 ASP CA C 77 52.584 54.863 -2.279 1 1 532 . 11 1 1 A 77 77 ASP N N 77 114.129 121.115 -6.986 1 1 533 . 11 1 1 A 78 78 LYS H H 78 6.579 7.896 -1.317 1 1 534 . 11 1 1 A 78 78 LYS HA H 78 4.572 4.461 0.111 1 1 539 . 11 1 1 A 78 78 LYS CA C 78 51.072 55.865 -4.793 1 1 540 . 11 1 1 A 78 78 LYS CB C 78 33.783 32.495 1.288 1 1 541 . 11 1 1 A 78 78 LYS N N 78 114.135 119.651 -5.516 1 1 542 . 11 1 1 A 79 79 VAL H H 79 8.729 8.474 0.255 1 1 543 . 11 1 1 A 79 79 VAL HA H 79 4.402 4.045 0.357 1 1 551 . 11 1 1 A 79 79 VAL CA C 79 59.240 61.115 -1.875 1 1 553 . 11 1 1 A 79 79 VAL N N 79 123.191 126.137 -2.946 1 1 554 . 11 1 1 A 80 80 SER H H 80 9.542 8.485 1.057 1 1 555 . 11 1 1 A 80 80 SER HA H 80 4.636 5.178 -0.542 1 1 558 . 11 1 1 A 80 80 SER CA C 80 55.978 57.746 -1.768 1 1 559 . 11 1 1 A 80 80 SER N N 80 127.445 121.666 5.779 1 1 560 . 11 1 1 A 81 81 ARG H H 81 8.093 8.833 -0.740 1 1 561 . 11 1 1 A 81 81 ARG HA H 81 5.210 5.198 0.012 1 1 569 . 11 1 1 A 81 81 ARG N N 81 123.743 125.326 -1.583 1 1 571 . 11 1 1 A 82 82 PHE H H 82 9.312 8.277 1.035 1 1 572 . 11 1 1 A 82 82 PHE HA H 82 4.951 5.010 -0.059 1 1 577 . 11 1 1 A 82 82 PHE CA C 82 53.090 56.581 -3.491 1 1 578 . 11 1 1 A 82 82 PHE N N 82 119.529 119.671 -0.142 1 1 579 . 11 1 1 A 83 83 ASP H H 83 9.122 8.728 0.394 1 1 580 . 11 1 1 A 83 83 ASP HA H 83 5.593 5.176 0.417 1 1 583 . 11 1 1 A 83 83 ASP N N 83 123.825 121.680 2.145 1 1 584 . 11 1 1 A 84 84 PHE H H 84 9.090 8.179 0.911 1 1 585 . 11 1 1 A 84 84 PHE HA H 84 6.410 5.972 0.438 1 1 592 . 11 1 1 A 84 84 PHE CA C 84 52.584 55.982 -3.398 1 1 593 . 11 1 1 A 84 84 PHE N N 84 118.862 119.771 -0.909 1 1 594 . 11 1 1 A 85 85 ILE H H 85 8.441 8.972 -0.531 1 1 595 . 11 1 1 A 85 85 ILE HA H 85 4.662 4.780 -0.118 1 1 605 . 11 1 1 A 85 85 ILE CB C 85 39.939 38.613 1.326 1 1 608 . 11 1 1 A 85 85 ILE N N 85 118.049 120.668 -2.619 1 1 609 . 11 1 1 A 86 86 ARG H H 86 8.983 8.601 0.382 1 1 610 . 11 1 1 A 86 86 ARG HA H 86 5.591 4.720 0.871 1 1 616 . 11 1 1 A 86 86 ARG N N 86 127.006 127.052 -0.046 1 1 618 . 11 1 1 A 87 87 GLN H H 87 8.643 8.397 0.246 1 1 619 . 11 1 1 A 87 87 GLN HA H 87 5.630 5.018 0.612 1 1 626 . 11 1 1 A 87 87 GLN CA C 87 51.512 54.527 -3.015 1 1 627 . 11 1 1 A 87 87 GLN N N 87 124.142 121.526 2.616 1 1 629 . 11 1 1 A 88 88 ILE H H 88 8.617 8.591 0.026 1 1 630 . 11 1 1 A 88 88 ILE HA H 88 4.690 4.821 -0.131 1 1 637 . 11 1 1 A 88 88 ILE CA C 88 56.995 60.729 -3.734 1 1 638 . 11 1 1 A 88 88 ILE CB C 88 39.927 40.259 -0.332 1 1 641 . 11 1 1 A 88 88 ILE N N 88 116.353 122.245 -5.892 1 1 642 . 11 1 1 A 89 89 GLU H H 89 8.298 9.014 -0.716 1 1 643 . 11 1 1 A 89 89 GLU HA H 89 5.100 5.897 -0.797 1 1 646 . 11 1 1 A 89 89 GLU CA C 89 52.204 54.830 -2.626 1 1 647 . 11 1 1 A 89 89 GLU CB C 89 27.325 33.035 -5.710 1 1 648 . 11 1 1 A 89 89 GLU N N 89 124.458 129.481 -5.023 1 1 649 . 11 1 1 A 90 90 VAL H H 90 8.957 8.822 0.135 1 1 650 . 11 1 1 A 90 90 VAL HA H 90 4.169 4.737 -0.568 1 1 658 . 11 1 1 A 90 90 VAL CA C 90 58.664 59.735 -1.071 1 1 659 . 11 1 1 A 90 90 VAL CB C 90 31.861 34.936 -3.075 1 1 660 . 11 1 1 A 90 90 VAL N N 90 127.580 126.310 1.270 1 1 661 . 11 1 1 A 91 91 ASP H H 91 9.369 8.826 0.543 1 1 662 . 11 1 1 A 91 91 ASP HA H 91 4.287 4.428 -0.141 1 1 665 . 11 1 1 A 91 91 ASP CA C 91 52.389 54.096 -1.707 1 1 666 . 11 1 1 A 91 91 ASP CB C 91 36.409 39.665 -3.256 1 1 667 . 11 1 1 A 91 91 ASP N N 91 129.411 123.304 6.107 1 1 668 . 11 1 1 A 92 92 GLY H H 92 8.552 7.445 1.107 1 1 669 . 11 1 1 A 92 92 GLY HA2 H 92 4.090 4.092 -0.002 1 1 670 . 11 1 1 A 92 92 GLY HA3 H 92 3.618 4.093 -0.475 1 1 671 . 11 1 1 A 92 92 GLY CA C 92 42.836 45.680 -2.844 1 1 672 . 11 1 1 A 92 92 GLY N N 92 103.862 106.405 -2.543 1 1 673 . 11 1 1 A 93 93 GLN H H 93 7.808 7.384 0.424 1 1 674 . 11 1 1 A 93 93 GLN HA H 93 4.578 4.760 -0.182 1 1 679 . 11 1 1 A 93 93 GLN CA C 93 50.918 54.210 -3.292 1 1 680 . 11 1 1 A 93 93 GLN CB C 93 28.602 30.753 -2.151 1 1 682 . 11 1 1 A 93 93 GLN N N 93 120.412 116.682 3.730 1 1 683 . 11 1 1 A 94 94 LEU H H 94 8.414 8.414 0.000 1 1 684 . 11 1 1 A 94 94 LEU HA H 94 4.704 4.404 0.300 1 1 693 . 11 1 1 A 94 94 LEU CB C 94 39.873 42.496 -2.623 1 1 696 . 11 1 1 A 94 94 LEU N N 94 125.061 121.400 3.661 1 1 697 . 11 1 1 A 95 95 ILE H H 95 9.181 8.624 0.557 1 1 698 . 11 1 1 A 95 95 ILE HA H 95 4.371 4.798 -0.427 1 1 708 . 11 1 1 A 95 95 ILE CA C 95 63.319 60.749 2.570 1 1 709 . 11 1 1 A 95 95 ILE CB C 95 37.407 39.651 -2.244 1 1 711 . 11 1 1 A 95 95 ILE N N 95 127.724 121.383 6.341 1 1 712 . 11 1 1 A 96 96 THR H H 96 8.730 7.420 1.310 1 1 713 . 11 1 1 A 96 96 THR HA H 96 4.411 4.289 0.122 1 1 718 . 11 1 1 A 96 96 THR CA C 96 60.344 63.044 -2.700 1 1 719 . 11 1 1 A 96 96 THR CB C 96 59.719 69.787 -10.068 1 1 720 . 11 1 1 A 96 96 THR N N 96 124.240 119.302 4.938 1 1 721 . 11 1 1 A 97 97 LEU H H 97 8.790 8.721 0.069 1 1 722 . 11 1 1 A 97 97 LEU HA H 97 4.400 5.142 -0.742 1 1 732 . 11 1 1 A 97 97 LEU N N 97 126.147 124.078 2.069 1 1 733 . 11 1 1 A 98 98 GLU H H 98 7.596 8.357 -0.761 1 1 734 . 11 1 1 A 98 98 GLU HA H 98 5.102 4.899 0.203 1 1 739 . 11 1 1 A 98 98 GLU N N 98 116.937 122.222 -5.285 1 1 740 . 11 1 1 A 99 99 SER H H 99 8.906 8.844 0.062 1 1 741 . 11 1 1 A 99 99 SER HA H 99 4.504 5.263 -0.759 1 1 744 . 11 1 1 A 99 99 SER CA C 99 54.010 56.247 -2.237 1 1 745 . 11 1 1 A 99 99 SER CB C 99 63.876 66.751 -2.875 1 1 746 . 11 1 1 A 99 99 SER N N 99 117.823 117.254 0.569 1 1 747 . 11 1 1 A 100 100 GLY H H 100 7.250 7.837 -0.587 1 1 748 . 11 1 1 A 100 100 GLY HA2 H 100 4.872 4.017 0.855 1 1 749 . 11 1 1 A 100 100 GLY HA3 H 100 3.731 4.097 -0.366 1 1 750 . 11 1 1 A 100 100 GLY N N 100 109.436 109.853 -0.417 1 1 751 . 11 1 1 A 101 101 GLU H H 101 9.661 8.957 0.704 1 1 752 . 11 1 1 A 101 101 GLU HA H 101 5.643 4.865 0.778 1 1 757 . 11 1 1 A 101 101 GLU CA C 101 52.584 54.520 -1.936 1 1 758 . 11 1 1 A 101 101 GLU CB C 101 31.750 33.244 -1.494 1 1 759 . 11 1 1 A 101 101 GLU N N 101 126.793 121.040 5.753 1 1 760 . 11 1 1 A 102 102 PHE H H 102 10.441 8.621 1.820 1 1 761 . 11 1 1 A 102 102 PHE HA H 102 5.248 5.161 0.087 1 1 768 . 11 1 1 A 102 102 PHE CA C 102 53.537 56.118 -2.581 1 1 769 . 11 1 1 A 102 102 PHE N N 102 131.837 125.083 6.754 1 1 770 . 11 1 1 A 103 103 GLN H H 103 9.135 9.567 -0.432 1 1 771 . 11 1 1 A 103 103 GLN HA H 103 5.205 5.078 0.127 1 1 776 . 11 1 1 A 103 103 GLN CA C 103 50.925 54.575 -3.650 1 1 777 . 11 1 1 A 103 103 GLN N N 103 127.720 127.606 0.114 1 1 778 . 11 1 1 A 104 104 VAL H H 104 8.937 9.543 -0.606 1 1 779 . 11 1 1 A 104 104 VAL HA H 104 4.780 4.992 -0.212 1 1 787 . 11 1 1 A 104 104 VAL CA C 104 57.086 61.243 -4.157 1 1 789 . 11 1 1 A 104 104 VAL N N 104 120.097 126.128 -6.031 1 1 790 . 11 1 1 A 105 105 TYR H H 105 9.108 10.174 -1.066 1 1 791 . 11 1 1 A 105 105 TYR HA H 105 4.834 5.414 -0.580 1 1 798 . 11 1 1 A 105 105 TYR CA C 105 54.486 56.437 -1.951 1 1 799 . 11 1 1 A 105 105 TYR N N 105 128.426 126.394 2.032 1 1 800 . 11 1 1 A 106 106 LYS H H 106 5.945 8.869 -2.924 1 1 805 . 11 1 1 A 106 106 LYS N N 106 129.163 120.226 8.937 1 1 806 . 11 1 1 A 107 107 GLN H H 107 8.526 8.387 0.139 1 1 807 . 11 1 1 A 107 107 GLN HA H 107 5.160 4.655 0.505 1 1 812 . 11 1 1 A 107 107 GLN CA C 107 52.584 54.008 -1.424 1 1 813 . 11 1 1 A 107 107 GLN CB C 107 26.175 28.993 -2.818 1 1 814 . 11 1 1 A 107 107 GLN N N 107 125.978 122.498 3.480 1 1 815 . 11 1 1 A 108 108 SER H H 108 8.621 8.684 -0.063 1 1 816 . 11 1 1 A 108 108 SER HA H 108 4.403 4.331 0.072 1 1 819 . 11 1 1 A 108 108 SER CA C 108 58.521 60.376 -1.855 1 1 820 . 11 1 1 A 108 108 SER CB C 108 60.737 63.865 -3.128 1 1 821 . 11 1 1 A 108 108 SER N N 108 117.542 115.160 2.382 1 1 822 . 11 1 1 A 109 109 HIS H H 109 10.381 7.910 2.471 1 1 823 . 11 1 1 A 109 109 HIS HA H 109 4.594 4.846 -0.252 1 1 828 . 11 1 1 A 109 109 HIS CA C 109 51.743 55.761 -4.018 1 1 829 . 11 1 1 A 109 109 HIS CB C 109 27.174 30.578 -3.404 1 1 830 . 11 1 1 A 109 109 HIS N N 109 118.449 117.516 0.933 1 1 831 . 11 1 1 A 110 110 SER H H 110 7.366 7.772 -0.406 1 1 832 . 11 1 1 A 110 110 SER HA H 110 4.870 4.649 0.221 1 1 835 . 11 1 1 A 110 110 SER CB C 110 62.986 64.323 -1.337 1 1 836 . 11 1 1 A 110 110 SER N N 110 113.397 113.532 -0.135 1 1 837 . 11 1 1 A 111 111 ALA H H 111 8.541 8.488 0.053 1 1 838 . 11 1 1 A 111 111 ALA HA H 111 4.826 4.818 0.008 1 1 842 . 11 1 1 A 111 111 ALA CA C 111 49.015 51.734 -2.719 1 1 843 . 11 1 1 A 111 111 ALA CB C 111 20.256 23.043 -2.787 1 1 844 . 11 1 1 A 111 111 ALA N N 111 117.786 123.868 -6.082 1 1 845 . 11 1 1 A 112 112 LEU H H 112 8.529 8.567 -0.038 1 1 846 . 11 1 1 A 112 112 LEU HA H 112 5.680 5.150 0.530 1 1 855 . 11 1 1 A 112 112 LEU CA C 112 51.818 52.923 -1.105 1 1 856 . 11 1 1 A 112 112 LEU N N 112 116.345 118.094 -1.749 1 1 857 . 11 1 1 A 113 113 THR H H 113 8.758 8.532 0.226 1 1 858 . 11 1 1 A 113 113 THR HA H 113 5.563 5.338 0.225 1 1 863 . 11 1 1 A 113 113 THR CA C 113 54.458 60.687 -6.229 1 1 864 . 11 1 1 A 113 113 THR CB C 113 68.586 70.406 -1.820 1 1 866 . 11 1 1 A 113 113 THR N N 113 110.469 114.575 -4.106 1 1 867 . 11 1 1 A 114 114 ALA H H 114 8.829 9.676 -0.847 1 1 868 . 11 1 1 A 114 114 ALA HA H 114 4.466 5.255 -0.789 1 1 872 . 11 1 1 A 114 114 ALA CA C 114 48.886 51.822 -2.936 1 1 873 . 11 1 1 A 114 114 ALA CB C 114 21.583 22.522 -0.939 1 1 874 . 11 1 1 A 114 114 ALA N N 114 121.456 124.616 -3.160 1 1 875 . 11 1 1 A 115 115 LEU H H 115 8.407 9.854 -1.447 1 1 876 . 11 1 1 A 115 115 LEU HA H 115 4.814 4.764 0.050 1 1 886 . 11 1 1 A 115 115 LEU N N 115 119.223 123.939 -4.716 1 1 887 . 11 1 1 A 116 116 GLN H H 116 9.720 8.762 0.958 1 1 888 . 11 1 1 A 116 116 GLN HA H 116 5.312 5.291 0.021 1 1 893 . 11 1 1 A 116 116 GLN CA C 116 50.544 54.081 -3.537 1 1 894 . 11 1 1 A 116 116 GLN N N 116 127.827 121.923 5.904 1 1 895 . 11 1 1 A 117 117 THR H H 117 9.663 9.427 0.236 1 1 896 . 11 1 1 A 117 117 THR HA H 117 4.198 4.942 -0.744 1 1 901 . 11 1 1 A 117 117 THR CA C 117 64.037 60.735 3.302 1 1 902 . 11 1 1 A 117 117 THR CB C 117 66.868 72.385 -5.517 1 1 904 . 11 1 1 A 117 117 THR N N 117 128.929 121.557 7.372 1 1 905 . 11 1 1 A 118 118 GLU H H 118 9.486 8.445 1.041 1 1 906 . 11 1 1 A 118 118 GLU HA H 118 4.885 4.659 0.226 1 1 911 . 11 1 1 A 118 118 GLU N N 118 123.497 119.206 4.291 1 1 912 . 11 1 1 A 119 119 GLN H H 119 8.076 7.438 0.638 1 1 913 . 11 1 1 A 119 119 GLN HA H 119 5.331 4.877 0.454 1 1 916 . 11 1 1 A 119 119 GLN CA C 119 51.858 54.114 -2.256 1 1 917 . 11 1 1 A 119 119 GLN N N 119 118.023 119.486 -1.463 1 1 918 . 11 1 1 A 120 120 GLU H H 120 9.078 9.415 -0.337 1 1 919 . 11 1 1 A 120 120 GLU HA H 120 5.071 4.845 0.226 1 1 924 . 11 1 1 A 120 120 GLU N N 120 118.433 123.363 -4.930 1 1 925 . 11 1 1 A 121 121 GLN H H 121 7.711 8.691 -0.980 1 1 926 . 11 1 1 A 121 121 GLN HA H 121 4.430 5.195 -0.765 1 1 933 . 11 1 1 A 121 121 GLN CA C 121 53.996 54.221 -0.225 1 1 934 . 11 1 1 A 121 121 GLN CB C 121 27.158 32.882 -5.724 1 1 936 . 11 1 1 A 121 121 GLN N N 121 122.412 117.971 4.441 1 1 938 . 11 1 1 A 122 122 ASP H H 122 8.675 10.181 -1.506 1 1 939 . 11 1 1 A 122 122 ASP HA H 122 4.632 5.224 -0.592 1 1 942 . 11 1 1 A 122 122 ASP CA C 122 48.797 50.669 -1.872 1 1 943 . 11 1 1 A 122 122 ASP CB C 122 39.852 42.826 -2.974 1 1 944 . 11 1 1 A 122 122 ASP N N 122 128.625 120.906 7.719 1 1 945 . 11 1 1 A 123 123 PRO CA C 123 61.579 62.697 -1.118 1 1 946 . 11 1 1 A 123 123 PRO CB C 123 29.597 29.489 0.108 1 1 948 . 11 1 1 A 124 124 GLU H H 124 8.297 8.625 -0.328 1 1 949 . 11 1 1 A 124 124 GLU HA H 124 4.196 4.264 -0.068 1 1 954 . 11 1 1 A 124 124 GLU CA C 124 53.025 57.581 -4.556 1 1 955 . 11 1 1 A 124 124 GLU CB C 124 27.927 31.012 -3.085 1 1 957 . 11 1 1 A 124 124 GLU N N 124 115.538 121.872 -6.334 1 1 958 . 11 1 1 A 125 125 HIS H H 125 7.419 7.290 0.129 1 1 959 . 11 1 1 A 125 125 HIS HA H 125 4.833 4.605 0.228 1 1 964 . 11 1 1 A 125 125 HIS CA C 125 51.886 56.288 -4.402 1 1 965 . 11 1 1 A 125 125 HIS CB C 125 26.387 30.858 -4.471 1 1 966 . 11 1 1 A 125 125 HIS N N 125 117.464 115.643 1.821 1 1 967 . 11 1 1 A 126 126 SER H H 126 8.441 8.510 -0.069 1 1 968 . 11 1 1 A 126 126 SER HA H 126 4.261 4.690 -0.429 1 1 971 . 11 1 1 A 126 126 SER CA C 126 57.988 57.170 0.818 1 1 972 . 11 1 1 A 126 126 SER N N 126 117.954 114.412 3.542 1 1 973 . 11 1 1 A 127 127 GLU H H 127 9.221 7.691 1.530 1 1 974 . 11 1 1 A 127 127 GLU HA H 127 4.366 4.504 -0.138 1 1 979 . 11 1 1 A 127 127 GLU CA C 127 53.707 56.283 -2.576 1 1 980 . 11 1 1 A 127 127 GLU CB C 127 25.492 30.227 -4.735 1 1 981 . 11 1 1 A 127 127 GLU N N 127 120.404 120.724 -0.320 1 1 982 . 11 1 1 A 128 128 LYS H H 128 8.262 8.092 0.170 1 1 983 . 11 1 1 A 128 128 LYS HA H 128 4.661 4.033 0.628 1 1 990 . 11 1 1 A 128 128 LYS CA C 128 52.264 58.176 -5.912 1 1 991 . 11 1 1 A 128 128 LYS CB C 128 32.404 31.652 0.752 1 1 994 . 11 1 1 A 128 128 LYS N N 128 122.166 117.372 4.794 1 1 995 . 11 1 1 A 129 129 MET H H 129 8.242 7.663 0.579 1 1 996 . 11 1 1 A 129 129 MET HA H 129 5.012 4.877 0.135 1 1 1001 . 11 1 1 A 129 129 MET CA C 129 50.958 54.862 -3.904 1 1 1003 . 11 1 1 A 129 129 MET N N 129 119.422 118.873 0.549 1 1 1004 . 11 1 1 A 130 130 VAL H H 130 9.200 10.986 -1.786 1 1 1005 . 11 1 1 A 130 130 VAL HA H 130 4.609 4.676 -0.067 1 1 1013 . 11 1 1 A 130 130 VAL CA C 130 56.296 60.317 -4.021 1 1 1014 . 11 1 1 A 130 130 VAL CB C 130 32.606 36.301 -3.695 1 1 1015 . 11 1 1 A 130 130 VAL N N 130 118.290 123.310 -5.020 1 1 1016 . 11 1 1 A 131 131 ALA H H 131 8.368 8.866 -0.498 1 1 1017 . 11 1 1 A 131 131 ALA HA H 131 4.654 5.186 -0.532 1 1 1021 . 11 1 1 A 131 131 ALA CA C 131 49.739 50.384 -0.645 1 1 1022 . 11 1 1 A 131 131 ALA CB C 131 15.351 21.145 -5.794 1 1 1023 . 11 1 1 A 131 131 ALA N N 131 126.734 125.361 1.373 1 1 1024 . 11 1 1 A 132 132 LYS H H 132 7.732 8.893 -1.161 1 1 1025 . 11 1 1 A 132 132 LYS HA H 132 4.171 5.030 -0.859 1 1 1028 . 11 1 1 A 132 132 LYS N N 132 127.309 122.731 4.578 1 1 1029 . 11 1 1 A 133 133 ARG H H 133 8.193 8.870 -0.677 1 1 1030 . 11 1 1 A 133 133 ARG HA H 133 5.073 5.151 -0.078 1 1 1038 . 11 1 1 A 133 133 ARG N N 133 122.190 119.156 3.034 1 1 1040 . 11 1 1 A 134 134 ARG H H 134 7.539 9.074 -1.535 1 1 1041 . 11 1 1 A 134 134 ARG HA H 134 4.667 5.043 -0.376 1 1 1049 . 11 1 1 A 134 134 ARG CA C 134 52.584 54.725 -2.141 1 1 1050 . 11 1 1 A 134 134 ARG CB C 134 31.325 32.114 -0.789 1 1 1052 . 11 1 1 A 134 134 ARG N N 134 121.632 125.633 -4.001 1 1 1054 . 11 1 1 A 135 135 PHE H H 135 8.816 8.835 -0.019 1 1 1055 . 11 1 1 A 135 135 PHE HA H 135 5.680 5.850 -0.170 1 1 1062 . 11 1 1 A 135 135 PHE N N 135 125.107 120.391 4.716 1 1 1063 . 11 1 1 A 136 136 ARG H H 136 7.741 9.815 -2.074 1 1 1064 . 11 1 1 A 136 136 ARG HA H 136 4.402 4.579 -0.177 1 1 1068 . 11 1 1 A 136 136 ARG N N 136 125.640 124.736 0.904 1 1 1070 . 11 1 1 A 137 137 ILE H H 137 8.556 8.763 -0.207 1 1 1071 . 11 1 1 A 137 137 ILE HA H 137 3.912 4.609 -0.697 1 1 1076 . 11 1 1 A 137 137 ILE CA C 137 55.676 61.105 -5.429 1 1 1079 . 11 1 1 A 137 137 ILE N N 137 122.891 127.888 -4.997 1 1 1080 . 11 1 1 A 138 138 GLY H H 138 8.676 9.952 -1.276 1 1 1081 . 11 1 1 A 138 138 GLY HA2 H 138 3.740 4.092 -0.352 1 1 1082 . 11 1 1 A 138 138 GLY HA3 H 138 2.982 4.108 -1.126 1 1 1083 . 11 1 1 A 138 138 GLY CA C 138 41.908 46.136 -4.228 1 1 1084 . 11 1 1 A 138 138 GLY N N 138 117.058 116.060 0.998 1 1 1085 . 11 1 1 A 139 139 ASP H H 139 7.858 7.780 0.078 1 1 1086 . 11 1 1 A 139 139 ASP HA H 139 4.753 4.675 0.078 1 1 1089 . 11 1 1 A 139 139 ASP CA C 139 52.584 53.465 -0.881 1 1 1090 . 11 1 1 A 139 139 ASP CB C 139 43.062 38.952 4.110 1 1 1091 . 11 1 1 A 139 139 ASP N N 139 124.516 120.683 3.833 1 1 1092 . 11 1 1 A 140 140 ILE H H 140 8.354 9.081 -0.727 1 1 1093 . 11 1 1 A 140 140 ILE HA H 140 4.473 4.430 0.043 1 1 1103 . 11 1 1 A 140 140 ILE CB C 140 36.173 38.875 -2.702 1 1 1105 . 11 1 1 A 140 140 ILE N N 140 120.679 119.609 1.070 1 1 1106 . 11 1 1 A 141 141 ALA H H 141 8.708 8.655 0.053 1 1 1107 . 11 1 1 A 141 141 ALA HA H 141 4.862 4.947 -0.085 1 1 1111 . 11 1 1 A 141 141 ALA CA C 141 47.968 51.629 -3.661 1 1 1112 . 11 1 1 A 141 141 ALA CB C 141 21.733 23.183 -1.450 1 1 1113 . 11 1 1 A 141 141 ALA N N 141 130.144 121.560 8.584 1 1 1114 . 11 1 1 A 142 142 GLY H H 142 7.888 8.501 -0.613 1 1 1115 . 11 1 1 A 142 142 GLY HA2 H 142 4.519 4.158 0.361 1 1 1116 . 11 1 1 A 142 142 GLY HA3 H 142 3.634 4.188 -0.554 1 1 1117 . 11 1 1 A 142 142 GLY N N 142 102.272 105.950 -3.678 1 1 1118 . 11 1 1 A 143 143 GLU H H 143 8.068 8.347 -0.279 1 1 1119 . 11 1 1 A 143 143 GLU HA H 143 4.577 4.789 -0.212 1 1 1124 . 11 1 1 A 143 143 GLU N N 143 120.569 121.305 -0.736 1 1 1125 . 11 1 1 A 144 144 HIS H H 144 8.478 8.716 -0.238 1 1 1126 . 11 1 1 A 144 144 HIS HA H 144 4.968 4.784 0.184 1 1 1131 . 11 1 1 A 144 144 HIS N N 144 124.275 124.162 0.113 1 1 1132 . 11 1 1 A 145 145 THR H H 145 9.031 8.343 0.688 1 1 1133 . 11 1 1 A 145 145 THR HA H 145 4.025 4.320 -0.295 1 1 1138 . 11 1 1 A 145 145 THR CA C 145 61.247 62.347 -1.100 1 1 1139 . 11 1 1 A 145 145 THR CB C 145 65.181 69.024 -3.843 1 1 1141 . 11 1 1 A 145 145 THR N N 145 125.828 114.901 10.927 1 1 1142 . 11 1 1 A 146 146 SER H H 146 9.077 7.996 1.081 1 1 1143 . 11 1 1 A 146 146 SER HA H 146 4.684 4.610 0.074 1 1 1145 . 11 1 1 A 146 146 SER CA C 146 56.067 58.866 -2.799 1 1 1146 . 11 1 1 A 146 146 SER CB C 146 60.510 62.069 -1.559 1 1 1147 . 11 1 1 A 146 146 SER N N 146 124.154 120.441 3.713 1 1 1148 . 11 1 1 A 147 147 PHE H H 147 9.049 8.351 0.698 1 1 1149 . 11 1 1 A 147 147 PHE HA H 147 4.022 4.231 -0.209 1 1 1154 . 11 1 1 A 147 147 PHE N N 147 127.670 126.307 1.363 1 1 1155 . 11 1 1 A 148 148 ASP H H 148 8.504 8.435 0.069 1 1 1156 . 11 1 1 A 148 148 ASP HA H 148 4.422 4.596 -0.174 1 1 1158 . 11 1 1 A 148 148 ASP CA C 148 52.584 56.134 -3.550 1 1 1159 . 11 1 1 A 148 148 ASP CB C 148 37.800 40.444 -2.644 1 1 1160 . 11 1 1 A 148 148 ASP N N 148 114.377 120.305 -5.928 1 1 1161 . 11 1 1 A 149 149 LYS H H 149 7.380 9.219 -1.839 1 1 1162 . 11 1 1 A 149 149 LYS HA H 149 4.487 4.520 -0.033 1 1 1171 . 11 1 1 A 149 149 LYS CA C 149 51.735 57.181 -5.446 1 1 1172 . 11 1 1 A 149 149 LYS CB C 149 30.162 33.132 -2.970 1 1 1175 . 11 1 1 A 149 149 LYS N N 149 119.137 117.140 1.997 1 1 1176 . 11 1 1 A 150 150 LEU H H 150 6.886 7.918 -1.032 1 1 1177 . 11 1 1 A 150 150 LEU HA H 150 3.996 4.604 -0.608 1 1 1186 . 11 1 1 A 150 150 LEU CA C 150 50.502 56.176 -5.674 1 1 1187 . 11 1 1 A 150 150 LEU N N 150 120.614 119.585 1.029 1 1 1188 . 11 1 1 A 151 151 PRO CB C 151 29.567 29.089 0.478 1 1 1190 . 11 1 1 A 152 152 LYS H H 152 8.076 8.524 -0.448 1 1 1191 . 11 1 1 A 152 152 LYS HA H 152 4.346 4.457 -0.111 1 1 1195 . 11 1 1 A 152 152 LYS CA C 152 53.182 57.336 -4.154 1 1 1196 . 11 1 1 A 152 152 LYS CB C 152 31.487 32.843 -1.356 1 1 1198 . 11 1 1 A 152 152 LYS N N 152 118.133 121.413 -3.280 1 1 1199 . 11 1 1 A 153 153 ASP H H 153 7.982 7.980 0.002 1 1 1200 . 11 1 1 A 153 153 ASP HA H 153 4.402 3.181 1.221 1 1 1203 . 11 1 1 A 153 153 ASP CA C 153 52.584 53.032 -0.448 1 1 1204 . 11 1 1 A 153 153 ASP CB C 153 37.762 41.142 -3.380 1 1 1205 . 11 1 1 A 153 153 ASP N N 153 115.735 116.983 -1.248 1 1 1206 . 11 1 1 A 154 154 VAL H H 154 6.987 7.392 -0.405 1 1 1207 . 11 1 1 A 154 154 VAL HA H 154 4.406 4.615 -0.209 1 1 1215 . 11 1 1 A 154 154 VAL CA C 154 58.408 59.814 -1.406 1 1 1216 . 11 1 1 A 154 154 VAL CB C 154 32.617 34.812 -2.195 1 1 1217 . 11 1 1 A 154 154 VAL N N 154 116.266 119.533 -3.267 1 1 1218 . 11 1 1 A 155 155 MET H H 155 8.444 9.156 -0.712 1 1 1219 . 11 1 1 A 155 155 MET HA H 155 5.416 4.537 0.879 1 1 1224 . 11 1 1 A 155 155 MET CA C 155 51.183 56.837 -5.654 1 1 1226 . 11 1 1 A 155 155 MET N N 155 124.950 128.483 -3.533 1 1 1227 . 11 1 1 A 156 156 ALA H H 156 9.226 8.941 0.285 1 1 1228 . 11 1 1 A 156 156 ALA HA H 156 4.693 4.997 -0.304 1 1 1232 . 11 1 1 A 156 156 ALA CA C 156 48.379 51.592 -3.213 1 1 1233 . 11 1 1 A 156 156 ALA CB C 156 21.051 20.761 0.290 1 1 1234 . 11 1 1 A 156 156 ALA N N 156 129.938 125.557 4.381 1 1 1235 . 11 1 1 A 157 157 THR H H 157 8.554 8.650 -0.096 1 1 1236 . 11 1 1 A 157 157 THR HA H 157 4.839 4.212 0.627 1 1 1241 . 11 1 1 A 157 157 THR CA C 157 59.555 61.815 -2.260 1 1 1242 . 11 1 1 A 157 157 THR CB C 157 68.575 70.472 -1.897 1 1 1244 . 11 1 1 A 157 157 THR N N 157 118.815 117.881 0.934 1 1 1245 . 11 1 1 A 158 158 TYR H H 158 9.974 9.407 0.567 1 1 1246 . 11 1 1 A 158 158 TYR HA H 158 4.435 5.636 -1.201 1 1 1253 . 11 1 1 A 158 158 TYR N N 158 126.958 124.164 2.794 1 1 1254 . 11 1 1 A 159 159 ARG H H 159 8.909 8.855 0.054 1 1 1255 . 11 1 1 A 159 159 ARG HA H 159 5.444 5.602 -0.158 1 1 1263 . 11 1 1 A 159 159 ARG CA C 159 51.933 54.626 -2.693 1 1 1264 . 11 1 1 A 159 159 ARG N N 159 121.721 119.278 2.443 1 1 1266 . 11 1 1 A 160 160 GLY H H 160 8.910 8.180 0.730 1 1 1267 . 11 1 1 A 160 160 GLY HA2 H 160 4.904 4.445 0.459 1 1 1268 . 11 1 1 A 160 160 GLY HA3 H 160 4.484 4.481 0.003 1 1 1269 . 11 1 1 A 160 160 GLY N N 160 113.921 106.631 7.290 1 1 1270 . 11 1 1 A 161 161 THR H H 161 9.110 9.413 -0.303 1 1 1271 . 11 1 1 A 161 161 THR HA H 161 4.810 5.248 -0.438 1 1 1276 . 11 1 1 A 161 161 THR CA C 161 59.603 61.092 -1.489 1 1 1277 . 11 1 1 A 161 161 THR CB C 161 69.909 72.101 -2.192 1 1 1279 . 11 1 1 A 161 161 THR N N 161 126.813 115.939 10.874 1 1 1280 . 11 1 1 A 162 162 ALA H H 162 7.137 10.041 -2.904 1 1 1281 . 11 1 1 A 162 162 ALA HA H 162 5.361 5.199 0.162 1 1 1285 . 11 1 1 A 162 162 ALA CA C 162 46.573 50.597 -4.024 1 1 1286 . 11 1 1 A 162 162 ALA CB C 162 20.959 23.798 -2.839 1 1 1287 . 11 1 1 A 162 162 ALA N N 162 128.111 125.141 2.970 1 1 1288 . 11 1 1 A 163 163 PHE H H 163 8.587 9.271 -0.684 1 1 1289 . 11 1 1 A 163 163 PHE HA H 163 5.538 5.476 0.062 1 1 1296 . 11 1 1 A 163 163 PHE N N 163 117.349 114.280 3.069 1 1 1297 . 11 1 1 A 164 164 GLY H H 164 8.650 8.940 -0.290 1 1 1298 . 11 1 1 A 164 164 GLY HA2 H 164 4.210 4.019 0.191 1 1 1299 . 11 1 1 A 164 164 GLY HA3 H 164 3.285 4.219 -0.934 1 1 1300 . 11 1 1 A 164 164 GLY CA C 164 40.377 45.515 -5.138 1 1 1301 . 11 1 1 A 164 164 GLY N N 164 108.839 109.789 -0.950 1 1 1302 . 11 1 1 A 165 165 SER H H 165 7.684 9.763 -2.079 1 1 1303 . 11 1 1 A 165 165 SER HA H 165 3.458 4.416 -0.958 1 1 1304 . 11 1 1 A 165 165 SER N N 165 116.037 118.392 -2.355 1 1 1305 . 11 1 1 A 166 166 ASP H H 166 9.718 8.491 1.227 1 1 1306 . 11 1 1 A 166 166 ASP HA H 166 4.281 4.576 -0.295 1 1 1309 . 11 1 1 A 166 166 ASP CA C 166 52.584 55.926 -3.342 1 1 1310 . 11 1 1 A 166 166 ASP N N 166 125.166 121.437 3.729 1 1 1311 . 11 1 1 A 167 167 ASP H H 167 7.655 8.229 -0.574 1 1 1312 . 11 1 1 A 167 167 ASP HA H 167 4.666 4.887 -0.221 1 1 1315 . 11 1 1 A 167 167 ASP CB C 167 38.948 42.265 -3.317 1 1 1316 . 11 1 1 A 167 167 ASP N N 167 117.491 120.121 -2.630 1 1 1317 . 11 1 1 A 168 168 ALA H H 168 8.585 8.421 0.164 1 1 1318 . 11 1 1 A 168 168 ALA HA H 168 5.012 4.800 0.212 1 1 1322 . 11 1 1 A 168 168 ALA CA C 168 47.485 51.275 -3.790 1 1 1323 . 11 1 1 A 168 168 ALA N N 168 128.834 121.291 7.543 1 1 1324 . 11 1 1 A 169 169 GLY H H 169 8.472 8.088 0.384 1 1 1325 . 11 1 1 A 169 169 GLY HA2 H 169 4.404 4.318 0.086 1 1 1326 . 11 1 1 A 169 169 GLY HA3 H 169 4.051 4.346 -0.295 1 1 1327 . 11 1 1 A 169 169 GLY CA C 169 43.257 44.709 -1.452 1 1 1328 . 11 1 1 A 169 169 GLY N N 169 107.133 107.500 -0.367 1 1 1329 . 11 1 1 A 170 170 GLY H H 170 7.229 8.628 -1.399 1 1 1330 . 11 1 1 A 170 170 GLY HA2 H 170 4.223 4.364 -0.141 1 1 1331 . 11 1 1 A 170 170 GLY HA3 H 170 3.781 4.571 -0.790 1 1 1332 . 11 1 1 A 170 170 GLY CA C 170 43.310 45.770 -2.460 1 1 1333 . 11 1 1 A 170 170 GLY N N 170 107.542 109.741 -2.199 1 1 1334 . 11 1 1 A 171 171 LYS H H 171 9.641 8.266 1.375 1 1 1335 . 11 1 1 A 171 171 LYS HA H 171 5.129 5.153 -0.024 1 1 1342 . 11 1 1 A 171 171 LYS CA C 171 51.355 54.576 -3.221 1 1 1343 . 11 1 1 A 171 171 LYS N N 171 124.322 120.192 4.130 1 1 1344 . 11 1 1 A 172 172 LEU H H 172 7.764 8.548 -0.784 1 1 1345 . 11 1 1 A 172 172 LEU HA H 172 4.973 5.209 -0.236 1 1 1353 . 11 1 1 A 172 172 LEU CA C 172 50.348 53.712 -3.364 1 1 1354 . 11 1 1 A 172 172 LEU N N 172 126.389 120.476 5.913 1 1 1355 . 11 1 1 A 173 173 THR H H 173 8.321 8.596 -0.275 1 1 1356 . 11 1 1 A 173 173 THR HA H 173 5.017 5.028 -0.011 1 1 1361 . 11 1 1 A 173 173 THR CA C 173 59.149 62.051 -2.902 1 1 1362 . 11 1 1 A 173 173 THR CB C 173 67.449 69.620 -2.171 1 1 1364 . 11 1 1 A 173 173 THR N N 173 123.553 120.616 2.937 1 1 1365 . 11 1 1 A 174 174 TYR H H 174 9.367 10.311 -0.944 1 1 1366 . 11 1 1 A 174 174 TYR HA H 174 4.660 5.090 -0.430 1 1 1373 . 11 1 1 A 174 174 TYR CB C 174 41.267 43.290 -2.023 1 1 1374 . 11 1 1 A 174 174 TYR N N 174 129.583 125.212 4.371 1 1 1375 . 11 1 1 A 175 175 THR H H 175 8.529 9.534 -1.005 1 1 1376 . 11 1 1 A 175 175 THR HA H 175 5.388 4.605 0.783 1 1 1381 . 11 1 1 A 175 175 THR CA C 175 58.216 61.194 -2.978 1 1 1382 . 11 1 1 A 175 175 THR CB C 175 68.575 69.592 -1.017 1 1 1384 . 11 1 1 A 175 175 THR N N 175 125.967 116.239 9.728 1 1 1385 . 11 1 1 A 176 176 ILE H H 176 9.139 8.149 0.990 1 1 1386 . 11 1 1 A 176 176 ILE HA H 176 4.382 4.474 -0.092 1 1 1395 . 11 1 1 A 176 176 ILE CA C 176 58.006 59.787 -1.781 1 1 1396 . 11 1 1 A 176 176 ILE CB C 176 38.881 38.467 0.414 1 1 1400 . 11 1 1 A 176 176 ILE N N 176 123.715 126.925 -3.210 1 1 1401 . 11 1 1 A 177 177 ASP H H 177 8.501 8.397 0.104 1 1 1402 . 11 1 1 A 177 177 ASP HA H 177 5.011 4.602 0.409 1 1 1405 . 11 1 1 A 177 177 ASP CA C 177 49.089 54.110 -5.021 1 1 1406 . 11 1 1 A 177 177 ASP CB C 177 39.282 41.088 -1.806 1 1 1407 . 11 1 1 A 177 177 ASP N N 177 125.978 128.579 -2.601 1 1 1408 . 11 1 1 A 178 178 PHE H H 178 8.913 8.893 0.020 1 1 1409 . 11 1 1 A 178 178 PHE HA H 178 3.993 4.638 -0.645 1 1 1414 . 11 1 1 A 178 178 PHE CB C 178 34.588 39.999 -5.411 1 1 1415 . 11 1 1 A 178 178 PHE N N 178 123.522 120.786 2.736 1 1 1416 . 11 1 1 A 179 179 ALA H H 179 8.487 9.097 -0.610 1 1 1417 . 11 1 1 A 179 179 ALA HA H 179 4.528 4.176 0.352 1 1 1421 . 11 1 1 A 179 179 ALA CA C 179 52.584 55.865 -3.281 1 1 1422 . 11 1 1 A 179 179 ALA CB C 179 15.666 18.868 -3.202 1 1 1423 . 11 1 1 A 179 179 ALA N N 179 124.061 123.233 0.828 1 1 1424 . 11 1 1 A 180 180 ALA H H 180 7.162 8.307 -1.145 1 1 1425 . 11 1 1 A 180 180 ALA HA H 180 4.313 4.281 0.032 1 1 1429 . 11 1 1 A 180 180 ALA CA C 180 49.006 52.989 -3.983 1 1 1430 . 11 1 1 A 180 180 ALA CB C 180 16.933 18.345 -1.412 1 1 1431 . 11 1 1 A 180 180 ALA N N 180 119.710 119.045 0.665 1 1 1432 . 11 1 1 A 181 181 LYS H H 181 8.092 8.173 -0.081 1 1 1433 . 11 1 1 A 181 181 LYS HA H 181 3.457 4.398 -0.941 1 1 1440 . 11 1 1 A 181 181 LYS CA C 181 54.783 56.475 -1.692 1 1 1441 . 11 1 1 A 181 181 LYS CB C 181 27.088 33.641 -6.553 1 1 1444 . 11 1 1 A 181 181 LYS N N 181 114.996 116.031 -1.035 1 1 1445 . 11 1 1 A 182 182 GLN H H 182 7.532 7.937 -0.405 1 1 1446 . 11 1 1 A 182 182 GLN HA H 182 5.304 4.614 0.690 1 1 1453 . 11 1 1 A 182 182 GLN CA C 182 51.473 54.678 -3.205 1 1 1454 . 11 1 1 A 182 182 GLN CB C 182 31.585 30.947 0.638 1 1 1455 . 11 1 1 A 182 182 GLN N N 182 115.064 113.229 1.835 1 1 1457 . 11 1 1 A 183 183 GLY H H 183 9.026 8.101 0.925 1 1 1458 . 11 1 1 A 183 183 GLY HA2 H 183 5.376 3.007 2.369 1 1 1459 . 11 1 1 A 183 183 GLY HA3 H 183 3.567 3.573 -0.006 1 1 1460 . 11 1 1 A 183 183 GLY CA C 183 42.361 44.376 -2.015 1 1 1461 . 11 1 1 A 183 183 GLY N N 183 111.505 106.340 5.165 1 1 1462 . 11 1 1 A 184 184 HIS H H 184 7.508 7.822 -0.314 1 1 1463 . 11 1 1 A 184 184 HIS HA H 184 4.304 5.725 -1.421 1 1 1467 . 11 1 1 A 184 184 HIS CA C 184 52.793 53.538 -0.745 1 1 1468 . 11 1 1 A 184 184 HIS CB C 184 27.906 33.154 -5.248 1 1 1469 . 11 1 1 A 184 184 HIS N N 184 111.297 120.688 -9.391 1 1 1470 . 11 1 1 A 185 185 GLY H H 185 9.160 7.211 1.949 1 1 1471 . 11 1 1 A 185 185 GLY HA2 H 185 4.464 2.376 2.088 1 1 1472 . 11 1 1 A 185 185 GLY HA3 H 185 4.117 3.719 0.398 1 1 1473 . 11 1 1 A 185 185 GLY CA C 185 44.212 44.521 -0.309 1 1 1474 . 11 1 1 A 185 185 GLY N N 185 107.398 104.693 2.705 1 1 1475 . 11 1 1 A 186 186 LYS H H 186 9.170 8.453 0.717 1 1 1476 . 11 1 1 A 186 186 LYS HA H 186 4.925 4.754 0.171 1 1 1481 . 11 1 1 A 186 186 LYS CB C 186 33.642 35.982 -2.340 1 1 1482 . 11 1 1 A 186 186 LYS N N 186 122.690 120.103 2.587 1 1 1483 . 11 1 1 A 187 187 ILE H H 187 8.444 8.229 0.215 1 1 1484 . 11 1 1 A 187 187 ILE HA H 187 4.626 4.687 -0.061 1 1 1487 . 11 1 1 A 187 187 ILE N N 187 124.320 124.907 -0.587 1 1 1488 . 11 1 1 A 188 188 GLU H H 188 8.590 9.067 -0.477 1 1 1489 . 11 1 1 A 188 188 GLU HA H 188 4.650 4.767 -0.117 1 1 1495 . 11 1 1 A 188 188 GLU N N 188 122.575 128.844 -6.269 1 1 1496 . 11 1 1 A 189 189 HIS H H 189 8.726 9.347 -0.621 1 1 1497 . 11 1 1 A 189 189 HIS HA H 189 4.055 5.052 -0.997 1 1 1501 . 11 1 1 A 189 189 HIS CA C 189 54.623 54.671 -0.048 1 1 1502 . 11 1 1 A 189 189 HIS CB C 189 24.997 30.136 -5.139 1 1 1503 . 11 1 1 A 189 189 HIS N N 189 111.381 124.482 -13.101 1 1 1504 . 11 1 1 A 190 190 LEU H H 190 9.715 8.582 1.133 1 1 1505 . 11 1 1 A 190 190 LEU HA H 190 4.379 3.974 0.405 1 1 1515 . 11 1 1 A 190 190 LEU N N 190 124.648 125.824 -1.176 1 1 1516 . 11 1 1 A 191 191 LYS H H 191 10.099 8.095 2.004 1 1 1517 . 11 1 1 A 191 191 LYS HA H 191 3.736 4.255 -0.519 1 1 1524 . 11 1 1 A 191 191 LYS CA C 191 55.815 56.725 -0.910 1 1 1525 . 11 1 1 A 191 191 LYS CB C 191 30.201 32.455 -2.254 1 1 1527 . 11 1 1 A 191 191 LYS N N 191 123.618 123.864 -0.246 1 1 1528 . 11 1 1 A 192 192 SER H H 192 6.991 7.573 -0.582 1 1 1529 . 11 1 1 A 192 192 SER HA H 192 4.743 4.758 -0.015 1 1 1532 . 11 1 1 A 192 192 SER CA C 192 51.974 57.346 -5.372 1 1 1533 . 11 1 1 A 192 192 SER CB C 192 60.005 61.935 -1.930 1 1 1534 . 11 1 1 A 192 192 SER N N 192 115.071 116.428 -1.357 1 1 1535 . 11 1 1 A 193 193 PRO CB C 193 29.607 30.683 -1.076 1 1 1537 . 11 1 1 A 194 194 GLU H H 194 8.213 8.099 0.114 1 1 1538 . 11 1 1 A 194 194 GLU HA H 194 3.063 4.626 -1.563 1 1 1543 . 11 1 1 A 194 194 GLU CA C 194 54.185 55.342 -1.157 1 1 1545 . 11 1 1 A 194 194 GLU N N 194 114.055 118.644 -4.589 1 1 1546 . 11 1 1 A 195 195 LEU H H 195 7.082 7.992 -0.910 1 1 1547 . 11 1 1 A 195 195 LEU HA H 195 4.027 4.869 -0.842 1 1 1557 . 11 1 1 A 195 195 LEU CA C 195 51.361 57.984 -6.623 1 1 1558 . 11 1 1 A 195 195 LEU CB C 195 38.950 41.901 -2.951 1 1 1561 . 11 1 1 A 195 195 LEU N N 195 113.898 119.856 -5.958 1 1 1562 . 11 1 1 A 196 196 ASN H H 196 7.060 7.911 -0.851 1 1 1563 . 11 1 1 A 196 196 ASN HA H 196 4.638 5.864 -1.226 1 1 1567 . 11 1 1 A 196 196 ASN N N 196 119.196 114.854 4.342 1 1 1568 . 11 1 1 A 197 197 VAL H H 197 7.244 8.672 -1.428 1 1 1569 . 11 1 1 A 197 197 VAL HA H 197 4.540 4.872 -0.332 1 1 1577 . 11 1 1 A 197 197 VAL CA C 197 57.176 59.704 -2.528 1 1 1578 . 11 1 1 A 197 197 VAL N N 197 113.621 122.383 -8.762 1 1 1579 . 11 1 1 A 198 198 ASP H H 198 8.881 8.687 0.194 1 1 1580 . 11 1 1 A 198 198 ASP HA H 198 4.894 4.678 0.216 1 1 1581 . 11 1 1 A 198 198 ASP N N 198 118.852 123.536 -4.684 1 1 1582 . 11 1 1 A 199 199 LEU H H 199 8.498 8.446 0.052 1 1 1583 . 11 1 1 A 199 199 LEU HA H 199 4.317 4.493 -0.176 1 1 1591 . 11 1 1 A 199 199 LEU N N 199 124.078 127.647 -3.569 1 1 1592 . 11 1 1 A 200 200 ALA H H 200 8.386 8.685 -0.299 1 1 1593 . 11 1 1 A 200 200 ALA HA H 200 4.295 5.234 -0.939 1 1 1597 . 11 1 1 A 200 200 ALA CA C 200 50.044 50.711 -0.667 1 1 1598 . 11 1 1 A 200 200 ALA CB C 200 17.985 21.942 -3.957 1 1 1599 . 11 1 1 A 200 200 ALA N N 200 127.315 126.865 0.450 1 1 1600 . 11 1 1 A 201 201 VAL H H 201 8.007 9.078 -1.071 1 1 1601 . 11 1 1 A 201 201 VAL HA H 201 4.577 4.968 -0.391 1 1 1609 . 11 1 1 A 201 201 VAL CA C 201 60.004 60.084 -0.080 1 1 1610 . 11 1 1 A 201 201 VAL CB C 201 28.863 36.195 -7.332 1 1 1611 . 11 1 1 A 201 201 VAL N N 201 119.409 122.022 -2.613 1 1 1612 . 11 1 1 A 202 202 ALA H H 202 8.789 8.816 -0.027 1 1 1613 . 11 1 1 A 202 202 ALA HA H 202 4.630 5.342 -0.712 1 1 1617 . 11 1 1 A 202 202 ALA CA C 202 48.200 50.403 -2.203 1 1 1618 . 11 1 1 A 202 202 ALA N N 202 131.745 126.200 5.545 1 1 1619 . 11 1 1 A 203 203 TYR H H 203 8.522 9.214 -0.692 1 1 1620 . 11 1 1 A 203 203 TYR HA H 203 5.391 5.867 -0.476 1 1 1627 . 11 1 1 A 203 203 TYR CA C 203 54.648 57.152 -2.504 1 1 1628 . 11 1 1 A 203 203 TYR CB C 203 37.315 39.923 -2.608 1 1 1629 . 11 1 1 A 203 203 TYR N N 203 117.786 122.792 -5.006 1 1 1630 . 11 1 1 A 204 204 ILE H H 204 8.209 8.390 -0.181 1 1 1631 . 11 1 1 A 204 204 ILE HA H 204 4.393 4.606 -0.213 1 1 1641 . 11 1 1 A 204 204 ILE CB C 204 36.807 38.740 -1.933 1 1 1644 . 11 1 1 A 204 204 ILE N N 204 120.602 124.023 -3.421 1 1 1645 . 11 1 1 A 205 205 LYS H H 205 9.340 8.624 0.716 1 1 1646 . 11 1 1 A 205 205 LYS HA H 205 4.756 4.422 0.334 1 1 1651 . 11 1 1 A 205 205 LYS CA C 205 50.844 60.492 -9.648 1 1 1652 . 11 1 1 A 205 205 LYS N N 205 127.960 123.249 4.711 1 1 1653 . 11 1 1 A 207 207 ASP H H 207 8.436 8.796 -0.360 1 1 1654 . 11 1 1 A 207 207 ASP HA H 207 4.692 4.674 0.018 1 1 1657 . 11 1 1 A 207 207 ASP CA C 207 48.789 52.925 -4.136 1 1 1658 . 11 1 1 A 207 207 ASP CB C 207 38.377 41.299 -2.922 1 1 1659 . 11 1 1 A 207 207 ASP N N 207 123.098 124.108 -1.010 1 1 1660 . 11 1 1 A 208 208 GLU H H 208 8.880 8.306 0.574 1 1 1661 . 11 1 1 A 208 208 GLU HA H 208 3.994 3.934 0.060 1 1 1666 . 11 1 1 A 208 208 GLU CA C 208 56.123 59.546 -3.423 1 1 1667 . 11 1 1 A 208 208 GLU CB C 208 25.794 29.406 -3.612 1 1 1669 . 11 1 1 A 208 208 GLU N N 208 119.042 121.728 -2.686 1 1 1670 . 11 1 1 A 209 209 LYS H H 209 7.681 7.494 0.187 1 1 1671 . 11 1 1 A 209 209 LYS HA H 209 4.141 4.319 -0.178 1 1 1680 . 11 1 1 A 209 209 LYS N N 209 119.252 115.103 4.149 1 1 1681 . 11 1 1 A 210 210 HIS H H 210 8.177 6.796 1.381 1 1 1682 . 11 1 1 A 210 210 HIS HA H 210 3.825 4.709 -0.884 1 1 1687 . 11 1 1 A 210 210 HIS CA C 210 54.205 54.896 -0.691 1 1 1688 . 11 1 1 A 210 210 HIS CB C 210 23.439 30.711 -7.272 1 1 1689 . 11 1 1 A 210 210 HIS N N 210 112.758 112.566 0.192 1 1 1690 . 11 1 1 A 211 211 HIS H H 211 8.758 7.085 1.673 1 1 1691 . 11 1 1 A 211 211 HIS HA H 211 5.041 4.570 0.471 1 1 1695 . 11 1 1 A 211 211 HIS CA C 211 50.450 54.634 -4.184 1 1 1696 . 11 1 1 A 211 211 HIS CB C 211 25.703 33.013 -7.310 1 1 1697 . 11 1 1 A 211 211 HIS N N 211 119.552 118.500 1.052 1 1 1698 . 11 1 1 A 212 212 ALA H H 212 8.556 7.961 0.595 1 1 1699 . 11 1 1 A 212 212 ALA HA H 212 4.712 4.860 -0.148 1 1 1703 . 11 1 1 A 212 212 ALA CA C 212 49.886 51.327 -1.441 1 1 1704 . 11 1 1 A 212 212 ALA CB C 212 18.860 18.771 0.089 1 1 1705 . 11 1 1 A 212 212 ALA N N 212 123.780 123.407 0.373 1 1 1706 . 11 1 1 A 213 213 VAL H H 213 9.338 8.088 1.250 1 1 1707 . 11 1 1 A 213 213 VAL HA H 213 5.074 5.212 -0.138 1 1 1715 . 11 1 1 A 213 213 VAL CA C 213 57.486 60.766 -3.280 1 1 1716 . 11 1 1 A 213 213 VAL CB C 213 33.938 33.925 0.013 1 1 1717 . 11 1 1 A 213 213 VAL N N 213 124.742 120.162 4.580 1 1 1718 . 11 1 1 A 214 214 ILE H H 214 8.962 8.297 0.665 1 1 1719 . 11 1 1 A 214 214 ILE HA H 214 4.434 4.341 0.093 1 1 1726 . 11 1 1 A 214 214 ILE N N 214 122.881 125.911 -3.030 1 1 1727 . 11 1 1 A 215 215 SER H H 215 8.558 8.529 0.029 1 1 1728 . 11 1 1 A 215 215 SER HA H 215 5.001 5.579 -0.578 1 1 1731 . 11 1 1 A 215 215 SER CA C 215 53.230 56.666 -3.436 1 1 1732 . 11 1 1 A 215 215 SER CB C 215 62.077 65.361 -3.284 1 1 1733 . 11 1 1 A 215 215 SER N N 215 122.891 121.698 1.193 1 1 1734 . 11 1 1 A 216 216 GLY H H 216 7.282 9.750 -2.468 1 1 1735 . 11 1 1 A 216 216 GLY HA2 H 216 4.515 4.406 0.109 1 1 1736 . 11 1 1 A 216 216 GLY HA3 H 216 3.473 4.487 -1.014 1 1 1737 . 11 1 1 A 216 216 GLY CA C 216 42.816 45.891 -3.075 1 1 1738 . 11 1 1 A 216 216 GLY N N 216 110.899 111.201 -0.302 1 1 1739 . 11 1 1 A 217 217 SER H H 217 8.673 8.700 -0.027 1 1 1740 . 11 1 1 A 217 217 SER HA H 217 5.127 5.599 -0.472 1 1 1743 . 11 1 1 A 217 217 SER CA C 217 56.266 56.540 -0.274 1 1 1744 . 11 1 1 A 217 217 SER N N 217 117.164 114.842 2.322 1 1 1745 . 11 1 1 A 218 218 VAL H H 218 7.451 8.565 -1.114 1 1 1746 . 11 1 1 A 218 218 VAL HA H 218 5.128 4.559 0.569 1 1 1754 . 11 1 1 A 218 218 VAL CA C 218 56.637 61.809 -5.172 1 1 1755 . 11 1 1 A 218 218 VAL N N 218 117.826 123.198 -5.372 1 1 1756 . 11 1 1 A 219 219 LEU H H 219 9.022 8.962 0.060 1 1 1757 . 11 1 1 A 219 219 LEU HA H 219 5.387 5.079 0.308 1 1 1767 . 11 1 1 A 219 219 LEU CA C 219 50.450 53.667 -3.217 1 1 1768 . 11 1 1 A 219 219 LEU N N 219 124.820 128.242 -3.422 1 1 1769 . 11 1 1 A 220 220 TYR H H 220 8.816 9.087 -0.271 1 1 1770 . 11 1 1 A 220 220 TYR HA H 220 4.834 4.926 -0.092 1 1 1777 . 11 1 1 A 220 220 TYR N N 220 121.249 127.320 -6.071 1 1 1778 . 11 1 1 A 221 221 ASN H H 221 9.191 8.043 1.148 1 1 1779 . 11 1 1 A 221 221 ASN HA H 221 4.048 4.290 -0.242 1 1 1784 . 11 1 1 A 221 221 ASN CA C 221 51.647 55.876 -4.229 1 1 1785 . 11 1 1 A 221 221 ASN CB C 221 36.640 38.487 -1.847 1 1 1786 . 11 1 1 A 221 221 ASN N N 221 129.865 123.459 6.406 1 1 1788 . 11 1 1 A 222 222 GLN H H 222 8.468 7.708 0.760 1 1 1789 . 11 1 1 A 222 222 GLN HA H 222 3.671 4.562 -0.891 1 1 1794 . 11 1 1 A 222 222 GLN CA C 222 55.075 55.393 -0.318 1 1 1795 . 11 1 1 A 222 222 GLN CB C 222 24.663 29.612 -4.949 1 1 1797 . 11 1 1 A 222 222 GLN N N 222 108.367 112.135 -3.768 1 1 1798 . 11 1 1 A 223 223 ASP H H 223 7.797 8.573 -0.776 1 1 1799 . 11 1 1 A 223 223 ASP HA H 223 4.986 4.959 0.027 1 1 1802 . 11 1 1 A 223 223 ASP N N 223 120.842 119.918 0.924 1 1 1803 . 11 1 1 A 224 224 GLU H H 224 8.731 7.798 0.933 1 1 1804 . 11 1 1 A 224 224 GLU HA H 224 4.690 4.845 -0.155 1 1 1809 . 11 1 1 A 224 224 GLU CA C 224 54.703 54.983 -0.280 1 1 1810 . 11 1 1 A 224 224 GLU CB C 224 26.357 33.500 -7.143 1 1 1812 . 11 1 1 A 224 224 GLU N N 224 124.249 119.246 5.003 1 1 1813 . 11 1 1 A 225 225 LYS H H 225 8.730 8.505 0.225 1 1 1814 . 11 1 1 A 225 225 LYS HA H 225 4.754 4.834 -0.080 1 1 1822 . 11 1 1 A 225 225 LYS N N 225 126.784 124.290 2.494 1 1 1823 . 11 1 1 A 226 226 GLY H H 226 7.683 8.859 -1.176 1 1 1824 . 11 1 1 A 226 226 GLY HA2 H 226 5.567 4.165 1.402 1 1 1825 . 11 1 1 A 226 226 GLY HA3 H 226 3.819 4.183 -0.364 1 1 1826 . 11 1 1 A 226 226 GLY CA C 226 42.264 44.127 -1.863 1 1 1827 . 11 1 1 A 226 226 GLY N N 226 107.140 111.355 -4.215 1 1 1828 . 11 1 1 A 227 227 SER H H 227 8.672 11.071 -2.399 1 1 1829 . 11 1 1 A 227 227 SER HA H 227 5.564 5.493 0.071 1 1 1832 . 11 1 1 A 227 227 SER CA C 227 54.373 56.226 -1.853 1 1 1833 . 11 1 1 A 227 227 SER CB C 227 63.963 66.768 -2.805 1 1 1834 . 11 1 1 A 227 227 SER N N 227 117.767 114.527 3.240 1 1 1835 . 11 1 1 A 228 228 TYR H H 228 9.073 10.185 -1.112 1 1 1836 . 11 1 1 A 228 228 TYR HA H 228 5.519 5.329 0.190 1 1 1843 . 11 1 1 A 228 228 TYR N N 228 118.324 124.983 -6.659 1 1 1844 . 11 1 1 A 229 229 SER H H 229 8.929 8.019 0.910 1 1 1845 . 11 1 1 A 229 229 SER HA H 229 5.209 5.369 -0.160 1 1 1848 . 11 1 1 A 229 229 SER CA C 229 54.131 56.670 -2.539 1 1 1849 . 11 1 1 A 229 229 SER N N 229 116.118 122.375 -6.257 1 1 1850 . 11 1 1 A 230 230 LEU H H 230 9.372 9.730 -0.358 1 1 1851 . 11 1 1 A 230 230 LEU HA H 230 4.803 4.849 -0.046 1 1 1863 . 11 1 1 A 230 230 LEU N N 230 124.803 126.098 -1.295 1 1 1864 . 11 1 1 A 231 231 GLY H H 231 9.080 8.263 0.817 1 1 1865 . 11 1 1 A 231 231 GLY HA2 H 231 4.776 4.128 0.648 1 1 1866 . 11 1 1 A 231 231 GLY HA3 H 231 3.528 4.320 -0.792 1 1 1867 . 11 1 1 A 231 231 GLY CA C 231 41.468 44.126 -2.658 1 1 1868 . 11 1 1 A 231 231 GLY N N 231 109.611 108.464 1.147 1 1 1869 . 11 1 1 A 232 232 ILE H H 232 6.849 8.976 -2.127 1 1 1870 . 11 1 1 A 232 232 ILE HA H 232 4.742 5.065 -0.323 1 1 1878 . 11 1 1 A 232 232 ILE N N 232 120.566 123.635 -3.069 1 1 1879 . 11 1 1 A 233 233 PHE H H 233 9.569 9.752 -0.183 1 1 1880 . 11 1 1 A 233 233 PHE HA H 233 4.979 5.064 -0.085 1 1 1885 . 11 1 1 A 233 233 PHE N N 233 129.256 127.524 1.732 1 1 1886 . 11 1 1 A 234 234 GLY H H 234 8.734 8.934 -0.200 1 1 1887 . 11 1 1 A 234 234 GLY HA2 H 234 4.488 3.813 0.675 1 1 1888 . 11 1 1 A 234 234 GLY HA3 H 234 3.327 3.836 -0.509 1 1 1889 . 11 1 1 A 234 234 GLY CA C 234 40.377 47.189 -6.812 1 1 1890 . 11 1 1 A 234 234 GLY N N 234 105.294 111.429 -6.135 1 1 1891 . 11 1 1 A 235 235 GLU H H 235 9.198 8.444 0.754 1 1 1892 . 11 1 1 A 235 235 GLU HA H 235 4.111 3.787 0.324 1 1 1897 . 11 1 1 A 235 235 GLU CA C 235 56.466 59.190 -2.724 1 1 1898 . 11 1 1 A 235 235 GLU CB C 235 26.256 29.104 -2.848 1 1 1900 . 11 1 1 A 235 235 GLU N N 235 125.813 122.510 3.303 1 1 1901 . 11 1 1 A 236 236 LYS H H 236 8.147 7.969 0.178 1 1 1902 . 11 1 1 A 236 236 LYS HA H 236 4.373 4.511 -0.138 1 1 1905 . 11 1 1 A 236 236 LYS N N 236 117.810 119.978 -2.168 1 1 1906 . 11 1 1 A 237 237 ALA H H 237 7.685 7.906 -0.221 1 1 1907 . 11 1 1 A 237 237 ALA HA H 237 3.902 4.490 -0.588 1 1 1911 . 11 1 1 A 237 237 ALA CA C 237 49.762 53.072 -3.310 1 1 1912 . 11 1 1 A 237 237 ALA CB C 237 14.720 21.398 -6.678 1 1 1913 . 11 1 1 A 237 237 ALA N N 237 118.704 123.796 -5.092 1 1 1914 . 11 1 1 A 238 238 GLN H H 238 9.312 10.091 -0.779 1 1 1915 . 11 1 1 A 238 238 GLN HA H 238 4.049 4.630 -0.581 1 1 1920 . 11 1 1 A 238 238 GLN N N 238 118.059 116.431 1.628 1 1 1921 . 11 1 1 A 239 239 GLU H H 239 8.785 7.982 0.803 1 1 1922 . 11 1 1 A 239 239 GLU HA H 239 5.531 4.700 0.831 1 1 1927 . 11 1 1 A 239 239 GLU N N 239 116.914 114.195 2.719 1 1 1928 . 11 1 1 A 240 240 VAL H H 240 8.501 9.620 -1.119 1 1 1929 . 11 1 1 A 240 240 VAL HA H 240 5.655 4.732 0.923 1 1 1937 . 11 1 1 A 240 240 VAL CA C 240 55.582 60.738 -5.156 1 1 1940 . 11 1 1 A 240 240 VAL N N 240 110.588 119.835 -9.247 1 1 1941 . 11 1 1 A 241 241 ALA H H 241 8.463 8.441 0.022 1 1 1942 . 11 1 1 A 241 241 ALA HA H 241 5.014 5.018 -0.004 1 1 1946 . 11 1 1 A 241 241 ALA CA C 241 49.361 50.976 -1.615 1 1 1947 . 11 1 1 A 241 241 ALA CB C 241 18.196 23.640 -5.444 1 1 1948 . 11 1 1 A 241 241 ALA N N 241 121.125 129.657 -8.532 1 1 1949 . 11 1 1 A 242 242 GLY H H 242 9.421 8.280 1.141 1 1 1950 . 11 1 1 A 242 242 GLY HA2 H 242 5.161 4.148 1.013 1 1 1951 . 11 1 1 A 242 242 GLY HA3 H 242 4.076 4.226 -0.150 1 1 1952 . 11 1 1 A 242 242 GLY N N 242 112.036 105.796 6.240 1 1 1953 . 11 1 1 A 243 243 SER H H 243 8.929 8.208 0.721 1 1 1954 . 11 1 1 A 243 243 SER HA H 243 5.331 5.181 0.150 1 1 1957 . 11 1 1 A 243 243 SER N N 243 116.113 115.458 0.655 1 1 1958 . 11 1 1 A 244 244 ALA H H 244 9.218 8.131 1.087 1 1 1959 . 11 1 1 A 244 244 ALA HA H 244 5.221 4.729 0.492 1 1 1963 . 11 1 1 A 244 244 ALA CA C 244 47.883 51.275 -3.392 1 1 1964 . 11 1 1 A 244 244 ALA N N 244 120.635 121.392 -0.757 1 1 1965 . 11 1 1 A 245 245 GLU H H 245 9.194 8.170 1.024 1 1 1966 . 11 1 1 A 245 245 GLU HA H 245 4.869 5.126 -0.257 1 1 1971 . 11 1 1 A 245 245 GLU N N 245 123.487 117.849 5.638 1 1 1972 . 11 1 1 A 246 246 VAL H H 246 8.531 9.861 -1.330 1 1 1973 . 11 1 1 A 246 246 VAL HA H 246 4.518 4.877 -0.359 1 1 1981 . 11 1 1 A 246 246 VAL CA C 246 58.286 60.928 -2.642 1 1 1982 . 11 1 1 A 246 246 VAL N N 246 123.347 123.574 -0.227 1 1 1983 . 11 1 1 A 247 247 GLU H H 247 9.132 8.609 0.523 1 1 1984 . 11 1 1 A 247 247 GLU HA H 247 4.368 4.897 -0.529 1 1 1989 . 11 1 1 A 247 247 GLU CB C 247 26.744 32.106 -5.362 1 1 1990 . 11 1 1 A 247 247 GLU N N 247 129.243 126.556 2.687 1 1 1991 . 11 1 1 A 248 248 THR H H 248 7.827 8.505 -0.678 1 1 1992 . 11 1 1 A 248 248 THR HA H 248 4.749 4.730 0.019 1 1 1997 . 11 1 1 A 248 248 THR CA C 248 56.859 60.918 -4.059 1 1 1998 . 11 1 1 A 248 248 THR CB C 248 69.171 69.883 -0.712 1 1 2000 . 11 1 1 A 248 248 THR N N 248 114.228 119.432 -5.204 1 1 2001 . 11 1 1 A 249 249 ALA H H 249 9.148 8.627 0.521 1 1 2002 . 11 1 1 A 249 249 ALA HA H 249 4.174 4.155 0.019 1 1 2006 . 11 1 1 A 249 249 ALA CA C 249 51.970 53.931 -1.961 1 1 2007 . 11 1 1 A 249 249 ALA CB C 249 15.797 18.729 -2.932 1 1 2008 . 11 1 1 A 249 249 ALA N N 249 123.341 124.400 -1.059 1 1 2009 . 11 1 1 A 250 250 ASN H H 250 7.974 7.670 0.304 1 1 2010 . 11 1 1 A 250 250 ASN HA H 250 4.953 4.905 0.048 1 1 2015 . 11 1 1 A 250 250 ASN CA C 250 49.198 52.257 -3.059 1 1 2016 . 11 1 1 A 250 250 ASN CB C 250 35.976 38.681 -2.705 1 1 2017 . 11 1 1 A 250 250 ASN N N 250 113.358 113.713 -0.355 1 1 2019 . 11 1 1 A 251 251 GLY H H 251 7.510 7.720 -0.210 1 1 2020 . 11 1 1 A 251 251 GLY HA2 H 251 4.492 4.151 0.341 1 1 2021 . 11 1 1 A 251 251 GLY HA3 H 251 3.853 4.311 -0.458 1 1 2022 . 11 1 1 A 251 251 GLY CA C 251 41.435 45.846 -4.411 1 1 2023 . 11 1 1 A 251 251 GLY N N 251 108.692 107.621 1.071 1 1 2024 . 11 1 1 A 252 252 ILE H H 252 8.465 8.868 -0.403 1 1 2025 . 11 1 1 A 252 252 ILE HA H 252 4.521 4.773 -0.252 1 1 2035 . 11 1 1 A 252 252 ILE CB C 252 35.653 38.142 -2.489 1 1 2039 . 11 1 1 A 252 252 ILE N N 252 122.043 127.141 -5.098 1 1 2040 . 11 1 1 A 253 253 HIS H H 253 9.311 9.934 -0.623 1 1 2041 . 11 1 1 A 253 253 HIS HA H 253 4.861 5.303 -0.442 1 1 2046 . 11 1 1 A 253 253 HIS N N 253 126.617 126.049 0.568 1 1 2047 . 11 1 1 A 254 254 HIS H H 254 8.820 9.363 -0.543 1 1 2048 . 11 1 1 A 254 254 HIS HA H 254 5.305 5.312 -0.007 1 1 2051 . 11 1 1 A 254 254 HIS CA C 254 52.781 54.203 -1.422 1 1 2052 . 11 1 1 A 254 254 HIS N N 254 122.665 120.941 1.724 1 1 2053 . 11 1 1 A 255 255 ILE H H 255 9.047 8.478 0.569 1 1 2054 . 11 1 1 A 255 255 ILE HA H 255 4.651 4.224 0.427 1 1 2061 . 11 1 1 A 255 255 ILE N N 255 123.958 122.778 1.180 1 1 2062 . 11 1 1 A 256 256 GLY H H 256 9.339 8.177 1.162 1 1 2063 . 11 1 1 A 256 256 GLY HA2 H 256 3.816 3.740 0.076 1 1 2064 . 11 1 1 A 256 256 GLY HA3 H 256 2.267 3.741 -1.474 1 1 2065 . 11 1 1 A 256 256 GLY N N 256 115.022 110.442 4.580 1 1 2066 . 11 1 1 A 257 257 LEU H H 257 7.890 9.102 -1.212 1 1 2067 . 11 1 1 A 257 257 LEU HA H 257 4.853 4.978 -0.125 1 1 2077 . 11 1 1 A 257 257 LEU N N 257 121.441 122.860 -1.419 1 1 2078 . 11 1 1 A 258 258 ALA H H 258 7.982 9.022 -1.040 1 1 2079 . 11 1 1 A 258 258 ALA HA H 258 4.668 4.745 -0.077 1 1 2083 . 11 1 1 A 258 258 ALA CA C 258 49.678 51.434 -1.756 1 1 2084 . 11 1 1 A 258 258 ALA CB C 258 19.561 20.845 -1.284 1 1 2085 . 11 1 1 A 258 258 ALA N N 258 123.234 122.808 0.426 1 1 2086 . 11 1 1 A 259 259 ALA H H 259 9.117 8.423 0.694 1 1 2087 . 11 1 1 A 259 259 ALA HA H 259 4.790 5.038 -0.248 1 1 2091 . 11 1 1 A 259 259 ALA N N 259 123.901 123.597 0.304 1 1 2092 . 11 1 1 A 260 260 LYS H H 260 8.452 8.575 -0.123 1 1 2093 . 11 1 1 A 260 260 LYS HA H 260 5.914 4.803 1.111 1 1 2098 . 11 1 1 A 260 260 LYS CA C 260 51.818 54.654 -2.836 1 1 2099 . 11 1 1 A 260 260 LYS N N 260 116.464 117.576 -1.112 1 1 1 . 12 1 1 A 9 9 SER H H 9 8.293 8.331 -0.038 1 1 2 . 12 1 1 A 9 9 SER HA H 9 4.432 5.171 -0.739 1 1 3 . 12 1 1 A 9 9 SER N N 9 116.407 116.093 0.314 1 1 4 . 12 1 1 A 10 10 GLY H H 10 8.472 8.601 -0.129 1 1 5 . 12 1 1 A 10 10 GLY N N 10 111.611 113.748 -2.137 1 1 6 . 12 1 1 A 14 14 VAL H H 14 8.009 8.202 -0.193 1 1 7 . 12 1 1 A 14 14 VAL HA H 14 4.128 4.588 -0.460 1 1 15 . 12 1 1 A 14 14 VAL CA C 14 59.473 60.485 -1.012 1 1 16 . 12 1 1 A 14 14 VAL CB C 14 30.127 35.913 -5.786 1 1 17 . 12 1 1 A 14 14 VAL N N 14 119.846 124.235 -4.389 1 1 18 . 12 1 1 A 15 15 THR H H 15 8.152 8.551 -0.399 1 1 19 . 12 1 1 A 15 15 THR HA H 15 4.346 4.808 -0.462 1 1 24 . 12 1 1 A 15 15 THR N N 15 118.509 117.222 1.287 1 1 25 . 12 1 1 A 16 16 ALA H H 16 8.207 8.628 -0.421 1 1 26 . 12 1 1 A 16 16 ALA HA H 16 4.319 4.143 0.176 1 1 30 . 12 1 1 A 16 16 ALA CA C 16 49.835 53.710 -3.875 1 1 31 . 12 1 1 A 16 16 ALA CB C 16 16.714 18.578 -1.864 1 1 32 . 12 1 1 A 16 16 ALA N N 16 126.935 126.823 0.112 1 1 33 . 12 1 1 A 17 17 ASP H H 17 8.269 7.798 0.471 1 1 34 . 12 1 1 A 17 17 ASP HA H 17 4.581 4.984 -0.403 1 1 37 . 12 1 1 A 17 17 ASP CA C 17 51.643 53.212 -1.569 1 1 38 . 12 1 1 A 17 17 ASP CB C 17 38.257 41.460 -3.203 1 1 39 . 12 1 1 A 17 17 ASP N N 17 120.379 117.889 2.490 1 1 40 . 12 1 1 A 18 18 ILE H H 18 7.979 8.525 -0.546 1 1 41 . 12 1 1 A 18 18 ILE HA H 18 4.178 3.642 0.536 1 1 48 . 12 1 1 A 18 18 ILE CA C 18 58.737 65.246 -6.509 1 1 49 . 12 1 1 A 18 18 ILE CB C 18 36.077 38.052 -1.975 1 1 53 . 12 1 1 A 18 18 ILE N N 18 121.171 125.647 -4.476 1 1 54 . 12 1 1 A 19 19 GLY H H 19 8.410 8.336 0.074 1 1 55 . 12 1 1 A 19 19 GLY HA2 H 19 4.023 3.793 0.230 1 1 56 . 12 1 1 A 19 19 GLY HA3 H 19 4.023 3.796 0.227 1 1 57 . 12 1 1 A 19 19 GLY N N 19 112.246 108.478 3.768 1 1 58 . 12 1 1 A 20 20 THR H H 20 8.005 8.146 -0.141 1 1 59 . 12 1 1 A 20 20 THR HA H 20 4.463 4.045 0.418 1 1 64 . 12 1 1 A 20 20 THR CB C 20 66.723 68.606 -1.883 1 1 66 . 12 1 1 A 20 20 THR N N 20 112.239 116.128 -3.889 1 1 67 . 12 1 1 A 21 21 GLY H H 21 8.500 9.955 -1.455 1 1 68 . 12 1 1 A 21 21 GLY HA2 H 21 4.099 3.797 0.302 1 1 69 . 12 1 1 A 21 21 GLY HA3 H 21 3.872 3.799 0.073 1 1 70 . 12 1 1 A 21 21 GLY N N 21 111.048 111.472 -0.424 1 1 71 . 12 1 1 A 22 22 LEU H H 22 7.427 8.051 -0.624 1 1 72 . 12 1 1 A 22 22 LEU HA H 22 3.884 4.032 -0.148 1 1 84 . 12 1 1 A 22 22 LEU N N 22 118.837 120.310 -1.473 1 1 85 . 12 1 1 A 23 23 ALA H H 23 7.896 8.431 -0.535 1 1 86 . 12 1 1 A 23 23 ALA HA H 23 4.023 4.146 -0.123 1 1 90 . 12 1 1 A 23 23 ALA CA C 23 52.584 54.161 -1.577 1 1 91 . 12 1 1 A 23 23 ALA CB C 23 15.470 18.385 -2.915 1 1 92 . 12 1 1 A 23 23 ALA N N 23 119.194 121.493 -2.299 1 1 93 . 12 1 1 A 24 24 ASP H H 24 8.265 7.645 0.620 1 1 94 . 12 1 1 A 24 24 ASP HA H 24 4.337 4.519 -0.182 1 1 97 . 12 1 1 A 24 24 ASP CB C 24 37.029 41.216 -4.187 1 1 98 . 12 1 1 A 24 24 ASP N N 24 119.035 116.562 2.473 1 1 99 . 12 1 1 A 25 25 ALA H H 25 8.211 8.383 -0.172 1 1 100 . 12 1 1 A 25 25 ALA HA H 25 4.064 4.155 -0.091 1 1 104 . 12 1 1 A 25 25 ALA CA C 25 53.278 53.345 -0.067 1 1 105 . 12 1 1 A 25 25 ALA CB C 25 15.760 19.018 -3.258 1 1 106 . 12 1 1 A 25 25 ALA N N 25 122.434 121.282 1.152 1 1 107 . 12 1 1 A 26 26 LEU H H 26 7.334 7.366 -0.032 1 1 108 . 12 1 1 A 26 26 LEU HA H 26 4.351 4.351 0.000 1 1 117 . 12 1 1 A 26 26 LEU N N 26 114.238 115.324 -1.086 1 1 118 . 12 1 1 A 27 27 THR H H 27 7.708 7.799 -0.091 1 1 119 . 12 1 1 A 27 27 THR HA H 27 4.492 4.601 -0.109 1 1 124 . 12 1 1 A 27 27 THR CA C 27 59.438 62.241 -2.803 1 1 125 . 12 1 1 A 27 27 THR CB C 27 68.796 70.176 -1.380 1 1 127 . 12 1 1 A 27 27 THR N N 27 106.430 111.041 -4.611 1 1 128 . 12 1 1 A 28 28 ALA H H 28 8.906 7.693 1.213 1 1 129 . 12 1 1 A 28 28 ALA HA H 28 4.812 4.593 0.219 1 1 133 . 12 1 1 A 28 28 ALA CB C 28 16.724 19.431 -2.707 1 1 134 . 12 1 1 A 28 28 ALA N N 28 128.420 124.650 3.770 1 1 135 . 12 1 1 A 29 29 PRO CA C 29 59.166 62.169 -3.003 1 1 136 . 12 1 1 A 29 29 PRO CB C 29 29.865 33.161 -3.296 1 1 139 . 12 1 1 A 30 30 LEU H H 30 8.204 8.322 -0.118 1 1 140 . 12 1 1 A 30 30 LEU HA H 30 4.052 4.215 -0.163 1 1 150 . 12 1 1 A 30 30 LEU N N 30 121.970 121.912 0.058 1 1 151 . 12 1 1 A 31 31 ASP H H 31 8.720 8.671 0.049 1 1 152 . 12 1 1 A 31 31 ASP HA H 31 4.772 5.060 -0.288 1 1 155 . 12 1 1 A 31 31 ASP CA C 31 50.115 52.793 -2.678 1 1 156 . 12 1 1 A 31 31 ASP N N 31 125.105 127.127 -2.022 1 1 157 . 12 1 1 A 32 32 HIS CA C 32 55.083 58.206 -3.123 1 1 158 . 12 1 1 A 32 32 HIS CB C 32 25.707 30.492 -4.785 1 1 159 . 12 1 1 A 33 33 LYS H H 33 8.589 8.199 0.390 1 1 160 . 12 1 1 A 33 33 LYS HA H 33 4.112 4.033 0.079 1 1 167 . 12 1 1 A 33 33 LYS CB C 33 29.218 32.452 -3.234 1 1 169 . 12 1 1 A 33 33 LYS N N 33 118.920 119.284 -0.364 1 1 170 . 12 1 1 A 34 34 ASP H H 34 7.420 7.460 -0.040 1 1 171 . 12 1 1 A 34 34 ASP HA H 34 4.368 4.858 -0.490 1 1 174 . 12 1 1 A 34 34 ASP N N 34 120.940 119.539 1.401 1 1 175 . 12 1 1 A 35 35 LYS H H 35 8.266 8.394 -0.128 1 1 176 . 12 1 1 A 35 35 LYS HA H 35 4.169 4.701 -0.532 1 1 183 . 12 1 1 A 35 35 LYS N N 35 121.280 117.430 3.850 1 1 184 . 12 1 1 A 36 36 GLY H H 36 8.716 7.806 0.910 1 1 185 . 12 1 1 A 36 36 GLY HA2 H 36 3.822 4.073 -0.251 1 1 186 . 12 1 1 A 36 36 GLY HA3 H 36 3.618 4.081 -0.463 1 1 187 . 12 1 1 A 36 36 GLY N N 36 111.002 108.512 2.490 1 1 188 . 12 1 1 A 37 37 LEU H H 37 8.032 7.987 0.045 1 1 189 . 12 1 1 A 37 37 LEU HA H 37 4.406 4.569 -0.163 1 1 198 . 12 1 1 A 37 37 LEU N N 37 127.683 119.064 8.619 1 1 199 . 12 1 1 A 38 38 LYS H H 38 9.190 8.926 0.264 1 1 200 . 12 1 1 A 38 38 LYS HA H 38 3.925 4.344 -0.419 1 1 205 . 12 1 1 A 38 38 LYS N N 38 132.634 124.933 7.701 1 1 206 . 12 1 1 A 39 39 SER H H 39 7.161 7.664 -0.503 1 1 207 . 12 1 1 A 39 39 SER HA H 39 5.097 4.614 0.483 1 1 210 . 12 1 1 A 39 39 SER CA C 39 54.451 57.630 -3.179 1 1 211 . 12 1 1 A 39 39 SER N N 39 110.262 110.610 -0.348 1 1 212 . 12 1 1 A 40 40 LEU H H 40 8.142 8.703 -0.561 1 1 213 . 12 1 1 A 40 40 LEU HA H 40 4.481 4.945 -0.464 1 1 223 . 12 1 1 A 40 40 LEU N N 40 122.761 121.082 1.679 1 1 224 . 12 1 1 A 41 41 THR H H 41 8.641 8.762 -0.121 1 1 225 . 12 1 1 A 41 41 THR HA H 41 4.141 4.665 -0.524 1 1 230 . 12 1 1 A 41 41 THR CA C 41 60.301 62.532 -2.231 1 1 231 . 12 1 1 A 41 41 THR CB C 41 65.862 69.763 -3.901 1 1 233 . 12 1 1 A 41 41 THR N N 41 124.142 120.442 3.700 1 1 234 . 12 1 1 A 42 42 LEU H H 42 8.586 8.238 0.348 1 1 235 . 12 1 1 A 42 42 LEU HA H 42 4.337 4.384 -0.047 1 1 247 . 12 1 1 A 42 42 LEU N N 42 128.603 127.214 1.389 1 1 248 . 12 1 1 A 43 43 GLU H H 43 8.644 9.031 -0.387 1 1 249 . 12 1 1 A 43 43 GLU HA H 43 4.663 4.533 0.130 1 1 253 . 12 1 1 A 43 43 GLU N N 43 124.180 119.880 4.300 1 1 254 . 12 1 1 A 44 44 ASP H H 44 10.243 8.007 2.236 1 1 255 . 12 1 1 A 44 44 ASP HA H 44 4.518 4.905 -0.387 1 1 258 . 12 1 1 A 44 44 ASP CA C 44 52.879 53.057 -0.178 1 1 259 . 12 1 1 A 44 44 ASP CB C 44 37.711 42.483 -4.772 1 1 260 . 12 1 1 A 44 44 ASP N N 44 124.177 117.461 6.716 1 1 261 . 12 1 1 A 45 45 SER H H 45 8.546 7.894 0.652 1 1 262 . 12 1 1 A 45 45 SER HA H 45 3.850 4.099 -0.249 1 1 265 . 12 1 1 A 45 45 SER CA C 45 59.588 62.413 -2.825 1 1 266 . 12 1 1 A 45 45 SER CB C 45 61.660 63.151 -1.491 1 1 267 . 12 1 1 A 45 45 SER N N 45 116.191 114.761 1.430 1 1 268 . 12 1 1 A 46 46 ILE H H 46 6.902 8.165 -1.263 1 1 269 . 12 1 1 A 46 46 ILE HA H 46 3.874 4.210 -0.336 1 1 279 . 12 1 1 A 46 46 ILE CA C 46 57.605 60.690 -3.085 1 1 280 . 12 1 1 A 46 46 ILE CB C 46 36.694 37.708 -1.014 1 1 283 . 12 1 1 A 46 46 ILE N N 46 116.189 120.520 -4.331 1 1 284 . 12 1 1 A 47 47 SER H H 47 7.804 8.608 -0.804 1 1 285 . 12 1 1 A 47 47 SER HA H 47 4.342 4.424 -0.082 1 1 288 . 12 1 1 A 47 47 SER CA C 47 55.995 59.577 -3.582 1 1 289 . 12 1 1 A 47 47 SER N N 47 118.738 122.668 -3.930 1 1 290 . 12 1 1 A 48 48 GLN H H 48 8.522 8.743 -0.221 1 1 291 . 12 1 1 A 48 48 GLN HA H 48 3.939 4.041 -0.102 1 1 296 . 12 1 1 A 48 48 GLN CA C 48 55.111 58.459 -3.348 1 1 298 . 12 1 1 A 48 48 GLN N N 48 119.475 123.084 -3.609 1 1 299 . 12 1 1 A 49 49 ASN H H 49 8.437 8.324 0.113 1 1 300 . 12 1 1 A 49 49 ASN HA H 49 4.693 4.715 -0.022 1 1 305 . 12 1 1 A 49 49 ASN CA C 49 50.839 52.526 -1.687 1 1 306 . 12 1 1 A 49 49 ASN CB C 49 35.767 37.820 -2.053 1 1 307 . 12 1 1 A 49 49 ASN N N 49 117.233 114.439 2.794 1 1 309 . 12 1 1 A 50 50 GLY H H 50 7.952 7.400 0.552 1 1 310 . 12 1 1 A 50 50 GLY HA2 H 50 4.518 4.139 0.379 1 1 311 . 12 1 1 A 50 50 GLY HA3 H 50 4.054 4.146 -0.092 1 1 312 . 12 1 1 A 50 50 GLY CA C 50 41.883 45.405 -3.522 1 1 313 . 12 1 1 A 50 50 GLY N N 50 108.751 108.260 0.491 1 1 314 . 12 1 1 A 51 51 THR H H 51 8.548 8.425 0.123 1 1 315 . 12 1 1 A 51 51 THR HA H 51 5.012 5.294 -0.282 1 1 320 . 12 1 1 A 51 51 THR CA C 51 57.026 60.433 -3.407 1 1 321 . 12 1 1 A 51 51 THR CB C 51 69.887 70.562 -0.675 1 1 323 . 12 1 1 A 51 51 THR N N 51 108.710 115.894 -7.184 1 1 324 . 12 1 1 A 52 52 LEU H H 52 9.110 8.991 0.119 1 1 325 . 12 1 1 A 52 52 LEU HA H 52 5.183 5.091 0.092 1 1 333 . 12 1 1 A 52 52 LEU CA C 52 50.822 53.920 -3.098 1 1 335 . 12 1 1 A 52 52 LEU N N 52 124.606 122.225 2.381 1 1 336 . 12 1 1 A 53 53 THR H H 53 9.312 8.569 0.743 1 1 337 . 12 1 1 A 53 53 THR HA H 53 5.288 5.286 0.002 1 1 342 . 12 1 1 A 53 53 THR CA C 53 59.535 61.370 -1.835 1 1 343 . 12 1 1 A 53 53 THR CB C 53 66.838 72.457 -5.619 1 1 345 . 12 1 1 A 53 53 THR N N 53 125.445 114.891 10.554 1 1 346 . 12 1 1 A 54 54 LEU H H 54 8.992 8.527 0.465 1 1 347 . 12 1 1 A 54 54 LEU HA H 54 5.563 5.892 -0.329 1 1 357 . 12 1 1 A 54 54 LEU N N 54 128.814 119.991 8.823 1 1 358 . 12 1 1 A 55 55 SER H H 55 9.017 9.208 -0.191 1 1 359 . 12 1 1 A 55 55 SER HA H 55 5.476 5.217 0.259 1 1 362 . 12 1 1 A 55 55 SER CA C 55 53.944 57.664 -3.720 1 1 363 . 12 1 1 A 55 55 SER CB C 55 63.384 64.868 -1.484 1 1 364 . 12 1 1 A 55 55 SER N N 55 112.964 118.596 -5.632 1 1 365 . 12 1 1 A 56 56 ALA H H 56 8.324 10.674 -2.350 1 1 366 . 12 1 1 A 56 56 ALA HA H 56 4.605 4.791 -0.186 1 1 370 . 12 1 1 A 56 56 ALA CA C 56 50.743 50.174 0.569 1 1 371 . 12 1 1 A 56 56 ALA CB C 56 21.372 21.079 0.293 1 1 372 . 12 1 1 A 56 56 ALA N N 56 123.555 126.962 -3.407 1 1 373 . 12 1 1 A 57 57 GLN H H 57 9.080 8.554 0.526 1 1 374 . 12 1 1 A 57 57 GLN HA H 57 3.884 4.504 -0.620 1 1 381 . 12 1 1 A 57 57 GLN CA C 57 53.331 55.845 -2.514 1 1 382 . 12 1 1 A 57 57 GLN CB C 57 24.659 27.526 -2.867 1 1 384 . 12 1 1 A 57 57 GLN N N 57 116.815 115.008 1.807 1 1 386 . 12 1 1 A 58 58 GLY H H 58 8.527 7.959 0.568 1 1 387 . 12 1 1 A 58 58 GLY HA2 H 58 4.168 4.063 0.105 1 1 388 . 12 1 1 A 58 58 GLY HA3 H 58 3.608 4.065 -0.457 1 1 389 . 12 1 1 A 58 58 GLY CA C 58 42.856 45.580 -2.724 1 1 390 . 12 1 1 A 58 58 GLY N N 58 105.983 107.145 -1.162 1 1 391 . 12 1 1 A 59 59 ALA H H 59 8.203 7.693 0.510 1 1 392 . 12 1 1 A 59 59 ALA HA H 59 4.811 4.597 0.214 1 1 396 . 12 1 1 A 59 59 ALA CA C 59 47.662 51.424 -3.762 1 1 397 . 12 1 1 A 59 59 ALA CB C 59 20.147 22.679 -2.532 1 1 398 . 12 1 1 A 59 59 ALA N N 59 125.153 121.167 3.986 1 1 399 . 12 1 1 A 60 60 GLU H H 60 8.154 8.924 -0.770 1 1 400 . 12 1 1 A 60 60 GLU HA H 60 5.508 5.371 0.137 1 1 404 . 12 1 1 A 60 60 GLU CA C 60 52.179 54.425 -2.246 1 1 405 . 12 1 1 A 60 60 GLU CB C 60 30.203 34.133 -3.930 1 1 406 . 12 1 1 A 60 60 GLU N N 60 117.318 116.532 0.786 1 1 407 . 12 1 1 A 61 61 LYS H H 61 8.821 9.281 -0.460 1 1 408 . 12 1 1 A 61 61 LYS HA H 61 4.311 4.924 -0.613 1 1 413 . 12 1 1 A 61 61 LYS N N 61 123.743 120.991 2.752 1 1 414 . 12 1 1 A 62 62 THR H H 62 8.149 8.714 -0.565 1 1 415 . 12 1 1 A 62 62 THR HA H 62 4.928 4.698 0.230 1 1 420 . 12 1 1 A 62 62 THR CA C 62 59.427 62.191 -2.764 1 1 421 . 12 1 1 A 62 62 THR CB C 62 66.932 69.155 -2.223 1 1 422 . 12 1 1 A 62 62 THR N N 62 122.829 121.329 1.500 1 1 423 . 12 1 1 A 63 63 TYR H H 63 9.466 9.358 0.108 1 1 424 . 12 1 1 A 63 63 TYR HA H 63 4.606 5.848 -1.242 1 1 431 . 12 1 1 A 63 63 TYR CA C 63 54.508 56.648 -2.140 1 1 432 . 12 1 1 A 63 63 TYR N N 63 127.472 128.875 -1.403 1 1 433 . 12 1 1 A 64 64 GLY H H 64 9.253 8.742 0.511 1 1 434 . 12 1 1 A 64 64 GLY HA2 H 64 4.670 4.314 0.356 1 1 435 . 12 1 1 A 64 64 GLY HA3 H 64 3.619 4.327 -0.708 1 1 436 . 12 1 1 A 64 64 GLY CA C 64 39.885 43.998 -4.113 1 1 437 . 12 1 1 A 64 64 GLY N N 64 110.182 112.000 -1.818 1 1 438 . 12 1 1 A 65 65 ASN H H 65 8.616 8.565 0.051 1 1 439 . 12 1 1 A 65 65 ASN HA H 65 4.109 5.095 -0.986 1 1 444 . 12 1 1 A 65 65 ASN CA C 65 53.691 54.871 -1.180 1 1 445 . 12 1 1 A 65 65 ASN N N 65 117.778 118.335 -0.557 1 1 447 . 12 1 1 A 66 66 GLY H H 66 9.053 8.941 0.112 1 1 448 . 12 1 1 A 66 66 GLY HA2 H 66 4.344 3.882 0.462 1 1 449 . 12 1 1 A 66 66 GLY HA3 H 66 3.359 3.887 -0.528 1 1 450 . 12 1 1 A 66 66 GLY CA C 66 42.431 44.879 -2.448 1 1 451 . 12 1 1 A 66 66 GLY N N 66 115.232 114.184 1.048 1 1 452 . 12 1 1 A 67 67 ASP H H 67 8.120 8.771 -0.651 1 1 453 . 12 1 1 A 67 67 ASP HA H 67 4.844 4.361 0.483 1 1 456 . 12 1 1 A 67 67 ASP N N 67 122.593 122.282 0.311 1 1 457 . 12 1 1 A 68 68 SER H H 68 8.500 8.355 0.145 1 1 458 . 12 1 1 A 68 68 SER HA H 68 5.088 5.020 0.068 1 1 461 . 12 1 1 A 68 68 SER CA C 68 54.858 56.529 -1.671 1 1 462 . 12 1 1 A 68 68 SER CB C 68 62.114 66.482 -4.368 1 1 463 . 12 1 1 A 68 68 SER N N 68 113.557 115.274 -1.717 1 1 464 . 12 1 1 A 69 69 LEU H H 69 8.989 9.312 -0.323 1 1 465 . 