data_15829_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15829
_Entry.PDB_ID 2K5D
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 9 . 1 1 1 A 2 2 MET HA H 2 4.554 5.072 -0.518 1
1 14 . 1 1 1 A 2 2 MET C C 2 174.749 174.070 0.679 1
1 15 . 1 1 1 A 2 2 MET CA C 2 55.354 53.967 1.387 1
1 16 . 1 1 1 A 2 2 MET CB C 2 33.729 35.454 -1.725 1
1 18 . 1 1 1 A 3 3 ARG H H 3 8.518 8.608 -0.090 1
1 19 . 1 1 1 A 3 3 ARG HA H 3 4.531 4.794 -0.263 1
1 26 . 1 1 1 A 3 3 ARG C C 3 175.780 175.091 0.689 1
1 27 . 1 1 1 A 3 3 ARG CA C 3 55.854 55.837 0.017 1
1 28 . 1 1 1 A 3 3 ARG CB C 3 31.403 31.241 0.162 1
1 31 . 1 1 1 A 3 3 ARG N N 3 124.008 122.044 1.964 1
1 32 . 1 1 1 A 4 4 LEU H H 4 8.424 9.012 -0.588 1
1 33 . 1 1 1 A 4 4 LEU HA H 4 4.457 4.864 -0.407 1
1 43 . 1 1 1 A 4 4 LEU C C 4 177.362 176.541 0.821 1
1 44 . 1 1 1 A 4 4 LEU CA C 4 54.511 53.576 0.935 1
1 45 . 1 1 1 A 4 4 LEU CB C 4 42.686 43.358 -0.672 1
1 49 . 1 1 1 A 4 4 LEU N N 4 124.389 126.586 -2.197 1
1 50 . 1 1 1 A 5 5 ALA H H 5 8.418 8.740 -0.322 1
1 51 . 1 1 1 A 5 5 ALA HA H 5 4.254 4.348 -0.094 1
1 55 . 1 1 1 A 5 5 ALA C C 5 177.420 179.280 -1.860 1
1 56 . 1 1 1 A 5 5 ALA CA C 5 52.931 52.982 -0.051 1
1 57 . 1 1 1 A 5 5 ALA CB C 5 19.263 19.238 0.025 1
1 58 . 1 1 1 A 5 5 ALA N N 5 124.548 127.654 -3.106 1
1 59 . 1 1 1 A 6 6 ASN H H 6 8.287 8.990 -0.703 1
1 60 . 1 1 1 A 6 6 ASN HA H 6 4.616 4.721 -0.105 1
1 65 . 1 1 1 A 6 6 ASN C C 6 175.837 175.095 0.742 1
1 66 . 1 1 1 A 6 6 ASN CA C 6 53.345 52.812 0.533 1
1 67 . 1 1 1 A 6 6 ASN CB C 6 38.571 38.245 0.326 1
1 69 . 1 1 1 A 6 6 ASN N N 6 116.484 119.257 -2.773 1
1 71 . 1 1 1 A 7 7 GLY H H 7 8.351 7.706 0.645 1
1 72 . 1 1 1 A 7 7 GLY HA2 H 7 4.130 4.054 0.076 1
1 73 . 1 1 1 A 7 7 GLY HA3 H 7 3.808 4.055 -0.247 1
1 74 . 1 1 1 A 7 7 GLY C C 7 173.750 172.207 1.543 1
1 75 . 1 1 1 A 7 7 GLY CA C 7 45.343 45.541 -0.198 1
1 76 . 1 1 1 A 7 7 GLY N N 7 108.453 107.477 0.976 1
1 77 . 1 1 1 A 8 8 ILE H H 8 7.868 8.426 -0.558 1
1 78 . 1 1 1 A 8 8 ILE HA H 8 4.130 4.790 -0.660 1
1 88 . 1 1 1 A 8 8 ILE C C 8 175.570 177.389 -1.819 1
1 89 . 1 1 1 A 8 8 ILE CA C 8 61.095 59.042 2.053 1
1 90 . 1 1 1 A 8 8 ILE CB C 8 38.694 40.325 -1.631 1
1 94 . 1 1 1 A 8 8 ILE N N 8 120.848 119.057 1.791 1
1 95 . 1 1 1 A 9 9 VAL H H 9 8.220 8.624 -0.404 1
1 96 . 1 1 1 A 9 9 VAL HA H 9 4.172 3.927 0.245 1
1 104 . 1 1 1 A 9 9 VAL C C 9 175.898 176.316 -0.418 1
1 105 . 1 1 1 A 9 9 VAL CA C 9 62.488 64.729 -2.241 1
1 106 . 1 1 1 A 9 9 VAL CB C 9 32.460 32.379 0.081 1
1 109 . 1 1 1 A 9 9 VAL N N 9 125.805 123.646 2.159 1
1 110 . 1 1 1 A 10 10 LEU H H 10 8.437 7.585 0.852 1
1 111 . 1 1 1 A 10 10 LEU HA H 10 4.347 4.918 -0.571 1
1 121 . 1 1 1 A 10 10 LEU C C 10 176.398 175.596 0.802 1
1 122 . 1 1 1 A 10 10 LEU CA C 10 54.787 53.115 1.672 1
1 123 . 1 1 1 A 10 10 LEU CB C 10 42.639 46.080 -3.441 1
1 127 . 1 1 1 A 10 10 LEU N N 10 127.757 117.935 9.822 1
1 128 . 1 1 1 A 11 11 ASP H H 11 8.506 8.699 -0.193 1
1 129 . 1 1 1 A 11 11 ASP HA H 11 4.683 5.445 -0.762 1
1 132 . 1 1 1 A 11 11 ASP C C 11 176.672 175.195 1.477 1
1 133 . 1 1 1 A 11 11 ASP CA C 11 53.586 52.674 0.912 1
1 134 . 1 1 1 A 11 11 ASP CB C 11 41.123 43.210 -2.087 1
1 135 . 1 1 1 A 11 11 ASP N N 11 121.539 119.057 2.482 1
1 136 . 1 1 1 A 12 12 LYS H H 12 8.578 8.961 -0.383 1
1 137 . 1 1 1 A 12 12 LYS HA H 12 3.943 4.930 -0.987 1
1 146 . 1 1 1 A 12 12 LYS C C 12 176.917 176.107 0.810 1
1 147 . 1 1 1 A 12 12 LYS CA C 12 58.542 54.504 4.038 1
1 148 . 1 1 1 A 12 12 LYS CB C 12 32.703 35.892 -3.189 1
1 152 . 1 1 1 A 12 12 LYS N N 12 123.635 119.044 4.591 1
1 153 . 1 1 1 A 13 13 ASP H H 13 8.523 8.882 -0.359 1
1 154 . 1 1 1 A 13 13 ASP HA H 13 4.566 4.633 -0.067 1
1 157 . 1 1 1 A 13 13 ASP C C 13 177.535 176.823 0.712 1
1 158 . 1 1 1 A 13 13 ASP CA C 13 56.034 53.982 2.052 1
1 159 . 1 1 1 A 13 13 ASP CB C 13 41.051 40.297 0.754 1
1 160 . 1 1 1 A 13 13 ASP N N 13 120.448 119.877 0.571 1
1 161 . 1 1 1 A 14 14 THR H H 14 7.964 8.124 -0.160 1
1 162 . 1 1 1 A 14 14 THR HA H 14 4.146 4.161 -0.015 1
1 167 . 1 1 1 A 14 14 THR C C 14 175.440 176.005 -0.565 1
1 168 . 1 1 1 A 14 14 THR CA C 14 63.245 65.103 -1.858 1
1 169 . 1 1 1 A 14 14 THR CB C 14 69.092 68.679 0.413 1
1 171 . 1 1 1 A 14 14 THR N N 14 113.711 114.115 -0.404 1
1 172 . 1 1 1 A 15 15 THR H H 15 7.921 7.780 0.141 1
1 173 . 1 1 1 A 15 15 THR HA H 15 3.920 4.314 -0.394 1
1 178 . 1 1 1 A 15 15 THR C C 15 174.750 175.638 -0.888 1
1 179 . 1 1 1 A 15 15 THR CA C 15 64.562 62.688 1.874 1
1 180 . 1 1 1 A 15 15 THR CB C 15 69.166 69.910 -0.744 1
1 182 . 1 1 1 A 15 15 THR N N 15 116.710 113.553 3.157 1
1 183 . 1 1 1 A 16 16 PHE H H 16 8.191 8.071 0.120 1
1 184 . 1 1 1 A 16 16 PHE HA H 16 4.628 4.478 0.150 1
1 192 . 1 1 1 A 16 16 PHE C C 16 177.754 174.726 3.028 1
1 193 . 1 1 1 A 16 16 PHE CA C 16 57.975 59.544 -1.569 1
1 194 . 1 1 1 A 16 16 PHE CB C 16 39.553 38.589 0.964 1
1 200 . 1 1 1 A 16 16 PHE N N 16 117.124 121.644 -4.520 1
1 201 . 1 1 1 A 17 17 GLY H H 17 8.110 8.321 -0.211 1
1 202 . 1 1 1 A 17 17 GLY HA2 H 17 4.017 4.155 -0.138 1
1 203 . 1 1 1 A 17 17 GLY HA3 H 17 3.849 4.188 -0.339 1
1 204 . 1 1 1 A 17 17 GLY C C 17 172.231 171.883 0.348 1
1 205 . 1 1 1 A 17 17 GLY CA C 17 45.633 46.274 -0.641 1
1 206 . 1 1 1 A 17 17 GLY N N 17 109.951 105.362 4.589 1
1 207 . 1 1 1 A 18 18 GLU H H 18 8.304 8.617 -0.313 1
1 208 . 1 1 1 A 18 18 GLU HA H 18 4.078 4.795 -0.717 1
1 213 . 1 1 1 A 18 18 GLU C C 18 175.588 175.586 0.002 1
1 214 . 1 1 1 A 18 18 GLU CA C 18 57.446 55.551 1.895 1
1 215 . 1 1 1 A 18 18 GLU CB C 18 30.767 30.460 0.307 1
1 217 . 1 1 1 A 18 18 GLU N N 18 121.640 123.478 -1.838 1
1 218 . 1 1 1 A 19 19 LEU H H 19 8.799 8.973 -0.174 1
1 219 . 1 1 1 A 19 19 LEU HA H 19 5.416 4.889 0.527 1
1 229 . 1 1 1 A 19 19 LEU C C 19 176.875 176.119 0.756 1
1 230 . 1 1 1 A 19 19 LEU CA C 19 53.281 54.092 -0.811 1
1 231 . 1 1 1 A 19 19 LEU CB C 19 45.508 41.836 3.672 1
1 235 . 1 1 1 A 19 19 LEU N N 19 127.101 127.147 -0.046 1
1 236 . 1 1 1 A 20 20 LYS H H 20 8.494 8.629 -0.135 1
1 237 . 1 1 1 A 20 20 LYS HA H 20 5.200 5.160 0.040 1
1 246 . 1 1 1 A 20 20 LYS C C 20 176.163 175.788 0.375 1
1 247 . 1 1 1 A 20 20 LYS CA C 20 53.575 54.432 -0.857 1
1 248 . 1 1 1 A 20 20 LYS CB C 20 36.835 35.301 1.534 1
1 252 . 1 1 1 A 20 20 LYS N N 20 118.828 124.386 -5.558 1
1 253 . 1 1 1 A 21 21 PHE H H 21 9.658 8.825 0.833 1
1 254 . 1 1 1 A 21 21 PHE HA H 21 4.038 4.535 -0.497 1
1 262 . 1 1 1 A 21 21 PHE C C 21 174.296 174.729 -0.433 1
1 263 . 1 1 1 A 21 21 PHE CA C 21 60.462 59.230 1.232 1
1 264 . 1 1 1 A 21 21 PHE CB C 21 40.359 39.716 0.643 1
1 270 . 1 1 1 A 21 21 PHE N N 21 124.322 126.111 -1.789 1
1 271 . 1 1 1 A 22 22 SER H H 22 7.199 8.192 -0.993 1
1 272 . 1 1 1 A 22 22 SER HA H 22 5.046 4.320 0.726 1
1 275 . 1 1 1 A 22 22 SER C C 22 173.080 174.069 -0.989 1
1 276 . 1 1 1 A 22 22 SER CA C 22 58.547 59.392 -0.845 1
1 277 . 1 1 1 A 22 22 SER CB C 22 63.591 64.757 -1.166 1
1 278 . 1 1 1 A 22 22 SER N N 22 120.109 119.439 0.670 1
1 279 . 1 1 1 A 23 23 ALA H H 23 7.269 6.534 0.735 1
1 280 . 1 1 1 A 23 23 ALA HA H 23 4.426 4.358 0.068 1
1 284 . 1 1 1 A 23 23 ALA C C 23 176.568 174.182 2.386 1
1 285 . 1 1 1 A 23 23 ALA CA C 23 52.458 51.240 1.218 1
1 286 . 1 1 1 A 23 23 ALA CB C 23 22.728 22.188 0.540 1
1 287 . 1 1 1 A 23 23 ALA N N 23 114.102 117.907 -3.805 1
1 288 . 1 1 1 A 24 24 LEU H H 24 8.819 8.528 0.291 1
1 289 . 1 1 1 A 24 24 LEU HA H 24 4.060 4.461 -0.401 1
1 299 . 1 1 1 A 24 24 LEU C C 24 175.363 176.357 -0.994 1
1 300 . 1 1 1 A 24 24 LEU CA C 24 56.901 53.987 2.914 1
1 301 . 1 1 1 A 24 24 LEU CB C 24 42.065 42.509 -0.444 1
1 305 . 1 1 1 A 24 24 LEU N N 24 120.865 120.394 0.471 1
1 306 . 1 1 1 A 25 25 ARG H H 25 9.473 8.501 0.972 1
1 307 . 1 1 1 A 25 25 ARG HA H 25 4.428 4.021 0.407 1
1 315 . 1 1 1 A 25 25 ARG C C 25 175.729 175.760 -0.031 1
1 316 . 1 1 1 A 25 25 ARG CA C 25 56.721 58.517 -1.796 1
1 317 . 1 1 1 A 25 25 ARG CB C 25 31.109 31.110 -0.001 1
1 320 . 1 1 1 A 25 25 ARG N N 25 130.455 127.223 3.232 1
1 322 . 1 1 1 A 26 26 ARG H H 26 7.711 7.338 0.373 1
1 323 . 1 1 1 A 26 26 ARG HA H 26 4.559 4.502 0.057 1
1 330 . 1 1 1 A 26 26 ARG C C 26 173.724 173.626 0.098 1
1 331 . 1 1 1 A 26 26 ARG CA C 26 55.737 55.822 -0.085 1
1 332 . 1 1 1 A 26 26 ARG CB C 26 33.261 33.749 -0.488 1
1 335 . 1 1 1 A 26 26 ARG N N 26 113.305 118.356 -5.051 1
1 336 . 1 1 1 A 27 27 GLU H H 27 8.848 8.563 0.285 1
1 337 . 1 1 1 A 27 27 GLU HA H 27 4.615 4.653 -0.038 1
1 342 . 1 1 1 A 27 27 GLU C C 27 174.836 176.396 -1.560 1
1 343 . 1 1 1 A 27 27 GLU CA C 27 55.901 55.445 0.456 1
1 344 . 1 1 1 A 27 27 GLU CB C 27 30.755 29.881 0.874 1
1 346 . 1 1 1 A 27 27 GLU N N 27 121.934 125.152 -3.218 1
1 347 . 1 1 1 A 28 28 VAL H H 28 8.603 8.080 0.523 1
1 348 . 1 1 1 A 28 28 VAL HA H 28 4.013 4.066 -0.053 1
1 356 . 1 1 1 A 28 28 VAL C C 28 175.561 176.041 -0.480 1
1 357 . 1 1 1 A 28 28 VAL CA C 28 62.791 62.166 0.625 1
1 358 . 1 1 1 A 28 28 VAL CB C 28 32.710 32.676 0.034 1
1 361 . 1 1 1 A 28 28 VAL N N 28 125.545 122.940 2.605 1
1 362 . 1 1 1 A 29 29 ARG H H 29 8.735 8.834 -0.099 1
1 363 . 1 1 1 A 29 29 ARG HA H 29 4.774 4.901 -0.127 1
1 370 . 1 1 1 A 29 29 ARG C C 29 176.580 175.813 0.767 1
1 371 . 1 1 1 A 29 29 ARG CA C 29 55.481 53.765 1.716 1
1 372 . 1 1 1 A 29 29 ARG CB C 29 31.963 33.611 -1.648 1
1 375 . 1 1 1 A 29 29 ARG N N 29 128.327 124.114 4.213 1
1 376 . 1 1 1 A 30 30 ILE H H 30 8.358 8.690 -0.332 1
1 377 . 1 1 1 A 30 30 ILE HA H 30 3.882 4.113 -0.231 1
1 387 . 1 1 1 A 30 30 ILE C C 30 175.093 175.375 -0.282 1
1 388 . 1 1 1 A 30 30 ILE CA C 30 61.669 60.855 0.814 1
1 389 . 1 1 1 A 30 30 ILE CB C 30 38.806 37.113 1.693 1
1 393 . 1 1 1 A 30 30 ILE N N 30 121.957 121.924 0.033 1
1 394 . 1 1 1 A 31 31 GLN H H 31 8.560 8.774 -0.214 1
1 395 . 1 1 1 A 31 31 GLN HA H 31 4.647 4.635 0.012 1
1 402 . 1 1 1 A 31 31 GLN C C 31 175.954 175.895 0.059 1
1 403 . 1 1 1 A 31 31 GLN CA C 31 54.833 55.380 -0.547 1
1 404 . 1 1 1 A 31 31 GLN CB C 31 30.584 29.695 0.889 1
1 407 . 1 1 1 A 31 31 GLN N N 31 126.348 128.242 -1.894 1
1 409 . 1 1 1 A 32 32 ASN H H 32 8.994 9.050 -0.056 1
1 410 . 1 1 1 A 32 32 ASN HA H 32 4.784 4.812 -0.028 1
1 415 . 1 1 1 A 32 32 ASN C C 32 177.296 177.115 0.181 1
1 416 . 1 1 1 A 32 32 ASN CA C 32 53.206 53.208 -0.002 1
1 417 . 1 1 1 A 32 32 ASN CB C 32 39.472 39.353 0.119 1
1 419 . 1 1 1 A 32 32 ASN N N 32 122.834 124.318 -1.484 1
1 421 . 1 1 1 A 33 33 GLU H H 33 9.180 8.913 0.267 1
1 422 . 1 1 1 A 33 33 GLU HA H 33 4.063 4.007 0.056 1
1 427 . 1 1 1 A 33 33 GLU C C 33 176.787 178.084 -1.297 1
1 428 . 1 1 1 A 33 33 GLU CA C 33 59.347 59.492 -0.145 1
1 429 . 1 1 1 A 33 33 GLU CB C 33 29.294 29.321 -0.027 1
1 431 . 1 1 1 A 33 33 GLU N N 33 122.736 122.125 0.611 1
1 432 . 1 1 1 A 34 34 ASP H H 34 7.969 8.025 -0.056 1
1 433 . 1 1 1 A 34 34 ASP HA H 34 4.499 4.509 -0.010 1
1 436 . 1 1 1 A 34 34 ASP C C 34 177.111 176.171 0.940 1
1 437 . 1 1 1 A 34 34 ASP CA C 34 53.632 54.819 -1.187 1
1 438 . 1 1 1 A 34 34 ASP CB C 34 39.807 41.319 -1.512 1
1 439 . 1 1 1 A 34 34 ASP N N 34 115.921 117.573 -1.652 1
1 440 . 1 1 1 A 35 35 GLY H H 35 8.083 7.785 0.298 1
1 441 . 1 1 1 A 35 35 GLY HA2 H 35 4.366 4.013 0.353 1
1 442 . 1 1 1 A 35 35 GLY HA3 H 35 3.657 4.013 -0.356 1
1 443 . 1 1 1 A 35 35 GLY C C 35 174.584 174.815 -0.231 1
1 444 . 1 1 1 A 35 35 GLY CA C 35 45.134 45.437 -0.303 1
1 445 . 1 1 1 A 35 35 GLY N N 35 108.874 107.086 1.788 1
1 446 . 1 1 1 A 36 36 SER H H 36 8.274 8.031 0.243 1
1 447 . 1 1 1 A 36 36 SER HA H 36 4.389 4.465 -0.076 1
1 450 . 1 1 1 A 36 36 SER C C 36 173.284 173.690 -0.406 1
1 451 . 1 1 1 A 36 36 SER CA C 36 58.383 59.520 -1.137 1
1 452 . 1 1 1 A 36 36 SER CB C 36 64.576 64.072 0.504 1
1 453 . 1 1 1 A 36 36 SER N N 36 117.428 117.149 0.279 1
1 454 . 1 1 1 A 37 37 VAL H H 37 8.508 8.624 -0.116 1
1 455 . 1 1 1 A 37 37 VAL HA H 37 4.346 4.488 -0.142 1
1 463 . 1 1 1 A 37 37 VAL C C 37 176.370 175.698 0.672 1
1 464 . 1 1 1 A 37 37 VAL CA C 37 62.410 61.616 0.794 1
1 465 . 1 1 1 A 37 37 VAL CB C 37 33.086 32.775 0.311 1
1 468 . 1 1 1 A 37 37 VAL N N 37 119.189 125.337 -6.148 1
1 469 . 1 1 1 A 38 38 SER H H 38 8.461 8.937 -0.476 1
1 470 . 1 1 1 A 38 38 SER HA H 38 4.586 4.688 -0.102 1
1 473 . 1 1 1 A 38 38 SER C C 38 173.829 175.468 -1.639 1
1 474 . 1 1 1 A 38 38 SER CA C 38 57.618 57.520 0.098 1
1 475 . 1 1 1 A 38 38 SER CB C 38 64.537 64.691 -0.154 1
1 476 . 1 1 1 A 38 38 SER N N 38 121.629 120.229 1.400 1
1 477 . 1 1 1 A 39 39 ASP H H 39 8.512 8.651 -0.139 1
1 478 . 1 1 1 A 39 39 ASP HA H 39 4.606 4.604 0.002 1
1 481 . 1 1 1 A 39 39 ASP C C 39 176.557 176.372 0.185 1
1 482 . 1 1 1 A 39 39 ASP CA C 39 54.833 54.133 0.700 1
1 483 . 1 1 1 A 39 39 ASP CB C 39 41.123 40.978 0.145 1
1 484 . 1 1 1 A 39 39 ASP N N 39 120.305 123.690 -3.385 1
1 485 . 1 1 1 A 40 40 GLU H H 40 8.311 7.533 0.778 1
1 486 . 1 1 1 A 40 40 GLU HA H 40 4.235 4.385 -0.150 1
1 491 . 1 1 1 A 40 40 GLU C C 40 175.327 175.904 -0.577 1
1 492 . 1 1 1 A 40 40 GLU CA C 40 56.215 56.598 -0.383 1
1 493 . 1 1 1 A 40 40 GLU CB C 40 30.788 29.863 0.925 1
1 495 . 1 1 1 A 40 40 GLU N N 40 120.680 119.974 0.706 1
1 496 . 1 1 1 A 41 41 ILE H H 41 8.465 8.868 -0.403 1
1 497 . 1 1 1 A 41 41 ILE HA H 41 4.127 4.283 -0.156 1
1 507 . 1 1 1 A 41 41 ILE C C 41 175.380 175.840 -0.460 1
1 508 . 1 1 1 A 41 41 ILE CA C 41 60.670 60.840 -0.170 1
1 509 . 1 1 1 A 41 41 ILE CB C 41 38.805 38.251 0.554 1
1 513 . 1 1 1 A 41 41 ILE N N 41 123.665 124.243 -0.578 1
1 514 . 1 1 1 A 42 42 LYS H H 42 9.556 9.426 0.130 1
1 515 . 1 1 1 A 42 42 LYS HA H 42 4.428 4.511 -0.083 1
1 524 . 1 1 1 A 42 42 LYS C C 42 177.277 175.250 2.027 1
1 525 . 1 1 1 A 42 42 LYS CA C 42 57.274 57.459 -0.185 1
1 526 . 1 1 1 A 42 42 LYS CB C 42 35.169 35.279 -0.110 1
1 530 . 1 1 1 A 42 42 LYS N N 42 125.597 126.864 -1.267 1
1 531 . 1 1 1 A 43 43 GLU H H 43 7.809 7.597 0.212 1
1 532 . 1 1 1 A 43 43 GLU HA H 43 4.886 4.992 -0.106 1
1 537 . 1 1 1 A 43 43 GLU C C 43 173.593 174.624 -1.031 1
1 538 . 1 1 1 A 43 43 GLU CA C 43 54.669 54.834 -0.165 1
1 539 . 1 1 1 A 43 43 GLU CB C 43 32.882 34.661 -1.779 1
1 541 . 1 1 1 A 43 43 GLU N N 43 115.292 116.030 -0.738 1
1 542 . 1 1 1 A 44 44 ARG H H 44 8.879 8.787 0.092 1
1 543 . 1 1 1 A 44 44 ARG HA H 44 4.917 4.912 0.005 1
1 551 . 1 1 1 A 44 44 ARG C C 44 173.708 175.161 -1.453 1
1 552 . 1 1 1 A 44 44 ARG CA C 44 55.965 54.613 1.352 1
1 553 . 1 1 1 A 44 44 ARG CB C 44 33.579 32.080 1.499 1
1 556 . 1 1 1 A 44 44 ARG N N 44 118.233 121.693 -3.460 1
1 558 . 1 1 1 A 45 45 THR H H 45 8.892 9.073 -0.181 1
1 559 . 1 1 1 A 45 45 THR HA H 45 5.308 4.955 0.353 1
1 564 . 1 1 1 A 45 45 THR C C 45 173.357 173.365 -0.008 1
1 565 . 1 1 1 A 45 45 THR CA C 45 60.939 62.246 -1.307 1
1 566 . 1 1 1 A 45 45 THR CB C 45 70.054 69.489 0.565 1
1 568 . 1 1 1 A 45 45 THR N N 45 118.457 120.284 -1.827 1
1 569 . 1 1 1 A 46 46 TYR H H 46 9.625 9.637 -0.012 1
1 570 . 1 1 1 A 46 46 TYR HA H 46 4.771 5.154 -0.383 1
1 578 . 1 1 1 A 46 46 TYR C C 46 173.735 174.975 -1.240 1
1 579 . 1 1 1 A 46 46 TYR CA C 46 57.480 56.093 1.387 1
1 580 . 1 1 1 A 46 46 TYR CB C 46 41.724 41.326 0.398 1
1 585 . 1 1 1 A 46 46 TYR N N 46 125.916 126.396 -0.480 1
1 586 . 1 1 1 A 47 47 ASP H H 47 9.006 9.138 -0.132 1
1 587 . 1 1 1 A 47 47 ASP HA H 47 5.399 4.953 0.446 1
1 590 . 1 1 1 A 47 47 ASP C C 47 175.094 174.899 0.195 1
1 591 . 1 1 1 A 47 47 ASP CA C 47 53.460 53.712 -0.252 1
1 592 . 1 1 1 A 47 47 ASP CB C 47 41.947 41.574 0.373 1
1 593 . 1 1 1 A 47 47 ASP N N 47 122.109 123.002 -0.893 1
1 594 . 1 1 1 A 48 48 LEU H H 48 9.066 8.386 0.680 1
1 595 . 1 1 1 A 48 48 LEU HA H 48 4.831 4.948 -0.117 1
1 605 . 1 1 1 A 48 48 LEU C C 48 174.977 176.170 -1.193 1
1 606 . 1 1 1 A 48 48 LEU CA C 48 52.724 53.108 -0.384 1
1 607 . 1 1 1 A 48 48 LEU CB C 48 44.844 45.171 -0.327 1
1 611 . 1 1 1 A 48 48 LEU N N 48 121.879 125.105 -3.226 1
1 612 . 1 1 1 A 49 49 LYS H H 49 9.401 8.450 0.951 1
1 613 . 1 1 1 A 49 49 LYS HA H 49 4.477 4.840 -0.363 1
1 622 . 1 1 1 A 49 49 LYS C C 49 176.225 175.512 0.713 1
1 623 . 1 1 1 A 49 49 LYS CA C 49 56.017 55.367 0.650 1
1 624 . 1 1 1 A 49 49 LYS CB C 49 33.838 33.885 -0.047 1
1 628 . 1 1 1 A 49 49 LYS N N 49 122.218 123.459 -1.241 1
1 629 . 1 1 1 A 50 50 SER H H 50 8.266 8.906 -0.640 1
1 630 . 1 1 1 A 50 50 SER HA H 50 5.222 5.765 -0.543 1
1 633 . 1 1 1 A 50 50 SER C C 50 175.570 173.313 2.257 1
1 634 . 1 1 1 A 50 50 SER CA C 50 55.770 56.465 -0.695 1
1 635 . 1 1 1 A 50 50 SER CB C 50 64.738 66.132 -1.394 1
1 636 . 1 1 1 A 50 50 SER N N 50 117.388 117.718 -0.330 1
1 637 . 1 1 1 A 51 51 LYS H H 51 9.276 8.546 0.730 1
1 638 . 1 1 1 A 51 51 LYS HA H 51 4.208 4.511 -0.303 1
1 647 . 1 1 1 A 51 51 LYS C C 51 178.773 176.756 2.017 1
1 648 . 1 1 1 A 51 51 LYS CA C 51 58.674 56.903 1.771 1
1 649 . 1 1 1 A 51 51 LYS CB C 51 33.383 32.062 1.321 1
1 653 . 1 1 1 A 51 51 LYS N N 51 130.550 123.705 6.845 1
1 654 . 1 1 1 A 52 52 GLY H H 52 8.320 8.364 -0.044 1
1 655 . 1 1 1 A 52 52 GLY HA2 H 52 3.875 4.211 -0.336 1
1 656 . 1 1 1 A 52 52 GLY HA3 H 52 3.628 4.232 -0.604 1
1 657 . 1 1 1 A 52 52 GLY C C 52 175.108 174.204 0.904 1
1 658 . 1 1 1 A 52 52 GLY CA C 52 46.322 46.163 0.159 1
1 659 . 1 1 1 A 52 52 GLY N N 52 107.053 110.987 -3.934 1
1 660 . 1 1 1 A 53 53 GLN H H 53 7.859 8.759 -0.900 1
1 661 . 1 1 1 A 53 53 GLN HA H 53 4.409 4.408 0.001 1
1 668 . 1 1 1 A 53 53 GLN C C 53 176.469 176.287 0.182 1
1 669 . 1 1 1 A 53 53 GLN CA C 53 54.911 55.383 -0.472 1
1 670 . 1 1 1 A 53 53 GLN CB C 53 29.675 29.438 0.237 1
1 673 . 1 1 1 A 53 53 GLN N N 53 115.482 124.854 -9.372 1
1 675 . 1 1 1 A 54 54 GLY H H 54 7.992 8.213 -0.221 1
1 676 . 1 1 1 A 54 54 GLY HA2 H 54 3.934 3.953 -0.019 1
1 677 . 1 1 1 A 54 54 GLY HA3 H 54 3.934 3.964 -0.030 1
1 678 . 1 1 1 A 54 54 GLY C C 54 173.897 174.296 -0.399 1
1 679 . 1 1 1 A 54 54 GLY CA C 54 46.574 46.275 0.299 1
1 680 . 1 1 1 A 54 54 GLY N N 54 110.111 108.800 1.311 1
1 681 . 1 1 1 A 55 55 ARG H H 55 7.652 7.934 -0.282 1
1 682 . 1 1 1 A 55 55 ARG HA H 55 4.665 4.688 -0.023 1
1 690 . 1 1 1 A 55 55 ARG C C 55 174.649 176.216 -1.567 1
1 691 . 1 1 1 A 55 55 ARG CA C 55 54.631 54.665 -0.034 1
1 692 . 1 1 1 A 55 55 ARG CB C 55 32.166 32.766 -0.600 1
1 695 . 1 1 1 A 55 55 ARG N N 55 114.214 119.404 -5.190 1
1 697 . 1 1 1 A 56 56 MET H H 56 8.593 8.809 -0.216 1
1 698 . 1 1 1 A 56 56 MET HA H 56 5.012 4.588 0.424 1
1 703 . 1 1 1 A 56 56 MET C C 56 176.216 176.109 0.107 1
1 704 . 1 1 1 A 56 56 MET CA C 56 54.595 55.056 -0.461 1
1 705 . 1 1 1 A 56 56 MET CB C 56 33.466 32.526 0.940 1
1 707 . 1 1 1 A 56 56 MET N N 56 121.270 122.673 -1.403 1
1 708 . 1 1 1 A 57 57 ILE H H 57 9.393 8.491 0.902 1
1 709 . 1 1 1 A 57 57 ILE HA H 57 4.717 4.368 0.349 1
1 719 . 1 1 1 A 57 57 ILE C C 57 173.883 174.976 -1.093 1
1 720 . 1 1 1 A 57 57 ILE CA C 57 59.713 59.600 0.113 1
1 721 . 1 1 1 A 57 57 ILE CB C 57 40.933 38.859 2.074 1
1 725 . 1 1 1 A 57 57 ILE N N 57 120.811 120.479 0.332 1
1 726 . 1 1 1 A 58 58 GLN H H 58 8.218 7.829 0.389 1
1 727 . 1 1 1 A 58 58 GLN HA H 58 5.407 4.628 0.779 1
1 734 . 1 1 1 A 58 58 GLN C C 58 175.368 174.510 0.858 1
1 735 . 1 1 1 A 58 58 GLN CA C 58 55.163 55.238 -0.075 1
1 736 . 1 1 1 A 58 58 GLN CB C 58 30.841 29.106 1.735 1
1 739 . 1 1 1 A 58 58 GLN N N 58 122.281 122.869 -0.588 1
1 741 . 1 1 1 A 59 59 VAL H H 59 9.188 8.542 0.646 1
1 742 . 1 1 1 A 59 59 VAL HA H 59 5.025 5.049 -0.024 1
1 750 . 1 1 1 A 59 59 VAL C C 59 175.330 174.650 0.680 1
1 751 . 1 1 1 A 59 59 VAL CA C 59 59.975 61.217 -1.242 1
1 752 . 1 1 1 A 59 59 VAL CB C 59 34.818 32.958 1.860 1
1 755 . 1 1 1 A 59 59 VAL N N 59 122.421 126.684 -4.263 1
1 756 . 1 1 1 A 60 60 SER H H 60 9.022 9.116 -0.094 1
1 757 . 1 1 1 A 60 60 SER HA H 60 5.811 5.629 0.182 1
1 760 . 1 1 1 A 60 60 SER C C 60 173.234 173.405 -0.171 1
1 761 . 1 1 1 A 60 60 SER CA C 60 57.634 56.670 0.964 1
1 762 . 1 1 1 A 60 60 SER CB C 60 64.891 64.641 0.250 1
1 763 . 1 1 1 A 60 60 SER N N 60 124.709 122.710 1.999 1
1 764 . 1 1 1 A 61 61 ILE H H 61 9.226 8.899 0.327 1
1 765 . 1 1 1 A 61 61 ILE HA H 61 5.572 4.887 0.685 1
1 775 . 1 1 1 A 61 61 ILE C C 61 173.955 173.991 -0.036 1
1 776 . 1 1 1 A 61 61 ILE CA C 61 56.937 57.146 -0.209 1
1 777 . 1 1 1 A 61 61 ILE CB C 61 39.596 40.028 -0.432 1
1 781 . 1 1 1 A 61 61 ILE N N 61 121.648 123.098 -1.450 1
1 782 . 1 1 1 A 62 62 PRO HA H 62 4.606 4.544 0.062 1
1 789 . 1 1 1 A 62 62 PRO C C 62 178.143 177.353 0.790 1
1 790 . 1 1 1 A 62 62 PRO CA C 62 63.740 62.704 1.036 1
1 791 . 1 1 1 A 62 62 PRO CB C 62 33.303 32.666 0.637 1
1 794 . 1 1 1 A 63 63 ALA H H 63 7.803 8.980 -1.177 1
1 795 . 1 1 1 A 63 63 ALA HA H 63 4.037 4.111 -0.074 1
1 799 . 1 1 1 A 63 63 ALA C C 63 175.942 179.853 -3.911 1
1 800 . 1 1 1 A 63 63 ALA CA C 63 54.417 55.141 -0.724 1
1 801 . 1 1 1 A 63 63 ALA CB C 63 19.345 17.746 1.599 1
1 802 . 1 1 1 A 63 63 ALA N N 63 123.695 126.747 -3.052 1
1 803 . 1 1 1 A 64 64 SER H H 64 7.719 8.114 -0.395 1
1 804 . 1 1 1 A 64 64 SER HA H 64 4.097 4.385 -0.288 1
1 807 . 1 1 1 A 64 64 SER C C 64 175.199 174.815 0.384 1
1 808 . 1 1 1 A 64 64 SER CA C 64 59.474 61.111 -1.637 1
1 809 . 1 1 1 A 64 64 SER CB C 64 62.125 63.205 -1.080 1
1 810 . 1 1 1 A 64 64 SER N N 64 110.001 112.063 -2.062 1
1 811 . 1 1 1 A 65 65 VAL H H 65 7.790 7.751 0.039 1
1 812 . 1 1 1 A 65 65 VAL HA H 65 4.360 4.239 0.121 1
1 820 . 1 1 1 A 65 65 VAL C C 65 174.433 174.630 -0.197 1
1 821 . 1 1 1 A 65 65 VAL CA C 65 60.335 59.598 0.737 1
1 822 . 1 1 1 A 65 65 VAL CB C 65 32.714 32.133 0.581 1
1 825 . 1 1 1 A 65 65 VAL N N 65 126.142 120.971 5.171 1
1 826 . 1 1 1 A 66 66 PRO HA H 66 4.369 4.588 -0.219 1
1 833 . 1 1 1 A 66 66 PRO C C 66 177.412 176.342 1.070 1
1 834 . 1 1 1 A 66 66 PRO CA C 66 63.104 62.437 0.667 1
1 835 . 1 1 1 A 66 66 PRO CB C 66 32.558 32.322 0.236 1
1 838 . 1 1 1 A 67 67 LEU H H 67 8.578 8.294 0.284 1
1 839 . 1 1 1 A 67 67 LEU HA H 67 3.875 4.650 -0.775 1
1 849 . 1 1 1 A 67 67 LEU C C 67 176.077 175.158 0.919 1
1 850 . 1 1 1 A 67 67 LEU CA C 67 56.413 55.465 0.948 1
1 851 . 1 1 1 A 67 67 LEU CB C 67 43.279 42.925 0.354 1
1 855 . 1 1 1 A 67 67 LEU N N 67 124.236 122.789 1.447 1
1 856 . 1 1 1 A 68 68 LYS H H 68 7.994 8.698 -0.704 1
1 857 . 1 1 1 A 68 68 LYS HA H 68 3.793 4.409 -0.616 1
1 866 . 1 1 1 A 68 68 LYS C C 68 175.601 175.101 0.500 1
1 867 . 1 1 1 A 68 68 LYS CA C 68 53.350 54.779 -1.429 1
1 868 . 1 1 1 A 68 68 LYS CB C 68 31.035 32.778 -1.743 1
1 872 . 1 1 1 A 68 68 LYS N N 68 124.053 126.090 -2.037 1
1 873 . 1 1 1 A 69 69 GLU H H 69 8.347 8.525 -0.178 1
1 874 . 1 1 1 A 69 69 GLU HA H 69 4.501 4.264 0.237 1
1 879 . 1 1 1 A 69 69 GLU C C 69 175.304 174.849 0.455 1
1 880 . 1 1 1 A 69 69 GLU CA C 69 54.291 55.738 -1.447 1
1 881 . 1 1 1 A 69 69 GLU CB C 69 29.285 28.067 1.218 1
1 883 . 1 1 1 A 69 69 GLU N N 69 123.876 124.623 -0.747 1
1 884 . 1 1 1 A 70 70 PHE H H 70 5.549 8.007 -2.458 1
1 885 . 1 1 1 A 70 70 PHE HA H 70 4.592 4.662 -0.070 1
1 893 . 1 1 1 A 70 70 PHE C C 70 174.443 175.215 -0.772 1
1 894 . 1 1 1 A 70 70 PHE CA C 70 53.313 57.509 -4.196 1
1 895 . 1 1 1 A 70 70 PHE CB C 70 38.335 40.874 -2.539 1
1 901 . 1 1 1 A 70 70 PHE N N 70 117.781 124.032 -6.251 1
1 902 . 1 1 1 A 71 71 ASP H H 71 8.791 8.516 0.275 1
1 903 . 1 1 1 A 71 71 ASP HA H 71 4.535 4.759 -0.224 1
1 906 . 1 1 1 A 71 71 ASP C C 71 175.867 175.729 0.138 1
1 907 . 1 1 1 A 71 71 ASP CA C 71 54.248 52.723 1.525 1
1 908 . 1 1 1 A 71 71 ASP CB C 71 41.166 41.852 -0.686 1
1 909 . 1 1 1 A 71 71 ASP N N 71 120.385 120.739 -0.354 1
1 910 . 1 1 1 A 72 72 TYR H H 72 8.701 8.694 0.007 1
1 911 . 1 1 1 A 72 72 TYR HA H 72 4.283 4.659 -0.376 1
1 918 . 1 1 1 A 72 72 TYR C C 72 177.470 176.486 0.984 1
1 919 . 1 1 1 A 72 72 TYR CA C 72 60.513 59.950 0.563 1
1 920 . 1 1 1 A 72 72 TYR CB C 72 38.320 38.480 -0.160 1
1 925 . 1 1 1 A 72 72 TYR N N 72 121.876 121.528 0.348 1
1 926 . 1 1 1 A 73 73 ASN H H 73 8.819 8.999 -0.180 1
1 927 . 1 1 1 A 73 73 ASN HA H 73 4.096 4.163 -0.067 1
1 932 . 1 1 1 A 73 73 ASN C C 73 174.362 174.579 -0.217 1
1 933 . 1 1 1 A 73 73 ASN CA C 73 54.289 54.417 -0.128 1
1 934 . 1 1 1 A 73 73 ASN CB C 73 36.907 36.997 -0.090 1
1 936 . 1 1 1 A 73 73 ASN N N 73 121.726 119.567 2.159 1
1 938 . 1 1 1 A 74 74 ALA H H 74 8.059 7.524 0.535 1
1 939 . 1 1 1 A 74 74 ALA HA H 74 4.100 4.234 -0.134 1
1 943 . 1 1 1 A 74 74 ALA C C 74 177.757 177.259 0.498 1
1 944 . 1 1 1 A 74 74 ALA CA C 74 53.153 52.938 0.215 1
1 945 . 1 1 1 A 74 74 ALA CB C 74 19.412 19.341 0.071 1
1 946 . 1 1 1 A 74 74 ALA N N 74 122.292 121.208 1.084 1
1 947 . 1 1 1 A 75 75 ARG H H 75 8.500 8.465 0.035 1
1 948 . 1 1 1 A 75 75 ARG HA H 75 4.758 4.718 0.040 1
1 955 . 1 1 1 A 75 75 ARG C C 75 176.812 176.021 0.791 1
1 956 . 1 1 1 A 75 75 ARG CA C 75 56.646 56.114 0.532 1
1 957 . 1 1 1 A 75 75 ARG CB C 75 29.375 30.557 -1.182 1
1 960 . 1 1 1 A 75 75 ARG N N 75 122.871 123.096 -0.225 1
1 961 . 1 1 1 A 76 76 VAL H H 76 7.965 9.128 -1.163 1
1 962 . 1 1 1 A 76 76 VAL HA H 76 5.230 4.970 0.260 1
1 970 . 1 1 1 A 76 76 VAL C C 76 173.758 174.329 -0.571 1
1 971 . 1 1 1 A 76 76 VAL CA C 76 58.193 58.467 -0.274 1
1 972 . 1 1 1 A 76 76 VAL CB C 76 36.536 35.521 1.015 1
1 975 . 1 1 1 A 76 76 VAL N N 76 116.220 118.121 -1.901 1
1 976 . 1 1 1 A 77 77 GLU H H 77 9.166 9.179 -0.013 1
1 977 . 1 1 1 A 77 77 GLU HA H 77 4.663 4.999 -0.336 1
1 982 . 1 1 1 A 77 77 GLU C C 77 174.940 174.457 0.483 1
1 983 . 1 1 1 A 77 77 GLU CA C 77 53.546 54.494 -0.948 1
1 984 . 1 1 1 A 77 77 GLU CB C 77 33.395 33.489 -0.094 1
1 986 . 1 1 1 A 77 77 GLU N N 77 116.413 120.466 -4.053 1
1 987 . 1 1 1 A 78 78 LEU H H 78 8.670 8.795 -0.125 1
1 988 . 1 1 1 A 78 78 LEU HA H 78 4.677 4.738 -0.061 1
1 998 . 1 1 1 A 78 78 LEU C C 78 176.036 176.732 -0.696 1
1 999 . 1 1 1 A 78 78 LEU CA C 78 53.091 53.750 -0.659 1
1 1000 . 1 1 1 A 78 78 LEU CB C 78 43.276 42.994 0.282 1
1 1004 . 1 1 1 A 78 78 LEU N N 78 117.927 124.322 -6.395 1
1 1005 . 1 1 1 A 79 79 ILE H H 79 7.900 8.397 -0.497 1
1 1006 . 1 1 1 A 79 79 ILE HA H 79 4.312 3.916 0.396 1
1 1016 . 1 1 1 A 79 79 ILE C C 79 175.179 176.519 -1.340 1
1 1017 . 1 1 1 A 79 79 ILE CA C 79 58.294 64.819 -6.525 1
1 1018 . 1 1 1 A 79 79 ILE CB C 79 36.086 38.268 -2.182 1
1 1022 . 1 1 1 A 79 79 ILE N N 79 121.667 123.699 -2.032 1
1 1023 . 1 1 1 A 80 80 ASN H H 80 9.412 8.311 1.101 1
1 1024 . 1 1 1 A 80 80 ASN HA H 80 4.516 5.195 -0.679 1
1 1029 . 1 1 1 A 80 80 ASN C C 80 170.300 172.330 -2.030 1
1 1030 . 1 1 1 A 80 80 ASN CA C 80 54.198 50.536 3.662 1
1 1031 . 1 1 1 A 80 80 ASN CB C 80 37.450 39.123 -1.673 1
1 1033 . 1 1 1 A 80 80 ASN N N 80 123.831 119.025 4.806 1
1 1035 . 1 1 1 A 81 81 PRO HA H 81 5.185 4.858 0.327 1
1 1042 . 1 1 1 A 81 81 PRO C C 81 176.865 176.527 0.338 1
1 1043 . 1 1 1 A 81 81 PRO CA C 81 62.637 62.207 0.430 1
1 1044 . 1 1 1 A 81 81 PRO CB C 81 32.965 32.062 0.903 1
1 1047 . 1 1 1 A 82 82 ILE H H 82 9.374 8.510 0.864 1
1 1048 . 1 1 1 A 82 82 ILE HA H 82 4.524 5.058 -0.534 1
1 1058 . 1 1 1 A 82 82 ILE C C 82 174.731 174.314 0.417 1
1 1059 . 1 1 1 A 82 82 ILE CA C 82 60.205 58.643 1.562 1
1 1060 . 1 1 1 A 82 82 ILE CB C 82 41.737 41.223 0.514 1
1 1064 . 1 1 1 A 82 82 ILE N N 82 121.658 117.833 3.825 1
1 1065 . 1 1 1 A 83 83 ALA H H 83 8.819 8.908 -0.089 1
1 1066 . 1 1 1 A 83 83 ALA HA H 83 4.773 4.905 -0.132 1
1 1070 . 1 1 1 A 83 83 ALA C C 83 176.550 177.067 -0.517 1
1 1071 . 1 1 1 A 83 83 ALA CA C 83 52.069 51.738 0.331 1
1 1072 . 1 1 1 A 83 83 ALA CB C 83 20.374 19.673 0.701 1
1 1073 . 1 1 1 A 83 83 ALA N N 83 127.933 129.105 -1.172 1
1 1074 . 1 1 1 A 84 84 ASP H H 84 8.710 8.518 0.192 1
1 1075 . 1 1 1 A 84 84 ASP HA H 84 4.894 5.041 -0.147 1
1 1078 . 1 1 1 A 84 84 ASP C C 84 175.997 175.969 0.028 1
1 1079 . 1 1 1 A 84 84 ASP CA C 84 53.334 52.692 0.642 1
1 1080 . 1 1 1 A 84 84 ASP CB C 84 42.104 41.427 0.677 1
1 1081 . 1 1 1 A 84 84 ASP N N 84 122.009 125.122 -3.113 1
1 1082 . 1 1 1 A 85 85 THR H H 85 8.349 8.527 -0.178 1
1 1083 . 1 1 1 A 85 85 THR HA H 85 4.420 4.822 -0.402 1
1 1088 . 1 1 1 A 85 85 THR C C 85 175.085 175.008 0.077 1
1 1089 . 1 1 1 A 85 85 THR CA C 85 62.304 61.392 0.912 1
1 1090 . 1 1 1 A 85 85 THR CB C 85 69.718 69.723 -0.005 1
1 1092 . 1 1 1 A 85 85 THR N N 85 114.986 112.552 2.434 1
1 1093 . 1 1 1 A 86 86 VAL H H 86 8.188 7.959 0.229 1
1 1094 . 1 1 1 A 86 86 VAL HA H 86 4.021 3.868 0.153 1
1 1102 . 1 1 1 A 86 86 VAL C C 86 176.519 178.024 -1.505 1
1 1103 . 1 1 1 A 86 86 VAL CA C 86 63.046 64.625 -1.579 1
1 1104 . 1 1 1 A 86 86 VAL CB C 86 32.526 31.510 1.016 1
1 1107 . 1 1 1 A 86 86 VAL N N 86 122.275 121.176 1.099 1
1 1108 . 1 1 1 A 87 87 ALA H H 87 8.194 8.234 -0.040 1
1 1109 . 1 1 1 A 87 87 ALA HA H 87 4.212 4.044 0.168 1
1 1113 . 1 1 1 A 87 87 ALA C C 87 178.118 179.603 -1.485 1
1 1114 . 1 1 1 A 87 87 ALA CA C 87 53.153 55.210 -2.057 1
1 1115 . 1 1 1 A 87 87 ALA CB C 87 19.165 18.226 0.939 1
1 1116 . 1 1 1 A 87 87 ALA N N 87 126.609 124.687 1.922 1
1 1117 . 1 1 1 A 88 88 THR H H 88 7.914 8.119 -0.205 1
1 1118 . 1 1 1 A 88 88 THR HA H 88 4.173 4.331 -0.158 1
1 1123 . 1 1 1 A 88 88 THR C C 88 174.516 176.139 -1.623 1
1 1124 . 1 1 1 A 88 88 THR CA C 88 62.785 64.706 -1.921 1
1 1125 . 1 1 1 A 88 88 THR CB C 88 69.582 68.541 1.041 1
1 1127 . 1 1 1 A 88 88 THR N N 88 112.328 111.506 0.822 1
1 1128 . 1 1 1 A 89 89 ALA H H 89 8.076 7.696 0.380 1
1 1129 . 1 1 1 A 89 89 ALA HA H 89 4.320 4.224 0.096 1
1 1133 . 1 1 1 A 89 89 ALA C C 89 178.014 178.423 -0.409 1
1 1134 . 1 1 1 A 89 89 ALA CA C 89 53.079 53.936 -0.857 1
1 1135 . 1 1 1 A 89 89 ALA CB C 89 19.335 18.766 0.569 1
1 1136 . 1 1 1 A 89 89 ALA N N 89 124.632 124.734 -0.102 1
1 1137 . 1 1 1 A 90 90 THR H H 90 7.976 7.689 0.287 1
1 1138 . 1 1 1 A 90 90 THR HA H 90 4.203 4.415 -0.212 1
1 1143 . 1 1 1 A 90 90 THR C C 90 174.427 173.933 0.494 1
1 1144 . 1 1 1 A 90 90 THR CA C 90 62.519 63.078 -0.559 1
1 1145 . 1 1 1 A 90 90 THR CB C 90 69.721 70.189 -0.468 1
1 1147 . 1 1 1 A 90 90 THR N N 90 112.047 111.641 0.406 1
1 1148 . 1 1 1 A 91 91 TYR H H 91 7.959 7.774 0.185 1
1 1149 . 1 1 1 A 91 91 TYR HA H 91 4.564 5.026 -0.462 1
1 1156 . 1 1 1 A 91 91 TYR C C 91 175.522 175.241 0.281 1
1 1157 . 1 1 1 A 91 91 TYR CA C 91 57.874 57.197 0.677 1
1 1158 . 1 1 1 A 91 91 TYR CB C 91 38.584 40.881 -2.297 1
1 1163 . 1 1 1 A 91 91 TYR N N 91 121.184 119.332 1.852 1
1 1164 . 1 1 1 A 92 92 GLN H H 92 8.310 8.854 -0.544 1
1 1165 . 1 1 1 A 92 92 GLN HA H 92 4.258 4.749 -0.491 1
1 1172 . 1 1 1 A 92 92 GLN C C 92 176.099 175.503 0.596 1
1 1173 . 1 1 1 A 92 92 GLN CA C 92 56.109 55.303 0.806 1
1 1174 . 1 1 1 A 92 92 GLN CB C 92 29.112 31.657 -2.545 1
1 1177 . 1 1 1 A 92 92 GLN N N 92 121.631 122.089 -0.458 1
1 1179 . 1 1 1 A 93 93 GLY H H 93 8.052 9.031 -0.979 1
1 1180 . 1 1 1 A 93 93 GLY HA2 H 93 4.023 4.054 -0.031 1
1 1181 . 1 1 1 A 93 93 GLY HA3 H 93 3.856 4.055 -0.199 1
1 1182 . 1 1 1 A 93 93 GLY C C 93 173.791 175.770 -1.979 1
1 1183 . 1 1 1 A 93 93 GLY CA C 93 45.382 45.367 0.015 1
1 1184 . 1 1 1 A 93 93 GLY N N 93 109.847 116.193 -6.346 1
1 1185 . 1 1 1 A 94 94 ALA H H 94 8.162 8.175 -0.013 1
1 1186 . 1 1 1 A 94 94 ALA HA H 94 4.329 4.225 0.104 1
1 1190 . 1 1 1 A 94 94 ALA C C 94 177.392 177.857 -0.465 1
1 1191 . 1 1 1 A 94 94 ALA CA C 94 52.558 53.438 -0.880 1
1 1192 . 1 1 1 A 94 94 ALA CB C 94 19.526 19.188 0.338 1
1 1193 . 1 1 1 A 94 94 ALA N N 94 123.424 122.703 0.721 1
1 1194 . 1 1 1 A 95 95 ASP H H 95 8.457 7.630 0.827 1
1 1195 . 1 1 1 A 95 95 ASP HA H 95 4.608 5.144 -0.536 1
1 1198 . 1 1 1 A 95 95 ASP C C 95 175.630 177.053 -1.423 1
1 1199 . 1 1 1 A 95 95 ASP CA C 95 54.450 53.138 1.312 1
1 1200 . 1 1 1 A 95 95 ASP CB C 95 40.871 39.069 1.802 1
1 1201 . 1 1 1 A 95 95 ASP N N 95 118.814 118.257 0.557 1
1 1202 . 1 1 1 A 96 96 VAL H H 96 7.776 8.084 -0.308 1
1 1203 . 1 1 1 A 96 96 VAL HA H 96 4.141 4.246 -0.105 1
1 1211 . 1 1 1 A 96 96 VAL C C 96 175.301 175.491 -0.190 1
1 1212 . 1 1 1 A 96 96 VAL CA C 96 61.435 63.717 -2.282 1
1 1213 . 1 1 1 A 96 96 VAL CB C 96 33.517 32.292 1.225 1
1 1216 . 1 1 1 A 96 96 VAL N N 96 118.395 120.310 -1.915 1
1 1217 . 1 1 1 A 97 97 ASP H H 97 8.315 7.481 0.834 1
1 1218 . 1 1 1 A 97 97 ASP HA H 97 4.681 5.014 -0.333 1
1 1221 . 1 1 1 A 97 97 ASP C C 97 175.151 175.083 0.068 1
1 1222 . 1 1 1 A 97 97 ASP CA C 97 54.324 52.774 1.550 1
1 1223 . 1 1 1 A 97 97 ASP CB C 97 41.963 45.264 -3.301 1
1 1224 . 1 1 1 A 97 97 ASP N N 97 123.905 119.106 4.799 1
1 1225 . 1 1 1 A 98 98 TRP H H 98 8.210 8.780 -0.570 1
1 1226 . 1 1 1 A 98 98 TRP HA H 98 4.916 5.248 -0.332 1
1 1235 . 1 1 1 A 98 98 TRP C C 98 174.585 175.147 -0.562 1
1 1236 . 1 1 1 A 98 98 TRP CA C 98 56.164 54.913 1.251 1
1 1237 . 1 1 1 A 98 98 TRP CB C 98 31.466 32.069 -0.603 1
1 1243 . 1 1 1 A 98 98 TRP N N 98 120.340 120.042 0.298 1
1 1245 . 1 1 1 A 99 99 TYR H H 99 8.760 9.186 -0.426 1
1 1246 . 1 1 1 A 99 99 TYR HA H 99 5.119 5.042 0.077 1
1 1253 . 1 1 1 A 99 99 TYR C C 99 174.599 175.111 -0.512 1
1 1254 . 1 1 1 A 99 99 TYR CA C 99 57.021 56.145 0.876 1
1 1255 . 1 1 1 A 99 99 TYR CB C 99 39.526 41.312 -1.786 1
1 1260 . 1 1 1 A 99 99 TYR N N 99 123.319 119.071 4.248 1
1 1261 . 1 1 1 A 100 100 ILE H H 100 8.936 9.410 -0.474 1
1 1262 . 1 1 1 A 100 100 ILE HA H 100 4.850 4.783 0.067 1
1 1272 . 1 1 1 A 100 100 ILE C C 100 175.070 175.079 -0.009 1
1 1273 . 1 1 1 A 100 100 ILE CA C 100 58.998 60.446 -1.448 1
1 1274 . 1 1 1 A 100 100 ILE CB C 100 40.667 39.580 1.087 1
1 1278 . 1 1 1 A 100 100 ILE N N 100 123.281 122.583 0.698 1
1 1279 . 1 1 1 A 101 101 LYS H H 101 8.987 8.976 0.011 1
1 1280 . 1 1 1 A 101 101 LYS HA H 101 5.313 4.815 0.498 1
1 1289 . 1 1 1 A 101 101 LYS C C 101 174.440 176.318 -1.878 1
1 1290 . 1 1 1 A 101 101 LYS CA C 101 54.763 56.044 -1.281 1
1 1291 . 1 1 1 A 101 101 LYS CB C 101 34.880 33.158 1.722 1
1 1295 . 1 1 1 A 101 101 LYS N N 101 126.210 127.569 -1.359 1
1 1296 . 1 1 1 A 102 102 ALA H H 102 8.531 8.473 0.058 1
1 1297 . 1 1 1 A 102 102 ALA HA H 102 4.957 4.881 0.076 1
1 1301 . 1 1 1 A 102 102 ALA C C 102 175.024 177.736 -2.712 1
1 1302 . 1 1 1 A 102 102 ALA CA C 102 50.701 49.850 0.851 1
1 1303 . 1 1 1 A 102 102 ALA CB C 102 21.618 22.949 -1.331 1
1 1304 . 1 1 1 A 102 102 ALA N N 102 121.424 127.042 -5.618 1
1 1305 . 1 1 1 A 103 103 ASP H H 103 8.339 9.132 -0.793 1
1 1306 . 1 1 1 A 103 103 ASP HA H 103 4.603 4.629 -0.026 1
1 1309 . 1 1 1 A 103 103 ASP C C 103 176.188 175.053 1.135 1
1 1310 . 1 1 1 A 103 103 ASP CA C 103 56.049 56.328 -0.279 1
1 1311 . 1 1 1 A 103 103 ASP CB C 103 40.932 41.121 -0.189 1
1 1312 . 1 1 1 A 103 103 ASP N N 103 117.773 118.401 -0.628 1
1 1313 . 1 1 1 A 104 104 ASP H H 104 7.482 7.993 -0.511 1
1 1314 . 1 1 1 A 104 104 ASP HA H 104 4.727 5.115 -0.388 1
1 1317 . 1 1 1 A 104 104 ASP C C 104 174.261 173.557 0.704 1
1 1318 . 1 1 1 A 104 104 ASP CA C 104 52.768 53.173 -0.405 1
1 1319 . 1 1 1 A 104 104 ASP CB C 104 42.587 44.698 -2.111 1
1 1320 . 1 1 1 A 104 104 ASP N N 104 110.673 117.985 -7.312 1
1 1321 . 1 1 1 A 105 105 ILE H H 105 9.267 8.700 0.567 1
1 1322 . 1 1 1 A 105 105 ILE HA H 105 4.631 4.717 -0.086 1
1 1332 . 1 1 1 A 105 105 ILE C C 105 173.922 175.487 -1.565 1
1 1333 . 1 1 1 A 105 105 ILE CA C 105 61.114 60.109 1.005 1
1 1334 . 1 1 1 A 105 105 ILE CB C 105 42.522 39.374 3.148 1
1 1338 . 1 1 1 A 105 105 ILE N N 105 121.380 122.985 -1.605 1
1 1339 . 1 1 1 A 106 106 VAL H H 106 8.592 8.760 -0.168 1
1 1340 . 1 1 1 A 106 106 VAL HA H 106 4.975 5.000 -0.025 1
1 1348 . 1 1 1 A 106 106 VAL C C 106 175.049 175.254 -0.205 1
1 1349 . 1 1 1 A 106 106 VAL CA C 106 58.028 59.446 -1.418 1
1 1350 . 1 1 1 A 106 106 VAL CB C 106 35.388 35.515 -0.127 1
1 1353 . 1 1 1 A 106 106 VAL N N 106 116.356 121.099 -4.743 1
1 1354 . 1 1 1 A 107 107 LEU H H 107 8.360 8.578 -0.218 1
1 1355 . 1 1 1 A 107 107 LEU HA H 107 4.167 4.340 -0.173 1
1 1365 . 1 1 1 A 107 107 LEU C C 107 178.338 177.309 1.029 1
1 1366 . 1 1 1 A 107 107 LEU CA C 107 55.077 54.074 1.003 1
1 1367 . 1 1 1 A 107 107 LEU CB C 107 42.394 42.141 0.253 1
1 1371 . 1 1 1 A 107 107 LEU N N 107 121.368 122.266 -0.898 1
1 1372 . 1 1 1 A 108 108 THR H H 108 7.977 8.460 -0.483 1
1 1373 . 1 1 1 A 108 108 THR HA H 108 4.039 4.571 -0.532 1
1 1378 . 1 1 1 A 108 108 THR C C 108 174.725 175.510 -0.785 1
1 1379 . 1 1 1 A 108 108 THR CA C 108 63.513 63.765 -0.252 1
1 1380 . 1 1 1 A 108 108 THR CB C 108 69.194 68.172 1.022 1
1 1382 . 1 1 1 A 108 108 THR N N 108 118.728 117.582 1.146 1
1 1383 . 1 1 1 A 109 109 LEU H H 109 8.378 8.551 -0.173 1
1 1384 . 1 1 1 A 109 109 LEU HA H 109 4.274 4.259 0.015 1
1 1394 . 1 1 1 A 109 109 LEU C C 109 177.058 177.099 -0.041 1
1 1395 . 1 1 1 A 109 109 LEU CA C 109 55.045 55.601 -0.556 1
1 1396 . 1 1 1 A 109 109 LEU CB C 109 42.620 42.267 0.353 1
1 1400 . 1 1 1 A 109 109 LEU N N 109 124.847 123.740 1.107 1
1 9 . 2 1 1 A 2 2 MET HA H 2 4.554 5.120 -0.566 1
1 14 . 2 1 1 A 2 2 MET C C 2 174.749 174.650 0.099 1
1 15 . 2 1 1 A 2 2 MET CA C 2 55.354 54.054 1.300 1
1 16 . 2 1 1 A 2 2 MET CB C 2 33.729 37.116 -3.387 1
1 18 . 2 1 1 A 3 3 ARG H H 3 8.518 8.472 0.046 1
1 19 . 2 1 1 A 3 3 ARG HA H 3 4.531 4.823 -0.292 1
1 26 . 2 1 1 A 3 3 ARG C C 3 175.780 175.001 0.779 1
1 27 . 2 1 1 A 3 3 ARG CA C 3 55.854 55.502 0.352 1
1 28 . 2 1 1 A 3 3 ARG CB C 3 31.403 31.469 -0.066 1
1 31 . 2 1 1 A 3 3 ARG N N 3 124.008 122.171 1.837 1
1 32 . 2 1 1 A 4 4 LEU H H 4 8.424 8.987 -0.563 1
1 33 . 2 1 1 A 4 4 LEU HA H 4 4.457 4.902 -0.445 1
1 43 . 2 1 1 A 4 4 LEU C C 4 177.362 176.957 0.405 1
1 44 . 2 1 1 A 4 4 LEU CA C 4 54.511 53.710 0.801 1
1 45 . 2 1 1 A 4 4 LEU CB C 4 42.686 43.542 -0.856 1
1 49 . 2 1 1 A 4 4 LEU N N 4 124.389 125.682 -1.293 1
1 50 . 2 1 1 A 5 5 ALA H H 5 8.418 8.696 -0.278 1
1 51 . 2 1 1 A 5 5 ALA HA H 5 4.254 4.416 -0.162 1
1 55 . 2 1 1 A 5 5 ALA C C 5 177.420 177.070 0.350 1
1 56 . 2 1 1 A 5 5 ALA CA C 5 52.931 51.555 1.376 1
1 57 . 2 1 1 A 5 5 ALA CB C 5 19.263 20.245 -0.982 1
1 58 . 2 1 1 A 5 5 ALA N N 5 124.548 126.755 -2.207 1
1 59 . 2 1 1 A 6 6 ASN H H 6 8.287 8.606 -0.319 1
1 60 . 2 1 1 A 6 6 ASN HA H 6 4.616 4.899 -0.283 1
1 65 . 2 1 1 A 6 6 ASN C C 6 175.837 175.038 0.799 1
1 66 . 2 1 1 A 6 6 ASN CA C 6 53.345 53.415 -0.070 1
1 67 . 2 1 1 A 6 6 ASN CB C 6 38.571 39.419 -0.848 1
1 69 . 2 1 1 A 6 6 ASN N N 6 116.484 118.976 -2.492 1
1 71 . 2 1 1 A 7 7 GLY H H 7 8.351 8.535 -0.184 1
1 72 . 2 1 1 A 7 7 GLY HA2 H 7 4.130 4.178 -0.048 1
1 73 . 2 1 1 A 7 7 GLY HA3 H 7 3.808 4.178 -0.370 1
1 74 . 2 1 1 A 7 7 GLY C C 7 173.750 173.028 0.722 1
1 75 . 2 1 1 A 7 7 GLY CA C 7 45.343 45.225 0.118 1
1 76 . 2 1 1 A 7 7 GLY N N 7 108.453 110.318 -1.865 1
1 77 . 2 1 1 A 8 8 ILE H H 8 7.868 8.714 -0.846 1
1 78 . 2 1 1 A 8 8 ILE HA H 8 4.130 4.624 -0.494 1
1 88 . 2 1 1 A 8 8 ILE C C 8 175.570 175.891 -0.321 1
1 89 . 2 1 1 A 8 8 ILE CA C 8 61.095 59.645 1.450 1
1 90 . 2 1 1 A 8 8 ILE CB C 8 38.694 40.036 -1.342 1
1 94 . 2 1 1 A 8 8 ILE N N 8 120.848 120.767 0.081 1
1 95 . 2 1 1 A 9 9 VAL H H 9 8.220 8.547 -0.327 1
1 96 . 2 1 1 A 9 9 VAL HA H 9 4.172 4.358 -0.186 1
1 104 . 2 1 1 A 9 9 VAL C C 9 175.898 175.599 0.299 1
1 105 . 2 1 1 A 9 9 VAL CA C 9 62.488 62.122 0.366 1
1 106 . 2 1 1 A 9 9 VAL CB C 9 32.460 32.206 0.254 1
1 109 . 2 1 1 A 9 9 VAL N N 9 125.805 122.689 3.116 1
1 110 . 2 1 1 A 10 10 LEU H H 10 8.437 8.657 -0.220 1
1 111 . 2 1 1 A 10 10 LEU HA H 10 4.347 4.946 -0.599 1
1 121 . 2 1 1 A 10 10 LEU C C 10 176.398 175.426 0.972 1
1 122 . 2 1 1 A 10 10 LEU CA C 10 54.787 53.406 1.381 1
1 123 . 2 1 1 A 10 10 LEU CB C 10 42.639 45.457 -2.818 1
1 127 . 2 1 1 A 10 10 LEU N N 10 127.757 121.952 5.805 1
1 128 . 2 1 1 A 11 11 ASP H H 11 8.506 8.484 0.022 1
1 129 . 2 1 1 A 11 11 ASP HA H 11 4.683 4.671 0.012 1
1 132 . 2 1 1 A 11 11 ASP C C 11 176.672 175.193 1.479 1
1 133 . 2 1 1 A 11 11 ASP CA C 11 53.586 54.480 -0.894 1
1 134 . 2 1 1 A 11 11 ASP CB C 11 41.123 40.492 0.631 1
1 135 . 2 1 1 A 11 11 ASP N N 11 121.539 118.882 2.657 1
1 136 . 2 1 1 A 12 12 LYS H H 12 8.578 8.754 -0.176 1
1 137 . 2 1 1 A 12 12 LYS HA H 12 3.943 4.740 -0.797 1
1 146 . 2 1 1 A 12 12 LYS C C 12 176.917 175.465 1.452 1
1 147 . 2 1 1 A 12 12 LYS CA C 12 58.542 55.027 3.515 1
1 148 . 2 1 1 A 12 12 LYS CB C 12 32.703 34.627 -1.924 1
1 152 . 2 1 1 A 12 12 LYS N N 12 123.635 125.088 -1.453 1
1 153 . 2 1 1 A 13 13 ASP H H 13 8.523 9.131 -0.608 1
1 154 . 2 1 1 A 13 13 ASP HA H 13 4.566 4.279 0.287 1
1 157 . 2 1 1 A 13 13 ASP C C 13 177.535 176.373 1.162 1
1 158 . 2 1 1 A 13 13 ASP CA C 13 56.034 54.786 1.248 1
1 159 . 2 1 1 A 13 13 ASP CB C 13 41.051 39.230 1.821 1
1 160 . 2 1 1 A 13 13 ASP N N 13 120.448 126.033 -5.585 1
1 161 . 2 1 1 A 14 14 THR H H 14 7.964 7.996 -0.032 1
1 162 . 2 1 1 A 14 14 THR HA H 14 4.146 4.277 -0.131 1
1 167 . 2 1 1 A 14 14 THR C C 14 175.440 175.281 0.159 1
1 168 . 2 1 1 A 14 14 THR CA C 14 63.245 62.910 0.335 1
1 169 . 2 1 1 A 14 14 THR CB C 14 69.092 69.234 -0.142 1
1 171 . 2 1 1 A 14 14 THR N N 14 113.711 114.776 -1.065 1
1 172 . 2 1 1 A 15 15 THR H H 15 7.921 8.267 -0.346 1
1 173 . 2 1 1 A 15 15 THR HA H 15 3.920 4.138 -0.218 1
1 178 . 2 1 1 A 15 15 THR C C 15 174.750 174.337 0.413 1
1 179 . 2 1 1 A 15 15 THR CA C 15 64.562 62.014 2.548 1
1 180 . 2 1 1 A 15 15 THR CB C 15 69.166 68.546 0.620 1
1 182 . 2 1 1 A 15 15 THR N N 15 116.710 115.925 0.785 1
1 183 . 2 1 1 A 16 16 PHE H H 16 8.191 7.829 0.362 1
1 184 . 2 1 1 A 16 16 PHE HA H 16 4.628 4.491 0.137 1
1 192 . 2 1 1 A 16 16 PHE C C 16 177.754 175.152 2.602 1
1 193 . 2 1 1 A 16 16 PHE CA C 16 57.975 59.916 -1.941 1
1 194 . 2 1 1 A 16 16 PHE CB C 16 39.553 37.846 1.707 1
1 200 . 2 1 1 A 16 16 PHE N N 16 117.124 118.074 -0.950 1
1 201 . 2 1 1 A 17 17 GLY H H 17 8.110 8.699 -0.589 1
1 202 . 2 1 1 A 17 17 GLY HA2 H 17 4.017 4.176 -0.159 1
1 203 . 2 1 1 A 17 17 GLY HA3 H 17 3.849 4.176 -0.327 1
1 204 . 2 1 1 A 17 17 GLY C C 17 172.231 173.405 -1.174 1
1 205 . 2 1 1 A 17 17 GLY CA C 17 45.633 44.419 1.214 1
1 206 . 2 1 1 A 17 17 GLY N N 17 109.951 108.675 1.276 1
1 207 . 2 1 1 A 18 18 GLU H H 18 8.304 8.345 -0.041 1
1 208 . 2 1 1 A 18 18 GLU HA H 18 4.078 4.883 -0.805 1
1 213 . 2 1 1 A 18 18 GLU C C 18 175.588 176.413 -0.825 1
1 214 . 2 1 1 A 18 18 GLU CA C 18 57.446 55.370 2.076 1
1 215 . 2 1 1 A 18 18 GLU CB C 18 30.767 30.868 -0.101 1
1 217 . 2 1 1 A 18 18 GLU N N 18 121.640 119.449 2.191 1
1 218 . 2 1 1 A 19 19 LEU H H 19 8.799 8.764 0.035 1
1 219 . 2 1 1 A 19 19 LEU HA H 19 5.416 4.823 0.593 1
1 229 . 2 1 1 A 19 19 LEU C C 19 176.875 176.181 0.694 1
1 230 . 2 1 1 A 19 19 LEU CA C 19 53.281 53.933 -0.652 1
1 231 . 2 1 1 A 19 19 LEU CB C 19 45.508 43.017 2.491 1
1 235 . 2 1 1 A 19 19 LEU N N 19 127.101 125.283 1.818 1
1 236 . 2 1 1 A 20 20 LYS H H 20 8.494 8.422 0.072 1
1 237 . 2 1 1 A 20 20 LYS HA H 20 5.200 5.062 0.138 1
1 246 . 2 1 1 A 20 20 LYS C C 20 176.163 175.374 0.789 1
1 247 . 2 1 1 A 20 20 LYS CA C 20 53.575 54.987 -1.412 1
1 248 . 2 1 1 A 20 20 LYS CB C 20 36.835 34.364 2.471 1
1 252 . 2 1 1 A 20 20 LYS N N 20 118.828 119.744 -0.916 1
1 253 . 2 1 1 A 21 21 PHE H H 21 9.658 9.138 0.520 1
1 254 . 2 1 1 A 21 21 PHE HA H 21 4.038 4.652 -0.614 1
1 262 . 2 1 1 A 21 21 PHE C C 21 174.296 175.930 -1.634 1
1 263 . 2 1 1 A 21 21 PHE CA C 21 60.462 59.011 1.451 1
1 264 . 2 1 1 A 21 21 PHE CB C 21 40.359 39.834 0.525 1
1 270 . 2 1 1 A 21 21 PHE N N 21 124.322 127.089 -2.767 1
1 271 . 2 1 1 A 22 22 SER H H 22 7.199 8.563 -1.364 1
1 272 . 2 1 1 A 22 22 SER HA H 22 5.046 4.299 0.747 1
1 275 . 2 1 1 A 22 22 SER C C 22 173.080 174.110 -1.030 1
1 276 . 2 1 1 A 22 22 SER CA C 22 58.547 58.315 0.232 1
1 277 . 2 1 1 A 22 22 SER CB C 22 63.591 63.545 0.046 1
1 278 . 2 1 1 A 22 22 SER N N 22 120.109 120.416 -0.307 1
1 279 . 2 1 1 A 23 23 ALA H H 23 7.269 7.030 0.239 1
1 280 . 2 1 1 A 23 23 ALA HA H 23 4.426 4.315 0.111 1
1 284 . 2 1 1 A 23 23 ALA C C 23 176.568 174.770 1.798 1
1 285 . 2 1 1 A 23 23 ALA CA C 23 52.458 51.212 1.246 1
1 286 . 2 1 1 A 23 23 ALA CB C 23 22.728 22.331 0.397 1
1 287 . 2 1 1 A 23 23 ALA N N 23 114.102 119.775 -5.673 1
1 288 . 2 1 1 A 24 24 LEU H H 24 8.819 8.632 0.187 1
1 289 . 2 1 1 A 24 24 LEU HA H 24 4.060 4.626 -0.566 1
1 299 . 2 1 1 A 24 24 LEU C C 24 175.363 176.833 -1.470 1
1 300 . 2 1 1 A 24 24 LEU CA C 24 56.901 54.771 2.130 1
1 301 . 2 1 1 A 24 24 LEU CB C 24 42.065 42.344 -0.279 1
1 305 . 2 1 1 A 24 24 LEU N N 24 120.865 120.936 -0.071 1
1 306 . 2 1 1 A 25 25 ARG H H 25 9.473 8.590 0.883 1
1 307 . 2 1 1 A 25 25 ARG HA H 25 4.428 4.149 0.279 1
1 315 . 2 1 1 A 25 25 ARG C C 25 175.729 175.619 0.110 1
1 316 . 2 1 1 A 25 25 ARG CA C 25 56.721 58.170 -1.449 1
1 317 . 2 1 1 A 25 25 ARG CB C 25 31.109 31.165 -0.056 1
1 320 . 2 1 1 A 25 25 ARG N N 25 130.455 127.788 2.667 1
1 322 . 2 1 1 A 26 26 ARG H H 26 7.711 7.384 0.327 1
1 323 . 2 1 1 A 26 26 ARG HA H 26 4.559 4.556 0.003 1
1 330 . 2 1 1 A 26 26 ARG C C 26 173.724 173.688 0.036 1
1 331 . 2 1 1 A 26 26 ARG CA C 26 55.737 55.738 -0.001 1
1 332 . 2 1 1 A 26 26 ARG CB C 26 33.261 33.644 -0.383 1
1 335 . 2 1 1 A 26 26 ARG N N 26 113.305 118.337 -5.032 1
1 336 . 2 1 1 A 27 27 GLU H H 27 8.848 8.672 0.176 1
1 337 . 2 1 1 A 27 27 GLU HA H 27 4.615 4.625 -0.010 1
1 342 . 2 1 1 A 27 27 GLU C C 27 174.836 176.067 -1.231 1
1 343 . 2 1 1 A 27 27 GLU CA C 27 55.901 55.456 0.445 1
1 344 . 2 1 1 A 27 27 GLU CB C 27 30.755 29.891 0.864 1
1 346 . 2 1 1 A 27 27 GLU N N 27 121.934 125.669 -3.735 1
1 347 . 2 1 1 A 28 28 VAL H H 28 8.603 8.112 0.491 1
1 348 . 2 1 1 A 28 28 VAL HA H 28 4.013 4.140 -0.127 1
1 356 . 2 1 1 A 28 28 VAL C C 28 175.561 175.845 -0.284 1
1 357 . 2 1 1 A 28 28 VAL CA C 28 62.791 61.727 1.064 1
1 358 . 2 1 1 A 28 28 VAL CB C 28 32.710 31.938 0.772 1
1 361 . 2 1 1 A 28 28 VAL N N 28 125.545 122.709 2.836 1
1 362 . 2 1 1 A 29 29 ARG H H 29 8.735 8.551 0.184 1
1 363 . 2 1 1 A 29 29 ARG HA H 29 4.774 4.702 0.072 1
1 370 . 2 1 1 A 29 29 ARG C C 29 176.580 176.422 0.158 1
1 371 . 2 1 1 A 29 29 ARG CA C 29 55.481 54.125 1.356 1
1 372 . 2 1 1 A 29 29 ARG CB C 29 31.963 31.469 0.494 1
1 375 . 2 1 1 A 29 29 ARG N N 29 128.327 125.986 2.341 1
1 376 . 2 1 1 A 30 30 ILE H H 30 8.358 8.863 -0.505 1
1 377 . 2 1 1 A 30 30 ILE HA H 30 3.882 4.123 -0.241 1
1 387 . 2 1 1 A 30 30 ILE C C 30 175.093 175.498 -0.405 1
1 388 . 2 1 1 A 30 30 ILE CA C 30 61.669 61.024 0.645 1
1 389 . 2 1 1 A 30 30 ILE CB C 30 38.806 37.337 1.469 1
1 393 . 2 1 1 A 30 30 ILE N N 30 121.957 122.226 -0.269 1
1 394 . 2 1 1 A 31 31 GLN H H 31 8.560 8.840 -0.280 1
1 395 . 2 1 1 A 31 31 GLN HA H 31 4.647 4.582 0.065 1
1 402 . 2 1 1 A 31 31 GLN C C 31 175.954 175.812 0.142 1
1 403 . 2 1 1 A 31 31 GLN CA C 31 54.833 55.595 -0.762 1
1 404 . 2 1 1 A 31 31 GLN CB C 31 30.584 29.740 0.844 1
1 407 . 2 1 1 A 31 31 GLN N N 31 126.348 128.505 -2.157 1
1 409 . 2 1 1 A 32 32 ASN H H 32 8.994 9.221 -0.227 1
1 410 . 2 1 1 A 32 32 ASN HA H 32 4.784 4.973 -0.189 1
1 415 . 2 1 1 A 32 32 ASN C C 32 177.296 176.792 0.504 1
1 416 . 2 1 1 A 32 32 ASN CA C 32 53.206 52.554 0.652 1
1 417 . 2 1 1 A 32 32 ASN CB C 32 39.472 39.560 -0.088 1
1 419 . 2 1 1 A 32 32 ASN N N 32 122.834 123.325 -0.491 1
1 421 . 2 1 1 A 33 33 GLU H H 33 9.180 8.808 0.372 1
1 422 . 2 1 1 A 33 33 GLU HA H 33 4.063 4.078 -0.015 1
1 427 . 2 1 1 A 33 33 GLU C C 33 176.787 177.356 -0.569 1
1 428 . 2 1 1 A 33 33 GLU CA C 33 59.347 59.073 0.274 1
1 429 . 2 1 1 A 33 33 GLU CB C 33 29.294 29.691 -0.397 1
1 431 . 2 1 1 A 33 33 GLU N N 33 122.736 121.404 1.332 1
1 432 . 2 1 1 A 34 34 ASP H H 34 7.969 7.957 0.012 1
1 433 . 2 1 1 A 34 34 ASP HA H 34 4.499 4.703 -0.204 1
1 436 . 2 1 1 A 34 34 ASP C C 34 177.111 176.348 0.763 1
1 437 . 2 1 1 A 34 34 ASP CA C 34 53.632 54.048 -0.416 1
1 438 . 2 1 1 A 34 34 ASP CB C 34 39.807 40.900 -1.093 1
1 439 . 2 1 1 A 34 34 ASP N N 34 115.921 117.522 -1.601 1
1 440 . 2 1 1 A 35 35 GLY H H 35 8.083 8.204 -0.121 1
1 441 . 2 1 1 A 35 35 GLY HA2 H 35 4.366 3.938 0.428 1
1 442 . 2 1 1 A 35 35 GLY HA3 H 35 3.657 3.940 -0.283 1
1 443 . 2 1 1 A 35 35 GLY C C 35 174.584 174.251 0.333 1
1 444 . 2 1 1 A 35 35 GLY CA C 35 45.134 45.456 -0.322 1
1 445 . 2 1 1 A 35 35 GLY N N 35 108.874 108.533 0.341 1
1 446 . 2 1 1 A 36 36 SER H H 36 8.274 8.059 0.215 1
1 447 . 2 1 1 A 36 36 SER HA H 36 4.389 4.454 -0.065 1
1 450 . 2 1 1 A 36 36 SER C C 36 173.284 173.701 -0.417 1
1 451 . 2 1 1 A 36 36 SER CA C 36 58.383 59.607 -1.224 1
1 452 . 2 1 1 A 36 36 SER CB C 36 64.576 63.780 0.796 1
1 453 . 2 1 1 A 36 36 SER N N 36 117.428 117.368 0.060 1
1 454 . 2 1 1 A 37 37 VAL H H 37 8.508 8.670 -0.162 1
1 455 . 2 1 1 A 37 37 VAL HA H 37 4.346 4.392 -0.046 1
1 463 . 2 1 1 A 37 37 VAL C C 37 176.370 175.552 0.818 1
1 464 . 2 1 1 A 37 37 VAL CA C 37 62.410 61.365 1.045 1
1 465 . 2 1 1 A 37 37 VAL CB C 37 33.086 33.554 -0.468 1
1 468 . 2 1 1 A 37 37 VAL N N 37 119.189 126.033 -6.844 1
1 469 . 2 1 1 A 38 38 SER H H 38 8.461 8.852 -0.391 1
1 470 . 2 1 1 A 38 38 SER HA H 38 4.586 4.640 -0.054 1
1 473 . 2 1 1 A 38 38 SER C C 38 173.829 175.016 -1.187 1
1 474 . 2 1 1 A 38 38 SER CA C 38 57.618 58.062 -0.444 1
1 475 . 2 1 1 A 38 38 SER CB C 38 64.537 64.189 0.348 1
1 476 . 2 1 1 A 38 38 SER N N 38 121.629 121.286 0.343 1
1 477 . 2 1 1 A 39 39 ASP H H 39 8.512 8.740 -0.228 1
1 478 . 2 1 1 A 39 39 ASP HA H 39 4.606 4.626 -0.020 1
1 481 . 2 1 1 A 39 39 ASP C C 39 176.557 176.495 0.062 1
1 482 . 2 1 1 A 39 39 ASP CA C 39 54.833 55.536 -0.703 1
1 483 . 2 1 1 A 39 39 ASP CB C 39 41.123 41.541 -0.418 1
1 484 . 2 1 1 A 39 39 ASP N N 39 120.305 122.972 -2.667 1
1 485 . 2 1 1 A 40 40 GLU H H 40 8.311 7.735 0.576 1
1 486 . 2 1 1 A 40 40 GLU HA H 40 4.235 4.400 -0.165 1
1 491 . 2 1 1 A 40 40 GLU C C 40 175.327 175.993 -0.666 1
1 492 . 2 1 1 A 40 40 GLU CA C 40 56.215 57.217 -1.002 1
1 493 . 2 1 1 A 40 40 GLU CB C 40 30.788 30.165 0.623 1
1 495 . 2 1 1 A 40 40 GLU N N 40 120.680 118.450 2.230 1
1 496 . 2 1 1 A 41 41 ILE H H 41 8.465 8.815 -0.350 1
1 497 . 2 1 1 A 41 41 ILE HA H 41 4.127 4.453 -0.326 1
1 507 . 2 1 1 A 41 41 ILE C C 41 175.380 175.855 -0.475 1
1 508 . 2 1 1 A 41 41 ILE CA C 41 60.670 60.233 0.437 1
1 509 . 2 1 1 A 41 41 ILE CB C 41 38.805 39.660 -0.855 1
1 513 . 2 1 1 A 41 41 ILE N N 41 123.665 123.996 -0.331 1
1 514 . 2 1 1 A 42 42 LYS H H 42 9.556 9.319 0.237 1
1 515 . 2 1 1 A 42 42 LYS HA H 42 4.428 4.377 0.051 1
1 524 . 2 1 1 A 42 42 LYS C C 42 177.277 175.485 1.792 1
1 525 . 2 1 1 A 42 42 LYS CA C 42 57.274 57.439 -0.165 1
1 526 . 2 1 1 A 42 42 LYS CB C 42 35.169 33.788 1.381 1
1 530 . 2 1 1 A 42 42 LYS N N 42 125.597 127.642 -2.045 1
1 531 . 2 1 1 A 43 43 GLU H H 43 7.809 7.476 0.333 1
1 532 . 2 1 1 A 43 43 GLU HA H 43 4.886 4.732 0.154 1
1 537 . 2 1 1 A 43 43 GLU C C 43 173.593 174.766 -1.173 1
1 538 . 2 1 1 A 43 43 GLU CA C 43 54.669 54.801 -0.132 1
1 539 . 2 1 1 A 43 43 GLU CB C 43 32.882 34.102 -1.220 1
1 541 . 2 1 1 A 43 43 GLU N N 43 115.292 116.151 -0.859 1
1 542 . 2 1 1 A 44 44 ARG H H 44 8.879 8.728 0.151 1
1 543 . 2 1 1 A 44 44 ARG HA H 44 4.917 4.748 0.169 1
1 551 . 2 1 1 A 44 44 ARG C C 44 173.708 174.950 -1.242 1
1 552 . 2 1 1 A 44 44 ARG CA C 44 55.965 54.786 1.179 1
1 553 . 2 1 1 A 44 44 ARG CB C 44 33.579 31.496 2.083 1
1 556 . 2 1 1 A 44 44 ARG N N 44 118.233 122.191 -3.958 1
1 558 . 2 1 1 A 45 45 THR H H 45 8.892 8.689 0.203 1
1 559 . 2 1 1 A 45 45 THR HA H 45 5.308 5.078 0.230 1
1 564 . 2 1 1 A 45 45 THR C C 45 173.357 173.008 0.349 1
1 565 . 2 1 1 A 45 45 THR CA C 45 60.939 61.798 -0.859 1
1 566 . 2 1 1 A 45 45 THR CB C 45 70.054 70.006 0.048 1
1 568 . 2 1 1 A 45 45 THR N N 45 118.457 120.799 -2.342 1
1 569 . 2 1 1 A 46 46 TYR H H 46 9.625 9.691 -0.066 1
1 570 . 2 1 1 A 46 46 TYR HA H 46 4.771 5.166 -0.395 1
1 578 . 2 1 1 A 46 46 TYR C C 46 173.735 174.985 -1.250 1
1 579 . 2 1 1 A 46 46 TYR CA C 46 57.480 56.357 1.123 1
1 580 . 2 1 1 A 46 46 TYR CB C 46 41.724 43.035 -1.311 1
1 585 . 2 1 1 A 46 46 TYR N N 46 125.916 125.673 0.243 1
1 586 . 2 1 1 A 47 47 ASP H H 47 9.006 8.919 0.087 1
1 587 . 2 1 1 A 47 47 ASP HA H 47 5.399 5.089 0.310 1
1 590 . 2 1 1 A 47 47 ASP C C 47 175.094 175.132 -0.038 1
1 591 . 2 1 1 A 47 47 ASP CA C 47 53.460 53.739 -0.279 1
1 592 . 2 1 1 A 47 47 ASP CB C 47 41.947 42.246 -0.299 1
1 593 . 2 1 1 A 47 47 ASP N N 47 122.109 122.174 -0.065 1
1 594 . 2 1 1 A 48 48 LEU H H 48 9.066 8.585 0.481 1
1 595 . 2 1 1 A 48 48 LEU HA H 48 4.831 5.090 -0.259 1
1 605 . 2 1 1 A 48 48 LEU C C 48 174.977 175.945 -0.968 1
1 606 . 2 1 1 A 48 48 LEU CA C 48 52.724 53.100 -0.376 1
1 607 . 2 1 1 A 48 48 LEU CB C 48 44.844 45.338 -0.494 1
1 611 . 2 1 1 A 48 48 LEU N N 48 121.879 125.368 -3.489 1
1 612 . 2 1 1 A 49 49 LYS H H 49 9.401 8.655 0.746 1
1 613 . 2 1 1 A 49 49 LYS HA H 49 4.477 4.436 0.041 1
1 622 . 2 1 1 A 49 49 LYS C C 49 176.225 177.249 -1.024 1
1 623 . 2 1 1 A 49 49 LYS CA C 49 56.017 55.881 0.136 1
1 624 . 2 1 1 A 49 49 LYS CB C 49 33.838 33.168 0.670 1
1 628 . 2 1 1 A 49 49 LYS N N 49 122.218 123.757 -1.539 1
1 629 . 2 1 1 A 50 50 SER H H 50 8.266 8.698 -0.432 1
1 630 . 2 1 1 A 50 50 SER HA H 50 5.222 4.848 0.374 1
1 633 . 2 1 1 A 50 50 SER C C 50 175.570 176.396 -0.826 1
1 634 . 2 1 1 A 50 50 SER CA C 50 55.770 57.045 -1.275 1
1 635 . 2 1 1 A 50 50 SER CB C 50 64.738 65.725 -0.987 1
1 636 . 2 1 1 A 50 50 SER N N 50 117.388 116.155 1.233 1
1 637 . 2 1 1 A 51 51 LYS H H 51 9.276 8.724 0.552 1
1 638 . 2 1 1 A 51 51 LYS HA H 51 4.208 4.204 0.004 1
1 647 . 2 1 1 A 51 51 LYS C C 51 178.773 176.956 1.817 1
1 648 . 2 1 1 A 51 51 LYS CA C 51 58.674 55.934 2.740 1
1 649 . 2 1 1 A 51 51 LYS CB C 51 33.383 31.786 1.597 1
1 653 . 2 1 1 A 51 51 LYS N N 51 130.550 118.412 12.138 1
1 654 . 2 1 1 A 52 52 GLY H H 52 8.320 7.337 0.983 1
1 655 . 2 1 1 A 52 52 GLY HA2 H 52 3.875 4.054 -0.179 1
1 656 . 2 1 1 A 52 52 GLY HA3 H 52 3.628 4.059 -0.431 1
1 657 . 2 1 1 A 52 52 GLY C C 52 175.108 175.448 -0.340 1
1 658 . 2 1 1 A 52 52 GLY CA C 52 46.322 45.022 1.300 1
1 659 . 2 1 1 A 52 52 GLY N N 52 107.053 108.998 -1.945 1
1 660 . 2 1 1 A 53 53 GLN H H 53 7.859 8.541 -0.682 1
1 661 . 2 1 1 A 53 53 GLN HA H 53 4.409 4.421 -0.012 1
1 668 . 2 1 1 A 53 53 GLN C C 53 176.469 176.388 0.081 1
1 669 . 2 1 1 A 53 53 GLN CA C 53 54.911 55.445 -0.534 1
1 670 . 2 1 1 A 53 53 GLN CB C 53 29.675 29.599 0.076 1
1 673 . 2 1 1 A 53 53 GLN N N 53 115.482 118.689 -3.207 1
1 675 . 2 1 1 A 54 54 GLY H H 54 7.992 8.474 -0.482 1
1 676 . 2 1 1 A 54 54 GLY HA2 H 54 3.934 3.947 -0.013 1
1 677 . 2 1 1 A 54 54 GLY HA3 H 54 3.934 3.952 -0.018 1
1 678 . 2 1 1 A 54 54 GLY C C 54 173.897 173.627 0.270 1
1 679 . 2 1 1 A 54 54 GLY CA C 54 46.574 46.452 0.122 1
1 680 . 2 1 1 A 54 54 GLY N N 54 110.111 109.407 0.704 1
1 681 . 2 1 1 A 55 55 ARG H H 55 7.652 7.589 0.063 1
1 682 . 2 1 1 A 55 55 ARG HA H 55 4.665 4.986 -0.321 1
1 690 . 2 1 1 A 55 55 ARG C C 55 174.649 174.086 0.563 1
1 691 . 2 1 1 A 55 55 ARG CA C 55 54.631 54.429 0.202 1
1 692 . 2 1 1 A 55 55 ARG CB C 55 32.166 33.530 -1.364 1
1 695 . 2 1 1 A 55 55 ARG N N 55 114.214 116.026 -1.812 1
1 697 . 2 1 1 A 56 56 MET H H 56 8.593 8.991 -0.398 1
1 698 . 2 1 1 A 56 56 MET HA H 56 5.012 4.914 0.098 1
1 703 . 2 1 1 A 56 56 MET C C 56 176.216 174.927 1.289 1
1 704 . 2 1 1 A 56 56 MET CA C 56 54.595 54.054 0.541 1
1 705 . 2 1 1 A 56 56 MET CB C 56 33.466 33.795 -0.329 1
1 707 . 2 1 1 A 56 56 MET N N 56 121.270 122.735 -1.465 1
1 708 . 2 1 1 A 57 57 ILE H H 57 9.393 8.253 1.140 1
1 709 . 2 1 1 A 57 57 ILE HA H 57 4.717 4.417 0.300 1
1 719 . 2 1 1 A 57 57 ILE C C 57 173.883 175.015 -1.132 1
1 720 . 2 1 1 A 57 57 ILE CA C 57 59.713 59.808 -0.095 1
1 721 . 2 1 1 A 57 57 ILE CB C 57 40.933 38.791 2.142 1
1 725 . 2 1 1 A 57 57 ILE N N 57 120.811 122.971 -2.160 1
1 726 . 2 1 1 A 58 58 GLN H H 58 8.218 7.970 0.248 1
1 727 . 2 1 1 A 58 58 GLN HA H 58 5.407 4.686 0.721 1
1 734 . 2 1 1 A 58 58 GLN C C 58 175.368 174.429 0.939 1
1 735 . 2 1 1 A 58 58 GLN CA C 58 55.163 55.148 0.015 1
1 736 . 2 1 1 A 58 58 GLN CB C 58 30.841 28.846 1.995 1
1 739 . 2 1 1 A 58 58 GLN N N 58 122.281 124.700 -2.419 1
1 741 . 2 1 1 A 59 59 VAL H H 59 9.188 8.666 0.522 1
1 742 . 2 1 1 A 59 59 VAL HA H 59 5.025 5.128 -0.103 1
1 750 . 2 1 1 A 59 59 VAL C C 59 175.330 174.681 0.649 1
1 751 . 2 1 1 A 59 59 VAL CA C 59 59.975 61.325 -1.350 1
1 752 . 2 1 1 A 59 59 VAL CB C 59 34.818 32.536 2.282 1
1 755 . 2 1 1 A 59 59 VAL N N 59 122.421 126.669 -4.248 1
1 756 . 2 1 1 A 60 60 SER H H 60 9.022 8.853 0.169 1
1 757 . 2 1 1 A 60 60 SER HA H 60 5.811 5.675 0.136 1
1 760 . 2 1 1 A 60 60 SER C C 60 173.234 173.294 -0.060 1
1 761 . 2 1 1 A 60 60 SER CA C 60 57.634 56.567 1.067 1
1 762 . 2 1 1 A 60 60 SER CB C 60 64.891 64.947 -0.056 1
1 763 . 2 1 1 A 60 60 SER N N 60 124.709 122.762 1.947 1
1 764 . 2 1 1 A 61 61 ILE H H 61 9.226 8.972 0.254 1
1 765 . 2 1 1 A 61 61 ILE HA H 61 5.572 5.000 0.572 1
1 775 . 2 1 1 A 61 61 ILE C C 61 173.955 173.932 0.023 1
1 776 . 2 1 1 A 61 61 ILE CA C 61 56.937 57.221 -0.284 1
1 777 . 2 1 1 A 61 61 ILE CB C 61 39.596 39.701 -0.105 1
1 781 . 2 1 1 A 61 61 ILE N N 61 121.648 121.701 -0.053 1
1 782 . 2 1 1 A 62 62 PRO HA H 62 4.606 4.490 0.116 1
1 789 . 2 1 1 A 62 62 PRO C C 62 178.143 177.703 0.440 1
1 790 . 2 1 1 A 62 62 PRO CA C 62 63.740 63.168 0.572 1
1 791 . 2 1 1 A 62 62 PRO CB C 62 33.303 32.104 1.199 1
1 794 . 2 1 1 A 63 63 ALA H H 63 7.803 8.660 -0.857 1
1 795 . 2 1 1 A 63 63 ALA HA H 63 4.037 4.044 -0.007 1
1 799 . 2 1 1 A 63 63 ALA C C 63 175.942 179.493 -3.551 1
1 800 . 2 1 1 A 63 63 ALA CA C 63 54.417 54.827 -0.410 1
1 801 . 2 1 1 A 63 63 ALA CB C 63 19.345 18.046 1.299 1
1 802 . 2 1 1 A 63 63 ALA N N 63 123.695 128.966 -5.271 1
1 803 . 2 1 1 A 64 64 SER H H 64 7.719 8.121 -0.402 1
1 804 . 2 1 1 A 64 64 SER HA H 64 4.097 4.182 -0.085 1
1 807 . 2 1 1 A 64 64 SER C C 64 175.199 174.675 0.524 1
1 808 . 2 1 1 A 64 64 SER CA C 64 59.474 61.145 -1.671 1
1 809 . 2 1 1 A 64 64 SER CB C 64 62.125 63.108 -0.983 1
1 810 . 2 1 1 A 64 64 SER N N 64 110.001 112.769 -2.768 1
1 811 . 2 1 1 A 65 65 VAL H H 65 7.790 7.791 -0.001 1
1 812 . 2 1 1 A 65 65 VAL HA H 65 4.360 4.143 0.217 1
1 820 . 2 1 1 A 65 65 VAL C C 65 174.433 174.065 0.368 1
1 821 . 2 1 1 A 65 65 VAL CA C 65 60.335 60.910 -0.575 1
1 822 . 2 1 1 A 65 65 VAL CB C 65 32.714 32.257 0.457 1
1 825 . 2 1 1 A 65 65 VAL N N 65 126.142 121.971 4.171 1
1 826 . 2 1 1 A 66 66 PRO HA H 66 4.369 4.506 -0.137 1
1 833 . 2 1 1 A 66 66 PRO C C 66 177.412 176.478 0.934 1
1 834 . 2 1 1 A 66 66 PRO CA C 66 63.104 62.753 0.351 1
1 835 . 2 1 1 A 66 66 PRO CB C 66 32.558 32.214 0.344 1
1 838 . 2 1 1 A 67 67 LEU H H 67 8.578 8.297 0.281 1
1 839 . 2 1 1 A 67 67 LEU HA H 67 3.875 4.444 -0.569 1
1 849 . 2 1 1 A 67 67 LEU C C 67 176.077 176.566 -0.489 1
1 850 . 2 1 1 A 67 67 LEU CA C 67 56.413 55.362 1.051 1
1 851 . 2 1 1 A 67 67 LEU CB C 67 43.279 43.253 0.026 1
1 855 . 2 1 1 A 67 67 LEU N N 67 124.236 122.939 1.297 1
1 856 . 2 1 1 A 68 68 LYS H H 68 7.994 8.192 -0.198 1
1 857 . 2 1 1 A 68 68 LYS HA H 68 3.793 4.028 -0.235 1
1 866 . 2 1 1 A 68 68 LYS C C 68 175.601 175.981 -0.380 1
1 867 . 2 1 1 A 68 68 LYS CA C 68 53.350 55.113 -1.763 1
1 868 . 2 1 1 A 68 68 LYS CB C 68 31.035 32.335 -1.300 1
1 872 . 2 1 1 A 68 68 LYS N N 68 124.053 125.414 -1.361 1
1 873 . 2 1 1 A 69 69 GLU H H 69 8.347 8.079 0.268 1
1 874 . 2 1 1 A 69 69 GLU HA H 69 4.501 4.398 0.103 1
1 879 . 2 1 1 A 69 69 GLU C C 69 175.304 176.126 -0.822 1
1 880 . 2 1 1 A 69 69 GLU CA C 69 54.291 55.844 -1.553 1
1 881 . 2 1 1 A 69 69 GLU CB C 69 29.285 29.765 -0.480 1
1 883 . 2 1 1 A 69 69 GLU N N 69 123.876 122.979 0.897 1
1 884 . 2 1 1 A 70 70 PHE H H 70 5.549 6.980 -1.431 1
1 885 . 2 1 1 A 70 70 PHE HA H 70 4.592 4.398 0.194 1
1 893 . 2 1 1 A 70 70 PHE C C 70 174.443 175.702 -1.259 1
1 894 . 2 1 1 A 70 70 PHE CA C 70 53.313 58.462 -5.149 1
1 895 . 2 1 1 A 70 70 PHE CB C 70 38.335 38.965 -0.630 1
1 901 . 2 1 1 A 70 70 PHE N N 70 117.781 120.650 -2.869 1
1 902 . 2 1 1 A 71 71 ASP H H 71 8.791 8.531 0.260 1
1 903 . 2 1 1 A 71 71 ASP HA H 71 4.535 4.792 -0.257 1
1 906 . 2 1 1 A 71 71 ASP C C 71 175.867 175.551 0.316 1
1 907 . 2 1 1 A 71 71 ASP CA C 71 54.248 53.714 0.534 1
1 908 . 2 1 1 A 71 71 ASP CB C 71 41.166 41.793 -0.627 1
1 909 . 2 1 1 A 71 71 ASP N N 71 120.385 121.952 -1.567 1
1 910 . 2 1 1 A 72 72 TYR H H 72 8.701 8.689 0.012 1
1 911 . 2 1 1 A 72 72 TYR HA H 72 4.283 4.398 -0.115 1
1 918 . 2 1 1 A 72 72 TYR C C 72 177.470 176.244 1.226 1
1 919 . 2 1 1 A 72 72 TYR CA C 72 60.513 59.359 1.154 1
1 920 . 2 1 1 A 72 72 TYR CB C 72 38.320 38.317 0.003 1
1 925 . 2 1 1 A 72 72 TYR N N 72 121.876 124.577 -2.701 1
1 926 . 2 1 1 A 73 73 ASN H H 73 8.819 9.191 -0.372 1
1 927 . 2 1 1 A 73 73 ASN HA H 73 4.096 4.129 -0.033 1
1 932 . 2 1 1 A 73 73 ASN C C 73 174.362 174.514 -0.152 1
1 933 . 2 1 1 A 73 73 ASN CA C 73 54.289 54.230 0.059 1
1 934 . 2 1 1 A 73 73 ASN CB C 73 36.907 36.709 0.198 1
1 936 . 2 1 1 A 73 73 ASN N N 73 121.726 119.911 1.815 1
1 938 . 2 1 1 A 74 74 ALA H H 74 8.059 7.820 0.239 1
1 939 . 2 1 1 A 74 74 ALA HA H 74 4.100 4.321 -0.221 1
1 943 . 2 1 1 A 74 74 ALA C C 74 177.757 177.353 0.404 1
1 944 . 2 1 1 A 74 74 ALA CA C 74 53.153 52.791 0.362 1
1 945 . 2 1 1 A 74 74 ALA CB C 74 19.412 19.489 -0.077 1
1 946 . 2 1 1 A 74 74 ALA N N 74 122.292 120.844 1.448 1
1 947 . 2 1 1 A 75 75 ARG H H 75 8.500 8.519 -0.019 1
1 948 . 2 1 1 A 75 75 ARG HA H 75 4.758 4.902 -0.144 1
1 955 . 2 1 1 A 75 75 ARG C C 75 176.812 176.058 0.754 1
1 956 . 2 1 1 A 75 75 ARG CA C 75 56.646 56.131 0.515 1
1 957 . 2 1 1 A 75 75 ARG CB C 75 29.375 30.788 -1.413 1
1 960 . 2 1 1 A 75 75 ARG N N 75 122.871 122.740 0.131 1
1 961 . 2 1 1 A 76 76 VAL H H 76 7.965 9.178 -1.213 1
1 962 . 2 1 1 A 76 76 VAL HA H 76 5.230 4.849 0.381 1
1 970 . 2 1 1 A 76 76 VAL C C 76 173.758 174.396 -0.638 1
1 971 . 2 1 1 A 76 76 VAL CA C 76 58.193 58.789 -0.596 1
1 972 . 2 1 1 A 76 76 VAL CB C 76 36.536 35.394 1.142 1
1 975 . 2 1 1 A 76 76 VAL N N 76 116.220 118.019 -1.799 1
1 976 . 2 1 1 A 77 77 GLU H H 77 9.166 9.090 0.076 1
1 977 . 2 1 1 A 77 77 GLU HA H 77 4.663 4.991 -0.328 1
1 982 . 2 1 1 A 77 77 GLU C C 77 174.940 174.761 0.179 1
1 983 . 2 1 1 A 77 77 GLU CA C 77 53.546 54.252 -0.706 1
1 984 . 2 1 1 A 77 77 GLU CB C 77 33.395 33.548 -0.153 1
1 986 . 2 1 1 A 77 77 GLU N N 77 116.413 121.049 -4.636 1
1 987 . 2 1 1 A 78 78 LEU H H 78 8.670 8.856 -0.186 1
1 988 . 2 1 1 A 78 78 LEU HA H 78 4.677 4.844 -0.167 1
1 998 . 2 1 1 A 78 78 LEU C C 78 176.036 176.239 -0.203 1
1 999 . 2 1 1 A 78 78 LEU CA C 78 53.091 53.639 -0.548 1
1 1000 . 2 1 1 A 78 78 LEU CB C 78 43.276 43.741 -0.465 1
1 1004 . 2 1 1 A 78 78 LEU N N 78 117.927 123.630 -5.703 1
1 1005 . 2 1 1 A 79 79 ILE H H 79 7.900 8.904 -1.004 1
1 1006 . 2 1 1 A 79 79 ILE HA H 79 4.312 4.577 -0.265 1
1 1016 . 2 1 1 A 79 79 ILE C C 79 175.179 175.832 -0.653 1
1 1017 . 2 1 1 A 79 79 ILE CA C 79 58.294 60.157 -1.863 1
1 1018 . 2 1 1 A 79 79 ILE CB C 79 36.086 37.982 -1.896 1
1 1022 . 2 1 1 A 79 79 ILE N N 79 121.667 124.586 -2.919 1
1 1023 . 2 1 1 A 80 80 ASN H H 80 9.412 8.906 0.506 1
1 1024 . 2 1 1 A 80 80 ASN HA H 80 4.516 4.288 0.228 1
1 1029 . 2 1 1 A 80 80 ASN C C 80 170.300 173.573 -3.273 1
1 1030 . 2 1 1 A 80 80 ASN CA C 80 54.198 53.911 0.287 1
1 1031 . 2 1 1 A 80 80 ASN CB C 80 37.450 37.054 0.396 1
1 1033 . 2 1 1 A 80 80 ASN N N 80 123.831 123.073 0.758 1
1 1035 . 2 1 1 A 81 81 PRO HA H 81 5.185 4.793 0.392 1
1 1042 . 2 1 1 A 81 81 PRO C C 81 176.865 176.523 0.342 1
1 1043 . 2 1 1 A 81 81 PRO CA C 81 62.637 62.512 0.125 1
1 1044 . 2 1 1 A 81 81 PRO CB C 81 32.965 32.422 0.543 1
1 1047 . 2 1 1 A 82 82 ILE H H 82 9.374 8.603 0.771 1
1 1048 . 2 1 1 A 82 82 ILE HA H 82 4.524 5.011 -0.487 1
1 1058 . 2 1 1 A 82 82 ILE C C 82 174.731 174.540 0.191 1
1 1059 . 2 1 1 A 82 82 ILE CA C 82 60.205 58.652 1.553 1
1 1060 . 2 1 1 A 82 82 ILE CB C 82 41.737 42.072 -0.335 1
1 1064 . 2 1 1 A 82 82 ILE N N 82 121.658 117.497 4.161 1
1 1065 . 2 1 1 A 83 83 ALA H H 83 8.819 8.728 0.091 1
1 1066 . 2 1 1 A 83 83 ALA HA H 83 4.773 4.774 -0.001 1
1 1070 . 2 1 1 A 83 83 ALA C C 83 176.550 176.234 0.316 1
1 1071 . 2 1 1 A 83 83 ALA CA C 83 52.069 51.668 0.401 1
1 1072 . 2 1 1 A 83 83 ALA CB C 83 20.374 19.345 1.029 1
1 1073 . 2 1 1 A 83 83 ALA N N 83 127.933 125.276 2.657 1
1 1074 . 2 1 1 A 84 84 ASP H H 84 8.710 8.518 0.192 1
1 1075 . 2 1 1 A 84 84 ASP HA H 84 4.894 4.731 0.163 1
1 1078 . 2 1 1 A 84 84 ASP C C 84 175.997 176.761 -0.764 1
1 1079 . 2 1 1 A 84 84 ASP CA C 84 53.334 53.282 0.052 1
1 1080 . 2 1 1 A 84 84 ASP CB C 84 42.104 40.505 1.599 1
1 1081 . 2 1 1 A 84 84 ASP N N 84 122.009 124.346 -2.337 1
1 1082 . 2 1 1 A 85 85 THR H H 85 8.349 8.590 -0.241 1
1 1083 . 2 1 1 A 85 85 THR HA H 85 4.420 4.195 0.225 1
1 1088 . 2 1 1 A 85 85 THR C C 85 175.085 175.757 -0.672 1
1 1089 . 2 1 1 A 85 85 THR CA C 85 62.304 64.893 -2.589 1
1 1090 . 2 1 1 A 85 85 THR CB C 85 69.718 68.701 1.017 1
1 1092 . 2 1 1 A 85 85 THR N N 85 114.986 119.090 -4.104 1
1 1093 . 2 1 1 A 86 86 VAL H H 86 8.188 7.956 0.232 1
1 1094 . 2 1 1 A 86 86 VAL HA H 86 4.021 4.073 -0.052 1
1 1102 . 2 1 1 A 86 86 VAL C C 86 176.519 177.497 -0.978 1
1 1103 . 2 1 1 A 86 86 VAL CA C 86 63.046 64.391 -1.345 1
1 1104 . 2 1 1 A 86 86 VAL CB C 86 32.526 31.284 1.242 1
1 1107 . 2 1 1 A 86 86 VAL N N 86 122.275 119.528 2.747 1
1 1108 . 2 1 1 A 87 87 ALA H H 87 8.194 8.086 0.108 1
1 1109 . 2 1 1 A 87 87 ALA HA H 87 4.212 4.111 0.101 1
1 1113 . 2 1 1 A 87 87 ALA C C 87 178.118 180.108 -1.990 1
1 1114 . 2 1 1 A 87 87 ALA CA C 87 53.153 55.459 -2.306 1
1 1115 . 2 1 1 A 87 87 ALA CB C 87 19.165 18.732 0.433 1
1 1116 . 2 1 1 A 87 87 ALA N N 87 126.609 125.364 1.245 1
1 1117 . 2 1 1 A 88 88 THR H H 88 7.914 8.067 -0.153 1
1 1118 . 2 1 1 A 88 88 THR HA H 88 4.173 3.959 0.214 1
1 1123 . 2 1 1 A 88 88 THR C C 88 174.516 176.784 -2.268 1
1 1124 . 2 1 1 A 88 88 THR CA C 88 62.785 65.058 -2.273 1
1 1125 . 2 1 1 A 88 88 THR CB C 88 69.582 68.916 0.666 1
1 1127 . 2 1 1 A 88 88 THR N N 88 112.328 112.437 -0.109 1
1 1128 . 2 1 1 A 89 89 ALA H H 89 8.076 8.016 0.060 1
1 1129 . 2 1 1 A 89 89 ALA HA H 89 4.320 4.146 0.174 1
1 1133 . 2 1 1 A 89 89 ALA C C 89 178.014 179.151 -1.137 1
1 1134 . 2 1 1 A 89 89 ALA CA C 89 53.079 54.605 -1.526 1
1 1135 . 2 1 1 A 89 89 ALA CB C 89 19.335 18.239 1.096 1
1 1136 . 2 1 1 A 89 89 ALA N N 89 124.632 123.335 1.297 1
1 1137 . 2 1 1 A 90 90 THR H H 90 7.976 7.531 0.445 1
1 1138 . 2 1 1 A 90 90 THR HA H 90 4.203 4.026 0.177 1
1 1143 . 2 1 1 A 90 90 THR C C 90 174.427 173.725 0.702 1
1 1144 . 2 1 1 A 90 90 THR CA C 90 62.519 64.216 -1.697 1
1 1145 . 2 1 1 A 90 90 THR CB C 90 69.721 69.916 -0.195 1
1 1147 . 2 1 1 A 90 90 THR N N 90 112.047 110.629 1.418 1
1 1148 . 2 1 1 A 91 91 TYR H H 91 7.959 8.125 -0.166 1
1 1149 . 2 1 1 A 91 91 TYR HA H 91 4.564 5.008 -0.444 1
1 1156 . 2 1 1 A 91 91 TYR C C 91 175.522 174.832 0.690 1
1 1157 . 2 1 1 A 91 91 TYR CA C 91 57.874 56.253 1.621 1
1 1158 . 2 1 1 A 91 91 TYR CB C 91 38.584 38.911 -0.327 1
1 1163 . 2 1 1 A 91 91 TYR N N 91 121.184 117.785 3.399 1
1 1164 . 2 1 1 A 92 92 GLN H H 92 8.310 8.582 -0.272 1
1 1165 . 2 1 1 A 92 92 GLN HA H 92 4.258 4.352 -0.094 1
1 1172 . 2 1 1 A 92 92 GLN C C 92 176.099 176.897 -0.798 1
1 1173 . 2 1 1 A 92 92 GLN CA C 92 56.109 57.567 -1.458 1
1 1174 . 2 1 1 A 92 92 GLN CB C 92 29.112 28.819 0.293 1
1 1177 . 2 1 1 A 92 92 GLN N N 92 121.631 123.886 -2.255 1
1 1179 . 2 1 1 A 93 93 GLY H H 93 8.052 8.842 -0.790 1
1 1180 . 2 1 1 A 93 93 GLY HA2 H 93 4.023 4.037 -0.014 1
1 1181 . 2 1 1 A 93 93 GLY HA3 H 93 3.856 4.042 -0.186 1
1 1182 . 2 1 1 A 93 93 GLY C C 93 173.791 174.574 -0.783 1
1 1183 . 2 1 1 A 93 93 GLY CA C 93 45.382 45.276 0.106 1
1 1184 . 2 1 1 A 93 93 GLY N N 93 109.847 112.359 -2.512 1
1 1185 . 2 1 1 A 94 94 ALA H H 94 8.162 7.872 0.290 1
1 1186 . 2 1 1 A 94 94 ALA HA H 94 4.329 4.700 -0.371 1
1 1190 . 2 1 1 A 94 94 ALA C C 94 177.392 177.765 -0.373 1
1 1191 . 2 1 1 A 94 94 ALA CA C 94 52.558 51.068 1.490 1
1 1192 . 2 1 1 A 94 94 ALA CB C 94 19.526 19.652 -0.126 1
1 1193 . 2 1 1 A 94 94 ALA N N 94 123.424 120.152 3.272 1
1 1194 . 2 1 1 A 95 95 ASP H H 95 8.457 8.387 0.070 1
1 1195 . 2 1 1 A 95 95 ASP HA H 95 4.608 4.549 0.059 1
1 1198 . 2 1 1 A 95 95 ASP C C 95 175.630 178.631 -3.001 1
1 1199 . 2 1 1 A 95 95 ASP CA C 95 54.450 57.059 -2.609 1
1 1200 . 2 1 1 A 95 95 ASP CB C 95 40.871 41.256 -0.385 1
1 1201 . 2 1 1 A 95 95 ASP N N 95 118.814 119.455 -0.641 1
1 1202 . 2 1 1 A 96 96 VAL H H 96 7.776 7.980 -0.204 1
1 1203 . 2 1 1 A 96 96 VAL HA H 96 4.141 3.896 0.245 1
1 1211 . 2 1 1 A 96 96 VAL C C 96 175.301 175.915 -0.614 1
1 1212 . 2 1 1 A 96 96 VAL CA C 96 61.435 64.614 -3.179 1
1 1213 . 2 1 1 A 96 96 VAL CB C 96 33.517 31.792 1.725 1
1 1216 . 2 1 1 A 96 96 VAL N N 96 118.395 119.439 -1.044 1
1 1217 . 2 1 1 A 97 97 ASP H H 97 8.315 7.922 0.393 1
1 1218 . 2 1 1 A 97 97 ASP HA H 97 4.681 4.921 -0.240 1
1 1221 . 2 1 1 A 97 97 ASP C C 97 175.151 175.396 -0.245 1
1 1222 . 2 1 1 A 97 97 ASP CA C 97 54.324 53.306 1.018 1
1 1223 . 2 1 1 A 97 97 ASP CB C 97 41.963 39.568 2.395 1
1 1224 . 2 1 1 A 97 97 ASP N N 97 123.905 119.891 4.014 1
1 1225 . 2 1 1 A 98 98 TRP H H 98 8.210 8.588 -0.378 1
1 1226 . 2 1 1 A 98 98 TRP HA H 98 4.916 4.642 0.274 1
1 1235 . 2 1 1 A 98 98 TRP C C 98 174.585 175.744 -1.159 1
1 1236 . 2 1 1 A 98 98 TRP CA C 98 56.164 57.035 -0.871 1
1 1237 . 2 1 1 A 98 98 TRP CB C 98 31.466 30.233 1.233 1
1 1243 . 2 1 1 A 98 98 TRP N N 98 120.340 124.471 -4.131 1
1 1245 . 2 1 1 A 99 99 TYR H H 99 8.760 9.205 -0.445 1
1 1246 . 2 1 1 A 99 99 TYR HA H 99 5.119 5.495 -0.376 1
1 1253 . 2 1 1 A 99 99 TYR C C 99 174.599 174.730 -0.131 1
1 1254 . 2 1 1 A 99 99 TYR CA C 99 57.021 57.253 -0.232 1
1 1255 . 2 1 1 A 99 99 TYR CB C 99 39.526 40.016 -0.490 1
1 1260 . 2 1 1 A 99 99 TYR N N 99 123.319 119.416 3.903 1
1 1261 . 2 1 1 A 100 100 ILE H H 100 8.936 8.929 0.007 1
1 1262 . 2 1 1 A 100 100 ILE HA H 100 4.850 4.612 0.238 1
1 1272 . 2 1 1 A 100 100 ILE C C 100 175.070 174.965 0.105 1
1 1273 . 2 1 1 A 100 100 ILE CA C 100 58.998 60.170 -1.172 1
1 1274 . 2 1 1 A 100 100 ILE CB C 100 40.667 37.910 2.757 1
1 1278 . 2 1 1 A 100 100 ILE N N 100 123.281 124.508 -1.227 1
1 1279 . 2 1 1 A 101 101 LYS H H 101 8.987 8.962 0.025 1
1 1280 . 2 1 1 A 101 101 LYS HA H 101 5.313 5.281 0.032 1
1 1289 . 2 1 1 A 101 101 LYS C C 101 174.440 175.880 -1.440 1
1 1290 . 2 1 1 A 101 101 LYS CA C 101 54.763 55.413 -0.650 1
1 1291 . 2 1 1 A 101 101 LYS CB C 101 34.880 33.984 0.896 1
1 1295 . 2 1 1 A 101 101 LYS N N 101 126.210 127.418 -1.208 1
1 1296 . 2 1 1 A 102 102 ALA H H 102 8.531 8.133 0.398 1
1 1297 . 2 1 1 A 102 102 ALA HA H 102 4.957 4.881 0.076 1
1 1301 . 2 1 1 A 102 102 ALA C C 102 175.024 177.769 -2.745 1
1 1302 . 2 1 1 A 102 102 ALA CA C 102 50.701 50.077 0.624 1
1 1303 . 2 1 1 A 102 102 ALA CB C 102 21.618 22.415 -0.797 1
1 1304 . 2 1 1 A 102 102 ALA N N 102 121.424 126.835 -5.411 1
1 1305 . 2 1 1 A 103 103 ASP H H 103 8.339 9.370 -1.031 1
1 1306 . 2 1 1 A 103 103 ASP HA H 103 4.603 4.578 0.025 1
1 1309 . 2 1 1 A 103 103 ASP C C 103 176.188 175.199 0.989 1
1 1310 . 2 1 1 A 103 103 ASP CA C 103 56.049 56.172 -0.123 1
1 1311 . 2 1 1 A 103 103 ASP CB C 103 40.932 42.145 -1.213 1
1 1312 . 2 1 1 A 103 103 ASP N N 103 117.773 118.150 -0.377 1
1 1313 . 2 1 1 A 104 104 ASP H H 104 7.482 7.421 0.061 1
1 1314 . 2 1 1 A 104 104 ASP HA H 104 4.727 4.982 -0.255 1
1 1317 . 2 1 1 A 104 104 ASP C C 104 174.261 173.778 0.483 1
1 1318 . 2 1 1 A 104 104 ASP CA C 104 52.768 53.358 -0.590 1
1 1319 . 2 1 1 A 104 104 ASP CB C 104 42.587 43.686 -1.099 1
1 1320 . 2 1 1 A 104 104 ASP N N 104 110.673 116.150 -5.477 1
1 1321 . 2 1 1 A 105 105 ILE H H 105 9.267 8.427 0.840 1
1 1322 . 2 1 1 A 105 105 ILE HA H 105 4.631 4.929 -0.298 1
1 1332 . 2 1 1 A 105 105 ILE C C 105 173.922 175.593 -1.671 1
1 1333 . 2 1 1 A 105 105 ILE CA C 105 61.114 60.355 0.759 1
1 1334 . 2 1 1 A 105 105 ILE CB C 105 42.522 40.667 1.855 1
1 1338 . 2 1 1 A 105 105 ILE N N 105 121.380 122.043 -0.663 1
1 1339 . 2 1 1 A 106 106 VAL H H 106 8.592 8.901 -0.309 1
1 1340 . 2 1 1 A 106 106 VAL HA H 106 4.975 5.047 -0.072 1
1 1348 . 2 1 1 A 106 106 VAL C C 106 175.049 175.230 -0.181 1
1 1349 . 2 1 1 A 106 106 VAL CA C 106 58.028 59.132 -1.104 1
1 1350 . 2 1 1 A 106 106 VAL CB C 106 35.388 35.472 -0.084 1
1 1353 . 2 1 1 A 106 106 VAL N N 106 116.356 121.128 -4.772 1
1 1354 . 2 1 1 A 107 107 LEU H H 107 8.360 8.378 -0.018 1
1 1355 . 2 1 1 A 107 107 LEU HA H 107 4.167 4.084 0.083 1
1 1365 . 2 1 1 A 107 107 LEU C C 107 178.338 177.555 0.783 1
1 1366 . 2 1 1 A 107 107 LEU CA C 107 55.077 54.717 0.360 1
1 1367 . 2 1 1 A 107 107 LEU CB C 107 42.394 42.126 0.268 1
1 1371 . 2 1 1 A 107 107 LEU N N 107 121.368 122.869 -1.501 1
1 1372 . 2 1 1 A 108 108 THR H H 108 7.977 8.610 -0.633 1
1 1373 . 2 1 1 A 108 108 THR HA H 108 4.039 4.328 -0.289 1
1 1378 . 2 1 1 A 108 108 THR C C 108 174.725 174.246 0.479 1
1 1379 . 2 1 1 A 108 108 THR CA C 108 63.513 63.668 -0.155 1
1 1380 . 2 1 1 A 108 108 THR CB C 108 69.194 68.798 0.396 1
1 1382 . 2 1 1 A 108 108 THR N N 108 118.728 118.395 0.333 1
1 1383 . 2 1 1 A 109 109 LEU H H 109 8.378 8.865 -0.487 1
1 1384 . 2 1 1 A 109 109 LEU HA H 109 4.274 4.256 0.018 1
1 1394 . 2 1 1 A 109 109 LEU C C 109 177.058 176.431 0.627 1
1 1395 . 2 1 1 A 109 109 LEU CA C 109 55.045 54.612 0.433 1
1 1396 . 2 1 1 A 109 109 LEU CB C 109 42.620 40.564 2.056 1
1 1400 . 2 1 1 A 109 109 LEU N N 109 124.847 128.226 -3.379 1
1 9 . 3 1 1 A 2 2 MET HA H 2 4.554 4.802 -0.248 1
1 14 . 3 1 1 A 2 2 MET C C 2 174.749 173.870 0.879 1
1 15 . 3 1 1 A 2 2 MET CA C 2 55.354 54.404 0.950 1
1 16 . 3 1 1 A 2 2 MET CB C 2 33.729 35.054 -1.325 1
1 18 . 3 1 1 A 3 3 ARG H H 3 8.518 8.858 -0.340 1
1 19 . 3 1 1 A 3 3 ARG HA H 3 4.531 4.950 -0.419 1
1 26 . 3 1 1 A 3 3 ARG C C 3 175.780 175.446 0.334 1
1 27 . 3 1 1 A 3 3 ARG CA C 3 55.854 54.842 1.012 1
1 28 . 3 1 1 A 3 3 ARG CB C 3 31.403 32.485 -1.082 1
1 31 . 3 1 1 A 3 3 ARG N N 3 124.008 121.666 2.342 1
1 32 . 3 1 1 A 4 4 LEU H H 4 8.424 8.729 -0.305 1
1 33 . 3 1 1 A 4 4 LEU HA H 4 4.457 4.754 -0.297 1
1 43 . 3 1 1 A 4 4 LEU C C 4 177.362 178.212 -0.850 1
1 44 . 3 1 1 A 4 4 LEU CA C 4 54.511 53.466 1.045 1
1 45 . 3 1 1 A 4 4 LEU CB C 4 42.686 43.258 -0.572 1
1 49 . 3 1 1 A 4 4 LEU N N 4 124.389 125.015 -0.626 1
1 50 . 3 1 1 A 5 5 ALA H H 5 8.418 8.604 -0.186 1
1 51 . 3 1 1 A 5 5 ALA HA H 5 4.254 4.189 0.065 1
1 55 . 3 1 1 A 5 5 ALA C C 5 177.420 176.945 0.475 1
1 56 . 3 1 1 A 5 5 ALA CA C 5 52.931 54.322 -1.391 1
1 57 . 3 1 1 A 5 5 ALA CB C 5 19.263 18.782 0.481 1
1 58 . 3 1 1 A 5 5 ALA N N 5 124.548 122.666 1.882 1
1 59 . 3 1 1 A 6 6 ASN H H 6 8.287 7.673 0.614 1
1 60 . 3 1 1 A 6 6 ASN HA H 6 4.616 4.652 -0.036 1
1 65 . 3 1 1 A 6 6 ASN C C 6 175.837 175.242 0.595 1
1 66 . 3 1 1 A 6 6 ASN CA C 6 53.345 52.617 0.728 1
1 67 . 3 1 1 A 6 6 ASN CB C 6 38.571 38.733 -0.162 1
1 69 . 3 1 1 A 6 6 ASN N N 6 116.484 116.067 0.417 1
1 71 . 3 1 1 A 7 7 GLY H H 7 8.351 8.419 -0.068 1
1 72 . 3 1 1 A 7 7 GLY HA2 H 7 4.130 4.004 0.126 1
1 73 . 3 1 1 A 7 7 GLY HA3 H 7 3.808 4.005 -0.197 1
1 74 . 3 1 1 A 7 7 GLY C C 7 173.750 174.407 -0.657 1
1 75 . 3 1 1 A 7 7 GLY CA C 7 45.343 46.275 -0.932 1
1 76 . 3 1 1 A 7 7 GLY N N 7 108.453 112.417 -3.964 1
1 77 . 3 1 1 A 8 8 ILE H H 8 7.868 7.780 0.088 1
1 78 . 3 1 1 A 8 8 ILE HA H 8 4.130 4.781 -0.651 1
1 88 . 3 1 1 A 8 8 ILE C C 8 175.570 174.777 0.793 1
1 89 . 3 1 1 A 8 8 ILE CA C 8 61.095 59.156 1.939 1
1 90 . 3 1 1 A 8 8 ILE CB C 8 38.694 40.198 -1.504 1
1 94 . 3 1 1 A 8 8 ILE N N 8 120.848 115.375 5.473 1
1 95 . 3 1 1 A 9 9 VAL H H 9 8.220 8.897 -0.677 1
1 96 . 3 1 1 A 9 9 VAL HA H 9 4.172 4.556 -0.384 1
1 104 . 3 1 1 A 9 9 VAL C C 9 175.898 175.843 0.055 1
1 105 . 3 1 1 A 9 9 VAL CA C 9 62.488 61.009 1.479 1
1 106 . 3 1 1 A 9 9 VAL CB C 9 32.460 34.834 -2.374 1
1 109 . 3 1 1 A 9 9 VAL N N 9 125.805 122.070 3.735 1
1 110 . 3 1 1 A 10 10 LEU H H 10 8.437 8.692 -0.255 1
1 111 . 3 1 1 A 10 10 LEU HA H 10 4.347 4.428 -0.081 1
1 121 . 3 1 1 A 10 10 LEU C C 10 176.398 177.263 -0.865 1
1 122 . 3 1 1 A 10 10 LEU CA C 10 54.787 53.974 0.813 1
1 123 . 3 1 1 A 10 10 LEU CB C 10 42.639 43.815 -1.176 1
1 127 . 3 1 1 A 10 10 LEU N N 10 127.757 126.671 1.086 1
1 128 . 3 1 1 A 11 11 ASP H H 11 8.506 8.982 -0.476 1
1 129 . 3 1 1 A 11 11 ASP HA H 11 4.683 4.765 -0.082 1
1 132 . 3 1 1 A 11 11 ASP C C 11 176.672 175.915 0.757 1
1 133 . 3 1 1 A 11 11 ASP CA C 11 53.586 55.423 -1.837 1
1 134 . 3 1 1 A 11 11 ASP CB C 11 41.123 40.896 0.227 1
1 135 . 3 1 1 A 11 11 ASP N N 11 121.539 118.328 3.211 1
1 136 . 3 1 1 A 12 12 LYS H H 12 8.578 7.594 0.984 1
1 137 . 3 1 1 A 12 12 LYS HA H 12 3.943 4.511 -0.568 1
1 146 . 3 1 1 A 12 12 LYS C C 12 176.917 175.810 1.107 1
1 147 . 3 1 1 A 12 12 LYS CA C 12 58.542 56.008 2.534 1
1 148 . 3 1 1 A 12 12 LYS CB C 12 32.703 34.242 -1.539 1
1 152 . 3 1 1 A 12 12 LYS N N 12 123.635 118.075 5.560 1
1 153 . 3 1 1 A 13 13 ASP H H 13 8.523 9.125 -0.602 1
1 154 . 3 1 1 A 13 13 ASP HA H 13 4.566 4.492 0.074 1
1 157 . 3 1 1 A 13 13 ASP C C 13 177.535 176.583 0.952 1
1 158 . 3 1 1 A 13 13 ASP CA C 13 56.034 55.418 0.616 1
1 159 . 3 1 1 A 13 13 ASP CB C 13 41.051 40.303 0.748 1
1 160 . 3 1 1 A 13 13 ASP N N 13 120.448 125.490 -5.042 1
1 161 . 3 1 1 A 14 14 THR H H 14 7.964 7.836 0.128 1
1 162 . 3 1 1 A 14 14 THR HA H 14 4.146 4.366 -0.220 1
1 167 . 3 1 1 A 14 14 THR C C 14 175.440 175.455 -0.015 1
1 168 . 3 1 1 A 14 14 THR CA C 14 63.245 61.624 1.621 1
1 169 . 3 1 1 A 14 14 THR CB C 14 69.092 68.435 0.657 1
1 171 . 3 1 1 A 14 14 THR N N 14 113.711 112.863 0.848 1
1 172 . 3 1 1 A 15 15 THR H H 15 7.921 7.963 -0.042 1
1 173 . 3 1 1 A 15 15 THR HA H 15 3.920 4.076 -0.156 1
1 178 . 3 1 1 A 15 15 THR C C 15 174.750 175.215 -0.465 1
1 179 . 3 1 1 A 15 15 THR CA C 15 64.562 64.433 0.129 1
1 180 . 3 1 1 A 15 15 THR CB C 15 69.166 68.379 0.787 1
1 182 . 3 1 1 A 15 15 THR N N 15 116.710 117.959 -1.249 1
1 183 . 3 1 1 A 16 16 PHE H H 16 8.191 7.715 0.476 1
1 184 . 3 1 1 A 16 16 PHE HA H 16 4.628 4.636 -0.008 1
1 192 . 3 1 1 A 16 16 PHE C C 16 177.754 176.016 1.738 1
1 193 . 3 1 1 A 16 16 PHE CA C 16 57.975 58.080 -0.105 1
1 194 . 3 1 1 A 16 16 PHE CB C 16 39.553 39.160 0.393 1
1 200 . 3 1 1 A 16 16 PHE N N 16 117.124 119.577 -2.453 1
1 201 . 3 1 1 A 17 17 GLY H H 17 8.110 8.163 -0.053 1
1 202 . 3 1 1 A 17 17 GLY HA2 H 17 4.017 4.124 -0.107 1
1 203 . 3 1 1 A 17 17 GLY HA3 H 17 3.849 4.140 -0.291 1
1 204 . 3 1 1 A 17 17 GLY C C 17 172.231 173.470 -1.239 1
1 205 . 3 1 1 A 17 17 GLY CA C 17 45.633 45.746 -0.113 1
1 206 . 3 1 1 A 17 17 GLY N N 17 109.951 107.720 2.231 1
1 207 . 3 1 1 A 18 18 GLU H H 18 8.304 8.447 -0.143 1
1 208 . 3 1 1 A 18 18 GLU HA H 18 4.078 4.560 -0.482 1
1 213 . 3 1 1 A 18 18 GLU C C 18 175.588 176.189 -0.601 1
1 214 . 3 1 1 A 18 18 GLU CA C 18 57.446 55.986 1.460 1
1 215 . 3 1 1 A 18 18 GLU CB C 18 30.767 30.740 0.027 1
1 217 . 3 1 1 A 18 18 GLU N N 18 121.640 121.898 -0.258 1
1 218 . 3 1 1 A 19 19 LEU H H 19 8.799 8.634 0.165 1
1 219 . 3 1 1 A 19 19 LEU HA H 19 5.416 4.746 0.670 1
1 229 . 3 1 1 A 19 19 LEU C C 19 176.875 176.140 0.735 1
1 230 . 3 1 1 A 19 19 LEU CA C 19 53.281 53.962 -0.681 1
1 231 . 3 1 1 A 19 19 LEU CB C 19 45.508 42.328 3.180 1
1 235 . 3 1 1 A 19 19 LEU N N 19 127.101 125.261 1.840 1
1 236 . 3 1 1 A 20 20 LYS H H 20 8.494 8.783 -0.289 1
1 237 . 3 1 1 A 20 20 LYS HA H 20 5.200 5.393 -0.193 1
1 246 . 3 1 1 A 20 20 LYS C C 20 176.163 175.553 0.610 1
1 247 . 3 1 1 A 20 20 LYS CA C 20 53.575 54.635 -1.060 1
1 248 . 3 1 1 A 20 20 LYS CB C 20 36.835 34.937 1.898 1
1 252 . 3 1 1 A 20 20 LYS N N 20 118.828 124.437 -5.609 1
1 253 . 3 1 1 A 21 21 PHE H H 21 9.658 8.975 0.683 1
1 254 . 3 1 1 A 21 21 PHE HA H 21 4.038 4.457 -0.419 1
1 262 . 3 1 1 A 21 21 PHE C C 21 174.296 174.655 -0.359 1
1 263 . 3 1 1 A 21 21 PHE CA C 21 60.462 59.439 1.023 1
1 264 . 3 1 1 A 21 21 PHE CB C 21 40.359 39.719 0.640 1
1 270 . 3 1 1 A 21 21 PHE N N 21 124.322 126.742 -2.420 1
1 271 . 3 1 1 A 22 22 SER H H 22 7.199 7.643 -0.444 1
1 272 . 3 1 1 A 22 22 SER HA H 22 5.046 3.932 1.114 1
1 275 . 3 1 1 A 22 22 SER C C 22 173.080 173.870 -0.790 1
1 276 . 3 1 1 A 22 22 SER CA C 22 58.547 58.830 -0.283 1
1 277 . 3 1 1 A 22 22 SER CB C 22 63.591 64.944 -1.353 1
1 278 . 3 1 1 A 22 22 SER N N 22 120.109 118.857 1.252 1
1 279 . 3 1 1 A 23 23 ALA H H 23 7.269 6.894 0.375 1
1 280 . 3 1 1 A 23 23 ALA HA H 23 4.426 4.373 0.053 1
1 284 . 3 1 1 A 23 23 ALA C C 23 176.568 174.477 2.091 1
1 285 . 3 1 1 A 23 23 ALA CA C 23 52.458 51.189 1.269 1
1 286 . 3 1 1 A 23 23 ALA CB C 23 22.728 22.135 0.593 1
1 287 . 3 1 1 A 23 23 ALA N N 23 114.102 117.966 -3.864 1
1 288 . 3 1 1 A 24 24 LEU H H 24 8.819 8.684 0.135 1
1 289 . 3 1 1 A 24 24 LEU HA H 24 4.060 4.634 -0.574 1
1 299 . 3 1 1 A 24 24 LEU C C 24 175.363 176.894 -1.531 1
1 300 . 3 1 1 A 24 24 LEU CA C 24 56.901 54.580 2.321 1
1 301 . 3 1 1 A 24 24 LEU CB C 24 42.065 42.316 -0.251 1
1 305 . 3 1 1 A 24 24 LEU N N 24 120.865 120.693 0.172 1
1 306 . 3 1 1 A 25 25 ARG H H 25 9.473 9.072 0.401 1
1 307 . 3 1 1 A 25 25 ARG HA H 25 4.428 4.172 0.256 1
1 315 . 3 1 1 A 25 25 ARG C C 25 175.729 175.549 0.180 1
1 316 . 3 1 1 A 25 25 ARG CA C 25 56.721 57.944 -1.223 1
1 317 . 3 1 1 A 25 25 ARG CB C 25 31.109 31.236 -0.127 1
1 320 . 3 1 1 A 25 25 ARG N N 25 130.455 128.381 2.074 1
1 322 . 3 1 1 A 26 26 ARG H H 26 7.711 7.304 0.407 1
1 323 . 3 1 1 A 26 26 ARG HA H 26 4.559 4.540 0.019 1
1 330 . 3 1 1 A 26 26 ARG C C 26 173.724 173.805 -0.081 1
1 331 . 3 1 1 A 26 26 ARG CA C 26 55.737 55.777 -0.040 1
1 332 . 3 1 1 A 26 26 ARG CB C 26 33.261 33.720 -0.459 1
1 335 . 3 1 1 A 26 26 ARG N N 26 113.305 118.470 -5.165 1
1 336 . 3 1 1 A 27 27 GLU H H 27 8.848 8.589 0.259 1
1 337 . 3 1 1 A 27 27 GLU HA H 27 4.615 4.676 -0.061 1
1 342 . 3 1 1 A 27 27 GLU C C 27 174.836 176.276 -1.440 1
1 343 . 3 1 1 A 27 27 GLU CA C 27 55.901 55.702 0.199 1
1 344 . 3 1 1 A 27 27 GLU CB C 27 30.755 29.809 0.946 1
1 346 . 3 1 1 A 27 27 GLU N N 27 121.934 125.341 -3.407 1
1 347 . 3 1 1 A 28 28 VAL H H 28 8.603 8.223 0.380 1
1 348 . 3 1 1 A 28 28 VAL HA H 28 4.013 4.087 -0.074 1
1 356 . 3 1 1 A 28 28 VAL C C 28 175.561 175.898 -0.337 1
1 357 . 3 1 1 A 28 28 VAL CA C 28 62.791 61.929 0.862 1
1 358 . 3 1 1 A 28 28 VAL CB C 28 32.710 32.224 0.486 1
1 361 . 3 1 1 A 28 28 VAL N N 28 125.545 123.542 2.003 1
1 362 . 3 1 1 A 29 29 ARG H H 29 8.735 8.570 0.165 1
1 363 . 3 1 1 A 29 29 ARG HA H 29 4.774 4.692 0.082 1
1 370 . 3 1 1 A 29 29 ARG C C 29 176.580 176.362 0.218 1
1 371 . 3 1 1 A 29 29 ARG CA C 29 55.481 54.092 1.389 1
1 372 . 3 1 1 A 29 29 ARG CB C 29 31.963 31.618 0.345 1
1 375 . 3 1 1 A 29 29 ARG N N 29 128.327 125.993 2.334 1
1 376 . 3 1 1 A 30 30 ILE H H 30 8.358 8.789 -0.431 1
1 377 . 3 1 1 A 30 30 ILE HA H 30 3.882 4.327 -0.445 1
1 387 . 3 1 1 A 30 30 ILE C C 30 175.093 174.860 0.233 1
1 388 . 3 1 1 A 30 30 ILE CA C 30 61.669 61.181 0.488 1
1 389 . 3 1 1 A 30 30 ILE CB C 30 38.806 37.151 1.655 1
1 393 . 3 1 1 A 30 30 ILE N N 30 121.957 122.819 -0.862 1
1 394 . 3 1 1 A 31 31 GLN H H 31 8.560 8.732 -0.172 1
1 395 . 3 1 1 A 31 31 GLN HA H 31 4.647 4.650 -0.003 1
1 402 . 3 1 1 A 31 31 GLN C C 31 175.954 175.897 0.057 1
1 403 . 3 1 1 A 31 31 GLN CA C 31 54.833 55.812 -0.979 1
1 404 . 3 1 1 A 31 31 GLN CB C 31 30.584 29.375 1.209 1
1 407 . 3 1 1 A 31 31 GLN N N 31 126.348 128.446 -2.098 1
1 409 . 3 1 1 A 32 32 ASN H H 32 8.994 8.732 0.262 1
1 410 . 3 1 1 A 32 32 ASN HA H 32 4.784 4.745 0.039 1
1 415 . 3 1 1 A 32 32 ASN C C 32 177.296 176.775 0.521 1
1 416 . 3 1 1 A 32 32 ASN CA C 32 53.206 53.327 -0.121 1
1 417 . 3 1 1 A 32 32 ASN CB C 32 39.472 39.428 0.044 1
1 419 . 3 1 1 A 32 32 ASN N N 32 122.834 125.399 -2.565 1
1 421 . 3 1 1 A 33 33 GLU H H 33 9.180 8.932 0.248 1
1 422 . 3 1 1 A 33 33 GLU HA H 33 4.063 4.080 -0.017 1
1 427 . 3 1 1 A 33 33 GLU C C 33 176.787 178.298 -1.511 1
1 428 . 3 1 1 A 33 33 GLU CA C 33 59.347 59.107 0.240 1
1 429 . 3 1 1 A 33 33 GLU CB C 33 29.294 29.128 0.166 1
1 431 . 3 1 1 A 33 33 GLU N N 33 122.736 121.738 0.998 1
1 432 . 3 1 1 A 34 34 ASP H H 34 7.969 7.975 -0.006 1
1 433 . 3 1 1 A 34 34 ASP HA H 34 4.499 4.513 -0.014 1
1 436 . 3 1 1 A 34 34 ASP C C 34 177.111 176.232 0.879 1
1 437 . 3 1 1 A 34 34 ASP CA C 34 53.632 54.693 -1.061 1
1 438 . 3 1 1 A 34 34 ASP CB C 34 39.807 41.161 -1.354 1
1 439 . 3 1 1 A 34 34 ASP N N 34 115.921 118.487 -2.566 1
1 440 . 3 1 1 A 35 35 GLY H H 35 8.083 7.727 0.356 1
1 441 . 3 1 1 A 35 35 GLY HA2 H 35 4.366 4.022 0.344 1
1 442 . 3 1 1 A 35 35 GLY HA3 H 35 3.657 4.023 -0.366 1
1 443 . 3 1 1 A 35 35 GLY C C 35 174.584 174.818 -0.234 1
1 444 . 3 1 1 A 35 35 GLY CA C 35 45.134 45.273 -0.139 1
1 445 . 3 1 1 A 35 35 GLY N N 35 108.874 106.642 2.232 1
1 446 . 3 1 1 A 36 36 SER H H 36 8.274 7.958 0.316 1
1 447 . 3 1 1 A 36 36 SER HA H 36 4.389 4.436 -0.047 1
1 450 . 3 1 1 A 36 36 SER C C 36 173.284 173.667 -0.383 1
1 451 . 3 1 1 A 36 36 SER CA C 36 58.383 59.389 -1.006 1
1 452 . 3 1 1 A 36 36 SER CB C 36 64.576 64.432 0.144 1
1 453 . 3 1 1 A 36 36 SER N N 36 117.428 117.290 0.138 1
1 454 . 3 1 1 A 37 37 VAL H H 37 8.508 8.564 -0.056 1
1 455 . 3 1 1 A 37 37 VAL HA H 37 4.346 4.346 0.000 1
1 463 . 3 1 1 A 37 37 VAL C C 37 176.370 175.453 0.917 1
1 464 . 3 1 1 A 37 37 VAL CA C 37 62.410 61.835 0.575 1
1 465 . 3 1 1 A 37 37 VAL CB C 37 33.086 32.846 0.240 1
1 468 . 3 1 1 A 37 37 VAL N N 37 119.189 125.025 -5.836 1
1 469 . 3 1 1 A 38 38 SER H H 38 8.461 8.933 -0.472 1
1 470 . 3 1 1 A 38 38 SER HA H 38 4.586 4.651 -0.065 1
1 473 . 3 1 1 A 38 38 SER C C 38 173.829 175.632 -1.803 1
1 474 . 3 1 1 A 38 38 SER CA C 38 57.618 57.769 -0.151 1
1 475 . 3 1 1 A 38 38 SER CB C 38 64.537 64.381 0.156 1
1 476 . 3 1 1 A 38 38 SER N N 38 121.629 121.485 0.144 1
1 477 . 3 1 1 A 39 39 ASP H H 39 8.512 8.800 -0.288 1
1 478 . 3 1 1 A 39 39 ASP HA H 39 4.606 4.503 0.103 1
1 481 . 3 1 1 A 39 39 ASP C C 39 176.557 176.857 -0.300 1
1 482 . 3 1 1 A 39 39 ASP CA C 39 54.833 55.740 -0.907 1
1 483 . 3 1 1 A 39 39 ASP CB C 39 41.123 40.566 0.557 1
1 484 . 3 1 1 A 39 39 ASP N N 39 120.305 124.706 -4.401 1
1 485 . 3 1 1 A 40 40 GLU H H 40 8.311 7.571 0.740 1
1 486 . 3 1 1 A 40 40 GLU HA H 40 4.235 4.388 -0.153 1
1 491 . 3 1 1 A 40 40 GLU C C 40 175.327 175.925 -0.598 1
1 492 . 3 1 1 A 40 40 GLU CA C 40 56.215 57.452 -1.237 1
1 493 . 3 1 1 A 40 40 GLU CB C 40 30.788 30.184 0.604 1
1 495 . 3 1 1 A 40 40 GLU N N 40 120.680 120.128 0.552 1
1 496 . 3 1 1 A 41 41 ILE H H 41 8.465 8.847 -0.382 1
1 497 . 3 1 1 A 41 41 ILE HA H 41 4.127 4.354 -0.227 1
1 507 . 3 1 1 A 41 41 ILE C C 41 175.380 175.923 -0.543 1
1 508 . 3 1 1 A 41 41 ILE CA C 41 60.670 60.302 0.368 1
1 509 . 3 1 1 A 41 41 ILE CB C 41 38.805 39.343 -0.538 1
1 513 . 3 1 1 A 41 41 ILE N N 41 123.665 123.887 -0.222 1
1 514 . 3 1 1 A 42 42 LYS H H 42 9.556 9.327 0.229 1
1 515 . 3 1 1 A 42 42 LYS HA H 42 4.428 4.382 0.046 1
1 524 . 3 1 1 A 42 42 LYS C C 42 177.277 175.560 1.717 1
1 525 . 3 1 1 A 42 42 LYS CA C 42 57.274 57.452 -0.178 1
1 526 . 3 1 1 A 42 42 LYS CB C 42 35.169 33.797 1.372 1
1 530 . 3 1 1 A 42 42 LYS N N 42 125.597 127.903 -2.306 1
1 531 . 3 1 1 A 43 43 GLU H H 43 7.809 7.468 0.341 1
1 532 . 3 1 1 A 43 43 GLU HA H 43 4.886 4.907 -0.021 1
1 537 . 3 1 1 A 43 43 GLU C C 43 173.593 174.564 -0.971 1
1 538 . 3 1 1 A 43 43 GLU CA C 43 54.669 54.814 -0.145 1
1 539 . 3 1 1 A 43 43 GLU CB C 43 32.882 34.770 -1.888 1
1 541 . 3 1 1 A 43 43 GLU N N 43 115.292 116.116 -0.824 1
1 542 . 3 1 1 A 44 44 ARG H H 44 8.879 8.843 0.036 1
1 543 . 3 1 1 A 44 44 ARG HA H 44 4.917 4.865 0.052 1
1 551 . 3 1 1 A 44 44 ARG C C 44 173.708 174.882 -1.174 1
1 552 . 3 1 1 A 44 44 ARG CA C 44 55.965 54.723 1.242 1
1 553 . 3 1 1 A 44 44 ARG CB C 44 33.579 31.987 1.592 1
1 556 . 3 1 1 A 44 44 ARG N N 44 118.233 121.838 -3.605 1
1 558 . 3 1 1 A 45 45 THR H H 45 8.892 8.994 -0.102 1
1 559 . 3 1 1 A 45 45 THR HA H 45 5.308 4.877 0.431 1
1 564 . 3 1 1 A 45 45 THR C C 45 173.357 173.037 0.320 1
1 565 . 3 1 1 A 45 45 THR CA C 45 60.939 62.133 -1.194 1
1 566 . 3 1 1 A 45 45 THR CB C 45 70.054 69.773 0.281 1
1 568 . 3 1 1 A 45 45 THR N N 45 118.457 120.155 -1.698 1
1 569 . 3 1 1 A 46 46 TYR H H 46 9.625 9.658 -0.033 1
1 570 . 3 1 1 A 46 46 TYR HA H 46 4.771 5.159 -0.388 1
1 578 . 3 1 1 A 46 46 TYR C C 46 173.735 174.833 -1.098 1
1 579 . 3 1 1 A 46 46 TYR CA C 46 57.480 55.913 1.567 1
1 580 . 3 1 1 A 46 46 TYR CB C 46 41.724 42.437 -0.713 1
1 585 . 3 1 1 A 46 46 TYR N N 46 125.916 126.209 -0.293 1
1 586 . 3 1 1 A 47 47 ASP H H 47 9.006 8.931 0.075 1
1 587 . 3 1 1 A 47 47 ASP HA H 47 5.399 4.967 0.432 1
1 590 . 3 1 1 A 47 47 ASP C C 47 175.094 174.579 0.515 1
1 591 . 3 1 1 A 47 47 ASP CA C 47 53.460 53.707 -0.247 1
1 592 . 3 1 1 A 47 47 ASP CB C 47 41.947 41.578 0.369 1
1 593 . 3 1 1 A 47 47 ASP N N 47 122.109 122.489 -0.380 1
1 594 . 3 1 1 A 48 48 LEU H H 48 9.066 8.750 0.316 1
1 595 . 3 1 1 A 48 48 LEU HA H 48 4.831 5.035 -0.204 1
1 605 . 3 1 1 A 48 48 LEU C C 48 174.977 175.421 -0.444 1
1 606 . 3 1 1 A 48 48 LEU CA C 48 52.724 53.203 -0.479 1
1 607 . 3 1 1 A 48 48 LEU CB C 48 44.844 44.997 -0.153 1
1 611 . 3 1 1 A 48 48 LEU N N 48 121.879 125.093 -3.214 1
1 612 . 3 1 1 A 49 49 LYS H H 49 9.401 8.773 0.628 1
1 613 . 3 1 1 A 49 49 LYS HA H 49 4.477 4.855 -0.378 1
1 622 . 3 1 1 A 49 49 LYS C C 49 176.225 175.860 0.365 1
1 623 . 3 1 1 A 49 49 LYS CA C 49 56.017 54.313 1.704 1
1 624 . 3 1 1 A 49 49 LYS CB C 49 33.838 34.724 -0.886 1
1 628 . 3 1 1 A 49 49 LYS N N 49 122.218 122.066 0.152 1
1 629 . 3 1 1 A 50 50 SER H H 50 8.266 8.921 -0.655 1
1 630 . 3 1 1 A 50 50 SER HA H 50 5.222 4.982 0.240 1
1 633 . 3 1 1 A 50 50 SER C C 50 175.570 174.827 0.743 1
1 634 . 3 1 1 A 50 50 SER CA C 50 55.770 57.298 -1.528 1
1 635 . 3 1 1 A 50 50 SER CB C 50 64.738 64.170 0.568 1
1 636 . 3 1 1 A 50 50 SER N N 50 117.388 116.874 0.514 1
1 637 . 3 1 1 A 51 51 LYS H H 51 9.276 8.781 0.495 1
1 638 . 3 1 1 A 51 51 LYS HA H 51 4.208 3.946 0.262 1
1 647 . 3 1 1 A 51 51 LYS C C 51 178.773 179.184 -0.411 1
1 648 . 3 1 1 A 51 51 LYS CA C 51 58.674 59.840 -1.166 1
1 649 . 3 1 1 A 51 51 LYS CB C 51 33.383 32.183 1.200 1
1 653 . 3 1 1 A 51 51 LYS N N 51 130.550 125.189 5.361 1
1 654 . 3 1 1 A 52 52 GLY H H 52 8.320 8.567 -0.247 1
1 655 . 3 1 1 A 52 52 GLY HA2 H 52 3.875 3.725 0.150 1
1 656 . 3 1 1 A 52 52 GLY HA3 H 52 3.628 3.742 -0.114 1
1 657 . 3 1 1 A 52 52 GLY C C 52 175.108 175.892 -0.784 1
1 658 . 3 1 1 A 52 52 GLY CA C 52 46.322 47.191 -0.869 1
1 659 . 3 1 1 A 52 52 GLY N N 52 107.053 107.056 -0.003 1
1 660 . 3 1 1 A 53 53 GLN H H 53 7.859 7.879 -0.020 1
1 661 . 3 1 1 A 53 53 GLN HA H 53 4.409 4.428 -0.019 1
1 668 . 3 1 1 A 53 53 GLN C C 53 176.469 176.408 0.061 1
1 669 . 3 1 1 A 53 53 GLN CA C 53 54.911 55.782 -0.871 1
1 670 . 3 1 1 A 53 53 GLN CB C 53 29.675 29.682 -0.007 1
1 673 . 3 1 1 A 53 53 GLN N N 53 115.482 120.291 -4.809 1
1 675 . 3 1 1 A 54 54 GLY H H 54 7.992 9.073 -1.081 1
1 676 . 3 1 1 A 54 54 GLY HA2 H 54 3.934 3.913 0.021 1
1 677 . 3 1 1 A 54 54 GLY HA3 H 54 3.934 3.914 0.020 1
1 678 . 3 1 1 A 54 54 GLY C C 54 173.897 173.684 0.213 1
1 679 . 3 1 1 A 54 54 GLY CA C 54 46.574 45.734 0.840 1
1 680 . 3 1 1 A 54 54 GLY N N 54 110.111 108.560 1.551 1
1 681 . 3 1 1 A 55 55 ARG H H 55 7.652 7.361 0.291 1
1 682 . 3 1 1 A 55 55 ARG HA H 55 4.665 4.981 -0.316 1
1 690 . 3 1 1 A 55 55 ARG C C 55 174.649 174.708 -0.059 1
1 691 . 3 1 1 A 55 55 ARG CA C 55 54.631 54.069 0.562 1
1 692 . 3 1 1 A 55 55 ARG CB C 55 32.166 33.611 -1.445 1
1 695 . 3 1 1 A 55 55 ARG N N 55 114.214 116.193 -1.979 1
1 697 . 3 1 1 A 56 56 MET H H 56 8.593 8.431 0.162 1
1 698 . 3 1 1 A 56 56 MET HA H 56 5.012 5.082 -0.070 1
1 703 . 3 1 1 A 56 56 MET C C 56 176.216 175.882 0.334 1
1 704 . 3 1 1 A 56 56 MET CA C 56 54.595 55.218 -0.623 1
1 705 . 3 1 1 A 56 56 MET CB C 56 33.466 33.470 -0.004 1
1 707 . 3 1 1 A 56 56 MET N N 56 121.270 119.789 1.481 1
1 708 . 3 1 1 A 57 57 ILE H H 57 9.393 8.867 0.526 1
1 709 . 3 1 1 A 57 57 ILE HA H 57 4.717 4.614 0.103 1
1 719 . 3 1 1 A 57 57 ILE C C 57 173.883 173.591 0.292 1
1 720 . 3 1 1 A 57 57 ILE CA C 57 59.713 58.611 1.102 1
1 721 . 3 1 1 A 57 57 ILE CB C 57 40.933 41.530 -0.597 1
1 725 . 3 1 1 A 57 57 ILE N N 57 120.811 116.439 4.372 1
1 726 . 3 1 1 A 58 58 GLN H H 58 8.218 7.932 0.286 1
1 727 . 3 1 1 A 58 58 GLN HA H 58 5.407 4.828 0.579 1
1 734 . 3 1 1 A 58 58 GLN C C 58 175.368 174.387 0.981 1
1 735 . 3 1 1 A 58 58 GLN CA C 58 55.163 55.088 0.075 1
1 736 . 3 1 1 A 58 58 GLN CB C 58 30.841 28.808 2.033 1
1 739 . 3 1 1 A 58 58 GLN N N 58 122.281 122.951 -0.670 1
1 741 . 3 1 1 A 59 59 VAL H H 59 9.188 8.477 0.711 1
1 742 . 3 1 1 A 59 59 VAL HA H 59 5.025 4.947 0.078 1
1 750 . 3 1 1 A 59 59 VAL C C 59 175.330 175.341 -0.011 1
1 751 . 3 1 1 A 59 59 VAL CA C 59 59.975 61.286 -1.311 1
1 752 . 3 1 1 A 59 59 VAL CB C 59 34.818 32.987 1.831 1
1 755 . 3 1 1 A 59 59 VAL N N 59 122.421 126.625 -4.204 1
1 756 . 3 1 1 A 60 60 SER H H 60 9.022 9.332 -0.310 1
1 757 . 3 1 1 A 60 60 SER HA H 60 5.811 5.597 0.214 1
1 760 . 3 1 1 A 60 60 SER C C 60 173.234 174.101 -0.867 1
1 761 . 3 1 1 A 60 60 SER CA C 60 57.634 57.577 0.057 1
1 762 . 3 1 1 A 60 60 SER CB C 60 64.891 64.657 0.234 1
1 763 . 3 1 1 A 60 60 SER N N 60 124.709 125.208 -0.499 1
1 764 . 3 1 1 A 61 61 ILE H H 61 9.226 8.827 0.399 1
1 765 . 3 1 1 A 61 61 ILE HA H 61 5.572 5.036 0.536 1
1 775 . 3 1 1 A 61 61 ILE C C 61 173.955 173.918 0.037 1
1 776 . 3 1 1 A 61 61 ILE CA C 61 56.937 57.117 -0.180 1
1 777 . 3 1 1 A 61 61 ILE CB C 61 39.596 39.902 -0.306 1
1 781 . 3 1 1 A 61 61 ILE N N 61 121.648 121.127 0.521 1
1 782 . 3 1 1 A 62 62 PRO HA H 62 4.606 4.526 0.080 1
1 789 . 3 1 1 A 62 62 PRO C C 62 178.143 177.683 0.460 1
1 790 . 3 1 1 A 62 62 PRO CA C 62 63.740 63.113 0.627 1
1 791 . 3 1 1 A 62 62 PRO CB C 62 33.303 32.695 0.608 1
1 794 . 3 1 1 A 63 63 ALA H H 63 7.803 8.964 -1.161 1
1 795 . 3 1 1 A 63 63 ALA HA H 63 4.037 4.079 -0.042 1
1 799 . 3 1 1 A 63 63 ALA C C 63 175.942 179.613 -3.671 1
1 800 . 3 1 1 A 63 63 ALA CA C 63 54.417 55.054 -0.637 1
1 801 . 3 1 1 A 63 63 ALA CB C 63 19.345 17.911 1.434 1
1 802 . 3 1 1 A 63 63 ALA N N 63 123.695 127.771 -4.076 1
1 803 . 3 1 1 A 64 64 SER H H 64 7.719 8.199 -0.480 1
1 804 . 3 1 1 A 64 64 SER HA H 64 4.097 4.154 -0.057 1
1 807 . 3 1 1 A 64 64 SER C C 64 175.199 174.750 0.449 1
1 808 . 3 1 1 A 64 64 SER CA C 64 59.474 61.280 -1.806 1
1 809 . 3 1 1 A 64 64 SER CB C 64 62.125 63.196 -1.071 1
1 810 . 3 1 1 A 64 64 SER N N 64 110.001 112.359 -2.358 1
1 811 . 3 1 1 A 65 65 VAL H H 65 7.790 7.641 0.149 1
1 812 . 3 1 1 A 65 65 VAL HA H 65 4.360 4.125 0.235 1
1 820 . 3 1 1 A 65 65 VAL C C 65 174.433 174.299 0.134 1
1 821 . 3 1 1 A 65 65 VAL CA C 65 60.335 61.167 -0.832 1
1 822 . 3 1 1 A 65 65 VAL CB C 65 32.714 32.350 0.364 1
1 825 . 3 1 1 A 65 65 VAL N N 65 126.142 122.186 3.956 1
1 826 . 3 1 1 A 66 66 PRO HA H 66 4.369 4.373 -0.004 1
1 833 . 3 1 1 A 66 66 PRO C C 66 177.412 176.172 1.240 1
1 834 . 3 1 1 A 66 66 PRO CA C 66 63.104 63.232 -0.128 1
1 835 . 3 1 1 A 66 66 PRO CB C 66 32.558 32.030 0.528 1
1 838 . 3 1 1 A 67 67 LEU H H 67 8.578 8.319 0.259 1
1 839 . 3 1 1 A 67 67 LEU HA H 67 3.875 4.434 -0.559 1
1 849 . 3 1 1 A 67 67 LEU C C 67 176.077 176.917 -0.840 1
1 850 . 3 1 1 A 67 67 LEU CA C 67 56.413 55.479 0.934 1
1 851 . 3 1 1 A 67 67 LEU CB C 67 43.279 43.530 -0.251 1
1 855 . 3 1 1 A 67 67 LEU N N 67 124.236 124.757 -0.521 1
1 856 . 3 1 1 A 68 68 LYS H H 68 7.994 8.496 -0.502 1
1 857 . 3 1 1 A 68 68 LYS HA H 68 3.793 3.773 0.020 1
1 866 . 3 1 1 A 68 68 LYS C C 68 175.601 176.161 -0.560 1
1 867 . 3 1 1 A 68 68 LYS CA C 68 53.350 56.194 -2.844 1
1 868 . 3 1 1 A 68 68 LYS CB C 68 31.035 31.817 -0.782 1
1 872 . 3 1 1 A 68 68 LYS N N 68 124.053 125.593 -1.540 1
1 873 . 3 1 1 A 69 69 GLU H H 69 8.347 7.853 0.494 1
1 874 . 3 1 1 A 69 69 GLU HA H 69 4.501 4.470 0.031 1
1 879 . 3 1 1 A 69 69 GLU C C 69 175.304 175.905 -0.601 1
1 880 . 3 1 1 A 69 69 GLU CA C 69 54.291 55.862 -1.571 1
1 881 . 3 1 1 A 69 69 GLU CB C 69 29.285 30.095 -0.810 1
1 883 . 3 1 1 A 69 69 GLU N N 69 123.876 123.203 0.673 1
1 884 . 3 1 1 A 70 70 PHE H H 70 5.549 6.955 -1.406 1
1 885 . 3 1 1 A 70 70 PHE HA H 70 4.592 4.416 0.176 1
1 893 . 3 1 1 A 70 70 PHE C C 70 174.443 175.268 -0.825 1
1 894 . 3 1 1 A 70 70 PHE CA C 70 53.313 58.184 -4.871 1
1 895 . 3 1 1 A 70 70 PHE CB C 70 38.335 39.209 -0.874 1
1 901 . 3 1 1 A 70 70 PHE N N 70 117.781 120.253 -2.472 1
1 902 . 3 1 1 A 71 71 ASP H H 71 8.791 8.881 -0.090 1
1 903 . 3 1 1 A 71 71 ASP HA H 71 4.535 5.022 -0.487 1
1 906 . 3 1 1 A 71 71 ASP C C 71 175.867 175.655 0.212 1
1 907 . 3 1 1 A 71 71 ASP CA C 71 54.248 53.691 0.557 1
1 908 . 3 1 1 A 71 71 ASP CB C 71 41.166 42.372 -1.206 1
1 909 . 3 1 1 A 71 71 ASP N N 71 120.385 121.133 -0.748 1
1 910 . 3 1 1 A 72 72 TYR H H 72 8.701 8.646 0.055 1
1 911 . 3 1 1 A 72 72 TYR HA H 72 4.283 4.623 -0.340 1
1 918 . 3 1 1 A 72 72 TYR C C 72 177.470 176.244 1.226 1
1 919 . 3 1 1 A 72 72 TYR CA C 72 60.513 59.402 1.111 1
1 920 . 3 1 1 A 72 72 TYR CB C 72 38.320 38.689 -0.369 1
1 925 . 3 1 1 A 72 72 TYR N N 72 121.876 122.715 -0.839 1
1 926 . 3 1 1 A 73 73 ASN H H 73 8.819 8.865 -0.046 1
1 927 . 3 1 1 A 73 73 ASN HA H 73 4.096 4.165 -0.069 1
1 932 . 3 1 1 A 73 73 ASN C C 73 174.362 174.483 -0.121 1
1 933 . 3 1 1 A 73 73 ASN CA C 73 54.289 54.542 -0.253 1
1 934 . 3 1 1 A 73 73 ASN CB C 73 36.907 37.001 -0.094 1
1 936 . 3 1 1 A 73 73 ASN N N 73 121.726 119.463 2.263 1
1 938 . 3 1 1 A 74 74 ALA H H 74 8.059 7.401 0.658 1
