data_15651_sparta save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15651 _Entry.PDB_ID 2K0L _Entry.NMR_STAR_version 3.0.9.100 save_ save_delta_chem_shifts_single _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single _Entity_delta_chem_shifts.Conformer_type "single" _Entity_delta_chem_shifts.Conformer_count 20 _Entity_delta_chem_shifts.Best_conformer 1 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Conformer_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 1 . 1 1 1 A 2 2 ARG C C 2 175.857 174.392 1.465 1 1 2 . 1 1 1 A 2 2 ARG CA C 2 55.872 55.255 0.617 1 1 3 . 1 1 1 A 2 2 ARG CB C 2 29.983 32.185 -2.202 1 1 5 . 1 1 1 A 3 3 ILE H H 3 8.238 8.860 -0.622 1 1 9 . 1 1 1 A 3 3 ILE C C 3 175.763 174.953 0.810 1 1 10 . 1 1 1 A 3 3 ILE CA C 3 60.779 59.294 1.485 1 1 11 . 1 1 1 A 3 3 ILE CB C 3 37.664 42.366 -4.702 1 1 15 . 1 1 1 A 3 3 ILE N N 3 122.580 126.730 -4.150 1 1 16 . 1 1 1 A 4 4 MET H H 4 8.261 8.884 -0.623 1 1 17 . 1 1 1 A 4 4 MET C C 4 175.660 176.229 -0.569 1 1 18 . 1 1 1 A 4 4 MET CA C 4 54.893 56.171 -1.278 1 1 19 . 1 1 1 A 4 4 MET CB C 4 32.060 32.907 -0.847 1 1 22 . 1 1 1 A 4 4 MET N N 4 123.988 127.425 -3.437 1 1 23 . 1 1 1 A 5 5 LYS H H 5 8.041 8.686 -0.645 1 1 24 . 1 1 1 A 5 5 LYS C C 5 175.850 176.865 -1.015 1 1 25 . 1 1 1 A 5 5 LYS CA C 5 56.081 55.178 0.903 1 1 26 . 1 1 1 A 5 5 LYS CB C 5 32.220 32.357 -0.137 1 1 29 . 1 1 1 A 5 5 LYS N N 5 122.015 121.127 0.888 1 1 30 . 1 1 1 A 6 6 ALA H H 6 8.042 8.320 -0.278 1 1 34 . 1 1 1 A 6 6 ALA C C 6 177.160 178.289 -1.129 1 1 35 . 1 1 1 A 6 6 ALA CA C 6 52.109 53.388 -1.279 1 1 36 . 1 1 1 A 6 6 ALA CB C 6 18.637 20.136 -1.499 1 1 37 . 1 1 1 A 6 6 ALA N N 6 123.943 122.227 1.716 1 1 38 . 1 1 1 A 7 7 ILE H H 7 7.916 7.561 0.355 1 1 42 . 1 1 1 A 7 7 ILE C C 7 175.611 175.120 0.491 1 1 43 . 1 1 1 A 7 7 ILE CA C 7 61.181 60.134 1.047 1 1 44 . 1 1 1 A 7 7 ILE CB C 7 37.910 38.153 -0.243 1 1 48 . 1 1 1 A 7 7 ILE N N 7 118.380 111.328 7.052 1 1 49 . 1 1 1 A 8 8 PHE H H 8 8.167 7.742 0.425 1 1 50 . 1 1 1 A 8 8 PHE C C 8 175.363 174.690 0.673 1 1 51 . 1 1 1 A 8 8 PHE CA C 8 57.286 56.089 1.197 1 1 52 . 1 1 1 A 8 8 PHE CB C 8 39.008 38.343 0.665 1 1 53 . 1 1 1 A 8 8 PHE N N 8 121.971 122.752 -0.781 1 1 54 . 1 1 1 A 9 9 VAL H H 9 7.872 8.133 -0.261 1 1 61 . 1 1 1 A 9 9 VAL C C 9 175.405 175.716 -0.311 1 1 62 . 1 1 1 A 9 9 VAL CA C 9 61.662 61.747 -0.085 1 1 63 . 1 1 1 A 9 9 VAL CB C 9 32.026 32.789 -0.763 1 1 66 . 1 1 1 A 9 9 VAL N N 9 120.864 120.259 0.605 1 1 67 . 1 1 1 A 10 10 LEU H H 10 8.077 8.464 -0.387 1 1 74 . 1 1 1 A 10 10 LEU C C 10 176.652 178.158 -1.506 1 1 75 . 1 1 1 A 10 10 LEU CA C 10 54.856 55.607 -0.751 1 1 76 . 1 1 1 A 10 10 LEU CB C 10 41.401 42.949 -1.548 1 1 80 . 1 1 1 A 10 10 LEU N N 10 124.826 125.115 -0.289 1 1 81 . 1 1 1 A 11 11 ASN H H 11 8.177 8.120 0.057 1 1 82 . 1 1 1 A 11 11 ASN C C 11 174.394 175.415 -1.021 1 1 83 . 1 1 1 A 11 11 ASN CA C 11 52.704 55.685 -2.981 1 1 84 . 1 1 1 A 11 11 ASN CB C 11 38.468 39.442 -0.974 1 1 85 . 1 1 1 A 11 11 ASN N N 11 119.029 116.398 2.631 1 1 86 . 1 1 1 A 12 12 ALA H H 12 7.991 7.745 0.246 1 1 90 . 1 1 1 A 12 12 ALA C C 12 176.649 176.096 0.553 1 1 91 . 1 1 1 A 12 12 ALA CA C 12 51.950 51.337 0.613 1 1 92 . 1 1 1 A 12 12 ALA CB C 12 18.659 22.512 -3.853 1 1 93 . 1 1 1 A 12 12 ALA N N 12 123.695 118.923 4.772 1 1 94 . 1 1 1 A 13 13 ALA H H 13 8.083 8.620 -0.537 1 1 95 . 1 1 1 A 13 13 ALA C C 13 175.395 177.161 -1.766 1 1 96 . 1 1 1 A 13 13 ALA CA C 13 49.797 51.216 -1.419 1 1 97 . 1 1 1 A 13 13 ALA CB C 13 17.486 18.327 -0.841 1 1 98 . 1 1 1 A 13 13 ALA N N 13 124.281 124.138 0.143 1 1 99 . 1 1 1 A 14 14 PRO C C 14 176.641 175.604 1.037 1 1 100 . 1 1 1 A 14 14 PRO CA C 14 62.675 62.461 0.214 1 1 101 . 1 1 1 A 14 14 PRO CB C 14 31.000 29.178 1.822 1 1 103 . 1 1 1 A 15 15 LYS H H 15 8.283 8.568 -0.285 1 1 104 . 1 1 1 A 15 15 LYS C C 15 175.683 175.100 0.583 1 1 105 . 1 1 1 A 15 15 LYS CA C 15 55.429 55.525 -0.096 1 1 106 . 1 1 1 A 15 15 LYS CB C 15 32.246 35.217 -2.971 1 1 109 . 1 1 1 A 15 15 LYS N N 15 119.069 122.561 -3.492 1 1 110 . 1 1 1 A 16 16 ASP H H 16 7.880 8.674 -0.794 1 1 111 . 1 1 1 A 16 16 ASP C C 16 175.419 175.439 -0.020 1 1 112 . 1 1 1 A 16 16 ASP CA C 16 54.413 54.045 0.368 1 1 113 . 1 1 1 A 16 16 ASP CB C 16 40.224 41.233 -1.009 1 1 114 . 1 1 1 A 16 16 ASP N N 16 119.625 124.689 -5.064 1 1 115 . 1 1 1 A 17 17 ASN H H 17 7.973 7.837 0.136 1 1 116 . 1 1 1 A 17 17 ASN C C 17 174.231 174.222 0.009 1 1 117 . 1 1 1 A 17 17 ASN CA C 17 53.948 52.099 1.849 1 1 118 . 1 1 1 A 17 17 ASN CB C 17 37.009 38.240 -1.231 1 1 119 . 1 1 1 A 17 17 ASN N N 17 118.063 118.268 -0.205 1 1 120 . 1 1 1 A 18 18 THR H H 18 7.318 8.956 -1.638 1 1 121 . 1 1 1 A 18 18 THR C C 18 172.323 173.580 -1.257 1 1 122 . 1 1 1 A 18 18 THR CA C 18 60.153 60.848 -0.695 1 1 123 . 1 1 1 A 18 18 THR CB C 18 71.534 71.482 0.052 1 1 125 . 1 1 1 A 18 18 THR N N 18 109.092 121.071 -11.979 1 1 126 . 1 1 1 A 19 19 TRP H H 19 8.541 8.893 -0.352 1 1 127 . 1 1 1 A 19 19 TRP C C 19 175.969 173.889 2.080 1 1 128 . 1 1 1 A 19 19 TRP CA C 19 55.700 56.477 -0.777 1 1 129 . 1 1 1 A 19 19 TRP CB C 19 31.471 32.986 -1.515 1 1 130 . 1 1 1 A 19 19 TRP N N 19 121.992 126.768 -4.776 1 1 131 . 1 1 1 A 20 20 TYR H H 20 8.691 8.277 0.414 1 1 132 . 1 1 1 A 20 20 TYR C C 20 173.684 172.898 0.786 1 1 133 . 1 1 1 A 20 20 TYR CA C 20 55.805 55.528 0.277 1 1 134 . 1 1 1 A 20 20 TYR CB C 20 40.513 42.483 -1.970 1 1 135 . 1 1 1 A 20 20 TYR N N 20 116.519 122.378 -5.859 1 1 136 . 1 1 1 A 21 21 ALA H H 21 8.876 8.545 0.331 1 1 137 . 1 1 1 A 21 21 ALA C C 21 175.395 176.920 -1.525 1 1 138 . 1 1 1 A 21 21 ALA CA C 21 50.970 50.780 0.190 1 1 139 . 1 1 1 A 21 21 ALA CB C 21 22.142 23.514 -1.372 1 1 140 . 1 1 1 A 21 21 ALA N N 21 119.359 122.250 -2.891 1 1 141 . 1 1 1 A 22 22 GLY H H 22 8.613 8.740 -0.127 1 1 142 . 1 1 1 A 22 22 GLY C C 22 171.458 172.756 -1.298 1 1 143 . 1 1 1 A 22 22 GLY CA C 22 45.608 46.331 -0.723 1 1 144 . 1 1 1 A 22 22 GLY N N 22 106.678 106.209 0.469 1 1 145 . 1 1 1 A 23 23 GLY H H 23 7.911 8.591 -0.680 1 1 146 . 1 1 1 A 23 23 GLY C C 23 170.563 172.349 -1.786 1 1 147 . 1 1 1 A 23 23 GLY CA C 23 44.026 45.301 -1.275 1 1 148 . 1 1 1 A 23 23 GLY N N 23 103.399 109.207 -5.808 1 1 149 . 1 1 1 A 24 24 LYS H H 24 9.001 9.783 -0.782 1 1 150 . 1 1 1 A 24 24 LYS C C 24 172.965 174.258 -1.293 1 1 151 . 1 1 1 A 24 24 LYS CA C 24 54.062 54.312 -0.250 1 1 152 . 1 1 1 A 24 24 LYS CB C 24 36.774 36.233 0.541 1 1 156 . 1 1 1 A 24 24 LYS N N 24 116.402 120.860 -4.458 1 1 157 . 1 1 1 A 25 25 LEU H H 25 8.587 9.555 -0.968 1 1 164 . 1 1 1 A 25 25 LEU C C 25 175.205 175.642 -0.437 1 1 165 . 1 1 1 A 25 25 LEU CA C 25 53.446 53.425 0.021 1 1 166 . 1 1 1 A 25 25 LEU CB C 25 46.287 46.585 -0.298 1 1 170 . 1 1 1 A 25 25 LEU N N 25 119.932 122.106 -2.174 1 1 171 . 1 1 1 A 26 26 GLY H H 26 8.637 8.238 0.399 1 1 172 . 1 1 1 A 26 26 GLY C C 26 170.804 171.817 -1.013 1 1 173 . 1 1 1 A 26 26 GLY CA C 26 45.669 46.362 -0.693 1 1 174 . 1 1 1 A 26 26 GLY N N 26 108.136 110.800 -2.664 1 1 175 . 1 1 1 A 27 27 TRP H H 27 8.642 8.548 0.094 1 1 177 . 1 1 1 A 27 27 TRP C C 27 174.820 176.061 -1.241 1 1 178 . 1 1 1 A 27 27 TRP CB C 27 30.883 31.994 -1.111 1 1 179 . 1 1 1 A 27 27 TRP N N 27 120.887 122.003 -1.116 1 1 181 . 1 1 1 A 32 32 ASP C C 32 176.315 175.638 0.677 1 1 182 . 1 1 1 A 32 32 ASP CA C 32 53.737 54.456 -0.719 1 1 183 . 1 1 1 A 32 32 ASP CB C 32 41.230 42.339 -1.109 1 1 184 . 1 1 1 A 33 33 THR H H 33 8.190 7.567 0.623 1 1 188 . 1 1 1 A 33 33 THR C C 33 175.291 174.690 0.601 1 1 189 . 1 1 1 A 33 33 THR CA C 33 61.909 61.323 0.586 1 1 190 . 1 1 1 A 33 33 THR CB C 33 68.961 70.383 -1.422 1 1 192 . 1 1 1 A 33 33 THR N N 33 114.235 113.262 0.973 1 1 193 . 1 1 1 A 34 34 GLY H H 34 8.341 8.219 0.122 1 1 194 . 1 1 1 A 34 34 GLY C C 34 173.766 172.405 1.361 1 1 195 . 1 1 1 A 34 34 GLY CA C 34 44.941 44.454 0.487 1 1 196 . 1 1 1 A 34 34 GLY N N 34 110.678 111.245 -0.567 1 1 197 . 1 1 1 A 35 35 PHE H H 35 7.945 8.446 -0.501 1 1 198 . 1 1 1 A 35 35 PHE C C 35 175.411 174.198 1.213 1 1 199 . 1 1 1 A 35 35 PHE CA C 35 57.921 56.276 1.645 1 1 200 . 1 1 1 A 35 35 PHE CB C 35 38.806 44.248 -5.442 1 1 201 . 1 1 1 A 35 35 PHE N N 35 120.533 118.457 2.076 1 1 202 . 1 1 1 A 36 36 TYR H H 36 7.967 8.739 -0.772 1 1 203 . 1 1 1 A 36 36 TYR C C 36 176.104 175.747 0.357 1 1 204 . 1 1 1 A 36 36 TYR CA C 36 57.568 56.382 1.186 1 1 205 . 1 1 1 A 36 36 TYR CB C 36 37.727 42.857 -5.130 1 1 206 . 1 1 1 A 36 36 TYR N N 36 120.254 118.080 2.174 1 1 207 . 1 1 1 A 37 37 GLY H H 37 7.666 8.983 -1.317 1 1 208 . 1 1 1 A 37 37 GLY C C 37 173.794 173.423 0.371 1 1 209 . 1 1 1 A 37 37 GLY CA C 37 45.007 46.149 -1.142 1 1 210 . 1 1 1 A 37 37 GLY N N 37 108.995 112.070 -3.075 1 1 211 . 1 1 1 A 38 38 ASN H H 38 8.109 7.680 0.429 1 1 212 . 1 1 1 A 38 38 ASN C C 38 175.612 176.130 -0.518 1 1 213 . 1 1 1 A 38 38 ASN CA C 38 52.954 52.080 0.874 1 1 214 . 1 1 1 A 38 38 ASN CB C 38 38.425 40.690 -2.265 1 1 215 . 1 1 1 A 38 38 ASN N N 38 118.603 118.314 0.289 1 1 216 . 1 1 1 A 39 39 GLY H H 39 8.202 8.697 -0.495 1 1 217 . 1 1 1 A 39 39 GLY C C 39 173.958 174.622 -0.664 1 1 218 . 1 1 1 A 39 39 GLY CA C 39 45.012 47.472 -2.460 1 1 219 . 1 1 1 A 39 39 GLY N N 39 108.897 110.829 -1.932 1 1 220 . 1 1 1 A 40 40 PHE H H 40 7.960 7.956 0.004 1 1 221 . 1 1 1 A 40 40 PHE C C 40 175.653 175.121 0.532 1 1 222 . 1 1 1 A 40 40 PHE CA C 40 57.556 58.268 -0.712 1 1 223 . 1 1 1 A 40 40 PHE CB C 40 38.513 38.583 -0.070 1 1 224 . 1 1 1 A 40 40 PHE N N 40 119.829 121.212 -1.383 1 1 225 . 1 1 1 A 41 41 GLN H H 41 8.173 8.830 -0.657 1 1 226 . 1 1 1 A 41 41 GLN C C 41 175.234 175.911 -0.677 1 1 227 . 1 1 1 A 41 41 GLN CA C 41 55.488 57.172 -1.684 1 1 228 . 1 1 1 A 41 41 GLN CB C 41 28.523 30.198 -1.675 1 1 230 . 1 1 1 A 41 41 GLN N N 41 120.810 124.072 -3.262 1 1 231 . 1 1 1 A 42 42 ASN H H 42 8.193 8.112 0.081 1 1 232 . 1 1 1 A 42 42 ASN C C 42 174.618 175.583 -0.965 1 1 233 . 1 1 1 A 42 42 ASN CA C 42 52.924 51.976 0.948 1 1 234 . 1 1 1 A 42 42 ASN CB C 42 38.333 38.654 -0.321 1 1 235 . 1 1 1 A 42 42 ASN N N 42 119.679 117.376 2.303 1 1 236 . 1 1 1 A 43 43 ASN H H 43 8.255 8.909 -0.654 1 1 237 . 1 1 1 A 43 43 ASN C C 43 173.873 175.290 -1.417 1 1 238 . 1 1 1 A 43 43 ASN CA C 43 52.919 55.310 -2.391 1 1 239 . 1 1 1 A 43 43 ASN CB C 43 38.580 38.658 -0.078 1 1 240 . 1 1 1 A 43 43 ASN N N 43 119.773 123.304 -3.531 1 1 241 . 1 1 1 A 44 44 ASN H H 44 7.865 7.906 -0.041 1 1 242 . 1 1 1 A 44 44 ASN C C 44 175.518 174.813 0.705 1 1 243 . 1 1 1 A 44 44 ASN CA C 44 54.528 51.814 2.714 1 1 244 . 1 1 1 A 44 44 ASN CB C 44 40.170 42.734 -2.564 1 1 246 . 1 1 1 A 44 44 ASN N N 44 124.152 115.828 8.324 1 1 247 . 1 1 1 A 46 46 PRO C C 46 177.228 176.768 0.460 1 1 248 . 1 1 1 A 46 46 PRO CA C 46 62.794 62.738 0.056 1 1 249 . 1 1 1 A 46 46 PRO CB C 46 31.283 33.657 -2.374 1 1 251 . 1 1 1 A 47 47 THR H H 47 8.165 8.556 -0.391 1 1 255 . 1 1 1 A 47 47 THR C C 47 174.573 173.334 1.239 1 1 256 . 1 1 1 A 47 47 THR CA C 47 61.346 60.887 0.459 1 1 257 . 1 1 1 A 47 47 THR CB C 47 69.573 69.428 0.145 1 1 259 . 1 1 1 A 47 47 THR N N 47 114.265 114.462 -0.197 1 1 260 . 1 1 1 A 48 48 ARG H H 48 8.237 7.592 0.645 1 1 261 . 1 1 1 A 48 48 ARG C C 48 175.898 175.263 0.635 1 1 262 . 1 1 1 A 48 48 ARG CA C 48 55.717 54.401 1.316 1 1 263 . 1 1 1 A 48 48 ARG CB C 48 30.151 32.436 -2.285 1 1 266 . 1 1 1 A 48 48 ARG N N 48 122.795 120.176 2.619 1 1 267 . 1 1 1 A 49 49 ASN H H 49 8.369 9.007 -0.638 1 1 268 . 1 1 1 A 49 49 ASN C C 49 174.560 174.251 0.309 1 1 269 . 1 1 1 A 49 49 ASN CA C 49 53.005 52.391 0.614 1 1 270 . 1 1 1 A 49 49 ASN CB C 49 38.761 37.169 1.592 1 1 271 . 1 1 1 A 49 49 ASN N N 49 119.837 123.806 -3.969 1 1 272 . 1 1 1 A 50 50 ASP H H 50 8.192 7.976 0.216 1 1 273 . 1 1 1 A 50 50 ASP C C 50 175.699 174.730 0.969 1 1 274 . 1 1 1 A 50 50 ASP CA C 50 54.289 53.587 0.702 1 1 275 . 1 1 1 A 50 50 ASP CB C 50 41.264 39.289 1.975 1 1 276 . 1 1 1 A 50 50 ASP N N 50 120.403 122.554 -2.151 1 1 277 . 1 1 1 A 51 51 GLN H H 51 8.428 8.360 0.068 1 1 278 . 1 1 1 A 51 51 GLN C C 51 175.186 174.294 0.892 1 1 279 . 1 1 1 A 51 51 GLN CA C 51 54.512 54.321 0.191 1 1 280 . 1 1 1 A 51 51 GLN CB C 51 30.424 29.339 1.085 1 1 282 . 1 1 1 A 51 51 GLN N N 51 118.959 122.728 -3.769 1 1 289 . 1 1 1 A 52 52 LEU C C 52 176.018 175.501 0.517 1 1 290 . 1 1 1 A 52 52 LEU CA C 52 54.332 53.071 1.261 1 1 291 . 1 1 1 A 52 52 LEU CB C 52 43.022 45.475 -2.453 1 1 294 . 1 1 1 A 53 53 GLY H H 53 8.639 9.115 -0.476 1 1 295 . 1 1 1 A 53 53 GLY C C 53 171.931 172.050 -0.119 1 1 296 . 1 1 1 A 53 53 GLY CA C 53 43.501 44.417 -0.916 1 1 297 . 1 1 1 A 53 53 GLY N N 53 109.964 112.084 -2.120 1 1 298 . 1 1 1 A 54 54 ALA H H 54 8.881 8.901 -0.020 1 1 299 . 1 1 1 A 54 54 ALA C C 54 175.543 176.757 -1.214 1 1 300 . 1 1 1 A 54 54 ALA CA C 54 50.710 50.912 -0.202 1 1 301 . 1 1 1 A 54 54 ALA CB C 54 22.914 21.428 1.486 1 1 302 . 1 1 1 A 54 54 ALA N N 54 120.413 124.578 -4.165 1 1 303 . 1 1 1 A 55 55 GLY H H 55 8.346 8.876 -0.530 1 1 304 . 1 1 1 A 55 55 GLY C C 55 170.960 171.971 -1.011 1 1 305 . 1 1 1 A 55 55 GLY CA C 55 46.704 45.083 1.621 1 1 306 . 1 1 1 A 55 55 GLY N N 55 104.688 107.987 -3.299 1 1 307 . 1 1 1 A 56 56 ALA H H 56 9.116 9.297 -0.181 1 1 308 . 1 1 1 A 56 56 ALA C C 56 176.472 176.901 -0.429 1 1 309 . 1 1 1 A 56 56 ALA CA C 56 49.638 51.145 -1.507 1 1 310 . 1 1 1 A 56 56 ALA CB C 56 22.275 20.991 1.284 1 1 311 . 1 1 1 A 56 56 ALA N N 56 120.608 127.332 -6.724 1 1 312 . 1 1 1 A 57 57 PHE H H 57 8.688 9.500 -0.812 1 1 313 . 1 1 1 A 57 57 PHE C C 57 172.816 175.511 -2.695 1 1 314 . 1 1 1 A 57 57 PHE CA C 57 56.066 55.863 0.203 1 1 315 . 1 1 1 A 57 57 PHE CB C 57 41.770 41.870 -0.100 1 1 316 . 1 1 1 A 57 57 PHE N N 57 120.027 120.543 -0.516 1 1 317 . 1 1 1 A 58 58 GLY H H 58 9.034 8.594 0.440 1 1 318 . 1 1 1 A 58 58 GLY C C 58 170.860 172.180 -1.320 1 1 319 . 1 1 1 A 58 58 GLY CA C 58 44.954 44.662 0.292 1 1 320 . 1 1 1 A 58 58 GLY N N 58 105.817 109.356 -3.539 1 1 321 . 1 1 1 A 59 59 GLY H H 59 8.382 8.886 -0.504 1 1 322 . 1 1 1 A 59 59 GLY C C 59 169.284 171.512 -2.228 1 1 323 . 1 1 1 A 59 59 GLY CA C 59 45.840 43.646 2.194 1 1 324 . 1 1 1 A 59 59 GLY N N 59 109.059 111.652 -2.593 1 1 325 . 1 1 1 A 60 60 TYR H H 60 8.430 8.317 0.113 1 1 326 . 1 1 1 A 60 60 TYR C C 60 173.453 172.326 1.127 1 1 327 . 1 1 1 A 60 60 TYR CA C 60 55.282 55.782 -0.500 1 1 328 . 1 1 1 A 60 60 TYR CB C 60 41.712 40.879 0.833 1 1 329 . 1 1 1 A 60 60 TYR N N 60 118.352 116.708 1.644 1 1 330 . 1 1 1 A 61 61 GLN H H 61 8.833 8.298 0.535 1 1 331 . 1 1 1 A 61 61 GLN C C 61 174.365 175.269 -0.904 1 1 332 . 1 1 1 A 61 61 GLN CA C 61 54.125 55.142 -1.017 1 1 333 . 1 1 1 A 61 61 GLN CB C 61 28.033 30.492 -2.459 1 1 335 . 1 1 1 A 61 61 GLN N N 61 129.628 123.544 6.084 1 1 336 . 1 1 1 A 62 62 VAL H H 62 8.714 8.947 -0.233 1 1 343 . 1 1 1 A 62 62 VAL C C 62 175.758 175.756 0.002 1 1 344 . 1 1 1 A 62 62 VAL CA C 62 64.649 63.139 1.510 1 1 345 . 1 1 1 A 62 62 VAL CB C 62 31.900 33.517 -1.617 1 1 348 . 1 1 1 A 62 62 VAL N N 62 127.666 124.955 2.711 1 1 349 . 1 1 1 A 63 63 ASN H H 63 8.062 7.726 0.336 1 1 350 . 1 1 1 A 63 63 ASN C C 63 172.827 173.003 -0.176 1 1 351 . 1 1 1 A 63 63 ASN CA C 63 51.575 49.858 1.717 1 1 352 . 1 1 1 A 63 63 ASN CB C 63 37.194 41.279 -4.085 1 1 353 . 1 1 1 A 63 63 ASN N N 63 116.310 117.826 -1.516 1 1 354 . 1 1 1 A 64 64 PRO C C 64 175.071 175.157 -0.086 1 1 355 . 1 1 1 A 64 64 PRO CA C 64 65.296 62.510 2.786 1 1 356 . 1 1 1 A 64 64 PRO CB C 64 30.428 29.186 1.242 1 1 357 . 1 1 1 A 65 65 TYR H H 65 7.873 9.111 -1.238 1 1 358 . 1 1 1 A 65 65 TYR C C 65 175.145 175.024 0.121 1 1 359 . 1 1 1 A 65 65 TYR CA C 65 56.125 59.184 -3.059 1 1 360 . 1 1 1 A 65 65 TYR CB C 65 39.189 40.732 -1.543 1 1 361 . 1 1 1 A 65 65 TYR N N 65 112.894 122.530 -9.636 1 1 362 . 1 1 1 A 66 66 LEU H H 66 7.308 7.525 -0.217 1 1 369 . 1 1 1 A 66 66 LEU C C 66 173.866 174.234 -0.368 1 1 370 . 1 1 1 A 66 66 LEU CA C 66 53.431 53.895 -0.464 1 1 371 . 1 1 1 A 66 66 LEU CB C 66 44.958 44.264 0.694 1 1 375 . 1 1 1 A 66 66 LEU N N 66 120.270 116.632 3.638 1 1 376 . 1 1 1 A 67 67 GLY H H 67 8.855 8.495 0.360 1 1 377 . 1 1 1 A 67 67 GLY C C 67 170.698 171.592 -0.894 1 1 378 . 1 1 1 A 67 67 GLY CA C 67 44.008 43.806 0.202 1 1 379 . 1 1 1 A 67 67 GLY N N 67 114.388 106.554 7.834 1 1 380 . 1 1 1 A 68 68 PHE H H 68 8.770 8.294 0.476 1 1 381 . 1 1 1 A 68 68 PHE C C 68 173.386 174.544 -1.158 1 1 382 . 1 1 1 A 68 68 PHE CA C 68 56.507 57.705 -1.198 1 1 383 . 1 1 1 A 68 68 PHE CB C 68 42.428 39.531 2.897 1 1 384 . 1 1 1 A 68 68 PHE N N 68 117.510 119.418 -1.908 1 1 385 . 1 1 1 A 69 69 GLU H H 69 9.079 9.484 -0.405 1 1 386 . 1 1 1 A 69 69 GLU C C 69 174.556 174.552 0.004 1 1 387 . 1 1 1 A 69 69 GLU CA C 69 54.939 54.677 0.262 1 1 388 . 1 1 1 A 69 69 GLU CB C 69 33.963 32.504 1.459 1 1 390 . 1 1 1 A 69 69 GLU N N 69 120.562 121.494 -0.932 1 1 391 . 1 1 1 A 70 70 MET H H 70 9.481 9.586 -0.105 1 1 392 . 1 1 1 A 70 70 MET C C 70 174.595 175.443 -0.848 1 1 393 . 1 1 1 A 70 70 MET CA C 70 53.091 54.022 -0.931 1 1 394 . 1 1 1 A 70 70 MET CB C 70 36.159 34.466 1.693 1 1 397 . 1 1 1 A 70 70 MET N N 70 124.928 126.029 -1.101 1 1 398 . 1 1 1 A 71 71 GLY H H 71 8.845 8.670 0.175 1 1 399 . 1 1 1 A 71 71 GLY C C 71 170.811 171.525 -0.714 1 1 400 . 1 1 1 A 71 71 GLY CA C 71 44.624 43.535 1.089 1 1 401 . 1 1 1 A 71 71 GLY N N 71 108.896 112.093 -3.197 1 1 402 . 1 1 1 A 72 72 TYR H H 72 8.925 9.018 -0.093 1 1 403 . 1 1 1 A 72 72 TYR C C 72 173.278 174.548 -1.270 1 1 404 . 1 1 1 A 72 72 TYR CA C 72 55.912 56.353 -0.441 1 1 405 . 1 1 1 A 72 72 TYR CB C 72 41.611 41.054 0.557 1 1 406 . 1 1 1 A 72 72 TYR N N 72 123.253 120.105 3.148 1 1 407 . 1 1 1 A 73 73 ASP H H 73 8.665 8.999 -0.334 1 1 408 . 1 1 1 A 73 73 ASP C C 73 173.598 175.560 -1.962 1 1 409 . 1 1 1 A 73 73 ASP CA C 73 52.857 54.485 -1.628 1 1 410 . 1 1 1 A 73 73 ASP CB C 73 42.774 41.814 0.960 1 1 411 . 1 1 1 A 73 73 ASP N N 73 126.178 124.909 1.269 1 1 412 . 1 1 1 A 74 74 TRP H H 74 9.080 9.070 0.010 1 1 413 . 1 1 1 A 74 74 TRP C C 74 174.868 175.188 -0.320 1 1 414 . 1 1 1 A 74 74 TRP CB C 74 30.083 33.200 -3.117 1 1 415 . 1 1 1 A 74 74 TRP N N 74 121.824 126.635 -4.811 1 1 416 . 1 1 1 A 78 78 MET C C 78 174.548 174.966 -0.418 1 1 417 . 1 1 1 A 78 78 MET CA C 78 54.388 53.708 0.680 1 1 418 . 1 1 1 A 78 78 MET CB C 78 32.542 33.441 -0.899 1 1 419 . 1 1 1 A 79 79 ALA H H 79 8.105 8.625 -0.520 1 1 420 . 1 1 1 A 79 79 ALA C C 79 176.629 175.306 1.323 1 1 421 . 1 1 1 A 79 79 ALA CA C 79 51.210 52.153 -0.943 1 1 422 . 1 1 1 A 79 79 ALA CB C 79 19.106 20.609 -1.503 1 1 423 . 1 1 1 A 79 79 ALA N N 79 125.778 126.748 -0.970 1 1 424 . 1 1 1 A 80 80 TYR H H 80 8.035 8.747 -0.712 1 1 425 . 1 1 1 A 80 80 TYR C C 80 175.604 173.715 1.889 1 1 426 . 1 1 1 A 80 80 TYR CA C 80 57.021 57.557 -0.536 1 1 427 . 1 1 1 A 80 80 TYR CB C 80 38.416 39.171 -0.755 1 1 428 . 1 1 1 A 80 80 TYR N N 80 120.045 123.495 -3.450 1 1 429 . 1 1 1 A 81 81 LYS H H 81 8.295 8.388 -0.093 1 1 430 . 1 1 1 A 81 81 LYS C C 81 176.647 174.923 1.724 1 1 431 . 1 1 1 A 81 81 LYS CA C 81 56.285 55.651 0.634 1 1 432 . 1 1 1 A 81 81 LYS CB C 81 31.571 35.265 -3.694 1 1 434 . 1 1 1 A 81 81 LYS N N 81 123.191 125.886 -2.695 1 1 435 . 1 1 1 A 82 82 GLY H H 82 8.117 8.220 -0.103 1 1 436 . 1 1 1 A 82 82 GLY C C 82 174.010 174.470 -0.460 1 1 437 . 1 1 1 A 82 82 GLY CA C 82 44.982 45.521 -0.539 1 1 438 . 1 1 1 A 82 82 GLY N N 82 110.014 114.076 -4.062 1 1 439 . 1 1 1 A 83 83 SER H H 83 7.938 8.717 -0.779 1 1 440 . 1 1 1 A 83 83 SER C C 83 174.634 174.675 -0.041 1 1 441 . 1 1 1 A 83 83 SER CA C 83 57.685 61.942 -4.257 1 1 442 . 1 1 1 A 83 83 SER CB C 83 63.303 63.645 -0.342 1 1 443 . 1 1 1 A 83 83 SER N N 83 115.655 116.010 -0.355 1 1 444 . 1 1 1 A 84 84 VAL H H 84 8.008 7.519 0.489 1 1 451 . 1 1 1 A 84 84 VAL C C 84 175.525 173.988 1.537 1 1 452 . 1 1 1 A 84 84 VAL CA C 84 61.769 59.789 1.980 1 1 453 . 1 1 1 A 84 84 VAL CB C 84 31.711 35.071 -3.360 1 1 456 . 1 1 1 A 84 84 VAL N N 84 120.054 114.264 5.790 1 1 457 . 1 1 1 A 85 85 ASP H H 85 8.140 9.070 -0.930 1 1 458 . 1 1 1 A 85 85 ASP C C 85 174.740 174.253 0.487 1 1 459 . 1 1 1 A 85 85 ASP CA C 85 53.983 52.772 1.211 1 1 460 . 1 1 1 A 85 85 ASP CB C 85 40.633 43.956 -3.323 1 1 461 . 1 1 1 A 85 85 ASP N N 85 122.510 124.813 -2.303 1 1 462 . 1 1 1 A 86 86 ASN H H 86 7.736 8.795 -1.059 1 1 463 . 1 1 1 A 86 86 ASN C C 86 175.970 174.562 1.408 1 1 464 . 1 1 1 A 86 86 ASN CA C 86 54.349 51.410 2.939 1 1 465 . 1 1 1 A 86 86 ASN CB C 86 40.490 42.298 -1.808 1 1 467 . 1 1 1 A 86 86 ASN N N 86 124.290 118.418 5.872 1 1 468 . 1 1 1 A 87 87 GLY H H 87 8.000 8.697 -0.697 1 1 469 . 1 1 1 A 87 87 GLY C C 87 173.456 175.558 -2.102 1 1 470 . 1 1 1 A 87 87 GLY CA C 87 44.973 45.759 -0.786 1 1 471 . 1 1 1 A 87 87 GLY N N 87 113.494 111.841 1.653 1 1 472 . 1 1 1 A 88 88 ALA H H 88 8.024 8.119 -0.095 1 1 473 . 1 1 1 A 88 88 ALA C C 88 176.833 176.399 0.434 1 1 474 . 1 1 1 A 88 88 ALA CA C 88 51.734 54.946 -3.212 1 1 475 . 1 1 1 A 88 88 ALA CB C 88 19.818 19.400 0.418 1 1 476 . 1 1 1 A 88 88 ALA N N 88 122.676 120.965 1.711 1 1 477 . 1 1 1 A 91 91 ALA C C 91 174.781 176.350 -1.569 1 1 478 . 1 1 1 A 91 91 ALA CA C 91 50.537 50.356 0.181 1 1 479 . 1 1 1 A 91 91 ALA CB C 91 21.324 22.456 -1.132 1 1 480 . 1 1 1 A 92 92 GLN H H 92 8.451 8.724 -0.273 1 1 481 . 1 1 1 A 92 92 GLN C C 92 173.557 175.510 -1.953 1 1 482 . 1 1 1 A 92 92 GLN CA C 92 53.380 54.910 -1.530 1 1 484 . 1 1 1 A 92 92 GLN N N 92 116.847 119.530 -2.683 1 1 485 . 1 1 1 A 93 93 GLY C C 93 170.631 172.707 -2.076 1 1 486 . 1 1 1 A 93 93 GLY CA C 93 45.718 45.358 0.360 1 1 487 . 1 1 1 A 94 94 VAL H H 94 8.686 9.407 -0.721 1 1 494 . 1 1 1 A 94 94 VAL C C 94 173.698 173.814 -0.116 1 1 495 . 1 1 1 A 94 94 VAL CA C 94 58.997 60.200 -1.203 1 1 496 . 1 1 1 A 94 94 VAL CB C 94 33.311 34.434 -1.123 1 1 499 . 1 1 1 A 94 94 VAL N N 94 118.489 120.424 -1.935 1 1 500 . 1 1 1 A 95 95 GLN H H 95 9.468 9.539 -0.071 1 1 501 . 1 1 1 A 95 95 GLN C C 95 174.028 173.786 0.242 1 1 502 . 1 1 1 A 95 95 GLN CA C 95 52.547 54.133 -1.586 1 1 503 . 1 1 1 A 95 95 GLN CB C 95 33.816 31.718 2.098 1 1 505 . 1 1 1 A 95 95 GLN N N 95 122.106 125.738 -3.632 1 1 506 . 1 1 1 A 96 96 LEU H H 96 8.484 8.944 -0.460 1 1 513 . 1 1 1 A 96 96 LEU C C 96 175.322 174.805 0.517 1 1 514 . 1 1 1 A 96 96 LEU CA C 96 53.736 53.705 0.031 1 1 515 . 1 1 1 A 96 96 LEU CB C 96 41.088 45.006 -3.918 1 1 519 . 1 1 1 A 96 96 LEU N N 96 123.224 127.310 -4.086 1 1 520 . 1 1 1 A 97 97 THR H H 97 9.116 8.707 0.409 1 1 521 . 1 1 1 A 97 97 THR C C 97 173.251 172.738 0.513 1 1 522 . 1 1 1 A 97 97 THR CA C 97 58.931 60.825 -1.894 1 1 523 . 1 1 1 A 97 97 THR CB C 97 72.984 70.608 2.376 1 1 525 . 1 1 1 A 97 97 THR N N 97 112.504 118.457 -5.953 1 1 526 . 1 1 1 A 98 98 ALA H H 98 8.603 8.784 -0.181 1 1 527 . 1 1 1 A 98 98 ALA C C 98 174.948 175.329 -0.381 1 1 528 . 1 1 1 A 98 98 ALA CA C 98 49.980 50.033 -0.053 1 1 529 . 1 1 1 A 98 98 ALA CB C 98 19.157 20.607 -1.450 1 1 530 . 1 1 1 A 98 98 ALA N N 98 121.608 126.400 -4.792 1 1 531 . 1 1 1 A 99 99 LYS H H 99 8.890 9.313 -0.423 1 1 532 . 1 1 1 A 99 99 LYS C C 99 174.294 175.235 -0.941 1 1 533 . 1 1 1 A 99 99 LYS CA C 99 54.019 54.691 -0.672 1 1 534 . 1 1 1 A 99 99 LYS CB C 99 33.018 35.440 -2.422 1 1 538 . 1 1 1 A 99 99 LYS N N 99 124.522 123.480 1.042 1 1 539 . 1 1 1 A 100 100 LEU H H 100 8.985 8.866 0.119 1 1 546 . 1 1 1 A 100 100 LEU C C 100 175.265 175.733 -0.468 1 1 547 . 1 1 1 A 100 100 LEU CA C 100 52.698 53.245 -0.547 1 1 548 . 1 1 1 A 100 100 LEU CB C 100 42.889 44.675 -1.786 1 1 552 . 1 1 1 A 100 100 LEU N N 100 131.876 123.398 8.478 1 1 553 . 1 1 1 A 101 101 GLY H H 101 9.137 8.431 0.706 1 1 554 . 1 1 1 A 101 101 GLY C C 101 170.798 171.806 -1.008 1 1 555 . 1 1 1 A 101 101 GLY CA C 101 44.429 46.044 -1.615 1 1 556 . 1 1 1 A 101 101 GLY N N 101 111.928 107.846 4.082 1 1 557 . 1 1 1 A 102 102 TYR H H 102 8.779 8.850 -0.071 1 1 558 . 1 1 1 A 102 102 TYR C C 102 173.402 173.837 -0.435 1 1 559 . 1 1 1 A 102 102 TYR CA C 102 54.444 56.566 -2.122 1 1 560 . 1 1 1 A 102 102 TYR CB C 102 42.239 42.542 -0.303 1 1 561 . 1 1 1 A 102 102 TYR N N 102 116.664 119.670 -3.006 1 1 562 . 1 1 1 A 103 103 PRO C C 103 175.676 176.564 -0.888 1 1 563 . 1 1 1 A 103 103 PRO CA C 103 61.462 62.276 -0.814 1 1 564 . 1 1 1 A 103 103 PRO CB C 103 30.073 33.277 -3.204 1 1 565 . 1 1 1 A 104 104 ILE H H 104 8.670 9.169 -0.499 1 1 569 . 1 1 1 A 104 104 ILE C C 104 176.646 176.496 0.150 1 1 570 . 1 1 1 A 104 104 ILE CA C 104 62.054 62.542 -0.488 1 1 571 . 1 1 1 A 104 104 ILE CB C 104 37.678 39.307 -1.629 1 1 574 . 1 1 1 A 104 104 ILE N N 104 125.939 120.020 5.919 1 1 575 . 1 1 1 A 105 105 THR H H 105 8.129 7.942 0.187 1 1 576 . 1 1 1 A 105 105 THR C C 105 174.344 174.675 -0.331 1 1 577 . 1 1 1 A 105 105 THR CA C 105 59.176 63.418 -4.242 1 1 578 . 1 1 1 A 105 105 THR CB C 105 71.049 71.040 0.009 1 1 580 . 1 1 1 A 105 105 THR N N 105 109.853 112.419 -2.566 1 1 581 . 1 1 1 A 106 106 ASP H H 106 8.424 7.672 0.752 1 1 582 . 1 1 1 A 106 106 ASP C C 106 175.692 175.397 0.295 1 1 583 . 1 1 1 A 106 106 ASP CA C 106 56.465 53.112 3.353 1 1 584 . 1 1 1 A 106 106 ASP CB C 106 40.032 41.450 -1.418 1 1 585 . 1 1 1 A 106 106 ASP N N 106 117.156 118.270 -1.114 1 1 586 . 1 1 1 A 107 107 ASP H H 107 8.124 7.887 0.237 1 1 587 . 1 1 1 A 107 107 ASP C C 107 174.174 175.699 -1.525 1 1 588 . 1 1 1 A 107 107 ASP CA C 107 52.907 54.654 -1.747 1 1 589 . 1 1 1 A 107 107 ASP CB C 107 41.661 43.043 -1.382 1 1 590 . 1 1 1 A 107 107 ASP N N 107 113.591 116.169 -2.578 1 1 591 . 1 1 1 A 108 108 LEU H H 108 7.336 8.027 -0.691 1 1 598 . 1 1 1 A 108 108 LEU C C 108 174.321 175.394 -1.073 1 1 599 . 1 1 1 A 108 108 LEU CA C 108 54.449 53.621 0.828 1 1 600 . 1 1 1 A 108 108 LEU CB C 108 44.754 43.935 0.819 1 1 604 . 1 1 1 A 108 108 LEU N N 108 123.244 119.709 3.535 1 1 605 . 1 1 1 A 109 109 ASP H H 109 8.943 9.108 -0.165 1 1 606 . 1 1 1 A 109 109 ASP C C 109 176.248 174.634 1.614 1 1 607 . 1 1 1 A 109 109 ASP CA C 109 52.376 52.413 -0.037 1 1 608 . 1 1 1 A 109 109 ASP CB C 109 42.764 44.959 -2.195 1 1 609 . 1 1 1 A 109 109 ASP N N 109 124.634 121.759 2.875 1 1 610 . 1 1 1 A 110 110 ILE H H 110 8.372 8.738 -0.366 1 1 614 . 1 1 1 A 110 110 ILE C C 110 173.735 174.480 -0.745 1 1 615 . 1 1 1 A 110 110 ILE CA C 110 59.129 59.234 -0.105 1 1 616 . 1 1 1 A 110 110 ILE CB C 110 39.402 40.733 -1.331 1 1 620 . 1 1 1 A 110 110 ILE N N 110 119.135 117.462 1.673 1 1 621 . 1 1 1 A 111 111 TYR H H 111 8.695 8.658 0.037 1 1 622 . 1 1 1 A 111 111 TYR C C 111 172.838 173.229 -0.391 1 1 623 . 1 1 1 A 111 111 TYR CA C 111 56.182 56.121 0.061 1 1 624 . 1 1 1 A 111 111 TYR CB C 111 41.489 41.554 -0.065 1 1 625 . 1 1 1 A 111 111 TYR N N 111 121.248 119.232 2.016 1 1 626 . 1 1 1 A 112 112 THR H H 112 9.172 9.029 0.143 1 1 627 . 1 1 1 A 112 112 THR C C 112 173.850 173.892 -0.042 1 1 628 . 1 1 1 A 112 112 THR CA C 112 58.246 60.396 -2.150 1 1 629 . 1 1 1 A 112 112 THR CB C 112 71.676 71.634 0.042 1 1 631 . 1 1 1 A 112 112 THR N N 112 110.671 112.602 -1.931 1 1 632 . 1 1 1 A 113 113 ARG H H 113 8.732 9.464 -0.732 1 1 633 . 1 1 1 A 113 113 ARG C C 113 175.037 174.769 0.268 1 1 634 . 1 1 1 A 113 113 ARG CA C 113 53.995 54.856 -0.861 1 1 635 . 1 1 1 A 113 113 ARG CB C 113 32.266 33.089 -0.823 1 1 638 . 1 1 1 A 113 113 ARG N N 113 120.642 122.909 -2.267 1 1 639 . 1 1 1 A 114 114 LEU H H 114 8.449 9.134 -0.685 1 1 646 . 1 1 1 A 114 114 LEU C C 114 175.812 175.799 0.013 1 1 647 . 1 1 1 A 114 114 LEU CA C 114 53.335 53.618 -0.283 1 1 648 . 1 1 1 A 114 114 LEU CB C 114 45.182 44.828 0.354 1 1 652 . 1 1 1 A 114 114 LEU N N 114 119.078 124.333 -5.255 1 1 653 . 1 1 1 A 115 115 GLY H H 115 8.232 8.627 -0.395 1 1 654 . 1 1 1 A 115 115 GLY C C 115 171.343 172.354 -1.011 1 1 655 . 1 1 1 A 115 115 GLY CA C 115 46.217 46.131 0.086 1 1 656 . 1 1 1 A 115 115 GLY N N 115 108.966 112.365 -3.399 1 1 657 . 1 1 1 A 116 116 GLY H H 116 8.293 8.417 -0.124 1 1 658 . 1 1 1 A 116 116 GLY C C 116 169.856 171.684 -1.828 1 1 659 . 1 1 1 A 116 116 GLY CA C 116 44.084 45.554 -1.470 1 1 660 . 1 1 1 A 116 116 GLY N N 116 109.676 110.896 -1.220 1 1 661 . 1 1 1 A 117 117 MET H H 117 9.286 9.110 0.176 1 1 662 . 1 1 1 A 117 117 MET C C 117 174.557 174.729 -0.172 1 1 663 . 1 1 1 A 117 117 MET CA C 117 53.258 53.932 -0.674 1 1 664 . 1 1 1 A 117 117 MET CB C 117 37.195 35.759 1.436 1 1 667 . 1 1 1 A 117 117 MET N N 117 120.425 119.991 0.434 1 1 668 . 1 1 1 A 118 118 VAL H H 118 9.062 9.153 -0.091 1 1 675 . 1 1 1 A 118 118 VAL C C 118 173.993 175.160 -1.167 1 1 676 . 1 1 1 A 118 118 VAL CA C 118 59.883 61.323 -1.440 1 1 677 . 1 1 1 A 118 118 VAL CB C 118 31.782 34.205 -2.423 1 1 680 . 1 1 1 A 118 118 VAL N N 118 126.948 121.737 5.211 1 1 681 . 1 1 1 A 119 119 TRP H H 119 8.482 8.563 -0.081 1 1 682 . 1 1 1 A 119 119 TRP C C 119 174.608 173.725 0.883 1 1 683 . 1 1 1 A 119 119 TRP CA C 119 53.332 54.531 -1.199 1 1 684 . 1 1 1 A 119 119 TRP CB C 119 33.569 32.894 0.675 1 1 685 . 1 1 1 A 119 119 TRP N N 119 124.631 125.435 -0.804 1 1 686 . 1 1 1 A 120 120 ARG H H 120 9.113 9.179 -0.066 1 1 687 . 1 1 1 A 120 120 ARG C C 120 174.951 175.348 -0.397 1 1 688 . 1 1 1 A 120 120 ARG CA C 120 54.684 54.860 -0.176 1 1 689 . 1 1 1 A 120 120 ARG CB C 120 33.424 33.541 -0.117 1 1 690 . 1 1 1 A 120 120 ARG N N 120 117.899 119.663 -1.764 1 1 691 . 1 1 1 A 121 121 ALA H H 121 9.299 8.863 0.436 1 1 692 . 1 1 1 A 121 121 ALA C C 121 175.954 176.567 -0.613 1 1 693 . 1 1 1 A 121 121 ALA CA C 121 50.368 51.213 -0.845 1 1 694 . 1 1 1 A 121 121 ALA CB C 121 21.141 20.234 0.907 1 1 695 . 1 1 1 A 121 121 ALA N N 121 128.863 123.731 5.132 1 1 696 . 1 1 1 A 122 122 ASP H H 122 8.488 8.358 0.130 1 1 697 . 1 1 1 A 122 122 ASP C C 122 175.635 175.934 -0.299 1 1 698 . 1 1 1 A 122 122 ASP CA C 122 53.891 54.254 -0.363 1 1 699 . 1 1 1 A 122 122 ASP CB C 122 42.492 41.631 0.861 1 1 700 . 1 1 1 A 122 122 ASP N N 122 121.721 121.849 -0.128 1 1 701 . 1 1 1 A 123 123 SER H H 123 8.466 8.616 -0.150 1 1 702 . 1 1 1 A 123 123 SER C C 123 174.325 174.635 -0.310 1 1 703 . 1 1 1 A 123 123 SER CA C 123 57.325 58.686 -1.361 1 1 704 . 1 1 1 A 123 123 SER CB C 123 63.988 63.792 0.196 1 1 705 . 1 1 1 A 123 123 SER N N 123 117.374 120.944 -3.570 1 1 706 . 1 1 1 A 124 124 LYS H H 124 8.389 8.607 -0.218 1 1 707 . 1 1 1 A 124 124 LYS C C 124 176.840 176.492 0.348 1 1 708 . 1 1 1 A 124 124 LYS CA C 124 56.036 56.574 -0.538 1 1 709 . 1 1 1 A 124 124 LYS CB C 124 32.397 32.925 -0.528 1 1 711 . 1 1 1 A 124 124 LYS N N 124 122.883 123.889 -1.006 1 1 712 . 1 1 1 A 125 125 GLY H H 125 8.281 8.554 -0.273 1 1 713 . 1 1 1 A 125 125 GLY C C 125 173.592 172.439 1.153 1 1 714 . 1 1 1 A 125 125 GLY CA C 125 44.924 45.753 -0.829 1 1 715 . 1 1 1 A 125 125 GLY N N 125 109.541 110.384 -0.843 1 1 716 . 1 1 1 A 126 126 ASN H H 126 8.185 8.629 -0.444 1 1 717 . 1 1 1 A 126 126 ASN C C 126 176.649 173.634 3.015 1 1 718 . 1 1 1 A 126 126 ASN CA C 126 52.763 52.442 0.321 1 1 719 . 1 1 1 A 126 126 ASN CB C 126 38.439 36.968 1.471 1 1 720 . 1 1 1 A 126 126 ASN N N 126 119.019 120.804 -1.785 1 1 721 . 1 1 1 A 127 127 TYR C C 127 176.913 174.930 1.983 1 1 722 . 1 1 1 A 127 127 TYR CA C 127 57.757 56.985 0.772 1 1 723 . 1 1 1 A 127 127 TYR CB C 127 37.703 41.528 -3.825 1 1 724 . 1 1 1 A 128 128 ALA H H 128 8.050 8.919 -0.869 1 1 728 . 1 1 1 A 128 128 ALA C C 128 177.756 175.714 2.042 1 1 729 . 1 1 1 A 128 128 ALA CA C 128 52.321 51.189 1.132 1 1 730 . 1 1 1 A 128 128 ALA CB C 128 18.273 21.071 -2.798 1 1 731 . 1 1 1 A 128 128 ALA N N 128 124.529 123.703 0.826 1 1 732 . 1 1 1 A 129 129 SER H H 129 8.063 8.818 -0.755 1 1 733 . 1 1 1 A 129 129 SER C C 129 174.938 172.383 2.555 1 1 734 . 1 1 1 A 129 129 SER CA C 129 58.202 56.988 1.214 1 1 735 . 1 1 1 A 129 129 SER CB C 129 62.974 65.757 -2.783 1 1 736 . 1 1 1 A 129 129 SER N N 129 114.374 117.869 -3.495 1 1 737 . 1 1 1 A 130 130 THR H H 130 7.875 8.672 -0.797 1 1 741 . 1 1 1 A 130 130 THR C C 130 175.198 174.482 0.716 1 1 742 . 1 1 1 A 130 130 THR CA C 130 61.520 60.581 0.939 1 1 743 . 1 1 1 A 130 130 THR CB C 130 69.312 69.287 0.025 1 1 745 . 1 1 1 A 130 130 THR N N 130 113.608 116.932 -3.324 1 1 746 . 1 1 1 A 131 131 GLY H H 131 8.219 7.525 0.694 1 1 747 . 1 1 1 A 131 131 GLY C C 131 173.979 173.260 0.719 1 1 748 . 1 1 1 A 131 131 GLY CA C 131 44.991 46.211 -1.220 1 1 749 . 1 1 1 A 131 131 GLY N N 131 110.848 109.691 1.157 1 1 750 . 1 1 1 A 132 132 VAL H H 132 7.729 8.031 -0.302 1 1 757 . 1 1 1 A 132 132 VAL C C 132 175.988 174.815 1.173 1 1 758 . 1 1 1 A 132 132 VAL CA C 132 61.643 60.896 0.747 1 1 759 . 1 1 1 A 132 132 VAL CB C 132 31.941 33.578 -1.637 1 1 762 . 1 1 1 A 132 132 VAL N N 132 118.932 121.661 -2.729 1 1 763 . 1 1 1 A 133 133 SER H H 133 8.224 8.830 -0.606 1 1 764 . 1 1 1 A 133 133 SER C C 133 174.320 172.328 1.992 1 1 765 . 1 1 1 A 133 133 SER CA C 133 57.756 57.584 0.172 1 1 766 . 1 1 1 A 133 133 SER CB C 133 63.140 66.215 -3.075 1 1 767 . 1 1 1 A 133 133 SER N N 133 119.260 121.851 -2.591 1 1 768 . 1 1 1 A 134 134 ARG H H 134 8.199 8.556 -0.357 1 1 769 . 1 1 1 A 134 134 ARG C C 134 175.923 175.572 0.351 1 1 770 . 1 1 1 A 134 134 ARG CA C 134 55.461 55.033 0.428 1 1 771 . 1 1 1 A 134 134 ARG CB C 134 30.195 31.611 -1.416 1 1 774 . 1 1 1 A 134 134 ARG N N 134 123.262 121.448 1.814 1 1 775 . 1 1 1 A 135 135 SER H H 135 8.256 8.641 -0.385 1 1 776 . 1 1 1 A 135 135 SER C C 135 174.360 173.556 0.804 1 1 777 . 1 1 1 A 135 135 SER CA C 135 57.730 57.562 0.168 1 1 778 . 1 1 1 A 135 135 SER CB C 135 63.275 63.725 -0.450 1 1 779 . 1 1 1 A 135 135 SER N N 135 117.155 121.910 -4.755 1 1 780 . 1 1 1 A 136 136 GLU H H 136 8.374 7.806 0.568 1 1 781 . 1 1 1 A 136 136 GLU C C 136 176.284 175.622 0.662 1 1 782 . 1 1 1 A 136 136 GLU CA C 136 56.082 54.381 1.701 1 1 783 . 1 1 1 A 136 136 GLU CB C 136 29.820 33.458 -3.638 1 1 785 . 1 1 1 A 136 136 GLU N N 136 122.812 118.621 4.191 1 1 786 . 1 1 1 A 137 137 HIS H H 137 8.118 8.738 -0.620 1 1 787 . 1 1 1 A 137 137 HIS C C 137 173.529 173.035 0.494 1 1 788 . 1 1 1 A 137 137 HIS CA C 137 54.793 53.605 1.188 1 1 789 . 1 1 1 A 137 137 HIS CB C 137 30.191 29.731 0.460 1 1 790 . 1 1 1 A 137 137 HIS N N 137 118.002 116.585 1.417 1 1 791 . 1 1 1 A 138 138 ASP H H 138 8.572 9.076 -0.504 1 1 792 . 1 1 1 A 138 138 ASP C C 138 174.940 174.879 0.061 1 1 793 . 1 1 1 A 138 138 ASP CA C 138 53.594 52.184 1.410 1 1 794 . 1 1 1 A 138 138 ASP CB C 138 42.165 44.341 -2.176 1 1 795 . 1 1 1 A 138 138 ASP N N 138 121.536 124.271 -2.735 1 1 796 . 1 1 1 A 139 139 THR H H 139 7.857 8.489 -0.632 1 1 797 . 1 1 1 A 139 139 THR C C 139 172.822 173.904 -1.082 1 1 798 . 1 1 1 A 139 139 THR CA C 139 59.197 60.746 -1.549 1 1 799 . 1 1 1 A 139 139 THR CB C 139 71.457 70.210 1.247 1 1 801 . 1 1 1 A 139 139 THR N N 139 113.598 112.636 0.962 1 1 802 . 1 1 1 A 140 140 GLY C C 140 169.622 171.293 -1.671 1 1 803 . 1 1 1 A 140 140 GLY CA C 140 44.287 44.234 0.053 1 1 804 . 1 1 1 A 141 141 VAL H H 141 7.815 8.316 -0.501 1 1 811 . 1 1 1 A 141 141 VAL C C 141 176.038 173.493 2.545 1 1 812 . 1 1 1 A 141 141 VAL CA C 141 59.739 59.522 0.217 1 1 813 . 1 1 1 A 141 141 VAL CB C 141 33.308 34.945 -1.637 1 1 816 . 1 1 1 A 141 141 VAL N N 141 116.224 122.846 -6.622 1 1 817 . 1 1 1 A 142 142 SER H H 142 9.284 8.956 0.328 1 1 818 . 1 1 1 A 142 142 SER C C 142 171.050 172.404 -1.354 1 1 819 . 1 1 1 A 142 142 SER CB C 142 67.608 66.672 0.936 1 1 820 . 1 1 1 A 142 142 SER N N 142 123.223 122.051 1.172 1 1 821 . 1 1 1 A 143 143 PRO C C 143 174.032 176.407 -2.375 1 1 822 . 1 1 1 A 143 143 PRO CA C 143 62.350 62.447 -0.097 1 1 823 . 1 1 1 A 143 143 PRO CB C 143 31.774 32.307 -0.533 1 1 825 . 1 1 1 A 144 144 VAL H H 144 7.785 8.912 -1.127 1 1 832 . 1 1 1 A 144 144 VAL C C 144 172.826 174.425 -1.599 1 1 833 . 1 1 1 A 144 144 VAL CA C 144 59.770 59.975 -0.205 1 1 834 . 1 1 1 A 144 144 VAL CB C 144 34.407 36.120 -1.713 1 1 837 . 1 1 1 A 144 144 VAL N N 144 120.214 117.381 2.833 1 1 838 . 1 1 1 A 145 145 PHE H H 145 8.623 9.144 -0.521 1 1 839 . 1 1 1 A 145 145 PHE C C 145 173.658 172.758 0.900 1 1 840 . 1 1 1 A 145 145 PHE CA C 145 54.942 55.950 -1.008 1 1 841 . 1 1 1 A 145 145 PHE CB C 145 42.692 42.495 0.197 1 1 842 . 1 1 1 A 145 145 PHE N N 145 123.914 119.195 4.719 1 1 843 . 1 1 1 A 146 146 ALA H H 146 8.886 9.043 -0.157 1 1 844 . 1 1 1 A 146 146 ALA C C 146 176.258 176.486 -0.228 1 1 845 . 1 1 1 A 146 146 ALA CA C 146 49.734 50.590 -0.856 1 1 846 . 1 1 1 A 146 146 ALA CB C 146 22.244 22.844 -0.600 1 1 847 . 1 1 1 A 146 146 ALA N N 146 125.243 123.562 1.681 1 1 848 . 1 1 1 A 147 147 GLY H H 147 8.470 8.447 0.023 1 1 849 . 1 1 1 A 147 147 GLY C C 147 170.940 172.564 -1.624 1 1 850 . 1 1 1 A 147 147 GLY CA C 147 44.063 45.092 -1.029 1 1 851 . 1 1 1 A 147 147 GLY N N 147 106.669 105.243 1.426 1 1 852 . 1 1 1 A 148 148 GLY H H 148 8.008 8.164 -0.156 1 1 853 . 1 1 1 A 148 148 GLY C C 148 170.181 172.157 -1.976 1 1 854 . 1 1 1 A 148 148 GLY CA C 148 45.736 45.547 0.189 1 1 855 . 1 1 1 A 148 148 GLY N N 148 109.475 109.043 0.432 1 1 856 . 1 1 1 A 149 149 VAL H H 149 8.426 8.028 0.398 1 1 863 . 1 1 1 A 149 149 VAL C C 149 174.157 173.117 1.040 1 1 864 . 1 1 1 A 149 149 VAL CA C 149 58.200 58.548 -0.348 1 1 865 . 1 1 1 A 149 149 VAL CB C 149 34.464 35.607 -1.143 1 1 868 . 1 1 1 A 149 149 VAL N N 149 112.651 117.357 -4.706 1 1 869 . 1 1 1 A 150 150 GLU H H 150 9.070 8.911 0.159 1 1 870 . 1 1 1 A 150 150 GLU C C 150 173.892 174.483 -0.591 1 1 871 . 1 1 1 A 150 150 GLU CA C 150 54.617 54.783 -0.166 1 1 872 . 1 1 1 A 150 150 GLU CB C 150 32.911 33.612 -0.701 1 1 874 . 1 1 1 A 150 150 GLU N N 150 124.471 120.198 4.273 1 1 875 . 1 1 1 A 151 151 TRP H H 151 9.461 9.265 0.196 1 1 877 . 1 1 1 A 151 151 TRP C C 151 174.370 175.290 -0.920 1 1 878 . 1 1 1 A 151 151 TRP CA C 151 54.113 56.017 -1.904 1 1 879 . 1 1 1 A 151 151 TRP CB C 151 31.688 32.836 -1.148 1 1 880 . 1 1 1 A 151 151 TRP N N 151 129.611 125.271 4.340 1 1 882 . 1 1 1 A 152 152 ALA H H 152 8.771 9.159 -0.388 1 1 883 . 1 1 1 A 152 152 ALA C C 152 175.079 176.679 -1.600 1 1 884 . 1 1 1 A 152 152 ALA CA C 152 51.417 50.815 0.602 1 1 885 . 1 1 1 A 152 152 ALA CB C 152 17.209 20.310 -3.101 1 1 886 . 1 1 1 A 152 152 ALA N N 152 130.502 126.622 3.880 1 1 887 . 1 1 1 A 153 153 VAL H H 153 7.893 8.813 -0.920 1 1 894 . 1 1 1 A 153 153 VAL C C 153 176.612 176.067 0.545 1 1 895 . 1 1 1 A 153 153 VAL CA C 153 63.600 63.999 -0.399 1 1 896 . 1 1 1 A 153 153 VAL CB C 153 31.280 32.500 -1.220 1 1 899 . 1 1 1 A 153 153 VAL N N 153 124.360 123.517 0.843 1 1 900 . 1 1 1 A 154 154 THR H H 154 7.950 7.802 0.148 1 1 904 . 1 1 1 A 154 154 THR C C 154 173.884 175.211 -1.327 1 1 905 . 1 1 1 A 154 154 THR CA C 154 58.655 61.683 -3.028 1 1 906 . 1 1 1 A 154 154 THR CB C 154 71.262 69.850 1.412 1 1 908 . 1 1 1 A 154 154 THR N N 154 109.176 114.480 -5.304 1 1 909 . 1 1 1 A 155 155 ARG H H 155 8.310 8.642 -0.332 1 1 910 . 1 1 1 A 155 155 ARG C C 155 176.753 176.724 0.029 1 1 911 . 1 1 1 A 155 155 ARG CA C 155 58.456 58.607 -0.151 1 1 912 . 1 1 1 A 155 155 ARG CB C 155 29.043 30.252 -1.209 1 1 915 . 1 1 1 A 155 155 ARG N N 155 116.576 124.002 -7.426 1 1 916 . 1 1 1 A 156 156 ASP H H 156 7.783 8.175 -0.392 1 1 917 . 1 1 1 A 156 156 ASP C C 156 174.222 175.549 -1.327 1 1 918 . 1 1 1 A 156 156 ASP CA C 156 53.540 53.320 0.220 1 1 919 . 1 1 1 A 156 156 ASP CB C 156 42.327 41.404 0.923 1 1 920 . 1 1 1 A 156 156 ASP N N 156 112.950 114.536 -1.586 1 1 921 . 1 1 1 A 157 157 ILE H H 157 7.233 7.591 -0.358 1 1 925 . 1 1 1 A 157 157 ILE C C 157 174.178 175.269 -1.091 1 1 926 . 1 1 1 A 157 157 ILE CA C 157 59.350 61.127 -1.777 1 1 927 . 1 1 1 A 157 157 ILE CB C 157 38.969 39.997 -1.028 1 1 930 . 1 1 1 A 157 157 ILE N N 157 119.732 120.016 -0.284 1 1 931 . 1 1 1 A 158 158 ALA H H 158 8.729 9.562 -0.833 1 1 932 . 1 1 1 A 158 158 ALA C C 158 176.567 176.582 -0.015 1 1 933 . 1 1 1 A 158 158 ALA CA C 158 49.418 50.358 -0.940 1 1 934 . 1 1 1 A 158 158 ALA CB C 158 21.430 22.786 -1.356 1 1 935 . 1 1 1 A 158 158 ALA N N 158 128.564 130.221 -1.657 1 1 936 . 1 1 1 A 159 159 THR H H 159 8.972 9.192 -0.220 1 1 940 . 1 1 1 A 159 159 THR C C 159 172.213 173.942 -1.729 1 1 941 . 1 1 1 A 159 159 THR CA C 159 59.504 59.518 -0.014 1 1 942 . 1 1 1 A 159 159 THR CB C 159 70.728 71.955 -1.227 1 1 944 . 1 1 1 A 159 159 THR N N 159 114.901 109.983 4.918 1 1 945 . 1 1 1 A 160 160 ARG H H 160 8.924 9.374 -0.450 1 1 946 . 1 1 1 A 160 160 ARG C C 160 174.097 173.927 0.170 1 1 947 . 1 1 1 A 160 160 ARG CA C 160 53.066 54.207 -1.141 1 1 948 . 1 1 1 A 160 160 ARG CB C 160 32.922 34.261 -1.339 1 1 951 . 1 1 1 A 160 160 ARG N N 160 121.507 120.666 0.841 1 1 952 . 1 1 1 A 161 161 LEU H H 161 8.611 8.740 -0.129 1 1 959 . 1 1 1 A 161 161 LEU C C 161 174.389 174.732 -0.343 1 1 960 . 1 1 1 A 161 161 LEU CA C 161 53.355 53.765 -0.410 1 1 961 . 1 1 1 A 161 161 LEU CB C 161 44.360 45.415 -1.055 1 1 964 . 1 1 1 A 161 161 LEU N N 161 124.711 122.280 2.431 1 1 965 . 1 1 1 A 162 162 GLU H H 162 8.746 8.850 -0.104 1 1 966 . 1 1 1 A 162 162 GLU C C 162 173.376 175.265 -1.889 1 1 967 . 1 1 1 A 162 162 GLU CA C 162 53.904 54.856 -0.952 1 1 968 . 1 1 1 A 162 162 GLU CB C 162 33.773 32.833 0.940 1 1 970 . 1 1 1 A 162 162 GLU N N 162 122.300 126.129 -3.829 1 1 971 . 1 1 1 A 163 163 TYR H H 163 8.872 8.823 0.049 1 1 972 . 1 1 1 A 163 163 TYR C C 163 173.425 176.210 -2.785 1 1 973 . 1 1 1 A 163 163 TYR CA C 163 56.192 56.976 -0.784 1 1 974 . 1 1 1 A 163 163 TYR CB C 163 40.870 43.552 -2.682 1 1 975 . 1 1 1 A 163 163 TYR N N 163 124.618 121.552 3.066 1 1 976 . 1 1 1 A 171 171 ASP C C 171 175.753 174.549 1.204 1 1 977 . 1 1 1 A 171 171 ASP CA C 171 53.517 52.783 0.734 1 1 978 . 1 1 1 A 171 171 ASP CB C 171 41.353 44.664 -3.311 1 1 979 . 1 1 1 A 172 172 ALA H H 172 8.336 8.379 -0.043 1 1 983 . 1 1 1 A 172 172 ALA C C 172 178.110 176.339 1.771 1 1 984 . 1 1 1 A 172 172 ALA CA C 172 52.190 51.685 0.505 1 1 985 . 1 1 1 A 172 172 ALA CB C 172 18.305 22.873 -4.568 1 1 986 . 1 1 1 A 172 172 ALA N N 172 125.294 123.652 1.642 1 1 987 . 1 1 1 A 173 173 GLY H H 173 8.300 8.476 -0.176 1 1 988 . 1 1 1 A 173 173 GLY C C 173 174.437 174.019 0.418 1 1 989 . 1 1 1 A 173 173 GLY CA C 173 45.083 45.900 -0.817 1 1 990 . 1 1 1 A 173 173 GLY N N 173 107.268 111.531 -4.263 1 1 991 . 1 1 1 A 174 174 THR H H 174 7.754 7.606 0.148 1 1 992 . 1 1 1 A 174 174 THR C C 174 174.738 172.414 2.324 1 1 993 . 1 1 1 A 174 174 THR CA C 174 61.310 60.761 0.549 1 1 994 . 1 1 1 A 174 174 THR CB C 174 69.310 71.078 -1.768 1 1 996 . 1 1 1 A 174 174 THR N N 174 113.472 112.617 0.855 1 1 997 . 1 1 1 A 175 175 VAL H H 175 7.993 8.833 -0.840 1 1 1004 . 1 1 1 A 175 175 VAL C C 175 176.535 174.866 1.669 1 1 1005 . 1 1 1 A 175 175 VAL CA C 175 62.126 60.174 1.952 1 1 1006 . 1 1 1 A 175 175 VAL CB C 175 31.282 34.642 -3.360 1 1 1009 . 1 1 1 A 175 175 VAL N N 175 121.643 121.814 -0.171 1 1 1010 . 1 1 1 A 176 176 GLY H H 176 8.056 8.963 -0.907 1 1 1011 . 1 1 1 A 176 176 GLY C C 176 173.930 172.770 1.160 1 1 1012 . 1 1 1 A 176 176 GLY CA C 176 44.983 45.249 -0.266 1 1 1013 . 1 1 1 A 176 176 GLY N N 176 110.460 111.985 -1.525 1 1 1014 . 1 1 1 A 177 177 THR H H 177 7.520 8.273 -0.753 1 1 1015 . 1 1 1 A 177 177 THR C C 177 173.574 174.298 -0.724 1 1 1016 . 1 1 1 A 177 177 THR CA C 177 60.609 60.561 0.048 1 1 1017 . 1 1 1 A 177 177 THR CB C 177 69.506 70.718 -1.212 1 1 1019 . 1 1 1 A 177 177 THR N N 177 113.390 115.340 -1.950 1 1 1020 . 1 1 1 A 178 178 ARG H H 178 8.261 8.832 -0.571 1 1 1021 . 1 1 1 A 178 178 ARG C C 178 173.932 175.154 -1.222 1 1 1022 . 1 1 1 A 178 178 ARG CA C 178 53.683 61.429 -7.746 1 1 1023 . 1 1 1 A 178 178 ARG CB C 178 29.224 28.775 0.449 1 1 1026 . 1 1 1 A 178 178 ARG N N 178 123.906 126.004 -2.098 1 1 1027 . 1 1 1 A 183 183 MET C C 183 174.053 174.477 -0.424 1 1 1028 . 1 1 1 A 183 183 MET CA C 183 53.700 54.356 -0.656 1 1 1029 . 1 1 1 A 183 183 MET CB C 183 35.908 36.960 -1.052 1 1 1032 . 1 1 1 A 184 184 LEU H H 184 8.319 8.575 -0.256 1 1 1033 . 1 1 1 A 184 184 LEU C C 184 175.235 175.636 -0.401 1 1 1034 . 1 1 1 A 184 184 LEU CA C 184 53.120 53.971 -0.851 1 1 1035 . 1 1 1 A 184 184 LEU CB C 184 42.857 42.940 -0.083 1 1 1038 . 1 1 1 A 184 184 LEU N N 184 131.293 124.775 6.518 1 1 1039 . 1 1 1 A 185 185 SER H H 185 9.603 8.780 0.823 1 1 1040 . 1 1 1 A 185 185 SER C C 185 171.293 172.189 -0.896 1 1 1041 . 1 1 1 A 185 185 SER CA C 185 56.504 57.645 -1.141 1 1 1042 . 1 1 1 A 185 185 SER CB C 185 66.585 66.314 0.271 1 1 1043 . 1 1 1 A 185 185 SER N N 185 119.338 117.263 2.075 1 1 1044 . 1 1 1 A 186 186 LEU H H 186 8.583 8.238 0.345 1 1 1051 . 1 1 1 A 186 186 LEU C C 186 175.328 176.555 -1.227 1 1 1052 . 1 1 1 A 186 186 LEU CA C 186 52.729 53.176 -0.447 1 1 1053 . 1 1 1 A 186 186 LEU CB C 186 44.996 44.849 0.147 1 1 1056 . 1 1 1 A 186 186 LEU N N 186 122.719 120.953 1.766 1 1 1057 . 1 1 1 A 187 187 GLY H H 187 9.287 8.388 0.899 1 1 1058 . 1 1 1 A 187 187 GLY C C 187 172.315 173.056 -0.741 1 1 1059 . 1 1 1 A 187 187 GLY CA C 187 43.502 45.185 -1.683 1 1 1060 . 1 1 1 A 187 187 GLY N N 187 110.265 110.504 -0.239 1 1 1061 . 1 1 1 A 188 188 VAL H H 188 8.825 8.680 0.145 1 1 1068 . 1 1 1 A 188 188 VAL C C 188 173.125 174.853 -1.728 1 1 1069 . 1 1 1 A 188 188 VAL CA C 188 59.739 59.317 0.422 1 1 1070 . 1 1 1 A 188 188 VAL CB C 188 34.532 35.310 -0.778 1 1 1073 . 1 1 1 A 188 188 VAL N N 188 119.161 116.314 2.847 1 1 1074 . 1 1 1 A 189 189 SER H H 189 9.051 9.183 -0.132 1 1 1075 . 1 1 1 A 189 189 SER C C 189 171.698 173.153 -1.455 1 1 1076 . 1 1 1 A 189 189 SER CA C 189 55.997 56.906 -0.909 1 1 1077 . 1 1 1 A 189 189 SER CB C 189 66.094 67.130 -1.036 1 1 1078 . 1 1 1 A 189 189 SER N N 189 117.810 118.677 -0.867 1 1 1079 . 1 1 1 A 190 190 TYR H H 190 9.145 9.321 -0.176 1 1 1080 . 1 1 1 A 190 190 TYR C C 190 174.063 173.558 0.505 1 1 1081 . 1 1 1 A 190 190 TYR CA C 190 55.375 55.578 -0.203 1 1 1082 . 1 1 1 A 190 190 TYR CB C 190 41.183 41.620 -0.437 1 1 1083 . 1 1 1 A 190 190 TYR N N 190 123.690 117.765 5.925 1 1 1084 . 1 1 1 A 191 191 ARG H H 191 8.211 8.590 -0.379 1 1 1085 . 1 1 1 A 191 191 ARG C C 191 174.826 176.446 -1.620 1 1 1086 . 1 1 1 A 191 191 ARG CA C 191 54.464 56.253 -1.789 1 1 1087 . 1 1 1 A 191 191 ARG CB C 191 30.507 30.988 -0.481 1 1 1090 . 1 1 1 A 191 191 ARG N N 191 125.366 121.125 4.241 1 1 1091 . 1 1 1 A 192 192 PHE H H 192 8.496 9.466 -0.970 1 1 1092 . 1 1 1 A 192 192 PHE C C 192 176.384 174.666 1.718 1 1 1093 . 1 1 1 A 192 192 PHE CA C 192 57.179 56.714 0.465 1 1 1094 . 1 1 1 A 192 192 PHE CB C 192 39.430 38.729 0.701 1 1 1095 . 1 1 1 A 192 192 PHE N N 192 121.586 123.450 -1.864 1 1 1096 . 1 1 1 A 193 193 GLY H H 193 8.643 8.486 0.157 1 1 1097 . 1 1 1 A 193 193 GLY C C 193 174.466 172.151 2.315 1 1 1098 . 1 1 1 A 193 193 GLY CA C 193 45.126 44.468 0.658 1 1 1099 . 1 1 1 A 193 193 GLY N N 193 109.499 113.343 -3.844 1 1 1100 . 1 1 1 A 194 194 GLN H H 194 8.512 8.441 0.071 1 1 1101 . 1 1 1 A 194 194 GLN C C 194 176.201 174.466 1.735 1 1 1102 . 1 1 1 A 194 194 GLN CA C 194 55.433 55.319 0.114 1 1 1103 . 1 1 1 A 194 194 GLN CB C 194 28.729 31.447 -2.718 1 1 1105 . 1 1 1 A 194 194 GLN N N 194 119.448 121.806 -2.358 1 1 1106 . 1 1 1 A 195 195 GLU H H 195 8.530 8.670 -0.140 1 1 1107 . 1 1 1 A 195 195 GLU C C 195 176.151 175.855 0.296 1 1 1108 . 1 1 1 A 195 195 GLU CA C 195 56.256 56.248 0.008 1 1 1109 . 1 1 1 A 195 195 GLU CB C 195 29.486 30.617 -1.131 1 1 1111 . 1 1 1 A 195 195 GLU N N 195 121.959 125.782 -3.823 1 1 1112 . 1 1 1 A 196 196 ASP H H 196 8.253 8.559 -0.306 1 1 1113 . 1 1 1 A 196 196 ASP C C 196 175.667 175.745 -0.078 1 1 1114 . 1 1 1 A 196 196 ASP CA C 196 53.981 54.355 -0.374 1 1 1115 . 1 1 1 A 196 196 ASP CB C 196 40.700 41.719 -1.019 1 1 1116 . 1 1 1 A 196 196 ASP N N 196 121.819 123.672 -1.853 1 1 1117 . 1 1 1 A 197 197 ALA H H 197 7.999 8.532 -0.533 1 1 1121 . 1 1 1 A 197 197 ALA C C 197 176.847 175.681 1.166 1 1 1122 . 1 1 1 A 197 197 ALA CA C 197 51.612 51.429 0.183 1 1 1123 . 1 1 1 A 197 197 ALA CB C 197 18.192 22.679 -4.487 1 1 1124 . 1 1 1 A 197 197 ALA N N 197 124.262 121.474 2.788 1 1 1125 . 1 1 1 A 198 198 ALA H H 198 8.042 8.425 -0.383 1 1 1126 . 1 1 1 A 198 198 ALA C C 198 176.865 174.827 2.038 1 1 1127 . 1 1 1 A 198 198 ALA CA C 198 49.999 49.340 0.659 1 1 1128 . 1 1 1 A 198 198 ALA CB C 198 17.327 22.272 -4.945 1 1 1129 . 1 1 1 A 198 198 ALA N N 198 124.724 122.072 2.652 1 1 1130 . 1 1 1 A 199 199 PRO C C 199 176.727 175.908 0.819 1 1 1131 . 1 1 1 A 199 199 PRO CA C 199 62.399 62.846 -0.447 1 1 1132 . 1 1 1 A 199 199 PRO CB C 199 30.949 30.890 0.059 1 1 1135 . 1 1 1 A 200 200 VAL H H 200 8.026 8.220 -0.194 1 1 1142 . 1 1 1 A 200 200 VAL C C 200 176.034 174.578 1.456 1 1 1143 . 1 1 1 A 200 200 VAL CA C 200 61.944 61.503 0.441 1 1 1144 . 1 1 1 A 200 200 VAL CB C 200 31.734 33.611 -1.877 1 1 1147 . 1 1 1 A 200 200 VAL N N 200 120.635 123.710 -3.075 1 1 1148 . 1 1 1 A 201 201 VAL H H 201 7.966 8.730 -0.764 1 1 1155 . 1 1 1 A 201 201 VAL C C 201 175.128 176.107 -0.979 1 1 1156 . 1 1 1 A 201 201 VAL CA C 201 61.249 61.599 -0.350 1 1 1157 . 1 1 1 A 201 201 VAL CB C 201 31.917 30.825 1.092 1 1 1160 . 1 1 1 A 201 201 VAL N N 201 124.053 126.718 -2.665 1 1 1161 . 1 1 1 A 202 202 ALA H H 202 8.159 8.338 -0.179 1 1 1162 . 1 1 1 A 202 202 ALA C C 202 175.153 176.278 -1.125 1 1 1163 . 1 1 1 A 202 202 ALA CA C 202 49.742 56.749 -7.007 1 1 1164 . 1 1 1 A 202 202 ALA CB C 202 17.532 18.429 -0.897 1 1 1165 . 1 1 1 A 202 202 ALA N N 202 129.251 126.397 2.854 1 1 1166 . 1 1 1 A 203 203 PRO C C 203 176.273 176.676 -0.403 1 1 1167 . 1 1 1 A 203 203 PRO CA C 203 62.324 65.882 -3.558 1 1 1168 . 1 1 1 A 203 203 PRO CB C 203 31.042 30.710 0.332 1 1 1170 . 1 1 1 A 204 204 ALA H H 204 8.137 8.023 0.114 1 1 1171 . 1 1 1 A 204 204 ALA C C 204 175.697 176.147 -0.450 1 1 1172 . 1 1 1 A 204 204 ALA CA C 204 49.865 50.317 -0.452 1 1 1173 . 1 1 1 A 204 204 ALA CB C 204 17.364 19.859 -2.495 1 1 1174 . 1 1 1 A 204 204 ALA N N 204 125.510 121.085 4.425 1 1 1175 . 1 1 1 A 205 205 PRO C C 205 175.430 176.648 -1.218 1 1 1176 . 1 1 1 A 205 205 PRO CA C 205 62.511 62.458 0.053 1 1 1177 . 1 1 1 A 205 205 PRO CB C 205 31.056 31.786 -0.730 1 1 1179 . 1 1 1 A 206 206 ALA H H 206 7.847 8.437 -0.590 1 1 1180 . 1 1 1 A 206 206 ALA C C 206 175.565 178.141 -2.576 1 1 1181 . 1 1 1 A 206 206 ALA CA C 206 49.487 55.547 -6.060 1 1 1182 . 1 1 1 A 206 206 ALA CB C 206 18.843 19.422 -0.579 1 1 1183 . 1 1 1 A 206 206 ALA N N 206 123.663 127.050 -3.387 1 1 1184 . 1 1 1 A 207 207 PRO C C 207 174.397 176.922 -2.525 1 1 1185 . 1 1 1 A 207 207 PRO CA C 207 61.454 62.858 -1.404 1 1 1186 . 1 1 1 A 207 207 PRO CB C 207 31.929 31.660 0.269 1 1 1187 . 1 1 1 A 208 208 ALA H H 208 7.898 8.568 -0.670 1 1 1188 . 1 1 1 A 208 208 ALA C C 208 175.411 176.497 -1.086 1 1 1189 . 1 1 1 A 208 208 ALA CA C 208 49.472 56.058 -6.586 1 1 1190 . 1 1 1 A 208 208 ALA CB C 208 19.082 18.658 0.424 1 1 1191 . 1 1 1 A 208 208 ALA N N 208 127.450 127.508 -0.058 1 1 1192 . 1 1 1 A 209 209 PRO C C 209 176.932 176.671 0.261 1 1 1193 . 1 1 1 A 209 209 PRO CA C 209 62.736 65.236 -2.500 1 1 1194 . 1 1 1 A 209 209 PRO CB C 209 31.012 31.651 -0.639 1 1 1 . 2 1 1 A 2 2 ARG C C 2 175.857 174.893 0.964 1 1 2 . 2 1 1 A 2 2 ARG CA C 2 55.872 55.186 0.686 1 1 3 . 2 1 1 A 2 2 ARG CB C 2 29.983 31.137 -1.154 1 1 5 . 2 1 1 A 3 3 ILE H H 3 8.238 8.697 -0.459 1 1 9 . 2 1 1 A 3 3 ILE C C 3 175.763 174.652 1.111 1 1 10 . 2 1 1 A 3 3 ILE CA C 3 60.779 59.051 1.728 1 1 11 . 2 1 1 A 3 3 ILE CB C 3 37.664 41.600 -3.936 1 1 15 . 2 1 1 A 3 3 ILE N N 3 122.580 121.942 0.638 1 1 16 . 2 1 1 A 4 4 MET H H 4 8.261 8.888 -0.627 1 1 17 . 2 1 1 A 4 4 MET C C 4 175.660 174.278 1.382 1 1 18 . 2 1 1 A 4 4 MET CA C 4 54.893 54.581 0.312 1 1 19 . 2 1 1 A 4 4 MET CB C 4 32.060 34.849 -2.789 1 1 22 . 2 1 1 A 4 4 MET N N 4 123.988 123.349 0.639 1 1 23 . 2 1 1 A 5 5 LYS H H 5 8.041 9.115 -1.074 1 1 24 . 2 1 1 A 5 5 LYS C C 5 175.850 176.342 -0.492 1 1 25 . 2 1 1 A 5 5 LYS CA C 5 56.081 54.604 1.477 1 1 26 . 2 1 1 A 5 5 LYS CB C 5 32.220 35.427 -3.207 1 1 29 . 2 1 1 A 5 5 LYS N N 5 122.015 127.798 -5.783 1 1 30 . 2 1 1 A 6 6 ALA H H 6 8.042 8.659 -0.617 1 1 34 . 2 1 1 A 6 6 ALA C C 6 177.160 177.052 0.108 1 1 35 . 2 1 1 A 6 6 ALA CA C 6 52.109 51.712 0.397 1 1 36 . 2 1 1 A 6 6 ALA CB C 6 18.637 19.171 -0.534 1 1 37 . 2 1 1 A 6 6 ALA N N 6 123.943 127.824 -3.881 1 1 38 . 2 1 1 A 7 7 ILE H H 7 7.916 7.477 0.439 1 1 42 . 2 1 1 A 7 7 ILE C C 7 175.611 175.233 0.378 1 1 43 . 2 1 1 A 7 7 ILE CA C 7 61.181 62.075 -0.894 1 1 44 . 2 1 1 A 7 7 ILE CB C 7 37.910 38.292 -0.382 1 1 48 . 2 1 1 A 7 7 ILE N N 7 118.380 120.673 -2.293 1 1 49 . 2 1 1 A 8 8 PHE H H 8 8.167 8.439 -0.272 1 1 50 . 2 1 1 A 8 8 PHE C C 8 175.363 175.212 0.151 1 1 51 . 2 1 1 A 8 8 PHE CA C 8 57.286 57.883 -0.597 1 1 52 . 2 1 1 A 8 8 PHE CB C 8 39.008 39.981 -0.973 1 1 53 . 2 1 1 A 8 8 PHE N N 8 121.971 130.383 -8.412 1 1 54 . 2 1 1 A 9 9 VAL H H 9 7.872 8.436 -0.564 1 1 61 . 2 1 1 A 9 9 VAL C C 9 175.405 175.969 -0.564 1 1 62 . 2 1 1 A 9 9 VAL CA C 9 61.662 63.603 -1.941 1 1 63 . 2 1 1 A 9 9 VAL CB C 9 32.026 33.289 -1.263 1 1 66 . 2 1 1 A 9 9 VAL N N 9 120.864 127.141 -6.277 1 1 67 . 2 1 1 A 10 10 LEU H H 10 8.077 7.527 0.550 1 1 74 . 2 1 1 A 10 10 LEU C C 10 176.652 177.041 -0.389 1 1 75 . 2 1 1 A 10 10 LEU CA C 10 54.856 53.669 1.187 1 1 76 . 2 1 1 A 10 10 LEU CB C 10 41.401 42.969 -1.568 1 1 80 . 2 1 1 A 10 10 LEU N N 10 124.826 119.169 5.657 1 1 81 . 2 1 1 A 11 11 ASN H H 11 8.177 8.717 -0.540 1 1 82 . 2 1 1 A 11 11 ASN C C 11 174.394 174.366 0.028 1 1 83 . 2 1 1 A 11 11 ASN CA C 11 52.704 52.813 -0.109 1 1 84 . 2 1 1 A 11 11 ASN CB C 11 38.468 36.834 1.634 1 1 85 . 2 1 1 A 11 11 ASN N N 11 119.029 120.671 -1.642 1 1 86 . 2 1 1 A 12 12 ALA H H 12 7.991 7.373 0.618 1 1 90 . 2 1 1 A 12 12 ALA C C 12 176.649 176.602 0.047 1 1 91 . 2 1 1 A 12 12 ALA CA C 12 51.950 50.789 1.161 1 1 92 . 2 1 1 A 12 12 ALA CB C 12 18.659 19.960 -1.301 1 1 93 . 2 1 1 A 12 12 ALA N N 12 123.695 123.242 0.453 1 1 94 . 2 1 1 A 13 13 ALA H H 13 8.083 8.582 -0.499 1 1 95 . 2 1 1 A 13 13 ALA C C 13 175.395 177.735 -2.340 1 1 96 . 2 1 1 A 13 13 ALA CA C 13 49.797 50.817 -1.020 1 1 97 . 2 1 1 A 13 13 ALA CB C 13 17.486 17.767 -0.281 1 1 98 . 2 1 1 A 13 13 ALA N N 13 124.281 127.204 -2.923 1 1 99 . 2 1 1 A 14 14 PRO C C 14 176.641 176.344 0.297 1 1 100 . 2 1 1 A 14 14 PRO CA C 14 62.675 64.688 -2.013 1 1 101 . 2 1 1 A 14 14 PRO CB C 14 31.000 32.154 -1.154 1 1 103 . 2 1 1 A 15 15 LYS H H 15 8.283 7.639 0.644 1 1 104 . 2 1 1 A 15 15 LYS C C 15 175.683 174.817 0.866 1 1 105 . 2 1 1 A 15 15 LYS CA C 15 55.429 55.231 0.198 1 1 106 . 2 1 1 A 15 15 LYS CB C 15 32.246 35.304 -3.058 1 1 109 . 2 1 1 A 15 15 LYS N N 15 119.069 116.811 2.258 1 1 110 . 2 1 1 A 16 16 ASP H H 16 7.880 8.749 -0.869 1 1 111 . 2 1 1 A 16 16 ASP C C 16 175.419 175.835 -0.416 1 1 112 . 2 1 1 A 16 16 ASP CA C 16 54.413 54.299 0.114 1 1 113 . 2 1 1 A 16 16 ASP CB C 16 40.224 42.041 -1.817 1 1 114 . 2 1 1 A 16 16 ASP N N 16 119.625 127.824 -8.199 1 1 115 . 2 1 1 A 17 17 ASN H H 17 7.973 9.271 -1.298 1 1 116 . 2 1 1 A 17 17 ASN C C 17 174.231 174.624 -0.393 1 1 117 . 2 1 1 A 17 17 ASN CA C 17 53.948 55.050 -1.102 1 1 118 . 2 1 1 A 17 17 ASN CB C 17 37.009 40.352 -3.343 1 1 119 . 2 1 1 A 17 17 ASN N N 17 118.063 120.122 -2.059 1 1 120 . 2 1 1 A 18 18 THR H H 18 7.318 7.828 -0.510 1 1 121 . 2 1 1 A 18 18 THR C C 18 172.323 172.042 0.281 1 1 122 . 2 1 1 A 18 18 THR CA C 18 60.153 61.066 -0.913 1 1 123 . 2 1 1 A 18 18 THR CB C 18 71.534 70.854 0.680 1 1 125 . 2 1 1 A 18 18 THR N N 18 109.092 110.927 -1.835 1 1 126 . 2 1 1 A 19 19 TRP H H 19 8.541 8.597 -0.056 1 1 127 . 2 1 1 A 19 19 TRP C C 19 175.969 175.279 0.690 1 1 128 . 2 1 1 A 19 19 TRP CA C 19 55.700 55.363 0.337 1 1 129 . 2 1 1 A 19 19 TRP CB C 19 31.471 33.331 -1.860 1 1 130 . 2 1 1 A 19 19 TRP N N 19 121.992 125.138 -3.146 1 1 131 . 2 1 1 A 20 20 TYR H H 20 8.691 9.069 -0.378 1 1 132 . 2 1 1 A 20 20 TYR C C 20 173.684 174.942 -1.258 1 1 133 . 2 1 1 A 20 20 TYR CA C 20 55.805 56.143 -0.338 1 1 134 . 2 1 1 A 20 20 TYR CB C 20 40.513 42.231 -1.718 1 1 135 . 2 1 1 A 20 20 TYR N N 20 116.519 121.571 -5.052 1 1 136 . 2 1 1 A 21 21 ALA H H 21 8.876 8.808 0.068 1 1 137 . 2 1 1 A 21 21 ALA C C 21 175.395 175.845 -0.450 1 1 138 . 2 1 1 A 21 21 ALA CA C 21 50.970 51.171 -0.201 1 1 139 . 2 1 1 A 21 21 ALA CB C 21 22.142 23.514 -1.372 1 1 140 . 2 1 1 A 21 21 ALA N N 21 119.359 123.401 -4.042 1 1 141 . 2 1 1 A 22 22 GLY H H 22 8.613 7.833 0.780 1 1 142 . 2 1 1 A 22 22 GLY C C 22 171.458 171.264 0.194 1 1 143 . 2 1 1 A 22 22 GLY CA C 22 45.608 45.483 0.125 1 1 144 . 2 1 1 A 22 22 GLY N N 22 106.678 105.945 0.733 1 1 145 . 2 1 1 A 23 23 GLY H H 23 7.911 8.033 -0.122 1 1 146 . 2 1 1 A 23 23 GLY C C 23 170.563 172.139 -1.576 1 1 147 . 2 1 1 A 23 23 GLY CA C 23 44.026 44.641 -0.615 1 1 148 . 2 1 1 A 23 23 GLY N N 23 103.399 108.144 -4.745 1 1 149 . 2 1 1 A 24 24 LYS H H 24 9.001 9.569 -0.568 1 1 150 . 2 1 1 A 24 24 LYS C C 24 172.965 174.306 -1.341 1 1 151 . 2 1 1 A 24 24 LYS CA C 24 54.062 54.188 -0.126 1 1 152 . 2 1 1 A 24 24 LYS CB C 24 36.774 36.743 0.031 1 1 156 . 2 1 1 A 24 24 LYS N N 24 116.402 119.405 -3.003 1 1 157 . 2 1 1 A 25 25 LEU H H 25 8.587 9.548 -0.961 1 1 164 . 2 1 1 A 25 25 LEU C C 25 175.205 175.408 -0.203 1 1 165 . 2 1 1 A 25 25 LEU CA C 25 53.446 53.201 0.245 1 1 166 . 2 1 1 A 25 25 LEU CB C 25 46.287 46.842 -0.555 1 1 170 . 2 1 1 A 25 25 LEU N N 25 119.932 121.542 -1.610 1 1 171 . 2 1 1 A 26 26 GLY H H 26 8.637 8.202 0.435 1 1 172 . 2 1 1 A 26 26 GLY C C 26 170.804 172.502 -1.698 1 1 173 . 2 1 1 A 26 26 GLY CA C 26 45.669 46.108 -0.439 1 1 174 . 2 1 1 A 26 26 GLY N N 26 108.136 110.521 -2.385 1 1 175 . 2 1 1 A 27 27 TRP H H 27 8.642 9.148 -0.506 1 1 177 . 2 1 1 A 27 27 TRP C C 27 174.820 172.830 1.990 1 1 178 . 2 1 1 A 27 27 TRP CB C 27 30.883 33.006 -2.123 1 1 179 . 2 1 1 A 27 27 TRP N N 27 120.887 117.811 3.076 1 1 181 . 2 1 1 A 32 32 ASP C C 32 176.315 175.812 0.503 1 1 182 . 2 1 1 A 32 32 ASP CA C 32 53.737 53.079 0.658 1 1 183 . 2 1 1 A 32 32 ASP CB C 32 41.230 44.732 -3.502 1 1 184 . 2 1 1 A 33 33 THR H H 33 8.190 8.964 -0.774 1 1 188 . 2 1 1 A 33 33 THR C C 33 175.291 174.649 0.642 1 1 189 . 2 1 1 A 33 33 THR CA C 33 61.909 63.267 -1.358 1 1 190 . 2 1 1 A 33 33 THR CB C 33 68.961 70.862 -1.901 1 1 192 . 2 1 1 A 33 33 THR N N 33 114.235 117.681 -3.446 1 1 193 . 2 1 1 A 34 34 GLY H H 34 8.341 7.865 0.476 1 1 194 . 2 1 1 A 34 34 GLY C C 34 173.766 174.351 -0.585 1 1 195 . 2 1 1 A 34 34 GLY CA C 34 44.941 44.748 0.193 1 1 196 . 2 1 1 A 34 34 GLY N N 34 110.678 108.735 1.943 1 1 197 . 2 1 1 A 35 35 PHE H H 35 7.945 8.774 -0.829 1 1 198 . 2 1 1 A 35 35 PHE C C 35 175.411 176.314 -0.903 1 1 199 . 2 1 1 A 35 35 PHE CA C 35 57.921 59.356 -1.435 1 1 200 . 2 1 1 A 35 35 PHE CB C 35 38.806 41.048 -2.242 1 1 201 . 2 1 1 A 35 35 PHE N N 35 120.533 121.107 -0.574 1 1 202 . 2 1 1 A 36 36 TYR H H 36 7.967 8.313 -0.346 1 1 203 . 2 1 1 A 36 36 TYR C C 36 176.104 176.202 -0.098 1 1 204 . 2 1 1 A 36 36 TYR CA C 36 57.568 59.272 -1.704 1 1 205 . 2 1 1 A 36 36 TYR CB C 36 37.727 40.269 -2.542 1 1 206 . 2 1 1 A 36 36 TYR N N 36 120.254 114.985 5.269 1 1 207 . 2 1 1 A 37 37 GLY H H 37 7.666 8.160 -0.494 1 1 208 . 2 1 1 A 37 37 GLY C C 37 173.794 175.129 -1.335 1 1 209 . 2 1 1 A 37 37 GLY CA C 37 45.007 45.849 -0.842 1 1 210 . 2 1 1 A 37 37 GLY N N 37 108.995 106.755 2.240 1 1 211 . 2 1 1 A 38 38 ASN H H 38 8.109 9.017 -0.908 1 1 212 . 2 1 1 A 38 38 ASN C C 38 175.612 175.501 0.111 1 1 213 . 2 1 1 A 38 38 ASN CA C 38 52.954 55.375 -2.421 1 1 214 . 2 1 1 A 38 38 ASN CB C 38 38.425 39.353 -0.928 1 1 215 . 2 1 1 A 38 38 ASN N N 38 118.603 123.641 -5.038 1 1 216 . 2 1 1 A 39 39 GLY H H 39 8.202 7.708 0.494 1 1 217 . 2 1 1 A 39 39 GLY C C 39 173.958 172.781 1.177 1 1 218 . 2 1 1 A 39 39 GLY CA C 39 45.012 45.096 -0.084 1 1 219 . 2 1 1 A 39 39 GLY N N 39 108.897 106.217 2.680 1 1 220 . 2 1 1 A 40 40 PHE H H 40 7.960 8.197 -0.237 1 1 221 . 2 1 1 A 40 40 PHE C C 40 175.653 176.608 -0.955 1 1 222 . 2 1 1 A 40 40 PHE CA C 40 57.556 57.251 0.305 1 1 223 . 2 1 1 A 40 40 PHE CB C 40 38.513 41.784 -3.271 1 1 224 . 2 1 1 A 40 40 PHE N N 40 119.829 118.890 0.939 1 1 225 . 2 1 1 A 41 41 GLN H H 41 8.173 8.610 -0.437 1 1 226 . 2 1 1 A 41 41 GLN C C 41 175.234 176.629 -1.395 1 1 227 . 2 1 1 A 41 41 GLN CA C 41 55.488 59.104 -3.616 1 1 228 . 2 1 1 A 41 41 GLN CB C 41 28.523 29.276 -0.753 1 1 230 . 2 1 1 A 41 41 GLN N N 41 120.810 120.611 0.199 1 1 231 . 2 1 1 A 42 42 ASN H H 42 8.193 8.005 0.188 1 1 232 . 2 1 1 A 42 42 ASN C C 42 174.618 175.051 -0.433 1 1 233 . 2 1 1 A 42 42 ASN CA C 42 52.924 53.021 -0.097 1 1 234 . 2 1 1 A 42 42 ASN CB C 42 38.333 40.042 -1.709 1 1 235 . 2 1 1 A 42 42 ASN N N 42 119.679 117.020 2.659 1 1 236 . 2 1 1 A 43 43 ASN H H 43 8.255 8.648 -0.393 1 1 237 . 2 1 1 A 43 43 ASN C C 43 173.873 174.571 -0.698 1 1 238 . 2 1 1 A 43 43 ASN CA C 43 52.919 53.585 -0.666 1 1 239 . 2 1 1 A 43 43 ASN CB C 43 38.580 37.419 1.161 1 1 240 . 2 1 1 A 43 43 ASN N N 43 119.773 121.188 -1.415 1 1 241 . 2 1 1 A 44 44 ASN H H 44 7.865 8.752 -0.887 1 1 242 . 2 1 1 A 44 44 ASN C C 44 175.518 174.515 1.003 1 1 243 . 2 1 1 A 44 44 ASN CA C 44 54.528 51.938 2.590 1 1 244 . 2 1 1 A 44 44 ASN CB C 44 40.170 41.109 -0.939 1 1 246 . 2 1 1 A 44 44 ASN N N 44 124.152 122.766 1.386 1 1 247 . 2 1 1 A 46 46 PRO C C 46 177.228 175.958 1.270 1 1 248 . 2 1 1 A 46 46 PRO CA C 46 62.794 62.578 0.216 1 1 249 . 2 1 1 A 46 46 PRO CB C 46 31.283 33.401 -2.118 1 1 251 . 2 1 1 A 47 47 THR H H 47 8.165 8.433 -0.268 1 1 255 . 2 1 1 A 47 47 THR C C 47 174.573 174.730 -0.157 1 1 256 . 2 1 1 A 47 47 THR CA C 47 61.346 62.121 -0.775 1 1 257 . 2 1 1 A 47 47 THR CB C 47 69.573 69.814 -0.241 1 1 259 . 2 1 1 A 47 47 THR N N 47 114.265 109.035 5.230 1 1 260 . 2 1 1 A 48 48 ARG H H 48 8.237 7.926 0.311 1 1 261 . 2 1 1 A 48 48 ARG C C 48 175.898 175.360 0.538 1 1 262 . 2 1 1 A 48 48 ARG CA C 48 55.717 55.382 0.335 1 1 263 . 2 1 1 A 48 48 ARG CB C 48 30.151 31.228 -1.077 1 1 266 . 2 1 1 A 48 48 ARG N N 48 122.795 119.404 3.391 1 1 267 . 2 1 1 A 49 49 ASN H H 49 8.369 7.706 0.663 1 1 268 . 2 1 1 A 49 49 ASN C C 49 174.560 174.274 0.286 1 1 269 . 2 1 1 A 49 49 ASN CA C 49 53.005 51.359 1.646 1 1 270 . 2 1 1 A 49 49 ASN CB C 49 38.761 42.043 -3.282 1 1 271 . 2 1 1 A 49 49 ASN N N 49 119.837 116.548 3.289 1 1 272 . 2 1 1 A 50 50 ASP H H 50 8.192 8.682 -0.490 1 1 273 . 2 1 1 A 50 50 ASP C C 50 175.699 175.624 0.075 1 1 274 . 2 1 1 A 50 50 ASP CA C 50 54.289 53.287 1.002 1 1 275 . 2 1 1 A 50 50 ASP CB C 50 41.264 43.106 -1.842 1 1 276 . 2 1 1 A 50 50 ASP N N 50 120.403 120.851 -0.448 1 1 277 . 2 1 1 A 51 51 GLN H H 51 8.428 8.739 -0.311 1 1 278 . 2 1 1 A 51 51 GLN C C 51 175.186 174.860 0.326 1 1 279 . 2 1 1 A 51 51 GLN CA C 51 54.512 54.785 -0.273 1 1 280 . 2 1 1 A 51 51 GLN CB C 51 30.424 29.241 1.183 1 1 282 . 2 1 1 A 51 51 GLN N N 51 118.959 121.656 -2.697 1 1 289 . 2 1 1 A 52 52 LEU C C 52 176.018 175.866 0.152 1 1 290 . 2 1 1 A 52 52 LEU CA C 52 54.332 52.743 1.589 1 1 291 . 2 1 1 A 52 52 LEU CB C 52 43.022 45.706 -2.684 1 1 294 . 2 1 1 A 53 53 GLY H H 53 8.639 8.462 0.177 1 1 295 . 