12 1 1 A 69 69 LEU HA H 69 4.570 5.234 -0.664 1 1 474 . 12 1 1 A 69 69 LEU N N 69 126.836 121.593 5.243 1 1 475 . 12 1 1 A 70 70 ASN H H 70 8.491 8.870 -0.379 1 1 476 . 12 1 1 A 70 70 ASN HA H 70 4.958 5.157 -0.199 1 1 479 . 12 1 1 A 70 70 ASN CB C 70 33.265 38.376 -5.111 1 1 480 . 12 1 1 A 70 70 ASN N N 70 126.343 122.168 4.175 1 1 481 . 12 1 1 A 71 71 THR H H 71 7.831 8.347 -0.516 1 1 482 . 12 1 1 A 71 71 THR HA H 71 3.759 4.745 -0.986 1 1 487 . 12 1 1 A 71 71 THR CA C 71 61.005 60.199 0.806 1 1 488 . 12 1 1 A 71 71 THR N N 71 114.742 113.438 1.304 1 1 489 . 12 1 1 A 72 72 GLY H H 72 8.880 8.513 0.367 1 1 490 . 12 1 1 A 72 72 GLY HA2 H 72 3.907 3.870 0.037 1 1 491 . 12 1 1 A 72 72 GLY HA3 H 72 3.907 3.871 0.036 1 1 492 . 12 1 1 A 72 72 GLY N N 72 114.976 111.254 3.722 1 1 493 . 12 1 1 A 73 73 LYS H H 73 6.604 7.510 -0.906 1 1 494 . 12 1 1 A 73 73 LYS HA H 73 4.160 4.629 -0.469 1 1 501 . 12 1 1 A 73 73 LYS N N 73 113.898 113.074 0.824 1 1 502 . 12 1 1 A 74 74 LEU H H 74 7.422 8.377 -0.955 1 1 503 . 12 1 1 A 74 74 LEU HA H 74 4.358 4.476 -0.118 1 1 513 . 12 1 1 A 74 74 LEU N N 74 117.180 120.732 -3.552 1 1 514 . 12 1 1 A 75 75 LYS H H 75 8.617 8.517 0.100 1 1 515 . 12 1 1 A 75 75 LYS HA H 75 4.079 4.515 -0.436 1 1 518 . 12 1 1 A 75 75 LYS N N 75 121.119 118.666 2.453 1 1 519 . 12 1 1 A 76 76 ASN H H 76 8.154 8.779 -0.625 1 1 520 . 12 1 1 A 76 76 ASN HA H 76 3.935 5.546 -1.611 1 1 525 . 12 1 1 A 76 76 ASN CB C 76 35.772 39.159 -3.387 1 1 526 . 12 1 1 A 76 76 ASN N N 76 122.761 119.081 3.680 1 1 527 . 12 1 1 A 77 77 ASP H H 77 9.227 7.815 1.412 1 1 528 . 12 1 1 A 77 77 ASP HA H 77 3.787 5.060 -1.273 1 1 531 . 12 1 1 A 77 77 ASP CA C 77 52.584 53.443 -0.859 1 1 532 . 12 1 1 A 77 77 ASP N N 77 114.129 116.922 -2.793 1 1 533 . 12 1 1 A 78 78 LYS H H 78 6.579 8.023 -1.444 1 1 534 . 12 1 1 A 78 78 LYS HA H 78 4.572 4.613 -0.041 1 1 539 . 12 1 1 A 78 78 LYS CA C 78 51.072 55.291 -4.219 1 1 540 . 12 1 1 A 78 78 LYS CB C 78 33.783 36.740 -2.957 1 1 541 . 12 1 1 A 78 78 LYS N N 78 114.135 122.578 -8.443 1 1 542 . 12 1 1 A 79 79 VAL H H 79 8.729 8.492 0.237 1 1 543 . 12 1 1 A 79 79 VAL HA H 79 4.402 4.659 -0.257 1 1 551 . 12 1 1 A 79 79 VAL CA C 79 59.240 60.004 -0.764 1 1 553 . 12 1 1 A 79 79 VAL N N 79 123.191 120.883 2.308 1 1 554 . 12 1 1 A 80 80 SER H H 80 9.542 9.526 0.016 1 1 555 . 12 1 1 A 80 80 SER HA H 80 4.636 4.951 -0.315 1 1 558 . 12 1 1 A 80 80 SER CA C 80 55.978 57.663 -1.685 1 1 559 . 12 1 1 A 80 80 SER N N 80 127.445 121.425 6.020 1 1 560 . 12 1 1 A 81 81 ARG H H 81 8.093 8.542 -0.449 1 1 561 . 12 1 1 A 81 81 ARG HA H 81 5.210 5.501 -0.291 1 1 569 . 12 1 1 A 81 81 ARG N N 81 123.743 123.356 0.387 1 1 571 . 12 1 1 A 82 82 PHE H H 82 9.312 7.904 1.408 1 1 572 . 12 1 1 A 82 82 PHE HA H 82 4.951 5.292 -0.341 1 1 577 . 12 1 1 A 82 82 PHE CA C 82 53.090 56.304 -3.214 1 1 578 . 12 1 1 A 82 82 PHE N N 82 119.529 117.321 2.208 1 1 579 . 12 1 1 A 83 83 ASP H H 83 9.122 8.619 0.503 1 1 580 . 12 1 1 A 83 83 ASP HA H 83 5.593 4.806 0.787 1 1 583 . 12 1 1 A 83 83 ASP N N 83 123.825 122.278 1.547 1 1 584 . 12 1 1 A 84 84 PHE H H 84 9.090 8.347 0.743 1 1 585 . 12 1 1 A 84 84 PHE HA H 84 6.410 6.051 0.359 1 1 592 . 12 1 1 A 84 84 PHE CA C 84 52.584 56.271 -3.687 1 1 593 . 12 1 1 A 84 84 PHE N N 84 118.862 120.109 -1.247 1 1 594 . 12 1 1 A 85 85 ILE H H 85 8.441 8.360 0.081 1 1 595 . 12 1 1 A 85 85 ILE HA H 85 4.662 4.898 -0.236 1 1 605 . 12 1 1 A 85 85 ILE CB C 85 39.939 41.851 -1.912 1 1 608 . 12 1 1 A 85 85 ILE N N 85 118.049 119.875 -1.826 1 1 609 . 12 1 1 A 86 86 ARG H H 86 8.983 8.921 0.062 1 1 610 . 12 1 1 A 86 86 ARG HA H 86 5.591 4.889 0.702 1 1 616 . 12 1 1 A 86 86 ARG N N 86 127.006 127.703 -0.697 1 1 618 . 12 1 1 A 87 87 GLN H H 87 8.643 9.151 -0.508 1 1 619 . 12 1 1 A 87 87 GLN HA H 87 5.630 5.133 0.497 1 1 626 . 12 1 1 A 87 87 GLN CA C 87 51.512 54.302 -2.790 1 1 627 . 12 1 1 A 87 87 GLN N N 87 124.142 122.942 1.200 1 1 629 . 12 1 1 A 88 88 ILE H H 88 8.617 8.921 -0.304 1 1 630 . 12 1 1 A 88 88 ILE HA H 88 4.690 4.867 -0.177 1 1 637 . 12 1 1 A 88 88 ILE CA C 88 56.995 60.565 -3.570 1 1 638 . 12 1 1 A 88 88 ILE CB C 88 39.927 39.988 -0.061 1 1 641 . 12 1 1 A 88 88 ILE N N 88 116.353 124.326 -7.973 1 1 642 . 12 1 1 A 89 89 GLU H H 89 8.298 9.012 -0.714 1 1 643 . 12 1 1 A 89 89 GLU HA H 89 5.100 5.821 -0.721 1 1 646 . 12 1 1 A 89 89 GLU CA C 89 52.204 54.766 -2.562 1 1 647 . 12 1 1 A 89 89 GLU CB C 89 27.325 33.283 -5.958 1 1 648 . 12 1 1 A 89 89 GLU N N 89 124.458 129.388 -4.930 1 1 649 . 12 1 1 A 90 90 VAL H H 90 8.957 8.935 0.022 1 1 650 . 12 1 1 A 90 90 VAL HA H 90 4.169 4.569 -0.400 1 1 658 . 12 1 1 A 90 90 VAL CA C 90 58.664 60.091 -1.427 1 1 659 . 12 1 1 A 90 90 VAL CB C 90 31.861 32.933 -1.072 1 1 660 . 12 1 1 A 90 90 VAL N N 90 127.580 126.977 0.603 1 1 661 . 12 1 1 A 91 91 ASP H H 91 9.369 8.793 0.576 1 1 662 . 12 1 1 A 91 91 ASP HA H 91 4.287 4.552 -0.265 1 1 665 . 12 1 1 A 91 91 ASP CA C 91 52.389 54.574 -2.185 1 1 666 . 12 1 1 A 91 91 ASP CB C 91 36.409 40.684 -4.275 1 1 667 . 12 1 1 A 91 91 ASP N N 91 129.411 124.230 5.181 1 1 668 . 12 1 1 A 92 92 GLY H H 92 8.552 7.466 1.086 1 1 669 . 12 1 1 A 92 92 GLY HA2 H 92 4.090 4.091 -0.001 1 1 670 . 12 1 1 A 92 92 GLY HA3 H 92 3.618 4.091 -0.473 1 1 671 . 12 1 1 A 92 92 GLY CA C 92 42.836 45.588 -2.752 1 1 672 . 12 1 1 A 92 92 GLY N N 92 103.862 106.273 -2.411 1 1 673 . 12 1 1 A 93 93 GLN H H 93 7.808 7.609 0.199 1 1 674 . 12 1 1 A 93 93 GLN HA H 93 4.578 4.833 -0.255 1 1 679 . 12 1 1 A 93 93 GLN CA C 93 50.918 54.300 -3.382 1 1 680 . 12 1 1 A 93 93 GLN CB C 93 28.602 31.184 -2.582 1 1 682 . 12 1 1 A 93 93 GLN N N 93 120.412 118.745 1.667 1 1 683 . 12 1 1 A 94 94 LEU H H 94 8.414 8.446 -0.032 1 1 684 . 12 1 1 A 94 94 LEU HA H 94 4.704 4.242 0.462 1 1 693 . 12 1 1 A 94 94 LEU CB C 94 39.873 42.394 -2.521 1 1 696 . 12 1 1 A 94 94 LEU N N 94 125.061 122.547 2.514 1 1 697 . 12 1 1 A 95 95 ILE H H 95 9.181 8.620 0.561 1 1 698 . 12 1 1 A 95 95 ILE HA H 95 4.371 4.892 -0.521 1 1 708 . 12 1 1 A 95 95 ILE CA C 95 63.319 60.764 2.555 1 1 709 . 12 1 1 A 95 95 ILE CB C 95 37.407 39.640 -2.233 1 1 711 . 12 1 1 A 95 95 ILE N N 95 127.724 121.663 6.061 1 1 712 . 12 1 1 A 96 96 THR H H 96 8.730 7.438 1.292 1 1 713 . 12 1 1 A 96 96 THR HA H 96 4.411 4.951 -0.540 1 1 718 . 12 1 1 A 96 96 THR CA C 96 60.344 62.995 -2.651 1 1 719 . 12 1 1 A 96 96 THR CB C 96 59.719 69.595 -9.876 1 1 720 . 12 1 1 A 96 96 THR N N 96 124.240 118.593 5.647 1 1 721 . 12 1 1 A 97 97 LEU H H 97 8.790 8.716 0.074 1 1 722 . 12 1 1 A 97 97 LEU HA H 97 4.400 4.985 -0.585 1 1 732 . 12 1 1 A 97 97 LEU N N 97 126.147 124.409 1.738 1 1 733 . 12 1 1 A 98 98 GLU H H 98 7.596 9.052 -1.456 1 1 734 . 12 1 1 A 98 98 GLU HA H 98 5.102 4.870 0.232 1 1 739 . 12 1 1 A 98 98 GLU N N 98 116.937 122.998 -6.061 1 1 740 . 12 1 1 A 99 99 SER H H 99 8.906 8.817 0.089 1 1 741 . 12 1 1 A 99 99 SER HA H 99 4.504 5.333 -0.829 1 1 744 . 12 1 1 A 99 99 SER CA C 99 54.010 56.469 -2.459 1 1 745 . 12 1 1 A 99 99 SER CB C 99 63.876 66.136 -2.260 1 1 746 . 12 1 1 A 99 99 SER N N 99 117.823 118.147 -0.324 1 1 747 . 12 1 1 A 100 100 GLY H H 100 7.250 8.373 -1.123 1 1 748 . 12 1 1 A 100 100 GLY HA2 H 100 4.872 3.752 1.120 1 1 749 . 12 1 1 A 100 100 GLY HA3 H 100 3.731 3.847 -0.116 1 1 750 . 12 1 1 A 100 100 GLY N N 100 109.436 109.929 -0.493 1 1 751 . 12 1 1 A 101 101 GLU H H 101 9.661 8.166 1.495 1 1 752 . 12 1 1 A 101 101 GLU HA H 101 5.643 4.458 1.185 1 1 757 . 12 1 1 A 101 101 GLU CA C 101 52.584 55.014 -2.430 1 1 758 . 12 1 1 A 101 101 GLU CB C 101 31.750 31.257 0.493 1 1 759 . 12 1 1 A 101 101 GLU N N 101 126.793 120.588 6.205 1 1 760 . 12 1 1 A 102 102 PHE H H 102 10.441 8.244 2.197 1 1 761 . 12 1 1 A 102 102 PHE HA H 102 5.248 5.228 0.020 1 1 768 . 12 1 1 A 102 102 PHE CA C 102 53.537 56.147 -2.610 1 1 769 . 12 1 1 A 102 102 PHE N N 102 131.837 125.795 6.042 1 1 770 . 12 1 1 A 103 103 GLN H H 103 9.135 9.869 -0.734 1 1 771 . 12 1 1 A 103 103 GLN HA H 103 5.205 4.908 0.297 1 1 776 . 12 1 1 A 103 103 GLN CA C 103 50.925 54.635 -3.710 1 1 777 . 12 1 1 A 103 103 GLN N N 103 127.720 126.142 1.578 1 1 778 . 12 1 1 A 104 104 VAL H H 104 8.937 9.021 -0.084 1 1 779 . 12 1 1 A 104 104 VAL HA H 104 4.780 4.878 -0.098 1 1 787 . 12 1 1 A 104 104 VAL CA C 104 57.086 61.543 -4.457 1 1 789 . 12 1 1 A 104 104 VAL N N 104 120.097 125.346 -5.249 1 1 790 . 12 1 1 A 105 105 TYR H H 105 9.108 9.163 -0.055 1 1 791 . 12 1 1 A 105 105 TYR HA H 105 4.834 4.826 0.008 1 1 798 . 12 1 1 A 105 105 TYR CA C 105 54.486 59.161 -4.675 1 1 799 . 12 1 1 A 105 105 TYR N N 105 128.426 129.114 -0.688 1 1 800 . 12 1 1 A 106 106 LYS H H 106 5.945 9.062 -3.117 1 1 805 . 12 1 1 A 106 106 LYS N N 106 129.163 123.549 5.614 1 1 806 . 12 1 1 A 107 107 GLN H H 107 8.526 9.162 -0.636 1 1 807 . 12 1 1 A 107 107 GLN HA H 107 5.160 4.842 0.318 1 1 812 . 12 1 1 A 107 107 GLN CA C 107 52.584 55.006 -2.422 1 1 813 . 12 1 1 A 107 107 GLN CB C 107 26.175 30.364 -4.189 1 1 814 . 12 1 1 A 107 107 GLN N N 107 125.978 122.935 3.043 1 1 815 . 12 1 1 A 108 108 SER H H 108 8.621 8.714 -0.093 1 1 816 . 12 1 1 A 108 108 SER HA H 108 4.403 4.378 0.025 1 1 819 . 12 1 1 A 108 108 SER CA C 108 58.521 60.579 -2.058 1 1 820 . 12 1 1 A 108 108 SER CB C 108 60.737 63.938 -3.201 1 1 821 . 12 1 1 A 108 108 SER N N 108 117.542 119.862 -2.320 1 1 822 . 12 1 1 A 109 109 HIS H H 109 10.381 7.950 2.431 1 1 823 . 12 1 1 A 109 109 HIS HA H 109 4.594 4.754 -0.160 1 1 828 . 12 1 1 A 109 109 HIS CA C 109 51.743 55.524 -3.781 1 1 829 . 12 1 1 A 109 109 HIS CB C 109 27.174 30.399 -3.225 1 1 830 . 12 1 1 A 109 109 HIS N N 109 118.449 116.458 1.991 1 1 831 . 12 1 1 A 110 110 SER H H 110 7.366 7.831 -0.465 1 1 832 . 12 1 1 A 110 110 SER HA H 110 4.870 4.610 0.260 1 1 835 . 12 1 1 A 110 110 SER CB C 110 62.986 65.363 -2.377 1 1 836 . 12 1 1 A 110 110 SER N N 110 113.397 112.349 1.048 1 1 837 . 12 1 1 A 111 111 ALA H H 111 8.541 8.251 0.290 1 1 838 . 12 1 1 A 111 111 ALA HA H 111 4.826 5.014 -0.188 1 1 842 . 12 1 1 A 111 111 ALA CA C 111 49.015 51.704 -2.689 1 1 843 . 12 1 1 A 111 111 ALA CB C 111 20.256 23.044 -2.788 1 1 844 . 12 1 1 A 111 111 ALA N N 111 117.786 123.009 -5.223 1 1 845 . 12 1 1 A 112 112 LEU H H 112 8.529 8.889 -0.360 1 1 846 . 12 1 1 A 112 112 LEU HA H 112 5.680 5.130 0.550 1 1 855 . 12 1 1 A 112 112 LEU CA C 112 51.818 53.307 -1.489 1 1 856 . 12 1 1 A 112 112 LEU N N 112 116.345 119.840 -3.495 1 1 857 . 12 1 1 A 113 113 THR H H 113 8.758 9.311 -0.553 1 1 858 . 12 1 1 A 113 113 THR HA H 113 5.563 5.234 0.329 1 1 863 . 12 1 1 A 113 113 THR CA C 113 54.458 60.886 -6.428 1 1 864 . 12 1 1 A 113 113 THR CB C 113 68.586 73.420 -4.834 1 1 866 . 12 1 1 A 113 113 THR N N 113 110.469 114.441 -3.972 1 1 867 . 12 1 1 A 114 114 ALA H H 114 8.829 8.729 0.100 1 1 868 . 12 1 1 A 114 114 ALA HA H 114 4.466 4.970 -0.504 1 1 872 . 12 1 1 A 114 114 ALA CA C 114 48.886 52.087 -3.201 1 1 873 . 12 1 1 A 114 114 ALA CB C 114 21.583 21.667 -0.084 1 1 874 . 12 1 1 A 114 114 ALA N N 114 121.456 123.339 -1.883 1 1 875 . 12 1 1 A 115 115 LEU H H 115 8.407 9.691 -1.284 1 1 876 . 12 1 1 A 115 115 LEU HA H 115 4.814 4.777 0.037 1 1 886 . 12 1 1 A 115 115 LEU N N 115 119.223 123.605 -4.382 1 1 887 . 12 1 1 A 116 116 GLN H H 116 9.720 8.460 1.260 1 1 888 . 12 1 1 A 116 116 GLN HA H 116 5.312 4.254 1.058 1 1 893 . 12 1 1 A 116 116 GLN CA C 116 50.544 53.814 -3.270 1 1 894 . 12 1 1 A 116 116 GLN N N 116 127.827 122.215 5.612 1 1 895 . 12 1 1 A 117 117 THR H H 117 9.663 8.598 1.065 1 1 896 . 12 1 1 A 117 117 THR HA H 117 4.198 4.671 -0.473 1 1 901 . 12 1 1 A 117 117 THR CA C 117 64.037 60.462 3.575 1 1 902 . 12 1 1 A 117 117 THR CB C 117 66.868 72.653 -5.785 1 1 904 . 12 1 1 A 117 117 THR N N 117 128.929 120.813 8.116 1 1 905 . 12 1 1 A 118 118 GLU H H 118 9.486 8.195 1.291 1 1 906 . 12 1 1 A 118 118 GLU HA H 118 4.885 4.616 0.269 1 1 911 . 12 1 1 A 118 118 GLU N N 118 123.497 119.438 4.059 1 1 912 . 12 1 1 A 119 119 GLN H H 119 8.076 7.038 1.038 1 1 913 . 12 1 1 A 119 119 GLN HA H 119 5.331 4.848 0.483 1 1 916 . 12 1 1 A 119 119 GLN CA C 119 51.858 54.134 -2.276 1 1 917 . 12 1 1 A 119 119 GLN N N 119 118.023 119.805 -1.782 1 1 918 . 12 1 1 A 120 120 GLU H H 120 9.078 9.523 -0.445 1 1 919 . 12 1 1 A 120 120 GLU HA H 120 5.071 4.862 0.209 1 1 924 . 12 1 1 A 120 120 GLU N N 120 118.433 124.707 -6.274 1 1 925 . 12 1 1 A 121 121 GLN H H 121 7.711 8.830 -1.119 1 1 926 . 12 1 1 A 121 121 GLN HA H 121 4.430 5.076 -0.646 1 1 933 . 12 1 1 A 121 121 GLN CA C 121 53.996 53.991 0.005 1 1 934 . 12 1 1 A 121 121 GLN CB C 121 27.158 32.053 -4.895 1 1 936 . 12 1 1 A 121 121 GLN N N 121 122.412 124.700 -2.288 1 1 938 . 12 1 1 A 122 122 ASP H H 122 8.675 9.904 -1.229 1 1 939 . 12 1 1 A 122 122 ASP HA H 122 4.632 5.201 -0.569 1 1 942 . 12 1 1 A 122 122 ASP CA C 122 48.797 50.818 -2.021 1 1 943 . 12 1 1 A 122 122 ASP CB C 122 39.852 42.742 -2.890 1 1 944 . 12 1 1 A 122 122 ASP N N 122 128.625 122.274 6.351 1 1 945 . 12 1 1 A 123 123 PRO CA C 123 61.579 62.693 -1.114 1 1 946 . 12 1 1 A 123 123 PRO CB C 123 29.597 29.486 0.111 1 1 948 . 12 1 1 A 124 124 GLU H H 124 8.297 8.592 -0.295 1 1 949 . 12 1 1 A 124 124 GLU HA H 124 4.196 4.280 -0.084 1 1 954 . 12 1 1 A 124 124 GLU CA C 124 53.025 57.400 -4.375 1 1 955 . 12 1 1 A 124 124 GLU CB C 124 27.927 31.276 -3.349 1 1 957 . 12 1 1 A 124 124 GLU N N 124 115.538 121.854 -6.316 1 1 958 . 12 1 1 A 125 125 HIS H H 125 7.419 7.288 0.131 1 1 959 . 12 1 1 A 125 125 HIS HA H 125 4.833 4.605 0.228 1 1 964 . 12 1 1 A 125 125 HIS CA C 125 51.886 56.286 -4.400 1 1 965 . 12 1 1 A 125 125 HIS CB C 125 26.387 30.852 -4.465 1 1 966 . 12 1 1 A 125 125 HIS N N 125 117.464 115.987 1.477 1 1 967 . 12 1 1 A 126 126 SER H H 126 8.441 8.494 -0.053 1 1 968 . 12 1 1 A 126 126 SER HA H 126 4.261 4.725 -0.464 1 1 971 . 12 1 1 A 126 126 SER CA C 126 57.988 57.224 0.764 1 1 972 . 12 1 1 A 126 126 SER N N 126 117.954 114.411 3.543 1 1 973 . 12 1 1 A 127 127 GLU H H 127 9.221 7.716 1.505 1 1 974 . 12 1 1 A 127 127 GLU HA H 127 4.366 4.521 -0.155 1 1 979 . 12 1 1 A 127 127 GLU CA C 127 53.707 56.375 -2.668 1 1 980 . 12 1 1 A 127 127 GLU CB C 127 25.492 30.249 -4.757 1 1 981 . 12 1 1 A 127 127 GLU N N 127 120.404 121.000 -0.596 1 1 982 . 12 1 1 A 128 128 LYS H H 128 8.262 8.095 0.167 1 1 983 . 12 1 1 A 128 128 LYS HA H 128 4.661 4.047 0.614 1 1 990 . 12 1 1 A 128 128 LYS CA C 128 52.264 58.336 -6.072 1 1 991 . 12 1 1 A 128 128 LYS CB C 128 32.404 31.764 0.640 1 1 994 . 12 1 1 A 128 128 LYS N N 128 122.166 117.732 4.434 1 1 995 . 12 1 1 A 129 129 MET H H 129 8.242 7.667 0.575 1 1 996 . 12 1 1 A 129 129 MET HA H 129 5.012 4.933 0.079 1 1 1001 . 12 1 1 A 129 129 MET CA C 129 50.958 54.970 -4.012 1 1 1003 . 12 1 1 A 129 129 MET N N 129 119.422 118.808 0.614 1 1 1004 . 12 1 1 A 130 130 VAL H H 130 9.200 10.205 -1.005 1 1 1005 . 12 1 1 A 130 130 VAL HA H 130 4.609 4.756 -0.147 1 1 1013 . 12 1 1 A 130 130 VAL CA C 130 56.296 60.327 -4.031 1 1 1014 . 12 1 1 A 130 130 VAL CB C 130 32.606 36.227 -3.621 1 1 1015 . 12 1 1 A 130 130 VAL N N 130 118.290 123.465 -5.175 1 1 1016 . 12 1 1 A 131 131 ALA H H 131 8.368 8.906 -0.538 1 1 1017 . 12 1 1 A 131 131 ALA HA H 131 4.654 5.191 -0.537 1 1 1021 . 12 1 1 A 131 131 ALA CA C 131 49.739 50.373 -0.634 1 1 1022 . 12 1 1 A 131 131 ALA CB C 131 15.351 21.038 -5.687 1 1 1023 . 12 1 1 A 131 131 ALA N N 131 126.734 125.703 1.031 1 1 1024 . 12 1 1 A 132 132 LYS H H 132 7.732 8.867 -1.135 1 1 1025 . 12 1 1 A 132 132 LYS HA H 132 4.171 4.884 -0.713 1 1 1028 . 12 1 1 A 132 132 LYS N N 132 127.309 122.328 4.981 1 1 1029 . 12 1 1 A 133 133 ARG H H 133 8.193 8.531 -0.338 1 1 1030 . 12 1 1 A 133 133 ARG HA H 133 5.073 5.102 -0.029 1 1 1038 . 12 1 1 A 133 133 ARG N N 133 122.190 120.270 1.920 1 1 1040 . 12 1 1 A 134 134 ARG H H 134 7.539 8.928 -1.389 1 1 1041 . 12 1 1 A 134 134 ARG HA H 134 4.667 5.031 -0.364 1 1 1049 . 12 1 1 A 134 134 ARG CA C 134 52.584 54.860 -2.276 1 1 1050 . 12 1 1 A 134 134 ARG CB C 134 31.325 32.234 -0.909 1 1 1052 . 12 1 1 A 134 134 ARG N N 134 121.632 125.424 -3.792 1 1 1054 . 12 1 1 A 135 135 PHE H H 135 8.816 9.231 -0.415 1 1 1055 . 12 1 1 A 135 135 PHE HA H 135 5.680 5.273 0.407 1 1 1062 . 12 1 1 A 135 135 PHE N N 135 125.107 125.000 0.107 1 1 1063 . 12 1 1 A 136 136 ARG H H 136 7.741 9.569 -1.828 1 1 1064 . 12 1 1 A 136 136 ARG HA H 136 4.402 5.059 -0.657 1 1 1068 . 12 1 1 A 136 136 ARG N N 136 125.640 124.024 1.616 1 1 1070 . 12 1 1 A 137 137 ILE H H 137 8.556 8.746 -0.190 1 1 1071 . 12 1 1 A 137 137 ILE HA H 137 3.912 5.018 -1.106 1 1 1076 . 12 1 1 A 137 137 ILE CA C 137 55.676 59.055 -3.379 1 1 1079 . 12 1 1 A 137 137 ILE N N 137 122.891 119.434 3.457 1 1 1080 . 12 1 1 A 138 138 GLY H H 138 8.676 7.943 0.733 1 1 1081 . 12 1 1 A 138 138 GLY HA2 H 138 3.740 4.362 -0.622 1 1 1082 . 12 1 1 A 138 138 GLY HA3 H 138 2.982 4.387 -1.405 1 1 1083 . 12 1 1 A 138 138 GLY CA C 138 41.908 45.645 -3.737 1 1 1084 . 12 1 1 A 138 138 GLY N N 138 117.058 109.847 7.211 1 1 1085 . 12 1 1 A 139 139 ASP H H 139 7.858 8.763 -0.905 1 1 1086 . 12 1 1 A 139 139 ASP HA H 139 4.753 5.346 -0.593 1 1 1089 . 12 1 1 A 139 139 ASP CA C 139 52.584 53.401 -0.817 1 1 1090 . 12 1 1 A 139 139 ASP CB C 139 43.062 44.170 -1.108 1 1 1091 . 12 1 1 A 139 139 ASP N N 139 124.516 118.214 6.302 1 1 1092 . 12 1 1 A 140 140 ILE H H 140 8.354 9.016 -0.662 1 1 1093 . 12 1 1 A 140 140 ILE HA H 140 4.473 4.433 0.040 1 1 1103 . 12 1 1 A 140 140 ILE CB C 140 36.173 38.827 -2.654 1 1 1105 . 12 1 1 A 140 140 ILE N N 140 120.679 121.592 -0.913 1 1 1106 . 12 1 1 A 141 141 ALA H H 141 8.708 8.223 0.485 1 1 1107 . 12 1 1 A 141 141 ALA HA H 141 4.862 4.359 0.503 1 1 1111 . 12 1 1 A 141 141 ALA CA C 141 47.968 52.657 -4.689 1 1 1112 . 12 1 1 A 141 141 ALA CB C 141 21.733 18.874 2.859 1 1 1113 . 12 1 1 A 141 141 ALA N N 141 130.144 130.745 -0.601 1 1 1114 . 12 1 1 A 142 142 GLY H H 142 7.888 8.525 -0.637 1 1 1115 . 12 1 1 A 142 142 GLY HA2 H 142 4.519 3.932 0.587 1 1 1116 . 12 1 1 A 142 142 GLY HA3 H 142 3.634 3.964 -0.330 1 1 1117 . 12 1 1 A 142 142 GLY N N 142 102.272 109.327 -7.055 1 1 1118 . 12 1 1 A 143 143 GLU H H 143 8.068 8.234 -0.166 1 1 1119 . 12 1 1 A 143 143 GLU HA H 143 4.577 4.552 0.025 1 1 1124 . 12 1 1 A 143 143 GLU N N 143 120.569 115.063 5.506 1 1 1125 . 12 1 1 A 144 144 HIS H H 144 8.478 8.044 0.434 1 1 1126 . 12 1 1 A 144 144 HIS HA H 144 4.968 4.674 0.294 1 1 1131 . 12 1 1 A 144 144 HIS N N 144 124.275 118.806 5.469 1 1 1132 . 12 1 1 A 145 145 THR H H 145 9.031 8.653 0.378 1 1 1133 . 12 1 1 A 145 145 THR HA H 145 4.025 4.973 -0.948 1 1 1138 . 12 1 1 A 145 145 THR CA C 145 61.247 60.668 0.579 1 1 1139 . 12 1 1 A 145 145 THR CB C 145 65.181 70.095 -4.914 1 1 1141 . 12 1 1 A 145 145 THR N N 145 125.828 114.725 11.103 1 1 1142 . 12 1 1 A 146 146 SER H H 146 9.077 8.857 0.220 1 1 1143 . 12 1 1 A 146 146 SER HA H 146 4.684 4.797 -0.113 1 1 1145 . 12 1 1 A 146 146 SER CA C 146 56.067 58.364 -2.297 1 1 1146 . 12 1 1 A 146 146 SER CB C 146 60.510 64.072 -3.562 1 1 1147 . 12 1 1 A 146 146 SER N N 146 124.154 117.590 6.564 1 1 1148 . 12 1 1 A 147 147 PHE H H 147 9.049 9.299 -0.250 1 1 1149 . 12 1 1 A 147 147 PHE HA H 147 4.022 4.330 -0.308 1 1 1154 . 12 1 1 A 147 147 PHE N N 147 127.670 128.076 -0.406 1 1 1155 . 12 1 1 A 148 148 ASP H H 148 8.504 8.678 -0.174 1 1 1156 . 12 1 1 A 148 148 ASP HA H 148 4.422 4.336 0.086 1 1 1158 . 12 1 1 A 148 148 ASP CA C 148 52.584 57.592 -5.008 1 1 1159 . 12 1 1 A 148 148 ASP CB C 148 37.800 40.751 -2.951 1 1 1160 . 12 1 1 A 148 148 ASP N N 148 114.377 120.333 -5.956 1 1 1161 . 12 1 1 A 149 149 LYS H H 149 7.380 8.180 -0.800 1 1 1162 . 12 1 1 A 149 149 LYS HA H 149 4.487 4.398 0.089 1 1 1171 . 12 1 1 A 149 149 LYS CA C 149 51.735 56.355 -4.620 1 1 1172 . 12 1 1 A 149 149 LYS CB C 149 30.162 32.622 -2.460 1 1 1175 . 12 1 1 A 149 149 LYS N N 149 119.137 116.272 2.865 1 1 1176 . 12 1 1 A 150 150 LEU H H 150 6.886 7.893 -1.007 1 1 1177 . 12 1 1 A 150 150 LEU HA H 150 3.996 4.471 -0.475 1 1 1186 . 12 1 1 A 150 150 LEU CA C 150 50.502 52.976 -2.474 1 1 1187 . 12 1 1 A 150 150 LEU N N 150 120.614 121.003 -0.389 1 1 1188 . 12 1 1 A 151 151 PRO CB C 151 29.567 31.028 -1.461 1 1 1190 . 12 1 1 A 152 152 LYS H H 152 8.076 8.606 -0.530 1 1 1191 . 12 1 1 A 152 152 LYS HA H 152 4.346 4.653 -0.307 1 1 1195 . 12 1 1 A 152 152 LYS CA C 152 53.182 54.884 -1.702 1 1 1196 . 12 1 1 A 152 152 LYS CB C 152 31.487 32.664 -1.177 1 1 1198 . 12 1 1 A 152 152 LYS N N 152 118.133 123.878 -5.745 1 1 1199 . 12 1 1 A 153 153 ASP H H 153 7.982 8.592 -0.610 1 1 1200 . 12 1 1 A 153 153 ASP HA H 153 4.402 4.794 -0.392 1 1 1203 . 12 1 1 A 153 153 ASP CA C 153 52.584 54.077 -1.493 1 1 1204 . 12 1 1 A 153 153 ASP CB C 153 37.762 39.003 -1.241 1 1 1205 . 12 1 1 A 153 153 ASP N N 153 115.735 124.410 -8.675 1 1 1206 . 12 1 1 A 154 154 VAL H H 154 6.987 10.254 -3.267 1 1 1207 . 12 1 1 A 154 154 VAL HA H 154 4.406 4.738 -0.332 1 1 1215 . 12 1 1 A 154 154 VAL CA C 154 58.408 60.733 -2.325 1 1 1216 . 12 1 1 A 154 154 VAL CB C 154 32.617 34.227 -1.610 1 1 1217 . 12 1 1 A 154 154 VAL N N 154 116.266 120.192 -3.926 1 1 1218 . 12 1 1 A 155 155 MET H H 155 8.444 8.790 -0.346 1 1 1219 . 12 1 1 A 155 155 MET HA H 155 5.416 4.523 0.893 1 1 1224 . 12 1 1 A 155 155 MET CA C 155 51.183 56.354 -5.171 1 1 1226 . 12 1 1 A 155 155 MET N N 155 124.950 128.060 -3.110 1 1 1227 . 12 1 1 A 156 156 ALA H H 156 9.226 9.100 0.126 1 1 1228 . 12 1 1 A 156 156 ALA HA H 156 4.693 5.207 -0.514 1 1 1232 . 12 1 1 A 156 156 ALA CA C 156 48.379 50.456 -2.077 1 1 1233 . 12 1 1 A 156 156 ALA CB C 156 21.051 20.593 0.458 1 1 1234 . 12 1 1 A 156 156 ALA N N 156 129.938 127.779 2.159 1 1 1235 . 12 1 1 A 157 157 THR H H 157 8.554 8.862 -0.308 1 1 1236 . 12 1 1 A 157 157 THR HA H 157 4.839 4.623 0.216 1 1 1241 . 12 1 1 A 157 157 THR CA C 157 59.555 63.173 -3.618 1 1 1242 . 12 1 1 A 157 157 THR CB C 157 68.575 70.068 -1.493 1 1 1244 . 12 1 1 A 157 157 THR N N 157 118.815 118.535 0.280 1 1 1245 . 12 1 1 A 158 158 TYR H H 158 9.974 10.165 -0.191 1 1 1246 . 12 1 1 A 158 158 TYR HA H 158 4.435 5.153 -0.718 1 1 1253 . 12 1 1 A 158 158 TYR N N 158 126.958 122.888 4.070 1 1 1254 . 12 1 1 A 159 159 ARG H H 159 8.909 8.676 0.233 1 1 1255 . 12 1 1 A 159 159 ARG HA H 159 5.444 5.205 0.239 1 1 1263 . 12 1 1 A 159 159 ARG CA C 159 51.933 54.471 -2.538 1 1 1264 . 12 1 1 A 159 159 ARG N N 159 121.721 119.584 2.137 1 1 1266 . 12 1 1 A 160 160 GLY H H 160 8.910 8.292 0.618 1 1 1267 . 12 1 1 A 160 160 GLY HA2 H 160 4.904 4.308 0.596 1 1 1268 . 12 1 1 A 160 160 GLY HA3 H 160 4.484 4.505 -0.021 1 1 1269 . 12 1 1 A 160 160 GLY N N 160 113.921 107.814 6.107 1 1 1270 . 12 1 1 A 161 161 THR H H 161 9.110 9.692 -0.582 1 1 1271 . 12 1 1 A 161 161 THR HA H 161 4.810 5.353 -0.543 1 1 1276 . 12 1 1 A 161 161 THR CA C 161 59.603 61.151 -1.548 1 1 1277 . 12 1 1 A 161 161 THR CB C 161 69.909 72.017 -2.108 1 1 1279 . 12 1 1 A 161 161 THR N N 161 126.813 115.473 11.340 1 1 1280 . 12 1 1 A 162 162 ALA H H 162 7.137 8.978 -1.841 1 1 1281 . 12 1 1 A 162 162 ALA HA H 162 5.361 4.849 0.512 1 1 1285 . 12 1 1 A 162 162 ALA CA C 162 46.573 51.118 -4.545 1 1 1286 . 12 1 1 A 162 162 ALA CB C 162 20.959 23.526 -2.567 1 1 1287 . 12 1 1 A 162 162 ALA N N 162 128.111 123.644 4.467 1 1 1288 . 12 1 1 A 163 163 PHE H H 163 8.587 8.363 0.224 1 1 1289 . 12 1 1 A 163 163 PHE HA H 163 5.538 5.307 0.231 1 1 1296 . 12 1 1 A 163 163 PHE N N 163 117.349 114.914 2.435 1 1 1297 . 12 1 1 A 164 164 GLY H H 164 8.650 8.421 0.229 1 1 1298 . 12 1 1 A 164 164 GLY HA2 H 164 4.210 3.814 0.396 1 1 1299 . 12 1 1 A 164 164 GLY HA3 H 164 3.285 3.936 -0.651 1 1 1300 . 12 1 1 A 164 164 GLY CA C 164 40.377 45.045 -4.668 1 1 1301 . 12 1 1 A 164 164 GLY N N 164 108.839 108.912 -0.073 1 1 1302 . 12 1 1 A 165 165 SER H H 165 7.684 9.871 -2.187 1 1 1303 . 12 1 1 A 165 165 SER HA H 165 3.458 3.886 -0.428 1 1 1304 . 12 1 1 A 165 165 SER N N 165 116.037 117.203 -1.166 1 1 1305 . 12 1 1 A 166 166 ASP H H 166 9.718 8.369 1.349 1 1 1306 . 12 1 1 A 166 166 ASP HA H 166 4.281 4.441 -0.160 1 1 1309 . 12 1 1 A 166 166 ASP CA C 166 52.584 56.669 -4.085 1 1 1310 . 12 1 1 A 166 166 ASP N N 166 125.166 121.831 3.335 1 1 1311 . 12 1 1 A 167 167 ASP H H 167 7.655 8.094 -0.439 1 1 1312 . 12 1 1 A 167 167 ASP HA H 167 4.666 5.028 -0.362 1 1 1315 . 12 1 1 A 167 167 ASP CB C 167 38.948 42.665 -3.717 1 1 1316 . 12 1 1 A 167 167 ASP N N 167 117.491 118.194 -0.703 1 1 1317 . 12 1 1 A 168 168 ALA H H 168 8.585 8.419 0.166 1 1 1318 . 12 1 1 A 168 168 ALA HA H 168 5.012 5.120 -0.108 1 1 1322 . 12 1 1 A 168 168 ALA CA C 168 47.485 51.428 -3.943 1 1 1323 . 12 1 1 A 168 168 ALA N N 168 128.834 121.455 7.379 1 1 1324 . 12 1 1 A 169 169 GLY H H 169 8.472 7.806 0.666 1 1 1325 . 12 1 1 A 169 169 GLY HA2 H 169 4.404 2.814 1.590 1 1 1326 . 12 1 1 A 169 169 GLY HA3 H 169 4.051 3.943 0.108 1 1 1327 . 12 1 1 A 169 169 GLY CA C 169 43.257 44.012 -0.755 1 1 1328 . 12 1 1 A 169 169 GLY N N 169 107.133 107.013 0.120 1 1 1329 . 12 1 1 A 170 170 GLY H H 170 7.229 8.183 -0.954 1 1 1330 . 12 1 1 A 170 170 GLY HA2 H 170 4.223 4.057 0.166 1 1 1331 . 12 1 1 A 170 170 GLY HA3 H 170 3.781 4.137 -0.356 1 1 1332 . 12 1 1 A 170 170 GLY CA C 170 43.310 45.559 -2.249 1 1 1333 . 12 1 1 A 170 170 GLY N N 170 107.542 108.240 -0.698 1 1 1334 . 12 1 1 A 171 171 LYS H H 171 9.641 9.046 0.595 1 1 1335 . 12 1 1 A 171 171 LYS HA H 171 5.129 4.918 0.211 1 1 1342 . 12 1 1 A 171 171 LYS CA C 171 51.355 55.543 -4.188 1 1 1343 . 12 1 1 A 171 171 LYS N N 171 124.322 125.193 -0.871 1 1 1344 . 12 1 1 A 172 172 LEU H H 172 7.764 8.720 -0.956 1 1 1345 . 12 1 1 A 172 172 LEU HA H 172 4.973 5.622 -0.649 1 1 1353 . 12 1 1 A 172 172 LEU CA C 172 50.348 53.468 -3.120 1 1 1354 . 12 1 1 A 172 172 LEU N N 172 126.389 123.054 3.335 1 1 1355 . 12 1 1 A 173 173 THR H H 173 8.321 8.683 -0.362 1 1 1356 . 12 1 1 A 173 173 THR HA H 173 5.017 4.922 0.095 1 1 1361 . 12 1 1 A 173 173 THR CA C 173 59.149 62.011 -2.862 1 1 1362 . 12 1 1 A 173 173 THR CB C 173 67.449 69.307 -1.858 1 1 1364 . 12 1 1 A 173 173 THR N N 173 123.553 120.327 3.226 1 1 1365 . 12 1 1 A 174 174 TYR H H 174 9.367 9.782 -0.415 1 1 1366 . 12 1 1 A 174 174 TYR HA H 174 4.660 5.014 -0.354 1 1 1373 . 12 1 1 A 174 174 TYR CB C 174 41.267 40.750 0.517 1 1 1374 . 12 1 1 A 174 174 TYR N N 174 129.583 127.233 2.350 1 1 1375 . 12 1 1 A 175 175 THR H H 175 8.529 9.625 -1.096 1 1 1376 . 12 1 1 A 175 175 THR HA H 175 5.388 5.077 0.311 1 1 1381 . 12 1 1 A 175 175 THR CA C 175 58.216 61.766 -3.550 1 1 1382 . 12 1 1 A 175 175 THR CB C 175 68.575 70.920 -2.345 1 1 1384 . 12 1 1 A 175 175 THR N N 175 125.967 115.598 10.369 1 1 1385 . 12 1 1 A 176 176 ILE H H 176 9.139 8.542 0.597 1 1 1386 . 12 1 1 A 176 176 ILE HA H 176 4.382 5.168 -0.786 1 1 1395 . 12 1 1 A 176 176 ILE CA C 176 58.006 58.996 -0.990 1 1 1396 . 12 1 1 A 176 176 ILE CB C 176 38.881 42.124 -3.243 1 1 1400 . 12 1 1 A 176 176 ILE N N 176 123.715 120.972 2.743 1 1 1401 . 12 1 1 A 177 177 ASP H H 177 8.501 9.289 -0.788 1 1 1402 . 12 1 1 A 177 177 ASP HA H 177 5.011 5.181 -0.170 1 1 1405 . 12 1 1 A 177 177 ASP CA C 177 49.089 52.145 -3.056 1 1 1406 . 12 1 1 A 177 177 ASP CB C 177 39.282 43.589 -4.307 1 1 1407 . 12 1 1 A 177 177 ASP N N 177 125.978 122.606 3.372 1 1 1408 . 12 1 1 A 178 178 PHE H H 178 8.913 8.635 0.278 1 1 1409 . 12 1 1 A 178 178 PHE HA H 178 3.993 4.354 -0.361 1 1 1414 . 12 1 1 A 178 178 PHE CB C 178 34.588 39.742 -5.154 1 1 1415 . 12 1 1 A 178 178 PHE N N 178 123.522 124.251 -0.729 1 1 1416 . 12 1 1 A 179 179 ALA H H 179 8.487 9.282 -0.795 1 1 1417 . 12 1 1 A 179 179 ALA HA H 179 4.528 4.060 0.468 1 1 1421 . 12 1 1 A 179 179 ALA CA C 179 52.584 54.469 -1.885 1 1 1422 . 12 1 1 A 179 179 ALA CB C 179 15.666 18.648 -2.982 1 1 1423 . 12 1 1 A 179 179 ALA N N 179 124.061 122.720 1.341 1 1 1424 . 12 1 1 A 180 180 ALA H H 180 7.162 7.658 -0.496 1 1 1425 . 12 1 1 A 180 180 ALA HA H 180 4.313 4.838 -0.525 1 1 1429 . 12 1 1 A 180 180 ALA CA C 180 49.006 54.723 -5.717 1 1 1430 . 12 1 1 A 180 180 ALA CB C 180 16.933 19.310 -2.377 1 1 1431 . 12 1 1 A 180 180 ALA N N 180 119.710 120.633 -0.923 1 1 1432 . 12 1 1 A 181 181 LYS H H 181 8.092 7.865 0.227 1 1 1433 . 12 1 1 A 181 181 LYS HA H 181 3.457 4.622 -1.165 1 1 1440 . 12 1 1 A 181 181 LYS CA C 181 54.783 55.588 -0.805 1 1 1441 . 12 1 1 A 181 181 LYS CB C 181 27.088 32.979 -5.891 1 1 1444 . 12 1 1 A 181 181 LYS N N 181 114.996 115.575 -0.579 1 1 1445 . 12 1 1 A 182 182 GLN H H 182 7.532 7.450 0.082 1 1 1446 . 12 1 1 A 182 182 GLN HA H 182 5.304 4.870 0.434 1 1 1453 . 12 1 1 A 182 182 GLN CA C 182 51.473 54.530 -3.057 1 1 1454 . 12 1 1 A 182 182 GLN CB C 182 31.585 33.190 -1.605 1 1 1455 . 12 1 1 A 182 182 GLN N N 182 115.064 120.346 -5.282 1 1 1457 . 12 1 1 A 183 183 GLY H H 183 9.026 8.319 0.707 1 1 1458 . 12 1 1 A 183 183 GLY HA2 H 183 5.376 4.267 1.109 1 1 1459 . 12 1 1 A 183 183 GLY HA3 H 183 3.567 4.282 -0.715 1 1 1460 . 12 1 1 A 183 183 GLY CA C 183 42.361 45.331 -2.970 1 1 1461 . 12 1 1 A 183 183 GLY N N 183 111.505 109.398 2.107 1 1 1462 . 12 1 1 A 184 184 HIS H H 184 7.508 8.788 -1.280 1 1 1463 . 12 1 1 A 184 184 HIS HA H 184 4.304 5.163 -0.859 1 1 1467 . 12 1 1 A 184 184 HIS CA C 184 52.793 53.919 -1.126 1 1 1468 . 12 1 1 A 184 184 HIS CB C 184 27.906 33.920 -6.014 1 1 1469 . 12 1 1 A 184 184 HIS N N 184 111.297 124.963 -13.666 1 1 1470 . 12 1 1 A 185 185 GLY H H 185 9.160 6.739 2.421 1 1 1471 . 12 1 1 A 185 185 GLY HA2 H 185 4.464 2.920 1.544 1 1 1472 . 12 1 1 A 185 185 GLY HA3 H 185 4.117 3.641 0.476 1 1 1473 . 12 1 1 A 185 185 GLY CA C 185 44.212 45.026 -0.814 1 1 1474 . 12 1 1 A 185 185 GLY N N 185 107.398 107.633 -0.235 1 1 1475 . 12 1 1 A 186 186 LYS H H 186 9.170 8.090 1.080 1 1 1476 . 12 1 1 A 186 186 LYS HA H 186 4.925 4.850 0.075 1 1 1481 . 12 1 1 A 186 186 LYS CB C 186 33.642 36.786 -3.144 1 1 1482 . 12 1 1 A 186 186 LYS N N 186 122.690 118.877 3.813 1 1 1483 . 12 1 1 A 187 187 ILE H H 187 8.444 8.499 -0.055 1 1 1484 . 12 1 1 A 187 187 ILE HA H 187 4.626 5.776 -1.150 1 1 1487 . 12 1 1 A 187 187 ILE N N 187 124.320 118.341 5.979 1 1 1488 . 12 1 1 A 188 188 GLU H H 188 8.590 10.004 -1.414 1 1 1489 . 12 1 1 A 188 188 GLU HA H 188 4.650 5.240 -0.590 1 1 1495 . 12 1 1 A 188 188 GLU N N 188 122.575 120.753 1.822 1 1 1496 . 12 1 1 A 189 189 HIS H H 189 8.726 8.856 -0.130 1 1 1497 . 12 1 1 A 189 189 HIS HA H 189 4.055 4.740 -0.685 1 1 1501 . 12 1 1 A 189 189 HIS CA C 189 54.623 57.071 -2.448 1 1 1502 . 12 1 1 A 189 189 HIS CB C 189 24.997 31.817 -6.820 1 1 1503 . 12 1 1 A 189 189 HIS N N 189 111.381 121.541 -10.160 1 1 1504 . 12 1 1 A 190 190 LEU H H 190 9.715 7.941 1.774 1 1 1505 . 12 1 1 A 190 190 LEU HA H 190 4.379 4.462 -0.083 1 1 1515 . 12 1 1 A 190 190 LEU N N 190 124.648 116.178 8.470 1 1 1516 . 12 1 1 A 191 191 LYS H H 191 10.099 8.427 1.672 1 1 1517 . 12 1 1 A 191 191 LYS HA H 191 3.736 4.538 -0.802 1 1 1524 . 12 1 1 A 191 191 LYS CA C 191 55.815 55.729 0.086 1 1 1525 . 12 1 1 A 191 191 LYS CB C 191 30.201 33.969 -3.768 1 1 1527 . 12 1 1 A 191 191 LYS N N 191 123.618 117.300 6.318 1 1 1528 . 12 1 1 A 192 192 SER H H 192 6.991 7.491 -0.500 1 1 1529 . 12 1 1 A 192 192 SER HA H 192 4.743 4.537 0.206 1 1 1532 . 12 1 1 A 192 192 SER CA C 192 51.974 57.205 -5.231 1 1 1533 . 12 1 1 A 192 192 SER CB C 192 60.005 63.869 -3.864 1 1 1534 . 12 1 1 A 192 192 SER N N 192 115.071 117.874 -2.803 1 1 1535 . 12 1 1 A 193 193 PRO CB C 193 29.607 31.481 -1.874 1 1 1537 . 12 1 1 A 194 194 GLU H H 194 8.213 8.305 -0.092 1 1 1538 . 12 1 1 A 194 194 GLU HA H 194 3.063 4.872 -1.809 1 1 1543 . 12 1 1 A 194 194 GLU CA C 194 54.185 55.760 -1.575 1 1 1545 . 12 1 1 A 194 194 GLU N N 194 114.055 117.830 -3.775 1 1 1546 . 12 1 1 A 195 195 LEU H H 195 7.082 7.979 -0.897 1 1 1547 . 12 1 1 A 195 195 LEU HA H 195 4.027 4.201 -0.174 1 1 1557 . 12 1 1 A 195 195 LEU CA C 195 51.361 58.134 -6.773 1 1 1558 . 12 1 1 A 195 195 LEU CB C 195 38.950 41.491 -2.541 1 1 1561 . 12 1 1 A 195 195 LEU N N 195 113.898 120.836 -6.938 1 1 1562 . 12 1 1 A 196 196 ASN H H 196 7.060 7.984 -0.924 1 1 1563 . 12 1 1 A 196 196 ASN HA H 196 4.638 5.836 -1.198 1 1 1567 . 12 1 1 A 196 196 ASN N N 196 119.196 116.511 2.685 1 1 1568 . 12 1 1 A 197 197 VAL H H 197 7.244 8.773 -1.529 1 1 1569 . 12 1 1 A 197 197 VAL HA H 197 4.540 4.724 -0.184 1 1 1577 . 12 1 1 A 197 197 VAL CA C 197 57.176 60.224 -3.048 1 1 1578 . 12 1 1 A 197 197 VAL N N 197 113.621 118.940 -5.319 1 1 1579 . 12 1 1 A 198 198 ASP H H 198 8.881 8.843 0.038 1 1 1580 . 12 1 1 A 198 198 ASP HA H 198 4.894 5.047 -0.153 1 1 1581 . 12 1 1 A 198 198 ASP N N 198 118.852 126.055 -7.203 1 1 1582 . 12 1 1 A 199 199 LEU H H 199 8.498 8.639 -0.141 1 1 1583 . 12 1 1 A 199 199 LEU HA H 199 4.317 4.948 -0.631 1 1 1591 . 12 1 1 A 199 199 LEU N N 199 124.078 127.825 -3.747 1 1 1592 . 12 1 1 A 200 200 ALA H H 200 8.386 8.971 -0.585 1 1 1593 . 12 1 1 A 200 200 ALA HA H 200 4.295 5.570 -1.275 1 1 1597 . 12 1 1 A 200 200 ALA CA C 200 50.044 51.380 -1.336 1 1 1598 . 12 1 1 A 200 200 ALA CB C 200 17.985 22.396 -4.411 1 1 1599 . 12 1 1 A 200 200 ALA N N 200 127.315 124.939 2.376 1 1 1600 . 12 1 1 A 201 201 VAL H H 201 8.007 8.785 -0.778 1 1 1601 . 12 1 1 A 201 201 VAL HA H 201 4.577 4.861 -0.284 1 1 1609 . 12 1 1 A 201 201 VAL CA C 201 60.004 59.371 0.633 1 1 1610 . 12 1 1 A 201 201 VAL CB C 201 28.863 35.842 -6.979 1 1 1611 . 12 1 1 A 201 201 VAL N N 201 119.409 121.838 -2.429 1 1 1612 . 12 1 1 A 202 202 ALA H H 202 8.789 9.225 -0.436 1 1 1613 . 12 1 1 A 202 202 ALA HA H 202 4.630 5.335 -0.705 1 1 1617 . 12 1 1 A 202 202 ALA CA C 202 48.200 49.874 -1.674 1 1 1618 . 12 1 1 A 202 202 ALA N N 202 131.745 126.276 5.469 1 1 1619 . 12 1 1 A 203 203 TYR H H 203 8.522 8.943 -0.421 1 1 1620 . 12 1 1 A 203 203 TYR HA H 203 5.391 5.165 0.226 1 1 1627 . 12 1 1 A 203 203 TYR CA C 203 54.648 58.421 -3.773 1 1 1628 . 12 1 1 A 203 203 TYR CB C 203 37.315 39.988 -2.673 1 1 1629 . 12 1 1 A 203 203 TYR N N 203 117.786 123.960 -6.174 1 1 1630 . 12 1 1 A 204 204 ILE H H 204 8.209 7.632 0.577 1 1 1631 . 12 1 1 A 204 204 ILE HA H 204 4.393 4.732 -0.339 1 1 1641 . 12 1 1 A 204 204 ILE CB C 204 36.807 42.088 -5.281 1 1 1644 . 12 1 1 A 204 204 ILE N N 204 120.602 123.586 -2.984 1 1 1645 . 12 1 1 A 205 205 LYS H H 205 9.340 8.970 0.370 1 1 1646 . 12 1 1 A 205 205 LYS HA H 205 4.756 4.449 0.307 1 1 1651 . 12 1 1 A 205 205 LYS CA C 205 50.844 60.804 -9.960 1 1 1652 . 12 1 1 A 205 205 LYS N N 205 127.960 124.030 3.930 1 1 1653 . 12 1 1 A 207 207 ASP H H 207 8.436 8.727 -0.291 1 1 1654 . 12 1 1 A 207 207 ASP HA H 207 4.692 4.724 -0.032 1 1 1657 . 12 1 1 A 207 207 ASP CA C 207 48.789 52.649 -3.860 1 1 1658 . 12 1 1 A 207 207 ASP CB C 207 38.377 41.549 -3.172 1 1 1659 . 12 1 1 A 207 207 ASP N N 207 123.098 123.933 -0.835 1 1 1660 . 12 1 1 A 208 208 GLU H H 208 8.880 8.482 0.398 1 1 1661 . 12 1 1 A 208 208 GLU HA H 208 3.994 3.957 0.037 1 1 1666 . 12 1 1 A 208 208 GLU CA C 208 56.123 59.633 -3.510 1 1 1667 . 12 1 1 A 208 208 GLU CB C 208 25.794 29.497 -3.703 1 1 1669 . 12 1 1 A 208 208 GLU N N 208 119.042 122.034 -2.992 1 1 1670 . 12 1 1 A 209 209 LYS H H 209 7.681 7.649 0.032 1 1 1671 . 12 1 1 A 209 209 LYS HA H 209 4.141 4.380 -0.239 1 1 1680 . 12 1 1 A 209 209 LYS N N 209 119.252 115.988 3.264 1 1 1681 . 12 1 1 A 210 210 HIS H H 210 8.177 6.576 1.601 1 1 1682 . 12 1 1 A 210 210 HIS HA H 210 3.825 4.751 -0.926 1 1 1687 . 12 1 1 A 210 210 HIS CA C 210 54.205 54.124 0.081 1 1 1688 . 12 1 1 A 210 210 HIS CB C 210 23.439 29.720 -6.281 1 1 1689 . 12 1 1 A 210 210 HIS N N 210 112.758 113.026 -0.268 1 1 1690 . 12 1 1 A 211 211 HIS H H 211 8.758 7.247 1.511 1 1 1691 . 12 1 1 A 211 211 HIS HA H 211 5.041 5.682 -0.641 1 1 1695 . 12 1 1 A 211 211 HIS CA C 211 50.450 54.905 -4.455 1 1 1696 . 12 1 1 A 211 211 HIS CB C 211 25.703 33.759 -8.056 1 1 1697 . 12 1 1 A 211 211 HIS N N 211 119.552 119.155 0.397 1 1 1698 . 12 1 1 A 212 212 ALA H H 212 8.556 8.188 0.368 1 1 1699 . 12 1 1 A 212 212 ALA HA H 212 4.712 4.604 0.108 1 1 1703 . 12 1 1 A 212 212 ALA CA C 212 49.886 51.323 -1.437 1 1 1704 . 12 1 1 A 212 212 ALA CB C 212 18.860 19.309 -0.449 1 1 1705 . 12 1 1 A 212 212 ALA N N 212 123.780 123.453 0.327 1 1 1706 . 12 1 1 A 213 213 VAL H H 213 9.338 7.766 1.572 1 1 1707 . 12 1 1 A 213 213 VAL HA H 213 5.074 4.777 0.297 1 1 1715 . 12 1 1 A 213 213 VAL CA C 213 57.486 60.294 -2.808 1 1 1716 . 12 1 1 A 213 213 VAL CB C 213 33.938 35.120 -1.182 1 1 1717 . 12 1 1 A 213 213 VAL N N 213 124.742 119.417 5.325 1 1 1718 . 12 1 1 A 214 214 ILE H H 214 8.962 8.378 0.584 1 1 1719 . 12 1 1 A 214 214 ILE HA H 214 4.434 4.931 -0.497 1 1 1726 . 12 1 1 A 214 214 ILE N N 214 122.881 127.352 -4.471 1 1 1727 . 12 1 1 A 215 215 SER H H 215 8.558 8.492 0.066 1 1 1728 . 12 1 1 A 215 215 SER HA H 215 5.001 5.491 -0.490 1 1 1731 . 12 1 1 A 215 215 SER CA C 215 53.230 56.437 -3.207 1 1 1732 . 12 1 1 A 215 215 SER CB C 215 62.077 66.106 -4.029 1 1 1733 . 12 1 1 A 215 215 SER N N 215 122.891 120.991 1.900 1 1 1734 . 12 1 1 A 216 216 GLY H H 216 7.282 8.950 -1.668 1 1 1735 . 12 1 1 A 216 216 GLY HA2 H 216 4.515 4.308 0.207 1 1 1736 . 12 1 1 A 216 216 GLY HA3 H 216 3.473 4.309 -0.836 1 1 1737 . 12 1 1 A 216 216 GLY CA C 216 42.816 46.146 -3.330 1 1 1738 . 12 1 1 A 216 216 GLY N N 216 110.899 110.761 0.138 1 1 1739 . 12 1 1 A 217 217 SER H H 217 8.673 8.632 0.041 1 1 1740 . 12 1 1 A 217 217 SER HA H 217 5.127 5.421 -0.294 1 1 1743 . 12 1 1 A 217 217 SER CA C 217 56.266 57.329 -1.063 1 1 1744 . 12 1 1 A 217 217 SER N N 217 117.164 116.809 0.355 1 1 1745 . 12 1 1 A 218 218 VAL H H 218 7.451 9.485 -2.034 1 1 1746 . 12 1 1 A 218 218 VAL HA H 218 5.128 4.695 0.433 1 1 1754 . 12 1 1 A 218 218 VAL CA C 218 56.637 59.908 -3.271 1 1 1755 . 12 1 1 A 218 218 VAL N N 218 117.826 120.772 -2.946 1 1 1756 . 12 1 1 A 219 219 LEU H H 219 9.022 8.642 0.380 1 1 1757 . 12 1 1 A 219 219 LEU HA H 219 5.387 5.070 0.317 1 1 1767 . 12 1 1 A 219 219 LEU CA C 219 50.450 54.143 -3.693 1 1 1768 . 12 1 1 A 219 219 LEU N N 219 124.820 125.166 -0.346 1 1 1769 . 12 1 1 A 220 220 TYR H H 220 8.816 8.778 0.038 1 1 1770 . 12 1 1 A 220 220 TYR HA H 220 4.834 5.294 -0.460 1 1 1777 . 12 1 1 A 220 220 TYR N N 220 121.249 120.122 1.127 1 1 1778 . 12 1 1 A 221 221 ASN H H 221 9.191 8.561 0.630 1 1 1779 . 12 1 1 A 221 221 ASN HA H 221 4.048 4.878 -0.830 1 1 1784 . 12 1 1 A 221 221 ASN CA C 221 51.647 54.578 -2.931 1 1 1785 . 12 1 1 A 221 221 ASN CB C 221 36.640 40.348 -3.708 1 1 1786 . 12 1 1 A 221 221 ASN N N 221 129.865 120.594 9.271 1 1 1788 . 12 1 1 A 222 222 GLN H H 222 8.468 7.829 0.639 1 1 1789 . 12 1 1 A 222 222 GLN HA H 222 3.671 4.488 -0.817 1 1 1794 . 12 1 1 A 222 222 GLN CA C 222 55.075 56.022 -0.947 1 1 1795 . 12 1 1 A 222 222 GLN CB C 222 24.663 31.469 -6.806 1 1 1797 . 12 1 1 A 222 222 GLN N N 222 108.367 115.032 -6.665 1 1 1798 . 12 1 1 A 223 223 ASP H H 223 7.797 7.897 -0.100 1 1 1799 . 12 1 1 A 223 223 ASP HA H 223 4.986 4.851 0.135 1 1 1802 . 12 1 1 A 223 223 ASP N N 223 120.842 119.293 1.549 1 1 1803 . 12 1 1 A 224 224 GLU H H 224 8.731 7.424 1.307 1 1 1804 . 12 1 1 A 224 224 GLU HA H 224 4.690 4.342 0.348 1 1 1809 . 12 1 1 A 224 224 GLU CA C 224 54.703 55.105 -0.402 1 1 1810 . 12 1 1 A 224 224 GLU CB C 224 26.357 29.903 -3.546 1 1 1812 . 12 1 1 A 224 224 GLU N N 224 124.249 118.426 5.823 1 1 1813 . 12 1 1 A 225 225 LYS H H 225 8.730 8.207 0.523 1 1 1814 . 12 1 1 A 225 225 LYS HA H 225 4.754 4.875 -0.121 1 1 1822 . 12 1 1 A 225 225 LYS N N 225 126.784 118.694 8.090 1 1 1823 . 12 1 1 A 226 226 GLY H H 226 7.683 9.043 -1.360 1 1 1824 . 12 1 1 A 226 226 GLY HA2 H 226 5.567 4.196 1.371 1 1 1825 . 12 1 1 A 226 226 GLY HA3 H 226 3.819 4.328 -0.509 1 1 1826 . 12 1 1 A 226 226 GLY CA C 226 42.264 44.510 -2.246 1 1 1827 . 12 1 1 A 226 226 GLY N N 226 107.140 112.026 -4.886 1 1 1828 . 12 1 1 A 227 227 SER H H 227 8.672 10.762 -2.090 1 1 1829 . 12 1 1 A 227 227 SER HA H 227 5.564 5.334 0.230 1 1 1832 . 12 1 1 A 227 227 SER CA C 227 54.373 57.252 -2.879 1 1 1833 . 12 1 1 A 227 227 SER CB C 227 63.963 66.046 -2.083 1 1 1834 . 12 1 1 A 227 227 SER N N 227 117.767 116.519 1.248 1 1 1835 . 12 1 1 A 228 228 TYR H H 228 9.073 8.469 0.604 1 1 1836 . 12 1 1 A 228 228 TYR HA H 228 5.519 4.945 0.574 1 1 1843 . 12 1 1 A 228 228 TYR N N 228 118.324 122.234 -3.910 1 1 1844 . 12 1 1 A 229 229 SER H H 229 8.929 8.638 0.291 1 1 1845 . 12 1 1 A 229 229 SER HA H 229 5.209 5.427 -0.218 1 1 1848 . 12 1 1 A 229 229 SER CA C 229 54.131 56.953 -2.822 1 1 1849 . 12 1 1 A 229 229 SER N N 229 116.118 119.032 -2.914 1 1 1850 . 12 1 1 A 230 230 LEU H H 230 9.372 9.156 0.216 1 1 1851 . 12 1 1 A 230 230 LEU HA H 230 4.803 4.844 -0.041 1 1 1863 . 12 1 1 A 230 230 LEU N N 230 124.803 123.779 1.024 1 1 1864 . 12 1 1 A 231 231 GLY H H 231 9.080 8.411 0.669 1 1 1865 . 12 1 1 A 231 231 GLY HA2 H 231 4.776 4.250 0.526 1 1 1866 . 12 1 1 A 231 231 GLY HA3 H 231 3.528 4.336 -0.808 1 1 1867 . 12 1 1 A 231 231 GLY CA C 231 41.468 44.256 -2.788 1 1 1868 . 12 1 1 A 231 231 GLY N N 231 109.611 108.022 1.589 1 1 1869 . 12 1 1 A 232 232 ILE H H 232 6.849 8.800 -1.951 1 1 1870 . 12 1 1 A 232 232 ILE HA H 232 4.742 4.925 -0.183 1 1 1878 . 12 1 1 A 232 232 ILE N N 232 120.566 123.606 -3.040 1 1 1879 . 12 1 1 A 233 233 PHE H H 233 9.569 7.941 1.628 1 1 1880 . 12 1 1 A 233 233 PHE HA H 233 4.979 5.911 -0.932 1 1 1885 . 12 1 1 A 233 233 PHE N N 233 129.256 122.941 6.315 1 1 1886 . 12 1 1 A 234 234 GLY H H 234 8.734 8.908 -0.174 1 1 1887 . 12 1 1 A 234 234 GLY HA2 H 234 4.488 4.236 0.252 1 1 1888 . 12 1 1 A 234 234 GLY HA3 H 234 3.327 4.357 -1.030 1 1 1889 . 12 1 1 A 234 234 GLY CA C 234 40.377 45.651 -5.274 1 1 1890 . 12 1 1 A 234 234 GLY N N 234 105.294 108.151 -2.857 1 1 1891 . 12 1 1 A 235 235 GLU H H 235 9.198 8.290 0.908 1 1 1892 . 12 1 1 A 235 235 GLU HA H 235 4.111 4.118 -0.007 1 1 1897 . 12 1 1 A 235 235 GLU CA C 235 56.466 59.115 -2.649 1 1 1898 . 12 1 1 A 235 235 GLU CB C 235 26.256 29.698 -3.442 1 1 1900 . 12 1 1 A 235 235 GLU N N 235 125.813 121.068 4.745 1 1 1901 . 12 1 1 A 236 236 LYS H H 236 8.147 7.798 0.349 1 1 1902 . 12 1 1 A 236 236 LYS HA H 236 4.373 4.498 -0.125 1 1 1905 . 12 1 1 A 236 236 LYS N N 236 117.810 119.137 -1.327 1 1 1906 . 12 1 1 A 237 237 ALA H H 237 7.685 7.630 0.055 1 1 1907 . 12 1 1 A 237 237 ALA HA H 237 3.902 4.548 -0.646 1 1 1911 . 12 1 1 A 237 237 ALA CA C 237 49.762 51.983 -2.221 1 1 1912 . 12 1 1 A 237 237 ALA CB C 237 14.720 19.211 -4.491 1 1 1913 . 12 1 1 A 237 237 ALA N N 237 118.704 122.197 -3.493 1 1 1914 . 12 1 1 A 238 238 GLN H H 238 9.312 8.527 0.785 1 1 1915 . 12 1 1 A 238 238 GLN HA H 238 4.049 4.622 -0.573 1 1 1920 . 12 1 1 A 238 238 GLN N N 238 118.059 122.235 -4.176 1 1 1921 . 12 1 1 A 239 239 GLU H H 239 8.785 9.790 -1.005 1 1 1922 . 12 1 1 A 239 239 GLU HA H 239 5.531 4.879 0.652 1 1 1927 . 12 1 1 A 239 239 GLU N N 239 116.914 117.582 -0.668 1 1 1928 . 12 1 1 A 240 240 VAL H H 240 8.501 9.339 -0.838 1 1 1929 . 12 1 1 A 240 240 VAL HA H 240 5.655 4.076 1.579 1 1 1937 . 12 1 1 A 240 240 VAL CA C 240 55.582 60.312 -4.730 1 1 1940 . 12 1 1 A 240 240 VAL N N 240 110.588 120.186 -9.598 1 1 1941 . 12 1 1 A 241 241 ALA H H 241 8.463 8.763 -0.300 1 1 1942 . 12 1 1 A 241 241 ALA HA H 241 5.014 5.221 -0.207 1 1 1946 . 12 1 1 A 241 241 ALA CA C 241 49.361 51.258 -1.897 1 1 1947 . 12 1 1 A 241 241 ALA CB C 241 18.196 23.759 -5.563 1 1 1948 . 12 1 1 A 241 241 ALA N N 241 121.125 129.308 -8.183 1 1 1949 . 12 1 1 A 242 242 GLY H H 242 9.421 8.192 1.229 1 1 1950 . 12 1 1 A 242 242 GLY HA2 H 242 5.161 4.221 0.940 1 1 1951 . 12 1 1 A 242 242 GLY HA3 H 242 4.076 4.253 -0.177 1 1 1952 . 12 1 1 A 242 242 GLY N N 242 112.036 106.902 5.134 1 1 1953 . 12 1 1 A 243 243 SER H H 243 8.929 8.254 0.675 1 1 1954 . 12 1 1 A 243 243 SER HA H 243 5.331 5.139 0.192 1 1 1957 . 12 1 1 A 243 243 SER N N 243 116.113 116.002 0.111 1 1 1958 . 12 1 1 A 244 244 ALA H H 244 9.218 8.481 0.737 1 1 1959 . 12 1 1 A 244 244 ALA HA H 244 5.221 4.982 0.239 1 1 1963 . 12 1 1 A 244 244 ALA CA C 244 47.883 50.112 -2.229 1 1 1964 . 12 1 1 A 244 244 ALA N N 244 120.635 126.490 -5.855 1 1 1965 . 12 1 1 A 245 245 GLU H H 245 9.194 8.465 0.729 1 1 1966 . 12 1 1 A 245 245 GLU HA H 245 4.869 5.046 -0.177 1 1 1971 . 12 1 1 A 245 245 GLU N N 245 123.487 117.019 6.468 1 1 1972 . 12 1 1 A 246 246 VAL H H 246 8.531 9.575 -1.044 1 1 1973 . 12 1 1 A 246 246 VAL HA H 246 4.518 4.668 -0.150 1 1 1981 . 12 1 1 A 246 246 VAL CA C 246 58.286 61.342 -3.056 1 1 1982 . 12 1 1 A 246 246 VAL N N 246 123.347 125.411 -2.064 1 1 1983 . 12 1 1 A 247 247 GLU H H 247 9.132 8.347 0.785 1 1 1984 . 12 1 1 A 247 247 GLU HA H 247 4.368 4.833 -0.465 1 1 1989 . 12 1 1 A 247 247 GLU CB C 247 26.744 32.175 -5.431 1 1 1990 . 12 1 1 A 247 247 GLU N N 247 129.243 126.677 2.566 1 1 1991 . 12 1 1 A 248 248 THR H H 248 7.827 8.296 -0.469 1 1 1992 . 12 1 1 A 248 248 THR HA H 248 4.749 4.711 0.038 1 1 1997 . 12 1 1 A 248 248 THR CA C 248 56.859 60.685 -3.826 1 1 1998 . 12 1 1 A 248 248 THR CB C 248 69.171 70.263 -1.092 1 1 2000 . 12 1 1 A 248 248 THR N N 248 114.228 120.153 -5.925 1 1 2001 . 12 1 1 A 249 249 ALA H H 249 9.148 8.619 0.529 1 1 2002 . 12 1 1 A 249 249 ALA HA H 249 4.174 4.184 -0.010 1 1 2006 . 12 1 1 A 249 249 ALA CA C 249 51.970 53.557 -1.587 1 1 2007 . 12 1 1 A 249 249 ALA CB C 249 15.797 19.073 -3.276 1 1 2008 . 12 1 1 A 249 249 ALA N N 249 123.341 124.374 -1.033 1 1 2009 . 12 1 1 A 250 250 ASN H H 250 7.974 7.690 0.284 1 1 2010 . 12 1 1 A 250 250 ASN HA H 250 4.953 4.868 0.085 1 1 2015 . 12 1 1 A 250 250 ASN CA C 250 49.198 52.685 -3.487 1 1 2016 . 12 1 1 A 250 250 ASN CB C 250 35.976 38.750 -2.774 1 1 2017 . 12 1 1 A 250 250 ASN N N 250 113.358 116.026 -2.668 1 1 2019 . 12 1 1 A 251 251 GLY H H 251 7.510 7.630 -0.120 1 1 2020 . 12 1 1 A 251 251 GLY HA2 H 251 4.492 4.157 0.335 1 1 2021 . 12 1 1 A 251 251 GLY HA3 H 251 3.853 4.270 -0.417 1 1 2022 . 12 1 1 A 251 251 GLY CA C 251 41.435 45.828 -4.393 1 1 2023 . 12 1 1 A 251 251 GLY N N 251 108.692 108.183 0.509 1 1 2024 . 12 1 1 A 252 252 ILE H H 252 8.465 8.868 -0.403 1 1 2025 . 12 1 1 A 252 252 ILE HA H 252 4.521 4.647 -0.126 1 1 2035 . 12 1 1 A 252 252 ILE CB C 252 35.653 38.353 -2.700 1 1 2039 . 12 1 1 A 252 252 ILE N N 252 122.043 127.232 -5.189 1 1 2040 . 12 1 1 A 253 253 HIS H H 253 9.311 9.923 -0.612 1 1 2041 . 12 1 1 A 253 253 HIS HA H 253 4.861 5.307 -0.446 1 1 2046 . 12 1 1 A 253 253 HIS N N 253 126.617 126.263 0.354 1 1 2047 . 12 1 1 A 254 254 HIS H H 254 8.820 8.977 -0.157 1 1 2048 . 12 1 1 A 254 254 HIS HA H 254 5.305 5.278 0.027 1 1 2051 . 12 1 1 A 254 254 HIS CA C 254 52.781 54.238 -1.457 1 1 2052 . 12 1 1 A 254 254 HIS N N 254 122.665 121.185 1.480 1 1 2053 . 12 1 1 A 255 255 ILE H H 255 9.047 8.714 0.333 1 1 2054 . 12 1 1 A 255 255 ILE HA H 255 4.651 4.038 0.613 1 1 2061 . 12 1 1 A 255 255 ILE N N 255 123.958 125.727 -1.769 1 1 2062 . 12 1 1 A 256 256 GLY H H 256 9.339 8.307 1.032 1 1 2063 . 12 1 1 A 256 256 GLY HA2 H 256 3.816 2.961 0.855 1 1 2064 . 12 1 1 A 256 256 GLY HA3 H 256 2.267 3.657 -1.390 1 1 2065 . 12 1 1 A 256 256 GLY N N 256 115.022 114.835 0.187 1 1 2066 . 12 1 1 A 257 257 LEU H H 257 7.890 8.916 -1.026 1 1 2067 . 12 1 1 A 257 257 LEU HA H 257 4.853 4.925 -0.072 1 1 2077 . 12 1 1 A 257 257 LEU N N 257 121.441 124.027 -2.586 1 1 2078 . 12 1 1 A 258 258 ALA H H 258 7.982 8.606 -0.624 1 1 2079 . 12 1 1 A 258 258 ALA HA H 258 4.668 4.944 -0.276 1 1 2083 . 12 1 1 A 258 258 ALA CA C 258 49.678 51.509 -1.831 1 1 2084 . 12 1 1 A 258 258 ALA CB C 258 19.561 21.193 -1.632 1 1 2085 . 12 1 1 A 258 258 ALA N N 258 123.234 122.270 0.964 1 1 2086 . 12 1 1 A 259 259 ALA H H 259 9.117 9.140 -0.023 1 1 2087 . 12 1 1 A 259 259 ALA HA H 259 4.790 4.946 -0.156 1 1 2091 . 12 1 1 A 259 259 ALA N N 259 123.901 124.635 -0.734 1 1 2092 . 12 1 1 A 260 260 LYS H H 260 8.452 8.704 -0.252 1 1 2093 . 12 1 1 A 260 260 LYS HA H 260 5.914 4.840 1.074 1 1 2098 . 12 1 1 A 260 260 LYS CA C 260 51.818 54.267 -2.449 1 1 2099 . 12 1 1 A 260 260 LYS N N 260 116.464 116.837 -0.373 1 1 1 . 13 1 1 A 9 9 SER H H 9 8.293 8.930 -0.637 1 1 2 . 13 1 1 A 9 9 SER HA H 9 4.432 5.124 -0.692 1 1 3 . 13 1 1 A 9 9 SER N N 9 116.407 122.755 -6.348 1 1 4 . 13 1 1 A 10 10 GLY H H 10 8.472 8.533 -0.061 1 1 5 . 13 1 1 A 10 10 GLY N N 10 111.611 112.079 -0.468 1 1 6 . 13 1 1 A 14 14 VAL H H 14 8.009 8.389 -0.380 1 1 7 . 13 1 1 A 14 14 VAL HA H 14 4.128 4.066 0.062 1 1 15 . 13 1 1 A 14 14 VAL CA C 14 59.473 62.914 -3.441 1 1 16 . 13 1 1 A 14 14 VAL CB C 14 30.127 32.393 -2.266 1 1 17 . 13 1 1 A 14 14 VAL N N 14 119.846 121.623 -1.777 1 1 18 . 13 1 1 A 15 15 THR H H 15 8.152 8.703 -0.551 1 1 19 . 13 1 1 A 15 15 THR HA H 15 4.346 4.577 -0.231 1 1 24 . 13 1 1 A 15 15 THR N N 15 118.509 118.693 -0.184 1 1 25 . 13 1 1 A 16 16 ALA H H 16 8.207 8.622 -0.415 1 1 26 . 13 1 1 A 16 16 ALA HA H 16 4.319 4.188 0.131 1 1 30 . 13 1 1 A 16 16 ALA CA C 16 49.835 53.489 -3.654 1 1 31 . 13 1 1 A 16 16 ALA CB C 16 16.714 19.251 -2.537 1 1 32 . 13 1 1 A 16 16 ALA N N 16 126.935 124.652 2.283 1 1 33 . 13 1 1 A 17 17 ASP H H 17 8.269 7.851 0.418 1 1 34 . 13 1 1 A 17 17 ASP HA H 17 4.581 4.815 -0.234 1 1 37 . 13 1 1 A 17 17 ASP CA C 17 51.643 53.396 -1.753 1 1 38 . 13 1 1 A 17 17 ASP CB C 17 38.257 41.310 -3.053 1 1 39 . 13 1 1 A 17 17 ASP N N 17 120.379 118.349 2.030 1 1 40 . 13 1 1 A 18 18 ILE H H 18 7.979 7.805 0.174 1 1 41 . 13 1 1 A 18 18 ILE HA H 18 4.178 4.030 0.148 1 1 48 . 13 1 1 A 18 18 ILE CA C 18 58.737 63.359 -4.622 1 1 49 . 13 1 1 A 18 18 ILE CB C 18 36.077 38.234 -2.157 1 1 53 . 13 1 1 A 18 18 ILE N N 18 121.171 122.747 -1.576 1 1 54 . 13 1 1 A 19 19 GLY H H 19 8.410 7.928 0.482 1 1 55 . 13 1 1 A 19 19 GLY HA2 H 19 4.023 4.019 0.004 1 1 56 . 13 1 1 A 19 19 GLY HA3 H 19 4.023 4.027 -0.004 1 1 57 . 13 1 1 A 19 19 GLY N N 19 112.246 109.006 3.240 1 1 58 . 13 1 1 A 20 20 THR H H 20 8.005 7.763 0.242 1 1 59 . 13 1 1 A 20 20 THR HA H 20 4.463 4.112 0.351 1 1 64 . 13 1 1 A 20 20 THR CB C 20 66.723 68.034 -1.311 1 1 66 . 13 1 1 A 20 20 THR N N 20 112.239 115.984 -3.745 1 1 67 . 13 1 1 A 21 21 GLY H H 21 8.500 8.334 0.166 1 1 68 . 13 1 1 A 21 21 GLY HA2 H 21 4.099 3.905 0.194 1 1 69 . 13 1 1 A 21 21 GLY HA3 H 21 3.872 3.906 -0.034 1 1 70 . 13 1 1 A 21 21 GLY N N 21 111.048 110.632 0.416 1 1 71 . 13 1 1 A 22 22 LEU H H 22 7.427 8.062 -0.635 1 1 72 . 13 1 1 A 22 22 LEU HA H 22 3.884 4.036 -0.152 1 1 84 . 13 1 1 A 22 22 LEU N N 22 118.837 122.872 -4.035 1 1 85 . 13 1 1 A 23 23 ALA H H 23 7.896 7.918 -0.022 1 1 86 . 13 1 1 A 23 23 ALA HA H 23 4.023 4.124 -0.101 1 1 90 . 13 1 1 A 23 23 ALA CA C 23 52.584 54.143 -1.559 1 1 91 . 13 1 1 A 23 23 ALA CB C 23 15.470 18.370 -2.900 1 1 92 . 13 1 1 A 23 23 ALA N N 23 119.194 120.751 -1.557 1 1 93 . 13 1 1 A 24 24 ASP H H 24 8.265 7.697 0.568 1 1 94 . 13 1 1 A 24 24 ASP HA H 24 4.337 5.175 -0.838 1 1 97 . 13 1 1 A 24 24 ASP CB C 24 37.029 41.332 -4.303 1 1 98 . 13 1 1 A 24 24 ASP N N 24 119.035 116.425 2.610 1 1 99 . 13 1 1 A 25 25 ALA H H 25 8.211 8.317 -0.106 1 1 100 . 13 1 1 A 25 25 ALA HA H 25 4.064 4.196 -0.132 1 1 104 . 13 1 1 A 25 25 ALA CA C 25 53.278 53.810 -0.532 1 1 105 . 13 1 1 A 25 25 ALA CB C 25 15.760 18.536 -2.776 1 1 106 . 13 1 1 A 25 25 ALA N N 25 122.434 121.319 1.115 1 1 107 . 13 1 1 A 26 26 LEU H H 26 7.334 7.471 -0.137 1 1 108 . 13 1 1 A 26 26 LEU HA H 26 4.351 4.205 0.146 1 1 117 . 13 1 1 A 26 26 LEU N N 26 114.238 115.638 -1.400 1 1 118 . 13 1 1 A 27 27 THR H H 27 7.708 7.094 0.614 1 1 119 . 13 1 1 A 27 27 THR HA H 27 4.492 4.588 -0.096 1 1 124 . 13 1 1 A 27 27 THR CA C 27 59.438 62.236 -2.798 1 1 125 . 13 1 1 A 27 27 THR CB C 27 68.796 69.613 -0.817 1 1 127 . 13 1 1 A 27 27 THR N N 27 106.430 106.993 -0.563 1 1 128 . 13 1 1 A 28 28 ALA H H 28 8.906 7.865 1.041 1 1 129 . 13 1 1 A 28 28 ALA HA H 28 4.812 4.274 0.538 1 1 133 . 13 1 1 A 28 28 ALA CB C 28 16.724 19.305 -2.581 1 1 134 . 13 1 1 A 28 28 ALA N N 28 128.420 124.426 3.994 1 1 135 . 13 1 1 A 29 29 PRO CA C 29 59.166 62.566 -3.400 1 1 136 . 13 1 1 A 29 29 PRO CB C 29 29.865 31.938 -2.073 1 1 139 . 13 1 1 A 30 30 LEU H H 30 8.204 8.389 -0.185 1 1 140 . 13 1 1 A 30 30 LEU HA H 30 4.052 4.308 -0.256 1 1 150 . 13 1 1 A 30 30 LEU N N 30 121.970 122.540 -0.570 1 1 151 . 13 1 1 A 31 31 ASP H H 31 8.720 8.087 0.633 1 1 152 . 13 1 1 A 31 31 ASP HA H 31 4.772 4.776 -0.004 1 1 155 . 13 1 1 A 31 31 ASP CA C 31 50.115 53.038 -2.923 1 1 156 . 13 1 1 A 31 31 ASP N N 31 125.105 119.442 5.663 1 1 157 . 13 1 1 A 32 32 HIS CA C 32 55.083 58.200 -3.117 1 1 158 . 13 1 1 A 32 32 HIS CB C 32 25.707 29.479 -3.772 1 1 159 . 13 1 1 A 33 33 LYS H H 33 8.589 7.915 0.674 1 1 160 . 13 1 1 A 33 33 LYS HA H 33 4.112 4.420 -0.308 1 1 167 . 13 1 1 A 33 33 LYS CB C 33 29.218 33.612 -4.394 1 1 169 . 13 1 1 A 33 33 LYS N N 33 118.920 112.731 6.189 1 1 170 . 13 1 1 A 34 34 ASP H H 34 7.420 7.747 -0.327 1 1 171 . 13 1 1 A 34 34 ASP HA H 34 4.368 5.203 -0.835 1 1 174 . 13 1 1 A 34 34 ASP N N 34 120.940 120.885 0.055 1 1 175 . 13 1 1 A 35 35 LYS H H 35 8.266 8.717 -0.451 1 1 176 . 13 1 1 A 35 35 LYS HA H 35 4.169 4.689 -0.520 1 1 183 . 13 1 1 A 35 35 LYS N N 35 121.280 127.068 -5.788 1 1 184 . 13 1 1 A 36 36 GLY H H 36 8.716 8.239 0.477 1 1 185 . 13 1 1 A 36 36 GLY HA2 H 36 3.822 4.180 -0.358 1 1 186 . 13 1 1 A 36 36 GLY HA3 H 36 3.618 4.181 -0.563 1 1 187 . 13 1 1 A 36 36 GLY N N 36 111.002 111.807 -0.805 1 1 188 . 13 1 1 A 37 37 LEU H H 37 8.032 8.460 -0.428 1 1 189 . 13 1 1 A 37 37 LEU HA H 37 4.406 4.129 0.277 1 1 198 . 13 1 1 A 37 37 LEU N N 37 127.683 124.098 3.585 1 1 199 . 13 1 1 A 38 38 LYS H H 38 9.190 8.917 0.273 1 1 200 . 13 1 1 A 38 38 LYS HA H 38 3.925 4.205 -0.280 1 1 205 . 13 1 1 A 38 38 LYS N N 38 132.634 124.048 8.586 1 1 206 . 13 1 1 A 39 39 SER H H 39 7.161 7.538 -0.377 1 1 207 . 13 1 1 A 39 39 SER HA H 39 5.097 4.588 0.509 1 1 210 . 13 1 1 A 39 39 SER CA C 39 54.451 56.763 -2.312 1 1 211 . 13 1 1 A 39 39 SER N N 39 110.262 109.703 0.559 1 1 212 . 13 1 1 A 40 40 LEU H H 40 8.142 9.700 -1.558 1 1 213 . 13 1 1 A 40 40 LEU HA H 40 4.481 4.715 -0.234 1 1 223 . 13 1 1 A 40 40 LEU N N 40 122.761 123.445 -0.684 1 1 224 . 13 1 1 A 41 41 THR H H 41 8.641 8.808 -0.167 1 1 225 . 13 1 1 A 41 41 THR HA H 41 4.141 4.517 -0.376 1 1 230 . 13 1 1 A 41 41 THR CA C 41 60.301 62.142 -1.841 1 1 231 . 13 1 1 A 41 41 THR CB C 41 65.862 69.926 -4.064 1 1 233 . 13 1 1 A 41 41 THR N N 41 124.142 121.334 2.808 1 1 234 . 13 1 1 A 42 42 LEU H H 42 8.586 8.405 0.181 1 1 235 . 13 1 1 A 42 42 LEU HA H 42 4.337 4.782 -0.445 1 1 247 . 13 1 1 A 42 42 LEU N N 42 128.603 127.028 1.575 1 1 248 . 13 1 1 A 43 43 GLU H H 43 8.644 8.598 0.046 1 1 249 . 13 1 1 A 43 43 GLU HA H 43 4.663 4.207 0.456 1 1 253 . 13 1 1 A 43 43 GLU N N 43 124.180 124.013 0.167 1 1 254 . 13 1 1 A 44 44 ASP H H 44 10.243 8.738 1.505 1 1 255 . 13 1 1 A 44 44 ASP HA H 44 4.518 4.645 -0.127 1 1 258 . 13 1 1 A 44 44 ASP CA C 44 52.879 52.857 0.022 1 1 259 . 13 1 1 A 44 44 ASP CB C 44 37.711 39.116 -1.405 1 1 260 . 13 1 1 A 44 44 ASP N N 44 124.177 121.288 2.889 1 1 261 . 13 1 1 A 45 45 SER H H 45 8.546 9.978 -1.432 1 1 262 . 13 1 1 A 45 45 SER HA H 45 3.850 4.125 -0.275 1 1 265 . 13 1 1 A 45 45 SER CA C 45 59.588 61.546 -1.958 1 1 266 . 13 1 1 A 45 45 SER CB C 45 61.660 62.994 -1.334 1 1 267 . 13 1 1 A 45 45 SER N N 45 116.191 119.095 -2.904 1 1 268 . 13 1 1 A 46 46 ILE H H 46 6.902 7.639 -0.737 1 1 269 . 13 1 1 A 46 46 ILE HA H 46 3.874 4.680 -0.806 1 1 279 . 13 1 1 A 46 46 ILE CA C 46 57.605 60.075 -2.470 1 1 280 . 13 1 1 A 46 46 ILE CB C 46 36.694 39.691 -2.997 1 1 283 . 13 1 1 A 46 46 ILE N N 46 116.189 119.270 -3.081 1 1 284 . 13 1 1 A 47 47 SER H H 47 7.804 8.551 -0.747 1 1 285 . 13 1 1 A 47 47 SER HA H 47 4.342 4.923 -0.581 1 1 288 . 13 1 1 A 47 47 SER CA C 47 55.995 57.407 -1.412 1 1 289 . 13 1 1 A 47 47 SER N N 47 118.738 118.302 0.436 1 1 290 . 13 1 1 A 48 48 GLN H H 48 8.522 8.691 -0.169 1 1 291 . 13 1 1 A 48 48 GLN HA H 48 3.939 4.123 -0.184 1 1 296 . 13 1 1 A 48 48 GLN CA C 48 55.111 58.223 -3.112 1 1 298 . 13 1 1 A 48 48 GLN N N 48 119.475 121.681 -2.206 1 1 299 . 13 1 1 A 49 49 ASN H H 49 8.437 8.156 0.281 1 1 300 . 13 1 1 A 49 49 ASN HA H 49 4.693 4.736 -0.043 1 1 305 . 13 1 1 A 49 49 ASN CA C 49 50.839 52.165 -1.326 1 1 306 . 13 1 1 A 49 49 ASN CB C 49 35.767 38.092 -2.325 1 1 307 . 13 1 1 A 49 49 ASN N N 49 117.233 114.099 3.134 1 1 309 . 13 1 1 A 50 50 GLY H H 50 7.952 7.388 0.564 1 1 310 . 13 1 1 A 50 50 GLY HA2 H 50 4.518 4.133 0.385 1 1 311 . 13 1 1 A 50 50 GLY HA3 H 50 4.054 4.145 -0.091 1 1 312 . 13 1 1 A 50 50 GLY CA C 50 41.883 45.491 -3.608 1 1 313 . 13 1 1 A 50 50 GLY N N 50 108.751 107.865 0.886 1 1 314 . 13 1 1 A 51 51 THR H H 51 8.548 8.642 -0.094 1 1 315 . 13 1 1 A 51 51 THR HA H 51 5.012 5.442 -0.430 1 1 320 . 13 1 1 A 51 51 THR CA C 51 57.026 59.850 -2.824 1 1 321 . 13 1 1 A 51 51 THR CB C 51 69.887 71.014 -1.127 1 1 323 . 13 1 1 A 51 51 THR N N 51 108.710 116.552 -7.842 1 1 324 . 13 1 1 A 52 52 LEU H H 52 9.110 8.670 0.440 1 1 325 . 13 1 1 A 52 52 LEU HA H 52 5.183 5.278 -0.095 1 1 333 . 13 1 1 A 52 52 LEU CA C 52 50.822 53.961 -3.139 1 1 335 . 13 1 1 A 52 52 LEU N N 52 124.606 122.461 2.145 1 1 336 . 13 1 1 A 53 53 THR H H 53 9.312 8.638 0.674 1 1 337 . 13 1 1 A 53 53 THR HA H 53 5.288 5.236 0.052 1 1 342 . 13 1 1 A 53 53 THR CA C 53 59.535 60.996 -1.461 1 1 343 . 13 1 1 A 53 53 THR CB C 53 66.838 72.290 -5.452 1 1 345 . 13 1 1 A 53 53 THR N N 53 125.445 115.394 10.051 1 1 346 . 13 1 1 A 54 54 LEU H H 54 8.992 8.603 0.389 1 1 347 . 13 1 1 A 54 54 LEU HA H 54 5.563 5.888 -0.325 1 1 357 . 13 1 1 A 54 54 LEU N N 54 128.814 119.754 9.060 1 1 358 . 13 1 1 A 55 55 SER H H 55 9.017 8.849 0.168 1 1 359 . 13 1 1 A 55 55 SER HA H 55 5.476 5.349 0.127 1 1 362 . 13 1 1 A 55 55 SER CA C 55 53.944 56.283 -2.339 1 1 363 . 13 1 1 A 55 55 SER CB C 55 63.384 66.392 -3.008 1 1 364 . 13 1 1 A 55 55 SER N N 55 112.964 117.783 -4.819 1 1 365 . 13 1 1 A 56 56 ALA H H 56 8.324 9.600 -1.276 1 1 366 . 13 1 1 A 56 56 ALA HA H 56 4.605 4.709 -0.104 1 1 370 . 13 1 1 A 56 56 ALA CA C 56 50.743 50.278 0.465 1 1 371 . 13 1 1 A 56 56 ALA CB C 56 21.372 22.027 -0.655 1 1 372 . 13 1 1 A 56 56 ALA N N 56 123.555 124.965 -1.410 1 1 373 . 13 1 1 A 57 57 GLN H H 57 9.080 8.539 0.541 1 1 374 . 13 1 1 A 57 57 GLN HA H 57 3.884 4.390 -0.506 1 1 381 . 13 1 1 A 57 57 GLN CA C 57 53.331 55.034 -1.703 1 1 382 . 13 1 1 A 57 57 GLN CB C 57 24.659 27.556 -2.897 1 1 384 . 13 1 1 A 57 57 GLN N N 57 116.815 117.322 -0.507 1 1 386 . 13 1 1 A 58 58 GLY H H 58 8.527 7.944 0.583 1 1 387 . 13 1 1 A 58 58 GLY HA2 H 58 4.168 4.052 0.116 1 1 388 . 13 1 1 A 58 58 GLY HA3 H 58 3.608 4.056 -0.448 1 1 389 . 13 1 1 A 58 58 GLY CA C 58 42.856 45.702 -2.846 1 1 390 . 13 1 1 A 58 58 GLY N N 58 105.983 107.719 -1.736 1 1 391 . 13 1 1 A 59 59 ALA H H 59 8.203 7.690 0.513 1 1 392 . 13 1 1 A 59 59 ALA HA H 59 4.811 4.591 0.220 1 1 396 . 13 1 1 A 59 59 ALA CA C 59 47.662 51.431 -3.769 1 1 397 . 13 1 1 A 59 59 ALA CB C 59 20.147 22.765 -2.618 1 1 398 . 13 1 1 A 59 59 ALA N N 59 125.153 121.394 3.759 1 1 399 . 13 1 1 A 60 60 GLU H H 60 8.154 8.908 -0.754 1 1 400 . 13 1 1 A 60 60 GLU HA H 60 5.508 5.380 0.128 1 1 404 . 13 1 1 A 60 60 GLU CA C 60 52.179 54.283 -2.104 1 1 405 . 13 1 1 A 60 60 GLU CB C 60 30.203 34.480 -4.277 1 1 406 . 13 1 1 A 60 60 GLU N N 60 117.318 116.430 0.888 1 1 407 . 13 1 1 A 61 61 LYS H H 61 8.821 9.222 -0.401 1 1 408 . 13 1 1 A 61 61 LYS HA H 61 4.311 4.751 -0.440 1 1 413 . 13 1 1 A 61 61 LYS N N 61 123.743 120.606 3.137 1 1 414 . 13 1 1 A 62 62 THR H H 62 8.149 8.575 -0.426 1 1 415 . 13 1 1 A 62 62 THR HA H 62 4.928 4.511 0.417 1 1 420 . 13 1 1 A 62 62 THR CA C 62 59.427 63.057 -3.630 1 1 421 . 