1 939 . 3 1 1 A 74 74 ALA HA H 74 4.100 4.326 -0.226 1
1 943 . 3 1 1 A 74 74 ALA C C 74 177.757 177.435 0.322 1
1 944 . 3 1 1 A 74 74 ALA CA C 74 53.153 52.663 0.490 1
1 945 . 3 1 1 A 74 74 ALA CB C 74 19.412 19.583 -0.171 1
1 946 . 3 1 1 A 74 74 ALA N N 74 122.292 121.013 1.279 1
1 947 . 3 1 1 A 75 75 ARG H H 75 8.500 8.462 0.038 1
1 948 . 3 1 1 A 75 75 ARG HA H 75 4.758 4.459 0.299 1
1 955 . 3 1 1 A 75 75 ARG C C 75 176.812 175.857 0.955 1
1 956 . 3 1 1 A 75 75 ARG CA C 75 56.646 56.211 0.435 1
1 957 . 3 1 1 A 75 75 ARG CB C 75 29.375 30.651 -1.276 1
1 960 . 3 1 1 A 75 75 ARG N N 75 122.871 121.876 0.995 1
1 961 . 3 1 1 A 76 76 VAL H H 76 7.965 8.952 -0.987 1
1 962 . 3 1 1 A 76 76 VAL HA H 76 5.230 5.118 0.112 1
1 970 . 3 1 1 A 76 76 VAL C C 76 173.758 174.406 -0.648 1
1 971 . 3 1 1 A 76 76 VAL CA C 76 58.193 58.946 -0.753 1
1 972 . 3 1 1 A 76 76 VAL CB C 76 36.536 35.411 1.125 1
1 975 . 3 1 1 A 76 76 VAL N N 76 116.220 118.261 -2.041 1
1 976 . 3 1 1 A 77 77 GLU H H 77 9.166 9.289 -0.123 1
1 977 . 3 1 1 A 77 77 GLU HA H 77 4.663 4.970 -0.307 1
1 982 . 3 1 1 A 77 77 GLU C C 77 174.940 174.629 0.311 1
1 983 . 3 1 1 A 77 77 GLU CA C 77 53.546 54.336 -0.790 1
1 984 . 3 1 1 A 77 77 GLU CB C 77 33.395 33.709 -0.314 1
1 986 . 3 1 1 A 77 77 GLU N N 77 116.413 121.444 -5.031 1
1 987 . 3 1 1 A 78 78 LEU H H 78 8.670 8.812 -0.142 1
1 988 . 3 1 1 A 78 78 LEU HA H 78 4.677 4.799 -0.122 1
1 998 . 3 1 1 A 78 78 LEU C C 78 176.036 176.372 -0.336 1
1 999 . 3 1 1 A 78 78 LEU CA C 78 53.091 53.703 -0.612 1
1 1000 . 3 1 1 A 78 78 LEU CB C 78 43.276 43.188 0.088 1
1 1004 . 3 1 1 A 78 78 LEU N N 78 117.927 124.169 -6.242 1
1 1005 . 3 1 1 A 79 79 ILE H H 79 7.900 8.415 -0.515 1
1 1006 . 3 1 1 A 79 79 ILE HA H 79 4.312 3.992 0.320 1
1 1016 . 3 1 1 A 79 79 ILE C C 79 175.179 176.514 -1.335 1
1 1017 . 3 1 1 A 79 79 ILE CA C 79 58.294 64.397 -6.103 1
1 1018 . 3 1 1 A 79 79 ILE CB C 79 36.086 38.131 -2.045 1
1 1022 . 3 1 1 A 79 79 ILE N N 79 121.667 125.340 -3.673 1
1 1023 . 3 1 1 A 80 80 ASN H H 80 9.412 8.301 1.111 1
1 1024 . 3 1 1 A 80 80 ASN HA H 80 4.516 5.227 -0.711 1
1 1029 . 3 1 1 A 80 80 ASN C C 80 170.300 172.331 -2.031 1
1 1030 . 3 1 1 A 80 80 ASN CA C 80 54.198 50.542 3.656 1
1 1031 . 3 1 1 A 80 80 ASN CB C 80 37.450 39.258 -1.808 1
1 1033 . 3 1 1 A 80 80 ASN N N 80 123.831 118.434 5.397 1
1 1035 . 3 1 1 A 81 81 PRO HA H 81 5.185 5.032 0.153 1
1 1042 . 3 1 1 A 81 81 PRO C C 81 176.865 176.385 0.480 1
1 1043 . 3 1 1 A 81 81 PRO CA C 81 62.637 62.527 0.110 1
1 1044 . 3 1 1 A 81 81 PRO CB C 81 32.965 32.500 0.465 1
1 1047 . 3 1 1 A 82 82 ILE H H 82 9.374 8.659 0.715 1
1 1048 . 3 1 1 A 82 82 ILE HA H 82 4.524 4.982 -0.458 1
1 1058 . 3 1 1 A 82 82 ILE C C 82 174.731 174.427 0.304 1
1 1059 . 3 1 1 A 82 82 ILE CA C 82 60.205 58.854 1.351 1
1 1060 . 3 1 1 A 82 82 ILE CB C 82 41.737 41.202 0.535 1
1 1064 . 3 1 1 A 82 82 ILE N N 82 121.658 116.772 4.886 1
1 1065 . 3 1 1 A 83 83 ALA H H 83 8.819 8.701 0.118 1
1 1066 . 3 1 1 A 83 83 ALA HA H 83 4.773 4.531 0.242 1
1 1070 . 3 1 1 A 83 83 ALA C C 83 176.550 176.726 -0.176 1
1 1071 . 3 1 1 A 83 83 ALA CA C 83 52.069 52.373 -0.304 1
1 1072 . 3 1 1 A 83 83 ALA CB C 83 20.374 19.323 1.051 1
1 1073 . 3 1 1 A 83 83 ALA N N 83 127.933 128.900 -0.967 1
1 1074 . 3 1 1 A 84 84 ASP H H 84 8.710 8.862 -0.152 1
1 1075 . 3 1 1 A 84 84 ASP HA H 84 4.894 4.656 0.238 1
1 1078 . 3 1 1 A 84 84 ASP C C 84 175.997 177.454 -1.457 1
1 1079 . 3 1 1 A 84 84 ASP CA C 84 53.334 54.391 -1.057 1
1 1080 . 3 1 1 A 84 84 ASP CB C 84 42.104 43.221 -1.117 1
1 1081 . 3 1 1 A 84 84 ASP N N 84 122.009 122.802 -0.793 1
1 1082 . 3 1 1 A 85 85 THR H H 85 8.349 8.700 -0.351 1
1 1083 . 3 1 1 A 85 85 THR HA H 85 4.420 4.199 0.221 1
1 1088 . 3 1 1 A 85 85 THR C C 85 175.085 175.059 0.026 1
1 1089 . 3 1 1 A 85 85 THR CA C 85 62.304 65.935 -3.631 1
1 1090 . 3 1 1 A 85 85 THR CB C 85 69.718 69.038 0.680 1
1 1092 . 3 1 1 A 85 85 THR N N 85 114.986 119.638 -4.652 1
1 1093 . 3 1 1 A 86 86 VAL H H 86 8.188 7.886 0.302 1
1 1094 . 3 1 1 A 86 86 VAL HA H 86 4.021 4.489 -0.468 1
1 1102 . 3 1 1 A 86 86 VAL C C 86 176.519 175.747 0.772 1
1 1103 . 3 1 1 A 86 86 VAL CA C 86 63.046 60.599 2.447 1
1 1104 . 3 1 1 A 86 86 VAL CB C 86 32.526 32.161 0.365 1
1 1107 . 3 1 1 A 86 86 VAL N N 86 122.275 115.258 7.017 1
1 1108 . 3 1 1 A 87 87 ALA H H 87 8.194 8.951 -0.757 1
1 1109 . 3 1 1 A 87 87 ALA HA H 87 4.212 4.318 -0.106 1
1 1113 . 3 1 1 A 87 87 ALA C C 87 178.118 178.958 -0.840 1
1 1114 . 3 1 1 A 87 87 ALA CA C 87 53.153 55.279 -2.126 1
1 1115 . 3 1 1 A 87 87 ALA CB C 87 19.165 19.024 0.141 1
1 1116 . 3 1 1 A 87 87 ALA N N 87 126.609 129.637 -3.028 1
1 1117 . 3 1 1 A 88 88 THR H H 88 7.914 7.777 0.137 1
1 1118 . 3 1 1 A 88 88 THR HA H 88 4.173 4.168 0.005 1
1 1123 . 3 1 1 A 88 88 THR C C 88 174.516 175.632 -1.116 1
1 1124 . 3 1 1 A 88 88 THR CA C 88 62.785 64.096 -1.311 1
1 1125 . 3 1 1 A 88 88 THR CB C 88 69.582 68.911 0.671 1
1 1127 . 3 1 1 A 88 88 THR N N 88 112.328 113.843 -1.515 1
1 1128 . 3 1 1 A 89 89 ALA H H 89 8.076 7.934 0.142 1
1 1129 . 3 1 1 A 89 89 ALA HA H 89 4.320 4.580 -0.260 1
1 1133 . 3 1 1 A 89 89 ALA C C 89 178.014 179.117 -1.103 1
1 1134 . 3 1 1 A 89 89 ALA CA C 89 53.079 53.113 -0.034 1
1 1135 . 3 1 1 A 89 89 ALA CB C 89 19.335 20.816 -1.481 1
1 1136 . 3 1 1 A 89 89 ALA N N 89 124.632 123.112 1.520 1
1 1137 . 3 1 1 A 90 90 THR H H 90 7.976 8.667 -0.691 1
1 1138 . 3 1 1 A 90 90 THR HA H 90 4.203 3.991 0.212 1
1 1143 . 3 1 1 A 90 90 THR C C 90 174.427 174.372 0.055 1
1 1144 . 3 1 1 A 90 90 THR CA C 90 62.519 65.599 -3.080 1
1 1145 . 3 1 1 A 90 90 THR CB C 90 69.721 67.782 1.939 1
1 1147 . 3 1 1 A 90 90 THR N N 90 112.047 110.342 1.705 1
1 1148 . 3 1 1 A 91 91 TYR H H 91 7.959 8.013 -0.054 1
1 1149 . 3 1 1 A 91 91 TYR HA H 91 4.564 4.622 -0.058 1
1 1156 . 3 1 1 A 91 91 TYR C C 91 175.522 175.073 0.449 1
1 1157 . 3 1 1 A 91 91 TYR CA C 91 57.874 56.983 0.891 1
1 1158 . 3 1 1 A 91 91 TYR CB C 91 38.584 37.341 1.243 1
1 1163 . 3 1 1 A 91 91 TYR N N 91 121.184 120.505 0.679 1
1 1164 . 3 1 1 A 92 92 GLN H H 92 8.310 8.614 -0.304 1
1 1165 . 3 1 1 A 92 92 GLN HA H 92 4.258 4.525 -0.267 1
1 1172 . 3 1 1 A 92 92 GLN C C 92 176.099 175.688 0.411 1
1 1173 . 3 1 1 A 92 92 GLN CA C 92 56.109 56.394 -0.285 1
1 1174 . 3 1 1 A 92 92 GLN CB C 92 29.112 28.013 1.099 1
1 1177 . 3 1 1 A 92 92 GLN N N 92 121.631 125.040 -3.409 1
1 1179 . 3 1 1 A 93 93 GLY H H 93 8.052 7.931 0.121 1
1 1180 . 3 1 1 A 93 93 GLY HA2 H 93 4.023 4.153 -0.130 1
1 1181 . 3 1 1 A 93 93 GLY HA3 H 93 3.856 4.165 -0.309 1
1 1182 . 3 1 1 A 93 93 GLY C C 93 173.791 172.144 1.647 1
1 1183 . 3 1 1 A 93 93 GLY CA C 93 45.382 46.028 -0.646 1
1 1184 . 3 1 1 A 93 93 GLY N N 93 109.847 110.723 -0.876 1
1 1185 . 3 1 1 A 94 94 ALA H H 94 8.162 8.339 -0.177 1
1 1186 . 3 1 1 A 94 94 ALA HA H 94 4.329 4.470 -0.141 1
1 1190 . 3 1 1 A 94 94 ALA C C 94 177.392 176.506 0.886 1
1 1191 . 3 1 1 A 94 94 ALA CA C 94 52.558 51.873 0.685 1
1 1192 . 3 1 1 A 94 94 ALA CB C 94 19.526 17.853 1.673 1
1 1193 . 3 1 1 A 94 94 ALA N N 94 123.424 123.814 -0.390 1
1 1194 . 3 1 1 A 95 95 ASP H H 95 8.457 8.443 0.014 1
1 1195 . 3 1 1 A 95 95 ASP HA H 95 4.608 5.397 -0.789 1
1 1198 . 3 1 1 A 95 95 ASP C C 95 175.630 175.108 0.522 1
1 1199 . 3 1 1 A 95 95 ASP CA C 95 54.450 52.842 1.608 1
1 1200 . 3 1 1 A 95 95 ASP CB C 95 40.871 45.276 -4.405 1
1 1201 . 3 1 1 A 95 95 ASP N N 95 118.814 123.389 -4.575 1
1 1202 . 3 1 1 A 96 96 VAL H H 96 7.776 8.794 -1.018 1
1 1203 . 3 1 1 A 96 96 VAL HA H 96 4.141 4.385 -0.244 1
1 1211 . 3 1 1 A 96 96 VAL C C 96 175.301 175.218 0.083 1
1 1212 . 3 1 1 A 96 96 VAL CA C 96 61.435 61.503 -0.068 1
1 1213 . 3 1 1 A 96 96 VAL CB C 96 33.517 34.364 -0.847 1
1 1216 . 3 1 1 A 96 96 VAL N N 96 118.395 120.398 -2.003 1
1 1217 . 3 1 1 A 97 97 ASP H H 97 8.315 7.755 0.560 1
1 1218 . 3 1 1 A 97 97 ASP HA H 97 4.681 4.791 -0.110 1
1 1221 . 3 1 1 A 97 97 ASP C C 97 175.151 175.551 -0.400 1
1 1222 . 3 1 1 A 97 97 ASP CA C 97 54.324 53.045 1.279 1
1 1223 . 3 1 1 A 97 97 ASP CB C 97 41.963 42.413 -0.450 1
1 1224 . 3 1 1 A 97 97 ASP N N 97 123.905 122.048 1.857 1
1 1225 . 3 1 1 A 98 98 TRP H H 98 8.210 8.740 -0.530 1
1 1226 . 3 1 1 A 98 98 TRP HA H 98 4.916 5.577 -0.661 1
1 1235 . 3 1 1 A 98 98 TRP C C 98 174.585 172.957 1.628 1
1 1236 . 3 1 1 A 98 98 TRP CA C 98 56.164 55.489 0.675 1
1 1237 . 3 1 1 A 98 98 TRP CB C 98 31.466 32.814 -1.348 1
1 1243 . 3 1 1 A 98 98 TRP N N 98 120.340 118.327 2.013 1
1 1245 . 3 1 1 A 99 99 TYR H H 99 8.760 9.141 -0.381 1
1 1246 . 3 1 1 A 99 99 TYR HA H 99 5.119 5.641 -0.522 1
1 1253 . 3 1 1 A 99 99 TYR C C 99 174.599 175.163 -0.564 1
1 1254 . 3 1 1 A 99 99 TYR CA C 99 57.021 56.672 0.349 1
1 1255 . 3 1 1 A 99 99 TYR CB C 99 39.526 41.309 -1.783 1
1 1260 . 3 1 1 A 99 99 TYR N N 99 123.319 119.599 3.720 1
1 1261 . 3 1 1 A 100 100 ILE H H 100 8.936 9.171 -0.235 1
1 1262 . 3 1 1 A 100 100 ILE HA H 100 4.850 4.872 -0.022 1
1 1272 . 3 1 1 A 100 100 ILE C C 100 175.070 175.209 -0.139 1
1 1273 . 3 1 1 A 100 100 ILE CA C 100 58.998 60.483 -1.485 1
1 1274 . 3 1 1 A 100 100 ILE CB C 100 40.667 39.976 0.691 1
1 1278 . 3 1 1 A 100 100 ILE N N 100 123.281 121.405 1.876 1
1 1279 . 3 1 1 A 101 101 LYS H H 101 8.987 8.871 0.116 1
1 1280 . 3 1 1 A 101 101 LYS HA H 101 5.313 5.031 0.282 1
1 1289 . 3 1 1 A 101 101 LYS C C 101 174.440 176.403 -1.963 1
1 1290 . 3 1 1 A 101 101 LYS CA C 101 54.763 56.235 -1.472 1
1 1291 . 3 1 1 A 101 101 LYS CB C 101 34.880 33.096 1.784 1
1 1295 . 3 1 1 A 101 101 LYS N N 101 126.210 127.749 -1.539 1
1 1296 . 3 1 1 A 102 102 ALA H H 102 8.531 8.382 0.149 1
1 1297 . 3 1 1 A 102 102 ALA HA H 102 4.957 4.923 0.034 1
1 1301 . 3 1 1 A 102 102 ALA C C 102 175.024 177.704 -2.680 1
1 1302 . 3 1 1 A 102 102 ALA CA C 102 50.701 50.258 0.443 1
1 1303 . 3 1 1 A 102 102 ALA CB C 102 21.618 22.572 -0.954 1
1 1304 . 3 1 1 A 102 102 ALA N N 102 121.424 126.959 -5.535 1
1 1305 . 3 1 1 A 103 103 ASP H H 103 8.339 8.720 -0.381 1
1 1306 . 3 1 1 A 103 103 ASP HA H 103 4.603 4.439 0.164 1
1 1309 . 3 1 1 A 103 103 ASP C C 103 176.188 175.383 0.805 1
1 1310 . 3 1 1 A 103 103 ASP CA C 103 56.049 56.674 -0.625 1
1 1311 . 3 1 1 A 103 103 ASP CB C 103 40.932 41.347 -0.415 1
1 1312 . 3 1 1 A 103 103 ASP N N 103 117.773 120.107 -2.334 1
1 1313 . 3 1 1 A 104 104 ASP H H 104 7.482 7.717 -0.235 1
1 1314 . 3 1 1 A 104 104 ASP HA H 104 4.727 4.935 -0.208 1
1 1317 . 3 1 1 A 104 104 ASP C C 104 174.261 173.607 0.654 1
1 1318 . 3 1 1 A 104 104 ASP CA C 104 52.768 53.806 -1.038 1
1 1319 . 3 1 1 A 104 104 ASP CB C 104 42.587 43.839 -1.252 1
1 1320 . 3 1 1 A 104 104 ASP N N 104 110.673 116.595 -5.922 1
1 1321 . 3 1 1 A 105 105 ILE H H 105 9.267 8.387 0.880 1
1 1322 . 3 1 1 A 105 105 ILE HA H 105 4.631 4.898 -0.267 1
1 1332 . 3 1 1 A 105 105 ILE C C 105 173.922 175.375 -1.453 1
1 1333 . 3 1 1 A 105 105 ILE CA C 105 61.114 60.283 0.831 1
1 1334 . 3 1 1 A 105 105 ILE CB C 105 42.522 40.594 1.928 1
1 1338 . 3 1 1 A 105 105 ILE N N 105 121.380 122.449 -1.069 1
1 1339 . 3 1 1 A 106 106 VAL H H 106 8.592 8.938 -0.346 1
1 1340 . 3 1 1 A 106 106 VAL HA H 106 4.975 5.045 -0.070 1
1 1348 . 3 1 1 A 106 106 VAL C C 106 175.049 175.214 -0.165 1
1 1349 . 3 1 1 A 106 106 VAL CA C 106 58.028 59.732 -1.704 1
1 1350 . 3 1 1 A 106 106 VAL CB C 106 35.388 35.445 -0.057 1
1 1353 . 3 1 1 A 106 106 VAL N N 106 116.356 121.066 -4.710 1
1 1354 . 3 1 1 A 107 107 LEU H H 107 8.360 8.453 -0.093 1
1 1355 . 3 1 1 A 107 107 LEU HA H 107 4.167 4.412 -0.245 1
1 1365 . 3 1 1 A 107 107 LEU C C 107 178.338 177.447 0.891 1
1 1366 . 3 1 1 A 107 107 LEU CA C 107 55.077 54.407 0.670 1
1 1367 . 3 1 1 A 107 107 LEU CB C 107 42.394 42.149 0.245 1
1 1371 . 3 1 1 A 107 107 LEU N N 107 121.368 122.479 -1.111 1
1 1372 . 3 1 1 A 108 108 THR H H 108 7.977 8.522 -0.545 1
1 1373 . 3 1 1 A 108 108 THR HA H 108 4.039 4.645 -0.606 1
1 1378 . 3 1 1 A 108 108 THR C C 108 174.725 174.715 0.010 1
1 1379 . 3 1 1 A 108 108 THR CA C 108 63.513 62.951 0.562 1
1 1380 . 3 1 1 A 108 108 THR CB C 108 69.194 69.457 -0.263 1
1 1382 . 3 1 1 A 108 108 THR N N 108 118.728 117.902 0.826 1
1 1383 . 3 1 1 A 109 109 LEU H H 109 8.378 8.886 -0.508 1
1 1384 . 3 1 1 A 109 109 LEU HA H 109 4.274 4.510 -0.236 1
1 1394 . 3 1 1 A 109 109 LEU C C 109 177.058 176.552 0.506 1
1 1395 . 3 1 1 A 109 109 LEU CA C 109 55.045 54.154 0.891 1
1 1396 . 3 1 1 A 109 109 LEU CB C 109 42.620 40.670 1.950 1
1 1400 . 3 1 1 A 109 109 LEU N N 109 124.847 126.775 -1.928 1
1 9 . 4 1 1 A 2 2 MET HA H 2 4.554 4.389 0.165 1
1 14 . 4 1 1 A 2 2 MET C C 2 174.749 176.927 -2.178 1
1 15 . 4 1 1 A 2 2 MET CA C 2 55.354 54.961 0.393 1
1 16 . 4 1 1 A 2 2 MET CB C 2 33.729 31.938 1.791 1
1 18 . 4 1 1 A 3 3 ARG H H 3 8.518 8.002 0.516 1
1 19 . 4 1 1 A 3 3 ARG HA H 3 4.531 4.018 0.513 1
1 26 . 4 1 1 A 3 3 ARG C C 3 175.780 176.059 -0.279 1
1 27 . 4 1 1 A 3 3 ARG CA C 3 55.854 57.382 -1.528 1
1 28 . 4 1 1 A 3 3 ARG CB C 3 31.403 28.149 3.254 1
1 31 . 4 1 1 A 3 3 ARG N N 3 124.008 124.217 -0.209 1
1 32 . 4 1 1 A 4 4 LEU H H 4 8.424 7.975 0.449 1
1 33 . 4 1 1 A 4 4 LEU HA H 4 4.457 3.918 0.539 1
1 43 . 4 1 1 A 4 4 LEU C C 4 177.362 178.681 -1.319 1
1 44 . 4 1 1 A 4 4 LEU CA C 4 54.511 57.863 -3.352 1
1 45 . 4 1 1 A 4 4 LEU CB C 4 42.686 42.223 0.463 1
1 49 . 4 1 1 A 4 4 LEU N N 4 124.389 120.742 3.647 1
1 50 . 4 1 1 A 5 5 ALA H H 5 8.418 7.657 0.761 1
1 51 . 4 1 1 A 5 5 ALA HA H 5 4.254 4.437 -0.183 1
1 55 . 4 1 1 A 5 5 ALA C C 5 177.420 178.309 -0.889 1
1 56 . 4 1 1 A 5 5 ALA CA C 5 52.931 53.328 -0.397 1
1 57 . 4 1 1 A 5 5 ALA CB C 5 19.263 20.362 -1.099 1
1 58 . 4 1 1 A 5 5 ALA N N 5 124.548 118.386 6.162 1
1 59 . 4 1 1 A 6 6 ASN H H 6 8.287 8.193 0.094 1
1 60 . 4 1 1 A 6 6 ASN HA H 6 4.616 4.574 0.042 1
1 65 . 4 1 1 A 6 6 ASN C C 6 175.837 176.630 -0.793 1
1 66 . 4 1 1 A 6 6 ASN CA C 6 53.345 55.533 -2.188 1
1 67 . 4 1 1 A 6 6 ASN CB C 6 38.571 38.013 0.558 1
1 69 . 4 1 1 A 6 6 ASN N N 6 116.484 116.116 0.368 1
1 71 . 4 1 1 A 7 7 GLY H H 7 8.351 8.618 -0.267 1
1 72 . 4 1 1 A 7 7 GLY HA2 H 7 4.130 3.526 0.604 1
1 73 . 4 1 1 A 7 7 GLY HA3 H 7 3.808 3.539 0.269 1
1 74 . 4 1 1 A 7 7 GLY C C 7 173.750 174.432 -0.682 1
1 75 . 4 1 1 A 7 7 GLY CA C 7 45.343 47.230 -1.887 1
1 76 . 4 1 1 A 7 7 GLY N N 7 108.453 106.920 1.533 1
1 77 . 4 1 1 A 8 8 ILE H H 8 7.868 7.642 0.226 1
1 78 . 4 1 1 A 8 8 ILE HA H 8 4.130 4.751 -0.621 1
1 88 . 4 1 1 A 8 8 ILE C C 8 175.570 174.247 1.323 1
1 89 . 4 1 1 A 8 8 ILE CA C 8 61.095 58.663 2.432 1
1 90 . 4 1 1 A 8 8 ILE CB C 8 38.694 41.634 -2.940 1
1 94 . 4 1 1 A 8 8 ILE N N 8 120.848 114.122 6.726 1
1 95 . 4 1 1 A 9 9 VAL H H 9 8.220 8.653 -0.433 1
1 96 . 4 1 1 A 9 9 VAL HA H 9 4.172 4.700 -0.528 1
1 104 . 4 1 1 A 9 9 VAL C C 9 175.898 174.667 1.231 1
1 105 . 4 1 1 A 9 9 VAL CA C 9 62.488 60.241 2.247 1
1 106 . 4 1 1 A 9 9 VAL CB C 9 32.460 35.186 -2.726 1
1 109 . 4 1 1 A 9 9 VAL N N 9 125.805 120.694 5.111 1
1 110 . 4 1 1 A 10 10 LEU H H 10 8.437 8.536 -0.099 1
1 111 . 4 1 1 A 10 10 LEU HA H 10 4.347 4.752 -0.405 1
1 121 . 4 1 1 A 10 10 LEU C C 10 176.398 177.997 -1.599 1
1 122 . 4 1 1 A 10 10 LEU CA C 10 54.787 54.527 0.260 1
1 123 . 4 1 1 A 10 10 LEU CB C 10 42.639 43.356 -0.717 1
1 127 . 4 1 1 A 10 10 LEU N N 10 127.757 124.672 3.085 1
1 128 . 4 1 1 A 11 11 ASP H H 11 8.506 8.197 0.309 1
1 129 . 4 1 1 A 11 11 ASP HA H 11 4.683 4.558 0.125 1
1 132 . 4 1 1 A 11 11 ASP C C 11 176.672 175.804 0.868 1
1 133 . 4 1 1 A 11 11 ASP CA C 11 53.586 55.852 -2.266 1
1 134 . 4 1 1 A 11 11 ASP CB C 11 41.123 41.824 -0.701 1
1 135 . 4 1 1 A 11 11 ASP N N 11 121.539 119.530 2.009 1
1 136 . 4 1 1 A 12 12 LYS H H 12 8.578 7.603 0.975 1
1 137 . 4 1 1 A 12 12 LYS HA H 12 3.943 4.867 -0.924 1
1 146 . 4 1 1 A 12 12 LYS C C 12 176.917 174.646 2.271 1
1 147 . 4 1 1 A 12 12 LYS CA C 12 58.542 54.947 3.595 1
1 148 . 4 1 1 A 12 12 LYS CB C 12 32.703 35.557 -2.854 1
1 152 . 4 1 1 A 12 12 LYS N N 12 123.635 119.175 4.460 1
1 153 . 4 1 1 A 13 13 ASP H H 13 8.523 8.706 -0.183 1
1 154 . 4 1 1 A 13 13 ASP HA H 13 4.566 4.845 -0.279 1
1 157 . 4 1 1 A 13 13 ASP C C 13 177.535 175.509 2.026 1
1 158 . 4 1 1 A 13 13 ASP CA C 13 56.034 54.225 1.809 1
1 159 . 4 1 1 A 13 13 ASP CB C 13 41.051 40.672 0.379 1
1 160 . 4 1 1 A 13 13 ASP N N 13 120.448 126.816 -6.368 1
1 161 . 4 1 1 A 14 14 THR H H 14 7.964 8.705 -0.741 1
1 162 . 4 1 1 A 14 14 THR HA H 14 4.146 4.512 -0.366 1
1 167 . 4 1 1 A 14 14 THR C C 14 175.440 173.745 1.695 1
1 168 . 4 1 1 A 14 14 THR CA C 14 63.245 63.146 0.099 1
1 169 . 4 1 1 A 14 14 THR CB C 14 69.092 69.607 -0.515 1
1 171 . 4 1 1 A 14 14 THR N N 14 113.711 120.878 -7.167 1
1 172 . 4 1 1 A 15 15 THR H H 15 7.921 8.889 -0.968 1
1 173 . 4 1 1 A 15 15 THR HA H 15 3.920 5.310 -1.390 1
1 178 . 4 1 1 A 15 15 THR C C 15 174.750 173.731 1.019 1
1 179 . 4 1 1 A 15 15 THR CA C 15 64.562 60.018 4.544 1
1 180 . 4 1 1 A 15 15 THR CB C 15 69.166 71.388 -2.222 1
1 182 . 4 1 1 A 15 15 THR N N 15 116.710 116.837 -0.127 1
1 183 . 4 1 1 A 16 16 PHE H H 16 8.191 9.247 -1.056 1
1 184 . 4 1 1 A 16 16 PHE HA H 16 4.628 4.895 -0.267 1
1 192 . 4 1 1 A 16 16 PHE C C 16 177.754 176.175 1.579 1
1 193 . 4 1 1 A 16 16 PHE CA C 16 57.975 56.742 1.233 1
1 194 . 4 1 1 A 16 16 PHE CB C 16 39.553 40.493 -0.940 1
1 200 . 4 1 1 A 16 16 PHE N N 16 117.124 122.391 -5.267 1
1 201 . 4 1 1 A 17 17 GLY H H 17 8.110 8.297 -0.187 1
1 202 . 4 1 1 A 17 17 GLY HA2 H 17 4.017 4.163 -0.146 1
1 203 . 4 1 1 A 17 17 GLY HA3 H 17 3.849 4.164 -0.315 1
1 204 . 4 1 1 A 17 17 GLY C C 17 172.231 173.296 -1.065 1
1 205 . 4 1 1 A 17 17 GLY CA C 17 45.633 44.511 1.122 1
1 206 . 4 1 1 A 17 17 GLY N N 17 109.951 109.917 0.034 1
1 207 . 4 1 1 A 18 18 GLU H H 18 8.304 8.536 -0.232 1
1 208 . 4 1 1 A 18 18 GLU HA H 18 4.078 4.277 -0.199 1
1 213 . 4 1 1 A 18 18 GLU C C 18 175.588 176.405 -0.817 1
1 214 . 4 1 1 A 18 18 GLU CA C 18 57.446 56.677 0.769 1
1 215 . 4 1 1 A 18 18 GLU CB C 18 30.767 29.480 1.287 1
1 217 . 4 1 1 A 18 18 GLU N N 18 121.640 119.899 1.741 1
1 218 . 4 1 1 A 19 19 LEU H H 19 8.799 8.615 0.184 1
1 219 . 4 1 1 A 19 19 LEU HA H 19 5.416 4.603 0.813 1
1 229 . 4 1 1 A 19 19 LEU C C 19 176.875 176.390 0.485 1
1 230 . 4 1 1 A 19 19 LEU CA C 19 53.281 55.276 -1.995 1
1 231 . 4 1 1 A 19 19 LEU CB C 19 45.508 42.313 3.195 1
1 235 . 4 1 1 A 19 19 LEU N N 19 127.101 126.509 0.592 1
1 236 . 4 1 1 A 20 20 LYS H H 20 8.494 9.068 -0.574 1
1 237 . 4 1 1 A 20 20 LYS HA H 20 5.200 5.368 -0.168 1
1 246 . 4 1 1 A 20 20 LYS C C 20 176.163 175.465 0.698 1
1 247 . 4 1 1 A 20 20 LYS CA C 20 53.575 54.517 -0.942 1
1 248 . 4 1 1 A 20 20 LYS CB C 20 36.835 35.066 1.769 1
1 252 . 4 1 1 A 20 20 LYS N N 20 118.828 121.358 -2.530 1
1 253 . 4 1 1 A 21 21 PHE H H 21 9.658 9.048 0.610 1
1 254 . 4 1 1 A 21 21 PHE HA H 21 4.038 4.599 -0.561 1
1 262 . 4 1 1 A 21 21 PHE C C 21 174.296 175.322 -1.026 1
1 263 . 4 1 1 A 21 21 PHE CA C 21 60.462 56.987 3.475 1
1 264 . 4 1 1 A 21 21 PHE CB C 21 40.359 39.021 1.338 1
1 270 . 4 1 1 A 21 21 PHE N N 21 124.322 127.013 -2.691 1
1 271 . 4 1 1 A 22 22 SER H H 22 7.199 8.730 -1.531 1
1 272 . 4 1 1 A 22 22 SER HA H 22 5.046 4.452 0.594 1
1 275 . 4 1 1 A 22 22 SER C C 22 173.080 173.728 -0.648 1
1 276 . 4 1 1 A 22 22 SER CA C 22 58.547 60.162 -1.615 1
1 277 . 4 1 1 A 22 22 SER CB C 22 63.591 63.440 0.151 1
1 278 . 4 1 1 A 22 22 SER N N 22 120.109 123.575 -3.466 1
1 279 . 4 1 1 A 23 23 ALA H H 23 7.269 6.815 0.454 1
1 280 . 4 1 1 A 23 23 ALA HA H 23 4.426 4.316 0.110 1
1 284 . 4 1 1 A 23 23 ALA C C 23 176.568 174.502 2.066 1
1 285 . 4 1 1 A 23 23 ALA CA C 23 52.458 51.289 1.169 1
1 286 . 4 1 1 A 23 23 ALA CB C 23 22.728 22.187 0.541 1
1 287 . 4 1 1 A 23 23 ALA N N 23 114.102 119.198 -5.096 1
1 288 . 4 1 1 A 24 24 LEU H H 24 8.819 8.545 0.274 1
1 289 . 4 1 1 A 24 24 LEU HA H 24 4.060 4.652 -0.592 1
1 299 . 4 1 1 A 24 24 LEU C C 24 175.363 176.590 -1.227 1
1 300 . 4 1 1 A 24 24 LEU CA C 24 56.901 54.587 2.314 1
1 301 . 4 1 1 A 24 24 LEU CB C 24 42.065 42.207 -0.142 1
1 305 . 4 1 1 A 24 24 LEU N N 24 120.865 120.553 0.312 1
1 306 . 4 1 1 A 25 25 ARG H H 25 9.473 8.946 0.527 1
1 307 . 4 1 1 A 25 25 ARG HA H 25 4.428 4.215 0.213 1
1 315 . 4 1 1 A 25 25 ARG C C 25 175.729 175.628 0.101 1
1 316 . 4 1 1 A 25 25 ARG CA C 25 56.721 57.962 -1.241 1
1 317 . 4 1 1 A 25 25 ARG CB C 25 31.109 31.205 -0.096 1
1 320 . 4 1 1 A 25 25 ARG N N 25 130.455 128.342 2.113 1
1 322 . 4 1 1 A 26 26 ARG H H 26 7.711 7.206 0.505 1
1 323 . 4 1 1 A 26 26 ARG HA H 26 4.559 4.625 -0.066 1
1 330 . 4 1 1 A 26 26 ARG C C 26 173.724 173.702 0.022 1
1 331 . 4 1 1 A 26 26 ARG CA C 26 55.737 55.842 -0.105 1
1 332 . 4 1 1 A 26 26 ARG CB C 26 33.261 33.918 -0.657 1
1 335 . 4 1 1 A 26 26 ARG N N 26 113.305 118.379 -5.074 1
1 336 . 4 1 1 A 27 27 GLU H H 27 8.848 8.708 0.140 1
1 337 . 4 1 1 A 27 27 GLU HA H 27 4.615 4.628 -0.013 1
1 342 . 4 1 1 A 27 27 GLU C C 27 174.836 175.604 -0.768 1
1 343 . 4 1 1 A 27 27 GLU CA C 27 55.901 55.490 0.411 1
1 344 . 4 1 1 A 27 27 GLU CB C 27 30.755 30.001 0.754 1
1 346 . 4 1 1 A 27 27 GLU N N 27 121.934 125.146 -3.212 1
1 347 . 4 1 1 A 28 28 VAL H H 28 8.603 8.058 0.545 1
1 348 . 4 1 1 A 28 28 VAL HA H 28 4.013 4.219 -0.206 1
1 356 . 4 1 1 A 28 28 VAL C C 28 175.561 175.803 -0.242 1
1 357 . 4 1 1 A 28 28 VAL CA C 28 62.791 61.811 0.980 1
1 358 . 4 1 1 A 28 28 VAL CB C 28 32.710 31.625 1.085 1
1 361 . 4 1 1 A 28 28 VAL N N 28 125.545 123.374 2.171 1
1 362 . 4 1 1 A 29 29 ARG H H 29 8.735 8.586 0.149 1
1 363 . 4 1 1 A 29 29 ARG HA H 29 4.774 4.573 0.201 1
1 370 . 4 1 1 A 29 29 ARG C C 29 176.580 176.525 0.055 1
1 371 . 4 1 1 A 29 29 ARG CA C 29 55.481 55.332 0.149 1
1 372 . 4 1 1 A 29 29 ARG CB C 29 31.963 31.112 0.851 1
1 375 . 4 1 1 A 29 29 ARG N N 29 128.327 127.590 0.737 1
1 376 . 4 1 1 A 30 30 ILE H H 30 8.358 8.563 -0.205 1
1 377 . 4 1 1 A 30 30 ILE HA H 30 3.882 4.066 -0.184 1
1 387 . 4 1 1 A 30 30 ILE C C 30 175.093 175.236 -0.143 1
1 388 . 4 1 1 A 30 30 ILE CA C 30 61.669 61.639 0.030 1
1 389 . 4 1 1 A 30 30 ILE CB C 30 38.806 37.172 1.634 1
1 393 . 4 1 1 A 30 30 ILE N N 30 121.957 121.807 0.150 1
1 394 . 4 1 1 A 31 31 GLN H H 31 8.560 8.785 -0.225 1
1 395 . 4 1 1 A 31 31 GLN HA H 31 4.647 4.636 0.011 1
1 402 . 4 1 1 A 31 31 GLN C C 31 175.954 175.901 0.053 1
1 403 . 4 1 1 A 31 31 GLN CA C 31 54.833 55.259 -0.426 1
1 404 . 4 1 1 A 31 31 GLN CB C 31 30.584 29.892 0.692 1
1 407 . 4 1 1 A 31 31 GLN N N 31 126.348 128.325 -1.977 1
1 409 . 4 1 1 A 32 32 ASN H H 32 8.994 9.058 -0.064 1
1 410 . 4 1 1 A 32 32 ASN HA H 32 4.784 4.752 0.032 1
1 415 . 4 1 1 A 32 32 ASN C C 32 177.296 176.556 0.740 1
1 416 . 4 1 1 A 32 32 ASN CA C 32 53.206 53.496 -0.290 1
1 417 . 4 1 1 A 32 32 ASN CB C 32 39.472 39.616 -0.144 1
1 419 . 4 1 1 A 32 32 ASN N N 32 122.834 125.291 -2.457 1
1 421 . 4 1 1 A 33 33 GLU H H 33 9.180 8.906 0.274 1
1 422 . 4 1 1 A 33 33 GLU HA H 33 4.063 4.029 0.034 1
1 427 . 4 1 1 A 33 33 GLU C C 33 176.787 178.130 -1.343 1
1 428 . 4 1 1 A 33 33 GLU CA C 33 59.347 59.378 -0.031 1
1 429 . 4 1 1 A 33 33 GLU CB C 33 29.294 29.245 0.049 1
1 431 . 4 1 1 A 33 33 GLU N N 33 122.736 121.898 0.838 1
1 432 . 4 1 1 A 34 34 ASP H H 34 7.969 7.961 0.008 1
1 433 . 4 1 1 A 34 34 ASP HA H 34 4.499 4.558 -0.059 1
1 436 . 4 1 1 A 34 34 ASP C C 34 177.111 176.176 0.935 1
1 437 . 4 1 1 A 34 34 ASP CA C 34 53.632 54.312 -0.680 1
1 438 . 4 1 1 A 34 34 ASP CB C 34 39.807 40.837 -1.030 1
1 439 . 4 1 1 A 34 34 ASP N N 34 115.921 117.352 -1.431 1
1 440 . 4 1 1 A 35 35 GLY H H 35 8.083 8.140 -0.057 1
1 441 . 4 1 1 A 35 35 GLY HA2 H 35 4.366 3.945 0.421 1
1 442 . 4 1 1 A 35 35 GLY HA3 H 35 3.657 3.947 -0.290 1
1 443 . 4 1 1 A 35 35 GLY C C 35 174.584 174.334 0.250 1
1 444 . 4 1 1 A 35 35 GLY CA C 35 45.134 45.019 0.115 1
1 445 . 4 1 1 A 35 35 GLY N N 35 108.874 106.504 2.370 1
1 446 . 4 1 1 A 36 36 SER H H 36 8.274 7.963 0.311 1
1 447 . 4 1 1 A 36 36 SER HA H 36 4.389 4.550 -0.161 1
1 450 . 4 1 1 A 36 36 SER C C 36 173.284 173.447 -0.163 1
1 451 . 4 1 1 A 36 36 SER CA C 36 58.383 58.539 -0.156 1
1 452 . 4 1 1 A 36 36 SER CB C 36 64.576 64.888 -0.312 1
1 453 . 4 1 1 A 36 36 SER N N 36 117.428 116.011 1.417 1
1 454 . 4 1 1 A 37 37 VAL H H 37 8.508 8.408 0.100 1
1 455 . 4 1 1 A 37 37 VAL HA H 37 4.346 4.485 -0.139 1
1 463 . 4 1 1 A 37 37 VAL C C 37 176.370 174.852 1.518 1
1 464 . 4 1 1 A 37 37 VAL CA C 37 62.410 60.957 1.453 1
1 465 . 4 1 1 A 37 37 VAL CB C 37 33.086 33.741 -0.655 1
1 468 . 4 1 1 A 37 37 VAL N N 37 119.189 122.729 -3.540 1
1 469 . 4 1 1 A 38 38 SER H H 38 8.461 8.927 -0.466 1
1 470 . 4 1 1 A 38 38 SER HA H 38 4.586 4.765 -0.179 1
1 473 . 4 1 1 A 38 38 SER C C 38 173.829 175.182 -1.353 1
1 474 . 4 1 1 A 38 38 SER CA C 38 57.618 56.944 0.674 1
1 475 . 4 1 1 A 38 38 SER CB C 38 64.537 64.834 -0.297 1
1 476 . 4 1 1 A 38 38 SER N N 38 121.629 121.181 0.448 1
1 477 . 4 1 1 A 39 39 ASP H H 39 8.512 8.756 -0.244 1
1 478 . 4 1 1 A 39 39 ASP HA H 39 4.606 4.351 0.255 1
1 481 . 4 1 1 A 39 39 ASP C C 39 176.557 177.284 -0.727 1
1 482 . 4 1 1 A 39 39 ASP CA C 39 54.833 57.053 -2.220 1
1 483 . 4 1 1 A 39 39 ASP CB C 39 41.123 40.510 0.613 1
1 484 . 4 1 1 A 39 39 ASP N N 39 120.305 123.904 -3.599 1
1 485 . 4 1 1 A 40 40 GLU H H 40 8.311 7.779 0.532 1
1 486 . 4 1 1 A 40 40 GLU HA H 40 4.235 4.383 -0.148 1
1 491 . 4 1 1 A 40 40 GLU C C 40 175.327 176.220 -0.893 1
1 492 . 4 1 1 A 40 40 GLU CA C 40 56.215 57.518 -1.303 1
1 493 . 4 1 1 A 40 40 GLU CB C 40 30.788 30.293 0.495 1
1 495 . 4 1 1 A 40 40 GLU N N 40 120.680 118.059 2.621 1
1 496 . 4 1 1 A 41 41 ILE H H 41 8.465 8.758 -0.293 1
1 497 . 4 1 1 A 41 41 ILE HA H 41 4.127 4.626 -0.499 1
1 507 . 4 1 1 A 41 41 ILE C C 41 175.380 175.870 -0.490 1
1 508 . 4 1 1 A 41 41 ILE CA C 41 60.670 60.004 0.666 1
1 509 . 4 1 1 A 41 41 ILE CB C 41 38.805 40.818 -2.013 1
1 513 . 4 1 1 A 41 41 ILE N N 41 123.665 123.666 -0.001 1
1 514 . 4 1 1 A 42 42 LYS H H 42 9.556 8.950 0.606 1
1 515 . 4 1 1 A 42 42 LYS HA H 42 4.428 4.244 0.184 1
1 524 . 4 1 1 A 42 42 LYS C C 42 177.277 176.748 0.529 1
1 525 . 4 1 1 A 42 42 LYS CA C 42 57.274 58.077 -0.803 1
1 526 . 4 1 1 A 42 42 LYS CB C 42 35.169 33.072 2.097 1
1 530 . 4 1 1 A 42 42 LYS N N 42 125.597 126.176 -0.579 1
1 531 . 4 1 1 A 43 43 GLU H H 43 7.809 7.679 0.130 1
1 532 . 4 1 1 A 43 43 GLU HA H 43 4.886 4.688 0.198 1
1 537 . 4 1 1 A 43 43 GLU C C 43 173.593 173.736 -0.143 1
1 538 . 4 1 1 A 43 43 GLU CA C 43 54.669 55.374 -0.705 1
1 539 . 4 1 1 A 43 43 GLU CB C 43 32.882 32.115 0.767 1
1 541 . 4 1 1 A 43 43 GLU N N 43 115.292 112.822 2.470 1
1 542 . 4 1 1 A 44 44 ARG H H 44 8.879 8.605 0.274 1
1 543 . 4 1 1 A 44 44 ARG HA H 44 4.917 4.855 0.062 1
1 551 . 4 1 1 A 44 44 ARG C C 44 173.708 174.891 -1.183 1
1 552 . 4 1 1 A 44 44 ARG CA C 44 55.965 54.688 1.277 1
1 553 . 4 1 1 A 44 44 ARG CB C 44 33.579 31.993 1.586 1
1 556 . 4 1 1 A 44 44 ARG N N 44 118.233 119.716 -1.483 1
1 558 . 4 1 1 A 45 45 THR H H 45 8.892 8.680 0.212 1
1 559 . 4 1 1 A 45 45 THR HA H 45 5.308 4.809 0.499 1
1 564 . 4 1 1 A 45 45 THR C C 45 173.357 173.016 0.341 1
1 565 . 4 1 1 A 45 45 THR CA C 45 60.939 62.088 -1.149 1
1 566 . 4 1 1 A 45 45 THR CB C 45 70.054 69.930 0.124 1
1 568 . 4 1 1 A 45 45 THR N N 45 118.457 120.204 -1.747 1
1 569 . 4 1 1 A 46 46 TYR H H 46 9.625 9.377 0.248 1
1 570 . 4 1 1 A 46 46 TYR HA H 46 4.771 5.018 -0.247 1
1 578 . 4 1 1 A 46 46 TYR C C 46 173.735 175.484 -1.749 1
1 579 . 4 1 1 A 46 46 TYR CA C 46 57.480 55.897 1.583 1
1 580 . 4 1 1 A 46 46 TYR CB C 46 41.724 41.849 -0.125 1
1 585 . 4 1 1 A 46 46 TYR N N 46 125.916 126.031 -0.115 1
1 586 . 4 1 1 A 47 47 ASP H H 47 9.006 9.029 -0.023 1
1 587 . 4 1 1 A 47 47 ASP HA H 47 5.399 4.847 0.552 1
1 590 . 4 1 1 A 47 47 ASP C C 47 175.094 175.245 -0.151 1
1 591 . 4 1 1 A 47 47 ASP CA C 47 53.460 54.447 -0.987 1
1 592 . 4 1 1 A 47 47 ASP CB C 47 41.947 41.184 0.763 1
1 593 . 4 1 1 A 47 47 ASP N N 47 122.109 123.390 -1.281 1
1 594 . 4 1 1 A 48 48 LEU H H 48 9.066 8.798 0.268 1
1 595 . 4 1 1 A 48 48 LEU HA H 48 4.831 5.217 -0.386 1
1 605 . 4 1 1 A 48 48 LEU C C 48 174.977 175.407 -0.430 1
1 606 . 4 1 1 A 48 48 LEU CA C 48 52.724 53.344 -0.620 1
1 607 . 4 1 1 A 48 48 LEU CB C 48 44.844 44.011 0.833 1
1 611 . 4 1 1 A 48 48 LEU N N 48 121.879 125.879 -4.000 1
1 612 . 4 1 1 A 49 49 LYS H H 49 9.401 8.819 0.582 1
1 613 . 4 1 1 A 49 49 LYS HA H 49 4.477 4.898 -0.421 1
1 622 . 4 1 1 A 49 49 LYS C C 49 176.225 175.097 1.128 1
1 623 . 4 1 1 A 49 49 LYS CA C 49 56.017 55.042 0.975 1
1 624 . 4 1 1 A 49 49 LYS CB C 49 33.838 34.318 -0.480 1
1 628 . 4 1 1 A 49 49 LYS N N 49 122.218 124.033 -1.815 1
1 629 . 4 1 1 A 50 50 SER H H 50 8.266 8.241 0.025 1
1 630 . 4 1 1 A 50 50 SER HA H 50 5.222 4.786 0.436 1
1 633 . 4 1 1 A 50 50 SER C C 50 175.570 174.546 1.024 1
1 634 . 4 1 1 A 50 50 SER CA C 50 55.770 56.746 -0.976 1
1 635 . 4 1 1 A 50 50 SER CB C 50 64.738 64.450 0.288 1
1 636 . 4 1 1 A 50 50 SER N N 50 117.388 117.682 -0.294 1
1 637 . 4 1 1 A 51 51 LYS H H 51 9.276 8.713 0.563 1
1 638 . 4 1 1 A 51 51 LYS HA H 51 4.208 3.904 0.304 1
1 647 . 4 1 1 A 51 51 LYS C C 51 178.773 178.998 -0.225 1
1 648 . 4 1 1 A 51 51 LYS CA C 51 58.674 59.689 -1.015 1
1 649 . 4 1 1 A 51 51 LYS CB C 51 33.383 32.127 1.256 1
1 653 . 4 1 1 A 51 51 LYS N N 51 130.550 128.413 2.137 1
1 654 . 4 1 1 A 52 52 GLY H H 52 8.320 7.969 0.351 1
1 655 . 4 1 1 A 52 52 GLY HA2 H 52 3.875 3.967 -0.092 1
1 656 . 4 1 1 A 52 52 GLY HA3 H 52 3.628 3.980 -0.352 1
1 657 . 4 1 1 A 52 52 GLY C C 52 175.108 174.702 0.406 1
1 658 . 4 1 1 A 52 52 GLY CA C 52 46.322 46.727 -0.405 1
1 659 . 4 1 1 A 52 52 GLY N N 52 107.053 107.083 -0.030 1
1 660 . 4 1 1 A 53 53 GLN H H 53 7.859 7.330 0.529 1
1 661 . 4 1 1 A 53 53 GLN HA H 53 4.409 4.448 -0.039 1
1 668 . 4 1 1 A 53 53 GLN C C 53 176.469 176.712 -0.243 1
1 669 . 4 1 1 A 53 53 GLN CA C 53 54.911 55.479 -0.568 1
1 670 . 4 1 1 A 53 53 GLN CB C 53 29.675 30.428 -0.753 1
1 673 . 4 1 1 A 53 53 GLN N N 53 115.482 117.658 -2.176 1
1 675 . 4 1 1 A 54 54 GLY H H 54 7.992 8.957 -0.965 1
1 676 . 4 1 1 A 54 54 GLY HA2 H 54 3.934 3.911 0.023 1
1 677 . 4 1 1 A 54 54 GLY HA3 H 54 3.934 3.915 0.019 1
1 678 . 4 1 1 A 54 54 GLY C C 54 173.897 173.508 0.389 1
1 679 . 4 1 1 A 54 54 GLY CA C 54 46.574 45.509 1.065 1
1 680 . 4 1 1 A 54 54 GLY N N 54 110.111 109.552 0.559 1
1 681 . 4 1 1 A 55 55 ARG H H 55 7.652 7.962 -0.310 1
1 682 . 4 1 1 A 55 55 ARG HA H 55 4.665 4.808 -0.143 1
1 690 . 4 1 1 A 55 55 ARG C C 55 174.649 175.206 -0.557 1
1 691 . 4 1 1 A 55 55 ARG CA C 55 54.631 53.977 0.654 1
1 692 . 4 1 1 A 55 55 ARG CB C 55 32.166 33.284 -1.118 1
1 695 . 4 1 1 A 55 55 ARG N N 55 114.214 119.870 -5.656 1
1 697 . 4 1 1 A 56 56 MET H H 56 8.593 8.685 -0.092 1
1 698 . 4 1 1 A 56 56 MET HA H 56 5.012 5.154 -0.142 1
1 703 . 4 1 1 A 56 56 MET C C 56 176.216 175.847 0.369 1
1 704 . 4 1 1 A 56 56 MET CA C 56 54.595 54.062 0.533 1
1 705 . 4 1 1 A 56 56 MET CB C 56 33.466 33.449 0.017 1
1 707 . 4 1 1 A 56 56 MET N N 56 121.270 119.030 2.240 1
1 708 . 4 1 1 A 57 57 ILE H H 57 9.393 9.111 0.282 1
1 709 . 4 1 1 A 57 57 ILE HA H 57 4.717 4.826 -0.109 1
1 719 . 4 1 1 A 57 57 ILE C C 57 173.883 173.923 -0.040 1
1 720 . 4 1 1 A 57 57 ILE CA C 57 59.713 58.763 0.950 1
1 721 . 4 1 1 A 57 57 ILE CB C 57 40.933 41.049 -0.116 1
1 725 . 4 1 1 A 57 57 ILE N N 57 120.811 120.258 0.553 1
1 726 . 4 1 1 A 58 58 GLN H H 58 8.218 8.204 0.014 1
1 727 . 4 1 1 A 58 58 GLN HA H 58 5.407 4.603 0.804 1
1 734 . 4 1 1 A 58 58 GLN C C 58 175.368 174.559 0.809 1
1 735 . 4 1 1 A 58 58 GLN CA C 58 55.163 55.109 0.054 1
1 736 . 4 1 1 A 58 58 GLN CB C 58 30.841 28.811 2.030 1
1 739 . 4 1 1 A 58 58 GLN N N 58 122.281 122.664 -0.383 1
1 741 . 4 1 1 A 59 59 VAL H H 59 9.188 8.655 0.533 1
1 742 . 4 1 1 A 59 59 VAL HA H 59 5.025 5.316 -0.291 1
1 750 . 4 1 1 A 59 59 VAL C C 59 175.330 175.015 0.315 1
1 751 . 4 1 1 A 59 59 VAL CA C 59 59.975 61.219 -1.244 1
1 752 . 4 1 1 A 59 59 VAL CB C 59 34.818 33.351 1.467 1
1 755 . 4 1 1 A 59 59 VAL N N 59 122.421 126.315 -3.894 1
1 756 . 4 1 1 A 60 60 SER H H 60 9.022 8.840 0.182 1
1 757 . 4 1 1 A 60 60 SER HA H 60 5.811 5.418 0.393 1
1 760 . 4 1 1 A 60 60 SER C C 60 173.234 174.044 -0.810 1
1 761 . 4 1 1 A 60 60 SER CA C 60 57.634 57.669 -0.035 1
1 762 . 4 1 1 A 60 60 SER CB C 60 64.891 64.831 0.060 1
1 763 . 4 1 1 A 60 60 SER N N 60 124.709 124.939 -0.230 1
1 764 . 4 1 1 A 61 61 ILE H H 61 9.226 8.825 0.401 1
1 765 . 4 1 1 A 61 61 ILE HA H 61 5.572 4.943 0.629 1
1 775 . 4 1 1 A 61 61 ILE C C 61 173.955 174.180 -0.225 1
1 776 . 4 1 1 A 61 61 ILE CA C 61 56.937 57.102 -0.165 1
1 777 . 4 1 1 A 61 61 ILE CB C 61 39.596 40.138 -0.542 1
1 781 . 4 1 1 A 61 61 ILE N N 61 121.648 121.588 0.060 1
1 782 . 4 1 1 A 62 62 PRO HA H 62 4.606 4.569 0.037 1
1 789 . 4 1 1 A 62 62 PRO C C 62 178.143 177.252 0.891 1
1 790 . 4 1 1 A 62 62 PRO CA C 62 63.740 62.824 0.916 1
1 791 . 4 1 1 A 62 62 PRO CB C 62 33.303 32.653 0.650 1
1 794 . 4 1 1 A 63 63 ALA H H 63 7.803 8.607 -0.804 1
1 795 . 4 1 1 A 63 63 ALA HA H 63 4.037 4.046 -0.009 1
1 799 . 4 1 1 A 63 63 ALA C C 63 175.942 179.173 -3.231 1
1 800 . 4 1 1 A 63 63 ALA CA C 63 54.417 54.707 -0.290 1
1 801 . 4 1 1 A 63 63 ALA CB C 63 19.345 18.215 1.130 1
1 802 . 4 1 1 A 63 63 ALA N N 63 123.695 126.514 -2.819 1
1 803 . 4 1 1 A 64 64 SER H H 64 7.719 7.995 -0.276 1
1 804 . 4 1 1 A 64 64 SER HA H 64 4.097 4.354 -0.257 1
1 807 . 4 1 1 A 64 64 SER C C 64 175.199 173.870 1.329 1
1 808 . 4 1 1 A 64 64 SER CA C 64 59.474 60.721 -1.247 1
1 809 . 4 1 1 A 64 64 SER CB C 64 62.125 63.518 -1.393 1
1 810 . 4 1 1 A 64 64 SER N N 64 110.001 111.636 -1.635 1
1 811 . 4 1 1 A 65 65 VAL H H 65 7.790 7.889 -0.099 1
1 812 . 4 1 1 A 65 65 VAL HA H 65 4.360 4.362 -0.002 1
1 820 . 4 1 1 A 65 65 VAL C C 65 174.433 174.215 0.218 1
1 821 . 4 1 1 A 65 65 VAL CA C 65 60.335 58.633 1.702 1
1 822 . 4 1 1 A 65 65 VAL CB C 65 32.714 33.571 -0.857 1
1 825 . 4 1 1 A 65 65 VAL N N 65 126.142 120.826 5.316 1
1 826 . 4 1 1 A 66 66 PRO HA H 66 4.369 4.584 -0.215 1
1 833 . 4 1 1 A 66 66 PRO C C 66 177.412 176.443 0.969 1
1 834 . 4 1 1 A 66 66 PRO CA C 66 63.104 62.483 0.621 1
1 835 . 4 1 1 A 66 66 PRO CB C 66 32.558 32.331 0.227 1
1 838 . 4 1 1 A 67 67 LEU H H 67 8.578 8.302 0.276 1
1 839 . 4 1 1 A 67 67 LEU HA H 67 3.875 4.395 -0.520 1
1 849 . 4 1 1 A 67 67 LEU C C 67 176.077 176.079 -0.002 1
1 850 . 4 1 1 A 67 67 LEU CA C 67 56.413 55.380 1.033 1
1 851 . 4 1 1 A 67 67 LEU CB C 67 43.279 42.807 0.472 1
1 855 . 4 1 1 A 67 67 LEU N N 67 124.236 122.963 1.273 1
1 856 . 4 1 1 A 68 68 LYS H H 68 7.994 8.176 -0.182 1
1 857 . 4 1 1 A 68 68 LYS HA H 68 3.793 4.165 -0.372 1
1 866 . 4 1 1 A 68 68 LYS C C 68 175.601 175.035 0.566 1
1 867 . 4 1 1 A 68 68 LYS CA C 68 53.350 55.218 -1.868 1
1 868 . 4 1 1 A 68 68 LYS CB C 68 31.035 32.521 -1.486 1
1 872 . 4 1 1 A 68 68 LYS N N 68 124.053 125.684 -1.631 1
1 873 . 4 1 1 A 69 69 GLU H H 69 8.347 8.352 -0.005 1
1 874 . 4 1 1 A 69 69 GLU HA H 69 4.501 4.296 0.205 1
1 879 . 4 1 1 A 69 69 GLU C C 69 175.304 174.561 0.743 1
1 880 . 4 1 1 A 69 69 GLU CA C 69 54.291 55.390 -1.099 1
1 881 . 4 1 1 A 69 69 GLU CB C 69 29.285 28.171 1.114 1
1 883 . 4 1 1 A 69 69 GLU N N 69 123.876 124.188 -0.312 1
1 884 . 4 1 1 A 70 70 PHE H H 70 5.549 8.041 -2.492 1
1 885 . 4 1 1 A 70 70 PHE HA H 70 4.592 4.916 -0.324 1
1 893 . 4 1 1 A 70 70 PHE C C 70 174.443 175.380 -0.937 1
1 894 . 4 1 1 A 70 70 PHE CA C 70 53.313 56.102 -2.789 1
1 895 . 4 1 1 A 70 70 PHE CB C 70 38.335 41.347 -3.012 1
1 901 . 4 1 1 A 70 70 PHE N N 70 117.781 123.627 -5.846 1
1 902 . 4 1 1 A 71 71 ASP H H 71 8.791 8.698 0.093 1
1 903 . 4 1 1 A 71 71 ASP HA H 71 4.535 4.820 -0.285 1
1 906 . 4 1 1 A 71 71 ASP C C 71 175.867 175.849 0.018 1
1 907 . 4 1 1 A 71 71 ASP CA C 71 54.248 52.949 1.299 1
1 908 . 4 1 1 A 71 71 ASP CB C 71 41.166 41.674 -0.508 1
1 909 . 4 1 1 A 71 71 ASP N N 71 120.385 121.138 -0.753 1
1 910 . 4 1 1 A 72 72 TYR H H 72 8.701 8.688 0.013 1
1 911 . 4 1 1 A 72 72 TYR HA H 72 4.283 4.408 -0.125 1
1 918 . 4 1 1 A 72 72 TYR C C 72 177.470 176.226 1.244 1
1 919 . 4 1 1 A 72 72 TYR CA C 72 60.513 59.451 1.062 1
1 920 . 4 1 1 A 72 72 TYR CB C 72 38.320 38.366 -0.046 1
1 925 . 4 1 1 A 72 72 TYR N N 72 121.876 121.286 0.590 1
1 926 . 4 1 1 A 73 73 ASN H H 73 8.819 9.135 -0.316 1
1 927 . 4 1 1 A 73 73 ASN HA H 73 4.096 4.108 -0.012 1
1 932 . 4 1 1 A 73 73 ASN C C 73 174.362 174.538 -0.176 1
1 933 . 4 1 1 A 73 73 ASN CA C 73 54.289 54.065 0.224 1
1 934 . 4 1 1 A 73 73 ASN CB C 73 36.907 36.520 0.387 1
1 936 . 4 1 1 A 73 73 ASN N N 73 121.726 119.769 1.957 1
1 938 . 4 1 1 A 74 74 ALA H H 74 8.059 7.507 0.552 1
1 939 . 4 1 1 A 74 74 ALA HA H 74 4.100 4.275 -0.175 1
1 943 . 4 1 1 A 74 74 ALA C C 74 177.757 177.309 0.448 1
1 944 . 4 1 1 A 74 74 ALA CA C 74 53.153 52.827 0.326 1
1 945 . 4 1 1 A 74 74 ALA CB C 74 19.412 19.398 0.014 1
1 946 . 4 1 1 A 74 74 ALA N N 74 122.292 119.420 2.872 1
1 947 . 4 1 1 A 75 75 ARG H H 75 8.500 8.374 0.126 1
1 948 . 4 1 1 A 75 75 ARG HA H 75 4.758 4.452 0.306 1
1 955 . 4 1 1 A 75 75 ARG C C 75 176.812 175.709 1.103 1
1 956 . 4 1 1 A 75 75 ARG CA C 75 56.646 56.110 0.536 1
1 957 . 4 1 1 A 75 75 ARG CB C 75 29.375 30.017 -0.642 1
1 960 . 4 1 1 A 75 75 ARG N N 75 122.871 122.277 0.594 1
1 961 . 4 1 1 A 76 76 VAL H H 76 7.965 8.876 -0.911 1
1 962 . 4 1 1 A 76 76 VAL HA H 76 5.230 5.006 0.224 1
1 970 . 4 1 1 A 76 76 VAL C C 76 173.758 173.950 -0.192 1
1 971 . 4 1 1 A 76 76 VAL CA C 76 58.193 59.025 -0.832 1
1 972 . 4 1 1 A 76 76 VAL CB C 76 36.536 35.726 0.810 1
1 975 . 4 1 1 A 76 76 VAL N N 76 116.220 117.598 -1.378 1
1 976 . 4 1 1 A 77 77 GLU H H 77 9.166 9.376 -0.210 1
1 977 . 4 1 1 A 77 77 GLU HA H 77 4.663 4.939 -0.276 1
1 982 . 4 1 1 A 77 77 GLU C C 77 174.940 173.227 1.713 1
1 983 . 4 1 1 A 77 77 GLU CA C 77 53.546 54.924 -1.378 1
1 984 . 4 1 1 A 77 77 GLU CB C 77 33.395 32.834 0.561 1
1 986 . 4 1 1 A 77 77 GLU N N 77 116.413 119.840 -3.427 1
1 987 . 4 1 1 A 78 78 LEU H H 78 8.670 8.815 -0.145 1
1 988 . 4 1 1 A 78 78 LEU HA H 78 4.677 5.068 -0.391 1
1 998 . 4 1 1 A 78 78 LEU C C 78 176.036 176.343 -0.307 1
1 999 . 4 1 1 A 78 78 LEU CA C 78 53.091 53.344 -0.253 1
1 1000 . 4 1 1 A 78 78 LEU CB C 78 43.276 44.540 -1.264 1
1 1004 . 4 1 1 A 78 78 LEU N N 78 117.927 121.377 -3.450 1
1 1005 . 4 1 1 A 79 79 ILE H H 79 7.900 8.652 -0.752 1
1 1006 . 4 1 1 A 79 79 ILE HA H 79 4.312 4.101 0.211 1
1 1016 . 4 1 1 A 79 79 ILE C C 79 175.179 176.167 -0.988 1
1 1017 . 4 1 1 A 79 79 ILE CA C 79 58.294 63.526 -5.232 1
1 1018 . 4 1 1 A 79 79 ILE CB C 79 36.086 38.282 -2.196 1
1 1022 . 4 1 1 A 79 79 ILE N N 79 121.667 123.287 -1.620 1
1 1023 . 4 1 1 A 80 80 ASN H H 80 9.412 8.269 1.143 1
1 1024 . 4 1 1 A 80 80 ASN HA H 80 4.516 5.166 -0.650 1
1 1029 . 4 1 1 A 80 80 ASN C C 80 170.300 172.352 -2.052 1
1 1030 . 4 1 1 A 80 80 ASN CA C 80 54.198 50.417 3.781 1
1 1031 . 4 1 1 A 80 80 ASN CB C 80 37.450 39.223 -1.773 1
1 1033 . 4 1 1 A 80 80 ASN N N 80 123.831 118.718 5.113 1
1 1035 . 4 1 1 A 81 81 PRO HA H 81 5.185 4.787 0.398 1
1 1042 . 4 1 1 A 81 81 PRO C C 81 176.865 176.555 0.310 1
1 1043 . 4 1 1 A 81 81 PRO CA C 81 62.637 62.089 0.548 1
1 1044 . 4 1 1 A 81 81 PRO CB C 81 32.965 32.041 0.924 1
1 1047 . 4 1 1 A 82 82 ILE H H 82 9.374 8.353 1.021 1
1 1048 . 4 1 1 A 82 82 ILE HA H 82 4.524 5.037 -0.513 1
1 1058 . 4 1 1 A 82 82 ILE C C 82 174.731 174.761 -0.030 1
1 1059 . 4 1 1 A 82 82 ILE CA C 82 60.205 58.477 1.728 1
1 1060 . 4 1 1 A 82 82 ILE CB C 82 41.737 41.216 0.521 1
1 1064 . 4 1 1 A 82 82 ILE N N 82 121.658 117.410 4.248 1
1 1065 . 4 1 1 A 83 83 ALA H H 83 8.819 8.866 -0.047 1
1 1066 . 4 1 1 A 83 83 ALA HA H 83 4.773 4.730 0.043 1
1 1070 . 4 1 1 A 83 83 ALA C C 83 176.550 176.300 0.250 1
1 1071 . 4 1 1 A 83 83 ALA CA C 83 52.069 51.766 0.303 1
1 1072 . 4 1 1 A 83 83 ALA CB C 83 20.374 19.530 0.844 1
1 1073 . 4 1 1 A 83 83 ALA N N 83 127.933 127.014 0.919 1
1 1074 . 4 1 1 A 84 84 ASP H H 84 8.710 8.683 0.027 1
1 1075 . 4 1 1 A 84 84 ASP HA H 84 4.894 5.192 -0.298 1
1 1078 . 4 1 1 A 84 84 ASP C C 84 175.997 177.285 -1.288 1
1 1079 . 4 1 1 A 84 84 ASP CA C 84 53.334 53.170 0.164 1
1 1080 . 4 1 1 A 84 84 ASP CB C 84 42.104 43.562 -1.458 1
1 1081 . 4 1 1 A 84 84 ASP N N 84 122.009 124.219 -2.210 1
1 1082 . 4 1 1 A 85 85 THR H H 85 8.349 8.408 -0.059 1
1 1083 . 4 1 1 A 85 85 THR HA H 85 4.420 4.783 -0.363 1
1 1088 . 4 1 1 A 85 85 THR C C 85 175.085 175.605 -0.520 1
1 1089 . 4 1 1 A 85 85 THR CA C 85 62.304 61.397 0.907 1
1 1090 . 4 1 1 A 85 85 THR CB C 85 69.718 69.442 0.276 1
1 1092 . 4 1 1 A 85 85 THR N N 85 114.986 115.479 -0.493 1
1 1093 . 4 1 1 A 86 86 VAL H H 86 8.188 8.215 -0.027 1
1 1094 . 4 1 1 A 86 86 VAL HA H 86 4.021 3.892 0.129 1
1 1102 . 4 1 1 A 86 86 VAL C C 86 176.519 177.427 -0.908 1
1 1103 . 4 1 1 A 86 86 VAL CA C 86 63.046 65.278 -2.232 1
1 1104 . 4 1 1 A 86 86 VAL CB C 86 32.526 31.347 1.179 1
1 1107 . 4 1 1 A 86 86 VAL N N 86 122.275 122.188 0.087 1
1 1108 . 4 1 1 A 87 87 ALA H H 87 8.194 8.118 0.076 1
1 1109 . 4 1 1 A 87 87 ALA HA H 87 4.212 4.293 -0.081 1
1 1113 . 4 1 1 A 87 87 ALA C C 87 178.118 178.106 0.012 1
1 1114 . 4 1 1 A 87 87 ALA CA C 87 53.153 53.504 -0.351 1
1 1115 . 4 1 1 A 87 87 ALA CB C 87 19.165 18.281 0.884 1
1 1116 . 4 1 1 A 87 87 ALA N N 87 126.609 123.622 2.987 1
1 1117 . 4 1 1 A 88 88 THR H H 88 7.914 8.044 -0.130 1
1 1118 . 4 1 1 A 88 88 THR HA H 88 4.173 4.128 0.045 1
1 1123 . 4 1 1 A 88 88 THR C C 88 174.516 176.097 -1.581 1
1 1124 . 4 1 1 A 88 88 THR CA C 88 62.785 64.185 -1.400 1
1 1125 . 4 1 1 A 88 88 THR CB C 88 69.582 68.776 0.806 1
1 1127 . 4 1 1 A 88 88 THR N N 88 112.328 113.432 -1.104 1
1 1128 . 4 1 1 A 89 89 ALA H H 89 8.076 7.670 0.406 1
1 1129 . 4 1 1 A 89 89 ALA HA H 89 4.320 4.364 -0.044 1
1 1133 . 4 1 1 A 89 89 ALA C C 89 178.014 179.104 -1.090 1
1 1134 . 4 1 1 A 89 89 ALA CA C 89 53.079 53.972 -0.893 1
1 1135 . 4 1 1 A 89 89 ALA CB C 89 19.335 19.719 -0.384 1
1 1136 . 4 1 1 A 89 89 ALA N N 89 124.632 122.626 2.006 1
1 1137 . 4 1 1 A 90 90 THR H H 90 7.976 7.867 0.109 1
1 1138 . 4 1 1 A 90 90 THR HA H 90 4.203 3.961 0.242 1
1 1143 . 4 1 1 A 90 90 THR C C 90 174.427 173.577 0.850 1
1 1144 . 4 1 1 A 90 90 THR CA C 90 62.519 64.241 -1.722 1
1 1145 . 4 1 1 A 90 90 THR CB C 90 69.721 69.108 0.613 1
1 1147 . 4 1 1 A 90 90 THR N N 90 112.047 112.201 -0.154 1
1 1148 . 4 1 1 A 91 91 TYR H H 91 7.959 7.465 0.494 1
1 1149 . 4 1 1 A 91 91 TYR HA H 91 4.564 4.934 -0.370 1
1 1156 . 4 1 1 A 91 91 TYR C C 91 175.522 175.649 -0.127 1
1 1157 . 4 1 1 A 91 91 TYR CA C 91 57.874 56.908 0.966 1
1 1158 . 4 1 1 A 91 91 TYR CB C 91 38.584 40.584 -2.000 1
1 1163 . 4 1 1 A 91 91 TYR N N 91 121.184 120.150 1.034 1
1 1164 . 4 1 1 A 92 92 GLN H H 92 8.310 9.072 -0.762 1
1 1165 . 4 1 1 A 92 92 GLN HA H 92 4.258 4.451 -0.193 1
1 1172 . 4 1 1 A 92 92 GLN C C 92 176.099 175.263 0.836 1
1 1173 . 4 1 1 A 92 92 GLN CA C 92 56.109 55.728 0.381 1
1 1174 . 4 1 1 A 92 92 GLN CB C 92 29.112 28.211 0.901 1
1 1177 . 4 1 1 A 92 92 GLN N N 92 121.631 122.733 -1.102 1
1 1179 . 4 1 1 A 93 93 GLY H H 93 8.052 7.959 0.093 1
1 1180 . 4 1 1 A 93 93 GLY HA2 H 93 4.023 4.158 -0.135 1
1 1181 . 4 1 1 A 93 93 GLY HA3 H 93 3.856 4.167 -0.311 1
1 1182 . 4 1 1 A 93 93 GLY C C 93 173.791 174.284 -0.493 1
1 1183 . 4 1 1 A 93 93 GLY CA C 93 45.382 44.960 0.422 1
1 1184 . 4 1 1 A 93 93 GLY N N 93 109.847 107.804 2.043 1
1 1185 . 4 1 1 A 94 94 ALA H H 94 8.162 8.471 -0.309 1
1 1186 . 4 1 1 A 94 94 ALA HA H 94 4.329 4.787 -0.458 1
1 1190 . 4 1 1 A 94 94 ALA C C 94 177.392 177.388 0.004 1
1 1191 . 4 1 1 A 94 94 ALA CA C 94 52.558 50.892 1.666 1
1 1192 . 4 1 1 A 94 94 ALA CB C 94 19.526 18.977 0.549 1
1 1193 . 4 1 1 A 94 94 ALA N N 94 123.424 124.407 -0.983 1
1 1194 . 4 1 1 A 95 95 ASP H H 95 8.457 8.344 0.113 1
1 1195 . 4 1 1 A 95 95 ASP HA H 95 4.608 4.751 -0.143 1
1 1198 . 4 1 1 A 95 95 ASP C C 95 175.630 176.601 -0.971 1
1 1199 . 4 1 1 A 95 95 ASP CA C 95 54.450 54.701 -0.251 1
1 1200 . 4 1 1 A 95 95 ASP CB C 95 40.871 41.289 -0.418 1
1 1201 . 4 1 1 A 95 95 ASP N N 95 118.814 118.869 -0.055 1
1 1202 . 4 1 1 A 96 96 VAL H H 96 7.776 7.692 0.084 1
1 1203 . 4 1 1 A 96 96 VAL HA H 96 4.141 3.949 0.192 1
1 1211 . 4 1 1 A 96 96 VAL C C 96 175.301 175.348 -0.047 1
1 1212 . 4 1 1 A 96 96 VAL CA C 96 61.435 64.723 -3.288 1
1 1213 . 4 1 1 A 96 96 VAL CB C 96 33.517 32.545 0.972 1
1 1216 . 4 1 1 A 96 96 VAL N N 96 118.395 119.158 -0.763 1
1 1217 . 4 1 1 A 97 97 ASP H H 97 8.315 7.814 0.501 1
1 1218 . 4 1 1 A 97 97 ASP HA H 97 4.681 5.131 -0.450 1
1 1221 . 4 1 1 A 97 97 ASP C C 97 175.151 174.983 0.168 1
1 1222 . 4 1 1 A 97 97 ASP CA C 97 54.324 53.232 1.092 1
1 1223 . 4 1 1 A 97 97 ASP CB C 97 41.963 43.135 -1.172 1
1 1224 . 4 1 1 A 97 97 ASP N N 97 123.905 116.852 7.053 1
1 1225 . 4 1 1 A 98 98 TRP H H 98 8.210 9.275 -1.065 1
1 1226 . 4 1 1 A 98 98 TRP HA H 98 4.916 4.746 0.170 1
1 1235 . 4 1 1 A 98 98 TRP C C 98 174.585 175.576 -0.991 1
1 1236 . 4 1 1 A 98 98 TRP CA C 98 56.164 56.971 -0.807 1
1 1237 . 4 1 1 A 98 98 TRP CB C 98 31.466 30.295 1.171 1
1 1243 . 4 1 1 A 98 98 TRP N N 98 120.340 123.544 -3.204 1
1 1245 . 4 1 1 A 99 99 TYR H H 99 8.760 9.217 -0.457 1
1 1246 . 4 1 1 A 99 99 TYR HA H 99 5.119 5.268 -0.149 1
1 1253 . 4 1 1 A 99 99 TYR C C 99 174.599 174.769 -0.170 1
1 1254 . 4 1 1 A 99 99 TYR CA C 99 57.021 57.288 -0.267 1
1 1255 . 4 1 1 A 99 99 TYR CB C 99 39.526 39.977 -0.451 1
1 1260 . 4 1 1 A 99 99 TYR N N 99 123.319 119.552 3.767 1
1 1261 . 4 1 1 A 100 100 ILE H H 100 8.936 9.345 -0.409 1
1 1262 . 4 1 1 A 100 100 ILE HA H 100 4.850 4.642 0.208 1
1 1272 . 4 1 1 A 100 100 ILE C C 100 175.070 174.859 0.211 1
1 1273 . 4 1 1 A 100 100 ILE CA C 100 58.998 60.295 -1.297 1
1 1274 . 4 1 1 A 100 100 ILE CB C 100 40.667 37.778 2.889 1
1 1278 . 4 1 1 A 100 100 ILE N N 100 123.281 124.554 -1.273 1
1 1279 . 4 1 1 A 101 101 LYS H H 101 8.987 8.717 0.270 1
1 1280 . 4 1 1 A 101 101 LYS HA H 101 5.313 4.705 0.608 1
1 1289 . 4 1 1 A 101 101 LYS C C 101 174.440 175.673 -1.233 1
1 1290 . 4 1 1 A 101 101 LYS CA C 101 54.763 55.833 -1.070 1
1 1291 . 4 1 1 A 101 101 LYS CB C 101 34.880 33.366 1.514 1
1 1295 . 4 1 1 A 101 101 LYS N N 101 126.210 127.338 -1.128 1
1 1296 . 4 1 1 A 102 102 ALA H H 102 8.531 8.383 0.148 1
1 1297 . 4 1 1 A 102 102 ALA HA H 102 4.957 4.928 0.029 1
1 1301 . 4 1 1 A 102 102 ALA C C 102 175.024 177.794 -2.770 1
1 1302 . 4 1 1 A 102 102 ALA CA C 102 50.701 49.890 0.811 1
1 1303 . 4 1 1 A 102 102 ALA CB C 102 21.618 22.458 -0.840 1
1 1304 . 4 1 1 A 102 102 ALA N N 102 121.424 127.760 -6.336 1
1 1305 . 4 1 1 A 103 103 ASP H H 103 8.339 8.951 -0.612 1
1 1306 . 4 1 1 A 103 103 ASP HA H 103 4.603 4.449 0.154 1
1 1309 . 4 1 1 A 103 103 ASP C C 103 176.188 175.272 0.916 1
1 1310 . 4 1 1 A 103 103 ASP CA C 103 56.049 56.911 -0.862 1
1 1311 . 4 1 1 A 103 103 ASP CB C 103 40.932 41.364 -0.432 1
1 1312 . 4 1 1 A 103 103 ASP N N 103 117.773 119.516 -1.743 1
1 1313 . 4 1 1 A 104 104 ASP H H 104 7.482 7.847 -0.365 1
1 1314 . 4 1 1 A 104 104 ASP HA H 104 4.727 4.983 -0.256 1
1 1317 . 4 1 1 A 104 104 ASP C C 104 174.261 173.685 0.576 1
1 1318 . 4 1 1 A 104 104 ASP CA C 104 52.768 53.506 -0.738 1
1 1319 . 4 1 1 A 104 104 ASP CB C 104 42.587 43.901 -1.314 1
1 1320 . 4 1 1 A 104 104 ASP N N 104 110.673 117.266 -6.593 1
1 1321 . 4 1 1 A 105 105 ILE H H 105 9.267 8.715 0.552 1
1 1322 . 4 1 1 A 105 105 ILE HA H 105 4.631 4.966 -0.335 1
1 1332 . 4 1 1 A 105 105 ILE C C 105 173.922 175.191 -1.269 1
1 1333 . 4 1 1 A 105 105 ILE CA C 105 61.114 60.068 1.046 1
1 1334 . 4 1 1 A 105 105 ILE CB C 105 42.522 39.924 2.598 1
1 1338 . 4 1 1 A 105 105 ILE N N 105 121.380 122.620 -1.240 1
1 1339 . 4 1 1 A 106 106 VAL H H 106 8.592 8.950 -0.358 1
1 1340 . 4 1 1 A 106 106 VAL HA H 106 4.975 5.016 -0.041 1
1 1348 . 4 1 1 A 106 106 VAL C C 106 175.049 175.333 -0.284 1
1 1349 . 4 1 1 A 106 106 VAL CA C 106 58.028 59.799 -1.771 1
1 1350 . 4 1 1 A 106 106 VAL CB C 106 35.388 35.609 -0.221 1
1 1353 . 4 1 1 A 106 106 VAL N N 106 116.356 120.741 -4.385 1
1 1354 . 4 1 1 A 107 107 LEU H H 107 8.360 8.679 -0.319 1
1 1355 . 4 1 1 A 107 107 LEU HA H 107 4.167 4.305 -0.138 1
1 1365 . 4 1 1 A 107 107 LEU C C 107 178.338 177.550 0.788 1
1 1366 . 4 1 1 A 107 107 LEU CA C 107 55.077 54.186 0.891 1
1 1367 . 4 1 1 A 107 107 LEU CB C 107 42.394 42.164 0.230 1
1 1371 . 4 1 1 A 107 107 LEU N N 107 121.368 122.167 -0.799 1
1 1372 . 4 1 1 A 108 108 THR H H 108 7.977 8.313 -0.336 1
1 1373 . 4 1 1 A 108 108 THR HA H 108 4.039 4.385 -0.346 1
1 1378 . 4 1 1 A 108 108 THR C C 108 174.725 174.183 0.542 1
1 1379 . 4 1 1 A 108 108 THR CA C 108 63.513 63.709 -0.196 1
1 1380 . 4 1 1 A 108 108 THR CB C 108 69.194 68.859 0.335 1
1 1382 . 4 1 1 A 108 108 THR N N 108 118.728 117.162 1.566 1
1 1383 . 4 1 1 A 109 109 LEU H H 109 8.378 8.790 -0.412 1
1 1384 . 4 1 1 A 109 109 LEU HA H 109 4.274 4.572 -0.298 1
1 1394 . 4 1 1 A 109 109 LEU C C 109 177.058 177.037 0.021 1
1 1395 . 4 1 1 A 109 109 LEU CA C 109 55.045 54.493 0.552 1
1 1396 . 4 1 1 A 109 109 LEU CB C 109 42.620 40.827 1.793 1
1 1400 . 4 1 1 A 109 109 LEU N N 109 124.847 128.314 -3.467 1
1 9 . 5 1 1 A 2 2 MET HA H 2 4.554 4.895 -0.341 1
1 14 . 5 1 1 A 2 2 MET C C 2 174.749 176.039 -1.290 1
1 15 . 5 1 1 A 2 2 MET CA C 2 55.354 54.005 1.349 1
1 16 . 5 1 1 A 2 2 MET CB C 2 33.729 35.307 -1.578 1
1 18 . 5 1 1 A 3 3 ARG H H 3 8.518 8.690 -0.172 1
1 19 . 5 1 1 A 3 3 ARG HA H 3 4.531 4.365 0.166 1
1 26 . 5 1 1 A 3 3 ARG C C 3 175.780 176.079 -0.299 1
1 27 . 5 1 1 A 3 3 ARG CA C 3 55.854 57.266 -1.412 1
1 28 . 5 1 1 A 3 3 ARG CB C 3 31.403 30.532 0.871 1
1 31 . 5 1 1 A 3 3 ARG N N 3 124.008 117.410 6.598 1
1 32 . 5 1 1 A 4 4 LEU H H 4 8.424 7.427 0.997 1
1 33 . 5 1 1 A 4 4 LEU HA H 4 4.457 4.322 0.135 1
1 43 . 5 1 1 A 4 4 LEU C C 4 177.362 177.126 0.236 1
1 44 . 5 1 1 A 4 4 LEU CA C 4 54.511 55.044 -0.533 1
1 45 . 5 1 1 A 4 4 LEU CB C 4 42.686 42.590 0.096 1
1 49 . 5 1 1 A 4 4 LEU N N 4 124.389 123.054 1.335 1
1 50 . 5 1 1 A 5 5 ALA H H 5 8.418 8.868 -0.450 1
1 51 . 5 1 1 A 5 5 ALA HA H 5 4.254 4.044 0.210 1
1 55 . 5 1 1 A 5 5 ALA C C 5 177.420 177.370 0.050 1
1 56 . 5 1 1 A 5 5 ALA CA C 5 52.931 54.079 -1.148 1
1 57 . 5 1 1 A 5 5 ALA CB C 5 19.263 18.003 1.260 1
1 58 . 5 1 1 A 5 5 ALA N N 5 124.548 123.165 1.383 1
1 59 . 5 1 1 A 6 6 ASN H H 6 8.287 7.514 0.773 1
1 60 . 5 1 1 A 6 6 ASN HA H 6 4.616 4.548 0.068 1
1 65 . 5 1 1 A 6 6 ASN C C 6 175.837 175.897 -0.060 1
1 66 . 5 1 1 A 6 6 ASN CA C 6 53.345 55.254 -1.909 1
1 67 . 5 1 1 A 6 6 ASN CB C 6 38.571 39.605 -1.034 1
1 69 . 5 1 1 A 6 6 ASN N N 6 116.484 115.534 0.950 1
1 71 . 5 1 1 A 7 7 GLY H H 7 8.351 7.397 0.954 1
1 72 . 5 1 1 A 7 7 GLY HA2 H 7 4.130 4.140 -0.010 1
1 73 . 5 1 1 A 7 7 GLY HA3 H 7 3.808 4.141 -0.333 1
1 74 . 5 1 1 A 7 7 GLY C C 7 173.750 172.188 1.562 1
1 75 . 5 1 1 A 7 7 GLY CA C 7 45.343 45.498 -0.155 1
1 76 . 5 1 1 A 7 7 GLY N N 7 108.453 105.338 3.115 1
1 77 . 5 1 1 A 8 8 ILE H H 8 7.868 9.006 -1.138 1
1 78 . 5 1 1 A 8 8 ILE HA H 8 4.130 5.064 -0.934 1
1 88 . 5 1 1 A 8 8 ILE C C 8 175.570 174.738 0.832 1
1 89 . 5 1 1 A 8 8 ILE CA C 8 61.095 58.600 2.495 1
1 90 . 5 1 1 A 8 8 ILE CB C 8 38.694 41.785 -3.091 1
1 94 . 5 1 1 A 8 8 ILE N N 8 120.848 121.938 -1.090 1
1 95 . 5 1 1 A 9 9 VAL H H 9 8.220 8.938 -0.718 1
1 96 . 5 1 1 A 9 9 VAL HA H 9 4.172 4.045 0.127 1
1 104 . 5 1 1 A 9 9 VAL C C 9 175.898 177.293 -1.395 1
1 105 . 5 1 1 A 9 9 VAL CA C 9 62.488 62.978 -0.490 1
1 106 . 5 1 1 A 9 9 VAL CB C 9 32.460 30.987 1.473 1
1 109 . 5 1 1 A 9 9 VAL N N 9 125.805 123.796 2.009 1
1 110 . 5 1 1 A 10 10 LEU H H 10 8.437 8.442 -0.005 1
1 111 . 5 1 1 A 10 10 LEU HA H 10 4.347 4.071 0.276 1
1 121 . 5 1 1 A 10 10 LEU C C 10 176.398 176.442 -0.044 1
1 122 . 5 1 1 A 10 10 LEU CA C 10 54.787 57.705 -2.918 1
1 123 . 5 1 1 A 10 10 LEU CB C 10 42.639 41.901 0.738 1
1 127 . 5 1 1 A 10 10 LEU N N 10 127.757 126.801 0.956 1
1 128 . 5 1 1 A 11 11 ASP H H 11 8.506 7.694 0.812 1
1 129 . 5 1 1 A 11 11 ASP HA H 11 4.683 5.098 -0.415 1
1 132 . 5 1 1 A 11 11 ASP C C 11 176.672 174.156 2.516 1
1 133 . 5 1 1 A 11 11 ASP CA C 11 53.586 53.322 0.264 1
1 134 . 5 1 1 A 11 11 ASP CB C 11 41.123 43.046 -1.923 1
1 135 . 5 1 1 A 11 11 ASP N N 11 121.539 116.299 5.240 1
1 136 . 5 1 1 A 12 12 LYS H H 12 8.578 8.730 -0.152 1
1 137 . 5 1 1 A 12 12 LYS HA H 12 3.943 4.569 -0.626 1
1 146 . 5 1 1 A 12 12 LYS C C 12 176.917 175.553 1.364 1
1 147 . 5 1 1 A 12 12 LYS CA C 12 58.542 56.193 2.349 1
1 148 . 5 1 1 A 12 12 LYS CB C 12 32.703 34.303 -1.600 1
1 152 . 5 1 1 A 12 12 LYS N N 12 123.635 121.312 2.323 1
1 153 . 5 1 1 A 13 13 ASP H H 13 8.523 9.016 -0.493 1
1 154 . 5 1 1 A 13 13 ASP HA H 13 4.566 4.190 0.376 1
1 157 . 5 1 1 A 13 13 ASP C C 13 177.535 175.762 1.773 1
1 158 . 5 1 1 A 13 13 ASP CA C 13 56.034 56.655 -0.621 1
1 159 . 5 1 1 A 13 13 ASP CB C 13 41.051 38.581 2.470 1
1 160 . 5 1 1 A 13 13 ASP N N 13 120.448 123.797 -3.349 1
1 161 . 5 1 1 A 14 14 THR H H 14 7.964 8.287 -0.323 1
1 162 . 5 1 1 A 14 14 THR HA H 14 4.146 4.283 -0.137 1
1 167 . 5 1 1 A 14 14 THR C C 14 175.440 173.711 1.729 1
1 168 . 5 1 1 A 14 14 THR CA C 14 63.245 62.240 1.005 1
1 169 . 5 1 1 A 14 14 THR CB C 14 69.092 68.950 0.142 1
1 171 . 5 1 1 A 14 14 THR N N 14 113.711 112.684 1.027 1
1 172 . 5 1 1 A 15 15 THR H H 15 7.921 8.721 -0.800 1
1 173 . 5 1 1 A 15 15 THR HA H 15 3.920 4.761 -0.841 1
1 178 . 5 1 1 A 15 15 THR C C 15 174.750 172.404 2.346 1
1 179 . 5 1 1 A 15 15 THR CA C 15 64.562 60.212 4.350 1
1 180 . 5 1 1 A 15 15 THR CB C 15 69.166 69.229 -0.063 1
1 182 . 5 1 1 A 15 15 THR N N 15 116.710 121.929 -5.219 1
1 183 . 5 1 1 A 16 16 PHE H H 16 8.191 9.148 -0.957 1
1 184 . 5 1 1 A 16 16 PHE HA H 16 4.628 4.898 -0.270 1
1 192 . 5 1 1 A 16 16 PHE C C 16 177.754 176.330 1.424 1
1 193 . 5 1 1 A 16 16 PHE CA C 16 57.975 57.491 0.484 1
1 194 . 5 1 1 A 16 16 PHE CB C 16 39.553 39.526 0.027 1
1 200 . 5 1 1 A 16 16 PHE N N 16 117.124 128.073 -10.949 1
1 201 . 5 1 1 A 17 17 GLY H H 17 8.110 8.728 -0.618 1
1 202 . 5 1 1 A 17 17 GLY HA2 H 17 4.017 4.084 -0.067 1
1 203 . 5 1 1 A 17 17 GLY HA3 H 17 3.849 4.090 -0.241 1
1 204 . 5 1 1 A 17 17 GLY C C 17 172.231 173.379 -1.148 1
1 205 . 5 1 1 A 17 17 GLY CA C 17 45.633 44.346 1.287 1
1 206 . 5 1 1 A 17 17 GLY N N 17 109.951 111.740 -1.789 1
1 207 . 5 1 1 A 18 18 GLU H H 18 8.304 8.537 -0.233 1
1 208 . 5 1 1 A 18 18 GLU HA H 18 4.078 4.264 -0.186 1
1 213 . 5 1 1 A 18 18 GLU C C 18 175.588 176.433 -0.845 1
1 214 . 5 1 1 A 18 18 GLU CA C 18 57.446 56.785 0.661 1
1 215 . 5 1 1 A 18 18 GLU CB C 18 30.767 29.598 1.169 1
1 217 . 5 1 1 A 18 18 GLU N N 18 121.640 119.676 1.964 1
1 218 . 5 1 1 A 19 19 LEU H H 19 8.799 8.749 0.050 1
1 219 . 5 1 1 A 19 19 LEU HA H 19 5.416 4.610 0.806 1
1 229 . 5 1 1 A 19 19 LEU C C 19 176.875 176.352 0.523 1
1 230 . 5 1 1 A 19 19 LEU CA C 19 53.281 54.045 -0.764 1
1 231 . 5 1 1 A 19 19 LEU CB C 19 45.508 42.521 2.987 1
1 235 . 5 1 1 A 19 19 LEU N N 19 127.101 126.536 0.565 1
1 236 . 5 1 1 A 20 20 LYS H H 20 8.494 8.927 -0.433 1
1 237 . 5 1 1 A 20 20 LYS HA H 20 5.200 5.202 -0.002 1
1 246 . 5 1 1 A 20 20 LYS C C 20 176.163 175.681 0.482 1
1 247 . 5 1 1 A 20 20 LYS CA C 20 53.575 54.672 -1.097 1
1 248 . 5 1 1 A 20 20 LYS CB C 20 36.835 35.242 1.593 1
1 252 . 5 1 1 A 20 20 LYS N N 20 118.828 123.676 -4.848 1
1 253 . 5 1 1 A 21 21 PHE H H 21 9.658 8.978 0.680 1
1 254 . 5 1 1 A 21 21 PHE HA H 21 4.038 4.676 -0.638 1
1 262 . 5 1 1 A 21 21 PHE C C 21 174.296 175.636 -1.340 1
1 263 . 5 1 1 A 21 21 PHE CA C 21 60.462 59.304 1.158 1
1 264 . 5 1 1 A 21 21 PHE CB C 21 40.359 39.895 0.464 1
1 270 . 5 1 1 A 21 21 PHE N N 21 124.322 126.774 -2.452 1
1 271 . 5 1 1 A 22 22 SER H H 22 7.199 8.572 -1.373 1
1 272 . 5 1 1 A 22 22 SER HA H 22 5.046 4.265 0.781 1
1 275 . 5 1 1 A 22 22 SER C C 22 173.080 174.224 -1.144 1
1 276 . 5 1 1 A 22 22 SER CA C 22 58.547 58.182 0.365 1
1 277 . 5 1 1 A 22 22 SER CB C 22 63.591 63.804 -0.213 1
1 278 . 5 1 1 A 22 22 SER N N 22 120.109 119.526 0.583 1
1 279 . 5 1 1 A 23 23 ALA H H 23 7.269 7.028 0.241 1
1 280 . 5 1 1 A 23 23 ALA HA H 23 4.426 4.240 0.186 1
1 284 . 5 1 1 A 23 23 ALA C C 23 176.568 174.396 2.172 1
1 285 . 5 1 1 A 23 23 ALA CA C 23 52.458 51.075 1.383 1
1 286 . 5 1 1 A 23 23 ALA CB C 23 22.728 21.774 0.954 1
1 287 . 5 1 1 A 23 23 ALA N N 23 114.102 119.458 -5.356 1
1 288 . 5 1 1 A 24 24 LEU H H 24 8.819 8.563 0.256 1
1 289 . 5 1 1 A 24 24 LEU HA H 24 4.060 4.551 -0.491 1
1 299 . 5 1 1 A 24 24 LEU C C 24 175.363 176.743 -1.380 1
1 300 . 5 1 1 A 24 24 LEU CA C 24 56.901 54.181 2.720 1
1 301 . 5 1 1 A 24 24 LEU CB C 24 42.065 42.598 -0.533 1
1 305 . 5 1 1 A 24 24 LEU N N 24 120.865 120.239 0.626 1
1 306 . 5 1 1 A 25 25 ARG H H 25 9.473 8.892 0.581 1
1 307 . 5 1 1 A 25 25 ARG HA H 25 4.428 4.200 0.228 1
1 315 . 5 1 1 A 25 25 ARG C C 25 175.729 175.532 0.197 1
1 316 . 5 1 1 A 25 25 ARG CA C 25 56.721 57.892 -1.171 1
1 317 . 5 1 1 A 25 25 ARG CB C 25 31.109 31.264 -0.155 1
1 320 . 5 1 1 A 25 25 ARG N N 25 130.455 127.712 2.743 1
1 322 . 5 1 1 A 26 26 ARG H H 26 7.711 7.299 0.412 1
1 323 . 5 1 1 A 26 26 ARG HA H 26 4.559 4.598 -0.039 1
1 330 . 5 1 1 A 26 26 ARG C C 26 173.724 173.548 0.176 1
1 331 . 5 1 1 A 26 26 ARG CA C 26 55.737 55.840 -0.103 1
1 332 . 5 1 1 A 26 26 ARG CB C 26 33.261 34.044 -0.783 1
1 335 . 5 1 1 A 26 26 ARG N N 26 113.305 118.342 -5.037 1
1 336 . 5 1 1 A 27 27 GLU H H 27 8.848 8.557 0.291 1
1 337 . 5 1 1 A 27 27 GLU HA H 27 4.615 4.642 -0.027 1
1 342 . 5 1 1 A 27 27 GLU C C 27 174.836 175.957 -1.121 1
1 343 . 5 1 1 A 27 27 GLU CA C 27 55.901 55.368 0.533 1
1 344 . 5 1 1 A 27 27 GLU CB C 27 30.755 30.049 0.706 1
1 346 . 5 1 1 A 27 27 GLU N N 27 121.934 125.169 -3.235 1
1 347 . 5 1 1 A 28 28 VAL H H 28 8.603 7.996 0.607 1
1 348 . 5 1 1 A 28 28 VAL HA H 28 4.013 4.120 -0.107 1
1 356 . 5 1 1 A 28 28 VAL C C 28 175.561 175.867 -0.306 1
1 357 . 5 1 1 A 28 28 VAL CA C 28 62.791 61.833 0.958 1
1 358 . 5 1 1 A 28 28 VAL CB C 28 32.710 31.785 0.925 1
1 361 . 5 1 1 A 28 28 VAL N N 28 125.545 123.193 2.352 1
1 362 . 5 1 1 A 29 29 ARG H H 29 8.735 8.602 0.133 1
1 363 . 5 1 1 A 29 29 ARG HA H 29 4.774 4.666 0.108 1
1 370 . 5 1 1 A 29 29 ARG C C 29 176.580 176.465 0.115 1
1 371 . 5 1 1 A 29 29 ARG CA C 29 55.481 54.222 1.259 1
1 372 . 5 1 1 A 29 29 ARG CB C 29 31.963 32.004 -0.041 1
1 375 . 5 1 1 A 29 29 ARG N N 29 128.327 127.004 1.323 1
1 376 . 5 1 1 A 30 30 ILE H H 30 8.358 8.579 -0.221 1
1 377 . 5 1 1 A 30 30 ILE HA H 30 3.882 3.971 -0.089 1
1 387 . 5 1 1 A 30 30 ILE C C 30 175.093 175.557 -0.464 1
1 388 . 5 1 1 A 30 30 ILE CA C 30 61.669 61.961 -0.292 1
1 389 . 5 1 1 A 30 30 ILE CB C 30 38.806 36.987 1.819 1
1 393 . 5 1 1 A 30 30 ILE N N 30 121.957 121.834 0.123 1
1 394 . 5 1 1 A 31 31 GLN H H 31 8.560 8.821 -0.261 1
1 395 . 5 1 1 A 31 31 GLN HA H 31 4.647 4.655 -0.008 1
1 402 . 5 1 1 A 31 31 GLN C C 31 175.954 175.841 0.113 1
1 403 . 5 1 1 A 31 31 GLN CA C 31 54.833 55.085 -0.252 1
1 404 . 5 1 1 A 31 31 GLN CB C 31 30.584 30.095 0.489 1
1 407 . 5 1 1 A 31 31 GLN N N 31 126.348 127.899 -1.551 1
1 409 . 5 1 1 A 32 32 ASN H H 32 8.994 9.031 -0.037 1
1 410 . 5 1 1 A 32 32 ASN HA H 32 4.784 4.713 0.071 1
1 415 . 5 1 1 A 32 32 ASN C C 32 177.296 176.518 0.778 1
1 416 . 5 1 1 A 32 32 ASN CA C 32 53.206 53.562 -0.356 1
1 417 . 5 1 1 A 32 32 ASN CB C 32 39.472 39.537 -0.065 1
1 419 . 5 1 1 A 32 32 ASN N N 32 122.834 125.468 -2.634 1
1 421 . 5 1 1 A 33 33 GLU H H 33 9.180 8.860 0.320 1
1 422 . 5 1 1 A 33 33 GLU HA H 33 4.063 4.033 0.030 1
1 427 . 5 1 1 A 33 33 GLU C C 33 176.787 177.540 -0.753 1
1 428 . 5 1 1 A 33 33 GLU CA C 33 59.347 59.167 0.180 1
1 429 . 5 1 1 A 33 33 GLU CB C 33 29.294 29.228 0.066 1
1 431 . 5 1 1 A 33 33 GLU N N 33 122.736 121.763 0.973 1
1 432 . 5 1 1 A 34 34 ASP H H 34 7.969 7.995 -0.026 1
1 433 . 5 1 1 A 34 34 ASP HA H 34 4.499 4.671 -0.172 1
1 436 . 5 1 1 A 34 34 ASP C C 34 177.111 176.625 0.486 1
1 437 . 5 1 1 A 34 34 ASP CA C 34 53.632 54.131 -0.499 1
1 438 . 5 1 1 A 34 34 ASP CB C 34 39.807 41.275 -1.468 1
1 439 . 5 1 1 A 34 34 ASP N N 34 115.921 117.553 -1.632 1
1 440 . 5 1 1 A 35 35 GLY H H 35 8.083 8.294 -0.211 1
1 441 . 5 1 1 A 35 35 GLY HA2 H 35 4.366 3.964 0.402 1
1 442 . 5 1 1 A 35 35 GLY HA3 H 35 3.657 3.964 -0.307 1
1 443 . 5 1 1 A 35 35 GLY C C 35 174.584 174.492 0.092 1
1 444 . 5 1 1 A 35 35 GLY CA C 35 45.134 45.053 0.081 1
1 445 . 5 1 1 A 35 35 GLY N N 35 108.874 108.197 0.677 1
1 446 . 5 1 1 A 36 36 SER H H 36 8.274 7.961 0.313 1
1 447 . 5 1 1 A 36 36 SER HA H 36 4.389 4.539 -0.150 1
1 450 . 5 1 1 A 36 36 SER C C 36 173.284 173.696 -0.412 1
1 451 . 5 1 1 A 36 36 SER CA C 36 58.383 58.225 0.158 1
1 452 . 5 1 1 A 36 36 SER CB C 36 64.576 64.920 -0.344 1
1 453 . 5 1 1 A 36 36 SER N N 36 117.428 116.043 1.385 1
1 454 . 5 1 1 A 37 37 VAL H H 37 8.508 8.610 -0.102 1
1 455 . 5 1 1 A 37 37 VAL HA H 37 4.346 4.629 -0.283 1
1 463 . 5 1 1 A 37 37 VAL C C 37 176.370 175.591 0.779 1
1 464 . 5 1 1 A 37 37 VAL CA C 37 62.410 61.349 1.061 1
1 465 . 5 1 1 A 37 37 VAL CB C 37 33.086 32.751 0.335 1
1 468 . 5 1 1 A 37 37 VAL N N 37 119.189 122.960 -3.771 1
1 469 . 5 1 1 A 38 38 SER H H 38 8.461 8.960 -0.499 1
1 470 . 5 1 1 A 38 38 SER HA H 38 4.586 4.693 -0.107 1
1 473 . 5 1 1 A 38 38 SER C C 38 173.829 174.831 -1.002 1
1 474 . 5 1 1 A 38 38 SER CA C 38 57.618 57.706 -0.088 1
1 475 . 5 1 1 A 38 38 SER CB C 38 64.537 64.800 -0.263 1
1 476 . 5 1 1 A 38 38 SER N N 38 121.629 121.777 -0.148 1
1 477 . 5 1 1 A 39 39 ASP H H 39 8.512 8.595 -0.083 1
1 478 . 5 1 1 A 39 39 ASP HA H 39 4.606 4.540 0.066 1
1 481 . 5 1 1 A 39 39 ASP C C 39 176.557 176.705 -0.148 1
1 482 . 5 1 1 A 39 39 ASP CA C 39 54.833 56.071 -1.238 1
1 483 . 5 1 1 A 39 39 ASP CB C 39 41.123 41.553 -0.430 1
1 484 . 5 1 1 A 39 39 ASP N N 39 120.305 122.948 -2.643 1
1 485 . 5 1 1 A 40 40 GLU H H 40 8.311 7.616 0.695 1
1 486 . 5 1 1 A 40 40 GLU HA H 40 4.235 4.405 -0.170 1
1 491 . 5 1 1 A 40 40 GLU C C 40 175.327 175.897 -0.570 1
1 492 . 5 1 1 A 40 40 GLU CA C 40 56.215 57.251 -1.036 1
1 493 . 5 1 1 A 40 40 GLU CB C 40 30.788 30.156 0.632 1
1 495 . 5 1 1 A 40 40 GLU N N 40 120.680 117.610 3.070 1
1 496 . 5 1 1 A 41 41 ILE H H 41 8.465 8.864 -0.399 1
1 497 . 5 1 1 A 41 41 ILE HA H 41 4.127 4.367 -0.240 1
1 507 . 5 1 1 A 41 41 ILE C C 41 175.380 176.222 -0.842 1
1 508 . 5 1 1 A 41 41 ILE CA C 41 60.670 60.358 0.312 1
1 509 . 5 1 1 A 41 41 ILE CB C 41 38.805 39.345 -0.540 1
1 513 . 5 1 1 A 41 41 ILE N N 41 123.665 123.865 -0.200 1
1 514 . 5 1 1 A 42 42 LYS H H 42 9.556 9.165 0.391 1
1 515 . 5 1 1 A 42 42 LYS HA H 42 4.428 4.249 0.179 1
1 524 . 5 1 1 A 42 42 LYS C C 42 177.277 176.282 0.995 1
1 525 . 5 1 1 A 42 42 LYS CA C 42 57.274 57.836 -0.562 1
1 526 . 5 1 1 A 42 42 LYS CB C 42 35.169 33.584 1.585 1
1 530 . 5 1 1 A 42 42 LYS N N 42 125.597 127.750 -2.153 1
1 531 . 5 1 1 A 43 43 GLU H H 43 7.809 7.356 0.453 1
1 532 . 5 1 1 A 43 43 GLU HA H 43 4.886 4.683 0.203 1
1 537 . 5 1 1 A 43 43 GLU C C 43 173.593 174.001 -0.408 1
1 538 . 5 1 1 A 43 43 GLU CA C 43 54.669 55.410 -0.741 1
1 539 . 5 1 1 A 43 43 GLU CB C 43 32.882 32.181 0.701 1
1 541 . 5 1 1 A 43 43 GLU N N 43 115.292 113.962 1.330 1
1 542 . 5 1 1 A 44 44 ARG H H 44 8.879 8.730 0.149 1
1 543 . 5 1 1 A 44 44 ARG HA H 44 4.917 4.829 0.088 1
1 551 . 5 1 1 A 44 44 ARG C C 44 173.708 175.312 -1.604 1
1 552 . 5 1 1 A 44 44 ARG CA C 44 55.965 54.814 1.151 1
1 553 . 5 1 1 A 44 44 ARG CB C 44 33.579 31.904 1.675 1
1 556 . 5 1 1 A 44 44 ARG N N 44 118.233 120.071 -1.838 1
1 558 . 5 1 1 A 45 45 THR H H 45 8.892 9.088 -0.196 1
1 559 . 5 1 1 A 45 45 THR HA H 45 5.308 5.191 0.117 1
1 564 . 5 1 1 A 45 45 THR C C 45 173.357 173.701 -0.344 1
1 565 . 5 1 1 A 45 45 THR CA C 45 60.939 62.122 -1.183 1
1 566 . 5 1 1 A 45 45 THR CB C 45 70.054 69.299 0.755 1
1 568 . 5 1 1 A 45 45 THR N N 45 118.457 119.105 -0.648 1
1 569 . 5 1 1 A 46 46 TYR H H 46 9.625 9.602 0.023 1
1 570 . 5 1 1 A 46 46 TYR HA H 46 4.771 5.088 -0.317 1
1 578 . 5 1 1 A 46 46 TYR C C 46 173.735 175.327 -1.592 1
1 579 . 5 1 1 A 46 46 TYR CA C 46 57.480 57.145 0.335 1
1 580 . 5 1 1 A 46 46 TYR CB C 46 41.724 40.852 0.872 1
1 585 . 5 1 1 A 46 46 TYR N N 46 125.916 127.099 -1.183 1
1 586 . 5 1 1 A 47 47 ASP H H 47 9.006 9.188 -0.182 1
1 587 . 5 1 1 A 47 47 ASP HA H 47 5.399 5.042 0.357 1
1 590 . 5 1 1 A 47 47 ASP C C 47 175.094 175.143 -0.049 1
1 591 . 5 1 1 A 47 47 ASP CA C 47 53.460 53.903 -0.443 1
1 592 . 5 1 1 A 47 47 ASP CB C 47 41.947 41.650 0.297 1
1 593 . 5 1 1 A 47 47 ASP N N 47 122.109 123.048 -0.939 1
1 594 . 5 1 1 A 48 48 LEU H H 48 9.066 8.849 0.217 1
1 595 . 5 1 1 A 48 48 LEU HA H 48 4.831 5.159 -0.328 1
1 605 . 5 1 1 A 48 48 LEU C C 48 174.977 175.443 -0.466 1
1 606 . 5 1 1 A 48 48 LEU CA C 48 52.724 53.497 -0.773 1
1 607 . 5 1 1 A 48 48 LEU CB C 48 44.844 43.985 0.859 1
1 611 . 5 1 1 A 48 48 LEU N N 48 121.879 125.719 -3.840 1
1 612 . 5 1 1 A 49 49 LYS H H 49 9.401 9.240 0.161 1
1 613 . 5 1 1 A 49 49 LYS HA H 49 4.477 4.854 -0.377 1
1 622 . 5 1 1 A 49 49 LYS C C 49 176.225 175.383 0.842 1
1 623 . 5 1 1 A 49 49 LYS CA C 49 56.017 55.216 0.801 1
1 624 . 5 1 1 A 49 49 LYS CB C 49 33.838 33.647 0.191 1
1 628 . 5 1 1 A 49 49 LYS N N 49 122.218 124.827 -2.609 1
1 629 . 5 1 1 A 50 50 SER H H 50 8.266 8.930 -0.664 1
1 630 . 5 1 1 A 50 50 SER HA H 50 5.222 4.717 0.505 1
1 633 . 5 1 1 A 50 50 SER C C 50 175.570 174.383 1.187 1
1 634 . 5 1 1 A 50 50 SER CA C 50 55.770 57.917 -2.147 1
1 635 . 5 1 1 A 50 50 SER CB C 50 64.738 63.110 1.628 1
1 636 . 5 1 1 A 50 50 SER N N 50 117.388 120.298 -2.910 1
1 637 . 5 1 1 A 51 51 LYS H H 51 9.276 8.709 0.567 1
1 638 . 5 1 1 A 51 51 LYS HA H 51 4.208 4.292 -0.084 1
1 647 . 5 1 1 A 51 51 LYS C C 51 178.773 180.006 -1.233 1
1 648 . 5 1 1 A 51 51 LYS CA C 51 58.674 58.500 0.174 1
1 649 . 5 1 1 A 51 51 LYS CB C 51 33.383 32.654 0.729 1
1 653 . 5 1 1 A 51 51 LYS N N 51 130.550 126.519 4.031 1
1 654 . 5 1 1 A 52 52 GLY H H 52 8.320 8.071 0.249 1
1 655 . 5 1 1 A 52 52 GLY HA2 H 52 3.875 3.686 0.189 1
1 656 . 5 1 1 A 52 52 GLY HA3 H 52 3.628 3.697 -0.069 1
1 657 . 5 1 1 A 52 52 GLY C C 52 175.108 175.809 -0.701 1
1 658 . 5 1 1 A 52 52 GLY CA C 52 46.322 47.173 -0.851 1
1 659 . 5 1 1 A 52 52 GLY N N 52 107.053 108.322 -1.269 1
1 660 . 5 1 1 A 53 53 GLN H H 53 7.859 7.777 0.082 1
1 661 . 5 1 1 A 53 53 GLN HA H 53 4.409 4.390 0.019 1
1 668 . 5 1 1 A 53 53 GLN C C 53 176.469 176.611 -0.142 1
1 669 . 5 1 1 A 53 53 GLN CA C 53 54.911 55.668 -0.757 1
1 670 . 5 1 1 A 53 53 GLN CB C 53 29.675 29.892 -0.217 1
1 673 . 5 1 1 A 53 53 GLN N N 53 115.482 119.271 -3.789 1
1 675 . 5 1 1 A 54 54 GLY H H 54 7.992 8.740 -0.748 1
1 676 . 5 1 1 A 54 54 GLY HA2 H 54 3.934 3.904 0.030 1
1 677 . 5 1 1 A 54 54 GLY HA3 H 54 3.934 3.908 0.026 1
1 678 . 5 1 1 A 54 54 GLY C C 54 173.897 173.669 0.228 1
1 679 . 5 1 1 A 54 54 GLY CA C 54 46.574 46.230 0.344 1
1 680 . 5 1 1 A 54 54 GLY N N 54 110.111 108.663 1.448 1
1 681 . 5 1 1 A 55 55 ARG H H 55 7.652 7.874 -0.222 1
1 682 . 5 1 1 A 55 55 ARG HA H 55 4.665 4.912 -0.247 1
1 690 . 5 1 1 A 55 55 ARG C C 55 174.649 174.671 -0.022 1
1 691 . 5 1 1 A 55 55 ARG CA C 55 54.631 54.087 0.544 1
1 692 . 5 1 1 A 55 55 ARG CB C 55 32.166 34.041 -1.875 1
1 695 . 5 1 1 A 55 55 ARG N N 55 114.214 119.428 -5.214 1
1 697 . 5 1 1 A 56 56 MET H H 56 8.593 8.616 -0.023 1
1 698 . 5 1 1 A 56 56 MET HA H 56 5.012 5.197 -0.185 1
1 703 . 5 1 1 A 56 56 MET C C 56 176.216 175.798 0.418 1
1 704 . 5 1 1 A 56 56 MET CA C 56 54.595 53.902 0.693 1
1 705 . 5 1 1 A 56 56 MET CB C 56 33.466 33.094 0.372 1
1 707 . 5 1 1 A 56 56 MET N N 56 121.270 119.473 1.797 1
1 708 . 5 1 1 A 57 57 ILE H H 57 9.393 8.866 0.527 1
1 709 . 5 1 1 A 57 57 ILE HA H 57 4.717 4.768 -0.051 1
1 719 . 5 1 1 A 57 57 ILE C C 57 173.883 173.861 0.022 1
1 720 . 5 1 1 A 57 57 ILE CA C 57 59.713 58.688 1.025 1
1 721 . 5 1 1 A 57 57 ILE CB C 57 40.933 41.218 -0.285 1
1 725 . 5 1 1 A 57 57 ILE N N 57 120.811 120.127 0.684 1
1 726 . 5 1 1 A 58 58 GLN H H 58 8.218 8.310 -0.092 1
1 727 . 5 1 1 A 58 58 GLN HA H 58 5.407 4.783 0.624 1
1 734 . 5 1 1 A 58 58 GLN C C 58 175.368 174.617 0.751 1
1 735 . 5 1 1 A 58 58 GLN CA C 58 55.163 54.929 0.234 1
1 736 . 5 1 1 A 58 58 GLN CB C 58 30.841 29.653 1.188 1
1 739 . 5 1 1 A 58 58 GLN N N 58 122.281 122.170 0.111 1
1 741 . 5 1 1 A 59 59 VAL H H 59 9.188 8.641 0.547 1
1 742 . 5 1 1 A 59 59 VAL HA H 59 5.025 5.135 -0.110 1
1 750 . 5 1 1 A 59 59 VAL C C 59 175.330 175.642 -0.312 1
1 751 . 5 1 1 A 59 59 VAL CA C 59 59.975 61.291 -1.316 1
1 752 . 5 1 1 A 59 59 VAL CB C 59 34.818 33.529 1.289 1
1 755 . 5 1 1 A 59 59 VAL N N 59 122.421 126.554 -4.133 1
1 756 . 5 1 1 A 60 60 SER H H 60 9.022 9.383 -0.361 1
1 757 . 5 1 1 A 60 60 SER HA H 60 5.811 6.137 -0.326 1
1 760 . 5 1 1 A 60 60 SER C C 60 173.234 173.792 -0.558 1
1 761 . 5 1 1 A 60 60 SER CA C 60 57.634 56.312 1.322 1
1 762 . 5 1 1 A 60 60 SER CB C 60 64.891 65.685 -0.794 1
1 763 . 5 1 1 A 60 60 SER N N 60 124.709 120.925 3.784 1
1 764 . 5 1 1 A 61 61 ILE H H 61 9.226 8.971 0.255 1
1 765 . 5 1 1 A 61 61 ILE HA H 61 5.572 5.101 0.471 1
1 775 . 5 1 1 A 61 61 ILE C C 61 173.955 173.881 0.074 1
1 776 . 5 1 1 A 61 61 ILE CA C 61 56.937 57.190 -0.253 1
1 777 . 5 1 1 A 61 61 ILE CB C 61 39.596 39.773 -0.177 1
1 781 . 5 1 1 A 61 61 ILE N N 61 121.648 119.588 2.060 1
1 782 . 5 1 1 A 62 62 PRO HA H 62 4.606 4.538 0.068 1
1 789 . 5 1 1 A 62 62 PRO C C 62 178.143 177.241 0.902 1
1 790 . 5 1 1 A 62 62 PRO CA C 62 63.740 62.838 0.902 1
1 791 . 5 1 1 A 62 62 PRO CB C 62 33.303 32.759 0.544 1
1 794 . 5 1 1 A 63 63 ALA H H 63 7.803 8.741 -0.938 1
1 795 . 5 1 1 A 63 63 ALA HA H 63 4.037 4.037 0.000 1
1 799 . 5 1 1 A 63 63 ALA C C 63 175.942 179.307 -3.365 1
1 800 . 5 1 1 A 63 63 ALA CA C 63 54.417 54.670 -0.253 1
1 801 . 5 1 1 A 63 63 ALA CB C 63 19.345 18.221 1.124 1
1 802 . 5 1 1 A 63 63 ALA N N 63 123.695 126.940 -3.245 1
1 803 . 5 1 1 A 64 64 SER H H 64 7.719 7.877 -0.158 1
1 804 . 5 1 1 A 64 64 SER HA H 64 4.097 4.299 -0.202 1
1 807 . 5 1 1 A 64 64 SER C C 64 175.199 174.409 0.790 1
1 808 . 5 1 1 A 64 64 SER CA C 64 59.474 60.315 -0.841 1
1 809 . 5 1 1 A 64 64 SER CB C 64 62.125 62.974 -0.849 1
1 810 . 5 1 1 A 64 64 SER N N 64 110.001 110.986 -0.985 1
1 811 . 5 1 1 A 65 65 VAL H H 65 7.790 7.687 0.103 1
1 812 . 5 1 1 A 65 65 VAL HA H 65 4.360 4.275 0.085 1
1 820 . 5 1 1 A 65 65 VAL C C 65 174.433 174.690 -0.257 1
1 821 . 5 1 1 A 65 65 VAL CA C 65 60.335 59.367 0.968 1
1 822 . 5 1 1 A 65 65 VAL CB C 65 32.714 32.223 0.491 1
1 825 . 5 1 1 A 65 65 VAL N N 65 126.142 124.929 1.213 1
1 826 . 5 1 1 A 66 66 PRO HA H 66 4.369 4.633 -0.264 1
1 833 . 5 1 1 A 66 66 PRO C C 66 177.412 176.365 1.047 1
1 834 . 5 1 1 A 66 66 PRO CA C 66 63.104 62.333 0.771 1
1 835 . 5 1 1 A 66 66 PRO CB C 66 32.558 32.422 0.136 1
1 838 . 5 1 1 A 67 67 LEU H H 67 8.578 8.318 0.260 1
1 839 . 5 1 1 A 67 67 LEU HA H 67 3.875 4.772 -0.897 1
1 849 . 5 1 1 A 67 67 LEU C C 67 176.077 175.958 0.119 1
1 850 . 5 1 1 A 67 67 LEU CA C 67 56.413 55.478 0.935 1
1 851 . 5 1 1 A 67 67 LEU CB C 67 43.279 42.539 0.740 1
1 855 . 5 1 1 A 67 67 LEU N N 67 124.236 122.839 1.397 1
1 856 . 5 1 1 A 68 68 LYS H H 68 7.994 8.384 -0.390 1
1 857 . 5 1 1 A 68 68 LYS HA H 68 3.793 4.227 -0.434 1
1 866 . 5 1 1 A 68 68 LYS C C 68 175.601 175.688 -0.087 1
1 867 . 5 1 1 A 68 68 LYS CA C 68 53.350 55.294 -1.944 1
1 868 . 5 1 1 A 68 68 LYS CB C 68 31.035 32.095 -1.060 1
1 872 . 5 1 1 A 68 68 LYS N N 68 124.053 126.373 -2.320 1
1 873 . 5 1 1 A 69 69 GLU H H 69 8.347 8.571 -0.224 1
1 874 . 5 1 1 A 69 69 GLU HA H 69 4.501 4.398 0.103 1
1 879 . 5 1 1 A 69 69 GLU C C 69 175.304 175.581 -0.277 1
1 880 . 5 1 1 A 69 69 GLU CA C 69 54.291 55.661 -1.370 1
1 881 . 5 1 1 A 69 69 GLU CB C 69 29.285 28.188 1.097 1
1 883 . 5 1 1 A 69 69 GLU N N 69 123.876 124.111 -0.235 1
1 884 . 5 1 1 A 70 70 PHE H H 70 5.549 7.571 -2.022 1
1 885 . 5 1 1 A 70 70 PHE HA H 70 4.592 4.498 0.094 1
1 893 . 5 1 1 A 70 70 PHE C C 70 174.443 175.481 -1.038 1
1 894 . 5 1 1 A 70 70 PHE CA C 70 53.313 58.234 -4.921 1
1 895 . 5 1 1 A 70 70 PHE CB C 70 38.335 39.567 -1.232 1
1 901 . 5 1 1 A 70 70 PHE N N 70 117.781 120.380 -2.599 1
1 902 . 5 1 1 A 71 71 ASP H H 71 8.791 8.676 0.115 1
1 903 . 5 1 1 A 71 71 ASP HA H 71 4.535 4.913 -0.378 1
1 906 . 5 1 1 A 71 71 ASP C C 71 175.867 175.897 -0.030 1
1 907 . 5 1 1 A 71 71 ASP CA C 71 54.248 54.333 -0.085 1
1 908 . 5 1 1 A 71 71 ASP CB C 71 41.166 41.527 -0.361 1
1 909 . 5 1 1 A 71 71 ASP N N 71 120.385 122.095 -1.710 1
1 910 . 5 1 1 A 72 72 TYR H H 72 8.701 8.726 -0.025 1
1 911 . 5 1 1 A 72 72 TYR HA H 72 4.283 4.439 -0.156 1
1 918 . 5 1 1 A 72 72 TYR C C 72 177.470 176.396 1.074 1
1 919 . 5 1 1 A 72 72 TYR CA C 72 60.513 59.536 0.977 1
1 920 . 5 1 1 A 72 72 TYR CB C 72 38.320 38.343 -0.023 1
1 925 . 5 1 1 A 72 72 TYR N N 72 121.876 123.972 -2.096 1
1 926 . 5 1 1 A 73 73 ASN H H 73 8.819 9.152 -0.333 1
1 927 . 5 1 1 A 73 73 ASN HA H 73 4.096 4.167 -0.071 1
1 932 . 5 1 1 A 73 73 ASN C C 73 174.362 174.670 -0.308 1
1 933 . 5 1 1 A 73 73 ASN CA C 73 54.289 54.180 0.109 1
1 934 . 5 1 1 A 73 73 ASN CB C 73 36.907 36.616 0.291 1
1 936 . 5 1 1 A 73 73 ASN N N 73 121.726 119.799 1.927 1
1 938 . 5 1 1 A 74 74 ALA H H 74 8.059 7.729 0.330 1
1 939 . 5 1 1 A 74 74 ALA HA H 74 4.100 4.334 -0.234 1
1 943 . 5 1 1 A 74 74 ALA C C 74 177.757 177.374 0.383 1
1 944 . 5 1 1 A 74 74 ALA CA C 74 53.153 52.215 0.938 1
1 945 . 5 1 1 A 74 74 ALA CB C 74 19.412 19.592 -0.180 1
1 946 . 5 1 1 A 74 74 ALA N N 74 122.292 120.816 1.476 1
1 947 . 5 1 1 A 75 75 ARG H H 75 8.500 8.520 -0.020 1
1 948 . 5 1 1 A 75 75 ARG HA H 75 4.758 4.869 -0.111 1
1 955 . 5 1 1 A 75 75 ARG C C 75 176.812 176.228 0.584 1
1 956 . 5 1 1 A 75 75 ARG CA C 75 56.646 56.494 0.152 1
1 957 . 5 1 1 A 75 75 ARG CB C 75 29.375 30.601 -1.226 1
1 960 . 5 1 1 A 75 75 ARG N N 75 122.871 121.988 0.883 1
1 961 . 5 1 1 A 76 76 VAL H H 76 7.965 9.092 -1.127 1
1 962 . 5 1 1 A 76 76 VAL HA H 76 5.230 4.900 0.330 1
1 970 . 5 1 1 A 76 76 VAL C C 76 173.758 174.393 -0.635 1
1 971 . 5 1 1 A 76 76 VAL CA C 76 58.193 58.913 -0.720 1
1 972 . 5 1 1 A 76 76 VAL CB C 76 36.536 35.721 0.815 1
1 975 . 5 1 1 A 76 76 VAL N N 76 116.220 118.546 -2.326 1
1 976 . 5 1 1 A 77 77 GLU H H 77 9.166 9.225 -0.059 1
1 977 . 5 1 1 A 77 77 GLU HA H 77 4.663 4.965 -0.302 1
1 982 . 5 1 1 A 77 77 GLU C C 77 174.940 174.599 0.341 1
1 983 . 5 1 1 A 77 77 GLU CA C 77 53.546 54.247 -0.701 1
1 984 . 5 1 1 A 77 77 GLU CB C 77 33.395 33.762 -0.367 1
1 986 . 5 1 1 A 77 77 GLU N N 77 116.413 121.227 -4.814 1
1 987 . 5 1 1 A 78 78 LEU H H 78 8.670 8.905 -0.235 1
1 988 . 5 1 1 A 78 78 LEU HA H 78 4.677 5.001 -0.324 1
1 998 . 5 1 1 A 78 78 LEU C C 78 176.036 175.571 0.465 1
1 999 . 5 1 1 A 78 78 LEU CA C 78 53.091 53.233 -0.142 1
1 1000 . 5 1 1 A 78 78 LEU CB C 78 43.276 44.404 -1.128 1
1 1004 . 5 1 1 A 78 78 LEU N N 78 117.927 123.470 -5.543 1
1 1005 . 5 1 1 A 79 79 ILE H H 79 7.900 8.936 -1.036 1
1 1006 . 5 1 1 A 79 79 ILE HA H 79 4.312 4.540 -0.228 1
1 1016 . 5 1 1 A 79 79 ILE C C 79 175.179 175.759 -0.580 1
1 1017 . 5 1 1 A 79 79 ILE CA C 79 58.294 60.032 -1.738 1
1 1018 . 5 1 1 A 79 79 ILE CB C 79 36.086 38.211 -2.125 1
1 1022 . 5 1 1 A 79 79 ILE N N 79 121.667 124.691 -3.024 1
1 1023 . 5 1 1 A 80 80 ASN H H 80 9.412 8.964 0.448 1
1 1024 . 5 1 1 A 80 80 ASN HA H 80 4.516 4.258 0.258 1
1 1029 . 5 1 1 A 80 80 ASN C C 80 170.300 173.646 -3.346 1
1 1030 . 5 1 1 A 80 80 ASN CA C 80 54.198 53.903 0.295 1
1 1031 . 5 1 1 A 80 80 ASN CB C 80 37.450 37.024 0.426 1
1 1033 . 5 1 1 A 80 80 ASN N N 80 123.831 122.844 0.987 1
1 1035 . 5 1 1 A 81 81 PRO HA H 81 5.185 4.884 0.301 1
1 1042 . 5 1 1 A 81 81 PRO C C 81 176.865 176.349 0.516 1
1 1043 . 5 1 1 A 81 81 PRO CA C 81 62.637 62.320 0.317 1
1 1044 . 5 1 1 A 81 81 PRO CB C 81 32.965 32.157 0.808 1
1 1047 . 5 1 1 A 82 82 ILE H H 82 9.374 8.567 0.807 1
1 1048 . 5 1 1 A 82 82 ILE HA H 82 4.524 4.966 -0.442 1
1 1058 . 5 1 1 A 82 82 ILE C C 82 174.731 174.610 0.121 1
1 1059 . 5 1 1 A 82 82 ILE CA C 82 60.205 58.709 1.496 1
1 1060 . 5 1 1 A 82 82 ILE CB C 82 41.737 41.898 -0.161 1
1 1064 . 5 1 1 A 82 82 ILE N N 82 121.658 117.683 3.975 1
1 1065 . 5 1 1 A 83 83 ALA H H 83 8.819 8.636 0.183 1
1 1066 . 5 1 1 A 83 83 ALA HA H 83 4.773 4.558 0.215 1
1 1070 . 5 1 1 A 83 83 ALA C C 83 176.550 176.711 -0.161 1
1 1071 . 5 1 1 A 83 83 ALA CA C 83 52.069 52.201 -0.132 1
1 1072 . 5 1 1 A 83 83 ALA CB C 83 20.374 19.181 1.193 1
1 1073 . 5 1 1 A 83 83 ALA N N 83 127.933 125.383 2.550 1
1 1074 . 5 1 1 A 84 84 ASP H H 84 8.710 8.911 -0.201 1
1 1075 . 5 1 1 A 84 84 ASP HA H 84 4.894 4.826 0.068 1
1 1078 . 5 1 1 A 84 84 ASP C C 84 175.997 177.610 -1.613 1
1 1079 . 5 1 1 A 84 84 ASP CA C 84 53.334 54.439 -1.105 1
1 1080 . 5 1 1 A 84 84 ASP CB C 84 42.104 42.106 -0.002 1
1 1081 . 5 1 1 A 84 84 ASP N N 84 122.009 122.933 -0.924 1
1 1082 . 5 1 1 A 85 85 THR H H 85 8.349 8.693 -0.344 1
1 1083 . 5 1 1 A 85 85 THR HA H 85 4.420 4.562 -0.142 1
1 1088 . 5 1 1 A 85 85 THR C C 85 175.085 174.769 0.316 1
1 1089 . 5 1 1 A 85 85 THR CA C 85 62.304 61.796 0.508 1
1 1090 . 5 1 1 A 85 85 THR CB C 85 69.718 69.516 0.202 1
1 1092 . 5 1 1 A 85 85 THR N N 85 114.986 115.510 -0.524 1
1 1093 . 5 1 1 A 86 86 VAL H H 86 8.188 7.591 0.597 1
1 1094 . 5 1 1 A 86 86 VAL HA H 86 4.021 3.905 0.116 1
1 1102 . 5 1 1 A 86 86 VAL C C 86 176.519 176.712 -0.193 1
1 1103 . 5 1 1 A 86 86 VAL CA C 86 63.046 63.042 0.004 1
1 1104 . 5 1 1 A 86 86 VAL CB C 86 32.526 32.106 0.420 1
1 1107 . 5 1 1 A 86 86 VAL N N 86 122.275 122.730 -0.455 1
1 1108 . 5 1 1 A 87 87 ALA H H 87 8.194 8.832 -0.638 1
1 1109 . 5 1 1 A 87 87 ALA HA H 87 4.212 4.080 0.132 1
1 1113 . 5 1 1 A 87 87 ALA C C 87 178.118 178.101 0.017 1
1 1114 . 5 1 1 A 87 87 ALA CA C 87 53.153 54.332 -1.179 1
1 1115 . 5 1 1 A 87 87 ALA CB C 87 19.165 17.663 1.502 1
1 1116 . 5 1 1 A 87 87 ALA N N 87 126.609 126.674 -0.065 1
1 1117 . 5 1 1 A 88 88 THR H H 88 7.914 8.212 -0.298 1
1 1118 . 5 1 1 A 88 88 THR HA H 88 4.173 4.175 -0.002 1
1 1123 . 5 1 1 A 88 88 THR C C 88 174.516 175.947 -1.431 1
1 1124 . 5 1 1 A 88 88 THR CA C 88 62.785 65.294 -2.509 1
1 1125 . 5 1 1 A 88 88 THR CB C 88 69.582 68.380 1.202 1
1 1127 . 5 1 1 A 88 88 THR N N 88 112.328 112.170 0.158 1
1 1128 . 5 1 1 A 89 89 ALA H H 89 8.076 8.006 0.070 1
1 1129 . 5 1 1 A 89 89 ALA HA H 89 4.320 4.257 0.063 1
1 1133 . 5 1 1 A 89 89 ALA C C 89 178.014 179.167 -1.153 1
1 1134 . 5 1 1 A 89 89 ALA CA C 89 53.079 53.350 -0.271 1
1 1135 . 5 1 1 A 89 89 ALA CB C 89 19.335 19.062 0.273 1
1 1136 . 5 1 1 A 89 89 ALA N N 89 124.632 124.027 0.605 1
1 1137 . 5 1 1 A 90 90 THR H H 90 7.976 7.571 0.405 1
1 1138 . 5 1 1 A 90 90 THR HA H 90 4.203 4.206 -0.003 1
1 1143 . 5 1 1 A 90 90 THR C C 90 174.427 174.752 -0.325 1
1 1144 . 5 1 1 A 90 90 THR CA C 90 62.519 65.847 -3.328 1
1 1145 . 5 1 1 A 90 90 THR CB C 90 69.721 69.121 0.600 1
1 1147 . 5 1 1 A 90 90 THR N N 90 112.047 111.287 0.760 1
1 1148 . 5 1 1 A 91 91 TYR H H 91 7.959 7.903 0.056 1
1 1149 . 5 1 1 A 91 91 TYR HA H 91 4.564 4.752 -0.188 1
1 1156 . 5 1 1 A 91 91 TYR C C 91 175.522 175.505 0.017 1
1 1157 . 5 1 1 A 91 91 TYR CA C 91 57.874 58.071 -0.197 1
1 1158 . 5 1 1 A 91 91 TYR CB C 91 38.584 39.258 -0.674 1
1 1163 . 5 1 1 A 91 91 TYR N N 91 121.184 119.126 2.058 1
1 1164 . 5 1 1 A 92 92 GLN H H 92 8.310 8.544 -0.234 1
1 1165 . 5 1 1 A 92 92 GLN HA H 92 4.258 4.677 -0.419 1
1 1172 . 5 1 1 A 92 92 GLN C C 92 176.099 177.941 -1.842 1
1 1173 . 5 1 1 A 92 92 GLN CA C 92 56.109 54.001 2.108 1
1 1174 . 5 1 1 A 92 92 GLN CB C 92 29.112 30.615 -1.503 1
1 1177 . 5 1 1 A 92 92 GLN N N 92 121.631 120.151 1.480 1
1 1179 . 5 1 1 A 93 93 GLY H H 93 8.052 8.707 -0.655 1
1 1180 . 5 1 1 A 93 93 GLY HA2 H 93 4.023 3.787 0.236 1
1 1181 . 5 1 1 A 93 93 GLY HA3 H 93 3.856 3.794 0.062 1
1 1182 . 5 1 1 A 93 93 GLY C C 93 173.791 174.820 -1.029 1
1 1183 . 5 1 1 A 93 93 GLY CA C 93 45.382 47.376 -1.994 1
1 1184 . 5 1 1 A 93 93 GLY N N 93 109.847 110.243 -0.396 1
1 1185 . 5 1 1 A 94 94 ALA H H 94 8.162 7.470 0.692 1
1 1186 . 5 1 1 A 94 94 ALA HA H 94 4.329 4.508 -0.179 1
1 1190 . 5 1 1 A 94 94 ALA C C 94 177.392 176.871 0.521 1
1 1191 . 5 1 1 A 94 94 ALA CA C 94 52.558 51.558 1.000 1
1 1192 . 5 1 1 A 94 94 ALA CB C 94 19.526 20.203 -0.677 1
1 1193 . 5 1 1 A 94 94 ALA N N 94 123.424 119.647 3.777 1
1 1194 . 5 1 1 A 95 95 ASP H H 95 8.457 7.740 0.717 1
1 1195 . 5 1 1 A 95 95 ASP HA H 95 4.608 5.027 -0.419 1
1 1198 . 5 1 1 A 95 95 ASP C C 95 175.630 175.094 0.536 1
1 1199 . 5 1 1 A 95 95 ASP CA C 95 54.450 53.459 0.991 1
1 1200 . 5 1 1 A 95 95 ASP CB C 95 40.871 41.869 -0.998 1
1 1201 . 5 1 1 A 95 95 ASP N N 95 118.814 120.312 -1.498 1
1 1202 . 5 1 1 A 96 96 VAL H H 96 7.776 8.396 -0.620 1
1 1203 . 5 1 1 A 96 96 VAL HA H 96 4.141 4.815 -0.674 1
1 1211 . 5 1 1 A 96 96 VAL C C 96 175.301 173.619 1.682 1
1 1212 . 5 1 1 A 96 96 VAL CA C 96 61.435 60.978 0.457 1
1 1213 . 5 1 1 A 96 96 VAL CB C 96 33.517 34.384 -0.867 1
1 1216 . 5 1 1 A 96 96 VAL N N 96 118.395 123.681 -5.286 1
1 1217 . 5 1 1 A 97 97 ASP H H 97 8.315 8.948 -0.633 1
1 1218 . 5 1 1 A 97 97 ASP HA H 97 4.681 5.200 -0.519 1
1 1221 . 5 1 1 A 97 97 ASP C C 97 175.151 175.799 -0.648 1
1 1222 . 5 1 1 A 97 97 ASP CA C 97 54.324 53.672 0.652 1
1 1223 . 5 1 1 A 97 97 ASP CB C 97 41.963 41.626 0.337 1
1 1224 . 5 1 1 A 97 97 ASP N N 97 123.905 127.644 -3.739 1
1 1225 . 5 1 1 A 98 98 TRP H H 98 8.210 9.181 -0.971 1
1 1226 . 5 1 1 A 98 98 TRP HA H 98 4.916 4.637 0.279 1
1 1235 . 5 1 1 A 98 98 TRP C C 98 174.585 175.504 -0.919 1
1 1236 . 5 1 1 A 98 98 TRP CA C 98 56.164 56.730 -0.566 1
1 1237 . 5 1 1 A 98 98 TRP CB C 98 31.466 30.264 1.202 1
1 1243 . 5 1 1 A 98 98 TRP N N 98 120.340 125.493 -5.153 1
1 1245 . 5 1 1 A 99 99 TYR H H 99 8.760 9.217 -0.457 1
1 1246 . 5 1 1 A 99 99 TYR HA H 99 5.119 5.460 -0.341 1
1 1253 . 5 1 1 A 99 99 TYR C C 99 174.599 175.032 -0.433 1
1 1254 . 5 1 1 A 99 99 TYR CA C 99 57.021 56.243 0.778 1
1 1255 . 5 1 1 A 99 99 TYR CB C 99 39.526 41.733 -2.207 1
1 1260 . 5 1 1 A 99 99 TYR N N 99 123.319 118.206 5.113 1
1 1261 . 5 1 1 A 100 100 ILE H H 100 8.936 9.078 -0.142 1
1 1262 . 5 1 1 A 100 100 ILE HA H 100 4.850 4.791 0.059 1
1 1272 . 5 1 1 A 100 100 ILE C C 100 175.070 174.827 0.243 1
1 1273 . 5 1 1 A 100 100 ILE CA C 100 58.998 60.461 -1.463 1
1 1274 . 5 1 1 A 100 100 ILE CB C 100 40.667 40.794 -0.127 1
1 1278 . 5 1 1 A 100 100 ILE N N 100 123.281 121.456 1.825 1
1 1279 . 5 1 1 A 101 101 LYS H H 101 8.987 8.945 0.042 1
1 1280 . 5 1 1 A 101 101 LYS HA H 101 5.313 5.251 0.062 1
1 1289 . 5 1 1 A 101 101 LYS C C 101 174.440 176.193 -1.753 1
1 1290 . 5 1 1 A 101 101 LYS CA C 101 54.763 55.536 -0.773 1
1 1291 . 5 1 1 A 101 101 LYS CB C 101 34.880 34.308 0.572 1
1 1295 . 5 1 1 A 101 101 LYS N N 101 126.210 127.218 -1.008 1
1 1296 . 5 1 1 A 102 102 ALA H H 102 8.531 8.637 -0.106 1
1 1297 . 5 1 1 A 102 102 ALA HA H 102 4.957 5.044 -0.087 1
1 1301 . 5 1 1 A 102 102 ALA C C 102 175.024 177.158 -2.134 1
1 1302 . 5 1 1 A 102 102 ALA CA C 102 50.701 50.996 -0.295 1
1 1303 . 5 1 1 A 102 102 ALA CB C 102 21.618 23.206 -1.588 1
1 1304 . 5 1 1 A 102 102 ALA N N 102 121.424 123.992 -2.568 1
1 1305 . 5 1 1 A 103 103 ASP H H 103 8.339 9.223 -0.884 1
1 1306 . 5 1 1 A 103 103 ASP HA H 103 4.603 4.571 0.032 1
1 1309 . 5 1 1 A 103 103 ASP C C 103 176.188 175.253 0.935 1
1 1310 . 5 1 1 A 103 103 ASP CA C 103 56.049 55.875 0.174 1
1 1311 . 5 1 1 A 103 103 ASP CB C 103 40.932 42.407 -1.475 1
1 1312 . 5 1 1 A 103 103 ASP N N 103 117.773 119.066 -1.293 1
1 1313 . 5 1 1 A 104 104 ASP H H 104 7.482 7.430 0.052 1
1 1314 . 5 1 1 A 104 104 ASP HA H 104 4.727 4.891 -0.164 1
1 1317 . 5 1 1 A 104 104 ASP C C 104 174.261 173.645 0.616 1
1 1318 . 5 1 1 A 104 104 ASP CA C 104 52.768 53.680 -0.912 1
1 1319 . 5 1 1 A 104 104 ASP CB C 104 42.587 44.114 -1.527 1
1 1320 . 5 1 1 A 104 104 ASP N N 104 110.673 115.376 -4.703 1
1 1321 . 5 1 1 A 105 105 ILE H H 105 9.267 8.648 0.619 1
1 1322 . 5 1 1 A 105 105 ILE HA H 105 4.631 4.711 -0.080 1
1 1332 . 5 1 1 A 105 105 ILE C C 105 173.922 175.356 -1.434 1
1 1333 . 5 1 1 A 105 105 ILE CA C 105 61.114 60.239 0.875 1
1 1334 . 5 1 1 A 105 105 ILE CB C 105 42.522 39.417 3.105 1
1 1338 . 5 1 1 A 105 105 ILE N N 105 121.380 122.853 -1.473 1
1 1339 . 5 1 1 A 106 106 VAL H H 106 8.592 9.014 -0.422 1
1 1340 . 5 1 1 A 106 106 VAL HA H 106 4.975 5.143 -0.168 1
1 1348 . 5 1 1 A 106 106 VAL C C 106 175.049 175.265 -0.216 1
1 1349 . 5 1 1 A 106 106 VAL CA C 106 58.028 59.907 -1.879 1
1 1350 . 5 1 1 A 106 106 VAL CB C 106 35.388 35.755 -0.367 1
1 1353 . 5 1 1 A 106 106 VAL N N 106 116.356 121.213 -4.857 1
1 1354 . 5 1 1 A 107 107 LEU H H 107 8.360 8.500 -0.140 1
1 1355 . 5 1 1 A 107 107 LEU HA H 107 4.167 4.310 -0.143 1
1 1365 . 5 1 1 A 107 107 LEU C C 107 178.338 177.438 0.900 1
1 1366 . 5 1 1 A 107 107 LEU CA C 107 55.077 53.979 1.098 1
1 1367 . 5 1 1 A 107 107 LEU CB C 107 42.394 42.103 0.291 1
1 1371 . 5 1 1 A 107 107 LEU N N 107 121.368 122.116 -0.748 1
1 1372 . 5 1 1 A 108 108 THR H H 108 7.977 8.757 -0.780 1
1 1373 . 5 1 1 A 108 108 THR HA H 108 4.039 4.629 -0.590 1
1 1378 . 5 1 1 A 108 108 THR C C 108 174.725 174.984 -0.259 1
1 1379 . 5 1 1 A 108 108 THR CA C 108 63.513 62.778 0.735 1
1 1380 . 5 1 1 A 108 108 THR CB C 108 69.194 69.593 -0.399 1
1 1382 . 5 1 1 A 108 108 THR N N 108 118.728 117.898 0.830 1
1 1383 . 5 1 1 A 109 109 LEU H H 109 8.378 8.588 -0.210 1
1 1384 . 5 1 1 A 109 109 LEU HA H 109 4.274 4.458 -0.184 1
1 1394 . 5 1 1 A 109 109 LEU C C 109 177.058 175.487 1.571 1
1 1395 . 5 1 1 A 109 109 LEU CA C 109 55.045 54.640 0.405 1
1 1396 . 5 1 1 A 109 109 LEU CB C 109 42.620 40.785 1.835 1
1 1400 . 5 1 1 A 109 109 LEU N N 109 124.847 125.625 -0.778 1
1 9 . 6 1 1 A 2 2 MET HA H 2 4.554 5.002 -0.448 1
1 14 . 6 1 1 A 2 2 MET C C 2 174.749 174.682 0.067 1
1 15 . 6 1 1 A 2 2 MET CA C 2 55.354 54.004 1.350 1
1 16 . 6 1 1 A 2 2 MET CB C 2 33.729 34.403 -0.674 1
1 18 . 6 1 1 A 3 3 ARG H H 3 8.518 8.559 -0.041 1
1 19 . 6 1 1 A 3 3 ARG HA H 3 4.531 4.653 -0.122 1
1 26 . 6 1 1 A 3 3 ARG C C 3 175.780 174.481 1.299 1
1 27 . 6 1 1 A 3 3 ARG CA C 3 55.854 55.192 0.662 1
1 28 . 6 1 1 A 3 3 ARG CB C 3 31.403 31.084 0.319 1
1 31 . 6 1 1 A 3 3 ARG N N 3 124.008 122.745 1.263 1
1 32 . 6 1 1 A 4 4 LEU H H 4 8.424 8.581 -0.157 1
1 33 . 6 1 1 A 4 4 LEU HA H 4 4.457 4.424 0.033 1
1 43 . 6 1 1 A 4 4 LEU C C 4 177.362 177.320 0.042 1
1 44 . 6 1 1 A 4 4 LEU CA C 4 54.511 54.529 -0.018 1
1 45 . 6 1 1 A 4 4 LEU CB C 4 42.686 42.368 0.318 1
1 49 . 6 1 1 A 4 4 LEU N N 4 124.389 127.514 -3.125 1
1 50 . 6 1 1 A 5 5 ALA H H 5 8.418 8.840 -0.422 1
1 51 . 6 1 1 A 5 5 ALA HA H 5 4.254 4.480 -0.226 1
1 55 . 6 1 1 A 5 5 ALA C C 5 177.420 178.120 -0.700 1
1 56 . 6 1 1 A 5 5 ALA CA C 5 52.931 51.852 1.079 1
1 57 . 6 1 1 A 5 5 ALA CB C 5 19.263 20.056 -0.793 1
1 58 . 6 1 1 A 5 5 ALA N N 5 124.548 127.013 -2.465 1
1 59 . 6 1 1 A 6 6 ASN H H 6 8.287 9.003 -0.716 1
1 60 . 6 1 1 A 6 6 ASN HA H 6 4.616 4.336 0.280 1
1 65 . 6 1 1 A 6 6 ASN C C 6 175.837 176.146 -0.309 1
1 66 . 6 1 1 A 6 6 ASN CA C 6 53.345 55.898 -2.553 1
1 67 . 6 1 1 A 6 6 ASN CB C 6 38.571 38.541 0.030 1
1 69 . 6 1 1 A 6 6 ASN N N 6 116.484 117.964 -1.480 1
1 71 . 6 1 1 A 7 7 GLY H H 7 8.351 8.166 0.185 1
1 72 . 6 1 1 A 7 7 GLY HA2 H 7 4.130 3.943 0.187 1
1 73 . 6 1 1 A 7 7 GLY HA3 H 7 3.808 3.944 -0.136 1
1 74 . 6 1 1 A 7 7 GLY C C 7 173.750 174.355 -0.605 1
1 75 . 6 1 1 A 7 7 GLY CA C 7 45.343 46.345 -1.002 1
1 76 . 6 1 1 A 7 7 GLY N N 7 108.453 106.570 1.883 1
1 77 . 6 1 1 A 8 8 ILE H H 8 7.868 7.700 0.168 1
1 78 . 6 1 1 A 8 8 ILE HA H 8 4.130 4.491 -0.361 1
1 88 . 6 1 1 A 8 8 ILE C C 8 175.570 175.359 0.211 1
1 89 . 6 1 1 A 8 8 ILE CA C 8 61.095 59.587 1.508 1
1 90 . 6 1 1 A 8 8 ILE CB C 8 38.694 39.955 -1.261 1
1 94 . 6 1 1 A 8 8 ILE N N 8 120.848 117.219 3.629 1
1 95 . 6 1 1 A 9 9 VAL H H 9 8.220 8.753 -0.533 1
1 96 . 6 1 1 A 9 9 VAL HA H 9 4.172 4.195 -0.023 1
1 104 . 6 1 1 A 9 9 VAL C C 9 175.898 177.094 -1.196 1
1 105 . 6 1 1 A 9 9 VAL CA C 9 62.488 63.845 -1.357 1
1 106 . 6 1 1 A 9 9 VAL CB C 9 32.460 32.621 -0.161 1
1 109 . 6 1 1 A 9 9 VAL N N 9 125.805 121.897 3.908 1
1 110 . 6 1 1 A 10 10 LEU H H 10 8.437 7.918 0.519 1
1 111 . 6 1 1 A 10 10 LEU HA H 10 4.347 4.278 0.069 1
1 121 . 6 1 1 A 10 10 LEU C C 10 176.398 177.172 -0.774 1
1 122 . 6 1 1 A 10 10 LEU CA C 10 54.787 56.965 -2.178 1
1 123 . 6 1 1 A 10 10 LEU CB C 10 42.639 42.711 -0.072 1
1 127 . 6 1 1 A 10 10 LEU N N 10 127.757 119.157 8.600 1
1 128 . 6 1 1 A 11 11 ASP H H 11 8.506 8.072 0.434 1
1 129 . 6 1 1 A 11 11 ASP HA H 11 4.683 4.528 0.155 1
1 132 . 6 1 1 A 11 11 ASP C C 11 176.672 175.359 1.313 1
1 133 . 6 1 1 A 11 11 ASP CA C 11 53.586 54.307 -0.721 1
1 134 . 6 1 1 A 11 11 ASP CB C 11 41.123 39.532 1.591 1
1 135 . 6 1 1 A 11 11 ASP N N 11 121.539 119.856 1.683 1
1 136 . 6 1 1 A 12 12 LYS H H 12 8.578 8.381 0.197 1
1 137 . 6 1 1 A 12 12 LYS HA H 12 3.943 5.169 -1.226 1
1 146 . 6 1 1 A 12 12 LYS C C 12 176.917 174.484 2.433 1
1 147 . 6 1 1 A 12 12 LYS CA C 12 58.542 54.022 4.520 1
1 148 . 6 1 1 A 12 12 LYS CB C 12 32.703 35.788 -3.085 1
1 152 . 6 1 1 A 12 12 LYS N N 12 123.635 119.505 4.130 1
1 153 . 6 1 1 A 13 13 ASP H H 13 8.523 8.641 -0.118 1
1 154 . 6 1 1 A 13 13 ASP HA H 13 4.566 4.833 -0.267 1
1 157 . 6 1 1 A 13 13 ASP C C 13 177.535 177.266 0.269 1
1 158 . 6 1 1 A 13 13 ASP CA C 13 56.034 53.643 2.391 1
1 159 . 6 1 1 A 13 13 ASP CB C 13 41.051 41.786 -0.735 1
1 160 . 6 1 1 A 13 13 ASP N N 13 120.448 121.474 -1.026 1
1 161 . 6 1 1 A 14 14 THR H H 14 7.964 8.634 -0.670 1
1 162 . 6 1 1 A 14 14 THR HA H 14 4.146 4.015 0.131 1
1 167 . 6 1 1 A 14 14 THR C C 14 175.440 174.314 1.126 1
1 168 . 6 1 1 A 14 14 THR CA C 14 63.245 63.657 -0.412 1
1 169 . 6 1 1 A 14 14 THR CB C 14 69.092 70.035 -0.943 1
1 171 . 6 1 1 A 14 14 THR N N 14 113.711 119.445 -5.734 1
1 172 . 6 1 1 A 15 15 THR H H 15 7.921 7.894 0.027 1
1 173 . 6 1 1 A 15 15 THR HA H 15 3.920 3.968 -0.048 1
1 178 . 6 1 1 A 15 15 THR C C 15 174.750 172.901 1.849 1
1 179 . 6 1 1 A 15 15 THR CA C 15 64.562 62.142 2.420 1
1 180 . 6 1 1 A 15 15 THR CB C 15 69.166 67.151 2.015 1
1 182 . 6 1 1 A 15 15 THR N N 15 116.710 111.979 4.731 1
1 183 . 6 1 1 A 16 16 PHE H H 16 8.191 8.228 -0.037 1
1 184 . 6 1 1 A 16 16 PHE HA H 16 4.628 4.981 -0.353 1
1 192 . 6 1 1 A 16 16 PHE C C 16 177.754 175.406 2.348 1
1 193 . 6 1 1 A 16 16 PHE CA C 16 57.975 55.940 2.035 1
1 194 . 6 1 1 A 16 16 PHE CB C 16 39.553 42.560 -3.007 1
1 200 . 6 1 1 A 16 16 PHE N N 16 117.124 120.555 -3.431 1
1 201 . 6 1 1 A 17 17 GLY H H 17 8.110 8.623 -0.513 1
1 202 . 6 1 1 A 17 17 GLY HA2 H 17 4.017 4.073 -0.056 1
1 203 . 6 1 1 A 17 17 GLY HA3 H 17 3.849 4.077 -0.228 1
1 204 . 6 1 1 A 17 17 GLY C C 17 172.231 173.887 -1.656 1
1 205 . 6 1 1 A 17 17 GLY CA C 17 45.633 46.001 -0.368 1
1 206 . 6 1 1 A 17 17 GLY N N 17 109.951 111.310 -1.359 1
1 207 . 6 1 1 A 18 18 GLU H H 18 8.304 8.231 0.073 1
1 208 . 6 1 1 A 18 18 GLU HA H 18 4.078 4.567 -0.489 1
1 213 . 6 1 1 A 18 18 GLU C C 18 175.588 175.410 0.178 1
1 214 . 6 1 1 A 18 18 GLU CA C 18 57.446 55.729 1.717 1
1 215 . 6 1 1 A 18 18 GLU CB C 18 30.767 30.650 0.117 1
1 217 . 6 1 1 A 18 18 GLU N N 18 121.640 121.784 -0.144 1
1 218 . 6 1 1 A 19 19 LEU H H 19 8.799 9.205 -0.406 1
1 219 . 6 1 1 A 19 19 LEU HA H 19 5.416 5.006 0.410 1
1 229 . 6 1 1 A 19 19 LEU C C 19 176.875 175.723 1.152 1
1 230 . 6 1 1 A 19 19 LEU CA C 19 53.281 53.421 -0.140 1
1 231 . 6 1 1 A 19 19 LEU CB C 19 45.508 43.743 1.765 1
1 235 . 6 1 1 A 19 19 LEU N N 19 127.101 129.119 -2.018 1
1 236 . 6 1 1 A 20 20 LYS H H 20 8.494 8.734 -0.240 1
1 237 . 6 1 1 A 20 20 LYS HA H 20 5.200 4.929 0.271 1
1 246 . 6 1 1 A 20 20 LYS C C 20 176.163 175.345 0.818 1
1 247 . 6 1 1 A 20 20 LYS CA C 20 53.575 54.401 -0.826 1
1 248 . 6 1 1 A 20 20 LYS CB C 20 36.835 35.027 1.808 1
1 252 . 6 1 1 A 20 20 LYS N N 20 118.828 123.914 -5.086 1
1 253 . 6 1 1 A 21 21 PHE H H 21 9.658 9.019 0.639 1
1 254 . 6 1 1 A 21 21 PHE HA H 21 4.038 4.665 -0.627 1
1 262 . 6 1 1 A 21 21 PHE C C 21 174.296 175.100 -0.804 1
1 263 . 6 1 1 A 21 21 PHE CA C 21 60.462 58.810 1.652 1
1 264 . 6 1 1 A 21 21 PHE CB C 21 40.359 40.050 0.309 1
1 270 . 6 1 1 A 21 21 PHE N N 21 124.322 125.879 -1.557 1
1 271 . 6 1 1 A 22 22 SER H H 22 7.199 8.189 -0.990 1
1 272 . 6 1 1 A 22 22 SER HA H 22 5.046 4.635 0.411 1
1 275 . 6 1 1 A 22 22 SER C C 22 173.080 173.098 -0.018 1
1 276 . 6 1 1 A 22 22 SER CA C 22 58.547 59.730 -1.183 1
1 277 . 6 1 1 A 22 22 SER CB C 22 63.591 65.365 -1.774 1
1 278 . 6 1 1 A 22 22 SER N N 22 120.109 120.925 -0.816 1
1 279 . 6 1 1 A 23 23 ALA H H 23 7.269 6.990 0.279 1
1 280 . 6 1 1 A 23 23 ALA HA H 23 4.426 4.360 0.066 1
1 284 . 6 1 1 A 23 23 ALA C C 23 176.568 174.601 1.967 1
1 285 . 6 1 1 A 23 23 ALA CA C 23 52.458 51.230 1.228 1
1 286 . 6 1 1 A 23 23 ALA CB C 23 22.728 22.464 0.264 1
1 287 . 6 1 1 A 23 23 ALA N N 23 114.102 119.131 -5.029 1
1 288 . 6 1 1 A 24 24 LEU H H 24 8.819 8.639 0.180 1
1 289 . 6 1 1 A 24 24 LEU HA H 24 4.060 4.616 -0.556 1
1 299 . 6 1 1 A 24 24 LEU C C 24 175.363 176.743 -1.380 1
1 300 . 6 1 1 A 24 24 LEU CA C 24 56.901 54.577 2.324 1
1 301 . 6 1 1 A 24 24 LEU CB C 24 42.065 42.074 -0.009 1
1 305 . 6 1 1 A 24 24 LEU N N 24 120.865 121.005 -0.140 1
1 306 . 6 1 1 A 25 25 ARG H H 25 9.473 8.450 1.023 1
1 307 . 6 1 1 A 25 25 ARG HA H 25 4.428 4.054 0.374 1
1 315 . 6 1 1 A 25 25 ARG C C 25 175.729 175.826 -0.097 1
1 316 . 6 1 1 A 25 25 ARG CA C 25 56.721 58.428 -1.707 1
1 317 . 6 1 1 A 25 25 ARG CB C 25 31.109 31.209 -0.100 1
1 320 . 6 1 1 A 25 25 ARG N N 25 130.455 127.640 2.815 1
1 322 . 6 1 1 A 26 26 ARG H H 26 7.711 7.350 0.361 1
1 323 . 6 1 1 A 26 26 ARG HA H 26 4.559 4.561 -0.002 1
1 330 . 6 1 1 A 26 26 ARG C C 26 173.724 173.564 0.160 1
1 331 . 6 1 1 A 26 26 ARG CA C 26 55.737 55.766 -0.029 1
1 332 . 6 1 1 A 26 26 ARG CB C 26 33.261 34.137 -0.876 1
1 335 . 6 1 1 A 26 26 ARG N N 26 113.305 118.343 -5.038 1
1 336 . 6 1 1 A 27 27 GLU H H 27 8.848 8.495 0.353 1
1 337 . 6 1 1 A 27 27 GLU HA H 27 4.615 4.642 -0.027 1
1 342 . 6 1 1 A 27 27 GLU C C 27 174.836 176.046 -1.210 1
1 343 . 6 1 1 A 27 27 GLU CA C 27 55.901 55.350 0.551 1
1 344 . 6 1 1 A 27 27 GLU CB C 27 30.755 30.022 0.733 1
1 346 . 6 1 1 A 27 27 GLU N N 27 121.934 125.103 -3.169 1
1 347 . 6 1 1 A 28 28 VAL H H 28 8.603 8.029 0.574 1
1 348 . 6 1 1 A 28 28 VAL HA H 28 4.013 4.258 -0.245 1
1 356 . 6 1 1 A 28 28 VAL C C 28 175.561 175.751 -0.190 1
1 357 . 6 1 1 A 28 28 VAL CA C 28 62.791 61.845 0.946 1
1 358 . 6 1 1 A 28 28 VAL CB C 28 32.710 32.487 0.223 1
1 361 . 6 1 1 A 28 28 VAL N N 28 125.545 122.288 3.257 1
1 362 . 6 1 1 A 29 29 ARG H H 29 8.735 8.434 0.301 1
1 363 . 6 1 1 A 29 29 ARG HA H 29 4.774 4.680 0.094 1
1 370 . 6 1 1 A 29 29 ARG C C 29 176.580 176.668 -0.088 1
1 371 . 6 1 1 A 29 29 ARG CA C 29 55.481 54.252 1.229 1
1 372 . 6 1 1 A 29 29 ARG CB C 29 31.963 31.667 0.296 1
1 375 . 6 1 1 A 29 29 ARG N N 29 128.327 125.373 2.954 1
1 376 . 6 1 1 A 30 30 ILE H H 30 8.358 8.250 0.108 1
1 377 . 6 1 1 A 30 30 ILE HA H 30 3.882 4.083 -0.201 1
1 387 . 6 1 1 A 30 30 ILE C C 30 175.093 175.340 -0.247 1
1 388 . 6 1 1 A 30 30 ILE CA C 30 61.669 61.475 0.194 1
1 389 . 6 1 1 A 30 30 ILE CB C 30 38.806 38.218 0.588 1
1 393 . 6 1 1 A 30 30 ILE N N 30 121.957 121.505 0.452 1
1 394 . 6 1 1 A 31 31 GLN H H 31 8.560 8.731 -0.171 1
1 395 . 6 1 1 A 31 31 GLN HA H 31 4.647 4.974 -0.327 1
1 402 . 6 1 1 A 31 31 GLN C C 31 175.954 175.489 0.465 1
1 403 . 6 1 1 A 31 31 GLN CA C 31 54.833 54.208 0.625 1
1 404 . 6 1 1 A 31 31 GLN CB C 31 30.584 31.636 -1.052 1
1 407 . 6 1 1 A 31 31 GLN N N 31 126.348 126.491 -0.143 1
1 409 . 6 1 1 A 32 32 ASN H H 32 8.994 8.950 0.044 1
1 410 . 6 1 1 A 32 32 ASN HA H 32 4.784 4.833 -0.049 1
1 415 . 6 1 1 A 32 32 ASN C C 32 177.296 176.856 0.440 1
1 416 . 6 1 1 A 32 32 ASN CA C 32 53.206 53.180 0.026 1
1 417 . 6 1 1 A 32 32 ASN CB C 32 39.472 39.607 -0.135 1
1 419 . 6 1 1 A 32 32 ASN N N 32 122.834 125.631 -2.797 1
1 421 . 6 1 1 A 33 33 GLU H H 33 9.180 8.821 0.359 1
1 422 . 6 1 1 A 33 33 GLU HA H 33 4.063 4.030 0.033 1
1 427 . 6 1 1 A 33 33 GLU C C 33 176.787 178.067 -1.280 1
1 428 . 6 1 1 A 33 33 GLU CA C 33 59.347 59.435 -0.088 1
1 429 . 6 1 1 A 33 33 GLU CB C 33 29.294 29.236 0.058 1
1 431 . 6 1 1 A 33 33 GLU N N 33 122.736 121.499 1.237 1
1 432 . 6 1 1 A 34 34 ASP H H 34 7.969 8.028 -0.059 1
1 433 . 6 1 1 A 34 34 ASP HA H 34 4.499 4.541 -0.042 1
1 436 . 6 1 1 A 34 34 ASP C C 34 177.111 176.645 0.466 1
1 437 . 6 1 1 A 34 34 ASP CA C 34 53.632 54.237 -0.605 1
1 438 . 6 1 1 A 34 34 ASP CB C 34 39.807 41.015 -1.208 1
1 439 . 6 1 1 A 34 34 ASP N N 34 115.921 117.304 -1.383 1
1 440 . 6 1 1 A 35 35 GLY H H 35 8.083 8.330 -0.247 1
1 441 . 6 1 1 A 35 35 GLY HA2 H 35 4.366 3.935 0.431 1
1 442 . 6 1 1 A 35 35 GLY HA3 H 35 3.657 3.936 -0.279 1
1 443 . 6 1 1 A 35 35 GLY C C 35 174.584 174.087 0.497 1
1 444 . 6 1 1 A 35 35 GLY CA C 35 45.134 45.131 0.003 1
1 445 . 6 1 1 A 35 35 GLY N N 35 108.874 108.541 0.333 1
1 446 . 6 1 1 A 36 36 SER H H 36 8.274 7.878 0.396 1
1 447 . 6 1 1 A 36 36 SER HA H 36 4.389 4.590 -0.201 1
1 450 . 6 1 1 A 36 36 SER C C 36 173.284 174.107 -0.823 1
1 451 . 6 1 1 A 36 36 SER CA C 36 58.383 58.328 0.055 1
1 452 . 6 1 1 A 36 36 SER CB C 36 64.576 64.825 -0.249 1
1 453 . 6 1 1 A 36 36 SER N N 36 117.428 118.441 -1.013 1
1 454 . 6 1 1 A 37 37 VAL H H 37 8.508 8.606 -0.098 1
1 455 . 6 1 1 A 37 37 VAL HA H 37 4.346 4.229 0.117 1