2 1 1 A 53 53 GLY C C 53 171.931 172.178 -0.247 1 1 296 . 2 1 1 A 53 53 GLY CA C 53 43.501 45.350 -1.849 1 1 297 . 2 1 1 A 53 53 GLY N N 53 109.964 106.704 3.260 1 1 298 . 2 1 1 A 54 54 ALA H H 54 8.881 8.334 0.547 1 1 299 . 2 1 1 A 54 54 ALA C C 54 175.543 176.933 -1.390 1 1 300 . 2 1 1 A 54 54 ALA CA C 54 50.710 50.763 -0.053 1 1 301 . 2 1 1 A 54 54 ALA CB C 54 22.914 22.680 0.234 1 1 302 . 2 1 1 A 54 54 ALA N N 54 120.413 121.623 -1.210 1 1 303 . 2 1 1 A 55 55 GLY H H 55 8.346 8.626 -0.280 1 1 304 . 2 1 1 A 55 55 GLY C C 55 170.960 171.845 -0.885 1 1 305 . 2 1 1 A 55 55 GLY CA C 55 46.704 45.910 0.794 1 1 306 . 2 1 1 A 55 55 GLY N N 55 104.688 105.870 -1.182 1 1 307 . 2 1 1 A 56 56 ALA H H 56 9.116 8.363 0.753 1 1 308 . 2 1 1 A 56 56 ALA C C 56 176.472 176.798 -0.326 1 1 309 . 2 1 1 A 56 56 ALA CA C 56 49.638 50.850 -1.212 1 1 310 . 2 1 1 A 56 56 ALA CB C 56 22.275 20.992 1.283 1 1 311 . 2 1 1 A 56 56 ALA N N 56 120.608 123.181 -2.573 1 1 312 . 2 1 1 A 57 57 PHE H H 57 8.688 8.354 0.334 1 1 313 . 2 1 1 A 57 57 PHE C C 57 172.816 173.048 -0.232 1 1 314 . 2 1 1 A 57 57 PHE CA C 57 56.066 55.252 0.814 1 1 315 . 2 1 1 A 57 57 PHE CB C 57 41.770 41.488 0.282 1 1 316 . 2 1 1 A 57 57 PHE N N 57 120.027 115.046 4.981 1 1 317 . 2 1 1 A 58 58 GLY H H 58 9.034 8.744 0.290 1 1 318 . 2 1 1 A 58 58 GLY C C 58 170.860 171.626 -0.766 1 1 319 . 2 1 1 A 58 58 GLY CA C 58 44.954 44.390 0.564 1 1 320 . 2 1 1 A 58 58 GLY N N 58 105.817 106.839 -1.022 1 1 321 . 2 1 1 A 59 59 GLY H H 59 8.382 9.288 -0.906 1 1 322 . 2 1 1 A 59 59 GLY C C 59 169.284 171.947 -2.663 1 1 323 . 2 1 1 A 59 59 GLY CA C 59 45.840 44.797 1.043 1 1 324 . 2 1 1 A 59 59 GLY N N 59 109.059 113.069 -4.010 1 1 325 . 2 1 1 A 60 60 TYR H H 60 8.430 8.841 -0.411 1 1 326 . 2 1 1 A 60 60 TYR C C 60 173.453 174.581 -1.128 1 1 327 . 2 1 1 A 60 60 TYR CA C 60 55.282 56.409 -1.127 1 1 328 . 2 1 1 A 60 60 TYR CB C 60 41.712 40.292 1.420 1 1 329 . 2 1 1 A 60 60 TYR N N 60 118.352 123.462 -5.110 1 1 330 . 2 1 1 A 61 61 GLN H H 61 8.833 8.692 0.141 1 1 331 . 2 1 1 A 61 61 GLN C C 61 174.365 175.634 -1.269 1 1 332 . 2 1 1 A 61 61 GLN CA C 61 54.125 56.000 -1.875 1 1 333 . 2 1 1 A 61 61 GLN CB C 61 28.033 30.064 -2.031 1 1 335 . 2 1 1 A 61 61 GLN N N 61 129.628 125.025 4.603 1 1 336 . 2 1 1 A 62 62 VAL H H 62 8.714 8.869 -0.155 1 1 343 . 2 1 1 A 62 62 VAL C C 62 175.758 175.384 0.374 1 1 344 . 2 1 1 A 62 62 VAL CA C 62 64.649 63.449 1.200 1 1 345 . 2 1 1 A 62 62 VAL CB C 62 31.900 34.448 -2.548 1 1 348 . 2 1 1 A 62 62 VAL N N 62 127.666 124.896 2.770 1 1 349 . 2 1 1 A 63 63 ASN H H 63 8.062 8.259 -0.197 1 1 350 . 2 1 1 A 63 63 ASN C C 63 172.827 173.776 -0.949 1 1 351 . 2 1 1 A 63 63 ASN CA C 63 51.575 50.155 1.420 1 1 352 . 2 1 1 A 63 63 ASN CB C 63 37.194 39.558 -2.364 1 1 353 . 2 1 1 A 63 63 ASN N N 63 116.310 117.518 -1.208 1 1 354 . 2 1 1 A 64 64 PRO C C 64 175.071 175.983 -0.912 1 1 355 . 2 1 1 A 64 64 PRO CA C 64 65.296 62.505 2.791 1 1 356 . 2 1 1 A 64 64 PRO CB C 64 30.428 29.452 0.976 1 1 357 . 2 1 1 A 65 65 TYR H H 65 7.873 8.531 -0.658 1 1 358 . 2 1 1 A 65 65 TYR C C 65 175.145 174.946 0.199 1 1 359 . 2 1 1 A 65 65 TYR CA C 65 56.125 58.759 -2.634 1 1 360 . 2 1 1 A 65 65 TYR CB C 65 39.189 40.882 -1.693 1 1 361 . 2 1 1 A 65 65 TYR N N 65 112.894 123.226 -10.332 1 1 362 . 2 1 1 A 66 66 LEU H H 66 7.308 7.732 -0.424 1 1 369 . 2 1 1 A 66 66 LEU C C 66 173.866 174.507 -0.641 1 1 370 . 2 1 1 A 66 66 LEU CA C 66 53.431 53.962 -0.531 1 1 371 . 2 1 1 A 66 66 LEU CB C 66 44.958 44.281 0.677 1 1 375 . 2 1 1 A 66 66 LEU N N 66 120.270 117.103 3.167 1 1 376 . 2 1 1 A 67 67 GLY H H 67 8.855 8.563 0.292 1 1 377 . 2 1 1 A 67 67 GLY C C 67 170.698 172.154 -1.456 1 1 378 . 2 1 1 A 67 67 GLY CA C 67 44.008 44.193 -0.185 1 1 379 . 2 1 1 A 67 67 GLY N N 67 114.388 106.585 7.803 1 1 380 . 2 1 1 A 68 68 PHE H H 68 8.770 9.361 -0.591 1 1 381 . 2 1 1 A 68 68 PHE C C 68 173.386 175.027 -1.641 1 1 382 . 2 1 1 A 68 68 PHE CA C 68 56.507 58.492 -1.985 1 1 383 . 2 1 1 A 68 68 PHE CB C 68 42.428 40.186 2.242 1 1 384 . 2 1 1 A 68 68 PHE N N 68 117.510 119.246 -1.736 1 1 385 . 2 1 1 A 69 69 GLU H H 69 9.079 9.586 -0.507 1 1 386 . 2 1 1 A 69 69 GLU C C 69 174.556 174.864 -0.308 1 1 387 . 2 1 1 A 69 69 GLU CA C 69 54.939 54.934 0.005 1 1 388 . 2 1 1 A 69 69 GLU CB C 69 33.963 31.913 2.050 1 1 390 . 2 1 1 A 69 69 GLU N N 69 120.562 124.022 -3.460 1 1 391 . 2 1 1 A 70 70 MET H H 70 9.481 9.121 0.360 1 1 392 . 2 1 1 A 70 70 MET C C 70 174.595 175.433 -0.838 1 1 393 . 2 1 1 A 70 70 MET CA C 70 53.091 54.008 -0.917 1 1 394 . 2 1 1 A 70 70 MET CB C 70 36.159 35.245 0.914 1 1 397 . 2 1 1 A 70 70 MET N N 70 124.928 127.972 -3.044 1 1 398 . 2 1 1 A 71 71 GLY H H 71 8.845 8.993 -0.148 1 1 399 . 2 1 1 A 71 71 GLY C C 71 170.811 171.563 -0.752 1 1 400 . 2 1 1 A 71 71 GLY CA C 71 44.624 43.962 0.662 1 1 401 . 2 1 1 A 71 71 GLY N N 71 108.896 113.063 -4.167 1 1 402 . 2 1 1 A 72 72 TYR H H 72 8.925 9.502 -0.577 1 1 403 . 2 1 1 A 72 72 TYR C C 72 173.278 174.105 -0.827 1 1 404 . 2 1 1 A 72 72 TYR CA C 72 55.912 56.376 -0.464 1 1 405 . 2 1 1 A 72 72 TYR CB C 72 41.611 41.633 -0.022 1 1 406 . 2 1 1 A 72 72 TYR N N 72 123.253 120.837 2.416 1 1 407 . 2 1 1 A 73 73 ASP H H 73 8.665 9.126 -0.461 1 1 408 . 2 1 1 A 73 73 ASP C C 73 173.598 175.229 -1.631 1 1 409 . 2 1 1 A 73 73 ASP CA C 73 52.857 53.326 -0.469 1 1 410 . 2 1 1 A 73 73 ASP CB C 73 42.774 42.375 0.399 1 1 411 . 2 1 1 A 73 73 ASP N N 73 126.178 124.592 1.586 1 1 412 . 2 1 1 A 74 74 TRP H H 74 9.080 8.991 0.089 1 1 413 . 2 1 1 A 74 74 TRP C C 74 174.868 173.895 0.973 1 1 414 . 2 1 1 A 74 74 TRP CB C 74 30.083 32.796 -2.713 1 1 415 . 2 1 1 A 74 74 TRP N N 74 121.824 127.758 -5.934 1 1 416 . 2 1 1 A 78 78 MET C C 78 174.548 176.165 -1.617 1 1 417 . 2 1 1 A 78 78 MET CA C 78 54.388 54.976 -0.588 1 1 418 . 2 1 1 A 78 78 MET CB C 78 32.542 33.118 -0.576 1 1 419 . 2 1 1 A 79 79 ALA H H 79 8.105 7.834 0.271 1 1 420 . 2 1 1 A 79 79 ALA C C 79 176.629 177.039 -0.410 1 1 421 . 2 1 1 A 79 79 ALA CA C 79 51.210 51.206 0.004 1 1 422 . 2 1 1 A 79 79 ALA CB C 79 19.106 18.315 0.791 1 1 423 . 2 1 1 A 79 79 ALA N N 79 125.778 124.568 1.210 1 1 424 . 2 1 1 A 80 80 TYR H H 80 8.035 8.019 0.016 1 1 425 . 2 1 1 A 80 80 TYR C C 80 175.604 175.961 -0.357 1 1 426 . 2 1 1 A 80 80 TYR CA C 80 57.021 58.663 -1.642 1 1 427 . 2 1 1 A 80 80 TYR CB C 80 38.416 40.213 -1.797 1 1 428 . 2 1 1 A 80 80 TYR N N 80 120.045 119.165 0.880 1 1 429 . 2 1 1 A 81 81 LYS H H 81 8.295 7.872 0.423 1 1 430 . 2 1 1 A 81 81 LYS C C 81 176.647 176.581 0.066 1 1 431 . 2 1 1 A 81 81 LYS CA C 81 56.285 56.676 -0.391 1 1 432 . 2 1 1 A 81 81 LYS CB C 81 31.571 33.025 -1.454 1 1 434 . 2 1 1 A 81 81 LYS N N 81 123.191 118.207 4.984 1 1 435 . 2 1 1 A 82 82 GLY H H 82 8.117 8.378 -0.261 1 1 436 . 2 1 1 A 82 82 GLY C C 82 174.010 174.002 0.008 1 1 437 . 2 1 1 A 82 82 GLY CA C 82 44.982 44.257 0.725 1 1 438 . 2 1 1 A 82 82 GLY N N 82 110.014 109.905 0.109 1 1 439 . 2 1 1 A 83 83 SER H H 83 7.938 8.506 -0.568 1 1 440 . 2 1 1 A 83 83 SER C C 83 174.634 174.449 0.185 1 1 441 . 2 1 1 A 83 83 SER CA C 83 57.685 59.282 -1.597 1 1 442 . 2 1 1 A 83 83 SER CB C 83 63.303 66.251 -2.948 1 1 443 . 2 1 1 A 83 83 SER N N 83 115.655 114.554 1.101 1 1 444 . 2 1 1 A 84 84 VAL H H 84 8.008 7.862 0.146 1 1 451 . 2 1 1 A 84 84 VAL C C 84 175.525 174.458 1.067 1 1 452 . 2 1 1 A 84 84 VAL CA C 84 61.769 60.991 0.778 1 1 453 . 2 1 1 A 84 84 VAL CB C 84 31.711 33.003 -1.292 1 1 456 . 2 1 1 A 84 84 VAL N N 84 120.054 118.063 1.991 1 1 457 . 2 1 1 A 85 85 ASP H H 85 8.140 7.785 0.355 1 1 458 . 2 1 1 A 85 85 ASP C C 85 174.740 176.171 -1.431 1 1 459 . 2 1 1 A 85 85 ASP CA C 85 53.983 53.337 0.646 1 1 460 . 2 1 1 A 85 85 ASP CB C 85 40.633 42.393 -1.760 1 1 461 . 2 1 1 A 85 85 ASP N N 85 122.510 123.957 -1.447 1 1 462 . 2 1 1 A 86 86 ASN H H 86 7.736 8.944 -1.208 1 1 463 . 2 1 1 A 86 86 ASN C C 86 175.970 176.261 -0.291 1 1 464 . 2 1 1 A 86 86 ASN CA C 86 54.349 54.774 -0.425 1 1 465 . 2 1 1 A 86 86 ASN CB C 86 40.490 40.438 0.052 1 1 467 . 2 1 1 A 86 86 ASN N N 86 124.290 120.096 4.194 1 1 468 . 2 1 1 A 87 87 GLY H H 87 8.000 7.747 0.253 1 1 469 . 2 1 1 A 87 87 GLY C C 87 173.456 172.697 0.759 1 1 470 . 2 1 1 A 87 87 GLY CA C 87 44.973 44.413 0.560 1 1 471 . 2 1 1 A 87 87 GLY N N 87 113.494 108.267 5.227 1 1 472 . 2 1 1 A 88 88 ALA H H 88 8.024 8.215 -0.191 1 1 473 . 2 1 1 A 88 88 ALA C C 88 176.833 175.220 1.613 1 1 474 . 2 1 1 A 88 88 ALA CA C 88 51.734 50.495 1.239 1 1 475 . 2 1 1 A 88 88 ALA CB C 88 19.818 21.830 -2.012 1 1 476 . 2 1 1 A 88 88 ALA N N 88 122.676 123.288 -0.612 1 1 477 . 2 1 1 A 91 91 ALA C C 91 174.781 175.915 -1.134 1 1 478 . 2 1 1 A 91 91 ALA CA C 91 50.537 51.456 -0.919 1 1 479 . 2 1 1 A 91 91 ALA CB C 91 21.324 22.701 -1.377 1 1 480 . 2 1 1 A 92 92 GLN H H 92 8.451 8.369 0.082 1 1 481 . 2 1 1 A 92 92 GLN C C 92 173.557 174.533 -0.976 1 1 482 . 2 1 1 A 92 92 GLN CA C 92 53.380 55.590 -2.210 1 1 484 . 2 1 1 A 92 92 GLN N N 92 116.847 121.223 -4.376 1 1 485 . 2 1 1 A 93 93 GLY C C 93 170.631 172.491 -1.860 1 1 486 . 2 1 1 A 93 93 GLY CA C 93 45.718 45.139 0.579 1 1 487 . 2 1 1 A 94 94 VAL H H 94 8.686 9.541 -0.855 1 1 494 . 2 1 1 A 94 94 VAL C C 94 173.698 174.317 -0.619 1 1 495 . 2 1 1 A 94 94 VAL CA C 94 58.997 59.787 -0.790 1 1 496 . 2 1 1 A 94 94 VAL CB C 94 33.311 34.277 -0.966 1 1 499 . 2 1 1 A 94 94 VAL N N 94 118.489 119.245 -0.756 1 1 500 . 2 1 1 A 95 95 GLN H H 95 9.468 9.563 -0.095 1 1 501 . 2 1 1 A 95 95 GLN C C 95 174.028 174.054 -0.026 1 1 502 . 2 1 1 A 95 95 GLN CA C 95 52.547 54.394 -1.847 1 1 503 . 2 1 1 A 95 95 GLN CB C 95 33.816 31.522 2.294 1 1 505 . 2 1 1 A 95 95 GLN N N 95 122.106 125.766 -3.660 1 1 506 . 2 1 1 A 96 96 LEU H H 96 8.484 9.093 -0.609 1 1 513 . 2 1 1 A 96 96 LEU C C 96 175.322 175.488 -0.166 1 1 514 . 2 1 1 A 96 96 LEU CA C 96 53.736 53.825 -0.089 1 1 515 . 2 1 1 A 96 96 LEU CB C 96 41.088 44.291 -3.203 1 1 519 . 2 1 1 A 96 96 LEU N N 96 123.224 125.771 -2.547 1 1 520 . 2 1 1 A 97 97 THR H H 97 9.116 8.978 0.138 1 1 521 . 2 1 1 A 97 97 THR C C 97 173.251 171.747 1.504 1 1 522 . 2 1 1 A 97 97 THR CA C 97 58.931 59.634 -0.703 1 1 523 . 2 1 1 A 97 97 THR CB C 97 72.984 72.820 0.164 1 1 525 . 2 1 1 A 97 97 THR N N 97 112.504 115.599 -3.095 1 1 526 . 2 1 1 A 98 98 ALA H H 98 8.603 8.776 -0.173 1 1 527 . 2 1 1 A 98 98 ALA C C 98 174.948 175.341 -0.393 1 1 528 . 2 1 1 A 98 98 ALA CA C 98 49.980 50.074 -0.094 1 1 529 . 2 1 1 A 98 98 ALA CB C 98 19.157 20.654 -1.497 1 1 530 . 2 1 1 A 98 98 ALA N N 98 121.608 123.716 -2.108 1 1 531 . 2 1 1 A 99 99 LYS H H 99 8.890 9.182 -0.292 1 1 532 . 2 1 1 A 99 99 LYS C C 99 174.294 175.049 -0.755 1 1 533 . 2 1 1 A 99 99 LYS CA C 99 54.019 54.652 -0.633 1 1 534 . 2 1 1 A 99 99 LYS CB C 99 33.018 35.538 -2.520 1 1 538 . 2 1 1 A 99 99 LYS N N 99 124.522 123.749 0.773 1 1 539 . 2 1 1 A 100 100 LEU H H 100 8.985 9.026 -0.041 1 1 546 . 2 1 1 A 100 100 LEU C C 100 175.265 175.035 0.230 1 1 547 . 2 1 1 A 100 100 LEU CA C 100 52.698 53.146 -0.448 1 1 548 . 2 1 1 A 100 100 LEU CB C 100 42.889 44.731 -1.842 1 1 552 . 2 1 1 A 100 100 LEU N N 100 131.876 123.208 8.668 1 1 553 . 2 1 1 A 101 101 GLY H H 101 9.137 8.928 0.209 1 1 554 . 2 1 1 A 101 101 GLY C C 101 170.798 172.203 -1.405 1 1 555 . 2 1 1 A 101 101 GLY CA C 101 44.429 44.472 -0.043 1 1 556 . 2 1 1 A 101 101 GLY N N 101 111.928 109.136 2.792 1 1 557 . 2 1 1 A 102 102 TYR H H 102 8.779 8.837 -0.058 1 1 558 . 2 1 1 A 102 102 TYR C C 102 173.402 173.541 -0.139 1 1 559 . 2 1 1 A 102 102 TYR CA C 102 54.444 56.914 -2.470 1 1 560 . 2 1 1 A 102 102 TYR CB C 102 42.239 41.995 0.244 1 1 561 . 2 1 1 A 102 102 TYR N N 102 116.664 120.268 -3.604 1 1 562 . 2 1 1 A 103 103 PRO C C 103 175.676 176.121 -0.445 1 1 563 . 2 1 1 A 103 103 PRO CA C 103 61.462 62.394 -0.932 1 1 564 . 2 1 1 A 103 103 PRO CB C 103 30.073 32.963 -2.890 1 1 565 . 2 1 1 A 104 104 ILE H H 104 8.670 8.508 0.162 1 1 569 . 2 1 1 A 104 104 ILE C C 104 176.646 176.523 0.123 1 1 570 . 2 1 1 A 104 104 ILE CA C 104 62.054 62.077 -0.023 1 1 571 . 2 1 1 A 104 104 ILE CB C 104 37.678 39.375 -1.697 1 1 574 . 2 1 1 A 104 104 ILE N N 104 125.939 118.774 7.165 1 1 575 . 2 1 1 A 105 105 THR H H 105 8.129 7.676 0.453 1 1 576 . 2 1 1 A 105 105 THR C C 105 174.344 173.736 0.608 1 1 577 . 2 1 1 A 105 105 THR CA C 105 59.176 60.655 -1.479 1 1 578 . 2 1 1 A 105 105 THR CB C 105 71.049 69.681 1.368 1 1 580 . 2 1 1 A 105 105 THR N N 105 109.853 111.765 -1.912 1 1 581 . 2 1 1 A 106 106 ASP H H 106 8.424 8.082 0.342 1 1 582 . 2 1 1 A 106 106 ASP C C 106 175.692 174.730 0.962 1 1 583 . 2 1 1 A 106 106 ASP CA C 106 56.465 55.061 1.404 1 1 584 . 2 1 1 A 106 106 ASP CB C 106 40.032 39.916 0.116 1 1 585 . 2 1 1 A 106 106 ASP N N 106 117.156 119.671 -2.515 1 1 586 . 2 1 1 A 107 107 ASP H H 107 8.124 7.932 0.192 1 1 587 . 2 1 1 A 107 107 ASP C C 107 174.174 175.270 -1.096 1 1 588 . 2 1 1 A 107 107 ASP CA C 107 52.907 55.281 -2.374 1 1 589 . 2 1 1 A 107 107 ASP CB C 107 41.661 43.658 -1.997 1 1 590 . 2 1 1 A 107 107 ASP N N 107 113.591 118.625 -5.034 1 1 591 . 2 1 1 A 108 108 LEU H H 108 7.336 7.753 -0.417 1 1 598 . 2 1 1 A 108 108 LEU C C 108 174.321 174.803 -0.482 1 1 599 . 2 1 1 A 108 108 LEU CA C 108 54.449 53.077 1.372 1 1 600 . 2 1 1 A 108 108 LEU CB C 108 44.754 42.288 2.466 1 1 604 . 2 1 1 A 108 108 LEU N N 108 123.244 117.664 5.580 1 1 605 . 2 1 1 A 109 109 ASP H H 109 8.943 8.862 0.081 1 1 606 . 2 1 1 A 109 109 ASP C C 109 176.248 175.307 0.941 1 1 607 . 2 1 1 A 109 109 ASP CA C 109 52.376 52.662 -0.286 1 1 608 . 2 1 1 A 109 109 ASP CB C 109 42.764 44.688 -1.924 1 1 609 . 2 1 1 A 109 109 ASP N N 109 124.634 124.456 0.178 1 1 610 . 2 1 1 A 110 110 ILE H H 110 8.372 8.903 -0.531 1 1 614 . 2 1 1 A 110 110 ILE C C 110 173.735 174.753 -1.018 1 1 615 . 2 1 1 A 110 110 ILE CA C 110 59.129 59.239 -0.110 1 1 616 . 2 1 1 A 110 110 ILE CB C 110 39.402 41.007 -1.605 1 1 620 . 2 1 1 A 110 110 ILE N N 110 119.135 116.735 2.400 1 1 621 . 2 1 1 A 111 111 TYR H H 111 8.695 8.582 0.113 1 1 622 . 2 1 1 A 111 111 TYR C C 111 172.838 172.413 0.425 1 1 623 . 2 1 1 A 111 111 TYR CA C 111 56.182 56.344 -0.162 1 1 624 . 2 1 1 A 111 111 TYR CB C 111 41.489 41.230 0.259 1 1 625 . 2 1 1 A 111 111 TYR N N 111 121.248 118.996 2.252 1 1 626 . 2 1 1 A 112 112 THR H H 112 9.172 8.883 0.289 1 1 627 . 2 1 1 A 112 112 THR C C 112 173.850 172.707 1.143 1 1 628 . 2 1 1 A 112 112 THR CA C 112 58.246 60.192 -1.946 1 1 629 . 2 1 1 A 112 112 THR CB C 112 71.676 71.079 0.597 1 1 631 . 2 1 1 A 112 112 THR N N 112 110.671 116.032 -5.361 1 1 632 . 2 1 1 A 113 113 ARG H H 113 8.732 9.750 -1.018 1 1 633 . 2 1 1 A 113 113 ARG C C 113 175.037 174.575 0.462 1 1 634 . 2 1 1 A 113 113 ARG CA C 113 53.995 54.700 -0.705 1 1 635 . 2 1 1 A 113 113 ARG CB C 113 32.266 33.110 -0.844 1 1 638 . 2 1 1 A 113 113 ARG N N 113 120.642 126.790 -6.148 1 1 639 . 2 1 1 A 114 114 LEU H H 114 8.449 9.057 -0.608 1 1 646 . 2 1 1 A 114 114 LEU C C 114 175.812 175.777 0.035 1 1 647 . 2 1 1 A 114 114 LEU CA C 114 53.335 53.716 -0.381 1 1 648 . 2 1 1 A 114 114 LEU CB C 114 45.182 45.483 -0.301 1 1 652 . 2 1 1 A 114 114 LEU N N 114 119.078 123.398 -4.320 1 1 653 . 2 1 1 A 115 115 GLY H H 115 8.232 8.499 -0.267 1 1 654 . 2 1 1 A 115 115 GLY C C 115 171.343 172.388 -1.045 1 1 655 . 2 1 1 A 115 115 GLY CA C 115 46.217 46.162 0.055 1 1 656 . 2 1 1 A 115 115 GLY N N 115 108.966 112.457 -3.491 1 1 657 . 2 1 1 A 116 116 GLY H H 116 8.293 8.398 -0.105 1 1 658 . 2 1 1 A 116 116 GLY C C 116 169.856 172.666 -2.810 1 1 659 . 2 1 1 A 116 116 GLY CA C 116 44.084 44.626 -0.542 1 1 660 . 2 1 1 A 116 116 GLY N N 116 109.676 110.758 -1.082 1 1 661 . 2 1 1 A 117 117 MET H H 117 9.286 9.273 0.013 1 1 662 . 2 1 1 A 117 117 MET C C 117 174.557 175.296 -0.739 1 1 663 . 2 1 1 A 117 117 MET CA C 117 53.258 53.470 -0.212 1 1 664 . 2 1 1 A 117 117 MET CB C 117 37.195 34.967 2.228 1 1 667 . 2 1 1 A 117 117 MET N N 117 120.425 117.059 3.366 1 1 668 . 2 1 1 A 118 118 VAL H H 118 9.062 9.195 -0.133 1 1 675 . 2 1 1 A 118 118 VAL C C 118 173.993 173.919 0.074 1 1 676 . 2 1 1 A 118 118 VAL CA C 118 59.883 61.151 -1.268 1 1 677 . 2 1 1 A 118 118 VAL CB C 118 31.782 34.299 -2.517 1 1 680 . 2 1 1 A 118 118 VAL N N 118 126.948 121.226 5.722 1 1 681 . 2 1 1 A 119 119 TRP H H 119 8.482 9.877 -1.395 1 1 682 . 2 1 1 A 119 119 TRP C C 119 174.608 174.642 -0.034 1 1 683 . 2 1 1 A 119 119 TRP CA C 119 53.332 55.425 -2.093 1 1 684 . 2 1 1 A 119 119 TRP CB C 119 33.569 33.399 0.170 1 1 685 . 2 1 1 A 119 119 TRP N N 119 124.631 130.584 -5.953 1 1 686 . 2 1 1 A 120 120 ARG H H 120 9.113 8.720 0.393 1 1 687 . 2 1 1 A 120 120 ARG C C 120 174.951 173.928 1.023 1 1 688 . 2 1 1 A 120 120 ARG CA C 120 54.684 54.266 0.418 1 1 689 . 2 1 1 A 120 120 ARG CB C 120 33.424 33.069 0.355 1 1 690 . 2 1 1 A 120 120 ARG N N 120 117.899 126.895 -8.996 1 1 691 . 2 1 1 A 121 121 ALA H H 121 9.299 8.562 0.737 1 1 692 . 2 1 1 A 121 121 ALA C C 121 175.954 175.100 0.854 1 1 693 . 2 1 1 A 121 121 ALA CA C 121 50.368 50.074 0.294 1 1 694 . 2 1 1 A 121 121 ALA CB C 121 21.141 23.546 -2.405 1 1 695 . 2 1 1 A 121 121 ALA N N 121 128.863 125.953 2.910 1 1 696 . 2 1 1 A 122 122 ASP H H 122 8.488 8.884 -0.396 1 1 697 . 2 1 1 A 122 122 ASP C C 122 175.635 173.491 2.144 1 1 698 . 2 1 1 A 122 122 ASP CA C 122 53.891 52.777 1.114 1 1 699 . 2 1 1 A 122 122 ASP CB C 122 42.492 44.728 -2.236 1 1 700 . 2 1 1 A 122 122 ASP N N 122 121.721 117.205 4.516 1 1 701 . 2 1 1 A 123 123 SER H H 123 8.466 8.573 -0.107 1 1 702 . 2 1 1 A 123 123 SER C C 123 174.325 173.029 1.296 1 1 703 . 2 1 1 A 123 123 SER CA C 123 57.325 56.447 0.878 1 1 704 . 2 1 1 A 123 123 SER CB C 123 63.988 64.100 -0.112 1 1 705 . 2 1 1 A 123 123 SER N N 123 117.374 117.315 0.059 1 1 706 . 2 1 1 A 124 124 LYS H H 124 8.389 8.672 -0.283 1 1 707 . 2 1 1 A 124 124 LYS C C 124 176.840 175.417 1.423 1 1 708 . 2 1 1 A 124 124 LYS CA C 124 56.036 54.877 1.159 1 1 709 . 2 1 1 A 124 124 LYS CB C 124 32.397 33.275 -0.878 1 1 711 . 2 1 1 A 124 124 LYS N N 124 122.883 128.021 -5.138 1 1 712 . 2 1 1 A 125 125 GLY H H 125 8.281 8.957 -0.676 1 1 713 . 2 1 1 A 125 125 GLY C C 125 173.592 173.304 0.288 1 1 714 . 2 1 1 A 125 125 GLY CA C 125 44.924 46.909 -1.985 1 1 715 . 2 1 1 A 125 125 GLY N N 125 109.541 111.558 -2.017 1 1 716 . 2 1 1 A 126 126 ASN H H 126 8.185 7.990 0.195 1 1 717 . 2 1 1 A 126 126 ASN C C 126 176.649 174.695 1.954 1 1 718 . 2 1 1 A 126 126 ASN CA C 126 52.763 52.237 0.526 1 1 719 . 2 1 1 A 126 126 ASN CB C 126 38.439 40.968 -2.529 1 1 720 . 2 1 1 A 126 126 ASN N N 126 119.019 122.423 -3.404 1 1 721 . 2 1 1 A 127 127 TYR C C 127 176.913 176.264 0.649 1 1 722 . 2 1 1 A 127 127 TYR CA C 127 57.757 59.625 -1.868 1 1 723 . 2 1 1 A 127 127 TYR CB C 127 37.703 39.019 -1.316 1 1 724 . 2 1 1 A 128 128 ALA H H 128 8.050 8.048 0.002 1 1 728 . 2 1 1 A 128 128 ALA C C 128 177.756 177.133 0.623 1 1 729 . 2 1 1 A 128 128 ALA CA C 128 52.321 50.586 1.735 1 1 730 . 2 1 1 A 128 128 ALA CB C 128 18.273 21.407 -3.134 1 1 731 . 2 1 1 A 128 128 ALA N N 128 124.529 121.370 3.159 1 1 732 . 2 1 1 A 129 129 SER H H 129 8.063 8.723 -0.660 1 1 733 . 2 1 1 A 129 129 SER C C 129 174.938 173.344 1.594 1 1 734 . 2 1 1 A 129 129 SER CA C 129 58.202 57.115 1.087 1 1 735 . 2 1 1 A 129 129 SER CB C 129 62.974 63.544 -0.570 1 1 736 . 2 1 1 A 129 129 SER N N 129 114.374 114.443 -0.069 1 1 737 . 2 1 1 A 130 130 THR H H 130 7.875 7.386 0.489 1 1 741 . 2 1 1 A 130 130 THR C C 130 175.198 173.991 1.207 1 1 742 . 2 1 1 A 130 130 THR CA C 130 61.520 62.951 -1.431 1 1 743 . 2 1 1 A 130 130 THR CB C 130 69.312 69.403 -0.091 1 1 745 . 2 1 1 A 130 130 THR N N 130 113.608 118.515 -4.907 1 1 746 . 2 1 1 A 131 131 GLY H H 131 8.219 8.466 -0.247 1 1 747 . 2 1 1 A 131 131 GLY C C 131 173.979 172.669 1.310 1 1 748 . 2 1 1 A 131 131 GLY CA C 131 44.991 43.760 1.231 1 1 749 . 2 1 1 A 131 131 GLY N N 131 110.848 113.436 -2.588 1 1 750 . 2 1 1 A 132 132 VAL H H 132 7.729 8.414 -0.685 1 1 757 . 2 1 1 A 132 132 VAL C C 132 175.988 175.537 0.451 1 1 758 . 2 1 1 A 132 132 VAL CA C 132 61.643 59.318 2.325 1 1 759 . 2 1 1 A 132 132 VAL CB C 132 31.941 35.946 -4.005 1 1 762 . 2 1 1 A 132 132 VAL N N 132 118.932 118.000 0.932 1 1 763 . 2 1 1 A 133 133 SER H H 133 8.224 8.803 -0.579 1 1 764 . 2 1 1 A 133 133 SER C C 133 174.320 174.432 -0.112 1 1 765 . 2 1 1 A 133 133 SER CA C 133 57.756 60.370 -2.614 1 1 766 . 2 1 1 A 133 133 SER CB C 133 63.140 64.314 -1.174 1 1 767 . 2 1 1 A 133 133 SER N N 133 119.260 116.889 2.371 1 1 768 . 2 1 1 A 134 134 ARG H H 134 8.199 7.722 0.477 1 1 769 . 2 1 1 A 134 134 ARG C C 134 175.923 174.824 1.099 1 1 770 . 2 1 1 A 134 134 ARG CA C 134 55.461 54.815 0.646 1 1 771 . 2 1 1 A 134 134 ARG CB C 134 30.195 32.449 -2.254 1 1 774 . 2 1 1 A 134 134 ARG N N 134 123.262 121.289 1.973 1 1 775 . 2 1 1 A 135 135 SER H H 135 8.256 8.840 -0.584 1 1 776 . 2 1 1 A 135 135 SER C C 135 174.360 172.681 1.679 1 1 777 . 2 1 1 A 135 135 SER CA C 135 57.730 57.216 0.514 1 1 778 . 2 1 1 A 135 135 SER CB C 135 63.275 66.504 -3.229 1 1 779 . 2 1 1 A 135 135 SER N N 135 117.155 121.916 -4.761 1 1 780 . 2 1 1 A 136 136 GLU H H 136 8.374 8.643 -0.269 1 1 781 . 2 1 1 A 136 136 GLU C C 136 176.284 174.781 1.503 1 1 782 . 2 1 1 A 136 136 GLU CA C 136 56.082 55.396 0.686 1 1 783 . 2 1 1 A 136 136 GLU CB C 136 29.820 30.091 -0.271 1 1 785 . 2 1 1 A 136 136 GLU N N 136 122.812 123.575 -0.763 1 1 786 . 2 1 1 A 137 137 HIS H H 137 8.118 8.712 -0.594 1 1 787 . 2 1 1 A 137 137 HIS C C 137 173.529 172.610 0.919 1 1 788 . 2 1 1 A 137 137 HIS CA C 137 54.793 55.111 -0.318 1 1 789 . 2 1 1 A 137 137 HIS CB C 137 30.191 33.353 -3.162 1 1 790 . 2 1 1 A 137 137 HIS N N 137 118.002 123.527 -5.525 1 1 791 . 2 1 1 A 138 138 ASP H H 138 8.572 8.789 -0.217 1 1 792 . 2 1 1 A 138 138 ASP C C 138 174.940 174.529 0.411 1 1 793 . 2 1 1 A 138 138 ASP CA C 138 53.594 53.010 0.584 1 1 794 . 2 1 1 A 138 138 ASP CB C 138 42.165 44.599 -2.434 1 1 795 . 2 1 1 A 138 138 ASP N N 138 121.536 126.333 -4.797 1 1 796 . 2 1 1 A 139 139 THR H H 139 7.857 8.615 -0.758 1 1 797 . 2 1 1 A 139 139 THR C C 139 172.822 173.067 -0.245 1 1 798 . 2 1 1 A 139 139 THR CA C 139 59.197 59.802 -0.605 1 1 799 . 2 1 1 A 139 139 THR CB C 139 71.457 71.169 0.288 1 1 801 . 2 1 1 A 139 139 THR N N 139 113.598 116.347 -2.749 1 1 802 . 2 1 1 A 140 140 GLY C C 140 169.622 172.107 -2.485 1 1 803 . 2 1 1 A 140 140 GLY CA C 140 44.287 45.098 -0.811 1 1 804 . 2 1 1 A 141 141 VAL H H 141 7.815 8.713 -0.898 1 1 811 . 2 1 1 A 141 141 VAL C C 141 176.038 173.853 2.185 1 1 812 . 2 1 1 A 141 141 VAL CA C 141 59.739 60.014 -0.275 1 1 813 . 2 1 1 A 141 141 VAL CB C 141 33.308 35.153 -1.845 1 1 816 . 2 1 1 A 141 141 VAL N N 141 116.224 123.187 -6.963 1 1 817 . 2 1 1 A 142 142 SER H H 142 9.284 8.867 0.417 1 1 818 . 2 1 1 A 142 142 SER C C 142 171.050 172.412 -1.362 1 1 819 . 2 1 1 A 142 142 SER CB C 142 67.608 66.198 1.410 1 1 820 . 2 1 1 A 142 142 SER N N 142 123.223 121.740 1.483 1 1 821 . 2 1 1 A 143 143 PRO C C 143 174.032 176.180 -2.148 1 1 822 . 2 1 1 A 143 143 PRO CA C 143 62.350 62.555 -0.205 1 1 823 . 2 1 1 A 143 143 PRO CB C 143 31.774 32.495 -0.721 1 1 825 . 2 1 1 A 144 144 VAL H H 144 7.785 8.512 -0.727 1 1 832 . 2 1 1 A 144 144 VAL C C 144 172.826 174.258 -1.432 1 1 833 . 2 1 1 A 144 144 VAL CA C 144 59.770 59.667 0.103 1 1 834 . 2 1 1 A 144 144 VAL CB C 144 34.407 35.861 -1.454 1 1 837 . 2 1 1 A 144 144 VAL N N 144 120.214 117.219 2.995 1 1 838 . 2 1 1 A 145 145 PHE H H 145 8.623 8.415 0.208 1 1 839 . 2 1 1 A 145 145 PHE C C 145 173.658 172.770 0.888 1 1 840 . 2 1 1 A 145 145 PHE CA C 145 54.942 55.873 -0.931 1 1 841 . 2 1 1 A 145 145 PHE CB C 145 42.692 42.238 0.454 1 1 842 . 2 1 1 A 145 145 PHE N N 145 123.914 119.314 4.600 1 1 843 . 2 1 1 A 146 146 ALA H H 146 8.886 8.939 -0.053 1 1 844 . 2 1 1 A 146 146 ALA C C 146 176.258 176.387 -0.129 1 1 845 . 2 1 1 A 146 146 ALA CA C 146 49.734 50.238 -0.504 1 1 846 . 2 1 1 A 146 146 ALA CB C 146 22.244 21.339 0.905 1 1 847 . 2 1 1 A 146 146 ALA N N 146 125.243 125.765 -0.522 1 1 848 . 2 1 1 A 147 147 GLY H H 147 8.470 8.739 -0.269 1 1 849 . 2 1 1 A 147 147 GLY C C 147 170.940 172.160 -1.220 1 1 850 . 2 1 1 A 147 147 GLY CA C 147 44.063 44.311 -0.248 1 1 851 . 2 1 1 A 147 147 GLY N N 147 106.669 110.442 -3.773 1 1 852 . 2 1 1 A 148 148 GLY H H 148 8.008 7.959 0.049 1 1 853 . 2 1 1 A 148 148 GLY C C 148 170.181 172.139 -1.958 1 1 854 . 2 1 1 A 148 148 GLY CA C 148 45.736 45.206 0.530 1 1 855 . 2 1 1 A 148 148 GLY N N 148 109.475 109.679 -0.204 1 1 856 . 2 1 1 A 149 149 VAL H H 149 8.426 8.231 0.195 1 1 863 . 2 1 1 A 149 149 VAL C C 149 174.157 173.527 0.630 1 1 864 . 2 1 1 A 149 149 VAL CA C 149 58.200 58.844 -0.644 1 1 865 . 2 1 1 A 149 149 VAL CB C 149 34.464 35.921 -1.457 1 1 868 . 2 1 1 A 149 149 VAL N N 149 112.651 118.151 -5.500 1 1 869 . 2 1 1 A 150 150 GLU H H 150 9.070 9.099 -0.029 1 1 870 . 2 1 1 A 150 150 GLU C C 150 173.892 174.718 -0.826 1 1 871 . 2 1 1 A 150 150 GLU CA C 150 54.617 54.870 -0.253 1 1 872 . 2 1 1 A 150 150 GLU CB C 150 32.911 33.464 -0.553 1 1 874 . 2 1 1 A 150 150 GLU N N 150 124.471 120.633 3.838 1 1 875 . 2 1 1 A 151 151 TRP H H 151 9.461 9.326 0.135 1 1 877 . 2 1 1 A 151 151 TRP C C 151 174.370 175.733 -1.363 1 1 878 . 2 1 1 A 151 151 TRP CA C 151 54.113 56.150 -2.037 1 1 879 . 2 1 1 A 151 151 TRP CB C 151 31.688 32.692 -1.004 1 1 880 . 2 1 1 A 151 151 TRP N N 151 129.611 126.485 3.126 1 1 882 . 2 1 1 A 152 152 ALA H H 152 8.771 9.448 -0.677 1 1 883 . 2 1 1 A 152 152 ALA C C 152 175.079 176.733 -1.654 1 1 884 . 2 1 1 A 152 152 ALA CA C 152 51.417 51.141 0.276 1 1 885 . 2 1 1 A 152 152 ALA CB C 152 17.209 20.329 -3.120 1 1 886 . 2 1 1 A 152 152 ALA N N 152 130.502 126.825 3.677 1 1 887 . 2 1 1 A 153 153 VAL H H 153 7.893 8.818 -0.925 1 1 894 . 2 1 1 A 153 153 VAL C C 153 176.612 175.498 1.114 1 1 895 . 2 1 1 A 153 153 VAL CA C 153 63.600 61.049 2.551 1 1 896 . 2 1 1 A 153 153 VAL CB C 153 31.280 31.703 -0.423 1 1 899 . 2 1 1 A 153 153 VAL N N 153 124.360 124.686 -0.326 1 1 900 . 2 1 1 A 154 154 THR H H 154 7.950 8.770 -0.820 1 1 904 . 2 1 1 A 154 154 THR C C 154 173.884 174.753 -0.869 1 1 905 . 2 1 1 A 154 154 THR CA C 154 58.655 62.894 -4.239 1 1 906 . 2 1 1 A 154 154 THR CB C 154 71.262 68.632 2.630 1 1 908 . 2 1 1 A 154 154 THR N N 154 109.176 119.068 -9.892 1 1 909 . 2 1 1 A 155 155 ARG H H 155 8.310 9.129 -0.819 1 1 910 . 2 1 1 A 155 155 ARG C C 155 176.753 174.750 2.003 1 1 911 . 2 1 1 A 155 155 ARG CA C 155 58.456 57.325 1.131 1 1 912 . 2 1 1 A 155 155 ARG CB C 155 29.043 29.556 -0.513 1 1 915 . 2 1 1 A 155 155 ARG N N 155 116.576 126.026 -9.450 1 1 916 . 2 1 1 A 156 156 ASP H H 156 7.783 8.552 -0.769 1 1 917 . 2 1 1 A 156 156 ASP C C 156 174.222 174.709 -0.487 1 1 918 . 2 1 1 A 156 156 ASP CA C 156 53.540 55.839 -2.299 1 1 919 . 2 1 1 A 156 156 ASP CB C 156 42.327 39.951 2.376 1 1 920 . 2 1 1 A 156 156 ASP N N 156 112.950 112.414 0.536 1 1 921 . 2 1 1 A 157 157 ILE H H 157 7.233 7.546 -0.313 1 1 925 . 2 1 1 A 157 157 ILE C C 157 174.178 174.676 -0.498 1 1 926 . 2 1 1 A 157 157 ILE CA C 157 59.350 59.929 -0.579 1 1 927 . 2 1 1 A 157 157 ILE CB C 157 38.969 41.377 -2.408 1 1 930 . 2 1 1 A 157 157 ILE N N 157 119.732 118.596 1.136 1 1 931 . 2 1 1 A 158 158 ALA H H 158 8.729 9.118 -0.389 1 1 932 . 2 1 1 A 158 158 ALA C C 158 176.567 175.838 0.729 1 1 933 . 2 1 1 A 158 158 ALA CA C 158 49.418 50.167 -0.749 1 1 934 . 2 1 1 A 158 158 ALA CB C 158 21.430 23.921 -2.491 1 1 935 . 2 1 1 A 158 158 ALA N N 158 128.564 128.223 0.341 1 1 936 . 2 1 1 A 159 159 THR H H 159 8.972 8.879 0.093 1 1 940 . 2 1 1 A 159 159 THR C C 159 172.213 173.868 -1.655 1 1 941 . 2 1 1 A 159 159 THR CA C 159 59.504 60.328 -0.824 1 1 942 . 2 1 1 A 159 159 THR CB C 159 70.728 70.563 0.165 1 1 944 . 2 1 1 A 159 159 THR N N 159 114.901 110.728 4.173 1 1 945 . 2 1 1 A 160 160 ARG H H 160 8.924 9.590 -0.666 1 1 946 . 2 1 1 A 160 160 ARG C C 160 174.097 174.197 -0.100 1 1 947 . 2 1 1 A 160 160 ARG CA C 160 53.066 54.863 -1.797 1 1 948 . 2 1 1 A 160 160 ARG CB C 160 32.922 32.420 0.502 1 1 951 . 2 1 1 A 160 160 ARG N N 160 121.507 121.601 -0.094 1 1 952 . 2 1 1 A 161 161 LEU H H 161 8.611 9.288 -0.677 1 1 959 . 2 1 1 A 161 161 LEU C C 161 174.389 175.143 -0.754 1 1 960 . 2 1 1 A 161 161 LEU CA C 161 53.355 53.557 -0.202 1 1 961 . 2 1 1 A 161 161 LEU CB C 161 44.360 45.616 -1.256 1 1 964 . 2 1 1 A 161 161 LEU N N 161 124.711 127.263 -2.552 1 1 965 . 2 1 1 A 162 162 GLU H H 162 8.746 8.817 -0.071 1 1 966 . 2 1 1 A 162 162 GLU C C 162 173.376 175.375 -1.999 1 1 967 . 2 1 1 A 162 162 GLU CA C 162 53.904 54.877 -0.973 1 1 968 . 2 1 1 A 162 162 GLU CB C 162 33.773 32.706 1.067 1 1 970 . 2 1 1 A 162 162 GLU N N 162 122.300 125.277 -2.977 1 1 971 . 2 1 1 A 163 163 TYR H H 163 8.872 8.627 0.245 1 1 972 . 2 1 1 A 163 163 TYR C C 163 173.425 173.543 -0.118 1 1 973 . 2 1 1 A 163 163 TYR CA C 163 56.192 55.743 0.449 1 1 974 . 2 1 1 A 163 163 TYR CB C 163 40.870 42.021 -1.151 1 1 975 . 2 1 1 A 163 163 TYR N N 163 124.618 117.747 6.871 1 1 976 . 2 1 1 A 171 171 ASP C C 171 175.753 175.222 0.531 1 1 977 . 2 1 1 A 171 171 ASP CA C 171 53.517 53.836 -0.319 1 1 978 . 2 1 1 A 171 171 ASP CB C 171 41.353 42.503 -1.150 1 1 979 . 2 1 1 A 172 172 ALA H H 172 8.336 8.722 -0.386 1 1 983 . 2 1 1 A 172 172 ALA C C 172 178.110 176.383 1.727 1 1 984 . 2 1 1 A 172 172 ALA CA C 172 52.190 50.879 1.311 1 1 985 . 2 1 1 A 172 172 ALA CB C 172 18.305 21.900 -3.595 1 1 986 . 2 1 1 A 172 172 ALA N N 172 125.294 126.174 -0.880 1 1 987 . 2 1 1 A 173 173 GLY H H 173 8.300 8.361 -0.061 1 1 988 . 2 1 1 A 173 173 GLY C C 173 174.437 175.233 -0.796 1 1 989 . 2 1 1 A 173 173 GLY CA C 173 45.083 46.187 -1.104 1 1 990 . 2 1 1 A 173 173 GLY N N 173 107.268 111.797 -4.529 1 1 991 . 2 1 1 A 174 174 THR H H 174 7.754 7.630 0.124 1 1 992 . 2 1 1 A 174 174 THR C C 174 174.738 174.081 0.657 1 1 993 . 2 1 1 A 174 174 THR CA C 174 61.310 62.365 -1.055 1 1 994 . 2 1 1 A 174 174 THR CB C 174 69.310 70.023 -0.713 1 1 996 . 2 1 1 A 174 174 THR N N 174 113.472 112.103 1.369 1 1 997 . 2 1 1 A 175 175 VAL H H 175 7.993 7.509 0.484 1 1 1004 . 2 1 1 A 175 175 VAL C C 175 176.535 174.558 1.977 1 1 1005 . 2 1 1 A 175 175 VAL CA C 175 62.126 59.824 2.302 1 1 1006 . 2 1 1 A 175 175 VAL CB C 175 31.282 35.023 -3.741 1 1 1009 . 2 1 1 A 175 175 VAL N N 175 121.643 117.467 4.176 1 1 1010 . 2 1 1 A 176 176 GLY H H 176 8.056 8.594 -0.538 1 1 1011 . 2 1 1 A 176 176 GLY C C 176 173.930 172.715 1.215 1 1 1012 . 2 1 1 A 176 176 GLY CA C 176 44.983 43.740 1.243 1 1 1013 . 2 1 1 A 176 176 GLY N N 176 110.460 109.315 1.145 1 1 1014 . 2 1 1 A 177 177 THR H H 177 7.520 8.664 -1.144 1 1 1015 . 2 1 1 A 177 177 THR C C 177 173.574 172.669 0.905 1 1 1016 . 2 1 1 A 177 177 THR CA C 177 60.609 61.040 -0.431 1 1 1017 . 2 1 1 A 177 177 THR CB C 177 69.506 73.018 -3.512 1 1 1019 . 2 1 1 A 177 177 THR N N 177 113.390 115.682 -2.292 1 1 1020 . 2 1 1 A 178 178 ARG H H 178 8.261 8.789 -0.528 1 1 1021 . 2 1 1 A 178 178 ARG C C 178 173.932 174.454 -0.522 1 1 1022 . 2 1 1 A 178 178 ARG CA C 178 53.683 52.518 1.165 1 1 1023 . 2 1 1 A 178 178 ARG CB C 178 29.224 31.174 -1.950 1 1 1026 . 2 1 1 A 178 178 ARG N N 178 123.906 125.196 -1.290 1 1 1027 . 2 1 1 A 183 183 MET C C 183 174.053 174.089 -0.036 1 1 1028 . 2 1 1 A 183 183 MET CA C 183 53.700 54.391 -0.691 1 1 1029 . 2 1 1 A 183 183 MET CB C 183 35.908 35.827 0.081 1 1 1032 . 2 1 1 A 184 184 LEU H H 184 8.319 8.645 -0.326 1 1 1033 . 2 1 1 A 184 184 LEU C C 184 175.235 175.267 -0.032 1 1 1034 . 2 1 1 A 184 184 LEU CA C 184 53.120 53.805 -0.685 1 1 1035 . 2 1 1 A 184 184 LEU CB C 184 42.857 44.047 -1.190 1 1 1038 . 2 1 1 A 184 184 LEU N N 184 131.293 120.601 10.692 1 1 1039 . 2 1 1 A 185 185 SER H H 185 9.603 8.637 0.966 1 1 1040 . 2 1 1 A 185 185 SER C C 185 171.293 173.011 -1.718 1 1 1041 . 2 1 1 A 185 185 SER CA C 185 56.504 57.404 -0.900 1 1 1042 . 2 1 1 A 185 185 SER CB C 185 66.585 67.076 -0.491 1 1 1043 . 2 1 1 A 185 185 SER N N 185 119.338 115.667 3.671 1 1 1044 . 2 1 1 A 186 186 LEU H H 186 8.583 8.561 0.022 1 1 1051 . 2 1 1 A 186 186 LEU C C 186 175.328 176.725 -1.397 1 1 1052 . 2 1 1 A 186 186 LEU CA C 186 52.729 53.204 -0.475 1 1 1053 . 2 1 1 A 186 186 LEU CB C 186 44.996 45.022 -0.026 1 1 1056 . 2 1 1 A 186 186 LEU N N 186 122.719 124.181 -1.462 1 1 1057 . 2 1 1 A 187 187 GLY H H 187 9.287 8.338 0.949 1 1 1058 . 2 1 1 A 187 187 GLY C C 187 172.315 172.965 -0.650 1 1 1059 . 2 1 1 A 187 187 GLY CA C 187 43.502 45.411 -1.909 1 1 1060 . 2 1 1 A 187 187 GLY N N 187 110.265 110.213 0.052 1 1 1061 . 2 1 1 A 188 188 VAL H H 188 8.825 8.589 0.236 1 1 1068 . 2 1 1 A 188 188 VAL C C 188 173.125 174.842 -1.717 1 1 1069 . 2 1 1 A 188 188 VAL CA C 188 59.739 59.459 0.280 1 1 1070 . 2 1 1 A 188 188 VAL CB C 188 34.532 34.738 -0.206 1 1 1073 . 2 1 1 A 188 188 VAL N N 188 119.161 116.390 2.771 1 1 1074 . 2 1 1 A 189 189 SER H H 189 9.051 8.985 0.066 1 1 1075 . 2 1 1 A 189 189 SER C C 189 171.698 172.856 -1.158 1 1 1076 . 2 1 1 A 189 189 SER CA C 189 55.997 56.880 -0.883 1 1 1077 . 2 1 1 A 189 189 SER CB C 189 66.094 67.043 -0.949 1 1 1078 . 2 1 1 A 189 189 SER N N 189 117.810 118.505 -0.695 1 1 1079 . 2 1 1 A 190 190 TYR H H 190 9.145 8.892 0.253 1 1 1080 . 2 1 1 A 190 190 TYR C C 190 174.063 172.474 1.589 1 1 1081 . 2 1 1 A 190 190 TYR CA C 190 55.375 56.007 -0.632 1 1 1082 . 2 1 1 A 190 190 TYR CB C 190 41.183 41.362 -0.179 1 1 1083 . 2 1 1 A 190 190 TYR N N 190 123.690 117.811 5.879 1 1 1084 . 2 1 1 A 191 191 ARG H H 191 8.211 8.939 -0.728 1 1 1085 . 2 1 1 A 191 191 ARG C C 191 174.826 176.376 -1.550 1 1 1086 . 2 1 1 A 191 191 ARG CA C 191 54.464 54.686 -0.222 1 1 1087 . 2 1 1 A 191 191 ARG CB C 191 30.507 31.775 -1.268 1 1 1090 . 2 1 1 A 191 191 ARG N N 191 125.366 121.094 4.272 1 1 1091 . 2 1 1 A 192 192 PHE H H 192 8.496 9.206 -0.710 1 1 1092 . 2 1 1 A 192 192 PHE C C 192 176.384 174.743 1.641 1 1 1093 . 2 1 1 A 192 192 PHE CA C 192 57.179 58.320 -1.141 1 1 1094 . 2 1 1 A 192 192 PHE CB C 192 39.430 39.115 0.315 1 1 1095 . 2 1 1 A 192 192 PHE N N 192 121.586 126.183 -4.597 1 1 1096 . 2 1 1 A 193 193 GLY H H 193 8.643 8.334 0.309 1 1 1097 . 2 1 1 A 193 193 GLY C C 193 174.466 172.111 2.355 1 1 1098 . 2 1 1 A 193 193 GLY CA C 193 45.126 44.723 0.403 1 1 1099 . 2 1 1 A 193 193 GLY N N 193 109.499 112.872 -3.373 1 1 1100 . 2 1 1 A 194 194 GLN H H 194 8.512 8.364 0.148 1 1 1101 . 2 1 1 A 194 194 GLN C C 194 176.201 174.099 2.102 1 1 1102 . 2 1 1 A 194 194 GLN CA C 194 55.433 54.527 0.906 1 1 1103 . 2 1 1 A 194 194 GLN CB C 194 28.729 29.270 -0.541 1 1 1105 . 2 1 1 A 194 194 GLN N N 194 119.448 119.572 -0.124 1 1 1106 . 2 1 1 A 195 195 GLU H H 195 8.530 8.905 -0.375 1 1 1107 . 2 1 1 A 195 195 GLU C C 195 176.151 174.897 1.254 1 1 1108 . 2 1 1 A 195 195 GLU CA C 195 56.256 55.490 0.766 1 1 1109 . 2 1 1 A 195 195 GLU CB C 195 29.486 31.639 -2.153 1 1 1111 . 2 1 1 A 195 195 GLU N N 195 121.959 126.722 -4.763 1 1 1112 . 2 1 1 A 196 196 ASP H H 196 8.253 8.870 -0.617 1 1 1113 . 2 1 1 A 196 196 ASP C C 196 175.667 174.021 1.646 1 1 1114 . 2 1 1 A 196 196 ASP CA C 196 53.981 52.673 1.308 1 1 1115 . 2 1 1 A 196 196 ASP CB C 196 40.700 45.194 -4.494 1 1 1116 . 2 1 1 A 196 196 ASP N N 196 121.819 121.581 0.238 1 1 1117 . 2 1 1 A 197 197 ALA H H 197 7.999 8.570 -0.571 1 1 1121 . 2 1 1 A 197 197 ALA C C 197 176.847 176.602 0.245 1 1 1122 . 2 1 1 A 197 197 ALA CA C 197 51.612 51.073 0.539 1 1 1123 . 2 1 1 A 197 197 ALA CB C 197 18.192 19.570 -1.378 1 1 1124 . 2 1 1 A 197 197 ALA N N 197 124.262 123.751 0.511 1 1 1125 . 2 1 1 A 198 198 ALA H H 198 8.042 7.646 0.396 1 1 1126 . 2 1 1 A 198 198 ALA C C 198 176.865 175.287 1.578 1 1 1127 . 2 1 1 A 198 198 ALA CA C 198 49.999 49.998 0.001 1 1 1128 . 2 1 1 A 198 198 ALA CB C 198 17.327 18.855 -1.528 1 1 1129 . 2 1 1 A 198 198 ALA N N 198 124.724 121.504 3.220 1 1 1130 . 2 1 1 A 199 199 PRO C C 199 176.727 176.739 -0.012 1 1 1131 . 2 1 1 A 199 199 PRO CA C 199 62.399 62.621 -0.222 1 1 1132 . 2 1 1 A 199 199 PRO CB C 199 30.949 29.333 1.616 1 1 1135 . 2 1 1 A 200 200 VAL H H 200 8.026 8.454 -0.428 1 1 1142 . 2 1 1 A 200 200 VAL C C 200 176.034 174.909 1.125 1 1 1143 . 2 1 1 A 200 200 VAL CA C 200 61.944 62.799 -0.855 1 1 1144 . 2 1 1 A 200 200 VAL CB C 200 31.734 34.288 -2.554 1 1 1147 . 2 1 1 A 200 200 VAL N N 200 120.635 121.300 -0.665 1 1 1148 . 2 1 1 A 201 201 VAL H H 201 7.966 7.464 0.502 1 1 1155 . 2 1 1 A 201 201 VAL C C 201 175.128 174.223 0.905 1 1 1156 . 2 1 1 A 201 201 VAL CA C 201 61.249 60.662 0.587 1 1 1157 . 2 1 1 A 201 201 VAL CB C 201 31.917 35.017 -3.100 1 1 1160 . 2 1 1 A 201 201 VAL N N 201 124.053 120.025 4.028 1 1 1161 . 2 1 1 A 202 202 ALA H H 202 8.159 8.832 -0.673 1 1 1162 . 2 1 1 A 202 202 ALA C C 202 175.153 175.955 -0.802 1 1 1163 . 2 1 1 A 202 202 ALA CA C 202 49.742 48.732 1.010 1 1 1164 . 2 1 1 A 202 202 ALA CB C 202 17.532 20.585 -3.053 1 1 1165 . 2 1 1 A 202 202 ALA N N 202 129.251 128.510 0.741 1 1 1166 . 2 1 1 A 203 203 PRO C C 203 176.273 175.959 0.314 1 1 1167 . 2 1 1 A 203 203 PRO CA C 203 62.324 62.550 -0.226 1 1 1168 . 2 1 1 A 203 203 PRO CB C 203 31.042 31.552 -0.510 1 1 1170 . 2 1 1 A 204 204 ALA H H 204 8.137 8.471 -0.334 1 1 1171 . 2 1 1 A 204 204 ALA C C 204 175.697 175.292 0.405 1 1 1172 . 2 1 1 A 204 204 ALA CA C 204 49.865 49.298 0.567 1 1 1173 . 2 1 1 A 204 204 ALA CB C 204 17.364 20.181 -2.817 1 1 1174 . 2 1 1 A 204 204 ALA N N 204 125.510 127.414 -1.904 1 1 1175 . 2 1 1 A 205 205 PRO C C 205 175.430 177.720 -2.290 1 1 1176 . 2 1 1 A 205 205 PRO CA C 205 62.511 63.111 -0.600 1 1 1177 . 2 1 1 A 205 205 PRO CB C 205 31.056 31.920 -0.864 1 1 1179 . 2 1 1 A 206 206 ALA H H 206 7.847 8.555 -0.708 1 1 1180 . 2 1 1 A 206 206 ALA C C 206 175.565 178.377 -2.812 1 1 1181 . 2 1 1 A 206 206 ALA CA C 206 49.487 55.734 -6.247 1 1 1182 . 2 1 1 A 206 206 ALA CB C 206 18.843 18.500 0.343 1 1 1183 . 2 1 1 A 206 206 ALA N N 206 123.663 126.803 -3.140 1 1 1184 . 2 1 1 A 207 207 PRO C C 207 174.397 177.941 -3.544 1 1 1185 . 2 1 1 A 207 207 PRO CA C 207 61.454 63.017 -1.563 1 1 1186 . 2 1 1 A 207 207 PRO CB C 207 31.929 31.733 0.196 1 1 1187 . 2 1 1 A 208 208 ALA H H 208 7.898 8.509 -0.611 1 1 1188 . 2 1 1 A 208 208 ALA C C 208 175.411 177.941 -2.530 1 1 1189 . 2 1 1 A 208 208 ALA CA C 208 49.472 56.127 -6.655 1 1 1190 . 2 1 1 A 208 208 ALA CB C 208 19.082 18.590 0.492 1 1 1191 . 2 1 1 A 208 208 ALA N N 208 127.450 127.198 0.252 1 1 1192 . 2 1 1 A 209 209 PRO C C 209 176.932 176.727 0.205 1 1 1193 . 2 1 1 A 209 209 PRO CA C 209 62.736 62.652 0.084 1 1 1194 . 2 1 1 A 209 209 PRO CB C 209 31.012 33.044 -2.032 1 1 1 . 3 1 1 A 2 2 ARG C C 2 175.857 175.625 0.232 1 1 2 . 3 1 1 A 2 2 ARG CA C 2 55.872 56.897 -1.025 1 1 3 . 3 1 1 A 2 2 ARG CB C 2 29.983 33.418 -3.435 1 1 5 . 3 1 1 A 3 3 ILE H H 3 8.238 7.956 0.282 1 1 9 . 3 1 1 A 3 3 ILE C C 3 175.763 175.364 0.399 1 1 10 . 3 1 1 A 3 3 ILE CA C 3 60.779 61.932 -1.153 1 1 11 . 3 1 1 A 3 3 ILE CB C 3 37.664 38.652 -0.988 1 1 15 . 3 1 1 A 3 3 ILE N N 3 122.580 120.177 2.403 1 1 16 . 3 1 1 A 4 4 MET H H 4 8.261 8.846 -0.585 1 1 17 . 3 1 1 A 4 4 MET C C 4 175.660 174.146 1.514 1 1 18 . 3 1 1 A 4 4 MET CA C 4 54.893 54.373 0.520 1 1 19 . 3 1 1 A 4 4 MET CB C 4 32.060 33.227 -1.167 1 1 22 . 3 1 1 A 4 4 MET N N 4 123.988 127.073 -3.085 1 1 23 . 3 1 1 A 5 5 LYS H H 5 8.041 7.632 0.409 1 1 24 . 3 1 1 A 5 5 LYS C C 5 175.850 175.262 0.588 1 1 25 . 3 1 1 A 5 5 LYS CA C 5 56.081 54.928 1.153 1 1 26 . 3 1 1 A 5 5 LYS CB C 5 32.220 35.070 -2.850 1 1 29 . 3 1 1 A 5 5 LYS N N 5 122.015 117.637 4.378 1 1 30 . 3 1 1 A 6 6 ALA H H 6 8.042 8.699 -0.657 1 1 34 . 3 1 1 A 6 6 ALA C C 6 177.160 176.952 0.208 1 1 35 . 3 1 1 A 6 6 ALA CA C 6 52.109 51.999 0.110 1 1 36 . 3 1 1 A 6 6 ALA CB C 6 18.637 18.844 -0.207 1 1 37 . 3 1 1 A 6 6 ALA N N 6 123.943 127.733 -3.790 1 1 38 . 3 1 1 A 7 7 ILE H H 7 7.916 8.106 -0.190 1 1 42 . 3 1 1 A 7 7 ILE C C 7 175.611 174.940 0.671 1 1 43 . 3 1 1 A 7 7 ILE CA C 7 61.181 59.208 1.973 1 1 44 . 3 1 1 A 7 7 ILE CB C 7 37.910 39.789 -1.879 1 1 48 . 3 1 1 A 7 7 ILE N N 7 118.380 119.686 -1.306 1 1 49 . 3 1 1 A 8 8 PHE H H 8 8.167 8.672 -0.505 1 1 50 . 3 1 1 A 8 8 PHE C C 8 175.363 174.995 0.368 1 1 51 . 3 1 1 A 8 8 PHE CA C 8 57.286 56.495 0.791 1 1 52 . 3 1 1 A 8 8 PHE CB C 8 39.008 42.598 -3.590 1 1 53 . 3 1 1 A 8 8 PHE N N 8 121.971 120.389 1.582 1 1 54 . 3 1 1 A 9 9 VAL H H 9 7.872 9.073 -1.201 1 1 61 . 3 1 1 A 9 9 VAL C C 9 175.405 175.620 -0.215 1 1 62 . 3 1 1 A 9 9 VAL CA C 9 61.662 63.590 -1.928 1 1 63 . 3 1 1 A 9 9 VAL CB C 9 32.026 33.529 -1.503 1 1 66 . 3 1 1 A 9 9 VAL N N 9 120.864 124.058 -3.194 1 1 67 . 3 1 1 A 10 10 LEU H H 10 8.077 7.830 0.247 1 1 74 . 3 1 1 A 10 10 LEU C C 10 176.652 176.466 0.186 1 1 75 . 3 1 1 A 10 10 LEU CA C 10 54.856 53.875 0.981 1 1 76 . 3 1 1 A 10 10 LEU CB C 10 41.401 42.915 -1.514 1 1 80 . 3 1 1 A 10 10 LEU N N 10 124.826 120.147 4.679 1 1 81 . 3 1 1 A 11 11 ASN H H 11 8.177 8.829 -0.652 1 1 82 . 3 1 1 A 11 11 ASN C C 11 174.394 176.649 -2.255 1 1 83 . 3 1 1 A 11 11 ASN CA C 11 52.704 55.605 -2.901 1 1 84 . 3 1 1 A 11 11 ASN CB C 11 38.468 39.139 -0.671 1 1 85 . 3 1 1 A 11 11 ASN N N 11 119.029 121.942 -2.913 1 1 86 . 3 1 1 A 12 12 ALA H H 12 7.991 7.758 0.233 1 1 90 . 3 1 1 A 12 12 ALA C C 12 176.649 176.079 0.570 1 1 91 . 3 1 1 A 12 12 ALA CA C 12 51.950 51.297 0.653 1 1 92 . 3 1 1 A 12 12 ALA CB C 12 18.659 19.868 -1.209 1 1 93 . 3 1 1 A 12 12 ALA N N 12 123.695 117.850 5.845 1 1 94 . 3 1 1 A 13 13 ALA H H 13 8.083 7.441 0.642 1 1 95 . 3 1 1 A 13 13 ALA C C 13 175.395 176.667 -1.272 1 1 96 . 3 1 1 A 13 13 ALA CA C 13 49.797 48.690 1.107 1 1 97 . 3 1 1 A 13 13 ALA CB C 13 17.486 20.432 -2.946 1 1 98 . 3 1 1 A 13 13 ALA N N 13 124.281 121.842 2.439 1 1 99 . 3 1 1 A 14 14 PRO C C 14 176.641 176.691 -0.050 1 1 100 . 3 1 1 A 14 14 PRO CA C 14 62.675 64.781 -2.106 1 1 101 . 3 1 1 A 14 14 PRO CB C 14 31.000 32.077 -1.077 1 1 103 . 3 1 1 A 15 15 LYS H H 15 8.283 7.779 0.504 1 1 104 . 3 1 1 A 15 15 LYS C C 15 175.683 175.182 0.501 1 1 105 . 3 1 1 A 15 15 LYS CA C 15 55.429 55.019 0.410 1 1 106 . 3 1 1 A 15 15 LYS CB C 15 32.246 35.198 -2.952 1 1 109 . 3 1 1 A 15 15 LYS N N 15 119.069 118.009 1.060 1 1 110 . 3 1 1 A 16 16 ASP H H 16 7.880 8.745 -0.865 1 1 111 . 3 1 1 A 16 16 ASP C C 16 175.419 175.059 0.360 1 1 112 . 3 1 1 A 16 16 ASP CA C 16 54.413 53.827 0.586 1 1 113 . 3 1 1 A 16 16 ASP CB C 16 40.224 39.312 0.912 1 1 114 . 3 1 1 A 16 16 ASP N N 16 119.625 125.231 -5.606 1 1 115 . 3 1 1 A 17 17 ASN H H 17 7.973 8.766 -0.793 1 1 116 . 3 1 1 A 17 17 ASN C C 17 174.231 174.986 -0.755 1 1 117 . 3 1 1 A 17 17 ASN CA C 17 53.948 53.131 0.817 1 1 118 . 3 1 1 A 17 17 ASN CB C 17 37.009 39.928 -2.919 1 1 119 . 3 1 1 A 17 17 ASN N N 17 118.063 123.573 -5.510 1 1 120 . 3 1 1 A 18 18 THR H H 18 7.318 8.778 -1.460 1 1 121 . 3 1 1 A 18 18 THR C C 18 172.323 172.804 -0.481 1 1 122 . 3 1 1 A 18 18 THR CA C 18 60.153 60.575 -0.422 1 1 123 . 3 1 1 A 18 18 THR CB C 18 71.534 72.204 -0.670 1 1 125 . 3 1 1 A 18 18 THR N N 18 109.092 114.610 -5.518 1 1 126 . 3 1 1 A 19 19 TRP H H 19 8.541 8.766 -0.225 1 1 127 . 3 1 1 A 19 19 TRP C C 19 175.969 175.225 0.744 1 1 128 . 3 1 1 A 19 19 TRP CA C 19 55.700 56.198 -0.498 1 1 129 . 3 1 1 A 19 19 TRP CB C 19 31.471 33.955 -2.484 1 1 130 . 3 1 1 A 19 19 TRP N N 19 121.992 119.960 2.032 1 1 131 . 3 1 1 A 20 20 TYR H H 20 8.691 8.916 -0.225 1 1 132 . 3 1 1 A 20 20 TYR C C 20 173.684 174.689 -1.005 1 1 133 . 3 1 1 A 20 20 TYR CA C 20 55.805 56.170 -0.365 1 1 134 . 3 1 1 A 20 20 TYR CB C 20 40.513 42.816 -2.303 1 1 135 . 3 1 1 A 20 20 TYR N N 20 116.519 120.062 -3.543 1 1 136 . 3 1 1 A 21 21 ALA H H 21 8.876 8.352 0.524 1 1 137 . 3 1 1 A 21 21 ALA C C 21 175.395 175.866 -0.471 1 1 138 . 3 1 1 A 21 21 ALA CA C 21 50.970 51.075 -0.105 1 1 139 . 3 1 1 A 21 21 ALA CB C 21 22.142 23.362 -1.220 1 1 140 . 3 1 1 A 21 21 ALA N N 21 119.359 123.311 -3.952 1 1 141 . 3 1 1 A 22 22 GLY H H 22 8.613 8.656 -0.043 1 1 142 . 3 1 1 A 22 22 GLY C C 22 171.458 172.167 -0.709 1 1 143 . 3 1 1 A 22 22 GLY CA C 22 45.608 46.139 -0.531 1 1 144 . 3 1 1 A 22 22 GLY N N 22 106.678 106.280 0.398 1 1 145 . 3 1 1 A 23 23 GLY H H 23 7.911 8.483 -0.572 1 1 146 . 3 1 1 A 23 23 GLY C C 23 170.563 172.164 -1.601 1 1 147 . 3 1 1 A 23 23 GLY CA C 23 44.026 44.938 -0.912 1 1 148 . 3 1 1 A 23 23 GLY N N 23 103.399 108.828 -5.429 1 1 149 . 3 1 1 A 24 24 LYS H H 24 9.001 9.814 -0.813 1 1 150 . 3 1 1 A 24 24 LYS C C 24 172.965 174.227 -1.262 1 1 151 . 3 1 1 A 24 24 LYS CA C 24 54.062 54.055 0.007 1 1 152 . 3 1 1 A 24 24 LYS CB C 24 36.774 36.465 0.309 1 1 156 . 3 1 1 A 24 24 LYS N N 24 116.402 118.856 -2.454 1 1 157 . 3 1 1 A 25 25 LEU H H 25 8.587 9.033 -0.446 1 1 164 . 3 1 1 A 25 25 LEU C C 25 175.205 174.977 0.228 1 1 165 . 3 1 1 A 25 25 LEU CA C 25 53.446 53.395 0.051 1 1 166 . 3 1 1 A 25 25 LEU CB C 25 46.287 46.668 -0.381 1 1 170 . 3 1 1 A 25 25 LEU N N 25 119.932 121.645 -1.713 1 1 171 . 3 1 1 A 26 26 GLY H H 26 8.637 8.505 0.132 1 1 172 . 3 1 1 A 26 26 GLY C C 26 170.804 171.944 -1.140 1 1 173 . 3 1 1 A 26 26 GLY CA C 26 45.669 44.973 0.696 1 1 174 . 3 1 1 A 26 26 GLY N N 26 108.136 111.685 -3.549 1 1 175 . 3 1 1 A 27 27 TRP H H 27 8.642 8.679 -0.037 1 1 177 . 3 1 1 A 27 27 TRP C C 27 174.820 176.279 -1.459 1 1 178 . 3 1 1 A 27 27 TRP CB C 27 30.883 30.048 0.835 1 1 179 . 3 1 1 A 27 27 TRP N N 27 120.887 121.240 -0.353 1 1 181 . 3 1 1 A 32 32 ASP C C 32 176.315 177.697 -1.382 1 1 182 . 3 1 1 A 32 32 ASP CA C 32 53.737 54.858 -1.121 1 1 183 . 3 1 1 A 32 32 ASP CB C 32 41.230 42.159 -0.929 1 1 184 . 3 1 1 A 33 33 THR H H 33 8.190 7.903 0.287 1 1 188 . 3 1 1 A 33 33 THR C C 33 175.291 175.427 -0.136 1 1 189 . 3 1 1 A 33 33 THR CA C 33 61.909 65.948 -4.039 1 1 190 . 3 1 1 A 33 33 THR CB C 33 68.961 69.335 -0.374 1 1 192 . 3 1 1 A 33 33 THR N N 33 114.235 114.800 -0.565 1 1 193 . 3 1 1 A 34 34 GLY H H 34 8.341 7.722 0.619 1 1 194 . 3 1 1 A 34 34 GLY C C 34 173.766 174.583 -0.817 1 1 195 . 3 1 1 A 34 34 GLY CA C 34 44.941 45.326 -0.385 1 1 196 . 3 1 1 A 34 34 GLY N N 34 110.678 107.934 2.744 1 1 197 . 3 1 1 A 35 35 PHE H H 35 7.945 8.671 -0.726 1 1 198 . 3 1 1 A 35 35 PHE C C 35 175.411 174.567 0.844 1 1 199 . 3 1 1 A 35 35 PHE CA C 35 57.921 58.714 -0.793 1 1 200 . 3 1 1 A 35 35 PHE CB C 35 38.806 40.308 -1.502 1 1 201 . 3 1 1 A 35 35 PHE N N 35 120.533 122.093 -1.560 1 1 202 . 3 1 1 A 36 36 TYR H H 36 7.967 7.982 -0.015 1 1 203 . 3 1 1 A 36 36 TYR C C 36 176.104 173.913 2.191 1 1 204 . 3 1 1 A 36 36 TYR CA C 36 57.568 56.092 1.476 1 1 205 . 3 1 1 A 36 36 TYR CB C 36 37.727 41.565 -3.838 1 1 206 . 3 1 1 A 36 36 TYR N N 36 120.254 114.362 5.892 1 1 207 . 3 1 1 A 37 37 GLY H H 37 7.666 8.694 -1.028 1 1 208 . 3 1 1 A 37 37 GLY C C 37 173.794 174.758 -0.964 1 1 209 . 3 1 1 A 37 37 GLY CA C 37 45.007 45.329 -0.322 1 1 210 . 3 1 1 A 37 37 GLY N N 37 108.995 106.553 2.442 1 1 211 . 3 1 1 A 38 38 ASN H H 38 8.109 9.099 -0.990 1 1 212 . 3 1 1 A 38 38 ASN C C 38 175.612 176.526 -0.914 1 1 213 . 3 1 1 A 38 38 ASN CA C 38 52.954 56.157 -3.203 1 1 214 . 3 1 1 A 38 38 ASN CB C 38 38.425 39.546 -1.121 1 1 215 . 3 1 1 A 38 38 ASN N N 38 118.603 122.535 -3.932 1 1 216 . 3 1 1 A 39 39 GLY H H 39 8.202 7.747 0.455 1 1 217 . 3 1 1 A 39 39 GLY C C 39 173.958 173.741 0.217 1 1 218 . 3 1 1 A 39 39 GLY CA C 39 45.012 46.202 -1.190 1 1 219 . 3 1 1 A 39 39 GLY N N 39 108.897 104.558 4.339 1 1 220 . 3 1 1 A 40 40 PHE H H 40 7.960 8.097 -0.137 1 1 221 . 3 1 1 A 40 40 PHE C C 40 175.653 174.558 1.095 1 1 222 . 3 1 1 A 40 40 PHE CA C 40 57.556 57.902 -0.346 1 1 223 . 3 1 1 A 40 40 PHE CB C 40 38.513 40.281 -1.768 1 1 224 . 3 1 1 A 40 40 PHE N N 40 119.829 120.516 -0.687 1 1 225 . 3 1 1 A 41 41 GLN H H 41 8.173 8.299 -0.126 1 1 226 . 3 1 1 A 41 41 GLN C C 41 175.234 174.014 1.220 1 1 227 . 3 1 1 A 41 41 GLN CA C 41 55.488 54.333 1.155 1 1 228 . 3 1 1 A 41 41 GLN CB C 41 28.523 32.200 -3.677 1 1 230 . 3 1 1 A 41 41 GLN N N 41 120.810 123.137 -2.327 1 1 231 . 3 1 1 A 42 42 ASN H H 42 8.193 8.459 -0.266 1 1 232 . 3 1 1 A 42 42 ASN C C 42 174.618 175.185 -0.567 1 1 233 . 3 1 1 A 42 42 ASN CA C 42 52.924 51.895 1.029 1 1 234 . 3 1 1 A 42 42 ASN CB C 42 38.333 38.327 0.006 1 1 235 . 3 1 1 A 42 42 ASN N N 42 119.679 118.050 1.629 1 1 236 . 3 1 1 A 43 43 ASN H H 43 8.255 8.580 -0.325 1 1 237 . 3 1 1 A 43 43 ASN C C 43 173.873 175.842 -1.969 1 1 238 . 3 1 1 A 43 43 ASN CA C 43 52.919 55.544 -2.625 1 1 239 . 3 1 1 A 43 43 ASN CB C 43 38.580 39.006 -0.426 1 1 240 . 3 1 1 A 43 43 ASN N N 43 119.773 121.750 -1.977 1 1 241 . 3 1 1 A 44 44 ASN H H 44 7.865 8.032 -0.167 1 1 242 . 3 1 1 A 44 44 ASN C C 44 175.518 176.393 -0.875 1 1 243 . 3 1 1 A 44 44 ASN CA C 44 54.528 51.922 2.606 1 1 244 . 3 1 1 A 44 44 ASN CB C 44 40.170 38.588 1.582 1 1 246 . 3 1 1 A 44 44 ASN N N 44 124.152 113.803 10.349 1 1 247 . 3 1 1 A 46 46 PRO C C 46 177.228 176.255 0.973 1 1 248 . 3 1 1 A 46 46 PRO CA C 46 62.794 65.828 -3.034 1 1 249 . 3 1 1 A 46 46 PRO CB C 46 31.283 31.035 0.248 1 1 251 . 3 1 1 A 47 47 THR H H 47 8.165 7.529 0.636 1 1 255 . 3 1 1 A 47 47 THR C C 47 174.573 173.463 1.110 1 1 256 . 3 1 1 A 47 47 THR CA C 47 61.346 59.744 1.602 1 1 257 . 3 1 1 A 47 47 THR CB C 47 69.573 72.259 -2.686 1 1 259 . 3 1 1 A 47 47 THR N N 47 114.265 107.374 6.891 1 1 260 . 3 1 1 A 48 48 ARG H H 48 8.237 8.496 -0.259 1 1 261 . 3 1 1 A 48 48 ARG C C 48 175.898 176.484 -0.586 1 1 262 . 3 1 1 A 48 48 ARG CA C 48 55.717 56.492 -0.775 1 1 263 . 3 1 1 A 48 48 ARG CB C 48 30.151 32.195 -2.044 1 1 266 . 3 1 1 A 48 48 ARG N N 48 122.795 118.682 4.113 1 1 267 . 3 1 1 A 49 49 ASN H H 49 8.369 7.681 0.688 1 1 268 . 3 1 1 A 49 49 ASN C C 49 174.560 175.056 -0.496 1 1 269 . 3 1 1 A 49 49 ASN CA C 49 53.005 53.207 -0.202 1 1 270 . 3 1 1 A 49 49 ASN CB C 49 38.761 38.950 -0.189 1 1 271 . 3 1 1 A 49 49 ASN N N 49 119.837 119.298 0.539 1 1 272 . 3 1 1 A 50 50 ASP H H 50 8.192 9.035 -0.843 1 1 273 . 3 1 1 A 50 50 ASP C C 50 175.699 176.092 -0.393 1 1 274 . 3 1 1 A 50 50 ASP CA C 50 54.289 52.364 1.925 1 1 275 . 3 1 1 A 50 50 ASP CB C 50 41.264 43.211 -1.947 1 1 276 . 3 1 1 A 50 50 ASP N N 50 120.403 120.443 -0.040 1 1 277 . 3 1 1 A 51 51 GLN H H 51 8.428 8.372 0.056 1 1 278 . 3 1 1 A 51 51 GLN C C 51 175.186 175.939 -0.753 1 1 279 . 3 1 1 A 51 51 GLN CA C 51 54.512 56.861 -2.349 1 1 280 . 3 1 1 A 51 51 GLN CB C 51 30.424 29.553 0.871 1 1 282 . 3 1 1 A 51 51 GLN N N 51 118.959 119.245 -0.286 1 1 289 . 3 1 1 A 52 52 LEU C C 52 176.018 175.713 0.305 1 1 290 . 3 1 1 A 52 52 LEU CA C 52 54.332 52.966 1.366 1 1 291 . 3 1 1 A 52 52 LEU CB C 52 43.022 45.948 -2.926 1 1 294 . 3 1 1 A 53 53 GLY H H 53 8.639 9.024 -0.385 1 1 295 . 3 1 1 A 53 53 GLY C C 53 171.931 171.437 0.494 1 1 296 . 3 1 1 A 53 53 GLY CA C 53 43.501 44.182 -0.681 1 1 297 . 3 1 1 A 53 53 GLY N N 53 109.964 106.777 3.187 1 1 298 . 3 1 1 A 54 54 ALA H H 54 8.881 8.847 0.034 1 1 299 . 3 1 1 A 54 54 ALA C C 54 175.543 176.658 -1.115 1 1 300 . 3 1 1 A 54 54 ALA CA C 54 50.710 50.810 -0.100 1 1 301 . 3 1 1 A 54 54 ALA CB C 54 22.914 21.288 1.626 1 1 302 . 3 1 1 A 54 54 ALA N N 54 120.413 124.686 -4.273 1 1 303 . 3 1 1 A 55 55 GLY H H 55 8.346 8.805 -0.459 1 1 304 . 3 1 1 A 55 55 GLY C C 55 170.960 172.022 -1.062 1 1 305 . 3 1 1 A 55 55 GLY CA C 55 46.704 44.951 1.753 1 1 306 . 3 1 1 A 55 55 GLY N N 55 104.688 108.573 -3.885 1 1 307 . 3 1 1 A 56 56 ALA H H 56 9.116 9.123 -0.007 1 1 308 . 3 1 1 A 56 56 ALA C C 56 176.472 176.828 -0.356 1 1 309 . 3 1 1 A 56 56 ALA CA C 56 49.638 50.919 -1.281 1 1 310 . 3 1 1 A 56 56 ALA CB C 56 22.275 21.505 0.770 1 1 311 . 3 1 1 A 56 56 ALA N N 56 120.608 126.266 -5.658 1 1 312 . 3 1 1 A 57 57 PHE H H 57 8.688 9.526 -0.838 1 1 313 . 3 1 1 A 57 57 PHE C C 57 172.816 175.558 -2.742 1 1 314 . 3 1 1 A 57 57 PHE CA C 57 56.066 55.995 0.071 1 1 315 . 3 1 1 A 57 57 PHE CB C 57 41.770 41.880 -0.110 1 1 316 . 3 1 1 A 57 57 PHE N N 57 120.027 119.271 0.756 1 1 317 . 3 1 1 A 58 58 GLY H H 58 9.034 8.402 0.632 1 1 318 . 3 1 1 A 58 58 GLY C C 58 170.860 172.635 -1.775 1 1 319 . 3 1 1 A 58 58 GLY CA C 58 44.954 44.815 0.139 1 1 320 . 3 1 1 A 58 58 GLY N N 58 105.817 109.676 -3.859 1 1 321 . 3 1 1 A 59 59 GLY H H 59 8.382 8.330 0.052 1 1 322 . 3 1 1 A 59 59 GLY C C 59 169.284 171.802 -2.518 1 1 323 . 3 1 1 A 59 59 GLY CA C 59 45.840 45.598 0.242 1 1 324 . 3 1 1 A 59 59 GLY N N 59 109.059 109.783 -0.724 1 1 325 . 3 1 1 A 60 60 TYR H H 60 8.430 8.636 -0.206 1 1 326 . 3 1 1 A 60 60 TYR C C 60 173.453 172.082 1.371 1 1 327 . 3 1 1 A 60 60 TYR CA C 60 55.282 56.131 -0.849 1 1 328 . 3 1 1 A 60 60 TYR CB C 60 41.712 40.666 1.046 1 1 329 . 3 1 1 A 60 60 TYR N N 60 118.352 115.967 2.385 1 1 330 . 3 1 1 A 61 61 GLN H H 61 8.833 8.783 0.050 1 1 331 . 3 1 1 A 61 61 GLN C C 61 174.365 175.401 -1.036 1 1 332 . 3 1 1 A 61 61 GLN CA C 61 54.125 54.614 -0.489 1 1 333 . 3 1 1 A 61 61 GLN CB C 61 28.033 31.776 -3.743 1 1 335 . 3 1 1 A 61 61 GLN N N 61 129.628 119.618 10.010 1 1 336 . 3 1 1 A 62 62 VAL H H 62 8.714 8.455 0.259 1 1 343 . 3 1 1 A 62 62 VAL C C 62 175.758 174.598 1.160 1 1 344 . 3 1 1 A 62 62 VAL CA C 62 64.649 61.138 3.511 1 1 345 . 3 1 1 A 62 62 VAL CB C 62 31.900 32.525 -0.625 1 1 348 . 3 1 1 A 62 62 VAL N N 62 127.666 123.746 3.920 1 1 349 . 3 1 1 A 63 63 ASN H H 63 8.062 7.540 0.522 1 1 350 . 3 1 1 A 63 63 ASN C C 63 172.827 174.360 -1.533 1 1 351 . 3 1 1 A 63 63 ASN CA C 63 51.575 50.637 0.938 1 1 352 . 3 1 1 A 63 63 ASN CB C 63 37.194 41.094 -3.900 1 1 353 . 3 1 1 A 63 63 ASN N N 63 116.310 118.380 -2.070 1 1 354 . 3 1 1 A 64 64 PRO C C 64 175.071 177.090 -2.019 1 1 355 . 3 1 1 A 64 64 PRO CA C 64 65.296 64.702 0.594 1 1 356 . 3 1 1 A 64 64 PRO CB C 64 30.428 31.600 -1.172 1 1 357 . 3 1 1 A 65 65 TYR H H 65 7.873 7.579 0.294 1 1 358 . 3 1 1 A 65 65 TYR C C 65 175.145 174.253 0.892 1 1 359 . 3 1 1 A 65 65 TYR CA C 65 56.125 56.967 -0.842 1 1 360 . 3 1 1 A 65 65 TYR CB C 65 39.189 39.126 0.063 1 1 361 . 3 1 1 A 65 65 TYR N N 65 112.894 114.598 -1.704 1 1 362 . 3 1 1 A 66 66 LEU H H 66 7.308 7.443 -0.135 1 1 369 . 3 1 1 A 66 66 LEU C C 66 173.866 174.754 -0.888 1 1 370 . 3 1 1 A 66 66 LEU CA C 66 53.431 54.261 -0.830 1 1 371 . 3 1 1 A 66 66 LEU CB C 66 44.958 45.467 -0.509 1 1 375 . 3 1 1 A 66 66 LEU N N 66 120.270 121.876 -1.606 1 1 376 . 3 1 1 A 67 67 GLY H H 67 8.855 8.981 -0.126 1 1 377 . 3 1 1 A 67 67 GLY C C 67 170.698 171.891 -1.193 1 1 378 . 3 1 1 A 67 67 GLY CA C 67 44.008 44.098 -0.090 1 1 379 . 3 1 1 A 67 67 GLY N N 67 114.388 111.830 2.558 1 1 380 . 3 1 1 A 68 68 PHE H H 68 8.770 8.732 0.038 1 1 381 . 3 1 1 A 68 68 PHE C C 68 173.386 174.620 -1.234 1 1 382 . 3 1 1 A 68 68 PHE CA C 68 56.507 56.649 -0.142 1 1 383 . 3 1 1 A 68 68 PHE CB C 68 42.428 40.245 2.183 1 1 384 . 3 1 1 A 68 68 PHE N N 68 117.510 122.697 -5.187 1 1 385 . 3 1 1 A 69 69 GLU H H 69 9.079 8.835 0.244 1 1 386 . 3 1 1 A 69 69 GLU C C 69 174.556 174.840 -0.284 1 1 387 . 3 1 1 A 69 69 GLU CA C 69 54.939 54.588 0.351 1 1 388 . 3 1 1 A 69 69 GLU CB C 69 33.963 32.915 1.048 1 1 390 . 3 1 1 A 69 69 GLU N N 69 120.562 123.780 -3.218 1 1 391 . 3 1 1 A 70 70 MET H H 70 9.481 8.954 0.527 1 1 392 . 3 1 1 A 70 70 MET C C 70 174.595 175.152 -0.557 1 1 393 . 3 1 1 A 70 70 MET CA C 70 53.091 54.210 -1.119 1 1 394 . 3 1 1 A 70 70 MET CB C 70 36.159 35.373 0.786 1 1 397 . 3 1 1 A 70 70 MET N N 70 124.928 122.736 2.192 1 1 398 . 3 1 1 A 71 71 GLY H H 71 8.845 8.870 -0.025 1 1 399 . 3 1 1 A 71 71 GLY C C 71 170.811 171.548 -0.737 1 1 400 . 3 1 1 A 71 71 GLY CA C 71 44.624 43.678 0.946 1 1 401 . 3 1 1 A 71 71 GLY N N 71 108.896 112.343 -3.447 1 1 402 . 3 1 1 A 72 72 TYR H H 72 8.925 8.745 0.180 1 1 403 . 3 1 1 A 72 72 TYR C C 72 173.278 173.407 -0.129 1 1 404 . 3 1 1 A 72 72 TYR CA C 72 55.912 56.426 -0.514 1 1 405 . 3 1 1 A 72 72 TYR CB C 72 41.611 41.835 -0.224 1 1 406 . 3 1 1 A 72 72 TYR N N 72 123.253 123.353 -0.100 1 1 407 . 3 1 1 A 73 73 ASP H H 73 8.665 8.935 -0.270 1 1 408 . 3 1 1 A 73 73 ASP C C 73 173.598 175.309 -1.711 1 1 409 . 3 1 1 A 73 73 ASP CA C 73 52.857 53.544 -0.687 1 1 410 . 3 1 1 A 73 73 ASP CB C 73 42.774 41.754 1.020 1 1 411 . 3 1 1 A 73 73 ASP N N 73 126.178 127.756 -1.578 1 1 412 . 3 1 1 A 74 74 TRP H H 74 9.080 8.757 0.323 1 1 413 . 3 1 1 A 74 74 TRP C C 74 174.868 174.013 0.855 1 1 414 . 3 1 1 A 74 74 TRP CB C 74 30.083 33.169 -3.086 1 1 415 . 3 1 1 A 74 74 TRP N N 74 121.824 127.611 -5.787 1 1 416 . 3 1 1 A 78 78 MET C C 78 174.548 175.124 -0.576 1 1 417 . 3 1 1 A 78 78 MET CA C 78 54.388 55.503 -1.115 1 1 418 . 3 1 1 A 78 78 MET CB C 78 32.542 31.971 0.571 1 1 419 . 3 1 1 A 79 79 ALA H H 79 8.105 7.846 0.259 1 1 420 . 3 1 1 A 79 79 ALA C C 79 176.629 175.970 0.659 1 1 421 . 3 1 1 A 79 79 ALA CA C 79 51.210 51.038 0.172 1 1 422 . 3 1 1 A 79 79 ALA CB C 79 19.106 22.711 -3.605 1 1 423 . 3 1 1 A 79 79 ALA N N 79 125.778 127.566 -1.788 1 1 424 . 3 1 1 A 80 80 TYR H H 80 8.035 8.803 -0.768 1 1 425 . 3 1 1 A 80 80 TYR C C 80 175.604 175.399 0.205 1 1 426 . 3 1 1 A 80 80 TYR CA C 80 57.021 57.548 -0.527 1 1 427 . 3 1 1 A 80 80 TYR CB C 80 38.416 39.926 -1.510 1 1 428 . 3 1 1 A 80 80 TYR N N 80 120.045 118.494 1.551 1 1 429 . 3 1 1 A 81 81 LYS H H 81 8.295 8.407 -0.112 1 1 430 . 3 1 1 A 81 81 LYS C C 81 176.647 176.786 -0.139 1 1 431 . 3 1 1 A 81 81 LYS CA C 81 56.285 56.814 -0.529 1 1 432 . 3 1 1 A 81 81 LYS CB C 81 31.571 32.658 -1.087 1 1 434 . 3 1 1 A 81 81 LYS N N 81 123.191 121.077 2.114 1 1 435 . 3 1 1 A 82 82 GLY H H 82 8.117 8.409 -0.292 1 1 436 . 3 1 1 A 82 82 GLY C C 82 174.010 174.564 -0.554 1 1 437 . 3 1 1 A 82 82 GLY CA C 82 44.982 46.219 -1.237 1 1 438 . 3 1 1 A 82 82 GLY N N 82 110.014 113.278 -3.264 1 1 439 . 3 1 1 A 83 83 SER H H 83 7.938 8.147 -0.209 1 1 440 . 3 1 1 A 83 83 SER C C 83 174.634 173.767 0.867 1 1 441 . 3 1 1 A 83 83 SER CA C 83 57.685 58.129 -0.444 1 1 442 . 3 1 1 A 83 83 SER CB C 83 63.303 64.151 -0.848 1 1 443 . 3 1 1 A 83 83 SER N N 83 115.655 115.651 0.004 1 1 444 . 3 1 1 A 84 84 VAL H H 84 8.008 8.612 -0.604 1 1 451 . 3 1 1 A 84 84 VAL C C 84 175.525 174.413 1.112 1 1 452 . 3 1 1 A 84 84 VAL CA C 84 61.769 60.127 1.642 1 1 453 . 3 1 1 A 84 84 VAL CB C 84 31.711 33.965 -2.254 1 1 456 . 3 1 1 A 84 84 VAL N N 84 120.054 117.689 2.365 1 1 457 . 3 1 1 A 85 85 ASP H H 85 8.140 8.910 -0.770 1 1 458 . 3 1 1 A 85 85 ASP C C 85 174.740 173.866 0.874 1 1 459 . 3 1 1 A 85 85 ASP CA C 85 53.983 53.144 0.839 1 1 460 . 3 1 1 A 85 85 ASP CB C 85 40.633 44.515 -3.882 1 1 461 . 3 1 1 A 85 85 ASP N N 85 122.510 124.392 -1.882 1 1 462 . 3 1 1 A 86 86 ASN H H 86 7.736 8.634 -0.898 1 1 463 . 3 1 1 A 86 86 ASN C C 86 175.970 174.405 1.565 1 1 464 . 3 1 1 A 86 86 ASN CA C 86 54.349 52.110 2.239 1 1 465 . 3 1 1 A 86 86 ASN CB C 86 40.490 42.816 -2.326 1 1 467 . 3 1 1 A 86 86 ASN N N 86 124.290 119.129 5.161 1 1 468 . 3 1 1 A 87 87 GLY H H 87 8.000 8.306 -0.306 1 1 469 . 3 1 1 A 87 87 GLY C C 87 173.456 174.684 -1.228 1 1 470 . 3 1 1 A 87 87 GLY CA C 87 44.973 45.451 -0.478 1 1 471 . 3 1 1 A 87 87 GLY N N 87 113.494 111.794 1.700 1 1 472 . 3 1 1 A 88 88 ALA H H 88 8.024 8.596 -0.572 1 1 473 . 3 1 1 A 88 88 ALA C C 88 176.833 177.787 -0.954 1 1 474 . 3 1 1 A 88 88 ALA CA C 88 51.734 53.914 -2.180 1 1 475 . 3 1 1 A 88 88 ALA CB C 88 19.818 19.486 0.332 1 1 476 . 3 1 1 A 88 88 ALA N N 88 122.676 129.002 -6.326 1 1 477 . 3 1 1 A 91 91 ALA C C 91 174.781 174.988 -0.207 1 1 478 . 3 1 1 A 91 91 ALA CA C 91 50.537 50.434 0.103 1 1 479 . 3 1 1 A 91 91 ALA CB C 91 21.324 23.966 -2.642 1 1 480 . 3 1 1 A 92 92 GLN H H 92 8.451 8.586 -0.135 1 1 481 . 3 1 1 A 92 92 GLN C C 92 173.557 174.518 -0.961 1 1 482 . 3 1 1 A 92 92 GLN CA C 92 53.380 54.394 -1.014 1 1 484 . 3 1 1 A 92 92 GLN N N 92 116.847 117.385 -0.538 1 1 485 . 3 1 1 A 93 93 GLY C C 93 170.631 172.542 -1.911 1 1 486 . 3 1 1 A 93 93 GLY CA C 93 45.718 44.239 1.479 1 1 487 . 3 1 1 A 94 94 VAL H H 94 8.686 9.768 -1.082 1 1 494 . 3 1 1 A 94 94 VAL C C 94 173.698 174.499 -0.801 1 1 495 . 3 1 1 A 94 94 VAL CA C 94 58.997 60.026 -1.029 1 1 496 . 3 1 1 A 94 94 VAL CB C 94 33.311 34.503 -1.192 1 1 499 . 3 1 1 A 94 94 VAL N N 94 118.489 119.040 -0.551 1 1 500 . 3 1 1 A 95 95 GLN H H 95 9.468 9.486 -0.018 1 1 501 . 3 1 1 A 95 95 GLN C C 95 174.028 174.419 -0.391 1 1 502 . 3 1 1 A 95 95 GLN CA C 95 52.547 54.379 -1.832 1 1 503 . 3 1 1 A 95 95 GLN CB C 95 33.816 31.590 2.226 1 1 505 . 3 1 1 A 95 95 GLN N N 95 122.106 125.510 -3.404 1 1 506 . 3 1 1 A 96 96 LEU H H 96 8.484 8.912 -0.428 1 1 513 . 3 1 1 A 96 96 LEU C C 96 175.322 174.644 0.678 1 1 514 . 3 1 1 A 96 96 LEU CA C 96 53.736 53.638 0.098 1 1 515 . 3 1 1 A 96 96 LEU CB C 96 41.088 45.297 -4.209 1 1 519 . 3 1 1 A 96 96 LEU N N 96 123.224 124.951 -1.727 1 1 520 . 3 1 1 A 97 97 THR H H 97 9.116 8.415 0.701 1 1 521 . 3 1 1 A 97 97 THR C C 97 173.251 172.483 0.768 1 1 522 . 3 1 1 A 97 97 THR CA C 97 58.931 60.498 -1.567 1 1 523 . 3 1 1 A 97 97 THR CB C 97 72.984 70.439 2.545 1 1 525 . 3 1 1 A 97 97 THR N N 97 112.504 118.187 -5.683 1 1 526 . 3 1 1 A 98 98 ALA H H 98 8.603 8.494 0.109 1 1 527 . 3 1 1 A 98 98 ALA C C 98 174.948 175.450 -0.502 1 1 528 . 3 1 1 A 98 98 ALA CA C 98 49.980 50.102 -0.122 1 1 529 . 3 1 1 A 98 98 ALA CB C 98 19.157 20.277 -1.120 1 1 530 . 3 1 1 A 98 98 ALA N N 98 121.608 126.347 -4.739 1 1 531 . 3 1 1 A 99 99 LYS H H 99 8.890 9.270 -0.380 1 1 532 . 3 1 1 A 99 99 LYS C C 99 174.294 175.523 -1.229 1 1 533 . 3 1 1 A 99 99 LYS CA C 99 54.019 54.718 -0.699 1 1 534 . 3 1 1 A 99 99 LYS CB C 99 33.018 34.529 -1.511 1 1 538 . 3 1 1 A 99 99 LYS N N 99 124.522 124.134 0.388 1 1 539 . 3 1 1 A 100 100 LEU H H 100 8.985 8.747 0.238 1 1 546 . 3 1 1 A 100 100 LEU C C 100 175.265 175.509 -0.244 1 1 547 . 3 1 1 A 100 100 LEU CA C 100 52.698 53.176 -0.478 1 1 548 . 3 1 1 A 100 100 LEU CB C 100 42.889 44.704 -1.815 1 1 552 . 3 1 1 A 100 100 LEU N N 100 131.876 123.268 8.608 1 1 553 . 3 1 1 A 101 101 GLY H H 101 9.137 8.213 0.924 1 1 554 . 3 1 1 A 101 101 GLY C C 101 170.798 171.503 -0.705 1 1 555 . 3 1 1 A 101 101 GLY CA C 101 44.429 45.753 -1.324 1 1 556 . 3 1 1 A 101 101 GLY N N 101 111.928 108.248 3.680 1 1 557 . 3 1 1 A 102 102 TYR H H 102 8.779 8.589 0.190 1 1 558 . 3 1 1 A 102 102 TYR C C 102 173.402 173.629 -0.227 1 1 559 . 3 1 1 A 102 102 TYR CA C 102 54.444 56.153 -1.709 1 1 560 . 3 1 1 A 102 102 TYR CB C 102 42.239 42.172 0.067 1 1 561 . 3 1 1 A 102 102 TYR N N 102 116.664 119.108 -2.444 1 1 562 . 3 1 1 A 103 103 PRO C C 103 175.676 176.189 -0.513 1 1 563 . 3 1 1 A 103 103 PRO CA C 103 61.462 62.615 -1.153 1 1 564 . 3 1 1 A 103 103 PRO CB C 103 30.073 33.490 -3.417 1 1 565 . 3 1 1 A 104 104 ILE H H 104 8.670 9.008 -0.338 1 1 569 . 3 1 1 A 104 104 ILE C C 104 176.646 177.038 -0.392 1 1 570 . 3 1 1 A 104 104 ILE CA C 104 62.054 62.140 -0.086 1 1 571 . 3 1 1 A 104 104 ILE CB C 104 37.678 40.794 -3.116 1 1 574 . 3 1 1 A 104 104 ILE N N 104 125.939 121.254 4.685 1 1 575 . 3 1 1 A 105 105 THR H H 105 8.129 7.877 0.252 1 1 576 . 3 1 1 A 105 105 THR C C 105 174.344 174.471 -0.127 1 1 577 . 3 1 1 A 105 105 THR CA C 105 59.176 62.382 -3.206 1 1 578 . 3 1 1 A 105 105 THR CB C 105 71.049 69.979 1.070 1 1 580 . 3 1 1 A 105 105 THR N N 105 109.853 111.549 -1.696 1 1 581 . 