13 1 1 A 62 62 THR CB C 62 66.932 69.024 -2.092 1 1 422 . 13 1 1 A 62 62 THR N N 62 122.829 120.689 2.140 1 1 423 . 13 1 1 A 63 63 TYR H H 63 9.466 9.329 0.137 1 1 424 . 13 1 1 A 63 63 TYR HA H 63 4.606 5.199 -0.593 1 1 431 . 13 1 1 A 63 63 TYR CA C 63 54.508 56.887 -2.379 1 1 432 . 13 1 1 A 63 63 TYR N N 63 127.472 129.043 -1.571 1 1 433 . 13 1 1 A 64 64 GLY H H 64 9.253 8.559 0.694 1 1 434 . 13 1 1 A 64 64 GLY HA2 H 64 4.670 4.247 0.423 1 1 435 . 13 1 1 A 64 64 GLY HA3 H 64 3.619 4.255 -0.636 1 1 436 . 13 1 1 A 64 64 GLY CA C 64 39.885 44.748 -4.863 1 1 437 . 13 1 1 A 64 64 GLY N N 64 110.182 111.722 -1.540 1 1 438 . 13 1 1 A 65 65 ASN H H 65 8.616 8.504 0.112 1 1 439 . 13 1 1 A 65 65 ASN HA H 65 4.109 4.382 -0.273 1 1 444 . 13 1 1 A 65 65 ASN CA C 65 53.691 54.825 -1.134 1 1 445 . 13 1 1 A 65 65 ASN N N 65 117.778 118.695 -0.917 1 1 447 . 13 1 1 A 66 66 GLY H H 66 9.053 8.947 0.106 1 1 448 . 13 1 1 A 66 66 GLY HA2 H 66 4.344 3.887 0.457 1 1 449 . 13 1 1 A 66 66 GLY HA3 H 66 3.359 3.888 -0.529 1 1 450 . 13 1 1 A 66 66 GLY CA C 66 42.431 44.822 -2.391 1 1 451 . 13 1 1 A 66 66 GLY N N 66 115.232 114.423 0.809 1 1 452 . 13 1 1 A 67 67 ASP H H 67 8.120 8.635 -0.515 1 1 453 . 13 1 1 A 67 67 ASP HA H 67 4.844 4.170 0.674 1 1 456 . 13 1 1 A 67 67 ASP N N 67 122.593 121.353 1.240 1 1 457 . 13 1 1 A 68 68 SER H H 68 8.500 8.775 -0.275 1 1 458 . 13 1 1 A 68 68 SER HA H 68 5.088 5.184 -0.096 1 1 461 . 13 1 1 A 68 68 SER CA C 68 54.858 57.144 -2.286 1 1 462 . 13 1 1 A 68 68 SER CB C 68 62.114 66.789 -4.675 1 1 463 . 13 1 1 A 68 68 SER N N 68 113.557 118.836 -5.279 1 1 464 . 13 1 1 A 69 69 LEU H H 69 8.989 9.983 -0.994 1 1 465 . 13 1 1 A 69 69 LEU HA H 69 4.570 5.108 -0.538 1 1 474 . 13 1 1 A 69 69 LEU N N 69 126.836 123.014 3.822 1 1 475 . 13 1 1 A 70 70 ASN H H 70 8.491 8.794 -0.303 1 1 476 . 13 1 1 A 70 70 ASN HA H 70 4.958 5.674 -0.716 1 1 479 . 13 1 1 A 70 70 ASN CB C 70 33.265 39.050 -5.785 1 1 480 . 13 1 1 A 70 70 ASN N N 70 126.343 124.452 1.891 1 1 481 . 13 1 1 A 71 71 THR H H 71 7.831 8.308 -0.477 1 1 482 . 13 1 1 A 71 71 THR HA H 71 3.759 4.602 -0.843 1 1 487 . 13 1 1 A 71 71 THR CA C 71 61.005 60.632 0.373 1 1 488 . 13 1 1 A 71 71 THR N N 71 114.742 114.426 0.316 1 1 489 . 13 1 1 A 72 72 GLY H H 72 8.880 8.350 0.530 1 1 490 . 13 1 1 A 72 72 GLY HA2 H 72 3.907 3.818 0.089 1 1 491 . 13 1 1 A 72 72 GLY HA3 H 72 3.907 3.823 0.084 1 1 492 . 13 1 1 A 72 72 GLY N N 72 114.976 110.475 4.501 1 1 493 . 13 1 1 A 73 73 LYS H H 73 6.604 8.015 -1.411 1 1 494 . 13 1 1 A 73 73 LYS HA H 73 4.160 4.519 -0.359 1 1 501 . 13 1 1 A 73 73 LYS N N 73 113.898 117.988 -4.090 1 1 502 . 13 1 1 A 74 74 LEU H H 74 7.422 8.543 -1.121 1 1 503 . 13 1 1 A 74 74 LEU HA H 74 4.358 4.515 -0.157 1 1 513 . 13 1 1 A 74 74 LEU N N 74 117.180 122.770 -5.590 1 1 514 . 13 1 1 A 75 75 LYS H H 75 8.617 8.536 0.081 1 1 515 . 13 1 1 A 75 75 LYS HA H 75 4.079 4.451 -0.372 1 1 518 . 13 1 1 A 75 75 LYS N N 75 121.119 119.161 1.958 1 1 519 . 13 1 1 A 76 76 ASN H H 76 8.154 8.727 -0.573 1 1 520 . 13 1 1 A 76 76 ASN HA H 76 3.935 5.441 -1.506 1 1 525 . 13 1 1 A 76 76 ASN CB C 76 35.772 38.930 -3.158 1 1 526 . 13 1 1 A 76 76 ASN N N 76 122.761 119.986 2.775 1 1 527 . 13 1 1 A 77 77 ASP H H 77 9.227 7.881 1.346 1 1 528 . 13 1 1 A 77 77 ASP HA H 77 3.787 5.279 -1.492 1 1 531 . 13 1 1 A 77 77 ASP CA C 77 52.584 53.445 -0.861 1 1 532 . 13 1 1 A 77 77 ASP N N 77 114.129 118.156 -4.027 1 1 533 . 13 1 1 A 78 78 LYS H H 78 6.579 8.237 -1.658 1 1 534 . 13 1 1 A 78 78 LYS HA H 78 4.572 4.798 -0.226 1 1 539 . 13 1 1 A 78 78 LYS CA C 78 51.072 54.311 -3.239 1 1 540 . 13 1 1 A 78 78 LYS CB C 78 33.783 36.799 -3.016 1 1 541 . 13 1 1 A 78 78 LYS N N 78 114.135 121.953 -7.818 1 1 542 . 13 1 1 A 79 79 VAL H H 79 8.729 8.070 0.659 1 1 543 . 13 1 1 A 79 79 VAL HA H 79 4.402 4.554 -0.152 1 1 551 . 13 1 1 A 79 79 VAL CA C 79 59.240 60.002 -0.762 1 1 553 . 13 1 1 A 79 79 VAL N N 79 123.191 120.258 2.933 1 1 554 . 13 1 1 A 80 80 SER H H 80 9.542 8.911 0.631 1 1 555 . 13 1 1 A 80 80 SER HA H 80 4.636 4.906 -0.270 1 1 558 . 13 1 1 A 80 80 SER CA C 80 55.978 57.686 -1.708 1 1 559 . 13 1 1 A 80 80 SER N N 80 127.445 118.221 9.224 1 1 560 . 13 1 1 A 81 81 ARG H H 81 8.093 8.747 -0.654 1 1 561 . 13 1 1 A 81 81 ARG HA H 81 5.210 5.725 -0.515 1 1 569 . 13 1 1 A 81 81 ARG N N 81 123.743 123.253 0.490 1 1 571 . 13 1 1 A 82 82 PHE H H 82 9.312 7.946 1.366 1 1 572 . 13 1 1 A 82 82 PHE HA H 82 4.951 5.487 -0.536 1 1 577 . 13 1 1 A 82 82 PHE CA C 82 53.090 55.410 -2.320 1 1 578 . 13 1 1 A 82 82 PHE N N 82 119.529 117.151 2.378 1 1 579 . 13 1 1 A 83 83 ASP H H 83 9.122 9.006 0.116 1 1 580 . 13 1 1 A 83 83 ASP HA H 83 5.593 4.910 0.683 1 1 583 . 13 1 1 A 83 83 ASP N N 83 123.825 121.416 2.409 1 1 584 . 13 1 1 A 84 84 PHE H H 84 9.090 8.181 0.909 1 1 585 . 13 1 1 A 84 84 PHE HA H 84 6.410 6.016 0.394 1 1 592 . 13 1 1 A 84 84 PHE CA C 84 52.584 56.360 -3.776 1 1 593 . 13 1 1 A 84 84 PHE N N 84 118.862 119.385 -0.523 1 1 594 . 13 1 1 A 85 85 ILE H H 85 8.441 9.013 -0.572 1 1 595 . 13 1 1 A 85 85 ILE HA H 85 4.662 4.923 -0.261 1 1 605 . 13 1 1 A 85 85 ILE CB C 85 39.939 40.987 -1.048 1 1 608 . 13 1 1 A 85 85 ILE N N 85 118.049 121.831 -3.782 1 1 609 . 13 1 1 A 86 86 ARG H H 86 8.983 8.656 0.327 1 1 610 . 13 1 1 A 86 86 ARG HA H 86 5.591 4.686 0.905 1 1 616 . 13 1 1 A 86 86 ARG N N 86 127.006 128.312 -1.306 1 1 618 . 13 1 1 A 87 87 GLN H H 87 8.643 8.775 -0.132 1 1 619 . 13 1 1 A 87 87 GLN HA H 87 5.630 5.083 0.547 1 1 626 . 13 1 1 A 87 87 GLN CA C 87 51.512 54.464 -2.952 1 1 627 . 13 1 1 A 87 87 GLN N N 87 124.142 122.377 1.765 1 1 629 . 13 1 1 A 88 88 ILE H H 88 8.617 8.743 -0.126 1 1 630 . 13 1 1 A 88 88 ILE HA H 88 4.690 4.839 -0.149 1 1 637 . 13 1 1 A 88 88 ILE CA C 88 56.995 60.591 -3.596 1 1 638 . 13 1 1 A 88 88 ILE CB C 88 39.927 40.074 -0.147 1 1 641 . 13 1 1 A 88 88 ILE N N 88 116.353 122.963 -6.610 1 1 642 . 13 1 1 A 89 89 GLU H H 89 8.298 9.034 -0.736 1 1 643 . 13 1 1 A 89 89 GLU HA H 89 5.100 5.813 -0.713 1 1 646 . 13 1 1 A 89 89 GLU CA C 89 52.204 54.988 -2.784 1 1 647 . 13 1 1 A 89 89 GLU CB C 89 27.325 33.267 -5.942 1 1 648 . 13 1 1 A 89 89 GLU N N 89 124.458 129.501 -5.043 1 1 649 . 13 1 1 A 90 90 VAL H H 90 8.957 8.866 0.091 1 1 650 . 13 1 1 A 90 90 VAL HA H 90 4.169 4.596 -0.427 1 1 658 . 13 1 1 A 90 90 VAL CA C 90 58.664 60.090 -1.426 1 1 659 . 13 1 1 A 90 90 VAL CB C 90 31.861 33.041 -1.180 1 1 660 . 13 1 1 A 90 90 VAL N N 90 127.580 126.853 0.727 1 1 661 . 13 1 1 A 91 91 ASP H H 91 9.369 8.572 0.797 1 1 662 . 13 1 1 A 91 91 ASP HA H 91 4.287 4.620 -0.333 1 1 665 . 13 1 1 A 91 91 ASP CA C 91 52.389 54.796 -2.407 1 1 666 . 13 1 1 A 91 91 ASP CB C 91 36.409 40.414 -4.005 1 1 667 . 13 1 1 A 91 91 ASP N N 91 129.411 123.744 5.667 1 1 668 . 13 1 1 A 92 92 GLY H H 92 8.552 7.442 1.110 1 1 669 . 13 1 1 A 92 92 GLY HA2 H 92 4.090 4.096 -0.006 1 1 670 . 13 1 1 A 92 92 GLY HA3 H 92 3.618 4.097 -0.479 1 1 671 . 13 1 1 A 92 92 GLY CA C 92 42.836 45.594 -2.758 1 1 672 . 13 1 1 A 92 92 GLY N N 92 103.862 105.541 -1.679 1 1 673 . 13 1 1 A 93 93 GLN H H 93 7.808 7.590 0.218 1 1 674 . 13 1 1 A 93 93 GLN HA H 93 4.578 4.838 -0.260 1 1 679 . 13 1 1 A 93 93 GLN CA C 93 50.918 54.308 -3.390 1 1 680 . 13 1 1 A 93 93 GLN CB C 93 28.602 31.186 -2.584 1 1 682 . 13 1 1 A 93 93 GLN N N 93 120.412 118.887 1.525 1 1 683 . 13 1 1 A 94 94 LEU H H 94 8.414 8.481 -0.067 1 1 684 . 13 1 1 A 94 94 LEU HA H 94 4.704 4.249 0.455 1 1 693 . 13 1 1 A 94 94 LEU CB C 94 39.873 42.437 -2.564 1 1 696 . 13 1 1 A 94 94 LEU N N 94 125.061 122.371 2.690 1 1 697 . 13 1 1 A 95 95 ILE H H 95 9.181 8.612 0.569 1 1 698 . 13 1 1 A 95 95 ILE HA H 95 4.371 4.845 -0.474 1 1 708 . 13 1 1 A 95 95 ILE CA C 95 63.319 60.779 2.540 1 1 709 . 13 1 1 A 95 95 ILE CB C 95 37.407 39.697 -2.290 1 1 711 . 13 1 1 A 95 95 ILE N N 95 127.724 121.792 5.932 1 1 712 . 13 1 1 A 96 96 THR H H 96 8.730 7.383 1.347 1 1 713 . 13 1 1 A 96 96 THR HA H 96 4.411 5.028 -0.617 1 1 718 . 13 1 1 A 96 96 THR CA C 96 60.344 62.930 -2.586 1 1 719 . 13 1 1 A 96 96 THR CB C 96 59.719 69.828 -10.109 1 1 720 . 13 1 1 A 96 96 THR N N 96 124.240 118.943 5.297 1 1 721 . 13 1 1 A 97 97 LEU H H 97 8.790 10.125 -1.335 1 1 722 . 13 1 1 A 97 97 LEU HA H 97 4.400 5.001 -0.601 1 1 732 . 13 1 1 A 97 97 LEU N N 97 126.147 123.957 2.190 1 1 733 . 13 1 1 A 98 98 GLU H H 98 7.596 8.618 -1.022 1 1 734 . 13 1 1 A 98 98 GLU HA H 98 5.102 4.996 0.106 1 1 739 . 13 1 1 A 98 98 GLU N N 98 116.937 122.242 -5.305 1 1 740 . 13 1 1 A 99 99 SER H H 99 8.906 8.792 0.114 1 1 741 . 13 1 1 A 99 99 SER HA H 99 4.504 5.371 -0.867 1 1 744 . 13 1 1 A 99 99 SER CA C 99 54.010 56.197 -2.187 1 1 745 . 13 1 1 A 99 99 SER CB C 99 63.876 66.757 -2.881 1 1 746 . 13 1 1 A 99 99 SER N N 99 117.823 118.054 -0.231 1 1 747 . 13 1 1 A 100 100 GLY H H 100 7.250 7.859 -0.609 1 1 748 . 13 1 1 A 100 100 GLY HA2 H 100 4.872 3.967 0.905 1 1 749 . 13 1 1 A 100 100 GLY HA3 H 100 3.731 4.054 -0.323 1 1 750 . 13 1 1 A 100 100 GLY N N 100 109.436 110.012 -0.576 1 1 751 . 13 1 1 A 101 101 GLU H H 101 9.661 9.360 0.301 1 1 752 . 13 1 1 A 101 101 GLU HA H 101 5.643 4.942 0.701 1 1 757 . 13 1 1 A 101 101 GLU CA C 101 52.584 54.582 -1.998 1 1 758 . 13 1 1 A 101 101 GLU CB C 101 31.750 33.400 -1.650 1 1 759 . 13 1 1 A 101 101 GLU N N 101 126.793 120.906 5.887 1 1 760 . 13 1 1 A 102 102 PHE H H 102 10.441 8.710 1.731 1 1 761 . 13 1 1 A 102 102 PHE HA H 102 5.248 5.243 0.005 1 1 768 . 13 1 1 A 102 102 PHE CA C 102 53.537 56.147 -2.610 1 1 769 . 13 1 1 A 102 102 PHE N N 102 131.837 125.551 6.286 1 1 770 . 13 1 1 A 103 103 GLN H H 103 9.135 9.250 -0.115 1 1 771 . 13 1 1 A 103 103 GLN HA H 103 5.205 5.048 0.157 1 1 776 . 13 1 1 A 103 103 GLN CA C 103 50.925 54.815 -3.890 1 1 777 . 13 1 1 A 103 103 GLN N N 103 127.720 126.971 0.749 1 1 778 . 13 1 1 A 104 104 VAL H H 104 8.937 8.787 0.150 1 1 779 . 13 1 1 A 104 104 VAL HA H 104 4.780 4.936 -0.156 1 1 787 . 13 1 1 A 104 104 VAL CA C 104 57.086 61.451 -4.365 1 1 789 . 13 1 1 A 104 104 VAL N N 104 120.097 126.575 -6.478 1 1 790 . 13 1 1 A 105 105 TYR H H 105 9.108 9.244 -0.136 1 1 791 . 13 1 1 A 105 105 TYR HA H 105 4.834 5.398 -0.564 1 1 798 . 13 1 1 A 105 105 TYR CA C 105 54.486 56.151 -1.665 1 1 799 . 13 1 1 A 105 105 TYR N N 105 128.426 128.947 -0.521 1 1 800 . 13 1 1 A 106 106 LYS H H 106 5.945 8.765 -2.820 1 1 805 . 13 1 1 A 106 106 LYS N N 106 129.163 126.803 2.360 1 1 806 . 13 1 1 A 107 107 GLN H H 107 8.526 9.812 -1.286 1 1 807 . 13 1 1 A 107 107 GLN HA H 107 5.160 4.863 0.297 1 1 812 . 13 1 1 A 107 107 GLN CA C 107 52.584 55.027 -2.443 1 1 813 . 13 1 1 A 107 107 GLN CB C 107 26.175 30.349 -4.174 1 1 814 . 13 1 1 A 107 107 GLN N N 107 125.978 122.501 3.477 1 1 815 . 13 1 1 A 108 108 SER H H 108 8.621 7.899 0.722 1 1 816 . 13 1 1 A 108 108 SER HA H 108 4.403 4.549 -0.146 1 1 819 . 13 1 1 A 108 108 SER CA C 108 58.521 61.109 -2.588 1 1 820 . 13 1 1 A 108 108 SER CB C 108 60.737 63.879 -3.142 1 1 821 . 13 1 1 A 108 108 SER N N 108 117.542 116.421 1.121 1 1 822 . 13 1 1 A 109 109 HIS H H 109 10.381 8.054 2.327 1 1 823 . 13 1 1 A 109 109 HIS HA H 109 4.594 4.765 -0.171 1 1 828 . 13 1 1 A 109 109 HIS CA C 109 51.743 56.643 -4.900 1 1 829 . 13 1 1 A 109 109 HIS CB C 109 27.174 32.086 -4.912 1 1 830 . 13 1 1 A 109 109 HIS N N 109 118.449 116.050 2.399 1 1 831 . 13 1 1 A 110 110 SER H H 110 7.366 8.030 -0.664 1 1 832 . 13 1 1 A 110 110 SER HA H 110 4.870 4.687 0.183 1 1 835 . 13 1 1 A 110 110 SER CB C 110 62.986 65.426 -2.440 1 1 836 . 13 1 1 A 110 110 SER N N 110 113.397 112.119 1.278 1 1 837 . 13 1 1 A 111 111 ALA H H 111 8.541 8.752 -0.211 1 1 838 . 13 1 1 A 111 111 ALA HA H 111 4.826 5.166 -0.340 1 1 842 . 13 1 1 A 111 111 ALA CA C 111 49.015 51.813 -2.798 1 1 843 . 13 1 1 A 111 111 ALA CB C 111 20.256 23.136 -2.880 1 1 844 . 13 1 1 A 111 111 ALA N N 111 117.786 123.212 -5.426 1 1 845 . 13 1 1 A 112 112 LEU H H 112 8.529 9.483 -0.954 1 1 846 . 13 1 1 A 112 112 LEU HA H 112 5.680 5.373 0.307 1 1 855 . 13 1 1 A 112 112 LEU CA C 112 51.818 53.074 -1.256 1 1 856 . 13 1 1 A 112 112 LEU N N 112 116.345 117.588 -1.243 1 1 857 . 13 1 1 A 113 113 THR H H 113 8.758 8.669 0.089 1 1 858 . 13 1 1 A 113 113 THR HA H 113 5.563 5.692 -0.129 1 1 863 . 13 1 1 A 113 113 THR CA C 113 54.458 60.455 -5.997 1 1 864 . 13 1 1 A 113 113 THR CB C 113 68.586 72.460 -3.874 1 1 866 . 13 1 1 A 113 113 THR N N 113 110.469 111.235 -0.766 1 1 867 . 13 1 1 A 114 114 ALA H H 114 8.829 9.186 -0.357 1 1 868 . 13 1 1 A 114 114 ALA HA H 114 4.466 5.011 -0.545 1 1 872 . 13 1 1 A 114 114 ALA CA C 114 48.886 51.617 -2.731 1 1 873 . 13 1 1 A 114 114 ALA CB C 114 21.583 22.104 -0.521 1 1 874 . 13 1 1 A 114 114 ALA N N 114 121.456 123.850 -2.394 1 1 875 . 13 1 1 A 115 115 LEU H H 115 8.407 8.839 -0.432 1 1 876 . 13 1 1 A 115 115 LEU HA H 115 4.814 4.466 0.348 1 1 886 . 13 1 1 A 115 115 LEU N N 115 119.223 124.064 -4.841 1 1 887 . 13 1 1 A 116 116 GLN H H 116 9.720 8.251 1.469 1 1 888 . 13 1 1 A 116 116 GLN HA H 116 5.312 4.651 0.661 1 1 893 . 13 1 1 A 116 116 GLN CA C 116 50.544 54.750 -4.206 1 1 894 . 13 1 1 A 116 116 GLN N N 116 127.827 121.912 5.915 1 1 895 . 13 1 1 A 117 117 THR H H 117 9.663 9.283 0.380 1 1 896 . 13 1 1 A 117 117 THR HA H 117 4.198 4.569 -0.371 1 1 901 . 13 1 1 A 117 117 THR CA C 117 64.037 61.601 2.436 1 1 902 . 13 1 1 A 117 117 THR CB C 117 66.868 69.801 -2.933 1 1 904 . 13 1 1 A 117 117 THR N N 117 128.929 122.827 6.102 1 1 905 . 13 1 1 A 118 118 GLU H H 118 9.486 8.611 0.875 1 1 906 . 13 1 1 A 118 118 GLU HA H 118 4.885 4.677 0.208 1 1 911 . 13 1 1 A 118 118 GLU N N 118 123.497 119.371 4.126 1 1 912 . 13 1 1 A 119 119 GLN H H 119 8.076 7.424 0.652 1 1 913 . 13 1 1 A 119 119 GLN HA H 119 5.331 4.904 0.427 1 1 916 . 13 1 1 A 119 119 GLN CA C 119 51.858 53.974 -2.116 1 1 917 . 13 1 1 A 119 119 GLN N N 119 118.023 119.439 -1.416 1 1 918 . 13 1 1 A 120 120 GLU H H 120 9.078 8.732 0.346 1 1 919 . 13 1 1 A 120 120 GLU HA H 120 5.071 4.862 0.209 1 1 924 . 13 1 1 A 120 120 GLU N N 120 118.433 123.195 -4.762 1 1 925 . 13 1 1 A 121 121 GLN H H 121 7.711 8.693 -0.982 1 1 926 . 13 1 1 A 121 121 GLN HA H 121 4.430 5.147 -0.717 1 1 933 . 13 1 1 A 121 121 GLN CA C 121 53.996 54.005 -0.009 1 1 934 . 13 1 1 A 121 121 GLN CB C 121 27.158 32.256 -5.098 1 1 936 . 13 1 1 A 121 121 GLN N N 121 122.412 121.724 0.688 1 1 938 . 13 1 1 A 122 122 ASP H H 122 8.675 8.645 0.030 1 1 939 . 13 1 1 A 122 122 ASP HA H 122 4.632 5.098 -0.466 1 1 942 . 13 1 1 A 122 122 ASP CA C 122 48.797 51.290 -2.493 1 1 943 . 13 1 1 A 122 122 ASP CB C 122 39.852 42.882 -3.030 1 1 944 . 13 1 1 A 122 122 ASP N N 122 128.625 125.288 3.337 1 1 945 . 13 1 1 A 123 123 PRO CA C 123 61.579 65.699 -4.120 1 1 946 . 13 1 1 A 123 123 PRO CB C 123 29.597 31.457 -1.860 1 1 948 . 13 1 1 A 124 124 GLU H H 124 8.297 8.656 -0.359 1 1 949 . 13 1 1 A 124 124 GLU HA H 124 4.196 3.734 0.462 1 1 954 . 13 1 1 A 124 124 GLU CA C 124 53.025 59.189 -6.164 1 1 955 . 13 1 1 A 124 124 GLU CB C 124 27.927 29.136 -1.209 1 1 957 . 13 1 1 A 124 124 GLU N N 124 115.538 117.505 -1.967 1 1 958 . 13 1 1 A 125 125 HIS H H 125 7.419 7.716 -0.297 1 1 959 . 13 1 1 A 125 125 HIS HA H 125 4.833 4.982 -0.149 1 1 964 . 13 1 1 A 125 125 HIS CA C 125 51.886 54.209 -2.323 1 1 965 . 13 1 1 A 125 125 HIS CB C 125 26.387 29.376 -2.989 1 1 966 . 13 1 1 A 125 125 HIS N N 125 117.464 116.650 0.814 1 1 967 . 13 1 1 A 126 126 SER H H 126 8.441 8.408 0.033 1 1 968 . 13 1 1 A 126 126 SER HA H 126 4.261 4.832 -0.571 1 1 971 . 13 1 1 A 126 126 SER CA C 126 57.988 61.932 -3.944 1 1 972 . 13 1 1 A 126 126 SER N N 126 117.954 117.550 0.404 1 1 973 . 13 1 1 A 127 127 GLU H H 127 9.221 8.556 0.665 1 1 974 . 13 1 1 A 127 127 GLU HA H 127 4.366 4.258 0.108 1 1 979 . 13 1 1 A 127 127 GLU CA C 127 53.707 57.374 -3.667 1 1 980 . 13 1 1 A 127 127 GLU CB C 127 25.492 28.637 -3.145 1 1 981 . 13 1 1 A 127 127 GLU N N 127 120.404 118.259 2.145 1 1 982 . 13 1 1 A 128 128 LYS H H 128 8.262 9.339 -1.077 1 1 983 . 13 1 1 A 128 128 LYS HA H 128 4.661 4.481 0.180 1 1 990 . 13 1 1 A 128 128 LYS CA C 128 52.264 56.264 -4.000 1 1 991 . 13 1 1 A 128 128 LYS CB C 128 32.404 33.752 -1.348 1 1 994 . 13 1 1 A 128 128 LYS N N 128 122.166 121.120 1.046 1 1 995 . 13 1 1 A 129 129 MET H H 129 8.242 8.695 -0.453 1 1 996 . 13 1 1 A 129 129 MET HA H 129 5.012 5.954 -0.942 1 1 1001 . 13 1 1 A 129 129 MET CA C 129 50.958 53.990 -3.032 1 1 1003 . 13 1 1 A 129 129 MET N N 129 119.422 117.142 2.280 1 1 1004 . 13 1 1 A 130 130 VAL H H 130 9.200 8.862 0.338 1 1 1005 . 13 1 1 A 130 130 VAL HA H 130 4.609 4.627 -0.018 1 1 1013 . 13 1 1 A 130 130 VAL CA C 130 56.296 61.133 -4.837 1 1 1014 . 13 1 1 A 130 130 VAL CB C 130 32.606 32.314 0.292 1 1 1015 . 13 1 1 A 130 130 VAL N N 130 118.290 124.034 -5.744 1 1 1016 . 13 1 1 A 131 131 ALA H H 131 8.368 8.606 -0.238 1 1 1017 . 13 1 1 A 131 131 ALA HA H 131 4.654 5.203 -0.549 1 1 1021 . 13 1 1 A 131 131 ALA CA C 131 49.739 50.523 -0.784 1 1 1022 . 13 1 1 A 131 131 ALA CB C 131 15.351 21.094 -5.743 1 1 1023 . 13 1 1 A 131 131 ALA N N 131 126.734 124.390 2.344 1 1 1024 . 13 1 1 A 132 132 LYS H H 132 7.732 8.869 -1.137 1 1 1025 . 13 1 1 A 132 132 LYS HA H 132 4.171 5.085 -0.914 1 1 1028 . 13 1 1 A 132 132 LYS N N 132 127.309 120.459 6.850 1 1 1029 . 13 1 1 A 133 133 ARG H H 133 8.193 8.523 -0.330 1 1 1030 . 13 1 1 A 133 133 ARG HA H 133 5.073 5.043 0.030 1 1 1038 . 13 1 1 A 133 133 ARG N N 133 122.190 119.665 2.525 1 1 1040 . 13 1 1 A 134 134 ARG H H 134 7.539 8.891 -1.352 1 1 1041 . 13 1 1 A 134 134 ARG HA H 134 4.667 4.846 -0.179 1 1 1049 . 13 1 1 A 134 134 ARG CA C 134 52.584 55.047 -2.463 1 1 1050 . 13 1 1 A 134 134 ARG CB C 134 31.325 33.473 -2.148 1 1 1052 . 13 1 1 A 134 134 ARG N N 134 121.632 124.813 -3.181 1 1 1054 . 13 1 1 A 135 135 PHE H H 135 8.816 8.166 0.650 1 1 1055 . 13 1 1 A 135 135 PHE HA H 135 5.680 5.555 0.125 1 1 1062 . 13 1 1 A 135 135 PHE N N 135 125.107 122.152 2.955 1 1 1063 . 13 1 1 A 136 136 ARG H H 136 7.741 8.931 -1.190 1 1 1064 . 13 1 1 A 136 136 ARG HA H 136 4.402 4.722 -0.320 1 1 1068 . 13 1 1 A 136 136 ARG N N 136 125.640 121.379 4.261 1 1 1070 . 13 1 1 A 137 137 ILE H H 137 8.556 8.614 -0.058 1 1 1071 . 13 1 1 A 137 137 ILE HA H 137 3.912 4.868 -0.956 1 1 1076 . 13 1 1 A 137 137 ILE CA C 137 55.676 60.230 -4.554 1 1 1079 . 13 1 1 A 137 137 ILE N N 137 122.891 121.917 0.974 1 1 1080 . 13 1 1 A 138 138 GLY H H 138 8.676 8.949 -0.273 1 1 1081 . 13 1 1 A 138 138 GLY HA2 H 138 3.740 4.125 -0.385 1 1 1082 . 13 1 1 A 138 138 GLY HA3 H 138 2.982 4.155 -1.173 1 1 1083 . 13 1 1 A 138 138 GLY CA C 138 41.908 46.137 -4.229 1 1 1084 . 13 1 1 A 138 138 GLY N N 138 117.058 115.960 1.098 1 1 1085 . 13 1 1 A 139 139 ASP H H 139 7.858 8.682 -0.824 1 1 1086 . 13 1 1 A 139 139 ASP HA H 139 4.753 4.769 -0.016 1 1 1089 . 13 1 1 A 139 139 ASP CA C 139 52.584 54.357 -1.773 1 1 1090 . 13 1 1 A 139 139 ASP CB C 139 43.062 41.157 1.905 1 1 1091 . 13 1 1 A 139 139 ASP N N 139 124.516 121.641 2.875 1 1 1092 . 13 1 1 A 140 140 ILE H H 140 8.354 8.339 0.015 1 1 1093 . 13 1 1 A 140 140 ILE HA H 140 4.473 4.313 0.160 1 1 1103 . 13 1 1 A 140 140 ILE CB C 140 36.173 41.359 -5.186 1 1 1105 . 13 1 1 A 140 140 ILE N N 140 120.679 121.335 -0.656 1 1 1106 . 13 1 1 A 141 141 ALA H H 141 8.708 8.213 0.495 1 1 1107 . 13 1 1 A 141 141 ALA HA H 141 4.862 4.778 0.084 1 1 1111 . 13 1 1 A 141 141 ALA CA C 141 47.968 50.325 -2.357 1 1 1112 . 13 1 1 A 141 141 ALA CB C 141 21.733 21.482 0.251 1 1 1113 . 13 1 1 A 141 141 ALA N N 141 130.144 129.995 0.149 1 1 1114 . 13 1 1 A 142 142 GLY H H 142 7.888 8.693 -0.805 1 1 1115 . 13 1 1 A 142 142 GLY HA2 H 142 4.519 3.877 0.642 1 1 1116 . 13 1 1 A 142 142 GLY HA3 H 142 3.634 3.894 -0.260 1 1 1117 . 13 1 1 A 142 142 GLY N N 142 102.272 106.260 -3.988 1 1 1118 . 13 1 1 A 143 143 GLU H H 143 8.068 8.000 0.068 1 1 1119 . 13 1 1 A 143 143 GLU HA H 143 4.577 4.398 0.179 1 1 1124 . 13 1 1 A 143 143 GLU N N 143 120.569 117.398 3.171 1 1 1125 . 13 1 1 A 144 144 HIS H H 144 8.478 7.613 0.865 1 1 1126 . 13 1 1 A 144 144 HIS HA H 144 4.968 4.530 0.438 1 1 1131 . 13 1 1 A 144 144 HIS N N 144 124.275 122.547 1.728 1 1 1132 . 13 1 1 A 145 145 THR H H 145 9.031 8.027 1.004 1 1 1133 . 13 1 1 A 145 145 THR HA H 145 4.025 5.172 -1.147 1 1 1138 . 13 1 1 A 145 145 THR CA C 145 61.247 60.355 0.892 1 1 1139 . 13 1 1 A 145 145 THR CB C 145 65.181 70.775 -5.594 1 1 1141 . 13 1 1 A 145 145 THR N N 145 125.828 115.985 9.843 1 1 1142 . 13 1 1 A 146 146 SER H H 146 9.077 8.688 0.389 1 1 1143 . 13 1 1 A 146 146 SER HA H 146 4.684 5.115 -0.431 1 1 1145 . 13 1 1 A 146 146 SER CA C 146 56.067 58.089 -2.022 1 1 1146 . 13 1 1 A 146 146 SER CB C 146 60.510 63.840 -3.330 1 1 1147 . 13 1 1 A 146 146 SER N N 146 124.154 118.974 5.180 1 1 1148 . 13 1 1 A 147 147 PHE H H 147 9.049 8.852 0.197 1 1 1149 . 13 1 1 A 147 147 PHE HA H 147 4.022 4.218 -0.196 1 1 1154 . 13 1 1 A 147 147 PHE N N 147 127.670 126.077 1.593 1 1 1155 . 13 1 1 A 148 148 ASP H H 148 8.504 7.509 0.995 1 1 1156 . 13 1 1 A 148 148 ASP HA H 148 4.422 4.350 0.072 1 1 1158 . 13 1 1 A 148 148 ASP CA C 148 52.584 56.201 -3.617 1 1 1159 . 13 1 1 A 148 148 ASP CB C 148 37.800 40.607 -2.807 1 1 1160 . 13 1 1 A 148 148 ASP N N 148 114.377 120.086 -5.709 1 1 1161 . 13 1 1 A 149 149 LYS H H 149 7.380 8.204 -0.824 1 1 1162 . 13 1 1 A 149 149 LYS HA H 149 4.487 4.157 0.330 1 1 1171 . 13 1 1 A 149 149 LYS CA C 149 51.735 57.604 -5.869 1 1 1172 . 13 1 1 A 149 149 LYS CB C 149 30.162 32.256 -2.094 1 1 1175 . 13 1 1 A 149 149 LYS N N 149 119.137 117.429 1.708 1 1 1176 . 13 1 1 A 150 150 LEU H H 150 6.886 7.790 -0.904 1 1 1177 . 13 1 1 A 150 150 LEU HA H 150 3.996 4.581 -0.585 1 1 1186 . 13 1 1 A 150 150 LEU CA C 150 50.502 56.154 -5.652 1 1 1187 . 13 1 1 A 150 150 LEU N N 150 120.614 118.928 1.686 1 1 1188 . 13 1 1 A 151 151 PRO CB C 151 29.567 32.104 -2.537 1 1 1190 . 13 1 1 A 152 152 LYS H H 152 8.076 9.068 -0.992 1 1 1191 . 13 1 1 A 152 152 LYS HA H 152 4.346 4.696 -0.350 1 1 1195 . 13 1 1 A 152 152 LYS CA C 152 53.182 57.223 -4.041 1 1 1196 . 13 1 1 A 152 152 LYS CB C 152 31.487 35.128 -3.641 1 1 1198 . 13 1 1 A 152 152 LYS N N 152 118.133 119.043 -0.910 1 1 1199 . 13 1 1 A 153 153 ASP H H 153 7.982 8.241 -0.259 1 1 1200 . 13 1 1 A 153 153 ASP HA H 153 4.402 4.929 -0.527 1 1 1203 . 13 1 1 A 153 153 ASP CA C 153 52.584 53.453 -0.869 1 1 1204 . 13 1 1 A 153 153 ASP CB C 153 37.762 41.647 -3.885 1 1 1205 . 13 1 1 A 153 153 ASP N N 153 115.735 114.050 1.685 1 1 1206 . 13 1 1 A 154 154 VAL H H 154 6.987 7.615 -0.628 1 1 1207 . 13 1 1 A 154 154 VAL HA H 154 4.406 4.213 0.193 1 1 1215 . 13 1 1 A 154 154 VAL CA C 154 58.408 60.803 -2.395 1 1 1216 . 13 1 1 A 154 154 VAL CB C 154 32.617 33.313 -0.696 1 1 1217 . 13 1 1 A 154 154 VAL N N 154 116.266 120.101 -3.835 1 1 1218 . 13 1 1 A 155 155 MET H H 155 8.444 8.479 -0.035 1 1 1219 . 13 1 1 A 155 155 MET HA H 155 5.416 5.154 0.262 1 1 1224 . 13 1 1 A 155 155 MET CA C 155 51.183 53.664 -2.481 1 1 1226 . 13 1 1 A 155 155 MET N N 155 124.950 122.785 2.165 1 1 1227 . 13 1 1 A 156 156 ALA H H 156 9.226 8.011 1.215 1 1 1228 . 13 1 1 A 156 156 ALA HA H 156 4.693 4.830 -0.137 1 1 1232 . 13 1 1 A 156 156 ALA CA C 156 48.379 50.696 -2.317 1 1 1233 . 13 1 1 A 156 156 ALA CB C 156 21.051 20.328 0.723 1 1 1234 . 13 1 1 A 156 156 ALA N N 156 129.938 126.988 2.950 1 1 1235 . 13 1 1 A 157 157 THR H H 157 8.554 8.741 -0.187 1 1 1236 . 13 1 1 A 157 157 THR HA H 157 4.839 4.565 0.274 1 1 1241 . 13 1 1 A 157 157 THR CA C 157 59.555 62.956 -3.401 1 1 1242 . 13 1 1 A 157 157 THR CB C 157 68.575 69.550 -0.975 1 1 1244 . 13 1 1 A 157 157 THR N N 157 118.815 119.907 -1.092 1 1 1245 . 13 1 1 A 158 158 TYR H H 158 9.974 10.024 -0.050 1 1 1246 . 13 1 1 A 158 158 TYR HA H 158 4.435 5.164 -0.729 1 1 1253 . 13 1 1 A 158 158 TYR N N 158 126.958 124.825 2.133 1 1 1254 . 13 1 1 A 159 159 ARG H H 159 8.909 8.682 0.227 1 1 1255 . 13 1 1 A 159 159 ARG HA H 159 5.444 5.271 0.173 1 1 1263 . 13 1 1 A 159 159 ARG CA C 159 51.933 54.543 -2.610 1 1 1264 . 13 1 1 A 159 159 ARG N N 159 121.721 119.616 2.105 1 1 1266 . 13 1 1 A 160 160 GLY H H 160 8.910 8.455 0.455 1 1 1267 . 13 1 1 A 160 160 GLY HA2 H 160 4.904 4.359 0.545 1 1 1268 . 13 1 1 A 160 160 GLY HA3 H 160 4.484 4.605 -0.121 1 1 1269 . 13 1 1 A 160 160 GLY N N 160 113.921 107.504 6.417 1 1 1270 . 13 1 1 A 161 161 THR H H 161 9.110 9.171 -0.061 1 1 1271 . 13 1 1 A 161 161 THR HA H 161 4.810 5.335 -0.525 1 1 1276 . 13 1 1 A 161 161 THR CA C 161 59.603 59.603 0.000 1 1 1277 . 13 1 1 A 161 161 THR CB C 161 69.909 72.450 -2.541 1 1 1279 . 13 1 1 A 161 161 THR N N 161 126.813 113.809 13.004 1 1 1280 . 13 1 1 A 162 162 ALA H H 162 7.137 9.889 -2.752 1 1 1281 . 13 1 1 A 162 162 ALA HA H 162 5.361 5.163 0.198 1 1 1285 . 13 1 1 A 162 162 ALA CA C 162 46.573 50.689 -4.116 1 1 1286 . 13 1 1 A 162 162 ALA CB C 162 20.959 23.653 -2.694 1 1 1287 . 13 1 1 A 162 162 ALA N N 162 128.111 126.449 1.662 1 1 1288 . 13 1 1 A 163 163 PHE H H 163 8.587 9.625 -1.038 1 1 1289 . 13 1 1 A 163 163 PHE HA H 163 5.538 5.602 -0.064 1 1 1296 . 13 1 1 A 163 163 PHE N N 163 117.349 114.465 2.884 1 1 1297 . 13 1 1 A 164 164 GLY H H 164 8.650 9.058 -0.408 1 1 1298 . 13 1 1 A 164 164 GLY HA2 H 164 4.210 3.803 0.407 1 1 1299 . 13 1 1 A 164 164 GLY HA3 H 164 3.285 4.019 -0.734 1 1 1300 . 13 1 1 A 164 164 GLY CA C 164 40.377 44.123 -3.746 1 1 1301 . 13 1 1 A 164 164 GLY N N 164 108.839 108.506 0.333 1 1 1302 . 13 1 1 A 165 165 SER H H 165 7.684 9.025 -1.341 1 1 1303 . 13 1 1 A 165 165 SER HA H 165 3.458 4.506 -1.048 1 1 1304 . 13 1 1 A 165 165 SER N N 165 116.037 118.501 -2.464 1 1 1305 . 13 1 1 A 166 166 ASP H H 166 9.718 7.915 1.803 1 1 1306 . 13 1 1 A 166 166 ASP HA H 166 4.281 4.843 -0.562 1 1 1309 . 13 1 1 A 166 166 ASP CA C 166 52.584 53.895 -1.311 1 1 1310 . 13 1 1 A 166 166 ASP N N 166 125.166 119.592 5.574 1 1 1311 . 13 1 1 A 167 167 ASP H H 167 7.655 7.399 0.256 1 1 1312 . 13 1 1 A 167 167 ASP HA H 167 4.666 5.001 -0.335 1 1 1315 . 13 1 1 A 167 167 ASP CB C 167 38.948 44.041 -5.093 1 1 1316 . 13 1 1 A 167 167 ASP N N 167 117.491 118.939 -1.448 1 1 1317 . 13 1 1 A 168 168 ALA H H 168 8.585 8.473 0.112 1 1 1318 . 13 1 1 A 168 168 ALA HA H 168 5.012 4.017 0.995 1 1 1322 . 13 1 1 A 168 168 ALA CA C 168 47.485 54.701 -7.216 1 1 1323 . 13 1 1 A 168 168 ALA N N 168 128.834 122.927 5.907 1 1 1324 . 13 1 1 A 169 169 GLY H H 169 8.472 7.511 0.961 1 1 1325 . 13 1 1 A 169 169 GLY HA2 H 169 4.404 4.130 0.274 1 1 1326 . 13 1 1 A 169 169 GLY HA3 H 169 4.051 4.159 -0.108 1 1 1327 . 13 1 1 A 169 169 GLY CA C 169 43.257 45.998 -2.741 1 1 1328 . 13 1 1 A 169 169 GLY N N 169 107.133 103.044 4.089 1 1 1329 . 13 1 1 A 170 170 GLY H H 170 7.229 8.014 -0.785 1 1 1330 . 13 1 1 A 170 170 GLY HA2 H 170 4.223 4.119 0.104 1 1 1331 . 13 1 1 A 170 170 GLY HA3 H 170 3.781 4.168 -0.387 1 1 1332 . 13 1 1 A 170 170 GLY CA C 170 43.310 45.790 -2.480 1 1 1333 . 13 1 1 A 170 170 GLY N N 170 107.542 109.646 -2.104 1 1 1334 . 13 1 1 A 171 171 LYS H H 171 9.641 8.411 1.230 1 1 1335 . 13 1 1 A 171 171 LYS HA H 171 5.129 4.943 0.186 1 1 1342 . 13 1 1 A 171 171 LYS CA C 171 51.355 55.093 -3.738 1 1 1343 . 13 1 1 A 171 171 LYS N N 171 124.322 120.618 3.704 1 1 1344 . 13 1 1 A 172 172 LEU H H 172 7.764 8.557 -0.793 1 1 1345 . 13 1 1 A 172 172 LEU HA H 172 4.973 5.021 -0.048 1 1 1353 . 13 1 1 A 172 172 LEU CA C 172 50.348 53.850 -3.502 1 1 1354 . 13 1 1 A 172 172 LEU N N 172 126.389 121.731 4.658 1 1 1355 . 13 1 1 A 173 173 THR H H 173 8.321 8.784 -0.463 1 1 1356 . 13 1 1 A 173 173 THR HA H 173 5.017 5.161 -0.144 1 1 1361 . 13 1 1 A 173 173 THR CA C 173 59.149 61.444 -2.295 1 1 1362 . 13 1 1 A 173 173 THR CB C 173 67.449 70.269 -2.820 1 1 1364 . 13 1 1 A 173 173 THR N N 173 123.553 115.824 7.729 1 1 1365 . 13 1 1 A 174 174 TYR H H 174 9.367 9.610 -0.243 1 1 1366 . 13 1 1 A 174 174 TYR HA H 174 4.660 5.191 -0.531 1 1 1373 . 13 1 1 A 174 174 TYR CB C 174 41.267 40.580 0.687 1 1 1374 . 13 1 1 A 174 174 TYR N N 174 129.583 126.442 3.141 1 1 1375 . 13 1 1 A 175 175 THR H H 175 8.529 9.036 -0.507 1 1 1376 . 13 1 1 A 175 175 THR HA H 175 5.388 4.939 0.449 1 1 1381 . 13 1 1 A 175 175 THR CA C 175 58.216 61.423 -3.207 1 1 1382 . 13 1 1 A 175 175 THR CB C 175 68.575 70.667 -2.092 1 1 1384 . 13 1 1 A 175 175 THR N N 175 125.967 115.255 10.712 1 1 1385 . 13 1 1 A 176 176 ILE H H 176 9.139 8.562 0.577 1 1 1386 . 13 1 1 A 176 176 ILE HA H 176 4.382 4.956 -0.574 1 1 1395 . 13 1 1 A 176 176 ILE CA C 176 58.006 58.754 -0.748 1 1 1396 . 13 1 1 A 176 176 ILE CB C 176 38.881 41.836 -2.955 1 1 1400 . 13 1 1 A 176 176 ILE N N 176 123.715 120.983 2.732 1 1 1401 . 13 1 1 A 177 177 ASP H H 177 8.501 9.558 -1.057 1 1 1402 . 13 1 1 A 177 177 ASP HA H 177 5.011 5.327 -0.316 1 1 1405 . 13 1 1 A 177 177 ASP CA C 177 49.089 51.946 -2.857 1 1 1406 . 13 1 1 A 177 177 ASP CB C 177 39.282 44.018 -4.736 1 1 1407 . 13 1 1 A 177 177 ASP N N 177 125.978 122.225 3.753 1 1 1408 . 13 1 1 A 178 178 PHE H H 178 8.913 8.351 0.562 1 1 1409 . 13 1 1 A 178 178 PHE HA H 178 3.993 3.556 0.437 1 1 1414 . 13 1 1 A 178 178 PHE CB C 178 34.588 39.568 -4.980 1 1 1415 . 13 1 1 A 178 178 PHE N N 178 123.522 124.431 -0.909 1 1 1416 . 13 1 1 A 179 179 ALA H H 179 8.487 8.960 -0.473 1 1 1417 . 13 1 1 A 179 179 ALA HA H 179 4.528 3.950 0.578 1 1 1421 . 13 1 1 A 179 179 ALA CA C 179 52.584 54.492 -1.908 1 1 1422 . 13 1 1 A 179 179 ALA CB C 179 15.666 18.668 -3.002 1 1 1423 . 13 1 1 A 179 179 ALA N N 179 124.061 122.595 1.466 1 1 1424 . 13 1 1 A 180 180 ALA H H 180 7.162 7.731 -0.569 1 1 1425 . 13 1 1 A 180 180 ALA HA H 180 4.313 4.175 0.138 1 1 1429 . 13 1 1 A 180 180 ALA CA C 180 49.006 54.718 -5.712 1 1 1430 . 13 1 1 A 180 180 ALA CB C 180 16.933 19.240 -2.307 1 1 1431 . 13 1 1 A 180 180 ALA N N 180 119.710 120.648 -0.938 1 1 1432 . 13 1 1 A 181 181 LYS H H 181 8.092 7.561 0.531 1 1 1433 . 13 1 1 A 181 181 LYS HA H 181 3.457 4.620 -1.163 1 1 1440 . 13 1 1 A 181 181 LYS CA C 181 54.783 55.573 -0.790 1 1 1441 . 13 1 1 A 181 181 LYS CB C 181 27.088 32.833 -5.745 1 1 1444 . 13 1 1 A 181 181 LYS N N 181 114.996 111.742 3.254 1 1 1445 . 13 1 1 A 182 182 GLN H H 182 7.532 7.336 0.196 1 1 1446 . 13 1 1 A 182 182 GLN HA H 182 5.304 5.042 0.262 1 1 1453 . 13 1 1 A 182 182 GLN CA C 182 51.473 54.706 -3.233 1 1 1454 . 13 1 1 A 182 182 GLN CB C 182 31.585 32.481 -0.896 1 1 1455 . 13 1 1 A 182 182 GLN N N 182 115.064 119.922 -4.858 1 1 1457 . 13 1 1 A 183 183 GLY H H 183 9.026 8.269 0.757 1 1 1458 . 13 1 1 A 183 183 GLY HA2 H 183 5.376 4.201 1.175 1 1 1459 . 13 1 1 A 183 183 GLY HA3 H 183 3.567 4.331 -0.764 1 1 1460 . 13 1 1 A 183 183 GLY CA C 183 42.361 45.569 -3.208 1 1 1461 . 13 1 1 A 183 183 GLY N N 183 111.505 110.469 1.036 1 1 1462 . 13 1 1 A 184 184 HIS H H 184 7.508 7.990 -0.482 1 1 1463 . 13 1 1 A 184 184 HIS HA H 184 4.304 4.703 -0.399 1 1 1467 . 13 1 1 A 184 184 HIS CA C 184 52.793 53.069 -0.276 1 1 1468 . 13 1 1 A 184 184 HIS CB C 184 27.906 32.957 -5.051 1 1 1469 . 13 1 1 A 184 184 HIS N N 184 111.297 117.875 -6.578 1 1 1470 . 13 1 1 A 185 185 GLY H H 185 9.160 7.839 1.321 1 1 1471 . 13 1 1 A 185 185 GLY HA2 H 185 4.464 3.587 0.877 1 1 1472 . 13 1 1 A 185 185 GLY HA3 H 185 4.117 3.815 0.302 1 1 1473 . 13 1 1 A 185 185 GLY CA C 185 44.212 45.762 -1.550 1 1 1474 . 13 1 1 A 185 185 GLY N N 185 107.398 105.318 2.080 1 1 1475 . 13 1 1 A 186 186 LYS H H 186 9.170 8.278 0.892 1 1 1476 . 13 1 1 A 186 186 LYS HA H 186 4.925 4.993 -0.068 1 1 1481 . 13 1 1 A 186 186 LYS CB C 186 33.642 35.499 -1.857 1 1 1482 . 13 1 1 A 186 186 LYS N N 186 122.690 120.289 2.401 1 1 1483 . 13 1 1 A 187 187 ILE H H 187 8.444 8.610 -0.166 1 1 1484 . 13 1 1 A 187 187 ILE HA H 187 4.626 4.761 -0.135 1 1 1487 . 13 1 1 A 187 187 ILE N N 187 124.320 122.349 1.971 1 1 1488 . 13 1 1 A 188 188 GLU H H 188 8.590 8.222 0.368 1 1 1489 . 13 1 1 A 188 188 GLU HA H 188 4.650 4.866 -0.216 1 1 1495 . 13 1 1 A 188 188 GLU N N 188 122.575 126.807 -4.232 1 1 1496 . 13 1 1 A 189 189 HIS H H 189 8.726 8.001 0.725 1 1 1497 . 13 1 1 A 189 189 HIS HA H 189 4.055 4.133 -0.078 1 1 1501 . 13 1 1 A 189 189 HIS CA C 189 54.623 59.460 -4.837 1 1 1502 . 13 1 1 A 189 189 HIS CB C 189 24.997 29.848 -4.851 1 1 1503 . 13 1 1 A 189 189 HIS N N 189 111.381 124.223 -12.842 1 1 1504 . 13 1 1 A 190 190 LEU H H 190 9.715 7.765 1.950 1 1 1505 . 13 1 1 A 190 190 LEU HA H 190 4.379 4.307 0.072 1 1 1515 . 13 1 1 A 190 190 LEU N N 190 124.648 116.980 7.668 1 1 1516 . 13 1 1 A 191 191 LYS H H 191 10.099 8.036 2.063 1 1 1517 . 13 1 1 A 191 191 LYS HA H 191 3.736 4.524 -0.788 1 1 1524 . 13 1 1 A 191 191 LYS CA C 191 55.815 56.771 -0.956 1 1 1525 . 13 1 1 A 191 191 LYS CB C 191 30.201 35.353 -5.152 1 1 1527 . 13 1 1 A 191 191 LYS N N 191 123.618 120.643 2.975 1 1 1528 . 13 1 1 A 192 192 SER H H 192 6.991 7.589 -0.598 1 1 1529 . 13 1 1 A 192 192 SER HA H 192 4.743 4.417 0.326 1 1 1532 . 13 1 1 A 192 192 SER CA C 192 51.974 56.625 -4.651 1 1 1533 . 13 1 1 A 192 192 SER CB C 192 60.005 63.757 -3.752 1 1 1534 . 13 1 1 A 192 192 SER N N 192 115.071 117.002 -1.931 1 1 1535 . 13 1 1 A 193 193 PRO CB C 193 29.607 30.199 -0.592 1 1 1537 . 13 1 1 A 194 194 GLU H H 194 8.213 8.885 -0.672 1 1 1538 . 13 1 1 A 194 194 GLU HA H 194 3.063 5.190 -2.127 1 1 1543 . 13 1 1 A 194 194 GLU CA C 194 54.185 57.212 -3.027 1 1 1545 . 13 1 1 A 194 194 GLU N N 194 114.055 120.871 -6.816 1 1 1546 . 13 1 1 A 195 195 LEU H H 195 7.082 7.622 -0.540 1 1 1547 . 13 1 1 A 195 195 LEU HA H 195 4.027 4.306 -0.279 1 1 1557 . 13 1 1 A 195 195 LEU CA C 195 51.361 54.007 -2.646 1 1 1558 . 13 1 1 A 195 195 LEU CB C 195 38.950 41.297 -2.347 1 1 1561 . 13 1 1 A 195 195 LEU N N 195 113.898 119.010 -5.112 1 1 1562 . 13 1 1 A 196 196 ASN H H 196 7.060 7.189 -0.129 1 1 1563 . 13 1 1 A 196 196 ASN HA H 196 4.638 4.927 -0.289 1 1 1567 . 13 1 1 A 196 196 ASN N N 196 119.196 119.044 0.152 1 1 1568 . 13 1 1 A 197 197 VAL H H 197 7.244 8.651 -1.407 1 1 1569 . 13 1 1 A 197 197 VAL HA H 197 4.540 4.312 0.228 1 1 1577 . 13 1 1 A 197 197 VAL CA C 197 57.176 61.303 -4.127 1 1 1578 . 13 1 1 A 197 197 VAL N N 197 113.621 124.646 -11.025 1 1 1579 . 13 1 1 A 198 198 ASP H H 198 8.881 9.343 -0.462 1 1 1580 . 13 1 1 A 198 198 ASP HA H 198 4.894 4.823 0.071 1 1 1581 . 13 1 1 A 198 198 ASP N N 198 118.852 125.106 -6.254 1 1 1582 . 13 1 1 A 199 199 LEU H H 199 8.498 8.402 0.096 1 1 1583 . 13 1 1 A 199 199 LEU HA H 199 4.317 4.447 -0.130 1 1 1591 . 13 1 1 A 199 199 LEU N N 199 124.078 126.757 -2.679 1 1 1592 . 13 1 1 A 200 200 ALA H H 200 8.386 8.277 0.109 1 1 1593 . 13 1 1 A 200 200 ALA HA H 200 4.295 5.107 -0.812 1 1 1597 . 13 1 1 A 200 200 ALA CA C 200 50.044 50.733 -0.689 1 1 1598 . 13 1 1 A 200 200 ALA CB C 200 17.985 21.865 -3.880 1 1 1599 . 13 1 1 A 200 200 ALA N N 200 127.315 126.378 0.937 1 1 1600 . 13 1 1 A 201 201 VAL H H 201 8.007 8.836 -0.829 1 1 1601 . 13 1 1 A 201 201 VAL HA H 201 4.577 4.648 -0.071 1 1 1609 . 13 1 1 A 201 201 VAL CA C 201 60.004 60.314 -0.310 1 1 1610 . 13 1 1 A 201 201 VAL CB C 201 28.863 35.883 -7.020 1 1 1611 . 13 1 1 A 201 201 VAL N N 201 119.409 121.807 -2.398 1 1 1612 . 13 1 1 A 202 202 ALA H H 202 8.789 9.135 -0.346 1 1 1613 . 13 1 1 A 202 202 ALA HA H 202 4.630 5.376 -0.746 1 1 1617 . 13 1 1 A 202 202 ALA CA C 202 48.200 50.010 -1.810 1 1 1618 . 13 1 1 A 202 202 ALA N N 202 131.745 126.719 5.026 1 1 1619 . 13 1 1 A 203 203 TYR H H 203 8.522 8.949 -0.427 1 1 1620 . 13 1 1 A 203 203 TYR HA H 203 5.391 5.338 0.053 1 1 1627 . 13 1 1 A 203 203 TYR CA C 203 54.648 56.768 -2.120 1 1 1628 . 13 1 1 A 203 203 TYR CB C 203 37.315 38.922 -1.607 1 1 1629 . 13 1 1 A 203 203 TYR N N 203 117.786 124.867 -7.081 1 1 1630 . 13 1 1 A 204 204 ILE H H 204 8.209 8.298 -0.089 1 1 1631 . 13 1 1 A 204 204 ILE HA H 204 4.393 4.272 0.121 1 1 1641 . 13 1 1 A 204 204 ILE CB C 204 36.807 38.118 -1.311 1 1 1644 . 13 1 1 A 204 204 ILE N N 204 120.602 128.721 -8.119 1 1 1645 . 13 1 1 A 205 205 LYS H H 205 9.340 8.601 0.739 1 1 1646 . 13 1 1 A 205 205 LYS HA H 205 4.756 3.950 0.806 1 1 1651 . 13 1 1 A 205 205 LYS CA C 205 50.844 60.315 -9.471 1 1 1652 . 13 1 1 A 205 205 LYS N N 205 127.960 123.582 4.378 1 1 1653 . 13 1 1 A 207 207 ASP H H 207 8.436 8.612 -0.176 1 1 1654 . 13 1 1 A 207 207 ASP HA H 207 4.692 4.755 -0.063 1 1 1657 . 13 1 1 A 207 207 ASP CA C 207 48.789 54.075 -5.286 1 1 1658 . 13 1 1 A 207 207 ASP CB C 207 38.377 41.006 -2.629 1 1 1659 . 13 1 1 A 207 207 ASP N N 207 123.098 124.763 -1.665 1 1 1660 . 13 1 1 A 208 208 GLU H H 208 8.880 8.569 0.311 1 1 1661 . 13 1 1 A 208 208 GLU HA H 208 3.994 4.151 -0.157 1 1 1666 . 13 1 1 A 208 208 GLU CA C 208 56.123 58.997 -2.874 1 1 1667 . 13 1 1 A 208 208 GLU CB C 208 25.794 30.237 -4.443 1 1 1669 . 13 1 1 A 208 208 GLU N N 208 119.042 121.573 -2.531 1 1 1670 . 13 1 1 A 209 209 LYS H H 209 7.681 7.675 0.006 1 1 1671 . 13 1 1 A 209 209 LYS HA H 209 4.141 4.344 -0.203 1 1 1680 . 13 1 1 A 209 209 LYS N N 209 119.252 114.686 4.566 1 1 1681 . 13 1 1 A 210 210 HIS H H 210 8.177 5.977 2.200 1 1 1682 . 13 1 1 A 210 210 HIS HA H 210 3.825 4.643 -0.818 1 1 1687 . 13 1 1 A 210 210 HIS CA C 210 54.205 54.049 0.156 1 1 1688 . 13 1 1 A 210 210 HIS CB C 210 23.439 29.592 -6.153 1 1 1689 . 13 1 1 A 210 210 HIS N N 210 112.758 112.593 0.165 1 1 1690 . 13 1 1 A 211 211 HIS H H 211 8.758 7.210 1.548 1 1 1691 . 13 1 1 A 211 211 HIS HA H 211 5.041 5.814 -0.773 1 1 1695 . 13 1 1 A 211 211 HIS CA C 211 50.450 55.197 -4.747 1 1 1696 . 13 1 1 A 211 211 HIS CB C 211 25.703 33.325 -7.622 1 1 1697 . 13 1 1 A 211 211 HIS N N 211 119.552 118.881 0.671 1 1 1698 . 13 1 1 A 212 212 ALA H H 212 8.556 8.374 0.182 1 1 1699 . 13 1 1 A 212 212 ALA HA H 212 4.712 4.617 0.095 1 1 1703 . 13 1 1 A 212 212 ALA CA C 212 49.886 51.520 -1.634 1 1 1704 . 13 1 1 A 212 212 ALA CB C 212 18.860 20.281 -1.421 1 1 1705 . 13 1 1 A 212 212 ALA N N 212 123.780 123.230 0.550 1 1 1706 . 13 1 1 A 213 213 VAL H H 213 9.338 7.672 1.666 1 1 1707 . 13 1 1 A 213 213 VAL HA H 213 5.074 4.943 0.131 1 1 1715 . 13 1 1 A 213 213 VAL CA C 213 57.486 60.478 -2.992 1 1 1716 . 13 1 1 A 213 213 VAL CB C 213 33.938 35.610 -1.672 1 1 1717 . 13 1 1 A 213 213 VAL N N 213 124.742 119.382 5.360 1 1 1718 . 13 1 1 A 214 214 ILE H H 214 8.962 8.890 0.072 1 1 1719 . 13 1 1 A 214 214 ILE HA H 214 4.434 4.980 -0.546 1 1 1726 . 13 1 1 A 214 214 ILE N N 214 122.881 127.255 -4.374 1 1 1727 . 13 1 1 A 215 215 SER H H 215 8.558 8.519 0.039 1 1 1728 . 13 1 1 A 215 215 SER HA H 215 5.001 5.648 -0.647 1 1 1731 . 13 1 1 A 215 215 SER CA C 215 53.230 57.314 -4.084 1 1 1732 . 13 1 1 A 215 215 SER CB C 215 62.077 66.579 -4.502 1 1 1733 . 13 1 1 A 215 215 SER N N 215 122.891 122.388 0.503 1 1 1734 . 13 1 1 A 216 216 GLY H H 216 7.282 8.915 -1.633 1 1 1735 . 13 1 1 A 216 216 GLY HA2 H 216 4.515 4.365 0.150 1 1 1736 . 13 1 1 A 216 216 GLY HA3 H 216 3.473 4.375 -0.902 1 1 1737 . 13 1 1 A 216 216 GLY CA C 216 42.816 46.237 -3.421 1 1 1738 . 13 1 1 A 216 216 GLY N N 216 110.899 110.920 -0.021 1 1 1739 . 13 1 1 A 217 217 SER H H 217 8.673 9.067 -0.394 1 1 1740 . 13 1 1 A 217 217 SER HA H 217 5.127 5.546 -0.419 1 1 1743 . 13 1 1 A 217 217 SER CA C 217 56.266 56.389 -0.123 1 1 1744 . 13 1 1 A 217 217 SER N N 217 117.164 116.976 0.188 1 1 1745 . 13 1 1 A 218 218 VAL H H 218 7.451 9.037 -1.586 1 1 1746 . 13 1 1 A 218 218 VAL HA H 218 5.128 4.680 0.448 1 1 1754 . 13 1 1 A 218 218 VAL CA C 218 56.637 62.091 -5.454 1 1 1755 . 13 1 1 A 218 218 VAL N N 218 117.826 124.484 -6.658 1 1 1756 . 13 1 1 A 219 219 LEU H H 219 9.022 8.597 0.425 1 1 1757 . 13 1 1 A 219 219 LEU HA H 219 5.387 5.054 0.333 1 1 1767 . 13 1 1 A 219 219 LEU CA C 219 50.450 53.700 -3.250 1 1 1768 . 13 1 1 A 219 219 LEU N N 219 124.820 127.129 -2.309 1 1 1769 . 13 1 1 A 220 220 TYR H H 220 8.816 9.194 -0.378 1 1 1770 . 13 1 1 A 220 220 TYR HA H 220 4.834 4.960 -0.126 1 1 1777 . 13 1 1 A 220 220 TYR N N 220 121.249 126.209 -4.960 1 1 1778 . 13 1 1 A 221 221 ASN H H 221 9.191 8.588 0.603 1 1 1779 . 13 1 1 A 221 221 ASN HA H 221 4.048 4.441 -0.393 1 1 1784 . 13 1 1 A 221 221 ASN CA C 221 51.647 54.749 -3.102 1 1 1785 . 13 1 1 A 221 221 ASN CB C 221 36.640 38.372 -1.732 1 1 1786 . 13 1 1 A 221 221 ASN N N 221 129.865 124.091 5.774 1 1 1788 . 13 1 1 A 222 222 GLN H H 222 8.468 6.399 2.069 1 1 1789 . 13 1 1 A 222 222 GLN HA H 222 3.671 3.902 -0.231 1 1 1794 . 13 1 1 A 222 222 GLN CA C 222 55.075 57.812 -2.737 1 1 1795 . 13 1 1 A 222 222 GLN CB C 222 24.663 29.408 -4.745 1 1 1797 . 13 1 1 A 222 222 GLN N N 222 108.367 118.546 -10.179 1 1 1798 . 13 1 1 A 223 223 ASP H H 223 7.797 7.818 -0.021 1 1 1799 . 13 1 1 A 223 223 ASP HA H 223 4.986 4.837 0.149 1 1 1802 . 13 1 1 A 223 223 ASP N N 223 120.842 118.612 2.230 1 1 1803 . 13 1 1 A 224 224 GLU H H 224 8.731 7.831 0.900 1 1 1804 . 13 1 1 A 224 224 GLU HA H 224 4.690 4.631 0.059 1 1 1809 . 13 1 1 A 224 224 GLU CA C 224 54.703 56.577 -1.874 1 1 1810 . 13 1 1 A 224 224 GLU CB C 224 26.357 31.276 -4.919 1 1 1812 . 13 1 1 A 224 224 GLU N N 224 124.249 120.242 4.007 1 1 1813 . 13 1 1 A 225 225 LYS H H 225 8.730 8.388 0.342 1 1 1814 . 13 1 1 A 225 225 LYS HA H 225 4.754 4.894 -0.140 1 1 1822 . 13 1 1 A 225 225 LYS N N 225 126.784 124.687 2.097 1 1 1823 . 13 1 1 A 226 226 GLY H H 226 7.683 8.870 -1.187 1 1 1824 . 13 1 1 A 226 226 GLY HA2 H 226 5.567 4.411 1.156 1 1 1825 . 13 1 1 A 226 226 GLY HA3 H 226 3.819 4.432 -0.613 1 1 1826 . 13 1 1 A 226 226 GLY CA C 226 42.264 44.766 -2.502 1 1 1827 . 13 1 1 A 226 226 GLY N N 226 107.140 111.312 -4.172 1 1 1828 . 13 1 1 A 227 227 SER H H 227 8.672 8.752 -0.080 1 1 1829 . 13 1 1 A 227 227 SER HA H 227 5.564 5.422 0.142 1 1 1832 . 13 1 1 A 227 227 SER CA C 227 54.373 56.912 -2.539 1 1 1833 . 13 1 1 A 227 227 SER CB C 227 63.963 66.561 -2.598 1 1 1834 . 13 1 1 A 227 227 SER N N 227 117.767 116.234 1.533 1 1 1835 . 13 1 1 A 228 228 TYR H H 228 9.073 8.658 0.415 1 1 1836 . 13 1 1 A 228 228 TYR HA H 228 5.519 5.117 0.402 1 1 1843 . 13 1 1 A 228 228 TYR N N 228 118.324 124.712 -6.388 1 1 1844 . 13 1 1 A 229 229 SER H H 229 8.929 7.855 1.074 1 1 1845 . 13 1 1 A 229 229 SER HA H 229 5.209 5.261 -0.052 1 1 1848 . 13 1 1 A 229 229 SER CA C 229 54.131 56.589 -2.458 1 1 1849 . 13 1 1 A 229 229 SER N N 229 116.118 122.141 -6.023 1 1 1850 . 13 1 1 A 230 230 LEU H H 230 9.372 8.835 0.537 1 1 1851 . 13 1 1 A 230 230 LEU HA H 230 4.803 4.632 0.171 1 1 1863 . 13 1 1 A 230 230 LEU N N 230 124.803 126.348 -1.545 1 1 1864 . 13 1 1 A 231 231 GLY H H 231 9.080 8.386 0.694 1 1 1865 . 13 1 1 A 231 231 GLY HA2 H 231 4.776 4.271 0.505 1 1 1866 . 13 1 1 A 231 231 GLY HA3 H 231 3.528 4.336 -0.808 1 1 1867 . 13 1 1 A 231 231 GLY CA C 231 41.468 44.682 -3.214 1 1 1868 . 13 1 1 A 231 231 GLY N N 231 109.611 110.881 -1.270 1 1 1869 . 13 1 1 A 232 232 ILE H H 232 6.849 8.808 -1.959 1 1 1870 . 13 1 1 A 232 232 ILE HA H 232 4.742 4.507 0.235 1 1 1878 . 13 1 1 A 232 232 ILE N N 232 120.566 124.411 -3.845 1 1 1879 . 13 1 1 A 233 233 PHE H H 233 9.569 7.790 1.779 1 1 1880 . 13 1 1 A 233 233 PHE HA H 233 4.979 5.300 -0.321 1 1 1885 . 13 1 1 A 233 233 PHE N N 233 129.256 127.495 1.761 1 1 1886 . 13 1 1 A 234 234 GLY H H 234 8.734 8.526 0.208 1 1 1887 . 13 1 1 A 234 234 GLY HA2 H 234 4.488 4.273 0.215 1 1 1888 . 13 1 1 A 234 234 GLY HA3 H 234 3.327 4.296 -0.969 1 1 1889 . 13 1 1 A 234 234 GLY CA C 234 40.377 45.828 -5.451 1 1 1890 . 13 1 1 A 234 234 GLY N N 234 105.294 111.924 -6.630 1 1 1891 . 13 1 1 A 235 235 GLU H H 235 9.198 8.589 0.609 1 1 1892 . 13 1 1 A 235 235 GLU HA H 235 4.111 4.432 -0.321 1 1 1897 . 13 1 1 A 235 235 GLU CA C 235 56.466 58.816 -2.350 1 1 1898 . 13 1 1 A 235 235 GLU CB C 235 26.256 29.090 -2.834 1 1 1900 . 13 1 1 A 235 235 GLU N N 235 125.813 120.303 5.510 1 1 1901 . 13 1 1 A 236 236 LYS H H 236 8.147 7.737 0.410 1 1 1902 . 13 1 1 A 236 236 LYS HA H 236 4.373 4.411 -0.038 1 1 1905 . 13 1 1 A 236 236 LYS N N 236 117.810 119.763 -1.953 1 1 1906 . 13 1 1 A 237 237 ALA H H 237 7.685 7.615 0.070 1 1 1907 . 13 1 1 A 237 237 ALA HA H 237 3.902 4.549 -0.647 1 1 1911 . 13 1 1 A 237 237 ALA CA C 237 49.762 51.733 -1.971 1 1 1912 . 13 1 1 A 237 237 ALA CB C 237 14.720 19.168 -4.448 1 1 1913 . 13 1 1 A 237 237 ALA N N 237 118.704 122.728 -4.024 1 1 1914 . 13 1 1 A 238 238 GLN H H 238 9.312 8.519 0.793 1 1 1915 . 13 1 1 A 238 238 GLN HA H 238 4.049 4.980 -0.931 1 1 1920 . 13 1 1 A 238 238 GLN N N 238 118.059 122.018 -3.959 1 1 1921 . 13 1 1 A 239 239 GLU H H 239 8.785 10.080 -1.295 1 1 1922 . 13 1 1 A 239 239 GLU HA H 239 5.531 4.878 0.653 1 1 1927 . 13 1 1 A 239 239 GLU N N 239 116.914 117.923 -1.009 1 1 1928 . 13 1 1 A 240 240 VAL H H 240 8.501 9.374 -0.873 1 1 1929 . 13 1 1 A 240 240 VAL HA H 240 5.655 4.217 1.438 1 1 1937 . 13 1 1 A 240 240 VAL CA C 240 55.582 60.665 -5.083 1 1 1940 . 13 1 1 A 240 240 VAL N N 240 110.588 120.089 -9.501 1 1 1941 . 13 1 1 A 241 241 ALA H H 241 8.463 8.140 0.323 1 1 1942 . 13 1 1 A 241 241 ALA HA H 241 5.014 5.215 -0.201 1 1 1946 . 13 1 1 A 241 241 ALA CA C 241 49.361 51.259 -1.898 1 1 1947 . 13 1 1 A 241 241 ALA CB C 241 18.196 22.849 -4.653 1 1 1948 . 13 1 1 A 241 241 ALA N N 241 121.125 127.801 -6.676 1 1 1949 . 13 1 1 A 242 242 GLY H H 242 9.421 8.348 1.073 1 1 1950 . 13 1 1 A 242 242 GLY HA2 H 242 5.161 4.225 0.936 1 1 1951 . 13 1 1 A 242 242 GLY HA3 H 242 4.076 4.322 -0.246 1 1 1952 . 13 1 1 A 242 242 GLY N N 242 112.036 108.606 3.430 1 1 1953 . 13 1 1 A 243 243 SER H H 243 8.929 8.000 0.929 1 1 1954 . 13 1 1 A 243 243 SER HA H 243 5.331 5.110 0.221 1 1 1957 . 13 1 1 A 243 243 SER N N 243 116.113 115.319 0.794 1 1 1958 . 13 1 1 A 244 244 ALA H H 244 9.218 8.743 0.475 1 1 1959 . 13 1 1 A 244 244 ALA HA H 244 5.221 4.784 0.437 1 1 1963 . 13 1 1 A 244 244 ALA CA C 244 47.883 51.160 -3.277 1 1 1964 . 13 1 1 A 244 244 ALA N N 244 120.635 121.504 -0.869 1 1 1965 . 13 1 1 A 245 245 GLU H H 245 9.194 8.399 0.795 1 1 1966 . 13 1 1 A 245 245 GLU HA H 245 4.869 5.240 -0.371 1 1 1971 . 13 1 1 A 245 245 GLU N N 245 123.487 117.601 5.886 1 1 1972 . 13 1 1 A 246 246 VAL H H 246 8.531 8.649 -0.118 1 1 1973 . 13 1 1 A 246 246 VAL HA H 246 4.518 4.953 -0.435 1 1 1981 . 13 1 1 A 246 246 VAL CA C 246 58.286 59.590 -1.304 1 1 1982 . 13 1 1 A 246 246 VAL N N 246 123.347 120.562 2.785 1 1 1983 . 13 1 1 A 247 247 GLU H H 247 9.132 8.472 0.660 1 1 1984 . 13 1 1 A 247 247 GLU HA H 247 4.368 4.903 -0.535 1 1 1989 . 13 1 1 A 247 247 GLU CB C 247 26.744 32.983 -6.239 1 1 1990 . 13 1 1 A 247 247 GLU N N 247 129.243 125.663 3.580 1 1 1991 . 13 1 1 A 248 248 THR H H 248 7.827 8.478 -0.651 1 1 1992 . 13 1 1 A 248 248 THR HA H 248 4.749 4.843 -0.094 1 1 1997 . 13 1 1 A 248 248 THR CA C 248 56.859 60.740 -3.881 1 1 1998 . 13 1 1 A 248 248 THR CB C 248 69.171 70.844 -1.673 1 1 2000 . 13 1 1 A 248 248 THR N N 248 114.228 117.811 -3.583 1 1 2001 . 13 1 1 A 249 249 ALA H H 249 9.148 8.675 0.473 1 1 2002 . 13 1 1 A 249 249 ALA HA H 249 4.174 4.185 -0.011 1 1 2006 . 13 1 1 A 249 249 ALA CA C 249 51.970 53.855 -1.885 1 1 2007 . 13 1 1 A 249 249 ALA CB C 249 15.797 18.488 -2.691 1 1 2008 . 13 1 1 A 249 249 ALA N N 249 123.341 124.425 -1.084 1 1 2009 . 13 1 1 A 250 250 ASN H H 250 7.974 7.652 0.322 1 1 2010 . 13 1 1 A 250 250 ASN HA H 250 4.953 4.866 0.087 1 1 2015 . 13 1 1 A 250 250 ASN CA C 250 49.198 52.662 -3.464 1 1 2016 . 13 1 1 A 250 250 ASN CB C 250 35.976 38.741 -2.765 1 1 2017 . 13 1 1 A 250 250 ASN N N 250 113.358 115.239 -1.881 1 1 2019 . 13 1 1 A 251 251 GLY H H 251 7.510 7.891 -0.381 1 1 2020 . 13 1 1 A 251 251 GLY HA2 H 251 4.492 4.101 0.391 1 1 2021 . 13 1 1 A 251 251 GLY HA3 H 251 3.853 4.109 -0.256 1 1 2022 . 13 1 1 A 251 251 GLY CA C 251 41.435 45.877 -4.442 1 1 2023 . 13 1 1 A 251 251 GLY N N 251 108.692 108.358 0.334 1 1 2024 . 13 1 1 A 252 252 ILE H H 252 8.465 8.181 0.284 1 1 2025 . 13 1 1 A 252 252 ILE HA H 252 4.521 4.289 0.232 1 1 2035 . 13 1 1 A 252 252 ILE CB C 252 35.653 42.295 -6.642 1 1 2039 . 13 1 1 A 252 252 ILE N N 252 122.043 119.947 2.096 1 1 2040 . 13 1 1 A 253 253 HIS H H 253 9.311 8.286 1.025 1 1 2041 . 13 1 1 A 253 253 HIS HA H 253 4.861 4.683 0.178 1 1 2046 . 13 1 1 A 253 253 HIS N N 253 126.617 121.636 4.981 1 1 2047 . 13 1 1 A 254 254 HIS H H 254 8.820 8.009 0.811 1 1 2048 . 13 1 1 A 254 254 HIS HA H 254 5.305 5.637 -0.332 1 1 2051 . 13 1 1 A 254 254 HIS CA C 254 52.781 53.380 -0.599 1 1 2052 . 13 1 1 A 254 254 HIS N N 254 122.665 116.320 6.345 1 1 2053 . 13 1 1 A 255 255 ILE H H 255 9.047 9.044 0.003 1 1 2054 . 13 1 1 A 255 255 ILE HA H 255 4.651 4.428 0.223 1 1 2061 . 13 1 1 A 255 255 ILE N N 255 123.958 117.795 6.163 1 1 2062 . 13 1 1 A 256 256 GLY H H 256 9.339 8.206 1.133 1 1 2063 . 13 1 1 A 256 256 GLY HA2 H 256 3.816 3.884 -0.068 1 1 2064 . 13 1 1 A 256 256 GLY HA3 H 256 2.267 4.047 -1.780 1 1 2065 . 13 1 1 A 256 256 GLY N N 256 115.022 111.088 3.934 1 1 2066 . 13 1 1 A 257 257 LEU H H 257 7.890 9.479 -1.589 1 1 2067 . 13 1 1 A 257 257 LEU HA H 257 4.853 5.055 -0.202 1 1 2077 . 13 1 1 A 257 257 LEU N N 257 121.441 122.960 -1.519 1 1 2078 . 13 1 1 A 258 258 ALA H H 258 7.982 9.130 -1.148 1 1 2079 . 13 1 1 A 258 258 ALA HA H 258 4.668 5.100 -0.432 1 1 2083 . 13 1 1 A 258 258 ALA CA C 258 49.678 51.765 -2.087 1 1 2084 . 13 1 1 A 258 258 ALA CB C 258 19.561 20.935 -1.374 1 1 2085 . 13 1 1 A 258 258 ALA N N 258 123.234 123.100 0.134 1 1 2086 . 13 1 1 A 259 259 ALA H H 259 9.117 9.634 -0.517 1 1 2087 . 13 1 1 A 259 259 ALA HA H 259 4.790 4.685 0.105 1 1 2091 . 13 1 1 A 259 259 ALA N N 259 123.901 124.844 -0.943 1 1 2092 . 13 1 1 A 260 260 LYS H H 260 8.452 8.093 0.359 1 1 2093 . 13 1 1 A 260 260 LYS HA H 260 5.914 4.852 1.062 1 1 2098 . 13 1 1 A 260 260 LYS CA C 260 51.818 54.120 -2.302 1 1 2099 . 13 1 1 A 260 260 LYS N N 260 116.464 116.653 -0.189 1 1 1 . 14 1 1 A 9 9 SER H H 9 8.293 8.288 0.005 1 1 2 . 14 1 1 A 9 9 SER HA H 9 4.432 5.083 -0.651 1 1 3 . 14 1 1 A 9 9 SER N N 9 116.407 117.175 -0.768 1 1 4 . 14 1 1 A 10 10 GLY H H 10 8.472 8.358 0.114 1 1 5 . 14 1 1 A 10 10 GLY N N 10 111.611 107.783 3.828 1 1 6 . 14 1 1 A 14 14 VAL H H 14 8.009 7.517 0.492 1 1 7 . 14 1 1 A 14 14 VAL HA H 14 4.128 4.128 0.000 1 1 15 . 14 1 1 A 14 14 VAL CA C 14 59.473 61.858 -2.385 1 1 16 . 14 1 1 A 14 14 VAL CB C 14 30.127 32.973 -2.846 1 1 17 . 14 1 1 A 14 14 VAL N N 14 119.846 118.206 1.640 1 1 18 . 14 1 1 A 15 15 THR H H 15 8.152 8.653 -0.501 1 1 19 . 14 1 1 A 15 15 THR HA H 15 4.346 4.426 -0.080 1 1 24 . 14 1 1 A 15 15 THR N N 15 118.509 118.046 0.463 1 1 25 . 14 1 1 A 16 16 ALA H H 16 8.207 8.603 -0.396 1 1 26 . 14 1 1 A 16 16 ALA HA H 16 4.319 4.301 0.018 1 1 30 . 14 1 1 A 16 16 ALA CA C 16 49.835 53.324 -3.489 1 1 31 . 14 1 1 A 16 16 ALA CB C 16 16.714 19.147 -2.433 1 1 32 . 14 1 1 A 16 16 ALA N N 16 126.935 124.824 2.111 1 1 33 . 14 1 1 A 17 17 ASP H H 17 8.269 7.892 0.377 1 1 34 . 14 1 1 A 17 17 ASP HA H 17 4.581 4.922 -0.341 1 1 37 . 14 1 1 A 17 17 ASP CA C 17 51.643 53.108 -1.465 1 1 38 . 14 1 1 A 17 17 ASP CB C 17 38.257 41.669 -3.412 1 1 39 . 14 1 1 A 17 17 ASP N N 17 120.379 118.216 2.163 1 1 40 . 14 1 1 A 18 18 ILE H H 18 7.979 7.902 0.077 1 1 41 . 14 1 1 A 18 18 ILE HA H 18 4.178 4.064 0.114 1 1 48 . 14 1 1 A 18 18 ILE CA C 18 58.737 63.432 -4.695 1 1 49 . 14 1 1 A 18 18 ILE CB C 18 36.077 38.118 -2.041 1 1 53 . 14 1 1 A 18 18 ILE N N 18 121.171 120.957 0.214 1 1 54 . 14 1 1 A 19 19 GLY H H 19 8.410 7.892 0.518 1 1 55 . 14 1 1 A 19 19 GLY HA2 H 19 4.023 3.957 0.066 1 1 56 . 14 1 1 A 19 19 GLY HA3 H 19 4.023 3.958 0.065 1 1 57 . 14 1 1 A 19 19 GLY N N 19 112.246 108.813 3.433 1 1 58 . 14 1 1 A 20 20 THR H H 20 8.005 8.332 -0.327 1 1 59 . 14 1 1 A 20 20 THR HA H 20 4.463 4.135 0.328 1 1 64 . 14 1 1 A 20 20 THR CB C 20 66.723 68.663 -1.940 1 1 66 . 14 1 1 A 20 20 THR N N 20 112.239 115.538 -3.299 1 1 67 . 14 1 1 A 21 21 GLY H H 21 8.500 8.360 0.140 1 1 68 . 14 1 1 A 21 21 GLY HA2 H 21 4.099 3.792 0.307 1 1 69 . 14 1 1 A 21 21 GLY HA3 H 21 3.872 3.795 0.077 1 1 70 . 14 1 1 A 21 21 GLY N N 21 111.048 112.255 -1.207 1 1 71 . 14 1 1 A 22 22 LEU H H 22 7.427 7.517 -0.090 1 1 72 . 14 1 1 A 22 22 LEU HA H 22 3.884 4.042 -0.158 1 1 84 . 14 1 1 A 22 22 LEU N N 22 118.837 120.528 -1.691 1 1 85 . 14 1 1 A 23 23 ALA H H 23 7.896 8.622 -0.726 1 1 86 . 14 1 1 A 23 23 ALA HA H 23 4.023 4.136 -0.113 1 1 90 . 14 1 1 A 23 23 ALA CA C 23 52.584 54.174 -1.590 1 1 91 . 14 1 1 A 23 23 ALA CB C 23 15.470 18.388 -2.918 1 1 92 . 14 1 1 A 23 23 ALA N N 23 119.194 121.568 -2.374 1 1 93 . 14 1 1 A 24 24 ASP H H 24 8.265 8.153 0.112 1 1 94 . 14 1 1 A 24 24 ASP HA H 24 4.337 4.545 -0.208 1 1 97 . 14 1 1 A 24 24 ASP CB C 24 37.029 41.160 -4.131 1 1 98 . 14 1 1 A 24 24 ASP N N 24 119.035 116.444 2.591 1 1 99 . 14 1 1 A 25 25 ALA H H 25 8.211 8.428 -0.217 1 1 100 . 14 1 1 A 25 25 ALA HA H 25 4.064 4.737 -0.673 1 1 104 . 14 1 1 A 25 25 ALA CA C 25 53.278 53.432 -0.154 1 1 105 . 14 1 1 A 25 25 ALA CB C 25 15.760 18.983 -3.223 1 1 106 . 14 1 1 A 25 25 ALA N N 25 122.434 121.160 1.274 1 1 107 . 14 1 1 A 26 26 LEU H H 26 7.334 7.408 -0.074 1 1 108 . 14 1 1 A 26 26 LEU HA H 26 4.351 4.361 -0.010 1 1 117 . 14 1 1 A 26 26 LEU N N 26 114.238 115.032 -0.794 1 1 118 . 14 1 1 A 27 27 THR H H 27 7.708 7.844 -0.136 1 1 119 . 14 1 1 A 27 27 THR HA H 27 4.492 4.581 -0.089 1 1 124 . 14 1 1 A 27 27 THR CA C 27 59.438 62.197 -2.759 1 1 125 . 14 1 1 A 27 27 THR CB C 27 68.796 70.050 -1.254 1 1 127 . 14 1 1 A 27 27 THR N N 27 106.430 111.324 -4.894 1 1 128 . 14 1 1 A 28 28 ALA H H 28 8.906 7.766 1.140 1 1 129 . 14 1 1 A 28 28 ALA HA H 28 4.812 4.580 0.232 1 1 133 . 14 1 1 A 28 28 ALA CB C 28 16.724 19.468 -2.744 1 1 134 . 14 1 1 A 28 28 ALA N N 28 128.420 124.682 3.738 1 1 135 . 14 1 1 A 29 29 PRO CA C 29 59.166 62.217 -3.051 1 1 136 . 14 1 1 A 29 29 PRO CB C 29 29.865 33.042 -3.177 1 1 139 . 14 1 1 A 30 30 LEU H H 30 8.204 8.340 -0.136 1 1 140 . 14 1 1 A 30 30 LEU HA H 30 4.052 4.231 -0.179 1 1 150 . 14 1 1 A 30 30 LEU N N 30 121.970 122.346 -0.376 1 1 151 . 14 1 1 A 31 31 ASP H H 31 8.720 8.902 -0.182 1 1 152 . 14 1 1 A 31 31 ASP HA H 31 4.772 4.927 -0.155 1 1 155 . 14 1 1 A 31 31 ASP CA C 31 50.115 54.082 -3.967 1 1 156 . 14 1 1 A 31 31 ASP N N 31 125.105 126.506 -1.401 1 1 157 . 14 1 1 A 32 32 HIS CA C 32 55.083 58.127 -3.044 1 1 158 . 14 1 1 A 32 32 HIS CB C 32 25.707 29.320 -3.613 1 1 159 . 14 1 1 A 33 33 LYS H H 33 8.589 7.769 0.820 1 1 160 . 14 1 1 A 33 33 LYS HA H 33 4.112 4.246 -0.134 1 1 167 . 14 1 1 A 33 33 LYS CB C 33 29.218 32.226 -3.008 1 1 169 . 14 1 1 A 33 33 LYS N N 33 118.920 117.211 1.709 1 1 170 . 14 1 1 A 34 34 ASP H H 34 7.420 7.078 0.342 1 1 171 . 14 1 1 A 34 34 ASP HA H 34 4.368 4.752 -0.384 1 1 174 . 14 1 1 A 34 34 ASP N N 34 120.940 119.948 0.992 1 1 175 . 14 1 1 A 35 35 LYS H H 35 8.266 8.785 -0.519 1 1 176 . 14 1 1 A 35 35 LYS HA H 35 4.169 4.107 0.062 1 1 183 . 14 1 1 A 35 35 LYS N N 35 121.280 121.638 -0.358 1 1 184 . 14 1 1 A 36 36 GLY H H 36 8.716 7.735 0.981 1 1 185 . 14 1 1 A 36 36 GLY HA2 H 36 3.822 4.051 -0.229 1 1 186 . 14 1 1 A 36 36 GLY HA3 H 36 3.618 4.058 -0.440 1 1 187 . 14 1 1 A 36 36 GLY N N 36 111.002 107.546 3.456 1 1 188 . 14 1 1 A 37 37 LEU H H 37 8.032 8.031 0.001 1 1 189 . 14 1 1 A 37 37 LEU HA H 37 4.406 4.188 0.218 1 1 198 . 14 1 1 A 37 37 LEU N N 37 127.683 123.307 4.376 1 1 199 . 14 1 1 A 38 38 LYS H H 38 9.190 8.905 0.285 1 1 200 . 14 1 1 A 38 38 LYS HA H 38 3.925 4.386 -0.461 1 1 205 . 14 1 1 A 38 38 LYS N N 38 132.634 124.175 8.459 1 1 206 . 14 1 1 A 39 39 SER H H 39 7.161 7.726 -0.565 1 1 207 . 14 1 1 A 39 39 SER HA H 39 5.097 4.769 0.328 1 1 210 . 14 1 1 A 39 39 SER CA C 39 54.451 57.589 -3.138 1 1 211 . 14 1 1 A 39 39 SER N N 39 110.262 109.551 0.711 1 1 212 . 14 1 1 A 40 40 LEU H H 40 8.142 9.569 -1.427 1 1 213 . 14 1 1 A 40 40 LEU HA H 40 4.481 4.959 -0.478 1 1 223 . 14 1 1 A 40 40 LEU N N 40 122.761 121.724 1.037 1 1 224 . 14 1 1 A 41 41 THR H H 41 8.641 8.716 -0.075 1 1 225 . 14 1 1 A 41 41 THR HA H 41 4.141 4.961 -0.820 1 1 230 . 14 1 1 A 41 41 THR CA C 41 60.301 62.118 -1.817 1 1 231 . 14 1 1 A 41 41 THR CB C 41 65.862 69.952 -4.090 1 1 233 . 14 1 1 A 41 41 THR N N 41 124.142 121.151 2.991 1 1 234 . 14 1 1 A 42 42 LEU H H 42 8.586 8.291 0.295 1 1 235 . 14 1 1 A 42 42 LEU HA H 42 4.337 4.585 -0.248 1 1 247 . 14 1 1 A 42 42 LEU N N 42 128.603 125.908 2.695 1 1 248 . 14 1 1 A 43 43 GLU H H 43 8.644 8.026 0.618 1 1 249 . 14 1 1 A 43 43 GLU HA H 43 4.663 4.220 0.443 1 1 253 . 14 1 1 A 43 43 GLU N N 43 124.180 121.123 3.057 1 1 254 . 14 1 1 A 44 44 ASP H H 44 10.243 8.736 1.507 1 1 255 . 14 1 1 A 44 44 ASP HA H 44 4.518 4.726 -0.208 1 1 258 . 14 1 1 A 44 44 ASP CA C 44 52.879 53.428 -0.549 1 1 259 . 14 1 1 A 44 44 ASP CB C 44 37.711 40.097 -2.386 1 1 260 . 14 1 1 A 44 44 ASP N N 44 124.177 124.367 -0.190 1 1 261 . 14 1 1 A 45 45 SER H H 45 8.546 8.262 0.284 1 1 262 . 14 1 1 A 45 45 SER HA H 45 3.850 4.191 -0.341 1 1 265 . 14 1 1 A 45 45 SER CA C 45 59.588 62.352 -2.764 1 1 266 . 14 1 1 A 45 45 SER CB C 45 61.660 62.905 -1.245 1 1 267 . 14 1 1 A 45 45 SER N N 45 116.191 115.343 0.848 1 1 268 . 14 1 1 A 46 46 ILE H H 46 6.902 7.692 -0.790 1 1 269 . 14 1 1 A 46 46 ILE HA H 46 3.874 4.630 -0.756 1 1 279 . 14 1 1 A 46 46 ILE CA C 46 57.605 60.175 -2.570 1 1 280 . 14 1 1 A 46 46 ILE CB C 46 36.694 39.377 -2.683 1 1 283 . 14 1 1 A 46 46 ILE N N 46 116.189 120.864 -4.675 1 1 284 . 14 1 1 A 47 47 SER H H 47 7.804 8.446 -0.642 1 1 285 . 14 1 1 A 47 47 SER HA H 47 4.342 4.723 -0.381 1 1 288 . 14 1 1 A 47 47 SER CA C 47 55.995 56.523 -0.528 1 1 289 . 14 1 1 A 47 47 SER N N 47 118.738 116.176 2.562 1 1 290 . 14 1 1 A 48 48 GLN H H 48 8.522 8.533 -0.011 1 1 291 . 14 1 1 A 48 48 GLN HA H 48 3.939 4.161 -0.222 1 1 296 . 14 1 1 A 48 48 GLN CA C 48 55.111 58.057 -2.946 1 1 298 . 14 1 1 A 48 48 GLN N N 48 119.475 122.051 -2.576 1 1 299 . 14 1 1 A 49 49 ASN H H 49 8.437 8.159 0.278 1 1 300 . 14 1 1 A 49 49 ASN HA H 49 4.693 4.871 -0.178 1 1 305 . 14 1 1 A 49 49 ASN CA C 49 50.839 52.237 -1.398 1 1 306 . 14 1 1 A 49 49 ASN CB C 49 35.767 38.187 -2.420 1 1 307 . 14 1 1 A 49 49 ASN N N 49 117.233 114.538 2.695 1 1 309 . 14 1 1 A 50 50 GLY H H 50 7.952 7.818 0.134 1 1 310 . 14 1 1 A 50 50 GLY HA2 H 50 4.518 4.145 0.373 1 1 311 . 14 1 1 A 50 50 GLY HA3 H 50 4.054 4.147 -0.093 1 1 312 . 14 1 1 A 50 50 GLY CA C 50 41.883 45.417 -3.534 1 1 313 . 14 1 1 A 50 50 GLY N N 50 108.751 108.422 0.329 1 1 314 . 14 1 1 A 51 51 THR H H 51 8.548 8.646 -0.098 1 1 315 . 14 1 1 A 51 51 THR HA H 51 5.012 5.417 -0.405 1 1 320 . 14 1 1 A 51 51 THR CA C 51 57.026 59.864 -2.838 1 1 321 . 14 1 1 A 51 51 THR CB C 51 69.887 70.968 -1.081 1 1 323 . 14 1 1 A 51 51 THR N N 51 108.710 116.622 -7.912 1 1 324 . 14 1 1 A 52 52 LEU H H 52 9.110 8.670 0.440 1 1 325 . 14 1 1 A 52 52 LEU HA H 52 5.183 5.612 -0.429 1 1 333 . 14 1 1 A 52 52 LEU CA C 52 50.822 53.886 -3.064 1 1 335 . 14 1 1 A 52 52 LEU N N 52 124.606 122.624 1.982 1 1 336 . 14 1 1 A 53 53 THR H H 53 9.312 8.900 0.412 1 1 337 . 14 1 1 A 53 53 THR HA H 53 5.288 5.045 0.243 1 1 342 . 14 1 1 A 53 53 THR CA C 53 59.535 61.567 -2.032 1 1 343 . 14 1 1 A 53 53 THR CB C 53 66.838 70.958 -4.120 1 1 345 . 14 1 1 A 53 53 THR N N 53 125.445 118.383 7.062 1 1 346 . 14 1 1 A 54 54 LEU H H 54 8.992 8.850 0.142 1 1 347 . 14 1 1 A 54 54 LEU HA H 54 5.563 5.601 -0.038 1 1 357 . 14 1 1 A 54 54 LEU N N 54 128.814 119.910 8.904 1 1 358 . 14 1 1 A 55 55 SER H H 55 9.017 10.078 -1.061 1 1 359 . 14 1 1 A 55 55 SER HA H 55 5.476 5.573 -0.097 1 1 362 . 14 1 1 A 55 55 SER CA C 55 53.944 55.514 -1.570 1 1 363 . 14 1 1 A 55 55 SER CB C 55 63.384 66.291 -2.907 1 1 364 . 14 1 1 A 55 55 SER N N 55 112.964 117.589 -4.625 1 1 365 . 14 1 1 A 56 56 ALA H H 56 8.324 10.067 -1.743 1 1 366 . 14 1 1 A 56 56 ALA HA H 56 4.605 4.738 -0.133 1 1 370 . 14 1 1 A 56 56 ALA CA C 56 50.743 50.141 0.602 1 1 371 . 