1 463 . 6 1 1 A 37 37 VAL C C 37 176.370 176.035 0.335 1
1 464 . 6 1 1 A 37 37 VAL CA C 37 62.410 62.551 -0.141 1
1 465 . 6 1 1 A 37 37 VAL CB C 37 33.086 32.237 0.849 1
1 468 . 6 1 1 A 37 37 VAL N N 37 119.189 125.146 -5.957 1
1 469 . 6 1 1 A 38 38 SER H H 38 8.461 8.980 -0.519 1
1 470 . 6 1 1 A 38 38 SER HA H 38 4.586 4.727 -0.141 1
1 473 . 6 1 1 A 38 38 SER C C 38 173.829 175.396 -1.567 1
1 474 . 6 1 1 A 38 38 SER CA C 38 57.618 56.743 0.875 1
1 475 . 6 1 1 A 38 38 SER CB C 38 64.537 65.033 -0.496 1
1 476 . 6 1 1 A 38 38 SER N N 38 121.629 120.577 1.052 1
1 477 . 6 1 1 A 39 39 ASP H H 39 8.512 8.762 -0.250 1
1 478 . 6 1 1 A 39 39 ASP HA H 39 4.606 4.491 0.115 1
1 481 . 6 1 1 A 39 39 ASP C C 39 176.557 176.704 -0.147 1
1 482 . 6 1 1 A 39 39 ASP CA C 39 54.833 55.631 -0.798 1
1 483 . 6 1 1 A 39 39 ASP CB C 39 41.123 40.815 0.308 1
1 484 . 6 1 1 A 39 39 ASP N N 39 120.305 124.069 -3.764 1
1 485 . 6 1 1 A 40 40 GLU H H 40 8.311 7.610 0.701 1
1 486 . 6 1 1 A 40 40 GLU HA H 40 4.235 4.387 -0.152 1
1 491 . 6 1 1 A 40 40 GLU C C 40 175.327 175.824 -0.497 1
1 492 . 6 1 1 A 40 40 GLU CA C 40 56.215 56.788 -0.573 1
1 493 . 6 1 1 A 40 40 GLU CB C 40 30.788 30.035 0.753 1
1 495 . 6 1 1 A 40 40 GLU N N 40 120.680 119.787 0.893 1
1 496 . 6 1 1 A 41 41 ILE H H 41 8.465 8.870 -0.405 1
1 497 . 6 1 1 A 41 41 ILE HA H 41 4.127 4.404 -0.277 1
1 507 . 6 1 1 A 41 41 ILE C C 41 175.380 176.217 -0.837 1
1 508 . 6 1 1 A 41 41 ILE CA C 41 60.670 60.320 0.350 1
1 509 . 6 1 1 A 41 41 ILE CB C 41 38.805 39.178 -0.373 1
1 513 . 6 1 1 A 41 41 ILE N N 41 123.665 123.848 -0.183 1
1 514 . 6 1 1 A 42 42 LYS H H 42 9.556 9.222 0.334 1
1 515 . 6 1 1 A 42 42 LYS HA H 42 4.428 4.226 0.202 1
1 524 . 6 1 1 A 42 42 LYS C C 42 177.277 176.189 1.088 1
1 525 . 6 1 1 A 42 42 LYS CA C 42 57.274 57.923 -0.649 1
1 526 . 6 1 1 A 42 42 LYS CB C 42 35.169 33.444 1.725 1
1 530 . 6 1 1 A 42 42 LYS N N 42 125.597 127.132 -1.535 1
1 531 . 6 1 1 A 43 43 GLU H H 43 7.809 7.357 0.452 1
1 532 . 6 1 1 A 43 43 GLU HA H 43 4.886 4.678 0.208 1
1 537 . 6 1 1 A 43 43 GLU C C 43 173.593 173.934 -0.341 1
1 538 . 6 1 1 A 43 43 GLU CA C 43 54.669 55.406 -0.737 1
1 539 . 6 1 1 A 43 43 GLU CB C 43 32.882 32.177 0.705 1
1 541 . 6 1 1 A 43 43 GLU N N 43 115.292 113.731 1.561 1
1 542 . 6 1 1 A 44 44 ARG H H 44 8.879 8.651 0.228 1
1 543 . 6 1 1 A 44 44 ARG HA H 44 4.917 4.809 0.108 1
1 551 . 6 1 1 A 44 44 ARG C C 44 173.708 175.134 -1.426 1
1 552 . 6 1 1 A 44 44 ARG CA C 44 55.965 54.683 1.282 1
1 553 . 6 1 1 A 44 44 ARG CB C 44 33.579 32.029 1.550 1
1 556 . 6 1 1 A 44 44 ARG N N 44 118.233 120.198 -1.965 1
1 558 . 6 1 1 A 45 45 THR H H 45 8.892 8.878 0.014 1
1 559 . 6 1 1 A 45 45 THR HA H 45 5.308 5.224 0.084 1
1 564 . 6 1 1 A 45 45 THR C C 45 173.357 173.327 0.030 1
1 565 . 6 1 1 A 45 45 THR CA C 45 60.939 61.691 -0.752 1
1 566 . 6 1 1 A 45 45 THR CB C 45 70.054 69.941 0.113 1
1 568 . 6 1 1 A 45 45 THR N N 45 118.457 118.207 0.250 1
1 569 . 6 1 1 A 46 46 TYR H H 46 9.625 9.461 0.164 1
1 570 . 6 1 1 A 46 46 TYR HA H 46 4.771 5.254 -0.483 1
1 578 . 6 1 1 A 46 46 TYR C C 46 173.735 174.993 -1.258 1
1 579 . 6 1 1 A 46 46 TYR CA C 46 57.480 56.206 1.274 1
1 580 . 6 1 1 A 46 46 TYR CB C 46 41.724 41.432 0.292 1
1 585 . 6 1 1 A 46 46 TYR N N 46 125.916 126.238 -0.322 1
1 586 . 6 1 1 A 47 47 ASP H H 47 9.006 8.904 0.102 1
1 587 . 6 1 1 A 47 47 ASP HA H 47 5.399 4.956 0.443 1
1 590 . 6 1 1 A 47 47 ASP C C 47 175.094 174.895 0.199 1
1 591 . 6 1 1 A 47 47 ASP CA C 47 53.460 53.751 -0.291 1
1 592 . 6 1 1 A 47 47 ASP CB C 47 41.947 41.626 0.321 1
1 593 . 6 1 1 A 47 47 ASP N N 47 122.109 123.112 -1.003 1
1 594 . 6 1 1 A 48 48 LEU H H 48 9.066 8.976 0.090 1
1 595 . 6 1 1 A 48 48 LEU HA H 48 4.831 5.262 -0.431 1
1 605 . 6 1 1 A 48 48 LEU C C 48 174.977 175.585 -0.608 1
1 606 . 6 1 1 A 48 48 LEU CA C 48 52.724 53.285 -0.561 1
1 607 . 6 1 1 A 48 48 LEU CB C 48 44.844 43.841 1.003 1
1 611 . 6 1 1 A 48 48 LEU N N 48 121.879 125.833 -3.954 1
1 612 . 6 1 1 A 49 49 LYS H H 49 9.401 9.023 0.378 1
1 613 . 6 1 1 A 49 49 LYS HA H 49 4.477 4.881 -0.404 1
1 622 . 6 1 1 A 49 49 LYS C C 49 176.225 175.393 0.832 1
1 623 . 6 1 1 A 49 49 LYS CA C 49 56.017 54.602 1.415 1
1 624 . 6 1 1 A 49 49 LYS CB C 49 33.838 35.831 -1.993 1
1 628 . 6 1 1 A 49 49 LYS N N 49 122.218 124.231 -2.013 1
1 629 . 6 1 1 A 50 50 SER H H 50 8.266 8.958 -0.692 1
1 630 . 6 1 1 A 50 50 SER HA H 50 5.222 5.464 -0.242 1
1 633 . 6 1 1 A 50 50 SER C C 50 175.570 173.972 1.598 1
1 634 . 6 1 1 A 50 50 SER CA C 50 55.770 56.363 -0.593 1
1 635 . 6 1 1 A 50 50 SER CB C 50 64.738 65.305 -0.567 1
1 636 . 6 1 1 A 50 50 SER N N 50 117.388 115.855 1.533 1
1 637 . 6 1 1 A 51 51 LYS H H 51 9.276 8.618 0.658 1
1 638 . 6 1 1 A 51 51 LYS HA H 51 4.208 4.489 -0.281 1
1 647 . 6 1 1 A 51 51 LYS C C 51 178.773 177.102 1.671 1
1 648 . 6 1 1 A 51 51 LYS CA C 51 58.674 55.637 3.037 1
1 649 . 6 1 1 A 51 51 LYS CB C 51 33.383 33.556 -0.173 1
1 653 . 6 1 1 A 51 51 LYS N N 51 130.550 121.824 8.726 1
1 654 . 6 1 1 A 52 52 GLY H H 52 8.320 8.938 -0.618 1
1 655 . 6 1 1 A 52 52 GLY HA2 H 52 3.875 3.910 -0.035 1
1 656 . 6 1 1 A 52 52 GLY HA3 H 52 3.628 3.912 -0.284 1
1 657 . 6 1 1 A 52 52 GLY C C 52 175.108 175.225 -0.117 1
1 658 . 6 1 1 A 52 52 GLY CA C 52 46.322 47.225 -0.903 1
1 659 . 6 1 1 A 52 52 GLY N N 52 107.053 109.411 -2.358 1
1 660 . 6 1 1 A 53 53 GLN H H 53 7.859 8.543 -0.684 1
1 661 . 6 1 1 A 53 53 GLN HA H 53 4.409 4.337 0.072 1
1 668 . 6 1 1 A 53 53 GLN C C 53 176.469 176.113 0.356 1
1 669 . 6 1 1 A 53 53 GLN CA C 53 54.911 57.517 -2.606 1
1 670 . 6 1 1 A 53 53 GLN CB C 53 29.675 29.362 0.313 1
1 673 . 6 1 1 A 53 53 GLN N N 53 115.482 121.872 -6.390 1
1 675 . 6 1 1 A 54 54 GLY H H 54 7.992 8.397 -0.405 1
1 676 . 6 1 1 A 54 54 GLY HA2 H 54 3.934 3.936 -0.002 1
1 677 . 6 1 1 A 54 54 GLY HA3 H 54 3.934 3.940 -0.006 1
1 678 . 6 1 1 A 54 54 GLY C C 54 173.897 174.416 -0.519 1
1 679 . 6 1 1 A 54 54 GLY CA C 54 46.574 46.688 -0.114 1
1 680 . 6 1 1 A 54 54 GLY N N 54 110.111 108.653 1.458 1
1 681 . 6 1 1 A 55 55 ARG H H 55 7.652 7.492 0.160 1
1 682 . 6 1 1 A 55 55 ARG HA H 55 4.665 4.865 -0.200 1
1 690 . 6 1 1 A 55 55 ARG C C 55 174.649 175.073 -0.424 1
1 691 . 6 1 1 A 55 55 ARG CA C 55 54.631 54.349 0.282 1
1 692 . 6 1 1 A 55 55 ARG CB C 55 32.166 32.945 -0.779 1
1 695 . 6 1 1 A 55 55 ARG N N 55 114.214 119.500 -5.286 1
1 697 . 6 1 1 A 56 56 MET H H 56 8.593 9.160 -0.567 1
1 698 . 6 1 1 A 56 56 MET HA H 56 5.012 5.425 -0.413 1
1 703 . 6 1 1 A 56 56 MET C C 56 176.216 175.406 0.810 1
1 704 . 6 1 1 A 56 56 MET CA C 56 54.595 53.233 1.362 1
1 705 . 6 1 1 A 56 56 MET CB C 56 33.466 35.078 -1.612 1
1 707 . 6 1 1 A 56 56 MET N N 56 121.270 120.081 1.189 1
1 708 . 6 1 1 A 57 57 ILE H H 57 9.393 8.879 0.514 1
1 709 . 6 1 1 A 57 57 ILE HA H 57 4.717 4.493 0.224 1
1 719 . 6 1 1 A 57 57 ILE C C 57 173.883 173.463 0.420 1
1 720 . 6 1 1 A 57 57 ILE CA C 57 59.713 58.605 1.108 1
1 721 . 6 1 1 A 57 57 ILE CB C 57 40.933 41.293 -0.360 1
1 725 . 6 1 1 A 57 57 ILE N N 57 120.811 118.152 2.659 1
1 726 . 6 1 1 A 58 58 GLN H H 58 8.218 8.310 -0.092 1
1 727 . 6 1 1 A 58 58 GLN HA H 58 5.407 4.936 0.471 1
1 734 . 6 1 1 A 58 58 GLN C C 58 175.368 174.575 0.793 1
1 735 . 6 1 1 A 58 58 GLN CA C 58 55.163 55.187 -0.024 1
1 736 . 6 1 1 A 58 58 GLN CB C 58 30.841 29.384 1.457 1
1 739 . 6 1 1 A 58 58 GLN N N 58 122.281 122.580 -0.299 1
1 741 . 6 1 1 A 59 59 VAL H H 59 9.188 8.613 0.575 1
1 742 . 6 1 1 A 59 59 VAL HA H 59 5.025 5.126 -0.101 1
1 750 . 6 1 1 A 59 59 VAL C C 59 175.330 175.538 -0.208 1
1 751 . 6 1 1 A 59 59 VAL CA C 59 59.975 61.476 -1.501 1
1 752 . 6 1 1 A 59 59 VAL CB C 59 34.818 32.476 2.342 1
1 755 . 6 1 1 A 59 59 VAL N N 59 122.421 126.658 -4.237 1
1 756 . 6 1 1 A 60 60 SER H H 60 9.022 9.012 0.010 1
1 757 . 6 1 1 A 60 60 SER HA H 60 5.811 5.498 0.313 1
1 760 . 6 1 1 A 60 60 SER C C 60 173.234 174.102 -0.868 1
1 761 . 6 1 1 A 60 60 SER CA C 60 57.634 57.960 -0.326 1
1 762 . 6 1 1 A 60 60 SER CB C 60 64.891 63.933 0.958 1
1 763 . 6 1 1 A 60 60 SER N N 60 124.709 125.263 -0.554 1
1 764 . 6 1 1 A 61 61 ILE H H 61 9.226 8.817 0.409 1
1 765 . 6 1 1 A 61 61 ILE HA H 61 5.572 4.865 0.707 1
1 775 . 6 1 1 A 61 61 ILE C C 61 173.955 173.997 -0.042 1
1 776 . 6 1 1 A 61 61 ILE CA C 61 56.937 57.488 -0.551 1
1 777 . 6 1 1 A 61 61 ILE CB C 61 39.596 39.354 0.242 1
1 781 . 6 1 1 A 61 61 ILE N N 61 121.648 121.082 0.566 1
1 782 . 6 1 1 A 62 62 PRO HA H 62 4.606 4.525 0.081 1
1 789 . 6 1 1 A 62 62 PRO C C 62 178.143 177.277 0.866 1
1 790 . 6 1 1 A 62 62 PRO CA C 62 63.740 62.887 0.853 1
1 791 . 6 1 1 A 62 62 PRO CB C 62 33.303 32.744 0.559 1
1 794 . 6 1 1 A 63 63 ALA H H 63 7.803 8.264 -0.461 1
1 795 . 6 1 1 A 63 63 ALA HA H 63 4.037 4.031 0.006 1
1 799 . 6 1 1 A 63 63 ALA C C 63 175.942 179.212 -3.270 1
1 800 . 6 1 1 A 63 63 ALA CA C 63 54.417 54.748 -0.331 1
1 801 . 6 1 1 A 63 63 ALA CB C 63 19.345 18.200 1.145 1
1 802 . 6 1 1 A 63 63 ALA N N 63 123.695 127.295 -3.600 1
1 803 . 6 1 1 A 64 64 SER H H 64 7.719 7.936 -0.217 1
1 804 . 6 1 1 A 64 64 SER HA H 64 4.097 4.245 -0.148 1
1 807 . 6 1 1 A 64 64 SER C C 64 175.199 174.495 0.704 1
1 808 . 6 1 1 A 64 64 SER CA C 64 59.474 60.968 -1.494 1
1 809 . 6 1 1 A 64 64 SER CB C 64 62.125 62.934 -0.809 1
1 810 . 6 1 1 A 64 64 SER N N 64 110.001 112.750 -2.749 1
1 811 . 6 1 1 A 65 65 VAL H H 65 7.790 7.589 0.201 1
1 812 . 6 1 1 A 65 65 VAL HA H 65 4.360 4.219 0.141 1
1 820 . 6 1 1 A 65 65 VAL C C 65 174.433 174.552 -0.119 1
1 821 . 6 1 1 A 65 65 VAL CA C 65 60.335 60.270 0.065 1
1 822 . 6 1 1 A 65 65 VAL CB C 65 32.714 32.085 0.629 1
1 825 . 6 1 1 A 65 65 VAL N N 65 126.142 122.352 3.790 1
1 826 . 6 1 1 A 66 66 PRO HA H 66 4.369 4.641 -0.272 1
1 833 . 6 1 1 A 66 66 PRO C C 66 177.412 176.000 1.412 1
1 834 . 6 1 1 A 66 66 PRO CA C 66 63.104 62.253 0.851 1
1 835 . 6 1 1 A 66 66 PRO CB C 66 32.558 32.884 -0.326 1
1 838 . 6 1 1 A 67 67 LEU H H 67 8.578 8.349 0.229 1
1 839 . 6 1 1 A 67 67 LEU HA H 67 3.875 5.027 -1.152 1
1 849 . 6 1 1 A 67 67 LEU C C 67 176.077 175.929 0.148 1
1 850 . 6 1 1 A 67 67 LEU CA C 67 56.413 54.986 1.427 1
1 851 . 6 1 1 A 67 67 LEU CB C 67 43.279 43.061 0.218 1
1 855 . 6 1 1 A 67 67 LEU N N 67 124.236 122.497 1.739 1
1 856 . 6 1 1 A 68 68 LYS H H 68 7.994 8.463 -0.469 1
1 857 . 6 1 1 A 68 68 LYS HA H 68 3.793 4.145 -0.352 1
1 866 . 6 1 1 A 68 68 LYS C C 68 175.601 175.476 0.125 1
1 867 . 6 1 1 A 68 68 LYS CA C 68 53.350 55.677 -2.327 1
1 868 . 6 1 1 A 68 68 LYS CB C 68 31.035 32.024 -0.989 1
1 872 . 6 1 1 A 68 68 LYS N N 68 124.053 126.105 -2.052 1
1 873 . 6 1 1 A 69 69 GLU H H 69 8.347 8.338 0.009 1
1 874 . 6 1 1 A 69 69 GLU HA H 69 4.501 4.421 0.080 1
1 879 . 6 1 1 A 69 69 GLU C C 69 175.304 175.154 0.150 1
1 880 . 6 1 1 A 69 69 GLU CA C 69 54.291 54.680 -0.389 1
1 881 . 6 1 1 A 69 69 GLU CB C 69 29.285 28.583 0.702 1
1 883 . 6 1 1 A 69 69 GLU N N 69 123.876 123.597 0.279 1
1 884 . 6 1 1 A 70 70 PHE H H 70 5.549 8.313 -2.764 1
1 885 . 6 1 1 A 70 70 PHE HA H 70 4.592 4.730 -0.138 1
1 893 . 6 1 1 A 70 70 PHE C C 70 174.443 174.268 0.175 1
1 894 . 6 1 1 A 70 70 PHE CA C 70 53.313 57.600 -4.287 1
1 895 . 6 1 1 A 70 70 PHE CB C 70 38.335 39.940 -1.605 1
1 901 . 6 1 1 A 70 70 PHE N N 70 117.781 124.563 -6.782 1
1 902 . 6 1 1 A 71 71 ASP H H 71 8.791 8.971 -0.180 1
1 903 . 6 1 1 A 71 71 ASP HA H 71 4.535 5.467 -0.932 1
1 906 . 6 1 1 A 71 71 ASP C C 71 175.867 175.184 0.683 1
1 907 . 6 1 1 A 71 71 ASP CA C 71 54.248 52.497 1.751 1
1 908 . 6 1 1 A 71 71 ASP CB C 71 41.166 44.581 -3.415 1
1 909 . 6 1 1 A 71 71 ASP N N 71 120.385 120.581 -0.196 1
1 910 . 6 1 1 A 72 72 TYR H H 72 8.701 8.719 -0.018 1
1 911 . 6 1 1 A 72 72 TYR HA H 72 4.283 4.391 -0.108 1
1 918 . 6 1 1 A 72 72 TYR C C 72 177.470 176.360 1.110 1
1 919 . 6 1 1 A 72 72 TYR CA C 72 60.513 59.455 1.058 1
1 920 . 6 1 1 A 72 72 TYR CB C 72 38.320 38.384 -0.064 1
1 925 . 6 1 1 A 72 72 TYR N N 72 121.876 124.426 -2.550 1
1 926 . 6 1 1 A 73 73 ASN H H 73 8.819 8.773 0.046 1
1 927 . 6 1 1 A 73 73 ASN HA H 73 4.096 4.143 -0.047 1
1 932 . 6 1 1 A 73 73 ASN C C 73 174.362 174.507 -0.145 1
1 933 . 6 1 1 A 73 73 ASN CA C 73 54.289 54.398 -0.109 1
1 934 . 6 1 1 A 73 73 ASN CB C 73 36.907 36.844 0.063 1
1 936 . 6 1 1 A 73 73 ASN N N 73 121.726 119.563 2.163 1
1 938 . 6 1 1 A 74 74 ALA H H 74 8.059 7.747 0.312 1
1 939 . 6 1 1 A 74 74 ALA HA H 74 4.100 4.286 -0.186 1
1 943 . 6 1 1 A 74 74 ALA C C 74 177.757 177.155 0.602 1
1 944 . 6 1 1 A 74 74 ALA CA C 74 53.153 52.590 0.563 1
1 945 . 6 1 1 A 74 74 ALA CB C 74 19.412 19.262 0.150 1
1 946 . 6 1 1 A 74 74 ALA N N 74 122.292 121.697 0.595 1
1 947 . 6 1 1 A 75 75 ARG H H 75 8.500 8.478 0.022 1
1 948 . 6 1 1 A 75 75 ARG HA H 75 4.758 4.638 0.120 1
1 955 . 6 1 1 A 75 75 ARG C C 75 176.812 175.837 0.975 1
1 956 . 6 1 1 A 75 75 ARG CA C 75 56.646 56.291 0.355 1
1 957 . 6 1 1 A 75 75 ARG CB C 75 29.375 30.574 -1.199 1
1 960 . 6 1 1 A 75 75 ARG N N 75 122.871 123.130 -0.259 1
1 961 . 6 1 1 A 76 76 VAL H H 76 7.965 9.038 -1.073 1
1 962 . 6 1 1 A 76 76 VAL HA H 76 5.230 4.783 0.447 1
1 970 . 6 1 1 A 76 76 VAL C C 76 173.758 174.608 -0.850 1
1 971 . 6 1 1 A 76 76 VAL CA C 76 58.193 59.169 -0.976 1
1 972 . 6 1 1 A 76 76 VAL CB C 76 36.536 34.726 1.810 1
1 975 . 6 1 1 A 76 76 VAL N N 76 116.220 118.682 -2.462 1
1 976 . 6 1 1 A 77 77 GLU H H 77 9.166 9.255 -0.089 1
1 977 . 6 1 1 A 77 77 GLU HA H 77 4.663 4.975 -0.312 1
1 982 . 6 1 1 A 77 77 GLU C C 77 174.940 174.844 0.096 1
1 983 . 6 1 1 A 77 77 GLU CA C 77 53.546 54.416 -0.870 1
1 984 . 6 1 1 A 77 77 GLU CB C 77 33.395 33.469 -0.074 1
1 986 . 6 1 1 A 77 77 GLU N N 77 116.413 123.175 -6.762 1
1 987 . 6 1 1 A 78 78 LEU H H 78 8.670 8.788 -0.118 1
1 988 . 6 1 1 A 78 78 LEU HA H 78 4.677 4.741 -0.064 1
1 998 . 6 1 1 A 78 78 LEU C C 78 176.036 176.737 -0.701 1
1 999 . 6 1 1 A 78 78 LEU CA C 78 53.091 53.654 -0.563 1
1 1000 . 6 1 1 A 78 78 LEU CB C 78 43.276 43.431 -0.155 1
1 1004 . 6 1 1 A 78 78 LEU N N 78 117.927 123.678 -5.751 1
1 1005 . 6 1 1 A 79 79 ILE H H 79 7.900 8.455 -0.555 1
1 1006 . 6 1 1 A 79 79 ILE HA H 79 4.312 4.087 0.225 1
1 1016 . 6 1 1 A 79 79 ILE C C 79 175.179 176.218 -1.039 1
1 1017 . 6 1 1 A 79 79 ILE CA C 79 58.294 63.888 -5.594 1
1 1018 . 6 1 1 A 79 79 ILE CB C 79 36.086 38.315 -2.229 1
1 1022 . 6 1 1 A 79 79 ILE N N 79 121.667 122.858 -1.191 1
1 1023 . 6 1 1 A 80 80 ASN H H 80 9.412 8.321 1.091 1
1 1024 . 6 1 1 A 80 80 ASN HA H 80 4.516 5.201 -0.685 1
1 1029 . 6 1 1 A 80 80 ASN C C 80 170.300 172.378 -2.078 1
1 1030 . 6 1 1 A 80 80 ASN CA C 80 54.198 50.487 3.711 1
1 1031 . 6 1 1 A 80 80 ASN CB C 80 37.450 39.186 -1.736 1
1 1033 . 6 1 1 A 80 80 ASN N N 80 123.831 118.670 5.161 1
1 1035 . 6 1 1 A 81 81 PRO HA H 81 5.185 4.869 0.316 1
1 1042 . 6 1 1 A 81 81 PRO C C 81 176.865 176.552 0.313 1
1 1043 . 6 1 1 A 81 81 PRO CA C 81 62.637 62.466 0.171 1
1 1044 . 6 1 1 A 81 81 PRO CB C 81 32.965 32.644 0.321 1
1 1047 . 6 1 1 A 82 82 ILE H H 82 9.374 8.607 0.767 1
1 1048 . 6 1 1 A 82 82 ILE HA H 82 4.524 5.045 -0.521 1
1 1058 . 6 1 1 A 82 82 ILE C C 82 174.731 174.353 0.378 1
1 1059 . 6 1 1 A 82 82 ILE CA C 82 60.205 58.777 1.428 1
1 1060 . 6 1 1 A 82 82 ILE CB C 82 41.737 41.452 0.285 1
1 1064 . 6 1 1 A 82 82 ILE N N 82 121.658 117.172 4.486 1
1 1065 . 6 1 1 A 83 83 ALA H H 83 8.819 8.848 -0.029 1
1 1066 . 6 1 1 A 83 83 ALA HA H 83 4.773 4.915 -0.142 1
1 1070 . 6 1 1 A 83 83 ALA C C 83 176.550 176.448 0.102 1
1 1071 . 6 1 1 A 83 83 ALA CA C 83 52.069 52.060 0.009 1
1 1072 . 6 1 1 A 83 83 ALA CB C 83 20.374 19.689 0.685 1
1 1073 . 6 1 1 A 83 83 ALA N N 83 127.933 127.206 0.727 1
1 1074 . 6 1 1 A 84 84 ASP H H 84 8.710 8.754 -0.044 1
1 1075 . 6 1 1 A 84 84 ASP HA H 84 4.894 4.785 0.109 1
1 1078 . 6 1 1 A 84 84 ASP C C 84 175.997 176.982 -0.985 1
1 1079 . 6 1 1 A 84 84 ASP CA C 84 53.334 53.904 -0.570 1
1 1080 . 6 1 1 A 84 84 ASP CB C 84 42.104 40.986 1.118 1
1 1081 . 6 1 1 A 84 84 ASP N N 84 122.009 122.884 -0.875 1
1 1082 . 6 1 1 A 85 85 THR H H 85 8.349 8.467 -0.118 1
1 1083 . 6 1 1 A 85 85 THR HA H 85 4.420 4.708 -0.288 1
1 1088 . 6 1 1 A 85 85 THR C C 85 175.085 175.369 -0.284 1
1 1089 . 6 1 1 A 85 85 THR CA C 85 62.304 61.650 0.654 1
1 1090 . 6 1 1 A 85 85 THR CB C 85 69.718 69.830 -0.112 1
1 1092 . 6 1 1 A 85 85 THR N N 85 114.986 116.077 -1.091 1
1 1093 . 6 1 1 A 86 86 VAL H H 86 8.188 7.523 0.665 1
1 1094 . 6 1 1 A 86 86 VAL HA H 86 4.021 4.182 -0.161 1
1 1102 . 6 1 1 A 86 86 VAL C C 86 176.519 177.397 -0.878 1
1 1103 . 6 1 1 A 86 86 VAL CA C 86 63.046 62.964 0.082 1
1 1104 . 6 1 1 A 86 86 VAL CB C 86 32.526 32.129 0.397 1
1 1107 . 6 1 1 A 86 86 VAL N N 86 122.275 119.955 2.320 1
1 1108 . 6 1 1 A 87 87 ALA H H 87 8.194 8.116 0.078 1
1 1109 . 6 1 1 A 87 87 ALA HA H 87 4.212 4.487 -0.275 1
1 1113 . 6 1 1 A 87 87 ALA C C 87 178.118 178.483 -0.365 1
1 1114 . 6 1 1 A 87 87 ALA CA C 87 53.153 53.725 -0.572 1
1 1115 . 6 1 1 A 87 87 ALA CB C 87 19.165 18.500 0.665 1
1 1116 . 6 1 1 A 87 87 ALA N N 87 126.609 125.453 1.156 1
1 1117 . 6 1 1 A 88 88 THR H H 88 7.914 7.834 0.080 1
1 1118 . 6 1 1 A 88 88 THR HA H 88 4.173 4.397 -0.224 1
1 1123 . 6 1 1 A 88 88 THR C C 88 174.516 173.704 0.812 1
1 1124 . 6 1 1 A 88 88 THR CA C 88 62.785 61.845 0.940 1
1 1125 . 6 1 1 A 88 88 THR CB C 88 69.582 68.586 0.996 1
1 1127 . 6 1 1 A 88 88 THR N N 88 112.328 108.505 3.823 1
1 1128 . 6 1 1 A 89 89 ALA H H 89 8.076 8.075 0.001 1
1 1129 . 6 1 1 A 89 89 ALA HA H 89 4.320 4.539 -0.219 1
1 1133 . 6 1 1 A 89 89 ALA C C 89 178.014 176.607 1.407 1
1 1134 . 6 1 1 A 89 89 ALA CA C 89 53.079 51.259 1.820 1
1 1135 . 6 1 1 A 89 89 ALA CB C 89 19.335 20.656 -1.321 1
1 1136 . 6 1 1 A 89 89 ALA N N 89 124.632 123.112 1.520 1
1 1137 . 6 1 1 A 90 90 THR H H 90 7.976 8.625 -0.649 1
1 1138 . 6 1 1 A 90 90 THR HA H 90 4.203 3.768 0.435 1
1 1143 . 6 1 1 A 90 90 THR C C 90 174.427 174.775 -0.348 1
1 1144 . 6 1 1 A 90 90 THR CA C 90 62.519 65.650 -3.131 1
1 1145 . 6 1 1 A 90 90 THR CB C 90 69.721 66.514 3.207 1
1 1147 . 6 1 1 A 90 90 THR N N 90 112.047 117.180 -5.133 1
1 1148 . 6 1 1 A 91 91 TYR H H 91 7.959 8.128 -0.169 1
1 1149 . 6 1 1 A 91 91 TYR HA H 91 4.564 4.438 0.126 1
1 1156 . 6 1 1 A 91 91 TYR C C 91 175.522 176.305 -0.783 1
1 1157 . 6 1 1 A 91 91 TYR CA C 91 57.874 59.609 -1.735 1
1 1158 . 6 1 1 A 91 91 TYR CB C 91 38.584 38.050 0.534 1
1 1163 . 6 1 1 A 91 91 TYR N N 91 121.184 119.450 1.734 1
1 1164 . 6 1 1 A 92 92 GLN H H 92 8.310 7.919 0.391 1
1 1165 . 6 1 1 A 92 92 GLN HA H 92 4.258 4.829 -0.571 1
1 1172 . 6 1 1 A 92 92 GLN C C 92 176.099 175.320 0.779 1
1 1173 . 6 1 1 A 92 92 GLN CA C 92 56.109 55.068 1.041 1
1 1174 . 6 1 1 A 92 92 GLN CB C 92 29.112 31.800 -2.688 1
1 1177 . 6 1 1 A 92 92 GLN N N 92 121.631 117.813 3.818 1
1 1179 . 6 1 1 A 93 93 GLY H H 93 8.052 8.640 -0.588 1
1 1180 . 6 1 1 A 93 93 GLY HA2 H 93 4.023 3.960 0.063 1
1 1181 . 6 1 1 A 93 93 GLY HA3 H 93 3.856 3.962 -0.106 1
1 1182 . 6 1 1 A 93 93 GLY C C 93 173.791 174.084 -0.293 1
1 1183 . 6 1 1 A 93 93 GLY CA C 93 45.382 45.972 -0.590 1
1 1184 . 6 1 1 A 93 93 GLY N N 93 109.847 113.324 -3.477 1
1 1185 . 6 1 1 A 94 94 ALA H H 94 8.162 7.781 0.381 1
1 1186 . 6 1 1 A 94 94 ALA HA H 94 4.329 4.441 -0.112 1
1 1190 . 6 1 1 A 94 94 ALA C C 94 177.392 176.965 0.427 1
1 1191 . 6 1 1 A 94 94 ALA CA C 94 52.558 51.316 1.242 1
1 1192 . 6 1 1 A 94 94 ALA CB C 94 19.526 20.616 -1.090 1
1 1193 . 6 1 1 A 94 94 ALA N N 94 123.424 123.388 0.036 1
1 1194 . 6 1 1 A 95 95 ASP H H 95 8.457 8.700 -0.243 1
1 1195 . 6 1 1 A 95 95 ASP HA H 95 4.608 4.882 -0.274 1
1 1198 . 6 1 1 A 95 95 ASP C C 95 175.630 176.063 -0.433 1
1 1199 . 6 1 1 A 95 95 ASP CA C 95 54.450 54.227 0.223 1
1 1200 . 6 1 1 A 95 95 ASP CB C 95 40.871 40.547 0.324 1
1 1201 . 6 1 1 A 95 95 ASP N N 95 118.814 121.044 -2.230 1
1 1202 . 6 1 1 A 96 96 VAL H H 96 7.776 8.734 -0.958 1
1 1203 . 6 1 1 A 96 96 VAL HA H 96 4.141 4.936 -0.795 1
1 1211 . 6 1 1 A 96 96 VAL C C 96 175.301 174.498 0.803 1
1 1212 . 6 1 1 A 96 96 VAL CA C 96 61.435 59.812 1.623 1
1 1213 . 6 1 1 A 96 96 VAL CB C 96 33.517 34.660 -1.143 1
1 1216 . 6 1 1 A 96 96 VAL N N 96 118.395 117.287 1.108 1
1 1217 . 6 1 1 A 97 97 ASP H H 97 8.315 8.534 -0.219 1
1 1218 . 6 1 1 A 97 97 ASP HA H 97 4.681 4.591 0.090 1
1 1221 . 6 1 1 A 97 97 ASP C C 97 175.151 176.427 -1.276 1
1 1222 . 6 1 1 A 97 97 ASP CA C 97 54.324 54.672 -0.348 1
1 1223 . 6 1 1 A 97 97 ASP CB C 97 41.963 40.800 1.163 1
1 1224 . 6 1 1 A 97 97 ASP N N 97 123.905 119.874 4.031 1
1 1225 . 6 1 1 A 98 98 TRP H H 98 8.210 8.893 -0.683 1
1 1226 . 6 1 1 A 98 98 TRP HA H 98 4.916 5.538 -0.622 1
1 1235 . 6 1 1 A 98 98 TRP C C 98 174.585 175.046 -0.461 1
1 1236 . 6 1 1 A 98 98 TRP CA C 98 56.164 55.059 1.105 1
1 1237 . 6 1 1 A 98 98 TRP CB C 98 31.466 32.666 -1.200 1
1 1243 . 6 1 1 A 98 98 TRP N N 98 120.340 120.746 -0.406 1
1 1245 . 6 1 1 A 99 99 TYR H H 99 8.760 9.210 -0.450 1
1 1246 . 6 1 1 A 99 99 TYR HA H 99 5.119 5.444 -0.325 1
1 1253 . 6 1 1 A 99 99 TYR C C 99 174.599 175.016 -0.417 1
1 1254 . 6 1 1 A 99 99 TYR CA C 99 57.021 56.075 0.946 1
1 1255 . 6 1 1 A 99 99 TYR CB C 99 39.526 41.549 -2.023 1
1 1260 . 6 1 1 A 99 99 TYR N N 99 123.319 117.621 5.698 1
1 1261 . 6 1 1 A 100 100 ILE H H 100 8.936 9.361 -0.425 1
1 1262 . 6 1 1 A 100 100 ILE HA H 100 4.850 4.792 0.058 1
1 1272 . 6 1 1 A 100 100 ILE C C 100 175.070 174.968 0.102 1
1 1273 . 6 1 1 A 100 100 ILE CA C 100 58.998 60.474 -1.476 1
1 1274 . 6 1 1 A 100 100 ILE CB C 100 40.667 39.962 0.705 1
1 1278 . 6 1 1 A 100 100 ILE N N 100 123.281 122.550 0.731 1
1 1279 . 6 1 1 A 101 101 LYS H H 101 8.987 8.877 0.110 1
1 1280 . 6 1 1 A 101 101 LYS HA H 101 5.313 4.970 0.343 1
1 1289 . 6 1 1 A 101 101 LYS C C 101 174.440 176.068 -1.628 1
1 1290 . 6 1 1 A 101 101 LYS CA C 101 54.763 55.982 -1.219 1
1 1291 . 6 1 1 A 101 101 LYS CB C 101 34.880 33.191 1.689 1
1 1295 . 6 1 1 A 101 101 LYS N N 101 126.210 127.464 -1.254 1
1 1296 . 6 1 1 A 102 102 ALA H H 102 8.531 8.154 0.377 1
1 1297 . 6 1 1 A 102 102 ALA HA H 102 4.957 4.995 -0.038 1
1 1301 . 6 1 1 A 102 102 ALA C C 102 175.024 177.162 -2.138 1
1 1302 . 6 1 1 A 102 102 ALA CA C 102 50.701 50.513 0.188 1
1 1303 . 6 1 1 A 102 102 ALA CB C 102 21.618 23.017 -1.399 1
1 1304 . 6 1 1 A 102 102 ALA N N 102 121.424 124.936 -3.512 1
1 1305 . 6 1 1 A 103 103 ASP H H 103 8.339 8.836 -0.497 1
1 1306 . 6 1 1 A 103 103 ASP HA H 103 4.603 4.551 0.052 1
1 1309 . 6 1 1 A 103 103 ASP C C 103 176.188 175.026 1.162 1
1 1310 . 6 1 1 A 103 103 ASP CA C 103 56.049 56.811 -0.762 1
1 1311 . 6 1 1 A 103 103 ASP CB C 103 40.932 40.793 0.139 1
1 1312 . 6 1 1 A 103 103 ASP N N 103 117.773 119.247 -1.474 1
1 1313 . 6 1 1 A 104 104 ASP H H 104 7.482 8.092 -0.610 1
1 1314 . 6 1 1 A 104 104 ASP HA H 104 4.727 5.076 -0.349 1
1 1317 . 6 1 1 A 104 104 ASP C C 104 174.261 173.858 0.403 1
1 1318 . 6 1 1 A 104 104 ASP CA C 104 52.768 52.893 -0.125 1
1 1319 . 6 1 1 A 104 104 ASP CB C 104 42.587 44.604 -2.017 1
1 1320 . 6 1 1 A 104 104 ASP N N 104 110.673 117.937 -7.264 1
1 1321 . 6 1 1 A 105 105 ILE H H 105 9.267 8.416 0.851 1
1 1322 . 6 1 1 A 105 105 ILE HA H 105 4.631 5.050 -0.419 1
1 1332 . 6 1 1 A 105 105 ILE C C 105 173.922 175.610 -1.688 1
1 1333 . 6 1 1 A 105 105 ILE CA C 105 61.114 60.505 0.609 1
1 1334 . 6 1 1 A 105 105 ILE CB C 105 42.522 40.560 1.962 1
1 1338 . 6 1 1 A 105 105 ILE N N 105 121.380 122.494 -1.114 1
1 1339 . 6 1 1 A 106 106 VAL H H 106 8.592 8.873 -0.281 1
1 1340 . 6 1 1 A 106 106 VAL HA H 106 4.975 5.056 -0.081 1
1 1348 . 6 1 1 A 106 106 VAL C C 106 175.049 174.868 0.181 1
1 1349 . 6 1 1 A 106 106 VAL CA C 106 58.028 59.188 -1.160 1
1 1350 . 6 1 1 A 106 106 VAL CB C 106 35.388 35.693 -0.305 1
1 1353 . 6 1 1 A 106 106 VAL N N 106 116.356 120.283 -3.927 1
1 1354 . 6 1 1 A 107 107 LEU H H 107 8.360 8.619 -0.259 1
1 1355 . 6 1 1 A 107 107 LEU HA H 107 4.167 4.270 -0.103 1
1 1365 . 6 1 1 A 107 107 LEU C C 107 178.338 177.406 0.932 1
1 1366 . 6 1 1 A 107 107 LEU CA C 107 55.077 54.459 0.618 1
1 1367 . 6 1 1 A 107 107 LEU CB C 107 42.394 42.115 0.279 1
1 1371 . 6 1 1 A 107 107 LEU N N 107 121.368 122.730 -1.362 1
1 1372 . 6 1 1 A 108 108 THR H H 108 7.977 8.842 -0.865 1
1 1373 . 6 1 1 A 108 108 THR HA H 108 4.039 4.618 -0.579 1
1 1378 . 6 1 1 A 108 108 THR C C 108 174.725 174.953 -0.228 1
1 1379 . 6 1 1 A 108 108 THR CA C 108 63.513 63.574 -0.061 1
1 1380 . 6 1 1 A 108 108 THR CB C 108 69.194 69.200 -0.006 1
1 1382 . 6 1 1 A 108 108 THR N N 108 118.728 118.928 -0.200 1
1 1383 . 6 1 1 A 109 109 LEU H H 109 8.378 8.676 -0.298 1
1 1384 . 6 1 1 A 109 109 LEU HA H 109 4.274 4.378 -0.104 1
1 1394 . 6 1 1 A 109 109 LEU C C 109 177.058 177.552 -0.494 1
1 1395 . 6 1 1 A 109 109 LEU CA C 109 55.045 55.731 -0.686 1
1 1396 . 6 1 1 A 109 109 LEU CB C 109 42.620 41.182 1.438 1
1 1400 . 6 1 1 A 109 109 LEU N N 109 124.847 126.809 -1.962 1
1 9 . 7 1 1 A 2 2 MET HA H 2 4.554 4.825 -0.271 1
1 14 . 7 1 1 A 2 2 MET C C 2 174.749 174.503 0.246 1
1 15 . 7 1 1 A 2 2 MET CA C 2 55.354 54.100 1.254 1
1 16 . 7 1 1 A 2 2 MET CB C 2 33.729 35.929 -2.200 1
1 18 . 7 1 1 A 3 3 ARG H H 3 8.518 8.516 0.002 1
1 19 . 7 1 1 A 3 3 ARG HA H 3 4.531 4.623 -0.092 1
1 26 . 7 1 1 A 3 3 ARG C C 3 175.780 175.162 0.618 1
1 27 . 7 1 1 A 3 3 ARG CA C 3 55.854 55.340 0.514 1
1 28 . 7 1 1 A 3 3 ARG CB C 3 31.403 31.099 0.304 1
1 31 . 7 1 1 A 3 3 ARG N N 3 124.008 121.860 2.148 1
1 32 . 7 1 1 A 4 4 LEU H H 4 8.424 8.973 -0.549 1
1 33 . 7 1 1 A 4 4 LEU HA H 4 4.457 5.055 -0.598 1
1 43 . 7 1 1 A 4 4 LEU C C 4 177.362 175.958 1.404 1
1 44 . 7 1 1 A 4 4 LEU CA C 4 54.511 53.152 1.359 1
1 45 . 7 1 1 A 4 4 LEU CB C 4 42.686 45.801 -3.115 1
1 49 . 7 1 1 A 4 4 LEU N N 4 124.389 128.372 -3.983 1
1 50 . 7 1 1 A 5 5 ALA H H 5 8.418 8.672 -0.254 1
1 51 . 7 1 1 A 5 5 ALA HA H 5 4.254 4.480 -0.226 1
1 55 . 7 1 1 A 5 5 ALA C C 5 177.420 176.889 0.531 1
1 56 . 7 1 1 A 5 5 ALA CA C 5 52.931 53.362 -0.431 1
1 57 . 7 1 1 A 5 5 ALA CB C 5 19.263 20.692 -1.429 1
1 58 . 7 1 1 A 5 5 ALA N N 5 124.548 121.873 2.675 1
1 59 . 7 1 1 A 6 6 ASN H H 6 8.287 8.359 -0.072 1
1 60 . 7 1 1 A 6 6 ASN HA H 6 4.616 5.028 -0.412 1
1 65 . 7 1 1 A 6 6 ASN C C 6 175.837 174.630 1.207 1
1 66 . 7 1 1 A 6 6 ASN CA C 6 53.345 51.716 1.629 1
1 67 . 7 1 1 A 6 6 ASN CB C 6 38.571 41.584 -3.013 1
1 69 . 7 1 1 A 6 6 ASN N N 6 116.484 112.834 3.650 1
1 71 . 7 1 1 A 7 7 GLY H H 7 8.351 8.480 -0.129 1
1 72 . 7 1 1 A 7 7 GLY HA2 H 7 4.130 3.954 0.176 1
1 73 . 7 1 1 A 7 7 GLY HA3 H 7 3.808 3.954 -0.146 1
1 74 . 7 1 1 A 7 7 GLY C C 7 173.750 174.248 -0.498 1
1 75 . 7 1 1 A 7 7 GLY CA C 7 45.343 45.112 0.231 1
1 76 . 7 1 1 A 7 7 GLY N N 7 108.453 108.771 -0.318 1
1 77 . 7 1 1 A 8 8 ILE H H 8 7.868 7.727 0.141 1
1 78 . 7 1 1 A 8 8 ILE HA H 8 4.130 4.270 -0.140 1
1 88 . 7 1 1 A 8 8 ILE C C 8 175.570 175.457 0.113 1
1 89 . 7 1 1 A 8 8 ILE CA C 8 61.095 59.956 1.139 1
1 90 . 7 1 1 A 8 8 ILE CB C 8 38.694 39.318 -0.624 1
1 94 . 7 1 1 A 8 8 ILE N N 8 120.848 118.478 2.370 1
1 95 . 7 1 1 A 9 9 VAL H H 9 8.220 8.165 0.055 1
1 96 . 7 1 1 A 9 9 VAL HA H 9 4.172 4.146 0.026 1
1 104 . 7 1 1 A 9 9 VAL C C 9 175.898 176.401 -0.503 1
1 105 . 7 1 1 A 9 9 VAL CA C 9 62.488 62.055 0.433 1
1 106 . 7 1 1 A 9 9 VAL CB C 9 32.460 31.034 1.426 1
1 109 . 7 1 1 A 9 9 VAL N N 9 125.805 122.666 3.139 1
1 110 . 7 1 1 A 10 10 LEU H H 10 8.437 7.880 0.557 1
1 111 . 7 1 1 A 10 10 LEU HA H 10 4.347 4.038 0.309 1
1 121 . 7 1 1 A 10 10 LEU C C 10 176.398 176.624 -0.226 1
1 122 . 7 1 1 A 10 10 LEU CA C 10 54.787 57.112 -2.325 1
1 123 . 7 1 1 A 10 10 LEU CB C 10 42.639 42.927 -0.288 1
1 127 . 7 1 1 A 10 10 LEU N N 10 127.757 126.298 1.459 1
1 128 . 7 1 1 A 11 11 ASP H H 11 8.506 8.111 0.395 1
1 129 . 7 1 1 A 11 11 ASP HA H 11 4.683 4.260 0.423 1
1 132 . 7 1 1 A 11 11 ASP C C 11 176.672 175.838 0.834 1
1 133 . 7 1 1 A 11 11 ASP CA C 11 53.586 54.938 -1.352 1
1 134 . 7 1 1 A 11 11 ASP CB C 11 41.123 39.255 1.868 1
1 135 . 7 1 1 A 11 11 ASP N N 11 121.539 119.729 1.810 1
1 136 . 7 1 1 A 12 12 LYS H H 12 8.578 7.736 0.842 1
1 137 . 7 1 1 A 12 12 LYS HA H 12 3.943 4.623 -0.680 1
1 146 . 7 1 1 A 12 12 LYS C C 12 176.917 175.075 1.842 1
1 147 . 7 1 1 A 12 12 LYS CA C 12 58.542 54.763 3.779 1
1 148 . 7 1 1 A 12 12 LYS CB C 12 32.703 34.048 -1.345 1
1 152 . 7 1 1 A 12 12 LYS N N 12 123.635 120.843 2.792 1
1 153 . 7 1 1 A 13 13 ASP H H 13 8.523 8.821 -0.298 1
1 154 . 7 1 1 A 13 13 ASP HA H 13 4.566 4.610 -0.044 1
1 157 . 7 1 1 A 13 13 ASP C C 13 177.535 176.274 1.261 1
1 158 . 7 1 1 A 13 13 ASP CA C 13 56.034 54.150 1.884 1
1 159 . 7 1 1 A 13 13 ASP CB C 13 41.051 40.005 1.046 1
1 160 . 7 1 1 A 13 13 ASP N N 13 120.448 126.896 -6.448 1
1 161 . 7 1 1 A 14 14 THR H H 14 7.964 8.097 -0.133 1
1 162 . 7 1 1 A 14 14 THR HA H 14 4.146 4.095 0.051 1
1 167 . 7 1 1 A 14 14 THR C C 14 175.440 173.785 1.655 1
1 168 . 7 1 1 A 14 14 THR CA C 14 63.245 64.686 -1.441 1
1 169 . 7 1 1 A 14 14 THR CB C 14 69.092 69.361 -0.269 1
1 171 . 7 1 1 A 14 14 THR N N 14 113.711 120.740 -7.029 1
1 172 . 7 1 1 A 15 15 THR H H 15 7.921 7.885 0.036 1
1 173 . 7 1 1 A 15 15 THR HA H 15 3.920 4.553 -0.633 1
1 178 . 7 1 1 A 15 15 THR C C 15 174.750 173.787 0.963 1
1 179 . 7 1 1 A 15 15 THR CA C 15 64.562 61.369 3.193 1
1 180 . 7 1 1 A 15 15 THR CB C 15 69.166 70.355 -1.189 1
1 182 . 7 1 1 A 15 15 THR N N 15 116.710 113.759 2.951 1
1 183 . 7 1 1 A 16 16 PHE H H 16 8.191 8.965 -0.774 1
1 184 . 7 1 1 A 16 16 PHE HA H 16 4.628 4.784 -0.156 1
1 192 . 7 1 1 A 16 16 PHE C C 16 177.754 176.440 1.314 1
1 193 . 7 1 1 A 16 16 PHE CA C 16 57.975 57.568 0.407 1
1 194 . 7 1 1 A 16 16 PHE CB C 16 39.553 39.698 -0.145 1
1 200 . 7 1 1 A 16 16 PHE N N 16 117.124 126.231 -9.107 1
1 201 . 7 1 1 A 17 17 GLY H H 17 8.110 8.679 -0.569 1
1 202 . 7 1 1 A 17 17 GLY HA2 H 17 4.017 4.085 -0.068 1
1 203 . 7 1 1 A 17 17 GLY HA3 H 17 3.849 4.089 -0.240 1
1 204 . 7 1 1 A 17 17 GLY C C 17 172.231 173.512 -1.281 1
1 205 . 7 1 1 A 17 17 GLY CA C 17 45.633 44.389 1.244 1
1 206 . 7 1 1 A 17 17 GLY N N 17 109.951 110.862 -0.911 1
1 207 . 7 1 1 A 18 18 GLU H H 18 8.304 8.535 -0.231 1
1 208 . 7 1 1 A 18 18 GLU HA H 18 4.078 4.193 -0.115 1
1 213 . 7 1 1 A 18 18 GLU C C 18 175.588 176.224 -0.636 1
1 214 . 7 1 1 A 18 18 GLU CA C 18 57.446 56.678 0.768 1
1 215 . 7 1 1 A 18 18 GLU CB C 18 30.767 29.792 0.975 1
1 217 . 7 1 1 A 18 18 GLU N N 18 121.640 119.510 2.130 1
1 218 . 7 1 1 A 19 19 LEU H H 19 8.799 8.076 0.723 1
1 219 . 7 1 1 A 19 19 LEU HA H 19 5.416 4.947 0.469 1
1 229 . 7 1 1 A 19 19 LEU C C 19 176.875 176.251 0.624 1
1 230 . 7 1 1 A 19 19 LEU CA C 19 53.281 53.476 -0.195 1
1 231 . 7 1 1 A 19 19 LEU CB C 19 45.508 44.026 1.482 1
1 235 . 7 1 1 A 19 19 LEU N N 19 127.101 125.417 1.684 1
1 236 . 7 1 1 A 20 20 LYS H H 20 8.494 8.608 -0.114 1
1 237 . 7 1 1 A 20 20 LYS HA H 20 5.200 4.802 0.398 1
1 246 . 7 1 1 A 20 20 LYS C C 20 176.163 175.157 1.006 1
1 247 . 7 1 1 A 20 20 LYS CA C 20 53.575 55.045 -1.470 1
1 248 . 7 1 1 A 20 20 LYS CB C 20 36.835 34.373 2.462 1
1 252 . 7 1 1 A 20 20 LYS N N 20 118.828 121.257 -2.429 1
1 253 . 7 1 1 A 21 21 PHE H H 21 9.658 9.236 0.422 1
1 254 . 7 1 1 A 21 21 PHE HA H 21 4.038 4.678 -0.640 1
1 262 . 7 1 1 A 21 21 PHE C C 21 174.296 175.841 -1.545 1
1 263 . 7 1 1 A 21 21 PHE CA C 21 60.462 57.285 3.177 1
1 264 . 7 1 1 A 21 21 PHE CB C 21 40.359 39.728 0.631 1
1 270 . 7 1 1 A 21 21 PHE N N 21 124.322 127.268 -2.946 1
1 271 . 7 1 1 A 22 22 SER H H 22 7.199 8.673 -1.474 1
1 272 . 7 1 1 A 22 22 SER HA H 22 5.046 4.586 0.460 1
1 275 . 7 1 1 A 22 22 SER C C 22 173.080 174.400 -1.320 1
1 276 . 7 1 1 A 22 22 SER CA C 22 58.547 58.744 -0.197 1
1 277 . 7 1 1 A 22 22 SER CB C 22 63.591 63.366 0.225 1
1 278 . 7 1 1 A 22 22 SER N N 22 120.109 121.058 -0.949 1
1 279 . 7 1 1 A 23 23 ALA H H 23 7.269 7.213 0.056 1
1 280 . 7 1 1 A 23 23 ALA HA H 23 4.426 4.446 -0.020 1
1 284 . 7 1 1 A 23 23 ALA C C 23 176.568 174.756 1.812 1
1 285 . 7 1 1 A 23 23 ALA CA C 23 52.458 51.313 1.145 1
1 286 . 7 1 1 A 23 23 ALA CB C 23 22.728 22.392 0.336 1
1 287 . 7 1 1 A 23 23 ALA N N 23 114.102 119.699 -5.597 1
1 288 . 7 1 1 A 24 24 LEU H H 24 8.819 8.616 0.203 1
1 289 . 7 1 1 A 24 24 LEU HA H 24 4.060 4.432 -0.372 1
1 299 . 7 1 1 A 24 24 LEU C C 24 175.363 176.880 -1.517 1
1 300 . 7 1 1 A 24 24 LEU CA C 24 56.901 54.610 2.291 1
1 301 . 7 1 1 A 24 24 LEU CB C 24 42.065 42.266 -0.201 1
1 305 . 7 1 1 A 24 24 LEU N N 24 120.865 120.772 0.093 1
1 306 . 7 1 1 A 25 25 ARG H H 25 9.473 8.907 0.566 1
1 307 . 7 1 1 A 25 25 ARG HA H 25 4.428 4.161 0.267 1
1 315 . 7 1 1 A 25 25 ARG C C 25 175.729 175.517 0.212 1
1 316 . 7 1 1 A 25 25 ARG CA C 25 56.721 57.956 -1.235 1
1 317 . 7 1 1 A 25 25 ARG CB C 25 31.109 31.226 -0.117 1
1 320 . 7 1 1 A 25 25 ARG N N 25 130.455 128.244 2.211 1
1 322 . 7 1 1 A 26 26 ARG H H 26 7.711 7.322 0.389 1
1 323 . 7 1 1 A 26 26 ARG HA H 26 4.559 4.612 -0.053 1
1 330 . 7 1 1 A 26 26 ARG C C 26 173.724 173.592 0.132 1
1 331 . 7 1 1 A 26 26 ARG CA C 26 55.737 55.786 -0.049 1
1 332 . 7 1 1 A 26 26 ARG CB C 26 33.261 34.195 -0.934 1
1 335 . 7 1 1 A 26 26 ARG N N 26 113.305 118.320 -5.015 1
1 336 . 7 1 1 A 27 27 GLU H H 27 8.848 8.727 0.121 1
1 337 . 7 1 1 A 27 27 GLU HA H 27 4.615 4.933 -0.318 1
1 342 . 7 1 1 A 27 27 GLU C C 27 174.836 175.600 -0.764 1
1 343 . 7 1 1 A 27 27 GLU CA C 27 55.901 54.849 1.052 1
1 344 . 7 1 1 A 27 27 GLU CB C 27 30.755 31.638 -0.883 1
1 346 . 7 1 1 A 27 27 GLU N N 27 121.934 125.010 -3.076 1
1 347 . 7 1 1 A 28 28 VAL H H 28 8.603 8.625 -0.022 1
1 348 . 7 1 1 A 28 28 VAL HA H 28 4.013 4.787 -0.774 1
1 356 . 7 1 1 A 28 28 VAL C C 28 175.561 175.677 -0.116 1
1 357 . 7 1 1 A 28 28 VAL CA C 28 62.791 60.916 1.875 1
1 358 . 7 1 1 A 28 28 VAL CB C 28 32.710 33.181 -0.471 1
1 361 . 7 1 1 A 28 28 VAL N N 28 125.545 120.685 4.860 1
1 362 . 7 1 1 A 29 29 ARG H H 29 8.735 8.741 -0.006 1
1 363 . 7 1 1 A 29 29 ARG HA H 29 4.774 4.675 0.099 1
1 370 . 7 1 1 A 29 29 ARG C C 29 176.580 175.811 0.769 1
1 371 . 7 1 1 A 29 29 ARG CA C 29 55.481 54.728 0.753 1
1 372 . 7 1 1 A 29 29 ARG CB C 29 31.963 32.187 -0.224 1
1 375 . 7 1 1 A 29 29 ARG N N 29 128.327 126.596 1.731 1
1 376 . 7 1 1 A 30 30 ILE H H 30 8.358 8.616 -0.258 1
1 377 . 7 1 1 A 30 30 ILE HA H 30 3.882 4.531 -0.649 1
1 387 . 7 1 1 A 30 30 ILE C C 30 175.093 174.732 0.361 1
1 388 . 7 1 1 A 30 30 ILE CA C 30 61.669 60.218 1.451 1
1 389 . 7 1 1 A 30 30 ILE CB C 30 38.806 38.558 0.248 1
1 393 . 7 1 1 A 30 30 ILE N N 30 121.957 121.801 0.156 1
1 394 . 7 1 1 A 31 31 GLN H H 31 8.560 8.737 -0.177 1
1 395 . 7 1 1 A 31 31 GLN HA H 31 4.647 4.637 0.010 1
1 402 . 7 1 1 A 31 31 GLN C C 31 175.954 175.832 0.122 1
1 403 . 7 1 1 A 31 31 GLN CA C 31 54.833 55.543 -0.710 1
1 404 . 7 1 1 A 31 31 GLN CB C 31 30.584 29.623 0.961 1
1 407 . 7 1 1 A 31 31 GLN N N 31 126.348 128.242 -1.894 1
1 409 . 7 1 1 A 32 32 ASN H H 32 8.994 9.004 -0.010 1
1 410 . 7 1 1 A 32 32 ASN HA H 32 4.784 4.798 -0.014 1
1 415 . 7 1 1 A 32 32 ASN C C 32 177.296 176.714 0.582 1
1 416 . 7 1 1 A 32 32 ASN CA C 32 53.206 53.092 0.114 1
1 417 . 7 1 1 A 32 32 ASN CB C 32 39.472 39.032 0.440 1
1 419 . 7 1 1 A 32 32 ASN N N 32 122.834 124.792 -1.958 1
1 421 . 7 1 1 A 33 33 GLU H H 33 9.180 8.876 0.304 1
1 422 . 7 1 1 A 33 33 GLU HA H 33 4.063 4.063 0.000 1
1 427 . 7 1 1 A 33 33 GLU C C 33 176.787 178.170 -1.383 1
1 428 . 7 1 1 A 33 33 GLU CA C 33 59.347 59.256 0.091 1
1 429 . 7 1 1 A 33 33 GLU CB C 33 29.294 29.283 0.011 1
1 431 . 7 1 1 A 33 33 GLU N N 33 122.736 122.155 0.581 1
1 432 . 7 1 1 A 34 34 ASP H H 34 7.969 7.871 0.098 1
1 433 . 7 1 1 A 34 34 ASP HA H 34 4.499 4.559 -0.060 1
1 436 . 7 1 1 A 34 34 ASP C C 34 177.111 176.026 1.085 1
1 437 . 7 1 1 A 34 34 ASP CA C 34 53.632 54.449 -0.817 1
1 438 . 7 1 1 A 34 34 ASP CB C 34 39.807 40.907 -1.100 1
1 439 . 7 1 1 A 34 34 ASP N N 34 115.921 117.598 -1.677 1
1 440 . 7 1 1 A 35 35 GLY H H 35 8.083 8.130 -0.047 1
1 441 . 7 1 1 A 35 35 GLY HA2 H 35 4.366 4.019 0.347 1
1 442 . 7 1 1 A 35 35 GLY HA3 H 35 3.657 4.020 -0.363 1
1 443 . 7 1 1 A 35 35 GLY C C 35 174.584 174.739 -0.155 1
1 444 . 7 1 1 A 35 35 GLY CA C 35 45.134 45.323 -0.189 1
1 445 . 7 1 1 A 35 35 GLY N N 35 108.874 106.141 2.733 1
1 446 . 7 1 1 A 36 36 SER H H 36 8.274 7.970 0.304 1
1 447 . 7 1 1 A 36 36 SER HA H 36 4.389 4.464 -0.075 1
1 450 . 7 1 1 A 36 36 SER C C 36 173.284 173.601 -0.317 1
1 451 . 7 1 1 A 36 36 SER CA C 36 58.383 59.283 -0.900 1
1 452 . 7 1 1 A 36 36 SER CB C 36 64.576 64.560 0.016 1
1 453 . 7 1 1 A 36 36 SER N N 36 117.428 117.033 0.395 1
1 454 . 7 1 1 A 37 37 VAL H H 37 8.508 8.540 -0.032 1
1 455 . 7 1 1 A 37 37 VAL HA H 37 4.346 4.566 -0.220 1
1 463 . 7 1 1 A 37 37 VAL C C 37 176.370 175.633 0.737 1
1 464 . 7 1 1 A 37 37 VAL CA C 37 62.410 61.299 1.111 1
1 465 . 7 1 1 A 37 37 VAL CB C 37 33.086 32.835 0.251 1
1 468 . 7 1 1 A 37 37 VAL N N 37 119.189 124.999 -5.810 1
1 469 . 7 1 1 A 38 38 SER H H 38 8.461 8.819 -0.358 1
1 470 . 7 1 1 A 38 38 SER HA H 38 4.586 4.553 0.033 1
1 473 . 7 1 1 A 38 38 SER C C 38 173.829 175.290 -1.461 1
1 474 . 7 1 1 A 38 38 SER CA C 38 57.618 58.571 -0.953 1
1 475 . 7 1 1 A 38 38 SER CB C 38 64.537 63.964 0.573 1
1 476 . 7 1 1 A 38 38 SER N N 38 121.629 122.696 -1.067 1
1 477 . 7 1 1 A 39 39 ASP H H 39 8.512 8.806 -0.294 1
1 478 . 7 1 1 A 39 39 ASP HA H 39 4.606 4.632 -0.026 1
1 481 . 7 1 1 A 39 39 ASP C C 39 176.557 176.368 0.189 1
1 482 . 7 1 1 A 39 39 ASP CA C 39 54.833 55.367 -0.534 1
1 483 . 7 1 1 A 39 39 ASP CB C 39 41.123 41.084 0.039 1
1 484 . 7 1 1 A 39 39 ASP N N 39 120.305 123.627 -3.322 1
1 485 . 7 1 1 A 40 40 GLU H H 40 8.311 7.883 0.428 1
1 486 . 7 1 1 A 40 40 GLU HA H 40 4.235 4.354 -0.119 1
1 491 . 7 1 1 A 40 40 GLU C C 40 175.327 175.933 -0.606 1
1 492 . 7 1 1 A 40 40 GLU CA C 40 56.215 56.293 -0.078 1
1 493 . 7 1 1 A 40 40 GLU CB C 40 30.788 30.666 0.122 1
1 495 . 7 1 1 A 40 40 GLU N N 40 120.680 119.439 1.241 1
1 496 . 7 1 1 A 41 41 ILE H H 41 8.465 8.840 -0.375 1
1 497 . 7 1 1 A 41 41 ILE HA H 41 4.127 4.326 -0.199 1
1 507 . 7 1 1 A 41 41 ILE C C 41 175.380 176.013 -0.633 1
1 508 . 7 1 1 A 41 41 ILE CA C 41 60.670 60.487 0.183 1
1 509 . 7 1 1 A 41 41 ILE CB C 41 38.805 38.888 -0.083 1
1 513 . 7 1 1 A 41 41 ILE N N 41 123.665 125.335 -1.670 1
1 514 . 7 1 1 A 42 42 LYS H H 42 9.556 9.191 0.365 1
1 515 . 7 1 1 A 42 42 LYS HA H 42 4.428 4.276 0.152 1
1 524 . 7 1 1 A 42 42 LYS C C 42 177.277 175.572 1.705 1
1 525 . 7 1 1 A 42 42 LYS CA C 42 57.274 57.684 -0.410 1
1 526 . 7 1 1 A 42 42 LYS CB C 42 35.169 33.422 1.747 1
1 530 . 7 1 1 A 42 42 LYS N N 42 125.597 127.596 -1.999 1
1 531 . 7 1 1 A 43 43 GLU H H 43 7.809 7.546 0.263 1
1 532 . 7 1 1 A 43 43 GLU HA H 43 4.886 4.772 0.114 1
1 537 . 7 1 1 A 43 43 GLU C C 43 173.593 174.469 -0.876 1
1 538 . 7 1 1 A 43 43 GLU CA C 43 54.669 54.793 -0.124 1
1 539 . 7 1 1 A 43 43 GLU CB C 43 32.882 34.844 -1.962 1
1 541 . 7 1 1 A 43 43 GLU N N 43 115.292 116.125 -0.833 1
1 542 . 7 1 1 A 44 44 ARG H H 44 8.879 9.088 -0.209 1
1 543 . 7 1 1 A 44 44 ARG HA H 44 4.917 4.927 -0.010 1
1 551 . 7 1 1 A 44 44 ARG C C 44 173.708 174.463 -0.755 1
1 552 . 7 1 1 A 44 44 ARG CA C 44 55.965 54.999 0.966 1
1 553 . 7 1 1 A 44 44 ARG CB C 44 33.579 33.424 0.155 1
1 556 . 7 1 1 A 44 44 ARG N N 44 118.233 124.253 -6.020 1
1 558 . 7 1 1 A 45 45 THR H H 45 8.892 9.008 -0.116 1
1 559 . 7 1 1 A 45 45 THR HA H 45 5.308 5.280 0.028 1
1 564 . 7 1 1 A 45 45 THR C C 45 173.357 173.197 0.160 1
1 565 . 7 1 1 A 45 45 THR CA C 45 60.939 62.146 -1.207 1
1 566 . 7 1 1 A 45 45 THR CB C 45 70.054 70.006 0.048 1
1 568 . 7 1 1 A 45 45 THR N N 45 118.457 122.041 -3.584 1
1 569 . 7 1 1 A 46 46 TYR H H 46 9.625 9.599 0.026 1
1 570 . 7 1 1 A 46 46 TYR HA H 46 4.771 5.102 -0.331 1
1 578 . 7 1 1 A 46 46 TYR C C 46 173.735 175.437 -1.702 1
1 579 . 7 1 1 A 46 46 TYR CA C 46 57.480 55.793 1.687 1
1 580 . 7 1 1 A 46 46 TYR CB C 46 41.724 41.491 0.233 1
1 585 . 7 1 1 A 46 46 TYR N N 46 125.916 126.073 -0.157 1
1 586 . 7 1 1 A 47 47 ASP H H 47 9.006 9.087 -0.081 1
1 587 . 7 1 1 A 47 47 ASP HA H 47 5.399 4.835 0.564 1
1 590 . 7 1 1 A 47 47 ASP C C 47 175.094 175.032 0.062 1
1 591 . 7 1 1 A 47 47 ASP CA C 47 53.460 53.995 -0.535 1
1 592 . 7 1 1 A 47 47 ASP CB C 47 41.947 41.532 0.415 1
1 593 . 7 1 1 A 47 47 ASP N N 47 122.109 122.813 -0.704 1
1 594 . 7 1 1 A 48 48 LEU H H 48 9.066 8.622 0.444 1
1 595 . 7 1 1 A 48 48 LEU HA H 48 4.831 5.073 -0.242 1
1 605 . 7 1 1 A 48 48 LEU C C 48 174.977 175.625 -0.648 1
1 606 . 7 1 1 A 48 48 LEU CA C 48 52.724 53.267 -0.543 1
1 607 . 7 1 1 A 48 48 LEU CB C 48 44.844 43.965 0.879 1
1 611 . 7 1 1 A 48 48 LEU N N 48 121.879 125.659 -3.780 1
1 612 . 7 1 1 A 49 49 LYS H H 49 9.401 8.826 0.575 1
1 613 . 7 1 1 A 49 49 LYS HA H 49 4.477 4.723 -0.246 1
1 622 . 7 1 1 A 49 49 LYS C C 49 176.225 175.559 0.666 1
1 623 . 7 1 1 A 49 49 LYS CA C 49 56.017 55.569 0.448 1
1 624 . 7 1 1 A 49 49 LYS CB C 49 33.838 33.275 0.563 1
1 628 . 7 1 1 A 49 49 LYS N N 49 122.218 124.695 -2.477 1
1 629 . 7 1 1 A 50 50 SER H H 50 8.266 8.754 -0.488 1
1 630 . 7 1 1 A 50 50 SER HA H 50 5.222 4.811 0.411 1
1 633 . 7 1 1 A 50 50 SER C C 50 175.570 174.826 0.744 1
1 634 . 7 1 1 A 50 50 SER CA C 50 55.770 56.669 -0.899 1
1 635 . 7 1 1 A 50 50 SER CB C 50 64.738 64.701 0.037 1
1 636 . 7 1 1 A 50 50 SER N N 50 117.388 120.329 -2.941 1
1 637 . 7 1 1 A 51 51 LYS H H 51 9.276 9.085 0.191 1
1 638 . 7 1 1 A 51 51 LYS HA H 51 4.208 4.394 -0.186 1
1 647 . 7 1 1 A 51 51 LYS C C 51 178.773 178.740 0.033 1
1 648 . 7 1 1 A 51 51 LYS CA C 51 58.674 57.409 1.265 1
1 649 . 7 1 1 A 51 51 LYS CB C 51 33.383 32.718 0.665 1
1 653 . 7 1 1 A 51 51 LYS N N 51 130.550 126.286 4.264 1
1 654 . 7 1 1 A 52 52 GLY H H 52 8.320 8.164 0.156 1
1 655 . 7 1 1 A 52 52 GLY HA2 H 52 3.875 3.857 0.018 1
1 656 . 7 1 1 A 52 52 GLY HA3 H 52 3.628 4.007 -0.379 1
1 657 . 7 1 1 A 52 52 GLY C C 52 175.108 175.429 -0.321 1
1 658 . 7 1 1 A 52 52 GLY CA C 52 46.322 45.246 1.076 1
1 659 . 7 1 1 A 52 52 GLY N N 52 107.053 108.161 -1.108 1
1 660 . 7 1 1 A 53 53 GLN H H 53 7.859 8.281 -0.422 1
1 661 . 7 1 1 A 53 53 GLN HA H 53 4.409 4.403 0.006 1
1 668 . 7 1 1 A 53 53 GLN C C 53 176.469 176.197 0.272 1
1 669 . 7 1 1 A 53 53 GLN CA C 53 54.911 55.517 -0.606 1
1 670 . 7 1 1 A 53 53 GLN CB C 53 29.675 28.810 0.865 1
1 673 . 7 1 1 A 53 53 GLN N N 53 115.482 123.430 -7.948 1
1 675 . 7 1 1 A 54 54 GLY H H 54 7.992 8.238 -0.246 1
1 676 . 7 1 1 A 54 54 GLY HA2 H 54 3.934 3.968 -0.034 1
1 677 . 7 1 1 A 54 54 GLY HA3 H 54 3.934 3.977 -0.043 1
1 678 . 7 1 1 A 54 54 GLY C C 54 173.897 174.020 -0.123 1
1 679 . 7 1 1 A 54 54 GLY CA C 54 46.574 45.619 0.955 1
1 680 . 7 1 1 A 54 54 GLY N N 54 110.111 108.445 1.666 1
1 681 . 7 1 1 A 55 55 ARG H H 55 7.652 7.712 -0.060 1
1 682 . 7 1 1 A 55 55 ARG HA H 55 4.665 4.439 0.226 1
1 690 . 7 1 1 A 55 55 ARG C C 55 174.649 176.155 -1.506 1
1 691 . 7 1 1 A 55 55 ARG CA C 55 54.631 55.971 -1.340 1
1 692 . 7 1 1 A 55 55 ARG CB C 55 32.166 31.506 0.660 1
1 695 . 7 1 1 A 55 55 ARG N N 55 114.214 120.561 -6.347 1
1 697 . 7 1 1 A 56 56 MET H H 56 8.593 8.510 0.083 1
1 698 . 7 1 1 A 56 56 MET HA H 56 5.012 4.506 0.506 1
1 703 . 7 1 1 A 56 56 MET C C 56 176.216 176.034 0.182 1
1 704 . 7 1 1 A 56 56 MET CA C 56 54.595 55.315 -0.720 1
1 705 . 7 1 1 A 56 56 MET CB C 56 33.466 33.007 0.459 1
1 707 . 7 1 1 A 56 56 MET N N 56 121.270 120.531 0.739 1
1 708 . 7 1 1 A 57 57 ILE H H 57 9.393 8.742 0.651 1
1 709 . 7 1 1 A 57 57 ILE HA H 57 4.717 4.363 0.354 1
1 719 . 7 1 1 A 57 57 ILE C C 57 173.883 174.775 -0.892 1
1 720 . 7 1 1 A 57 57 ILE CA C 57 59.713 59.360 0.353 1
1 721 . 7 1 1 A 57 57 ILE CB C 57 40.933 39.323 1.610 1
1 725 . 7 1 1 A 57 57 ILE N N 57 120.811 119.701 1.110 1
1 726 . 7 1 1 A 58 58 GLN H H 58 8.218 8.041 0.177 1
1 727 . 7 1 1 A 58 58 GLN HA H 58 5.407 4.524 0.883 1
1 734 . 7 1 1 A 58 58 GLN C C 58 175.368 174.468 0.900 1
1 735 . 7 1 1 A 58 58 GLN CA C 58 55.163 55.279 -0.116 1
1 736 . 7 1 1 A 58 58 GLN CB C 58 30.841 28.735 2.106 1
1 739 . 7 1 1 A 58 58 GLN N N 58 122.281 126.084 -3.803 1
1 741 . 7 1 1 A 59 59 VAL H H 59 9.188 8.574 0.614 1
1 742 . 7 1 1 A 59 59 VAL HA H 59 5.025 5.000 0.025 1
1 750 . 7 1 1 A 59 59 VAL C C 59 175.330 175.507 -0.177 1
1 751 . 7 1 1 A 59 59 VAL CA C 59 59.975 61.354 -1.379 1
1 752 . 7 1 1 A 59 59 VAL CB C 59 34.818 32.378 2.440 1
1 755 . 7 1 1 A 59 59 VAL N N 59 122.421 126.767 -4.346 1
1 756 . 7 1 1 A 60 60 SER H H 60 9.022 8.834 0.188 1
1 757 . 7 1 1 A 60 60 SER HA H 60 5.811 5.212 0.599 1
1 760 . 7 1 1 A 60 60 SER C C 60 173.234 173.943 -0.709 1
1 761 . 7 1 1 A 60 60 SER CA C 60 57.634 57.942 -0.308 1
1 762 . 7 1 1 A 60 60 SER CB C 60 64.891 64.229 0.662 1
1 763 . 7 1 1 A 60 60 SER N N 60 124.709 124.979 -0.270 1
1 764 . 7 1 1 A 61 61 ILE H H 61 9.226 8.729 0.497 1
1 765 . 7 1 1 A 61 61 ILE HA H 61 5.572 4.944 0.628 1
1 775 . 7 1 1 A 61 61 ILE C C 61 173.955 173.979 -0.024 1
1 776 . 7 1 1 A 61 61 ILE CA C 61 56.937 57.213 -0.276 1
1 777 . 7 1 1 A 61 61 ILE CB C 61 39.596 39.922 -0.326 1
1 781 . 7 1 1 A 61 61 ILE N N 61 121.648 121.389 0.259 1
1 782 . 7 1 1 A 62 62 PRO HA H 62 4.606 4.503 0.103 1
1 789 . 7 1 1 A 62 62 PRO C C 62 178.143 177.607 0.536 1
1 790 . 7 1 1 A 62 62 PRO CA C 62 63.740 62.983 0.757 1
1 791 . 7 1 1 A 62 62 PRO CB C 62 33.303 32.509 0.794 1
1 794 . 7 1 1 A 63 63 ALA H H 63 7.803 8.836 -1.033 1
1 795 . 7 1 1 A 63 63 ALA HA H 63 4.037 4.009 0.028 1
1 799 . 7 1 1 A 63 63 ALA C C 63 175.942 179.027 -3.085 1
1 800 . 7 1 1 A 63 63 ALA CA C 63 54.417 54.283 0.134 1
1 801 . 7 1 1 A 63 63 ALA CB C 63 19.345 18.404 0.941 1
1 802 . 7 1 1 A 63 63 ALA N N 63 123.695 127.719 -4.024 1
1 803 . 7 1 1 A 64 64 SER H H 64 7.719 7.806 -0.087 1
1 804 . 7 1 1 A 64 64 SER HA H 64 4.097 4.356 -0.259 1
1 807 . 7 1 1 A 64 64 SER C C 64 175.199 174.801 0.398 1
1 808 . 7 1 1 A 64 64 SER CA C 64 59.474 60.076 -0.602 1
1 809 . 7 1 1 A 64 64 SER CB C 64 62.125 63.135 -1.010 1
1 810 . 7 1 1 A 64 64 SER N N 64 110.001 111.192 -1.191 1
1 811 . 7 1 1 A 65 65 VAL H H 65 7.790 7.805 -0.015 1
1 812 . 7 1 1 A 65 65 VAL HA H 65 4.360 4.170 0.190 1
1 820 . 7 1 1 A 65 65 VAL C C 65 174.433 174.022 0.411 1
1 821 . 7 1 1 A 65 65 VAL CA C 65 60.335 60.661 -0.326 1
1 822 . 7 1 1 A 65 65 VAL CB C 65 32.714 32.215 0.499 1
1 825 . 7 1 1 A 65 65 VAL N N 65 126.142 125.925 0.217 1
1 826 . 7 1 1 A 66 66 PRO HA H 66 4.369 4.489 -0.120 1
1 833 . 7 1 1 A 66 66 PRO C C 66 177.412 176.614 0.798 1
1 834 . 7 1 1 A 66 66 PRO CA C 66 63.104 62.868 0.236 1
1 835 . 7 1 1 A 66 66 PRO CB C 66 32.558 32.091 0.467 1
1 838 . 7 1 1 A 67 67 LEU H H 67 8.578 8.328 0.250 1
1 839 . 7 1 1 A 67 67 LEU HA H 67 3.875 4.394 -0.519 1
1 849 . 7 1 1 A 67 67 LEU C C 67 176.077 176.408 -0.331 1
1 850 . 7 1 1 A 67 67 LEU CA C 67 56.413 55.517 0.896 1
1 851 . 7 1 1 A 67 67 LEU CB C 67 43.279 43.075 0.204 1
1 855 . 7 1 1 A 67 67 LEU N N 67 124.236 123.443 0.793 1
1 856 . 7 1 1 A 68 68 LYS H H 68 7.994 8.236 -0.242 1
1 857 . 7 1 1 A 68 68 LYS HA H 68 3.793 4.244 -0.451 1
1 866 . 7 1 1 A 68 68 LYS C C 68 175.601 175.279 0.322 1
1 867 . 7 1 1 A 68 68 LYS CA C 68 53.350 54.981 -1.631 1
1 868 . 7 1 1 A 68 68 LYS CB C 68 31.035 33.110 -2.075 1
1 872 . 7 1 1 A 68 68 LYS N N 68 124.053 126.036 -1.983 1
1 873 . 7 1 1 A 69 69 GLU H H 69 8.347 8.339 0.008 1
1 874 . 7 1 1 A 69 69 GLU HA H 69 4.501 4.562 -0.061 1
1 879 . 7 1 1 A 69 69 GLU C C 69 175.304 175.074 0.230 1
1 880 . 7 1 1 A 69 69 GLU CA C 69 54.291 54.979 -0.688 1
1 881 . 7 1 1 A 69 69 GLU CB C 69 29.285 30.046 -0.761 1
1 883 . 7 1 1 A 69 69 GLU N N 69 123.876 123.573 0.303 1
1 884 . 7 1 1 A 70 70 PHE H H 70 5.549 8.287 -2.738 1
1 885 . 7 1 1 A 70 70 PHE HA H 70 4.592 4.745 -0.153 1
1 893 . 7 1 1 A 70 70 PHE C C 70 174.443 174.719 -0.276 1
1 894 . 7 1 1 A 70 70 PHE CA C 70 53.313 57.221 -3.908 1
1 895 . 7 1 1 A 70 70 PHE CB C 70 38.335 41.477 -3.142 1
1 901 . 7 1 1 A 70 70 PHE N N 70 117.781 123.227 -5.446 1
1 902 . 7 1 1 A 71 71 ASP H H 71 8.791 8.669 0.122 1
1 903 . 7 1 1 A 71 71 ASP HA H 71 4.535 4.926 -0.391 1
1 906 . 7 1 1 A 71 71 ASP C C 71 175.867 175.635 0.232 1
1 907 . 7 1 1 A 71 71 ASP CA C 71 54.248 52.673 1.575 1
1 908 . 7 1 1 A 71 71 ASP CB C 71 41.166 42.674 -1.508 1
1 909 . 7 1 1 A 71 71 ASP N N 71 120.385 121.591 -1.206 1
1 910 . 7 1 1 A 72 72 TYR H H 72 8.701 8.687 0.014 1
1 911 . 7 1 1 A 72 72 TYR HA H 72 4.283 4.557 -0.274 1
1 918 . 7 1 1 A 72 72 TYR C C 72 177.470 176.266 1.204 1
1 919 . 7 1 1 A 72 72 TYR CA C 72 60.513 59.623 0.890 1
1 920 . 7 1 1 A 72 72 TYR CB C 72 38.320 38.551 -0.231 1
1 925 . 7 1 1 A 72 72 TYR N N 72 121.876 124.126 -2.250 1
1 926 . 7 1 1 A 73 73 ASN H H 73 8.819 8.943 -0.124 1
1 927 . 7 1 1 A 73 73 ASN HA H 73 4.096 4.082 0.014 1
1 932 . 7 1 1 A 73 73 ASN C C 73 174.362 174.395 -0.033 1
1 933 . 7 1 1 A 73 73 ASN CA C 73 54.289 54.321 -0.032 1
1 934 . 7 1 1 A 73 73 ASN CB C 73 36.907 36.666 0.241 1
1 936 . 7 1 1 A 73 73 ASN N N 73 121.726 119.633 2.093 1
1 938 . 7 1 1 A 74 74 ALA H H 74 8.059 7.492 0.567 1
1 939 . 7 1 1 A 74 74 ALA HA H 74 4.100 4.289 -0.189 1
1 943 . 7 1 1 A 74 74 ALA C C 74 177.757 177.341 0.416 1
1 944 . 7 1 1 A 74 74 ALA CA C 74 53.153 52.617 0.536 1
1 945 . 7 1 1 A 74 74 ALA CB C 74 19.412 19.229 0.183 1
1 946 . 7 1 1 A 74 74 ALA N N 74 122.292 120.937 1.355 1
1 947 . 7 1 1 A 75 75 ARG H H 75 8.500 8.448 0.052 1
1 948 . 7 1 1 A 75 75 ARG HA H 75 4.758 4.744 0.014 1
1 955 . 7 1 1 A 75 75 ARG C C 75 176.812 175.991 0.821 1
1 956 . 7 1 1 A 75 75 ARG CA C 75 56.646 56.356 0.290 1
1 957 . 7 1 1 A 75 75 ARG CB C 75 29.375 30.654 -1.279 1
1 960 . 7 1 1 A 75 75 ARG N N 75 122.871 123.227 -0.356 1
1 961 . 7 1 1 A 76 76 VAL H H 76 7.965 9.047 -1.082 1
1 962 . 7 1 1 A 76 76 VAL HA H 76 5.230 4.883 0.347 1
1 970 . 7 1 1 A 76 76 VAL C C 76 173.758 174.340 -0.582 1
1 971 . 7 1 1 A 76 76 VAL CA C 76 58.193 58.785 -0.592 1
1 972 . 7 1 1 A 76 76 VAL CB C 76 36.536 35.718 0.818 1
1 975 . 7 1 1 A 76 76 VAL N N 76 116.220 118.682 -2.462 1
1 976 . 7 1 1 A 77 77 GLU H H 77 9.166 9.053 0.113 1
1 977 . 7 1 1 A 77 77 GLU HA H 77 4.663 4.989 -0.326 1
1 982 . 7 1 1 A 77 77 GLU C C 77 174.940 174.688 0.252 1
1 983 . 7 1 1 A 77 77 GLU CA C 77 53.546 54.386 -0.840 1
1 984 . 7 1 1 A 77 77 GLU CB C 77 33.395 33.621 -0.226 1
1 986 . 7 1 1 A 77 77 GLU N N 77 116.413 120.952 -4.539 1
1 987 . 7 1 1 A 78 78 LEU H H 78 8.670 8.894 -0.224 1
1 988 . 7 1 1 A 78 78 LEU HA H 78 4.677 4.838 -0.161 1
1 998 . 7 1 1 A 78 78 LEU C C 78 176.036 176.309 -0.273 1
1 999 . 7 1 1 A 78 78 LEU CA C 78 53.091 53.651 -0.560 1
1 1000 . 7 1 1 A 78 78 LEU CB C 78 43.276 43.962 -0.686 1
1 1004 . 7 1 1 A 78 78 LEU N N 78 117.927 123.704 -5.777 1
1 1005 . 7 1 1 A 79 79 ILE H H 79 7.900 8.916 -1.016 1
1 1006 . 7 1 1 A 79 79 ILE HA H 79 4.312 4.484 -0.172 1
1 1016 . 7 1 1 A 79 79 ILE C C 79 175.179 175.806 -0.627 1
1 1017 . 7 1 1 A 79 79 ILE CA C 79 58.294 59.947 -1.653 1
1 1018 . 7 1 1 A 79 79 ILE CB C 79 36.086 37.826 -1.740 1
1 1022 . 7 1 1 A 79 79 ILE N N 79 121.667 124.440 -2.773 1
1 1023 . 7 1 1 A 80 80 ASN H H 80 9.412 8.971 0.441 1
1 1024 . 7 1 1 A 80 80 ASN HA H 80 4.516 4.317 0.199 1
1 1029 . 7 1 1 A 80 80 ASN C C 80 170.300 173.341 -3.041 1
1 1030 . 7 1 1 A 80 80 ASN CA C 80 54.198 53.898 0.300 1
1 1031 . 7 1 1 A 80 80 ASN CB C 80 37.450 37.159 0.291 1
1 1033 . 7 1 1 A 80 80 ASN N N 80 123.831 123.249 0.582 1
1 1035 . 7 1 1 A 81 81 PRO HA H 81 5.185 4.842 0.343 1
1 1042 . 7 1 1 A 81 81 PRO C C 81 176.865 176.430 0.435 1
1 1043 . 7 1 1 A 81 81 PRO CA C 81 62.637 62.489 0.148 1
1 1044 . 7 1 1 A 81 81 PRO CB C 81 32.965 32.614 0.351 1
1 1047 . 7 1 1 A 82 82 ILE H H 82 9.374 8.615 0.759 1
1 1048 . 7 1 1 A 82 82 ILE HA H 82 4.524 4.996 -0.472 1
1 1058 . 7 1 1 A 82 82 ILE C C 82 174.731 174.793 -0.062 1
1 1059 . 7 1 1 A 82 82 ILE CA C 82 60.205 58.652 1.553 1
1 1060 . 7 1 1 A 82 82 ILE CB C 82 41.737 41.673 0.064 1
1 1064 . 7 1 1 A 82 82 ILE N N 82 121.658 117.228 4.430 1
1 1065 . 7 1 1 A 83 83 ALA H H 83 8.819 8.701 0.118 1
1 1066 . 7 1 1 A 83 83 ALA HA H 83 4.773 4.466 0.307 1
1 1070 . 7 1 1 A 83 83 ALA C C 83 176.550 176.589 -0.039 1
1 1071 . 7 1 1 A 83 83 ALA CA C 83 52.069 52.438 -0.369 1
1 1072 . 7 1 1 A 83 83 ALA CB C 83 20.374 19.255 1.119 1
1 1073 . 7 1 1 A 83 83 ALA N N 83 127.933 126.635 1.298 1
1 1074 . 7 1 1 A 84 84 ASP H H 84 8.710 8.837 -0.127 1
1 1075 . 7 1 1 A 84 84 ASP HA H 84 4.894 4.706 0.188 1
1 1078 . 7 1 1 A 84 84 ASP C C 84 175.997 176.938 -0.941 1
1 1079 . 7 1 1 A 84 84 ASP CA C 84 53.334 54.417 -1.083 1
1 1080 . 7 1 1 A 84 84 ASP CB C 84 42.104 41.184 0.920 1
1 1081 . 7 1 1 A 84 84 ASP N N 84 122.009 123.090 -1.081 1
1 1082 . 7 1 1 A 85 85 THR H H 85 8.349 8.926 -0.577 1
1 1083 . 7 1 1 A 85 85 THR HA H 85 4.420 4.211 0.209 1
1 1088 . 7 1 1 A 85 85 THR C C 85 175.085 176.365 -1.280 1
1 1089 . 7 1 1 A 85 85 THR CA C 85 62.304 65.697 -3.393 1
1 1090 . 7 1 1 A 85 85 THR CB C 85 69.718 68.576 1.142 1
1 1092 . 7 1 1 A 85 85 THR N N 85 114.986 121.717 -6.731 1
1 1093 . 7 1 1 A 86 86 VAL H H 86 8.188 8.073 0.115 1
1 1094 . 7 1 1 A 86 86 VAL HA H 86 4.021 3.864 0.157 1
1 1102 . 7 1 1 A 86 86 VAL C C 86 176.519 177.922 -1.403 1
1 1103 . 7 1 1 A 86 86 VAL CA C 86 63.046 65.004 -1.958 1
1 1104 . 7 1 1 A 86 86 VAL CB C 86 32.526 31.746 0.780 1
1 1107 . 7 1 1 A 86 86 VAL N N 86 122.275 117.589 4.686 1
1 1108 . 7 1 1 A 87 87 ALA H H 87 8.194 8.513 -0.319 1
1 1109 . 7 1 1 A 87 87 ALA HA H 87 4.212 4.092 0.120 1
1 1113 . 7 1 1 A 87 87 ALA C C 87 178.118 179.784 -1.666 1
1 1114 . 7 1 1 A 87 87 ALA CA C 87 53.153 55.445 -2.292 1
1 1115 . 7 1 1 A 87 87 ALA CB C 87 19.165 18.824 0.341 1
1 1116 . 7 1 1 A 87 87 ALA N N 87 126.609 124.145 2.464 1
1 1117 . 7 1 1 A 88 88 THR H H 88 7.914 7.907 0.007 1
1 1118 . 7 1 1 A 88 88 THR HA H 88 4.173 4.327 -0.154 1
1 1123 . 7 1 1 A 88 88 THR C C 88 174.516 176.952 -2.436 1
1 1124 . 7 1 1 A 88 88 THR CA C 88 62.785 65.050 -2.265 1
1 1125 . 7 1 1 A 88 88 THR CB C 88 69.582 68.936 0.646 1
1 1127 . 7 1 1 A 88 88 THR N N 88 112.328 112.156 0.172 1
1 1128 . 7 1 1 A 89 89 ALA H H 89 8.076 8.003 0.073 1
1 1129 . 7 1 1 A 89 89 ALA HA H 89 4.320 4.124 0.196 1
1 1133 . 7 1 1 A 89 89 ALA C C 89 178.014 179.505 -1.491 1
1 1134 . 7 1 1 A 89 89 ALA CA C 89 53.079 55.298 -2.219 1
1 1135 . 7 1 1 A 89 89 ALA CB C 89 19.335 18.290 1.045 1
1 1136 . 7 1 1 A 89 89 ALA N N 89 124.632 123.310 1.322 1
1 1137 . 7 1 1 A 90 90 THR H H 90 7.976 7.699 0.277 1
1 1138 . 7 1 1 A 90 90 THR HA H 90 4.203 3.966 0.237 1
1 1143 . 7 1 1 A 90 90 THR C C 90 174.427 173.883 0.544 1
1 1144 . 7 1 1 A 90 90 THR CA C 90 62.519 64.409 -1.890 1
1 1145 . 7 1 1 A 90 90 THR CB C 90 69.721 69.197 0.524 1
1 1147 . 7 1 1 A 90 90 THR N N 90 112.047 112.853 -0.806 1
1 1148 . 7 1 1 A 91 91 TYR H H 91 7.959 8.075 -0.116 1
1 1149 . 7 1 1 A 91 91 TYR HA H 91 4.564 4.844 -0.280 1
1 1156 . 7 1 1 A 91 91 TYR C C 91 175.522 176.091 -0.569 1
1 1157 . 7 1 1 A 91 91 TYR CA C 91 57.874 56.621 1.253 1
1 1158 . 7 1 1 A 91 91 TYR CB C 91 38.584 38.140 0.444 1
1 1163 . 7 1 1 A 91 91 TYR N N 91 121.184 120.158 1.026 1
1 1164 . 7 1 1 A 92 92 GLN H H 92 8.310 8.530 -0.220 1
1 1165 . 7 1 1 A 92 92 GLN HA H 92 4.258 4.331 -0.073 1
1 1172 . 7 1 1 A 92 92 GLN C C 92 176.099 176.247 -0.148 1
1 1173 . 7 1 1 A 92 92 GLN CA C 92 56.109 56.435 -0.326 1
1 1174 . 7 1 1 A 92 92 GLN CB C 92 29.112 28.521 0.591 1
1 1177 . 7 1 1 A 92 92 GLN N N 92 121.631 122.873 -1.242 1
1 1179 . 7 1 1 A 93 93 GLY H H 93 8.052 8.135 -0.083 1
1 1180 . 7 1 1 A 93 93 GLY HA2 H 93 4.023 4.104 -0.081 1
1 1181 . 7 1 1 A 93 93 GLY HA3 H 93 3.856 4.113 -0.257 1
1 1182 . 7 1 1 A 93 93 GLY C C 93 173.791 174.621 -0.830 1
1 1183 . 7 1 1 A 93 93 GLY CA C 93 45.382 44.958 0.424 1
1 1184 . 7 1 1 A 93 93 GLY N N 93 109.847 109.429 0.418 1
1 1185 . 7 1 1 A 94 94 ALA H H 94 8.162 8.878 -0.716 1
1 1186 . 7 1 1 A 94 94 ALA HA H 94 4.329 4.256 0.073 1
1 1190 . 7 1 1 A 94 94 ALA C C 94 177.392 178.539 -1.147 1
1 1191 . 7 1 1 A 94 94 ALA CA C 94 52.558 53.265 -0.707 1
1 1192 . 7 1 1 A 94 94 ALA CB C 94 19.526 19.029 0.497 1
1 1193 . 7 1 1 A 94 94 ALA N N 94 123.424 123.307 0.117 1
1 1194 . 7 1 1 A 95 95 ASP H H 95 8.457 8.125 0.332 1
1 1195 . 7 1 1 A 95 95 ASP HA H 95 4.608 4.385 0.223 1
1 1198 . 7 1 1 A 95 95 ASP C C 95 175.630 176.306 -0.676 1
1 1199 . 7 1 1 A 95 95 ASP CA C 95 54.450 57.166 -2.716 1
1 1200 . 7 1 1 A 95 95 ASP CB C 95 40.871 41.291 -0.420 1
1 1201 . 7 1 1 A 95 95 ASP N N 95 118.814 119.243 -0.429 1
1 1202 . 7 1 1 A 96 96 VAL H H 96 7.776 7.899 -0.123 1
1 1203 . 7 1 1 A 96 96 VAL HA H 96 4.141 4.119 0.022 1
1 1211 . 7 1 1 A 96 96 VAL C C 96 175.301 175.094 0.207 1
1 1212 . 7 1 1 A 96 96 VAL CA C 96 61.435 62.240 -0.805 1
1 1213 . 7 1 1 A 96 96 VAL CB C 96 33.517 32.112 1.405 1
1 1216 . 7 1 1 A 96 96 VAL N N 96 118.395 118.528 -0.133 1
1 1217 . 7 1 1 A 97 97 ASP H H 97 8.315 8.852 -0.537 1
1 1218 . 7 1 1 A 97 97 ASP HA H 97 4.681 4.779 -0.098 1
1 1221 . 7 1 1 A 97 97 ASP C C 97 175.151 175.913 -0.762 1
1 1222 . 7 1 1 A 97 97 ASP CA C 97 54.324 54.075 0.249 1
1 1223 . 7 1 1 A 97 97 ASP CB C 97 41.963 41.535 0.428 1
1 1224 . 7 1 1 A 97 97 ASP N N 97 123.905 128.749 -4.844 1
1 1225 . 7 1 1 A 98 98 TRP H H 98 8.210 8.931 -0.721 1
1 1226 . 7 1 1 A 98 98 TRP HA H 98 4.916 4.986 -0.070 1
1 1235 . 7 1 1 A 98 98 TRP C C 98 174.585 175.733 -1.148 1
1 1236 . 7 1 1 A 98 98 TRP CA C 98 56.164 56.623 -0.459 1
1 1237 . 7 1 1 A 98 98 TRP CB C 98 31.466 30.449 1.017 1
1 1243 . 7 1 1 A 98 98 TRP N N 98 120.340 124.175 -3.835 1
1 1245 . 7 1 1 A 99 99 TYR H H 99 8.760 9.274 -0.514 1
1 1246 . 7 1 1 A 99 99 TYR HA H 99 5.119 5.484 -0.365 1
1 1253 . 7 1 1 A 99 99 TYR C C 99 174.599 174.853 -0.254 1
1 1254 . 7 1 1 A 99 99 TYR CA C 99 57.021 56.649 0.372 1
1 1255 . 7 1 1 A 99 99 TYR CB C 99 39.526 41.473 -1.947 1
1 1260 . 7 1 1 A 99 99 TYR N N 99 123.319 119.800 3.519 1
1 1261 . 7 1 1 A 100 100 ILE H H 100 8.936 9.144 -0.208 1
1 1262 . 7 1 1 A 100 100 ILE HA H 100 4.850 4.759 0.091 1
1 1272 . 7 1 1 A 100 100 ILE C C 100 175.070 174.892 0.178 1
1 1273 . 7 1 1 A 100 100 ILE CA C 100 58.998 60.363 -1.365 1
1 1274 . 7 1 1 A 100 100 ILE CB C 100 40.667 39.836 0.831 1
1 1278 . 7 1 1 A 100 100 ILE N N 100 123.281 121.219 2.062 1
1 1279 . 7 1 1 A 101 101 LYS H H 101 8.987 9.021 -0.034 1
1 1280 . 7 1 1 A 101 101 LYS HA H 101 5.313 5.147 0.166 1
1 1289 . 7 1 1 A 101 101 LYS C C 101 174.440 176.249 -1.809 1
1 1290 . 7 1 1 A 101 101 LYS CA C 101 54.763 55.922 -1.159 1
1 1291 . 7 1 1 A 101 101 LYS CB C 101 34.880 33.304 1.576 1
1 1295 . 7 1 1 A 101 101 LYS N N 101 126.210 127.672 -1.462 1
1 1296 . 7 1 1 A 102 102 ALA H H 102 8.531 8.046 0.485 1
1 1297 . 7 1 1 A 102 102 ALA HA H 102 4.957 4.769 0.188 1
1 1301 . 7 1 1 A 102 102 ALA C C 102 175.024 178.019 -2.995 1
1 1302 . 7 1 1 A 102 102 ALA CA C 102 50.701 50.166 0.535 1
1 1303 . 7 1 1 A 102 102 ALA CB C 102 21.618 22.492 -0.874 1
1 1304 . 7 1 1 A 102 102 ALA N N 102 121.424 126.654 -5.230 1
1 1305 . 7 1 1 A 103 103 ASP H H 103 8.339 8.998 -0.659 1
1 1306 . 7 1 1 A 103 103 ASP HA H 103 4.603 4.483 0.120 1
1 1309 . 7 1 1 A 103 103 ASP C C 103 176.188 175.417 0.771 1
1 1310 . 7 1 1 A 103 103 ASP CA C 103 56.049 56.203 -0.154 1
1 1311 . 7 1 1 A 103 103 ASP CB C 103 40.932 41.531 -0.599 1
1 1312 . 7 1 1 A 103 103 ASP N N 103 117.773 119.925 -2.152 1
1 1313 . 7 1 1 A 104 104 ASP H H 104 7.482 7.332 0.150 1
1 1314 . 7 1 1 A 104 104 ASP HA H 104 4.727 4.956 -0.229 1
1 1317 . 7 1 1 A 104 104 ASP C C 104 174.261 173.718 0.543 1
1 1318 . 7 1 1 A 104 104 ASP CA C 104 52.768 53.672 -0.904 1
1 1319 . 7 1 1 A 104 104 ASP CB C 104 42.587 43.807 -1.220 1
1 1320 . 7 1 1 A 104 104 ASP N N 104 110.673 116.086 -5.413 1
1 1321 . 7 1 1 A 105 105 ILE H H 105 9.267 8.499 0.768 1
1 1322 . 7 1 1 A 105 105 ILE HA H 105 4.631 4.927 -0.296 1
1 1332 . 7 1 1 A 105 105 ILE C C 105 173.922 175.523 -1.601 1
1 1333 . 7 1 1 A 105 105 ILE CA C 105 61.114 60.434 0.680 1
1 1334 . 7 1 1 A 105 105 ILE CB C 105 42.522 40.674 1.848 1
1 1338 . 7 1 1 A 105 105 ILE N N 105 121.380 122.561 -1.181 1
1 1339 . 7 1 1 A 106 106 VAL H H 106 8.592 8.840 -0.248 1
1 1340 . 7 1 1 A 106 106 VAL HA H 106 4.975 5.021 -0.046 1
1 1348 . 7 1 1 A 106 106 VAL C C 106 175.049 175.021 0.028 1
1 1349 . 7 1 1 A 106 106 VAL CA C 106 58.028 59.318 -1.290 1
1 1350 . 7 1 1 A 106 106 VAL CB C 106 35.388 35.500 -0.112 1
1 1353 . 7 1 1 A 106 106 VAL N N 106 116.356 120.915 -4.559 1
1 1354 . 7 1 1 A 107 107 LEU H H 107 8.360 8.479 -0.119 1
1 1355 . 7 1 1 A 107 107 LEU HA H 107 4.167 4.026 0.141 1
1 1365 . 7 1 1 A 107 107 LEU C C 107 178.338 177.527 0.811 1
1 1366 . 7 1 1 A 107 107 LEU CA C 107 55.077 54.413 0.664 1
1 1367 . 7 1 1 A 107 107 LEU CB C 107 42.394 42.048 0.346 1
1 1371 . 7 1 1 A 107 107 LEU N N 107 121.368 122.665 -1.297 1
1 1372 . 7 1 1 A 108 108 THR H H 108 7.977 8.653 -0.676 1
1 1373 . 7 1 1 A 108 108 THR HA H 108 4.039 4.606 -0.567 1
1 1378 . 7 1 1 A 108 108 THR C C 108 174.725 175.346 -0.621 1
1 1379 . 7 1 1 A 108 108 THR CA C 108 63.513 62.820 0.693 1
1 1380 . 7 1 1 A 108 108 THR CB C 108 69.194 69.461 -0.267 1
1 1382 . 7 1 1 A 108 108 THR N N 108 118.728 117.951 0.777 1
1 1383 . 7 1 1 A 109 109 LEU H H 109 8.378 8.558 -0.180 1
1 1384 . 7 1 1 A 109 109 LEU HA H 109 4.274 4.167 0.107 1
1 1394 . 7 1 1 A 109 109 LEU C C 109 177.058 178.047 -0.989 1
1 1395 . 7 1 1 A 109 109 LEU CA C 109 55.045 56.203 -1.158 1
1 1396 . 7 1 1 A 109 109 LEU CB C 109 42.620 41.344 1.276 1
1 1400 . 7 1 1 A 109 109 LEU N N 109 124.847 124.773 0.074 1
1 9 . 8 1 1 A 2 2 MET HA H 2 4.554 4.478 0.076 1
1 14 . 8 1 1 A 2 2 MET C C 2 174.749 175.993 -1.244 1
1 15 . 8 1 1 A 2 2 MET CA C 2 55.354 55.142 0.212 1
1 16 . 8 1 1 A 2 2 MET CB C 2 33.729 33.821 -0.092 1
1 18 . 8 1 1 A 3 3 ARG H H 3 8.518 8.469 0.049 1
1 19 . 8 1 1 A 3 3 ARG HA H 3 4.531 4.596 -0.065 1
1 26 . 8 1 1 A 3 3 ARG C C 3 175.780 174.748 1.032 1
1 27 . 8 1 1 A 3 3 ARG CA C 3 55.854 55.148 0.706 1
1 28 . 8 1 1 A 3 3 ARG CB C 3 31.403 30.618 0.785 1
1 31 . 8 1 1 A 3 3 ARG N N 3 124.008 122.258 1.750 1
1 32 . 8 1 1 A 4 4 LEU H H 4 8.424 8.558 -0.134 1
1 33 . 8 1 1 A 4 4 LEU HA H 4 4.457 4.622 -0.165 1
1 43 . 8 1 1 A 4 4 LEU C C 4 177.362 176.602 0.760 1
1 44 . 8 1 1 A 4 4 LEU CA C 4 54.511 54.722 -0.211 1
1 45 . 8 1 1 A 4 4 LEU CB C 4 42.686 42.400 0.286 1
1 49 . 8 1 1 A 4 4 LEU N N 4 124.389 127.334 -2.945 1
1 50 . 8 1 1 A 5 5 ALA H H 5 8.418 8.446 -0.028 1
1 51 . 8 1 1 A 5 5 ALA HA H 5 4.254 4.600 -0.346 1
1 55 . 8 1 1 A 5 5 ALA C C 5 177.420 176.383 1.037 1
1 56 . 8 1 1 A 5 5 ALA CA C 5 52.931 51.474 1.457 1
1 57 . 8 1 1 A 5 5 ALA CB C 5 19.263 18.745 0.518 1
1 58 . 8 1 1 A 5 5 ALA N N 5 124.548 127.536 -2.988 1
1 59 . 8 1 1 A 6 6 ASN H H 6 8.287 9.019 -0.732 1
1 60 . 8 1 1 A 6 6 ASN HA H 6 4.616 4.966 -0.350 1
1 65 . 8 1 1 A 6 6 ASN C C 6 175.837 175.224 0.613 1
1 66 . 8 1 1 A 6 6 ASN CA C 6 53.345 52.358 0.987 1
1 67 . 8 1 1 A 6 6 ASN CB C 6 38.571 39.865 -1.294 1
1 69 . 8 1 1 A 6 6 ASN N N 6 116.484 123.374 -6.890 1
1 71 . 8 1 1 A 7 7 GLY H H 7 8.351 8.726 -0.375 1
1 72 . 8 1 1 A 7 7 GLY HA2 H 7 4.130 4.197 -0.067 1
1 73 . 8 1 1 A 7 7 GLY HA3 H 7 3.808 4.199 -0.391 1
1 74 . 8 1 1 A 7 7 GLY C C 7 173.750 172.704 1.046 1
1 75 . 8 1 1 A 7 7 GLY CA C 7 45.343 45.892 -0.549 1
1 76 . 8 1 1 A 7 7 GLY N N 7 108.453 112.268 -3.815 1
1 77 . 8 1 1 A 8 8 ILE H H 8 7.868 7.831 0.037 1
1 78 . 8 1 1 A 8 8 ILE HA H 8 4.130 4.236 -0.106 1
1 88 . 8 1 1 A 8 8 ILE C C 8 175.570 175.326 0.244 1
1 89 . 8 1 1 A 8 8 ILE CA C 8 61.095 61.046 0.049 1
1 90 . 8 1 1 A 8 8 ILE CB C 8 38.694 38.627 0.067 1
1 94 . 8 1 1 A 8 8 ILE N N 8 120.848 119.240 1.608 1
1 95 . 8 1 1 A 9 9 VAL H H 9 8.220 8.504 -0.284 1
1 96 . 8 1 1 A 9 9 VAL HA H 9 4.172 4.860 -0.688 1
1 104 . 8 1 1 A 9 9 VAL C C 9 175.898 174.908 0.990 1
1 105 . 8 1 1 A 9 9 VAL CA C 9 62.488 59.547 2.941 1
1 106 . 8 1 1 A 9 9 VAL CB C 9 32.460 35.857 -3.397 1
1 109 . 8 1 1 A 9 9 VAL N N 9 125.805 124.067 1.738 1
1 110 . 8 1 1 A 10 10 LEU H H 10 8.437 8.482 -0.045 1
1 111 . 8 1 1 A 10 10 LEU HA H 10 4.347 4.557 -0.210 1
1 121 . 8 1 1 A 10 10 LEU C C 10 176.398 176.009 0.389 1
1 122 . 8 1 1 A 10 10 LEU CA C 10 54.787 55.451 -0.664 1
1 123 . 8 1 1 A 10 10 LEU CB C 10 42.639 43.180 -0.541 1
1 127 . 8 1 1 A 10 10 LEU N N 10 127.757 124.582 3.175 1
1 128 . 8 1 1 A 11 11 ASP H H 11 8.506 7.829 0.677 1
1 129 . 8 1 1 A 11 11 ASP HA H 11 4.683 4.886 -0.203 1
1 132 . 8 1 1 A 11 11 ASP C C 11 176.672 175.294 1.378 1
1 133 . 8 1 1 A 11 11 ASP CA C 11 53.586 53.803 -0.217 1
1 134 . 8 1 1 A 11 11 ASP CB C 11 41.123 41.938 -0.815 1
1 135 . 8 1 1 A 11 11 ASP N N 11 121.539 120.788 0.751 1
1 136 . 8 1 1 A 12 12 LYS H H 12 8.578 8.824 -0.246 1
1 137 . 8 1 1 A 12 12 LYS HA H 12 3.943 5.024 -1.081 1
1 146 . 8 1 1 A 12 12 LYS C C 12 176.917 174.137 2.780 1
1 147 . 8 1 1 A 12 12 LYS CA C 12 58.542 54.794 3.748 1
1 148 . 8 1 1 A 12 12 LYS CB C 12 32.703 36.152 -3.449 1
1 152 . 8 1 1 A 12 12 LYS N N 12 123.635 122.931 0.704 1
1 153 . 8 1 1 A 13 13 ASP H H 13 8.523 8.729 -0.206 1
1 154 . 8 1 1 A 13 13 ASP HA H 13 4.566 5.020 -0.454 1
1 157 . 8 1 1 A 13 13 ASP C C 13 177.535 176.027 1.508 1
1 158 . 8 1 1 A 13 13 ASP CA C 13 56.034 53.984 2.050 1
1 159 . 8 1 1 A 13 13 ASP CB C 13 41.051 41.636 -0.585 1
1 160 . 8 1 1 A 13 13 ASP N N 13 120.448 124.815 -4.367 1
1 161 . 8 1 1 A 14 14 THR H H 14 7.964 8.796 -0.832 1
1 162 . 8 1 1 A 14 14 THR HA H 14 4.146 4.422 -0.276 1
1 167 . 8 1 1 A 14 14 THR C C 14 175.440 174.914 0.526 1
1 168 . 8 1 1 A 14 14 THR CA C 14 63.245 61.388 1.857 1
1 169 . 8 1 1 A 14 14 THR CB C 14 69.092 68.159 0.933 1
1 171 . 8 1 1 A 14 14 THR N N 14 113.711 117.519 -3.808 1
1 172 . 8 1 1 A 15 15 THR H H 15 7.921 8.300 -0.379 1
1 173 . 8 1 1 A 15 15 THR HA H 15 3.920 4.221 -0.301 1
1 178 . 8 1 1 A 15 15 THR C C 15 174.750 174.825 -0.075 1
1 179 . 8 1 1 A 15 15 THR CA C 15 64.562 64.612 -0.050 1
1 180 . 8 1 1 A 15 15 THR CB C 15 69.166 68.852 0.314 1
1 182 . 8 1 1 A 15 15 THR N N 15 116.710 118.138 -1.428 1
1 183 . 8 1 1 A 16 16 PHE H H 16 8.191 7.981 0.210 1
1 184 . 8 1 1 A 16 16 PHE HA H 16 4.628 4.534 0.094 1
1 192 . 8 1 1 A 16 16 PHE C C 16 177.754 176.271 1.483 1
1 193 . 8 1 1 A 16 16 PHE CA C 16 57.975 57.946 0.029 1
1 194 . 8 1 1 A 16 16 PHE CB C 16 39.553 38.707 0.846 1
1 200 . 8 1 1 A 16 16 PHE N N 16 117.124 119.495 -2.371 1
1 201 . 8 1 1 A 17 17 GLY H H 17 8.110 8.706 -0.596 1
1 202 . 8 1 1 A 17 17 GLY HA2 H 17 4.017 4.066 -0.049 1
1 203 . 8 1 1 A 17 17 GLY HA3 H 17 3.849 4.070 -0.221 1
1 204 . 8 1 1 A 17 17 GLY C C 17 172.231 173.378 -1.147 1
1 205 . 8 1 1 A 17 17 GLY CA C 17 45.633 44.703 0.930 1
1 206 . 8 1 1 A 17 17 GLY N N 17 109.951 111.365 -1.414 1
1 207 . 8 1 1 A 18 18 GLU H H 18 8.304 8.551 -0.247 1
1 208 . 8 1 1 A 18 18 GLU HA H 18 4.078 4.149 -0.071 1
1 213 . 8 1 1 A 18 18 GLU C C 18 175.588 176.674 -1.086 1
1 214 . 8 1 1 A 18 18 GLU CA C 18 57.446 57.316 0.130 1
1 215 . 8 1 1 A 18 18 GLU CB C 18 30.767 29.827 0.940 1
1 217 . 8 1 1 A 18 18 GLU N N 18 121.640 119.144 2.496 1
1 218 . 8 1 1 A 19 19 LEU H H 19 8.799 8.768 0.031 1
1 219 . 8 1 1 A 19 19 LEU HA H 19 5.416 4.510 0.906 1
1 229 . 8 1 1 A 19 19 LEU C C 19 176.875 176.497 0.378 1
1 230 . 8 1 1 A 19 19 LEU CA C 19 53.281 54.805 -1.524 1
1 231 . 8 1 1 A 19 19 LEU CB C 19 45.508 42.504 3.004 1
1 235 . 8 1 1 A 19 19 LEU N N 19 127.101 127.135 -0.034 1
1 236 . 8 1 1 A 20 20 LYS H H 20 8.494 8.857 -0.363 1
1 237 . 8 1 1 A 20 20 LYS HA H 20 5.200 5.289 -0.089 1
1 246 . 8 1 1 A 20 20 LYS C C 20 176.163 175.417 0.746 1
1 247 . 8 1 1 A 20 20 LYS CA C 20 53.575 54.546 -0.971 1
1 248 . 8 1 1 A 20 20 LYS CB C 20 36.835 36.499 0.336 1
1 252 . 8 1 1 A 20 20 LYS N N 20 118.828 123.316 -4.488 1
1 253 . 8 1 1 A 21 21 PHE H H 21 9.658 8.948 0.710 1
1 254 . 8 1 1 A 21 21 PHE HA H 21 4.038 4.685 -0.647 1
1 262 . 8 1 1 A 21 21 PHE C C 21 174.296 174.948 -0.652 1
1 263 . 8 1 1 A 21 21 PHE CA C 21 60.462 59.520 0.942 1
1 264 . 8 1 1 A 21 21 PHE CB C 21 40.359 39.882 0.477 1
1 270 . 8 1 1 A 21 21 PHE N N 21 124.322 125.938 -1.616 1
1 271 . 8 1 1 A 22 22 SER H H 22 7.199 8.613 -1.414 1
1 272 . 8 1 1 A 22 22 SER HA H 22 5.046 4.859 0.187 1
1 275 . 8 1 1 A 22 22 SER C C 22 173.080 174.184 -1.104 1
1 276 . 8 1 1 A 22 22 SER CA C 22 58.547 59.779 -1.232 1
1 277 . 8 1 1 A 22 22 SER CB C 22 63.591 64.481 -0.890 1
1 278 . 8 1 1 A 22 22 SER N N 22 120.109 120.531 -0.422 1
1 279 . 8 1 1 A 23 23 ALA H H 23 7.269 6.622 0.647 1
1 280 . 8 1 1 A 23 23 ALA HA H 23 4.426 4.319 0.107 1
1 284 . 8 1 1 A 23 23 ALA C C 23 176.568 174.234 2.334 1
1 285 . 8 1 1 A 23 23 ALA CA C 23 52.458 51.097 1.361 1
1 286 . 8 1 1 A 23 23 ALA CB C 23 22.728 21.707 1.021 1
1 287 . 8 1 1 A 23 23 ALA N N 23 114.102 117.903 -3.801 1
1 288 . 8 1 1 A 24 24 LEU H H 24 8.819 8.511 0.308 1
1 289 . 8 1 1 A 24 24 LEU HA H 24 4.060 4.871 -0.811 1
1 299 . 8 1 1 A 24 24 LEU C C 24 175.363 176.411 -1.048 1
1 300 . 8 1 1 A 24 24 LEU CA C 24 56.901 53.701 3.200 1
1 301 . 8 1 1 A 24 24 LEU CB C 24 42.065 43.558 -1.493 1
1 305 . 8 1 1 A 24 24 LEU N N 24 120.865 120.008 0.857 1
1 306 . 8 1 1 A 25 25 ARG H H 25 9.473 8.969 0.504 1
1 307 . 8 1 1 A 25 25 ARG HA H 25 4.428 4.228 0.200 1
1 315 . 8 1 1 A 25 25 ARG C C 25 175.729 175.417 0.312 1
1 316 . 8 1 1 A 25 25 ARG CA C 25 56.721 57.935 -1.214 1
1 317 . 8 1 1 A 25 25 ARG CB C 25 31.109 31.064 0.045 1
1 320 . 8 1 1 A 25 25 ARG N N 25 130.455 127.785 2.670 1
1 322 . 8 1 1 A 26 26 ARG H H 26 7.711 7.258 0.453 1
1 323 . 8 1 1 A 26 26 ARG HA H 26 4.559 4.670 -0.111 1
1 330 . 8 1 1 A 26 26 ARG C C 26 173.724 173.578 0.146 1
1 331 . 8 1 1 A 26 26 ARG CA C 26 55.737 55.670 0.067 1
1 332 . 8 1 1 A 26 26 ARG CB C 26 33.261 33.892 -0.631 1
1 335 . 8 1 1 A 26 26 ARG N N 26 113.305 118.407 -5.102 1
1 336 . 8 1 1 A 27 27 GLU H H 27 8.848 8.596 0.252 1
1 337 . 8 1 1 A 27 27 GLU HA H 27 4.615 4.789 -0.174 1
1 342 . 8 1 1 A 27 27 GLU C C 27 174.836 175.676 -0.840 1
1 343 . 8 1 1 A 27 27 GLU CA C 27 55.901 55.269 0.632 1
1 344 . 8 1 1 A 27 27 GLU CB C 27 30.755 30.415 0.340 1
1 346 . 8 1 1 A 27 27 GLU N N 27 121.934 124.907 -2.973 1
1 347 . 8 1 1 A 28 28 VAL H H 28 8.603 8.150 0.453 1
1 348 . 8 1 1 A 28 28 VAL HA H 28 4.013 4.298 -0.285 1
1 356 . 8 1 1 A 28 28 VAL C C 28 175.561 175.777 -0.216 1
1 357 . 8 1 1 A 28 28 VAL CA C 28 62.791 61.781 1.010 1
1 358 . 8 1 1 A 28 28 VAL CB C 28 32.710 32.076 0.634 1
1 361 . 8 1 1 A 28 28 VAL N N 28 125.545 122.583 2.962 1
1 362 . 8 1 1 A 29 29 ARG H H 29 8.735 8.535 0.200 1
1 363 . 8 1 1 A 29 29 ARG HA H 29 4.774 4.582 0.192 1
1 370 . 8 1 1 A 29 29 ARG C C 29 176.580 176.407 0.173 1
1 371 . 8 1 1 A 29 29 ARG CA C 29 55.481 54.705 0.776 1
1 372 . 8 1 1 A 29 29 ARG CB C 29 31.963 31.383 0.580 1
1 375 . 8 1 1 A 29 29 ARG N N 29 128.327 126.747 1.580 1
1 376 . 8 1 1 A 30 30 ILE H H 30 8.358 8.408 -0.050 1
1 377 . 8 1 1 A 30 30 ILE HA H 30 3.882 4.215 -0.333 1
1 387 . 8 1 1 A 30 30 ILE C C 30 175.093 175.316 -0.223 1
1 388 . 8 1 1 A 30 30 ILE CA C 30 61.669 60.434 1.235 1
1 389 . 8 1 1 A 30 30 ILE CB C 30 38.806 37.709 1.097 1
1 393 . 8 1 1 A 30 30 ILE N N 30 121.957 121.350 0.607 1
1 394 . 8 1 1 A 31 31 GLN H H 31 8.560 8.748 -0.188 1
1 395 . 8 1 1 A 31 31 GLN HA H 31 4.647 5.116 -0.469 1
1 402 . 8 1 1 A 31 31 GLN C C 31 175.954 175.325 0.629 1
1 403 . 8 1 1 A 31 31 GLN CA C 31 54.833 53.971 0.862 1
1 404 . 8 1 1 A 31 31 GLN CB C 31 30.584 32.170 -1.586 1
1 407 . 8 1 1 A 31 31 GLN N N 31 126.348 126.146 0.202 1
1 409 . 8 1 1 A 32 32 ASN H H 32 8.994 9.225 -0.231 1
1 410 . 8 1 1 A 32 32 ASN HA H 32 4.784 4.886 -0.102 1
1 415 . 8 1 1 A 32 32 ASN C C 32 177.296 177.228 0.068 1
1 416 . 8 1 1 A 32 32 ASN CA C 32 53.206 53.028 0.178 1
1 417 . 8 1 1 A 32 32 ASN CB C 32 39.472 39.437 0.035 1
1 419 . 8 1 1 A 32 32 ASN N N 32 122.834 124.666 -1.832 1
1 421 . 8 1 1 A 33 33 GLU H H 33 9.180 8.871 0.309 1
1 422 . 8 1 1 A 33 33 GLU HA H 33 4.063 3.956 0.107 1
1 427 . 8 1 1 A 33 33 GLU C C 33 176.787 178.650 -1.863 1
1 428 . 8 1 1 A 33 33 GLU CA C 33 59.347 59.459 -0.112 1
1 429 . 8 1 1 A 33 33 GLU CB C 33 29.294 29.282 0.012 1
1 431 . 8 1 1 A 33 33 GLU N N 33 122.736 122.026 0.710 1
1 432 . 8 1 1 A 34 34 ASP H H 34 7.969 7.967 0.002 1
1 433 . 8 1 1 A 34 34 ASP HA H 34 4.499 4.526 -0.027 1
1 436 . 8 1 1 A 34 34 ASP C C 34 177.111 176.177 0.934 1
1 437 . 8 1 1 A 34 34 ASP CA C 34 53.632 54.828 -1.196 1
1 438 . 8 1 1 A 34 34 ASP CB C 34 39.807 41.107 -1.300 1
1 439 . 8 1 1 A 34 34 ASP N N 34 115.921 117.369 -1.448 1
1 440 . 8 1 1 A 35 35 GLY H H 35 8.083 7.759 0.324 1
1 441 . 8 1 1 A 35 35 GLY HA2 H 35 4.366 4.012 0.354 1
1 442 . 8 1 1 A 35 35 GLY HA3 H 35 3.657 4.012 -0.355 1
1 443 . 8 1 1 A 35 35 GLY C C 35 174.584 174.690 -0.106 1
1 444 . 8 1 1 A 35 35 GLY CA C 35 45.134 45.147 -0.013 1
1 445 . 8 1 1 A 35 35 GLY N N 35 108.874 108.115 0.759 1
1 446 . 8 1 1 A 36 36 SER H H 36 8.274 8.047 0.227 1
1 447 . 8 1 1 A 36 36 SER HA H 36 4.389 4.461 -0.072 1
1 450 . 8 1 1 A 36 36 SER C C 36 173.284 173.688 -0.404 1
1 451 . 8 1 1 A 36 36 SER CA C 36 58.383 59.106 -0.723 1
1 452 . 8 1 1 A 36 36 SER CB C 36 64.576 64.705 -0.129 1
1 453 . 8 1 1 A 36 36 SER N N 36 117.428 117.502 -0.074 1
1 454 . 8 1 1 A 37 37 VAL H H 37 8.508 8.475 0.033 1
1 455 . 8 1 1 A 37 37 VAL HA H 37 4.346 4.414 -0.068 1
1 463 . 8 1 1 A 37 37 VAL C C 37 176.370 175.391 0.979 1
1 464 . 8 1 1 A 37 37 VAL CA C 37 62.410 61.687 0.723 1
1 465 . 8 1 1 A 37 37 VAL CB C 37 33.086 32.626 0.460 1
1 468 . 8 1 1 A 37 37 VAL N N 37 119.189 122.702 -3.513 1
1 469 . 8 1 1 A 38 38 SER H H 38 8.461 8.928 -0.467 1
1 470 . 8 1 1 A 38 38 SER HA H 38 4.586 4.790 -0.204 1
1 473 . 8 1 1 A 38 38 SER C C 38 173.829 174.780 -0.951 1
1 474 . 8 1 1 A 38 38 SER CA C 38 57.618 56.450 1.168 1
1 475 . 8 1 1 A 38 38 SER CB C 38 64.537 64.980 -0.443 1
1 476 . 8 1 1 A 38 38 SER N N 38 121.629 120.456 1.173 1
1 477 . 8 1 1 A 39 39 ASP H H 39 8.512 8.948 -0.436 1
1 478 . 8 1 1 A 39 39 ASP HA H 39 4.606 4.448 0.158 1
1 481 . 8 1 1 A 39 39 ASP C C 39 176.557 176.618 -0.061 1
1 482 . 8 1 1 A 39 39 ASP CA C 39 54.833 57.182 -2.349 1
1 483 . 8 1 1 A 39 39 ASP CB C 39 41.123 40.643 0.480 1
1 484 . 8 1 1 A 39 39 ASP N N 39 120.305 125.732 -5.427 1
1 485 . 8 1 1 A 40 40 GLU H H 40 8.311 7.561 0.750 1
1 486 . 8 1 1 A 40 40 GLU HA H 40 4.235 4.437 -0.202 1
1 491 . 8 1 1 A 40 40 GLU C C 40 175.327 176.130 -0.803 1
1 492 . 8 1 1 A 40 40 GLU CA C 40 56.215 56.996 -0.781 1
1 493 . 8 1 1 A 40 40 GLU CB C 40 30.788 30.369 0.419 1
1 495 . 8 1 1 A 40 40 GLU N N 40 120.680 118.461 2.219 1
1 496 . 8 1 1 A 41 41 ILE H H 41 8.465 8.652 -0.187 1
1 497 . 8 1 1 A 41 41 ILE HA H 41 4.127 4.744 -0.617 1
1 507 . 8 1 1 A 41 41 ILE C C 41 175.380 175.769 -0.389 1
1 508 . 8 1 1 A 41 41 ILE CA C 41 60.670 59.661 1.009 1
1 509 . 8 1 1 A 41 41 ILE CB C 41 38.805 40.451 -1.646 1
1 513 . 8 1 1 A 41 41 ILE N N 41 123.665 123.097 0.568 1
1 514 . 8 1 1 A 42 42 LYS H H 42 9.556 9.020 0.536 1
1 515 . 8 1 1 A 42 42 LYS HA H 42 4.428 4.308 0.120 1
1 524 . 8 1 1 A 42 42 LYS C C 42 177.277 176.841 0.436 1
1 525 . 8 1 1 A 42 42 LYS CA C 42 57.274 58.050 -0.776 1
1 526 . 8 1 1 A 42 42 LYS CB C 42 35.169 33.055 2.114 1
1 530 . 8 1 1 A 42 42 LYS N N 42 125.597 125.850 -0.253 1
1 531 . 8 1 1 A 43 43 GLU H H 43 7.809 7.461 0.348 1
1 532 . 8 1 1 A 43 43 GLU HA H 43 4.886 4.865 0.021 1
1 537 . 8 1 1 A 43 43 GLU C C 43 173.593 174.180 -0.587 1
1 538 . 8 1 1 A 43 43 GLU CA C 43 54.669 54.862 -0.193 1
1 539 . 8 1 1 A 43 43 GLU CB C 43 32.882 34.574 -1.692 1
1 541 . 8 1 1 A 43 43 GLU N N 43 115.292 116.769 -1.477 1
1 542 . 8 1 1 A 44 44 ARG H H 44 8.879 8.982 -0.103 1
1 543 . 8 1 1 A 44 44 ARG HA H 44 4.917 5.083 -0.166 1
1 551 . 8 1 1 A 44 44 ARG C C 44 173.708 174.504 -0.796 1
1 552 . 8 1 1 A 44 44 ARG CA C 44 55.965 54.846 1.119 1
1 553 . 8 1 1 A 44 44 ARG CB C 44 33.579 33.380 0.199 1
1 556 . 8 1 1 A 44 44 ARG N N 44 118.233 123.189 -4.956 1
1 558 . 8 1 1 A 45 45 THR H H 45 8.892 9.084 -0.192 1
1 559 . 8 1 1 A 45 45 THR HA H 45 5.308 5.204 0.104 1
1 564 . 8 1 1 A 45 45 THR C C 45 173.357 173.432 -0.075 1
1 565 . 8 1 1 A 45 45 THR CA C 45 60.939 62.189 -1.250 1
1 566 . 8 1 1 A 45 45 THR CB C 45 70.054 69.648 0.406 1
1 568 . 8 1 1 A 45 45 THR N N 45 118.457 122.722 -4.265 1
1 569 . 8 1 1 A 46 46 TYR H H 46 9.625 9.705 -0.080 1
1 570 . 8 1 1 A 46 46 TYR HA H 46 4.771 5.108 -0.337 1
1 578 . 8 1 1 A 46 46 TYR C C 46 173.735 174.817 -1.082 1
1 579 . 8 1 1 A 46 46 TYR CA C 46 57.480 56.937 0.543 1
1 580 . 8 1 1 A 46 46 TYR CB C 46 41.724 42.150 -0.426 1
1 585 . 8 1 1 A 46 46 TYR N N 46 125.916 126.623 -0.707 1
1 586 . 8 1 1 A 47 47 ASP H H 47 9.006 8.985 0.021 1
1 587 . 8 1 1 A 47 47 ASP HA H 47 5.399 5.258 0.141 1
1 590 . 8 1 1 A 47 47 ASP C C 47 175.094 175.170 -0.076 1
1 591 . 8 1 1 A 47 47 ASP CA C 47 53.460 53.529 -0.069 1
1 592 . 8 1 1 A 47 47 ASP CB C 47 41.947 42.621 -0.674 1
1 593 . 8 1 1 A 47 47 ASP N N 47 122.109 121.524 0.585 1
1 594 . 8 1 1 A 48 48 LEU H H 48 9.066 8.764 0.302 1
1 595 . 8 1 1 A 48 48 LEU HA H 48 4.831 5.125 -0.294 1
1 605 . 8 1 1 A 48 48 LEU C C 48 174.977 175.634 -0.657 1
1 606 . 8 1 1 A 48 48 LEU CA C 48 52.724 53.459 -0.735 1
1 607 . 8 1 1 A 48 48 LEU CB C 48 44.844 43.765 1.079 1
1 611 . 8 1 1 A 48 48 LEU N N 48 121.879 125.534 -3.655 1
1 612 . 8 1 1 A 49 49 LYS H H 49 9.401 8.982 0.419 1
1 613 . 8 1 1 A 49 49 LYS HA H 49 4.477 5.069 -0.592 1
1 622 . 8 1 1 A 49 49 LYS C C 49 176.225 175.351 0.874 1
1 623 . 8 1 1 A 49 49 LYS CA C 49 56.017 55.529 0.488 1
1 624 . 8 1 1 A 49 49 LYS CB C 49 33.838 33.621 0.217 1
1 628 . 8 1 1 A 49 49 LYS N N 49 122.218 124.156 -1.938 1
1 629 . 8 1 1 A 50 50 SER H H 50 8.266 8.838 -0.572 1
1 630 . 8 1 1 A 50 50 SER HA H 50 5.222 5.041 0.181 1
1 633 . 8 1 1 A 50 50 SER C C 50 175.570 173.963 1.607 1
1 634 . 8 1 1 A 50 50 SER CA C 50 55.770 57.525 -1.755 1
1 635 . 8 1 1 A 50 50 SER CB C 50 64.738 64.223 0.515 1
1 636 . 8 1 1 A 50 50 SER N N 50 117.388 120.583 -3.195 1
1 637 . 8 1 1 A 51 51 LYS H H 51 9.276 8.656 0.620 1
1 638 . 8 1 1 A 51 51 LYS HA H 51 4.208 4.220 -0.012 1
1 647 . 8 1 1 A 51 51 LYS C C 51 178.773 177.172 1.601 1
1 648 . 8 1 1 A 51 51 LYS CA C 51 58.674 58.014 0.660 1
1 649 . 8 1 1 A 51 51 LYS CB C 51 33.383 32.859 0.524 1
1 653 . 8 1 1 A 51 51 LYS N N 51 130.550 125.514 5.036 1
1 654 . 8 1 1 A 52 52 GLY H H 52 8.320 8.387 -0.067 1
1 655 . 8 1 1 A 52 52 GLY HA2 H 52 3.875 4.012 -0.137 1
1 656 . 8 1 1 A 52 52 GLY HA3 H 52 3.628 4.016 -0.388 1
1 657 . 8 1 1 A 52 52 GLY C C 52 175.108 174.925 0.183 1
1 658 . 8 1 1 A 52 52 GLY CA C 52 46.322 45.792 0.530 1
1 659 . 8 1 1 A 52 52 GLY N N 52 107.053 114.047 -6.994 1
1 660 . 8 1 1 A 53 53 GLN H H 53 7.859 8.378 -0.519 1
1 661 . 8 1 1 A 53 53 GLN HA H 53 4.409 4.400 0.009 1
1 668 . 8 1 1 A 53 53 GLN C C 53 176.469 176.621 -0.152 1
1 669 . 8 1 1 A 53 53 GLN CA C 53 54.911 55.379 -0.468 1
1 670 . 8 1 1 A 53 53 GLN CB C 53 29.675 29.596 0.079 1
1 673 . 8 1 1 A 53 53 GLN N N 53 115.482 123.492 -8.010 1
1 675 . 8 1 1 A 54 54 GLY H H 54 7.992 8.149 -0.157 1
1 676 . 8 1 1 A 54 54 GLY HA2 H 54 3.934 3.914 0.020 1
1 677 . 8 1 1 A 54 54 GLY HA3 H 54 3.934 3.914 0.020 1
1 678 . 8 1 1 A 54 54 GLY C C 54 173.897 174.060 -0.163 1
1 679 . 8 1 1 A 54 54 GLY CA C 54 46.574 45.754 0.820 1
1 680 . 8 1 1 A 54 54 GLY N N 54 110.111 109.284 0.827 1
1 681 . 8 1 1 A 55 55 ARG H H 55 7.652 7.688 -0.036 1
1 682 . 8 1 1 A 55 55 ARG HA H 55 4.665 4.409 0.256 1
1 690 . 8 1 1 A 55 55 ARG C C 55 174.649 175.488 -0.839 1
1 691 . 8 1 1 A 55 55 ARG CA C 55 54.631 55.761 -1.130 1
1 692 . 8 1 1 A 55 55 ARG CB C 55 32.166 31.622 0.544 1
1 695 . 8 1 1 A 55 55 ARG N N 55 114.214 120.422 -6.208 1
1 697 . 8 1 1 A 56 56 MET H H 56 8.593 8.682 -0.089 1
1 698 . 8 1 1 A 56 56 MET HA H 56 5.012 5.598 -0.586 1
1 703 . 8 1 1 A 56 56 MET C C 56 176.216 176.031 0.185 1
1 704 . 8 1 1 A 56 56 MET CA C 56 54.595 53.271 1.324 1
1 705 . 8 1 1 A 56 56 MET CB C 56 33.466 35.060 -1.594 1
1 707 . 8 1 1 A 56 56 MET N N 56 121.270 117.974 3.296 1
1 708 . 8 1 1 A 57 57 ILE H H 57 9.393 9.059 0.334 1
1 709 . 8 1 1 A 57 57 ILE HA H 57 4.717 4.769 -0.052 1
1 719 . 8 1 1 A 57 57 ILE C C 57 173.883 174.693 -0.810 1
1 720 . 8 1 1 A 57 57 ILE CA C 57 59.713 59.207 0.506 1
1 721 . 8 1 1 A 57 57 ILE CB C 57 40.933 39.818 1.115 1
1 725 . 8 1 1 A 57 57 ILE N N 57 120.811 117.638 3.173 1
1 726 . 8 1 1 A 58 58 GLN H H 58 8.218 7.935 0.283 1
1 727 . 8 1 1 A 58 58 GLN HA H 58 5.407 4.525 0.882 1
1 734 . 8 1 1 A 58 58 GLN C C 58 175.368 174.455 0.913 1
1 735 . 8 1 1 A 58 58 GLN CA C 58 55.163 55.361 -0.198 1
1 736 . 8 1 1 A 58 58 GLN CB C 58 30.841 28.798 2.043 1
1 739 . 8 1 1 A 58 58 GLN N N 58 122.281 121.854 0.427 1
1 741 . 8 1 1 A 59 59 VAL H H 59 9.188 8.600 0.588 1
1 742 . 8 1 1 A 59 59 VAL HA H 59 5.025 5.145 -0.120 1
1 750 . 8 1 1 A 59 59 VAL C C 59 175.330 174.998 0.332 1
1 751 . 8 1 1 A 59 59 VAL CA C 59 59.975 61.010 -1.035 1
1 752 . 8 1 1 A 59 59 VAL CB C 59 34.818 33.134 1.684 1
1 755 . 8 1 1 A 59 59 VAL N N 59 122.421 126.475 -4.054 1
1 756 . 8 1 1 A 60 60 SER H H 60 9.022 9.214 -0.192 1
1 757 . 8 1 1 A 60 60 SER HA H 60 5.811 5.195 0.616 1
1 760 . 8 1 1 A 60 60 SER C C 60 173.234 174.114 -0.880 1
1 761 . 8 1 1 A 60 60 SER CA C 60 57.634 58.039 -0.405 1
1 762 . 8 1 1 A 60 60 SER CB C 60 64.891 64.558 0.333 1
1 763 . 8 1 1 A 60 60 SER N N 60 124.709 124.724 -0.015 1
1 764 . 8 1 1 A 61 61 ILE H H 61 9.226 8.784 0.442 1
1 765 . 8 1 1 A 61 61 ILE HA H 61 5.572 5.026 0.546 1
1 775 . 8 1 1 A 61 61 ILE C C 61 173.955 173.804 0.151 1
1 776 . 8 1 1 A 61 61 ILE CA C 61 56.937 57.188 -0.251 1
1 777 . 8 1 1 A 61 61 ILE CB C 61 39.596 40.231 -0.635 1
1 781 . 8 1 1 A 61 61 ILE N N 61 121.648 121.502 0.146 1
1 782 . 8 1 1 A 62 62 PRO HA H 62 4.606 4.546 0.060 1
1 789 . 8 1 1 A 62 62 PRO C C 62 178.143 177.432 0.711 1
1 790 . 8 1 1 A 62 62 PRO CA C 62 63.740 62.985 0.755 1
1 791 . 8 1 1 A 62 62 PRO CB C 62 33.303 32.758 0.545 1
1 794 . 8 1 1 A 63 63 ALA H H 63 7.803 8.724 -0.921 1
1 795 . 8 1 1 A 63 63 ALA HA H 63 4.037 4.044 -0.007 1
1 799 . 8 1 1 A 63 63 ALA C C 63 175.942 179.515 -3.573 1
1 800 . 8 1 1 A 63 63 ALA CA C 63 54.417 54.778 -0.361 1
1 801 . 8 1 1 A 63 63 ALA CB C 63 19.345 18.155 1.190 1
1 802 . 8 1 1 A 63 63 ALA N N 63 123.695 127.481 -3.786 1
1 803 . 8 1 1 A 64 64 SER H H 64 7.719 8.049 -0.330 1
1 804 . 8 1 1 A 64 64 SER HA H 64 4.097 4.191 -0.094 1
1 807 . 8 1 1 A 64 64 SER C C 64 175.199 174.662 0.537 1
1 808 . 8 1 1 A 64 64 SER CA C 64 59.474 61.287 -1.813 1
1 809 . 8 1 1 A 64 64 SER CB C 64 62.125 63.172 -1.047 1
1 810 . 8 1 1 A 64 64 SER N N 64 110.001 112.765 -2.764 1
1 811 . 8 1 1 A 65 65 VAL H H 65 7.790 7.807 -0.017 1
1 812 . 8 1 1 A 65 65 VAL HA H 65 4.360 4.137 0.223 1
1 820 . 8 1 1 A 65 65 VAL C C 65 174.433 174.246 0.187 1
1 821 . 8 1 1 A 65 65 VAL CA C 65 60.335 60.917 -0.582 1
1 822 . 8 1 1 A 65 65 VAL CB C 65 32.714 32.251 0.463 1
1 825 . 8 1 1 A 65 65 VAL N N 65 126.142 122.193 3.949 1
1 826 . 8 1 1 A 66 66 PRO HA H 66 4.369 4.565 -0.196 1
1 833 . 8 1 1 A 66 66 PRO C C 66 177.412 176.473 0.939 1
1 834 . 8 1 1 A 66 66 PRO CA C 66 63.104 62.737 0.367 1
1 835 . 8 1 1 A 66 66 PRO CB C 66 32.558 32.043 0.515 1
1 838 . 8 1 1 A 67 67 LEU H H 67 8.578 8.450 0.128 1
1 839 . 8 1 1 A 67 67 LEU HA H 67 3.875 4.508 -0.633 1
1 849 . 8 1 1 A 67 67 LEU C C 67 176.077 176.360 -0.283 1
1 850 . 8 1 1 A 67 67 LEU CA C 67 56.413 55.727 0.686 1
1 851 . 8 1 1 A 67 67 LEU CB C 67 43.279 42.683 0.596 1
1 855 . 8 1 1 A 67 67 LEU N N 67 124.236 123.330 0.906 1
1 856 . 8 1 1 A 68 68 LYS H H 68 7.994 8.645 -0.651 1
1 857 . 8 1 1 A 68 68 LYS HA H 68 3.793 3.618 0.175 1
1 866 . 8 1 1 A 68 68 LYS C C 68 175.601 176.113 -0.512 1
1 867 . 8 1 1 A 68 68 LYS CA C 68 53.350 58.572 -5.222 1
1 868 . 8 1 1 A 68 68 LYS CB C 68 31.035 31.667 -0.632 1
1 872 . 8 1 1 A 68 68 LYS N N 68 124.053 127.047 -2.994 1
1 873 . 8 1 1 A 69 69 GLU H H 69 8.347 7.880 0.467 1
1 874 . 8 1 1 A 69 69 GLU HA H 69 4.501 3.676 0.825 1
1 879 . 8 1 1 A 69 69 GLU C C 69 175.304 175.443 -0.139 1
1 880 . 8 1 1 A 69 69 GLU CA C 69 54.291 57.319 -3.028 1
1 881 . 8 1 1 A 69 69 GLU CB C 69 29.285 27.176 2.109 1
1 883 . 8 1 1 A 69 69 GLU N N 69 123.876 116.208 7.668 1
1 884 . 8 1 1 A 70 70 PHE H H 70 5.549 6.661 -1.112 1
1 885 . 8 1 1 A 70 70 PHE HA H 70 4.592 4.224 0.368 1
1 893 . 8 1 1 A 70 70 PHE C C 70 174.443 175.198 -0.755 1
1 894 . 8 1 1 A 70 70 PHE CA C 70 53.313 57.523 -4.210 1
1 895 . 8 1 1 A 70 70 PHE CB C 70 38.335 39.007 -0.672 1
1 901 . 8 1 1 A 70 70 PHE N N 70 117.781 116.593 1.188 1
1 902 . 8 1 1 A 71 71 ASP H H 71 8.791 8.800 -0.009 1
1 903 . 8 1 1 A 71 71 ASP HA H 71 4.535 4.690 -0.155 1
1 906 . 8 1 1 A 71 71 ASP C C 71 175.867 176.116 -0.249 1
1 907 . 8 1 1 A 71 71 ASP CA C 71 54.248 54.487 -0.239 1
1 908 . 8 1 1 A 71 71 ASP CB C 71 41.166 41.206 -0.040 1
1 909 . 8 1 1 A 71 71 ASP N N 71 120.385 121.887 -1.502 1
1 910 . 8 1 1 A 72 72 TYR H H 72 8.701 8.700 0.001 1
1 911 . 8 1 1 A 72 72 TYR HA H 72 4.283 4.608 -0.325 1
1 918 . 8 1 1 A 72 72 TYR C C 72 177.470 176.457 1.013 1
1 919 . 8 1 1 A 72 72 TYR CA C 72 60.513 59.797 0.716 1
1 920 . 8 1 1 A 72 72 TYR CB C 72 38.320 38.426 -0.106 1
1 925 . 8 1 1 A 72 72 TYR N N 72 121.876 124.358 -2.482 1
1 926 . 8 1 1 A 73 73 ASN H H 73 8.819 9.261 -0.442 1
1 927 . 8 1 1 A 73 73 ASN HA H 73 4.096 4.216 -0.120 1
1 932 . 8 1 1 A 73 73 ASN C C 73 174.362 174.451 -0.089 1
1 933 . 8 1 1 A 73 73 ASN CA C 73 54.289 54.384 -0.095 1
1 934 . 8 1 1 A 73 73 ASN CB C 73 36.907 36.874 0.033 1
1 936 . 8 1 1 A 73 73 ASN N N 73 121.726 119.548 2.178 1
1 938 . 8 1 1 A 74 74 ALA H H 74 8.059 7.710 0.349 1
1 939 . 8 1 1 A 74 74 ALA HA H 74 4.100 4.405 -0.305 1
1 943 . 8 1 1 A 74 74 ALA C C 74 177.757 177.399 0.358 1
1 944 . 8 1 1 A 74 74 ALA CA C 74 53.153 52.125 1.028 1
1 945 . 8 1 1 A 74 74 ALA CB C 74 19.412 19.788 -0.376 1
1 946 . 8 1 1 A 74 74 ALA N N 74 122.292 121.434 0.858 1
1 947 . 8 1 1 A 75 75 ARG H H 75 8.500 8.498 0.002 1
1 948 . 8 1 1 A 75 75 ARG HA H 75 4.758 4.663 0.095 1
1 955 . 8 1 1 A 75 75 ARG C C 75 176.812 175.984 0.828 1
1 956 . 8 1 1 A 75 75 ARG CA C 75 56.646 56.187 0.459 1
1 957 . 8 1 1 A 75 75 ARG CB C 75 29.375 30.628 -1.253 1
1 960 . 8 1 1 A 75 75 ARG N N 75 122.871 121.247 1.624 1
1 961 . 8 1 1 A 76 76 VAL H H 76 7.965 8.978 -1.013 1
1 962 . 8 1 1 A 76 76 VAL HA H 76 5.230 4.828 0.402 1
1 970 . 8 1 1 A 76 76 VAL C C 76 173.758 174.614 -0.856 1
1 971 . 8 1 1 A 76 76 VAL CA C 76 58.193 59.143 -0.950 1
1 972 . 8 1 1 A 76 76 VAL CB C 76 36.536 34.993 1.543 1
1 975 . 8 1 1 A 76 76 VAL N N 76 116.220 118.655 -2.435 1
1 976 . 8 1 1 A 77 77 GLU H H 77 9.166 9.217 -0.051 1
1 977 . 8 1 1 A 77 77 GLU HA H 77 4.663 4.966 -0.303 1
1 982 . 8 1 1 A 77 77 GLU C C 77 174.940 174.903 0.037 1
1 983 . 8 1 1 A 77 77 GLU CA C 77 53.546 54.327 -0.781 1
1 984 . 8 1 1 A 77 77 GLU CB C 77 33.395 33.477 -0.082 1
1 986 . 8 1 1 A 77 77 GLU N N 77 116.413 122.932 -6.519 1
1 987 . 8 1 1 A 78 78 LEU H H 78 8.670 8.961 -0.291 1
1 988 . 8 1 1 A 78 78 LEU HA H 78 4.677 4.931 -0.254 1
1 998 . 8 1 1 A 78 78 LEU C C 78 176.036 176.060 -0.024 1
1 999 . 8 1 1 A 78 78 LEU CA C 78 53.091 53.285 -0.194 1
1 1000 . 8 1 1 A 78 78 LEU CB C 78 43.276 42.706 0.570 1
1 1004 . 8 1 1 A 78 78 LEU N N 78 117.927 124.075 -6.148 1
1 1005 . 8 1 1 A 79 79 ILE H H 79 7.900 8.895 -0.995 1
1 1006 . 8 1 1 A 79 79 ILE HA H 79 4.312 3.908 0.404 1
1 1016 . 8 1 1 A 79 79 ILE C C 79 175.179 176.366 -1.187 1
1 1017 . 8 1 1 A 79 79 ILE CA C 79 58.294 61.325 -3.031 1
1 1018 . 8 1 1 A 79 79 ILE CB C 79 36.086 37.199 -1.113 1
1 1022 . 8 1 1 A 79 79 ILE N N 79 121.667 125.081 -3.414 1
1 1023 . 8 1 1 A 80 80 ASN H H 80 9.412 8.953 0.459 1
1 1024 . 8 1 1 A 80 80 ASN HA H 80 4.516 4.254 0.262 1
1 1029 . 8 1 1 A 80 80 ASN C C 80 170.300 173.446 -3.146 1
1 1030 . 8 1 1 A 80 80 ASN CA C 80 54.198 53.849 0.349 1
1 1031 . 8 1 1 A 80 80 ASN CB C 80 37.450 37.157 0.293 1
1 1033 . 8 1 1 A 80 80 ASN N N 80 123.831 122.628 1.203 1
1 1035 . 8 1 1 A 81 81 PRO HA H 81 5.185 4.703 0.482 1
1 1042 . 8 1 1 A 81 81 PRO C C 81 176.865 176.656 0.209 1
1 1043 . 8 1 1 A 81 81 PRO CA C 81 62.637 62.306 0.331 1
1 1044 . 8 1 1 A 81 81 PRO CB C 81 32.965 32.269 0.696 1
1 1047 . 8 1 1 A 82 82 ILE H H 82 9.374 8.671 0.703 1
1 1048 . 8 1 1 A 82 82 ILE HA H 82 4.524 4.948 -0.424 1
1 1058 . 8 1 1 A 82 82 ILE C C 82 174.731 175.049 -0.318 1
1 1059 . 8 1 1 A 82 82 ILE CA C 82 60.205 58.463 1.742 1
1 1060 . 8 1 1 A 82 82 ILE CB C 82 41.737 41.100 0.637 1
1 1064 . 8 1 1 A 82 82 ILE N N 82 121.658 117.013 4.645 1
1 1065 . 8 1 1 A 83 83 ALA H H 83 8.819 8.774 0.045 1
1 1066 . 8 1 1 A 83 83 ALA HA H 83 4.773 4.512 0.261 1
1 1070 . 8 1 1 A 83 83 ALA C C 83 176.550 176.565 -0.015 1
1 1071 . 8 1 1 A 83 83 ALA CA C 83 52.069 52.198 -0.129 1
1 1072 . 8 1 1 A 83 83 ALA CB C 83 20.374 19.530 0.844 1
1 1073 . 8 1 1 A 83 83 ALA N N 83 127.933 125.863 2.070 1
1 1074 . 8 1 1 A 84 84 ASP H H 84 8.710 8.516 0.194 1
1 1075 . 8 1 1 A 84 84 ASP HA H 84 4.894 4.761 0.133 1
1 1078 . 8 1 1 A 84 84 ASP C C 84 175.997 177.508 -1.511 1
1 1079 . 8 1 1 A 84 84 ASP CA C 84 53.334 54.245 -0.911 1
1 1080 . 8 1 1 A 84 84 ASP CB C 84 42.104 42.419 -0.315 1
1 1081 . 8 1 1 A 84 84 ASP N N 84 122.009 122.443 -0.434 1
1 1082 . 8 1 1 A 85 85 THR H H 85 8.349 8.795 -0.446 1
1 1083 . 8 1 1 A 85 85 THR HA H 85 4.420 4.022 0.398 1
1 1088 . 8 1 1 A 85 85 THR C C 85 175.085 176.224 -1.139 1
1 1089 . 8 1 1 A 85 85 THR CA C 85 62.304 66.813 -4.509 1
1 1090 . 8 1 1 A 85 85 THR CB C 85 69.718 68.755 0.963 1
1 1092 . 8 1 1 A 85 85 THR N N 85 114.986 120.487 -5.501 1
1 1093 . 8 1 1 A 86 86 VAL H H 86 8.188 7.664 0.524 1
1 1094 . 8 1 1 A 86 86 VAL HA H 86 4.021 3.967 0.054 1
1 1102 . 8 1 1 A 86 86 VAL C C 86 176.519 176.920 -0.401 1
1 1103 . 8 1 1 A 86 86 VAL CA C 86 63.046 64.572 -1.526 1
1 1104 . 8 1 1 A 86 86 VAL CB C 86 32.526 31.249 1.277 1
1 1107 . 8 1 1 A 86 86 VAL N N 86 122.275 118.094 4.181 1
1 1108 . 8 1 1 A 87 87 ALA H H 87 8.194 7.734 0.460 1
1 1109 . 8 1 1 A 87 87 ALA HA H 87 4.212 4.524 -0.312 1
1 1113 . 8 1 1 A 87 87 ALA C C 87 178.118 179.196 -1.078 1
1 1114 . 8 1 1 A 87 87 ALA CA C 87 53.153 53.752 -0.599 1
1 1115 . 8 1 1 A 87 87 ALA CB C 87 19.165 20.511 -1.346 1
1 1116 . 8 1 1 A 87 87 ALA N N 87 126.609 123.991 2.618 1
1 1117 . 8 1 1 A 88 88 THR H H 88 7.914 8.298 -0.384 1
1 1118 . 8 1 1 A 88 88 THR HA H 88 4.173 4.280 -0.107 1
1 1123 . 8 1 1 A 88 88 THR C C 88 174.516 175.472 -0.956 1
1 1124 . 8 1 1 A 88 88 THR CA C 88 62.785 64.814 -2.029 1
1 1125 . 8 1 1 A 88 88 THR CB C 88 69.582 68.447 1.135 1
1 1127 . 8 1 1 A 88 88 THR N N 88 112.328 111.123 1.205 1
1 1128 . 8 1 1 A 89 89 ALA H H 89 8.076 7.756 0.320 1
1 1129 . 8 1 1 A 89 89 ALA HA H 89 4.320 4.459 -0.139 1
1 1133 . 8 1 1 A 89 89 ALA C C 89 178.014 177.419 0.595 1
1 1134 . 8 1 1 A 89 89 ALA CA C 89 53.079 51.709 1.370 1
1 1135 . 8 1 1 A 89 89 ALA CB C 89 19.335 19.477 -0.142 1
1 1136 . 8 1 1 A 89 89 ALA N N 89 124.632 123.763 0.869 1
1 1137 . 8 1 1 A 90 90 THR H H 90 7.976 7.752 0.224 1
1 1138 . 8 1 1 A 90 90 THR HA H 90 4.203 4.341 -0.138 1
1 1143 . 8 1 1 A 90 90 THR C C 90 174.427 173.774 0.653 1
1 1144 . 8 1 1 A 90 90 THR CA C 90 62.519 63.115 -0.596 1
1 1145 . 8 1 1 A 90 90 THR CB C 90 69.721 70.441 -0.720 1
1 1147 . 8 1 1 A 90 90 THR N N 90 112.047 111.294 0.753 1
1 1148 . 8 1 1 A 91 91 TYR H H 91 7.959 7.765 0.194 1
1 1149 . 8 1 1 A 91 91 TYR HA H 91 4.564 4.732 -0.168 1
1 1156 . 8 1 1 A 91 91 TYR C C 91 175.522 175.335 0.187 1
1 1157 . 8 1 1 A 91 91 TYR CA C 91 57.874 57.184 0.690 1
1 1158 . 8 1 1 A 91 91 TYR CB C 91 38.584 39.232 -0.648 1
1 1163 . 8 1 1 A 91 91 TYR N N 91 121.184 118.484 2.700 1
1 1164 . 8 1 1 A 92 92 GLN H H 92 8.310 8.851 -0.541 1
1 1165 . 8 1 1 A 92 92 GLN HA H 92 4.258 3.958 0.300 1
1 1172 . 8 1 1 A 92 92 GLN C C 92 176.099 176.943 -0.844 1
1 1173 . 8 1 1 A 92 92 GLN CA C 92 56.109 57.913 -1.804 1
1 1174 . 8 1 1 A 92 92 GLN CB C 92 29.112 28.162 0.950 1
1 1177 . 8 1 1 A 92 92 GLN N N 92 121.631 124.716 -3.085 1
1 1179 . 8 1 1 A 93 93 GLY H H 93 8.052 8.480 -0.428 1
1 1180 . 8 1 1 A 93 93 GLY HA2 H 93 4.023 3.879 0.144 1
1 1181 . 8 1 1 A 93 93 GLY HA3 H 93 3.856 3.890 -0.034 1
1 1182 . 8 1 1 A 93 93 GLY C C 93 173.791 174.350 -0.559 1
1 1183 . 8 1 1 A 93 93 GLY CA C 93 45.382 46.801 -1.419 1
1 1184 . 8 1 1 A 93 93 GLY N N 93 109.847 113.234 -3.387 1
1 1185 . 8 1 1 A 94 94 ALA H H 94 8.162 7.412 0.750 1
1 1186 . 8 1 1 A 94 94 ALA HA H 94 4.329 4.440 -0.111 1
1 1190 . 8 1 1 A 94 94 ALA C C 94 177.392 176.967 0.425 1
1 1191 . 8 1 1 A 94 94 ALA CA C 94 52.558 50.768 1.790 1
1 1192 . 8 1 1 A 94 94 ALA CB C 94 19.526 20.701 -1.175 1
1 1193 . 8 1 1 A 94 94 ALA N N 94 123.424 122.747 0.677 1
1 1194 . 8 1 1 A 95 95 ASP H H 95 8.457 8.853 -0.396 1
1 1195 . 8 1 1 A 95 95 ASP HA H 95 4.608 4.316 0.292 1
1 1198 . 8 1 1 A 95 95 ASP C C 95 175.630 176.198 -0.568 1
1 1199 . 8 1 1 A 95 95 ASP CA C 95 54.450 53.212 1.238 1
1 1200 . 8 1 1 A 95 95 ASP CB C 95 40.871 39.511 1.360 1
1 1201 . 8 1 1 A 95 95 ASP N N 95 118.814 122.750 -3.936 1
1 1202 . 8 1 1 A 96 96 VAL H H 96 7.776 7.194 0.582 1
1 1203 . 8 1 1 A 96 96 VAL HA H 96 4.141 3.935 0.206 1
1 1211 . 8 1 1 A 96 96 VAL C C 96 175.301 176.098 -0.797 1
1 1212 . 8 1 1 A 96 96 VAL CA C 96 61.435 62.938 -1.503 1
1 1213 . 8 1 1 A 96 96 VAL CB C 96 33.517 30.922 2.595 1
1 1216 . 8 1 1 A 96 96 VAL N N 96 118.395 121.884 -3.489 1
1 1217 . 8 1 1 A 97 97 ASP H H 97 8.315 9.191 -0.876 1
1 1218 . 8 1 1 A 97 97 ASP HA H 97 4.681 4.214 0.467 1
1 1221 . 8 1 1 A 97 97 ASP C C 97 175.151 175.290 -0.139 1
1 1222 . 8 1 1 A 97 97 ASP CA C 97 54.324 55.329 -1.005 1
1 1223 . 8 1 1 A 97 97 ASP CB C 97 41.963 39.265 2.698 1
1 1224 . 8 1 1 A 97 97 ASP N N 97 123.905 125.176 -1.271 1
1 1225 . 8 1 1 A 98 98 TRP H H 98 8.210 7.663 0.547 1
1 1226 . 8 1 1 A 98 98 TRP HA H 98 4.916 4.781 0.135 1
1 1235 . 8 1 1 A 98 98 TRP C C 98 174.585 175.102 -0.517 1
1 1236 . 8 1 1 A 98 98 TRP CA C 98 56.164 57.029 -0.865 1
1 1237 . 8 1 1 A 98 98 TRP CB C 98 31.466 30.498 0.968 1
1 1243 . 8 1 1 A 98 98 TRP N N 98 120.340 117.935 2.405 1
1 1245 . 8 1 1 A 99 99 TYR H H 99 8.760 9.443 -0.683 1
1 1246 . 8 1 1 A 99 99 TYR HA H 99 5.119 5.544 -0.425 1
1 1253 . 8 1 1 A 99 99 TYR C C 99 174.599 174.994 -0.395 1
1 1254 . 8 1 1 A 99 99 TYR CA C 99 57.021 56.429 0.592 1
1 1255 . 8 1 1 A 99 99 TYR CB C 99 39.526 41.803 -2.277 1
1 1260 . 8 1 1 A 99 99 TYR N N 99 123.319 118.416 4.903 1
1 1261 . 8 1 1 A 100 100 ILE H H 100 8.936 8.971 -0.035 1
1 1262 . 8 1 1 A 100 100 ILE HA H 100 4.850 4.788 0.062 1
1 1272 . 8 1 1 A 100 100 ILE C C 100 175.070 174.725 0.345 1
1 1273 . 8 1 1 A 100 100 ILE CA C 100 58.998 60.156 -1.158 1
1 1274 . 8 1 1 A 100 100 ILE CB C 100 40.667 41.635 -0.968 1
1 1278 . 8 1 1 A 100 100 ILE N N 100 123.281 121.490 1.791 1
1 1279 . 8 1 1 A 101 101 LYS H H 101 8.987 9.098 -0.111 1
1 1280 . 8 1 1 A 101 101 LYS HA H 101 5.313 5.429 -0.116 1
1 1289 . 8 1 1 A 101 101 LYS C C 101 174.440 175.923 -1.483 1
1 1290 . 8 1 1 A 101 101 LYS CA C 101 54.763 54.975 -0.212 1
1 1291 . 8 1 1 A 101 101 LYS CB C 101 34.880 34.163 0.717 1
1 1295 . 8 1 1 A 101 101 LYS N N 101 126.210 126.772 -0.562 1
1 1296 . 8 1 1 A 102 102 ALA H H 102 8.531 8.146 0.385 1
1 1297 . 8 1 1 A 102 102 ALA HA H 102 4.957 4.755 0.202 1
1 1301 . 8 1 1 A 102 102 ALA C C 102 175.024 178.016 -2.992 1
1 1302 . 8 1 1 A 102 102 ALA CA C 102 50.701 49.873 0.828 1
1 1303 . 8 1 1 A 102 102 ALA CB C 102 21.618 22.484 -0.866 1
1 1304 . 8 1 1 A 102 102 ALA N N 102 121.424 127.191 -5.767 1
1 1305 . 8 1 1 A 103 103 ASP H H 103 8.339 9.071 -0.732 1
1 1306 . 8 1 1 A 103 103 ASP HA H 103 4.603 4.481 0.122 1
1 1309 . 8 1 1 A 103 103 ASP C C 103 176.188 175.354 0.834 1
1 1310 . 8 1 1 A 103 103 ASP CA C 103 56.049 56.100 -0.051 1
1 1311 . 8 1 1 A 103 103 ASP CB C 103 40.932 41.515 -0.583 1
1 1312 . 8 1 1 A 103 103 ASP N N 103 117.773 119.417 -1.644 1
1 1313 . 8 1 1 A 104 104 ASP H H 104 7.482 7.296 0.186 1
1 1314 . 8 1 1 A 104 104 ASP HA H 104 4.727 4.905 -0.178 1
1 1317 . 8 1 1 A 104 104 ASP C C 104 174.261 173.556 0.705 1
1 1318 . 8 1 1 A 104 104 ASP CA C 104 52.768 53.805 -1.037 1
1 1319 . 8 1 1 A 104 104 ASP CB C 104 42.587 43.845 -1.258 1
1 1320 . 8 1 1 A 104 104 ASP N N 104 110.673 116.411 -5.738 1
1 1321 . 8 1 1 A 105 105 ILE H H 105 9.267 8.494 0.773 1
1 1322 . 8 1 1 A 105 105 ILE HA H 105 4.631 4.902 -0.271 1
1 1332 . 8 1 1 A 105 105 ILE C C 105 173.922 175.248 -1.326 1
1 1333 . 8 1 1 A 105 105 ILE CA C 105 61.114 60.218 0.896 1
1 1334 . 8 1 1 A 105 105 ILE CB C 105 42.522 40.067 2.455 1
1 1338 . 8 1 1 A 105 105 ILE N N 105 121.380 122.184 -0.804 1
1 1339 . 8 1 1 A 106 106 VAL H H 106 8.592 8.940 -0.348 1
1 1340 . 8 1 1 A 106 106 VAL HA H 106 4.975 4.901 0.074 1
1 1348 . 8 1 1 A 106 106 VAL C C 106 175.049 174.814 0.235 1
1 1349 . 8 1 1 A 106 106 VAL CA C 106 58.028 59.168 -1.140 1
1 1350 . 8 1 1 A 106 106 VAL CB C 106 35.388 35.628 -0.240 1
1 1353 . 8 1 1 A 106 106 VAL N N 106 116.356 120.479 -4.123 1
1 1354 . 8 1 1 A 107 107 LEU H H 107 8.360 8.536 -0.176 1
1 1355 . 8 1 1 A 107 107 LEU HA H 107 4.167 4.138 0.029 1
1 1365 . 8 1 1 A 107 107 LEU C C 107 178.338 177.289 1.049 1
1 1366 . 8 1 1 A 107 107 LEU CA C 107 55.077 54.126 0.951 1
1 1367 . 8 1 1 A 107 107 LEU CB C 107 42.394 41.785 0.609 1
1 1371 . 8 1 1 A 107 107 LEU N N 107 121.368 122.653 -1.285 1
1 1372 . 8 1 1 A 108 108 THR H H 108 7.977 8.664 -0.687 1
1 1373 . 8 1 1 A 108 108 THR HA H 108 4.039 4.352 -0.313 1
1 1378 . 8 1 1 A 108 108 THR C C 108 174.725 174.547 0.178 1