3 1 1 A 106 106 ASP H H 106 8.424 7.945 0.479 1 1 582 . 3 1 1 A 106 106 ASP C C 106 175.692 176.135 -0.443 1 1 583 . 3 1 1 A 106 106 ASP CA C 106 56.465 55.340 1.125 1 1 584 . 3 1 1 A 106 106 ASP CB C 106 40.032 43.546 -3.514 1 1 585 . 3 1 1 A 106 106 ASP N N 106 117.156 120.283 -3.127 1 1 586 . 3 1 1 A 107 107 ASP H H 107 8.124 8.622 -0.498 1 1 587 . 3 1 1 A 107 107 ASP C C 107 174.174 174.711 -0.537 1 1 588 . 3 1 1 A 107 107 ASP CA C 107 52.907 53.833 -0.926 1 1 589 . 3 1 1 A 107 107 ASP CB C 107 41.661 41.832 -0.171 1 1 590 . 3 1 1 A 107 107 ASP N N 107 113.591 117.434 -3.843 1 1 591 . 3 1 1 A 108 108 LEU H H 108 7.336 7.467 -0.131 1 1 598 . 3 1 1 A 108 108 LEU C C 108 174.321 175.142 -0.821 1 1 599 . 3 1 1 A 108 108 LEU CA C 108 54.449 53.770 0.679 1 1 600 . 3 1 1 A 108 108 LEU CB C 108 44.754 45.056 -0.302 1 1 604 . 3 1 1 A 108 108 LEU N N 108 123.244 119.653 3.591 1 1 605 . 3 1 1 A 109 109 ASP H H 109 8.943 8.881 0.062 1 1 606 . 3 1 1 A 109 109 ASP C C 109 176.248 174.685 1.563 1 1 607 . 3 1 1 A 109 109 ASP CA C 109 52.376 52.285 0.091 1 1 608 . 3 1 1 A 109 109 ASP CB C 109 42.764 44.705 -1.941 1 1 609 . 3 1 1 A 109 109 ASP N N 109 124.634 122.315 2.319 1 1 610 . 3 1 1 A 110 110 ILE H H 110 8.372 8.825 -0.453 1 1 614 . 3 1 1 A 110 110 ILE C C 110 173.735 174.717 -0.982 1 1 615 . 3 1 1 A 110 110 ILE CA C 110 59.129 59.219 -0.090 1 1 616 . 3 1 1 A 110 110 ILE CB C 110 39.402 40.558 -1.156 1 1 620 . 3 1 1 A 110 110 ILE N N 110 119.135 115.565 3.570 1 1 621 . 3 1 1 A 111 111 TYR H H 111 8.695 8.669 0.026 1 1 622 . 3 1 1 A 111 111 TYR C C 111 172.838 173.081 -0.243 1 1 623 . 3 1 1 A 111 111 TYR CA C 111 56.182 56.032 0.150 1 1 624 . 3 1 1 A 111 111 TYR CB C 111 41.489 41.927 -0.438 1 1 625 . 3 1 1 A 111 111 TYR N N 111 121.248 119.256 1.992 1 1 626 . 3 1 1 A 112 112 THR H H 112 9.172 8.925 0.247 1 1 627 . 3 1 1 A 112 112 THR C C 112 173.850 173.429 0.421 1 1 628 . 3 1 1 A 112 112 THR CA C 112 58.246 59.894 -1.648 1 1 629 . 3 1 1 A 112 112 THR CB C 112 71.676 71.464 0.212 1 1 631 . 3 1 1 A 112 112 THR N N 112 110.671 112.357 -1.686 1 1 632 . 3 1 1 A 113 113 ARG H H 113 8.732 8.991 -0.259 1 1 633 . 3 1 1 A 113 113 ARG C C 113 175.037 174.264 0.773 1 1 634 . 3 1 1 A 113 113 ARG CA C 113 53.995 54.424 -0.429 1 1 635 . 3 1 1 A 113 113 ARG CB C 113 32.266 32.789 -0.523 1 1 638 . 3 1 1 A 113 113 ARG N N 113 120.642 122.773 -2.131 1 1 639 . 3 1 1 A 114 114 LEU H H 114 8.449 8.853 -0.404 1 1 646 . 3 1 1 A 114 114 LEU C C 114 175.812 175.782 0.030 1 1 647 . 3 1 1 A 114 114 LEU CA C 114 53.335 53.455 -0.120 1 1 648 . 3 1 1 A 114 114 LEU CB C 114 45.182 44.860 0.322 1 1 652 . 3 1 1 A 114 114 LEU N N 114 119.078 123.950 -4.872 1 1 653 . 3 1 1 A 115 115 GLY H H 115 8.232 8.282 -0.050 1 1 654 . 3 1 1 A 115 115 GLY C C 115 171.343 172.284 -0.941 1 1 655 . 3 1 1 A 115 115 GLY CA C 115 46.217 46.067 0.150 1 1 656 . 3 1 1 A 115 115 GLY N N 115 108.966 112.345 -3.379 1 1 657 . 3 1 1 A 116 116 GLY H H 116 8.293 8.339 -0.046 1 1 658 . 3 1 1 A 116 116 GLY C C 116 169.856 172.532 -2.676 1 1 659 . 3 1 1 A 116 116 GLY CA C 116 44.084 45.490 -1.406 1 1 660 . 3 1 1 A 116 116 GLY N N 116 109.676 110.864 -1.188 1 1 661 . 3 1 1 A 117 117 MET H H 117 9.286 9.256 0.030 1 1 662 . 3 1 1 A 117 117 MET C C 117 174.557 175.039 -0.482 1 1 663 . 3 1 1 A 117 117 MET CA C 117 53.258 53.357 -0.099 1 1 664 . 3 1 1 A 117 117 MET CB C 117 37.195 35.133 2.062 1 1 667 . 3 1 1 A 117 117 MET N N 117 120.425 116.721 3.704 1 1 668 . 3 1 1 A 118 118 VAL H H 118 9.062 9.054 0.008 1 1 675 . 3 1 1 A 118 118 VAL C C 118 173.993 175.181 -1.188 1 1 676 . 3 1 1 A 118 118 VAL CA C 118 59.883 60.914 -1.031 1 1 677 . 3 1 1 A 118 118 VAL CB C 118 31.782 34.466 -2.684 1 1 680 . 3 1 1 A 118 118 VAL N N 118 126.948 120.754 6.194 1 1 681 . 3 1 1 A 119 119 TRP H H 119 8.482 9.453 -0.971 1 1 682 . 3 1 1 A 119 119 TRP C C 119 174.608 173.003 1.605 1 1 683 . 3 1 1 A 119 119 TRP CA C 119 53.332 55.181 -1.849 1 1 684 . 3 1 1 A 119 119 TRP CB C 119 33.569 31.385 2.184 1 1 685 . 3 1 1 A 119 119 TRP N N 119 124.631 124.538 0.093 1 1 686 . 3 1 1 A 120 120 ARG H H 120 9.113 8.421 0.692 1 1 687 . 3 1 1 A 120 120 ARG C C 120 174.951 174.825 0.126 1 1 688 . 3 1 1 A 120 120 ARG CA C 120 54.684 54.599 0.085 1 1 689 . 3 1 1 A 120 120 ARG CB C 120 33.424 32.438 0.986 1 1 690 . 3 1 1 A 120 120 ARG N N 120 117.899 119.613 -1.714 1 1 691 . 3 1 1 A 121 121 ALA H H 121 9.299 8.259 1.040 1 1 692 . 3 1 1 A 121 121 ALA C C 121 175.954 174.979 0.975 1 1 693 . 3 1 1 A 121 121 ALA CA C 121 50.368 50.455 -0.087 1 1 694 . 3 1 1 A 121 121 ALA CB C 121 21.141 22.349 -1.208 1 1 695 . 3 1 1 A 121 121 ALA N N 121 128.863 121.146 7.717 1 1 696 . 3 1 1 A 122 122 ASP H H 122 8.488 8.677 -0.189 1 1 697 . 3 1 1 A 122 122 ASP C C 122 175.635 174.622 1.013 1 1 698 . 3 1 1 A 122 122 ASP CA C 122 53.891 52.943 0.948 1 1 699 . 3 1 1 A 122 122 ASP CB C 122 42.492 45.192 -2.700 1 1 700 . 3 1 1 A 122 122 ASP N N 122 121.721 121.422 0.299 1 1 701 . 3 1 1 A 123 123 SER H H 123 8.466 8.711 -0.245 1 1 702 . 3 1 1 A 123 123 SER C C 123 174.325 174.321 0.004 1 1 703 . 3 1 1 A 123 123 SER CA C 123 57.325 58.337 -1.012 1 1 704 . 3 1 1 A 123 123 SER CB C 123 63.988 64.913 -0.925 1 1 705 . 3 1 1 A 123 123 SER N N 123 117.374 113.442 3.932 1 1 706 . 3 1 1 A 124 124 LYS H H 124 8.389 8.029 0.360 1 1 707 . 3 1 1 A 124 124 LYS C C 124 176.840 176.263 0.577 1 1 708 . 3 1 1 A 124 124 LYS CA C 124 56.036 55.312 0.724 1 1 709 . 3 1 1 A 124 124 LYS CB C 124 32.397 33.114 -0.717 1 1 711 . 3 1 1 A 124 124 LYS N N 124 122.883 120.086 2.797 1 1 712 . 3 1 1 A 125 125 GLY H H 125 8.281 8.270 0.011 1 1 713 . 3 1 1 A 125 125 GLY C C 125 173.592 173.706 -0.114 1 1 714 . 3 1 1 A 125 125 GLY CA C 125 44.924 45.660 -0.736 1 1 715 . 3 1 1 A 125 125 GLY N N 125 109.541 111.390 -1.849 1 1 716 . 3 1 1 A 126 126 ASN H H 126 8.185 9.149 -0.964 1 1 717 . 3 1 1 A 126 126 ASN C C 126 176.649 173.493 3.156 1 1 718 . 3 1 1 A 126 126 ASN CA C 126 52.763 54.004 -1.241 1 1 719 . 3 1 1 A 126 126 ASN CB C 126 38.439 41.441 -3.002 1 1 720 . 3 1 1 A 126 126 ASN N N 126 119.019 121.329 -2.310 1 1 721 . 3 1 1 A 127 127 TYR C C 127 176.913 174.921 1.992 1 1 722 . 3 1 1 A 127 127 TYR CA C 127 57.757 56.640 1.117 1 1 723 . 3 1 1 A 127 127 TYR CB C 127 37.703 40.206 -2.503 1 1 724 . 3 1 1 A 128 128 ALA H H 128 8.050 9.147 -1.097 1 1 728 . 3 1 1 A 128 128 ALA C C 128 177.756 176.207 1.549 1 1 729 . 3 1 1 A 128 128 ALA CA C 128 52.321 51.086 1.235 1 1 730 . 3 1 1 A 128 128 ALA CB C 128 18.273 21.475 -3.202 1 1 731 . 3 1 1 A 128 128 ALA N N 128 124.529 127.791 -3.262 1 1 732 . 3 1 1 A 129 129 SER H H 129 8.063 8.538 -0.475 1 1 733 . 3 1 1 A 129 129 SER C C 129 174.938 173.244 1.694 1 1 734 . 3 1 1 A 129 129 SER CA C 129 58.202 56.364 1.838 1 1 735 . 3 1 1 A 129 129 SER CB C 129 62.974 66.633 -3.659 1 1 736 . 3 1 1 A 129 129 SER N N 129 114.374 113.893 0.481 1 1 737 . 3 1 1 A 130 130 THR H H 130 7.875 8.266 -0.391 1 1 741 . 3 1 1 A 130 130 THR C C 130 175.198 174.066 1.132 1 1 742 . 3 1 1 A 130 130 THR CA C 130 61.520 61.226 0.294 1 1 743 . 3 1 1 A 130 130 THR CB C 130 69.312 69.462 -0.150 1 1 745 . 3 1 1 A 130 130 THR N N 130 113.608 115.724 -2.116 1 1 746 . 3 1 1 A 131 131 GLY H H 131 8.219 8.887 -0.668 1 1 747 . 3 1 1 A 131 131 GLY C C 131 173.979 174.892 -0.913 1 1 748 . 3 1 1 A 131 131 GLY CA C 131 44.991 44.144 0.847 1 1 749 . 3 1 1 A 131 131 GLY N N 131 110.848 111.958 -1.110 1 1 750 . 3 1 1 A 132 132 VAL H H 132 7.729 8.442 -0.713 1 1 757 . 3 1 1 A 132 132 VAL C C 132 175.988 176.863 -0.875 1 1 758 . 3 1 1 A 132 132 VAL CA C 132 61.643 65.983 -4.340 1 1 759 . 3 1 1 A 132 132 VAL CB C 132 31.941 32.029 -0.088 1 1 762 . 3 1 1 A 132 132 VAL N N 132 118.932 122.135 -3.203 1 1 763 . 3 1 1 A 133 133 SER H H 133 8.224 7.894 0.330 1 1 764 . 3 1 1 A 133 133 SER C C 133 174.320 173.479 0.841 1 1 765 . 3 1 1 A 133 133 SER CA C 133 57.756 58.655 -0.899 1 1 766 . 3 1 1 A 133 133 SER CB C 133 63.140 64.559 -1.419 1 1 767 . 3 1 1 A 133 133 SER N N 133 119.260 116.408 2.852 1 1 768 . 3 1 1 A 134 134 ARG H H 134 8.199 8.709 -0.510 1 1 769 . 3 1 1 A 134 134 ARG C C 134 175.923 175.854 0.069 1 1 770 . 3 1 1 A 134 134 ARG CA C 134 55.461 54.624 0.837 1 1 771 . 3 1 1 A 134 134 ARG CB C 134 30.195 31.664 -1.469 1 1 774 . 3 1 1 A 134 134 ARG N N 134 123.262 121.937 1.325 1 1 775 . 3 1 1 A 135 135 SER H H 135 8.256 8.918 -0.662 1 1 776 . 3 1 1 A 135 135 SER C C 135 174.360 174.735 -0.375 1 1 777 . 3 1 1 A 135 135 SER CA C 135 57.730 57.497 0.233 1 1 778 . 3 1 1 A 135 135 SER CB C 135 63.275 64.253 -0.978 1 1 779 . 3 1 1 A 135 135 SER N N 135 117.155 120.553 -3.398 1 1 780 . 3 1 1 A 136 136 GLU H H 136 8.374 8.585 -0.211 1 1 781 . 3 1 1 A 136 136 GLU C C 136 176.284 175.981 0.303 1 1 782 . 3 1 1 A 136 136 GLU CA C 136 56.082 56.436 -0.354 1 1 783 . 3 1 1 A 136 136 GLU CB C 136 29.820 31.140 -1.320 1 1 785 . 3 1 1 A 136 136 GLU N N 136 122.812 122.671 0.141 1 1 786 . 3 1 1 A 137 137 HIS H H 137 8.118 8.311 -0.193 1 1 787 . 3 1 1 A 137 137 HIS C C 137 173.529 172.946 0.583 1 1 788 . 3 1 1 A 137 137 HIS CA C 137 54.793 53.119 1.674 1 1 789 . 3 1 1 A 137 137 HIS CB C 137 30.191 32.966 -2.775 1 1 790 . 3 1 1 A 137 137 HIS N N 137 118.002 117.261 0.741 1 1 791 . 3 1 1 A 138 138 ASP H H 138 8.572 8.557 0.015 1 1 792 . 3 1 1 A 138 138 ASP C C 138 174.940 175.740 -0.800 1 1 793 . 3 1 1 A 138 138 ASP CA C 138 53.594 54.255 -0.661 1 1 794 . 3 1 1 A 138 138 ASP CB C 138 42.165 42.125 0.040 1 1 795 . 3 1 1 A 138 138 ASP N N 138 121.536 120.885 0.651 1 1 796 . 3 1 1 A 139 139 THR H H 139 7.857 8.856 -0.999 1 1 797 . 3 1 1 A 139 139 THR C C 139 172.822 173.018 -0.196 1 1 798 . 3 1 1 A 139 139 THR CA C 139 59.197 59.536 -0.339 1 1 799 . 3 1 1 A 139 139 THR CB C 139 71.457 71.859 -0.402 1 1 801 . 3 1 1 A 139 139 THR N N 139 113.598 114.195 -0.597 1 1 802 . 3 1 1 A 140 140 GLY C C 140 169.622 172.265 -2.643 1 1 803 . 3 1 1 A 140 140 GLY CA C 140 44.287 44.370 -0.083 1 1 804 . 3 1 1 A 141 141 VAL H H 141 7.815 8.868 -1.053 1 1 811 . 3 1 1 A 141 141 VAL C C 141 176.038 173.645 2.393 1 1 812 . 3 1 1 A 141 141 VAL CA C 141 59.739 60.147 -0.408 1 1 813 . 3 1 1 A 141 141 VAL CB C 141 33.308 35.212 -1.904 1 1 816 . 3 1 1 A 141 141 VAL N N 141 116.224 123.024 -6.800 1 1 817 . 3 1 1 A 142 142 SER H H 142 9.284 8.795 0.489 1 1 818 . 3 1 1 A 142 142 SER C C 142 171.050 171.703 -0.653 1 1 819 . 3 1 1 A 142 142 SER CB C 142 67.608 66.643 0.965 1 1 820 . 3 1 1 A 142 142 SER N N 142 123.223 122.207 1.016 1 1 821 . 3 1 1 A 143 143 PRO C C 143 174.032 176.130 -2.098 1 1 822 . 3 1 1 A 143 143 PRO CA C 143 62.350 62.736 -0.386 1 1 823 . 3 1 1 A 143 143 PRO CB C 143 31.774 32.894 -1.120 1 1 825 . 3 1 1 A 144 144 VAL H H 144 7.785 8.668 -0.883 1 1 832 . 3 1 1 A 144 144 VAL C C 144 172.826 173.983 -1.157 1 1 833 . 3 1 1 A 144 144 VAL CA C 144 59.770 59.790 -0.020 1 1 834 . 3 1 1 A 144 144 VAL CB C 144 34.407 36.038 -1.631 1 1 837 . 3 1 1 A 144 144 VAL N N 144 120.214 116.240 3.974 1 1 838 . 3 1 1 A 145 145 PHE H H 145 8.623 8.771 -0.148 1 1 839 . 3 1 1 A 145 145 PHE C C 145 173.658 173.015 0.643 1 1 840 . 3 1 1 A 145 145 PHE CA C 145 54.942 57.022 -2.080 1 1 841 . 3 1 1 A 145 145 PHE CB C 145 42.692 42.157 0.535 1 1 842 . 3 1 1 A 145 145 PHE N N 145 123.914 123.103 0.811 1 1 843 . 3 1 1 A 146 146 ALA H H 146 8.886 8.581 0.305 1 1 844 . 3 1 1 A 146 146 ALA C C 146 176.258 175.956 0.302 1 1 845 . 3 1 1 A 146 146 ALA CA C 146 49.734 50.049 -0.315 1 1 846 . 3 1 1 A 146 146 ALA CB C 146 22.244 21.939 0.305 1 1 847 . 3 1 1 A 146 146 ALA N N 146 125.243 129.796 -4.553 1 1 848 . 3 1 1 A 147 147 GLY H H 147 8.470 8.851 -0.381 1 1 849 . 3 1 1 A 147 147 GLY C C 147 170.940 172.888 -1.948 1 1 850 . 3 1 1 A 147 147 GLY CA C 147 44.063 44.632 -0.569 1 1 851 . 3 1 1 A 147 147 GLY N N 147 106.669 109.251 -2.582 1 1 852 . 3 1 1 A 148 148 GLY H H 148 8.008 8.261 -0.253 1 1 853 . 3 1 1 A 148 148 GLY C C 148 170.181 172.180 -1.999 1 1 854 . 3 1 1 A 148 148 GLY CA C 148 45.736 45.481 0.255 1 1 855 . 3 1 1 A 148 148 GLY N N 148 109.475 110.238 -0.763 1 1 856 . 3 1 1 A 149 149 VAL H H 149 8.426 8.278 0.148 1 1 863 . 3 1 1 A 149 149 VAL C C 149 174.157 173.222 0.935 1 1 864 . 3 1 1 A 149 149 VAL CA C 149 58.200 58.664 -0.464 1 1 865 . 3 1 1 A 149 149 VAL CB C 149 34.464 35.505 -1.041 1 1 868 . 3 1 1 A 149 149 VAL N N 149 112.651 116.836 -4.185 1 1 869 . 3 1 1 A 150 150 GLU H H 150 9.070 9.113 -0.043 1 1 870 . 3 1 1 A 150 150 GLU C C 150 173.892 174.597 -0.705 1 1 871 . 3 1 1 A 150 150 GLU CA C 150 54.617 54.770 -0.153 1 1 872 . 3 1 1 A 150 150 GLU CB C 150 32.911 33.602 -0.691 1 1 874 . 3 1 1 A 150 150 GLU N N 150 124.471 120.947 3.524 1 1 875 . 3 1 1 A 151 151 TRP H H 151 9.461 9.804 -0.343 1 1 877 . 3 1 1 A 151 151 TRP C C 151 174.370 175.674 -1.304 1 1 878 . 3 1 1 A 151 151 TRP CA C 151 54.113 55.994 -1.881 1 1 879 . 3 1 1 A 151 151 TRP CB C 151 31.688 31.861 -0.173 1 1 880 . 3 1 1 A 151 151 TRP N N 151 129.611 126.356 3.255 1 1 882 . 3 1 1 A 152 152 ALA H H 152 8.771 9.008 -0.237 1 1 883 . 3 1 1 A 152 152 ALA C C 152 175.079 176.805 -1.726 1 1 884 . 3 1 1 A 152 152 ALA CA C 152 51.417 51.459 -0.042 1 1 885 . 3 1 1 A 152 152 ALA CB C 152 17.209 19.709 -2.500 1 1 886 . 3 1 1 A 152 152 ALA N N 152 130.502 127.541 2.961 1 1 887 . 3 1 1 A 153 153 VAL H H 153 7.893 8.782 -0.889 1 1 894 . 3 1 1 A 153 153 VAL C C 153 176.612 176.009 0.603 1 1 895 . 3 1 1 A 153 153 VAL CA C 153 63.600 63.667 -0.067 1 1 896 . 3 1 1 A 153 153 VAL CB C 153 31.280 32.311 -1.031 1 1 899 . 3 1 1 A 153 153 VAL N N 153 124.360 123.152 1.208 1 1 900 . 3 1 1 A 154 154 THR H H 154 7.950 7.591 0.359 1 1 904 . 3 1 1 A 154 154 THR C C 154 173.884 175.084 -1.200 1 1 905 . 3 1 1 A 154 154 THR CA C 154 58.655 61.678 -3.023 1 1 906 . 3 1 1 A 154 154 THR CB C 154 71.262 69.502 1.760 1 1 908 . 3 1 1 A 154 154 THR N N 154 109.176 114.520 -5.344 1 1 909 . 3 1 1 A 155 155 ARG H H 155 8.310 8.558 -0.248 1 1 910 . 3 1 1 A 155 155 ARG C C 155 176.753 176.833 -0.080 1 1 911 . 3 1 1 A 155 155 ARG CA C 155 58.456 58.163 0.293 1 1 912 . 3 1 1 A 155 155 ARG CB C 155 29.043 30.602 -1.559 1 1 915 . 3 1 1 A 155 155 ARG N N 155 116.576 123.051 -6.475 1 1 916 . 3 1 1 A 156 156 ASP H H 156 7.783 8.076 -0.293 1 1 917 . 3 1 1 A 156 156 ASP C C 156 174.222 175.494 -1.272 1 1 918 . 3 1 1 A 156 156 ASP CA C 156 53.540 53.122 0.418 1 1 919 . 3 1 1 A 156 156 ASP CB C 156 42.327 41.201 1.126 1 1 920 . 3 1 1 A 156 156 ASP N N 156 112.950 114.010 -1.060 1 1 921 . 3 1 1 A 157 157 ILE H H 157 7.233 7.587 -0.354 1 1 925 . 3 1 1 A 157 157 ILE C C 157 174.178 175.056 -0.878 1 1 926 . 3 1 1 A 157 157 ILE CA C 157 59.350 61.050 -1.700 1 1 927 . 3 1 1 A 157 157 ILE CB C 157 38.969 39.946 -0.977 1 1 930 . 3 1 1 A 157 157 ILE N N 157 119.732 119.957 -0.225 1 1 931 . 3 1 1 A 158 158 ALA H H 158 8.729 9.105 -0.376 1 1 932 . 3 1 1 A 158 158 ALA C C 158 176.567 175.350 1.217 1 1 933 . 3 1 1 A 158 158 ALA CA C 158 49.418 50.354 -0.936 1 1 934 . 3 1 1 A 158 158 ALA CB C 158 21.430 22.789 -1.359 1 1 935 . 3 1 1 A 158 158 ALA N N 158 128.564 130.300 -1.736 1 1 936 . 3 1 1 A 159 159 THR H H 159 8.972 9.023 -0.051 1 1 940 . 3 1 1 A 159 159 THR C C 159 172.213 172.967 -0.754 1 1 941 . 3 1 1 A 159 159 THR CA C 159 59.504 60.164 -0.660 1 1 942 . 3 1 1 A 159 159 THR CB C 159 70.728 72.087 -1.359 1 1 944 . 3 1 1 A 159 159 THR N N 159 114.901 113.342 1.559 1 1 945 . 3 1 1 A 160 160 ARG H H 160 8.924 9.307 -0.383 1 1 946 . 3 1 1 A 160 160 ARG C C 160 174.097 174.030 0.067 1 1 947 . 3 1 1 A 160 160 ARG CA C 160 53.066 54.395 -1.329 1 1 948 . 3 1 1 A 160 160 ARG CB C 160 32.922 34.174 -1.252 1 1 951 . 3 1 1 A 160 160 ARG N N 160 121.507 125.989 -4.482 1 1 952 . 3 1 1 A 161 161 LEU H H 161 8.611 9.058 -0.447 1 1 959 . 3 1 1 A 161 161 LEU C C 161 174.389 174.842 -0.453 1 1 960 . 3 1 1 A 161 161 LEU CA C 161 53.355 53.350 0.005 1 1 961 . 3 1 1 A 161 161 LEU CB C 161 44.360 45.784 -1.424 1 1 964 . 3 1 1 A 161 161 LEU N N 161 124.711 123.019 1.692 1 1 965 . 3 1 1 A 162 162 GLU H H 162 8.746 8.761 -0.015 1 1 966 . 3 1 1 A 162 162 GLU C C 162 173.376 174.860 -1.484 1 1 967 . 3 1 1 A 162 162 GLU CA C 162 53.904 54.413 -0.509 1 1 968 . 3 1 1 A 162 162 GLU CB C 162 33.773 32.798 0.975 1 1 970 . 3 1 1 A 162 162 GLU N N 162 122.300 125.599 -3.299 1 1 971 . 3 1 1 A 163 163 TYR H H 163 8.872 8.733 0.139 1 1 972 . 3 1 1 A 163 163 TYR C C 163 173.425 175.987 -2.562 1 1 973 . 3 1 1 A 163 163 TYR CA C 163 56.192 56.480 -0.288 1 1 974 . 3 1 1 A 163 163 TYR CB C 163 40.870 42.117 -1.247 1 1 975 . 3 1 1 A 163 163 TYR N N 163 124.618 121.735 2.883 1 1 976 . 3 1 1 A 171 171 ASP C C 171 175.753 174.455 1.298 1 1 977 . 3 1 1 A 171 171 ASP CA C 171 53.517 52.659 0.858 1 1 978 . 3 1 1 A 171 171 ASP CB C 171 41.353 45.239 -3.886 1 1 979 . 3 1 1 A 172 172 ALA H H 172 8.336 8.739 -0.403 1 1 983 . 3 1 1 A 172 172 ALA C C 172 178.110 177.513 0.597 1 1 984 . 3 1 1 A 172 172 ALA CA C 172 52.190 50.606 1.584 1 1 985 . 3 1 1 A 172 172 ALA CB C 172 18.305 20.583 -2.278 1 1 986 . 3 1 1 A 172 172 ALA N N 172 125.294 124.273 1.021 1 1 987 . 3 1 1 A 173 173 GLY H H 173 8.300 8.657 -0.357 1 1 988 . 3 1 1 A 173 173 GLY C C 173 174.437 175.004 -0.567 1 1 989 . 3 1 1 A 173 173 GLY CA C 173 45.083 45.911 -0.828 1 1 990 . 3 1 1 A 173 173 GLY N N 173 107.268 111.927 -4.659 1 1 991 . 3 1 1 A 174 174 THR H H 174 7.754 7.649 0.105 1 1 992 . 3 1 1 A 174 174 THR C C 174 174.738 174.436 0.302 1 1 993 . 3 1 1 A 174 174 THR CA C 174 61.310 62.266 -0.956 1 1 994 . 3 1 1 A 174 174 THR CB C 174 69.310 70.318 -1.008 1 1 996 . 3 1 1 A 174 174 THR N N 174 113.472 107.323 6.149 1 1 997 . 3 1 1 A 175 175 VAL H H 175 7.993 7.652 0.341 1 1 1004 . 3 1 1 A 175 175 VAL C C 175 176.535 174.339 2.196 1 1 1005 . 3 1 1 A 175 175 VAL CA C 175 62.126 60.097 2.029 1 1 1006 . 3 1 1 A 175 175 VAL CB C 175 31.282 34.455 -3.173 1 1 1009 . 3 1 1 A 175 175 VAL N N 175 121.643 119.318 2.325 1 1 1010 . 3 1 1 A 176 176 GLY H H 176 8.056 8.967 -0.911 1 1 1011 . 3 1 1 A 176 176 GLY C C 176 173.930 174.197 -0.267 1 1 1012 . 3 1 1 A 176 176 GLY CA C 176 44.983 47.174 -2.191 1 1 1013 . 3 1 1 A 176 176 GLY N N 176 110.460 113.740 -3.280 1 1 1014 . 3 1 1 A 177 177 THR H H 177 7.520 7.404 0.116 1 1 1015 . 3 1 1 A 177 177 THR C C 177 173.574 173.629 -0.055 1 1 1016 . 3 1 1 A 177 177 THR CA C 177 60.609 60.382 0.227 1 1 1017 . 3 1 1 A 177 177 THR CB C 177 69.506 69.280 0.226 1 1 1019 . 3 1 1 A 177 177 THR N N 177 113.390 113.926 -0.536 1 1 1020 . 3 1 1 A 178 178 ARG H H 178 8.261 8.118 0.143 1 1 1021 . 3 1 1 A 178 178 ARG C C 178 173.932 174.144 -0.212 1 1 1022 . 3 1 1 A 178 178 ARG CA C 178 53.683 54.373 -0.690 1 1 1023 . 3 1 1 A 178 178 ARG CB C 178 29.224 29.345 -0.121 1 1 1026 . 3 1 1 A 178 178 ARG N N 178 123.906 124.082 -0.176 1 1 1027 . 3 1 1 A 183 183 MET C C 183 174.053 174.359 -0.306 1 1 1028 . 3 1 1 A 183 183 MET CA C 183 53.700 54.826 -1.126 1 1 1029 . 3 1 1 A 183 183 MET CB C 183 35.908 36.238 -0.330 1 1 1032 . 3 1 1 A 184 184 LEU H H 184 8.319 8.935 -0.616 1 1 1033 . 3 1 1 A 184 184 LEU C C 184 175.235 175.281 -0.046 1 1 1034 . 3 1 1 A 184 184 LEU CA C 184 53.120 53.572 -0.452 1 1 1035 . 3 1 1 A 184 184 LEU CB C 184 42.857 46.031 -3.174 1 1 1038 . 3 1 1 A 184 184 LEU N N 184 131.293 125.065 6.228 1 1 1039 . 3 1 1 A 185 185 SER H H 185 9.603 8.713 0.890 1 1 1040 . 3 1 1 A 185 185 SER C C 185 171.293 173.012 -1.719 1 1 1041 . 3 1 1 A 185 185 SER CA C 185 56.504 56.849 -0.345 1 1 1042 . 3 1 1 A 185 185 SER CB C 185 66.585 65.910 0.675 1 1 1043 . 3 1 1 A 185 185 SER N N 185 119.338 118.693 0.645 1 1 1044 . 3 1 1 A 186 186 LEU H H 186 8.583 8.627 -0.044 1 1 1051 . 3 1 1 A 186 186 LEU C C 186 175.328 176.228 -0.900 1 1 1052 . 3 1 1 A 186 186 LEU CA C 186 52.729 53.016 -0.287 1 1 1053 . 3 1 1 A 186 186 LEU CB C 186 44.996 45.111 -0.115 1 1 1056 . 3 1 1 A 186 186 LEU N N 186 122.719 124.618 -1.899 1 1 1057 . 3 1 1 A 187 187 GLY H H 187 9.287 8.461 0.826 1 1 1058 . 3 1 1 A 187 187 GLY C C 187 172.315 173.498 -1.183 1 1 1059 . 3 1 1 A 187 187 GLY CA C 187 43.502 45.032 -1.530 1 1 1060 . 3 1 1 A 187 187 GLY N N 187 110.265 110.771 -0.506 1 1 1061 . 3 1 1 A 188 188 VAL H H 188 8.825 8.614 0.211 1 1 1068 . 3 1 1 A 188 188 VAL C C 188 173.125 174.462 -1.337 1 1 1069 . 3 1 1 A 188 188 VAL CA C 188 59.739 59.205 0.534 1 1 1070 . 3 1 1 A 188 188 VAL CB C 188 34.532 34.981 -0.449 1 1 1073 . 3 1 1 A 188 188 VAL N N 188 119.161 116.624 2.537 1 1 1074 . 3 1 1 A 189 189 SER H H 189 9.051 8.608 0.443 1 1 1075 . 3 1 1 A 189 189 SER C C 189 171.698 172.713 -1.015 1 1 1076 . 3 1 1 A 189 189 SER CA C 189 55.997 57.470 -1.473 1 1 1077 . 3 1 1 A 189 189 SER CB C 189 66.094 67.464 -1.370 1 1 1078 . 3 1 1 A 189 189 SER N N 189 117.810 119.102 -1.292 1 1 1079 . 3 1 1 A 190 190 TYR H H 190 9.145 8.951 0.194 1 1 1080 . 3 1 1 A 190 190 TYR C C 190 174.063 172.648 1.415 1 1 1081 . 3 1 1 A 190 190 TYR CA C 190 55.375 55.354 0.021 1 1 1082 . 3 1 1 A 190 190 TYR CB C 190 41.183 42.068 -0.885 1 1 1083 . 3 1 1 A 190 190 TYR N N 190 123.690 118.560 5.130 1 1 1084 . 3 1 1 A 191 191 ARG H H 191 8.211 8.661 -0.450 1 1 1085 . 3 1 1 A 191 191 ARG C C 191 174.826 174.777 0.049 1 1 1086 . 3 1 1 A 191 191 ARG CA C 191 54.464 54.181 0.283 1 1 1087 . 3 1 1 A 191 191 ARG CB C 191 30.507 33.012 -2.505 1 1 1090 . 3 1 1 A 191 191 ARG N N 191 125.366 119.014 6.352 1 1 1091 . 3 1 1 A 192 192 PHE H H 192 8.496 8.656 -0.160 1 1 1092 . 3 1 1 A 192 192 PHE C C 192 176.384 175.916 0.468 1 1 1093 . 3 1 1 A 192 192 PHE CA C 192 57.179 56.880 0.299 1 1 1094 . 3 1 1 A 192 192 PHE CB C 192 39.430 39.343 0.087 1 1 1095 . 3 1 1 A 192 192 PHE N N 192 121.586 121.479 0.107 1 1 1096 . 3 1 1 A 193 193 GLY H H 193 8.643 8.789 -0.146 1 1 1097 . 3 1 1 A 193 193 GLY C C 193 174.466 171.910 2.556 1 1 1098 . 3 1 1 A 193 193 GLY CA C 193 45.126 44.042 1.084 1 1 1099 . 3 1 1 A 193 193 GLY N N 193 109.499 111.518 -2.019 1 1 1100 . 3 1 1 A 194 194 GLN H H 194 8.512 8.553 -0.041 1 1 1101 . 3 1 1 A 194 194 GLN C C 194 176.201 175.248 0.953 1 1 1102 . 3 1 1 A 194 194 GLN CA C 194 55.433 55.585 -0.152 1 1 1103 . 3 1 1 A 194 194 GLN CB C 194 28.729 30.396 -1.667 1 1 1105 . 3 1 1 A 194 194 GLN N N 194 119.448 119.698 -0.250 1 1 1106 . 3 1 1 A 195 195 GLU H H 195 8.530 9.054 -0.524 1 1 1107 . 3 1 1 A 195 195 GLU C C 195 176.151 175.480 0.671 1 1 1108 . 3 1 1 A 195 195 GLU CA C 195 56.256 57.221 -0.965 1 1 1109 . 3 1 1 A 195 195 GLU CB C 195 29.486 32.030 -2.544 1 1 1111 . 3 1 1 A 195 195 GLU N N 195 121.959 122.417 -0.458 1 1 1112 . 3 1 1 A 196 196 ASP H H 196 8.253 8.280 -0.027 1 1 1113 . 3 1 1 A 196 196 ASP C C 196 175.667 174.679 0.988 1 1 1114 . 3 1 1 A 196 196 ASP CA C 196 53.981 52.885 1.096 1 1 1115 . 3 1 1 A 196 196 ASP CB C 196 40.700 41.047 -0.347 1 1 1116 . 3 1 1 A 196 196 ASP N N 196 121.819 119.210 2.609 1 1 1117 . 3 1 1 A 197 197 ALA H H 197 7.999 8.780 -0.781 1 1 1121 . 3 1 1 A 197 197 ALA C C 197 176.847 176.812 0.035 1 1 1122 . 3 1 1 A 197 197 ALA CA C 197 51.612 51.673 -0.061 1 1 1123 . 3 1 1 A 197 197 ALA CB C 197 18.192 18.898 -0.706 1 1 1124 . 3 1 1 A 197 197 ALA N N 197 124.262 128.816 -4.554 1 1 1125 . 3 1 1 A 198 198 ALA H H 198 8.042 8.555 -0.513 1 1 1126 . 3 1 1 A 198 198 ALA C C 198 176.865 176.997 -0.132 1 1 1127 . 3 1 1 A 198 198 ALA CA C 198 49.999 53.371 -3.372 1 1 1128 . 3 1 1 A 198 198 ALA CB C 198 17.327 20.422 -3.095 1 1 1129 . 3 1 1 A 198 198 ALA N N 198 124.724 127.357 -2.633 1 1 1130 . 3 1 1 A 199 199 PRO C C 199 176.727 176.071 0.656 1 1 1131 . 3 1 1 A 199 199 PRO CA C 199 62.399 62.314 0.085 1 1 1132 . 3 1 1 A 199 199 PRO CB C 199 30.949 29.259 1.690 1 1 1135 . 3 1 1 A 200 200 VAL H H 200 8.026 8.804 -0.778 1 1 1142 . 3 1 1 A 200 200 VAL C C 200 176.034 175.287 0.747 1 1 1143 . 3 1 1 A 200 200 VAL CA C 200 61.944 63.154 -1.210 1 1 1144 . 3 1 1 A 200 200 VAL CB C 200 31.734 34.830 -3.096 1 1 1147 . 3 1 1 A 200 200 VAL N N 200 120.635 123.286 -2.651 1 1 1148 . 3 1 1 A 201 201 VAL H H 201 7.966 7.669 0.297 1 1 1155 . 3 1 1 A 201 201 VAL C C 201 175.128 174.095 1.033 1 1 1156 . 3 1 1 A 201 201 VAL CA C 201 61.249 59.356 1.893 1 1 1157 . 3 1 1 A 201 201 VAL CB C 201 31.917 34.893 -2.976 1 1 1160 . 3 1 1 A 201 201 VAL N N 201 124.053 117.694 6.359 1 1 1161 . 3 1 1 A 202 202 ALA H H 202 8.159 8.885 -0.726 1 1 1162 . 3 1 1 A 202 202 ALA C C 202 175.153 175.183 -0.030 1 1 1163 . 3 1 1 A 202 202 ALA CA C 202 49.742 49.119 0.623 1 1 1164 . 3 1 1 A 202 202 ALA CB C 202 17.532 21.805 -4.273 1 1 1165 . 3 1 1 A 202 202 ALA N N 202 129.251 125.410 3.841 1 1 1166 . 3 1 1 A 203 203 PRO C C 203 176.273 176.841 -0.568 1 1 1167 . 3 1 1 A 203 203 PRO CA C 203 62.324 62.354 -0.030 1 1 1168 . 3 1 1 A 203 203 PRO CB C 203 31.042 31.552 -0.510 1 1 1170 . 3 1 1 A 204 204 ALA H H 204 8.137 8.592 -0.455 1 1 1171 . 3 1 1 A 204 204 ALA C C 204 175.697 178.005 -2.308 1 1 1172 . 3 1 1 A 204 204 ALA CA C 204 49.865 55.832 -5.967 1 1 1173 . 3 1 1 A 204 204 ALA CB C 204 17.364 18.709 -1.345 1 1 1174 . 3 1 1 A 204 204 ALA N N 204 125.510 127.740 -2.230 1 1 1175 . 3 1 1 A 205 205 PRO C C 205 175.430 174.617 0.813 1 1 1176 . 3 1 1 A 205 205 PRO CA C 205 62.511 62.727 -0.216 1 1 1177 . 3 1 1 A 205 205 PRO CB C 205 31.056 29.395 1.661 1 1 1179 . 3 1 1 A 206 206 ALA H H 206 7.847 8.030 -0.183 1 1 1180 . 3 1 1 A 206 206 ALA C C 206 175.565 176.807 -1.242 1 1 1181 . 3 1 1 A 206 206 ALA CA C 206 49.487 50.176 -0.689 1 1 1182 . 3 1 1 A 206 206 ALA CB C 206 18.843 21.309 -2.466 1 1 1183 . 3 1 1 A 206 206 ALA N N 206 123.663 123.189 0.474 1 1 1184 . 3 1 1 A 207 207 PRO C C 207 174.397 176.468 -2.071 1 1 1185 . 3 1 1 A 207 207 PRO CA C 207 61.454 65.251 -3.797 1 1 1186 . 3 1 1 A 207 207 PRO CB C 207 31.929 31.849 0.080 1 1 1187 . 3 1 1 A 208 208 ALA H H 208 7.898 7.378 0.520 1 1 1188 . 3 1 1 A 208 208 ALA C C 208 175.411 176.829 -1.418 1 1 1189 . 3 1 1 A 208 208 ALA CA C 208 49.472 49.409 0.063 1 1 1190 . 3 1 1 A 208 208 ALA CB C 208 19.082 21.104 -2.022 1 1 1191 . 3 1 1 A 208 208 ALA N N 208 127.450 116.536 10.914 1 1 1192 . 3 1 1 A 209 209 PRO C C 209 176.932 178.511 -1.579 1 1 1193 . 3 1 1 A 209 209 PRO CA C 209 62.736 65.138 -2.402 1 1 1194 . 3 1 1 A 209 209 PRO CB C 209 31.012 32.119 -1.107 1 1 1 . 4 1 1 A 2 2 ARG C C 2 175.857 176.060 -0.203 1 1 2 . 4 1 1 A 2 2 ARG CA C 2 55.872 53.931 1.941 1 1 3 . 4 1 1 A 2 2 ARG CB C 2 29.983 32.768 -2.785 1 1 5 . 4 1 1 A 3 3 ILE H H 3 8.238 8.416 -0.178 1 1 9 . 4 1 1 A 3 3 ILE C C 3 175.763 175.782 -0.019 1 1 10 . 4 1 1 A 3 3 ILE CA C 3 60.779 61.025 -0.246 1 1 11 . 4 1 1 A 3 3 ILE CB C 3 37.664 36.943 0.721 1 1 15 . 4 1 1 A 3 3 ILE N N 3 122.580 120.138 2.442 1 1 16 . 4 1 1 A 4 4 MET H H 4 8.261 8.539 -0.278 1 1 17 . 4 1 1 A 4 4 MET C C 4 175.660 174.714 0.946 1 1 18 . 4 1 1 A 4 4 MET CA C 4 54.893 54.281 0.612 1 1 19 . 4 1 1 A 4 4 MET CB C 4 32.060 33.366 -1.306 1 1 22 . 4 1 1 A 4 4 MET N N 4 123.988 126.560 -2.572 1 1 23 . 4 1 1 A 5 5 LYS H H 5 8.041 7.789 0.252 1 1 24 . 4 1 1 A 5 5 LYS C C 5 175.850 175.155 0.695 1 1 25 . 4 1 1 A 5 5 LYS CA C 5 56.081 54.212 1.869 1 1 26 . 4 1 1 A 5 5 LYS CB C 5 32.220 35.820 -3.600 1 1 29 . 4 1 1 A 5 5 LYS N N 5 122.015 116.851 5.164 1 1 30 . 4 1 1 A 6 6 ALA H H 6 8.042 8.491 -0.449 1 1 34 . 4 1 1 A 6 6 ALA C C 6 177.160 178.249 -1.089 1 1 35 . 4 1 1 A 6 6 ALA CA C 6 52.109 52.118 -0.009 1 1 36 . 4 1 1 A 6 6 ALA CB C 6 18.637 20.134 -1.497 1 1 37 . 4 1 1 A 6 6 ALA N N 6 123.943 123.074 0.869 1 1 38 . 4 1 1 A 7 7 ILE H H 7 7.916 8.419 -0.503 1 1 42 . 4 1 1 A 7 7 ILE C C 7 175.611 176.252 -0.641 1 1 43 . 4 1 1 A 7 7 ILE CA C 7 61.181 64.155 -2.974 1 1 44 . 4 1 1 A 7 7 ILE CB C 7 37.910 37.680 0.230 1 1 48 . 4 1 1 A 7 7 ILE N N 7 118.380 119.359 -0.979 1 1 49 . 4 1 1 A 8 8 PHE H H 8 8.167 7.924 0.243 1 1 50 . 4 1 1 A 8 8 PHE C C 8 175.363 174.307 1.056 1 1 51 . 4 1 1 A 8 8 PHE CA C 8 57.286 56.535 0.751 1 1 52 . 4 1 1 A 8 8 PHE CB C 8 39.008 42.093 -3.085 1 1 53 . 4 1 1 A 8 8 PHE N N 8 121.971 117.204 4.767 1 1 54 . 4 1 1 A 9 9 VAL H H 9 7.872 9.137 -1.265 1 1 61 . 4 1 1 A 9 9 VAL C C 9 175.405 175.926 -0.521 1 1 62 . 4 1 1 A 9 9 VAL CA C 9 61.662 61.961 -0.299 1 1 63 . 4 1 1 A 9 9 VAL CB C 9 32.026 30.165 1.861 1 1 66 . 4 1 1 A 9 9 VAL N N 9 120.864 122.662 -1.798 1 1 67 . 4 1 1 A 10 10 LEU H H 10 8.077 8.364 -0.287 1 1 74 . 4 1 1 A 10 10 LEU C C 10 176.652 177.532 -0.880 1 1 75 . 4 1 1 A 10 10 LEU CA C 10 54.856 53.929 0.927 1 1 76 . 4 1 1 A 10 10 LEU CB C 10 41.401 42.303 -0.902 1 1 80 . 4 1 1 A 10 10 LEU N N 10 124.826 121.374 3.452 1 1 81 . 4 1 1 A 11 11 ASN H H 11 8.177 8.428 -0.251 1 1 82 . 4 1 1 A 11 11 ASN C C 11 174.394 174.942 -0.548 1 1 83 . 4 1 1 A 11 11 ASN CA C 11 52.704 55.323 -2.619 1 1 84 . 4 1 1 A 11 11 ASN CB C 11 38.468 39.146 -0.678 1 1 85 . 4 1 1 A 11 11 ASN N N 11 119.029 117.680 1.349 1 1 86 . 4 1 1 A 12 12 ALA H H 12 7.991 7.486 0.505 1 1 90 . 4 1 1 A 12 12 ALA C C 12 176.649 174.906 1.743 1 1 91 . 4 1 1 A 12 12 ALA CA C 12 51.950 51.529 0.421 1 1 92 . 4 1 1 A 12 12 ALA CB C 12 18.659 21.203 -2.544 1 1 93 . 4 1 1 A 12 12 ALA N N 12 123.695 116.999 6.696 1 1 94 . 4 1 1 A 13 13 ALA H H 13 8.083 8.520 -0.437 1 1 95 . 4 1 1 A 13 13 ALA C C 13 175.395 175.921 -0.526 1 1 96 . 4 1 1 A 13 13 ALA CA C 13 49.797 49.532 0.265 1 1 97 . 4 1 1 A 13 13 ALA CB C 13 17.486 19.278 -1.792 1 1 98 . 4 1 1 A 13 13 ALA N N 13 124.281 121.314 2.967 1 1 99 . 4 1 1 A 14 14 PRO C C 14 176.641 176.601 0.040 1 1 100 . 4 1 1 A 14 14 PRO CA C 14 62.675 64.930 -2.255 1 1 101 . 4 1 1 A 14 14 PRO CB C 14 31.000 31.849 -0.849 1 1 103 . 4 1 1 A 15 15 LYS H H 15 8.283 8.395 -0.112 1 1 104 . 4 1 1 A 15 15 LYS C C 15 175.683 175.522 0.161 1 1 105 . 4 1 1 A 15 15 LYS CA C 15 55.429 55.550 -0.121 1 1 106 . 4 1 1 A 15 15 LYS CB C 15 32.246 33.037 -0.791 1 1 109 . 4 1 1 A 15 15 LYS N N 15 119.069 113.380 5.689 1 1 110 . 4 1 1 A 16 16 ASP H H 16 7.880 8.743 -0.863 1 1 111 . 4 1 1 A 16 16 ASP C C 16 175.419 175.961 -0.542 1 1 112 . 4 1 1 A 16 16 ASP CA C 16 54.413 53.627 0.786 1 1 113 . 4 1 1 A 16 16 ASP CB C 16 40.224 42.301 -2.077 1 1 114 . 4 1 1 A 16 16 ASP N N 16 119.625 125.992 -6.367 1 1 115 . 4 1 1 A 17 17 ASN H H 17 7.973 8.519 -0.546 1 1 116 . 4 1 1 A 17 17 ASN C C 17 174.231 174.356 -0.125 1 1 117 . 4 1 1 A 17 17 ASN CA C 17 53.948 52.517 1.431 1 1 118 . 4 1 1 A 17 17 ASN CB C 17 37.009 39.206 -2.197 1 1 119 . 4 1 1 A 17 17 ASN N N 17 118.063 119.574 -1.511 1 1 120 . 4 1 1 A 18 18 THR H H 18 7.318 8.229 -0.911 1 1 121 . 4 1 1 A 18 18 THR C C 18 172.323 173.108 -0.785 1 1 122 . 4 1 1 A 18 18 THR CA C 18 60.153 60.555 -0.402 1 1 123 . 4 1 1 A 18 18 THR CB C 18 71.534 71.638 -0.104 1 1 125 . 4 1 1 A 18 18 THR N N 18 109.092 116.662 -7.570 1 1 126 . 4 1 1 A 19 19 TRP H H 19 8.541 8.611 -0.070 1 1 127 . 4 1 1 A 19 19 TRP C C 19 175.969 175.027 0.942 1 1 128 . 4 1 1 A 19 19 TRP CA C 19 55.700 55.882 -0.182 1 1 129 . 4 1 1 A 19 19 TRP CB C 19 31.471 33.319 -1.848 1 1 130 . 4 1 1 A 19 19 TRP N N 19 121.992 125.414 -3.422 1 1 131 . 4 1 1 A 20 20 TYR H H 20 8.691 8.675 0.016 1 1 132 . 4 1 1 A 20 20 TYR C C 20 173.684 172.618 1.066 1 1 133 . 4 1 1 A 20 20 TYR CA C 20 55.805 56.149 -0.344 1 1 134 . 4 1 1 A 20 20 TYR CB C 20 40.513 41.105 -0.592 1 1 135 . 4 1 1 A 20 20 TYR N N 20 116.519 118.757 -2.238 1 1 136 . 4 1 1 A 21 21 ALA H H 21 8.876 8.343 0.533 1 1 137 . 4 1 1 A 21 21 ALA C C 21 175.395 176.325 -0.930 1 1 138 . 4 1 1 A 21 21 ALA CA C 21 50.970 50.963 0.007 1 1 139 . 4 1 1 A 21 21 ALA CB C 21 22.142 23.615 -1.473 1 1 140 . 4 1 1 A 21 21 ALA N N 21 119.359 121.824 -2.465 1 1 141 . 4 1 1 A 22 22 GLY H H 22 8.613 7.994 0.619 1 1 142 . 4 1 1 A 22 22 GLY C C 22 171.458 172.040 -0.582 1 1 143 . 4 1 1 A 22 22 GLY CA C 22 45.608 45.948 -0.340 1 1 144 . 4 1 1 A 22 22 GLY N N 22 106.678 105.539 1.139 1 1 145 . 4 1 1 A 23 23 GLY H H 23 7.911 8.402 -0.491 1 1 146 . 4 1 1 A 23 23 GLY C C 23 170.563 172.622 -2.059 1 1 147 . 4 1 1 A 23 23 GLY CA C 23 44.026 44.852 -0.826 1 1 148 . 4 1 1 A 23 23 GLY N N 23 103.399 108.886 -5.487 1 1 149 . 4 1 1 A 24 24 LYS H H 24 9.001 9.439 -0.438 1 1 150 . 4 1 1 A 24 24 LYS C C 24 172.965 174.176 -1.211 1 1 151 . 4 1 1 A 24 24 LYS CA C 24 54.062 54.268 -0.206 1 1 152 . 4 1 1 A 24 24 LYS CB C 24 36.774 36.305 0.469 1 1 156 . 4 1 1 A 24 24 LYS N N 24 116.402 119.610 -3.208 1 1 157 . 4 1 1 A 25 25 LEU H H 25 8.587 9.211 -0.624 1 1 164 . 4 1 1 A 25 25 LEU C C 25 175.205 174.947 0.258 1 1 165 . 4 1 1 A 25 25 LEU CA C 25 53.446 53.010 0.436 1 1 166 . 4 1 1 A 25 25 LEU CB C 25 46.287 46.400 -0.113 1 1 170 . 4 1 1 A 25 25 LEU N N 25 119.932 122.470 -2.538 1 1 171 . 4 1 1 A 26 26 GLY H H 26 8.637 8.051 0.586 1 1 172 . 4 1 1 A 26 26 GLY C C 26 170.804 171.649 -0.845 1 1 173 . 4 1 1 A 26 26 GLY CA C 26 45.669 44.941 0.728 1 1 174 . 4 1 1 A 26 26 GLY N N 26 108.136 110.245 -2.109 1 1 175 . 4 1 1 A 27 27 TRP H H 27 8.642 8.518 0.124 1 1 177 . 4 1 1 A 27 27 TRP C C 27 174.820 175.220 -0.400 1 1 178 . 4 1 1 A 27 27 TRP CB C 27 30.883 32.572 -1.689 1 1 179 . 4 1 1 A 27 27 TRP N N 27 120.887 120.667 0.220 1 1 181 . 4 1 1 A 32 32 ASP C C 32 176.315 175.178 1.137 1 1 182 . 4 1 1 A 32 32 ASP CA C 32 53.737 53.396 0.341 1 1 183 . 4 1 1 A 32 32 ASP CB C 32 41.230 41.997 -0.767 1 1 184 . 4 1 1 A 33 33 THR H H 33 8.190 7.558 0.632 1 1 188 . 4 1 1 A 33 33 THR C C 33 175.291 175.266 0.025 1 1 189 . 4 1 1 A 33 33 THR CA C 33 61.909 62.303 -0.394 1 1 190 . 4 1 1 A 33 33 THR CB C 33 68.961 70.233 -1.272 1 1 192 . 4 1 1 A 33 33 THR N N 33 114.235 115.328 -1.093 1 1 193 . 4 1 1 A 34 34 GLY H H 34 8.341 8.334 0.007 1 1 194 . 4 1 1 A 34 34 GLY C C 34 173.766 173.186 0.580 1 1 195 . 4 1 1 A 34 34 GLY CA C 34 44.941 45.765 -0.824 1 1 196 . 4 1 1 A 34 34 GLY N N 34 110.678 112.404 -1.726 1 1 197 . 4 1 1 A 35 35 PHE H H 35 7.945 8.536 -0.591 1 1 198 . 4 1 1 A 35 35 PHE C C 35 175.411 174.959 0.452 1 1 199 . 4 1 1 A 35 35 PHE CA C 35 57.921 56.928 0.993 1 1 200 . 4 1 1 A 35 35 PHE CB C 35 38.806 43.270 -4.464 1 1 201 . 4 1 1 A 35 35 PHE N N 35 120.533 121.738 -1.205 1 1 202 . 4 1 1 A 36 36 TYR H H 36 7.967 9.285 -1.318 1 1 203 . 4 1 1 A 36 36 TYR C C 36 176.104 175.830 0.274 1 1 204 . 4 1 1 A 36 36 TYR CA C 36 57.568 58.373 -0.805 1 1 205 . 4 1 1 A 36 36 TYR CB C 36 37.727 39.491 -1.764 1 1 206 . 4 1 1 A 36 36 TYR N N 36 120.254 119.952 0.302 1 1 207 . 4 1 1 A 37 37 GLY H H 37 7.666 8.704 -1.038 1 1 208 . 4 1 1 A 37 37 GLY C C 37 173.794 171.800 1.994 1 1 209 . 4 1 1 A 37 37 GLY CA C 37 45.007 45.291 -0.284 1 1 210 . 4 1 1 A 37 37 GLY N N 37 108.995 108.725 0.270 1 1 211 . 4 1 1 A 38 38 ASN H H 38 8.109 8.688 -0.579 1 1 212 . 4 1 1 A 38 38 ASN C C 38 175.612 174.954 0.658 1 1 213 . 4 1 1 A 38 38 ASN CA C 38 52.954 52.013 0.941 1 1 214 . 4 1 1 A 38 38 ASN CB C 38 38.425 39.523 -1.098 1 1 215 . 4 1 1 A 38 38 ASN N N 38 118.603 122.692 -4.089 1 1 216 . 4 1 1 A 39 39 GLY H H 39 8.202 8.352 -0.150 1 1 217 . 4 1 1 A 39 39 GLY C C 39 173.958 171.815 2.143 1 1 218 . 4 1 1 A 39 39 GLY CA C 39 45.012 46.010 -0.998 1 1 219 . 4 1 1 A 39 39 GLY N N 39 108.897 110.385 -1.488 1 1 220 . 4 1 1 A 40 40 PHE H H 40 7.960 8.484 -0.524 1 1 221 . 4 1 1 A 40 40 PHE C C 40 175.653 174.844 0.809 1 1 222 . 4 1 1 A 40 40 PHE CA C 40 57.556 57.934 -0.378 1 1 223 . 4 1 1 A 40 40 PHE CB C 40 38.513 41.296 -2.783 1 1 224 . 4 1 1 A 40 40 PHE N N 40 119.829 120.214 -0.385 1 1 225 . 4 1 1 A 41 41 GLN H H 41 8.173 9.006 -0.833 1 1 226 . 4 1 1 A 41 41 GLN C C 41 175.234 174.338 0.896 1 1 227 . 4 1 1 A 41 41 GLN CA C 41 55.488 53.707 1.781 1 1 228 . 4 1 1 A 41 41 GLN CB C 41 28.523 31.666 -3.143 1 1 230 . 4 1 1 A 41 41 GLN N N 41 120.810 120.268 0.542 1 1 231 . 4 1 1 A 42 42 ASN H H 42 8.193 8.675 -0.482 1 1 232 . 4 1 1 A 42 42 ASN C C 42 174.618 174.828 -0.210 1 1 233 . 4 1 1 A 42 42 ASN CA C 42 52.924 52.983 -0.059 1 1 234 . 4 1 1 A 42 42 ASN CB C 42 38.333 39.505 -1.172 1 1 235 . 4 1 1 A 42 42 ASN N N 42 119.679 119.643 0.036 1 1 236 . 4 1 1 A 43 43 ASN H H 43 8.255 8.978 -0.723 1 1 237 . 4 1 1 A 43 43 ASN C C 43 173.873 174.570 -0.697 1 1 238 . 4 1 1 A 43 43 ASN CA C 43 52.919 54.095 -1.176 1 1 239 . 4 1 1 A 43 43 ASN CB C 43 38.580 41.611 -3.031 1 1 240 . 4 1 1 A 43 43 ASN N N 43 119.773 122.975 -3.202 1 1 241 . 4 1 1 A 44 44 ASN H H 44 7.865 7.973 -0.108 1 1 242 . 4 1 1 A 44 44 ASN C C 44 175.518 174.417 1.101 1 1 243 . 4 1 1 A 44 44 ASN CA C 44 54.528 52.163 2.365 1 1 244 . 4 1 1 A 44 44 ASN CB C 44 40.170 39.374 0.796 1 1 246 . 4 1 1 A 44 44 ASN N N 44 124.152 116.941 7.211 1 1 247 . 4 1 1 A 46 46 PRO C C 46 177.228 177.602 -0.374 1 1 248 . 4 1 1 A 46 46 PRO CA C 46 62.794 64.883 -2.089 1 1 249 . 4 1 1 A 46 46 PRO CB C 46 31.283 32.042 -0.759 1 1 251 . 4 1 1 A 47 47 THR H H 47 8.165 7.596 0.569 1 1 255 . 4 1 1 A 47 47 THR C C 47 174.573 175.243 -0.670 1 1 256 . 4 1 1 A 47 47 THR CA C 47 61.346 65.039 -3.693 1 1 257 . 4 1 1 A 47 47 THR CB C 47 69.573 68.995 0.578 1 1 259 . 4 1 1 A 47 47 THR N N 47 114.265 110.826 3.439 1 1 260 . 4 1 1 A 48 48 ARG H H 48 8.237 7.904 0.333 1 1 261 . 4 1 1 A 48 48 ARG C C 48 175.898 175.685 0.213 1 1 262 . 4 1 1 A 48 48 ARG CA C 48 55.717 56.426 -0.709 1 1 263 . 4 1 1 A 48 48 ARG CB C 48 30.151 31.020 -0.869 1 1 266 . 4 1 1 A 48 48 ARG N N 48 122.795 121.691 1.104 1 1 267 . 4 1 1 A 49 49 ASN H H 49 8.369 8.771 -0.402 1 1 268 . 4 1 1 A 49 49 ASN C C 49 174.560 173.705 0.855 1 1 269 . 4 1 1 A 49 49 ASN CA C 49 53.005 51.832 1.173 1 1 270 . 4 1 1 A 49 49 ASN CB C 49 38.761 41.569 -2.808 1 1 271 . 4 1 1 A 49 49 ASN N N 49 119.837 123.022 -3.185 1 1 272 . 4 1 1 A 50 50 ASP H H 50 8.192 8.877 -0.685 1 1 273 . 4 1 1 A 50 50 ASP C C 50 175.699 175.621 0.078 1 1 274 . 4 1 1 A 50 50 ASP CA C 50 54.289 53.894 0.395 1 1 275 . 4 1 1 A 50 50 ASP CB C 50 41.264 41.700 -0.436 1 1 276 . 4 1 1 A 50 50 ASP N N 50 120.403 124.420 -4.017 1 1 277 . 4 1 1 A 51 51 GLN H H 51 8.428 8.615 -0.187 1 1 278 . 4 1 1 A 51 51 GLN C C 51 175.186 175.131 0.055 1 1 279 . 4 1 1 A 51 51 GLN CA C 51 54.512 54.503 0.009 1 1 280 . 4 1 1 A 51 51 GLN CB C 51 30.424 28.929 1.495 1 1 282 . 4 1 1 A 51 51 GLN N N 51 118.959 123.771 -4.812 1 1 289 . 4 1 1 A 52 52 LEU C C 52 176.018 175.658 0.360 1 1 290 . 4 1 1 A 52 52 LEU CA C 52 54.332 52.718 1.614 1 1 291 . 4 1 1 A 52 52 LEU CB C 52 43.022 43.972 -0.950 1 1 294 . 4 1 1 A 53 53 GLY H H 53 8.639 8.410 0.229 1 1 295 . 4 1 1 A 53 53 GLY C C 53 171.931 171.567 0.364 1 1 296 . 4 1 1 A 53 53 GLY CA C 53 43.501 44.313 -0.812 1 1 297 . 4 1 1 A 53 53 GLY N N 53 109.964 108.137 1.827 1 1 298 . 4 1 1 A 54 54 ALA H H 54 8.881 8.166 0.715 1 1 299 . 4 1 1 A 54 54 ALA C C 54 175.543 175.417 0.126 1 1 300 . 4 1 1 A 54 54 ALA CA C 54 50.710 50.007 0.703 1 1 301 . 4 1 1 A 54 54 ALA CB C 54 22.914 22.021 0.893 1 1 302 . 4 1 1 A 54 54 ALA N N 54 120.413 122.668 -2.255 1 1 303 . 4 1 1 A 55 55 GLY H H 55 8.346 8.304 0.042 1 1 304 . 4 1 1 A 55 55 GLY C C 55 170.960 171.972 -1.012 1 1 305 . 4 1 1 A 55 55 GLY CA C 55 46.704 45.218 1.486 1 1 306 . 4 1 1 A 55 55 GLY N N 55 104.688 106.841 -2.153 1 1 307 . 4 1 1 A 56 56 ALA H H 56 9.116 8.867 0.249 1 1 308 . 4 1 1 A 56 56 ALA C C 56 176.472 176.941 -0.469 1 1 309 . 4 1 1 A 56 56 ALA CA C 56 49.638 50.902 -1.264 1 1 310 . 4 1 1 A 56 56 ALA CB C 56 22.275 21.473 0.802 1 1 311 . 4 1 1 A 56 56 ALA N N 56 120.608 123.730 -3.122 1 1 312 . 4 1 1 A 57 57 PHE H H 57 8.688 8.847 -0.159 1 1 313 . 4 1 1 A 57 57 PHE C C 57 172.816 173.859 -1.043 1 1 314 . 4 1 1 A 57 57 PHE CA C 57 56.066 54.867 1.199 1 1 315 . 4 1 1 A 57 57 PHE CB C 57 41.770 42.580 -0.810 1 1 316 . 4 1 1 A 57 57 PHE N N 57 120.027 118.929 1.098 1 1 317 . 4 1 1 A 58 58 GLY H H 58 9.034 9.008 0.026 1 1 318 . 4 1 1 A 58 58 GLY C C 58 170.860 171.999 -1.139 1 1 319 . 4 1 1 A 58 58 GLY CA C 58 44.954 44.578 0.376 1 1 320 . 4 1 1 A 58 58 GLY N N 58 105.817 107.453 -1.636 1 1 321 . 4 1 1 A 59 59 GLY H H 59 8.382 8.905 -0.523 1 1 322 . 4 1 1 A 59 59 GLY C C 59 169.284 171.241 -1.957 1 1 323 . 4 1 1 A 59 59 GLY CA C 59 45.840 43.779 2.061 1 1 324 . 4 1 1 A 59 59 GLY N N 59 109.059 112.701 -3.642 1 1 325 . 4 1 1 A 60 60 TYR H H 60 8.430 8.800 -0.370 1 1 326 . 4 1 1 A 60 60 TYR C C 60 173.453 174.452 -0.999 1 1 327 . 4 1 1 A 60 60 TYR CA C 60 55.282 56.528 -1.246 1 1 328 . 4 1 1 A 60 60 TYR CB C 60 41.712 40.914 0.798 1 1 329 . 4 1 1 A 60 60 TYR N N 60 118.352 122.233 -3.881 1 1 330 . 4 1 1 A 61 61 GLN H H 61 8.833 9.448 -0.615 1 1 331 . 4 1 1 A 61 61 GLN C C 61 174.365 175.297 -0.932 1 1 332 . 4 1 1 A 61 61 GLN CA C 61 54.125 56.100 -1.975 1 1 333 . 4 1 1 A 61 61 GLN CB C 61 28.033 28.975 -0.942 1 1 335 . 4 1 1 A 61 61 GLN N N 61 129.628 124.841 4.787 1 1 336 . 4 1 1 A 62 62 VAL H H 62 8.714 8.754 -0.040 1 1 343 . 4 1 1 A 62 62 VAL C C 62 175.758 175.543 0.215 1 1 344 . 4 1 1 A 62 62 VAL CA C 62 64.649 63.323 1.326 1 1 345 . 4 1 1 A 62 62 VAL CB C 62 31.900 34.814 -2.914 1 1 348 . 4 1 1 A 62 62 VAL N N 62 127.666 125.041 2.625 1 1 349 . 4 1 1 A 63 63 ASN H H 63 8.062 7.938 0.124 1 1 350 . 4 1 1 A 63 63 ASN C C 63 172.827 173.547 -0.720 1 1 351 . 4 1 1 A 63 63 ASN CA C 63 51.575 51.937 -0.362 1 1 352 . 4 1 1 A 63 63 ASN CB C 63 37.194 37.815 -0.621 1 1 353 . 4 1 1 A 63 63 ASN N N 63 116.310 118.138 -1.828 1 1 354 . 4 1 1 A 64 64 PRO C C 64 175.071 177.118 -2.047 1 1 355 . 4 1 1 A 64 64 PRO CA C 64 65.296 63.742 1.554 1 1 356 . 4 1 1 A 64 64 PRO CB C 64 30.428 31.272 -0.844 1 1 357 . 4 1 1 A 65 65 TYR H H 65 7.873 8.852 -0.979 1 1 358 . 4 1 1 A 65 65 TYR C C 65 175.145 174.592 0.553 1 1 359 . 4 1 1 A 65 65 TYR CA C 65 56.125 58.983 -2.858 1 1 360 . 4 1 1 A 65 65 TYR CB C 65 39.189 36.522 2.667 1 1 361 . 4 1 1 A 65 65 TYR N N 65 112.894 122.171 -9.277 1 1 362 . 4 1 1 A 66 66 LEU H H 66 7.308 7.391 -0.083 1 1 369 . 4 1 1 A 66 66 LEU C C 66 173.866 175.143 -1.277 1 1 370 . 4 1 1 A 66 66 LEU CA C 66 53.431 53.788 -0.357 1 1 371 . 4 1 1 A 66 66 LEU CB C 66 44.958 44.687 0.271 1 1 375 . 4 1 1 A 66 66 LEU N N 66 120.270 116.234 4.036 1 1 376 . 4 1 1 A 67 67 GLY H H 67 8.855 9.183 -0.328 1 1 377 . 4 1 1 A 67 67 GLY C C 67 170.698 172.954 -2.256 1 1 378 . 4 1 1 A 67 67 GLY CA C 67 44.008 44.183 -0.175 1 1 379 . 4 1 1 A 67 67 GLY N N 67 114.388 109.220 5.168 1 1 380 . 4 1 1 A 68 68 PHE H H 68 8.770 9.136 -0.366 1 1 381 . 4 1 1 A 68 68 PHE C C 68 173.386 174.882 -1.496 1 1 382 . 4 1 1 A 68 68 PHE CA C 68 56.507 57.914 -1.407 1 1 383 . 4 1 1 A 68 68 PHE CB C 68 42.428 40.852 1.576 1 1 384 . 4 1 1 A 68 68 PHE N N 68 117.510 119.175 -1.665 1 1 385 . 4 1 1 A 69 69 GLU H H 69 9.079 9.706 -0.627 1 1 386 . 4 1 1 A 69 69 GLU C C 69 174.556 174.877 -0.321 1 1 387 . 4 1 1 A 69 69 GLU CA C 69 54.939 54.987 -0.048 1 1 388 . 4 1 1 A 69 69 GLU CB C 69 33.963 32.402 1.561 1 1 390 . 4 1 1 A 69 69 GLU N N 69 120.562 122.267 -1.705 1 1 391 . 4 1 1 A 70 70 MET H H 70 9.481 9.108 0.373 1 1 392 . 4 1 1 A 70 70 MET C C 70 174.595 176.151 -1.556 1 1 393 . 4 1 1 A 70 70 MET CA C 70 53.091 54.188 -1.097 1 1 394 . 4 1 1 A 70 70 MET CB C 70 36.159 33.406 2.753 1 1 397 . 4 1 1 A 70 70 MET N N 70 124.928 127.055 -2.127 1 1 398 . 4 1 1 A 71 71 GLY H H 71 8.845 9.022 -0.177 1 1 399 . 4 1 1 A 71 71 GLY C C 71 170.811 171.396 -0.585 1 1 400 . 4 1 1 A 71 71 GLY CA C 71 44.624 43.999 0.625 1 1 401 . 4 1 1 A 71 71 GLY N N 71 108.896 113.013 -4.117 1 1 402 . 4 1 1 A 72 72 TYR H H 72 8.925 9.312 -0.387 1 1 403 . 4 1 1 A 72 72 TYR C C 72 173.278 174.262 -0.984 1 1 404 . 4 1 1 A 72 72 TYR CA C 72 55.912 56.533 -0.621 1 1 405 . 4 1 1 A 72 72 TYR CB C 72 41.611 40.697 0.914 1 1 406 . 4 1 1 A 72 72 TYR N N 72 123.253 121.865 1.388 1 1 407 . 4 1 1 A 73 73 ASP H H 73 8.665 9.425 -0.760 1 1 408 . 4 1 1 A 73 73 ASP C C 73 173.598 175.829 -2.231 1 1 409 . 4 1 1 A 73 73 ASP CA C 73 52.857 53.719 -0.862 1 1 410 . 4 1 1 A 73 73 ASP CB C 73 42.774 42.678 0.096 1 1 411 . 4 1 1 A 73 73 ASP N N 73 126.178 124.874 1.304 1 1 412 . 4 1 1 A 74 74 TRP H H 74 9.080 9.063 0.017 1 1 413 . 4 1 1 A 74 74 TRP C C 74 174.868 173.772 1.096 1 1 414 . 4 1 1 A 74 74 TRP CB C 74 30.083 33.000 -2.917 1 1 415 . 4 1 1 A 74 74 TRP N N 74 121.824 122.926 -1.102 1 1 416 . 4 1 1 A 78 78 MET C C 78 174.548 174.762 -0.214 1 1 417 . 4 1 1 A 78 78 MET CA C 78 54.388 54.273 0.115 1 1 418 . 4 1 1 A 78 78 MET CB C 78 32.542 37.208 -4.666 1 1 419 . 4 1 1 A 79 79 ALA H H 79 8.105 8.747 -0.642 1 1 420 . 4 1 1 A 79 79 ALA C C 79 176.629 176.456 0.173 1 1 421 . 4 1 1 A 79 79 ALA CA C 79 51.210 53.519 -2.309 1 1 422 . 4 1 1 A 79 79 ALA CB C 79 19.106 20.467 -1.361 1 1 423 . 4 1 1 A 79 79 ALA N N 79 125.778 121.102 4.676 1 1 424 . 4 1 1 A 80 80 TYR H H 80 8.035 7.751 0.284 1 1 425 . 4 1 1 A 80 80 TYR C C 80 175.604 175.838 -0.234 1 1 426 . 4 1 1 A 80 80 TYR CA C 80 57.021 57.181 -0.160 1 1 427 . 4 1 1 A 80 80 TYR CB C 80 38.416 39.017 -0.601 1 1 428 . 4 1 1 A 80 80 TYR N N 80 120.045 116.710 3.335 1 1 429 . 4 1 1 A 81 81 LYS H H 81 8.295 7.777 0.518 1 1 430 . 4 1 1 A 81 81 LYS C C 81 176.647 175.942 0.705 1 1 431 . 4 1 1 A 81 81 LYS CA C 81 56.285 55.909 0.376 1 1 432 . 4 1 1 A 81 81 LYS CB C 81 31.571 32.421 -0.850 1 1 434 . 4 1 1 A 81 81 LYS N N 81 123.191 121.262 1.929 1 1 435 . 4 1 1 A 82 82 GLY H H 82 8.117 8.346 -0.229 1 1 436 . 4 1 1 A 82 82 GLY C C 82 174.010 174.600 -0.590 1 1 437 . 4 1 1 A 82 82 GLY CA C 82 44.982 44.608 0.374 1 1 438 . 4 1 1 A 82 82 GLY N N 82 110.014 108.993 1.021 1 1 439 . 4 1 1 A 83 83 SER H H 83 7.938 8.774 -0.836 1 1 440 . 4 1 1 A 83 83 SER C C 83 174.634 176.286 -1.652 1 1 441 . 4 1 1 A 83 83 SER CA C 83 57.685 60.046 -2.361 1 1 442 . 4 1 1 A 83 83 SER CB C 83 63.303 64.048 -0.745 1 1 443 . 4 1 1 A 83 83 SER N N 83 115.655 116.600 -0.945 1 1 444 . 4 1 1 A 84 84 VAL H H 84 8.008 7.630 0.378 1 1 451 . 4 1 1 A 84 84 VAL C C 84 175.525 175.537 -0.012 1 1 452 . 4 1 1 A 84 84 VAL CA C 84 61.769 63.599 -1.830 1 1 453 . 4 1 1 A 84 84 VAL CB C 84 31.711 32.749 -1.038 1 1 456 . 4 1 1 A 84 84 VAL N N 84 120.054 119.941 0.113 1 1 457 . 4 1 1 A 85 85 ASP H H 85 8.140 7.652 0.488 1 1 458 . 4 1 1 A 85 85 ASP C C 85 174.740 175.714 -0.974 1 1 459 . 4 1 1 A 85 85 ASP CA C 85 53.983 52.774 1.209 1 1 460 . 4 1 1 A 85 85 ASP CB C 85 40.633 44.201 -3.568 1 1 461 . 4 1 1 A 85 85 ASP N N 85 122.510 118.788 3.722 1 1 462 . 4 1 1 A 86 86 ASN H H 86 7.736 9.045 -1.309 1 1 463 . 4 1 1 A 86 86 ASN C C 86 175.970 176.300 -0.330 1 1 464 . 4 1 1 A 86 86 ASN CA C 86 54.349 54.471 -0.122 1 1 465 . 4 1 1 A 86 86 ASN CB C 86 40.490 39.111 1.379 1 1 467 . 4 1 1 A 86 86 ASN N N 86 124.290 119.930 4.360 1 1 468 . 4 1 1 A 87 87 GLY H H 87 8.000 7.766 0.234 1 1 469 . 4 1 1 A 87 87 GLY C C 87 173.456 174.570 -1.114 1 1 470 . 4 1 1 A 87 87 GLY CA C 87 44.973 44.689 0.284 1 1 471 . 4 1 1 A 87 87 GLY N N 87 113.494 105.834 7.660 1 1 472 . 4 1 1 A 88 88 ALA H H 88 8.024 8.489 -0.465 1 1 473 . 4 1 1 A 88 88 ALA C C 88 176.833 178.794 -1.961 1 1 474 . 4 1 1 A 88 88 ALA CA C 88 51.734 52.887 -1.153 1 1 475 . 4 1 1 A 88 88 ALA CB C 88 19.818 20.160 -0.342 1 1 476 . 4 1 1 A 88 88 ALA N N 88 122.676 123.630 -0.954 1 1 477 . 4 1 1 A 91 91 ALA C C 91 174.781 175.154 -0.373 1 1 478 . 4 1 1 A 91 91 ALA CA C 91 50.537 51.808 -1.271 1 1 479 . 4 1 1 A 91 91 ALA CB C 91 21.324 21.899 -0.575 1 1 480 . 4 1 1 A 92 92 GLN H H 92 8.451 8.133 0.318 1 1 481 . 4 1 1 A 92 92 GLN C C 92 173.557 173.857 -0.300 1 1 482 . 4 1 1 A 92 92 GLN CA C 92 53.380 53.780 -0.400 1 1 484 . 4 1 1 A 92 92 GLN N N 92 116.847 116.665 0.182 1 1 485 . 4 1 1 A 93 93 GLY C C 93 170.631 172.503 -1.872 1 1 486 . 4 1 1 A 93 93 GLY CA C 93 45.718 43.876 1.842 1 1 487 . 4 1 1 A 94 94 VAL H H 94 8.686 8.960 -0.274 1 1 494 . 4 1 1 A 94 94 VAL C C 94 173.698 174.220 -0.522 1 1 495 . 4 1 1 A 94 94 VAL CA C 94 58.997 60.127 -1.130 1 1 496 . 4 1 1 A 94 94 VAL CB C 94 33.311 34.045 -0.734 1 1 499 . 4 1 1 A 94 94 VAL N N 94 118.489 120.909 -2.420 1 1 500 . 4 1 1 A 95 95 GLN H H 95 9.468 9.528 -0.060 1 1 501 . 4 1 1 A 95 95 GLN C C 95 174.028 173.930 0.098 1 1 502 . 4 1 1 A 95 95 GLN CA C 95 52.547 54.289 -1.742 1 1 503 . 4 1 1 A 95 95 GLN CB C 95 33.816 31.528 2.288 1 1 505 . 4 1 1 A 95 95 GLN N N 95 122.106 126.385 -4.279 1 1 506 . 4 1 1 A 96 96 LEU H H 96 8.484 9.094 -0.610 1 1 513 . 4 1 1 A 96 96 LEU C C 96 175.322 175.437 -0.115 1 1 514 . 4 1 1 A 96 96 LEU CA C 96 53.736 53.985 -0.249 1 1 515 . 4 1 1 A 96 96 LEU CB C 96 41.088 44.786 -3.698 1 1 519 . 4 1 1 A 96 96 LEU N N 96 123.224 125.829 -2.605 1 1 520 . 4 1 1 A 97 97 THR H H 97 9.116 9.062 0.054 1 1 521 . 4 1 1 A 97 97 THR C C 97 173.251 172.343 0.908 1 1 522 . 4 1 1 A 97 97 THR CA C 97 58.931 59.722 -0.791 1 1 523 . 4 1 1 A 97 97 THR CB C 97 72.984 71.967 1.017 1 1 525 . 4 1 1 A 97 97 THR N N 97 112.504 115.699 -3.195 1 1 526 . 4 1 1 A 98 98 ALA H H 98 8.603 8.836 -0.233 1 1 527 . 4 1 1 A 98 98 ALA C C 98 174.948 175.244 -0.296 1 1 528 . 4 1 1 A 98 98 ALA CA C 98 49.980 49.847 0.133 1 1 529 . 4 1 1 A 98 98 ALA CB C 98 19.157 22.694 -3.537 1 1 530 . 4 1 1 A 98 98 ALA N N 98 121.608 123.351 -1.743 1 1 531 . 4 1 1 A 99 99 LYS H H 99 8.890 9.247 -0.357 1 1 532 . 4 1 1 A 99 99 LYS C C 99 174.294 174.872 -0.578 1 1 533 . 4 1 1 A 99 99 LYS CA C 99 54.019 54.761 -0.742 1 1 534 . 4 1 1 A 99 99 LYS CB C 99 33.018 36.189 -3.171 1 1 538 . 4 1 1 A 99 99 LYS N N 99 124.522 122.548 1.974 1 1 539 . 4 1 1 A 100 100 LEU H H 100 8.985 9.037 -0.052 1 1 546 . 4 1 1 A 100 100 LEU C C 100 175.265 175.157 0.108 1 1 547 . 4 1 1 A 100 100 LEU CA C 100 52.698 53.440 -0.742 1 1 548 . 4 1 1 A 100 100 LEU CB C 100 42.889 44.880 -1.991 1 1 552 . 4 1 1 A 100 100 LEU N N 100 131.876 122.914 8.962 1 1 553 . 4 1 1 A 101 101 GLY H H 101 9.137 8.892 0.245 1 1 554 . 4 1 1 A 101 101 GLY C C 101 170.798 171.932 -1.134 1 1 555 . 4 1 1 A 101 101 GLY CA C 101 44.429 44.202 0.227 1 1 556 . 4 1 1 A 101 101 GLY N N 101 111.928 109.259 2.669 1 1 557 . 4 1 1 A 102 102 TYR H H 102 8.779 8.534 0.245 1 1 558 . 4 1 1 A 102 102 TYR C C 102 173.402 173.338 0.064 1 1 559 . 4 1 1 A 102 102 TYR CA C 102 54.444 56.769 -2.325 1 1 560 . 4 1 1 A 102 102 TYR CB C 102 42.239 42.056 0.183 1 1 561 . 4 1 1 A 102 102 TYR N N 102 116.664 120.116 -3.452 1 1 562 . 4 1 1 A 103 103 PRO C C 103 175.676 176.322 -0.646 1 1 563 . 4 1 1 A 103 103 PRO CA C 103 61.462 62.716 -1.254 1 1 564 . 4 1 1 A 103 103 PRO CB C 103 30.073 33.541 -3.468 1 1 565 . 4 1 1 A 104 104 ILE H H 104 8.670 9.302 -0.632 1 1 569 . 4 1 1 A 104 104 ILE C C 104 176.646 177.672 -1.026 1 1 570 . 4 1 1 A 104 104 ILE CA C 104 62.054 62.183 -0.129 1 1 571 . 4 1 1 A 104 104 ILE CB C 104 37.678 38.511 -0.833 1 1 574 . 4 1 1 A 104 104 ILE N N 104 125.939 120.358 5.581 1 1 575 . 4 1 1 A 105 105 THR H H 105 8.129 7.888 0.241 1 1 576 . 4 1 1 A 105 105 THR C C 105 174.344 174.205 0.139 1 1 577 . 4 1 1 A 105 105 THR CA C 105 59.176 62.465 -3.289 1 1 578 . 4 1 1 A 105 105 THR CB C 105 71.049 69.948 1.101 1 1 580 . 4 1 1 A 105 105 THR N N 105 109.853 110.098 -0.245 1 1 581 . 4 1 1 A 106 106 ASP H H 106 8.424 7.846 0.578 1 1 582 . 4 1 1 A 106 106 ASP C C 106 175.692 176.232 -0.540 1 1 583 . 4 1 1 A 106 106 ASP CA C 106 56.465 55.172 1.293 1 1 584 . 4 1 1 A 106 106 ASP CB C 106 40.032 43.517 -3.485 1 1 585 . 4 1 1 A 106 106 ASP N N 106 117.156 121.042 -3.886 1 1 586 . 4 1 1 A 107 107 ASP H H 107 8.124 8.770 -0.646 1 1 587 . 4 1 1 A 107 107 ASP C C 107 174.174 174.066 0.108 1 1 588 . 4 1 1 A 107 107 ASP CA C 107 52.907 53.916 -1.009 1 1 589 . 4 1 1 A 107 107 ASP CB C 107 41.661 41.768 -0.107 1 1 590 . 4 1 1 A 107 107 ASP N N 107 113.591 116.279 -2.688 1 1 591 . 4 1 1 A 108 108 LEU H H 108 7.336 7.353 -0.017 1 1 598 . 4 1 1 A 108 108 LEU C C 108 174.321 175.098 -0.777 1 1 599 . 4 1 1 A 108 108 LEU CA C 108 54.449 53.833 0.616 1 1 600 . 4 1 1 A 108 108 LEU CB C 108 44.754 45.491 -0.737 1 1 604 . 4 1 1 A 108 108 LEU N N 108 123.244 120.605 2.639 1 1 605 . 4 1 1 A 109 109 ASP H H 109 8.943 9.179 -0.236 1 1 606 . 4 1 1 A 109 109 ASP C C 109 176.248 174.777 1.471 1 1 607 . 4 1 1 A 109 109 ASP CA C 109 52.376 52.631 -0.255 1 1 608 . 4 1 1 A 109 109 ASP CB C 109 42.764 44.877 -2.113 1 1 609 . 4 1 1 A 109 109 ASP N N 109 124.634 121.940 2.694 1 1 610 . 4 1 1 A 110 110 ILE H H 110 8.372 8.640 -0.268 1 1 614 . 4 1 1 A 110 110 ILE C C 110 173.735 174.203 -0.468 1 1 615 . 4 1 1 A 110 110 ILE CA C 110 59.129 59.300 -0.171 1 1 616 . 4 1 1 A 110 110 ILE CB C 110 39.402 40.669 -1.267 1 1 620 . 4 1 1 A 110 110 ILE N N 110 119.135 116.219 2.916 1 1 621 . 4 1 1 A 111 111 TYR H H 111 8.695 9.131 -0.436 1 1 622 . 4 1 1 A 111 111 TYR C C 111 172.838 174.139 -1.301 1 1 623 . 4 1 1 A 111 111 TYR CA C 111 56.182 56.645 -0.463 1 1 624 . 4 1 1 A 111 111 TYR CB C 111 41.489 42.993 -1.504 1 1 625 . 4 1 1 A 111 111 TYR N N 111 121.248 121.799 -0.551 1 1 626 . 4 1 1 A 112 112 THR H H 112 9.172 9.052 0.120 1 1 627 . 4 1 1 A 112 112 THR C C 112 173.850 172.279 1.571 1 1 628 . 4 1 1 A 112 112 THR CA C 112 58.246 60.254 -2.008 1 1 629 . 4 1 1 A 112 112 THR CB C 112 71.676 71.479 0.197 1 1 631 . 4 1 1 A 112 112 THR N N 112 110.671 113.764 -3.093 1 1 632 . 4 1 1 A 113 113 ARG H H 113 8.732 9.449 -0.717 1 1 633 . 4 1 1 A 113 113 ARG C C 113 175.037 173.725 1.312 1 1 634 . 4 1 1 A 113 113 ARG CA C 113 53.995 54.125 -0.130 1 1 635 . 4 1 1 A 113 113 ARG CB C 113 32.266 33.284 -1.018 1 1 638 . 4 1 1 A 113 113 ARG N N 113 120.642 125.380 -4.738 1 1 639 . 4 1 1 A 114 114 LEU H H 114 8.449 8.679 -0.230 1 1 646 . 4 1 1 A 114 114 LEU C C 114 175.812 175.729 0.083 1 1 647 . 4 1 1 A 114 114 LEU CA C 114 53.335 54.040 -0.705 1 1 648 . 4 1 1 A 114 114 LEU CB C 114 45.182 45.790 -0.608 1 1 652 . 4 1 1 A 114 114 LEU N N 114 119.078 127.784 -8.706 1 1 653 . 4 1 1 A 115 115 GLY H H 115 8.232 8.372 -0.140 1 1 654 . 4 1 1 A 115 115 GLY C C 115 171.343 172.330 -0.987 1 1 655 . 4 1 1 A 115 115 GLY CA C 115 46.217 46.037 0.180 1 1 656 . 4 1 1 A 115 115 GLY N N 115 108.966 112.303 -3.337 1 1 657 . 4 1 1 A 116 116 GLY H H 116 8.293 8.358 -0.065 1 1 658 . 4 1 1 A 116 116 GLY C C 116 169.856 172.487 -2.631 1 1 659 . 4 1 1 A 116 116 GLY CA C 116 44.084 45.114 -1.030 1 1 660 . 4 1 1 A 116 116 GLY N N 116 109.676 110.333 -0.657 1 1 661 . 4 1 1 A 117 117 MET H H 117 9.286 9.489 -0.203 1 1 662 . 4 1 1 A 117 117 MET C C 117 174.557 174.996 -0.439 1 1 663 . 4 1 1 A 117 117 MET CA C 117 53.258 53.265 -0.007 1 1 664 . 4 1 1 A 117 117 MET CB C 117 37.195 35.567 1.628 1 1 667 . 4 1 1 A 117 117 MET N N 117 120.425 116.885 3.540 1 1 668 . 4 1 1 A 118 118 VAL H H 118 9.062 8.991 0.071 1 1 675 . 4 1 1 A 118 118 VAL C C 118 173.993 175.033 -1.040 1 1 676 . 4 1 1 A 118 118 VAL CA C 118 59.883 60.686 -0.803 1 1 677 . 4 1 1 A 118 118 VAL CB C 118 31.782 35.143 -3.361 1 1 680 . 4 1 1 A 118 118 VAL N N 118 126.948 119.392 7.556 1 1 681 . 4 1 1 A 119 119 TRP H H 119 8.482 10.017 -1.535 1 1 682 . 4 1 1 A 119 119 TRP C C 119 174.608 175.513 -0.905 1 1 683 . 4 1 1 A 119 119 TRP CA C 119 53.332 55.322 -1.990 1 1 684 . 4 1 1 A 119 119 TRP CB C 119 33.569 33.384 0.185 1 1 685 . 4 1 1 A 119 119 TRP N N 119 124.631 127.300 -2.669 1 1 686 . 4 1 1 A 120 120 ARG H H 120 9.113 8.495 0.618 1 1 687 . 4 1 1 A 120 120 ARG C C 120 174.951 174.136 0.815 1 1 688 . 4 1 1 A 120 120 ARG CA C 120 54.684 54.824 -0.140 1 1 689 . 4 1 1 A 120 120 ARG CB C 120 33.424 33.875 -0.451 1 1 690 . 4 1 1 A 120 120 ARG N N 120 117.899 120.221 -2.322 1 1 691 . 4 1 1 A 121 121 ALA H H 121 9.299 8.974 0.325 1 1 692 . 4 1 1 A 121 121 ALA C C 121 175.954 176.321 -0.367 1 1 693 . 4 1 1 A 121 121 ALA CA C 121 50.368 50.949 -0.581 1 1 694 . 4 1 1 A 121 121 ALA CB C 121 21.141 20.634 0.507 1 1 695 . 4 1 1 A 121 121 ALA N N 121 128.863 126.614 2.249 1 1 696 . 4 1 1 A 122 122 ASP H H 122 8.488 8.835 -0.347 1 1 697 . 4 1 1 A 122 122 ASP C C 122 175.635 173.944 1.691 1 1 698 . 4 1 1 A 122 122 ASP CA C 122 53.891 53.163 0.728 1 1 699 . 4 1 1 A 122 122 ASP CB C 122 42.492 45.560 -3.068 1 1 700 . 4 1 1 A 122 122 ASP N N 122 121.721 121.697 0.024 1 1 701 . 4 1 1 A 123 123 SER H H 123 8.466 8.668 -0.202 1 1 702 . 4 1 1 A 123 123 SER C C 123 174.325 173.413 0.912 1 1 703 . 4 1 1 A 123 123 SER CA C 123 57.325 56.638 0.687 1 1 704 . 4 1 1 A 123 123 SER CB C 123 63.988 64.789 -0.801 1 1 705 . 4 1 1 A 123 123 SER N N 123 117.374 117.252 0.122 1 1 706 . 4 1 1 A 124 124 LYS H H 124 8.389 8.834 -0.445 1 1 707 . 4 1 1 A 124 124 LYS C C 124 176.840 176.005 0.835 1 1 708 . 4 1 1 A 124 124 LYS CA C 124 56.036 55.065 0.971 1 1 709 . 4 1 1 A 124 124 LYS CB C 124 32.397 33.995 -1.598 1 1 711 . 4 1 1 A 124 124 LYS N N 124 122.883 127.174 -4.291 1 1 712 . 4 1 1 A 125 125 GLY H H 125 8.281 8.771 -0.490 1 1 713 . 4 1 1 A 125 125 GLY C C 125 173.592 174.890 -1.298 1 1 714 . 4 1 1 A 125 125 GLY CA C 125 44.924 44.093 0.831 1 1 715 . 4 1 1 A 125 125 GLY N N 125 109.541 112.547 -3.006 1 1 716 . 4 1 1 A 126 126 ASN H H 126 8.185 8.883 -0.698 1 1 717 . 4 1 1 A 126 126 ASN C C 126 176.649 176.076 0.573 1 1 718 . 4 1 1 A 126 126 ASN CA C 126 52.763 55.461 -2.698 1 1 719 . 4 1 1 A 126 126 ASN CB C 126 38.439 39.818 -1.379 1 1 720 . 4 1 1 A 126 126 ASN N N 126 119.019 118.542 0.477 1 1 721 . 4 1 1 A 127 127 TYR C C 127 176.913 174.837 2.076 1 1 722 . 4 1 1 A 127 127 TYR CA C 127 57.757 57.276 0.481 1 1 723 . 4 1 1 A 127 127 TYR CB C 127 37.703 38.861 -1.158 1 1 724 . 4 1 1 A 128 128 ALA H H 128 8.050 7.607 0.443 1 1 728 . 4 1 1 A 128 128 ALA C C 128 177.756 176.061 1.695 1 1 729 . 4 1 1 A 128 128 ALA CA C 128 52.321 50.539 1.782 1 1 730 . 4 1 1 A 128 128 ALA CB C 128 18.273 23.642 -5.369 1 1 731 . 4 1 1 A 128 128 ALA N N 128 124.529 123.004 1.525 1 1 732 . 4 1 1 A 129 129 SER H H 129 8.063 8.598 -0.535 1 1 733 . 4 1 1 A 129 129 SER C C 129 174.938 173.905 1.033 1 1 734 . 4 1 1 A 129 129 SER CA C 129 58.202 58.714 -0.512 1 1 735 . 4 1 1 A 129 129 SER CB C 129 62.974 63.858 -0.884 1 1 736 . 4 1 1 A 129 129 SER N N 129 114.374 115.860 -1.486 1 1 737 . 4 1 1 A 130 130 THR H H 130 7.875 8.695 -0.820 1 1 741 . 4 1 1 A 130 130 THR C C 130 175.198 174.580 0.618 1 1 742 . 4 1 1 A 130 130 THR CA C 130 61.520 61.935 -0.415 1 1 743 . 4 1 1 A 130 130 THR CB C 130 69.312 68.989 0.323 1 1 745 . 4 1 1 A 130 130 THR N N 130 113.608 121.446 -7.838 1 1 746 . 4 1 1 A 131 131 GLY H H 131 8.219 8.655 -0.436 1 1 747 . 4 1 1 A 131 131 GLY C C 131 173.979 175.492 -1.513 1 1 748 . 4 1 1 A 131 131 GLY CA C 131 44.991 45.906 -0.915 1 1 749 . 4 1 1 A 131 131 GLY N N 131 110.848 113.742 -2.894 1 1 750 . 4 1 1 A 132 132 VAL H H 132 7.729 8.842 -1.113 1 1 757 . 4 1 1 A 132 132 VAL C C 132 175.988 175.768 0.220 1 1 758 . 4 1 1 A 132 132 VAL CA C 132 61.643 62.206 -0.563 1 1 759 . 4 1 1 A 132 132 VAL CB C 132 31.941 33.483 -1.542 1 1 762 . 4 1 1 A 132 132 VAL N N 132 118.932 119.256 -0.324 1 1 763 . 4 1 1 A 133 133 SER H H 133 8.224 7.942 0.282 1 1 764 . 4 1 1 A 133 133 SER C C 133 174.320 173.806 0.514 1 1 765 . 4 1 1 A 133 133 SER CA C 133 57.756 57.614 0.142 1 1 766 . 4 1 1 A 133 133 SER CB C 133 63.140 63.445 -0.305 1 1 767 . 4 1 1 A 133 133 SER N N 133 119.260 118.271 0.989 1 1 768 . 4 1 1 A 134 134 ARG H H 134 8.199 8.765 -0.566 1 1 769 . 4 1 1 A 134 134 ARG C C 134 175.923 176.929 -1.006 1 1 770 . 4 1 1 A 134 134 ARG CA C 134 55.461 56.276 -0.815 1 1 771 . 4 1 1 A 134 134 ARG CB C 134 30.195 30.645 -0.450 1 1 774 . 4 1 1 A 134 134 ARG N N 134 123.262 128.677 -5.415 1 1 775 . 4 1 1 A 135 135 SER H H 135 8.256 8.806 -0.550 1 1 776 . 4 1 1 A 135 135 SER C C 135 174.360 174.366 -0.006 1 1 777 . 4 1 1 A 135 135 SER CA C 135 57.730 58.775 -1.045 1 1 778 . 4 1 1 A 135 135 SER CB C 135 63.275 64.026 -0.751 1 1 779 . 4 1 1 A 135 135 SER N N 135 117.155 117.552 -0.397 1 1 780 . 4 1 1 A 136 136 GLU H H 136 8.374 7.661 0.713 1 1 781 . 4 1 1 A 136 136 GLU C C 136 176.284 174.940 1.344 1 1 782 . 4 1 1 A 136 136 GLU CA C 136 56.082 55.444 0.638 1 1 783 . 4 1 1 A 136 136 GLU CB C 136 29.820 29.614 0.206 1 1 785 . 4 1 1 A 136 136 GLU N N 136 122.812 116.986 5.826 1 1 786 . 4 1 1 A 137 137 HIS H H 137 8.118 8.605 -0.487 1 1 787 . 4 1 1 A 137 137 HIS C C 137 173.529 173.685 -0.156 1 1 788 . 4 1 1 A 137 137 HIS CA C 137 54.793 54.530 0.263 1 1 789 . 4 1 1 A 137 137 HIS CB C 137 30.191 33.454 -3.263 1 1 790 . 4 1 1 A 137 137 HIS N N 137 118.002 122.996 -4.994 1 1 791 . 4 1 1 A 138 138 ASP H H 138 8.572 9.221 -0.649 1 1 792 . 4 1 1 A 138 138 ASP C C 138 174.940 175.211 -0.271 1 1 793 . 4 1 1 A 138 138 ASP CA C 138 53.594 53.209 0.385 1 1 794 . 4 1 1 A 138 138 ASP CB C 138 42.165 44.640 -2.475 1 1 795 . 4 1 1 A 138 138 ASP N N 138 121.536 123.539 -2.003 1 1 796 . 4 1 1 A 139 139 THR H H 139 7.857 8.772 -0.915 1 1 797 . 4 1 1 A 139 139 THR C C 139 172.822 174.254 -1.432 1 1 798 . 4 1 1 A 139 139 THR CA C 139 59.197 59.910 -0.713 1 1 799 . 4 1 1 A 139 139 THR CB C 139 71.457 71.752 -0.295 1 1 801 . 4 1 1 A 139 139 THR N N 139 113.598 112.187 1.411 1 1 802 . 4 1 1 A 140 140 GLY C C 140 169.622 172.288 -2.666 1 1 803 . 4 1 1 A 140 140 GLY CA C 140 44.287 44.768 -0.481 1 1 804 . 4 1 1 A 141 141 VAL H H 141 7.815 8.906 -1.091 1 1 811 . 4 1 1 A 141 141 VAL C C 141 176.038 173.591 2.447 1 1 812 . 4 1 1 A 141 141 VAL CA C 141 59.739 60.205 -0.466 1 1 813 . 4 1 1 A 141 141 VAL CB C 141 33.308 35.137 -1.829 1 1 816 . 4 1 1 A 141 141 VAL N N 141 116.224 122.377 -6.153 1 1 817 . 4 1 1 A 142 142 SER H H 142 9.284 8.850 0.434 1 1 818 . 4 1 1 A 142 142 SER C C 142 171.050 171.597 -0.547 1 1 819 . 4 1 1 A 142 142 SER CB C 142 67.608 66.447 1.161 1 1 820 . 4 1 1 A 142 142 SER N N 142 123.223 122.194 1.029 1 1 821 . 4 1 1 A 143 143 PRO C C 143 174.032 175.882 -1.850 1 1 822 . 4 1 1 A 143 143 PRO CA C 143 62.350 62.447 -0.097 1 1 823 . 4 1 1 A 143 143 PRO CB C 143 31.774 33.484 -1.710 1 1 825 . 4 1 1 A 144 144 VAL H H 144 7.785 8.869 -1.084 1 1 832 . 4 1 1 A 144 144 VAL C C 144 172.826 174.091 -1.265 1 1 833 . 4 1 1 A 144 144 VAL CA C 144 59.770 59.889 -0.119 1 1 834 . 4 1 1 A 144 144 VAL CB C 144 34.407 36.037 -1.630 1 1 837 . 4 1 1 A 144 144 VAL N N 144 120.214 115.955 4.259 1 1 838 . 4 1 1 A 145 145 PHE H H 145 8.623 8.936 -0.313 1 1 839 . 4 1 1 A 145 145 PHE C C 145 173.658 173.284 0.374 1 1 840 . 4 1 1 A 145 145 PHE CA C 145 54.942 57.505 -2.563 1 1 841 . 4 1 1 A 145 145 PHE CB C 145 42.692 42.356 0.336 1 1 842 . 4 1 1 A 145 145 PHE N N 145 123.914 123.340 0.574 1 1 843 . 4 1 1 A 146 146 ALA H H 146 8.886 8.631 0.255 1 1 844 . 4 1 1 A 146 146 ALA C C 146 176.258 176.274 -0.016 1 1 845 . 4 1 1 A 146 146 ALA CA C 146 49.734 50.210 -0.476 1 1 846 . 4 1 1 A 146 146 ALA CB C 146 22.244 21.366 0.878 1 1 847 . 4 1 1 A 146 146 ALA N N 146 125.243 129.867 -4.624 1 1 848 . 4 1 1 A 147 147 GLY H H 147 8.470 9.054 -0.584 1 1 849 . 4 1 1 A 147 147 GLY C C 147 170.940 172.599 -1.659 1 1 850 . 4 1 1 A 147 147 GLY CA C 147 44.063 44.506 -0.443 1 1 851 . 4 1 1 A 147 147 GLY N N 147 106.669 111.033 -4.364 1 1 852 . 4 1 1 A 148 148 GLY H H 148 8.008 8.561 -0.553 1 1 853 . 4 1 1 A 148 148 GLY C C 148 170.181 172.472 -2.291 1 1 854 . 4 1 1 A 148 148 GLY CA C 148 45.736 45.793 -0.057 1 1 855 . 4 1 1 A 148 148 GLY N N 148 109.475 109.725 -0.250 1 1 856 . 4 1 1 A 149 149 VAL H H 149 8.426 8.430 -0.004 1 1 863 . 4 1 1 A 149 149 VAL C C 149 174.157 173.450 0.707 1 1 864 . 4 1 1 A 149 149 VAL CA C 149 58.200 59.034 -0.834 1 1 865 . 4 1 1 A 149 149 VAL CB C 149 34.464 36.368 -1.904 1 1 868 . 4 1 1 A 149 149 VAL N N 149 112.651 118.293 -5.642 1 1 869 . 4 1 1 A 150 150 GLU H H 150 9.070 9.397 -0.327 1 1 870 . 4 1 1 A 150 150 GLU C C 150 173.892 174.715 -0.823 1 1 871 . 