14 1 1 A 56 56 ALA CB C 56 21.372 21.447 -0.075 1 1 372 . 14 1 1 A 56 56 ALA N N 56 123.555 123.459 0.096 1 1 373 . 14 1 1 A 57 57 GLN H H 57 9.080 8.631 0.449 1 1 374 . 14 1 1 A 57 57 GLN HA H 57 3.884 4.437 -0.553 1 1 381 . 14 1 1 A 57 57 GLN CA C 57 53.331 55.215 -1.884 1 1 382 . 14 1 1 A 57 57 GLN CB C 57 24.659 27.812 -3.153 1 1 384 . 14 1 1 A 57 57 GLN N N 57 116.815 118.055 -1.240 1 1 386 . 14 1 1 A 58 58 GLY H H 58 8.527 7.951 0.576 1 1 387 . 14 1 1 A 58 58 GLY HA2 H 58 4.168 4.046 0.122 1 1 388 . 14 1 1 A 58 58 GLY HA3 H 58 3.608 4.047 -0.439 1 1 389 . 14 1 1 A 58 58 GLY CA C 58 42.856 45.577 -2.721 1 1 390 . 14 1 1 A 58 58 GLY N N 58 105.983 107.118 -1.135 1 1 391 . 14 1 1 A 59 59 ALA H H 59 8.203 7.704 0.499 1 1 392 . 14 1 1 A 59 59 ALA HA H 59 4.811 4.600 0.211 1 1 396 . 14 1 1 A 59 59 ALA CA C 59 47.662 51.428 -3.766 1 1 397 . 14 1 1 A 59 59 ALA CB C 59 20.147 22.637 -2.490 1 1 398 . 14 1 1 A 59 59 ALA N N 59 125.153 121.590 3.563 1 1 399 . 14 1 1 A 60 60 GLU H H 60 8.154 8.877 -0.723 1 1 400 . 14 1 1 A 60 60 GLU HA H 60 5.508 5.609 -0.101 1 1 404 . 14 1 1 A 60 60 GLU CA C 60 52.179 54.277 -2.098 1 1 405 . 14 1 1 A 60 60 GLU CB C 60 30.203 34.064 -3.861 1 1 406 . 14 1 1 A 60 60 GLU N N 60 117.318 117.124 0.194 1 1 407 . 14 1 1 A 61 61 LYS H H 61 8.821 9.482 -0.661 1 1 408 . 14 1 1 A 61 61 LYS HA H 61 4.311 5.060 -0.749 1 1 413 . 14 1 1 A 61 61 LYS N N 61 123.743 121.385 2.358 1 1 414 . 14 1 1 A 62 62 THR H H 62 8.149 8.858 -0.709 1 1 415 . 14 1 1 A 62 62 THR HA H 62 4.928 4.570 0.358 1 1 420 . 14 1 1 A 62 62 THR CA C 62 59.427 61.093 -1.666 1 1 421 . 14 1 1 A 62 62 THR CB C 62 66.932 69.009 -2.077 1 1 422 . 14 1 1 A 62 62 THR N N 62 122.829 120.737 2.092 1 1 423 . 14 1 1 A 63 63 TYR H H 63 9.466 9.303 0.163 1 1 424 . 14 1 1 A 63 63 TYR HA H 63 4.606 5.209 -0.603 1 1 431 . 14 1 1 A 63 63 TYR CA C 63 54.508 56.429 -1.921 1 1 432 . 14 1 1 A 63 63 TYR N N 63 127.472 129.440 -1.968 1 1 433 . 14 1 1 A 64 64 GLY H H 64 9.253 8.458 0.795 1 1 434 . 14 1 1 A 64 64 GLY HA2 H 64 4.670 4.167 0.503 1 1 435 . 14 1 1 A 64 64 GLY HA3 H 64 3.619 4.198 -0.579 1 1 436 . 14 1 1 A 64 64 GLY CA C 64 39.885 44.436 -4.551 1 1 437 . 14 1 1 A 64 64 GLY N N 64 110.182 112.162 -1.980 1 1 438 . 14 1 1 A 65 65 ASN H H 65 8.616 8.495 0.121 1 1 439 . 14 1 1 A 65 65 ASN HA H 65 4.109 4.404 -0.295 1 1 444 . 14 1 1 A 65 65 ASN CA C 65 53.691 54.806 -1.115 1 1 445 . 14 1 1 A 65 65 ASN N N 65 117.778 119.222 -1.444 1 1 447 . 14 1 1 A 66 66 GLY H H 66 9.053 8.817 0.236 1 1 448 . 14 1 1 A 66 66 GLY HA2 H 66 4.344 3.912 0.432 1 1 449 . 14 1 1 A 66 66 GLY HA3 H 66 3.359 3.938 -0.579 1 1 450 . 14 1 1 A 66 66 GLY CA C 66 42.431 44.891 -2.460 1 1 451 . 14 1 1 A 66 66 GLY N N 66 115.232 114.695 0.537 1 1 452 . 14 1 1 A 67 67 ASP H H 67 8.120 8.949 -0.829 1 1 453 . 14 1 1 A 67 67 ASP HA H 67 4.844 3.813 1.031 1 1 456 . 14 1 1 A 67 67 ASP N N 67 122.593 121.485 1.108 1 1 457 . 14 1 1 A 68 68 SER H H 68 8.500 7.715 0.785 1 1 458 . 14 1 1 A 68 68 SER HA H 68 5.088 4.790 0.298 1 1 461 . 14 1 1 A 68 68 SER CA C 68 54.858 56.309 -1.451 1 1 462 . 14 1 1 A 68 68 SER CB C 68 62.114 64.037 -1.923 1 1 463 . 14 1 1 A 68 68 SER N N 68 113.557 118.545 -4.988 1 1 464 . 14 1 1 A 69 69 LEU H H 69 8.989 10.040 -1.051 1 1 465 . 14 1 1 A 69 69 LEU HA H 69 4.570 5.708 -1.138 1 1 474 . 14 1 1 A 69 69 LEU N N 69 126.836 129.654 -2.818 1 1 475 . 14 1 1 A 70 70 ASN H H 70 8.491 8.939 -0.448 1 1 476 . 14 1 1 A 70 70 ASN HA H 70 4.958 4.776 0.182 1 1 479 . 14 1 1 A 70 70 ASN CB C 70 33.265 36.551 -3.286 1 1 480 . 14 1 1 A 70 70 ASN N N 70 126.343 125.840 0.503 1 1 481 . 14 1 1 A 71 71 THR H H 71 7.831 8.121 -0.290 1 1 482 . 14 1 1 A 71 71 THR HA H 71 3.759 4.728 -0.969 1 1 487 . 14 1 1 A 71 71 THR CA C 71 61.005 59.964 1.041 1 1 488 . 14 1 1 A 71 71 THR N N 71 114.742 112.881 1.861 1 1 489 . 14 1 1 A 72 72 GLY H H 72 8.880 8.243 0.637 1 1 490 . 14 1 1 A 72 72 GLY HA2 H 72 3.907 3.857 0.050 1 1 491 . 14 1 1 A 72 72 GLY HA3 H 72 3.907 3.857 0.050 1 1 492 . 14 1 1 A 72 72 GLY N N 72 114.976 111.348 3.628 1 1 493 . 14 1 1 A 73 73 LYS H H 73 6.604 7.786 -1.182 1 1 494 . 14 1 1 A 73 73 LYS HA H 73 4.160 4.522 -0.362 1 1 501 . 14 1 1 A 73 73 LYS N N 73 113.898 117.569 -3.671 1 1 502 . 14 1 1 A 74 74 LEU H H 74 7.422 6.959 0.463 1 1 503 . 14 1 1 A 74 74 LEU HA H 74 4.358 4.195 0.163 1 1 513 . 14 1 1 A 74 74 LEU N N 74 117.180 122.898 -5.718 1 1 514 . 14 1 1 A 75 75 LYS H H 75 8.617 8.649 -0.032 1 1 515 . 14 1 1 A 75 75 LYS HA H 75 4.079 4.651 -0.572 1 1 518 . 14 1 1 A 75 75 LYS N N 75 121.119 120.760 0.359 1 1 519 . 14 1 1 A 76 76 ASN H H 76 8.154 8.593 -0.439 1 1 520 . 14 1 1 A 76 76 ASN HA H 76 3.935 4.366 -0.431 1 1 525 . 14 1 1 A 76 76 ASN CB C 76 35.772 39.257 -3.485 1 1 526 . 14 1 1 A 76 76 ASN N N 76 122.761 120.587 2.174 1 1 527 . 14 1 1 A 77 77 ASP H H 77 9.227 8.351 0.876 1 1 528 . 14 1 1 A 77 77 ASP HA H 77 3.787 5.689 -1.902 1 1 531 . 14 1 1 A 77 77 ASP CA C 77 52.584 53.292 -0.708 1 1 532 . 14 1 1 A 77 77 ASP N N 77 114.129 118.087 -3.958 1 1 533 . 14 1 1 A 78 78 LYS H H 78 6.579 8.023 -1.444 1 1 534 . 14 1 1 A 78 78 LYS HA H 78 4.572 4.162 0.410 1 1 539 . 14 1 1 A 78 78 LYS CA C 78 51.072 56.110 -5.038 1 1 540 . 14 1 1 A 78 78 LYS CB C 78 33.783 33.238 0.545 1 1 541 . 14 1 1 A 78 78 LYS N N 78 114.135 121.071 -6.936 1 1 542 . 14 1 1 A 79 79 VAL H H 79 8.729 8.317 0.412 1 1 543 . 14 1 1 A 79 79 VAL HA H 79 4.402 4.246 0.156 1 1 551 . 14 1 1 A 79 79 VAL CA C 79 59.240 60.398 -1.158 1 1 553 . 14 1 1 A 79 79 VAL N N 79 123.191 123.513 -0.322 1 1 554 . 14 1 1 A 80 80 SER H H 80 9.542 9.661 -0.119 1 1 555 . 14 1 1 A 80 80 SER HA H 80 4.636 4.957 -0.321 1 1 558 . 14 1 1 A 80 80 SER CA C 80 55.978 56.896 -0.918 1 1 559 . 14 1 1 A 80 80 SER N N 80 127.445 121.162 6.283 1 1 560 . 14 1 1 A 81 81 ARG H H 81 8.093 8.619 -0.526 1 1 561 . 14 1 1 A 81 81 ARG HA H 81 5.210 5.252 -0.042 1 1 569 . 14 1 1 A 81 81 ARG N N 81 123.743 121.342 2.401 1 1 571 . 14 1 1 A 82 82 PHE H H 82 9.312 7.992 1.320 1 1 572 . 14 1 1 A 82 82 PHE HA H 82 4.951 5.031 -0.080 1 1 577 . 14 1 1 A 82 82 PHE CA C 82 53.090 56.413 -3.323 1 1 578 . 14 1 1 A 82 82 PHE N N 82 119.529 116.803 2.726 1 1 579 . 14 1 1 A 83 83 ASP H H 83 9.122 8.513 0.609 1 1 580 . 14 1 1 A 83 83 ASP HA H 83 5.593 4.963 0.630 1 1 583 . 14 1 1 A 83 83 ASP N N 83 123.825 120.255 3.570 1 1 584 . 14 1 1 A 84 84 PHE H H 84 9.090 7.978 1.112 1 1 585 . 14 1 1 A 84 84 PHE HA H 84 6.410 6.120 0.290 1 1 592 . 14 1 1 A 84 84 PHE CA C 84 52.584 55.600 -3.016 1 1 593 . 14 1 1 A 84 84 PHE N N 84 118.862 118.928 -0.066 1 1 594 . 14 1 1 A 85 85 ILE H H 85 8.441 8.855 -0.414 1 1 595 . 14 1 1 A 85 85 ILE HA H 85 4.662 5.035 -0.373 1 1 605 . 14 1 1 A 85 85 ILE CB C 85 39.939 41.620 -1.681 1 1 608 . 14 1 1 A 85 85 ILE N N 85 118.049 120.682 -2.633 1 1 609 . 14 1 1 A 86 86 ARG H H 86 8.983 8.609 0.374 1 1 610 . 14 1 1 A 86 86 ARG HA H 86 5.591 4.630 0.961 1 1 616 . 14 1 1 A 86 86 ARG N N 86 127.006 128.409 -1.403 1 1 618 . 14 1 1 A 87 87 GLN H H 87 8.643 9.291 -0.648 1 1 619 . 14 1 1 A 87 87 GLN HA H 87 5.630 5.020 0.610 1 1 626 . 14 1 1 A 87 87 GLN CA C 87 51.512 54.364 -2.852 1 1 627 . 14 1 1 A 87 87 GLN N N 87 124.142 124.683 -0.541 1 1 629 . 14 1 1 A 88 88 ILE H H 88 8.617 9.013 -0.396 1 1 630 . 14 1 1 A 88 88 ILE HA H 88 4.690 4.916 -0.226 1 1 637 . 14 1 1 A 88 88 ILE CA C 88 56.995 60.181 -3.186 1 1 638 . 14 1 1 A 88 88 ILE CB C 88 39.927 40.468 -0.541 1 1 641 . 14 1 1 A 88 88 ILE N N 88 116.353 125.959 -9.606 1 1 642 . 14 1 1 A 89 89 GLU H H 89 8.298 8.967 -0.669 1 1 643 . 14 1 1 A 89 89 GLU HA H 89 5.100 5.698 -0.598 1 1 646 . 14 1 1 A 89 89 GLU CA C 89 52.204 54.912 -2.708 1 1 647 . 14 1 1 A 89 89 GLU CB C 89 27.325 33.184 -5.859 1 1 648 . 14 1 1 A 89 89 GLU N N 89 124.458 129.621 -5.163 1 1 649 . 14 1 1 A 90 90 VAL H H 90 8.957 8.723 0.234 1 1 650 . 14 1 1 A 90 90 VAL HA H 90 4.169 4.676 -0.507 1 1 658 . 14 1 1 A 90 90 VAL CA C 90 58.664 59.897 -1.233 1 1 659 . 14 1 1 A 90 90 VAL CB C 90 31.861 34.097 -2.236 1 1 660 . 14 1 1 A 90 90 VAL N N 90 127.580 126.368 1.212 1 1 661 . 14 1 1 A 91 91 ASP H H 91 9.369 8.574 0.795 1 1 662 . 14 1 1 A 91 91 ASP HA H 91 4.287 4.577 -0.290 1 1 665 . 14 1 1 A 91 91 ASP CA C 91 52.389 55.426 -3.037 1 1 666 . 14 1 1 A 91 91 ASP CB C 91 36.409 40.355 -3.946 1 1 667 . 14 1 1 A 91 91 ASP N N 91 129.411 123.807 5.604 1 1 668 . 14 1 1 A 92 92 GLY H H 92 8.552 7.424 1.128 1 1 669 . 14 1 1 A 92 92 GLY HA2 H 92 4.090 4.110 -0.020 1 1 670 . 14 1 1 A 92 92 GLY HA3 H 92 3.618 4.111 -0.493 1 1 671 . 14 1 1 A 92 92 GLY CA C 92 42.836 45.606 -2.770 1 1 672 . 14 1 1 A 92 92 GLY N N 92 103.862 105.298 -1.436 1 1 673 . 14 1 1 A 93 93 GLN H H 93 7.808 7.689 0.119 1 1 674 . 14 1 1 A 93 93 GLN HA H 93 4.578 4.836 -0.258 1 1 679 . 14 1 1 A 93 93 GLN CA C 93 50.918 54.306 -3.388 1 1 680 . 14 1 1 A 93 93 GLN CB C 93 28.602 31.134 -2.532 1 1 682 . 14 1 1 A 93 93 GLN N N 93 120.412 118.906 1.506 1 1 683 . 14 1 1 A 94 94 LEU H H 94 8.414 8.477 -0.063 1 1 684 . 14 1 1 A 94 94 LEU HA H 94 4.704 4.250 0.454 1 1 693 . 14 1 1 A 94 94 LEU CB C 94 39.873 42.551 -2.678 1 1 696 . 14 1 1 A 94 94 LEU N N 94 125.061 122.681 2.380 1 1 697 . 14 1 1 A 95 95 ILE H H 95 9.181 8.603 0.578 1 1 698 . 14 1 1 A 95 95 ILE HA H 95 4.371 5.022 -0.651 1 1 708 . 14 1 1 A 95 95 ILE CA C 95 63.319 60.737 2.582 1 1 709 . 14 1 1 A 95 95 ILE CB C 95 37.407 39.534 -2.127 1 1 711 . 14 1 1 A 95 95 ILE N N 95 127.724 121.673 6.051 1 1 712 . 14 1 1 A 96 96 THR H H 96 8.730 7.348 1.382 1 1 713 . 14 1 1 A 96 96 THR HA H 96 4.411 4.296 0.115 1 1 718 . 14 1 1 A 96 96 THR CA C 96 60.344 63.279 -2.935 1 1 719 . 14 1 1 A 96 96 THR CB C 96 59.719 69.843 -10.124 1 1 720 . 14 1 1 A 96 96 THR N N 96 124.240 118.791 5.449 1 1 721 . 14 1 1 A 97 97 LEU H H 97 8.790 8.741 0.049 1 1 722 . 14 1 1 A 97 97 LEU HA H 97 4.400 5.017 -0.617 1 1 732 . 14 1 1 A 97 97 LEU N N 97 126.147 125.026 1.121 1 1 733 . 14 1 1 A 98 98 GLU H H 98 7.596 8.720 -1.124 1 1 734 . 14 1 1 A 98 98 GLU HA H 98 5.102 4.988 0.114 1 1 739 . 14 1 1 A 98 98 GLU N N 98 116.937 123.171 -6.234 1 1 740 . 14 1 1 A 99 99 SER H H 99 8.906 8.451 0.455 1 1 741 . 14 1 1 A 99 99 SER HA H 99 4.504 5.474 -0.970 1 1 744 . 14 1 1 A 99 99 SER CA C 99 54.010 57.106 -3.096 1 1 745 . 14 1 1 A 99 99 SER CB C 99 63.876 65.937 -2.061 1 1 746 . 14 1 1 A 99 99 SER N N 99 117.823 116.996 0.827 1 1 747 . 14 1 1 A 100 100 GLY H H 100 7.250 8.137 -0.887 1 1 748 . 14 1 1 A 100 100 GLY HA2 H 100 4.872 4.205 0.667 1 1 749 . 14 1 1 A 100 100 GLY HA3 H 100 3.731 4.251 -0.520 1 1 750 . 14 1 1 A 100 100 GLY N N 100 109.436 110.037 -0.601 1 1 751 . 14 1 1 A 101 101 GLU H H 101 9.661 8.961 0.700 1 1 752 . 14 1 1 A 101 101 GLU HA H 101 5.643 4.748 0.895 1 1 757 . 14 1 1 A 101 101 GLU CA C 101 52.584 54.546 -1.962 1 1 758 . 14 1 1 A 101 101 GLU CB C 101 31.750 33.229 -1.479 1 1 759 . 14 1 1 A 101 101 GLU N N 101 126.793 120.451 6.342 1 1 760 . 14 1 1 A 102 102 PHE H H 102 10.441 8.535 1.906 1 1 761 . 14 1 1 A 102 102 PHE HA H 102 5.248 5.409 -0.161 1 1 768 . 14 1 1 A 102 102 PHE CA C 102 53.537 56.234 -2.697 1 1 769 . 14 1 1 A 102 102 PHE N N 102 131.837 126.209 5.628 1 1 770 . 14 1 1 A 103 103 GLN H H 103 9.135 9.607 -0.472 1 1 771 . 14 1 1 A 103 103 GLN HA H 103 5.205 4.927 0.278 1 1 776 . 14 1 1 A 103 103 GLN CA C 103 50.925 55.094 -4.169 1 1 777 . 14 1 1 A 103 103 GLN N N 103 127.720 126.114 1.606 1 1 778 . 14 1 1 A 104 104 VAL H H 104 8.937 8.824 0.113 1 1 779 . 14 1 1 A 104 104 VAL HA H 104 4.780 5.285 -0.505 1 1 787 . 14 1 1 A 104 104 VAL CA C 104 57.086 60.962 -3.876 1 1 789 . 14 1 1 A 104 104 VAL N N 104 120.097 126.126 -6.029 1 1 790 . 14 1 1 A 105 105 TYR H H 105 9.108 8.946 0.162 1 1 791 . 14 1 1 A 105 105 TYR HA H 105 4.834 5.378 -0.544 1 1 798 . 14 1 1 A 105 105 TYR CA C 105 54.486 57.867 -3.381 1 1 799 . 14 1 1 A 105 105 TYR N N 105 128.426 126.105 2.321 1 1 800 . 14 1 1 A 106 106 LYS H H 106 5.945 9.404 -3.459 1 1 805 . 14 1 1 A 106 106 LYS N N 106 129.163 127.423 1.740 1 1 806 . 14 1 1 A 107 107 GLN H H 107 8.526 8.477 0.049 1 1 807 . 14 1 1 A 107 107 GLN HA H 107 5.160 5.425 -0.265 1 1 812 . 14 1 1 A 107 107 GLN CA C 107 52.584 54.052 -1.468 1 1 813 . 14 1 1 A 107 107 GLN CB C 107 26.175 29.082 -2.907 1 1 814 . 14 1 1 A 107 107 GLN N N 107 125.978 124.581 1.397 1 1 815 . 14 1 1 A 108 108 SER H H 108 8.621 8.645 -0.024 1 1 816 . 14 1 1 A 108 108 SER HA H 108 4.403 4.156 0.247 1 1 819 . 14 1 1 A 108 108 SER CA C 108 58.521 61.059 -2.538 1 1 820 . 14 1 1 A 108 108 SER CB C 108 60.737 62.562 -1.825 1 1 821 . 14 1 1 A 108 108 SER N N 108 117.542 113.668 3.874 1 1 822 . 14 1 1 A 109 109 HIS H H 109 10.381 8.488 1.893 1 1 823 . 14 1 1 A 109 109 HIS HA H 109 4.594 4.767 -0.173 1 1 828 . 14 1 1 A 109 109 HIS CA C 109 51.743 56.505 -4.762 1 1 829 . 14 1 1 A 109 109 HIS CB C 109 27.174 31.626 -4.452 1 1 830 . 14 1 1 A 109 109 HIS N N 109 118.449 118.003 0.446 1 1 831 . 14 1 1 A 110 110 SER H H 110 7.366 8.079 -0.713 1 1 832 . 14 1 1 A 110 110 SER HA H 110 4.870 4.736 0.134 1 1 835 . 14 1 1 A 110 110 SER CB C 110 62.986 65.130 -2.144 1 1 836 . 14 1 1 A 110 110 SER N N 110 113.397 113.534 -0.137 1 1 837 . 14 1 1 A 111 111 ALA H H 111 8.541 8.277 0.264 1 1 838 . 14 1 1 A 111 111 ALA HA H 111 4.826 4.847 -0.021 1 1 842 . 14 1 1 A 111 111 ALA CA C 111 49.015 51.588 -2.573 1 1 843 . 14 1 1 A 111 111 ALA CB C 111 20.256 23.053 -2.797 1 1 844 . 14 1 1 A 111 111 ALA N N 111 117.786 123.525 -5.739 1 1 845 . 14 1 1 A 112 112 LEU H H 112 8.529 9.356 -0.827 1 1 846 . 14 1 1 A 112 112 LEU HA H 112 5.680 5.214 0.466 1 1 855 . 14 1 1 A 112 112 LEU CA C 112 51.818 53.507 -1.689 1 1 856 . 14 1 1 A 112 112 LEU N N 112 116.345 115.159 1.186 1 1 857 . 14 1 1 A 113 113 THR H H 113 8.758 8.785 -0.027 1 1 858 . 14 1 1 A 113 113 THR HA H 113 5.563 5.280 0.283 1 1 863 . 14 1 1 A 113 113 THR CA C 113 54.458 60.540 -6.082 1 1 864 . 14 1 1 A 113 113 THR CB C 113 68.586 72.371 -3.785 1 1 866 . 14 1 1 A 113 113 THR N N 113 110.469 118.345 -7.876 1 1 867 . 14 1 1 A 114 114 ALA H H 114 8.829 8.713 0.116 1 1 868 . 14 1 1 A 114 114 ALA HA H 114 4.466 4.969 -0.503 1 1 872 . 14 1 1 A 114 114 ALA CA C 114 48.886 51.976 -3.090 1 1 873 . 14 1 1 A 114 114 ALA CB C 114 21.583 21.770 -0.187 1 1 874 . 14 1 1 A 114 114 ALA N N 114 121.456 124.065 -2.609 1 1 875 . 14 1 1 A 115 115 LEU H H 115 8.407 9.641 -1.234 1 1 876 . 14 1 1 A 115 115 LEU HA H 115 4.814 4.719 0.095 1 1 886 . 14 1 1 A 115 115 LEU N N 115 119.223 123.946 -4.723 1 1 887 . 14 1 1 A 116 116 GLN H H 116 9.720 9.191 0.529 1 1 888 . 14 1 1 A 116 116 GLN HA H 116 5.312 5.239 0.073 1 1 893 . 14 1 1 A 116 116 GLN CA C 116 50.544 54.075 -3.531 1 1 894 . 14 1 1 A 116 116 GLN N N 116 127.827 122.116 5.711 1 1 895 . 14 1 1 A 117 117 THR H H 117 9.663 9.245 0.418 1 1 896 . 14 1 1 A 117 117 THR HA H 117 4.198 5.097 -0.899 1 1 901 . 14 1 1 A 117 117 THR CA C 117 64.037 60.885 3.152 1 1 902 . 14 1 1 A 117 117 THR CB C 117 66.868 72.513 -5.645 1 1 904 . 14 1 1 A 117 117 THR N N 117 128.929 120.255 8.674 1 1 905 . 14 1 1 A 118 118 GLU H H 118 9.486 9.168 0.318 1 1 906 . 14 1 1 A 118 118 GLU HA H 118 4.885 4.602 0.283 1 1 911 . 14 1 1 A 118 118 GLU N N 118 123.497 121.563 1.934 1 1 912 . 14 1 1 A 119 119 GLN H H 119 8.076 7.548 0.528 1 1 913 . 14 1 1 A 119 119 GLN HA H 119 5.331 4.840 0.491 1 1 916 . 14 1 1 A 119 119 GLN CA C 119 51.858 54.387 -2.529 1 1 917 . 14 1 1 A 119 119 GLN N N 119 118.023 116.511 1.512 1 1 918 . 14 1 1 A 120 120 GLU H H 120 9.078 8.650 0.428 1 1 919 . 14 1 1 A 120 120 GLU HA H 120 5.071 5.034 0.037 1 1 924 . 14 1 1 A 120 120 GLU N N 120 118.433 124.938 -6.505 1 1 925 . 14 1 1 A 121 121 GLN H H 121 7.711 8.979 -1.268 1 1 926 . 14 1 1 A 121 121 GLN HA H 121 4.430 5.133 -0.703 1 1 933 . 14 1 1 A 121 121 GLN CA C 121 53.996 54.573 -0.577 1 1 934 . 14 1 1 A 121 121 GLN CB C 121 27.158 33.061 -5.903 1 1 936 . 14 1 1 A 121 121 GLN N N 121 122.412 118.984 3.428 1 1 938 . 14 1 1 A 122 122 ASP H H 122 8.675 10.182 -1.507 1 1 939 . 14 1 1 A 122 122 ASP HA H 122 4.632 5.179 -0.547 1 1 942 . 14 1 1 A 122 122 ASP CA C 122 48.797 50.744 -1.947 1 1 943 . 14 1 1 A 122 122 ASP CB C 122 39.852 42.293 -2.441 1 1 944 . 14 1 1 A 122 122 ASP N N 122 128.625 122.617 6.008 1 1 945 . 14 1 1 A 123 123 PRO CA C 123 61.579 62.686 -1.107 1 1 946 . 14 1 1 A 123 123 PRO CB C 123 29.597 31.738 -2.141 1 1 948 . 14 1 1 A 124 124 GLU H H 124 8.297 8.886 -0.589 1 1 949 . 14 1 1 A 124 124 GLU HA H 124 4.196 4.555 -0.359 1 1 954 . 14 1 1 A 124 124 GLU CA C 124 53.025 56.702 -3.677 1 1 955 . 14 1 1 A 124 124 GLU CB C 124 27.927 31.979 -4.052 1 1 957 . 14 1 1 A 124 124 GLU N N 124 115.538 120.263 -4.725 1 1 958 . 14 1 1 A 125 125 HIS H H 125 7.419 7.315 0.104 1 1 959 . 14 1 1 A 125 125 HIS HA H 125 4.833 4.657 0.176 1 1 964 . 14 1 1 A 125 125 HIS CA C 125 51.886 56.356 -4.470 1 1 965 . 14 1 1 A 125 125 HIS CB C 125 26.387 30.870 -4.483 1 1 966 . 14 1 1 A 125 125 HIS N N 125 117.464 115.811 1.653 1 1 967 . 14 1 1 A 126 126 SER H H 126 8.441 8.485 -0.044 1 1 968 . 14 1 1 A 126 126 SER HA H 126 4.261 4.666 -0.405 1 1 971 . 14 1 1 A 126 126 SER CA C 126 57.988 57.149 0.839 1 1 972 . 14 1 1 A 126 126 SER N N 126 117.954 114.400 3.554 1 1 973 . 14 1 1 A 127 127 GLU H H 127 9.221 7.735 1.486 1 1 974 . 14 1 1 A 127 127 GLU HA H 127 4.366 4.367 -0.001 1 1 979 . 14 1 1 A 127 127 GLU CA C 127 53.707 55.946 -2.239 1 1 980 . 14 1 1 A 127 127 GLU CB C 127 25.492 30.425 -4.933 1 1 981 . 14 1 1 A 127 127 GLU N N 127 120.404 120.417 -0.013 1 1 982 . 14 1 1 A 128 128 LYS H H 128 8.262 7.981 0.281 1 1 983 . 14 1 1 A 128 128 LYS HA H 128 4.661 4.091 0.570 1 1 990 . 14 1 1 A 128 128 LYS CA C 128 52.264 57.528 -5.264 1 1 991 . 14 1 1 A 128 128 LYS CB C 128 32.404 31.323 1.081 1 1 994 . 14 1 1 A 128 128 LYS N N 128 122.166 117.024 5.142 1 1 995 . 14 1 1 A 129 129 MET H H 129 8.242 9.694 -1.452 1 1 996 . 14 1 1 A 129 129 MET HA H 129 5.012 5.193 -0.181 1 1 1001 . 14 1 1 A 129 129 MET CA C 129 50.958 53.898 -2.940 1 1 1003 . 14 1 1 A 129 129 MET N N 129 119.422 116.999 2.423 1 1 1004 . 14 1 1 A 130 130 VAL H H 130 9.200 9.857 -0.657 1 1 1005 . 14 1 1 A 130 130 VAL HA H 130 4.609 4.672 -0.063 1 1 1013 . 14 1 1 A 130 130 VAL CA C 130 56.296 60.486 -4.190 1 1 1014 . 14 1 1 A 130 130 VAL CB C 130 32.606 36.336 -3.730 1 1 1015 . 14 1 1 A 130 130 VAL N N 130 118.290 119.700 -1.410 1 1 1016 . 14 1 1 A 131 131 ALA H H 131 8.368 8.585 -0.217 1 1 1017 . 14 1 1 A 131 131 ALA HA H 131 4.654 5.023 -0.369 1 1 1021 . 14 1 1 A 131 131 ALA CA C 131 49.739 51.904 -2.165 1 1 1022 . 14 1 1 A 131 131 ALA CB C 131 15.351 20.932 -5.581 1 1 1023 . 14 1 1 A 131 131 ALA N N 131 126.734 124.142 2.592 1 1 1024 . 14 1 1 A 132 132 LYS H H 132 7.732 8.575 -0.843 1 1 1025 . 14 1 1 A 132 132 LYS HA H 132 4.171 4.815 -0.644 1 1 1028 . 14 1 1 A 132 132 LYS N N 132 127.309 121.626 5.683 1 1 1029 . 14 1 1 A 133 133 ARG H H 133 8.193 8.660 -0.467 1 1 1030 . 14 1 1 A 133 133 ARG HA H 133 5.073 4.702 0.371 1 1 1038 . 14 1 1 A 133 133 ARG N N 133 122.190 123.299 -1.109 1 1 1040 . 14 1 1 A 134 134 ARG H H 134 7.539 8.891 -1.352 1 1 1041 . 14 1 1 A 134 134 ARG HA H 134 4.667 5.018 -0.351 1 1 1049 . 14 1 1 A 134 134 ARG CA C 134 52.584 54.645 -2.061 1 1 1050 . 14 1 1 A 134 134 ARG CB C 134 31.325 33.365 -2.040 1 1 1052 . 14 1 1 A 134 134 ARG N N 134 121.632 125.321 -3.689 1 1 1054 . 14 1 1 A 135 135 PHE H H 135 8.816 8.855 -0.039 1 1 1055 . 14 1 1 A 135 135 PHE HA H 135 5.680 5.686 -0.006 1 1 1062 . 14 1 1 A 135 135 PHE N N 135 125.107 121.561 3.546 1 1 1063 . 14 1 1 A 136 136 ARG H H 136 7.741 9.692 -1.951 1 1 1064 . 14 1 1 A 136 136 ARG HA H 136 4.402 4.473 -0.071 1 1 1068 . 14 1 1 A 136 136 ARG N N 136 125.640 124.657 0.983 1 1 1070 . 14 1 1 A 137 137 ILE H H 137 8.556 8.715 -0.159 1 1 1071 . 14 1 1 A 137 137 ILE HA H 137 3.912 4.470 -0.558 1 1 1076 . 14 1 1 A 137 137 ILE CA C 137 55.676 61.057 -5.381 1 1 1079 . 14 1 1 A 137 137 ILE N N 137 122.891 127.816 -4.925 1 1 1080 . 14 1 1 A 138 138 GLY H H 138 8.676 8.751 -0.075 1 1 1081 . 14 1 1 A 138 138 GLY HA2 H 138 3.740 4.058 -0.318 1 1 1082 . 14 1 1 A 138 138 GLY HA3 H 138 2.982 4.061 -1.079 1 1 1083 . 14 1 1 A 138 138 GLY CA C 138 41.908 45.668 -3.760 1 1 1084 . 14 1 1 A 138 138 GLY N N 138 117.058 117.092 -0.034 1 1 1085 . 14 1 1 A 139 139 ASP H H 139 7.858 7.895 -0.037 1 1 1086 . 14 1 1 A 139 139 ASP HA H 139 4.753 4.582 0.171 1 1 1089 . 14 1 1 A 139 139 ASP CA C 139 52.584 54.484 -1.900 1 1 1090 . 14 1 1 A 139 139 ASP CB C 139 43.062 41.222 1.840 1 1 1091 . 14 1 1 A 139 139 ASP N N 139 124.516 118.716 5.800 1 1 1092 . 14 1 1 A 140 140 ILE H H 140 8.354 8.503 -0.149 1 1 1093 . 14 1 1 A 140 140 ILE HA H 140 4.473 4.557 -0.084 1 1 1103 . 14 1 1 A 140 140 ILE CB C 140 36.173 38.757 -2.584 1 1 1105 . 14 1 1 A 140 140 ILE N N 140 120.679 121.966 -1.287 1 1 1106 . 14 1 1 A 141 141 ALA H H 141 8.708 7.633 1.075 1 1 1107 . 14 1 1 A 141 141 ALA HA H 141 4.862 3.696 1.166 1 1 1111 . 14 1 1 A 141 141 ALA CA C 141 47.968 52.827 -4.859 1 1 1112 . 14 1 1 A 141 141 ALA CB C 141 21.733 18.840 2.893 1 1 1113 . 14 1 1 A 141 141 ALA N N 141 130.144 126.845 3.299 1 1 1114 . 14 1 1 A 142 142 GLY H H 142 7.888 8.056 -0.168 1 1 1115 . 14 1 1 A 142 142 GLY HA2 H 142 4.519 4.449 0.070 1 1 1116 . 14 1 1 A 142 142 GLY HA3 H 142 3.634 4.829 -1.195 1 1 1117 . 14 1 1 A 142 142 GLY N N 142 102.272 110.546 -8.274 1 1 1118 . 14 1 1 A 143 143 GLU H H 143 8.068 8.076 -0.008 1 1 1119 . 14 1 1 A 143 143 GLU HA H 143 4.577 4.610 -0.033 1 1 1124 . 14 1 1 A 143 143 GLU N N 143 120.569 121.709 -1.140 1 1 1125 . 14 1 1 A 144 144 HIS H H 144 8.478 8.792 -0.314 1 1 1126 . 14 1 1 A 144 144 HIS HA H 144 4.968 5.045 -0.077 1 1 1131 . 14 1 1 A 144 144 HIS N N 144 124.275 123.885 0.390 1 1 1132 . 14 1 1 A 145 145 THR H H 145 9.031 9.668 -0.637 1 1 1133 . 14 1 1 A 145 145 THR HA H 145 4.025 4.794 -0.769 1 1 1138 . 14 1 1 A 145 145 THR CA C 145 61.247 61.225 0.022 1 1 1139 . 14 1 1 A 145 145 THR CB C 145 65.181 69.326 -4.145 1 1 1141 . 14 1 1 A 145 145 THR N N 145 125.828 119.460 6.368 1 1 1142 . 14 1 1 A 146 146 SER H H 146 9.077 8.288 0.789 1 1 1143 . 14 1 1 A 146 146 SER HA H 146 4.684 5.545 -0.861 1 1 1145 . 14 1 1 A 146 146 SER CA C 146 56.067 57.956 -1.889 1 1 1146 . 14 1 1 A 146 146 SER CB C 146 60.510 61.027 -0.517 1 1 1147 . 14 1 1 A 146 146 SER N N 146 124.154 119.650 4.504 1 1 1148 . 14 1 1 A 147 147 PHE H H 147 9.049 9.346 -0.297 1 1 1149 . 14 1 1 A 147 147 PHE HA H 147 4.022 4.664 -0.642 1 1 1154 . 14 1 1 A 147 147 PHE N N 147 127.670 124.049 3.621 1 1 1155 . 14 1 1 A 148 148 ASP H H 148 8.504 8.563 -0.059 1 1 1156 . 14 1 1 A 148 148 ASP HA H 148 4.422 4.621 -0.199 1 1 1158 . 14 1 1 A 148 148 ASP CA C 148 52.584 57.301 -4.717 1 1 1159 . 14 1 1 A 148 148 ASP CB C 148 37.800 41.239 -3.439 1 1 1160 . 14 1 1 A 148 148 ASP N N 148 114.377 120.024 -5.647 1 1 1161 . 14 1 1 A 149 149 LYS H H 149 7.380 10.153 -2.773 1 1 1162 . 14 1 1 A 149 149 LYS HA H 149 4.487 4.214 0.273 1 1 1171 . 14 1 1 A 149 149 LYS CA C 149 51.735 58.238 -6.503 1 1 1172 . 14 1 1 A 149 149 LYS CB C 149 30.162 31.885 -1.723 1 1 1175 . 14 1 1 A 149 149 LYS N N 149 119.137 115.765 3.372 1 1 1176 . 14 1 1 A 150 150 LEU H H 150 6.886 8.176 -1.290 1 1 1177 . 14 1 1 A 150 150 LEU HA H 150 3.996 4.580 -0.584 1 1 1186 . 14 1 1 A 150 150 LEU CA C 150 50.502 52.025 -1.523 1 1 1187 . 14 1 1 A 150 150 LEU N N 150 120.614 117.625 2.989 1 1 1188 . 14 1 1 A 151 151 PRO CB C 151 29.567 31.494 -1.927 1 1 1190 . 14 1 1 A 152 152 LYS H H 152 8.076 8.720 -0.644 1 1 1191 . 14 1 1 A 152 152 LYS HA H 152 4.346 4.507 -0.161 1 1 1195 . 14 1 1 A 152 152 LYS CA C 152 53.182 56.815 -3.633 1 1 1196 . 14 1 1 A 152 152 LYS CB C 152 31.487 34.374 -2.887 1 1 1198 . 14 1 1 A 152 152 LYS N N 152 118.133 120.494 -2.361 1 1 1199 . 14 1 1 A 153 153 ASP H H 153 7.982 8.006 -0.024 1 1 1200 . 14 1 1 A 153 153 ASP HA H 153 4.402 4.903 -0.501 1 1 1203 . 14 1 1 A 153 153 ASP CA C 153 52.584 53.206 -0.622 1 1 1204 . 14 1 1 A 153 153 ASP CB C 153 37.762 41.420 -3.658 1 1 1205 . 14 1 1 A 153 153 ASP N N 153 115.735 115.832 -0.097 1 1 1206 . 14 1 1 A 154 154 VAL H H 154 6.987 7.513 -0.526 1 1 1207 . 14 1 1 A 154 154 VAL HA H 154 4.406 4.320 0.086 1 1 1215 . 14 1 1 A 154 154 VAL CA C 154 58.408 62.171 -3.763 1 1 1216 . 14 1 1 A 154 154 VAL CB C 154 32.617 31.766 0.851 1 1 1217 . 14 1 1 A 154 154 VAL N N 154 116.266 121.499 -5.233 1 1 1218 . 14 1 1 A 155 155 MET H H 155 8.444 8.894 -0.450 1 1 1219 . 14 1 1 A 155 155 MET HA H 155 5.416 5.141 0.275 1 1 1224 . 14 1 1 A 155 155 MET CA C 155 51.183 54.027 -2.844 1 1 1226 . 14 1 1 A 155 155 MET N N 155 124.950 127.005 -2.055 1 1 1227 . 14 1 1 A 156 156 ALA H H 156 9.226 9.163 0.063 1 1 1228 . 14 1 1 A 156 156 ALA HA H 156 4.693 5.158 -0.465 1 1 1232 . 14 1 1 A 156 156 ALA CA C 156 48.379 50.178 -1.799 1 1 1233 . 14 1 1 A 156 156 ALA CB C 156 21.051 21.161 -0.110 1 1 1234 . 14 1 1 A 156 156 ALA N N 156 129.938 127.499 2.439 1 1 1235 . 14 1 1 A 157 157 THR H H 157 8.554 8.546 0.008 1 1 1236 . 14 1 1 A 157 157 THR HA H 157 4.839 4.472 0.367 1 1 1241 . 14 1 1 A 157 157 THR CA C 157 59.555 62.450 -2.895 1 1 1242 . 14 1 1 A 157 157 THR CB C 157 68.575 69.927 -1.352 1 1 1244 . 14 1 1 A 157 157 THR N N 157 118.815 117.668 1.147 1 1 1245 . 14 1 1 A 158 158 TYR H H 158 9.974 9.678 0.296 1 1 1246 . 14 1 1 A 158 158 TYR HA H 158 4.435 5.047 -0.612 1 1 1253 . 14 1 1 A 158 158 TYR N N 158 126.958 122.532 4.426 1 1 1254 . 14 1 1 A 159 159 ARG H H 159 8.909 8.674 0.235 1 1 1255 . 14 1 1 A 159 159 ARG HA H 159 5.444 5.900 -0.456 1 1 1263 . 14 1 1 A 159 159 ARG CA C 159 51.933 54.298 -2.365 1 1 1264 . 14 1 1 A 159 159 ARG N N 159 121.721 121.462 0.259 1 1 1266 . 14 1 1 A 160 160 GLY H H 160 8.910 9.478 -0.568 1 1 1267 . 14 1 1 A 160 160 GLY HA2 H 160 4.904 4.402 0.502 1 1 1268 . 14 1 1 A 160 160 GLY HA3 H 160 4.484 4.447 0.037 1 1 1269 . 14 1 1 A 160 160 GLY N N 160 113.921 107.219 6.702 1 1 1270 . 14 1 1 A 161 161 THR H H 161 9.110 8.988 0.122 1 1 1271 . 14 1 1 A 161 161 THR HA H 161 4.810 5.287 -0.477 1 1 1276 . 14 1 1 A 161 161 THR CA C 161 59.603 60.896 -1.293 1 1 1277 . 14 1 1 A 161 161 THR CB C 161 69.909 72.284 -2.375 1 1 1279 . 14 1 1 A 161 161 THR N N 161 126.813 115.845 10.968 1 1 1280 . 14 1 1 A 162 162 ALA H H 162 7.137 9.130 -1.993 1 1 1281 . 14 1 1 A 162 162 ALA HA H 162 5.361 5.151 0.210 1 1 1285 . 14 1 1 A 162 162 ALA CA C 162 46.573 51.178 -4.605 1 1 1286 . 14 1 1 A 162 162 ALA CB C 162 20.959 23.535 -2.576 1 1 1287 . 14 1 1 A 162 162 ALA N N 162 128.111 123.547 4.564 1 1 1288 . 14 1 1 A 163 163 PHE H H 163 8.587 9.131 -0.544 1 1 1289 . 14 1 1 A 163 163 PHE HA H 163 5.538 5.319 0.219 1 1 1296 . 14 1 1 A 163 163 PHE N N 163 117.349 114.696 2.653 1 1 1297 . 14 1 1 A 164 164 GLY H H 164 8.650 8.398 0.252 1 1 1298 . 14 1 1 A 164 164 GLY HA2 H 164 4.210 3.693 0.517 1 1 1299 . 14 1 1 A 164 164 GLY HA3 H 164 3.285 3.834 -0.549 1 1 1300 . 14 1 1 A 164 164 GLY CA C 164 40.377 45.346 -4.969 1 1 1301 . 14 1 1 A 164 164 GLY N N 164 108.839 108.645 0.194 1 1 1302 . 14 1 1 A 165 165 SER H H 165 7.684 10.652 -2.968 1 1 1303 . 14 1 1 A 165 165 SER HA H 165 3.458 3.659 -0.201 1 1 1304 . 14 1 1 A 165 165 SER N N 165 116.037 118.502 -2.465 1 1 1305 . 14 1 1 A 166 166 ASP H H 166 9.718 8.458 1.260 1 1 1306 . 14 1 1 A 166 166 ASP HA H 166 4.281 4.441 -0.160 1 1 1309 . 14 1 1 A 166 166 ASP CA C 166 52.584 56.755 -4.171 1 1 1310 . 14 1 1 A 166 166 ASP N N 166 125.166 120.519 4.647 1 1 1311 . 14 1 1 A 167 167 ASP H H 167 7.655 8.448 -0.793 1 1 1312 . 14 1 1 A 167 167 ASP HA H 167 4.666 4.925 -0.259 1 1 1315 . 14 1 1 A 167 167 ASP CB C 167 38.948 42.617 -3.669 1 1 1316 . 14 1 1 A 167 167 ASP N N 167 117.491 118.102 -0.611 1 1 1317 . 14 1 1 A 168 168 ALA H H 168 8.585 8.422 0.163 1 1 1318 . 14 1 1 A 168 168 ALA HA H 168 5.012 4.716 0.296 1 1 1322 . 14 1 1 A 168 168 ALA CA C 168 47.485 51.121 -3.636 1 1 1323 . 14 1 1 A 168 168 ALA N N 168 128.834 120.844 7.990 1 1 1324 . 14 1 1 A 169 169 GLY H H 169 8.472 7.629 0.843 1 1 1325 . 14 1 1 A 169 169 GLY HA2 H 169 4.404 4.188 0.216 1 1 1326 . 14 1 1 A 169 169 GLY HA3 H 169 4.051 4.243 -0.192 1 1 1327 . 14 1 1 A 169 169 GLY CA C 169 43.257 45.242 -1.985 1 1 1328 . 14 1 1 A 169 169 GLY N N 169 107.133 106.924 0.209 1 1 1329 . 14 1 1 A 170 170 GLY H H 170 7.229 8.258 -1.029 1 1 1330 . 14 1 1 A 170 170 GLY HA2 H 170 4.223 4.038 0.185 1 1 1331 . 14 1 1 A 170 170 GLY HA3 H 170 3.781 4.063 -0.282 1 1 1332 . 14 1 1 A 170 170 GLY CA C 170 43.310 45.650 -2.340 1 1 1333 . 14 1 1 A 170 170 GLY N N 170 107.542 108.182 -0.640 1 1 1334 . 14 1 1 A 171 171 LYS H H 171 9.641 8.382 1.259 1 1 1335 . 14 1 1 A 171 171 LYS HA H 171 5.129 4.701 0.428 1 1 1342 . 14 1 1 A 171 171 LYS CA C 171 51.355 55.703 -4.348 1 1 1343 . 14 1 1 A 171 171 LYS N N 171 124.322 126.021 -1.699 1 1 1344 . 14 1 1 A 172 172 LEU H H 172 7.764 8.655 -0.891 1 1 1345 . 14 1 1 A 172 172 LEU HA H 172 4.973 5.308 -0.335 1 1 1353 . 14 1 1 A 172 172 LEU CA C 172 50.348 53.369 -3.021 1 1 1354 . 14 1 1 A 172 172 LEU N N 172 126.389 120.870 5.519 1 1 1355 . 14 1 1 A 173 173 THR H H 173 8.321 8.697 -0.376 1 1 1356 . 14 1 1 A 173 173 THR HA H 173 5.017 5.039 -0.022 1 1 1361 . 14 1 1 A 173 173 THR CA C 173 59.149 61.817 -2.668 1 1 1362 . 14 1 1 A 173 173 THR CB C 173 67.449 70.953 -3.504 1 1 1364 . 14 1 1 A 173 173 THR N N 173 123.553 118.791 4.762 1 1 1365 . 14 1 1 A 174 174 TYR H H 174 9.367 9.204 0.163 1 1 1366 . 14 1 1 A 174 174 TYR HA H 174 4.660 5.489 -0.829 1 1 1373 . 14 1 1 A 174 174 TYR CB C 174 41.267 41.568 -0.301 1 1 1374 . 14 1 1 A 174 174 TYR N N 174 129.583 123.177 6.406 1 1 1375 . 14 1 1 A 175 175 THR H H 175 8.529 8.801 -0.272 1 1 1376 . 14 1 1 A 175 175 THR HA H 175 5.388 4.788 0.600 1 1 1381 . 14 1 1 A 175 175 THR CA C 175 58.216 62.437 -4.221 1 1 1382 . 14 1 1 A 175 175 THR CB C 175 68.575 69.917 -1.342 1 1 1384 . 14 1 1 A 175 175 THR N N 175 125.967 115.608 10.359 1 1 1385 . 14 1 1 A 176 176 ILE H H 176 9.139 8.744 0.395 1 1 1386 . 14 1 1 A 176 176 ILE HA H 176 4.382 5.340 -0.958 1 1 1395 . 14 1 1 A 176 176 ILE CA C 176 58.006 59.980 -1.974 1 1 1396 . 14 1 1 A 176 176 ILE CB C 176 38.881 41.967 -3.086 1 1 1400 . 14 1 1 A 176 176 ILE N N 176 123.715 125.980 -2.265 1 1 1401 . 14 1 1 A 177 177 ASP H H 177 8.501 9.582 -1.081 1 1 1402 . 14 1 1 A 177 177 ASP HA H 177 5.011 5.288 -0.277 1 1 1405 . 14 1 1 A 177 177 ASP CA C 177 49.089 52.935 -3.846 1 1 1406 . 14 1 1 A 177 177 ASP CB C 177 39.282 43.926 -4.644 1 1 1407 . 14 1 1 A 177 177 ASP N N 177 125.978 124.008 1.970 1 1 1408 . 14 1 1 A 178 178 PHE H H 178 8.913 10.049 -1.136 1 1 1409 . 14 1 1 A 178 178 PHE HA H 178 3.993 4.564 -0.571 1 1 1414 . 14 1 1 A 178 178 PHE CB C 178 34.588 39.707 -5.119 1 1 1415 . 14 1 1 A 178 178 PHE N N 178 123.522 125.760 -2.238 1 1 1416 . 14 1 1 A 179 179 ALA H H 179 8.487 9.241 -0.754 1 1 1417 . 14 1 1 A 179 179 ALA HA H 179 4.528 4.378 0.150 1 1 1421 . 14 1 1 A 179 179 ALA CA C 179 52.584 55.578 -2.994 1 1 1422 . 14 1 1 A 179 179 ALA CB C 179 15.666 18.562 -2.896 1 1 1423 . 14 1 1 A 179 179 ALA N N 179 124.061 124.183 -0.122 1 1 1424 . 14 1 1 A 180 180 ALA H H 180 7.162 7.851 -0.689 1 1 1425 . 14 1 1 A 180 180 ALA HA H 180 4.313 4.429 -0.116 1 1 1429 . 14 1 1 A 180 180 ALA CA C 180 49.006 51.159 -2.153 1 1 1430 . 14 1 1 A 180 180 ALA CB C 180 16.933 17.407 -0.474 1 1 1431 . 14 1 1 A 180 180 ALA N N 180 119.710 119.072 0.638 1 1 1432 . 14 1 1 A 181 181 LYS H H 181 8.092 9.655 -1.563 1 1 1433 . 14 1 1 A 181 181 LYS HA H 181 3.457 4.566 -1.109 1 1 1440 . 14 1 1 A 181 181 LYS CA C 181 54.783 57.333 -2.550 1 1 1441 . 14 1 1 A 181 181 LYS CB C 181 27.088 31.355 -4.267 1 1 1444 . 14 1 1 A 181 181 LYS N N 181 114.996 121.852 -6.856 1 1 1445 . 14 1 1 A 182 182 GLN H H 182 7.532 8.019 -0.487 1 1 1446 . 14 1 1 A 182 182 GLN HA H 182 5.304 5.250 0.054 1 1 1453 . 14 1 1 A 182 182 GLN CA C 182 51.473 54.310 -2.837 1 1 1454 . 14 1 1 A 182 182 GLN CB C 182 31.585 32.314 -0.729 1 1 1455 . 14 1 1 A 182 182 GLN N N 182 115.064 120.616 -5.552 1 1 1457 . 14 1 1 A 183 183 GLY H H 183 9.026 8.303 0.723 1 1 1458 . 14 1 1 A 183 183 GLY HA2 H 183 5.376 4.340 1.036 1 1 1459 . 14 1 1 A 183 183 GLY HA3 H 183 3.567 4.363 -0.796 1 1 1460 . 14 1 1 A 183 183 GLY CA C 183 42.361 45.495 -3.134 1 1 1461 . 14 1 1 A 183 183 GLY N N 183 111.505 111.014 0.491 1 1 1462 . 14 1 1 A 184 184 HIS H H 184 7.508 9.161 -1.653 1 1 1463 . 14 1 1 A 184 184 HIS HA H 184 4.304 5.281 -0.977 1 1 1467 . 14 1 1 A 184 184 HIS CA C 184 52.793 54.705 -1.912 1 1 1468 . 14 1 1 A 184 184 HIS CB C 184 27.906 33.539 -5.633 1 1 1469 . 14 1 1 A 184 184 HIS N N 184 111.297 124.225 -12.928 1 1 1470 . 14 1 1 A 185 185 GLY H H 185 9.160 7.744 1.416 1 1 1471 . 14 1 1 A 185 185 GLY HA2 H 185 4.464 4.358 0.106 1 1 1472 . 14 1 1 A 185 185 GLY HA3 H 185 4.117 4.388 -0.271 1 1 1473 . 14 1 1 A 185 185 GLY CA C 185 44.212 46.131 -1.919 1 1 1474 . 14 1 1 A 185 185 GLY N N 185 107.398 111.361 -3.963 1 1 1475 . 14 1 1 A 186 186 LYS H H 186 9.170 8.156 1.014 1 1 1476 . 14 1 1 A 186 186 LYS HA H 186 4.925 5.000 -0.075 1 1 1481 . 14 1 1 A 186 186 LYS CB C 186 33.642 36.487 -2.845 1 1 1482 . 14 1 1 A 186 186 LYS N N 186 122.690 121.397 1.293 1 1 1483 . 14 1 1 A 187 187 ILE H H 187 8.444 8.227 0.217 1 1 1484 . 14 1 1 A 187 187 ILE HA H 187 4.626 4.896 -0.270 1 1 1487 . 14 1 1 A 187 187 ILE N N 187 124.320 123.555 0.765 1 1 1488 . 14 1 1 A 188 188 GLU H H 188 8.590 9.290 -0.700 1 1 1489 . 14 1 1 A 188 188 GLU HA H 188 4.650 4.532 0.118 1 1 1495 . 14 1 1 A 188 188 GLU N N 188 122.575 127.979 -5.404 1 1 1496 . 14 1 1 A 189 189 HIS H H 189 8.726 8.445 0.281 1 1 1497 . 14 1 1 A 189 189 HIS HA H 189 4.055 4.401 -0.346 1 1 1501 . 14 1 1 A 189 189 HIS CA C 189 54.623 56.754 -2.131 1 1 1502 . 14 1 1 A 189 189 HIS CB C 189 24.997 29.605 -4.608 1 1 1503 . 14 1 1 A 189 189 HIS N N 189 111.381 122.009 -10.628 1 1 1504 . 14 1 1 A 190 190 LEU H H 190 9.715 8.073 1.642 1 1 1505 . 14 1 1 A 190 190 LEU HA H 190 4.379 4.569 -0.190 1 1 1515 . 14 1 1 A 190 190 LEU N N 190 124.648 126.499 -1.851 1 1 1516 . 14 1 1 A 191 191 LYS H H 191 10.099 9.287 0.812 1 1 1517 . 14 1 1 A 191 191 LYS HA H 191 3.736 3.696 0.040 1 1 1524 . 14 1 1 A 191 191 LYS CA C 191 55.815 59.878 -4.063 1 1 1525 . 14 1 1 A 191 191 LYS CB C 191 30.201 32.129 -1.928 1 1 1527 . 14 1 1 A 191 191 LYS N N 191 123.618 121.113 2.505 1 1 1528 . 14 1 1 A 192 192 SER H H 192 6.991 7.917 -0.926 1 1 1529 . 14 1 1 A 192 192 SER HA H 192 4.743 4.419 0.324 1 1 1532 . 14 1 1 A 192 192 SER CA C 192 51.974 57.387 -5.413 1 1 1533 . 14 1 1 A 192 192 SER CB C 192 60.005 63.537 -3.532 1 1 1534 . 14 1 1 A 192 192 SER N N 192 115.071 114.150 0.921 1 1 1535 . 14 1 1 A 193 193 PRO CB C 193 29.607 31.705 -2.098 1 1 1537 . 14 1 1 A 194 194 GLU H H 194 8.213 8.454 -0.241 1 1 1538 . 14 1 1 A 194 194 GLU HA H 194 3.063 4.301 -1.238 1 1 1543 . 14 1 1 A 194 194 GLU CA C 194 54.185 56.068 -1.883 1 1 1545 . 14 1 1 A 194 194 GLU N N 194 114.055 118.276 -4.221 1 1 1546 . 14 1 1 A 195 195 LEU H H 195 7.082 7.953 -0.871 1 1 1547 . 14 1 1 A 195 195 LEU HA H 195 4.027 3.995 0.032 1 1 1557 . 14 1 1 A 195 195 LEU CA C 195 51.361 56.843 -5.482 1 1 1558 . 14 1 1 A 195 195 LEU CB C 195 38.950 41.689 -2.739 1 1 1561 . 14 1 1 A 195 195 LEU N N 195 113.898 120.037 -6.139 1 1 1562 . 14 1 1 A 196 196 ASN H H 196 7.060 7.612 -0.552 1 1 1563 . 14 1 1 A 196 196 ASN HA H 196 4.638 5.769 -1.131 1 1 1567 . 14 1 1 A 196 196 ASN N N 196 119.196 116.083 3.113 1 1 1568 . 14 1 1 A 197 197 VAL H H 197 7.244 8.549 -1.305 1 1 1569 . 14 1 1 A 197 197 VAL HA H 197 4.540 4.830 -0.290 1 1 1577 . 14 1 1 A 197 197 VAL CA C 197 57.176 59.748 -2.572 1 1 1578 . 14 1 1 A 197 197 VAL N N 197 113.621 123.349 -9.728 1 1 1579 . 14 1 1 A 198 198 ASP H H 198 8.881 9.252 -0.371 1 1 1580 . 14 1 1 A 198 198 ASP HA H 198 4.894 4.955 -0.061 1 1 1581 . 14 1 1 A 198 198 ASP N N 198 118.852 123.927 -5.075 1 1 1582 . 14 1 1 A 199 199 LEU H H 199 8.498 8.989 -0.491 1 1 1583 . 14 1 1 A 199 199 LEU HA H 199 4.317 4.534 -0.217 1 1 1591 . 14 1 1 A 199 199 LEU N N 199 124.078 125.214 -1.136 1 1 1592 . 14 1 1 A 200 200 ALA H H 200 8.386 8.127 0.259 1 1 1593 . 14 1 1 A 200 200 ALA HA H 200 4.295 5.420 -1.125 1 1 1597 . 14 1 1 A 200 200 ALA CA C 200 50.044 51.209 -1.165 1 1 1598 . 14 1 1 A 200 200 ALA CB C 200 17.985 22.009 -4.024 1 1 1599 . 14 1 1 A 200 200 ALA N N 200 127.315 125.251 2.064 1 1 1600 . 14 1 1 A 201 201 VAL H H 201 8.007 9.000 -0.993 1 1 1601 . 14 1 1 A 201 201 VAL HA H 201 4.577 4.682 -0.105 1 1 1609 . 14 1 1 A 201 201 VAL CA C 201 60.004 60.241 -0.237 1 1 1610 . 14 1 1 A 201 201 VAL CB C 201 28.863 35.877 -7.014 1 1 1611 . 14 1 1 A 201 201 VAL N N 201 119.409 121.948 -2.539 1 1 1612 . 14 1 1 A 202 202 ALA H H 202 8.789 8.822 -0.033 1 1 1613 . 14 1 1 A 202 202 ALA HA H 202 4.630 5.406 -0.776 1 1 1617 . 14 1 1 A 202 202 ALA CA C 202 48.200 50.088 -1.888 1 1 1618 . 14 1 1 A 202 202 ALA N N 202 131.745 127.183 4.562 1 1 1619 . 14 1 1 A 203 203 TYR H H 203 8.522 9.058 -0.536 1 1 1620 . 14 1 1 A 203 203 TYR HA H 203 5.391 4.939 0.452 1 1 1627 . 14 1 1 A 203 203 TYR CA C 203 54.648 59.016 -4.368 1 1 1628 . 14 1 1 A 203 203 TYR CB C 203 37.315 39.544 -2.229 1 1 1629 . 14 1 1 A 203 203 TYR N N 203 117.786 125.161 -7.375 1 1 1630 . 14 1 1 A 204 204 ILE H H 204 8.209 7.008 1.201 1 1 1631 . 14 1 1 A 204 204 ILE HA H 204 4.393 4.462 -0.069 1 1 1641 . 14 1 1 A 204 204 ILE CB C 204 36.807 41.671 -4.864 1 1 1644 . 14 1 1 A 204 204 ILE N N 204 120.602 122.842 -2.240 1 1 1645 . 14 1 1 A 205 205 LYS H H 205 9.340 8.802 0.538 1 1 1646 . 14 1 1 A 205 205 LYS HA H 205 4.756 4.400 0.356 1 1 1651 . 14 1 1 A 205 205 LYS CA C 205 50.844 60.696 -9.852 1 1 1652 . 14 1 1 A 205 205 LYS N N 205 127.960 124.267 3.693 1 1 1653 . 14 1 1 A 207 207 ASP H H 207 8.436 8.446 -0.010 1 1 1654 . 14 1 1 A 207 207 ASP HA H 207 4.692 4.479 0.213 1 1 1657 . 14 1 1 A 207 207 ASP CA C 207 48.789 54.938 -6.149 1 1 1658 . 14 1 1 A 207 207 ASP CB C 207 38.377 40.565 -2.188 1 1 1659 . 14 1 1 A 207 207 ASP N N 207 123.098 125.227 -2.129 1 1 1660 . 14 1 1 A 208 208 GLU H H 208 8.880 7.960 0.920 1 1 1661 . 14 1 1 A 208 208 GLU HA H 208 3.994 4.212 -0.218 1 1 1666 . 14 1 1 A 208 208 GLU CA C 208 56.123 57.461 -1.338 1 1 1667 . 14 1 1 A 208 208 GLU CB C 208 25.794 30.114 -4.320 1 1 1669 . 14 1 1 A 208 208 GLU N N 208 119.042 120.823 -1.781 1 1 1670 . 14 1 1 A 209 209 LYS H H 209 7.681 7.560 0.121 1 1 1671 . 14 1 1 A 209 209 LYS HA H 209 4.141 4.321 -0.180 1 1 1680 . 14 1 1 A 209 209 LYS N N 209 119.252 116.761 2.491 1 1 1681 . 14 1 1 A 210 210 HIS H H 210 8.177 7.143 1.034 1 1 1682 . 14 1 1 A 210 210 HIS HA H 210 3.825 4.755 -0.930 1 1 1687 . 14 1 1 A 210 210 HIS CA C 210 54.205 54.350 -0.145 1 1 1688 . 14 1 1 A 210 210 HIS CB C 210 23.439 29.862 -6.423 1 1 1689 . 14 1 1 A 210 210 HIS N N 210 112.758 113.464 -0.706 1 1 1690 . 14 1 1 A 211 211 HIS H H 211 8.758 7.408 1.350 1 1 1691 . 14 1 1 A 211 211 HIS HA H 211 5.041 4.805 0.236 1 1 1695 . 14 1 1 A 211 211 HIS CA C 211 50.450 54.608 -4.158 1 1 1696 . 14 1 1 A 211 211 HIS CB C 211 25.703 33.544 -7.841 1 1 1697 . 14 1 1 A 211 211 HIS N N 211 119.552 118.836 0.716 1 1 1698 . 14 1 1 A 212 212 ALA H H 212 8.556 7.686 0.870 1 1 1699 . 14 1 1 A 212 212 ALA HA H 212 4.712 4.659 0.053 1 1 1703 . 14 1 1 A 212 212 ALA CA C 212 49.886 51.888 -2.002 1 1 1704 . 14 1 1 A 212 212 ALA CB C 212 18.860 17.889 0.971 1 1 1705 . 14 1 1 A 212 212 ALA N N 212 123.780 124.045 -0.265 1 1 1706 . 14 1 1 A 213 213 VAL H H 213 9.338 7.462 1.876 1 1 1707 . 14 1 1 A 213 213 VAL HA H 213 5.074 4.665 0.409 1 1 1715 . 14 1 1 A 213 213 VAL CA C 213 57.486 60.213 -2.727 1 1 1716 . 14 1 1 A 213 213 VAL CB C 213 33.938 34.792 -0.854 1 1 1717 . 14 1 1 A 213 213 VAL N N 213 124.742 119.220 5.522 1 1 1718 . 14 1 1 A 214 214 ILE H H 214 8.962 8.333 0.629 1 1 1719 . 14 1 1 A 214 214 ILE HA H 214 4.434 4.744 -0.310 1 1 1726 . 14 1 1 A 214 214 ILE N N 214 122.881 126.845 -3.964 1 1 1727 . 14 1 1 A 215 215 SER H H 215 8.558 8.700 -0.142 1 1 1728 . 14 1 1 A 215 215 SER HA H 215 5.001 5.585 -0.584 1 1 1731 . 14 1 1 A 215 215 SER CA C 215 53.230 56.450 -3.220 1 1 1732 . 14 1 1 A 215 215 SER CB C 215 62.077 65.373 -3.296 1 1 1733 . 14 1 1 A 215 215 SER N N 215 122.891 122.967 -0.076 1 1 1734 . 14 1 1 A 216 216 GLY H H 216 7.282 9.703 -2.421 1 1 1735 . 14 1 1 A 216 216 GLY HA2 H 216 4.515 4.367 0.148 1 1 1736 . 14 1 1 A 216 216 GLY HA3 H 216 3.473 4.388 -0.915 1 1 1737 . 14 1 1 A 216 216 GLY CA C 216 42.816 45.941 -3.125 1 1 1738 . 14 1 1 A 216 216 GLY N N 216 110.899 114.263 -3.364 1 1 1739 . 14 1 1 A 217 217 SER H H 217 8.673 8.806 -0.133 1 1 1740 . 14 1 1 A 217 217 SER HA H 217 5.127 5.525 -0.398 1 1 1743 . 14 1 1 A 217 217 SER CA C 217 56.266 56.399 -0.133 1 1 1744 . 14 1 1 A 217 217 SER N N 217 117.164 115.719 1.445 1 1 1745 . 14 1 1 A 218 218 VAL H H 218 7.451 8.856 -1.405 1 1 1746 . 14 1 1 A 218 218 VAL HA H 218 5.128 4.609 0.519 1 1 1754 . 14 1 1 A 218 218 VAL CA C 218 56.637 61.719 -5.082 1 1 1755 . 14 1 1 A 218 218 VAL N N 218 117.826 123.567 -5.741 1 1 1756 . 14 1 1 A 219 219 LEU H H 219 9.022 9.058 -0.036 1 1 1757 . 14 1 1 A 219 219 LEU HA H 219 5.387 4.978 0.409 1 1 1767 . 14 1 1 A 219 219 LEU CA C 219 50.450 53.776 -3.326 1 1 1768 . 14 1 1 A 219 219 LEU N N 219 124.820 126.484 -1.664 1 1 1769 . 14 1 1 A 220 220 TYR H H 220 8.816 9.117 -0.301 1 1 1770 . 14 1 1 A 220 220 TYR HA H 220 4.834 5.662 -0.828 1 1 1777 . 14 1 1 A 220 220 TYR N N 220 121.249 126.061 -4.812 1 1 1778 . 14 1 1 A 221 221 ASN H H 221 9.191 8.651 0.540 1 1 1779 . 14 1 1 A 221 221 ASN HA H 221 4.048 4.449 -0.401 1 1 1784 . 14 1 1 A 221 221 ASN CA C 221 51.647 54.574 -2.927 1 1 1785 . 14 1 1 A 221 221 ASN CB C 221 36.640 38.299 -1.659 1 1 1786 . 14 1 1 A 221 221 ASN N N 221 129.865 122.850 7.015 1 1 1788 . 14 1 1 A 222 222 GLN H H 222 8.468 7.159 1.309 1 1 1789 . 14 1 1 A 222 222 GLN HA H 222 3.671 4.041 -0.370 1 1 1794 . 14 1 1 A 222 222 GLN CA C 222 55.075 57.791 -2.716 1 1 1795 . 14 1 1 A 222 222 GLN CB C 222 24.663 29.631 -4.968 1 1 1797 . 14 1 1 A 222 222 GLN N N 222 108.367 118.672 -10.305 1 1 1798 . 14 1 1 A 223 223 ASP H H 223 7.797 7.937 -0.140 1 1 1799 . 14 1 1 A 223 223 ASP HA H 223 4.986 4.846 0.140 1 1 1802 . 14 1 1 A 223 223 ASP N N 223 120.842 118.367 2.475 1 1 1803 . 14 1 1 A 224 224 GLU H H 224 8.731 7.934 0.797 1 1 1804 . 14 1 1 A 224 224 GLU HA H 224 4.690 4.821 -0.131 1 1 1809 . 14 1 1 A 224 224 GLU CA C 224 54.703 56.191 -1.488 1 1 1810 . 14 1 1 A 224 224 GLU CB C 224 26.357 31.452 -5.095 1 1 1812 . 14 1 1 A 224 224 GLU N N 224 124.249 121.220 3.029 1 1 1813 . 14 1 1 A 225 225 LYS H H 225 8.730 8.380 0.350 1 1 1814 . 14 1 1 A 225 225 LYS HA H 225 4.754 4.817 -0.063 1 1 1822 . 14 1 1 A 225 225 LYS N N 225 126.784 124.817 1.967 1 1 1823 . 14 1 1 A 226 226 GLY H H 226 7.683 9.264 -1.581 1 1 1824 . 14 1 1 A 226 226 GLY HA2 H 226 5.567 4.187 1.380 1 1 1825 . 14 1 1 A 226 226 GLY HA3 H 226 3.819 4.188 -0.369 1 1 1826 . 14 1 1 A 226 226 GLY CA C 226 42.264 44.125 -1.861 1 1 1827 . 14 1 1 A 226 226 GLY N N 226 107.140 111.308 -4.168 1 1 1828 . 14 1 1 A 227 227 SER H H 227 8.672 9.394 -0.722 1 1 1829 . 14 1 1 A 227 227 SER HA H 227 5.564 5.290 0.274 1 1 1832 . 14 1 1 A 227 227 SER CA C 227 54.373 56.269 -1.896 1 1 1833 . 14 1 1 A 227 227 SER CB C 227 63.963 65.979 -2.016 1 1 1834 . 14 1 1 A 227 227 SER N N 227 117.767 115.104 2.663 1 1 1835 . 14 1 1 A 228 228 TYR H H 228 9.073 9.388 -0.315 1 1 1836 . 14 1 1 A 228 228 TYR HA H 228 5.519 5.002 0.517 1 1 1843 . 14 1 1 A 228 228 TYR N N 228 118.324 123.486 -5.162 1 1 1844 . 14 1 1 A 229 229 SER H H 229 8.929 8.135 0.794 1 1 1845 . 14 1 1 A 229 229 SER HA H 229 5.209 5.131 0.078 1 1 1848 . 14 1 1 A 229 229 SER CA C 229 54.131 57.433 -3.302 1 1 1849 . 14 1 1 A 229 229 SER N N 229 116.118 123.499 -7.381 1 1 1850 . 14 1 1 A 230 230 LEU H H 230 9.372 8.784 0.588 1 1 1851 . 14 1 1 A 230 230 LEU HA H 230 4.803 4.783 0.020 1 1 1863 . 14 1 1 A 230 230 LEU N N 230 124.803 125.289 -0.486 1 1 1864 . 14 1 1 A 231 231 GLY H H 231 9.080 8.329 0.751 1 1 1865 . 14 1 1 A 231 231 GLY HA2 H 231 4.776 4.091 0.685 1 1 1866 . 14 1 1 A 231 231 GLY HA3 H 231 3.528 4.178 -0.650 1 1 1867 . 14 1 1 A 231 231 GLY CA C 231 41.468 44.328 -2.860 1 1 1868 . 14 1 1 A 231 231 GLY N N 231 109.611 108.570 1.041 1 1 1869 . 14 1 1 A 232 232 ILE H H 232 6.849 8.638 -1.789 1 1 1870 . 14 1 1 A 232 232 ILE HA H 232 4.742 5.034 -0.292 1 1 1878 . 14 1 1 A 232 232 ILE N N 232 120.566 124.194 -3.628 1 1 1879 . 14 1 1 A 233 233 PHE H H 233 9.569 9.481 0.088 1 1 1880 . 14 1 1 A 233 233 PHE HA H 233 4.979 6.244 -1.265 1 1 1885 . 14 1 1 A 233 233 PHE N N 233 129.256 128.203 1.053 1 1 1886 . 14 1 1 A 234 234 GLY H H 234 8.734 9.280 -0.546 1 1 1887 . 14 1 1 A 234 234 GLY HA2 H 234 4.488 4.432 0.056 1 1 1888 . 14 1 1 A 234 234 GLY HA3 H 234 3.327 4.496 -1.169 1 1 1889 . 14 1 1 A 234 234 GLY CA C 234 40.377 45.849 -5.472 1 1 1890 . 14 1 1 A 234 234 GLY N N 234 105.294 112.150 -6.856 1 1 1891 . 14 1 1 A 235 235 GLU H H 235 9.198 8.377 0.821 1 1 1892 . 14 1 1 A 235 235 GLU HA H 235 4.111 4.234 -0.123 1 1 1897 . 14 1 1 A 235 235 GLU CA C 235 56.466 59.211 -2.745 1 1 1898 . 14 1 1 A 235 235 GLU CB C 235 26.256 29.788 -3.532 1 1 1900 . 14 1 1 A 235 235 GLU N N 235 125.813 121.068 4.745 1 1 1901 . 14 1 1 A 236 236 LYS H H 236 8.147 7.803 0.344 1 1 1902 . 14 1 1 A 236 236 LYS HA H 236 4.373 4.531 -0.158 1 1 1905 . 14 1 1 A 236 236 LYS N N 236 117.810 119.169 -1.359 1 1 1906 . 14 1 1 A 237 237 ALA H H 237 7.685 7.643 0.042 1 1 1907 . 14 1 1 A 237 237 ALA HA H 237 3.902 4.507 -0.605 1 1 1911 . 14 1 1 A 237 237 ALA CA C 237 49.762 52.043 -2.281 1 1 1912 . 14 1 1 A 237 237 ALA CB C 237 14.720 19.456 -4.736 1 1 1913 . 14 1 1 A 237 237 ALA N N 237 118.704 121.493 -2.789 1 1 1914 . 14 1 1 A 238 238 GLN H H 238 9.312 8.481 0.831 1 1 1915 . 14 1 1 A 238 238 GLN HA H 238 4.049 4.699 -0.650 1 1 1920 . 14 1 1 A 238 238 GLN N N 238 118.059 122.086 -4.027 1 1 1921 . 14 1 1 A 239 239 GLU H H 239 8.785 10.363 -1.578 1 1 1922 . 14 1 1 A 239 239 GLU HA H 239 5.531 5.255 0.276 1 1 1927 . 14 1 1 A 239 239 GLU N N 239 116.914 121.535 -4.621 1 1 1928 . 14 1 1 A 240 240 VAL H H 240 8.501 9.189 -0.688 1 1 1929 . 14 1 1 A 240 240 VAL HA H 240 5.655 4.887 0.768 1 1 1937 . 14 1 1 A 240 240 VAL CA C 240 55.582 60.827 -5.245 1 1 1940 . 14 1 1 A 240 240 VAL N N 240 110.588 122.310 -11.722 1 1 1941 . 14 1 1 A 241 241 ALA H H 241 8.463 8.590 -0.127 1 1 1942 . 14 1 1 A 241 241 ALA HA H 241 5.014 5.293 -0.279 1 1 1946 . 14 1 1 A 241 241 ALA CA C 241 49.361 51.245 -1.884 1 1 1947 . 14 1 1 A 241 241 ALA CB C 241 18.196 23.854 -5.658 1 1 1948 . 14 1 1 A 241 241 ALA N N 241 121.125 129.810 -8.685 1 1 1949 . 14 1 1 A 242 242 GLY H H 242 9.421 8.911 0.510 1 1 1950 . 14 1 1 A 242 242 GLY HA2 H 242 5.161 4.217 0.944 1 1 1951 . 14 1 1 A 242 242 GLY HA3 H 242 4.076 4.288 -0.212 1 1 1952 . 14 1 1 A 242 242 GLY N N 242 112.036 106.873 5.163 1 1 1953 . 14 1 1 A 243 243 SER H H 243 8.929 8.256 0.673 1 1 1954 . 14 1 1 A 243 243 SER HA H 243 5.331 5.507 -0.176 1 1 1957 . 14 1 1 A 243 243 SER N N 243 116.113 116.473 -0.360 1 1 1958 . 14 1 1 A 244 244 ALA H H 244 9.218 9.389 -0.171 1 1 1959 . 14 1 1 A 244 244 ALA HA H 244 5.221 4.795 0.426 1 1 1963 . 14 1 1 A 244 244 ALA CA C 244 47.883 50.281 -2.398 1 1 1964 . 14 1 1 A 244 244 ALA N N 244 120.635 127.699 -7.064 1 1 1965 . 14 1 1 A 245 245 GLU H H 245 9.194 8.507 0.687 1 1 1966 . 14 1 1 A 245 245 GLU HA H 245 4.869 5.005 -0.136 1 1 1971 . 14 1 1 A 245 245 GLU N N 245 123.487 118.773 4.714 1 1 1972 . 14 1 1 A 246 246 VAL H H 246 8.531 8.758 -0.227 1 1 1973 . 14 1 1 A 246 246 VAL HA H 246 4.518 4.646 -0.128 1 1 1981 . 14 1 1 A 246 246 VAL CA C 246 58.286 61.792 -3.506 1 1 1982 . 14 1 1 A 246 246 VAL N N 246 123.347 121.371 1.976 1 1 1983 . 14 1 1 A 247 247 GLU H H 247 9.132 8.816 0.316 1 1 1984 . 14 1 1 A 247 247 GLU HA H 247 4.368 4.884 -0.516 1 1 1989 . 14 1 1 A 247 247 GLU CB C 247 26.744 31.808 -5.064 1 1 1990 . 14 1 1 A 247 247 GLU N N 247 129.243 126.740 2.503 1 1 1991 . 14 1 1 A 248 248 THR H H 248 7.827 8.436 -0.609 1 1 1992 . 14 1 1 A 248 248 THR HA H 248 4.749 4.820 -0.071 1 1 1997 . 14 1 1 A 248 248 THR CA C 248 56.859 60.769 -3.910 1 1 1998 . 14 1 1 A 248 248 THR CB C 248 69.171 70.634 -1.463 1 1 2000 . 14 1 1 A 248 248 THR N N 248 114.228 119.032 -4.804 1 1 2001 . 14 1 1 A 249 249 ALA H H 249 9.148 8.638 0.510 1 1 2002 . 14 1 1 A 249 249 ALA HA H 249 4.174 4.167 0.007 1 1 2006 . 14 1 1 A 249 249 ALA CA C 249 51.970 53.683 -1.713 1 1 2007 . 14 1 1 A 249 249 ALA CB C 249 15.797 18.764 -2.967 1 1 2008 . 14 1 1 A 249 249 ALA N N 249 123.341 124.481 -1.140 1 1 2009 . 14 1 1 A 250 250 ASN H H 250 7.974 7.701 0.273 1 1 2010 . 14 1 1 A 250 250 ASN HA H 250 4.953 4.856 0.097 1 1 2015 . 14 1 1 A 250 250 ASN CA C 250 49.198 52.676 -3.478 1 1 2016 . 14 1 1 A 250 250 ASN CB C 250 35.976 38.685 -2.709 1 1 2017 . 14 1 1 A 250 250 ASN N N 250 113.358 116.018 -2.660 1 1 2019 . 14 1 1 A 251 251 GLY H H 251 7.510 7.782 -0.272 1 1 2020 . 14 1 1 A 251 251 GLY HA2 H 251 4.492 4.024 0.468 1 1 2021 . 14 1 1 A 251 251 GLY HA3 H 251 3.853 4.153 -0.300 1 1 2022 . 14 1 1 A 251 251 GLY CA C 251 41.435 45.455 -4.020 1 1 2023 . 14 1 1 A 251 251 GLY N N 251 108.692 107.955 0.737 1 1 2024 . 14 1 1 A 252 252 ILE H H 252 8.465 8.757 -0.292 1 1 2025 . 14 1 1 A 252 252 ILE HA H 252 4.521 4.430 0.091 1 1 2035 . 14 1 1 A 252 252 ILE CB C 252 35.653 38.281 -2.628 1 1 2039 . 14 1 1 A 252 252 ILE N N 252 122.043 126.935 -4.892 1 1 2040 . 14 1 1 A 253 253 HIS H H 253 9.311 8.683 0.628 1 1 2041 . 14 1 1 A 253 253 HIS HA H 253 4.861 5.214 -0.353 1 1 2046 . 14 1 1 A 253 253 HIS N N 253 126.617 122.615 4.002 1 1 2047 . 14 1 1 A 254 254 HIS H H 254 8.820 9.176 -0.356 1 1 2048 . 14 1 1 A 254 254 HIS HA H 254 5.305 5.719 -0.414 1 1 2051 . 14 1 1 A 254 254 HIS CA C 254 52.781 53.499 -0.718 1 1 2052 . 14 1 1 A 254 254 HIS N N 254 122.665 116.929 5.736 1 1 2053 . 14 1 1 A 255 255 ILE H H 255 9.047 9.799 -0.752 1 1 2054 . 14 1 1 A 255 255 ILE HA H 255 4.651 4.210 0.441 1 1 2061 . 14 1 1 A 255 255 ILE N N 255 123.958 120.716 3.242 1 1 2062 . 14 1 1 A 256 256 GLY H H 256 9.339 8.218 1.121 1 1 2063 . 14 1 1 A 256 256 GLY HA2 H 256 3.816 2.521 1.295 1 1 2064 . 14 1 1 A 256 256 GLY HA3 H 256 2.267 3.593 -1.326 1 1 2065 . 14 1 1 A 256 256 GLY N N 256 115.022 114.416 0.606 1 1 2066 . 14 1 1 A 257 257 LEU H H 257 7.890 9.284 -1.394 1 1 2067 . 14 1 1 A 257 257 LEU HA H 257 4.853 5.064 -0.211 1 1 2077 . 14 1 1 A 257 257 LEU N N 257 121.441 125.486 -4.045 1 1 2078 . 14 1 1 A 258 258 ALA H H 258 7.982 9.155 -1.173 1 1 2079 . 14 1 1 A 258 258 ALA HA H 258 4.668 5.002 -0.334 1 1 2083 . 14 1 1 A 258 258 ALA CA C 258 49.678 51.689 -2.011 1 1 2084 . 14 1 1 A 258 258 ALA CB C 258 19.561 20.558 -0.997 1 1 2085 . 14 1 1 A 258 258 ALA N N 258 123.234 122.880 0.354 1 1 2086 . 14 1 1 A 259 259 ALA H H 259 9.117 8.724 0.393 1 1 2087 . 14 1 1 A 259 259 ALA HA H 259 4.790 4.991 -0.201 1 1 2091 . 14 1 1 A 259 259 ALA N N 259 123.901 124.802 -0.901 1 1 2092 . 14 1 1 A 260 260 LYS H H 260 8.452 8.315 0.137 1 1 2093 . 14 1 1 A 260 260 LYS HA H 260 5.914 4.903 1.011 1 1 2098 . 14 1 1 A 260 260 LYS CA C 260 51.818 54.371 -2.553 1 1 2099 . 14 1 1 A 260 260 LYS N N 260 116.464 116.701 -0.237 1 1 1 . 15 1 1 A 9 9 SER H H 9 8.293 8.567 -0.274 1 1 2 . 15 1 1 A 9 9 SER HA H 9 4.432 5.041 -0.609 1 1 3 . 15 1 1 A 9 9 SER N N 9 116.407 120.204 -3.797 1 1 4 . 15 1 1 A 10 10 GLY H H 10 8.472 8.892 -0.420 1 1 5 . 15 1 1 A 10 10 GLY N N 10 111.611 113.324 -1.713 1 1 6 . 15 1 1 A 14 14 VAL H H 14 8.009 8.333 -0.324 1 1 7 . 15 1 1 A 14 14 VAL HA H 14 4.128 4.108 0.020 1 1 15 . 15 1 1 A 14 14 VAL CA C 14 59.473 62.063 -2.590 1 1 16 . 15 1 1 A 14 14 VAL CB C 14 30.127 33.342 -3.215 1 1 17 . 15 1 1 A 14 14 VAL N N 14 119.846 117.209 2.637 1 1 18 . 15 1 1 A 15 15 THR H H 15 8.152 8.642 -0.490 1 1 19 . 15 1 1 A 15 15 THR HA H 15 4.346 4.454 -0.108 1 1 24 . 15 1 1 A 15 15 THR N N 15 118.509 116.873 1.636 1 1 25 . 15 1 1 A 16 16 ALA H H 16 8.207 8.616 -0.409 1 1 26 . 15 1 1 A 16 16 ALA HA H 16 4.319 4.244 0.075 1 1 30 . 15 1 1 A 16 16 ALA CA C 16 49.835 53.449 -3.614 1 1 31 . 15 1 1 A 16 16 ALA CB C 16 16.714 19.243 -2.529 1 1 32 . 15 1 1 A 16 16 ALA N N 16 126.935 125.037 1.898 1 1 33 . 15 1 1 A 17 17 ASP H H 17 8.269 7.861 0.408 1 1 34 . 15 1 1 A 17 17 ASP HA H 17 4.581 4.828 -0.247 1 1 37 . 15 1 1 A 17 17 ASP CA C 17 51.643 53.420 -1.777 1 1 38 . 15 1 1 A 17 17 ASP CB C 17 38.257 41.309 -3.052 1 1 39 . 15 1 1 A 17 17 ASP N N 17 120.379 118.376 2.003 1 1 40 . 15 1 1 A 18 18 ILE H H 18 7.979 7.916 0.063 1 1 41 . 15 1 1 A 18 18 ILE HA H 18 4.178 4.064 0.114 1 1 48 . 15 1 1 A 18 18 ILE CA C 18 58.737 63.465 -4.728 1 1 49 . 15 1 1 A 18 18 ILE CB C 18 36.077 38.066 -1.989 1 1 53 . 15 1 1 A 18 18 ILE N N 18 121.171 122.880 -1.709 1 1 54 . 15 1 1 A 19 19 GLY H H 19 8.410 8.099 0.311 1 1 55 . 15 1 1 A 19 19 GLY HA2 H 19 4.023 3.819 0.204 1 1 56 . 15 1 1 A 19 19 GLY HA3 H 19 4.023 3.822 0.201 1 1 57 . 15 1 1 A 19 19 GLY N N 19 112.246 108.471 3.775 1 1 58 . 15 1 1 A 20 20 THR H H 20 8.005 8.329 -0.324 1 1 59 . 15 1 1 A 20 20 THR HA H 20 4.463 4.199 0.264 1 1 64 . 15 1 1 A 20 20 THR CB C 20 66.723 68.696 -1.973 1 1 66 . 15 1 1 A 20 20 THR N N 20 112.239 115.313 -3.074 1 1 67 . 15 1 1 A 21 21 GLY H H 21 8.500 8.553 -0.053 1 1 68 . 15 1 1 A 21 21 GLY HA2 H 21 4.099 3.801 0.298 1 1 69 . 15 1 1 A 21 21 GLY HA3 H 21 3.872 3.802 0.070 1 1 70 . 15 1 1 A 21 21 GLY N N 21 111.048 112.936 -1.888 1 1 71 . 15 1 1 A 22 22 LEU H H 22 7.427 7.760 -0.333 1 1 72 . 15 1 1 A 22 22 LEU HA H 22 3.884 4.041 -0.157 1 1 84 . 15 1 1 A 22 22 LEU N N 22 118.837 120.257 -1.420 1 1 85 . 15 1 1 A 23 23 ALA H H 23 7.896 7.776 0.120 1 1 86 . 15 1 1 A 23 23 ALA HA H 23 4.023 4.171 -0.148 1 1 90 . 15 1 1 A 23 23 ALA CA C 23 52.584 54.183 -1.599 1 1 91 . 15 1 1 A 23 23 ALA CB C 23 15.470 18.425 -2.955 1 1 92 . 15 1 1 A 23 23 ALA N N 23 119.194 121.556 -2.362 1 1 93 . 15 1 1 A 24 24 ASP H H 24 8.265 7.972 0.293 1 1 94 . 15 1 1 A 24 24 ASP HA H 24 4.337 4.578 -0.241 1 1 97 . 15 1 1 A 24 24 ASP CB C 24 37.029 41.223 -4.194 1 1 98 . 15 1 1 A 24 24 ASP N N 24 119.035 116.935 2.100 1 1 99 . 15 1 1 A 25 25 ALA H H 25 8.211 8.386 -0.175 1 1 100 . 15 1 1 A 25 25 ALA HA H 25 4.064 4.408 -0.344 1 1 104 . 15 1 1 A 25 25 ALA CA C 25 53.278 54.138 -0.860 1 1 105 . 15 1 1 A 25 25 ALA CB C 25 15.760 18.250 -2.490 1 1 106 . 15 1 1 A 25 25 ALA N N 25 122.434 121.296 1.138 1 1 107 . 15 1 1 A 26 26 LEU H H 26 7.334 7.487 -0.153 1 1 108 . 15 1 1 A 26 26 LEU HA H 26 4.351 4.375 -0.024 1 1 117 . 15 1 1 A 26 26 LEU N N 26 114.238 115.307 -1.069 1 1 118 . 15 1 1 A 27 27 THR H H 27 7.708 7.572 0.136 1 1 119 . 15 1 1 A 27 27 THR HA H 27 4.492 4.367 0.125 1 1 124 . 15 1 1 A 27 27 THR CA C 27 59.438 62.405 -2.967 1 1 125 . 15 1 1 A 27 27 THR CB C 27 68.796 69.221 -0.425 1 1 127 . 15 1 1 A 27 27 THR N N 27 106.430 111.327 -4.897 1 1 128 . 15 1 1 A 28 28 ALA H H 28 8.906 7.261 1.645 1 1 129 . 15 1 1 A 28 28 ALA HA H 28 4.812 4.584 0.228 1 1 133 . 15 1 1 A 28 28 ALA CB C 28 16.724 19.522 -2.798 1 1 134 . 15 1 1 A 28 28 ALA N N 28 128.420 125.207 3.213 1 1 135 . 15 1 1 A 29 29 PRO CA C 29 59.166 62.333 -3.167 1 1 136 . 15 1 1 A 29 29 PRO CB C 29 29.865 32.582 -2.717 1 1 139 . 15 1 1 A 30 30 LEU H H 30 8.204 8.086 0.118 1 1 140 . 15 1 1 A 30 30 LEU HA H 30 4.052 4.129 -0.077 1 1 150 . 15 1 1 A 30 30 LEU N N 30 121.970 124.072 -2.102 1 1 151 . 15 1 1 A 31 31 ASP H H 31 8.720 8.636 0.084 1 1 152 . 15 1 1 A 31 31 ASP HA H 31 4.772 4.935 -0.163 1 1 155 . 15 1 1 A 31 31 ASP CA C 31 50.115 54.083 -3.968 1 1 156 . 15 1 1 A 31 31 ASP N N 31 125.105 122.917 2.188 1 1 157 . 15 1 1 A 32 32 HIS CA C 32 55.083 58.169 -3.086 1 1 158 . 15 1 1 A 32 32 HIS CB C 32 25.707 29.284 -3.577 1 1 159 . 15 1 1 A 33 33 LYS H H 33 8.589 7.800 0.789 1 1 160 . 15 1 1 A 33 33 LYS HA H 33 4.112 4.213 -0.101 1 1 167 . 15 1 1 A 33 33 LYS CB C 33 29.218 32.144 -2.926 1 1 169 . 15 1 1 A 33 33 LYS N N 33 118.920 117.989 0.931 1 1 170 . 15 1 1 A 34 34 ASP H H 34 7.420 7.571 -0.151 1 1 171 . 15 1 1 A 34 34 ASP HA H 34 4.368 4.856 -0.488 1 1 174 . 15 1 1 A 34 34 ASP N N 34 120.940 119.202 1.738 1 1 175 . 15 1 1 A 35 35 LYS H H 35 8.266 8.911 -0.645 1 1 176 . 15 1 1 A 35 35 LYS HA H 35 4.169 4.646 -0.477 1 1 183 . 15 1 1 A 35 35 LYS N N 35 121.280 119.318 1.962 1 1 184 . 15 1 1 A 36 36 GLY H H 36 8.716 7.647 1.069 1 1 185 . 15 1 1 A 36 36 GLY HA2 H 36 3.822 3.997 -0.175 1 1 186 . 15 1 1 A 36 36 GLY HA3 H 36 3.618 4.001 -0.383 1 1 187 . 15 1 1 A 36 36 GLY N N 36 111.002 105.981 5.021 1 1 188 . 15 1 1 A 37 37 LEU H H 37 8.032 7.941 0.091 1 1 189 . 15 1 1 A 37 37 LEU HA H 37 4.406 4.587 -0.181 1 1 198 . 15 1 1 A 37 37 LEU N N 37 127.683 120.467 7.216 1 1 199 . 15 1 1 A 38 38 LYS H H 38 9.190 8.830 0.360 1 1 200 . 15 1 1 A 38 38 LYS HA H 38 3.925 4.608 -0.683 1 1 205 . 15 1 1 A 38 38 LYS N N 38 132.634 118.379 14.255 1 1 206 . 15 1 1 A 39 39 SER H H 39 7.161 7.576 -0.415 1 1 207 . 15 1 1 A 39 39 SER HA H 39 5.097 4.738 0.359 1 1 210 . 15 1 1 A 39 39 SER CA C 39 54.451 57.682 -3.231 1 1 211 . 15 1 1 A 39 39 SER N N 39 110.262 111.685 -1.423 1 1 212 . 15 1 1 A 40 40 LEU H H 40 8.142 10.535 -2.393 1 1 213 . 15 1 1 A 40 40 LEU HA H 40 4.481 4.769 -0.288 1 1 223 . 15 1 1 A 40 40 LEU N N 40 122.761 122.221 0.540 1 1 224 . 15 1 1 A 41 41 THR H H 41 8.641 8.800 -0.159 1 1 225 . 15 1 1 A 41 41 THR HA H 41 4.141 4.899 -0.758 1 1 230 . 15 1 1 A 41 41 THR CA C 41 60.301 61.559 -1.258 1 1 231 . 15 1 1 A 41 41 THR CB C 41 65.862 70.476 -4.614 1 1 233 . 15 1 1 A 41 41 THR N N 41 124.142 122.057 2.085 1 1 234 . 15 1 1 A 42 42 LEU H H 42 8.586 8.601 -0.015 1 1 235 . 15 1 1 A 42 42 LEU HA H 42 4.337 5.090 -0.753 1 1 247 . 15 1 1 A 42 42 LEU N N 42 128.603 125.249 3.354 1 1 248 . 15 1 1 A 43 43 GLU H H 43 8.644 8.573 0.071 1 1 249 . 15 1 1 A 43 43 GLU HA H 43 4.663 4.189 0.474 1 1 253 . 15 1 1 A 43 43 GLU N N 43 124.180 125.654 -1.474 1 1 254 . 15 1 1 A 44 44 ASP H H 44 10.243 8.611 1.632 1 1 255 . 15 1 1 A 44 44 ASP HA H 44 4.518 5.072 -0.554 1 1 258 . 15 1 1 A 44 44 ASP CA C 44 52.879 53.065 -0.186 1 1 259 . 15 1 1 A 44 44 ASP CB C 44 37.711 44.491 -6.780 1 1 260 . 15 1 1 A 44 44 ASP N N 44 124.177 120.100 4.077 1 1 261 . 15 1 1 A 45 45 SER H H 45 8.546 8.909 -0.363 1 1 262 . 15 1 1 A 45 45 SER HA H 45 3.850 4.216 -0.366 1 1 265 . 15 1 1 A 45 45 SER CA C 45 59.588 60.733 -1.145 1 1 266 . 15 1 1 A 45 45 SER CB C 45 61.660 62.847 -1.187 1 1 267 . 15 1 1 A 45 45 SER N N 45 116.191 117.534 -1.343 1 1 268 . 15 1 1 A 46 46 ILE H H 46 6.902 7.809 -0.907 1 1 269 . 15 1 1 A 46 46 ILE HA H 46 3.874 4.485 -0.611 1 1 279 . 15 1 1 A 46 46 ILE CA C 46 57.605 60.633 -3.028 1 1 280 . 15 1 1 A 46 46 ILE CB C 46 36.694 39.032 -2.338 1 1 283 . 15 1 1 A 46 46 ILE N N 46 116.189 123.544 -7.355 1 1 284 . 15 1 1 A 47 47 SER H H 47 7.804 8.411 -0.607 1 1 285 . 15 1 1 A 47 47 SER HA H 47 4.342 5.417 -1.075 1 1 288 . 15 1 1 A 47 47 SER CA C 47 55.995 56.464 -0.469 1 1 289 . 15 1 1 A 47 47 SER N N 47 118.738 116.962 1.776 1 1 290 . 15 1 1 A 48 48 GLN H H 48 8.522 8.752 -0.230 1 1 291 . 15 1 1 A 48 48 GLN HA H 48 3.939 4.008 -0.069 1 1 296 . 15 1 1 A 48 48 GLN CA C 48 55.111 58.336 -3.225 1 1 298 . 15 1 1 A 48 48 GLN N N 48 119.475 122.911 -3.436 1 1 299 . 15 1 1 A 49 49 ASN H H 49 8.437 8.180 0.257 1 1 300 . 15 1 1 A 49 49 ASN HA H 49 4.693 4.771 -0.078 1 1 305 . 15 1 1 A 49 49 ASN CA C 49 50.839 52.268 -1.429 1 1 306 . 15 1 1 A 49 49 ASN CB C 49 35.767 38.108 -2.341 1 1 307 . 15 1 1 A 49 49 ASN N N 49 117.233 113.438 3.795 1 1 309 . 15 1 1 A 50 50 GLY H H 50 7.952 7.670 0.282 1 1 310 . 