1 1379 . 8 1 1 A 108 108 THR CA C 108 63.513 63.255 0.258 1
1 1380 . 8 1 1 A 108 108 THR CB C 108 69.194 69.602 -0.408 1
1 1382 . 8 1 1 A 108 108 THR N N 108 118.728 118.289 0.439 1
1 1383 . 8 1 1 A 109 109 LEU H H 109 8.378 8.525 -0.147 1
1 1384 . 8 1 1 A 109 109 LEU HA H 109 4.274 4.398 -0.124 1
1 1394 . 8 1 1 A 109 109 LEU C C 109 177.058 175.754 1.304 1
1 1395 . 8 1 1 A 109 109 LEU CA C 109 55.045 54.870 0.175 1
1 1396 . 8 1 1 A 109 109 LEU CB C 109 42.620 40.209 2.411 1
1 1400 . 8 1 1 A 109 109 LEU N N 109 124.847 127.927 -3.080 1
1 9 . 9 1 1 A 2 2 MET HA H 2 4.554 4.543 0.011 1
1 14 . 9 1 1 A 2 2 MET C C 2 174.749 175.436 -0.687 1
1 15 . 9 1 1 A 2 2 MET CA C 2 55.354 53.885 1.469 1
1 16 . 9 1 1 A 2 2 MET CB C 2 33.729 32.344 1.385 1
1 18 . 9 1 1 A 3 3 ARG H H 3 8.518 8.606 -0.088 1
1 19 . 9 1 1 A 3 3 ARG HA H 3 4.531 4.994 -0.463 1
1 26 . 9 1 1 A 3 3 ARG C C 3 175.780 174.763 1.017 1
1 27 . 9 1 1 A 3 3 ARG CA C 3 55.854 54.525 1.329 1
1 28 . 9 1 1 A 3 3 ARG CB C 3 31.403 33.748 -2.345 1
1 31 . 9 1 1 A 3 3 ARG N N 3 124.008 124.514 -0.506 1
1 32 . 9 1 1 A 4 4 LEU H H 4 8.424 8.950 -0.526 1
1 33 . 9 1 1 A 4 4 LEU HA H 4 4.457 4.824 -0.367 1
1 43 . 9 1 1 A 4 4 LEU C C 4 177.362 176.112 1.250 1
1 44 . 9 1 1 A 4 4 LEU CA C 4 54.511 53.691 0.820 1
1 45 . 9 1 1 A 4 4 LEU CB C 4 42.686 44.020 -1.334 1
1 49 . 9 1 1 A 4 4 LEU N N 4 124.389 123.825 0.564 1
1 50 . 9 1 1 A 5 5 ALA H H 5 8.418 8.666 -0.248 1
1 51 . 9 1 1 A 5 5 ALA HA H 5 4.254 4.537 -0.283 1
1 55 . 9 1 1 A 5 5 ALA C C 5 177.420 178.502 -1.082 1
1 56 . 9 1 1 A 5 5 ALA CA C 5 52.931 51.299 1.632 1
1 57 . 9 1 1 A 5 5 ALA CB C 5 19.263 20.066 -0.803 1
1 58 . 9 1 1 A 5 5 ALA N N 5 124.548 126.076 -1.528 1
1 59 . 9 1 1 A 6 6 ASN H H 6 8.287 8.577 -0.290 1
1 60 . 9 1 1 A 6 6 ASN HA H 6 4.616 4.511 0.105 1
1 65 . 9 1 1 A 6 6 ASN C C 6 175.837 175.793 0.044 1
1 66 . 9 1 1 A 6 6 ASN CA C 6 53.345 54.182 -0.837 1
1 67 . 9 1 1 A 6 6 ASN CB C 6 38.571 39.210 -0.639 1
1 69 . 9 1 1 A 6 6 ASN N N 6 116.484 120.129 -3.645 1
1 71 . 9 1 1 A 7 7 GLY H H 7 8.351 7.996 0.355 1
1 72 . 9 1 1 A 7 7 GLY HA2 H 7 4.130 3.970 0.160 1
1 73 . 9 1 1 A 7 7 GLY HA3 H 7 3.808 3.971 -0.163 1
1 74 . 9 1 1 A 7 7 GLY C C 7 173.750 174.148 -0.398 1
1 75 . 9 1 1 A 7 7 GLY CA C 7 45.343 45.980 -0.637 1
1 76 . 9 1 1 A 7 7 GLY N N 7 108.453 108.255 0.198 1
1 77 . 9 1 1 A 8 8 ILE H H 8 7.868 8.216 -0.348 1
1 78 . 9 1 1 A 8 8 ILE HA H 8 4.130 4.774 -0.644 1
1 88 . 9 1 1 A 8 8 ILE C C 8 175.570 175.273 0.297 1
1 89 . 9 1 1 A 8 8 ILE CA C 8 61.095 59.534 1.561 1
1 90 . 9 1 1 A 8 8 ILE CB C 8 38.694 39.842 -1.148 1
1 94 . 9 1 1 A 8 8 ILE N N 8 120.848 119.623 1.225 1
1 95 . 9 1 1 A 9 9 VAL H H 9 8.220 8.474 -0.254 1
1 96 . 9 1 1 A 9 9 VAL HA H 9 4.172 4.232 -0.060 1
1 104 . 9 1 1 A 9 9 VAL C C 9 175.898 175.364 0.534 1
1 105 . 9 1 1 A 9 9 VAL CA C 9 62.488 62.776 -0.288 1
1 106 . 9 1 1 A 9 9 VAL CB C 9 32.460 30.988 1.472 1
1 109 . 9 1 1 A 9 9 VAL N N 9 125.805 123.289 2.516 1
1 110 . 9 1 1 A 10 10 LEU H H 10 8.437 8.630 -0.193 1
1 111 . 9 1 1 A 10 10 LEU HA H 10 4.347 4.950 -0.603 1
1 121 . 9 1 1 A 10 10 LEU C C 10 176.398 175.645 0.753 1
1 122 . 9 1 1 A 10 10 LEU CA C 10 54.787 53.449 1.338 1
1 123 . 9 1 1 A 10 10 LEU CB C 10 42.639 45.722 -3.083 1
1 127 . 9 1 1 A 10 10 LEU N N 10 127.757 123.607 4.150 1
1 128 . 9 1 1 A 11 11 ASP H H 11 8.506 8.790 -0.284 1
1 129 . 9 1 1 A 11 11 ASP HA H 11 4.683 4.965 -0.282 1
1 132 . 9 1 1 A 11 11 ASP C C 11 176.672 176.804 -0.132 1
1 133 . 9 1 1 A 11 11 ASP CA C 11 53.586 53.625 -0.039 1
1 134 . 9 1 1 A 11 11 ASP CB C 11 41.123 41.225 -0.102 1
1 135 . 9 1 1 A 11 11 ASP N N 11 121.539 117.502 4.037 1
1 136 . 9 1 1 A 12 12 LYS H H 12 8.578 8.150 0.428 1
1 137 . 9 1 1 A 12 12 LYS HA H 12 3.943 4.066 -0.123 1
1 146 . 9 1 1 A 12 12 LYS C C 12 176.917 176.293 0.624 1
1 147 . 9 1 1 A 12 12 LYS CA C 12 58.542 59.103 -0.561 1
1 148 . 9 1 1 A 12 12 LYS CB C 12 32.703 32.180 0.523 1
1 152 . 9 1 1 A 12 12 LYS N N 12 123.635 118.728 4.907 1
1 153 . 9 1 1 A 13 13 ASP H H 13 8.523 8.142 0.381 1
1 154 . 9 1 1 A 13 13 ASP HA H 13 4.566 4.968 -0.402 1
1 157 . 9 1 1 A 13 13 ASP C C 13 177.535 176.181 1.354 1
1 158 . 9 1 1 A 13 13 ASP CA C 13 56.034 53.580 2.454 1
1 159 . 9 1 1 A 13 13 ASP CB C 13 41.051 41.382 -0.331 1
1 160 . 9 1 1 A 13 13 ASP N N 13 120.448 119.235 1.213 1
1 161 . 9 1 1 A 14 14 THR H H 14 7.964 8.667 -0.703 1
1 162 . 9 1 1 A 14 14 THR HA H 14 4.146 4.610 -0.464 1
1 167 . 9 1 1 A 14 14 THR C C 14 175.440 174.543 0.897 1
1 168 . 9 1 1 A 14 14 THR CA C 14 63.245 61.336 1.909 1
1 169 . 9 1 1 A 14 14 THR CB C 14 69.092 70.806 -1.714 1
1 171 . 9 1 1 A 14 14 THR N N 14 113.711 115.604 -1.893 1
1 172 . 9 1 1 A 15 15 THR H H 15 7.921 8.220 -0.299 1
1 173 . 9 1 1 A 15 15 THR HA H 15 3.920 4.711 -0.791 1
1 178 . 9 1 1 A 15 15 THR C C 15 174.750 174.309 0.441 1
1 179 . 9 1 1 A 15 15 THR CA C 15 64.562 61.017 3.545 1
1 180 . 9 1 1 A 15 15 THR CB C 15 69.166 70.054 -0.888 1
1 182 . 9 1 1 A 15 15 THR N N 15 116.710 111.367 5.343 1
1 183 . 9 1 1 A 16 16 PHE H H 16 8.191 9.003 -0.812 1
1 184 . 9 1 1 A 16 16 PHE HA H 16 4.628 5.000 -0.372 1
1 192 . 9 1 1 A 16 16 PHE C C 16 177.754 176.134 1.620 1
1 193 . 9 1 1 A 16 16 PHE CA C 16 57.975 56.432 1.543 1
1 194 . 9 1 1 A 16 16 PHE CB C 16 39.553 41.515 -1.962 1
1 200 . 9 1 1 A 16 16 PHE N N 16 117.124 120.890 -3.766 1
1 201 . 9 1 1 A 17 17 GLY H H 17 8.110 8.531 -0.421 1
1 202 . 9 1 1 A 17 17 GLY HA2 H 17 4.017 4.128 -0.111 1
1 203 . 9 1 1 A 17 17 GLY HA3 H 17 3.849 4.131 -0.282 1
1 204 . 9 1 1 A 17 17 GLY C C 17 172.231 173.292 -1.061 1
1 205 . 9 1 1 A 17 17 GLY CA C 17 45.633 44.541 1.092 1
1 206 . 9 1 1 A 17 17 GLY N N 17 109.951 108.953 0.998 1
1 207 . 9 1 1 A 18 18 GLU H H 18 8.304 8.541 -0.237 1
1 208 . 9 1 1 A 18 18 GLU HA H 18 4.078 4.264 -0.186 1
1 213 . 9 1 1 A 18 18 GLU C C 18 175.588 176.275 -0.687 1
1 214 . 9 1 1 A 18 18 GLU CA C 18 57.446 56.581 0.865 1
1 215 . 9 1 1 A 18 18 GLU CB C 18 30.767 29.503 1.264 1
1 217 . 9 1 1 A 18 18 GLU N N 18 121.640 118.462 3.178 1
1 218 . 9 1 1 A 19 19 LEU H H 19 8.799 8.759 0.040 1
1 219 . 9 1 1 A 19 19 LEU HA H 19 5.416 4.741 0.675 1
1 229 . 9 1 1 A 19 19 LEU C C 19 176.875 176.230 0.645 1
1 230 . 9 1 1 A 19 19 LEU CA C 19 53.281 54.446 -1.165 1
1 231 . 9 1 1 A 19 19 LEU CB C 19 45.508 41.562 3.946 1
1 235 . 9 1 1 A 19 19 LEU N N 19 127.101 126.652 0.449 1
1 236 . 9 1 1 A 20 20 LYS H H 20 8.494 8.278 0.216 1
1 237 . 9 1 1 A 20 20 LYS HA H 20 5.200 4.890 0.310 1
1 246 . 9 1 1 A 20 20 LYS C C 20 176.163 175.898 0.265 1
1 247 . 9 1 1 A 20 20 LYS CA C 20 53.575 54.957 -1.382 1
1 248 . 9 1 1 A 20 20 LYS CB C 20 36.835 33.583 3.252 1
1 252 . 9 1 1 A 20 20 LYS N N 20 118.828 124.912 -6.084 1
1 253 . 9 1 1 A 21 21 PHE H H 21 9.658 8.927 0.731 1
1 254 . 9 1 1 A 21 21 PHE HA H 21 4.038 4.514 -0.476 1
1 262 . 9 1 1 A 21 21 PHE C C 21 174.296 175.197 -0.901 1
1 263 . 9 1 1 A 21 21 PHE CA C 21 60.462 58.720 1.742 1
1 264 . 9 1 1 A 21 21 PHE CB C 21 40.359 39.842 0.517 1
1 270 . 9 1 1 A 21 21 PHE N N 21 124.322 127.182 -2.860 1
1 271 . 9 1 1 A 22 22 SER H H 22 7.199 8.458 -1.259 1
1 272 . 9 1 1 A 22 22 SER HA H 22 5.046 4.605 0.441 1
1 275 . 9 1 1 A 22 22 SER C C 22 173.080 174.783 -1.703 1
1 276 . 9 1 1 A 22 22 SER CA C 22 58.547 60.093 -1.546 1
1 277 . 9 1 1 A 22 22 SER CB C 22 63.591 63.620 -0.029 1
1 278 . 9 1 1 A 22 22 SER N N 22 120.109 121.904 -1.795 1
1 279 . 9 1 1 A 23 23 ALA H H 23 7.269 6.732 0.537 1
1 280 . 9 1 1 A 23 23 ALA HA H 23 4.426 4.485 -0.059 1
1 284 . 9 1 1 A 23 23 ALA C C 23 176.568 174.482 2.086 1
1 285 . 9 1 1 A 23 23 ALA CA C 23 52.458 51.409 1.049 1
1 286 . 9 1 1 A 23 23 ALA CB C 23 22.728 22.411 0.317 1
1 287 . 9 1 1 A 23 23 ALA N N 23 114.102 118.064 -3.962 1
1 288 . 9 1 1 A 24 24 LEU H H 24 8.819 8.592 0.227 1
1 289 . 9 1 1 A 24 24 LEU HA H 24 4.060 4.444 -0.384 1
1 299 . 9 1 1 A 24 24 LEU C C 24 175.363 176.483 -1.120 1
1 300 . 9 1 1 A 24 24 LEU CA C 24 56.901 54.413 2.488 1
1 301 . 9 1 1 A 24 24 LEU CB C 24 42.065 42.044 0.021 1
1 305 . 9 1 1 A 24 24 LEU N N 24 120.865 120.961 -0.096 1
1 306 . 9 1 1 A 25 25 ARG H H 25 9.473 8.593 0.880 1
1 307 . 9 1 1 A 25 25 ARG HA H 25 4.428 4.052 0.376 1
1 315 . 9 1 1 A 25 25 ARG C C 25 175.729 175.770 -0.041 1
1 316 . 9 1 1 A 25 25 ARG CA C 25 56.721 58.396 -1.675 1
1 317 . 9 1 1 A 25 25 ARG CB C 25 31.109 31.200 -0.091 1
1 320 . 9 1 1 A 25 25 ARG N N 25 130.455 127.491 2.964 1
1 322 . 9 1 1 A 26 26 ARG H H 26 7.711 7.463 0.248 1
1 323 . 9 1 1 A 26 26 ARG HA H 26 4.559 4.507 0.052 1
1 330 . 9 1 1 A 26 26 ARG C C 26 173.724 173.673 0.051 1
1 331 . 9 1 1 A 26 26 ARG CA C 26 55.737 55.817 -0.080 1
1 332 . 9 1 1 A 26 26 ARG CB C 26 33.261 33.712 -0.451 1
1 335 . 9 1 1 A 26 26 ARG N N 26 113.305 118.354 -5.049 1
1 336 . 9 1 1 A 27 27 GLU H H 27 8.848 8.634 0.214 1
1 337 . 9 1 1 A 27 27 GLU HA H 27 4.615 4.743 -0.128 1
1 342 . 9 1 1 A 27 27 GLU C C 27 174.836 175.843 -1.007 1
1 343 . 9 1 1 A 27 27 GLU CA C 27 55.901 55.475 0.426 1
1 344 . 9 1 1 A 27 27 GLU CB C 27 30.755 29.902 0.853 1
1 346 . 9 1 1 A 27 27 GLU N N 27 121.934 125.958 -4.024 1
1 347 . 9 1 1 A 28 28 VAL H H 28 8.603 8.218 0.385 1
1 348 . 9 1 1 A 28 28 VAL HA H 28 4.013 4.309 -0.296 1
1 356 . 9 1 1 A 28 28 VAL C C 28 175.561 175.929 -0.368 1
1 357 . 9 1 1 A 28 28 VAL CA C 28 62.791 61.785 1.006 1
1 358 . 9 1 1 A 28 28 VAL CB C 28 32.710 32.175 0.535 1
1 361 . 9 1 1 A 28 28 VAL N N 28 125.545 122.481 3.064 1
1 362 . 9 1 1 A 29 29 ARG H H 29 8.735 8.511 0.224 1
1 363 . 9 1 1 A 29 29 ARG HA H 29 4.774 4.494 0.280 1
1 370 . 9 1 1 A 29 29 ARG C C 29 176.580 176.767 -0.187 1
1 371 . 9 1 1 A 29 29 ARG CA C 29 55.481 55.468 0.013 1
1 372 . 9 1 1 A 29 29 ARG CB C 29 31.963 31.442 0.521 1
1 375 . 9 1 1 A 29 29 ARG N N 29 128.327 126.727 1.600 1
1 376 . 9 1 1 A 30 30 ILE H H 30 8.358 8.552 -0.194 1
1 377 . 9 1 1 A 30 30 ILE HA H 30 3.882 4.196 -0.314 1
1 387 . 9 1 1 A 30 30 ILE C C 30 175.093 174.883 0.210 1
1 388 . 9 1 1 A 30 30 ILE CA C 30 61.669 60.936 0.733 1
1 389 . 9 1 1 A 30 30 ILE CB C 30 38.806 37.630 1.176 1
1 393 . 9 1 1 A 30 30 ILE N N 30 121.957 121.763 0.194 1
1 394 . 9 1 1 A 31 31 GLN H H 31 8.560 8.763 -0.203 1
1 395 . 9 1 1 A 31 31 GLN HA H 31 4.647 4.674 -0.027 1
1 402 . 9 1 1 A 31 31 GLN C C 31 175.954 175.576 0.378 1
1 403 . 9 1 1 A 31 31 GLN CA C 31 54.833 54.967 -0.134 1
1 404 . 9 1 1 A 31 31 GLN CB C 31 30.584 29.874 0.710 1
1 407 . 9 1 1 A 31 31 GLN N N 31 126.348 128.052 -1.704 1
1 409 . 9 1 1 A 32 32 ASN H H 32 8.994 9.003 -0.009 1
1 410 . 9 1 1 A 32 32 ASN HA H 32 4.784 4.750 0.034 1
1 415 . 9 1 1 A 32 32 ASN C C 32 177.296 176.693 0.603 1
1 416 . 9 1 1 A 32 32 ASN CA C 32 53.206 53.482 -0.276 1
1 417 . 9 1 1 A 32 32 ASN CB C 32 39.472 39.551 -0.079 1
1 419 . 9 1 1 A 32 32 ASN N N 32 122.834 125.757 -2.923 1
1 421 . 9 1 1 A 33 33 GLU H H 33 9.180 8.929 0.251 1
1 422 . 9 1 1 A 33 33 GLU HA H 33 4.063 3.982 0.081 1
1 427 . 9 1 1 A 33 33 GLU C C 33 176.787 177.894 -1.107 1
1 428 . 9 1 1 A 33 33 GLU CA C 33 59.347 59.381 -0.034 1
1 429 . 9 1 1 A 33 33 GLU CB C 33 29.294 29.307 -0.013 1
1 431 . 9 1 1 A 33 33 GLU N N 33 122.736 121.600 1.136 1
1 432 . 9 1 1 A 34 34 ASP H H 34 7.969 8.049 -0.080 1
1 433 . 9 1 1 A 34 34 ASP HA H 34 4.499 4.561 -0.062 1
1 436 . 9 1 1 A 34 34 ASP C C 34 177.111 176.523 0.588 1
1 437 . 9 1 1 A 34 34 ASP CA C 34 53.632 54.153 -0.521 1
1 438 . 9 1 1 A 34 34 ASP CB C 34 39.807 40.943 -1.136 1
1 439 . 9 1 1 A 34 34 ASP N N 34 115.921 117.444 -1.523 1
1 440 . 9 1 1 A 35 35 GLY H H 35 8.083 8.391 -0.308 1
1 441 . 9 1 1 A 35 35 GLY HA2 H 35 4.366 3.958 0.408 1
1 442 . 9 1 1 A 35 35 GLY HA3 H 35 3.657 3.958 -0.301 1
1 443 . 9 1 1 A 35 35 GLY C C 35 174.584 174.048 0.536 1
1 444 . 9 1 1 A 35 35 GLY CA C 35 45.134 45.054 0.080 1
1 445 . 9 1 1 A 35 35 GLY N N 35 108.874 107.476 1.398 1
1 446 . 9 1 1 A 36 36 SER H H 36 8.274 7.894 0.380 1
1 447 . 9 1 1 A 36 36 SER HA H 36 4.389 4.516 -0.127 1
1 450 . 9 1 1 A 36 36 SER C C 36 173.284 174.198 -0.914 1
1 451 . 9 1 1 A 36 36 SER CA C 36 58.383 58.962 -0.579 1
1 452 . 9 1 1 A 36 36 SER CB C 36 64.576 64.517 0.059 1
1 453 . 9 1 1 A 36 36 SER N N 36 117.428 117.775 -0.347 1
1 454 . 9 1 1 A 37 37 VAL H H 37 8.508 8.570 -0.062 1
1 455 . 9 1 1 A 37 37 VAL HA H 37 4.346 4.252 0.094 1
1 463 . 9 1 1 A 37 37 VAL C C 37 176.370 175.473 0.897 1
1 464 . 9 1 1 A 37 37 VAL CA C 37 62.410 62.142 0.268 1
1 465 . 9 1 1 A 37 37 VAL CB C 37 33.086 32.467 0.619 1
1 468 . 9 1 1 A 37 37 VAL N N 37 119.189 125.561 -6.372 1
1 469 . 9 1 1 A 38 38 SER H H 38 8.461 8.548 -0.087 1
1 470 . 9 1 1 A 38 38 SER HA H 38 4.586 4.854 -0.268 1
1 473 . 9 1 1 A 38 38 SER C C 38 173.829 174.361 -0.532 1
1 474 . 9 1 1 A 38 38 SER CA C 38 57.618 56.018 1.600 1
1 475 . 9 1 1 A 38 38 SER CB C 38 64.537 65.749 -1.212 1
1 476 . 9 1 1 A 38 38 SER N N 38 121.629 119.680 1.949 1
1 477 . 9 1 1 A 39 39 ASP H H 39 8.512 8.404 0.108 1
1 478 . 9 1 1 A 39 39 ASP HA H 39 4.606 4.448 0.158 1
1 481 . 9 1 1 A 39 39 ASP C C 39 176.557 176.970 -0.413 1
1 482 . 9 1 1 A 39 39 ASP CA C 39 54.833 56.605 -1.772 1
1 483 . 9 1 1 A 39 39 ASP CB C 39 41.123 41.278 -0.155 1
1 484 . 9 1 1 A 39 39 ASP N N 39 120.305 123.133 -2.828 1
1 485 . 9 1 1 A 40 40 GLU H H 40 8.311 7.501 0.810 1
1 486 . 9 1 1 A 40 40 GLU HA H 40 4.235 4.402 -0.167 1
1 491 . 9 1 1 A 40 40 GLU C C 40 175.327 175.818 -0.491 1
1 492 . 9 1 1 A 40 40 GLU CA C 40 56.215 56.900 -0.685 1
1 493 . 9 1 1 A 40 40 GLU CB C 40 30.788 30.016 0.772 1
1 495 . 9 1 1 A 40 40 GLU N N 40 120.680 116.823 3.857 1
1 496 . 9 1 1 A 41 41 ILE H H 41 8.465 8.851 -0.386 1
1 497 . 9 1 1 A 41 41 ILE HA H 41 4.127 4.491 -0.364 1
1 507 . 9 1 1 A 41 41 ILE C C 41 175.380 176.074 -0.694 1
1 508 . 9 1 1 A 41 41 ILE CA C 41 60.670 59.779 0.891 1
1 509 . 9 1 1 A 41 41 ILE CB C 41 38.805 39.679 -0.874 1
1 513 . 9 1 1 A 41 41 ILE N N 41 123.665 123.650 0.015 1
1 514 . 9 1 1 A 42 42 LYS H H 42 9.556 9.330 0.226 1
1 515 . 9 1 1 A 42 42 LYS HA H 42 4.428 4.464 -0.036 1
1 524 . 9 1 1 A 42 42 LYS C C 42 177.277 175.158 2.119 1
1 525 . 9 1 1 A 42 42 LYS CA C 42 57.274 57.460 -0.186 1
1 526 . 9 1 1 A 42 42 LYS CB C 42 35.169 34.695 0.474 1
1 530 . 9 1 1 A 42 42 LYS N N 42 125.597 126.646 -1.049 1
1 531 . 9 1 1 A 43 43 GLU H H 43 7.809 7.499 0.310 1
1 532 . 9 1 1 A 43 43 GLU HA H 43 4.886 4.689 0.197 1
1 537 . 9 1 1 A 43 43 GLU C C 43 173.593 174.794 -1.201 1
1 538 . 9 1 1 A 43 43 GLU CA C 43 54.669 55.084 -0.415 1
1 539 . 9 1 1 A 43 43 GLU CB C 43 32.882 33.424 -0.542 1
1 541 . 9 1 1 A 43 43 GLU N N 43 115.292 116.382 -1.090 1
1 542 . 9 1 1 A 44 44 ARG H H 44 8.879 8.924 -0.045 1
1 543 . 9 1 1 A 44 44 ARG HA H 44 4.917 4.805 0.112 1
1 551 . 9 1 1 A 44 44 ARG C C 44 173.708 175.050 -1.342 1
1 552 . 9 1 1 A 44 44 ARG CA C 44 55.965 54.980 0.985 1
1 553 . 9 1 1 A 44 44 ARG CB C 44 33.579 31.445 2.134 1
1 556 . 9 1 1 A 44 44 ARG N N 44 118.233 122.861 -4.628 1
1 558 . 9 1 1 A 45 45 THR H H 45 8.892 8.961 -0.069 1
1 559 . 9 1 1 A 45 45 THR HA H 45 5.308 4.968 0.340 1
1 564 . 9 1 1 A 45 45 THR C C 45 173.357 173.405 -0.048 1
1 565 . 9 1 1 A 45 45 THR CA C 45 60.939 61.837 -0.898 1
1 566 . 9 1 1 A 45 45 THR CB C 45 70.054 69.846 0.208 1
1 568 . 9 1 1 A 45 45 THR N N 45 118.457 120.711 -2.254 1
1 569 . 9 1 1 A 46 46 TYR H H 46 9.625 9.534 0.091 1
1 570 . 9 1 1 A 46 46 TYR HA H 46 4.771 4.989 -0.218 1
1 578 . 9 1 1 A 46 46 TYR C C 46 173.735 174.701 -0.966 1
1 579 . 9 1 1 A 46 46 TYR CA C 46 57.480 56.650 0.830 1
1 580 . 9 1 1 A 46 46 TYR CB C 46 41.724 41.373 0.351 1
1 585 . 9 1 1 A 46 46 TYR N N 46 125.916 126.337 -0.421 1
1 586 . 9 1 1 A 47 47 ASP H H 47 9.006 8.763 0.243 1
1 587 . 9 1 1 A 47 47 ASP HA H 47 5.399 5.124 0.275 1
1 590 . 9 1 1 A 47 47 ASP C C 47 175.094 174.792 0.302 1
1 591 . 9 1 1 A 47 47 ASP CA C 47 53.460 53.618 -0.158 1
1 592 . 9 1 1 A 47 47 ASP CB C 47 41.947 42.080 -0.133 1
1 593 . 9 1 1 A 47 47 ASP N N 47 122.109 122.206 -0.097 1
1 594 . 9 1 1 A 48 48 LEU H H 48 9.066 8.902 0.164 1
1 595 . 9 1 1 A 48 48 LEU HA H 48 4.831 5.059 -0.228 1
1 605 . 9 1 1 A 48 48 LEU C C 48 174.977 175.284 -0.307 1
1 606 . 9 1 1 A 48 48 LEU CA C 48 52.724 53.194 -0.470 1
1 607 . 9 1 1 A 48 48 LEU CB C 48 44.844 44.883 -0.039 1
1 611 . 9 1 1 A 48 48 LEU N N 48 121.879 125.326 -3.447 1
1 612 . 9 1 1 A 49 49 LYS H H 49 9.401 8.524 0.877 1
1 613 . 9 1 1 A 49 49 LYS HA H 49 4.477 5.020 -0.543 1
1 622 . 9 1 1 A 49 49 LYS C C 49 176.225 175.863 0.362 1
1 623 . 9 1 1 A 49 49 LYS CA C 49 56.017 54.844 1.173 1
1 624 . 9 1 1 A 49 49 LYS CB C 49 33.838 33.858 -0.020 1
1 628 . 9 1 1 A 49 49 LYS N N 49 122.218 122.634 -0.416 1
1 629 . 9 1 1 A 50 50 SER H H 50 8.266 8.789 -0.523 1
1 630 . 9 1 1 A 50 50 SER HA H 50 5.222 4.766 0.456 1
1 633 . 9 1 1 A 50 50 SER C C 50 175.570 173.972 1.598 1
1 634 . 9 1 1 A 50 50 SER CA C 50 55.770 58.794 -3.024 1
1 635 . 9 1 1 A 50 50 SER CB C 50 64.738 63.726 1.012 1
1 636 . 9 1 1 A 50 50 SER N N 50 117.388 120.920 -3.532 1
1 637 . 9 1 1 A 51 51 LYS H H 51 9.276 8.785 0.491 1
1 638 . 9 1 1 A 51 51 LYS HA H 51 4.208 3.898 0.310 1
1 647 . 9 1 1 A 51 51 LYS C C 51 178.773 177.442 1.331 1
1 648 . 9 1 1 A 51 51 LYS CA C 51 58.674 58.304 0.370 1
1 649 . 9 1 1 A 51 51 LYS CB C 51 33.383 32.191 1.192 1
1 653 . 9 1 1 A 51 51 LYS N N 51 130.550 126.687 3.863 1
1 654 . 9 1 1 A 52 52 GLY H H 52 8.320 9.016 -0.696 1
1 655 . 9 1 1 A 52 52 GLY HA2 H 52 3.875 3.996 -0.121 1
1 656 . 9 1 1 A 52 52 GLY HA3 H 52 3.628 4.002 -0.374 1
1 657 . 9 1 1 A 52 52 GLY C C 52 175.108 175.644 -0.536 1
1 658 . 9 1 1 A 52 52 GLY CA C 52 46.322 45.620 0.702 1
1 659 . 9 1 1 A 52 52 GLY N N 52 107.053 115.081 -8.028 1
1 660 . 9 1 1 A 53 53 GLN H H 53 7.859 8.166 -0.307 1
1 661 . 9 1 1 A 53 53 GLN HA H 53 4.409 4.438 -0.029 1
1 668 . 9 1 1 A 53 53 GLN C C 53 176.469 176.938 -0.469 1
1 669 . 9 1 1 A 53 53 GLN CA C 53 54.911 55.786 -0.875 1
1 670 . 9 1 1 A 53 53 GLN CB C 53 29.675 29.671 0.004 1
1 673 . 9 1 1 A 53 53 GLN N N 53 115.482 119.337 -3.855 1
1 675 . 9 1 1 A 54 54 GLY H H 54 7.992 8.488 -0.496 1
1 676 . 9 1 1 A 54 54 GLY HA2 H 54 3.934 3.929 0.005 1
1 677 . 9 1 1 A 54 54 GLY HA3 H 54 3.934 3.935 -0.001 1
1 678 . 9 1 1 A 54 54 GLY C C 54 173.897 174.468 -0.571 1
1 679 . 9 1 1 A 54 54 GLY CA C 54 46.574 46.637 -0.063 1
1 680 . 9 1 1 A 54 54 GLY N N 54 110.111 108.752 1.359 1
1 681 . 9 1 1 A 55 55 ARG H H 55 7.652 7.895 -0.243 1
1 682 . 9 1 1 A 55 55 ARG HA H 55 4.665 4.706 -0.041 1
1 690 . 9 1 1 A 55 55 ARG C C 55 174.649 175.702 -1.053 1
1 691 . 9 1 1 A 55 55 ARG CA C 55 54.631 54.262 0.369 1
1 692 . 9 1 1 A 55 55 ARG CB C 55 32.166 32.398 -0.232 1
1 695 . 9 1 1 A 55 55 ARG N N 55 114.214 119.262 -5.048 1
1 697 . 9 1 1 A 56 56 MET H H 56 8.593 8.715 -0.122 1
1 698 . 9 1 1 A 56 56 MET HA H 56 5.012 5.186 -0.174 1
1 703 . 9 1 1 A 56 56 MET C C 56 176.216 175.472 0.744 1
1 704 . 9 1 1 A 56 56 MET CA C 56 54.595 53.763 0.832 1
1 705 . 9 1 1 A 56 56 MET CB C 56 33.466 33.533 -0.067 1
1 707 . 9 1 1 A 56 56 MET N N 56 121.270 119.536 1.734 1
1 708 . 9 1 1 A 57 57 ILE H H 57 9.393 8.853 0.540 1
1 709 . 9 1 1 A 57 57 ILE HA H 57 4.717 4.512 0.205 1
1 719 . 9 1 1 A 57 57 ILE C C 57 173.883 174.929 -1.046 1
1 720 . 9 1 1 A 57 57 ILE CA C 57 59.713 59.510 0.203 1
1 721 . 9 1 1 A 57 57 ILE CB C 57 40.933 39.111 1.822 1
1 725 . 9 1 1 A 57 57 ILE N N 57 120.811 120.492 0.319 1
1 726 . 9 1 1 A 58 58 GLN H H 58 8.218 7.785 0.433 1
1 727 . 9 1 1 A 58 58 GLN HA H 58 5.407 4.545 0.862 1
1 734 . 9 1 1 A 58 58 GLN C C 58 175.368 174.449 0.919 1
1 735 . 9 1 1 A 58 58 GLN CA C 58 55.163 55.165 -0.002 1
1 736 . 9 1 1 A 58 58 GLN CB C 58 30.841 28.681 2.160 1
1 739 . 9 1 1 A 58 58 GLN N N 58 122.281 122.955 -0.674 1
1 741 . 9 1 1 A 59 59 VAL H H 59 9.188 8.782 0.406 1
1 742 . 9 1 1 A 59 59 VAL HA H 59 5.025 5.050 -0.025 1
1 750 . 9 1 1 A 59 59 VAL C C 59 175.330 174.760 0.570 1
1 751 . 9 1 1 A 59 59 VAL CA C 59 59.975 61.753 -1.778 1
1 752 . 9 1 1 A 59 59 VAL CB C 59 34.818 32.195 2.623 1
1 755 . 9 1 1 A 59 59 VAL N N 59 122.421 126.680 -4.259 1
1 756 . 9 1 1 A 60 60 SER H H 60 9.022 8.782 0.240 1
1 757 . 9 1 1 A 60 60 SER HA H 60 5.811 5.458 0.353 1
1 760 . 9 1 1 A 60 60 SER C C 60 173.234 173.541 -0.307 1
1 761 . 9 1 1 A 60 60 SER CA C 60 57.634 56.792 0.842 1
1 762 . 9 1 1 A 60 60 SER CB C 60 64.891 64.516 0.375 1
1 763 . 9 1 1 A 60 60 SER N N 60 124.709 122.827 1.882 1
1 764 . 9 1 1 A 61 61 ILE H H 61 9.226 9.160 0.066 1
1 765 . 9 1 1 A 61 61 ILE HA H 61 5.572 4.932 0.640 1
1 775 . 9 1 1 A 61 61 ILE C C 61 173.955 173.829 0.126 1
1 776 . 9 1 1 A 61 61 ILE CA C 61 56.937 57.143 -0.206 1
1 777 . 9 1 1 A 61 61 ILE CB C 61 39.596 40.044 -0.448 1
1 781 . 9 1 1 A 61 61 ILE N N 61 121.648 121.610 0.038 1
1 782 . 9 1 1 A 62 62 PRO HA H 62 4.606 4.500 0.106 1
1 789 . 9 1 1 A 62 62 PRO C C 62 178.143 177.601 0.542 1
1 790 . 9 1 1 A 62 62 PRO CA C 62 63.740 62.816 0.924 1
1 791 . 9 1 1 A 62 62 PRO CB C 62 33.303 32.656 0.647 1
1 794 . 9 1 1 A 63 63 ALA H H 63 7.803 8.420 -0.617 1
1 795 . 9 1 1 A 63 63 ALA HA H 63 4.037 4.094 -0.057 1
1 799 . 9 1 1 A 63 63 ALA C C 63 175.942 179.638 -3.696 1
1 800 . 9 1 1 A 63 63 ALA CA C 63 54.417 55.295 -0.878 1
1 801 . 9 1 1 A 63 63 ALA CB C 63 19.345 18.540 0.805 1
1 802 . 9 1 1 A 63 63 ALA N N 63 123.695 126.759 -3.064 1
1 803 . 9 1 1 A 64 64 SER H H 64 7.719 7.858 -0.139 1
1 804 . 9 1 1 A 64 64 SER HA H 64 4.097 4.361 -0.264 1
1 807 . 9 1 1 A 64 64 SER C C 64 175.199 174.915 0.284 1
1 808 . 9 1 1 A 64 64 SER CA C 64 59.474 60.397 -0.923 1
1 809 . 9 1 1 A 64 64 SER CB C 64 62.125 63.411 -1.286 1
1 810 . 9 1 1 A 64 64 SER N N 64 110.001 111.564 -1.563 1
1 811 . 9 1 1 A 65 65 VAL H H 65 7.790 7.551 0.239 1
1 812 . 9 1 1 A 65 65 VAL HA H 65 4.360 4.165 0.195 1
1 820 . 9 1 1 A 65 65 VAL C C 65 174.433 174.372 0.061 1
1 821 . 9 1 1 A 65 65 VAL CA C 65 60.335 60.553 -0.218 1
1 822 . 9 1 1 A 65 65 VAL CB C 65 32.714 32.054 0.660 1
1 825 . 9 1 1 A 65 65 VAL N N 65 126.142 122.861 3.281 1
1 826 . 9 1 1 A 66 66 PRO HA H 66 4.369 4.454 -0.085 1
1 833 . 9 1 1 A 66 66 PRO C C 66 177.412 176.444 0.968 1
1 834 . 9 1 1 A 66 66 PRO CA C 66 63.104 63.056 0.048 1
1 835 . 9 1 1 A 66 66 PRO CB C 66 32.558 31.995 0.563 1
1 838 . 9 1 1 A 67 67 LEU H H 67 8.578 8.446 0.132 1
1 839 . 9 1 1 A 67 67 LEU HA H 67 3.875 4.403 -0.528 1
1 849 . 9 1 1 A 67 67 LEU C C 67 176.077 176.340 -0.263 1
1 850 . 9 1 1 A 67 67 LEU CA C 67 56.413 55.630 0.783 1
1 851 . 9 1 1 A 67 67 LEU CB C 67 43.279 42.673 0.606 1
1 855 . 9 1 1 A 67 67 LEU N N 67 124.236 123.505 0.731 1
1 856 . 9 1 1 A 68 68 LYS H H 68 7.994 8.902 -0.908 1
1 857 . 9 1 1 A 68 68 LYS HA H 68 3.793 3.663 0.130 1
1 866 . 9 1 1 A 68 68 LYS C C 68 175.601 176.154 -0.553 1
1 867 . 9 1 1 A 68 68 LYS CA C 68 53.350 59.268 -5.918 1
1 868 . 9 1 1 A 68 68 LYS CB C 68 31.035 32.013 -0.978 1
1 872 . 9 1 1 A 68 68 LYS N N 68 124.053 127.291 -3.238 1
1 873 . 9 1 1 A 69 69 GLU H H 69 8.347 7.876 0.471 1
1 874 . 9 1 1 A 69 69 GLU HA H 69 4.501 3.980 0.521 1
1 879 . 9 1 1 A 69 69 GLU C C 69 175.304 175.286 0.018 1
1 880 . 9 1 1 A 69 69 GLU CA C 69 54.291 57.455 -3.164 1
1 881 . 9 1 1 A 69 69 GLU CB C 69 29.285 27.145 2.140 1
1 883 . 9 1 1 A 69 69 GLU N N 69 123.876 116.271 7.605 1
1 884 . 9 1 1 A 70 70 PHE H H 70 5.549 6.239 -0.690 1
1 885 . 9 1 1 A 70 70 PHE HA H 70 4.592 4.274 0.318 1
1 893 . 9 1 1 A 70 70 PHE C C 70 174.443 174.761 -0.318 1
1 894 . 9 1 1 A 70 70 PHE CA C 70 53.313 57.363 -4.050 1
1 895 . 9 1 1 A 70 70 PHE CB C 70 38.335 39.179 -0.844 1
1 901 . 9 1 1 A 70 70 PHE N N 70 117.781 117.183 0.598 1
1 902 . 9 1 1 A 71 71 ASP H H 71 8.791 8.733 0.058 1
1 903 . 9 1 1 A 71 71 ASP HA H 71 4.535 4.947 -0.412 1
1 906 . 9 1 1 A 71 71 ASP C C 71 175.867 177.656 -1.789 1
1 907 . 9 1 1 A 71 71 ASP CA C 71 54.248 53.346 0.902 1
1 908 . 9 1 1 A 71 71 ASP CB C 71 41.166 41.779 -0.613 1
1 909 . 9 1 1 A 71 71 ASP N N 71 120.385 119.193 1.192 1
1 910 . 9 1 1 A 72 72 TYR H H 72 8.701 9.240 -0.539 1
1 911 . 9 1 1 A 72 72 TYR HA H 72 4.283 4.778 -0.495 1
1 918 . 9 1 1 A 72 72 TYR C C 72 177.470 176.613 0.857 1
1 919 . 9 1 1 A 72 72 TYR CA C 72 60.513 61.464 -0.951 1
1 920 . 9 1 1 A 72 72 TYR CB C 72 38.320 39.114 -0.794 1
1 925 . 9 1 1 A 72 72 TYR N N 72 121.876 123.532 -1.656 1
1 926 . 9 1 1 A 73 73 ASN H H 73 8.819 8.056 0.763 1
1 927 . 9 1 1 A 73 73 ASN HA H 73 4.096 4.795 -0.699 1
1 932 . 9 1 1 A 73 73 ASN C C 73 174.362 174.819 -0.457 1
1 933 . 9 1 1 A 73 73 ASN CA C 73 54.289 52.731 1.558 1
1 934 . 9 1 1 A 73 73 ASN CB C 73 36.907 39.587 -2.680 1
1 936 . 9 1 1 A 73 73 ASN N N 73 121.726 115.610 6.116 1
1 938 . 9 1 1 A 74 74 ALA H H 74 8.059 7.400 0.659 1
1 939 . 9 1 1 A 74 74 ALA HA H 74 4.100 4.226 -0.126 1
1 943 . 9 1 1 A 74 74 ALA C C 74 177.757 177.106 0.651 1
1 944 . 9 1 1 A 74 74 ALA CA C 74 53.153 51.915 1.238 1
1 945 . 9 1 1 A 74 74 ALA CB C 74 19.412 19.477 -0.065 1
1 946 . 9 1 1 A 74 74 ALA N N 74 122.292 123.040 -0.748 1
1 947 . 9 1 1 A 75 75 ARG H H 75 8.500 8.634 -0.134 1
1 948 . 9 1 1 A 75 75 ARG HA H 75 4.758 4.750 0.008 1
1 955 . 9 1 1 A 75 75 ARG C C 75 176.812 175.934 0.878 1
1 956 . 9 1 1 A 75 75 ARG CA C 75 56.646 56.110 0.536 1
1 957 . 9 1 1 A 75 75 ARG CB C 75 29.375 30.758 -1.383 1
1 960 . 9 1 1 A 75 75 ARG N N 75 122.871 123.650 -0.779 1
1 961 . 9 1 1 A 76 76 VAL H H 76 7.965 9.154 -1.189 1
1 962 . 9 1 1 A 76 76 VAL HA H 76 5.230 5.014 0.216 1
1 970 . 9 1 1 A 76 76 VAL C C 76 173.758 174.578 -0.820 1
1 971 . 9 1 1 A 76 76 VAL CA C 76 58.193 59.069 -0.876 1
1 972 . 9 1 1 A 76 76 VAL CB C 76 36.536 34.970 1.566 1
1 975 . 9 1 1 A 76 76 VAL N N 76 116.220 118.643 -2.423 1
1 976 . 9 1 1 A 77 77 GLU H H 77 9.166 9.232 -0.066 1
1 977 . 9 1 1 A 77 77 GLU HA H 77 4.663 5.032 -0.369 1
1 982 . 9 1 1 A 77 77 GLU C C 77 174.940 174.617 0.323 1
1 983 . 9 1 1 A 77 77 GLU CA C 77 53.546 54.391 -0.845 1
1 984 . 9 1 1 A 77 77 GLU CB C 77 33.395 33.611 -0.216 1
1 986 . 9 1 1 A 77 77 GLU N N 77 116.413 120.587 -4.174 1
1 987 . 9 1 1 A 78 78 LEU H H 78 8.670 8.970 -0.300 1
1 988 . 9 1 1 A 78 78 LEU HA H 78 4.677 5.005 -0.328 1
1 998 . 9 1 1 A 78 78 LEU C C 78 176.036 176.164 -0.128 1
1 999 . 9 1 1 A 78 78 LEU CA C 78 53.091 53.596 -0.505 1
1 1000 . 9 1 1 A 78 78 LEU CB C 78 43.276 44.211 -0.935 1
1 1004 . 9 1 1 A 78 78 LEU N N 78 117.927 124.077 -6.150 1
1 1005 . 9 1 1 A 79 79 ILE H H 79 7.900 8.921 -1.021 1
1 1006 . 9 1 1 A 79 79 ILE HA H 79 4.312 4.404 -0.092 1
1 1016 . 9 1 1 A 79 79 ILE C C 79 175.179 175.867 -0.688 1
1 1017 . 9 1 1 A 79 79 ILE CA C 79 58.294 60.233 -1.939 1
1 1018 . 9 1 1 A 79 79 ILE CB C 79 36.086 37.204 -1.118 1
1 1022 . 9 1 1 A 79 79 ILE N N 79 121.667 124.360 -2.693 1
1 1023 . 9 1 1 A 80 80 ASN H H 80 9.412 9.031 0.381 1
1 1024 . 9 1 1 A 80 80 ASN HA H 80 4.516 4.304 0.212 1
1 1029 . 9 1 1 A 80 80 ASN C C 80 170.300 173.267 -2.967 1
1 1030 . 9 1 1 A 80 80 ASN CA C 80 54.198 53.867 0.331 1
1 1031 . 9 1 1 A 80 80 ASN CB C 80 37.450 37.195 0.255 1
1 1033 . 9 1 1 A 80 80 ASN N N 80 123.831 123.205 0.626 1
1 1035 . 9 1 1 A 81 81 PRO HA H 81 5.185 4.868 0.317 1
1 1042 . 9 1 1 A 81 81 PRO C C 81 176.865 176.383 0.482 1
1 1043 . 9 1 1 A 81 81 PRO CA C 81 62.637 62.532 0.105 1
1 1044 . 9 1 1 A 81 81 PRO CB C 81 32.965 32.615 0.350 1
1 1047 . 9 1 1 A 82 82 ILE H H 82 9.374 8.662 0.712 1
1 1048 . 9 1 1 A 82 82 ILE HA H 82 4.524 4.990 -0.466 1
1 1058 . 9 1 1 A 82 82 ILE C C 82 174.731 173.957 0.774 1
1 1059 . 9 1 1 A 82 82 ILE CA C 82 60.205 58.725 1.480 1
1 1060 . 9 1 1 A 82 82 ILE CB C 82 41.737 41.989 -0.252 1
1 1064 . 9 1 1 A 82 82 ILE N N 82 121.658 117.073 4.585 1
1 1065 . 9 1 1 A 83 83 ALA H H 83 8.819 8.735 0.084 1
1 1066 . 9 1 1 A 83 83 ALA HA H 83 4.773 4.863 -0.090 1
1 1070 . 9 1 1 A 83 83 ALA C C 83 176.550 176.862 -0.312 1
1 1071 . 9 1 1 A 83 83 ALA CA C 83 52.069 51.359 0.710 1
1 1072 . 9 1 1 A 83 83 ALA CB C 83 20.374 19.695 0.679 1
1 1073 . 9 1 1 A 83 83 ALA N N 83 127.933 126.001 1.932 1
1 1074 . 9 1 1 A 84 84 ASP H H 84 8.710 8.774 -0.064 1
1 1075 . 9 1 1 A 84 84 ASP HA H 84 4.894 4.861 0.033 1
1 1078 . 9 1 1 A 84 84 ASP C C 84 175.997 175.825 0.172 1
1 1079 . 9 1 1 A 84 84 ASP CA C 84 53.334 54.107 -0.773 1
1 1080 . 9 1 1 A 84 84 ASP CB C 84 42.104 42.236 -0.132 1
1 1081 . 9 1 1 A 84 84 ASP N N 84 122.009 124.584 -2.575 1
1 1082 . 9 1 1 A 85 85 THR H H 85 8.349 8.646 -0.297 1
1 1083 . 9 1 1 A 85 85 THR HA H 85 4.420 4.584 -0.164 1
1 1088 . 9 1 1 A 85 85 THR C C 85 175.085 175.816 -0.731 1
1 1089 . 9 1 1 A 85 85 THR CA C 85 62.304 61.949 0.355 1
1 1090 . 9 1 1 A 85 85 THR CB C 85 69.718 71.098 -1.380 1
1 1092 . 9 1 1 A 85 85 THR N N 85 114.986 118.020 -3.034 1
1 1093 . 9 1 1 A 86 86 VAL H H 86 8.188 8.246 -0.058 1
1 1094 . 9 1 1 A 86 86 VAL HA H 86 4.021 3.897 0.124 1
1 1102 . 9 1 1 A 86 86 VAL C C 86 176.519 177.568 -1.049 1
1 1103 . 9 1 1 A 86 86 VAL CA C 86 63.046 64.857 -1.811 1
1 1104 . 9 1 1 A 86 86 VAL CB C 86 32.526 31.292 1.234 1
1 1107 . 9 1 1 A 86 86 VAL N N 86 122.275 119.438 2.837 1
1 1108 . 9 1 1 A 87 87 ALA H H 87 8.194 8.219 -0.025 1
1 1109 . 9 1 1 A 87 87 ALA HA H 87 4.212 4.140 0.072 1
1 1113 . 9 1 1 A 87 87 ALA C C 87 178.118 179.953 -1.835 1
1 1114 . 9 1 1 A 87 87 ALA CA C 87 53.153 55.455 -2.302 1
1 1115 . 9 1 1 A 87 87 ALA CB C 87 19.165 18.390 0.775 1
1 1116 . 9 1 1 A 87 87 ALA N N 87 126.609 124.574 2.035 1
1 1117 . 9 1 1 A 88 88 THR H H 88 7.914 7.882 0.032 1
1 1118 . 9 1 1 A 88 88 THR HA H 88 4.173 4.308 -0.135 1
1 1123 . 9 1 1 A 88 88 THR C C 88 174.516 177.039 -2.523 1
1 1124 . 9 1 1 A 88 88 THR CA C 88 62.785 64.242 -1.457 1
1 1125 . 9 1 1 A 88 88 THR CB C 88 69.582 68.528 1.054 1
1 1127 . 9 1 1 A 88 88 THR N N 88 112.328 111.471 0.857 1
1 1128 . 9 1 1 A 89 89 ALA H H 89 8.076 7.713 0.363 1
1 1129 . 9 1 1 A 89 89 ALA HA H 89 4.320 4.143 0.177 1
1 1133 . 9 1 1 A 89 89 ALA C C 89 178.014 179.819 -1.805 1
1 1134 . 9 1 1 A 89 89 ALA CA C 89 53.079 55.215 -2.136 1
1 1135 . 9 1 1 A 89 89 ALA CB C 89 19.335 18.499 0.836 1
1 1136 . 9 1 1 A 89 89 ALA N N 89 124.632 125.513 -0.881 1
1 1137 . 9 1 1 A 90 90 THR H H 90 7.976 7.639 0.337 1
1 1138 . 9 1 1 A 90 90 THR HA H 90 4.203 4.268 -0.065 1
1 1143 . 9 1 1 A 90 90 THR C C 90 174.427 174.804 -0.377 1
1 1144 . 9 1 1 A 90 90 THR CA C 90 62.519 64.822 -2.303 1
1 1145 . 9 1 1 A 90 90 THR CB C 90 69.721 68.906 0.815 1
1 1147 . 9 1 1 A 90 90 THR N N 90 112.047 108.132 3.915 1
1 1148 . 9 1 1 A 91 91 TYR H H 91 7.959 7.719 0.240 1
1 1149 . 9 1 1 A 91 91 TYR HA H 91 4.564 4.585 -0.021 1
1 1156 . 9 1 1 A 91 91 TYR C C 91 175.522 175.754 -0.232 1
1 1157 . 9 1 1 A 91 91 TYR CA C 91 57.874 58.377 -0.503 1
1 1158 . 9 1 1 A 91 91 TYR CB C 91 38.584 39.460 -0.876 1
1 1163 . 9 1 1 A 91 91 TYR N N 91 121.184 121.917 -0.733 1
1 1164 . 9 1 1 A 92 92 GLN H H 92 8.310 8.911 -0.601 1
1 1165 . 9 1 1 A 92 92 GLN HA H 92 4.258 4.488 -0.230 1
1 1172 . 9 1 1 A 92 92 GLN C C 92 176.099 175.971 0.128 1
1 1173 . 9 1 1 A 92 92 GLN CA C 92 56.109 55.408 0.701 1
1 1174 . 9 1 1 A 92 92 GLN CB C 92 29.112 29.004 0.108 1
1 1177 . 9 1 1 A 92 92 GLN N N 92 121.631 122.795 -1.164 1
1 1179 . 9 1 1 A 93 93 GLY H H 93 8.052 7.989 0.063 1
1 1180 . 9 1 1 A 93 93 GLY HA2 H 93 4.023 3.985 0.038 1
1 1181 . 9 1 1 A 93 93 GLY HA3 H 93 3.856 3.995 -0.139 1
1 1182 . 9 1 1 A 93 93 GLY C C 93 173.791 174.831 -1.040 1
1 1183 . 9 1 1 A 93 93 GLY CA C 93 45.382 46.815 -1.433 1
1 1184 . 9 1 1 A 93 93 GLY N N 93 109.847 108.591 1.256 1
1 1185 . 9 1 1 A 94 94 ALA H H 94 8.162 8.237 -0.075 1
1 1186 . 9 1 1 A 94 94 ALA HA H 94 4.329 4.307 0.022 1
1 1190 . 9 1 1 A 94 94 ALA C C 94 177.392 176.595 0.797 1
1 1191 . 9 1 1 A 94 94 ALA CA C 94 52.558 54.298 -1.740 1
1 1192 . 9 1 1 A 94 94 ALA CB C 94 19.526 19.766 -0.240 1
1 1193 . 9 1 1 A 94 94 ALA N N 94 123.424 121.039 2.385 1
1 1194 . 9 1 1 A 95 95 ASP H H 95 8.457 8.296 0.161 1
1 1195 . 9 1 1 A 95 95 ASP HA H 95 4.608 5.118 -0.510 1
1 1198 . 9 1 1 A 95 95 ASP C C 95 175.630 175.655 -0.025 1
1 1199 . 9 1 1 A 95 95 ASP CA C 95 54.450 52.616 1.834 1
1 1200 . 9 1 1 A 95 95 ASP CB C 95 40.871 43.842 -2.971 1
1 1201 . 9 1 1 A 95 95 ASP N N 95 118.814 117.413 1.401 1
1 1202 . 9 1 1 A 96 96 VAL H H 96 7.776 8.305 -0.529 1
1 1203 . 9 1 1 A 96 96 VAL HA H 96 4.141 4.450 -0.309 1
1 1211 . 9 1 1 A 96 96 VAL C C 96 175.301 175.737 -0.436 1
1 1212 . 9 1 1 A 96 96 VAL CA C 96 61.435 60.652 0.783 1
1 1213 . 9 1 1 A 96 96 VAL CB C 96 33.517 31.714 1.803 1
1 1216 . 9 1 1 A 96 96 VAL N N 96 118.395 120.748 -2.353 1
1 1217 . 9 1 1 A 97 97 ASP H H 97 8.315 7.177 1.138 1
1 1218 . 9 1 1 A 97 97 ASP HA H 97 4.681 4.635 0.046 1
1 1221 . 9 1 1 A 97 97 ASP C C 97 175.151 175.260 -0.109 1
1 1222 . 9 1 1 A 97 97 ASP CA C 97 54.324 53.803 0.521 1
1 1223 . 9 1 1 A 97 97 ASP CB C 97 41.963 40.742 1.221 1
1 1224 . 9 1 1 A 97 97 ASP N N 97 123.905 123.154 0.751 1
1 1225 . 9 1 1 A 98 98 TRP H H 98 8.210 9.083 -0.873 1
1 1226 . 9 1 1 A 98 98 TRP HA H 98 4.916 5.828 -0.912 1
1 1235 . 9 1 1 A 98 98 TRP C C 98 174.585 173.962 0.623 1
1 1236 . 9 1 1 A 98 98 TRP CA C 98 56.164 54.191 1.973 1
1 1237 . 9 1 1 A 98 98 TRP CB C 98 31.466 32.963 -1.497 1
1 1243 . 9 1 1 A 98 98 TRP N N 98 120.340 124.944 -4.604 1
1 1245 . 9 1 1 A 99 99 TYR H H 99 8.760 9.084 -0.324 1
1 1246 . 9 1 1 A 99 99 TYR HA H 99 5.119 5.444 -0.325 1
1 1253 . 9 1 1 A 99 99 TYR C C 99 174.599 174.516 0.083 1
1 1254 . 9 1 1 A 99 99 TYR CA C 99 57.021 56.086 0.935 1
1 1255 . 9 1 1 A 99 99 TYR CB C 99 39.526 41.097 -1.571 1
1 1260 . 9 1 1 A 99 99 TYR N N 99 123.319 118.262 5.057 1
1 1261 . 9 1 1 A 100 100 ILE H H 100 8.936 9.240 -0.304 1
1 1262 . 9 1 1 A 100 100 ILE HA H 100 4.850 4.733 0.117 1
1 1272 . 9 1 1 A 100 100 ILE C C 100 175.070 175.009 0.061 1
1 1273 . 9 1 1 A 100 100 ILE CA C 100 58.998 60.115 -1.117 1
1 1274 . 9 1 1 A 100 100 ILE CB C 100 40.667 38.129 2.538 1
1 1278 . 9 1 1 A 100 100 ILE N N 100 123.281 124.008 -0.727 1
1 1279 . 9 1 1 A 101 101 LYS H H 101 8.987 9.057 -0.070 1
1 1280 . 9 1 1 A 101 101 LYS HA H 101 5.313 5.138 0.175 1
1 1289 . 9 1 1 A 101 101 LYS C C 101 174.440 175.621 -1.181 1
1 1290 . 9 1 1 A 101 101 LYS CA C 101 54.763 55.356 -0.593 1
1 1291 . 9 1 1 A 101 101 LYS CB C 101 34.880 34.248 0.632 1
1 1295 . 9 1 1 A 101 101 LYS N N 101 126.210 127.415 -1.205 1
1 1296 . 9 1 1 A 102 102 ALA H H 102 8.531 8.173 0.358 1
1 1297 . 9 1 1 A 102 102 ALA HA H 102 4.957 4.755 0.202 1
1 1301 . 9 1 1 A 102 102 ALA C C 102 175.024 177.561 -2.537 1
1 1302 . 9 1 1 A 102 102 ALA CA C 102 50.701 50.371 0.330 1
1 1303 . 9 1 1 A 102 102 ALA CB C 102 21.618 22.808 -1.190 1
1 1304 . 9 1 1 A 102 102 ALA N N 102 121.424 126.031 -4.607 1
1 1305 . 9 1 1 A 103 103 ASP H H 103 8.339 9.375 -1.036 1
1 1306 . 9 1 1 A 103 103 ASP HA H 103 4.603 4.507 0.096 1
1 1309 . 9 1 1 A 103 103 ASP C C 103 176.188 175.381 0.807 1
1 1310 . 9 1 1 A 103 103 ASP CA C 103 56.049 56.375 -0.326 1
1 1311 . 9 1 1 A 103 103 ASP CB C 103 40.932 41.691 -0.759 1
1 1312 . 9 1 1 A 103 103 ASP N N 103 117.773 118.113 -0.340 1
1 1313 . 9 1 1 A 104 104 ASP H H 104 7.482 7.765 -0.283 1
1 1314 . 9 1 1 A 104 104 ASP HA H 104 4.727 4.993 -0.266 1
1 1317 . 9 1 1 A 104 104 ASP C C 104 174.261 173.753 0.508 1
1 1318 . 9 1 1 A 104 104 ASP CA C 104 52.768 53.694 -0.926 1
1 1319 . 9 1 1 A 104 104 ASP CB C 104 42.587 43.852 -1.265 1
1 1320 . 9 1 1 A 104 104 ASP N N 104 110.673 116.769 -6.096 1
1 1321 . 9 1 1 A 105 105 ILE H H 105 9.267 8.734 0.533 1
1 1322 . 9 1 1 A 105 105 ILE HA H 105 4.631 4.877 -0.246 1
1 1332 . 9 1 1 A 105 105 ILE C C 105 173.922 175.373 -1.451 1
1 1333 . 9 1 1 A 105 105 ILE CA C 105 61.114 60.364 0.750 1
1 1334 . 9 1 1 A 105 105 ILE CB C 105 42.522 39.958 2.564 1
1 1338 . 9 1 1 A 105 105 ILE N N 105 121.380 122.709 -1.329 1
1 1339 . 9 1 1 A 106 106 VAL H H 106 8.592 8.956 -0.364 1
1 1340 . 9 1 1 A 106 106 VAL HA H 106 4.975 5.044 -0.069 1
1 1348 . 9 1 1 A 106 106 VAL C C 106 175.049 175.147 -0.098 1
1 1349 . 9 1 1 A 106 106 VAL CA C 106 58.028 59.916 -1.888 1
1 1350 . 9 1 1 A 106 106 VAL CB C 106 35.388 35.702 -0.314 1
1 1353 . 9 1 1 A 106 106 VAL N N 106 116.356 121.111 -4.755 1
1 1354 . 9 1 1 A 107 107 LEU H H 107 8.360 8.519 -0.159 1
1 1355 . 9 1 1 A 107 107 LEU HA H 107 4.167 4.430 -0.263 1
1 1365 . 9 1 1 A 107 107 LEU C C 107 178.338 177.300 1.038 1
1 1366 . 9 1 1 A 107 107 LEU CA C 107 55.077 54.008 1.069 1
1 1367 . 9 1 1 A 107 107 LEU CB C 107 42.394 42.225 0.169 1
1 1371 . 9 1 1 A 107 107 LEU N N 107 121.368 122.176 -0.808 1
1 1372 . 9 1 1 A 108 108 THR H H 108 7.977 8.786 -0.809 1
1 1373 . 9 1 1 A 108 108 THR HA H 108 4.039 4.547 -0.508 1
1 1378 . 9 1 1 A 108 108 THR C C 108 174.725 174.862 -0.137 1
1 1379 . 9 1 1 A 108 108 THR CA C 108 63.513 63.486 0.027 1
1 1380 . 9 1 1 A 108 108 THR CB C 108 69.194 68.458 0.736 1
1 1382 . 9 1 1 A 108 108 THR N N 108 118.728 119.182 -0.454 1
1 1383 . 9 1 1 A 109 109 LEU H H 109 8.378 8.597 -0.219 1
1 1384 . 9 1 1 A 109 109 LEU HA H 109 4.274 4.473 -0.199 1
1 1394 . 9 1 1 A 109 109 LEU C C 109 177.058 176.159 0.899 1
1 1395 . 9 1 1 A 109 109 LEU CA C 109 55.045 54.495 0.550 1
1 1396 . 9 1 1 A 109 109 LEU CB C 109 42.620 41.405 1.215 1
1 1400 . 9 1 1 A 109 109 LEU N N 109 124.847 126.807 -1.960 1
1 9 . 10 1 1 A 2 2 MET HA H 2 4.554 4.924 -0.370 1
1 14 . 10 1 1 A 2 2 MET C C 2 174.749 174.156 0.593 1
1 15 . 10 1 1 A 2 2 MET CA C 2 55.354 53.574 1.780 1
1 16 . 10 1 1 A 2 2 MET CB C 2 33.729 34.365 -0.636 1
1 18 . 10 1 1 A 3 3 ARG H H 3 8.518 8.936 -0.418 1
1 19 . 10 1 1 A 3 3 ARG HA H 3 4.531 4.676 -0.145 1
1 26 . 10 1 1 A 3 3 ARG C C 3 175.780 175.217 0.563 1
1 27 . 10 1 1 A 3 3 ARG CA C 3 55.854 55.242 0.612 1
1 28 . 10 1 1 A 3 3 ARG CB C 3 31.403 30.091 1.312 1
1 31 . 10 1 1 A 3 3 ARG N N 3 124.008 125.931 -1.923 1
1 32 . 10 1 1 A 4 4 LEU H H 4 8.424 8.152 0.272 1
1 33 . 10 1 1 A 4 4 LEU HA H 4 4.457 5.166 -0.709 1
1 43 . 10 1 1 A 4 4 LEU C C 4 177.362 174.981 2.381 1
1 44 . 10 1 1 A 4 4 LEU CA C 4 54.511 53.606 0.905 1
1 45 . 10 1 1 A 4 4 LEU CB C 4 42.686 45.607 -2.921 1
1 49 . 10 1 1 A 4 4 LEU N N 4 124.389 122.458 1.931 1
1 50 . 10 1 1 A 5 5 ALA H H 5 8.418 8.445 -0.027 1
1 51 . 10 1 1 A 5 5 ALA HA H 5 4.254 4.972 -0.718 1
1 55 . 10 1 1 A 5 5 ALA C C 5 177.420 175.475 1.945 1
1 56 . 10 1 1 A 5 5 ALA CA C 5 52.931 52.082 0.849 1
1 57 . 10 1 1 A 5 5 ALA CB C 5 19.263 20.638 -1.375 1
1 58 . 10 1 1 A 5 5 ALA N N 5 124.548 120.379 4.169 1
1 59 . 10 1 1 A 6 6 ASN H H 6 8.287 8.809 -0.522 1
1 60 . 10 1 1 A 6 6 ASN HA H 6 4.616 5.312 -0.696 1
1 65 . 10 1 1 A 6 6 ASN C C 6 175.837 174.518 1.319 1
1 66 . 10 1 1 A 6 6 ASN CA C 6 53.345 51.960 1.385 1
1 67 . 10 1 1 A 6 6 ASN CB C 6 38.571 42.364 -3.793 1
1 69 . 10 1 1 A 6 6 ASN N N 6 116.484 120.286 -3.802 1
1 71 . 10 1 1 A 7 7 GLY H H 7 8.351 8.297 0.054 1
1 72 . 10 1 1 A 7 7 GLY HA2 H 7 4.130 4.139 -0.009 1
1 73 . 10 1 1 A 7 7 GLY HA3 H 7 3.808 4.140 -0.332 1
1 74 . 10 1 1 A 7 7 GLY C C 7 173.750 173.960 -0.210 1
1 75 . 10 1 1 A 7 7 GLY CA C 7 45.343 45.476 -0.133 1
1 76 . 10 1 1 A 7 7 GLY N N 7 108.453 107.652 0.801 1
1 77 . 10 1 1 A 8 8 ILE H H 8 7.868 7.463 0.405 1
1 78 . 10 1 1 A 8 8 ILE HA H 8 4.130 4.351 -0.221 1
1 88 . 10 1 1 A 8 8 ILE C C 8 175.570 175.574 -0.004 1
1 89 . 10 1 1 A 8 8 ILE CA C 8 61.095 59.953 1.142 1
1 90 . 10 1 1 A 8 8 ILE CB C 8 38.694 39.748 -1.054 1
1 94 . 10 1 1 A 8 8 ILE N N 8 120.848 118.489 2.359 1
1 95 . 10 1 1 A 9 9 VAL H H 9 8.220 8.887 -0.667 1
1 96 . 10 1 1 A 9 9 VAL HA H 9 4.172 4.142 0.030 1
1 104 . 10 1 1 A 9 9 VAL C C 9 175.898 176.526 -0.628 1
1 105 . 10 1 1 A 9 9 VAL CA C 9 62.488 62.713 -0.225 1
1 106 . 10 1 1 A 9 9 VAL CB C 9 32.460 30.777 1.683 1
1 109 . 10 1 1 A 9 9 VAL N N 9 125.805 122.629 3.176 1
1 110 . 10 1 1 A 10 10 LEU H H 10 8.437 8.408 0.029 1
1 111 . 10 1 1 A 10 10 LEU HA H 10 4.347 4.289 0.058 1
1 121 . 10 1 1 A 10 10 LEU C C 10 176.398 177.056 -0.658 1
1 122 . 10 1 1 A 10 10 LEU CA C 10 54.787 57.165 -2.378 1
1 123 . 10 1 1 A 10 10 LEU CB C 10 42.639 42.046 0.593 1
1 127 . 10 1 1 A 10 10 LEU N N 10 127.757 125.102 2.655 1
1 128 . 10 1 1 A 11 11 ASP H H 11 8.506 7.874 0.632 1
1 129 . 10 1 1 A 11 11 ASP HA H 11 4.683 4.816 -0.133 1
1 132 . 10 1 1 A 11 11 ASP C C 11 176.672 175.805 0.867 1
1 133 . 10 1 1 A 11 11 ASP CA C 11 53.586 52.932 0.654 1
1 134 . 10 1 1 A 11 11 ASP CB C 11 41.123 42.438 -1.315 1
1 135 . 10 1 1 A 11 11 ASP N N 11 121.539 119.462 2.077 1
1 136 . 10 1 1 A 12 12 LYS H H 12 8.578 8.552 0.026 1
1 137 . 10 1 1 A 12 12 LYS HA H 12 3.943 4.471 -0.528 1
1 146 . 10 1 1 A 12 12 LYS C C 12 176.917 176.543 0.374 1
1 147 . 10 1 1 A 12 12 LYS CA C 12 58.542 56.494 2.048 1
1 148 . 10 1 1 A 12 12 LYS CB C 12 32.703 34.204 -1.501 1
1 152 . 10 1 1 A 12 12 LYS N N 12 123.635 119.243 4.392 1
1 153 . 10 1 1 A 13 13 ASP H H 13 8.523 7.853 0.670 1
1 154 . 10 1 1 A 13 13 ASP HA H 13 4.566 4.571 -0.005 1
1 157 . 10 1 1 A 13 13 ASP C C 13 177.535 177.055 0.480 1
1 158 . 10 1 1 A 13 13 ASP CA C 13 56.034 53.713 2.321 1
1 159 . 10 1 1 A 13 13 ASP CB C 13 41.051 40.596 0.455 1
1 160 . 10 1 1 A 13 13 ASP N N 13 120.448 119.270 1.178 1
1 161 . 10 1 1 A 14 14 THR H H 14 7.964 7.938 0.026 1
1 162 . 10 1 1 A 14 14 THR HA H 14 4.146 4.312 -0.166 1
1 167 . 10 1 1 A 14 14 THR C C 14 175.440 174.555 0.885 1
1 168 . 10 1 1 A 14 14 THR CA C 14 63.245 61.871 1.374 1
1 169 . 10 1 1 A 14 14 THR CB C 14 69.092 69.017 0.075 1
1 171 . 10 1 1 A 14 14 THR N N 14 113.711 116.919 -3.208 1
1 172 . 10 1 1 A 15 15 THR H H 15 7.921 7.504 0.417 1
1 173 . 10 1 1 A 15 15 THR HA H 15 3.920 3.915 0.005 1
1 178 . 10 1 1 A 15 15 THR C C 15 174.750 174.611 0.139 1
1 179 . 10 1 1 A 15 15 THR CA C 15 64.562 63.250 1.312 1
1 180 . 10 1 1 A 15 15 THR CB C 15 69.166 69.555 -0.389 1
1 182 . 10 1 1 A 15 15 THR N N 15 116.710 118.867 -2.157 1
1 183 . 10 1 1 A 16 16 PHE H H 16 8.191 8.441 -0.250 1
1 184 . 10 1 1 A 16 16 PHE HA H 16 4.628 4.562 0.066 1
1 192 . 10 1 1 A 16 16 PHE C C 16 177.754 175.881 1.873 1
1 193 . 10 1 1 A 16 16 PHE CA C 16 57.975 58.122 -0.147 1
1 194 . 10 1 1 A 16 16 PHE CB C 16 39.553 39.126 0.427 1
1 200 . 10 1 1 A 16 16 PHE N N 16 117.124 125.607 -8.483 1
1 201 . 10 1 1 A 17 17 GLY H H 17 8.110 8.008 0.102 1
1 202 . 10 1 1 A 17 17 GLY HA2 H 17 4.017 3.887 0.130 1
1 203 . 10 1 1 A 17 17 GLY HA3 H 17 3.849 3.910 -0.061 1
1 204 . 10 1 1 A 17 17 GLY C C 17 172.231 173.782 -1.551 1
1 205 . 10 1 1 A 17 17 GLY CA C 17 45.633 47.294 -1.661 1
1 206 . 10 1 1 A 17 17 GLY N N 17 109.951 107.207 2.744 1
1 207 . 10 1 1 A 18 18 GLU H H 18 8.304 8.408 -0.104 1
1 208 . 10 1 1 A 18 18 GLU HA H 18 4.078 4.964 -0.886 1
1 213 . 10 1 1 A 18 18 GLU C C 18 175.588 175.363 0.225 1
1 214 . 10 1 1 A 18 18 GLU CA C 18 57.446 55.564 1.882 1
1 215 . 10 1 1 A 18 18 GLU CB C 18 30.767 31.236 -0.469 1
1 217 . 10 1 1 A 18 18 GLU N N 18 121.640 123.441 -1.801 1
1 218 . 10 1 1 A 19 19 LEU H H 19 8.799 8.805 -0.006 1
1 219 . 10 1 1 A 19 19 LEU HA H 19 5.416 4.875 0.541 1
1 229 . 10 1 1 A 19 19 LEU C C 19 176.875 175.941 0.934 1
1 230 . 10 1 1 A 19 19 LEU CA C 19 53.281 53.563 -0.282 1
1 231 . 10 1 1 A 19 19 LEU CB C 19 45.508 43.079 2.429 1
1 235 . 10 1 1 A 19 19 LEU N N 19 127.101 125.801 1.300 1
1 236 . 10 1 1 A 20 20 LYS H H 20 8.494 8.710 -0.216 1
1 237 . 10 1 1 A 20 20 LYS HA H 20 5.200 5.175 0.025 1
1 246 . 10 1 1 A 20 20 LYS C C 20 176.163 175.698 0.465 1
1 247 . 10 1 1 A 20 20 LYS CA C 20 53.575 55.084 -1.509 1
1 248 . 10 1 1 A 20 20 LYS CB C 20 36.835 33.245 3.590 1
1 252 . 10 1 1 A 20 20 LYS N N 20 118.828 124.790 -5.962 1
1 253 . 10 1 1 A 21 21 PHE H H 21 9.658 9.081 0.577 1
1 254 . 10 1 1 A 21 21 PHE HA H 21 4.038 4.525 -0.487 1
1 262 . 10 1 1 A 21 21 PHE C C 21 174.296 175.085 -0.789 1
1 263 . 10 1 1 A 21 21 PHE CA C 21 60.462 59.342 1.120 1
1 264 . 10 1 1 A 21 21 PHE CB C 21 40.359 39.816 0.543 1
1 270 . 10 1 1 A 21 21 PHE N N 21 124.322 126.893 -2.571 1
1 271 . 10 1 1 A 22 22 SER H H 22 7.199 8.211 -1.012 1
1 272 . 10 1 1 A 22 22 SER HA H 22 5.046 4.501 0.545 1
1 275 . 10 1 1 A 22 22 SER C C 22 173.080 173.406 -0.326 1
1 276 . 10 1 1 A 22 22 SER CA C 22 58.547 59.819 -1.272 1
1 277 . 10 1 1 A 22 22 SER CB C 22 63.591 65.168 -1.577 1
1 278 . 10 1 1 A 22 22 SER N N 22 120.109 121.397 -1.288 1
1 279 . 10 1 1 A 23 23 ALA H H 23 7.269 6.643 0.626 1
1 280 . 10 1 1 A 23 23 ALA HA H 23 4.426 4.574 -0.148 1
1 284 . 10 1 1 A 23 23 ALA C C 23 176.568 174.444 2.124 1
1 285 . 10 1 1 A 23 23 ALA CA C 23 52.458 51.398 1.060 1
1 286 . 10 1 1 A 23 23 ALA CB C 23 22.728 22.256 0.472 1
1 287 . 10 1 1 A 23 23 ALA N N 23 114.102 119.274 -5.172 1
1 288 . 10 1 1 A 24 24 LEU H H 24 8.819 8.558 0.261 1
1 289 . 10 1 1 A 24 24 LEU HA H 24 4.060 4.348 -0.288 1
1 299 . 10 1 1 A 24 24 LEU C C 24 175.363 176.309 -0.946 1
1 300 . 10 1 1 A 24 24 LEU CA C 24 56.901 54.326 2.575 1
1 301 . 10 1 1 A 24 24 LEU CB C 24 42.065 42.151 -0.086 1
1 305 . 10 1 1 A 24 24 LEU N N 24 120.865 120.813 0.052 1
1 306 . 10 1 1 A 25 25 ARG H H 25 9.473 8.796 0.677 1
1 307 . 10 1 1 A 25 25 ARG HA H 25 4.428 4.095 0.333 1
1 315 . 10 1 1 A 25 25 ARG C C 25 175.729 175.739 -0.010 1
1 316 . 10 1 1 A 25 25 ARG CA C 25 56.721 58.309 -1.588 1
1 317 . 10 1 1 A 25 25 ARG CB C 25 31.109 31.228 -0.119 1
1 320 . 10 1 1 A 25 25 ARG N N 25 130.455 127.520 2.935 1
1 322 . 10 1 1 A 26 26 ARG H H 26 7.711 7.226 0.485 1
1 323 . 10 1 1 A 26 26 ARG HA H 26 4.559 4.574 -0.015 1
1 330 . 10 1 1 A 26 26 ARG C C 26 173.724 173.663 0.061 1
1 331 . 10 1 1 A 26 26 ARG CA C 26 55.737 55.838 -0.101 1
1 332 . 10 1 1 A 26 26 ARG CB C 26 33.261 33.939 -0.678 1
1 335 . 10 1 1 A 26 26 ARG N N 26 113.305 118.362 -5.057 1
1 336 . 10 1 1 A 27 27 GLU H H 27 8.848 8.646 0.202 1
1 337 . 10 1 1 A 27 27 GLU HA H 27 4.615 4.664 -0.049 1
1 342 . 10 1 1 A 27 27 GLU C C 27 174.836 176.183 -1.347 1
1 343 . 10 1 1 A 27 27 GLU CA C 27 55.901 55.548 0.353 1
1 344 . 10 1 1 A 27 27 GLU CB C 27 30.755 30.052 0.703 1
1 346 . 10 1 1 A 27 27 GLU N N 27 121.934 125.092 -3.158 1
1 347 . 10 1 1 A 28 28 VAL H H 28 8.603 8.419 0.184 1
1 348 . 10 1 1 A 28 28 VAL HA H 28 4.013 4.113 -0.100 1
1 356 . 10 1 1 A 28 28 VAL C C 28 175.561 176.054 -0.493 1
1 357 . 10 1 1 A 28 28 VAL CA C 28 62.791 62.066 0.725 1
1 358 . 10 1 1 A 28 28 VAL CB C 28 32.710 32.280 0.430 1
1 361 . 10 1 1 A 28 28 VAL N N 28 125.545 122.596 2.949 1
1 362 . 10 1 1 A 29 29 ARG H H 29 8.735 8.578 0.157 1
1 363 . 10 1 1 A 29 29 ARG HA H 29 4.774 4.708 0.066 1
1 370 . 10 1 1 A 29 29 ARG C C 29 176.580 176.299 0.281 1
1 371 . 10 1 1 A 29 29 ARG CA C 29 55.481 54.314 1.167 1
1 372 . 10 1 1 A 29 29 ARG CB C 29 31.963 32.624 -0.661 1
1 375 . 10 1 1 A 29 29 ARG N N 29 128.327 125.354 2.973 1
1 376 . 10 1 1 A 30 30 ILE H H 30 8.358 8.638 -0.280 1
1 377 . 10 1 1 A 30 30 ILE HA H 30 3.882 4.059 -0.177 1
1 387 . 10 1 1 A 30 30 ILE C C 30 175.093 175.154 -0.061 1
1 388 . 10 1 1 A 30 30 ILE CA C 30 61.669 61.639 0.030 1
1 389 . 10 1 1 A 30 30 ILE CB C 30 38.806 37.453 1.353 1
1 393 . 10 1 1 A 30 30 ILE N N 30 121.957 122.137 -0.180 1
1 394 . 10 1 1 A 31 31 GLN H H 31 8.560 8.807 -0.247 1
1 395 . 10 1 1 A 31 31 GLN HA H 31 4.647 4.977 -0.330 1
1 402 . 10 1 1 A 31 31 GLN C C 31 175.954 175.390 0.564 1
1 403 . 10 1 1 A 31 31 GLN CA C 31 54.833 54.398 0.435 1
1 404 . 10 1 1 A 31 31 GLN CB C 31 30.584 31.222 -0.638 1
1 407 . 10 1 1 A 31 31 GLN N N 31 126.348 128.033 -1.685 1
1 409 . 10 1 1 A 32 32 ASN H H 32 8.994 9.118 -0.124 1
1 410 . 10 1 1 A 32 32 ASN HA H 32 4.784 4.956 -0.172 1
1 415 . 10 1 1 A 32 32 ASN C C 32 177.296 177.204 0.092 1
1 416 . 10 1 1 A 32 32 ASN CA C 32 53.206 52.765 0.441 1
1 417 . 10 1 1 A 32 32 ASN CB C 32 39.472 39.385 0.087 1
1 419 . 10 1 1 A 32 32 ASN N N 32 122.834 124.534 -1.700 1
1 421 . 10 1 1 A 33 33 GLU H H 33 9.180 8.787 0.393 1
1 422 . 10 1 1 A 33 33 GLU HA H 33 4.063 3.962 0.101 1
1 427 . 10 1 1 A 33 33 GLU C C 33 176.787 178.569 -1.782 1
1 428 . 10 1 1 A 33 33 GLU CA C 33 59.347 59.650 -0.303 1
1 429 . 10 1 1 A 33 33 GLU CB C 33 29.294 29.281 0.013 1
1 431 . 10 1 1 A 33 33 GLU N N 33 122.736 121.598 1.138 1
1 432 . 10 1 1 A 34 34 ASP H H 34 7.969 7.878 0.091 1
1 433 . 10 1 1 A 34 34 ASP HA H 34 4.499 4.590 -0.091 1
1 436 . 10 1 1 A 34 34 ASP C C 34 177.111 176.293 0.818 1
1 437 . 10 1 1 A 34 34 ASP CA C 34 53.632 54.615 -0.983 1
1 438 . 10 1 1 A 34 34 ASP CB C 34 39.807 41.254 -1.447 1
1 439 . 10 1 1 A 34 34 ASP N N 34 115.921 117.151 -1.230 1
1 440 . 10 1 1 A 35 35 GLY H H 35 8.083 7.885 0.198 1
1 441 . 10 1 1 A 35 35 GLY HA2 H 35 4.366 4.019 0.347 1
1 442 . 10 1 1 A 35 35 GLY HA3 H 35 3.657 4.019 -0.362 1
1 443 . 10 1 1 A 35 35 GLY C C 35 174.584 174.572 0.012 1
1 444 . 10 1 1 A 35 35 GLY CA C 35 45.134 45.092 0.042 1
1 445 . 10 1 1 A 35 35 GLY N N 35 108.874 108.001 0.873 1
1 446 . 10 1 1 A 36 36 SER H H 36 8.274 7.592 0.682 1
1 447 . 10 1 1 A 36 36 SER HA H 36 4.389 4.447 -0.058 1
1 450 . 10 1 1 A 36 36 SER C C 36 173.284 173.792 -0.508 1
1 451 . 10 1 1 A 36 36 SER CA C 36 58.383 59.637 -1.254 1
1 452 . 10 1 1 A 36 36 SER CB C 36 64.576 63.671 0.905 1
1 453 . 10 1 1 A 36 36 SER N N 36 117.428 117.823 -0.395 1
1 454 . 10 1 1 A 37 37 VAL H H 37 8.508 8.683 -0.175 1
1 455 . 10 1 1 A 37 37 VAL HA H 37 4.346 4.421 -0.075 1
1 463 . 10 1 1 A 37 37 VAL C C 37 176.370 175.268 1.102 1
1 464 . 10 1 1 A 37 37 VAL CA C 37 62.410 61.118 1.292 1
1 465 . 10 1 1 A 37 37 VAL CB C 37 33.086 33.642 -0.556 1
1 468 . 10 1 1 A 37 37 VAL N N 37 119.189 126.422 -7.233 1
1 469 . 10 1 1 A 38 38 SER H H 38 8.461 9.063 -0.602 1
1 470 . 10 1 1 A 38 38 SER HA H 38 4.586 4.652 -0.066 1
1 473 . 10 1 1 A 38 38 SER C C 38 173.829 175.168 -1.339 1
1 474 . 10 1 1 A 38 38 SER CA C 38 57.618 57.800 -0.182 1
1 475 . 10 1 1 A 38 38 SER CB C 38 64.537 64.135 0.402 1
1 476 . 10 1 1 A 38 38 SER N N 38 121.629 121.231 0.398 1
1 477 . 10 1 1 A 39 39 ASP H H 39 8.512 8.731 -0.219 1
1 478 . 10 1 1 A 39 39 ASP HA H 39 4.606 4.592 0.014 1
1 481 . 10 1 1 A 39 39 ASP C C 39 176.557 176.763 -0.206 1
1 482 . 10 1 1 A 39 39 ASP CA C 39 54.833 55.745 -0.912 1
1 483 . 10 1 1 A 39 39 ASP CB C 39 41.123 41.160 -0.037 1
1 484 . 10 1 1 A 39 39 ASP N N 39 120.305 123.405 -3.100 1
1 485 . 10 1 1 A 40 40 GLU H H 40 8.311 7.708 0.603 1
1 486 . 10 1 1 A 40 40 GLU HA H 40 4.235 4.377 -0.142 1
1 491 . 10 1 1 A 40 40 GLU C C 40 175.327 176.011 -0.684 1
1 492 . 10 1 1 A 40 40 GLU CA C 40 56.215 56.541 -0.326 1
1 493 . 10 1 1 A 40 40 GLU CB C 40 30.788 30.357 0.431 1
1 495 . 10 1 1 A 40 40 GLU N N 40 120.680 118.869 1.811 1
1 496 . 10 1 1 A 41 41 ILE H H 41 8.465 8.875 -0.410 1
1 497 . 10 1 1 A 41 41 ILE HA H 41 4.127 4.436 -0.309 1
1 507 . 10 1 1 A 41 41 ILE C C 41 175.380 176.067 -0.687 1
1 508 . 10 1 1 A 41 41 ILE CA C 41 60.670 60.206 0.464 1
1 509 . 10 1 1 A 41 41 ILE CB C 41 38.805 39.317 -0.512 1
1 513 . 10 1 1 A 41 41 ILE N N 41 123.665 124.895 -1.230 1
1 514 . 10 1 1 A 42 42 LYS H H 42 9.556 9.406 0.150 1
1 515 . 10 1 1 A 42 42 LYS HA H 42 4.428 4.459 -0.031 1
1 524 . 10 1 1 A 42 42 LYS C C 42 177.277 175.434 1.843 1
1 525 . 10 1 1 A 42 42 LYS CA C 42 57.274 57.302 -0.028 1
1 526 . 10 1 1 A 42 42 LYS CB C 42 35.169 34.185 0.984 1
1 530 . 10 1 1 A 42 42 LYS N N 42 125.597 127.623 -2.026 1
1 531 . 10 1 1 A 43 43 GLU H H 43 7.809 7.362 0.447 1
1 532 . 10 1 1 A 43 43 GLU HA H 43 4.886 4.869 0.017 1
1 537 . 10 1 1 A 43 43 GLU C C 43 173.593 174.720 -1.127 1
1 538 . 10 1 1 A 43 43 GLU CA C 43 54.669 54.947 -0.278 1
1 539 . 10 1 1 A 43 43 GLU CB C 43 32.882 34.398 -1.516 1
1 541 . 10 1 1 A 43 43 GLU N N 43 115.292 116.171 -0.879 1
1 542 . 10 1 1 A 44 44 ARG H H 44 8.879 9.134 -0.255 1
1 543 . 10 1 1 A 44 44 ARG HA H 44 4.917 5.147 -0.230 1
1 551 . 10 1 1 A 44 44 ARG C C 44 173.708 174.866 -1.158 1
1 552 . 10 1 1 A 44 44 ARG CA C 44 55.965 54.796 1.169 1
1 553 . 10 1 1 A 44 44 ARG CB C 44 33.579 32.293 1.286 1
1 556 . 10 1 1 A 44 44 ARG N N 44 118.233 119.603 -1.370 1
1 558 . 10 1 1 A 45 45 THR H H 45 8.892 9.171 -0.279 1
1 559 . 10 1 1 A 45 45 THR HA H 45 5.308 4.953 0.355 1
1 564 . 10 1 1 A 45 45 THR C C 45 173.357 173.640 -0.283 1
1 565 . 10 1 1 A 45 45 THR CA C 45 60.939 62.260 -1.321 1
1 566 . 10 1 1 A 45 45 THR CB C 45 70.054 69.369 0.685 1
1 568 . 10 1 1 A 45 45 THR N N 45 118.457 120.100 -1.643 1
1 569 . 10 1 1 A 46 46 TYR H H 46 9.625 9.633 -0.008 1
1 570 . 10 1 1 A 46 46 TYR HA H 46 4.771 4.968 -0.197 1
1 578 . 10 1 1 A 46 46 TYR C C 46 173.735 175.201 -1.466 1
1 579 . 10 1 1 A 46 46 TYR CA C 46 57.480 56.434 1.046 1
1 580 . 10 1 1 A 46 46 TYR CB C 46 41.724 41.060 0.664 1
1 585 . 10 1 1 A 46 46 TYR N N 46 125.916 126.784 -0.868 1
1 586 . 10 1 1 A 47 47 ASP H H 47 9.006 8.936 0.070 1
1 587 . 10 1 1 A 47 47 ASP HA H 47 5.399 4.872 0.527 1
1 590 . 10 1 1 A 47 47 ASP C C 47 175.094 174.918 0.176 1
1 591 . 10 1 1 A 47 47 ASP CA C 47 53.460 53.937 -0.477 1
1 592 . 10 1 1 A 47 47 ASP CB C 47 41.947 41.754 0.193 1
1 593 . 10 1 1 A 47 47 ASP N N 47 122.109 122.912 -0.803 1
1 594 . 10 1 1 A 48 48 LEU H H 48 9.066 8.731 0.335 1
1 595 . 10 1 1 A 48 48 LEU HA H 48 4.831 4.979 -0.148 1
1 605 . 10 1 1 A 48 48 LEU C C 48 174.977 175.714 -0.737 1
1 606 . 10 1 1 A 48 48 LEU CA C 48 52.724 53.191 -0.467 1
1 607 . 10 1 1 A 48 48 LEU CB C 48 44.844 44.950 -0.106 1
1 611 . 10 1 1 A 48 48 LEU N N 48 121.879 125.222 -3.343 1
1 612 . 10 1 1 A 49 49 LYS H H 49 9.401 8.804 0.597 1
1 613 . 10 1 1 A 49 49 LYS HA H 49 4.477 4.944 -0.467 1
1 622 . 10 1 1 A 49 49 LYS C C 49 176.225 175.566 0.659 1
1 623 . 10 1 1 A 49 49 LYS CA C 49 56.017 54.605 1.412 1
1 624 . 10 1 1 A 49 49 LYS CB C 49 33.838 35.441 -1.603 1
1 628 . 10 1 1 A 49 49 LYS N N 49 122.218 122.225 -0.007 1
1 629 . 10 1 1 A 50 50 SER H H 50 8.266 8.661 -0.395 1
1 630 . 10 1 1 A 50 50 SER HA H 50 5.222 5.263 -0.041 1
1 633 . 10 1 1 A 50 50 SER C C 50 175.570 174.449 1.121 1
1 634 . 10 1 1 A 50 50 SER CA C 50 55.770 55.742 0.028 1
1 635 . 10 1 1 A 50 50 SER CB C 50 64.738 65.656 -0.918 1
1 636 . 10 1 1 A 50 50 SER N N 50 117.388 115.592 1.796 1
1 637 . 10 1 1 A 51 51 LYS H H 51 9.276 8.634 0.642 1
1 638 . 10 1 1 A 51 51 LYS HA H 51 4.208 4.519 -0.311 1
1 647 . 10 1 1 A 51 51 LYS C C 51 178.773 176.993 1.780 1
1 648 . 10 1 1 A 51 51 LYS CA C 51 58.674 55.452 3.222 1
1 649 . 10 1 1 A 51 51 LYS CB C 51 33.383 33.684 -0.301 1
1 653 . 10 1 1 A 51 51 LYS N N 51 130.550 120.676 9.874 1
1 654 . 10 1 1 A 52 52 GLY H H 52 8.320 8.918 -0.598 1
1 655 . 10 1 1 A 52 52 GLY HA2 H 52 3.875 3.996 -0.121 1
1 656 . 10 1 1 A 52 52 GLY HA3 H 52 3.628 4.015 -0.387 1
1 657 . 10 1 1 A 52 52 GLY C C 52 175.108 175.741 -0.633 1
1 658 . 10 1 1 A 52 52 GLY CA C 52 46.322 45.891 0.431 1
1 659 . 10 1 1 A 52 52 GLY N N 52 107.053 109.464 -2.411 1
1 660 . 10 1 1 A 53 53 GLN H H 53 7.859 8.461 -0.602 1
1 661 . 10 1 1 A 53 53 GLN HA H 53 4.409 4.294 0.115 1
1 668 . 10 1 1 A 53 53 GLN C C 53 176.469 176.776 -0.307 1
1 669 . 10 1 1 A 53 53 GLN CA C 53 54.911 56.022 -1.111 1
1 670 . 10 1 1 A 53 53 GLN CB C 53 29.675 29.233 0.442 1
1 673 . 10 1 1 A 53 53 GLN N N 53 115.482 120.438 -4.956 1
1 675 . 10 1 1 A 54 54 GLY H H 54 7.992 8.339 -0.347 1
1 676 . 10 1 1 A 54 54 GLY HA2 H 54 3.934 3.872 0.062 1
1 677 . 10 1 1 A 54 54 GLY HA3 H 54 3.934 3.881 0.053 1
1 678 . 10 1 1 A 54 54 GLY C C 54 173.897 173.699 0.198 1
1 679 . 10 1 1 A 54 54 GLY CA C 54 46.574 46.865 -0.291 1
1 680 . 10 1 1 A 54 54 GLY N N 54 110.111 109.106 1.005 1
1 681 . 10 1 1 A 55 55 ARG H H 55 7.652 7.581 0.071 1
1 682 . 10 1 1 A 55 55 ARG HA H 55 4.665 4.962 -0.297 1
1 690 . 10 1 1 A 55 55 ARG C C 55 174.649 174.657 -0.008 1
1 691 . 10 1 1 A 55 55 ARG CA C 55 54.631 53.958 0.673 1
1 692 . 10 1 1 A 55 55 ARG CB C 55 32.166 33.701 -1.535 1
1 695 . 10 1 1 A 55 55 ARG N N 55 114.214 115.821 -1.607 1
1 697 . 10 1 1 A 56 56 MET H H 56 8.593 8.628 -0.035 1
1 698 . 10 1 1 A 56 56 MET HA H 56 5.012 5.170 -0.158 1
1 703 . 10 1 1 A 56 56 MET C C 56 176.216 175.661 0.555 1
1 704 . 10 1 1 A 56 56 MET CA C 56 54.595 53.444 1.151 1
1 705 . 10 1 1 A 56 56 MET CB C 56 33.466 34.553 -1.087 1
1 707 . 10 1 1 A 56 56 MET N N 56 121.270 118.477 2.793 1
1 708 . 10 1 1 A 57 57 ILE H H 57 9.393 9.051 0.342 1
1 709 . 10 1 1 A 57 57 ILE HA H 57 4.717 4.628 0.089 1
1 719 . 10 1 1 A 57 57 ILE C C 57 173.883 174.400 -0.517 1
1 720 . 10 1 1 A 57 57 ILE CA C 57 59.713 58.330 1.383 1
1 721 . 10 1 1 A 57 57 ILE CB C 57 40.933 41.675 -0.742 1
1 725 . 10 1 1 A 57 57 ILE N N 57 120.811 117.053 3.758 1
1 726 . 10 1 1 A 58 58 GLN H H 58 8.218 7.956 0.262 1
1 727 . 10 1 1 A 58 58 GLN HA H 58 5.407 4.761 0.646 1
1 734 . 10 1 1 A 58 58 GLN C C 58 175.368 174.094 1.274 1
1 735 . 10 1 1 A 58 58 GLN CA C 58 55.163 54.370 0.793 1
1 736 . 10 1 1 A 58 58 GLN CB C 58 30.841 29.516 1.325 1
1 739 . 10 1 1 A 58 58 GLN N N 58 122.281 121.908 0.373 1
1 741 . 10 1 1 A 59 59 VAL H H 59 9.188 8.656 0.532 1
1 742 . 10 1 1 A 59 59 VAL HA H 59 5.025 4.925 0.100 1
1 750 . 10 1 1 A 59 59 VAL C C 59 175.330 175.499 -0.169 1
1 751 . 10 1 1 A 59 59 VAL CA C 59 59.975 61.340 -1.365 1
1 752 . 10 1 1 A 59 59 VAL CB C 59 34.818 32.433 2.385 1
1 755 . 10 1 1 A 59 59 VAL N N 59 122.421 126.353 -3.932 1
1 756 . 10 1 1 A 60 60 SER H H 60 9.022 8.787 0.235 1
1 757 . 10 1 1 A 60 60 SER HA H 60 5.811 5.762 0.049 1
1 760 . 10 1 1 A 60 60 SER C C 60 173.234 174.132 -0.898 1
1 761 . 10 1 1 A 60 60 SER CA C 60 57.634 56.242 1.392 1
1 762 . 10 1 1 A 60 60 SER CB C 60 64.891 65.501 -0.610 1
1 763 . 10 1 1 A 60 60 SER N N 60 124.709 121.258 3.451 1
1 764 . 10 1 1 A 61 61 ILE H H 61 9.226 8.780 0.446 1
1 765 . 10 1 1 A 61 61 ILE HA H 61 5.572 4.981 0.591 1
1 775 . 10 1 1 A 61 61 ILE C C 61 173.955 173.928 0.027 1
1 776 . 10 1 1 A 61 61 ILE CA C 61 56.937 57.193 -0.256 1
1 777 . 10 1 1 A 61 61 ILE CB C 61 39.596 40.173 -0.577 1
1 781 . 10 1 1 A 61 61 ILE N N 61 121.648 119.233 2.415 1
1 782 . 10 1 1 A 62 62 PRO HA H 62 4.606 4.552 0.054 1
1 789 . 10 1 1 A 62 62 PRO C C 62 178.143 177.677 0.466 1
1 790 . 10 1 1 A 62 62 PRO CA C 62 63.740 62.900 0.840 1
1 791 . 10 1 1 A 62 62 PRO CB C 62 33.303 32.717 0.586 1
1 794 . 10 1 1 A 63 63 ALA H H 63 7.803 8.965 -1.162 1
1 795 . 10 1 1 A 63 63 ALA HA H 63 4.037 4.089 -0.052 1
1 799 . 10 1 1 A 63 63 ALA C C 63 175.942 179.530 -3.588 1
1 800 . 10 1 1 A 63 63 ALA CA C 63 54.417 54.953 -0.536 1
1 801 . 10 1 1 A 63 63 ALA CB C 63 19.345 18.032 1.313 1
1 802 . 10 1 1 A 63 63 ALA N N 63 123.695 127.250 -3.555 1
1 803 . 10 1 1 A 64 64 SER H H 64 7.719 8.026 -0.307 1
1 804 . 10 1 1 A 64 64 SER HA H 64 4.097 4.314 -0.217 1
1 807 . 10 1 1 A 64 64 SER C C 64 175.199 174.830 0.369 1
1 808 . 10 1 1 A 64 64 SER CA C 64 59.474 60.577 -1.103 1
1 809 . 10 1 1 A 64 64 SER CB C 64 62.125 63.020 -0.895 1
1 810 . 10 1 1 A 64 64 SER N N 64 110.001 110.991 -0.990 1
1 811 . 10 1 1 A 65 65 VAL H H 65 7.790 7.817 -0.027 1
1 812 . 10 1 1 A 65 65 VAL HA H 65 4.360 4.225 0.135 1
1 820 . 10 1 1 A 65 65 VAL C C 65 174.433 174.365 0.068 1
1 821 . 10 1 1 A 65 65 VAL CA C 65 60.335 60.391 -0.056 1
1 822 . 10 1 1 A 65 65 VAL CB C 65 32.714 32.117 0.597 1
1 825 . 10 1 1 A 65 65 VAL N N 65 126.142 125.255 0.887 1
1 826 . 10 1 1 A 66 66 PRO HA H 66 4.369 4.555 -0.186 1
1 833 . 10 1 1 A 66 66 PRO C C 66 177.412 176.146 1.266 1
1 834 . 10 1 1 A 66 66 PRO CA C 66 63.104 62.671 0.433 1
1 835 . 10 1 1 A 66 66 PRO CB C 66 32.558 32.165 0.393 1
1 838 . 10 1 1 A 67 67 LEU H H 67 8.578 8.484 0.094 1
1 839 . 10 1 1 A 67 67 LEU HA H 67 3.875 4.677 -0.802 1
1 849 . 10 1 1 A 67 67 LEU C C 67 176.077 176.132 -0.055 1
1 850 . 10 1 1 A 67 67 LEU CA C 67 56.413 55.426 0.987 1
1 851 . 10 1 1 A 67 67 LEU CB C 67 43.279 42.500 0.779 1
1 855 . 10 1 1 A 67 67 LEU N N 67 124.236 123.133 1.103 1
1 856 . 10 1 1 A 68 68 LYS H H 68 7.994 8.888 -0.894 1
1 857 . 10 1 1 A 68 68 LYS HA H 68 3.793 3.758 0.035 1
1 866 . 10 1 1 A 68 68 LYS C C 68 175.601 176.192 -0.591 1
1 867 . 10 1 1 A 68 68 LYS CA C 68 53.350 59.137 -5.787 1
1 868 . 10 1 1 A 68 68 LYS CB C 68 31.035 32.167 -1.132 1
1 872 . 10 1 1 A 68 68 LYS N N 68 124.053 127.140 -3.087 1
1 873 . 10 1 1 A 69 69 GLU H H 69 8.347 8.073 0.274 1
1 874 . 10 1 1 A 69 69 GLU HA H 69 4.501 3.854 0.647 1
1 879 . 10 1 1 A 69 69 GLU C C 69 175.304 175.539 -0.235 1
1 880 . 10 1 1 A 69 69 GLU CA C 69 54.291 57.398 -3.107 1
1 881 . 10 1 1 A 69 69 GLU CB C 69 29.285 27.188 2.097 1
1 883 . 10 1 1 A 69 69 GLU N N 69 123.876 116.350 7.526 1
1 884 . 10 1 1 A 70 70 PHE H H 70 5.549 6.632 -1.083 1
1 885 . 10 1 1 A 70 70 PHE HA H 70 4.592 4.230 0.362 1
1 893 . 10 1 1 A 70 70 PHE C C 70 174.443 175.126 -0.683 1
1 894 . 10 1 1 A 70 70 PHE CA C 70 53.313 57.712 -4.399 1
1 895 . 10 1 1 A 70 70 PHE CB C 70 38.335 38.822 -0.487 1
1 901 . 10 1 1 A 70 70 PHE N N 70 117.781 116.744 1.037 1
1 902 . 10 1 1 A 71 71 ASP H H 71 8.791 8.726 0.065 1
1 903 . 10 1 1 A 71 71 ASP HA H 71 4.535 4.691 -0.156 1
1 906 . 10 1 1 A 71 71 ASP C C 71 175.867 175.870 -0.003 1
1 907 . 10 1 1 A 71 71 ASP CA C 71 54.248 54.565 -0.317 1
1 908 . 10 1 1 A 71 71 ASP CB C 71 41.166 41.638 -0.472 1
1 909 . 10 1 1 A 71 71 ASP N N 71 120.385 121.208 -0.823 1
1 910 . 10 1 1 A 72 72 TYR H H 72 8.701 8.680 0.021 1
1 911 . 10 1 1 A 72 72 TYR HA H 72 4.283 4.724 -0.441 1
1 918 . 10 1 1 A 72 72 TYR C C 72 177.470 176.476 0.994 1
1 919 . 10 1 1 A 72 72 TYR CA C 72 60.513 59.974 0.539 1
1 920 . 10 1 1 A 72 72 TYR CB C 72 38.320 38.521 -0.201 1
1 925 . 10 1 1 A 72 72 TYR N N 72 121.876 122.849 -0.973 1
1 926 . 10 1 1 A 73 73 ASN H H 73 8.819 8.909 -0.090 1
1 927 . 10 1 1 A 73 73 ASN HA H 73 4.096 4.146 -0.050 1
1 932 . 10 1 1 A 73 73 ASN C C 73 174.362 174.577 -0.215 1
1 933 . 10 1 1 A 73 73 ASN CA C 73 54.289 54.473 -0.184 1
1 934 . 10 1 1 A 73 73 ASN CB C 73 36.907 37.133 -0.226 1
1 936 . 10 1 1 A 73 73 ASN N N 73 121.726 119.159 2.567 1
1 938 . 10 1 1 A 74 74 ALA H H 74 8.059 7.517 0.542 1
1 939 . 10 1 1 A 74 74 ALA HA H 74 4.100 4.310 -0.210 1
1 943 . 10 1 1 A 74 74 ALA C C 74 177.757 177.367 0.390 1
1 944 . 10 1 1 A 74 74 ALA CA C 74 53.153 52.771 0.382 1
1 945 . 10 1 1 A 74 74 ALA CB C 74 19.412 19.485 -0.073 1
1 946 . 10 1 1 A 74 74 ALA N N 74 122.292 121.817 0.475 1
1 947 . 10 1 1 A 75 75 ARG H H 75 8.500 8.476 0.024 1
1 948 . 10 1 1 A 75 75 ARG HA H 75 4.758 4.543 0.215 1
1 955 . 10 1 1 A 75 75 ARG C C 75 176.812 176.004 0.808 1
1 956 . 10 1 1 A 75 75 ARG CA C 75 56.646 55.975 0.671 1
1 957 . 10 1 1 A 75 75 ARG CB C 75 29.375 30.680 -1.305 1
1 960 . 10 1 1 A 75 75 ARG N N 75 122.871 122.547 0.324 1
1 961 . 10 1 1 A 76 76 VAL H H 76 7.965 9.173 -1.208 1
1 962 . 10 1 1 A 76 76 VAL HA H 76 5.230 4.873 0.357 1
1 970 . 10 1 1 A 76 76 VAL C C 76 173.758 174.512 -0.754 1
1 971 . 10 1 1 A 76 76 VAL CA C 76 58.193 58.811 -0.618 1
1 972 . 10 1 1 A 76 76 VAL CB C 76 36.536 35.380 1.156 1
1 975 . 10 1 1 A 76 76 VAL N N 76 116.220 117.630 -1.410 1
1 976 . 10 1 1 A 77 77 GLU H H 77 9.166 9.205 -0.039 1
1 977 . 10 1 1 A 77 77 GLU HA H 77 4.663 5.006 -0.343 1
1 982 . 10 1 1 A 77 77 GLU C C 77 174.940 174.711 0.229 1
1 983 . 10 1 1 A 77 77 GLU CA C 77 53.546 54.295 -0.749 1
1 984 . 10 1 1 A 77 77 GLU CB C 77 33.395 33.498 -0.103 1
1 986 . 10 1 1 A 77 77 GLU N N 77 116.413 120.788 -4.375 1
1 987 . 10 1 1 A 78 78 LEU H H 78 8.670 9.016 -0.346 1
1 988 . 10 1 1 A 78 78 LEU HA H 78 4.677 5.027 -0.350 1
1 998 . 10 1 1 A 78 78 LEU C C 78 176.036 176.044 -0.008 1
1 999 . 10 1 1 A 78 78 LEU CA C 78 53.091 53.404 -0.313 1
1 1000 . 10 1 1 A 78 78 LEU CB C 78 43.276 44.177 -0.901 1
1 1004 . 10 1 1 A 78 78 LEU N N 78 117.927 123.734 -5.807 1
1 1005 . 10 1 1 A 79 79 ILE H H 79 7.900 8.866 -0.966 1
1 1006 . 10 1 1 A 79 79 ILE HA H 79 4.312 4.365 -0.053 1
1 1016 . 10 1 1 A 79 79 ILE C C 79 175.179 175.962 -0.783 1
1 1017 . 10 1 1 A 79 79 ILE CA C 79 58.294 60.257 -1.963 1
1 1018 . 10 1 1 A 79 79 ILE CB C 79 36.086 36.992 -0.906 1
1 1022 . 10 1 1 A 79 79 ILE N N 79 121.667 124.289 -2.622 1
1 1023 . 10 1 1 A 80 80 ASN H H 80 9.412 8.881 0.531 1
1 1024 . 10 1 1 A 80 80 ASN HA H 80 4.516 4.267 0.249 1
1 1029 . 10 1 1 A 80 80 ASN C C 80 170.300 173.577 -3.277 1
1 1030 . 10 1 1 A 80 80 ASN CA C 80 54.198 53.814 0.384 1
1 1031 . 10 1 1 A 80 80 ASN CB C 80 37.450 37.158 0.292 1
1 1033 . 10 1 1 A 80 80 ASN N N 80 123.831 123.014 0.817 1
1 1035 . 10 1 1 A 81 81 PRO HA H 81 5.185 4.951 0.234 1
1 1042 . 10 1 1 A 81 81 PRO C C 81 176.865 176.607 0.258 1
1 1043 . 10 1 1 A 81 81 PRO CA C 81 62.637 62.381 0.256 1
1 1044 . 10 1 1 A 81 81 PRO CB C 81 32.965 32.198 0.767 1
1 1047 . 10 1 1 A 82 82 ILE H H 82 9.374 8.642 0.732 1
1 1048 . 10 1 1 A 82 82 ILE HA H 82 4.524 5.071 -0.547 1
1 1058 . 10 1 1 A 82 82 ILE C C 82 174.731 174.277 0.454 1
1 1059 . 10 1 1 A 82 82 ILE CA C 82 60.205 58.544 1.661 1
1 1060 . 10 1 1 A 82 82 ILE CB C 82 41.737 41.256 0.481 1
1 1064 . 10 1 1 A 82 82 ILE N N 82 121.658 117.767 3.891 1
1 1065 . 10 1 1 A 83 83 ALA H H 83 8.819 8.754 0.065 1
1 1066 . 10 1 1 A 83 83 ALA HA H 83 4.773 4.946 -0.173 1
1 1070 . 10 1 1 A 83 83 ALA C C 83 176.550 176.876 -0.326 1
1 1071 . 10 1 1 A 83 83 ALA CA C 83 52.069 51.221 0.848 1
1 1072 . 10 1 1 A 83 83 ALA CB C 83 20.374 20.050 0.324 1
1 1073 . 10 1 1 A 83 83 ALA N N 83 127.933 125.632 2.301 1
1 1074 . 10 1 1 A 84 84 ASP H H 84 8.710 8.848 -0.138 1
1 1075 . 10 1 1 A 84 84 ASP HA H 84 4.894 4.820 0.074 1
1 1078 . 10 1 1 A 84 84 ASP C C 84 175.997 175.882 0.115 1
1 1079 . 10 1 1 A 84 84 ASP CA C 84 53.334 54.167 -0.833 1
1 1080 . 10 1 1 A 84 84 ASP CB C 84 42.104 42.329 -0.225 1
1 1081 . 10 1 1 A 84 84 ASP N N 84 122.009 124.172 -2.163 1
1 1082 . 10 1 1 A 85 85 THR H H 85 8.349 8.833 -0.484 1
1 1083 . 10 1 1 A 85 85 THR HA H 85 4.420 4.764 -0.344 1
1 1088 . 10 1 1 A 85 85 THR C C 85 175.085 175.634 -0.549 1
1 1089 . 10 1 1 A 85 85 THR CA C 85 62.304 63.390 -1.086 1
1 1090 . 10 1 1 A 85 85 THR CB C 85 69.718 71.319 -1.601 1
1 1092 . 10 1 1 A 85 85 THR N N 85 114.986 118.535 -3.549 1
1 1093 . 10 1 1 A 86 86 VAL H H 86 8.188 8.427 -0.239 1
1 1094 . 10 1 1 A 86 86 VAL HA H 86 4.021 4.118 -0.097 1
1 1102 . 10 1 1 A 86 86 VAL C C 86 176.519 177.402 -0.883 1
1 1103 . 10 1 1 A 86 86 VAL CA C 86 63.046 62.739 0.307 1
1 1104 . 10 1 1 A 86 86 VAL CB C 86 32.526 31.867 0.659 1
1 1107 . 10 1 1 A 86 86 VAL N N 86 122.275 118.640 3.635 1
1 1108 . 10 1 1 A 87 87 ALA H H 87 8.194 7.880 0.314 1
1 1109 . 10 1 1 A 87 87 ALA HA H 87 4.212 4.456 -0.244 1
1 1113 . 10 1 1 A 87 87 ALA C C 87 178.118 180.158 -2.040 1
1 1114 . 10 1 1 A 87 87 ALA CA C 87 53.153 55.732 -2.579 1
1 1115 . 10 1 1 A 87 87 ALA CB C 87 19.165 18.635 0.530 1
1 1116 . 10 1 1 A 87 87 ALA N N 87 126.609 126.465 0.144 1
1 1117 . 10 1 1 A 88 88 THR H H 88 7.914 8.171 -0.257 1
1 1118 . 10 1 1 A 88 88 THR HA H 88 4.173 4.024 0.149 1
1 1123 . 10 1 1 A 88 88 THR C C 88 174.516 175.822 -1.306 1
1 1124 . 10 1 1 A 88 88 THR CA C 88 62.785 64.753 -1.968 1
1 1125 . 10 1 1 A 88 88 THR CB C 88 69.582 68.778 0.804 1
1 1127 . 10 1 1 A 88 88 THR N N 88 112.328 112.043 0.285 1
1 1128 . 10 1 1 A 89 89 ALA H H 89 8.076 7.969 0.107 1
1 1129 . 10 1 1 A 89 89 ALA HA H 89 4.320 4.485 -0.165 1
1 1133 . 10 1 1 A 89 89 ALA C C 89 178.014 178.435 -0.421 1
1 1134 . 10 1 1 A 89 89 ALA CA C 89 53.079 52.697 0.382 1
1 1135 . 10 1 1 A 89 89 ALA CB C 89 19.335 20.020 -0.685 1
1 1136 . 10 1 1 A 89 89 ALA N N 89 124.632 122.770 1.862 1
1 1137 . 10 1 1 A 90 90 THR H H 90 7.976 7.574 0.402 1
1 1138 . 10 1 1 A 90 90 THR HA H 90 4.203 4.252 -0.049 1
1 1143 . 10 1 1 A 90 90 THR C C 90 174.427 176.371 -1.944 1
1 1144 . 10 1 1 A 90 90 THR CA C 90 62.519 63.399 -0.880 1
1 1145 . 10 1 1 A 90 90 THR CB C 90 69.721 69.436 0.285 1
1 1147 . 10 1 1 A 90 90 THR N N 90 112.047 110.498 1.549 1
1 1148 . 10 1 1 A 91 91 TYR H H 91 7.959 8.365 -0.406 1
1 1149 . 10 1 1 A 91 91 TYR HA H 91 4.564 4.323 0.241 1
1 1156 . 10 1 1 A 91 91 TYR C C 91 175.522 176.643 -1.121 1
1 1157 . 10 1 1 A 91 91 TYR CA C 91 57.874 60.209 -2.335 1
1 1158 . 10 1 1 A 91 91 TYR CB C 91 38.584 38.696 -0.112 1
1 1163 . 10 1 1 A 91 91 TYR N N 91 121.184 120.055 1.129 1
1 1164 . 10 1 1 A 92 92 GLN H H 92 8.310 8.045 0.265 1
1 1165 . 10 1 1 A 92 92 GLN HA H 92 4.258 4.655 -0.397 1
1 1172 . 10 1 1 A 92 92 GLN C C 92 176.099 176.231 -0.132 1
1 1173 . 10 1 1 A 92 92 GLN CA C 92 56.109 57.320 -1.211 1
1 1174 . 10 1 1 A 92 92 GLN CB C 92 29.112 31.853 -2.741 1
1 1177 . 10 1 1 A 92 92 GLN N N 92 121.631 117.531 4.100 1
1 1179 . 10 1 1 A 93 93 GLY H H 93 8.052 7.864 0.188 1
1 1180 . 10 1 1 A 93 93 GLY HA2 H 93 4.023 4.034 -0.011 1
1 1181 . 10 1 1 A 93 93 GLY HA3 H 93 3.856 4.044 -0.188 1
1 1182 . 10 1 1 A 93 93 GLY C C 93 173.791 175.624 -1.833 1
1 1183 . 10 1 1 A 93 93 GLY CA C 93 45.382 45.557 -0.175 1
1 1184 . 10 1 1 A 93 93 GLY N N 93 109.847 108.074 1.773 1
1 1185 . 10 1 1 A 94 94 ALA H H 94 8.162 8.043 0.119 1
1 1186 . 10 1 1 A 94 94 ALA HA H 94 4.329 4.363 -0.034 1
1 1190 . 10 1 1 A 94 94 ALA C C 94 177.392 176.163 1.229 1
1 1191 . 10 1 1 A 94 94 ALA CA C 94 52.558 52.759 -0.201 1
1 1192 . 10 1 1 A 94 94 ALA CB C 94 19.526 19.091 0.435 1
1 1193 . 10 1 1 A 94 94 ALA N N 94 123.424 122.848 0.576 1
1 1194 . 10 1 1 A 95 95 ASP H H 95 8.457 7.706 0.751 1
1 1195 . 10 1 1 A 95 95 ASP HA H 95 4.608 4.928 -0.320 1
1 1198 . 10 1 1 A 95 95 ASP C C 95 175.630 176.443 -0.813 1
1 1199 . 10 1 1 A 95 95 ASP CA C 95 54.450 53.342 1.108 1
1 1200 . 10 1 1 A 95 95 ASP CB C 95 40.871 39.838 1.033 1
1 1201 . 10 1 1 A 95 95 ASP N N 95 118.814 119.388 -0.574 1
1 1202 . 10 1 1 A 96 96 VAL H H 96 7.776 8.420 -0.644 1
1 1203 . 10 1 1 A 96 96 VAL HA H 96 4.141 4.482 -0.341 1
1 1211 . 10 1 1 A 96 96 VAL C C 96 175.301 176.056 -0.755 1
1 1212 . 10 1 1 A 96 96 VAL CA C 96 61.435 62.035 -0.600 1
1 1213 . 10 1 1 A 96 96 VAL CB C 96 33.517 33.723 -0.206 1
1 1216 . 10 1 1 A 96 96 VAL N N 96 118.395 119.032 -0.637 1
1 1217 . 10 1 1 A 97 97 ASP H H 97 8.315 7.633 0.682 1
1 1218 . 10 1 1 A 97 97 ASP HA H 97 4.681 4.659 0.022 1
1 1221 . 10 1 1 A 97 97 ASP C C 97 175.151 176.109 -0.958 1
1 1222 . 10 1 1 A 97 97 ASP CA C 97 54.324 54.982 -0.658 1
1 1223 . 10 1 1 A 97 97 ASP CB C 97 41.963 41.079 0.884 1
1 1224 . 10 1 1 A 97 97 ASP N N 97 123.905 123.258 0.647 1
1 1225 . 10 1 1 A 98 98 TRP H H 98 8.210 8.811 -0.601 1
1 1226 . 10 1 1 A 98 98 TRP HA H 98 4.916 4.733 0.183 1
1 1235 . 10 1 1 A 98 98 TRP C C 98 174.585 175.814 -1.229 1
1 1236 . 10 1 1 A 98 98 TRP CA C 98 56.164 57.214 -1.050 1
1 1237 . 10 1 1 A 98 98 TRP CB C 98 31.466 29.634 1.832 1
1 1243 . 10 1 1 A 98 98 TRP N N 98 120.340 123.410 -3.070 1
1 1245 . 10 1 1 A 99 99 TYR H H 99 8.760 8.958 -0.198 1
1 1246 . 10 1 1 A 99 99 TYR HA H 99 5.119 5.652 -0.533 1
1 1253 . 10 1 1 A 99 99 TYR C C 99 174.599 175.236 -0.637 1
1 1254 . 10 1 1 A 99 99 TYR CA C 99 57.021 57.815 -0.794 1
1 1255 . 10 1 1 A 99 99 TYR CB C 99 39.526 39.024 0.502 1
1 1260 . 10 1 1 A 99 99 TYR N N 99 123.319 124.711 -1.392 1
1 1261 . 10 1 1 A 100 100 ILE H H 100 8.936 9.141 -0.205 1
1 1262 . 10 1 1 A 100 100 ILE HA H 100 4.850 4.896 -0.046 1
1 1272 . 10 1 1 A 100 100 ILE C C 100 175.070 175.451 -0.381 1
1 1273 . 10 1 1 A 100 100 ILE CA C 100 58.998 60.861 -1.863 1
1 1274 . 10 1 1 A 100 100 ILE CB C 100 40.667 37.710 2.957 1
1 1278 . 10 1 1 A 100 100 ILE N N 100 123.281 125.697 -2.416 1
1 1279 . 10 1 1 A 101 101 LYS H H 101 8.987 9.022 -0.035 1
1 1280 . 10 1 1 A 101 101 LYS HA H 101 5.313 5.217 0.096 1
1 1289 . 10 1 1 A 101 101 LYS C C 101 174.440 176.272 -1.832 1
1 1290 . 10 1 1 A 101 101 LYS CA C 101 54.763 55.972 -1.209 1
1 1291 . 10 1 1 A 101 101 LYS CB C 101 34.880 33.344 1.536 1
1 1295 . 10 1 1 A 101 101 LYS N N 101 126.210 127.712 -1.502 1
1 1296 . 10 1 1 A 102 102 ALA H H 102 8.531 7.971 0.560 1
1 1297 . 10 1 1 A 102 102 ALA HA H 102 4.957 4.787 0.170 1
1 1301 . 10 1 1 A 102 102 ALA C C 102 175.024 177.882 -2.858 1
1 1302 . 10 1 1 A 102 102 ALA CA C 102 50.701 50.000 0.701 1
1 1303 . 10 1 1 A 102 102 ALA CB C 102 21.618 22.644 -1.026 1
1 1304 . 10 1 1 A 102 102 ALA N N 102 121.424 126.892 -5.468 1
1 1305 . 10 1 1 A 103 103 ASP H H 103 8.339 9.093 -0.754 1
1 1306 . 10 1 1 A 103 103 ASP HA H 103 4.603 4.479 0.124 1
1 1309 . 10 1 1 A 103 103 ASP C C 103 176.188 175.380 0.808 1
1 1310 . 10 1 1 A 103 103 ASP CA C 103 56.049 56.453 -0.404 1
1 1311 . 10 1 1 A 103 103 ASP CB C 103 40.932 41.551 -0.619 1
1 1312 . 10 1 1 A 103 103 ASP N N 103 117.773 119.727 -1.954 1
1 1313 . 10 1 1 A 104 104 ASP H H 104 7.482 7.774 -0.292 1
1 1314 . 10 1 1 A 104 104 ASP HA H 104 4.727 4.967 -0.240 1
1 1317 . 10 1 1 A 104 104 ASP C C 104 174.261 173.774 0.487 1
1 1318 . 10 1 1 A 104 104 ASP CA C 104 52.768 53.508 -0.740 1
1 1319 . 10 1 1 A 104 104 ASP CB C 104 42.587 43.802 -1.215 1
1 1320 . 10 1 1 A 104 104 ASP N N 104 110.673 116.657 -5.984 1
1 1321 . 10 1 1 A 105 105 ILE H H 105 9.267 8.556 0.711 1
1 1322 . 10 1 1 A 105 105 ILE HA H 105 4.631 4.877 -0.246 1
1 1332 . 10 1 1 A 105 105 ILE C C 105 173.922 175.344 -1.422 1
1 1333 . 10 1 1 A 105 105 ILE CA C 105 61.114 60.356 0.758 1
1 1334 . 10 1 1 A 105 105 ILE CB C 105 42.522 40.036 2.486 1
1 1338 . 10 1 1 A 105 105 ILE N N 105 121.380 122.367 -0.987 1
1 1339 . 10 1 1 A 106 106 VAL H H 106 8.592 8.892 -0.300 1
1 1340 . 10 1 1 A 106 106 VAL HA H 106 4.975 4.985 -0.010 1
1 1348 . 10 1 1 A 106 106 VAL C C 106 175.049 174.939 0.110 1
1 1349 . 10 1 1 A 106 106 VAL CA C 106 58.028 59.237 -1.209 1
1 1350 . 10 1 1 A 106 106 VAL CB C 106 35.388 35.578 -0.190 1
1 1353 . 10 1 1 A 106 106 VAL N N 106 116.356 120.999 -4.643 1
1 1354 . 10 1 1 A 107 107 LEU H H 107 8.360 8.450 -0.090 1
1 1355 . 10 1 1 A 107 107 LEU HA H 107 4.167 4.083 0.084 1
1 1365 . 10 1 1 A 107 107 LEU C C 107 178.338 177.409 0.929 1
1 1366 . 10 1 1 A 107 107 LEU CA C 107 55.077 54.728 0.349 1
1 1367 . 10 1 1 A 107 107 LEU CB C 107 42.394 42.142 0.252 1
1 1371 . 10 1 1 A 107 107 LEU N N 107 121.368 122.668 -1.300 1
1 1372 . 10 1 1 A 108 108 THR H H 108 7.977 8.768 -0.791 1
1 1373 . 10 1 1 A 108 108 THR HA H 108 4.039 4.267 -0.228 1
1 1378 . 10 1 1 A 108 108 THR C C 108 174.725 174.403 0.322 1
1 1379 . 10 1 1 A 108 108 THR CA C 108 63.513 64.055 -0.542 1
1 1380 . 10 1 1 A 108 108 THR CB C 108 69.194 68.985 0.209 1
1 1382 . 10 1 1 A 108 108 THR N N 108 118.728 118.523 0.205 1
1 1383 . 10 1 1 A 109 109 LEU H H 109 8.378 8.736 -0.358 1
1 1384 . 10 1 1 A 109 109 LEU HA H 109 4.274 4.193 0.081 1
1 1394 . 10 1 1 A 109 109 LEU C C 109 177.058 177.992 -0.934 1
1 1395 . 10 1 1 A 109 109 LEU CA C 109 55.045 54.882 0.163 1
1 1396 . 10 1 1 A 109 109 LEU CB C 109 42.620 40.611 2.009 1
1 1400 . 10 1 1 A 109 109 LEU N N 109 124.847 128.261 -3.414 1
1 9 . 11 1 1 A 2 2 MET HA H 2 4.554 4.725 -0.171 1
1 14 . 11 1 1 A 2 2 MET C C 2 174.749 175.507 -0.758 1
1 15 . 11 1 1 A 2 2 MET CA C 2 55.354 54.615 0.739 1
1 16 . 11 1 1 A 2 2 MET CB C 2 33.729 34.233 -0.504 1
1 18 . 11 1 1 A 3 3 ARG H H 3 8.518 8.449 0.069 1
1 19 . 11 1 1 A 3 3 ARG HA H 3 4.531 4.796 -0.265 1
1 26 . 11 1 1 A 3 3 ARG C C 3 175.780 175.205 0.575 1
1 27 . 11 1 1 A 3 3 ARG CA C 3 55.854 54.179 1.675 1
1 28 . 11 1 1 A 3 3 ARG CB C 3 31.403 33.086 -1.683 1
1 31 . 11 1 1 A 3 3 ARG N N 3 124.008 119.988 4.020 1
1 32 . 11 1 1 A 4 4 LEU H H 4 8.424 8.874 -0.450 1
1 33 . 11 1 1 A 4 4 LEU HA H 4 4.457 4.993 -0.536 1
1 43 . 11 1 1 A 4 4 LEU C C 4 177.362 176.631 0.731 1
1 44 . 11 1 1 A 4 4 LEU CA C 4 54.511 53.778 0.733 1
1 45 . 11 1 1 A 4 4 LEU CB C 4 42.686 42.915 -0.229 1
1 49 . 11 1 1 A 4 4 LEU N N 4 124.389 123.490 0.899 1
1 50 . 11 1 1 A 5 5 ALA H H 5 8.418 8.745 -0.327 1
1 51 . 11 1 1 A 5 5 ALA HA H 5 4.254 4.348 -0.094 1
1 55 . 11 1 1 A 5 5 ALA C C 5 177.420 179.131 -1.711 1
1 56 . 11 1 1 A 5 5 ALA CA C 5 52.931 51.925 1.006 1
1 57 . 11 1 1 A 5 5 ALA CB C 5 19.263 19.251 0.012 1
1 58 . 11 1 1 A 5 5 ALA N N 5 124.548 127.590 -3.042 1
1 59 . 11 1 1 A 6 6 ASN H H 6 8.287 8.871 -0.584 1
1 60 . 11 1 1 A 6 6 ASN HA H 6 4.616 4.707 -0.091 1
1 65 . 11 1 1 A 6 6 ASN C C 6 175.837 176.704 -0.867 1
1 66 . 11 1 1 A 6 6 ASN CA C 6 53.345 52.058 1.287 1
1 67 . 11 1 1 A 6 6 ASN CB C 6 38.571 37.934 0.637 1
1 69 . 11 1 1 A 6 6 ASN N N 6 116.484 119.013 -2.529 1
1 71 . 11 1 1 A 7 7 GLY H H 7 8.351 8.359 -0.008 1
1 72 . 11 1 1 A 7 7 GLY HA2 H 7 4.130 3.969 0.161 1
1 73 . 11 1 1 A 7 7 GLY HA3 H 7 3.808 3.969 -0.161 1
1 74 . 11 1 1 A 7 7 GLY C C 7 173.750 174.372 -0.622 1
1 75 . 11 1 1 A 7 7 GLY CA C 7 45.343 47.582 -2.239 1
1 76 . 11 1 1 A 7 7 GLY N N 7 108.453 109.223 -0.770 1
1 77 . 11 1 1 A 8 8 ILE H H 8 7.868 7.486 0.382 1
1 78 . 11 1 1 A 8 8 ILE HA H 8 4.130 4.474 -0.344 1
1 88 . 11 1 1 A 8 8 ILE C C 8 175.570 175.102 0.468 1
1 89 . 11 1 1 A 8 8 ILE CA C 8 61.095 59.912 1.183 1
1 90 . 11 1 1 A 8 8 ILE CB C 8 38.694 39.362 -0.668 1
1 94 . 11 1 1 A 8 8 ILE N N 8 120.848 116.120 4.728 1
1 95 . 11 1 1 A 9 9 VAL H H 9 8.220 8.822 -0.602 1
1 96 . 11 1 1 A 9 9 VAL HA H 9 4.172 4.556 -0.384 1
1 104 . 11 1 1 A 9 9 VAL C C 9 175.898 175.574 0.324 1
1 105 . 11 1 1 A 9 9 VAL CA C 9 62.488 61.629 0.859 1
1 106 . 11 1 1 A 9 9 VAL CB C 9 32.460 32.305 0.155 1
1 109 . 11 1 1 A 9 9 VAL N N 9 125.805 125.578 0.227 1
1 110 . 11 1 1 A 10 10 LEU H H 10 8.437 8.538 -0.101 1
1 111 . 11 1 1 A 10 10 LEU HA H 10 4.347 5.079 -0.732 1
1 121 . 11 1 1 A 10 10 LEU C C 10 176.398 175.821 0.577 1
1 122 . 11 1 1 A 10 10 LEU CA C 10 54.787 52.753 2.034 1
1 123 . 11 1 1 A 10 10 LEU CB C 10 42.639 45.543 -2.904 1
1 127 . 11 1 1 A 10 10 LEU N N 10 127.757 123.630 4.127 1
1 128 . 11 1 1 A 11 11 ASP H H 11 8.506 9.300 -0.794 1
1 129 . 11 1 1 A 11 11 ASP HA H 11 4.683 4.793 -0.110 1
1 132 . 11 1 1 A 11 11 ASP C C 11 176.672 175.594 1.078 1
1 133 . 11 1 1 A 11 11 ASP CA C 11 53.586 55.422 -1.836 1
1 134 . 11 1 1 A 11 11 ASP CB C 11 41.123 42.190 -1.067 1
1 135 . 11 1 1 A 11 11 ASP N N 11 121.539 119.797 1.742 1
1 136 . 11 1 1 A 12 12 LYS H H 12 8.578 7.529 1.049 1
1 137 . 11 1 1 A 12 12 LYS HA H 12 3.943 4.621 -0.678 1
1 146 . 11 1 1 A 12 12 LYS C C 12 176.917 174.249 2.668 1
1 147 . 11 1 1 A 12 12 LYS CA C 12 58.542 56.177 2.365 1
1 148 . 11 1 1 A 12 12 LYS CB C 12 32.703 34.541 -1.838 1
1 152 . 11 1 1 A 12 12 LYS N N 12 123.635 118.262 5.373 1
1 153 . 11 1 1 A 13 13 ASP H H 13 8.523 8.945 -0.422 1
1 154 . 11 1 1 A 13 13 ASP HA H 13 4.566 4.736 -0.170 1
1 157 . 11 1 1 A 13 13 ASP C C 13 177.535 176.537 0.998 1
1 158 . 11 1 1 A 13 13 ASP CA C 13 56.034 54.913 1.121 1
1 159 . 11 1 1 A 13 13 ASP CB C 13 41.051 40.581 0.470 1
1 160 . 11 1 1 A 13 13 ASP N N 13 120.448 127.554 -7.106 1
1 161 . 11 1 1 A 14 14 THR H H 14 7.964 8.866 -0.902 1
1 162 . 11 1 1 A 14 14 THR HA H 14 4.146 4.107 0.039 1
1 167 . 11 1 1 A 14 14 THR C C 14 175.440 176.279 -0.839 1
1 168 . 11 1 1 A 14 14 THR CA C 14 63.245 64.729 -1.484 1
1 169 . 11 1 1 A 14 14 THR CB C 14 69.092 68.780 0.312 1
1 171 . 11 1 1 A 14 14 THR N N 14 113.711 120.866 -7.155 1
1 172 . 11 1 1 A 15 15 THR H H 15 7.921 7.895 0.026 1
1 173 . 11 1 1 A 15 15 THR HA H 15 3.920 4.037 -0.117 1
1 178 . 11 1 1 A 15 15 THR C C 15 174.750 174.198 0.552 1
1 179 . 11 1 1 A 15 15 THR CA C 15 64.562 65.499 -0.937 1
1 180 . 11 1 1 A 15 15 THR CB C 15 69.166 68.562 0.604 1
1 182 . 11 1 1 A 15 15 THR N N 15 116.710 114.866 1.844 1
1 183 . 11 1 1 A 16 16 PHE H H 16 8.191 8.034 0.157 1
1 184 . 11 1 1 A 16 16 PHE HA H 16 4.628 5.007 -0.379 1
1 192 . 11 1 1 A 16 16 PHE C C 16 177.754 175.923 1.831 1
1 193 . 11 1 1 A 16 16 PHE CA C 16 57.975 55.392 2.583 1
1 194 . 11 1 1 A 16 16 PHE CB C 16 39.553 39.499 0.054 1
1 200 . 11 1 1 A 16 16 PHE N N 16 117.124 118.065 -0.941 1
1 201 . 11 1 1 A 17 17 GLY H H 17 8.110 8.683 -0.573 1
1 202 . 11 1 1 A 17 17 GLY HA2 H 17 4.017 4.117 -0.100 1
1 203 . 11 1 1 A 17 17 GLY HA3 H 17 3.849 4.130 -0.281 1
1 204 . 11 1 1 A 17 17 GLY C C 17 172.231 173.314 -1.083 1
1 205 . 11 1 1 A 17 17 GLY CA C 17 45.633 44.499 1.134 1
1 206 . 11 1 1 A 17 17 GLY N N 17 109.951 110.480 -0.529 1
1 207 . 11 1 1 A 18 18 GLU H H 18 8.304 8.536 -0.232 1
1 208 . 11 1 1 A 18 18 GLU HA H 18 4.078 4.201 -0.123 1
1 213 . 11 1 1 A 18 18 GLU C C 18 175.588 176.226 -0.638 1
1 214 . 11 1 1 A 18 18 GLU CA C 18 57.446 56.706 0.740 1
1 215 . 11 1 1 A 18 18 GLU CB C 18 30.767 29.860 0.907 1
1 217 . 11 1 1 A 18 18 GLU N N 18 121.640 119.634 2.006 1
1 218 . 11 1 1 A 19 19 LEU H H 19 8.799 8.424 0.375 1
1 219 . 11 1 1 A 19 19 LEU HA H 19 5.416 4.827 0.589 1
1 229 . 11 1 1 A 19 19 LEU C C 19 176.875 176.361 0.514 1
1 230 . 11 1 1 A 19 19 LEU CA C 19 53.281 54.190 -0.909 1
1 231 . 11 1 1 A 19 19 LEU CB C 19 45.508 43.051 2.457 1
1 235 . 11 1 1 A 19 19 LEU N N 19 127.101 125.008 2.093 1
1 236 . 11 1 1 A 20 20 LYS H H 20 8.494 8.289 0.205 1
1 237 . 11 1 1 A 20 20 LYS HA H 20 5.200 4.569 0.631 1
1 246 . 11 1 1 A 20 20 LYS C C 20 176.163 174.629 1.534 1
1 247 . 11 1 1 A 20 20 LYS CA C 20 53.575 55.628 -2.053 1
1 248 . 11 1 1 A 20 20 LYS CB C 20 36.835 35.883 0.952 1
1 252 . 11 1 1 A 20 20 LYS N N 20 118.828 121.190 -2.362 1
1 253 . 11 1 1 A 21 21 PHE H H 21 9.658 9.406 0.252 1
1 254 . 11 1 1 A 21 21 PHE HA H 21 4.038 4.661 -0.623 1
1 262 . 11 1 1 A 21 21 PHE C C 21 174.296 174.998 -0.702 1
1 263 . 11 1 1 A 21 21 PHE CA C 21 60.462 58.930 1.532 1
1 264 . 11 1 1 A 21 21 PHE CB C 21 40.359 39.853 0.506 1
1 270 . 11 1 1 A 21 21 PHE N N 21 124.322 128.460 -4.138 1
1 271 . 11 1 1 A 22 22 SER H H 22 7.199 8.356 -1.157 1
1 272 . 11 1 1 A 22 22 SER HA H 22 5.046 4.751 0.295 1
1 275 . 11 1 1 A 22 22 SER C C 22 173.080 173.687 -0.607 1
1 276 . 11 1 1 A 22 22 SER CA C 22 58.547 59.971 -1.424 1
1 277 . 11 1 1 A 22 22 SER CB C 22 63.591 65.393 -1.802 1
1 278 . 11 1 1 A 22 22 SER N N 22 120.109 121.311 -1.202 1
1 279 . 11 1 1 A 23 23 ALA H H 23 7.269 6.928 0.341 1
1 280 . 11 1 1 A 23 23 ALA HA H 23 4.426 4.668 -0.242 1
1 284 . 11 1 1 A 23 23 ALA C C 23 176.568 174.576 1.992 1
1 285 . 11 1 1 A 23 23 ALA CA C 23 52.458 51.376 1.082 1
1 286 . 11 1 1 A 23 23 ALA CB C 23 22.728 21.853 0.875 1
1 287 . 11 1 1 A 23 23 ALA N N 23 114.102 119.294 -5.192 1
1 288 . 11 1 1 A 24 24 LEU H H 24 8.819 8.602 0.217 1
1 289 . 11 1 1 A 24 24 LEU HA H 24 4.060 4.511 -0.451 1
1 299 . 11 1 1 A 24 24 LEU C C 24 175.363 176.446 -1.083 1
1 300 . 11 1 1 A 24 24 LEU CA C 24 56.901 53.877 3.024 1
1 301 . 11 1 1 A 24 24 LEU CB C 24 42.065 43.605 -1.540 1
1 305 . 11 1 1 A 24 24 LEU N N 24 120.865 120.485 0.380 1
1 306 . 11 1 1 A 25 25 ARG H H 25 9.473 8.721 0.752 1
1 307 . 11 1 1 A 25 25 ARG HA H 25 4.428 4.236 0.192 1
1 315 . 11 1 1 A 25 25 ARG C C 25 175.729 175.341 0.388 1
1 316 . 11 1 1 A 25 25 ARG CA C 25 56.721 57.732 -1.011 1
1 317 . 11 1 1 A 25 25 ARG CB C 25 31.109 31.216 -0.107 1
1 320 . 11 1 1 A 25 25 ARG N N 25 130.455 127.315 3.140 1
1 322 . 11 1 1 A 26 26 ARG H H 26 7.711 7.432 0.279 1
1 323 . 11 1 1 A 26 26 ARG HA H 26 4.559 4.645 -0.086 1
1 330 . 11 1 1 A 26 26 ARG C C 26 173.724 173.531 0.193 1
1 331 . 11 1 1 A 26 26 ARG CA C 26 55.737 55.714 0.023 1
1 332 . 11 1 1 A 26 26 ARG CB C 26 33.261 33.870 -0.609 1
1 335 . 11 1 1 A 26 26 ARG N N 26 113.305 118.464 -5.159 1
1 336 . 11 1 1 A 27 27 GLU H H 27 8.848 8.628 0.220 1
1 337 . 11 1 1 A 27 27 GLU HA H 27 4.615 4.700 -0.085 1
1 342 . 11 1 1 A 27 27 GLU C C 27 174.836 175.308 -0.472 1
1 343 . 11 1 1 A 27 27 GLU CA C 27 55.901 55.337 0.564 1
1 344 . 11 1 1 A 27 27 GLU CB C 27 30.755 30.182 0.573 1
1 346 . 11 1 1 A 27 27 GLU N N 27 121.934 125.222 -3.288 1
1 347 . 11 1 1 A 28 28 VAL H H 28 8.603 8.171 0.432 1
1 348 . 11 1 1 A 28 28 VAL HA H 28 4.013 4.205 -0.192 1
1 356 . 11 1 1 A 28 28 VAL C C 28 175.561 175.804 -0.243 1
1 357 . 11 1 1 A 28 28 VAL CA C 28 62.791 61.667 1.124 1
1 358 . 11 1 1 A 28 28 VAL CB C 28 32.710 31.031 1.679 1
1 361 . 11 1 1 A 28 28 VAL N N 28 125.545 123.200 2.345 1
1 362 . 11 1 1 A 29 29 ARG H H 29 8.735 8.175 0.560 1
1 363 . 11 1 1 A 29 29 ARG HA H 29 4.774 4.440 0.334 1
1 370 . 11 1 1 A 29 29 ARG C C 29 176.580 176.515 0.065 1
1 371 . 11 1 1 A 29 29 ARG CA C 29 55.481 56.098 -0.617 1
1 372 . 11 1 1 A 29 29 ARG CB C 29 31.963 31.144 0.819 1
1 375 . 11 1 1 A 29 29 ARG N N 29 128.327 127.776 0.551 1
1 376 . 11 1 1 A 30 30 ILE H H 30 8.358 8.685 -0.327 1
1 377 . 11 1 1 A 30 30 ILE HA H 30 3.882 4.262 -0.380 1
1 387 . 11 1 1 A 30 30 ILE C C 30 175.093 175.295 -0.202 1
1 388 . 11 1 1 A 30 30 ILE CA C 30 61.669 59.982 1.687 1
1 389 . 11 1 1 A 30 30 ILE CB C 30 38.806 37.865 0.941 1
1 393 . 11 1 1 A 30 30 ILE N N 30 121.957 122.172 -0.215 1
1 394 . 11 1 1 A 31 31 GLN H H 31 8.560 8.836 -0.276 1
1 395 . 11 1 1 A 31 31 GLN HA H 31 4.647 5.011 -0.364 1
1 402 . 11 1 1 A 31 31 GLN C C 31 175.954 175.405 0.549 1
1 403 . 11 1 1 A 31 31 GLN CA C 31 54.833 54.002 0.831 1
1 404 . 11 1 1 A 31 31 GLN CB C 31 30.584 32.082 -1.498 1
1 407 . 11 1 1 A 31 31 GLN N N 31 126.348 126.892 -0.544 1
1 409 . 11 1 1 A 32 32 ASN H H 32 8.994 8.871 0.123 1
1 410 . 11 1 1 A 32 32 ASN HA H 32 4.784 4.720 0.064 1
1 415 . 11 1 1 A 32 32 ASN C C 32 177.296 176.883 0.413 1
1 416 . 11 1 1 A 32 32 ASN CA C 32 53.206 53.410 -0.204 1
1 417 . 11 1 1 A 32 32 ASN CB C 32 39.472 39.398 0.074 1
1 419 . 11 1 1 A 32 32 ASN N N 32 122.834 125.233 -2.399 1
1 421 . 11 1 1 A 33 33 GLU H H 33 9.180 8.913 0.267 1
1 422 . 11 1 1 A 33 33 GLU HA H 33 4.063 4.070 -0.007 1
1 427 . 11 1 1 A 33 33 GLU C C 33 176.787 178.351 -1.564 1
1 428 . 11 1 1 A 33 33 GLU CA C 33 59.347 59.288 0.059 1
1 429 . 11 1 1 A 33 33 GLU CB C 33 29.294 29.119 0.175 1
1 431 . 11 1 1 A 33 33 GLU N N 33 122.736 121.769 0.967 1
1 432 . 11 1 1 A 34 34 ASP H H 34 7.969 7.989 -0.020 1
1 433 . 11 1 1 A 34 34 ASP HA H 34 4.499 4.434 0.065 1
1 436 . 11 1 1 A 34 34 ASP C C 34 177.111 176.179 0.932 1
1 437 . 11 1 1 A 34 34 ASP CA C 34 53.632 55.839 -2.207 1
1 438 . 11 1 1 A 34 34 ASP CB C 34 39.807 40.821 -1.014 1
1 439 . 11 1 1 A 34 34 ASP N N 34 115.921 119.801 -3.880 1
1 440 . 11 1 1 A 35 35 GLY H H 35 8.083 7.740 0.343 1
1 441 . 11 1 1 A 35 35 GLY HA2 H 35 4.366 4.015 0.351 1
1 442 . 11 1 1 A 35 35 GLY HA3 H 35 3.657 4.016 -0.359 1
1 443 . 11 1 1 A 35 35 GLY C C 35 174.584 174.789 -0.205 1
1 444 . 11 1 1 A 35 35 GLY CA C 35 45.134 45.338 -0.204 1
1 445 . 11 1 1 A 35 35 GLY N N 35 108.874 107.915 0.959 1
1 446 . 11 1 1 A 36 36 SER H H 36 8.274 7.539 0.735 1
1 447 . 11 1 1 A 36 36 SER HA H 36 4.389 4.472 -0.083 1
1 450 . 11 1 1 A 36 36 SER C C 36 173.284 173.808 -0.524 1
1 451 . 11 1 1 A 36 36 SER CA C 36 58.383 59.441 -1.058 1
1 452 . 11 1 1 A 36 36 SER CB C 36 64.576 64.006 0.570 1
1 453 . 11 1 1 A 36 36 SER N N 36 117.428 117.348 0.080 1
1 454 . 11 1 1 A 37 37 VAL H H 37 8.508 8.588 -0.080 1
1 455 . 11 1 1 A 37 37 VAL HA H 37 4.346 4.383 -0.037 1
1 463 . 11 1 1 A 37 37 VAL C C 37 176.370 175.794 0.576 1
1 464 . 11 1 1 A 37 37 VAL CA C 37 62.410 61.888 0.522 1
1 465 . 11 1 1 A 37 37 VAL CB C 37 33.086 32.728 0.358 1
1 468 . 11 1 1 A 37 37 VAL N N 37 119.189 125.593 -6.404 1
1 469 . 11 1 1 A 38 38 SER H H 38 8.461 8.959 -0.498 1
1 470 . 11 1 1 A 38 38 SER HA H 38 4.586 4.755 -0.169 1
1 473 . 11 1 1 A 38 38 SER C C 38 173.829 174.755 -0.926 1
1 474 . 11 1 1 A 38 38 SER CA C 38 57.618 57.120 0.498 1
1 475 . 11 1 1 A 38 38 SER CB C 38 64.537 64.805 -0.268 1
1 476 . 11 1 1 A 38 38 SER N N 38 121.629 120.825 0.804 1
1 477 . 11 1 1 A 39 39 ASP H H 39 8.512 8.671 -0.159 1
1 478 . 11 1 1 A 39 39 ASP HA H 39 4.606 4.668 -0.062 1
1 481 . 11 1 1 A 39 39 ASP C C 39 176.557 176.439 0.118 1
1 482 . 11 1 1 A 39 39 ASP CA C 39 54.833 54.975 -0.142 1
1 483 . 11 1 1 A 39 39 ASP CB C 39 41.123 41.436 -0.313 1
1 484 . 11 1 1 A 39 39 ASP N N 39 120.305 122.961 -2.656 1
1 485 . 11 1 1 A 40 40 GLU H H 40 8.311 7.984 0.327 1
1 486 . 11 1 1 A 40 40 GLU HA H 40 4.235 4.367 -0.132 1
1 491 . 11 1 1 A 40 40 GLU C C 40 175.327 176.054 -0.727 1
1 492 . 11 1 1 A 40 40 GLU CA C 40 56.215 56.792 -0.577 1
1 493 . 11 1 1 A 40 40 GLU CB C 40 30.788 30.295 0.493 1
1 495 . 11 1 1 A 40 40 GLU N N 40 120.680 118.979 1.701 1
1 496 . 11 1 1 A 41 41 ILE H H 41 8.465 8.853 -0.388 1
1 497 . 11 1 1 A 41 41 ILE HA H 41 4.127 4.616 -0.489 1
1 507 . 11 1 1 A 41 41 ILE C C 41 175.380 175.543 -0.163 1
1 508 . 11 1 1 A 41 41 ILE CA C 41 60.670 59.596 1.074 1
1 509 . 11 1 1 A 41 41 ILE CB C 41 38.805 40.501 -1.696 1
1 513 . 11 1 1 A 41 41 ILE N N 41 123.665 123.960 -0.295 1
1 514 . 11 1 1 A 42 42 LYS H H 42 9.556 8.969 0.587 1
1 515 . 11 1 1 A 42 42 LYS HA H 42 4.428 4.431 -0.003 1
1 524 . 11 1 1 A 42 42 LYS C C 42 177.277 176.675 0.602 1
1 525 . 11 1 1 A 42 42 LYS CA C 42 57.274 57.559 -0.285 1
1 526 . 11 1 1 A 42 42 LYS CB C 42 35.169 33.101 2.068 1
1 530 . 11 1 1 A 42 42 LYS N N 42 125.597 123.890 1.707 1
1 531 . 11 1 1 A 43 43 GLU H H 43 7.809 7.747 0.062 1
1 532 . 11 1 1 A 43 43 GLU HA H 43 4.886 4.983 -0.097 1
1 537 . 11 1 1 A 43 43 GLU C C 43 173.593 174.005 -0.412 1
1 538 . 11 1 1 A 43 43 GLU CA C 43 54.669 55.004 -0.335 1
1 539 . 11 1 1 A 43 43 GLU CB C 43 32.882 34.432 -1.550 1
1 541 . 11 1 1 A 43 43 GLU N N 43 115.292 117.191 -1.899 1
1 542 . 11 1 1 A 44 44 ARG H H 44 8.879 9.205 -0.326 1
1 543 . 11 1 1 A 44 44 ARG HA H 44 4.917 4.892 0.025 1
1 551 . 11 1 1 A 44 44 ARG C C 44 173.708 174.514 -0.806 1
1 552 . 11 1 1 A 44 44 ARG CA C 44 55.965 54.672 1.293 1
1 553 . 11 1 1 A 44 44 ARG CB C 44 33.579 32.417 1.162 1
1 556 . 11 1 1 A 44 44 ARG N N 44 118.233 124.111 -5.878 1
1 558 . 11 1 1 A 45 45 THR H H 45 8.892 9.220 -0.328 1
1 559 . 11 1 1 A 45 45 THR HA H 45 5.308 5.277 0.031 1
1 564 . 11 1 1 A 45 45 THR C C 45 173.357 173.309 0.048 1
1 565 . 11 1 1 A 45 45 THR CA C 45 60.939 62.146 -1.207 1
1 566 . 11 1 1 A 45 45 THR CB C 45 70.054 69.652 0.402 1
1 568 . 11 1 1 A 45 45 THR N N 45 118.457 122.025 -3.568 1
1 569 . 11 1 1 A 46 46 TYR H H 46 9.625 9.509 0.116 1
1 570 . 11 1 1 A 46 46 TYR HA H 46 4.771 5.082 -0.311 1
1 578 . 11 1 1 A 46 46 TYR C C 46 173.735 174.933 -1.198 1
1 579 . 11 1 1 A 46 46 TYR CA C 46 57.480 56.476 1.004 1
1 580 . 11 1 1 A 46 46 TYR CB C 46 41.724 41.465 0.259 1
1 585 . 11 1 1 A 46 46 TYR N N 46 125.916 126.264 -0.348 1
1 586 . 11 1 1 A 47 47 ASP H H 47 9.006 9.081 -0.075 1
1 587 . 11 1 1 A 47 47 ASP HA H 47 5.399 4.898 0.501 1
1 590 . 11 1 1 A 47 47 ASP C C 47 175.094 174.690 0.404 1
1 591 . 11 1 1 A 47 47 ASP CA C 47 53.460 53.666 -0.206 1
1 592 . 11 1 1 A 47 47 ASP CB C 47 41.947 41.510 0.437 1
1 593 . 11 1 1 A 47 47 ASP N N 47 122.109 122.858 -0.749 1
1 594 . 11 1 1 A 48 48 LEU H H 48 9.066 8.528 0.538 1
1 595 . 11 1 1 A 48 48 LEU HA H 48 4.831 4.953 -0.122 1
1 605 . 11 1 1 A 48 48 LEU C C 48 174.977 175.669 -0.692 1
1 606 . 11 1 1 A 48 48 LEU CA C 48 52.724 53.441 -0.717 1
1 607 . 11 1 1 A 48 48 LEU CB C 48 44.844 45.686 -0.842 1
1 611 . 11 1 1 A 48 48 LEU N N 48 121.879 124.994 -3.115 1
1 612 . 11 1 1 A 49 49 LYS H H 49 9.401 8.826 0.575 1
1 613 . 11 1 1 A 49 49 LYS HA H 49 4.477 4.986 -0.509 1
1 622 . 11 1 1 A 49 49 LYS C C 49 176.225 175.600 0.625 1
1 623 . 11 1 1 A 49 49 LYS CA C 49 56.017 54.596 1.421 1
1 624 . 11 1 1 A 49 49 LYS CB C 49 33.838 35.647 -1.809 1
1 628 . 11 1 1 A 49 49 LYS N N 49 122.218 120.986 1.232 1
1 629 . 11 1 1 A 50 50 SER H H 50 8.266 8.798 -0.532 1
1 630 . 11 1 1 A 50 50 SER HA H 50 5.222 5.072 0.150 1
1 633 . 11 1 1 A 50 50 SER C C 50 175.570 174.435 1.135 1
1 634 . 11 1 1 A 50 50 SER CA C 50 55.770 58.130 -2.360 1
1 635 . 11 1 1 A 50 50 SER CB C 50 64.738 65.600 -0.862 1
1 636 . 11 1 1 A 50 50 SER N N 50 117.388 118.639 -1.251 1
1 637 . 11 1 1 A 51 51 LYS H H 51 9.276 8.621 0.655 1
1 638 . 11 1 1 A 51 51 LYS HA H 51 4.208 3.997 0.211 1
1 647 . 11 1 1 A 51 51 LYS C C 51 178.773 179.381 -0.608 1
1 648 . 11 1 1 A 51 51 LYS CA C 51 58.674 59.302 -0.628 1
1 649 . 11 1 1 A 51 51 LYS CB C 51 33.383 32.166 1.217 1
1 653 . 11 1 1 A 51 51 LYS N N 51 130.550 126.344 4.206 1
1 654 . 11 1 1 A 52 52 GLY H H 52 8.320 8.512 -0.192 1
1 655 . 11 1 1 A 52 52 GLY HA2 H 52 3.875 3.685 0.190 1
1 656 . 11 1 1 A 52 52 GLY HA3 H 52 3.628 3.724 -0.096 1
1 657 . 11 1 1 A 52 52 GLY C C 52 175.108 175.929 -0.821 1
1 658 . 11 1 1 A 52 52 GLY CA C 52 46.322 47.130 -0.808 1
1 659 . 11 1 1 A 52 52 GLY N N 52 107.053 108.361 -1.308 1
1 660 . 11 1 1 A 53 53 GLN H H 53 7.859 7.765 0.094 1
1 661 . 11 1 1 A 53 53 GLN HA H 53 4.409 4.329 0.080 1
1 668 . 11 1 1 A 53 53 GLN C C 53 176.469 176.014 0.455 1
1 669 . 11 1 1 A 53 53 GLN CA C 53 54.911 55.137 -0.226 1
1 670 . 11 1 1 A 53 53 GLN CB C 53 29.675 28.822 0.853 1
1 673 . 11 1 1 A 53 53 GLN N N 53 115.482 120.725 -5.243 1
1 675 . 11 1 1 A 54 54 GLY H H 54 7.992 8.314 -0.322 1
1 676 . 11 1 1 A 54 54 GLY HA2 H 54 3.934 3.924 0.010 1
1 677 . 11 1 1 A 54 54 GLY HA3 H 54 3.934 3.936 -0.002 1
1 678 . 11 1 1 A 54 54 GLY C C 54 173.897 173.955 -0.058 1
1 679 . 11 1 1 A 54 54 GLY CA C 54 46.574 46.512 0.062 1
1 680 . 11 1 1 A 54 54 GLY N N 54 110.111 109.672 0.439 1
1 681 . 11 1 1 A 55 55 ARG H H 55 7.652 7.879 -0.227 1
1 682 . 11 1 1 A 55 55 ARG HA H 55 4.665 4.962 -0.297 1
1 690 . 11 1 1 A 55 55 ARG C C 55 174.649 175.032 -0.383 1
1 691 . 11 1 1 A 55 55 ARG CA C 55 54.631 54.174 0.457 1
1 692 . 11 1 1 A 55 55 ARG CB C 55 32.166 34.178 -2.012 1
1 695 . 11 1 1 A 55 55 ARG N N 55 114.214 119.173 -4.959 1
1 697 . 11 1 1 A 56 56 MET H H 56 8.593 8.518 0.075 1
1 698 . 11 1 1 A 56 56 MET HA H 56 5.012 5.059 -0.047 1
1 703 . 11 1 1 A 56 56 MET C C 56 176.216 175.919 0.297 1
1 704 . 11 1 1 A 56 56 MET CA C 56 54.595 53.968 0.627 1
1 705 . 11 1 1 A 56 56 MET CB C 56 33.466 34.264 -0.798 1
1 707 . 11 1 1 A 56 56 MET N N 56 121.270 119.748 1.522 1
1 708 . 11 1 1 A 57 57 ILE H H 57 9.393 9.106 0.287 1
1 709 . 11 1 1 A 57 57 ILE HA H 57 4.717 4.412 0.305 1
1 719 . 11 1 1 A 57 57 ILE C C 57 173.883 173.955 -0.072 1
1 720 . 11 1 1 A 57 57 ILE CA C 57 59.713 58.573 1.140 1
1 721 . 11 1 1 A 57 57 ILE CB C 57 40.933 40.769 0.164 1
1 725 . 11 1 1 A 57 57 ILE N N 57 120.811 116.236 4.575 1
1 726 . 11 1 1 A 58 58 GLN H H 58 8.218 7.994 0.224 1
1 727 . 11 1 1 A 58 58 GLN HA H 58 5.407 4.567 0.840 1
1 734 . 11 1 1 A 58 58 GLN C C 58 175.368 174.456 0.912 1
1 735 . 11 1 1 A 58 58 GLN CA C 58 55.163 55.122 0.041 1
1 736 . 11 1 1 A 58 58 GLN CB C 58 30.841 28.781 2.060 1
1 739 . 11 1 1 A 58 58 GLN N N 58 122.281 122.619 -0.338 1
1 741 . 11 1 1 A 59 59 VAL H H 59 9.188 8.392 0.796 1
1 742 . 11 1 1 A 59 59 VAL HA H 59 5.025 4.986 0.039 1
1 750 . 11 1 1 A 59 59 VAL C C 59 175.330 175.356 -0.026 1
1 751 . 11 1 1 A 59 59 VAL CA C 59 59.975 61.498 -1.523 1
1 752 . 11 1 1 A 59 59 VAL CB C 59 34.818 32.223 2.595 1
1 755 . 11 1 1 A 59 59 VAL N N 59 122.421 126.699 -4.278 1
1 756 . 11 1 1 A 60 60 SER H H 60 9.022 8.834 0.188 1
1 757 . 11 1 1 A 60 60 SER HA H 60 5.811 5.149 0.662 1
1 760 . 11 1 1 A 60 60 SER C C 60 173.234 174.114 -0.880 1
1 761 . 11 1 1 A 60 60 SER CA C 60 57.634 57.837 -0.203 1
1 762 . 11 1 1 A 60 60 SER CB C 60 64.891 63.930 0.961 1
1 763 . 11 1 1 A 60 60 SER N N 60 124.709 125.169 -0.460 1
1 764 . 11 1 1 A 61 61 ILE H H 61 9.226 8.678 0.548 1
1 765 . 11 1 1 A 61 61 ILE HA H 61 5.572 5.174 0.398 1
1 775 . 11 1 1 A 61 61 ILE C C 61 173.955 173.980 -0.025 1
1 776 . 11 1 1 A 61 61 ILE CA C 61 56.937 57.211 -0.274 1
1 777 . 11 1 1 A 61 61 ILE CB C 61 39.596 39.422 0.174 1
1 781 . 11 1 1 A 61 61 ILE N N 61 121.648 121.096 0.552 1
1 782 . 11 1 1 A 62 62 PRO HA H 62 4.606 4.523 0.083 1
1 789 . 11 1 1 A 62 62 PRO C C 62 178.143 177.159 0.984 1
1 790 . 11 1 1 A 62 62 PRO CA C 62 63.740 62.841 0.899 1
1 791 . 11 1 1 A 62 62 PRO CB C 62 33.303 32.761 0.542 1
1 794 . 11 1 1 A 63 63 ALA H H 63 7.803 8.388 -0.585 1
1 795 . 11 1 1 A 63 63 ALA HA H 63 4.037 4.048 -0.011 1
1 799 . 11 1 1 A 63 63 ALA C C 63 175.942 179.186 -3.244 1
1 800 . 11 1 1 A 63 63 ALA CA C 63 54.417 54.702 -0.285 1
1 801 . 11 1 1 A 63 63 ALA CB C 63 19.345 18.202 1.143 1
1 802 . 11 1 1 A 63 63 ALA N N 63 123.695 126.902 -3.207 1
1 803 . 11 1 1 A 64 64 SER H H 64 7.719 7.908 -0.189 1
1 804 . 11 1 1 A 64 64 SER HA H 64 4.097 4.351 -0.254 1
1 807 . 11 1 1 A 64 64 SER C C 64 175.199 174.316 0.883 1
1 808 . 11 1 1 A 64 64 SER CA C 64 59.474 60.712 -1.238 1
1 809 . 11 1 1 A 64 64 SER CB C 64 62.125 63.440 -1.315 1
1 810 . 11 1 1 A 64 64 SER N N 64 110.001 111.399 -1.398 1
1 811 . 11 1 1 A 65 65 VAL H H 65 7.790 7.656 0.134 1
1 812 . 11 1 1 A 65 65 VAL HA H 65 4.360 4.218 0.142 1
1 820 . 11 1 1 A 65 65 VAL C C 65 174.433 174.516 -0.083 1
1 821 . 11 1 1 A 65 65 VAL CA C 65 60.335 59.536 0.799 1
1 822 . 11 1 1 A 65 65 VAL CB C 65 32.714 32.302 0.412 1
1 825 . 11 1 1 A 65 65 VAL N N 65 126.142 122.060 4.082 1
1 826 . 11 1 1 A 66 66 PRO HA H 66 4.369 4.590 -0.221 1
1 833 . 11 1 1 A 66 66 PRO C C 66 177.412 175.925 1.487 1
1 834 . 11 1 1 A 66 66 PRO CA C 66 63.104 62.147 0.957 1
1 835 . 11 1 1 A 66 66 PRO CB C 66 32.558 32.824 -0.266 1
1 838 . 11 1 1 A 67 67 LEU H H 67 8.578 8.407 0.171 1
1 839 . 11 1 1 A 67 67 LEU HA H 67 3.875 4.569 -0.694 1
1 849 . 11 1 1 A 67 67 LEU C C 67 176.077 175.823 0.254 1
1 850 . 11 1 1 A 67 67 LEU CA C 67 56.413 54.897 1.516 1
1 851 . 11 1 1 A 67 67 LEU CB C 67 43.279 43.101 0.178 1
1 855 . 11 1 1 A 67 67 LEU N N 67 124.236 122.810 1.426 1
1 856 . 11 1 1 A 68 68 LYS H H 68 7.994 8.810 -0.816 1
1 857 . 11 1 1 A 68 68 LYS HA H 68 3.793 3.962 -0.169 1
1 866 . 11 1 1 A 68 68 LYS C C 68 175.601 176.011 -0.410 1
1 867 . 11 1 1 A 68 68 LYS CA C 68 53.350 57.644 -4.294 1
1 868 . 11 1 1 A 68 68 LYS CB C 68 31.035 32.501 -1.466 1
1 872 . 11 1 1 A 68 68 LYS N N 68 124.053 125.791 -1.738 1
1 873 . 11 1 1 A 69 69 GLU H H 69 8.347 7.845 0.502 1
1 874 . 11 1 1 A 69 69 GLU HA H 69 4.501 3.981 0.520 1
1 879 . 11 1 1 A 69 69 GLU C C 69 175.304 175.553 -0.249 1
1 880 . 11 1 1 A 69 69 GLU CA C 69 54.291 57.329 -3.038 1
1 881 . 11 1 1 A 69 69 GLU CB C 69 29.285 27.628 1.657 1
1 883 . 11 1 1 A 69 69 GLU N N 69 123.876 116.355 7.521 1