4 1 1 A 150 150 GLU CA C 150 54.617 55.178 -0.561 1 1 872 . 4 1 1 A 150 150 GLU CB C 150 32.911 33.909 -0.998 1 1 874 . 4 1 1 A 150 150 GLU N N 150 124.471 120.397 4.074 1 1 875 . 4 1 1 A 151 151 TRP H H 151 9.461 9.357 0.104 1 1 877 . 4 1 1 A 151 151 TRP C C 151 174.370 175.795 -1.425 1 1 878 . 4 1 1 A 151 151 TRP CA C 151 54.113 56.139 -2.026 1 1 879 . 4 1 1 A 151 151 TRP CB C 151 31.688 33.322 -1.634 1 1 880 . 4 1 1 A 151 151 TRP N N 151 129.611 126.097 3.514 1 1 882 . 4 1 1 A 152 152 ALA H H 152 8.771 8.252 0.519 1 1 883 . 4 1 1 A 152 152 ALA C C 152 175.079 176.767 -1.688 1 1 884 . 4 1 1 A 152 152 ALA CA C 152 51.417 50.805 0.612 1 1 885 . 4 1 1 A 152 152 ALA CB C 152 17.209 20.420 -3.211 1 1 886 . 4 1 1 A 152 152 ALA N N 152 130.502 126.352 4.150 1 1 887 . 4 1 1 A 153 153 VAL H H 153 7.893 8.494 -0.601 1 1 894 . 4 1 1 A 153 153 VAL C C 153 176.612 176.028 0.584 1 1 895 . 4 1 1 A 153 153 VAL CA C 153 63.600 63.847 -0.247 1 1 896 . 4 1 1 A 153 153 VAL CB C 153 31.280 32.549 -1.269 1 1 899 . 4 1 1 A 153 153 VAL N N 153 124.360 122.732 1.628 1 1 900 . 4 1 1 A 154 154 THR H H 154 7.950 7.359 0.591 1 1 904 . 4 1 1 A 154 154 THR C C 154 173.884 174.318 -0.434 1 1 905 . 4 1 1 A 154 154 THR CA C 154 58.655 60.602 -1.947 1 1 906 . 4 1 1 A 154 154 THR CB C 154 71.262 70.663 0.599 1 1 908 . 4 1 1 A 154 154 THR N N 154 109.176 113.530 -4.354 1 1 909 . 4 1 1 A 155 155 ARG H H 155 8.310 8.784 -0.474 1 1 910 . 4 1 1 A 155 155 ARG C C 155 176.753 175.650 1.103 1 1 911 . 4 1 1 A 155 155 ARG CA C 155 58.456 55.615 2.841 1 1 912 . 4 1 1 A 155 155 ARG CB C 155 29.043 30.393 -1.350 1 1 915 . 4 1 1 A 155 155 ARG N N 155 116.576 118.694 -2.118 1 1 916 . 4 1 1 A 156 156 ASP H H 156 7.783 8.244 -0.461 1 1 917 . 4 1 1 A 156 156 ASP C C 156 174.222 174.889 -0.667 1 1 918 . 4 1 1 A 156 156 ASP CA C 156 53.540 55.056 -1.516 1 1 919 . 4 1 1 A 156 156 ASP CB C 156 42.327 44.142 -1.815 1 1 920 . 4 1 1 A 156 156 ASP N N 156 112.950 120.393 -7.443 1 1 921 . 4 1 1 A 157 157 ILE H H 157 7.233 7.983 -0.750 1 1 925 . 4 1 1 A 157 157 ILE C C 157 174.178 174.621 -0.443 1 1 926 . 4 1 1 A 157 157 ILE CA C 157 59.350 59.871 -0.521 1 1 927 . 4 1 1 A 157 157 ILE CB C 157 38.969 40.291 -1.322 1 1 930 . 4 1 1 A 157 157 ILE N N 157 119.732 120.547 -0.815 1 1 931 . 4 1 1 A 158 158 ALA H H 158 8.729 8.901 -0.172 1 1 932 . 4 1 1 A 158 158 ALA C C 158 176.567 176.199 0.368 1 1 933 . 4 1 1 A 158 158 ALA CA C 158 49.418 50.341 -0.923 1 1 934 . 4 1 1 A 158 158 ALA CB C 158 21.430 23.768 -2.338 1 1 935 . 4 1 1 A 158 158 ALA N N 158 128.564 128.099 0.465 1 1 936 . 4 1 1 A 159 159 THR H H 159 8.972 8.980 -0.008 1 1 940 . 4 1 1 A 159 159 THR C C 159 172.213 173.641 -1.428 1 1 941 . 4 1 1 A 159 159 THR CA C 159 59.504 61.639 -2.135 1 1 942 . 4 1 1 A 159 159 THR CB C 159 70.728 71.198 -0.470 1 1 944 . 4 1 1 A 159 159 THR N N 159 114.901 114.699 0.202 1 1 945 . 4 1 1 A 160 160 ARG H H 160 8.924 9.226 -0.302 1 1 946 . 4 1 1 A 160 160 ARG C C 160 174.097 173.544 0.553 1 1 947 . 4 1 1 A 160 160 ARG CA C 160 53.066 54.550 -1.484 1 1 948 . 4 1 1 A 160 160 ARG CB C 160 32.922 34.050 -1.128 1 1 951 . 4 1 1 A 160 160 ARG N N 160 121.507 125.399 -3.892 1 1 952 . 4 1 1 A 161 161 LEU H H 161 8.611 9.159 -0.548 1 1 959 . 4 1 1 A 161 161 LEU C C 161 174.389 175.026 -0.637 1 1 960 . 4 1 1 A 161 161 LEU CA C 161 53.355 53.492 -0.137 1 1 961 . 4 1 1 A 161 161 LEU CB C 161 44.360 45.613 -1.253 1 1 964 . 4 1 1 A 161 161 LEU N N 161 124.711 128.445 -3.734 1 1 965 . 4 1 1 A 162 162 GLU H H 162 8.746 8.878 -0.132 1 1 966 . 4 1 1 A 162 162 GLU C C 162 173.376 175.330 -1.954 1 1 967 . 4 1 1 A 162 162 GLU CA C 162 53.904 54.831 -0.927 1 1 968 . 4 1 1 A 162 162 GLU CB C 162 33.773 33.099 0.674 1 1 970 . 4 1 1 A 162 162 GLU N N 162 122.300 125.050 -2.750 1 1 971 . 4 1 1 A 163 163 TYR H H 163 8.872 8.820 0.052 1 1 972 . 4 1 1 A 163 163 TYR C C 163 173.425 173.150 0.275 1 1 973 . 4 1 1 A 163 163 TYR CA C 163 56.192 55.527 0.665 1 1 974 . 4 1 1 A 163 163 TYR CB C 163 40.870 41.375 -0.505 1 1 975 . 4 1 1 A 163 163 TYR N N 163 124.618 117.962 6.656 1 1 976 . 4 1 1 A 171 171 ASP C C 171 175.753 176.171 -0.418 1 1 977 . 4 1 1 A 171 171 ASP CA C 171 53.517 53.120 0.397 1 1 978 . 4 1 1 A 171 171 ASP CB C 171 41.353 43.072 -1.719 1 1 979 . 4 1 1 A 172 172 ALA H H 172 8.336 8.650 -0.314 1 1 983 . 4 1 1 A 172 172 ALA C C 172 178.110 176.627 1.483 1 1 984 . 4 1 1 A 172 172 ALA CA C 172 52.190 51.361 0.829 1 1 985 . 4 1 1 A 172 172 ALA CB C 172 18.305 20.767 -2.462 1 1 986 . 4 1 1 A 172 172 ALA N N 172 125.294 124.340 0.954 1 1 987 . 4 1 1 A 173 173 GLY H H 173 8.300 8.589 -0.289 1 1 988 . 4 1 1 A 173 173 GLY C C 173 174.437 174.475 -0.038 1 1 989 . 4 1 1 A 173 173 GLY CA C 173 45.083 44.412 0.671 1 1 990 . 4 1 1 A 173 173 GLY N N 173 107.268 105.672 1.596 1 1 991 . 4 1 1 A 174 174 THR H H 174 7.754 8.986 -1.232 1 1 992 . 4 1 1 A 174 174 THR C C 174 174.738 175.932 -1.194 1 1 993 . 4 1 1 A 174 174 THR CA C 174 61.310 65.589 -4.279 1 1 994 . 4 1 1 A 174 174 THR CB C 174 69.310 69.573 -0.263 1 1 996 . 4 1 1 A 174 174 THR N N 174 113.472 118.230 -4.758 1 1 997 . 4 1 1 A 175 175 VAL H H 175 7.993 7.828 0.165 1 1 1004 . 4 1 1 A 175 175 VAL C C 175 176.535 176.159 0.376 1 1 1005 . 4 1 1 A 175 175 VAL CA C 175 62.126 63.502 -1.376 1 1 1006 . 4 1 1 A 175 175 VAL CB C 175 31.282 33.488 -2.206 1 1 1009 . 4 1 1 A 175 175 VAL N N 175 121.643 116.736 4.907 1 1 1010 . 4 1 1 A 176 176 GLY H H 176 8.056 7.784 0.272 1 1 1011 . 4 1 1 A 176 176 GLY C C 176 173.930 172.573 1.357 1 1 1012 . 4 1 1 A 176 176 GLY CA C 176 44.983 44.693 0.290 1 1 1013 . 4 1 1 A 176 176 GLY N N 176 110.460 109.770 0.690 1 1 1014 . 4 1 1 A 177 177 THR H H 177 7.520 8.388 -0.868 1 1 1015 . 4 1 1 A 177 177 THR C C 177 173.574 174.466 -0.892 1 1 1016 . 4 1 1 A 177 177 THR CA C 177 60.609 60.364 0.245 1 1 1017 . 4 1 1 A 177 177 THR CB C 177 69.506 70.352 -0.846 1 1 1019 . 4 1 1 A 177 177 THR N N 177 113.390 111.361 2.029 1 1 1020 . 4 1 1 A 178 178 ARG H H 178 8.261 8.705 -0.444 1 1 1021 . 4 1 1 A 178 178 ARG C C 178 173.932 176.714 -2.782 1 1 1022 . 4 1 1 A 178 178 ARG CA C 178 53.683 61.020 -7.337 1 1 1023 . 4 1 1 A 178 178 ARG CB C 178 29.224 29.336 -0.112 1 1 1026 . 4 1 1 A 178 178 ARG N N 178 123.906 126.398 -2.492 1 1 1027 . 4 1 1 A 183 183 MET C C 183 174.053 174.497 -0.444 1 1 1028 . 4 1 1 A 183 183 MET CA C 183 53.700 55.114 -1.414 1 1 1029 . 4 1 1 A 183 183 MET CB C 183 35.908 35.081 0.827 1 1 1032 . 4 1 1 A 184 184 LEU H H 184 8.319 9.123 -0.804 1 1 1033 . 4 1 1 A 184 184 LEU C C 184 175.235 175.507 -0.272 1 1 1034 . 4 1 1 A 184 184 LEU CA C 184 53.120 53.496 -0.376 1 1 1035 . 4 1 1 A 184 184 LEU CB C 184 42.857 45.706 -2.849 1 1 1038 . 4 1 1 A 184 184 LEU N N 184 131.293 128.328 2.965 1 1 1039 . 4 1 1 A 185 185 SER H H 185 9.603 9.039 0.564 1 1 1040 . 4 1 1 A 185 185 SER C C 185 171.293 173.038 -1.745 1 1 1041 . 4 1 1 A 185 185 SER CA C 185 56.504 56.990 -0.486 1 1 1042 . 4 1 1 A 185 185 SER CB C 185 66.585 66.478 0.107 1 1 1043 . 4 1 1 A 185 185 SER N N 185 119.338 119.211 0.127 1 1 1044 . 4 1 1 A 186 186 LEU H H 186 8.583 8.390 0.193 1 1 1051 . 4 1 1 A 186 186 LEU C C 186 175.328 176.286 -0.958 1 1 1052 . 4 1 1 A 186 186 LEU CA C 186 52.729 53.105 -0.376 1 1 1053 . 4 1 1 A 186 186 LEU CB C 186 44.996 44.734 0.262 1 1 1056 . 4 1 1 A 186 186 LEU N N 186 122.719 123.860 -1.141 1 1 1057 . 4 1 1 A 187 187 GLY H H 187 9.287 8.593 0.694 1 1 1058 . 4 1 1 A 187 187 GLY C C 187 172.315 173.549 -1.234 1 1 1059 . 4 1 1 A 187 187 GLY CA C 187 43.502 45.181 -1.679 1 1 1060 . 4 1 1 A 187 187 GLY N N 187 110.265 110.896 -0.631 1 1 1061 . 4 1 1 A 188 188 VAL H H 188 8.825 8.752 0.073 1 1 1068 . 4 1 1 A 188 188 VAL C C 188 173.125 174.834 -1.709 1 1 1069 . 4 1 1 A 188 188 VAL CA C 188 59.739 59.384 0.355 1 1 1070 . 4 1 1 A 188 188 VAL CB C 188 34.532 34.782 -0.250 1 1 1073 . 4 1 1 A 188 188 VAL N N 188 119.161 116.838 2.323 1 1 1074 . 4 1 1 A 189 189 SER H H 189 9.051 9.007 0.044 1 1 1075 . 4 1 1 A 189 189 SER C C 189 171.698 173.046 -1.348 1 1 1076 . 4 1 1 A 189 189 SER CA C 189 55.997 57.089 -1.092 1 1 1077 . 4 1 1 A 189 189 SER CB C 189 66.094 67.146 -1.052 1 1 1078 . 4 1 1 A 189 189 SER N N 189 117.810 118.482 -0.672 1 1 1079 . 4 1 1 A 190 190 TYR H H 190 9.145 9.076 0.069 1 1 1080 . 4 1 1 A 190 190 TYR C C 190 174.063 173.212 0.851 1 1 1081 . 4 1 1 A 190 190 TYR CA C 190 55.375 55.533 -0.158 1 1 1082 . 4 1 1 A 190 190 TYR CB C 190 41.183 41.354 -0.171 1 1 1083 . 4 1 1 A 190 190 TYR N N 190 123.690 117.642 6.048 1 1 1084 . 4 1 1 A 191 191 ARG H H 191 8.211 8.185 0.026 1 1 1085 . 4 1 1 A 191 191 ARG C C 191 174.826 175.542 -0.716 1 1 1086 . 4 1 1 A 191 191 ARG CA C 191 54.464 55.699 -1.235 1 1 1087 . 4 1 1 A 191 191 ARG CB C 191 30.507 31.108 -0.601 1 1 1090 . 4 1 1 A 191 191 ARG N N 191 125.366 120.301 5.065 1 1 1091 . 4 1 1 A 192 192 PHE H H 192 8.496 9.619 -1.123 1 1 1092 . 4 1 1 A 192 192 PHE C C 192 176.384 174.967 1.417 1 1 1093 . 4 1 1 A 192 192 PHE CA C 192 57.179 56.940 0.239 1 1 1094 . 4 1 1 A 192 192 PHE CB C 192 39.430 39.695 -0.265 1 1 1095 . 4 1 1 A 192 192 PHE N N 192 121.586 123.053 -1.467 1 1 1096 . 4 1 1 A 193 193 GLY H H 193 8.643 8.926 -0.283 1 1 1097 . 4 1 1 A 193 193 GLY C C 193 174.466 175.292 -0.826 1 1 1098 . 4 1 1 A 193 193 GLY CA C 193 45.126 44.121 1.005 1 1 1099 . 4 1 1 A 193 193 GLY N N 193 109.499 113.460 -3.961 1 1 1100 . 4 1 1 A 194 194 GLN H H 194 8.512 8.930 -0.418 1 1 1101 . 4 1 1 A 194 194 GLN C C 194 176.201 176.117 0.084 1 1 1102 . 4 1 1 A 194 194 GLN CA C 194 55.433 57.644 -2.211 1 1 1103 . 4 1 1 A 194 194 GLN CB C 194 28.729 29.247 -0.518 1 1 1105 . 4 1 1 A 194 194 GLN N N 194 119.448 119.685 -0.237 1 1 1106 . 4 1 1 A 195 195 GLU H H 195 8.530 7.908 0.622 1 1 1107 . 4 1 1 A 195 195 GLU C C 195 176.151 175.425 0.726 1 1 1108 . 4 1 1 A 195 195 GLU CA C 195 56.256 55.767 0.489 1 1 1109 . 4 1 1 A 195 195 GLU CB C 195 29.486 31.169 -1.683 1 1 1111 . 4 1 1 A 195 195 GLU N N 195 121.959 118.632 3.327 1 1 1112 . 4 1 1 A 196 196 ASP H H 196 8.253 8.760 -0.507 1 1 1113 . 4 1 1 A 196 196 ASP C C 196 175.667 175.244 0.423 1 1 1114 . 4 1 1 A 196 196 ASP CA C 196 53.981 54.183 -0.202 1 1 1115 . 4 1 1 A 196 196 ASP CB C 196 40.700 42.163 -1.463 1 1 1116 . 4 1 1 A 196 196 ASP N N 196 121.819 127.307 -5.488 1 1 1117 . 4 1 1 A 197 197 ALA H H 197 7.999 8.795 -0.796 1 1 1121 . 4 1 1 A 197 197 ALA C C 197 176.847 176.805 0.042 1 1 1122 . 4 1 1 A 197 197 ALA CA C 197 51.612 50.252 1.360 1 1 1123 . 4 1 1 A 197 197 ALA CB C 197 18.192 20.939 -2.747 1 1 1124 . 4 1 1 A 197 197 ALA N N 197 124.262 125.340 -1.078 1 1 1125 . 4 1 1 A 198 198 ALA H H 198 8.042 8.615 -0.573 1 1 1126 . 4 1 1 A 198 198 ALA C C 198 176.865 175.708 1.157 1 1 1127 . 4 1 1 A 198 198 ALA CA C 198 49.999 51.002 -1.003 1 1 1128 . 4 1 1 A 198 198 ALA CB C 198 17.327 17.837 -0.510 1 1 1129 . 4 1 1 A 198 198 ALA N N 198 124.724 125.975 -1.251 1 1 1130 . 4 1 1 A 199 199 PRO C C 199 176.727 175.683 1.044 1 1 1131 . 4 1 1 A 199 199 PRO CA C 199 62.399 62.724 -0.325 1 1 1132 . 4 1 1 A 199 199 PRO CB C 199 30.949 32.374 -1.425 1 1 1135 . 4 1 1 A 200 200 VAL H H 200 8.026 8.506 -0.480 1 1 1142 . 4 1 1 A 200 200 VAL C C 200 176.034 175.126 0.908 1 1 1143 . 4 1 1 A 200 200 VAL CA C 200 61.944 61.498 0.446 1 1 1144 . 4 1 1 A 200 200 VAL CB C 200 31.734 31.453 0.281 1 1 1147 . 4 1 1 A 200 200 VAL N N 200 120.635 121.401 -0.766 1 1 1148 . 4 1 1 A 201 201 VAL H H 201 7.966 9.183 -1.217 1 1 1155 . 4 1 1 A 201 201 VAL C C 201 175.128 174.684 0.444 1 1 1156 . 4 1 1 A 201 201 VAL CA C 201 61.249 62.006 -0.757 1 1 1157 . 4 1 1 A 201 201 VAL CB C 201 31.917 30.762 1.155 1 1 1160 . 4 1 1 A 201 201 VAL N N 201 124.053 128.522 -4.469 1 1 1161 . 4 1 1 A 202 202 ALA H H 202 8.159 8.058 0.101 1 1 1162 . 4 1 1 A 202 202 ALA C C 202 175.153 176.628 -1.475 1 1 1163 . 4 1 1 A 202 202 ALA CA C 202 49.742 48.733 1.009 1 1 1164 . 4 1 1 A 202 202 ALA CB C 202 17.532 20.931 -3.399 1 1 1165 . 4 1 1 A 202 202 ALA N N 202 129.251 129.136 0.115 1 1 1166 . 4 1 1 A 203 203 PRO C C 203 176.273 176.568 -0.295 1 1 1167 . 4 1 1 A 203 203 PRO CA C 203 62.324 64.725 -2.401 1 1 1168 . 4 1 1 A 203 203 PRO CB C 203 31.042 32.115 -1.073 1 1 1170 . 4 1 1 A 204 204 ALA H H 204 8.137 7.955 0.182 1 1 1171 . 4 1 1 A 204 204 ALA C C 204 175.697 175.657 0.040 1 1 1172 . 4 1 1 A 204 204 ALA CA C 204 49.865 50.462 -0.597 1 1 1173 . 4 1 1 A 204 204 ALA CB C 204 17.364 19.243 -1.879 1 1 1174 . 4 1 1 A 204 204 ALA N N 204 125.510 119.903 5.607 1 1 1175 . 4 1 1 A 205 205 PRO C C 205 175.430 176.773 -1.343 1 1 1176 . 4 1 1 A 205 205 PRO CA C 205 62.511 62.988 -0.477 1 1 1177 . 4 1 1 A 205 205 PRO CB C 205 31.056 32.363 -1.307 1 1 1179 . 4 1 1 A 206 206 ALA H H 206 7.847 8.449 -0.602 1 1 1180 . 4 1 1 A 206 206 ALA C C 206 175.565 177.761 -2.196 1 1 1181 . 4 1 1 A 206 206 ALA CA C 206 49.487 55.603 -6.116 1 1 1182 . 4 1 1 A 206 206 ALA CB C 206 18.843 19.346 -0.503 1 1 1183 . 4 1 1 A 206 206 ALA N N 206 123.663 123.844 -0.181 1 1 1184 . 4 1 1 A 207 207 PRO C C 207 174.397 175.727 -1.330 1 1 1185 . 4 1 1 A 207 207 PRO CA C 207 61.454 62.454 -1.000 1 1 1186 . 4 1 1 A 207 207 PRO CB C 207 31.929 33.036 -1.107 1 1 1187 . 4 1 1 A 208 208 ALA H H 208 7.898 8.269 -0.371 1 1 1188 . 4 1 1 A 208 208 ALA C C 208 175.411 176.820 -1.409 1 1 1189 . 4 1 1 A 208 208 ALA CA C 208 49.472 49.987 -0.515 1 1 1190 . 4 1 1 A 208 208 ALA CB C 208 19.082 21.382 -2.300 1 1 1191 . 4 1 1 A 208 208 ALA N N 208 127.450 122.690 4.760 1 1 1192 . 4 1 1 A 209 209 PRO C C 209 176.932 178.483 -1.551 1 1 1193 . 4 1 1 A 209 209 PRO CA C 209 62.736 65.225 -2.489 1 1 1194 . 4 1 1 A 209 209 PRO CB C 209 31.012 31.891 -0.879 1 1 1 . 5 1 1 A 2 2 ARG C C 2 175.857 175.658 0.199 1 1 2 . 5 1 1 A 2 2 ARG CA C 2 55.872 56.963 -1.091 1 1 3 . 5 1 1 A 2 2 ARG CB C 2 29.983 33.096 -3.113 1 1 5 . 5 1 1 A 3 3 ILE H H 3 8.238 7.638 0.600 1 1 9 . 5 1 1 A 3 3 ILE C C 3 175.763 175.282 0.481 1 1 10 . 5 1 1 A 3 3 ILE CA C 3 60.779 60.931 -0.152 1 1 11 . 5 1 1 A 3 3 ILE CB C 3 37.664 38.229 -0.565 1 1 15 . 5 1 1 A 3 3 ILE N N 3 122.580 116.496 6.084 1 1 16 . 5 1 1 A 4 4 MET H H 4 8.261 9.083 -0.822 1 1 17 . 5 1 1 A 4 4 MET C C 4 175.660 175.789 -0.129 1 1 18 . 5 1 1 A 4 4 MET CA C 4 54.893 54.381 0.512 1 1 19 . 5 1 1 A 4 4 MET CB C 4 32.060 32.793 -0.733 1 1 22 . 5 1 1 A 4 4 MET N N 4 123.988 125.949 -1.961 1 1 23 . 5 1 1 A 5 5 LYS H H 5 8.041 7.717 0.324 1 1 24 . 5 1 1 A 5 5 LYS C C 5 175.850 176.853 -1.003 1 1 25 . 5 1 1 A 5 5 LYS CA C 5 56.081 55.321 0.760 1 1 26 . 5 1 1 A 5 5 LYS CB C 5 32.220 33.440 -1.220 1 1 29 . 5 1 1 A 5 5 LYS N N 5 122.015 122.781 -0.766 1 1 30 . 5 1 1 A 6 6 ALA H H 6 8.042 8.142 -0.100 1 1 34 . 5 1 1 A 6 6 ALA C C 6 177.160 177.675 -0.515 1 1 35 . 5 1 1 A 6 6 ALA CA C 6 52.109 52.212 -0.103 1 1 36 . 5 1 1 A 6 6 ALA CB C 6 18.637 19.771 -1.134 1 1 37 . 5 1 1 A 6 6 ALA N N 6 123.943 124.146 -0.203 1 1 38 . 5 1 1 A 7 7 ILE H H 7 7.916 7.597 0.319 1 1 42 . 5 1 1 A 7 7 ILE C C 7 175.611 175.867 -0.256 1 1 43 . 5 1 1 A 7 7 ILE CA C 7 61.181 60.997 0.184 1 1 44 . 5 1 1 A 7 7 ILE CB C 7 37.910 37.808 0.102 1 1 48 . 5 1 1 A 7 7 ILE N N 7 118.380 115.013 3.367 1 1 49 . 5 1 1 A 8 8 PHE H H 8 8.167 8.005 0.162 1 1 50 . 5 1 1 A 8 8 PHE C C 8 175.363 176.034 -0.671 1 1 51 . 5 1 1 A 8 8 PHE CA C 8 57.286 56.948 0.338 1 1 52 . 5 1 1 A 8 8 PHE CB C 8 39.008 40.273 -1.265 1 1 53 . 5 1 1 A 8 8 PHE N N 8 121.971 123.166 -1.195 1 1 54 . 5 1 1 A 9 9 VAL H H 9 7.872 7.715 0.157 1 1 61 . 5 1 1 A 9 9 VAL C C 9 175.405 175.590 -0.185 1 1 62 . 5 1 1 A 9 9 VAL CA C 9 61.662 61.677 -0.015 1 1 63 . 5 1 1 A 9 9 VAL CB C 9 32.026 33.719 -1.693 1 1 66 . 5 1 1 A 9 9 VAL N N 9 120.864 114.508 6.356 1 1 67 . 5 1 1 A 10 10 LEU H H 10 8.077 7.761 0.316 1 1 74 . 5 1 1 A 10 10 LEU C C 10 176.652 175.316 1.336 1 1 75 . 5 1 1 A 10 10 LEU CA C 10 54.856 54.317 0.539 1 1 76 . 5 1 1 A 10 10 LEU CB C 10 41.401 43.040 -1.639 1 1 80 . 5 1 1 A 10 10 LEU N N 10 124.826 121.107 3.719 1 1 81 . 5 1 1 A 11 11 ASN H H 11 8.177 8.870 -0.693 1 1 82 . 5 1 1 A 11 11 ASN C C 11 174.394 175.002 -0.608 1 1 83 . 5 1 1 A 11 11 ASN CA C 11 52.704 53.699 -0.995 1 1 84 . 5 1 1 A 11 11 ASN CB C 11 38.468 38.413 0.055 1 1 85 . 5 1 1 A 11 11 ASN N N 11 119.029 124.153 -5.124 1 1 86 . 5 1 1 A 12 12 ALA H H 12 7.991 8.737 -0.746 1 1 90 . 5 1 1 A 12 12 ALA C C 12 176.649 176.373 0.276 1 1 91 . 5 1 1 A 12 12 ALA CA C 12 51.950 54.596 -2.646 1 1 92 . 5 1 1 A 12 12 ALA CB C 12 18.659 18.822 -0.163 1 1 93 . 5 1 1 A 12 12 ALA N N 12 123.695 126.369 -2.674 1 1 94 . 5 1 1 A 13 13 ALA H H 13 8.083 7.792 0.291 1 1 95 . 5 1 1 A 13 13 ALA C C 13 175.395 174.885 0.510 1 1 96 . 5 1 1 A 13 13 ALA CA C 13 49.797 49.458 0.339 1 1 97 . 5 1 1 A 13 13 ALA CB C 13 17.486 19.587 -2.101 1 1 98 . 5 1 1 A 13 13 ALA N N 13 124.281 118.121 6.160 1 1 99 . 5 1 1 A 14 14 PRO C C 14 176.641 176.676 -0.035 1 1 100 . 5 1 1 A 14 14 PRO CA C 14 62.675 62.976 -0.301 1 1 101 . 5 1 1 A 14 14 PRO CB C 14 31.000 32.651 -1.651 1 1 103 . 5 1 1 A 15 15 LYS H H 15 8.283 8.981 -0.698 1 1 104 . 5 1 1 A 15 15 LYS C C 15 175.683 176.740 -1.057 1 1 105 . 5 1 1 A 15 15 LYS CA C 15 55.429 57.328 -1.899 1 1 106 . 5 1 1 A 15 15 LYS CB C 15 32.246 33.964 -1.718 1 1 109 . 5 1 1 A 15 15 LYS N N 15 119.069 119.831 -0.762 1 1 110 . 5 1 1 A 16 16 ASP H H 16 7.880 7.714 0.166 1 1 111 . 5 1 1 A 16 16 ASP C C 16 175.419 176.156 -0.737 1 1 112 . 5 1 1 A 16 16 ASP CA C 16 54.413 54.161 0.252 1 1 113 . 5 1 1 A 16 16 ASP CB C 16 40.224 40.146 0.078 1 1 114 . 5 1 1 A 16 16 ASP N N 16 119.625 119.383 0.242 1 1 115 . 5 1 1 A 17 17 ASN H H 17 7.973 8.884 -0.911 1 1 116 . 5 1 1 A 17 17 ASN C C 17 174.231 175.560 -1.329 1 1 117 . 5 1 1 A 17 17 ASN CA C 17 53.948 55.602 -1.654 1 1 118 . 5 1 1 A 17 17 ASN CB C 17 37.009 40.179 -3.170 1 1 119 . 5 1 1 A 17 17 ASN N N 17 118.063 124.821 -6.758 1 1 120 . 5 1 1 A 18 18 THR H H 18 7.318 7.786 -0.468 1 1 121 . 5 1 1 A 18 18 THR C C 18 172.323 173.469 -1.146 1 1 122 . 5 1 1 A 18 18 THR CA C 18 60.153 61.356 -1.203 1 1 123 . 5 1 1 A 18 18 THR CB C 18 71.534 72.485 -0.951 1 1 125 . 5 1 1 A 18 18 THR N N 18 109.092 110.879 -1.787 1 1 126 . 5 1 1 A 19 19 TRP H H 19 8.541 8.153 0.388 1 1 127 . 5 1 1 A 19 19 TRP C C 19 175.969 173.006 2.963 1 1 128 . 5 1 1 A 19 19 TRP CA C 19 55.700 55.032 0.668 1 1 129 . 5 1 1 A 19 19 TRP CB C 19 31.471 32.015 -0.544 1 1 130 . 5 1 1 A 19 19 TRP N N 19 121.992 123.479 -1.487 1 1 131 . 5 1 1 A 20 20 TYR H H 20 8.691 8.462 0.229 1 1 132 . 5 1 1 A 20 20 TYR C C 20 173.684 173.369 0.315 1 1 133 . 5 1 1 A 20 20 TYR CA C 20 55.805 55.452 0.353 1 1 134 . 5 1 1 A 20 20 TYR CB C 20 40.513 42.453 -1.940 1 1 135 . 5 1 1 A 20 20 TYR N N 20 116.519 118.002 -1.483 1 1 136 . 5 1 1 A 21 21 ALA H H 21 8.876 9.051 -0.175 1 1 137 . 5 1 1 A 21 21 ALA C C 21 175.395 176.966 -1.571 1 1 138 . 5 1 1 A 21 21 ALA CA C 21 50.970 51.030 -0.060 1 1 139 . 5 1 1 A 21 21 ALA CB C 21 22.142 23.721 -1.579 1 1 140 . 5 1 1 A 21 21 ALA N N 21 119.359 123.050 -3.691 1 1 141 . 5 1 1 A 22 22 GLY H H 22 8.613 8.551 0.062 1 1 142 . 5 1 1 A 22 22 GLY C C 22 171.458 172.601 -1.143 1 1 143 . 5 1 1 A 22 22 GLY CA C 22 45.608 46.377 -0.769 1 1 144 . 5 1 1 A 22 22 GLY N N 22 106.678 106.461 0.217 1 1 145 . 5 1 1 A 23 23 GLY H H 23 7.911 8.579 -0.668 1 1 146 . 5 1 1 A 23 23 GLY C C 23 170.563 172.050 -1.487 1 1 147 . 5 1 1 A 23 23 GLY CA C 23 44.026 44.709 -0.683 1 1 148 . 5 1 1 A 23 23 GLY N N 23 103.399 109.150 -5.751 1 1 149 . 5 1 1 A 24 24 LYS H H 24 9.001 9.335 -0.334 1 1 150 . 5 1 1 A 24 24 LYS C C 24 172.965 174.621 -1.656 1 1 151 . 5 1 1 A 24 24 LYS CA C 24 54.062 54.979 -0.917 1 1 152 . 5 1 1 A 24 24 LYS CB C 24 36.774 36.364 0.410 1 1 156 . 5 1 1 A 24 24 LYS N N 24 116.402 122.495 -6.093 1 1 157 . 5 1 1 A 25 25 LEU H H 25 8.587 9.406 -0.819 1 1 164 . 5 1 1 A 25 25 LEU C C 25 175.205 175.595 -0.390 1 1 165 . 5 1 1 A 25 25 LEU CA C 25 53.446 53.472 -0.026 1 1 166 . 5 1 1 A 25 25 LEU CB C 25 46.287 46.820 -0.533 1 1 170 . 5 1 1 A 25 25 LEU N N 25 119.932 126.640 -6.708 1 1 171 . 5 1 1 A 26 26 GLY H H 26 8.637 8.304 0.333 1 1 172 . 5 1 1 A 26 26 GLY C C 26 170.804 171.742 -0.938 1 1 173 . 5 1 1 A 26 26 GLY CA C 26 45.669 46.250 -0.581 1 1 174 . 5 1 1 A 26 26 GLY N N 26 108.136 110.724 -2.588 1 1 175 . 5 1 1 A 27 27 TRP H H 27 8.642 8.696 -0.054 1 1 177 . 5 1 1 A 27 27 TRP C C 27 174.820 176.227 -1.407 1 1 178 . 5 1 1 A 27 27 TRP CB C 27 30.883 32.088 -1.205 1 1 179 . 5 1 1 A 27 27 TRP N N 27 120.887 120.960 -0.073 1 1 181 . 5 1 1 A 32 32 ASP C C 32 176.315 176.592 -0.277 1 1 182 . 5 1 1 A 32 32 ASP CA C 32 53.737 53.400 0.337 1 1 183 . 5 1 1 A 32 32 ASP CB C 32 41.230 41.873 -0.643 1 1 184 . 5 1 1 A 33 33 THR H H 33 8.190 7.761 0.429 1 1 188 . 5 1 1 A 33 33 THR C C 33 175.291 174.466 0.825 1 1 189 . 5 1 1 A 33 33 THR CA C 33 61.909 62.364 -0.455 1 1 190 . 5 1 1 A 33 33 THR CB C 33 68.961 71.083 -2.122 1 1 192 . 5 1 1 A 33 33 THR N N 33 114.235 111.940 2.295 1 1 193 . 5 1 1 A 34 34 GLY H H 34 8.341 8.092 0.249 1 1 194 . 5 1 1 A 34 34 GLY C C 34 173.766 172.662 1.104 1 1 195 . 5 1 1 A 34 34 GLY CA C 34 44.941 46.033 -1.092 1 1 196 . 5 1 1 A 34 34 GLY N N 34 110.678 111.183 -0.505 1 1 197 . 5 1 1 A 35 35 PHE H H 35 7.945 8.637 -0.692 1 1 198 . 5 1 1 A 35 35 PHE C C 35 175.411 174.013 1.398 1 1 199 . 5 1 1 A 35 35 PHE CA C 35 57.921 57.671 0.250 1 1 200 . 5 1 1 A 35 35 PHE CB C 35 38.806 42.505 -3.699 1 1 201 . 5 1 1 A 35 35 PHE N N 35 120.533 123.346 -2.813 1 1 202 . 5 1 1 A 36 36 TYR H H 36 7.967 8.821 -0.854 1 1 203 . 5 1 1 A 36 36 TYR C C 36 176.104 176.308 -0.204 1 1 204 . 5 1 1 A 36 36 TYR CA C 36 57.568 56.623 0.945 1 1 205 . 5 1 1 A 36 36 TYR CB C 36 37.727 39.566 -1.839 1 1 206 . 5 1 1 A 36 36 TYR N N 36 120.254 126.013 -5.759 1 1 207 . 5 1 1 A 37 37 GLY H H 37 7.666 8.440 -0.774 1 1 208 . 5 1 1 A 37 37 GLY C C 37 173.794 172.572 1.222 1 1 209 . 5 1 1 A 37 37 GLY CA C 37 45.007 44.633 0.374 1 1 210 . 5 1 1 A 37 37 GLY N N 37 108.995 110.895 -1.900 1 1 211 . 5 1 1 A 38 38 ASN H H 38 8.109 8.466 -0.357 1 1 212 . 5 1 1 A 38 38 ASN C C 38 175.612 175.344 0.268 1 1 213 . 5 1 1 A 38 38 ASN CA C 38 52.954 53.876 -0.922 1 1 214 . 5 1 1 A 38 38 ASN CB C 38 38.425 39.495 -1.070 1 1 215 . 5 1 1 A 38 38 ASN N N 38 118.603 119.932 -1.329 1 1 216 . 5 1 1 A 39 39 GLY H H 39 8.202 8.515 -0.313 1 1 217 . 5 1 1 A 39 39 GLY C C 39 173.958 174.995 -1.037 1 1 218 . 5 1 1 A 39 39 GLY CA C 39 45.012 44.053 0.959 1 1 219 . 5 1 1 A 39 39 GLY N N 39 108.897 112.331 -3.434 1 1 220 . 5 1 1 A 40 40 PHE H H 40 7.960 8.895 -0.935 1 1 221 . 5 1 1 A 40 40 PHE C C 40 175.653 175.592 0.061 1 1 222 . 5 1 1 A 40 40 PHE CA C 40 57.556 60.859 -3.303 1 1 223 . 5 1 1 A 40 40 PHE CB C 40 38.513 40.033 -1.520 1 1 224 . 5 1 1 A 40 40 PHE N N 40 119.829 119.246 0.583 1 1 225 . 5 1 1 A 41 41 GLN H H 41 8.173 7.733 0.440 1 1 226 . 5 1 1 A 41 41 GLN C C 41 175.234 174.064 1.170 1 1 227 . 5 1 1 A 41 41 GLN CA C 41 55.488 55.137 0.351 1 1 228 . 5 1 1 A 41 41 GLN CB C 41 28.523 28.818 -0.295 1 1 230 . 5 1 1 A 41 41 GLN N N 41 120.810 113.239 7.571 1 1 231 . 5 1 1 A 42 42 ASN H H 42 8.193 8.956 -0.763 1 1 232 . 5 1 1 A 42 42 ASN C C 42 174.618 173.906 0.712 1 1 233 . 5 1 1 A 42 42 ASN CA C 42 52.924 52.049 0.875 1 1 234 . 5 1 1 A 42 42 ASN CB C 42 38.333 42.052 -3.719 1 1 235 . 5 1 1 A 42 42 ASN N N 42 119.679 123.298 -3.619 1 1 236 . 5 1 1 A 43 43 ASN H H 43 8.255 8.640 -0.385 1 1 237 . 5 1 1 A 43 43 ASN C C 43 173.873 174.172 -0.299 1 1 238 . 5 1 1 A 43 43 ASN CA C 43 52.919 52.003 0.916 1 1 239 . 5 1 1 A 43 43 ASN CB C 43 38.580 42.420 -3.840 1 1 240 . 5 1 1 A 43 43 ASN N N 43 119.773 116.268 3.505 1 1 241 . 5 1 1 A 44 44 ASN H H 44 7.865 8.816 -0.951 1 1 242 . 5 1 1 A 44 44 ASN C C 44 175.518 175.652 -0.134 1 1 243 . 5 1 1 A 44 44 ASN CA C 44 54.528 51.605 2.923 1 1 244 . 5 1 1 A 44 44 ASN CB C 44 40.170 42.269 -2.099 1 1 246 . 5 1 1 A 44 44 ASN N N 44 124.152 117.140 7.012 1 1 247 . 5 1 1 A 46 46 PRO C C 46 177.228 177.131 0.097 1 1 248 . 5 1 1 A 46 46 PRO CA C 46 62.794 62.935 -0.141 1 1 249 . 5 1 1 A 46 46 PRO CB C 46 31.283 33.154 -1.871 1 1 251 . 5 1 1 A 47 47 THR H H 47 8.165 8.233 -0.068 1 1 255 . 5 1 1 A 47 47 THR C C 47 174.573 175.397 -0.824 1 1 256 . 5 1 1 A 47 47 THR CA C 47 61.346 63.917 -2.571 1 1 257 . 5 1 1 A 47 47 THR CB C 47 69.573 69.326 0.247 1 1 259 . 5 1 1 A 47 47 THR N N 47 114.265 110.729 3.536 1 1 260 . 5 1 1 A 48 48 ARG H H 48 8.237 7.648 0.589 1 1 261 . 5 1 1 A 48 48 ARG C C 48 175.898 175.705 0.193 1 1 262 . 5 1 1 A 48 48 ARG CA C 48 55.717 55.578 0.139 1 1 263 . 5 1 1 A 48 48 ARG CB C 48 30.151 31.637 -1.486 1 1 266 . 5 1 1 A 48 48 ARG N N 48 122.795 121.456 1.339 1 1 267 . 5 1 1 A 49 49 ASN H H 49 8.369 8.859 -0.490 1 1 268 . 5 1 1 A 49 49 ASN C C 49 174.560 174.234 0.326 1 1 269 . 5 1 1 A 49 49 ASN CA C 49 53.005 51.854 1.151 1 1 270 . 5 1 1 A 49 49 ASN CB C 49 38.761 41.486 -2.725 1 1 271 . 5 1 1 A 49 49 ASN N N 49 119.837 119.720 0.117 1 1 272 . 5 1 1 A 50 50 ASP H H 50 8.192 8.648 -0.456 1 1 273 . 5 1 1 A 50 50 ASP C C 50 175.699 174.509 1.190 1 1 274 . 5 1 1 A 50 50 ASP CA C 50 54.289 53.272 1.017 1 1 275 . 5 1 1 A 50 50 ASP CB C 50 41.264 39.050 2.214 1 1 276 . 5 1 1 A 50 50 ASP N N 50 120.403 123.494 -3.091 1 1 277 . 5 1 1 A 51 51 GLN H H 51 8.428 8.548 -0.120 1 1 278 . 5 1 1 A 51 51 GLN C C 51 175.186 174.606 0.580 1 1 279 . 5 1 1 A 51 51 GLN CA C 51 54.512 54.786 -0.274 1 1 280 . 5 1 1 A 51 51 GLN CB C 51 30.424 27.538 2.886 1 1 282 . 5 1 1 A 51 51 GLN N N 51 118.959 123.282 -4.323 1 1 289 . 5 1 1 A 52 52 LEU C C 52 176.018 175.372 0.646 1 1 290 . 5 1 1 A 52 52 LEU CA C 52 54.332 52.573 1.759 1 1 291 . 5 1 1 A 52 52 LEU CB C 52 43.022 45.604 -2.582 1 1 294 . 5 1 1 A 53 53 GLY H H 53 8.639 8.950 -0.311 1 1 295 . 5 1 1 A 53 53 GLY C C 53 171.931 172.097 -0.166 1 1 296 . 5 1 1 A 53 53 GLY CA C 53 43.501 44.239 -0.738 1 1 297 . 5 1 1 A 53 53 GLY N N 53 109.964 107.873 2.091 1 1 298 . 5 1 1 A 54 54 ALA H H 54 8.881 9.040 -0.159 1 1 299 . 5 1 1 A 54 54 ALA C C 54 175.543 176.578 -1.035 1 1 300 . 5 1 1 A 54 54 ALA CA C 54 50.710 51.118 -0.408 1 1 301 . 5 1 1 A 54 54 ALA CB C 54 22.914 22.976 -0.062 1 1 302 . 5 1 1 A 54 54 ALA N N 54 120.413 124.713 -4.300 1 1 303 . 5 1 1 A 55 55 GLY H H 55 8.346 8.716 -0.370 1 1 304 . 5 1 1 A 55 55 GLY C C 55 170.960 171.988 -1.028 1 1 305 . 5 1 1 A 55 55 GLY CA C 55 46.704 45.508 1.196 1 1 306 . 5 1 1 A 55 55 GLY N N 55 104.688 108.082 -3.394 1 1 307 . 5 1 1 A 56 56 ALA H H 56 9.116 8.187 0.929 1 1 308 . 5 1 1 A 56 56 ALA C C 56 176.472 176.903 -0.431 1 1 309 . 5 1 1 A 56 56 ALA CA C 56 49.638 50.978 -1.340 1 1 310 . 5 1 1 A 56 56 ALA CB C 56 22.275 20.826 1.449 1 1 311 . 5 1 1 A 56 56 ALA N N 56 120.608 122.048 -1.440 1 1 312 . 5 1 1 A 57 57 PHE H H 57 8.688 9.325 -0.637 1 1 313 . 5 1 1 A 57 57 PHE C C 57 172.816 175.229 -2.413 1 1 314 . 5 1 1 A 57 57 PHE CA C 57 56.066 56.449 -0.383 1 1 315 . 5 1 1 A 57 57 PHE CB C 57 41.770 43.174 -1.404 1 1 316 . 5 1 1 A 57 57 PHE N N 57 120.027 118.639 1.388 1 1 317 . 5 1 1 A 58 58 GLY H H 58 9.034 9.028 0.006 1 1 318 . 5 1 1 A 58 58 GLY C C 58 170.860 172.428 -1.568 1 1 319 . 5 1 1 A 58 58 GLY CA C 58 44.954 44.845 0.109 1 1 320 . 5 1 1 A 58 58 GLY N N 58 105.817 111.240 -5.423 1 1 321 . 5 1 1 A 59 59 GLY H H 59 8.382 9.779 -1.397 1 1 322 . 5 1 1 A 59 59 GLY C C 59 169.284 171.790 -2.506 1 1 323 . 5 1 1 A 59 59 GLY CA C 59 45.840 44.682 1.158 1 1 324 . 5 1 1 A 59 59 GLY N N 59 109.059 113.266 -4.207 1 1 325 . 5 1 1 A 60 60 TYR H H 60 8.430 9.267 -0.837 1 1 326 . 5 1 1 A 60 60 TYR C C 60 173.453 174.232 -0.779 1 1 327 . 5 1 1 A 60 60 TYR CA C 60 55.282 56.661 -1.379 1 1 328 . 5 1 1 A 60 60 TYR CB C 60 41.712 41.106 0.606 1 1 329 . 5 1 1 A 60 60 TYR N N 60 118.352 123.380 -5.028 1 1 330 . 5 1 1 A 61 61 GLN H H 61 8.833 9.053 -0.220 1 1 331 . 5 1 1 A 61 61 GLN C C 61 174.365 174.940 -0.575 1 1 332 . 5 1 1 A 61 61 GLN CA C 61 54.125 54.936 -0.811 1 1 333 . 5 1 1 A 61 61 GLN CB C 61 28.033 30.261 -2.228 1 1 335 . 5 1 1 A 61 61 GLN N N 61 129.628 124.817 4.811 1 1 336 . 5 1 1 A 62 62 VAL H H 62 8.714 8.663 0.051 1 1 343 . 5 1 1 A 62 62 VAL C C 62 175.758 175.308 0.450 1 1 344 . 5 1 1 A 62 62 VAL CA C 62 64.649 63.199 1.450 1 1 345 . 5 1 1 A 62 62 VAL CB C 62 31.900 33.973 -2.073 1 1 348 . 5 1 1 A 62 62 VAL N N 62 127.666 126.135 1.531 1 1 349 . 5 1 1 A 63 63 ASN H H 63 8.062 7.978 0.084 1 1 350 . 5 1 1 A 63 63 ASN C C 63 172.827 173.631 -0.804 1 1 351 . 5 1 1 A 63 63 ASN CA C 63 51.575 49.496 2.079 1 1 352 . 5 1 1 A 63 63 ASN CB C 63 37.194 40.120 -2.926 1 1 353 . 5 1 1 A 63 63 ASN N N 63 116.310 117.207 -0.897 1 1 354 . 5 1 1 A 64 64 PRO C C 64 175.071 175.999 -0.928 1 1 355 . 5 1 1 A 64 64 PRO CA C 64 65.296 62.413 2.883 1 1 356 . 5 1 1 A 64 64 PRO CB C 64 30.428 29.261 1.167 1 1 357 . 5 1 1 A 65 65 TYR H H 65 7.873 8.780 -0.907 1 1 358 . 5 1 1 A 65 65 TYR C C 65 175.145 174.978 0.167 1 1 359 . 5 1 1 A 65 65 TYR CA C 65 56.125 58.675 -2.550 1 1 360 . 5 1 1 A 65 65 TYR CB C 65 39.189 40.798 -1.609 1 1 361 . 5 1 1 A 65 65 TYR N N 65 112.894 123.044 -10.150 1 1 362 . 5 1 1 A 66 66 LEU H H 66 7.308 7.676 -0.368 1 1 369 . 5 1 1 A 66 66 LEU C C 66 173.866 174.479 -0.613 1 1 370 . 5 1 1 A 66 66 LEU CA C 66 53.431 53.941 -0.510 1 1 371 . 5 1 1 A 66 66 LEU CB C 66 44.958 44.484 0.474 1 1 375 . 5 1 1 A 66 66 LEU N N 66 120.270 116.665 3.605 1 1 376 . 5 1 1 A 67 67 GLY H H 67 8.855 8.835 0.020 1 1 377 . 5 1 1 A 67 67 GLY C C 67 170.698 171.909 -1.211 1 1 378 . 5 1 1 A 67 67 GLY CA C 67 44.008 44.153 -0.145 1 1 379 . 5 1 1 A 67 67 GLY N N 67 114.388 106.587 7.801 1 1 380 . 5 1 1 A 68 68 PHE H H 68 8.770 8.625 0.145 1 1 381 . 5 1 1 A 68 68 PHE C C 68 173.386 175.142 -1.756 1 1 382 . 5 1 1 A 68 68 PHE CA C 68 56.507 58.078 -1.571 1 1 383 . 5 1 1 A 68 68 PHE CB C 68 42.428 40.305 2.123 1 1 384 . 5 1 1 A 68 68 PHE N N 68 117.510 119.452 -1.942 1 1 385 . 5 1 1 A 69 69 GLU H H 69 9.079 9.664 -0.585 1 1 386 . 5 1 1 A 69 69 GLU C C 69 174.556 175.153 -0.597 1 1 387 . 5 1 1 A 69 69 GLU CA C 69 54.939 55.124 -0.185 1 1 388 . 5 1 1 A 69 69 GLU CB C 69 33.963 31.450 2.513 1 1 390 . 5 1 1 A 69 69 GLU N N 69 120.562 124.206 -3.644 1 1 391 . 5 1 1 A 70 70 MET H H 70 9.481 9.285 0.196 1 1 392 . 5 1 1 A 70 70 MET C C 70 174.595 175.812 -1.217 1 1 393 . 5 1 1 A 70 70 MET CA C 70 53.091 54.173 -1.082 1 1 394 . 5 1 1 A 70 70 MET CB C 70 36.159 34.274 1.885 1 1 397 . 5 1 1 A 70 70 MET N N 70 124.928 126.512 -1.584 1 1 398 . 5 1 1 A 71 71 GLY H H 71 8.845 9.059 -0.214 1 1 399 . 5 1 1 A 71 71 GLY C C 71 170.811 171.464 -0.653 1 1 400 . 5 1 1 A 71 71 GLY CA C 71 44.624 43.792 0.832 1 1 401 . 5 1 1 A 71 71 GLY N N 71 108.896 112.391 -3.495 1 1 402 . 5 1 1 A 72 72 TYR H H 72 8.925 9.020 -0.095 1 1 403 . 5 1 1 A 72 72 TYR C C 72 173.278 173.781 -0.503 1 1 404 . 5 1 1 A 72 72 TYR CA C 72 55.912 56.331 -0.419 1 1 405 . 5 1 1 A 72 72 TYR CB C 72 41.611 40.729 0.882 1 1 406 . 5 1 1 A 72 72 TYR N N 72 123.253 121.640 1.613 1 1 407 . 5 1 1 A 73 73 ASP H H 73 8.665 9.129 -0.464 1 1 408 . 5 1 1 A 73 73 ASP C C 73 173.598 175.007 -1.409 1 1 409 . 5 1 1 A 73 73 ASP CA C 73 52.857 54.150 -1.293 1 1 410 . 5 1 1 A 73 73 ASP CB C 73 42.774 42.064 0.710 1 1 411 . 5 1 1 A 73 73 ASP N N 73 126.178 126.070 0.108 1 1 412 . 5 1 1 A 74 74 TRP H H 74 9.080 8.978 0.102 1 1 413 . 5 1 1 A 74 74 TRP C C 74 174.868 174.753 0.115 1 1 414 . 5 1 1 A 74 74 TRP CB C 74 30.083 32.166 -2.083 1 1 415 . 5 1 1 A 74 74 TRP N N 74 121.824 125.289 -3.465 1 1 416 . 5 1 1 A 78 78 MET C C 78 174.548 175.598 -1.050 1 1 417 . 5 1 1 A 78 78 MET CA C 78 54.388 56.789 -2.401 1 1 418 . 5 1 1 A 78 78 MET CB C 78 32.542 34.139 -1.597 1 1 419 . 5 1 1 A 79 79 ALA H H 79 8.105 8.099 0.006 1 1 420 . 5 1 1 A 79 79 ALA C C 79 176.629 178.037 -1.408 1 1 421 . 5 1 1 A 79 79 ALA CA C 79 51.210 51.848 -0.638 1 1 422 . 5 1 1 A 79 79 ALA CB C 79 19.106 19.631 -0.525 1 1 423 . 5 1 1 A 79 79 ALA N N 79 125.778 123.018 2.760 1 1 424 . 5 1 1 A 80 80 TYR H H 80 8.035 8.479 -0.444 1 1 425 . 5 1 1 A 80 80 TYR C C 80 175.604 176.754 -1.150 1 1 426 . 5 1 1 A 80 80 TYR CA C 80 57.021 58.433 -1.412 1 1 427 . 5 1 1 A 80 80 TYR CB C 80 38.416 39.797 -1.381 1 1 428 . 5 1 1 A 80 80 TYR N N 80 120.045 116.534 3.511 1 1 429 . 5 1 1 A 81 81 LYS H H 81 8.295 6.952 1.343 1 1 430 . 5 1 1 A 81 81 LYS C C 81 176.647 175.171 1.476 1 1 431 . 5 1 1 A 81 81 LYS CA C 81 56.285 55.018 1.267 1 1 432 . 5 1 1 A 81 81 LYS CB C 81 31.571 32.992 -1.421 1 1 434 . 5 1 1 A 81 81 LYS N N 81 123.191 118.344 4.847 1 1 435 . 5 1 1 A 82 82 GLY H H 82 8.117 7.273 0.844 1 1 436 . 5 1 1 A 82 82 GLY C C 82 174.010 173.207 0.803 1 1 437 . 5 1 1 A 82 82 GLY CA C 82 44.982 45.425 -0.443 1 1 438 . 5 1 1 A 82 82 GLY N N 82 110.014 107.888 2.126 1 1 439 . 5 1 1 A 83 83 SER H H 83 7.938 9.080 -1.142 1 1 440 . 5 1 1 A 83 83 SER C C 83 174.634 174.121 0.513 1 1 441 . 5 1 1 A 83 83 SER CA C 83 57.685 57.347 0.338 1 1 442 . 5 1 1 A 83 83 SER CB C 83 63.303 64.409 -1.106 1 1 443 . 5 1 1 A 83 83 SER N N 83 115.655 121.327 -5.672 1 1 444 . 5 1 1 A 84 84 VAL H H 84 8.008 7.652 0.356 1 1 451 . 5 1 1 A 84 84 VAL C C 84 175.525 175.069 0.456 1 1 452 . 5 1 1 A 84 84 VAL CA C 84 61.769 60.720 1.049 1 1 453 . 5 1 1 A 84 84 VAL CB C 84 31.711 31.492 0.219 1 1 456 . 5 1 1 A 84 84 VAL N N 84 120.054 117.689 2.365 1 1 457 . 5 1 1 A 85 85 ASP H H 85 8.140 8.255 -0.115 1 1 458 . 5 1 1 A 85 85 ASP C C 85 174.740 175.975 -1.235 1 1 459 . 5 1 1 A 85 85 ASP CA C 85 53.983 52.731 1.252 1 1 460 . 5 1 1 A 85 85 ASP CB C 85 40.633 43.731 -3.098 1 1 461 . 5 1 1 A 85 85 ASP N N 85 122.510 124.425 -1.915 1 1 462 . 5 1 1 A 86 86 ASN H H 86 7.736 8.687 -0.951 1 1 463 . 5 1 1 A 86 86 ASN C C 86 175.970 176.978 -1.008 1 1 464 . 5 1 1 A 86 86 ASN CA C 86 54.349 54.347 0.002 1 1 465 . 5 1 1 A 86 86 ASN CB C 86 40.490 39.378 1.112 1 1 467 . 5 1 1 A 86 86 ASN N N 86 124.290 117.791 6.499 1 1 468 . 5 1 1 A 87 87 GLY H H 87 8.000 8.698 -0.698 1 1 469 . 5 1 1 A 87 87 GLY C C 87 173.456 175.356 -1.900 1 1 470 . 5 1 1 A 87 87 GLY CA C 87 44.973 45.601 -0.628 1 1 471 . 5 1 1 A 87 87 GLY N N 87 113.494 111.563 1.931 1 1 472 . 5 1 1 A 88 88 ALA H H 88 8.024 8.094 -0.070 1 1 473 . 5 1 1 A 88 88 ALA C C 88 176.833 177.598 -0.765 1 1 474 . 5 1 1 A 88 88 ALA CA C 88 51.734 54.758 -3.024 1 1 475 . 5 1 1 A 88 88 ALA CB C 88 19.818 19.826 -0.008 1 1 476 . 5 1 1 A 88 88 ALA N N 88 122.676 120.935 1.741 1 1 477 . 5 1 1 A 91 91 ALA C C 91 174.781 175.226 -0.445 1 1 478 . 5 1 1 A 91 91 ALA CA C 91 50.537 51.781 -1.244 1 1 479 . 5 1 1 A 91 91 ALA CB C 91 21.324 22.469 -1.145 1 1 480 . 5 1 1 A 92 92 GLN H H 92 8.451 8.773 -0.322 1 1 481 . 5 1 1 A 92 92 GLN C C 92 173.557 175.006 -1.449 1 1 482 . 5 1 1 A 92 92 GLN CA C 92 53.380 54.308 -0.928 1 1 484 . 5 1 1 A 92 92 GLN N N 92 116.847 117.833 -0.986 1 1 485 . 5 1 1 A 93 93 GLY C C 93 170.631 172.280 -1.649 1 1 486 . 5 1 1 A 93 93 GLY CA C 93 45.718 44.526 1.192 1 1 487 . 5 1 1 A 94 94 VAL H H 94 8.686 9.450 -0.764 1 1 494 . 5 1 1 A 94 94 VAL C C 94 173.698 174.661 -0.963 1 1 495 . 5 1 1 A 94 94 VAL CA C 94 58.997 59.915 -0.918 1 1 496 . 5 1 1 A 94 94 VAL CB C 94 33.311 33.743 -0.432 1 1 499 . 5 1 1 A 94 94 VAL N N 94 118.489 120.138 -1.649 1 1 500 . 5 1 1 A 95 95 GLN H H 95 9.468 9.466 0.002 1 1 501 . 5 1 1 A 95 95 GLN C C 95 174.028 174.364 -0.336 1 1 502 . 5 1 1 A 95 95 GLN CA C 95 52.547 54.446 -1.899 1 1 503 . 5 1 1 A 95 95 GLN CB C 95 33.816 31.527 2.289 1 1 505 . 5 1 1 A 95 95 GLN N N 95 122.106 126.047 -3.941 1 1 506 . 5 1 1 A 96 96 LEU H H 96 8.484 9.023 -0.539 1 1 513 . 5 1 1 A 96 96 LEU C C 96 175.322 174.978 0.344 1 1 514 . 5 1 1 A 96 96 LEU CA C 96 53.736 53.907 -0.171 1 1 515 . 5 1 1 A 96 96 LEU CB C 96 41.088 44.863 -3.775 1 1 519 . 5 1 1 A 96 96 LEU N N 96 123.224 125.389 -2.165 1 1 520 . 5 1 1 A 97 97 THR H H 97 9.116 8.950 0.166 1 1 521 . 5 1 1 A 97 97 THR C C 97 173.251 173.000 0.251 1 1 522 . 5 1 1 A 97 97 THR CA C 97 58.931 60.754 -1.823 1 1 523 . 5 1 1 A 97 97 THR CB C 97 72.984 71.147 1.837 1 1 525 . 5 1 1 A 97 97 THR N N 97 112.504 118.685 -6.181 1 1 526 . 5 1 1 A 98 98 ALA H H 98 8.603 8.799 -0.196 1 1 527 . 5 1 1 A 98 98 ALA C C 98 174.948 176.849 -1.901 1 1 528 . 5 1 1 A 98 98 ALA CA C 98 49.980 50.511 -0.531 1 1 529 . 5 1 1 A 98 98 ALA CB C 98 19.157 20.671 -1.514 1 1 530 . 5 1 1 A 98 98 ALA N N 98 121.608 126.773 -5.165 1 1 531 . 5 1 1 A 99 99 LYS H H 99 8.890 9.247 -0.357 1 1 532 . 5 1 1 A 99 99 LYS C C 99 174.294 175.764 -1.470 1 1 533 . 5 1 1 A 99 99 LYS CA C 99 54.019 54.833 -0.814 1 1 534 . 5 1 1 A 99 99 LYS CB C 99 33.018 35.446 -2.428 1 1 538 . 5 1 1 A 99 99 LYS N N 99 124.522 120.239 4.283 1 1 539 . 5 1 1 A 100 100 LEU H H 100 8.985 9.380 -0.395 1 1 546 . 5 1 1 A 100 100 LEU C C 100 175.265 175.188 0.077 1 1 547 . 5 1 1 A 100 100 LEU CA C 100 52.698 53.284 -0.586 1 1 548 . 5 1 1 A 100 100 LEU CB C 100 42.889 44.963 -2.074 1 1 552 . 5 1 1 A 100 100 LEU N N 100 131.876 122.128 9.748 1 1 553 . 5 1 1 A 101 101 GLY H H 101 9.137 9.004 0.133 1 1 554 . 5 1 1 A 101 101 GLY C C 101 170.798 172.106 -1.308 1 1 555 . 5 1 1 A 101 101 GLY CA C 101 44.429 44.239 0.190 1 1 556 . 5 1 1 A 101 101 GLY N N 101 111.928 109.169 2.759 1 1 557 . 5 1 1 A 102 102 TYR H H 102 8.779 8.217 0.562 1 1 558 . 5 1 1 A 102 102 TYR C C 102 173.402 173.748 -0.346 1 1 559 . 5 1 1 A 102 102 TYR CA C 102 54.444 56.519 -2.075 1 1 560 . 5 1 1 A 102 102 TYR CB C 102 42.239 42.078 0.161 1 1 561 . 5 1 1 A 102 102 TYR N N 102 116.664 119.268 -2.604 1 1 562 . 5 1 1 A 103 103 PRO C C 103 175.676 176.135 -0.459 1 1 563 . 5 1 1 A 103 103 PRO CA C 103 61.462 62.569 -1.107 1 1 564 . 5 1 1 A 103 103 PRO CB C 103 30.073 33.225 -3.152 1 1 565 . 5 1 1 A 104 104 ILE H H 104 8.670 8.894 -0.224 1 1 569 . 5 1 1 A 104 104 ILE C C 104 176.646 175.889 0.757 1 1 570 . 5 1 1 A 104 104 ILE CA C 104 62.054 62.020 0.034 1 1 571 . 5 1 1 A 104 104 ILE CB C 104 37.678 38.745 -1.067 1 1 574 . 5 1 1 A 104 104 ILE N N 104 125.939 119.288 6.651 1 1 575 . 5 1 1 A 105 105 THR H H 105 8.129 7.934 0.195 1 1 576 . 5 1 1 A 105 105 THR C C 105 174.344 173.779 0.565 1 1 577 . 5 1 1 A 105 105 THR CA C 105 59.176 61.168 -1.992 1 1 578 . 5 1 1 A 105 105 THR CB C 105 71.049 70.892 0.157 1 1 580 . 5 1 1 A 105 105 THR N N 105 109.853 111.172 -1.319 1 1 581 . 5 1 1 A 106 106 ASP H H 106 8.424 8.893 -0.469 1 1 582 . 5 1 1 A 106 106 ASP C C 106 175.692 175.245 0.447 1 1 583 . 5 1 1 A 106 106 ASP CA C 106 56.465 56.075 0.390 1 1 584 . 5 1 1 A 106 106 ASP CB C 106 40.032 39.742 0.290 1 1 585 . 5 1 1 A 106 106 ASP N N 106 117.156 120.142 -2.986 1 1 586 . 5 1 1 A 107 107 ASP H H 107 8.124 7.912 0.212 1 1 587 . 5 1 1 A 107 107 ASP C C 107 174.174 174.846 -0.672 1 1 588 . 5 1 1 A 107 107 ASP CA C 107 52.907 52.899 0.008 1 1 589 . 5 1 1 A 107 107 ASP CB C 107 41.661 40.579 1.082 1 1 590 . 5 1 1 A 107 107 ASP N N 107 113.591 113.434 0.157 1 1 591 . 5 1 1 A 108 108 LEU H H 108 7.336 8.061 -0.725 1 1 598 . 5 1 1 A 108 108 LEU C C 108 174.321 175.145 -0.824 1 1 599 . 5 1 1 A 108 108 LEU CA C 108 54.449 53.764 0.685 1 1 600 . 5 1 1 A 108 108 LEU CB C 108 44.754 45.589 -0.835 1 1 604 . 5 1 1 A 108 108 LEU N N 108 123.244 121.231 2.013 1 1 605 . 5 1 1 A 109 109 ASP H H 109 8.943 8.878 0.065 1 1 606 . 5 1 1 A 109 109 ASP C C 109 176.248 174.872 1.376 1 1 607 . 5 1 1 A 109 109 ASP CA C 109 52.376 52.651 -0.275 1 1 608 . 5 1 1 A 109 109 ASP CB C 109 42.764 45.441 -2.677 1 1 609 . 5 1 1 A 109 109 ASP N N 109 124.634 122.989 1.645 1 1 610 . 5 1 1 A 110 110 ILE H H 110 8.372 8.861 -0.489 1 1 614 . 5 1 1 A 110 110 ILE C C 110 173.735 174.235 -0.500 1 1 615 . 5 1 1 A 110 110 ILE CA C 110 59.129 59.176 -0.047 1 1 616 . 5 1 1 A 110 110 ILE CB C 110 39.402 40.977 -1.575 1 1 620 . 5 1 1 A 110 110 ILE N N 110 119.135 116.663 2.472 1 1 621 . 5 1 1 A 111 111 TYR H H 111 8.695 8.981 -0.286 1 1 622 . 5 1 1 A 111 111 TYR C C 111 172.838 174.907 -2.069 1 1 623 . 5 1 1 A 111 111 TYR CA C 111 56.182 56.626 -0.444 1 1 624 . 5 1 1 A 111 111 TYR CB C 111 41.489 43.149 -1.660 1 1 625 . 5 1 1 A 111 111 TYR N N 111 121.248 121.480 -0.232 1 1 626 . 5 1 1 A 112 112 THR H H 112 9.172 8.891 0.281 1 1 627 . 5 1 1 A 112 112 THR C C 112 173.850 173.843 0.007 1 1 628 . 5 1 1 A 112 112 THR CA C 112 58.246 60.740 -2.494 1 1 629 . 5 1 1 A 112 112 THR CB C 112 71.676 71.463 0.213 1 1 631 . 5 1 1 A 112 112 THR N N 112 110.671 113.534 -2.863 1 1 632 . 5 1 1 A 113 113 ARG H H 113 8.732 9.682 -0.950 1 1 633 . 5 1 1 A 113 113 ARG C C 113 175.037 174.796 0.241 1 1 634 . 5 1 1 A 113 113 ARG CA C 113 53.995 54.751 -0.756 1 1 635 . 5 1 1 A 113 113 ARG CB C 113 32.266 33.333 -1.067 1 1 638 . 5 1 1 A 113 113 ARG N N 113 120.642 123.127 -2.485 1 1 639 . 5 1 1 A 114 114 LEU H H 114 8.449 9.050 -0.601 1 1 646 . 5 1 1 A 114 114 LEU C C 114 175.812 175.894 -0.082 1 1 647 . 5 1 1 A 114 114 LEU CA C 114 53.335 53.973 -0.638 1 1 648 . 5 1 1 A 114 114 LEU CB C 114 45.182 45.645 -0.463 1 1 652 . 5 1 1 A 114 114 LEU N N 114 119.078 123.225 -4.147 1 1 653 . 5 1 1 A 115 115 GLY H H 115 8.232 8.702 -0.470 1 1 654 . 5 1 1 A 115 115 GLY C C 115 171.343 172.534 -1.191 1 1 655 . 5 1 1 A 115 115 GLY CA C 115 46.217 46.203 0.014 1 1 656 . 5 1 1 A 115 115 GLY N N 115 108.966 112.510 -3.544 1 1 657 . 5 1 1 A 116 116 GLY H H 116 8.293 8.442 -0.149 1 1 658 . 5 1 1 A 116 116 GLY C C 116 169.856 172.599 -2.743 1 1 659 . 5 1 1 A 116 116 GLY CA C 116 44.084 45.571 -1.487 1 1 660 . 5 1 1 A 116 116 GLY N N 116 109.676 110.929 -1.253 1 1 661 . 5 1 1 A 117 117 MET H H 117 9.286 9.387 -0.101 1 1 662 . 5 1 1 A 117 117 MET C C 117 174.557 175.101 -0.544 1 1 663 . 5 1 1 A 117 117 MET CA C 117 53.258 53.427 -0.169 1 1 664 . 5 1 1 A 117 117 MET CB C 117 37.195 35.337 1.858 1 1 667 . 5 1 1 A 117 117 MET N N 117 120.425 117.163 3.262 1 1 668 . 5 1 1 A 118 118 VAL H H 118 9.062 9.016 0.046 1 1 675 . 5 1 1 A 118 118 VAL C C 118 173.993 175.050 -1.057 1 1 676 . 5 1 1 A 118 118 VAL CA C 118 59.883 60.695 -0.812 1 1 677 . 5 1 1 A 118 118 VAL CB C 118 31.782 34.510 -2.728 1 1 680 . 5 1 1 A 118 118 VAL N N 118 126.948 120.077 6.871 1 1 681 . 5 1 1 A 119 119 TRP H H 119 8.482 8.813 -0.331 1 1 682 . 5 1 1 A 119 119 TRP C C 119 174.608 174.402 0.206 1 1 683 . 5 1 1 A 119 119 TRP CA C 119 53.332 54.843 -1.511 1 1 684 . 5 1 1 A 119 119 TRP CB C 119 33.569 33.225 0.344 1 1 685 . 5 1 1 A 119 119 TRP N N 119 124.631 124.719 -0.088 1 1 686 . 5 1 1 A 120 120 ARG H H 120 9.113 8.849 0.264 1 1 687 . 5 1 1 A 120 120 ARG C C 120 174.951 174.632 0.319 1 1 688 . 5 1 1 A 120 120 ARG CA C 120 54.684 54.561 0.123 1 1 689 . 5 1 1 A 120 120 ARG CB C 120 33.424 33.873 -0.449 1 1 690 . 5 1 1 A 120 120 ARG N N 120 117.899 119.872 -1.973 1 1 691 . 5 1 1 A 121 121 ALA H H 121 9.299 9.071 0.228 1 1 692 . 5 1 1 A 121 121 ALA C C 121 175.954 175.223 0.731 1 1 693 . 5 1 1 A 121 121 ALA CA C 121 50.368 50.822 -0.454 1 1 694 . 5 1 1 A 121 121 ALA CB C 121 21.141 23.523 -2.382 1 1 695 . 5 1 1 A 121 121 ALA N N 121 128.863 124.290 4.573 1 1 696 . 5 1 1 A 122 122 ASP H H 122 8.488 8.776 -0.288 1 1 697 . 5 1 1 A 122 122 ASP C C 122 175.635 174.021 1.614 1 1 698 . 5 1 1 A 122 122 ASP CA C 122 53.891 53.575 0.316 1 1 699 . 5 1 1 A 122 122 ASP CB C 122 42.492 44.919 -2.427 1 1 700 . 5 1 1 A 122 122 ASP N N 122 121.721 120.811 0.910 1 1 701 . 5 1 1 A 123 123 SER H H 123 8.466 8.762 -0.296 1 1 702 . 5 1 1 A 123 123 SER C C 123 174.325 174.879 -0.554 1 1 703 . 5 1 1 A 123 123 SER CA C 123 57.325 57.574 -0.249 1 1 704 . 5 1 1 A 123 123 SER CB C 123 63.988 62.222 1.766 1 1 705 . 5 1 1 A 123 123 SER N N 123 117.374 118.235 -0.861 1 1 706 . 5 1 1 A 124 124 LYS H H 124 8.389 7.974 0.415 1 1 707 . 5 1 1 A 124 124 LYS C C 124 176.840 176.864 -0.024 1 1 708 . 5 1 1 A 124 124 LYS CA C 124 56.036 55.456 0.580 1 1 709 . 5 1 1 A 124 124 LYS CB C 124 32.397 31.930 0.467 1 1 711 . 5 1 1 A 124 124 LYS N N 124 122.883 121.780 1.103 1 1 712 . 5 1 1 A 125 125 GLY H H 125 8.281 8.403 -0.122 1 1 713 . 5 1 1 A 125 125 GLY C C 125 173.592 175.165 -1.573 1 1 714 . 5 1 1 A 125 125 GLY CA C 125 44.924 46.104 -1.180 1 1 715 . 5 1 1 A 125 125 GLY N N 125 109.541 109.874 -0.333 1 1 716 . 5 1 1 A 126 126 ASN H H 126 8.185 8.222 -0.037 1 1 717 . 5 1 1 A 126 126 ASN C C 126 176.649 176.032 0.617 1 1 718 . 5 1 1 A 126 126 ASN CA C 126 52.763 53.882 -1.119 1 1 719 . 5 1 1 A 126 126 ASN CB C 126 38.439 39.900 -1.461 1 1 720 . 5 1 1 A 126 126 ASN N N 126 119.019 120.008 -0.989 1 1 721 . 5 1 1 A 127 127 TYR C C 127 176.913 176.663 0.250 1 1 722 . 5 1 1 A 127 127 TYR CA C 127 57.757 61.213 -3.456 1 1 723 . 5 1 1 A 127 127 TYR CB C 127 37.703 38.887 -1.184 1 1 724 . 5 1 1 A 128 128 ALA H H 128 8.050 7.760 0.290 1 1 728 . 5 1 1 A 128 128 ALA C C 128 177.756 177.362 0.394 1 1 729 . 5 1 1 A 128 128 ALA CA C 128 52.321 51.136 1.185 1 1 730 . 5 1 1 A 128 128 ALA CB C 128 18.273 19.479 -1.206 1 1 731 . 5 1 1 A 128 128 ALA N N 128 124.529 121.214 3.315 1 1 732 . 5 1 1 A 129 129 SER H H 129 8.063 8.559 -0.496 1 1 733 . 5 1 1 A 129 129 SER C C 129 174.938 175.528 -0.590 1 1 734 . 5 1 1 A 129 129 SER CA C 129 58.202 58.624 -0.422 1 1 735 . 5 1 1 A 129 129 SER CB C 129 62.974 64.217 -1.243 1 1 736 . 5 1 1 A 129 129 SER N N 129 114.374 115.993 -1.619 1 1 737 . 5 1 1 A 130 130 THR H H 130 7.875 8.139 -0.264 1 1 741 . 5 1 1 A 130 130 THR C C 130 175.198 174.687 0.511 1 1 742 . 5 1 1 A 130 130 THR CA C 130 61.520 65.079 -3.559 1 1 743 . 5 1 1 A 130 130 THR CB C 130 69.312 69.852 -0.540 1 1 745 . 5 1 1 A 130 130 THR N N 130 113.608 115.754 -2.146 1 1 746 . 5 1 1 A 131 131 GLY H H 131 8.219 7.429 0.790 1 1 747 . 5 1 1 A 131 131 GLY C C 131 173.979 171.844 2.135 1 1 748 . 5 1 1 A 131 131 GLY CA C 131 44.991 45.772 -0.781 1 1 749 . 5 1 1 A 131 131 GLY N N 131 110.848 107.063 3.785 1 1 750 . 5 1 1 A 132 132 VAL H H 132 7.729 8.645 -0.916 1 1 757 . 5 1 1 A 132 132 VAL C C 132 175.988 175.640 0.348 1 1 758 . 5 1 1 A 132 132 VAL CA C 132 61.643 61.449 0.194 1 1 759 . 5 1 1 A 132 132 VAL CB C 132 31.941 32.106 -0.165 1 1 762 . 5 1 1 A 132 132 VAL N N 132 118.932 119.724 -0.792 1 1 763 . 5 1 1 A 133 133 SER H H 133 8.224 8.682 -0.458 1 1 764 . 5 1 1 A 133 133 SER C C 133 174.320 176.380 -2.060 1 1 765 . 5 1 1 A 133 133 SER CA C 133 57.756 60.561 -2.805 1 1 766 . 5 1 1 A 133 133 SER CB C 133 63.140 63.941 -0.801 1 1 767 . 5 1 1 A 133 133 SER N N 133 119.260 122.310 -3.050 1 1 768 . 5 1 1 A 134 134 ARG H H 134 8.199 8.227 -0.028 1 1 769 . 5 1 1 A 134 134 ARG C C 134 175.923 176.908 -0.985 1 1 770 . 5 1 1 A 134 134 ARG CA C 134 55.461 59.257 -3.796 1 1 771 . 5 1 1 A 134 134 ARG CB C 134 30.195 29.730 0.465 1 1 774 . 5 1 1 A 134 134 ARG N N 134 123.262 122.163 1.099 1 1 775 . 5 1 1 A 135 135 SER H H 135 8.256 7.722 0.534 1 1 776 . 5 1 1 A 135 135 SER C C 135 174.360 174.097 0.263 1 1 777 . 5 1 1 A 135 135 SER CA C 135 57.730 57.124 0.606 1 1 778 . 5 1 1 A 135 135 SER CB C 135 63.275 64.074 -0.799 1 1 779 . 5 1 1 A 135 135 SER N N 135 117.155 115.368 1.787 1 1 780 . 5 1 1 A 136 136 GLU H H 136 8.374 8.376 -0.002 1 1 781 . 5 1 1 A 136 136 GLU C C 136 176.284 175.831 0.453 1 1 782 . 5 1 1 A 136 136 GLU CA C 136 56.082 55.407 0.675 1 1 783 . 5 1 1 A 136 136 GLU CB C 136 29.820 31.361 -1.541 1 1 785 . 5 1 1 A 136 136 GLU N N 136 122.812 128.664 -5.852 1 1 786 . 5 1 1 A 137 137 HIS H H 137 8.118 8.652 -0.534 1 1 787 . 5 1 1 A 137 137 HIS C C 137 173.529 173.709 -0.180 1 1 788 . 5 1 1 A 137 137 HIS CA C 137 54.793 55.228 -0.435 1 1 789 . 5 1 1 A 137 137 HIS CB C 137 30.191 31.479 -1.288 1 1 790 . 5 1 1 A 137 137 HIS N N 137 118.002 118.634 -0.632 1 1 791 . 5 1 1 A 138 138 ASP H H 138 8.572 8.764 -0.192 1 1 792 . 5 1 1 A 138 138 ASP C C 138 174.940 174.497 0.443 1 1 793 . 5 1 1 A 138 138 ASP CA C 138 53.594 53.324 0.270 1 1 794 . 5 1 1 A 138 138 ASP CB C 138 42.165 44.998 -2.833 1 1 795 . 5 1 1 A 138 138 ASP N N 138 121.536 119.806 1.730 1 1 796 . 5 1 1 A 139 139 THR H H 139 7.857 8.533 -0.676 1 1 797 . 5 1 1 A 139 139 THR C C 139 172.822 172.912 -0.090 1 1 798 . 5 1 1 A 139 139 THR CA C 139 59.197 59.574 -0.377 1 1 799 . 5 1 1 A 139 139 THR CB C 139 71.457 71.454 0.003 1 1 801 . 5 1 1 A 139 139 THR N N 139 113.598 112.930 0.668 1 1 802 . 5 1 1 A 140 140 GLY C C 140 169.622 171.322 -1.700 1 1 803 . 5 1 1 A 140 140 GLY CA C 140 44.287 43.536 0.751 1 1 804 . 5 1 1 A 141 141 VAL H H 141 7.815 8.452 -0.637 1 1 811 . 5 1 1 A 141 141 VAL C C 141 176.038 173.675 2.363 1 1 812 . 5 1 1 A 141 141 VAL CA C 141 59.739 59.577 0.162 1 1 813 . 5 1 1 A 141 141 VAL CB C 141 33.308 34.849 -1.541 1 1 816 . 5 1 1 A 141 141 VAL N N 141 116.224 123.573 -7.349 1 1 817 . 5 1 1 A 142 142 SER H H 142 9.284 8.810 0.474 1 1 818 . 5 1 1 A 142 142 SER C C 142 171.050 172.540 -1.490 1 1 819 . 5 1 1 A 142 142 SER CB C 142 67.608 66.316 1.292 1 1 820 . 5 1 1 A 142 142 SER N N 142 123.223 121.795 1.428 1 1 821 . 5 1 1 A 143 143 PRO C C 143 174.032 176.252 -2.220 1 1 822 . 5 1 1 A 143 143 PRO CA C 143 62.350 62.536 -0.186 1 1 823 . 5 1 1 A 143 143 PRO CB C 143 31.774 32.633 -0.859 1 1 825 . 5 1 1 A 144 144 VAL H H 144 7.785 8.684 -0.899 1 1 832 . 5 1 1 A 144 144 VAL C C 144 172.826 174.214 -1.388 1 1 833 . 5 1 1 A 144 144 VAL CA C 144 59.770 59.783 -0.013 1 1 834 . 5 1 1 A 144 144 VAL CB C 144 34.407 36.016 -1.609 1 1 837 . 5 1 1 A 144 144 VAL N N 144 120.214 117.241 2.973 1 1 838 . 5 1 1 A 145 145 PHE H H 145 8.623 8.403 0.220 1 1 839 . 5 1 1 A 145 145 PHE C C 145 173.658 172.692 0.966 1 1 840 . 5 1 1 A 145 145 PHE CA C 145 54.942 55.870 -0.928 1 1 841 . 5 1 1 A 145 145 PHE CB C 145 42.692 42.347 0.345 1 1 842 . 5 1 1 A 145 145 PHE N N 145 123.914 119.200 4.714 1 1 843 . 5 1 1 A 146 146 ALA H H 146 8.886 9.046 -0.160 1 1 844 . 5 1 1 A 146 146 ALA C C 146 176.258 176.167 0.091 1 1 845 . 5 1 1 A 146 146 ALA CA C 146 49.734 50.242 -0.508 1 1 846 . 5 1 1 A 146 146 ALA CB C 146 22.244 22.504 -0.260 1 1 847 . 5 1 1 A 146 146 ALA N N 146 125.243 124.065 1.178 1 1 848 . 5 1 1 A 147 147 GLY H H 147 8.470 8.481 -0.011 1 1 849 . 5 1 1 A 147 147 GLY C C 147 170.940 172.949 -2.009 1 1 850 . 5 1 1 A 147 147 GLY CA C 147 44.063 44.704 -0.641 1 1 851 . 5 1 1 A 147 147 GLY N N 147 106.669 107.135 -0.466 1 1 852 . 5 1 1 A 148 148 GLY H H 148 8.008 8.840 -0.832 1 1 853 . 5 1 1 A 148 148 GLY C C 148 170.181 172.488 -2.307 1 1 854 . 5 1 1 A 148 148 GLY CA C 148 45.736 46.062 -0.326 1 1 855 . 5 1 1 A 148 148 GLY N N 148 109.475 109.867 -0.392 1 1 856 . 5 1 1 A 149 149 VAL H H 149 8.426 8.554 -0.128 1 1 863 . 5 1 1 A 149 149 VAL C C 149 174.157 173.846 0.311 1 1 864 . 5 1 1 A 149 149 VAL CA C 149 58.200 59.078 -0.878 1 1 865 . 5 1 1 A 149 149 VAL CB C 149 34.464 36.114 -1.650 1 1 868 . 5 1 1 A 149 149 VAL N N 149 112.651 118.755 -6.104 1 1 869 . 5 1 1 A 150 150 GLU H H 150 9.070 9.424 -0.354 1 1 870 . 5 1 1 A 150 150 GLU C C 150 173.892 174.320 -0.428 1 1 871 . 5 1 1 A 150 150 GLU CA C 150 54.617 54.872 -0.255 1 1 872 . 5 1 1 A 150 150 GLU CB C 150 32.911 33.642 -0.731 1 1 874 . 5 1 1 A 150 150 GLU N N 150 124.471 120.512 3.959 1 1 875 . 5 1 1 A 151 151 TRP H H 151 9.461 8.971 0.490 1 1 877 . 5 1 1 A 151 151 TRP C C 151 174.370 174.355 0.015 1 1 878 . 5 1 1 A 151 151 TRP CA C 151 54.113 55.513 -1.400 1 1 879 . 5 1 1 A 151 151 TRP CB C 151 31.688 32.959 -1.271 1 1 880 . 5 1 1 A 151 151 TRP N N 151 129.611 129.014 0.597 1 1 882 . 5 1 1 A 152 152 ALA H H 152 8.771 8.066 0.705 1 1 883 . 5 1 1 A 152 152 ALA C C 152 175.079 176.923 -1.844 1 1 884 . 5 1 1 A 152 152 ALA CA C 152 51.417 51.303 0.114 1 1 885 . 5 1 1 A 152 152 ALA CB C 152 17.209 20.164 -2.955 1 1 886 . 5 1 1 A 152 152 ALA N N 152 130.502 130.065 0.437 1 1 887 . 5 1 1 A 153 153 VAL H H 153 7.893 8.663 -0.770 1 1 894 . 5 1 1 A 153 153 VAL C C 153 176.612 176.029 0.583 1 1 895 . 5 1 1 A 153 153 VAL CA C 153 63.600 63.807 -0.207 1 1 896 . 5 1 1 A 153 153 VAL CB C 153 31.280 33.121 -1.841 1 1 899 . 5 1 1 A 153 153 VAL N N 153 124.360 122.784 1.576 1 1 900 . 5 1 1 A 154 154 THR H H 154 7.950 7.638 0.312 1 1 904 . 5 1 1 A 154 154 THR C C 154 173.884 174.445 -0.561 1 1 905 . 5 1 1 A 154 154 THR CA C 154 58.655 60.723 -2.068 1 1 906 . 5 1 1 A 154 154 THR CB C 154 71.262 69.968 1.294 1 1 908 . 5 1 1 A 154 154 THR N N 154 109.176 111.588 -2.412 1 1 909 . 5 1 1 A 155 155 ARG H H 155 8.310 8.754 -0.444 1 1 910 . 5 1 1 A 155 155 ARG C C 155 176.753 175.559 1.194 1 1 911 . 5 1 1 A 155 155 ARG CA C 155 58.456 55.828 2.628 1 1 912 . 5 1 1 A 155 155 ARG CB C 155 29.043 30.805 -1.762 1 1 915 . 5 1 1 A 155 155 ARG N N 155 116.576 122.543 -5.967 1 1 916 . 5 1 1 A 156 156 ASP H H 156 7.783 8.056 -0.273 1 1 917 . 5 1 1 A 156 156 ASP C C 156 174.222 174.542 -0.320 1 1 918 . 5 1 1 A 156 156 ASP CA C 156 53.540 54.639 -1.099 1 1 919 . 5 1 1 A 156 156 ASP CB C 156 42.327 43.645 -1.318 1 1 920 . 5 1 1 A 156 156 ASP N N 156 112.950 119.789 -6.839 1 1 921 . 5 1 1 A 157 157 ILE H H 157 7.233 7.813 -0.580 1 1 925 . 5 1 1 A 157 157 ILE C C 157 174.178 174.756 -0.578 1 1 926 . 5 1 1 A 157 157 ILE CA C 157 59.350 60.275 -0.925 1 1 927 . 5 1 1 A 157 157 ILE CB C 157 38.969 39.202 -0.233 1 1 930 . 5 1 1 A 157 157 ILE N N 157 119.732 120.057 -0.325 1 1 931 . 5 1 1 A 158 158 ALA H H 158 8.729 8.720 0.009 1 1 932 . 5 1 1 A 158 158 ALA C C 158 176.567 175.784 0.783 1 1 933 . 5 1 1 A 158 158 ALA CA C 158 49.418 50.115 -0.697 1 1 934 . 5 1 1 A 158 158 ALA CB C 158 21.430 23.827 -2.397 1 1 935 . 5 1 1 A 158 158 ALA N N 158 128.564 128.795 -0.231 1 1 936 . 5 1 1 A 159 159 THR H H 159 8.972 9.412 -0.440 1 1 940 . 5 1 1 A 159 159 THR C C 159 172.213 173.477 -1.264 1 1 941 . 5 1 1 A 159 159 THR CA C 159 59.504 61.589 -2.085 1 1 942 . 5 1 1 A 159 159 THR CB C 159 70.728 71.069 -0.341 1 1 944 . 5 1 1 A 159 159 THR N N 159 114.901 114.258 0.643 1 1 945 . 5 1 1 A 160 160 ARG H H 160 8.924 9.167 -0.243 1 1 946 . 5 1 1 A 160 160 ARG C C 160 174.097 173.719 0.378 1 1 947 . 5 1 1 A 160 160 ARG CA C 160 53.066 54.542 -1.476 1 1 948 . 5 1 1 A 160 160 ARG CB C 160 32.922 33.585 -0.663 1 1 951 . 5 1 1 A 160 160 ARG N N 160 121.507 124.810 -3.303 1 1 952 . 5 1 1 A 161 161 LEU H H 161 8.611 9.114 -0.503 1 1 959 . 5 1 1 A 161 161 LEU C C 161 174.389 174.843 -0.454 1 1 960 . 5 1 1 A 161 161 LEU CA C 161 53.355 53.757 -0.402 1 1 961 . 5 1 1 A 161 161 LEU CB C 161 44.360 44.880 -0.520 1 1 964 . 5 1 1 A 161 161 LEU N N 161 124.711 128.749 -4.038 1 1 965 . 5 1 1 A 162 162 GLU H H 162 8.746 8.887 -0.141 1 1 966 . 5 1 1 A 162 162 GLU C C 162 173.376 174.925 -1.549 1 1 967 . 5 1 1 A 162 162 GLU CA C 162 53.904 54.516 -0.612 1 1 968 . 5 1 1 A 162 162 GLU CB C 162 33.773 34.188 -0.415 1 1 970 . 5 1 1 A 162 162 GLU N N 162 122.300 124.415 -2.115 1 1 971 . 5 1 1 A 163 163 TYR H H 163 8.872 8.381 0.491 1 1 972 . 5 1 1 A 163 163 TYR C C 163 173.425 173.493 -0.068 1 1 973 . 5 1 1 A 163 163 TYR CA C 163 56.192 55.247 0.945 1 1 974 . 5 1 1 A 163 163 TYR CB C 163 40.870 41.651 -0.781 1 1 975 . 5 1 1 A 163 163 TYR N N 163 124.618 119.151 5.467 1 1 976 . 5 1 1 A 171 171 ASP C C 171 175.753 175.126 0.627 1 1 977 . 5 1 1 A 171 171 ASP CA C 171 53.517 52.139 1.378 1 1 978 . 5 1 1 A 171 171 ASP CB C 171 41.353 43.318 -1.965 1 1 979 . 5 1 1 A 172 172 ALA H H 172 8.336 8.757 -0.421 1 1 983 . 5 1 1 A 172 172 ALA C C 172 178.110 177.667 0.443 1 1 984 . 5 1 1 A 172 172 ALA CA C 172 52.190 50.951 1.239 1 1 985 . 5 1 1 A 172 172 ALA CB C 172 18.305 20.845 -2.540 1 1 986 . 5 1 1 A 172 172 ALA N N 172 125.294 124.256 1.038 1 1 987 . 5 1 1 A 173 173 GLY H H 173 8.300 8.702 -0.402 1 1 988 . 5 1 1 A 173 173 GLY C C 173 174.437 173.499 0.938 1 1 989 . 5 1 1 A 173 173 GLY CA C 173 45.083 46.860 -1.777 1 1 990 . 5 1 1 A 173 173 GLY N N 173 107.268 108.682 -1.414 1 1 991 . 5 1 1 A 174 174 THR H H 174 7.754 7.931 -0.177 1 1 992 . 5 1 1 A 174 174 THR C C 174 174.738 173.122 1.616 1 1 993 . 5 1 1 A 174 174 THR CA C 174 61.310 60.182 1.128 1 1 994 . 5 1 1 A 174 174 THR CB C 174 69.310 71.954 -2.644 1 1 996 . 5 1 1 A 174 174 THR N N 174 113.472 111.508 1.964 1 1 997 . 5 1 1 A 175 175 VAL H H 175 7.993 8.433 -0.440 1 1 1004 . 5 1 1 A 175 175 VAL C C 175 176.535 176.017 0.518 1 1 1005 . 5 1 1 A 175 175 VAL CA C 175 62.126 61.683 0.443 1 1 1006 . 5 1 1 A 175 175 VAL CB C 175 31.282 33.033 -1.751 1 1 1009 . 5 1 1 A 175 175 VAL N N 175 121.643 117.152 4.491 1 1 1010 . 5 1 1 A 176 176 GLY H H 176 8.056 8.402 -0.346 1 1 1011 . 5 1 1 A 176 176 GLY C C 176 173.930 173.421 0.509 1 1 1012 . 5 1 1 A 176 176 GLY CA C 176 44.983 45.290 -0.307 1 1 1013 . 5 1 1 A 176 176 GLY N N 176 110.460 110.139 0.321 1 1 1014 . 5 1 1 A 177 177 THR H H 177 7.520 8.473 -0.953 1 1 1015 . 5 1 1 A 177 177 THR C C 177 173.574 174.350 -0.776 1 1 1016 . 5 1 1 A 177 177 THR CA C 177 60.609 63.843 -3.234 1 1 1017 . 5 1 1 A 177 177 THR CB C 177 69.506 69.750 -0.244 1 1 1019 . 5 1 1 A 177 177 THR N N 177 113.390 112.700 0.690 1 1 1020 . 5 1 1 A 178 178 ARG H H 178 8.261 8.099 0.162 1 1 1021 . 5 1 1 A 178 178 ARG C C 178 173.932 173.637 0.295 1 1 1022 . 5 1 1 A 178 178 ARG CA C 178 53.683 53.824 -0.141 1 1 1023 . 5 1 1 A 178 178 ARG CB C 178 29.224 30.928 -1.704 1 1 1026 . 5 1 1 A 178 178 ARG N N 178 123.906 120.758 3.148 1 1 1027 . 5 1 1 A 183 183 MET C C 183 174.053 174.865 -0.812 1 1 1028 . 5 1 1 A 183 183 MET CA C 183 53.700 54.565 -0.865 1 1 1029 . 5 1 1 A 183 183 MET CB C 183 35.908 35.130 0.778 1 1 1032 . 5 1 1 A 184 184 LEU H H 184 8.319 8.872 -0.553 1 1 1033 . 5 1 1 A 184 184 LEU C C 184 175.235 175.338 -0.103 1 1 1034 . 5 1 1 A 184 184 LEU CA C 184 53.120 53.594 -0.474 1 1 1035 . 5 1 1 A 184 184 LEU CB C 184 42.857 44.612 -1.755 1 1 1038 . 5 1 1 A 184 184 LEU N N 184 131.293 126.212 5.081 1 1 1039 . 5 1 1 A 185 185 SER H H 185 9.603 9.393 0.210 1 1 1040 . 5 1 1 A 185 185 SER C C 185 171.293 173.295 -2.002 1 1 1041 . 5 1 1 A 185 185 SER CA C 185 56.504 57.008 -0.504 1 1 1042 . 5 1 1 A 185 185 SER CB C 185 66.585 65.605 0.980 1 1 1043 . 5 1 1 A 185 185 SER N N 185 119.338 119.416 -0.078 1 1 1044 . 5 1 1 A 186 186 LEU H H 186 8.583 8.936 -0.353 1 1 1051 . 5 1 1 A 186 186 LEU C C 186 175.328 176.045 -0.717 1 1 1052 . 5 1 1 A 186 186 LEU CA C 186 52.729 52.816 -0.087 1 1 1053 . 5 1 1 A 186 186 LEU CB C 186 44.996 45.927 -0.931 1 1 1056 . 5 1 1 A 186 186 LEU N N 186 122.719 122.926 -0.207 1 1 1057 . 5 1 1 A 187 187 GLY H H 187 9.287 8.256 1.031 1 1 1058 . 5 1 1 A 187 187 GLY C C 187 172.315 172.738 -0.423 1 1 1059 . 5 1 1 A 187 187 GLY CA C 187 43.502 45.691 -2.189 1 1 1060 . 5 1 1 A 187 187 GLY N N 187 110.265 107.252 3.013 1 1 1061 . 5 1 1 A 188 188 VAL H H 188 8.825 8.562 0.263 1 1 1068 . 5 1 1 A 188 188 VAL C C 188 173.125 174.166 -1.041 1 1 1069 . 5 1 1 A 188 188 VAL CA C 188 59.739 59.114 0.625 1 1 1070 . 5 1 1 A 188 188 VAL CB C 188 34.532 35.543 -1.011 1 1 1073 . 5 1 1 A 188 188 VAL N N 188 119.161 116.329 2.832 1 1 1074 . 5 1 1 A 189 189 SER H H 189 9.051 8.989 0.062 1 1 1075 . 5 1 1 A 189 189 SER C C 189 171.698 172.378 -0.680 1 1 1076 . 5 1 1 A 189 189 SER CA C 189 55.997 56.314 -0.317 1 1 1077 . 5 1 1 A 189 189 SER CB C 189 66.094 67.001 -0.907 1 1 1078 . 5 1 1 A 189 189 SER N N 189 117.810 119.495 -1.685 1 1 1079 . 5 1 1 A 190 190 TYR H H 190 9.145 9.381 -0.236 1 1 1080 . 5 1 1 A 190 190 TYR C C 190 174.063 174.780 -0.717 1 1 1081 . 5 1 1 A 190 190 TYR CA C 190 55.375 56.624 -1.249 1 1 1082 . 5 1 1 A 190 190 TYR CB C 190 41.183 42.231 -1.048 1 1 1083 . 5 1 1 A 190 190 TYR N N 190 123.690 126.158 -2.468 1 1 1084 . 5 1 1 A 191 191 ARG H H 191 8.211 8.127 0.084 1 1 1085 . 5 1 1 A 191 191 ARG C C 191 174.826 175.340 -0.514 1 1 1086 . 5 1 1 A 191 191 ARG CA C 191 54.464 55.812 -1.348 1 1 1087 . 5 1 1 A 191 191 ARG CB C 191 30.507 31.035 -0.528 1 1 1090 . 5 1 1 A 191 191 ARG N N 191 125.366 123.873 1.493 1 1 1091 . 5 1 1 A 192 192 PHE H H 192 8.496 8.716 -0.220 1 1 1092 . 5 1 1 A 192 192 PHE C C 192 176.384 173.671 2.713 1 1 1093 . 5 1 1 A 192 192 PHE CA C 192 57.179 55.869 1.310 1 1 1094 . 5 1 1 A 192 192 PHE CB C 192 39.430 42.930 -3.500 1 1 1095 . 5 1 1 A 192 192 PHE N N 192 121.586 122.721 -1.135 1 1 1096 . 5 1 1 A 193 193 GLY H H 193 8.643 7.817 0.826 1 1 1097 . 5 1 1 A 193 193 GLY C C 193 174.466 171.917 2.549 1 1 1098 . 5 1 1 A 193 193 GLY CA C 193 45.126 44.559 0.567 1 1 1099 . 5 1 1 A 193 193 GLY N N 193 109.499 111.195 -1.696 1 1 1100 . 5 1 1 A 194 194 GLN H H 194 8.512 8.329 0.183 1 1 1101 . 5 1 1 A 194 194 GLN C C 194 176.201 175.048 1.153 1 1 1102 . 5 1 1 A 194 194 GLN CA C 194 55.433 55.611 -0.178 1 1 1103 . 5 1 1 A 194 194 GLN CB C 194 28.729 30.443 -1.714 1 1 1105 . 5 1 1 A 194 194 GLN N N 194 119.448 119.617 -0.169 1 1 1106 . 5 1 1 A 195 195 GLU H H 195 8.530 8.721 -0.191 1 1 1107 . 5 1 1 A 195 195 GLU C C 195 176.151 175.189 0.962 1 1 1108 . 5 1 1 A 195 195 GLU CA C 195 56.256 55.350 0.906 1 1 1109 . 5 1 1 A 195 195 GLU CB C 195 29.486 32.701 -3.215 1 1 1111 . 5 1 1 A 195 195 GLU N N 195 121.959 124.284 -2.325 1 1 1112 . 5 1 1 A 196 196 ASP H H 196 8.253 9.091 -0.838 1 1 1113 . 5 1 1 A 196 196 ASP C C 196 175.667 175.006 0.661 1 1 1114 . 5 1 1 A 196 196 ASP CA C 196 53.981 55.929 -1.948 1 1 1115 . 5 1 1 A 196 196 ASP CB C 196 40.700 43.117 -2.417 1 1 1116 . 5 1 1 A 196 196 ASP N N 196 121.819 123.725 -1.906 1 1 1117 . 5 1 1 A 197 197 ALA H H 197 7.999 8.053 -0.054 1 1 1121 . 5 1 1 A 197 197 ALA C C 197 176.847 176.712 0.135 1 1 1122 . 5 1 1 A 197 197 ALA CA C 197 51.612 50.729 0.883 1 1 1123 . 5 1 1 A 197 197 ALA CB C 197 18.192 19.889 -1.697 1 1 1124 . 5 1 1 A 197 197 ALA N N 197 124.262 122.382 1.880 1 1 1125 . 5 1 1 A 198 198 ALA H H 198 8.042 8.719 -0.677 1 1 1126 . 5 1 1 A 198 198 ALA C C 198 176.865 174.849 2.016 1 1 1127 . 5 1 1 A 198 198 ALA CA C 198 49.999 49.765 0.234 1 1 1128 . 5 1 1 A 198 198 ALA CB C 198 17.327 19.501 -2.174 1 1 1129 . 5 1 1 A 198 198 ALA N N 198 124.724 127.264 -2.540 1 1 1130 . 5 1 1 A 199 199 PRO C C 199 176.727 175.720 1.007 1 1 1131 . 5 1 1 A 199 199 PRO CA C 199 62.399 62.271 0.128 1 1 1132 . 5 1 1 A 199 199 PRO CB C 199 30.949 30.071 0.878 1 1 1135 . 5 1 1 A 200 200 VAL H H 200 8.026 8.218 -0.192 1 1 1142 . 5 1 1 A 200 200 VAL C C 200 176.034 175.863 0.171 1 1 1143 . 5 1 1 A 200 200 VAL CA C 200 61.944 63.236 -1.292 1 1 1144 . 5 1 1 A 200 200 VAL CB C 200 31.734 33.874 -2.140 1 1 1147 . 5 1 1 A 200 200 VAL N N 200 120.635 120.912 -0.277 1 1 1148 . 5 1 1 A 201 201 VAL H H 201 7.966 7.692 0.274 1 1 1155 . 5 1 1 A 201 201 VAL C C 201 175.128 175.500 -0.372 1 1 1156 . 5 1 1 A 201 201 VAL CA C 201 61.249 60.624 0.625 1 1 1157 . 5 1 1 A 201 201 VAL CB C 201 31.917 33.774 -1.857 1 1 1160 . 5 1 1 A 201 201 VAL N N 201 124.053 117.466 6.587 1 1 1161 . 5 1 1 A 202 202 ALA H H 202 8.159 8.670 -0.511 1 1 1162 . 5 1 1 A 202 202 ALA C C 202 175.153 177.843 -2.690 1 1 1163 . 5 1 1 A 202 202 ALA CA C 202 49.742 56.529 -6.787 1 1 1164 . 5 1 1 A 202 202 ALA CB C 202 17.532 18.470 -0.938 1 1 1165 . 5 1 1 A 202 202 ALA N N 202 129.251 127.330 1.921 1 1 1166 . 5 1 1 A 203 203 PRO C C 203 176.273 176.519 -0.246 1 1 1167 . 5 1 1 A 203 203 PRO CA C 203 62.324 62.437 -0.113 1 1 1168 . 5 1 1 A 203 203 PRO CB C 203 31.042 32.187 -1.145 1 1 1170 . 5 1 1 A 204 204 ALA H H 204 8.137 8.149 -0.012 1 1 1171 . 5 1 1 A 204 204 ALA C C 204 175.697 175.425 0.272 1 1 1172 . 5 1 1 A 204 204 ALA CA C 204 49.865 49.598 0.267 1 1 1173 . 5 1 1 A 204 204 ALA CB C 204 17.364 18.686 -1.322 1 1 1174 . 5 1 1 A 204 204 ALA N N 204 125.510 123.733 1.777 1 1 1175 . 