15 1 1 A 50 50 GLY HA2 H 50 4.518 4.139 0.379 1 1 311 . 15 1 1 A 50 50 GLY HA3 H 50 4.054 4.143 -0.089 1 1 312 . 15 1 1 A 50 50 GLY CA C 50 41.883 45.428 -3.545 1 1 313 . 15 1 1 A 50 50 GLY N N 50 108.751 108.186 0.565 1 1 314 . 15 1 1 A 51 51 THR H H 51 8.548 8.386 0.162 1 1 315 . 15 1 1 A 51 51 THR HA H 51 5.012 5.266 -0.254 1 1 320 . 15 1 1 A 51 51 THR CA C 51 57.026 60.547 -3.521 1 1 321 . 15 1 1 A 51 51 THR CB C 51 69.887 70.475 -0.588 1 1 323 . 15 1 1 A 51 51 THR N N 51 108.710 116.184 -7.474 1 1 324 . 15 1 1 A 52 52 LEU H H 52 9.110 8.530 0.580 1 1 325 . 15 1 1 A 52 52 LEU HA H 52 5.183 5.866 -0.683 1 1 333 . 15 1 1 A 52 52 LEU CA C 52 50.822 53.434 -2.612 1 1 335 . 15 1 1 A 52 52 LEU N N 52 124.606 123.304 1.302 1 1 336 . 15 1 1 A 53 53 THR H H 53 9.312 8.887 0.425 1 1 337 . 15 1 1 A 53 53 THR HA H 53 5.288 4.709 0.579 1 1 342 . 15 1 1 A 53 53 THR CA C 53 59.535 62.004 -2.469 1 1 343 . 15 1 1 A 53 53 THR CB C 53 66.838 70.398 -3.560 1 1 345 . 15 1 1 A 53 53 THR N N 53 125.445 120.533 4.912 1 1 346 . 15 1 1 A 54 54 LEU H H 54 8.992 8.540 0.452 1 1 347 . 15 1 1 A 54 54 LEU HA H 54 5.563 5.782 -0.219 1 1 357 . 15 1 1 A 54 54 LEU N N 54 128.814 120.697 8.117 1 1 358 . 15 1 1 A 55 55 SER H H 55 9.017 8.856 0.161 1 1 359 . 15 1 1 A 55 55 SER HA H 55 5.476 5.201 0.275 1 1 362 . 15 1 1 A 55 55 SER CA C 55 53.944 56.718 -2.774 1 1 363 . 15 1 1 A 55 55 SER CB C 55 63.384 64.476 -1.092 1 1 364 . 15 1 1 A 55 55 SER N N 55 112.964 119.501 -6.537 1 1 365 . 15 1 1 A 56 56 ALA H H 56 8.324 10.062 -1.738 1 1 366 . 15 1 1 A 56 56 ALA HA H 56 4.605 4.741 -0.136 1 1 370 . 15 1 1 A 56 56 ALA CA C 56 50.743 50.544 0.199 1 1 371 . 15 1 1 A 56 56 ALA CB C 56 21.372 21.022 0.350 1 1 372 . 15 1 1 A 56 56 ALA N N 56 123.555 128.171 -4.616 1 1 373 . 15 1 1 A 57 57 GLN H H 57 9.080 8.612 0.468 1 1 374 . 15 1 1 A 57 57 GLN HA H 57 3.884 4.513 -0.629 1 1 381 . 15 1 1 A 57 57 GLN CA C 57 53.331 55.983 -2.652 1 1 382 . 15 1 1 A 57 57 GLN CB C 57 24.659 27.529 -2.870 1 1 384 . 15 1 1 A 57 57 GLN N N 57 116.815 115.680 1.135 1 1 386 . 15 1 1 A 58 58 GLY H H 58 8.527 7.979 0.548 1 1 387 . 15 1 1 A 58 58 GLY HA2 H 58 4.168 4.038 0.130 1 1 388 . 15 1 1 A 58 58 GLY HA3 H 58 3.608 4.039 -0.431 1 1 389 . 15 1 1 A 58 58 GLY CA C 58 42.856 45.587 -2.731 1 1 390 . 15 1 1 A 58 58 GLY N N 58 105.983 107.408 -1.425 1 1 391 . 15 1 1 A 59 59 ALA H H 59 8.203 7.708 0.495 1 1 392 . 15 1 1 A 59 59 ALA HA H 59 4.811 4.603 0.208 1 1 396 . 15 1 1 A 59 59 ALA CA C 59 47.662 51.474 -3.812 1 1 397 . 15 1 1 A 59 59 ALA CB C 59 20.147 22.762 -2.615 1 1 398 . 15 1 1 A 59 59 ALA N N 59 125.153 121.460 3.693 1 1 399 . 15 1 1 A 60 60 GLU H H 60 8.154 9.033 -0.879 1 1 400 . 15 1 1 A 60 60 GLU HA H 60 5.508 5.377 0.131 1 1 404 . 15 1 1 A 60 60 GLU CA C 60 52.179 54.469 -2.290 1 1 405 . 15 1 1 A 60 60 GLU CB C 60 30.203 33.897 -3.694 1 1 406 . 15 1 1 A 60 60 GLU N N 60 117.318 116.445 0.873 1 1 407 . 15 1 1 A 61 61 LYS H H 61 8.821 8.663 0.158 1 1 408 . 15 1 1 A 61 61 LYS HA H 61 4.311 4.828 -0.517 1 1 413 . 15 1 1 A 61 61 LYS N N 61 123.743 120.761 2.982 1 1 414 . 15 1 1 A 62 62 THR H H 62 8.149 8.607 -0.458 1 1 415 . 15 1 1 A 62 62 THR HA H 62 4.928 4.494 0.434 1 1 420 . 15 1 1 A 62 62 THR CA C 62 59.427 62.900 -3.473 1 1 421 . 15 1 1 A 62 62 THR CB C 62 66.932 69.628 -2.696 1 1 422 . 15 1 1 A 62 62 THR N N 62 122.829 120.292 2.537 1 1 423 . 15 1 1 A 63 63 TYR H H 63 9.466 8.958 0.508 1 1 424 . 15 1 1 A 63 63 TYR HA H 63 4.606 5.098 -0.492 1 1 431 . 15 1 1 A 63 63 TYR CA C 63 54.508 55.086 -0.578 1 1 432 . 15 1 1 A 63 63 TYR N N 63 127.472 126.459 1.013 1 1 433 . 15 1 1 A 64 64 GLY H H 64 9.253 8.681 0.572 1 1 434 . 15 1 1 A 64 64 GLY HA2 H 64 4.670 4.064 0.606 1 1 435 . 15 1 1 A 64 64 GLY HA3 H 64 3.619 4.097 -0.478 1 1 436 . 15 1 1 A 64 64 GLY CA C 64 39.885 44.070 -4.185 1 1 437 . 15 1 1 A 64 64 GLY N N 64 110.182 112.295 -2.113 1 1 438 . 15 1 1 A 65 65 ASN H H 65 8.616 8.604 0.012 1 1 439 . 15 1 1 A 65 65 ASN HA H 65 4.109 4.384 -0.275 1 1 444 . 15 1 1 A 65 65 ASN CA C 65 53.691 54.779 -1.088 1 1 445 . 15 1 1 A 65 65 ASN N N 65 117.778 119.020 -1.242 1 1 447 . 15 1 1 A 66 66 GLY H H 66 9.053 8.784 0.269 1 1 448 . 15 1 1 A 66 66 GLY HA2 H 66 4.344 3.926 0.418 1 1 449 . 15 1 1 A 66 66 GLY HA3 H 66 3.359 3.950 -0.591 1 1 450 . 15 1 1 A 66 66 GLY CA C 66 42.431 44.946 -2.515 1 1 451 . 15 1 1 A 66 66 GLY N N 66 115.232 114.469 0.763 1 1 452 . 15 1 1 A 67 67 ASP H H 67 8.120 8.799 -0.679 1 1 453 . 15 1 1 A 67 67 ASP HA H 67 4.844 3.996 0.848 1 1 456 . 15 1 1 A 67 67 ASP N N 67 122.593 118.545 4.048 1 1 457 . 15 1 1 A 68 68 SER H H 68 8.500 7.564 0.936 1 1 458 . 15 1 1 A 68 68 SER HA H 68 5.088 4.830 0.258 1 1 461 . 15 1 1 A 68 68 SER CA C 68 54.858 56.761 -1.903 1 1 462 . 15 1 1 A 68 68 SER CB C 68 62.114 64.084 -1.970 1 1 463 . 15 1 1 A 68 68 SER N N 68 113.557 116.723 -3.166 1 1 464 . 15 1 1 A 69 69 LEU H H 69 8.989 9.720 -0.731 1 1 465 . 15 1 1 A 69 69 LEU HA H 69 4.570 5.189 -0.619 1 1 474 . 15 1 1 A 69 69 LEU N N 69 126.836 126.726 0.110 1 1 475 . 15 1 1 A 70 70 ASN H H 70 8.491 8.955 -0.464 1 1 476 . 15 1 1 A 70 70 ASN HA H 70 4.958 5.035 -0.077 1 1 479 . 15 1 1 A 70 70 ASN CB C 70 33.265 37.833 -4.568 1 1 480 . 15 1 1 A 70 70 ASN N N 70 126.343 123.634 2.709 1 1 481 . 15 1 1 A 71 71 THR H H 71 7.831 7.932 -0.101 1 1 482 . 15 1 1 A 71 71 THR HA H 71 3.759 4.699 -0.940 1 1 487 . 15 1 1 A 71 71 THR CA C 71 61.005 60.554 0.451 1 1 488 . 15 1 1 A 71 71 THR N N 71 114.742 113.477 1.265 1 1 489 . 15 1 1 A 72 72 GLY H H 72 8.880 8.279 0.601 1 1 490 . 15 1 1 A 72 72 GLY HA2 H 72 3.907 3.917 -0.010 1 1 491 . 15 1 1 A 72 72 GLY HA3 H 72 3.907 3.921 -0.014 1 1 492 . 15 1 1 A 72 72 GLY N N 72 114.976 111.010 3.966 1 1 493 . 15 1 1 A 73 73 LYS H H 73 6.604 7.524 -0.920 1 1 494 . 15 1 1 A 73 73 LYS HA H 73 4.160 4.683 -0.523 1 1 501 . 15 1 1 A 73 73 LYS N N 73 113.898 113.414 0.484 1 1 502 . 15 1 1 A 74 74 LEU H H 74 7.422 8.595 -1.173 1 1 503 . 15 1 1 A 74 74 LEU HA H 74 4.358 4.638 -0.280 1 1 513 . 15 1 1 A 74 74 LEU N N 74 117.180 121.901 -4.721 1 1 514 . 15 1 1 A 75 75 LYS H H 75 8.617 8.428 0.189 1 1 515 . 15 1 1 A 75 75 LYS HA H 75 4.079 4.745 -0.666 1 1 518 . 15 1 1 A 75 75 LYS N N 75 121.119 118.891 2.228 1 1 519 . 15 1 1 A 76 76 ASN H H 76 8.154 8.796 -0.642 1 1 520 . 15 1 1 A 76 76 ASN HA H 76 3.935 5.539 -1.604 1 1 525 . 15 1 1 A 76 76 ASN CB C 76 35.772 38.808 -3.036 1 1 526 . 15 1 1 A 76 76 ASN N N 76 122.761 119.161 3.600 1 1 527 . 15 1 1 A 77 77 ASP H H 77 9.227 7.888 1.339 1 1 528 . 15 1 1 A 77 77 ASP HA H 77 3.787 5.097 -1.310 1 1 531 . 15 1 1 A 77 77 ASP CA C 77 52.584 53.398 -0.814 1 1 532 . 15 1 1 A 77 77 ASP N N 77 114.129 117.217 -3.088 1 1 533 . 15 1 1 A 78 78 LYS H H 78 6.579 8.425 -1.846 1 1 534 . 15 1 1 A 78 78 LYS HA H 78 4.572 4.994 -0.422 1 1 539 . 15 1 1 A 78 78 LYS CA C 78 51.072 54.876 -3.804 1 1 540 . 15 1 1 A 78 78 LYS CB C 78 33.783 36.539 -2.756 1 1 541 . 15 1 1 A 78 78 LYS N N 78 114.135 122.348 -8.213 1 1 542 . 15 1 1 A 79 79 VAL H H 79 8.729 8.861 -0.132 1 1 543 . 15 1 1 A 79 79 VAL HA H 79 4.402 4.329 0.073 1 1 551 . 15 1 1 A 79 79 VAL CA C 79 59.240 61.015 -1.775 1 1 553 . 15 1 1 A 79 79 VAL N N 79 123.191 124.416 -1.225 1 1 554 . 15 1 1 A 80 80 SER H H 80 9.542 9.649 -0.107 1 1 555 . 15 1 1 A 80 80 SER HA H 80 4.636 4.894 -0.258 1 1 558 . 15 1 1 A 80 80 SER CA C 80 55.978 56.934 -0.956 1 1 559 . 15 1 1 A 80 80 SER N N 80 127.445 122.008 5.437 1 1 560 . 15 1 1 A 81 81 ARG H H 81 8.093 8.454 -0.361 1 1 561 . 15 1 1 A 81 81 ARG HA H 81 5.210 5.316 -0.106 1 1 569 . 15 1 1 A 81 81 ARG N N 81 123.743 121.327 2.416 1 1 571 . 15 1 1 A 82 82 PHE H H 82 9.312 8.023 1.289 1 1 572 . 15 1 1 A 82 82 PHE HA H 82 4.951 5.026 -0.075 1 1 577 . 15 1 1 A 82 82 PHE CA C 82 53.090 56.366 -3.276 1 1 578 . 15 1 1 A 82 82 PHE N N 82 119.529 116.511 3.018 1 1 579 . 15 1 1 A 83 83 ASP H H 83 9.122 8.877 0.245 1 1 580 . 15 1 1 A 83 83 ASP HA H 83 5.593 4.877 0.716 1 1 583 . 15 1 1 A 83 83 ASP N N 83 123.825 119.916 3.909 1 1 584 . 15 1 1 A 84 84 PHE H H 84 9.090 8.362 0.728 1 1 585 . 15 1 1 A 84 84 PHE HA H 84 6.410 6.015 0.395 1 1 592 . 15 1 1 A 84 84 PHE CA C 84 52.584 56.255 -3.671 1 1 593 . 15 1 1 A 84 84 PHE N N 84 118.862 116.691 2.171 1 1 594 . 15 1 1 A 85 85 ILE H H 85 8.441 8.306 0.135 1 1 595 . 15 1 1 A 85 85 ILE HA H 85 4.662 5.165 -0.503 1 1 605 . 15 1 1 A 85 85 ILE CB C 85 39.939 41.013 -1.074 1 1 608 . 15 1 1 A 85 85 ILE N N 85 118.049 119.931 -1.882 1 1 609 . 15 1 1 A 86 86 ARG H H 86 8.983 8.635 0.348 1 1 610 . 15 1 1 A 86 86 ARG HA H 86 5.591 4.632 0.959 1 1 616 . 15 1 1 A 86 86 ARG N N 86 127.006 127.388 -0.382 1 1 618 . 15 1 1 A 87 87 GLN H H 87 8.643 9.172 -0.529 1 1 619 . 15 1 1 A 87 87 GLN HA H 87 5.630 5.164 0.466 1 1 626 . 15 1 1 A 87 87 GLN CA C 87 51.512 54.239 -2.727 1 1 627 . 15 1 1 A 87 87 GLN N N 87 124.142 123.601 0.541 1 1 629 . 15 1 1 A 88 88 ILE H H 88 8.617 8.703 -0.086 1 1 630 . 15 1 1 A 88 88 ILE HA H 88 4.690 4.794 -0.104 1 1 637 . 15 1 1 A 88 88 ILE CA C 88 56.995 60.664 -3.669 1 1 638 . 15 1 1 A 88 88 ILE CB C 88 39.927 40.240 -0.313 1 1 641 . 15 1 1 A 88 88 ILE N N 88 116.353 122.191 -5.838 1 1 642 . 15 1 1 A 89 89 GLU H H 89 8.298 9.005 -0.707 1 1 643 . 15 1 1 A 89 89 GLU HA H 89 5.100 5.858 -0.758 1 1 646 . 15 1 1 A 89 89 GLU CA C 89 52.204 54.939 -2.735 1 1 647 . 15 1 1 A 89 89 GLU CB C 89 27.325 33.142 -5.817 1 1 648 . 15 1 1 A 89 89 GLU N N 89 124.458 129.457 -4.999 1 1 649 . 15 1 1 A 90 90 VAL H H 90 8.957 8.963 -0.006 1 1 650 . 15 1 1 A 90 90 VAL HA H 90 4.169 4.606 -0.437 1 1 658 . 15 1 1 A 90 90 VAL CA C 90 58.664 60.195 -1.531 1 1 659 . 15 1 1 A 90 90 VAL CB C 90 31.861 32.891 -1.030 1 1 660 . 15 1 1 A 90 90 VAL N N 90 127.580 126.848 0.732 1 1 661 . 15 1 1 A 91 91 ASP H H 91 9.369 8.636 0.733 1 1 662 . 15 1 1 A 91 91 ASP HA H 91 4.287 4.612 -0.325 1 1 665 . 15 1 1 A 91 91 ASP CA C 91 52.389 54.773 -2.384 1 1 666 . 15 1 1 A 91 91 ASP CB C 91 36.409 40.426 -4.017 1 1 667 . 15 1 1 A 91 91 ASP N N 91 129.411 123.941 5.470 1 1 668 . 15 1 1 A 92 92 GLY H H 92 8.552 7.444 1.108 1 1 669 . 15 1 1 A 92 92 GLY HA2 H 92 4.090 4.092 -0.002 1 1 670 . 15 1 1 A 92 92 GLY HA3 H 92 3.618 4.092 -0.474 1 1 671 . 15 1 1 A 92 92 GLY CA C 92 42.836 45.628 -2.792 1 1 672 . 15 1 1 A 92 92 GLY N N 92 103.862 105.401 -1.539 1 1 673 . 15 1 1 A 93 93 GLN H H 93 7.808 7.664 0.144 1 1 674 . 15 1 1 A 93 93 GLN HA H 93 4.578 4.831 -0.253 1 1 679 . 15 1 1 A 93 93 GLN CA C 93 50.918 54.319 -3.401 1 1 680 . 15 1 1 A 93 93 GLN CB C 93 28.602 30.942 -2.340 1 1 682 . 15 1 1 A 93 93 GLN N N 93 120.412 118.396 2.016 1 1 683 . 15 1 1 A 94 94 LEU H H 94 8.414 8.501 -0.087 1 1 684 . 15 1 1 A 94 94 LEU HA H 94 4.704 4.241 0.463 1 1 693 . 15 1 1 A 94 94 LEU CB C 94 39.873 42.392 -2.519 1 1 696 . 15 1 1 A 94 94 LEU N N 94 125.061 122.358 2.703 1 1 697 . 15 1 1 A 95 95 ILE H H 95 9.181 8.601 0.580 1 1 698 . 15 1 1 A 95 95 ILE HA H 95 4.371 4.854 -0.483 1 1 708 . 15 1 1 A 95 95 ILE CA C 95 63.319 60.764 2.555 1 1 709 . 15 1 1 A 95 95 ILE CB C 95 37.407 39.639 -2.232 1 1 711 . 15 1 1 A 95 95 ILE N N 95 127.724 121.694 6.030 1 1 712 . 15 1 1 A 96 96 THR H H 96 8.730 7.366 1.364 1 1 713 . 15 1 1 A 96 96 THR HA H 96 4.411 4.378 0.033 1 1 718 . 15 1 1 A 96 96 THR CA C 96 60.344 62.927 -2.583 1 1 719 . 15 1 1 A 96 96 THR CB C 96 59.719 69.795 -10.076 1 1 720 . 15 1 1 A 96 96 THR N N 96 124.240 118.701 5.539 1 1 721 . 15 1 1 A 97 97 LEU H H 97 8.790 8.436 0.354 1 1 722 . 15 1 1 A 97 97 LEU HA H 97 4.400 5.055 -0.655 1 1 732 . 15 1 1 A 97 97 LEU N N 97 126.147 124.494 1.653 1 1 733 . 15 1 1 A 98 98 GLU H H 98 7.596 8.773 -1.177 1 1 734 . 15 1 1 A 98 98 GLU HA H 98 5.102 5.105 -0.003 1 1 739 . 15 1 1 A 98 98 GLU N N 98 116.937 123.442 -6.505 1 1 740 . 15 1 1 A 99 99 SER H H 99 8.906 8.644 0.262 1 1 741 . 15 1 1 A 99 99 SER HA H 99 4.504 5.283 -0.779 1 1 744 . 15 1 1 A 99 99 SER CA C 99 54.010 56.099 -2.089 1 1 745 . 15 1 1 A 99 99 SER CB C 99 63.876 66.069 -2.193 1 1 746 . 15 1 1 A 99 99 SER N N 99 117.823 115.919 1.904 1 1 747 . 15 1 1 A 100 100 GLY H H 100 7.250 8.104 -0.854 1 1 748 . 15 1 1 A 100 100 GLY HA2 H 100 4.872 3.816 1.056 1 1 749 . 15 1 1 A 100 100 GLY HA3 H 100 3.731 3.907 -0.176 1 1 750 . 15 1 1 A 100 100 GLY N N 100 109.436 107.318 2.118 1 1 751 . 15 1 1 A 101 101 GLU H H 101 9.661 9.019 0.642 1 1 752 . 15 1 1 A 101 101 GLU HA H 101 5.643 4.657 0.986 1 1 757 . 15 1 1 A 101 101 GLU CA C 101 52.584 54.348 -1.764 1 1 758 . 15 1 1 A 101 101 GLU CB C 101 31.750 32.923 -1.173 1 1 759 . 15 1 1 A 101 101 GLU N N 101 126.793 119.802 6.991 1 1 760 . 15 1 1 A 102 102 PHE H H 102 10.441 8.760 1.681 1 1 761 . 15 1 1 A 102 102 PHE HA H 102 5.248 5.252 -0.004 1 1 768 . 15 1 1 A 102 102 PHE CA C 102 53.537 56.132 -2.595 1 1 769 . 15 1 1 A 102 102 PHE N N 102 131.837 120.104 11.733 1 1 770 . 15 1 1 A 103 103 GLN H H 103 9.135 8.915 0.220 1 1 771 . 15 1 1 A 103 103 GLN HA H 103 5.205 4.783 0.422 1 1 776 . 15 1 1 A 103 103 GLN CA C 103 50.925 54.700 -3.775 1 1 777 . 15 1 1 A 103 103 GLN N N 103 127.720 124.737 2.983 1 1 778 . 15 1 1 A 104 104 VAL H H 104 8.937 8.919 0.018 1 1 779 . 15 1 1 A 104 104 VAL HA H 104 4.780 4.968 -0.188 1 1 787 . 15 1 1 A 104 104 VAL CA C 104 57.086 61.230 -4.144 1 1 789 . 15 1 1 A 104 104 VAL N N 104 120.097 126.158 -6.061 1 1 790 . 15 1 1 A 105 105 TYR H H 105 9.108 9.832 -0.724 1 1 791 . 15 1 1 A 105 105 TYR HA H 105 4.834 5.265 -0.431 1 1 798 . 15 1 1 A 105 105 TYR CA C 105 54.486 56.834 -2.348 1 1 799 . 15 1 1 A 105 105 TYR N N 105 128.426 125.215 3.211 1 1 800 . 15 1 1 A 106 106 LYS H H 106 5.945 9.342 -3.397 1 1 805 . 15 1 1 A 106 106 LYS N N 106 129.163 124.558 4.605 1 1 806 . 15 1 1 A 107 107 GLN H H 107 8.526 8.011 0.515 1 1 807 . 15 1 1 A 107 107 GLN HA H 107 5.160 4.746 0.414 1 1 812 . 15 1 1 A 107 107 GLN CA C 107 52.584 54.036 -1.452 1 1 813 . 15 1 1 A 107 107 GLN CB C 107 26.175 29.289 -3.114 1 1 814 . 15 1 1 A 107 107 GLN N N 107 125.978 122.038 3.940 1 1 815 . 15 1 1 A 108 108 SER H H 108 8.621 8.570 0.051 1 1 816 . 15 1 1 A 108 108 SER HA H 108 4.403 5.104 -0.701 1 1 819 . 15 1 1 A 108 108 SER CA C 108 58.521 61.933 -3.412 1 1 820 . 15 1 1 A 108 108 SER CB C 108 60.737 63.511 -2.774 1 1 821 . 15 1 1 A 108 108 SER N N 108 117.542 113.682 3.860 1 1 822 . 15 1 1 A 109 109 HIS H H 109 10.381 8.112 2.269 1 1 823 . 15 1 1 A 109 109 HIS HA H 109 4.594 4.845 -0.251 1 1 828 . 15 1 1 A 109 109 HIS CA C 109 51.743 55.487 -3.744 1 1 829 . 15 1 1 A 109 109 HIS CB C 109 27.174 30.100 -2.926 1 1 830 . 15 1 1 A 109 109 HIS N N 109 118.449 114.310 4.139 1 1 831 . 15 1 1 A 110 110 SER H H 110 7.366 7.872 -0.506 1 1 832 . 15 1 1 A 110 110 SER HA H 110 4.870 4.853 0.017 1 1 835 . 15 1 1 A 110 110 SER CB C 110 62.986 66.678 -3.692 1 1 836 . 15 1 1 A 110 110 SER N N 110 113.397 112.809 0.588 1 1 837 . 15 1 1 A 111 111 ALA H H 111 8.541 8.154 0.387 1 1 838 . 15 1 1 A 111 111 ALA HA H 111 4.826 5.250 -0.424 1 1 842 . 15 1 1 A 111 111 ALA CA C 111 49.015 52.066 -3.051 1 1 843 . 15 1 1 A 111 111 ALA CB C 111 20.256 22.065 -1.809 1 1 844 . 15 1 1 A 111 111 ALA N N 111 117.786 121.030 -3.244 1 1 845 . 15 1 1 A 112 112 LEU H H 112 8.529 9.585 -1.056 1 1 846 . 15 1 1 A 112 112 LEU HA H 112 5.680 5.224 0.456 1 1 855 . 15 1 1 A 112 112 LEU CA C 112 51.818 52.997 -1.179 1 1 856 . 15 1 1 A 112 112 LEU N N 112 116.345 119.531 -3.186 1 1 857 . 15 1 1 A 113 113 THR H H 113 8.758 8.683 0.075 1 1 858 . 15 1 1 A 113 113 THR HA H 113 5.563 5.406 0.157 1 1 863 . 15 1 1 A 113 113 THR CA C 113 54.458 59.794 -5.336 1 1 864 . 15 1 1 A 113 113 THR CB C 113 68.586 70.986 -2.400 1 1 866 . 15 1 1 A 113 113 THR N N 113 110.469 117.527 -7.058 1 1 867 . 15 1 1 A 114 114 ALA H H 114 8.829 9.280 -0.451 1 1 868 . 15 1 1 A 114 114 ALA HA H 114 4.466 4.877 -0.411 1 1 872 . 15 1 1 A 114 114 ALA CA C 114 48.886 51.684 -2.798 1 1 873 . 15 1 1 A 114 114 ALA CB C 114 21.583 22.535 -0.952 1 1 874 . 15 1 1 A 114 114 ALA N N 114 121.456 124.930 -3.474 1 1 875 . 15 1 1 A 115 115 LEU H H 115 8.407 8.325 0.082 1 1 876 . 15 1 1 A 115 115 LEU HA H 115 4.814 3.951 0.863 1 1 886 . 15 1 1 A 115 115 LEU N N 115 119.223 123.789 -4.566 1 1 887 . 15 1 1 A 116 116 GLN H H 116 9.720 8.051 1.669 1 1 888 . 15 1 1 A 116 116 GLN HA H 116 5.312 4.236 1.076 1 1 893 . 15 1 1 A 116 116 GLN CA C 116 50.544 54.188 -3.644 1 1 894 . 15 1 1 A 116 116 GLN N N 116 127.827 122.239 5.588 1 1 895 . 15 1 1 A 117 117 THR H H 117 9.663 9.642 0.021 1 1 896 . 15 1 1 A 117 117 THR HA H 117 4.198 4.304 -0.106 1 1 901 . 15 1 1 A 117 117 THR CA C 117 64.037 62.449 1.588 1 1 902 . 15 1 1 A 117 117 THR CB C 117 66.868 69.461 -2.593 1 1 904 . 15 1 1 A 117 117 THR N N 117 128.929 121.140 7.789 1 1 905 . 15 1 1 A 118 118 GLU H H 118 9.486 8.968 0.518 1 1 906 . 15 1 1 A 118 118 GLU HA H 118 4.885 4.460 0.425 1 1 911 . 15 1 1 A 118 118 GLU N N 118 123.497 123.896 -0.399 1 1 912 . 15 1 1 A 119 119 GLN H H 119 8.076 7.340 0.736 1 1 913 . 15 1 1 A 119 119 GLN HA H 119 5.331 4.850 0.481 1 1 916 . 15 1 1 A 119 119 GLN CA C 119 51.858 54.744 -2.886 1 1 917 . 15 1 1 A 119 119 GLN N N 119 118.023 116.313 1.710 1 1 918 . 15 1 1 A 120 120 GLU H H 120 9.078 8.292 0.786 1 1 919 . 15 1 1 A 120 120 GLU HA H 120 5.071 5.064 0.007 1 1 924 . 15 1 1 A 120 120 GLU N N 120 118.433 120.932 -2.499 1 1 925 . 15 1 1 A 121 121 GLN H H 121 7.711 8.452 -0.741 1 1 926 . 15 1 1 A 121 121 GLN HA H 121 4.430 5.542 -1.112 1 1 933 . 15 1 1 A 121 121 GLN CA C 121 53.996 55.966 -1.970 1 1 934 . 15 1 1 A 121 121 GLN CB C 121 27.158 30.047 -2.889 1 1 936 . 15 1 1 A 121 121 GLN N N 121 122.412 122.345 0.067 1 1 938 . 15 1 1 A 122 122 ASP H H 122 8.675 10.790 -2.115 1 1 939 . 15 1 1 A 122 122 ASP HA H 122 4.632 5.130 -0.498 1 1 942 . 15 1 1 A 122 122 ASP CA C 122 48.797 51.385 -2.588 1 1 943 . 15 1 1 A 122 122 ASP CB C 122 39.852 42.817 -2.965 1 1 944 . 15 1 1 A 122 122 ASP N N 122 128.625 126.142 2.483 1 1 945 . 15 1 1 A 123 123 PRO CA C 123 61.579 63.852 -2.273 1 1 946 . 15 1 1 A 123 123 PRO CB C 123 29.597 32.482 -2.885 1 1 948 . 15 1 1 A 124 124 GLU H H 124 8.297 9.721 -1.424 1 1 949 . 15 1 1 A 124 124 GLU HA H 124 4.196 4.628 -0.432 1 1 954 . 15 1 1 A 124 124 GLU CA C 124 53.025 56.342 -3.317 1 1 955 . 15 1 1 A 124 124 GLU CB C 124 27.927 30.774 -2.847 1 1 957 . 15 1 1 A 124 124 GLU N N 124 115.538 118.176 -2.638 1 1 958 . 15 1 1 A 125 125 HIS H H 125 7.419 7.701 -0.282 1 1 959 . 15 1 1 A 125 125 HIS HA H 125 4.833 4.816 0.017 1 1 964 . 15 1 1 A 125 125 HIS CA C 125 51.886 56.054 -4.168 1 1 965 . 15 1 1 A 125 125 HIS CB C 125 26.387 30.380 -3.993 1 1 966 . 15 1 1 A 125 125 HIS N N 125 117.464 116.080 1.384 1 1 967 . 15 1 1 A 126 126 SER H H 126 8.441 8.902 -0.461 1 1 968 . 15 1 1 A 126 126 SER HA H 126 4.261 4.216 0.045 1 1 971 . 15 1 1 A 126 126 SER CA C 126 57.988 62.241 -4.253 1 1 972 . 15 1 1 A 126 126 SER N N 126 117.954 116.291 1.663 1 1 973 . 15 1 1 A 127 127 GLU H H 127 9.221 7.679 1.542 1 1 974 . 15 1 1 A 127 127 GLU HA H 127 4.366 4.430 -0.064 1 1 979 . 15 1 1 A 127 127 GLU CA C 127 53.707 55.290 -1.583 1 1 980 . 15 1 1 A 127 127 GLU CB C 127 25.492 29.561 -4.069 1 1 981 . 15 1 1 A 127 127 GLU N N 127 120.404 119.705 0.699 1 1 982 . 15 1 1 A 128 128 LYS H H 128 8.262 8.327 -0.065 1 1 983 . 15 1 1 A 128 128 LYS HA H 128 4.661 5.152 -0.491 1 1 990 . 15 1 1 A 128 128 LYS CA C 128 52.264 54.899 -2.635 1 1 991 . 15 1 1 A 128 128 LYS CB C 128 32.404 33.650 -1.246 1 1 994 . 15 1 1 A 128 128 LYS N N 128 122.166 120.938 1.228 1 1 995 . 15 1 1 A 129 129 MET H H 129 8.242 8.640 -0.398 1 1 996 . 15 1 1 A 129 129 MET HA H 129 5.012 5.236 -0.224 1 1 1001 . 15 1 1 A 129 129 MET CA C 129 50.958 53.802 -2.844 1 1 1003 . 15 1 1 A 129 129 MET N N 129 119.422 118.264 1.158 1 1 1004 . 15 1 1 A 130 130 VAL H H 130 9.200 8.534 0.666 1 1 1005 . 15 1 1 A 130 130 VAL HA H 130 4.609 4.749 -0.140 1 1 1013 . 15 1 1 A 130 130 VAL CA C 130 56.296 60.492 -4.196 1 1 1014 . 15 1 1 A 130 130 VAL CB C 130 32.606 36.369 -3.763 1 1 1015 . 15 1 1 A 130 130 VAL N N 130 118.290 125.886 -7.596 1 1 1016 . 15 1 1 A 131 131 ALA H H 131 8.368 8.828 -0.460 1 1 1017 . 15 1 1 A 131 131 ALA HA H 131 4.654 5.209 -0.555 1 1 1021 . 15 1 1 A 131 131 ALA CA C 131 49.739 50.506 -0.767 1 1 1022 . 15 1 1 A 131 131 ALA CB C 131 15.351 20.971 -5.620 1 1 1023 . 15 1 1 A 131 131 ALA N N 131 126.734 125.558 1.176 1 1 1024 . 15 1 1 A 132 132 LYS H H 132 7.732 8.671 -0.939 1 1 1025 . 15 1 1 A 132 132 LYS HA H 132 4.171 4.802 -0.631 1 1 1028 . 15 1 1 A 132 132 LYS N N 132 127.309 122.061 5.248 1 1 1029 . 15 1 1 A 133 133 ARG H H 133 8.193 8.501 -0.308 1 1 1030 . 15 1 1 A 133 133 ARG HA H 133 5.073 5.121 -0.048 1 1 1038 . 15 1 1 A 133 133 ARG N N 133 122.190 120.854 1.336 1 1 1040 . 15 1 1 A 134 134 ARG H H 134 7.539 9.128 -1.589 1 1 1041 . 15 1 1 A 134 134 ARG HA H 134 4.667 4.995 -0.328 1 1 1049 . 15 1 1 A 134 134 ARG CA C 134 52.584 54.972 -2.388 1 1 1050 . 15 1 1 A 134 134 ARG CB C 134 31.325 32.375 -1.050 1 1 1052 . 15 1 1 A 134 134 ARG N N 134 121.632 125.477 -3.845 1 1 1054 . 15 1 1 A 135 135 PHE H H 135 8.816 9.101 -0.285 1 1 1055 . 15 1 1 A 135 135 PHE HA H 135 5.680 5.564 0.116 1 1 1062 . 15 1 1 A 135 135 PHE N N 135 125.107 127.056 -1.949 1 1 1063 . 15 1 1 A 136 136 ARG H H 136 7.741 9.206 -1.465 1 1 1064 . 15 1 1 A 136 136 ARG HA H 136 4.402 4.937 -0.535 1 1 1068 . 15 1 1 A 136 136 ARG N N 136 125.640 128.583 -2.943 1 1 1070 . 15 1 1 A 137 137 ILE H H 137 8.556 8.627 -0.071 1 1 1071 . 15 1 1 A 137 137 ILE HA H 137 3.912 5.090 -1.178 1 1 1076 . 15 1 1 A 137 137 ILE CA C 137 55.676 59.389 -3.713 1 1 1079 . 15 1 1 A 137 137 ILE N N 137 122.891 122.998 -0.107 1 1 1080 . 15 1 1 A 138 138 GLY H H 138 8.676 8.347 0.329 1 1 1081 . 15 1 1 A 138 138 GLY HA2 H 138 3.740 4.183 -0.443 1 1 1082 . 15 1 1 A 138 138 GLY HA3 H 138 2.982 4.200 -1.218 1 1 1083 . 15 1 1 A 138 138 GLY CA C 138 41.908 45.326 -3.418 1 1 1084 . 15 1 1 A 138 138 GLY N N 138 117.058 114.765 2.293 1 1 1085 . 15 1 1 A 139 139 ASP H H 139 7.858 8.951 -1.093 1 1 1086 . 15 1 1 A 139 139 ASP HA H 139 4.753 5.314 -0.561 1 1 1089 . 15 1 1 A 139 139 ASP CA C 139 52.584 53.039 -0.455 1 1 1090 . 15 1 1 A 139 139 ASP CB C 139 43.062 43.664 -0.602 1 1 1091 . 15 1 1 A 139 139 ASP N N 139 124.516 124.830 -0.314 1 1 1092 . 15 1 1 A 140 140 ILE H H 140 8.354 8.868 -0.514 1 1 1093 . 15 1 1 A 140 140 ILE HA H 140 4.473 4.547 -0.074 1 1 1103 . 15 1 1 A 140 140 ILE CB C 140 36.173 38.490 -2.317 1 1 1105 . 15 1 1 A 140 140 ILE N N 140 120.679 123.933 -3.254 1 1 1106 . 15 1 1 A 141 141 ALA H H 141 8.708 8.160 0.548 1 1 1107 . 15 1 1 A 141 141 ALA HA H 141 4.862 4.135 0.727 1 1 1111 . 15 1 1 A 141 141 ALA CA C 141 47.968 52.766 -4.798 1 1 1112 . 15 1 1 A 141 141 ALA CB C 141 21.733 18.945 2.788 1 1 1113 . 15 1 1 A 141 141 ALA N N 141 130.144 130.402 -0.258 1 1 1114 . 15 1 1 A 142 142 GLY H H 142 7.888 8.581 -0.693 1 1 1115 . 15 1 1 A 142 142 GLY HA2 H 142 4.519 3.925 0.594 1 1 1116 . 15 1 1 A 142 142 GLY HA3 H 142 3.634 3.948 -0.314 1 1 1117 . 15 1 1 A 142 142 GLY N N 142 102.272 109.954 -7.682 1 1 1118 . 15 1 1 A 143 143 GLU H H 143 8.068 8.225 -0.157 1 1 1119 . 15 1 1 A 143 143 GLU HA H 143 4.577 4.545 0.032 1 1 1124 . 15 1 1 A 143 143 GLU N N 143 120.569 115.049 5.520 1 1 1125 . 15 1 1 A 144 144 HIS H H 144 8.478 7.993 0.485 1 1 1126 . 15 1 1 A 144 144 HIS HA H 144 4.968 4.686 0.282 1 1 1131 . 15 1 1 A 144 144 HIS N N 144 124.275 118.799 5.476 1 1 1132 . 15 1 1 A 145 145 THR H H 145 9.031 8.684 0.347 1 1 1133 . 15 1 1 A 145 145 THR HA H 145 4.025 5.073 -1.048 1 1 1138 . 15 1 1 A 145 145 THR CA C 145 61.247 60.544 0.703 1 1 1139 . 15 1 1 A 145 145 THR CB C 145 65.181 70.258 -5.077 1 1 1141 . 15 1 1 A 145 145 THR N N 145 125.828 114.474 11.354 1 1 1142 . 15 1 1 A 146 146 SER H H 146 9.077 8.876 0.201 1 1 1143 . 15 1 1 A 146 146 SER HA H 146 4.684 4.771 -0.087 1 1 1145 . 15 1 1 A 146 146 SER CA C 146 56.067 58.055 -1.988 1 1 1146 . 15 1 1 A 146 146 SER CB C 146 60.510 64.021 -3.511 1 1 1147 . 15 1 1 A 146 146 SER N N 146 124.154 118.134 6.020 1 1 1148 . 15 1 1 A 147 147 PHE H H 147 9.049 9.078 -0.029 1 1 1149 . 15 1 1 A 147 147 PHE HA H 147 4.022 4.427 -0.405 1 1 1154 . 15 1 1 A 147 147 PHE N N 147 127.670 126.613 1.057 1 1 1155 . 15 1 1 A 148 148 ASP H H 148 8.504 8.429 0.075 1 1 1156 . 15 1 1 A 148 148 ASP HA H 148 4.422 4.488 -0.066 1 1 1158 . 15 1 1 A 148 148 ASP CA C 148 52.584 57.364 -4.780 1 1 1159 . 15 1 1 A 148 148 ASP CB C 148 37.800 41.045 -3.245 1 1 1160 . 15 1 1 A 148 148 ASP N N 148 114.377 120.365 -5.988 1 1 1161 . 15 1 1 A 149 149 LYS H H 149 7.380 8.329 -0.949 1 1 1162 . 15 1 1 A 149 149 LYS HA H 149 4.487 4.326 0.161 1 1 1171 . 15 1 1 A 149 149 LYS CA C 149 51.735 56.582 -4.847 1 1 1172 . 15 1 1 A 149 149 LYS CB C 149 30.162 32.477 -2.315 1 1 1175 . 15 1 1 A 149 149 LYS N N 149 119.137 116.813 2.324 1 1 1176 . 15 1 1 A 150 150 LEU H H 150 6.886 8.223 -1.337 1 1 1177 . 15 1 1 A 150 150 LEU HA H 150 3.996 4.470 -0.474 1 1 1186 . 15 1 1 A 150 150 LEU CA C 150 50.502 52.981 -2.479 1 1 1187 . 15 1 1 A 150 150 LEU N N 150 120.614 120.531 0.083 1 1 1188 . 15 1 1 A 151 151 PRO CB C 151 29.567 30.500 -0.933 1 1 1190 . 15 1 1 A 152 152 LYS H H 152 8.076 8.548 -0.472 1 1 1191 . 15 1 1 A 152 152 LYS HA H 152 4.346 4.709 -0.363 1 1 1195 . 15 1 1 A 152 152 LYS CA C 152 53.182 55.072 -1.890 1 1 1196 . 15 1 1 A 152 152 LYS CB C 152 31.487 32.890 -1.403 1 1 1198 . 15 1 1 A 152 152 LYS N N 152 118.133 123.259 -5.126 1 1 1199 . 15 1 1 A 153 153 ASP H H 153 7.982 8.650 -0.668 1 1 1200 . 15 1 1 A 153 153 ASP HA H 153 4.402 4.558 -0.156 1 1 1203 . 15 1 1 A 153 153 ASP CA C 153 52.584 54.111 -1.527 1 1 1204 . 15 1 1 A 153 153 ASP CB C 153 37.762 38.927 -1.165 1 1 1205 . 15 1 1 A 153 153 ASP N N 153 115.735 124.458 -8.723 1 1 1206 . 15 1 1 A 154 154 VAL H H 154 6.987 8.986 -1.999 1 1 1207 . 15 1 1 A 154 154 VAL HA H 154 4.406 4.880 -0.474 1 1 1215 . 15 1 1 A 154 154 VAL CA C 154 58.408 60.138 -1.730 1 1 1216 . 15 1 1 A 154 154 VAL CB C 154 32.617 35.155 -2.538 1 1 1217 . 15 1 1 A 154 154 VAL N N 154 116.266 119.810 -3.544 1 1 1218 . 15 1 1 A 155 155 MET H H 155 8.444 8.774 -0.330 1 1 1219 . 15 1 1 A 155 155 MET HA H 155 5.416 5.079 0.337 1 1 1224 . 15 1 1 A 155 155 MET CA C 155 51.183 54.077 -2.894 1 1 1226 . 15 1 1 A 155 155 MET N N 155 124.950 123.785 1.165 1 1 1227 . 15 1 1 A 156 156 ALA H H 156 9.226 8.788 0.438 1 1 1228 . 15 1 1 A 156 156 ALA HA H 156 4.693 4.927 -0.234 1 1 1232 . 15 1 1 A 156 156 ALA CA C 156 48.379 50.214 -1.835 1 1 1233 . 15 1 1 A 156 156 ALA CB C 156 21.051 20.230 0.821 1 1 1234 . 15 1 1 A 156 156 ALA N N 156 129.938 126.116 3.822 1 1 1235 . 15 1 1 A 157 157 THR H H 157 8.554 8.780 -0.226 1 1 1236 . 15 1 1 A 157 157 THR HA H 157 4.839 4.232 0.607 1 1 1241 . 15 1 1 A 157 157 THR CA C 157 59.555 62.718 -3.163 1 1 1242 . 15 1 1 A 157 157 THR CB C 157 68.575 69.303 -0.728 1 1 1244 . 15 1 1 A 157 157 THR N N 157 118.815 120.223 -1.408 1 1 1245 . 15 1 1 A 158 158 TYR H H 158 9.974 9.642 0.332 1 1 1246 . 15 1 1 A 158 158 TYR HA H 158 4.435 5.344 -0.909 1 1 1253 . 15 1 1 A 158 158 TYR N N 158 126.958 126.095 0.863 1 1 1254 . 15 1 1 A 159 159 ARG H H 159 8.909 8.892 0.017 1 1 1255 . 15 1 1 A 159 159 ARG HA H 159 5.444 5.314 0.130 1 1 1263 . 15 1 1 A 159 159 ARG CA C 159 51.933 54.710 -2.777 1 1 1264 . 15 1 1 A 159 159 ARG N N 159 121.721 120.600 1.121 1 1 1266 . 15 1 1 A 160 160 GLY H H 160 8.910 8.480 0.430 1 1 1267 . 15 1 1 A 160 160 GLY HA2 H 160 4.904 4.191 0.713 1 1 1268 . 15 1 1 A 160 160 GLY HA3 H 160 4.484 4.452 0.032 1 1 1269 . 15 1 1 A 160 160 GLY N N 160 113.921 107.690 6.231 1 1 1270 . 15 1 1 A 161 161 THR H H 161 9.110 8.709 0.401 1 1 1271 . 15 1 1 A 161 161 THR HA H 161 4.810 5.158 -0.348 1 1 1276 . 15 1 1 A 161 161 THR CA C 161 59.603 61.382 -1.779 1 1 1277 . 15 1 1 A 161 161 THR CB C 161 69.909 72.553 -2.644 1 1 1279 . 15 1 1 A 161 161 THR N N 161 126.813 115.882 10.931 1 1 1280 . 15 1 1 A 162 162 ALA H H 162 7.137 8.974 -1.837 1 1 1281 . 15 1 1 A 162 162 ALA HA H 162 5.361 5.462 -0.101 1 1 1285 . 15 1 1 A 162 162 ALA CA C 162 46.573 50.576 -4.003 1 1 1286 . 15 1 1 A 162 162 ALA CB C 162 20.959 21.429 -0.470 1 1 1287 . 15 1 1 A 162 162 ALA N N 162 128.111 127.660 0.451 1 1 1288 . 15 1 1 A 163 163 PHE H H 163 8.587 9.161 -0.574 1 1 1289 . 15 1 1 A 163 163 PHE HA H 163 5.538 6.288 -0.750 1 1 1296 . 15 1 1 A 163 163 PHE N N 163 117.349 121.507 -4.158 1 1 1297 . 15 1 1 A 164 164 GLY H H 164 8.650 8.747 -0.097 1 1 1298 . 15 1 1 A 164 164 GLY HA2 H 164 4.210 4.005 0.205 1 1 1299 . 15 1 1 A 164 164 GLY HA3 H 164 3.285 4.234 -0.949 1 1 1300 . 15 1 1 A 164 164 GLY CA C 164 40.377 44.113 -3.736 1 1 1301 . 15 1 1 A 164 164 GLY N N 164 108.839 107.392 1.447 1 1 1302 . 15 1 1 A 165 165 SER H H 165 7.684 9.701 -2.017 1 1 1303 . 15 1 1 A 165 165 SER HA H 165 3.458 4.591 -1.133 1 1 1304 . 15 1 1 A 165 165 SER N N 165 116.037 117.881 -1.844 1 1 1305 . 15 1 1 A 166 166 ASP H H 166 9.718 8.130 1.588 1 1 1306 . 15 1 1 A 166 166 ASP HA H 166 4.281 4.960 -0.679 1 1 1309 . 15 1 1 A 166 166 ASP CA C 166 52.584 53.212 -0.628 1 1 1310 . 15 1 1 A 166 166 ASP N N 166 125.166 120.159 5.007 1 1 1311 . 15 1 1 A 167 167 ASP H H 167 7.655 7.698 -0.043 1 1 1312 . 15 1 1 A 167 167 ASP HA H 167 4.666 4.913 -0.247 1 1 1315 . 15 1 1 A 167 167 ASP CB C 167 38.948 43.858 -4.910 1 1 1316 . 15 1 1 A 167 167 ASP N N 167 117.491 120.266 -2.775 1 1 1317 . 15 1 1 A 168 168 ALA H H 168 8.585 8.578 0.007 1 1 1318 . 15 1 1 A 168 168 ALA HA H 168 5.012 4.246 0.766 1 1 1322 . 15 1 1 A 168 168 ALA CA C 168 47.485 52.537 -5.052 1 1 1323 . 15 1 1 A 168 168 ALA N N 168 128.834 123.640 5.194 1 1 1324 . 15 1 1 A 169 169 GLY H H 169 8.472 8.159 0.313 1 1 1325 . 15 1 1 A 169 169 GLY HA2 H 169 4.404 3.683 0.721 1 1 1326 . 15 1 1 A 169 169 GLY HA3 H 169 4.051 3.712 0.339 1 1 1327 . 15 1 1 A 169 169 GLY CA C 169 43.257 46.537 -3.280 1 1 1328 . 15 1 1 A 169 169 GLY N N 169 107.133 106.393 0.740 1 1 1329 . 15 1 1 A 170 170 GLY H H 170 7.229 8.426 -1.197 1 1 1330 . 15 1 1 A 170 170 GLY HA2 H 170 4.223 3.400 0.823 1 1 1331 . 15 1 1 A 170 170 GLY HA3 H 170 3.781 3.958 -0.177 1 1 1332 . 15 1 1 A 170 170 GLY CA C 170 43.310 45.629 -2.319 1 1 1333 . 15 1 1 A 170 170 GLY N N 170 107.542 111.842 -4.300 1 1 1334 . 15 1 1 A 171 171 LYS H H 171 9.641 7.617 2.024 1 1 1335 . 15 1 1 A 171 171 LYS HA H 171 5.129 4.945 0.184 1 1 1342 . 15 1 1 A 171 171 LYS CA C 171 51.355 54.480 -3.125 1 1 1343 . 15 1 1 A 171 171 LYS N N 171 124.322 118.148 6.174 1 1 1344 . 15 1 1 A 172 172 LEU H H 172 7.764 8.564 -0.800 1 1 1345 . 15 1 1 A 172 172 LEU HA H 172 4.973 5.166 -0.193 1 1 1353 . 15 1 1 A 172 172 LEU CA C 172 50.348 53.470 -3.122 1 1 1354 . 15 1 1 A 172 172 LEU N N 172 126.389 120.365 6.024 1 1 1355 . 15 1 1 A 173 173 THR H H 173 8.321 8.377 -0.056 1 1 1356 . 15 1 1 A 173 173 THR HA H 173 5.017 5.109 -0.092 1 1 1361 . 15 1 1 A 173 173 THR CA C 173 59.149 62.234 -3.085 1 1 1362 . 15 1 1 A 173 173 THR CB C 173 67.449 70.450 -3.001 1 1 1364 . 15 1 1 A 173 173 THR N N 173 123.553 117.952 5.601 1 1 1365 . 15 1 1 A 174 174 TYR H H 174 9.367 9.993 -0.626 1 1 1366 . 15 1 1 A 174 174 TYR HA H 174 4.660 5.354 -0.694 1 1 1373 . 15 1 1 A 174 174 TYR CB C 174 41.267 43.613 -2.346 1 1 1374 . 15 1 1 A 174 174 TYR N N 174 129.583 126.572 3.011 1 1 1375 . 15 1 1 A 175 175 THR H H 175 8.529 9.522 -0.993 1 1 1376 . 15 1 1 A 175 175 THR HA H 175 5.388 5.201 0.187 1 1 1381 . 15 1 1 A 175 175 THR CA C 175 58.216 61.978 -3.762 1 1 1382 . 15 1 1 A 175 175 THR CB C 175 68.575 71.121 -2.546 1 1 1384 . 15 1 1 A 175 175 THR N N 175 125.967 115.263 10.704 1 1 1385 . 15 1 1 A 176 176 ILE H H 176 9.139 9.230 -0.091 1 1 1386 . 15 1 1 A 176 176 ILE HA H 176 4.382 5.419 -1.037 1 1 1395 . 15 1 1 A 176 176 ILE CA C 176 58.006 60.100 -2.094 1 1 1396 . 15 1 1 A 176 176 ILE CB C 176 38.881 41.802 -2.921 1 1 1400 . 15 1 1 A 176 176 ILE N N 176 123.715 126.349 -2.634 1 1 1401 . 15 1 1 A 177 177 ASP H H 177 8.501 9.606 -1.105 1 1 1402 . 15 1 1 A 177 177 ASP HA H 177 5.011 5.256 -0.245 1 1 1405 . 15 1 1 A 177 177 ASP CA C 177 49.089 52.596 -3.507 1 1 1406 . 15 1 1 A 177 177 ASP CB C 177 39.282 43.088 -3.806 1 1 1407 . 15 1 1 A 177 177 ASP N N 177 125.978 125.122 0.856 1 1 1408 . 15 1 1 A 178 178 PHE H H 178 8.913 8.633 0.280 1 1 1409 . 15 1 1 A 178 178 PHE HA H 178 3.993 4.238 -0.245 1 1 1414 . 15 1 1 A 178 178 PHE CB C 178 34.588 39.593 -5.005 1 1 1415 . 15 1 1 A 178 178 PHE N N 178 123.522 123.769 -0.247 1 1 1416 . 15 1 1 A 179 179 ALA H H 179 8.487 8.835 -0.348 1 1 1417 . 15 1 1 A 179 179 ALA HA H 179 4.528 4.209 0.319 1 1 1421 . 15 1 1 A 179 179 ALA CA C 179 52.584 55.388 -2.804 1 1 1422 . 15 1 1 A 179 179 ALA CB C 179 15.666 18.448 -2.782 1 1 1423 . 15 1 1 A 179 179 ALA N N 179 124.061 123.706 0.355 1 1 1424 . 15 1 1 A 180 180 ALA H H 180 7.162 7.735 -0.573 1 1 1425 . 15 1 1 A 180 180 ALA HA H 180 4.313 4.365 -0.052 1 1 1429 . 15 1 1 A 180 180 ALA CA C 180 49.006 51.054 -2.048 1 1 1430 . 15 1 1 A 180 180 ALA CB C 180 16.933 17.338 -0.405 1 1 1431 . 15 1 1 A 180 180 ALA N N 180 119.710 118.930 0.780 1 1 1432 . 15 1 1 A 181 181 LYS H H 181 8.092 9.480 -1.388 1 1 1433 . 15 1 1 A 181 181 LYS HA H 181 3.457 4.496 -1.039 1 1 1440 . 15 1 1 A 181 181 LYS CA C 181 54.783 57.273 -2.490 1 1 1441 . 15 1 1 A 181 181 LYS CB C 181 27.088 31.387 -4.299 1 1 1444 . 15 1 1 A 181 181 LYS N N 181 114.996 121.729 -6.733 1 1 1445 . 15 1 1 A 182 182 GLN H H 182 7.532 7.913 -0.381 1 1 1446 . 15 1 1 A 182 182 GLN HA H 182 5.304 5.212 0.092 1 1 1453 . 15 1 1 A 182 182 GLN CA C 182 51.473 54.230 -2.757 1 1 1454 . 15 1 1 A 182 182 GLN CB C 182 31.585 32.294 -0.709 1 1 1455 . 15 1 1 A 182 182 GLN N N 182 115.064 121.376 -6.312 1 1 1457 . 15 1 1 A 183 183 GLY H H 183 9.026 8.527 0.499 1 1 1458 . 15 1 1 A 183 183 GLY HA2 H 183 5.376 4.575 0.801 1 1 1459 . 15 1 1 A 183 183 GLY HA3 H 183 3.567 4.607 -1.040 1 1 1460 . 15 1 1 A 183 183 GLY CA C 183 42.361 45.584 -3.223 1 1 1461 . 15 1 1 A 183 183 GLY N N 183 111.505 112.119 -0.614 1 1 1462 . 15 1 1 A 184 184 HIS H H 184 7.508 9.004 -1.496 1 1 1463 . 15 1 1 A 184 184 HIS HA H 184 4.304 5.033 -0.729 1 1 1467 . 15 1 1 A 184 184 HIS CA C 184 52.793 55.653 -2.860 1 1 1468 . 15 1 1 A 184 184 HIS CB C 184 27.906 33.107 -5.201 1 1 1469 . 15 1 1 A 184 184 HIS N N 184 111.297 120.272 -8.975 1 1 1470 . 15 1 1 A 185 185 GLY H H 185 9.160 7.749 1.411 1 1 1471 . 15 1 1 A 185 185 GLY HA2 H 185 4.464 3.116 1.348 1 1 1472 . 15 1 1 A 185 185 GLY HA3 H 185 4.117 3.959 0.158 1 1 1473 . 15 1 1 A 185 185 GLY CA C 185 44.212 44.940 -0.728 1 1 1474 . 15 1 1 A 185 185 GLY N N 185 107.398 111.315 -3.917 1 1 1475 . 15 1 1 A 186 186 LYS H H 186 9.170 8.511 0.659 1 1 1476 . 15 1 1 A 186 186 LYS HA H 186 4.925 4.979 -0.054 1 1 1481 . 15 1 1 A 186 186 LYS CB C 186 33.642 36.951 -3.309 1 1 1482 . 15 1 1 A 186 186 LYS N N 186 122.690 119.298 3.392 1 1 1483 . 15 1 1 A 187 187 ILE H H 187 8.444 8.464 -0.020 1 1 1484 . 15 1 1 A 187 187 ILE HA H 187 4.626 5.181 -0.555 1 1 1487 . 15 1 1 A 187 187 ILE N N 187 124.320 123.528 0.792 1 1 1488 . 15 1 1 A 188 188 GLU H H 188 8.590 9.996 -1.406 1 1 1489 . 15 1 1 A 188 188 GLU HA H 188 4.650 5.104 -0.454 1 1 1495 . 15 1 1 A 188 188 GLU N N 188 122.575 126.085 -3.510 1 1 1496 . 15 1 1 A 189 189 HIS H H 189 8.726 8.835 -0.109 1 1 1497 . 15 1 1 A 189 189 HIS HA H 189 4.055 4.738 -0.683 1 1 1501 . 15 1 1 A 189 189 HIS CA C 189 54.623 56.621 -1.998 1 1 1502 . 15 1 1 A 189 189 HIS CB C 189 24.997 32.867 -7.870 1 1 1503 . 15 1 1 A 189 189 HIS N N 189 111.381 122.318 -10.937 1 1 1504 . 15 1 1 A 190 190 LEU H H 190 9.715 7.324 2.391 1 1 1505 . 15 1 1 A 190 190 LEU HA H 190 4.379 4.168 0.211 1 1 1515 . 15 1 1 A 190 190 LEU N N 190 124.648 119.179 5.469 1 1 1516 . 15 1 1 A 191 191 LYS H H 191 10.099 8.598 1.501 1 1 1517 . 15 1 1 A 191 191 LYS HA H 191 3.736 4.124 -0.388 1 1 1524 . 15 1 1 A 191 191 LYS CA C 191 55.815 58.083 -2.268 1 1 1525 . 15 1 1 A 191 191 LYS CB C 191 30.201 31.985 -1.784 1 1 1527 . 15 1 1 A 191 191 LYS N N 191 123.618 118.914 4.704 1 1 1528 . 15 1 1 A 192 192 SER H H 192 6.991 7.764 -0.773 1 1 1529 . 15 1 1 A 192 192 SER HA H 192 4.743 4.904 -0.161 1 1 1532 . 15 1 1 A 192 192 SER CA C 192 51.974 55.667 -3.693 1 1 1533 . 15 1 1 A 192 192 SER CB C 192 60.005 65.834 -5.829 1 1 1534 . 15 1 1 A 192 192 SER N N 192 115.071 114.152 0.919 1 1 1535 . 15 1 1 A 193 193 PRO CB C 193 29.607 31.822 -2.215 1 1 1537 . 15 1 1 A 194 194 GLU H H 194 8.213 8.299 -0.086 1 1 1538 . 15 1 1 A 194 194 GLU HA H 194 3.063 4.413 -1.350 1 1 1543 . 15 1 1 A 194 194 GLU CA C 194 54.185 57.512 -3.327 1 1 1545 . 15 1 1 A 194 194 GLU N N 194 114.055 117.553 -3.498 1 1 1546 . 15 1 1 A 195 195 LEU H H 195 7.082 7.141 -0.059 1 1 1547 . 15 1 1 A 195 195 LEU HA H 195 4.027 5.029 -1.002 1 1 1557 . 15 1 1 A 195 195 LEU CA C 195 51.361 54.139 -2.778 1 1 1558 . 15 1 1 A 195 195 LEU CB C 195 38.950 41.355 -2.405 1 1 1561 . 15 1 1 A 195 195 LEU N N 195 113.898 117.632 -3.734 1 1 1562 . 15 1 1 A 196 196 ASN H H 196 7.060 7.845 -0.785 1 1 1563 . 15 1 1 A 196 196 ASN HA H 196 4.638 4.694 -0.056 1 1 1567 . 15 1 1 A 196 196 ASN N N 196 119.196 118.042 1.154 1 1 1568 . 15 1 1 A 197 197 VAL H H 197 7.244 8.045 -0.801 1 1 1569 . 15 1 1 A 197 197 VAL HA H 197 4.540 4.639 -0.099 1 1 1577 . 15 1 1 A 197 197 VAL CA C 197 57.176 60.188 -3.012 1 1 1578 . 15 1 1 A 197 197 VAL N N 197 113.621 118.266 -4.645 1 1 1579 . 15 1 1 A 198 198 ASP H H 198 8.881 9.000 -0.119 1 1 1580 . 15 1 1 A 198 198 ASP HA H 198 4.894 5.184 -0.290 1 1 1581 . 15 1 1 A 198 198 ASP N N 198 118.852 127.007 -8.155 1 1 1582 . 15 1 1 A 199 199 LEU H H 199 8.498 9.370 -0.872 1 1 1583 . 15 1 1 A 199 199 LEU HA H 199 4.317 5.127 -0.810 1 1 1591 . 15 1 1 A 199 199 LEU N N 199 124.078 125.620 -1.542 1 1 1592 . 15 1 1 A 200 200 ALA H H 200 8.386 9.003 -0.617 1 1 1593 . 15 1 1 A 200 200 ALA HA H 200 4.295 4.481 -0.186 1 1 1597 . 15 1 1 A 200 200 ALA CA C 200 50.044 50.602 -0.558 1 1 1598 . 15 1 1 A 200 200 ALA CB C 200 17.985 22.105 -4.120 1 1 1599 . 15 1 1 A 200 200 ALA N N 200 127.315 124.662 2.653 1 1 1600 . 15 1 1 A 201 201 VAL H H 201 8.007 8.658 -0.651 1 1 1601 . 15 1 1 A 201 201 VAL HA H 201 4.577 5.053 -0.476 1 1 1609 . 15 1 1 A 201 201 VAL CA C 201 60.004 59.629 0.375 1 1 1610 . 15 1 1 A 201 201 VAL CB C 201 28.863 36.049 -7.186 1 1 1611 . 15 1 1 A 201 201 VAL N N 201 119.409 120.997 -1.588 1 1 1612 . 15 1 1 A 202 202 ALA H H 202 8.789 9.762 -0.973 1 1 1613 . 15 1 1 A 202 202 ALA HA H 202 4.630 5.350 -0.720 1 1 1617 . 15 1 1 A 202 202 ALA CA C 202 48.200 50.129 -1.929 1 1 1618 . 15 1 1 A 202 202 ALA N N 202 131.745 126.512 5.233 1 1 1619 . 15 1 1 A 203 203 TYR H H 203 8.522 9.120 -0.598 1 1 1620 . 15 1 1 A 203 203 TYR HA H 203 5.391 5.091 0.300 1 1 1627 . 15 1 1 A 203 203 TYR CA C 203 54.648 58.983 -4.335 1 1 1628 . 15 1 1 A 203 203 TYR CB C 203 37.315 39.584 -2.269 1 1 1629 . 15 1 1 A 203 203 TYR N N 203 117.786 125.359 -7.573 1 1 1630 . 15 1 1 A 204 204 ILE H H 204 8.209 7.320 0.889 1 1 1631 . 15 1 1 A 204 204 ILE HA H 204 4.393 4.813 -0.420 1 1 1641 . 15 1 1 A 204 204 ILE CB C 204 36.807 41.906 -5.099 1 1 1644 . 15 1 1 A 204 204 ILE N N 204 120.602 124.812 -4.210 1 1 1645 . 15 1 1 A 205 205 LYS H H 205 9.340 8.963 0.377 1 1 1646 . 15 1 1 A 205 205 LYS HA H 205 4.756 4.447 0.309 1 1 1651 . 15 1 1 A 205 205 LYS CA C 205 50.844 61.016 -10.172 1 1 1652 . 15 1 1 A 205 205 LYS N N 205 127.960 123.918 4.042 1 1 1653 . 15 1 1 A 207 207 ASP H H 207 8.436 8.681 -0.245 1 1 1654 . 15 1 1 A 207 207 ASP HA H 207 4.692 4.537 0.155 1 1 1657 . 15 1 1 A 207 207 ASP CA C 207 48.789 54.282 -5.493 1 1 1658 . 15 1 1 A 207 207 ASP CB C 207 38.377 40.801 -2.424 1 1 1659 . 15 1 1 A 207 207 ASP N N 207 123.098 125.186 -2.088 1 1 1660 . 15 1 1 A 208 208 GLU H H 208 8.880 8.302 0.578 1 1 1661 . 15 1 1 A 208 208 GLU HA H 208 3.994 4.146 -0.152 1 1 1666 . 15 1 1 A 208 208 GLU CA C 208 56.123 58.631 -2.508 1 1 1667 . 15 1 1 A 208 208 GLU CB C 208 25.794 30.349 -4.555 1 1 1669 . 15 1 1 A 208 208 GLU N N 208 119.042 121.459 -2.417 1 1 1670 . 15 1 1 A 209 209 LYS H H 209 7.681 7.601 0.080 1 1 1671 . 15 1 1 A 209 209 LYS HA H 209 4.141 4.384 -0.243 1 1 1680 . 15 1 1 A 209 209 LYS N N 209 119.252 115.640 3.612 1 1 1681 . 15 1 1 A 210 210 HIS H H 210 8.177 6.639 1.538 1 1 1682 . 15 1 1 A 210 210 HIS HA H 210 3.825 4.705 -0.880 1 1 1687 . 15 1 1 A 210 210 HIS CA C 210 54.205 54.294 -0.089 1 1 1688 . 15 1 1 A 210 210 HIS CB C 210 23.439 30.108 -6.669 1 1 1689 . 15 1 1 A 210 210 HIS N N 210 112.758 113.618 -0.860 1 1 1690 . 15 1 1 A 211 211 HIS H H 211 8.758 7.355 1.403 1 1 1691 . 15 1 1 A 211 211 HIS HA H 211 5.041 5.674 -0.633 1 1 1695 . 15 1 1 A 211 211 HIS CA C 211 50.450 54.895 -4.445 1 1 1696 . 15 1 1 A 211 211 HIS CB C 211 25.703 33.975 -8.272 1 1 1697 . 15 1 1 A 211 211 HIS N N 211 119.552 118.376 1.176 1 1 1698 . 15 1 1 A 212 212 ALA H H 212 8.556 8.250 0.306 1 1 1699 . 15 1 1 A 212 212 ALA HA H 212 4.712 3.916 0.796 1 1 1703 . 15 1 1 A 212 212 ALA CA C 212 49.886 51.881 -1.995 1 1 1704 . 15 1 1 A 212 212 ALA CB C 212 18.860 19.001 -0.141 1 1 1705 . 15 1 1 A 212 212 ALA N N 212 123.780 123.618 0.162 1 1 1706 . 15 1 1 A 213 213 VAL H H 213 9.338 7.365 1.973 1 1 1707 . 15 1 1 A 213 213 VAL HA H 213 5.074 4.797 0.277 1 1 1715 . 15 1 1 A 213 213 VAL CA C 213 57.486 60.192 -2.706 1 1 1716 . 15 1 1 A 213 213 VAL CB C 213 33.938 35.291 -1.353 1 1 1717 . 15 1 1 A 213 213 VAL N N 213 124.742 119.181 5.561 1 1 1718 . 15 1 1 A 214 214 ILE H H 214 8.962 8.588 0.374 1 1 1719 . 15 1 1 A 214 214 ILE HA H 214 4.434 4.789 -0.355 1 1 1726 . 15 1 1 A 214 214 ILE N N 214 122.881 126.287 -3.406 1 1 1727 . 15 1 1 A 215 215 SER H H 215 8.558 8.364 0.194 1 1 1728 . 15 1 1 A 215 215 SER HA H 215 5.001 5.613 -0.612 1 1 1731 . 15 1 1 A 215 215 SER CA C 215 53.230 57.486 -4.256 1 1 1732 . 15 1 1 A 215 215 SER CB C 215 62.077 66.602 -4.525 1 1 1733 . 15 1 1 A 215 215 SER N N 215 122.891 123.118 -0.227 1 1 1734 . 15 1 1 A 216 216 GLY H H 216 7.282 9.061 -1.779 1 1 1735 . 15 1 1 A 216 216 GLY HA2 H 216 4.515 4.213 0.302 1 1 1736 . 15 1 1 A 216 216 GLY HA3 H 216 3.473 4.229 -0.756 1 1 1737 . 15 1 1 A 216 216 GLY CA C 216 42.816 46.052 -3.236 1 1 1738 . 15 1 1 A 216 216 GLY N N 216 110.899 110.780 0.119 1 1 1739 . 15 1 1 A 217 217 SER H H 217 8.673 8.245 0.428 1 1 1740 . 15 1 1 A 217 217 SER HA H 217 5.127 5.379 -0.252 1 1 1743 . 15 1 1 A 217 217 SER CA C 217 56.266 57.194 -0.928 1 1 1744 . 15 1 1 A 217 217 SER N N 217 117.164 115.098 2.066 1 1 1745 . 15 1 1 A 218 218 VAL H H 218 7.451 9.341 -1.890 1 1 1746 . 15 1 1 A 218 218 VAL HA H 218 5.128 4.951 0.177 1 1 1754 . 15 1 1 A 218 218 VAL CA C 218 56.637 60.115 -3.478 1 1 1755 . 15 1 1 A 218 218 VAL N N 218 117.826 121.653 -3.827 1 1 1756 . 15 1 1 A 219 219 LEU H H 219 9.022 9.100 -0.078 1 1 1757 . 15 1 1 A 219 219 LEU HA H 219 5.387 4.942 0.445 1 1 1767 . 15 1 1 A 219 219 LEU CA C 219 50.450 53.710 -3.260 1 1 1768 . 15 1 1 A 219 219 LEU N N 219 124.820 124.819 0.001 1 1 1769 . 15 1 1 A 220 220 TYR H H 220 8.816 8.705 0.111 1 1 1770 . 15 1 1 A 220 220 TYR HA H 220 4.834 4.935 -0.101 1 1 1777 . 15 1 1 A 220 220 TYR N N 220 121.249 122.179 -0.930 1 1 1778 . 15 1 1 A 221 221 ASN H H 221 9.191 8.518 0.673 1 1 1779 . 15 1 1 A 221 221 ASN HA H 221 4.048 4.224 -0.176 1 1 1784 . 15 1 1 A 221 221 ASN CA C 221 51.647 55.678 -4.031 1 1 1785 . 15 1 1 A 221 221 ASN CB C 221 36.640 37.800 -1.160 1 1 1786 . 15 1 1 A 221 221 ASN N N 221 129.865 123.182 6.683 1 1 1788 . 15 1 1 A 222 222 GLN H H 222 8.468 6.762 1.706 1 1 1789 . 15 1 1 A 222 222 GLN HA H 222 3.671 4.169 -0.498 1 1 1794 . 15 1 1 A 222 222 GLN CA C 222 55.075 54.586 0.489 1 1 1795 . 15 1 1 A 222 222 GLN CB C 222 24.663 27.161 -2.498 1 1 1797 . 15 1 1 A 222 222 GLN N N 222 108.367 116.965 -8.598 1 1 1798 . 15 1 1 A 223 223 ASP H H 223 7.797 7.896 -0.099 1 1 1799 . 15 1 1 A 223 223 ASP HA H 223 4.986 4.240 0.746 1 1 1802 . 15 1 1 A 223 223 ASP N N 223 120.842 124.463 -3.621 1 1 1803 . 15 1 1 A 224 224 GLU H H 224 8.731 8.316 0.415 1 1 1804 . 15 1 1 A 224 224 GLU HA H 224 4.690 4.531 0.159 1 1 1809 . 15 1 1 A 224 224 GLU CA C 224 54.703 55.114 -0.411 1 1 1810 . 15 1 1 A 224 224 GLU CB C 224 26.357 31.759 -5.402 1 1 1812 . 15 1 1 A 224 224 GLU N N 224 124.249 121.398 2.851 1 1 1813 . 15 1 1 A 225 225 LYS H H 225 8.730 8.401 0.329 1 1 1814 . 15 1 1 A 225 225 LYS HA H 225 4.754 4.921 -0.167 1 1 1822 . 15 1 1 A 225 225 LYS N N 225 126.784 121.421 5.363 1 1 1823 . 15 1 1 A 226 226 GLY H H 226 7.683 8.877 -1.194 1 1 1824 . 15 1 1 A 226 226 GLY HA2 H 226 5.567 4.255 1.312 1 1 1825 . 15 1 1 A 226 226 GLY HA3 H 226 3.819 4.272 -0.453 1 1 1826 . 15 1 1 A 226 226 GLY CA C 226 42.264 44.217 -1.953 1 1 1827 . 15 1 1 A 226 226 GLY N N 226 107.140 111.895 -4.755 1 1 1828 . 15 1 1 A 227 227 SER H H 227 8.672 9.843 -1.171 1 1 1829 . 15 1 1 A 227 227 SER HA H 227 5.564 5.299 0.265 1 1 1832 . 15 1 1 A 227 227 SER CA C 227 54.373 57.262 -2.889 1 1 1833 . 15 1 1 A 227 227 SER CB C 227 63.963 65.767 -1.804 1 1 1834 . 15 1 1 A 227 227 SER N N 227 117.767 116.728 1.039 1 1 1835 . 15 1 1 A 228 228 TYR H H 228 9.073 9.217 -0.144 1 1 1836 . 15 1 1 A 228 228 TYR HA H 228 5.519 5.005 0.514 1 1 1843 . 15 1 1 A 228 228 TYR N N 228 118.324 122.711 -4.387 1 1 1844 . 15 1 1 A 229 229 SER H H 229 8.929 8.324 0.605 1 1 1845 . 15 1 1 A 229 229 SER HA H 229 5.209 5.643 -0.434 1 1 1848 . 15 1 1 A 229 229 SER CA C 229 54.131 56.701 -2.570 1 1 1849 . 15 1 1 A 229 229 SER N N 229 116.118 118.789 -2.671 1 1 1850 . 15 1 1 A 230 230 LEU H H 230 9.372 9.832 -0.460 1 1 1851 . 15 1 1 A 230 230 LEU HA H 230 4.803 4.986 -0.183 1 1 1863 . 15 1 1 A 230 230 LEU N N 230 124.803 124.933 -0.130 1 1 1864 . 15 1 1 A 231 231 GLY H H 231 9.080 8.296 0.784 1 1 1865 . 15 1 1 A 231 231 GLY HA2 H 231 4.776 4.173 0.603 1 1 1866 . 15 1 1 A 231 231 GLY HA3 H 231 3.528 4.269 -0.741 1 1 1867 . 15 1 1 A 231 231 GLY CA C 231 41.468 44.561 -3.093 1 1 1868 . 15 1 1 A 231 231 GLY N N 231 109.611 108.513 1.098 1 1 1869 . 15 1 1 A 232 232 ILE H H 232 6.849 8.723 -1.874 1 1 1870 . 15 1 1 A 232 232 ILE HA H 232 4.742 4.642 0.100 1 1 1878 . 15 1 1 A 232 232 ILE N N 232 120.566 125.177 -4.611 1 1 1879 . 15 1 1 A 233 233 PHE H H 233 9.569 8.158 1.411 1 1 1880 . 15 1 1 A 233 233 PHE HA H 233 4.979 5.976 -0.997 1 1 1885 . 15 1 1 A 233 233 PHE N N 233 129.256 120.079 9.177 1 1 1886 . 15 1 1 A 234 234 GLY H H 234 8.734 8.797 -0.063 1 1 1887 . 15 1 1 A 234 234 GLY HA2 H 234 4.488 4.050 0.438 1 1 1888 . 15 1 1 A 234 234 GLY HA3 H 234 3.327 4.278 -0.951 1 1 1889 . 15 1 1 A 234 234 GLY CA C 234 40.377 45.539 -5.162 1 1 1890 . 15 1 1 A 234 234 GLY N N 234 105.294 107.843 -2.549 1 1 1891 . 15 1 1 A 235 235 GLU H H 235 9.198 8.174 1.024 1 1 1892 . 15 1 1 A 235 235 GLU HA H 235 4.111 4.077 0.034 1 1 1897 . 15 1 1 A 235 235 GLU CA C 235 56.466 59.116 -2.650 1 1 1898 . 15 1 1 A 235 235 GLU CB C 235 26.256 29.715 -3.459 1 1 1900 . 15 1 1 A 235 235 GLU N N 235 125.813 120.924 4.889 1 1 1901 . 15 1 1 A 236 236 LYS H H 236 8.147 7.740 0.407 1 1 1902 . 15 1 1 A 236 236 LYS HA H 236 4.373 4.485 -0.112 1 1 1905 . 15 1 1 A 236 236 LYS N N 236 117.810 119.252 -1.442 1 1 1906 . 15 1 1 A 237 237 ALA H H 237 7.685 7.631 0.054 1 1 1907 . 15 1 1 A 237 237 ALA HA H 237 3.902 4.559 -0.657 1 1 1911 . 15 1 1 A 237 237 ALA CA C 237 49.762 51.971 -2.209 1 1 1912 . 15 1 1 A 237 237 ALA CB C 237 14.720 19.000 -4.280 1 1 1913 . 15 1 1 A 237 237 ALA N N 237 118.704 121.545 -2.841 1 1 1914 . 15 1 1 A 238 238 GLN H H 238 9.312 8.532 0.780 1 1 1915 . 15 1 1 A 238 238 GLN HA H 238 4.049 4.569 -0.520 1 1 1920 . 15 1 1 A 238 238 GLN N N 238 118.059 122.195 -4.136 1 1 1921 . 15 1 1 A 239 239 GLU H H 239 8.785 10.049 -1.264 1 1 1922 . 15 1 1 A 239 239 GLU HA H 239 5.531 5.133 0.398 1 1 1927 . 15 1 1 A 239 239 GLU N N 239 116.914 122.118 -5.204 1 1 1928 . 15 1 1 A 240 240 VAL H H 240 8.501 9.141 -0.640 1 1 1929 . 15 1 1 A 240 240 VAL HA H 240 5.655 4.460 1.195 1 1 1937 . 15 1 1 A 240 240 VAL CA C 240 55.582 59.677 -4.095 1 1 1940 . 15 1 1 A 240 240 VAL N N 240 110.588 121.692 -11.104 1 1 1941 . 15 1 1 A 241 241 ALA H H 241 8.463 8.681 -0.218 1 1 1942 . 15 1 1 A 241 241 ALA HA H 241 5.014 5.252 -0.238 1 1 1946 . 15 1 1 A 241 241 ALA CA C 241 49.361 51.273 -1.912 1 1 1947 . 15 1 1 A 241 241 ALA CB C 241 18.196 23.682 -5.486 1 1 1948 . 15 1 1 A 241 241 ALA N N 241 121.125 129.790 -8.665 1 1 1949 . 15 1 1 A 242 242 GLY H H 242 9.421 9.128 0.293 1 1 1950 . 15 1 1 A 242 242 GLY HA2 H 242 5.161 4.215 0.946 1 1 1951 . 15 1 1 A 242 242 GLY HA3 H 242 4.076 4.260 -0.184 1 1 1952 . 15 1 1 A 242 242 GLY N N 242 112.036 106.946 5.090 1 1 1953 . 15 1 1 A 243 243 SER H H 243 8.929 8.238 0.691 1 1 1954 . 15 1 1 A 243 243 SER HA H 243 5.331 5.140 0.191 1 1 1957 . 15 1 1 A 243 243 SER N N 243 116.113 115.729 0.384 1 1 1958 . 15 1 1 A 244 244 ALA H H 244 9.218 8.101 1.117 1 1 1959 . 15 1 1 A 244 244 ALA HA H 244 5.221 4.655 0.566 1 1 1963 . 15 1 1 A 244 244 ALA CA C 244 47.883 51.044 -3.161 1 1 1964 . 15 1 1 A 244 244 ALA N N 244 120.635 121.393 -0.758 1 1 1965 . 15 1 1 A 245 245 GLU H H 245 9.194 8.507 0.687 1 1 1966 . 15 1 1 A 245 245 GLU HA H 245 4.869 5.105 -0.236 1 1 1971 . 15 1 1 A 245 245 GLU N N 245 123.487 118.712 4.775 1 1 1972 . 15 1 1 A 246 246 VAL H H 246 8.531 8.909 -0.378 1 1 1973 . 15 1 1 A 246 246 VAL HA H 246 4.518 4.767 -0.249 1 1 1981 . 15 1 1 A 246 246 VAL CA C 246 58.286 61.502 -3.216 1 1 1982 . 15 1 1 A 246 246 VAL N N 246 123.347 122.002 1.345 1 1 1983 . 15 1 1 A 247 247 GLU H H 247 9.132 8.809 0.323 1 1 1984 . 15 1 1 A 247 247 GLU HA H 247 4.368 4.848 -0.480 1 1 1989 . 15 1 1 A 247 247 GLU CB C 247 26.744 33.166 -6.422 1 1 1990 . 15 1 1 A 247 247 GLU N N 247 129.243 126.299 2.944 1 1 1991 . 15 1 1 A 248 248 THR H H 248 7.827 8.418 -0.591 1 1 1992 . 15 1 1 A 248 248 THR HA H 248 4.749 4.798 -0.049 1 1 1997 . 15 1 1 A 248 248 THR CA C 248 56.859 60.659 -3.800 1 1 1998 . 15 1 1 A 248 248 THR CB C 248 69.171 70.984 -1.813 1 1 2000 . 15 1 1 A 248 248 THR N N 248 114.228 119.531 -5.303 1 1 2001 . 15 1 1 A 249 249 ALA H H 249 9.148 8.771 0.377 1 1 2002 . 15 1 1 A 249 249 ALA HA H 249 4.174 4.133 0.041 1 1 2006 . 15 1 1 A 249 249 ALA CA C 249 51.970 53.545 -1.575 1 1 2007 . 15 1 1 A 249 249 ALA CB C 249 15.797 18.363 -2.566 1 1 2008 . 15 1 1 A 249 249 ALA N N 249 123.341 124.516 -1.175 1 1 2009 . 15 1 1 A 250 250 ASN H H 250 7.974 7.931 0.043 1 1 2010 . 15 1 1 A 250 250 ASN HA H 250 4.953 4.928 0.025 1 1 2015 . 15 1 1 A 250 250 ASN CA C 250 49.198 52.605 -3.407 1 1 2016 . 15 1 1 A 250 250 ASN CB C 250 35.976 39.688 -3.712 1 1 2017 . 15 1 1 A 250 250 ASN N N 250 113.358 116.319 -2.961 1 1 2019 . 15 1 1 A 251 251 GLY H H 251 7.510 7.844 -0.334 1 1 2020 . 15 1 1 A 251 251 GLY HA2 H 251 4.492 4.033 0.459 1 1 2021 . 15 1 1 A 251 251 GLY HA3 H 251 3.853 4.051 -0.198 1 1 2022 . 15 1 1 A 251 251 GLY CA C 251 41.435 45.052 -3.617 1 1 2023 . 15 1 1 A 251 251 GLY N N 251 108.692 107.216 1.476 1 1 2024 . 15 1 1 A 252 252 ILE H H 252 8.465 8.324 0.141 1 1 2025 . 15 1 1 A 252 252 ILE HA H 252 4.521 4.477 0.044 1 1 2035 . 15 1 1 A 252 252 ILE CB C 252 35.653 41.125 -5.472 1 1 2039 . 15 1 1 A 252 252 ILE N N 252 122.043 120.329 1.714 1 1 2040 . 15 1 1 A 253 253 HIS H H 253 9.311 8.915 0.396 1 1 2041 . 15 1 1 A 253 253 HIS HA H 253 4.861 4.715 0.146 1 1 2046 . 15 1 1 A 253 253 HIS N N 253 126.617 122.490 4.127 1 1 2047 . 15 1 1 A 254 254 HIS H H 254 8.820 7.908 0.912 1 1 2048 . 15 1 1 A 254 254 HIS HA H 254 5.305 5.592 -0.287 1 1 2051 . 15 1 1 A 254 254 HIS CA C 254 52.781 53.341 -0.560 1 1 2052 . 15 1 1 A 254 254 HIS N N 254 122.665 116.509 6.156 1 1 2053 . 15 1 1 A 255 255 ILE H H 255 9.047 8.771 0.276 1 1 2054 . 15 1 1 A 255 255 ILE HA H 255 4.651 4.622 0.029 1 1 2061 . 15 1 1 A 255 255 ILE N N 255 123.958 119.103 4.855 1 1 2062 . 15 1 1 A 256 256 GLY H H 256 9.339 7.446 1.893 1 1 2063 . 15 1 1 A 256 256 GLY HA2 H 256 3.816 3.627 0.189 1 1 2064 . 15 1 1 A 256 256 GLY HA3 H 256 2.267 3.764 -1.497 1 1 2065 . 15 1 1 A 256 256 GLY N N 256 115.022 114.245 0.777 1 1 2066 . 15 1 1 A 257 257 LEU H H 257 7.890 8.564 -0.674 1 1 2067 . 15 1 1 A 257 257 LEU HA H 257 4.853 4.991 -0.138 1 1 2077 . 15 1 1 A 257 257 LEU N N 257 121.441 123.725 -2.284 1 1 2078 . 15 1 1 A 258 258 ALA H H 258 7.982 8.782 -0.800 1 1 2079 . 15 1 1 A 258 258 ALA HA H 258 4.668 5.070 -0.402 1 1 2083 . 15 1 1 A 258 258 ALA CA C 258 49.678 51.811 -2.133 1 1 2084 . 15 1 1 A 258 258 ALA CB C 258 19.561 20.731 -1.170 1 1 2085 . 15 1 1 A 258 258 ALA N N 258 123.234 124.169 -0.935 1 1 2086 . 15 1 1 A 259 259 ALA H H 259 9.117 8.959 0.158 1 1 2087 . 15 1 1 A 259 259 ALA HA H 259 4.790 4.581 0.209 1 1 2091 . 15 1 1 A 259 259 ALA N N 259 123.901 124.902 -1.001 1 1 2092 . 15 1 1 A 260 260 LYS H H 260 8.452 7.967 0.485 1 1 2093 . 15 1 1 A 260 260 LYS HA H 260 5.914 4.751 1.163 1 1 2098 . 15 1 1 A 260 260 LYS CA C 260 51.818 54.582 -2.764 1 1 2099 . 15 1 1 A 260 260 LYS N N 260 116.464 116.973 -0.509 1 1 1 . 16 1 1 A 9 9 SER H H 9 8.293 8.300 -0.007 1 1 2 . 16 1 1 A 9 9 SER HA H 9 4.432 4.669 -0.237 1 1 3 . 16 1 1 A 9 9 SER N N 9 116.407 117.844 -1.437 1 1 4 . 16 1 1 A 10 10 GLY H H 10 8.472 7.940 0.532 1 1 5 . 16 1 1 A 10 10 GLY N N 10 111.611 108.712 2.899 1 1 6 . 16 1 1 A 14 14 VAL H H 14 8.009 8.532 -0.523 1 1 7 . 16 1 1 A 14 14 VAL HA H 14 4.128 4.076 0.052 1 1 15 . 16 1 1 A 14 14 VAL CA C 14 59.473 61.904 -2.431 1 1 16 . 16 1 1 A 14 14 VAL CB C 14 30.127 32.819 -2.692 1 1 17 . 16 1 1 A 14 14 VAL N N 14 119.846 117.814 2.032 1 1 18 . 16 1 1 A 15 15 THR H H 15 8.152 8.384 -0.232 1 1 19 . 16 1 1 A 15 15 THR HA H 15 4.346 4.577 -0.231 1 1 24 . 16 1 1 A 15 15 THR N N 15 118.509 118.066 0.443 1 1 25 . 16 1 1 A 16 16 ALA H H 16 8.207 8.681 -0.474 1 1 26 . 16 1 1 A 16 16 ALA HA H 16 4.319 4.142 0.177 1 1 30 . 16 1 1 A 16 16 ALA CA C 16 49.835 53.531 -3.696 1 1 31 . 16 1 1 A 16 16 ALA CB C 16 16.714 18.491 -1.777 1 1 32 . 16 1 1 A 16 16 ALA N N 16 126.935 127.031 -0.096 1 1 33 . 16 1 1 A 17 17 ASP H H 17 8.269 7.963 0.306 1 1 34 . 16 1 1 A 17 17 ASP HA H 17 4.581 4.896 -0.315 1 1 37 . 16 1 1 A 17 17 ASP CA C 17 51.643 53.377 -1.734 1 1 38 . 16 1 1 A 17 17 ASP CB C 17 38.257 41.284 -3.027 1 1 39 . 16 1 1 A 17 17 ASP N N 17 120.379 118.135 2.244 1 1 40 . 16 1 1 A 18 18 ILE H H 18 7.979 7.835 0.144 1 1 41 . 16 1 1 A 18 18 ILE HA H 18 4.178 4.172 0.006 1 1 48 . 16 1 1 A 18 18 ILE CA C 18 58.737 63.015 -4.278 1 1 49 . 16 1 1 A 18 18 ILE CB C 18 36.077 38.292 -2.215 1 1 53 . 16 1 1 A 18 18 ILE N N 18 121.171 118.878 2.293 1 1 54 . 16 1 1 A 19 19 GLY H H 19 8.410 7.922 0.488 1 1 55 . 16 1 1 A 19 19 GLY HA2 H 19 4.023 4.095 -0.072 1 1 56 . 16 1 1 A 19 19 GLY HA3 H 19 4.023 4.098 -0.075 1 1 57 . 16 1 1 A 19 19 GLY N N 19 112.246 108.929 3.317 1 1 58 . 16 1 1 A 20 20 THR H H 20 8.005 7.804 0.201 1 1 59 . 16 1 1 A 20 20 THR HA H 20 4.463 4.104 0.359 1 1 64 . 16 1 1 A 20 20 THR CB C 20 66.723 67.979 -1.256 1 1 66 . 16 1 1 A 20 20 THR N N 20 112.239 115.621 -3.382 1 1 67 . 16 1 1 A 21 21 GLY H H 21 8.500 8.342 0.158 1 1 68 . 16 1 1 A 21 21 GLY HA2 H 21 4.099 3.913 0.186 1 1 69 . 16 1 1 A 21 21 GLY HA3 H 21 3.872 3.915 -0.043 1 1 70 . 16 1 1 A 21 21 GLY N N 21 111.048 110.644 0.404 1 1 71 . 16 1 1 A 22 22 LEU H H 22 7.427 8.051 -0.624 1 1 72 . 16 1 1 A 22 22 LEU HA H 22 3.884 4.038 -0.154 1 1 84 . 16 1 1 A 22 22 LEU N N 22 118.837 122.855 -4.018 1 1 85 . 16 1 1 A 23 23 ALA H H 23 7.896 7.965 -0.069 1 1 86 . 16 1 1 A 23 23 ALA HA H 23 4.023 4.140 -0.117 1 1 90 . 16 1 1 A 23 23 ALA CA C 23 52.584 54.160 -1.576 1 1 91 . 16 1 1 A 23 23 ALA CB C 23 15.470 18.388 -2.918 1 1 92 . 16 1 1 A 23 23 ALA N N 23 119.194 120.791 -1.597 1 1 93 . 16 1 1 A 24 24 ASP H H 24 8.265 7.728 0.537 1 1 94 . 16 1 1 A 24 24 ASP HA H 24 4.337 4.593 -0.256 1 1 97 . 16 1 1 A 24 24 ASP CB C 24 37.029 41.358 -4.329 1 1 98 . 16 1 1 A 24 24 ASP N N 24 119.035 116.445 2.590 1 1 99 . 16 1 1 A 25 25 ALA H H 25 8.211 8.334 -0.123 1 1 100 . 16 1 1 A 25 25 ALA HA H 25 4.064 4.278 -0.214 1 1 104 . 16 1 1 A 25 25 ALA CA C 25 53.278 53.957 -0.679 1 1 105 . 16 1 1 A 25 25 ALA CB C 25 15.760 18.300 -2.540 1 1 106 . 16 1 1 A 25 25 ALA N N 25 122.434 121.350 1.084 1 1 107 . 16 1 1 A 26 26 LEU H H 26 7.334 7.464 -0.130 1 1 108 . 16 1 1 A 26 26 LEU HA H 26 4.351 4.250 0.101 1 1 117 . 16 1 1 A 26 26 LEU N N 26 114.238 115.454 -1.216 1 1 118 . 16 1 1 A 27 27 THR H H 27 7.708 7.322 0.386 1 1 119 . 16 1 1 A 27 27 THR HA H 27 4.492 4.330 0.162 1 1 124 . 16 1 1 A 27 27 THR CA C 27 59.438 63.337 -3.899 1 1 125 . 16 1 1 A 27 27 THR CB C 27 68.796 68.725 0.071 1 1 127 . 16 1 1 A 27 27 THR N N 27 106.430 111.133 -4.703 1 1 128 . 16 1 1 A 28 28 ALA H H 28 8.906 7.773 1.133 1 1 129 . 16 1 1 A 28 28 ALA HA H 28 4.812 4.692 0.120 1 1 133 . 16 1 1 A 28 28 ALA CB C 28 16.724 19.329 -2.605 1 1 134 . 16 1 1 A 28 28 ALA N N 28 128.420 124.048 4.372 1 1 135 . 16 1 1 A 29 29 PRO CA C 29 59.166 62.346 -3.180 1 1 136 . 16 1 1 A 29 29 PRO CB C 29 29.865 32.581 -2.716 1 1 139 . 16 1 1 A 30 30 LEU H H 30 8.204 8.314 -0.110 1 1 140 . 16 1 1 A 30 30 LEU HA H 30 4.052 4.161 -0.109 1 1 150 . 16 1 1 A 30 30 LEU N N 30 121.970 123.433 -1.463 1 1 151 . 16 1 1 A 31 31 ASP H H 31 8.720 8.770 -0.050 1 1 152 . 16 1 1 A 31 31 ASP HA H 31 4.772 4.978 -0.206 1 1 155 . 16 1 1 A 31 31 ASP CA C 31 50.115 53.084 -2.969 1 1 156 . 16 1 1 A 31 31 ASP N N 31 125.105 125.703 -0.598 1 1 157 . 16 1 1 A 32 32 HIS CA C 32 55.083 54.369 0.714 1 1 158 . 16 1 1 A 32 32 HIS CB C 32 25.707 29.914 -4.207 1 1 159 . 16 1 1 A 33 33 LYS H H 33 8.589 7.999 0.590 1 1 160 . 16 1 1 A 33 33 LYS HA H 33 4.112 4.491 -0.379 1 1 167 . 16 1 1 A 33 33 LYS CB C 33 29.218 33.661 -4.443 1 1 169 . 16 1 1 A 33 33 LYS N N 33 118.920 118.146 0.774 1 1 170 . 16 1 1 A 34 34 ASP H H 34 7.420 7.694 -0.274 1 1 171 . 16 1 1 A 34 34 ASP HA H 34 4.368 4.634 -0.266 1 1 174 . 16 1 1 A 34 34 ASP N N 34 120.940 120.945 -0.005 1 1 175 . 16 1 1 A 35 35 LYS H H 35 8.266 8.836 -0.570 1 1 176 . 16 1 1 A 35 35 LYS HA H 35 4.169 4.441 -0.272 1 1 183 . 16 1 1 A 35 35 LYS N N 35 121.280 119.523 1.757 1 1 184 . 16 1 1 A 36 36 GLY H H 36 8.716 7.854 0.862 1 1 185 . 16 1 1 A 36 36 GLY HA2 H 36 3.822 3.915 -0.093 1 1 186 . 16 1 1 A 36 36 GLY HA3 H 36 3.618 3.915 -0.297 1 1 187 . 16 1 1 A 36 36 GLY N N 36 111.002 108.018 2.984 1 1 188 . 16 1 1 A 37 37 LEU H H 37 8.032 8.253 -0.221 1 1 189 . 16 1 1 A 37 37 LEU HA H 37 4.406 4.387 0.019 1 1 198 . 16 1 1 A 37 37 LEU N N 37 127.683 124.105 3.578 1 1 199 . 16 1 1 A 38 38 LYS H H 38 9.190 8.930 0.260 1 1 200 . 16 1 1 A 38 38 LYS HA H 38 3.925 4.038 -0.113 1 1 205 . 16 1 1 A 38 38 LYS N N 38 132.634 125.924 6.710 1 1 206 . 16 1 1 A 39 39 SER H H 39 7.161 7.674 -0.513 1 1 207 . 16 1 1 A 39 39 SER HA H 39 5.097 4.620 0.477 1 1 210 . 16 1 1 A 39 39 SER CA C 39 54.451 57.622 -3.171 1 1 211 . 16 1 1 A 39 39 SER N N 39 110.262 109.487 0.775 1 1 212 . 16 1 1 A 40 40 LEU H H 40 8.142 9.985 -1.843 1 1 213 . 16 1 1 A 40 40 LEU HA H 40 4.481 4.789 -0.308 1 1 223 . 16 1 1 A 40 40 LEU N N 40 122.761 121.811 0.950 1 1 224 . 16 1 1 A 41 41 THR H H 41 8.641 8.775 -0.134 1 1 225 . 16 1 1 A 41 41 THR HA H 41 4.141 4.591 -0.450 1 1 230 . 16 1 1 A 41 41 THR CA C 41 60.301 61.778 -1.477 1 1 231 . 16 1 1 A 41 41 THR CB C 41 65.862 70.336 -4.474 1 1 233 . 16 1 1 A 41 41 THR N N 41 124.142 121.692 2.450 1 1 234 . 16 1 1 A 42 42 LEU H H 42 8.586 8.433 0.153 1 1 235 . 16 1 1 A 42 42 LEU HA H 42 4.337 4.875 -0.538 1 1 247 . 16 1 1 A 42 42 LEU N N 42 128.603 125.005 3.598 1 1 248 . 16 1 1 A 43 43 GLU H H 43 8.644 8.665 -0.021 1 1 249 . 16 1 1 A 43 43 GLU HA H 43 4.663 4.326 0.337 1 1 253 . 16 1 1 A 43 43 GLU N N 43 124.180 124.117 0.063 1 1 254 . 