1 884 . 11 1 1 A 70 70 PHE H H 70 5.549 6.625 -1.076 1
1 885 . 11 1 1 A 70 70 PHE HA H 70 4.592 4.247 0.345 1
1 893 . 11 1 1 A 70 70 PHE C C 70 174.443 175.050 -0.607 1
1 894 . 11 1 1 A 70 70 PHE CA C 70 53.313 57.459 -4.146 1
1 895 . 11 1 1 A 70 70 PHE CB C 70 38.335 38.831 -0.496 1
1 901 . 11 1 1 A 70 70 PHE N N 70 117.781 116.861 0.920 1
1 902 . 11 1 1 A 71 71 ASP H H 71 8.791 8.615 0.176 1
1 903 . 11 1 1 A 71 71 ASP HA H 71 4.535 4.710 -0.175 1
1 906 . 11 1 1 A 71 71 ASP C C 71 175.867 176.029 -0.162 1
1 907 . 11 1 1 A 71 71 ASP CA C 71 54.248 54.420 -0.172 1
1 908 . 11 1 1 A 71 71 ASP CB C 71 41.166 41.373 -0.207 1
1 909 . 11 1 1 A 71 71 ASP N N 71 120.385 121.191 -0.806 1
1 910 . 11 1 1 A 72 72 TYR H H 72 8.701 8.691 0.010 1
1 911 . 11 1 1 A 72 72 TYR HA H 72 4.283 4.499 -0.216 1
1 918 . 11 1 1 A 72 72 TYR C C 72 177.470 176.417 1.053 1
1 919 . 11 1 1 A 72 72 TYR CA C 72 60.513 59.769 0.744 1
1 920 . 11 1 1 A 72 72 TYR CB C 72 38.320 38.368 -0.048 1
1 925 . 11 1 1 A 72 72 TYR N N 72 121.876 123.595 -1.719 1
1 926 . 11 1 1 A 73 73 ASN H H 73 8.819 9.190 -0.371 1
1 927 . 11 1 1 A 73 73 ASN HA H 73 4.096 4.144 -0.048 1
1 932 . 11 1 1 A 73 73 ASN C C 73 174.362 174.291 0.071 1
1 933 . 11 1 1 A 73 73 ASN CA C 73 54.289 54.027 0.262 1
1 934 . 11 1 1 A 73 73 ASN CB C 73 36.907 36.265 0.642 1
1 936 . 11 1 1 A 73 73 ASN N N 73 121.726 119.458 2.268 1
1 938 . 11 1 1 A 74 74 ALA H H 74 8.059 7.569 0.490 1
1 939 . 11 1 1 A 74 74 ALA HA H 74 4.100 4.395 -0.295 1
1 943 . 11 1 1 A 74 74 ALA C C 74 177.757 177.268 0.489 1
1 944 . 11 1 1 A 74 74 ALA CA C 74 53.153 51.956 1.197 1
1 945 . 11 1 1 A 74 74 ALA CB C 74 19.412 19.757 -0.345 1
1 946 . 11 1 1 A 74 74 ALA N N 74 122.292 120.169 2.123 1
1 947 . 11 1 1 A 75 75 ARG H H 75 8.500 8.445 0.055 1
1 948 . 11 1 1 A 75 75 ARG HA H 75 4.758 4.557 0.201 1
1 955 . 11 1 1 A 75 75 ARG C C 75 176.812 176.016 0.796 1
1 956 . 11 1 1 A 75 75 ARG CA C 75 56.646 56.171 0.475 1
1 957 . 11 1 1 A 75 75 ARG CB C 75 29.375 30.691 -1.316 1
1 960 . 11 1 1 A 75 75 ARG N N 75 122.871 121.455 1.416 1
1 961 . 11 1 1 A 76 76 VAL H H 76 7.965 8.870 -0.905 1
1 962 . 11 1 1 A 76 76 VAL HA H 76 5.230 4.835 0.395 1
1 970 . 11 1 1 A 76 76 VAL C C 76 173.758 174.798 -1.040 1
1 971 . 11 1 1 A 76 76 VAL CA C 76 58.193 59.079 -0.886 1
1 972 . 11 1 1 A 76 76 VAL CB C 76 36.536 35.358 1.178 1
1 975 . 11 1 1 A 76 76 VAL N N 76 116.220 118.494 -2.274 1
1 976 . 11 1 1 A 77 77 GLU H H 77 9.166 9.173 -0.007 1
1 977 . 11 1 1 A 77 77 GLU HA H 77 4.663 4.977 -0.314 1
1 982 . 11 1 1 A 77 77 GLU C C 77 174.940 174.712 0.228 1
1 983 . 11 1 1 A 77 77 GLU CA C 77 53.546 54.381 -0.835 1
1 984 . 11 1 1 A 77 77 GLU CB C 77 33.395 33.595 -0.200 1
1 986 . 11 1 1 A 77 77 GLU N N 77 116.413 121.742 -5.329 1
1 987 . 11 1 1 A 78 78 LEU H H 78 8.670 9.032 -0.362 1
1 988 . 11 1 1 A 78 78 LEU HA H 78 4.677 4.956 -0.279 1
1 998 . 11 1 1 A 78 78 LEU C C 78 176.036 176.014 0.022 1
1 999 . 11 1 1 A 78 78 LEU CA C 78 53.091 53.405 -0.314 1
1 1000 . 11 1 1 A 78 78 LEU CB C 78 43.276 43.898 -0.622 1
1 1004 . 11 1 1 A 78 78 LEU N N 78 117.927 124.279 -6.352 1
1 1005 . 11 1 1 A 79 79 ILE H H 79 7.900 8.907 -1.007 1
1 1006 . 11 1 1 A 79 79 ILE HA H 79 4.312 4.321 -0.009 1
1 1016 . 11 1 1 A 79 79 ILE C C 79 175.179 175.957 -0.778 1
1 1017 . 11 1 1 A 79 79 ILE CA C 79 58.294 60.329 -2.035 1
1 1018 . 11 1 1 A 79 79 ILE CB C 79 36.086 37.131 -1.045 1
1 1022 . 11 1 1 A 79 79 ILE N N 79 121.667 124.455 -2.788 1
1 1023 . 11 1 1 A 80 80 ASN H H 80 9.412 8.861 0.551 1
1 1024 . 11 1 1 A 80 80 ASN HA H 80 4.516 4.245 0.271 1
1 1029 . 11 1 1 A 80 80 ASN C C 80 170.300 173.622 -3.322 1
1 1030 . 11 1 1 A 80 80 ASN CA C 80 54.198 53.818 0.380 1
1 1031 . 11 1 1 A 80 80 ASN CB C 80 37.450 37.119 0.331 1
1 1033 . 11 1 1 A 80 80 ASN N N 80 123.831 122.898 0.933 1
1 1035 . 11 1 1 A 81 81 PRO HA H 81 5.185 4.912 0.273 1
1 1042 . 11 1 1 A 81 81 PRO C C 81 176.865 176.308 0.557 1
1 1043 . 11 1 1 A 81 81 PRO CA C 81 62.637 62.234 0.403 1
1 1044 . 11 1 1 A 81 81 PRO CB C 81 32.965 32.018 0.947 1
1 1047 . 11 1 1 A 82 82 ILE H H 82 9.374 8.532 0.842 1
1 1048 . 11 1 1 A 82 82 ILE HA H 82 4.524 4.953 -0.429 1
1 1058 . 11 1 1 A 82 82 ILE C C 82 174.731 174.561 0.170 1
1 1059 . 11 1 1 A 82 82 ILE CA C 82 60.205 58.583 1.622 1
1 1060 . 11 1 1 A 82 82 ILE CB C 82 41.737 41.179 0.558 1
1 1064 . 11 1 1 A 82 82 ILE N N 82 121.658 117.869 3.789 1
1 1065 . 11 1 1 A 83 83 ALA H H 83 8.819 8.660 0.159 1
1 1066 . 11 1 1 A 83 83 ALA HA H 83 4.773 4.623 0.150 1
1 1070 . 11 1 1 A 83 83 ALA C C 83 176.550 176.798 -0.248 1
1 1071 . 11 1 1 A 83 83 ALA CA C 83 52.069 51.952 0.117 1
1 1072 . 11 1 1 A 83 83 ALA CB C 83 20.374 19.016 1.358 1
1 1073 . 11 1 1 A 83 83 ALA N N 83 127.933 128.457 -0.524 1
1 1074 . 11 1 1 A 84 84 ASP H H 84 8.710 8.769 -0.059 1
1 1075 . 11 1 1 A 84 84 ASP HA H 84 4.894 4.762 0.132 1
1 1078 . 11 1 1 A 84 84 ASP C C 84 175.997 176.177 -0.180 1
1 1079 . 11 1 1 A 84 84 ASP CA C 84 53.334 54.231 -0.897 1
1 1080 . 11 1 1 A 84 84 ASP CB C 84 42.104 42.012 0.092 1
1 1081 . 11 1 1 A 84 84 ASP N N 84 122.009 124.658 -2.649 1
1 1082 . 11 1 1 A 85 85 THR H H 85 8.349 8.731 -0.382 1
1 1083 . 11 1 1 A 85 85 THR HA H 85 4.420 4.850 -0.430 1
1 1088 . 11 1 1 A 85 85 THR C C 85 175.085 175.234 -0.149 1
1 1089 . 11 1 1 A 85 85 THR CA C 85 62.304 62.058 0.246 1
1 1090 . 11 1 1 A 85 85 THR CB C 85 69.718 70.710 -0.992 1
1 1092 . 11 1 1 A 85 85 THR N N 85 114.986 118.880 -3.894 1
1 1093 . 11 1 1 A 86 86 VAL H H 86 8.188 7.667 0.521 1
1 1094 . 11 1 1 A 86 86 VAL HA H 86 4.021 4.633 -0.612 1
1 1102 . 11 1 1 A 86 86 VAL C C 86 176.519 176.103 0.416 1
1 1103 . 11 1 1 A 86 86 VAL CA C 86 63.046 60.785 2.261 1
1 1104 . 11 1 1 A 86 86 VAL CB C 86 32.526 32.002 0.524 1
1 1107 . 11 1 1 A 86 86 VAL N N 86 122.275 112.133 10.142 1
1 1108 . 11 1 1 A 87 87 ALA H H 87 8.194 7.872 0.322 1
1 1109 . 11 1 1 A 87 87 ALA HA H 87 4.212 4.330 -0.118 1
1 1113 . 11 1 1 A 87 87 ALA C C 87 178.118 178.242 -0.124 1
1 1114 . 11 1 1 A 87 87 ALA CA C 87 53.153 51.284 1.869 1
1 1115 . 11 1 1 A 87 87 ALA CB C 87 19.165 17.521 1.644 1
1 1116 . 11 1 1 A 87 87 ALA N N 87 126.609 126.244 0.365 1
1 1117 . 11 1 1 A 88 88 THR H H 88 7.914 8.318 -0.404 1
1 1118 . 11 1 1 A 88 88 THR HA H 88 4.173 4.148 0.025 1
1 1123 . 11 1 1 A 88 88 THR C C 88 174.516 176.073 -1.557 1
1 1124 . 11 1 1 A 88 88 THR CA C 88 62.785 65.432 -2.647 1
1 1125 . 11 1 1 A 88 88 THR CB C 88 69.582 68.204 1.378 1
1 1127 . 11 1 1 A 88 88 THR N N 88 112.328 115.789 -3.461 1
1 1128 . 11 1 1 A 89 89 ALA H H 89 8.076 8.063 0.013 1
1 1129 . 11 1 1 A 89 89 ALA HA H 89 4.320 3.992 0.328 1
1 1133 . 11 1 1 A 89 89 ALA C C 89 178.014 179.392 -1.378 1
1 1134 . 11 1 1 A 89 89 ALA CA C 89 53.079 55.134 -2.055 1
1 1135 . 11 1 1 A 89 89 ALA CB C 89 19.335 18.048 1.287 1
1 1136 . 11 1 1 A 89 89 ALA N N 89 124.632 124.388 0.244 1
1 1137 . 11 1 1 A 90 90 THR H H 90 7.976 7.417 0.559 1
1 1138 . 11 1 1 A 90 90 THR HA H 90 4.203 4.007 0.196 1
1 1143 . 11 1 1 A 90 90 THR C C 90 174.427 176.380 -1.953 1
1 1144 . 11 1 1 A 90 90 THR CA C 90 62.519 65.074 -2.555 1
1 1145 . 11 1 1 A 90 90 THR CB C 90 69.721 68.983 0.738 1
1 1147 . 11 1 1 A 90 90 THR N N 90 112.047 112.727 -0.680 1
1 1148 . 11 1 1 A 91 91 TYR H H 91 7.959 7.766 0.193 1
1 1149 . 11 1 1 A 91 91 TYR HA H 91 4.564 4.282 0.282 1
1 1156 . 11 1 1 A 91 91 TYR C C 91 175.522 178.258 -2.736 1
1 1157 . 11 1 1 A 91 91 TYR CA C 91 57.874 61.147 -3.273 1
1 1158 . 11 1 1 A 91 91 TYR CB C 91 38.584 37.686 0.898 1
1 1163 . 11 1 1 A 91 91 TYR N N 91 121.184 120.754 0.430 1
1 1164 . 11 1 1 A 92 92 GLN H H 92 8.310 8.423 -0.113 1
1 1165 . 11 1 1 A 92 92 GLN HA H 92 4.258 4.054 0.204 1
1 1172 . 11 1 1 A 92 92 GLN C C 92 176.099 177.690 -1.591 1
1 1173 . 11 1 1 A 92 92 GLN CA C 92 56.109 59.459 -3.350 1
1 1174 . 11 1 1 A 92 92 GLN CB C 92 29.112 28.586 0.526 1
1 1177 . 11 1 1 A 92 92 GLN N N 92 121.631 120.812 0.819 1
1 1179 . 11 1 1 A 93 93 GLY H H 93 8.052 7.658 0.394 1
1 1180 . 11 1 1 A 93 93 GLY HA2 H 93 4.023 3.964 0.059 1
1 1181 . 11 1 1 A 93 93 GLY HA3 H 93 3.856 3.973 -0.117 1
1 1182 . 11 1 1 A 93 93 GLY C C 93 173.791 173.727 0.064 1
1 1183 . 11 1 1 A 93 93 GLY CA C 93 45.382 45.217 0.165 1
1 1184 . 11 1 1 A 93 93 GLY N N 93 109.847 106.854 2.993 1
1 1185 . 11 1 1 A 94 94 ALA H H 94 8.162 8.032 0.130 1
1 1186 . 11 1 1 A 94 94 ALA HA H 94 4.329 4.065 0.264 1
1 1190 . 11 1 1 A 94 94 ALA C C 94 177.392 175.620 1.772 1
1 1191 . 11 1 1 A 94 94 ALA CA C 94 52.558 53.473 -0.915 1
1 1192 . 11 1 1 A 94 94 ALA CB C 94 19.526 17.685 1.841 1
1 1193 . 11 1 1 A 94 94 ALA N N 94 123.424 119.184 4.240 1
1 1194 . 11 1 1 A 95 95 ASP H H 95 8.457 7.714 0.743 1
1 1195 . 11 1 1 A 95 95 ASP HA H 95 4.608 4.871 -0.263 1
1 1198 . 11 1 1 A 95 95 ASP C C 95 175.630 176.607 -0.977 1
1 1199 . 11 1 1 A 95 95 ASP CA C 95 54.450 53.377 1.073 1
1 1200 . 11 1 1 A 95 95 ASP CB C 95 40.871 41.958 -1.087 1
1 1201 . 11 1 1 A 95 95 ASP N N 95 118.814 117.516 1.298 1
1 1202 . 11 1 1 A 96 96 VAL H H 96 7.776 8.550 -0.774 1
1 1203 . 11 1 1 A 96 96 VAL HA H 96 4.141 4.606 -0.465 1
1 1211 . 11 1 1 A 96 96 VAL C C 96 175.301 175.765 -0.464 1
1 1212 . 11 1 1 A 96 96 VAL CA C 96 61.435 62.152 -0.717 1
1 1213 . 11 1 1 A 96 96 VAL CB C 96 33.517 32.871 0.646 1
1 1216 . 11 1 1 A 96 96 VAL N N 96 118.395 126.979 -8.584 1
1 1217 . 11 1 1 A 97 97 ASP H H 97 8.315 7.739 0.576 1
1 1218 . 11 1 1 A 97 97 ASP HA H 97 4.681 4.657 0.024 1
1 1221 . 11 1 1 A 97 97 ASP C C 97 175.151 176.319 -1.168 1
1 1222 . 11 1 1 A 97 97 ASP CA C 97 54.324 54.568 -0.244 1
1 1223 . 11 1 1 A 97 97 ASP CB C 97 41.963 41.284 0.679 1
1 1224 . 11 1 1 A 97 97 ASP N N 97 123.905 122.284 1.621 1
1 1225 . 11 1 1 A 98 98 TRP H H 98 8.210 8.882 -0.672 1
1 1226 . 11 1 1 A 98 98 TRP HA H 98 4.916 4.662 0.254 1
1 1235 . 11 1 1 A 98 98 TRP C C 98 174.585 176.010 -1.425 1
1 1236 . 11 1 1 A 98 98 TRP CA C 98 56.164 57.226 -1.062 1
1 1237 . 11 1 1 A 98 98 TRP CB C 98 31.466 29.829 1.637 1
1 1243 . 11 1 1 A 98 98 TRP N N 98 120.340 124.332 -3.992 1
1 1245 . 11 1 1 A 99 99 TYR H H 99 8.760 9.114 -0.354 1
1 1246 . 11 1 1 A 99 99 TYR HA H 99 5.119 5.490 -0.371 1
1 1253 . 11 1 1 A 99 99 TYR C C 99 174.599 175.016 -0.417 1
1 1254 . 11 1 1 A 99 99 TYR CA C 99 57.021 57.439 -0.418 1
1 1255 . 11 1 1 A 99 99 TYR CB C 99 39.526 39.956 -0.430 1
1 1260 . 11 1 1 A 99 99 TYR N N 99 123.319 123.017 0.302 1
1 1261 . 11 1 1 A 100 100 ILE H H 100 8.936 9.212 -0.276 1
1 1262 . 11 1 1 A 100 100 ILE HA H 100 4.850 4.882 -0.032 1
1 1272 . 11 1 1 A 100 100 ILE C C 100 175.070 175.441 -0.371 1
1 1273 . 11 1 1 A 100 100 ILE CA C 100 58.998 60.264 -1.266 1
1 1274 . 11 1 1 A 100 100 ILE CB C 100 40.667 37.908 2.759 1
1 1278 . 11 1 1 A 100 100 ILE N N 100 123.281 124.991 -1.710 1
1 1279 . 11 1 1 A 101 101 LYS H H 101 8.987 8.899 0.088 1
1 1280 . 11 1 1 A 101 101 LYS HA H 101 5.313 4.811 0.502 1
1 1289 . 11 1 1 A 101 101 LYS C C 101 174.440 176.165 -1.725 1
1 1290 . 11 1 1 A 101 101 LYS CA C 101 54.763 56.258 -1.495 1
1 1291 . 11 1 1 A 101 101 LYS CB C 101 34.880 33.158 1.722 1
1 1295 . 11 1 1 A 101 101 LYS N N 101 126.210 127.559 -1.349 1
1 1296 . 11 1 1 A 102 102 ALA H H 102 8.531 8.331 0.200 1
1 1297 . 11 1 1 A 102 102 ALA HA H 102 4.957 5.158 -0.201 1
1 1301 . 11 1 1 A 102 102 ALA C C 102 175.024 177.771 -2.747 1
1 1302 . 11 1 1 A 102 102 ALA CA C 102 50.701 50.342 0.359 1
1 1303 . 11 1 1 A 102 102 ALA CB C 102 21.618 23.267 -1.649 1
1 1304 . 11 1 1 A 102 102 ALA N N 102 121.424 125.653 -4.229 1
1 1305 . 11 1 1 A 103 103 ASP H H 103 8.339 9.365 -1.026 1
1 1306 . 11 1 1 A 103 103 ASP HA H 103 4.603 4.546 0.057 1
1 1309 . 11 1 1 A 103 103 ASP C C 103 176.188 175.289 0.899 1
1 1310 . 11 1 1 A 103 103 ASP CA C 103 56.049 55.796 0.253 1
1 1311 . 11 1 1 A 103 103 ASP CB C 103 40.932 42.103 -1.171 1
1 1312 . 11 1 1 A 103 103 ASP N N 103 117.773 119.773 -2.000 1
1 1313 . 11 1 1 A 104 104 ASP H H 104 7.482 7.707 -0.225 1
1 1314 . 11 1 1 A 104 104 ASP HA H 104 4.727 4.925 -0.198 1
1 1317 . 11 1 1 A 104 104 ASP C C 104 174.261 173.624 0.637 1
1 1318 . 11 1 1 A 104 104 ASP CA C 104 52.768 53.791 -1.023 1
1 1319 . 11 1 1 A 104 104 ASP CB C 104 42.587 43.952 -1.365 1
1 1320 . 11 1 1 A 104 104 ASP N N 104 110.673 116.251 -5.578 1
1 1321 . 11 1 1 A 105 105 ILE H H 105 9.267 8.626 0.641 1
1 1322 . 11 1 1 A 105 105 ILE HA H 105 4.631 4.789 -0.158 1
1 1332 . 11 1 1 A 105 105 ILE C C 105 173.922 175.568 -1.646 1
1 1333 . 11 1 1 A 105 105 ILE CA C 105 61.114 60.343 0.771 1
1 1334 . 11 1 1 A 105 105 ILE CB C 105 42.522 39.851 2.671 1
1 1338 . 11 1 1 A 105 105 ILE N N 105 121.380 122.713 -1.333 1
1 1339 . 11 1 1 A 106 106 VAL H H 106 8.592 8.977 -0.385 1
1 1340 . 11 1 1 A 106 106 VAL HA H 106 4.975 5.029 -0.054 1
1 1348 . 11 1 1 A 106 106 VAL C C 106 175.049 175.311 -0.262 1
1 1349 . 11 1 1 A 106 106 VAL CA C 106 58.028 59.982 -1.954 1
1 1350 . 11 1 1 A 106 106 VAL CB C 106 35.388 34.804 0.584 1
1 1353 . 11 1 1 A 106 106 VAL N N 106 116.356 121.925 -5.569 1
1 1354 . 11 1 1 A 107 107 LEU H H 107 8.360 8.405 -0.045 1
1 1355 . 11 1 1 A 107 107 LEU HA H 107 4.167 4.460 -0.293 1
1 1365 . 11 1 1 A 107 107 LEU C C 107 178.338 177.299 1.039 1
1 1366 . 11 1 1 A 107 107 LEU CA C 107 55.077 53.767 1.310 1
1 1367 . 11 1 1 A 107 107 LEU CB C 107 42.394 42.396 -0.002 1
1 1371 . 11 1 1 A 107 107 LEU N N 107 121.368 122.169 -0.801 1
1 1372 . 11 1 1 A 108 108 THR H H 108 7.977 8.734 -0.757 1
1 1373 . 11 1 1 A 108 108 THR HA H 108 4.039 4.545 -0.506 1
1 1378 . 11 1 1 A 108 108 THR C C 108 174.725 174.981 -0.256 1
1 1379 . 11 1 1 A 108 108 THR CA C 108 63.513 62.457 1.056 1
1 1380 . 11 1 1 A 108 108 THR CB C 108 69.194 69.656 -0.462 1
1 1382 . 11 1 1 A 108 108 THR N N 108 118.728 118.158 0.570 1
1 1383 . 11 1 1 A 109 109 LEU H H 109 8.378 8.824 -0.446 1
1 1384 . 11 1 1 A 109 109 LEU HA H 109 4.274 3.944 0.330 1
1 1394 . 11 1 1 A 109 109 LEU C C 109 177.058 176.474 0.584 1
1 1395 . 11 1 1 A 109 109 LEU CA C 109 55.045 56.237 -1.192 1
1 1396 . 11 1 1 A 109 109 LEU CB C 109 42.620 39.756 2.864 1
1 1400 . 11 1 1 A 109 109 LEU N N 109 124.847 122.376 2.471 1
1 9 . 12 1 1 A 2 2 MET HA H 2 4.554 5.056 -0.502 1
1 14 . 12 1 1 A 2 2 MET C C 2 174.749 176.429 -1.680 1
1 15 . 12 1 1 A 2 2 MET CA C 2 55.354 54.311 1.043 1
1 16 . 12 1 1 A 2 2 MET CB C 2 33.729 36.308 -2.579 1
1 18 . 12 1 1 A 3 3 ARG H H 3 8.518 8.576 -0.058 1
1 19 . 12 1 1 A 3 3 ARG HA H 3 4.531 4.089 0.442 1
1 26 . 12 1 1 A 3 3 ARG C C 3 175.780 176.849 -1.069 1
1 27 . 12 1 1 A 3 3 ARG CA C 3 55.854 58.233 -2.379 1
1 28 . 12 1 1 A 3 3 ARG CB C 3 31.403 29.953 1.450 1
1 31 . 12 1 1 A 3 3 ARG N N 3 124.008 123.213 0.795 1
1 32 . 12 1 1 A 4 4 LEU H H 4 8.424 7.518 0.906 1
1 33 . 12 1 1 A 4 4 LEU HA H 4 4.457 4.298 0.159 1
1 43 . 12 1 1 A 4 4 LEU C C 4 177.362 177.171 0.191 1
1 44 . 12 1 1 A 4 4 LEU CA C 4 54.511 55.902 -1.391 1
1 45 . 12 1 1 A 4 4 LEU CB C 4 42.686 41.623 1.063 1
1 49 . 12 1 1 A 4 4 LEU N N 4 124.389 121.443 2.946 1
1 50 . 12 1 1 A 5 5 ALA H H 5 8.418 8.744 -0.326 1
1 51 . 12 1 1 A 5 5 ALA HA H 5 4.254 3.894 0.360 1
1 55 . 12 1 1 A 5 5 ALA C C 5 177.420 176.617 0.803 1
1 56 . 12 1 1 A 5 5 ALA CA C 5 52.931 55.025 -2.094 1
1 57 . 12 1 1 A 5 5 ALA CB C 5 19.263 16.919 2.344 1
1 58 . 12 1 1 A 5 5 ALA N N 5 124.548 123.097 1.451 1
1 59 . 12 1 1 A 6 6 ASN H H 6 8.287 8.312 -0.025 1
1 60 . 12 1 1 A 6 6 ASN HA H 6 4.616 4.877 -0.261 1
1 65 . 12 1 1 A 6 6 ASN C C 6 175.837 175.448 0.389 1
1 66 . 12 1 1 A 6 6 ASN CA C 6 53.345 52.932 0.413 1
1 67 . 12 1 1 A 6 6 ASN CB C 6 38.571 37.036 1.535 1
1 69 . 12 1 1 A 6 6 ASN N N 6 116.484 116.527 -0.043 1
1 71 . 12 1 1 A 7 7 GLY H H 7 8.351 8.140 0.211 1
1 72 . 12 1 1 A 7 7 GLY HA2 H 7 4.130 4.047 0.083 1
1 73 . 12 1 1 A 7 7 GLY HA3 H 7 3.808 4.047 -0.239 1
1 74 . 12 1 1 A 7 7 GLY C C 7 173.750 174.341 -0.591 1
1 75 . 12 1 1 A 7 7 GLY CA C 7 45.343 46.202 -0.859 1
1 76 . 12 1 1 A 7 7 GLY N N 7 108.453 111.787 -3.334 1
1 77 . 12 1 1 A 8 8 ILE H H 8 7.868 7.498 0.370 1
1 78 . 12 1 1 A 8 8 ILE HA H 8 4.130 4.227 -0.097 1
1 88 . 12 1 1 A 8 8 ILE C C 8 175.570 175.684 -0.114 1
1 89 . 12 1 1 A 8 8 ILE CA C 8 61.095 60.980 0.115 1
1 90 . 12 1 1 A 8 8 ILE CB C 8 38.694 38.621 0.073 1
1 94 . 12 1 1 A 8 8 ILE N N 8 120.848 119.172 1.676 1
1 95 . 12 1 1 A 9 9 VAL H H 9 8.220 8.444 -0.224 1
1 96 . 12 1 1 A 9 9 VAL HA H 9 4.172 3.932 0.240 1
1 104 . 12 1 1 A 9 9 VAL C C 9 175.898 175.822 0.076 1
1 105 . 12 1 1 A 9 9 VAL CA C 9 62.488 63.230 -0.742 1
1 106 . 12 1 1 A 9 9 VAL CB C 9 32.460 31.634 0.826 1
1 109 . 12 1 1 A 9 9 VAL N N 9 125.805 123.538 2.267 1
1 110 . 12 1 1 A 10 10 LEU H H 10 8.437 8.668 -0.231 1
1 111 . 12 1 1 A 10 10 LEU HA H 10 4.347 4.596 -0.249 1
1 121 . 12 1 1 A 10 10 LEU C C 10 176.398 176.597 -0.199 1
1 122 . 12 1 1 A 10 10 LEU CA C 10 54.787 54.011 0.776 1
1 123 . 12 1 1 A 10 10 LEU CB C 10 42.639 42.379 0.260 1
1 127 . 12 1 1 A 10 10 LEU N N 10 127.757 128.959 -1.202 1
1 128 . 12 1 1 A 11 11 ASP H H 11 8.506 8.545 -0.039 1
1 129 . 12 1 1 A 11 11 ASP HA H 11 4.683 4.575 0.108 1
1 132 . 12 1 1 A 11 11 ASP C C 11 176.672 175.330 1.342 1
1 133 . 12 1 1 A 11 11 ASP CA C 11 53.586 53.409 0.177 1
1 134 . 12 1 1 A 11 11 ASP CB C 11 41.123 41.768 -0.645 1
1 135 . 12 1 1 A 11 11 ASP N N 11 121.539 121.393 0.146 1
1 136 . 12 1 1 A 12 12 LYS H H 12 8.578 8.423 0.155 1
1 137 . 12 1 1 A 12 12 LYS HA H 12 3.943 4.629 -0.686 1
1 146 . 12 1 1 A 12 12 LYS C C 12 176.917 174.203 2.714 1
1 147 . 12 1 1 A 12 12 LYS CA C 12 58.542 55.822 2.720 1
1 148 . 12 1 1 A 12 12 LYS CB C 12 32.703 36.351 -3.648 1
1 152 . 12 1 1 A 12 12 LYS N N 12 123.635 119.515 4.120 1
1 153 . 12 1 1 A 13 13 ASP H H 13 8.523 8.647 -0.124 1
1 154 . 12 1 1 A 13 13 ASP HA H 13 4.566 4.719 -0.153 1
1 157 . 12 1 1 A 13 13 ASP C C 13 177.535 176.259 1.276 1
1 158 . 12 1 1 A 13 13 ASP CA C 13 56.034 54.608 1.426 1
1 159 . 12 1 1 A 13 13 ASP CB C 13 41.051 40.493 0.558 1
1 160 . 12 1 1 A 13 13 ASP N N 13 120.448 125.088 -4.640 1
1 161 . 12 1 1 A 14 14 THR H H 14 7.964 8.343 -0.379 1
1 162 . 12 1 1 A 14 14 THR HA H 14 4.146 4.411 -0.265 1
1 167 . 12 1 1 A 14 14 THR C C 14 175.440 173.668 1.772 1
1 168 . 12 1 1 A 14 14 THR CA C 14 63.245 61.527 1.718 1
1 169 . 12 1 1 A 14 14 THR CB C 14 69.092 67.845 1.247 1
1 171 . 12 1 1 A 14 14 THR N N 14 113.711 116.097 -2.386 1
1 172 . 12 1 1 A 15 15 THR H H 15 7.921 7.769 0.152 1
1 173 . 12 1 1 A 15 15 THR HA H 15 3.920 4.814 -0.894 1
1 178 . 12 1 1 A 15 15 THR C C 15 174.750 175.602 -0.852 1
1 179 . 12 1 1 A 15 15 THR CA C 15 64.562 60.141 4.421 1
1 180 . 12 1 1 A 15 15 THR CB C 15 69.166 70.582 -1.416 1
1 182 . 12 1 1 A 15 15 THR N N 15 116.710 116.846 -0.136 1
1 183 . 12 1 1 A 16 16 PHE H H 16 8.191 8.970 -0.779 1
1 184 . 12 1 1 A 16 16 PHE HA H 16 4.628 4.355 0.273 1
1 192 . 12 1 1 A 16 16 PHE C C 16 177.754 176.476 1.278 1
1 193 . 12 1 1 A 16 16 PHE CA C 16 57.975 61.134 -3.159 1
1 194 . 12 1 1 A 16 16 PHE CB C 16 39.553 39.584 -0.031 1
1 200 . 12 1 1 A 16 16 PHE N N 16 117.124 123.574 -6.450 1
1 201 . 12 1 1 A 17 17 GLY H H 17 8.110 7.976 0.134 1
1 202 . 12 1 1 A 17 17 GLY HA2 H 17 4.017 4.125 -0.108 1
1 203 . 12 1 1 A 17 17 GLY HA3 H 17 3.849 4.125 -0.276 1
1 204 . 12 1 1 A 17 17 GLY C C 17 172.231 173.947 -1.716 1
1 205 . 12 1 1 A 17 17 GLY CA C 17 45.633 44.940 0.693 1
1 206 . 12 1 1 A 17 17 GLY N N 17 109.951 105.887 4.064 1
1 207 . 12 1 1 A 18 18 GLU H H 18 8.304 8.479 -0.175 1
1 208 . 12 1 1 A 18 18 GLU HA H 18 4.078 4.386 -0.308 1
1 213 . 12 1 1 A 18 18 GLU C C 18 175.588 176.105 -0.517 1
1 214 . 12 1 1 A 18 18 GLU CA C 18 57.446 56.282 1.164 1
1 215 . 12 1 1 A 18 18 GLU CB C 18 30.767 29.344 1.423 1
1 217 . 12 1 1 A 18 18 GLU N N 18 121.640 121.610 0.030 1
1 218 . 12 1 1 A 19 19 LEU H H 19 8.799 8.773 0.026 1
1 219 . 12 1 1 A 19 19 LEU HA H 19 5.416 4.663 0.753 1
1 229 . 12 1 1 A 19 19 LEU C C 19 176.875 176.265 0.610 1
1 230 . 12 1 1 A 19 19 LEU CA C 19 53.281 54.747 -1.466 1
1 231 . 12 1 1 A 19 19 LEU CB C 19 45.508 42.091 3.417 1
1 235 . 12 1 1 A 19 19 LEU N N 19 127.101 126.344 0.757 1
1 236 . 12 1 1 A 20 20 LYS H H 20 8.494 8.803 -0.309 1
1 237 . 12 1 1 A 20 20 LYS HA H 20 5.200 4.739 0.461 1
1 246 . 12 1 1 A 20 20 LYS C C 20 176.163 175.628 0.535 1
1 247 . 12 1 1 A 20 20 LYS CA C 20 53.575 55.047 -1.472 1
1 248 . 12 1 1 A 20 20 LYS CB C 20 36.835 32.760 4.075 1
1 252 . 12 1 1 A 20 20 LYS N N 20 118.828 125.475 -6.647 1
1 253 . 12 1 1 A 21 21 PHE H H 21 9.658 8.643 1.015 1
1 254 . 12 1 1 A 21 21 PHE HA H 21 4.038 4.606 -0.568 1
1 262 . 12 1 1 A 21 21 PHE C C 21 174.296 174.805 -0.509 1
1 263 . 12 1 1 A 21 21 PHE CA C 21 60.462 59.354 1.108 1
1 264 . 12 1 1 A 21 21 PHE CB C 21 40.359 39.758 0.601 1
1 270 . 12 1 1 A 21 21 PHE N N 21 124.322 127.253 -2.931 1
1 271 . 12 1 1 A 22 22 SER H H 22 7.199 8.572 -1.373 1
1 272 . 12 1 1 A 22 22 SER HA H 22 5.046 4.141 0.905 1
1 275 . 12 1 1 A 22 22 SER C C 22 173.080 174.129 -1.049 1
1 276 . 12 1 1 A 22 22 SER CA C 22 58.547 59.549 -1.002 1
1 277 . 12 1 1 A 22 22 SER CB C 22 63.591 64.246 -0.655 1
1 278 . 12 1 1 A 22 22 SER N N 22 120.109 120.337 -0.228 1
1 279 . 12 1 1 A 23 23 ALA H H 23 7.269 7.247 0.022 1
1 280 . 12 1 1 A 23 23 ALA HA H 23 4.426 4.457 -0.031 1
1 284 . 12 1 1 A 23 23 ALA C C 23 176.568 175.597 0.971 1
1 285 . 12 1 1 A 23 23 ALA CA C 23 52.458 51.191 1.267 1
1 286 . 12 1 1 A 23 23 ALA CB C 23 22.728 23.076 -0.348 1
1 287 . 12 1 1 A 23 23 ALA N N 23 114.102 118.261 -4.159 1
1 288 . 12 1 1 A 24 24 LEU H H 24 8.819 8.906 -0.087 1
1 289 . 12 1 1 A 24 24 LEU HA H 24 4.060 4.431 -0.371 1
1 299 . 12 1 1 A 24 24 LEU C C 24 175.363 176.959 -1.596 1
1 300 . 12 1 1 A 24 24 LEU CA C 24 56.901 54.831 2.070 1
1 301 . 12 1 1 A 24 24 LEU CB C 24 42.065 42.296 -0.231 1
1 305 . 12 1 1 A 24 24 LEU N N 24 120.865 121.895 -1.030 1
1 306 . 12 1 1 A 25 25 ARG H H 25 9.473 8.787 0.686 1
1 307 . 12 1 1 A 25 25 ARG HA H 25 4.428 4.122 0.306 1
1 315 . 12 1 1 A 25 25 ARG C C 25 175.729 175.805 -0.076 1
1 316 . 12 1 1 A 25 25 ARG CA C 25 56.721 58.406 -1.685 1
1 317 . 12 1 1 A 25 25 ARG CB C 25 31.109 31.162 -0.053 1
1 320 . 12 1 1 A 25 25 ARG N N 25 130.455 127.918 2.537 1
1 322 . 12 1 1 A 26 26 ARG H H 26 7.711 7.333 0.378 1
1 323 . 12 1 1 A 26 26 ARG HA H 26 4.559 4.596 -0.037 1
1 330 . 12 1 1 A 26 26 ARG C C 26 173.724 173.570 0.154 1
1 331 . 12 1 1 A 26 26 ARG CA C 26 55.737 55.565 0.172 1
1 332 . 12 1 1 A 26 26 ARG CB C 26 33.261 34.186 -0.925 1
1 335 . 12 1 1 A 26 26 ARG N N 26 113.305 118.352 -5.047 1
1 336 . 12 1 1 A 27 27 GLU H H 27 8.848 8.625 0.223 1
1 337 . 12 1 1 A 27 27 GLU HA H 27 4.615 4.776 -0.161 1
1 342 . 12 1 1 A 27 27 GLU C C 27 174.836 175.663 -0.827 1
1 343 . 12 1 1 A 27 27 GLU CA C 27 55.901 55.323 0.578 1
1 344 . 12 1 1 A 27 27 GLU CB C 27 30.755 30.367 0.388 1
1 346 . 12 1 1 A 27 27 GLU N N 27 121.934 124.822 -2.888 1
1 347 . 12 1 1 A 28 28 VAL H H 28 8.603 8.129 0.474 1
1 348 . 12 1 1 A 28 28 VAL HA H 28 4.013 4.393 -0.380 1
1 356 . 12 1 1 A 28 28 VAL C C 28 175.561 175.742 -0.181 1
1 357 . 12 1 1 A 28 28 VAL CA C 28 62.791 61.680 1.111 1
1 358 . 12 1 1 A 28 28 VAL CB C 28 32.710 32.273 0.437 1
1 361 . 12 1 1 A 28 28 VAL N N 28 125.545 121.920 3.625 1
1 362 . 12 1 1 A 29 29 ARG H H 29 8.735 8.702 0.033 1
1 363 . 12 1 1 A 29 29 ARG HA H 29 4.774 4.722 0.052 1
1 370 . 12 1 1 A 29 29 ARG C C 29 176.580 176.322 0.258 1
1 371 . 12 1 1 A 29 29 ARG CA C 29 55.481 54.185 1.296 1
1 372 . 12 1 1 A 29 29 ARG CB C 29 31.963 31.990 -0.027 1
1 375 . 12 1 1 A 29 29 ARG N N 29 128.327 126.626 1.701 1
1 376 . 12 1 1 A 30 30 ILE H H 30 8.358 8.407 -0.049 1
1 377 . 12 1 1 A 30 30 ILE HA H 30 3.882 4.044 -0.162 1
1 387 . 12 1 1 A 30 30 ILE C C 30 175.093 175.136 -0.043 1
1 388 . 12 1 1 A 30 30 ILE CA C 30 61.669 61.640 0.029 1
1 389 . 12 1 1 A 30 30 ILE CB C 30 38.806 37.055 1.751 1
1 393 . 12 1 1 A 30 30 ILE N N 30 121.957 121.721 0.236 1
1 394 . 12 1 1 A 31 31 GLN H H 31 8.560 8.798 -0.238 1
1 395 . 12 1 1 A 31 31 GLN HA H 31 4.647 4.661 -0.014 1
1 402 . 12 1 1 A 31 31 GLN C C 31 175.954 175.861 0.093 1
1 403 . 12 1 1 A 31 31 GLN CA C 31 54.833 55.124 -0.291 1
1 404 . 12 1 1 A 31 31 GLN CB C 31 30.584 30.076 0.508 1
1 407 . 12 1 1 A 31 31 GLN N N 31 126.348 128.222 -1.874 1
1 409 . 12 1 1 A 32 32 ASN H H 32 8.994 8.835 0.159 1
1 410 . 12 1 1 A 32 32 ASN HA H 32 4.784 4.763 0.021 1
1 415 . 12 1 1 A 32 32 ASN C C 32 177.296 176.544 0.752 1
1 416 . 12 1 1 A 32 32 ASN CA C 32 53.206 53.493 -0.287 1
1 417 . 12 1 1 A 32 32 ASN CB C 32 39.472 39.553 -0.081 1
1 419 . 12 1 1 A 32 32 ASN N N 32 122.834 125.626 -2.792 1
1 421 . 12 1 1 A 33 33 GLU H H 33 9.180 8.874 0.306 1
1 422 . 12 1 1 A 33 33 GLU HA H 33 4.063 4.034 0.029 1
1 427 . 12 1 1 A 33 33 GLU C C 33 176.787 177.732 -0.945 1
1 428 . 12 1 1 A 33 33 GLU CA C 33 59.347 59.211 0.136 1
1 429 . 12 1 1 A 33 33 GLU CB C 33 29.294 29.281 0.013 1
1 431 . 12 1 1 A 33 33 GLU N N 33 122.736 121.814 0.922 1
1 432 . 12 1 1 A 34 34 ASP H H 34 7.969 7.998 -0.029 1
1 433 . 12 1 1 A 34 34 ASP HA H 34 4.499 4.612 -0.113 1
1 436 . 12 1 1 A 34 34 ASP C C 34 177.111 176.648 0.463 1
1 437 . 12 1 1 A 34 34 ASP CA C 34 53.632 54.248 -0.616 1
1 438 . 12 1 1 A 34 34 ASP CB C 34 39.807 40.929 -1.122 1
1 439 . 12 1 1 A 34 34 ASP N N 34 115.921 117.436 -1.515 1
1 440 . 12 1 1 A 35 35 GLY H H 35 8.083 8.296 -0.213 1
1 441 . 12 1 1 A 35 35 GLY HA2 H 35 4.366 3.975 0.391 1
1 442 . 12 1 1 A 35 35 GLY HA3 H 35 3.657 3.976 -0.319 1
1 443 . 12 1 1 A 35 35 GLY C C 35 174.584 174.171 0.413 1
1 444 . 12 1 1 A 35 35 GLY CA C 35 45.134 45.088 0.046 1
1 445 . 12 1 1 A 35 35 GLY N N 35 108.874 107.258 1.616 1
1 446 . 12 1 1 A 36 36 SER H H 36 8.274 7.895 0.379 1
1 447 . 12 1 1 A 36 36 SER HA H 36 4.389 4.503 -0.114 1
1 450 . 12 1 1 A 36 36 SER C C 36 173.284 173.813 -0.529 1
1 451 . 12 1 1 A 36 36 SER CA C 36 58.383 59.221 -0.838 1
1 452 . 12 1 1 A 36 36 SER CB C 36 64.576 64.472 0.104 1
1 453 . 12 1 1 A 36 36 SER N N 36 117.428 117.520 -0.092 1
1 454 . 12 1 1 A 37 37 VAL H H 37 8.508 8.610 -0.102 1
1 455 . 12 1 1 A 37 37 VAL HA H 37 4.346 4.320 0.026 1
1 463 . 12 1 1 A 37 37 VAL C C 37 176.370 175.890 0.480 1
1 464 . 12 1 1 A 37 37 VAL CA C 37 62.410 62.202 0.208 1
1 465 . 12 1 1 A 37 37 VAL CB C 37 33.086 32.623 0.463 1
1 468 . 12 1 1 A 37 37 VAL N N 37 119.189 124.447 -5.258 1
1 469 . 12 1 1 A 38 38 SER H H 38 8.461 9.210 -0.749 1
1 470 . 12 1 1 A 38 38 SER HA H 38 4.586 4.693 -0.107 1
1 473 . 12 1 1 A 38 38 SER C C 38 173.829 174.879 -1.050 1
1 474 . 12 1 1 A 38 38 SER CA C 38 57.618 57.519 0.099 1
1 475 . 12 1 1 A 38 38 SER CB C 38 64.537 64.509 0.028 1
1 476 . 12 1 1 A 38 38 SER N N 38 121.629 121.116 0.513 1
1 477 . 12 1 1 A 39 39 ASP H H 39 8.512 8.642 -0.130 1
1 478 . 12 1 1 A 39 39 ASP HA H 39 4.606 4.394 0.212 1
1 481 . 12 1 1 A 39 39 ASP C C 39 176.557 176.874 -0.317 1
1 482 . 12 1 1 A 39 39 ASP CA C 39 54.833 56.420 -1.587 1
1 483 . 12 1 1 A 39 39 ASP CB C 39 41.123 40.851 0.272 1
1 484 . 12 1 1 A 39 39 ASP N N 39 120.305 123.436 -3.131 1
1 485 . 12 1 1 A 40 40 GLU H H 40 8.311 7.545 0.766 1
1 486 . 12 1 1 A 40 40 GLU HA H 40 4.235 4.354 -0.119 1
1 491 . 12 1 1 A 40 40 GLU C C 40 175.327 175.858 -0.531 1
1 492 . 12 1 1 A 40 40 GLU CA C 40 56.215 56.491 -0.276 1
1 493 . 12 1 1 A 40 40 GLU CB C 40 30.788 30.401 0.387 1
1 495 . 12 1 1 A 40 40 GLU N N 40 120.680 117.472 3.208 1
1 496 . 12 1 1 A 41 41 ILE H H 41 8.465 8.868 -0.403 1
1 497 . 12 1 1 A 41 41 ILE HA H 41 4.127 4.425 -0.298 1
1 507 . 12 1 1 A 41 41 ILE C C 41 175.380 176.277 -0.897 1
1 508 . 12 1 1 A 41 41 ILE CA C 41 60.670 60.264 0.406 1
1 509 . 12 1 1 A 41 41 ILE CB C 41 38.805 38.907 -0.102 1
1 513 . 12 1 1 A 41 41 ILE N N 41 123.665 125.003 -1.338 1
1 514 . 12 1 1 A 42 42 LYS H H 42 9.556 8.819 0.737 1
1 515 . 12 1 1 A 42 42 LYS HA H 42 4.428 4.358 0.070 1
1 524 . 12 1 1 A 42 42 LYS C C 42 177.277 176.215 1.062 1
1 525 . 12 1 1 A 42 42 LYS CA C 42 57.274 57.603 -0.329 1
1 526 . 12 1 1 A 42 42 LYS CB C 42 35.169 33.803 1.366 1
1 530 . 12 1 1 A 42 42 LYS N N 42 125.597 127.178 -1.581 1
1 531 . 12 1 1 A 43 43 GLU H H 43 7.809 7.569 0.240 1
1 532 . 12 1 1 A 43 43 GLU HA H 43 4.886 4.699 0.187 1
1 537 . 12 1 1 A 43 43 GLU C C 43 173.593 173.630 -0.037 1
1 538 . 12 1 1 A 43 43 GLU CA C 43 54.669 55.353 -0.684 1
1 539 . 12 1 1 A 43 43 GLU CB C 43 32.882 32.011 0.871 1
1 541 . 12 1 1 A 43 43 GLU N N 43 115.292 114.262 1.030 1
1 542 . 12 1 1 A 44 44 ARG H H 44 8.879 8.661 0.218 1
1 543 . 12 1 1 A 44 44 ARG HA H 44 4.917 5.070 -0.153 1
1 551 . 12 1 1 A 44 44 ARG C C 44 173.708 175.038 -1.330 1
1 552 . 12 1 1 A 44 44 ARG CA C 44 55.965 54.582 1.383 1
1 553 . 12 1 1 A 44 44 ARG CB C 44 33.579 32.681 0.898 1
1 556 . 12 1 1 A 44 44 ARG N N 44 118.233 119.402 -1.169 1
1 558 . 12 1 1 A 45 45 THR H H 45 8.892 8.981 -0.089 1
1 559 . 12 1 1 A 45 45 THR HA H 45 5.308 5.077 0.231 1
1 564 . 12 1 1 A 45 45 THR C C 45 173.357 173.240 0.117 1
1 565 . 12 1 1 A 45 45 THR CA C 45 60.939 61.782 -0.843 1
1 566 . 12 1 1 A 45 45 THR CB C 45 70.054 70.245 -0.191 1
1 568 . 12 1 1 A 45 45 THR N N 45 118.457 119.017 -0.560 1
1 569 . 12 1 1 A 46 46 TYR H H 46 9.625 9.585 0.040 1
1 570 . 12 1 1 A 46 46 TYR HA H 46 4.771 5.210 -0.439 1
1 578 . 12 1 1 A 46 46 TYR C C 46 173.735 175.336 -1.601 1
1 579 . 12 1 1 A 46 46 TYR CA C 46 57.480 55.969 1.511 1
1 580 . 12 1 1 A 46 46 TYR CB C 46 41.724 41.888 -0.164 1
1 585 . 12 1 1 A 46 46 TYR N N 46 125.916 126.128 -0.212 1
1 586 . 12 1 1 A 47 47 ASP H H 47 9.006 9.304 -0.298 1
1 587 . 12 1 1 A 47 47 ASP HA H 47 5.399 4.979 0.420 1
1 590 . 12 1 1 A 47 47 ASP C C 47 175.094 175.191 -0.097 1
1 591 . 12 1 1 A 47 47 ASP CA C 47 53.460 53.923 -0.463 1
1 592 . 12 1 1 A 47 47 ASP CB C 47 41.947 41.703 0.244 1
1 593 . 12 1 1 A 47 47 ASP N N 47 122.109 123.262 -1.153 1
1 594 . 12 1 1 A 48 48 LEU H H 48 9.066 8.594 0.472 1
1 595 . 12 1 1 A 48 48 LEU HA H 48 4.831 5.044 -0.213 1
1 605 . 12 1 1 A 48 48 LEU C C 48 174.977 175.792 -0.815 1
1 606 . 12 1 1 A 48 48 LEU CA C 48 52.724 53.620 -0.896 1
1 607 . 12 1 1 A 48 48 LEU CB C 48 44.844 43.318 1.526 1
1 611 . 12 1 1 A 48 48 LEU N N 48 121.879 125.778 -3.899 1
1 612 . 12 1 1 A 49 49 LYS H H 49 9.401 8.673 0.728 1
1 613 . 12 1 1 A 49 49 LYS HA H 49 4.477 4.677 -0.200 1
1 622 . 12 1 1 A 49 49 LYS C C 49 176.225 177.163 -0.938 1
1 623 . 12 1 1 A 49 49 LYS CA C 49 56.017 54.644 1.373 1
1 624 . 12 1 1 A 49 49 LYS CB C 49 33.838 34.138 -0.300 1
1 628 . 12 1 1 A 49 49 LYS N N 49 122.218 124.699 -2.481 1
1 629 . 12 1 1 A 50 50 SER H H 50 8.266 8.811 -0.545 1
1 630 . 12 1 1 A 50 50 SER HA H 50 5.222 4.616 0.606 1
1 633 . 12 1 1 A 50 50 SER C C 50 175.570 175.240 0.330 1
1 634 . 12 1 1 A 50 50 SER CA C 50 55.770 58.248 -2.478 1
1 635 . 12 1 1 A 50 50 SER CB C 50 64.738 64.614 0.124 1
1 636 . 12 1 1 A 50 50 SER N N 50 117.388 118.306 -0.918 1
1 637 . 12 1 1 A 51 51 LYS H H 51 9.276 8.577 0.699 1
1 638 . 12 1 1 A 51 51 LYS HA H 51 4.208 4.028 0.180 1
1 647 . 12 1 1 A 51 51 LYS C C 51 178.773 177.465 1.308 1
1 648 . 12 1 1 A 51 51 LYS CA C 51 58.674 59.735 -1.061 1
1 649 . 12 1 1 A 51 51 LYS CB C 51 33.383 33.009 0.374 1
1 653 . 12 1 1 A 51 51 LYS N N 51 130.550 124.607 5.943 1
1 654 . 12 1 1 A 52 52 GLY H H 52 8.320 7.708 0.612 1
1 655 . 12 1 1 A 52 52 GLY HA2 H 52 3.875 4.098 -0.223 1
1 656 . 12 1 1 A 52 52 GLY HA3 H 52 3.628 4.100 -0.472 1
1 657 . 12 1 1 A 52 52 GLY C C 52 175.108 174.826 0.282 1
1 658 . 12 1 1 A 52 52 GLY CA C 52 46.322 45.664 0.658 1
1 659 . 12 1 1 A 52 52 GLY N N 52 107.053 106.121 0.932 1
1 660 . 12 1 1 A 53 53 GLN H H 53 7.859 8.085 -0.226 1
1 661 . 12 1 1 A 53 53 GLN HA H 53 4.409 4.469 -0.060 1
1 668 . 12 1 1 A 53 53 GLN C C 53 176.469 176.296 0.173 1
1 669 . 12 1 1 A 53 53 GLN CA C 53 54.911 56.447 -1.536 1
1 670 . 12 1 1 A 53 53 GLN CB C 53 29.675 30.781 -1.106 1
1 673 . 12 1 1 A 53 53 GLN N N 53 115.482 119.621 -4.139 1
1 675 . 12 1 1 A 54 54 GLY H H 54 7.992 8.881 -0.889 1
1 676 . 12 1 1 A 54 54 GLY HA2 H 54 3.934 3.906 0.028 1
1 677 . 12 1 1 A 54 54 GLY HA3 H 54 3.934 3.909 0.025 1
1 678 . 12 1 1 A 54 54 GLY C C 54 173.897 173.692 0.205 1
1 679 . 12 1 1 A 54 54 GLY CA C 54 46.574 45.719 0.855 1
1 680 . 12 1 1 A 54 54 GLY N N 54 110.111 107.778 2.333 1
1 681 . 12 1 1 A 55 55 ARG H H 55 7.652 7.607 0.045 1
1 682 . 12 1 1 A 55 55 ARG HA H 55 4.665 5.059 -0.394 1
1 690 . 12 1 1 A 55 55 ARG C C 55 174.649 174.387 0.262 1
1 691 . 12 1 1 A 55 55 ARG CA C 55 54.631 54.160 0.471 1
1 692 . 12 1 1 A 55 55 ARG CB C 55 32.166 34.477 -2.311 1
1 695 . 12 1 1 A 55 55 ARG N N 55 114.214 116.181 -1.967 1
1 697 . 12 1 1 A 56 56 MET H H 56 8.593 9.120 -0.527 1
1 698 . 12 1 1 A 56 56 MET HA H 56 5.012 5.161 -0.149 1
1 703 . 12 1 1 A 56 56 MET C C 56 176.216 174.551 1.665 1
1 704 . 12 1 1 A 56 56 MET CA C 56 54.595 53.322 1.273 1
1 705 . 12 1 1 A 56 56 MET CB C 56 33.466 36.230 -2.764 1
1 707 . 12 1 1 A 56 56 MET N N 56 121.270 116.181 5.089 1
1 708 . 12 1 1 A 57 57 ILE H H 57 9.393 8.742 0.651 1
1 709 . 12 1 1 A 57 57 ILE HA H 57 4.717 4.707 0.010 1
1 719 . 12 1 1 A 57 57 ILE C C 57 173.883 173.584 0.299 1
1 720 . 12 1 1 A 57 57 ILE CA C 57 59.713 58.925 0.788 1
1 721 . 12 1 1 A 57 57 ILE CB C 57 40.933 41.625 -0.692 1
1 725 . 12 1 1 A 57 57 ILE N N 57 120.811 113.235 7.576 1
1 726 . 12 1 1 A 58 58 GLN H H 58 8.218 8.065 0.153 1
1 727 . 12 1 1 A 58 58 GLN HA H 58 5.407 4.868 0.539 1
1 734 . 12 1 1 A 58 58 GLN C C 58 175.368 174.511 0.857 1
1 735 . 12 1 1 A 58 58 GLN CA C 58 55.163 55.280 -0.117 1
1 736 . 12 1 1 A 58 58 GLN CB C 58 30.841 29.066 1.775 1
1 739 . 12 1 1 A 58 58 GLN N N 58 122.281 123.098 -0.817 1
1 741 . 12 1 1 A 59 59 VAL H H 59 9.188 8.497 0.691 1
1 742 . 12 1 1 A 59 59 VAL HA H 59 5.025 5.222 -0.197 1
1 750 . 12 1 1 A 59 59 VAL C C 59 175.330 174.408 0.922 1
1 751 . 12 1 1 A 59 59 VAL CA C 59 59.975 61.227 -1.252 1
1 752 . 12 1 1 A 59 59 VAL CB C 59 34.818 32.898 1.920 1
1 755 . 12 1 1 A 59 59 VAL N N 59 122.421 126.725 -4.304 1
1 756 . 12 1 1 A 60 60 SER H H 60 9.022 9.271 -0.249 1
1 757 . 12 1 1 A 60 60 SER HA H 60 5.811 5.509 0.302 1
1 760 . 12 1 1 A 60 60 SER C C 60 173.234 173.512 -0.278 1
1 761 . 12 1 1 A 60 60 SER CA C 60 57.634 56.615 1.019 1
1 762 . 12 1 1 A 60 60 SER CB C 60 64.891 64.641 0.250 1
1 763 . 12 1 1 A 60 60 SER N N 60 124.709 123.083 1.626 1
1 764 . 12 1 1 A 61 61 ILE H H 61 9.226 8.848 0.378 1
1 765 . 12 1 1 A 61 61 ILE HA H 61 5.572 4.839 0.733 1
1 775 . 12 1 1 A 61 61 ILE C C 61 173.955 174.056 -0.101 1
1 776 . 12 1 1 A 61 61 ILE CA C 61 56.937 57.712 -0.775 1
1 777 . 12 1 1 A 61 61 ILE CB C 61 39.596 39.275 0.321 1
1 781 . 12 1 1 A 61 61 ILE N N 61 121.648 123.699 -2.051 1
1 782 . 12 1 1 A 62 62 PRO HA H 62 4.606 4.524 0.082 1
1 789 . 12 1 1 A 62 62 PRO C C 62 178.143 177.268 0.875 1
1 790 . 12 1 1 A 62 62 PRO CA C 62 63.740 62.888 0.852 1
1 791 . 12 1 1 A 62 62 PRO CB C 62 33.303 32.830 0.473 1
1 794 . 12 1 1 A 63 63 ALA H H 63 7.803 8.373 -0.570 1
1 795 . 12 1 1 A 63 63 ALA HA H 63 4.037 3.979 0.058 1
1 799 . 12 1 1 A 63 63 ALA C C 63 175.942 179.314 -3.372 1
1 800 . 12 1 1 A 63 63 ALA CA C 63 54.417 54.371 0.046 1
1 801 . 12 1 1 A 63 63 ALA CB C 63 19.345 18.462 0.883 1
1 802 . 12 1 1 A 63 63 ALA N N 63 123.695 126.979 -3.284 1
1 803 . 12 1 1 A 64 64 SER H H 64 7.719 7.941 -0.222 1
1 804 . 12 1 1 A 64 64 SER HA H 64 4.097 4.196 -0.099 1
1 807 . 12 1 1 A 64 64 SER C C 64 175.199 174.240 0.959 1
1 808 . 12 1 1 A 64 64 SER CA C 64 59.474 61.067 -1.593 1
1 809 . 12 1 1 A 64 64 SER CB C 64 62.125 62.942 -0.817 1
1 810 . 12 1 1 A 64 64 SER N N 64 110.001 112.752 -2.751 1
1 811 . 12 1 1 A 65 65 VAL H H 65 7.790 7.515 0.275 1
1 812 . 12 1 1 A 65 65 VAL HA H 65 4.360 4.266 0.094 1
1 820 . 12 1 1 A 65 65 VAL C C 65 174.433 174.308 0.125 1
1 821 . 12 1 1 A 65 65 VAL CA C 65 60.335 59.323 1.012 1
1 822 . 12 1 1 A 65 65 VAL CB C 65 32.714 32.104 0.610 1
1 825 . 12 1 1 A 65 65 VAL N N 65 126.142 122.183 3.959 1
1 826 . 12 1 1 A 66 66 PRO HA H 66 4.369 4.490 -0.121 1
1 833 . 12 1 1 A 66 66 PRO C C 66 177.412 176.518 0.894 1
1 834 . 12 1 1 A 66 66 PRO CA C 66 63.104 62.867 0.237 1
1 835 . 12 1 1 A 66 66 PRO CB C 66 32.558 32.061 0.497 1
1 838 . 12 1 1 A 67 67 LEU H H 67 8.578 8.409 0.169 1
1 839 . 12 1 1 A 67 67 LEU HA H 67 3.875 4.265 -0.390 1
1 849 . 12 1 1 A 67 67 LEU C C 67 176.077 176.734 -0.657 1
1 850 . 12 1 1 A 67 67 LEU CA C 67 56.413 55.736 0.677 1
1 851 . 12 1 1 A 67 67 LEU CB C 67 43.279 43.179 0.100 1
1 855 . 12 1 1 A 67 67 LEU N N 67 124.236 123.281 0.955 1
1 856 . 12 1 1 A 68 68 LYS H H 68 7.994 8.672 -0.678 1
1 857 . 12 1 1 A 68 68 LYS HA H 68 3.793 3.648 0.145 1
1 866 . 12 1 1 A 68 68 LYS C C 68 175.601 176.182 -0.581 1
1 867 . 12 1 1 A 68 68 LYS CA C 68 53.350 58.896 -5.546 1
1 868 . 12 1 1 A 68 68 LYS CB C 68 31.035 32.106 -1.071 1
1 872 . 12 1 1 A 68 68 LYS N N 68 124.053 126.536 -2.483 1
1 873 . 12 1 1 A 69 69 GLU H H 69 8.347 7.466 0.881 1
1 874 . 12 1 1 A 69 69 GLU HA H 69 4.501 3.777 0.724 1
1 879 . 12 1 1 A 69 69 GLU C C 69 175.304 175.562 -0.258 1
1 880 . 12 1 1 A 69 69 GLU CA C 69 54.291 57.395 -3.104 1
1 881 . 12 1 1 A 69 69 GLU CB C 69 29.285 27.268 2.017 1
1 883 . 12 1 1 A 69 69 GLU N N 69 123.876 116.213 7.663 1
1 884 . 12 1 1 A 70 70 PHE H H 70 5.549 7.050 -1.501 1
1 885 . 12 1 1 A 70 70 PHE HA H 70 4.592 4.348 0.244 1
1 893 . 12 1 1 A 70 70 PHE C C 70 174.443 175.383 -0.940 1
1 894 . 12 1 1 A 70 70 PHE CA C 70 53.313 57.812 -4.499 1
1 895 . 12 1 1 A 70 70 PHE CB C 70 38.335 38.994 -0.659 1
1 901 . 12 1 1 A 70 70 PHE N N 70 117.781 117.414 0.367 1
1 902 . 12 1 1 A 71 71 ASP H H 71 8.791 8.538 0.253 1
1 903 . 12 1 1 A 71 71 ASP HA H 71 4.535 4.797 -0.262 1
1 906 . 12 1 1 A 71 71 ASP C C 71 175.867 175.725 0.142 1
1 907 . 12 1 1 A 71 71 ASP CA C 71 54.248 54.279 -0.031 1
1 908 . 12 1 1 A 71 71 ASP CB C 71 41.166 41.429 -0.263 1
1 909 . 12 1 1 A 71 71 ASP N N 71 120.385 121.350 -0.965 1
1 910 . 12 1 1 A 72 72 TYR H H 72 8.701 8.731 -0.030 1
1 911 . 12 1 1 A 72 72 TYR HA H 72 4.283 4.540 -0.257 1
1 918 . 12 1 1 A 72 72 TYR C C 72 177.470 176.463 1.007 1
1 919 . 12 1 1 A 72 72 TYR CA C 72 60.513 59.563 0.950 1
1 920 . 12 1 1 A 72 72 TYR CB C 72 38.320 38.355 -0.035 1
1 925 . 12 1 1 A 72 72 TYR N N 72 121.876 125.256 -3.380 1
1 926 . 12 1 1 A 73 73 ASN H H 73 8.819 9.146 -0.327 1
1 927 . 12 1 1 A 73 73 ASN HA H 73 4.096 4.441 -0.345 1
1 932 . 12 1 1 A 73 73 ASN C C 73 174.362 174.648 -0.286 1
1 933 . 12 1 1 A 73 73 ASN CA C 73 54.289 54.373 -0.084 1
1 934 . 12 1 1 A 73 73 ASN CB C 73 36.907 36.779 0.128 1
1 936 . 12 1 1 A 73 73 ASN N N 73 121.726 120.140 1.586 1
1 938 . 12 1 1 A 74 74 ALA H H 74 8.059 7.907 0.152 1
1 939 . 12 1 1 A 74 74 ALA HA H 74 4.100 4.284 -0.184 1
1 943 . 12 1 1 A 74 74 ALA C C 74 177.757 177.442 0.315 1
1 944 . 12 1 1 A 74 74 ALA CA C 74 53.153 52.795 0.358 1
1 945 . 12 1 1 A 74 74 ALA CB C 74 19.412 19.406 0.006 1
1 946 . 12 1 1 A 74 74 ALA N N 74 122.292 121.128 1.164 1
1 947 . 12 1 1 A 75 75 ARG H H 75 8.500 8.518 -0.018 1
1 948 . 12 1 1 A 75 75 ARG HA H 75 4.758 4.504 0.254 1
1 955 . 12 1 1 A 75 75 ARG C C 75 176.812 176.008 0.804 1
1 956 . 12 1 1 A 75 75 ARG CA C 75 56.646 56.140 0.506 1
1 957 . 12 1 1 A 75 75 ARG CB C 75 29.375 30.731 -1.356 1
1 960 . 12 1 1 A 75 75 ARG N N 75 122.871 121.813 1.058 1
1 961 . 12 1 1 A 76 76 VAL H H 76 7.965 9.126 -1.161 1
1 962 . 12 1 1 A 76 76 VAL HA H 76 5.230 5.069 0.161 1
1 970 . 12 1 1 A 76 76 VAL C C 76 173.758 174.268 -0.510 1
1 971 . 12 1 1 A 76 76 VAL CA C 76 58.193 58.457 -0.264 1
1 972 . 12 1 1 A 76 76 VAL CB C 76 36.536 35.690 0.846 1
1 975 . 12 1 1 A 76 76 VAL N N 76 116.220 118.246 -2.026 1
1 976 . 12 1 1 A 77 77 GLU H H 77 9.166 9.215 -0.049 1
1 977 . 12 1 1 A 77 77 GLU HA H 77 4.663 4.894 -0.231 1
1 982 . 12 1 1 A 77 77 GLU C C 77 174.940 174.487 0.453 1
1 983 . 12 1 1 A 77 77 GLU CA C 77 53.546 54.383 -0.837 1
1 984 . 12 1 1 A 77 77 GLU CB C 77 33.395 33.530 -0.135 1
1 986 . 12 1 1 A 77 77 GLU N N 77 116.413 120.537 -4.124 1
1 987 . 12 1 1 A 78 78 LEU H H 78 8.670 8.836 -0.166 1
1 988 . 12 1 1 A 78 78 LEU HA H 78 4.677 4.658 0.019 1
1 998 . 12 1 1 A 78 78 LEU C C 78 176.036 176.426 -0.390 1
1 999 . 12 1 1 A 78 78 LEU CA C 78 53.091 53.959 -0.868 1
1 1000 . 12 1 1 A 78 78 LEU CB C 78 43.276 42.943 0.333 1
1 1004 . 12 1 1 A 78 78 LEU N N 78 117.927 123.618 -5.691 1
1 1005 . 12 1 1 A 79 79 ILE H H 79 7.900 8.531 -0.631 1
1 1006 . 12 1 1 A 79 79 ILE HA H 79 4.312 4.023 0.289 1
1 1016 . 12 1 1 A 79 79 ILE C C 79 175.179 176.246 -1.067 1
1 1017 . 12 1 1 A 79 79 ILE CA C 79 58.294 63.671 -5.377 1
1 1018 . 12 1 1 A 79 79 ILE CB C 79 36.086 38.082 -1.996 1
1 1022 . 12 1 1 A 79 79 ILE N N 79 121.667 124.090 -2.423 1
1 1023 . 12 1 1 A 80 80 ASN H H 80 9.412 8.277 1.135 1
1 1024 . 12 1 1 A 80 80 ASN HA H 80 4.516 5.180 -0.664 1
1 1029 . 12 1 1 A 80 80 ASN C C 80 170.300 172.441 -2.141 1
1 1030 . 12 1 1 A 80 80 ASN CA C 80 54.198 50.343 3.855 1
1 1031 . 12 1 1 A 80 80 ASN CB C 80 37.450 39.115 -1.665 1
1 1033 . 12 1 1 A 80 80 ASN N N 80 123.831 117.595 6.236 1
1 1035 . 12 1 1 A 81 81 PRO HA H 81 5.185 4.806 0.379 1
1 1042 . 12 1 1 A 81 81 PRO C C 81 176.865 176.402 0.463 1
1 1043 . 12 1 1 A 81 81 PRO CA C 81 62.637 62.484 0.153 1
1 1044 . 12 1 1 A 81 81 PRO CB C 81 32.965 32.441 0.524 1
1 1047 . 12 1 1 A 82 82 ILE H H 82 9.374 8.647 0.727 1
1 1048 . 12 1 1 A 82 82 ILE HA H 82 4.524 4.938 -0.414 1
1 1058 . 12 1 1 A 82 82 ILE C C 82 174.731 174.261 0.470 1
1 1059 . 12 1 1 A 82 82 ILE CA C 82 60.205 58.861 1.344 1
1 1060 . 12 1 1 A 82 82 ILE CB C 82 41.737 41.565 0.172 1
1 1064 . 12 1 1 A 82 82 ILE N N 82 121.658 116.829 4.829 1
1 1065 . 12 1 1 A 83 83 ALA H H 83 8.819 8.898 -0.079 1
1 1066 . 12 1 1 A 83 83 ALA HA H 83 4.773 4.549 0.224 1
1 1070 . 12 1 1 A 83 83 ALA C C 83 176.550 176.676 -0.126 1
1 1071 . 12 1 1 A 83 83 ALA CA C 83 52.069 52.450 -0.381 1
1 1072 . 12 1 1 A 83 83 ALA CB C 83 20.374 18.882 1.492 1
1 1073 . 12 1 1 A 83 83 ALA N N 83 127.933 128.004 -0.071 1
1 1074 . 12 1 1 A 84 84 ASP H H 84 8.710 8.857 -0.147 1
1 1075 . 12 1 1 A 84 84 ASP HA H 84 4.894 4.809 0.085 1
1 1078 . 12 1 1 A 84 84 ASP C C 84 175.997 175.494 0.503 1
1 1079 . 12 1 1 A 84 84 ASP CA C 84 53.334 55.657 -2.323 1
1 1080 . 12 1 1 A 84 84 ASP CB C 84 42.104 42.137 -0.033 1
1 1081 . 12 1 1 A 84 84 ASP N N 84 122.009 126.286 -4.277 1
1 1082 . 12 1 1 A 85 85 THR H H 85 8.349 7.842 0.507 1
1 1083 . 12 1 1 A 85 85 THR HA H 85 4.420 4.652 -0.232 1
1 1088 . 12 1 1 A 85 85 THR C C 85 175.085 173.207 1.878 1
1 1089 . 12 1 1 A 85 85 THR CA C 85 62.304 60.903 1.401 1
1 1090 . 12 1 1 A 85 85 THR CB C 85 69.718 69.048 0.670 1
1 1092 . 12 1 1 A 85 85 THR N N 85 114.986 110.415 4.571 1
1 1093 . 12 1 1 A 86 86 VAL H H 86 8.188 8.875 -0.687 1
1 1094 . 12 1 1 A 86 86 VAL HA H 86 4.021 4.587 -0.566 1
1 1102 . 12 1 1 A 86 86 VAL C C 86 176.519 175.774 0.745 1
1 1103 . 12 1 1 A 86 86 VAL CA C 86 63.046 62.481 0.565 1
1 1104 . 12 1 1 A 86 86 VAL CB C 86 32.526 31.719 0.807 1
1 1107 . 12 1 1 A 86 86 VAL N N 86 122.275 128.014 -5.739 1
1 1108 . 12 1 1 A 87 87 ALA H H 87 8.194 8.923 -0.729 1
1 1109 . 12 1 1 A 87 87 ALA HA H 87 4.212 3.886 0.326 1
1 1113 . 12 1 1 A 87 87 ALA C C 87 178.118 179.886 -1.768 1
1 1114 . 12 1 1 A 87 87 ALA CA C 87 53.153 55.498 -2.345 1
1 1115 . 12 1 1 A 87 87 ALA CB C 87 19.165 18.685 0.480 1
1 1116 . 12 1 1 A 87 87 ALA N N 87 126.609 132.722 -6.113 1
1 1117 . 12 1 1 A 88 88 THR H H 88 7.914 8.140 -0.226 1
1 1118 . 12 1 1 A 88 88 THR HA H 88 4.173 4.206 -0.033 1
1 1123 . 12 1 1 A 88 88 THR C C 88 174.516 175.442 -0.926 1
1 1124 . 12 1 1 A 88 88 THR CA C 88 62.785 65.146 -2.361 1
1 1125 . 12 1 1 A 88 88 THR CB C 88 69.582 68.669 0.913 1
1 1127 . 12 1 1 A 88 88 THR N N 88 112.328 110.998 1.330 1
1 1128 . 12 1 1 A 89 89 ALA H H 89 8.076 7.903 0.173 1
1 1129 . 12 1 1 A 89 89 ALA HA H 89 4.320 4.415 -0.095 1
1 1133 . 12 1 1 A 89 89 ALA C C 89 178.014 177.369 0.645 1
1 1134 . 12 1 1 A 89 89 ALA CA C 89 53.079 51.733 1.346 1
1 1135 . 12 1 1 A 89 89 ALA CB C 89 19.335 19.611 -0.276 1
1 1136 . 12 1 1 A 89 89 ALA N N 89 124.632 123.164 1.468 1
1 1137 . 12 1 1 A 90 90 THR H H 90 7.976 7.867 0.109 1
1 1138 . 12 1 1 A 90 90 THR HA H 90 4.203 4.363 -0.160 1
1 1143 . 12 1 1 A 90 90 THR C C 90 174.427 173.621 0.806 1
1 1144 . 12 1 1 A 90 90 THR CA C 90 62.519 61.882 0.637 1
1 1145 . 12 1 1 A 90 90 THR CB C 90 69.721 69.329 0.392 1
1 1147 . 12 1 1 A 90 90 THR N N 90 112.047 112.378 -0.331 1
1 1148 . 12 1 1 A 91 91 TYR H H 91 7.959 7.694 0.265 1
1 1149 . 12 1 1 A 91 91 TYR HA H 91 4.564 4.895 -0.331 1
1 1156 . 12 1 1 A 91 91 TYR C C 91 175.522 175.670 -0.148 1
1 1157 . 12 1 1 A 91 91 TYR CA C 91 57.874 56.943 0.931 1
1 1158 . 12 1 1 A 91 91 TYR CB C 91 38.584 41.570 -2.986 1
1 1163 . 12 1 1 A 91 91 TYR N N 91 121.184 120.421 0.763 1
1 1164 . 12 1 1 A 92 92 GLN H H 92 8.310 8.861 -0.551 1
1 1165 . 12 1 1 A 92 92 GLN HA H 92 4.258 4.498 -0.240 1
1 1172 . 12 1 1 A 92 92 GLN C C 92 176.099 175.837 0.262 1
1 1173 . 12 1 1 A 92 92 GLN CA C 92 56.109 55.556 0.553 1
1 1174 . 12 1 1 A 92 92 GLN CB C 92 29.112 28.872 0.240 1
1 1177 . 12 1 1 A 92 92 GLN N N 92 121.631 120.130 1.501 1
1 1179 . 12 1 1 A 93 93 GLY H H 93 8.052 7.910 0.142 1
1 1180 . 12 1 1 A 93 93 GLY HA2 H 93 4.023 4.084 -0.061 1
1 1181 . 12 1 1 A 93 93 GLY HA3 H 93 3.856 4.092 -0.236 1
1 1182 . 12 1 1 A 93 93 GLY C C 93 173.791 174.595 -0.804 1
1 1183 . 12 1 1 A 93 93 GLY CA C 93 45.382 45.308 0.074 1
1 1184 . 12 1 1 A 93 93 GLY N N 93 109.847 106.943 2.904 1
1 1185 . 12 1 1 A 94 94 ALA H H 94 8.162 8.050 0.112 1
1 1186 . 12 1 1 A 94 94 ALA HA H 94 4.329 4.269 0.060 1
1 1190 . 12 1 1 A 94 94 ALA C C 94 177.392 176.577 0.815 1
1 1191 . 12 1 1 A 94 94 ALA CA C 94 52.558 52.457 0.101 1
1 1192 . 12 1 1 A 94 94 ALA CB C 94 19.526 18.869 0.657 1
1 1193 . 12 1 1 A 94 94 ALA N N 94 123.424 124.314 -0.890 1
1 1194 . 12 1 1 A 95 95 ASP H H 95 8.457 8.973 -0.516 1
1 1195 . 12 1 1 A 95 95 ASP HA H 95 4.608 4.965 -0.357 1
1 1198 . 12 1 1 A 95 95 ASP C C 95 175.630 175.902 -0.272 1
1 1199 . 12 1 1 A 95 95 ASP CA C 95 54.450 53.590 0.860 1
1 1200 . 12 1 1 A 95 95 ASP CB C 95 40.871 41.419 -0.548 1
1 1201 . 12 1 1 A 95 95 ASP N N 95 118.814 125.658 -6.844 1
1 1202 . 12 1 1 A 96 96 VAL H H 96 7.776 8.822 -1.046 1
1 1203 . 12 1 1 A 96 96 VAL HA H 96 4.141 4.944 -0.803 1
1 1211 . 12 1 1 A 96 96 VAL C C 96 175.301 174.568 0.733 1
1 1212 . 12 1 1 A 96 96 VAL CA C 96 61.435 59.010 2.425 1
1 1213 . 12 1 1 A 96 96 VAL CB C 96 33.517 35.702 -2.185 1
1 1216 . 12 1 1 A 96 96 VAL N N 96 118.395 119.408 -1.013 1
1 1217 . 12 1 1 A 97 97 ASP H H 97 8.315 8.560 -0.245 1
1 1218 . 12 1 1 A 97 97 ASP HA H 97 4.681 4.702 -0.021 1
1 1221 . 12 1 1 A 97 97 ASP C C 97 175.151 176.558 -1.407 1
1 1222 . 12 1 1 A 97 97 ASP CA C 97 54.324 54.410 -0.086 1
1 1223 . 12 1 1 A 97 97 ASP CB C 97 41.963 41.210 0.753 1
1 1224 . 12 1 1 A 97 97 ASP N N 97 123.905 120.777 3.128 1
1 1225 . 12 1 1 A 98 98 TRP H H 98 8.210 8.946 -0.736 1
1 1226 . 12 1 1 A 98 98 TRP HA H 98 4.916 5.866 -0.950 1
1 1235 . 12 1 1 A 98 98 TRP C C 98 174.585 173.722 0.863 1
1 1236 . 12 1 1 A 98 98 TRP CA C 98 56.164 54.266 1.898 1
1 1237 . 12 1 1 A 98 98 TRP CB C 98 31.466 32.790 -1.324 1
1 1243 . 12 1 1 A 98 98 TRP N N 98 120.340 117.930 2.410 1
1 1245 . 12 1 1 A 99 99 TYR H H 99 8.760 8.773 -0.013 1
1 1246 . 12 1 1 A 99 99 TYR HA H 99 5.119 5.179 -0.060 1
1 1253 . 12 1 1 A 99 99 TYR C C 99 174.599 174.597 0.002 1
1 1254 . 12 1 1 A 99 99 TYR CA C 99 57.021 56.346 0.675 1
1 1255 . 12 1 1 A 99 99 TYR CB C 99 39.526 40.171 -0.645 1
1 1260 . 12 1 1 A 99 99 TYR N N 99 123.319 118.676 4.643 1
1 1261 . 12 1 1 A 100 100 ILE H H 100 8.936 9.391 -0.455 1
1 1262 . 12 1 1 A 100 100 ILE HA H 100 4.850 4.703 0.147 1
1 1272 . 12 1 1 A 100 100 ILE C C 100 175.070 174.970 0.100 1
1 1273 . 12 1 1 A 100 100 ILE CA C 100 58.998 60.064 -1.066 1
1 1274 . 12 1 1 A 100 100 ILE CB C 100 40.667 39.975 0.692 1
1 1278 . 12 1 1 A 100 100 ILE N N 100 123.281 123.549 -0.268 1
1 1279 . 12 1 1 A 101 101 LYS H H 101 8.987 8.837 0.150 1
1 1280 . 12 1 1 A 101 101 LYS HA H 101 5.313 5.142 0.171 1
1 1289 . 12 1 1 A 101 101 LYS C C 101 174.440 175.822 -1.382 1
1 1290 . 12 1 1 A 101 101 LYS CA C 101 54.763 55.441 -0.678 1
1 1291 . 12 1 1 A 101 101 LYS CB C 101 34.880 33.801 1.079 1
1 1295 . 12 1 1 A 101 101 LYS N N 101 126.210 127.161 -0.951 1
1 1296 . 12 1 1 A 102 102 ALA H H 102 8.531 8.085 0.446 1
1 1297 . 12 1 1 A 102 102 ALA HA H 102 4.957 4.772 0.185 1
1 1301 . 12 1 1 A 102 102 ALA C C 102 175.024 177.557 -2.533 1
1 1302 . 12 1 1 A 102 102 ALA CA C 102 50.701 50.057 0.644 1
1 1303 . 12 1 1 A 102 102 ALA CB C 102 21.618 22.936 -1.318 1
1 1304 . 12 1 1 A 102 102 ALA N N 102 121.424 124.991 -3.567 1
1 1305 . 12 1 1 A 103 103 ASP H H 103 8.339 8.895 -0.556 1
1 1306 . 12 1 1 A 103 103 ASP HA H 103 4.603 4.455 0.148 1
1 1309 . 12 1 1 A 103 103 ASP C C 103 176.188 175.259 0.929 1
1 1310 . 12 1 1 A 103 103 ASP CA C 103 56.049 56.831 -0.782 1
1 1311 . 12 1 1 A 103 103 ASP CB C 103 40.932 41.310 -0.378 1
1 1312 . 12 1 1 A 103 103 ASP N N 103 117.773 119.338 -1.565 1
1 1313 . 12 1 1 A 104 104 ASP H H 104 7.482 7.783 -0.301 1
1 1314 . 12 1 1 A 104 104 ASP HA H 104 4.727 4.945 -0.218 1
1 1317 . 12 1 1 A 104 104 ASP C C 104 174.261 173.726 0.535 1
1 1318 . 12 1 1 A 104 104 ASP CA C 104 52.768 53.542 -0.774 1
1 1319 . 12 1 1 A 104 104 ASP CB C 104 42.587 43.786 -1.199 1
1 1320 . 12 1 1 A 104 104 ASP N N 104 110.673 117.210 -6.537 1
1 1321 . 12 1 1 A 105 105 ILE H H 105 9.267 8.556 0.711 1
1 1322 . 12 1 1 A 105 105 ILE HA H 105 4.631 4.987 -0.356 1
1 1332 . 12 1 1 A 105 105 ILE C C 105 173.922 175.274 -1.352 1
1 1333 . 12 1 1 A 105 105 ILE CA C 105 61.114 60.188 0.926 1
1 1334 . 12 1 1 A 105 105 ILE CB C 105 42.522 40.252 2.270 1
1 1338 . 12 1 1 A 105 105 ILE N N 105 121.380 122.279 -0.899 1
1 1339 . 12 1 1 A 106 106 VAL H H 106 8.592 8.937 -0.345 1
1 1340 . 12 1 1 A 106 106 VAL HA H 106 4.975 4.941 0.034 1
1 1348 . 12 1 1 A 106 106 VAL C C 106 175.049 175.247 -0.198 1
1 1349 . 12 1 1 A 106 106 VAL CA C 106 58.028 59.722 -1.694 1
1 1350 . 12 1 1 A 106 106 VAL CB C 106 35.388 35.529 -0.141 1
1 1353 . 12 1 1 A 106 106 VAL N N 106 116.356 120.784 -4.428 1
1 1354 . 12 1 1 A 107 107 LEU H H 107 8.360 8.472 -0.112 1
1 1355 . 12 1 1 A 107 107 LEU HA H 107 4.167 4.285 -0.118 1
1 1365 . 12 1 1 A 107 107 LEU C C 107 178.338 177.554 0.784 1
1 1366 . 12 1 1 A 107 107 LEU CA C 107 55.077 54.156 0.921 1
1 1367 . 12 1 1 A 107 107 LEU CB C 107 42.394 42.046 0.348 1
1 1371 . 12 1 1 A 107 107 LEU N N 107 121.368 122.219 -0.851 1
1 1372 . 12 1 1 A 108 108 THR H H 108 7.977 8.781 -0.804 1
1 1373 . 12 1 1 A 108 108 THR HA H 108 4.039 4.522 -0.483 1
1 1378 . 12 1 1 A 108 108 THR C C 108 174.725 174.064 0.661 1
1 1379 . 12 1 1 A 108 108 THR CA C 108 63.513 63.873 -0.360 1
1 1380 . 12 1 1 A 108 108 THR CB C 108 69.194 68.803 0.391 1
1 1382 . 12 1 1 A 108 108 THR N N 108 118.728 117.246 1.482 1
1 1383 . 12 1 1 A 109 109 LEU H H 109 8.378 8.776 -0.398 1
1 1384 . 12 1 1 A 109 109 LEU HA H 109 4.274 4.003 0.271 1
1 1394 . 12 1 1 A 109 109 LEU C C 109 177.058 178.367 -1.309 1
1 1395 . 12 1 1 A 109 109 LEU CA C 109 55.045 58.189 -3.144 1
1 1396 . 12 1 1 A 109 109 LEU CB C 109 42.620 42.024 0.596 1
1 1400 . 12 1 1 A 109 109 LEU N N 109 124.847 128.112 -3.265 1
1 9 . 13 1 1 A 2 2 MET HA H 2 4.554 3.945 0.609 1
1 14 . 13 1 1 A 2 2 MET C C 2 174.749 174.789 -0.040 1
1 15 . 13 1 1 A 2 2 MET CA C 2 55.354 56.214 -0.860 1
1 16 . 13 1 1 A 2 2 MET CB C 2 33.729 31.200 2.529 1
1 18 . 13 1 1 A 3 3 ARG H H 3 8.518 7.856 0.662 1
1 19 . 13 1 1 A 3 3 ARG HA H 3 4.531 4.588 -0.057 1
1 26 . 13 1 1 A 3 3 ARG C C 3 175.780 175.526 0.254 1
1 27 . 13 1 1 A 3 3 ARG CA C 3 55.854 55.899 -0.045 1
1 28 . 13 1 1 A 3 3 ARG CB C 3 31.403 31.248 0.155 1
1 31 . 13 1 1 A 3 3 ARG N N 3 124.008 118.857 5.151 1
1 32 . 13 1 1 A 4 4 LEU H H 4 8.424 8.539 -0.115 1
1 33 . 13 1 1 A 4 4 LEU HA H 4 4.457 4.188 0.269 1
1 43 . 13 1 1 A 4 4 LEU C C 4 177.362 177.178 0.184 1
1 44 . 13 1 1 A 4 4 LEU CA C 4 54.511 55.298 -0.787 1
1 45 . 13 1 1 A 4 4 LEU CB C 4 42.686 42.108 0.578 1
1 49 . 13 1 1 A 4 4 LEU N N 4 124.389 127.420 -3.031 1
1 50 . 13 1 1 A 5 5 ALA H H 5 8.418 8.380 0.038 1
1 51 . 13 1 1 A 5 5 ALA HA H 5 4.254 4.573 -0.319 1
1 55 . 13 1 1 A 5 5 ALA C C 5 177.420 177.482 -0.062 1
1 56 . 13 1 1 A 5 5 ALA CA C 5 52.931 52.107 0.824 1
1 57 . 13 1 1 A 5 5 ALA CB C 5 19.263 19.502 -0.239 1
1 58 . 13 1 1 A 5 5 ALA N N 5 124.548 126.518 -1.970 1
1 59 . 13 1 1 A 6 6 ASN H H 6 8.287 8.718 -0.431 1
1 60 . 13 1 1 A 6 6 ASN HA H 6 4.616 5.349 -0.733 1
1 65 . 13 1 1 A 6 6 ASN C C 6 175.837 175.071 0.766 1
1 66 . 13 1 1 A 6 6 ASN CA C 6 53.345 51.980 1.365 1
1 67 . 13 1 1 A 6 6 ASN CB C 6 38.571 40.936 -2.365 1
1 69 . 13 1 1 A 6 6 ASN N N 6 116.484 120.638 -4.154 1
1 71 . 13 1 1 A 7 7 GLY H H 7 8.351 8.198 0.153 1
1 72 . 13 1 1 A 7 7 GLY HA2 H 7 4.130 4.092 0.038 1
1 73 . 13 1 1 A 7 7 GLY HA3 H 7 3.808 4.093 -0.285 1
1 74 . 13 1 1 A 7 7 GLY C C 7 173.750 173.434 0.316 1
1 75 . 13 1 1 A 7 7 GLY CA C 7 45.343 45.609 -0.266 1
1 76 . 13 1 1 A 7 7 GLY N N 7 108.453 107.693 0.760 1
1 77 . 13 1 1 A 8 8 ILE H H 8 7.868 8.061 -0.193 1
1 78 . 13 1 1 A 8 8 ILE HA H 8 4.130 4.831 -0.701 1
1 88 . 13 1 1 A 8 8 ILE C C 8 175.570 175.244 0.326 1
1 89 . 13 1 1 A 8 8 ILE CA C 8 61.095 58.585 2.510 1
1 90 . 13 1 1 A 8 8 ILE CB C 8 38.694 41.253 -2.559 1
1 94 . 13 1 1 A 8 8 ILE N N 8 120.848 116.449 4.399 1
1 95 . 13 1 1 A 9 9 VAL H H 9 8.220 8.423 -0.203 1
1 96 . 13 1 1 A 9 9 VAL HA H 9 4.172 3.964 0.208 1
1 104 . 13 1 1 A 9 9 VAL C C 9 175.898 177.338 -1.440 1
1 105 . 13 1 1 A 9 9 VAL CA C 9 62.488 63.523 -1.035 1
1 106 . 13 1 1 A 9 9 VAL CB C 9 32.460 32.610 -0.150 1
1 109 . 13 1 1 A 9 9 VAL N N 9 125.805 123.141 2.664 1
1 110 . 13 1 1 A 10 10 LEU H H 10 8.437 8.436 0.001 1
1 111 . 13 1 1 A 10 10 LEU HA H 10 4.347 3.968 0.379 1
1 121 . 13 1 1 A 10 10 LEU C C 10 176.398 178.149 -1.751 1
1 122 . 13 1 1 A 10 10 LEU CA C 10 54.787 57.721 -2.934 1
1 123 . 13 1 1 A 10 10 LEU CB C 10 42.639 41.369 1.270 1
1 127 . 13 1 1 A 10 10 LEU N N 10 127.757 127.097 0.660 1
1 128 . 13 1 1 A 11 11 ASP H H 11 8.506 8.243 0.263 1
1 129 . 13 1 1 A 11 11 ASP HA H 11 4.683 4.308 0.375 1
1 132 . 13 1 1 A 11 11 ASP C C 11 176.672 177.829 -1.157 1
1 133 . 13 1 1 A 11 11 ASP CA C 11 53.586 57.512 -3.926 1
1 134 . 13 1 1 A 11 11 ASP CB C 11 41.123 40.195 0.928 1
1 135 . 13 1 1 A 11 11 ASP N N 11 121.539 119.481 2.058 1
1 136 . 13 1 1 A 12 12 LYS H H 12 8.578 7.732 0.846 1
1 137 . 13 1 1 A 12 12 LYS HA H 12 3.943 4.370 -0.427 1
1 146 . 13 1 1 A 12 12 LYS C C 12 176.917 178.268 -1.351 1
1 147 . 13 1 1 A 12 12 LYS CA C 12 58.542 56.312 2.230 1
1 148 . 13 1 1 A 12 12 LYS CB C 12 32.703 32.967 -0.264 1
1 152 . 13 1 1 A 12 12 LYS N N 12 123.635 116.951 6.684 1
1 153 . 13 1 1 A 13 13 ASP H H 13 8.523 7.635 0.888 1
1 154 . 13 1 1 A 13 13 ASP HA H 13 4.566 4.439 0.127 1
1 157 . 13 1 1 A 13 13 ASP C C 13 177.535 176.843 0.692 1
1 158 . 13 1 1 A 13 13 ASP CA C 13 56.034 56.265 -0.231 1
1 159 . 13 1 1 A 13 13 ASP CB C 13 41.051 41.231 -0.180 1
1 160 . 13 1 1 A 13 13 ASP N N 13 120.448 119.565 0.883 1
1 161 . 13 1 1 A 14 14 THR H H 14 7.964 7.343 0.621 1
1 162 . 13 1 1 A 14 14 THR HA H 14 4.146 4.374 -0.228 1
1 167 . 13 1 1 A 14 14 THR C C 14 175.440 173.376 2.064 1
1 168 . 13 1 1 A 14 14 THR CA C 14 63.245 62.549 0.696 1
1 169 . 13 1 1 A 14 14 THR CB C 14 69.092 69.620 -0.528 1
1 171 . 13 1 1 A 14 14 THR N N 14 113.711 113.388 0.323 1
1 172 . 13 1 1 A 15 15 THR H H 15 7.921 8.781 -0.860 1
1 173 . 13 1 1 A 15 15 THR HA H 15 3.920 4.652 -0.732 1
1 178 . 13 1 1 A 15 15 THR C C 15 174.750 173.469 1.281 1
1 179 . 13 1 1 A 15 15 THR CA C 15 64.562 60.146 4.416 1
1 180 . 13 1 1 A 15 15 THR CB C 15 69.166 71.876 -2.710 1
1 182 . 13 1 1 A 15 15 THR N N 15 116.710 117.398 -0.688 1
1 183 . 13 1 1 A 16 16 PHE H H 16 8.191 8.527 -0.336 1
1 184 . 13 1 1 A 16 16 PHE HA H 16 4.628 4.775 -0.147 1
1 192 . 13 1 1 A 16 16 PHE C C 16 177.754 175.893 1.861 1
1 193 . 13 1 1 A 16 16 PHE CA C 16 57.975 57.053 0.922 1
1 194 . 13 1 1 A 16 16 PHE CB C 16 39.553 38.014 1.539 1
1 200 . 13 1 1 A 16 16 PHE N N 16 117.124 120.071 -2.947 1
1 201 . 13 1 1 A 17 17 GLY H H 17 8.110 8.778 -0.668 1
1 202 . 13 1 1 A 17 17 GLY HA2 H 17 4.017 3.984 0.033 1
1 203 . 13 1 1 A 17 17 GLY HA3 H 17 3.849 3.993 -0.144 1
1 204 . 13 1 1 A 17 17 GLY C C 17 172.231 174.605 -2.374 1
1 205 . 13 1 1 A 17 17 GLY CA C 17 45.633 46.248 -0.615 1
1 206 . 13 1 1 A 17 17 GLY N N 17 109.951 112.145 -2.194 1
1 207 . 13 1 1 A 18 18 GLU H H 18 8.304 8.255 0.049 1
1 208 . 13 1 1 A 18 18 GLU HA H 18 4.078 4.432 -0.354 1
1 213 . 13 1 1 A 18 18 GLU C C 18 175.588 175.915 -0.327 1
1 214 . 13 1 1 A 18 18 GLU CA C 18 57.446 56.489 0.957 1
1 215 . 13 1 1 A 18 18 GLU CB C 18 30.767 30.302 0.465 1
1 217 . 13 1 1 A 18 18 GLU N N 18 121.640 121.532 0.108 1
1 218 . 13 1 1 A 19 19 LEU H H 19 8.799 9.064 -0.265 1
1 219 . 13 1 1 A 19 19 LEU HA H 19 5.416 5.112 0.304 1
1 229 . 13 1 1 A 19 19 LEU C C 19 176.875 175.957 0.918 1
1 230 . 13 1 1 A 19 19 LEU CA C 19 53.281 53.547 -0.266 1
1 231 . 13 1 1 A 19 19 LEU CB C 19 45.508 42.976 2.532 1
1 235 . 13 1 1 A 19 19 LEU N N 19 127.101 127.452 -0.351 1
1 236 . 13 1 1 A 20 20 LYS H H 20 8.494 8.716 -0.222 1
1 237 . 13 1 1 A 20 20 LYS HA H 20 5.200 5.220 -0.020 1
1 246 . 13 1 1 A 20 20 LYS C C 20 176.163 175.680 0.483 1
1 247 . 13 1 1 A 20 20 LYS CA C 20 53.575 54.708 -1.133 1
1 248 . 13 1 1 A 20 20 LYS CB C 20 36.835 35.326 1.509 1
1 252 . 13 1 1 A 20 20 LYS N N 20 118.828 124.032 -5.204 1
1 253 . 13 1 1 A 21 21 PHE H H 21 9.658 9.211 0.447 1
1 254 . 13 1 1 A 21 21 PHE HA H 21 4.038 4.655 -0.617 1
1 262 . 13 1 1 A 21 21 PHE C C 21 174.296 174.857 -0.561 1
1 263 . 13 1 1 A 21 21 PHE CA C 21 60.462 59.197 1.265 1
1 264 . 13 1 1 A 21 21 PHE CB C 21 40.359 39.854 0.505 1
1 270 . 13 1 1 A 21 21 PHE N N 21 124.322 126.590 -2.268 1
1 271 . 13 1 1 A 22 22 SER H H 22 7.199 8.307 -1.108 1
1 272 . 13 1 1 A 22 22 SER HA H 22 5.046 4.540 0.506 1
1 275 . 13 1 1 A 22 22 SER C C 22 173.080 174.227 -1.147 1
1 276 . 13 1 1 A 22 22 SER CA C 22 58.547 59.756 -1.209 1
1 277 . 13 1 1 A 22 22 SER CB C 22 63.591 64.028 -0.437 1
1 278 . 13 1 1 A 22 22 SER N N 22 120.109 120.196 -0.087 1
1 279 . 13 1 1 A 23 23 ALA H H 23 7.269 7.088 0.181 1
1 280 . 13 1 1 A 23 23 ALA HA H 23 4.426 4.398 0.028 1
1 284 . 13 1 1 A 23 23 ALA C C 23 176.568 174.916 1.652 1
1 285 . 13 1 1 A 23 23 ALA CA C 23 52.458 51.241 1.217 1
1 286 . 13 1 1 A 23 23 ALA CB C 23 22.728 22.454 0.274 1
1 287 . 13 1 1 A 23 23 ALA N N 23 114.102 117.795 -3.693 1
1 288 . 13 1 1 A 24 24 LEU H H 24 8.819 8.749 0.070 1
1 289 . 13 1 1 A 24 24 LEU HA H 24 4.060 4.514 -0.454 1
1 299 . 13 1 1 A 24 24 LEU C C 24 175.363 176.831 -1.468 1
1 300 . 13 1 1 A 24 24 LEU CA C 24 56.901 54.673 2.228 1
1 301 . 13 1 1 A 24 24 LEU CB C 24 42.065 42.048 0.017 1
1 305 . 13 1 1 A 24 24 LEU N N 24 120.865 121.357 -0.492 1
1 306 . 13 1 1 A 25 25 ARG H H 25 9.473 8.774 0.699 1
1 307 . 13 1 1 A 25 25 ARG HA H 25 4.428 4.116 0.312 1
1 315 . 13 1 1 A 25 25 ARG C C 25 175.729 175.683 0.046 1
1 316 . 13 1 1 A 25 25 ARG CA C 25 56.721 58.154 -1.433 1
1 317 . 13 1 1 A 25 25 ARG CB C 25 31.109 31.252 -0.143 1
1 320 . 13 1 1 A 25 25 ARG N N 25 130.455 128.386 2.069 1
1 322 . 13 1 1 A 26 26 ARG H H 26 7.711 7.270 0.441 1
1 323 . 13 1 1 A 26 26 ARG HA H 26 4.559 4.491 0.068 1
1 330 . 13 1 1 A 26 26 ARG C C 26 173.724 173.723 0.001 1
1 331 . 13 1 1 A 26 26 ARG CA C 26 55.737 55.855 -0.118 1
1 332 . 13 1 1 A 26 26 ARG CB C 26 33.261 33.821 -0.560 1
1 335 . 13 1 1 A 26 26 ARG N N 26 113.305 118.347 -5.042 1
1 336 . 13 1 1 A 27 27 GLU H H 27 8.848 8.595 0.253 1
1 337 . 13 1 1 A 27 27 GLU HA H 27 4.615 4.666 -0.051 1
1 342 . 13 1 1 A 27 27 GLU C C 27 174.836 176.309 -1.473 1
1 343 . 13 1 1 A 27 27 GLU CA C 27 55.901 55.592 0.309 1
1 344 . 13 1 1 A 27 27 GLU CB C 27 30.755 29.948 0.807 1
1 346 . 13 1 1 A 27 27 GLU N N 27 121.934 125.201 -3.267 1
1 347 . 13 1 1 A 28 28 VAL H H 28 8.603 8.039 0.564 1
1 348 . 13 1 1 A 28 28 VAL HA H 28 4.013 4.043 -0.030 1
1 356 . 13 1 1 A 28 28 VAL C C 28 175.561 175.862 -0.301 1
1 357 . 13 1 1 A 28 28 VAL CA C 28 62.791 62.023 0.768 1
1 358 . 13 1 1 A 28 28 VAL CB C 28 32.710 32.258 0.452 1
1 361 . 13 1 1 A 28 28 VAL N N 28 125.545 122.820 2.725 1
1 362 . 13 1 1 A 29 29 ARG H H 29 8.735 8.488 0.247 1
1 363 . 13 1 1 A 29 29 ARG HA H 29 4.774 4.735 0.039 1
1 370 . 13 1 1 A 29 29 ARG C C 29 176.580 176.187 0.393 1
1 371 . 13 1 1 A 29 29 ARG CA C 29 55.481 54.162 1.319 1
1 372 . 13 1 1 A 29 29 ARG CB C 29 31.963 32.197 -0.234 1
1 375 . 13 1 1 A 29 29 ARG N N 29 128.327 124.999 3.328 1
1 376 . 13 1 1 A 30 30 ILE H H 30 8.358 8.796 -0.438 1
1 377 . 13 1 1 A 30 30 ILE HA H 30 3.882 4.126 -0.244 1
1 387 . 13 1 1 A 30 30 ILE C C 30 175.093 174.999 0.094 1
1 388 . 13 1 1 A 30 30 ILE CA C 30 61.669 60.849 0.820 1
1 389 . 13 1 1 A 30 30 ILE CB C 30 38.806 37.147 1.659 1
1 393 . 13 1 1 A 30 30 ILE N N 30 121.957 121.879 0.078 1
1 394 . 13 1 1 A 31 31 GLN H H 31 8.560 8.830 -0.270 1
1 395 . 13 1 1 A 31 31 GLN HA H 31 4.647 4.694 -0.047 1
1 402 . 13 1 1 A 31 31 GLN C C 31 175.954 175.626 0.328 1
1 403 . 13 1 1 A 31 31 GLN CA C 31 54.833 55.433 -0.600 1
1 404 . 13 1 1 A 31 31 GLN CB C 31 30.584 29.761 0.823 1
1 407 . 13 1 1 A 31 31 GLN N N 31 126.348 128.201 -1.853 1
1 409 . 13 1 1 A 32 32 ASN H H 32 8.994 8.837 0.157 1
1 410 . 13 1 1 A 32 32 ASN HA H 32 4.784 4.670 0.114 1
1 415 . 13 1 1 A 32 32 ASN C C 32 177.296 177.036 0.260 1
1 416 . 13 1 1 A 32 32 ASN CA C 32 53.206 53.603 -0.397 1
1 417 . 13 1 1 A 32 32 ASN CB C 32 39.472 39.022 0.450 1
1 419 . 13 1 1 A 32 32 ASN N N 32 122.834 125.499 -2.665 1
1 421 . 13 1 1 A 33 33 GLU H H 33 9.180 8.871 0.309 1
1 422 . 13 1 1 A 33 33 GLU HA H 33 4.063 4.076 -0.013 1
1 427 . 13 1 1 A 33 33 GLU C C 33 176.787 178.371 -1.584 1
1 428 . 13 1 1 A 33 33 GLU CA C 33 59.347 58.901 0.446 1
1 429 . 13 1 1 A 33 33 GLU CB C 33 29.294 29.097 0.197 1
1 431 . 13 1 1 A 33 33 GLU N N 33 122.736 122.368 0.368 1
1 432 . 13 1 1 A 34 34 ASP H H 34 7.969 7.910 0.059 1
1 433 . 13 1 1 A 34 34 ASP HA H 34 4.499 4.464 0.035 1
1 436 . 13 1 1 A 34 34 ASP C C 34 177.111 176.097 1.014 1
1 437 . 13 1 1 A 34 34 ASP CA C 34 53.632 55.142 -1.510 1
1 438 . 13 1 1 A 34 34 ASP CB C 34 39.807 41.202 -1.395 1
1 439 . 13 1 1 A 34 34 ASP N N 34 115.921 118.537 -2.616 1
1 440 . 13 1 1 A 35 35 GLY H H 35 8.083 8.095 -0.012 1
1 441 . 13 1 1 A 35 35 GLY HA2 H 35 4.366 4.025 0.341 1
1 442 . 13 1 1 A 35 35 GLY HA3 H 35 3.657 4.026 -0.369 1
1 443 . 13 1 1 A 35 35 GLY C C 35 174.584 174.411 0.173 1
1 444 . 13 1 1 A 35 35 GLY CA C 35 45.134 45.111 0.023 1
1 445 . 13 1 1 A 35 35 GLY N N 35 108.874 106.494 2.380 1
1 446 . 13 1 1 A 36 36 SER H H 36 8.274 7.777 0.497 1
1 447 . 13 1 1 A 36 36 SER HA H 36 4.389 4.558 -0.169 1
1 450 . 13 1 1 A 36 36 SER C C 36 173.284 174.096 -0.812 1
1 451 . 13 1 1 A 36 36 SER CA C 36 58.383 58.559 -0.176 1
1 452 . 13 1 1 A 36 36 SER CB C 36 64.576 64.649 -0.073 1
1 453 . 13 1 1 A 36 36 SER N N 36 117.428 117.682 -0.254 1
1 454 . 13 1 1 A 37 37 VAL H H 37 8.508 8.579 -0.071 1
1 455 . 13 1 1 A 37 37 VAL HA H 37 4.346 4.376 -0.030 1
1 463 . 13 1 1 A 37 37 VAL C C 37 176.370 175.837 0.533 1
1 464 . 13 1 1 A 37 37 VAL CA C 37 62.410 62.069 0.341 1
1 465 . 13 1 1 A 37 37 VAL CB C 37 33.086 32.373 0.713 1
1 468 . 13 1 1 A 37 37 VAL N N 37 119.189 125.726 -6.537 1
1 469 . 13 1 1 A 38 38 SER H H 38 8.461 8.738 -0.277 1
1 470 . 13 1 1 A 38 38 SER HA H 38 4.586 4.738 -0.152 1
1 473 . 13 1 1 A 38 38 SER C C 38 173.829 174.446 -0.617 1
1 474 . 13 1 1 A 38 38 SER CA C 38 57.618 56.507 1.111 1
1 475 . 13 1 1 A 38 38 SER CB C 38 64.537 65.324 -0.787 1
1 476 . 13 1 1 A 38 38 SER N N 38 121.629 120.388 1.241 1
1 477 . 13 1 1 A 39 39 ASP H H 39 8.512 8.619 -0.107 1
1 478 . 13 1 1 A 39 39 ASP HA H 39 4.606 4.592 0.014 1
1 481 . 13 1 1 A 39 39 ASP C C 39 176.557 176.530 0.027 1
1 482 . 13 1 1 A 39 39 ASP CA C 39 54.833 55.935 -1.102 1
1 483 . 13 1 1 A 39 39 ASP CB C 39 41.123 41.563 -0.440 1
1 484 . 13 1 1 A 39 39 ASP N N 39 120.305 122.903 -2.598 1
1 485 . 13 1 1 A 40 40 GLU H H 40 8.311 7.545 0.766 1
1 486 . 13 1 1 A 40 40 GLU HA H 40 4.235 4.383 -0.148 1
1 491 . 13 1 1 A 40 40 GLU C C 40 175.327 175.765 -0.438 1
1 492 . 13 1 1 A 40 40 GLU CA C 40 56.215 56.779 -0.564 1
1 493 . 13 1 1 A 40 40 GLU CB C 40 30.788 30.034 0.754 1
1 495 . 13 1 1 A 40 40 GLU N N 40 120.680 117.890 2.790 1
1 496 . 13 1 1 A 41 41 ILE H H 41 8.465 8.902 -0.437 1
1 497 . 13 1 1 A 41 41 ILE HA H 41 4.127 4.270 -0.143 1
1 507 . 13 1 1 A 41 41 ILE C C 41 175.380 175.922 -0.542 1
1 508 . 13 1 1 A 41 41 ILE CA C 41 60.670 60.619 0.051 1
1 509 . 13 1 1 A 41 41 ILE CB C 41 38.805 38.641 0.164 1
1 513 . 13 1 1 A 41 41 ILE N N 41 123.665 124.682 -1.017 1
1 514 . 13 1 1 A 42 42 LYS H H 42 9.556 9.363 0.193 1
1 515 . 13 1 1 A 42 42 LYS HA H 42 4.428 4.444 -0.016 1
1 524 . 13 1 1 A 42 42 LYS C C 42 177.277 175.511 1.766 1
1 525 . 13 1 1 A 42 42 LYS CA C 42 57.274 57.373 -0.099 1
1 526 . 13 1 1 A 42 42 LYS CB C 42 35.169 33.961 1.208 1
1 530 . 13 1 1 A 42 42 LYS N N 42 125.597 127.754 -2.157 1
1 531 . 13 1 1 A 43 43 GLU H H 43 7.809 7.740 0.069 1
1 532 . 13 1 1 A 43 43 GLU HA H 43 4.886 4.856 0.030 1
1 537 . 13 1 1 A 43 43 GLU C C 43 173.593 174.902 -1.309 1
1 538 . 13 1 1 A 43 43 GLU CA C 43 54.669 54.729 -0.060 1
1 539 . 13 1 1 A 43 43 GLU CB C 43 32.882 34.494 -1.612 1
1 541 . 13 1 1 A 43 43 GLU N N 43 115.292 116.049 -0.757 1
1 542 . 13 1 1 A 44 44 ARG H H 44 8.879 8.830 0.049 1
1 543 . 13 1 1 A 44 44 ARG HA H 44 4.917 5.053 -0.136 1
1 551 . 13 1 1 A 44 44 ARG C C 44 173.708 175.011 -1.303 1
1 552 . 13 1 1 A 44 44 ARG CA C 44 55.965 54.467 1.498 1
1 553 . 13 1 1 A 44 44 ARG CB C 44 33.579 32.492 1.087 1
1 556 . 13 1 1 A 44 44 ARG N N 44 118.233 120.977 -2.744 1
1 558 . 13 1 1 A 45 45 THR H H 45 8.892 8.942 -0.050 1
1 559 . 13 1 1 A 45 45 THR HA H 45 5.308 4.936 0.372 1
1 564 . 13 1 1 A 45 45 THR C C 45 173.357 172.890 0.467 1
1 565 . 13 1 1 A 45 45 THR CA C 45 60.939 61.617 -0.678 1
1 566 . 13 1 1 A 45 45 THR CB C 45 70.054 70.196 -0.142 1
1 568 . 13 1 1 A 45 45 THR N N 45 118.457 119.243 -0.786 1
1 569 . 13 1 1 A 46 46 TYR H H 46 9.625 9.575 0.050 1
1 570 . 13 1 1 A 46 46 TYR HA H 46 4.771 5.017 -0.246 1
1 578 . 13 1 1 A 46 46 TYR C C 46 173.735 174.809 -1.074 1
1 579 . 13 1 1 A 46 46 TYR CA C 46 57.480 56.183 1.297 1
1 580 . 13 1 1 A 46 46 TYR CB C 46 41.724 43.196 -1.472 1
1 585 . 13 1 1 A 46 46 TYR N N 46 125.916 125.943 -0.027 1
1 586 . 13 1 1 A 47 47 ASP H H 47 9.006 8.886 0.120 1
1 587 . 13 1 1 A 47 47 ASP HA H 47 5.399 5.049 0.350 1
1 590 . 13 1 1 A 47 47 ASP C C 47 175.094 174.991 0.103 1
1 591 . 13 1 1 A 47 47 ASP CA C 47 53.460 53.836 -0.376 1
1 592 . 13 1 1 A 47 47 ASP CB C 47 41.947 42.018 -0.071 1
1 593 . 13 1 1 A 47 47 ASP N N 47 122.109 122.505 -0.396 1
1 594 . 13 1 1 A 48 48 LEU H H 48 9.066 8.806 0.260 1
1 595 . 13 1 1 A 48 48 LEU HA H 48 4.831 5.037 -0.206 1
1 605 . 13 1 1 A 48 48 LEU C C 48 174.977 175.738 -0.761 1
1 606 . 13 1 1 A 48 48 LEU CA C 48 52.724 53.329 -0.605 1
1 607 . 13 1 1 A 48 48 LEU CB C 48 44.844 44.410 0.434 1
1 611 . 13 1 1 A 48 48 LEU N N 48 121.879 125.061 -3.182 1
1 612 . 13 1 1 A 49 49 LYS H H 49 9.401 8.811 0.590 1
1 613 . 13 1 1 A 49 49 LYS HA H 49 4.477 4.598 -0.121 1
1 622 . 13 1 1 A 49 49 LYS C C 49 176.225 175.046 1.179 1
1 623 . 13 1 1 A 49 49 LYS CA C 49 56.017 55.790 0.227 1
1 624 . 13 1 1 A 49 49 LYS CB C 49 33.838 33.192 0.646 1
1 628 . 13 1 1 A 49 49 LYS N N 49 122.218 124.925 -2.707 1
1 629 . 13 1 1 A 50 50 SER H H 50 8.266 8.797 -0.531 1
1 630 . 13 1 1 A 50 50 SER HA H 50 5.222 5.051 0.171 1
1 633 . 13 1 1 A 50 50 SER C C 50 175.570 174.481 1.089 1
1 634 . 13 1 1 A 50 50 SER CA C 50 55.770 56.905 -1.135 1
1 635 . 13 1 1 A 50 50 SER CB C 50 64.738 63.579 1.159 1
1 636 . 13 1 1 A 50 50 SER N N 50 117.388 121.394 -4.006 1
1 637 . 13 1 1 A 51 51 LYS H H 51 9.276 8.894 0.382 1
1 638 . 13 1 1 A 51 51 LYS HA H 51 4.208 3.944 0.264 1
1 647 . 13 1 1 A 51 51 LYS C C 51 178.773 178.969 -0.196 1
1 648 . 13 1 1 A 51 51 LYS CA C 51 58.674 59.601 -0.927 1
1 649 . 13 1 1 A 51 51 LYS CB C 51 33.383 32.174 1.209 1
1 653 . 13 1 1 A 51 51 LYS N N 51 130.550 128.344 2.206 1
1 654 . 13 1 1 A 52 52 GLY H H 52 8.320 8.185 0.135 1
1 655 . 13 1 1 A 52 52 GLY HA2 H 52 3.875 3.763 0.112 1
1 656 . 13 1 1 A 52 52 GLY HA3 H 52 3.628 3.773 -0.145 1
1 657 . 13 1 1 A 52 52 GLY C C 52 175.108 175.573 -0.465 1
1 658 . 13 1 1 A 52 52 GLY CA C 52 46.322 47.143 -0.821 1
1 659 . 13 1 1 A 52 52 GLY N N 52 107.053 107.432 -0.379 1
1 660 . 13 1 1 A 53 53 GLN H H 53 7.859 7.411 0.448 1
1 661 . 13 1 1 A 53 53 GLN HA H 53 4.409 4.414 -0.005 1
1 668 . 13 1 1 A 53 53 GLN C C 53 176.469 176.303 0.166 1
1 669 . 13 1 1 A 53 53 GLN CA C 53 54.911 56.566 -1.655 1
1 670 . 13 1 1 A 53 53 GLN CB C 53 29.675 29.591 0.084 1
1 673 . 13 1 1 A 53 53 GLN N N 53 115.482 119.916 -4.434 1
1 675 . 13 1 1 A 54 54 GLY H H 54 7.992 8.753 -0.761 1
1 676 . 13 1 1 A 54 54 GLY HA2 H 54 3.934 3.967 -0.033 1
1 677 . 13 1 1 A 54 54 GLY HA3 H 54 3.934 3.974 -0.040 1
1 678 . 13 1 1 A 54 54 GLY C C 54 173.897 173.700 0.197 1
1 679 . 13 1 1 A 54 54 GLY CA C 54 46.574 46.260 0.314 1
1 680 . 13 1 1 A 54 54 GLY N N 54 110.111 108.815 1.296 1
1 681 . 13 1 1 A 55 55 ARG H H 55 7.652 7.540 0.112 1
1 682 . 13 1 1 A 55 55 ARG HA H 55 4.665 4.955 -0.290 1
1 690 . 13 1 1 A 55 55 ARG C C 55 174.649 174.742 -0.093 1
1 691 . 13 1 1 A 55 55 ARG CA C 55 54.631 54.082 0.549 1
1 692 . 13 1 1 A 55 55 ARG CB C 55 32.166 34.181 -2.015 1
1 695 . 13 1 1 A 55 55 ARG N N 55 114.214 119.762 -5.548 1
1 697 . 13 1 1 A 56 56 MET H H 56 8.593 8.684 -0.091 1
1 698 . 13 1 1 A 56 56 MET HA H 56 5.012 5.262 -0.250 1
1 703 . 13 1 1 A 56 56 MET C C 56 176.216 175.838 0.378 1
1 704 . 13 1 1 A 56 56 MET CA C 56 54.595 53.667 0.928 1
1 705 . 13 1 1 A 56 56 MET CB C 56 33.466 33.083 0.383 1
1 707 . 13 1 1 A 56 56 MET N N 56 121.270 120.364 0.906 1
1 708 . 13 1 1 A 57 57 ILE H H 57 9.393 8.529 0.864 1
1 709 . 13 1 1 A 57 57 ILE HA H 57 4.717 4.417 0.300 1
1 719 . 13 1 1 A 57 57 ILE C C 57 173.883 175.080 -1.197 1
1 720 . 13 1 1 A 57 57 ILE CA C 57 59.713 59.774 -0.061 1
1 721 . 13 1 1 A 57 57 ILE CB C 57 40.933 38.797 2.136 1
1 725 . 13 1 1 A 57 57 ILE N N 57 120.811 121.224 -0.413 1
1 726 . 13 1 1 A 58 58 GLN H H 58 8.218 7.830 0.388 1
1 727 . 13 1 1 A 58 58 GLN HA H 58 5.407 4.784 0.623 1
1 734 . 13 1 1 A 58 58 GLN C C 58 175.368 174.478 0.890 1
1 735 . 13 1 1 A 58 58 GLN CA C 58 55.163 55.284 -0.121 1
1 736 . 13 1 1 A 58 58 GLN CB C 58 30.841 28.917 1.924 1
1 739 . 13 1 1 A 58 58 GLN N N 58 122.281 123.272 -0.991 1
1 741 . 13 1 1 A 59 59 VAL H H 59 9.188 8.497 0.691 1
1 742 . 13 1 1 A 59 59 VAL HA H 59 5.025 5.312 -0.287 1
1 750 . 13 1 1 A 59 59 VAL C C 59 175.330 175.217 0.113 1
1 751 . 13 1 1 A 59 59 VAL CA C 59 59.975 61.370 -1.395 1
1 752 . 13 1 1 A 59 59 VAL CB C 59 34.818 32.934 1.884 1
1 755 . 13 1 1 A 59 59 VAL N N 59 122.421 126.672 -4.251 1
1 756 . 13 1 1 A 60 60 SER H H 60 9.022 8.919 0.103 1
1 757 . 13 1 1 A 60 60 SER HA H 60 5.811 5.875 -0.064 1
1 760 . 13 1 1 A 60 60 SER C C 60 173.234 174.052 -0.818 1
1 761 . 13 1 1 A 60 60 SER CA C 60 57.634 57.156 0.478 1
1 762 . 13 1 1 A 60 60 SER CB C 60 64.891 65.339 -0.448 1
1 763 . 13 1 1 A 60 60 SER N N 60 124.709 124.553 0.156 1
1 764 . 13 1 1 A 61 61 ILE H H 61 9.226 8.989 0.237 1
1 765 . 13 1 1 A 61 61 ILE HA H 61 5.572 5.003 0.569 1
1 775 . 13 1 1 A 61 61 ILE C C 61 173.955 173.762 0.193 1
1 776 . 13 1 1 A 61 61 ILE CA C 61 56.937 57.170 -0.233 1
1 777 . 13 1 1 A 61 61 ILE CB C 61 39.596 40.308 -0.712 1
1 781 . 13 1 1 A 61 61 ILE N N 61 121.648 120.823 0.825 1
1 782 . 13 1 1 A 62 62 PRO HA H 62 4.606 4.540 0.066 1
1 789 . 13 1 1 A 62 62 PRO C C 62 178.143 177.419 0.724 1
1 790 . 13 1 1 A 62 62 PRO CA C 62 63.740 62.923 0.817 1
1 791 . 13 1 1 A 62 62 PRO CB C 62 33.303 32.862 0.441 1
1 794 . 13 1 1 A 63 63 ALA H H 63 7.803 9.080 -1.277 1
1 795 . 13 1 1 A 63 63 ALA HA H 63 4.037 4.104 -0.067 1
1 799 . 13 1 1 A 63 63 ALA C C 63 175.942 179.752 -3.810 1
1 800 . 13 1 1 A 63 63 ALA CA C 63 54.417 54.998 -0.581 1
1 801 . 13 1 1 A 63 63 ALA CB C 63 19.345 17.667 1.678 1
1 802 . 13 1 1 A 63 63 ALA N N 63 123.695 127.193 -3.498 1
1 803 . 13 1 1 A 64 64 SER H H 64 7.719 8.156 -0.437 1
1 804 . 13 1 1 A 64 64 SER HA H 64 4.097 4.256 -0.159 1
1 807 . 13 1 1 A 64 64 SER C C 64 175.199 175.255 -0.056 1
1 808 . 13 1 1 A 64 64 SER CA C 64 59.474 61.962 -2.488 1
1 809 . 13 1 1 A 64 64 SER CB C 64 62.125 63.103 -0.978 1
1 810 . 13 1 1 A 64 64 SER N N 64 110.001 113.222 -3.221 1
1 811 . 13 1 1 A 65 65 VAL H H 65 7.790 7.701 0.089 1
1 812 . 13 1 1 A 65 65 VAL HA H 65 4.360 4.177 0.183 1
1 820 . 13 1 1 A 65 65 VAL C C 65 174.433 174.382 0.051 1
1 821 . 13 1 1 A 65 65 VAL CA C 65 60.335 60.400 -0.065 1
1 822 . 13 1 1 A 65 65 VAL CB C 65 32.714 32.174 0.540 1
1 825 . 13 1 1 A 65 65 VAL N N 65 126.142 120.903 5.239 1
1 826 . 13 1 1 A 66 66 PRO HA H 66 4.369 4.462 -0.093 1
1 833 . 13 1 1 A 66 66 PRO C C 66 177.412 176.661 0.751 1
1 834 . 13 1 1 A 66 66 PRO CA C 66 63.104 63.047 0.057 1
1 835 . 13 1 1 A 66 66 PRO CB C 66 32.558 32.035 0.523 1
1 838 . 13 1 1 A 67 67 LEU H H 67 8.578 8.352 0.226 1
1 839 . 13 1 1 A 67 67 LEU HA H 67 3.875 4.288 -0.413 1
1 849 . 13 1 1 A 67 67 LEU C C 67 176.077 177.499 -1.422 1
1 850 . 13 1 1 A 67 67 LEU CA C 67 56.413 55.759 0.654 1
1 851 . 13 1 1 A 67 67 LEU CB C 67 43.279 43.510 -0.231 1
1 855 . 13 1 1 A 67 67 LEU N N 67 124.236 123.849 0.387 1
1 856 . 13 1 1 A 68 68 LYS H H 68 7.994 8.448 -0.454 1
1 857 . 13 1 1 A 68 68 LYS HA H 68 3.793 3.424 0.369 1
1 866 . 13 1 1 A 68 68 LYS C C 68 175.601 175.987 -0.386 1
1 867 . 13 1 1 A 68 68 LYS CA C 68 53.350 59.046 -5.696 1
1 868 . 13 1 1 A 68 68 LYS CB C 68 31.035 31.966 -0.931 1
1 872 . 13 1 1 A 68 68 LYS N N 68 124.053 126.900 -2.847 1
1 873 . 13 1 1 A 69 69 GLU H H 69 8.347 7.744 0.603 1
1 874 . 13 1 1 A 69 69 GLU HA H 69 4.501 3.780 0.721 1
1 879 . 13 1 1 A 69 69 GLU C C 69 175.304 175.577 -0.273 1
1 880 . 13 1 1 A 69 69 GLU CA C 69 54.291 57.379 -3.088 1
1 881 . 13 1 1 A 69 69 GLU CB C 69 29.285 27.158 2.127 1
1 883 . 13 1 1 A 69 69 GLU N N 69 123.876 116.126 7.750 1
1 884 . 13 1 1 A 70 70 PHE H H 70 5.549 6.900 -1.351 1
1 885 . 13 1 1 A 70 70 PHE HA H 70 4.592 4.341 0.251 1
1 893 . 13 1 1 A 70 70 PHE C C 70 174.443 175.365 -0.922 1
1 894 . 13 1 1 A 70 70 PHE CA C 70 53.313 57.772 -4.459 1
1 895 . 13 1 1 A 70 70 PHE CB C 70 38.335 39.061 -0.726 1
1 901 . 13 1 1 A 70 70 PHE N N 70 117.781 117.713 0.068 1
1 902 . 13 1 1 A 71 71 ASP H H 71 8.791 8.840 -0.049 1
1 903 . 13 1 1 A 71 71 ASP HA H 71 4.535 4.787 -0.252 1
1 906 . 13 1 1 A 71 71 ASP C C 71 175.867 175.940 -0.073 1
1 907 . 13 1 1 A 71 71 ASP CA C 71 54.248 54.531 -0.283 1
1 908 . 13 1 1 A 71 71 ASP CB C 71 41.166 41.541 -0.375 1
1 909 . 13 1 1 A 71 71 ASP N N 71 120.385 121.051 -0.666 1
1 910 . 13 1 1 A 72 72 TYR H H 72 8.701 8.680 0.021 1
1 911 . 13 1 1 A 72 72 TYR HA H 72 4.283 4.564 -0.281 1
1 918 . 13 1 1 A 72 72 TYR C C 72 177.470 176.237 1.233 1
1 919 . 13 1 1 A 72 72 TYR CA C 72 60.513 59.410 1.103 1
1 920 . 13 1 1 A 72 72 TYR CB C 72 38.320 38.504 -0.184 1
1 925 . 13 1 1 A 72 72 TYR N N 72 121.876 122.918 -1.042 1
1 926 . 13 1 1 A 73 73 ASN H H 73 8.819 9.185 -0.366 1
1 927 . 13 1 1 A 73 73 ASN HA H 73 4.096 4.244 -0.148 1
1 932 . 13 1 1 A 73 73 ASN C C 73 174.362 174.697 -0.335 1
1 933 . 13 1 1 A 73 73 ASN CA C 73 54.289 54.329 -0.040 1
1 934 . 13 1 1 A 73 73 ASN CB C 73 36.907 36.848 0.059 1
1 936 . 13 1 1 A 73 73 ASN N N 73 121.726 120.323 1.403 1
1 938 . 13 1 1 A 74 74 ALA H H 74 8.059 7.665 0.394 1
1 939 . 13 1 1 A 74 74 ALA HA H 74 4.100 4.366 -0.266 1
1 943 . 13 1 1 A 74 74 ALA C C 74 177.757 177.398 0.359 1
1 944 . 13 1 1 A 74 74 ALA CA C 74 53.153 52.300 0.853 1
1 945 . 13 1 1 A 74 74 ALA CB C 74 19.412 19.687 -0.275 1
1 946 . 13 1 1 A 74 74 ALA N N 74 122.292 121.008 1.284 1
1 947 . 13 1 1 A 75 75 ARG H H 75 8.500 8.426 0.074 1
1 948 . 13 1 1 A 75 75 ARG HA H 75 4.758 4.525 0.233 1
1 955 . 13 1 1 A 75 75 ARG C C 75 176.812 175.939 0.873 1
1 956 . 13 1 1 A 75 75 ARG CA C 75 56.646 56.211 0.435 1
1 957 . 13 1 1 A 75 75 ARG CB C 75 29.375 30.548 -1.173 1
1 960 . 13 1 1 A 75 75 ARG N N 75 122.871 121.395 1.476 1
1 961 . 13 1 1 A 76 76 VAL H H 76 7.965 9.110 -1.145 1
1 962 . 13 1 1 A 76 76 VAL HA H 76 5.230 4.942 0.288 1
1 970 . 13 1 1 A 76 76 VAL C C 76 173.758 174.597 -0.839 1
1 971 . 13 1 1 A 76 76 VAL CA C 76 58.193 59.137 -0.944 1
1 972 . 13 1 1 A 76 76 VAL CB C 76 36.536 35.000 1.536 1
1 975 . 13 1 1 A 76 76 VAL N N 76 116.220 118.736 -2.516 1
1 976 . 13 1 1 A 77 77 GLU H H 77 9.166 9.333 -0.167 1
1 977 . 13 1 1 A 77 77 GLU HA H 77 4.663 5.004 -0.341 1
1 982 . 13 1 1 A 77 77 GLU C C 77 174.940 174.806 0.134 1
1 983 . 13 1 1 A 77 77 GLU CA C 77 53.546 54.208 -0.662 1
1 984 . 13 1 1 A 77 77 GLU CB C 77 33.395 33.396 -0.001 1
1 986 . 13 1 1 A 77 77 GLU N N 77 116.413 122.761 -6.348 1
1 987 . 13 1 1 A 78 78 LEU H H 78 8.670 8.804 -0.134 1
1 988 . 13 1 1 A 78 78 LEU HA H 78 4.677 4.743 -0.066 1
1 998 . 13 1 1 A 78 78 LEU C C 78 176.036 176.331 -0.295 1
1 999 . 13 1 1 A 78 78 LEU CA C 78 53.091 53.648 -0.557 1
1 1000 . 13 1 1 A 78 78 LEU CB C 78 43.276 42.915 0.361 1
1 1004 . 13 1 1 A 78 78 LEU N N 78 117.927 123.743 -5.816 1
1 1005 . 13 1 1 A 79 79 ILE H H 79 7.900 8.683 -0.783 1
1 1006 . 13 1 1 A 79 79 ILE HA H 79 4.312 3.939 0.373 1
1 1016 . 13 1 1 A 79 79 ILE C C 79 175.179 176.460 -1.281 1
1 1017 . 13 1 1 A 79 79 ILE CA C 79 58.294 64.703 -6.409 1
1 1018 . 13 1 1 A 79 79 ILE CB C 79 36.086 38.331 -2.245 1
1 1022 . 13 1 1 A 79 79 ILE N N 79 121.667 125.364 -3.697 1
1 1023 . 13 1 1 A 80 80 ASN H H 80 9.412 8.236 1.176 1
1 1024 . 13 1 1 A 80 80 ASN HA H 80 4.516 5.155 -0.639 1
1 1029 . 13 1 1 A 80 80 ASN C C 80 170.300 172.487 -2.187 1
1 1030 . 13 1 1 A 80 80 ASN CA C 80 54.198 50.376 3.822 1
1 1031 . 13 1 1 A 80 80 ASN CB C 80 37.450 39.218 -1.768 1
1 1033 . 13 1 1 A 80 80 ASN N N 80 123.831 118.479 5.352 1
1 1035 . 13 1 1 A 81 81 PRO HA H 81 5.185 4.868 0.317 1
1 1042 . 13 1 1 A 81 81 PRO C C 81 176.865 176.652 0.213 1
1 1043 . 13 1 1 A 81 81 PRO CA C 81 62.637 62.370 0.267 1
1 1044 . 13 1 1 A 81 81 PRO CB C 81 32.965 32.472 0.493 1
1 1047 . 13 1 1 A 82 82 ILE H H 82 9.374 8.577 0.797 1
1 1048 . 13 1 1 A 82 82 ILE HA H 82 4.524 5.026 -0.502 1
1 1058 . 13 1 1 A 82 82 ILE C C 82 174.731 174.123 0.608 1
1 1059 . 13 1 1 A 82 82 ILE CA C 82 60.205 58.701 1.504 1
1 1060 . 13 1 1 A 82 82 ILE CB C 82 41.737 42.307 -0.570 1
1 1064 . 13 1 1 A 82 82 ILE N N 82 121.658 117.135 4.523 1
1 1065 . 13 1 1 A 83 83 ALA H H 83 8.819 8.689 0.130 1
1 1066 . 13 1 1 A 83 83 ALA HA H 83 4.773 5.023 -0.250 1
1 1070 . 13 1 1 A 83 83 ALA C C 83 176.550 176.792 -0.242 1
1 1071 . 13 1 1 A 83 83 ALA CA C 83 52.069 51.031 1.038 1
1 1072 . 13 1 1 A 83 83 ALA CB C 83 20.374 20.023 0.351 1
1 1073 . 13 1 1 A 83 83 ALA N N 83 127.933 124.978 2.955 1
1 1074 . 13 1 1 A 84 84 ASP H H 84 8.710 8.900 -0.190 1
1 1075 . 13 1 1 A 84 84 ASP HA H 84 4.894 4.818 0.076 1
1 1078 . 13 1 1 A 84 84 ASP C C 84 175.997 176.169 -0.172 1
1 1079 . 13 1 1 A 84 84 ASP CA C 84 53.334 54.291 -0.957 1
1 1080 . 13 1 1 A 84 84 ASP CB C 84 42.104 42.365 -0.261 1
1 1081 . 13 1 1 A 84 84 ASP N N 84 122.009 124.164 -2.155 1
1 1082 . 13 1 1 A 85 85 THR H H 85 8.349 8.711 -0.362 1
1 1083 . 13 1 1 A 85 85 THR HA H 85 4.420 4.741 -0.321 1
1 1088 . 13 1 1 A 85 85 THR C C 85 175.085 174.768 0.317 1
1 1089 . 13 1 1 A 85 85 THR CA C 85 62.304 61.780 0.524 1
1 1090 . 13 1 1 A 85 85 THR CB C 85 69.718 70.881 -1.163 1
1 1092 . 13 1 1 A 85 85 THR N N 85 114.986 119.148 -4.162 1
1 1093 . 13 1 1 A 86 86 VAL H H 86 8.188 7.797 0.391 1
1 1094 . 13 1 1 A 86 86 VAL HA H 86 4.021 3.901 0.120 1
1 1102 . 13 1 1 A 86 86 VAL C C 86 176.519 177.246 -0.727 1
1 1103 . 13 1 1 A 86 86 VAL CA C 86 63.046 64.033 -0.987 1
1 1104 . 13 1 1 A 86 86 VAL CB C 86 32.526 31.945 0.581 1
1 1107 . 13 1 1 A 86 86 VAL N N 86 122.275 121.401 0.874 1
1 1108 . 13 1 1 A 87 87 ALA H H 87 8.194 7.902 0.292 1
1 1109 . 13 1 1 A 87 87 ALA HA H 87 4.212 4.376 -0.164 1
1 1113 . 13 1 1 A 87 87 ALA C C 87 178.118 178.030 0.088 1
1 1114 . 13 1 1 A 87 87 ALA CA C 87 53.153 54.273 -1.120 1
1 1115 . 13 1 1 A 87 87 ALA CB C 87 19.165 18.293 0.872 1
1 1116 . 13 1 1 A 87 87 ALA N N 87 126.609 124.131 2.478 1
1 1117 . 13 1 1 A 88 88 THR H H 88 7.914 7.870 0.044 1
1 1118 . 13 1 1 A 88 88 THR HA H 88 4.173 4.701 -0.528 1
1 1123 . 13 1 1 A 88 88 THR C C 88 174.516 175.882 -1.366 1
1 1124 . 13 1 1 A 88 88 THR CA C 88 62.785 62.854 -0.069 1
1 1125 . 13 1 1 A 88 88 THR CB C 88 69.582 70.175 -0.593 1
1 1127 . 13 1 1 A 88 88 THR N N 88 112.328 112.224 0.104 1
1 1128 . 13 1 1 A 89 89 ALA H H 89 8.076 7.792 0.284 1
1 1129 . 13 1 1 A 89 89 ALA HA H 89 4.320 4.310 0.010 1
1 1133 . 13 1 1 A 89 89 ALA C C 89 178.014 179.289 -1.275 1
1 1134 . 13 1 1 A 89 89 ALA CA C 89 53.079 54.174 -1.095 1
1 1135 . 13 1 1 A 89 89 ALA CB C 89 19.335 19.670 -0.335 1
1 1136 . 13 1 1 A 89 89 ALA N N 89 124.632 122.879 1.753 1
1 1137 . 13 1 1 A 90 90 THR H H 90 7.976 7.846 0.130 1
1 1138 . 13 1 1 A 90 90 THR HA H 90 4.203 3.985 0.218 1
1 1143 . 13 1 1 A 90 90 THR C C 90 174.427 173.437 0.990 1
1 1144 . 13 1 1 A 90 90 THR CA C 90 62.519 63.796 -1.277 1
1 1145 . 13 1 1 A 90 90 THR CB C 90 69.721 69.157 0.564 1
1 1147 . 13 1 1 A 90 90 THR N N 90 112.047 111.929 0.118 1
1 1148 . 13 1 1 A 91 91 TYR H H 91 7.959 7.625 0.334 1
1 1149 . 13 1 1 A 91 91 TYR HA H 91 4.564 5.050 -0.486 1
1 1156 . 13 1 1 A 91 91 TYR C C 91 175.522 174.922 0.600 1
1 1157 . 13 1 1 A 91 91 TYR CA C 91 57.874 56.148 1.726 1
1 1158 . 13 1 1 A 91 91 TYR CB C 91 38.584 39.283 -0.699 1
1 1163 . 13 1 1 A 91 91 TYR N N 91 121.184 119.697 1.487 1
1 1164 . 13 1 1 A 92 92 GLN H H 92 8.310 8.776 -0.466 1
1 1165 . 13 1 1 A 92 92 GLN HA H 92 4.258 4.222 0.036 1
1 1172 . 13 1 1 A 92 92 GLN C C 92 176.099 176.910 -0.811 1
1 1173 . 13 1 1 A 92 92 GLN CA C 92 56.109 57.422 -1.313 1
1 1174 . 13 1 1 A 92 92 GLN CB C 92 29.112 27.875 1.237 1
1 1177 . 13 1 1 A 92 92 GLN N N 92 121.631 124.403 -2.772 1
1 1179 . 13 1 1 A 93 93 GLY H H 93 8.052 8.988 -0.936 1
1 1180 . 13 1 1 A 93 93 GLY HA2 H 93 4.023 4.061 -0.038 1
1 1181 . 13 1 1 A 93 93 GLY HA3 H 93 3.856 4.067 -0.211 1
1 1182 . 13 1 1 A 93 93 GLY C C 93 173.791 174.929 -1.138 1
1 1183 . 13 1 1 A 93 93 GLY CA C 93 45.382 45.655 -0.273 1
1 1184 . 13 1 1 A 93 93 GLY N N 93 109.847 114.120 -4.273 1
1 1185 . 13 1 1 A 94 94 ALA H H 94 8.162 7.574 0.588 1
1 1186 . 13 1 1 A 94 94 ALA HA H 94 4.329 4.119 0.210 1
1 1190 . 13 1 1 A 94 94 ALA C C 94 177.392 177.518 -0.126 1
1 1191 . 13 1 1 A 94 94 ALA CA C 94 52.558 53.713 -1.155 1
1 1192 . 13 1 1 A 94 94 ALA CB C 94 19.526 19.290 0.236 1
1 1193 . 13 1 1 A 94 94 ALA N N 94 123.424 122.002 1.422 1
1 1194 . 13 1 1 A 95 95 ASP H H 95 8.457 7.714 0.743 1
1 1195 . 13 1 1 A 95 95 ASP HA H 95 4.608 4.834 -0.226 1
1 1198 . 13 1 1 A 95 95 ASP C C 95 175.630 175.726 -0.096 1
1 1199 . 13 1 1 A 95 95 ASP CA C 95 54.450 54.843 -0.393 1
1 1200 . 13 1 1 A 95 95 ASP CB C 95 40.871 41.767 -0.896 1
1 1201 . 13 1 1 A 95 95 ASP N N 95 118.814 117.275 1.539 1
1 1202 . 13 1 1 A 96 96 VAL H H 96 7.776 9.200 -1.424 1
1 1203 . 13 1 1 A 96 96 VAL HA H 96 4.141 4.298 -0.157 1
1 1211 . 13 1 1 A 96 96 VAL C C 96 175.301 176.699 -1.398 1
1 1212 . 13 1 1 A 96 96 VAL CA C 96 61.435 63.623 -2.188 1
1 1213 . 13 1 1 A 96 96 VAL CB C 96 33.517 32.727 0.790 1
1 1216 . 13 1 1 A 96 96 VAL N N 96 118.395 125.944 -7.549 1
1 1217 . 13 1 1 A 97 97 ASP H H 97 8.315 8.175 0.140 1
1 1218 . 13 1 1 A 97 97 ASP HA H 97 4.681 4.883 -0.202 1
1 1221 . 13 1 1 A 97 97 ASP C C 97 175.151 176.548 -1.397 1
1 1222 . 13 1 1 A 97 97 ASP CA C 97 54.324 55.732 -1.408 1
1 1223 . 13 1 1 A 97 97 ASP CB C 97 41.963 41.222 0.741 1
1 1224 . 13 1 1 A 97 97 ASP N N 97 123.905 116.979 6.926 1
1 1225 . 13 1 1 A 98 98 TRP H H 98 8.210 7.832 0.378 1
1 1226 . 13 1 1 A 98 98 TRP HA H 98 4.916 5.086 -0.170 1
1 1235 . 13 1 1 A 98 98 TRP C C 98 174.585 173.055 1.530 1
1 1236 . 13 1 1 A 98 98 TRP CA C 98 56.164 56.241 -0.077 1
1 1237 . 13 1 1 A 98 98 TRP CB C 98 31.466 30.965 0.501 1
1 1243 . 13 1 1 A 98 98 TRP N N 98 120.340 117.114 3.226 1
1 1245 . 13 1 1 A 99 99 TYR H H 99 8.760 9.139 -0.379 1
1 1246 . 13 1 1 A 99 99 TYR HA H 99 5.119 5.389 -0.270 1
1 1253 . 13 1 1 A 99 99 TYR C C 99 174.599 174.641 -0.042 1
1 1254 . 13 1 1 A 99 99 TYR CA C 99 57.021 56.712 0.309 1
1 1255 . 13 1 1 A 99 99 TYR CB C 99 39.526 40.479 -0.953 1
1 1260 . 13 1 1 A 99 99 TYR N N 99 123.319 119.787 3.532 1
1 1261 . 13 1 1 A 100 100 ILE H H 100 8.936 9.302 -0.366 1
1 1262 . 13 1 1 A 100 100 ILE HA H 100 4.850 4.663 0.187 1
1 1272 . 13 1 1 A 100 100 ILE C C 100 175.070 174.919 0.151 1
1 1273 . 13 1 1 A 100 100 ILE CA C 100 58.998 60.356 -1.358 1
1 1274 . 13 1 1 A 100 100 ILE CB C 100 40.667 37.888 2.779 1
1 1278 . 13 1 1 A 100 100 ILE N N 100 123.281 124.152 -0.871 1
1 1279 . 13 1 1 A 101 101 LYS H H 101 8.987 8.729 0.258 1
1 1280 . 13 1 1 A 101 101 LYS HA H 101 5.313 5.046 0.267 1
1 1289 . 13 1 1 A 101 101 LYS C C 101 174.440 176.165 -1.725 1
1 1290 . 13 1 1 A 101 101 LYS CA C 101 54.763 55.741 -0.978 1
1 1291 . 13 1 1 A 101 101 LYS CB C 101 34.880 33.515 1.365 1
1 1295 . 13 1 1 A 101 101 LYS N N 101 126.210 127.382 -1.172 1
1 1296 . 13 1 1 A 102 102 ALA H H 102 8.531 8.255 0.276 1
1 1297 . 13 1 1 A 102 102 ALA HA H 102 4.957 4.828 0.129 1
1 1301 . 13 1 1 A 102 102 ALA C C 102 175.024 177.937 -2.913 1
1 1302 . 13 1 1 A 102 102 ALA CA C 102 50.701 49.945 0.756 1
1 1303 . 13 1 1 A 102 102 ALA CB C 102 21.618 22.618 -1.000 1
1 1304 . 13 1 1 A 102 102 ALA N N 102 121.424 126.988 -5.564 1
1 1305 . 13 1 1 A 103 103 ASP H H 103 8.339 9.020 -0.681 1
1 1306 . 13 1 1 A 103 103 ASP HA H 103 4.603 4.461 0.142 1
1 1309 . 13 1 1 A 103 103 ASP C C 103 176.188 175.374 0.814 1
1 1310 . 13 1 1 A 103 103 ASP CA C 103 56.049 56.501 -0.452 1
1 1311 . 13 1 1 A 103 103 ASP CB C 103 40.932 41.499 -0.567 1
1 1312 . 13 1 1 A 103 103 ASP N N 103 117.773 119.676 -1.903 1
1 1313 . 13 1 1 A 104 104 ASP H H 104 7.482 7.724 -0.242 1
1 1314 . 13 1 1 A 104 104 ASP HA H 104 4.727 4.932 -0.205 1
1 1317 . 13 1 1 A 104 104 ASP C C 104 174.261 173.618 0.643 1
1 1318 . 13 1 1 A 104 104 ASP CA C 104 52.768 53.744 -0.976 1
1 1319 . 13 1 1 A 104 104 ASP CB C 104 42.587 43.987 -1.400 1
1 1320 . 13 1 1 A 104 104 ASP N N 104 110.673 116.733 -6.060 1
1 1321 . 13 1 1 A 105 105 ILE H H 105 9.267 8.567 0.700 1
1 1322 . 13 1 1 A 105 105 ILE HA H 105 4.631 4.907 -0.276 1
1 1332 . 13 1 1 A 105 105 ILE C C 105 173.922 175.258 -1.336 1
1 1333 . 13 1 1 A 105 105 ILE CA C 105 61.114 60.212 0.902 1
1 1334 . 13 1 1 A 105 105 ILE CB C 105 42.522 40.123 2.399 1
1 1338 . 13 1 1 A 105 105 ILE N N 105 121.380 122.353 -0.973 1
1 1339 . 13 1 1 A 106 106 VAL H H 106 8.592 9.167 -0.575 1
1 1340 . 13 1 1 A 106 106 VAL HA H 106 4.975 4.944 0.031 1
1 1348 . 13 1 1 A 106 106 VAL C C 106 175.049 174.831 0.218 1
1 1349 . 13 1 1 A 106 106 VAL CA C 106 58.028 59.832 -1.804 1
1 1350 . 13 1 1 A 106 106 VAL CB C 106 35.388 35.554 -0.166 1
1 1353 . 13 1 1 A 106 106 VAL N N 106 116.356 121.234 -4.878 1
1 1354 . 13 1 1 A 107 107 LEU H H 107 8.360 8.461 -0.101 1
1 1355 . 13 1 1 A 107 107 LEU HA H 107 4.167 4.640 -0.473 1
1 1365 . 13 1 1 A 107 107 LEU C C 107 178.338 176.453 1.885 1
1 1366 . 13 1 1 A 107 107 LEU CA C 107 55.077 53.364 1.713 1
1 1367 . 13 1 1 A 107 107 LEU CB C 107 42.394 42.384 0.010 1
1 1371 . 13 1 1 A 107 107 LEU N N 107 121.368 122.058 -0.690 1
1 1372 . 13 1 1 A 108 108 THR H H 108 7.977 8.809 -0.832 1
1 1373 . 13 1 1 A 108 108 THR HA H 108 4.039 4.153 -0.114 1
1 1378 . 13 1 1 A 108 108 THR C C 108 174.725 175.585 -0.860 1
1 1379 . 13 1 1 A 108 108 THR CA C 108 63.513 63.544 -0.031 1
1 1380 . 13 1 1 A 108 108 THR CB C 108 69.194 68.210 0.984 1
1 1382 . 13 1 1 A 108 108 THR N N 108 118.728 119.683 -0.955 1
1 1383 . 13 1 1 A 109 109 LEU H H 109 8.378 8.354 0.024 1
1 1384 . 13 1 1 A 109 109 LEU HA H 109 4.274 4.112 0.162 1
1 1394 . 13 1 1 A 109 109 LEU C C 109 177.058 177.761 -0.703 1
1 1395 . 13 1 1 A 109 109 LEU CA C 109 55.045 56.716 -1.671 1
1 1396 . 13 1 1 A 109 109 LEU CB C 109 42.620 41.882 0.738 1
1 1400 . 13 1 1 A 109 109 LEU N N 109 124.847 125.363 -0.516 1
1 9 . 14 1 1 A 2 2 MET HA H 2 4.554 5.006 -0.452 1
1 14 . 14 1 1 A 2 2 MET C C 2 174.749 174.295 0.454 1
1 15 . 14 1 1 A 2 2 MET CA C 2 55.354 53.533 1.821 1
1 16 . 14 1 1 A 2 2 MET CB C 2 33.729 34.918 -1.189 1
1 18 . 14 1 1 A 3 3 ARG H H 3 8.518 8.743 -0.225 1
1 19 . 14 1 1 A 3 3 ARG HA H 3 4.531 4.373 0.158 1
1 26 . 14 1 1 A 3 3 ARG C C 3 175.780 175.149 0.631 1
1 27 . 14 1 1 A 3 3 ARG CA C 3 55.854 55.820 0.034 1
1 28 . 14 1 1 A 3 3 ARG CB C 3 31.403 29.360 2.043 1
1 31 . 14 1 1 A 3 3 ARG N N 3 124.008 125.303 -1.295 1
1 32 . 14 1 1 A 4 4 LEU H H 4 8.424 8.678 -0.254 1
1 33 . 14 1 1 A 4 4 LEU HA H 4 4.457 4.343 0.114 1
1 43 . 14 1 1 A 4 4 LEU C C 4 177.362 176.226 1.136 1
1 44 . 14 1 1 A 4 4 LEU CA C 4 54.511 56.271 -1.760 1
1 45 . 14 1 1 A 4 4 LEU CB C 4 42.686 42.437 0.249 1
1 49 . 14 1 1 A 4 4 LEU N N 4 124.389 128.211 -3.822 1
1 50 . 14 1 1 A 5 5 ALA H H 5 8.418 7.950 0.468 1
1 51 . 14 1 1 A 5 5 ALA HA H 5 4.254 4.613 -0.359 1
1 55 . 14 1 1 A 5 5 ALA C C 5 177.420 176.481 0.939 1
1 56 . 14 1 1 A 5 5 ALA CA C 5 52.931 50.352 2.579 1
1 57 . 14 1 1 A 5 5 ALA CB C 5 19.263 20.975 -1.712 1
1 58 . 14 1 1 A 5 5 ALA N N 5 124.548 118.558 5.990 1
1 59 . 14 1 1 A 6 6 ASN H H 6 8.287 8.903 -0.616 1
1 60 . 14 1 1 A 6 6 ASN HA H 6 4.616 4.732 -0.116 1
1 65 . 14 1 1 A 6 6 ASN C C 6 175.837 174.810 1.027 1
1 66 . 14 1 1 A 6 6 ASN CA C 6 53.345 54.376 -1.031 1
1 67 . 14 1 1 A 6 6 ASN CB C 6 38.571 39.462 -0.891 1
1 69 . 14 1 1 A 6 6 ASN N N 6 116.484 122.718 -6.234 1
1 71 . 14 1 1 A 7 7 GLY H H 7 8.351 8.373 -0.022 1
1 72 . 14 1 1 A 7 7 GLY HA2 H 7 4.130 4.183 -0.053 1
1 73 . 14 1 1 A 7 7 GLY HA3 H 7 3.808 4.185 -0.377 1
1 74 . 14 1 1 A 7 7 GLY C C 7 173.750 172.160 1.590 1
1 75 . 14 1 1 A 7 7 GLY CA C 7 45.343 45.888 -0.545 1
1 76 . 14 1 1 A 7 7 GLY N N 7 108.453 111.620 -3.167 1
1 77 . 14 1 1 A 8 8 ILE H H 8 7.868 9.235 -1.367 1
1 78 . 14 1 1 A 8 8 ILE HA H 8 4.130 5.034 -0.904 1
1 88 . 14 1 1 A 8 8 ILE C C 8 175.570 174.616 0.954 1
1 89 . 14 1 1 A 8 8 ILE CA C 8 61.095 58.595 2.500 1
1 90 . 14 1 1 A 8 8 ILE CB C 8 38.694 41.882 -3.188 1
1 94 . 14 1 1 A 8 8 ILE N N 8 120.848 120.904 -0.056 1
1 95 . 14 1 1 A 9 9 VAL H H 9 8.220 8.661 -0.441 1
1 96 . 14 1 1 A 9 9 VAL HA H 9 4.172 4.098 0.074 1
1 104 . 14 1 1 A 9 9 VAL C C 9 175.898 175.963 -0.065 1
1 105 . 14 1 1 A 9 9 VAL CA C 9 62.488 63.167 -0.679 1
1 106 . 14 1 1 A 9 9 VAL CB C 9 32.460 31.578 0.882 1
1 109 . 14 1 1 A 9 9 VAL N N 9 125.805 125.273 0.532 1
1 110 . 14 1 1 A 10 10 LEU H H 10 8.437 8.768 -0.331 1
1 111 . 14 1 1 A 10 10 LEU HA H 10 4.347 4.625 -0.278 1
1 121 . 14 1 1 A 10 10 LEU C C 10 176.398 177.014 -0.616 1
1 122 . 14 1 1 A 10 10 LEU CA C 10 54.787 54.191 0.596 1
1 123 . 14 1 1 A 10 10 LEU CB C 10 42.639 42.117 0.522 1
1 127 . 14 1 1 A 10 10 LEU N N 10 127.757 129.762 -2.005 1
1 128 . 14 1 1 A 11 11 ASP H H 11 8.506 8.692 -0.186 1
1 129 . 14 1 1 A 11 11 ASP HA H 11 4.683 4.930 -0.247 1
1 132 . 14 1 1 A 11 11 ASP C C 11 176.672 176.130 0.542 1
1 133 . 14 1 1 A 11 11 ASP CA C 11 53.586 52.810 0.776 1
1 134 . 14 1 1 A 11 11 ASP CB C 11 41.123 41.464 -0.341 1
1 135 . 14 1 1 A 11 11 ASP N N 11 121.539 121.133 0.406 1
1 136 . 14 1 1 A 12 12 LYS H H 12 8.578 8.925 -0.347 1
1 137 . 14 1 1 A 12 12 LYS HA H 12 3.943 4.571 -0.628 1
1 146 . 14 1 1 A 12 12 LYS C C 12 176.917 177.215 -0.298 1
1 147 . 14 1 1 A 12 12 LYS CA C 12 58.542 56.806 1.736 1
1 148 . 14 1 1 A 12 12 LYS CB C 12 32.703 34.574 -1.871 1
1 152 . 14 1 1 A 12 12 LYS N N 12 123.635 118.011 5.624 1
1 153 . 14 1 1 A 13 13 ASP H H 13 8.523 8.192 0.331 1
1 154 . 14 1 1 A 13 13 ASP HA H 13 4.566 4.410 0.156 1
1 157 . 14 1 1 A 13 13 ASP C C 13 177.535 176.529 1.006 1
1 158 . 14 1 1 A 13 13 ASP CA C 13 56.034 53.725 2.309 1
1 159 . 14 1 1 A 13 13 ASP CB C 13 41.051 40.113 0.938 1
1 160 . 14 1 1 A 13 13 ASP N N 13 120.448 116.642 3.806 1
1 161 . 14 1 1 A 14 14 THR H H 14 7.964 7.460 0.504 1
1 162 . 14 1 1 A 14 14 THR HA H 14 4.146 3.844 0.302 1
1 167 . 14 1 1 A 14 14 THR C C 14 175.440 175.347 0.093 1
1 168 . 14 1 1 A 14 14 THR CA C 14 63.245 65.409 -2.164 1
1 169 . 14 1 1 A 14 14 THR CB C 14 69.092 69.231 -0.139 1
1 171 . 14 1 1 A 14 14 THR N N 14 113.711 113.997 -0.286 1
1 172 . 14 1 1 A 15 15 THR H H 15 7.921 7.865 0.056 1
1 173 . 14 1 1 A 15 15 THR HA H 15 3.920 4.328 -0.408 1
1 178 . 14 1 1 A 15 15 THR C C 15 174.750 174.577 0.173 1
1 179 . 14 1 1 A 15 15 THR CA C 15 64.562 61.205 3.357 1
1 180 . 14 1 1 A 15 15 THR CB C 15 69.166 68.231 0.935 1
1 182 . 14 1 1 A 15 15 THR N N 15 116.710 112.599 4.111 1
1 183 . 14 1 1 A 16 16 PHE H H 16 8.191 8.918 -0.727 1
1 184 . 14 1 1 A 16 16 PHE HA H 16 4.628 4.309 0.319 1
1 192 . 14 1 1 A 16 16 PHE C C 16 177.754 176.300 1.454 1
1 193 . 14 1 1 A 16 16 PHE CA C 16 57.975 61.018 -3.043 1
1 194 . 14 1 1 A 16 16 PHE CB C 16 39.553 39.605 -0.052 1
1 200 . 14 1 1 A 16 16 PHE N N 16 117.124 124.477 -7.353 1
1 201 . 14 1 1 A 17 17 GLY H H 17 8.110 8.094 0.016 1
1 202 . 14 1 1 A 17 17 GLY HA2 H 17 4.017 4.102 -0.085 1
1 203 . 14 1 1 A 17 17 GLY HA3 H 17 3.849 4.112 -0.263 1
1 204 . 14 1 1 A 17 17 GLY C C 17 172.231 173.645 -1.414 1
1 205 . 14 1 1 A 17 17 GLY CA C 17 45.633 45.556 0.077 1
1 206 . 14 1 1 A 17 17 GLY N N 17 109.951 105.791 4.160 1
1 207 . 14 1 1 A 18 18 GLU H H 18 8.304 8.469 -0.165 1
1 208 . 14 1 1 A 18 18 GLU HA H 18 4.078 4.505 -0.427 1
1 213 . 14 1 1 A 18 18 GLU C C 18 175.588 175.429 0.159 1
1 214 . 14 1 1 A 18 18 GLU CA C 18 57.446 56.273 1.173 1
1 215 . 14 1 1 A 18 18 GLU CB C 18 30.767 29.936 0.831 1
1 217 . 14 1 1 A 18 18 GLU N N 18 121.640 125.158 -3.518 1
1 218 . 14 1 1 A 19 19 LEU H H 19 8.799 8.855 -0.056 1
1 219 . 14 1 1 A 19 19 LEU HA H 19 5.416 5.232 0.184 1
1 229 . 14 1 1 A 19 19 LEU C C 19 176.875 175.334 1.541 1
1 230 . 14 1 1 A 19 19 LEU CA C 19 53.281 53.552 -0.271 1
1 231 . 14 1 1 A 19 19 LEU CB C 19 45.508 43.651 1.857 1
1 235 . 14 1 1 A 19 19 LEU N N 19 127.101 126.799 0.302 1
1 236 . 14 1 1 A 20 20 LYS H H 20 8.494 8.589 -0.095 1
1 237 . 14 1 1 A 20 20 LYS HA H 20 5.200 4.897 0.303 1
1 246 . 14 1 1 A 20 20 LYS C C 20 176.163 175.817 0.346 1
1 247 . 14 1 1 A 20 20 LYS CA C 20 53.575 54.424 -0.849 1
1 248 . 14 1 1 A 20 20 LYS CB C 20 36.835 34.101 2.734 1
1 252 . 14 1 1 A 20 20 LYS N N 20 118.828 124.483 -5.655 1
1 253 . 14 1 1 A 21 21 PHE H H 21 9.658 8.911 0.747 1
1 254 . 14 1 1 A 21 21 PHE HA H 21 4.038 4.742 -0.704 1
1 262 . 14 1 1 A 21 21 PHE C C 21 174.296 175.241 -0.945 1
1 263 . 14 1 1 A 21 21 PHE CA C 21 60.462 56.391 4.071 1
1 264 . 14 1 1 A 21 21 PHE CB C 21 40.359 38.923 1.436 1
1 270 . 14 1 1 A 21 21 PHE N N 21 124.322 126.595 -2.273 1
1 271 . 14 1 1 A 22 22 SER H H 22 7.199 8.552 -1.353 1
1 272 . 14 1 1 A 22 22 SER HA H 22 5.046 4.453 0.593 1
1 275 . 14 1 1 A 22 22 SER C C 22 173.080 174.118 -1.038 1
1 276 . 14 1 1 A 22 22 SER CA C 22 58.547 60.755 -2.208 1
1 277 . 14 1 1 A 22 22 SER CB C 22 63.591 63.051 0.540 1
1 278 . 14 1 1 A 22 22 SER N N 22 120.109 123.959 -3.850 1
1 279 . 14 1 1 A 23 23 ALA H H 23 7.269 6.853 0.416 1
1 280 . 14 1 1 A 23 23 ALA HA H 23 4.426 4.462 -0.036 1
1 284 . 14 1 1 A 23 23 ALA C C 23 176.568 174.447 2.121 1
1 285 . 14 1 1 A 23 23 ALA CA C 23 52.458 51.391 1.067 1
1 286 . 14 1 1 A 23 23 ALA CB C 23 22.728 22.425 0.303 1
1 287 . 14 1 1 A 23 23 ALA N N 23 114.102 118.979 -4.877 1
1 288 . 14 1 1 A 24 24 LEU H H 24 8.819 8.704 0.115 1
1 289 . 14 1 1 A 24 24 LEU HA H 24 4.060 4.413 -0.353 1
1 299 . 14 1 1 A 24 24 LEU C C 24 175.363 176.450 -1.087 1
1 300 . 14 1 1 A 24 24 LEU CA C 24 56.901 54.349 2.552 1
1 301 . 14 1 1 A 24 24 LEU CB C 24 42.065 42.095 -0.030 1
1 305 . 14 1 1 A 24 24 LEU N N 24 120.865 120.964 -0.099 1
1 306 . 14 1 1 A 25 25 ARG H H 25 9.473 8.544 0.929 1
1 307 . 14 1 1 A 25 25 ARG HA H 25 4.428 4.079 0.349 1
1 315 . 14 1 1 A 25 25 ARG C C 25 175.729 175.809 -0.080 1
1 316 . 14 1 1 A 25 25 ARG CA C 25 56.721 58.169 -1.448 1
1 317 . 14 1 1 A 25 25 ARG CB C 25 31.109 31.234 -0.125 1
1 320 . 14 1 1 A 25 25 ARG N N 25 130.455 127.616 2.839 1
1 322 . 14 1 1 A 26 26 ARG H H 26 7.711 7.315 0.396 1
1 323 . 14 1 1 A 26 26 ARG HA H 26 4.559 4.531 0.028 1
1 330 . 14 1 1 A 26 26 ARG C C 26 173.724 173.649 0.075 1
1 331 . 14 1 1 A 26 26 ARG CA C 26 55.737 55.755 -0.018 1
1 332 . 14 1 1 A 26 26 ARG CB C 26 33.261 34.180 -0.919 1
1 335 . 14 1 1 A 26 26 ARG N N 26 113.305 118.253 -4.948 1
1 336 . 14 1 1 A 27 27 GLU H H 27 8.848 8.593 0.255 1
1 337 . 14 1 1 A 27 27 GLU HA H 27 4.615 4.582 0.033 1
1 342 . 14 1 1 A 27 27 GLU C C 27 174.836 176.613 -1.777 1
1 343 . 14 1 1 A 27 27 GLU CA C 27 55.901 55.633 0.268 1
1 344 . 14 1 1 A 27 27 GLU CB C 27 30.755 29.987 0.768 1
1 346 . 14 1 1 A 27 27 GLU N N 27 121.934 124.836 -2.902 1
1 347 . 14 1 1 A 28 28 VAL H H 28 8.603 8.125 0.478 1