5 1 1 A 205 205 PRO C C 205 175.430 175.888 -0.458 1 1 1176 . 5 1 1 A 205 205 PRO CA C 205 62.511 62.716 -0.205 1 1 1177 . 5 1 1 A 205 205 PRO CB C 205 31.056 31.675 -0.619 1 1 1179 . 5 1 1 A 206 206 ALA H H 206 7.847 8.759 -0.912 1 1 1180 . 5 1 1 A 206 206 ALA C C 206 175.565 175.906 -0.341 1 1 1181 . 5 1 1 A 206 206 ALA CA C 206 49.487 49.566 -0.079 1 1 1182 . 5 1 1 A 206 206 ALA CB C 206 18.843 19.311 -0.468 1 1 1183 . 5 1 1 A 206 206 ALA N N 206 123.663 126.264 -2.601 1 1 1184 . 5 1 1 A 207 207 PRO C C 207 174.397 176.324 -1.927 1 1 1185 . 5 1 1 A 207 207 PRO CA C 207 61.454 64.689 -3.235 1 1 1186 . 5 1 1 A 207 207 PRO CB C 207 31.929 32.136 -0.207 1 1 1187 . 5 1 1 A 208 208 ALA H H 208 7.898 7.798 0.100 1 1 1188 . 5 1 1 A 208 208 ALA C C 208 175.411 177.278 -1.867 1 1 1189 . 5 1 1 A 208 208 ALA CA C 208 49.472 50.168 -0.696 1 1 1190 . 5 1 1 A 208 208 ALA CB C 208 19.082 20.017 -0.935 1 1 1191 . 5 1 1 A 208 208 ALA N N 208 127.450 120.193 7.257 1 1 1192 . 5 1 1 A 209 209 PRO C C 209 176.932 178.665 -1.733 1 1 1193 . 5 1 1 A 209 209 PRO CA C 209 62.736 65.839 -3.103 1 1 1194 . 5 1 1 A 209 209 PRO CB C 209 31.012 31.625 -0.613 1 1 1 . 6 1 1 A 2 2 ARG C C 2 175.857 175.947 -0.090 1 1 2 . 6 1 1 A 2 2 ARG CA C 2 55.872 56.956 -1.084 1 1 3 . 6 1 1 A 2 2 ARG CB C 2 29.983 33.276 -3.293 1 1 5 . 6 1 1 A 3 3 ILE H H 3 8.238 7.980 0.258 1 1 9 . 6 1 1 A 3 3 ILE C C 3 175.763 174.511 1.252 1 1 10 . 6 1 1 A 3 3 ILE CA C 3 60.779 59.179 1.600 1 1 11 . 6 1 1 A 3 3 ILE CB C 3 37.664 41.285 -3.621 1 1 15 . 6 1 1 A 3 3 ILE N N 3 122.580 114.947 7.633 1 1 16 . 6 1 1 A 4 4 MET H H 4 8.261 9.046 -0.785 1 1 17 . 6 1 1 A 4 4 MET C C 4 175.660 174.841 0.819 1 1 18 . 6 1 1 A 4 4 MET CA C 4 54.893 54.019 0.874 1 1 19 . 6 1 1 A 4 4 MET CB C 4 32.060 35.692 -3.632 1 1 22 . 6 1 1 A 4 4 MET N N 4 123.988 124.489 -0.501 1 1 23 . 6 1 1 A 5 5 LYS H H 5 8.041 8.829 -0.788 1 1 24 . 6 1 1 A 5 5 LYS C C 5 175.850 175.039 0.811 1 1 25 . 6 1 1 A 5 5 LYS CA C 5 56.081 54.692 1.389 1 1 26 . 6 1 1 A 5 5 LYS CB C 5 32.220 34.943 -2.723 1 1 29 . 6 1 1 A 5 5 LYS N N 5 122.015 121.569 0.446 1 1 30 . 6 1 1 A 6 6 ALA H H 6 8.042 9.138 -1.096 1 1 34 . 6 1 1 A 6 6 ALA C C 6 177.160 176.895 0.265 1 1 35 . 6 1 1 A 6 6 ALA CA C 6 52.109 50.281 1.828 1 1 36 . 6 1 1 A 6 6 ALA CB C 6 18.637 21.613 -2.976 1 1 37 . 6 1 1 A 6 6 ALA N N 6 123.943 127.626 -3.683 1 1 38 . 6 1 1 A 7 7 ILE H H 7 7.916 9.006 -1.090 1 1 42 . 6 1 1 A 7 7 ILE C C 7 175.611 175.158 0.453 1 1 43 . 6 1 1 A 7 7 ILE CA C 7 61.181 59.228 1.953 1 1 44 . 6 1 1 A 7 7 ILE CB C 7 37.910 40.514 -2.604 1 1 48 . 6 1 1 A 7 7 ILE N N 7 118.380 118.985 -0.605 1 1 49 . 6 1 1 A 8 8 PHE H H 8 8.167 8.984 -0.817 1 1 50 . 6 1 1 A 8 8 PHE C C 8 175.363 174.820 0.543 1 1 51 . 6 1 1 A 8 8 PHE CA C 8 57.286 57.030 0.256 1 1 52 . 6 1 1 A 8 8 PHE CB C 8 39.008 41.307 -2.299 1 1 53 . 6 1 1 A 8 8 PHE N N 8 121.971 119.582 2.389 1 1 54 . 6 1 1 A 9 9 VAL H H 9 7.872 8.586 -0.714 1 1 61 . 6 1 1 A 9 9 VAL C C 9 175.405 175.089 0.316 1 1 62 . 6 1 1 A 9 9 VAL CA C 9 61.662 61.755 -0.093 1 1 63 . 6 1 1 A 9 9 VAL CB C 9 32.026 31.175 0.851 1 1 66 . 6 1 1 A 9 9 VAL N N 9 120.864 121.370 -0.506 1 1 67 . 6 1 1 A 10 10 LEU H H 10 8.077 7.994 0.083 1 1 74 . 6 1 1 A 10 10 LEU C C 10 176.652 175.046 1.606 1 1 75 . 6 1 1 A 10 10 LEU CA C 10 54.856 52.973 1.883 1 1 76 . 6 1 1 A 10 10 LEU CB C 10 41.401 44.334 -2.933 1 1 80 . 6 1 1 A 10 10 LEU N N 10 124.826 128.140 -3.314 1 1 81 . 6 1 1 A 11 11 ASN H H 11 8.177 8.663 -0.486 1 1 82 . 6 1 1 A 11 11 ASN C C 11 174.394 175.170 -0.776 1 1 83 . 6 1 1 A 11 11 ASN CA C 11 52.704 53.635 -0.931 1 1 84 . 6 1 1 A 11 11 ASN CB C 11 38.468 37.754 0.714 1 1 85 . 6 1 1 A 11 11 ASN N N 11 119.029 120.410 -1.381 1 1 86 . 6 1 1 A 12 12 ALA H H 12 7.991 8.852 -0.861 1 1 90 . 6 1 1 A 12 12 ALA C C 12 176.649 177.819 -1.170 1 1 91 . 6 1 1 A 12 12 ALA CA C 12 51.950 51.637 0.313 1 1 92 . 6 1 1 A 12 12 ALA CB C 12 18.659 17.498 1.161 1 1 93 . 6 1 1 A 12 12 ALA N N 12 123.695 129.329 -5.634 1 1 94 . 6 1 1 A 13 13 ALA H H 13 8.083 7.977 0.106 1 1 95 . 6 1 1 A 13 13 ALA C C 13 175.395 178.356 -2.961 1 1 96 . 6 1 1 A 13 13 ALA CA C 13 49.797 56.424 -6.627 1 1 97 . 6 1 1 A 13 13 ALA CB C 13 17.486 19.346 -1.860 1 1 98 . 6 1 1 A 13 13 ALA N N 13 124.281 122.965 1.316 1 1 99 . 6 1 1 A 14 14 PRO C C 14 176.641 175.832 0.809 1 1 100 . 6 1 1 A 14 14 PRO CA C 14 62.675 62.400 0.275 1 1 101 . 6 1 1 A 14 14 PRO CB C 14 31.000 29.714 1.286 1 1 103 . 6 1 1 A 15 15 LYS H H 15 8.283 8.423 -0.140 1 1 104 . 6 1 1 A 15 15 LYS C C 15 175.683 175.318 0.365 1 1 105 . 6 1 1 A 15 15 LYS CA C 15 55.429 55.589 -0.160 1 1 106 . 6 1 1 A 15 15 LYS CB C 15 32.246 32.295 -0.049 1 1 109 . 6 1 1 A 15 15 LYS N N 15 119.069 123.285 -4.216 1 1 110 . 6 1 1 A 16 16 ASP H H 16 7.880 8.691 -0.811 1 1 111 . 6 1 1 A 16 16 ASP C C 16 175.419 174.929 0.490 1 1 112 . 6 1 1 A 16 16 ASP CA C 16 54.413 53.748 0.665 1 1 113 . 6 1 1 A 16 16 ASP CB C 16 40.224 39.216 1.008 1 1 114 . 6 1 1 A 16 16 ASP N N 16 119.625 125.427 -5.802 1 1 115 . 6 1 1 A 17 17 ASN H H 17 7.973 8.413 -0.440 1 1 116 . 6 1 1 A 17 17 ASN C C 17 174.231 174.814 -0.583 1 1 117 . 6 1 1 A 17 17 ASN CA C 17 53.948 52.001 1.947 1 1 118 . 6 1 1 A 17 17 ASN CB C 17 37.009 40.849 -3.840 1 1 119 . 6 1 1 A 17 17 ASN N N 17 118.063 121.615 -3.552 1 1 120 . 6 1 1 A 18 18 THR H H 18 7.318 8.896 -1.578 1 1 121 . 6 1 1 A 18 18 THR C C 18 172.323 172.126 0.197 1 1 122 . 6 1 1 A 18 18 THR CA C 18 60.153 60.848 -0.695 1 1 123 . 6 1 1 A 18 18 THR CB C 18 71.534 70.148 1.386 1 1 125 . 6 1 1 A 18 18 THR N N 18 109.092 115.363 -6.271 1 1 126 . 6 1 1 A 19 19 TRP H H 19 8.541 8.839 -0.298 1 1 127 . 6 1 1 A 19 19 TRP C C 19 175.969 173.868 2.101 1 1 128 . 6 1 1 A 19 19 TRP CA C 19 55.700 56.575 -0.875 1 1 129 . 6 1 1 A 19 19 TRP CB C 19 31.471 33.112 -1.641 1 1 130 . 6 1 1 A 19 19 TRP N N 19 121.992 126.681 -4.689 1 1 131 . 6 1 1 A 20 20 TYR H H 20 8.691 9.746 -1.055 1 1 132 . 6 1 1 A 20 20 TYR C C 20 173.684 174.848 -1.164 1 1 133 . 6 1 1 A 20 20 TYR CA C 20 55.805 55.875 -0.070 1 1 134 . 6 1 1 A 20 20 TYR CB C 20 40.513 41.481 -0.968 1 1 135 . 6 1 1 A 20 20 TYR N N 20 116.519 126.265 -9.746 1 1 136 . 6 1 1 A 21 21 ALA H H 21 8.876 8.213 0.663 1 1 137 . 6 1 1 A 21 21 ALA C C 21 175.395 175.969 -0.574 1 1 138 . 6 1 1 A 21 21 ALA CA C 21 50.970 50.820 0.150 1 1 139 . 6 1 1 A 21 21 ALA CB C 21 22.142 23.011 -0.869 1 1 140 . 6 1 1 A 21 21 ALA N N 21 119.359 123.210 -3.851 1 1 141 . 6 1 1 A 22 22 GLY H H 22 8.613 8.361 0.252 1 1 142 . 6 1 1 A 22 22 GLY C C 22 171.458 172.502 -1.044 1 1 143 . 6 1 1 A 22 22 GLY CA C 22 45.608 46.160 -0.552 1 1 144 . 6 1 1 A 22 22 GLY N N 22 106.678 106.440 0.238 1 1 145 . 6 1 1 A 23 23 GLY H H 23 7.911 8.400 -0.489 1 1 146 . 6 1 1 A 23 23 GLY C C 23 170.563 172.007 -1.444 1 1 147 . 6 1 1 A 23 23 GLY CA C 23 44.026 45.025 -0.999 1 1 148 . 6 1 1 A 23 23 GLY N N 23 103.399 109.255 -5.856 1 1 149 . 6 1 1 A 24 24 LYS H H 24 9.001 8.801 0.200 1 1 150 . 6 1 1 A 24 24 LYS C C 24 172.965 174.946 -1.981 1 1 151 . 6 1 1 A 24 24 LYS CA C 24 54.062 54.515 -0.453 1 1 152 . 6 1 1 A 24 24 LYS CB C 24 36.774 36.471 0.303 1 1 156 . 6 1 1 A 24 24 LYS N N 24 116.402 121.900 -5.498 1 1 157 . 6 1 1 A 25 25 LEU H H 25 8.587 8.854 -0.267 1 1 164 . 6 1 1 A 25 25 LEU C C 25 175.205 175.550 -0.345 1 1 165 . 6 1 1 A 25 25 LEU CA C 25 53.446 53.689 -0.243 1 1 166 . 6 1 1 A 25 25 LEU CB C 25 46.287 46.917 -0.630 1 1 170 . 6 1 1 A 25 25 LEU N N 25 119.932 123.686 -3.754 1 1 171 . 6 1 1 A 26 26 GLY H H 26 8.637 8.310 0.327 1 1 172 . 6 1 1 A 26 26 GLY C C 26 170.804 171.751 -0.947 1 1 173 . 6 1 1 A 26 26 GLY CA C 26 45.669 46.259 -0.590 1 1 174 . 6 1 1 A 26 26 GLY N N 26 108.136 110.388 -2.252 1 1 175 . 6 1 1 A 27 27 TRP H H 27 8.642 8.454 0.188 1 1 177 . 6 1 1 A 27 27 TRP C C 27 174.820 175.016 -0.196 1 1 178 . 6 1 1 A 27 27 TRP CB C 27 30.883 31.814 -0.931 1 1 179 . 6 1 1 A 27 27 TRP N N 27 120.887 120.990 -0.103 1 1 181 . 6 1 1 A 32 32 ASP C C 32 176.315 176.128 0.187 1 1 182 . 6 1 1 A 32 32 ASP CA C 32 53.737 52.770 0.967 1 1 183 . 6 1 1 A 32 32 ASP CB C 32 41.230 44.535 -3.305 1 1 184 . 6 1 1 A 33 33 THR H H 33 8.190 8.756 -0.566 1 1 188 . 6 1 1 A 33 33 THR C C 33 175.291 175.326 -0.035 1 1 189 . 6 1 1 A 33 33 THR CA C 33 61.909 65.283 -3.374 1 1 190 . 6 1 1 A 33 33 THR CB C 33 68.961 69.490 -0.529 1 1 192 . 6 1 1 A 33 33 THR N N 33 114.235 115.880 -1.645 1 1 193 . 6 1 1 A 34 34 GLY H H 34 8.341 8.092 0.249 1 1 194 . 6 1 1 A 34 34 GLY C C 34 173.766 174.848 -1.082 1 1 195 . 6 1 1 A 34 34 GLY CA C 34 44.941 46.113 -1.172 1 1 196 . 6 1 1 A 34 34 GLY N N 34 110.678 108.529 2.149 1 1 197 . 6 1 1 A 35 35 PHE H H 35 7.945 8.014 -0.069 1 1 198 . 6 1 1 A 35 35 PHE C C 35 175.411 174.869 0.542 1 1 199 . 6 1 1 A 35 35 PHE CA C 35 57.921 57.794 0.127 1 1 200 . 6 1 1 A 35 35 PHE CB C 35 38.806 38.658 0.148 1 1 201 . 6 1 1 A 35 35 PHE N N 35 120.533 120.495 0.038 1 1 202 . 6 1 1 A 36 36 TYR H H 36 7.967 7.734 0.233 1 1 203 . 6 1 1 A 36 36 TYR C C 36 176.104 175.445 0.659 1 1 204 . 6 1 1 A 36 36 TYR CA C 36 57.568 56.982 0.586 1 1 205 . 6 1 1 A 36 36 TYR CB C 36 37.727 39.253 -1.526 1 1 206 . 6 1 1 A 36 36 TYR N N 36 120.254 120.783 -0.529 1 1 207 . 6 1 1 A 37 37 GLY H H 37 7.666 8.302 -0.636 1 1 208 . 6 1 1 A 37 37 GLY C C 37 173.794 173.681 0.113 1 1 209 . 6 1 1 A 37 37 GLY CA C 37 45.007 46.257 -1.250 1 1 210 . 6 1 1 A 37 37 GLY N N 37 108.995 112.298 -3.303 1 1 211 . 6 1 1 A 38 38 ASN H H 38 8.109 8.160 -0.051 1 1 212 . 6 1 1 A 38 38 ASN C C 38 175.612 174.911 0.701 1 1 213 . 6 1 1 A 38 38 ASN CA C 38 52.954 52.761 0.193 1 1 214 . 6 1 1 A 38 38 ASN CB C 38 38.425 39.626 -1.201 1 1 215 . 6 1 1 A 38 38 ASN N N 38 118.603 120.276 -1.673 1 1 216 . 6 1 1 A 39 39 GLY H H 39 8.202 8.782 -0.580 1 1 217 . 6 1 1 A 39 39 GLY C C 39 173.958 171.985 1.973 1 1 218 . 6 1 1 A 39 39 GLY CA C 39 45.012 45.067 -0.055 1 1 219 . 6 1 1 A 39 39 GLY N N 39 108.897 112.178 -3.281 1 1 220 . 6 1 1 A 40 40 PHE H H 40 7.960 9.257 -1.297 1 1 221 . 6 1 1 A 40 40 PHE C C 40 175.653 174.669 0.984 1 1 222 . 6 1 1 A 40 40 PHE CA C 40 57.556 56.153 1.403 1 1 223 . 6 1 1 A 40 40 PHE CB C 40 38.513 41.032 -2.519 1 1 224 . 6 1 1 A 40 40 PHE N N 40 119.829 125.776 -5.947 1 1 225 . 6 1 1 A 41 41 GLN H H 41 8.173 8.702 -0.529 1 1 226 . 6 1 1 A 41 41 GLN C C 41 175.234 175.198 0.036 1 1 227 . 6 1 1 A 41 41 GLN CA C 41 55.488 55.911 -0.423 1 1 228 . 6 1 1 A 41 41 GLN CB C 41 28.523 29.486 -0.963 1 1 230 . 6 1 1 A 41 41 GLN N N 41 120.810 125.393 -4.583 1 1 231 . 6 1 1 A 42 42 ASN H H 42 8.193 8.839 -0.646 1 1 232 . 6 1 1 A 42 42 ASN C C 42 174.618 173.950 0.668 1 1 233 . 6 1 1 A 42 42 ASN CA C 42 52.924 52.442 0.482 1 1 234 . 6 1 1 A 42 42 ASN CB C 42 38.333 38.272 0.061 1 1 235 . 6 1 1 A 42 42 ASN N N 42 119.679 125.438 -5.759 1 1 236 . 6 1 1 A 43 43 ASN H H 43 8.255 8.599 -0.344 1 1 237 . 6 1 1 A 43 43 ASN C C 43 173.873 174.042 -0.169 1 1 238 . 6 1 1 A 43 43 ASN CA C 43 52.919 52.413 0.506 1 1 239 . 6 1 1 A 43 43 ASN CB C 43 38.580 40.467 -1.887 1 1 240 . 6 1 1 A 43 43 ASN N N 43 119.773 124.801 -5.028 1 1 241 . 6 1 1 A 44 44 ASN H H 44 7.865 9.012 -1.147 1 1 242 . 6 1 1 A 44 44 ASN C C 44 175.518 174.388 1.130 1 1 243 . 6 1 1 A 44 44 ASN CA C 44 54.528 52.136 2.392 1 1 244 . 6 1 1 A 44 44 ASN CB C 44 40.170 38.385 1.785 1 1 246 . 6 1 1 A 44 44 ASN N N 44 124.152 119.599 4.553 1 1 247 . 6 1 1 A 46 46 PRO C C 46 177.228 176.748 0.480 1 1 248 . 6 1 1 A 46 46 PRO CA C 46 62.794 64.740 -1.946 1 1 249 . 6 1 1 A 46 46 PRO CB C 46 31.283 32.161 -0.878 1 1 251 . 6 1 1 A 47 47 THR H H 47 8.165 7.438 0.727 1 1 255 . 6 1 1 A 47 47 THR C C 47 174.573 172.615 1.958 1 1 256 . 6 1 1 A 47 47 THR CA C 47 61.346 60.806 0.540 1 1 257 . 6 1 1 A 47 47 THR CB C 47 69.573 73.289 -3.716 1 1 259 . 6 1 1 A 47 47 THR N N 47 114.265 110.963 3.302 1 1 260 . 6 1 1 A 48 48 ARG H H 48 8.237 8.669 -0.432 1 1 261 . 6 1 1 A 48 48 ARG C C 48 175.898 174.263 1.635 1 1 262 . 6 1 1 A 48 48 ARG CA C 48 55.717 53.750 1.967 1 1 263 . 6 1 1 A 48 48 ARG CB C 48 30.151 34.011 -3.860 1 1 266 . 6 1 1 A 48 48 ARG N N 48 122.795 124.150 -1.355 1 1 267 . 6 1 1 A 49 49 ASN H H 49 8.369 8.743 -0.374 1 1 268 . 6 1 1 A 49 49 ASN C C 49 174.560 174.295 0.265 1 1 269 . 6 1 1 A 49 49 ASN CA C 49 53.005 52.170 0.835 1 1 270 . 6 1 1 A 49 49 ASN CB C 49 38.761 40.638 -1.877 1 1 271 . 6 1 1 A 49 49 ASN N N 49 119.837 120.180 -0.343 1 1 272 . 6 1 1 A 50 50 ASP H H 50 8.192 8.787 -0.595 1 1 273 . 6 1 1 A 50 50 ASP C C 50 175.699 175.310 0.389 1 1 274 . 6 1 1 A 50 50 ASP CA C 50 54.289 52.843 1.446 1 1 275 . 6 1 1 A 50 50 ASP CB C 50 41.264 43.355 -2.091 1 1 276 . 6 1 1 A 50 50 ASP N N 50 120.403 121.553 -1.150 1 1 277 . 6 1 1 A 51 51 GLN H H 51 8.428 8.225 0.203 1 1 278 . 6 1 1 A 51 51 GLN C C 51 175.186 174.647 0.539 1 1 279 . 6 1 1 A 51 51 GLN CA C 51 54.512 55.096 -0.584 1 1 280 . 6 1 1 A 51 51 GLN CB C 51 30.424 27.291 3.133 1 1 282 . 6 1 1 A 51 51 GLN N N 51 118.959 121.676 -2.717 1 1 289 . 6 1 1 A 52 52 LEU C C 52 176.018 176.397 -0.379 1 1 290 . 6 1 1 A 52 52 LEU CA C 52 54.332 53.459 0.873 1 1 291 . 6 1 1 A 52 52 LEU CB C 52 43.022 43.169 -0.147 1 1 294 . 6 1 1 A 53 53 GLY H H 53 8.639 9.039 -0.400 1 1 295 . 6 1 1 A 53 53 GLY C C 53 171.931 172.176 -0.245 1 1 296 . 6 1 1 A 53 53 GLY CA C 53 43.501 44.135 -0.634 1 1 297 . 6 1 1 A 53 53 GLY N N 53 109.964 108.696 1.268 1 1 298 . 6 1 1 A 54 54 ALA H H 54 8.881 8.824 0.057 1 1 299 . 6 1 1 A 54 54 ALA C C 54 175.543 176.989 -1.446 1 1 300 . 6 1 1 A 54 54 ALA CA C 54 50.710 51.055 -0.345 1 1 301 . 6 1 1 A 54 54 ALA CB C 54 22.914 23.694 -0.780 1 1 302 . 6 1 1 A 54 54 ALA N N 54 120.413 123.376 -2.963 1 1 303 . 6 1 1 A 55 55 GLY H H 55 8.346 8.637 -0.291 1 1 304 . 6 1 1 A 55 55 GLY C C 55 170.960 172.137 -1.177 1 1 305 . 6 1 1 A 55 55 GLY CA C 55 46.704 45.938 0.766 1 1 306 . 6 1 1 A 55 55 GLY N N 55 104.688 106.460 -1.772 1 1 307 . 6 1 1 A 56 56 ALA H H 56 9.116 8.638 0.478 1 1 308 . 6 1 1 A 56 56 ALA C C 56 176.472 175.944 0.528 1 1 309 . 6 1 1 A 56 56 ALA CA C 56 49.638 50.665 -1.027 1 1 310 . 6 1 1 A 56 56 ALA CB C 56 22.275 21.990 0.285 1 1 311 . 6 1 1 A 56 56 ALA N N 56 120.608 122.863 -2.255 1 1 312 . 6 1 1 A 57 57 PHE H H 57 8.688 9.204 -0.516 1 1 313 . 6 1 1 A 57 57 PHE C C 57 172.816 175.376 -2.560 1 1 314 . 6 1 1 A 57 57 PHE CA C 57 56.066 56.029 0.037 1 1 315 . 6 1 1 A 57 57 PHE CB C 57 41.770 41.732 0.038 1 1 316 . 6 1 1 A 57 57 PHE N N 57 120.027 120.273 -0.246 1 1 317 . 6 1 1 A 58 58 GLY H H 58 9.034 8.882 0.152 1 1 318 . 6 1 1 A 58 58 GLY C C 58 170.860 172.607 -1.747 1 1 319 . 6 1 1 A 58 58 GLY CA C 58 44.954 44.850 0.104 1 1 320 . 6 1 1 A 58 58 GLY N N 58 105.817 110.840 -5.023 1 1 321 . 6 1 1 A 59 59 GLY H H 59 8.382 9.226 -0.844 1 1 322 . 6 1 1 A 59 59 GLY C C 59 169.284 172.482 -3.198 1 1 323 . 6 1 1 A 59 59 GLY CA C 59 45.840 44.441 1.399 1 1 324 . 6 1 1 A 59 59 GLY N N 59 109.059 111.600 -2.541 1 1 325 . 6 1 1 A 60 60 TYR H H 60 8.430 8.793 -0.363 1 1 326 . 6 1 1 A 60 60 TYR C C 60 173.453 173.411 0.042 1 1 327 . 6 1 1 A 60 60 TYR CA C 60 55.282 55.660 -0.378 1 1 328 . 6 1 1 A 60 60 TYR CB C 60 41.712 42.047 -0.335 1 1 329 . 6 1 1 A 60 60 TYR N N 60 118.352 119.168 -0.816 1 1 330 . 6 1 1 A 61 61 GLN H H 61 8.833 8.663 0.170 1 1 331 . 6 1 1 A 61 61 GLN C C 61 174.365 175.098 -0.733 1 1 332 . 6 1 1 A 61 61 GLN CA C 61 54.125 55.019 -0.894 1 1 333 . 6 1 1 A 61 61 GLN CB C 61 28.033 31.048 -3.015 1 1 335 . 6 1 1 A 61 61 GLN N N 61 129.628 122.265 7.363 1 1 336 . 6 1 1 A 62 62 VAL H H 62 8.714 9.050 -0.336 1 1 343 . 6 1 1 A 62 62 VAL C C 62 175.758 176.049 -0.291 1 1 344 . 6 1 1 A 62 62 VAL CA C 62 64.649 63.334 1.315 1 1 345 . 6 1 1 A 62 62 VAL CB C 62 31.900 33.388 -1.488 1 1 348 . 6 1 1 A 62 62 VAL N N 62 127.666 123.636 4.030 1 1 349 . 6 1 1 A 63 63 ASN H H 63 8.062 8.041 0.021 1 1 350 . 6 1 1 A 63 63 ASN C C 63 172.827 173.501 -0.674 1 1 351 . 6 1 1 A 63 63 ASN CA C 63 51.575 50.491 1.084 1 1 352 . 6 1 1 A 63 63 ASN CB C 63 37.194 41.154 -3.960 1 1 353 . 6 1 1 A 63 63 ASN N N 63 116.310 115.897 0.413 1 1 354 . 6 1 1 A 64 64 PRO C C 64 175.071 175.269 -0.198 1 1 355 . 6 1 1 A 64 64 PRO CA C 64 65.296 62.450 2.846 1 1 356 . 6 1 1 A 64 64 PRO CB C 64 30.428 29.180 1.248 1 1 357 . 6 1 1 A 65 65 TYR H H 65 7.873 8.949 -1.076 1 1 358 . 6 1 1 A 65 65 TYR C C 65 175.145 175.012 0.133 1 1 359 . 6 1 1 A 65 65 TYR CA C 65 56.125 59.007 -2.882 1 1 360 . 6 1 1 A 65 65 TYR CB C 65 39.189 40.747 -1.558 1 1 361 . 6 1 1 A 65 65 TYR N N 65 112.894 122.281 -9.387 1 1 362 . 6 1 1 A 66 66 LEU H H 66 7.308 7.610 -0.302 1 1 369 . 6 1 1 A 66 66 LEU C C 66 173.866 174.490 -0.624 1 1 370 . 6 1 1 A 66 66 LEU CA C 66 53.431 54.133 -0.702 1 1 371 . 6 1 1 A 66 66 LEU CB C 66 44.958 43.889 1.069 1 1 375 . 6 1 1 A 66 66 LEU N N 66 120.270 116.367 3.903 1 1 376 . 6 1 1 A 67 67 GLY H H 67 8.855 8.567 0.288 1 1 377 . 6 1 1 A 67 67 GLY C C 67 170.698 172.226 -1.528 1 1 378 . 6 1 1 A 67 67 GLY CA C 67 44.008 44.193 -0.185 1 1 379 . 6 1 1 A 67 67 GLY N N 67 114.388 106.552 7.836 1 1 380 . 6 1 1 A 68 68 PHE H H 68 8.770 8.380 0.390 1 1 381 . 6 1 1 A 68 68 PHE C C 68 173.386 174.262 -0.876 1 1 382 . 6 1 1 A 68 68 PHE CA C 68 56.507 57.191 -0.684 1 1 383 . 6 1 1 A 68 68 PHE CB C 68 42.428 39.599 2.829 1 1 384 . 6 1 1 A 68 68 PHE N N 68 117.510 121.016 -3.506 1 1 385 . 6 1 1 A 69 69 GLU H H 69 9.079 9.167 -0.088 1 1 386 . 6 1 1 A 69 69 GLU C C 69 174.556 174.555 0.001 1 1 387 . 6 1 1 A 69 69 GLU CA C 69 54.939 55.012 -0.073 1 1 388 . 6 1 1 A 69 69 GLU CB C 69 33.963 32.430 1.533 1 1 390 . 6 1 1 A 69 69 GLU N N 69 120.562 124.100 -3.538 1 1 391 . 6 1 1 A 70 70 MET H H 70 9.481 9.902 -0.421 1 1 392 . 6 1 1 A 70 70 MET C C 70 174.595 175.019 -0.424 1 1 393 . 6 1 1 A 70 70 MET CA C 70 53.091 53.850 -0.759 1 1 394 . 6 1 1 A 70 70 MET CB C 70 36.159 35.067 1.092 1 1 397 . 6 1 1 A 70 70 MET N N 70 124.928 127.730 -2.802 1 1 398 . 6 1 1 A 71 71 GLY H H 71 8.845 8.821 0.024 1 1 399 . 6 1 1 A 71 71 GLY C C 71 170.811 171.070 -0.259 1 1 400 . 6 1 1 A 71 71 GLY CA C 71 44.624 43.538 1.086 1 1 401 . 6 1 1 A 71 71 GLY N N 71 108.896 112.603 -3.707 1 1 402 . 6 1 1 A 72 72 TYR H H 72 8.925 8.664 0.261 1 1 403 . 6 1 1 A 72 72 TYR C C 72 173.278 173.935 -0.657 1 1 404 . 6 1 1 A 72 72 TYR CA C 72 55.912 56.328 -0.416 1 1 405 . 6 1 1 A 72 72 TYR CB C 72 41.611 40.483 1.128 1 1 406 . 6 1 1 A 72 72 TYR N N 72 123.253 121.611 1.642 1 1 407 . 6 1 1 A 73 73 ASP H H 73 8.665 9.181 -0.516 1 1 408 . 6 1 1 A 73 73 ASP C C 73 173.598 175.338 -1.740 1 1 409 . 6 1 1 A 73 73 ASP CA C 73 52.857 53.682 -0.825 1 1 410 . 6 1 1 A 73 73 ASP CB C 73 42.774 42.275 0.499 1 1 411 . 6 1 1 A 73 73 ASP N N 73 126.178 124.725 1.453 1 1 412 . 6 1 1 A 74 74 TRP H H 74 9.080 9.300 -0.220 1 1 413 . 6 1 1 A 74 74 TRP C C 74 174.868 175.090 -0.222 1 1 414 . 6 1 1 A 74 74 TRP CB C 74 30.083 31.800 -1.717 1 1 415 . 6 1 1 A 74 74 TRP N N 74 121.824 126.688 -4.864 1 1 416 . 6 1 1 A 78 78 MET C C 78 174.548 174.782 -0.234 1 1 417 . 6 1 1 A 78 78 MET CA C 78 54.388 55.232 -0.844 1 1 418 . 6 1 1 A 78 78 MET CB C 78 32.542 33.957 -1.415 1 1 419 . 6 1 1 A 79 79 ALA H H 79 8.105 8.204 -0.099 1 1 420 . 6 1 1 A 79 79 ALA C C 79 176.629 174.805 1.824 1 1 421 . 6 1 1 A 79 79 ALA CA C 79 51.210 50.981 0.229 1 1 422 . 6 1 1 A 79 79 ALA CB C 79 19.106 22.357 -3.251 1 1 423 . 6 1 1 A 79 79 ALA N N 79 125.778 120.677 5.101 1 1 424 . 6 1 1 A 80 80 TYR H H 80 8.035 9.339 -1.304 1 1 425 . 6 1 1 A 80 80 TYR C C 80 175.604 175.479 0.125 1 1 426 . 6 1 1 A 80 80 TYR CA C 80 57.021 56.744 0.277 1 1 427 . 6 1 1 A 80 80 TYR CB C 80 38.416 40.399 -1.983 1 1 428 . 6 1 1 A 80 80 TYR N N 80 120.045 121.356 -1.311 1 1 429 . 6 1 1 A 81 81 LYS H H 81 8.295 8.629 -0.334 1 1 430 . 6 1 1 A 81 81 LYS C C 81 176.647 176.232 0.415 1 1 431 . 6 1 1 A 81 81 LYS CA C 81 56.285 55.870 0.415 1 1 432 . 6 1 1 A 81 81 LYS CB C 81 31.571 32.075 -0.504 1 1 434 . 6 1 1 A 81 81 LYS N N 81 123.191 123.967 -0.776 1 1 435 . 6 1 1 A 82 82 GLY H H 82 8.117 8.529 -0.412 1 1 436 . 6 1 1 A 82 82 GLY C C 82 174.010 174.207 -0.197 1 1 437 . 6 1 1 A 82 82 GLY CA C 82 44.982 46.760 -1.778 1 1 438 . 6 1 1 A 82 82 GLY N N 82 110.014 110.802 -0.788 1 1 439 . 6 1 1 A 83 83 SER H H 83 7.938 8.106 -0.168 1 1 440 . 6 1 1 A 83 83 SER C C 83 174.634 174.892 -0.258 1 1 441 . 6 1 1 A 83 83 SER CA C 83 57.685 56.645 1.040 1 1 442 . 6 1 1 A 83 83 SER CB C 83 63.303 65.088 -1.785 1 1 443 . 6 1 1 A 83 83 SER N N 83 115.655 116.330 -0.675 1 1 444 . 6 1 1 A 84 84 VAL H H 84 8.008 8.432 -0.424 1 1 451 . 6 1 1 A 84 84 VAL C C 84 175.525 174.830 0.695 1 1 452 . 6 1 1 A 84 84 VAL CA C 84 61.769 60.358 1.411 1 1 453 . 6 1 1 A 84 84 VAL CB C 84 31.711 31.206 0.505 1 1 456 . 6 1 1 A 84 84 VAL N N 84 120.054 122.435 -2.381 1 1 457 . 6 1 1 A 85 85 ASP H H 85 8.140 7.771 0.369 1 1 458 . 6 1 1 A 85 85 ASP C C 85 174.740 175.176 -0.436 1 1 459 . 6 1 1 A 85 85 ASP CA C 85 53.983 53.234 0.749 1 1 460 . 6 1 1 A 85 85 ASP CB C 85 40.633 43.803 -3.170 1 1 461 . 6 1 1 A 85 85 ASP N N 85 122.510 118.463 4.047 1 1 462 . 6 1 1 A 86 86 ASN H H 86 7.736 8.628 -0.892 1 1 463 . 6 1 1 A 86 86 ASN C C 86 175.970 175.506 0.464 1 1 464 . 6 1 1 A 86 86 ASN CA C 86 54.349 54.366 -0.017 1 1 465 . 6 1 1 A 86 86 ASN CB C 86 40.490 40.837 -0.347 1 1 467 . 6 1 1 A 86 86 ASN N N 86 124.290 119.204 5.086 1 1 468 . 6 1 1 A 87 87 GLY H H 87 8.000 8.410 -0.410 1 1 469 . 6 1 1 A 87 87 GLY C C 87 173.456 173.206 0.250 1 1 470 . 6 1 1 A 87 87 GLY CA C 87 44.973 45.170 -0.197 1 1 471 . 6 1 1 A 87 87 GLY N N 87 113.494 107.225 6.269 1 1 472 . 6 1 1 A 88 88 ALA H H 88 8.024 7.370 0.654 1 1 473 . 6 1 1 A 88 88 ALA C C 88 176.833 175.528 1.305 1 1 474 . 6 1 1 A 88 88 ALA CA C 88 51.734 51.036 0.698 1 1 475 . 6 1 1 A 88 88 ALA CB C 88 19.818 23.073 -3.255 1 1 476 . 6 1 1 A 88 88 ALA N N 88 122.676 120.790 1.886 1 1 477 . 6 1 1 A 91 91 ALA C C 91 174.781 175.160 -0.379 1 1 478 . 6 1 1 A 91 91 ALA CA C 91 50.537 51.312 -0.775 1 1 479 . 6 1 1 A 91 91 ALA CB C 91 21.324 23.721 -2.397 1 1 480 . 6 1 1 A 92 92 GLN H H 92 8.451 8.811 -0.360 1 1 481 . 6 1 1 A 92 92 GLN C C 92 173.557 174.899 -1.342 1 1 482 . 6 1 1 A 92 92 GLN CA C 92 53.380 54.582 -1.202 1 1 484 . 6 1 1 A 92 92 GLN N N 92 116.847 118.229 -1.382 1 1 485 . 6 1 1 A 93 93 GLY C C 93 170.631 172.701 -2.070 1 1 486 . 6 1 1 A 93 93 GLY CA C 93 45.718 44.613 1.105 1 1 487 . 6 1 1 A 94 94 VAL H H 94 8.686 9.351 -0.665 1 1 494 . 6 1 1 A 94 94 VAL C C 94 173.698 173.814 -0.116 1 1 495 . 6 1 1 A 94 94 VAL CA C 94 58.997 59.946 -0.949 1 1 496 . 6 1 1 A 94 94 VAL CB C 94 33.311 34.192 -0.881 1 1 499 . 6 1 1 A 94 94 VAL N N 94 118.489 120.479 -1.990 1 1 500 . 6 1 1 A 95 95 GLN H H 95 9.468 9.504 -0.036 1 1 501 . 6 1 1 A 95 95 GLN C C 95 174.028 173.679 0.349 1 1 502 . 6 1 1 A 95 95 GLN CA C 95 52.547 54.246 -1.699 1 1 503 . 6 1 1 A 95 95 GLN CB C 95 33.816 31.434 2.382 1 1 505 . 6 1 1 A 95 95 GLN N N 95 122.106 125.927 -3.821 1 1 506 . 6 1 1 A 96 96 LEU H H 96 8.484 8.909 -0.425 1 1 513 . 6 1 1 A 96 96 LEU C C 96 175.322 175.217 0.105 1 1 514 . 6 1 1 A 96 96 LEU CA C 96 53.736 53.954 -0.218 1 1 515 . 6 1 1 A 96 96 LEU CB C 96 41.088 44.988 -3.900 1 1 519 . 6 1 1 A 96 96 LEU N N 96 123.224 125.361 -2.137 1 1 520 . 6 1 1 A 97 97 THR H H 97 9.116 8.811 0.305 1 1 521 . 6 1 1 A 97 97 THR C C 97 173.251 171.205 2.046 1 1 522 . 6 1 1 A 97 97 THR CA C 97 58.931 59.536 -0.605 1 1 523 . 6 1 1 A 97 97 THR CB C 97 72.984 71.755 1.229 1 1 525 . 6 1 1 A 97 97 THR N N 97 112.504 115.557 -3.053 1 1 526 . 6 1 1 A 98 98 ALA H H 98 8.603 8.515 0.088 1 1 527 . 6 1 1 A 98 98 ALA C C 98 174.948 175.419 -0.471 1 1 528 . 6 1 1 A 98 98 ALA CA C 98 49.980 50.088 -0.108 1 1 529 . 6 1 1 A 98 98 ALA CB C 98 19.157 20.407 -1.250 1 1 530 . 6 1 1 A 98 98 ALA N N 98 121.608 123.510 -1.902 1 1 531 . 6 1 1 A 99 99 LYS H H 99 8.890 8.897 -0.007 1 1 532 . 6 1 1 A 99 99 LYS C C 99 174.294 175.526 -1.232 1 1 533 . 6 1 1 A 99 99 LYS CA C 99 54.019 54.739 -0.720 1 1 534 . 6 1 1 A 99 99 LYS CB C 99 33.018 34.980 -1.962 1 1 538 . 6 1 1 A 99 99 LYS N N 99 124.522 124.692 -0.170 1 1 539 . 6 1 1 A 100 100 LEU H H 100 8.985 9.100 -0.115 1 1 546 . 6 1 1 A 100 100 LEU C C 100 175.265 175.520 -0.255 1 1 547 . 6 1 1 A 100 100 LEU CA C 100 52.698 53.096 -0.398 1 1 548 . 6 1 1 A 100 100 LEU CB C 100 42.889 45.097 -2.208 1 1 552 . 6 1 1 A 100 100 LEU N N 100 131.876 123.245 8.631 1 1 553 . 6 1 1 A 101 101 GLY H H 101 9.137 8.435 0.702 1 1 554 . 6 1 1 A 101 101 GLY C C 101 170.798 172.247 -1.449 1 1 555 . 6 1 1 A 101 101 GLY CA C 101 44.429 45.701 -1.272 1 1 556 . 6 1 1 A 101 101 GLY N N 101 111.928 108.078 3.850 1 1 557 . 6 1 1 A 102 102 TYR H H 102 8.779 8.691 0.088 1 1 558 . 6 1 1 A 102 102 TYR C C 102 173.402 172.807 0.595 1 1 559 . 6 1 1 A 102 102 TYR CA C 102 54.444 56.104 -1.660 1 1 560 . 6 1 1 A 102 102 TYR CB C 102 42.239 39.650 2.589 1 1 561 . 6 1 1 A 102 102 TYR N N 102 116.664 116.454 0.210 1 1 562 . 6 1 1 A 103 103 PRO C C 103 175.676 176.529 -0.853 1 1 563 . 6 1 1 A 103 103 PRO CA C 103 61.462 62.398 -0.936 1 1 564 . 6 1 1 A 103 103 PRO CB C 103 30.073 33.230 -3.157 1 1 565 . 6 1 1 A 104 104 ILE H H 104 8.670 9.350 -0.680 1 1 569 . 6 1 1 A 104 104 ILE C C 104 176.646 175.755 0.891 1 1 570 . 6 1 1 A 104 104 ILE CA C 104 62.054 60.327 1.727 1 1 571 . 6 1 1 A 104 104 ILE CB C 104 37.678 38.441 -0.763 1 1 574 . 6 1 1 A 104 104 ILE N N 104 125.939 121.281 4.658 1 1 575 . 6 1 1 A 105 105 THR H H 105 8.129 8.398 -0.269 1 1 576 . 6 1 1 A 105 105 THR C C 105 174.344 173.832 0.512 1 1 577 . 6 1 1 A 105 105 THR CA C 105 59.176 64.268 -5.092 1 1 578 . 6 1 1 A 105 105 THR CB C 105 71.049 67.643 3.406 1 1 580 . 6 1 1 A 105 105 THR N N 105 109.853 113.014 -3.161 1 1 581 . 6 1 1 A 106 106 ASP H H 106 8.424 9.235 -0.811 1 1 582 . 6 1 1 A 106 106 ASP C C 106 175.692 175.231 0.461 1 1 583 . 6 1 1 A 106 106 ASP CA C 106 56.465 55.699 0.766 1 1 584 . 6 1 1 A 106 106 ASP CB C 106 40.032 39.530 0.502 1 1 585 . 6 1 1 A 106 106 ASP N N 106 117.156 119.556 -2.400 1 1 586 . 6 1 1 A 107 107 ASP H H 107 8.124 8.583 -0.459 1 1 587 . 6 1 1 A 107 107 ASP C C 107 174.174 174.639 -0.465 1 1 588 . 6 1 1 A 107 107 ASP CA C 107 52.907 55.605 -2.698 1 1 589 . 6 1 1 A 107 107 ASP CB C 107 41.661 39.067 2.594 1 1 590 . 6 1 1 A 107 107 ASP N N 107 113.591 110.550 3.041 1 1 591 . 6 1 1 A 108 108 LEU H H 108 7.336 7.499 -0.163 1 1 598 . 6 1 1 A 108 108 LEU C C 108 174.321 175.268 -0.947 1 1 599 . 6 1 1 A 108 108 LEU CA C 108 54.449 53.831 0.618 1 1 600 . 6 1 1 A 108 108 LEU CB C 108 44.754 45.624 -0.870 1 1 604 . 6 1 1 A 108 108 LEU N N 108 123.244 118.671 4.573 1 1 605 . 6 1 1 A 109 109 ASP H H 109 8.943 9.169 -0.226 1 1 606 . 6 1 1 A 109 109 ASP C C 109 176.248 174.669 1.579 1 1 607 . 6 1 1 A 109 109 ASP CA C 109 52.376 52.552 -0.176 1 1 608 . 6 1 1 A 109 109 ASP CB C 109 42.764 44.894 -2.130 1 1 609 . 6 1 1 A 109 109 ASP N N 109 124.634 121.868 2.766 1 1 610 . 6 1 1 A 110 110 ILE H H 110 8.372 8.429 -0.057 1 1 614 . 6 1 1 A 110 110 ILE C C 110 173.735 174.710 -0.975 1 1 615 . 6 1 1 A 110 110 ILE CA C 110 59.129 59.037 0.092 1 1 616 . 6 1 1 A 110 110 ILE CB C 110 39.402 40.310 -0.908 1 1 620 . 6 1 1 A 110 110 ILE N N 110 119.135 116.090 3.045 1 1 621 . 6 1 1 A 111 111 TYR H H 111 8.695 8.446 0.249 1 1 622 . 6 1 1 A 111 111 TYR C C 111 172.838 173.114 -0.276 1 1 623 . 6 1 1 A 111 111 TYR CA C 111 56.182 55.704 0.478 1 1 624 . 6 1 1 A 111 111 TYR CB C 111 41.489 42.375 -0.886 1 1 625 . 6 1 1 A 111 111 TYR N N 111 121.248 119.445 1.803 1 1 626 . 6 1 1 A 112 112 THR H H 112 9.172 8.940 0.232 1 1 627 . 6 1 1 A 112 112 THR C C 112 173.850 173.662 0.188 1 1 628 . 6 1 1 A 112 112 THR CA C 112 58.246 60.472 -2.226 1 1 629 . 6 1 1 A 112 112 THR CB C 112 71.676 71.499 0.177 1 1 631 . 6 1 1 A 112 112 THR N N 112 110.671 112.944 -2.273 1 1 632 . 6 1 1 A 113 113 ARG H H 113 8.732 9.319 -0.587 1 1 633 . 6 1 1 A 113 113 ARG C C 113 175.037 173.728 1.309 1 1 634 . 6 1 1 A 113 113 ARG CA C 113 53.995 54.267 -0.272 1 1 635 . 6 1 1 A 113 113 ARG CB C 113 32.266 33.432 -1.166 1 1 638 . 6 1 1 A 113 113 ARG N N 113 120.642 122.643 -2.001 1 1 639 . 6 1 1 A 114 114 LEU H H 114 8.449 8.736 -0.287 1 1 646 . 6 1 1 A 114 114 LEU C C 114 175.812 175.652 0.160 1 1 647 . 6 1 1 A 114 114 LEU CA C 114 53.335 53.443 -0.108 1 1 648 . 6 1 1 A 114 114 LEU CB C 114 45.182 44.970 0.212 1 1 652 . 6 1 1 A 114 114 LEU N N 114 119.078 122.554 -3.476 1 1 653 . 6 1 1 A 115 115 GLY H H 115 8.232 8.306 -0.074 1 1 654 . 6 1 1 A 115 115 GLY C C 115 171.343 172.394 -1.051 1 1 655 . 6 1 1 A 115 115 GLY CA C 115 46.217 46.062 0.155 1 1 656 . 6 1 1 A 115 115 GLY N N 115 108.966 112.338 -3.372 1 1 657 . 6 1 1 A 116 116 GLY H H 116 8.293 8.305 -0.012 1 1 658 . 6 1 1 A 116 116 GLY C C 116 169.856 172.113 -2.257 1 1 659 . 6 1 1 A 116 116 GLY CA C 116 44.084 44.926 -0.842 1 1 660 . 6 1 1 A 116 116 GLY N N 116 109.676 110.442 -0.766 1 1 661 . 6 1 1 A 117 117 MET H H 117 9.286 8.937 0.349 1 1 662 . 6 1 1 A 117 117 MET C C 117 174.557 174.530 0.027 1 1 663 . 6 1 1 A 117 117 MET CA C 117 53.258 54.242 -0.984 1 1 664 . 6 1 1 A 117 117 MET CB C 117 37.195 36.032 1.163 1 1 667 . 6 1 1 A 117 117 MET N N 117 120.425 119.233 1.192 1 1 668 . 6 1 1 A 118 118 VAL H H 118 9.062 8.932 0.130 1 1 675 . 6 1 1 A 118 118 VAL C C 118 173.993 175.081 -1.088 1 1 676 . 6 1 1 A 118 118 VAL CA C 118 59.883 60.917 -1.034 1 1 677 . 6 1 1 A 118 118 VAL CB C 118 31.782 34.519 -2.737 1 1 680 . 6 1 1 A 118 118 VAL N N 118 126.948 124.297 2.651 1 1 681 . 6 1 1 A 119 119 TRP H H 119 8.482 9.088 -0.606 1 1 682 . 6 1 1 A 119 119 TRP C C 119 174.608 173.166 1.442 1 1 683 . 6 1 1 A 119 119 TRP CA C 119 53.332 54.725 -1.393 1 1 684 . 6 1 1 A 119 119 TRP CB C 119 33.569 32.277 1.292 1 1 685 . 6 1 1 A 119 119 TRP N N 119 124.631 124.909 -0.278 1 1 686 . 6 1 1 A 120 120 ARG H H 120 9.113 8.887 0.226 1 1 687 . 6 1 1 A 120 120 ARG C C 120 174.951 176.252 -1.301 1 1 688 . 6 1 1 A 120 120 ARG CA C 120 54.684 54.707 -0.023 1 1 689 . 6 1 1 A 120 120 ARG CB C 120 33.424 32.187 1.237 1 1 690 . 6 1 1 A 120 120 ARG N N 120 117.899 120.893 -2.994 1 1 691 . 6 1 1 A 121 121 ALA H H 121 9.299 8.441 0.858 1 1 692 . 6 1 1 A 121 121 ALA C C 121 175.954 176.360 -0.406 1 1 693 . 6 1 1 A 121 121 ALA CA C 121 50.368 51.319 -0.951 1 1 694 . 6 1 1 A 121 121 ALA CB C 121 21.141 20.045 1.096 1 1 695 . 6 1 1 A 121 121 ALA N N 121 128.863 127.454 1.409 1 1 696 . 6 1 1 A 122 122 ASP H H 122 8.488 8.829 -0.341 1 1 697 . 6 1 1 A 122 122 ASP C C 122 175.635 175.399 0.236 1 1 698 . 6 1 1 A 122 122 ASP CA C 122 53.891 52.946 0.945 1 1 699 . 6 1 1 A 122 122 ASP CB C 122 42.492 45.158 -2.666 1 1 700 . 6 1 1 A 122 122 ASP N N 122 121.721 119.083 2.638 1 1 701 . 6 1 1 A 123 123 SER H H 123 8.466 8.825 -0.359 1 1 702 . 6 1 1 A 123 123 SER C C 123 174.325 175.532 -1.207 1 1 703 . 6 1 1 A 123 123 SER CA C 123 57.325 58.706 -1.381 1 1 704 . 6 1 1 A 123 123 SER CB C 123 63.988 64.225 -0.237 1 1 705 . 6 1 1 A 123 123 SER N N 123 117.374 118.237 -0.863 1 1 706 . 6 1 1 A 124 124 LYS H H 124 8.389 8.762 -0.373 1 1 707 . 6 1 1 A 124 124 LYS C C 124 176.840 176.390 0.450 1 1 708 . 6 1 1 A 124 124 LYS CA C 124 56.036 56.531 -0.495 1 1 709 . 6 1 1 A 124 124 LYS CB C 124 32.397 33.674 -1.277 1 1 711 . 6 1 1 A 124 124 LYS N N 124 122.883 119.299 3.584 1 1 712 . 6 1 1 A 125 125 GLY H H 125 8.281 7.389 0.892 1 1 713 . 6 1 1 A 125 125 GLY C C 125 173.592 171.830 1.762 1 1 714 . 6 1 1 A 125 125 GLY CA C 125 44.924 45.603 -0.679 1 1 715 . 6 1 1 A 125 125 GLY N N 125 109.541 107.042 2.499 1 1 716 . 6 1 1 A 126 126 ASN H H 126 8.185 8.658 -0.473 1 1 717 . 6 1 1 A 126 126 ASN C C 126 176.649 174.442 2.207 1 1 718 . 6 1 1 A 126 126 ASN CA C 126 52.763 51.357 1.406 1 1 719 . 6 1 1 A 126 126 ASN CB C 126 38.439 38.850 -0.411 1 1 720 . 6 1 1 A 126 126 ASN N N 126 119.019 118.556 0.463 1 1 721 . 6 1 1 A 127 127 TYR C C 127 176.913 175.258 1.655 1 1 722 . 6 1 1 A 127 127 TYR CA C 127 57.757 59.844 -2.087 1 1 723 . 6 1 1 A 127 127 TYR CB C 127 37.703 40.639 -2.936 1 1 724 . 6 1 1 A 128 128 ALA H H 128 8.050 7.908 0.142 1 1 728 . 6 1 1 A 128 128 ALA C C 128 177.756 176.471 1.285 1 1 729 . 6 1 1 A 128 128 ALA CA C 128 52.321 50.699 1.622 1 1 730 . 6 1 1 A 128 128 ALA CB C 128 18.273 22.266 -3.993 1 1 731 . 6 1 1 A 128 128 ALA N N 128 124.529 120.887 3.642 1 1 732 . 6 1 1 A 129 129 SER H H 129 8.063 8.701 -0.638 1 1 733 . 6 1 1 A 129 129 SER C C 129 174.938 173.036 1.902 1 1 734 . 6 1 1 A 129 129 SER CA C 129 58.202 58.045 0.157 1 1 735 . 6 1 1 A 129 129 SER CB C 129 62.974 64.463 -1.489 1 1 736 . 6 1 1 A 129 129 SER N N 129 114.374 114.878 -0.504 1 1 737 . 6 1 1 A 130 130 THR H H 130 7.875 8.860 -0.985 1 1 741 . 6 1 1 A 130 130 THR C C 130 175.198 174.242 0.956 1 1 742 . 6 1 1 A 130 130 THR CA C 130 61.520 60.629 0.891 1 1 743 . 6 1 1 A 130 130 THR CB C 130 69.312 68.843 0.469 1 1 745 . 6 1 1 A 130 130 THR N N 130 113.608 117.827 -4.219 1 1 746 . 6 1 1 A 131 131 GLY H H 131 8.219 7.812 0.407 1 1 747 . 6 1 1 A 131 131 GLY C C 131 173.979 172.322 1.657 1 1 748 . 6 1 1 A 131 131 GLY CA C 131 44.991 45.026 -0.035 1 1 749 . 6 1 1 A 131 131 GLY N N 131 110.848 110.757 0.091 1 1 750 . 6 1 1 A 132 132 VAL H H 132 7.729 8.368 -0.639 1 1 757 . 6 1 1 A 132 132 VAL C C 132 175.988 175.112 0.876 1 1 758 . 6 1 1 A 132 132 VAL CA C 132 61.643 60.986 0.657 1 1 759 . 6 1 1 A 132 132 VAL CB C 132 31.941 32.068 -0.127 1 1 762 . 6 1 1 A 132 132 VAL N N 132 118.932 121.086 -2.154 1 1 763 . 6 1 1 A 133 133 SER H H 133 8.224 8.235 -0.011 1 1 764 . 6 1 1 A 133 133 SER C C 133 174.320 174.967 -0.647 1 1 765 . 6 1 1 A 133 133 SER CA C 133 57.756 56.887 0.869 1 1 766 . 6 1 1 A 133 133 SER CB C 133 63.140 63.741 -0.601 1 1 767 . 6 1 1 A 133 133 SER N N 133 119.260 122.114 -2.854 1 1 768 . 6 1 1 A 134 134 ARG H H 134 8.199 7.956 0.243 1 1 769 . 6 1 1 A 134 134 ARG C C 134 175.923 177.547 -1.624 1 1 770 . 6 1 1 A 134 134 ARG CA C 134 55.461 59.904 -4.443 1 1 771 . 6 1 1 A 134 134 ARG CB C 134 30.195 30.066 0.129 1 1 774 . 6 1 1 A 134 134 ARG N N 134 123.262 125.693 -2.431 1 1 775 . 6 1 1 A 135 135 SER H H 135 8.256 7.813 0.443 1 1 776 . 6 1 1 A 135 135 SER C C 135 174.360 173.529 0.831 1 1 777 . 6 1 1 A 135 135 SER CA C 135 57.730 57.450 0.280 1 1 778 . 6 1 1 A 135 135 SER CB C 135 63.275 63.589 -0.314 1 1 779 . 6 1 1 A 135 135 SER N N 135 117.155 110.639 6.516 1 1 780 . 6 1 1 A 136 136 GLU H H 136 8.374 7.559 0.815 1 1 781 . 6 1 1 A 136 136 GLU C C 136 176.284 175.607 0.677 1 1 782 . 6 1 1 A 136 136 GLU CA C 136 56.082 56.519 -0.437 1 1 783 . 6 1 1 A 136 136 GLU CB C 136 29.820 30.454 -0.634 1 1 785 . 6 1 1 A 136 136 GLU N N 136 122.812 123.088 -0.276 1 1 786 . 6 1 1 A 137 137 HIS H H 137 8.118 9.017 -0.899 1 1 787 . 6 1 1 A 137 137 HIS C C 137 173.529 173.147 0.382 1 1 788 . 6 1 1 A 137 137 HIS CA C 137 54.793 54.852 -0.059 1 1 789 . 6 1 1 A 137 137 HIS CB C 137 30.191 32.285 -2.094 1 1 790 . 6 1 1 A 137 137 HIS N N 137 118.002 123.202 -5.200 1 1 791 . 6 1 1 A 138 138 ASP H H 138 8.572 9.245 -0.673 1 1 792 . 6 1 1 A 138 138 ASP C C 138 174.940 174.614 0.326 1 1 793 . 6 1 1 A 138 138 ASP CA C 138 53.594 52.709 0.885 1 1 794 . 6 1 1 A 138 138 ASP CB C 138 42.165 44.731 -2.566 1 1 795 . 6 1 1 A 138 138 ASP N N 138 121.536 125.293 -3.757 1 1 796 . 6 1 1 A 139 139 THR H H 139 7.857 8.619 -0.762 1 1 797 . 6 1 1 A 139 139 THR C C 139 172.822 172.668 0.154 1 1 798 . 6 1 1 A 139 139 THR CA C 139 59.197 59.427 -0.230 1 1 799 . 6 1 1 A 139 139 THR CB C 139 71.457 71.905 -0.448 1 1 801 . 6 1 1 A 139 139 THR N N 139 113.598 112.240 1.358 1 1 802 . 6 1 1 A 140 140 GLY C C 140 169.622 171.775 -2.153 1 1 803 . 6 1 1 A 140 140 GLY CA C 140 44.287 43.477 0.810 1 1 804 . 6 1 1 A 141 141 VAL H H 141 7.815 8.658 -0.843 1 1 811 . 6 1 1 A 141 141 VAL C C 141 176.038 173.683 2.355 1 1 812 . 6 1 1 A 141 141 VAL CA C 141 59.739 59.733 0.006 1 1 813 . 6 1 1 A 141 141 VAL CB C 141 33.308 35.116 -1.808 1 1 816 . 6 1 1 A 141 141 VAL N N 141 116.224 122.284 -6.060 1 1 817 . 6 1 1 A 142 142 SER H H 142 9.284 9.031 0.253 1 1 818 . 6 1 1 A 142 142 SER C C 142 171.050 171.696 -0.646 1 1 819 . 6 1 1 A 142 142 SER CB C 142 67.608 66.536 1.072 1 1 820 . 6 1 1 A 142 142 SER N N 142 123.223 122.009 1.214 1 1 821 . 6 1 1 A 143 143 PRO C C 143 174.032 176.199 -2.167 1 1 822 . 6 1 1 A 143 143 PRO CA C 143 62.350 62.806 -0.456 1 1 823 . 6 1 1 A 143 143 PRO CB C 143 31.774 32.515 -0.741 1 1 825 . 6 1 1 A 144 144 VAL H H 144 7.785 8.689 -0.904 1 1 832 . 6 1 1 A 144 144 VAL C C 144 172.826 173.496 -0.670 1 1 833 . 6 1 1 A 144 144 VAL CA C 144 59.770 59.652 0.118 1 1 834 . 6 1 1 A 144 144 VAL CB C 144 34.407 36.060 -1.653 1 1 837 . 6 1 1 A 144 144 VAL N N 144 120.214 116.480 3.734 1 1 838 . 6 1 1 A 145 145 PHE H H 145 8.623 8.535 0.088 1 1 839 . 6 1 1 A 145 145 PHE C C 145 173.658 173.123 0.535 1 1 840 . 6 1 1 A 145 145 PHE CA C 145 54.942 56.039 -1.097 1 1 841 . 6 1 1 A 145 145 PHE CB C 145 42.692 42.041 0.651 1 1 842 . 6 1 1 A 145 145 PHE N N 145 123.914 123.287 0.627 1 1 843 . 6 1 1 A 146 146 ALA H H 146 8.886 8.650 0.236 1 1 844 . 6 1 1 A 146 146 ALA C C 146 176.258 176.681 -0.423 1 1 845 . 6 1 1 A 146 146 ALA CA C 146 49.734 50.290 -0.556 1 1 846 . 6 1 1 A 146 146 ALA CB C 146 22.244 20.772 1.472 1 1 847 . 6 1 1 A 146 146 ALA N N 146 125.243 129.625 -4.382 1 1 848 . 6 1 1 A 147 147 GLY H H 147 8.470 8.912 -0.442 1 1 849 . 6 1 1 A 147 147 GLY C C 147 170.940 172.968 -2.028 1 1 850 . 6 1 1 A 147 147 GLY CA C 147 44.063 44.752 -0.689 1 1 851 . 6 1 1 A 147 147 GLY N N 147 106.669 110.547 -3.878 1 1 852 . 6 1 1 A 148 148 GLY H H 148 8.008 8.324 -0.316 1 1 853 . 6 1 1 A 148 148 GLY C C 148 170.181 171.899 -1.718 1 1 854 . 6 1 1 A 148 148 GLY CA C 148 45.736 45.607 0.129 1 1 855 . 6 1 1 A 148 148 GLY N N 148 109.475 110.431 -0.956 1 1 856 . 6 1 1 A 149 149 VAL H H 149 8.426 8.153 0.273 1 1 863 . 6 1 1 A 149 149 VAL C C 149 174.157 173.338 0.819 1 1 864 . 6 1 1 A 149 149 VAL CA C 149 58.200 58.657 -0.457 1 1 865 . 6 1 1 A 149 149 VAL CB C 149 34.464 35.693 -1.229 1 1 868 . 6 1 1 A 149 149 VAL N N 149 112.651 117.371 -4.720 1 1 869 . 6 1 1 A 150 150 GLU H H 150 9.070 9.416 -0.346 1 1 870 . 6 1 1 A 150 150 GLU C C 150 173.892 174.270 -0.378 1 1 871 . 6 1 1 A 150 150 GLU CA C 150 54.617 54.884 -0.267 1 1 872 . 6 1 1 A 150 150 GLU CB C 150 32.911 33.893 -0.982 1 1 874 . 6 1 1 A 150 150 GLU N N 150 124.471 121.281 3.190 1 1 875 . 6 1 1 A 151 151 TRP H H 151 9.461 9.678 -0.217 1 1 877 . 6 1 1 A 151 151 TRP C C 151 174.370 174.332 0.038 1 1 878 . 6 1 1 A 151 151 TRP CA C 151 54.113 55.322 -1.209 1 1 879 . 6 1 1 A 151 151 TRP CB C 151 31.688 32.733 -1.045 1 1 880 . 6 1 1 A 151 151 TRP N N 151 129.611 128.605 1.006 1 1 882 . 6 1 1 A 152 152 ALA H H 152 8.771 8.834 -0.063 1 1 883 . 6 1 1 A 152 152 ALA C C 152 175.079 176.502 -1.423 1 1 884 . 6 1 1 A 152 152 ALA CA C 152 51.417 51.156 0.261 1 1 885 . 6 1 1 A 152 152 ALA CB C 152 17.209 20.073 -2.864 1 1 886 . 6 1 1 A 152 152 ALA N N 152 130.502 131.020 -0.518 1 1 887 . 6 1 1 A 153 153 VAL H H 153 7.893 8.355 -0.462 1 1 894 . 6 1 1 A 153 153 VAL C C 153 176.612 175.850 0.762 1 1 895 . 6 1 1 A 153 153 VAL CA C 153 63.600 63.443 0.157 1 1 896 . 6 1 1 A 153 153 VAL CB C 153 31.280 32.814 -1.534 1 1 899 . 6 1 1 A 153 153 VAL N N 153 124.360 122.418 1.942 1 1 900 . 6 1 1 A 154 154 THR H H 154 7.950 7.524 0.426 1 1 904 . 6 1 1 A 154 154 THR C C 154 173.884 174.215 -0.331 1 1 905 . 6 1 1 A 154 154 THR CA C 154 58.655 59.756 -1.101 1 1 906 . 6 1 1 A 154 154 THR CB C 154 71.262 70.858 0.404 1 1 908 . 6 1 1 A 154 154 THR N N 154 109.176 112.896 -3.720 1 1 909 . 6 1 1 A 155 155 ARG H H 155 8.310 8.650 -0.340 1 1 910 . 6 1 1 A 155 155 ARG C C 155 176.753 175.772 0.981 1 1 911 . 6 1 1 A 155 155 ARG CA C 155 58.456 55.743 2.713 1 1 912 . 6 1 1 A 155 155 ARG CB C 155 29.043 29.564 -0.521 1 1 915 . 6 1 1 A 155 155 ARG N N 155 116.576 118.250 -1.674 1 1 916 . 6 1 1 A 156 156 ASP H H 156 7.783 8.090 -0.307 1 1 917 . 6 1 1 A 156 156 ASP C C 156 174.222 174.791 -0.569 1 1 918 . 6 1 1 A 156 156 ASP CA C 156 53.540 54.801 -1.261 1 1 919 . 6 1 1 A 156 156 ASP CB C 156 42.327 43.956 -1.629 1 1 920 . 6 1 1 A 156 156 ASP N N 156 112.950 119.936 -6.986 1 1 921 . 6 1 1 A 157 157 ILE H H 157 7.233 7.599 -0.366 1 1 925 . 6 1 1 A 157 157 ILE C C 157 174.178 174.484 -0.306 1 1 926 . 6 1 1 A 157 157 ILE CA C 157 59.350 60.104 -0.754 1 1 927 . 6 1 1 A 157 157 ILE CB C 157 38.969 39.455 -0.486 1 1 930 . 6 1 1 A 157 157 ILE N N 157 119.732 120.275 -0.543 1 1 931 . 6 1 1 A 158 158 ALA H H 158 8.729 9.151 -0.422 1 1 932 . 6 1 1 A 158 158 ALA C C 158 176.567 174.928 1.639 1 1 933 . 6 1 1 A 158 158 ALA CA C 158 49.418 50.154 -0.736 1 1 934 . 6 1 1 A 158 158 ALA CB C 158 21.430 23.839 -2.409 1 1 935 . 6 1 1 A 158 158 ALA N N 158 128.564 128.980 -0.416 1 1 936 . 6 1 1 A 159 159 THR H H 159 8.972 9.156 -0.184 1 1 940 . 6 1 1 A 159 159 THR C C 159 172.213 173.363 -1.150 1 1 941 . 6 1 1 A 159 159 THR CA C 159 59.504 60.047 -0.543 1 1 942 . 6 1 1 A 159 159 THR CB C 159 70.728 71.949 -1.221 1 1 944 . 6 1 1 A 159 159 THR N N 159 114.901 113.866 1.035 1 1 945 . 6 1 1 A 160 160 ARG H H 160 8.924 9.421 -0.497 1 1 946 . 6 1 1 A 160 160 ARG C C 160 174.097 174.134 -0.037 1 1 947 . 6 1 1 A 160 160 ARG CA C 160 53.066 54.453 -1.387 1 1 948 . 6 1 1 A 160 160 ARG CB C 160 32.922 34.275 -1.353 1 1 951 . 6 1 1 A 160 160 ARG N N 160 121.507 126.263 -4.756 1 1 952 . 6 1 1 A 161 161 LEU H H 161 8.611 9.125 -0.514 1 1 959 . 6 1 1 A 161 161 LEU C C 161 174.389 174.301 0.088 1 1 960 . 6 1 1 A 161 161 LEU CA C 161 53.355 53.562 -0.207 1 1 961 . 6 1 1 A 161 161 LEU CB C 161 44.360 45.877 -1.517 1 1 964 . 6 1 1 A 161 161 LEU N N 161 124.711 123.398 1.313 1 1 965 . 6 1 1 A 162 162 GLU H H 162 8.746 8.986 -0.240 1 1 966 . 6 1 1 A 162 162 GLU C C 162 173.376 174.273 -0.897 1 1 967 . 6 1 1 A 162 162 GLU CA C 162 53.904 54.732 -0.828 1 1 968 . 6 1 1 A 162 162 GLU CB C 162 33.773 32.686 1.087 1 1 970 . 6 1 1 A 162 162 GLU N N 162 122.300 127.450 -5.150 1 1 971 . 6 1 1 A 163 163 TYR H H 163 8.872 8.698 0.174 1 1 972 . 6 1 1 A 163 163 TYR C C 163 173.425 175.735 -2.310 1 1 973 . 6 1 1 A 163 163 TYR CA C 163 56.192 56.937 -0.745 1 1 974 . 6 1 1 A 163 163 TYR CB C 163 40.870 41.321 -0.451 1 1 975 . 6 1 1 A 163 163 TYR N N 163 124.618 126.970 -2.352 1 1 976 . 6 1 1 A 171 171 ASP C C 171 175.753 175.046 0.707 1 1 977 . 6 1 1 A 171 171 ASP CA C 171 53.517 52.629 0.888 1 1 978 . 6 1 1 A 171 171 ASP CB C 171 41.353 43.684 -2.331 1 1 979 . 6 1 1 A 172 172 ALA H H 172 8.336 8.750 -0.414 1 1 983 . 6 1 1 A 172 172 ALA C C 172 178.110 178.888 -0.778 1 1 984 . 6 1 1 A 172 172 ALA CA C 172 52.190 54.134 -1.944 1 1 985 . 6 1 1 A 172 172 ALA CB C 172 18.305 19.691 -1.386 1 1 986 . 6 1 1 A 172 172 ALA N N 172 125.294 122.273 3.021 1 1 987 . 6 1 1 A 173 173 GLY H H 173 8.300 7.797 0.503 1 1 988 . 6 1 1 A 173 173 GLY C C 173 174.437 172.785 1.652 1 1 989 . 6 1 1 A 173 173 GLY CA C 173 45.083 44.288 0.795 1 1 990 . 6 1 1 A 173 173 GLY N N 173 107.268 107.510 -0.242 1 1 991 . 6 1 1 A 174 174 THR H H 174 7.754 8.237 -0.483 1 1 992 . 6 1 1 A 174 174 THR C C 174 174.738 173.309 1.429 1 1 993 . 6 1 1 A 174 174 THR CA C 174 61.310 59.752 1.558 1 1 994 . 6 1 1 A 174 174 THR CB C 174 69.310 70.917 -1.607 1 1 996 . 6 1 1 A 174 174 THR N N 174 113.472 115.019 -1.547 1 1 997 . 6 1 1 A 175 175 VAL H H 175 7.993 8.796 -0.803 1 1 1004 . 6 1 1 A 175 175 VAL C C 175 176.535 176.691 -0.156 1 1 1005 . 6 1 1 A 175 175 VAL CA C 175 62.126 63.781 -1.655 1 1 1006 . 6 1 1 A 175 175 VAL CB C 175 31.282 32.728 -1.446 1 1 1009 . 6 1 1 A 175 175 VAL N N 175 121.643 128.354 -6.711 1 1 1010 . 6 1 1 A 176 176 GLY H H 176 8.056 7.792 0.264 1 1 1011 . 6 1 1 A 176 176 GLY C C 176 173.930 173.230 0.700 1 1 1012 . 6 1 1 A 176 176 GLY CA C 176 44.983 44.779 0.204 1 1 1013 . 6 1 1 A 176 176 GLY N N 176 110.460 106.787 3.673 1 1 1014 . 6 1 1 A 177 177 THR H H 177 7.520 8.611 -1.091 1 1 1015 . 6 1 1 A 177 177 THR C C 177 173.574 174.526 -0.952 1 1 1016 . 6 1 1 A 177 177 THR CA C 177 60.609 62.316 -1.707 1 1 1017 . 6 1 1 A 177 177 THR CB C 177 69.506 70.165 -0.659 1 1 1019 . 6 1 1 A 177 177 THR N N 177 113.390 114.913 -1.523 1 1 1020 . 6 1 1 A 178 178 ARG H H 178 8.261 7.991 0.270 1 1 1021 . 6 1 1 A 178 178 ARG C C 178 173.932 173.421 0.511 1 1 1022 . 6 1 1 A 178 178 ARG CA C 178 53.683 52.781 0.902 1 1 1023 . 6 1 1 A 178 178 ARG CB C 178 29.224 31.292 -2.068 1 1 1026 . 6 1 1 A 178 178 ARG N N 178 123.906 120.080 3.826 1 1 1027 . 6 1 1 A 183 183 MET C C 183 174.053 174.015 0.038 1 1 1028 . 6 1 1 A 183 183 MET CA C 183 53.700 54.456 -0.756 1 1 1029 . 6 1 1 A 183 183 MET CB C 183 35.908 35.586 0.322 1 1 1032 . 6 1 1 A 184 184 LEU H H 184 8.319 8.752 -0.433 1 1 1033 . 6 1 1 A 184 184 LEU C C 184 175.235 175.646 -0.411 1 1 1034 . 6 1 1 A 184 184 LEU CA C 184 53.120 53.301 -0.181 1 1 1035 . 6 1 1 A 184 184 LEU CB C 184 42.857 44.245 -1.388 1 1 1038 . 6 1 1 A 184 184 LEU N N 184 131.293 127.384 3.909 1 1 1039 . 6 1 1 A 185 185 SER H H 185 9.603 8.814 0.789 1 1 1040 . 6 1 1 A 185 185 SER C C 185 171.293 173.017 -1.724 1 1 1041 . 6 1 1 A 185 185 SER CA C 185 56.504 56.493 0.011 1 1 1042 . 6 1 1 A 185 185 SER CB C 185 66.585 66.390 0.195 1 1 1043 . 6 1 1 A 185 185 SER N N 185 119.338 118.060 1.278 1 1 1044 . 6 1 1 A 186 186 LEU H H 186 8.583 8.624 -0.041 1 1 1051 . 6 1 1 A 186 186 LEU C C 186 175.328 176.186 -0.858 1 1 1052 . 6 1 1 A 186 186 LEU CA C 186 52.729 53.079 -0.350 1 1 1053 . 6 1 1 A 186 186 LEU CB C 186 44.996 45.182 -0.186 1 1 1056 . 6 1 1 A 186 186 LEU N N 186 122.719 123.575 -0.856 1 1 1057 . 6 1 1 A 187 187 GLY H H 187 9.287 8.532 0.755 1 1 1058 . 6 1 1 A 187 187 GLY C C 187 172.315 173.391 -1.076 1 1 1059 . 6 1 1 A 187 187 GLY CA C 187 43.502 44.884 -1.382 1 1 1060 . 6 1 1 A 187 187 GLY N N 187 110.265 110.807 -0.542 1 1 1061 . 6 1 1 A 188 188 VAL H H 188 8.825 8.710 0.115 1 1 1068 . 6 1 1 A 188 188 VAL C C 188 173.125 174.691 -1.566 1 1 1069 . 6 1 1 A 188 188 VAL CA C 188 59.739 59.631 0.108 1 1 1070 . 6 1 1 A 188 188 VAL CB C 188 34.532 34.365 0.167 1 1 1073 . 6 1 1 A 188 188 VAL N N 188 119.161 117.155 2.006 1 1 1074 . 6 1 1 A 189 189 SER H H 189 9.051 8.865 0.186 1 1 1075 . 6 1 1 A 189 189 SER C C 189 171.698 172.795 -1.097 1 1 1076 . 6 1 1 A 189 189 SER CA C 189 55.997 57.305 -1.308 1 1 1077 . 6 1 1 A 189 189 SER CB C 189 66.094 67.653 -1.559 1 1 1078 . 6 1 1 A 189 189 SER N N 189 117.810 119.871 -2.061 1 1 1079 . 6 1 1 A 190 190 TYR H H 190 9.145 8.773 0.372 1 1 1080 . 6 1 1 A 190 190 TYR C C 190 174.063 172.894 1.169 1 1 1081 . 6 1 1 A 190 190 TYR CA C 190 55.375 55.480 -0.105 1 1 1082 . 6 1 1 A 190 190 TYR CB C 190 41.183 41.851 -0.668 1 1 1083 . 6 1 1 A 190 190 TYR N N 190 123.690 118.599 5.091 1 1 1084 . 6 1 1 A 191 191 ARG H H 191 8.211 8.668 -0.457 1 1 1085 . 6 1 1 A 191 191 ARG C C 191 174.826 174.805 0.021 1 1 1086 . 6 1 1 A 191 191 ARG CA C 191 54.464 54.764 -0.300 1 1 1087 . 6 1 1 A 191 191 ARG CB C 191 30.507 31.888 -1.381 1 1 1090 . 6 1 1 A 191 191 ARG N N 191 125.366 119.024 6.342 1 1 1091 . 6 1 1 A 192 192 PHE H H 192 8.496 8.997 -0.501 1 1 1092 . 6 1 1 A 192 192 PHE C C 192 176.384 174.680 1.704 1 1 1093 . 6 1 1 A 192 192 PHE CA C 192 57.179 57.268 -0.089 1 1 1094 . 6 1 1 A 192 192 PHE CB C 192 39.430 41.215 -1.785 1 1 1095 . 6 1 1 A 192 192 PHE N N 192 121.586 123.561 -1.975 1 1 1096 . 6 1 1 A 193 193 GLY H H 193 8.643 8.177 0.466 1 1 1097 . 6 1 1 A 193 193 GLY C C 193 174.466 173.073 1.393 1 1 1098 . 6 1 1 A 193 193 GLY CA C 193 45.126 45.282 -0.156 1 1 1099 . 6 1 1 A 193 193 GLY N N 193 109.499 112.149 -2.650 1 1 1100 . 6 1 1 A 194 194 GLN H H 194 8.512 8.549 -0.037 1 1 1101 . 6 1 1 A 194 194 GLN C C 194 176.201 174.156 2.045 1 1 1102 . 6 1 1 A 194 194 GLN CA C 194 55.433 54.765 0.668 1 1 1103 . 6 1 1 A 194 194 GLN CB C 194 28.729 29.383 -0.654 1 1 1105 . 6 1 1 A 194 194 GLN N N 194 119.448 115.666 3.782 1 1 1106 . 6 1 1 A 195 195 GLU H H 195 8.530 8.991 -0.461 1 1 1107 . 6 1 1 A 195 195 GLU C C 195 176.151 174.965 1.186 1 1 1108 . 6 1 1 A 195 195 GLU CA C 195 56.256 56.598 -0.342 1 1 1109 . 6 1 1 A 195 195 GLU CB C 195 29.486 30.583 -1.097 1 1 1111 . 6 1 1 A 195 195 GLU N N 195 121.959 126.283 -4.324 1 1 1112 . 6 1 1 A 196 196 ASP H H 196 8.253 8.604 -0.351 1 1 1113 . 6 1 1 A 196 196 ASP C C 196 175.667 175.206 0.461 1 1 1114 . 6 1 1 A 196 196 ASP CA C 196 53.981 52.687 1.294 1 1 1115 . 6 1 1 A 196 196 ASP CB C 196 40.700 42.338 -1.638 1 1 1116 . 6 1 1 A 196 196 ASP N N 196 121.819 125.533 -3.714 1 1 1117 . 6 1 1 A 197 197 ALA H H 197 7.999 8.472 -0.473 1 1 1121 . 6 1 1 A 197 197 ALA C C 197 176.847 176.109 0.738 1 1 1122 . 6 1 1 A 197 197 ALA CA C 197 51.612 53.381 -1.769 1 1 1123 . 6 1 1 A 197 197 ALA CB C 197 18.192 21.353 -3.161 1 1 1124 . 6 1 1 A 197 197 ALA N N 197 124.262 128.232 -3.970 1 1 1125 . 6 1 1 A 198 198 ALA H H 198 8.042 7.934 0.108 1 1 1126 . 6 1 1 A 198 198 ALA C C 198 176.865 175.667 1.198 1 1 1127 . 6 1 1 A 198 198 ALA CA C 198 49.999 49.229 0.770 1 1 1128 . 6 1 1 A 198 198 ALA CB C 198 17.327 19.726 -2.399 1 1 1129 . 6 1 1 A 198 198 ALA N N 198 124.724 120.524 4.200 1 1 1130 . 6 1 1 A 199 199 PRO C C 199 176.727 176.865 -0.138 1 1 1131 . 6 1 1 A 199 199 PRO CA C 199 62.399 62.561 -0.162 1 1 1132 . 6 1 1 A 199 199 PRO CB C 199 30.949 30.236 0.713 1 1 1135 . 6 1 1 A 200 200 VAL H H 200 8.026 7.889 0.137 1 1 1142 . 6 1 1 A 200 200 VAL C C 200 176.034 175.834 0.200 1 1 1143 . 6 1 1 A 200 200 VAL CA C 200 61.944 60.308 1.636 1 1 1144 . 6 1 1 A 200 200 VAL CB C 200 31.734 32.777 -1.043 1 1 1147 . 6 1 1 A 200 200 VAL N N 200 120.635 117.852 2.783 1 1 1148 . 6 1 1 A 201 201 VAL H H 201 7.966 8.852 -0.886 1 1 1155 . 6 1 1 A 201 201 VAL C C 201 175.128 175.073 0.055 1 1 1156 . 6 1 1 A 201 201 VAL CA C 201 61.249 60.559 0.690 1 1 1157 . 6 1 1 A 201 201 VAL CB C 201 31.917 31.595 0.322 1 1 1160 . 6 1 1 A 201 201 VAL N N 201 124.053 119.240 4.813 1 1 1161 . 6 1 1 A 202 202 ALA H H 202 8.159 7.651 0.508 1 1 1162 . 6 1 1 A 202 202 ALA C C 202 175.153 176.234 -1.081 1 1 1163 . 6 1 1 A 202 202 ALA CA C 202 49.742 49.035 0.707 1 1 1164 . 6 1 1 A 202 202 ALA CB C 202 17.532 19.924 -2.392 1 1 1165 . 6 1 1 A 202 202 ALA N N 202 129.251 125.308 3.943 1 1 1166 . 6 1 1 A 203 203 PRO C C 203 176.273 176.721 -0.448 1 1 1167 . 6 1 1 A 203 203 PRO CA C 203 62.324 64.472 -2.148 1 1 1168 . 6 1 1 A 203 203 PRO CB C 203 31.042 31.831 -0.789 1 1 1170 . 6 1 1 A 204 204 ALA H H 204 8.137 7.878 0.259 1 1 1171 . 6 1 1 A 204 204 ALA C C 204 175.697 176.238 -0.541 1 1 1172 . 6 1 1 A 204 204 ALA CA C 204 49.865 50.900 -1.035 1 1 1173 . 6 1 1 A 204 204 ALA CB C 204 17.364 18.579 -1.215 1 1 1174 . 6 1 1 A 204 204 ALA N N 204 125.510 121.818 3.692 1 1 1175 . 6 1 1 A 205 205 PRO C C 205 175.430 176.251 -0.821 1 1 1176 . 6 1 1 A 205 205 PRO CA C 205 62.511 62.677 -0.166 1 1 1177 . 6 1 1 A 205 205 PRO CB C 205 31.056 33.069 -2.013 1 1 1179 . 6 1 1 A 206 206 ALA H H 206 7.847 8.413 -0.566 1 1 1180 . 6 1 1 A 206 206 ALA C C 206 175.565 178.546 -2.981 1 1 1181 . 6 1 1 A 206 206 ALA CA C 206 49.487 55.572 -6.085 1 1 1182 . 6 1 1 A 206 206 ALA CB C 206 18.843 19.237 -0.394 1 1 1183 . 6 1 1 A 206 206 ALA N N 206 123.663 122.217 1.446 1 1 1184 . 6 1 1 A 207 207 PRO C C 207 174.397 176.478 -2.081 1 1 1185 . 6 1 1 A 207 207 PRO CA C 207 61.454 62.461 -1.007 1 1 1186 . 6 1 1 A 207 207 PRO CB C 207 31.929 29.901 2.028 1 1 1187 . 6 1 1 A 208 208 ALA H H 208 7.898 8.369 -0.471 1 1 1188 . 6 1 1 A 208 208 ALA C C 208 175.411 178.258 -2.847 1 1 1189 . 6 1 1 A 208 208 ALA CA C 208 49.472 54.455 -4.983 1 1 1190 . 6 1 1 A 208 208 ALA CB C 208 19.082 19.978 -0.896 1 1 1191 . 6 1 1 A 208 208 ALA N N 208 127.450 125.272 2.178 1 1 1192 . 6 1 1 A 209 209 PRO C C 209 176.932 175.471 1.461 1 1 1193 . 6 1 1 A 209 209 PRO CA C 209 62.736 62.651 0.085 1 1 1194 . 6 1 1 A 209 209 PRO CB C 209 31.012 33.521 -2.509 1 1 1 . 7 1 1 A 2 2 ARG C C 2 175.857 176.131 -0.274 1 1 2 . 7 1 1 A 2 2 ARG CA C 2 55.872 56.642 -0.770 1 1 3 . 7 1 1 A 2 2 ARG CB C 2 29.983 32.998 -3.015 1 1 5 . 7 1 1 A 3 3 ILE H H 3 8.238 7.708 0.530 1 1 9 . 7 1 1 A 3 3 ILE C C 3 175.763 174.249 1.514 1 1 10 . 7 1 1 A 3 3 ILE CA C 3 60.779 58.815 1.964 1 1 11 . 7 1 1 A 3 3 ILE CB C 3 37.664 42.015 -4.351 1 1 15 . 7 1 1 A 3 3 ILE N N 3 122.580 114.541 8.039 1 1 16 . 7 1 1 A 4 4 MET H H 4 8.261 9.062 -0.801 1 1 17 . 7 1 1 A 4 4 MET C C 4 175.660 174.262 1.398 1 1 18 . 7 1 1 A 4 4 MET CA C 4 54.893 54.263 0.630 1 1 19 . 7 1 1 A 4 4 MET CB C 4 32.060 35.629 -3.569 1 1 22 . 7 1 1 A 4 4 MET N N 4 123.988 123.032 0.956 1 1 23 . 7 1 1 A 5 5 LYS H H 5 8.041 8.942 -0.901 1 1 24 . 7 1 1 A 5 5 LYS C C 5 175.850 174.690 1.160 1 1 25 . 7 1 1 A 5 5 LYS CA C 5 56.081 54.887 1.194 1 1 26 . 7 1 1 A 5 5 LYS CB C 5 32.220 32.686 -0.466 1 1 29 . 7 1 1 A 5 5 LYS N N 5 122.015 121.965 0.050 1 1 30 . 7 1 1 A 6 6 ALA H H 6 8.042 8.609 -0.567 1 1 34 . 7 1 1 A 6 6 ALA C C 6 177.160 177.485 -0.325 1 1 35 . 7 1 1 A 6 6 ALA CA C 6 52.109 51.651 0.458 1 1 36 . 7 1 1 A 6 6 ALA CB C 6 18.637 18.704 -0.067 1 1 37 . 7 1 1 A 6 6 ALA N N 6 123.943 126.897 -2.954 1 1 38 . 7 1 1 A 7 7 ILE H H 7 7.916 8.782 -0.866 1 1 42 . 7 1 1 A 7 7 ILE C C 7 175.611 175.590 0.021 1 1 43 . 7 1 1 A 7 7 ILE CA C 7 61.181 63.051 -1.870 1 1 44 . 7 1 1 A 7 7 ILE CB C 7 37.910 39.002 -1.092 1 1 48 . 7 1 1 A 7 7 ILE N N 7 118.380 125.852 -7.472 1 1 49 . 7 1 1 A 8 8 PHE H H 8 8.167 7.573 0.594 1 1 50 . 7 1 1 A 8 8 PHE C C 8 175.363 173.263 2.100 1 1 51 . 7 1 1 A 8 8 PHE CA C 8 57.286 57.797 -0.511 1 1 52 . 7 1 1 A 8 8 PHE CB C 8 39.008 42.357 -3.349 1 1 53 . 7 1 1 A 8 8 PHE N N 8 121.971 120.197 1.774 1 1 54 . 7 1 1 A 9 9 VAL H H 9 7.872 8.492 -0.620 1 1 61 . 7 1 1 A 9 9 VAL C C 9 175.405 175.662 -0.257 1 1 62 . 7 1 1 A 9 9 VAL CA C 9 61.662 59.173 2.489 1 1 63 . 7 1 1 A 9 9 VAL CB C 9 32.026 35.271 -3.245 1 1 66 . 7 1 1 A 9 9 VAL N N 9 120.864 123.047 -2.183 1 1 67 . 7 1 1 A 10 10 LEU H H 10 8.077 8.441 -0.364 1 1 74 . 7 1 1 A 10 10 LEU C C 10 176.652 176.980 -0.328 1 1 75 . 7 1 1 A 10 10 LEU CA C 10 54.856 55.468 -0.612 1 1 76 . 7 1 1 A 10 10 LEU CB C 10 41.401 42.296 -0.895 1 1 80 . 7 1 1 A 10 10 LEU N N 10 124.826 121.671 3.155 1 1 81 . 7 1 1 A 11 11 ASN H H 11 8.177 7.786 0.391 1 1 82 . 7 1 1 A 11 11 ASN C C 11 174.394 175.251 -0.857 1 1 83 . 7 1 1 A 11 11 ASN CA C 11 52.704 53.722 -1.018 1 1 84 . 7 1 1 A 11 11 ASN CB C 11 38.468 38.949 -0.481 1 1 85 . 7 1 1 A 11 11 ASN N N 11 119.029 117.944 1.085 1 1 86 . 7 1 1 A 12 12 ALA H H 12 7.991 8.340 -0.349 1 1 90 . 7 1 1 A 12 12 ALA C C 12 176.649 176.535 0.114 1 1 91 . 7 1 1 A 12 12 ALA CA C 12 51.950 52.155 -0.205 1 1 92 . 7 1 1 A 12 12 ALA CB C 12 18.659 18.750 -0.091 1 1 93 . 7 1 1 A 12 12 ALA N N 12 123.695 124.664 -0.969 1 1 94 . 7 1 1 A 13 13 ALA H H 13 8.083 8.311 -0.228 1 1 95 . 7 1 1 A 13 13 ALA C C 13 175.395 176.852 -1.457 1 1 96 . 7 1 1 A 13 13 ALA CA C 13 49.797 49.505 0.292 1 1 97 . 7 1 1 A 13 13 ALA CB C 13 17.486 20.138 -2.652 1 1 98 . 7 1 1 A 13 13 ALA N N 13 124.281 128.207 -3.926 1 1 99 . 7 1 1 A 14 14 PRO C C 14 176.641 177.122 -0.481 1 1 100 . 7 1 1 A 14 14 PRO CA C 14 62.675 64.618 -1.943 1 1 101 . 7 1 1 A 14 14 PRO CB C 14 31.000 32.114 -1.114 1 1 103 . 7 1 1 A 15 15 LYS H H 15 8.283 8.369 -0.086 1 1 104 . 7 1 1 A 15 15 LYS C C 15 175.683 176.659 -0.976 1 1 105 . 7 1 1 A 15 15 LYS CA C 15 55.429 55.542 -0.113 1 1 106 . 7 1 1 A 15 15 LYS CB C 15 32.246 31.224 1.022 1 1 109 . 7 1 1 A 15 15 LYS N N 15 119.069 117.424 1.645 1 1 110 . 7 1 1 A 16 16 ASP H H 16 7.880 7.988 -0.108 1 1 111 . 7 1 1 A 16 16 ASP C C 16 175.419 176.540 -1.121 1 1 112 . 7 1 1 A 16 16 ASP CA C 16 54.413 53.513 0.900 1 1 113 . 7 1 1 A 16 16 ASP CB C 16 40.224 39.848 0.376 1 1 114 . 7 1 1 A 16 16 ASP N N 16 119.625 119.045 0.580 1 1 115 . 7 1 1 A 17 17 ASN H H 17 7.973 7.649 0.324 1 1 116 . 7 1 1 A 17 17 ASN C C 17 174.231 175.213 -0.982 1 1 117 . 7 1 1 A 17 17 ASN CA C 17 53.948 53.772 0.176 1 1 118 . 7 1 1 A 17 17 ASN CB C 17 37.009 38.969 -1.960 1 1 119 . 7 1 1 A 17 17 ASN N N 17 118.063 118.068 -0.005 1 1 120 . 7 1 1 A 18 18 THR H H 18 7.318 8.896 -1.578 1 1 121 . 7 1 1 A 18 18 THR C C 18 172.323 173.303 -0.980 1 1 122 . 7 1 1 A 18 18 THR CA C 18 60.153 60.668 -0.515 1 1 123 . 7 1 1 A 18 18 THR CB C 18 71.534 73.549 -2.015 1 1 125 . 7 1 1 A 18 18 THR N N 18 109.092 114.909 -5.817 1 1 126 . 7 1 1 A 19 19 TRP H H 19 8.541 7.943 0.598 1 1 127 . 7 1 1 A 19 19 TRP C C 19 175.969 173.016 2.953 1 1 128 . 7 1 1 A 19 19 TRP CA C 19 55.700 55.324 0.376 1 1 129 . 7 1 1 A 19 19 TRP CB C 19 31.471 33.208 -1.737 1 1 130 . 7 1 1 A 19 19 TRP N N 19 121.992 120.754 1.238 1 1 131 . 7 1 1 A 20 20 TYR H H 20 8.691 9.281 -0.590 1 1 132 . 7 1 1 A 20 20 TYR C C 20 173.684 175.169 -1.485 1 1 133 . 7 1 1 A 20 20 TYR CA C 20 55.805 56.040 -0.235 1 1 134 . 7 1 1 A 20 20 TYR CB C 20 40.513 41.943 -1.430 1 1 135 . 7 1 1 A 20 20 TYR N N 20 116.519 119.942 -3.423 1 1 136 . 7 1 1 A 21 21 ALA H H 21 8.876 8.928 -0.052 1 1 137 . 7 1 1 A 21 21 ALA C C 21 175.395 176.702 -1.307 1 1 138 . 7 1 1 A 21 21 ALA CA C 21 50.970 51.052 -0.082 1 1 139 . 7 1 1 A 21 21 ALA CB C 21 22.142 23.477 -1.335 1 1 140 . 7 1 1 A 21 21 ALA N N 21 119.359 124.064 -4.705 1 1 141 . 7 1 1 A 22 22 GLY H H 22 8.613 8.573 0.040 1 1 142 . 7 1 1 A 22 22 GLY C C 22 171.458 172.446 -0.988 1 1 143 . 7 1 1 A 22 22 GLY CA C 22 45.608 46.323 -0.715 1 1 144 . 7 1 1 A 22 22 GLY N N 22 106.678 106.704 -0.026 1 1 145 . 7 1 1 A 23 23 GLY H H 23 7.911 8.492 -0.581 1 1 146 . 7 1 1 A 23 23 GLY C C 23 170.563 172.388 -1.825 1 1 147 . 7 1 1 A 23 23 GLY CA C 23 44.026 45.406 -1.380 1 1 148 . 7 1 1 A 23 23 GLY N N 23 103.399 109.370 -5.971 1 1 149 . 7 1 1 A 24 24 LYS H H 24 9.001 9.611 -0.610 1 1 150 . 7 1 1 A 24 24 LYS C C 24 172.965 174.240 -1.275 1 1 151 . 7 1 1 A 24 24 LYS CA C 24 54.062 54.035 0.027 1 1 152 . 7 1 1 A 24 24 LYS CB C 24 36.774 36.437 0.337 1 1 156 . 7 1 1 A 24 24 LYS N N 24 116.402 118.807 -2.405 1 1 157 . 7 1 1 A 25 25 LEU H H 25 8.587 9.255 -0.668 1 1 164 . 7 1 1 A 25 25 LEU C C 25 175.205 175.444 -0.239 1 1 165 . 7 1 1 A 25 25 LEU CA C 25 53.446 53.206 0.240 1 1 166 . 7 1 1 A 25 25 LEU CB C 25 46.287 46.679 -0.392 1 1 170 . 7 1 1 A 25 25 LEU N N 25 119.932 121.508 -1.576 1 1 171 . 7 1 1 A 26 26 GLY H H 26 8.637 8.107 0.530 1 1 172 . 7 1 1 A 26 26 GLY C C 26 170.804 171.601 -0.797 1 1 173 . 7 1 1 A 26 26 GLY CA C 26 45.669 46.127 -0.458 1 1 174 . 7 1 1 A 26 26 GLY N N 26 108.136 110.179 -2.043 1 1 175 . 7 1 1 A 27 27 TRP H H 27 8.642 8.789 -0.147 1 1 177 . 7 1 1 A 27 27 TRP C C 27 174.820 175.931 -1.111 1 1 178 . 7 1 1 A 27 27 TRP CB C 27 30.883 32.918 -2.035 1 1 179 . 7 1 1 A 27 27 TRP N N 27 120.887 121.728 -0.841 1 1 181 . 7 1 1 A 32 32 ASP C C 32 176.315 175.254 1.061 1 1 182 . 7 1 1 A 32 32 ASP CA C 32 53.737 52.780 0.957 1 1 183 . 7 1 1 A 32 32 ASP CB C 32 41.230 44.234 -3.004 1 1 184 . 7 1 1 A 33 33 THR H H 33 8.190 8.825 -0.635 1 1 188 . 7 1 1 A 33 33 THR C C 33 175.291 174.576 0.715 1 1 189 . 7 1 1 A 33 33 THR CA C 33 61.909 60.886 1.023 1 1 190 . 7 1 1 A 33 33 THR CB C 33 68.961 67.977 0.984 1 1 192 . 7 1 1 A 33 33 THR N N 33 114.235 117.012 -2.777 1 1 193 . 7 1 1 A 34 34 GLY H H 34 8.341 8.578 -0.237 1 1 194 . 7 1 1 A 34 34 GLY C C 34 173.766 173.298 0.468 1 1 195 . 7 1 1 A 34 34 GLY CA C 34 44.941 44.839 0.102 1 1 196 . 7 1 1 A 34 34 GLY N N 34 110.678 116.076 -5.398 1 1 197 . 7 1 1 A 35 35 PHE H H 35 7.945 8.542 -0.597 1 1 198 . 7 1 1 A 35 35 PHE C C 35 175.411 173.966 1.445 1 1 199 . 7 1 1 A 35 35 PHE CA C 35 57.921 56.533 1.388 1 1 200 . 7 1 1 A 35 35 PHE CB C 35 38.806 38.618 0.188 1 1 201 . 7 1 1 A 35 35 PHE N N 35 120.533 120.574 -0.041 1 1 202 . 7 1 1 A 36 36 TYR H H 36 7.967 8.656 -0.689 1 1 203 . 7 1 1 A 36 36 TYR C C 36 176.104 175.138 0.966 1 1 204 . 7 1 1 A 36 36 TYR CA C 36 57.568 55.780 1.788 1 1 205 . 7 1 1 A 36 36 TYR CB C 36 37.727 39.405 -1.678 1 1 206 . 7 1 1 A 36 36 TYR N N 36 120.254 129.273 -9.019 1 1 207 . 7 1 1 A 37 37 GLY H H 37 7.666 8.835 -1.169 1 1 208 . 7 1 1 A 37 37 GLY C C 37 173.794 172.787 1.007 1 1 209 . 7 1 1 A 37 37 GLY CA C 37 45.007 46.410 -1.403 1 1 210 . 7 1 1 A 37 37 GLY N N 37 108.995 114.228 -5.233 1 1 211 . 7 1 1 A 38 38 ASN H H 38 8.109 7.707 0.402 1 1 212 . 7 1 1 A 38 38 ASN C C 38 175.612 176.056 -0.444 1 1 213 . 7 1 1 A 38 38 ASN CA C 38 52.954 51.720 1.234 1 1 214 . 7 1 1 A 38 38 ASN CB C 38 38.425 39.099 -0.674 1 1 215 . 7 1 1 A 38 38 ASN N N 38 118.603 120.057 -1.454 1 1 216 . 7 1 1 A 39 39 GLY H H 39 8.202 8.746 -0.544 1 1 217 . 7 1 1 A 39 39 GLY C C 39 173.958 174.494 -0.536 1 1 218 . 7 1 1 A 39 39 GLY CA C 39 45.012 47.079 -2.067 1 1 219 . 7 1 1 A 39 39 GLY N N 39 108.897 112.924 -4.027 1 1 220 . 7 1 1 A 40 40 PHE H H 40 7.960 8.187 -0.227 1 1 221 . 7 1 1 A 40 40 PHE C C 40 175.653 175.374 0.279 1 1 222 . 7 1 1 A 40 40 PHE CA C 40 57.556 58.170 -0.614 1 1 223 . 7 1 1 A 40 40 PHE CB C 40 38.513 40.365 -1.852 1 1 224 . 7 1 1 A 40 40 PHE N N 40 119.829 119.216 0.613 1 1 225 . 7 1 1 A 41 41 GLN H H 41 8.173 8.115 0.058 1 1 226 . 7 1 1 A 41 41 GLN C C 41 175.234 175.544 -0.310 1 1 227 . 7 1 1 A 41 41 GLN CA C 41 55.488 54.717 0.771 1 1 228 . 7 1 1 A 41 41 GLN CB C 41 28.523 31.679 -3.156 1 1 230 . 7 1 1 A 41 41 GLN N N 41 120.810 124.119 -3.309 1 1 231 . 7 1 1 A 42 42 ASN H H 42 8.193 8.832 -0.639 1 1 232 . 7 1 1 A 42 42 ASN C C 42 174.618 175.908 -1.290 1 1 233 . 7 1 1 A 42 42 ASN CA C 42 52.924 55.374 -2.450 1 1 234 . 7 1 1 A 42 42 ASN CB C 42 38.333 38.903 -0.570 1 1 235 . 7 1 1 A 42 42 ASN N N 42 119.679 124.375 -4.696 1 1 236 . 7 1 1 A 43 43 ASN H H 43 8.255 8.065 0.190 1 1 237 . 7 1 1 A 43 43 ASN C C 43 173.873 175.064 -1.191 1 1 238 . 7 1 1 A 43 43 ASN CA C 43 52.919 53.106 -0.187 1 1 239 . 7 1 1 A 43 43 ASN CB C 43 38.580 39.311 -0.731 1 1 240 . 7 1 1 A 43 43 ASN N N 43 119.773 117.468 2.305 1 1 241 . 7 1 1 A 44 44 ASN H H 44 7.865 8.523 -0.658 1 1 242 . 7 1 1 A 44 44 ASN C C 44 175.518 175.336 0.182 1 1 243 . 7 1 1 A 44 44 ASN CA C 44 54.528 52.309 2.219 1 1 244 . 7 1 1 A 44 44 ASN CB C 44 40.170 39.244 0.926 1 1 246 . 7 1 1 A 44 44 ASN N N 44 124.152 119.276 4.876 1 1 247 . 7 1 1 A 46 46 PRO C C 46 177.228 176.171 1.057 1 1 248 . 7 1 1 A 46 46 PRO CA C 46 62.794 64.463 -1.669 1 1 249 . 7 1 1 A 46 46 PRO CB C 46 31.283 32.127 -0.844 1 1 251 . 7 1 1 A 47 47 THR H H 47 8.165 7.698 0.467 1 1 255 . 7 1 1 A 47 47 THR C C 47 174.573 173.339 1.234 1 1 256 . 7 1 1 A 47 47 THR CA C 47 61.346 60.564 0.782 1 1 257 . 7 1 1 A 47 47 THR CB C 47 69.573 70.853 -1.280 1 1 259 . 7 1 1 A 47 47 THR N N 47 114.265 111.666 2.599 1 1 260 . 7 1 1 A 48 48 ARG H H 48 8.237 8.708 -0.471 1 1 261 . 7 1 1 A 48 48 ARG C C 48 175.898 176.028 -0.130 1 1 262 . 7 1 1 A 48 48 ARG CA C 48 55.717 57.261 -1.544 1 1 263 . 7 1 1 A 48 48 ARG CB C 48 30.151 31.276 -1.125 1 1 266 . 7 1 1 A 48 48 ARG N N 48 122.795 126.489 -3.694 1 1 267 . 7 1 1 A 49 49 ASN H H 49 8.369 7.941 0.428 1 1 268 . 7 1 1 A 49 49 ASN C C 49 174.560 174.420 0.140 1 1 269 . 7 1 1 A 49 49 ASN CA C 49 53.005 51.873 1.132 1 1 270 . 7 1 1 A 49 49 ASN CB C 49 38.761 39.962 -1.201 1 1 271 . 7 1 1 A 49 49 ASN N N 49 119.837 115.483 4.354 1 1 272 . 7 1 1 A 50 50 ASP H H 50 8.192 8.595 -0.403 1 1 273 . 7 1 1 A 50 50 ASP C C 50 175.699 176.305 -0.606 1 1 274 . 