16 1 1 A 44 44 ASP H H 44 10.243 8.535 1.708 1 1 255 . 16 1 1 A 44 44 ASP HA H 44 4.518 4.593 -0.075 1 1 258 . 16 1 1 A 44 44 ASP CA C 44 52.879 52.752 0.127 1 1 259 . 16 1 1 A 44 44 ASP CB C 44 37.711 39.062 -1.351 1 1 260 . 16 1 1 A 44 44 ASP N N 44 124.177 120.900 3.277 1 1 261 . 16 1 1 A 45 45 SER H H 45 8.546 10.050 -1.504 1 1 262 . 16 1 1 A 45 45 SER HA H 45 3.850 4.287 -0.437 1 1 265 . 16 1 1 A 45 45 SER CA C 45 59.588 61.233 -1.645 1 1 266 . 16 1 1 A 45 45 SER CB C 45 61.660 63.109 -1.449 1 1 267 . 16 1 1 A 45 45 SER N N 45 116.191 118.253 -2.062 1 1 268 . 16 1 1 A 46 46 ILE H H 46 6.902 7.648 -0.746 1 1 269 . 16 1 1 A 46 46 ILE HA H 46 3.874 4.695 -0.821 1 1 279 . 16 1 1 A 46 46 ILE CA C 46 57.605 60.063 -2.458 1 1 280 . 16 1 1 A 46 46 ILE CB C 46 36.694 39.833 -3.139 1 1 283 . 16 1 1 A 46 46 ILE N N 46 116.189 119.984 -3.795 1 1 284 . 16 1 1 A 47 47 SER H H 47 7.804 8.475 -0.671 1 1 285 . 16 1 1 A 47 47 SER HA H 47 4.342 4.807 -0.465 1 1 288 . 16 1 1 A 47 47 SER CA C 47 55.995 56.492 -0.497 1 1 289 . 16 1 1 A 47 47 SER N N 47 118.738 116.990 1.748 1 1 290 . 16 1 1 A 48 48 GLN H H 48 8.522 8.958 -0.436 1 1 291 . 16 1 1 A 48 48 GLN HA H 48 3.939 4.154 -0.215 1 1 296 . 16 1 1 A 48 48 GLN CA C 48 55.111 58.042 -2.931 1 1 298 . 16 1 1 A 48 48 GLN N N 48 119.475 121.965 -2.490 1 1 299 . 16 1 1 A 49 49 ASN H H 49 8.437 8.259 0.178 1 1 300 . 16 1 1 A 49 49 ASN HA H 49 4.693 4.790 -0.097 1 1 305 . 16 1 1 A 49 49 ASN CA C 49 50.839 52.377 -1.538 1 1 306 . 16 1 1 A 49 49 ASN CB C 49 35.767 37.836 -2.069 1 1 307 . 16 1 1 A 49 49 ASN N N 49 117.233 115.408 1.825 1 1 309 . 16 1 1 A 50 50 GLY H H 50 7.952 8.752 -0.800 1 1 310 . 16 1 1 A 50 50 GLY HA2 H 50 4.518 4.147 0.371 1 1 311 . 16 1 1 A 50 50 GLY HA3 H 50 4.054 4.156 -0.102 1 1 312 . 16 1 1 A 50 50 GLY CA C 50 41.883 45.964 -4.081 1 1 313 . 16 1 1 A 50 50 GLY N N 50 108.751 106.858 1.893 1 1 314 . 16 1 1 A 51 51 THR H H 51 8.548 8.206 0.342 1 1 315 . 16 1 1 A 51 51 THR HA H 51 5.012 5.367 -0.355 1 1 320 . 16 1 1 A 51 51 THR CA C 51 57.026 60.291 -3.265 1 1 321 . 16 1 1 A 51 51 THR CB C 51 69.887 70.604 -0.717 1 1 323 . 16 1 1 A 51 51 THR N N 51 108.710 114.801 -6.091 1 1 324 . 16 1 1 A 52 52 LEU H H 52 9.110 9.317 -0.207 1 1 325 . 16 1 1 A 52 52 LEU HA H 52 5.183 5.332 -0.149 1 1 333 . 16 1 1 A 52 52 LEU CA C 52 50.822 54.002 -3.180 1 1 335 . 16 1 1 A 52 52 LEU N N 52 124.606 122.349 2.257 1 1 336 . 16 1 1 A 53 53 THR H H 53 9.312 8.621 0.691 1 1 337 . 16 1 1 A 53 53 THR HA H 53 5.288 5.305 -0.017 1 1 342 . 16 1 1 A 53 53 THR CA C 53 59.535 60.964 -1.429 1 1 343 . 16 1 1 A 53 53 THR CB C 53 66.838 72.249 -5.411 1 1 345 . 16 1 1 A 53 53 THR N N 53 125.445 115.597 9.848 1 1 346 . 16 1 1 A 54 54 LEU H H 54 8.992 8.592 0.400 1 1 347 . 16 1 1 A 54 54 LEU HA H 54 5.563 5.936 -0.373 1 1 357 . 16 1 1 A 54 54 LEU N N 54 128.814 119.985 8.829 1 1 358 . 16 1 1 A 55 55 SER H H 55 9.017 9.455 -0.438 1 1 359 . 16 1 1 A 55 55 SER HA H 55 5.476 5.187 0.289 1 1 362 . 16 1 1 A 55 55 SER CA C 55 53.944 56.532 -2.588 1 1 363 . 16 1 1 A 55 55 SER CB C 55 63.384 64.910 -1.526 1 1 364 . 16 1 1 A 55 55 SER N N 55 112.964 118.913 -5.949 1 1 365 . 16 1 1 A 56 56 ALA H H 56 8.324 10.387 -2.063 1 1 366 . 16 1 1 A 56 56 ALA HA H 56 4.605 4.656 -0.051 1 1 370 . 16 1 1 A 56 56 ALA CA C 56 50.743 50.906 -0.163 1 1 371 . 16 1 1 A 56 56 ALA CB C 56 21.372 20.475 0.897 1 1 372 . 16 1 1 A 56 56 ALA N N 56 123.555 128.808 -5.253 1 1 373 . 16 1 1 A 57 57 GLN H H 57 9.080 8.618 0.462 1 1 374 . 16 1 1 A 57 57 GLN HA H 57 3.884 4.509 -0.625 1 1 381 . 16 1 1 A 57 57 GLN CA C 57 53.331 55.998 -2.667 1 1 382 . 16 1 1 A 57 57 GLN CB C 57 24.659 27.523 -2.864 1 1 384 . 16 1 1 A 57 57 GLN N N 57 116.815 116.301 0.514 1 1 386 . 16 1 1 A 58 58 GLY H H 58 8.527 8.013 0.514 1 1 387 . 16 1 1 A 58 58 GLY HA2 H 58 4.168 4.054 0.114 1 1 388 . 16 1 1 A 58 58 GLY HA3 H 58 3.608 4.056 -0.448 1 1 389 . 16 1 1 A 58 58 GLY CA C 58 42.856 45.596 -2.740 1 1 390 . 16 1 1 A 58 58 GLY N N 58 105.983 107.145 -1.162 1 1 391 . 16 1 1 A 59 59 ALA H H 59 8.203 7.692 0.511 1 1 392 . 16 1 1 A 59 59 ALA HA H 59 4.811 4.608 0.203 1 1 396 . 16 1 1 A 59 59 ALA CA C 59 47.662 51.489 -3.827 1 1 397 . 16 1 1 A 59 59 ALA CB C 59 20.147 22.773 -2.626 1 1 398 . 16 1 1 A 59 59 ALA N N 59 125.153 120.757 4.396 1 1 399 . 16 1 1 A 60 60 GLU H H 60 8.154 9.083 -0.929 1 1 400 . 16 1 1 A 60 60 GLU HA H 60 5.508 5.412 0.096 1 1 404 . 16 1 1 A 60 60 GLU CA C 60 52.179 54.479 -2.300 1 1 405 . 16 1 1 A 60 60 GLU CB C 60 30.203 34.389 -4.186 1 1 406 . 16 1 1 A 60 60 GLU N N 60 117.318 116.473 0.845 1 1 407 . 16 1 1 A 61 61 LYS H H 61 8.821 9.192 -0.371 1 1 408 . 16 1 1 A 61 61 LYS HA H 61 4.311 4.714 -0.403 1 1 413 . 16 1 1 A 61 61 LYS N N 61 123.743 120.586 3.157 1 1 414 . 16 1 1 A 62 62 THR H H 62 8.149 8.653 -0.504 1 1 415 . 16 1 1 A 62 62 THR HA H 62 4.928 4.586 0.342 1 1 420 . 16 1 1 A 62 62 THR CA C 62 59.427 62.985 -3.558 1 1 421 . 16 1 1 A 62 62 THR CB C 62 66.932 68.957 -2.025 1 1 422 . 16 1 1 A 62 62 THR N N 62 122.829 120.967 1.862 1 1 423 . 16 1 1 A 63 63 TYR H H 63 9.466 9.561 -0.095 1 1 424 . 16 1 1 A 63 63 TYR HA H 63 4.606 5.202 -0.596 1 1 431 . 16 1 1 A 63 63 TYR CA C 63 54.508 56.111 -1.603 1 1 432 . 16 1 1 A 63 63 TYR N N 63 127.472 129.015 -1.543 1 1 433 . 16 1 1 A 64 64 GLY H H 64 9.253 8.625 0.628 1 1 434 . 16 1 1 A 64 64 GLY HA2 H 64 4.670 4.258 0.412 1 1 435 . 16 1 1 A 64 64 GLY HA3 H 64 3.619 4.278 -0.659 1 1 436 . 16 1 1 A 64 64 GLY CA C 64 39.885 44.740 -4.855 1 1 437 . 16 1 1 A 64 64 GLY N N 64 110.182 111.886 -1.704 1 1 438 . 16 1 1 A 65 65 ASN H H 65 8.616 8.524 0.092 1 1 439 . 16 1 1 A 65 65 ASN HA H 65 4.109 4.392 -0.283 1 1 444 . 16 1 1 A 65 65 ASN CA C 65 53.691 54.834 -1.143 1 1 445 . 16 1 1 A 65 65 ASN N N 65 117.778 118.815 -1.037 1 1 447 . 16 1 1 A 66 66 GLY H H 66 9.053 8.946 0.107 1 1 448 . 16 1 1 A 66 66 GLY HA2 H 66 4.344 3.887 0.457 1 1 449 . 16 1 1 A 66 66 GLY HA3 H 66 3.359 3.889 -0.530 1 1 450 . 16 1 1 A 66 66 GLY CA C 66 42.431 44.864 -2.433 1 1 451 . 16 1 1 A 66 66 GLY N N 66 115.232 114.384 0.848 1 1 452 . 16 1 1 A 67 67 ASP H H 67 8.120 8.629 -0.509 1 1 453 . 16 1 1 A 67 67 ASP HA H 67 4.844 4.147 0.697 1 1 456 . 16 1 1 A 67 67 ASP N N 67 122.593 121.345 1.248 1 1 457 . 16 1 1 A 68 68 SER H H 68 8.500 8.298 0.202 1 1 458 . 16 1 1 A 68 68 SER HA H 68 5.088 5.123 -0.035 1 1 461 . 16 1 1 A 68 68 SER CA C 68 54.858 56.530 -1.672 1 1 462 . 16 1 1 A 68 68 SER CB C 68 62.114 66.545 -4.431 1 1 463 . 16 1 1 A 68 68 SER N N 68 113.557 116.914 -3.357 1 1 464 . 16 1 1 A 69 69 LEU H H 69 8.989 9.405 -0.416 1 1 465 . 16 1 1 A 69 69 LEU HA H 69 4.570 5.641 -1.071 1 1 474 . 16 1 1 A 69 69 LEU N N 69 126.836 124.641 2.195 1 1 475 . 16 1 1 A 70 70 ASN H H 70 8.491 8.657 -0.166 1 1 476 . 16 1 1 A 70 70 ASN HA H 70 4.958 5.065 -0.107 1 1 479 . 16 1 1 A 70 70 ASN CB C 70 33.265 40.731 -7.466 1 1 480 . 16 1 1 A 70 70 ASN N N 70 126.343 120.996 5.347 1 1 481 . 16 1 1 A 71 71 THR H H 71 7.831 8.492 -0.661 1 1 482 . 16 1 1 A 71 71 THR HA H 71 3.759 4.761 -1.002 1 1 487 . 16 1 1 A 71 71 THR CA C 71 61.005 60.186 0.819 1 1 488 . 16 1 1 A 71 71 THR N N 71 114.742 115.791 -1.049 1 1 489 . 16 1 1 A 72 72 GLY H H 72 8.880 8.521 0.359 1 1 490 . 16 1 1 A 72 72 GLY HA2 H 72 3.907 3.917 -0.010 1 1 491 . 16 1 1 A 72 72 GLY HA3 H 72 3.907 3.918 -0.011 1 1 492 . 16 1 1 A 72 72 GLY N N 72 114.976 110.751 4.225 1 1 493 . 16 1 1 A 73 73 LYS H H 73 6.604 7.690 -1.086 1 1 494 . 16 1 1 A 73 73 LYS HA H 73 4.160 4.372 -0.212 1 1 501 . 16 1 1 A 73 73 LYS N N 73 113.898 118.788 -4.890 1 1 502 . 16 1 1 A 74 74 LEU H H 74 7.422 7.077 0.345 1 1 503 . 16 1 1 A 74 74 LEU HA H 74 4.358 4.752 -0.394 1 1 513 . 16 1 1 A 74 74 LEU N N 74 117.180 114.452 2.728 1 1 514 . 16 1 1 A 75 75 LYS H H 75 8.617 8.335 0.282 1 1 515 . 16 1 1 A 75 75 LYS HA H 75 4.079 4.694 -0.615 1 1 518 . 16 1 1 A 75 75 LYS N N 75 121.119 118.528 2.591 1 1 519 . 16 1 1 A 76 76 ASN H H 76 8.154 8.408 -0.254 1 1 520 . 16 1 1 A 76 76 ASN HA H 76 3.935 4.961 -1.026 1 1 525 . 16 1 1 A 76 76 ASN CB C 76 35.772 39.569 -3.797 1 1 526 . 16 1 1 A 76 76 ASN N N 76 122.761 119.226 3.535 1 1 527 . 16 1 1 A 77 77 ASP H H 77 9.227 7.887 1.340 1 1 528 . 16 1 1 A 77 77 ASP HA H 77 3.787 5.033 -1.246 1 1 531 . 16 1 1 A 77 77 ASP CA C 77 52.584 53.305 -0.721 1 1 532 . 16 1 1 A 77 77 ASP N N 77 114.129 119.736 -5.607 1 1 533 . 16 1 1 A 78 78 LYS H H 78 6.579 7.646 -1.067 1 1 534 . 16 1 1 A 78 78 LYS HA H 78 4.572 4.735 -0.163 1 1 539 . 16 1 1 A 78 78 LYS CA C 78 51.072 54.211 -3.139 1 1 540 . 16 1 1 A 78 78 LYS CB C 78 33.783 36.760 -2.977 1 1 541 . 16 1 1 A 78 78 LYS N N 78 114.135 119.421 -5.286 1 1 542 . 16 1 1 A 79 79 VAL H H 79 8.729 8.190 0.539 1 1 543 . 16 1 1 A 79 79 VAL HA H 79 4.402 4.478 -0.076 1 1 551 . 16 1 1 A 79 79 VAL CA C 79 59.240 59.720 -0.480 1 1 553 . 16 1 1 A 79 79 VAL N N 79 123.191 119.993 3.198 1 1 554 . 16 1 1 A 80 80 SER H H 80 9.542 9.190 0.352 1 1 555 . 16 1 1 A 80 80 SER HA H 80 4.636 5.256 -0.620 1 1 558 . 16 1 1 A 80 80 SER CA C 80 55.978 57.743 -1.765 1 1 559 . 16 1 1 A 80 80 SER N N 80 127.445 121.307 6.138 1 1 560 . 16 1 1 A 81 81 ARG H H 81 8.093 8.899 -0.806 1 1 561 . 16 1 1 A 81 81 ARG HA H 81 5.210 5.709 -0.499 1 1 569 . 16 1 1 A 81 81 ARG N N 81 123.743 125.360 -1.617 1 1 571 . 16 1 1 A 82 82 PHE H H 82 9.312 8.144 1.168 1 1 572 . 16 1 1 A 82 82 PHE HA H 82 4.951 5.234 -0.283 1 1 577 . 16 1 1 A 82 82 PHE CA C 82 53.090 56.109 -3.019 1 1 578 . 16 1 1 A 82 82 PHE N N 82 119.529 117.163 2.366 1 1 579 . 16 1 1 A 83 83 ASP H H 83 9.122 8.623 0.499 1 1 580 . 16 1 1 A 83 83 ASP HA H 83 5.593 4.953 0.640 1 1 583 . 16 1 1 A 83 83 ASP N N 83 123.825 120.265 3.560 1 1 584 . 16 1 1 A 84 84 PHE H H 84 9.090 8.089 1.001 1 1 585 . 16 1 1 A 84 84 PHE HA H 84 6.410 6.160 0.250 1 1 592 . 16 1 1 A 84 84 PHE CA C 84 52.584 56.399 -3.815 1 1 593 . 16 1 1 A 84 84 PHE N N 84 118.862 116.841 2.021 1 1 594 . 16 1 1 A 85 85 ILE H H 85 8.441 8.419 0.022 1 1 595 . 16 1 1 A 85 85 ILE HA H 85 4.662 4.948 -0.286 1 1 605 . 16 1 1 A 85 85 ILE CB C 85 39.939 41.412 -1.473 1 1 608 . 16 1 1 A 85 85 ILE N N 85 118.049 119.772 -1.723 1 1 609 . 16 1 1 A 86 86 ARG H H 86 8.983 8.721 0.262 1 1 610 . 16 1 1 A 86 86 ARG HA H 86 5.591 4.911 0.680 1 1 616 . 16 1 1 A 86 86 ARG N N 86 127.006 127.970 -0.964 1 1 618 . 16 1 1 A 87 87 GLN H H 87 8.643 9.340 -0.697 1 1 619 . 16 1 1 A 87 87 GLN HA H 87 5.630 5.108 0.522 1 1 626 . 16 1 1 A 87 87 GLN CA C 87 51.512 54.277 -2.765 1 1 627 . 16 1 1 A 87 87 GLN N N 87 124.142 123.124 1.018 1 1 629 . 16 1 1 A 88 88 ILE H H 88 8.617 8.780 -0.163 1 1 630 . 16 1 1 A 88 88 ILE HA H 88 4.690 4.930 -0.240 1 1 637 . 16 1 1 A 88 88 ILE CA C 88 56.995 60.119 -3.124 1 1 638 . 16 1 1 A 88 88 ILE CB C 88 39.927 40.478 -0.551 1 1 641 . 16 1 1 A 88 88 ILE N N 88 116.353 125.579 -9.226 1 1 642 . 16 1 1 A 89 89 GLU H H 89 8.298 8.979 -0.681 1 1 643 . 16 1 1 A 89 89 GLU HA H 89 5.100 5.785 -0.685 1 1 646 . 16 1 1 A 89 89 GLU CA C 89 52.204 54.949 -2.745 1 1 647 . 16 1 1 A 89 89 GLU CB C 89 27.325 33.079 -5.754 1 1 648 . 16 1 1 A 89 89 GLU N N 89 124.458 130.069 -5.611 1 1 649 . 16 1 1 A 90 90 VAL H H 90 8.957 8.841 0.116 1 1 650 . 16 1 1 A 90 90 VAL HA H 90 4.169 4.624 -0.455 1 1 658 . 16 1 1 A 90 90 VAL CA C 90 58.664 59.781 -1.117 1 1 659 . 16 1 1 A 90 90 VAL CB C 90 31.861 34.057 -2.196 1 1 660 . 16 1 1 A 90 90 VAL N N 90 127.580 126.486 1.094 1 1 661 . 16 1 1 A 91 91 ASP H H 91 9.369 8.845 0.524 1 1 662 . 16 1 1 A 91 91 ASP HA H 91 4.287 4.412 -0.125 1 1 665 . 16 1 1 A 91 91 ASP CA C 91 52.389 53.712 -1.323 1 1 666 . 16 1 1 A 91 91 ASP CB C 91 36.409 39.675 -3.266 1 1 667 . 16 1 1 A 91 91 ASP N N 91 129.411 123.359 6.052 1 1 668 . 16 1 1 A 92 92 GLY H H 92 8.552 7.481 1.071 1 1 669 . 16 1 1 A 92 92 GLY HA2 H 92 4.090 4.083 0.007 1 1 670 . 16 1 1 A 92 92 GLY HA3 H 92 3.618 4.083 -0.465 1 1 671 . 16 1 1 A 92 92 GLY CA C 92 42.836 45.586 -2.750 1 1 672 . 16 1 1 A 92 92 GLY N N 92 103.862 106.532 -2.670 1 1 673 . 16 1 1 A 93 93 GLN H H 93 7.808 7.599 0.209 1 1 674 . 16 1 1 A 93 93 GLN HA H 93 4.578 4.794 -0.216 1 1 679 . 16 1 1 A 93 93 GLN CA C 93 50.918 54.307 -3.389 1 1 680 . 16 1 1 A 93 93 GLN CB C 93 28.602 31.075 -2.473 1 1 682 . 16 1 1 A 93 93 GLN N N 93 120.412 118.848 1.564 1 1 683 . 16 1 1 A 94 94 LEU H H 94 8.414 8.475 -0.061 1 1 684 . 16 1 1 A 94 94 LEU HA H 94 4.704 4.245 0.459 1 1 693 . 16 1 1 A 94 94 LEU CB C 94 39.873 42.551 -2.678 1 1 696 . 16 1 1 A 94 94 LEU N N 94 125.061 122.620 2.441 1 1 697 . 16 1 1 A 95 95 ILE H H 95 9.181 8.624 0.557 1 1 698 . 16 1 1 A 95 95 ILE HA H 95 4.371 5.129 -0.758 1 1 708 . 16 1 1 A 95 95 ILE CA C 95 63.319 60.758 2.561 1 1 709 . 16 1 1 A 95 95 ILE CB C 95 37.407 39.480 -2.073 1 1 711 . 16 1 1 A 95 95 ILE N N 95 127.724 121.727 5.997 1 1 712 . 16 1 1 A 96 96 THR H H 96 8.730 7.385 1.345 1 1 713 . 16 1 1 A 96 96 THR HA H 96 4.411 4.430 -0.019 1 1 718 . 16 1 1 A 96 96 THR CA C 96 60.344 62.947 -2.603 1 1 719 . 16 1 1 A 96 96 THR CB C 96 59.719 69.474 -9.755 1 1 720 . 16 1 1 A 96 96 THR N N 96 124.240 118.612 5.628 1 1 721 . 16 1 1 A 97 97 LEU H H 97 8.790 8.736 0.054 1 1 722 . 16 1 1 A 97 97 LEU HA H 97 4.400 4.976 -0.576 1 1 732 . 16 1 1 A 97 97 LEU N N 97 126.147 124.261 1.886 1 1 733 . 16 1 1 A 98 98 GLU H H 98 7.596 9.171 -1.575 1 1 734 . 16 1 1 A 98 98 GLU HA H 98 5.102 5.171 -0.069 1 1 739 . 16 1 1 A 98 98 GLU N N 98 116.937 126.382 -9.445 1 1 740 . 16 1 1 A 99 99 SER H H 99 8.906 8.677 0.229 1 1 741 . 16 1 1 A 99 99 SER HA H 99 4.504 5.212 -0.708 1 1 744 . 16 1 1 A 99 99 SER CA C 99 54.010 56.129 -2.119 1 1 745 . 16 1 1 A 99 99 SER CB C 99 63.876 66.917 -3.041 1 1 746 . 16 1 1 A 99 99 SER N N 99 117.823 118.552 -0.729 1 1 747 . 16 1 1 A 100 100 GLY H H 100 7.250 7.890 -0.640 1 1 748 . 16 1 1 A 100 100 GLY HA2 H 100 4.872 3.936 0.936 1 1 749 . 16 1 1 A 100 100 GLY HA3 H 100 3.731 4.048 -0.317 1 1 750 . 16 1 1 A 100 100 GLY N N 100 109.436 109.907 -0.471 1 1 751 . 16 1 1 A 101 101 GLU H H 101 9.661 9.318 0.343 1 1 752 . 16 1 1 A 101 101 GLU HA H 101 5.643 4.979 0.664 1 1 757 . 16 1 1 A 101 101 GLU CA C 101 52.584 54.774 -2.190 1 1 758 . 16 1 1 A 101 101 GLU CB C 101 31.750 33.288 -1.538 1 1 759 . 16 1 1 A 101 101 GLU N N 101 126.793 121.192 5.601 1 1 760 . 16 1 1 A 102 102 PHE H H 102 10.441 8.279 2.162 1 1 761 . 16 1 1 A 102 102 PHE HA H 102 5.248 5.246 0.002 1 1 768 . 16 1 1 A 102 102 PHE CA C 102 53.537 56.184 -2.647 1 1 769 . 16 1 1 A 102 102 PHE N N 102 131.837 125.811 6.026 1 1 770 . 16 1 1 A 103 103 GLN H H 103 9.135 9.896 -0.761 1 1 771 . 16 1 1 A 103 103 GLN HA H 103 5.205 4.927 0.278 1 1 776 . 16 1 1 A 103 103 GLN CA C 103 50.925 54.547 -3.622 1 1 777 . 16 1 1 A 103 103 GLN N N 103 127.720 125.622 2.098 1 1 778 . 16 1 1 A 104 104 VAL H H 104 8.937 9.280 -0.343 1 1 779 . 16 1 1 A 104 104 VAL HA H 104 4.780 4.880 -0.100 1 1 787 . 16 1 1 A 104 104 VAL CA C 104 57.086 61.251 -4.165 1 1 789 . 16 1 1 A 104 104 VAL N N 104 120.097 125.330 -5.233 1 1 790 . 16 1 1 A 105 105 TYR H H 105 9.108 9.340 -0.232 1 1 791 . 16 1 1 A 105 105 TYR HA H 105 4.834 5.071 -0.237 1 1 798 . 16 1 1 A 105 105 TYR CA C 105 54.486 57.917 -3.431 1 1 799 . 16 1 1 A 105 105 TYR N N 105 128.426 129.165 -0.739 1 1 800 . 16 1 1 A 106 106 LYS H H 106 5.945 8.970 -3.025 1 1 805 . 16 1 1 A 106 106 LYS N N 106 129.163 125.937 3.226 1 1 806 . 16 1 1 A 107 107 GLN H H 107 8.526 8.616 -0.090 1 1 807 . 16 1 1 A 107 107 GLN HA H 107 5.160 5.491 -0.331 1 1 812 . 16 1 1 A 107 107 GLN CA C 107 52.584 54.723 -2.139 1 1 813 . 16 1 1 A 107 107 GLN CB C 107 26.175 30.366 -4.191 1 1 814 . 16 1 1 A 107 107 GLN N N 107 125.978 122.376 3.602 1 1 815 . 16 1 1 A 108 108 SER H H 108 8.621 8.800 -0.179 1 1 816 . 16 1 1 A 108 108 SER HA H 108 4.403 4.331 0.072 1 1 819 . 16 1 1 A 108 108 SER CA C 108 58.521 60.493 -1.972 1 1 820 . 16 1 1 A 108 108 SER CB C 108 60.737 63.560 -2.823 1 1 821 . 16 1 1 A 108 108 SER N N 108 117.542 115.770 1.772 1 1 822 . 16 1 1 A 109 109 HIS H H 109 10.381 8.148 2.233 1 1 823 . 16 1 1 A 109 109 HIS HA H 109 4.594 4.797 -0.203 1 1 828 . 16 1 1 A 109 109 HIS CA C 109 51.743 56.582 -4.839 1 1 829 . 16 1 1 A 109 109 HIS CB C 109 27.174 31.899 -4.725 1 1 830 . 16 1 1 A 109 109 HIS N N 109 118.449 118.218 0.231 1 1 831 . 16 1 1 A 110 110 SER H H 110 7.366 7.938 -0.572 1 1 832 . 16 1 1 A 110 110 SER HA H 110 4.870 4.825 0.045 1 1 835 . 16 1 1 A 110 110 SER CB C 110 62.986 64.796 -1.810 1 1 836 . 16 1 1 A 110 110 SER N N 110 113.397 112.288 1.109 1 1 837 . 16 1 1 A 111 111 ALA H H 111 8.541 8.689 -0.148 1 1 838 . 16 1 1 A 111 111 ALA HA H 111 4.826 5.006 -0.180 1 1 842 . 16 1 1 A 111 111 ALA CA C 111 49.015 51.754 -2.739 1 1 843 . 16 1 1 A 111 111 ALA CB C 111 20.256 23.121 -2.865 1 1 844 . 16 1 1 A 111 111 ALA N N 111 117.786 121.252 -3.466 1 1 845 . 16 1 1 A 112 112 LEU H H 112 8.529 9.521 -0.992 1 1 846 . 16 1 1 A 112 112 LEU HA H 112 5.680 5.166 0.514 1 1 855 . 16 1 1 A 112 112 LEU CA C 112 51.818 53.412 -1.594 1 1 856 . 16 1 1 A 112 112 LEU N N 112 116.345 119.574 -3.229 1 1 857 . 16 1 1 A 113 113 THR H H 113 8.758 9.036 -0.278 1 1 858 . 16 1 1 A 113 113 THR HA H 113 5.563 5.160 0.403 1 1 863 . 16 1 1 A 113 113 THR CA C 113 54.458 60.951 -6.493 1 1 864 . 16 1 1 A 113 113 THR CB C 113 68.586 73.390 -4.804 1 1 866 . 16 1 1 A 113 113 THR N N 113 110.469 114.504 -4.035 1 1 867 . 16 1 1 A 114 114 ALA H H 114 8.829 8.751 0.078 1 1 868 . 16 1 1 A 114 114 ALA HA H 114 4.466 4.954 -0.488 1 1 872 . 16 1 1 A 114 114 ALA CA C 114 48.886 51.994 -3.108 1 1 873 . 16 1 1 A 114 114 ALA CB C 114 21.583 21.554 0.029 1 1 874 . 16 1 1 A 114 114 ALA N N 114 121.456 123.494 -2.038 1 1 875 . 16 1 1 A 115 115 LEU H H 115 8.407 8.958 -0.551 1 1 876 . 16 1 1 A 115 115 LEU HA H 115 4.814 4.616 0.198 1 1 886 . 16 1 1 A 115 115 LEU N N 115 119.223 123.847 -4.624 1 1 887 . 16 1 1 A 116 116 GLN H H 116 9.720 9.044 0.676 1 1 888 . 16 1 1 A 116 116 GLN HA H 116 5.312 5.168 0.144 1 1 893 . 16 1 1 A 116 116 GLN CA C 116 50.544 54.017 -3.473 1 1 894 . 16 1 1 A 116 116 GLN N N 116 127.827 125.881 1.946 1 1 895 . 16 1 1 A 117 117 THR H H 117 9.663 9.339 0.324 1 1 896 . 16 1 1 A 117 117 THR HA H 117 4.198 4.748 -0.550 1 1 901 . 16 1 1 A 117 117 THR CA C 117 64.037 61.071 2.966 1 1 902 . 16 1 1 A 117 117 THR CB C 117 66.868 71.587 -4.719 1 1 904 . 16 1 1 A 117 117 THR N N 117 128.929 121.989 6.940 1 1 905 . 16 1 1 A 118 118 GLU H H 118 9.486 8.902 0.584 1 1 906 . 16 1 1 A 118 118 GLU HA H 118 4.885 4.464 0.421 1 1 911 . 16 1 1 A 118 118 GLU N N 118 123.497 124.596 -1.099 1 1 912 . 16 1 1 A 119 119 GLN H H 119 8.076 7.434 0.642 1 1 913 . 16 1 1 A 119 119 GLN HA H 119 5.331 4.758 0.573 1 1 916 . 16 1 1 A 119 119 GLN CA C 119 51.858 54.302 -2.444 1 1 917 . 16 1 1 A 119 119 GLN N N 119 118.023 117.190 0.833 1 1 918 . 16 1 1 A 120 120 GLU H H 120 9.078 9.758 -0.680 1 1 919 . 16 1 1 A 120 120 GLU HA H 120 5.071 5.216 -0.145 1 1 924 . 16 1 1 A 120 120 GLU N N 120 118.433 118.817 -0.384 1 1 925 . 16 1 1 A 121 121 GLN H H 121 7.711 8.757 -1.046 1 1 926 . 16 1 1 A 121 121 GLN HA H 121 4.430 5.202 -0.772 1 1 933 . 16 1 1 A 121 121 GLN CA C 121 53.996 54.435 -0.439 1 1 934 . 16 1 1 A 121 121 GLN CB C 121 27.158 32.119 -4.961 1 1 936 . 16 1 1 A 121 121 GLN N N 121 122.412 121.375 1.037 1 1 938 . 16 1 1 A 122 122 ASP H H 122 8.675 10.319 -1.644 1 1 939 . 16 1 1 A 122 122 ASP HA H 122 4.632 5.259 -0.627 1 1 942 . 16 1 1 A 122 122 ASP CA C 122 48.797 50.415 -1.618 1 1 943 . 16 1 1 A 122 122 ASP CB C 122 39.852 42.963 -3.111 1 1 944 . 16 1 1 A 122 122 ASP N N 122 128.625 123.066 5.559 1 1 945 . 16 1 1 A 123 123 PRO CA C 123 61.579 62.808 -1.229 1 1 946 . 16 1 1 A 123 123 PRO CB C 123 29.597 29.830 -0.233 1 1 948 . 16 1 1 A 124 124 GLU H H 124 8.297 8.720 -0.423 1 1 949 . 16 1 1 A 124 124 GLU HA H 124 4.196 3.855 0.341 1 1 954 . 16 1 1 A 124 124 GLU CA C 124 53.025 58.269 -5.244 1 1 955 . 16 1 1 A 124 124 GLU CB C 124 27.927 30.967 -3.040 1 1 957 . 16 1 1 A 124 124 GLU N N 124 115.538 121.597 -6.059 1 1 958 . 16 1 1 A 125 125 HIS H H 125 7.419 7.724 -0.305 1 1 959 . 16 1 1 A 125 125 HIS HA H 125 4.833 4.751 0.082 1 1 964 . 16 1 1 A 125 125 HIS CA C 125 51.886 56.953 -5.067 1 1 965 . 16 1 1 A 125 125 HIS CB C 125 26.387 31.770 -5.383 1 1 966 . 16 1 1 A 125 125 HIS N N 125 117.464 113.645 3.819 1 1 967 . 16 1 1 A 126 126 SER H H 126 8.441 8.277 0.164 1 1 968 . 16 1 1 A 126 126 SER HA H 126 4.261 4.732 -0.471 1 1 971 . 16 1 1 A 126 126 SER CA C 126 57.988 57.215 0.773 1 1 972 . 16 1 1 A 126 126 SER N N 126 117.954 112.579 5.375 1 1 973 . 16 1 1 A 127 127 GLU H H 127 9.221 7.959 1.262 1 1 974 . 16 1 1 A 127 127 GLU HA H 127 4.366 4.577 -0.211 1 1 979 . 16 1 1 A 127 127 GLU CA C 127 53.707 56.215 -2.508 1 1 980 . 16 1 1 A 127 127 GLU CB C 127 25.492 30.251 -4.759 1 1 981 . 16 1 1 A 127 127 GLU N N 127 120.404 121.121 -0.717 1 1 982 . 16 1 1 A 128 128 LYS H H 128 8.262 8.143 0.119 1 1 983 . 16 1 1 A 128 128 LYS HA H 128 4.661 4.078 0.583 1 1 990 . 16 1 1 A 128 128 LYS CA C 128 52.264 58.287 -6.023 1 1 991 . 16 1 1 A 128 128 LYS CB C 128 32.404 31.850 0.554 1 1 994 . 16 1 1 A 128 128 LYS N N 128 122.166 117.847 4.319 1 1 995 . 16 1 1 A 129 129 MET H H 129 8.242 7.737 0.505 1 1 996 . 16 1 1 A 129 129 MET HA H 129 5.012 4.931 0.081 1 1 1001 . 16 1 1 A 129 129 MET CA C 129 50.958 54.126 -3.168 1 1 1003 . 16 1 1 A 129 129 MET N N 129 119.422 115.374 4.048 1 1 1004 . 16 1 1 A 130 130 VAL H H 130 9.200 9.606 -0.406 1 1 1005 . 16 1 1 A 130 130 VAL HA H 130 4.609 4.763 -0.154 1 1 1013 . 16 1 1 A 130 130 VAL CA C 130 56.296 60.340 -4.044 1 1 1014 . 16 1 1 A 130 130 VAL CB C 130 32.606 36.562 -3.956 1 1 1015 . 16 1 1 A 130 130 VAL N N 130 118.290 121.428 -3.138 1 1 1016 . 16 1 1 A 131 131 ALA H H 131 8.368 8.729 -0.361 1 1 1017 . 16 1 1 A 131 131 ALA HA H 131 4.654 5.181 -0.527 1 1 1021 . 16 1 1 A 131 131 ALA CA C 131 49.739 51.372 -1.633 1 1 1022 . 16 1 1 A 131 131 ALA CB C 131 15.351 21.442 -6.091 1 1 1023 . 16 1 1 A 131 131 ALA N N 131 126.734 125.531 1.203 1 1 1024 . 16 1 1 A 132 132 LYS H H 132 7.732 8.500 -0.768 1 1 1025 . 16 1 1 A 132 132 LYS HA H 132 4.171 5.003 -0.832 1 1 1028 . 16 1 1 A 132 132 LYS N N 132 127.309 120.728 6.581 1 1 1029 . 16 1 1 A 133 133 ARG H H 133 8.193 8.342 -0.149 1 1 1030 . 16 1 1 A 133 133 ARG HA H 133 5.073 5.168 -0.095 1 1 1038 . 16 1 1 A 133 133 ARG N N 133 122.190 119.334 2.856 1 1 1040 . 16 1 1 A 134 134 ARG H H 134 7.539 8.767 -1.228 1 1 1041 . 16 1 1 A 134 134 ARG HA H 134 4.667 4.630 0.037 1 1 1049 . 16 1 1 A 134 134 ARG CA C 134 52.584 54.972 -2.388 1 1 1050 . 16 1 1 A 134 134 ARG CB C 134 31.325 33.368 -2.043 1 1 1052 . 16 1 1 A 134 134 ARG N N 134 121.632 124.423 -2.791 1 1 1054 . 16 1 1 A 135 135 PHE H H 135 8.816 7.678 1.138 1 1 1055 . 16 1 1 A 135 135 PHE HA H 135 5.680 6.082 -0.402 1 1 1062 . 16 1 1 A 135 135 PHE N N 135 125.107 122.153 2.954 1 1 1063 . 16 1 1 A 136 136 ARG H H 136 7.741 9.874 -2.133 1 1 1064 . 16 1 1 A 136 136 ARG HA H 136 4.402 4.744 -0.342 1 1 1068 . 16 1 1 A 136 136 ARG N N 136 125.640 122.797 2.843 1 1 1070 . 16 1 1 A 137 137 ILE H H 137 8.556 8.772 -0.216 1 1 1071 . 16 1 1 A 137 137 ILE HA H 137 3.912 4.458 -0.546 1 1 1076 . 16 1 1 A 137 137 ILE CA C 137 55.676 60.846 -5.170 1 1 1079 . 16 1 1 A 137 137 ILE N N 137 122.891 122.486 0.405 1 1 1080 . 16 1 1 A 138 138 GLY H H 138 8.676 8.564 0.112 1 1 1081 . 16 1 1 A 138 138 GLY HA2 H 138 3.740 4.441 -0.701 1 1 1082 . 16 1 1 A 138 138 GLY HA3 H 138 2.982 4.452 -1.470 1 1 1083 . 16 1 1 A 138 138 GLY CA C 138 41.908 44.636 -2.728 1 1 1084 . 16 1 1 A 138 138 GLY N N 138 117.058 112.623 4.435 1 1 1085 . 16 1 1 A 139 139 ASP H H 139 7.858 8.932 -1.074 1 1 1086 . 16 1 1 A 139 139 ASP HA H 139 4.753 5.429 -0.676 1 1 1089 . 16 1 1 A 139 139 ASP CA C 139 52.584 53.287 -0.703 1 1 1090 . 16 1 1 A 139 139 ASP CB C 139 43.062 44.484 -1.422 1 1 1091 . 16 1 1 A 139 139 ASP N N 139 124.516 118.895 5.621 1 1 1092 . 16 1 1 A 140 140 ILE H H 140 8.354 9.278 -0.924 1 1 1093 . 16 1 1 A 140 140 ILE HA H 140 4.473 4.632 -0.159 1 1 1103 . 16 1 1 A 140 140 ILE CB C 140 36.173 38.740 -2.567 1 1 1105 . 16 1 1 A 140 140 ILE N N 140 120.679 120.823 -0.144 1 1 1106 . 16 1 1 A 141 141 ALA H H 141 8.708 8.438 0.270 1 1 1107 . 16 1 1 A 141 141 ALA HA H 141 4.862 5.724 -0.862 1 1 1111 . 16 1 1 A 141 141 ALA CA C 141 47.968 50.030 -2.062 1 1 1112 . 16 1 1 A 141 141 ALA CB C 141 21.733 20.810 0.923 1 1 1113 . 16 1 1 A 141 141 ALA N N 141 130.144 130.510 -0.366 1 1 1114 . 16 1 1 A 142 142 GLY H H 142 7.888 8.885 -0.997 1 1 1115 . 16 1 1 A 142 142 GLY HA2 H 142 4.519 3.950 0.569 1 1 1116 . 16 1 1 A 142 142 GLY HA3 H 142 3.634 3.956 -0.322 1 1 1117 . 16 1 1 A 142 142 GLY N N 142 102.272 110.283 -8.011 1 1 1118 . 16 1 1 A 143 143 GLU H H 143 8.068 8.825 -0.757 1 1 1119 . 16 1 1 A 143 143 GLU HA H 143 4.577 4.448 0.129 1 1 1124 . 16 1 1 A 143 143 GLU N N 143 120.569 123.461 -2.892 1 1 1125 . 16 1 1 A 144 144 HIS H H 144 8.478 8.246 0.232 1 1 1126 . 16 1 1 A 144 144 HIS HA H 144 4.968 4.934 0.034 1 1 1131 . 16 1 1 A 144 144 HIS N N 144 124.275 120.566 3.709 1 1 1132 . 16 1 1 A 145 145 THR H H 145 9.031 7.725 1.306 1 1 1133 . 16 1 1 A 145 145 THR HA H 145 4.025 4.941 -0.916 1 1 1138 . 16 1 1 A 145 145 THR CA C 145 61.247 60.481 0.766 1 1 1139 . 16 1 1 A 145 145 THR CB C 145 65.181 70.829 -5.648 1 1 1141 . 16 1 1 A 145 145 THR N N 145 125.828 115.380 10.448 1 1 1142 . 16 1 1 A 146 146 SER H H 146 9.077 9.064 0.013 1 1 1143 . 16 1 1 A 146 146 SER HA H 146 4.684 4.673 0.011 1 1 1145 . 16 1 1 A 146 146 SER CA C 146 56.067 58.455 -2.388 1 1 1146 . 16 1 1 A 146 146 SER CB C 146 60.510 64.377 -3.867 1 1 1147 . 16 1 1 A 146 146 SER N N 146 124.154 124.858 -0.704 1 1 1148 . 16 1 1 A 147 147 PHE H H 147 9.049 8.940 0.109 1 1 1149 . 16 1 1 A 147 147 PHE HA H 147 4.022 4.506 -0.484 1 1 1154 . 16 1 1 A 147 147 PHE N N 147 127.670 126.039 1.631 1 1 1155 . 16 1 1 A 148 148 ASP H H 148 8.504 8.326 0.178 1 1 1156 . 16 1 1 A 148 148 ASP HA H 148 4.422 4.779 -0.357 1 1 1158 . 16 1 1 A 148 148 ASP CA C 148 52.584 53.618 -1.034 1 1 1159 . 16 1 1 A 148 148 ASP CB C 148 37.800 41.392 -3.592 1 1 1160 . 16 1 1 A 148 148 ASP N N 148 114.377 120.351 -5.974 1 1 1161 . 16 1 1 A 149 149 LYS H H 149 7.380 8.037 -0.657 1 1 1162 . 16 1 1 A 149 149 LYS HA H 149 4.487 4.530 -0.043 1 1 1171 . 16 1 1 A 149 149 LYS CA C 149 51.735 56.468 -4.733 1 1 1172 . 16 1 1 A 149 149 LYS CB C 149 30.162 33.842 -3.680 1 1 1175 . 16 1 1 A 149 149 LYS N N 149 119.137 118.148 0.989 1 1 1176 . 16 1 1 A 150 150 LEU H H 150 6.886 8.093 -1.207 1 1 1177 . 16 1 1 A 150 150 LEU HA H 150 3.996 4.611 -0.615 1 1 1186 . 16 1 1 A 150 150 LEU CA C 150 50.502 56.215 -5.713 1 1 1187 . 16 1 1 A 150 150 LEU N N 150 120.614 120.768 -0.154 1 1 1188 . 16 1 1 A 151 151 PRO CB C 151 29.567 32.355 -2.788 1 1 1190 . 16 1 1 A 152 152 LYS H H 152 8.076 8.716 -0.640 1 1 1191 . 16 1 1 A 152 152 LYS HA H 152 4.346 4.554 -0.208 1 1 1195 . 16 1 1 A 152 152 LYS CA C 152 53.182 57.027 -3.845 1 1 1196 . 16 1 1 A 152 152 LYS CB C 152 31.487 34.864 -3.377 1 1 1198 . 16 1 1 A 152 152 LYS N N 152 118.133 118.186 -0.053 1 1 1199 . 16 1 1 A 153 153 ASP H H 153 7.982 8.109 -0.127 1 1 1200 . 16 1 1 A 153 153 ASP HA H 153 4.402 5.051 -0.649 1 1 1203 . 16 1 1 A 153 153 ASP CA C 153 52.584 53.314 -0.730 1 1 1204 . 16 1 1 A 153 153 ASP CB C 153 37.762 41.181 -3.419 1 1 1205 . 16 1 1 A 153 153 ASP N N 153 115.735 114.081 1.654 1 1 1206 . 16 1 1 A 154 154 VAL H H 154 6.987 7.678 -0.691 1 1 1207 . 16 1 1 A 154 154 VAL HA H 154 4.406 4.564 -0.158 1 1 1215 . 16 1 1 A 154 154 VAL CA C 154 58.408 61.165 -2.757 1 1 1216 . 16 1 1 A 154 154 VAL CB C 154 32.617 33.691 -1.074 1 1 1217 . 16 1 1 A 154 154 VAL N N 154 116.266 120.555 -4.289 1 1 1218 . 16 1 1 A 155 155 MET H H 155 8.444 8.919 -0.475 1 1 1219 . 16 1 1 A 155 155 MET HA H 155 5.416 5.837 -0.421 1 1 1224 . 16 1 1 A 155 155 MET CA C 155 51.183 54.036 -2.853 1 1 1226 . 16 1 1 A 155 155 MET N N 155 124.950 123.401 1.549 1 1 1227 . 16 1 1 A 156 156 ALA H H 156 9.226 8.120 1.106 1 1 1228 . 16 1 1 A 156 156 ALA HA H 156 4.693 4.696 -0.003 1 1 1232 . 16 1 1 A 156 156 ALA CA C 156 48.379 51.064 -2.685 1 1 1233 . 16 1 1 A 156 156 ALA CB C 156 21.051 19.360 1.691 1 1 1234 . 16 1 1 A 156 156 ALA N N 156 129.938 127.168 2.770 1 1 1235 . 16 1 1 A 157 157 THR H H 157 8.554 8.380 0.174 1 1 1236 . 16 1 1 A 157 157 THR HA H 157 4.839 4.196 0.643 1 1 1241 . 16 1 1 A 157 157 THR CA C 157 59.555 63.879 -4.324 1 1 1242 . 16 1 1 A 157 157 THR CB C 157 68.575 69.681 -1.106 1 1 1244 . 16 1 1 A 157 157 THR N N 157 118.815 119.169 -0.354 1 1 1245 . 16 1 1 A 158 158 TYR H H 158 9.974 9.990 -0.016 1 1 1246 . 16 1 1 A 158 158 TYR HA H 158 4.435 5.955 -1.520 1 1 1253 . 16 1 1 A 158 158 TYR N N 158 126.958 123.886 3.072 1 1 1254 . 16 1 1 A 159 159 ARG H H 159 8.909 8.780 0.129 1 1 1255 . 16 1 1 A 159 159 ARG HA H 159 5.444 5.375 0.069 1 1 1263 . 16 1 1 A 159 159 ARG CA C 159 51.933 54.222 -2.289 1 1 1264 . 16 1 1 A 159 159 ARG N N 159 121.721 121.339 0.382 1 1 1266 . 16 1 1 A 160 160 GLY H H 160 8.910 9.360 -0.450 1 1 1267 . 16 1 1 A 160 160 GLY HA2 H 160 4.904 4.511 0.393 1 1 1268 . 16 1 1 A 160 160 GLY HA3 H 160 4.484 4.662 -0.178 1 1 1269 . 16 1 1 A 160 160 GLY N N 160 113.921 107.022 6.899 1 1 1270 . 16 1 1 A 161 161 THR H H 161 9.110 9.475 -0.365 1 1 1271 . 16 1 1 A 161 161 THR HA H 161 4.810 5.340 -0.530 1 1 1276 . 16 1 1 A 161 161 THR CA C 161 59.603 61.075 -1.472 1 1 1277 . 16 1 1 A 161 161 THR CB C 161 69.909 72.798 -2.889 1 1 1279 . 16 1 1 A 161 161 THR N N 161 126.813 115.644 11.169 1 1 1280 . 16 1 1 A 162 162 ALA H H 162 7.137 9.718 -2.581 1 1 1281 . 16 1 1 A 162 162 ALA HA H 162 5.361 5.490 -0.129 1 1 1285 . 16 1 1 A 162 162 ALA CA C 162 46.573 50.997 -4.424 1 1 1286 . 16 1 1 A 162 162 ALA CB C 162 20.959 23.828 -2.869 1 1 1287 . 16 1 1 A 162 162 ALA N N 162 128.111 123.626 4.485 1 1 1288 . 16 1 1 A 163 163 PHE H H 163 8.587 9.428 -0.841 1 1 1289 . 16 1 1 A 163 163 PHE HA H 163 5.538 4.982 0.556 1 1 1296 . 16 1 1 A 163 163 PHE N N 163 117.349 114.937 2.412 1 1 1297 . 16 1 1 A 164 164 GLY H H 164 8.650 8.840 -0.190 1 1 1298 . 16 1 1 A 164 164 GLY HA2 H 164 4.210 4.389 -0.179 1 1 1299 . 16 1 1 A 164 164 GLY HA3 H 164 3.285 4.424 -1.139 1 1 1300 . 16 1 1 A 164 164 GLY CA C 164 40.377 43.964 -3.587 1 1 1301 . 16 1 1 A 164 164 GLY N N 164 108.839 109.088 -0.249 1 1 1302 . 16 1 1 A 165 165 SER H H 165 7.684 8.913 -1.229 1 1 1303 . 16 1 1 A 165 165 SER HA H 165 3.458 4.420 -0.962 1 1 1304 . 16 1 1 A 165 165 SER N N 165 116.037 117.212 -1.175 1 1 1305 . 16 1 1 A 166 166 ASP H H 166 9.718 7.840 1.878 1 1 1306 . 16 1 1 A 166 166 ASP HA H 166 4.281 4.702 -0.421 1 1 1309 . 16 1 1 A 166 166 ASP CA C 166 52.584 53.882 -1.298 1 1 1310 . 16 1 1 A 166 166 ASP N N 166 125.166 119.226 5.940 1 1 1311 . 16 1 1 A 167 167 ASP H H 167 7.655 7.506 0.149 1 1 1312 . 16 1 1 A 167 167 ASP HA H 167 4.666 4.973 -0.307 1 1 1315 . 16 1 1 A 167 167 ASP CB C 167 38.948 43.697 -4.749 1 1 1316 . 16 1 1 A 167 167 ASP N N 167 117.491 120.200 -2.709 1 1 1317 . 16 1 1 A 168 168 ALA H H 168 8.585 8.549 0.036 1 1 1318 . 16 1 1 A 168 168 ALA HA H 168 5.012 4.005 1.007 1 1 1322 . 16 1 1 A 168 168 ALA CA C 168 47.485 52.736 -5.251 1 1 1323 . 16 1 1 A 168 168 ALA N N 168 128.834 123.452 5.382 1 1 1324 . 16 1 1 A 169 169 GLY H H 169 8.472 7.277 1.195 1 1 1325 . 16 1 1 A 169 169 GLY HA2 H 169 4.404 2.866 1.538 1 1 1326 . 16 1 1 A 169 169 GLY HA3 H 169 4.051 3.337 0.714 1 1 1327 . 16 1 1 A 169 169 GLY CA C 169 43.257 45.272 -2.015 1 1 1328 . 16 1 1 A 169 169 GLY N N 169 107.133 103.256 3.877 1 1 1329 . 16 1 1 A 170 170 GLY H H 170 7.229 8.117 -0.888 1 1 1330 . 16 1 1 A 170 170 GLY HA2 H 170 4.223 4.202 0.021 1 1 1331 . 16 1 1 A 170 170 GLY HA3 H 170 3.781 4.213 -0.432 1 1 1332 . 16 1 1 A 170 170 GLY CA C 170 43.310 45.866 -2.556 1 1 1333 . 16 1 1 A 170 170 GLY N N 170 107.542 109.689 -2.147 1 1 1334 . 16 1 1 A 171 171 LYS H H 171 9.641 8.438 1.203 1 1 1335 . 16 1 1 A 171 171 LYS HA H 171 5.129 5.004 0.125 1 1 1342 . 16 1 1 A 171 171 LYS CA C 171 51.355 54.844 -3.489 1 1 1343 . 16 1 1 A 171 171 LYS N N 171 124.322 120.454 3.868 1 1 1344 . 16 1 1 A 172 172 LEU H H 172 7.764 8.824 -1.060 1 1 1345 . 16 1 1 A 172 172 LEU HA H 172 4.973 6.030 -1.057 1 1 1353 . 16 1 1 A 172 172 LEU CA C 172 50.348 52.906 -2.558 1 1 1354 . 16 1 1 A 172 172 LEU N N 172 126.389 121.133 5.256 1 1 1355 . 16 1 1 A 173 173 THR H H 173 8.321 7.591 0.730 1 1 1356 . 16 1 1 A 173 173 THR HA H 173 5.017 4.787 0.230 1 1 1361 . 16 1 1 A 173 173 THR CA C 173 59.149 61.147 -1.998 1 1 1362 . 16 1 1 A 173 173 THR CB C 173 67.449 70.754 -3.305 1 1 1364 . 16 1 1 A 173 173 THR N N 173 123.553 115.719 7.834 1 1 1365 . 16 1 1 A 174 174 TYR H H 174 9.367 9.358 0.009 1 1 1366 . 16 1 1 A 174 174 TYR HA H 174 4.660 5.189 -0.529 1 1 1373 . 16 1 1 A 174 174 TYR CB C 174 41.267 42.815 -1.548 1 1 1374 . 16 1 1 A 174 174 TYR N N 174 129.583 125.235 4.348 1 1 1375 . 16 1 1 A 175 175 THR H H 175 8.529 8.677 -0.148 1 1 1376 . 16 1 1 A 175 175 THR HA H 175 5.388 4.880 0.508 1 1 1381 . 16 1 1 A 175 175 THR CA C 175 58.216 62.209 -3.993 1 1 1382 . 16 1 1 A 175 175 THR CB C 175 68.575 69.545 -0.970 1 1 1384 . 16 1 1 A 175 175 THR N N 175 125.967 117.125 8.842 1 1 1385 . 16 1 1 A 176 176 ILE H H 176 9.139 8.830 0.309 1 1 1386 . 16 1 1 A 176 176 ILE HA H 176 4.382 4.701 -0.319 1 1 1395 . 16 1 1 A 176 176 ILE CA C 176 58.006 59.015 -1.009 1 1 1396 . 16 1 1 A 176 176 ILE CB C 176 38.881 39.935 -1.054 1 1 1400 . 16 1 1 A 176 176 ILE N N 176 123.715 128.803 -5.088 1 1 1401 . 16 1 1 A 177 177 ASP H H 177 8.501 8.366 0.135 1 1 1402 . 16 1 1 A 177 177 ASP HA H 177 5.011 5.782 -0.771 1 1 1405 . 16 1 1 A 177 177 ASP CA C 177 49.089 52.118 -3.029 1 1 1406 . 16 1 1 A 177 177 ASP CB C 177 39.282 44.178 -4.896 1 1 1407 . 16 1 1 A 177 177 ASP N N 177 125.978 123.756 2.222 1 1 1408 . 16 1 1 A 178 178 PHE H H 178 8.913 9.030 -0.117 1 1 1409 . 16 1 1 A 178 178 PHE HA H 178 3.993 5.159 -1.166 1 1 1414 . 16 1 1 A 178 178 PHE CB C 178 34.588 39.983 -5.395 1 1 1415 . 16 1 1 A 178 178 PHE N N 178 123.522 125.083 -1.561 1 1 1416 . 16 1 1 A 179 179 ALA H H 179 8.487 8.973 -0.486 1 1 1417 . 16 1 1 A 179 179 ALA HA H 179 4.528 4.180 0.348 1 1 1421 . 16 1 1 A 179 179 ALA CA C 179 52.584 55.554 -2.970 1 1 1422 . 16 1 1 A 179 179 ALA CB C 179 15.666 18.657 -2.991 1 1 1423 . 16 1 1 A 179 179 ALA N N 179 124.061 123.650 0.411 1 1 1424 . 16 1 1 A 180 180 ALA H H 180 7.162 7.962 -0.800 1 1 1425 . 16 1 1 A 180 180 ALA HA H 180 4.313 4.401 -0.088 1 1 1429 . 16 1 1 A 180 180 ALA CA C 180 49.006 51.409 -2.403 1 1 1430 . 16 1 1 A 180 180 ALA CB C 180 16.933 17.335 -0.402 1 1 1431 . 16 1 1 A 180 180 ALA N N 180 119.710 118.997 0.713 1 1 1432 . 16 1 1 A 181 181 LYS H H 181 8.092 9.663 -1.571 1 1 1433 . 16 1 1 A 181 181 LYS HA H 181 3.457 5.030 -1.573 1 1 1440 . 16 1 1 A 181 181 LYS CA C 181 54.783 56.790 -2.007 1 1 1441 . 16 1 1 A 181 181 LYS CB C 181 27.088 31.811 -4.723 1 1 1444 . 16 1 1 A 181 181 LYS N N 181 114.996 118.333 -3.337 1 1 1445 . 16 1 1 A 182 182 GLN H H 182 7.532 7.731 -0.199 1 1 1446 . 16 1 1 A 182 182 GLN HA H 182 5.304 4.994 0.310 1 1 1453 . 16 1 1 A 182 182 GLN CA C 182 51.473 55.147 -3.674 1 1 1454 . 16 1 1 A 182 182 GLN CB C 182 31.585 31.622 -0.037 1 1 1455 . 16 1 1 A 182 182 GLN N N 182 115.064 124.253 -9.189 1 1 1457 . 16 1 1 A 183 183 GLY H H 183 9.026 8.414 0.612 1 1 1458 . 16 1 1 A 183 183 GLY HA2 H 183 5.376 4.281 1.095 1 1 1459 . 16 1 1 A 183 183 GLY HA3 H 183 3.567 4.362 -0.795 1 1 1460 . 16 1 1 A 183 183 GLY CA C 183 42.361 45.453 -3.092 1 1 1461 . 16 1 1 A 183 183 GLY N N 183 111.505 112.427 -0.922 1 1 1462 . 16 1 1 A 184 184 HIS H H 184 7.508 8.574 -1.066 1 1 1463 . 16 1 1 A 184 184 HIS HA H 184 4.304 4.981 -0.677 1 1 1467 . 16 1 1 A 184 184 HIS CA C 184 52.793 55.442 -2.649 1 1 1468 . 16 1 1 A 184 184 HIS CB C 184 27.906 32.652 -4.746 1 1 1469 . 16 1 1 A 184 184 HIS N N 184 111.297 119.075 -7.778 1 1 1470 . 16 1 1 A 185 185 GLY H H 185 9.160 7.451 1.709 1 1 1471 . 16 1 1 A 185 185 GLY HA2 H 185 4.464 4.397 0.067 1 1 1472 . 16 1 1 A 185 185 GLY HA3 H 185 4.117 4.528 -0.411 1 1 1473 . 16 1 1 A 185 185 GLY CA C 185 44.212 46.408 -2.196 1 1 1474 . 16 1 1 A 185 185 GLY N N 185 107.398 110.423 -3.025 1 1 1475 . 16 1 1 A 186 186 LYS H H 186 9.170 8.435 0.735 1 1 1476 . 16 1 1 A 186 186 LYS HA H 186 4.925 4.904 0.021 1 1 1481 . 16 1 1 A 186 186 LYS CB C 186 33.642 35.508 -1.866 1 1 1482 . 16 1 1 A 186 186 LYS N N 186 122.690 121.681 1.009 1 1 1483 . 16 1 1 A 187 187 ILE H H 187 8.444 8.378 0.066 1 1 1484 . 16 1 1 A 187 187 ILE HA H 187 4.626 4.972 -0.346 1 1 1487 . 16 1 1 A 187 187 ILE N N 187 124.320 126.635 -2.315 1 1 1488 . 16 1 1 A 188 188 GLU H H 188 8.590 9.627 -1.037 1 1 1489 . 16 1 1 A 188 188 GLU HA H 188 4.650 4.620 0.030 1 1 1495 . 16 1 1 A 188 188 GLU N N 188 122.575 128.169 -5.594 1 1 1496 . 16 1 1 A 189 189 HIS H H 189 8.726 7.718 1.008 1 1 1497 . 16 1 1 A 189 189 HIS HA H 189 4.055 4.195 -0.140 1 1 1501 . 16 1 1 A 189 189 HIS CA C 189 54.623 59.309 -4.686 1 1 1502 . 16 1 1 A 189 189 HIS CB C 189 24.997 29.907 -4.910 1 1 1503 . 16 1 1 A 189 189 HIS N N 189 111.381 122.588 -11.207 1 1 1504 . 16 1 1 A 190 190 LEU H H 190 9.715 7.745 1.970 1 1 1505 . 16 1 1 A 190 190 LEU HA H 190 4.379 4.217 0.162 1 1 1515 . 16 1 1 A 190 190 LEU N N 190 124.648 116.342 8.306 1 1 1516 . 16 1 1 A 191 191 LYS H H 191 10.099 8.015 2.084 1 1 1517 . 16 1 1 A 191 191 LYS HA H 191 3.736 4.492 -0.756 1 1 1524 . 16 1 1 A 191 191 LYS CA C 191 55.815 56.906 -1.091 1 1 1525 . 16 1 1 A 191 191 LYS CB C 191 30.201 35.339 -5.138 1 1 1527 . 16 1 1 A 191 191 LYS N N 191 123.618 120.767 2.851 1 1 1528 . 16 1 1 A 192 192 SER H H 192 6.991 7.687 -0.696 1 1 1529 . 16 1 1 A 192 192 SER HA H 192 4.743 4.483 0.260 1 1 1532 . 16 1 1 A 192 192 SER CA C 192 51.974 56.488 -4.514 1 1 1533 . 16 1 1 A 192 192 SER CB C 192 60.005 64.253 -4.248 1 1 1534 . 16 1 1 A 192 192 SER N N 192 115.071 116.979 -1.908 1 1 1535 . 16 1 1 A 193 193 PRO CB C 193 29.607 29.964 -0.357 1 1 1537 . 16 1 1 A 194 194 GLU H H 194 8.213 8.822 -0.609 1 1 1538 . 16 1 1 A 194 194 GLU HA H 194 3.063 4.622 -1.559 1 1 1543 . 16 1 1 A 194 194 GLU CA C 194 54.185 57.229 -3.044 1 1 1545 . 16 1 1 A 194 194 GLU N N 194 114.055 119.802 -5.747 1 1 1546 . 16 1 1 A 195 195 LEU H H 195 7.082 7.753 -0.671 1 1 1547 . 16 1 1 A 195 195 LEU HA H 195 4.027 4.558 -0.531 1 1 1557 . 16 1 1 A 195 195 LEU CA C 195 51.361 54.111 -2.750 1 1 1558 . 16 1 1 A 195 195 LEU CB C 195 38.950 41.352 -2.402 1 1 1561 . 16 1 1 A 195 195 LEU N N 195 113.898 118.262 -4.364 1 1 1562 . 16 1 1 A 196 196 ASN H H 196 7.060 8.024 -0.964 1 1 1563 . 16 1 1 A 196 196 ASN HA H 196 4.638 4.699 -0.061 1 1 1567 . 16 1 1 A 196 196 ASN N N 196 119.196 118.526 0.670 1 1 1568 . 16 1 1 A 197 197 VAL H H 197 7.244 8.668 -1.424 1 1 1569 . 16 1 1 A 197 197 VAL HA H 197 4.540 4.936 -0.396 1 1 1577 . 16 1 1 A 197 197 VAL CA C 197 57.176 58.831 -1.655 1 1 1578 . 16 1 1 A 197 197 VAL N N 197 113.621 116.457 -2.836 1 1 1579 . 16 1 1 A 198 198 ASP H H 198 8.881 8.996 -0.115 1 1 1580 . 16 1 1 A 198 198 ASP HA H 198 4.894 4.915 -0.021 1 1 1581 . 16 1 1 A 198 198 ASP N N 198 118.852 121.658 -2.806 1 1 1582 . 16 1 1 A 199 199 LEU H H 199 8.498 8.414 0.084 1 1 1583 . 16 1 1 A 199 199 LEU HA H 199 4.317 4.930 -0.613 1 1 1591 . 16 1 1 A 199 199 LEU N N 199 124.078 126.971 -2.893 1 1 1592 . 16 1 1 A 200 200 ALA H H 200 8.386 8.995 -0.609 1 1 1593 . 16 1 1 A 200 200 ALA HA H 200 4.295 5.098 -0.803 1 1 1597 . 16 1 1 A 200 200 ALA CA C 200 50.044 50.642 -0.598 1 1 1598 . 16 1 1 A 200 200 ALA CB C 200 17.985 22.352 -4.367 1 1 1599 . 16 1 1 A 200 200 ALA N N 200 127.315 125.767 1.548 1 1 1600 . 16 1 1 A 201 201 VAL H H 201 8.007 8.748 -0.741 1 1 1601 . 16 1 1 A 201 201 VAL HA H 201 4.577 4.569 0.008 1 1 1609 . 16 1 1 A 201 201 VAL CA C 201 60.004 60.817 -0.813 1 1 1610 . 16 1 1 A 201 201 VAL CB C 201 28.863 33.695 -4.832 1 1 1611 . 16 1 1 A 201 201 VAL N N 201 119.409 123.293 -3.884 1 1 1612 . 16 1 1 A 202 202 ALA H H 202 8.789 8.736 0.053 1 1 1613 . 16 1 1 A 202 202 ALA HA H 202 4.630 5.289 -0.659 1 1 1617 . 16 1 1 A 202 202 ALA CA C 202 48.200 49.960 -1.760 1 1 1618 . 16 1 1 A 202 202 ALA N N 202 131.745 129.365 2.380 1 1 1619 . 16 1 1 A 203 203 TYR H H 203 8.522 9.229 -0.707 1 1 1620 . 16 1 1 A 203 203 TYR HA H 203 5.391 5.199 0.192 1 1 1627 . 16 1 1 A 203 203 TYR CA C 203 54.648 57.085 -2.437 1 1 1628 . 16 1 1 A 203 203 TYR CB C 203 37.315 38.218 -0.903 1 1 1629 . 16 1 1 A 203 203 TYR N N 203 117.786 124.018 -6.232 1 1 1630 . 16 1 1 A 204 204 ILE H H 204 8.209 8.469 -0.260 1 1 1631 . 16 1 1 A 204 204 ILE HA H 204 4.393 4.317 0.076 1 1 1641 . 16 1 1 A 204 204 ILE CB C 204 36.807 37.990 -1.183 1 1 1644 . 16 1 1 A 204 204 ILE N N 204 120.602 125.470 -4.868 1 1 1645 . 16 1 1 A 205 205 LYS H H 205 9.340 8.807 0.533 1 1 1646 . 16 1 1 A 205 205 LYS HA H 205 4.756 4.321 0.435 1 1 1651 . 16 1 1 A 205 205 LYS CA C 205 50.844 60.278 -9.434 1 1 1652 . 16 1 1 A 205 205 LYS N N 205 127.960 125.407 2.553 1 1 1653 . 16 1 1 A 207 207 ASP H H 207 8.436 8.929 -0.493 1 1 1654 . 16 1 1 A 207 207 ASP HA H 207 4.692 4.589 0.103 1 1 1657 . 16 1 1 A 207 207 ASP CA C 207 48.789 52.777 -3.988 1 1 1658 . 16 1 1 A 207 207 ASP CB C 207 38.377 41.681 -3.304 1 1 1659 . 16 1 1 A 207 207 ASP N N 207 123.098 124.786 -1.688 1 1 1660 . 16 1 1 A 208 208 GLU H H 208 8.880 8.486 0.394 1 1 1661 . 16 1 1 A 208 208 GLU HA H 208 3.994 4.081 -0.087 1 1 1666 . 16 1 1 A 208 208 GLU CA C 208 56.123 58.623 -2.500 1 1 1667 . 16 1 1 A 208 208 GLU CB C 208 25.794 29.347 -3.553 1 1 1669 . 16 1 1 A 208 208 GLU N N 208 119.042 121.908 -2.866 1 1 1670 . 16 1 1 A 209 209 LYS H H 209 7.681 7.665 0.016 1 1 1671 . 16 1 1 A 209 209 LYS HA H 209 4.141 4.371 -0.230 1 1 1680 . 16 1 1 A 209 209 LYS N N 209 119.252 117.259 1.993 1 1 1681 . 16 1 1 A 210 210 HIS H H 210 8.177 6.447 1.730 1 1 1682 . 16 1 1 A 210 210 HIS HA H 210 3.825 4.670 -0.845 1 1 1687 . 16 1 1 A 210 210 HIS CA C 210 54.205 54.136 0.069 1 1 1688 . 16 1 1 A 210 210 HIS CB C 210 23.439 29.769 -6.330 1 1 1689 . 16 1 1 A 210 210 HIS N N 210 112.758 111.817 0.941 1 1 1690 . 16 1 1 A 211 211 HIS H H 211 8.758 7.133 1.625 1 1 1691 . 16 1 1 A 211 211 HIS HA H 211 5.041 4.914 0.127 1 1 1695 . 16 1 1 A 211 211 HIS CA C 211 50.450 54.663 -4.213 1 1 1696 . 16 1 1 A 211 211 HIS CB C 211 25.703 33.959 -8.256 1 1 1697 . 16 1 1 A 211 211 HIS N N 211 119.552 118.892 0.660 1 1 1698 . 16 1 1 A 212 212 ALA H H 212 8.556 7.998 0.558 1 1 1699 . 16 1 1 A 212 212 ALA HA H 212 4.712 4.793 -0.081 1 1 1703 . 16 1 1 A 212 212 ALA CA C 212 49.886 50.607 -0.721 1 1 1704 . 16 1 1 A 212 212 ALA CB C 212 18.860 19.831 -0.971 1 1 1705 . 16 1 1 A 212 212 ALA N N 212 123.780 122.569 1.211 1 1 1706 . 16 1 1 A 213 213 VAL H H 213 9.338 8.002 1.336 1 1 1707 . 16 1 1 A 213 213 VAL HA H 213 5.074 4.827 0.247 1 1 1715 . 16 1 1 A 213 213 VAL CA C 213 57.486 60.004 -2.518 1 1 1716 . 16 1 1 A 213 213 VAL CB C 213 33.938 36.293 -2.355 1 1 1717 . 16 1 1 A 213 213 VAL N N 213 124.742 119.221 5.521 1 1 1718 . 16 1 1 A 214 214 ILE H H 214 8.962 9.118 -0.156 1 1 1719 . 16 1 1 A 214 214 ILE HA H 214 4.434 5.428 -0.994 1 1 1726 . 16 1 1 A 214 214 ILE N N 214 122.881 124.692 -1.811 1 1 1727 . 16 1 1 A 215 215 SER H H 215 8.558 8.781 -0.223 1 1 1728 . 16 1 1 A 215 215 SER HA H 215 5.001 5.478 -0.477 1 1 1731 . 16 1 1 A 215 215 SER CA C 215 53.230 56.354 -3.124 1 1 1732 . 16 1 1 A 215 215 SER CB C 215 62.077 66.168 -4.091 1 1 1733 . 16 1 1 A 215 215 SER N N 215 122.891 121.930 0.961 1 1 1734 . 16 1 1 A 216 216 GLY H H 216 7.282 8.616 -1.334 1 1 1735 . 16 1 1 A 216 216 GLY HA2 H 216 4.515 4.289 0.226 1 1 1736 . 16 1 1 A 216 216 GLY HA3 H 216 3.473 4.307 -0.834 1 1 1737 . 16 1 1 A 216 216 GLY CA C 216 42.816 46.018 -3.202 1 1 1738 . 16 1 1 A 216 216 GLY N N 216 110.899 112.704 -1.805 1 1 1739 . 16 1 1 A 217 217 SER H H 217 8.673 8.686 -0.013 1 1 1740 . 16 1 1 A 217 217 SER HA H 217 5.127 5.373 -0.246 1 1 1743 . 16 1 1 A 217 217 SER CA C 217 56.266 56.590 -0.324 1 1 1744 . 16 1 1 A 217 217 SER N N 217 117.164 116.408 0.756 1 1 1745 . 16 1 1 A 218 218 VAL H H 218 7.451 9.365 -1.914 1 1 1746 . 16 1 1 A 218 218 VAL HA H 218 5.128 4.945 0.183 1 1 1754 . 16 1 1 A 218 218 VAL CA C 218 56.637 60.505 -3.868 1 1 1755 . 16 1 1 A 218 218 VAL N N 218 117.826 120.093 -2.267 1 1 1756 . 16 1 1 A 219 219 LEU H H 219 9.022 8.994 0.028 1 1 1757 . 16 1 1 A 219 219 LEU HA H 219 5.387 5.103 0.284 1 1 1767 . 16 1 1 A 219 219 LEU CA C 219 50.450 53.846 -3.396 1 1 1768 . 16 1 1 A 219 219 LEU N N 219 124.820 125.419 -0.599 1 1 1769 . 16 1 1 A 220 220 TYR H H 220 8.816 8.977 -0.161 1 1 1770 . 16 1 1 A 220 220 TYR HA H 220 4.834 4.952 -0.118 1 1 1777 . 16 1 1 A 220 220 TYR N N 220 121.249 125.177 -3.928 1 1 1778 . 16 1 1 A 221 221 ASN H H 221 9.191 8.948 0.243 1 1 1779 . 16 1 1 A 221 221 ASN HA H 221 4.048 4.486 -0.438 1 1 1784 . 16 1 1 A 221 221 ASN CA C 221 51.647 55.162 -3.515 1 1 1785 . 16 1 1 A 221 221 ASN CB C 221 36.640 38.089 -1.449 1 1 1786 . 16 1 1 A 221 221 ASN N N 221 129.865 125.332 4.533 1 1 1788 . 16 1 1 A 222 222 GLN H H 222 8.468 6.595 1.873 1 1 1789 . 16 1 1 A 222 222 GLN HA H 222 3.671 3.953 -0.282 1 1 1794 . 16 1 1 A 222 222 GLN CA C 222 55.075 57.656 -2.581 1 1 1795 . 16 1 1 A 222 222 GLN CB C 222 24.663 29.399 -4.736 1 1 1797 . 16 1 1 A 222 222 GLN N N 222 108.367 118.223 -9.856 1 1 1798 . 16 1 1 A 223 223 ASP H H 223 7.797 7.841 -0.044 1 1 1799 . 16 1 1 A 223 223 ASP HA H 223 4.986 4.821 0.165 1 1 1802 . 16 1 1 A 223 223 ASP N N 223 120.842 118.399 2.443 1 1 1803 . 16 1 1 A 224 224 GLU H H 224 8.731 7.952 0.779 1 1 1804 . 16 1 1 A 224 224 GLU HA H 224 4.690 4.696 -0.006 1 1 1809 . 16 1 1 A 224 224 GLU CA C 224 54.703 55.759 -1.056 1 1 1810 . 16 1 1 A 224 224 GLU CB C 224 26.357 31.435 -5.078 1 1 1812 . 16 1 1 A 224 224 GLU N N 224 124.249 120.622 3.627 1 1 1813 . 16 1 1 A 225 225 LYS H H 225 8.730 8.395 0.335 1 1 1814 . 16 1 1 A 225 225 LYS HA H 225 4.754 4.903 -0.149 1 1 1822 . 16 1 1 A 225 225 LYS N N 225 126.784 121.871 4.913 1 1 1823 . 16 1 1 A 226 226 GLY H H 226 7.683 8.743 -1.060 1 1 1824 . 16 1 1 A 226 226 GLY HA2 H 226 5.567 4.226 1.341 1 1 1825 . 16 1 1 A 226 226 GLY HA3 H 226 3.819 4.273 -0.454 1 1 1826 . 16 1 1 A 226 226 GLY CA C 226 42.264 44.304 -2.040 1 1 1827 . 16 1 1 A 226 226 GLY N N 226 107.140 111.485 -4.345 1 1 1828 . 16 1 1 A 227 227 SER H H 227 8.672 9.899 -1.227 1 1 1829 . 16 1 1 A 227 227 SER HA H 227 5.564 5.307 0.257 1 1 1832 . 16 1 1 A 227 227 SER CA C 227 54.373 56.461 -2.088 1 1 1833 . 16 1 1 A 227 227 SER CB C 227 63.963 66.070 -2.107 1 1 1834 . 16 1 1 A 227 227 SER N N 227 117.767 114.439 3.328 1 1 1835 . 16 1 1 A 228 228 TYR H H 228 9.073 8.665 0.408 1 1 1836 . 16 1 1 A 228 228 TYR HA H 228 5.519 5.241 0.278 1 1 1843 . 16 1 1 A 228 228 TYR N N 228 118.324 123.629 -5.305 1 1 1844 . 16 1 1 A 229 229 SER H H 229 8.929 8.339 0.590 1 1 1845 . 16 1 1 A 229 229 SER HA H 229 5.209 5.138 0.071 1 1 1848 . 16 1 1 A 229 229 SER CA C 229 54.131 56.933 -2.802 1 1 1849 . 16 1 1 A 229 229 SER N N 229 116.118 120.509 -4.391 1 1 1850 . 16 1 1 A 230 230 LEU H H 230 9.372 9.794 -0.422 1 1 1851 . 16 1 1 A 230 230 LEU HA H 230 4.803 4.837 -0.034 1 1 1863 . 16 1 1 A 230 230 LEU N N 230 124.803 126.017 -1.214 1 1 1864 . 16 1 1 A 231 231 GLY H H 231 9.080 8.243 0.837 1 1 1865 . 16 1 1 A 231 231 GLY HA2 H 231 4.776 4.161 0.615 1 1 1866 . 16 1 1 A 231 231 GLY HA3 H 231 3.528 4.250 -0.722 1 1 1867 . 16 1 1 A 231 231 GLY CA C 231 41.468 44.303 -2.835 1 1 1868 . 16 1 1 A 231 231 GLY N N 231 109.611 108.243 1.368 1 1 1869 . 16 1 1 A 232 232 ILE H H 232 6.849 8.559 -1.710 1 1 1870 . 16 1 1 A 232 232 ILE HA H 232 4.742 4.197 0.545 1 1 1878 . 16 1 1 A 232 232 ILE N N 232 120.566 123.708 -3.142 1 1 1879 . 16 1 1 A 233 233 PHE H H 233 9.569 7.854 1.715 1 1 1880 . 16 1 1 A 233 233 PHE HA H 233 4.979 5.494 -0.515 1 1 1885 . 16 1 1 A 233 233 PHE N N 233 129.256 123.638 5.618 1 1 1886 . 16 1 1 A 234 234 GLY H H 234 8.734 8.780 -0.046 1 1 1887 . 16 1 1 A 234 234 GLY HA2 H 234 4.488 4.455 0.033 1 1 1888 . 16 1 1 A 234 234 GLY HA3 H 234 3.327 4.585 -1.258 1 1 1889 . 16 1 1 A 234 234 GLY CA C 234 40.377 46.120 -5.743 1 1 1890 . 16 1 1 A 234 234 GLY N N 234 105.294 106.924 -1.630 1 1 1891 . 16 1 1 A 235 235 GLU H H 235 9.198 8.290 0.908 1 1 1892 . 16 1 1 A 235 235 GLU HA H 235 4.111 4.172 -0.061 1 1 1897 . 16 1 1 A 235 235 GLU CA C 235 56.466 58.583 -2.117 1 1 1898 . 16 1 1 A 235 235 GLU CB C 235 26.256 28.876 -2.620 1 1 1900 . 16 1 1 A 235 235 GLU N N 235 125.813 120.249 5.564 1 1 1901 . 16 1 1 A 236 236 LYS H H 236 8.147 7.770 0.377 1 1 1902 . 16 1 1 A 236 236 LYS HA H 236 4.373 4.521 -0.148 1 1 1905 . 16 1 1 A 236 236 LYS N N 236 117.810 120.220 -2.410 1 1 1906 . 16 1 1 A 237 237 ALA H H 237 7.685 7.670 0.015 1 1 1907 . 16 1 1 A 237 237 ALA HA H 237 3.902 4.554 -0.652 1 1 1911 . 16 1 1 A 237 237 ALA CA C 237 49.762 52.162 -2.400 1 1 1912 . 16 1 1 A 237 237 ALA CB C 237 14.720 19.791 -5.071 1 1 1913 . 16 1 1 A 237 237 ALA N N 237 118.704 121.687 -2.983 1 1 1914 . 16 1 1 A 238 238 GLN H H 238 9.312 8.573 0.739 1 1 1915 . 16 1 1 A 238 238 GLN HA H 238 4.049 4.909 -0.860 1 1 1920 . 16 1 1 A 238 238 GLN N N 238 118.059 122.303 -4.244 1 1 1921 . 16 1 1 A 239 239 GLU H H 239 8.785 10.114 -1.329 1 1 1922 . 16 1 1 A 239 239 GLU HA H 239 5.531 5.137 0.394 1 1 1927 . 16 1 1 A 239 239 GLU N N 239 116.914 118.682 -1.768 1 1 1928 . 16 1 1 A 240 240 VAL H H 240 8.501 9.362 -0.861 1 1 1929 . 16 1 1 A 240 240 VAL HA H 240 5.655 3.112 2.543 1 1 1937 . 16 1 1 A 240 240 VAL CA C 240 55.582 59.494 -3.912 1 1 1940 . 16 1 1 A 240 240 VAL N N 240 110.588 120.176 -9.588 1 1 1941 . 16 1 1 A 241 241 ALA H H 241 8.463 8.419 0.044 1 1 1942 . 16 1 1 A 241 241 ALA HA H 241 5.014 5.189 -0.175 1 1 1946 . 16 1 1 A 241 241 ALA CA C 241 49.361 51.211 -1.850 1 1 1947 . 16 1 1 A 241 241 ALA CB C 241 18.196 23.803 -5.607 1 1 1948 . 16 1 1 A 241 241 ALA N N 241 121.125 128.045 -6.920 1 1 1949 . 16 1 1 A 242 242 GLY H H 242 9.421 8.638 0.783 1 1 1950 . 16 1 1 A 242 242 GLY HA2 H 242 5.161 4.239 0.922 1 1 1951 . 16 1 1 A 242 242 GLY HA3 H 242 4.076 4.283 -0.207 1 1 1952 . 16 1 1 A 242 242 GLY N N 242 112.036 106.532 5.504 1 1 1953 . 16 1 1 A 243 243 SER H H 243 8.929 8.119 0.810 1 1 1954 . 16 1 1 A 243 243 SER HA H 243 5.331 5.352 -0.021 1 1 1957 . 16 1 1 A 243 243 SER N N 243 116.113 115.213 0.900 1 1 1958 . 16 1 1 A 244 244 ALA H H 244 9.218 8.894 0.324 1 1 1959 . 16 1 1 A 244 244 ALA HA H 244 5.221 5.027 0.194 1 1 1963 . 16 1 1 A 244 244 ALA CA C 244 47.883 50.289 -2.406 1 1 1964 . 16 1 1 A 244 244 ALA N N 244 120.635 126.919 -6.284 1 1 1965 . 16 1 1 A 245 245 GLU H H 245 9.194 8.274 0.920 1 1 1966 . 16 1 1 A 245 245 GLU HA H 245 4.869 5.172 -0.303 1 1 1971 . 16 1 1 A 245 245 GLU N N 245 123.487 117.190 6.297 1 1 1972 . 16 1 1 A 246 246 VAL H H 246 8.531 9.085 -0.554 1 1 1973 . 16 1 1 A 246 246 VAL HA H 246 4.518 4.703 -0.185 1 1 1981 . 16 1 1 A 246 246 VAL CA C 246 58.286 61.043 -2.757 1 1 1982 . 16 1 1 A 246 246 VAL N N 246 123.347 124.179 -0.832 1 1 1983 . 16 1 1 A 247 247 GLU H H 247 9.132 8.574 0.558 1 1 1984 . 16 1 1 A 247 247 GLU HA H 247 4.368 4.700 -0.332 1 1 1989 . 16 1 1 A 247 247 GLU CB C 247 26.744 31.803 -5.059 1 1 1990 . 16 1 1 A 247 247 GLU N N 247 129.243 126.549 2.694 1 1 1991 . 16 1 1 A 248 248 THR H H 248 7.827 8.464 -0.637 1 1 1992 . 16 1 1 A 248 248 THR HA H 248 4.749 4.605 0.144 1 1 1997 . 16 1 1 A 248 248 THR CA C 248 56.859 61.792 -4.933 1 1 1998 . 16 1 1 A 248 248 THR CB C 248 69.171 69.367 -0.196 1 1 2000 . 16 1 1 A 248 248 THR N N 248 114.228 118.797 -4.569 1 1 2001 . 16 1 1 A 249 249 ALA H H 249 9.148 8.057 1.091 1 1 2002 . 16 1 1 A 249 249 ALA HA H 249 4.174 4.563 -0.389 1 1 2006 . 16 1 1 A 249 249 ALA CA C 249 51.970 51.442 0.528 1 1 2007 . 16 1 1 A 249 249 ALA CB C 249 15.797 20.271 -4.474 1 1 2008 . 16 1 1 A 249 249 ALA N N 249 123.341 125.961 -2.620 1 1 2009 . 16 1 1 A 250 250 ASN H H 250 7.974 7.888 0.086 1 1 2010 . 16 1 1 A 250 250 ASN HA H 250 4.953 4.985 -0.032 1 1 2015 . 16 1 1 A 250 250 ASN CA C 250 49.198 52.621 -3.423 1 1 2016 . 16 1 1 A 250 250 ASN CB C 250 35.976 40.266 -4.290 1 1 2017 . 16 1 1 A 250 250 ASN N N 250 113.358 115.638 -2.280 1 1 2019 . 16 1 1 A 251 251 GLY H H 251 7.510 7.549 -0.039 1 1 2020 . 16 1 1 A 251 251 GLY HA2 H 251 4.492 4.125 0.367 1 1 2021 . 16 1 1 A 251 251 GLY HA3 H 251 3.853 4.177 -0.324 1 1 2022 . 16 1 1 A 251 251 GLY CA C 251 41.435 46.032 -4.597 1 1 2023 . 16 1 1 A 251 251 GLY N N 251 108.692 105.960 2.732 1 1 2024 . 16 1 1 A 252 252 ILE H H 252 8.465 8.450 0.015 1 1 2025 . 16 1 1 A 252 252 ILE HA H 252 4.521 4.528 -0.007 1 1 2035 . 16 1 1 A 252 252 ILE CB C 252 35.653 42.204 -6.551 1 1 2039 . 16 1 1 A 252 252 ILE N N 252 122.043 120.511 1.532 1 1 2040 . 16 1 1 A 253 253 HIS H H 253 9.311 8.983 0.328 1 1 2041 . 16 1 1 A 253 253 HIS HA H 253 4.861 5.362 -0.501 1 1 2046 . 16 1 1 A 253 253 HIS N N 253 126.617 125.506 1.111 1 1 2047 . 16 1 1 A 254 254 HIS H H 254 8.820 8.982 -0.162 1 1 2048 . 16 1 1 A 254 254 HIS HA H 254 5.305 5.395 -0.090 1 1 2051 . 16 1 1 A 254 254 HIS CA C 254 52.781 54.448 -1.667 1 1 2052 . 16 1 1 A 254 254 HIS N N 254 122.665 119.466 3.199 1 1 2053 . 16 1 1 A 255 255 ILE H H 255 9.047 8.726 0.321 1 1 2054 . 16 1 1 A 255 255 ILE HA H 255 4.651 4.979 -0.328 1 1 2061 . 16 1 1 A 255 255 ILE N N 255 123.958 124.272 -0.314 1 1 2062 . 16 1 1 A 256 256 GLY H H 256 9.339 9.397 -0.058 1 1 2063 . 16 1 1 A 256 256 GLY HA2 H 256 3.816 3.902 -0.086 1 1 2064 . 16 1 1 A 256 256 GLY HA3 H 256 2.267 3.967 -1.700 1 1 2065 . 16 1 1 A 256 256 GLY N N 256 115.022 113.925 1.097 1 1 2066 . 16 1 1 A 257 257 LEU H H 257 7.890 9.432 -1.542 1 1 2067 . 16 1 1 A 257 257 LEU HA H 257 4.853 5.219 -0.366 1 1 2077 . 16 1 1 A 257 257 LEU N N 257 121.441 125.515 -4.074 1 1 2078 . 16 1 1 A 258 258 ALA H H 258 7.982 9.008 -1.026 1 1 2079 . 16 1 1 A 258 258 ALA HA H 258 4.668 5.048 -0.380 1 1 2083 . 16 1 1 A 258 258 ALA CA C 258 49.678 51.730 -2.052 1 1 2084 . 16 1 1 A 258 258 ALA CB C 258 19.561 21.336 -1.775 1 1 2085 . 16 1 1 A 258 258 ALA N N 258 123.234 122.502 0.732 1 1 2086 . 16 1 1 A 259 259 ALA H H 259 9.117 8.896 0.221 1 1 2087 . 16 1 1 A 259 259 ALA HA H 259 4.790 4.886 -0.096 1 1 2091 . 16 1 1 A 259 259 ALA N N 259 123.901 123.605 0.296 1 1 2092 . 16 1 1 A 260 260 LYS H H 260 8.452 8.317 0.135 1 1 2093 . 16 1 1 A 260 260 LYS HA H 260 5.914 4.810 1.104 1 1 2098 . 16 1 1 A 260 260 LYS CA C 260 51.818 54.696 -2.878 1 1 2099 . 16 1 1 A 260 260 LYS N N 260 116.464 117.116 -0.652 1 1 1 . 17 1 1 A 9 9 SER H H 9 8.293 8.236 0.057 1 1 2 . 17 1 1 A 9 9 SER HA H 9 4.432 4.564 -0.132 1 1 3 . 17 1 1 A 9 9 SER N N 9 116.407 117.531 -1.124 1 1 4 . 17 1 1 A 10 10 GLY H H 10 8.472 7.444 1.028 1 1 5 . 17 1 1 A 10 10 GLY N N 10 111.611 107.487 4.124 1 1 6 . 17 1 1 A 14 14 VAL H H 14 8.009 8.328 -0.319 1 1 7 . 17 1 1 A 14 14 VAL HA H 14 4.128 4.144 -0.016 1 1 15 . 17 1 1 A 14 14 VAL CA C 14 59.473 62.611 -3.138 1 1 16 . 17 1 1 A 14 14 VAL CB C 14 30.127 32.199 -2.072 1 1 17 . 17 1 1 A 14 14 VAL N N 14 119.846 119.829 0.017 1 1 18 . 17 1 1 A 15 15 THR H H 15 8.152 8.612 -0.460 1 1 19 . 17 1 1 A 15 15 THR HA H 15 4.346 4.866 -0.520 1 1 24 . 17 1 1 A 15 15 THR N N 15 118.509 117.934 0.575 1 1 25 . 17 1 1 A 16 16 ALA H H 16 8.207 8.803 -0.596 1 1 26 . 17 1 1 A 16 16 ALA HA H 16 4.319 4.248 0.071 1 1 30 . 17 1 1 A 16 16 ALA CA C 16 49.835 53.493 -3.658 1 1 31 . 17 1 1 A 16 16 ALA CB C 16 16.714 19.103 -2.389 1 1 32 . 17 1 1 A 16 16 ALA N N 16 126.935 124.784 2.151 1 1 33 . 17 1 1 A 17 17 ASP H H 17 8.269 7.974 0.295 1 1 34 . 17 1 1 A 17 17 ASP HA H 17 4.581 4.929 -0.348 1 1 37 . 17 1 1 A 17 17 ASP CA C 17 51.643 53.208 -1.565 1 1 38 . 17 1 1 A 17 17 ASP CB C 17 38.257 41.545 -3.288 1 1 39 . 17 1 1 A 17 17 ASP N N 17 120.379 118.274 2.105 1 1 40 . 17 1 1 A 18 18 ILE H H 18 7.979 7.947 0.032 1 1 41 . 17 1 1 A 18 18 ILE HA H 18 4.178 4.036 0.142 1 1 48 . 17 1 1 A 18 18 ILE CA C 18 58.737 63.481 -4.744 1 1 49 . 17 1 1 A 18 18 ILE CB C 18 36.077 38.028 -1.951 1 1 53 . 17 1 1 A 18 18 ILE N N 18 121.171 120.460 0.711 1 1 54 . 17 1 1 A 19 19 GLY H H 19 8.410 8.121 0.289 1 1 55 . 17 1 1 A 19 19 GLY HA2 H 19 4.023 3.725 0.298 1 1 56 . 17 1 1 A 19 19 GLY HA3 H 19 4.023 3.730 0.293 1 1 57 . 17 1 1 A 19 19 GLY N N 19 112.246 108.350 3.896 1 1 58 . 17 1 1 A 20 20 THR H H 20 8.005 7.954 0.051 1 1 59 . 17 1 1 A 20 20 THR HA H 20 4.463 4.088 0.375 1 1 64 . 17 1 1 A 20 20 THR CB C 20 66.723 68.282 -1.559 1 1 66 . 17 1 1 A 20 20 THR N N 20 112.239 116.504 -4.265 1 1 67 . 17 1 1 A 21 21 GLY H H 21 8.500 8.496 0.004 1 1 68 . 17 1 1 A 21 21 GLY HA2 H 21 4.099 3.772 0.327 1 1 69 . 17 1 1 A 21 21 GLY HA3 H 21 3.872 3.774 0.098 1 1 70 . 17 1 1 A 21 21 GLY N N 21 111.048 112.554 -1.506 1 1 71 . 17 1 1 A 22 22 LEU H H 22 7.427 7.680 -0.253 1 1 72 . 17 1 1 A 22 22 LEU HA H 22 3.884 4.007 -0.123 1 1 84 . 17 1 1 A 22 22 LEU N N 22 118.837 120.302 -1.465 1 1 85 . 17 1 1 A 23 23 ALA H H 23 7.896 7.786 0.110 1 1 86 . 17 1 1 A 23 23 ALA HA H 23 4.023 4.111 -0.088 1 1 90 . 17 1 1 A 23 23 ALA CA C 23 52.584 54.136 -1.552 1 1 91 . 17 1 1 A 23 23 ALA CB C 23 15.470 18.398 -2.928 1 1 92 . 17 1 1 A 23 23 ALA N N 23 119.194 121.406 -2.212 1 1 93 . 17 1 1 A 24 24 ASP H H 24 8.265 8.051 0.214 1 1 94 . 17 1 1 A 24 24 ASP HA H 24 4.337 4.579 -0.242 1 1 97 . 17 1 1 A 24 24 ASP CB C 24 37.029 41.178 -4.149 1 1 98 . 17 1 1 A 24 24 ASP N N 24 119.035 116.990 2.045 1 1 99 . 17 1 1 A 25 25 ALA H H 25 8.211 8.568 -0.357 1 1 100 . 17 1 1 A 25 25 ALA HA H 25 4.064 4.147 -0.083 1 1 104 . 17 1 1 A 25 25 ALA CA C 25 53.278 54.548 -1.270 1 1 105 . 17 1 1 A 25 25 ALA CB C 25 15.760 18.522 -2.762 1 1 106 . 17 1 1 A 25 25 ALA N N 25 122.434 121.522 0.912 1 1 107 . 17 1 1 A 26 26 LEU H H 26 7.334 7.421 -0.087 1 1 108 . 17 1 1 A 26 26 LEU HA H 26 4.351 4.281 0.070 1 1 117 . 17 1 1 A 26 26 LEU N N 26 114.238 115.934 -1.696 1 1 118 . 17 1 1 A 27 27 THR H H 27 7.708 7.159 0.549 1 1 119 . 17 1 1 A 27 27 THR HA H 27 4.492 4.345 0.147 1 1 124 . 17 1 1 A 27 27 THR CA C 27 59.438 62.734 -3.296 1 1 125 . 17 1 1 A 27 27 THR CB C 27 68.796 69.061 -0.265 1 1 127 . 17 1 1 A 27 27 THR N N 27 106.430 111.089 -4.659 1 1 128 . 17 1 1 A 28 28 ALA H H 28 8.906 7.497 1.409 1 1 129 . 17 1 1 A 28 28 ALA HA H 28 4.812 4.695 0.117 1 1 133 . 17 1 1 A 28 28 ALA CB C 28 16.724 19.413 -2.689 1 1 134 . 17 1 1 A 28 28 ALA N N 28 128.420 124.179 4.241 1 1 135 . 17 1 1 A 29 29 PRO CA C 29 59.166 62.137 -2.971 1 1 136 . 17 1 1 A 29 29 PRO CB C 29 29.865 33.132 -3.267 1 1 139 . 17 1 1 A 30 30 LEU H H 30 8.204 8.320 -0.116 1 1 140 . 17 1 1 A 30 30 LEU HA H 30 4.052 4.241 -0.189 1 1 150 . 17 1 1 A 30 30 LEU N N 30 121.970 121.981 -0.011 1 1 151 . 17 1 1 A 31 31 ASP H H 31 8.720 8.609 0.111 1 1 152 . 17 1 1 A 31 31 ASP HA H 31 4.772 4.812 -0.040 1 1 155 . 17 1 1 A 31 31 ASP CA C 31 50.115 52.805 -2.690 1 1 156 . 17 1 1 A 31 31 ASP N N 31 125.105 122.351 2.754 1 1 157 . 17 1 1 A 32 32 HIS CA C 32 55.083 55.090 -0.007 1 1 158 . 17 1 1 A 32 32 HIS CB C 32 25.707 28.956 -3.249 1 1 159 . 17 1 1 A 33 33 LYS H H 33 8.589 7.735 0.854 1 1 160 . 17 1 1 A 33 33 LYS HA H 33 4.112 4.434 -0.322 1 1 167 . 17 1 1 A 33 33 LYS CB C 33 29.218 33.526 -4.308 1 1 169 . 17 1 1 A 33 33 LYS N N 33 118.920 118.470 0.450 1 1 170 . 17 1 1 A 34 34 ASP H H 34 7.420 7.739 -0.319 1 1 171 . 17 1 1 A 34 34 ASP HA H 34 4.368 4.673 -0.305 1 1 174 . 17 1 1 A 34 34 ASP N N 34 120.940 119.725 1.215 1 1 175 . 17 1 1 A 35 35 LYS H H 35 8.266 9.010 -0.744 1 1 176 . 17 1 1 A 35 35 LYS HA H 35 4.169 3.882 0.287 1 1 183 . 