1 348 . 14 1 1 A 28 28 VAL HA H 28 4.013 4.230 -0.217 1
1 356 . 14 1 1 A 28 28 VAL C C 28 175.561 175.956 -0.395 1
1 357 . 14 1 1 A 28 28 VAL CA C 28 62.791 61.918 0.873 1
1 358 . 14 1 1 A 28 28 VAL CB C 28 32.710 32.747 -0.037 1
1 361 . 14 1 1 A 28 28 VAL N N 28 125.545 121.181 4.364 1
1 362 . 14 1 1 A 29 29 ARG H H 29 8.735 8.591 0.144 1
1 363 . 14 1 1 A 29 29 ARG HA H 29 4.774 4.799 -0.025 1
1 370 . 14 1 1 A 29 29 ARG C C 29 176.580 175.719 0.861 1
1 371 . 14 1 1 A 29 29 ARG CA C 29 55.481 53.969 1.512 1
1 372 . 14 1 1 A 29 29 ARG CB C 29 31.963 33.207 -1.244 1
1 375 . 14 1 1 A 29 29 ARG N N 29 128.327 123.142 5.185 1
1 376 . 14 1 1 A 30 30 ILE H H 30 8.358 8.884 -0.526 1
1 377 . 14 1 1 A 30 30 ILE HA H 30 3.882 4.231 -0.349 1
1 387 . 14 1 1 A 30 30 ILE C C 30 175.093 175.743 -0.650 1
1 388 . 14 1 1 A 30 30 ILE CA C 30 61.669 60.638 1.031 1
1 389 . 14 1 1 A 30 30 ILE CB C 30 38.806 37.732 1.074 1
1 393 . 14 1 1 A 30 30 ILE N N 30 121.957 121.362 0.595 1
1 394 . 14 1 1 A 31 31 GLN H H 31 8.560 8.611 -0.051 1
1 395 . 14 1 1 A 31 31 GLN HA H 31 4.647 4.811 -0.164 1
1 402 . 14 1 1 A 31 31 GLN C C 31 175.954 175.482 0.472 1
1 403 . 14 1 1 A 31 31 GLN CA C 31 54.833 54.638 0.195 1
1 404 . 14 1 1 A 31 31 GLN CB C 31 30.584 30.200 0.384 1
1 407 . 14 1 1 A 31 31 GLN N N 31 126.348 126.922 -0.574 1
1 409 . 14 1 1 A 32 32 ASN H H 32 8.994 9.246 -0.252 1
1 410 . 14 1 1 A 32 32 ASN HA H 32 4.784 4.942 -0.158 1
1 415 . 14 1 1 A 32 32 ASN C C 32 177.296 176.791 0.505 1
1 416 . 14 1 1 A 32 32 ASN CA C 32 53.206 52.391 0.815 1
1 417 . 14 1 1 A 32 32 ASN CB C 32 39.472 39.606 -0.134 1
1 419 . 14 1 1 A 32 32 ASN N N 32 122.834 123.531 -0.697 1
1 421 . 14 1 1 A 33 33 GLU H H 33 9.180 9.038 0.142 1
1 422 . 14 1 1 A 33 33 GLU HA H 33 4.063 4.029 0.034 1
1 427 . 14 1 1 A 33 33 GLU C C 33 176.787 178.363 -1.576 1
1 428 . 14 1 1 A 33 33 GLU CA C 33 59.347 59.329 0.018 1
1 429 . 14 1 1 A 33 33 GLU CB C 33 29.294 29.258 0.036 1
1 431 . 14 1 1 A 33 33 GLU N N 33 122.736 122.280 0.456 1
1 432 . 14 1 1 A 34 34 ASP H H 34 7.969 7.910 0.059 1
1 433 . 14 1 1 A 34 34 ASP HA H 34 4.499 4.586 -0.087 1
1 436 . 14 1 1 A 34 34 ASP C C 34 177.111 176.251 0.860 1
1 437 . 14 1 1 A 34 34 ASP CA C 34 53.632 54.778 -1.146 1
1 438 . 14 1 1 A 34 34 ASP CB C 34 39.807 41.308 -1.501 1
1 439 . 14 1 1 A 34 34 ASP N N 34 115.921 117.315 -1.394 1
1 440 . 14 1 1 A 35 35 GLY H H 35 8.083 8.081 0.002 1
1 441 . 14 1 1 A 35 35 GLY HA2 H 35 4.366 4.012 0.354 1
1 442 . 14 1 1 A 35 35 GLY HA3 H 35 3.657 4.014 -0.357 1
1 443 . 14 1 1 A 35 35 GLY C C 35 174.584 174.671 -0.087 1
1 444 . 14 1 1 A 35 35 GLY CA C 35 45.134 45.116 0.018 1
1 445 . 14 1 1 A 35 35 GLY N N 35 108.874 107.987 0.887 1
1 446 . 14 1 1 A 36 36 SER H H 36 8.274 7.732 0.542 1
1 447 . 14 1 1 A 36 36 SER HA H 36 4.389 4.467 -0.078 1
1 450 . 14 1 1 A 36 36 SER C C 36 173.284 173.734 -0.450 1
1 451 . 14 1 1 A 36 36 SER CA C 36 58.383 59.484 -1.101 1
1 452 . 14 1 1 A 36 36 SER CB C 36 64.576 64.421 0.155 1
1 453 . 14 1 1 A 36 36 SER N N 36 117.428 117.647 -0.219 1
1 454 . 14 1 1 A 37 37 VAL H H 37 8.508 8.592 -0.084 1
1 455 . 14 1 1 A 37 37 VAL HA H 37 4.346 4.416 -0.070 1
1 463 . 14 1 1 A 37 37 VAL C C 37 176.370 175.802 0.568 1
1 464 . 14 1 1 A 37 37 VAL CA C 37 62.410 61.737 0.673 1
1 465 . 14 1 1 A 37 37 VAL CB C 37 33.086 32.263 0.823 1
1 468 . 14 1 1 A 37 37 VAL N N 37 119.189 124.285 -5.096 1
1 469 . 14 1 1 A 38 38 SER H H 38 8.461 8.926 -0.465 1
1 470 . 14 1 1 A 38 38 SER HA H 38 4.586 4.771 -0.185 1
1 473 . 14 1 1 A 38 38 SER C C 38 173.829 174.584 -0.755 1
1 474 . 14 1 1 A 38 38 SER CA C 38 57.618 56.868 0.750 1
1 475 . 14 1 1 A 38 38 SER CB C 38 64.537 65.157 -0.620 1
1 476 . 14 1 1 A 38 38 SER N N 38 121.629 120.286 1.343 1
1 477 . 14 1 1 A 39 39 ASP H H 39 8.512 8.577 -0.065 1
1 478 . 14 1 1 A 39 39 ASP HA H 39 4.606 4.562 0.044 1
1 481 . 14 1 1 A 39 39 ASP C C 39 176.557 176.530 0.027 1
1 482 . 14 1 1 A 39 39 ASP CA C 39 54.833 55.617 -0.784 1
1 483 . 14 1 1 A 39 39 ASP CB C 39 41.123 41.625 -0.502 1
1 484 . 14 1 1 A 39 39 ASP N N 39 120.305 122.954 -2.649 1
1 485 . 14 1 1 A 40 40 GLU H H 40 8.311 7.833 0.478 1
1 486 . 14 1 1 A 40 40 GLU HA H 40 4.235 4.397 -0.162 1
1 491 . 14 1 1 A 40 40 GLU C C 40 175.327 175.909 -0.582 1
1 492 . 14 1 1 A 40 40 GLU CA C 40 56.215 57.173 -0.958 1
1 493 . 14 1 1 A 40 40 GLU CB C 40 30.788 30.112 0.676 1
1 495 . 14 1 1 A 40 40 GLU N N 40 120.680 118.565 2.115 1
1 496 . 14 1 1 A 41 41 ILE H H 41 8.465 8.868 -0.403 1
1 497 . 14 1 1 A 41 41 ILE HA H 41 4.127 4.316 -0.189 1
1 507 . 14 1 1 A 41 41 ILE C C 41 175.380 175.898 -0.518 1
1 508 . 14 1 1 A 41 41 ILE CA C 41 60.670 60.367 0.303 1
1 509 . 14 1 1 A 41 41 ILE CB C 41 38.805 38.724 0.081 1
1 513 . 14 1 1 A 41 41 ILE N N 41 123.665 124.663 -0.998 1
1 514 . 14 1 1 A 42 42 LYS H H 42 9.556 9.363 0.193 1
1 515 . 14 1 1 A 42 42 LYS HA H 42 4.428 4.433 -0.005 1
1 524 . 14 1 1 A 42 42 LYS C C 42 177.277 176.215 1.062 1
1 525 . 14 1 1 A 42 42 LYS CA C 42 57.274 57.424 -0.150 1
1 526 . 14 1 1 A 42 42 LYS CB C 42 35.169 33.980 1.189 1
1 530 . 14 1 1 A 42 42 LYS N N 42 125.597 128.089 -2.492 1
1 531 . 14 1 1 A 43 43 GLU H H 43 7.809 7.422 0.387 1
1 532 . 14 1 1 A 43 43 GLU HA H 43 4.886 4.706 0.180 1
1 537 . 14 1 1 A 43 43 GLU C C 43 173.593 173.747 -0.154 1
1 538 . 14 1 1 A 43 43 GLU CA C 43 54.669 55.343 -0.674 1
1 539 . 14 1 1 A 43 43 GLU CB C 43 32.882 32.102 0.780 1
1 541 . 14 1 1 A 43 43 GLU N N 43 115.292 114.304 0.988 1
1 542 . 14 1 1 A 44 44 ARG H H 44 8.879 8.822 0.057 1
1 543 . 14 1 1 A 44 44 ARG HA H 44 4.917 4.908 0.009 1
1 551 . 14 1 1 A 44 44 ARG C C 44 173.708 175.003 -1.295 1
1 552 . 14 1 1 A 44 44 ARG CA C 44 55.965 54.876 1.089 1
1 553 . 14 1 1 A 44 44 ARG CB C 44 33.579 32.148 1.431 1
1 556 . 14 1 1 A 44 44 ARG N N 44 118.233 119.896 -1.663 1
1 558 . 14 1 1 A 45 45 THR H H 45 8.892 9.071 -0.179 1
1 559 . 14 1 1 A 45 45 THR HA H 45 5.308 4.726 0.582 1
1 564 . 14 1 1 A 45 45 THR C C 45 173.357 173.139 0.218 1
1 565 . 14 1 1 A 45 45 THR CA C 45 60.939 62.174 -1.235 1
1 566 . 14 1 1 A 45 45 THR CB C 45 70.054 69.658 0.396 1
1 568 . 14 1 1 A 45 45 THR N N 45 118.457 120.578 -2.121 1
1 569 . 14 1 1 A 46 46 TYR H H 46 9.625 9.703 -0.078 1
1 570 . 14 1 1 A 46 46 TYR HA H 46 4.771 4.974 -0.203 1
1 578 . 14 1 1 A 46 46 TYR C C 46 173.735 174.691 -0.956 1
1 579 . 14 1 1 A 46 46 TYR CA C 46 57.480 55.929 1.551 1
1 580 . 14 1 1 A 46 46 TYR CB C 46 41.724 42.624 -0.900 1
1 585 . 14 1 1 A 46 46 TYR N N 46 125.916 125.751 0.165 1
1 586 . 14 1 1 A 47 47 ASP H H 47 9.006 8.919 0.087 1
1 587 . 14 1 1 A 47 47 ASP HA H 47 5.399 5.024 0.375 1
1 590 . 14 1 1 A 47 47 ASP C C 47 175.094 174.636 0.458 1
1 591 . 14 1 1 A 47 47 ASP CA C 47 53.460 53.693 -0.233 1
1 592 . 14 1 1 A 47 47 ASP CB C 47 41.947 41.826 0.121 1
1 593 . 14 1 1 A 47 47 ASP N N 47 122.109 122.730 -0.621 1
1 594 . 14 1 1 A 48 48 LEU H H 48 9.066 8.828 0.238 1
1 595 . 14 1 1 A 48 48 LEU HA H 48 4.831 5.010 -0.179 1
1 605 . 14 1 1 A 48 48 LEU C C 48 174.977 175.229 -0.252 1
1 606 . 14 1 1 A 48 48 LEU CA C 48 52.724 53.285 -0.561 1
1 607 . 14 1 1 A 48 48 LEU CB C 48 44.844 44.869 -0.025 1
1 611 . 14 1 1 A 48 48 LEU N N 48 121.879 125.830 -3.951 1
1 612 . 14 1 1 A 49 49 LYS H H 49 9.401 8.760 0.641 1
1 613 . 14 1 1 A 49 49 LYS HA H 49 4.477 4.749 -0.272 1
1 622 . 14 1 1 A 49 49 LYS C C 49 176.225 174.671 1.554 1
1 623 . 14 1 1 A 49 49 LYS CA C 49 56.017 55.123 0.894 1
1 624 . 14 1 1 A 49 49 LYS CB C 49 33.838 33.725 0.113 1
1 628 . 14 1 1 A 49 49 LYS N N 49 122.218 123.161 -0.943 1
1 629 . 14 1 1 A 50 50 SER H H 50 8.266 8.859 -0.593 1
1 630 . 14 1 1 A 50 50 SER HA H 50 5.222 4.946 0.276 1
1 633 . 14 1 1 A 50 50 SER C C 50 175.570 173.456 2.114 1
1 634 . 14 1 1 A 50 50 SER CA C 50 55.770 56.566 -0.796 1
1 635 . 14 1 1 A 50 50 SER CB C 50 64.738 64.117 0.621 1
1 636 . 14 1 1 A 50 50 SER N N 50 117.388 120.053 -2.665 1
1 637 . 14 1 1 A 51 51 LYS H H 51 9.276 8.598 0.678 1
1 638 . 14 1 1 A 51 51 LYS HA H 51 4.208 3.997 0.211 1
1 647 . 14 1 1 A 51 51 LYS C C 51 178.773 177.319 1.454 1
1 648 . 14 1 1 A 51 51 LYS CA C 51 58.674 58.073 0.601 1
1 649 . 14 1 1 A 51 51 LYS CB C 51 33.383 32.399 0.984 1
1 653 . 14 1 1 A 51 51 LYS N N 51 130.550 129.196 1.354 1
1 654 . 14 1 1 A 52 52 GLY H H 52 8.320 8.907 -0.587 1
1 655 . 14 1 1 A 52 52 GLY HA2 H 52 3.875 3.997 -0.122 1
1 656 . 14 1 1 A 52 52 GLY HA3 H 52 3.628 4.010 -0.382 1
1 657 . 14 1 1 A 52 52 GLY C C 52 175.108 175.732 -0.624 1
1 658 . 14 1 1 A 52 52 GLY CA C 52 46.322 45.674 0.648 1
1 659 . 14 1 1 A 52 52 GLY N N 52 107.053 115.101 -8.048 1
1 660 . 14 1 1 A 53 53 GLN H H 53 7.859 8.369 -0.510 1
1 661 . 14 1 1 A 53 53 GLN HA H 53 4.409 4.380 0.029 1
1 668 . 14 1 1 A 53 53 GLN C C 53 176.469 176.756 -0.287 1
1 669 . 14 1 1 A 53 53 GLN CA C 53 54.911 55.814 -0.903 1
1 670 . 14 1 1 A 53 53 GLN CB C 53 29.675 29.459 0.216 1
1 673 . 14 1 1 A 53 53 GLN N N 53 115.482 119.378 -3.896 1
1 675 . 14 1 1 A 54 54 GLY H H 54 7.992 8.089 -0.097 1
1 676 . 14 1 1 A 54 54 GLY HA2 H 54 3.934 3.959 -0.025 1
1 677 . 14 1 1 A 54 54 GLY HA3 H 54 3.934 3.964 -0.030 1
1 678 . 14 1 1 A 54 54 GLY C C 54 173.897 174.147 -0.250 1
1 679 . 14 1 1 A 54 54 GLY CA C 54 46.574 46.324 0.250 1
1 680 . 14 1 1 A 54 54 GLY N N 54 110.111 109.654 0.457 1
1 681 . 14 1 1 A 55 55 ARG H H 55 7.652 7.313 0.339 1
1 682 . 14 1 1 A 55 55 ARG HA H 55 4.665 4.871 -0.206 1
1 690 . 14 1 1 A 55 55 ARG C C 55 174.649 175.175 -0.526 1
1 691 . 14 1 1 A 55 55 ARG CA C 55 54.631 54.916 -0.285 1
1 692 . 14 1 1 A 55 55 ARG CB C 55 32.166 33.083 -0.917 1
1 695 . 14 1 1 A 55 55 ARG N N 55 114.214 116.903 -2.689 1
1 697 . 14 1 1 A 56 56 MET H H 56 8.593 9.058 -0.465 1
1 698 . 14 1 1 A 56 56 MET HA H 56 5.012 5.547 -0.535 1
1 703 . 14 1 1 A 56 56 MET C C 56 176.216 175.574 0.642 1
1 704 . 14 1 1 A 56 56 MET CA C 56 54.595 53.372 1.223 1
1 705 . 14 1 1 A 56 56 MET CB C 56 33.466 34.500 -1.034 1
1 707 . 14 1 1 A 56 56 MET N N 56 121.270 118.915 2.355 1
1 708 . 14 1 1 A 57 57 ILE H H 57 9.393 8.698 0.695 1
1 709 . 14 1 1 A 57 57 ILE HA H 57 4.717 4.755 -0.038 1
1 719 . 14 1 1 A 57 57 ILE C C 57 173.883 174.165 -0.282 1
1 720 . 14 1 1 A 57 57 ILE CA C 57 59.713 58.582 1.131 1
1 721 . 14 1 1 A 57 57 ILE CB C 57 40.933 40.536 0.397 1
1 725 . 14 1 1 A 57 57 ILE N N 57 120.811 119.301 1.510 1
1 726 . 14 1 1 A 58 58 GLN H H 58 8.218 7.903 0.315 1
1 727 . 14 1 1 A 58 58 GLN HA H 58 5.407 4.490 0.917 1
1 734 . 14 1 1 A 58 58 GLN C C 58 175.368 174.429 0.939 1
1 735 . 14 1 1 A 58 58 GLN CA C 58 55.163 55.225 -0.062 1
1 736 . 14 1 1 A 58 58 GLN CB C 58 30.841 28.707 2.134 1
1 739 . 14 1 1 A 58 58 GLN N N 58 122.281 121.938 0.343 1
1 741 . 14 1 1 A 59 59 VAL H H 59 9.188 8.620 0.568 1
1 742 . 14 1 1 A 59 59 VAL HA H 59 5.025 5.162 -0.137 1
1 750 . 14 1 1 A 59 59 VAL C C 59 175.330 175.049 0.281 1
1 751 . 14 1 1 A 59 59 VAL CA C 59 59.975 61.288 -1.313 1
1 752 . 14 1 1 A 59 59 VAL CB C 59 34.818 33.173 1.645 1
1 755 . 14 1 1 A 59 59 VAL N N 59 122.421 126.594 -4.173 1
1 756 . 14 1 1 A 60 60 SER H H 60 9.022 8.830 0.192 1
1 757 . 14 1 1 A 60 60 SER HA H 60 5.811 6.035 -0.224 1
1 760 . 14 1 1 A 60 60 SER C C 60 173.234 173.242 -0.008 1
1 761 . 14 1 1 A 60 60 SER CA C 60 57.634 56.794 0.840 1
1 762 . 14 1 1 A 60 60 SER CB C 60 64.891 66.340 -1.449 1
1 763 . 14 1 1 A 60 60 SER N N 60 124.709 122.183 2.526 1
1 764 . 14 1 1 A 61 61 ILE H H 61 9.226 8.674 0.552 1
1 765 . 14 1 1 A 61 61 ILE HA H 61 5.572 5.028 0.544 1
1 775 . 14 1 1 A 61 61 ILE C C 61 173.955 173.849 0.106 1
1 776 . 14 1 1 A 61 61 ILE CA C 61 56.937 57.106 -0.169 1
1 777 . 14 1 1 A 61 61 ILE CB C 61 39.596 40.770 -1.174 1
1 781 . 14 1 1 A 61 61 ILE N N 61 121.648 119.416 2.232 1
1 782 . 14 1 1 A 62 62 PRO HA H 62 4.606 4.541 0.065 1
1 789 . 14 1 1 A 62 62 PRO C C 62 178.143 177.370 0.773 1
1 790 . 14 1 1 A 62 62 PRO CA C 62 63.740 62.788 0.952 1
1 791 . 14 1 1 A 62 62 PRO CB C 62 33.303 32.663 0.640 1
1 794 . 14 1 1 A 63 63 ALA H H 63 7.803 8.727 -0.924 1
1 795 . 14 1 1 A 63 63 ALA HA H 63 4.037 4.092 -0.055 1
1 799 . 14 1 1 A 63 63 ALA C C 63 175.942 179.673 -3.731 1
1 800 . 14 1 1 A 63 63 ALA CA C 63 54.417 55.020 -0.603 1
1 801 . 14 1 1 A 63 63 ALA CB C 63 19.345 17.720 1.625 1
1 802 . 14 1 1 A 63 63 ALA N N 63 123.695 126.892 -3.197 1
1 803 . 14 1 1 A 64 64 SER H H 64 7.719 7.959 -0.240 1
1 804 . 14 1 1 A 64 64 SER HA H 64 4.097 4.322 -0.225 1
1 807 . 14 1 1 A 64 64 SER C C 64 175.199 174.828 0.371 1
1 808 . 14 1 1 A 64 64 SER CA C 64 59.474 60.286 -0.812 1
1 809 . 14 1 1 A 64 64 SER CB C 64 62.125 62.993 -0.868 1
1 810 . 14 1 1 A 64 64 SER N N 64 110.001 110.812 -0.811 1
1 811 . 14 1 1 A 65 65 VAL H H 65 7.790 7.743 0.047 1
1 812 . 14 1 1 A 65 65 VAL HA H 65 4.360 4.197 0.163 1
1 820 . 14 1 1 A 65 65 VAL C C 65 174.433 174.197 0.236 1
1 821 . 14 1 1 A 65 65 VAL CA C 65 60.335 60.445 -0.110 1
1 822 . 14 1 1 A 65 65 VAL CB C 65 32.714 32.171 0.543 1
1 825 . 14 1 1 A 65 65 VAL N N 65 126.142 125.639 0.503 1
1 826 . 14 1 1 A 66 66 PRO HA H 66 4.369 4.552 -0.183 1
1 833 . 14 1 1 A 66 66 PRO C C 66 177.412 176.154 1.258 1
1 834 . 14 1 1 A 66 66 PRO CA C 66 63.104 62.656 0.448 1
1 835 . 14 1 1 A 66 66 PRO CB C 66 32.558 32.129 0.429 1
1 838 . 14 1 1 A 67 67 LEU H H 67 8.578 8.281 0.297 1
1 839 . 14 1 1 A 67 67 LEU HA H 67 3.875 4.507 -0.632 1
1 849 . 14 1 1 A 67 67 LEU C C 67 176.077 175.983 0.094 1
1 850 . 14 1 1 A 67 67 LEU CA C 67 56.413 55.195 1.218 1
1 851 . 14 1 1 A 67 67 LEU CB C 67 43.279 42.766 0.513 1
1 855 . 14 1 1 A 67 67 LEU N N 67 124.236 122.816 1.420 1
1 856 . 14 1 1 A 68 68 LYS H H 68 7.994 8.659 -0.665 1
1 857 . 14 1 1 A 68 68 LYS HA H 68 3.793 4.138 -0.345 1
1 866 . 14 1 1 A 68 68 LYS C C 68 175.601 175.552 0.049 1
1 867 . 14 1 1 A 68 68 LYS CA C 68 53.350 55.352 -2.002 1
1 868 . 14 1 1 A 68 68 LYS CB C 68 31.035 32.589 -1.554 1
1 872 . 14 1 1 A 68 68 LYS N N 68 124.053 126.318 -2.265 1
1 873 . 14 1 1 A 69 69 GLU H H 69 8.347 8.258 0.089 1
1 874 . 14 1 1 A 69 69 GLU HA H 69 4.501 4.545 -0.044 1
1 879 . 14 1 1 A 69 69 GLU C C 69 175.304 175.617 -0.313 1
1 880 . 14 1 1 A 69 69 GLU CA C 69 54.291 55.360 -1.069 1
1 881 . 14 1 1 A 69 69 GLU CB C 69 29.285 29.804 -0.519 1
1 883 . 14 1 1 A 69 69 GLU N N 69 123.876 123.341 0.535 1
1 884 . 14 1 1 A 70 70 PHE H H 70 5.549 6.982 -1.433 1
1 885 . 14 1 1 A 70 70 PHE HA H 70 4.592 4.505 0.087 1
1 893 . 14 1 1 A 70 70 PHE C C 70 174.443 175.161 -0.718 1
1 894 . 14 1 1 A 70 70 PHE CA C 70 53.313 57.701 -4.388 1
1 895 . 14 1 1 A 70 70 PHE CB C 70 38.335 39.689 -1.354 1
1 901 . 14 1 1 A 70 70 PHE N N 70 117.781 120.154 -2.373 1
1 902 . 14 1 1 A 71 71 ASP H H 71 8.791 8.669 0.122 1
1 903 . 14 1 1 A 71 71 ASP HA H 71 4.535 5.182 -0.647 1
1 906 . 14 1 1 A 71 71 ASP C C 71 175.867 176.658 -0.791 1
1 907 . 14 1 1 A 71 71 ASP CA C 71 54.248 53.119 1.129 1
1 908 . 14 1 1 A 71 71 ASP CB C 71 41.166 42.949 -1.783 1
1 909 . 14 1 1 A 71 71 ASP N N 71 120.385 121.615 -1.230 1
1 910 . 14 1 1 A 72 72 TYR H H 72 8.701 9.227 -0.526 1
1 911 . 14 1 1 A 72 72 TYR HA H 72 4.283 4.924 -0.641 1
1 918 . 14 1 1 A 72 72 TYR C C 72 177.470 177.033 0.437 1
1 919 . 14 1 1 A 72 72 TYR CA C 72 60.513 62.642 -2.129 1
1 920 . 14 1 1 A 72 72 TYR CB C 72 38.320 38.960 -0.640 1
1 925 . 14 1 1 A 72 72 TYR N N 72 121.876 127.248 -5.372 1
1 926 . 14 1 1 A 73 73 ASN H H 73 8.819 8.051 0.768 1
1 927 . 14 1 1 A 73 73 ASN HA H 73 4.096 4.717 -0.621 1
1 932 . 14 1 1 A 73 73 ASN C C 73 174.362 175.242 -0.880 1
1 933 . 14 1 1 A 73 73 ASN CA C 73 54.289 53.082 1.207 1
1 934 . 14 1 1 A 73 73 ASN CB C 73 36.907 39.356 -2.449 1
1 936 . 14 1 1 A 73 73 ASN N N 73 121.726 115.722 6.004 1
1 938 . 14 1 1 A 74 74 ALA H H 74 8.059 7.389 0.670 1
1 939 . 14 1 1 A 74 74 ALA HA H 74 4.100 4.255 -0.155 1
1 943 . 14 1 1 A 74 74 ALA C C 74 177.757 177.567 0.190 1
1 944 . 14 1 1 A 74 74 ALA CA C 74 53.153 52.387 0.766 1
1 945 . 14 1 1 A 74 74 ALA CB C 74 19.412 19.395 0.017 1
1 946 . 14 1 1 A 74 74 ALA N N 74 122.292 123.216 -0.924 1
1 947 . 14 1 1 A 75 75 ARG H H 75 8.500 8.441 0.059 1
1 948 . 14 1 1 A 75 75 ARG HA H 75 4.758 4.699 0.059 1
1 955 . 14 1 1 A 75 75 ARG C C 75 176.812 176.063 0.749 1
1 956 . 14 1 1 A 75 75 ARG CA C 75 56.646 56.116 0.530 1
1 957 . 14 1 1 A 75 75 ARG CB C 75 29.375 30.731 -1.356 1
1 960 . 14 1 1 A 75 75 ARG N N 75 122.871 122.523 0.348 1
1 961 . 14 1 1 A 76 76 VAL H H 76 7.965 8.745 -0.780 1
1 962 . 14 1 1 A 76 76 VAL HA H 76 5.230 4.899 0.331 1
1 970 . 14 1 1 A 76 76 VAL C C 76 173.758 174.275 -0.517 1
1 971 . 14 1 1 A 76 76 VAL CA C 76 58.193 59.156 -0.963 1
1 972 . 14 1 1 A 76 76 VAL CB C 76 36.536 35.214 1.322 1
1 975 . 14 1 1 A 76 76 VAL N N 76 116.220 118.265 -2.045 1
1 976 . 14 1 1 A 77 77 GLU H H 77 9.166 9.342 -0.176 1
1 977 . 14 1 1 A 77 77 GLU HA H 77 4.663 5.098 -0.435 1
1 982 . 14 1 1 A 77 77 GLU C C 77 174.940 174.483 0.457 1
1 983 . 14 1 1 A 77 77 GLU CA C 77 53.546 54.130 -0.584 1
1 984 . 14 1 1 A 77 77 GLU CB C 77 33.395 33.645 -0.250 1
1 986 . 14 1 1 A 77 77 GLU N N 77 116.413 121.886 -5.473 1
1 987 . 14 1 1 A 78 78 LEU H H 78 8.670 8.836 -0.166 1
1 988 . 14 1 1 A 78 78 LEU HA H 78 4.677 5.000 -0.323 1
1 998 . 14 1 1 A 78 78 LEU C C 78 176.036 176.680 -0.644 1
1 999 . 14 1 1 A 78 78 LEU CA C 78 53.091 53.369 -0.278 1
1 1000 . 14 1 1 A 78 78 LEU CB C 78 43.276 43.996 -0.720 1
1 1004 . 14 1 1 A 78 78 LEU N N 78 117.927 122.530 -4.603 1
1 1005 . 14 1 1 A 79 79 ILE H H 79 7.900 8.539 -0.639 1
1 1006 . 14 1 1 A 79 79 ILE HA H 79 4.312 3.963 0.349 1
1 1016 . 14 1 1 A 79 79 ILE C C 79 175.179 176.512 -1.333 1
1 1017 . 14 1 1 A 79 79 ILE CA C 79 58.294 64.579 -6.285 1
1 1018 . 14 1 1 A 79 79 ILE CB C 79 36.086 38.421 -2.335 1
1 1022 . 14 1 1 A 79 79 ILE N N 79 121.667 125.084 -3.417 1
1 1023 . 14 1 1 A 80 80 ASN H H 80 9.412 8.240 1.172 1
1 1024 . 14 1 1 A 80 80 ASN HA H 80 4.516 5.179 -0.663 1
1 1029 . 14 1 1 A 80 80 ASN C C 80 170.300 172.410 -2.110 1
1 1030 . 14 1 1 A 80 80 ASN CA C 80 54.198 50.474 3.724 1
1 1031 . 14 1 1 A 80 80 ASN CB C 80 37.450 39.203 -1.753 1
1 1033 . 14 1 1 A 80 80 ASN N N 80 123.831 119.066 4.765 1
1 1035 . 14 1 1 A 81 81 PRO HA H 81 5.185 4.836 0.349 1
1 1042 . 14 1 1 A 81 81 PRO C C 81 176.865 176.603 0.262 1
1 1043 . 14 1 1 A 81 81 PRO CA C 81 62.637 62.277 0.360 1
1 1044 . 14 1 1 A 81 81 PRO CB C 81 32.965 32.459 0.506 1
1 1047 . 14 1 1 A 82 82 ILE H H 82 9.374 8.620 0.754 1
1 1048 . 14 1 1 A 82 82 ILE HA H 82 4.524 5.017 -0.493 1
1 1058 . 14 1 1 A 82 82 ILE C C 82 174.731 174.776 -0.045 1
1 1059 . 14 1 1 A 82 82 ILE CA C 82 60.205 58.553 1.652 1
1 1060 . 14 1 1 A 82 82 ILE CB C 82 41.737 41.177 0.560 1
1 1064 . 14 1 1 A 82 82 ILE N N 82 121.658 117.346 4.312 1
1 1065 . 14 1 1 A 83 83 ALA H H 83 8.819 8.665 0.154 1
1 1066 . 14 1 1 A 83 83 ALA HA H 83 4.773 4.588 0.185 1
1 1070 . 14 1 1 A 83 83 ALA C C 83 176.550 176.382 0.168 1
1 1071 . 14 1 1 A 83 83 ALA CA C 83 52.069 52.403 -0.334 1
1 1072 . 14 1 1 A 83 83 ALA CB C 83 20.374 18.959 1.415 1
1 1073 . 14 1 1 A 83 83 ALA N N 83 127.933 127.758 0.175 1
1 1074 . 14 1 1 A 84 84 ASP H H 84 8.710 9.257 -0.547 1
1 1075 . 14 1 1 A 84 84 ASP HA H 84 4.894 4.800 0.094 1
1 1078 . 14 1 1 A 84 84 ASP C C 84 175.997 177.047 -1.050 1
1 1079 . 14 1 1 A 84 84 ASP CA C 84 53.334 54.465 -1.131 1
1 1080 . 14 1 1 A 84 84 ASP CB C 84 42.104 41.304 0.800 1
1 1081 . 14 1 1 A 84 84 ASP N N 84 122.009 124.147 -2.138 1
1 1082 . 14 1 1 A 85 85 THR H H 85 8.349 8.496 -0.147 1
1 1083 . 14 1 1 A 85 85 THR HA H 85 4.420 4.811 -0.391 1
1 1088 . 14 1 1 A 85 85 THR C C 85 175.085 174.843 0.242 1
1 1089 . 14 1 1 A 85 85 THR CA C 85 62.304 60.986 1.318 1
1 1090 . 14 1 1 A 85 85 THR CB C 85 69.718 68.689 1.029 1
1 1092 . 14 1 1 A 85 85 THR N N 85 114.986 115.583 -0.597 1
1 1093 . 14 1 1 A 86 86 VAL H H 86 8.188 7.706 0.482 1
1 1094 . 14 1 1 A 86 86 VAL HA H 86 4.021 4.085 -0.064 1
1 1102 . 14 1 1 A 86 86 VAL C C 86 176.519 177.768 -1.249 1
1 1103 . 14 1 1 A 86 86 VAL CA C 86 63.046 64.340 -1.294 1
1 1104 . 14 1 1 A 86 86 VAL CB C 86 32.526 32.858 -0.332 1
1 1107 . 14 1 1 A 86 86 VAL N N 86 122.275 120.751 1.524 1
1 1108 . 14 1 1 A 87 87 ALA H H 87 8.194 8.195 -0.001 1
1 1109 . 14 1 1 A 87 87 ALA HA H 87 4.212 3.959 0.253 1
1 1113 . 14 1 1 A 87 87 ALA C C 87 178.118 177.557 0.561 1
1 1114 . 14 1 1 A 87 87 ALA CA C 87 53.153 53.398 -0.245 1
1 1115 . 14 1 1 A 87 87 ALA CB C 87 19.165 18.632 0.533 1
1 1116 . 14 1 1 A 87 87 ALA N N 87 126.609 121.676 4.933 1
1 1117 . 14 1 1 A 88 88 THR H H 88 7.914 7.655 0.259 1
1 1118 . 14 1 1 A 88 88 THR HA H 88 4.173 4.456 -0.283 1
1 1123 . 14 1 1 A 88 88 THR C C 88 174.516 174.731 -0.215 1
1 1124 . 14 1 1 A 88 88 THR CA C 88 62.785 62.368 0.417 1
1 1125 . 14 1 1 A 88 88 THR CB C 88 69.582 68.278 1.304 1
1 1127 . 14 1 1 A 88 88 THR N N 88 112.328 110.773 1.555 1
1 1128 . 14 1 1 A 89 89 ALA H H 89 8.076 8.734 -0.658 1
1 1129 . 14 1 1 A 89 89 ALA HA H 89 4.320 4.157 0.163 1
1 1133 . 14 1 1 A 89 89 ALA C C 89 178.014 177.383 0.631 1
1 1134 . 14 1 1 A 89 89 ALA CA C 89 53.079 53.739 -0.660 1
1 1135 . 14 1 1 A 89 89 ALA CB C 89 19.335 18.166 1.169 1
1 1136 . 14 1 1 A 89 89 ALA N N 89 124.632 122.666 1.966 1
1 1137 . 14 1 1 A 90 90 THR H H 90 7.976 7.699 0.277 1
1 1138 . 14 1 1 A 90 90 THR HA H 90 4.203 3.974 0.229 1
1 1143 . 14 1 1 A 90 90 THR C C 90 174.427 174.517 -0.090 1
1 1144 . 14 1 1 A 90 90 THR CA C 90 62.519 63.946 -1.427 1
1 1145 . 14 1 1 A 90 90 THR CB C 90 69.721 68.891 0.830 1
1 1147 . 14 1 1 A 90 90 THR N N 90 112.047 111.561 0.486 1
1 1148 . 14 1 1 A 91 91 TYR H H 91 7.959 7.369 0.590 1
1 1149 . 14 1 1 A 91 91 TYR HA H 91 4.564 4.610 -0.046 1
1 1156 . 14 1 1 A 91 91 TYR C C 91 175.522 176.651 -1.129 1
1 1157 . 14 1 1 A 91 91 TYR CA C 91 57.874 58.144 -0.270 1
1 1158 . 14 1 1 A 91 91 TYR CB C 91 38.584 39.957 -1.373 1
1 1163 . 14 1 1 A 91 91 TYR N N 91 121.184 120.318 0.866 1
1 1164 . 14 1 1 A 92 92 GLN H H 92 8.310 8.658 -0.348 1
1 1165 . 14 1 1 A 92 92 GLN HA H 92 4.258 4.526 -0.268 1
1 1172 . 14 1 1 A 92 92 GLN C C 92 176.099 175.713 0.386 1
1 1173 . 14 1 1 A 92 92 GLN CA C 92 56.109 55.104 1.005 1
1 1174 . 14 1 1 A 92 92 GLN CB C 92 29.112 27.985 1.127 1
1 1177 . 14 1 1 A 92 92 GLN N N 92 121.631 119.547 2.084 1
1 1179 . 14 1 1 A 93 93 GLY H H 93 8.052 7.712 0.340 1
1 1180 . 14 1 1 A 93 93 GLY HA2 H 93 4.023 4.021 0.002 1
1 1181 . 14 1 1 A 93 93 GLY HA3 H 93 3.856 4.028 -0.172 1
1 1182 . 14 1 1 A 93 93 GLY C C 93 173.791 174.623 -0.832 1
1 1183 . 14 1 1 A 93 93 GLY CA C 93 45.382 45.606 -0.224 1
1 1184 . 14 1 1 A 93 93 GLY N N 93 109.847 107.926 1.921 1
1 1185 . 14 1 1 A 94 94 ALA H H 94 8.162 7.962 0.200 1
1 1186 . 14 1 1 A 94 94 ALA HA H 94 4.329 4.337 -0.008 1
1 1190 . 14 1 1 A 94 94 ALA C C 94 177.392 175.830 1.562 1
1 1191 . 14 1 1 A 94 94 ALA CA C 94 52.558 51.037 1.521 1
1 1192 . 14 1 1 A 94 94 ALA CB C 94 19.526 17.157 2.369 1
1 1193 . 14 1 1 A 94 94 ALA N N 94 123.424 124.509 -1.085 1
1 1194 . 14 1 1 A 95 95 ASP H H 95 8.457 8.842 -0.385 1
1 1195 . 14 1 1 A 95 95 ASP HA H 95 4.608 5.063 -0.455 1
1 1198 . 14 1 1 A 95 95 ASP C C 95 175.630 175.866 -0.236 1
1 1199 . 14 1 1 A 95 95 ASP CA C 95 54.450 53.868 0.582 1
1 1200 . 14 1 1 A 95 95 ASP CB C 95 40.871 40.570 0.301 1
1 1201 . 14 1 1 A 95 95 ASP N N 95 118.814 122.023 -3.209 1
1 1202 . 14 1 1 A 96 96 VAL H H 96 7.776 8.731 -0.955 1
1 1203 . 14 1 1 A 96 96 VAL HA H 96 4.141 5.015 -0.874 1
1 1211 . 14 1 1 A 96 96 VAL C C 96 175.301 175.044 0.257 1
1 1212 . 14 1 1 A 96 96 VAL CA C 96 61.435 58.842 2.593 1
1 1213 . 14 1 1 A 96 96 VAL CB C 96 33.517 34.970 -1.453 1
1 1216 . 14 1 1 A 96 96 VAL N N 96 118.395 117.175 1.220 1
1 1217 . 14 1 1 A 97 97 ASP H H 97 8.315 8.581 -0.266 1
1 1218 . 14 1 1 A 97 97 ASP HA H 97 4.681 4.736 -0.055 1
1 1221 . 14 1 1 A 97 97 ASP C C 97 175.151 176.035 -0.884 1
1 1222 . 14 1 1 A 97 97 ASP CA C 97 54.324 54.683 -0.359 1
1 1223 . 14 1 1 A 97 97 ASP CB C 97 41.963 41.861 0.102 1
1 1224 . 14 1 1 A 97 97 ASP N N 97 123.905 121.043 2.862 1
1 1225 . 14 1 1 A 98 98 TRP H H 98 8.210 8.830 -0.620 1
1 1226 . 14 1 1 A 98 98 TRP HA H 98 4.916 4.958 -0.042 1
1 1235 . 14 1 1 A 98 98 TRP C C 98 174.585 175.610 -1.025 1
1 1236 . 14 1 1 A 98 98 TRP CA C 98 56.164 56.802 -0.638 1
1 1237 . 14 1 1 A 98 98 TRP CB C 98 31.466 30.265 1.201 1
1 1243 . 14 1 1 A 98 98 TRP N N 98 120.340 120.618 -0.278 1
1 1245 . 14 1 1 A 99 99 TYR H H 99 8.760 9.180 -0.420 1
1 1246 . 14 1 1 A 99 99 TYR HA H 99 5.119 5.554 -0.435 1
1 1253 . 14 1 1 A 99 99 TYR C C 99 174.599 174.571 0.028 1
1 1254 . 14 1 1 A 99 99 TYR CA C 99 57.021 56.140 0.881 1
1 1255 . 14 1 1 A 99 99 TYR CB C 99 39.526 41.328 -1.802 1
1 1260 . 14 1 1 A 99 99 TYR N N 99 123.319 118.866 4.453 1
1 1261 . 14 1 1 A 100 100 ILE H H 100 8.936 9.280 -0.344 1
1 1262 . 14 1 1 A 100 100 ILE HA H 100 4.850 4.707 0.143 1
1 1272 . 14 1 1 A 100 100 ILE C C 100 175.070 174.752 0.318 1
1 1273 . 14 1 1 A 100 100 ILE CA C 100 58.998 60.281 -1.283 1
1 1274 . 14 1 1 A 100 100 ILE CB C 100 40.667 39.262 1.405 1
1 1278 . 14 1 1 A 100 100 ILE N N 100 123.281 123.220 0.061 1
1 1279 . 14 1 1 A 101 101 LYS H H 101 8.987 9.104 -0.117 1
1 1280 . 14 1 1 A 101 101 LYS HA H 101 5.313 5.306 0.007 1
1 1289 . 14 1 1 A 101 101 LYS C C 101 174.440 175.826 -1.386 1
1 1290 . 14 1 1 A 101 101 LYS CA C 101 54.763 55.162 -0.399 1
1 1291 . 14 1 1 A 101 101 LYS CB C 101 34.880 34.117 0.763 1
1 1295 . 14 1 1 A 101 101 LYS N N 101 126.210 127.361 -1.151 1
1 1296 . 14 1 1 A 102 102 ALA H H 102 8.531 8.278 0.253 1
1 1297 . 14 1 1 A 102 102 ALA HA H 102 4.957 5.053 -0.096 1
1 1301 . 14 1 1 A 102 102 ALA C C 102 175.024 177.948 -2.924 1
1 1302 . 14 1 1 A 102 102 ALA CA C 102 50.701 49.964 0.737 1
1 1303 . 14 1 1 A 102 102 ALA CB C 102 21.618 22.362 -0.744 1
1 1304 . 14 1 1 A 102 102 ALA N N 102 121.424 126.732 -5.308 1
1 1305 . 14 1 1 A 103 103 ASP H H 103 8.339 8.847 -0.508 1
1 1306 . 14 1 1 A 103 103 ASP HA H 103 4.603 4.427 0.176 1
1 1309 . 14 1 1 A 103 103 ASP C C 103 176.188 175.553 0.635 1
1 1310 . 14 1 1 A 103 103 ASP CA C 103 56.049 56.675 -0.626 1
1 1311 . 14 1 1 A 103 103 ASP CB C 103 40.932 41.184 -0.252 1
1 1312 . 14 1 1 A 103 103 ASP N N 103 117.773 119.715 -1.942 1
1 1313 . 14 1 1 A 104 104 ASP H H 104 7.482 7.795 -0.313 1
1 1314 . 14 1 1 A 104 104 ASP HA H 104 4.727 4.910 -0.183 1
1 1317 . 14 1 1 A 104 104 ASP C C 104 174.261 173.562 0.699 1
1 1318 . 14 1 1 A 104 104 ASP CA C 104 52.768 53.913 -1.145 1
1 1319 . 14 1 1 A 104 104 ASP CB C 104 42.587 44.117 -1.530 1
1 1320 . 14 1 1 A 104 104 ASP N N 104 110.673 116.774 -6.101 1
1 1321 . 14 1 1 A 105 105 ILE H H 105 9.267 8.773 0.494 1
1 1322 . 14 1 1 A 105 105 ILE HA H 105 4.631 4.784 -0.153 1
1 1332 . 14 1 1 A 105 105 ILE C C 105 173.922 175.566 -1.644 1
1 1333 . 14 1 1 A 105 105 ILE CA C 105 61.114 60.237 0.877 1
1 1334 . 14 1 1 A 105 105 ILE CB C 105 42.522 39.098 3.424 1
1 1338 . 14 1 1 A 105 105 ILE N N 105 121.380 123.154 -1.774 1
1 1339 . 14 1 1 A 106 106 VAL H H 106 8.592 8.793 -0.201 1
1 1340 . 14 1 1 A 106 106 VAL HA H 106 4.975 5.030 -0.055 1
1 1348 . 14 1 1 A 106 106 VAL C C 106 175.049 174.907 0.142 1
1 1349 . 14 1 1 A 106 106 VAL CA C 106 58.028 59.108 -1.080 1
1 1350 . 14 1 1 A 106 106 VAL CB C 106 35.388 35.361 0.027 1
1 1353 . 14 1 1 A 106 106 VAL N N 106 116.356 120.761 -4.405 1
1 1354 . 14 1 1 A 107 107 LEU H H 107 8.360 8.473 -0.113 1
1 1355 . 14 1 1 A 107 107 LEU HA H 107 4.167 4.235 -0.068 1
1 1365 . 14 1 1 A 107 107 LEU C C 107 178.338 177.123 1.215 1
1 1366 . 14 1 1 A 107 107 LEU CA C 107 55.077 54.505 0.572 1
1 1367 . 14 1 1 A 107 107 LEU CB C 107 42.394 41.953 0.441 1
1 1371 . 14 1 1 A 107 107 LEU N N 107 121.368 123.275 -1.907 1
1 1372 . 14 1 1 A 108 108 THR H H 108 7.977 8.868 -0.891 1
1 1373 . 14 1 1 A 108 108 THR HA H 108 4.039 4.555 -0.516 1
1 1378 . 14 1 1 A 108 108 THR C C 108 174.725 174.750 -0.025 1
1 1379 . 14 1 1 A 108 108 THR CA C 108 63.513 61.582 1.931 1
1 1380 . 14 1 1 A 108 108 THR CB C 108 69.194 69.978 -0.784 1
1 1382 . 14 1 1 A 108 108 THR N N 108 118.728 118.171 0.557 1
1 1383 . 14 1 1 A 109 109 LEU H H 109 8.378 8.397 -0.019 1
1 1384 . 14 1 1 A 109 109 LEU HA H 109 4.274 4.151 0.123 1
1 1394 . 14 1 1 A 109 109 LEU C C 109 177.058 176.664 0.394 1
1 1395 . 14 1 1 A 109 109 LEU CA C 109 55.045 55.316 -0.271 1
1 1396 . 14 1 1 A 109 109 LEU CB C 109 42.620 40.655 1.965 1
1 1400 . 14 1 1 A 109 109 LEU N N 109 124.847 124.496 0.351 1
1 9 . 15 1 1 A 2 2 MET HA H 2 4.554 4.915 -0.361 1
1 14 . 15 1 1 A 2 2 MET C C 2 174.749 173.781 0.968 1
1 15 . 15 1 1 A 2 2 MET CA C 2 55.354 54.801 0.553 1
1 16 . 15 1 1 A 2 2 MET CB C 2 33.729 36.933 -3.204 1
1 18 . 15 1 1 A 3 3 ARG H H 3 8.518 8.798 -0.280 1
1 19 . 15 1 1 A 3 3 ARG HA H 3 4.531 4.997 -0.466 1
1 26 . 15 1 1 A 3 3 ARG C C 3 175.780 174.917 0.863 1
1 27 . 15 1 1 A 3 3 ARG CA C 3 55.854 55.049 0.805 1
1 28 . 15 1 1 A 3 3 ARG CB C 3 31.403 32.019 -0.616 1
1 31 . 15 1 1 A 3 3 ARG N N 3 124.008 126.091 -2.083 1
1 32 . 15 1 1 A 4 4 LEU H H 4 8.424 9.264 -0.840 1
1 33 . 15 1 1 A 4 4 LEU HA H 4 4.457 5.038 -0.581 1
1 43 . 15 1 1 A 4 4 LEU C C 4 177.362 175.777 1.585 1
1 44 . 15 1 1 A 4 4 LEU CA C 4 54.511 53.260 1.251 1
1 45 . 15 1 1 A 4 4 LEU CB C 4 42.686 44.923 -2.237 1
1 49 . 15 1 1 A 4 4 LEU N N 4 124.389 127.439 -3.050 1
1 50 . 15 1 1 A 5 5 ALA H H 5 8.418 8.865 -0.447 1
1 51 . 15 1 1 A 5 5 ALA HA H 5 4.254 4.671 -0.417 1
1 55 . 15 1 1 A 5 5 ALA C C 5 177.420 176.000 1.420 1
1 56 . 15 1 1 A 5 5 ALA CA C 5 52.931 50.721 2.210 1
1 57 . 15 1 1 A 5 5 ALA CB C 5 19.263 19.468 -0.205 1
1 58 . 15 1 1 A 5 5 ALA N N 5 124.548 122.210 2.338 1
1 59 . 15 1 1 A 6 6 ASN H H 6 8.287 8.814 -0.527 1
1 60 . 15 1 1 A 6 6 ASN HA H 6 4.616 4.904 -0.288 1
1 65 . 15 1 1 A 6 6 ASN C C 6 175.837 174.056 1.781 1
1 66 . 15 1 1 A 6 6 ASN CA C 6 53.345 53.016 0.329 1
1 67 . 15 1 1 A 6 6 ASN CB C 6 38.571 36.801 1.770 1
1 69 . 15 1 1 A 6 6 ASN N N 6 116.484 122.035 -5.551 1
1 71 . 15 1 1 A 7 7 GLY H H 7 8.351 7.944 0.407 1
1 72 . 15 1 1 A 7 7 GLY HA2 H 7 4.130 4.399 -0.269 1
1 73 . 15 1 1 A 7 7 GLY HA3 H 7 3.808 4.400 -0.592 1
1 74 . 15 1 1 A 7 7 GLY C C 7 173.750 172.444 1.306 1
1 75 . 15 1 1 A 7 7 GLY CA C 7 45.343 44.911 0.432 1
1 76 . 15 1 1 A 7 7 GLY N N 7 108.453 109.262 -0.809 1
1 77 . 15 1 1 A 8 8 ILE H H 8 7.868 9.053 -1.185 1
1 78 . 15 1 1 A 8 8 ILE HA H 8 4.130 4.942 -0.812 1
1 88 . 15 1 1 A 8 8 ILE C C 8 175.570 175.009 0.561 1
1 89 . 15 1 1 A 8 8 ILE CA C 8 61.095 58.808 2.287 1
1 90 . 15 1 1 A 8 8 ILE CB C 8 38.694 40.674 -1.980 1
1 94 . 15 1 1 A 8 8 ILE N N 8 120.848 118.992 1.856 1
1 95 . 15 1 1 A 9 9 VAL H H 9 8.220 8.392 -0.172 1
1 96 . 15 1 1 A 9 9 VAL HA H 9 4.172 4.337 -0.165 1
1 104 . 15 1 1 A 9 9 VAL C C 9 175.898 176.295 -0.397 1
1 105 . 15 1 1 A 9 9 VAL CA C 9 62.488 61.820 0.668 1
1 106 . 15 1 1 A 9 9 VAL CB C 9 32.460 32.008 0.452 1
1 109 . 15 1 1 A 9 9 VAL N N 9 125.805 122.178 3.627 1
1 110 . 15 1 1 A 10 10 LEU H H 10 8.437 8.436 0.001 1
1 111 . 15 1 1 A 10 10 LEU HA H 10 4.347 4.115 0.232 1
1 121 . 15 1 1 A 10 10 LEU C C 10 176.398 177.120 -0.722 1
1 122 . 15 1 1 A 10 10 LEU CA C 10 54.787 57.539 -2.752 1
1 123 . 15 1 1 A 10 10 LEU CB C 10 42.639 41.590 1.049 1
1 127 . 15 1 1 A 10 10 LEU N N 10 127.757 126.457 1.300 1
1 128 . 15 1 1 A 11 11 ASP H H 11 8.506 8.191 0.315 1
1 129 . 15 1 1 A 11 11 ASP HA H 11 4.683 4.832 -0.149 1
1 132 . 15 1 1 A 11 11 ASP C C 11 176.672 176.374 0.298 1
1 133 . 15 1 1 A 11 11 ASP CA C 11 53.586 53.734 -0.148 1
1 134 . 15 1 1 A 11 11 ASP CB C 11 41.123 41.709 -0.586 1
1 135 . 15 1 1 A 11 11 ASP N N 11 121.539 119.215 2.324 1
1 136 . 15 1 1 A 12 12 LYS H H 12 8.578 8.463 0.115 1
1 137 . 15 1 1 A 12 12 LYS HA H 12 3.943 4.302 -0.359 1
1 146 . 15 1 1 A 12 12 LYS C C 12 176.917 176.498 0.419 1
1 147 . 15 1 1 A 12 12 LYS CA C 12 58.542 56.889 1.653 1
1 148 . 15 1 1 A 12 12 LYS CB C 12 32.703 32.690 0.013 1
1 152 . 15 1 1 A 12 12 LYS N N 12 123.635 121.341 2.294 1
1 153 . 15 1 1 A 13 13 ASP H H 13 8.523 8.764 -0.241 1
1 154 . 15 1 1 A 13 13 ASP HA H 13 4.566 4.665 -0.099 1
1 157 . 15 1 1 A 13 13 ASP C C 13 177.535 176.203 1.332 1
1 158 . 15 1 1 A 13 13 ASP CA C 13 56.034 54.482 1.552 1
1 159 . 15 1 1 A 13 13 ASP CB C 13 41.051 40.292 0.759 1
1 160 . 15 1 1 A 13 13 ASP N N 13 120.448 123.193 -2.745 1
1 161 . 15 1 1 A 14 14 THR H H 14 7.964 8.127 -0.163 1
1 162 . 15 1 1 A 14 14 THR HA H 14 4.146 4.264 -0.118 1
1 167 . 15 1 1 A 14 14 THR C C 14 175.440 174.029 1.411 1
1 168 . 15 1 1 A 14 14 THR CA C 14 63.245 62.200 1.045 1
1 169 . 15 1 1 A 14 14 THR CB C 14 69.092 69.025 0.067 1
1 171 . 15 1 1 A 14 14 THR N N 14 113.711 117.770 -4.059 1
1 172 . 15 1 1 A 15 15 THR H H 15 7.921 8.426 -0.505 1
1 173 . 15 1 1 A 15 15 THR HA H 15 3.920 4.736 -0.816 1
1 178 . 15 1 1 A 15 15 THR C C 15 174.750 173.893 0.857 1
1 179 . 15 1 1 A 15 15 THR CA C 15 64.562 61.087 3.475 1
1 180 . 15 1 1 A 15 15 THR CB C 15 69.166 69.822 -0.656 1
1 182 . 15 1 1 A 15 15 THR N N 15 116.710 118.531 -1.821 1
1 183 . 15 1 1 A 16 16 PHE H H 16 8.191 8.853 -0.662 1
1 184 . 15 1 1 A 16 16 PHE HA H 16 4.628 5.025 -0.397 1
1 192 . 15 1 1 A 16 16 PHE C C 16 177.754 175.571 2.183 1
1 193 . 15 1 1 A 16 16 PHE CA C 16 57.975 55.785 2.190 1
1 194 . 15 1 1 A 16 16 PHE CB C 16 39.553 43.673 -4.120 1
1 200 . 15 1 1 A 16 16 PHE N N 16 117.124 120.658 -3.534 1
1 201 . 15 1 1 A 17 17 GLY H H 17 8.110 8.593 -0.483 1
1 202 . 15 1 1 A 17 17 GLY HA2 H 17 4.017 4.145 -0.128 1
1 203 . 15 1 1 A 17 17 GLY HA3 H 17 3.849 4.146 -0.297 1
1 204 . 15 1 1 A 17 17 GLY C C 17 172.231 173.667 -1.436 1
1 205 . 15 1 1 A 17 17 GLY CA C 17 45.633 44.937 0.696 1
1 206 . 15 1 1 A 17 17 GLY N N 17 109.951 110.318 -0.367 1
1 207 . 15 1 1 A 18 18 GLU H H 18 8.304 8.116 0.188 1
1 208 . 15 1 1 A 18 18 GLU HA H 18 4.078 5.006 -0.928 1
1 213 . 15 1 1 A 18 18 GLU C C 18 175.588 175.265 0.323 1
1 214 . 15 1 1 A 18 18 GLU CA C 18 57.446 55.512 1.934 1
1 215 . 15 1 1 A 18 18 GLU CB C 18 30.767 31.070 -0.303 1
1 217 . 15 1 1 A 18 18 GLU N N 18 121.640 120.557 1.083 1
1 218 . 15 1 1 A 19 19 LEU H H 19 8.799 8.980 -0.181 1
1 219 . 15 1 1 A 19 19 LEU HA H 19 5.416 4.819 0.597 1
1 229 . 15 1 1 A 19 19 LEU C C 19 176.875 176.071 0.804 1
1 230 . 15 1 1 A 19 19 LEU CA C 19 53.281 53.569 -0.288 1
1 231 . 15 1 1 A 19 19 LEU CB C 19 45.508 42.044 3.464 1
1 235 . 15 1 1 A 19 19 LEU N N 19 127.101 127.159 -0.058 1
1 236 . 15 1 1 A 20 20 LYS H H 20 8.494 8.320 0.174 1
1 237 . 15 1 1 A 20 20 LYS HA H 20 5.200 4.971 0.229 1
1 246 . 15 1 1 A 20 20 LYS C C 20 176.163 175.813 0.350 1
1 247 . 15 1 1 A 20 20 LYS CA C 20 53.575 55.028 -1.453 1
1 248 . 15 1 1 A 20 20 LYS CB C 20 36.835 34.056 2.779 1
1 252 . 15 1 1 A 20 20 LYS N N 20 118.828 125.228 -6.400 1
1 253 . 15 1 1 A 21 21 PHE H H 21 9.658 9.229 0.429 1
1 254 . 15 1 1 A 21 21 PHE HA H 21 4.038 4.569 -0.531 1
1 262 . 15 1 1 A 21 21 PHE C C 21 174.296 175.339 -1.043 1
1 263 . 15 1 1 A 21 21 PHE CA C 21 60.462 59.112 1.350 1
1 264 . 15 1 1 A 21 21 PHE CB C 21 40.359 39.776 0.583 1
1 270 . 15 1 1 A 21 21 PHE N N 21 124.322 126.843 -2.521 1
1 271 . 15 1 1 A 22 22 SER H H 22 7.199 8.037 -0.838 1
1 272 . 15 1 1 A 22 22 SER HA H 22 5.046 4.580 0.466 1
1 275 . 15 1 1 A 22 22 SER C C 22 173.080 174.486 -1.406 1
1 276 . 15 1 1 A 22 22 SER CA C 22 58.547 58.356 0.191 1
1 277 . 15 1 1 A 22 22 SER CB C 22 63.591 64.159 -0.568 1
1 278 . 15 1 1 A 22 22 SER N N 22 120.109 119.079 1.030 1
1 279 . 15 1 1 A 23 23 ALA H H 23 7.269 7.186 0.083 1
1 280 . 15 1 1 A 23 23 ALA HA H 23 4.426 4.550 -0.124 1
1 284 . 15 1 1 A 23 23 ALA C C 23 176.568 175.298 1.270 1
1 285 . 15 1 1 A 23 23 ALA CA C 23 52.458 51.215 1.243 1
1 286 . 15 1 1 A 23 23 ALA CB C 23 22.728 22.756 -0.028 1
1 287 . 15 1 1 A 23 23 ALA N N 23 114.102 119.631 -5.529 1
1 288 . 15 1 1 A 24 24 LEU H H 24 8.819 8.812 0.007 1
1 289 . 15 1 1 A 24 24 LEU HA H 24 4.060 4.416 -0.356 1
1 299 . 15 1 1 A 24 24 LEU C C 24 175.363 176.732 -1.369 1
1 300 . 15 1 1 A 24 24 LEU CA C 24 56.901 55.191 1.710 1
1 301 . 15 1 1 A 24 24 LEU CB C 24 42.065 42.537 -0.472 1
1 305 . 15 1 1 A 24 24 LEU N N 24 120.865 122.266 -1.401 1
1 306 . 15 1 1 A 25 25 ARG H H 25 9.473 8.770 0.703 1
1 307 . 15 1 1 A 25 25 ARG HA H 25 4.428 4.160 0.268 1
1 315 . 15 1 1 A 25 25 ARG C C 25 175.729 175.608 0.121 1
1 316 . 15 1 1 A 25 25 ARG CA C 25 56.721 58.098 -1.377 1
1 317 . 15 1 1 A 25 25 ARG CB C 25 31.109 31.216 -0.107 1
1 320 . 15 1 1 A 25 25 ARG N N 25 130.455 128.869 1.586 1
1 322 . 15 1 1 A 26 26 ARG H H 26 7.711 7.317 0.394 1
1 323 . 15 1 1 A 26 26 ARG HA H 26 4.559 4.663 -0.104 1
1 330 . 15 1 1 A 26 26 ARG C C 26 173.724 173.645 0.079 1
1 331 . 15 1 1 A 26 26 ARG CA C 26 55.737 55.903 -0.166 1
1 332 . 15 1 1 A 26 26 ARG CB C 26 33.261 33.807 -0.546 1
1 335 . 15 1 1 A 26 26 ARG N N 26 113.305 118.355 -5.050 1
1 336 . 15 1 1 A 27 27 GLU H H 27 8.848 8.536 0.312 1
1 337 . 15 1 1 A 27 27 GLU HA H 27 4.615 4.650 -0.035 1
1 342 . 15 1 1 A 27 27 GLU C C 27 174.836 175.553 -0.717 1
1 343 . 15 1 1 A 27 27 GLU CA C 27 55.901 55.356 0.545 1
1 344 . 15 1 1 A 27 27 GLU CB C 27 30.755 30.073 0.682 1
1 346 . 15 1 1 A 27 27 GLU N N 27 121.934 125.067 -3.133 1
1 347 . 15 1 1 A 28 28 VAL H H 28 8.603 8.021 0.582 1
1 348 . 15 1 1 A 28 28 VAL HA H 28 4.013 4.129 -0.116 1
1 356 . 15 1 1 A 28 28 VAL C C 28 175.561 175.642 -0.081 1
1 357 . 15 1 1 A 28 28 VAL CA C 28 62.791 61.663 1.128 1
1 358 . 15 1 1 A 28 28 VAL CB C 28 32.710 30.962 1.748 1
1 361 . 15 1 1 A 28 28 VAL N N 28 125.545 123.597 1.948 1
1 362 . 15 1 1 A 29 29 ARG H H 29 8.735 8.251 0.484 1
1 363 . 15 1 1 A 29 29 ARG HA H 29 4.774 4.455 0.319 1
1 370 . 15 1 1 A 29 29 ARG C C 29 176.580 176.441 0.139 1
1 371 . 15 1 1 A 29 29 ARG CA C 29 55.481 56.118 -0.637 1
1 372 . 15 1 1 A 29 29 ARG CB C 29 31.963 30.943 1.020 1
1 375 . 15 1 1 A 29 29 ARG N N 29 128.327 127.783 0.544 1
1 376 . 15 1 1 A 30 30 ILE H H 30 8.358 8.535 -0.177 1
1 377 . 15 1 1 A 30 30 ILE HA H 30 3.882 4.034 -0.152 1
1 387 . 15 1 1 A 30 30 ILE C C 30 175.093 175.151 -0.058 1
1 388 . 15 1 1 A 30 30 ILE CA C 30 61.669 61.581 0.088 1
1 389 . 15 1 1 A 30 30 ILE CB C 30 38.806 37.169 1.637 1
1 393 . 15 1 1 A 30 30 ILE N N 30 121.957 121.985 -0.028 1
1 394 . 15 1 1 A 31 31 GLN H H 31 8.560 8.786 -0.226 1
1 395 . 15 1 1 A 31 31 GLN HA H 31 4.647 4.826 -0.179 1
1 402 . 15 1 1 A 31 31 GLN C C 31 175.954 175.782 0.172 1
1 403 . 15 1 1 A 31 31 GLN CA C 31 54.833 55.455 -0.622 1
1 404 . 15 1 1 A 31 31 GLN CB C 31 30.584 29.684 0.900 1
1 407 . 15 1 1 A 31 31 GLN N N 31 126.348 128.352 -2.004 1
1 409 . 15 1 1 A 32 32 ASN H H 32 8.994 9.025 -0.031 1
1 410 . 15 1 1 A 32 32 ASN HA H 32 4.784 4.760 0.024 1
1 415 . 15 1 1 A 32 32 ASN C C 32 177.296 176.723 0.573 1
1 416 . 15 1 1 A 32 32 ASN CA C 32 53.206 53.527 -0.321 1
1 417 . 15 1 1 A 32 32 ASN CB C 32 39.472 39.634 -0.162 1
1 419 . 15 1 1 A 32 32 ASN N N 32 122.834 126.032 -3.198 1
1 421 . 15 1 1 A 33 33 GLU H H 33 9.180 9.046 0.134 1
1 422 . 15 1 1 A 33 33 GLU HA H 33 4.063 4.085 -0.022 1
1 427 . 15 1 1 A 33 33 GLU C C 33 176.787 177.876 -1.089 1
1 428 . 15 1 1 A 33 33 GLU CA C 33 59.347 59.100 0.247 1
1 429 . 15 1 1 A 33 33 GLU CB C 33 29.294 29.073 0.221 1
1 431 . 15 1 1 A 33 33 GLU N N 33 122.736 121.382 1.354 1
1 432 . 15 1 1 A 34 34 ASP H H 34 7.969 8.066 -0.097 1
1 433 . 15 1 1 A 34 34 ASP HA H 34 4.499 4.567 -0.068 1
1 436 . 15 1 1 A 34 34 ASP C C 34 177.111 176.579 0.532 1
1 437 . 15 1 1 A 34 34 ASP CA C 34 53.632 54.196 -0.564 1
1 438 . 15 1 1 A 34 34 ASP CB C 34 39.807 40.968 -1.161 1
1 439 . 15 1 1 A 34 34 ASP N N 34 115.921 118.111 -2.190 1
1 440 . 15 1 1 A 35 35 GLY H H 35 8.083 8.313 -0.230 1
1 441 . 15 1 1 A 35 35 GLY HA2 H 35 4.366 3.946 0.420 1
1 442 . 15 1 1 A 35 35 GLY HA3 H 35 3.657 3.946 -0.289 1
1 443 . 15 1 1 A 35 35 GLY C C 35 174.584 174.506 0.078 1
1 444 . 15 1 1 A 35 35 GLY CA C 35 45.134 45.028 0.106 1
1 445 . 15 1 1 A 35 35 GLY N N 35 108.874 108.421 0.453 1
1 446 . 15 1 1 A 36 36 SER H H 36 8.274 7.961 0.313 1
1 447 . 15 1 1 A 36 36 SER HA H 36 4.389 4.558 -0.169 1
1 450 . 15 1 1 A 36 36 SER C C 36 173.284 173.643 -0.359 1
1 451 . 15 1 1 A 36 36 SER CA C 36 58.383 58.389 -0.006 1
1 452 . 15 1 1 A 36 36 SER CB C 36 64.576 64.903 -0.327 1
1 453 . 15 1 1 A 36 36 SER N N 36 117.428 116.394 1.034 1
1 454 . 15 1 1 A 37 37 VAL H H 37 8.508 8.580 -0.072 1
1 455 . 15 1 1 A 37 37 VAL HA H 37 4.346 4.570 -0.224 1
1 463 . 15 1 1 A 37 37 VAL C C 37 176.370 175.347 1.023 1
1 464 . 15 1 1 A 37 37 VAL CA C 37 62.410 61.396 1.014 1
1 465 . 15 1 1 A 37 37 VAL CB C 37 33.086 32.627 0.459 1
1 468 . 15 1 1 A 37 37 VAL N N 37 119.189 122.743 -3.554 1
1 469 . 15 1 1 A 38 38 SER H H 38 8.461 8.991 -0.530 1
1 470 . 15 1 1 A 38 38 SER HA H 38 4.586 4.685 -0.099 1
1 473 . 15 1 1 A 38 38 SER C C 38 173.829 175.074 -1.245 1
1 474 . 15 1 1 A 38 38 SER CA C 38 57.618 57.604 0.014 1
1 475 . 15 1 1 A 38 38 SER CB C 38 64.537 64.542 -0.005 1
1 476 . 15 1 1 A 38 38 SER N N 38 121.629 121.614 0.015 1
1 477 . 15 1 1 A 39 39 ASP H H 39 8.512 8.753 -0.241 1
1 478 . 15 1 1 A 39 39 ASP HA H 39 4.606 4.350 0.256 1
1 481 . 15 1 1 A 39 39 ASP C C 39 176.557 177.225 -0.668 1
1 482 . 15 1 1 A 39 39 ASP CA C 39 54.833 57.205 -2.372 1
1 483 . 15 1 1 A 39 39 ASP CB C 39 41.123 40.679 0.444 1
1 484 . 15 1 1 A 39 39 ASP N N 39 120.305 124.171 -3.866 1
1 485 . 15 1 1 A 40 40 GLU H H 40 8.311 7.665 0.646 1
1 486 . 15 1 1 A 40 40 GLU HA H 40 4.235 4.420 -0.185 1
1 491 . 15 1 1 A 40 40 GLU C C 40 175.327 176.007 -0.680 1
1 492 . 15 1 1 A 40 40 GLU CA C 40 56.215 57.417 -1.202 1
1 493 . 15 1 1 A 40 40 GLU CB C 40 30.788 30.347 0.441 1
1 495 . 15 1 1 A 40 40 GLU N N 40 120.680 117.148 3.532 1
1 496 . 15 1 1 A 41 41 ILE H H 41 8.465 8.760 -0.295 1
1 497 . 15 1 1 A 41 41 ILE HA H 41 4.127 4.577 -0.450 1
1 507 . 15 1 1 A 41 41 ILE C C 41 175.380 175.871 -0.491 1
1 508 . 15 1 1 A 41 41 ILE CA C 41 60.670 59.733 0.937 1
1 509 . 15 1 1 A 41 41 ILE CB C 41 38.805 40.400 -1.595 1
1 513 . 15 1 1 A 41 41 ILE N N 41 123.665 123.510 0.155 1
1 514 . 15 1 1 A 42 42 LYS H H 42 9.556 9.025 0.531 1
1 515 . 15 1 1 A 42 42 LYS HA H 42 4.428 4.277 0.151 1
1 524 . 15 1 1 A 42 42 LYS C C 42 177.277 176.668 0.609 1
1 525 . 15 1 1 A 42 42 LYS CA C 42 57.274 58.068 -0.794 1
1 526 . 15 1 1 A 42 42 LYS CB C 42 35.169 32.988 2.181 1
1 530 . 15 1 1 A 42 42 LYS N N 42 125.597 125.707 -0.110 1
1 531 . 15 1 1 A 43 43 GLU H H 43 7.809 7.656 0.153 1
1 532 . 15 1 1 A 43 43 GLU HA H 43 4.886 4.664 0.222 1
1 537 . 15 1 1 A 43 43 GLU C C 43 173.593 173.778 -0.185 1
1 538 . 15 1 1 A 43 43 GLU CA C 43 54.669 55.346 -0.677 1
1 539 . 15 1 1 A 43 43 GLU CB C 43 32.882 31.816 1.066 1
1 541 . 15 1 1 A 43 43 GLU N N 43 115.292 113.369 1.923 1
1 542 . 15 1 1 A 44 44 ARG H H 44 8.879 8.802 0.077 1
1 543 . 15 1 1 A 44 44 ARG HA H 44 4.917 4.845 0.072 1
1 551 . 15 1 1 A 44 44 ARG C C 44 173.708 174.954 -1.246 1
1 552 . 15 1 1 A 44 44 ARG CA C 44 55.965 54.733 1.232 1
1 553 . 15 1 1 A 44 44 ARG CB C 44 33.579 31.941 1.638 1
1 556 . 15 1 1 A 44 44 ARG N N 44 118.233 119.924 -1.691 1
1 558 . 15 1 1 A 45 45 THR H H 45 8.892 8.977 -0.085 1
1 559 . 15 1 1 A 45 45 THR HA H 45 5.308 4.955 0.353 1
1 564 . 15 1 1 A 45 45 THR C C 45 173.357 172.978 0.379 1
1 565 . 15 1 1 A 45 45 THR CA C 45 60.939 61.759 -0.820 1
1 566 . 15 1 1 A 45 45 THR CB C 45 70.054 70.147 -0.093 1
1 568 . 15 1 1 A 45 45 THR N N 45 118.457 119.919 -1.462 1
1 569 . 15 1 1 A 46 46 TYR H H 46 9.625 9.479 0.146 1
1 570 . 15 1 1 A 46 46 TYR HA H 46 4.771 5.002 -0.231 1
1 578 . 15 1 1 A 46 46 TYR C C 46 173.735 175.043 -1.308 1
1 579 . 15 1 1 A 46 46 TYR CA C 46 57.480 55.949 1.531 1
1 580 . 15 1 1 A 46 46 TYR CB C 46 41.724 42.407 -0.683 1
1 585 . 15 1 1 A 46 46 TYR N N 46 125.916 126.111 -0.195 1
1 586 . 15 1 1 A 47 47 ASP H H 47 9.006 8.760 0.246 1
1 587 . 15 1 1 A 47 47 ASP HA H 47 5.399 4.856 0.543 1
1 590 . 15 1 1 A 47 47 ASP C C 47 175.094 175.044 0.050 1
1 591 . 15 1 1 A 47 47 ASP CA C 47 53.460 54.033 -0.573 1
1 592 . 15 1 1 A 47 47 ASP CB C 47 41.947 41.573 0.374 1
1 593 . 15 1 1 A 47 47 ASP N N 47 122.109 122.906 -0.797 1
1 594 . 15 1 1 A 48 48 LEU H H 48 9.066 8.692 0.374 1
1 595 . 15 1 1 A 48 48 LEU HA H 48 4.831 4.891 -0.060 1
1 605 . 15 1 1 A 48 48 LEU C C 48 174.977 175.443 -0.466 1
1 606 . 15 1 1 A 48 48 LEU CA C 48 52.724 53.489 -0.765 1
1 607 . 15 1 1 A 48 48 LEU CB C 48 44.844 43.290 1.554 1
1 611 . 15 1 1 A 48 48 LEU N N 48 121.879 125.981 -4.102 1
1 612 . 15 1 1 A 49 49 LYS H H 49 9.401 8.575 0.826 1
1 613 . 15 1 1 A 49 49 LYS HA H 49 4.477 4.882 -0.405 1
1 622 . 15 1 1 A 49 49 LYS C C 49 176.225 175.680 0.545 1
1 623 . 15 1 1 A 49 49 LYS CA C 49 56.017 54.961 1.056 1
1 624 . 15 1 1 A 49 49 LYS CB C 49 33.838 34.350 -0.512 1
1 628 . 15 1 1 A 49 49 LYS N N 49 122.218 125.082 -2.864 1
1 629 . 15 1 1 A 50 50 SER H H 50 8.266 8.619 -0.353 1
1 630 . 15 1 1 A 50 50 SER HA H 50 5.222 4.969 0.253 1
1 633 . 15 1 1 A 50 50 SER C C 50 175.570 174.265 1.305 1
1 634 . 15 1 1 A 50 50 SER CA C 50 55.770 58.160 -2.390 1
1 635 . 15 1 1 A 50 50 SER CB C 50 64.738 63.901 0.837 1
1 636 . 15 1 1 A 50 50 SER N N 50 117.388 119.690 -2.302 1
1 637 . 15 1 1 A 51 51 LYS H H 51 9.276 8.675 0.601 1
1 638 . 15 1 1 A 51 51 LYS HA H 51 4.208 4.149 0.059 1
1 647 . 15 1 1 A 51 51 LYS C C 51 178.773 176.853 1.920 1
1 648 . 15 1 1 A 51 51 LYS CA C 51 58.674 56.364 2.310 1
1 649 . 15 1 1 A 51 51 LYS CB C 51 33.383 33.050 0.333 1
1 653 . 15 1 1 A 51 51 LYS N N 51 130.550 126.081 4.469 1
1 654 . 15 1 1 A 52 52 GLY H H 52 8.320 9.035 -0.715 1
1 655 . 15 1 1 A 52 52 GLY HA2 H 52 3.875 3.989 -0.114 1
1 656 . 15 1 1 A 52 52 GLY HA3 H 52 3.628 3.993 -0.365 1
1 657 . 15 1 1 A 52 52 GLY C C 52 175.108 174.725 0.383 1
1 658 . 15 1 1 A 52 52 GLY CA C 52 46.322 45.442 0.880 1
1 659 . 15 1 1 A 52 52 GLY N N 52 107.053 110.714 -3.661 1
1 660 . 15 1 1 A 53 53 GLN H H 53 7.859 8.107 -0.248 1
1 661 . 15 1 1 A 53 53 GLN HA H 53 4.409 4.410 -0.001 1
1 668 . 15 1 1 A 53 53 GLN C C 53 176.469 176.063 0.406 1
1 669 . 15 1 1 A 53 53 GLN CA C 53 54.911 57.291 -2.380 1
1 670 . 15 1 1 A 53 53 GLN CB C 53 29.675 29.562 0.113 1
1 673 . 15 1 1 A 53 53 GLN N N 53 115.482 120.526 -5.044 1
1 675 . 15 1 1 A 54 54 GLY H H 54 7.992 8.123 -0.131 1
1 676 . 15 1 1 A 54 54 GLY HA2 H 54 3.934 3.925 0.009 1
1 677 . 15 1 1 A 54 54 GLY HA3 H 54 3.934 3.928 0.006 1
1 678 . 15 1 1 A 54 54 GLY C C 54 173.897 173.987 -0.090 1
1 679 . 15 1 1 A 54 54 GLY CA C 54 46.574 46.553 0.021 1
1 680 . 15 1 1 A 54 54 GLY N N 54 110.111 108.787 1.324 1
1 681 . 15 1 1 A 55 55 ARG H H 55 7.652 7.749 -0.097 1
1 682 . 15 1 1 A 55 55 ARG HA H 55 4.665 5.010 -0.345 1
1 690 . 15 1 1 A 55 55 ARG C C 55 174.649 174.850 -0.201 1
1 691 . 15 1 1 A 55 55 ARG CA C 55 54.631 54.423 0.208 1
1 692 . 15 1 1 A 55 55 ARG CB C 55 32.166 33.628 -1.462 1
1 695 . 15 1 1 A 55 55 ARG N N 55 114.214 116.329 -2.115 1
1 697 . 15 1 1 A 56 56 MET H H 56 8.593 8.901 -0.308 1
1 698 . 15 1 1 A 56 56 MET HA H 56 5.012 5.352 -0.340 1
1 703 . 15 1 1 A 56 56 MET C C 56 176.216 175.610 0.606 1
1 704 . 15 1 1 A 56 56 MET CA C 56 54.595 53.824 0.771 1
1 705 . 15 1 1 A 56 56 MET CB C 56 33.466 34.743 -1.277 1
1 707 . 15 1 1 A 56 56 MET N N 56 121.270 121.123 0.147 1
1 708 . 15 1 1 A 57 57 ILE H H 57 9.393 8.517 0.876 1
1 709 . 15 1 1 A 57 57 ILE HA H 57 4.717 4.596 0.121 1
1 719 . 15 1 1 A 57 57 ILE C C 57 173.883 174.551 -0.668 1
1 720 . 15 1 1 A 57 57 ILE CA C 57 59.713 59.525 0.188 1
1 721 . 15 1 1 A 57 57 ILE CB C 57 40.933 39.077 1.856 1
1 725 . 15 1 1 A 57 57 ILE N N 57 120.811 121.226 -0.415 1
1 726 . 15 1 1 A 58 58 GLN H H 58 8.218 7.744 0.474 1
1 727 . 15 1 1 A 58 58 GLN HA H 58 5.407 4.529 0.878 1
1 734 . 15 1 1 A 58 58 GLN C C 58 175.368 174.509 0.859 1
1 735 . 15 1 1 A 58 58 GLN CA C 58 55.163 54.980 0.183 1
1 736 . 15 1 1 A 58 58 GLN CB C 58 30.841 28.611 2.230 1
1 739 . 15 1 1 A 58 58 GLN N N 58 122.281 122.116 0.165 1
1 741 . 15 1 1 A 59 59 VAL H H 59 9.188 8.571 0.617 1
1 742 . 15 1 1 A 59 59 VAL HA H 59 5.025 5.050 -0.025 1
1 750 . 15 1 1 A 59 59 VAL C C 59 175.330 174.762 0.568 1
1 751 . 15 1 1 A 59 59 VAL CA C 59 59.975 61.320 -1.345 1
1 752 . 15 1 1 A 59 59 VAL CB C 59 34.818 33.340 1.478 1
1 755 . 15 1 1 A 59 59 VAL N N 59 122.421 126.226 -3.805 1
1 756 . 15 1 1 A 60 60 SER H H 60 9.022 9.202 -0.180 1
1 757 . 15 1 1 A 60 60 SER HA H 60 5.811 5.778 0.033 1
1 760 . 15 1 1 A 60 60 SER C C 60 173.234 173.095 0.139 1
1 761 . 15 1 1 A 60 60 SER CA C 60 57.634 56.794 0.840 1
1 762 . 15 1 1 A 60 60 SER CB C 60 64.891 65.129 -0.238 1
1 763 . 15 1 1 A 60 60 SER N N 60 124.709 122.377 2.332 1
1 764 . 15 1 1 A 61 61 ILE H H 61 9.226 8.898 0.328 1
1 765 . 15 1 1 A 61 61 ILE HA H 61 5.572 4.991 0.581 1
1 775 . 15 1 1 A 61 61 ILE C C 61 173.955 173.960 -0.005 1
1 776 . 15 1 1 A 61 61 ILE CA C 61 56.937 57.146 -0.209 1
1 777 . 15 1 1 A 61 61 ILE CB C 61 39.596 40.059 -0.463 1
1 781 . 15 1 1 A 61 61 ILE N N 61 121.648 121.368 0.280 1
1 782 . 15 1 1 A 62 62 PRO HA H 62 4.606 4.541 0.065 1
1 789 . 15 1 1 A 62 62 PRO C C 62 178.143 177.442 0.701 1
1 790 . 15 1 1 A 62 62 PRO CA C 62 63.740 62.902 0.838 1
1 791 . 15 1 1 A 62 62 PRO CB C 62 33.303 32.743 0.560 1
1 794 . 15 1 1 A 63 63 ALA H H 63 7.803 8.364 -0.561 1
1 795 . 15 1 1 A 63 63 ALA HA H 63 4.037 4.038 -0.001 1
1 799 . 15 1 1 A 63 63 ALA C C 63 175.942 178.999 -3.057 1
1 800 . 15 1 1 A 63 63 ALA CA C 63 54.417 54.645 -0.228 1
1 801 . 15 1 1 A 63 63 ALA CB C 63 19.345 18.222 1.123 1
1 802 . 15 1 1 A 63 63 ALA N N 63 123.695 126.965 -3.270 1
1 803 . 15 1 1 A 64 64 SER H H 64 7.719 7.879 -0.160 1
1 804 . 15 1 1 A 64 64 SER HA H 64 4.097 4.477 -0.380 1
1 807 . 15 1 1 A 64 64 SER C C 64 175.199 174.089 1.110 1
1 808 . 15 1 1 A 64 64 SER CA C 64 59.474 59.877 -0.403 1
1 809 . 15 1 1 A 64 64 SER CB C 64 62.125 63.607 -1.482 1
1 810 . 15 1 1 A 64 64 SER N N 64 110.001 111.413 -1.412 1
1 811 . 15 1 1 A 65 65 VAL H H 65 7.790 7.834 -0.044 1
1 812 . 15 1 1 A 65 65 VAL HA H 65 4.360 4.331 0.029 1
1 820 . 15 1 1 A 65 65 VAL C C 65 174.433 174.004 0.429 1
1 821 . 15 1 1 A 65 65 VAL CA C 65 60.335 58.744 1.591 1
1 822 . 15 1 1 A 65 65 VAL CB C 65 32.714 32.934 -0.220 1
1 825 . 15 1 1 A 65 65 VAL N N 65 126.142 122.068 4.074 1
1 826 . 15 1 1 A 66 66 PRO HA H 66 4.369 4.445 -0.076 1
1 833 . 15 1 1 A 66 66 PRO C C 66 177.412 176.539 0.873 1
1 834 . 15 1 1 A 66 66 PRO CA C 66 63.104 62.938 0.166 1
1 835 . 15 1 1 A 66 66 PRO CB C 66 32.558 31.958 0.600 1
1 838 . 15 1 1 A 67 67 LEU H H 67 8.578 8.299 0.279 1
1 839 . 15 1 1 A 67 67 LEU HA H 67 3.875 4.473 -0.598 1
1 849 . 15 1 1 A 67 67 LEU C C 67 176.077 176.547 -0.470 1
1 850 . 15 1 1 A 67 67 LEU CA C 67 56.413 55.354 1.059 1
1 851 . 15 1 1 A 67 67 LEU CB C 67 43.279 42.790 0.489 1
1 855 . 15 1 1 A 67 67 LEU N N 67 124.236 123.101 1.135 1
1 856 . 15 1 1 A 68 68 LYS H H 68 7.994 8.248 -0.254 1
1 857 . 15 1 1 A 68 68 LYS HA H 68 3.793 4.059 -0.266 1
1 866 . 15 1 1 A 68 68 LYS C C 68 175.601 175.789 -0.188 1
1 867 . 15 1 1 A 68 68 LYS CA C 68 53.350 55.429 -2.079 1
1 868 . 15 1 1 A 68 68 LYS CB C 68 31.035 32.884 -1.849 1
1 872 . 15 1 1 A 68 68 LYS N N 68 124.053 126.155 -2.102 1
1 873 . 15 1 1 A 69 69 GLU H H 69 8.347 8.126 0.221 1
1 874 . 15 1 1 A 69 69 GLU HA H 69 4.501 4.527 -0.026 1
1 879 . 15 1 1 A 69 69 GLU C C 69 175.304 175.931 -0.627 1
1 880 . 15 1 1 A 69 69 GLU CA C 69 54.291 55.631 -1.340 1
1 881 . 15 1 1 A 69 69 GLU CB C 69 29.285 29.703 -0.418 1
1 883 . 15 1 1 A 69 69 GLU N N 69 123.876 122.904 0.972 1
1 884 . 15 1 1 A 70 70 PHE H H 70 5.549 6.940 -1.391 1
1 885 . 15 1 1 A 70 70 PHE HA H 70 4.592 4.358 0.234 1
1 893 . 15 1 1 A 70 70 PHE C C 70 174.443 175.577 -1.134 1
1 894 . 15 1 1 A 70 70 PHE CA C 70 53.313 58.223 -4.910 1
1 895 . 15 1 1 A 70 70 PHE CB C 70 38.335 38.707 -0.372 1
1 901 . 15 1 1 A 70 70 PHE N N 70 117.781 120.451 -2.670 1
1 902 . 15 1 1 A 71 71 ASP H H 71 8.791 8.629 0.162 1
1 903 . 15 1 1 A 71 71 ASP HA H 71 4.535 4.768 -0.233 1
1 906 . 15 1 1 A 71 71 ASP C C 71 175.867 175.571 0.296 1
1 907 . 15 1 1 A 71 71 ASP CA C 71 54.248 53.640 0.608 1
1 908 . 15 1 1 A 71 71 ASP CB C 71 41.166 41.855 -0.689 1
1 909 . 15 1 1 A 71 71 ASP N N 71 120.385 121.704 -1.319 1
1 910 . 15 1 1 A 72 72 TYR H H 72 8.701 8.692 0.009 1
1 911 . 15 1 1 A 72 72 TYR HA H 72 4.283 4.485 -0.202 1
1 918 . 15 1 1 A 72 72 TYR C C 72 177.470 176.250 1.220 1
1 919 . 15 1 1 A 72 72 TYR CA C 72 60.513 59.339 1.174 1
1 920 . 15 1 1 A 72 72 TYR CB C 72 38.320 38.405 -0.085 1
1 925 . 15 1 1 A 72 72 TYR N N 72 121.876 124.527 -2.651 1
1 926 . 15 1 1 A 73 73 ASN H H 73 8.819 8.983 -0.164 1
1 927 . 15 1 1 A 73 73 ASN HA H 73 4.096 4.135 -0.039 1
1 932 . 15 1 1 A 73 73 ASN C C 73 174.362 174.390 -0.028 1
1 933 . 15 1 1 A 73 73 ASN CA C 73 54.289 54.076 0.213 1
1 934 . 15 1 1 A 73 73 ASN CB C 73 36.907 36.433 0.474 1
1 936 . 15 1 1 A 73 73 ASN N N 73 121.726 119.833 1.893 1
1 938 . 15 1 1 A 74 74 ALA H H 74 8.059 7.590 0.469 1
1 939 . 15 1 1 A 74 74 ALA HA H 74 4.100 4.363 -0.263 1
1 943 . 15 1 1 A 74 74 ALA C C 74 177.757 177.206 0.551 1
1 944 . 15 1 1 A 74 74 ALA CA C 74 53.153 52.025 1.128 1
1 945 . 15 1 1 A 74 74 ALA CB C 74 19.412 19.428 -0.016 1
1 946 . 15 1 1 A 74 74 ALA N N 74 122.292 119.972 2.320 1
1 947 . 15 1 1 A 75 75 ARG H H 75 8.500 8.503 -0.003 1
1 948 . 15 1 1 A 75 75 ARG HA H 75 4.758 4.378 0.380 1
1 955 . 15 1 1 A 75 75 ARG C C 75 176.812 175.986 0.826 1
1 956 . 15 1 1 A 75 75 ARG CA C 75 56.646 56.059 0.587 1
1 957 . 15 1 1 A 75 75 ARG CB C 75 29.375 30.794 -1.419 1
1 960 . 15 1 1 A 75 75 ARG N N 75 122.871 123.269 -0.398 1
1 961 . 15 1 1 A 76 76 VAL H H 76 7.965 8.968 -1.003 1
1 962 . 15 1 1 A 76 76 VAL HA H 76 5.230 4.934 0.296 1
1 970 . 15 1 1 A 76 76 VAL C C 76 173.758 174.113 -0.355 1
1 971 . 15 1 1 A 76 76 VAL CA C 76 58.193 58.490 -0.297 1
1 972 . 15 1 1 A 76 76 VAL CB C 76 36.536 35.924 0.612 1
1 975 . 15 1 1 A 76 76 VAL N N 76 116.220 118.236 -2.016 1
1 976 . 15 1 1 A 77 77 GLU H H 77 9.166 9.329 -0.163 1
1 977 . 15 1 1 A 77 77 GLU HA H 77 4.663 4.926 -0.263 1
1 982 . 15 1 1 A 77 77 GLU C C 77 174.940 174.336 0.604 1
1 983 . 15 1 1 A 77 77 GLU CA C 77 53.546 54.319 -0.773 1
1 984 . 15 1 1 A 77 77 GLU CB C 77 33.395 33.688 -0.293 1
1 986 . 15 1 1 A 77 77 GLU N N 77 116.413 120.055 -3.642 1
1 987 . 15 1 1 A 78 78 LEU H H 78 8.670 8.870 -0.200 1
1 988 . 15 1 1 A 78 78 LEU HA H 78 4.677 4.761 -0.084 1
1 998 . 15 1 1 A 78 78 LEU C C 78 176.036 176.498 -0.462 1
1 999 . 15 1 1 A 78 78 LEU CA C 78 53.091 53.586 -0.495 1
1 1000 . 15 1 1 A 78 78 LEU CB C 78 43.276 43.142 0.134 1
1 1004 . 15 1 1 A 78 78 LEU N N 78 117.927 123.436 -5.509 1
1 1005 . 15 1 1 A 79 79 ILE H H 79 7.900 8.755 -0.855 1
1 1006 . 15 1 1 A 79 79 ILE HA H 79 4.312 3.883 0.429 1
1 1016 . 15 1 1 A 79 79 ILE C C 79 175.179 176.584 -1.405 1
1 1017 . 15 1 1 A 79 79 ILE CA C 79 58.294 64.542 -6.248 1
1 1018 . 15 1 1 A 79 79 ILE CB C 79 36.086 38.138 -2.052 1
1 1022 . 15 1 1 A 79 79 ILE N N 79 121.667 125.694 -4.027 1
1 1023 . 15 1 1 A 80 80 ASN H H 80 9.412 8.176 1.236 1
1 1024 . 15 1 1 A 80 80 ASN HA H 80 4.516 5.216 -0.700 1
1 1029 . 15 1 1 A 80 80 ASN C C 80 170.300 172.365 -2.065 1
1 1030 . 15 1 1 A 80 80 ASN CA C 80 54.198 50.434 3.764 1
1 1031 . 15 1 1 A 80 80 ASN CB C 80 37.450 39.100 -1.650 1
1 1033 . 15 1 1 A 80 80 ASN N N 80 123.831 118.906 4.925 1
1 1035 . 15 1 1 A 81 81 PRO HA H 81 5.185 4.936 0.249 1
1 1042 . 15 1 1 A 81 81 PRO C C 81 176.865 176.501 0.364 1
1 1043 . 15 1 1 A 81 81 PRO CA C 81 62.637 62.285 0.352 1
1 1044 . 15 1 1 A 81 81 PRO CB C 81 32.965 32.446 0.519 1
1 1047 . 15 1 1 A 82 82 ILE H H 82 9.374 8.570 0.804 1
1 1048 . 15 1 1 A 82 82 ILE HA H 82 4.524 5.028 -0.504 1
1 1058 . 15 1 1 A 82 82 ILE C C 82 174.731 174.321 0.410 1
1 1059 . 15 1 1 A 82 82 ILE CA C 82 60.205 58.783 1.422 1
1 1060 . 15 1 1 A 82 82 ILE CB C 82 41.737 41.386 0.351 1
1 1064 . 15 1 1 A 82 82 ILE N N 82 121.658 117.606 4.052 1
1 1065 . 15 1 1 A 83 83 ALA H H 83 8.819 8.889 -0.070 1
1 1066 . 15 1 1 A 83 83 ALA HA H 83 4.773 4.770 0.003 1
1 1070 . 15 1 1 A 83 83 ALA C C 83 176.550 176.810 -0.260 1
1 1071 . 15 1 1 A 83 83 ALA CA C 83 52.069 52.241 -0.172 1
1 1072 . 15 1 1 A 83 83 ALA CB C 83 20.374 19.093 1.281 1
1 1073 . 15 1 1 A 83 83 ALA N N 83 127.933 127.897 0.036 1
1 1074 . 15 1 1 A 84 84 ASP H H 84 8.710 8.716 -0.006 1
1 1075 . 15 1 1 A 84 84 ASP HA H 84 4.894 4.877 0.017 1
1 1078 . 15 1 1 A 84 84 ASP C C 84 175.997 174.690 1.307 1
1 1079 . 15 1 1 A 84 84 ASP CA C 84 53.334 52.297 1.037 1
1 1080 . 15 1 1 A 84 84 ASP CB C 84 42.104 42.767 -0.663 1
1 1081 . 15 1 1 A 84 84 ASP N N 84 122.009 124.756 -2.747 1
1 1082 . 15 1 1 A 85 85 THR H H 85 8.349 8.260 0.089 1
1 1083 . 15 1 1 A 85 85 THR HA H 85 4.420 4.500 -0.080 1
1 1088 . 15 1 1 A 85 85 THR C C 85 175.085 173.995 1.090 1
1 1089 . 15 1 1 A 85 85 THR CA C 85 62.304 61.061 1.243 1
1 1090 . 15 1 1 A 85 85 THR CB C 85 69.718 68.568 1.150 1
1 1092 . 15 1 1 A 85 85 THR N N 85 114.986 115.073 -0.087 1
1 1093 . 15 1 1 A 86 86 VAL H H 86 8.188 8.388 -0.200 1
1 1094 . 15 1 1 A 86 86 VAL HA H 86 4.021 4.420 -0.399 1
1 1102 . 15 1 1 A 86 86 VAL C C 86 176.519 177.164 -0.645 1
1 1103 . 15 1 1 A 86 86 VAL CA C 86 63.046 62.412 0.634 1
1 1104 . 15 1 1 A 86 86 VAL CB C 86 32.526 32.942 -0.416 1
1 1107 . 15 1 1 A 86 86 VAL N N 86 122.275 125.173 -2.898 1
1 1108 . 15 1 1 A 87 87 ALA H H 87 8.194 8.932 -0.738 1
1 1109 . 15 1 1 A 87 87 ALA HA H 87 4.212 4.081 0.131 1
1 1113 . 15 1 1 A 87 87 ALA C C 87 178.118 179.995 -1.877 1
1 1114 . 15 1 1 A 87 87 ALA CA C 87 53.153 55.521 -2.368 1
1 1115 . 15 1 1 A 87 87 ALA CB C 87 19.165 18.851 0.314 1
1 1116 . 15 1 1 A 87 87 ALA N N 87 126.609 127.495 -0.886 1
1 1117 . 15 1 1 A 88 88 THR H H 88 7.914 8.220 -0.306 1
1 1118 . 15 1 1 A 88 88 THR HA H 88 4.173 4.252 -0.079 1
1 1123 . 15 1 1 A 88 88 THR C C 88 174.516 176.788 -2.272 1
1 1124 . 15 1 1 A 88 88 THR CA C 88 62.785 65.187 -2.402 1
1 1125 . 15 1 1 A 88 88 THR CB C 88 69.582 68.515 1.067 1
1 1127 . 15 1 1 A 88 88 THR N N 88 112.328 111.468 0.860 1
1 1128 . 15 1 1 A 89 89 ALA H H 89 8.076 7.988 0.088 1
1 1129 . 15 1 1 A 89 89 ALA HA H 89 4.320 4.309 0.011 1
1 1133 . 15 1 1 A 89 89 ALA C C 89 178.014 179.791 -1.777 1
1 1134 . 15 1 1 A 89 89 ALA CA C 89 53.079 54.377 -1.298 1
1 1135 . 15 1 1 A 89 89 ALA CB C 89 19.335 19.088 0.247 1
1 1136 . 15 1 1 A 89 89 ALA N N 89 124.632 124.593 0.039 1
1 1137 . 15 1 1 A 90 90 THR H H 90 7.976 7.494 0.482 1
1 1138 . 15 1 1 A 90 90 THR HA H 90 4.203 3.942 0.261 1
1 1143 . 15 1 1 A 90 90 THR C C 90 174.427 173.782 0.645 1
1 1144 . 15 1 1 A 90 90 THR CA C 90 62.519 64.718 -2.199 1
1 1145 . 15 1 1 A 90 90 THR CB C 90 69.721 68.852 0.869 1
1 1147 . 15 1 1 A 90 90 THR N N 90 112.047 112.890 -0.843 1
1 1148 . 15 1 1 A 91 91 TYR H H 91 7.959 7.956 0.003 1
1 1149 . 15 1 1 A 91 91 TYR HA H 91 4.564 4.868 -0.304 1
1 1156 . 15 1 1 A 91 91 TYR C C 91 175.522 174.964 0.558 1
1 1157 . 15 1 1 A 91 91 TYR CA C 91 57.874 57.432 0.442 1
1 1158 . 15 1 1 A 91 91 TYR CB C 91 38.584 39.638 -1.054 1
1 1163 . 15 1 1 A 91 91 TYR N N 91 121.184 119.900 1.284 1
1 1164 . 15 1 1 A 92 92 GLN H H 92 8.310 8.777 -0.467 1
1 1165 . 15 1 1 A 92 92 GLN HA H 92 4.258 4.251 0.007 1
1 1172 . 15 1 1 A 92 92 GLN C C 92 176.099 176.877 -0.778 1
1 1173 . 15 1 1 A 92 92 GLN CA C 92 56.109 57.269 -1.160 1
1 1174 . 15 1 1 A 92 92 GLN CB C 92 29.112 29.010 0.102 1
1 1177 . 15 1 1 A 92 92 GLN N N 92 121.631 124.142 -2.511 1
1 1179 . 15 1 1 A 93 93 GLY H H 93 8.052 8.849 -0.797 1
1 1180 . 15 1 1 A 93 93 GLY HA2 H 93 4.023 3.973 0.050 1
1 1181 . 15 1 1 A 93 93 GLY HA3 H 93 3.856 3.973 -0.117 1
1 1182 . 15 1 1 A 93 93 GLY C C 93 173.791 173.871 -0.080 1
1 1183 . 15 1 1 A 93 93 GLY CA C 93 45.382 46.456 -1.074 1
1 1184 . 15 1 1 A 93 93 GLY N N 93 109.847 114.121 -4.274 1
1 1185 . 15 1 1 A 94 94 ALA H H 94 8.162 7.723 0.439 1
1 1186 . 15 1 1 A 94 94 ALA HA H 94 4.329 4.721 -0.392 1
1 1190 . 15 1 1 A 94 94 ALA C C 94 177.392 176.495 0.897 1
1 1191 . 15 1 1 A 94 94 ALA CA C 94 52.558 51.405 1.153 1
1 1192 . 15 1 1 A 94 94 ALA CB C 94 19.526 20.732 -1.206 1
1 1193 . 15 1 1 A 94 94 ALA N N 94 123.424 121.515 1.909 1
1 1194 . 15 1 1 A 95 95 ASP H H 95 8.457 8.969 -0.512 1
1 1195 . 15 1 1 A 95 95 ASP HA H 95 4.608 4.757 -0.149 1
1 1198 . 15 1 1 A 95 95 ASP C C 95 175.630 175.900 -0.270 1
1 1199 . 15 1 1 A 95 95 ASP CA C 95 54.450 53.905 0.545 1
1 1200 . 15 1 1 A 95 95 ASP CB C 95 40.871 39.599 1.272 1
1 1201 . 15 1 1 A 95 95 ASP N N 95 118.814 123.489 -4.675 1
1 1202 . 15 1 1 A 96 96 VAL H H 96 7.776 8.070 -0.294 1
1 1203 . 15 1 1 A 96 96 VAL HA H 96 4.141 4.526 -0.385 1
1 1211 . 15 1 1 A 96 96 VAL C C 96 175.301 175.948 -0.647 1
1 1212 . 15 1 1 A 96 96 VAL CA C 96 61.435 60.759 0.676 1
1 1213 . 15 1 1 A 96 96 VAL CB C 96 33.517 32.900 0.617 1
1 1216 . 15 1 1 A 96 96 VAL N N 96 118.395 121.364 -2.969 1
1 1217 . 15 1 1 A 97 97 ASP H H 97 8.315 8.547 -0.232 1
1 1218 . 15 1 1 A 97 97 ASP HA H 97 4.681 4.720 -0.039 1
1 1221 . 15 1 1 A 97 97 ASP C C 97 175.151 176.298 -1.147 1
1 1222 . 15 1 1 A 97 97 ASP CA C 97 54.324 55.086 -0.762 1
1 1223 . 15 1 1 A 97 97 ASP CB C 97 41.963 41.652 0.311 1
1 1224 . 15 1 1 A 97 97 ASP N N 97 123.905 123.917 -0.012 1
1 1225 . 15 1 1 A 98 98 TRP H H 98 8.210 8.795 -0.585 1
1 1226 . 15 1 1 A 98 98 TRP HA H 98 4.916 5.834 -0.918 1
1 1235 . 15 1 1 A 98 98 TRP C C 98 174.585 175.088 -0.503 1
1 1236 . 15 1 1 A 98 98 TRP CA C 98 56.164 54.657 1.507 1
1 1237 . 15 1 1 A 98 98 TRP CB C 98 31.466 32.629 -1.163 1
1 1243 . 15 1 1 A 98 98 TRP N N 98 120.340 119.361 0.979 1
1 1245 . 15 1 1 A 99 99 TYR H H 99 8.760 9.187 -0.427 1
1 1246 . 15 1 1 A 99 99 TYR HA H 99 5.119 5.417 -0.298 1
1 1253 . 15 1 1 A 99 99 TYR C C 99 174.599 174.572 0.027 1
1 1254 . 15 1 1 A 99 99 TYR CA C 99 57.021 56.284 0.737 1
1 1255 . 15 1 1 A 99 99 TYR CB C 99 39.526 40.467 -0.941 1
1 1260 . 15 1 1 A 99 99 TYR N N 99 123.319 119.421 3.898 1
1 1261 . 15 1 1 A 100 100 ILE H H 100 8.936 9.370 -0.434 1
1 1262 . 15 1 1 A 100 100 ILE HA H 100 4.850 4.761 0.089 1
1 1272 . 15 1 1 A 100 100 ILE C C 100 175.070 175.099 -0.029 1
1 1273 . 15 1 1 A 100 100 ILE CA C 100 58.998 60.118 -1.120 1
1 1274 . 15 1 1 A 100 100 ILE CB C 100 40.667 39.024 1.643 1
1 1278 . 15 1 1 A 100 100 ILE N N 100 123.281 124.020 -0.739 1
1 1279 . 15 1 1 A 101 101 LYS H H 101 8.987 8.880 0.107 1
1 1280 . 15 1 1 A 101 101 LYS HA H 101 5.313 5.092 0.221 1
1 1289 . 15 1 1 A 101 101 LYS C C 101 174.440 176.281 -1.841 1
1 1290 . 15 1 1 A 101 101 LYS CA C 101 54.763 55.911 -1.148 1
1 1291 . 15 1 1 A 101 101 LYS CB C 101 34.880 33.425 1.455 1
1 1295 . 15 1 1 A 101 101 LYS N N 101 126.210 127.653 -1.443 1
1 1296 . 15 1 1 A 102 102 ALA H H 102 8.531 8.260 0.271 1
1 1297 . 15 1 1 A 102 102 ALA HA H 102 4.957 5.154 -0.197 1
1 1301 . 15 1 1 A 102 102 ALA C C 102 175.024 177.847 -2.823 1
1 1302 . 15 1 1 A 102 102 ALA CA C 102 50.701 50.457 0.244 1
1 1303 . 15 1 1 A 102 102 ALA CB C 102 21.618 22.290 -0.672 1
1 1304 . 15 1 1 A 102 102 ALA N N 102 121.424 126.248 -4.824 1
1 1305 . 15 1 1 A 103 103 ASP H H 103 8.339 8.993 -0.654 1
1 1306 . 15 1 1 A 103 103 ASP HA H 103 4.603 4.459 0.144 1
1 1309 . 15 1 1 A 103 103 ASP C C 103 176.188 175.394 0.794 1
1 1310 . 15 1 1 A 103 103 ASP CA C 103 56.049 56.569 -0.520 1
1 1311 . 15 1 1 A 103 103 ASP CB C 103 40.932 41.491 -0.559 1
1 1312 . 15 1 1 A 103 103 ASP N N 103 117.773 121.245 -3.472 1
1 1313 . 15 1 1 A 104 104 ASP H H 104 7.482 7.733 -0.251 1
1 1314 . 15 1 1 A 104 104 ASP HA H 104 4.727 4.946 -0.219 1
1 1317 . 15 1 1 A 104 104 ASP C C 104 174.261 173.624 0.637 1
1 1318 . 15 1 1 A 104 104 ASP CA C 104 52.768 53.770 -1.002 1
1 1319 . 15 1 1 A 104 104 ASP CB C 104 42.587 43.885 -1.298 1
1 1320 . 15 1 1 A 104 104 ASP N N 104 110.673 116.818 -6.145 1
1 1321 . 15 1 1 A 105 105 ILE H H 105 9.267 8.419 0.848 1
1 1322 . 15 1 1 A 105 105 ILE HA H 105 4.631 4.978 -0.347 1
1 1332 . 15 1 1 A 105 105 ILE C C 105 173.922 175.460 -1.538 1
1 1333 . 15 1 1 A 105 105 ILE CA C 105 61.114 60.353 0.761 1
1 1334 . 15 1 1 A 105 105 ILE CB C 105 42.522 40.573 1.949 1
1 1338 . 15 1 1 A 105 105 ILE N N 105 121.380 122.387 -1.007 1
1 1339 . 15 1 1 A 106 106 VAL H H 106 8.592 9.010 -0.418 1
1 1340 . 15 1 1 A 106 106 VAL HA H 106 4.975 5.022 -0.047 1
1 1348 . 15 1 1 A 106 106 VAL C C 106 175.049 175.007 0.042 1
1 1349 . 15 1 1 A 106 106 VAL CA C 106 58.028 59.410 -1.382 1
1 1350 . 15 1 1 A 106 106 VAL CB C 106 35.388 35.638 -0.250 1
1 1353 . 15 1 1 A 106 106 VAL N N 106 116.356 120.659 -4.303 1
1 1354 . 15 1 1 A 107 107 LEU H H 107 8.360 8.304 0.056 1
1 1355 . 15 1 1 A 107 107 LEU HA H 107 4.167 4.113 0.054 1
1 1365 . 15 1 1 A 107 107 LEU C C 107 178.338 177.365 0.973 1
1 1366 . 15 1 1 A 107 107 LEU CA C 107 55.077 54.453 0.624 1
1 1367 . 15 1 1 A 107 107 LEU CB C 107 42.394 42.221 0.173 1
1 1371 . 15 1 1 A 107 107 LEU N N 107 121.368 122.634 -1.266 1
1 1372 . 15 1 1 A 108 108 THR H H 108 7.977 8.533 -0.556 1
1 1373 . 15 1 1 A 108 108 THR HA H 108 4.039 4.123 -0.084 1
1 1378 . 15 1 1 A 108 108 THR C C 108 174.725 175.191 -0.466 1
1 1379 . 15 1 1 A 108 108 THR CA C 108 63.513 64.713 -1.200 1
1 1380 . 15 1 1 A 108 108 THR CB C 108 69.194 68.436 0.758 1
1 1382 . 15 1 1 A 108 108 THR N N 108 118.728 117.563 1.165 1
1 1383 . 15 1 1 A 109 109 LEU H H 109 8.378 9.029 -0.651 1
1 1384 . 15 1 1 A 109 109 LEU HA H 109 4.274 3.986 0.288 1
1 1394 . 15 1 1 A 109 109 LEU C C 109 177.058 176.284 0.774 1
1 1395 . 15 1 1 A 109 109 LEU CA C 109 55.045 55.881 -0.836 1
1 1396 . 15 1 1 A 109 109 LEU CB C 109 42.620 39.716 2.904 1
1 1400 . 15 1 1 A 109 109 LEU N N 109 124.847 124.379 0.468 1
1 9 . 16 1 1 A 2 2 MET HA H 2 4.554 5.094 -0.540 1
1 14 . 16 1 1 A 2 2 MET C C 2 174.749 175.238 -0.489 1
1 15 . 16 1 1 A 2 2 MET CA C 2 55.354 54.076 1.278 1
1 16 . 16 1 1 A 2 2 MET CB C 2 33.729 36.750 -3.021 1
1 18 . 16 1 1 A 3 3 ARG H H 3 8.518 8.560 -0.042 1
1 19 . 16 1 1 A 3 3 ARG HA H 3 4.531 4.570 -0.039 1
1 26 . 16 1 1 A 3 3 ARG C C 3 175.780 175.892 -0.112 1
1 27 . 16 1 1 A 3 3 ARG CA C 3 55.854 56.318 -0.464 1
1 28 . 16 1 1 A 3 3 ARG CB C 3 31.403 31.329 0.074 1
1 31 . 16 1 1 A 3 3 ARG N N 3 124.008 123.083 0.925 1
1 32 . 16 1 1 A 4 4 LEU H H 4 8.424 8.400 0.024 1
1 33 . 16 1 1 A 4 4 LEU HA H 4 4.457 4.902 -0.445 1
1 43 . 16 1 1 A 4 4 LEU C C 4 177.362 176.215 1.147 1
1 44 . 16 1 1 A 4 4 LEU CA C 4 54.511 53.557 0.954 1
1 45 . 16 1 1 A 4 4 LEU CB C 4 42.686 44.224 -1.538 1
1 49 . 16 1 1 A 4 4 LEU N N 4 124.389 122.173 2.216 1
1 50 . 16 1 1 A 5 5 ALA H H 5 8.418 8.841 -0.423 1
1 51 . 16 1 1 A 5 5 ALA HA H 5 4.254 4.837 -0.583 1
1 55 . 16 1 1 A 5 5 ALA C C 5 177.420 176.267 1.153 1
1 56 . 16 1 1 A 5 5 ALA CA C 5 52.931 50.492 2.439 1
1 57 . 16 1 1 A 5 5 ALA CB C 5 19.263 19.666 -0.403 1
1 58 . 16 1 1 A 5 5 ALA N N 5 124.548 125.341 -0.793 1
1 59 . 16 1 1 A 6 6 ASN H H 6 8.287 8.671 -0.384 1
1 60 . 16 1 1 A 6 6 ASN HA H 6 4.616 5.301 -0.685 1
1 65 . 16 1 1 A 6 6 ASN C C 6 175.837 174.858 0.979 1
1 66 . 16 1 1 A 6 6 ASN CA C 6 53.345 51.207 2.138 1
1 67 . 16 1 1 A 6 6 ASN CB C 6 38.571 42.105 -3.534 1
1 69 . 16 1 1 A 6 6 ASN N N 6 116.484 119.129 -2.645 1
1 71 . 16 1 1 A 7 7 GLY H H 7 8.351 8.625 -0.274 1
1 72 . 16 1 1 A 7 7 GLY HA2 H 7 4.130 3.861 0.269 1
1 73 . 16 1 1 A 7 7 GLY HA3 H 7 3.808 3.865 -0.057 1
1 74 . 16 1 1 A 7 7 GLY C C 7 173.750 174.179 -0.429 1
1 75 . 16 1 1 A 7 7 GLY CA C 7 45.343 46.346 -1.003 1
1 76 . 16 1 1 A 7 7 GLY N N 7 108.453 109.918 -1.465 1
1 77 . 16 1 1 A 8 8 ILE H H 8 7.868 7.751 0.117 1
1 78 . 16 1 1 A 8 8 ILE HA H 8 4.130 4.318 -0.188 1
1 88 . 16 1 1 A 8 8 ILE C C 8 175.570 174.797 0.773 1
1 89 . 16 1 1 A 8 8 ILE CA C 8 61.095 60.182 0.913 1
1 90 . 16 1 1 A 8 8 ILE CB C 8 38.694 39.163 -0.469 1
1 94 . 16 1 1 A 8 8 ILE N N 8 120.848 117.976 2.872 1
1 95 . 16 1 1 A 9 9 VAL H H 9 8.220 8.500 -0.280 1
1 96 . 16 1 1 A 9 9 VAL HA H 9 4.172 4.471 -0.299 1
1 104 . 16 1 1 A 9 9 VAL C C 9 175.898 175.616 0.282 1
1 105 . 16 1 1 A 9 9 VAL CA C 9 62.488 61.030 1.458 1
1 106 . 16 1 1 A 9 9 VAL CB C 9 32.460 32.846 -0.386 1
1 109 . 16 1 1 A 9 9 VAL N N 9 125.805 123.221 2.584 1
1 110 . 16 1 1 A 10 10 LEU H H 10 8.437 8.647 -0.210 1
1 111 . 16 1 1 A 10 10 LEU HA H 10 4.347 4.558 -0.211 1
1 121 . 16 1 1 A 10 10 LEU C C 10 176.398 175.896 0.502 1
1 122 . 16 1 1 A 10 10 LEU CA C 10 54.787 54.076 0.711 1
1 123 . 16 1 1 A 10 10 LEU CB C 10 42.639 42.379 0.260 1
1 127 . 16 1 1 A 10 10 LEU N N 10 127.757 128.813 -1.056 1
1 128 . 16 1 1 A 11 11 ASP H H 11 8.506 8.287 0.219 1
1 129 . 16 1 1 A 11 11 ASP HA H 11 4.683 4.642 0.041 1
1 132 . 16 1 1 A 11 11 ASP C C 11 176.672 175.314 1.358 1
1 133 . 16 1 1 A 11 11 ASP CA C 11 53.586 54.390 -0.804 1
1 134 . 16 1 1 A 11 11 ASP CB C 11 41.123 41.754 -0.631 1
1 135 . 16 1 1 A 11 11 ASP N N 11 121.539 120.737 0.802 1
1 136 . 16 1 1 A 12 12 LYS H H 12 8.578 8.844 -0.266 1
1 137 . 16 1 1 A 12 12 LYS HA H 12 3.943 4.493 -0.550 1
1 146 . 16 1 1 A 12 12 LYS C C 12 176.917 175.380 1.537 1
1 147 . 16 1 1 A 12 12 LYS CA C 12 58.542 57.369 1.173 1
1 148 . 16 1 1 A 12 12 LYS CB C 12 32.703 35.776 -3.073 1
1 152 . 16 1 1 A 12 12 LYS N N 12 123.635 124.621 -0.986 1
1 153 . 16 1 1 A 13 13 ASP H H 13 8.523 7.892 0.631 1
1 154 . 16 1 1 A 13 13 ASP HA H 13 4.566 4.724 -0.158 1
1 157 . 16 1 1 A 13 13 ASP C C 13 177.535 175.786 1.749 1
1 158 . 16 1 1 A 13 13 ASP CA C 13 56.034 53.314 2.720 1
1 159 . 16 1 1 A 13 13 ASP CB C 13 41.051 40.737 0.314 1
1 160 . 16 1 1 A 13 13 ASP N N 13 120.448 118.504 1.944 1
1 161 . 16 1 1 A 14 14 THR H H 14 7.964 8.411 -0.447 1
1 162 . 16 1 1 A 14 14 THR HA H 14 4.146 3.762 0.384 1
1 167 . 16 1 1 A 14 14 THR C C 14 175.440 174.524 0.916 1
1 168 . 16 1 1 A 14 14 THR CA C 14 63.245 64.371 -1.126 1
1 169 . 16 1 1 A 14 14 THR CB C 14 69.092 68.717 0.375 1
1 171 . 16 1 1 A 14 14 THR N N 14 113.711 119.847 -6.136 1
1 172 . 16 1 1 A 15 15 THR H H 15 7.921 7.435 0.486 1
1 173 . 16 1 1 A 15 15 THR HA H 15 3.920 4.373 -0.453 1
1 178 . 16 1 1 A 15 15 THR C C 15 174.750 174.368 0.382 1
1 179 . 16 1 1 A 15 15 THR CA C 15 64.562 61.119 3.443 1
1 180 . 16 1 1 A 15 15 THR CB C 15 69.166 68.207 0.959 1
1 182 . 16 1 1 A 15 15 THR N N 15 116.710 109.959 6.751 1
1 183 . 16 1 1 A 16 16 PHE H H 16 8.191 8.370 -0.179 1
1 184 . 16 1 1 A 16 16 PHE HA H 16 4.628 4.448 0.180 1
1 192 . 16 1 1 A 16 16 PHE C C 16 177.754 175.977 1.777 1
1 193 . 16 1 1 A 16 16 PHE CA C 16 57.975 58.901 -0.926 1
1 194 . 16 1 1 A 16 16 PHE CB C 16 39.553 39.128 0.425 1
1 200 . 16 1 1 A 16 16 PHE N N 16 117.124 127.024 -9.900 1
1 201 . 16 1 1 A 17 17 GLY H H 17 8.110 8.732 -0.622 1
1 202 . 16 1 1 A 17 17 GLY HA2 H 17 4.017 4.028 -0.011 1
1 203 . 16 1 1 A 17 17 GLY HA3 H 17 3.849 4.029 -0.180 1
1 204 . 16 1 1 A 17 17 GLY C C 17 172.231 173.438 -1.207 1
1 205 . 16 1 1 A 17 17 GLY CA C 17 45.633 45.113 0.520 1
1 206 . 16 1 1 A 17 17 GLY N N 17 109.951 111.831 -1.880 1
1 207 . 16 1 1 A 18 18 GLU H H 18 8.304 8.345 -0.041 1
1 208 . 16 1 1 A 18 18 GLU HA H 18 4.078 4.829 -0.751 1
1 213 . 16 1 1 A 18 18 GLU C C 18 175.588 175.436 0.152 1
1 214 . 16 1 1 A 18 18 GLU CA C 18 57.446 55.359 2.087 1
1 215 . 16 1 1 A 18 18 GLU CB C 18 30.767 31.078 -0.311 1
1 217 . 16 1 1 A 18 18 GLU N N 18 121.640 123.475 -1.835 1
1 218 . 16 1 1 A 19 19 LEU H H 19 8.799 9.250 -0.451 1
1 219 . 16 1 1 A 19 19 LEU HA H 19 5.416 5.233 0.183 1
1 229 . 16 1 1 A 19 19 LEU C C 19 176.875 175.943 0.932 1
1 230 . 16 1 1 A 19 19 LEU CA C 19 53.281 53.297 -0.016 1
1 231 . 16 1 1 A 19 19 LEU CB C 19 45.508 44.865 0.643 1
1 235 . 16 1 1 A 19 19 LEU N N 19 127.101 127.938 -0.837 1
1 236 . 16 1 1 A 20 20 LYS H H 20 8.494 8.939 -0.445 1
1 237 . 16 1 1 A 20 20 LYS HA H 20 5.200 5.210 -0.010 1
1 246 . 16 1 1 A 20 20 LYS C C 20 176.163 175.478 0.685 1
1 247 . 16 1 1 A 20 20 LYS CA C 20 53.575 54.462 -0.887 1
1 248 . 16 1 1 A 20 20 LYS CB C 20 36.835 36.058 0.777 1
1 252 . 16 1 1 A 20 20 LYS N N 20 118.828 122.426 -3.598 1
1 253 . 16 1 1 A 21 21 PHE H H 21 9.658 8.898 0.760 1
1 254 . 16 1 1 A 21 21 PHE HA H 21 4.038 4.603 -0.565 1
1 262 . 16 1 1 A 21 21 PHE C C 21 174.296 175.264 -0.968 1
1 263 . 16 1 1 A 21 21 PHE CA C 21 60.462 59.026 1.436 1
1 264 . 16 1 1 A 21 21 PHE CB C 21 40.359 39.887 0.472 1
1 270 . 16 1 1 A 21 21 PHE N N 21 124.322 125.914 -1.592 1
1 271 . 16 1 1 A 22 22 SER H H 22 7.199 8.228 -1.029 1
1 272 . 16 1 1 A 22 22 SER HA H 22 5.046 4.326 0.720 1
1 275 . 16 1 1 A 22 22 SER C C 22 173.080 174.297 -1.217 1
1 276 . 16 1 1 A 22 22 SER CA C 22 58.547 58.186 0.361 1
1 277 . 16 1 1 A 22 22 SER CB C 22 63.591 64.100 -0.509 1
1 278 . 16 1 1 A 22 22 SER N N 22 120.109 119.089 1.020 1
1 279 . 16 1 1 A 23 23 ALA H H 23 7.269 6.819 0.450 1
1 280 . 16 1 1 A 23 23 ALA HA H 23 4.426 4.367 0.059 1
1 284 . 16 1 1 A 23 23 ALA C C 23 176.568 174.103 2.465 1
1 285 . 16 1 1 A 23 23 ALA CA C 23 52.458 51.154 1.304 1
1 286 . 16 1 1 A 23 23 ALA CB C 23 22.728 22.376 0.352 1
1 287 . 16 1 1 A 23 23 ALA N N 23 114.102 119.734 -5.632 1
1 288 . 16 1 1 A 24 24 LEU H H 24 8.819 8.565 0.254 1
1 289 . 16 1 1 A 24 24 LEU HA H 24 4.060 5.020 -0.960 1
1 299 . 16 1 1 A 24 24 LEU C C 24 175.363 176.390 -1.027 1
1 300 . 16 1 1 A 24 24 LEU CA C 24 56.901 53.667 3.234 1
1 301 . 16 1 1 A 24 24 LEU CB C 24 42.065 43.569 -1.504 1
1 305 . 16 1 1 A 24 24 LEU N N 24 120.865 119.869 0.996 1
1 306 . 16 1 1 A 25 25 ARG H H 25 9.473 8.786 0.687 1
1 307 . 16 1 1 A 25 25 ARG HA H 25 4.428 4.180 0.248 1
1 315 . 16 1 1 A 25 25 ARG C C 25 175.729 175.576 0.153 1
1 316 . 16 1 1 A 25 25 ARG CA C 25 56.721 57.974 -1.253 1
1 317 . 16 1 1 A 25 25 ARG CB C 25 31.109 31.183 -0.074 1
1 320 . 16 1 1 A 25 25 ARG N N 25 130.455 127.790 2.665 1
1 322 . 16 1 1 A 26 26 ARG H H 26 7.711 7.383 0.328 1
1 323 . 16 1 1 A 26 26 ARG HA H 26 4.559 4.634 -0.075 1
1 330 . 16 1 1 A 26 26 ARG C C 26 173.724 173.524 0.200 1
1 331 . 16 1 1 A 26 26 ARG CA C 26 55.737 55.756 -0.019 1
1 332 . 16 1 1 A 26 26 ARG CB C 26 33.261 34.218 -0.957 1
1 335 . 16 1 1 A 26 26 ARG N N 26 113.305 118.354 -5.049 1
1 336 . 16 1 1 A 27 27 GLU H H 27 8.848 8.663 0.185 1
1 337 . 16 1 1 A 27 27 GLU HA H 27 4.615 4.889 -0.274 1
1 342 . 16 1 1 A 27 27 GLU C C 27 174.836 175.678 -0.842 1
1 343 . 16 1 1 A 27 27 GLU CA C 27 55.901 55.310 0.591 1
1 344 . 16 1 1 A 27 27 GLU CB C 27 30.755 30.765 -0.010 1
1 346 . 16 1 1 A 27 27 GLU N N 27 121.934 125.124 -3.190 1
1 347 . 16 1 1 A 28 28 VAL H H 28 8.603 8.344 0.259 1
1 348 . 16 1 1 A 28 28 VAL HA H 28 4.013 4.463 -0.450 1
1 356 . 16 1 1 A 28 28 VAL C C 28 175.561 175.695 -0.134 1
1 357 . 16 1 1 A 28 28 VAL CA C 28 62.791 61.620 1.171 1
1 358 . 16 1 1 A 28 28 VAL CB C 28 32.710 32.564 0.146 1
1 361 . 16 1 1 A 28 28 VAL N N 28 125.545 121.621 3.924 1
1 362 . 16 1 1 A 29 29 ARG H H 29 8.735 8.635 0.100 1
1 363 . 16 1 1 A 29 29 ARG HA H 29 4.774 4.731 0.043 1
1 370 . 16 1 1 A 29 29 ARG C C 29 176.580 176.177 0.403 1
1 371 . 16 1 1 A 29 29 ARG CA C 29 55.481 54.178 1.303 1
1 372 . 16 1 1 A 29 29 ARG CB C 29 31.963 32.178 -0.215 1
1 375 . 16 1 1 A 29 29 ARG N N 29 128.327 126.922 1.405 1
1 376 . 16 1 1 A 30 30 ILE H H 30 8.358 8.845 -0.487 1
1 377 . 16 1 1 A 30 30 ILE HA H 30 3.882 4.260 -0.378 1
1 387 . 16 1 1 A 30 30 ILE C C 30 175.093 175.172 -0.079 1
1 388 . 16 1 1 A 30 30 ILE CA C 30 61.669 60.433 1.236 1
1 389 . 16 1 1 A 30 30 ILE CB C 30 38.806 37.852 0.954 1
1 393 . 16 1 1 A 30 30 ILE N N 30 121.957 122.124 -0.167 1
1 394 . 16 1 1 A 31 31 GLN H H 31 8.560 8.811 -0.251 1
1 395 . 16 1 1 A 31 31 GLN HA H 31 4.647 4.929 -0.282 1
1 402 . 16 1 1 A 31 31 GLN C C 31 175.954 175.659 0.295 1
1 403 . 16 1 1 A 31 31 GLN CA C 31 54.833 54.271 0.562 1
1 404 . 16 1 1 A 31 31 GLN CB C 31 30.584 30.883 -0.299 1
1 407 . 16 1 1 A 31 31 GLN N N 31 126.348 127.743 -1.395 1
1 409 . 16 1 1 A 32 32 ASN H H 32 8.994 9.028 -0.034 1
1 410 . 16 1 1 A 32 32 ASN HA H 32 4.784 4.728 0.056 1
1 415 . 16 1 1 A 32 32 ASN C C 32 177.296 176.688 0.608 1
1 416 . 16 1 1 A 32 32 ASN CA C 32 53.206 53.455 -0.249 1
1 417 . 16 1 1 A 32 32 ASN CB C 32 39.472 38.906 0.566 1
1 419 . 16 1 1 A 32 32 ASN N N 32 122.834 124.786 -1.952 1
1 421 . 16 1 1 A 33 33 GLU H H 33 9.180 8.825 0.355 1
1 422 . 16 1 1 A 33 33 GLU HA H 33 4.063 4.055 0.008 1
1 427 . 16 1 1 A 33 33 GLU C C 33 176.787 178.277 -1.490 1
1 428 . 16 1 1 A 33 33 GLU CA C 33 59.347 59.204 0.143 1
1 429 . 16 1 1 A 33 33 GLU CB C 33 29.294 29.294 0.000 1
1 431 . 16 1 1 A 33 33 GLU N N 33 122.736 122.083 0.653 1
1 432 . 16 1 1 A 34 34 ASP H H 34 7.969 7.895 0.074 1
1 433 . 16 1 1 A 34 34 ASP HA H 34 4.499 4.465 0.034 1
1 436 . 16 1 1 A 34 34 ASP C C 34 177.111 176.087 1.024 1
1 437 . 16 1 1 A 34 34 ASP CA C 34 53.632 55.034 -1.402 1
1 438 . 16 1 1 A 34 34 ASP CB C 34 39.807 41.266 -1.459 1
1 439 . 16 1 1 A 34 34 ASP N N 34 115.921 117.826 -1.905 1
1 440 . 16 1 1 A 35 35 GLY H H 35 8.083 7.702 0.381 1
1 441 . 16 1 1 A 35 35 GLY HA2 H 35 4.366 4.024 0.342 1
1 442 . 16 1 1 A 35 35 GLY HA3 H 35 3.657 4.025 -0.368 1
1 443 . 16 1 1 A 35 35 GLY C C 35 174.584 174.690 -0.106 1
1 444 . 16 1 1 A 35 35 GLY CA C 35 45.134 45.394 -0.260 1
1 445 . 16 1 1 A 35 35 GLY N N 35 108.874 107.193 1.681 1
1 446 . 16 1 1 A 36 36 SER H H 36 8.274 8.010 0.264 1
1 447 . 16 1 1 A 36 36 SER HA H 36 4.389 4.504 -0.115 1
1 450 . 16 1 1 A 36 36 SER C C 36 173.284 173.633 -0.349 1
1 451 . 16 1 1 A 36 36 SER CA C 36 58.383 58.629 -0.246 1
1 452 . 16 1 1 A 36 36 SER CB C 36 64.576 64.570 0.006 1
1 453 . 16 1 1 A 36 36 SER N N 36 117.428 115.849 1.579 1
1 454 . 16 1 1 A 37 37 VAL H H 37 8.508 8.474 0.034 1
1 455 . 16 1 1 A 37 37 VAL HA H 37 4.346 4.503 -0.157 1
1 463 . 16 1 1 A 37 37 VAL C C 37 176.370 175.110 1.260 1
1 464 . 16 1 1 A 37 37 VAL CA C 37 62.410 60.845 1.565 1
1 465 . 16 1 1 A 37 37 VAL CB C 37 33.086 34.240 -1.154 1
1 468 . 16 1 1 A 37 37 VAL N N 37 119.189 122.467 -3.278 1
1 469 . 16 1 1 A 38 38 SER H H 38 8.461 8.980 -0.519 1
1 470 . 16 1 1 A 38 38 SER HA H 38 4.586 4.690 -0.104 1
1 473 . 16 1 1 A 38 38 SER C C 38 173.829 174.874 -1.045 1
1 474 . 16 1 1 A 38 38 SER CA C 38 57.618 57.668 -0.050 1
1 475 . 16 1 1 A 38 38 SER CB C 38 64.537 64.371 0.166 1
1 476 . 16 1 1 A 38 38 SER N N 38 121.629 121.688 -0.059 1
1 477 . 16 1 1 A 39 39 ASP H H 39 8.512 8.743 -0.231 1
1 478 . 16 1 1 A 39 39 ASP HA H 39 4.606 4.493 0.113 1
1 481 . 16 1 1 A 39 39 ASP C C 39 176.557 176.971 -0.414 1
1 482 . 16 1 1 A 39 39 ASP CA C 39 54.833 56.293 -1.460 1
1 483 . 16 1 1 A 39 39 ASP CB C 39 41.123 41.217 -0.094 1
1 484 . 16 1 1 A 39 39 ASP N N 39 120.305 123.265 -2.960 1
1 485 . 16 1 1 A 40 40 GLU H H 40 8.311 7.637 0.674 1
1 486 . 16 1 1 A 40 40 GLU HA H 40 4.235 4.409 -0.174 1
1 491 . 16 1 1 A 40 40 GLU C C 40 175.327 176.231 -0.904 1
1 492 . 16 1 1 A 40 40 GLU CA C 40 56.215 57.348 -1.133 1
1 493 . 16 1 1 A 40 40 GLU CB C 40 30.788 30.289 0.499 1
1 495 . 16 1 1 A 40 40 GLU N N 40 120.680 117.740 2.940 1
1 496 . 16 1 1 A 41 41 ILE H H 41 8.465 8.726 -0.261 1
1 497 . 16 1 1 A 41 41 ILE HA H 41 4.127 4.656 -0.529 1
1 507 . 16 1 1 A 41 41 ILE C C 41 175.380 175.875 -0.495 1
1 508 . 16 1 1 A 41 41 ILE CA C 41 60.670 59.717 0.953 1
1 509 . 16 1 1 A 41 41 ILE CB C 41 38.805 40.661 -1.856 1
1 513 . 16 1 1 A 41 41 ILE N N 41 123.665 123.533 0.132 1
1 514 . 16 1 1 A 42 42 LYS H H 42 9.556 9.002 0.554 1
1 515 . 16 1 1 A 42 42 LYS HA H 42 4.428 4.265 0.163 1
1 524 . 16 1 1 A 42 42 LYS C C 42 177.277 176.761 0.516 1
1 525 . 16 1 1 A 42 42 LYS CA C 42 57.274 58.053 -0.779 1
1 526 . 16 1 1 A 42 42 LYS CB C 42 35.169 33.038 2.131 1
1 530 . 16 1 1 A 42 42 LYS N N 42 125.597 125.703 -0.106 1
1 531 . 16 1 1 A 43 43 GLU H H 43 7.809 7.324 0.485 1
1 532 . 16 1 1 A 43 43 GLU HA H 43 4.886 4.687 0.199 1
1 537 . 16 1 1 A 43 43 GLU C C 43 173.593 173.571 0.022 1
1 538 . 16 1 1 A 43 43 GLU CA C 43 54.669 55.381 -0.712 1
1 539 . 16 1 1 A 43 43 GLU CB C 43 32.882 32.083 0.799 1
1 541 . 16 1 1 A 43 43 GLU N N 43 115.292 112.975 2.317 1
1 542 . 16 1 1 A 44 44 ARG H H 44 8.879 8.946 -0.067 1
1 543 . 16 1 1 A 44 44 ARG HA H 44 4.917 5.153 -0.236 1
1 551 . 16 1 1 A 44 44 ARG C C 44 173.708 174.383 -0.675 1
1 552 . 16 1 1 A 44 44 ARG CA C 44 55.965 54.470 1.495 1
1 553 . 16 1 1 A 44 44 ARG CB C 44 33.579 33.310 0.269 1
1 556 . 16 1 1 A 44 44 ARG N N 44 118.233 121.213 -2.980 1
1 558 . 16 1 1 A 45 45 THR H H 45 8.892 9.033 -0.141 1
1 559 . 16 1 1 A 45 45 THR HA H 45 5.308 5.055 0.253 1
1 564 . 16 1 1 A 45 45 THR C C 45 173.357 173.370 -0.013 1
1 565 . 16 1 1 A 45 45 THR CA C 45 60.939 61.710 -0.771 1
1 566 . 16 1 1 A 45 45 THR CB C 45 70.054 70.200 -0.146 1
1 568 . 16 1 1 A 45 45 THR N N 45 118.457 122.848 -4.391 1
1 569 . 16 1 1 A 46 46 TYR H H 46 9.625 9.846 -0.221 1
1 570 . 16 1 1 A 46 46 TYR HA H 46 4.771 5.256 -0.485 1
1 578 . 16 1 1 A 46 46 TYR C C 46 173.735 175.288 -1.553 1
1 579 . 16 1 1 A 46 46 TYR CA C 46 57.480 56.498 0.982 1
1 580 . 16 1 1 A 46 46 TYR CB C 46 41.724 41.912 -0.188 1
1 585 . 16 1 1 A 46 46 TYR N N 46 125.916 126.171 -0.255 1
1 586 . 16 1 1 A 47 47 ASP H H 47 9.006 9.212 -0.206 1
1 587 . 16 1 1 A 47 47 ASP HA H 47 5.399 5.002 0.397 1
1 590 . 16 1 1 A 47 47 ASP C C 47 175.094 175.047 0.047 1
1 591 . 16 1 1 A 47 47 ASP CA C 47 53.460 54.008 -0.548 1
1 592 . 16 1 1 A 47 47 ASP CB C 47 41.947 42.066 -0.119 1
1 593 . 16 1 1 A 47 47 ASP N N 47 122.109 122.357 -0.248 1
1 594 . 16 1 1 A 48 48 LEU H H 48 9.066 8.859 0.207 1
1 595 . 16 1 1 A 48 48 LEU HA H 48 4.831 5.014 -0.183 1
1 605 . 16 1 1 A 48 48 LEU C C 48 174.977 175.584 -0.607 1
1 606 . 16 1 1 A 48 48 LEU CA C 48 52.724 53.298 -0.574 1
1 607 . 16 1 1 A 48 48 LEU CB C 48 44.844 45.048 -0.204 1
1 611 . 16 1 1 A 48 48 LEU N N 48 121.879 125.053 -3.174 1
1 612 . 16 1 1 A 49 49 LYS H H 49 9.401 8.942 0.459 1
1 613 . 16 1 1 A 49 49 LYS HA H 49 4.477 4.543 -0.066 1
1 622 . 16 1 1 A 49 49 LYS C C 49 176.225 175.778 0.447 1
1 623 . 16 1 1 A 49 49 LYS CA C 49 56.017 56.114 -0.097 1
1 624 . 16 1 1 A 49 49 LYS CB C 49 33.838 33.139 0.699 1
1 628 . 16 1 1 A 49 49 LYS N N 49 122.218 124.858 -2.640 1
1 629 . 16 1 1 A 50 50 SER H H 50 8.266 8.948 -0.682 1
1 630 . 16 1 1 A 50 50 SER HA H 50 5.222 4.994 0.228 1
1 633 . 16 1 1 A 50 50 SER C C 50 175.570 173.747 1.823 1
1 634 . 16 1 1 A 50 50 SER CA C 50 55.770 57.664 -1.894 1
1 635 . 16 1 1 A 50 50 SER CB C 50 64.738 65.024 -0.286 1
1 636 . 16 1 1 A 50 50 SER N N 50 117.388 121.040 -3.652 1
1 637 . 16 1 1 A 51 51 LYS H H 51 9.276 8.426 0.850 1
1 638 . 16 1 1 A 51 51 LYS HA H 51 4.208 4.536 -0.328 1
1 647 . 16 1 1 A 51 51 LYS C C 51 178.773 176.267 2.506 1
1 648 . 16 1 1 A 51 51 LYS CA C 51 58.674 56.215 2.459 1
1 649 . 16 1 1 A 51 51 LYS CB C 51 33.383 31.615 1.768 1
1 653 . 16 1 1 A 51 51 LYS N N 51 130.550 125.411 5.139 1
1 654 . 16 1 1 A 52 52 GLY H H 52 8.320 7.855 0.465 1
1 655 . 16 1 1 A 52 52 GLY HA2 H 52 3.875 4.219 -0.344 1
1 656 . 16 1 1 A 52 52 GLY HA3 H 52 3.628 4.245 -0.617 1
1 657 . 16 1 1 A 52 52 GLY C C 52 175.108 173.900 1.208 1
1 658 . 16 1 1 A 52 52 GLY CA C 52 46.322 46.178 0.144 1
1 659 . 16 1 1 A 52 52 GLY N N 52 107.053 111.109 -4.056 1
1 660 . 16 1 1 A 53 53 GLN H H 53 7.859 8.721 -0.862 1
1 661 . 16 1 1 A 53 53 GLN HA H 53 4.409 4.393 0.016 1
1 668 . 16 1 1 A 53 53 GLN C C 53 176.469 176.069 0.400 1
1 669 . 16 1 1 A 53 53 GLN CA C 53 54.911 55.607 -0.696 1
1 670 . 16 1 1 A 53 53 GLN CB C 53 29.675 28.458 1.217 1
1 673 . 16 1 1 A 53 53 GLN N N 53 115.482 121.836 -6.354 1
1 675 . 16 1 1 A 54 54 GLY H H 54 7.992 8.253 -0.261 1
1 676 . 16 1 1 A 54 54 GLY HA2 H 54 3.934 3.922 0.012 1
1 677 . 16 1 1 A 54 54 GLY HA3 H 54 3.934 3.928 0.006 1
1 678 . 16 1 1 A 54 54 GLY C C 54 173.897 173.886 0.011 1
1 679 . 16 1 1 A 54 54 GLY CA C 54 46.574 45.841 0.733 1
1 680 . 16 1 1 A 54 54 GLY N N 54 110.111 108.263 1.848 1
1 681 . 16 1 1 A 55 55 ARG H H 55 7.652 7.774 -0.122 1
1 682 . 16 1 1 A 55 55 ARG HA H 55 4.665 4.964 -0.299 1
1 690 . 16 1 1 A 55 55 ARG C C 55 174.649 175.396 -0.747 1
1 691 . 16 1 1 A 55 55 ARG CA C 55 54.631 54.547 0.084 1
1 692 . 16 1 1 A 55 55 ARG CB C 55 32.166 33.548 -1.382 1
1 695 . 16 1 1 A 55 55 ARG N N 55 114.214 116.478 -2.264 1
1 697 . 16 1 1 A 56 56 MET H H 56 8.593 9.139 -0.546 1
1 698 . 16 1 1 A 56 56 MET HA H 56 5.012 5.376 -0.364 1
1 703 . 16 1 1 A 56 56 MET C C 56 176.216 175.203 1.013 1
1 704 . 16 1 1 A 56 56 MET CA C 56 54.595 53.142 1.453 1
1 705 . 16 1 1 A 56 56 MET CB C 56 33.466 35.221 -1.755 1
1 707 . 16 1 1 A 56 56 MET N N 56 121.270 118.908 2.362 1
1 708 . 16 1 1 A 57 57 ILE H H 57 9.393 8.705 0.688 1
1 709 . 16 1 1 A 57 57 ILE HA H 57 4.717 4.720 -0.003 1
1 719 . 16 1 1 A 57 57 ILE C C 57 173.883 173.841 0.042 1
1 720 . 16 1 1 A 57 57 ILE CA C 57 59.713 58.888 0.825 1
1 721 . 16 1 1 A 57 57 ILE CB C 57 40.933 41.327 -0.394 1
1 725 . 16 1 1 A 57 57 ILE N N 57 120.811 112.264 8.547 1
1 726 . 16 1 1 A 58 58 GLN H H 58 8.218 8.233 -0.015 1
1 727 . 16 1 1 A 58 58 GLN HA H 58 5.407 4.829 0.578 1
1 734 . 16 1 1 A 58 58 GLN C C 58 175.368 174.570 0.798 1
1 735 . 16 1 1 A 58 58 GLN CA C 58 55.163 54.765 0.398 1
1 736 . 16 1 1 A 58 58 GLN CB C 58 30.841 29.033 1.808 1
1 739 . 16 1 1 A 58 58 GLN N N 58 122.281 122.386 -0.105 1
1 741 . 16 1 1 A 59 59 VAL H H 59 9.188 8.588 0.600 1
1 742 . 16 1 1 A 59 59 VAL HA H 59 5.025 5.311 -0.286 1
1 750 . 16 1 1 A 59 59 VAL C C 59 175.330 174.684 0.646 1
1 751 . 16 1 1 A 59 59 VAL CA C 59 59.975 61.118 -1.143 1
1 752 . 16 1 1 A 59 59 VAL CB C 59 34.818 33.106 1.712 1
1 755 . 16 1 1 A 59 59 VAL N N 59 122.421 126.498 -4.077 1
1 756 . 16 1 1 A 60 60 SER H H 60 9.022 9.125 -0.103 1
1 757 . 16 1 1 A 60 60 SER HA H 60 5.811 5.457 0.354 1
1 760 . 16 1 1 A 60 60 SER C C 60 173.234 173.281 -0.047 1
1 761 . 16 1 1 A 60 60 SER CA C 60 57.634 56.540 1.094 1
1 762 . 16 1 1 A 60 60 SER CB C 60 64.891 64.787 0.104 1
1 763 . 16 1 1 A 60 60 SER N N 60 124.709 122.851 1.858 1
1 764 . 16 1 1 A 61 61 ILE H H 61 9.226 8.983 0.243 1
1 765 . 16 1 1 A 61 61 ILE HA H 61 5.572 5.042 0.530 1
1 775 . 16 1 1 A 61 61 ILE C C 61 173.955 173.912 0.043 1
1 776 . 16 1 1 A 61 61 ILE CA C 61 56.937 57.303 -0.366 1
1 777 . 16 1 1 A 61 61 ILE CB C 61 39.596 39.388 0.208 1
1 781 . 16 1 1 A 61 61 ILE N N 61 121.648 122.641 -0.993 1
1 782 . 16 1 1 A 62 62 PRO HA H 62 4.606 4.509 0.097 1
1 789 . 16 1 1 A 62 62 PRO C C 62 178.143 177.473 0.670 1
1 790 . 16 1 1 A 62 62 PRO CA C 62 63.740 62.980 0.760 1
1 791 . 16 1 1 A 62 62 PRO CB C 62 33.303 32.692 0.611 1
1 794 . 16 1 1 A 63 63 ALA H H 63 7.803 8.414 -0.611 1
1 795 . 16 1 1 A 63 63 ALA HA H 63 4.037 4.014 0.023 1
1 799 . 16 1 1 A 63 63 ALA C C 63 175.942 178.633 -2.691 1
1 800 . 16 1 1 A 63 63 ALA CA C 63 54.417 54.332 0.085 1
1 801 . 16 1 1 A 63 63 ALA CB C 63 19.345 18.469 0.876 1
1 802 . 16 1 1 A 63 63 ALA N N 63 123.695 127.319 -3.624 1
1 803 . 16 1 1 A 64 64 SER H H 64 7.719 7.902 -0.183 1
1 804 . 16 1 1 A 64 64 SER HA H 64 4.097 4.488 -0.391 1
1 807 . 16 1 1 A 64 64 SER C C 64 175.199 173.974 1.225 1
1 808 . 16 1 1 A 64 64 SER CA C 64 59.474 59.691 -0.217 1
1 809 . 16 1 1 A 64 64 SER CB C 64 62.125 62.996 -0.871 1
1 810 . 16 1 1 A 64 64 SER N N 64 110.001 111.933 -1.932 1
1 811 . 16 1 1 A 65 65 VAL H H 65 7.790 7.639 0.151 1
1 812 . 16 1 1 A 65 65 VAL HA H 65 4.360 4.322 0.038 1
1 820 . 16 1 1 A 65 65 VAL C C 65 174.433 174.119 0.314 1
1 821 . 16 1 1 A 65 65 VAL CA C 65 60.335 58.795 1.540 1
1 822 . 16 1 1 A 65 65 VAL CB C 65 32.714 32.743 -0.029 1
1 825 . 16 1 1 A 65 65 VAL N N 65 126.142 122.382 3.760 1
1 826 . 16 1 1 A 66 66 PRO HA H 66 4.369 4.562 -0.193 1
1 833 . 16 1 1 A 66 66 PRO C C 66 177.412 176.517 0.895 1
1 834 . 16 1 1 A 66 66 PRO CA C 66 63.104 62.680 0.424 1
1 835 . 16 1 1 A 66 66 PRO CB C 66 32.558 32.094 0.464 1
1 838 . 16 1 1 A 67 67 LEU H H 67 8.578 8.426 0.152 1
1 839 . 16 1 1 A 67 67 LEU HA H 67 3.875 4.294 -0.419 1
1 849 . 16 1 1 A 67 67 LEU C C 67 176.077 176.353 -0.276 1
1 850 . 16 1 1 A 67 67 LEU CA C 67 56.413 55.504 0.909 1
1 851 . 16 1 1 A 67 67 LEU CB C 67 43.279 43.150 0.129 1
1 855 . 16 1 1 A 67 67 LEU N N 67 124.236 123.218 1.018 1
1 856 . 16 1 1 A 68 68 LYS H H 68 7.994 8.718 -0.724 1
1 857 . 16 1 1 A 68 68 LYS HA H 68 3.793 3.910 -0.117 1
1 866 . 16 1 1 A 68 68 LYS C C 68 175.601 176.092 -0.491 1
1 867 . 16 1 1 A 68 68 LYS CA C 68 53.350 58.064 -4.714 1
1 868 . 16 1 1 A 68 68 LYS CB C 68 31.035 31.763 -0.728 1
1 872 . 16 1 1 A 68 68 LYS N N 68 124.053 125.247 -1.194 1
1 873 . 16 1 1 A 69 69 GLU H H 69 8.347 7.709 0.638 1
1 874 . 16 1 1 A 69 69 GLU HA H 69 4.501 3.731 0.770 1
1 879 . 16 1 1 A 69 69 GLU C C 69 175.304 175.674 -0.370 1
1 880 . 16 1 1 A 69 69 GLU CA C 69 54.291 57.356 -3.065 1
1 881 . 16 1 1 A 69 69 GLU CB C 69 29.285 27.263 2.022 1
1 883 . 16 1 1 A 69 69 GLU N N 69 123.876 116.196 7.680 1
1 884 . 16 1 1 A 70 70 PHE H H 70 5.549 6.844 -1.295 1
1 885 . 16 1 1 A 70 70 PHE HA H 70 4.592 4.345 0.247 1
1 893 . 16 1 1 A 70 70 PHE C C 70 174.443 175.295 -0.852 1
1 894 . 16 1 1 A 70 70 PHE CA C 70 53.313 57.587 -4.274 1
1 895 . 16 1 1 A 70 70 PHE CB C 70 38.335 38.941 -0.606 1
1 901 . 16 1 1 A 70 70 PHE N N 70 117.781 116.879 0.902 1
1 902 . 16 1 1 A 71 71 ASP H H 71 8.791 8.840 -0.049 1
1 903 . 16 1 1 A 71 71 ASP HA H 71 4.535 4.802 -0.267 1
1 906 . 16 1 1 A 71 71 ASP C C 71 175.867 175.868 -0.001 1
1 907 . 16 1 1 A 71 71 ASP CA C 71 54.248 54.478 -0.230 1
1 908 . 16 1 1 A 71 71 ASP CB C 71 41.166 41.513 -0.347 1
1 909 . 16 1 1 A 71 71 ASP N N 71 120.385 121.042 -0.657 1
1 910 . 16 1 1 A 72 72 TYR H H 72 8.701 8.728 -0.027 1
1 911 . 16 1 1 A 72 72 TYR HA H 72 4.283 4.594 -0.311 1
1 918 . 16 1 1 A 72 72 TYR C C 72 177.470 176.203 1.267 1
1 919 . 16 1 1 A 72 72 TYR CA C 72 60.513 58.886 1.627 1
1 920 . 16 1 1 A 72 72 TYR CB C 72 38.320 38.393 -0.073 1
1 925 . 16 1 1 A 72 72 TYR N N 72 121.876 123.328 -1.452 1
1 926 . 16 1 1 A 73 73 ASN H H 73 8.819 9.040 -0.221 1
1 927 . 16 1 1 A 73 73 ASN HA H 73 4.096 4.154 -0.058 1
1 932 . 16 1 1 A 73 73 ASN C C 73 174.362 174.016 0.346 1
1 933 . 16 1 1 A 73 73 ASN CA C 73 54.289 54.091 0.198 1
1 934 . 16 1 1 A 73 73 ASN CB C 73 36.907 36.829 0.078 1
1 936 . 16 1 1 A 73 73 ASN N N 73 121.726 120.250 1.476 1
1 938 . 16 1 1 A 74 74 ALA H H 74 8.059 7.484 0.575 1
1 939 . 16 1 1 A 74 74 ALA HA H 74 4.100 4.456 -0.356 1
1 943 . 16 1 1 A 74 74 ALA C C 74 177.757 177.271 0.486 1
1 944 . 16 1 1 A 74 74 ALA CA C 74 53.153 51.507 1.646 1
1 945 . 16 1 1 A 74 74 ALA CB C 74 19.412 19.981 -0.569 1
1 946 . 16 1 1 A 74 74 ALA N N 74 122.292 119.838 2.454 1
1 947 . 16 1 1 A 75 75 ARG H H 75 8.500 8.450 0.050 1
1 948 . 16 1 1 A 75 75 ARG HA H 75 4.758 4.512 0.246 1
1 955 . 16 1 1 A 75 75 ARG C C 75 176.812 175.986 0.826 1
1 956 . 16 1 1 A 75 75 ARG CA C 75 56.646 56.321 0.325 1
1 957 . 16 1 1 A 75 75 ARG CB C 75 29.375 30.632 -1.257 1
1 960 . 16 1 1 A 75 75 ARG N N 75 122.871 121.452 1.419 1
1 961 . 16 1 1 A 76 76 VAL H H 76 7.965 9.062 -1.097 1
1 962 . 16 1 1 A 76 76 VAL HA H 76 5.230 4.869 0.361 1
1 970 . 16 1 1 A 76 76 VAL C C 76 173.758 174.445 -0.687 1
1 971 . 16 1 1 A 76 76 VAL CA C 76 58.193 58.979 -0.786 1
1 972 . 16 1 1 A 76 76 VAL CB C 76 36.536 35.185 1.351 1
1 975 . 16 1 1 A 76 76 VAL N N 76 116.220 118.754 -2.534 1
1 976 . 16 1 1 A 77 77 GLU H H 77 9.166 9.331 -0.165 1
1 977 . 16 1 1 A 77 77 GLU HA H 77 4.663 5.082 -0.419 1
1 982 . 16 1 1 A 77 77 GLU C C 77 174.940 174.714 0.226 1
1 983 . 16 1 1 A 77 77 GLU CA C 77 53.546 54.123 -0.577 1
1 984 . 16 1 1 A 77 77 GLU CB C 77 33.395 33.622 -0.227 1
1 986 . 16 1 1 A 77 77 GLU N N 77 116.413 121.754 -5.341 1
1 987 . 16 1 1 A 78 78 LEU H H 78 8.670 8.792 -0.122 1
1 988 . 16 1 1 A 78 78 LEU HA H 78 4.677 4.907 -0.230 1
1 998 . 16 1 1 A 78 78 LEU C C 78 176.036 176.700 -0.664 1
1 999 . 16 1 1 A 78 78 LEU CA C 78 53.091 53.188 -0.097 1
1 1000 . 16 1 1 A 78 78 LEU CB C 78 43.276 43.973 -0.697 1
1 1004 . 16 1 1 A 78 78 LEU N N 78 117.927 123.181 -5.254 1
1 1005 . 16 1 1 A 79 79 ILE H H 79 7.900 8.325 -0.425 1
1 1006 . 16 1 1 A 79 79 ILE HA H 79 4.312 3.974 0.338 1
1 1016 . 16 1 1 A 79 79 ILE C C 79 175.179 176.436 -1.257 1
1 1017 . 16 1 1 A 79 79 ILE CA C 79 58.294 64.522 -6.228 1
1 1018 . 16 1 1 A 79 79 ILE CB C 79 36.086 38.419 -2.333 1
1 1022 . 16 1 1 A 79 79 ILE N N 79 121.667 124.154 -2.487 1
1 1023 . 16 1 1 A 80 80 ASN H H 80 9.412 8.310 1.102 1
1 1024 . 16 1 1 A 80 80 ASN HA H 80 4.516 5.167 -0.651 1
1 1029 . 16 1 1 A 80 80 ASN C C 80 170.300 172.346 -2.046 1
1 1030 . 16 1 1 A 80 80 ASN CA C 80 54.198 50.474 3.724 1
1 1031 . 16 1 1 A 80 80 ASN CB C 80 37.450 39.180 -1.730 1
1 1033 . 16 1 1 A 80 80 ASN N N 80 123.831 118.972 4.859 1
1 1035 . 16 1 1 A 81 81 PRO HA H 81 5.185 4.848 0.337 1
1 1042 . 16 1 1 A 81 81 PRO C C 81 176.865 176.504 0.361 1
1 1043 . 16 1 1 A 81 81 PRO CA C 81 62.637 62.236 0.401 1
1 1044 . 16 1 1 A 81 81 PRO CB C 81 32.965 31.984 0.981 1
1 1047 . 16 1 1 A 82 82 ILE H H 82 9.374 8.579 0.795 1
1 1048 . 16 1 1 A 82 82 ILE HA H 82 4.524 5.053 -0.529 1
1 1058 . 16 1 1 A 82 82 ILE C C 82 174.731 174.303 0.428 1
1 1059 . 16 1 1 A 82 82 ILE CA C 82 60.205 58.708 1.497 1
1 1060 . 16 1 1 A 82 82 ILE CB C 82 41.737 41.384 0.353 1
1 1064 . 16 1 1 A 82 82 ILE N N 82 121.658 117.807 3.851 1
1 1065 . 16 1 1 A 83 83 ALA H H 83 8.819 9.015 -0.196 1
1 1066 . 16 1 1 A 83 83 ALA HA H 83 4.773 4.812 -0.039 1
1 1070 . 16 1 1 A 83 83 ALA C C 83 176.550 176.543 0.007 1
1 1071 . 16 1 1 A 83 83 ALA CA C 83 52.069 51.689 0.380 1
1 1072 . 16 1 1 A 83 83 ALA CB C 83 20.374 19.953 0.421 1
1 1073 . 16 1 1 A 83 83 ALA N N 83 127.933 127.455 0.478 1
1 1074 . 16 1 1 A 84 84 ASP H H 84 8.710 9.031 -0.321 1
1 1075 . 16 1 1 A 84 84 ASP HA H 84 4.894 5.326 -0.432 1
1 1078 . 16 1 1 A 84 84 ASP C C 84 175.997 175.498 0.499 1
1 1079 . 16 1 1 A 84 84 ASP CA C 84 53.334 52.892 0.442 1
1 1080 . 16 1 1 A 84 84 ASP CB C 84 42.104 44.095 -1.991 1
1 1081 . 16 1 1 A 84 84 ASP N N 84 122.009 123.364 -1.355 1
1 1082 . 16 1 1 A 85 85 THR H H 85 8.349 8.857 -0.508 1
1 1083 . 16 1 1 A 85 85 THR HA H 85 4.420 4.577 -0.157 1
1 1088 . 16 1 1 A 85 85 THR C C 85 175.085 173.504 1.581 1
1 1089 . 16 1 1 A 85 85 THR CA C 85 62.304 62.104 0.200 1
1 1090 . 16 1 1 A 85 85 THR CB C 85 69.718 67.079 2.639 1
1 1092 . 16 1 1 A 85 85 THR N N 85 114.986 119.300 -4.314 1
1 1093 . 16 1 1 A 86 86 VAL H H 86 8.188 8.593 -0.405 1
1 1094 . 16 1 1 A 86 86 VAL HA H 86 4.021 4.535 -0.514 1
1 1102 . 16 1 1 A 86 86 VAL C C 86 176.519 174.774 1.745 1
1 1103 . 16 1 1 A 86 86 VAL CA C 86 63.046 60.085 2.961 1
1 1104 . 16 1 1 A 86 86 VAL CB C 86 32.526 35.444 -2.918 1
1 1107 . 16 1 1 A 86 86 VAL N N 86 122.275 125.346 -3.071 1
1 1108 . 16 1 1 A 87 87 ALA H H 87 8.194 8.637 -0.443 1
1 1109 . 16 1 1 A 87 87 ALA HA H 87 4.212 3.873 0.339 1
1 1113 . 16 1 1 A 87 87 ALA C C 87 178.118 177.811 0.307 1
1 1114 . 16 1 1 A 87 87 ALA CA C 87 53.153 55.183 -2.030 1
1 1115 . 16 1 1 A 87 87 ALA CB C 87 19.165 17.199 1.966 1
1 1116 . 16 1 1 A 87 87 ALA N N 87 126.609 125.705 0.904 1
1 1117 . 16 1 1 A 88 88 THR H H 88 7.914 8.322 -0.408 1
1 1118 . 16 1 1 A 88 88 THR HA H 88 4.173 4.096 0.077 1
1 1123 . 16 1 1 A 88 88 THR C C 88 174.516 175.469 -0.953 1
1 1124 . 16 1 1 A 88 88 THR CA C 88 62.785 64.581 -1.796 1
1 1125 . 16 1 1 A 88 88 THR CB C 88 69.582 68.768 0.814 1
1 1127 . 16 1 1 A 88 88 THR N N 88 112.328 113.045 -0.717 1
1 1128 . 16 1 1 A 89 89 ALA H H 89 8.076 7.586 0.490 1
1 1129 . 16 1 1 A 89 89 ALA HA H 89 4.320 4.327 -0.007 1
1 1133 . 16 1 1 A 89 89 ALA C C 89 178.014 177.312 0.702 1
1 1134 . 16 1 1 A 89 89 ALA CA C 89 53.079 52.264 0.815 1
1 1135 . 16 1 1 A 89 89 ALA CB C 89 19.335 19.393 -0.058 1
1 1136 . 16 1 1 A 89 89 ALA N N 89 124.632 122.181 2.451 1
1 1137 . 16 1 1 A 90 90 THR H H 90 7.976 7.877 0.099 1
1 1138 . 16 1 1 A 90 90 THR HA H 90 4.203 4.288 -0.085 1
1 1143 . 16 1 1 A 90 90 THR C C 90 174.427 173.613 0.814 1
1 1144 . 16 1 1 A 90 90 THR CA C 90 62.519 63.624 -1.105 1
1 1145 . 16 1 1 A 90 90 THR CB C 90 69.721 70.410 -0.689 1
1 1147 . 16 1 1 A 90 90 THR N N 90 112.047 111.493 0.554 1
1 1148 . 16 1 1 A 91 91 TYR H H 91 7.959 7.796 0.163 1
1 1149 . 16 1 1 A 91 91 TYR HA H 91 4.564 4.779 -0.215 1
1 1156 . 16 1 1 A 91 91 TYR C C 91 175.522 176.701 -1.179 1
1 1157 . 16 1 1 A 91 91 TYR CA C 91 57.874 57.812 0.062 1
1 1158 . 16 1 1 A 91 91 TYR CB C 91 38.584 40.151 -1.567 1
1 1163 . 16 1 1 A 91 91 TYR N N 91 121.184 118.565 2.619 1
1 1164 . 16 1 1 A 92 92 GLN H H 92 8.310 8.893 -0.583 1
1 1165 . 16 1 1 A 92 92 GLN HA H 92 4.258 4.101 0.157 1
1 1172 . 16 1 1 A 92 92 GLN C C 92 176.099 176.101 -0.002 1
1 1173 . 16 1 1 A 92 92 GLN CA C 92 56.109 56.828 -0.719 1
1 1174 . 16 1 1 A 92 92 GLN CB C 92 29.112 29.744 -0.632 1
1 1177 . 16 1 1 A 92 92 GLN N N 92 121.631 121.886 -0.255 1
1 1179 . 16 1 1 A 93 93 GLY H H 93 8.052 7.976 0.076 1
1 1180 . 16 1 1 A 93 93 GLY HA2 H 93 4.023 4.056 -0.033 1
1 1181 . 16 1 1 A 93 93 GLY HA3 H 93 3.856 4.082 -0.226 1
1 1182 . 16 1 1 A 93 93 GLY C C 93 173.791 175.124 -1.333 1
1 1183 . 16 1 1 A 93 93 GLY CA C 93 45.382 46.236 -0.854 1
1 1184 . 16 1 1 A 93 93 GLY N N 93 109.847 107.719 2.128 1
1 1185 . 16 1 1 A 94 94 ALA H H 94 8.162 8.186 -0.024 1
1 1186 . 16 1 1 A 94 94 ALA HA H 94 4.329 4.346 -0.017 1
1 1190 . 16 1 1 A 94 94 ALA C C 94 177.392 176.907 0.485 1
1 1191 . 16 1 1 A 94 94 ALA CA C 94 52.558 51.710 0.848 1
1 1192 . 16 1 1 A 94 94 ALA CB C 94 19.526 19.866 -0.340 1
1 1193 . 16 1 1 A 94 94 ALA N N 94 123.424 121.200 2.224 1