7 1 1 A 50 50 ASP CA C 50 54.289 54.489 -0.200 1 1 275 . 7 1 1 A 50 50 ASP CB C 50 41.264 41.953 -0.689 1 1 276 . 7 1 1 A 50 50 ASP N N 50 120.403 121.679 -1.276 1 1 277 . 7 1 1 A 51 51 GLN H H 51 8.428 8.971 -0.543 1 1 278 . 7 1 1 A 51 51 GLN C C 51 175.186 174.825 0.361 1 1 279 . 7 1 1 A 51 51 GLN CA C 51 54.512 54.009 0.503 1 1 280 . 7 1 1 A 51 51 GLN CB C 51 30.424 32.342 -1.918 1 1 282 . 7 1 1 A 51 51 GLN N N 51 118.959 122.884 -3.925 1 1 289 . 7 1 1 A 52 52 LEU C C 52 176.018 175.273 0.745 1 1 290 . 7 1 1 A 52 52 LEU CA C 52 54.332 52.730 1.602 1 1 291 . 7 1 1 A 52 52 LEU CB C 52 43.022 45.950 -2.928 1 1 294 . 7 1 1 A 53 53 GLY H H 53 8.639 8.746 -0.107 1 1 295 . 7 1 1 A 53 53 GLY C C 53 171.931 171.611 0.320 1 1 296 . 7 1 1 A 53 53 GLY CA C 53 43.501 44.436 -0.935 1 1 297 . 7 1 1 A 53 53 GLY N N 53 109.964 107.074 2.890 1 1 298 . 7 1 1 A 54 54 ALA H H 54 8.881 8.576 0.305 1 1 299 . 7 1 1 A 54 54 ALA C C 54 175.543 176.731 -1.188 1 1 300 . 7 1 1 A 54 54 ALA CA C 54 50.710 50.248 0.462 1 1 301 . 7 1 1 A 54 54 ALA CB C 54 22.914 22.193 0.721 1 1 302 . 7 1 1 A 54 54 ALA N N 54 120.413 122.546 -2.133 1 1 303 . 7 1 1 A 55 55 GLY H H 55 8.346 8.763 -0.417 1 1 304 . 7 1 1 A 55 55 GLY C C 55 170.960 171.954 -0.994 1 1 305 . 7 1 1 A 55 55 GLY CA C 55 46.704 45.185 1.519 1 1 306 . 7 1 1 A 55 55 GLY N N 55 104.688 107.880 -3.192 1 1 307 . 7 1 1 A 56 56 ALA H H 56 9.116 9.012 0.104 1 1 308 . 7 1 1 A 56 56 ALA C C 56 176.472 177.329 -0.857 1 1 309 . 7 1 1 A 56 56 ALA CA C 56 49.638 51.078 -1.440 1 1 310 . 7 1 1 A 56 56 ALA CB C 56 22.275 21.581 0.694 1 1 311 . 7 1 1 A 56 56 ALA N N 56 120.608 124.778 -4.170 1 1 312 . 7 1 1 A 57 57 PHE H H 57 8.688 9.202 -0.514 1 1 313 . 7 1 1 A 57 57 PHE C C 57 172.816 175.694 -2.878 1 1 314 . 7 1 1 A 57 57 PHE CA C 57 56.066 56.088 -0.022 1 1 315 . 7 1 1 A 57 57 PHE CB C 57 41.770 43.196 -1.426 1 1 316 . 7 1 1 A 57 57 PHE N N 57 120.027 118.875 1.152 1 1 317 . 7 1 1 A 58 58 GLY H H 58 9.034 8.549 0.485 1 1 318 . 7 1 1 A 58 58 GLY C C 58 170.860 172.485 -1.625 1 1 319 . 7 1 1 A 58 58 GLY CA C 58 44.954 44.946 0.008 1 1 320 . 7 1 1 A 58 58 GLY N N 58 105.817 109.855 -4.038 1 1 321 . 7 1 1 A 59 59 GLY H H 59 8.382 9.015 -0.633 1 1 322 . 7 1 1 A 59 59 GLY C C 59 169.284 172.664 -3.380 1 1 323 . 7 1 1 A 59 59 GLY CA C 59 45.840 44.543 1.297 1 1 324 . 7 1 1 A 59 59 GLY N N 59 109.059 110.550 -1.491 1 1 325 . 7 1 1 A 60 60 TYR H H 60 8.430 9.069 -0.639 1 1 326 . 7 1 1 A 60 60 TYR C C 60 173.453 172.675 0.778 1 1 327 . 7 1 1 A 60 60 TYR CA C 60 55.282 55.911 -0.629 1 1 328 . 7 1 1 A 60 60 TYR CB C 60 41.712 42.068 -0.356 1 1 329 . 7 1 1 A 60 60 TYR N N 60 118.352 115.738 2.614 1 1 330 . 7 1 1 A 61 61 GLN H H 61 8.833 9.201 -0.368 1 1 331 . 7 1 1 A 61 61 GLN C C 61 174.365 175.479 -1.114 1 1 332 . 7 1 1 A 61 61 GLN CA C 61 54.125 56.013 -1.888 1 1 333 . 7 1 1 A 61 61 GLN CB C 61 28.033 29.957 -1.924 1 1 335 . 7 1 1 A 61 61 GLN N N 61 129.628 122.814 6.814 1 1 336 . 7 1 1 A 62 62 VAL H H 62 8.714 8.756 -0.042 1 1 343 . 7 1 1 A 62 62 VAL C C 62 175.758 175.596 0.162 1 1 344 . 7 1 1 A 62 62 VAL CA C 62 64.649 63.465 1.184 1 1 345 . 7 1 1 A 62 62 VAL CB C 62 31.900 34.651 -2.751 1 1 348 . 7 1 1 A 62 62 VAL N N 62 127.666 124.075 3.591 1 1 349 . 7 1 1 A 63 63 ASN H H 63 8.062 7.924 0.138 1 1 350 . 7 1 1 A 63 63 ASN C C 63 172.827 174.597 -1.770 1 1 351 . 7 1 1 A 63 63 ASN CA C 63 51.575 50.877 0.698 1 1 352 . 7 1 1 A 63 63 ASN CB C 63 37.194 38.710 -1.516 1 1 353 . 7 1 1 A 63 63 ASN N N 63 116.310 118.154 -1.844 1 1 354 . 7 1 1 A 64 64 PRO C C 64 175.071 176.401 -1.330 1 1 355 . 7 1 1 A 64 64 PRO CA C 64 65.296 62.604 2.692 1 1 356 . 7 1 1 A 64 64 PRO CB C 64 30.428 29.327 1.101 1 1 357 . 7 1 1 A 65 65 TYR H H 65 7.873 8.946 -1.073 1 1 358 . 7 1 1 A 65 65 TYR C C 65 175.145 174.819 0.326 1 1 359 . 7 1 1 A 65 65 TYR CA C 65 56.125 58.347 -2.222 1 1 360 . 7 1 1 A 65 65 TYR CB C 65 39.189 41.373 -2.184 1 1 361 . 7 1 1 A 65 65 TYR N N 65 112.894 122.206 -9.312 1 1 362 . 7 1 1 A 66 66 LEU H H 66 7.308 7.875 -0.567 1 1 369 . 7 1 1 A 66 66 LEU C C 66 173.866 174.609 -0.743 1 1 370 . 7 1 1 A 66 66 LEU CA C 66 53.431 53.732 -0.301 1 1 371 . 7 1 1 A 66 66 LEU CB C 66 44.958 44.357 0.601 1 1 375 . 7 1 1 A 66 66 LEU N N 66 120.270 117.363 2.907 1 1 376 . 7 1 1 A 67 67 GLY H H 67 8.855 8.453 0.402 1 1 377 . 7 1 1 A 67 67 GLY C C 67 170.698 172.000 -1.302 1 1 378 . 7 1 1 A 67 67 GLY CA C 67 44.008 44.296 -0.288 1 1 379 . 7 1 1 A 67 67 GLY N N 67 114.388 106.669 7.719 1 1 380 . 7 1 1 A 68 68 PHE H H 68 8.770 8.298 0.472 1 1 381 . 7 1 1 A 68 68 PHE C C 68 173.386 174.537 -1.151 1 1 382 . 7 1 1 A 68 68 PHE CA C 68 56.507 57.173 -0.666 1 1 383 . 7 1 1 A 68 68 PHE CB C 68 42.428 41.260 1.168 1 1 384 . 7 1 1 A 68 68 PHE N N 68 117.510 118.742 -1.232 1 1 385 . 7 1 1 A 69 69 GLU H H 69 9.079 9.765 -0.686 1 1 386 . 7 1 1 A 69 69 GLU C C 69 174.556 175.070 -0.514 1 1 387 . 7 1 1 A 69 69 GLU CA C 69 54.939 54.977 -0.038 1 1 388 . 7 1 1 A 69 69 GLU CB C 69 33.963 33.049 0.914 1 1 390 . 7 1 1 A 69 69 GLU N N 69 120.562 121.616 -1.054 1 1 391 . 7 1 1 A 70 70 MET H H 70 9.481 9.675 -0.194 1 1 392 . 7 1 1 A 70 70 MET C C 70 174.595 175.319 -0.724 1 1 393 . 7 1 1 A 70 70 MET CA C 70 53.091 53.623 -0.532 1 1 394 . 7 1 1 A 70 70 MET CB C 70 36.159 34.136 2.023 1 1 397 . 7 1 1 A 70 70 MET N N 70 124.928 123.885 1.043 1 1 398 . 7 1 1 A 71 71 GLY H H 71 8.845 8.640 0.205 1 1 399 . 7 1 1 A 71 71 GLY C C 71 170.811 171.144 -0.333 1 1 400 . 7 1 1 A 71 71 GLY CA C 71 44.624 43.384 1.240 1 1 401 . 7 1 1 A 71 71 GLY N N 71 108.896 109.109 -0.213 1 1 402 . 7 1 1 A 72 72 TYR H H 72 8.925 9.080 -0.155 1 1 403 . 7 1 1 A 72 72 TYR C C 72 173.278 174.212 -0.934 1 1 404 . 7 1 1 A 72 72 TYR CA C 72 55.912 56.422 -0.510 1 1 405 . 7 1 1 A 72 72 TYR CB C 72 41.611 40.606 1.005 1 1 406 . 7 1 1 A 72 72 TYR N N 72 123.253 120.973 2.280 1 1 407 . 7 1 1 A 73 73 ASP H H 73 8.665 9.116 -0.451 1 1 408 . 7 1 1 A 73 73 ASP C C 73 173.598 175.610 -2.012 1 1 409 . 7 1 1 A 73 73 ASP CA C 73 52.857 53.560 -0.703 1 1 410 . 7 1 1 A 73 73 ASP CB C 73 42.774 42.092 0.682 1 1 411 . 7 1 1 A 73 73 ASP N N 73 126.178 124.917 1.261 1 1 412 . 7 1 1 A 74 74 TRP H H 74 9.080 8.877 0.203 1 1 413 . 7 1 1 A 74 74 TRP C C 74 174.868 174.226 0.642 1 1 414 . 7 1 1 A 74 74 TRP CB C 74 30.083 32.919 -2.836 1 1 415 . 7 1 1 A 74 74 TRP N N 74 121.824 127.541 -5.717 1 1 416 . 7 1 1 A 78 78 MET C C 78 174.548 176.585 -2.037 1 1 417 . 7 1 1 A 78 78 MET CA C 78 54.388 56.113 -1.725 1 1 418 . 7 1 1 A 78 78 MET CB C 78 32.542 34.072 -1.530 1 1 419 . 7 1 1 A 79 79 ALA H H 79 8.105 7.517 0.588 1 1 420 . 7 1 1 A 79 79 ALA C C 79 176.629 175.889 0.740 1 1 421 . 7 1 1 A 79 79 ALA CA C 79 51.210 53.387 -2.177 1 1 422 . 7 1 1 A 79 79 ALA CB C 79 19.106 21.232 -2.126 1 1 423 . 7 1 1 A 79 79 ALA N N 79 125.778 119.732 6.046 1 1 424 . 7 1 1 A 80 80 TYR H H 80 8.035 7.943 0.092 1 1 425 . 7 1 1 A 80 80 TYR C C 80 175.604 175.496 0.108 1 1 426 . 7 1 1 A 80 80 TYR CA C 80 57.021 57.406 -0.385 1 1 427 . 7 1 1 A 80 80 TYR CB C 80 38.416 40.841 -2.425 1 1 428 . 7 1 1 A 80 80 TYR N N 80 120.045 119.268 0.777 1 1 429 . 7 1 1 A 81 81 LYS H H 81 8.295 8.392 -0.097 1 1 430 . 7 1 1 A 81 81 LYS C C 81 176.647 177.137 -0.490 1 1 431 . 7 1 1 A 81 81 LYS CA C 81 56.285 54.652 1.633 1 1 432 . 7 1 1 A 81 81 LYS CB C 81 31.571 34.038 -2.467 1 1 434 . 7 1 1 A 81 81 LYS N N 81 123.191 125.298 -2.107 1 1 435 . 7 1 1 A 82 82 GLY H H 82 8.117 8.583 -0.466 1 1 436 . 7 1 1 A 82 82 GLY C C 82 174.010 174.227 -0.217 1 1 437 . 7 1 1 A 82 82 GLY CA C 82 44.982 45.909 -0.927 1 1 438 . 7 1 1 A 82 82 GLY N N 82 110.014 110.484 -0.470 1 1 439 . 7 1 1 A 83 83 SER H H 83 7.938 8.910 -0.972 1 1 440 . 7 1 1 A 83 83 SER C C 83 174.634 174.545 0.089 1 1 441 . 7 1 1 A 83 83 SER CA C 83 57.685 59.374 -1.689 1 1 442 . 7 1 1 A 83 83 SER CB C 83 63.303 66.195 -2.892 1 1 443 . 7 1 1 A 83 83 SER N N 83 115.655 120.905 -5.250 1 1 444 . 7 1 1 A 84 84 VAL H H 84 8.008 8.308 -0.300 1 1 451 . 7 1 1 A 84 84 VAL C C 84 175.525 174.254 1.271 1 1 452 . 7 1 1 A 84 84 VAL CA C 84 61.769 61.670 0.099 1 1 453 . 7 1 1 A 84 84 VAL CB C 84 31.711 29.905 1.806 1 1 456 . 7 1 1 A 84 84 VAL N N 84 120.054 120.100 -0.046 1 1 457 . 7 1 1 A 85 85 ASP H H 85 8.140 7.662 0.478 1 1 458 . 7 1 1 A 85 85 ASP C C 85 174.740 175.870 -1.130 1 1 459 . 7 1 1 A 85 85 ASP CA C 85 53.983 52.637 1.346 1 1 460 . 7 1 1 A 85 85 ASP CB C 85 40.633 43.212 -2.579 1 1 461 . 7 1 1 A 85 85 ASP N N 85 122.510 121.507 1.003 1 1 462 . 7 1 1 A 86 86 ASN H H 86 7.736 8.466 -0.730 1 1 463 . 7 1 1 A 86 86 ASN C C 86 175.970 175.551 0.419 1 1 464 . 7 1 1 A 86 86 ASN CA C 86 54.349 52.033 2.316 1 1 465 . 7 1 1 A 86 86 ASN CB C 86 40.490 38.593 1.897 1 1 467 . 7 1 1 A 86 86 ASN N N 86 124.290 116.915 7.375 1 1 468 . 7 1 1 A 87 87 GLY H H 87 8.000 7.856 0.144 1 1 469 . 7 1 1 A 87 87 GLY C C 87 173.456 173.641 -0.185 1 1 470 . 7 1 1 A 87 87 GLY CA C 87 44.973 44.232 0.741 1 1 471 . 7 1 1 A 87 87 GLY N N 87 113.494 109.793 3.701 1 1 472 . 7 1 1 A 88 88 ALA H H 88 8.024 8.125 -0.101 1 1 473 . 7 1 1 A 88 88 ALA C C 88 176.833 177.059 -0.226 1 1 474 . 7 1 1 A 88 88 ALA CA C 88 51.734 52.288 -0.554 1 1 475 . 7 1 1 A 88 88 ALA CB C 88 19.818 20.226 -0.408 1 1 476 . 7 1 1 A 88 88 ALA N N 88 122.676 122.466 0.210 1 1 477 . 7 1 1 A 91 91 ALA C C 91 174.781 176.124 -1.343 1 1 478 . 7 1 1 A 91 91 ALA CA C 91 50.537 51.812 -1.275 1 1 479 . 7 1 1 A 91 91 ALA CB C 91 21.324 23.026 -1.702 1 1 480 . 7 1 1 A 92 92 GLN H H 92 8.451 9.084 -0.633 1 1 481 . 7 1 1 A 92 92 GLN C C 92 173.557 174.772 -1.215 1 1 482 . 7 1 1 A 92 92 GLN CA C 92 53.380 55.827 -2.447 1 1 484 . 7 1 1 A 92 92 GLN N N 92 116.847 120.606 -3.759 1 1 485 . 7 1 1 A 93 93 GLY C C 93 170.631 172.689 -2.058 1 1 486 . 7 1 1 A 93 93 GLY CA C 93 45.718 45.250 0.468 1 1 487 . 7 1 1 A 94 94 VAL H H 94 8.686 9.254 -0.568 1 1 494 . 7 1 1 A 94 94 VAL C C 94 173.698 174.701 -1.003 1 1 495 . 7 1 1 A 94 94 VAL CA C 94 58.997 60.164 -1.167 1 1 496 . 7 1 1 A 94 94 VAL CB C 94 33.311 34.232 -0.921 1 1 499 . 7 1 1 A 94 94 VAL N N 94 118.489 120.930 -2.441 1 1 500 . 7 1 1 A 95 95 GLN H H 95 9.468 9.395 0.073 1 1 501 . 7 1 1 A 95 95 GLN C C 95 174.028 174.348 -0.320 1 1 502 . 7 1 1 A 95 95 GLN CA C 95 52.547 54.264 -1.717 1 1 503 . 7 1 1 A 95 95 GLN CB C 95 33.816 31.709 2.107 1 1 505 . 7 1 1 A 95 95 GLN N N 95 122.106 126.519 -4.413 1 1 506 . 7 1 1 A 96 96 LEU H H 96 8.484 9.078 -0.594 1 1 513 . 7 1 1 A 96 96 LEU C C 96 175.322 175.466 -0.144 1 1 514 . 7 1 1 A 96 96 LEU CA C 96 53.736 53.962 -0.226 1 1 515 . 7 1 1 A 96 96 LEU CB C 96 41.088 44.739 -3.651 1 1 519 . 7 1 1 A 96 96 LEU N N 96 123.224 125.284 -2.060 1 1 520 . 7 1 1 A 97 97 THR H H 97 9.116 9.082 0.034 1 1 521 . 7 1 1 A 97 97 THR C C 97 173.251 172.231 1.020 1 1 522 . 7 1 1 A 97 97 THR CA C 97 58.931 59.664 -0.733 1 1 523 . 7 1 1 A 97 97 THR CB C 97 72.984 72.333 0.651 1 1 525 . 7 1 1 A 97 97 THR N N 97 112.504 115.750 -3.246 1 1 526 . 7 1 1 A 98 98 ALA H H 98 8.603 8.919 -0.316 1 1 527 . 7 1 1 A 98 98 ALA C C 98 174.948 176.461 -1.513 1 1 528 . 7 1 1 A 98 98 ALA CA C 98 49.980 49.793 0.187 1 1 529 . 7 1 1 A 98 98 ALA CB C 98 19.157 21.633 -2.476 1 1 530 . 7 1 1 A 98 98 ALA N N 98 121.608 123.612 -2.004 1 1 531 . 7 1 1 A 99 99 LYS H H 99 8.890 9.136 -0.246 1 1 532 . 7 1 1 A 99 99 LYS C C 99 174.294 175.626 -1.332 1 1 533 . 7 1 1 A 99 99 LYS CA C 99 54.019 54.812 -0.793 1 1 534 . 7 1 1 A 99 99 LYS CB C 99 33.018 35.381 -2.363 1 1 538 . 7 1 1 A 99 99 LYS N N 99 124.522 120.220 4.302 1 1 539 . 7 1 1 A 100 100 LEU H H 100 8.985 8.847 0.138 1 1 546 . 7 1 1 A 100 100 LEU C C 100 175.265 175.776 -0.511 1 1 547 . 7 1 1 A 100 100 LEU CA C 100 52.698 52.998 -0.300 1 1 548 . 7 1 1 A 100 100 LEU CB C 100 42.889 44.738 -1.849 1 1 552 . 7 1 1 A 100 100 LEU N N 100 131.876 122.032 9.844 1 1 553 . 7 1 1 A 101 101 GLY H H 101 9.137 8.346 0.791 1 1 554 . 7 1 1 A 101 101 GLY C C 101 170.798 171.490 -0.692 1 1 555 . 7 1 1 A 101 101 GLY CA C 101 44.429 46.131 -1.702 1 1 556 . 7 1 1 A 101 101 GLY N N 101 111.928 107.124 4.804 1 1 557 . 7 1 1 A 102 102 TYR H H 102 8.779 8.767 0.012 1 1 558 . 7 1 1 A 102 102 TYR C C 102 173.402 173.504 -0.102 1 1 559 . 7 1 1 A 102 102 TYR CA C 102 54.444 56.542 -2.098 1 1 560 . 7 1 1 A 102 102 TYR CB C 102 42.239 42.470 -0.231 1 1 561 . 7 1 1 A 102 102 TYR N N 102 116.664 120.025 -3.361 1 1 562 . 7 1 1 A 103 103 PRO C C 103 175.676 175.913 -0.237 1 1 563 . 7 1 1 A 103 103 PRO CA C 103 61.462 62.802 -1.340 1 1 564 . 7 1 1 A 103 103 PRO CB C 103 30.073 33.183 -3.110 1 1 565 . 7 1 1 A 104 104 ILE H H 104 8.670 9.089 -0.419 1 1 569 . 7 1 1 A 104 104 ILE C C 104 176.646 176.792 -0.146 1 1 570 . 7 1 1 A 104 104 ILE CA C 104 62.054 61.701 0.353 1 1 571 . 7 1 1 A 104 104 ILE CB C 104 37.678 40.949 -3.271 1 1 574 . 7 1 1 A 104 104 ILE N N 104 125.939 120.944 4.995 1 1 575 . 7 1 1 A 105 105 THR H H 105 8.129 7.863 0.266 1 1 576 . 7 1 1 A 105 105 THR C C 105 174.344 175.238 -0.894 1 1 577 . 7 1 1 A 105 105 THR CA C 105 59.176 63.692 -4.516 1 1 578 . 7 1 1 A 105 105 THR CB C 105 71.049 70.594 0.455 1 1 580 . 7 1 1 A 105 105 THR N N 105 109.853 112.811 -2.958 1 1 581 . 7 1 1 A 106 106 ASP H H 106 8.424 8.216 0.208 1 1 582 . 7 1 1 A 106 106 ASP C C 106 175.692 176.232 -0.540 1 1 583 . 7 1 1 A 106 106 ASP CA C 106 56.465 54.815 1.650 1 1 584 . 7 1 1 A 106 106 ASP CB C 106 40.032 42.275 -2.243 1 1 585 . 7 1 1 A 106 106 ASP N N 106 117.156 116.548 0.608 1 1 586 . 7 1 1 A 107 107 ASP H H 107 8.124 8.538 -0.414 1 1 587 . 7 1 1 A 107 107 ASP C C 107 174.174 174.748 -0.574 1 1 588 . 7 1 1 A 107 107 ASP CA C 107 52.907 53.562 -0.655 1 1 589 . 7 1 1 A 107 107 ASP CB C 107 41.661 41.301 0.360 1 1 590 . 7 1 1 A 107 107 ASP N N 107 113.591 117.558 -3.967 1 1 591 . 7 1 1 A 108 108 LEU H H 108 7.336 7.683 -0.347 1 1 598 . 7 1 1 A 108 108 LEU C C 108 174.321 175.038 -0.717 1 1 599 . 7 1 1 A 108 108 LEU CA C 108 54.449 53.449 1.000 1 1 600 . 7 1 1 A 108 108 LEU CB C 108 44.754 44.715 0.039 1 1 604 . 7 1 1 A 108 108 LEU N N 108 123.244 117.727 5.517 1 1 605 . 7 1 1 A 109 109 ASP H H 109 8.943 9.166 -0.223 1 1 606 . 7 1 1 A 109 109 ASP C C 109 176.248 174.990 1.258 1 1 607 . 7 1 1 A 109 109 ASP CA C 109 52.376 52.261 0.115 1 1 608 . 7 1 1 A 109 109 ASP CB C 109 42.764 44.818 -2.054 1 1 609 . 7 1 1 A 109 109 ASP N N 109 124.634 122.783 1.851 1 1 610 . 7 1 1 A 110 110 ILE H H 110 8.372 8.853 -0.481 1 1 614 . 7 1 1 A 110 110 ILE C C 110 173.735 174.737 -1.002 1 1 615 . 7 1 1 A 110 110 ILE CA C 110 59.129 59.351 -0.222 1 1 616 . 7 1 1 A 110 110 ILE CB C 110 39.402 40.690 -1.288 1 1 620 . 7 1 1 A 110 110 ILE N N 110 119.135 115.890 3.245 1 1 621 . 7 1 1 A 111 111 TYR H H 111 8.695 8.789 -0.094 1 1 622 . 7 1 1 A 111 111 TYR C C 111 172.838 172.420 0.418 1 1 623 . 7 1 1 A 111 111 TYR CA C 111 56.182 56.186 -0.004 1 1 624 . 7 1 1 A 111 111 TYR CB C 111 41.489 41.123 0.366 1 1 625 . 7 1 1 A 111 111 TYR N N 111 121.248 119.413 1.835 1 1 626 . 7 1 1 A 112 112 THR H H 112 9.172 8.803 0.369 1 1 627 . 7 1 1 A 112 112 THR C C 112 173.850 172.677 1.173 1 1 628 . 7 1 1 A 112 112 THR CA C 112 58.246 59.843 -1.597 1 1 629 . 7 1 1 A 112 112 THR CB C 112 71.676 71.958 -0.282 1 1 631 . 7 1 1 A 112 112 THR N N 112 110.671 115.069 -4.398 1 1 632 . 7 1 1 A 113 113 ARG H H 113 8.732 9.274 -0.542 1 1 633 . 7 1 1 A 113 113 ARG C C 113 175.037 174.689 0.348 1 1 634 . 7 1 1 A 113 113 ARG CA C 113 53.995 54.763 -0.768 1 1 635 . 7 1 1 A 113 113 ARG CB C 113 32.266 33.221 -0.955 1 1 638 . 7 1 1 A 113 113 ARG N N 113 120.642 125.059 -4.417 1 1 639 . 7 1 1 A 114 114 LEU H H 114 8.449 9.173 -0.724 1 1 646 . 7 1 1 A 114 114 LEU C C 114 175.812 175.890 -0.078 1 1 647 . 7 1 1 A 114 114 LEU CA C 114 53.335 53.764 -0.429 1 1 648 . 7 1 1 A 114 114 LEU CB C 114 45.182 44.882 0.300 1 1 652 . 7 1 1 A 114 114 LEU N N 114 119.078 124.649 -5.571 1 1 653 . 7 1 1 A 115 115 GLY H H 115 8.232 8.444 -0.212 1 1 654 . 7 1 1 A 115 115 GLY C C 115 171.343 172.472 -1.129 1 1 655 . 7 1 1 A 115 115 GLY CA C 115 46.217 46.130 0.087 1 1 656 . 7 1 1 A 115 115 GLY N N 115 108.966 112.468 -3.502 1 1 657 . 7 1 1 A 116 116 GLY H H 116 8.293 8.399 -0.106 1 1 658 . 7 1 1 A 116 116 GLY C C 116 169.856 172.777 -2.921 1 1 659 . 7 1 1 A 116 116 GLY CA C 116 44.084 44.893 -0.809 1 1 660 . 7 1 1 A 116 116 GLY N N 116 109.676 110.369 -0.693 1 1 661 . 7 1 1 A 117 117 MET H H 117 9.286 9.444 -0.158 1 1 662 . 7 1 1 A 117 117 MET C C 117 174.557 174.885 -0.328 1 1 663 . 7 1 1 A 117 117 MET CA C 117 53.258 53.305 -0.047 1 1 664 . 7 1 1 A 117 117 MET CB C 117 37.195 35.314 1.881 1 1 667 . 7 1 1 A 117 117 MET N N 117 120.425 116.728 3.697 1 1 668 . 7 1 1 A 118 118 VAL H H 118 9.062 9.177 -0.115 1 1 675 . 7 1 1 A 118 118 VAL C C 118 173.993 174.946 -0.953 1 1 676 . 7 1 1 A 118 118 VAL CA C 118 59.883 60.757 -0.874 1 1 677 . 7 1 1 A 118 118 VAL CB C 118 31.782 35.031 -3.249 1 1 680 . 7 1 1 A 118 118 VAL N N 118 126.948 119.858 7.090 1 1 681 . 7 1 1 A 119 119 TRP H H 119 8.482 9.030 -0.548 1 1 682 . 7 1 1 A 119 119 TRP C C 119 174.608 174.238 0.370 1 1 683 . 7 1 1 A 119 119 TRP CA C 119 53.332 56.755 -3.423 1 1 684 . 7 1 1 A 119 119 TRP CB C 119 33.569 33.454 0.115 1 1 685 . 7 1 1 A 119 119 TRP N N 119 124.631 128.588 -3.957 1 1 686 . 7 1 1 A 120 120 ARG H H 120 9.113 8.834 0.279 1 1 687 . 7 1 1 A 120 120 ARG C C 120 174.951 175.202 -0.251 1 1 688 . 7 1 1 A 120 120 ARG CA C 120 54.684 54.978 -0.294 1 1 689 . 7 1 1 A 120 120 ARG CB C 120 33.424 31.857 1.567 1 1 690 . 7 1 1 A 120 120 ARG N N 120 117.899 126.434 -8.535 1 1 691 . 7 1 1 A 121 121 ALA H H 121 9.299 8.383 0.916 1 1 692 . 7 1 1 A 121 121 ALA C C 121 175.954 175.103 0.851 1 1 693 . 7 1 1 A 121 121 ALA CA C 121 50.368 50.170 0.198 1 1 694 . 7 1 1 A 121 121 ALA CB C 121 21.141 23.281 -2.140 1 1 695 . 7 1 1 A 121 121 ALA N N 121 128.863 125.473 3.390 1 1 696 . 7 1 1 A 122 122 ASP H H 122 8.488 8.651 -0.163 1 1 697 . 7 1 1 A 122 122 ASP C C 122 175.635 174.085 1.550 1 1 698 . 7 1 1 A 122 122 ASP CA C 122 53.891 53.554 0.337 1 1 699 . 7 1 1 A 122 122 ASP CB C 122 42.492 45.329 -2.837 1 1 700 . 7 1 1 A 122 122 ASP N N 122 121.721 120.655 1.066 1 1 701 . 7 1 1 A 123 123 SER H H 123 8.466 8.750 -0.284 1 1 702 . 7 1 1 A 123 123 SER C C 123 174.325 173.401 0.924 1 1 703 . 7 1 1 A 123 123 SER CA C 123 57.325 57.026 0.299 1 1 704 . 7 1 1 A 123 123 SER CB C 123 63.988 64.097 -0.109 1 1 705 . 7 1 1 A 123 123 SER N N 123 117.374 117.856 -0.482 1 1 706 . 7 1 1 A 124 124 LYS H H 124 8.389 7.666 0.723 1 1 707 . 7 1 1 A 124 124 LYS C C 124 176.840 175.586 1.254 1 1 708 . 7 1 1 A 124 124 LYS CA C 124 56.036 54.894 1.142 1 1 709 . 7 1 1 A 124 124 LYS CB C 124 32.397 33.133 -0.736 1 1 711 . 7 1 1 A 124 124 LYS N N 124 122.883 124.793 -1.910 1 1 712 . 7 1 1 A 125 125 GLY H H 125 8.281 8.453 -0.172 1 1 713 . 7 1 1 A 125 125 GLY C C 125 173.592 173.258 0.334 1 1 714 . 7 1 1 A 125 125 GLY CA C 125 44.924 46.020 -1.096 1 1 715 . 7 1 1 A 125 125 GLY N N 125 109.541 113.418 -3.877 1 1 716 . 7 1 1 A 126 126 ASN H H 126 8.185 8.152 0.033 1 1 717 . 7 1 1 A 126 126 ASN C C 126 176.649 174.283 2.366 1 1 718 . 7 1 1 A 126 126 ASN CA C 126 52.763 52.030 0.733 1 1 719 . 7 1 1 A 126 126 ASN CB C 126 38.439 39.664 -1.225 1 1 720 . 7 1 1 A 126 126 ASN N N 126 119.019 118.544 0.475 1 1 721 . 7 1 1 A 127 127 TYR C C 127 176.913 175.775 1.138 1 1 722 . 7 1 1 A 127 127 TYR CA C 127 57.757 58.065 -0.308 1 1 723 . 7 1 1 A 127 127 TYR CB C 127 37.703 39.994 -2.291 1 1 724 . 7 1 1 A 128 128 ALA H H 128 8.050 8.594 -0.544 1 1 728 . 7 1 1 A 128 128 ALA C C 128 177.756 177.642 0.114 1 1 729 . 7 1 1 A 128 128 ALA CA C 128 52.321 54.104 -1.783 1 1 730 . 7 1 1 A 128 128 ALA CB C 128 18.273 19.097 -0.824 1 1 731 . 7 1 1 A 128 128 ALA N N 128 124.529 130.409 -5.880 1 1 732 . 7 1 1 A 129 129 SER H H 129 8.063 7.858 0.205 1 1 733 . 7 1 1 A 129 129 SER C C 129 174.938 173.773 1.165 1 1 734 . 7 1 1 A 129 129 SER CA C 129 58.202 59.455 -1.253 1 1 735 . 7 1 1 A 129 129 SER CB C 129 62.974 64.424 -1.450 1 1 736 . 7 1 1 A 129 129 SER N N 129 114.374 110.128 4.246 1 1 737 . 7 1 1 A 130 130 THR H H 130 7.875 7.712 0.163 1 1 741 . 7 1 1 A 130 130 THR C C 130 175.198 173.927 1.271 1 1 742 . 7 1 1 A 130 130 THR CA C 130 61.520 61.062 0.458 1 1 743 . 7 1 1 A 130 130 THR CB C 130 69.312 68.085 1.227 1 1 745 . 7 1 1 A 130 130 THR N N 130 113.608 112.082 1.526 1 1 746 . 7 1 1 A 131 131 GLY H H 131 8.219 8.320 -0.101 1 1 747 . 7 1 1 A 131 131 GLY C C 131 173.979 172.664 1.315 1 1 748 . 7 1 1 A 131 131 GLY CA C 131 44.991 44.579 0.412 1 1 749 . 7 1 1 A 131 131 GLY N N 131 110.848 112.014 -1.166 1 1 750 . 7 1 1 A 132 132 VAL H H 132 7.729 8.804 -1.075 1 1 757 . 7 1 1 A 132 132 VAL C C 132 175.988 174.621 1.367 1 1 758 . 7 1 1 A 132 132 VAL CA C 132 61.643 60.361 1.282 1 1 759 . 7 1 1 A 132 132 VAL CB C 132 31.941 34.239 -2.298 1 1 762 . 7 1 1 A 132 132 VAL N N 132 118.932 120.640 -1.708 1 1 763 . 7 1 1 A 133 133 SER H H 133 8.224 8.763 -0.539 1 1 764 . 7 1 1 A 133 133 SER C C 133 174.320 173.142 1.178 1 1 765 . 7 1 1 A 133 133 SER CA C 133 57.756 57.725 0.031 1 1 766 . 7 1 1 A 133 133 SER CB C 133 63.140 65.731 -2.591 1 1 767 . 7 1 1 A 133 133 SER N N 133 119.260 120.942 -1.682 1 1 768 . 7 1 1 A 134 134 ARG H H 134 8.199 8.753 -0.554 1 1 769 . 7 1 1 A 134 134 ARG C C 134 175.923 176.581 -0.658 1 1 770 . 7 1 1 A 134 134 ARG CA C 134 55.461 57.537 -2.076 1 1 771 . 7 1 1 A 134 134 ARG CB C 134 30.195 32.671 -2.476 1 1 774 . 7 1 1 A 134 134 ARG N N 134 123.262 126.762 -3.500 1 1 775 . 7 1 1 A 135 135 SER H H 135 8.256 7.935 0.321 1 1 776 . 7 1 1 A 135 135 SER C C 135 174.360 173.416 0.944 1 1 777 . 7 1 1 A 135 135 SER CA C 135 57.730 57.674 0.056 1 1 778 . 7 1 1 A 135 135 SER CB C 135 63.275 63.247 0.028 1 1 779 . 7 1 1 A 135 135 SER N N 135 117.155 111.688 5.467 1 1 780 . 7 1 1 A 136 136 GLU H H 136 8.374 7.569 0.805 1 1 781 . 7 1 1 A 136 136 GLU C C 136 176.284 174.933 1.351 1 1 782 . 7 1 1 A 136 136 GLU CA C 136 56.082 55.140 0.942 1 1 783 . 7 1 1 A 136 136 GLU CB C 136 29.820 30.047 -0.227 1 1 785 . 7 1 1 A 136 136 GLU N N 136 122.812 121.111 1.701 1 1 786 . 7 1 1 A 137 137 HIS H H 137 8.118 8.686 -0.568 1 1 787 . 7 1 1 A 137 137 HIS C C 137 173.529 175.117 -1.588 1 1 788 . 7 1 1 A 137 137 HIS CA C 137 54.793 55.336 -0.543 1 1 789 . 7 1 1 A 137 137 HIS CB C 137 30.191 31.110 -0.919 1 1 790 . 7 1 1 A 137 137 HIS N N 137 118.002 124.651 -6.649 1 1 791 . 7 1 1 A 138 138 ASP H H 138 8.572 8.900 -0.328 1 1 792 . 7 1 1 A 138 138 ASP C C 138 174.940 175.111 -0.171 1 1 793 . 7 1 1 A 138 138 ASP CA C 138 53.594 52.702 0.892 1 1 794 . 7 1 1 A 138 138 ASP CB C 138 42.165 44.453 -2.288 1 1 795 . 7 1 1 A 138 138 ASP N N 138 121.536 122.786 -1.250 1 1 796 . 7 1 1 A 139 139 THR H H 139 7.857 8.773 -0.916 1 1 797 . 7 1 1 A 139 139 THR C C 139 172.822 173.280 -0.458 1 1 798 . 7 1 1 A 139 139 THR CA C 139 59.197 60.791 -1.594 1 1 799 . 7 1 1 A 139 139 THR CB C 139 71.457 72.481 -1.024 1 1 801 . 7 1 1 A 139 139 THR N N 139 113.598 116.301 -2.703 1 1 802 . 7 1 1 A 140 140 GLY C C 140 169.622 172.072 -2.450 1 1 803 . 7 1 1 A 140 140 GLY CA C 140 44.287 45.278 -0.991 1 1 804 . 7 1 1 A 141 141 VAL H H 141 7.815 9.120 -1.305 1 1 811 . 7 1 1 A 141 141 VAL C C 141 176.038 174.379 1.659 1 1 812 . 7 1 1 A 141 141 VAL CA C 141 59.739 59.710 0.029 1 1 813 . 7 1 1 A 141 141 VAL CB C 141 33.308 34.834 -1.526 1 1 816 . 7 1 1 A 141 141 VAL N N 141 116.224 124.901 -8.677 1 1 817 . 7 1 1 A 142 142 SER H H 142 9.284 9.066 0.218 1 1 818 . 7 1 1 A 142 142 SER C C 142 171.050 171.614 -0.564 1 1 819 . 7 1 1 A 142 142 SER CB C 142 67.608 65.423 2.185 1 1 820 . 7 1 1 A 142 142 SER N N 142 123.223 122.169 1.054 1 1 821 . 7 1 1 A 143 143 PRO C C 143 174.032 176.010 -1.978 1 1 822 . 7 1 1 A 143 143 PRO CA C 143 62.350 62.553 -0.203 1 1 823 . 7 1 1 A 143 143 PRO CB C 143 31.774 33.169 -1.395 1 1 825 . 7 1 1 A 144 144 VAL H H 144 7.785 8.781 -0.996 1 1 832 . 7 1 1 A 144 144 VAL C C 144 172.826 174.046 -1.220 1 1 833 . 7 1 1 A 144 144 VAL CA C 144 59.770 59.808 -0.038 1 1 834 . 7 1 1 A 144 144 VAL CB C 144 34.407 36.029 -1.622 1 1 837 . 7 1 1 A 144 144 VAL N N 144 120.214 116.195 4.019 1 1 838 . 7 1 1 A 145 145 PHE H H 145 8.623 8.772 -0.149 1 1 839 . 7 1 1 A 145 145 PHE C C 145 173.658 173.258 0.400 1 1 840 . 7 1 1 A 145 145 PHE CA C 145 54.942 57.474 -2.532 1 1 841 . 7 1 1 A 145 145 PHE CB C 145 42.692 42.341 0.351 1 1 842 . 7 1 1 A 145 145 PHE N N 145 123.914 123.579 0.335 1 1 843 . 7 1 1 A 146 146 ALA H H 146 8.886 8.541 0.345 1 1 844 . 7 1 1 A 146 146 ALA C C 146 176.258 175.210 1.048 1 1 845 . 7 1 1 A 146 146 ALA CA C 146 49.734 49.850 -0.116 1 1 846 . 7 1 1 A 146 146 ALA CB C 146 22.244 22.839 -0.595 1 1 847 . 7 1 1 A 146 146 ALA N N 146 125.243 129.186 -3.943 1 1 848 . 7 1 1 A 147 147 GLY H H 147 8.470 8.062 0.408 1 1 849 . 7 1 1 A 147 147 GLY C C 147 170.940 172.080 -1.140 1 1 850 . 7 1 1 A 147 147 GLY CA C 147 44.063 43.815 0.248 1 1 851 . 7 1 1 A 147 147 GLY N N 147 106.669 106.669 0.000 1 1 852 . 7 1 1 A 148 148 GLY H H 148 8.008 8.065 -0.057 1 1 853 . 7 1 1 A 148 148 GLY C C 148 170.181 172.251 -2.070 1 1 854 . 7 1 1 A 148 148 GLY CA C 148 45.736 45.428 0.308 1 1 855 . 7 1 1 A 148 148 GLY N N 148 109.475 109.143 0.332 1 1 856 . 7 1 1 A 149 149 VAL H H 149 8.426 8.559 -0.133 1 1 863 . 7 1 1 A 149 149 VAL C C 149 174.157 173.536 0.621 1 1 864 . 7 1 1 A 149 149 VAL CA C 149 58.200 58.971 -0.771 1 1 865 . 7 1 1 A 149 149 VAL CB C 149 34.464 35.610 -1.146 1 1 868 . 7 1 1 A 149 149 VAL N N 149 112.651 116.059 -3.408 1 1 869 . 7 1 1 A 150 150 GLU H H 150 9.070 9.692 -0.622 1 1 870 . 7 1 1 A 150 150 GLU C C 150 173.892 174.947 -1.055 1 1 871 . 7 1 1 A 150 150 GLU CA C 150 54.617 54.931 -0.314 1 1 872 . 7 1 1 A 150 150 GLU CB C 150 32.911 32.395 0.516 1 1 874 . 7 1 1 A 150 150 GLU N N 150 124.471 122.428 2.043 1 1 875 . 7 1 1 A 151 151 TRP H H 151 9.461 9.616 -0.155 1 1 877 . 7 1 1 A 151 151 TRP C C 151 174.370 174.510 -0.140 1 1 878 . 7 1 1 A 151 151 TRP CA C 151 54.113 55.339 -1.226 1 1 879 . 7 1 1 A 151 151 TRP CB C 151 31.688 32.745 -1.057 1 1 880 . 7 1 1 A 151 151 TRP N N 151 129.611 129.008 0.603 1 1 882 . 7 1 1 A 152 152 ALA H H 152 8.771 8.333 0.438 1 1 883 . 7 1 1 A 152 152 ALA C C 152 175.079 176.612 -1.533 1 1 884 . 7 1 1 A 152 152 ALA CA C 152 51.417 51.791 -0.374 1 1 885 . 7 1 1 A 152 152 ALA CB C 152 17.209 19.055 -1.846 1 1 886 . 7 1 1 A 152 152 ALA N N 152 130.502 130.540 -0.038 1 1 887 . 7 1 1 A 153 153 VAL H H 153 7.893 8.494 -0.601 1 1 894 . 7 1 1 A 153 153 VAL C C 153 176.612 176.106 0.506 1 1 895 . 7 1 1 A 153 153 VAL CA C 153 63.600 63.995 -0.395 1 1 896 . 7 1 1 A 153 153 VAL CB C 153 31.280 32.354 -1.074 1 1 899 . 7 1 1 A 153 153 VAL N N 153 124.360 123.397 0.963 1 1 900 . 7 1 1 A 154 154 THR H H 154 7.950 7.760 0.190 1 1 904 . 7 1 1 A 154 154 THR C C 154 173.884 175.063 -1.179 1 1 905 . 7 1 1 A 154 154 THR CA C 154 58.655 61.482 -2.827 1 1 906 . 7 1 1 A 154 154 THR CB C 154 71.262 69.788 1.474 1 1 908 . 7 1 1 A 154 154 THR N N 154 109.176 114.250 -5.074 1 1 909 . 7 1 1 A 155 155 ARG H H 155 8.310 8.572 -0.262 1 1 910 . 7 1 1 A 155 155 ARG C C 155 176.753 176.623 0.130 1 1 911 . 7 1 1 A 155 155 ARG CA C 155 58.456 58.444 0.012 1 1 912 . 7 1 1 A 155 155 ARG CB C 155 29.043 30.226 -1.183 1 1 915 . 7 1 1 A 155 155 ARG N N 155 116.576 123.608 -7.032 1 1 916 . 7 1 1 A 156 156 ASP H H 156 7.783 8.135 -0.352 1 1 917 . 7 1 1 A 156 156 ASP C C 156 174.222 175.311 -1.089 1 1 918 . 7 1 1 A 156 156 ASP CA C 156 53.540 53.097 0.443 1 1 919 . 7 1 1 A 156 156 ASP CB C 156 42.327 41.372 0.955 1 1 920 . 7 1 1 A 156 156 ASP N N 156 112.950 114.608 -1.658 1 1 921 . 7 1 1 A 157 157 ILE H H 157 7.233 7.453 -0.220 1 1 925 . 7 1 1 A 157 157 ILE C C 157 174.178 175.168 -0.990 1 1 926 . 7 1 1 A 157 157 ILE CA C 157 59.350 60.454 -1.104 1 1 927 . 7 1 1 A 157 157 ILE CB C 157 38.969 41.169 -2.200 1 1 930 . 7 1 1 A 157 157 ILE N N 157 119.732 119.731 0.001 1 1 931 . 7 1 1 A 158 158 ALA H H 158 8.729 9.175 -0.446 1 1 932 . 7 1 1 A 158 158 ALA C C 158 176.567 175.795 0.772 1 1 933 . 7 1 1 A 158 158 ALA CA C 158 49.418 50.274 -0.856 1 1 934 . 7 1 1 A 158 158 ALA CB C 158 21.430 22.677 -1.247 1 1 935 . 7 1 1 A 158 158 ALA N N 158 128.564 130.521 -1.957 1 1 936 . 7 1 1 A 159 159 THR H H 159 8.972 9.027 -0.055 1 1 940 . 7 1 1 A 159 159 THR C C 159 172.213 173.626 -1.413 1 1 941 . 7 1 1 A 159 159 THR CA C 159 59.504 61.158 -1.654 1 1 942 . 7 1 1 A 159 159 THR CB C 159 70.728 72.114 -1.386 1 1 944 . 7 1 1 A 159 159 THR N N 159 114.901 114.136 0.765 1 1 945 . 7 1 1 A 160 160 ARG H H 160 8.924 9.272 -0.348 1 1 946 . 7 1 1 A 160 160 ARG C C 160 174.097 174.031 0.066 1 1 947 . 7 1 1 A 160 160 ARG CA C 160 53.066 54.372 -1.306 1 1 948 . 7 1 1 A 160 160 ARG CB C 160 32.922 34.110 -1.188 1 1 951 . 7 1 1 A 160 160 ARG N N 160 121.507 122.892 -1.385 1 1 952 . 7 1 1 A 161 161 LEU H H 161 8.611 9.017 -0.406 1 1 959 . 7 1 1 A 161 161 LEU C C 161 174.389 174.203 0.186 1 1 960 . 7 1 1 A 161 161 LEU CA C 161 53.355 53.423 -0.068 1 1 961 . 7 1 1 A 161 161 LEU CB C 161 44.360 45.432 -1.072 1 1 964 . 7 1 1 A 161 161 LEU N N 161 124.711 122.888 1.823 1 1 965 . 7 1 1 A 162 162 GLU H H 162 8.746 8.812 -0.066 1 1 966 . 7 1 1 A 162 162 GLU C C 162 173.376 174.573 -1.197 1 1 967 . 7 1 1 A 162 162 GLU CA C 162 53.904 54.747 -0.843 1 1 968 . 7 1 1 A 162 162 GLU CB C 162 33.773 33.186 0.587 1 1 970 . 7 1 1 A 162 162 GLU N N 162 122.300 126.791 -4.491 1 1 971 . 7 1 1 A 163 163 TYR H H 163 8.872 8.915 -0.043 1 1 972 . 7 1 1 A 163 163 TYR C C 163 173.425 174.401 -0.976 1 1 973 . 7 1 1 A 163 163 TYR CA C 163 56.192 55.258 0.934 1 1 974 . 7 1 1 A 163 163 TYR CB C 163 40.870 41.695 -0.825 1 1 975 . 7 1 1 A 163 163 TYR N N 163 124.618 122.059 2.559 1 1 976 . 7 1 1 A 171 171 ASP C C 171 175.753 174.999 0.754 1 1 977 . 7 1 1 A 171 171 ASP CA C 171 53.517 53.849 -0.332 1 1 978 . 7 1 1 A 171 171 ASP CB C 171 41.353 41.356 -0.003 1 1 979 . 7 1 1 A 172 172 ALA H H 172 8.336 7.471 0.865 1 1 983 . 7 1 1 A 172 172 ALA C C 172 178.110 176.623 1.487 1 1 984 . 7 1 1 A 172 172 ALA CA C 172 52.190 50.883 1.307 1 1 985 . 7 1 1 A 172 172 ALA CB C 172 18.305 19.394 -1.089 1 1 986 . 7 1 1 A 172 172 ALA N N 172 125.294 123.343 1.951 1 1 987 . 7 1 1 A 173 173 GLY H H 173 8.300 8.341 -0.041 1 1 988 . 7 1 1 A 173 173 GLY C C 173 174.437 173.601 0.836 1 1 989 . 7 1 1 A 173 173 GLY CA C 173 45.083 45.331 -0.248 1 1 990 . 7 1 1 A 173 173 GLY N N 173 107.268 109.929 -2.661 1 1 991 . 7 1 1 A 174 174 THR H H 174 7.754 8.640 -0.886 1 1 992 . 7 1 1 A 174 174 THR C C 174 174.738 174.788 -0.050 1 1 993 . 7 1 1 A 174 174 THR CA C 174 61.310 63.838 -2.528 1 1 994 . 7 1 1 A 174 174 THR CB C 174 69.310 69.800 -0.490 1 1 996 . 7 1 1 A 174 174 THR N N 174 113.472 117.401 -3.929 1 1 997 . 7 1 1 A 175 175 VAL H H 175 7.993 7.748 0.245 1 1 1004 . 7 1 1 A 175 175 VAL C C 175 176.535 175.535 1.000 1 1 1005 . 7 1 1 A 175 175 VAL CA C 175 62.126 61.372 0.754 1 1 1006 . 7 1 1 A 175 175 VAL CB C 175 31.282 32.805 -1.523 1 1 1009 . 7 1 1 A 175 175 VAL N N 175 121.643 118.785 2.858 1 1 1010 . 7 1 1 A 176 176 GLY H H 176 8.056 8.446 -0.390 1 1 1011 . 7 1 1 A 176 176 GLY C C 176 173.930 173.730 0.200 1 1 1012 . 7 1 1 A 176 176 GLY CA C 176 44.983 45.877 -0.894 1 1 1013 . 7 1 1 A 176 176 GLY N N 176 110.460 113.960 -3.500 1 1 1014 . 7 1 1 A 177 177 THR H H 177 7.520 7.866 -0.346 1 1 1015 . 7 1 1 A 177 177 THR C C 177 173.574 174.380 -0.806 1 1 1016 . 7 1 1 A 177 177 THR CA C 177 60.609 59.953 0.656 1 1 1017 . 7 1 1 A 177 177 THR CB C 177 69.506 71.024 -1.518 1 1 1019 . 7 1 1 A 177 177 THR N N 177 113.390 110.032 3.358 1 1 1020 . 7 1 1 A 178 178 ARG H H 178 8.261 8.579 -0.318 1 1 1021 . 7 1 1 A 178 178 ARG C C 178 173.932 176.488 -2.556 1 1 1022 . 7 1 1 A 178 178 ARG CA C 178 53.683 60.812 -7.129 1 1 1023 . 7 1 1 A 178 178 ARG CB C 178 29.224 29.321 -0.097 1 1 1026 . 7 1 1 A 178 178 ARG N N 178 123.906 124.164 -0.258 1 1 1027 . 7 1 1 A 183 183 MET C C 183 174.053 174.844 -0.791 1 1 1028 . 7 1 1 A 183 183 MET CA C 183 53.700 54.937 -1.237 1 1 1029 . 7 1 1 A 183 183 MET CB C 183 35.908 34.828 1.080 1 1 1032 . 7 1 1 A 184 184 LEU H H 184 8.319 9.088 -0.769 1 1 1033 . 7 1 1 A 184 184 LEU C C 184 175.235 175.472 -0.237 1 1 1034 . 7 1 1 A 184 184 LEU CA C 184 53.120 53.471 -0.351 1 1 1035 . 7 1 1 A 184 184 LEU CB C 184 42.857 45.648 -2.791 1 1 1038 . 7 1 1 A 184 184 LEU N N 184 131.293 126.131 5.162 1 1 1039 . 7 1 1 A 185 185 SER H H 185 9.603 8.908 0.695 1 1 1040 . 7 1 1 A 185 185 SER C C 185 171.293 172.971 -1.678 1 1 1041 . 7 1 1 A 185 185 SER CA C 185 56.504 57.468 -0.964 1 1 1042 . 7 1 1 A 185 185 SER CB C 185 66.585 67.136 -0.551 1 1 1043 . 7 1 1 A 185 185 SER N N 185 119.338 115.958 3.380 1 1 1044 . 7 1 1 A 186 186 LEU H H 186 8.583 8.479 0.104 1 1 1051 . 7 1 1 A 186 186 LEU C C 186 175.328 176.236 -0.908 1 1 1052 . 7 1 1 A 186 186 LEU CA C 186 52.729 53.106 -0.377 1 1 1053 . 7 1 1 A 186 186 LEU CB C 186 44.996 45.052 -0.056 1 1 1056 . 7 1 1 A 186 186 LEU N N 186 122.719 123.589 -0.870 1 1 1057 . 7 1 1 A 187 187 GLY H H 187 9.287 8.496 0.791 1 1 1058 . 7 1 1 A 187 187 GLY C C 187 172.315 173.526 -1.211 1 1 1059 . 7 1 1 A 187 187 GLY CA C 187 43.502 45.087 -1.585 1 1 1060 . 7 1 1 A 187 187 GLY N N 187 110.265 110.423 -0.158 1 1 1061 . 7 1 1 A 188 188 VAL H H 188 8.825 8.666 0.159 1 1 1068 . 7 1 1 A 188 188 VAL C C 188 173.125 174.678 -1.553 1 1 1069 . 7 1 1 A 188 188 VAL CA C 188 59.739 59.388 0.351 1 1 1070 . 7 1 1 A 188 188 VAL CB C 188 34.532 34.833 -0.301 1 1 1073 . 7 1 1 A 188 188 VAL N N 188 119.161 116.652 2.509 1 1 1074 . 7 1 1 A 189 189 SER H H 189 9.051 8.864 0.187 1 1 1075 . 7 1 1 A 189 189 SER C C 189 171.698 172.415 -0.717 1 1 1076 . 7 1 1 A 189 189 SER CA C 189 55.997 57.354 -1.357 1 1 1077 . 7 1 1 A 189 189 SER CB C 189 66.094 66.400 -0.306 1 1 1078 . 7 1 1 A 189 189 SER N N 189 117.810 117.326 0.484 1 1 1079 . 7 1 1 A 190 190 TYR H H 190 9.145 8.891 0.254 1 1 1080 . 7 1 1 A 190 190 TYR C C 190 174.063 174.017 0.046 1 1 1081 . 7 1 1 A 190 190 TYR CA C 190 55.375 57.443 -2.068 1 1 1082 . 7 1 1 A 190 190 TYR CB C 190 41.183 42.314 -1.131 1 1 1083 . 7 1 1 A 190 190 TYR N N 190 123.690 121.749 1.941 1 1 1084 . 7 1 1 A 191 191 ARG H H 191 8.211 7.917 0.294 1 1 1085 . 7 1 1 A 191 191 ARG C C 191 174.826 174.260 0.566 1 1 1086 . 7 1 1 A 191 191 ARG CA C 191 54.464 54.625 -0.161 1 1 1087 . 7 1 1 A 191 191 ARG CB C 191 30.507 30.971 -0.464 1 1 1090 . 7 1 1 A 191 191 ARG N N 191 125.366 122.644 2.722 1 1 1091 . 7 1 1 A 192 192 PHE H H 192 8.496 8.036 0.460 1 1 1092 . 7 1 1 A 192 192 PHE C C 192 176.384 173.051 3.333 1 1 1093 . 7 1 1 A 192 192 PHE CA C 192 57.179 55.494 1.685 1 1 1094 . 7 1 1 A 192 192 PHE CB C 192 39.430 41.920 -2.490 1 1 1095 . 7 1 1 A 192 192 PHE N N 192 121.586 121.079 0.507 1 1 1096 . 7 1 1 A 193 193 GLY H H 193 8.643 8.444 0.199 1 1 1097 . 7 1 1 A 193 193 GLY C C 193 174.466 171.857 2.609 1 1 1098 . 7 1 1 A 193 193 GLY CA C 193 45.126 44.805 0.321 1 1 1099 . 7 1 1 A 193 193 GLY N N 193 109.499 111.633 -2.134 1 1 1100 . 7 1 1 A 194 194 GLN H H 194 8.512 9.302 -0.790 1 1 1101 . 7 1 1 A 194 194 GLN C C 194 176.201 175.627 0.574 1 1 1102 . 7 1 1 A 194 194 GLN CA C 194 55.433 54.538 0.895 1 1 1103 . 7 1 1 A 194 194 GLN CB C 194 28.729 31.673 -2.944 1 1 1105 . 7 1 1 A 194 194 GLN N N 194 119.448 123.823 -4.375 1 1 1106 . 7 1 1 A 195 195 GLU H H 195 8.530 8.931 -0.401 1 1 1107 . 7 1 1 A 195 195 GLU C C 195 176.151 176.672 -0.521 1 1 1108 . 7 1 1 A 195 195 GLU CA C 195 56.256 56.055 0.201 1 1 1109 . 7 1 1 A 195 195 GLU CB C 195 29.486 30.068 -0.582 1 1 1111 . 7 1 1 A 195 195 GLU N N 195 121.959 123.902 -1.943 1 1 1112 . 7 1 1 A 196 196 ASP H H 196 8.253 8.193 0.060 1 1 1113 . 7 1 1 A 196 196 ASP C C 196 175.667 175.626 0.041 1 1 1114 . 7 1 1 A 196 196 ASP CA C 196 53.981 55.153 -1.172 1 1 1115 . 7 1 1 A 196 196 ASP CB C 196 40.700 43.379 -2.679 1 1 1116 . 7 1 1 A 196 196 ASP N N 196 121.819 120.696 1.123 1 1 1117 . 7 1 1 A 197 197 ALA H H 197 7.999 8.316 -0.317 1 1 1121 . 7 1 1 A 197 197 ALA C C 197 176.847 177.973 -1.126 1 1 1122 . 7 1 1 A 197 197 ALA CA C 197 51.612 51.541 0.071 1 1 1123 . 7 1 1 A 197 197 ALA CB C 197 18.192 17.279 0.913 1 1 1124 . 7 1 1 A 197 197 ALA N N 197 124.262 121.593 2.669 1 1 1125 . 7 1 1 A 198 198 ALA H H 198 8.042 8.763 -0.721 1 1 1126 . 7 1 1 A 198 198 ALA C C 198 176.865 176.512 0.353 1 1 1127 . 7 1 1 A 198 198 ALA CA C 198 49.999 56.363 -6.364 1 1 1128 . 7 1 1 A 198 198 ALA CB C 198 17.327 18.810 -1.483 1 1 1129 . 7 1 1 A 198 198 ALA N N 198 124.724 125.186 -0.462 1 1 1130 . 7 1 1 A 199 199 PRO C C 199 176.727 176.324 0.403 1 1 1131 . 7 1 1 A 199 199 PRO CA C 199 62.399 64.971 -2.572 1 1 1132 . 7 1 1 A 199 199 PRO CB C 199 30.949 31.568 -0.619 1 1 1135 . 7 1 1 A 200 200 VAL H H 200 8.026 7.703 0.323 1 1 1142 . 7 1 1 A 200 200 VAL C C 200 176.034 173.730 2.304 1 1 1143 . 7 1 1 A 200 200 VAL CA C 200 61.944 59.632 2.312 1 1 1144 . 7 1 1 A 200 200 VAL CB C 200 31.734 35.361 -3.627 1 1 1147 . 7 1 1 A 200 200 VAL N N 200 120.635 116.301 4.334 1 1 1148 . 7 1 1 A 201 201 VAL H H 201 7.966 8.804 -0.838 1 1 1155 . 7 1 1 A 201 201 VAL C C 201 175.128 173.497 1.631 1 1 1156 . 7 1 1 A 201 201 VAL CA C 201 61.249 59.807 1.442 1 1 1157 . 7 1 1 A 201 201 VAL CB C 201 31.917 35.015 -3.098 1 1 1160 . 7 1 1 A 201 201 VAL N N 201 124.053 125.495 -1.442 1 1 1161 . 7 1 1 A 202 202 ALA H H 202 8.159 8.634 -0.475 1 1 1162 . 7 1 1 A 202 202 ALA C C 202 175.153 176.060 -0.907 1 1 1163 . 7 1 1 A 202 202 ALA CA C 202 49.742 50.064 -0.322 1 1 1164 . 7 1 1 A 202 202 ALA CB C 202 17.532 19.549 -2.017 1 1 1165 . 7 1 1 A 202 202 ALA N N 202 129.251 131.350 -2.099 1 1 1166 . 7 1 1 A 203 203 PRO C C 203 176.273 176.492 -0.219 1 1 1167 . 7 1 1 A 203 203 PRO CA C 203 62.324 63.001 -0.677 1 1 1168 . 7 1 1 A 203 203 PRO CB C 203 31.042 31.558 -0.516 1 1 1170 . 7 1 1 A 204 204 ALA H H 204 8.137 8.366 -0.229 1 1 1171 . 7 1 1 A 204 204 ALA C C 204 175.697 175.815 -0.118 1 1 1172 . 7 1 1 A 204 204 ALA CA C 204 49.865 50.434 -0.569 1 1 1173 . 7 1 1 A 204 204 ALA CB C 204 17.364 18.417 -1.053 1 1 1174 . 7 1 1 A 204 204 ALA N N 204 125.510 125.569 -0.059 1 1 1175 . 7 1 1 A 205 205 PRO C C 205 175.430 176.914 -1.484 1 1 1176 . 7 1 1 A 205 205 PRO CA C 205 62.511 62.856 -0.345 1 1 1177 . 7 1 1 A 205 205 PRO CB C 205 31.056 32.576 -1.520 1 1 1179 . 7 1 1 A 206 206 ALA H H 206 7.847 8.512 -0.665 1 1 1180 . 7 1 1 A 206 206 ALA C C 206 175.565 178.280 -2.715 1 1 1181 . 7 1 1 A 206 206 ALA CA C 206 49.487 55.531 -6.044 1 1 1182 . 7 1 1 A 206 206 ALA CB C 206 18.843 19.333 -0.490 1 1 1183 . 7 1 1 A 206 206 ALA N N 206 123.663 123.645 0.018 1 1 1184 . 7 1 1 A 207 207 PRO C C 207 174.397 176.176 -1.779 1 1 1185 . 7 1 1 A 207 207 PRO CA C 207 61.454 63.016 -1.562 1 1 1186 . 7 1 1 A 207 207 PRO CB C 207 31.929 31.433 0.496 1 1 1187 . 7 1 1 A 208 208 ALA H H 208 7.898 8.166 -0.268 1 1 1188 . 7 1 1 A 208 208 ALA C C 208 175.411 176.878 -1.467 1 1 1189 . 7 1 1 A 208 208 ALA CA C 208 49.472 50.034 -0.562 1 1 1190 . 7 1 1 A 208 208 ALA CB C 208 19.082 22.044 -2.962 1 1 1191 . 7 1 1 A 208 208 ALA N N 208 127.450 124.442 3.008 1 1 1192 . 7 1 1 A 209 209 PRO C C 209 176.932 177.517 -0.585 1 1 1193 . 7 1 1 A 209 209 PRO CA C 209 62.736 64.551 -1.815 1 1 1194 . 7 1 1 A 209 209 PRO CB C 209 31.012 32.052 -1.040 1 1 1 . 8 1 1 A 2 2 ARG C C 2 175.857 176.355 -0.498 1 1 2 . 8 1 1 A 2 2 ARG CA C 2 55.872 55.599 0.273 1 1 3 . 8 1 1 A 2 2 ARG CB C 2 29.983 30.987 -1.004 1 1 5 . 8 1 1 A 3 3 ILE H H 3 8.238 7.940 0.298 1 1 9 . 8 1 1 A 3 3 ILE C C 3 175.763 176.108 -0.345 1 1 10 . 8 1 1 A 3 3 ILE CA C 3 60.779 62.844 -2.065 1 1 11 . 8 1 1 A 3 3 ILE CB C 3 37.664 38.474 -0.810 1 1 15 . 8 1 1 A 3 3 ILE N N 3 122.580 121.640 0.940 1 1 16 . 8 1 1 A 4 4 MET H H 4 8.261 8.100 0.161 1 1 17 . 8 1 1 A 4 4 MET C C 4 175.660 174.727 0.933 1 1 18 . 8 1 1 A 4 4 MET CA C 4 54.893 54.317 0.576 1 1 19 . 8 1 1 A 4 4 MET CB C 4 32.060 35.494 -3.434 1 1 22 . 8 1 1 A 4 4 MET N N 4 123.988 117.904 6.084 1 1 23 . 8 1 1 A 5 5 LYS H H 5 8.041 8.793 -0.752 1 1 24 . 8 1 1 A 5 5 LYS C C 5 175.850 175.085 0.765 1 1 25 . 8 1 1 A 5 5 LYS CA C 5 56.081 55.968 0.113 1 1 26 . 8 1 1 A 5 5 LYS CB C 5 32.220 30.800 1.420 1 1 29 . 8 1 1 A 5 5 LYS N N 5 122.015 126.310 -4.295 1 1 30 . 8 1 1 A 6 6 ALA H H 6 8.042 7.448 0.594 1 1 34 . 8 1 1 A 6 6 ALA C C 6 177.160 177.161 -0.001 1 1 35 . 8 1 1 A 6 6 ALA CA C 6 52.109 50.308 1.801 1 1 36 . 8 1 1 A 6 6 ALA CB C 6 18.637 21.049 -2.412 1 1 37 . 8 1 1 A 6 6 ALA N N 6 123.943 123.978 -0.035 1 1 38 . 8 1 1 A 7 7 ILE H H 7 7.916 8.528 -0.612 1 1 42 . 8 1 1 A 7 7 ILE C C 7 175.611 175.490 0.121 1 1 43 . 8 1 1 A 7 7 ILE CA C 7 61.181 60.161 1.020 1 1 44 . 8 1 1 A 7 7 ILE CB C 7 37.910 39.577 -1.667 1 1 48 . 8 1 1 A 7 7 ILE N N 7 118.380 121.165 -2.785 1 1 49 . 8 1 1 A 8 8 PHE H H 8 8.167 8.376 -0.209 1 1 50 . 8 1 1 A 8 8 PHE C C 8 175.363 173.157 2.206 1 1 51 . 8 1 1 A 8 8 PHE CA C 8 57.286 56.199 1.087 1 1 52 . 8 1 1 A 8 8 PHE CB C 8 39.008 41.116 -2.108 1 1 53 . 8 1 1 A 8 8 PHE N N 8 121.971 118.375 3.596 1 1 54 . 8 1 1 A 9 9 VAL H H 9 7.872 8.873 -1.001 1 1 61 . 8 1 1 A 9 9 VAL C C 9 175.405 175.405 0.000 1 1 62 . 8 1 1 A 9 9 VAL CA C 9 61.662 61.575 0.087 1 1 63 . 8 1 1 A 9 9 VAL CB C 9 32.026 32.936 -0.910 1 1 66 . 8 1 1 A 9 9 VAL N N 9 120.864 118.075 2.789 1 1 67 . 8 1 1 A 10 10 LEU H H 10 8.077 8.911 -0.834 1 1 74 . 8 1 1 A 10 10 LEU C C 10 176.652 176.573 0.079 1 1 75 . 8 1 1 A 10 10 LEU CA C 10 54.856 55.843 -0.987 1 1 76 . 8 1 1 A 10 10 LEU CB C 10 41.401 44.532 -3.131 1 1 80 . 8 1 1 A 10 10 LEU N N 10 124.826 124.678 0.148 1 1 81 . 8 1 1 A 11 11 ASN H H 11 8.177 7.945 0.232 1 1 82 . 8 1 1 A 11 11 ASN C C 11 174.394 175.860 -1.466 1 1 83 . 8 1 1 A 11 11 ASN CA C 11 52.704 54.002 -1.298 1 1 84 . 8 1 1 A 11 11 ASN CB C 11 38.468 40.482 -2.014 1 1 85 . 8 1 1 A 11 11 ASN N N 11 119.029 117.252 1.777 1 1 86 . 8 1 1 A 12 12 ALA H H 12 7.991 8.664 -0.673 1 1 90 . 8 1 1 A 12 12 ALA C C 12 176.649 177.012 -0.363 1 1 91 . 8 1 1 A 12 12 ALA CA C 12 51.950 55.309 -3.359 1 1 92 . 8 1 1 A 12 12 ALA CB C 12 18.659 18.931 -0.272 1 1 93 . 8 1 1 A 12 12 ALA N N 12 123.695 127.825 -4.130 1 1 94 . 8 1 1 A 13 13 ALA H H 13 8.083 7.986 0.097 1 1 95 . 8 1 1 A 13 13 ALA C C 13 175.395 176.354 -0.959 1 1 96 . 8 1 1 A 13 13 ALA CA C 13 49.797 49.311 0.486 1 1 97 . 8 1 1 A 13 13 ALA CB C 13 17.486 20.061 -2.575 1 1 98 . 8 1 1 A 13 13 ALA N N 13 124.281 119.530 4.751 1 1 99 . 8 1 1 A 14 14 PRO C C 14 176.641 175.466 1.175 1 1 100 . 8 1 1 A 14 14 PRO CA C 14 62.675 62.379 0.296 1 1 101 . 8 1 1 A 14 14 PRO CB C 14 31.000 29.053 1.947 1 1 103 . 8 1 1 A 15 15 LYS H H 15 8.283 8.193 0.090 1 1 104 . 8 1 1 A 15 15 LYS C C 15 175.683 176.103 -0.420 1 1 105 . 8 1 1 A 15 15 LYS CA C 15 55.429 55.125 0.304 1 1 106 . 8 1 1 A 15 15 LYS CB C 15 32.246 33.199 -0.953 1 1 109 . 8 1 1 A 15 15 LYS N N 15 119.069 122.734 -3.665 1 1 110 . 8 1 1 A 16 16 ASP H H 16 7.880 8.674 -0.794 1 1 111 . 8 1 1 A 16 16 ASP C C 16 175.419 176.454 -1.035 1 1 112 . 8 1 1 A 16 16 ASP CA C 16 54.413 57.230 -2.817 1 1 113 . 8 1 1 A 16 16 ASP CB C 16 40.224 41.481 -1.257 1 1 114 . 8 1 1 A 16 16 ASP N N 16 119.625 125.778 -6.153 1 1 115 . 8 1 1 A 17 17 ASN H H 17 7.973 8.026 -0.053 1 1 116 . 8 1 1 A 17 17 ASN C C 17 174.231 174.031 0.200 1 1 117 . 8 1 1 A 17 17 ASN CA C 17 53.948 52.724 1.224 1 1 118 . 8 1 1 A 17 17 ASN CB C 17 37.009 38.513 -1.504 1 1 119 . 8 1 1 A 17 17 ASN N N 17 118.063 116.647 1.416 1 1 120 . 8 1 1 A 18 18 THR H H 18 7.318 8.219 -0.901 1 1 121 . 8 1 1 A 18 18 THR C C 18 172.323 172.758 -0.435 1 1 122 . 8 1 1 A 18 18 THR CA C 18 60.153 60.704 -0.551 1 1 123 . 8 1 1 A 18 18 THR CB C 18 71.534 71.827 -0.293 1 1 125 . 8 1 1 A 18 18 THR N N 18 109.092 119.472 -10.380 1 1 126 . 8 1 1 A 19 19 TRP H H 19 8.541 8.943 -0.402 1 1 127 . 8 1 1 A 19 19 TRP C C 19 175.969 174.846 1.123 1 1 128 . 8 1 1 A 19 19 TRP CA C 19 55.700 56.099 -0.399 1 1 129 . 8 1 1 A 19 19 TRP CB C 19 31.471 33.382 -1.911 1 1 130 . 8 1 1 A 19 19 TRP N N 19 121.992 124.339 -2.347 1 1 131 . 8 1 1 A 20 20 TYR H H 20 8.691 9.351 -0.660 1 1 132 . 8 1 1 A 20 20 TYR C C 20 173.684 174.505 -0.821 1 1 133 . 8 1 1 A 20 20 TYR CA C 20 55.805 56.170 -0.365 1 1 134 . 8 1 1 A 20 20 TYR CB C 20 40.513 42.582 -2.069 1 1 135 . 8 1 1 A 20 20 TYR N N 20 116.519 122.719 -6.200 1 1 136 . 8 1 1 A 21 21 ALA H H 21 8.876 8.646 0.230 1 1 137 . 8 1 1 A 21 21 ALA C C 21 175.395 176.149 -0.754 1 1 138 . 8 1 1 A 21 21 ALA CA C 21 50.970 51.178 -0.208 1 1 139 . 8 1 1 A 21 21 ALA CB C 21 22.142 23.409 -1.267 1 1 140 . 8 1 1 A 21 21 ALA N N 21 119.359 127.336 -7.977 1 1 141 . 8 1 1 A 22 22 GLY H H 22 8.613 8.478 0.135 1 1 142 . 8 1 1 A 22 22 GLY C C 22 171.458 172.241 -0.783 1 1 143 . 8 1 1 A 22 22 GLY CA C 22 45.608 46.168 -0.560 1 1 144 . 8 1 1 A 22 22 GLY N N 22 106.678 106.488 0.190 1 1 145 . 8 1 1 A 23 23 GLY H H 23 7.911 8.428 -0.517 1 1 146 . 8 1 1 A 23 23 GLY C C 23 170.563 172.307 -1.744 1 1 147 . 8 1 1 A 23 23 GLY CA C 23 44.026 45.382 -1.356 1 1 148 . 8 1 1 A 23 23 GLY N N 23 103.399 108.928 -5.529 1 1 149 . 8 1 1 A 24 24 LYS H H 24 9.001 9.854 -0.853 1 1 150 . 8 1 1 A 24 24 LYS C C 24 172.965 174.199 -1.234 1 1 151 . 8 1 1 A 24 24 LYS CA C 24 54.062 53.944 0.118 1 1 152 . 8 1 1 A 24 24 LYS CB C 24 36.774 36.741 0.033 1 1 156 . 8 1 1 A 24 24 LYS N N 24 116.402 118.946 -2.544 1 1 157 . 8 1 1 A 25 25 LEU H H 25 8.587 9.005 -0.418 1 1 164 . 8 1 1 A 25 25 LEU C C 25 175.205 174.958 0.247 1 1 165 . 8 1 1 A 25 25 LEU CA C 25 53.446 53.606 -0.160 1 1 166 . 8 1 1 A 25 25 LEU CB C 25 46.287 46.831 -0.544 1 1 170 . 8 1 1 A 25 25 LEU N N 25 119.932 121.326 -1.394 1 1 171 . 8 1 1 A 26 26 GLY H H 26 8.637 8.317 0.320 1 1 172 . 8 1 1 A 26 26 GLY C C 26 170.804 171.716 -0.912 1 1 173 . 8 1 1 A 26 26 GLY CA C 26 45.669 45.320 0.349 1 1 174 . 8 1 1 A 26 26 GLY N N 26 108.136 110.909 -2.773 1 1 175 . 8 1 1 A 27 27 TRP H H 27 8.642 8.301 0.341 1 1 177 . 8 1 1 A 27 27 TRP C C 27 174.820 175.761 -0.941 1 1 178 . 8 1 1 A 27 27 TRP CB C 27 30.883 31.308 -0.425 1 1 179 . 8 1 1 A 27 27 TRP N N 27 120.887 120.899 -0.012 1 1 181 . 8 1 1 A 32 32 ASP C C 32 176.315 178.010 -1.695 1 1 182 . 8 1 1 A 32 32 ASP CA C 32 53.737 55.774 -2.037 1 1 183 . 8 1 1 A 32 32 ASP CB C 32 41.230 41.991 -0.761 1 1 184 . 8 1 1 A 33 33 THR H H 33 8.190 8.087 0.103 1 1 188 . 8 1 1 A 33 33 THR C C 33 175.291 175.543 -0.252 1 1 189 . 8 1 1 A 33 33 THR CA C 33 61.909 65.178 -3.269 1 1 190 . 8 1 1 A 33 33 THR CB C 33 68.961 69.438 -0.477 1 1 192 . 8 1 1 A 33 33 THR N N 33 114.235 114.315 -0.080 1 1 193 . 8 1 1 A 34 34 GLY H H 34 8.341 7.840 0.501 1 1 194 . 8 1 1 A 34 34 GLY C C 34 173.766 172.792 0.974 1 1 195 . 8 1 1 A 34 34 GLY CA C 34 44.941 44.276 0.665 1 1 196 . 8 1 1 A 34 34 GLY N N 34 110.678 107.117 3.561 1 1 197 . 8 1 1 A 35 35 PHE H H 35 7.945 8.327 -0.382 1 1 198 . 8 1 1 A 35 35 PHE C C 35 175.411 174.472 0.939 1 1 199 . 8 1 1 A 35 35 PHE CA C 35 57.921 56.324 1.597 1 1 200 . 8 1 1 A 35 35 PHE CB C 35 38.806 42.323 -3.517 1 1 201 . 8 1 1 A 35 35 PHE N N 35 120.533 120.170 0.363 1 1 202 . 8 1 1 A 36 36 TYR H H 36 7.967 9.013 -1.046 1 1 203 . 8 1 1 A 36 36 TYR C C 36 176.104 175.145 0.959 1 1 204 . 8 1 1 A 36 36 TYR CA C 36 57.568 56.260 1.308 1 1 205 . 8 1 1 A 36 36 TYR CB C 36 37.727 42.611 -4.884 1 1 206 . 8 1 1 A 36 36 TYR N N 36 120.254 120.945 -0.691 1 1 207 . 8 1 1 A 37 37 GLY H H 37 7.666 9.238 -1.572 1 1 208 . 8 1 1 A 37 37 GLY C C 37 173.794 174.448 -0.654 1 1 209 . 8 1 1 A 37 37 GLY CA C 37 45.007 45.198 -0.191 1 1 210 . 8 1 1 A 37 37 GLY N N 37 108.995 109.707 -0.712 1 1 211 . 8 1 1 A 38 38 ASN H H 38 8.109 9.081 -0.972 1 1 212 . 8 1 1 A 38 38 ASN C C 38 175.612 175.923 -0.311 1 1 213 . 8 1 1 A 38 38 ASN CA C 38 52.954 54.569 -1.615 1 1 214 . 8 1 1 A 38 38 ASN CB C 38 38.425 39.919 -1.494 1 1 215 . 8 1 1 A 38 38 ASN N N 38 118.603 120.886 -2.283 1 1 216 . 8 1 1 A 39 39 GLY H H 39 8.202 7.817 0.385 1 1 217 . 8 1 1 A 39 39 GLY C C 39 173.958 172.680 1.278 1 1 218 . 8 1 1 A 39 39 GLY CA C 39 45.012 45.881 -0.869 1 1 219 . 8 1 1 A 39 39 GLY N N 39 108.897 103.723 5.174 1 1 220 . 8 1 1 A 40 40 PHE H H 40 7.960 8.530 -0.570 1 1 221 . 8 1 1 A 40 40 PHE C C 40 175.653 174.724 0.929 1 1 222 . 8 1 1 A 40 40 PHE CA C 40 57.556 56.845 0.711 1 1 223 . 8 1 1 A 40 40 PHE CB C 40 38.513 38.078 0.435 1 1 224 . 8 1 1 A 40 40 PHE N N 40 119.829 123.226 -3.397 1 1 225 . 8 1 1 A 41 41 GLN H H 41 8.173 8.154 0.019 1 1 226 . 8 1 1 A 41 41 GLN C C 41 175.234 174.569 0.665 1 1 227 . 8 1 1 A 41 41 GLN CA C 41 55.488 54.272 1.216 1 1 228 . 8 1 1 A 41 41 GLN CB C 41 28.523 30.857 -2.334 1 1 230 . 8 1 1 A 41 41 GLN N N 41 120.810 126.246 -5.436 1 1 231 . 8 1 1 A 42 42 ASN H H 42 8.193 8.956 -0.763 1 1 232 . 8 1 1 A 42 42 ASN C C 42 174.618 174.036 0.582 1 1 233 . 8 1 1 A 42 42 ASN CA C 42 52.924 52.794 0.130 1 1 234 . 8 1 1 A 42 42 ASN CB C 42 38.333 37.344 0.989 1 1 235 . 8 1 1 A 42 42 ASN N N 42 119.679 124.644 -4.965 1 1 236 . 8 1 1 A 43 43 ASN H H 43 8.255 8.406 -0.151 1 1 237 . 8 1 1 A 43 43 ASN C C 43 173.873 173.694 0.179 1 1 238 . 8 1 1 A 43 43 ASN CA C 43 52.919 51.853 1.066 1 1 239 . 8 1 1 A 43 43 ASN CB C 43 38.580 39.174 -0.594 1 1 240 . 8 1 1 A 43 43 ASN N N 43 119.773 123.390 -3.617 1 1 241 . 8 1 1 A 44 44 ASN H H 44 7.865 8.771 -0.906 1 1 242 . 8 1 1 A 44 44 ASN C C 44 175.518 174.731 0.787 1 1 243 . 8 1 1 A 44 44 ASN CA C 44 54.528 52.140 2.388 1 1 244 . 8 1 1 A 44 44 ASN CB C 44 40.170 38.242 1.928 1 1 246 . 8 1 1 A 44 44 ASN N N 44 124.152 122.302 1.850 1 1 247 . 8 1 1 A 46 46 PRO C C 46 177.228 176.095 1.133 1 1 248 . 8 1 1 A 46 46 PRO CA C 46 62.794 62.581 0.213 1 1 249 . 8 1 1 A 46 46 PRO CB C 46 31.283 32.730 -1.447 1 1 251 . 8 1 1 A 47 47 THR H H 47 8.165 8.291 -0.126 1 1 255 . 8 1 1 A 47 47 THR C C 47 174.573 173.985 0.588 1 1 256 . 8 1 1 A 47 47 THR CA C 47 61.346 62.011 -0.665 1 1 257 . 8 1 1 A 47 47 THR CB C 47 69.573 67.074 2.499 1 1 259 . 8 1 1 A 47 47 THR N N 47 114.265 116.557 -2.292 1 1 260 . 8 1 1 A 48 48 ARG H H 48 8.237 8.081 0.156 1 1 261 . 8 1 1 A 48 48 ARG C C 48 175.898 174.604 1.294 1 1 262 . 8 1 1 A 48 48 ARG CA C 48 55.717 54.123 1.594 1 1 263 . 8 1 1 A 48 48 ARG CB C 48 30.151 34.567 -4.416 1 1 266 . 8 1 1 A 48 48 ARG N N 48 122.795 124.020 -1.225 1 1 267 . 8 1 1 A 49 49 ASN H H 49 8.369 8.803 -0.434 1 1 268 . 8 1 1 A 49 49 ASN C C 49 174.560 176.277 -1.717 1 1 269 . 8 1 1 A 49 49 ASN CA C 49 53.005 52.059 0.946 1 1 270 . 8 1 1 A 49 49 ASN CB C 49 38.761 40.623 -1.862 1 1 271 . 8 1 1 A 49 49 ASN N N 49 119.837 119.797 0.040 1 1 272 . 8 1 1 A 50 50 ASP H H 50 8.192 8.745 -0.553 1 1 273 . 8 1 1 A 50 50 ASP C C 50 175.699 176.192 -0.493 1 1 274 . 8 1 1 A 50 50 ASP CA C 50 54.289 56.393 -2.104 1 1 275 . 8 1 1 A 50 50 ASP CB C 50 41.264 41.393 -0.129 1 1 276 . 8 1 1 A 50 50 ASP N N 50 120.403 120.970 -0.567 1 1 277 . 8 1 1 A 51 51 GLN H H 51 8.428 7.739 0.689 1 1 278 . 8 1 1 A 51 51 GLN C C 51 175.186 174.203 0.983 1 1 279 . 8 1 1 A 51 51 GLN CA C 51 54.512 55.477 -0.965 1 1 280 . 8 1 1 A 51 51 GLN CB C 51 30.424 32.457 -2.033 1 1 282 . 8 1 1 A 51 51 GLN N N 51 118.959 114.953 4.006 1 1 289 . 8 1 1 A 52 52 LEU C C 52 176.018 175.572 0.446 1 1 290 . 8 1 1 A 52 52 LEU CA C 52 54.332 52.960 1.372 1 1 291 . 8 1 1 A 52 52 LEU CB C 52 43.022 46.062 -3.040 1 1 294 . 8 1 1 A 53 53 GLY H H 53 8.639 8.816 -0.177 1 1 295 . 8 1 1 A 53 53 GLY C C 53 171.931 171.542 0.389 1 1 296 . 8 1 1 A 53 53 GLY CA C 53 43.501 44.469 -0.968 1 1 297 . 8 1 1 A 53 53 GLY N N 53 109.964 107.146 2.818 1 1 298 . 8 1 1 A 54 54 ALA H H 54 8.881 8.911 -0.030 1 1 299 . 8 1 1 A 54 54 ALA C C 54 175.543 176.371 -0.828 1 1 300 . 8 1 1 A 54 54 ALA CA C 54 50.710 50.270 0.440 1 1 301 . 8 1 1 A 54 54 ALA CB C 54 22.914 22.146 0.768 1 1 302 . 8 1 1 A 54 54 ALA N N 54 120.413 124.542 -4.129 1 1 303 . 8 1 1 A 55 55 GLY H H 55 8.346 9.182 -0.836 1 1 304 . 8 1 1 A 55 55 GLY C C 55 170.960 171.806 -0.846 1 1 305 . 8 1 1 A 55 55 GLY CA C 55 46.704 44.862 1.842 1 1 306 . 8 1 1 A 55 55 GLY N N 55 104.688 108.064 -3.376 1 1 307 . 8 1 1 A 56 56 ALA H H 56 9.116 9.034 0.082 1 1 308 . 8 1 1 A 56 56 ALA C C 56 176.472 176.689 -0.217 1 1 309 . 8 1 1 A 56 56 ALA CA C 56 49.638 50.930 -1.292 1 1 310 . 8 1 1 A 56 56 ALA CB C 56 22.275 21.291 0.984 1 1 311 . 8 1 1 A 56 56 ALA N N 56 120.608 127.739 -7.131 1 1 312 . 8 1 1 A 57 57 PHE H H 57 8.688 9.211 -0.523 1 1 313 . 8 1 1 A 57 57 PHE C C 57 172.816 175.647 -2.831 1 1 314 . 8 1 1 A 57 57 PHE CA C 57 56.066 55.995 0.071 1 1 315 . 8 1 1 A 57 57 PHE CB C 57 41.770 42.062 -0.292 1 1 316 . 8 1 1 A 57 57 PHE N N 57 120.027 119.478 0.549 1 1 317 . 8 1 1 A 58 58 GLY H H 58 9.034 8.638 0.396 1 1 318 . 8 1 1 A 58 58 GLY C C 58 170.860 172.875 -2.015 1 1 319 . 8 1 1 A 58 58 GLY CA C 58 44.954 44.965 -0.011 1 1 320 . 8 1 1 A 58 58 GLY N N 58 105.817 109.751 -3.934 1 1 321 . 8 1 1 A 59 59 GLY H H 59 8.382 8.701 -0.319 1 1 322 . 8 1 1 A 59 59 GLY C C 59 169.284 172.420 -3.136 1 1 323 . 8 1 1 A 59 59 GLY CA C 59 45.840 46.077 -0.237 1 1 324 . 8 1 1 A 59 59 GLY N N 59 109.059 110.177 -1.118 1 1 325 . 8 1 1 A 60 60 TYR H H 60 8.430 9.242 -0.812 1 1 326 . 8 1 1 A 60 60 TYR C C 60 173.453 172.105 1.348 1 1 327 . 8 1 1 A 60 60 TYR CA C 60 55.282 56.047 -0.765 1 1 328 . 8 1 1 A 60 60 TYR CB C 60 41.712 41.692 0.020 1 1 329 . 8 1 1 A 60 60 TYR N N 60 118.352 115.524 2.828 1 1 330 . 8 1 1 A 61 61 GLN H H 61 8.833 8.360 0.473 1 1 331 . 8 1 1 A 61 61 GLN C C 61 174.365 175.081 -0.716 1 1 332 . 8 1 1 A 61 61 GLN CA C 61 54.125 54.609 -0.484 1 1 333 . 8 1 1 A 61 61 GLN CB C 61 28.033 30.321 -2.288 1 1 335 . 8 1 1 A 61 61 GLN N N 61 129.628 119.389 10.239 1 1 336 . 8 1 1 A 62 62 VAL H H 62 8.714 8.298 0.416 1 1 343 . 8 1 1 A 62 62 VAL C C 62 175.758 175.974 -0.216 1 1 344 . 8 1 1 A 62 62 VAL CA C 62 64.649 63.264 1.385 1 1 345 . 8 1 1 A 62 62 VAL CB C 62 31.900 34.407 -2.507 1 1 348 . 8 1 1 A 62 62 VAL N N 62 127.666 122.745 4.921 1 1 349 . 8 1 1 A 63 63 ASN H H 63 8.062 7.694 0.368 1 1 350 . 8 1 1 A 63 63 ASN C C 63 172.827 175.355 -2.528 1 1 351 . 8 1 1 A 63 63 ASN CA C 63 51.575 51.983 -0.408 1 1 352 . 8 1 1 A 63 63 ASN CB C 63 37.194 37.937 -0.743 1 1 353 . 8 1 1 A 63 63 ASN N N 63 116.310 119.986 -3.676 1 1 354 . 8 1 1 A 64 64 PRO C C 64 175.071 176.538 -1.467 1 1 355 . 8 1 1 A 64 64 PRO CA C 64 65.296 65.091 0.205 1 1 356 . 8 1 1 A 64 64 PRO CB C 64 30.428 31.669 -1.241 1 1 357 . 8 1 1 A 65 65 TYR H H 65 7.873 7.661 0.212 1 1 358 . 8 1 1 A 65 65 TYR C C 65 175.145 173.850 1.295 1 1 359 . 8 1 1 A 65 65 TYR CA C 65 56.125 57.086 -0.961 1 1 360 . 8 1 1 A 65 65 TYR CB C 65 39.189 39.044 0.145 1 1 361 . 8 1 1 A 65 65 TYR N N 65 112.894 116.554 -3.660 1 1 362 . 8 1 1 A 66 66 LEU H H 66 7.308 7.597 -0.289 1 1 369 . 8 1 1 A 66 66 LEU C C 66 173.866 173.973 -0.107 1 1 370 . 8 1 1 A 66 66 LEU CA C 66 53.431 53.817 -0.386 1 1 371 . 8 1 1 A 66 66 LEU CB C 66 44.958 43.665 1.293 1 1 375 . 8 1 1 A 66 66 LEU N N 66 120.270 118.961 1.309 1 1 376 . 8 1 1 A 67 67 GLY H H 67 8.855 8.145 0.710 1 1 377 . 8 1 1 A 67 67 GLY C C 67 170.698 171.470 -0.772 1 1 378 . 8 1 1 A 67 67 GLY CA C 67 44.008 44.258 -0.250 1 1 379 . 8 1 1 A 67 67 GLY N N 67 114.388 106.260 8.128 1 1 380 . 8 1 1 A 68 68 PHE H H 68 8.770 8.168 0.602 1 1 381 . 8 1 1 A 68 68 PHE C C 68 173.386 175.073 -1.687 1 1 382 . 8 1 1 A 68 68 PHE CA C 68 56.507 56.500 0.007 1 1 383 . 8 1 1 A 68 68 PHE CB C 68 42.428 41.630 0.798 1 1 384 . 8 1 1 A 68 68 PHE N N 68 117.510 118.790 -1.280 1 1 385 . 8 1 1 A 69 69 GLU H H 69 9.079 9.795 -0.716 1 1 386 . 8 1 1 A 69 69 GLU C C 69 174.556 174.504 0.052 1 1 387 . 8 1 1 A 69 69 GLU CA C 69 54.939 54.659 0.280 1 1 388 . 8 1 1 A 69 69 GLU CB C 69 33.963 33.352 0.611 1 1 390 . 8 1 1 A 69 69 GLU N N 69 120.562 119.788 0.774 1 1 391 . 8 1 1 A 70 70 MET H H 70 9.481 9.244 0.237 1 1 392 . 8 1 1 A 70 70 MET C C 70 174.595 175.563 -0.968 1 1 393 . 8 1 1 A 70 70 MET CA C 70 53.091 54.381 -1.290 1 1 394 . 8 1 1 A 70 70 MET CB C 70 36.159 35.239 0.920 1 1 397 . 8 1 1 A 70 70 MET N N 70 124.928 121.825 3.103 1 1 398 . 8 1 1 A 71 71 GLY H H 71 8.845 8.782 0.063 1 1 399 . 8 1 1 A 71 71 GLY C C 71 170.811 171.309 -0.498 1 1 400 . 8 1 1 A 71 71 GLY CA C 71 44.624 43.531 1.093 1 1 401 . 8 1 1 A 71 71 GLY N N 71 108.896 110.619 -1.723 1 1 402 . 8 1 1 A 72 72 TYR H H 72 8.925 8.721 0.204 1 1 403 . 8 1 1 A 72 72 TYR C C 72 173.278 173.258 0.020 1 1 404 . 8 1 1 A 72 72 TYR CA C 72 55.912 56.482 -0.570 1 1 405 . 8 1 1 A 72 72 TYR CB C 72 41.611 41.698 -0.087 1 1 406 . 8 1 1 A 72 72 TYR N N 72 123.253 122.986 0.267 1 1 407 . 8 1 1 A 73 73 ASP H H 73 8.665 8.702 -0.037 1 1 408 . 8 1 1 A 73 73 ASP C C 73 173.598 175.452 -1.854 1 1 409 . 8 1 1 A 73 73 ASP CA C 73 52.857 53.277 -0.420 1 1 410 . 8 1 1 A 73 73 ASP CB C 73 42.774 41.684 1.090 1 1 411 . 8 1 1 A 73 73 ASP N N 73 126.178 127.228 -1.050 1 1 412 . 8 1 1 A 74 74 TRP H H 74 9.080 8.786 0.294 1 1 413 . 8 1 1 A 74 74 TRP C C 74 174.868 175.514 -0.646 1 1 414 . 8 1 1 A 74 74 TRP CB C 74 30.083 32.495 -2.412 1 1 415 . 8 1 1 A 74 74 TRP N N 74 121.824 128.174 -6.350 1 1 416 . 8 1 1 A 78 78 MET C C 78 174.548 176.558 -2.010 1 1 417 . 8 1 1 A 78 78 MET CA C 78 54.388 55.912 -1.524 1 1 418 . 8 1 1 A 78 78 MET CB C 78 32.542 34.318 -1.776 1 1 419 . 8 1 1 A 79 79 ALA H H 79 8.105 7.628 0.477 1 1 420 . 8 1 1 A 79 79 ALA C C 79 176.629 176.835 -0.206 1 1 421 . 8 1 1 A 79 79 ALA CA C 79 51.210 53.426 -2.216 1 1 422 . 8 1 1 A 79 79 ALA CB C 79 19.106 20.816 -1.710 1 1 423 . 8 1 1 A 79 79 ALA N N 79 125.778 117.034 8.744 1 1 424 . 8 1 1 A 80 80 TYR H H 80 8.035 7.675 0.360 1 1 425 . 8 1 1 A 80 80 TYR C C 80 175.604 175.819 -0.215 1 1 426 . 8 1 1 A 80 80 TYR CA C 80 57.021 58.569 -1.548 1 1 427 . 8 1 1 A 80 80 TYR CB C 80 38.416 38.674 -0.258 1 1 428 . 8 1 1 A 80 80 TYR N N 80 120.045 118.449 1.596 1 1 429 . 8 1 1 A 81 81 LYS H H 81 8.295 8.754 -0.459 1 1 430 . 8 1 1 A 81 81 LYS C C 81 176.647 175.856 0.791 1 1 431 . 8 1 1 A 81 81 LYS CA C 81 56.285 56.669 -0.384 1 1 432 . 8 1 1 A 81 81 LYS CB C 81 31.571 33.599 -2.028 1 1 434 . 8 1 1 A 81 81 LYS N N 81 123.191 123.838 -0.647 1 1 435 . 8 1 1 A 82 82 GLY H H 82 8.117 8.243 -0.126 1 1 436 . 8 1 1 A 82 82 GLY C C 82 174.010 171.474 2.536 1 1 437 . 8 1 1 A 82 82 GLY CA C 82 44.982 45.758 -0.776 1 1 438 . 8 1 1 A 82 82 GLY N N 82 110.014 110.344 -0.330 1 1 439 . 8 1 1 A 83 83 SER H H 83 7.938 8.636 -0.698 1 1 440 . 8 1 1 A 83 83 SER C C 83 174.634 173.123 1.511 1 1 441 . 8 1 1 A 83 83 SER CA C 83 57.685 56.776 0.909 1 1 442 . 8 1 1 A 83 83 SER CB C 83 63.303 64.448 -1.145 1 1 443 . 8 1 1 A 83 83 SER N N 83 115.655 115.485 0.170 1 1 444 . 8 1 1 A 84 84 VAL H H 84 8.008 8.690 -0.682 1 1 451 . 8 1 1 A 84 84 VAL C C 84 175.525 175.236 0.289 1 1 452 . 8 1 1 A 84 84 VAL CA C 84 61.769 60.576 1.193 1 1 453 . 8 1 1 A 84 84 VAL CB C 84 31.711 33.286 -1.575 1 1 456 . 8 1 1 A 84 84 VAL N N 84 120.054 124.496 -4.442 1 1 457 . 8 1 1 A 85 85 ASP H H 85 8.140 8.955 -0.815 1 1 458 . 8 1 1 A 85 85 ASP C C 85 174.740 176.838 -2.098 1 1 459 . 8 1 1 A 85 85 ASP CA C 85 53.983 54.837 -0.854 1 1 460 . 8 1 1 A 85 85 ASP CB C 85 40.633 42.606 -1.973 1 1 461 . 8 1 1 A 85 85 ASP N N 85 122.510 124.346 -1.836 1 1 462 . 8 1 1 A 86 86 ASN H H 86 7.736 8.100 -0.364 1 1 463 . 8 1 1 A 86 86 ASN C C 86 175.970 175.283 0.687 1 1 464 . 8 1 1 A 86 86 ASN CA C 86 54.349 54.707 -0.358 1 1 465 . 8 1 1 A 86 86 ASN CB C 86 40.490 39.880 0.610 1 1 467 . 8 1 1 A 86 86 ASN N N 86 124.290 117.166 7.124 1 1 468 . 8 1 1 A 87 87 GLY H H 87 8.000 7.443 0.557 1 1 469 . 8 1 1 A 87 87 GLY C C 87 173.456 174.168 -0.712 1 1 470 . 8 1 1 A 87 87 GLY CA C 87 44.973 45.653 -0.680 1 1 471 . 8 1 1 A 87 87 GLY N N 87 113.494 104.569 8.925 1 1 472 . 8 1 1 A 88 88 ALA H H 88 8.024 8.838 -0.814 1 1 473 . 8 1 1 A 88 88 ALA C C 88 176.833 177.667 -0.834 1 1 474 . 8 1 1 A 88 88 ALA CA C 88 51.734 53.374 -1.640 1 1 475 . 8 1 1 A 88 88 ALA CB C 88 19.818 20.860 -1.042 1 1 476 . 8 1 1 A 88 88 ALA N N 88 122.676 126.091 -3.415 1 1 477 . 8 1 1 A 91 91 ALA C C 91 174.781 175.706 -0.925 1 1 478 . 8 1 1 A 91 91 ALA CA C 91 50.537 51.313 -0.776 1 1 479 . 8 1 1 A 91 91 ALA CB C 91 21.324 24.048 -2.724 1 1 480 . 8 1 1 A 92 92 GLN H H 92 8.451 8.508 -0.057 1 1 481 . 8 1 1 A 92 92 GLN C C 92 173.557 174.134 -0.577 1 1 482 . 8 1 1 A 92 92 GLN CA C 92 53.380 54.415 -1.035 1 1 484 . 8 1 1 A 92 92 GLN N N 92 116.847 115.767 1.080 1 1 485 . 8 1 1 A 93 93 GLY C C 93 170.631 171.910 -1.279 1 1 486 . 8 1 1 A 93 93 GLY CA C 93 45.718 44.292 1.426 1 1 487 . 8 1 1 A 94 94 VAL H H 94 8.686 8.821 -0.135 1 1 494 . 8 1 1 A 94 94 VAL C C 94 173.698 174.189 -0.491 1 1 495 . 8 1 1 A 94 94 VAL CA C 94 58.997 59.841 -0.844 1 1 496 . 8 1 1 A 94 94 VAL CB C 94 33.311 34.008 -0.697 1 1 499 . 8 1 1 A 94 94 VAL N N 94 118.489 119.874 -1.385 1 1 500 . 8 1 1 A 95 95 GLN H H 95 9.468 9.287 0.181 1 1 501 . 8 1 1 A 95 95 GLN C C 95 174.028 174.729 -0.701 1 1 502 . 8 1 1 A 95 95 GLN CA C 95 52.547 54.295 -1.748 1 1 503 . 8 1 1 A 95 95 GLN CB C 95 33.816 31.861 1.955 1 1 505 . 8 1 1 A 95 95 GLN N N 95 122.106 125.660 -3.554 1 1 506 . 8 1 1 A 96 96 LEU H H 96 8.484 8.824 -0.340 1 1 513 . 8 1 1 A 96 96 LEU C C 96 175.322 174.894 0.428 1 1 514 . 8 1 1 A 96 96 LEU CA C 96 53.736 54.212 -0.476 1 1 515 . 8 1 1 A 96 96 LEU CB C 96 41.088 45.481 -4.393 1 1 519 . 8 1 1 A 96 96 LEU N N 96 123.224 124.488 -1.264 1 1 520 . 8 1 1 A 97 97 THR H H 97 9.116 8.885 0.231 1 1 521 . 8 1 1 A 97 97 THR C C 97 173.251 172.527 0.724 1 1 522 . 8 1 1 A 97 97 THR CA C 97 58.931 60.871 -1.940 1 1 523 . 8 1 1 A 97 97 THR CB C 97 72.984 70.502 2.482 1 1 525 . 8 1 1 A 97 97 THR N N 97 112.504 118.580 -6.076 1 1 526 . 8 1 1 A 98 98 ALA H H 98 8.603 8.969 -0.366 1 1 527 . 8 1 1 A 98 98 ALA C C 98 174.948 176.563 -1.615 1 1 528 . 8 1 1 A 98 98 ALA CA C 98 49.980 49.975 0.005 1 1 529 . 8 1 1 A 98 98 ALA CB C 98 19.157 21.089 -1.932 1 1 530 . 8 1 1 A 98 98 ALA N N 98 121.608 126.480 -4.872 1 1 531 . 8 1 1 A 99 99 LYS H H 99 8.890 8.923 -0.033 1 1 532 . 8 1 1 A 99 99 LYS C C 99 174.294 175.540 -1.246 1 1 533 . 8 1 1 A 99 99 LYS CA C 99 54.019 55.004 -0.985 1 1 534 . 8 1 1 A 99 99 LYS CB C 99 33.018 34.494 -1.476 1 1 538 . 8 1 1 A 99 99 LYS N N 99 124.522 121.215 3.307 1 1 539 . 8 1 1 A 100 100 LEU H H 100 8.985 8.727 0.258 1 1 546 . 8 1 1 A 100 100 LEU C C 100 175.265 175.441 -0.176 1 1 547 . 8 1 1 A 100 100 LEU CA C 100 52.698 53.024 -0.326 1 1 548 . 8 1 1 A 100 100 LEU CB C 100 42.889 44.490 -1.601 1 1 552 . 8 1 1 A 100 100 LEU N N 100 131.876 121.744 10.132 1 1 553 . 8 1 1 A 101 101 GLY H H 101 9.137 8.102 1.035 1 1 554 . 8 1 1 A 101 101 GLY C C 101 170.798 171.539 -0.741 1 1 555 . 8 1 1 A 101 101 GLY CA C 101 44.429 45.996 -1.567 1 1 556 . 8 1 1 A 101 101 GLY N N 101 111.928 107.732 4.196 1 1 557 . 8 1 1 A 102 102 TYR H H 102 8.779 8.588 0.191 1 1 558 . 8 1 1 A 102 102 TYR C C 102 173.402 173.035 0.367 1 1 559 . 8 1 1 A 102 102 TYR CA C 102 54.444 56.030 -1.586 1 1 560 . 8 1 1 A 102 102 TYR CB C 102 42.239 39.390 2.849 1 1 561 . 8 1 1 A 102 102 TYR N N 102 116.664 116.513 0.151 1 1 562 . 8 1 1 A 103 103 PRO C C 103 175.676 176.713 -1.037 1 1 563 . 8 1 1 A 103 103 PRO CA C 103 61.462 62.529 -1.067 1 1 564 . 