17 1 1 A 35 35 LYS N N 35 121.280 122.223 -0.943 1 1 184 . 17 1 1 A 36 36 GLY H H 36 8.716 7.755 0.961 1 1 185 . 17 1 1 A 36 36 GLY HA2 H 36 3.822 4.091 -0.269 1 1 186 . 17 1 1 A 36 36 GLY HA3 H 36 3.618 4.092 -0.474 1 1 187 . 17 1 1 A 36 36 GLY N N 36 111.002 106.020 4.982 1 1 188 . 17 1 1 A 37 37 LEU H H 37 8.032 7.913 0.119 1 1 189 . 17 1 1 A 37 37 LEU HA H 37 4.406 4.524 -0.118 1 1 198 . 17 1 1 A 37 37 LEU N N 37 127.683 120.639 7.044 1 1 199 . 17 1 1 A 38 38 LYS H H 38 9.190 9.027 0.163 1 1 200 . 17 1 1 A 38 38 LYS HA H 38 3.925 4.411 -0.486 1 1 205 . 17 1 1 A 38 38 LYS N N 38 132.634 124.872 7.762 1 1 206 . 17 1 1 A 39 39 SER H H 39 7.161 7.659 -0.498 1 1 207 . 17 1 1 A 39 39 SER HA H 39 5.097 4.602 0.495 1 1 210 . 17 1 1 A 39 39 SER CA C 39 54.451 57.616 -3.165 1 1 211 . 17 1 1 A 39 39 SER N N 39 110.262 109.991 0.271 1 1 212 . 17 1 1 A 40 40 LEU H H 40 8.142 9.303 -1.161 1 1 213 . 17 1 1 A 40 40 LEU HA H 40 4.481 4.735 -0.254 1 1 223 . 17 1 1 A 40 40 LEU N N 40 122.761 121.821 0.940 1 1 224 . 17 1 1 A 41 41 THR H H 41 8.641 8.800 -0.159 1 1 225 . 17 1 1 A 41 41 THR HA H 41 4.141 4.589 -0.448 1 1 230 . 17 1 1 A 41 41 THR CA C 41 60.301 61.811 -1.510 1 1 231 . 17 1 1 A 41 41 THR CB C 41 65.862 70.231 -4.369 1 1 233 . 17 1 1 A 41 41 THR N N 41 124.142 121.634 2.508 1 1 234 . 17 1 1 A 42 42 LEU H H 42 8.586 8.432 0.154 1 1 235 . 17 1 1 A 42 42 LEU HA H 42 4.337 4.810 -0.473 1 1 247 . 17 1 1 A 42 42 LEU N N 42 128.603 124.844 3.759 1 1 248 . 17 1 1 A 43 43 GLU H H 43 8.644 8.596 0.048 1 1 249 . 17 1 1 A 43 43 GLU HA H 43 4.663 4.443 0.220 1 1 253 . 17 1 1 A 43 43 GLU N N 43 124.180 122.935 1.245 1 1 254 . 17 1 1 A 44 44 ASP H H 44 10.243 8.476 1.767 1 1 255 . 17 1 1 A 44 44 ASP HA H 44 4.518 4.761 -0.243 1 1 258 . 17 1 1 A 44 44 ASP CA C 44 52.879 54.330 -1.451 1 1 259 . 17 1 1 A 44 44 ASP CB C 44 37.711 41.230 -3.519 1 1 260 . 17 1 1 A 44 44 ASP N N 44 124.177 118.889 5.288 1 1 261 . 17 1 1 A 45 45 SER H H 45 8.546 8.020 0.526 1 1 262 . 17 1 1 A 45 45 SER HA H 45 3.850 4.122 -0.272 1 1 265 . 17 1 1 A 45 45 SER CA C 45 59.588 62.531 -2.943 1 1 266 . 17 1 1 A 45 45 SER CB C 45 61.660 62.716 -1.056 1 1 267 . 17 1 1 A 45 45 SER N N 45 116.191 115.712 0.479 1 1 268 . 17 1 1 A 46 46 ILE H H 46 6.902 7.624 -0.722 1 1 269 . 17 1 1 A 46 46 ILE HA H 46 3.874 4.576 -0.702 1 1 279 . 17 1 1 A 46 46 ILE CA C 46 57.605 60.298 -2.693 1 1 280 . 17 1 1 A 46 46 ILE CB C 46 36.694 39.242 -2.548 1 1 283 . 17 1 1 A 46 46 ILE N N 46 116.189 118.869 -2.680 1 1 284 . 17 1 1 A 47 47 SER H H 47 7.804 8.431 -0.627 1 1 285 . 17 1 1 A 47 47 SER HA H 47 4.342 4.786 -0.444 1 1 288 . 17 1 1 A 47 47 SER CA C 47 55.995 56.887 -0.892 1 1 289 . 17 1 1 A 47 47 SER N N 47 118.738 117.245 1.493 1 1 290 . 17 1 1 A 48 48 GLN H H 48 8.522 8.698 -0.176 1 1 291 . 17 1 1 A 48 48 GLN HA H 48 3.939 4.084 -0.145 1 1 296 . 17 1 1 A 48 48 GLN CA C 48 55.111 58.162 -3.051 1 1 298 . 17 1 1 A 48 48 GLN N N 48 119.475 122.110 -2.635 1 1 299 . 17 1 1 A 49 49 ASN H H 49 8.437 8.154 0.283 1 1 300 . 17 1 1 A 49 49 ASN HA H 49 4.693 4.866 -0.173 1 1 305 . 17 1 1 A 49 49 ASN CA C 49 50.839 52.230 -1.391 1 1 306 . 17 1 1 A 49 49 ASN CB C 49 35.767 38.144 -2.377 1 1 307 . 17 1 1 A 49 49 ASN N N 49 117.233 114.005 3.228 1 1 309 . 17 1 1 A 50 50 GLY H H 50 7.952 7.813 0.139 1 1 310 . 17 1 1 A 50 50 GLY HA2 H 50 4.518 4.133 0.385 1 1 311 . 17 1 1 A 50 50 GLY HA3 H 50 4.054 4.134 -0.080 1 1 312 . 17 1 1 A 50 50 GLY CA C 50 41.883 45.408 -3.525 1 1 313 . 17 1 1 A 50 50 GLY N N 50 108.751 108.477 0.274 1 1 314 . 17 1 1 A 51 51 THR H H 51 8.548 8.644 -0.096 1 1 315 . 17 1 1 A 51 51 THR HA H 51 5.012 5.420 -0.408 1 1 320 . 17 1 1 A 51 51 THR CA C 51 57.026 59.699 -2.673 1 1 321 . 17 1 1 A 51 51 THR CB C 51 69.887 71.033 -1.146 1 1 323 . 17 1 1 A 51 51 THR N N 51 108.710 116.541 -7.831 1 1 324 . 17 1 1 A 52 52 LEU H H 52 9.110 8.786 0.324 1 1 325 . 17 1 1 A 52 52 LEU HA H 52 5.183 5.275 -0.092 1 1 333 . 17 1 1 A 52 52 LEU CA C 52 50.822 53.929 -3.107 1 1 335 . 17 1 1 A 52 52 LEU N N 52 124.606 122.451 2.155 1 1 336 . 17 1 1 A 53 53 THR H H 53 9.312 8.677 0.635 1 1 337 . 17 1 1 A 53 53 THR HA H 53 5.288 5.099 0.189 1 1 342 . 17 1 1 A 53 53 THR CA C 53 59.535 61.268 -1.733 1 1 343 . 17 1 1 A 53 53 THR CB C 53 66.838 71.946 -5.108 1 1 345 . 17 1 1 A 53 53 THR N N 53 125.445 114.829 10.616 1 1 346 . 17 1 1 A 54 54 LEU H H 54 8.992 9.708 -0.716 1 1 347 . 17 1 1 A 54 54 LEU HA H 54 5.563 5.441 0.122 1 1 357 . 17 1 1 A 54 54 LEU N N 54 128.814 125.700 3.114 1 1 358 . 17 1 1 A 55 55 SER H H 55 9.017 8.859 0.158 1 1 359 . 17 1 1 A 55 55 SER HA H 55 5.476 5.137 0.339 1 1 362 . 17 1 1 A 55 55 SER CA C 55 53.944 57.694 -3.750 1 1 363 . 17 1 1 A 55 55 SER CB C 55 63.384 65.732 -2.348 1 1 364 . 17 1 1 A 55 55 SER N N 55 112.964 121.376 -8.412 1 1 365 . 17 1 1 A 56 56 ALA H H 56 8.324 9.441 -1.117 1 1 366 . 17 1 1 A 56 56 ALA HA H 56 4.605 4.747 -0.142 1 1 370 . 17 1 1 A 56 56 ALA CA C 56 50.743 50.009 0.734 1 1 371 . 17 1 1 A 56 56 ALA CB C 56 21.372 21.401 -0.029 1 1 372 . 17 1 1 A 56 56 ALA N N 56 123.555 129.029 -5.474 1 1 373 . 17 1 1 A 57 57 GLN H H 57 9.080 8.609 0.471 1 1 374 . 17 1 1 A 57 57 GLN HA H 57 3.884 4.486 -0.602 1 1 381 . 17 1 1 A 57 57 GLN CA C 57 53.331 55.995 -2.664 1 1 382 . 17 1 1 A 57 57 GLN CB C 57 24.659 27.709 -3.050 1 1 384 . 17 1 1 A 57 57 GLN N N 57 116.815 114.935 1.880 1 1 386 . 17 1 1 A 58 58 GLY H H 58 8.527 7.960 0.567 1 1 387 . 17 1 1 A 58 58 GLY HA2 H 58 4.168 4.059 0.109 1 1 388 . 17 1 1 A 58 58 GLY HA3 H 58 3.608 4.064 -0.456 1 1 389 . 17 1 1 A 58 58 GLY CA C 58 42.856 45.807 -2.951 1 1 390 . 17 1 1 A 58 58 GLY N N 58 105.983 107.708 -1.725 1 1 391 . 17 1 1 A 59 59 ALA H H 59 8.203 7.717 0.486 1 1 392 . 17 1 1 A 59 59 ALA HA H 59 4.811 4.545 0.266 1 1 396 . 17 1 1 A 59 59 ALA CA C 59 47.662 51.427 -3.765 1 1 397 . 17 1 1 A 59 59 ALA CB C 59 20.147 22.764 -2.617 1 1 398 . 17 1 1 A 59 59 ALA N N 59 125.153 121.338 3.815 1 1 399 . 17 1 1 A 60 60 GLU H H 60 8.154 8.813 -0.659 1 1 400 . 17 1 1 A 60 60 GLU HA H 60 5.508 5.896 -0.388 1 1 404 . 17 1 1 A 60 60 GLU CA C 60 52.179 54.010 -1.831 1 1 405 . 17 1 1 A 60 60 GLU CB C 60 30.203 34.377 -4.174 1 1 406 . 17 1 1 A 60 60 GLU N N 60 117.318 116.985 0.333 1 1 407 . 17 1 1 A 61 61 LYS H H 61 8.821 9.184 -0.363 1 1 408 . 17 1 1 A 61 61 LYS HA H 61 4.311 4.832 -0.521 1 1 413 . 17 1 1 A 61 61 LYS N N 61 123.743 118.743 5.000 1 1 414 . 17 1 1 A 62 62 THR H H 62 8.149 8.810 -0.661 1 1 415 . 17 1 1 A 62 62 THR HA H 62 4.928 4.663 0.265 1 1 420 . 17 1 1 A 62 62 THR CA C 62 59.427 62.411 -2.984 1 1 421 . 17 1 1 A 62 62 THR CB C 62 66.932 69.385 -2.453 1 1 422 . 17 1 1 A 62 62 THR N N 62 122.829 119.966 2.863 1 1 423 . 17 1 1 A 63 63 TYR H H 63 9.466 10.310 -0.844 1 1 424 . 17 1 1 A 63 63 TYR HA H 63 4.606 5.258 -0.652 1 1 431 . 17 1 1 A 63 63 TYR CA C 63 54.508 55.689 -1.181 1 1 432 . 17 1 1 A 63 63 TYR N N 63 127.472 127.956 -0.484 1 1 433 . 17 1 1 A 64 64 GLY H H 64 9.253 8.668 0.585 1 1 434 . 17 1 1 A 64 64 GLY HA2 H 64 4.670 4.205 0.465 1 1 435 . 17 1 1 A 64 64 GLY HA3 H 64 3.619 4.224 -0.605 1 1 436 . 17 1 1 A 64 64 GLY CA C 64 39.885 44.443 -4.558 1 1 437 . 17 1 1 A 64 64 GLY N N 64 110.182 112.089 -1.907 1 1 438 . 17 1 1 A 65 65 ASN H H 65 8.616 8.499 0.117 1 1 439 . 17 1 1 A 65 65 ASN HA H 65 4.109 4.409 -0.300 1 1 444 . 17 1 1 A 65 65 ASN CA C 65 53.691 54.890 -1.199 1 1 445 . 17 1 1 A 65 65 ASN N N 65 117.778 118.831 -1.053 1 1 447 . 17 1 1 A 66 66 GLY H H 66 9.053 8.993 0.060 1 1 448 . 17 1 1 A 66 66 GLY HA2 H 66 4.344 3.875 0.469 1 1 449 . 17 1 1 A 66 66 GLY HA3 H 66 3.359 3.886 -0.527 1 1 450 . 17 1 1 A 66 66 GLY CA C 66 42.431 44.972 -2.541 1 1 451 . 17 1 1 A 66 66 GLY N N 66 115.232 114.091 1.141 1 1 452 . 17 1 1 A 67 67 ASP H H 67 8.120 8.701 -0.581 1 1 453 . 17 1 1 A 67 67 ASP HA H 67 4.844 4.244 0.600 1 1 456 . 17 1 1 A 67 67 ASP N N 67 122.593 121.339 1.254 1 1 457 . 17 1 1 A 68 68 SER H H 68 8.500 8.109 0.391 1 1 458 . 17 1 1 A 68 68 SER HA H 68 5.088 5.282 -0.194 1 1 461 . 17 1 1 A 68 68 SER CA C 68 54.858 56.247 -1.389 1 1 462 . 17 1 1 A 68 68 SER CB C 68 62.114 66.719 -4.605 1 1 463 . 17 1 1 A 68 68 SER N N 68 113.557 118.034 -4.477 1 1 464 . 17 1 1 A 69 69 LEU H H 69 8.989 9.522 -0.533 1 1 465 . 17 1 1 A 69 69 LEU HA H 69 4.570 5.551 -0.981 1 1 474 . 17 1 1 A 69 69 LEU N N 69 126.836 123.164 3.672 1 1 475 . 17 1 1 A 70 70 ASN H H 70 8.491 8.884 -0.393 1 1 476 . 17 1 1 A 70 70 ASN HA H 70 4.958 5.202 -0.244 1 1 479 . 17 1 1 A 70 70 ASN CB C 70 33.265 39.123 -5.858 1 1 480 . 17 1 1 A 70 70 ASN N N 70 126.343 123.562 2.781 1 1 481 . 17 1 1 A 71 71 THR H H 71 7.831 8.312 -0.481 1 1 482 . 17 1 1 A 71 71 THR HA H 71 3.759 4.733 -0.974 1 1 487 . 17 1 1 A 71 71 THR CA C 71 61.005 60.006 0.999 1 1 488 . 17 1 1 A 71 71 THR N N 71 114.742 113.742 1.000 1 1 489 . 17 1 1 A 72 72 GLY H H 72 8.880 8.462 0.418 1 1 490 . 17 1 1 A 72 72 GLY HA2 H 72 3.907 3.836 0.071 1 1 491 . 17 1 1 A 72 72 GLY HA3 H 72 3.907 3.840 0.067 1 1 492 . 17 1 1 A 72 72 GLY N N 72 114.976 110.609 4.367 1 1 493 . 17 1 1 A 73 73 LYS H H 73 6.604 8.006 -1.402 1 1 494 . 17 1 1 A 73 73 LYS HA H 73 4.160 4.000 0.160 1 1 501 . 17 1 1 A 73 73 LYS N N 73 113.898 121.782 -7.884 1 1 502 . 17 1 1 A 74 74 LEU H H 74 7.422 7.551 -0.129 1 1 503 . 17 1 1 A 74 74 LEU HA H 74 4.358 4.214 0.144 1 1 513 . 17 1 1 A 74 74 LEU N N 74 117.180 121.242 -4.062 1 1 514 . 17 1 1 A 75 75 LYS H H 75 8.617 8.601 0.016 1 1 515 . 17 1 1 A 75 75 LYS HA H 75 4.079 4.891 -0.812 1 1 518 . 17 1 1 A 75 75 LYS N N 75 121.119 120.368 0.751 1 1 519 . 17 1 1 A 76 76 ASN H H 76 8.154 8.566 -0.412 1 1 520 . 17 1 1 A 76 76 ASN HA H 76 3.935 5.427 -1.492 1 1 525 . 17 1 1 A 76 76 ASN CB C 76 35.772 38.761 -2.989 1 1 526 . 17 1 1 A 76 76 ASN N N 76 122.761 119.936 2.825 1 1 527 . 17 1 1 A 77 77 ASP H H 77 9.227 7.936 1.291 1 1 528 . 17 1 1 A 77 77 ASP HA H 77 3.787 5.112 -1.325 1 1 531 . 17 1 1 A 77 77 ASP CA C 77 52.584 53.437 -0.853 1 1 532 . 17 1 1 A 77 77 ASP N N 77 114.129 117.289 -3.160 1 1 533 . 17 1 1 A 78 78 LYS H H 78 6.579 8.116 -1.537 1 1 534 . 17 1 1 A 78 78 LYS HA H 78 4.572 4.733 -0.161 1 1 539 . 17 1 1 A 78 78 LYS CA C 78 51.072 55.086 -4.014 1 1 540 . 17 1 1 A 78 78 LYS CB C 78 33.783 36.829 -3.046 1 1 541 . 17 1 1 A 78 78 LYS N N 78 114.135 123.751 -9.616 1 1 542 . 17 1 1 A 79 79 VAL H H 79 8.729 8.309 0.420 1 1 543 . 17 1 1 A 79 79 VAL HA H 79 4.402 4.719 -0.317 1 1 551 . 17 1 1 A 79 79 VAL CA C 79 59.240 60.164 -0.924 1 1 553 . 17 1 1 A 79 79 VAL N N 79 123.191 121.358 1.833 1 1 554 . 17 1 1 A 80 80 SER H H 80 9.542 9.877 -0.335 1 1 555 . 17 1 1 A 80 80 SER HA H 80 4.636 5.229 -0.593 1 1 558 . 17 1 1 A 80 80 SER CA C 80 55.978 57.674 -1.696 1 1 559 . 17 1 1 A 80 80 SER N N 80 127.445 121.789 5.656 1 1 560 . 17 1 1 A 81 81 ARG H H 81 8.093 8.863 -0.770 1 1 561 . 17 1 1 A 81 81 ARG HA H 81 5.210 5.342 -0.132 1 1 569 . 17 1 1 A 81 81 ARG N N 81 123.743 125.570 -1.827 1 1 571 . 17 1 1 A 82 82 PHE H H 82 9.312 9.159 0.153 1 1 572 . 17 1 1 A 82 82 PHE HA H 82 4.951 5.168 -0.217 1 1 577 . 17 1 1 A 82 82 PHE CA C 82 53.090 56.140 -3.050 1 1 578 . 17 1 1 A 82 82 PHE N N 82 119.529 119.660 -0.131 1 1 579 . 17 1 1 A 83 83 ASP H H 83 9.122 8.782 0.340 1 1 580 . 17 1 1 A 83 83 ASP HA H 83 5.593 5.333 0.260 1 1 583 . 17 1 1 A 83 83 ASP N N 83 123.825 120.003 3.822 1 1 584 . 17 1 1 A 84 84 PHE H H 84 9.090 8.180 0.910 1 1 585 . 17 1 1 A 84 84 PHE HA H 84 6.410 5.681 0.729 1 1 592 . 17 1 1 A 84 84 PHE CA C 84 52.584 55.896 -3.312 1 1 593 . 17 1 1 A 84 84 PHE N N 84 118.862 119.512 -0.650 1 1 594 . 17 1 1 A 85 85 ILE H H 85 8.441 9.306 -0.865 1 1 595 . 17 1 1 A 85 85 ILE HA H 85 4.662 4.832 -0.170 1 1 605 . 17 1 1 A 85 85 ILE CB C 85 39.939 39.034 0.905 1 1 608 . 17 1 1 A 85 85 ILE N N 85 118.049 120.517 -2.468 1 1 609 . 17 1 1 A 86 86 ARG H H 86 8.983 8.503 0.480 1 1 610 . 17 1 1 A 86 86 ARG HA H 86 5.591 4.670 0.921 1 1 616 . 17 1 1 A 86 86 ARG N N 86 127.006 127.138 -0.132 1 1 618 . 17 1 1 A 87 87 GLN H H 87 8.643 8.942 -0.299 1 1 619 . 17 1 1 A 87 87 GLN HA H 87 5.630 5.073 0.557 1 1 626 . 17 1 1 A 87 87 GLN CA C 87 51.512 54.337 -2.825 1 1 627 . 17 1 1 A 87 87 GLN N N 87 124.142 121.486 2.656 1 1 629 . 17 1 1 A 88 88 ILE H H 88 8.617 8.924 -0.307 1 1 630 . 17 1 1 A 88 88 ILE HA H 88 4.690 4.914 -0.224 1 1 637 . 17 1 1 A 88 88 ILE CA C 88 56.995 60.118 -3.123 1 1 638 . 17 1 1 A 88 88 ILE CB C 88 39.927 40.425 -0.498 1 1 641 . 17 1 1 A 88 88 ILE N N 88 116.353 126.289 -9.936 1 1 642 . 17 1 1 A 89 89 GLU H H 89 8.298 8.915 -0.617 1 1 643 . 17 1 1 A 89 89 GLU HA H 89 5.100 5.719 -0.619 1 1 646 . 17 1 1 A 89 89 GLU CA C 89 52.204 54.906 -2.702 1 1 647 . 17 1 1 A 89 89 GLU CB C 89 27.325 33.239 -5.914 1 1 648 . 17 1 1 A 89 89 GLU N N 89 124.458 129.614 -5.156 1 1 649 . 17 1 1 A 90 90 VAL H H 90 8.957 8.699 0.258 1 1 650 . 17 1 1 A 90 90 VAL HA H 90 4.169 4.672 -0.503 1 1 658 . 17 1 1 A 90 90 VAL CA C 90 58.664 59.856 -1.192 1 1 659 . 17 1 1 A 90 90 VAL CB C 90 31.861 34.189 -2.328 1 1 660 . 17 1 1 A 90 90 VAL N N 90 127.580 126.341 1.239 1 1 661 . 17 1 1 A 91 91 ASP H H 91 9.369 8.569 0.800 1 1 662 . 17 1 1 A 91 91 ASP HA H 91 4.287 4.574 -0.287 1 1 665 . 17 1 1 A 91 91 ASP CA C 91 52.389 55.424 -3.035 1 1 666 . 17 1 1 A 91 91 ASP CB C 91 36.409 40.352 -3.943 1 1 667 . 17 1 1 A 91 91 ASP N N 91 129.411 123.803 5.608 1 1 668 . 17 1 1 A 92 92 GLY H H 92 8.552 7.419 1.133 1 1 669 . 17 1 1 A 92 92 GLY HA2 H 92 4.090 4.105 -0.015 1 1 670 . 17 1 1 A 92 92 GLY HA3 H 92 3.618 4.105 -0.487 1 1 671 . 17 1 1 A 92 92 GLY CA C 92 42.836 45.602 -2.766 1 1 672 . 17 1 1 A 92 92 GLY N N 92 103.862 105.291 -1.429 1 1 673 . 17 1 1 A 93 93 GLN H H 93 7.808 7.682 0.126 1 1 674 . 17 1 1 A 93 93 GLN HA H 93 4.578 4.829 -0.251 1 1 679 . 17 1 1 A 93 93 GLN CA C 93 50.918 54.299 -3.381 1 1 680 . 17 1 1 A 93 93 GLN CB C 93 28.602 31.126 -2.524 1 1 682 . 17 1 1 A 93 93 GLN N N 93 120.412 118.899 1.513 1 1 683 . 17 1 1 A 94 94 LEU H H 94 8.414 8.470 -0.056 1 1 684 . 17 1 1 A 94 94 LEU HA H 94 4.704 4.240 0.464 1 1 693 . 17 1 1 A 94 94 LEU CB C 94 39.873 42.598 -2.725 1 1 696 . 17 1 1 A 94 94 LEU N N 94 125.061 122.673 2.388 1 1 697 . 17 1 1 A 95 95 ILE H H 95 9.181 8.591 0.590 1 1 698 . 17 1 1 A 95 95 ILE HA H 95 4.371 4.903 -0.532 1 1 708 . 17 1 1 A 95 95 ILE CA C 95 63.319 60.739 2.580 1 1 709 . 17 1 1 A 95 95 ILE CB C 95 37.407 39.522 -2.115 1 1 711 . 17 1 1 A 95 95 ILE N N 95 127.724 121.638 6.086 1 1 712 . 17 1 1 A 96 96 THR H H 96 8.730 7.111 1.619 1 1 713 . 17 1 1 A 96 96 THR HA H 96 4.411 4.281 0.130 1 1 718 . 17 1 1 A 96 96 THR CA C 96 60.344 63.137 -2.793 1 1 719 . 17 1 1 A 96 96 THR CB C 96 59.719 69.767 -10.048 1 1 720 . 17 1 1 A 96 96 THR N N 96 124.240 119.020 5.220 1 1 721 . 17 1 1 A 97 97 LEU H H 97 8.790 8.722 0.068 1 1 722 . 17 1 1 A 97 97 LEU HA H 97 4.400 4.982 -0.582 1 1 732 . 17 1 1 A 97 97 LEU N N 97 126.147 124.983 1.164 1 1 733 . 17 1 1 A 98 98 GLU H H 98 7.596 9.195 -1.599 1 1 734 . 17 1 1 A 98 98 GLU HA H 98 5.102 4.794 0.308 1 1 739 . 17 1 1 A 98 98 GLU N N 98 116.937 122.388 -5.451 1 1 740 . 17 1 1 A 99 99 SER H H 99 8.906 8.678 0.228 1 1 741 . 17 1 1 A 99 99 SER HA H 99 4.504 5.374 -0.870 1 1 744 . 17 1 1 A 99 99 SER CA C 99 54.010 56.166 -2.156 1 1 745 . 17 1 1 A 99 99 SER CB C 99 63.876 66.417 -2.541 1 1 746 . 17 1 1 A 99 99 SER N N 99 117.823 116.154 1.669 1 1 747 . 17 1 1 A 100 100 GLY H H 100 7.250 7.898 -0.648 1 1 748 . 17 1 1 A 100 100 GLY HA2 H 100 4.872 3.863 1.009 1 1 749 . 17 1 1 A 100 100 GLY HA3 H 100 3.731 3.959 -0.228 1 1 750 . 17 1 1 A 100 100 GLY N N 100 109.436 109.839 -0.403 1 1 751 . 17 1 1 A 101 101 GLU H H 101 9.661 8.619 1.042 1 1 752 . 17 1 1 A 101 101 GLU HA H 101 5.643 4.814 0.829 1 1 757 . 17 1 1 A 101 101 GLU CA C 101 52.584 54.565 -1.981 1 1 758 . 17 1 1 A 101 101 GLU CB C 101 31.750 33.078 -1.328 1 1 759 . 17 1 1 A 101 101 GLU N N 101 126.793 120.745 6.048 1 1 760 . 17 1 1 A 102 102 PHE H H 102 10.441 10.454 -0.013 1 1 761 . 17 1 1 A 102 102 PHE HA H 102 5.248 5.083 0.165 1 1 768 . 17 1 1 A 102 102 PHE CA C 102 53.537 56.019 -2.482 1 1 769 . 17 1 1 A 102 102 PHE N N 102 131.837 124.871 6.966 1 1 770 . 17 1 1 A 103 103 GLN H H 103 9.135 9.517 -0.382 1 1 771 . 17 1 1 A 103 103 GLN HA H 103 5.205 5.139 0.066 1 1 776 . 17 1 1 A 103 103 GLN CA C 103 50.925 54.625 -3.700 1 1 777 . 17 1 1 A 103 103 GLN N N 103 127.720 127.679 0.041 1 1 778 . 17 1 1 A 104 104 VAL H H 104 8.937 9.158 -0.221 1 1 779 . 17 1 1 A 104 104 VAL HA H 104 4.780 5.073 -0.293 1 1 787 . 17 1 1 A 104 104 VAL CA C 104 57.086 61.074 -3.988 1 1 789 . 17 1 1 A 104 104 VAL N N 104 120.097 126.756 -6.659 1 1 790 . 17 1 1 A 105 105 TYR H H 105 9.108 9.728 -0.620 1 1 791 . 17 1 1 A 105 105 TYR HA H 105 4.834 5.212 -0.378 1 1 798 . 17 1 1 A 105 105 TYR CA C 105 54.486 57.475 -2.989 1 1 799 . 17 1 1 A 105 105 TYR N N 105 128.426 127.600 0.826 1 1 800 . 17 1 1 A 106 106 LYS H H 106 5.945 9.484 -3.539 1 1 805 . 17 1 1 A 106 106 LYS N N 106 129.163 129.748 -0.585 1 1 806 . 17 1 1 A 107 107 GLN H H 107 8.526 8.733 -0.207 1 1 807 . 17 1 1 A 107 107 GLN HA H 107 5.160 4.938 0.222 1 1 812 . 17 1 1 A 107 107 GLN CA C 107 52.584 54.684 -2.100 1 1 813 . 17 1 1 A 107 107 GLN CB C 107 26.175 30.475 -4.300 1 1 814 . 17 1 1 A 107 107 GLN N N 107 125.978 125.354 0.624 1 1 815 . 17 1 1 A 108 108 SER H H 108 8.621 8.601 0.020 1 1 816 . 17 1 1 A 108 108 SER HA H 108 4.403 4.555 -0.152 1 1 819 . 17 1 1 A 108 108 SER CA C 108 58.521 61.912 -3.391 1 1 820 . 17 1 1 A 108 108 SER CB C 108 60.737 63.770 -3.033 1 1 821 . 17 1 1 A 108 108 SER N N 108 117.542 115.983 1.559 1 1 822 . 17 1 1 A 109 109 HIS H H 109 10.381 8.303 2.078 1 1 823 . 17 1 1 A 109 109 HIS HA H 109 4.594 4.834 -0.240 1 1 828 . 17 1 1 A 109 109 HIS CA C 109 51.743 56.464 -4.721 1 1 829 . 17 1 1 A 109 109 HIS CB C 109 27.174 32.062 -4.888 1 1 830 . 17 1 1 A 109 109 HIS N N 109 118.449 114.641 3.808 1 1 831 . 17 1 1 A 110 110 SER H H 110 7.366 7.861 -0.495 1 1 832 . 17 1 1 A 110 110 SER HA H 110 4.870 4.781 0.089 1 1 835 . 17 1 1 A 110 110 SER CB C 110 62.986 64.380 -1.394 1 1 836 . 17 1 1 A 110 110 SER N N 110 113.397 112.486 0.911 1 1 837 . 17 1 1 A 111 111 ALA H H 111 8.541 8.245 0.296 1 1 838 . 17 1 1 A 111 111 ALA HA H 111 4.826 4.980 -0.154 1 1 842 . 17 1 1 A 111 111 ALA CA C 111 49.015 51.812 -2.797 1 1 843 . 17 1 1 A 111 111 ALA CB C 111 20.256 23.228 -2.972 1 1 844 . 17 1 1 A 111 111 ALA N N 111 117.786 120.617 -2.831 1 1 845 . 17 1 1 A 112 112 LEU H H 112 8.529 9.066 -0.537 1 1 846 . 17 1 1 A 112 112 LEU HA H 112 5.680 5.010 0.670 1 1 855 . 17 1 1 A 112 112 LEU CA C 112 51.818 53.896 -2.078 1 1 856 . 17 1 1 A 112 112 LEU N N 112 116.345 116.395 -0.050 1 1 857 . 17 1 1 A 113 113 THR H H 113 8.758 8.933 -0.175 1 1 858 . 17 1 1 A 113 113 THR HA H 113 5.563 5.364 0.199 1 1 863 . 17 1 1 A 113 113 THR CA C 113 54.458 60.556 -6.098 1 1 864 . 17 1 1 A 113 113 THR CB C 113 68.586 70.493 -1.907 1 1 866 . 17 1 1 A 113 113 THR N N 113 110.469 114.371 -3.902 1 1 867 . 17 1 1 A 114 114 ALA H H 114 8.829 9.273 -0.444 1 1 868 . 17 1 1 A 114 114 ALA HA H 114 4.466 4.897 -0.431 1 1 872 . 17 1 1 A 114 114 ALA CA C 114 48.886 51.753 -2.867 1 1 873 . 17 1 1 A 114 114 ALA CB C 114 21.583 22.376 -0.793 1 1 874 . 17 1 1 A 114 114 ALA N N 114 121.456 123.945 -2.489 1 1 875 . 17 1 1 A 115 115 LEU H H 115 8.407 9.508 -1.101 1 1 876 . 17 1 1 A 115 115 LEU HA H 115 4.814 4.697 0.117 1 1 886 . 17 1 1 A 115 115 LEU N N 115 119.223 123.612 -4.389 1 1 887 . 17 1 1 A 116 116 GLN H H 116 9.720 9.470 0.250 1 1 888 . 17 1 1 A 116 116 GLN HA H 116 5.312 5.044 0.268 1 1 893 . 17 1 1 A 116 116 GLN CA C 116 50.544 53.839 -3.295 1 1 894 . 17 1 1 A 116 116 GLN N N 116 127.827 121.934 5.893 1 1 895 . 17 1 1 A 117 117 THR H H 117 9.663 8.838 0.825 1 1 896 . 17 1 1 A 117 117 THR HA H 117 4.198 4.937 -0.739 1 1 901 . 17 1 1 A 117 117 THR CA C 117 64.037 60.532 3.505 1 1 902 . 17 1 1 A 117 117 THR CB C 117 66.868 72.678 -5.810 1 1 904 . 17 1 1 A 117 117 THR N N 117 128.929 118.343 10.586 1 1 905 . 17 1 1 A 118 118 GLU H H 118 9.486 9.185 0.301 1 1 906 . 17 1 1 A 118 118 GLU HA H 118 4.885 4.387 0.498 1 1 911 . 17 1 1 A 118 118 GLU N N 118 123.497 124.458 -0.961 1 1 912 . 17 1 1 A 119 119 GLN H H 119 8.076 7.823 0.253 1 1 913 . 17 1 1 A 119 119 GLN HA H 119 5.331 4.819 0.512 1 1 916 . 17 1 1 A 119 119 GLN CA C 119 51.858 54.314 -2.456 1 1 917 . 17 1 1 A 119 119 GLN N N 119 118.023 117.944 0.079 1 1 918 . 17 1 1 A 120 120 GLU H H 120 9.078 8.367 0.711 1 1 919 . 17 1 1 A 120 120 GLU HA H 120 5.071 4.917 0.154 1 1 924 . 17 1 1 A 120 120 GLU N N 120 118.433 123.273 -4.840 1 1 925 . 17 1 1 A 121 121 GLN H H 121 7.711 8.920 -1.209 1 1 926 . 17 1 1 A 121 121 GLN HA H 121 4.430 5.095 -0.665 1 1 933 . 17 1 1 A 121 121 GLN CA C 121 53.996 54.508 -0.512 1 1 934 . 17 1 1 A 121 121 GLN CB C 121 27.158 32.866 -5.708 1 1 936 . 17 1 1 A 121 121 GLN N N 121 122.412 117.730 4.682 1 1 938 . 17 1 1 A 122 122 ASP H H 122 8.675 8.996 -0.321 1 1 939 . 17 1 1 A 122 122 ASP HA H 122 4.632 4.977 -0.345 1 1 942 . 17 1 1 A 122 122 ASP CA C 122 48.797 51.827 -3.030 1 1 943 . 17 1 1 A 122 122 ASP CB C 122 39.852 42.910 -3.058 1 1 944 . 17 1 1 A 122 122 ASP N N 122 128.625 122.269 6.356 1 1 945 . 17 1 1 A 123 123 PRO CA C 123 61.579 63.582 -2.003 1 1 946 . 17 1 1 A 123 123 PRO CB C 123 29.597 31.599 -2.002 1 1 948 . 17 1 1 A 124 124 GLU H H 124 8.297 7.611 0.686 1 1 949 . 17 1 1 A 124 124 GLU HA H 124 4.196 4.482 -0.286 1 1 954 . 17 1 1 A 124 124 GLU CA C 124 53.025 55.362 -2.337 1 1 955 . 17 1 1 A 124 124 GLU CB C 124 27.927 31.024 -3.097 1 1 957 . 17 1 1 A 124 124 GLU N N 124 115.538 119.395 -3.857 1 1 958 . 17 1 1 A 125 125 HIS H H 125 7.419 8.052 -0.633 1 1 959 . 17 1 1 A 125 125 HIS HA H 125 4.833 4.163 0.670 1 1 964 . 17 1 1 A 125 125 HIS CA C 125 51.886 59.160 -7.274 1 1 965 . 17 1 1 A 125 125 HIS CB C 125 26.387 29.955 -3.568 1 1 966 . 17 1 1 A 125 125 HIS N N 125 117.464 123.768 -6.304 1 1 967 . 17 1 1 A 126 126 SER H H 126 8.441 8.347 0.094 1 1 968 . 17 1 1 A 126 126 SER HA H 126 4.261 4.003 0.258 1 1 971 . 17 1 1 A 126 126 SER CA C 126 57.988 61.658 -3.670 1 1 972 . 17 1 1 A 126 126 SER N N 126 117.954 113.611 4.343 1 1 973 . 17 1 1 A 127 127 GLU H H 127 9.221 9.803 -0.582 1 1 974 . 17 1 1 A 127 127 GLU HA H 127 4.366 4.519 -0.153 1 1 979 . 17 1 1 A 127 127 GLU CA C 127 53.707 56.475 -2.768 1 1 980 . 17 1 1 A 127 127 GLU CB C 127 25.492 30.562 -5.070 1 1 981 . 17 1 1 A 127 127 GLU N N 127 120.404 119.645 0.759 1 1 982 . 17 1 1 A 128 128 LYS H H 128 8.262 8.677 -0.415 1 1 983 . 17 1 1 A 128 128 LYS HA H 128 4.661 4.912 -0.251 1 1 990 . 17 1 1 A 128 128 LYS CA C 128 52.264 58.171 -5.907 1 1 991 . 17 1 1 A 128 128 LYS CB C 128 32.404 31.564 0.840 1 1 994 . 17 1 1 A 128 128 LYS N N 128 122.166 118.084 4.082 1 1 995 . 17 1 1 A 129 129 MET H H 129 8.242 7.577 0.665 1 1 996 . 17 1 1 A 129 129 MET HA H 129 5.012 5.079 -0.067 1 1 1001 . 17 1 1 A 129 129 MET CA C 129 50.958 54.475 -3.517 1 1 1003 . 17 1 1 A 129 129 MET N N 129 119.422 117.086 2.336 1 1 1004 . 17 1 1 A 130 130 VAL H H 130 9.200 9.496 -0.296 1 1 1005 . 17 1 1 A 130 130 VAL HA H 130 4.609 4.742 -0.133 1 1 1013 . 17 1 1 A 130 130 VAL CA C 130 56.296 60.491 -4.195 1 1 1014 . 17 1 1 A 130 130 VAL CB C 130 32.606 36.465 -3.859 1 1 1015 . 17 1 1 A 130 130 VAL N N 130 118.290 122.505 -4.215 1 1 1016 . 17 1 1 A 131 131 ALA H H 131 8.368 8.534 -0.166 1 1 1017 . 17 1 1 A 131 131 ALA HA H 131 4.654 5.014 -0.360 1 1 1021 . 17 1 1 A 131 131 ALA CA C 131 49.739 51.879 -2.140 1 1 1022 . 17 1 1 A 131 131 ALA CB C 131 15.351 20.830 -5.479 1 1 1023 . 17 1 1 A 131 131 ALA N N 131 126.734 124.392 2.342 1 1 1024 . 17 1 1 A 132 132 LYS H H 132 7.732 8.242 -0.510 1 1 1025 . 17 1 1 A 132 132 LYS HA H 132 4.171 4.699 -0.528 1 1 1028 . 17 1 1 A 132 132 LYS N N 132 127.309 122.056 5.253 1 1 1029 . 17 1 1 A 133 133 ARG H H 133 8.193 8.374 -0.181 1 1 1030 . 17 1 1 A 133 133 ARG HA H 133 5.073 4.887 0.186 1 1 1038 . 17 1 1 A 133 133 ARG N N 133 122.190 121.213 0.977 1 1 1040 . 17 1 1 A 134 134 ARG H H 134 7.539 8.365 -0.826 1 1 1041 . 17 1 1 A 134 134 ARG HA H 134 4.667 4.772 -0.105 1 1 1049 . 17 1 1 A 134 134 ARG CA C 134 52.584 54.030 -1.446 1 1 1050 . 17 1 1 A 134 134 ARG CB C 134 31.325 33.574 -2.249 1 1 1052 . 17 1 1 A 134 134 ARG N N 134 121.632 124.767 -3.135 1 1 1054 . 17 1 1 A 135 135 PHE H H 135 8.816 9.005 -0.189 1 1 1055 . 17 1 1 A 135 135 PHE HA H 135 5.680 5.355 0.325 1 1 1062 . 17 1 1 A 135 135 PHE N N 135 125.107 120.979 4.128 1 1 1063 . 17 1 1 A 136 136 ARG H H 136 7.741 9.525 -1.784 1 1 1064 . 17 1 1 A 136 136 ARG HA H 136 4.402 4.699 -0.297 1 1 1068 . 17 1 1 A 136 136 ARG N N 136 125.640 124.421 1.219 1 1 1070 . 17 1 1 A 137 137 ILE H H 137 8.556 8.620 -0.064 1 1 1071 . 17 1 1 A 137 137 ILE HA H 137 3.912 4.105 -0.193 1 1 1076 . 17 1 1 A 137 137 ILE CA C 137 55.676 61.569 -5.893 1 1 1079 . 17 1 1 A 137 137 ILE N N 137 122.891 127.873 -4.982 1 1 1080 . 17 1 1 A 138 138 GLY H H 138 8.676 8.996 -0.320 1 1 1081 . 17 1 1 A 138 138 GLY HA2 H 138 3.740 4.183 -0.443 1 1 1082 . 17 1 1 A 138 138 GLY HA3 H 138 2.982 4.192 -1.210 1 1 1083 . 17 1 1 A 138 138 GLY CA C 138 41.908 46.115 -4.207 1 1 1084 . 17 1 1 A 138 138 GLY N N 138 117.058 115.029 2.029 1 1 1085 . 17 1 1 A 139 139 ASP H H 139 7.858 8.209 -0.351 1 1 1086 . 17 1 1 A 139 139 ASP HA H 139 4.753 5.037 -0.284 1 1 1089 . 17 1 1 A 139 139 ASP CA C 139 52.584 53.671 -1.087 1 1 1090 . 17 1 1 A 139 139 ASP CB C 139 43.062 42.950 0.112 1 1 1091 . 17 1 1 A 139 139 ASP N N 139 124.516 120.686 3.830 1 1 1092 . 17 1 1 A 140 140 ILE H H 140 8.354 8.776 -0.422 1 1 1093 . 17 1 1 A 140 140 ILE HA H 140 4.473 4.517 -0.044 1 1 1103 . 17 1 1 A 140 140 ILE CB C 140 36.173 38.709 -2.536 1 1 1105 . 17 1 1 A 140 140 ILE N N 140 120.679 123.082 -2.403 1 1 1106 . 17 1 1 A 141 141 ALA H H 141 8.708 7.588 1.120 1 1 1107 . 17 1 1 A 141 141 ALA HA H 141 4.862 4.436 0.426 1 1 1111 . 17 1 1 A 141 141 ALA CA C 141 47.968 51.636 -3.668 1 1 1112 . 17 1 1 A 141 141 ALA CB C 141 21.733 19.822 1.911 1 1 1113 . 17 1 1 A 141 141 ALA N N 141 130.144 127.442 2.702 1 1 1114 . 17 1 1 A 142 142 GLY H H 142 7.888 8.059 -0.171 1 1 1115 . 17 1 1 A 142 142 GLY HA2 H 142 4.519 3.703 0.816 1 1 1116 . 17 1 1 A 142 142 GLY HA3 H 142 3.634 3.963 -0.329 1 1 1117 . 17 1 1 A 142 142 GLY N N 142 102.272 110.662 -8.390 1 1 1118 . 17 1 1 A 143 143 GLU H H 143 8.068 7.459 0.609 1 1 1119 . 17 1 1 A 143 143 GLU HA H 143 4.577 4.319 0.258 1 1 1124 . 17 1 1 A 143 143 GLU N N 143 120.569 120.780 -0.211 1 1 1125 . 17 1 1 A 144 144 HIS H H 144 8.478 8.116 0.362 1 1 1126 . 17 1 1 A 144 144 HIS HA H 144 4.968 4.586 0.382 1 1 1131 . 17 1 1 A 144 144 HIS N N 144 124.275 119.872 4.403 1 1 1132 . 17 1 1 A 145 145 THR H H 145 9.031 9.018 0.013 1 1 1133 . 17 1 1 A 145 145 THR HA H 145 4.025 4.749 -0.724 1 1 1138 . 17 1 1 A 145 145 THR CA C 145 61.247 63.253 -2.006 1 1 1139 . 17 1 1 A 145 145 THR CB C 145 65.181 69.777 -4.596 1 1 1141 . 17 1 1 A 145 145 THR N N 145 125.828 119.302 6.526 1 1 1142 . 17 1 1 A 146 146 SER H H 146 9.077 7.980 1.097 1 1 1143 . 17 1 1 A 146 146 SER HA H 146 4.684 5.568 -0.884 1 1 1145 . 17 1 1 A 146 146 SER CA C 146 56.067 58.895 -2.828 1 1 1146 . 17 1 1 A 146 146 SER CB C 146 60.510 63.138 -2.628 1 1 1147 . 17 1 1 A 146 146 SER N N 146 124.154 116.176 7.978 1 1 1148 . 17 1 1 A 147 147 PHE H H 147 9.049 8.391 0.658 1 1 1149 . 17 1 1 A 147 147 PHE HA H 147 4.022 4.383 -0.361 1 1 1154 . 17 1 1 A 147 147 PHE N N 147 127.670 126.046 1.624 1 1 1155 . 17 1 1 A 148 148 ASP H H 148 8.504 8.477 0.027 1 1 1156 . 17 1 1 A 148 148 ASP HA H 148 4.422 4.321 0.101 1 1 1158 . 17 1 1 A 148 148 ASP CA C 148 52.584 57.303 -4.719 1 1 1159 . 17 1 1 A 148 148 ASP CB C 148 37.800 40.465 -2.665 1 1 1160 . 17 1 1 A 148 148 ASP N N 148 114.377 119.484 -5.107 1 1 1161 . 17 1 1 A 149 149 LYS H H 149 7.380 8.405 -1.025 1 1 1162 . 17 1 1 A 149 149 LYS HA H 149 4.487 4.315 0.172 1 1 1171 . 17 1 1 A 149 149 LYS CA C 149 51.735 56.443 -4.708 1 1 1172 . 17 1 1 A 149 149 LYS CB C 149 30.162 32.579 -2.417 1 1 1175 . 17 1 1 A 149 149 LYS N N 149 119.137 116.010 3.127 1 1 1176 . 17 1 1 A 150 150 LEU H H 150 6.886 8.509 -1.623 1 1 1177 . 17 1 1 A 150 150 LEU HA H 150 3.996 4.513 -0.517 1 1 1186 . 17 1 1 A 150 150 LEU CA C 150 50.502 52.003 -1.501 1 1 1187 . 17 1 1 A 150 150 LEU N N 150 120.614 117.982 2.632 1 1 1188 . 17 1 1 A 151 151 PRO CB C 151 29.567 31.647 -2.080 1 1 1190 . 17 1 1 A 152 152 LYS H H 152 8.076 8.082 -0.006 1 1 1191 . 17 1 1 A 152 152 LYS HA H 152 4.346 4.641 -0.295 1 1 1195 . 17 1 1 A 152 152 LYS CA C 152 53.182 54.847 -1.665 1 1 1196 . 17 1 1 A 152 152 LYS CB C 152 31.487 32.788 -1.301 1 1 1198 . 17 1 1 A 152 152 LYS N N 152 118.133 117.261 0.872 1 1 1199 . 17 1 1 A 153 153 ASP H H 153 7.982 8.662 -0.680 1 1 1200 . 17 1 1 A 153 153 ASP HA H 153 4.402 4.805 -0.403 1 1 1203 . 17 1 1 A 153 153 ASP CA C 153 52.584 54.033 -1.449 1 1 1204 . 17 1 1 A 153 153 ASP CB C 153 37.762 38.960 -1.198 1 1 1205 . 17 1 1 A 153 153 ASP N N 153 115.735 126.456 -10.721 1 1 1206 . 17 1 1 A 154 154 VAL H H 154 6.987 10.499 -3.512 1 1 1207 . 17 1 1 A 154 154 VAL HA H 154 4.406 4.630 -0.224 1 1 1215 . 17 1 1 A 154 154 VAL CA C 154 58.408 61.547 -3.139 1 1 1216 . 17 1 1 A 154 154 VAL CB C 154 32.617 34.211 -1.594 1 1 1217 . 17 1 1 A 154 154 VAL N N 154 116.266 121.729 -5.463 1 1 1218 . 17 1 1 A 155 155 MET H H 155 8.444 8.785 -0.341 1 1 1219 . 17 1 1 A 155 155 MET HA H 155 5.416 4.314 1.102 1 1 1224 . 17 1 1 A 155 155 MET CA C 155 51.183 56.148 -4.965 1 1 1226 . 17 1 1 A 155 155 MET N N 155 124.950 127.790 -2.840 1 1 1227 . 17 1 1 A 156 156 ALA H H 156 9.226 8.355 0.871 1 1 1228 . 17 1 1 A 156 156 ALA HA H 156 4.693 5.266 -0.573 1 1 1232 . 17 1 1 A 156 156 ALA CA C 156 48.379 50.792 -2.413 1 1 1233 . 17 1 1 A 156 156 ALA CB C 156 21.051 22.649 -1.598 1 1 1234 . 17 1 1 A 156 156 ALA N N 156 129.938 124.334 5.604 1 1 1235 . 17 1 1 A 157 157 THR H H 157 8.554 8.798 -0.244 1 1 1236 . 17 1 1 A 157 157 THR HA H 157 4.839 4.546 0.293 1 1 1241 . 17 1 1 A 157 157 THR CA C 157 59.555 63.378 -3.823 1 1 1242 . 17 1 1 A 157 157 THR CB C 157 68.575 69.577 -1.002 1 1 1244 . 17 1 1 A 157 157 THR N N 157 118.815 120.073 -1.258 1 1 1245 . 17 1 1 A 158 158 TYR H H 158 9.974 9.584 0.390 1 1 1246 . 17 1 1 A 158 158 TYR HA H 158 4.435 5.274 -0.839 1 1 1253 . 17 1 1 A 158 158 TYR N N 158 126.958 126.322 0.636 1 1 1254 . 17 1 1 A 159 159 ARG H H 159 8.909 8.798 0.111 1 1 1255 . 17 1 1 A 159 159 ARG HA H 159 5.444 5.266 0.178 1 1 1263 . 17 1 1 A 159 159 ARG CA C 159 51.933 54.417 -2.484 1 1 1264 . 17 1 1 A 159 159 ARG N N 159 121.721 120.316 1.405 1 1 1266 . 17 1 1 A 160 160 GLY H H 160 8.910 8.434 0.476 1 1 1267 . 17 1 1 A 160 160 GLY HA2 H 160 4.904 4.465 0.439 1 1 1268 . 17 1 1 A 160 160 GLY HA3 H 160 4.484 4.742 -0.258 1 1 1269 . 17 1 1 A 160 160 GLY N N 160 113.921 108.495 5.426 1 1 1270 . 17 1 1 A 161 161 THR H H 161 9.110 9.553 -0.443 1 1 1271 . 17 1 1 A 161 161 THR HA H 161 4.810 5.435 -0.625 1 1 1276 . 17 1 1 A 161 161 THR CA C 161 59.603 61.290 -1.687 1 1 1277 . 17 1 1 A 161 161 THR CB C 161 69.909 72.408 -2.499 1 1 1279 . 17 1 1 A 161 161 THR N N 161 126.813 115.626 11.187 1 1 1280 . 17 1 1 A 162 162 ALA H H 162 7.137 8.804 -1.667 1 1 1281 . 17 1 1 A 162 162 ALA HA H 162 5.361 5.261 0.100 1 1 1285 . 17 1 1 A 162 162 ALA CA C 162 46.573 51.269 -4.696 1 1 1286 . 17 1 1 A 162 162 ALA CB C 162 20.959 23.800 -2.841 1 1 1287 . 17 1 1 A 162 162 ALA N N 162 128.111 123.592 4.519 1 1 1288 . 17 1 1 A 163 163 PHE H H 163 8.587 9.857 -1.270 1 1 1289 . 17 1 1 A 163 163 PHE HA H 163 5.538 5.607 -0.069 1 1 1296 . 17 1 1 A 163 163 PHE N N 163 117.349 114.821 2.528 1 1 1297 . 17 1 1 A 164 164 GLY H H 164 8.650 8.971 -0.321 1 1 1298 . 17 1 1 A 164 164 GLY HA2 H 164 4.210 4.088 0.122 1 1 1299 . 17 1 1 A 164 164 GLY HA3 H 164 3.285 4.231 -0.946 1 1 1300 . 17 1 1 A 164 164 GLY CA C 164 40.377 43.581 -3.204 1 1 1301 . 17 1 1 A 164 164 GLY N N 164 108.839 107.665 1.174 1 1 1302 . 17 1 1 A 165 165 SER H H 165 7.684 8.810 -1.126 1 1 1303 . 17 1 1 A 165 165 SER HA H 165 3.458 3.615 -0.157 1 1 1304 . 17 1 1 A 165 165 SER N N 165 116.037 116.062 -0.025 1 1 1305 . 17 1 1 A 166 166 ASP H H 166 9.718 8.138 1.580 1 1 1306 . 17 1 1 A 166 166 ASP HA H 166 4.281 4.625 -0.344 1 1 1309 . 17 1 1 A 166 166 ASP CA C 166 52.584 53.163 -0.579 1 1 1310 . 17 1 1 A 166 166 ASP N N 166 125.166 118.592 6.574 1 1 1311 . 17 1 1 A 167 167 ASP H H 167 7.655 7.412 0.243 1 1 1312 . 17 1 1 A 167 167 ASP HA H 167 4.666 4.873 -0.207 1 1 1315 . 17 1 1 A 167 167 ASP CB C 167 38.948 44.159 -5.211 1 1 1316 . 17 1 1 A 167 167 ASP N N 167 117.491 118.803 -1.312 1 1 1317 . 17 1 1 A 168 168 ALA H H 168 8.585 8.630 -0.045 1 1 1318 . 17 1 1 A 168 168 ALA HA H 168 5.012 4.240 0.772 1 1 1322 . 17 1 1 A 168 168 ALA CA C 168 47.485 52.655 -5.170 1 1 1323 . 17 1 1 A 168 168 ALA N N 168 128.834 122.337 6.497 1 1 1324 . 17 1 1 A 169 169 GLY H H 169 8.472 7.510 0.962 1 1 1325 . 17 1 1 A 169 169 GLY HA2 H 169 4.404 4.210 0.194 1 1 1326 . 17 1 1 A 169 169 GLY HA3 H 169 4.051 4.248 -0.197 1 1 1327 . 17 1 1 A 169 169 GLY CA C 169 43.257 46.097 -2.840 1 1 1328 . 17 1 1 A 169 169 GLY N N 169 107.133 104.533 2.600 1 1 1329 . 17 1 1 A 170 170 GLY H H 170 7.229 8.124 -0.895 1 1 1330 . 17 1 1 A 170 170 GLY HA2 H 170 4.223 4.288 -0.065 1 1 1331 . 17 1 1 A 170 170 GLY HA3 H 170 3.781 4.322 -0.541 1 1 1332 . 17 1 1 A 170 170 GLY CA C 170 43.310 45.719 -2.409 1 1 1333 . 17 1 1 A 170 170 GLY N N 170 107.542 109.626 -2.084 1 1 1334 . 17 1 1 A 171 171 LYS H H 171 9.641 8.836 0.805 1 1 1335 . 17 1 1 A 171 171 LYS HA H 171 5.129 4.710 0.419 1 1 1342 . 17 1 1 A 171 171 LYS CA C 171 51.355 56.091 -4.736 1 1 1343 . 17 1 1 A 171 171 LYS N N 171 124.322 124.786 -0.464 1 1 1344 . 17 1 1 A 172 172 LEU H H 172 7.764 8.668 -0.904 1 1 1345 . 17 1 1 A 172 172 LEU HA H 172 4.973 5.586 -0.613 1 1 1353 . 17 1 1 A 172 172 LEU CA C 172 50.348 53.118 -2.770 1 1 1354 . 17 1 1 A 172 172 LEU N N 172 126.389 120.882 5.507 1 1 1355 . 17 1 1 A 173 173 THR H H 173 8.321 8.837 -0.516 1 1 1356 . 17 1 1 A 173 173 THR HA H 173 5.017 5.079 -0.062 1 1 1361 . 17 1 1 A 173 173 THR CA C 173 59.149 62.304 -3.155 1 1 1362 . 17 1 1 A 173 173 THR CB C 173 67.449 69.718 -2.269 1 1 1364 . 17 1 1 A 173 173 THR N N 173 123.553 118.774 4.779 1 1 1365 . 17 1 1 A 174 174 TYR H H 174 9.367 10.016 -0.649 1 1 1366 . 17 1 1 A 174 174 TYR HA H 174 4.660 5.141 -0.481 1 1 1373 . 17 1 1 A 174 174 TYR CB C 174 41.267 41.824 -0.557 1 1 1374 . 17 1 1 A 174 174 TYR N N 174 129.583 126.162 3.421 1 1 1375 . 17 1 1 A 175 175 THR H H 175 8.529 9.735 -1.206 1 1 1376 . 17 1 1 A 175 175 THR HA H 175 5.388 5.166 0.222 1 1 1381 . 17 1 1 A 175 175 THR CA C 175 58.216 61.731 -3.515 1 1 1382 . 17 1 1 A 175 175 THR CB C 175 68.575 70.822 -2.247 1 1 1384 . 17 1 1 A 175 175 THR N N 175 125.967 115.444 10.523 1 1 1385 . 17 1 1 A 176 176 ILE H H 176 9.139 8.615 0.524 1 1 1386 . 17 1 1 A 176 176 ILE HA H 176 4.382 4.577 -0.195 1 1 1395 . 17 1 1 A 176 176 ILE CA C 176 58.006 59.816 -1.810 1 1 1396 . 17 1 1 A 176 176 ILE CB C 176 38.881 39.977 -1.096 1 1 1400 . 17 1 1 A 176 176 ILE N N 176 123.715 127.311 -3.596 1 1 1401 . 17 1 1 A 177 177 ASP H H 177 8.501 8.753 -0.252 1 1 1402 . 17 1 1 A 177 177 ASP HA H 177 5.011 4.655 0.356 1 1 1405 . 17 1 1 A 177 177 ASP CA C 177 49.089 53.266 -4.177 1 1 1406 . 17 1 1 A 177 177 ASP CB C 177 39.282 41.829 -2.547 1 1 1407 . 17 1 1 A 177 177 ASP N N 177 125.978 127.675 -1.697 1 1 1408 . 17 1 1 A 178 178 PHE H H 178 8.913 8.340 0.573 1 1 1409 . 17 1 1 A 178 178 PHE HA H 178 3.993 4.341 -0.348 1 1 1414 . 17 1 1 A 178 178 PHE CB C 178 34.588 39.440 -4.852 1 1 1415 . 17 1 1 A 178 178 PHE N N 178 123.522 124.398 -0.876 1 1 1416 . 17 1 1 A 179 179 ALA H H 179 8.487 9.080 -0.593 1 1 1417 . 17 1 1 A 179 179 ALA HA H 179 4.528 4.465 0.063 1 1 1421 . 17 1 1 A 179 179 ALA CA C 179 52.584 54.623 -2.039 1 1 1422 . 17 1 1 A 179 179 ALA CB C 179 15.666 18.686 -3.020 1 1 1423 . 17 1 1 A 179 179 ALA N N 179 124.061 122.721 1.340 1 1 1424 . 17 1 1 A 180 180 ALA H H 180 7.162 7.700 -0.538 1 1 1425 . 17 1 1 A 180 180 ALA HA H 180 4.313 4.883 -0.570 1 1 1429 . 17 1 1 A 180 180 ALA CA C 180 49.006 54.763 -5.757 1 1 1430 . 17 1 1 A 180 180 ALA CB C 180 16.933 19.284 -2.351 1 1 1431 . 17 1 1 A 180 180 ALA N N 180 119.710 120.699 -0.989 1 1 1432 . 17 1 1 A 181 181 LYS H H 181 8.092 7.639 0.453 1 1 1433 . 17 1 1 A 181 181 LYS HA H 181 3.457 4.676 -1.219 1 1 1440 . 17 1 1 A 181 181 LYS CA C 181 54.783 55.644 -0.861 1 1 1441 . 17 1 1 A 181 181 LYS CB C 181 27.088 32.886 -5.798 1 1 1444 . 17 1 1 A 181 181 LYS N N 181 114.996 111.834 3.162 1 1 1445 . 17 1 1 A 182 182 GLN H H 182 7.532 7.413 0.119 1 1 1446 . 17 1 1 A 182 182 GLN HA H 182 5.304 4.892 0.412 1 1 1453 . 17 1 1 A 182 182 GLN CA C 182 51.473 55.131 -3.658 1 1 1454 . 17 1 1 A 182 182 GLN CB C 182 31.585 32.790 -1.205 1 1 1455 . 17 1 1 A 182 182 GLN N N 182 115.064 119.443 -4.379 1 1 1457 . 17 1 1 A 183 183 GLY H H 183 9.026 8.202 0.824 1 1 1458 . 17 1 1 A 183 183 GLY HA2 H 183 5.376 4.250 1.126 1 1 1459 . 17 1 1 A 183 183 GLY HA3 H 183 3.567 4.320 -0.753 1 1 1460 . 17 1 1 A 183 183 GLY CA C 183 42.361 45.429 -3.068 1 1 1461 . 17 1 1 A 183 183 GLY N N 183 111.505 109.238 2.267 1 1 1462 . 17 1 1 A 184 184 HIS H H 184 7.508 8.803 -1.295 1 1 1463 . 17 1 1 A 184 184 HIS HA H 184 4.304 5.302 -0.998 1 1 1467 . 17 1 1 A 184 184 HIS CA C 184 52.793 53.565 -0.772 1 1 1468 . 17 1 1 A 184 184 HIS CB C 184 27.906 32.855 -4.949 1 1 1469 . 17 1 1 A 184 184 HIS N N 184 111.297 119.978 -8.681 1 1 1470 . 17 1 1 A 185 185 GLY H H 185 9.160 7.222 1.938 1 1 1471 . 17 1 1 A 185 185 GLY HA2 H 185 4.464 2.157 2.307 1 1 1472 . 17 1 1 A 185 185 GLY HA3 H 185 4.117 3.332 0.785 1 1 1473 . 17 1 1 A 185 185 GLY CA C 185 44.212 44.776 -0.564 1 1 1474 . 17 1 1 A 185 185 GLY N N 185 107.398 104.800 2.598 1 1 1475 . 17 1 1 A 186 186 LYS H H 186 9.170 7.903 1.267 1 1 1476 . 17 1 1 A 186 186 LYS HA H 186 4.925 4.888 0.037 1 1 1481 . 17 1 1 A 186 186 LYS CB C 186 33.642 35.841 -2.199 1 1 1482 . 17 1 1 A 186 186 LYS N N 186 122.690 120.337 2.353 1 1 1483 . 17 1 1 A 187 187 ILE H H 187 8.444 8.243 0.201 1 1 1484 . 17 1 1 A 187 187 ILE HA H 187 4.626 4.700 -0.074 1 1 1487 . 17 1 1 A 187 187 ILE N N 187 124.320 126.081 -1.761 1 1 1488 . 17 1 1 A 188 188 GLU H H 188 8.590 8.534 0.056 1 1 1489 . 17 1 1 A 188 188 GLU HA H 188 4.650 4.690 -0.040 1 1 1495 . 17 1 1 A 188 188 GLU N N 188 122.575 128.135 -5.560 1 1 1496 . 17 1 1 A 189 189 HIS H H 189 8.726 7.719 1.007 1 1 1497 . 17 1 1 A 189 189 HIS HA H 189 4.055 4.141 -0.086 1 1 1501 . 17 1 1 A 189 189 HIS CA C 189 54.623 59.348 -4.725 1 1 1502 . 17 1 1 A 189 189 HIS CB C 189 24.997 29.868 -4.871 1 1 1503 . 17 1 1 A 189 189 HIS N N 189 111.381 122.029 -10.648 1 1 1504 . 17 1 1 A 190 190 LEU H H 190 9.715 7.858 1.857 1 1 1505 . 17 1 1 A 190 190 LEU HA H 190 4.379 4.366 0.013 1 1 1515 . 17 1 1 A 190 190 LEU N N 190 124.648 116.710 7.938 1 1 1516 . 17 1 1 A 191 191 LYS H H 191 10.099 8.079 2.020 1 1 1517 . 17 1 1 A 191 191 LYS HA H 191 3.736 4.555 -0.819 1 1 1524 . 17 1 1 A 191 191 LYS CA C 191 55.815 56.797 -0.982 1 1 1525 . 17 1 1 A 191 191 LYS CB C 191 30.201 35.295 -5.094 1 1 1527 . 17 1 1 A 191 191 LYS N N 191 123.618 120.886 2.732 1 1 1528 . 17 1 1 A 192 192 SER H H 192 6.991 7.585 -0.594 1 1 1529 . 17 1 1 A 192 192 SER HA H 192 4.743 4.462 0.281 1 1 1532 . 17 1 1 A 192 192 SER CA C 192 51.974 56.562 -4.588 1 1 1533 . 17 1 1 A 192 192 SER CB C 192 60.005 64.022 -4.017 1 1 1534 . 17 1 1 A 192 192 SER N N 192 115.071 117.006 -1.935 1 1 1535 . 17 1 1 A 193 193 PRO CB C 193 29.607 29.974 -0.367 1 1 1537 . 17 1 1 A 194 194 GLU H H 194 8.213 8.810 -0.597 1 1 1538 . 17 1 1 A 194 194 GLU HA H 194 3.063 4.626 -1.563 1 1 1543 . 17 1 1 A 194 194 GLU CA C 194 54.185 57.175 -2.990 1 1 1545 . 17 1 1 A 194 194 GLU N N 194 114.055 119.338 -5.283 1 1 1546 . 17 1 1 A 195 195 LEU H H 195 7.082 7.757 -0.675 1 1 1547 . 17 1 1 A 195 195 LEU HA H 195 4.027 4.404 -0.377 1 1 1557 . 17 1 1 A 195 195 LEU CA C 195 51.361 54.390 -3.029 1 1 1558 . 17 1 1 A 195 195 LEU CB C 195 38.950 41.334 -2.384 1 1 1561 . 17 1 1 A 195 195 LEU N N 195 113.898 118.304 -4.406 1 1 1562 . 17 1 1 A 196 196 ASN H H 196 7.060 7.909 -0.849 1 1 1563 . 17 1 1 A 196 196 ASN HA H 196 4.638 5.144 -0.506 1 1 1567 . 17 1 1 A 196 196 ASN N N 196 119.196 117.622 1.574 1 1 1568 . 17 1 1 A 197 197 VAL H H 197 7.244 8.977 -1.733 1 1 1569 . 17 1 1 A 197 197 VAL HA H 197 4.540 4.610 -0.070 1 1 1577 . 17 1 1 A 197 197 VAL CA C 197 57.176 60.441 -3.265 1 1 1578 . 17 1 1 A 197 197 VAL N N 197 113.621 119.669 -6.048 1 1 1579 . 17 1 1 A 198 198 ASP H H 198 8.881 9.277 -0.396 1 1 1580 . 17 1 1 A 198 198 ASP HA H 198 4.894 4.503 0.391 1 1 1581 . 17 1 1 A 198 198 ASP N N 198 118.852 126.682 -7.830 1 1 1582 . 17 1 1 A 199 199 LEU H H 199 8.498 8.090 0.408 1 1 1583 . 17 1 1 A 199 199 LEU HA H 199 4.317 4.317 0.000 1 1 1591 . 17 1 1 A 199 199 LEU N N 199 124.078 126.443 -2.365 1 1 1592 . 17 1 1 A 200 200 ALA H H 200 8.386 8.302 0.084 1 1 1593 . 17 1 1 A 200 200 ALA HA H 200 4.295 5.169 -0.874 1 1 1597 . 17 1 1 A 200 200 ALA CA C 200 50.044 50.791 -0.747 1 1 1598 . 17 1 1 A 200 200 ALA CB C 200 17.985 21.950 -3.965 1 1 1599 . 17 1 1 A 200 200 ALA N N 200 127.315 126.003 1.312 1 1 1600 . 17 1 1 A 201 201 VAL H H 201 8.007 8.983 -0.976 1 1 1601 . 17 1 1 A 201 201 VAL HA H 201 4.577 4.821 -0.244 1 1 1609 . 17 1 1 A 201 201 VAL CA C 201 60.004 60.406 -0.402 1 1 1610 . 17 1 1 A 201 201 VAL CB C 201 28.863 36.086 -7.223 1 1 1611 . 17 1 1 A 201 201 VAL N N 201 119.409 121.948 -2.539 1 1 1612 . 17 1 1 A 202 202 ALA H H 202 8.789 9.015 -0.226 1 1 1613 . 17 1 1 A 202 202 ALA HA H 202 4.630 5.377 -0.747 1 1 1617 . 17 1 1 A 202 202 ALA CA C 202 48.200 50.024 -1.824 1 1 1618 . 17 1 1 A 202 202 ALA N N 202 131.745 126.989 4.756 1 1 1619 . 17 1 1 A 203 203 TYR H H 203 8.522 9.030 -0.508 1 1 1620 . 17 1 1 A 203 203 TYR HA H 203 5.391 5.433 -0.042 1 1 1627 . 17 1 1 A 203 203 TYR CA C 203 54.648 58.959 -4.311 1 1 1628 . 17 1 1 A 203 203 TYR CB C 203 37.315 39.664 -2.349 1 1 1629 . 17 1 1 A 203 203 TYR N N 203 117.786 124.720 -6.934 1 1 1630 . 17 1 1 A 204 204 ILE H H 204 8.209 7.523 0.686 1 1 1631 . 17 1 1 A 204 204 ILE HA H 204 4.393 4.332 0.061 1 1 1641 . 17 1 1 A 204 204 ILE CB C 204 36.807 41.480 -4.673 1 1 1644 . 17 1 1 A 204 204 ILE N N 204 120.602 126.331 -5.729 1 1 1645 . 17 1 1 A 205 205 LYS H H 205 9.340 8.513 0.827 1 1 1646 . 17 1 1 A 205 205 LYS HA H 205 4.756 4.814 -0.058 1 1 1651 . 17 1 1 A 205 205 LYS CA C 205 50.844 60.706 -9.862 1 1 1652 . 17 1 1 A 205 205 LYS N N 205 127.960 128.032 -0.072 1 1 1653 . 17 1 1 A 207 207 ASP H H 207 8.436 8.315 0.121 1 1 1654 . 17 1 1 A 207 207 ASP HA H 207 4.692 4.549 0.143 1 1 1657 . 17 1 1 A 207 207 ASP CA C 207 48.789 52.728 -3.939 1 1 1658 . 17 1 1 A 207 207 ASP CB C 207 38.377 42.414 -4.037 1 1 1659 . 17 1 1 A 207 207 ASP N N 207 123.098 123.992 -0.894 1 1 1660 . 17 1 1 A 208 208 GLU H H 208 8.880 8.652 0.228 1 1 1661 . 17 1 1 A 208 208 GLU HA H 208 3.994 3.999 -0.005 1 1 1666 . 17 1 1 A 208 208 GLU CA C 208 56.123 59.192 -3.069 1 1 1667 . 17 1 1 A 208 208 GLU CB C 208 25.794 29.625 -3.831 1 1 1669 . 17 1 1 A 208 208 GLU N N 208 119.042 121.661 -2.619 1 1 1670 . 17 1 1 A 209 209 LYS H H 209 7.681 7.567 0.114 1 1 1671 . 17 1 1 A 209 209 LYS HA H 209 4.141 4.158 -0.017 1 1 1680 . 17 1 1 A 209 209 LYS N N 209 119.252 116.036 3.216 1 1 1681 . 17 1 1 A 210 210 HIS H H 210 8.177 6.758 1.419 1 1 1682 . 17 1 1 A 210 210 HIS HA H 210 3.825 4.694 -0.869 1 1 1687 . 17 1 1 A 210 210 HIS CA C 210 54.205 55.004 -0.799 1 1 1688 . 17 1 1 A 210 210 HIS CB C 210 23.439 31.584 -8.145 1 1 1689 . 17 1 1 A 210 210 HIS N N 210 112.758 111.826 0.932 1 1 1690 . 17 1 1 A 211 211 HIS H H 211 8.758 6.965 1.793 1 1 1691 . 17 1 1 A 211 211 HIS HA H 211 5.041 5.371 -0.330 1 1 1695 . 17 1 1 A 211 211 HIS CA C 211 50.450 56.420 -5.970 1 1 1696 . 17 1 1 A 211 211 HIS CB C 211 25.703 30.475 -4.772 1 1 1697 . 17 1 1 A 211 211 HIS N N 211 119.552 119.747 -0.195 1 1 1698 . 17 1 1 A 212 212 ALA H H 212 8.556 8.394 0.162 1 1 1699 . 17 1 1 A 212 212 ALA HA H 212 4.712 4.910 -0.198 1 1 1703 . 17 1 1 A 212 212 ALA CA C 212 49.886 50.084 -0.198 1 1 1704 . 17 1 1 A 212 212 ALA CB C 212 18.860 20.634 -1.774 1 1 1705 . 17 1 1 A 212 212 ALA N N 212 123.780 122.700 1.080 1 1 1706 . 17 1 1 A 213 213 VAL H H 213 9.338 7.909 1.429 1 1 1707 . 17 1 1 A 213 213 VAL HA H 213 5.074 4.856 0.218 1 1 1715 . 17 1 1 A 213 213 VAL CA C 213 57.486 60.066 -2.580 1 1 1716 . 17 1 1 A 213 213 VAL CB C 213 33.938 35.473 -1.535 1 1 1717 . 17 1 1 A 213 213 VAL N N 213 124.742 119.756 4.986 1 1 1718 . 17 1 1 A 214 214 ILE H H 214 8.962 8.713 0.249 1 1 1719 . 17 1 1 A 214 214 ILE HA H 214 4.434 4.896 -0.462 1 1 1726 . 17 1 1 A 214 214 ILE N N 214 122.881 125.786 -2.905 1 1 1727 . 17 1 1 A 215 215 SER H H 215 8.558 8.642 -0.084 1 1 1728 . 17 1 1 A 215 215 SER HA H 215 5.001 5.553 -0.552 1 1 1731 . 17 1 1 A 215 215 SER CA C 215 53.230 56.529 -3.299 1 1 1732 . 17 1 1 A 215 215 SER CB C 215 62.077 65.757 -3.680 1 1 1733 . 17 1 1 A 215 215 SER N N 215 122.891 121.623 1.268 1 1 1734 . 17 1 1 A 216 216 GLY H H 216 7.282 9.160 -1.878 1 1 1735 . 17 1 1 A 216 216 GLY HA2 H 216 4.515 4.400 0.115 1 1 1736 . 17 1 1 A 216 216 GLY HA3 H 216 3.473 4.435 -0.962 1 1 1737 . 17 1 1 A 216 216 GLY CA C 216 42.816 46.117 -3.301 1 1 1738 . 17 1 1 A 216 216 GLY N N 216 110.899 113.340 -2.441 1 1 1739 . 17 1 1 A 217 217 SER H H 217 8.673 8.829 -0.156 1 1 1740 . 17 1 1 A 217 217 SER HA H 217 5.127 5.257 -0.130 1 1 1743 . 17 1 1 A 217 217 SER CA C 217 56.266 57.674 -1.408 1 1 1744 . 17 1 1 A 217 217 SER N N 217 117.164 116.341 0.823 1 1 1745 . 17 1 1 A 218 218 VAL H H 218 7.451 8.984 -1.533 1 1 1746 . 17 1 1 A 218 218 VAL HA H 218 5.128 4.623 0.505 1 1 1754 . 17 1 1 A 218 218 VAL CA C 218 56.637 61.769 -5.132 1 1 1755 . 17 1 1 A 218 218 VAL N N 218 117.826 125.874 -8.048 1 1 1756 . 17 1 1 A 219 219 LEU H H 219 9.022 8.545 0.477 1 1 1757 . 17 1 1 A 219 219 LEU HA H 219 5.387 5.004 0.383 1 1 1767 . 17 1 1 A 219 219 LEU CA C 219 50.450 54.096 -3.646 1 1 1768 . 17 1 1 A 219 219 LEU N N 219 124.820 126.821 -2.001 1 1 1769 . 17 1 1 A 220 220 TYR H H 220 8.816 9.139 -0.323 1 1 1770 . 17 1 1 A 220 220 TYR HA H 220 4.834 4.921 -0.087 1 1 1777 . 17 1 1 A 220 220 TYR N N 220 121.249 126.906 -5.657 1 1 1778 . 17 1 1 A 221 221 ASN H H 221 9.191 8.862 0.329 1 1 1779 . 17 1 1 A 221 221 ASN HA H 221 4.048 4.428 -0.380 1 1 1784 . 17 1 1 A 221 221 ASN CA C 221 51.647 55.131 -3.484 1 1 1785 . 17 1 1 A 221 221 ASN CB C 221 36.640 38.252 -1.612 1 1 1786 . 17 1 1 A 221 221 ASN N N 221 129.865 124.337 5.528 1 1 1788 . 17 1 1 A 222 222 GLN H H 222 8.468 6.474 1.994 1 1 1789 . 17 1 1 A 222 222 GLN HA H 222 3.671 3.889 -0.218 1 1 1794 . 17 1 1 A 222 222 GLN CA C 222 55.075 57.586 -2.511 1 1 1795 . 17 1 1 A 222 222 GLN CB C 222 24.663 29.253 -4.590 1 1 1797 . 17 1 1 A 222 222 GLN N N 222 108.367 117.742 -9.375 1 1 1798 . 17 1 1 A 223 223 ASP H H 223 7.797 7.812 -0.015 1 1 1799 . 17 1 1 A 223 223 ASP HA H 223 4.986 4.776 0.210 1 1 1802 . 17 1 1 A 223 223 ASP N N 223 120.842 118.378 2.464 1 1 1803 . 17 1 1 A 224 224 GLU H H 224 8.731 7.917 0.814 1 1 1804 . 17 1 1 A 224 224 GLU HA H 224 4.690 4.700 -0.010 1 1 1809 . 17 1 1 A 224 224 GLU CA C 224 54.703 56.383 -1.680 1 1 1810 . 17 1 1 A 224 224 GLU CB C 224 26.357 31.509 -5.152 1 1 1812 . 17 1 1 A 224 224 GLU N N 224 124.249 120.652 3.597 1 1 1813 . 17 1 1 A 225 225 LYS H H 225 8.730 8.358 0.372 1 1 1814 . 17 1 1 A 225 225 LYS HA H 225 4.754 4.868 -0.114 1 1 1822 . 17 1 1 A 225 225 LYS N N 225 126.784 123.450 3.334 1 1 1823 . 17 1 1 A 226 226 GLY H H 226 7.683 8.612 -0.929 1 1 1824 . 17 1 1 A 226 226 GLY HA2 H 226 5.567 4.159 1.408 1 1 1825 . 17 1 1 A 226 226 GLY HA3 H 226 3.819 4.190 -0.371 1 1 1826 . 17 1 1 A 226 226 GLY CA C 226 42.264 44.205 -1.941 1 1 1827 . 17 1 1 A 226 226 GLY N N 226 107.140 111.408 -4.268 1 1 1828 . 17 1 1 A 227 227 SER H H 227 8.672 10.077 -1.405 1 1 1829 . 17 1 1 A 227 227 SER HA H 227 5.564 5.349 0.215 1 1 1832 . 17 1 1 A 227 227 SER CA C 227 54.373 56.528 -2.155 1 1 1833 . 17 1 1 A 227 227 SER CB C 227 63.963 66.824 -2.861 1 1 1834 . 17 1 1 A 227 227 SER N N 227 117.767 114.980 2.787 1 1 1835 . 17 1 1 A 228 228 TYR H H 228 9.073 8.826 0.247 1 1 1836 . 17 1 1 A 228 228 TYR HA H 228 5.519 5.205 0.314 1 1 1843 . 17 1 1 A 228 228 TYR N N 228 118.324 124.075 -5.751 1 1 1844 . 17 1 1 A 229 229 SER H H 229 8.929 8.151 0.778 1 1 1845 . 17 1 1 A 229 229 SER HA H 229 5.209 5.311 -0.102 1 1 1848 . 17 1 1 A 229 229 SER CA C 229 54.131 57.485 -3.354 1 1 1849 . 17 1 1 A 229 229 SER N N 229 116.118 123.390 -7.272 1 1 1850 . 17 1 1 A 230 230 LEU H H 230 9.372 9.512 -0.140 1 1 1851 . 17 1 1 A 230 230 LEU HA H 230 4.803 4.869 -0.066 1 1 1863 . 17 1 1 A 230 230 LEU N N 230 124.803 125.281 -0.478 1 1 1864 . 17 1 1 A 231 231 GLY H H 231 9.080 8.227 0.853 1 1 1865 . 17 1 1 A 231 231 GLY HA2 H 231 4.776 4.100 0.676 1 1 1866 . 17 1 1 A 231 231 GLY HA3 H 231 3.528 4.202 -0.674 1 1 1867 . 17 1 1 A 231 231 GLY CA C 231 41.468 44.396 -2.928 1 1 1868 . 17 1 1 A 231 231 GLY N N 231 109.611 108.480 1.131 1 1 1869 . 17 1 1 A 232 232 ILE H H 232 6.849 8.728 -1.879 1 1 1870 . 17 1 1 A 232 232 ILE HA H 232 4.742 4.192 0.550 1 1 1878 . 17 1 1 A 232 232 ILE N N 232 120.566 124.052 -3.486 1 1 1879 . 17 1 1 A 233 233 PHE H H 233 9.569 8.977 0.592 1 1 1880 . 17 1 1 A 233 233 PHE HA H 233 4.979 6.067 -1.088 1 1 1885 . 17 1 1 A 233 233 PHE N N 233 129.256 128.190 1.066 1 1 1886 . 17 1 1 A 234 234 GLY H H 234 8.734 8.244 0.490 1 1 1887 . 17 1 1 A 234 234 GLY HA2 H 234 4.488 4.316 0.172 1 1 1888 . 17 1 1 A 234 234 GLY HA3 H 234 3.327 4.356 -1.029 1 1 1889 . 17 1 1 A 234 234 GLY CA C 234 40.377 45.968 -5.591 1 1 1890 . 17 1 1 A 234 234 GLY N N 234 105.294 108.869 -3.575 1 1 1891 . 17 1 1 A 235 235 GLU H H 235 9.198 8.120 1.078 1 1 1892 . 17 1 1 A 235 235 GLU HA H 235 4.111 3.730 0.381 1 1 1897 . 17 1 1 A 235 235 GLU CA C 235 56.466 58.424 -1.958 1 1 1898 . 17 1 1 A 235 235 GLU CB C 235 26.256 28.140 -1.884 1 1 1900 . 17 1 1 A 235 235 GLU N N 235 125.813 120.556 5.257 1 1 1901 . 17 1 1 A 236 236 LYS H H 236 8.147 7.621 0.526 1 1 1902 . 17 1 1 A 236 236 LYS HA H 236 4.373 4.867 -0.494 1 1 1905 . 17 1 1 A 236 236 LYS N N 236 117.810 118.831 -1.021 1 1 1906 . 17 1 1 A 237 237 ALA H H 237 7.685 7.656 0.029 1 1 1907 . 17 1 1 A 237 237 ALA HA H 237 3.902 4.479 -0.577 1 1 1911 . 17 1 1 A 237 237 ALA CA C 237 49.762 50.992 -1.230 1 1 1912 . 17 1 1 A 237 237 ALA CB C 237 14.720 20.018 -5.298 1 1 1913 . 17 1 1 A 237 237 ALA N N 237 118.704 119.956 -1.252 1 1 1914 . 17 1 1 A 238 238 GLN H H 238 9.312 8.394 0.918 1 1 1915 . 17 1 1 A 238 238 GLN HA H 238 4.049 5.779 -1.730 1 1 1920 . 17 1 1 A 238 238 GLN N N 238 118.059 117.373 0.686 1 1 1921 . 17 1 1 A 239 239 GLU H H 239 8.785 8.474 0.311 1 1 1922 . 17 1 1 A 239 239 GLU HA H 239 5.531 5.333 0.198 1 1 1927 . 17 1 1 A 239 239 GLU N N 239 116.914 121.732 -4.818 1 1 1928 . 17 1 1 A 240 240 VAL H H 240 8.501 8.743 -0.242 1 1 1929 . 17 1 1 A 240 240 VAL HA H 240 5.655 4.120 1.535 1 1 1937 . 17 1 1 A 240 240 VAL CA C 240 55.582 60.547 -4.965 1 1 1940 . 17 1 1 A 240 240 VAL N N 240 110.588 120.573 -9.985 1 1 1941 . 17 1 1 A 241 241 ALA H H 241 8.463 8.174 0.289 1 1 1942 . 17 1 1 A 241 241 ALA HA H 241 5.014 5.115 -0.101 1 1 1946 . 17 1 1 A 241 241 ALA CA C 241 49.361 51.096 -1.735 1 1 1947 . 17 1 1 A 241 241 ALA CB C 241 18.196 23.919 -5.723 1 1 1948 . 17 1 1 A 241 241 ALA N N 241 121.125 128.825 -7.700 1 1 1949 . 17 1 1 A 242 242 GLY H H 242 9.421 8.648 0.773 1 1 1950 . 17 1 1 A 242 242 GLY HA2 H 242 5.161 4.160 1.001 1 1 1951 . 17 1 1 A 242 242 GLY HA3 H 242 4.076 4.264 -0.188 1 1 1952 . 17 1 1 A 242 242 GLY N N 242 112.036 105.869 6.167 1 1 1953 . 17 1 1 A 243 243 SER H H 243 8.929 8.175 0.754 1 1 1954 . 17 1 1 A 243 243 SER HA H 243 5.331 5.510 -0.179 1 1 1957 . 17 1 1 A 243 243 SER N N 243 116.113 115.370 0.743 1 1 1958 . 17 1 1 A 244 244 ALA H H 244 9.218 8.997 0.221 1 1 1959 . 17 1 1 A 244 244 ALA HA H 244 5.221 4.906 0.315 1 1 1963 . 17 1 1 A 244 244 ALA CA C 244 47.883 50.372 -2.489 1 1 1964 . 17 1 1 A 244 244 ALA N N 244 120.635 126.262 -5.627 1 1 1965 . 17 1 1 A 245 245 GLU H H 245 9.194 8.581 0.613 1 1 1966 . 17 1 1 A 245 245 GLU HA H 245 4.869 5.227 -0.358 1 1 1971 . 17 1 1 A 245 245 GLU N N 245 123.487 118.785 4.702 1 1 1972 . 17 1 1 A 246 246 VAL H H 246 8.531 9.475 -0.944 1 1 1973 . 17 1 1 A 246 246 VAL HA H 246 4.518 4.561 -0.043 1 1 1981 . 17 1 1 A 246 246 VAL CA C 246 58.286 61.772 -3.486 1 1 1982 . 17 1 1 A 246 246 VAL N N 246 123.347 123.426 -0.079 1 1 1983 . 17 1 1 A 247 247 GLU H H 247 9.132 8.560 0.572 1 1 1984 . 17 1 1 A 247 247 GLU HA H 247 4.368 4.673 -0.305 1 1 1989 . 17 1 1 A 247 247 GLU CB C 247 26.744 31.771 -5.027 1 1 1990 . 17 1 1 A 247 247 GLU N N 247 129.243 127.942 1.301 1 1 1991 . 17 1 1 A 248 248 THR H H 248 7.827 7.967 -0.140 1 1 1992 . 17 1 1 A 248 248 THR HA H 248 4.749 4.416 0.333 1 1 1997 . 17 1 1 A 248 248 THR CA C 248 56.859 62.694 -5.835 1 1 1998 . 17 1 1 A 248 248 THR CB C 248 69.171 69.092 0.079 1 1 2000 . 17 1 1 A 248 248 THR N N 248 114.228 120.899 -6.671 1 1 2001 . 17 1 1 A 249 249 ALA H H 249 9.148 8.038 1.110 1 1 2002 . 17 1 1 A 249 249 ALA HA H 249 4.174 4.455 -0.281 1 1 2006 . 17 1 1 A 249 249 ALA CA C 249 51.970 51.891 0.079 1 1 2007 . 17 1 1 A 249 249 ALA CB C 249 15.797 20.519 -4.722 1 1 2008 . 17 1 1 A 249 249 ALA N N 249 123.341 125.650 -2.309 1 1 2009 . 17 1 1 A 250 250 ASN H H 250 7.974 7.712 0.262 1 1 2010 . 17 1 1 A 250 250 ASN HA H 250 4.953 4.923 0.030 1 1 2015 . 17 1 1 A 250 250 ASN CA C 250 49.198 52.566 -3.368 1 1 2016 . 17 1 1 A 250 250 ASN CB C 250 35.976 39.897 -3.921 1 1 2017 . 17 1 1 A 250 250 ASN N N 250 113.358 116.158 -2.800 1 1 2019 . 17 1 1 A 251 251 GLY H H 251 7.510 7.541 -0.031 1 1 2020 . 17 1 1 A 251 251 GLY HA2 H 251 4.492 4.162 0.330 1 1 2021 . 17 1 1 A 251 251 GLY HA3 H 251 3.853 4.301 -0.448 1 1 2022 . 17 1 1 A 251 251 GLY CA C 251 41.435 45.432 -3.997 1 1 2023 . 17 1 1 A 251 251 GLY N N 251 108.692 107.054 1.638 1 1 2024 . 17 1 1 A 252 252 ILE H H 252 8.465 8.811 -0.346 1 1 2025 . 17 1 1 A 252 252 ILE HA H 252 4.521 4.253 0.268 1 1 2035 . 17 1 1 A 252 252 ILE CB C 252 35.653 37.985 -2.332 1 1 2039 . 17 1 1 A 252 252 ILE N N 252 122.043 126.411 -4.368 1 1 2040 . 17 1 1 A 253 253 HIS H H 253 9.311 9.800 -0.489 1 1 2041 . 17 1 1 A 253 253 HIS HA H 253 4.861 4.810 0.051 1 1 2046 . 17 1 1 A 253 253 HIS N N 253 126.617 125.937 0.680 1 1 2047 . 17 1 1 A 254 254 HIS H H 254 8.820 8.146 0.674 1 1 2048 . 17 1 1 A 254 254 HIS HA H 254 5.305 5.675 -0.370 1 1 2051 . 17 1 1 A 254 254 HIS CA C 254 52.781 53.502 -0.721 1 1 2052 . 17 1 1 A 254 254 HIS N N 254 122.665 116.408 6.257 1 1 2053 . 17 1 1 A 255 255 ILE H H 255 9.047 9.059 -0.012 1 1 2054 . 17 1 1 A 255 255 ILE HA H 255 4.651 4.636 0.015 1 1 2061 . 17 1 1 A 255 255 ILE N N 255 123.958 121.245 2.713 1 1 2062 . 17 1 1 A 256 256 GLY H H 256 9.339 8.230 1.109 1 1 2063 . 17 1 1 A 256 256 GLY HA2 H 256 3.816 3.999 -0.183 1 1 2064 . 17 1 1 A 256 256 GLY HA3 H 256 2.267 4.190 -1.923 1 1 2065 . 17 1 1 A 256 256 GLY N N 256 115.022 114.652 0.370 1 1 2066 . 17 1 1 A 257 257 LEU H H 257 7.890 9.562 -1.672 1 1 2067 . 17 1 1 A 257 257 LEU HA H 257 4.853 5.235 -0.382 1 1 2077 . 17 1 1 A 257 257 LEU N N 257 121.441 125.027 -3.586 1 1 2078 . 17 1 1 A 258 258 ALA H H 258 7.982 8.901 -0.919 1 1 2079 . 17 1 1 A 258 258 ALA HA H 258 4.668 4.929 -0.261 1 1 2083 . 17 1 1 A 258 258 ALA CA C 258 49.678 51.473 -1.795 1 1 2084 . 17 1 1 A 258 258 ALA CB C 258 19.561 21.506 -1.945 1 1 2085 . 17 1 1 A 258 258 ALA N N 258 123.234 122.706 0.528 1 1 2086 . 17 1 1 A 259 259 ALA H H 259 9.117 8.759 0.358 1 1 2087 . 17 1 1 A 259 259 ALA HA H 259 4.790 5.162 -0.372 1 1 2091 . 17 1 1 A 259 259 ALA N N 259 123.901 123.285 0.616 1 1 2092 . 17 1 1 A 260 260 LYS H H 260 8.452 9.076 -0.624 1 1 2093 . 17 1 1 A 260 260 LYS HA H 260 5.914 5.066 0.848 1 1 2098 . 17 1 1 A 260 260 LYS CA C 260 51.818 54.280 -2.462 1 1 2099 . 17 1 1 A 260 260 LYS N N 260 116.464 116.863 -0.399 1 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Assigned_chem_shift_list_ID _SPARTA_output.Conformer_ID _SPARTA_output.Entity_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Entity_delta_chem_shifts_ID 1 1 1 1 "RMS(OBS, PRED)" C 0 0.000 1 2 1 1 1 "RMS(OBS, PRED)" CA 157 3.138 1 3 1 1 1 "RMS(OBS, PRED)" CB 116 3.800 1 4 1 1 1 "RMS(OBS, PRED)" H 243 0.839 1 5 1 1 1 "RMS(OBS, PRED)" HA 266 0.496 1 6 1 1 1 "RMS(OBS, PRED)" N 243 4.157 1 7 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1 8 1 2 1 "RMS(OBS, PRED)" CA 157 3.181 1 9 1 2 1 "RMS(OBS, PRED)" CB 116 3.446 1 10 1 2 1 "RMS(OBS, PRED)" H 243 0.857 1 11 1 2 1 "RMS(OBS, PRED)" HA 266 0.502 1 12 1 2 1 "RMS(OBS, PRED)" N 243 4.131 1 13 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1 14 1 3 1 "RMS(OBS, PRED)" CA 157 3.233 1 15 1 3 1 "RMS(OBS, PRED)" CB 116 3.712 1 16 1 3 1 "RMS(OBS, PRED)" H 243 0.823 1 17 1 3 1 "RMS(OBS, PRED)" HA 266 0.508 1 18 1 3 1 "RMS(OBS, PRED)" N 243 4.163 1 19 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1 20 1 4 1 "RMS(OBS, PRED)" CA 157 3.101 1 21 1 4 1 "RMS(OBS, PRED)" CB 116 3.576 1 22 1 4 1 "RMS(OBS, PRED)" H 243 0.843 1 23 1 4 1 "RMS(OBS, PRED)" HA 266 0.576 1 24 1 4 1 "RMS(OBS, PRED)" N 243 4.315 1 25 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1 26 1 5 1 "RMS(OBS, PRED)" CA 157 3.175 1 27 1 5 1 "RMS(OBS, PRED)" CB 116 3.667 1 28 1 5 1 "RMS(OBS, PRED)" H 243 0.854 1 29 1 5 1 "RMS(OBS, PRED)" HA 266 0.501 1 30 1 5 1 "RMS(OBS, PRED)" N 243 4.130 1 31 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1 32 1 6 1 "RMS(OBS, PRED)" CA 157 3.123 1 33 1 6 1 "RMS(OBS, PRED)" CB 116 3.643 1 34 1 6 1 "RMS(OBS, PRED)" H 243 0.826 1 35 1 6 1 "RMS(OBS, PRED)" HA 266 0.506 1 36 1 6 1 "RMS(OBS, PRED)" N 243 4.400 1 37 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1 38 1 7 1 "RMS(OBS, PRED)" CA 157 3.148 1 39 1 7 1 "RMS(OBS, PRED)" CB 116 3.500 1 40 1 7 1 "RMS(OBS, PRED)" H 243 0.832 1 41 1 7 1 "RMS(OBS, PRED)" HA 266 0.548 1 42 1 7 1 "RMS(OBS, PRED)" N 243 4.111 1 43 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1 44 1 8 1 "RMS(OBS, PRED)" CA 157 3.226 1 45 1 8 1 "RMS(OBS, PRED)" CB 116 3.745 1 46 1 8 1 "RMS(OBS, PRED)" H 243 0.842 1 47 1 8 1 "RMS(OBS, PRED)" HA 266 0.510 1 48 1 8 1 "RMS(OBS, PRED)" N 243 4.098 1 49 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1 50 1 9 1 "RMS(OBS, PRED)" CA 157 3.259 1 51 1 9 1 "RMS(OBS, PRED)" CB 116 3.553 1 52 1 9 1 "RMS(OBS, PRED)" H 243 0.795 1 53 1 9 1 "RMS(OBS, PRED)" HA 266 0.489 1 54 1 9 1 "RMS(OBS, PRED)" N 243 4.104 1 55 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1 56 1 10 1 "RMS(OBS, PRED)" CA 157 3.134 1 57 1 10 1 "RMS(OBS, PRED)" CB 116 3.461 1 58 1 10 1 "RMS(OBS, PRED)" H 243 0.824 1 59 1 10 1 "RMS(OBS, PRED)" HA 266 0.552 1 60 1 10 1 "RMS(OBS, PRED)" N 243 4.128 1 61 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1 62 1 11 1 "RMS(OBS, PRED)" CA 157 3.180 1 63 1 11 1 "RMS(OBS, PRED)" CB 116 3.498 1 64 1 11 1 "RMS(OBS, PRED)" H 243 0.879 1 65 1 11 1 "RMS(OBS, PRED)" HA 266 0.508 1 66 1 11 1 "RMS(OBS, PRED)" N 243 4.216 1 67 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1 68 1 12 1 "RMS(OBS, PRED)" CA 157 3.168 1 69 1 12 1 "RMS(OBS, PRED)" CB 116 3.666 1 70 1 12 1 "RMS(OBS, PRED)" H 243 0.881 1 71 1 12 1 "RMS(OBS, PRED)" HA 266 0.532 1 72 1 12 1 "RMS(OBS, PRED)" N 243 4.272 1 73 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1 74 1 13 1 "RMS(OBS, PRED)" CA 157 3.173 1 75 1 13 1 "RMS(OBS, PRED)" CB 116 3.576 1 76 1 13 1 "RMS(OBS, PRED)" H 243 0.832 1 77 1 13 1 "RMS(OBS, PRED)" HA 266 0.504 1 78 1 13 1 "RMS(OBS, PRED)" N 243 4.142 1 79 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1 80 1 14 1 "RMS(OBS, PRED)" CA 157 3.168 1 81 1 14 1 "RMS(OBS, PRED)" CB 116 3.452 1 82 1 14 1 "RMS(OBS, PRED)" H 243 0.849 1 83 1 14 1 "RMS(OBS, PRED)" HA 266 0.485 1 84 1 14 1 "RMS(OBS, PRED)" N 243 4.164 1 85 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1 86 1 15 1 "RMS(OBS, PRED)" CA 157 3.011 1 87 1 15 1 "RMS(OBS, PRED)" CB 116 3.532 1 88 1 15 1 "RMS(OBS, PRED)" H 243 0.865 1 89 1 15 1 "RMS(OBS, PRED)" HA 266 0.521 1 90 1 15 1 "RMS(OBS, PRED)" N 243 4.258 1 91 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1 92 1 16 1 "RMS(OBS, PRED)" CA 157 3.040 1 93 1 16 1 "RMS(OBS, PRED)" CB 116 3.656 1 94 1 16 1 "RMS(OBS, PRED)" H 243 0.839 1 95 1 16 1 "RMS(OBS, PRED)" HA 266 0.531 1 96 1 16 1 "RMS(OBS, PRED)" N 243 3.982 1 97 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1 98 1 17 1 "RMS(OBS, PRED)" CA 157 3.229 1 99 1 17 1 "RMS(OBS, PRED)" CB 116 3.558 1 100 1 17 1 "RMS(OBS, PRED)" H 243 0.832 1 101 1 17 1 "RMS(OBS, PRED)" HA 266 0.514 1 102 1 17 1 "RMS(OBS, PRED)" N 243 4.242 1 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Conformer_type "average" _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 1 . 