1 1194 . 16 1 1 A 95 95 ASP H H 95 8.457 7.625 0.832 1
1 1195 . 16 1 1 A 95 95 ASP HA H 95 4.608 4.885 -0.277 1
1 1198 . 16 1 1 A 95 95 ASP C C 95 175.630 175.992 -0.362 1
1 1199 . 16 1 1 A 95 95 ASP CA C 95 54.450 54.313 0.137 1
1 1200 . 16 1 1 A 95 95 ASP CB C 95 40.871 40.650 0.221 1
1 1201 . 16 1 1 A 95 95 ASP N N 95 118.814 119.678 -0.864 1
1 1202 . 16 1 1 A 96 96 VAL H H 96 7.776 8.746 -0.970 1
1 1203 . 16 1 1 A 96 96 VAL HA H 96 4.141 4.152 -0.011 1
1 1211 . 16 1 1 A 96 96 VAL C C 96 175.301 175.965 -0.664 1
1 1212 . 16 1 1 A 96 96 VAL CA C 96 61.435 64.005 -2.570 1
1 1213 . 16 1 1 A 96 96 VAL CB C 96 33.517 32.667 0.850 1
1 1216 . 16 1 1 A 96 96 VAL N N 96 118.395 125.913 -7.518 1
1 1217 . 16 1 1 A 97 97 ASP H H 97 8.315 7.836 0.479 1
1 1218 . 16 1 1 A 97 97 ASP HA H 97 4.681 4.901 -0.220 1
1 1221 . 16 1 1 A 97 97 ASP C C 97 175.151 176.226 -1.075 1
1 1222 . 16 1 1 A 97 97 ASP CA C 97 54.324 53.925 0.399 1
1 1223 . 16 1 1 A 97 97 ASP CB C 97 41.963 41.758 0.205 1
1 1224 . 16 1 1 A 97 97 ASP N N 97 123.905 118.671 5.234 1
1 1225 . 16 1 1 A 98 98 TRP H H 98 8.210 9.097 -0.887 1
1 1226 . 16 1 1 A 98 98 TRP HA H 98 4.916 5.008 -0.092 1
1 1235 . 16 1 1 A 98 98 TRP C C 98 174.585 175.744 -1.159 1
1 1236 . 16 1 1 A 98 98 TRP CA C 98 56.164 56.394 -0.230 1
1 1237 . 16 1 1 A 98 98 TRP CB C 98 31.466 30.748 0.718 1
1 1243 . 16 1 1 A 98 98 TRP N N 98 120.340 120.688 -0.348 1
1 1245 . 16 1 1 A 99 99 TYR H H 99 8.760 9.240 -0.480 1
1 1246 . 16 1 1 A 99 99 TYR HA H 99 5.119 5.217 -0.098 1
1 1253 . 16 1 1 A 99 99 TYR C C 99 174.599 175.101 -0.502 1
1 1254 . 16 1 1 A 99 99 TYR CA C 99 57.021 57.166 -0.145 1
1 1255 . 16 1 1 A 99 99 TYR CB C 99 39.526 40.624 -1.098 1
1 1260 . 16 1 1 A 99 99 TYR N N 99 123.319 119.771 3.548 1
1 1261 . 16 1 1 A 100 100 ILE H H 100 8.936 9.268 -0.332 1
1 1262 . 16 1 1 A 100 100 ILE HA H 100 4.850 4.589 0.261 1
1 1272 . 16 1 1 A 100 100 ILE C C 100 175.070 174.967 0.103 1
1 1273 . 16 1 1 A 100 100 ILE CA C 100 58.998 60.337 -1.339 1
1 1274 . 16 1 1 A 100 100 ILE CB C 100 40.667 39.981 0.686 1
1 1278 . 16 1 1 A 100 100 ILE N N 100 123.281 122.243 1.038 1
1 1279 . 16 1 1 A 101 101 LYS H H 101 8.987 8.935 0.052 1
1 1280 . 16 1 1 A 101 101 LYS HA H 101 5.313 4.910 0.403 1
1 1289 . 16 1 1 A 101 101 LYS C C 101 174.440 176.019 -1.579 1
1 1290 . 16 1 1 A 101 101 LYS CA C 101 54.763 56.069 -1.306 1
1 1291 . 16 1 1 A 101 101 LYS CB C 101 34.880 33.340 1.540 1
1 1295 . 16 1 1 A 101 101 LYS N N 101 126.210 127.529 -1.319 1
1 1296 . 16 1 1 A 102 102 ALA H H 102 8.531 8.487 0.044 1
1 1297 . 16 1 1 A 102 102 ALA HA H 102 4.957 5.282 -0.325 1
1 1301 . 16 1 1 A 102 102 ALA C C 102 175.024 177.245 -2.221 1
1 1302 . 16 1 1 A 102 102 ALA CA C 102 50.701 50.333 0.368 1
1 1303 . 16 1 1 A 102 102 ALA CB C 102 21.618 22.856 -1.238 1
1 1304 . 16 1 1 A 102 102 ALA N N 102 121.424 125.253 -3.829 1
1 1305 . 16 1 1 A 103 103 ASP H H 103 8.339 8.676 -0.337 1
1 1306 . 16 1 1 A 103 103 ASP HA H 103 4.603 4.450 0.153 1
1 1309 . 16 1 1 A 103 103 ASP C C 103 176.188 175.267 0.921 1
1 1310 . 16 1 1 A 103 103 ASP CA C 103 56.049 56.936 -0.887 1
1 1311 . 16 1 1 A 103 103 ASP CB C 103 40.932 41.424 -0.492 1
1 1312 . 16 1 1 A 103 103 ASP N N 103 117.773 119.612 -1.839 1
1 1313 . 16 1 1 A 104 104 ASP H H 104 7.482 7.721 -0.239 1
1 1314 . 16 1 1 A 104 104 ASP HA H 104 4.727 4.943 -0.216 1
1 1317 . 16 1 1 A 104 104 ASP C C 104 174.261 173.638 0.623 1
1 1318 . 16 1 1 A 104 104 ASP CA C 104 52.768 53.420 -0.652 1
1 1319 . 16 1 1 A 104 104 ASP CB C 104 42.587 43.829 -1.242 1
1 1320 . 16 1 1 A 104 104 ASP N N 104 110.673 117.140 -6.467 1
1 1321 . 16 1 1 A 105 105 ILE H H 105 9.267 8.620 0.647 1
1 1322 . 16 1 1 A 105 105 ILE HA H 105 4.631 4.805 -0.174 1
1 1332 . 16 1 1 A 105 105 ILE C C 105 173.922 175.310 -1.388 1
1 1333 . 16 1 1 A 105 105 ILE CA C 105 61.114 60.297 0.817 1
1 1334 . 16 1 1 A 105 105 ILE CB C 105 42.522 39.425 3.097 1
1 1338 . 16 1 1 A 105 105 ILE N N 105 121.380 122.073 -0.693 1
1 1339 . 16 1 1 A 106 106 VAL H H 106 8.592 8.951 -0.359 1
1 1340 . 16 1 1 A 106 106 VAL HA H 106 4.975 5.092 -0.117 1
1 1348 . 16 1 1 A 106 106 VAL C C 106 175.049 174.910 0.139 1
1 1349 . 16 1 1 A 106 106 VAL CA C 106 58.028 59.449 -1.421 1
1 1350 . 16 1 1 A 106 106 VAL CB C 106 35.388 35.570 -0.182 1
1 1353 . 16 1 1 A 106 106 VAL N N 106 116.356 120.751 -4.395 1
1 1354 . 16 1 1 A 107 107 LEU H H 107 8.360 8.511 -0.151 1
1 1355 . 16 1 1 A 107 107 LEU HA H 107 4.167 4.094 0.073 1
1 1365 . 16 1 1 A 107 107 LEU C C 107 178.338 177.488 0.850 1
1 1366 . 16 1 1 A 107 107 LEU CA C 107 55.077 54.350 0.727 1
1 1367 . 16 1 1 A 107 107 LEU CB C 107 42.394 42.023 0.371 1
1 1371 . 16 1 1 A 107 107 LEU N N 107 121.368 122.673 -1.305 1
1 1372 . 16 1 1 A 108 108 THR H H 108 7.977 8.618 -0.641 1
1 1373 . 16 1 1 A 108 108 THR HA H 108 4.039 4.430 -0.391 1
1 1378 . 16 1 1 A 108 108 THR C C 108 174.725 174.404 0.321 1
1 1379 . 16 1 1 A 108 108 THR CA C 108 63.513 63.158 0.355 1
1 1380 . 16 1 1 A 108 108 THR CB C 108 69.194 69.380 -0.186 1
1 1382 . 16 1 1 A 108 108 THR N N 108 118.728 118.392 0.336 1
1 1383 . 16 1 1 A 109 109 LEU H H 109 8.378 8.488 -0.110 1
1 1384 . 16 1 1 A 109 109 LEU HA H 109 4.274 4.426 -0.152 1
1 1394 . 16 1 1 A 109 109 LEU C C 109 177.058 175.710 1.348 1
1 1395 . 16 1 1 A 109 109 LEU CA C 109 55.045 54.558 0.487 1
1 1396 . 16 1 1 A 109 109 LEU CB C 109 42.620 40.342 2.278 1
1 1400 . 16 1 1 A 109 109 LEU N N 109 124.847 128.218 -3.371 1
1 9 . 17 1 1 A 2 2 MET HA H 2 4.554 5.038 -0.484 1
1 14 . 17 1 1 A 2 2 MET C C 2 174.749 174.910 -0.161 1
1 15 . 17 1 1 A 2 2 MET CA C 2 55.354 54.491 0.863 1
1 16 . 17 1 1 A 2 2 MET CB C 2 33.729 35.591 -1.862 1
1 18 . 17 1 1 A 3 3 ARG H H 3 8.518 8.563 -0.045 1
1 19 . 17 1 1 A 3 3 ARG HA H 3 4.531 4.507 0.024 1
1 26 . 17 1 1 A 3 3 ARG C C 3 175.780 175.196 0.584 1
1 27 . 17 1 1 A 3 3 ARG CA C 3 55.854 56.097 -0.243 1
1 28 . 17 1 1 A 3 3 ARG CB C 3 31.403 30.256 1.147 1
1 31 . 17 1 1 A 3 3 ARG N N 3 124.008 122.579 1.429 1
1 32 . 17 1 1 A 4 4 LEU H H 4 8.424 7.605 0.819 1
1 33 . 17 1 1 A 4 4 LEU HA H 4 4.457 4.818 -0.361 1
1 43 . 17 1 1 A 4 4 LEU C C 4 177.362 175.865 1.497 1
1 44 . 17 1 1 A 4 4 LEU CA C 4 54.511 53.041 1.470 1
1 45 . 17 1 1 A 4 4 LEU CB C 4 42.686 45.050 -2.364 1
1 49 . 17 1 1 A 4 4 LEU N N 4 124.389 121.662 2.727 1
1 50 . 17 1 1 A 5 5 ALA H H 5 8.418 8.515 -0.097 1
1 51 . 17 1 1 A 5 5 ALA HA H 5 4.254 5.114 -0.860 1
1 55 . 17 1 1 A 5 5 ALA C C 5 177.420 176.640 0.780 1
1 56 . 17 1 1 A 5 5 ALA CA C 5 52.931 50.366 2.565 1
1 57 . 17 1 1 A 5 5 ALA CB C 5 19.263 21.986 -2.723 1
1 58 . 17 1 1 A 5 5 ALA N N 5 124.548 121.433 3.115 1
1 59 . 17 1 1 A 6 6 ASN H H 6 8.287 9.111 -0.824 1
1 60 . 17 1 1 A 6 6 ASN HA H 6 4.616 5.154 -0.538 1
1 65 . 17 1 1 A 6 6 ASN C C 6 175.837 176.117 -0.280 1
1 66 . 17 1 1 A 6 6 ASN CA C 6 53.345 53.255 0.090 1
1 67 . 17 1 1 A 6 6 ASN CB C 6 38.571 40.063 -1.492 1
1 69 . 17 1 1 A 6 6 ASN N N 6 116.484 119.913 -3.429 1
1 71 . 17 1 1 A 7 7 GLY H H 7 8.351 7.916 0.435 1
1 72 . 17 1 1 A 7 7 GLY HA2 H 7 4.130 3.994 0.136 1
1 73 . 17 1 1 A 7 7 GLY HA3 H 7 3.808 3.994 -0.186 1
1 74 . 17 1 1 A 7 7 GLY C C 7 173.750 173.238 0.512 1
1 75 . 17 1 1 A 7 7 GLY CA C 7 45.343 44.651 0.692 1
1 76 . 17 1 1 A 7 7 GLY N N 7 108.453 106.486 1.967 1
1 77 . 17 1 1 A 8 8 ILE H H 8 7.868 8.281 -0.413 1
1 78 . 17 1 1 A 8 8 ILE HA H 8 4.130 4.644 -0.514 1
1 88 . 17 1 1 A 8 8 ILE C C 8 175.570 177.104 -1.534 1
1 89 . 17 1 1 A 8 8 ILE CA C 8 61.095 60.225 0.870 1
1 90 . 17 1 1 A 8 8 ILE CB C 8 38.694 38.827 -0.133 1
1 94 . 17 1 1 A 8 8 ILE N N 8 120.848 120.945 -0.097 1
1 95 . 17 1 1 A 9 9 VAL H H 9 8.220 8.829 -0.609 1
1 96 . 17 1 1 A 9 9 VAL HA H 9 4.172 3.846 0.326 1
1 104 . 17 1 1 A 9 9 VAL C C 9 175.898 176.070 -0.172 1
1 105 . 17 1 1 A 9 9 VAL CA C 9 62.488 64.939 -2.451 1
1 106 . 17 1 1 A 9 9 VAL CB C 9 32.460 32.151 0.309 1
1 109 . 17 1 1 A 9 9 VAL N N 9 125.805 124.574 1.231 1
1 110 . 17 1 1 A 10 10 LEU H H 10 8.437 7.540 0.897 1
1 111 . 17 1 1 A 10 10 LEU HA H 10 4.347 4.630 -0.283 1
1 121 . 17 1 1 A 10 10 LEU C C 10 176.398 174.394 2.004 1
1 122 . 17 1 1 A 10 10 LEU CA C 10 54.787 53.581 1.206 1
1 123 . 17 1 1 A 10 10 LEU CB C 10 42.639 43.992 -1.353 1
1 127 . 17 1 1 A 10 10 LEU N N 10 127.757 115.606 12.151 1
1 128 . 17 1 1 A 11 11 ASP H H 11 8.506 8.655 -0.149 1
1 129 . 17 1 1 A 11 11 ASP HA H 11 4.683 4.619 0.064 1
1 132 . 17 1 1 A 11 11 ASP C C 11 176.672 175.852 0.820 1
1 133 . 17 1 1 A 11 11 ASP CA C 11 53.586 54.093 -0.507 1
1 134 . 17 1 1 A 11 11 ASP CB C 11 41.123 41.151 -0.028 1
1 135 . 17 1 1 A 11 11 ASP N N 11 121.539 121.169 0.370 1
1 136 . 17 1 1 A 12 12 LYS H H 12 8.578 8.143 0.435 1
1 137 . 17 1 1 A 12 12 LYS HA H 12 3.943 4.035 -0.092 1
1 146 . 17 1 1 A 12 12 LYS C C 12 176.917 176.160 0.757 1
1 147 . 17 1 1 A 12 12 LYS CA C 12 58.542 56.557 1.985 1
1 148 . 17 1 1 A 12 12 LYS CB C 12 32.703 32.785 -0.082 1
1 152 . 17 1 1 A 12 12 LYS N N 12 123.635 128.380 -4.745 1
1 153 . 17 1 1 A 13 13 ASP H H 13 8.523 8.418 0.105 1
1 154 . 17 1 1 A 13 13 ASP HA H 13 4.566 4.376 0.190 1
1 157 . 17 1 1 A 13 13 ASP C C 13 177.535 175.834 1.701 1
1 158 . 17 1 1 A 13 13 ASP CA C 13 56.034 54.613 1.421 1
1 159 . 17 1 1 A 13 13 ASP CB C 13 41.051 40.067 0.984 1
1 160 . 17 1 1 A 13 13 ASP N N 13 120.448 125.810 -5.362 1
1 161 . 17 1 1 A 14 14 THR H H 14 7.964 8.587 -0.623 1
1 162 . 17 1 1 A 14 14 THR HA H 14 4.146 4.411 -0.265 1
1 167 . 17 1 1 A 14 14 THR C C 14 175.440 174.166 1.274 1
1 168 . 17 1 1 A 14 14 THR CA C 14 63.245 62.934 0.311 1
1 169 . 17 1 1 A 14 14 THR CB C 14 69.092 71.631 -2.539 1
1 171 . 17 1 1 A 14 14 THR N N 14 113.711 119.022 -5.311 1
1 172 . 17 1 1 A 15 15 THR H H 15 7.921 7.427 0.494 1
1 173 . 17 1 1 A 15 15 THR HA H 15 3.920 4.383 -0.463 1
1 178 . 17 1 1 A 15 15 THR C C 15 174.750 173.794 0.956 1
1 179 . 17 1 1 A 15 15 THR CA C 15 64.562 60.743 3.819 1
1 180 . 17 1 1 A 15 15 THR CB C 15 69.166 68.116 1.050 1
1 182 . 17 1 1 A 15 15 THR N N 15 116.710 108.377 8.333 1
1 183 . 17 1 1 A 16 16 PHE H H 16 8.191 8.521 -0.330 1
1 184 . 17 1 1 A 16 16 PHE HA H 16 4.628 4.756 -0.128 1
1 192 . 17 1 1 A 16 16 PHE C C 16 177.754 176.281 1.473 1
1 193 . 17 1 1 A 16 16 PHE CA C 16 57.975 57.402 0.573 1
1 194 . 17 1 1 A 16 16 PHE CB C 16 39.553 39.793 -0.240 1
1 200 . 17 1 1 A 16 16 PHE N N 16 117.124 126.962 -9.838 1
1 201 . 17 1 1 A 17 17 GLY H H 17 8.110 8.560 -0.450 1
1 202 . 17 1 1 A 17 17 GLY HA2 H 17 4.017 4.118 -0.101 1
1 203 . 17 1 1 A 17 17 GLY HA3 H 17 3.849 4.119 -0.270 1
1 204 . 17 1 1 A 17 17 GLY C C 17 172.231 173.286 -1.055 1
1 205 . 17 1 1 A 17 17 GLY CA C 17 45.633 44.589 1.044 1
1 206 . 17 1 1 A 17 17 GLY N N 17 109.951 110.413 -0.462 1
1 207 . 17 1 1 A 18 18 GLU H H 18 8.304 8.617 -0.313 1
1 208 . 17 1 1 A 18 18 GLU HA H 18 4.078 4.448 -0.370 1
1 213 . 17 1 1 A 18 18 GLU C C 18 175.588 176.143 -0.555 1
1 214 . 17 1 1 A 18 18 GLU CA C 18 57.446 56.662 0.784 1
1 215 . 17 1 1 A 18 18 GLU CB C 18 30.767 30.342 0.425 1
1 217 . 17 1 1 A 18 18 GLU N N 18 121.640 120.318 1.322 1
1 218 . 17 1 1 A 19 19 LEU H H 19 8.799 8.682 0.117 1
1 219 . 17 1 1 A 19 19 LEU HA H 19 5.416 4.585 0.831 1
1 229 . 17 1 1 A 19 19 LEU C C 19 176.875 176.375 0.500 1
1 230 . 17 1 1 A 19 19 LEU CA C 19 53.281 54.770 -1.489 1
1 231 . 17 1 1 A 19 19 LEU CB C 19 45.508 42.000 3.508 1
1 235 . 17 1 1 A 19 19 LEU N N 19 127.101 126.951 0.150 1
1 236 . 17 1 1 A 20 20 LYS H H 20 8.494 8.443 0.051 1
1 237 . 17 1 1 A 20 20 LYS HA H 20 5.200 4.973 0.227 1
1 246 . 17 1 1 A 20 20 LYS C C 20 176.163 175.999 0.164 1
1 247 . 17 1 1 A 20 20 LYS CA C 20 53.575 54.579 -1.004 1
1 248 . 17 1 1 A 20 20 LYS CB C 20 36.835 34.880 1.955 1
1 252 . 17 1 1 A 20 20 LYS N N 20 118.828 124.300 -5.472 1
1 253 . 17 1 1 A 21 21 PHE H H 21 9.658 9.158 0.500 1
1 254 . 17 1 1 A 21 21 PHE HA H 21 4.038 4.659 -0.621 1
1 262 . 17 1 1 A 21 21 PHE C C 21 174.296 174.846 -0.550 1
1 263 . 17 1 1 A 21 21 PHE CA C 21 60.462 59.349 1.113 1
1 264 . 17 1 1 A 21 21 PHE CB C 21 40.359 39.858 0.501 1
1 270 . 17 1 1 A 21 21 PHE N N 21 124.322 126.599 -2.277 1
1 271 . 17 1 1 A 22 22 SER H H 22 7.199 8.336 -1.137 1
1 272 . 17 1 1 A 22 22 SER HA H 22 5.046 4.623 0.423 1
1 275 . 17 1 1 A 22 22 SER C C 22 173.080 174.199 -1.119 1
1 276 . 17 1 1 A 22 22 SER CA C 22 58.547 59.696 -1.149 1
1 277 . 17 1 1 A 22 22 SER CB C 22 63.591 64.554 -0.963 1
1 278 . 17 1 1 A 22 22 SER N N 22 120.109 120.674 -0.565 1
1 279 . 17 1 1 A 23 23 ALA H H 23 7.269 7.105 0.164 1
1 280 . 17 1 1 A 23 23 ALA HA H 23 4.426 4.305 0.121 1
1 284 . 17 1 1 A 23 23 ALA C C 23 176.568 174.059 2.509 1
1 285 . 17 1 1 A 23 23 ALA CA C 23 52.458 51.182 1.276 1
1 286 . 17 1 1 A 23 23 ALA CB C 23 22.728 21.840 0.888 1
1 287 . 17 1 1 A 23 23 ALA N N 23 114.102 118.007 -3.905 1
1 288 . 17 1 1 A 24 24 LEU H H 24 8.819 8.481 0.338 1
1 289 . 17 1 1 A 24 24 LEU HA H 24 4.060 4.462 -0.402 1
1 299 . 17 1 1 A 24 24 LEU C C 24 175.363 176.401 -1.038 1
1 300 . 17 1 1 A 24 24 LEU CA C 24 56.901 53.742 3.159 1
1 301 . 17 1 1 A 24 24 LEU CB C 24 42.065 42.961 -0.896 1
1 305 . 17 1 1 A 24 24 LEU N N 24 120.865 119.779 1.086 1
1 306 . 17 1 1 A 25 25 ARG H H 25 9.473 8.638 0.835 1
1 307 . 17 1 1 A 25 25 ARG HA H 25 4.428 4.040 0.388 1
1 315 . 17 1 1 A 25 25 ARG C C 25 175.729 175.772 -0.043 1
1 316 . 17 1 1 A 25 25 ARG CA C 25 56.721 58.467 -1.746 1
1 317 . 17 1 1 A 25 25 ARG CB C 25 31.109 30.961 0.148 1
1 320 . 17 1 1 A 25 25 ARG N N 25 130.455 127.271 3.184 1
1 322 . 17 1 1 A 26 26 ARG H H 26 7.711 7.283 0.428 1
1 323 . 17 1 1 A 26 26 ARG HA H 26 4.559 4.543 0.016 1
1 330 . 17 1 1 A 26 26 ARG C C 26 173.724 173.552 0.172 1
1 331 . 17 1 1 A 26 26 ARG CA C 26 55.737 55.880 -0.143 1
1 332 . 17 1 1 A 26 26 ARG CB C 26 33.261 33.888 -0.627 1
1 335 . 17 1 1 A 26 26 ARG N N 26 113.305 118.323 -5.018 1
1 336 . 17 1 1 A 27 27 GLU H H 27 8.848 8.672 0.176 1
1 337 . 17 1 1 A 27 27 GLU HA H 27 4.615 4.764 -0.149 1
1 342 . 17 1 1 A 27 27 GLU C C 27 174.836 175.686 -0.850 1
1 343 . 17 1 1 A 27 27 GLU CA C 27 55.901 55.411 0.490 1
1 344 . 17 1 1 A 27 27 GLU CB C 27 30.755 30.670 0.085 1
1 346 . 17 1 1 A 27 27 GLU N N 27 121.934 125.464 -3.530 1
1 347 . 17 1 1 A 28 28 VAL H H 28 8.603 8.260 0.343 1
1 348 . 17 1 1 A 28 28 VAL HA H 28 4.013 4.355 -0.342 1
1 356 . 17 1 1 A 28 28 VAL C C 28 175.561 175.905 -0.344 1
1 357 . 17 1 1 A 28 28 VAL CA C 28 62.791 61.770 1.021 1
1 358 . 17 1 1 A 28 28 VAL CB C 28 32.710 32.087 0.623 1
1 361 . 17 1 1 A 28 28 VAL N N 28 125.545 121.861 3.684 1
1 362 . 17 1 1 A 29 29 ARG H H 29 8.735 8.490 0.245 1
1 363 . 17 1 1 A 29 29 ARG HA H 29 4.774 4.415 0.359 1
1 370 . 17 1 1 A 29 29 ARG C C 29 176.580 176.554 0.026 1
1 371 . 17 1 1 A 29 29 ARG CA C 29 55.481 55.997 -0.516 1
1 372 . 17 1 1 A 29 29 ARG CB C 29 31.963 31.189 0.774 1
1 375 . 17 1 1 A 29 29 ARG N N 29 128.327 126.673 1.654 1
1 376 . 17 1 1 A 30 30 ILE H H 30 8.358 8.429 -0.071 1
1 377 . 17 1 1 A 30 30 ILE HA H 30 3.882 4.166 -0.284 1
1 387 . 17 1 1 A 30 30 ILE C C 30 175.093 175.190 -0.097 1
1 388 . 17 1 1 A 30 30 ILE CA C 30 61.669 61.245 0.424 1
1 389 . 17 1 1 A 30 30 ILE CB C 30 38.806 37.281 1.525 1
1 393 . 17 1 1 A 30 30 ILE N N 30 121.957 122.709 -0.752 1
1 394 . 17 1 1 A 31 31 GLN H H 31 8.560 8.784 -0.224 1
1 395 . 17 1 1 A 31 31 GLN HA H 31 4.647 4.625 0.022 1
1 402 . 17 1 1 A 31 31 GLN C C 31 175.954 175.953 0.001 1
1 403 . 17 1 1 A 31 31 GLN CA C 31 54.833 55.867 -1.034 1
1 404 . 17 1 1 A 31 31 GLN CB C 31 30.584 29.309 1.275 1
1 407 . 17 1 1 A 31 31 GLN N N 31 126.348 128.301 -1.953 1
1 409 . 17 1 1 A 32 32 ASN H H 32 8.994 8.776 0.218 1
1 410 . 17 1 1 A 32 32 ASN HA H 32 4.784 4.680 0.104 1
1 415 . 17 1 1 A 32 32 ASN C C 32 177.296 176.611 0.685 1
1 416 . 17 1 1 A 32 32 ASN CA C 32 53.206 53.624 -0.418 1
1 417 . 17 1 1 A 32 32 ASN CB C 32 39.472 39.118 0.354 1
1 419 . 17 1 1 A 32 32 ASN N N 32 122.834 125.268 -2.434 1
1 421 . 17 1 1 A 33 33 GLU H H 33 9.180 8.879 0.301 1
1 422 . 17 1 1 A 33 33 GLU HA H 33 4.063 4.115 -0.052 1
1 427 . 17 1 1 A 33 33 GLU C C 33 176.787 177.903 -1.116 1
1 428 . 17 1 1 A 33 33 GLU CA C 33 59.347 59.101 0.246 1
1 429 . 17 1 1 A 33 33 GLU CB C 33 29.294 29.267 0.027 1
1 431 . 17 1 1 A 33 33 GLU N N 33 122.736 121.848 0.888 1
1 432 . 17 1 1 A 34 34 ASP H H 34 7.969 7.816 0.153 1
1 433 . 17 1 1 A 34 34 ASP HA H 34 4.499 4.599 -0.100 1
1 436 . 17 1 1 A 34 34 ASP C C 34 177.111 176.073 1.038 1
1 437 . 17 1 1 A 34 34 ASP CA C 34 53.632 54.374 -0.742 1
1 438 . 17 1 1 A 34 34 ASP CB C 34 39.807 40.876 -1.069 1
1 439 . 17 1 1 A 34 34 ASP N N 34 115.921 117.603 -1.682 1
1 440 . 17 1 1 A 35 35 GLY H H 35 8.083 8.047 0.036 1
1 441 . 17 1 1 A 35 35 GLY HA2 H 35 4.366 4.020 0.346 1
1 442 . 17 1 1 A 35 35 GLY HA3 H 35 3.657 4.020 -0.363 1
1 443 . 17 1 1 A 35 35 GLY C C 35 174.584 174.817 -0.233 1
1 444 . 17 1 1 A 35 35 GLY CA C 35 45.134 45.277 -0.143 1
1 445 . 17 1 1 A 35 35 GLY N N 35 108.874 106.296 2.578 1
1 446 . 17 1 1 A 36 36 SER H H 36 8.274 7.969 0.305 1
1 447 . 17 1 1 A 36 36 SER HA H 36 4.389 4.494 -0.105 1
1 450 . 17 1 1 A 36 36 SER C C 36 173.284 173.647 -0.363 1
1 451 . 17 1 1 A 36 36 SER CA C 36 58.383 59.254 -0.871 1
1 452 . 17 1 1 A 36 36 SER CB C 36 64.576 64.650 -0.074 1
1 453 . 17 1 1 A 36 36 SER N N 36 117.428 117.275 0.153 1
1 454 . 17 1 1 A 37 37 VAL H H 37 8.508 8.574 -0.066 1
1 455 . 17 1 1 A 37 37 VAL HA H 37 4.346 4.448 -0.102 1
1 463 . 17 1 1 A 37 37 VAL C C 37 176.370 175.767 0.603 1
1 464 . 17 1 1 A 37 37 VAL CA C 37 62.410 61.428 0.982 1
1 465 . 17 1 1 A 37 37 VAL CB C 37 33.086 33.410 -0.324 1
1 468 . 17 1 1 A 37 37 VAL N N 37 119.189 123.779 -4.590 1
1 469 . 17 1 1 A 38 38 SER H H 38 8.461 8.995 -0.534 1
1 470 . 17 1 1 A 38 38 SER HA H 38 4.586 4.681 -0.095 1
1 473 . 17 1 1 A 38 38 SER C C 38 173.829 174.454 -0.625 1
1 474 . 17 1 1 A 38 38 SER CA C 38 57.618 57.576 0.042 1
1 475 . 17 1 1 A 38 38 SER CB C 38 64.537 64.980 -0.443 1
1 476 . 17 1 1 A 38 38 SER N N 38 121.629 120.862 0.767 1
1 477 . 17 1 1 A 39 39 ASP H H 39 8.512 8.760 -0.248 1
1 478 . 17 1 1 A 39 39 ASP HA H 39 4.606 4.467 0.139 1
1 481 . 17 1 1 A 39 39 ASP C C 39 176.557 176.550 0.007 1
1 482 . 17 1 1 A 39 39 ASP CA C 39 54.833 57.278 -2.445 1
1 483 . 17 1 1 A 39 39 ASP CB C 39 41.123 41.494 -0.371 1
1 484 . 17 1 1 A 39 39 ASP N N 39 120.305 124.533 -4.228 1
1 485 . 17 1 1 A 40 40 GLU H H 40 8.311 7.880 0.431 1
1 486 . 17 1 1 A 40 40 GLU HA H 40 4.235 4.449 -0.214 1
1 491 . 17 1 1 A 40 40 GLU C C 40 175.327 175.909 -0.582 1
1 492 . 17 1 1 A 40 40 GLU CA C 40 56.215 56.853 -0.638 1
1 493 . 17 1 1 A 40 40 GLU CB C 40 30.788 30.487 0.301 1
1 495 . 17 1 1 A 40 40 GLU N N 40 120.680 118.219 2.461 1
1 496 . 17 1 1 A 41 41 ILE H H 41 8.465 8.737 -0.272 1
1 497 . 17 1 1 A 41 41 ILE HA H 41 4.127 4.545 -0.418 1
1 507 . 17 1 1 A 41 41 ILE C C 41 175.380 176.457 -1.077 1
1 508 . 17 1 1 A 41 41 ILE CA C 41 60.670 59.860 0.810 1
1 509 . 17 1 1 A 41 41 ILE CB C 41 38.805 39.990 -1.185 1
1 513 . 17 1 1 A 41 41 ILE N N 41 123.665 122.614 1.051 1
1 514 . 17 1 1 A 42 42 LYS H H 42 9.556 9.338 0.218 1
1 515 . 17 1 1 A 42 42 LYS HA H 42 4.428 4.362 0.066 1
1 524 . 17 1 1 A 42 42 LYS C C 42 177.277 176.251 1.026 1
1 525 . 17 1 1 A 42 42 LYS CA C 42 57.274 57.609 -0.335 1
1 526 . 17 1 1 A 42 42 LYS CB C 42 35.169 33.657 1.512 1
1 530 . 17 1 1 A 42 42 LYS N N 42 125.597 126.639 -1.042 1
1 531 . 17 1 1 A 43 43 GLU H H 43 7.809 7.252 0.557 1
1 532 . 17 1 1 A 43 43 GLU HA H 43 4.886 4.742 0.144 1
1 537 . 17 1 1 A 43 43 GLU C C 43 173.593 173.978 -0.385 1
1 538 . 17 1 1 A 43 43 GLU CA C 43 54.669 55.339 -0.670 1
1 539 . 17 1 1 A 43 43 GLU CB C 43 32.882 33.024 -0.142 1
1 541 . 17 1 1 A 43 43 GLU N N 43 115.292 114.718 0.574 1
1 542 . 17 1 1 A 44 44 ARG H H 44 8.879 9.041 -0.162 1
1 543 . 17 1 1 A 44 44 ARG HA H 44 4.917 5.057 -0.140 1
1 551 . 17 1 1 A 44 44 ARG C C 44 173.708 174.475 -0.767 1
1 552 . 17 1 1 A 44 44 ARG CA C 44 55.965 54.466 1.499 1
1 553 . 17 1 1 A 44 44 ARG CB C 44 33.579 33.139 0.440 1
1 556 . 17 1 1 A 44 44 ARG N N 44 118.233 120.076 -1.843 1
1 558 . 17 1 1 A 45 45 THR H H 45 8.892 9.108 -0.216 1
1 559 . 17 1 1 A 45 45 THR HA H 45 5.308 5.014 0.294 1
1 564 . 17 1 1 A 45 45 THR C C 45 173.357 173.299 0.058 1
1 565 . 17 1 1 A 45 45 THR CA C 45 60.939 62.141 -1.202 1
1 566 . 17 1 1 A 45 45 THR CB C 45 70.054 69.911 0.143 1
1 568 . 17 1 1 A 45 45 THR N N 45 118.457 119.247 -0.790 1
1 569 . 17 1 1 A 46 46 TYR H H 46 9.625 9.651 -0.026 1
1 570 . 17 1 1 A 46 46 TYR HA H 46 4.771 5.113 -0.342 1
1 578 . 17 1 1 A 46 46 TYR C C 46 173.735 174.659 -0.924 1
1 579 . 17 1 1 A 46 46 TYR CA C 46 57.480 56.743 0.737 1
1 580 . 17 1 1 A 46 46 TYR CB C 46 41.724 41.792 -0.068 1
1 585 . 17 1 1 A 46 46 TYR N N 46 125.916 126.447 -0.531 1
1 586 . 17 1 1 A 47 47 ASP H H 47 9.006 8.889 0.117 1
1 587 . 17 1 1 A 47 47 ASP HA H 47 5.399 5.012 0.387 1
1 590 . 17 1 1 A 47 47 ASP C C 47 175.094 175.155 -0.061 1
1 591 . 17 1 1 A 47 47 ASP CA C 47 53.460 53.600 -0.140 1
1 592 . 17 1 1 A 47 47 ASP CB C 47 41.947 41.525 0.422 1
1 593 . 17 1 1 A 47 47 ASP N N 47 122.109 122.219 -0.110 1
1 594 . 17 1 1 A 48 48 LEU H H 48 9.066 8.466 0.600 1
1 595 . 17 1 1 A 48 48 LEU HA H 48 4.831 5.023 -0.192 1
1 605 . 17 1 1 A 48 48 LEU C C 48 174.977 175.620 -0.643 1
1 606 . 17 1 1 A 48 48 LEU CA C 48 52.724 53.391 -0.667 1
1 607 . 17 1 1 A 48 48 LEU CB C 48 44.844 44.277 0.567 1
1 611 . 17 1 1 A 48 48 LEU N N 48 121.879 125.318 -3.439 1
1 612 . 17 1 1 A 49 49 LYS H H 49 9.401 8.300 1.101 1
1 613 . 17 1 1 A 49 49 LYS HA H 49 4.477 4.737 -0.260 1
1 622 . 17 1 1 A 49 49 LYS C C 49 176.225 175.049 1.176 1
1 623 . 17 1 1 A 49 49 LYS CA C 49 56.017 55.490 0.527 1
1 624 . 17 1 1 A 49 49 LYS CB C 49 33.838 33.506 0.332 1
1 628 . 17 1 1 A 49 49 LYS N N 49 122.218 124.179 -1.961 1
1 629 . 17 1 1 A 50 50 SER H H 50 8.266 8.603 -0.337 1
1 630 . 17 1 1 A 50 50 SER HA H 50 5.222 5.139 0.083 1
1 633 . 17 1 1 A 50 50 SER C C 50 175.570 173.585 1.985 1
1 634 . 17 1 1 A 50 50 SER CA C 50 55.770 56.467 -0.697 1
1 635 . 17 1 1 A 50 50 SER CB C 50 64.738 64.574 0.164 1
1 636 . 17 1 1 A 50 50 SER N N 50 117.388 119.538 -2.150 1
1 637 . 17 1 1 A 51 51 LYS H H 51 9.276 8.771 0.505 1
1 638 . 17 1 1 A 51 51 LYS HA H 51 4.208 3.932 0.276 1
1 647 . 17 1 1 A 51 51 LYS C C 51 178.773 177.302 1.471 1
1 648 . 17 1 1 A 51 51 LYS CA C 51 58.674 58.281 0.393 1
1 649 . 17 1 1 A 51 51 LYS CB C 51 33.383 31.992 1.391 1
1 653 . 17 1 1 A 51 51 LYS N N 51 130.550 128.346 2.204 1
1 654 . 17 1 1 A 52 52 GLY H H 52 8.320 8.831 -0.511 1
1 655 . 17 1 1 A 52 52 GLY HA2 H 52 3.875 3.969 -0.094 1
1 656 . 17 1 1 A 52 52 GLY HA3 H 52 3.628 3.975 -0.347 1
1 657 . 17 1 1 A 52 52 GLY C C 52 175.108 175.475 -0.367 1
1 658 . 17 1 1 A 52 52 GLY CA C 52 46.322 45.235 1.087 1
1 659 . 17 1 1 A 52 52 GLY N N 52 107.053 115.729 -8.676 1
1 660 . 17 1 1 A 53 53 GLN H H 53 7.859 7.654 0.205 1
1 661 . 17 1 1 A 53 53 GLN HA H 53 4.409 4.419 -0.010 1
1 668 . 17 1 1 A 53 53 GLN C C 53 176.469 176.627 -0.158 1
1 669 . 17 1 1 A 53 53 GLN CA C 53 54.911 55.395 -0.484 1
1 670 . 17 1 1 A 53 53 GLN CB C 53 29.675 29.836 -0.161 1
1 673 . 17 1 1 A 53 53 GLN N N 53 115.482 119.472 -3.990 1
1 675 . 17 1 1 A 54 54 GLY H H 54 7.992 8.927 -0.935 1
1 676 . 17 1 1 A 54 54 GLY HA2 H 54 3.934 3.897 0.037 1
1 677 . 17 1 1 A 54 54 GLY HA3 H 54 3.934 3.898 0.036 1
1 678 . 17 1 1 A 54 54 GLY C C 54 173.897 173.515 0.382 1
1 679 . 17 1 1 A 54 54 GLY CA C 54 46.574 45.876 0.698 1
1 680 . 17 1 1 A 54 54 GLY N N 54 110.111 110.488 -0.377 1
1 681 . 17 1 1 A 55 55 ARG H H 55 7.652 7.660 -0.008 1
1 682 . 17 1 1 A 55 55 ARG HA H 55 4.665 4.956 -0.291 1
1 690 . 17 1 1 A 55 55 ARG C C 55 174.649 174.623 0.026 1
1 691 . 17 1 1 A 55 55 ARG CA C 55 54.631 54.188 0.443 1
1 692 . 17 1 1 A 55 55 ARG CB C 55 32.166 33.465 -1.299 1
1 695 . 17 1 1 A 55 55 ARG N N 55 114.214 115.842 -1.628 1
1 697 . 17 1 1 A 56 56 MET H H 56 8.593 8.813 -0.220 1
1 698 . 17 1 1 A 56 56 MET HA H 56 5.012 5.222 -0.210 1
1 703 . 17 1 1 A 56 56 MET C C 56 176.216 175.797 0.419 1
1 704 . 17 1 1 A 56 56 MET CA C 56 54.595 53.172 1.423 1
1 705 . 17 1 1 A 56 56 MET CB C 56 33.466 34.976 -1.510 1
1 707 . 17 1 1 A 56 56 MET N N 56 121.270 118.827 2.443 1
1 708 . 17 1 1 A 57 57 ILE H H 57 9.393 8.954 0.439 1
1 709 . 17 1 1 A 57 57 ILE HA H 57 4.717 4.509 0.208 1
1 719 . 17 1 1 A 57 57 ILE C C 57 173.883 174.603 -0.720 1
1 720 . 17 1 1 A 57 57 ILE CA C 57 59.713 59.202 0.511 1
1 721 . 17 1 1 A 57 57 ILE CB C 57 40.933 39.397 1.536 1
1 725 . 17 1 1 A 57 57 ILE N N 57 120.811 116.929 3.882 1
1 726 . 17 1 1 A 58 58 GLN H H 58 8.218 8.076 0.142 1
1 727 . 17 1 1 A 58 58 GLN HA H 58 5.407 4.625 0.782 1
1 734 . 17 1 1 A 58 58 GLN C C 58 175.368 174.591 0.777 1
1 735 . 17 1 1 A 58 58 GLN CA C 58 55.163 55.145 0.018 1
1 736 . 17 1 1 A 58 58 GLN CB C 58 30.841 28.869 1.972 1
1 739 . 17 1 1 A 58 58 GLN N N 58 122.281 122.779 -0.498 1
1 741 . 17 1 1 A 59 59 VAL H H 59 9.188 8.566 0.622 1
1 742 . 17 1 1 A 59 59 VAL HA H 59 5.025 5.111 -0.086 1
1 750 . 17 1 1 A 59 59 VAL C C 59 175.330 174.980 0.350 1
1 751 . 17 1 1 A 59 59 VAL CA C 59 59.975 61.205 -1.230 1
1 752 . 17 1 1 A 59 59 VAL CB C 59 34.818 32.798 2.020 1
1 755 . 17 1 1 A 59 59 VAL N N 59 122.421 126.294 -3.873 1
1 756 . 17 1 1 A 60 60 SER H H 60 9.022 8.949 0.073 1
1 757 . 17 1 1 A 60 60 SER HA H 60 5.811 5.823 -0.012 1
1 760 . 17 1 1 A 60 60 SER C C 60 173.234 174.091 -0.857 1
1 761 . 17 1 1 A 60 60 SER CA C 60 57.634 56.440 1.194 1
1 762 . 17 1 1 A 60 60 SER CB C 60 64.891 64.692 0.199 1
1 763 . 17 1 1 A 60 60 SER N N 60 124.709 121.894 2.815 1
1 764 . 17 1 1 A 61 61 ILE H H 61 9.226 9.040 0.186 1
1 765 . 17 1 1 A 61 61 ILE HA H 61 5.572 4.981 0.591 1
1 775 . 17 1 1 A 61 61 ILE C C 61 173.955 173.832 0.123 1
1 776 . 17 1 1 A 61 61 ILE CA C 61 56.937 57.205 -0.268 1
1 777 . 17 1 1 A 61 61 ILE CB C 61 39.596 40.048 -0.452 1
1 781 . 17 1 1 A 61 61 ILE N N 61 121.648 119.315 2.333 1
1 782 . 17 1 1 A 62 62 PRO HA H 62 4.606 4.516 0.090 1
1 789 . 17 1 1 A 62 62 PRO C C 62 178.143 177.594 0.549 1
1 790 . 17 1 1 A 62 62 PRO CA C 62 63.740 63.044 0.696 1
1 791 . 17 1 1 A 62 62 PRO CB C 62 33.303 32.680 0.623 1
1 794 . 17 1 1 A 63 63 ALA H H 63 7.803 8.662 -0.859 1
1 795 . 17 1 1 A 63 63 ALA HA H 63 4.037 4.093 -0.056 1
1 799 . 17 1 1 A 63 63 ALA C C 63 175.942 179.685 -3.743 1
1 800 . 17 1 1 A 63 63 ALA CA C 63 54.417 55.175 -0.758 1
1 801 . 17 1 1 A 63 63 ALA CB C 63 19.345 17.857 1.488 1
1 802 . 17 1 1 A 63 63 ALA N N 63 123.695 127.864 -4.169 1
1 803 . 17 1 1 A 64 64 SER H H 64 7.719 8.241 -0.522 1
1 804 . 17 1 1 A 64 64 SER HA H 64 4.097 4.159 -0.062 1
1 807 . 17 1 1 A 64 64 SER C C 64 175.199 174.748 0.451 1
1 808 . 17 1 1 A 64 64 SER CA C 64 59.474 61.209 -1.735 1
1 809 . 17 1 1 A 64 64 SER CB C 64 62.125 63.053 -0.928 1
1 810 . 17 1 1 A 64 64 SER N N 64 110.001 111.945 -1.944 1
1 811 . 17 1 1 A 65 65 VAL H H 65 7.790 7.605 0.185 1
1 812 . 17 1 1 A 65 65 VAL HA H 65 4.360 4.129 0.231 1
1 820 . 17 1 1 A 65 65 VAL C C 65 174.433 174.234 0.199 1
1 821 . 17 1 1 A 65 65 VAL CA C 65 60.335 60.930 -0.595 1
1 822 . 17 1 1 A 65 65 VAL CB C 65 32.714 32.282 0.432 1
1 825 . 17 1 1 A 65 65 VAL N N 65 126.142 122.468 3.674 1
1 826 . 17 1 1 A 66 66 PRO HA H 66 4.369 4.500 -0.131 1
1 833 . 17 1 1 A 66 66 PRO C C 66 177.412 176.588 0.824 1
1 834 . 17 1 1 A 66 66 PRO CA C 66 63.104 62.954 0.150 1
1 835 . 17 1 1 A 66 66 PRO CB C 66 32.558 31.877 0.681 1
1 838 . 17 1 1 A 67 67 LEU H H 67 8.578 8.349 0.229 1
1 839 . 17 1 1 A 67 67 LEU HA H 67 3.875 4.340 -0.465 1
1 849 . 17 1 1 A 67 67 LEU C C 67 176.077 176.877 -0.800 1
1 850 . 17 1 1 A 67 67 LEU CA C 67 56.413 55.694 0.719 1
1 851 . 17 1 1 A 67 67 LEU CB C 67 43.279 43.581 -0.302 1
1 855 . 17 1 1 A 67 67 LEU N N 67 124.236 123.801 0.435 1
1 856 . 17 1 1 A 68 68 LYS H H 68 7.994 8.906 -0.912 1
1 857 . 17 1 1 A 68 68 LYS HA H 68 3.793 3.545 0.248 1
1 866 . 17 1 1 A 68 68 LYS C C 68 175.601 176.140 -0.539 1
1 867 . 17 1 1 A 68 68 LYS CA C 68 53.350 58.270 -4.920 1
1 868 . 17 1 1 A 68 68 LYS CB C 68 31.035 32.017 -0.982 1
1 872 . 17 1 1 A 68 68 LYS N N 68 124.053 125.528 -1.475 1
1 873 . 17 1 1 A 69 69 GLU H H 69 8.347 7.761 0.586 1
1 874 . 17 1 1 A 69 69 GLU HA H 69 4.501 3.899 0.602 1
1 879 . 17 1 1 A 69 69 GLU C C 69 175.304 175.532 -0.228 1
1 880 . 17 1 1 A 69 69 GLU CA C 69 54.291 57.375 -3.084 1
1 881 . 17 1 1 A 69 69 GLU CB C 69 29.285 27.485 1.800 1
1 883 . 17 1 1 A 69 69 GLU N N 69 123.876 116.129 7.747 1
1 884 . 17 1 1 A 70 70 PHE H H 70 5.549 7.077 -1.528 1
1 885 . 17 1 1 A 70 70 PHE HA H 70 4.592 4.317 0.275 1
1 893 . 17 1 1 A 70 70 PHE C C 70 174.443 175.325 -0.882 1
1 894 . 17 1 1 A 70 70 PHE CA C 70 53.313 57.736 -4.423 1
1 895 . 17 1 1 A 70 70 PHE CB C 70 38.335 38.870 -0.535 1
1 901 . 17 1 1 A 70 70 PHE N N 70 117.781 118.587 -0.806 1
1 902 . 17 1 1 A 71 71 ASP H H 71 8.791 8.838 -0.047 1
1 903 . 17 1 1 A 71 71 ASP HA H 71 4.535 4.757 -0.222 1
1 906 . 17 1 1 A 71 71 ASP C C 71 175.867 176.212 -0.345 1
1 907 . 17 1 1 A 71 71 ASP CA C 71 54.248 54.755 -0.507 1
1 908 . 17 1 1 A 71 71 ASP CB C 71 41.166 41.230 -0.064 1
1 909 . 17 1 1 A 71 71 ASP N N 71 120.385 122.252 -1.867 1
1 910 . 17 1 1 A 72 72 TYR H H 72 8.701 8.689 0.012 1
1 911 . 17 1 1 A 72 72 TYR HA H 72 4.283 4.531 -0.248 1
1 918 . 17 1 1 A 72 72 TYR C C 72 177.470 176.456 1.014 1
1 919 . 17 1 1 A 72 72 TYR CA C 72 60.513 59.553 0.960 1
1 920 . 17 1 1 A 72 72 TYR CB C 72 38.320 38.406 -0.086 1
1 925 . 17 1 1 A 72 72 TYR N N 72 121.876 123.666 -1.790 1
1 926 . 17 1 1 A 73 73 ASN H H 73 8.819 9.123 -0.304 1
1 927 . 17 1 1 A 73 73 ASN HA H 73 4.096 4.189 -0.093 1
1 932 . 17 1 1 A 73 73 ASN C C 73 174.362 174.532 -0.170 1
1 933 . 17 1 1 A 73 73 ASN CA C 73 54.289 54.362 -0.073 1
1 934 . 17 1 1 A 73 73 ASN CB C 73 36.907 36.903 0.004 1
1 936 . 17 1 1 A 73 73 ASN N N 73 121.726 119.457 2.269 1
1 938 . 17 1 1 A 74 74 ALA H H 74 8.059 7.722 0.337 1
1 939 . 17 1 1 A 74 74 ALA HA H 74 4.100 4.413 -0.313 1
1 943 . 17 1 1 A 74 74 ALA C C 74 177.757 177.354 0.403 1
1 944 . 17 1 1 A 74 74 ALA CA C 74 53.153 52.150 1.003 1
1 945 . 17 1 1 A 74 74 ALA CB C 74 19.412 19.754 -0.342 1
1 946 . 17 1 1 A 74 74 ALA N N 74 122.292 121.500 0.792 1
1 947 . 17 1 1 A 75 75 ARG H H 75 8.500 8.475 0.025 1
1 948 . 17 1 1 A 75 75 ARG HA H 75 4.758 4.777 -0.019 1
1 955 . 17 1 1 A 75 75 ARG C C 75 176.812 175.978 0.834 1
1 956 . 17 1 1 A 75 75 ARG CA C 75 56.646 56.426 0.220 1
1 957 . 17 1 1 A 75 75 ARG CB C 75 29.375 30.569 -1.194 1
1 960 . 17 1 1 A 75 75 ARG N N 75 122.871 121.127 1.744 1
1 961 . 17 1 1 A 76 76 VAL H H 76 7.965 9.137 -1.172 1
1 962 . 17 1 1 A 76 76 VAL HA H 76 5.230 4.893 0.337 1
1 970 . 17 1 1 A 76 76 VAL C C 76 173.758 174.627 -0.869 1
1 971 . 17 1 1 A 76 76 VAL CA C 76 58.193 59.242 -1.049 1
1 972 . 17 1 1 A 76 76 VAL CB C 76 36.536 35.111 1.425 1
1 975 . 17 1 1 A 76 76 VAL N N 76 116.220 118.788 -2.568 1
1 976 . 17 1 1 A 77 77 GLU H H 77 9.166 9.340 -0.174 1
1 977 . 17 1 1 A 77 77 GLU HA H 77 4.663 4.998 -0.335 1
1 982 . 17 1 1 A 77 77 GLU C C 77 174.940 174.783 0.157 1
1 983 . 17 1 1 A 77 77 GLU CA C 77 53.546 54.361 -0.815 1
1 984 . 17 1 1 A 77 77 GLU CB C 77 33.395 33.530 -0.135 1
1 986 . 17 1 1 A 77 77 GLU N N 77 116.413 123.089 -6.676 1
1 987 . 17 1 1 A 78 78 LEU H H 78 8.670 8.878 -0.208 1
1 988 . 17 1 1 A 78 78 LEU HA H 78 4.677 4.661 0.016 1
1 998 . 17 1 1 A 78 78 LEU C C 78 176.036 176.765 -0.729 1
1 999 . 17 1 1 A 78 78 LEU CA C 78 53.091 53.916 -0.825 1
1 1000 . 17 1 1 A 78 78 LEU CB C 78 43.276 42.885 0.391 1
1 1004 . 17 1 1 A 78 78 LEU N N 78 117.927 123.574 -5.647 1
1 1005 . 17 1 1 A 79 79 ILE H H 79 7.900 8.807 -0.907 1
1 1006 . 17 1 1 A 79 79 ILE HA H 79 4.312 4.089 0.223 1
1 1016 . 17 1 1 A 79 79 ILE C C 79 175.179 176.249 -1.070 1
1 1017 . 17 1 1 A 79 79 ILE CA C 79 58.294 63.946 -5.652 1
1 1018 . 17 1 1 A 79 79 ILE CB C 79 36.086 38.320 -2.234 1
1 1022 . 17 1 1 A 79 79 ILE N N 79 121.667 122.777 -1.110 1
1 1023 . 17 1 1 A 80 80 ASN H H 80 9.412 8.288 1.124 1
1 1024 . 17 1 1 A 80 80 ASN HA H 80 4.516 5.160 -0.644 1
1 1029 . 17 1 1 A 80 80 ASN C C 80 170.300 172.432 -2.132 1
1 1030 . 17 1 1 A 80 80 ASN CA C 80 54.198 50.396 3.802 1
1 1031 . 17 1 1 A 80 80 ASN CB C 80 37.450 39.241 -1.791 1
1 1033 . 17 1 1 A 80 80 ASN N N 80 123.831 118.609 5.222 1
1 1035 . 17 1 1 A 81 81 PRO HA H 81 5.185 4.878 0.307 1
1 1042 . 17 1 1 A 81 81 PRO C C 81 176.865 176.460 0.405 1
1 1043 . 17 1 1 A 81 81 PRO CA C 81 62.637 62.194 0.443 1
1 1044 . 17 1 1 A 81 81 PRO CB C 81 32.965 31.982 0.983 1
1 1047 . 17 1 1 A 82 82 ILE H H 82 9.374 8.384 0.990 1
1 1048 . 17 1 1 A 82 82 ILE HA H 82 4.524 5.032 -0.508 1
1 1058 . 17 1 1 A 82 82 ILE C C 82 174.731 174.572 0.159 1
1 1059 . 17 1 1 A 82 82 ILE CA C 82 60.205 58.792 1.413 1
1 1060 . 17 1 1 A 82 82 ILE CB C 82 41.737 41.270 0.467 1
1 1064 . 17 1 1 A 82 82 ILE N N 82 121.658 117.833 3.825 1
1 1065 . 17 1 1 A 83 83 ALA H H 83 8.819 8.809 0.010 1
1 1066 . 17 1 1 A 83 83 ALA HA H 83 4.773 4.543 0.230 1
1 1070 . 17 1 1 A 83 83 ALA C C 83 176.550 176.609 -0.059 1
1 1071 . 17 1 1 A 83 83 ALA CA C 83 52.069 52.468 -0.399 1
1 1072 . 17 1 1 A 83 83 ALA CB C 83 20.374 19.662 0.712 1
1 1073 . 17 1 1 A 83 83 ALA N N 83 127.933 129.147 -1.214 1
1 1074 . 17 1 1 A 84 84 ASP H H 84 8.710 8.249 0.461 1
1 1075 . 17 1 1 A 84 84 ASP HA H 84 4.894 5.301 -0.407 1
1 1078 . 17 1 1 A 84 84 ASP C C 84 175.997 176.961 -0.964 1
1 1079 . 17 1 1 A 84 84 ASP CA C 84 53.334 52.984 0.350 1
1 1080 . 17 1 1 A 84 84 ASP CB C 84 42.104 44.201 -2.097 1
1 1081 . 17 1 1 A 84 84 ASP N N 84 122.009 121.895 0.114 1
1 1082 . 17 1 1 A 85 85 THR H H 85 8.349 8.858 -0.509 1
1 1083 . 17 1 1 A 85 85 THR HA H 85 4.420 4.456 -0.036 1
1 1088 . 17 1 1 A 85 85 THR C C 85 175.085 176.300 -1.215 1
1 1089 . 17 1 1 A 85 85 THR CA C 85 62.304 63.408 -1.104 1
1 1090 . 17 1 1 A 85 85 THR CB C 85 69.718 68.780 0.938 1
1 1092 . 17 1 1 A 85 85 THR N N 85 114.986 119.023 -4.037 1
1 1093 . 17 1 1 A 86 86 VAL H H 86 8.188 7.700 0.488 1
1 1094 . 17 1 1 A 86 86 VAL HA H 86 4.021 3.717 0.304 1
1 1102 . 17 1 1 A 86 86 VAL C C 86 176.519 177.184 -0.665 1
1 1103 . 17 1 1 A 86 86 VAL CA C 86 63.046 64.938 -1.892 1
1 1104 . 17 1 1 A 86 86 VAL CB C 86 32.526 31.253 1.273 1
1 1107 . 17 1 1 A 86 86 VAL N N 86 122.275 121.942 0.333 1
1 1108 . 17 1 1 A 87 87 ALA H H 87 8.194 8.159 0.035 1
1 1109 . 17 1 1 A 87 87 ALA HA H 87 4.212 4.122 0.090 1
1 1113 . 17 1 1 A 87 87 ALA C C 87 178.118 179.910 -1.792 1
1 1114 . 17 1 1 A 87 87 ALA CA C 87 53.153 55.363 -2.210 1
1 1115 . 17 1 1 A 87 87 ALA CB C 87 19.165 18.741 0.424 1
1 1116 . 17 1 1 A 87 87 ALA N N 87 126.609 123.848 2.761 1
1 1117 . 17 1 1 A 88 88 THR H H 88 7.914 8.384 -0.470 1
1 1118 . 17 1 1 A 88 88 THR HA H 88 4.173 4.392 -0.219 1
1 1123 . 17 1 1 A 88 88 THR C C 88 174.516 177.254 -2.738 1
1 1124 . 17 1 1 A 88 88 THR CA C 88 62.785 65.026 -2.241 1
1 1125 . 17 1 1 A 88 88 THR CB C 88 69.582 68.416 1.166 1
1 1127 . 17 1 1 A 88 88 THR N N 88 112.328 111.312 1.016 1
1 1128 . 17 1 1 A 89 89 ALA H H 89 8.076 7.894 0.182 1
1 1129 . 17 1 1 A 89 89 ALA HA H 89 4.320 4.127 0.193 1
1 1133 . 17 1 1 A 89 89 ALA C C 89 178.014 179.287 -1.273 1
1 1134 . 17 1 1 A 89 89 ALA CA C 89 53.079 55.279 -2.200 1
1 1135 . 17 1 1 A 89 89 ALA CB C 89 19.335 18.260 1.075 1
1 1136 . 17 1 1 A 89 89 ALA N N 89 124.632 125.165 -0.533 1
1 1137 . 17 1 1 A 90 90 THR H H 90 7.976 7.873 0.103 1
1 1138 . 17 1 1 A 90 90 THR HA H 90 4.203 4.452 -0.249 1
1 1143 . 17 1 1 A 90 90 THR C C 90 174.427 174.603 -0.176 1
1 1144 . 17 1 1 A 90 90 THR CA C 90 62.519 64.144 -1.625 1
1 1145 . 17 1 1 A 90 90 THR CB C 90 69.721 70.359 -0.638 1
1 1147 . 17 1 1 A 90 90 THR N N 90 112.047 111.666 0.381 1
1 1148 . 17 1 1 A 91 91 TYR H H 91 7.959 8.289 -0.330 1
1 1149 . 17 1 1 A 91 91 TYR HA H 91 4.564 4.659 -0.095 1
1 1156 . 17 1 1 A 91 91 TYR C C 91 175.522 175.228 0.294 1
1 1157 . 17 1 1 A 91 91 TYR CA C 91 57.874 58.154 -0.280 1
1 1158 . 17 1 1 A 91 91 TYR CB C 91 38.584 38.058 0.526 1
1 1163 . 17 1 1 A 91 91 TYR N N 91 121.184 119.972 1.212 1
1 1164 . 17 1 1 A 92 92 GLN H H 92 8.310 8.750 -0.440 1
1 1165 . 17 1 1 A 92 92 GLN HA H 92 4.258 4.057 0.201 1
1 1172 . 17 1 1 A 92 92 GLN C C 92 176.099 176.371 -0.272 1
1 1173 . 17 1 1 A 92 92 GLN CA C 92 56.109 57.763 -1.654 1
1 1174 . 17 1 1 A 92 92 GLN CB C 92 29.112 28.579 0.533 1
1 1177 . 17 1 1 A 92 92 GLN N N 92 121.631 125.400 -3.769 1
1 1179 . 17 1 1 A 93 93 GLY H H 93 8.052 8.722 -0.670 1
1 1180 . 17 1 1 A 93 93 GLY HA2 H 93 4.023 3.872 0.151 1
1 1181 . 17 1 1 A 93 93 GLY HA3 H 93 3.856 3.879 -0.023 1
1 1182 . 17 1 1 A 93 93 GLY C C 93 173.791 173.485 0.306 1
1 1183 . 17 1 1 A 93 93 GLY CA C 93 45.382 47.170 -1.788 1
1 1184 . 17 1 1 A 93 93 GLY N N 93 109.847 115.104 -5.257 1
1 1185 . 17 1 1 A 94 94 ALA H H 94 8.162 8.133 0.029 1
1 1186 . 17 1 1 A 94 94 ALA HA H 94 4.329 5.096 -0.767 1
1 1190 . 17 1 1 A 94 94 ALA C C 94 177.392 175.633 1.759 1
1 1191 . 17 1 1 A 94 94 ALA CA C 94 52.558 51.314 1.244 1
1 1192 . 17 1 1 A 94 94 ALA CB C 94 19.526 23.068 -3.542 1
1 1193 . 17 1 1 A 94 94 ALA N N 94 123.424 124.858 -1.434 1
1 1194 . 17 1 1 A 95 95 ASP H H 95 8.457 8.713 -0.256 1
1 1195 . 17 1 1 A 95 95 ASP HA H 95 4.608 5.009 -0.401 1
1 1198 . 17 1 1 A 95 95 ASP C C 95 175.630 175.693 -0.063 1
1 1199 . 17 1 1 A 95 95 ASP CA C 95 54.450 53.507 0.943 1
1 1200 . 17 1 1 A 95 95 ASP CB C 95 40.871 41.231 -0.360 1
1 1201 . 17 1 1 A 95 95 ASP N N 95 118.814 123.261 -4.447 1
1 1202 . 17 1 1 A 96 96 VAL H H 96 7.776 8.254 -0.478 1
1 1203 . 17 1 1 A 96 96 VAL HA H 96 4.141 3.709 0.432 1
1 1211 . 17 1 1 A 96 96 VAL C C 96 175.301 174.845 0.456 1
1 1212 . 17 1 1 A 96 96 VAL CA C 96 61.435 65.629 -4.194 1
1 1213 . 17 1 1 A 96 96 VAL CB C 96 33.517 29.645 3.872 1
1 1216 . 17 1 1 A 96 96 VAL N N 96 118.395 114.640 3.755 1
1 1217 . 17 1 1 A 97 97 ASP H H 97 8.315 8.183 0.132 1
1 1218 . 17 1 1 A 97 97 ASP HA H 97 4.681 4.934 -0.253 1
1 1221 . 17 1 1 A 97 97 ASP C C 97 175.151 175.711 -0.560 1
1 1222 . 17 1 1 A 97 97 ASP CA C 97 54.324 53.516 0.808 1
1 1223 . 17 1 1 A 97 97 ASP CB C 97 41.963 42.249 -0.286 1
1 1224 . 17 1 1 A 97 97 ASP N N 97 123.905 119.635 4.270 1
1 1225 . 17 1 1 A 98 98 TRP H H 98 8.210 8.684 -0.474 1
1 1226 . 17 1 1 A 98 98 TRP HA H 98 4.916 5.333 -0.417 1
1 1235 . 17 1 1 A 98 98 TRP C C 98 174.585 172.674 1.911 1
1 1236 . 17 1 1 A 98 98 TRP CA C 98 56.164 55.037 1.127 1
1 1237 . 17 1 1 A 98 98 TRP CB C 98 31.466 32.103 -0.637 1
1 1243 . 17 1 1 A 98 98 TRP N N 98 120.340 117.826 2.514 1
1 1245 . 17 1 1 A 99 99 TYR H H 99 8.760 8.994 -0.234 1
1 1246 . 17 1 1 A 99 99 TYR HA H 99 5.119 5.146 -0.027 1
1 1253 . 17 1 1 A 99 99 TYR C C 99 174.599 174.796 -0.197 1
1 1254 . 17 1 1 A 99 99 TYR CA C 99 57.021 56.264 0.757 1
1 1255 . 17 1 1 A 99 99 TYR CB C 99 39.526 40.437 -0.911 1
1 1260 . 17 1 1 A 99 99 TYR N N 99 123.319 118.314 5.005 1
1 1261 . 17 1 1 A 100 100 ILE H H 100 8.936 9.416 -0.480 1
1 1262 . 17 1 1 A 100 100 ILE HA H 100 4.850 4.760 0.090 1
1 1272 . 17 1 1 A 100 100 ILE C C 100 175.070 174.586 0.484 1
1 1273 . 17 1 1 A 100 100 ILE CA C 100 58.998 60.171 -1.173 1
1 1274 . 17 1 1 A 100 100 ILE CB C 100 40.667 40.736 -0.069 1
1 1278 . 17 1 1 A 100 100 ILE N N 100 123.281 123.295 -0.014 1
1 1279 . 17 1 1 A 101 101 LYS H H 101 8.987 8.925 0.062 1
1 1280 . 17 1 1 A 101 101 LYS HA H 101 5.313 5.083 0.230 1
1 1289 . 17 1 1 A 101 101 LYS C C 101 174.440 175.781 -1.341 1
1 1290 . 17 1 1 A 101 101 LYS CA C 101 54.763 55.295 -0.532 1
1 1291 . 17 1 1 A 101 101 LYS CB C 101 34.880 34.122 0.758 1
1 1295 . 17 1 1 A 101 101 LYS N N 101 126.210 127.158 -0.948 1
1 1296 . 17 1 1 A 102 102 ALA H H 102 8.531 8.318 0.213 1
1 1297 . 17 1 1 A 102 102 ALA HA H 102 4.957 4.880 0.077 1
1 1301 . 17 1 1 A 102 102 ALA C C 102 175.024 177.775 -2.751 1
1 1302 . 17 1 1 A 102 102 ALA CA C 102 50.701 49.853 0.848 1
1 1303 . 17 1 1 A 102 102 ALA CB C 102 21.618 22.782 -1.164 1
1 1304 . 17 1 1 A 102 102 ALA N N 102 121.424 126.850 -5.426 1
1 1305 . 17 1 1 A 103 103 ASP H H 103 8.339 8.948 -0.609 1
1 1306 . 17 1 1 A 103 103 ASP HA H 103 4.603 4.518 0.085 1
1 1309 . 17 1 1 A 103 103 ASP C C 103 176.188 175.263 0.925 1
1 1310 . 17 1 1 A 103 103 ASP CA C 103 56.049 56.299 -0.250 1
1 1311 . 17 1 1 A 103 103 ASP CB C 103 40.932 41.874 -0.942 1
1 1312 . 17 1 1 A 103 103 ASP N N 103 117.773 119.421 -1.648 1
1 1313 . 17 1 1 A 104 104 ASP H H 104 7.482 7.699 -0.217 1
1 1314 . 17 1 1 A 104 104 ASP HA H 104 4.727 4.884 -0.157 1
1 1317 . 17 1 1 A 104 104 ASP C C 104 174.261 173.695 0.566 1
1 1318 . 17 1 1 A 104 104 ASP CA C 104 52.768 53.917 -1.149 1
1 1319 . 17 1 1 A 104 104 ASP CB C 104 42.587 43.824 -1.237 1
1 1320 . 17 1 1 A 104 104 ASP N N 104 110.673 116.678 -6.005 1
1 1321 . 17 1 1 A 105 105 ILE H H 105 9.267 8.485 0.782 1
1 1322 . 17 1 1 A 105 105 ILE HA H 105 4.631 4.888 -0.257 1
1 1332 . 17 1 1 A 105 105 ILE C C 105 173.922 175.533 -1.611 1
1 1333 . 17 1 1 A 105 105 ILE CA C 105 61.114 60.201 0.913 1
1 1334 . 17 1 1 A 105 105 ILE CB C 105 42.522 40.340 2.182 1
1 1338 . 17 1 1 A 105 105 ILE N N 105 121.380 123.007 -1.627 1
1 1339 . 17 1 1 A 106 106 VAL H H 106 8.592 9.125 -0.533 1
1 1340 . 17 1 1 A 106 106 VAL HA H 106 4.975 5.083 -0.108 1
1 1348 . 17 1 1 A 106 106 VAL C C 106 175.049 174.860 0.189 1
1 1349 . 17 1 1 A 106 106 VAL CA C 106 58.028 59.195 -1.167 1
1 1350 . 17 1 1 A 106 106 VAL CB C 106 35.388 35.488 -0.100 1
1 1353 . 17 1 1 A 106 106 VAL N N 106 116.356 121.204 -4.848 1
1 1354 . 17 1 1 A 107 107 LEU H H 107 8.360 8.250 0.110 1
1 1355 . 17 1 1 A 107 107 LEU HA H 107 4.167 4.083 0.084 1
1 1365 . 17 1 1 A 107 107 LEU C C 107 178.338 177.275 1.063 1
1 1366 . 17 1 1 A 107 107 LEU CA C 107 55.077 54.393 0.684 1
1 1367 . 17 1 1 A 107 107 LEU CB C 107 42.394 41.665 0.729 1
1 1371 . 17 1 1 A 107 107 LEU N N 107 121.368 122.782 -1.414 1
1 1372 . 17 1 1 A 108 108 THR H H 108 7.977 8.704 -0.727 1
1 1373 . 17 1 1 A 108 108 THR HA H 108 4.039 4.368 -0.329 1
1 1378 . 17 1 1 A 108 108 THR C C 108 174.725 175.072 -0.347 1
1 1379 . 17 1 1 A 108 108 THR CA C 108 63.513 63.506 0.007 1
1 1380 . 17 1 1 A 108 108 THR CB C 108 69.194 69.251 -0.057 1
1 1382 . 17 1 1 A 108 108 THR N N 108 118.728 119.324 -0.596 1
1 1383 . 17 1 1 A 109 109 LEU H H 109 8.378 8.920 -0.542 1
1 1384 . 17 1 1 A 109 109 LEU HA H 109 4.274 4.245 0.029 1
1 1394 . 17 1 1 A 109 109 LEU C C 109 177.058 176.138 0.920 1
1 1395 . 17 1 1 A 109 109 LEU CA C 109 55.045 54.740 0.305 1
1 1396 . 17 1 1 A 109 109 LEU CB C 109 42.620 42.099 0.521 1
1 1400 . 17 1 1 A 109 109 LEU N N 109 124.847 125.640 -0.793 1
1 9 . 18 1 1 A 2 2 MET HA H 2 4.554 4.719 -0.165 1
1 14 . 18 1 1 A 2 2 MET C C 2 174.749 173.294 1.455 1
1 15 . 18 1 1 A 2 2 MET CA C 2 55.354 54.313 1.041 1
1 16 . 18 1 1 A 2 2 MET CB C 2 33.729 34.879 -1.150 1
1 18 . 18 1 1 A 3 3 ARG H H 3 8.518 8.823 -0.305 1
1 19 . 18 1 1 A 3 3 ARG HA H 3 4.531 4.865 -0.334 1
1 26 . 18 1 1 A 3 3 ARG C C 3 175.780 174.811 0.969 1
1 27 . 18 1 1 A 3 3 ARG CA C 3 55.854 54.769 1.085 1
1 28 . 18 1 1 A 3 3 ARG CB C 3 31.403 32.194 -0.791 1
1 31 . 18 1 1 A 3 3 ARG N N 3 124.008 122.551 1.457 1
1 32 . 18 1 1 A 4 4 LEU H H 4 8.424 9.003 -0.579 1
1 33 . 18 1 1 A 4 4 LEU HA H 4 4.457 4.540 -0.083 1
1 43 . 18 1 1 A 4 4 LEU C C 4 177.362 175.830 1.532 1
1 44 . 18 1 1 A 4 4 LEU CA C 4 54.511 54.442 0.069 1
1 45 . 18 1 1 A 4 4 LEU CB C 4 42.686 42.139 0.547 1
1 49 . 18 1 1 A 4 4 LEU N N 4 124.389 128.514 -4.125 1
1 50 . 18 1 1 A 5 5 ALA H H 5 8.418 8.933 -0.515 1
1 51 . 18 1 1 A 5 5 ALA HA H 5 4.254 4.939 -0.685 1
1 55 . 18 1 1 A 5 5 ALA C C 5 177.420 176.651 0.769 1
1 56 . 18 1 1 A 5 5 ALA CA C 5 52.931 50.579 2.352 1
1 57 . 18 1 1 A 5 5 ALA CB C 5 19.263 19.867 -0.604 1
1 58 . 18 1 1 A 5 5 ALA N N 5 124.548 128.170 -3.622 1
1 59 . 18 1 1 A 6 6 ASN H H 6 8.287 8.952 -0.665 1
1 60 . 18 1 1 A 6 6 ASN HA H 6 4.616 5.601 -0.985 1
1 65 . 18 1 1 A 6 6 ASN C C 6 175.837 174.883 0.954 1
1 66 . 18 1 1 A 6 6 ASN CA C 6 53.345 51.346 1.999 1
1 67 . 18 1 1 A 6 6 ASN CB C 6 38.571 41.751 -3.180 1
1 69 . 18 1 1 A 6 6 ASN N N 6 116.484 121.703 -5.219 1
1 71 . 18 1 1 A 7 7 GLY H H 7 8.351 8.367 -0.016 1
1 72 . 18 1 1 A 7 7 GLY HA2 H 7 4.130 4.205 -0.075 1
1 73 . 18 1 1 A 7 7 GLY HA3 H 7 3.808 4.207 -0.399 1
1 74 . 18 1 1 A 7 7 GLY C C 7 173.750 172.430 1.320 1
1 75 . 18 1 1 A 7 7 GLY CA C 7 45.343 46.129 -0.786 1
1 76 . 18 1 1 A 7 7 GLY N N 7 108.453 106.556 1.897 1
1 77 . 18 1 1 A 8 8 ILE H H 8 7.868 8.382 -0.514 1
1 78 . 18 1 1 A 8 8 ILE HA H 8 4.130 4.823 -0.693 1
1 88 . 18 1 1 A 8 8 ILE C C 8 175.570 174.295 1.275 1
1 89 . 18 1 1 A 8 8 ILE CA C 8 61.095 58.659 2.436 1
1 90 . 18 1 1 A 8 8 ILE CB C 8 38.694 40.985 -2.291 1
1 94 . 18 1 1 A 8 8 ILE N N 8 120.848 119.643 1.205 1
1 95 . 18 1 1 A 9 9 VAL H H 9 8.220 8.688 -0.468 1
1 96 . 18 1 1 A 9 9 VAL HA H 9 4.172 4.691 -0.519 1
1 104 . 18 1 1 A 9 9 VAL C C 9 175.898 174.465 1.433 1
1 105 . 18 1 1 A 9 9 VAL CA C 9 62.488 60.425 2.063 1
1 106 . 18 1 1 A 9 9 VAL CB C 9 32.460 34.929 -2.469 1
1 109 . 18 1 1 A 9 9 VAL N N 9 125.805 120.838 4.967 1
1 110 . 18 1 1 A 10 10 LEU H H 10 8.437 8.831 -0.394 1
1 111 . 18 1 1 A 10 10 LEU HA H 10 4.347 5.081 -0.734 1
1 121 . 18 1 1 A 10 10 LEU C C 10 176.398 175.578 0.820 1
1 122 . 18 1 1 A 10 10 LEU CA C 10 54.787 52.695 2.092 1
1 123 . 18 1 1 A 10 10 LEU CB C 10 42.639 44.643 -2.004 1
1 127 . 18 1 1 A 10 10 LEU N N 10 127.757 125.346 2.411 1
1 128 . 18 1 1 A 11 11 ASP H H 11 8.506 8.548 -0.042 1
1 129 . 18 1 1 A 11 11 ASP HA H 11 4.683 4.680 0.003 1
1 132 . 18 1 1 A 11 11 ASP C C 11 176.672 176.156 0.516 1
1 133 . 18 1 1 A 11 11 ASP CA C 11 53.586 54.388 -0.802 1
1 134 . 18 1 1 A 11 11 ASP CB C 11 41.123 40.653 0.470 1
1 135 . 18 1 1 A 11 11 ASP N N 11 121.539 119.697 1.842 1
1 136 . 18 1 1 A 12 12 LYS H H 12 8.578 8.630 -0.052 1
1 137 . 18 1 1 A 12 12 LYS HA H 12 3.943 4.839 -0.896 1
1 146 . 18 1 1 A 12 12 LYS C C 12 176.917 175.686 1.231 1
1 147 . 18 1 1 A 12 12 LYS CA C 12 58.542 54.399 4.143 1
1 148 . 18 1 1 A 12 12 LYS CB C 12 32.703 36.096 -3.393 1
1 152 . 18 1 1 A 12 12 LYS N N 12 123.635 123.011 0.624 1
1 153 . 18 1 1 A 13 13 ASP H H 13 8.523 8.786 -0.263 1
1 154 . 18 1 1 A 13 13 ASP HA H 13 4.566 4.676 -0.110 1
1 157 . 18 1 1 A 13 13 ASP C C 13 177.535 176.052 1.483 1
1 158 . 18 1 1 A 13 13 ASP CA C 13 56.034 54.968 1.066 1
1 159 . 18 1 1 A 13 13 ASP CB C 13 41.051 40.744 0.307 1
1 160 . 18 1 1 A 13 13 ASP N N 13 120.448 119.955 0.493 1
1 161 . 18 1 1 A 14 14 THR H H 14 7.964 9.012 -1.048 1
1 162 . 18 1 1 A 14 14 THR HA H 14 4.146 4.242 -0.096 1
1 167 . 18 1 1 A 14 14 THR C C 14 175.440 174.472 0.968 1
1 168 . 18 1 1 A 14 14 THR CA C 14 63.245 65.565 -2.320 1
1 169 . 18 1 1 A 14 14 THR CB C 14 69.092 69.374 -0.282 1
1 171 . 18 1 1 A 14 14 THR N N 14 113.711 120.865 -7.154 1
1 172 . 18 1 1 A 15 15 THR H H 15 7.921 7.923 -0.002 1
1 173 . 18 1 1 A 15 15 THR HA H 15 3.920 3.784 0.136 1
1 178 . 18 1 1 A 15 15 THR C C 15 174.750 175.368 -0.618 1
1 179 . 18 1 1 A 15 15 THR CA C 15 64.562 65.715 -1.153 1
1 180 . 18 1 1 A 15 15 THR CB C 15 69.166 66.709 2.457 1
1 182 . 18 1 1 A 15 15 THR N N 15 116.710 114.575 2.135 1
1 183 . 18 1 1 A 16 16 PHE H H 16 8.191 8.352 -0.161 1
1 184 . 18 1 1 A 16 16 PHE HA H 16 4.628 4.207 0.421 1
1 192 . 18 1 1 A 16 16 PHE C C 16 177.754 176.491 1.263 1
1 193 . 18 1 1 A 16 16 PHE CA C 16 57.975 60.226 -2.251 1
1 194 . 18 1 1 A 16 16 PHE CB C 16 39.553 38.367 1.186 1
1 200 . 18 1 1 A 16 16 PHE N N 16 117.124 119.968 -2.844 1
1 201 . 18 1 1 A 17 17 GLY H H 17 8.110 7.984 0.126 1
1 202 . 18 1 1 A 17 17 GLY HA2 H 17 4.017 3.960 0.057 1
1 203 . 18 1 1 A 17 17 GLY HA3 H 17 3.849 3.962 -0.113 1
1 204 . 18 1 1 A 17 17 GLY C C 17 172.231 174.196 -1.965 1
1 205 . 18 1 1 A 17 17 GLY CA C 17 45.633 47.384 -1.751 1
1 206 . 18 1 1 A 17 17 GLY N N 17 109.951 107.273 2.678 1
1 207 . 18 1 1 A 18 18 GLU H H 18 8.304 8.608 -0.304 1
1 208 . 18 1 1 A 18 18 GLU HA H 18 4.078 4.633 -0.555 1
1 213 . 18 1 1 A 18 18 GLU C C 18 175.588 176.076 -0.488 1
1 214 . 18 1 1 A 18 18 GLU CA C 18 57.446 55.789 1.657 1
1 215 . 18 1 1 A 18 18 GLU CB C 18 30.767 29.916 0.851 1
1 217 . 18 1 1 A 18 18 GLU N N 18 121.640 124.923 -3.283 1
1 218 . 18 1 1 A 19 19 LEU H H 19 8.799 9.157 -0.358 1
1 219 . 18 1 1 A 19 19 LEU HA H 19 5.416 4.728 0.688 1
1 229 . 18 1 1 A 19 19 LEU C C 19 176.875 176.418 0.457 1
1 230 . 18 1 1 A 19 19 LEU CA C 19 53.281 53.831 -0.550 1
1 231 . 18 1 1 A 19 19 LEU CB C 19 45.508 42.767 2.741 1
1 235 . 18 1 1 A 19 19 LEU N N 19 127.101 126.880 0.221 1
1 236 . 18 1 1 A 20 20 LYS H H 20 8.494 8.602 -0.108 1
1 237 . 18 1 1 A 20 20 LYS HA H 20 5.200 4.835 0.365 1
1 246 . 18 1 1 A 20 20 LYS C C 20 176.163 174.991 1.172 1
1 247 . 18 1 1 A 20 20 LYS CA C 20 53.575 55.181 -1.606 1
1 248 . 18 1 1 A 20 20 LYS CB C 20 36.835 33.270 3.565 1
1 252 . 18 1 1 A 20 20 LYS N N 20 118.828 121.493 -2.665 1
1 253 . 18 1 1 A 21 21 PHE H H 21 9.658 8.848 0.810 1
1 254 . 18 1 1 A 21 21 PHE HA H 21 4.038 4.595 -0.557 1
1 262 . 18 1 1 A 21 21 PHE C C 21 174.296 175.409 -1.113 1
1 263 . 18 1 1 A 21 21 PHE CA C 21 60.462 56.770 3.692 1
1 264 . 18 1 1 A 21 21 PHE CB C 21 40.359 39.313 1.046 1
1 270 . 18 1 1 A 21 21 PHE N N 21 124.322 126.978 -2.656 1
1 271 . 18 1 1 A 22 22 SER H H 22 7.199 8.284 -1.085 1
1 272 . 18 1 1 A 22 22 SER HA H 22 5.046 3.801 1.245 1
1 275 . 18 1 1 A 22 22 SER C C 22 173.080 174.044 -0.964 1
1 276 . 18 1 1 A 22 22 SER CA C 22 58.547 58.341 0.206 1
1 277 . 18 1 1 A 22 22 SER CB C 22 63.591 63.023 0.568 1
1 278 . 18 1 1 A 22 22 SER N N 22 120.109 120.822 -0.713 1
1 279 . 18 1 1 A 23 23 ALA H H 23 7.269 7.059 0.210 1
1 280 . 18 1 1 A 23 23 ALA HA H 23 4.426 4.300 0.126 1
1 284 . 18 1 1 A 23 23 ALA C C 23 176.568 174.495 2.073 1
1 285 . 18 1 1 A 23 23 ALA CA C 23 52.458 51.257 1.201 1
1 286 . 18 1 1 A 23 23 ALA CB C 23 22.728 22.457 0.271 1
1 287 . 18 1 1 A 23 23 ALA N N 23 114.102 119.528 -5.426 1
1 288 . 18 1 1 A 24 24 LEU H H 24 8.819 8.641 0.178 1
1 289 . 18 1 1 A 24 24 LEU HA H 24 4.060 4.620 -0.560 1
1 299 . 18 1 1 A 24 24 LEU C C 24 175.363 176.696 -1.333 1
1 300 . 18 1 1 A 24 24 LEU CA C 24 56.901 54.470 2.431 1
1 301 . 18 1 1 A 24 24 LEU CB C 24 42.065 42.156 -0.091 1
1 305 . 18 1 1 A 24 24 LEU N N 24 120.865 120.860 0.005 1
1 306 . 18 1 1 A 25 25 ARG H H 25 9.473 8.993 0.480 1
1 307 . 18 1 1 A 25 25 ARG HA H 25 4.428 4.140 0.288 1
1 315 . 18 1 1 A 25 25 ARG C C 25 175.729 175.599 0.130 1
1 316 . 18 1 1 A 25 25 ARG CA C 25 56.721 58.006 -1.285 1
1 317 . 18 1 1 A 25 25 ARG CB C 25 31.109 31.195 -0.086 1
1 320 . 18 1 1 A 25 25 ARG N N 25 130.455 128.080 2.375 1
1 322 . 18 1 1 A 26 26 ARG H H 26 7.711 7.191 0.520 1
1 323 . 18 1 1 A 26 26 ARG HA H 26 4.559 4.661 -0.102 1
1 330 . 18 1 1 A 26 26 ARG C C 26 173.724 173.536 0.188 1
1 331 . 18 1 1 A 26 26 ARG CA C 26 55.737 55.664 0.073 1
1 332 . 18 1 1 A 26 26 ARG CB C 26 33.261 33.945 -0.684 1
1 335 . 18 1 1 A 26 26 ARG N N 26 113.305 118.334 -5.029 1
1 336 . 18 1 1 A 27 27 GLU H H 27 8.848 8.655 0.193 1
1 337 . 18 1 1 A 27 27 GLU HA H 27 4.615 4.875 -0.260 1
1 342 . 18 1 1 A 27 27 GLU C C 27 174.836 175.833 -0.997 1
1 343 . 18 1 1 A 27 27 GLU CA C 27 55.901 55.152 0.749 1
1 344 . 18 1 1 A 27 27 GLU CB C 27 30.755 30.508 0.247 1
1 346 . 18 1 1 A 27 27 GLU N N 27 121.934 124.587 -2.653 1
1 347 . 18 1 1 A 28 28 VAL H H 28 8.603 8.149 0.454 1
1 348 . 18 1 1 A 28 28 VAL HA H 28 4.013 4.136 -0.123 1
1 356 . 18 1 1 A 28 28 VAL C C 28 175.561 175.909 -0.348 1
1 357 . 18 1 1 A 28 28 VAL CA C 28 62.791 61.804 0.987 1
1 358 . 18 1 1 A 28 28 VAL CB C 28 32.710 32.036 0.674 1
1 361 . 18 1 1 A 28 28 VAL N N 28 125.545 123.116 2.429 1
1 362 . 18 1 1 A 29 29 ARG H H 29 8.735 8.501 0.234 1
1 363 . 18 1 1 A 29 29 ARG HA H 29 4.774 4.685 0.089 1
1 370 . 18 1 1 A 29 29 ARG C C 29 176.580 176.310 0.270 1
1 371 . 18 1 1 A 29 29 ARG CA C 29 55.481 54.102 1.379 1
1 372 . 18 1 1 A 29 29 ARG CB C 29 31.963 31.660 0.303 1
1 375 . 18 1 1 A 29 29 ARG N N 29 128.327 125.683 2.644 1
1 376 . 18 1 1 A 30 30 ILE H H 30 8.358 8.534 -0.176 1
1 377 . 18 1 1 A 30 30 ILE HA H 30 3.882 4.040 -0.158 1
1 387 . 18 1 1 A 30 30 ILE C C 30 175.093 175.333 -0.240 1
1 388 . 18 1 1 A 30 30 ILE CA C 30 61.669 61.422 0.247 1
1 389 . 18 1 1 A 30 30 ILE CB C 30 38.806 37.108 1.698 1
1 393 . 18 1 1 A 30 30 ILE N N 30 121.957 121.493 0.464 1
1 394 . 18 1 1 A 31 31 GLN H H 31 8.560 8.779 -0.219 1
1 395 . 18 1 1 A 31 31 GLN HA H 31 4.647 4.677 -0.030 1
1 402 . 18 1 1 A 31 31 GLN C C 31 175.954 175.904 0.050 1
1 403 . 18 1 1 A 31 31 GLN CA C 31 54.833 55.327 -0.494 1
1 404 . 18 1 1 A 31 31 GLN CB C 31 30.584 29.881 0.703 1
1 407 . 18 1 1 A 31 31 GLN N N 31 126.348 128.189 -1.841 1
1 409 . 18 1 1 A 32 32 ASN H H 32 8.994 9.063 -0.069 1
1 410 . 18 1 1 A 32 32 ASN HA H 32 4.784 4.824 -0.040 1
1 415 . 18 1 1 A 32 32 ASN C C 32 177.296 176.808 0.488 1
1 416 . 18 1 1 A 32 32 ASN CA C 32 53.206 53.214 -0.008 1
1 417 . 18 1 1 A 32 32 ASN CB C 32 39.472 39.701 -0.229 1
1 419 . 18 1 1 A 32 32 ASN N N 32 122.834 125.790 -2.956 1
1 421 . 18 1 1 A 33 33 GLU H H 33 9.180 9.018 0.162 1
1 422 . 18 1 1 A 33 33 GLU HA H 33 4.063 4.076 -0.013 1
1 427 . 18 1 1 A 33 33 GLU C C 33 176.787 178.564 -1.777 1
1 428 . 18 1 1 A 33 33 GLU CA C 33 59.347 59.382 -0.035 1
1 429 . 18 1 1 A 33 33 GLU CB C 33 29.294 29.196 0.098 1
1 431 . 18 1 1 A 33 33 GLU N N 33 122.736 120.980 1.756 1
1 432 . 18 1 1 A 34 34 ASP H H 34 7.969 7.851 0.118 1
1 433 . 18 1 1 A 34 34 ASP HA H 34 4.499 4.604 -0.105 1
1 436 . 18 1 1 A 34 34 ASP C C 34 177.111 176.259 0.852 1
1 437 . 18 1 1 A 34 34 ASP CA C 34 53.632 54.584 -0.952 1
1 438 . 18 1 1 A 34 34 ASP CB C 34 39.807 41.201 -1.394 1
1 439 . 18 1 1 A 34 34 ASP N N 34 115.921 119.504 -3.583 1
1 440 . 18 1 1 A 35 35 GLY H H 35 8.083 7.931 0.152 1
1 441 . 18 1 1 A 35 35 GLY HA2 H 35 4.366 3.989 0.377 1
1 442 . 18 1 1 A 35 35 GLY HA3 H 35 3.657 3.991 -0.334 1
1 443 . 18 1 1 A 35 35 GLY C C 35 174.584 174.655 -0.071 1
1 444 . 18 1 1 A 35 35 GLY CA C 35 45.134 45.066 0.068 1
1 445 . 18 1 1 A 35 35 GLY N N 35 108.874 108.211 0.663 1
1 446 . 18 1 1 A 36 36 SER H H 36 8.274 7.982 0.292 1
1 447 . 18 1 1 A 36 36 SER HA H 36 4.389 4.476 -0.087 1
1 450 . 18 1 1 A 36 36 SER C C 36 173.284 174.178 -0.894 1
1 451 . 18 1 1 A 36 36 SER CA C 36 58.383 59.668 -1.285 1
1 452 . 18 1 1 A 36 36 SER CB C 36 64.576 63.639 0.937 1
1 453 . 18 1 1 A 36 36 SER N N 36 117.428 118.588 -1.160 1
1 454 . 18 1 1 A 37 37 VAL H H 37 8.508 8.580 -0.072 1
1 455 . 18 1 1 A 37 37 VAL HA H 37 4.346 4.292 0.054 1
1 463 . 18 1 1 A 37 37 VAL C C 37 176.370 175.900 0.470 1
1 464 . 18 1 1 A 37 37 VAL CA C 37 62.410 62.194 0.216 1
1 465 . 18 1 1 A 37 37 VAL CB C 37 33.086 32.309 0.777 1
1 468 . 18 1 1 A 37 37 VAL N N 37 119.189 126.844 -7.655 1
1 469 . 18 1 1 A 38 38 SER H H 38 8.461 8.674 -0.213 1
1 470 . 18 1 1 A 38 38 SER HA H 38 4.586 4.780 -0.194 1
1 473 . 18 1 1 A 38 38 SER C C 38 173.829 174.448 -0.619 1
1 474 . 18 1 1 A 38 38 SER CA C 38 57.618 56.399 1.219 1
1 475 . 18 1 1 A 38 38 SER CB C 38 64.537 65.457 -0.920 1
1 476 . 18 1 1 A 38 38 SER N N 38 121.629 120.374 1.255 1
1 477 . 18 1 1 A 39 39 ASP H H 39 8.512 8.606 -0.094 1
1 478 . 18 1 1 A 39 39 ASP HA H 39 4.606 4.532 0.074 1
1 481 . 18 1 1 A 39 39 ASP C C 39 176.557 177.004 -0.447 1
1 482 . 18 1 1 A 39 39 ASP CA C 39 54.833 56.269 -1.436 1
1 483 . 18 1 1 A 39 39 ASP CB C 39 41.123 41.488 -0.365 1
1 484 . 18 1 1 A 39 39 ASP N N 39 120.305 122.978 -2.673 1
1 485 . 18 1 1 A 40 40 GLU H H 40 8.311 7.477 0.834 1
1 486 . 18 1 1 A 40 40 GLU HA H 40 4.235 4.407 -0.172 1
1 491 . 18 1 1 A 40 40 GLU C C 40 175.327 175.864 -0.537 1
1 492 . 18 1 1 A 40 40 GLU CA C 40 56.215 57.416 -1.201 1
1 493 . 18 1 1 A 40 40 GLU CB C 40 30.788 30.222 0.566 1
1 495 . 18 1 1 A 40 40 GLU N N 40 120.680 117.651 3.029 1
1 496 . 18 1 1 A 41 41 ILE H H 41 8.465 8.823 -0.358 1
1 497 . 18 1 1 A 41 41 ILE HA H 41 4.127 4.411 -0.284 1
1 507 . 18 1 1 A 41 41 ILE C C 41 175.380 175.979 -0.599 1
1 508 . 18 1 1 A 41 41 ILE CA C 41 60.670 60.083 0.587 1
1 509 . 18 1 1 A 41 41 ILE CB C 41 38.805 39.638 -0.833 1
1 513 . 18 1 1 A 41 41 ILE N N 41 123.665 123.982 -0.317 1
1 514 . 18 1 1 A 42 42 LYS H H 42 9.556 9.163 0.393 1
1 515 . 18 1 1 A 42 42 LYS HA H 42 4.428 4.361 0.067 1
1 524 . 18 1 1 A 42 42 LYS C C 42 177.277 176.222 1.055 1
1 525 . 18 1 1 A 42 42 LYS CA C 42 57.274 57.442 -0.168 1
1 526 . 18 1 1 A 42 42 LYS CB C 42 35.169 33.812 1.357 1
1 530 . 18 1 1 A 42 42 LYS N N 42 125.597 127.177 -1.580 1
1 531 . 18 1 1 A 43 43 GLU H H 43 7.809 7.351 0.458 1
1 532 . 18 1 1 A 43 43 GLU HA H 43 4.886 4.693 0.193 1
1 537 . 18 1 1 A 43 43 GLU C C 43 173.593 173.591 0.002 1
1 538 . 18 1 1 A 43 43 GLU CA C 43 54.669 55.343 -0.674 1
1 539 . 18 1 1 A 43 43 GLU CB C 43 32.882 32.733 0.149 1
1 541 . 18 1 1 A 43 43 GLU N N 43 115.292 114.791 0.501 1
1 542 . 18 1 1 A 44 44 ARG H H 44 8.879 8.672 0.207 1
1 543 . 18 1 1 A 44 44 ARG HA H 44 4.917 5.052 -0.135 1
1 551 . 18 1 1 A 44 44 ARG C C 44 173.708 174.538 -0.830 1
1 552 . 18 1 1 A 44 44 ARG CA C 44 55.965 54.375 1.590 1
1 553 . 18 1 1 A 44 44 ARG CB C 44 33.579 34.022 -0.443 1
1 556 . 18 1 1 A 44 44 ARG N N 44 118.233 119.746 -1.513 1
1 558 . 18 1 1 A 45 45 THR H H 45 8.892 8.892 0.000 1
1 559 . 18 1 1 A 45 45 THR HA H 45 5.308 5.251 0.057 1
1 564 . 18 1 1 A 45 45 THR C C 45 173.357 173.341 0.016 1
1 565 . 18 1 1 A 45 45 THR CA C 45 60.939 61.532 -0.593 1
1 566 . 18 1 1 A 45 45 THR CB C 45 70.054 70.768 -0.714 1
1 568 . 18 1 1 A 45 45 THR N N 45 118.457 118.171 0.286 1
1 569 . 18 1 1 A 46 46 TYR H H 46 9.625 9.537 0.088 1
1 570 . 18 1 1 A 46 46 TYR HA H 46 4.771 5.187 -0.416 1
1 578 . 18 1 1 A 46 46 TYR C C 46 173.735 175.080 -1.345 1
1 579 . 18 1 1 A 46 46 TYR CA C 46 57.480 56.172 1.308 1
1 580 . 18 1 1 A 46 46 TYR CB C 46 41.724 41.676 0.048 1
1 585 . 18 1 1 A 46 46 TYR N N 46 125.916 125.867 0.049 1
1 586 . 18 1 1 A 47 47 ASP H H 47 9.006 8.842 0.164 1
1 587 . 18 1 1 A 47 47 ASP HA H 47 5.399 4.860 0.539 1
1 590 . 18 1 1 A 47 47 ASP C C 47 175.094 174.913 0.181 1
1 591 . 18 1 1 A 47 47 ASP CA C 47 53.460 53.781 -0.321 1
1 592 . 18 1 1 A 47 47 ASP CB C 47 41.947 41.578 0.369 1
1 593 . 18 1 1 A 47 47 ASP N N 47 122.109 122.780 -0.671 1
1 594 . 18 1 1 A 48 48 LEU H H 48 9.066 8.798 0.268 1
1 595 . 18 1 1 A 48 48 LEU HA H 48 4.831 5.105 -0.274 1
1 605 . 18 1 1 A 48 48 LEU C C 48 174.977 175.291 -0.314 1
1 606 . 18 1 1 A 48 48 LEU CA C 48 52.724 53.110 -0.386 1
1 607 . 18 1 1 A 48 48 LEU CB C 48 44.844 44.492 0.352 1
1 611 . 18 1 1 A 48 48 LEU N N 48 121.879 125.493 -3.614 1
1 612 . 18 1 1 A 49 49 LYS H H 49 9.401 8.573 0.828 1
1 613 . 18 1 1 A 49 49 LYS HA H 49 4.477 4.633 -0.156 1
1 622 . 18 1 1 A 49 49 LYS C C 49 176.225 176.592 -0.367 1
1 623 . 18 1 1 A 49 49 LYS CA C 49 56.017 54.913 1.104 1
1 624 . 18 1 1 A 49 49 LYS CB C 49 33.838 33.869 -0.031 1
1 628 . 18 1 1 A 49 49 LYS N N 49 122.218 123.877 -1.659 1
1 629 . 18 1 1 A 50 50 SER H H 50 8.266 8.643 -0.377 1
1 630 . 18 1 1 A 50 50 SER HA H 50 5.222 4.918 0.304 1
1 633 . 18 1 1 A 50 50 SER C C 50 175.570 174.609 0.961 1
1 634 . 18 1 1 A 50 50 SER CA C 50 55.770 56.744 -0.974 1
1 635 . 18 1 1 A 50 50 SER CB C 50 64.738 65.661 -0.923 1
1 636 . 18 1 1 A 50 50 SER N N 50 117.388 118.111 -0.723 1
1 637 . 18 1 1 A 51 51 LYS H H 51 9.276 8.376 0.900 1
1 638 . 18 1 1 A 51 51 LYS HA H 51 4.208 4.531 -0.323 1
1 647 . 18 1 1 A 51 51 LYS C C 51 178.773 177.299 1.474 1
1 648 . 18 1 1 A 51 51 LYS CA C 51 58.674 55.513 3.161 1
1 649 . 18 1 1 A 51 51 LYS CB C 51 33.383 34.243 -0.860 1
1 653 . 18 1 1 A 51 51 LYS N N 51 130.550 121.374 9.176 1
1 654 . 18 1 1 A 52 52 GLY H H 52 8.320 8.881 -0.561 1
1 655 . 18 1 1 A 52 52 GLY HA2 H 52 3.875 3.915 -0.040 1
1 656 . 18 1 1 A 52 52 GLY HA3 H 52 3.628 3.927 -0.299 1
1 657 . 18 1 1 A 52 52 GLY C C 52 175.108 175.192 -0.084 1
1 658 . 18 1 1 A 52 52 GLY CA C 52 46.322 47.289 -0.967 1
1 659 . 18 1 1 A 52 52 GLY N N 52 107.053 110.233 -3.180 1
1 660 . 18 1 1 A 53 53 GLN H H 53 7.859 8.554 -0.695 1
1 661 . 18 1 1 A 53 53 GLN HA H 53 4.409 4.366 0.043 1
1 668 . 18 1 1 A 53 53 GLN C C 53 176.469 176.094 0.375 1
1 669 . 18 1 1 A 53 53 GLN CA C 53 54.911 57.365 -2.454 1
1 670 . 18 1 1 A 53 53 GLN CB C 53 29.675 29.596 0.079 1
1 673 . 18 1 1 A 53 53 GLN N N 53 115.482 124.098 -8.616 1
1 675 . 18 1 1 A 54 54 GLY H H 54 7.992 8.168 -0.176 1
1 676 . 18 1 1 A 54 54 GLY HA2 H 54 3.934 3.975 -0.041 1
1 677 . 18 1 1 A 54 54 GLY HA3 H 54 3.934 3.979 -0.045 1
1 678 . 18 1 1 A 54 54 GLY C C 54 173.897 174.441 -0.544 1
1 679 . 18 1 1 A 54 54 GLY CA C 54 46.574 46.576 -0.002 1
1 680 . 18 1 1 A 54 54 GLY N N 54 110.111 108.254 1.857 1
1 681 . 18 1 1 A 55 55 ARG H H 55 7.652 7.889 -0.237 1
1 682 . 18 1 1 A 55 55 ARG HA H 55 4.665 4.763 -0.098 1
1 690 . 18 1 1 A 55 55 ARG C C 55 174.649 175.417 -0.768 1
1 691 . 18 1 1 A 55 55 ARG CA C 55 54.631 54.032 0.599 1
1 692 . 18 1 1 A 55 55 ARG CB C 55 32.166 32.587 -0.421 1
1 695 . 18 1 1 A 55 55 ARG N N 55 114.214 119.266 -5.052 1
1 697 . 18 1 1 A 56 56 MET H H 56 8.593 8.589 0.004 1
1 698 . 18 1 1 A 56 56 MET HA H 56 5.012 4.960 0.052 1
1 703 . 18 1 1 A 56 56 MET C C 56 176.216 175.838 0.378 1
1 704 . 18 1 1 A 56 56 MET CA C 56 54.595 54.074 0.521 1
1 705 . 18 1 1 A 56 56 MET CB C 56 33.466 32.664 0.802 1
1 707 . 18 1 1 A 56 56 MET N N 56 121.270 119.625 1.645 1
1 708 . 18 1 1 A 57 57 ILE H H 57 9.393 9.006 0.387 1
1 709 . 18 1 1 A 57 57 ILE HA H 57 4.717 4.582 0.135 1
1 719 . 18 1 1 A 57 57 ILE C C 57 173.883 173.678 0.205 1
1 720 . 18 1 1 A 57 57 ILE CA C 57 59.713 58.478 1.235 1
1 721 . 18 1 1 A 57 57 ILE CB C 57 40.933 40.895 0.038 1
1 725 . 18 1 1 A 57 57 ILE N N 57 120.811 119.844 0.967 1
1 726 . 18 1 1 A 58 58 GLN H H 58 8.218 8.011 0.207 1
1 727 . 18 1 1 A 58 58 GLN HA H 58 5.407 4.887 0.520 1
1 734 . 18 1 1 A 58 58 GLN C C 58 175.368 174.457 0.911 1
1 735 . 18 1 1 A 58 58 GLN CA C 58 55.163 55.162 0.001 1
1 736 . 18 1 1 A 58 58 GLN CB C 58 30.841 28.931 1.910 1
1 739 . 18 1 1 A 58 58 GLN N N 58 122.281 122.206 0.075 1
1 741 . 18 1 1 A 59 59 VAL H H 59 9.188 8.419 0.769 1
1 742 . 18 1 1 A 59 59 VAL HA H 59 5.025 5.068 -0.043 1
1 750 . 18 1 1 A 59 59 VAL C C 59 175.330 174.993 0.337 1
1 751 . 18 1 1 A 59 59 VAL CA C 59 59.975 61.277 -1.302 1
1 752 . 18 1 1 A 59 59 VAL CB C 59 34.818 33.200 1.618 1
1 755 . 18 1 1 A 59 59 VAL N N 59 122.421 126.618 -4.197 1
1 756 . 18 1 1 A 60 60 SER H H 60 9.022 9.206 -0.184 1
1 757 . 18 1 1 A 60 60 SER HA H 60 5.811 5.761 0.050 1
1 760 . 18 1 1 A 60 60 SER C C 60 173.234 173.219 0.015 1
1 761 . 18 1 1 A 60 60 SER CA C 60 57.634 56.507 1.127 1
1 762 . 18 1 1 A 60 60 SER CB C 60 64.891 65.336 -0.445 1
1 763 . 18 1 1 A 60 60 SER N N 60 124.709 122.801 1.908 1
1 764 . 18 1 1 A 61 61 ILE H H 61 9.226 9.030 0.196 1
1 765 . 18 1 1 A 61 61 ILE HA H 61 5.572 5.008 0.564 1
1 775 . 18 1 1 A 61 61 ILE C C 61 173.955 173.706 0.249 1
1 776 . 18 1 1 A 61 61 ILE CA C 61 56.937 57.152 -0.215 1
1 777 . 18 1 1 A 61 61 ILE CB C 61 39.596 40.568 -0.972 1
1 781 . 18 1 1 A 61 61 ILE N N 61 121.648 120.303 1.345 1
1 782 . 18 1 1 A 62 62 PRO HA H 62 4.606 4.513 0.093 1
1 789 . 18 1 1 A 62 62 PRO C C 62 178.143 177.227 0.916 1
1 790 . 18 1 1 A 62 62 PRO CA C 62 63.740 62.805 0.935 1
1 791 . 18 1 1 A 62 62 PRO CB C 62 33.303 32.781 0.522 1
1 794 . 18 1 1 A 63 63 ALA H H 63 7.803 8.911 -1.108 1
1 795 . 18 1 1 A 63 63 ALA HA H 63 4.037 3.989 0.048 1
1 799 . 18 1 1 A 63 63 ALA C C 63 175.942 178.788 -2.846 1
1 800 . 18 1 1 A 63 63 ALA CA C 63 54.417 54.146 0.271 1
1 801 . 18 1 1 A 63 63 ALA CB C 63 19.345 18.533 0.812 1
1 802 . 18 1 1 A 63 63 ALA N N 63 123.695 126.861 -3.166 1
1 803 . 18 1 1 A 64 64 SER H H 64 7.719 7.785 -0.066 1
1 804 . 18 1 1 A 64 64 SER HA H 64 4.097 4.340 -0.243 1
1 807 . 18 1 1 A 64 64 SER C C 64 175.199 174.605 0.594 1
1 808 . 18 1 1 A 64 64 SER CA C 64 59.474 59.812 -0.338 1
1 809 . 18 1 1 A 64 64 SER CB C 64 62.125 63.215 -1.090 1
1 810 . 18 1 1 A 64 64 SER N N 64 110.001 111.357 -1.356 1
1 811 . 18 1 1 A 65 65 VAL H H 65 7.790 7.694 0.096 1
1 812 . 18 1 1 A 65 65 VAL HA H 65 4.360 4.205 0.155 1
1 820 . 18 1 1 A 65 65 VAL C C 65 174.433 174.318 0.115 1
1 821 . 18 1 1 A 65 65 VAL CA C 65 60.335 59.819 0.516 1
1 822 . 18 1 1 A 65 65 VAL CB C 65 32.714 32.165 0.549 1
1 825 . 18 1 1 A 65 65 VAL N N 65 126.142 124.950 1.192 1
1 826 . 18 1 1 A 66 66 PRO HA H 66 4.369 4.406 -0.037 1
1 833 . 18 1 1 A 66 66 PRO C C 66 177.412 176.490 0.922 1
1 834 . 18 1 1 A 66 66 PRO CA C 66 63.104 63.165 -0.061 1
1 835 . 18 1 1 A 66 66 PRO CB C 66 32.558 31.815 0.743 1
1 838 . 18 1 1 A 67 67 LEU H H 67 8.578 8.430 0.148 1
1 839 . 18 1 1 A 67 67 LEU HA H 67 3.875 4.273 -0.398 1
1 849 . 18 1 1 A 67 67 LEU C C 67 176.077 177.040 -0.963 1
1 850 . 18 1 1 A 67 67 LEU CA C 67 56.413 55.827 0.586 1
1 851 . 18 1 1 A 67 67 LEU CB C 67 43.279 43.222 0.057 1
1 855 . 18 1 1 A 67 67 LEU N N 67 124.236 124.022 0.214 1
1 856 . 18 1 1 A 68 68 LYS H H 68 7.994 8.330 -0.336 1
1 857 . 18 1 1 A 68 68 LYS HA H 68 3.793 3.396 0.397 1
1 866 . 18 1 1 A 68 68 LYS C C 68 175.601 176.179 -0.578 1
1 867 . 18 1 1 A 68 68 LYS CA C 68 53.350 59.369 -6.019 1
1 868 . 18 1 1 A 68 68 LYS CB C 68 31.035 32.108 -1.073 1
1 872 . 18 1 1 A 68 68 LYS N N 68 124.053 127.923 -3.870 1
1 873 . 18 1 1 A 69 69 GLU H H 69 8.347 7.679 0.668 1
1 874 . 18 1 1 A 69 69 GLU HA H 69 4.501 3.896 0.605 1
1 879 . 18 1 1 A 69 69 GLU C C 69 175.304 175.371 -0.067 1
1 880 . 18 1 1 A 69 69 GLU CA C 69 54.291 57.452 -3.161 1
1 881 . 18 1 1 A 69 69 GLU CB C 69 29.285 27.045 2.240 1
1 883 . 18 1 1 A 69 69 GLU N N 69 123.876 116.065 7.811 1
1 884 . 18 1 1 A 70 70 PHE H H 70 5.549 6.730 -1.181 1
1 885 . 18 1 1 A 70 70 PHE HA H 70 4.592 4.440 0.152 1
1 893 . 18 1 1 A 70 70 PHE C C 70 174.443 175.191 -0.748 1
1 894 . 18 1 1 A 70 70 PHE CA C 70 53.313 57.621 -4.308 1
1 895 . 18 1 1 A 70 70 PHE CB C 70 38.335 39.460 -1.125 1
1 901 . 18 1 1 A 70 70 PHE N N 70 117.781 117.717 0.064 1
1 902 . 18 1 1 A 71 71 ASP H H 71 8.791 8.768 0.023 1
1 903 . 18 1 1 A 71 71 ASP HA H 71 4.535 4.886 -0.351 1
1 906 . 18 1 1 A 71 71 ASP C C 71 175.867 175.808 0.059 1
1 907 . 18 1 1 A 71 71 ASP CA C 71 54.248 54.448 -0.200 1
1 908 . 18 1 1 A 71 71 ASP CB C 71 41.166 41.984 -0.818 1
1 909 . 18 1 1 A 71 71 ASP N N 71 120.385 120.376 0.009 1
1 910 . 18 1 1 A 72 72 TYR H H 72 8.701 8.673 0.028 1
1 911 . 18 1 1 A 72 72 TYR HA H 72 4.283 4.621 -0.338 1
1 918 . 18 1 1 A 72 72 TYR C C 72 177.470 176.208 1.262 1
1 919 . 18 1 1 A 72 72 TYR CA C 72 60.513 59.008 1.505 1
1 920 . 18 1 1 A 72 72 TYR CB C 72 38.320 38.529 -0.209 1
1 925 . 18 1 1 A 72 72 TYR N N 72 121.876 122.772 -0.896 1
1 926 . 18 1 1 A 73 73 ASN H H 73 8.819 9.051 -0.232 1
1 927 . 18 1 1 A 73 73 ASN HA H 73 4.096 4.160 -0.064 1
1 932 . 18 1 1 A 73 73 ASN C C 73 174.362 174.414 -0.052 1
1 933 . 18 1 1 A 73 73 ASN CA C 73 54.289 54.221 0.068 1
1 934 . 18 1 1 A 73 73 ASN CB C 73 36.907 36.885 0.022 1
1 936 . 18 1 1 A 73 73 ASN N N 73 121.726 120.162 1.564 1
1 938 . 18 1 1 A 74 74 ALA H H 74 8.059 7.484 0.575 1
1 939 . 18 1 1 A 74 74 ALA HA H 74 4.100 4.432 -0.332 1
1 943 . 18 1 1 A 74 74 ALA C C 74 177.757 177.464 0.293 1
1 944 . 18 1 1 A 74 74 ALA CA C 74 53.153 52.328 0.825 1
1 945 . 18 1 1 A 74 74 ALA CB C 74 19.412 19.821 -0.409 1
1 946 . 18 1 1 A 74 74 ALA N N 74 122.292 119.945 2.347 1
1 947 . 18 1 1 A 75 75 ARG H H 75 8.500 8.449 0.051 1
1 948 . 18 1 1 A 75 75 ARG HA H 75 4.758 4.565 0.193 1
1 955 . 18 1 1 A 75 75 ARG C C 75 176.812 175.967 0.845 1
1 956 . 18 1 1 A 75 75 ARG CA C 75 56.646 56.152 0.494 1
1 957 . 18 1 1 A 75 75 ARG CB C 75 29.375 30.610 -1.235 1
1 960 . 18 1 1 A 75 75 ARG N N 75 122.871 121.276 1.595 1
1 961 . 18 1 1 A 76 76 VAL H H 76 7.965 9.021 -1.056 1
1 962 . 18 1 1 A 76 76 VAL HA H 76 5.230 5.038 0.192 1
1 970 . 18 1 1 A 76 76 VAL C C 76 173.758 174.580 -0.822 1
1 971 . 18 1 1 A 76 76 VAL CA C 76 58.193 59.365 -1.172 1
1 972 . 18 1 1 A 76 76 VAL CB C 76 36.536 34.789 1.747 1
1 975 . 18 1 1 A 76 76 VAL N N 76 116.220 117.879 -1.659 1
1 976 . 18 1 1 A 77 77 GLU H H 77 9.166 9.368 -0.202 1
1 977 . 18 1 1 A 77 77 GLU HA H 77 4.663 5.082 -0.419 1
1 982 . 18 1 1 A 77 77 GLU C C 77 174.940 174.784 0.156 1
1 983 . 18 1 1 A 77 77 GLU CA C 77 53.546 54.244 -0.698 1
1 984 . 18 1 1 A 77 77 GLU CB C 77 33.395 33.622 -0.227 1
1 986 . 18 1 1 A 77 77 GLU N N 77 116.413 122.599 -6.186 1
1 987 . 18 1 1 A 78 78 LEU H H 78 8.670 9.001 -0.331 1
1 988 . 18 1 1 A 78 78 LEU HA H 78 4.677 4.916 -0.239 1
1 998 . 18 1 1 A 78 78 LEU C C 78 176.036 176.490 -0.454 1
1 999 . 18 1 1 A 78 78 LEU CA C 78 53.091 53.561 -0.470 1
1 1000 . 18 1 1 A 78 78 LEU CB C 78 43.276 43.506 -0.230 1
1 1004 . 18 1 1 A 78 78 LEU N N 78 117.927 123.271 -5.344 1
1 1005 . 18 1 1 A 79 79 ILE H H 79 7.900 8.804 -0.904 1
1 1006 . 18 1 1 A 79 79 ILE HA H 79 4.312 4.034 0.278 1
1 1016 . 18 1 1 A 79 79 ILE C C 79 175.179 176.290 -1.111 1
1 1017 . 18 1 1 A 79 79 ILE CA C 79 58.294 64.122 -5.828 1
1 1018 . 18 1 1 A 79 79 ILE CB C 79 36.086 38.062 -1.976 1
1 1022 . 18 1 1 A 79 79 ILE N N 79 121.667 125.078 -3.411 1
1 1023 . 18 1 1 A 80 80 ASN H H 80 9.412 8.315 1.097 1
1 1024 . 18 1 1 A 80 80 ASN HA H 80 4.516 5.252 -0.736 1
1 1029 . 18 1 1 A 80 80 ASN C C 80 170.300 172.352 -2.052 1
1 1030 . 18 1 1 A 80 80 ASN CA C 80 54.198 50.473 3.725 1
1 1031 . 18 1 1 A 80 80 ASN CB C 80 37.450 39.271 -1.821 1
1 1033 . 18 1 1 A 80 80 ASN N N 80 123.831 118.395 5.436 1
1 1035 . 18 1 1 A 81 81 PRO HA H 81 5.185 4.865 0.320 1
1 1042 . 18 1 1 A 81 81 PRO C C 81 176.865 176.703 0.162 1
1 1043 . 18 1 1 A 81 81 PRO CA C 81 62.637 62.447 0.190 1
1 1044 . 18 1 1 A 81 81 PRO CB C 81 32.965 32.619 0.346 1
1 1047 . 18 1 1 A 82 82 ILE H H 82 9.374 8.625 0.749 1
1 1048 . 18 1 1 A 82 82 ILE HA H 82 4.524 5.070 -0.546 1
1 1058 . 18 1 1 A 82 82 ILE C C 82 174.731 174.115 0.616 1
1 1059 . 18 1 1 A 82 82 ILE CA C 82 60.205 58.566 1.639 1
1 1060 . 18 1 1 A 82 82 ILE CB C 82 41.737 41.219 0.518 1
1 1064 . 18 1 1 A 82 82 ILE N N 82 121.658 116.881 4.777 1
1 1065 . 18 1 1 A 83 83 ALA H H 83 8.819 8.847 -0.028 1
1 1066 . 18 1 1 A 83 83 ALA HA H 83 4.773 4.837 -0.064 1
1 1070 . 18 1 1 A 83 83 ALA C C 83 176.550 177.353 -0.803 1
1 1071 . 18 1 1 A 83 83 ALA CA C 83 52.069 51.304 0.765 1
1 1072 . 18 1 1 A 83 83 ALA CB C 83 20.374 19.677 0.697 1
1 1073 . 18 1 1 A 83 83 ALA N N 83 127.933 126.285 1.648 1
1 1074 . 18 1 1 A 84 84 ASP H H 84 8.710 8.909 -0.199 1
1 1075 . 18 1 1 A 84 84 ASP HA H 84 4.894 4.955 -0.061 1
1 1078 . 18 1 1 A 84 84 ASP C C 84 175.997 177.141 -1.144 1
1 1079 . 18 1 1 A 84 84 ASP CA C 84 53.334 53.804 -0.470 1
1 1080 . 18 1 1 A 84 84 ASP CB C 84 42.104 39.512 2.592 1
1 1081 . 18 1 1 A 84 84 ASP N N 84 122.009 125.499 -3.490 1
1 1082 . 18 1 1 A 85 85 THR H H 85 8.349 8.123 0.226 1
1 1083 . 18 1 1 A 85 85 THR HA H 85 4.420 4.079 0.341 1
1 1088 . 18 1 1 A 85 85 THR C C 85 175.085 176.115 -1.030 1
1 1089 . 18 1 1 A 85 85 THR CA C 85 62.304 65.871 -3.567 1
1 1090 . 18 1 1 A 85 85 THR CB C 85 69.718 68.256 1.462 1
1 1092 . 18 1 1 A 85 85 THR N N 85 114.986 112.775 2.211 1
1 1093 . 18 1 1 A 86 86 VAL H H 86 8.188 7.951 0.237 1
1 1094 . 18 1 1 A 86 86 VAL HA H 86 4.021 3.929 0.092 1
1 1102 . 18 1 1 A 86 86 VAL C C 86 176.519 177.869 -1.350 1
1 1103 . 18 1 1 A 86 86 VAL CA C 86 63.046 64.816 -1.770 1
1 1104 . 18 1 1 A 86 86 VAL CB C 86 32.526 31.419 1.107 1
1 1107 . 18 1 1 A 86 86 VAL N N 86 122.275 118.646 3.629 1
1 1108 . 18 1 1 A 87 87 ALA H H 87 8.194 8.188 0.006 1
1 1109 . 18 1 1 A 87 87 ALA HA H 87 4.212 4.318 -0.106 1
1 1113 . 18 1 1 A 87 87 ALA C C 87 178.118 179.438 -1.320 1
1 1114 . 18 1 1 A 87 87 ALA CA C 87 53.153 55.511 -2.358 1
1 1115 . 18 1 1 A 87 87 ALA CB C 87 19.165 18.215 0.950 1
1 1116 . 18 1 1 A 87 87 ALA N N 87 126.609 125.263 1.346 1
1 1117 . 18 1 1 A 88 88 THR H H 88 7.914 7.971 -0.057 1
1 1118 . 18 1 1 A 88 88 THR HA H 88 4.173 4.238 -0.065 1
1 1123 . 18 1 1 A 88 88 THR C C 88 174.516 176.887 -2.371 1
1 1124 . 18 1 1 A 88 88 THR CA C 88 62.785 65.587 -2.802 1
1 1125 . 18 1 1 A 88 88 THR CB C 88 69.582 68.114 1.468 1
1 1127 . 18 1 1 A 88 88 THR N N 88 112.328 111.575 0.753 1
1 1128 . 18 1 1 A 89 89 ALA H H 89 8.076 8.228 -0.152 1
1 1129 . 18 1 1 A 89 89 ALA HA H 89 4.320 4.527 -0.207 1
1 1133 . 18 1 1 A 89 89 ALA C C 89 178.014 180.136 -2.122 1
1 1134 . 18 1 1 A 89 89 ALA CA C 89 53.079 55.284 -2.205 1
1 1135 . 18 1 1 A 89 89 ALA CB C 89 19.335 17.967 1.368 1
1 1136 . 18 1 1 A 89 89 ALA N N 89 124.632 124.321 0.311 1
1 1137 . 18 1 1 A 90 90 THR H H 90 7.976 7.936 0.040 1
1 1138 . 18 1 1 A 90 90 THR HA H 90 4.203 4.044 0.159 1
1 1143 . 18 1 1 A 90 90 THR C C 90 174.427 175.346 -0.919 1
1 1144 . 18 1 1 A 90 90 THR CA C 90 62.519 66.152 -3.633 1
1 1145 . 18 1 1 A 90 90 THR CB C 90 69.721 68.851 0.870 1
1 1147 . 18 1 1 A 90 90 THR N N 90 112.047 114.205 -2.158 1
1 1148 . 18 1 1 A 91 91 TYR H H 91 7.959 8.025 -0.066 1
1 1149 . 18 1 1 A 91 91 TYR HA H 91 4.564 4.482 0.082 1
1 1156 . 18 1 1 A 91 91 TYR C C 91 175.522 176.572 -1.050 1
1 1157 . 18 1 1 A 91 91 TYR CA C 91 57.874 60.590 -2.716 1
1 1158 . 18 1 1 A 91 91 TYR CB C 91 38.584 40.058 -1.474 1
1 1163 . 18 1 1 A 91 91 TYR N N 91 121.184 117.263 3.921 1
1 1164 . 18 1 1 A 92 92 GLN H H 92 8.310 8.177 0.133 1
1 1165 . 18 1 1 A 92 92 GLN HA H 92 4.258 4.578 -0.320 1
1 1172 . 18 1 1 A 92 92 GLN C C 92 176.099 175.913 0.186 1
1 1173 . 18 1 1 A 92 92 GLN CA C 92 56.109 54.348 1.761 1
1 1174 . 18 1 1 A 92 92 GLN CB C 92 29.112 29.233 -0.121 1
1 1177 . 18 1 1 A 92 92 GLN N N 92 121.631 118.638 2.993 1
1 1179 . 18 1 1 A 93 93 GLY H H 93 8.052 8.972 -0.920 1
1 1180 . 18 1 1 A 93 93 GLY HA2 H 93 4.023 3.837 0.186 1
1 1181 . 18 1 1 A 93 93 GLY HA3 H 93 3.856 3.843 0.013 1
1 1182 . 18 1 1 A 93 93 GLY C C 93 173.791 174.137 -0.346 1
1 1183 . 18 1 1 A 93 93 GLY CA C 93 45.382 47.314 -1.932 1
1 1184 . 18 1 1 A 93 93 GLY N N 93 109.847 115.775 -5.928 1
1 1185 . 18 1 1 A 94 94 ALA H H 94 8.162 8.231 -0.069 1
1 1186 . 18 1 1 A 94 94 ALA HA H 94 4.329 4.514 -0.185 1
1 1190 . 18 1 1 A 94 94 ALA C C 94 177.392 175.888 1.504 1
1 1191 . 18 1 1 A 94 94 ALA CA C 94 52.558 51.411 1.147 1
1 1192 . 18 1 1 A 94 94 ALA CB C 94 19.526 18.734 0.792 1
1 1193 . 18 1 1 A 94 94 ALA N N 94 123.424 127.489 -4.065 1
1 1194 . 18 1 1 A 95 95 ASP H H 95 8.457 8.656 -0.199 1
1 1195 . 18 1 1 A 95 95 ASP HA H 95 4.608 4.864 -0.256 1
1 1198 . 18 1 1 A 95 95 ASP C C 95 175.630 177.437 -1.807 1
1 1199 . 18 1 1 A 95 95 ASP CA C 95 54.450 53.568 0.882 1
1 1200 . 18 1 1 A 95 95 ASP CB C 95 40.871 42.251 -1.380 1
1 1201 . 18 1 1 A 95 95 ASP N N 95 118.814 122.787 -3.973 1
1 1202 . 18 1 1 A 96 96 VAL H H 96 7.776 8.559 -0.783 1
1 1203 . 18 1 1 A 96 96 VAL HA H 96 4.141 4.171 -0.030 1
1 1211 . 18 1 1 A 96 96 VAL C C 96 175.301 176.188 -0.887 1
1 1212 . 18 1 1 A 96 96 VAL CA C 96 61.435 63.559 -2.124 1
1 1213 . 18 1 1 A 96 96 VAL CB C 96 33.517 32.449 1.068 1
1 1216 . 18 1 1 A 96 96 VAL N N 96 118.395 121.005 -2.610 1
1 1217 . 18 1 1 A 97 97 ASP H H 97 8.315 7.394 0.921 1
1 1218 . 18 1 1 A 97 97 ASP HA H 97 4.681 4.876 -0.195 1
1 1221 . 18 1 1 A 97 97 ASP C C 97 175.151 175.719 -0.568 1
1 1222 . 18 1 1 A 97 97 ASP CA C 97 54.324 53.728 0.596 1
1 1223 . 18 1 1 A 97 97 ASP CB C 97 41.963 42.094 -0.131 1
1 1224 . 18 1 1 A 97 97 ASP N N 97 123.905 121.218 2.687 1
1 1225 . 18 1 1 A 98 98 TRP H H 98 8.210 8.756 -0.546 1
1 1226 . 18 1 1 A 98 98 TRP HA H 98 4.916 5.590 -0.674 1
1 1235 . 18 1 1 A 98 98 TRP C C 98 174.585 172.904 1.681 1
1 1236 . 18 1 1 A 98 98 TRP CA C 98 56.164 54.823 1.341 1
1 1237 . 18 1 1 A 98 98 TRP CB C 98 31.466 32.669 -1.203 1
1 1243 . 18 1 1 A 98 98 TRP N N 98 120.340 119.164 1.176 1
1 1245 . 18 1 1 A 99 99 TYR H H 99 8.760 9.040 -0.280 1
1 1246 . 18 1 1 A 99 99 TYR HA H 99 5.119 5.698 -0.579 1
1 1253 . 18 1 1 A 99 99 TYR C C 99 174.599 175.326 -0.727 1
1 1254 . 18 1 1 A 99 99 TYR CA C 99 57.021 56.798 0.223 1
1 1255 . 18 1 1 A 99 99 TYR CB C 99 39.526 41.294 -1.768 1
1 1260 . 18 1 1 A 99 99 TYR N N 99 123.319 118.538 4.781 1
1 1261 . 18 1 1 A 100 100 ILE H H 100 8.936 9.058 -0.122 1
1 1262 . 18 1 1 A 100 100 ILE HA H 100 4.850 4.895 -0.045 1
1 1272 . 18 1 1 A 100 100 ILE C C 100 175.070 174.990 0.080 1
1 1273 . 18 1 1 A 100 100 ILE CA C 100 58.998 60.641 -1.643 1
1 1274 . 18 1 1 A 100 100 ILE CB C 100 40.667 40.305 0.362 1
1 1278 . 18 1 1 A 100 100 ILE N N 100 123.281 120.938 2.343 1
1 1279 . 18 1 1 A 101 101 LYS H H 101 8.987 9.057 -0.070 1
1 1280 . 18 1 1 A 101 101 LYS HA H 101 5.313 5.100 0.213 1
1 1289 . 18 1 1 A 101 101 LYS C C 101 174.440 175.891 -1.451 1
1 1290 . 18 1 1 A 101 101 LYS CA C 101 54.763 55.873 -1.110 1
1 1291 . 18 1 1 A 101 101 LYS CB C 101 34.880 33.275 1.605 1
1 1295 . 18 1 1 A 101 101 LYS N N 101 126.210 127.235 -1.025 1
1 1296 . 18 1 1 A 102 102 ALA H H 102 8.531 8.297 0.234 1
1 1297 . 18 1 1 A 102 102 ALA HA H 102 4.957 4.754 0.203 1
1 1301 . 18 1 1 A 102 102 ALA C C 102 175.024 177.813 -2.789 1
1 1302 . 18 1 1 A 102 102 ALA CA C 102 50.701 50.535 0.166 1
1 1303 . 18 1 1 A 102 102 ALA CB C 102 21.618 21.259 0.359 1
1 1304 . 18 1 1 A 102 102 ALA N N 102 121.424 128.040 -6.616 1
1 1305 . 18 1 1 A 103 103 ASP H H 103 8.339 8.923 -0.584 1
1 1306 . 18 1 1 A 103 103 ASP HA H 103 4.603 4.415 0.188 1
1 1309 . 18 1 1 A 103 103 ASP C C 103 176.188 175.346 0.842 1
1 1310 . 18 1 1 A 103 103 ASP CA C 103 56.049 57.055 -1.006 1
1 1311 . 18 1 1 A 103 103 ASP CB C 103 40.932 41.143 -0.211 1
1 1312 . 18 1 1 A 103 103 ASP N N 103 117.773 121.493 -3.720 1
1 1313 . 18 1 1 A 104 104 ASP H H 104 7.482 7.777 -0.295 1
1 1314 . 18 1 1 A 104 104 ASP HA H 104 4.727 4.990 -0.263 1
1 1317 . 18 1 1 A 104 104 ASP C C 104 174.261 173.711 0.550 1
1 1318 . 18 1 1 A 104 104 ASP CA C 104 52.768 53.795 -1.027 1
1 1319 . 18 1 1 A 104 104 ASP CB C 104 42.587 43.780 -1.193 1
1 1320 . 18 1 1 A 104 104 ASP N N 104 110.673 116.758 -6.085 1
1 1321 . 18 1 1 A 105 105 ILE H H 105 9.267 8.531 0.736 1
1 1322 . 18 1 1 A 105 105 ILE HA H 105 4.631 5.051 -0.420 1
1 1332 . 18 1 1 A 105 105 ILE C C 105 173.922 175.426 -1.504 1
1 1333 . 18 1 1 A 105 105 ILE CA C 105 61.114 60.339 0.775 1
1 1334 . 18 1 1 A 105 105 ILE CB C 105 42.522 40.586 1.936 1
1 1338 . 18 1 1 A 105 105 ILE N N 105 121.380 122.754 -1.374 1
1 1339 . 18 1 1 A 106 106 VAL H H 106 8.592 9.037 -0.445 1
1 1340 . 18 1 1 A 106 106 VAL HA H 106 4.975 4.975 0.000 1
1 1348 . 18 1 1 A 106 106 VAL C C 106 175.049 175.085 -0.036 1
1 1349 . 18 1 1 A 106 106 VAL CA C 106 58.028 59.553 -1.525 1
1 1350 . 18 1 1 A 106 106 VAL CB C 106 35.388 35.640 -0.252 1
1 1353 . 18 1 1 A 106 106 VAL N N 106 116.356 120.700 -4.344 1
1 1354 . 18 1 1 A 107 107 LEU H H 107 8.360 8.456 -0.096 1
1 1355 . 18 1 1 A 107 107 LEU HA H 107 4.167 4.363 -0.196 1
1 1365 . 18 1 1 A 107 107 LEU C C 107 178.338 177.454 0.884 1
1 1366 . 18 1 1 A 107 107 LEU CA C 107 55.077 54.384 0.693 1
1 1367 . 18 1 1 A 107 107 LEU CB C 107 42.394 41.984 0.410 1
1 1371 . 18 1 1 A 107 107 LEU N N 107 121.368 122.669 -1.301 1
1 1372 . 18 1 1 A 108 108 THR H H 108 7.977 8.627 -0.650 1
1 1373 . 18 1 1 A 108 108 THR HA H 108 4.039 4.460 -0.421 1
1 1378 . 18 1 1 A 108 108 THR C C 108 174.725 175.733 -1.008 1
1 1379 . 18 1 1 A 108 108 THR CA C 108 63.513 64.097 -0.584 1
1 1380 . 18 1 1 A 108 108 THR CB C 108 69.194 69.262 -0.068 1
1 1382 . 18 1 1 A 108 108 THR N N 108 118.728 117.935 0.793 1
1 1383 . 18 1 1 A 109 109 LEU H H 109 8.378 8.676 -0.298 1
1 1384 . 18 1 1 A 109 109 LEU HA H 109 4.274 3.913 0.361 1
1 1394 . 18 1 1 A 109 109 LEU C C 109 177.058 178.673 -1.615 1
1 1395 . 18 1 1 A 109 109 LEU CA C 109 55.045 57.738 -2.693 1
1 1396 . 18 1 1 A 109 109 LEU CB C 109 42.620 41.542 1.078 1
1 1400 . 18 1 1 A 109 109 LEU N N 109 124.847 126.180 -1.333 1
1 9 . 19 1 1 A 2 2 MET HA H 2 4.554 4.793 -0.239 1
1 14 . 19 1 1 A 2 2 MET C C 2 174.749 176.290 -1.541 1
1 15 . 19 1 1 A 2 2 MET CA C 2 55.354 53.880 1.474 1
1 16 . 19 1 1 A 2 2 MET CB C 2 33.729 35.045 -1.316 1
1 18 . 19 1 1 A 3 3 ARG H H 3 8.518 8.736 -0.218 1
1 19 . 19 1 1 A 3 3 ARG HA H 3 4.531 4.457 0.074 1
1 26 . 19 1 1 A 3 3 ARG C C 3 175.780 175.849 -0.069 1
1 27 . 19 1 1 A 3 3 ARG CA C 3 55.854 57.049 -1.195 1
1 28 . 19 1 1 A 3 3 ARG CB C 3 31.403 30.717 0.686 1
1 31 . 19 1 1 A 3 3 ARG N N 3 124.008 122.079 1.929 1
1 32 . 19 1 1 A 4 4 LEU H H 4 8.424 7.430 0.994 1
1 33 . 19 1 1 A 4 4 LEU HA H 4 4.457 4.377 0.080 1
1 43 . 19 1 1 A 4 4 LEU C C 4 177.362 176.455 0.907 1
1 44 . 19 1 1 A 4 4 LEU CA C 4 54.511 54.166 0.345 1
1 45 . 19 1 1 A 4 4 LEU CB C 4 42.686 43.148 -0.462 1
1 49 . 19 1 1 A 4 4 LEU N N 4 124.389 118.324 6.065 1
1 50 . 19 1 1 A 5 5 ALA H H 5 8.418 8.202 0.216 1
1 51 . 19 1 1 A 5 5 ALA HA H 5 4.254 4.854 -0.600 1
1 55 . 19 1 1 A 5 5 ALA C C 5 177.420 176.861 0.559 1
1 56 . 19 1 1 A 5 5 ALA CA C 5 52.931 49.891 3.040 1
1 57 . 19 1 1 A 5 5 ALA CB C 5 19.263 23.253 -3.990 1
1 58 . 19 1 1 A 5 5 ALA N N 5 124.548 121.172 3.376 1
1 59 . 19 1 1 A 6 6 ASN H H 6 8.287 8.807 -0.520 1
1 60 . 19 1 1 A 6 6 ASN HA H 6 4.616 4.937 -0.321 1
1 65 . 19 1 1 A 6 6 ASN C C 6 175.837 174.825 1.012 1
1 66 . 19 1 1 A 6 6 ASN CA C 6 53.345 53.680 -0.335 1
1 67 . 19 1 1 A 6 6 ASN CB C 6 38.571 39.076 -0.505 1
1 69 . 19 1 1 A 6 6 ASN N N 6 116.484 117.409 -0.925 1
1 71 . 19 1 1 A 7 7 GLY H H 7 8.351 7.866 0.485 1
1 72 . 19 1 1 A 7 7 GLY HA2 H 7 4.130 4.151 -0.021 1
1 73 . 19 1 1 A 7 7 GLY HA3 H 7 3.808 4.153 -0.345 1
1 74 . 19 1 1 A 7 7 GLY C C 7 173.750 172.426 1.324 1
1 75 . 19 1 1 A 7 7 GLY CA C 7 45.343 44.457 0.886 1
1 76 . 19 1 1 A 7 7 GLY N N 7 108.453 105.970 2.483 1
1 77 . 19 1 1 A 8 8 ILE H H 8 7.868 8.550 -0.682 1
1 78 . 19 1 1 A 8 8 ILE HA H 8 4.130 4.516 -0.386 1
1 88 . 19 1 1 A 8 8 ILE C C 8 175.570 176.955 -1.385 1
1 89 . 19 1 1 A 8 8 ILE CA C 8 61.095 59.014 2.081 1
1 90 . 19 1 1 A 8 8 ILE CB C 8 38.694 39.901 -1.207 1
1 94 . 19 1 1 A 8 8 ILE N N 8 120.848 118.195 2.653 1
1 95 . 19 1 1 A 9 9 VAL H H 9 8.220 8.796 -0.576 1
1 96 . 19 1 1 A 9 9 VAL HA H 9 4.172 3.971 0.201 1
1 104 . 19 1 1 A 9 9 VAL C C 9 175.898 176.283 -0.385 1
1 105 . 19 1 1 A 9 9 VAL CA C 9 62.488 64.461 -1.973 1
1 106 . 19 1 1 A 9 9 VAL CB C 9 32.460 32.270 0.190 1
1 109 . 19 1 1 A 9 9 VAL N N 9 125.805 121.591 4.214 1
1 110 . 19 1 1 A 10 10 LEU H H 10 8.437 7.627 0.810 1
1 111 . 19 1 1 A 10 10 LEU HA H 10 4.347 4.782 -0.435 1
1 121 . 19 1 1 A 10 10 LEU C C 10 176.398 174.474 1.924 1
1 122 . 19 1 1 A 10 10 LEU CA C 10 54.787 53.870 0.917 1
1 123 . 19 1 1 A 10 10 LEU CB C 10 42.639 44.074 -1.435 1
1 127 . 19 1 1 A 10 10 LEU N N 10 127.757 115.900 11.857 1
1 128 . 19 1 1 A 11 11 ASP H H 11 8.506 8.835 -0.329 1
1 129 . 19 1 1 A 11 11 ASP HA H 11 4.683 5.554 -0.871 1
1 132 . 19 1 1 A 11 11 ASP C C 11 176.672 175.490 1.182 1
1 133 . 19 1 1 A 11 11 ASP CA C 11 53.586 52.017 1.569 1
1 134 . 19 1 1 A 11 11 ASP CB C 11 41.123 45.068 -3.945 1
1 135 . 19 1 1 A 11 11 ASP N N 11 121.539 118.354 3.185 1
1 136 . 19 1 1 A 12 12 LYS H H 12 8.578 8.945 -0.367 1
1 137 . 19 1 1 A 12 12 LYS HA H 12 3.943 4.452 -0.509 1
1 146 . 19 1 1 A 12 12 LYS C C 12 176.917 175.362 1.555 1
1 147 . 19 1 1 A 12 12 LYS CA C 12 58.542 57.689 0.853 1
1 148 . 19 1 1 A 12 12 LYS CB C 12 32.703 35.324 -2.621 1
1 152 . 19 1 1 A 12 12 LYS N N 12 123.635 121.189 2.446 1
1 153 . 19 1 1 A 13 13 ASP H H 13 8.523 7.990 0.533 1
1 154 . 19 1 1 A 13 13 ASP HA H 13 4.566 4.970 -0.404 1
1 157 . 19 1 1 A 13 13 ASP C C 13 177.535 173.593 3.942 1
1 158 . 19 1 1 A 13 13 ASP CA C 13 56.034 54.111 1.923 1
1 159 . 19 1 1 A 13 13 ASP CB C 13 41.051 43.202 -2.151 1
1 160 . 19 1 1 A 13 13 ASP N N 13 120.448 118.247 2.201 1
1 161 . 19 1 1 A 14 14 THR H H 14 7.964 8.689 -0.725 1
1 162 . 19 1 1 A 14 14 THR HA H 14 4.146 4.516 -0.370 1
1 167 . 19 1 1 A 14 14 THR C C 14 175.440 174.272 1.168 1
1 168 . 19 1 1 A 14 14 THR CA C 14 63.245 59.720 3.525 1
1 169 . 19 1 1 A 14 14 THR CB C 14 69.092 69.097 -0.005 1
1 171 . 19 1 1 A 14 14 THR N N 14 113.711 115.571 -1.860 1
1 172 . 19 1 1 A 15 15 THR H H 15 7.921 8.148 -0.227 1
1 173 . 19 1 1 A 15 15 THR HA H 15 3.920 4.480 -0.560 1
1 178 . 19 1 1 A 15 15 THR C C 15 174.750 175.714 -0.964 1
1 179 . 19 1 1 A 15 15 THR CA C 15 64.562 62.315 2.247 1
1 180 . 19 1 1 A 15 15 THR CB C 15 69.166 70.410 -1.244 1
1 182 . 19 1 1 A 15 15 THR N N 15 116.710 114.994 1.716 1
1 183 . 19 1 1 A 16 16 PHE H H 16 8.191 7.847 0.344 1
1 184 . 19 1 1 A 16 16 PHE HA H 16 4.628 4.183 0.445 1
1 192 . 19 1 1 A 16 16 PHE C C 16 177.754 175.791 1.963 1
1 193 . 19 1 1 A 16 16 PHE CA C 16 57.975 59.063 -1.088 1
1 194 . 19 1 1 A 16 16 PHE CB C 16 39.553 36.462 3.091 1
1 200 . 19 1 1 A 16 16 PHE N N 16 117.124 116.661 0.463 1
1 201 . 19 1 1 A 17 17 GLY H H 17 8.110 8.657 -0.547 1
1 202 . 19 1 1 A 17 17 GLY HA2 H 17 4.017 3.939 0.078 1
1 203 . 19 1 1 A 17 17 GLY HA3 H 17 3.849 3.959 -0.110 1
1 204 . 19 1 1 A 17 17 GLY C C 17 172.231 173.899 -1.668 1
1 205 . 19 1 1 A 17 17 GLY CA C 17 45.633 47.378 -1.745 1
1 206 . 19 1 1 A 17 17 GLY N N 17 109.951 104.944 5.007 1
1 207 . 19 1 1 A 18 18 GLU H H 18 8.304 8.630 -0.326 1
1 208 . 19 1 1 A 18 18 GLU HA H 18 4.078 4.692 -0.614 1
1 213 . 19 1 1 A 18 18 GLU C C 18 175.588 175.567 0.021 1
1 214 . 19 1 1 A 18 18 GLU CA C 18 57.446 55.449 1.997 1
1 215 . 19 1 1 A 18 18 GLU CB C 18 30.767 30.129 0.638 1
1 217 . 19 1 1 A 18 18 GLU N N 18 121.640 125.021 -3.381 1
1 218 . 19 1 1 A 19 19 LEU H H 19 8.799 8.888 -0.089 1
1 219 . 19 1 1 A 19 19 LEU HA H 19 5.416 4.951 0.465 1
1 229 . 19 1 1 A 19 19 LEU C C 19 176.875 176.180 0.695 1
1 230 . 19 1 1 A 19 19 LEU CA C 19 53.281 54.189 -0.908 1
1 231 . 19 1 1 A 19 19 LEU CB C 19 45.508 42.164 3.344 1
1 235 . 19 1 1 A 19 19 LEU N N 19 127.101 126.967 0.134 1
1 236 . 19 1 1 A 20 20 LYS H H 20 8.494 8.775 -0.281 1
1 237 . 19 1 1 A 20 20 LYS HA H 20 5.200 5.278 -0.078 1
1 246 . 19 1 1 A 20 20 LYS C C 20 176.163 175.485 0.678 1
1 247 . 19 1 1 A 20 20 LYS CA C 20 53.575 54.641 -1.066 1
1 248 . 19 1 1 A 20 20 LYS CB C 20 36.835 35.496 1.339 1
1 252 . 19 1 1 A 20 20 LYS N N 20 118.828 124.407 -5.579 1
1 253 . 19 1 1 A 21 21 PHE H H 21 9.658 9.177 0.481 1
1 254 . 19 1 1 A 21 21 PHE HA H 21 4.038 4.687 -0.649 1
1 262 . 19 1 1 A 21 21 PHE C C 21 174.296 174.393 -0.097 1
1 263 . 19 1 1 A 21 21 PHE CA C 21 60.462 56.997 3.465 1
1 264 . 19 1 1 A 21 21 PHE CB C 21 40.359 39.649 0.710 1
1 270 . 19 1 1 A 21 21 PHE N N 21 124.322 126.751 -2.429 1
1 271 . 19 1 1 A 22 22 SER H H 22 7.199 8.285 -1.086 1
1 272 . 19 1 1 A 22 22 SER HA H 22 5.046 3.949 1.097 1
1 275 . 19 1 1 A 22 22 SER C C 22 173.080 174.404 -1.324 1
1 276 . 19 1 1 A 22 22 SER CA C 22 58.547 59.747 -1.200 1
1 277 . 19 1 1 A 22 22 SER CB C 22 63.591 63.297 0.294 1
1 278 . 19 1 1 A 22 22 SER N N 22 120.109 121.773 -1.664 1
1 279 . 19 1 1 A 23 23 ALA H H 23 7.269 7.152 0.117 1
1 280 . 19 1 1 A 23 23 ALA HA H 23 4.426 4.298 0.128 1
1 284 . 19 1 1 A 23 23 ALA C C 23 176.568 175.018 1.550 1
1 285 . 19 1 1 A 23 23 ALA CA C 23 52.458 51.204 1.254 1
1 286 . 19 1 1 A 23 23 ALA CB C 23 22.728 22.555 0.173 1
1 287 . 19 1 1 A 23 23 ALA N N 23 114.102 117.679 -3.577 1
1 288 . 19 1 1 A 24 24 LEU H H 24 8.819 8.633 0.186 1
1 289 . 19 1 1 A 24 24 LEU HA H 24 4.060 4.516 -0.456 1
1 299 . 19 1 1 A 24 24 LEU C C 24 175.363 176.734 -1.371 1
1 300 . 19 1 1 A 24 24 LEU CA C 24 56.901 54.937 1.964 1
1 301 . 19 1 1 A 24 24 LEU CB C 24 42.065 42.955 -0.890 1
1 305 . 19 1 1 A 24 24 LEU N N 24 120.865 121.311 -0.446 1
1 306 . 19 1 1 A 25 25 ARG H H 25 9.473 8.877 0.596 1
1 307 . 19 1 1 A 25 25 ARG HA H 25 4.428 4.249 0.179 1
1 315 . 19 1 1 A 25 25 ARG C C 25 175.729 175.456 0.273 1
1 316 . 19 1 1 A 25 25 ARG CA C 25 56.721 57.670 -0.949 1
1 317 . 19 1 1 A 25 25 ARG CB C 25 31.109 31.300 -0.191 1
1 320 . 19 1 1 A 25 25 ARG N N 25 130.455 127.328 3.127 1
1 322 . 19 1 1 A 26 26 ARG H H 26 7.711 7.363 0.348 1
1 323 . 19 1 1 A 26 26 ARG HA H 26 4.559 4.555 0.004 1
1 330 . 19 1 1 A 26 26 ARG C C 26 173.724 173.649 0.075 1
1 331 . 19 1 1 A 26 26 ARG CA C 26 55.737 55.872 -0.135 1
1 332 . 19 1 1 A 26 26 ARG CB C 26 33.261 33.965 -0.704 1
1 335 . 19 1 1 A 26 26 ARG N N 26 113.305 118.459 -5.154 1
1 336 . 19 1 1 A 27 27 GLU H H 27 8.848 8.599 0.249 1
1 337 . 19 1 1 A 27 27 GLU HA H 27 4.615 4.652 -0.037 1
1 342 . 19 1 1 A 27 27 GLU C C 27 174.836 176.191 -1.355 1
1 343 . 19 1 1 A 27 27 GLU CA C 27 55.901 55.848 0.053 1
1 344 . 19 1 1 A 27 27 GLU CB C 27 30.755 30.242 0.513 1
1 346 . 19 1 1 A 27 27 GLU N N 27 121.934 125.200 -3.266 1
1 347 . 19 1 1 A 28 28 VAL H H 28 8.603 8.207 0.396 1
1 348 . 19 1 1 A 28 28 VAL HA H 28 4.013 4.279 -0.266 1
1 356 . 19 1 1 A 28 28 VAL C C 28 175.561 175.891 -0.330 1
1 357 . 19 1 1 A 28 28 VAL CA C 28 62.791 61.835 0.956 1
1 358 . 19 1 1 A 28 28 VAL CB C 28 32.710 32.366 0.344 1
1 361 . 19 1 1 A 28 28 VAL N N 28 125.545 122.573 2.972 1
1 362 . 19 1 1 A 29 29 ARG H H 29 8.735 8.579 0.156 1
1 363 . 19 1 1 A 29 29 ARG HA H 29 4.774 4.743 0.031 1
1 370 . 19 1 1 A 29 29 ARG C C 29 176.580 175.404 1.176 1
1 371 . 19 1 1 A 29 29 ARG CA C 29 55.481 54.077 1.404 1
1 372 . 19 1 1 A 29 29 ARG CB C 29 31.963 32.926 -0.963 1
1 375 . 19 1 1 A 29 29 ARG N N 29 128.327 125.633 2.694 1
1 376 . 19 1 1 A 30 30 ILE H H 30 8.358 8.270 0.088 1
1 377 . 19 1 1 A 30 30 ILE HA H 30 3.882 4.620 -0.738 1
1 387 . 19 1 1 A 30 30 ILE C C 30 175.093 174.421 0.672 1
1 388 . 19 1 1 A 30 30 ILE CA C 30 61.669 59.928 1.741 1
1 389 . 19 1 1 A 30 30 ILE CB C 30 38.806 38.652 0.154 1
1 393 . 19 1 1 A 30 30 ILE N N 30 121.957 121.291 0.666 1
1 394 . 19 1 1 A 31 31 GLN H H 31 8.560 8.751 -0.191 1
1 395 . 19 1 1 A 31 31 GLN HA H 31 4.647 4.700 -0.053 1
1 402 . 19 1 1 A 31 31 GLN C C 31 175.954 175.875 0.079 1
1 403 . 19 1 1 A 31 31 GLN CA C 31 54.833 55.268 -0.435 1
1 404 . 19 1 1 A 31 31 GLN CB C 31 30.584 29.872 0.712 1
1 407 . 19 1 1 A 31 31 GLN N N 31 126.348 128.005 -1.657 1
1 409 . 19 1 1 A 32 32 ASN H H 32 8.994 8.930 0.064 1
1 410 . 19 1 1 A 32 32 ASN HA H 32 4.784 4.848 -0.064 1
1 415 . 19 1 1 A 32 32 ASN C C 32 177.296 176.496 0.800 1
1 416 . 19 1 1 A 32 32 ASN CA C 32 53.206 53.219 -0.013 1
1 417 . 19 1 1 A 32 32 ASN CB C 32 39.472 39.489 -0.017 1
1 419 . 19 1 1 A 32 32 ASN N N 32 122.834 126.138 -3.304 1
1 421 . 19 1 1 A 33 33 GLU H H 33 9.180 8.897 0.283 1
1 422 . 19 1 1 A 33 33 GLU HA H 33 4.063 4.108 -0.045 1
1 427 . 19 1 1 A 33 33 GLU C C 33 176.787 177.918 -1.131 1
1 428 . 19 1 1 A 33 33 GLU CA C 33 59.347 58.884 0.463 1
1 429 . 19 1 1 A 33 33 GLU CB C 33 29.294 29.326 -0.032 1
1 431 . 19 1 1 A 33 33 GLU N N 33 122.736 121.696 1.040 1
1 432 . 19 1 1 A 34 34 ASP H H 34 7.969 7.812 0.157 1
1 433 . 19 1 1 A 34 34 ASP HA H 34 4.499 4.533 -0.034 1
1 436 . 19 1 1 A 34 34 ASP C C 34 177.111 176.105 1.006 1
1 437 . 19 1 1 A 34 34 ASP CA C 34 53.632 54.603 -0.971 1
1 438 . 19 1 1 A 34 34 ASP CB C 34 39.807 41.086 -1.279 1
1 439 . 19 1 1 A 34 34 ASP N N 34 115.921 117.962 -2.041 1
1 440 . 19 1 1 A 35 35 GLY H H 35 8.083 7.707 0.376 1
1 441 . 19 1 1 A 35 35 GLY HA2 H 35 4.366 4.009 0.357 1
1 442 . 19 1 1 A 35 35 GLY HA3 H 35 3.657 4.009 -0.352 1
1 443 . 19 1 1 A 35 35 GLY C C 35 174.584 174.416 0.168 1
1 444 . 19 1 1 A 35 35 GLY CA C 35 45.134 45.126 0.008 1
1 445 . 19 1 1 A 35 35 GLY N N 35 108.874 106.541 2.333 1
1 446 . 19 1 1 A 36 36 SER H H 36 8.274 7.955 0.319 1
1 447 . 19 1 1 A 36 36 SER HA H 36 4.389 4.564 -0.175 1
1 450 . 19 1 1 A 36 36 SER C C 36 173.284 173.658 -0.374 1
1 451 . 19 1 1 A 36 36 SER CA C 36 58.383 58.373 0.010 1
1 452 . 19 1 1 A 36 36 SER CB C 36 64.576 64.838 -0.262 1
1 453 . 19 1 1 A 36 36 SER N N 36 117.428 115.376 2.052 1
1 454 . 19 1 1 A 37 37 VAL H H 37 8.508 8.567 -0.059 1
1 455 . 19 1 1 A 37 37 VAL HA H 37 4.346 4.529 -0.183 1
1 463 . 19 1 1 A 37 37 VAL C C 37 176.370 175.591 0.779 1
1 464 . 19 1 1 A 37 37 VAL CA C 37 62.410 61.533 0.877 1
1 465 . 19 1 1 A 37 37 VAL CB C 37 33.086 32.470 0.616 1
1 468 . 19 1 1 A 37 37 VAL N N 37 119.189 122.192 -3.003 1
1 469 . 19 1 1 A 38 38 SER H H 38 8.461 8.986 -0.525 1
1 470 . 19 1 1 A 38 38 SER HA H 38 4.586 4.527 0.059 1
1 473 . 19 1 1 A 38 38 SER C C 38 173.829 175.512 -1.683 1
1 474 . 19 1 1 A 38 38 SER CA C 38 57.618 58.867 -1.249 1
1 475 . 19 1 1 A 38 38 SER CB C 38 64.537 63.507 1.030 1
1 476 . 19 1 1 A 38 38 SER N N 38 121.629 122.277 -0.648 1
1 477 . 19 1 1 A 39 39 ASP H H 39 8.512 8.850 -0.338 1
1 478 . 19 1 1 A 39 39 ASP HA H 39 4.606 4.645 -0.039 1
1 481 . 19 1 1 A 39 39 ASP C C 39 176.557 176.650 -0.093 1
1 482 . 19 1 1 A 39 39 ASP CA C 39 54.833 55.579 -0.746 1
1 483 . 19 1 1 A 39 39 ASP CB C 39 41.123 41.128 -0.005 1
1 484 . 19 1 1 A 39 39 ASP N N 39 120.305 123.737 -3.432 1
1 485 . 19 1 1 A 40 40 GLU H H 40 8.311 7.808 0.503 1
1 486 . 19 1 1 A 40 40 GLU HA H 40 4.235 4.355 -0.120 1
1 491 . 19 1 1 A 40 40 GLU C C 40 175.327 175.965 -0.638 1
1 492 . 19 1 1 A 40 40 GLU CA C 40 56.215 57.061 -0.846 1
1 493 . 19 1 1 A 40 40 GLU CB C 40 30.788 29.963 0.825 1
1 495 . 19 1 1 A 40 40 GLU N N 40 120.680 118.955 1.725 1
1 496 . 19 1 1 A 41 41 ILE H H 41 8.465 8.825 -0.360 1
1 497 . 19 1 1 A 41 41 ILE HA H 41 4.127 4.479 -0.352 1
1 507 . 19 1 1 A 41 41 ILE C C 41 175.380 175.498 -0.118 1
1 508 . 19 1 1 A 41 41 ILE CA C 41 60.670 60.001 0.669 1
1 509 . 19 1 1 A 41 41 ILE CB C 41 38.805 39.826 -1.021 1
1 513 . 19 1 1 A 41 41 ILE N N 41 123.665 123.766 -0.101 1
1 514 . 19 1 1 A 42 42 LYS H H 42 9.556 9.177 0.379 1
1 515 . 19 1 1 A 42 42 LYS HA H 42 4.428 4.322 0.106 1
1 524 . 19 1 1 A 42 42 LYS C C 42 177.277 176.607 0.670 1
1 525 . 19 1 1 A 42 42 LYS CA C 42 57.274 57.981 -0.707 1
1 526 . 19 1 1 A 42 42 LYS CB C 42 35.169 32.914 2.255 1
1 530 . 19 1 1 A 42 42 LYS N N 42 125.597 126.232 -0.635 1
1 531 . 19 1 1 A 43 43 GLU H H 43 7.809 7.384 0.425 1
1 532 . 19 1 1 A 43 43 GLU HA H 43 4.886 4.980 -0.094 1
1 537 . 19 1 1 A 43 43 GLU C C 43 173.593 174.255 -0.662 1
1 538 . 19 1 1 A 43 43 GLU CA C 43 54.669 54.776 -0.107 1
1 539 . 19 1 1 A 43 43 GLU CB C 43 32.882 34.453 -1.571 1
1 541 . 19 1 1 A 43 43 GLU N N 43 115.292 116.883 -1.591 1
1 542 . 19 1 1 A 44 44 ARG H H 44 8.879 8.896 -0.017 1
1 543 . 19 1 1 A 44 44 ARG HA H 44 4.917 4.968 -0.051 1
1 551 . 19 1 1 A 44 44 ARG C C 44 173.708 174.504 -0.796 1
1 552 . 19 1 1 A 44 44 ARG CA C 44 55.965 54.965 1.000 1
1 553 . 19 1 1 A 44 44 ARG CB C 44 33.579 33.628 -0.049 1
1 556 . 19 1 1 A 44 44 ARG N N 44 118.233 123.007 -4.774 1
1 558 . 19 1 1 A 45 45 THR H H 45 8.892 8.982 -0.090 1
1 559 . 19 1 1 A 45 45 THR HA H 45 5.308 5.192 0.116 1
1 564 . 19 1 1 A 45 45 THR C C 45 173.357 173.240 0.117 1
1 565 . 19 1 1 A 45 45 THR CA C 45 60.939 62.102 -1.163 1
1 566 . 19 1 1 A 45 45 THR CB C 45 70.054 70.120 -0.066 1
1 568 . 19 1 1 A 45 45 THR N N 45 118.457 122.337 -3.880 1
1 569 . 19 1 1 A 46 46 TYR H H 46 9.625 9.746 -0.121 1
1 570 . 19 1 1 A 46 46 TYR HA H 46 4.771 5.289 -0.518 1
1 578 . 19 1 1 A 46 46 TYR C C 46 173.735 174.784 -1.049 1
1 579 . 19 1 1 A 46 46 TYR CA C 46 57.480 56.215 1.265 1
1 580 . 19 1 1 A 46 46 TYR CB C 46 41.724 41.809 -0.085 1
1 585 . 19 1 1 A 46 46 TYR N N 46 125.916 126.268 -0.352 1
1 586 . 19 1 1 A 47 47 ASP H H 47 9.006 8.948 0.058 1
1 587 . 19 1 1 A 47 47 ASP HA H 47 5.399 4.955 0.444 1
1 590 . 19 1 1 A 47 47 ASP C C 47 175.094 174.943 0.151 1
1 591 . 19 1 1 A 47 47 ASP CA C 47 53.460 53.705 -0.245 1
1 592 . 19 1 1 A 47 47 ASP CB C 47 41.947 41.545 0.402 1
1 593 . 19 1 1 A 47 47 ASP N N 47 122.109 123.113 -1.004 1
1 594 . 19 1 1 A 48 48 LEU H H 48 9.066 8.827 0.239 1
1 595 . 19 1 1 A 48 48 LEU HA H 48 4.831 4.976 -0.145 1
1 605 . 19 1 1 A 48 48 LEU C C 48 174.977 176.206 -1.229 1
1 606 . 19 1 1 A 48 48 LEU CA C 48 52.724 53.626 -0.902 1
1 607 . 19 1 1 A 48 48 LEU CB C 48 44.844 42.959 1.885 1
1 611 . 19 1 1 A 48 48 LEU N N 48 121.879 125.179 -3.300 1
1 612 . 19 1 1 A 49 49 LYS H H 49 9.401 8.731 0.670 1
1 613 . 19 1 1 A 49 49 LYS HA H 49 4.477 4.413 0.064 1
1 622 . 19 1 1 A 49 49 LYS C C 49 176.225 176.168 0.057 1
1 623 . 19 1 1 A 49 49 LYS CA C 49 56.017 56.492 -0.475 1
1 624 . 19 1 1 A 49 49 LYS CB C 49 33.838 33.294 0.544 1
1 628 . 19 1 1 A 49 49 LYS N N 49 122.218 124.888 -2.670 1
1 629 . 19 1 1 A 50 50 SER H H 50 8.266 8.722 -0.456 1
1 630 . 19 1 1 A 50 50 SER HA H 50 5.222 5.259 -0.037 1
1 633 . 19 1 1 A 50 50 SER C C 50 175.570 173.304 2.266 1
1 634 . 19 1 1 A 50 50 SER CA C 50 55.770 57.209 -1.439 1
1 635 . 19 1 1 A 50 50 SER CB C 50 64.738 66.516 -1.778 1
1 636 . 19 1 1 A 50 50 SER N N 50 117.388 116.930 0.458 1
1 637 . 19 1 1 A 51 51 LYS H H 51 9.276 8.711 0.565 1
1 638 . 19 1 1 A 51 51 LYS HA H 51 4.208 4.575 -0.367 1
1 647 . 19 1 1 A 51 51 LYS C C 51 178.773 177.124 1.649 1
1 648 . 19 1 1 A 51 51 LYS CA C 51 58.674 55.602 3.072 1
1 649 . 19 1 1 A 51 51 LYS CB C 51 33.383 34.181 -0.798 1
1 653 . 19 1 1 A 51 51 LYS N N 51 130.550 123.203 7.347 1
1 654 . 19 1 1 A 52 52 GLY H H 52 8.320 8.588 -0.268 1
1 655 . 19 1 1 A 52 52 GLY HA2 H 52 3.875 3.931 -0.056 1
1 656 . 19 1 1 A 52 52 GLY HA3 H 52 3.628 3.953 -0.325 1
1 657 . 19 1 1 A 52 52 GLY C C 52 175.108 175.158 -0.050 1
1 658 . 19 1 1 A 52 52 GLY CA C 52 46.322 47.186 -0.864 1
1 659 . 19 1 1 A 52 52 GLY N N 52 107.053 109.343 -2.290 1
1 660 . 19 1 1 A 53 53 GLN H H 53 7.859 8.825 -0.966 1