8 1 1 A 103 103 PRO CB C 103 30.073 33.515 -3.442 1 1 565 . 8 1 1 A 104 104 ILE H H 104 8.670 9.296 -0.626 1 1 569 . 8 1 1 A 104 104 ILE C C 104 176.646 177.051 -0.405 1 1 570 . 8 1 1 A 104 104 ILE CA C 104 62.054 62.597 -0.543 1 1 571 . 8 1 1 A 104 104 ILE CB C 104 37.678 39.171 -1.493 1 1 574 . 8 1 1 A 104 104 ILE N N 104 125.939 120.164 5.775 1 1 575 . 8 1 1 A 105 105 THR H H 105 8.129 7.937 0.192 1 1 576 . 8 1 1 A 105 105 THR C C 105 174.344 173.905 0.439 1 1 577 . 8 1 1 A 105 105 THR CA C 105 59.176 62.428 -3.252 1 1 578 . 8 1 1 A 105 105 THR CB C 105 71.049 70.214 0.835 1 1 580 . 8 1 1 A 105 105 THR N N 105 109.853 110.414 -0.561 1 1 581 . 8 1 1 A 106 106 ASP H H 106 8.424 7.731 0.693 1 1 582 . 8 1 1 A 106 106 ASP C C 106 175.692 175.839 -0.147 1 1 583 . 8 1 1 A 106 106 ASP CA C 106 56.465 53.641 2.824 1 1 584 . 8 1 1 A 106 106 ASP CB C 106 40.032 41.172 -1.140 1 1 585 . 8 1 1 A 106 106 ASP N N 106 117.156 119.779 -2.623 1 1 586 . 8 1 1 A 107 107 ASP H H 107 8.124 8.137 -0.013 1 1 587 . 8 1 1 A 107 107 ASP C C 107 174.174 175.025 -0.851 1 1 588 . 8 1 1 A 107 107 ASP CA C 107 52.907 54.804 -1.897 1 1 589 . 8 1 1 A 107 107 ASP CB C 107 41.661 43.619 -1.958 1 1 590 . 8 1 1 A 107 107 ASP N N 107 113.591 119.547 -5.956 1 1 591 . 8 1 1 A 108 108 LEU H H 108 7.336 8.229 -0.893 1 1 598 . 8 1 1 A 108 108 LEU C C 108 174.321 174.827 -0.506 1 1 599 . 8 1 1 A 108 108 LEU CA C 108 54.449 53.812 0.637 1 1 600 . 8 1 1 A 108 108 LEU CB C 108 44.754 43.459 1.295 1 1 604 . 8 1 1 A 108 108 LEU N N 108 123.244 120.275 2.969 1 1 605 . 8 1 1 A 109 109 ASP H H 109 8.943 8.906 0.037 1 1 606 . 8 1 1 A 109 109 ASP C C 109 176.248 173.540 2.708 1 1 607 . 8 1 1 A 109 109 ASP CA C 109 52.376 52.900 -0.524 1 1 608 . 8 1 1 A 109 109 ASP CB C 109 42.764 44.695 -1.931 1 1 609 . 8 1 1 A 109 109 ASP N N 109 124.634 125.291 -0.657 1 1 610 . 8 1 1 A 110 110 ILE H H 110 8.372 8.895 -0.523 1 1 614 . 8 1 1 A 110 110 ILE C C 110 173.735 173.726 0.009 1 1 615 . 8 1 1 A 110 110 ILE CA C 110 59.129 58.912 0.217 1 1 616 . 8 1 1 A 110 110 ILE CB C 110 39.402 40.987 -1.585 1 1 620 . 8 1 1 A 110 110 ILE N N 110 119.135 122.231 -3.096 1 1 621 . 8 1 1 A 111 111 TYR H H 111 8.695 8.430 0.265 1 1 622 . 8 1 1 A 111 111 TYR C C 111 172.838 172.861 -0.023 1 1 623 . 8 1 1 A 111 111 TYR CA C 111 56.182 55.675 0.507 1 1 624 . 8 1 1 A 111 111 TYR CB C 111 41.489 41.947 -0.458 1 1 625 . 8 1 1 A 111 111 TYR N N 111 121.248 124.310 -3.062 1 1 626 . 8 1 1 A 112 112 THR H H 112 9.172 8.901 0.271 1 1 627 . 8 1 1 A 112 112 THR C C 112 173.850 173.163 0.687 1 1 628 . 8 1 1 A 112 112 THR CA C 112 58.246 60.145 -1.899 1 1 629 . 8 1 1 A 112 112 THR CB C 112 71.676 71.884 -0.208 1 1 631 . 8 1 1 A 112 112 THR N N 112 110.671 111.941 -1.270 1 1 632 . 8 1 1 A 113 113 ARG H H 113 8.732 9.361 -0.629 1 1 633 . 8 1 1 A 113 113 ARG C C 113 175.037 174.756 0.281 1 1 634 . 8 1 1 A 113 113 ARG CA C 113 53.995 54.873 -0.878 1 1 635 . 8 1 1 A 113 113 ARG CB C 113 32.266 32.739 -0.473 1 1 638 . 8 1 1 A 113 113 ARG N N 113 120.642 122.732 -2.090 1 1 639 . 8 1 1 A 114 114 LEU H H 114 8.449 9.075 -0.626 1 1 646 . 8 1 1 A 114 114 LEU C C 114 175.812 175.651 0.161 1 1 647 . 8 1 1 A 114 114 LEU CA C 114 53.335 53.634 -0.299 1 1 648 . 8 1 1 A 114 114 LEU CB C 114 45.182 45.054 0.128 1 1 652 . 8 1 1 A 114 114 LEU N N 114 119.078 125.168 -6.090 1 1 653 . 8 1 1 A 115 115 GLY H H 115 8.232 8.605 -0.373 1 1 654 . 8 1 1 A 115 115 GLY C C 115 171.343 172.322 -0.979 1 1 655 . 8 1 1 A 115 115 GLY CA C 115 46.217 46.120 0.097 1 1 656 . 8 1 1 A 115 115 GLY N N 115 108.966 112.473 -3.507 1 1 657 . 8 1 1 A 116 116 GLY H H 116 8.293 8.451 -0.158 1 1 658 . 8 1 1 A 116 116 GLY C C 116 169.856 171.980 -2.124 1 1 659 . 8 1 1 A 116 116 GLY CA C 116 44.084 45.636 -1.552 1 1 660 . 8 1 1 A 116 116 GLY N N 116 109.676 110.892 -1.216 1 1 661 . 8 1 1 A 117 117 MET H H 117 9.286 9.029 0.257 1 1 662 . 8 1 1 A 117 117 MET C C 117 174.557 174.423 0.134 1 1 663 . 8 1 1 A 117 117 MET CA C 117 53.258 54.282 -1.024 1 1 664 . 8 1 1 A 117 117 MET CB C 117 37.195 36.018 1.177 1 1 667 . 8 1 1 A 117 117 MET N N 117 120.425 119.243 1.182 1 1 668 . 8 1 1 A 118 118 VAL H H 118 9.062 8.672 0.390 1 1 675 . 8 1 1 A 118 118 VAL C C 118 173.993 174.423 -0.430 1 1 676 . 8 1 1 A 118 118 VAL CA C 118 59.883 60.817 -0.934 1 1 677 . 8 1 1 A 118 118 VAL CB C 118 31.782 34.734 -2.952 1 1 680 . 8 1 1 A 118 118 VAL N N 118 126.948 124.131 2.817 1 1 681 . 8 1 1 A 119 119 TRP H H 119 8.482 9.468 -0.986 1 1 682 . 8 1 1 A 119 119 TRP C C 119 174.608 175.133 -0.525 1 1 683 . 8 1 1 A 119 119 TRP CA C 119 53.332 55.349 -2.017 1 1 684 . 8 1 1 A 119 119 TRP CB C 119 33.569 33.736 -0.167 1 1 685 . 8 1 1 A 119 119 TRP N N 119 124.631 128.942 -4.311 1 1 686 . 8 1 1 A 120 120 ARG H H 120 9.113 9.097 0.016 1 1 687 . 8 1 1 A 120 120 ARG C C 120 174.951 175.044 -0.093 1 1 688 . 8 1 1 A 120 120 ARG CA C 120 54.684 54.571 0.113 1 1 689 . 8 1 1 A 120 120 ARG CB C 120 33.424 34.559 -1.135 1 1 690 . 8 1 1 A 120 120 ARG N N 120 117.899 126.143 -8.244 1 1 691 . 8 1 1 A 121 121 ALA H H 121 9.299 8.386 0.913 1 1 692 . 8 1 1 A 121 121 ALA C C 121 175.954 174.831 1.123 1 1 693 . 8 1 1 A 121 121 ALA CA C 121 50.368 50.390 -0.022 1 1 694 . 8 1 1 A 121 121 ALA CB C 121 21.141 24.362 -3.221 1 1 695 . 8 1 1 A 121 121 ALA N N 121 128.863 122.689 6.174 1 1 696 . 8 1 1 A 122 122 ASP H H 122 8.488 8.093 0.395 1 1 697 . 8 1 1 A 122 122 ASP C C 122 175.635 173.828 1.807 1 1 698 . 8 1 1 A 122 122 ASP CA C 122 53.891 53.165 0.726 1 1 699 . 8 1 1 A 122 122 ASP CB C 122 42.492 44.281 -1.789 1 1 700 . 8 1 1 A 122 122 ASP N N 122 121.721 119.731 1.990 1 1 701 . 8 1 1 A 123 123 SER H H 123 8.466 8.787 -0.321 1 1 702 . 8 1 1 A 123 123 SER C C 123 174.325 173.198 1.127 1 1 703 . 8 1 1 A 123 123 SER CA C 123 57.325 56.851 0.474 1 1 704 . 8 1 1 A 123 123 SER CB C 123 63.988 63.150 0.838 1 1 705 . 8 1 1 A 123 123 SER N N 123 117.374 121.384 -4.010 1 1 706 . 8 1 1 A 124 124 LYS H H 124 8.389 7.751 0.638 1 1 707 . 8 1 1 A 124 124 LYS C C 124 176.840 175.358 1.482 1 1 708 . 8 1 1 A 124 124 LYS CA C 124 56.036 55.305 0.731 1 1 709 . 8 1 1 A 124 124 LYS CB C 124 32.397 32.236 0.161 1 1 711 . 8 1 1 A 124 124 LYS N N 124 122.883 125.087 -2.204 1 1 712 . 8 1 1 A 125 125 GLY H H 125 8.281 8.434 -0.153 1 1 713 . 8 1 1 A 125 125 GLY C C 125 173.592 173.364 0.228 1 1 714 . 8 1 1 A 125 125 GLY CA C 125 44.924 44.940 -0.016 1 1 715 . 8 1 1 A 125 125 GLY N N 125 109.541 112.279 -2.738 1 1 716 . 8 1 1 A 126 126 ASN H H 126 8.185 8.737 -0.552 1 1 717 . 8 1 1 A 126 126 ASN C C 126 176.649 173.605 3.044 1 1 718 . 8 1 1 A 126 126 ASN CA C 126 52.763 51.861 0.902 1 1 719 . 8 1 1 A 126 126 ASN CB C 126 38.439 39.495 -1.056 1 1 720 . 8 1 1 A 126 126 ASN N N 126 119.019 116.173 2.846 1 1 721 . 8 1 1 A 127 127 TYR C C 127 176.913 174.279 2.634 1 1 722 . 8 1 1 A 127 127 TYR CA C 127 57.757 58.026 -0.269 1 1 723 . 8 1 1 A 127 127 TYR CB C 127 37.703 38.938 -1.235 1 1 724 . 8 1 1 A 128 128 ALA H H 128 8.050 8.549 -0.499 1 1 728 . 8 1 1 A 128 128 ALA C C 128 177.756 176.692 1.064 1 1 729 . 8 1 1 A 128 128 ALA CA C 128 52.321 51.978 0.343 1 1 730 . 8 1 1 A 128 128 ALA CB C 128 18.273 20.337 -2.064 1 1 731 . 8 1 1 A 128 128 ALA N N 128 124.529 128.797 -4.268 1 1 732 . 8 1 1 A 129 129 SER H H 129 8.063 8.891 -0.828 1 1 733 . 8 1 1 A 129 129 SER C C 129 174.938 175.484 -0.546 1 1 734 . 8 1 1 A 129 129 SER CA C 129 58.202 60.149 -1.947 1 1 735 . 8 1 1 A 129 129 SER CB C 129 62.974 64.888 -1.914 1 1 736 . 8 1 1 A 129 129 SER N N 129 114.374 114.039 0.335 1 1 737 . 8 1 1 A 130 130 THR H H 130 7.875 8.103 -0.228 1 1 741 . 8 1 1 A 130 130 THR C C 130 175.198 175.193 0.005 1 1 742 . 8 1 1 A 130 130 THR CA C 130 61.520 62.370 -0.850 1 1 743 . 8 1 1 A 130 130 THR CB C 130 69.312 69.962 -0.650 1 1 745 . 8 1 1 A 130 130 THR N N 130 113.608 109.725 3.883 1 1 746 . 8 1 1 A 131 131 GLY H H 131 8.219 7.448 0.771 1 1 747 . 8 1 1 A 131 131 GLY C C 131 173.979 173.690 0.289 1 1 748 . 8 1 1 A 131 131 GLY CA C 131 44.991 45.803 -0.812 1 1 749 . 8 1 1 A 131 131 GLY N N 131 110.848 107.569 3.279 1 1 750 . 8 1 1 A 132 132 VAL H H 132 7.729 7.750 -0.021 1 1 757 . 8 1 1 A 132 132 VAL C C 132 175.988 174.467 1.521 1 1 758 . 8 1 1 A 132 132 VAL CA C 132 61.643 59.456 2.187 1 1 759 . 8 1 1 A 132 132 VAL CB C 132 31.941 34.835 -2.894 1 1 762 . 8 1 1 A 132 132 VAL N N 132 118.932 116.753 2.179 1 1 763 . 8 1 1 A 133 133 SER H H 133 8.224 8.991 -0.767 1 1 764 . 8 1 1 A 133 133 SER C C 133 174.320 173.676 0.644 1 1 765 . 8 1 1 A 133 133 SER CA C 133 57.756 57.313 0.443 1 1 766 . 8 1 1 A 133 133 SER CB C 133 63.140 64.129 -0.989 1 1 767 . 8 1 1 A 133 133 SER N N 133 119.260 121.826 -2.566 1 1 768 . 8 1 1 A 134 134 ARG H H 134 8.199 9.013 -0.814 1 1 769 . 8 1 1 A 134 134 ARG C C 134 175.923 174.106 1.817 1 1 770 . 8 1 1 A 134 134 ARG CA C 134 55.461 54.273 1.188 1 1 771 . 8 1 1 A 134 134 ARG CB C 134 30.195 33.434 -3.239 1 1 774 . 8 1 1 A 134 134 ARG N N 134 123.262 123.831 -0.569 1 1 775 . 8 1 1 A 135 135 SER H H 135 8.256 8.691 -0.435 1 1 776 . 8 1 1 A 135 135 SER C C 135 174.360 173.523 0.837 1 1 777 . 8 1 1 A 135 135 SER CA C 135 57.730 56.467 1.263 1 1 778 . 8 1 1 A 135 135 SER CB C 135 63.275 65.229 -1.954 1 1 779 . 8 1 1 A 135 135 SER N N 135 117.155 115.287 1.868 1 1 780 . 8 1 1 A 136 136 GLU H H 136 8.374 9.049 -0.675 1 1 781 . 8 1 1 A 136 136 GLU C C 136 176.284 174.471 1.813 1 1 782 . 8 1 1 A 136 136 GLU CA C 136 56.082 55.194 0.888 1 1 783 . 8 1 1 A 136 136 GLU CB C 136 29.820 32.345 -2.525 1 1 785 . 8 1 1 A 136 136 GLU N N 136 122.812 126.948 -4.136 1 1 786 . 8 1 1 A 137 137 HIS H H 137 8.118 8.900 -0.782 1 1 787 . 8 1 1 A 137 137 HIS C C 137 173.529 172.984 0.545 1 1 788 . 8 1 1 A 137 137 HIS CA C 137 54.793 54.153 0.640 1 1 789 . 8 1 1 A 137 137 HIS CB C 137 30.191 32.802 -2.611 1 1 790 . 8 1 1 A 137 137 HIS N N 137 118.002 124.590 -6.588 1 1 791 . 8 1 1 A 138 138 ASP H H 138 8.572 8.745 -0.173 1 1 792 . 8 1 1 A 138 138 ASP C C 138 174.940 175.085 -0.145 1 1 793 . 8 1 1 A 138 138 ASP CA C 138 53.594 53.278 0.316 1 1 794 . 8 1 1 A 138 138 ASP CB C 138 42.165 43.352 -1.187 1 1 795 . 8 1 1 A 138 138 ASP N N 138 121.536 125.746 -4.210 1 1 796 . 8 1 1 A 139 139 THR H H 139 7.857 8.929 -1.072 1 1 797 . 8 1 1 A 139 139 THR C C 139 172.822 173.402 -0.580 1 1 798 . 8 1 1 A 139 139 THR CA C 139 59.197 60.606 -1.409 1 1 799 . 8 1 1 A 139 139 THR CB C 139 71.457 71.534 -0.077 1 1 801 . 8 1 1 A 139 139 THR N N 139 113.598 114.551 -0.953 1 1 802 . 8 1 1 A 140 140 GLY C C 140 169.622 172.102 -2.480 1 1 803 . 8 1 1 A 140 140 GLY CA C 140 44.287 44.826 -0.539 1 1 804 . 8 1 1 A 141 141 VAL H H 141 7.815 9.091 -1.276 1 1 811 . 8 1 1 A 141 141 VAL C C 141 176.038 173.799 2.239 1 1 812 . 8 1 1 A 141 141 VAL CA C 141 59.739 60.006 -0.267 1 1 813 . 8 1 1 A 141 141 VAL CB C 141 33.308 35.098 -1.790 1 1 816 . 8 1 1 A 141 141 VAL N N 141 116.224 125.328 -9.104 1 1 817 . 8 1 1 A 142 142 SER H H 142 9.284 8.815 0.469 1 1 818 . 8 1 1 A 142 142 SER C C 142 171.050 172.182 -1.132 1 1 819 . 8 1 1 A 142 142 SER CB C 142 67.608 66.558 1.050 1 1 820 . 8 1 1 A 142 142 SER N N 142 123.223 122.187 1.036 1 1 821 . 8 1 1 A 143 143 PRO C C 143 174.032 176.268 -2.236 1 1 822 . 8 1 1 A 143 143 PRO CA C 143 62.350 62.587 -0.237 1 1 823 . 8 1 1 A 143 143 PRO CB C 143 31.774 32.579 -0.805 1 1 825 . 8 1 1 A 144 144 VAL H H 144 7.785 9.014 -1.229 1 1 832 . 8 1 1 A 144 144 VAL C C 144 172.826 174.439 -1.613 1 1 833 . 8 1 1 A 144 144 VAL CA C 144 59.770 59.930 -0.160 1 1 834 . 8 1 1 A 144 144 VAL CB C 144 34.407 36.034 -1.627 1 1 837 . 8 1 1 A 144 144 VAL N N 144 120.214 117.285 2.929 1 1 838 . 8 1 1 A 145 145 PHE H H 145 8.623 8.704 -0.081 1 1 839 . 8 1 1 A 145 145 PHE C C 145 173.658 172.813 0.845 1 1 840 . 8 1 1 A 145 145 PHE CA C 145 54.942 55.643 -0.701 1 1 841 . 8 1 1 A 145 145 PHE CB C 145 42.692 42.276 0.416 1 1 842 . 8 1 1 A 145 145 PHE N N 145 123.914 119.146 4.768 1 1 843 . 8 1 1 A 146 146 ALA H H 146 8.886 9.070 -0.184 1 1 844 . 8 1 1 A 146 146 ALA C C 146 176.258 175.969 0.289 1 1 845 . 8 1 1 A 146 146 ALA CA C 146 49.734 50.366 -0.632 1 1 846 . 8 1 1 A 146 146 ALA CB C 146 22.244 22.936 -0.692 1 1 847 . 8 1 1 A 146 146 ALA N N 146 125.243 123.608 1.635 1 1 848 . 8 1 1 A 147 147 GLY H H 147 8.470 8.186 0.284 1 1 849 . 8 1 1 A 147 147 GLY C C 147 170.940 172.160 -1.220 1 1 850 . 8 1 1 A 147 147 GLY CA C 147 44.063 44.456 -0.393 1 1 851 . 8 1 1 A 147 147 GLY N N 147 106.669 105.432 1.237 1 1 852 . 8 1 1 A 148 148 GLY H H 148 8.008 7.964 0.044 1 1 853 . 8 1 1 A 148 148 GLY C C 148 170.181 171.834 -1.653 1 1 854 . 8 1 1 A 148 148 GLY CA C 148 45.736 45.251 0.485 1 1 855 . 8 1 1 A 148 148 GLY N N 148 109.475 108.495 0.980 1 1 856 . 8 1 1 A 149 149 VAL H H 149 8.426 8.088 0.338 1 1 863 . 8 1 1 A 149 149 VAL C C 149 174.157 172.977 1.180 1 1 864 . 8 1 1 A 149 149 VAL CA C 149 58.200 58.467 -0.267 1 1 865 . 8 1 1 A 149 149 VAL CB C 149 34.464 35.633 -1.169 1 1 868 . 8 1 1 A 149 149 VAL N N 149 112.651 115.919 -3.268 1 1 869 . 8 1 1 A 150 150 GLU H H 150 9.070 8.626 0.444 1 1 870 . 8 1 1 A 150 150 GLU C C 150 173.892 174.201 -0.309 1 1 871 . 8 1 1 A 150 150 GLU CA C 150 54.617 54.595 0.022 1 1 872 . 8 1 1 A 150 150 GLU CB C 150 32.911 33.647 -0.736 1 1 874 . 8 1 1 A 150 150 GLU N N 150 124.471 119.967 4.504 1 1 875 . 8 1 1 A 151 151 TRP H H 151 9.461 9.401 0.060 1 1 877 . 8 1 1 A 151 151 TRP C C 151 174.370 175.460 -1.090 1 1 878 . 8 1 1 A 151 151 TRP CA C 151 54.113 55.834 -1.721 1 1 879 . 8 1 1 A 151 151 TRP CB C 151 31.688 31.894 -0.206 1 1 880 . 8 1 1 A 151 151 TRP N N 151 129.611 125.397 4.214 1 1 882 . 8 1 1 A 152 152 ALA H H 152 8.771 8.872 -0.101 1 1 883 . 8 1 1 A 152 152 ALA C C 152 175.079 176.795 -1.716 1 1 884 . 8 1 1 A 152 152 ALA CA C 152 51.417 51.950 -0.533 1 1 885 . 8 1 1 A 152 152 ALA CB C 152 17.209 19.051 -1.842 1 1 886 . 8 1 1 A 152 152 ALA N N 152 130.502 127.970 2.532 1 1 887 . 8 1 1 A 153 153 VAL H H 153 7.893 8.819 -0.926 1 1 894 . 8 1 1 A 153 153 VAL C C 153 176.612 176.040 0.572 1 1 895 . 8 1 1 A 153 153 VAL CA C 153 63.600 63.831 -0.231 1 1 896 . 8 1 1 A 153 153 VAL CB C 153 31.280 32.921 -1.641 1 1 899 . 8 1 1 A 153 153 VAL N N 153 124.360 123.505 0.855 1 1 900 . 8 1 1 A 154 154 THR H H 154 7.950 7.665 0.285 1 1 904 . 8 1 1 A 154 154 THR C C 154 173.884 175.482 -1.598 1 1 905 . 8 1 1 A 154 154 THR CA C 154 58.655 61.686 -3.031 1 1 906 . 8 1 1 A 154 154 THR CB C 154 71.262 69.752 1.510 1 1 908 . 8 1 1 A 154 154 THR N N 154 109.176 114.411 -5.235 1 1 909 . 8 1 1 A 155 155 ARG H H 155 8.310 8.683 -0.373 1 1 910 . 8 1 1 A 155 155 ARG C C 155 176.753 176.767 -0.014 1 1 911 . 8 1 1 A 155 155 ARG CA C 155 58.456 58.985 -0.529 1 1 912 . 8 1 1 A 155 155 ARG CB C 155 29.043 30.393 -1.350 1 1 915 . 8 1 1 A 155 155 ARG N N 155 116.576 123.816 -7.240 1 1 916 . 8 1 1 A 156 156 ASP H H 156 7.783 8.085 -0.302 1 1 917 . 8 1 1 A 156 156 ASP C C 156 174.222 175.518 -1.296 1 1 918 . 8 1 1 A 156 156 ASP CA C 156 53.540 53.094 0.446 1 1 919 . 8 1 1 A 156 156 ASP CB C 156 42.327 41.130 1.197 1 1 920 . 8 1 1 A 156 156 ASP N N 156 112.950 114.419 -1.469 1 1 921 . 8 1 1 A 157 157 ILE H H 157 7.233 7.664 -0.431 1 1 925 . 8 1 1 A 157 157 ILE C C 157 174.178 175.226 -1.048 1 1 926 . 8 1 1 A 157 157 ILE CA C 157 59.350 61.060 -1.710 1 1 927 . 8 1 1 A 157 157 ILE CB C 157 38.969 39.999 -1.030 1 1 930 . 8 1 1 A 157 157 ILE N N 157 119.732 120.018 -0.286 1 1 931 . 8 1 1 A 158 158 ALA H H 158 8.729 9.397 -0.668 1 1 932 . 8 1 1 A 158 158 ALA C C 158 176.567 175.380 1.187 1 1 933 . 8 1 1 A 158 158 ALA CA C 158 49.418 50.393 -0.975 1 1 934 . 8 1 1 A 158 158 ALA CB C 158 21.430 22.648 -1.218 1 1 935 . 8 1 1 A 158 158 ALA N N 158 128.564 130.298 -1.734 1 1 936 . 8 1 1 A 159 159 THR H H 159 8.972 9.050 -0.078 1 1 940 . 8 1 1 A 159 159 THR C C 159 172.213 173.117 -0.904 1 1 941 . 8 1 1 A 159 159 THR CA C 159 59.504 60.078 -0.574 1 1 942 . 8 1 1 A 159 159 THR CB C 159 70.728 72.096 -1.368 1 1 944 . 8 1 1 A 159 159 THR N N 159 114.901 113.311 1.590 1 1 945 . 8 1 1 A 160 160 ARG H H 160 8.924 9.376 -0.452 1 1 946 . 8 1 1 A 160 160 ARG C C 160 174.097 173.866 0.231 1 1 947 . 8 1 1 A 160 160 ARG CA C 160 53.066 54.143 -1.077 1 1 948 . 8 1 1 A 160 160 ARG CB C 160 32.922 33.804 -0.882 1 1 951 . 8 1 1 A 160 160 ARG N N 160 121.507 125.927 -4.420 1 1 952 . 8 1 1 A 161 161 LEU H H 161 8.611 8.575 0.036 1 1 959 . 8 1 1 A 161 161 LEU C C 161 174.389 174.927 -0.538 1 1 960 . 8 1 1 A 161 161 LEU CA C 161 53.355 53.341 0.014 1 1 961 . 8 1 1 A 161 161 LEU CB C 161 44.360 45.740 -1.380 1 1 964 . 8 1 1 A 161 161 LEU N N 161 124.711 122.955 1.756 1 1 965 . 8 1 1 A 162 162 GLU H H 162 8.746 8.748 -0.002 1 1 966 . 8 1 1 A 162 162 GLU C C 162 173.376 175.269 -1.893 1 1 967 . 8 1 1 A 162 162 GLU CA C 162 53.904 54.699 -0.795 1 1 968 . 8 1 1 A 162 162 GLU CB C 162 33.773 32.424 1.349 1 1 970 . 8 1 1 A 162 162 GLU N N 162 122.300 125.567 -3.267 1 1 971 . 8 1 1 A 163 163 TYR H H 163 8.872 8.898 -0.026 1 1 972 . 8 1 1 A 163 163 TYR C C 163 173.425 174.152 -0.727 1 1 973 . 8 1 1 A 163 163 TYR CA C 163 56.192 55.266 0.926 1 1 974 . 8 1 1 A 163 163 TYR CB C 163 40.870 42.226 -1.356 1 1 975 . 8 1 1 A 163 163 TYR N N 163 124.618 118.107 6.511 1 1 976 . 8 1 1 A 171 171 ASP C C 171 175.753 175.729 0.024 1 1 977 . 8 1 1 A 171 171 ASP CA C 171 53.517 55.021 -1.504 1 1 978 . 8 1 1 A 171 171 ASP CB C 171 41.353 43.277 -1.924 1 1 979 . 8 1 1 A 172 172 ALA H H 172 8.336 7.998 0.338 1 1 983 . 8 1 1 A 172 172 ALA C C 172 178.110 177.647 0.463 1 1 984 . 8 1 1 A 172 172 ALA CA C 172 52.190 50.572 1.618 1 1 985 . 8 1 1 A 172 172 ALA CB C 172 18.305 22.109 -3.804 1 1 986 . 8 1 1 A 172 172 ALA N N 172 125.294 121.367 3.927 1 1 987 . 8 1 1 A 173 173 GLY H H 173 8.300 8.512 -0.212 1 1 988 . 8 1 1 A 173 173 GLY C C 173 174.437 174.538 -0.101 1 1 989 . 8 1 1 A 173 173 GLY CA C 173 45.083 45.807 -0.724 1 1 990 . 8 1 1 A 173 173 GLY N N 173 107.268 111.847 -4.579 1 1 991 . 8 1 1 A 174 174 THR H H 174 7.754 7.944 -0.190 1 1 992 . 8 1 1 A 174 174 THR C C 174 174.738 173.418 1.320 1 1 993 . 8 1 1 A 174 174 THR CA C 174 61.310 61.367 -0.057 1 1 994 . 8 1 1 A 174 174 THR CB C 174 69.310 68.563 0.747 1 1 996 . 8 1 1 A 174 174 THR N N 174 113.472 113.157 0.315 1 1 997 . 8 1 1 A 175 175 VAL H H 175 7.993 7.356 0.637 1 1 1004 . 8 1 1 A 175 175 VAL C C 175 176.535 175.476 1.059 1 1 1005 . 8 1 1 A 175 175 VAL CA C 175 62.126 59.411 2.715 1 1 1006 . 8 1 1 A 175 175 VAL CB C 175 31.282 35.258 -3.976 1 1 1009 . 8 1 1 A 175 175 VAL N N 175 121.643 117.179 4.464 1 1 1010 . 8 1 1 A 176 176 GLY H H 176 8.056 8.490 -0.434 1 1 1011 . 8 1 1 A 176 176 GLY C C 176 173.930 172.459 1.471 1 1 1012 . 8 1 1 A 176 176 GLY CA C 176 44.983 44.397 0.586 1 1 1013 . 8 1 1 A 176 176 GLY N N 176 110.460 109.426 1.034 1 1 1014 . 8 1 1 A 177 177 THR H H 177 7.520 8.338 -0.818 1 1 1015 . 8 1 1 A 177 177 THR C C 177 173.574 173.460 0.114 1 1 1016 . 8 1 1 A 177 177 THR CA C 177 60.609 59.954 0.655 1 1 1017 . 8 1 1 A 177 177 THR CB C 177 69.506 71.269 -1.763 1 1 1019 . 8 1 1 A 177 177 THR N N 177 113.390 114.957 -1.567 1 1 1020 . 8 1 1 A 178 178 ARG H H 178 8.261 8.751 -0.490 1 1 1021 . 8 1 1 A 178 178 ARG C C 178 173.932 174.346 -0.414 1 1 1022 . 8 1 1 A 178 178 ARG CA C 178 53.683 54.232 -0.549 1 1 1023 . 8 1 1 A 178 178 ARG CB C 178 29.224 29.637 -0.413 1 1 1026 . 8 1 1 A 178 178 ARG N N 178 123.906 127.545 -3.639 1 1 1027 . 8 1 1 A 183 183 MET C C 183 174.053 174.096 -0.043 1 1 1028 . 8 1 1 A 183 183 MET CA C 183 53.700 54.672 -0.972 1 1 1029 . 8 1 1 A 183 183 MET CB C 183 35.908 36.409 -0.501 1 1 1032 . 8 1 1 A 184 184 LEU H H 184 8.319 8.841 -0.522 1 1 1033 . 8 1 1 A 184 184 LEU C C 184 175.235 175.137 0.098 1 1 1034 . 8 1 1 A 184 184 LEU CA C 184 53.120 53.473 -0.353 1 1 1035 . 8 1 1 A 184 184 LEU CB C 184 42.857 46.209 -3.352 1 1 1038 . 8 1 1 A 184 184 LEU N N 184 131.293 126.406 4.887 1 1 1039 . 8 1 1 A 185 185 SER H H 185 9.603 8.647 0.956 1 1 1040 . 8 1 1 A 185 185 SER C C 185 171.293 172.907 -1.614 1 1 1041 . 8 1 1 A 185 185 SER CA C 185 56.504 57.303 -0.799 1 1 1042 . 8 1 1 A 185 185 SER CB C 185 66.585 67.113 -0.528 1 1 1043 . 8 1 1 A 185 185 SER N N 185 119.338 116.392 2.946 1 1 1044 . 8 1 1 A 186 186 LEU H H 186 8.583 8.383 0.200 1 1 1051 . 8 1 1 A 186 186 LEU C C 186 175.328 176.355 -1.027 1 1 1052 . 8 1 1 A 186 186 LEU CA C 186 52.729 53.045 -0.316 1 1 1053 . 8 1 1 A 186 186 LEU CB C 186 44.996 44.674 0.322 1 1 1056 . 8 1 1 A 186 186 LEU N N 186 122.719 123.501 -0.782 1 1 1057 . 8 1 1 A 187 187 GLY H H 187 9.287 8.513 0.774 1 1 1058 . 8 1 1 A 187 187 GLY C C 187 172.315 173.573 -1.258 1 1 1059 . 8 1 1 A 187 187 GLY CA C 187 43.502 44.978 -1.476 1 1 1060 . 8 1 1 A 187 187 GLY N N 187 110.265 110.615 -0.350 1 1 1061 . 8 1 1 A 188 188 VAL H H 188 8.825 8.640 0.185 1 1 1068 . 8 1 1 A 188 188 VAL C C 188 173.125 174.520 -1.395 1 1 1069 . 8 1 1 A 188 188 VAL CA C 188 59.739 59.253 0.486 1 1 1070 . 8 1 1 A 188 188 VAL CB C 188 34.532 34.996 -0.464 1 1 1073 . 8 1 1 A 188 188 VAL N N 188 119.161 116.734 2.427 1 1 1074 . 8 1 1 A 189 189 SER H H 189 9.051 8.652 0.399 1 1 1075 . 8 1 1 A 189 189 SER C C 189 171.698 172.785 -1.087 1 1 1076 . 8 1 1 A 189 189 SER CA C 189 55.997 57.575 -1.578 1 1 1077 . 8 1 1 A 189 189 SER CB C 189 66.094 67.743 -1.649 1 1 1078 . 8 1 1 A 189 189 SER N N 189 117.810 119.269 -1.459 1 1 1079 . 8 1 1 A 190 190 TYR H H 190 9.145 8.955 0.190 1 1 1080 . 8 1 1 A 190 190 TYR C C 190 174.063 172.564 1.499 1 1 1081 . 8 1 1 A 190 190 TYR CA C 190 55.375 55.764 -0.389 1 1 1082 . 8 1 1 A 190 190 TYR CB C 190 41.183 41.632 -0.449 1 1 1083 . 8 1 1 A 190 190 TYR N N 190 123.690 118.833 4.857 1 1 1084 . 8 1 1 A 191 191 ARG H H 191 8.211 8.722 -0.511 1 1 1085 . 8 1 1 A 191 191 ARG C C 191 174.826 175.001 -0.175 1 1 1086 . 8 1 1 A 191 191 ARG CA C 191 54.464 54.427 0.037 1 1 1087 . 8 1 1 A 191 191 ARG CB C 191 30.507 32.750 -2.243 1 1 1090 . 8 1 1 A 191 191 ARG N N 191 125.366 119.137 6.229 1 1 1091 . 8 1 1 A 192 192 PHE H H 192 8.496 9.041 -0.545 1 1 1092 . 8 1 1 A 192 192 PHE C C 192 176.384 175.411 0.973 1 1 1093 . 8 1 1 A 192 192 PHE CA C 192 57.179 58.952 -1.773 1 1 1094 . 8 1 1 A 192 192 PHE CB C 192 39.430 39.355 0.075 1 1 1095 . 8 1 1 A 192 192 PHE N N 192 121.586 122.684 -1.098 1 1 1096 . 8 1 1 A 193 193 GLY H H 193 8.643 8.855 -0.212 1 1 1097 . 8 1 1 A 193 193 GLY C C 193 174.466 172.502 1.964 1 1 1098 . 8 1 1 A 193 193 GLY CA C 193 45.126 45.196 -0.070 1 1 1099 . 8 1 1 A 193 193 GLY N N 193 109.499 113.012 -3.513 1 1 1100 . 8 1 1 A 194 194 GLN H H 194 8.512 8.528 -0.016 1 1 1101 . 8 1 1 A 194 194 GLN C C 194 176.201 175.043 1.158 1 1 1102 . 8 1 1 A 194 194 GLN CA C 194 55.433 55.760 -0.327 1 1 1103 . 8 1 1 A 194 194 GLN CB C 194 28.729 27.748 0.981 1 1 1105 . 8 1 1 A 194 194 GLN N N 194 119.448 120.709 -1.261 1 1 1106 . 8 1 1 A 195 195 GLU H H 195 8.530 8.494 0.036 1 1 1107 . 8 1 1 A 195 195 GLU C C 195 176.151 177.144 -0.993 1 1 1108 . 8 1 1 A 195 195 GLU CA C 195 56.256 54.839 1.417 1 1 1109 . 8 1 1 A 195 195 GLU CB C 195 29.486 31.985 -2.499 1 1 1111 . 8 1 1 A 195 195 GLU N N 195 121.959 125.491 -3.532 1 1 1112 . 8 1 1 A 196 196 ASP H H 196 8.253 8.663 -0.410 1 1 1113 . 8 1 1 A 196 196 ASP C C 196 175.667 176.249 -0.582 1 1 1114 . 8 1 1 A 196 196 ASP CA C 196 53.981 56.409 -2.428 1 1 1115 . 8 1 1 A 196 196 ASP CB C 196 40.700 41.247 -0.547 1 1 1116 . 8 1 1 A 196 196 ASP N N 196 121.819 121.422 0.397 1 1 1117 . 8 1 1 A 197 197 ALA H H 197 7.999 7.903 0.096 1 1 1121 . 8 1 1 A 197 197 ALA C C 197 176.847 176.709 0.138 1 1 1122 . 8 1 1 A 197 197 ALA CA C 197 51.612 51.314 0.298 1 1 1123 . 8 1 1 A 197 197 ALA CB C 197 18.192 21.741 -3.549 1 1 1124 . 8 1 1 A 197 197 ALA N N 197 124.262 119.455 4.807 1 1 1125 . 8 1 1 A 198 198 ALA H H 198 8.042 8.560 -0.518 1 1 1126 . 8 1 1 A 198 198 ALA C C 198 176.865 175.709 1.156 1 1 1127 . 8 1 1 A 198 198 ALA CA C 198 49.999 49.608 0.391 1 1 1128 . 8 1 1 A 198 198 ALA CB C 198 17.327 18.866 -1.539 1 1 1129 . 8 1 1 A 198 198 ALA N N 198 124.724 121.451 3.273 1 1 1130 . 8 1 1 A 199 199 PRO C C 199 176.727 176.346 0.381 1 1 1131 . 8 1 1 A 199 199 PRO CA C 199 62.399 63.702 -1.303 1 1 1132 . 8 1 1 A 199 199 PRO CB C 199 30.949 32.566 -1.617 1 1 1135 . 8 1 1 A 200 200 VAL H H 200 8.026 7.754 0.272 1 1 1142 . 8 1 1 A 200 200 VAL C C 200 176.034 174.149 1.885 1 1 1143 . 8 1 1 A 200 200 VAL CA C 200 61.944 61.457 0.487 1 1 1144 . 8 1 1 A 200 200 VAL CB C 200 31.734 29.887 1.847 1 1 1147 . 8 1 1 A 200 200 VAL N N 200 120.635 119.827 0.808 1 1 1148 . 8 1 1 A 201 201 VAL H H 201 7.966 8.167 -0.201 1 1 1155 . 8 1 1 A 201 201 VAL C C 201 175.128 175.056 0.072 1 1 1156 . 8 1 1 A 201 201 VAL CA C 201 61.249 60.492 0.757 1 1 1157 . 8 1 1 A 201 201 VAL CB C 201 31.917 33.373 -1.456 1 1 1160 . 8 1 1 A 201 201 VAL N N 201 124.053 121.249 2.804 1 1 1161 . 8 1 1 A 202 202 ALA H H 202 8.159 8.468 -0.309 1 1 1162 . 8 1 1 A 202 202 ALA C C 202 175.153 177.196 -2.043 1 1 1163 . 8 1 1 A 202 202 ALA CA C 202 49.742 50.228 -0.486 1 1 1164 . 8 1 1 A 202 202 ALA CB C 202 17.532 19.601 -2.069 1 1 1165 . 8 1 1 A 202 202 ALA N N 202 129.251 128.132 1.119 1 1 1166 . 8 1 1 A 203 203 PRO C C 203 176.273 176.159 0.114 1 1 1167 . 8 1 1 A 203 203 PRO CA C 203 62.324 62.536 -0.212 1 1 1168 . 8 1 1 A 203 203 PRO CB C 203 31.042 29.077 1.965 1 1 1170 . 8 1 1 A 204 204 ALA H H 204 8.137 8.829 -0.692 1 1 1171 . 8 1 1 A 204 204 ALA C C 204 175.697 177.840 -2.143 1 1 1172 . 8 1 1 A 204 204 ALA CA C 204 49.865 55.806 -5.941 1 1 1173 . 8 1 1 A 204 204 ALA CB C 204 17.364 18.837 -1.473 1 1 1174 . 8 1 1 A 204 204 ALA N N 204 125.510 125.557 -0.047 1 1 1175 . 8 1 1 A 205 205 PRO C C 205 175.430 176.384 -0.954 1 1 1176 . 8 1 1 A 205 205 PRO CA C 205 62.511 62.763 -0.252 1 1 1177 . 8 1 1 A 205 205 PRO CB C 205 31.056 32.553 -1.497 1 1 1179 . 8 1 1 A 206 206 ALA H H 206 7.847 8.407 -0.560 1 1 1180 . 8 1 1 A 206 206 ALA C C 206 175.565 178.176 -2.611 1 1 1181 . 8 1 1 A 206 206 ALA CA C 206 49.487 55.521 -6.034 1 1 1182 . 8 1 1 A 206 206 ALA CB C 206 18.843 18.958 -0.115 1 1 1183 . 8 1 1 A 206 206 ALA N N 206 123.663 122.199 1.464 1 1 1184 . 8 1 1 A 207 207 PRO C C 207 174.397 175.897 -1.500 1 1 1185 . 8 1 1 A 207 207 PRO CA C 207 61.454 63.258 -1.804 1 1 1186 . 8 1 1 A 207 207 PRO CB C 207 31.929 31.878 0.051 1 1 1187 . 8 1 1 A 208 208 ALA H H 208 7.898 8.457 -0.559 1 1 1188 . 8 1 1 A 208 208 ALA C C 208 175.411 176.247 -0.836 1 1 1189 . 8 1 1 A 208 208 ALA CA C 208 49.472 48.829 0.643 1 1 1190 . 8 1 1 A 208 208 ALA CB C 208 19.082 20.151 -1.069 1 1 1191 . 8 1 1 A 208 208 ALA N N 208 127.450 126.550 0.900 1 1 1192 . 8 1 1 A 209 209 PRO C C 209 176.932 176.900 0.032 1 1 1193 . 8 1 1 A 209 209 PRO CA C 209 62.736 62.539 0.197 1 1 1194 . 8 1 1 A 209 209 PRO CB C 209 31.012 32.386 -1.374 1 1 1 . 9 1 1 A 2 2 ARG C C 2 175.857 175.017 0.840 1 1 2 . 9 1 1 A 2 2 ARG CA C 2 55.872 55.455 0.417 1 1 3 . 9 1 1 A 2 2 ARG CB C 2 29.983 30.983 -1.000 1 1 5 . 9 1 1 A 3 3 ILE H H 3 8.238 7.542 0.696 1 1 9 . 9 1 1 A 3 3 ILE C C 3 175.763 174.661 1.102 1 1 10 . 9 1 1 A 3 3 ILE CA C 3 60.779 60.786 -0.007 1 1 11 . 9 1 1 A 3 3 ILE CB C 3 37.664 40.585 -2.921 1 1 15 . 9 1 1 A 3 3 ILE N N 3 122.580 120.248 2.332 1 1 16 . 9 1 1 A 4 4 MET H H 4 8.261 8.607 -0.346 1 1 17 . 9 1 1 A 4 4 MET C C 4 175.660 175.290 0.370 1 1 18 . 9 1 1 A 4 4 MET CA C 4 54.893 54.721 0.172 1 1 19 . 9 1 1 A 4 4 MET CB C 4 32.060 36.706 -4.646 1 1 22 . 9 1 1 A 4 4 MET N N 4 123.988 125.879 -1.891 1 1 23 . 9 1 1 A 5 5 LYS H H 5 8.041 8.786 -0.745 1 1 24 . 9 1 1 A 5 5 LYS C C 5 175.850 176.656 -0.806 1 1 25 . 9 1 1 A 5 5 LYS CA C 5 56.081 58.079 -1.998 1 1 26 . 9 1 1 A 5 5 LYS CB C 5 32.220 32.685 -0.465 1 1 29 . 9 1 1 A 5 5 LYS N N 5 122.015 121.851 0.164 1 1 30 . 9 1 1 A 6 6 ALA H H 6 8.042 7.961 0.081 1 1 34 . 9 1 1 A 6 6 ALA C C 6 177.160 176.545 0.615 1 1 35 . 9 1 1 A 6 6 ALA CA C 6 52.109 52.100 0.009 1 1 36 . 9 1 1 A 6 6 ALA CB C 6 18.637 20.867 -2.230 1 1 37 . 9 1 1 A 6 6 ALA N N 6 123.943 120.106 3.837 1 1 38 . 9 1 1 A 7 7 ILE H H 7 7.916 9.079 -1.163 1 1 42 . 9 1 1 A 7 7 ILE C C 7 175.611 176.135 -0.524 1 1 43 . 9 1 1 A 7 7 ILE CA C 7 61.181 62.633 -1.452 1 1 44 . 9 1 1 A 7 7 ILE CB C 7 37.910 39.691 -1.781 1 1 48 . 9 1 1 A 7 7 ILE N N 7 118.380 119.916 -1.536 1 1 49 . 9 1 1 A 8 8 PHE H H 8 8.167 7.960 0.207 1 1 50 . 9 1 1 A 8 8 PHE C C 8 175.363 175.119 0.244 1 1 51 . 9 1 1 A 8 8 PHE CA C 8 57.286 55.777 1.509 1 1 52 . 9 1 1 A 8 8 PHE CB C 8 39.008 42.178 -3.170 1 1 53 . 9 1 1 A 8 8 PHE N N 8 121.971 118.769 3.202 1 1 54 . 9 1 1 A 9 9 VAL H H 9 7.872 8.855 -0.983 1 1 61 . 9 1 1 A 9 9 VAL C C 9 175.405 175.614 -0.209 1 1 62 . 9 1 1 A 9 9 VAL CA C 9 61.662 64.618 -2.956 1 1 63 . 9 1 1 A 9 9 VAL CB C 9 32.026 32.059 -0.033 1 1 66 . 9 1 1 A 9 9 VAL N N 9 120.864 119.822 1.042 1 1 67 . 9 1 1 A 10 10 LEU H H 10 8.077 7.519 0.558 1 1 74 . 9 1 1 A 10 10 LEU C C 10 176.652 176.828 -0.176 1 1 75 . 9 1 1 A 10 10 LEU CA C 10 54.856 55.449 -0.593 1 1 76 . 9 1 1 A 10 10 LEU CB C 10 41.401 42.928 -1.527 1 1 80 . 9 1 1 A 10 10 LEU N N 10 124.826 123.577 1.249 1 1 81 . 9 1 1 A 11 11 ASN H H 11 8.177 8.720 -0.543 1 1 82 . 9 1 1 A 11 11 ASN C C 11 174.394 175.731 -1.337 1 1 83 . 9 1 1 A 11 11 ASN CA C 11 52.704 54.055 -1.351 1 1 84 . 9 1 1 A 11 11 ASN CB C 11 38.468 38.441 0.027 1 1 85 . 9 1 1 A 11 11 ASN N N 11 119.029 124.368 -5.339 1 1 86 . 9 1 1 A 12 12 ALA H H 12 7.991 8.844 -0.853 1 1 90 . 9 1 1 A 12 12 ALA C C 12 176.649 177.674 -1.025 1 1 91 . 9 1 1 A 12 12 ALA CA C 12 51.950 53.215 -1.265 1 1 92 . 9 1 1 A 12 12 ALA CB C 12 18.659 21.233 -2.574 1 1 93 . 9 1 1 A 12 12 ALA N N 12 123.695 126.799 -3.104 1 1 94 . 9 1 1 A 13 13 ALA H H 13 8.083 7.792 0.291 1 1 95 . 9 1 1 A 13 13 ALA C C 13 175.395 176.106 -0.711 1 1 96 . 9 1 1 A 13 13 ALA CA C 13 49.797 51.010 -1.213 1 1 97 . 9 1 1 A 13 13 ALA CB C 13 17.486 18.394 -0.908 1 1 98 . 9 1 1 A 13 13 ALA N N 13 124.281 120.970 3.311 1 1 99 . 9 1 1 A 14 14 PRO C C 14 176.641 176.337 0.304 1 1 100 . 9 1 1 A 14 14 PRO CA C 14 62.675 62.415 0.260 1 1 101 . 9 1 1 A 14 14 PRO CB C 14 31.000 32.871 -1.871 1 1 103 . 9 1 1 A 15 15 LYS H H 15 8.283 8.394 -0.111 1 1 104 . 9 1 1 A 15 15 LYS C C 15 175.683 177.223 -1.540 1 1 105 . 9 1 1 A 15 15 LYS CA C 15 55.429 55.644 -0.215 1 1 106 . 9 1 1 A 15 15 LYS CB C 15 32.246 34.456 -2.210 1 1 109 . 9 1 1 A 15 15 LYS N N 15 119.069 121.445 -2.376 1 1 110 . 9 1 1 A 16 16 ASP H H 16 7.880 8.722 -0.842 1 1 111 . 9 1 1 A 16 16 ASP C C 16 175.419 177.312 -1.893 1 1 112 . 9 1 1 A 16 16 ASP CA C 16 54.413 56.646 -2.233 1 1 113 . 9 1 1 A 16 16 ASP CB C 16 40.224 41.195 -0.971 1 1 114 . 9 1 1 A 16 16 ASP N N 16 119.625 122.170 -2.545 1 1 115 . 9 1 1 A 17 17 ASN H H 17 7.973 8.118 -0.145 1 1 116 . 9 1 1 A 17 17 ASN C C 17 174.231 175.428 -1.197 1 1 117 . 9 1 1 A 17 17 ASN CA C 17 53.948 53.777 0.171 1 1 118 . 9 1 1 A 17 17 ASN CB C 17 37.009 39.248 -2.239 1 1 119 . 9 1 1 A 17 17 ASN N N 17 118.063 116.812 1.251 1 1 120 . 9 1 1 A 18 18 THR H H 18 7.318 8.768 -1.450 1 1 121 . 9 1 1 A 18 18 THR C C 18 172.323 172.145 0.178 1 1 122 . 9 1 1 A 18 18 THR CA C 18 60.153 60.853 -0.700 1 1 123 . 9 1 1 A 18 18 THR CB C 18 71.534 70.858 0.676 1 1 125 . 9 1 1 A 18 18 THR N N 18 109.092 114.584 -5.492 1 1 126 . 9 1 1 A 19 19 TRP H H 19 8.541 8.278 0.263 1 1 127 . 9 1 1 A 19 19 TRP C C 19 175.969 175.252 0.717 1 1 128 . 9 1 1 A 19 19 TRP CA C 19 55.700 55.377 0.323 1 1 129 . 9 1 1 A 19 19 TRP CB C 19 31.471 33.243 -1.772 1 1 130 . 9 1 1 A 19 19 TRP N N 19 121.992 126.405 -4.413 1 1 131 . 9 1 1 A 20 20 TYR H H 20 8.691 9.003 -0.312 1 1 132 . 9 1 1 A 20 20 TYR C C 20 173.684 174.795 -1.111 1 1 133 . 9 1 1 A 20 20 TYR CA C 20 55.805 56.068 -0.263 1 1 134 . 9 1 1 A 20 20 TYR CB C 20 40.513 41.914 -1.401 1 1 135 . 9 1 1 A 20 20 TYR N N 20 116.519 122.350 -5.831 1 1 136 . 9 1 1 A 21 21 ALA H H 21 8.876 8.704 0.172 1 1 137 . 9 1 1 A 21 21 ALA C C 21 175.395 175.726 -0.331 1 1 138 . 9 1 1 A 21 21 ALA CA C 21 50.970 51.068 -0.098 1 1 139 . 9 1 1 A 21 21 ALA CB C 21 22.142 23.692 -1.550 1 1 140 . 9 1 1 A 21 21 ALA N N 21 119.359 123.288 -3.929 1 1 141 . 9 1 1 A 22 22 GLY H H 22 8.613 8.345 0.268 1 1 142 . 9 1 1 A 22 22 GLY C C 22 171.458 171.970 -0.512 1 1 143 . 9 1 1 A 22 22 GLY CA C 22 45.608 46.005 -0.397 1 1 144 . 9 1 1 A 22 22 GLY N N 22 106.678 105.838 0.840 1 1 145 . 9 1 1 A 23 23 GLY H H 23 7.911 8.457 -0.546 1 1 146 . 9 1 1 A 23 23 GLY C C 23 170.563 172.181 -1.618 1 1 147 . 9 1 1 A 23 23 GLY CA C 23 44.026 45.613 -1.587 1 1 148 . 9 1 1 A 23 23 GLY N N 23 103.399 108.815 -5.416 1 1 149 . 9 1 1 A 24 24 LYS H H 24 9.001 9.647 -0.646 1 1 150 . 9 1 1 A 24 24 LYS C C 24 172.965 174.190 -1.225 1 1 151 . 9 1 1 A 24 24 LYS CA C 24 54.062 54.078 -0.016 1 1 152 . 9 1 1 A 24 24 LYS CB C 24 36.774 36.439 0.335 1 1 156 . 9 1 1 A 24 24 LYS N N 24 116.402 118.273 -1.871 1 1 157 . 9 1 1 A 25 25 LEU H H 25 8.587 9.188 -0.601 1 1 164 . 9 1 1 A 25 25 LEU C C 25 175.205 175.206 -0.001 1 1 165 . 9 1 1 A 25 25 LEU CA C 25 53.446 53.513 -0.067 1 1 166 . 9 1 1 A 25 25 LEU CB C 25 46.287 46.942 -0.655 1 1 170 . 9 1 1 A 25 25 LEU N N 25 119.932 121.611 -1.679 1 1 171 . 9 1 1 A 26 26 GLY H H 26 8.637 8.524 0.113 1 1 172 . 9 1 1 A 26 26 GLY C C 26 170.804 173.088 -2.284 1 1 173 . 9 1 1 A 26 26 GLY CA C 26 45.669 45.743 -0.074 1 1 174 . 9 1 1 A 26 26 GLY N N 26 108.136 110.981 -2.845 1 1 175 . 9 1 1 A 27 27 TRP H H 27 8.642 8.912 -0.270 1 1 177 . 9 1 1 A 27 27 TRP C C 27 174.820 174.240 0.580 1 1 178 . 9 1 1 A 27 27 TRP CB C 27 30.883 33.164 -2.281 1 1 179 . 9 1 1 A 27 27 TRP N N 27 120.887 117.924 2.963 1 1 181 . 9 1 1 A 32 32 ASP C C 32 176.315 175.470 0.845 1 1 182 . 9 1 1 A 32 32 ASP CA C 32 53.737 52.470 1.267 1 1 183 . 9 1 1 A 32 32 ASP CB C 32 41.230 44.689 -3.459 1 1 184 . 9 1 1 A 33 33 THR H H 33 8.190 8.724 -0.534 1 1 188 . 9 1 1 A 33 33 THR C C 33 175.291 175.555 -0.264 1 1 189 . 9 1 1 A 33 33 THR CA C 33 61.909 63.808 -1.899 1 1 190 . 9 1 1 A 33 33 THR CB C 33 68.961 69.701 -0.740 1 1 192 . 9 1 1 A 33 33 THR N N 33 114.235 113.456 0.779 1 1 193 . 9 1 1 A 34 34 GLY H H 34 8.341 7.941 0.400 1 1 194 . 9 1 1 A 34 34 GLY C C 34 173.766 174.215 -0.449 1 1 195 . 9 1 1 A 34 34 GLY CA C 34 44.941 45.054 -0.113 1 1 196 . 9 1 1 A 34 34 GLY N N 34 110.678 107.302 3.376 1 1 197 . 9 1 1 A 35 35 PHE H H 35 7.945 8.657 -0.712 1 1 198 . 9 1 1 A 35 35 PHE C C 35 175.411 175.159 0.252 1 1 199 . 9 1 1 A 35 35 PHE CA C 35 57.921 57.036 0.885 1 1 200 . 9 1 1 A 35 35 PHE CB C 35 38.806 37.538 1.268 1 1 201 . 9 1 1 A 35 35 PHE N N 35 120.533 123.256 -2.723 1 1 202 . 9 1 1 A 36 36 TYR H H 36 7.967 8.817 -0.850 1 1 203 . 9 1 1 A 36 36 TYR C C 36 176.104 175.328 0.776 1 1 204 . 9 1 1 A 36 36 TYR CA C 36 57.568 59.807 -2.239 1 1 205 . 9 1 1 A 36 36 TYR CB C 36 37.727 40.313 -2.586 1 1 206 . 9 1 1 A 36 36 TYR N N 36 120.254 126.226 -5.972 1 1 207 . 9 1 1 A 37 37 GLY H H 37 7.666 7.999 -0.333 1 1 208 . 9 1 1 A 37 37 GLY C C 37 173.794 174.715 -0.921 1 1 209 . 9 1 1 A 37 37 GLY CA C 37 45.007 44.945 0.062 1 1 210 . 9 1 1 A 37 37 GLY N N 37 108.995 106.954 2.041 1 1 211 . 9 1 1 A 38 38 ASN H H 38 8.109 8.855 -0.746 1 1 212 . 9 1 1 A 38 38 ASN C C 38 175.612 176.829 -1.217 1 1 213 . 9 1 1 A 38 38 ASN CA C 38 52.954 55.605 -2.651 1 1 214 . 9 1 1 A 38 38 ASN CB C 38 38.425 38.729 -0.304 1 1 215 . 9 1 1 A 38 38 ASN N N 38 118.603 122.470 -3.867 1 1 216 . 9 1 1 A 39 39 GLY H H 39 8.202 7.759 0.443 1 1 217 . 9 1 1 A 39 39 GLY C C 39 173.958 172.619 1.339 1 1 218 . 9 1 1 A 39 39 GLY CA C 39 45.012 44.507 0.505 1 1 219 . 9 1 1 A 39 39 GLY N N 39 108.897 107.943 0.954 1 1 220 . 9 1 1 A 40 40 PHE H H 40 7.960 8.601 -0.641 1 1 221 . 9 1 1 A 40 40 PHE C C 40 175.653 174.951 0.702 1 1 222 . 9 1 1 A 40 40 PHE CA C 40 57.556 57.276 0.280 1 1 223 . 9 1 1 A 40 40 PHE CB C 40 38.513 41.618 -3.105 1 1 224 . 9 1 1 A 40 40 PHE N N 40 119.829 120.573 -0.744 1 1 225 . 9 1 1 A 41 41 GLN H H 41 8.173 8.944 -0.771 1 1 226 . 9 1 1 A 41 41 GLN C C 41 175.234 174.803 0.431 1 1 227 . 9 1 1 A 41 41 GLN CA C 41 55.488 55.120 0.368 1 1 228 . 9 1 1 A 41 41 GLN CB C 41 28.523 31.003 -2.480 1 1 230 . 9 1 1 A 41 41 GLN N N 41 120.810 122.501 -1.691 1 1 231 . 9 1 1 A 42 42 ASN H H 42 8.193 8.813 -0.620 1 1 232 . 9 1 1 A 42 42 ASN C C 42 174.618 174.222 0.396 1 1 233 . 9 1 1 A 42 42 ASN CA C 42 52.924 52.160 0.764 1 1 234 . 9 1 1 A 42 42 ASN CB C 42 38.333 39.223 -0.890 1 1 235 . 9 1 1 A 42 42 ASN N N 42 119.679 121.601 -1.922 1 1 236 . 9 1 1 A 43 43 ASN H H 43 8.255 8.659 -0.404 1 1 237 . 9 1 1 A 43 43 ASN C C 43 173.873 174.926 -1.053 1 1 238 . 9 1 1 A 43 43 ASN CA C 43 52.919 52.205 0.714 1 1 239 . 9 1 1 A 43 43 ASN CB C 43 38.580 42.674 -4.094 1 1 240 . 9 1 1 A 43 43 ASN N N 43 119.773 124.283 -4.510 1 1 241 . 9 1 1 A 44 44 ASN H H 44 7.865 8.691 -0.826 1 1 242 . 9 1 1 A 44 44 ASN C C 44 175.518 174.687 0.831 1 1 243 . 9 1 1 A 44 44 ASN CA C 44 54.528 52.057 2.471 1 1 244 . 9 1 1 A 44 44 ASN CB C 44 40.170 39.979 0.191 1 1 246 . 9 1 1 A 44 44 ASN N N 44 124.152 121.881 2.271 1 1 247 . 9 1 1 A 46 46 PRO C C 46 177.228 175.622 1.606 1 1 248 . 9 1 1 A 46 46 PRO CA C 46 62.794 62.876 -0.082 1 1 249 . 9 1 1 A 46 46 PRO CB C 46 31.283 32.976 -1.693 1 1 251 . 9 1 1 A 47 47 THR H H 47 8.165 8.366 -0.201 1 1 255 . 9 1 1 A 47 47 THR C C 47 174.573 173.794 0.779 1 1 256 . 9 1 1 A 47 47 THR CA C 47 61.346 61.510 -0.164 1 1 257 . 9 1 1 A 47 47 THR CB C 47 69.573 70.170 -0.597 1 1 259 . 9 1 1 A 47 47 THR N N 47 114.265 116.049 -1.784 1 1 260 . 9 1 1 A 48 48 ARG H H 48 8.237 8.731 -0.494 1 1 261 . 9 1 1 A 48 48 ARG C C 48 175.898 176.066 -0.168 1 1 262 . 9 1 1 A 48 48 ARG CA C 48 55.717 56.555 -0.838 1 1 263 . 9 1 1 A 48 48 ARG CB C 48 30.151 31.036 -0.885 1 1 266 . 9 1 1 A 48 48 ARG N N 48 122.795 126.635 -3.840 1 1 267 . 9 1 1 A 49 49 ASN H H 49 8.369 8.676 -0.307 1 1 268 . 9 1 1 A 49 49 ASN C C 49 174.560 174.781 -0.221 1 1 269 . 9 1 1 A 49 49 ASN CA C 49 53.005 51.650 1.355 1 1 270 . 9 1 1 A 49 49 ASN CB C 49 38.761 40.712 -1.951 1 1 271 . 9 1 1 A 49 49 ASN N N 49 119.837 117.913 1.924 1 1 272 . 9 1 1 A 50 50 ASP H H 50 8.192 8.545 -0.353 1 1 273 . 9 1 1 A 50 50 ASP C C 50 175.699 175.762 -0.063 1 1 274 . 9 1 1 A 50 50 ASP CA C 50 54.289 52.754 1.535 1 1 275 . 9 1 1 A 50 50 ASP CB C 50 41.264 41.527 -0.263 1 1 276 . 9 1 1 A 50 50 ASP N N 50 120.403 120.277 0.126 1 1 277 . 9 1 1 A 51 51 GLN H H 51 8.428 8.557 -0.129 1 1 278 . 9 1 1 A 51 51 GLN C C 51 175.186 175.211 -0.025 1 1 279 . 9 1 1 A 51 51 GLN CA C 51 54.512 55.303 -0.791 1 1 280 . 9 1 1 A 51 51 GLN CB C 51 30.424 30.215 0.209 1 1 282 . 9 1 1 A 51 51 GLN N N 51 118.959 119.050 -0.091 1 1 289 . 9 1 1 A 52 52 LEU C C 52 176.018 176.612 -0.594 1 1 290 . 9 1 1 A 52 52 LEU CA C 52 54.332 53.569 0.763 1 1 291 . 9 1 1 A 52 52 LEU CB C 52 43.022 43.504 -0.482 1 1 294 . 9 1 1 A 53 53 GLY H H 53 8.639 8.755 -0.116 1 1 295 . 9 1 1 A 53 53 GLY C C 53 171.931 171.709 0.222 1 1 296 . 9 1 1 A 53 53 GLY CA C 53 43.501 44.573 -1.072 1 1 297 . 9 1 1 A 53 53 GLY N N 53 109.964 108.848 1.116 1 1 298 . 9 1 1 A 54 54 ALA H H 54 8.881 9.119 -0.238 1 1 299 . 9 1 1 A 54 54 ALA C C 54 175.543 176.663 -1.120 1 1 300 . 9 1 1 A 54 54 ALA CA C 54 50.710 50.540 0.170 1 1 301 . 9 1 1 A 54 54 ALA CB C 54 22.914 21.732 1.182 1 1 302 . 9 1 1 A 54 54 ALA N N 54 120.413 125.276 -4.863 1 1 303 . 9 1 1 A 55 55 GLY H H 55 8.346 9.147 -0.801 1 1 304 . 9 1 1 A 55 55 GLY C C 55 170.960 171.935 -0.975 1 1 305 . 9 1 1 A 55 55 GLY CA C 55 46.704 44.947 1.757 1 1 306 . 9 1 1 A 55 55 GLY N N 55 104.688 110.187 -5.499 1 1 307 . 9 1 1 A 56 56 ALA H H 56 9.116 9.193 -0.077 1 1 308 . 9 1 1 A 56 56 ALA C C 56 176.472 176.495 -0.023 1 1 309 . 9 1 1 A 56 56 ALA CA C 56 49.638 50.741 -1.103 1 1 310 . 9 1 1 A 56 56 ALA CB C 56 22.275 21.928 0.347 1 1 311 . 9 1 1 A 56 56 ALA N N 56 120.608 124.963 -4.355 1 1 312 . 9 1 1 A 57 57 PHE H H 57 8.688 9.483 -0.795 1 1 313 . 9 1 1 A 57 57 PHE C C 57 172.816 175.611 -2.795 1 1 314 . 9 1 1 A 57 57 PHE CA C 57 56.066 55.983 0.083 1 1 315 . 9 1 1 A 57 57 PHE CB C 57 41.770 41.771 -0.001 1 1 316 . 9 1 1 A 57 57 PHE N N 57 120.027 119.426 0.601 1 1 317 . 9 1 1 A 58 58 GLY H H 58 9.034 8.499 0.535 1 1 318 . 9 1 1 A 58 58 GLY C C 58 170.860 172.464 -1.604 1 1 319 . 9 1 1 A 58 58 GLY CA C 58 44.954 44.994 -0.040 1 1 320 . 9 1 1 A 58 58 GLY N N 58 105.817 109.825 -4.008 1 1 321 . 9 1 1 A 59 59 GLY H H 59 8.382 8.434 -0.052 1 1 322 . 9 1 1 A 59 59 GLY C C 59 169.284 172.121 -2.837 1 1 323 . 9 1 1 A 59 59 GLY CA C 59 45.840 45.216 0.624 1 1 324 . 9 1 1 A 59 59 GLY N N 59 109.059 109.826 -0.767 1 1 325 . 9 1 1 A 60 60 TYR H H 60 8.430 9.058 -0.628 1 1 326 . 9 1 1 A 60 60 TYR C C 60 173.453 172.269 1.184 1 1 327 . 9 1 1 A 60 60 TYR CA C 60 55.282 56.106 -0.824 1 1 328 . 9 1 1 A 60 60 TYR CB C 60 41.712 40.686 1.026 1 1 329 . 9 1 1 A 60 60 TYR N N 60 118.352 115.332 3.020 1 1 330 . 9 1 1 A 61 61 GLN H H 61 8.833 8.506 0.327 1 1 331 . 9 1 1 A 61 61 GLN C C 61 174.365 175.588 -1.223 1 1 332 . 9 1 1 A 61 61 GLN CA C 61 54.125 54.975 -0.850 1 1 333 . 9 1 1 A 61 61 GLN CB C 61 28.033 31.184 -3.151 1 1 335 . 9 1 1 A 61 61 GLN N N 61 129.628 119.626 10.002 1 1 336 . 9 1 1 A 62 62 VAL H H 62 8.714 8.846 -0.132 1 1 343 . 9 1 1 A 62 62 VAL C C 62 175.758 174.910 0.848 1 1 344 . 9 1 1 A 62 62 VAL CA C 62 64.649 61.601 3.048 1 1 345 . 9 1 1 A 62 62 VAL CB C 62 31.900 32.568 -0.668 1 1 348 . 9 1 1 A 62 62 VAL N N 62 127.666 123.724 3.942 1 1 349 . 9 1 1 A 63 63 ASN H H 63 8.062 7.833 0.229 1 1 350 . 9 1 1 A 63 63 ASN C C 63 172.827 173.066 -0.239 1 1 351 . 9 1 1 A 63 63 ASN CA C 63 51.575 51.504 0.071 1 1 352 . 9 1 1 A 63 63 ASN CB C 63 37.194 41.945 -4.751 1 1 353 . 9 1 1 A 63 63 ASN N N 63 116.310 118.795 -2.485 1 1 354 . 9 1 1 A 64 64 PRO C C 64 175.071 175.214 -0.143 1 1 355 . 9 1 1 A 64 64 PRO CA C 64 65.296 62.517 2.779 1 1 356 . 9 1 1 A 64 64 PRO CB C 64 30.428 29.211 1.217 1 1 357 . 9 1 1 A 65 65 TYR H H 65 7.873 8.798 -0.925 1 1 358 . 9 1 1 A 65 65 TYR C C 65 175.145 175.187 -0.042 1 1 359 . 9 1 1 A 65 65 TYR CA C 65 56.125 59.126 -3.001 1 1 360 . 9 1 1 A 65 65 TYR CB C 65 39.189 41.279 -2.090 1 1 361 . 9 1 1 A 65 65 TYR N N 65 112.894 121.765 -8.871 1 1 362 . 9 1 1 A 66 66 LEU H H 66 7.308 7.527 -0.219 1 1 369 . 9 1 1 A 66 66 LEU C C 66 173.866 174.319 -0.453 1 1 370 . 9 1 1 A 66 66 LEU CA C 66 53.431 54.026 -0.595 1 1 371 . 9 1 1 A 66 66 LEU CB C 66 44.958 43.860 1.098 1 1 375 . 9 1 1 A 66 66 LEU N N 66 120.270 116.586 3.684 1 1 376 . 9 1 1 A 67 67 GLY H H 67 8.855 8.451 0.404 1 1 377 . 9 1 1 A 67 67 GLY C C 67 170.698 171.722 -1.024 1 1 378 . 9 1 1 A 67 67 GLY CA C 67 44.008 43.979 0.029 1 1 379 . 9 1 1 A 67 67 GLY N N 67 114.388 106.405 7.983 1 1 380 . 9 1 1 A 68 68 PHE H H 68 8.770 8.341 0.429 1 1 381 . 9 1 1 A 68 68 PHE C C 68 173.386 174.353 -0.967 1 1 382 . 9 1 1 A 68 68 PHE CA C 68 56.507 57.282 -0.775 1 1 383 . 9 1 1 A 68 68 PHE CB C 68 42.428 41.038 1.390 1 1 384 . 9 1 1 A 68 68 PHE N N 68 117.510 118.681 -1.171 1 1 385 . 9 1 1 A 69 69 GLU H H 69 9.079 9.560 -0.481 1 1 386 . 9 1 1 A 69 69 GLU C C 69 174.556 174.728 -0.172 1 1 387 . 9 1 1 A 69 69 GLU CA C 69 54.939 54.728 0.211 1 1 388 . 9 1 1 A 69 69 GLU CB C 69 33.963 33.336 0.627 1 1 390 . 9 1 1 A 69 69 GLU N N 69 120.562 122.121 -1.559 1 1 391 . 9 1 1 A 70 70 MET H H 70 9.481 9.524 -0.043 1 1 392 . 9 1 1 A 70 70 MET C C 70 174.595 175.223 -0.628 1 1 393 . 9 1 1 A 70 70 MET CA C 70 53.091 53.999 -0.908 1 1 394 . 9 1 1 A 70 70 MET CB C 70 36.159 34.723 1.436 1 1 397 . 9 1 1 A 70 70 MET N N 70 124.928 125.343 -0.415 1 1 398 . 9 1 1 A 71 71 GLY H H 71 8.845 8.632 0.213 1 1 399 . 9 1 1 A 71 71 GLY C C 71 170.811 170.909 -0.098 1 1 400 . 9 1 1 A 71 71 GLY CA C 71 44.624 43.331 1.293 1 1 401 . 9 1 1 A 71 71 GLY N N 71 108.896 111.982 -3.086 1 1 402 . 9 1 1 A 72 72 TYR H H 72 8.925 9.184 -0.259 1 1 403 . 9 1 1 A 72 72 TYR C C 72 173.278 174.613 -1.335 1 1 404 . 9 1 1 A 72 72 TYR CA C 72 55.912 56.349 -0.437 1 1 405 . 9 1 1 A 72 72 TYR CB C 72 41.611 40.361 1.250 1 1 406 . 9 1 1 A 72 72 TYR N N 72 123.253 121.735 1.518 1 1 407 . 9 1 1 A 73 73 ASP H H 73 8.665 8.600 0.065 1 1 408 . 9 1 1 A 73 73 ASP C C 73 173.598 175.437 -1.839 1 1 409 . 9 1 1 A 73 73 ASP CA C 73 52.857 54.085 -1.228 1 1 410 . 9 1 1 A 73 73 ASP CB C 73 42.774 41.086 1.688 1 1 411 . 9 1 1 A 73 73 ASP N N 73 126.178 124.104 2.074 1 1 412 . 9 1 1 A 74 74 TRP H H 74 9.080 9.098 -0.018 1 1 413 . 9 1 1 A 74 74 TRP C C 74 174.868 176.680 -1.812 1 1 414 . 9 1 1 A 74 74 TRP CB C 74 30.083 33.099 -3.016 1 1 415 . 9 1 1 A 74 74 TRP N N 74 121.824 126.362 -4.538 1 1 416 . 9 1 1 A 78 78 MET C C 78 174.548 176.969 -2.421 1 1 417 . 9 1 1 A 78 78 MET CA C 78 54.388 53.942 0.446 1 1 418 . 9 1 1 A 78 78 MET CB C 78 32.542 35.111 -2.569 1 1 419 . 9 1 1 A 79 79 ALA H H 79 8.105 8.843 -0.738 1 1 420 . 9 1 1 A 79 79 ALA C C 79 176.629 178.102 -1.473 1 1 421 . 9 1 1 A 79 79 ALA CA C 79 51.210 55.432 -4.222 1 1 422 . 9 1 1 A 79 79 ALA CB C 79 19.106 18.742 0.364 1 1 423 . 9 1 1 A 79 79 ALA N N 79 125.778 129.567 -3.789 1 1 424 . 9 1 1 A 80 80 TYR H H 80 8.035 7.388 0.647 1 1 425 . 9 1 1 A 80 80 TYR C C 80 175.604 175.519 0.085 1 1 426 . 9 1 1 A 80 80 TYR CA C 80 57.021 57.588 -0.567 1 1 427 . 9 1 1 A 80 80 TYR CB C 80 38.416 39.828 -1.412 1 1 428 . 9 1 1 A 80 80 TYR N N 80 120.045 112.031 8.014 1 1 429 . 9 1 1 A 81 81 LYS H H 81 8.295 6.662 1.633 1 1 430 . 9 1 1 A 81 81 LYS C C 81 176.647 174.936 1.711 1 1 431 . 9 1 1 A 81 81 LYS CA C 81 56.285 54.971 1.314 1 1 432 . 9 1 1 A 81 81 LYS CB C 81 31.571 36.896 -5.325 1 1 434 . 9 1 1 A 81 81 LYS N N 81 123.191 117.761 5.430 1 1 435 . 9 1 1 A 82 82 GLY H H 82 8.117 8.425 -0.308 1 1 436 . 9 1 1 A 82 82 GLY C C 82 174.010 172.015 1.995 1 1 437 . 9 1 1 A 82 82 GLY CA C 82 44.982 45.503 -0.521 1 1 438 . 9 1 1 A 82 82 GLY N N 82 110.014 108.853 1.161 1 1 439 . 9 1 1 A 83 83 SER H H 83 7.938 8.396 -0.458 1 1 440 . 9 1 1 A 83 83 SER C C 83 174.634 174.440 0.194 1 1 441 . 9 1 1 A 83 83 SER CA C 83 57.685 58.556 -0.871 1 1 442 . 9 1 1 A 83 83 SER CB C 83 63.303 64.297 -0.994 1 1 443 . 9 1 1 A 83 83 SER N N 83 115.655 116.898 -1.243 1 1 444 . 9 1 1 A 84 84 VAL H H 84 8.008 8.351 -0.343 1 1 451 . 9 1 1 A 84 84 VAL C C 84 175.525 174.619 0.906 1 1 452 . 9 1 1 A 84 84 VAL CA C 84 61.769 61.429 0.340 1 1 453 . 9 1 1 A 84 84 VAL CB C 84 31.711 31.000 0.711 1 1 456 . 9 1 1 A 84 84 VAL N N 84 120.054 123.252 -3.198 1 1 457 . 9 1 1 A 85 85 ASP H H 85 8.140 7.708 0.432 1 1 458 . 9 1 1 A 85 85 ASP C C 85 174.740 175.938 -1.198 1 1 459 . 9 1 1 A 85 85 ASP CA C 85 53.983 52.942 1.041 1 1 460 . 9 1 1 A 85 85 ASP CB C 85 40.633 43.133 -2.500 1 1 461 . 9 1 1 A 85 85 ASP N N 85 122.510 123.684 -1.174 1 1 462 . 9 1 1 A 86 86 ASN H H 86 7.736 8.661 -0.925 1 1 463 . 9 1 1 A 86 86 ASN C C 86 175.970 175.624 0.346 1 1 464 . 9 1 1 A 86 86 ASN CA C 86 54.349 53.531 0.818 1 1 465 . 9 1 1 A 86 86 ASN CB C 86 40.490 38.530 1.960 1 1 467 . 9 1 1 A 86 86 ASN N N 86 124.290 118.069 6.221 1 1 468 . 9 1 1 A 87 87 GLY H H 87 8.000 8.412 -0.412 1 1 469 . 9 1 1 A 87 87 GLY C C 87 173.456 171.781 1.675 1 1 470 . 9 1 1 A 87 87 GLY CA C 87 44.973 45.339 -0.366 1 1 471 . 9 1 1 A 87 87 GLY N N 87 113.494 109.750 3.744 1 1 472 . 9 1 1 A 88 88 ALA H H 88 8.024 8.217 -0.193 1 1 473 . 9 1 1 A 88 88 ALA C C 88 176.833 177.444 -0.611 1 1 474 . 9 1 1 A 88 88 ALA CA C 88 51.734 50.453 1.281 1 1 475 . 9 1 1 A 88 88 ALA CB C 88 19.818 21.443 -1.625 1 1 476 . 9 1 1 A 88 88 ALA N N 88 122.676 120.598 2.078 1 1 477 . 9 1 1 A 91 91 ALA C C 91 174.781 176.576 -1.795 1 1 478 . 9 1 1 A 91 91 ALA CA C 91 50.537 50.403 0.134 1 1 479 . 9 1 1 A 91 91 ALA CB C 91 21.324 22.772 -1.448 1 1 480 . 9 1 1 A 92 92 GLN H H 92 8.451 8.987 -0.536 1 1 481 . 9 1 1 A 92 92 GLN C C 92 173.557 174.726 -1.169 1 1 482 . 9 1 1 A 92 92 GLN CA C 92 53.380 55.543 -2.163 1 1 484 . 9 1 1 A 92 92 GLN N N 92 116.847 119.130 -2.283 1 1 485 . 9 1 1 A 93 93 GLY C C 93 170.631 172.169 -1.538 1 1 486 . 9 1 1 A 93 93 GLY CA C 93 45.718 44.313 1.405 1 1 487 . 9 1 1 A 94 94 VAL H H 94 8.686 9.324 -0.638 1 1 494 . 9 1 1 A 94 94 VAL C C 94 173.698 174.400 -0.702 1 1 495 . 9 1 1 A 94 94 VAL CA C 94 58.997 59.953 -0.956 1 1 496 . 9 1 1 A 94 94 VAL CB C 94 33.311 34.108 -0.797 1 1 499 . 9 1 1 A 94 94 VAL N N 94 118.489 120.227 -1.738 1 1 500 . 9 1 1 A 95 95 GLN H H 95 9.468 9.340 0.128 1 1 501 . 9 1 1 A 95 95 GLN C C 95 174.028 174.120 -0.092 1 1 502 . 9 1 1 A 95 95 GLN CA C 95 52.547 54.258 -1.711 1 1 503 . 9 1 1 A 95 95 GLN CB C 95 33.816 31.501 2.315 1 1 505 . 9 1 1 A 95 95 GLN N N 95 122.106 125.965 -3.859 1 1 506 . 9 1 1 A 96 96 LEU H H 96 8.484 8.945 -0.461 1 1 513 . 9 1 1 A 96 96 LEU C C 96 175.322 175.417 -0.095 1 1 514 . 9 1 1 A 96 96 LEU CA C 96 53.736 53.860 -0.124 1 1 515 . 9 1 1 A 96 96 LEU CB C 96 41.088 44.457 -3.369 1 1 519 . 9 1 1 A 96 96 LEU N N 96 123.224 125.209 -1.985 1 1 520 . 9 1 1 A 97 97 THR H H 97 9.116 8.929 0.187 1 1 521 . 9 1 1 A 97 97 THR C C 97 173.251 171.748 1.503 1 1 522 . 9 1 1 A 97 97 THR CA C 97 58.931 59.379 -0.448 1 1 523 . 9 1 1 A 97 97 THR CB C 97 72.984 72.540 0.444 1 1 525 . 9 1 1 A 97 97 THR N N 97 112.504 115.811 -3.307 1 1 526 . 9 1 1 A 98 98 ALA H H 98 8.603 8.474 0.129 1 1 527 . 9 1 1 A 98 98 ALA C C 98 174.948 177.090 -2.142 1 1 528 . 9 1 1 A 98 98 ALA CA C 98 49.980 50.454 -0.474 1 1 529 . 9 1 1 A 98 98 ALA CB C 98 19.157 20.197 -1.040 1 1 530 . 9 1 1 A 98 98 ALA N N 98 121.608 124.086 -2.478 1 1 531 . 9 1 1 A 99 99 LYS H H 99 8.890 9.243 -0.353 1 1 532 . 9 1 1 A 99 99 LYS C C 99 174.294 175.617 -1.323 1 1 533 . 9 1 1 A 99 99 LYS CA C 99 54.019 55.226 -1.207 1 1 534 . 9 1 1 A 99 99 LYS CB C 99 33.018 34.309 -1.291 1 1 538 . 9 1 1 A 99 99 LYS N N 99 124.522 120.856 3.666 1 1 539 . 9 1 1 A 100 100 LEU H H 100 8.985 8.887 0.098 1 1 546 . 9 1 1 A 100 100 LEU C C 100 175.265 175.486 -0.221 1 1 547 . 9 1 1 A 100 100 LEU CA C 100 52.698 53.296 -0.598 1 1 548 . 9 1 1 A 100 100 LEU CB C 100 42.889 44.671 -1.782 1 1 552 . 9 1 1 A 100 100 LEU N N 100 131.876 122.214 9.662 1 1 553 . 9 1 1 A 101 101 GLY H H 101 9.137 8.236 0.901 1 1 554 . 9 1 1 A 101 101 GLY C C 101 170.798 171.347 -0.549 1 1 555 . 9 1 1 A 101 101 GLY CA C 101 44.429 45.047 -0.618 1 1 556 . 9 1 1 A 101 101 GLY N N 101 111.928 108.097 3.831 1 1 557 . 9 1 1 A 102 102 TYR H H 102 8.779 8.358 0.421 1 1 558 . 9 1 1 A 102 102 TYR C C 102 173.402 173.358 0.044 1 1 559 . 9 1 1 A 102 102 TYR CA C 102 54.444 56.386 -1.942 1 1 560 . 9 1 1 A 102 102 TYR CB C 102 42.239 42.189 0.050 1 1 561 . 9 1 1 A 102 102 TYR N N 102 116.664 120.031 -3.367 1 1 562 . 9 1 1 A 103 103 PRO C C 103 175.676 175.871 -0.195 1 1 563 . 9 1 1 A 103 103 PRO CA C 103 61.462 62.571 -1.109 1 1 564 . 9 1 1 A 103 103 PRO CB C 103 30.073 33.379 -3.306 1 1 565 . 9 1 1 A 104 104 ILE H H 104 8.670 9.013 -0.343 1 1 569 . 9 1 1 A 104 104 ILE C C 104 176.646 177.038 -0.392 1 1 570 . 9 1 1 A 104 104 ILE CA C 104 62.054 62.102 -0.048 1 1 571 . 9 1 1 A 104 104 ILE CB C 104 37.678 40.916 -3.238 1 1 574 . 9 1 1 A 104 104 ILE N N 104 125.939 120.458 5.481 1 1 575 . 9 1 1 A 105 105 THR H H 105 8.129 7.801 0.328 1 1 576 . 9 1 1 A 105 105 THR C C 105 174.344 174.514 -0.170 1 1 577 . 9 1 1 A 105 105 THR CA C 105 59.176 62.193 -3.017 1 1 578 . 9 1 1 A 105 105 THR CB C 105 71.049 70.084 0.965 1 1 580 . 9 1 1 A 105 105 THR N N 105 109.853 111.024 -1.171 1 1 581 . 9 1 1 A 106 106 ASP H H 106 8.424 7.893 0.531 1 1 582 . 9 1 1 A 106 106 ASP C C 106 175.692 176.000 -0.308 1 1 583 . 9 1 1 A 106 106 ASP CA C 106 56.465 55.620 0.845 1 1 584 . 9 1 1 A 106 106 ASP CB C 106 40.032 42.665 -2.633 1 1 585 . 9 1 1 A 106 106 ASP N N 106 117.156 120.354 -3.198 1 1 586 . 9 1 1 A 107 107 ASP H H 107 8.124 8.660 -0.536 1 1 587 . 9 1 1 A 107 107 ASP C C 107 174.174 174.493 -0.319 1 1 588 . 9 1 1 A 107 107 ASP CA C 107 52.907 53.922 -1.015 1 1 589 . 9 1 1 A 107 107 ASP CB C 107 41.661 41.620 0.041 1 1 590 . 9 1 1 A 107 107 ASP N N 107 113.591 118.416 -4.825 1 1 591 . 9 1 1 A 108 108 LEU H H 108 7.336 7.597 -0.261 1 1 598 . 9 1 1 A 108 108 LEU C C 108 174.321 175.115 -0.794 1 1 599 . 9 1 1 A 108 108 LEU CA C 108 54.449 53.359 1.090 1 1 600 . 9 1 1 A 108 108 LEU CB C 108 44.754 44.763 -0.009 1 1 604 . 9 1 1 A 108 108 LEU N N 108 123.244 117.743 5.501 1 1 605 . 9 1 1 A 109 109 ASP H H 109 8.943 9.121 -0.178 1 1 606 . 9 1 1 A 109 109 ASP C C 109 176.248 174.844 1.404 1 1 607 . 9 1 1 A 109 109 ASP CA C 109 52.376 52.315 0.061 1 1 608 . 9 1 1 A 109 109 ASP CB C 109 42.764 44.798 -2.034 1 1 609 . 9 1 1 A 109 109 ASP N N 109 124.634 122.637 1.997 1 1 610 . 9 1 1 A 110 110 ILE H H 110 8.372 8.730 -0.358 1 1 614 . 9 1 1 A 110 110 ILE C C 110 173.735 174.247 -0.512 1 1 615 . 9 1 1 A 110 110 ILE CA C 110 59.129 59.271 -0.142 1 1 616 . 9 1 1 A 110 110 ILE CB C 110 39.402 40.602 -1.200 1 1 620 . 9 1 1 A 110 110 ILE N N 110 119.135 115.621 3.514 1 1 621 . 9 1 1 A 111 111 TYR H H 111 8.695 9.147 -0.452 1 1 622 . 9 1 1 A 111 111 TYR C C 111 172.838 174.581 -1.743 1 1 623 . 9 1 1 A 111 111 TYR CA C 111 56.182 56.588 -0.406 1 1 624 . 9 1 1 A 111 111 TYR CB C 111 41.489 43.019 -1.530 1 1 625 . 9 1 1 A 111 111 TYR N N 111 121.248 122.118 -0.870 1 1 626 . 9 1 1 A 112 112 THR H H 112 9.172 8.882 0.290 1 1 627 . 9 1 1 A 112 112 THR C C 112 173.850 172.621 1.229 1 1 628 . 9 1 1 A 112 112 THR CA C 112 58.246 60.301 -2.055 1 1 629 . 9 1 1 A 112 112 THR CB C 112 71.676 71.359 0.317 1 1 631 . 9 1 1 A 112 112 THR N N 112 110.671 116.182 -5.511 1 1 632 . 9 1 1 A 113 113 ARG H H 113 8.732 9.667 -0.935 1 1 633 . 9 1 1 A 113 113 ARG C C 113 175.037 174.695 0.342 1 1 634 . 9 1 1 A 113 113 ARG CA C 113 53.995 54.717 -0.722 1 1 635 . 9 1 1 A 113 113 ARG CB C 113 32.266 33.048 -0.782 1 1 638 . 9 1 1 A 113 113 ARG N N 113 120.642 126.718 -6.076 1 1 639 . 9 1 1 A 114 114 LEU H H 114 8.449 9.010 -0.561 1 1 646 . 9 1 1 A 114 114 LEU C C 114 175.812 175.912 -0.100 1 1 647 . 9 1 1 A 114 114 LEU CA C 114 53.335 53.576 -0.241 1 1 648 . 9 1 1 A 114 114 LEU CB C 114 45.182 44.685 0.497 1 1 652 . 9 1 1 A 114 114 LEU N N 114 119.078 124.175 -5.097 1 1 653 . 9 1 1 A 115 115 GLY H H 115 8.232 8.603 -0.371 1 1 654 . 9 1 1 A 115 115 GLY C C 115 171.343 172.357 -1.014 1 1 655 . 9 1 1 A 115 115 GLY CA C 115 46.217 46.144 0.073 1 1 656 . 9 1 1 A 115 115 GLY N N 115 108.966 112.474 -3.508 1 1 657 . 9 1 1 A 116 116 GLY H H 116 8.293 8.357 -0.064 1 1 658 . 9 1 1 A 116 116 GLY C C 116 169.856 172.608 -2.752 1 1 659 . 9 1 1 A 116 116 GLY CA C 116 44.084 44.619 -0.535 1 1 660 . 9 1 1 A 116 116 GLY N N 116 109.676 111.231 -1.555 1 1 661 . 9 1 1 A 117 117 MET H H 117 9.286 9.350 -0.064 1 1 662 . 9 1 1 A 117 117 MET C C 117 174.557 175.004 -0.447 1 1 663 . 9 1 1 A 117 117 MET CA C 117 53.258 53.362 -0.104 1 1 664 . 9 1 1 A 117 117 MET CB C 117 37.195 35.168 2.027 1 1 667 . 9 1 1 A 117 117 MET N N 117 120.425 117.032 3.393 1 1 668 . 9 1 1 A 118 118 VAL H H 118 9.062 8.814 0.248 1 1 675 . 9 1 1 A 118 118 VAL C C 118 173.993 174.629 -0.636 1 1 676 . 9 1 1 A 118 118 VAL CA C 118 59.883 60.635 -0.752 1 1 677 . 9 1 1 A 118 118 VAL CB C 118 31.782 34.905 -3.123 1 1 680 . 9 1 1 A 118 118 VAL N N 118 126.948 120.395 6.553 1 1 681 . 9 1 1 A 119 119 TRP H H 119 8.482 9.425 -0.943 1 1 682 . 9 1 1 A 119 119 TRP C C 119 174.608 173.972 0.636 1 1 683 . 9 1 1 A 119 119 TRP CA C 119 53.332 56.284 -2.952 1 1 684 . 9 1 1 A 119 119 TRP CB C 119 33.569 33.141 0.428 1 1 685 . 9 1 1 A 119 119 TRP N N 119 124.631 128.632 -4.001 1 1 686 . 9 1 1 A 120 120 ARG H H 120 9.113 9.537 -0.424 1 1 687 . 9 1 1 A 120 120 ARG C C 120 174.951 174.999 -0.048 1 1 688 . 9 1 1 A 120 120 ARG CA C 120 54.684 54.554 0.130 1 1 689 . 9 1 1 A 120 120 ARG CB C 120 33.424 32.952 0.472 1 1 690 . 9 1 1 A 120 120 ARG N N 120 117.899 128.042 -10.143 1 1 691 . 9 1 1 A 121 121 ALA H H 121 9.299 9.158 0.141 1 1 692 . 9 1 1 A 121 121 ALA C C 121 175.954 176.000 -0.046 1 1 693 . 9 1 1 A 121 121 ALA CA C 121 50.368 50.129 0.239 1 1 694 . 9 1 1 A 121 121 ALA CB C 121 21.141 21.548 -0.407 1 1 695 . 9 1 1 A 121 121 ALA N N 121 128.863 129.018 -0.155 1 1 696 . 9 1 1 A 122 122 ASP H H 122 8.488 9.010 -0.522 1 1 697 . 9 1 1 A 122 122 ASP C C 122 175.635 175.404 0.231 1 1 698 . 9 1 1 A 122 122 ASP CA C 122 53.891 52.950 0.941 1 1 699 . 9 1 1 A 122 122 ASP CB C 122 42.492 44.251 -1.759 1 1 700 . 9 1 1 A 122 122 ASP N N 122 121.721 123.022 -1.301 1 1 701 . 9 1 1 A 123 123 SER H H 123 8.466 8.836 -0.370 1 1 702 . 9 1 1 A 123 123 SER C C 123 174.325 173.157 1.168 1 1 703 . 9 1 1 A 123 123 SER CA C 123 57.325 57.032 0.293 1 1 704 . 9 1 1 A 123 123 SER CB C 123 63.988 65.482 -1.494 1 1 705 . 9 1 1 A 123 123 SER N N 123 117.374 117.803 -0.429 1 1 706 . 9 1 1 A 124 124 LYS H H 124 8.389 8.758 -0.369 1 1 707 . 9 1 1 A 124 124 LYS C C 124 176.840 176.261 0.579 1 1 708 . 9 1 1 A 124 124 LYS CA C 124 56.036 54.695 1.341 1 1 709 . 9 1 1 A 124 124 LYS CB C 124 32.397 36.782 -4.385 1 1 711 . 9 1 1 A 124 124 LYS N N 124 122.883 125.756 -2.873 1 1 712 . 9 1 1 A 125 125 GLY H H 125 8.281 8.272 0.009 1 1 713 . 9 1 1 A 125 125 GLY C C 125 173.592 171.621 1.971 1 1 714 . 9 1 1 A 125 125 GLY CA C 125 44.924 45.641 -0.717 1 1 715 . 9 1 1 A 125 125 GLY N N 125 109.541 109.174 0.367 1 1 716 . 9 1 1 A 126 126 ASN H H 126 8.185 8.618 -0.433 1 1 717 . 9 1 1 A 126 126 ASN C C 126 176.649 173.646 3.003 1 1 718 . 9 1 1 A 126 126 ASN CA C 126 52.763 52.373 0.390 1 1 719 . 9 1 1 A 126 126 ASN CB C 126 38.439 38.647 -0.208 1 1 720 . 9 1 1 A 126 126 ASN N N 126 119.019 118.651 0.368 1 1 721 . 9 1 1 A 127 127 TYR C C 127 176.913 173.599 3.314 1 1 722 . 9 1 1 A 127 127 TYR CA C 127 57.757 56.905 0.852 1 1 723 . 9 1 1 A 127 127 TYR CB C 127 37.703 40.428 -2.725 1 1 724 . 9 1 1 A 128 128 ALA H H 128 8.050 8.505 -0.455 1 1 728 . 9 1 1 A 128 128 ALA C C 128 177.756 177.157 0.599 1 1 729 . 9 1 1 A 128 128 ALA CA C 128 52.321 50.860 1.461 1 1 730 . 9 1 1 A 128 128 ALA CB C 128 18.273 23.611 -5.338 1 1 731 . 9 1 1 A 128 128 ALA N N 128 124.529 124.568 -0.039 1 1 732 . 9 1 1 A 129 129 SER H H 129 8.063 9.080 -1.017 1 1 733 . 9 1 1 A 129 129 SER C C 129 174.938 174.890 0.048 1 1 734 . 9 1 1 A 129 129 SER CA C 129 58.202 60.226 -2.024 1 1 735 . 9 1 1 A 129 129 SER CB C 129 62.974 64.099 -1.125 1 1 736 . 9 1 1 A 129 129 SER N N 129 114.374 113.723 0.651 1 1 737 . 9 1 1 A 130 130 THR H H 130 7.875 7.587 0.288 1 1 741 . 9 1 1 A 130 130 THR C C 130 175.198 175.385 -0.187 1 1 742 . 9 1 1 A 130 130 THR CA C 130 61.520 63.024 -1.504 1 1 743 . 9 1 1 A 130 130 THR CB C 130 69.312 71.139 -1.827 1 1 745 . 9 1 1 A 130 130 THR N N 130 113.608 112.997 0.611 1 1 746 . 9 1 1 A 131 131 GLY H H 131 8.219 7.973 0.246 1 1 747 . 9 1 1 A 131 131 GLY C C 131 173.979 174.406 -0.427 1 1 748 . 9 1 1 A 131 131 GLY CA C 131 44.991 46.610 -1.619 1 1 749 . 9 1 1 A 131 131 GLY N N 131 110.848 108.149 2.699 1 1 750 . 9 1 1 A 132 132 VAL H H 132 7.729 7.627 0.102 1 1 757 . 9 1 1 A 132 132 VAL C C 132 175.988 175.454 0.534 1 1 758 . 9 1 1 A 132 132 VAL CA C 132 61.643 60.480 1.163 1 1 759 . 9 1 1 A 132 132 VAL CB C 132 31.941 34.020 -2.079 1 1 762 . 9 1 1 A 132 132 VAL N N 132 118.932 115.278 3.654 1 1 763 . 9 1 1 A 133 133 SER H H 133 8.224 8.722 -0.498 1 1 764 . 9 1 1 A 133 133 SER C C 133 174.320 175.777 -1.457 1 1 765 . 9 1 1 A 133 133 SER CA C 133 57.756 58.525 -0.769 1 1 766 . 9 1 1 A 133 133 SER CB C 133 63.140 64.166 -1.026 1 1 767 . 9 1 1 A 133 133 SER N N 133 119.260 122.394 -3.134 1 1 768 . 9 1 1 A 134 134 ARG H H 134 8.199 8.755 -0.556 1 1 769 . 9 1 1 A 134 134 ARG C C 134 175.923 176.967 -1.044 1 1 770 . 9 1 1 A 134 134 ARG CA C 134 55.461 58.532 -3.071 1 1 771 . 9 1 1 A 134 134 ARG CB C 134 30.195 29.951 0.244 1 1 774 . 9 1 1 A 134 134 ARG N N 134 123.262 122.010 1.252 1 1 775 . 9 1 1 A 135 135 SER H H 135 8.256 7.763 0.493 1 1 776 . 9 1 1 A 135 135 SER C C 135 174.360 173.718 0.642 1 1 777 . 9 1 1 A 135 135 SER CA C 135 57.730 59.261 -1.531 1 1 778 . 9 1 1 A 135 135 SER CB C 135 63.275 63.927 -0.652 1 1 779 . 9 1 1 A 135 135 SER N N 135 117.155 116.306 0.849 1 1 780 . 9 1 1 A 136 136 GLU H H 136 8.374 8.692 -0.318 1 1 781 . 9 1 1 A 136 136 GLU C C 136 176.284 174.529 1.755 1 1 782 . 9 1 1 A 136 136 GLU CA C 136 56.082 54.450 1.632 1 1 783 . 9 1 1 A 136 136 GLU CB C 136 29.820 33.320 -3.500 1 1 785 . 9 1 1 A 136 136 GLU N N 136 122.812 124.607 -1.795 1 1 786 . 9 1 1 A 137 137 HIS H H 137 8.118 8.597 -0.479 1 1 787 . 9 1 1 A 137 137 HIS C C 137 173.529 174.436 -0.907 1 1 788 . 9 1 1 A 137 137 HIS CA C 137 54.793 55.050 -0.257 1 1 789 . 9 1 1 A 137 137 HIS CB C 137 30.191 31.942 -1.751 1 1 790 . 9 1 1 A 137 137 HIS N N 137 118.002 120.595 -2.593 1 1 791 . 9 1 1 A 138 138 ASP H H 138 8.572 8.818 -0.246 1 1 792 . 9 1 1 A 138 138 ASP C C 138 174.940 175.438 -0.498 1 1 793 . 9 1 1 A 138 138 ASP CA C 138 53.594 52.910 0.684 1 1 794 . 9 1 1 A 138 138 ASP CB C 138 42.165 44.493 -2.328 1 1 795 . 9 1 1 A 138 138 ASP N N 138 121.536 123.260 -1.724 1 1 796 . 9 1 1 A 139 139 THR H H 139 7.857 9.030 -1.173 1 1 797 . 9 1 1 A 139 139 THR C C 139 172.822 173.421 -0.599 1 1 798 . 9 1 1 A 139 139 THR CA C 139 59.197 60.706 -1.509 1 1 799 . 9 1 1 A 139 139 THR CB C 139 71.457 71.340 0.117 1 1 801 . 9 1 1 A 139 139 THR N N 139 113.598 112.794 0.804 1 1 802 . 9 1 1 A 140 140 GLY C C 140 169.622 172.213 -2.591 1 1 803 . 9 1 1 A 140 140 GLY CA C 140 44.287 45.552 -1.265 1 1 804 . 9 1 1 A 141 141 VAL H H 141 7.815 8.896 -1.081 1 1 811 . 9 1 1 A 141 141 VAL C C 141 176.038 173.619 2.419 1 1 812 . 9 1 1 A 141 141 VAL CA C 141 59.739 59.876 -0.137 1 1 813 . 9 1 1 A 141 141 VAL CB C 141 33.308 35.289 -1.981 1 1 816 . 9 1 1 A 141 141 VAL N N 141 116.224 124.309 -8.085 1 1 817 . 9 1 1 A 142 142 SER H H 142 9.284 8.823 0.461 1 1 818 . 9 1 1 A 142 142 SER C C 142 171.050 172.065 -1.015 1 1 819 . 9 1 1 A 142 142 SER CB C 142 67.608 66.637 0.971 1 1 820 . 9 1 1 A 142 142 SER N N 142 123.223 122.027 1.196 1 1 821 . 9 1 1 A 143 143 PRO C C 143 174.032 176.355 -2.323 1 1 822 . 9 1 1 A 143 143 PRO CA C 143 62.350 62.447 -0.097 1 1 823 . 9 1 1 A 143 143 PRO CB C 143 31.774 32.278 -0.504 1 1 825 . 9 1 1 A 144 144 VAL H H 144 7.785 8.596 -0.811 1 1 832 . 9 1 1 A 144 144 VAL C C 144 172.826 174.429 -1.603 1 1 833 . 9 1 1 A 144 144 VAL CA C 144 59.770 59.776 -0.006 1 1 834 . 9 1 1 A 144 144 VAL CB C 144 34.407 36.058 -1.651 1 1 837 . 9 1 1 A 144 144 VAL N N 144 120.214 117.358 2.856 1 1 838 . 9 1 1 A 145 145 PHE H H 145 8.623 8.632 -0.009 1 1 839 . 9 1 1 A 145 145 PHE C C 145 173.658 173.056 0.602 1 1 840 . 9 1 1 A 145 145 PHE CA C 145 54.942 55.464 -0.522 1 1 841 . 9 1 1 A 145 145 PHE CB C 145 42.692 42.243 0.449 1 1 842 . 9 1 1 A 145 145 PHE N N 145 123.914 119.320 4.594 1 1 843 . 9 1 1 A 146 146 ALA H H 146 8.886 9.007 -0.121 1 1 844 . 9 1 1 A 146 146 ALA C C 146 176.258 176.477 -0.219 1 1 845 . 9 1 1 A 146 146 ALA CA C 146 49.734 50.399 -0.665 1 1 846 . 9 1 1 A 146 146 ALA CB C 146 22.244 21.823 0.421 1 1 847 . 9 1 1 A 146 146 ALA N N 146 125.243 125.819 -0.576 1 1 848 . 9 1 1 A 147 147 GLY H H 147 8.470 8.557 -0.087 1 1 849 . 9 1 1 A 147 147 GLY C C 147 170.940 172.428 -1.488 1 1 850 . 9 1 1 A 147 147 GLY CA C 147 44.063 44.402 -0.339 1 1 851 . 9 1 1 A 147 147 GLY N N 147 106.669 108.600 -1.931 1 1 852 . 