1 1 A 9 9 SER H H 9 8.293 8.458 -0.165 2 1 2 . 1 1 A 9 9 SER HA H 9 4.432 4.946 -0.514 2 1 3 . 1 1 A 9 9 SER N N 9 116.407 116.707 -0.300 2 1 4 . 1 1 A 10 10 GLY H H 10 8.472 8.404 0.068 2 1 5 . 1 1 A 10 10 GLY N N 10 111.611 110.294 1.317 2 1 6 . 1 1 A 14 14 VAL H H 14 8.009 8.264 -0.255 2 1 7 . 1 1 A 14 14 VAL HA H 14 4.128 4.153 -0.025 2 1 15 . 1 1 A 14 14 VAL CA C 14 59.473 62.256 -2.783 2 1 16 . 1 1 A 14 14 VAL CB C 14 30.127 32.869 -2.742 2 1 17 . 1 1 A 14 14 VAL N N 14 119.846 120.439 -0.593 2 1 18 . 1 1 A 15 15 THR H H 15 8.152 8.525 -0.373 2 1 19 . 1 1 A 15 15 THR HA H 15 4.346 4.552 -0.206 2 1 24 . 1 1 A 15 15 THR N N 15 118.509 118.161 0.348 2 1 25 . 1 1 A 16 16 ALA H H 16 8.207 8.469 -0.262 2 1 26 . 1 1 A 16 16 ALA HA H 16 4.319 4.219 0.100 2 1 30 . 1 1 A 16 16 ALA CA C 16 49.835 53.306 -3.471 2 1 31 . 1 1 A 16 16 ALA CB C 16 16.714 18.914 -2.200 2 1 32 . 1 1 A 16 16 ALA N N 16 126.935 124.887 2.048 2 1 33 . 1 1 A 17 17 ASP H H 17 8.269 7.973 0.296 2 1 34 . 1 1 A 17 17 ASP HA H 17 4.581 4.956 -0.375 2 1 37 . 1 1 A 17 17 ASP CA C 17 51.643 53.174 -1.531 2 1 38 . 1 1 A 17 17 ASP CB C 17 38.257 41.286 -3.029 2 1 39 . 1 1 A 17 17 ASP N N 17 120.379 118.198 2.181 2 1 40 . 1 1 A 18 18 ILE H H 18 7.979 7.989 -0.010 2 1 41 . 1 1 A 18 18 ILE HA H 18 4.178 4.001 0.177 2 1 48 . 1 1 A 18 18 ILE CA C 18 58.737 63.820 -5.083 2 1 49 . 1 1 A 18 18 ILE CB C 18 36.077 38.108 -2.031 2 1 53 . 1 1 A 18 18 ILE N N 18 121.171 121.805 -0.634 2 1 54 . 1 1 A 19 19 GLY H H 19 8.410 8.150 0.260 2 1 55 . 1 1 A 19 19 GLY HA2 H 19 4.023 3.865 0.158 2 1 56 . 1 1 A 19 19 GLY HA3 H 19 4.023 3.869 0.154 2 1 57 . 1 1 A 19 19 GLY N N 19 112.246 108.549 3.697 2 1 58 . 1 1 A 20 20 THR H H 20 8.005 8.189 -0.184 2 1 59 . 1 1 A 20 20 THR HA H 20 4.463 4.097 0.366 2 1 64 . 1 1 A 20 20 THR CB C 20 66.723 68.504 -1.781 2 1 66 . 1 1 A 20 20 THR N N 20 112.239 115.700 -3.461 2 1 67 . 1 1 A 21 21 GLY H H 21 8.500 8.565 -0.065 2 1 68 . 1 1 A 21 21 GLY HA2 H 21 4.099 3.822 0.277 2 1 69 . 1 1 A 21 21 GLY HA3 H 21 3.872 3.824 0.048 2 1 70 . 1 1 A 21 21 GLY N N 21 111.048 112.031 -0.983 2 1 71 . 1 1 A 22 22 LEU H H 22 7.427 7.790 -0.363 2 1 72 . 1 1 A 22 22 LEU HA H 22 3.884 4.029 -0.145 2 1 84 . 1 1 A 22 22 LEU N N 22 118.837 120.799 -1.962 2 1 85 . 1 1 A 23 23 ALA H H 23 7.896 8.055 -0.159 2 1 86 . 1 1 A 23 23 ALA HA H 23 4.023 4.130 -0.107 2 1 90 . 1 1 A 23 23 ALA CA C 23 52.584 54.149 -1.565 2 1 91 . 1 1 A 23 23 ALA CB C 23 15.470 18.400 -2.930 2 1 92 . 1 1 A 23 23 ALA N N 23 119.194 121.382 -2.188 2 1 93 . 1 1 A 24 24 ASP H H 24 8.265 7.944 0.321 2 1 94 . 1 1 A 24 24 ASP HA H 24 4.337 4.600 -0.263 2 1 97 . 1 1 A 24 24 ASP CB C 24 37.029 41.227 -4.198 2 1 98 . 1 1 A 24 24 ASP N N 24 119.035 116.717 2.318 2 1 99 . 1 1 A 25 25 ALA H H 25 8.211 8.440 -0.229 2 1 100 . 1 1 A 25 25 ALA HA H 25 4.064 4.352 -0.288 2 1 104 . 1 1 A 25 25 ALA CA C 25 53.278 53.853 -0.575 2 1 105 . 1 1 A 25 25 ALA CB C 25 15.760 18.652 -2.892 2 1 106 . 1 1 A 25 25 ALA N N 25 122.434 121.293 1.141 2 1 107 . 1 1 A 26 26 LEU H H 26 7.334 7.444 -0.110 2 1 108 . 1 1 A 26 26 LEU HA H 26 4.351 4.282 0.069 2 1 117 . 1 1 A 26 26 LEU N N 26 114.238 115.958 -1.720 2 1 118 . 1 1 A 27 27 THR H H 27 7.708 7.520 0.188 2 1 119 . 1 1 A 27 27 THR HA H 27 4.492 4.439 0.053 2 1 124 . 1 1 A 27 27 THR CA C 27 59.438 62.751 -3.313 2 1 125 . 1 1 A 27 27 THR CB C 27 68.796 69.427 -0.631 2 1 127 . 1 1 A 27 27 THR N N 27 106.430 110.344 -3.914 2 1 128 . 1 1 A 28 28 ALA H H 28 8.906 7.675 1.231 2 1 129 . 1 1 A 28 28 ALA HA H 28 4.812 4.578 0.234 2 1 133 . 1 1 A 28 28 ALA CB C 28 16.724 19.478 -2.754 2 1 134 . 1 1 A 28 28 ALA N N 28 128.420 124.294 4.126 2 1 135 . 1 1 A 29 29 PRO CA C 29 59.166 62.308 -3.142 2 1 136 . 1 1 A 29 29 PRO CB C 29 29.865 32.593 -2.728 2 1 139 . 1 1 A 30 30 LEU H H 30 8.204 8.257 -0.053 2 1 140 . 1 1 A 30 30 LEU HA H 30 4.052 4.245 -0.193 2 1 150 . 1 1 A 30 30 LEU N N 30 121.970 122.322 -0.352 2 1 151 . 1 1 A 31 31 ASP H H 31 8.720 8.685 0.035 2 1 152 . 1 1 A 31 31 ASP HA H 31 4.772 4.963 -0.191 2 1 155 . 1 1 A 31 31 ASP CA C 31 50.115 53.791 -3.676 2 1 156 . 1 1 A 31 31 ASP N N 31 125.105 123.484 1.621 2 1 157 . 1 1 A 32 32 HIS CA C 32 55.083 56.726 -1.643 2 1 158 . 1 1 A 32 32 HIS CB C 32 25.707 29.660 -3.953 2 1 159 . 1 1 A 33 33 LYS H H 33 8.589 8.110 0.479 2 1 160 . 1 1 A 33 33 LYS HA H 33 4.112 4.326 -0.214 2 1 167 . 1 1 A 33 33 LYS CB C 33 29.218 33.152 -3.934 2 1 169 . 1 1 A 33 33 LYS N N 33 118.920 118.550 0.370 2 1 170 . 1 1 A 34 34 ASP H H 34 7.420 7.585 -0.165 2 1 171 . 1 1 A 34 34 ASP HA H 34 4.368 4.758 -0.390 2 1 174 . 1 1 A 34 34 ASP N N 34 120.940 120.015 0.925 2 1 175 . 1 1 A 35 35 LYS H H 35 8.266 8.623 -0.357 2 1 176 . 1 1 A 35 35 LYS HA H 35 4.169 4.314 -0.145 2 1 183 . 1 1 A 35 35 LYS N N 35 121.280 121.717 -0.437 2 1 184 . 1 1 A 36 36 GLY H H 36 8.716 7.770 0.946 2 1 185 . 1 1 A 36 36 GLY HA2 H 36 3.822 4.014 -0.192 2 1 186 . 1 1 A 36 36 GLY HA3 H 36 3.618 4.019 -0.401 2 1 187 . 1 1 A 36 36 GLY N N 36 111.002 107.716 3.286 2 1 188 . 1 1 A 37 37 LEU H H 37 8.032 8.166 -0.134 2 1 189 . 1 1 A 37 37 LEU HA H 37 4.406 4.390 0.016 2 1 198 . 1 1 A 37 37 LEU N N 37 127.683 122.086 5.597 2 1 199 . 1 1 A 38 38 LYS H H 38 9.190 8.880 0.310 2 1 200 . 1 1 A 38 38 LYS HA H 38 3.925 4.371 -0.446 2 1 205 . 1 1 A 38 38 LYS N N 38 132.634 123.038 9.596 2 1 206 . 1 1 A 39 39 SER H H 39 7.161 7.657 -0.496 2 1 207 . 1 1 A 39 39 SER HA H 39 5.097 4.690 0.407 2 1 210 . 1 1 A 39 39 SER CA C 39 54.451 57.424 -2.973 2 1 211 . 1 1 A 39 39 SER N N 39 110.262 110.593 -0.331 2 1 212 . 1 1 A 40 40 LEU H H 40 8.142 9.412 -1.270 2 1 213 . 1 1 A 40 40 LEU HA H 40 4.481 4.863 -0.382 2 1 223 . 1 1 A 40 40 LEU N N 40 122.761 122.124 0.637 2 1 224 . 1 1 A 41 41 THR H H 41 8.641 8.780 -0.139 2 1 225 . 1 1 A 41 41 THR HA H 41 4.141 4.767 -0.626 2 1 230 . 1 1 A 41 41 THR CA C 41 60.301 61.961 -1.660 2 1 231 . 1 1 A 41 41 THR CB C 41 65.862 70.069 -4.207 2 1 233 . 1 1 A 41 41 THR N N 41 124.142 120.763 3.379 2 1 234 . 1 1 A 42 42 LEU H H 42 8.586 8.576 0.010 2 1 235 . 1 1 A 42 42 LEU HA H 42 4.337 4.664 -0.327 2 1 247 . 1 1 A 42 42 LEU N N 42 128.603 125.704 2.899 2 1 248 . 1 1 A 43 43 GLU H H 43 8.644 8.605 0.039 2 1 249 . 1 1 A 43 43 GLU HA H 43 4.663 4.261 0.402 2 1 253 . 1 1 A 43 43 GLU N N 43 124.180 122.753 1.427 2 1 254 . 1 1 A 44 44 ASP H H 44 10.243 8.466 1.777 2 1 255 . 1 1 A 44 44 ASP HA H 44 4.518 4.760 -0.242 2 1 258 . 1 1 A 44 44 ASP CA C 44 52.879 53.353 -0.474 2 1 259 . 1 1 A 44 44 ASP CB C 44 37.711 40.389 -2.678 2 1 260 . 1 1 A 44 44 ASP N N 44 124.177 119.793 4.384 2 1 261 . 1 1 A 45 45 SER H H 45 8.546 8.839 -0.293 2 1 262 . 1 1 A 45 45 SER HA H 45 3.850 4.142 -0.292 2 1 265 . 1 1 A 45 45 SER CA C 45 59.588 61.689 -2.101 2 1 266 . 1 1 A 45 45 SER CB C 45 61.660 62.994 -1.334 2 1 267 . 1 1 A 45 45 SER N N 45 116.191 116.443 -0.252 2 1 268 . 1 1 A 46 46 ILE H H 46 6.902 7.710 -0.808 2 1 269 . 1 1 A 46 46 ILE HA H 46 3.874 4.621 -0.747 2 1 279 . 1 1 A 46 46 ILE CA C 46 57.605 60.147 -2.542 2 1 280 . 1 1 A 46 46 ILE CB C 46 36.694 39.593 -2.899 2 1 283 . 1 1 A 46 46 ILE N N 46 116.189 119.816 -3.627 2 1 284 . 1 1 A 47 47 SER H H 47 7.804 8.508 -0.704 2 1 285 . 1 1 A 47 47 SER HA H 47 4.342 4.792 -0.450 2 1 288 . 1 1 A 47 47 SER CA C 47 55.995 57.174 -1.179 2 1 289 . 1 1 A 47 47 SER N N 47 118.738 118.010 0.728 2 1 290 . 1 1 A 48 48 GLN H H 48 8.522 8.704 -0.182 2 1 291 . 1 1 A 48 48 GLN HA H 48 3.939 4.103 -0.164 2 1 296 . 1 1 A 48 48 GLN CA C 48 55.111 58.094 -2.983 2 1 298 . 1 1 A 48 48 GLN N N 48 119.475 122.126 -2.651 2 1 299 . 1 1 A 49 49 ASN H H 49 8.437 8.215 0.222 2 1 300 . 1 1 A 49 49 ASN HA H 49 4.693 4.756 -0.063 2 1 305 . 1 1 A 49 49 ASN CA C 49 50.839 52.468 -1.629 2 1 306 . 1 1 A 49 49 ASN CB C 49 35.767 38.055 -2.288 2 1 307 . 1 1 A 49 49 ASN N N 49 117.233 114.885 2.348 2 1 309 . 1 1 A 50 50 GLY H H 50 7.952 7.763 0.189 2 1 310 . 1 1 A 50 50 GLY HA2 H 50 4.518 4.134 0.384 2 1 311 . 1 1 A 50 50 GLY HA3 H 50 4.054 4.141 -0.087 2 1 312 . 1 1 A 50 50 GLY CA C 50 41.883 45.659 -3.776 2 1 313 . 1 1 A 50 50 GLY N N 50 108.751 107.702 1.049 2 1 314 . 1 1 A 51 51 THR H H 51 8.548 8.400 0.148 2 1 315 . 1 1 A 51 51 THR HA H 51 5.012 5.335 -0.323 2 1 320 . 1 1 A 51 51 THR CA C 51 57.026 60.136 -3.110 2 1 321 . 1 1 A 51 51 THR CB C 51 69.887 70.867 -0.980 2 1 323 . 1 1 A 51 51 THR N N 51 108.710 115.444 -6.734 2 1 324 . 1 1 A 52 52 LEU H H 52 9.110 8.846 0.264 2 1 325 . 1 1 A 52 52 LEU HA H 52 5.183 5.357 -0.174 2 1 333 . 1 1 A 52 52 LEU CA C 52 50.822 53.850 -3.028 2 1 335 . 1 1 A 52 52 LEU N N 52 124.606 121.998 2.608 2 1 336 . 1 1 A 53 53 THR H H 53 9.312 8.685 0.627 2 1 337 . 1 1 A 53 53 THR HA H 53 5.288 5.125 0.163 2 1 342 . 1 1 A 53 53 THR CA C 53 59.535 61.356 -1.821 2 1 343 . 1 1 A 53 53 THR CB C 53 66.838 71.751 -4.913 2 1 345 . 1 1 A 53 53 THR N N 53 125.445 116.300 9.145 2 1 346 . 1 1 A 54 54 LEU H H 54 8.992 8.914 0.078 2 1 347 . 1 1 A 54 54 LEU HA H 54 5.563 5.655 -0.092 2 1 357 . 1 1 A 54 54 LEU N N 54 128.814 121.635 7.179 2 1 358 . 1 1 A 55 55 SER H H 55 9.017 9.175 -0.158 2 1 359 . 1 1 A 55 55 SER HA H 55 5.476 5.272 0.204 2 1 362 . 1 1 A 55 55 SER CA C 55 53.944 56.624 -2.680 2 1 363 . 1 1 A 55 55 SER CB C 55 63.384 65.343 -1.959 2 1 364 . 1 1 A 55 55 SER N N 55 112.964 118.591 -5.627 2 1 365 . 1 1 A 56 56 ALA H H 56 8.324 9.983 -1.659 2 1 366 . 1 1 A 56 56 ALA HA H 56 4.605 4.757 -0.152 2 1 370 . 1 1 A 56 56 ALA CA C 56 50.743 50.279 0.464 2 1 371 . 1 1 A 56 56 ALA CB C 56 21.372 21.207 0.165 2 1 372 . 1 1 A 56 56 ALA N N 56 123.555 127.281 -3.726 2 1 373 . 1 1 A 57 57 GLN H H 57 9.080 8.602 0.478 2 1 374 . 1 1 A 57 57 GLN HA H 57 3.884 4.482 -0.598 2 1 381 . 1 1 A 57 57 GLN CA C 57 53.331 55.770 -2.439 2 1 382 . 1 1 A 57 57 GLN CB C 57 24.659 27.597 -2.938 2 1 384 . 1 1 A 57 57 GLN N N 57 116.815 115.883 0.932 2 1 386 . 1 1 A 58 58 GLY H H 58 8.527 7.964 0.563 2 1 387 . 1 1 A 58 58 GLY HA2 H 58 4.168 4.049 0.119 2 1 388 . 1 1 A 58 58 GLY HA3 H 58 3.608 4.052 -0.444 2 1 389 . 1 1 A 58 58 GLY CA C 58 42.856 45.624 -2.768 2 1 390 . 1 1 A 58 58 GLY N N 58 105.983 107.346 -1.363 2 1 391 . 1 1 A 59 59 ALA H H 59 8.203 7.698 0.505 2 1 392 . 1 1 A 59 59 ALA HA H 59 4.811 4.600 0.211 2 1 396 . 1 1 A 59 59 ALA CA C 59 47.662 51.438 -3.776 2 1 397 . 1 1 A 59 59 ALA CB C 59 20.147 22.702 -2.555 2 1 398 . 1 1 A 59 59 ALA N N 59 125.153 121.327 3.826 2 1 399 . 1 1 A 60 60 GLU H H 60 8.154 8.916 -0.762 2 1 400 . 1 1 A 60 60 GLU HA H 60 5.508 5.546 -0.038 2 1 404 . 1 1 A 60 60 GLU CA C 60 52.179 54.227 -2.048 2 1 405 . 1 1 A 60 60 GLU CB C 60 30.203 34.312 -4.109 2 1 406 . 1 1 A 60 60 GLU N N 60 117.318 116.703 0.615 2 1 407 . 1 1 A 61 61 LYS H H 61 8.821 9.199 -0.378 2 1 408 . 1 1 A 61 61 LYS HA H 61 4.311 4.820 -0.509 2 1 413 . 1 1 A 61 61 LYS N N 61 123.743 120.661 3.082 2 1 414 . 1 1 A 62 62 THR H H 62 8.149 8.693 -0.544 2 1 415 . 1 1 A 62 62 THR HA H 62 4.928 4.617 0.311 2 1 420 . 1 1 A 62 62 THR CA C 62 59.427 62.556 -3.129 2 1 421 . 1 1 A 62 62 THR CB C 62 66.932 69.195 -2.263 2 1 422 . 1 1 A 62 62 THR N N 62 122.829 120.547 2.282 2 1 423 . 1 1 A 63 63 TYR H H 63 9.466 9.497 -0.031 2 1 424 . 1 1 A 63 63 TYR HA H 63 4.606 5.294 -0.688 2 1 431 . 1 1 A 63 63 TYR CA C 63 54.508 56.000 -1.492 2 1 432 . 1 1 A 63 63 TYR N N 63 127.472 127.905 -0.433 2 1 433 . 1 1 A 64 64 GLY H H 64 9.253 8.603 0.650 2 1 434 . 1 1 A 64 64 GLY HA2 H 64 4.670 4.192 0.478 2 1 435 . 1 1 A 64 64 GLY HA3 H 64 3.619 4.219 -0.600 2 1 436 . 1 1 A 64 64 GLY CA C 64 39.885 44.633 -4.748 2 1 437 . 1 1 A 64 64 GLY N N 64 110.182 111.224 -1.042 2 1 438 . 1 1 A 65 65 ASN H H 65 8.616 8.503 0.113 2 1 439 . 1 1 A 65 65 ASN HA H 65 4.109 4.485 -0.376 2 1 444 . 1 1 A 65 65 ASN CA C 65 53.691 54.840 -1.149 2 1 445 . 1 1 A 65 65 ASN N N 65 117.778 119.297 -1.519 2 1 447 . 1 1 A 66 66 GLY H H 66 9.053 8.877 0.176 2 1 448 . 1 1 A 66 66 GLY HA2 H 66 4.344 3.898 0.446 2 1 449 . 1 1 A 66 66 GLY HA3 H 66 3.359 3.907 -0.548 2 1 450 . 1 1 A 66 66 GLY CA C 66 42.431 44.905 -2.474 2 1 451 . 1 1 A 66 66 GLY N N 66 115.232 114.319 0.913 2 1 452 . 1 1 A 67 67 ASP H H 67 8.120 8.697 -0.577 2 1 453 . 1 1 A 67 67 ASP HA H 67 4.844 4.114 0.730 2 1 456 . 1 1 A 67 67 ASP N N 67 122.593 121.218 1.375 2 1 457 . 1 1 A 68 68 SER H H 68 8.500 8.176 0.324 2 1 458 . 1 1 A 68 68 SER HA H 68 5.088 5.057 0.031 2 1 461 . 1 1 A 68 68 SER CA C 68 54.858 56.758 -1.900 2 1 462 . 1 1 A 68 68 SER CB C 68 62.114 65.834 -3.720 2 1 463 . 1 1 A 68 68 SER N N 68 113.557 116.908 -3.351 2 1 464 . 1 1 A 69 69 LEU H H 69 8.989 9.405 -0.416 2 1 465 . 1 1 A 69 69 LEU HA H 69 4.570 5.279 -0.709 2 1 474 . 1 1 A 69 69 LEU N N 69 126.836 124.700 2.136 2 1 475 . 1 1 A 70 70 ASN H H 70 8.491 8.792 -0.301 2 1 476 . 1 1 A 70 70 ASN HA H 70 4.958 5.196 -0.238 2 1 479 . 1 1 A 70 70 ASN CB C 70 33.265 39.368 -6.103 2 1 480 . 1 1 A 70 70 ASN N N 70 126.343 123.471 2.872 2 1 481 . 1 1 A 71 71 THR H H 71 7.831 8.394 -0.563 2 1 482 . 1 1 A 71 71 THR HA H 71 3.759 4.716 -0.957 2 1 487 . 1 1 A 71 71 THR CA C 71 61.005 60.344 0.661 2 1 488 . 1 1 A 71 71 THR N N 71 114.742 114.225 0.517 2 1 489 . 1 1 A 72 72 GLY H H 72 8.880 8.306 0.574 2 1 490 . 1 1 A 72 72 GLY HA2 H 72 3.907 3.893 0.014 2 1 491 . 1 1 A 72 72 GLY HA3 H 72 3.907 3.895 0.012 2 1 492 . 1 1 A 72 72 GLY N N 72 114.976 110.812 4.164 2 1 493 . 1 1 A 73 73 LYS H H 73 6.604 7.917 -1.313 2 1 494 . 1 1 A 73 73 LYS HA H 73 4.160 4.424 -0.264 2 1 501 . 1 1 A 73 73 LYS N N 73 113.898 118.309 -4.411 2 1 502 . 1 1 A 74 74 LEU H H 74 7.422 7.770 -0.348 2 1 503 . 1 1 A 74 74 LEU HA H 74 4.358 4.445 -0.087 2 1 513 . 1 1 A 74 74 LEU N N 74 117.180 120.399 -3.219 2 1 514 . 1 1 A 75 75 LYS H H 75 8.617 8.500 0.117 2 1 515 . 1 1 A 75 75 LYS HA H 75 4.079 4.627 -0.548 2 1 518 . 1 1 A 75 75 LYS N N 75 121.119 120.290 0.829 2 1 519 . 1 1 A 76 76 ASN H H 76 8.154 8.584 -0.430 2 1 520 . 1 1 A 76 76 ASN HA H 76 3.935 5.080 -1.145 2 1 525 . 1 1 A 76 76 ASN CB C 76 35.772 39.018 -3.246 2 1 526 . 1 1 A 76 76 ASN N N 76 122.761 119.275 3.486 2 1 527 . 1 1 A 77 77 ASP H H 77 9.227 8.036 1.191 2 1 528 . 1 1 A 77 77 ASP HA H 77 3.787 5.245 -1.458 2 1 531 . 1 1 A 77 77 ASP CA C 77 52.584 53.431 -0.847 2 1 532 . 1 1 A 77 77 ASP N N 77 114.129 118.448 -4.319 2 1 533 . 1 1 A 78 78 LYS H H 78 6.579 7.998 -1.419 2 1 534 . 1 1 A 78 78 LYS HA H 78 4.572 4.709 -0.137 2 1 539 . 1 1 A 78 78 LYS CA C 78 51.072 55.033 -3.961 2 1 540 . 1 1 A 78 78 LYS CB C 78 33.783 35.357 -1.574 2 1 541 . 1 1 A 78 78 LYS N N 78 114.135 121.410 -7.275 2 1 542 . 1 1 A 79 79 VAL H H 79 8.729 8.323 0.406 2 1 543 . 1 1 A 79 79 VAL HA H 79 4.402 4.269 0.133 2 1 551 . 1 1 A 79 79 VAL CA C 79 59.240 60.475 -1.235 2 1 553 . 1 1 A 79 79 VAL N N 79 123.191 122.798 0.393 2 1 554 . 1 1 A 80 80 SER H H 80 9.542 9.221 0.321 2 1 555 . 1 1 A 80 80 SER HA H 80 4.636 5.063 -0.427 2 1 558 . 1 1 A 80 80 SER CA C 80 55.978 57.486 -1.508 2 1 559 . 1 1 A 80 80 SER N N 80 127.445 121.240 6.205 2 1 560 . 1 1 A 81 81 ARG H H 81 8.093 8.723 -0.630 2 1 561 . 1 1 A 81 81 ARG HA H 81 5.210 5.515 -0.305 2 1 569 . 1 1 A 81 81 ARG N N 81 123.743 124.031 -0.288 2 1 571 . 1 1 A 82 82 PHE H H 82 9.312 8.208 1.104 2 1 572 . 1 1 A 82 82 PHE HA H 82 4.951 5.209 -0.258 2 1 577 . 1 1 A 82 82 PHE CA C 82 53.090 56.085 -2.995 2 1 578 . 1 1 A 82 82 PHE N N 82 119.529 117.639 1.890 2 1 579 . 1 1 A 83 83 ASP H H 83 9.122 8.841 0.281 2 1 580 . 1 1 A 83 83 ASP HA H 83 5.593 5.103 0.490 2 1 583 . 1 1 A 83 83 ASP N N 83 123.825 120.638 3.187 2 1 584 . 1 1 A 84 84 PHE H H 84 9.090 8.211 0.879 2 1 585 . 1 1 A 84 84 PHE HA H 84 6.410 6.015 0.395 2 1 592 . 1 1 A 84 84 PHE CA C 84 52.584 56.077 -3.493 2 1 593 . 1 1 A 84 84 PHE N N 84 118.862 118.769 0.093 2 1 594 . 1 1 A 85 85 ILE H H 85 8.441 8.901 -0.460 2 1 595 . 1 1 A 85 85 ILE HA H 85 4.662 4.924 -0.262 2 1 605 . 1 1 A 85 85 ILE CB C 85 39.939 40.382 -0.443 2 1 608 . 1 1 A 85 85 ILE N N 85 118.049 120.764 -2.715 2 1 609 . 1 1 A 86 86 ARG H H 86 8.983 8.834 0.149 2 1 610 . 1 1 A 86 86 ARG HA H 86 5.591 4.748 0.843 2 1 616 . 1 1 A 86 86 ARG N N 86 127.006 127.947 -0.941 2 1 618 . 1 1 A 87 87 GLN H H 87 8.643 9.001 -0.358 2 1 619 . 1 1 A 87 87 GLN HA H 87 5.630 5.114 0.516 2 1 626 . 1 1 A 87 87 GLN CA C 87 51.512 54.373 -2.861 2 1 627 . 1 1 A 87 87 GLN N N 87 124.142 122.730 1.412 2 1 629 . 1 1 A 88 88 ILE H H 88 8.617 8.746 -0.129 2 1 630 . 1 1 A 88 88 ILE HA H 88 4.690 4.871 -0.181 2 1 637 . 1 1 A 88 88 ILE CA C 88 56.995 60.496 -3.501 2 1 638 . 1 1 A 88 88 ILE CB C 88 39.927 40.339 -0.412 2 1 641 . 1 1 A 88 88 ILE N N 88 116.353 123.465 -7.112 2 1 642 . 1 1 A 89 89 GLU H H 89 8.298 8.978 -0.680 2 1 643 . 1 1 A 89 89 GLU HA H 89 5.100 5.752 -0.652 2 1 646 . 1 1 A 89 89 GLU CA C 89 52.204 54.953 -2.749 2 1 647 . 1 1 A 89 89 GLU CB C 89 27.325 33.097 -5.772 2 1 648 . 1 1 A 89 89 GLU N N 89 124.458 128.994 -4.536 2 1 649 . 1 1 A 90 90 VAL H H 90 8.957 8.822 0.135 2 1 650 . 1 1 A 90 90 VAL HA H 90 4.169 4.594 -0.425 2 1 658 . 1 1 A 90 90 VAL CA C 90 58.664 60.230 -1.566 2 1 659 . 1 1 A 90 90 VAL CB C 90 31.861 33.483 -1.622 2 1 660 . 1 1 A 90 90 VAL N N 90 127.580 126.522 1.058 2 1 661 . 1 1 A 91 91 ASP H H 91 9.369 8.702 0.667 2 1 662 . 1 1 A 91 91 ASP HA H 91 4.287 4.530 -0.243 2 1 665 . 1 1 A 91 91 ASP CA C 91 52.389 54.829 -2.440 2 1 666 . 1 1 A 91 91 ASP CB C 91 36.409 40.300 -3.891 2 1 667 . 1 1 A 91 91 ASP N N 91 129.411 124.034 5.377 2 1 668 . 1 1 A 92 92 GLY H H 92 8.552 7.478 1.074 2 1 669 . 1 1 A 92 92 GLY HA2 H 92 4.090 4.096 -0.006 2 1 670 . 1 1 A 92 92 GLY HA3 H 92 3.618 4.097 -0.479 2 1 671 . 1 1 A 92 92 GLY CA C 92 42.836 45.594 -2.758 2 1 672 . 1 1 A 92 92 GLY N N 92 103.862 105.820 -1.958 2 1 673 . 1 1 A 93 93 GLN H H 93 7.808 7.717 0.091 2 1 674 . 1 1 A 93 93 GLN HA H 93 4.578 4.816 -0.238 2 1 679 . 1 1 A 93 93 GLN CA C 93 50.918 54.306 -3.388 2 1 680 . 1 1 A 93 93 GLN CB C 93 28.602 31.152 -2.550 2 1 682 . 1 1 A 93 93 GLN N N 93 120.412 118.538 1.874 2 1 683 . 1 1 A 94 94 LEU H H 94 8.414 8.487 -0.073 2 1 684 . 1 1 A 94 94 LEU HA H 94 4.704 4.314 0.390 2 1 693 . 1 1 A 94 94 LEU CB C 94 39.873 42.577 -2.704 2 1 696 . 1 1 A 94 94 LEU N N 94 125.061 122.233 2.828 2 1 697 . 1 1 A 95 95 ILE H H 95 9.181 8.597 0.584 2 1 698 . 1 1 A 95 95 ILE HA H 95 4.371 4.879 -0.508 2 1 708 . 1 1 A 95 95 ILE CA C 95 63.319 60.698 2.621 2 1 709 . 1 1 A 95 95 ILE CB C 95 37.407 39.759 -2.352 2 1 711 . 1 1 A 95 95 ILE N N 95 127.724 121.569 6.155 2 1 712 . 1 1 A 96 96 THR H H 96 8.730 7.492 1.238 2 1 713 . 1 1 A 96 96 THR HA H 96 4.411 4.454 -0.043 2 1 718 . 1 1 A 96 96 THR CA C 96 60.344 62.949 -2.605 2 1 719 . 1 1 A 96 96 THR CB C 96 59.719 69.842 -10.123 2 1 720 . 1 1 A 96 96 THR N N 96 124.240 118.709 5.531 2 1 721 . 1 1 A 97 97 LEU H H 97 8.790 8.812 -0.022 2 1 722 . 1 1 A 97 97 LEU HA H 97 4.400 5.024 -0.624 2 1 732 . 1 1 A 97 97 LEU N N 97 126.147 124.448 1.699 2 1 733 . 1 1 A 98 98 GLU H H 98 7.596 9.032 -1.436 2 1 734 . 1 1 A 98 98 GLU HA H 98 5.102 5.001 0.101 2 1 739 . 1 1 A 98 98 GLU N N 98 116.937 123.354 -6.417 2 1 740 . 1 1 A 99 99 SER H H 99 8.906 8.676 0.230 2 1 741 . 1 1 A 99 99 SER HA H 99 4.504 5.323 -0.819 2 1 744 . 1 1 A 99 99 SER CA C 99 54.010 56.427 -2.417 2 1 745 . 1 1 A 99 99 SER CB C 99 63.876 66.239 -2.363 2 1 746 . 1 1 A 99 99 SER N N 99 117.823 117.390 0.433 2 1 747 . 1 1 A 100 100 GLY H H 100 7.250 7.955 -0.705 2 1 748 . 1 1 A 100 100 GLY HA2 H 100 4.872 3.958 0.914 2 1 749 . 1 1 A 100 100 GLY HA3 H 100 3.731 4.043 -0.312 2 1 750 . 1 1 A 100 100 GLY N N 100 109.436 109.567 -0.131 2 1 751 . 1 1 A 101 101 GLU H H 101 9.661 8.800 0.861 2 1 752 . 1 1 A 101 101 GLU HA H 101 5.643 4.751 0.892 2 1 757 . 1 1 A 101 101 GLU CA C 101 52.584 54.749 -2.165 2 1 758 . 1 1 A 101 101 GLU CB C 101 31.750 32.723 -0.973 2 1 759 . 1 1 A 101 101 GLU N N 101 126.793 120.465 6.328 2 1 760 . 1 1 A 102 102 PHE H H 102 10.441 8.878 1.563 2 1 761 . 1 1 A 102 102 PHE HA H 102 5.248 5.228 0.020 2 1 768 . 1 1 A 102 102 PHE CA C 102 53.537 56.173 -2.636 2 1 769 . 1 1 A 102 102 PHE N N 102 131.837 124.038 7.799 2 1 770 . 1 1 A 103 103 GLN H H 103 9.135 9.558 -0.423 2 1 771 . 1 1 A 103 103 GLN HA H 103 5.205 4.949 0.256 2 1 776 . 1 1 A 103 103 GLN CA C 103 50.925 54.694 -3.769 2 1 777 . 1 1 A 103 103 GLN N N 103 127.720 126.083 1.637 2 1 778 . 1 1 A 104 104 VAL H H 104 8.937 9.149 -0.212 2 1 779 . 1 1 A 104 104 VAL HA H 104 4.780 4.961 -0.181 2 1 787 . 1 1 A 104 104 VAL CA C 104 57.086 61.348 -4.262 2 1 789 . 1 1 A 104 104 VAL N N 104 120.097 125.665 -5.568 2 1 790 . 1 1 A 105 105 TYR H H 105 9.108 9.605 -0.497 2 1 791 . 1 1 A 105 105 TYR HA H 105 4.834 5.202 -0.368 2 1 798 . 1 1 A 105 105 TYR CA C 105 54.486 57.473 -2.987 2 1 799 . 1 1 A 105 105 TYR N N 105 128.426 127.673 0.753 2 1 800 . 1 1 A 106 106 LYS H H 106 5.945 9.065 -3.120 2 1 805 . 1 1 A 106 106 LYS N N 106 129.163 125.081 4.082 2 1 806 . 1 1 A 107 107 GLN H H 107 8.526 8.561 -0.035 2 1 807 . 1 1 A 107 107 GLN HA H 107 5.160 5.132 0.028 2 1 812 . 1 1 A 107 107 GLN CA C 107 52.584 54.392 -1.808 2 1 813 . 1 1 A 107 107 GLN CB C 107 26.175 29.710 -3.535 2 1 814 . 1 1 A 107 107 GLN N N 107 125.978 123.776 2.202 2 1 815 . 1 1 A 108 108 SER H H 108 8.621 8.667 -0.046 2 1 816 . 1 1 A 108 108 SER HA H 108 4.403 4.462 -0.059 2 1 819 . 1 1 A 108 108 SER CA C 108 58.521 60.968 -2.447 2 1 820 . 1 1 A 108 108 SER CB C 108 60.737 63.519 -2.782 2 1 821 . 1 1 A 108 108 SER N N 108 117.542 115.641 1.901 2 1 822 . 1 1 A 109 109 HIS H H 109 10.381 8.147 2.234 2 1 823 . 1 1 A 109 109 HIS HA H 109 4.594 4.749 -0.155 2 1 828 . 1 1 A 109 109 HIS CA C 109 51.743 56.335 -4.592 2 1 829 . 1 1 A 109 109 HIS CB C 109 27.174 31.006 -3.832 2 1 830 . 1 1 A 109 109 HIS N N 109 118.449 116.846 1.603 2 1 831 . 1 1 A 110 110 SER H H 110 7.366 7.866 -0.500 2 1 832 . 1 1 A 110 110 SER HA H 110 4.870 4.768 0.102 2 1 835 . 1 1 A 110 110 SER CB C 110 62.986 65.212 -2.226 2 1 836 . 1 1 A 110 110 SER N N 110 113.397 113.388 0.009 2 1 837 . 1 1 A 111 111 ALA H H 111 8.541 8.455 0.086 2 1 838 . 1 1 A 111 111 ALA HA H 111 4.826 4.997 -0.171 2 1 842 . 1 1 A 111 111 ALA CA C 111 49.015 51.734 -2.719 2 1 843 . 1 1 A 111 111 ALA CB C 111 20.256 22.953 -2.697 2 1 844 . 1 1 A 111 111 ALA N N 111 117.786 122.755 -4.969 2 1 845 . 1 1 A 112 112 LEU H H 112 8.529 9.186 -0.657 2 1 846 . 1 1 A 112 112 LEU HA H 112 5.680 5.237 0.443 2 1 855 . 1 1 A 112 112 LEU CA C 112 51.818 53.409 -1.591 2 1 856 . 1 1 A 112 112 LEU N N 112 116.345 117.972 -1.627 2 1 857 . 1 1 A 113 113 THR H H 113 8.758 8.830 -0.072 2 1 858 . 1 1 A 113 113 THR HA H 113 5.563 5.349 0.214 2 1 863 . 1 1 A 113 113 THR CA C 113 54.458 60.510 -6.052 2 1 864 . 1 1 A 113 113 THR CB C 113 68.586 72.346 -3.760 2 1 866 . 1 1 A 113 113 THR N N 113 110.469 116.194 -5.725 2 1 867 . 1 1 A 114 114 ALA H H 114 8.829 8.952 -0.123 2 1 868 . 1 1 A 114 114 ALA HA H 114 4.466 4.971 -0.505 2 1 872 . 1 1 A 114 114 ALA CA C 114 48.886 51.840 -2.954 2 1 873 . 1 1 A 114 114 ALA CB C 114 21.583 22.020 -0.437 2 1 874 . 1 1 A 114 114 ALA N N 114 121.456 123.962 -2.506 2 1 875 . 1 1 A 115 115 LEU H H 115 8.407 9.182 -0.775 2 1 876 . 1 1 A 115 115 LEU HA H 115 4.814 4.674 0.140 2 1 886 . 1 1 A 115 115 LEU N N 115 119.223 123.007 -3.784 2 1 887 . 1 1 A 116 116 GLN H H 116 9.720 8.925 0.795 2 1 888 . 1 1 A 116 116 GLN HA H 116 5.312 4.946 0.366 2 1 893 . 1 1 A 116 116 GLN CA C 116 50.544 54.291 -3.747 2 1 894 . 1 1 A 116 116 GLN N N 116 127.827 122.200 5.627 2 1 895 . 1 1 A 117 117 THR H H 117 9.663 9.161 0.502 2 1 896 . 1 1 A 117 117 THR HA H 117 4.198 4.768 -0.570 2 1 901 . 1 1 A 117 117 THR CA C 117 64.037 61.157 2.880 2 1 902 . 1 1 A 117 117 THR CB C 117 66.868 71.591 -4.723 2 1 904 . 1 1 A 117 117 THR N N 117 128.929 120.254 8.675 2 1 905 . 1 1 A 118 118 GLU H H 118 9.486 8.856 0.630 2 1 906 . 1 1 A 118 118 GLU HA H 118 4.885 4.577 0.308 2 1 911 . 1 1 A 118 118 GLU N N 118 123.497 121.906 1.591 2 1 912 . 1 1 A 119 119 GLN H H 119 8.076 7.543 0.533 2 1 913 . 1 1 A 119 119 GLN HA H 119 5.331 4.847 0.484 2 1 916 . 1 1 A 119 119 GLN CA C 119 51.858 54.312 -2.454 2 1 917 . 1 1 A 119 119 GLN N N 119 118.023 118.039 -0.016 2 1 918 . 1 1 A 120 120 GLU H H 120 9.078 8.898 0.180 2 1 919 . 1 1 A 120 120 GLU HA H 120 5.071 4.969 0.102 2 1 924 . 1 1 A 120 120 GLU N N 120 118.433 122.480 -4.047 2 1 925 . 1 1 A 121 121 GLN H H 121 7.711 8.777 -1.066 2 1 926 . 1 1 A 121 121 GLN HA H 121 4.430 5.192 -0.762 2 1 933 . 1 1 A 121 121 GLN CA C 121 53.996 54.490 -0.494 2 1 934 . 1 1 A 121 121 GLN CB C 121 27.158 32.498 -5.340 2 1 936 . 1 1 A 121 121 GLN N N 121 122.412 119.846 2.566 2 1 938 . 1 1 A 122 122 ASP H H 122 8.675 9.716 -1.041 2 1 939 . 1 1 A 122 122 ASP HA H 122 4.632 5.178 -0.546 2 1 942 . 1 1 A 122 122 ASP CA C 122 48.797 51.079 -2.282 2 1 943 . 1 1 A 122 122 ASP CB C 122 39.852 42.754 -2.902 2 1 944 . 1 1 A 122 122 ASP N N 122 128.625 122.960 5.665 2 1 945 . 1 1 A 123 123 PRO CA C 123 61.579 63.996 -2.417 2 1 946 . 1 1 A 123 123 PRO CB C 123 29.597 31.063 -1.466 2 1 948 . 1 1 A 124 124 GLU H H 124 8.297 8.635 -0.338 2 1 949 . 1 1 A 124 124 GLU HA H 124 4.196 4.116 0.080 2 1 954 . 1 1 A 124 124 GLU CA C 124 53.025 57.901 -4.876 2 1 955 . 1 1 A 124 124 GLU CB C 124 27.927 30.343 -2.416 2 1 957 . 1 1 A 124 124 GLU N N 124 115.538 119.320 -3.782 2 1 958 . 1 1 A 125 125 HIS H H 125 7.419 7.705 -0.286 2 1 959 . 1 1 A 125 125 HIS HA H 125 4.833 4.757 0.076 2 1 964 . 1 1 A 125 125 HIS CA C 125 51.886 55.663 -3.777 2 1 965 . 1 1 A 125 125 HIS CB C 125 26.387 30.425 -4.038 2 1 966 . 1 1 A 125 125 HIS N N 125 117.464 116.089 1.375 2 1 967 . 1 1 A 126 126 SER H H 126 8.441 8.364 0.077 2 1 968 . 1 1 A 126 126 SER HA H 126 4.261 4.597 -0.336 2 1 971 . 1 1 A 126 126 SER CA C 126 57.988 59.841 -1.853 2 1 972 . 1 1 A 126 126 SER N N 126 117.954 115.768 2.186 2 1 973 . 1 1 A 127 127 GLU H H 127 9.221 8.142 1.079 2 1 974 . 1 1 A 127 127 GLU HA H 127 4.366 4.410 -0.044 2 1 979 . 1 1 A 127 127 GLU CA C 127 53.707 56.534 -2.827 2 1 980 . 1 1 A 127 127 GLU CB C 127 25.492 29.822 -4.330 2 1 981 . 1 1 A 127 127 GLU N N 127 120.404 119.202 1.202 2 1 982 . 1 1 A 128 128 LYS H H 128 8.262 8.595 -0.333 2 1 983 . 1 1 A 128 128 LYS HA H 128 4.661 4.420 0.241 2 1 990 . 1 1 A 128 128 LYS CA C 128 52.264 57.119 -4.855 2 1 991 . 1 1 A 128 128 LYS CB C 128 32.404 32.464 -0.060 2 1 994 . 1 1 A 128 128 LYS N N 128 122.166 118.908 3.258 2 1 995 . 1 1 A 129 129 MET H H 129 8.242 8.594 -0.352 2 1 996 . 1 1 A 129 129 MET HA H 129 5.012 5.340 -0.328 2 1 1001 . 1 1 A 129 129 MET CA C 129 50.958 54.173 -3.215 2 1 1003 . 1 1 A 129 129 MET N N 129 119.422 118.094 1.328 2 1 1004 . 1 1 A 130 130 VAL H H 130 9.200 9.391 -0.191 2 1 1005 . 1 1 A 130 130 VAL HA H 130 4.609 4.726 -0.117 2 1 1013 . 1 1 A 130 130 VAL CA C 130 56.296 60.487 -4.191 2 1 1014 . 1 1 A 130 130 VAL CB C 130 32.606 35.145 -2.539 2 1 1015 . 1 1 A 130 130 VAL N N 130 118.290 122.607 -4.317 2 1 1016 . 1 1 A 131 131 ALA H H 131 8.368 8.666 -0.298 2 1 1017 . 1 1 A 131 131 ALA HA H 131 4.654 5.136 -0.482 2 1 1021 . 1 1 A 131 131 ALA CA C 131 49.739 51.111 -1.372 2 1 1022 . 1 1 A 131 131 ALA CB C 131 15.351 21.071 -5.720 2 1 1023 . 1 1 A 131 131 ALA N N 131 126.734 124.975 1.759 2 1 1024 . 1 1 A 132 132 LYS H H 132 7.732 8.547 -0.815 2 1 1025 . 1 1 A 132 132 LYS HA H 132 4.171 4.860 -0.689 2 1 1028 . 1 1 A 132 132 LYS N N 132 127.309 121.663 5.646 2 1 1029 . 1 1 A 133 133 ARG H H 133 8.193 8.570 -0.377 2 1 1030 . 1 1 A 133 133 ARG HA H 133 5.073 4.977 0.096 2 1 1038 . 1 1 A 133 133 ARG N N 133 122.190 120.916 1.274 2 1 1040 . 1 1 A 134 134 ARG H H 134 7.539 8.919 -1.380 2 1 1041 . 1 1 A 134 134 ARG HA H 134 4.667 4.889 -0.222 2 1 1049 . 1 1 A 134 134 ARG CA C 134 52.584 54.829 -2.245 2 1 1050 . 1 1 A 134 134 ARG CB C 134 31.325 32.714 -1.389 2 1 1052 . 1 1 A 134 134 ARG N N 134 121.632 124.960 -3.328 2 1 1054 . 1 1 A 135 135 PHE H H 135 8.816 8.662 0.154 2 1 1055 . 1 1 A 135 135 PHE HA H 135 5.680 5.653 0.027 2 1 1062 . 1 1 A 135 135 PHE N N 135 125.107 122.431 2.676 2 1 1063 . 1 1 A 136 136 ARG H H 136 7.741 9.528 -1.787 2 1 1064 . 1 1 A 136 136 ARG HA H 136 4.402 4.765 -0.363 2 1 1068 . 1 1 A 136 136 ARG N N 136 125.640 124.280 1.360 2 1 1070 . 1 1 A 137 137 ILE H H 137 8.556 8.709 -0.153 2 1 1071 . 1 1 A 137 137 ILE HA H 137 3.912 4.652 -0.740 2 1 1076 . 1 1 A 137 137 ILE CA C 137 55.676 60.444 -4.768 2 1 1079 . 1 1 A 137 137 ILE N N 137 122.891 124.151 -1.260 2 1 1080 . 1 1 A 138 138 GLY H H 138 8.676 9.006 -0.330 2 1 1081 . 1 1 A 138 138 GLY HA2 H 138 3.740 4.171 -0.431 2 1 1082 . 1 1 A 138 138 GLY HA3 H 138 2.982 4.188 -1.206 2 1 1083 . 1 1 A 138 138 GLY CA C 138 41.908 45.664 -3.756 2 1 1084 . 1 1 A 138 138 GLY N N 138 117.058 114.793 2.265 2 1 1085 . 1 1 A 139 139 ASP H H 139 7.858 8.202 -0.344 2 1 1086 . 1 1 A 139 139 ASP HA H 139 4.753 4.861 -0.108 2 1 1089 . 1 1 A 139 139 ASP CA C 139 52.584 54.121 -1.537 2 1 1090 . 1 1 A 139 139 ASP CB C 139 43.062 41.880 1.182 2 1 1091 . 1 1 A 139 139 ASP N N 139 124.516 121.090 3.426 2 1 1092 . 1 1 A 140 140 ILE H H 140 8.354 8.744 -0.390 2 1 1093 . 1 1 A 140 140 ILE HA H 140 4.473 4.529 -0.056 2 1 1103 . 1 1 A 140 140 ILE CB C 140 36.173 38.897 -2.724 2 1 1105 . 1 1 A 140 140 ILE N N 140 120.679 123.165 -2.486 2 1 1106 . 1 1 A 141 141 ALA H H 141 8.708 8.052 0.656 2 1 1107 . 1 1 A 141 141 ALA HA H 141 4.862 4.526 0.336 2 1 1111 . 1 1 A 141 141 ALA CA C 141 47.968 51.568 -3.600 2 1 1112 . 1 1 A 141 141 ALA CB C 141 21.733 19.962 1.771 2 1 1113 . 1 1 A 141 141 ALA N N 141 130.144 127.570 2.574 2 1 1114 . 1 1 A 142 142 GLY H H 142 7.888 8.456 -0.568 2 1 1115 . 1 1 A 142 142 GLY HA2 H 142 4.519 3.940 0.579 2 1 1116 . 1 1 A 142 142 GLY HA3 H 142 3.634 4.052 -0.418 2 1 1117 . 1 1 A 142 142 GLY N N 142 102.272 108.785 -6.513 2 1 1118 . 1 1 A 143 143 GLU H H 143 8.068 8.204 -0.136 2 1 1119 . 1 1 A 143 143 GLU HA H 143 4.577 4.529 0.048 2 1 1124 . 1 1 A 143 143 GLU N N 143 120.569 119.067 1.502 2 1 1125 . 1 1 A 144 144 HIS H H 144 8.478 8.357 0.121 2 1 1126 . 1 1 A 144 144 HIS HA H 144 4.968 4.684 0.284 2 1 1131 . 1 1 A 144 144 HIS N N 144 124.275 120.753 3.522 2 1 1132 . 1 1 A 145 145 THR H H 145 9.031 8.405 0.626 2 1 1133 . 1 1 A 145 145 THR HA H 145 4.025 4.815 -0.790 2 1 1138 . 1 1 A 145 145 THR CA C 145 61.247 61.279 -0.032 2 1 1139 . 1 1 A 145 145 THR CB C 145 65.181 70.127 -4.946 2 1 1141 . 1 1 A 145 145 THR N N 145 125.828 116.902 8.926 2 1 1142 . 1 1 A 146 146 SER H H 146 9.077 8.589 0.488 2 1 1143 . 1 1 A 146 146 SER HA H 146 4.684 4.888 -0.204 2 1 1145 . 1 1 A 146 146 SER CA C 146 56.067 58.663 -2.596 2 1 1146 . 1 1 A 146 146 SER CB C 146 60.510 63.402 -2.892 2 1 1147 . 1 1 A 146 146 SER N N 146 124.154 120.432 3.722 2 1 1148 . 1 1 A 147 147 PHE H H 147 9.049 8.963 0.086 2 1 1149 . 1 1 A 147 147 PHE HA H 147 4.022 4.336 -0.314 2 1 1154 . 1 1 A 147 147 PHE N N 147 127.670 125.748 1.922 2 1 1155 . 1 1 A 148 148 ASP H H 148 8.504 8.361 0.143 2 1 1156 . 1 1 A 148 148 ASP HA H 148 4.422 4.533 -0.111 2 1 1158 . 1 1 A 148 148 ASP CA C 148 52.584 56.521 -3.937 2 1 1159 . 1 1 A 148 148 ASP CB C 148 37.800 40.992 -3.192 2 1 1160 . 1 1 A 148 148 ASP N N 148 114.377 120.214 -5.837 2 1 1161 . 1 1 A 149 149 LYS H H 149 7.380 8.576 -1.196 2 1 1162 . 1 1 A 149 149 LYS HA H 149 4.487 4.315 0.172 2 1 1171 . 1 1 A 149 149 LYS CA C 149 51.735 57.311 -5.576 2 1 1172 . 1 1 A 149 149 LYS CB C 149 30.162 32.669 -2.507 2 1 1175 . 1 1 A 149 149 LYS N N 149 119.137 117.049 2.088 2 1 1176 . 1 1 A 150 150 LEU H H 150 6.886 8.063 -1.177 2 1 1177 . 1 1 A 150 150 LEU HA H 150 3.996 4.560 -0.564 2 1 1186 . 1 1 A 150 150 LEU CA C 150 50.502 53.977 -3.475 2 1 1187 . 1 1 A 150 150 LEU N N 150 120.614 118.765 1.849 2 1 1188 . 1 1 A 151 151 PRO CB C 151 29.567 30.823 -1.256 2 1 1190 . 1 1 A 152 152 LYS H H 152 8.076 8.521 -0.445 2 1 1191 . 1 1 A 152 152 LYS HA H 152 4.346 4.532 -0.186 2 1 1195 . 1 1 A 152 152 LYS CA C 152 53.182 56.495 -3.313 2 1 1196 . 1 1 A 152 152 LYS CB C 152 31.487 33.844 -2.357 2 1 1198 . 1 1 A 152 152 LYS N N 152 118.133 120.382 -2.249 2 1 1199 . 1 1 A 153 153 ASP H H 153 7.982 8.124 -0.142 2 1 1200 . 1 1 A 153 153 ASP HA H 153 4.402 4.389 0.013 2 1 1203 . 1 1 A 153 153 ASP CA C 153 52.584 53.245 -0.661 2 1 1204 . 1 1 A 153 153 ASP CB C 153 37.762 40.590 -2.828 2 1 1205 . 1 1 A 153 153 ASP N N 153 115.735 118.214 -2.479 2 1 1206 . 1 1 A 154 154 VAL H H 154 6.987 8.053 -1.066 2 1 1207 . 1 1 A 154 154 VAL HA H 154 4.406 4.439 -0.033 2 1 1215 . 1 1 A 154 154 VAL CA C 154 58.408 60.795 -2.387 2 1 1216 . 1 1 A 154 154 VAL CB C 154 32.617 33.392 -0.775 2 1 1217 . 1 1 A 154 154 VAL N N 154 116.266 120.406 -4.140 2 1 1218 . 1 1 A 155 155 MET H H 155 8.444 8.669 -0.225 2 1 1219 . 1 1 A 155 155 MET HA H 155 5.416 4.864 0.552 2 1 1224 . 1 1 A 155 155 MET CA C 155 51.183 54.661 -3.478 2 1 1226 . 1 1 A 155 155 MET N N 155 124.950 125.457 -0.507 2 1 1227 . 1 1 A 156 156 ALA H H 156 9.226 8.771 0.455 2 1 1228 . 1 1 A 156 156 ALA HA H 156 4.693 4.986 -0.293 2 1 1232 . 1 1 A 156 156 ALA CA C 156 48.379 50.783 -2.404 2 1 1233 . 1 1 A 156 156 ALA CB C 156 21.051 20.814 0.237 2 1 1234 . 1 1 A 156 156 ALA N N 156 129.938 126.418 3.520 2 1 1235 . 1 1 A 157 157 THR H H 157 8.554 8.687 -0.133 2 1 1236 . 1 1 A 157 157 THR HA H 157 4.839 4.715 0.124 2 1 1241 . 1 1 A 157 157 THR CA C 157 59.555 62.331 -2.776 2 1 1242 . 1 1 A 157 157 THR CB C 157 68.575 70.124 -1.549 2 1 1244 . 1 1 A 157 157 THR N N 157 118.815 118.840 -0.025 2 1 1245 . 1 1 A 158 158 TYR H H 158 9.974 9.664 0.310 2 1 1246 . 1 1 A 158 158 TYR HA H 158 4.435 5.388 -0.953 2 1 1253 . 1 1 A 158 158 TYR N N 158 126.958 124.285 2.673 2 1 1254 . 1 1 A 159 159 ARG H H 159 8.909 8.733 0.176 2 1 1255 . 1 1 A 159 159 ARG HA H 159 5.444 5.380 0.064 2 1 1263 . 1 1 A 159 159 ARG CA C 159 51.933 54.495 -2.562 2 1 1264 . 1 1 A 159 159 ARG N N 159 121.721 119.889 1.832 2 1 1266 . 1 1 A 160 160 GLY H H 160 8.910 8.611 0.299 2 1 1267 . 1 1 A 160 160 GLY HA2 H 160 4.904 4.366 0.538 2 1 1268 . 1 1 A 160 160 GLY HA3 H 160 4.484 4.518 -0.034 2 1 1269 . 1 1 A 160 160 GLY N N 160 113.921 107.130 6.791 2 1 1270 . 1 1 A 161 161 THR H H 161 9.110 9.233 -0.123 2 1 1271 . 1 1 A 161 161 THR HA H 161 4.810 5.295 -0.485 2 1 1276 . 1 1 A 161 161 THR CA C 161 59.603 60.954 -1.351 2 1 1277 . 1 1 A 161 161 THR CB C 161 69.909 72.363 -2.454 2 1 1279 . 1 1 A 161 161 THR N N 161 126.813 115.609 11.204 2 1 1280 . 1 1 A 162 162 ALA H H 162 7.137 9.498 -2.361 2 1 1281 . 1 1 A 162 162 ALA HA H 162 5.361 5.205 0.156 2 1 1285 . 1 1 A 162 162 ALA CA C 162 46.573 50.788 -4.215 2 1 1286 . 1 1 A 162 162 ALA CB C 162 20.959 23.522 -2.563 2 1 1287 . 1 1 A 162 162 ALA N N 162 128.111 124.722 3.389 2 1 1288 . 1 1 A 163 163 PHE H H 163 8.587 9.071 -0.484 2 1 1289 . 1 1 A 163 163 PHE HA H 163 5.538 5.407 0.131 2 1 1296 . 1 1 A 163 163 PHE N N 163 117.349 115.307 2.042 2 1 1297 . 1 1 A 164 164 GLY H H 164 8.650 8.766 -0.116 2 1 1298 . 1 1 A 164 164 GLY HA2 H 164 4.210 4.007 0.203 2 1 1299 . 1 1 A 164 164 GLY HA3 H 164 3.285 4.139 -0.854 2 1 1300 . 1 1 A 164 164 GLY CA C 164 40.377 44.391 -4.014 2 1 1301 . 1 1 A 164 164 GLY N N 164 108.839 109.206 -0.367 2 1 1302 . 1 1 A 165 165 SER H H 165 7.684 9.305 -1.621 2 1 1303 . 1 1 A 165 165 SER HA H 165 3.458 4.254 -0.796 2 1 1304 . 1 1 A 165 165 SER N N 165 116.037 117.432 -1.395 2 1 1305 . 1 1 A 166 166 ASP H H 166 9.718 8.234 1.484 2 1 1306 . 1 1 A 166 166 ASP HA H 166 4.281 4.704 -0.423 2 1 1309 . 1 1 A 166 166 ASP CA C 166 52.584 54.537 -1.953 2 1 1310 . 1 1 A 166 166 ASP N N 166 125.166 120.199 4.967 2 1 1311 . 1 1 A 167 167 ASP H H 167 7.655 7.842 -0.187 2 1 1312 . 1 1 A 167 167 ASP HA H 167 4.666 4.967 -0.301 2 1 1315 . 1 1 A 167 167 ASP CB C 167 38.948 43.713 -4.765 2 1 1316 . 1 1 A 167 167 ASP N N 167 117.491 119.185 -1.694 2 1 1317 . 1 1 A 168 168 ALA H H 168 8.585 8.496 0.089 2 1 1318 . 1 1 A 168 168 ALA HA H 168 5.012 4.445 0.567 2 1 1322 . 1 1 A 168 168 ALA CA C 168 47.485 52.714 -5.229 2 1 1323 . 1 1 A 168 168 ALA N N 168 128.834 122.625 6.209 2 1 1324 . 1 1 A 169 169 GLY H H 169 8.472 7.802 0.670 2 1 1325 . 1 1 A 169 169 GLY HA2 H 169 4.404 3.754 0.650 2 1 1326 . 1 1 A 169 169 GLY HA3 H 169 4.051 3.950 0.101 2 1 1327 . 1 1 A 169 169 GLY CA C 169 43.257 45.588 -2.331 2 1 1328 . 1 1 A 169 169 GLY N N 169 107.133 105.758 1.375 2 1 1329 . 1 1 A 170 170 GLY H H 170 7.229 7.944 -0.715 2 1 1330 . 1 1 A 170 170 GLY HA2 H 170 4.223 4.076 0.147 2 1 1331 . 1 1 A 170 170 GLY HA3 H 170 3.781 4.166 -0.385 2 1 1332 . 1 1 A 170 170 GLY CA C 170 43.310 45.669 -2.359 2 1 1333 . 1 1 A 170 170 GLY N N 170 107.542 109.354 -1.812 2 1 1334 . 1 1 A 171 171 LYS H H 171 9.641 8.467 1.174 2 1 1335 . 1 1 A 171 171 LYS HA H 171 5.129 4.965 0.164 2 1 1342 . 1 1 A 171 171 LYS CA C 171 51.355 55.155 -3.800 2 1 1343 . 1 1 A 171 171 LYS N N 171 124.322 121.733 2.589 2 1 1344 . 1 1 A 172 172 LEU H H 172 7.764 8.632 -0.868 2 1 1345 . 1 1 A 172 172 LEU HA H 172 4.973 5.301 -0.328 2 1 1353 . 1 1 A 172 172 LEU CA C 172 50.348 53.443 -3.095 2 1 1354 . 1 1 A 172 172 LEU N N 172 126.389 121.508 4.881 2 1 1355 . 1 1 A 173 173 THR H H 173 8.321 8.504 -0.183 2 1 1356 . 1 1 A 173 173 THR HA H 173 5.017 5.068 -0.051 2 1 1361 . 1 1 A 173 173 THR CA C 173 59.149 61.636 -2.487 2 1 1362 . 1 1 A 173 173 THR CB C 173 67.449 70.485 -3.036 2 1 1364 . 1 1 A 173 173 THR N N 173 123.553 117.097 6.456 2 1 1365 . 1 1 A 174 174 TYR H H 174 9.367 9.753 -0.386 2 1 1366 . 1 1 A 174 174 TYR HA H 174 4.660 5.177 -0.517 2 1 1373 . 1 1 A 174 174 TYR CB C 174 41.267 41.964 -0.697 2 1 1374 . 1 1 A 174 174 TYR N N 174 129.583 125.530 4.053 2 1 1375 . 1 1 A 175 175 THR H H 175 8.529 9.156 -0.627 2 1 1376 . 1 1 A 175 175 THR HA H 175 5.388 5.001 0.387 2 1 1381 . 1 1 A 175 175 THR CA C 175 58.216 61.714 -3.498 2 1 1382 . 1 1 A 175 175 THR CB C 175 68.575 70.398 -1.823 2 1 1384 . 1 1 A 175 175 THR N N 175 125.967 116.001 9.966 2 1 1385 . 1 1 A 176 176 ILE H H 176 9.139 8.999 0.140 2 1 1386 . 1 1 A 176 176 ILE HA H 176 4.382 4.861 -0.479 2 1 1395 . 1 1 A 176 176 ILE CA C 176 58.006 59.596 -1.590 2 1 1396 . 1 1 A 176 176 ILE CB C 176 38.881 40.671 -1.790 2 1 1400 . 1 1 A 176 176 ILE N N 176 123.715 124.995 -1.280 2 1 1401 . 1 1 A 177 177 ASP H H 177 8.501 9.048 -0.547 2 1 1402 . 1 1 A 177 177 ASP HA H 177 5.011 4.980 0.031 2 1 1405 . 1 1 A 177 177 ASP CA C 177 49.089 53.128 -4.039 2 1 1406 . 1 1 A 177 177 ASP CB C 177 39.282 42.570 -3.288 2 1 1407 . 1 1 A 177 177 ASP N N 177 125.978 125.281 0.697 2 1 1408 . 1 1 A 178 178 PHE H H 178 8.913 8.948 -0.035 2 1 1409 . 1 1 A 178 178 PHE HA H 178 3.993 4.366 -0.373 2 1 1414 . 1 1 A 178 178 PHE CB C 178 34.588 39.725 -5.137 2 1 1415 . 1 1 A 178 178 PHE N N 178 123.522 123.243 0.279 2 1 1416 . 1 1 A 179 179 ALA H H 179 8.487 8.929 -0.442 2 1 1417 . 1 1 A 179 179 ALA HA H 179 4.528 4.225 0.303 2 1 1421 . 1 1 A 179 179 ALA CA C 179 52.584 55.384 -2.800 2 1 1422 . 1 1 A 179 179 ALA CB C 179 15.666 18.646 -2.980 2 1 1423 . 1 1 A 179 179 ALA N N 179 124.061 123.795 0.266 2 1 1424 . 1 1 A 180 180 ALA H H 180 7.162 7.713 -0.551 2 1 1425 . 1 1 A 180 180 ALA HA H 180 4.313 4.363 -0.050 2 1 1429 . 1 1 A 180 180 ALA CA C 180 49.006 52.650 -3.644 2 1 1430 . 1 1 A 180 180 ALA CB C 180 16.933 17.992 -1.059 2 1 1431 . 1 1 A 180 180 ALA N N 180 119.710 119.385 0.325 2 1 1432 . 1 1 A 181 181 LYS H H 181 8.092 8.744 -0.652 2 1 1433 . 1 1 A 181 181 LYS HA H 181 3.457 4.626 -1.169 2 1 1440 . 1 1 A 181 181 LYS CA C 181 54.783 56.642 -1.859 2 1 1441 . 1 1 A 181 181 LYS CB C 181 27.088 32.653 -5.565 2 1 1444 . 1 1 A 181 181 LYS N N 181 114.996 117.399 -2.403 2 1 1445 . 1 1 A 182 182 GLN H H 182 7.532 7.783 -0.251 2 1 1446 . 1 1 A 182 182 GLN HA H 182 5.304 4.945 0.359 2 1 1453 . 1 1 A 182 182 GLN CA C 182 51.473 54.779 -3.306 2 1 1454 . 1 1 A 182 182 GLN CB C 182 31.585 31.991 -0.406 2 1 1455 . 1 1 A 182 182 GLN N N 182 115.064 119.182 -4.118 2 1 1457 . 1 1 A 183 183 GLY H H 183 9.026 8.342 0.684 2 1 1458 . 1 1 A 183 183 GLY HA2 H 183 5.376 4.212 1.164 2 1 1459 . 1 1 A 183 183 GLY HA3 H 183 3.567 4.360 -0.793 2 1 1460 . 1 1 A 183 183 GLY CA C 183 42.361 45.307 -2.946 2 1 1461 . 1 1 A 183 183 GLY N N 183 111.505 109.849 1.656 2 1 1462 . 1 1 A 184 184 HIS H H 184 7.508 8.585 -1.077 2 1 1463 . 1 1 A 184 184 HIS HA H 184 4.304 5.208 -0.904 2 1 1467 . 1 1 A 184 184 HIS CA C 184 52.793 54.428 -1.635 2 1 1468 . 1 1 A 184 184 HIS CB C 184 27.906 33.082 -5.176 2 1 1469 . 1 1 A 184 184 HIS N N 184 111.297 120.240 -8.943 2 1 1470 . 1 1 A 185 185 GLY H H 185 9.160 7.506 1.654 2 1 1471 . 1 1 A 185 185 GLY HA2 H 185 4.464 3.278 1.186 2 1 1472 . 1 1 A 185 185 GLY HA3 H 185 4.117 3.906 0.211 2 1 1473 . 1 1 A 185 185 GLY CA C 185 44.212 45.161 -0.949 2 1 1474 . 1 1 A 185 185 GLY N N 185 107.398 107.751 -0.353 2 1 1475 . 1 1 A 186 186 LYS H H 186 9.170 8.351 0.819 2 1 1476 . 1 1 A 186 186 LYS HA H 186 4.925 4.915 0.010 2 1 1481 . 1 1 A 186 186 LYS CB C 186 33.642 36.027 -2.385 2 1 1482 . 1 1 A 186 186 LYS N N 186 122.690 119.668 3.022 2 1 1483 . 1 1 A 187 187 ILE H H 187 8.444 8.550 -0.106 2 1 1484 . 1 1 A 187 187 ILE HA H 187 4.626 5.000 -0.374 2 1 1487 . 1 1 A 187 187 ILE N N 187 124.320 123.400 0.920 2 1 1488 . 1 1 A 188 188 GLU H H 188 8.590 9.324 -0.734 2 1 1489 . 1 1 A 188 188 GLU HA H 188 4.650 4.857 -0.207 2 1 1495 . 1 1 A 188 188 GLU N N 188 122.575 126.992 -4.417 2 1 1496 . 1 1 A 189 189 HIS H H 189 8.726 8.442 0.284 2 1 1497 . 1 1 A 189 189 HIS HA H 189 4.055 4.452 -0.397 2 1 1501 . 1 1 A 189 189 HIS CA C 189 54.623 57.722 -3.099 2 1 1502 . 1 1 A 189 189 HIS CB C 189 24.997 30.564 -5.567 2 1 1503 . 1 1 A 189 189 HIS N N 189 111.381 122.607 -11.226 2 1 1504 . 1 1 A 190 190 LEU H H 190 9.715 7.920 1.795 2 1 1505 . 1 1 A 190 190 LEU HA H 190 4.379 4.325 0.054 2 1 1515 . 1 1 A 190 190 LEU N N 190 124.648 118.756 5.892 2 1 1516 . 1 1 A 191 191 LYS H H 191 10.099 8.278 1.821 2 1 1517 . 1 1 A 191 191 LYS HA H 191 3.736 4.363 -0.627 2 1 1524 . 1 1 A 191 191 LYS CA C 191 55.815 57.035 -1.220 2 1 1525 . 1 1 A 191 191 LYS CB C 191 30.201 33.915 -3.714 2 1 1527 . 1 1 A 191 191 LYS N N 191 123.618 119.857 3.761 2 1 1528 . 1 1 A 192 192 SER H H 192 6.991 7.643 -0.652 2 1 1529 . 1 1 A 192 192 SER HA H 192 4.743 4.443 0.300 2 1 1532 . 1 1 A 192 192 SER CA C 192 51.974 56.686 -4.712 2 1 1533 . 1 1 A 192 192 SER CB C 192 60.005 64.038 -4.033 2 1 1534 . 1 1 A 192 192 SER N N 192 115.071 116.243 -1.172 2 1 1535 . 1 1 A 193 193 PRO CB C 193 29.607 30.760 -1.153 2 1 1537 . 1 1 A 194 194 GLU H H 194 8.213 8.466 -0.253 2 1 1538 . 1 1 A 194 194 GLU HA H 194 3.063 4.643 -1.580 2 1 1543 . 1 1 A 194 194 GLU CA C 194 54.185 56.713 -2.528 2 1 1545 . 1 1 A 194 194 GLU N N 194 114.055 118.737 -4.682 2 1 1546 . 1 1 A 195 195 LEU H H 195 7.082 7.717 -0.635 2 1 1547 . 1 1 A 195 195 LEU HA H 195 4.027 4.463 -0.436 2 1 1557 . 1 1 A 195 195 LEU CA C 195 51.361 55.282 -3.921 2 1 1558 . 1 1 A 195 195 LEU CB C 195 38.950 41.653 -2.703 2 1 1561 . 1 1 A 195 195 LEU N N 195 113.898 118.879 -4.981 2 1 1562 . 1 1 A 196 196 ASN H H 196 7.060 7.732 -0.672 2 1 1563 . 1 1 A 196 196 ASN HA H 196 4.638 5.092 -0.454 2 1 1567 . 1 1 A 196 196 ASN N N 196 119.196 117.173 2.023 2 1 1568 . 1 1 A 197 197 VAL H H 197 7.244 8.547 -1.303 2 1 1569 . 1 1 A 197 197 VAL HA H 197 4.540 4.669 -0.129 2 1 1577 . 1 1 A 197 197 VAL CA C 197 57.176 60.131 -2.955 2 1 1578 . 1 1 A 197 197 VAL N N 197 113.621 119.537 -5.916 2 1 1579 . 1 1 A 198 198 ASP H H 198 8.881 8.998 -0.117 2 1 1580 . 1 1 A 198 198 ASP HA H 198 4.894 4.961 -0.067 2 1 1581 . 1 1 A 198 198 ASP N N 198 118.852 124.876 -6.024 2 1 1582 . 1 1 A 199 199 LEU H H 199 8.498 8.612 -0.114 2 1 1583 . 1 1 A 199 199 LEU HA H 199 4.317 4.796 -0.479 2 1 1591 . 1 1 A 199 199 LEU N N 199 124.078 126.187 -2.109 2 1 1592 . 1 1 A 200 200 ALA H H 200 8.386 8.675 -0.289 2 1 1593 . 1 1 A 200 200 ALA HA H 200 4.295 5.107 -0.812 2 1 1597 . 1 1 A 200 200 ALA CA C 200 50.044 50.951 -0.907 2 1 1598 . 1 1 A 200 200 ALA CB C 200 17.985 22.160 -4.175 2 1 1599 . 1 1 A 200 200 ALA N N 200 127.315 125.320 1.995 2 1 1600 . 1 1 A 201 201 VAL H H 201 8.007 8.845 -0.838 2 1 1601 . 1 1 A 201 201 VAL HA H 201 4.577 4.817 -0.240 2 1 1609 . 1 1 A 201 201 VAL CA C 201 60.004 60.201 -0.197 2 1 1610 . 1 1 A 201 201 VAL CB C 201 28.863 35.894 -7.031 2 1 1611 . 1 1 A 201 201 VAL N N 201 119.409 121.180 -1.771 2 1 1612 . 1 1 A 202 202 ALA H H 202 8.789 9.080 -0.291 2 1 1613 . 1 1 A 202 202 ALA HA H 202 4.630 5.351 -0.721 2 1 1617 . 1 1 A 202 202 ALA CA C 202 48.200 50.126 -1.926 2 1 1618 . 1 1 A 202 202 ALA N N 202 131.745 127.034 4.711 2 1 1619 . 1 1 A 203 203 TYR H H 203 8.522 9.065 -0.543 2 1 1620 . 1 1 A 203 203 TYR HA H 203 5.391 5.293 0.098 2 1 1627 . 1 1 A 203 203 TYR CA C 203 54.648 57.973 -3.325 2 1 1628 . 1 1 A 203 203 TYR CB C 203 37.315 39.601 -2.286 2 1 1629 . 1 1 A 203 203 TYR N N 203 117.786 123.668 -5.882 2 1 1630 . 1 1 A 204 204 ILE H H 204 8.209 8.101 0.108 2 1 1631 . 1 1 A 204 204 ILE HA H 204 4.393 4.563 -0.170 2 1 1641 . 1 1 A 204 204 ILE CB C 204 36.807 40.397 -3.590 2 1 1644 . 1 1 A 204 204 ILE N N 204 120.602 125.323 -4.721 2 1 1645 . 1 1 A 205 205 LYS H H 205 9.340 8.739 0.601 2 1 1646 . 1 1 A 205 205 LYS HA H 205 4.756 4.451 0.305 2 1 1651 . 1 1 A 205 205 LYS CA C 205 50.844 60.664 -9.820 2 1 1652 . 1 1 A 205 205 LYS N N 205 127.960 124.811 3.149 2 1 1653 . 1 1 A 207 207 ASP H H 207 8.436 8.726 -0.290 2 1 1654 . 1 1 A 207 207 ASP HA H 207 4.692 4.530 0.162 2 1 1657 . 1 1 A 207 207 ASP CA C 207 48.789 53.784 -4.995 2 1 1658 . 1 1 A 207 207 ASP CB C 207 38.377 41.208 -2.831 2 1 1659 . 1 1 A 207 207 ASP N N 207 123.098 124.720 -1.622 2 1 1660 . 1 1 A 208 208 GLU H H 208 8.880 8.360 0.520 2 1 1661 . 1 1 A 208 208 GLU HA H 208 3.994 4.080 -0.086 2 1 1666 . 1 1 A 208 208 GLU CA C 208 56.123 58.715 -2.592 2 1 1667 . 1 1 A 208 208 GLU CB C 208 25.794 29.759 -3.965 2 1 1669 . 1 1 A 208 208 GLU N N 208 119.042 121.584 -2.542 2 1 1670 . 1 1 A 209 209 LYS H H 209 7.681 7.661 0.020 2 1 1671 . 1 1 A 209 209 LYS HA H 209 4.141 4.321 -0.180 2 1 1680 . 1 1 A 209 209 LYS N N 209 119.252 116.167 3.085 2 1 1681 . 1 1 A 210 210 HIS H H 210 8.177 6.889 1.288 2 1 1682 . 1 1 A 210 210 HIS HA H 210 3.825 4.762 -0.937 2 1 1687 . 1 1 A 210 210 HIS CA C 210 54.205 54.558 -0.353 2 1 1688 . 1 1 A 210 210 HIS CB C 210 23.439 30.408 -6.969 2 1 1689 . 1 1 A 210 210 HIS N N 210 112.758 112.757 0.001 2 1 1690 . 1 1 A 211 211 HIS H H 211 8.758 7.212 1.546 2 1 1691 . 1 1 A 211 211 HIS HA H 211 5.041 5.220 -0.179 2 1 1695 . 1 1 A 211 211 HIS CA C 211 50.450 54.901 -4.451 2 1 1696 . 1 1 A 211 211 HIS CB C 211 25.703 33.006 -7.303 2 1 1697 . 1 1 A 211 211 HIS N N 211 119.552 118.416 1.136 2 1 1698 . 1 1 A 212 212 ALA H H 212 8.556 8.166 0.390 2 1 1699 . 1 1 A 212 212 ALA HA H 212 4.712 4.459 0.253 2 1 1703 . 1 1 A 212 212 ALA CA C 212 49.886 51.350 -1.464 2 1 1704 . 1 1 A 212 212 ALA CB C 212 18.860 19.189 -0.329 2 1 1705 . 1 1 A 212 212 ALA N N 212 123.780 123.148 0.632 2 1 1706 . 1 1 A 213 213 VAL H H 213 9.338 7.917 1.421 2 1 1707 . 1 1 A 213 213 VAL HA H 213 5.074 4.854 0.220 2 1 1715 . 1 1 A 213 213 VAL CA C 213 57.486 60.093 -2.607 2 1 1716 . 1 1 A 213 213 VAL CB C 213 33.938 35.258 -1.320 2 1 1717 . 1 1 A 213 213 VAL N N 213 124.742 119.092 5.650 2 1 1718 . 1 1 A 214 214 ILE H H 214 8.962 8.697 0.265 2 1 1719 . 1 1 A 214 214 ILE HA H 214 4.434 4.877 -0.443 2 1 1726 . 1 1 A 214 214 ILE N N 214 122.881 125.762 -2.881 2 1 1727 . 1 1 A 215 215 SER H H 215 8.558 8.570 -0.012 2 1 1728 . 1 1 A 215 215 SER HA H 215 5.001 5.529 -0.528 2 1 1731 . 1 1 A 215 215 SER CA C 215 53.230 56.779 -3.549 2 1 1732 . 1 1 A 215 215 SER CB C 215 62.077 65.952 -3.875 2 1 1733 . 1 1 A 215 215 SER N N 215 122.891 122.272 0.619 2 1 1734 . 1 1 A 216 216 GLY H H 216 7.282 9.150 -1.868 2 1 1735 . 1 1 A 216 216 GLY HA2 H 216 4.515 4.327 0.188 2 1 1736 . 1 1 A 216 216 GLY HA3 H 216 3.473 4.351 -0.878 2 1 1737 . 1 1 A 216 216 GLY CA C 216 42.816 46.019 -3.203 2 1 1738 . 1 1 A 216 216 GLY N N 216 110.899 111.841 -0.942 2 1 1739 . 1 1 A 217 217 SER H H 217 8.673 8.717 -0.044 2 1 1740 . 1 1 A 217 217 SER HA H 217 5.127 5.419 -0.292 2 1 1743 . 1 1 A 217 217 SER CA C 217 56.266 56.921 -0.655 2 1 1744 . 1 1 A 217 217 SER N N 217 117.164 115.710 1.454 2 1 1745 . 1 1 A 218 218 VAL H H 218 7.451 9.128 -1.677 2 1 1746 . 1 1 A 218 218 VAL HA H 218 5.128 4.781 0.347 2 1 1754 . 1 1 A 218 218 VAL CA C 218 56.637 60.930 -4.293 2 1 1755 . 1 1 A 218 218 VAL N N 218 117.826 122.629 -4.803 2 1 1756 . 1 1 A 219 219 LEU H H 219 9.022 8.933 0.089 2 1 1757 . 1 1 A 219 219 LEU HA H 219 5.387 5.003 0.384 2 1 1767 . 1 1 A 219 219 LEU CA C 219 50.450 53.887 -3.437 2 1 1768 . 1 1 A 219 219 LEU N N 219 124.820 126.473 -1.653 2 1 1769 . 1 1 A 220 220 TYR H H 220 8.816 8.929 -0.113 2 1 1770 . 1 1 A 220 220 TYR HA H 220 4.834 5.045 -0.211 2 1 1777 . 1 1 A 220 220 TYR N N 220 121.249 124.866 -3.617 2 1 1778 . 1 1 A 221 221 ASN H H 221 9.191 8.596 0.595 2 1 1779 . 1 1 A 221 221 ASN HA H 221 4.048 4.513 -0.465 2 1 1784 . 1 1 A 221 221 ASN CA C 221 51.647 55.035 -3.388 2 1 1785 . 1 1 A 221 221 ASN CB C 221 36.640 38.461 -1.821 2 1 1786 . 1 1 A 221 221 ASN N N 221 129.865 123.878 5.987 2 1 1788 . 1 1 A 222 222 GLN H H 222 8.468 7.196 1.272 2 1 1789 . 1 1 A 222 222 GLN HA H 222 3.671 4.206 -0.535 2 1 1794 . 1 1 A 222 222 GLN CA C 222 55.075 56.733 -1.658 2 1 1795 . 1 1 A 222 222 GLN CB C 222 24.663 29.599 -4.936 2 1 1797 . 1 1 A 222 222 GLN N N 222 108.367 117.071 -8.704 2 1 1798 . 1 1 A 223 223 ASP H H 223 7.797 7.936 -0.139 2 1 1799 . 1 1 A 223 223 ASP HA H 223 4.986 4.840 0.146 2 1 1802 . 1 1 A 223 223 ASP N N 223 120.842 118.830 2.012 2 1 1803 . 1 1 A 224 224 GLU H H 224 8.731 7.948 0.783 2 1 1804 . 1 1 A 224 224 GLU HA H 224 4.690 4.606 0.084 2 1 1809 . 1 1 A 224 224 GLU CA C 224 54.703 55.988 -1.285 2 1 1810 . 1 1 A 224 224 GLU CB C 224 26.357 31.276 -4.919 2 1 1812 . 1 1 A 224 224 GLU N N 224 124.249 119.947 4.302 2 1 1813 . 1 1 A 225 225 LYS H H 225 8.730 8.386 0.344 2 1 1814 . 1 1 A 225 225 LYS HA H 225 4.754 4.870 -0.116 2 1 1822 . 1 1 A 225 225 LYS N N 225 126.784 122.599 4.185 2 1 1823 . 1 1 A 226 226 GLY H H 226 7.683 8.965 -1.282 2 1 1824 . 1 1 A 226 226 GLY HA2 H 226 5.567 4.209 1.358 2 1 1825 . 1 1 A 226 226 GLY HA3 H 226 3.819 4.242 -0.423 2 1 1826 . 1 1 A 226 226 GLY CA C 226 42.264 44.280 -2.016 2 1 1827 . 1 1 A 226 226 GLY N N 226 107.140 111.476 -4.336 2 1 1828 . 1 1 A 227 227 SER H H 227 8.672 10.255 -1.583 2 1 1829 . 1 1 A 227 227 SER HA H 227 5.564 5.468 0.096 2 1 1832 . 1 1 A 227 227 SER CA C 227 54.373 56.776 -2.403 2 1 1833 . 1 1 A 227 227 SER CB C 227 63.963 66.407 -2.444 2 1 1834 . 1 1 A 227 227 SER N N 227 117.767 115.420 2.347 2 1 1835 . 1 1 A 228 228 TYR H H 228 9.073 9.070 0.003 2 1 1836 . 1 1 A 228 228 TYR HA H 228 5.519 5.123 0.396 2 1 1843 . 1 1 A 228 228 TYR N N 228 118.324 123.135 -4.811 2 1 1844 . 1 1 A 229 229 SER H H 229 8.929 8.212 0.717 2 1 1845 . 1 1 A 229 229 SER HA H 229 5.209 5.367 -0.158 2 1 1848 . 1 1 A 229 229 SER CA C 229 54.131 57.272 -3.141 2 1 1849 . 1 1 A 229 229 SER N N 229 116.118 120.909 -4.791 2 1 1850 . 1 1 A 230 230 LEU H H 230 9.372 9.492 -0.120 2 1 1851 . 1 1 A 230 230 LEU HA H 230 4.803 4.870 -0.067 2 1 1863 . 1 1 A 230 230 LEU N N 230 124.803 125.419 -0.616 2 1 1864 . 1 1 A 231 231 GLY H H 231 9.080 8.296 0.784 2 1 1865 . 1 1 A 231 231 GLY HA2 H 231 4.776 4.192 0.584 2 1 1866 . 1 1 A 231 231 GLY HA3 H 231 3.528 4.293 -0.765 2 1 1867 . 1 1 A 231 231 GLY CA C 231 41.468 44.424 -2.956 2 1 1868 . 1 1 A 231 231 GLY N N 231 109.611 108.603 1.008 2 1 1869 . 1 1 A 232 232 ILE H H 232 6.849 8.841 -1.992 2 1 1870 . 1 1 A 232 232 ILE HA H 232 4.742 4.587 0.155 2 1 1878 . 1 1 A 232 232 ILE N N 232 120.566 124.215 -3.649 2 1 1879 . 1 1 A 233 233 PHE H H 233 9.569 8.439 1.130 2 1 1880 . 1 1 A 233 233 PHE HA H 233 4.979 5.650 -0.671 2 1 1885 . 1 1 A 233 233 PHE N N 233 129.256 124.227 5.029 2 1 1886 . 1 1 A 234 234 GLY H H 234 8.734 8.733 0.001 2 1 1887 . 1 1 A 234 234 GLY HA2 H 234 4.488 4.263 0.225 2 1 1888 . 1 1 A 234 234 GLY HA3 H 234 3.327 4.314 -0.987 2 1 1889 . 1 1 A 234 234 GLY CA C 234 40.377 46.069 -5.692 2 1 1890 . 1 1 A 234 234 GLY N N 234 105.294 108.683 -3.389 2 1 1891 . 1 1 A 235 235 GLU H H 235 9.198 8.529 0.669 2 1 1892 . 1 1 A 235 235 GLU HA H 235 4.111 4.145 -0.034 2 1 1897 . 1 1 A 235 235 GLU CA C 235 56.466 59.131 -2.665 2 1 1898 . 1 1 A 235 235 GLU CB C 235 26.256 29.375 -3.119 2 1 1900 . 1 1 A 235 235 GLU N N 235 125.813 122.091 3.722 2 1 1901 . 1 1 A 236 236 LYS H H 236 8.147 7.763 0.384 2 1 1902 . 1 1 A 236 236 LYS HA H 236 4.373 4.547 -0.174 2 1 1905 . 1 1 A 236 236 LYS N N 236 117.810 118.444 -0.634 2 1 1906 . 1 1 A 237 237 ALA H H 237 7.685 7.734 -0.049 2 1 1907 . 1 1 A 237 237 ALA HA H 237 3.902 4.521 -0.619 2 1 1911 . 1 1 A 237 237 ALA CA C 237 49.762 51.821 -2.059 2 1 1912 . 1 1 A 237 237 ALA CB C 237 14.720 19.885 -5.165 2 1 1913 . 1 1 A 237 237 ALA N N 237 118.704 121.882 -3.178 2 1 1914 . 1 1 A 238 238 GLN H H 238 9.312 8.609 0.703 2 1 1915 . 1 1 A 238 238 GLN HA H 238 4.049 4.784 -0.735 2 1 1920 . 1 1 A 238 238 GLN N N 238 118.059 120.011 -1.952 2 1 1921 . 1 1 A 239 239 GLU H H 239 8.785 9.171 -0.386 2 1 1922 . 1 1 A 239 239 GLU HA H 239 5.531 5.003 0.528 2 1 1927 . 1 1 A 239 239 GLU N N 239 116.914 119.178 -2.264 2 1 1928 . 1 1 A 240 240 VAL H H 240 8.501 9.176 -0.675 2 1 1929 . 1 1 A 240 240 VAL HA H 240 5.655 3.960 1.695 2 1 1937 . 1 1 A 240 240 VAL CA C 240 55.582 60.073 -4.491 2 1 1940 . 1 1 A 240 240 VAL N N 240 110.588 120.764 -10.176 2 1 1941 . 1 1 A 241 241 ALA H H 241 8.463 8.513 -0.050 2 1 1942 . 1 1 A 241 241 ALA HA H 241 5.014 5.222 -0.208 2 1 1946 . 1 1 A 241 241 ALA CA C 241 49.361 51.161 -1.800 2 1 1947 . 1 1 A 241 241 ALA CB C 241 18.196 23.659 -5.463 2 1 1948 . 1 1 A 241 241 ALA N N 241 121.125 129.038 -7.913 2 1 1949 . 1 1 A 242 242 GLY H H 242 9.421 8.571 0.850 2 1 1950 . 1 1 A 242 242 GLY HA2 H 242 5.161 4.228 0.933 2 1 1951 . 1 1 A 242 242 GLY HA3 H 242 4.076 4.290 -0.214 2 1 1952 . 1 1 A 242 242 GLY N N 242 112.036 106.800 5.236 2 1 1953 . 1 1 A 243 243 SER H H 243 8.929 8.197 0.732 2 1 1954 . 1 1 A 243 243 SER HA H 243 5.331 5.226 0.105 2 1 1957 . 1 1 A 243 243 SER N N 243 116.113 115.686 0.427 2 1 1958 . 1 1 A 244 244 ALA H H 244 9.218 8.707 0.511 2 1 1959 . 1 1 A 244 244 ALA HA H 244 5.221 4.851 0.370 2 1 1963 . 1 1 A 244 244 ALA CA C 244 47.883 50.514 -2.631 2 1 1964 . 1 1 A 244 244 ALA N N 244 120.635 124.605 -3.970 2 1 1965 . 1 1 A 245 245 GLU H H 245 9.194 8.354 0.840 2 1 1966 . 1 1 A 245 245 GLU HA H 245 4.869 5.119 -0.250 2 1 1971 . 1 1 A 245 245 GLU N N 245 123.487 118.014 5.473 2 1 1972 . 1 1 A 246 246 VAL H H 246 8.531 9.164 -0.633 2 1 1973 . 1 1 A 246 246 VAL HA H 246 4.518 4.705 -0.187 2 1 1981 . 1 1 A 246 246 VAL CA C 246 58.286 61.195 -2.909 2 1 1982 . 1 1 A 246 246 VAL N N 246 123.347 123.191 0.156 2 1 1983 . 1 1 A 247 247 GLU H H 247 9.132 8.638 0.494 2 1 1984 . 1 1 A 247 247 GLU HA H 247 4.368 4.850 -0.482 2 1 1989 . 1 1 A 247 247 GLU CB C 247 26.744 32.428 -5.684 2 1 1990 . 1 1 A 247 247 GLU N N 247 129.243 126.790 2.453 2 1 1991 . 1 1 A 248 248 THR H H 248 7.827 8.343 -0.516 2 1 1992 . 1 1 A 248 248 THR HA H 248 4.749 4.652 0.097 2 1 1997 . 1 1 A 248 248 THR CA C 248 56.859 61.233 -4.374 2 1 1998 . 1 1 A 248 248 THR CB C 248 69.171 70.074 -0.903 2 1 2000 . 1 1 A 248 248 THR N N 248 114.228 119.488 -5.260 2 1 2001 . 1 1 A 249 249 ALA H H 249 9.148 8.428 0.720 2 1 2002 . 1 1 A 249 249 ALA HA H 249 4.174 4.327 -0.153 2 1 2006 . 1 1 A 249 249 ALA CA C 249 51.970 52.775 -0.805 2 1 2007 . 1 1 A 249 249 ALA CB C 249 15.797 19.458 -3.661 2 1 2008 . 1 1 A 249 249 ALA N N 249 123.341 124.866 -1.525 2 1 2009 . 1 1 A 250 250 ASN H H 250 7.974 7.793 0.181 2 1 2010 . 1 1 A 250 250 ASN HA H 250 4.953 4.913 0.040 2 1 2015 . 1 1 A 250 250 ASN CA C 250 49.198 52.557 -3.359 2 1 2016 . 1 1 A 250 250 ASN CB C 250 35.976 39.362 -3.386 2 1 2017 . 1 1 A 250 250 ASN N N 250 113.358 115.718 -2.360 2 1 2019 . 1 1 A 251 251 GLY H H 251 7.510 7.650 -0.140 2 1 2020 . 1 1 A 251 251 GLY HA2 H 251 4.492 4.100 0.392 2 1 2021 . 1 1 A 251 251 GLY HA3 H 251 3.853 4.185 -0.332 2 1 2022 . 1 1 A 251 251 GLY CA C 251 41.435 45.704 -4.269 2 1 2023 . 1 1 A 251 251 GLY N N 251 108.692 107.478 1.214 2 1 2024 . 1 1 A 252 252 ILE H H 252 8.465 8.603 -0.138 2 1 2025 . 1 1 A 252 252 ILE HA H 252 4.521 4.493 0.028 2 1 2035 . 1 1 A 252 252 ILE CB C 252 35.653 39.912 -4.259 2 1 2039 . 1 1 A 252 252 ILE N N 252 122.043 123.786 -1.743 2 1 2040 . 1 1 A 253 253 HIS H H 253 9.311 9.307 0.004 2 1 2041 . 1 1 A 253 253 HIS HA H 253 4.861 5.171 -0.310 2 1 2046 . 1 1 A 253 253 HIS N N 253 126.617 124.389 2.228 2 1 2047 . 1 1 A 254 254 HIS H H 254 8.820 8.749 0.071 2 1 2048 . 1 1 A 254 254 HIS HA H 254 5.305 5.482 -0.177 2 1 2051 . 1 1 A 254 254 HIS CA C 254 52.781 53.831 -1.050 2 1 2052 . 1 1 A 254 254 HIS N N 254 122.665 118.000 4.665 2 1 2053 . 1 1 A 255 255 ILE H H 255 9.047 8.912 0.135 2 1 2054 . 1 1 A 255 255 ILE HA H 255 4.651 4.578 0.073 2 1 2061 . 1 1 A 255 255 ILE N N 255 123.958 121.535 2.423 2 1 2062 . 1 1 A 256 256 GLY H H 256 9.339 8.487 0.852 2 1 2063 . 1 1 A 256 256 GLY HA2 H 256 3.816 3.219 0.597 2 1 2064 . 1 1 A 256 256 GLY HA3 H 256 2.267 3.749 -1.482 2 1 2065 . 1 1 A 256 256 GLY N N 256 115.022 113.140 1.882 2 1 2066 . 1 1 A 257 257 LEU H H 257 7.890 9.154 -1.264 2 1 2067 . 1 1 A 257 257 LEU HA H 257 4.853 5.034 -0.181 2 1 2077 . 1 1 A 257 257 LEU N N 257 121.441 124.059 -2.618 2 1 2078 . 1 1 A 258 258 ALA H H 258 7.982 8.996 -1.014 2 1 2079 . 1 1 A 258 258 ALA HA H 258 4.668 5.027 -0.359 2 1 2083 . 1 1 A 258 258 ALA CA C 258 49.678 51.687 -2.009 2 1 2084 . 1 1 A 258 258 ALA CB C 258 19.561 21.056 -1.495 2 1 2085 . 1 1 A 258 258 ALA N N 258 123.234 122.862 0.372 2 1 2086 . 1 1 A 259 259 ALA H H 259 9.117 8.993 0.124 2 1 2087 . 1 1 A 259 259 ALA HA H 259 4.790 4.845 -0.055 2 1 2091 . 1 1 A 259 259 ALA N N 259 123.901 124.269 -0.368 2 1 2092 . 1 1 A 260 260 LYS H H 260 8.452 8.445 0.007 2 1 2093 . 1 1 A 260 260 LYS HA H 260 5.914 4.867 1.047 2 1 2098 . 1 1 A 260 260 LYS CA C 260 51.818 54.376 -2.558 2 1 2099 . 1 1 A 260 260 LYS N N 260 116.464 116.808 -0.344 2 stop_ save_