1 661 . 19 1 1 A 53 53 GLN HA H 53 4.409 4.323 0.086 1
1 668 . 19 1 1 A 53 53 GLN C C 53 176.469 176.098 0.371 1
1 669 . 19 1 1 A 53 53 GLN CA C 53 54.911 56.813 -1.902 1
1 670 . 19 1 1 A 53 53 GLN CB C 53 29.675 29.499 0.176 1
1 673 . 19 1 1 A 53 53 GLN N N 53 115.482 126.067 -10.585 1
1 675 . 19 1 1 A 54 54 GLY H H 54 7.992 8.138 -0.146 1
1 676 . 19 1 1 A 54 54 GLY HA2 H 54 3.934 3.934 0.000 1
1 677 . 19 1 1 A 54 54 GLY HA3 H 54 3.934 3.940 -0.006 1
1 678 . 19 1 1 A 54 54 GLY C C 54 173.897 174.458 -0.561 1
1 679 . 19 1 1 A 54 54 GLY CA C 54 46.574 45.078 1.496 1
1 680 . 19 1 1 A 54 54 GLY N N 54 110.111 107.735 2.376 1
1 681 . 19 1 1 A 55 55 ARG H H 55 7.652 7.863 -0.211 1
1 682 . 19 1 1 A 55 55 ARG HA H 55 4.665 4.437 0.228 1
1 690 . 19 1 1 A 55 55 ARG C C 55 174.649 176.201 -1.552 1
1 691 . 19 1 1 A 55 55 ARG CA C 55 54.631 55.864 -1.233 1
1 692 . 19 1 1 A 55 55 ARG CB C 55 32.166 31.210 0.956 1
1 695 . 19 1 1 A 55 55 ARG N N 55 114.214 120.058 -5.844 1
1 697 . 19 1 1 A 56 56 MET H H 56 8.593 8.684 -0.091 1
1 698 . 19 1 1 A 56 56 MET HA H 56 5.012 4.962 0.050 1
1 703 . 19 1 1 A 56 56 MET C C 56 176.216 175.399 0.817 1
1 704 . 19 1 1 A 56 56 MET CA C 56 54.595 54.100 0.495 1
1 705 . 19 1 1 A 56 56 MET CB C 56 33.466 34.618 -1.152 1
1 707 . 19 1 1 A 56 56 MET N N 56 121.270 119.235 2.035 1
1 708 . 19 1 1 A 57 57 ILE H H 57 9.393 8.581 0.812 1
1 709 . 19 1 1 A 57 57 ILE HA H 57 4.717 4.532 0.185 1
1 719 . 19 1 1 A 57 57 ILE C C 57 173.883 173.751 0.132 1
1 720 . 19 1 1 A 57 57 ILE CA C 57 59.713 58.546 1.167 1
1 721 . 19 1 1 A 57 57 ILE CB C 57 40.933 40.596 0.337 1
1 725 . 19 1 1 A 57 57 ILE N N 57 120.811 112.425 8.386 1
1 726 . 19 1 1 A 58 58 GLN H H 58 8.218 8.161 0.057 1
1 727 . 19 1 1 A 58 58 GLN HA H 58 5.407 4.876 0.531 1
1 734 . 19 1 1 A 58 58 GLN C C 58 175.368 174.679 0.689 1
1 735 . 19 1 1 A 58 58 GLN CA C 58 55.163 54.894 0.269 1
1 736 . 19 1 1 A 58 58 GLN CB C 58 30.841 29.219 1.622 1
1 739 . 19 1 1 A 58 58 GLN N N 58 122.281 122.388 -0.107 1
1 741 . 19 1 1 A 59 59 VAL H H 59 9.188 8.587 0.601 1
1 742 . 19 1 1 A 59 59 VAL HA H 59 5.025 5.360 -0.335 1
1 750 . 19 1 1 A 59 59 VAL C C 59 175.330 174.737 0.593 1
1 751 . 19 1 1 A 59 59 VAL CA C 59 59.975 61.163 -1.188 1
1 752 . 19 1 1 A 59 59 VAL CB C 59 34.818 33.236 1.582 1
1 755 . 19 1 1 A 59 59 VAL N N 59 122.421 126.707 -4.286 1
1 756 . 19 1 1 A 60 60 SER H H 60 9.022 9.427 -0.405 1
1 757 . 19 1 1 A 60 60 SER HA H 60 5.811 5.581 0.230 1
1 760 . 19 1 1 A 60 60 SER C C 60 173.234 173.465 -0.231 1
1 761 . 19 1 1 A 60 60 SER CA C 60 57.634 56.645 0.989 1
1 762 . 19 1 1 A 60 60 SER CB C 60 64.891 64.548 0.343 1
1 763 . 19 1 1 A 60 60 SER N N 60 124.709 122.624 2.085 1
1 764 . 19 1 1 A 61 61 ILE H H 61 9.226 9.020 0.206 1
1 765 . 19 1 1 A 61 61 ILE HA H 61 5.572 4.900 0.672 1
1 775 . 19 1 1 A 61 61 ILE C C 61 173.955 173.950 0.005 1
1 776 . 19 1 1 A 61 61 ILE CA C 61 56.937 57.229 -0.292 1
1 777 . 19 1 1 A 61 61 ILE CB C 61 39.596 39.498 0.098 1
1 781 . 19 1 1 A 61 61 ILE N N 61 121.648 122.173 -0.525 1
1 782 . 19 1 1 A 62 62 PRO HA H 62 4.606 4.544 0.062 1
1 789 . 19 1 1 A 62 62 PRO C C 62 178.143 177.493 0.650 1
1 790 . 19 1 1 A 62 62 PRO CA C 62 63.740 62.801 0.939 1
1 791 . 19 1 1 A 62 62 PRO CB C 62 33.303 32.743 0.560 1
1 794 . 19 1 1 A 63 63 ALA H H 63 7.803 8.688 -0.885 1
1 795 . 19 1 1 A 63 63 ALA HA H 63 4.037 4.039 -0.002 1
1 799 . 19 1 1 A 63 63 ALA C C 63 175.942 179.597 -3.655 1
1 800 . 19 1 1 A 63 63 ALA CA C 63 54.417 54.802 -0.385 1
1 801 . 19 1 1 A 63 63 ALA CB C 63 19.345 18.155 1.190 1
1 802 . 19 1 1 A 63 63 ALA N N 63 123.695 127.002 -3.307 1
1 803 . 19 1 1 A 64 64 SER H H 64 7.719 8.135 -0.416 1
1 804 . 19 1 1 A 64 64 SER HA H 64 4.097 4.369 -0.272 1
1 807 . 19 1 1 A 64 64 SER C C 64 175.199 173.943 1.256 1
1 808 . 19 1 1 A 64 64 SER CA C 64 59.474 61.304 -1.830 1
1 809 . 19 1 1 A 64 64 SER CB C 64 62.125 63.132 -1.007 1
1 810 . 19 1 1 A 64 64 SER N N 64 110.001 111.996 -1.995 1
1 811 . 19 1 1 A 65 65 VAL H H 65 7.790 8.088 -0.298 1
1 812 . 19 1 1 A 65 65 VAL HA H 65 4.360 4.432 -0.072 1
1 820 . 19 1 1 A 65 65 VAL C C 65 174.433 174.153 0.280 1
1 821 . 19 1 1 A 65 65 VAL CA C 65 60.335 58.727 1.608 1
1 822 . 19 1 1 A 65 65 VAL CB C 65 32.714 33.343 -0.629 1
1 825 . 19 1 1 A 65 65 VAL N N 65 126.142 119.467 6.675 1
1 826 . 19 1 1 A 66 66 PRO HA H 66 4.369 4.586 -0.217 1
1 833 . 19 1 1 A 66 66 PRO C C 66 177.412 176.259 1.153 1
1 834 . 19 1 1 A 66 66 PRO CA C 66 63.104 62.115 0.989 1
1 835 . 19 1 1 A 66 66 PRO CB C 66 32.558 32.944 -0.386 1
1 838 . 19 1 1 A 67 67 LEU H H 67 8.578 8.312 0.266 1
1 839 . 19 1 1 A 67 67 LEU HA H 67 3.875 4.889 -1.014 1
1 849 . 19 1 1 A 67 67 LEU C C 67 176.077 176.008 0.069 1
1 850 . 19 1 1 A 67 67 LEU CA C 67 56.413 55.277 1.136 1
1 851 . 19 1 1 A 67 67 LEU CB C 67 43.279 43.190 0.089 1
1 855 . 19 1 1 A 67 67 LEU N N 67 124.236 122.577 1.659 1
1 856 . 19 1 1 A 68 68 LYS H H 68 7.994 8.443 -0.449 1
1 857 . 19 1 1 A 68 68 LYS HA H 68 3.793 4.210 -0.417 1
1 866 . 19 1 1 A 68 68 LYS C C 68 175.601 175.228 0.373 1
1 867 . 19 1 1 A 68 68 LYS CA C 68 53.350 54.998 -1.648 1
1 868 . 19 1 1 A 68 68 LYS CB C 68 31.035 32.121 -1.086 1
1 872 . 19 1 1 A 68 68 LYS N N 68 124.053 125.756 -1.703 1
1 873 . 19 1 1 A 69 69 GLU H H 69 8.347 8.541 -0.194 1
1 874 . 19 1 1 A 69 69 GLU HA H 69 4.501 4.415 0.086 1
1 879 . 19 1 1 A 69 69 GLU C C 69 175.304 175.259 0.045 1
1 880 . 19 1 1 A 69 69 GLU CA C 69 54.291 55.648 -1.357 1
1 881 . 19 1 1 A 69 69 GLU CB C 69 29.285 28.144 1.141 1
1 883 . 19 1 1 A 69 69 GLU N N 69 123.876 124.464 -0.588 1
1 884 . 19 1 1 A 70 70 PHE H H 70 5.549 8.126 -2.577 1
1 885 . 19 1 1 A 70 70 PHE HA H 70 4.592 4.801 -0.209 1
1 893 . 19 1 1 A 70 70 PHE C C 70 174.443 175.496 -1.053 1
1 894 . 19 1 1 A 70 70 PHE CA C 70 53.313 57.773 -4.460 1
1 895 . 19 1 1 A 70 70 PHE CB C 70 38.335 41.418 -3.083 1
1 901 . 19 1 1 A 70 70 PHE N N 70 117.781 122.667 -4.886 1
1 902 . 19 1 1 A 71 71 ASP H H 71 8.791 8.751 0.040 1
1 903 . 19 1 1 A 71 71 ASP HA H 71 4.535 4.826 -0.291 1
1 906 . 19 1 1 A 71 71 ASP C C 71 175.867 175.816 0.051 1
1 907 . 19 1 1 A 71 71 ASP CA C 71 54.248 54.259 -0.011 1
1 908 . 19 1 1 A 71 71 ASP CB C 71 41.166 41.776 -0.610 1
1 909 . 19 1 1 A 71 71 ASP N N 71 120.385 121.662 -1.277 1
1 910 . 19 1 1 A 72 72 TYR H H 72 8.701 8.697 0.004 1
1 911 . 19 1 1 A 72 72 TYR HA H 72 4.283 4.444 -0.161 1
1 918 . 19 1 1 A 72 72 TYR C C 72 177.470 176.213 1.257 1
1 919 . 19 1 1 A 72 72 TYR CA C 72 60.513 59.332 1.181 1
1 920 . 19 1 1 A 72 72 TYR CB C 72 38.320 38.335 -0.015 1
1 925 . 19 1 1 A 72 72 TYR N N 72 121.876 125.422 -3.546 1
1 926 . 19 1 1 A 73 73 ASN H H 73 8.819 8.981 -0.162 1
1 927 . 19 1 1 A 73 73 ASN HA H 73 4.096 4.078 0.018 1
1 932 . 19 1 1 A 73 73 ASN C C 73 174.362 174.319 0.043 1
1 933 . 19 1 1 A 73 73 ASN CA C 73 54.289 54.132 0.157 1
1 934 . 19 1 1 A 73 73 ASN CB C 73 36.907 36.564 0.343 1
1 936 . 19 1 1 A 73 73 ASN N N 73 121.726 119.662 2.064 1
1 938 . 19 1 1 A 74 74 ALA H H 74 8.059 7.616 0.443 1
1 939 . 19 1 1 A 74 74 ALA HA H 74 4.100 4.410 -0.310 1
1 943 . 19 1 1 A 74 74 ALA C C 74 177.757 177.335 0.422 1
1 944 . 19 1 1 A 74 74 ALA CA C 74 53.153 52.149 1.004 1
1 945 . 19 1 1 A 74 74 ALA CB C 74 19.412 20.048 -0.636 1
1 946 . 19 1 1 A 74 74 ALA N N 74 122.292 120.106 2.186 1
1 947 . 19 1 1 A 75 75 ARG H H 75 8.500 8.476 0.024 1
1 948 . 19 1 1 A 75 75 ARG HA H 75 4.758 4.668 0.090 1
1 955 . 19 1 1 A 75 75 ARG C C 75 176.812 176.250 0.562 1
1 956 . 19 1 1 A 75 75 ARG CA C 75 56.646 56.552 0.094 1
1 957 . 19 1 1 A 75 75 ARG CB C 75 29.375 30.556 -1.181 1
1 960 . 19 1 1 A 75 75 ARG N N 75 122.871 121.077 1.794 1
1 961 . 19 1 1 A 76 76 VAL H H 76 7.965 9.144 -1.179 1
1 962 . 19 1 1 A 76 76 VAL HA H 76 5.230 5.105 0.125 1
1 970 . 19 1 1 A 76 76 VAL C C 76 173.758 174.144 -0.386 1
1 971 . 19 1 1 A 76 76 VAL CA C 76 58.193 58.972 -0.779 1
1 972 . 19 1 1 A 76 76 VAL CB C 76 36.536 35.894 0.642 1
1 975 . 19 1 1 A 76 76 VAL N N 76 116.220 118.345 -2.125 1
1 976 . 19 1 1 A 77 77 GLU H H 77 9.166 9.368 -0.202 1
1 977 . 19 1 1 A 77 77 GLU HA H 77 4.663 5.002 -0.339 1
1 982 . 19 1 1 A 77 77 GLU C C 77 174.940 174.626 0.314 1
1 983 . 19 1 1 A 77 77 GLU CA C 77 53.546 54.225 -0.679 1
1 984 . 19 1 1 A 77 77 GLU CB C 77 33.395 33.710 -0.315 1
1 986 . 19 1 1 A 77 77 GLU N N 77 116.413 121.098 -4.685 1
1 987 . 19 1 1 A 78 78 LEU H H 78 8.670 8.722 -0.052 1
1 988 . 19 1 1 A 78 78 LEU HA H 78 4.677 5.110 -0.433 1
1 998 . 19 1 1 A 78 78 LEU C C 78 176.036 175.947 0.089 1
1 999 . 19 1 1 A 78 78 LEU CA C 78 53.091 53.249 -0.158 1
1 1000 . 19 1 1 A 78 78 LEU CB C 78 43.276 45.133 -1.857 1
1 1004 . 19 1 1 A 78 78 LEU N N 78 117.927 122.005 -4.078 1
1 1005 . 19 1 1 A 79 79 ILE H H 79 7.900 8.924 -1.024 1
1 1006 . 19 1 1 A 79 79 ILE HA H 79 4.312 4.602 -0.290 1
1 1016 . 19 1 1 A 79 79 ILE C C 79 175.179 175.843 -0.664 1
1 1017 . 19 1 1 A 79 79 ILE CA C 79 58.294 60.226 -1.932 1
1 1018 . 19 1 1 A 79 79 ILE CB C 79 36.086 39.105 -3.019 1
1 1022 . 19 1 1 A 79 79 ILE N N 79 121.667 123.359 -1.692 1
1 1023 . 19 1 1 A 80 80 ASN H H 80 9.412 8.851 0.561 1
1 1024 . 19 1 1 A 80 80 ASN HA H 80 4.516 4.258 0.258 1
1 1029 . 19 1 1 A 80 80 ASN C C 80 170.300 173.594 -3.294 1
1 1030 . 19 1 1 A 80 80 ASN CA C 80 54.198 53.780 0.418 1
1 1031 . 19 1 1 A 80 80 ASN CB C 80 37.450 37.130 0.320 1
1 1033 . 19 1 1 A 80 80 ASN N N 80 123.831 122.983 0.848 1
1 1035 . 19 1 1 A 81 81 PRO HA H 81 5.185 5.226 -0.041 1
1 1042 . 19 1 1 A 81 81 PRO C C 81 176.865 176.353 0.512 1
1 1043 . 19 1 1 A 81 81 PRO CA C 81 62.637 62.379 0.258 1
1 1044 . 19 1 1 A 81 81 PRO CB C 81 32.965 32.160 0.805 1
1 1047 . 19 1 1 A 82 82 ILE H H 82 9.374 8.527 0.847 1
1 1048 . 19 1 1 A 82 82 ILE HA H 82 4.524 5.202 -0.678 1
1 1058 . 19 1 1 A 82 82 ILE C C 82 174.731 174.316 0.415 1
1 1059 . 19 1 1 A 82 82 ILE CA C 82 60.205 58.574 1.631 1
1 1060 . 19 1 1 A 82 82 ILE CB C 82 41.737 42.401 -0.664 1
1 1064 . 19 1 1 A 82 82 ILE N N 82 121.658 117.803 3.855 1
1 1065 . 19 1 1 A 83 83 ALA H H 83 8.819 8.789 0.030 1
1 1066 . 19 1 1 A 83 83 ALA HA H 83 4.773 5.253 -0.480 1
1 1070 . 19 1 1 A 83 83 ALA C C 83 176.550 175.965 0.585 1
1 1071 . 19 1 1 A 83 83 ALA CA C 83 52.069 50.106 1.963 1
1 1072 . 19 1 1 A 83 83 ALA CB C 83 20.374 21.086 -0.712 1
1 1073 . 19 1 1 A 83 83 ALA N N 83 127.933 124.352 3.581 1
1 1074 . 19 1 1 A 84 84 ASP H H 84 8.710 8.764 -0.054 1
1 1075 . 19 1 1 A 84 84 ASP HA H 84 4.894 4.827 0.067 1
1 1078 . 19 1 1 A 84 84 ASP C C 84 175.997 176.443 -0.446 1
1 1079 . 19 1 1 A 84 84 ASP CA C 84 53.334 54.205 -0.871 1
1 1080 . 19 1 1 A 84 84 ASP CB C 84 42.104 42.236 -0.132 1
1 1081 . 19 1 1 A 84 84 ASP N N 84 122.009 121.894 0.115 1
1 1082 . 19 1 1 A 85 85 THR H H 85 8.349 8.423 -0.074 1
1 1083 . 19 1 1 A 85 85 THR HA H 85 4.420 4.701 -0.281 1
1 1088 . 19 1 1 A 85 85 THR C C 85 175.085 174.599 0.486 1
1 1089 . 19 1 1 A 85 85 THR CA C 85 62.304 61.348 0.956 1
1 1090 . 19 1 1 A 85 85 THR CB C 85 69.718 69.939 -0.221 1
1 1092 . 19 1 1 A 85 85 THR N N 85 114.986 116.372 -1.386 1
1 1093 . 19 1 1 A 86 86 VAL H H 86 8.188 7.550 0.638 1
1 1094 . 19 1 1 A 86 86 VAL HA H 86 4.021 4.215 -0.194 1
1 1102 . 19 1 1 A 86 86 VAL C C 86 176.519 175.707 0.812 1
1 1103 . 19 1 1 A 86 86 VAL CA C 86 63.046 61.314 1.732 1
1 1104 . 19 1 1 A 86 86 VAL CB C 86 32.526 33.188 -0.662 1
1 1107 . 19 1 1 A 86 86 VAL N N 86 122.275 119.985 2.290 1
1 1108 . 19 1 1 A 87 87 ALA H H 87 8.194 8.662 -0.468 1
1 1109 . 19 1 1 A 87 87 ALA HA H 87 4.212 4.137 0.075 1
1 1113 . 19 1 1 A 87 87 ALA C C 87 178.118 177.459 0.659 1
1 1114 . 19 1 1 A 87 87 ALA CA C 87 53.153 54.155 -1.002 1
1 1115 . 19 1 1 A 87 87 ALA CB C 87 19.165 18.070 1.095 1
1 1116 . 19 1 1 A 87 87 ALA N N 87 126.609 121.956 4.653 1
1 1117 . 19 1 1 A 88 88 THR H H 88 7.914 7.853 0.061 1
1 1118 . 19 1 1 A 88 88 THR HA H 88 4.173 4.471 -0.298 1
1 1123 . 19 1 1 A 88 88 THR C C 88 174.516 174.779 -0.263 1
1 1124 . 19 1 1 A 88 88 THR CA C 88 62.785 63.116 -0.331 1
1 1125 . 19 1 1 A 88 88 THR CB C 88 69.582 69.044 0.538 1
1 1127 . 19 1 1 A 88 88 THR N N 88 112.328 112.155 0.173 1
1 1128 . 19 1 1 A 89 89 ALA H H 89 8.076 7.637 0.439 1
1 1129 . 19 1 1 A 89 89 ALA HA H 89 4.320 4.328 -0.008 1
1 1133 . 19 1 1 A 89 89 ALA C C 89 178.014 177.563 0.451 1
1 1134 . 19 1 1 A 89 89 ALA CA C 89 53.079 51.537 1.542 1
1 1135 . 19 1 1 A 89 89 ALA CB C 89 19.335 19.115 0.220 1
1 1136 . 19 1 1 A 89 89 ALA N N 89 124.632 125.107 -0.475 1
1 1137 . 19 1 1 A 90 90 THR H H 90 7.976 8.119 -0.143 1
1 1138 . 19 1 1 A 90 90 THR HA H 90 4.203 3.817 0.386 1
1 1143 . 19 1 1 A 90 90 THR C C 90 174.427 173.364 1.063 1
1 1144 . 19 1 1 A 90 90 THR CA C 90 62.519 65.100 -2.581 1
1 1145 . 19 1 1 A 90 90 THR CB C 90 69.721 66.456 3.265 1
1 1147 . 19 1 1 A 90 90 THR N N 90 112.047 112.520 -0.473 1
1 1148 . 19 1 1 A 91 91 TYR H H 91 7.959 7.702 0.257 1
1 1149 . 19 1 1 A 91 91 TYR HA H 91 4.564 4.580 -0.016 1
1 1156 . 19 1 1 A 91 91 TYR C C 91 175.522 175.917 -0.395 1
1 1157 . 19 1 1 A 91 91 TYR CA C 91 57.874 58.127 -0.253 1
1 1158 . 19 1 1 A 91 91 TYR CB C 91 38.584 39.007 -0.423 1
1 1163 . 19 1 1 A 91 91 TYR N N 91 121.184 121.633 -0.449 1
1 1164 . 19 1 1 A 92 92 GLN H H 92 8.310 8.522 -0.212 1
1 1165 . 19 1 1 A 92 92 GLN HA H 92 4.258 4.467 -0.209 1
1 1172 . 19 1 1 A 92 92 GLN C C 92 176.099 176.613 -0.514 1
1 1173 . 19 1 1 A 92 92 GLN CA C 92 56.109 56.118 -0.009 1
1 1174 . 19 1 1 A 92 92 GLN CB C 92 29.112 29.297 -0.185 1
1 1177 . 19 1 1 A 92 92 GLN N N 92 121.631 121.818 -0.187 1
1 1179 . 19 1 1 A 93 93 GLY H H 93 8.052 8.589 -0.537 1
1 1180 . 19 1 1 A 93 93 GLY HA2 H 93 4.023 3.898 0.125 1
1 1181 . 19 1 1 A 93 93 GLY HA3 H 93 3.856 3.914 -0.058 1
1 1182 . 19 1 1 A 93 93 GLY C C 93 173.791 174.661 -0.870 1
1 1183 . 19 1 1 A 93 93 GLY CA C 93 45.382 47.338 -1.956 1
1 1184 . 19 1 1 A 93 93 GLY N N 93 109.847 111.145 -1.298 1
1 1185 . 19 1 1 A 94 94 ALA H H 94 8.162 8.233 -0.071 1
1 1186 . 19 1 1 A 94 94 ALA HA H 94 4.329 4.433 -0.104 1
1 1190 . 19 1 1 A 94 94 ALA C C 94 177.392 177.147 0.245 1
1 1191 . 19 1 1 A 94 94 ALA CA C 94 52.558 52.819 -0.261 1
1 1192 . 19 1 1 A 94 94 ALA CB C 94 19.526 21.319 -1.793 1
1 1193 . 19 1 1 A 94 94 ALA N N 94 123.424 122.462 0.962 1
1 1194 . 19 1 1 A 95 95 ASP H H 95 8.457 8.171 0.286 1
1 1195 . 19 1 1 A 95 95 ASP HA H 95 4.608 4.385 0.223 1
1 1198 . 19 1 1 A 95 95 ASP C C 95 175.630 176.273 -0.643 1
1 1199 . 19 1 1 A 95 95 ASP CA C 95 54.450 56.390 -1.940 1
1 1200 . 19 1 1 A 95 95 ASP CB C 95 40.871 41.219 -0.348 1
1 1201 . 19 1 1 A 95 95 ASP N N 95 118.814 119.639 -0.825 1
1 1202 . 19 1 1 A 96 96 VAL H H 96 7.776 7.709 0.067 1
1 1203 . 19 1 1 A 96 96 VAL HA H 96 4.141 3.996 0.145 1
1 1211 . 19 1 1 A 96 96 VAL C C 96 175.301 175.224 0.077 1
1 1212 . 19 1 1 A 96 96 VAL CA C 96 61.435 62.480 -1.045 1
1 1213 . 19 1 1 A 96 96 VAL CB C 96 33.517 32.488 1.029 1
1 1216 . 19 1 1 A 96 96 VAL N N 96 118.395 119.914 -1.519 1
1 1217 . 19 1 1 A 97 97 ASP H H 97 8.315 8.669 -0.354 1
1 1218 . 19 1 1 A 97 97 ASP HA H 97 4.681 4.734 -0.053 1
1 1221 . 19 1 1 A 97 97 ASP C C 97 175.151 176.224 -1.073 1
1 1222 . 19 1 1 A 97 97 ASP CA C 97 54.324 54.536 -0.212 1
1 1223 . 19 1 1 A 97 97 ASP CB C 97 41.963 41.281 0.682 1
1 1224 . 19 1 1 A 97 97 ASP N N 97 123.905 127.566 -3.661 1
1 1225 . 19 1 1 A 98 98 TRP H H 98 8.210 8.921 -0.711 1
1 1226 . 19 1 1 A 98 98 TRP HA H 98 4.916 4.759 0.157 1
1 1235 . 19 1 1 A 98 98 TRP C C 98 174.585 175.895 -1.310 1
1 1236 . 19 1 1 A 98 98 TRP CA C 98 56.164 56.928 -0.764 1
1 1237 . 19 1 1 A 98 98 TRP CB C 98 31.466 30.132 1.334 1
1 1243 . 19 1 1 A 98 98 TRP N N 98 120.340 124.564 -4.224 1
1 1245 . 19 1 1 A 99 99 TYR H H 99 8.760 9.067 -0.307 1
1 1246 . 19 1 1 A 99 99 TYR HA H 99 5.119 5.311 -0.192 1
1 1253 . 19 1 1 A 99 99 TYR C C 99 174.599 175.028 -0.429 1
1 1254 . 19 1 1 A 99 99 TYR CA C 99 57.021 57.495 -0.474 1
1 1255 . 19 1 1 A 99 99 TYR CB C 99 39.526 39.572 -0.046 1
1 1260 . 19 1 1 A 99 99 TYR N N 99 123.319 122.460 0.859 1
1 1261 . 19 1 1 A 100 100 ILE H H 100 8.936 8.818 0.118 1
1 1262 . 19 1 1 A 100 100 ILE HA H 100 4.850 4.758 0.092 1
1 1272 . 19 1 1 A 100 100 ILE C C 100 175.070 174.606 0.464 1
1 1273 . 19 1 1 A 100 100 ILE CA C 100 58.998 59.650 -0.652 1
1 1274 . 19 1 1 A 100 100 ILE CB C 100 40.667 39.645 1.022 1
1 1278 . 19 1 1 A 100 100 ILE N N 100 123.281 124.284 -1.003 1
1 1279 . 19 1 1 A 101 101 LYS H H 101 8.987 8.723 0.264 1
1 1280 . 19 1 1 A 101 101 LYS HA H 101 5.313 5.437 -0.124 1
1 1289 . 19 1 1 A 101 101 LYS C C 101 174.440 174.945 -0.505 1
1 1290 . 19 1 1 A 101 101 LYS CA C 101 54.763 54.779 -0.016 1
1 1291 . 19 1 1 A 101 101 LYS CB C 101 34.880 36.925 -2.045 1
1 1295 . 19 1 1 A 101 101 LYS N N 101 126.210 122.004 4.206 1
1 1296 . 19 1 1 A 102 102 ALA H H 102 8.531 8.301 0.230 1
1 1297 . 19 1 1 A 102 102 ALA HA H 102 4.957 5.018 -0.061 1
1 1301 . 19 1 1 A 102 102 ALA C C 102 175.024 176.952 -1.928 1
1 1302 . 19 1 1 A 102 102 ALA CA C 102 50.701 51.235 -0.534 1
1 1303 . 19 1 1 A 102 102 ALA CB C 102 21.618 22.942 -1.324 1
1 1304 . 19 1 1 A 102 102 ALA N N 102 121.424 121.538 -0.114 1
1 1305 . 19 1 1 A 103 103 ASP H H 103 8.339 9.257 -0.918 1
1 1306 . 19 1 1 A 103 103 ASP HA H 103 4.603 4.530 0.073 1
1 1309 . 19 1 1 A 103 103 ASP C C 103 176.188 175.371 0.817 1
1 1310 . 19 1 1 A 103 103 ASP CA C 103 56.049 55.984 0.065 1
1 1311 . 19 1 1 A 103 103 ASP CB C 103 40.932 41.944 -1.012 1
1 1312 . 19 1 1 A 103 103 ASP N N 103 117.773 119.871 -2.098 1
1 1313 . 19 1 1 A 104 104 ASP H H 104 7.482 7.217 0.265 1
1 1314 . 19 1 1 A 104 104 ASP HA H 104 4.727 4.873 -0.146 1
1 1317 . 19 1 1 A 104 104 ASP C C 104 174.261 173.631 0.630 1
1 1318 . 19 1 1 A 104 104 ASP CA C 104 52.768 53.853 -1.085 1
1 1319 . 19 1 1 A 104 104 ASP CB C 104 42.587 43.815 -1.228 1
1 1320 . 19 1 1 A 104 104 ASP N N 104 110.673 116.474 -5.801 1
1 1321 . 19 1 1 A 105 105 ILE H H 105 9.267 8.301 0.966 1
1 1322 . 19 1 1 A 105 105 ILE HA H 105 4.631 4.996 -0.365 1
1 1332 . 19 1 1 A 105 105 ILE C C 105 173.922 175.369 -1.447 1
1 1333 . 19 1 1 A 105 105 ILE CA C 105 61.114 60.384 0.730 1
1 1334 . 19 1 1 A 105 105 ILE CB C 105 42.522 40.555 1.967 1
1 1338 . 19 1 1 A 105 105 ILE N N 105 121.380 122.453 -1.073 1
1 1339 . 19 1 1 A 106 106 VAL H H 106 8.592 9.033 -0.441 1
1 1340 . 19 1 1 A 106 106 VAL HA H 106 4.975 5.145 -0.170 1
1 1348 . 19 1 1 A 106 106 VAL C C 106 175.049 175.125 -0.076 1
1 1349 . 19 1 1 A 106 106 VAL CA C 106 58.028 59.592 -1.564 1
1 1350 . 19 1 1 A 106 106 VAL CB C 106 35.388 35.945 -0.557 1
1 1353 . 19 1 1 A 106 106 VAL N N 106 116.356 120.473 -4.117 1
1 1354 . 19 1 1 A 107 107 LEU H H 107 8.360 8.589 -0.229 1
1 1355 . 19 1 1 A 107 107 LEU HA H 107 4.167 4.358 -0.191 1
1 1365 . 19 1 1 A 107 107 LEU C C 107 178.338 177.321 1.017 1
1 1366 . 19 1 1 A 107 107 LEU CA C 107 55.077 54.403 0.674 1
1 1367 . 19 1 1 A 107 107 LEU CB C 107 42.394 42.010 0.384 1
1 1371 . 19 1 1 A 107 107 LEU N N 107 121.368 122.354 -0.986 1
1 1372 . 19 1 1 A 108 108 THR H H 108 7.977 8.533 -0.556 1
1 1373 . 19 1 1 A 108 108 THR HA H 108 4.039 4.258 -0.219 1
1 1378 . 19 1 1 A 108 108 THR C C 108 174.725 174.177 0.548 1
1 1379 . 19 1 1 A 108 108 THR CA C 108 63.513 63.802 -0.289 1
1 1380 . 19 1 1 A 108 108 THR CB C 108 69.194 68.659 0.535 1
1 1382 . 19 1 1 A 108 108 THR N N 108 118.728 118.787 -0.059 1
1 1383 . 19 1 1 A 109 109 LEU H H 109 8.378 8.945 -0.567 1
1 1384 . 19 1 1 A 109 109 LEU HA H 109 4.274 4.464 -0.190 1
1 1394 . 19 1 1 A 109 109 LEU C C 109 177.058 175.508 1.550 1
1 1395 . 19 1 1 A 109 109 LEU CA C 109 55.045 54.417 0.628 1
1 1396 . 19 1 1 A 109 109 LEU CB C 109 42.620 39.737 2.883 1
1 1400 . 19 1 1 A 109 109 LEU N N 109 124.847 128.916 -4.069 1
1 9 . 20 1 1 A 2 2 MET HA H 2 4.554 4.576 -0.022 1
1 14 . 20 1 1 A 2 2 MET C C 2 174.749 175.280 -0.531 1
1 15 . 20 1 1 A 2 2 MET CA C 2 55.354 55.214 0.140 1
1 16 . 20 1 1 A 2 2 MET CB C 2 33.729 32.715 1.014 1
1 18 . 20 1 1 A 3 3 ARG H H 3 8.518 8.701 -0.183 1
1 19 . 20 1 1 A 3 3 ARG HA H 3 4.531 4.788 -0.257 1
1 26 . 20 1 1 A 3 3 ARG C C 3 175.780 175.913 -0.133 1
1 27 . 20 1 1 A 3 3 ARG CA C 3 55.854 55.460 0.394 1
1 28 . 20 1 1 A 3 3 ARG CB C 3 31.403 31.501 -0.098 1
1 31 . 20 1 1 A 3 3 ARG N N 3 124.008 125.105 -1.097 1
1 32 . 20 1 1 A 4 4 LEU H H 4 8.424 8.647 -0.223 1
1 33 . 20 1 1 A 4 4 LEU HA H 4 4.457 4.534 -0.077 1
1 43 . 20 1 1 A 4 4 LEU C C 4 177.362 176.838 0.524 1
1 44 . 20 1 1 A 4 4 LEU CA C 4 54.511 54.437 0.074 1
1 45 . 20 1 1 A 4 4 LEU CB C 4 42.686 42.254 0.432 1
1 49 . 20 1 1 A 4 4 LEU N N 4 124.389 128.125 -3.736 1
1 50 . 20 1 1 A 5 5 ALA H H 5 8.418 8.567 -0.149 1
1 51 . 20 1 1 A 5 5 ALA HA H 5 4.254 4.264 -0.010 1
1 55 . 20 1 1 A 5 5 ALA C C 5 177.420 177.354 0.066 1
1 56 . 20 1 1 A 5 5 ALA CA C 5 52.931 51.954 0.977 1
1 57 . 20 1 1 A 5 5 ALA CB C 5 19.263 20.146 -0.883 1
1 58 . 20 1 1 A 5 5 ALA N N 5 124.548 123.808 0.740 1
1 59 . 20 1 1 A 6 6 ASN H H 6 8.287 8.628 -0.341 1
1 60 . 20 1 1 A 6 6 ASN HA H 6 4.616 4.606 0.010 1
1 65 . 20 1 1 A 6 6 ASN C C 6 175.837 176.241 -0.404 1
1 66 . 20 1 1 A 6 6 ASN CA C 6 53.345 53.567 -0.222 1
1 67 . 20 1 1 A 6 6 ASN CB C 6 38.571 39.425 -0.854 1
1 69 . 20 1 1 A 6 6 ASN N N 6 116.484 117.257 -0.773 1
1 71 . 20 1 1 A 7 7 GLY H H 7 8.351 8.794 -0.443 1
1 72 . 20 1 1 A 7 7 GLY HA2 H 7 4.130 3.978 0.152 1
1 73 . 20 1 1 A 7 7 GLY HA3 H 7 3.808 3.978 -0.170 1
1 74 . 20 1 1 A 7 7 GLY C C 7 173.750 174.264 -0.514 1
1 75 . 20 1 1 A 7 7 GLY CA C 7 45.343 45.718 -0.375 1
1 76 . 20 1 1 A 7 7 GLY N N 7 108.453 110.015 -1.562 1
1 77 . 20 1 1 A 8 8 ILE H H 8 7.868 7.854 0.014 1
1 78 . 20 1 1 A 8 8 ILE HA H 8 4.130 4.231 -0.101 1
1 88 . 20 1 1 A 8 8 ILE C C 8 175.570 175.339 0.231 1
1 89 . 20 1 1 A 8 8 ILE CA C 8 61.095 60.709 0.386 1
1 90 . 20 1 1 A 8 8 ILE CB C 8 38.694 38.941 -0.247 1
1 94 . 20 1 1 A 8 8 ILE N N 8 120.848 119.906 0.942 1
1 95 . 20 1 1 A 9 9 VAL H H 9 8.220 8.806 -0.586 1
1 96 . 20 1 1 A 9 9 VAL HA H 9 4.172 4.065 0.107 1
1 104 . 20 1 1 A 9 9 VAL C C 9 175.898 176.002 -0.104 1
1 105 . 20 1 1 A 9 9 VAL CA C 9 62.488 62.661 -0.173 1
1 106 . 20 1 1 A 9 9 VAL CB C 9 32.460 32.319 0.141 1
1 109 . 20 1 1 A 9 9 VAL N N 9 125.805 123.741 2.064 1
1 110 . 20 1 1 A 10 10 LEU H H 10 8.437 8.532 -0.095 1
1 111 . 20 1 1 A 10 10 LEU HA H 10 4.347 4.332 0.015 1
1 121 . 20 1 1 A 10 10 LEU C C 10 176.398 176.012 0.386 1
1 122 . 20 1 1 A 10 10 LEU CA C 10 54.787 54.347 0.440 1
1 123 . 20 1 1 A 10 10 LEU CB C 10 42.639 42.193 0.446 1
1 127 . 20 1 1 A 10 10 LEU N N 10 127.757 128.598 -0.841 1
1 128 . 20 1 1 A 11 11 ASP H H 11 8.506 8.466 0.040 1
1 129 . 20 1 1 A 11 11 ASP HA H 11 4.683 4.579 0.104 1
1 132 . 20 1 1 A 11 11 ASP C C 11 176.672 175.040 1.632 1
1 133 . 20 1 1 A 11 11 ASP CA C 11 53.586 54.495 -0.909 1
1 134 . 20 1 1 A 11 11 ASP CB C 11 41.123 40.969 0.154 1
1 135 . 20 1 1 A 11 11 ASP N N 11 121.539 122.074 -0.535 1
1 136 . 20 1 1 A 12 12 LYS H H 12 8.578 8.716 -0.138 1
1 137 . 20 1 1 A 12 12 LYS HA H 12 3.943 4.599 -0.656 1
1 146 . 20 1 1 A 12 12 LYS C C 12 176.917 174.974 1.943 1
1 147 . 20 1 1 A 12 12 LYS CA C 12 58.542 55.595 2.947 1
1 148 . 20 1 1 A 12 12 LYS CB C 12 32.703 34.806 -2.103 1
1 152 . 20 1 1 A 12 12 LYS N N 12 123.635 126.993 -3.358 1
1 153 . 20 1 1 A 13 13 ASP H H 13 8.523 8.631 -0.108 1
1 154 . 20 1 1 A 13 13 ASP HA H 13 4.566 4.323 0.243 1
1 157 . 20 1 1 A 13 13 ASP C C 13 177.535 175.294 2.241 1
1 158 . 20 1 1 A 13 13 ASP CA C 13 56.034 54.833 1.201 1
1 159 . 20 1 1 A 13 13 ASP CB C 13 41.051 39.584 1.467 1
1 160 . 20 1 1 A 13 13 ASP N N 13 120.448 125.548 -5.100 1
1 161 . 20 1 1 A 14 14 THR H H 14 7.964 8.127 -0.163 1
1 162 . 20 1 1 A 14 14 THR HA H 14 4.146 5.056 -0.910 1
1 167 . 20 1 1 A 14 14 THR C C 14 175.440 174.093 1.347 1
1 168 . 20 1 1 A 14 14 THR CA C 14 63.245 60.940 2.305 1
1 169 . 20 1 1 A 14 14 THR CB C 14 69.092 70.041 -0.949 1
1 171 . 20 1 1 A 14 14 THR N N 14 113.711 114.294 -0.583 1
1 172 . 20 1 1 A 15 15 THR H H 15 7.921 8.743 -0.822 1
1 173 . 20 1 1 A 15 15 THR HA H 15 3.920 5.028 -1.108 1
1 178 . 20 1 1 A 15 15 THR C C 15 174.750 173.965 0.785 1
1 179 . 20 1 1 A 15 15 THR CA C 15 64.562 59.474 5.088 1
1 180 . 20 1 1 A 15 15 THR CB C 15 69.166 71.112 -1.946 1
1 182 . 20 1 1 A 15 15 THR N N 15 116.710 117.652 -0.942 1
1 183 . 20 1 1 A 16 16 PHE H H 16 8.191 8.873 -0.682 1
1 184 . 20 1 1 A 16 16 PHE HA H 16 4.628 4.824 -0.196 1
1 192 . 20 1 1 A 16 16 PHE C C 16 177.754 175.508 2.246 1
1 193 . 20 1 1 A 16 16 PHE CA C 16 57.975 57.937 0.038 1
1 194 . 20 1 1 A 16 16 PHE CB C 16 39.553 38.526 1.027 1
1 200 . 20 1 1 A 16 16 PHE N N 16 117.124 122.826 -5.702 1
1 201 . 20 1 1 A 17 17 GLY H H 17 8.110 8.642 -0.532 1
1 202 . 20 1 1 A 17 17 GLY HA2 H 17 4.017 4.056 -0.039 1
1 203 . 20 1 1 A 17 17 GLY HA3 H 17 3.849 4.072 -0.223 1
1 204 . 20 1 1 A 17 17 GLY C C 17 172.231 174.058 -1.827 1
1 205 . 20 1 1 A 17 17 GLY CA C 17 45.633 45.342 0.291 1
1 206 . 20 1 1 A 17 17 GLY N N 17 109.951 112.608 -2.657 1
1 207 . 20 1 1 A 18 18 GLU H H 18 8.304 8.287 0.017 1
1 208 . 20 1 1 A 18 18 GLU HA H 18 4.078 4.745 -0.667 1
1 213 . 20 1 1 A 18 18 GLU C C 18 175.588 175.190 0.398 1
1 214 . 20 1 1 A 18 18 GLU CA C 18 57.446 55.518 1.928 1
1 215 . 20 1 1 A 18 18 GLU CB C 18 30.767 30.934 -0.167 1
1 217 . 20 1 1 A 18 18 GLU N N 18 121.640 120.269 1.371 1
1 218 . 20 1 1 A 19 19 LEU H H 19 8.799 9.102 -0.303 1
1 219 . 20 1 1 A 19 19 LEU HA H 19 5.416 5.064 0.352 1
1 229 . 20 1 1 A 19 19 LEU C C 19 176.875 176.272 0.603 1
1 230 . 20 1 1 A 19 19 LEU CA C 19 53.281 53.304 -0.023 1
1 231 . 20 1 1 A 19 19 LEU CB C 19 45.508 44.592 0.916 1
1 235 . 20 1 1 A 19 19 LEU N N 19 127.101 126.339 0.762 1
1 236 . 20 1 1 A 20 20 LYS H H 20 8.494 8.903 -0.409 1
1 237 . 20 1 1 A 20 20 LYS HA H 20 5.200 5.396 -0.196 1
1 246 . 20 1 1 A 20 20 LYS C C 20 176.163 175.546 0.617 1
1 247 . 20 1 1 A 20 20 LYS CA C 20 53.575 54.701 -1.126 1
1 248 . 20 1 1 A 20 20 LYS CB C 20 36.835 34.716 2.119 1
1 252 . 20 1 1 A 20 20 LYS N N 20 118.828 119.923 -1.095 1
1 253 . 20 1 1 A 21 21 PHE H H 21 9.658 8.868 0.790 1
1 254 . 20 1 1 A 21 21 PHE HA H 21 4.038 4.694 -0.656 1
1 262 . 20 1 1 A 21 21 PHE C C 21 174.296 175.580 -1.284 1
1 263 . 20 1 1 A 21 21 PHE CA C 21 60.462 59.411 1.051 1
1 264 . 20 1 1 A 21 21 PHE CB C 21 40.359 39.872 0.487 1
1 270 . 20 1 1 A 21 21 PHE N N 21 124.322 127.099 -2.777 1
1 271 . 20 1 1 A 22 22 SER H H 22 7.199 8.697 -1.498 1
1 272 . 20 1 1 A 22 22 SER HA H 22 5.046 4.720 0.326 1
1 275 . 20 1 1 A 22 22 SER C C 22 173.080 173.342 -0.262 1
1 276 . 20 1 1 A 22 22 SER CA C 22 58.547 59.782 -1.235 1
1 277 . 20 1 1 A 22 22 SER CB C 22 63.591 64.546 -0.955 1
1 278 . 20 1 1 A 22 22 SER N N 22 120.109 121.726 -1.617 1
1 279 . 20 1 1 A 23 23 ALA H H 23 7.269 7.050 0.219 1
1 280 . 20 1 1 A 23 23 ALA HA H 23 4.426 4.377 0.049 1
1 284 . 20 1 1 A 23 23 ALA C C 23 176.568 174.504 2.064 1
1 285 . 20 1 1 A 23 23 ALA CA C 23 52.458 51.256 1.202 1
1 286 . 20 1 1 A 23 23 ALA CB C 23 22.728 22.262 0.466 1
1 287 . 20 1 1 A 23 23 ALA N N 23 114.102 119.266 -5.164 1
1 288 . 20 1 1 A 24 24 LEU H H 24 8.819 8.674 0.145 1
1 289 . 20 1 1 A 24 24 LEU HA H 24 4.060 4.611 -0.551 1
1 299 . 20 1 1 A 24 24 LEU C C 24 175.363 176.756 -1.393 1
1 300 . 20 1 1 A 24 24 LEU CA C 24 56.901 54.556 2.345 1
1 301 . 20 1 1 A 24 24 LEU CB C 24 42.065 42.214 -0.149 1
1 305 . 20 1 1 A 24 24 LEU N N 24 120.865 121.079 -0.214 1
1 306 . 20 1 1 A 25 25 ARG H H 25 9.473 8.745 0.728 1
1 307 . 20 1 1 A 25 25 ARG HA H 25 4.428 4.164 0.264 1
1 315 . 20 1 1 A 25 25 ARG C C 25 175.729 175.576 0.153 1
1 316 . 20 1 1 A 25 25 ARG CA C 25 56.721 58.092 -1.371 1
1 317 . 20 1 1 A 25 25 ARG CB C 25 31.109 31.267 -0.158 1
1 320 . 20 1 1 A 25 25 ARG N N 25 130.455 128.199 2.256 1
1 322 . 20 1 1 A 26 26 ARG H H 26 7.711 7.211 0.500 1
1 323 . 20 1 1 A 26 26 ARG HA H 26 4.559 4.622 -0.063 1
1 330 . 20 1 1 A 26 26 ARG C C 26 173.724 173.551 0.173 1
1 331 . 20 1 1 A 26 26 ARG CA C 26 55.737 55.655 0.082 1
1 332 . 20 1 1 A 26 26 ARG CB C 26 33.261 34.197 -0.936 1
1 335 . 20 1 1 A 26 26 ARG N N 26 113.305 118.332 -5.027 1
1 336 . 20 1 1 A 27 27 GLU H H 27 8.848 8.566 0.282 1
1 337 . 20 1 1 A 27 27 GLU HA H 27 4.615 4.676 -0.061 1
1 342 . 20 1 1 A 27 27 GLU C C 27 174.836 175.711 -0.875 1
1 343 . 20 1 1 A 27 27 GLU CA C 27 55.901 55.404 0.497 1
1 344 . 20 1 1 A 27 27 GLU CB C 27 30.755 30.525 0.230 1
1 346 . 20 1 1 A 27 27 GLU N N 27 121.934 125.100 -3.166 1
1 347 . 20 1 1 A 28 28 VAL H H 28 8.603 8.183 0.420 1
1 348 . 20 1 1 A 28 28 VAL HA H 28 4.013 4.192 -0.179 1
1 356 . 20 1 1 A 28 28 VAL C C 28 175.561 175.923 -0.362 1
1 357 . 20 1 1 A 28 28 VAL CA C 28 62.791 61.882 0.909 1
1 358 . 20 1 1 A 28 28 VAL CB C 28 32.710 31.670 1.040 1
1 361 . 20 1 1 A 28 28 VAL N N 28 125.545 123.455 2.090 1
1 362 . 20 1 1 A 29 29 ARG H H 29 8.735 8.737 -0.002 1
1 363 . 20 1 1 A 29 29 ARG HA H 29 4.774 4.690 0.084 1
1 370 . 20 1 1 A 29 29 ARG C C 29 176.580 176.415 0.165 1
1 371 . 20 1 1 A 29 29 ARG CA C 29 55.481 54.187 1.294 1
1 372 . 20 1 1 A 29 29 ARG CB C 29 31.963 31.851 0.112 1
1 375 . 20 1 1 A 29 29 ARG N N 29 128.327 127.287 1.040 1
1 376 . 20 1 1 A 30 30 ILE H H 30 8.358 8.556 -0.198 1
1 377 . 20 1 1 A 30 30 ILE HA H 30 3.882 4.078 -0.196 1
1 387 . 20 1 1 A 30 30 ILE C C 30 175.093 175.342 -0.249 1
1 388 . 20 1 1 A 30 30 ILE CA C 30 61.669 61.676 -0.007 1
1 389 . 20 1 1 A 30 30 ILE CB C 30 38.806 37.058 1.748 1
1 393 . 20 1 1 A 30 30 ILE N N 30 121.957 121.705 0.252 1
1 394 . 20 1 1 A 31 31 GLN H H 31 8.560 8.805 -0.245 1
1 395 . 20 1 1 A 31 31 GLN HA H 31 4.647 4.662 -0.015 1
1 402 . 20 1 1 A 31 31 GLN C C 31 175.954 175.864 0.090 1
1 403 . 20 1 1 A 31 31 GLN CA C 31 54.833 55.253 -0.420 1
1 404 . 20 1 1 A 31 31 GLN CB C 31 30.584 29.889 0.695 1
1 407 . 20 1 1 A 31 31 GLN N N 31 126.348 128.247 -1.899 1
1 409 . 20 1 1 A 32 32 ASN H H 32 8.994 9.005 -0.011 1
1 410 . 20 1 1 A 32 32 ASN HA H 32 4.784 4.764 0.020 1
1 415 . 20 1 1 A 32 32 ASN C C 32 177.296 176.773 0.523 1
1 416 . 20 1 1 A 32 32 ASN CA C 32 53.206 53.401 -0.195 1
1 417 . 20 1 1 A 32 32 ASN CB C 32 39.472 39.638 -0.166 1
1 419 . 20 1 1 A 32 32 ASN N N 32 122.834 125.235 -2.401 1
1 421 . 20 1 1 A 33 33 GLU H H 33 9.180 8.945 0.235 1
1 422 . 20 1 1 A 33 33 GLU HA H 33 4.063 4.064 -0.001 1
1 427 . 20 1 1 A 33 33 GLU C C 33 176.787 178.684 -1.897 1
1 428 . 20 1 1 A 33 33 GLU CA C 33 59.347 58.846 0.501 1
1 429 . 20 1 1 A 33 33 GLU CB C 33 29.294 29.128 0.166 1
1 431 . 20 1 1 A 33 33 GLU N N 33 122.736 121.396 1.340 1
1 432 . 20 1 1 A 34 34 ASP H H 34 7.969 7.922 0.047 1
1 433 . 20 1 1 A 34 34 ASP HA H 34 4.499 4.582 -0.083 1
1 436 . 20 1 1 A 34 34 ASP C C 34 177.111 176.303 0.808 1
1 437 . 20 1 1 A 34 34 ASP CA C 34 53.632 54.625 -0.993 1
1 438 . 20 1 1 A 34 34 ASP CB C 34 39.807 41.293 -1.486 1
1 439 . 20 1 1 A 34 34 ASP N N 34 115.921 119.888 -3.967 1
1 440 . 20 1 1 A 35 35 GLY H H 35 8.083 8.070 0.013 1
1 441 . 20 1 1 A 35 35 GLY HA2 H 35 4.366 4.013 0.353 1
1 442 . 20 1 1 A 35 35 GLY HA3 H 35 3.657 4.014 -0.357 1
1 443 . 20 1 1 A 35 35 GLY C C 35 174.584 174.432 0.152 1
1 444 . 20 1 1 A 35 35 GLY CA C 35 45.134 45.107 0.027 1
1 445 . 20 1 1 A 35 35 GLY N N 35 108.874 108.112 0.762 1
1 446 . 20 1 1 A 36 36 SER H H 36 8.274 7.574 0.700 1
1 447 . 20 1 1 A 36 36 SER HA H 36 4.389 4.521 -0.132 1
1 450 . 20 1 1 A 36 36 SER C C 36 173.284 173.730 -0.446 1
1 451 . 20 1 1 A 36 36 SER CA C 36 58.383 58.612 -0.229 1
1 452 . 20 1 1 A 36 36 SER CB C 36 64.576 64.737 -0.161 1
1 453 . 20 1 1 A 36 36 SER N N 36 117.428 115.445 1.983 1
1 454 . 20 1 1 A 37 37 VAL H H 37 8.508 8.573 -0.065 1
1 455 . 20 1 1 A 37 37 VAL HA H 37 4.346 4.455 -0.109 1
1 463 . 20 1 1 A 37 37 VAL C C 37 176.370 175.471 0.899 1
1 464 . 20 1 1 A 37 37 VAL CA C 37 62.410 61.557 0.853 1
1 465 . 20 1 1 A 37 37 VAL CB C 37 33.086 33.017 0.069 1
1 468 . 20 1 1 A 37 37 VAL N N 37 119.189 123.100 -3.911 1
1 469 . 20 1 1 A 38 38 SER H H 38 8.461 8.701 -0.240 1
1 470 . 20 1 1 A 38 38 SER HA H 38 4.586 4.881 -0.295 1
1 473 . 20 1 1 A 38 38 SER C C 38 173.829 174.487 -0.658 1
1 474 . 20 1 1 A 38 38 SER CA C 38 57.618 56.166 1.452 1
1 475 . 20 1 1 A 38 38 SER CB C 38 64.537 65.453 -0.916 1
1 476 . 20 1 1 A 38 38 SER N N 38 121.629 120.659 0.970 1
1 477 . 20 1 1 A 39 39 ASP H H 39 8.512 8.566 -0.054 1
1 478 . 20 1 1 A 39 39 ASP HA H 39 4.606 4.539 0.067 1
1 481 . 20 1 1 A 39 39 ASP C C 39 176.557 176.926 -0.369 1
1 482 . 20 1 1 A 39 39 ASP CA C 39 54.833 55.742 -0.909 1
1 483 . 20 1 1 A 39 39 ASP CB C 39 41.123 41.429 -0.306 1
1 484 . 20 1 1 A 39 39 ASP N N 39 120.305 123.094 -2.789 1
1 485 . 20 1 1 A 40 40 GLU H H 40 8.311 7.794 0.517 1
1 486 . 20 1 1 A 40 40 GLU HA H 40 4.235 4.385 -0.150 1
1 491 . 20 1 1 A 40 40 GLU C C 40 175.327 176.120 -0.793 1
1 492 . 20 1 1 A 40 40 GLU CA C 40 56.215 56.589 -0.374 1
1 493 . 20 1 1 A 40 40 GLU CB C 40 30.788 30.352 0.436 1
1 495 . 20 1 1 A 40 40 GLU N N 40 120.680 118.316 2.364 1
1 496 . 20 1 1 A 41 41 ILE H H 41 8.465 8.865 -0.400 1
1 497 . 20 1 1 A 41 41 ILE HA H 41 4.127 4.561 -0.434 1
1 507 . 20 1 1 A 41 41 ILE C C 41 175.380 176.256 -0.876 1
1 508 . 20 1 1 A 41 41 ILE CA C 41 60.670 59.806 0.864 1
1 509 . 20 1 1 A 41 41 ILE CB C 41 38.805 39.950 -1.145 1
1 513 . 20 1 1 A 41 41 ILE N N 41 123.665 124.655 -0.990 1
1 514 . 20 1 1 A 42 42 LYS H H 42 9.556 9.041 0.515 1
1 515 . 20 1 1 A 42 42 LYS HA H 42 4.428 4.242 0.186 1
1 524 . 20 1 1 A 42 42 LYS C C 42 177.277 176.829 0.448 1
1 525 . 20 1 1 A 42 42 LYS CA C 42 57.274 58.118 -0.844 1
1 526 . 20 1 1 A 42 42 LYS CB C 42 35.169 33.007 2.162 1
1 530 . 20 1 1 A 42 42 LYS N N 42 125.597 125.544 0.053 1
1 531 . 20 1 1 A 43 43 GLU H H 43 7.809 7.324 0.485 1
1 532 . 20 1 1 A 43 43 GLU HA H 43 4.886 4.848 0.038 1
1 537 . 20 1 1 A 43 43 GLU C C 43 173.593 174.159 -0.566 1
1 538 . 20 1 1 A 43 43 GLU CA C 43 54.669 55.070 -0.401 1
1 539 . 20 1 1 A 43 43 GLU CB C 43 32.882 34.428 -1.546 1
1 541 . 20 1 1 A 43 43 GLU N N 43 115.292 116.564 -1.272 1
1 542 . 20 1 1 A 44 44 ARG H H 44 8.879 8.911 -0.032 1
1 543 . 20 1 1 A 44 44 ARG HA H 44 4.917 4.951 -0.034 1
1 551 . 20 1 1 A 44 44 ARG C C 44 173.708 174.587 -0.879 1
1 552 . 20 1 1 A 44 44 ARG CA C 44 55.965 54.374 1.591 1
1 553 . 20 1 1 A 44 44 ARG CB C 44 33.579 33.293 0.286 1
1 556 . 20 1 1 A 44 44 ARG N N 44 118.233 118.762 -0.529 1
1 558 . 20 1 1 A 45 45 THR H H 45 8.892 8.967 -0.075 1
1 559 . 20 1 1 A 45 45 THR HA H 45 5.308 4.983 0.325 1
1 564 . 20 1 1 A 45 45 THR C C 45 173.357 173.338 0.019 1
1 565 . 20 1 1 A 45 45 THR CA C 45 60.939 61.678 -0.739 1
1 566 . 20 1 1 A 45 45 THR CB C 45 70.054 70.335 -0.281 1
1 568 . 20 1 1 A 45 45 THR N N 45 118.457 118.337 0.120 1
1 569 . 20 1 1 A 46 46 TYR H H 46 9.625 9.733 -0.108 1
1 570 . 20 1 1 A 46 46 TYR HA H 46 4.771 5.259 -0.488 1
1 578 . 20 1 1 A 46 46 TYR C C 46 173.735 174.978 -1.243 1
1 579 . 20 1 1 A 46 46 TYR CA C 46 57.480 55.889 1.591 1
1 580 . 20 1 1 A 46 46 TYR CB C 46 41.724 41.492 0.232 1
1 585 . 20 1 1 A 46 46 TYR N N 46 125.916 126.044 -0.128 1
1 586 . 20 1 1 A 47 47 ASP H H 47 9.006 9.115 -0.109 1
1 587 . 20 1 1 A 47 47 ASP HA H 47 5.399 4.966 0.433 1
1 590 . 20 1 1 A 47 47 ASP C C 47 175.094 174.901 0.193 1
1 591 . 20 1 1 A 47 47 ASP CA C 47 53.460 53.770 -0.310 1
1 592 . 20 1 1 A 47 47 ASP CB C 47 41.947 41.671 0.276 1
1 593 . 20 1 1 A 47 47 ASP N N 47 122.109 123.028 -0.919 1
1 594 . 20 1 1 A 48 48 LEU H H 48 9.066 8.837 0.229 1
1 595 . 20 1 1 A 48 48 LEU HA H 48 4.831 4.992 -0.161 1
1 605 . 20 1 1 A 48 48 LEU C C 48 174.977 175.699 -0.722 1
1 606 . 20 1 1 A 48 48 LEU CA C 48 52.724 53.319 -0.595 1
1 607 . 20 1 1 A 48 48 LEU CB C 48 44.844 44.075 0.769 1
1 611 . 20 1 1 A 48 48 LEU N N 48 121.879 125.928 -4.049 1
1 612 . 20 1 1 A 49 49 LYS H H 49 9.401 9.142 0.259 1
1 613 . 20 1 1 A 49 49 LYS HA H 49 4.477 4.735 -0.258 1
1 622 . 20 1 1 A 49 49 LYS C C 49 176.225 175.704 0.521 1
1 623 . 20 1 1 A 49 49 LYS CA C 49 56.017 54.940 1.077 1
1 624 . 20 1 1 A 49 49 LYS CB C 49 33.838 34.359 -0.521 1
1 628 . 20 1 1 A 49 49 LYS N N 49 122.218 123.846 -1.628 1
1 629 . 20 1 1 A 50 50 SER H H 50 8.266 8.348 -0.082 1
1 630 . 20 1 1 A 50 50 SER HA H 50 5.222 4.896 0.326 1
1 633 . 20 1 1 A 50 50 SER C C 50 175.570 173.029 2.541 1
1 634 . 20 1 1 A 50 50 SER CA C 50 55.770 57.782 -2.012 1
1 635 . 20 1 1 A 50 50 SER CB C 50 64.738 64.660 0.078 1
1 636 . 20 1 1 A 50 50 SER N N 50 117.388 119.150 -1.762 1
1 637 . 20 1 1 A 51 51 LYS H H 51 9.276 8.720 0.556 1
1 638 . 20 1 1 A 51 51 LYS HA H 51 4.208 4.109 0.099 1
1 647 . 20 1 1 A 51 51 LYS C C 51 178.773 176.801 1.972 1
1 648 . 20 1 1 A 51 51 LYS CA C 51 58.674 58.051 0.623 1
1 649 . 20 1 1 A 51 51 LYS CB C 51 33.383 32.464 0.919 1
1 653 . 20 1 1 A 51 51 LYS N N 51 130.550 128.157 2.393 1
1 654 . 20 1 1 A 52 52 GLY H H 52 8.320 8.408 -0.088 1
1 655 . 20 1 1 A 52 52 GLY HA2 H 52 3.875 4.073 -0.198 1
1 656 . 20 1 1 A 52 52 GLY HA3 H 52 3.628 4.074 -0.446 1
1 657 . 20 1 1 A 52 52 GLY C C 52 175.108 174.899 0.209 1
1 658 . 20 1 1 A 52 52 GLY CA C 52 46.322 44.991 1.331 1
1 659 . 20 1 1 A 52 52 GLY N N 52 107.053 114.015 -6.962 1
1 660 . 20 1 1 A 53 53 GLN H H 53 7.859 8.749 -0.890 1
1 661 . 20 1 1 A 53 53 GLN HA H 53 4.409 4.231 0.178 1
1 668 . 20 1 1 A 53 53 GLN C C 53 176.469 177.304 -0.835 1
1 669 . 20 1 1 A 53 53 GLN CA C 53 54.911 55.432 -0.521 1
1 670 . 20 1 1 A 53 53 GLN CB C 53 29.675 28.117 1.558 1
1 673 . 20 1 1 A 53 53 GLN N N 53 115.482 124.938 -9.456 1
1 675 . 20 1 1 A 54 54 GLY H H 54 7.992 8.089 -0.097 1
1 676 . 20 1 1 A 54 54 GLY HA2 H 54 3.934 3.899 0.035 1
1 677 . 20 1 1 A 54 54 GLY HA3 H 54 3.934 3.901 0.033 1
1 678 . 20 1 1 A 54 54 GLY C C 54 173.897 174.729 -0.832 1
1 679 . 20 1 1 A 54 54 GLY CA C 54 46.574 45.878 0.696 1
1 680 . 20 1 1 A 54 54 GLY N N 54 110.111 109.872 0.239 1
1 681 . 20 1 1 A 55 55 ARG H H 55 7.652 7.777 -0.125 1
1 682 . 20 1 1 A 55 55 ARG HA H 55 4.665 4.462 0.203 1
1 690 . 20 1 1 A 55 55 ARG C C 55 174.649 174.660 -0.011 1
1 691 . 20 1 1 A 55 55 ARG CA C 55 54.631 55.789 -1.158 1
1 692 . 20 1 1 A 55 55 ARG CB C 55 32.166 31.791 0.375 1
1 695 . 20 1 1 A 55 55 ARG N N 55 114.214 120.257 -6.043 1
1 697 . 20 1 1 A 56 56 MET H H 56 8.593 8.833 -0.240 1
1 698 . 20 1 1 A 56 56 MET HA H 56 5.012 5.263 -0.251 1
1 703 . 20 1 1 A 56 56 MET C C 56 176.216 174.991 1.225 1
1 704 . 20 1 1 A 56 56 MET CA C 56 54.595 54.140 0.455 1
1 705 . 20 1 1 A 56 56 MET CB C 56 33.466 35.818 -2.352 1
1 707 . 20 1 1 A 56 56 MET N N 56 121.270 121.950 -0.680 1
1 708 . 20 1 1 A 57 57 ILE H H 57 9.393 8.488 0.905 1
1 709 . 20 1 1 A 57 57 ILE HA H 57 4.717 4.755 -0.038 1
1 719 . 20 1 1 A 57 57 ILE C C 57 173.883 173.580 0.303 1
1 720 . 20 1 1 A 57 57 ILE CA C 57 59.713 58.871 0.842 1
1 721 . 20 1 1 A 57 57 ILE CB C 57 40.933 41.556 -0.623 1
1 725 . 20 1 1 A 57 57 ILE N N 57 120.811 119.357 1.454 1
1 726 . 20 1 1 A 58 58 GLN H H 58 8.218 8.144 0.074 1
1 727 . 20 1 1 A 58 58 GLN HA H 58 5.407 4.704 0.703 1
1 734 . 20 1 1 A 58 58 GLN C C 58 175.368 174.381 0.987 1
1 735 . 20 1 1 A 58 58 GLN CA C 58 55.163 55.042 0.121 1
1 736 . 20 1 1 A 58 58 GLN CB C 58 30.841 28.745 2.096 1
1 739 . 20 1 1 A 58 58 GLN N N 58 122.281 122.821 -0.540 1
1 741 . 20 1 1 A 59 59 VAL H H 59 9.188 8.452 0.736 1
1 742 . 20 1 1 A 59 59 VAL HA H 59 5.025 5.020 0.005 1
1 750 . 20 1 1 A 59 59 VAL C C 59 175.330 175.280 0.050 1
1 751 . 20 1 1 A 59 59 VAL CA C 59 59.975 61.380 -1.405 1
1 752 . 20 1 1 A 59 59 VAL CB C 59 34.818 32.646 2.172 1
1 755 . 20 1 1 A 59 59 VAL N N 59 122.421 126.595 -4.174 1
1 756 . 20 1 1 A 60 60 SER H H 60 9.022 9.167 -0.145 1
1 757 . 20 1 1 A 60 60 SER HA H 60 5.811 5.697 0.114 1
1 760 . 20 1 1 A 60 60 SER C C 60 173.234 173.986 -0.752 1
1 761 . 20 1 1 A 60 60 SER CA C 60 57.634 57.116 0.518 1
1 762 . 20 1 1 A 60 60 SER CB C 60 64.891 65.822 -0.931 1
1 763 . 20 1 1 A 60 60 SER N N 60 124.709 124.368 0.341 1
1 764 . 20 1 1 A 61 61 ILE H H 61 9.226 8.968 0.258 1
1 765 . 20 1 1 A 61 61 ILE HA H 61 5.572 4.993 0.579 1
1 775 . 20 1 1 A 61 61 ILE C C 61 173.955 173.591 0.364 1
1 776 . 20 1 1 A 61 61 ILE CA C 61 56.937 57.173 -0.236 1
1 777 . 20 1 1 A 61 61 ILE CB C 61 39.596 40.402 -0.806 1
1 781 . 20 1 1 A 61 61 ILE N N 61 121.648 120.505 1.143 1
1 782 . 20 1 1 A 62 62 PRO HA H 62 4.606 4.523 0.083 1
1 789 . 20 1 1 A 62 62 PRO C C 62 178.143 177.579 0.564 1
1 790 . 20 1 1 A 62 62 PRO CA C 62 63.740 62.887 0.853 1
1 791 . 20 1 1 A 62 62 PRO CB C 62 33.303 32.694 0.609 1
1 794 . 20 1 1 A 63 63 ALA H H 63 7.803 8.382 -0.579 1
1 795 . 20 1 1 A 63 63 ALA HA H 63 4.037 4.100 -0.063 1
1 799 . 20 1 1 A 63 63 ALA C C 63 175.942 179.817 -3.875 1
1 800 . 20 1 1 A 63 63 ALA CA C 63 54.417 55.232 -0.815 1
1 801 . 20 1 1 A 63 63 ALA CB C 63 19.345 17.606 1.739 1
1 802 . 20 1 1 A 63 63 ALA N N 63 123.695 127.481 -3.786 1
1 803 . 20 1 1 A 64 64 SER H H 64 7.719 8.075 -0.356 1
1 804 . 20 1 1 A 64 64 SER HA H 64 4.097 4.403 -0.306 1
1 807 . 20 1 1 A 64 64 SER C C 64 175.199 175.098 0.101 1
1 808 . 20 1 1 A 64 64 SER CA C 64 59.474 61.537 -2.063 1
1 809 . 20 1 1 A 64 64 SER CB C 64 62.125 63.135 -1.010 1
1 810 . 20 1 1 A 64 64 SER N N 64 110.001 111.591 -1.590 1
1 811 . 20 1 1 A 65 65 VAL H H 65 7.790 7.650 0.140 1
1 812 . 20 1 1 A 65 65 VAL HA H 65 4.360 4.136 0.224 1
1 820 . 20 1 1 A 65 65 VAL C C 65 174.433 174.389 0.044 1
1 821 . 20 1 1 A 65 65 VAL CA C 65 60.335 60.717 -0.382 1
1 822 . 20 1 1 A 65 65 VAL CB C 65 32.714 32.209 0.505 1
1 825 . 20 1 1 A 65 65 VAL N N 65 126.142 121.157 4.985 1
1 826 . 20 1 1 A 66 66 PRO HA H 66 4.369 4.610 -0.241 1
1 833 . 20 1 1 A 66 66 PRO C C 66 177.412 176.439 0.973 1
1 834 . 20 1 1 A 66 66 PRO CA C 66 63.104 62.498 0.606 1
1 835 . 20 1 1 A 66 66 PRO CB C 66 32.558 32.187 0.371 1
1 838 . 20 1 1 A 67 67 LEU H H 67 8.578 8.403 0.175 1
1 839 . 20 1 1 A 67 67 LEU HA H 67 3.875 4.303 -0.428 1
1 849 . 20 1 1 A 67 67 LEU C C 67 176.077 176.562 -0.485 1
1 850 . 20 1 1 A 67 67 LEU CA C 67 56.413 55.706 0.707 1
1 851 . 20 1 1 A 67 67 LEU CB C 67 43.279 42.935 0.344 1
1 855 . 20 1 1 A 67 67 LEU N N 67 124.236 123.198 1.038 1
1 856 . 20 1 1 A 68 68 LYS H H 68 7.994 8.688 -0.694 1
1 857 . 20 1 1 A 68 68 LYS HA H 68 3.793 3.472 0.321 1
1 866 . 20 1 1 A 68 68 LYS C C 68 175.601 176.089 -0.488 1
1 867 . 20 1 1 A 68 68 LYS CA C 68 53.350 58.593 -5.243 1
1 868 . 20 1 1 A 68 68 LYS CB C 68 31.035 32.389 -1.354 1
1 872 . 20 1 1 A 68 68 LYS N N 68 124.053 126.773 -2.720 1
1 873 . 20 1 1 A 69 69 GLU H H 69 8.347 7.594 0.753 1
1 874 . 20 1 1 A 69 69 GLU HA H 69 4.501 3.822 0.679 1
1 879 . 20 1 1 A 69 69 GLU C C 69 175.304 175.579 -0.275 1
1 880 . 20 1 1 A 69 69 GLU CA C 69 54.291 57.358 -3.067 1
1 881 . 20 1 1 A 69 69 GLU CB C 69 29.285 27.432 1.853 1
1 883 . 20 1 1 A 69 69 GLU N N 69 123.876 115.853 8.023 1
1 884 . 20 1 1 A 70 70 PHE H H 70 5.549 7.180 -1.631 1
1 885 . 20 1 1 A 70 70 PHE HA H 70 4.592 4.355 0.237 1
1 893 . 20 1 1 A 70 70 PHE C C 70 174.443 175.547 -1.104 1
1 894 . 20 1 1 A 70 70 PHE CA C 70 53.313 57.966 -4.653 1
1 895 . 20 1 1 A 70 70 PHE CB C 70 38.335 39.091 -0.756 1
1 901 . 20 1 1 A 70 70 PHE N N 70 117.781 118.501 -0.720 1
1 902 . 20 1 1 A 71 71 ASP H H 71 8.791 8.832 -0.041 1
1 903 . 20 1 1 A 71 71 ASP HA H 71 4.535 4.776 -0.241 1
1 906 . 20 1 1 A 71 71 ASP C C 71 175.867 176.009 -0.142 1
1 907 . 20 1 1 A 71 71 ASP CA C 71 54.248 54.684 -0.436 1
1 908 . 20 1 1 A 71 71 ASP CB C 71 41.166 41.584 -0.418 1
1 909 . 20 1 1 A 71 71 ASP N N 71 120.385 122.035 -1.650 1
1 910 . 20 1 1 A 72 72 TYR H H 72 8.701 8.738 -0.037 1
1 911 . 20 1 1 A 72 72 TYR HA H 72 4.283 4.567 -0.284 1
1 918 . 20 1 1 A 72 72 TYR C C 72 177.470 176.423 1.047 1
1 919 . 20 1 1 A 72 72 TYR CA C 72 60.513 59.963 0.550 1
1 920 . 20 1 1 A 72 72 TYR CB C 72 38.320 38.394 -0.074 1
1 925 . 20 1 1 A 72 72 TYR N N 72 121.876 123.096 -1.220 1
1 926 . 20 1 1 A 73 73 ASN H H 73 8.819 9.127 -0.308 1
1 927 . 20 1 1 A 73 73 ASN HA H 73 4.096 4.099 -0.003 1
1 932 . 20 1 1 A 73 73 ASN C C 73 174.362 174.361 0.001 1
1 933 . 20 1 1 A 73 73 ASN CA C 73 54.289 54.328 -0.039 1
1 934 . 20 1 1 A 73 73 ASN CB C 73 36.907 36.770 0.137 1
1 936 . 20 1 1 A 73 73 ASN N N 73 121.726 119.168 2.558 1
1 938 . 20 1 1 A 74 74 ALA H H 74 8.059 7.448 0.611 1
1 939 . 20 1 1 A 74 74 ALA HA H 74 4.100 4.444 -0.344 1
1 943 . 20 1 1 A 74 74 ALA C C 74 177.757 177.377 0.380 1
1 944 . 20 1 1 A 74 74 ALA CA C 74 53.153 52.313 0.840 1
1 945 . 20 1 1 A 74 74 ALA CB C 74 19.412 20.076 -0.664 1
1 946 . 20 1 1 A 74 74 ALA N N 74 122.292 120.994 1.298 1
1 947 . 20 1 1 A 75 75 ARG H H 75 8.500 8.442 0.058 1
1 948 . 20 1 1 A 75 75 ARG HA H 75 4.758 4.538 0.220 1
1 955 . 20 1 1 A 75 75 ARG C C 75 176.812 175.959 0.853 1
1 956 . 20 1 1 A 75 75 ARG CA C 75 56.646 56.126 0.520 1
1 957 . 20 1 1 A 75 75 ARG CB C 75 29.375 30.615 -1.240 1
1 960 . 20 1 1 A 75 75 ARG N N 75 122.871 121.189 1.682 1
1 961 . 20 1 1 A 76 76 VAL H H 76 7.965 9.140 -1.175 1
1 962 . 20 1 1 A 76 76 VAL HA H 76 5.230 5.169 0.061 1
1 970 . 20 1 1 A 76 76 VAL C C 76 173.758 174.357 -0.599 1
1 971 . 20 1 1 A 76 76 VAL CA C 76 58.193 59.366 -1.173 1
1 972 . 20 1 1 A 76 76 VAL CB C 76 36.536 35.016 1.520 1
1 975 . 20 1 1 A 76 76 VAL N N 76 116.220 117.940 -1.720 1
1 976 . 20 1 1 A 77 77 GLU H H 77 9.166 9.340 -0.174 1
1 977 . 20 1 1 A 77 77 GLU HA H 77 4.663 4.924 -0.261 1
1 982 . 20 1 1 A 77 77 GLU C C 77 174.940 173.740 1.200 1
1 983 . 20 1 1 A 77 77 GLU CA C 77 53.546 54.331 -0.785 1
1 984 . 20 1 1 A 77 77 GLU CB C 77 33.395 33.395 0.000 1
1 986 . 20 1 1 A 77 77 GLU N N 77 116.413 120.765 -4.352 1
1 987 . 20 1 1 A 78 78 LEU H H 78 8.670 8.942 -0.272 1
1 988 . 20 1 1 A 78 78 LEU HA H 78 4.677 4.877 -0.200 1
1 998 . 20 1 1 A 78 78 LEU C C 78 176.036 176.698 -0.662 1
1 999 . 20 1 1 A 78 78 LEU CA C 78 53.091 53.319 -0.228 1
1 1000 . 20 1 1 A 78 78 LEU CB C 78 43.276 43.688 -0.412 1
1 1004 . 20 1 1 A 78 78 LEU N N 78 117.927 122.700 -4.773 1
1 1005 . 20 1 1 A 79 79 ILE H H 79 7.900 8.684 -0.784 1
1 1006 . 20 1 1 A 79 79 ILE HA H 79 4.312 3.956 0.356 1
1 1016 . 20 1 1 A 79 79 ILE C C 79 175.179 176.437 -1.258 1
1 1017 . 20 1 1 A 79 79 ILE CA C 79 58.294 64.413 -6.119 1
1 1018 . 20 1 1 A 79 79 ILE CB C 79 36.086 38.292 -2.206 1
1 1022 . 20 1 1 A 79 79 ILE N N 79 121.667 125.197 -3.530 1
1 1023 . 20 1 1 A 80 80 ASN H H 80 9.412 8.195 1.217 1
1 1024 . 20 1 1 A 80 80 ASN HA H 80 4.516 5.174 -0.658 1
1 1029 . 20 1 1 A 80 80 ASN C C 80 170.300 172.339 -2.039 1
1 1030 . 20 1 1 A 80 80 ASN CA C 80 54.198 50.460 3.738 1
1 1031 . 20 1 1 A 80 80 ASN CB C 80 37.450 39.113 -1.663 1
1 1033 . 20 1 1 A 80 80 ASN N N 80 123.831 119.335 4.496 1
1 1035 . 20 1 1 A 81 81 PRO HA H 81 5.185 4.772 0.413 1
1 1042 . 20 1 1 A 81 81 PRO C C 81 176.865 176.643 0.222 1
1 1043 . 20 1 1 A 81 81 PRO CA C 81 62.637 62.162 0.475 1
1 1044 . 20 1 1 A 81 81 PRO CB C 81 32.965 32.236 0.729 1
1 1047 . 20 1 1 A 82 82 ILE H H 82 9.374 8.448 0.926 1
1 1048 . 20 1 1 A 82 82 ILE HA H 82 4.524 4.991 -0.467 1
1 1058 . 20 1 1 A 82 82 ILE C C 82 174.731 174.288 0.443 1
1 1059 . 20 1 1 A 82 82 ILE CA C 82 60.205 58.540 1.665 1
1 1060 . 20 1 1 A 82 82 ILE CB C 82 41.737 42.126 -0.389 1
1 1064 . 20 1 1 A 82 82 ILE N N 82 121.658 117.300 4.358 1
1 1065 . 20 1 1 A 83 83 ALA H H 83 8.819 8.700 0.119 1
1 1066 . 20 1 1 A 83 83 ALA HA H 83 4.773 5.014 -0.241 1
1 1070 . 20 1 1 A 83 83 ALA C C 83 176.550 176.374 0.176 1
1 1071 . 20 1 1 A 83 83 ALA CA C 83 52.069 51.026 1.043 1
1 1072 . 20 1 1 A 83 83 ALA CB C 83 20.374 20.200 0.174 1
1 1073 . 20 1 1 A 83 83 ALA N N 83 127.933 124.968 2.965 1
1 1074 . 20 1 1 A 84 84 ASP H H 84 8.710 8.812 -0.102 1
1 1075 . 20 1 1 A 84 84 ASP HA H 84 4.894 5.297 -0.403 1
1 1078 . 20 1 1 A 84 84 ASP C C 84 175.997 176.184 -0.187 1
1 1079 . 20 1 1 A 84 84 ASP CA C 84 53.334 52.815 0.519 1
1 1080 . 20 1 1 A 84 84 ASP CB C 84 42.104 43.495 -1.391 1
1 1081 . 20 1 1 A 84 84 ASP N N 84 122.009 124.250 -2.241 1
1 1082 . 20 1 1 A 85 85 THR H H 85 8.349 8.678 -0.329 1
1 1083 . 20 1 1 A 85 85 THR HA H 85 4.420 4.702 -0.282 1
1 1088 . 20 1 1 A 85 85 THR C C 85 175.085 174.660 0.425 1
1 1089 . 20 1 1 A 85 85 THR CA C 85 62.304 61.187 1.117 1
1 1090 . 20 1 1 A 85 85 THR CB C 85 69.718 70.297 -0.579 1
1 1092 . 20 1 1 A 85 85 THR N N 85 114.986 118.031 -3.045 1
1 1093 . 20 1 1 A 86 86 VAL H H 86 8.188 8.180 0.008 1
1 1094 . 20 1 1 A 86 86 VAL HA H 86 4.021 4.206 -0.185 1
1 1102 . 20 1 1 A 86 86 VAL C C 86 176.519 176.070 0.449 1
1 1103 . 20 1 1 A 86 86 VAL CA C 86 63.046 62.840 0.206 1
1 1104 . 20 1 1 A 86 86 VAL CB C 86 32.526 31.755 0.771 1
1 1107 . 20 1 1 A 86 86 VAL N N 86 122.275 120.077 2.198 1
1 1108 . 20 1 1 A 87 87 ALA H H 87 8.194 7.603 0.591 1
1 1109 . 20 1 1 A 87 87 ALA HA H 87 4.212 4.335 -0.123 1
1 1113 . 20 1 1 A 87 87 ALA C C 87 178.118 178.128 -0.010 1
1 1114 . 20 1 1 A 87 87 ALA CA C 87 53.153 51.479 1.674 1
1 1115 . 20 1 1 A 87 87 ALA CB C 87 19.165 17.140 2.025 1
1 1116 . 20 1 1 A 87 87 ALA N N 87 126.609 125.619 0.990 1
1 1117 . 20 1 1 A 88 88 THR H H 88 7.914 7.962 -0.048 1
1 1118 . 20 1 1 A 88 88 THR HA H 88 4.173 4.289 -0.116 1
1 1123 . 20 1 1 A 88 88 THR C C 88 174.516 174.666 -0.150 1
1 1124 . 20 1 1 A 88 88 THR CA C 88 62.785 63.410 -0.625 1
1 1125 . 20 1 1 A 88 88 THR CB C 88 69.582 69.018 0.564 1
1 1127 . 20 1 1 A 88 88 THR N N 88 112.328 111.902 0.426 1
1 1128 . 20 1 1 A 89 89 ALA H H 89 8.076 7.812 0.264 1
1 1129 . 20 1 1 A 89 89 ALA HA H 89 4.320 4.338 -0.018 1
1 1133 . 20 1 1 A 89 89 ALA C C 89 178.014 177.565 0.449 1
1 1134 . 20 1 1 A 89 89 ALA CA C 89 53.079 51.250 1.829 1
1 1135 . 20 1 1 A 89 89 ALA CB C 89 19.335 19.383 -0.048 1
1 1136 . 20 1 1 A 89 89 ALA N N 89 124.632 124.967 -0.335 1
1 1137 . 20 1 1 A 90 90 THR H H 90 7.976 8.086 -0.110 1
1 1138 . 20 1 1 A 90 90 THR HA H 90 4.203 3.774 0.429 1
1 1143 . 20 1 1 A 90 90 THR C C 90 174.427 174.209 0.218 1
1 1144 . 20 1 1 A 90 90 THR CA C 90 62.519 65.246 -2.727 1
1 1145 . 20 1 1 A 90 90 THR CB C 90 69.721 66.409 3.312 1
1 1147 . 20 1 1 A 90 90 THR N N 90 112.047 114.616 -2.569 1
1 1148 . 20 1 1 A 91 91 TYR H H 91 7.959 7.912 0.047 1
1 1149 . 20 1 1 A 91 91 TYR HA H 91 4.564 4.594 -0.030 1
1 1156 . 20 1 1 A 91 91 TYR C C 91 175.522 175.528 -0.006 1
1 1157 . 20 1 1 A 91 91 TYR CA C 91 57.874 58.641 -0.767 1
1 1158 . 20 1 1 A 91 91 TYR CB C 91 38.584 37.887 0.697 1
1 1163 . 20 1 1 A 91 91 TYR N N 91 121.184 118.818 2.366 1
1 1164 . 20 1 1 A 92 92 GLN H H 92 8.310 7.642 0.668 1
1 1165 . 20 1 1 A 92 92 GLN HA H 92 4.258 3.943 0.315 1
1 1172 . 20 1 1 A 92 92 GLN C C 92 176.099 177.118 -1.019 1
1 1173 . 20 1 1 A 92 92 GLN CA C 92 56.109 57.976 -1.867 1
1 1174 . 20 1 1 A 92 92 GLN CB C 92 29.112 28.461 0.651 1
1 1177 . 20 1 1 A 92 92 GLN N N 92 121.631 122.275 -0.644 1
1 1179 . 20 1 1 A 93 93 GLY H H 93 8.052 9.002 -0.950 1
1 1180 . 20 1 1 A 93 93 GLY HA2 H 93 4.023 4.025 -0.002 1
1 1181 . 20 1 1 A 93 93 GLY HA3 H 93 3.856 4.029 -0.173 1
1 1182 . 20 1 1 A 93 93 GLY C C 93 173.791 174.593 -0.802 1
1 1183 . 20 1 1 A 93 93 GLY CA C 93 45.382 46.392 -1.010 1
1 1184 . 20 1 1 A 93 93 GLY N N 93 109.847 114.920 -5.073 1
1 1185 . 20 1 1 A 94 94 ALA H H 94 8.162 7.899 0.263 1
1 1186 . 20 1 1 A 94 94 ALA HA H 94 4.329 4.754 -0.425 1
1 1190 . 20 1 1 A 94 94 ALA C C 94 177.392 175.585 1.807 1
1 1191 . 20 1 1 A 94 94 ALA CA C 94 52.558 50.750 1.808 1
1 1192 . 20 1 1 A 94 94 ALA CB C 94 19.526 19.374 0.152 1
1 1193 . 20 1 1 A 94 94 ALA N N 94 123.424 122.509 0.915 1
1 1194 . 20 1 1 A 95 95 ASP H H 95 8.457 8.577 -0.120 1
1 1195 . 20 1 1 A 95 95 ASP HA H 95 4.608 4.903 -0.295 1
1 1198 . 20 1 1 A 95 95 ASP C C 95 175.630 176.726 -1.096 1
1 1199 . 20 1 1 A 95 95 ASP CA C 95 54.450 54.687 -0.237 1
1 1200 . 20 1 1 A 95 95 ASP CB C 95 40.871 40.223 0.648 1
1 1201 . 20 1 1 A 95 95 ASP N N 95 118.814 123.192 -4.378 1
1 1202 . 20 1 1 A 96 96 VAL H H 96 7.776 8.590 -0.814 1
1 1203 . 20 1 1 A 96 96 VAL HA H 96 4.141 3.569 0.572 1
1 1211 . 20 1 1 A 96 96 VAL C C 96 175.301 174.999 0.302 1
1 1212 . 20 1 1 A 96 96 VAL CA C 96 61.435 65.465 -4.030 1
1 1213 . 20 1 1 A 96 96 VAL CB C 96 33.517 29.455 4.062 1
1 1216 . 20 1 1 A 96 96 VAL N N 96 118.395 118.836 -0.441 1
1 1217 . 20 1 1 A 97 97 ASP H H 97 8.315 8.468 -0.153 1
1 1218 . 20 1 1 A 97 97 ASP HA H 97 4.681 4.681 0.000 1
1 1221 . 20 1 1 A 97 97 ASP C C 97 175.151 175.331 -0.180 1
1 1222 . 20 1 1 A 97 97 ASP CA C 97 54.324 54.406 -0.082 1
1 1223 . 20 1 1 A 97 97 ASP CB C 97 41.963 41.282 0.681 1
1 1224 . 20 1 1 A 97 97 ASP N N 97 123.905 123.410 0.495 1
1 1225 . 20 1 1 A 98 98 TRP H H 98 8.210 9.118 -0.908 1
1 1226 . 20 1 1 A 98 98 TRP HA H 98 4.916 5.633 -0.717 1
1 1235 . 20 1 1 A 98 98 TRP C C 98 174.585 173.123 1.462 1
1 1236 . 20 1 1 A 98 98 TRP CA C 98 56.164 54.769 1.395 1
1 1237 . 20 1 1 A 98 98 TRP CB C 98 31.466 32.510 -1.044 1
1 1243 . 20 1 1 A 98 98 TRP N N 98 120.340 124.468 -4.128 1
1 1245 . 20 1 1 A 99 99 TYR H H 99 8.760 8.873 -0.113 1
1 1246 . 20 1 1 A 99 99 TYR HA H 99 5.119 5.522 -0.403 1
1 1253 . 20 1 1 A 99 99 TYR C C 99 174.599 174.968 -0.369 1
1 1254 . 20 1 1 A 99 99 TYR CA C 99 57.021 56.178 0.843 1
1 1255 . 20 1 1 A 99 99 TYR CB C 99 39.526 41.839 -2.313 1
1 1260 . 20 1 1 A 99 99 TYR N N 99 123.319 118.155 5.164 1
1 1261 . 20 1 1 A 100 100 ILE H H 100 8.936 8.955 -0.019 1
1 1262 . 20 1 1 A 100 100 ILE HA H 100 4.850 4.748 0.102 1
1 1272 . 20 1 1 A 100 100 ILE C C 100 175.070 174.842 0.228 1
1 1273 . 20 1 1 A 100 100 ILE CA C 100 58.998 60.410 -1.412 1
1 1274 . 20 1 1 A 100 100 ILE CB C 100 40.667 40.005 0.662 1
1 1278 . 20 1 1 A 100 100 ILE N N 100 123.281 120.973 2.308 1
1 1279 . 20 1 1 A 101 101 LYS H H 101 8.987 8.828 0.159 1
1 1280 . 20 1 1 A 101 101 LYS HA H 101 5.313 5.357 -0.044 1
1 1289 . 20 1 1 A 101 101 LYS C C 101 174.440 175.842 -1.402 1
1 1290 . 20 1 1 A 101 101 LYS CA C 101 54.763 55.367 -0.604 1
1 1291 . 20 1 1 A 101 101 LYS CB C 101 34.880 33.711 1.169 1
1 1295 . 20 1 1 A 101 101 LYS N N 101 126.210 127.338 -1.128 1
1 1296 . 20 1 1 A 102 102 ALA H H 102 8.531 8.149 0.382 1
1 1297 . 20 1 1 A 102 102 ALA HA H 102 4.957 5.046 -0.089 1
1 1301 . 20 1 1 A 102 102 ALA C C 102 175.024 177.735 -2.711 1
1 1302 . 20 1 1 A 102 102 ALA CA C 102 50.701 50.041 0.660 1
1 1303 . 20 1 1 A 102 102 ALA CB C 102 21.618 22.411 -0.793 1
1 1304 . 20 1 1 A 102 102 ALA N N 102 121.424 126.179 -4.755 1
1 1305 . 20 1 1 A 103 103 ASP H H 103 8.339 8.852 -0.513 1
1 1306 . 20 1 1 A 103 103 ASP HA H 103 4.603 4.430 0.173 1
1 1309 . 20 1 1 A 103 103 ASP C C 103 176.188 175.368 0.820 1
1 1310 . 20 1 1 A 103 103 ASP CA C 103 56.049 56.640 -0.591 1
1 1311 . 20 1 1 A 103 103 ASP CB C 103 40.932 41.427 -0.495 1
1 1312 . 20 1 1 A 103 103 ASP N N 103 117.773 119.767 -1.994 1
1 1313 . 20 1 1 A 104 104 ASP H H 104 7.482 7.760 -0.278 1
1 1314 . 20 1 1 A 104 104 ASP HA H 104 4.727 4.944 -0.217 1
1 1317 . 20 1 1 A 104 104 ASP C C 104 174.261 173.646 0.615 1
1 1318 . 20 1 1 A 104 104 ASP CA C 104 52.768 53.706 -0.938 1
1 1319 . 20 1 1 A 104 104 ASP CB C 104 42.587 43.880 -1.293 1
1 1320 . 20 1 1 A 104 104 ASP N N 104 110.673 116.658 -5.985 1
1 1321 . 20 1 1 A 105 105 ILE H H 105 9.267 8.570 0.697 1
1 1322 . 20 1 1 A 105 105 ILE HA H 105 4.631 5.032 -0.401 1
1 1332 . 20 1 1 A 105 105 ILE C C 105 173.922 175.206 -1.284 1
1 1333 . 20 1 1 A 105 105 ILE CA C 105 61.114 60.210 0.904 1
1 1334 . 20 1 1 A 105 105 ILE CB C 105 42.522 40.064 2.458 1
1 1338 . 20 1 1 A 105 105 ILE N N 105 121.380 122.465 -1.085 1
1 1339 . 20 1 1 A 106 106 VAL H H 106 8.592 9.056 -0.464 1
1 1340 . 20 1 1 A 106 106 VAL HA H 106 4.975 5.105 -0.130 1
1 1348 . 20 1 1 A 106 106 VAL C C 106 175.049 174.843 0.206 1
1 1349 . 20 1 1 A 106 106 VAL CA C 106 58.028 60.011 -1.983 1
1 1350 . 20 1 1 A 106 106 VAL CB C 106 35.388 36.307 -0.919 1
1 1353 . 20 1 1 A 106 106 VAL N N 106 116.356 120.651 -4.295 1
1 1354 . 20 1 1 A 107 107 LEU H H 107 8.360 8.480 -0.120 1
1 1355 . 20 1 1 A 107 107 LEU HA H 107 4.167 4.808 -0.641 1
1 1365 . 20 1 1 A 107 107 LEU C C 107 178.338 176.997 1.341 1
1 1366 . 20 1 1 A 107 107 LEU CA C 107 55.077 53.427 1.650 1
1 1367 . 20 1 1 A 107 107 LEU CB C 107 42.394 43.291 -0.897 1
1 1371 . 20 1 1 A 107 107 LEU N N 107 121.368 121.978 -0.610 1
1 1372 . 20 1 1 A 108 108 THR H H 108 7.977 8.663 -0.686 1
1 1373 . 20 1 1 A 108 108 THR HA H 108 4.039 4.138 -0.099 1
1 1378 . 20 1 1 A 108 108 THR C C 108 174.725 175.053 -0.328 1
1 1379 . 20 1 1 A 108 108 THR CA C 108 63.513 63.052 0.461 1
1 1380 . 20 1 1 A 108 108 THR CB C 108 69.194 69.486 -0.292 1
1 1382 . 20 1 1 A 108 108 THR N N 108 118.728 118.577 0.151 1
1 1383 . 20 1 1 A 109 109 LEU H H 109 8.378 8.816 -0.438 1
1 1384 . 20 1 1 A 109 109 LEU HA H 109 4.274 3.981 0.293 1
1 1394 . 20 1 1 A 109 109 LEU C C 109 177.058 175.583 1.475 1
1 1395 . 20 1 1 A 109 109 LEU CA C 109 55.045 55.880 -0.835 1
1 1396 . 20 1 1 A 109 109 LEU CB C 109 42.620 39.754 2.866 1
1 1400 . 20 1 1 A 109 109 LEU N N 109 124.847 120.461 4.386 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 108 1.104 1
2 1 1 1 "RMS(OBS, PRED)" CA 108 1.416 1
3 1 1 1 "RMS(OBS, PRED)" CB 102 1.300 1
4 1 1 1 "RMS(OBS, PRED)" H 104 0.547 1
5 1 1 1 "RMS(OBS, PRED)" HA 114 0.342 1
6 1 1 1 "RMS(OBS, PRED)" N 104 3.205 1
7 1 2 1 "RMS(OBS, PRED)" C 108 1.077 1
8 1 2 1 "RMS(OBS, PRED)" CA 108 1.299 1
9 1 2 1 "RMS(OBS, PRED)" CB 102 1.171 1
10 1 2 1 "RMS(OBS, PRED)" H 104 0.476 1
11 1 2 1 "RMS(OBS, PRED)" HA 114 0.296 1
12 1 2 1 "RMS(OBS, PRED)" N 104 2.983 1
13 1 3 1 "RMS(OBS, PRED)" C 108 0.951 1
14 1 3 1 "RMS(OBS, PRED)" CA 108 1.422 1
15 1 3 1 "RMS(OBS, PRED)" CB 102 1.161 1
16 1 3 1 "RMS(OBS, PRED)" H 104 0.467 1
17 1 3 1 "RMS(OBS, PRED)" HA 114 0.311 1
18 1 3 1 "RMS(OBS, PRED)" N 104 2.979 1
19 1 4 1 "RMS(OBS, PRED)" C 108 1.015 1
20 1 4 1 "RMS(OBS, PRED)" CA 108 1.506 1
21 1 4 1 "RMS(OBS, PRED)" CB 102 1.275 1
22 1 4 1 "RMS(OBS, PRED)" H 104 0.533 1
23 1 4 1 "RMS(OBS, PRED)" HA 114 0.358 1
24 1 4 1 "RMS(OBS, PRED)" N 104 2.985 1
25 1 5 1 "RMS(OBS, PRED)" C 108 1.051 1
26 1 5 1 "RMS(OBS, PRED)" CA 108 1.277 1
27 1 5 1 "RMS(OBS, PRED)" CB 102 1.119 1
28 1 5 1 "RMS(OBS, PRED)" H 104 0.546 1
29 1 5 1 "RMS(OBS, PRED)" HA 114 0.314 1
30 1 5 1 "RMS(OBS, PRED)" N 104 2.919 1
31 1 6 1 "RMS(OBS, PRED)" C 108 0.977 1
32 1 6 1 "RMS(OBS, PRED)" CA 108 1.455 1
33 1 6 1 "RMS(OBS, PRED)" CB 102 1.211 1
34 1 6 1 "RMS(OBS, PRED)" H 104 0.524 1
35 1 6 1 "RMS(OBS, PRED)" HA 114 0.343 1
36 1 6 1 "RMS(OBS, PRED)" N 104 3.229 1
37 1 7 1 "RMS(OBS, PRED)" C 108 1.026 1
38 1 7 1 "RMS(OBS, PRED)" CA 108 1.301 1
39 1 7 1 "RMS(OBS, PRED)" CB 102 1.115 1
40 1 7 1 "RMS(OBS, PRED)" H 104 0.499 1
41 1 7 1 "RMS(OBS, PRED)" HA 114 0.302 1
42 1 7 1 "RMS(OBS, PRED)" N 104 3.213 1
43 1 8 1 "RMS(OBS, PRED)" C 108 1.009 1
44 1 8 1 "RMS(OBS, PRED)" CA 108 1.402 1
45 1 8 1 "RMS(OBS, PRED)" CB 102 1.173 1
46 1 8 1 "RMS(OBS, PRED)" H 104 0.467 1
47 1 8 1 "RMS(OBS, PRED)" HA 114 0.333 1
48 1 8 1 "RMS(OBS, PRED)" N 104 3.238 1
49 1 9 1 "RMS(OBS, PRED)" C 108 1.009 1
50 1 9 1 "RMS(OBS, PRED)" CA 108 1.403 1
51 1 9 1 "RMS(OBS, PRED)" CB 102 1.261 1
52 1 9 1 "RMS(OBS, PRED)" H 104 0.472 1
53 1 9 1 "RMS(OBS, PRED)" HA 114 0.321 1
54 1 9 1 "RMS(OBS, PRED)" N 104 3.082 1
55 1 10 1 "RMS(OBS, PRED)" C 108 1.073 1
56 1 10 1 "RMS(OBS, PRED)" CA 108 1.341 1
57 1 10 1 "RMS(OBS, PRED)" CB 102 1.199 1
58 1 10 1 "RMS(OBS, PRED)" H 104 0.462 1
59 1 10 1 "RMS(OBS, PRED)" HA 114 0.300 1
60 1 10 1 "RMS(OBS, PRED)" N 104 3.062 1
61 1 11 1 "RMS(OBS, PRED)" C 108 1.046 1
62 1 11 1 "RMS(OBS, PRED)" CA 108 1.437 1
63 1 11 1 "RMS(OBS, PRED)" CB 102 1.191 1
64 1 11 1 "RMS(OBS, PRED)" H 104 0.480 1
65 1 11 1 "RMS(OBS, PRED)" HA 114 0.311 1
66 1 11 1 "RMS(OBS, PRED)" N 104 3.327 1
67 1 12 1 "RMS(OBS, PRED)" C 108 0.975 1
68 1 12 1 "RMS(OBS, PRED)" CA 108 1.592 1
69 1 12 1 "RMS(OBS, PRED)" CB 102 1.226 1
70 1 12 1 "RMS(OBS, PRED)" H 104 0.506 1
71 1 12 1 "RMS(OBS, PRED)" HA 114 0.337 1
72 1 12 1 "RMS(OBS, PRED)" N 104 3.227 1
73 1 13 1 "RMS(OBS, PRED)" C 108 1.044 1
74 1 13 1 "RMS(OBS, PRED)" CA 108 1.573 1
75 1 13 1 "RMS(OBS, PRED)" CB 102 1.132 1
76 1 13 1 "RMS(OBS, PRED)" H 104 0.514 1
77 1 13 1 "RMS(OBS, PRED)" HA 114 0.296 1
78 1 13 1 "RMS(OBS, PRED)" N 104 3.164 1
79 1 14 1 "RMS(OBS, PRED)" C 108 0.970 1
80 1 14 1 "RMS(OBS, PRED)" CA 108 1.487 1
81 1 14 1 "RMS(OBS, PRED)" CB 102 1.198 1
82 1 14 1 "RMS(OBS, PRED)" H 104 0.501 1
83 1 14 1 "RMS(OBS, PRED)" HA 114 0.327 1
84 1 14 1 "RMS(OBS, PRED)" N 104 3.130 1
85 1 15 1 "RMS(OBS, PRED)" C 108 1.010 1
86 1 15 1 "RMS(OBS, PRED)" CA 108 1.471 1
87 1 15 1 "RMS(OBS, PRED)" CB 102 1.238 1
88 1 15 1 "RMS(OBS, PRED)" H 104 0.476 1
89 1 15 1 "RMS(OBS, PRED)" HA 114 0.332 1
90 1 15 1 "RMS(OBS, PRED)" N 104 2.769 1
91 1 16 1 "RMS(OBS, PRED)" C 108 0.986 1
92 1 16 1 "RMS(OBS, PRED)" CA 108 1.527 1
93 1 16 1 "RMS(OBS, PRED)" CB 102 1.192 1
94 1 16 1 "RMS(OBS, PRED)" H 104 0.474 1
95 1 16 1 "RMS(OBS, PRED)" HA 114 0.330 1
96 1 16 1 "RMS(OBS, PRED)" N 104 3.260 1
97 1 17 1 "RMS(OBS, PRED)" C 108 1.028 1
98 1 17 1 "RMS(OBS, PRED)" CA 108 1.549 1
99 1 17 1 "RMS(OBS, PRED)" CB 102 1.217 1
100 1 17 1 "RMS(OBS, PRED)" H 104 0.504 1
101 1 17 1 "RMS(OBS, PRED)" HA 114 0.311 1
102 1 17 1 "RMS(OBS, PRED)" N 104 3.529 1
103 1 18 1 "RMS(OBS, PRED)" C 108 1.051 1
104 1 18 1 "RMS(OBS, PRED)" CA 108 1.785 1
105 1 18 1 "RMS(OBS, PRED)" CB 102 1.228 1
106 1 18 1 "RMS(OBS, PRED)" H 104 0.473 1
107 1 18 1 "RMS(OBS, PRED)" HA 114 0.350 1
108 1 18 1 "RMS(OBS, PRED)" N 104 3.354 1
109 1 19 1 "RMS(OBS, PRED)" C 108 1.084 1
110 1 19 1 "RMS(OBS, PRED)" CA 108 1.353 1
111 1 19 1 "RMS(OBS, PRED)" CB 102 1.334 1
112 1 19 1 "RMS(OBS, PRED)" H 104 0.526 1
113 1 19 1 "RMS(OBS, PRED)" HA 114 0.324 1
114 1 19 1 "RMS(OBS, PRED)" N 104 3.379 1
115 1 20 1 "RMS(OBS, PRED)" C 108 1.029 1
116 1 20 1 "RMS(OBS, PRED)" CA 108 1.584 1
117 1 20 1 "RMS(OBS, PRED)" CB 102 1.209 1
118 1 20 1 "RMS(OBS, PRED)" H 104 0.497 1
119 1 20 1 "RMS(OBS, PRED)" HA 114 0.327 1
120 1 20 1 "RMS(OBS, PRED)" N 104 3.029 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 9 . 1 1 A 2 2 MET HA H 2 4.554 4.796 -0.242 2
1 14 . 1 1 A 2 2 MET C C 2 174.749 175.007 -0.258 2
1 15 . 1 1 A 2 2 MET CA C 2 55.354 54.377 0.977 2
1 16 . 1 1 A 2 2 MET CB C 2 33.729 34.715 -0.986 2
1 18 . 1 1 A 3 3 ARG H H 3 8.518 8.576 -0.058 2
1 19 . 1 1 A 3 3 ARG HA H 3 4.531 4.626 -0.095 2
1 26 . 1 1 A 3 3 ARG C C 3 175.780 175.368 0.412 2
1 27 . 1 1 A 3 3 ARG CA C 3 55.854 55.757 0.097 2
1 28 . 1 1 A 3 3 ARG CB C 3 31.403 31.109 0.294 2
1 31 . 1 1 A 3 3 ARG N N 3 124.008 122.683 1.325 2
1 32 . 1 1 A 4 4 LEU H H 4 8.424 8.465 -0.041 2
1 33 . 1 1 A 4 4 LEU HA H 4 4.457 4.644 -0.187 2
1 43 . 1 1 A 4 4 LEU C C 4 177.362 176.634 0.728 2
1 44 . 1 1 A 4 4 LEU CA C 4 54.511 54.376 0.135 2
1 45 . 1 1 A 4 4 LEU CB C 4 42.686 43.299 -0.613 2
1 49 . 1 1 A 4 4 LEU N N 4 124.389 124.869 -0.480 2
1 50 . 1 1 A 5 5 ALA H H 5 8.418 8.569 -0.151 2
1 51 . 1 1 A 5 5 ALA HA H 5 4.254 4.530 -0.277 2
1 55 . 1 1 A 5 5 ALA C C 5 177.420 177.191 0.229 2
1 56 . 1 1 A 5 5 ALA CA C 5 52.931 51.987 0.944 2
1 57 . 1 1 A 5 5 ALA CB C 5 19.263 19.893 -0.630 2
1 58 . 1 1 A 5 5 ALA N N 5 124.548 123.970 0.578 2
1 59 . 1 1 A 6 6 ASN H H 6 8.287 8.627 -0.339 2
1 60 . 1 1 A 6 6 ASN HA H 6 4.616 4.886 -0.270 2
1 65 . 1 1 A 6 6 ASN C C 6 175.837 175.361 0.476 2
1 66 . 1 1 A 6 6 ASN CA C 6 53.345 53.158 0.187 2
1 67 . 1 1 A 6 6 ASN CB C 6 38.571 39.508 -0.937 2
1 69 . 1 1 A 6 6 ASN N N 6 116.484 118.844 -2.360 2
1 71 . 1 1 A 7 7 GLY H H 7 8.351 8.246 0.105 2
1 72 . 1 1 A 7 7 GLY HA2 H 7 4.130 4.049 0.081 2
1 73 . 1 1 A 7 7 GLY HA3 H 7 3.808 4.051 -0.243 2
1 74 . 1 1 A 7 7 GLY C C 7 173.750 173.448 0.302 2
1 75 . 1 1 A 7 7 GLY CA C 7 45.343 45.803 -0.460 2
1 76 . 1 1 A 7 7 GLY N N 7 108.453 108.726 -0.273 2
1 77 . 1 1 A 8 8 ILE H H 8 7.868 8.133 -0.265 2
1 78 . 1 1 A 8 8 ILE HA H 8 4.130 4.609 -0.479 2
1 88 . 1 1 A 8 8 ILE C C 8 175.570 175.409 0.161 2
1 89 . 1 1 A 8 8 ILE CA C 8 61.095 59.543 1.552 2
1 90 . 1 1 A 8 8 ILE CB C 8 38.694 40.054 -1.360 2
1 94 . 1 1 A 8 8 ILE N N 8 120.848 118.630 2.218 2
1 95 . 1 1 A 9 9 VAL H H 9 8.220 8.640 -0.420 2
1 96 . 1 1 A 9 9 VAL HA H 9 4.172 4.255 -0.083 2
1 104 . 1 1 A 9 9 VAL C C 9 175.898 175.972 -0.074 2
1 105 . 1 1 A 9 9 VAL CA C 9 62.488 62.445 0.043 2
1 106 . 1 1 A 9 9 VAL CB C 9 32.460 32.576 -0.116 2
1 109 . 1 1 A 9 9 VAL N N 9 125.805 123.056 2.749 2
1 110 . 1 1 A 10 10 LEU H H 10 8.437 8.363 0.074 2
1 111 . 1 1 A 10 10 LEU HA H 10 4.347 4.550 -0.203 2
1 121 . 1 1 A 10 10 LEU C C 10 176.398 176.314 0.084 2
1 122 . 1 1 A 10 10 LEU CA C 10 54.787 54.883 -0.096 2
1 123 . 1 1 A 10 10 LEU CB C 10 42.639 43.374 -0.735 2
1 127 . 1 1 A 10 10 LEU N N 10 127.757 124.347 3.410 2
1 128 . 1 1 A 11 11 ASP H H 11 8.506 8.425 0.081 2
1 129 . 1 1 A 11 11 ASP HA H 11 4.683 4.775 -0.092 2
1 132 . 1 1 A 11 11 ASP C C 11 176.672 175.724 0.948 2
1 133 . 1 1 A 11 11 ASP CA C 11 53.586 54.181 -0.595 2
1 134 . 1 1 A 11 11 ASP CB C 11 41.123 41.539 -0.416 2
1 135 . 1 1 A 11 11 ASP N N 11 121.539 119.624 1.915 2
1 136 . 1 1 A 12 12 LYS H H 12 8.578 8.382 0.196 2
1 137 . 1 1 A 12 12 LYS HA H 12 3.943 4.594 -0.651 2
1 146 . 1 1 A 12 12 LYS C C 12 176.917 175.605 1.312 2
1 147 . 1 1 A 12 12 LYS CA C 12 58.542 55.974 2.568 2
1 148 . 1 1 A 12 12 LYS CB C 12 32.703 34.645 -1.942 2
1 152 . 1 1 A 12 12 LYS N N 12 123.635 121.111 2.524 2
1 153 . 1 1 A 13 13 ASP H H 13 8.523 8.547 -0.024 2
1 154 . 1 1 A 13 13 ASP HA H 13 4.566 4.624 -0.058 2
1 157 . 1 1 A 13 13 ASP C C 13 177.535 176.139 1.396 2
1 158 . 1 1 A 13 13 ASP CA C 13 56.034 54.498 1.536 2
1 159 . 1 1 A 13 13 ASP CB C 13 41.051 40.577 0.474 2
1 160 . 1 1 A 13 13 ASP N N 13 120.448 122.690 -2.242 2
1 161 . 1 1 A 14 14 THR H H 14 7.964 8.302 -0.338 2
1 162 . 1 1 A 14 14 THR HA H 14 4.146 4.302 -0.156 2
1 167 . 1 1 A 14 14 THR C C 14 175.440 174.527 0.913 2
1 168 . 1 1 A 14 14 THR CA C 14 63.245 62.895 0.350 2
1 169 . 1 1 A 14 14 THR CB C 14 69.092 69.282 -0.190 2
1 171 . 1 1 A 14 14 THR N N 14 113.711 116.863 -3.152 2
1 172 . 1 1 A 15 15 THR H H 15 7.921 8.092 -0.171 2
1 173 . 1 1 A 15 15 THR HA H 15 3.920 4.429 -0.509 2
1 178 . 1 1 A 15 15 THR C C 15 174.750 174.335 0.415 2
1 179 . 1 1 A 15 15 THR CA C 15 64.562 61.960 2.602 2
1 180 . 1 1 A 15 15 THR CB C 15 69.166 69.352 -0.186 2
1 182 . 1 1 A 15 15 THR N N 15 116.710 115.305 1.404 2
1 183 . 1 1 A 16 16 PHE H H 16 8.191 8.495 -0.304 2
1 184 . 1 1 A 16 16 PHE HA H 16 4.628 4.657 -0.029 2
1 192 . 1 1 A 16 16 PHE C C 16 177.754 175.937 1.817 2
1 193 . 1 1 A 16 16 PHE CA C 16 57.975 58.085 -0.110 2
1 194 . 1 1 A 16 16 PHE CB C 16 39.553 39.494 0.059 2
1 200 . 1 1 A 16 16 PHE N N 16 117.124 122.141 -5.017 2
1 201 . 1 1 A 17 17 GLY H H 17 8.110 8.473 -0.363 2
1 202 . 1 1 A 17 17 GLY HA2 H 17 4.017 4.076 -0.059 2
1 203 . 1 1 A 17 17 GLY HA3 H 17 3.849 4.084 -0.235 2
1 204 . 1 1 A 17 17 GLY C C 17 172.231 173.567 -1.336 2
1 205 . 1 1 A 17 17 GLY CA C 17 45.633 45.410 0.223 2
1 206 . 1 1 A 17 17 GLY N N 17 109.951 109.240 0.711 2
1 207 . 1 1 A 18 18 GLU H H 18 8.304 8.454 -0.150 2
1 208 . 1 1 A 18 18 GLU HA H 18 4.078 4.540 -0.462 2
1 213 . 1 1 A 18 18 GLU C C 18 175.588 175.916 -0.328 2
1 214 . 1 1 A 18 18 GLU CA C 18 57.446 56.114 1.332 2
1 215 . 1 1 A 18 18 GLU CB C 18 30.767 30.253 0.514 2
1 217 . 1 1 A 18 18 GLU N N 18 121.640 121.462 0.178 2
1 218 . 1 1 A 19 19 LEU H H 19 8.799 8.826 -0.027 2
1 219 . 1 1 A 19 19 LEU HA H 19 5.416 4.848 0.568 2
1 229 . 1 1 A 19 19 LEU C C 19 176.875 176.150 0.725 2
1 230 . 1 1 A 19 19 LEU CA C 19 53.281 54.001 -0.720 2
1 231 . 1 1 A 19 19 LEU CB C 19 45.508 42.856 2.652 2
1 235 . 1 1 A 19 19 LEU N N 19 127.101 126.635 0.466 2
1 236 . 1 1 A 20 20 LYS H H 20 8.494 8.670 -0.176 2
1 237 . 1 1 A 20 20 LYS HA H 20 5.200 5.068 0.132 2
1 246 . 1 1 A 20 20 LYS C C 20 176.163 175.522 0.641 2
1 247 . 1 1 A 20 20 LYS CA C 20 53.575 54.784 -1.209 2
1 248 . 1 1 A 20 20 LYS CB C 20 36.835 34.709 2.126 2
1 252 . 1 1 A 20 20 LYS N N 20 118.828 123.237 -4.409 2
1 253 . 1 1 A 21 21 PHE H H 21 9.658 9.026 0.632 2
1 254 . 1 1 A 21 21 PHE HA H 21 4.038 4.623 -0.585 2
1 262 . 1 1 A 21 21 PHE C C 21 174.296 175.159 -0.863 2
1 263 . 1 1 A 21 21 PHE CA C 21 60.462 58.609 1.853 2
1 264 . 1 1 A 21 21 PHE CB C 21 40.359 39.712 0.647 2
1 270 . 1 1 A 21 21 PHE N N 21 124.322 126.799 -2.477 2
1 271 . 1 1 A 22 22 SER H H 22 7.199 8.375 -1.176 2
1 272 . 1 1 A 22 22 SER HA H 22 5.046 4.417 0.629 2
1 275 . 1 1 A 22 22 SER C C 22 173.080 174.040 -0.960 2
1 276 . 1 1 A 22 22 SER CA C 22 58.547 59.359 -0.812 2
1 277 . 1 1 A 22 22 SER CB C 22 63.591 64.144 -0.553 2
1 278 . 1 1 A 22 22 SER N N 22 120.109 120.830 -0.721 2
1 279 . 1 1 A 23 23 ALA H H 23 7.269 6.949 0.320 2
1 280 . 1 1 A 23 23 ALA HA H 23 4.426 4.398 0.028 2
1 284 . 1 1 A 23 23 ALA C C 23 176.568 174.593 1.975 2
1 285 . 1 1 A 23 23 ALA CA C 23 52.458 51.246 1.212 2
1 286 . 1 1 A 23 23 ALA CB C 23 22.728 22.295 0.433 2
1 287 . 1 1 A 23 23 ALA N N 23 114.102 118.827 -4.725 2
1 288 . 1 1 A 24 24 LEU H H 24 8.819 8.632 0.187 2
1 289 . 1 1 A 24 24 LEU HA H 24 4.060 4.557 -0.497 2
1 299 . 1 1 A 24 24 LEU C C 24 175.363 176.632 -1.269 2
1 300 . 1 1 A 24 24 LEU CA C 24 56.901 54.401 2.500 2
1 301 . 1 1 A 24 24 LEU CB C 24 42.065 42.525 -0.460 2
1 305 . 1 1 A 24 24 LEU N N 24 120.865 120.812 0.053 2
1 306 . 1 1 A 25 25 ARG H H 25 9.473 8.768 0.705 2
1 307 . 1 1 A 25 25 ARG HA H 25 4.428 4.142 0.286 2
1 315 . 1 1 A 25 25 ARG C C 25 175.729 175.629 0.100 2
1 316 . 1 1 A 25 25 ARG CA C 25 56.721 58.114 -1.393 2
1 317 . 1 1 A 25 25 ARG CB C 25 31.109 31.195 -0.086 2
1 320 . 1 1 A 25 25 ARG N N 25 130.455 127.845 2.610 2
1 322 . 1 1 A 26 26 ARG H H 26 7.711 7.312 0.399 2
1 323 . 1 1 A 26 26 ARG HA H 26 4.559 4.584 -0.025 2
1 330 . 1 1 A 26 26 ARG C C 26 173.724 173.618 0.106 2
1 331 . 1 1 A 26 26 ARG CA C 26 55.737 55.776 -0.039 2
1 332 . 1 1 A 26 26 ARG CB C 26 33.261 33.951 -0.690 2
1 335 . 1 1 A 26 26 ARG N N 26 113.305 118.362 -5.057 2
1 336 . 1 1 A 27 27 GLU H H 27 8.848 8.616 0.232 2
1 337 . 1 1 A 27 27 GLU HA H 27 4.615 4.711 -0.096 2
1 342 . 1 1 A 27 27 GLU C C 27 174.836 175.910 -1.074 2
1 343 . 1 1 A 27 27 GLU CA C 27 55.901 55.416 0.485 2
1 344 . 1 1 A 27 27 GLU CB C 27 30.755 30.246 0.509 2
1 346 . 1 1 A 27 27 GLU N N 27 121.934 125.159 -3.224 2
1 347 . 1 1 A 28 28 VAL H H 28 8.603 8.177 0.426 2
1 348 . 1 1 A 28 28 VAL HA H 28 4.013 4.241 -0.228 2
1 356 . 1 1 A 28 28 VAL C C 28 175.561 175.849 -0.288 2
1 357 . 1 1 A 28 28 VAL CA C 28 62.791 61.786 1.005 2
1 358 . 1 1 A 28 28 VAL CB C 28 32.710 32.122 0.588 2
1 361 . 1 1 A 28 28 VAL N N 28 125.545 122.587 2.958 2
1 362 . 1 1 A 29 29 ARG H H 29 8.735 8.555 0.180 2
1 363 . 1 1 A 29 29 ARG HA H 29 4.774 4.654 0.120 2
1 370 . 1 1 A 29 29 ARG C C 29 176.580 176.279 0.301 2
1 371 . 1 1 A 29 29 ARG CA C 29 55.481 54.604 0.877 2
1 372 . 1 1 A 29 29 ARG CB C 29 31.963 31.920 0.043 2
1 375 . 1 1 A 29 29 ARG N N 29 128.327 126.200 2.127 2
1 376 . 1 1 A 30 30 ILE H H 30 8.358 8.594 -0.236 2
1 377 . 1 1 A 30 30 ILE HA H 30 3.882 4.177 -0.295 2
1 387 . 1 1 A 30 30 ILE C C 30 175.093 175.187 -0.094 2
1 388 . 1 1 A 30 30 ILE CA C 30 61.669 61.038 0.631 2
1 389 . 1 1 A 30 30 ILE CB C 30 38.806 37.512 1.294 2
1 393 . 1 1 A 30 30 ILE N N 30 121.957 121.880 0.077 2
1 394 . 1 1 A 31 31 GLN H H 31 8.560 8.776 -0.216 2
1 395 . 1 1 A 31 31 GLN HA H 31 4.647 4.757 -0.110 2
1 402 . 1 1 A 31 31 GLN C C 31 175.954 175.718 0.236 2
1 403 . 1 1 A 31 31 GLN CA C 31 54.833 55.043 -0.210 2
1 404 . 1 1 A 31 31 GLN CB C 31 30.584 30.248 0.336 2
1 407 . 1 1 A 31 31 GLN N N 31 126.348 127.873 -1.525 2
1 409 . 1 1 A 32 32 ASN H H 32 8.994 9.000 -0.006 2
1 410 . 1 1 A 32 32 ASN HA H 32 4.784 4.796 -0.012 2
1 415 . 1 1 A 32 32 ASN C C 32 177.296 176.790 0.506 2
1 416 . 1 1 A 32 32 ASN CA C 32 53.206 53.252 -0.046 2
1 417 . 1 1 A 32 32 ASN CB C 32 39.472 39.429 0.043 2
1 419 . 1 1 A 32 32 ASN N N 32 122.834 125.116 -2.282 2
1 421 . 1 1 A 33 33 GLU H H 33 9.180 8.900 0.280 2
1 422 . 1 1 A 33 33 GLU HA H 33 4.063 4.047 0.016 2
1 427 . 1 1 A 33 33 GLU C C 33 176.787 178.140 -1.353 2
1 428 . 1 1 A 33 33 GLU CA C 33 59.347 59.232 0.115 2
1 429 . 1 1 A 33 33 GLU CB C 33 29.294 29.252 0.042 2
1 431 . 1 1 A 33 33 GLU N N 33 122.736 121.771 0.965 2
1 432 . 1 1 A 34 34 ASP H H 34 7.969 7.944 0.025 2
1 433 . 1 1 A 34 34 ASP HA H 34 4.499 4.559 -0.060 2
1 436 . 1 1 A 34 34 ASP C C 34 177.111 176.290 0.821 2
1 437 . 1 1 A 34 34 ASP CA C 34 53.632 54.585 -0.953 2
1 438 . 1 1 A 34 34 ASP CB C 34 39.807 41.083 -1.276 2
1 439 . 1 1 A 34 34 ASP N N 34 115.921 117.967 -2.046 2
1 440 . 1 1 A 35 35 GLY H H 35 8.083 8.031 0.052 2
1 441 . 1 1 A 35 35 GLY HA2 H 35 4.366 3.993 0.373 2
1 442 . 1 1 A 35 35 GLY HA3 H 35 3.657 3.993 -0.336 2
1 443 . 1 1 A 35 35 GLY C C 35 174.584 174.520 0.064 2
1 444 . 1 1 A 35 35 GLY CA C 35 45.134 45.182 -0.048 2
1 445 . 1 1 A 35 35 GLY N N 35 108.874 107.483 1.391 2
1 446 . 1 1 A 36 36 SER H H 36 8.274 7.887 0.387 2
1 447 . 1 1 A 36 36 SER HA H 36 4.389 4.502 -0.113 2
1 450 . 1 1 A 36 36 SER C C 36 173.284 173.776 -0.492 2
1 451 . 1 1 A 36 36 SER CA C 36 58.383 59.011 -0.628 2
1 452 . 1 1 A 36 36 SER CB C 36 64.576 64.463 0.113 2
1 453 . 1 1 A 36 36 SER N N 36 117.428 117.078 0.350 2
1 454 . 1 1 A 37 37 VAL H H 37 8.508 8.573 -0.065 2
1 455 . 1 1 A 37 37 VAL HA H 37 4.346 4.426 -0.080 2
1 463 . 1 1 A 37 37 VAL C C 37 176.370 175.573 0.797 2
1 464 . 1 1 A 37 37 VAL CA C 37 62.410 61.638 0.772 2
1 465 . 1 1 A 37 37 VAL CB C 37 33.086 32.877 0.209 2
1 468 . 1 1 A 37 37 VAL N N 37 119.189 124.404 -5.216 2
1 469 . 1 1 A 38 38 SER H H 38 8.461 8.905 -0.444 2
1 470 . 1 1 A 38 38 SER HA H 38 4.586 4.711 -0.125 2
1 473 . 1 1 A 38 38 SER C C 38 173.829 174.932 -1.103 2
1 474 . 1 1 A 38 38 SER CA C 38 57.618 57.294 0.324 2
1 475 . 1 1 A 38 38 SER CB C 38 64.537 64.743 -0.206 2
1 476 . 1 1 A 38 38 SER N N 38 121.629 121.034 0.595 2
1 477 . 1 1 A 39 39 ASP H H 39 8.512 8.699 -0.187 2
1 478 . 1 1 A 39 39 ASP HA H 39 4.606 4.524 0.082 2
1 481 . 1 1 A 39 39 ASP C C 39 176.557 176.742 -0.185 2
1 482 . 1 1 A 39 39 ASP CA C 39 54.833 56.019 -1.186 2
1 483 . 1 1 A 39 39 ASP CB C 39 41.123 41.152 -0.029 2
1 484 . 1 1 A 39 39 ASP N N 39 120.305 123.611 -3.306 2
1 485 . 1 1 A 40 40 GLU H H 40 8.311 7.683 0.628 2
1 486 . 1 1 A 40 40 GLU HA H 40 4.235 4.392 -0.157 2
1 491 . 1 1 A 40 40 GLU C C 40 175.327 175.967 -0.640 2
1 492 . 1 1 A 40 40 GLU CA C 40 56.215 56.974 -0.759 2
1 493 . 1 1 A 40 40 GLU CB C 40 30.788 30.230 0.558 2
1 495 . 1 1 A 40 40 GLU N N 40 120.680 118.427 2.253 2
1 496 . 1 1 A 41 41 ILE H H 41 8.465 8.823 -0.358 2
1 497 . 1 1 A 41 41 ILE HA H 41 4.127 4.467 -0.340 2
1 507 . 1 1 A 41 41 ILE C C 41 175.380 175.971 -0.591 2
1 508 . 1 1 A 41 41 ILE CA C 41 60.670 60.112 0.558 2
1 509 . 1 1 A 41 41 ILE CB C 41 38.805 39.608 -0.803 2
1 513 . 1 1 A 41 41 ILE N N 41 123.665 124.043 -0.377 2
1 514 . 1 1 A 42 42 LYS H H 42 9.556 9.181 0.375 2
1 515 . 1 1 A 42 42 LYS HA H 42 4.428 4.350 0.078 2
1 524 . 1 1 A 42 42 LYS C C 42 177.277 176.124 1.153 2
1 525 . 1 1 A 42 42 LYS CA C 42 57.274 57.696 -0.422 2
1 526 . 1 1 A 42 42 LYS CB C 42 35.169 33.629 1.540 2
1 530 . 1 1 A 42 42 LYS N N 42 125.597 126.755 -1.158 2
1 531 . 1 1 A 43 43 GLU H H 43 7.809 7.479 0.331 2
1 532 . 1 1 A 43 43 GLU HA H 43 4.886 4.787 0.099 2
1 537 . 1 1 A 43 43 GLU C C 43 173.593 174.170 -0.577 2
1 538 . 1 1 A 43 43 GLU CA C 43 54.669 55.100 -0.431 2
1 539 . 1 1 A 43 43 GLU CB C 43 32.882 33.441 -0.559 2
1 541 . 1 1 A 43 43 GLU N N 43 115.292 115.268 0.024 2
1 542 . 1 1 A 44 44 ARG H H 44 8.879 8.863 0.016 2
1 543 . 1 1 A 44 44 ARG HA H 44 4.917 4.946 -0.029 2
1 551 . 1 1 A 44 44 ARG C C 44 173.708 174.811 -1.103 2
1 552 . 1 1 A 44 44 ARG CA C 44 55.965 54.695 1.270 2
1 553 . 1 1 A 44 44 ARG CB C 44 33.579 32.555 1.024 2
1 556 . 1 1 A 44 44 ARG N N 44 118.233 121.136 -2.903 2
1 558 . 1 1 A 45 45 THR H H 45 8.892 8.990 -0.098 2
1 559 . 1 1 A 45 45 THR HA H 45 5.308 5.050 0.258 2
1 564 . 1 1 A 45 45 THR C C 45 173.357 173.264 0.093 2
1 565 . 1 1 A 45 45 THR CA C 45 60.939 61.958 -1.019 2
1 566 . 1 1 A 45 45 THR CB C 45 70.054 69.927 0.127 2
1 568 . 1 1 A 45 45 THR N N 45 118.457 120.302 -1.846 2
1 569 . 1 1 A 46 46 TYR H H 46 9.625 9.613 0.012 2
1 570 . 1 1 A 46 46 TYR HA H 46 4.771 5.120 -0.349 2
1 578 . 1 1 A 46 46 TYR C C 46 173.735 175.018 -1.283 2
1 579 . 1 1 A 46 46 TYR CA C 46 57.480 56.272 1.208 2
1 580 . 1 1 A 46 46 TYR CB C 46 41.724 41.863 -0.139 2
1 585 . 1 1 A 46 46 TYR N N 46 125.916 126.223 -0.307 2
1 586 . 1 1 A 47 47 ASP H H 47 9.006 8.992 0.014 2
1 587 . 1 1 A 47 47 ASP HA H 47 5.399 4.977 0.422 2
1 590 . 1 1 A 47 47 ASP C C 47 175.094 174.966 0.128 2
1 591 . 1 1 A 47 47 ASP CA C 47 53.460 53.818 -0.358 2
1 592 . 1 1 A 47 47 ASP CB C 47 41.947 41.743 0.204 2
1 593 . 1 1 A 47 47 ASP N N 47 122.109 122.721 -0.612 2
1 594 . 1 1 A 48 48 LEU H H 48 9.066 8.730 0.336 2
1 595 . 1 1 A 48 48 LEU HA H 48 4.831 5.050 -0.219 2
1 605 . 1 1 A 48 48 LEU C C 48 174.977 175.625 -0.648 2
1 606 . 1 1 A 48 48 LEU CA C 48 52.724 53.328 -0.604 2
1 607 . 1 1 A 48 48 LEU CB C 48 44.844 44.367 0.478 2
1 611 . 1 1 A 48 48 LEU N N 48 121.879 125.468 -3.589 2
1 612 . 1 1 A 49 49 LYS H H 49 9.401 8.771 0.630 2
1 613 . 1 1 A 49 49 LYS HA H 49 4.477 4.774 -0.297 2
1 622 . 1 1 A 49 49 LYS C C 49 176.225 175.714 0.511 2
1 623 . 1 1 A 49 49 LYS CA C 49 56.017 55.202 0.815 2
1 624 . 1 1 A 49 49 LYS CB C 49 33.838 34.049 -0.211 2
1 628 . 1 1 A 49 49 LYS N N 49 122.218 123.829 -1.611 2
1 629 . 1 1 A 50 50 SER H H 50 8.266 8.742 -0.476 2
1 630 . 1 1 A 50 50 SER HA H 50 5.222 5.015 0.207 2
1 633 . 1 1 A 50 50 SER C C 50 175.570 174.240 1.330 2
1 634 . 1 1 A 50 50 SER CA C 50 55.770 57.222 -1.452 2
1 635 . 1 1 A 50 50 SER CB C 50 64.738 64.772 -0.034 2
1 636 . 1 1 A 50 50 SER N N 50 117.388 118.743 -1.355 2
1 637 . 1 1 A 51 51 LYS H H 51 9.276 8.681 0.595 2
1 638 . 1 1 A 51 51 LYS HA H 51 4.208 4.209 -0.001 2
1 647 . 1 1 A 51 51 LYS C C 51 178.773 177.706 1.067 2
1 648 . 1 1 A 51 51 LYS CA C 51 58.674 57.621 1.053 2
1 649 . 1 1 A 51 51 LYS CB C 51 33.383 32.656 0.727 2
1 653 . 1 1 A 51 51 LYS N N 51 130.550 125.214 5.336 2
1 654 . 1 1 A 52 52 GLY H H 52 8.320 8.432 -0.112 2
1 655 . 1 1 A 52 52 GLY HA2 H 52 3.875 3.953 -0.078 2
1 656 . 1 1 A 52 52 GLY HA3 H 52 3.628 3.972 -0.344 2
1 657 . 1 1 A 52 52 GLY C C 52 175.108 175.221 -0.113 2
1 658 . 1 1 A 52 52 GLY CA C 52 46.322 46.199 0.123 2
1 659 . 1 1 A 52 52 GLY N N 52 107.053 110.338 -3.285 2
1 660 . 1 1 A 53 53 GLN H H 53 7.859 8.218 -0.359 2
1 661 . 1 1 A 53 53 GLN HA H 53 4.409 4.385 0.024 2
1 668 . 1 1 A 53 53 GLN C C 53 176.469 176.434 0.035 2
1 669 . 1 1 A 53 53 GLN CA C 53 54.911 55.992 -1.081 2
1 670 . 1 1 A 53 53 GLN CB C 53 29.675 29.472 0.203 2
1 673 . 1 1 A 53 53 GLN N N 53 115.482 121.295 -5.813 2
1 675 . 1 1 A 54 54 GLY H H 54 7.992 8.440 -0.448 2
1 676 . 1 1 A 54 54 GLY HA2 H 54 3.934 3.928 0.006 2
1 677 . 1 1 A 54 54 GLY HA3 H 54 3.934 3.933 0.001 2
1 678 . 1 1 A 54 54 GLY C C 54 173.897 173.998 -0.101 2
1 679 . 1 1 A 54 54 GLY CA C 54 46.574 46.119 0.455 2
1 680 . 1 1 A 54 54 GLY N N 54 110.111 108.927 1.184 2
1 681 . 1 1 A 55 55 ARG H H 55 7.652 7.707 -0.055 2
1 682 . 1 1 A 55 55 ARG HA H 55 4.665 4.810 -0.145 2
1 690 . 1 1 A 55 55 ARG C C 55 174.649 175.122 -0.473 2
1 691 . 1 1 A 55 55 ARG CA C 55 54.631 54.585 0.046 2
1 692 . 1 1 A 55 55 ARG CB C 55 32.166 33.078 -0.912 2
1 695 . 1 1 A 55 55 ARG N N 55 114.214 118.337 -4.123 2
1 697 . 1 1 A 56 56 MET H H 56 8.593 8.778 -0.185 2
1 698 . 1 1 A 56 56 MET HA H 56 5.012 5.149 -0.137 2
1 703 . 1 1 A 56 56 MET C C 56 176.216 175.594 0.622 2
1 704 . 1 1 A 56 56 MET CA C 56 54.595 53.905 0.690 2
1 705 . 1 1 A 56 56 MET CB C 56 33.466 34.184 -0.718 2
1 707 . 1 1 A 56 56 MET N N 56 121.270 119.759 1.511 2
1 708 . 1 1 A 57 57 ILE H H 57 9.393 8.775 0.618 2
1 709 . 1 1 A 57 57 ILE HA H 57 4.717 4.587 0.130 2
1 719 . 1 1 A 57 57 ILE C C 57 173.883 174.221 -0.338 2
1 720 . 1 1 A 57 57 ILE CA C 57 59.713 58.992 0.721 2
1 721 . 1 1 A 57 57 ILE CB C 57 40.933 40.362 0.571 2
1 725 . 1 1 A 57 57 ILE N N 57 120.811 118.268 2.543 2
1 726 . 1 1 A 58 58 GLN H H 58 8.218 8.022 0.196 2
1 727 . 1 1 A 58 58 GLN HA H 58 5.407 4.699 0.708 2
1 734 . 1 1 A 58 58 GLN C C 58 175.368 174.480 0.888 2
1 735 . 1 1 A 58 58 GLN CA C 58 55.163 55.089 0.074 2
1 736 . 1 1 A 58 58 GLN CB C 58 30.841 28.961 1.880 2
1 739 . 1 1 A 58 58 GLN N N 58 122.281 122.818 -0.537 2
1 741 . 1 1 A 59 59 VAL H H 59 9.188 8.570 0.618 2
1 742 . 1 1 A 59 59 VAL HA H 59 5.025 5.121 -0.096 2
1 750 . 1 1 A 59 59 VAL C C 59 175.330 175.055 0.275 2
1 751 . 1 1 A 59 59 VAL CA C 59 59.975 61.306 -1.331 2
1 752 . 1 1 A 59 59 VAL CB C 59 34.818 32.877 1.941 2
1 755 . 1 1 A 59 59 VAL N N 59 122.421 126.570 -4.149 2
1 756 . 1 1 A 60 60 SER H H 60 9.022 9.054 -0.032 2
1 757 . 1 1 A 60 60 SER HA H 60 5.811 5.612 0.199 2
1 760 . 1 1 A 60 60 SER C C 60 173.234 173.726 -0.492 2
1 761 . 1 1 A 60 60 SER CA C 60 57.634 57.011 0.623 2
1 762 . 1 1 A 60 60 SER CB C 60 64.891 64.903 -0.012 2
1 763 . 1 1 A 60 60 SER N N 60 124.709 123.375 1.334 2
1 764 . 1 1 A 61 61 ILE H H 61 9.226 8.895 0.331 2
1 765 . 1 1 A 61 61 ILE HA H 61 5.572 4.984 0.588 2
1 775 . 1 1 A 61 61 ILE C C 61 173.955 173.902 0.053 2
1 776 . 1 1 A 61 61 ILE CA C 61 56.937 57.220 -0.283 2
1 777 . 1 1 A 61 61 ILE CB C 61 39.596 39.950 -0.354 2
1 781 . 1 1 A 61 61 ILE N N 61 121.648 121.163 0.485 2
1 782 . 1 1 A 62 62 PRO HA H 62 4.606 4.528 0.078 2
1 789 . 1 1 A 62 62 PRO C C 62 178.143 177.442 0.701 2
1 790 . 1 1 A 62 62 PRO CA C 62 63.740 62.904 0.836 2
1 791 . 1 1 A 62 62 PRO CB C 62 33.303 32.685 0.618 2
1 794 . 1 1 A 63 63 ALA H H 63 7.803 8.658 -0.855 2
1 795 . 1 1 A 63 63 ALA HA H 63 4.037 4.054 -0.017 2
1 799 . 1 1 A 63 63 ALA C C 63 175.942 179.390 -3.448 2
1 800 . 1 1 A 63 63 ALA CA C 63 54.417 54.794 -0.377 2
1 801 . 1 1 A 63 63 ALA CB C 63 19.345 18.118 1.227 2
1 802 . 1 1 A 63 63 ALA N N 63 123.695 127.245 -3.550 2
1 803 . 1 1 A 64 64 SER H H 64 7.719 7.998 -0.279 2
1 804 . 1 1 A 64 64 SER HA H 64 4.097 4.310 -0.213 2
1 807 . 1 1 A 64 64 SER C C 64 175.199 174.566 0.633 2
1 808 . 1 1 A 64 64 SER CA C 64 59.474 60.767 -1.293 2
1 809 . 1 1 A 64 64 SER CB C 64 62.125 63.164 -1.039 2
1 810 . 1 1 A 64 64 SER N N 64 110.001 111.875 -1.874 2
1 811 . 1 1 A 65 65 VAL H H 65 7.790 7.723 0.067 2
1 812 . 1 1 A 65 65 VAL HA H 65 4.360 4.224 0.136 2
1 820 . 1 1 A 65 65 VAL C C 65 174.433 174.304 0.129 2
1 821 . 1 1 A 65 65 VAL CA C 65 60.335 59.995 0.340 2
1 822 . 1 1 A 65 65 VAL CB C 65 32.714 32.384 0.330 2
1 825 . 1 1 A 65 65 VAL N N 65 126.142 122.637 3.505 2
1 826 . 1 1 A 66 66 PRO HA H 66 4.369 4.530 -0.161 2
1 833 . 1 1 A 66 66 PRO C C 66 177.412 176.378 1.034 2
1 834 . 1 1 A 66 66 PRO CA C 66 63.104 62.694 0.409 2
1 835 . 1 1 A 66 66 PRO CB C 66 32.558 32.221 0.337 2
1 838 . 1 1 A 67 67 LEU H H 67 8.578 8.363 0.215 2
1 839 . 1 1 A 67 67 LEU HA H 67 3.875 4.495 -0.620 2
1 849 . 1 1 A 67 67 LEU C C 67 176.077 176.364 -0.287 2
1 850 . 1 1 A 67 67 LEU CA C 67 56.413 55.470 0.943 2
1 851 . 1 1 A 67 67 LEU CB C 67 43.279 43.023 0.256 2
1 855 . 1 1 A 67 67 LEU N N 67 124.236 123.243 0.993 2
1 856 . 1 1 A 68 68 LYS H H 68 7.994 8.550 -0.556 2
1 857 . 1 1 A 68 68 LYS HA H 68 3.793 3.890 -0.097 2
1 866 . 1 1 A 68 68 LYS C C 68 175.601 175.821 -0.220 2
1 867 . 1 1 A 68 68 LYS CA C 68 53.350 56.995 -3.645 2
1 868 . 1 1 A 68 68 LYS CB C 68 31.035 32.249 -1.214 2
1 872 . 1 1 A 68 68 LYS N N 68 124.053 126.285 -2.232 2
1 873 . 1 1 A 69 69 GLU H H 69 8.347 8.030 0.317 2
1 874 . 1 1 A 69 69 GLU HA H 69 4.501 4.135 0.366 2
1 879 . 1 1 A 69 69 GLU C C 69 175.304 175.459 -0.155 2
1 880 . 1 1 A 69 69 GLU CA C 69 54.291 56.430 -2.139 2
1 881 . 1 1 A 69 69 GLU CB C 69 29.285 28.168 1.117 2
1 883 . 1 1 A 69 69 GLU N N 69 123.876 119.937 3.939 2
1 884 . 1 1 A 70 70 PHE H H 70 5.549 7.207 -1.658 2
1 885 . 1 1 A 70 70 PHE HA H 70 4.592 4.457 0.134 2
1 893 . 1 1 A 70 70 PHE C C 70 174.443 175.225 -0.782 2
1 894 . 1 1 A 70 70 PHE CA C 70 53.313 57.678 -4.365 2
1 895 . 1 1 A 70 70 PHE CB C 70 38.335 39.572 -1.237 2
1 901 . 1 1 A 70 70 PHE N N 70 117.781 119.710 -1.929 2
1 902 . 1 1 A 71 71 ASP H H 71 8.791 8.726 0.065 2
1 903 . 1 1 A 71 71 ASP HA H 71 4.535 4.866 -0.331 2
1 906 . 1 1 A 71 71 ASP C C 71 175.867 175.939 -0.072 2
1 907 . 1 1 A 71 71 ASP CA C 71 54.248 53.880 0.368 2
1 908 . 1 1 A 71 71 ASP CB C 71 41.166 41.916 -0.751 2
1 909 . 1 1 A 71 71 ASP N N 71 120.385 121.290 -0.905 2
1 910 . 1 1 A 72 72 TYR H H 72 8.701 8.751 -0.050 2
1 911 . 1 1 A 72 72 TYR HA H 72 4.283 4.568 -0.285 2
1 918 . 1 1 A 72 72 TYR C C 72 177.470 176.384 1.086 2
1 919 . 1 1 A 72 72 TYR CA C 72 60.513 59.774 0.739 2
1 920 . 1 1 A 72 72 TYR CB C 72 38.320 38.492 -0.172 2
1 925 . 1 1 A 72 72 TYR N N 72 121.876 123.760 -1.884 2
1 926 . 1 1 A 73 73 ASN H H 73 8.819 8.958 -0.139 2
1 927 . 1 1 A 73 73 ASN HA H 73 4.096 4.224 -0.128 2
1 932 . 1 1 A 73 73 ASN C C 73 174.362 174.522 -0.160 2
1 933 . 1 1 A 73 73 ASN CA C 73 54.289 54.138 0.151 2
1 934 . 1 1 A 73 73 ASN CB C 73 36.907 37.029 -0.122 2
1 936 . 1 1 A 73 73 ASN N N 73 121.726 119.310 2.416 2
1 938 . 1 1 A 74 74 ALA H H 74 8.059 7.586 0.473 2
1 939 . 1 1 A 74 74 ALA HA H 74 4.100 4.341 -0.241 2
1 943 . 1 1 A 74 74 ALA C C 74 177.757 177.339 0.418 2
1 944 . 1 1 A 74 74 ALA CA C 74 53.153 52.368 0.785 2
1 945 . 1 1 A 74 74 ALA CB C 74 19.412 19.600 -0.188 2
1 946 . 1 1 A 74 74 ALA N N 74 122.292 121.005 1.287 2
1 947 . 1 1 A 75 75 ARG H H 75 8.500 8.475 0.025 2
1 948 . 1 1 A 75 75 ARG HA H 75 4.758 4.623 0.135 2
1 955 . 1 1 A 75 75 ARG C C 75 176.812 175.989 0.823 2
1 956 . 1 1 A 75 75 ARG CA C 75 56.646 56.213 0.433 2
1 957 . 1 1 A 75 75 ARG CB C 75 29.375 30.619 -1.244 2
1 960 . 1 1 A 75 75 ARG N N 75 122.871 122.118 0.753 2
1 961 . 1 1 A 76 76 VAL H H 76 7.965 9.047 -1.082 2
1 962 . 1 1 A 76 76 VAL HA H 76 5.230 4.949 0.281 2
1 970 . 1 1 A 76 76 VAL C C 76 173.758 174.417 -0.658 2
1 971 . 1 1 A 76 76 VAL CA C 76 58.193 58.968 -0.775 2
1 972 . 1 1 A 76 76 VAL CB C 76 36.536 35.337 1.199 2
1 975 . 1 1 A 76 76 VAL N N 76 116.220 118.326 -2.106 2
1 976 . 1 1 A 77 77 GLU H H 77 9.166 9.263 -0.097 2
1 977 . 1 1 A 77 77 GLU HA H 77 4.663 4.991 -0.328 2
1 982 . 1 1 A 77 77 GLU C C 77 174.940 174.545 0.395 2
1 983 . 1 1 A 77 77 GLU CA C 77 53.546 54.339 -0.793 2
1 984 . 1 1 A 77 77 GLU CB C 77 33.395 33.538 -0.143 2
1 986 . 1 1 A 77 77 GLU N N 77 116.413 121.437 -5.024 2
1 987 . 1 1 A 78 78 LEU H H 78 8.670 8.876 -0.206 2
1 988 . 1 1 A 78 78 LEU HA H 78 4.677 4.879 -0.202 2
1 998 . 1 1 A 78 78 LEU C C 78 176.036 176.356 -0.320 2
1 999 . 1 1 A 78 78 LEU CA C 78 53.091 53.523 -0.432 2
1 1000 . 1 1 A 78 78 LEU CB C 78 43.276 43.672 -0.396 2
1 1004 . 1 1 A 78 78 LEU N N 78 117.927 123.429 -5.502 2
1 1005 . 1 1 A 79 79 ILE H H 79 7.900 8.716 -0.816 2
1 1006 . 1 1 A 79 79 ILE HA H 79 4.312 4.158 0.154 2
1 1016 . 1 1 A 79 79 ILE C C 79 175.179 176.201 -1.022 2
1 1017 . 1 1 A 79 79 ILE CA C 79 58.294 62.682 -4.388 2
1 1018 . 1 1 A 79 79 ILE CB C 79 36.086 38.036 -1.950 2
1 1022 . 1 1 A 79 79 ILE N N 79 121.667 124.394 -2.727 2
1 1023 . 1 1 A 80 80 ASN H H 80 9.412 8.533 0.879 2
1 1024 . 1 1 A 80 80 ASN HA H 80 4.516 4.823 -0.307 2
1 1029 . 1 1 A 80 80 ASN C C 80 170.300 172.831 -2.531 2
1 1030 . 1 1 A 80 80 ASN CA C 80 54.198 51.813 2.385 2
1 1031 . 1 1 A 80 80 ASN CB C 80 37.450 38.361 -0.911 2
1 1033 . 1 1 A 80 80 ASN N N 80 123.831 120.405 3.426 2
1 1035 . 1 1 A 81 81 PRO HA H 81 5.185 4.877 0.308 2
1 1042 . 1 1 A 81 81 PRO C C 81 176.865 176.505 0.360 2
1 1043 . 1 1 A 81 81 PRO CA C 81 62.637 62.345 0.292 2
1 1044 . 1 1 A 81 81 PRO CB C 81 32.965 32.317 0.648 2
1 1047 . 1 1 A 82 82 ILE H H 82 9.374 8.570 0.804 2
1 1048 . 1 1 A 82 82 ILE HA H 82 4.524 5.021 -0.497 2
1 1058 . 1 1 A 82 82 ILE C C 82 174.731 174.436 0.295 2
1 1059 . 1 1 A 82 82 ILE CA C 82 60.205 58.658 1.547 2
1 1060 . 1 1 A 82 82 ILE CB C 82 41.737 41.555 0.182 2
1 1064 . 1 1 A 82 82 ILE N N 82 121.658 117.393 4.265 2
1 1065 . 1 1 A 83 83 ALA H H 83 8.819 8.781 0.038 2
1 1066 . 1 1 A 83 83 ALA HA H 83 4.773 4.761 0.012 2
1 1070 . 1 1 A 83 83 ALA C C 83 176.550 176.634 -0.084 2
1 1071 . 1 1 A 83 83 ALA CA C 83 52.069 51.785 0.284 2
1 1072 . 1 1 A 83 83 ALA CB C 83 20.374 19.591 0.783 2
1 1073 . 1 1 A 83 83 ALA N N 83 127.933 126.816 1.117 2
1 1074 . 1 1 A 84 84 ASP H H 84 8.710 8.774 -0.064 2
1 1075 . 1 1 A 84 84 ASP HA H 84 4.894 4.908 -0.014 2
1 1078 . 1 1 A 84 84 ASP C C 84 175.997 176.501 -0.504 2
1 1079 . 1 1 A 84 84 ASP CA C 84 53.334 53.823 -0.489 2
1 1080 . 1 1 A 84 84 ASP CB C 84 42.104 42.205 -0.101 2
1 1081 . 1 1 A 84 84 ASP N N 84 122.009 123.875 -1.866 2
1 1082 . 1 1 A 85 85 THR H H 85 8.349 8.578 -0.229 2
1 1083 . 1 1 A 85 85 THR HA H 85 4.420 4.546 -0.126 2
1 1088 . 1 1 A 85 85 THR C C 85 175.085 175.142 -0.057 2
1 1089 . 1 1 A 85 85 THR CA C 85 62.304 62.781 -0.477 2
1 1090 . 1 1 A 85 85 THR CB C 85 69.718 69.412 0.306 2
1 1092 . 1 1 A 85 85 THR N N 85 114.986 117.085 -2.099 2
1 1093 . 1 1 A 86 86 VAL H H 86 8.188 7.997 0.191 2
1 1094 . 1 1 A 86 86 VAL HA H 86 4.021 4.124 -0.103 2
1 1102 . 1 1 A 86 86 VAL C C 86 176.519 176.914 -0.395 2
1 1103 . 1 1 A 86 86 VAL CA C 86 63.046 63.306 -0.260 2
1 1104 . 1 1 A 86 86 VAL CB C 86 32.526 32.061 0.465 2
1 1107 . 1 1 A 86 86 VAL N N 86 122.275 120.403 1.872 2
1 1108 . 1 1 A 87 87 ALA H H 87 8.194 8.288 -0.094 2
1 1109 . 1 1 A 87 87 ALA HA H 87 4.212 4.198 0.014 2
1 1113 . 1 1 A 87 87 ALA C C 87 178.118 178.945 -0.827 2
1 1114 . 1 1 A 87 87 ALA CA C 87 53.153 54.478 -1.325 2
1 1115 . 1 1 A 87 87 ALA CB C 87 19.165 18.407 0.758 2
1 1116 . 1 1 A 87 87 ALA N N 87 126.609 125.464 1.145 2
1 1117 . 1 1 A 88 88 THR H H 88 7.914 8.050 -0.136 2
1 1118 . 1 1 A 88 88 THR HA H 88 4.173 4.267 -0.094 2
1 1123 . 1 1 A 88 88 THR C C 88 174.516 175.878 -1.362 2
1 1124 . 1 1 A 88 88 THR CA C 88 62.785 64.338 -1.553 2
1 1125 . 1 1 A 88 88 THR CB C 88 69.582 68.700 0.882 2
1 1127 . 1 1 A 88 88 THR N N 88 112.328 111.996 0.332 2
1 1128 . 1 1 A 89 89 ALA H H 89 8.076 7.924 0.152 2
1 1129 . 1 1 A 89 89 ALA HA H 89 4.320 4.308 0.012 2
1 1133 . 1 1 A 89 89 ALA C C 89 178.014 178.592 -0.578 2
1 1134 . 1 1 A 89 89 ALA CA C 89 53.079 53.496 -0.417 2
1 1135 . 1 1 A 89 89 ALA CB C 89 19.335 19.112 0.223 2
1 1136 . 1 1 A 89 89 ALA N N 89 124.632 123.787 0.845 2
1 1137 . 1 1 A 90 90 THR H H 90 7.976 7.841 0.135 2
1 1138 . 1 1 A 90 90 THR HA H 90 4.203 4.092 0.111 2
1 1143 . 1 1 A 90 90 THR C C 90 174.427 174.342 0.085 2
1 1144 . 1 1 A 90 90 THR CA C 90 62.519 64.403 -1.884 2
1 1145 . 1 1 A 90 90 THR CB C 90 69.721 68.915 0.806 2
1 1147 . 1 1 A 90 90 THR N N 90 112.047 112.102 -0.055 2
1 1148 . 1 1 A 91 91 TYR H H 91 7.959 7.873 0.086 2
1 1149 . 1 1 A 91 91 TYR HA H 91 4.564 4.703 -0.139 2
1 1156 . 1 1 A 91 91 TYR C C 91 175.522 175.842 -0.320 2
1 1157 . 1 1 A 91 91 TYR CA C 91 57.874 58.028 -0.154 2
1 1158 . 1 1 A 91 91 TYR CB C 91 38.584 39.192 -0.608 2
1 1163 . 1 1 A 91 91 TYR N N 91 121.184 119.715 1.469 2
1 1164 . 1 1 A 92 92 GLN H H 92 8.310 8.570 -0.260 2
1 1165 . 1 1 A 92 92 GLN HA H 92 4.258 4.386 -0.128 2
1 1172 . 1 1 A 92 92 GLN C C 92 176.099 176.357 -0.258 2
1 1173 . 1 1 A 92 92 GLN CA C 92 56.109 56.449 -0.340 2
1 1174 . 1 1 A 92 92 GLN CB C 92 29.112 29.215 -0.103 2
1 1177 . 1 1 A 92 92 GLN N N 92 121.631 121.934 -0.303 2
1 1179 . 1 1 A 93 93 GLY H H 93 8.052 8.398 -0.346 2
1 1180 . 1 1 A 93 93 GLY HA2 H 93 4.023 3.997 0.026 2
1 1181 . 1 1 A 93 93 GLY HA3 H 93 3.856 4.005 -0.149 2
1 1182 . 1 1 A 93 93 GLY C C 93 173.791 174.442 -0.651 2
1 1183 . 1 1 A 93 93 GLY CA C 93 45.382 46.090 -0.708 2
1 1184 . 1 1 A 93 93 GLY N N 93 109.847 111.230 -1.383 2
1 1185 . 1 1 A 94 94 ALA H H 94 8.162 8.035 0.127 2
1 1186 . 1 1 A 94 94 ALA HA H 94 4.329 4.458 -0.129 2
1 1190 . 1 1 A 94 94 ALA C C 94 177.392 176.741 0.651 2
1 1191 . 1 1 A 94 94 ALA CA C 94 52.558 52.066 0.492 2
1 1192 . 1 1 A 94 94 ALA CB C 94 19.526 19.558 -0.032 2
1 1193 . 1 1 A 94 94 ALA N N 94 123.424 122.705 0.719 2
1 1194 . 1 1 A 95 95 ASP H H 95 8.457 8.309 0.148 2
1 1195 . 1 1 A 95 95 ASP HA H 95 4.608 4.852 -0.244 2
1 1198 . 1 1 A 95 95 ASP C C 95 175.630 176.264 -0.634 2
1 1199 . 1 1 A 95 95 ASP CA C 95 54.450 54.191 0.260 2
1 1200 . 1 1 A 95 95 ASP CB C 95 40.871 41.234 -0.363 2
1 1201 . 1 1 A 95 95 ASP N N 95 118.814 120.732 -1.918 2
1 1202 . 1 1 A 96 96 VAL H H 96 7.776 8.336 -0.560 2
1 1203 . 1 1 A 96 96 VAL HA H 96 4.141 4.310 -0.169 2
1 1211 . 1 1 A 96 96 VAL C C 96 175.301 175.416 -0.115 2
1 1212 . 1 1 A 96 96 VAL CA C 96 61.435 62.437 -1.002 2
1 1213 . 1 1 A 96 96 VAL CB C 96 33.517 32.719 0.798 2
1 1216 . 1 1 A 96 96 VAL N N 96 118.395 120.582 -2.187 2
1 1217 . 1 1 A 97 97 ASP H H 97 8.315 8.173 0.142 2
1 1218 . 1 1 A 97 97 ASP HA H 97 4.681 4.788 -0.107 2
1 1221 . 1 1 A 97 97 ASP C C 97 175.151 175.839 -0.688 2
1 1222 . 1 1 A 97 97 ASP CA C 97 54.324 54.174 0.150 2
1 1223 . 1 1 A 97 97 ASP CB C 97 41.963 41.566 0.397 2
1 1224 . 1 1 A 97 97 ASP N N 97 123.905 122.063 1.842 2
1 1225 . 1 1 A 98 98 TRP H H 98 8.210 8.790 -0.580 2
1 1226 . 1 1 A 98 98 TRP HA H 98 4.916 5.172 -0.256 2
1 1235 . 1 1 A 98 98 TRP C C 98 174.585 174.720 -0.136 2
1 1236 . 1 1 A 98 98 TRP CA C 98 56.164 55.920 0.244 2
1 1237 . 1 1 A 98 98 TRP CB C 98 31.466 31.326 0.140 2
1 1243 . 1 1 A 98 98 TRP N N 98 120.340 121.458 -1.118 2
1 1245 . 1 1 A 99 99 TYR H H 99 8.760 9.127 -0.367 2
1 1246 . 1 1 A 99 99 TYR HA H 99 5.119 5.420 -0.301 2
1 1253 . 1 1 A 99 99 TYR C C 99 174.599 174.902 -0.303 2
1 1254 . 1 1 A 99 99 TYR CA C 99 57.021 56.674 0.347 2
1 1255 . 1 1 A 99 99 TYR CB C 99 39.526 40.773 -1.247 2
1 1260 . 1 1 A 99 99 TYR N N 99 123.319 119.583 3.736 2
1 1261 . 1 1 A 100 100 ILE H H 100 8.936 9.193 -0.257 2
1 1262 . 1 1 A 100 100 ILE HA H 100 4.850 4.757 0.093 2
1 1272 . 1 1 A 100 100 ILE C C 100 175.070 174.958 0.112 2
1 1273 . 1 1 A 100 100 ILE CA C 100 58.998 60.306 -1.308 2
1 1274 . 1 1 A 100 100 ILE CB C 100 40.667 39.402 1.265 2
1 1278 . 1 1 A 100 100 ILE N N 100 123.281 123.057 0.224 2
1 1279 . 1 1 A 101 101 LYS H H 101 8.987 8.923 0.064 2
1 1280 . 1 1 A 101 101 LYS HA H 101 5.313 5.113 0.200 2
1 1289 . 1 1 A 101 101 LYS C C 101 174.440 175.967 -1.527 2
1 1290 . 1 1 A 101 101 LYS CA C 101 54.763 55.658 -0.895 2
1 1291 . 1 1 A 101 101 LYS CB C 101 34.880 33.778 1.102 2
1 1295 . 1 1 A 101 101 LYS N N 101 126.210 127.135 -0.925 2
1 1296 . 1 1 A 102 102 ALA H H 102 8.531 8.263 0.268 2
1 1297 . 1 1 A 102 102 ALA HA H 102 4.957 4.933 0.024 2
1 1301 . 1 1 A 102 102 ALA C C 102 175.024 177.669 -2.645 2
1 1302 . 1 1 A 102 102 ALA CA C 102 50.701 50.238 0.463 2
1 1303 . 1 1 A 102 102 ALA CB C 102 21.618 22.638 -1.020 2
1 1304 . 1 1 A 102 102 ALA N N 102 121.424 126.138 -4.714 2
1 1305 . 1 1 A 103 103 ASP H H 103 8.339 9.027 -0.688 2
1 1306 . 1 1 A 103 103 ASP HA H 103 4.603 4.493 0.110 2
1 1309 . 1 1 A 103 103 ASP C C 103 176.188 175.310 0.878 2
1 1310 . 1 1 A 103 103 ASP CA C 103 56.049 56.459 -0.410 2
1 1311 . 1 1 A 103 103 ASP CB C 103 40.932 41.543 -0.611 2
1 1312 . 1 1 A 103 103 ASP N N 103 117.773 119.579 -1.806 2
1 1313 . 1 1 A 104 104 ASP H H 104 7.482 7.679 -0.197 2
1 1314 . 1 1 A 104 104 ASP HA H 104 4.727 4.955 -0.228 2
1 1317 . 1 1 A 104 104 ASP C C 104 174.261 173.670 0.591 2
1 1318 . 1 1 A 104 104 ASP CA C 104 52.768 53.627 -0.859 2
1 1319 . 1 1 A 104 104 ASP CB C 104 42.587 43.950 -1.363 2
1 1320 . 1 1 A 104 104 ASP N N 104 110.673 116.736 -6.063 2
1 1321 . 1 1 A 105 105 ILE H H 105 9.267 8.551 0.716 2
1 1322 . 1 1 A 105 105 ILE HA H 105 4.631 4.904 -0.273 2
1 1332 . 1 1 A 105 105 ILE C C 105 173.922 175.404 -1.481 2
1 1333 . 1 1 A 105 105 ILE CA C 105 61.114 60.285 0.829 2
1 1334 . 1 1 A 105 105 ILE CB C 105 42.522 40.107 2.415 2
1 1338 . 1 1 A 105 105 ILE N N 105 121.380 122.545 -1.165 2
1 1339 . 1 1 A 106 106 VAL H H 106 8.592 8.957 -0.365 2
1 1340 . 1 1 A 106 106 VAL HA H 106 4.975 5.031 -0.056 2
1 1348 . 1 1 A 106 106 VAL C C 106 175.049 175.061 -0.012 2
1 1349 . 1 1 A 106 106 VAL CA C 106 58.028 59.535 -1.507 2
1 1350 . 1 1 A 106 106 VAL CB C 106 35.388 35.587 -0.199 2
1 1353 . 1 1 A 106 106 VAL N N 106 116.356 120.909 -4.553 2
1 1354 . 1 1 A 107 107 LEU H H 107 8.360 8.480 -0.120 2
1 1355 . 1 1 A 107 107 LEU HA H 107 4.167 4.292 -0.125 2
1 1365 . 1 1 A 107 107 LEU C C 107 178.338 177.328 1.010 2
1 1366 . 1 1 A 107 107 LEU CA C 107 55.077 54.215 0.862 2
1 1367 . 1 1 A 107 107 LEU CB C 107 42.394 42.149 0.245 2
1 1371 . 1 1 A 107 107 LEU N N 107 121.368 122.480 -1.112 2
1 1372 . 1 1 A 108 108 THR H H 108 7.977 8.662 -0.685 2
1 1373 . 1 1 A 108 108 THR HA H 108 4.039 4.425 -0.386 2
1 1378 . 1 1 A 108 108 THR C C 108 174.725 174.838 -0.113 2
1 1379 . 1 1 A 108 108 THR CA C 108 63.513 63.392 0.121 2
1 1380 . 1 1 A 108 108 THR CB C 108 69.194 69.085 0.109 2
1 1382 . 1 1 A 108 108 THR N N 108 118.728 118.282 0.446 2
1 1383 . 1 1 A 109 109 LEU H H 109 8.378 8.700 -0.322 2
1 1384 . 1 1 A 109 109 LEU HA H 109 4.274 4.244 0.030 2
1 1394 . 1 1 A 109 109 LEU C C 109 177.058 176.764 0.294 2
1 1395 . 1 1 A 109 109 LEU CA C 109 55.045 55.468 -0.423 2
1 1396 . 1 1 A 109 109 LEU CB C 109 42.620 40.869 1.751 2
1 1400 . 1 1 A 109 109 LEU N N 109 124.847 126.070 -1.223 2
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