9 1 1 A 148 148 GLY H H 148 8.008 8.655 -0.647 1 1 853 . 9 1 1 A 148 148 GLY C C 148 170.181 172.780 -2.599 1 1 854 . 9 1 1 A 148 148 GLY CA C 148 45.736 45.623 0.113 1 1 855 . 9 1 1 A 148 148 GLY N N 148 109.475 109.822 -0.347 1 1 856 . 9 1 1 A 149 149 VAL H H 149 8.426 8.637 -0.211 1 1 863 . 9 1 1 A 149 149 VAL C C 149 174.157 173.500 0.657 1 1 864 . 9 1 1 A 149 149 VAL CA C 149 58.200 59.099 -0.899 1 1 865 . 9 1 1 A 149 149 VAL CB C 149 34.464 35.866 -1.402 1 1 868 . 9 1 1 A 149 149 VAL N N 149 112.651 116.549 -3.898 1 1 869 . 9 1 1 A 150 150 GLU H H 150 9.070 9.418 -0.348 1 1 870 . 9 1 1 A 150 150 GLU C C 150 173.892 175.173 -1.281 1 1 871 . 9 1 1 A 150 150 GLU CA C 150 54.617 54.972 -0.355 1 1 872 . 9 1 1 A 150 150 GLU CB C 150 32.911 33.415 -0.504 1 1 874 . 9 1 1 A 150 150 GLU N N 150 124.471 122.166 2.305 1 1 875 . 9 1 1 A 151 151 TRP H H 151 9.461 10.122 -0.661 1 1 877 . 9 1 1 A 151 151 TRP C C 151 174.370 175.844 -1.474 1 1 878 . 9 1 1 A 151 151 TRP CA C 151 54.113 55.994 -1.881 1 1 879 . 9 1 1 A 151 151 TRP CB C 151 31.688 32.073 -0.385 1 1 880 . 9 1 1 A 151 151 TRP N N 151 129.611 126.610 3.001 1 1 882 . 9 1 1 A 152 152 ALA H H 152 8.771 9.180 -0.409 1 1 883 . 9 1 1 A 152 152 ALA C C 152 175.079 176.877 -1.798 1 1 884 . 9 1 1 A 152 152 ALA CA C 152 51.417 52.207 -0.790 1 1 885 . 9 1 1 A 152 152 ALA CB C 152 17.209 19.176 -1.967 1 1 886 . 9 1 1 A 152 152 ALA N N 152 130.502 127.805 2.697 1 1 887 . 9 1 1 A 153 153 VAL H H 153 7.893 8.831 -0.938 1 1 894 . 9 1 1 A 153 153 VAL C C 153 176.612 176.651 -0.039 1 1 895 . 9 1 1 A 153 153 VAL CA C 153 63.600 63.951 -0.351 1 1 896 . 9 1 1 A 153 153 VAL CB C 153 31.280 32.834 -1.554 1 1 899 . 9 1 1 A 153 153 VAL N N 153 124.360 122.925 1.435 1 1 900 . 9 1 1 A 154 154 THR H H 154 7.950 7.809 0.141 1 1 904 . 9 1 1 A 154 154 THR C C 154 173.884 175.329 -1.445 1 1 905 . 9 1 1 A 154 154 THR CA C 154 58.655 63.581 -4.926 1 1 906 . 9 1 1 A 154 154 THR CB C 154 71.262 70.832 0.430 1 1 908 . 9 1 1 A 154 154 THR N N 154 109.176 114.312 -5.136 1 1 909 . 9 1 1 A 155 155 ARG H H 155 8.310 7.887 0.423 1 1 910 . 9 1 1 A 155 155 ARG C C 155 176.753 176.664 0.089 1 1 911 . 9 1 1 A 155 155 ARG CA C 155 58.456 57.068 1.388 1 1 912 . 9 1 1 A 155 155 ARG CB C 155 29.043 33.258 -4.215 1 1 915 . 9 1 1 A 155 155 ARG N N 155 116.576 116.376 0.200 1 1 916 . 9 1 1 A 156 156 ASP H H 156 7.783 8.920 -1.137 1 1 917 . 9 1 1 A 156 156 ASP C C 156 174.222 175.853 -1.631 1 1 918 . 9 1 1 A 156 156 ASP CA C 156 53.540 55.171 -1.631 1 1 919 . 9 1 1 A 156 156 ASP CB C 156 42.327 42.786 -0.459 1 1 920 . 9 1 1 A 156 156 ASP N N 156 112.950 117.163 -4.213 1 1 921 . 9 1 1 A 157 157 ILE H H 157 7.233 7.788 -0.555 1 1 925 . 9 1 1 A 157 157 ILE C C 157 174.178 174.625 -0.447 1 1 926 . 9 1 1 A 157 157 ILE CA C 157 59.350 60.398 -1.048 1 1 927 . 9 1 1 A 157 157 ILE CB C 157 38.969 39.571 -0.602 1 1 930 . 9 1 1 A 157 157 ILE N N 157 119.732 119.576 0.156 1 1 931 . 9 1 1 A 158 158 ALA H H 158 8.729 9.142 -0.413 1 1 932 . 9 1 1 A 158 158 ALA C C 158 176.567 174.869 1.698 1 1 933 . 9 1 1 A 158 158 ALA CA C 158 49.418 50.287 -0.869 1 1 934 . 9 1 1 A 158 158 ALA CB C 158 21.430 23.975 -2.545 1 1 935 . 9 1 1 A 158 158 ALA N N 158 128.564 129.261 -0.697 1 1 936 . 9 1 1 A 159 159 THR H H 159 8.972 8.938 0.034 1 1 940 . 9 1 1 A 159 159 THR C C 159 172.213 173.263 -1.050 1 1 941 . 9 1 1 A 159 159 THR CA C 159 59.504 59.797 -0.293 1 1 942 . 9 1 1 A 159 159 THR CB C 159 70.728 72.146 -1.418 1 1 944 . 9 1 1 A 159 159 THR N N 159 114.901 113.300 1.601 1 1 945 . 9 1 1 A 160 160 ARG H H 160 8.924 9.296 -0.372 1 1 946 . 9 1 1 A 160 160 ARG C C 160 174.097 173.905 0.192 1 1 947 . 9 1 1 A 160 160 ARG CA C 160 53.066 54.352 -1.286 1 1 948 . 9 1 1 A 160 160 ARG CB C 160 32.922 34.016 -1.094 1 1 951 . 9 1 1 A 160 160 ARG N N 160 121.507 125.775 -4.268 1 1 952 . 9 1 1 A 161 161 LEU H H 161 8.611 9.211 -0.600 1 1 959 . 9 1 1 A 161 161 LEU C C 161 174.389 175.055 -0.666 1 1 960 . 9 1 1 A 161 161 LEU CA C 161 53.355 53.501 -0.146 1 1 961 . 9 1 1 A 161 161 LEU CB C 161 44.360 45.922 -1.562 1 1 964 . 9 1 1 A 161 161 LEU N N 161 124.711 122.642 2.069 1 1 965 . 9 1 1 A 162 162 GLU H H 162 8.746 8.917 -0.171 1 1 966 . 9 1 1 A 162 162 GLU C C 162 173.376 175.446 -2.070 1 1 967 . 9 1 1 A 162 162 GLU CA C 162 53.904 54.809 -0.905 1 1 968 . 9 1 1 A 162 162 GLU CB C 162 33.773 32.787 0.986 1 1 970 . 9 1 1 A 162 162 GLU N N 162 122.300 126.303 -4.003 1 1 971 . 9 1 1 A 163 163 TYR H H 163 8.872 9.060 -0.188 1 1 972 . 9 1 1 A 163 163 TYR C C 163 173.425 175.926 -2.501 1 1 973 . 9 1 1 A 163 163 TYR CA C 163 56.192 55.440 0.752 1 1 974 . 9 1 1 A 163 163 TYR CB C 163 40.870 41.699 -0.829 1 1 975 . 9 1 1 A 163 163 TYR N N 163 124.618 119.756 4.862 1 1 976 . 9 1 1 A 171 171 ASP C C 171 175.753 175.834 -0.081 1 1 977 . 9 1 1 A 171 171 ASP CA C 171 53.517 55.523 -2.006 1 1 978 . 9 1 1 A 171 171 ASP CB C 171 41.353 42.728 -1.375 1 1 979 . 9 1 1 A 172 172 ALA H H 172 8.336 7.969 0.367 1 1 983 . 9 1 1 A 172 172 ALA C C 172 178.110 177.777 0.333 1 1 984 . 9 1 1 A 172 172 ALA CA C 172 52.190 51.685 0.505 1 1 985 . 9 1 1 A 172 172 ALA CB C 172 18.305 17.805 0.500 1 1 986 . 9 1 1 A 172 172 ALA N N 172 125.294 120.329 4.965 1 1 987 . 9 1 1 A 173 173 GLY H H 173 8.300 8.161 0.139 1 1 988 . 9 1 1 A 173 173 GLY C C 173 174.437 173.057 1.380 1 1 989 . 9 1 1 A 173 173 GLY CA C 173 45.083 46.087 -1.004 1 1 990 . 9 1 1 A 173 173 GLY N N 173 107.268 109.270 -2.002 1 1 991 . 9 1 1 A 174 174 THR H H 174 7.754 8.269 -0.515 1 1 992 . 9 1 1 A 174 174 THR C C 174 174.738 173.443 1.295 1 1 993 . 9 1 1 A 174 174 THR CA C 174 61.310 60.623 0.687 1 1 994 . 9 1 1 A 174 174 THR CB C 174 69.310 70.911 -1.601 1 1 996 . 9 1 1 A 174 174 THR N N 174 113.472 110.312 3.160 1 1 997 . 9 1 1 A 175 175 VAL H H 175 7.993 8.579 -0.586 1 1 1004 . 9 1 1 A 175 175 VAL C C 175 176.535 174.592 1.943 1 1 1005 . 9 1 1 A 175 175 VAL CA C 175 62.126 60.068 2.058 1 1 1006 . 9 1 1 A 175 175 VAL CB C 175 31.282 35.101 -3.819 1 1 1009 . 9 1 1 A 175 175 VAL N N 175 121.643 124.260 -2.617 1 1 1010 . 9 1 1 A 176 176 GLY H H 176 8.056 8.197 -0.141 1 1 1011 . 9 1 1 A 176 176 GLY C C 176 173.930 174.661 -0.731 1 1 1012 . 9 1 1 A 176 176 GLY CA C 176 44.983 46.230 -1.247 1 1 1013 . 9 1 1 A 176 176 GLY N N 176 110.460 113.706 -3.246 1 1 1014 . 9 1 1 A 177 177 THR H H 177 7.520 7.769 -0.249 1 1 1015 . 9 1 1 A 177 177 THR C C 177 173.574 173.829 -0.255 1 1 1016 . 9 1 1 A 177 177 THR CA C 177 60.609 62.338 -1.729 1 1 1017 . 9 1 1 A 177 177 THR CB C 177 69.506 70.576 -1.070 1 1 1019 . 9 1 1 A 177 177 THR N N 177 113.390 112.875 0.515 1 1 1020 . 9 1 1 A 178 178 ARG H H 178 8.261 7.669 0.592 1 1 1021 . 9 1 1 A 178 178 ARG C C 178 173.932 174.719 -0.787 1 1 1022 . 9 1 1 A 178 178 ARG CA C 178 53.683 52.480 1.203 1 1 1023 . 9 1 1 A 178 178 ARG CB C 178 29.224 31.416 -2.192 1 1 1026 . 9 1 1 A 178 178 ARG N N 178 123.906 122.789 1.117 1 1 1027 . 9 1 1 A 183 183 MET C C 183 174.053 175.216 -1.163 1 1 1028 . 9 1 1 A 183 183 MET CA C 183 53.700 53.844 -0.144 1 1 1029 . 9 1 1 A 183 183 MET CB C 183 35.908 33.307 2.601 1 1 1032 . 9 1 1 A 184 184 LEU H H 184 8.319 8.940 -0.621 1 1 1033 . 9 1 1 A 184 184 LEU C C 184 175.235 175.648 -0.413 1 1 1034 . 9 1 1 A 184 184 LEU CA C 184 53.120 53.595 -0.475 1 1 1035 . 9 1 1 A 184 184 LEU CB C 184 42.857 45.475 -2.618 1 1 1038 . 9 1 1 A 184 184 LEU N N 184 131.293 126.130 5.163 1 1 1039 . 9 1 1 A 185 185 SER H H 185 9.603 8.968 0.635 1 1 1040 . 9 1 1 A 185 185 SER C C 185 171.293 172.631 -1.338 1 1 1041 . 9 1 1 A 185 185 SER CA C 185 56.504 56.986 -0.482 1 1 1042 . 9 1 1 A 185 185 SER CB C 185 66.585 66.721 -0.136 1 1 1043 . 9 1 1 A 185 185 SER N N 185 119.338 118.330 1.008 1 1 1044 . 9 1 1 A 186 186 LEU H H 186 8.583 8.484 0.099 1 1 1051 . 9 1 1 A 186 186 LEU C C 186 175.328 176.528 -1.200 1 1 1052 . 9 1 1 A 186 186 LEU CA C 186 52.729 53.129 -0.400 1 1 1053 . 9 1 1 A 186 186 LEU CB C 186 44.996 45.123 -0.127 1 1 1056 . 9 1 1 A 186 186 LEU N N 186 122.719 123.102 -0.383 1 1 1057 . 9 1 1 A 187 187 GLY H H 187 9.287 8.446 0.841 1 1 1058 . 9 1 1 A 187 187 GLY C C 187 172.315 173.434 -1.119 1 1 1059 . 9 1 1 A 187 187 GLY CA C 187 43.502 45.189 -1.687 1 1 1060 . 9 1 1 A 187 187 GLY N N 187 110.265 110.431 -0.166 1 1 1061 . 9 1 1 A 188 188 VAL H H 188 8.825 8.639 0.186 1 1 1068 . 9 1 1 A 188 188 VAL C C 188 173.125 174.781 -1.656 1 1 1069 . 9 1 1 A 188 188 VAL CA C 188 59.739 59.321 0.418 1 1 1070 . 9 1 1 A 188 188 VAL CB C 188 34.532 35.036 -0.504 1 1 1073 . 9 1 1 A 188 188 VAL N N 188 119.161 116.228 2.933 1 1 1074 . 9 1 1 A 189 189 SER H H 189 9.051 9.185 -0.134 1 1 1075 . 9 1 1 A 189 189 SER C C 189 171.698 172.995 -1.297 1 1 1076 . 9 1 1 A 189 189 SER CA C 189 55.997 56.964 -0.967 1 1 1077 . 9 1 1 A 189 189 SER CB C 189 66.094 66.957 -0.863 1 1 1078 . 9 1 1 A 189 189 SER N N 189 117.810 118.531 -0.721 1 1 1079 . 9 1 1 A 190 190 TYR H H 190 9.145 9.086 0.059 1 1 1080 . 9 1 1 A 190 190 TYR C C 190 174.063 173.223 0.840 1 1 1081 . 9 1 1 A 190 190 TYR CA C 190 55.375 55.836 -0.461 1 1 1082 . 9 1 1 A 190 190 TYR CB C 190 41.183 41.401 -0.218 1 1 1083 . 9 1 1 A 190 190 TYR N N 190 123.690 117.760 5.930 1 1 1084 . 9 1 1 A 191 191 ARG H H 191 8.211 8.301 -0.090 1 1 1085 . 9 1 1 A 191 191 ARG C C 191 174.826 175.252 -0.426 1 1 1086 . 9 1 1 A 191 191 ARG CA C 191 54.464 55.555 -1.091 1 1 1087 . 9 1 1 A 191 191 ARG CB C 191 30.507 31.370 -0.863 1 1 1090 . 9 1 1 A 191 191 ARG N N 191 125.366 119.572 5.794 1 1 1091 . 9 1 1 A 192 192 PHE H H 192 8.496 9.509 -1.013 1 1 1092 . 9 1 1 A 192 192 PHE C C 192 176.384 174.116 2.268 1 1 1093 . 9 1 1 A 192 192 PHE CA C 192 57.179 56.280 0.899 1 1 1094 . 9 1 1 A 192 192 PHE CB C 192 39.430 42.754 -3.324 1 1 1095 . 9 1 1 A 192 192 PHE N N 192 121.586 122.113 -0.527 1 1 1096 . 9 1 1 A 193 193 GLY H H 193 8.643 7.347 1.296 1 1 1097 . 9 1 1 A 193 193 GLY C C 193 174.466 171.718 2.748 1 1 1098 . 9 1 1 A 193 193 GLY CA C 193 45.126 44.816 0.310 1 1 1099 . 9 1 1 A 193 193 GLY N N 193 109.499 108.803 0.696 1 1 1100 . 9 1 1 A 194 194 GLN H H 194 8.512 8.252 0.260 1 1 1101 . 9 1 1 A 194 194 GLN C C 194 176.201 175.356 0.845 1 1 1102 . 9 1 1 A 194 194 GLN CA C 194 55.433 54.400 1.033 1 1 1103 . 9 1 1 A 194 194 GLN CB C 194 28.729 31.214 -2.485 1 1 1105 . 9 1 1 A 194 194 GLN N N 194 119.448 119.581 -0.133 1 1 1106 . 9 1 1 A 195 195 GLU H H 195 8.530 8.631 -0.101 1 1 1107 . 9 1 1 A 195 195 GLU C C 195 176.151 177.117 -0.966 1 1 1108 . 9 1 1 A 195 195 GLU CA C 195 56.256 56.895 -0.639 1 1 1109 . 9 1 1 A 195 195 GLU CB C 195 29.486 29.791 -0.305 1 1 1111 . 9 1 1 A 195 195 GLU N N 195 121.959 119.767 2.192 1 1 1112 . 9 1 1 A 196 196 ASP H H 196 8.253 9.159 -0.906 1 1 1113 . 9 1 1 A 196 196 ASP C C 196 175.667 176.954 -1.287 1 1 1114 . 9 1 1 A 196 196 ASP CA C 196 53.981 56.595 -2.614 1 1 1115 . 9 1 1 A 196 196 ASP CB C 196 40.700 40.471 0.229 1 1 1116 . 9 1 1 A 196 196 ASP N N 196 121.819 124.441 -2.622 1 1 1117 . 9 1 1 A 197 197 ALA H H 197 7.999 7.707 0.292 1 1 1121 . 9 1 1 A 197 197 ALA C C 197 176.847 176.102 0.745 1 1 1122 . 9 1 1 A 197 197 ALA CA C 197 51.612 51.615 -0.003 1 1 1123 . 9 1 1 A 197 197 ALA CB C 197 18.192 18.622 -0.430 1 1 1124 . 9 1 1 A 197 197 ALA N N 197 124.262 118.866 5.396 1 1 1125 . 9 1 1 A 198 198 ALA H H 198 8.042 7.670 0.372 1 1 1126 . 9 1 1 A 198 198 ALA C C 198 176.865 174.898 1.967 1 1 1127 . 9 1 1 A 198 198 ALA CA C 198 49.999 49.405 0.594 1 1 1128 . 9 1 1 A 198 198 ALA CB C 198 17.327 19.441 -2.114 1 1 1129 . 9 1 1 A 198 198 ALA N N 198 124.724 122.795 1.929 1 1 1130 . 9 1 1 A 199 199 PRO C C 199 176.727 176.626 0.101 1 1 1131 . 9 1 1 A 199 199 PRO CA C 199 62.399 63.025 -0.626 1 1 1132 . 9 1 1 A 199 199 PRO CB C 199 30.949 32.492 -1.543 1 1 1135 . 9 1 1 A 200 200 VAL H H 200 8.026 8.646 -0.620 1 1 1142 . 9 1 1 A 200 200 VAL C C 200 176.034 175.721 0.313 1 1 1143 . 9 1 1 A 200 200 VAL CA C 200 61.944 63.033 -1.089 1 1 1144 . 9 1 1 A 200 200 VAL CB C 200 31.734 34.184 -2.450 1 1 1147 . 9 1 1 A 200 200 VAL N N 200 120.635 121.096 -0.461 1 1 1148 . 9 1 1 A 201 201 VAL H H 201 7.966 7.695 0.271 1 1 1155 . 9 1 1 A 201 201 VAL C C 201 175.128 175.002 0.126 1 1 1156 . 9 1 1 A 201 201 VAL CA C 201 61.249 60.766 0.483 1 1 1157 . 9 1 1 A 201 201 VAL CB C 201 31.917 32.405 -0.488 1 1 1160 . 9 1 1 A 201 201 VAL N N 201 124.053 117.043 7.010 1 1 1161 . 9 1 1 A 202 202 ALA H H 202 8.159 8.569 -0.410 1 1 1162 . 9 1 1 A 202 202 ALA C C 202 175.153 178.430 -3.277 1 1 1163 . 9 1 1 A 202 202 ALA CA C 202 49.742 56.042 -6.300 1 1 1164 . 9 1 1 A 202 202 ALA CB C 202 17.532 19.487 -1.955 1 1 1165 . 9 1 1 A 202 202 ALA N N 202 129.251 128.238 1.013 1 1 1166 . 9 1 1 A 203 203 PRO C C 203 176.273 175.526 0.747 1 1 1167 . 9 1 1 A 203 203 PRO CA C 203 62.324 62.741 -0.417 1 1 1168 . 9 1 1 A 203 203 PRO CB C 203 31.042 32.790 -1.748 1 1 1170 . 9 1 1 A 204 204 ALA H H 204 8.137 8.218 -0.081 1 1 1171 . 9 1 1 A 204 204 ALA C C 204 175.697 176.175 -0.478 1 1 1172 . 9 1 1 A 204 204 ALA CA C 204 49.865 49.032 0.833 1 1 1173 . 9 1 1 A 204 204 ALA CB C 204 17.364 20.455 -3.091 1 1 1174 . 9 1 1 A 204 204 ALA N N 204 125.510 122.844 2.666 1 1 1175 . 9 1 1 A 205 205 PRO C C 205 175.430 177.218 -1.788 1 1 1176 . 9 1 1 A 205 205 PRO CA C 205 62.511 62.626 -0.115 1 1 1177 . 9 1 1 A 205 205 PRO CB C 205 31.056 31.790 -0.734 1 1 1179 . 9 1 1 A 206 206 ALA H H 206 7.847 8.606 -0.759 1 1 1180 . 9 1 1 A 206 206 ALA C C 206 175.565 177.987 -2.422 1 1 1181 . 9 1 1 A 206 206 ALA CA C 206 49.487 56.052 -6.565 1 1 1182 . 9 1 1 A 206 206 ALA CB C 206 18.843 18.640 0.203 1 1 1183 . 9 1 1 A 206 206 ALA N N 206 123.663 127.398 -3.735 1 1 1184 . 9 1 1 A 207 207 PRO C C 207 174.397 174.773 -0.376 1 1 1185 . 9 1 1 A 207 207 PRO CA C 207 61.454 62.468 -1.014 1 1 1186 . 9 1 1 A 207 207 PRO CB C 207 31.929 29.139 2.790 1 1 1187 . 9 1 1 A 208 208 ALA H H 208 7.898 8.023 -0.125 1 1 1188 . 9 1 1 A 208 208 ALA C C 208 175.411 174.558 0.853 1 1 1189 . 9 1 1 A 208 208 ALA CA C 208 49.472 49.782 -0.310 1 1 1190 . 9 1 1 A 208 208 ALA CB C 208 19.082 22.149 -3.067 1 1 1191 . 9 1 1 A 208 208 ALA N N 208 127.450 124.043 3.407 1 1 1192 . 9 1 1 A 209 209 PRO C C 209 176.932 176.338 0.594 1 1 1193 . 9 1 1 A 209 209 PRO CA C 209 62.736 62.309 0.427 1 1 1194 . 9 1 1 A 209 209 PRO CB C 209 31.012 33.053 -2.041 1 1 1 . 10 1 1 A 2 2 ARG C C 2 175.857 173.721 2.136 1 1 2 . 10 1 1 A 2 2 ARG CA C 2 55.872 54.917 0.955 1 1 3 . 10 1 1 A 2 2 ARG CB C 2 29.983 33.127 -3.144 1 1 5 . 10 1 1 A 3 3 ILE H H 3 8.238 8.620 -0.382 1 1 9 . 10 1 1 A 3 3 ILE C C 3 175.763 174.420 1.343 1 1 10 . 10 1 1 A 3 3 ILE CA C 3 60.779 58.608 2.171 1 1 11 . 10 1 1 A 3 3 ILE CB C 3 37.664 42.234 -4.570 1 1 15 . 10 1 1 A 3 3 ILE N N 3 122.580 114.361 8.219 1 1 16 . 10 1 1 A 4 4 MET H H 4 8.261 8.884 -0.623 1 1 17 . 10 1 1 A 4 4 MET C C 4 175.660 174.713 0.947 1 1 18 . 10 1 1 A 4 4 MET CA C 4 54.893 54.336 0.557 1 1 19 . 10 1 1 A 4 4 MET CB C 4 32.060 33.019 -0.959 1 1 22 . 10 1 1 A 4 4 MET N N 4 123.988 122.592 1.396 1 1 23 . 10 1 1 A 5 5 LYS H H 5 8.041 7.354 0.687 1 1 24 . 10 1 1 A 5 5 LYS C C 5 175.850 176.367 -0.517 1 1 25 . 10 1 1 A 5 5 LYS CA C 5 56.081 54.381 1.700 1 1 26 . 10 1 1 A 5 5 LYS CB C 5 32.220 34.926 -2.706 1 1 29 . 10 1 1 A 5 5 LYS N N 5 122.015 121.625 0.390 1 1 30 . 10 1 1 A 6 6 ALA H H 6 8.042 8.602 -0.560 1 1 34 . 10 1 1 A 6 6 ALA C C 6 177.160 177.114 0.046 1 1 35 . 10 1 1 A 6 6 ALA CA C 6 52.109 53.822 -1.713 1 1 36 . 10 1 1 A 6 6 ALA CB C 6 18.637 19.966 -1.329 1 1 37 . 10 1 1 A 6 6 ALA N N 6 123.943 124.038 -0.095 1 1 38 . 10 1 1 A 7 7 ILE H H 7 7.916 7.579 0.337 1 1 42 . 10 1 1 A 7 7 ILE C C 7 175.611 174.726 0.885 1 1 43 . 10 1 1 A 7 7 ILE CA C 7 61.181 60.894 0.287 1 1 44 . 10 1 1 A 7 7 ILE CB C 7 37.910 39.303 -1.393 1 1 48 . 10 1 1 A 7 7 ILE N N 7 118.380 118.251 0.129 1 1 49 . 10 1 1 A 8 8 PHE H H 8 8.167 8.903 -0.736 1 1 50 . 10 1 1 A 8 8 PHE C C 8 175.363 175.367 -0.004 1 1 51 . 10 1 1 A 8 8 PHE CA C 8 57.286 57.013 0.273 1 1 52 . 10 1 1 A 8 8 PHE CB C 8 39.008 40.950 -1.942 1 1 53 . 10 1 1 A 8 8 PHE N N 8 121.971 128.656 -6.685 1 1 54 . 10 1 1 A 9 9 VAL H H 9 7.872 8.574 -0.702 1 1 61 . 10 1 1 A 9 9 VAL C C 9 175.405 175.672 -0.267 1 1 62 . 10 1 1 A 9 9 VAL CA C 9 61.662 61.768 -0.106 1 1 63 . 10 1 1 A 9 9 VAL CB C 9 32.026 31.724 0.302 1 1 66 . 10 1 1 A 9 9 VAL N N 9 120.864 121.545 -0.681 1 1 67 . 10 1 1 A 10 10 LEU H H 10 8.077 8.941 -0.864 1 1 74 . 10 1 1 A 10 10 LEU C C 10 176.652 176.327 0.325 1 1 75 . 10 1 1 A 10 10 LEU CA C 10 54.856 53.423 1.433 1 1 76 . 10 1 1 A 10 10 LEU CB C 10 41.401 42.163 -0.762 1 1 80 . 10 1 1 A 10 10 LEU N N 10 124.826 128.977 -4.151 1 1 81 . 10 1 1 A 11 11 ASN H H 11 8.177 8.318 -0.141 1 1 82 . 10 1 1 A 11 11 ASN C C 11 174.394 174.640 -0.246 1 1 83 . 10 1 1 A 11 11 ASN CA C 11 52.704 53.193 -0.489 1 1 84 . 10 1 1 A 11 11 ASN CB C 11 38.468 37.806 0.662 1 1 85 . 10 1 1 A 11 11 ASN N N 11 119.029 119.100 -0.071 1 1 86 . 10 1 1 A 12 12 ALA H H 12 7.991 7.355 0.636 1 1 90 . 10 1 1 A 12 12 ALA C C 12 176.649 175.040 1.609 1 1 91 . 10 1 1 A 12 12 ALA CA C 12 51.950 51.403 0.547 1 1 92 . 10 1 1 A 12 12 ALA CB C 12 18.659 23.855 -5.196 1 1 93 . 10 1 1 A 12 12 ALA N N 12 123.695 121.129 2.566 1 1 94 . 10 1 1 A 13 13 ALA H H 13 8.083 8.741 -0.658 1 1 95 . 10 1 1 A 13 13 ALA C C 13 175.395 176.063 -0.668 1 1 96 . 10 1 1 A 13 13 ALA CA C 13 49.797 49.503 0.294 1 1 97 . 10 1 1 A 13 13 ALA CB C 13 17.486 19.767 -2.281 1 1 98 . 10 1 1 A 13 13 ALA N N 13 124.281 121.365 2.916 1 1 99 . 10 1 1 A 14 14 PRO C C 14 176.641 176.843 -0.202 1 1 100 . 10 1 1 A 14 14 PRO CA C 14 62.675 62.399 0.276 1 1 101 . 10 1 1 A 14 14 PRO CB C 14 31.000 29.050 1.950 1 1 103 . 10 1 1 A 15 15 LYS H H 15 8.283 9.207 -0.924 1 1 104 . 10 1 1 A 15 15 LYS C C 15 175.683 177.172 -1.489 1 1 105 . 10 1 1 A 15 15 LYS CA C 15 55.429 57.281 -1.852 1 1 106 . 10 1 1 A 15 15 LYS CB C 15 32.246 34.291 -2.045 1 1 109 . 10 1 1 A 15 15 LYS N N 15 119.069 122.525 -3.456 1 1 110 . 10 1 1 A 16 16 ASP H H 16 7.880 7.697 0.183 1 1 111 . 10 1 1 A 16 16 ASP C C 16 175.419 174.921 0.498 1 1 112 . 10 1 1 A 16 16 ASP CA C 16 54.413 53.632 0.781 1 1 113 . 10 1 1 A 16 16 ASP CB C 16 40.224 39.058 1.166 1 1 114 . 10 1 1 A 16 16 ASP N N 16 119.625 117.056 2.569 1 1 115 . 10 1 1 A 17 17 ASN H H 17 7.973 7.615 0.358 1 1 116 . 10 1 1 A 17 17 ASN C C 17 174.231 174.677 -0.446 1 1 117 . 10 1 1 A 17 17 ASN CA C 17 53.948 51.750 2.198 1 1 118 . 10 1 1 A 17 17 ASN CB C 17 37.009 41.368 -4.359 1 1 119 . 10 1 1 A 17 17 ASN N N 17 118.063 117.278 0.785 1 1 120 . 10 1 1 A 18 18 THR H H 18 7.318 8.632 -1.314 1 1 121 . 10 1 1 A 18 18 THR C C 18 172.323 173.266 -0.943 1 1 122 . 10 1 1 A 18 18 THR CA C 18 60.153 59.761 0.392 1 1 123 . 10 1 1 A 18 18 THR CB C 18 71.534 71.659 -0.125 1 1 125 . 10 1 1 A 18 18 THR N N 18 109.092 110.549 -1.457 1 1 126 . 10 1 1 A 19 19 TRP H H 19 8.541 9.053 -0.512 1 1 127 . 10 1 1 A 19 19 TRP C C 19 175.969 174.986 0.983 1 1 128 . 10 1 1 A 19 19 TRP CA C 19 55.700 56.084 -0.384 1 1 129 . 10 1 1 A 19 19 TRP CB C 19 31.471 33.245 -1.774 1 1 130 . 10 1 1 A 19 19 TRP N N 19 121.992 124.022 -2.030 1 1 131 . 10 1 1 A 20 20 TYR H H 20 8.691 9.398 -0.707 1 1 132 . 10 1 1 A 20 20 TYR C C 20 173.684 175.097 -1.413 1 1 133 . 10 1 1 A 20 20 TYR CA C 20 55.805 56.307 -0.502 1 1 134 . 10 1 1 A 20 20 TYR CB C 20 40.513 42.728 -2.215 1 1 135 . 10 1 1 A 20 20 TYR N N 20 116.519 121.323 -4.804 1 1 136 . 10 1 1 A 21 21 ALA H H 21 8.876 8.737 0.139 1 1 137 . 10 1 1 A 21 21 ALA C C 21 175.395 175.850 -0.455 1 1 138 . 10 1 1 A 21 21 ALA CA C 21 50.970 51.263 -0.293 1 1 139 . 10 1 1 A 21 21 ALA CB C 21 22.142 23.532 -1.390 1 1 140 . 10 1 1 A 21 21 ALA N N 21 119.359 123.103 -3.744 1 1 141 . 10 1 1 A 22 22 GLY H H 22 8.613 8.609 0.004 1 1 142 . 10 1 1 A 22 22 GLY C C 22 171.458 172.181 -0.723 1 1 143 . 10 1 1 A 22 22 GLY CA C 22 45.608 46.072 -0.464 1 1 144 . 10 1 1 A 22 22 GLY N N 22 106.678 106.349 0.329 1 1 145 . 10 1 1 A 23 23 GLY H H 23 7.911 8.407 -0.496 1 1 146 . 10 1 1 A 23 23 GLY C C 23 170.563 172.381 -1.818 1 1 147 . 10 1 1 A 23 23 GLY CA C 23 44.026 45.149 -1.123 1 1 148 . 10 1 1 A 23 23 GLY N N 23 103.399 109.065 -5.666 1 1 149 . 10 1 1 A 24 24 LYS H H 24 9.001 9.671 -0.670 1 1 150 . 10 1 1 A 24 24 LYS C C 24 172.965 174.243 -1.278 1 1 151 . 10 1 1 A 24 24 LYS CA C 24 54.062 54.318 -0.256 1 1 152 . 10 1 1 A 24 24 LYS CB C 24 36.774 36.490 0.284 1 1 156 . 10 1 1 A 24 24 LYS N N 24 116.402 119.139 -2.737 1 1 157 . 10 1 1 A 25 25 LEU H H 25 8.587 8.977 -0.390 1 1 164 . 10 1 1 A 25 25 LEU C C 25 175.205 175.578 -0.373 1 1 165 . 10 1 1 A 25 25 LEU CA C 25 53.446 53.669 -0.223 1 1 166 . 10 1 1 A 25 25 LEU CB C 25 46.287 46.679 -0.392 1 1 170 . 10 1 1 A 25 25 LEU N N 25 119.932 121.250 -1.318 1 1 171 . 10 1 1 A 26 26 GLY H H 26 8.637 8.183 0.454 1 1 172 . 10 1 1 A 26 26 GLY C C 26 170.804 171.581 -0.777 1 1 173 . 10 1 1 A 26 26 GLY CA C 26 45.669 46.045 -0.376 1 1 174 . 10 1 1 A 26 26 GLY N N 26 108.136 110.593 -2.457 1 1 175 . 10 1 1 A 27 27 TRP H H 27 8.642 8.491 0.151 1 1 177 . 10 1 1 A 27 27 TRP C C 27 174.820 176.421 -1.601 1 1 178 . 10 1 1 A 27 27 TRP CB C 27 30.883 30.410 0.473 1 1 179 . 10 1 1 A 27 27 TRP N N 27 120.887 121.438 -0.551 1 1 181 . 10 1 1 A 32 32 ASP C C 32 176.315 176.593 -0.278 1 1 182 . 10 1 1 A 32 32 ASP CA C 32 53.737 53.049 0.688 1 1 183 . 10 1 1 A 32 32 ASP CB C 32 41.230 44.111 -2.881 1 1 184 . 10 1 1 A 33 33 THR H H 33 8.190 8.778 -0.588 1 1 188 . 10 1 1 A 33 33 THR C C 33 175.291 175.742 -0.451 1 1 189 . 10 1 1 A 33 33 THR CA C 33 61.909 62.616 -0.707 1 1 190 . 10 1 1 A 33 33 THR CB C 33 68.961 69.620 -0.659 1 1 192 . 10 1 1 A 33 33 THR N N 33 114.235 115.916 -1.681 1 1 193 . 10 1 1 A 34 34 GLY H H 34 8.341 7.928 0.413 1 1 194 . 10 1 1 A 34 34 GLY C C 34 173.766 174.694 -0.928 1 1 195 . 10 1 1 A 34 34 GLY CA C 34 44.941 46.310 -1.369 1 1 196 . 10 1 1 A 34 34 GLY N N 34 110.678 110.115 0.563 1 1 197 . 10 1 1 A 35 35 PHE H H 35 7.945 8.142 -0.197 1 1 198 . 10 1 1 A 35 35 PHE C C 35 175.411 174.839 0.572 1 1 199 . 10 1 1 A 35 35 PHE CA C 35 57.921 59.796 -1.875 1 1 200 . 10 1 1 A 35 35 PHE CB C 35 38.806 40.755 -1.949 1 1 201 . 10 1 1 A 35 35 PHE N N 35 120.533 119.895 0.638 1 1 202 . 10 1 1 A 36 36 TYR H H 36 7.967 8.064 -0.097 1 1 203 . 10 1 1 A 36 36 TYR C C 36 176.104 175.013 1.091 1 1 204 . 10 1 1 A 36 36 TYR CA C 36 57.568 55.593 1.975 1 1 205 . 10 1 1 A 36 36 TYR CB C 36 37.727 38.637 -0.910 1 1 206 . 10 1 1 A 36 36 TYR N N 36 120.254 115.770 4.484 1 1 207 . 10 1 1 A 37 37 GLY H H 37 7.666 8.659 -0.993 1 1 208 . 10 1 1 A 37 37 GLY C C 37 173.794 172.060 1.734 1 1 209 . 10 1 1 A 37 37 GLY CA C 37 45.007 44.468 0.539 1 1 210 . 10 1 1 A 37 37 GLY N N 37 108.995 110.475 -1.480 1 1 211 . 10 1 1 A 38 38 ASN H H 38 8.109 8.804 -0.695 1 1 212 . 10 1 1 A 38 38 ASN C C 38 175.612 174.136 1.476 1 1 213 . 10 1 1 A 38 38 ASN CA C 38 52.954 51.356 1.598 1 1 214 . 10 1 1 A 38 38 ASN CB C 38 38.425 42.520 -4.095 1 1 215 . 10 1 1 A 38 38 ASN N N 38 118.603 119.308 -0.705 1 1 216 . 10 1 1 A 39 39 GLY H H 39 8.202 8.489 -0.287 1 1 217 . 10 1 1 A 39 39 GLY C C 39 173.958 172.636 1.322 1 1 218 . 10 1 1 A 39 39 GLY CA C 39 45.012 45.809 -0.797 1 1 219 . 10 1 1 A 39 39 GLY N N 39 108.897 109.373 -0.476 1 1 220 . 10 1 1 A 40 40 PHE H H 40 7.960 7.910 0.050 1 1 221 . 10 1 1 A 40 40 PHE C C 40 175.653 174.851 0.802 1 1 222 . 10 1 1 A 40 40 PHE CA C 40 57.556 56.742 0.814 1 1 223 . 10 1 1 A 40 40 PHE CB C 40 38.513 43.575 -5.062 1 1 224 . 10 1 1 A 40 40 PHE N N 40 119.829 118.414 1.415 1 1 225 . 10 1 1 A 41 41 GLN H H 41 8.173 8.760 -0.587 1 1 226 . 10 1 1 A 41 41 GLN C C 41 175.234 175.584 -0.350 1 1 227 . 10 1 1 A 41 41 GLN CA C 41 55.488 54.990 0.498 1 1 228 . 10 1 1 A 41 41 GLN CB C 41 28.523 27.845 0.678 1 1 230 . 10 1 1 A 41 41 GLN N N 41 120.810 121.818 -1.008 1 1 231 . 10 1 1 A 42 42 ASN H H 42 8.193 8.189 0.004 1 1 232 . 10 1 1 A 42 42 ASN C C 42 174.618 175.113 -0.495 1 1 233 . 10 1 1 A 42 42 ASN CA C 42 52.924 51.024 1.900 1 1 234 . 10 1 1 A 42 42 ASN CB C 42 38.333 40.110 -1.777 1 1 235 . 10 1 1 A 42 42 ASN N N 42 119.679 121.680 -2.001 1 1 236 . 10 1 1 A 43 43 ASN H H 43 8.255 8.590 -0.335 1 1 237 . 10 1 1 A 43 43 ASN C C 43 173.873 174.388 -0.515 1 1 238 . 10 1 1 A 43 43 ASN CA C 43 52.919 53.151 -0.232 1 1 239 . 10 1 1 A 43 43 ASN CB C 43 38.580 39.505 -0.925 1 1 240 . 10 1 1 A 43 43 ASN N N 43 119.773 118.238 1.535 1 1 241 . 10 1 1 A 44 44 ASN H H 44 7.865 8.750 -0.885 1 1 242 . 10 1 1 A 44 44 ASN C C 44 175.518 174.948 0.570 1 1 243 . 10 1 1 A 44 44 ASN CA C 44 54.528 51.662 2.866 1 1 244 . 10 1 1 A 44 44 ASN CB C 44 40.170 42.672 -2.502 1 1 246 . 10 1 1 A 44 44 ASN N N 44 124.152 122.835 1.317 1 1 247 . 10 1 1 A 46 46 PRO C C 46 177.228 176.024 1.204 1 1 248 . 10 1 1 A 46 46 PRO CA C 46 62.794 63.013 -0.219 1 1 249 . 10 1 1 A 46 46 PRO CB C 46 31.283 32.891 -1.608 1 1 251 . 10 1 1 A 47 47 THR H H 47 8.165 8.411 -0.246 1 1 255 . 10 1 1 A 47 47 THR C C 47 174.573 173.066 1.507 1 1 256 . 10 1 1 A 47 47 THR CA C 47 61.346 60.302 1.044 1 1 257 . 10 1 1 A 47 47 THR CB C 47 69.573 70.835 -1.262 1 1 259 . 10 1 1 A 47 47 THR N N 47 114.265 111.902 2.363 1 1 260 . 10 1 1 A 48 48 ARG H H 48 8.237 8.805 -0.568 1 1 261 . 10 1 1 A 48 48 ARG C C 48 175.898 175.586 0.312 1 1 262 . 10 1 1 A 48 48 ARG CA C 48 55.717 54.692 1.025 1 1 263 . 10 1 1 A 48 48 ARG CB C 48 30.151 31.206 -1.055 1 1 266 . 10 1 1 A 48 48 ARG N N 48 122.795 127.816 -5.021 1 1 267 . 10 1 1 A 49 49 ASN H H 49 8.369 8.611 -0.242 1 1 268 . 10 1 1 A 49 49 ASN C C 49 174.560 174.916 -0.356 1 1 269 . 10 1 1 A 49 49 ASN CA C 49 53.005 53.692 -0.687 1 1 270 . 10 1 1 A 49 49 ASN CB C 49 38.761 40.618 -1.857 1 1 271 . 10 1 1 A 49 49 ASN N N 49 119.837 125.028 -5.191 1 1 272 . 10 1 1 A 50 50 ASP H H 50 8.192 7.685 0.507 1 1 273 . 10 1 1 A 50 50 ASP C C 50 175.699 175.978 -0.279 1 1 274 . 10 1 1 A 50 50 ASP CA C 50 54.289 54.407 -0.118 1 1 275 . 10 1 1 A 50 50 ASP CB C 50 41.264 41.663 -0.399 1 1 276 . 10 1 1 A 50 50 ASP N N 50 120.403 119.062 1.341 1 1 277 . 10 1 1 A 51 51 GLN H H 51 8.428 9.112 -0.684 1 1 278 . 10 1 1 A 51 51 GLN C C 51 175.186 174.326 0.860 1 1 279 . 10 1 1 A 51 51 GLN CA C 51 54.512 54.586 -0.074 1 1 280 . 10 1 1 A 51 51 GLN CB C 51 30.424 32.327 -1.903 1 1 282 . 10 1 1 A 51 51 GLN N N 51 118.959 121.957 -2.998 1 1 289 . 10 1 1 A 52 52 LEU C C 52 176.018 176.056 -0.038 1 1 290 . 10 1 1 A 52 52 LEU CA C 52 54.332 53.370 0.962 1 1 291 . 10 1 1 A 52 52 LEU CB C 52 43.022 44.448 -1.426 1 1 294 . 10 1 1 A 53 53 GLY H H 53 8.639 8.669 -0.030 1 1 295 . 10 1 1 A 53 53 GLY C C 53 171.931 171.809 0.122 1 1 296 . 10 1 1 A 53 53 GLY CA C 53 43.501 44.457 -0.956 1 1 297 . 10 1 1 A 53 53 GLY N N 53 109.964 110.920 -0.956 1 1 298 . 10 1 1 A 54 54 ALA H H 54 8.881 8.830 0.051 1 1 299 . 10 1 1 A 54 54 ALA C C 54 175.543 176.343 -0.800 1 1 300 . 10 1 1 A 54 54 ALA CA C 54 50.710 50.337 0.373 1 1 301 . 10 1 1 A 54 54 ALA CB C 54 22.914 22.601 0.313 1 1 302 . 10 1 1 A 54 54 ALA N N 54 120.413 125.315 -4.902 1 1 303 . 10 1 1 A 55 55 GLY H H 55 8.346 9.006 -0.660 1 1 304 . 10 1 1 A 55 55 GLY C C 55 170.960 171.721 -0.761 1 1 305 . 10 1 1 A 55 55 GLY CA C 55 46.704 44.854 1.850 1 1 306 . 10 1 1 A 55 55 GLY N N 55 104.688 107.939 -3.251 1 1 307 . 10 1 1 A 56 56 ALA H H 56 9.116 8.985 0.131 1 1 308 . 10 1 1 A 56 56 ALA C C 56 176.472 176.812 -0.340 1 1 309 . 10 1 1 A 56 56 ALA CA C 56 49.638 50.985 -1.347 1 1 310 . 10 1 1 A 56 56 ALA CB C 56 22.275 21.384 0.891 1 1 311 . 10 1 1 A 56 56 ALA N N 56 120.608 124.834 -4.226 1 1 312 . 10 1 1 A 57 57 PHE H H 57 8.688 9.113 -0.425 1 1 313 . 10 1 1 A 57 57 PHE C C 57 172.816 175.980 -3.164 1 1 314 . 10 1 1 A 57 57 PHE CA C 57 56.066 56.202 -0.136 1 1 315 . 10 1 1 A 57 57 PHE CB C 57 41.770 42.390 -0.620 1 1 316 . 10 1 1 A 57 57 PHE N N 57 120.027 119.148 0.879 1 1 317 . 10 1 1 A 58 58 GLY H H 58 9.034 9.058 -0.024 1 1 318 . 10 1 1 A 58 58 GLY C C 58 170.860 173.010 -2.150 1 1 319 . 10 1 1 A 58 58 GLY CA C 58 44.954 45.656 -0.702 1 1 320 . 10 1 1 A 58 58 GLY N N 58 105.817 109.785 -3.968 1 1 321 . 10 1 1 A 59 59 GLY H H 59 8.382 8.755 -0.373 1 1 322 . 10 1 1 A 59 59 GLY C C 59 169.284 172.299 -3.015 1 1 323 . 10 1 1 A 59 59 GLY CA C 59 45.840 46.117 -0.277 1 1 324 . 10 1 1 A 59 59 GLY N N 59 109.059 110.021 -0.962 1 1 325 . 10 1 1 A 60 60 TYR H H 60 8.430 8.741 -0.311 1 1 326 . 10 1 1 A 60 60 TYR C C 60 173.453 172.021 1.432 1 1 327 . 10 1 1 A 60 60 TYR CA C 60 55.282 55.980 -0.698 1 1 328 . 10 1 1 A 60 60 TYR CB C 60 41.712 41.059 0.653 1 1 329 . 10 1 1 A 60 60 TYR N N 60 118.352 115.961 2.391 1 1 330 . 10 1 1 A 61 61 GLN H H 61 8.833 8.851 -0.018 1 1 331 . 10 1 1 A 61 61 GLN C C 61 174.365 174.787 -0.422 1 1 332 . 10 1 1 A 61 61 GLN CA C 61 54.125 54.529 -0.404 1 1 333 . 10 1 1 A 61 61 GLN CB C 61 28.033 31.797 -3.764 1 1 335 . 10 1 1 A 61 61 GLN N N 61 129.628 121.302 8.326 1 1 336 . 10 1 1 A 62 62 VAL H H 62 8.714 7.972 0.742 1 1 343 . 10 1 1 A 62 62 VAL C C 62 175.758 176.042 -0.284 1 1 344 . 10 1 1 A 62 62 VAL CA C 62 64.649 63.410 1.239 1 1 345 . 10 1 1 A 62 62 VAL CB C 62 31.900 33.741 -1.841 1 1 348 . 10 1 1 A 62 62 VAL N N 62 127.666 126.654 1.012 1 1 349 . 10 1 1 A 63 63 ASN H H 63 8.062 7.403 0.659 1 1 350 . 10 1 1 A 63 63 ASN C C 63 172.827 175.221 -2.394 1 1 351 . 10 1 1 A 63 63 ASN CA C 63 51.575 51.757 -0.182 1 1 352 . 10 1 1 A 63 63 ASN CB C 63 37.194 38.803 -1.609 1 1 353 . 10 1 1 A 63 63 ASN N N 63 116.310 119.406 -3.096 1 1 354 . 10 1 1 A 64 64 PRO C C 64 175.071 176.590 -1.519 1 1 355 . 10 1 1 A 64 64 PRO CA C 64 65.296 64.883 0.413 1 1 356 . 10 1 1 A 64 64 PRO CB C 64 30.428 31.820 -1.392 1 1 357 . 10 1 1 A 65 65 TYR H H 65 7.873 7.762 0.111 1 1 358 . 10 1 1 A 65 65 TYR C C 65 175.145 173.944 1.201 1 1 359 . 10 1 1 A 65 65 TYR CA C 65 56.125 57.282 -1.157 1 1 360 . 10 1 1 A 65 65 TYR CB C 65 39.189 39.052 0.137 1 1 361 . 10 1 1 A 65 65 TYR N N 65 112.894 116.176 -3.282 1 1 362 . 10 1 1 A 66 66 LEU H H 66 7.308 7.167 0.141 1 1 369 . 10 1 1 A 66 66 LEU C C 66 173.866 174.666 -0.800 1 1 370 . 10 1 1 A 66 66 LEU CA C 66 53.431 54.181 -0.750 1 1 371 . 10 1 1 A 66 66 LEU CB C 66 44.958 45.368 -0.410 1 1 375 . 10 1 1 A 66 66 LEU N N 66 120.270 123.727 -3.457 1 1 376 . 10 1 1 A 67 67 GLY H H 67 8.855 8.691 0.164 1 1 377 . 10 1 1 A 67 67 GLY C C 67 170.698 171.217 -0.519 1 1 378 . 10 1 1 A 67 67 GLY CA C 67 44.008 43.919 0.089 1 1 379 . 10 1 1 A 67 67 GLY N N 67 114.388 112.724 1.664 1 1 380 . 10 1 1 A 68 68 PHE H H 68 8.770 8.317 0.453 1 1 381 . 10 1 1 A 68 68 PHE C C 68 173.386 174.286 -0.900 1 1 382 . 10 1 1 A 68 68 PHE CA C 68 56.507 56.771 -0.264 1 1 383 . 10 1 1 A 68 68 PHE CB C 68 42.428 40.892 1.536 1 1 384 . 10 1 1 A 68 68 PHE N N 68 117.510 119.081 -1.571 1 1 385 . 10 1 1 A 69 69 GLU H H 69 9.079 9.473 -0.394 1 1 386 . 10 1 1 A 69 69 GLU C C 69 174.556 174.520 0.036 1 1 387 . 10 1 1 A 69 69 GLU CA C 69 54.939 54.860 0.079 1 1 388 . 10 1 1 A 69 69 GLU CB C 69 33.963 33.337 0.626 1 1 390 . 10 1 1 A 69 69 GLU N N 69 120.562 124.014 -3.452 1 1 391 . 10 1 1 A 70 70 MET H H 70 9.481 9.305 0.176 1 1 392 . 10 1 1 A 70 70 MET C C 70 174.595 175.488 -0.893 1 1 393 . 10 1 1 A 70 70 MET CA C 70 53.091 54.193 -1.102 1 1 394 . 10 1 1 A 70 70 MET CB C 70 36.159 35.587 0.572 1 1 397 . 10 1 1 A 70 70 MET N N 70 124.928 126.900 -1.972 1 1 398 . 10 1 1 A 71 71 GLY H H 71 8.845 8.929 -0.084 1 1 399 . 10 1 1 A 71 71 GLY C C 71 170.811 171.493 -0.682 1 1 400 . 10 1 1 A 71 71 GLY CA C 71 44.624 43.686 0.938 1 1 401 . 10 1 1 A 71 71 GLY N N 71 108.896 112.652 -3.756 1 1 402 . 10 1 1 A 72 72 TYR H H 72 8.925 8.771 0.154 1 1 403 . 10 1 1 A 72 72 TYR C C 72 173.278 174.767 -1.489 1 1 404 . 10 1 1 A 72 72 TYR CA C 72 55.912 56.320 -0.408 1 1 405 . 10 1 1 A 72 72 TYR CB C 72 41.611 41.222 0.389 1 1 406 . 10 1 1 A 72 72 TYR N N 72 123.253 119.988 3.265 1 1 407 . 10 1 1 A 73 73 ASP H H 73 8.665 9.274 -0.609 1 1 408 . 10 1 1 A 73 73 ASP C C 73 173.598 176.044 -2.446 1 1 409 . 10 1 1 A 73 73 ASP CA C 73 52.857 54.158 -1.301 1 1 410 . 10 1 1 A 73 73 ASP CB C 73 42.774 41.370 1.404 1 1 411 . 10 1 1 A 73 73 ASP N N 73 126.178 123.976 2.202 1 1 412 . 10 1 1 A 74 74 TRP H H 74 9.080 9.159 -0.079 1 1 413 . 10 1 1 A 74 74 TRP C C 74 174.868 176.199 -1.331 1 1 414 . 10 1 1 A 74 74 TRP CB C 74 30.083 32.239 -2.156 1 1 415 . 10 1 1 A 74 74 TRP N N 74 121.824 123.301 -1.477 1 1 416 . 10 1 1 A 78 78 MET C C 78 174.548 175.325 -0.777 1 1 417 . 10 1 1 A 78 78 MET CA C 78 54.388 54.250 0.138 1 1 418 . 10 1 1 A 78 78 MET CB C 78 32.542 32.749 -0.207 1 1 419 . 10 1 1 A 79 79 ALA H H 79 8.105 7.229 0.876 1 1 420 . 10 1 1 A 79 79 ALA C C 79 176.629 176.203 0.426 1 1 421 . 10 1 1 A 79 79 ALA CA C 79 51.210 51.454 -0.244 1 1 422 . 10 1 1 A 79 79 ALA CB C 79 19.106 20.810 -1.704 1 1 423 . 10 1 1 A 79 79 ALA N N 79 125.778 122.509 3.269 1 1 424 . 10 1 1 A 80 80 TYR H H 80 8.035 8.622 -0.587 1 1 425 . 10 1 1 A 80 80 TYR C C 80 175.604 175.707 -0.103 1 1 426 . 10 1 1 A 80 80 TYR CA C 80 57.021 56.946 0.075 1 1 427 . 10 1 1 A 80 80 TYR CB C 80 38.416 42.313 -3.897 1 1 428 . 10 1 1 A 80 80 TYR N N 80 120.045 117.626 2.419 1 1 429 . 10 1 1 A 81 81 LYS H H 81 8.295 9.028 -0.733 1 1 430 . 10 1 1 A 81 81 LYS C C 81 176.647 177.417 -0.770 1 1 431 . 10 1 1 A 81 81 LYS CA C 81 56.285 56.260 0.025 1 1 432 . 10 1 1 A 81 81 LYS CB C 81 31.571 32.801 -1.230 1 1 434 . 10 1 1 A 81 81 LYS N N 81 123.191 120.714 2.477 1 1 435 . 10 1 1 A 82 82 GLY H H 82 8.117 8.116 0.001 1 1 436 . 10 1 1 A 82 82 GLY C C 82 174.010 173.883 0.127 1 1 437 . 10 1 1 A 82 82 GLY CA C 82 44.982 45.495 -0.513 1 1 438 . 10 1 1 A 82 82 GLY N N 82 110.014 108.748 1.266 1 1 439 . 10 1 1 A 83 83 SER H H 83 7.938 7.786 0.152 1 1 440 . 10 1 1 A 83 83 SER C C 83 174.634 172.223 2.411 1 1 441 . 10 1 1 A 83 83 SER CA C 83 57.685 57.413 0.272 1 1 442 . 10 1 1 A 83 83 SER CB C 83 63.303 65.880 -2.577 1 1 443 . 10 1 1 A 83 83 SER N N 83 115.655 113.315 2.340 1 1 444 . 10 1 1 A 84 84 VAL H H 84 8.008 8.553 -0.545 1 1 451 . 10 1 1 A 84 84 VAL C C 84 175.525 174.305 1.220 1 1 452 . 10 1 1 A 84 84 VAL CA C 84 61.769 59.907 1.862 1 1 453 . 10 1 1 A 84 84 VAL CB C 84 31.711 34.776 -3.065 1 1 456 . 10 1 1 A 84 84 VAL N N 84 120.054 114.044 6.010 1 1 457 . 10 1 1 A 85 85 ASP H H 85 8.140 9.175 -1.035 1 1 458 . 10 1 1 A 85 85 ASP C C 85 174.740 176.950 -2.210 1 1 459 . 10 1 1 A 85 85 ASP CA C 85 53.983 54.736 -0.753 1 1 460 . 10 1 1 A 85 85 ASP CB C 85 40.633 42.665 -2.032 1 1 461 . 10 1 1 A 85 85 ASP N N 85 122.510 123.395 -0.885 1 1 462 . 10 1 1 A 86 86 ASN H H 86 7.736 8.333 -0.597 1 1 463 . 10 1 1 A 86 86 ASN C C 86 175.970 175.584 0.386 1 1 464 . 10 1 1 A 86 86 ASN CA C 86 54.349 52.269 2.080 1 1 465 . 10 1 1 A 86 86 ASN CB C 86 40.490 39.512 0.978 1 1 467 . 10 1 1 A 86 86 ASN N N 86 124.290 115.056 9.234 1 1 468 . 10 1 1 A 87 87 GLY H H 87 8.000 8.044 -0.044 1 1 469 . 10 1 1 A 87 87 GLY C C 87 173.456 174.516 -1.060 1 1 470 . 10 1 1 A 87 87 GLY CA C 87 44.973 46.148 -1.175 1 1 471 . 10 1 1 A 87 87 GLY N N 87 113.494 107.066 6.428 1 1 472 . 10 1 1 A 88 88 ALA H H 88 8.024 8.583 -0.559 1 1 473 . 10 1 1 A 88 88 ALA C C 88 176.833 176.796 0.037 1 1 474 . 10 1 1 A 88 88 ALA CA C 88 51.734 53.051 -1.317 1 1 475 . 10 1 1 A 88 88 ALA CB C 88 19.818 20.223 -0.405 1 1 476 . 10 1 1 A 88 88 ALA N N 88 122.676 128.034 -5.358 1 1 477 . 10 1 1 A 91 91 ALA C C 91 174.781 176.208 -1.427 1 1 478 . 10 1 1 A 91 91 ALA CA C 91 50.537 50.727 -0.190 1 1 479 . 10 1 1 A 91 91 ALA CB C 91 21.324 21.045 0.279 1 1 480 . 10 1 1 A 92 92 GLN H H 92 8.451 8.195 0.256 1 1 481 . 10 1 1 A 92 92 GLN C C 92 173.557 173.600 -0.043 1 1 482 . 10 1 1 A 92 92 GLN CA C 92 53.380 54.745 -1.365 1 1 484 . 10 1 1 A 92 92 GLN N N 92 116.847 121.340 -4.493 1 1 485 . 10 1 1 A 93 93 GLY C C 93 170.631 172.762 -2.131 1 1 486 . 10 1 1 A 93 93 GLY CA C 93 45.718 43.624 2.094 1 1 487 . 10 1 1 A 94 94 VAL H H 94 8.686 9.659 -0.973 1 1 494 . 10 1 1 A 94 94 VAL C C 94 173.698 174.247 -0.549 1 1 495 . 10 1 1 A 94 94 VAL CA C 94 58.997 60.105 -1.108 1 1 496 . 10 1 1 A 94 94 VAL CB C 94 33.311 34.205 -0.894 1 1 499 . 10 1 1 A 94 94 VAL N N 94 118.489 119.337 -0.848 1 1 500 . 10 1 1 A 95 95 GLN H H 95 9.468 9.442 0.026 1 1 501 . 10 1 1 A 95 95 GLN C C 95 174.028 174.302 -0.274 1 1 502 . 10 1 1 A 95 95 GLN CA C 95 52.547 54.479 -1.932 1 1 503 . 10 1 1 A 95 95 GLN CB C 95 33.816 31.529 2.287 1 1 505 . 10 1 1 A 95 95 GLN N N 95 122.106 125.532 -3.426 1 1 506 . 10 1 1 A 96 96 LEU H H 96 8.484 8.841 -0.357 1 1 513 . 10 1 1 A 96 96 LEU C C 96 175.322 174.886 0.436 1 1 514 . 10 1 1 A 96 96 LEU CA C 96 53.736 54.330 -0.594 1 1 515 . 10 1 1 A 96 96 LEU CB C 96 41.088 45.789 -4.701 1 1 519 . 10 1 1 A 96 96 LEU N N 96 123.224 125.212 -1.988 1 1 520 . 10 1 1 A 97 97 THR H H 97 9.116 8.975 0.141 1 1 521 . 10 1 1 A 97 97 THR C C 97 173.251 172.859 0.392 1 1 522 . 10 1 1 A 97 97 THR CA C 97 58.931 60.889 -1.958 1 1 523 . 10 1 1 A 97 97 THR CB C 97 72.984 70.803 2.181 1 1 525 . 10 1 1 A 97 97 THR N N 97 112.504 118.592 -6.088 1 1 526 . 10 1 1 A 98 98 ALA H H 98 8.603 8.684 -0.081 1 1 527 . 10 1 1 A 98 98 ALA C C 98 174.948 177.023 -2.075 1 1 528 . 10 1 1 A 98 98 ALA CA C 98 49.980 50.226 -0.246 1 1 529 . 10 1 1 A 98 98 ALA CB C 98 19.157 20.618 -1.461 1 1 530 . 10 1 1 A 98 98 ALA N N 98 121.608 126.562 -4.954 1 1 531 . 10 1 1 A 99 99 LYS H H 99 8.890 9.590 -0.700 1 1 532 . 10 1 1 A 99 99 LYS C C 99 174.294 175.652 -1.358 1 1 533 . 10 1 1 A 99 99 LYS CA C 99 54.019 54.751 -0.732 1 1 534 . 10 1 1 A 99 99 LYS CB C 99 33.018 35.228 -2.210 1 1 538 . 10 1 1 A 99 99 LYS N N 99 124.522 120.658 3.864 1 1 539 . 10 1 1 A 100 100 LEU H H 100 8.985 8.728 0.257 1 1 546 . 10 1 1 A 100 100 LEU C C 100 175.265 175.432 -0.167 1 1 547 . 10 1 1 A 100 100 LEU CA C 100 52.698 53.136 -0.438 1 1 548 . 10 1 1 A 100 100 LEU CB C 100 42.889 44.436 -1.547 1 1 552 . 10 1 1 A 100 100 LEU N N 100 131.876 121.931 9.945 1 1 553 . 10 1 1 A 101 101 GLY H H 101 9.137 8.083 1.054 1 1 554 . 10 1 1 A 101 101 GLY C C 101 170.798 171.644 -0.846 1 1 555 . 10 1 1 A 101 101 GLY CA C 101 44.429 45.880 -1.451 1 1 556 . 10 1 1 A 101 101 GLY N N 101 111.928 107.716 4.212 1 1 557 . 10 1 1 A 102 102 TYR H H 102 8.779 8.759 0.020 1 1 558 . 10 1 1 A 102 102 TYR C C 102 173.402 172.573 0.829 1 1 559 . 10 1 1 A 102 102 TYR CA C 102 54.444 56.014 -1.570 1 1 560 . 10 1 1 A 102 102 TYR CB C 102 42.239 39.280 2.959 1 1 561 . 10 1 1 A 102 102 TYR N N 102 116.664 116.065 0.599 1 1 562 . 10 1 1 A 103 103 PRO C C 103 175.676 175.570 0.106 1 1 563 . 10 1 1 A 103 103 PRO CA C 103 61.462 62.797 -1.335 1 1 564 . 10 1 1 A 103 103 PRO CB C 103 30.073 33.287 -3.214 1 1 565 . 10 1 1 A 104 104 ILE H H 104 8.670 9.190 -0.520 1 1 569 . 10 1 1 A 104 104 ILE C C 104 176.646 176.399 0.247 1 1 570 . 10 1 1 A 104 104 ILE CA C 104 62.054 60.811 1.243 1 1 571 . 10 1 1 A 104 104 ILE CB C 104 37.678 40.627 -2.949 1 1 574 . 10 1 1 A 104 104 ILE N N 104 125.939 120.691 5.248 1 1 575 . 10 1 1 A 105 105 THR H H 105 8.129 7.953 0.176 1 1 576 . 10 1 1 A 105 105 THR C C 105 174.344 174.271 0.073 1 1 577 . 10 1 1 A 105 105 THR CA C 105 59.176 63.381 -4.205 1 1 578 . 10 1 1 A 105 105 THR CB C 105 71.049 70.989 0.060 1 1 580 . 10 1 1 A 105 105 THR N N 105 109.853 114.036 -4.183 1 1 581 . 10 1 1 A 106 106 ASP H H 106 8.424 7.721 0.703 1 1 582 . 10 1 1 A 106 106 ASP C C 106 175.692 175.991 -0.299 1 1 583 . 10 1 1 A 106 106 ASP CA C 106 56.465 55.300 1.165 1 1 584 . 10 1 1 A 106 106 ASP CB C 106 40.032 43.438 -3.406 1 1 585 . 10 1 1 A 106 106 ASP N N 106 117.156 116.846 0.310 1 1 586 . 10 1 1 A 107 107 ASP H H 107 8.124 8.562 -0.438 1 1 587 . 10 1 1 A 107 107 ASP C C 107 174.174 174.749 -0.575 1 1 588 . 10 1 1 A 107 107 ASP CA C 107 52.907 53.722 -0.815 1 1 589 . 10 1 1 A 107 107 ASP CB C 107 41.661 42.041 -0.380 1 1 590 . 10 1 1 A 107 107 ASP N N 107 113.591 117.214 -3.623 1 1 591 . 10 1 1 A 108 108 LEU H H 108 7.336 7.422 -0.086 1 1 598 . 10 1 1 A 108 108 LEU C C 108 174.321 174.953 -0.632 1 1 599 . 10 1 1 A 108 108 LEU CA C 108 54.449 53.676 0.773 1 1 600 . 10 1 1 A 108 108 LEU CB C 108 44.754 44.843 -0.089 1 1 604 . 10 1 1 A 108 108 LEU N N 108 123.244 119.680 3.564 1 1 605 . 10 1 1 A 109 109 ASP H H 109 8.943 9.105 -0.162 1 1 606 . 10 1 1 A 109 109 ASP C C 109 176.248 175.259 0.989 1 1 607 . 10 1 1 A 109 109 ASP CA C 109 52.376 52.683 -0.307 1 1 608 . 10 1 1 A 109 109 ASP CB C 109 42.764 44.414 -1.650 1 1 609 . 10 1 1 A 109 109 ASP N N 109 124.634 122.859 1.775 1 1 610 . 10 1 1 A 110 110 ILE H H 110 8.372 8.556 -0.184 1 1 614 . 10 1 1 A 110 110 ILE C C 110 173.735 174.341 -0.606 1 1 615 . 10 1 1 A 110 110 ILE CA C 110 59.129 59.201 -0.072 1 1 616 . 10 1 1 A 110 110 ILE CB C 110 39.402 40.550 -1.148 1 1 620 . 10 1 1 A 110 110 ILE N N 110 119.135 116.718 2.417 1 1 621 . 10 1 1 A 111 111 TYR H H 111 8.695 8.711 -0.016 1 1 622 . 10 1 1 A 111 111 TYR C C 111 172.838 172.851 -0.013 1 1 623 . 10 1 1 A 111 111 TYR CA C 111 56.182 55.919 0.263 1 1 624 . 10 1 1 A 111 111 TYR CB C 111 41.489 41.676 -0.187 1 1 625 . 10 1 1 A 111 111 TYR N N 111 121.248 119.525 1.723 1 1 626 . 10 1 1 A 112 112 THR H H 112 9.172 8.963 0.209 1 1 627 . 10 1 1 A 112 112 THR C C 112 173.850 173.466 0.384 1 1 628 . 10 1 1 A 112 112 THR CA C 112 58.246 59.702 -1.456 1 1 629 . 10 1 1 A 112 112 THR CB C 112 71.676 71.784 -0.108 1 1 631 . 10 1 1 A 112 112 THR N N 112 110.671 112.422 -1.751 1 1 632 . 10 1 1 A 113 113 ARG H H 113 8.732 9.470 -0.738 1 1 633 . 10 1 1 A 113 113 ARG C C 113 175.037 174.629 0.408 1 1 634 . 10 1 1 A 113 113 ARG CA C 113 53.995 54.591 -0.596 1 1 635 . 10 1 1 A 113 113 ARG CB C 113 32.266 33.259 -0.993 1 1 638 . 10 1 1 A 113 113 ARG N N 113 120.642 120.789 -0.147 1 1 639 . 10 1 1 A 114 114 LEU H H 114 8.449 9.078 -0.629 1 1 646 . 10 1 1 A 114 114 LEU C C 114 175.812 175.971 -0.159 1 1 647 . 10 1 1 A 114 114 LEU CA C 114 53.335 53.643 -0.308 1 1 648 . 10 1 1 A 114 114 LEU CB C 114 45.182 44.837 0.345 1 1 652 . 10 1 1 A 114 114 LEU N N 114 119.078 124.282 -5.204 1 1 653 . 10 1 1 A 115 115 GLY H H 115 8.232 8.523 -0.291 1 1 654 . 10 1 1 A 115 115 GLY C C 115 171.343 172.423 -1.080 1 1 655 . 10 1 1 A 115 115 GLY CA C 115 46.217 46.204 0.013 1 1 656 . 10 1 1 A 115 115 GLY N N 115 108.966 112.520 -3.554 1 1 657 . 10 1 1 A 116 116 GLY H H 116 8.293 8.447 -0.154 1 1 658 . 10 1 1 A 116 116 GLY C C 116 169.856 172.445 -2.589 1 1 659 . 10 1 1 A 116 116 GLY CA C 116 44.084 45.595 -1.511 1 1 660 . 10 1 1 A 116 116 GLY N N 116 109.676 110.682 -1.006 1 1 661 . 10 1 1 A 117 117 MET H H 117 9.286 9.107 0.179 1 1 662 . 10 1 1 A 117 117 MET C C 117 174.557 175.056 -0.499 1 1 663 . 10 1 1 A 117 117 MET CA C 117 53.258 53.377 -0.119 1 1 664 . 10 1 1 A 117 117 MET CB C 117 37.195 35.535 1.660 1 1 667 . 10 1 1 A 117 117 MET N N 117 120.425 117.141 3.284 1 1 668 . 10 1 1 A 118 118 VAL H H 118 9.062 9.433 -0.371 1 1 675 . 10 1 1 A 118 118 VAL C C 118 173.993 175.368 -1.375 1 1 676 . 10 1 1 A 118 118 VAL CA C 118 59.883 61.241 -1.358 1 1 677 . 10 1 1 A 118 118 VAL CB C 118 31.782 34.742 -2.960 1 1 680 . 10 1 1 A 118 118 VAL N N 118 126.948 119.832 7.116 1 1 681 . 10 1 1 A 119 119 TRP H H 119 8.482 9.848 -1.366 1 1 682 . 10 1 1 A 119 119 TRP C C 119 174.608 175.861 -1.253 1 1 683 . 10 1 1 A 119 119 TRP CA C 119 53.332 56.356 -3.024 1 1 684 . 10 1 1 A 119 119 TRP CB C 119 33.569 31.819 1.750 1 1 685 . 10 1 1 A 119 119 TRP N N 119 124.631 128.961 -4.330 1 1 686 . 10 1 1 A 120 120 ARG H H 120 9.113 8.327 0.786 1 1 687 . 10 1 1 A 120 120 ARG C C 120 174.951 174.230 0.721 1 1 688 . 10 1 1 A 120 120 ARG CA C 120 54.684 54.351 0.333 1 1 689 . 10 1 1 A 120 120 ARG CB C 120 33.424 34.594 -1.170 1 1 690 . 10 1 1 A 120 120 ARG N N 120 117.899 120.685 -2.786 1 1 691 . 10 1 1 A 121 121 ALA H H 121 9.299 8.715 0.584 1 1 692 . 10 1 1 A 121 121 ALA C C 121 175.954 174.524 1.430 1 1 693 . 10 1 1 A 121 121 ALA CA C 121 50.368 49.868 0.500 1 1 694 . 10 1 1 A 121 121 ALA CB C 121 21.141 22.910 -1.769 1 1 695 . 10 1 1 A 121 121 ALA N N 121 128.863 122.874 5.989 1 1 696 . 10 1 1 A 122 122 ASP H H 122 8.488 8.528 -0.040 1 1 697 . 10 1 1 A 122 122 ASP C C 122 175.635 173.542 2.093 1 1 698 . 10 1 1 A 122 122 ASP CA C 122 53.891 52.632 1.259 1 1 699 . 10 1 1 A 122 122 ASP CB C 122 42.492 44.664 -2.172 1 1 700 . 10 1 1 A 122 122 ASP N N 122 121.721 121.874 -0.153 1 1 701 . 10 1 1 A 123 123 SER H H 123 8.466 8.810 -0.344 1 1 702 . 10 1 1 A 123 123 SER C C 123 174.325 173.125 1.200 1 1 703 . 10 1 1 A 123 123 SER CA C 123 57.325 56.295 1.030 1 1 704 . 10 1 1 A 123 123 SER CB C 123 63.988 65.206 -1.218 1 1 705 . 10 1 1 A 123 123 SER N N 123 117.374 119.543 -2.169 1 1 706 . 10 1 1 A 124 124 LYS H H 124 8.389 8.627 -0.238 1 1 707 . 10 1 1 A 124 124 LYS C C 124 176.840 177.256 -0.416 1 1 708 . 10 1 1 A 124 124 LYS CA C 124 56.036 56.773 -0.737 1 1 709 . 10 1 1 A 124 124 LYS CB C 124 32.397 34.419 -2.022 1 1 711 . 10 1 1 A 124 124 LYS N N 124 122.883 124.140 -1.257 1 1 712 . 10 1 1 A 125 125 GLY H H 125 8.281 8.259 0.022 1 1 713 . 10 1 1 A 125 125 GLY C C 125 173.592 174.024 -0.432 1 1 714 . 10 1 1 A 125 125 GLY CA C 125 44.924 46.699 -1.775 1 1 715 . 10 1 1 A 125 125 GLY N N 125 109.541 108.881 0.660 1 1 716 . 10 1 1 A 126 126 ASN H H 126 8.185 8.321 -0.136 1 1 717 . 10 1 1 A 126 126 ASN C C 126 176.649 173.867 2.782 1 1 718 . 10 1 1 A 126 126 ASN CA C 126 52.763 52.356 0.407 1 1 719 . 10 1 1 A 126 126 ASN CB C 126 38.439 39.538 -1.099 1 1 720 . 10 1 1 A 126 126 ASN N N 126 119.019 121.811 -2.792 1 1 721 . 10 1 1 A 127 127 TYR C C 127 176.913 173.936 2.977 1 1 722 . 10 1 1 A 127 127 TYR CA C 127 57.757 57.968 -0.211 1 1 723 . 10 1 1 A 127 127 TYR CB C 127 37.703 40.580 -2.877 1 1 724 . 10 1 1 A 128 128 ALA H H 128 8.050 8.415 -0.365 1 1 728 . 10 1 1 A 128 128 ALA C C 128 177.756 176.660 1.096 1 1 729 . 10 1 1 A 128 128 ALA CA C 128 52.321 52.379 -0.058 1 1 730 . 10 1 1 A 128 128 ALA CB C 128 18.273 18.617 -0.344 1 1 731 . 10 1 1 A 128 128 ALA N N 128 124.529 125.635 -1.106 1 1 732 . 10 1 1 A 129 129 SER H H 129 8.063 8.441 -0.378 1 1 733 . 10 1 1 A 129 129 SER C C 129 174.938 173.510 1.428 1 1 734 . 10 1 1 A 129 129 SER CA C 129 58.202 57.868 0.334 1 1 735 . 10 1 1 A 129 129 SER CB C 129 62.974 64.987 -2.013 1 1 736 . 10 1 1 A 129 129 SER N N 129 114.374 120.081 -5.707 1 1 737 . 10 1 1 A 130 130 THR H H 130 7.875 8.750 -0.875 1 1 741 . 10 1 1 A 130 130 THR C C 130 175.198 174.778 0.420 1 1 742 . 10 1 1 A 130 130 THR CA C 130 61.520 63.452 -1.932 1 1 743 . 10 1 1 A 130 130 THR CB C 130 69.312 71.220 -1.908 1 1 745 . 10 1 1 A 130 130 THR N N 130 113.608 120.423 -6.815 1 1 746 . 10 1 1 A 131 131 GLY H H 131 8.219 7.832 0.387 1 1 747 . 10 1 1 A 131 131 GLY C C 131 173.979 175.225 -1.246 1 1 748 . 10 1 1 A 131 131 GLY CA C 131 44.991 45.709 -0.718 1 1 749 . 10 1 1 A 131 131 GLY N N 131 110.848 108.366 2.482 1 1 750 . 10 1 1 A 132 132 VAL H H 132 7.729 8.561 -0.832 1 1 757 . 10 1 1 A 132 132 VAL C C 132 175.988 176.276 -0.288 1 1 758 . 10 1 1 A 132 132 VAL CA C 132 61.643 61.059 0.584 1 1 759 . 10 1 1 A 132 132 VAL CB C 132 31.941 31.630 0.311 1 1 762 . 10 1 1 A 132 132 VAL N N 132 118.932 120.984 -2.052 1 1 763 . 10 1 1 A 133 133 SER H H 133 8.224 8.480 -0.256 1 1 764 . 10 1 1 A 133 133 SER C C 133 174.320 172.888 1.432 1 1 765 . 10 1 1 A 133 133 SER CA C 133 57.756 59.638 -1.882 1 1 766 . 10 1 1 A 133 133 SER CB C 133 63.140 65.605 -2.465 1 1 767 . 10 1 1 A 133 133 SER N N 133 119.260 116.589 2.671 1 1 768 . 10 1 1 A 134 134 ARG H H 134 8.199 7.597 0.602 1 1 769 . 10 1 1 A 134 134 ARG C C 134 175.923 174.971 0.952 1 1 770 . 10 1 1 A 134 134 ARG CA C 134 55.461 54.714 0.747 1 1 771 . 10 1 1 A 134 134 ARG CB C 134 30.195 33.446 -3.251 1 1 774 . 10 1 1 A 134 134 ARG N N 134 123.262 119.810 3.452 1 1 775 . 10 1 1 A 135 135 SER H H 135 8.256 8.767 -0.511 1 1 776 . 10 1 1 A 135 135 SER C C 135 174.360 173.088 1.272 1 1 777 . 10 1 1 A 135 135 SER CA C 135 57.730 57.685 0.045 1 1 778 . 10 1 1 A 135 135 SER CB C 135 63.275 65.097 -1.822 1 1 779 . 10 1 1 A 135 135 SER N N 135 117.155 120.422 -3.267 1 1 780 . 10 1 1 A 136 136 GLU H H 136 8.374 9.019 -0.645 1 1 781 . 10 1 1 A 136 136 GLU C C 136 176.284 176.288 -0.004 1 1 782 . 10 1 1 A 136 136 GLU CA C 136 56.082 56.913 -0.831 1 1 783 . 10 1 1 A 136 136 GLU CB C 136 29.820 30.169 -0.349 1 1 785 . 10 1 1 A 136 136 GLU N N 136 122.812 127.398 -4.586 1 1 786 . 10 1 1 A 137 137 HIS H H 137 8.118 8.434 -0.316 1 1 787 . 10 1 1 A 137 137 HIS C C 137 173.529 173.838 -0.309 1 1 788 . 10 1 1 A 137 137 HIS CA C 137 54.793 53.084 1.709 1 1 789 . 10 1 1 A 137 137 HIS CB C 137 30.191 32.815 -2.624 1 1 790 . 10 1 1 A 137 137 HIS N N 137 118.002 122.743 -4.741 1 1 791 . 10 1 1 A 138 138 ASP H H 138 8.572 8.663 -0.091 1 1 792 . 10 1 1 A 138 138 ASP C C 138 174.940 175.055 -0.115 1 1 793 . 10 1 1 A 138 138 ASP CA C 138 53.594 54.437 -0.843 1 1 794 . 10 1 1 A 138 138 ASP CB C 138 42.165 41.796 0.369 1 1 795 . 10 1 1 A 138 138 ASP N N 138 121.536 118.675 2.861 1 1 796 . 10 1 1 A 139 139 THR H H 139 7.857 8.983 -1.126 1 1 797 . 10 1 1 A 139 139 THR C C 139 172.822 173.556 -0.734 1 1 798 . 10 1 1 A 139 139 THR CA C 139 59.197 60.860 -1.663 1 1 799 . 10 1 1 A 139 139 THR CB C 139 71.457 71.272 0.185 1 1 801 . 10 1 1 A 139 139 THR N N 139 113.598 120.276 -6.678 1 1 802 . 10 1 1 A 140 140 GLY C C 140 169.622 172.170 -2.548 1 1 803 . 10 1 1 A 140 140 GLY CA C 140 44.287 44.262 0.025 1 1 804 . 10 1 1 A 141 141 VAL H H 141 7.815 8.691 -0.876 1 1 811 . 10 1 1 A 141 141 VAL C C 141 176.038 173.576 2.462 1 1 812 . 10 1 1 A 141 141 VAL CA C 141 59.739 59.815 -0.076 1 1 813 . 10 1 1 A 141 141 VAL CB C 141 33.308 35.039 -1.731 1 1 816 . 10 1 1 A 141 141 VAL N N 141 116.224 122.446 -6.222 1 1 817 . 10 1 1 A 142 142 SER H H 142 9.284 8.928 0.356 1 1 818 . 10 1 1 A 142 142 SER C C 142 171.050 172.514 -1.464 1 1 819 . 10 1 1 A 142 142 SER CB C 142 67.608 66.337 1.271 1 1 820 . 10 1 1 A 142 142 SER N N 142 123.223 121.682 1.541 1 1 821 . 10 1 1 A 143 143 PRO C C 143 174.032 176.308 -2.276 1 1 822 . 10 1 1 A 143 143 PRO CA C 143 62.350 62.538 -0.188 1 1 823 . 10 1 1 A 143 143 PRO CB C 143 31.774 32.504 -0.730 1 1 825 . 10 1 1 A 144 144 VAL H H 144 7.785 8.609 -0.824 1 1 832 . 10 1 1 A 144 144 VAL C C 144 172.826 174.200 -1.374 1 1 833 . 10 1 1 A 144 144 VAL CA C 144 59.770 59.717 0.053 1 1 834 . 10 1 1 A 144 144 VAL CB C 144 34.407 35.952 -1.545 1 1 837 . 10 1 1 A 144 144 VAL N N 144 120.214 117.224 2.990 1 1 838 . 10 1 1 A 145 145 PHE H H 145 8.623 8.462 0.161 1 1 839 . 10 1 1 A 145 145 PHE C C 145 173.658 172.956 0.702 1 1 840 . 10 1 1 A 145 145 PHE CA C 145 54.942 56.088 -1.146 1 1 841 . 10 1 1 A 145 145 PHE CB C 145 42.692 42.572 0.120 1 1 842 . 10 1 1 A 145 145 PHE N N 145 123.914 119.223 4.691 1 1 843 . 10 1 1 A 146 146 ALA H H 146 8.886 8.884 0.002 1 1 844 . 10 1 1 A 146 146 ALA C C 146 176.258 175.461 0.797 1 1 845 . 10 1 1 A 146 146 ALA CA C 146 49.734 51.052 -1.318 1 1 846 . 10 1 1 A 146 146 ALA CB C 146 22.244 24.244 -2.000 1 1 847 . 10 1 1 A 146 146 ALA N N 146 125.243 122.431 2.812 1 1 848 . 10 1 1 A 147 147 GLY H H 147 8.470 8.557 -0.087 1 1 849 . 10 1 1 A 147 147 GLY C C 147 170.940 172.803 -1.863 1 1 850 . 10 1 1 A 147 147 GLY CA C 147 44.063 44.415 -0.352 1 1 851 . 10 1 1 A 147 147 GLY N N 147 106.669 105.548 1.121 1 1 852 . 10 1 1 A 148 148 GLY H H 148 8.008 8.323 -0.315 1 1 853 . 10 1 1 A 148 148 GLY C C 148 170.181 172.530 -2.349 1 1 854 . 10 1 1 A 148 148 GLY CA C 148 45.736 45.305 0.431 1 1 855 . 10 1 1 A 148 148 GLY N N 148 109.475 109.071 0.404 1 1 856 . 10 1 1 A 149 149 VAL H H 149 8.426 8.509 -0.083 1 1 863 . 10 1 1 A 149 149 VAL C C 149 174.157 173.437 0.720 1 1 864 . 10 1 1 A 149 149 VAL CA C 149 58.200 58.806 -0.606 1 1 865 . 10 1 1 A 149 149 VAL CB C 149 34.464 35.577 -1.113 1 1 868 . 10 1 1 A 149 149 VAL N N 149 112.651 115.739 -3.088 1 1 869 . 10 1 1 A 150 150 GLU H H 150 9.070 9.354 -0.284 1 1 870 . 10 1 1 A 150 150 GLU C C 150 173.892 174.331 -0.439 1 1 871 . 10 1 1 A 150 150 GLU CA C 150 54.617 54.857 -0.240 1 1 872 . 10 1 1 A 150 150 GLU CB C 150 32.911 33.512 -0.601 1 1 874 . 10 1 1 A 150 150 GLU N N 150 124.471 121.978 2.493 1 1 875 . 10 1 1 A 151 151 TRP H H 151 9.461 9.510 -0.049 1 1 877 . 10 1 1 A 151 151 TRP C C 151 174.370 174.716 -0.346 1 1 878 . 10 1 1 A 151 151 TRP CA C 151 54.113 55.326 -1.213 1 1 879 . 10 1 1 A 151 151 TRP CB C 151 31.688 32.697 -1.009 1 1 880 . 10 1 1 A 151 151 TRP N N 151 129.611 128.828 0.783 1 1 882 . 10 1 1 A 152 152 ALA H H 152 8.771 8.976 -0.205 1 1 883 . 10 1 1 A 152 152 ALA C C 152 175.079 177.053 -1.974 1 1 884 . 10 1 1 A 152 152 ALA CA C 152 51.417 52.352 -0.935 1 1 885 . 10 1 1 A 152 152 ALA CB C 152 17.209 19.316 -2.107 1 1 886 . 10 1 1 A 152 152 ALA N N 152 130.502 130.685 -0.183 1 1 887 . 10 1 1 A 153 153 VAL H H 153 7.893 8.488 -0.595 1 1 894 . 10 1 1 A 153 153 VAL C C 153 176.612 177.895 -1.283 1 1 895 . 10 1 1 A 153 153 VAL CA C 153 63.600 63.990 -0.390 1 1 896 . 10 1 1 A 153 153 VAL CB C 153 31.280 31.938 -0.658 1 1 899 . 10 1 1 A 153 153 VAL N N 153 124.360 122.869 1.491 1 1 900 . 10 1 1 A 154 154 THR H H 154 7.950 8.104 -0.154 1 1 904 . 10 1 1 A 154 154 THR C C 154 173.884 175.398 -1.514 1 1 905 . 10 1 1 A 154 154 THR CA C 154 58.655 64.442 -5.787 1 1 906 . 10 1 1 A 154 154 THR CB C 154 71.262 68.362 2.900 1 1 908 . 10 1 1 A 154 154 THR N N 154 109.176 111.283 -2.107 1 1 909 . 10 1 1 A 155 155 ARG H H 155 8.310 8.039 0.271 1 1 910 . 10 1 1 A 155 155 ARG C C 155 176.753 176.099 0.654 1 1 911 . 10 1 1 A 155 155 ARG CA C 155 58.456 57.020 1.436 1 1 912 . 10 1 1 A 155 155 ARG CB C 155 29.043 33.578 -4.535 1 1 915 . 10 1 1 A 155 155 ARG N N 155 116.576 119.155 -2.579 1 1 916 . 10 1 1 A 156 156 ASP H H 156 7.783 8.201 -0.418 1 1 917 . 10 1 1 A 156 156 ASP C C 156 174.222 175.434 -1.212 1 1 918 . 10 1 1 A 156 156 ASP CA C 156 53.540 54.231 -0.691 1 1 919 . 10 1 1 A 156 156 ASP CB C 156 42.327 42.314 0.013 1 1 920 . 10 1 1 A 156 156 ASP N N 156 112.950 117.863 -4.913 1 1 921 . 10 1 1 A 157 157 ILE H H 157 7.233 7.636 -0.403 1 1 925 . 10 1 1 A 157 157 ILE C C 157 174.178 174.666 -0.488 1 1 926 . 10 1 1 A 157 157 ILE CA C 157 59.350 60.464 -1.114 1 1 927 . 10 1 1 A 157 157 ILE CB C 157 38.969 39.225 -0.256 1 1 930 . 10 1 1 A 157 157 ILE N N 157 119.732 119.532 0.200 1 1 931 . 10 1 1 A 158 158 ALA H H 158 8.729 8.930 -0.201 1 1 932 . 10 1 1 A 158 158 ALA C C 158 176.567 175.019 1.548 1 1 933 . 10 1 1 A 158 158 ALA CA C 158 49.418 50.364 -0.946 1 1 934 . 10 1 1 A 158 158 ALA CB C 158 21.430 23.814 -2.384 1 1 935 . 10 1 1 A 158 158 ALA N N 158 128.564 128.876 -0.312 1 1 936 . 10 1 1 A 159 159 THR H H 159 8.972 8.842 0.130 1 1 940 . 10 1 1 A 159 159 THR C C 159 172.213 173.703 -1.490 1 1 941 . 10 1 1 A 159 159 THR CA C 159 59.504 60.570 -1.066 1 1 942 . 10 1 1 A 159 159 THR CB C 159 70.728 71.452 -0.724 1 1 944 . 10 1 1 A 159 159 THR N N 159 114.901 115.289 -0.388 1 1 945 . 10 1 1 A 160 160 ARG H H 160 8.924 9.314 -0.390 1 1 946 . 10 1 1 A 160 160 ARG C C 160 174.097 174.058 0.039 1 1 947 . 10 1 1 A 160 160 ARG CA C 160 53.066 54.453 -1.387 1 1 948 . 10 1 1 A 160 160 ARG CB C 160 32.922 33.911 -0.989 1 1 951 . 10 1 1 A 160 160 ARG N N 160 121.507 126.263 -4.756 1 1 952 . 10 1 1 A 161 161 LEU H H 161 8.611 9.051 -0.440 1 1 959 . 10 1 1 A 161 161 LEU C C 161 174.389 174.186 0.203 1 1 960 . 10 1 1 A 161 161 LEU CA C 161 53.355 53.529 -0.174 1 1 961 . 10 1 1 A 161 161 LEU CB C 161 44.360 45.656 -1.296 1 1 964 . 10 1 1 A 161 161 LEU N N 161 124.711 124.805 -0.094 1 1 965 . 10 1 1 A 162 162 GLU H H 162 8.746 8.902 -0.156 1 1 966 . 10 1 1 A 162 162 GLU C C 162 173.376 174.646 -1.270 1 1 967 . 10 1 1 A 162 162 GLU CA C 162 53.904 54.782 -0.878 1 1 968 . 10 1 1 A 162 162 GLU CB C 162 33.773 33.205 0.568 1 1 970 . 10 1 1 A 162 162 GLU N N 162 122.300 127.159 -4.859 1 1 971 . 10 1 1 A 163 163 TYR H H 163 8.872 9.513 -0.641 1 1 972 . 10 1 1 A 163 163 TYR C C 163 173.425 175.067 -1.642 1 1 973 . 10 1 1 A 163 163 TYR CA C 163 56.192 56.829 -0.637 1 1 974 . 10 1 1 A 163 163 TYR CB C 163 40.870 41.812 -0.942 1 1 975 . 10 1 1 A 163 163 TYR N N 163 124.618 127.308 -2.690 1 1 976 . 10 1 1 A 171 171 ASP C C 171 175.753 175.929 -0.176 1 1 977 . 10 1 1 A 171 171 ASP CA C 171 53.517 52.953 0.564 1 1 978 . 10 1 1 A 171 171 ASP CB C 171 41.353 41.877 -0.524 1 1 979 . 10 1 1 A 172 172 ALA H H 172 8.336 8.761 -0.425 1 1 983 . 10 1 1 A 172 172 ALA C C 172 178.110 178.373 -0.263 1 1 984 . 10 1 1 A 172 172 ALA CA C 172 52.190 54.670 -2.480 1 1 985 . 10 1 1 A 172 172 ALA CB C 172 18.305 19.971 -1.666 1 1 986 . 10 1 1 A 172 172 ALA N N 172 125.294 127.745 -2.451 1 1 987 . 10 1 1 A 173 173 GLY H H 173 8.300 7.448 0.852 1 1 988 . 10 1 1 A 173 173 GLY C C 173 174.437 173.357 1.080 1 1 989 . 10 1 1 A 173 173 GLY CA C 173 45.083 45.802 -0.719 1 1 990 . 10 1 1 A 173 173 GLY N N 173 107.268 102.938 4.330 1 1 991 . 10 1 1 A 174 174 THR H H 174 7.754 8.860 -1.106 1 1 992 . 10 1 1 A 174 174 THR C C 174 174.738 173.558 1.180 1 1 993 . 10 1 1 A 174 174 THR CA C 174 61.310 61.408 -0.098 1 1 994 . 10 1 1 A 174 174 THR CB C 174 69.310 69.121 0.189 1 1 996 . 10 1 1 A 174 174 THR N N 174 113.472 119.044 -5.572 1 1 997 . 10 1 1 A 175 175 VAL H H 175 7.993 7.456 0.537 1 1 1004 . 10 1 1 A 175 175 VAL C C 175 176.535 175.688 0.847 1 1 1005 . 10 1 1 A 175 175 VAL CA C 175 62.126 59.585 2.541 1 1 1006 . 10 1 1 A 175 175 VAL CB C 175 31.282 35.827 -4.545 1 1 1009 . 10 1 1 A 175 175 VAL N N 175 121.643 118.422 3.221 1 1 1010 . 10 1 1 A 176 176 GLY H H 176 8.056 8.544 -0.488 1 1 1011 . 10 1 1 A 176 176 GLY C C 176 173.930 174.414 -0.484 1 1 1012 . 10 1 1 A 176 176 GLY CA C 176 44.983 46.557 -1.574 1 1 1013 . 10 1 1 A 176 176 GLY N N 176 110.460 110.150 0.310 1 1 1014 . 10 1 1 A 177 177 THR H H 177 7.520 8.056 -0.536 1 1 1015 . 10 1 1 A 177 177 THR C C 177 173.574 174.851 -1.277 1 1 1016 . 10 1 1 A 177 177 THR CA C 177 60.609 59.645 0.964 1 1 1017 . 10 1 1 A 177 177 THR CB C 177 69.506 71.528 -2.022 1 1 1019 . 10 1 1 A 177 177 THR N N 177 113.390 111.675 1.715 1 1 1020 . 10 1 1 A 178 178 ARG H H 178 8.261 8.792 -0.531 1 1 1021 . 10 1 1 A 178 178 ARG C C 178 173.932 177.135 -3.203 1 1 1022 . 10 1 1 A 178 178 ARG CA C 178 53.683 60.594 -6.911 1 1 1023 . 10 1 1 A 178 178 ARG CB C 178 29.224 30.305 -1.081 1 1 1026 . 10 1 1 A 178 178 ARG N N 178 123.906 122.011 1.895 1 1 1027 . 10 1 1 A 183 183 MET C C 183 174.053 174.201 -0.148 1 1 1028 . 10 1 1 A 183 183 MET CA C 183 53.700 54.658 -0.958 1 1 1029 . 10 1 1 A 183 183 MET CB C 183 35.908 36.013 -0.105 1 1 1032 . 10 1 1 A 184 184 LEU H H 184 8.319 8.930 -0.611 1 1 1033 . 10 1 1 A 184 184 LEU C C 184 175.235 175.543 -0.308 1 1 1034 . 10 1 1 A 184 184 LEU CA C 184 53.120 53.202 -0.082 1 1 1035 . 10 1 1 A 184 184 LEU CB C 184 42.857 44.802 -1.945 1 1 1038 . 10 1 1 A 184 184 LEU N N 184 131.293 127.119 4.174 1 1 1039 . 10 1 1 A 185 185 SER H H 185 9.603 8.831 0.772 1 1 1040 . 10 1 1 A 185 185 SER C C 185 171.293 173.117 -1.824 1 1 1041 . 10 1 1 A 185 185 SER CA C 185 56.504 56.985 -0.481 1 1 1042 . 10 1 1 A 185 185 SER CB C 185 66.585 66.223 0.362 1 1 1043 . 10 1 1 A 185 185 SER N N 185 119.338 121.807 -2.469 1 1 1044 . 10 1 1 A 186 186 LEU H H 186 8.583 8.765 -0.182 1 1 1051 . 10 1 1 A 186 186 LEU C C 186 175.328 176.219 -0.891 1 1 1052 . 10 1 1 A 186 186 LEU CA C 186 52.729 53.035 -0.306 1 1 1053 . 10 1 1 A 186 186 LEU CB C 186 44.996 45.080 -0.084 1 1 1056 . 10 1 1 A 186 186 LEU N N 186 122.719 124.314 -1.595 1 1 1057 . 10 1 1 A 187 187 GLY H H 187 9.287 8.603 0.684 1 1 1058 . 10 1 1 A 187 187 GLY C C 187 172.315 173.486 -1.171 1 1 1059 . 10 1 1 A 187 187 GLY CA C 187 43.502 45.020 -1.518 1 1 1060 . 10 1 1 A 187 187 GLY N N 187 110.265 110.993 -0.728 1 1 1061 . 10 1 1 A 188 188 VAL H H 188 8.825 8.645 0.180 1 1 1068 . 10 1 1 A 188 188 VAL C C 188 173.125 174.792 -1.667 1 1 1069 . 10 1 1 A 188 188 VAL CA C 188 59.739 59.426 0.313 1 1 1070 . 10 1 1 A 188 188 VAL CB C 188 34.532 34.886 -0.354 1 1 1073 . 10 1 1 A 188 188 VAL N N 188 119.161 116.780 2.381 1 1 1074 . 10 1 1 A 189 189 SER H H 189 9.051 8.994 0.057 1 1 1075 . 10 1 1 A 189 189 SER C C 189 171.698 172.943 -1.245 1 1 1076 . 10 1 1 A 189 189 SER CA C 189 55.997 56.981 -0.984 1 1 1077 . 10 1 1 A 189 189 SER CB C 189 66.094 67.020 -0.926 1 1 1078 . 10 1 1 A 189 189 SER N N 189 117.810 118.586 -0.776 1 1 1079 . 10 1 1 A 190 190 TYR H H 190 9.145 9.055 0.090 1 1 1080 . 10 1 1 A 190 190 TYR C C 190 174.063 172.517 1.546 1 1 1081 . 10 1 1 A 190 190 TYR CA C 190 55.375 55.767 -0.392 1 1 1082 . 10 1 1 A 190 190 TYR CB C 190 41.183 41.592 -0.409 1 1 1083 . 10 1 1 A 190 190 TYR N N 190 123.690 118.085 5.605 1 1 1084 . 10 1 1 A 191 191 ARG H H 191 8.211 8.737 -0.526 1 1 1085 . 10 1 1 A 191 191 ARG C C 191 174.826 175.821 -0.995 1 1 1086 . 10 1 1 A 191 191 ARG CA C 191 54.464 54.264 0.200 1 1 1087 . 10 1 1 A 191 191 ARG CB C 191 30.507 32.277 -1.770 1 1 1090 . 10 1 1 A 191 191 ARG N N 191 125.366 120.809 4.557 1 1 1091 . 10 1 1 A 192 192 PHE H H 192 8.496 8.514 -0.018 1 1 1092 . 10 1 1 A 192 192 PHE C C 192 176.384 175.649 0.735 1 1 1093 . 10 1 1 A 192 192 PHE CA C 192 57.179 57.558 -0.379 1 1 1094 . 10 1 1 A 192 192 PHE CB C 192 39.430 40.304 -0.874 1 1 1095 . 10 1 1 A 192 192 PHE N N 192 121.586 124.047 -2.461 1 1 1096 . 10 1 1 A 193 193 GLY H H 193 8.643 8.511 0.132 1 1 1097 . 10 1 1 A 193 193 GLY C C 193 174.466 172.699 1.767 1 1 1098 . 10 1 1 A 193 193 GLY CA C 193 45.126 44.157 0.969 1 1 1099 . 10 1 1 A 193 193 GLY N N 193 109.499 110.028 -0.529 1 1 1100 . 10 1 1 A 194 194 GLN H H 194 8.512 8.418 0.094 1 1 1101 . 10 1 1 A 194 194 GLN C C 194 176.201 176.312 -0.111 1 1 1102 . 10 1 1 A 194 194 GLN CA C 194 55.433 55.182 0.251 1 1 1103 . 10 1 1 A 194 194 GLN CB C 194 28.729 30.747 -2.018 1 1 1105 . 10 1 1 A 194 194 GLN N N 194 119.448 119.618 -0.170 1 1 1106 . 10 1 1 A 195 195 GLU H H 195 8.530 8.818 -0.288 1 1 1107 . 10 1 1 A 195 195 GLU C C 195 176.151 176.444 -0.293 1 1 1108 . 10 1 1 A 195 195 GLU CA C 195 56.256 58.366 -2.110 1 1 1109 . 10 1 1 A 195 195 GLU CB C 195 29.486 30.765 -1.279 1 1 1111 . 10 1 1 A 195 195 GLU N N 195 121.959 123.320 -1.361 1 1 1112 . 10 1 1 A 196 196 ASP H H 196 8.253 7.900 0.353 1 1 1113 . 10 1 1 A 196 196 ASP C C 196 175.667 175.335 0.332 1 1 1114 . 10 1 1 A 196 196 ASP CA C 196 53.981 53.945 0.036 1 1 1115 . 10 1 1 A 196 196 ASP CB C 196 40.700 42.234 -1.534 1 1 1116 . 10 1 1 A 196 196 ASP N N 196 121.819 119.195 2.624 1 1 1117 . 10 1 1 A 197 197 ALA H H 197 7.999 8.825 -0.826 1 1 1121 . 10 1 1 A 197 197 ALA C C 197 176.847 176.113 0.734 1 1 1122 . 10 1 1 A 197 197 ALA CA C 197 51.612 50.171 1.441 1 1 1123 . 10 1 1 A 197 197 ALA CB C 197 18.192 22.889 -4.697 1 1 1124 . 10 1 1 A 197 197 ALA N N 197 124.262 125.572 -1.310 1 1 1125 . 10 1 1 A 198 198 ALA H H 198 8.042 8.661 -0.619 1 1 1126 . 10 1 1 A 198 198 ALA C C 198 176.865 174.694 2.171 1 1 1127 . 10 1 1 A 198 198 ALA CA C 198 49.999 50.209 -0.210 1 1 1128 . 10 1 1 A 198 198 ALA CB C 198 17.327 18.936 -1.609 1 1 1129 . 10 1 1 A 198 198 ALA N N 198 124.724 122.706 2.018 1 1 1130 . 10 1 1 A 199 199 PRO C C 199 176.727 175.969 0.758 1 1 1131 . 10 1 1 A 199 199 PRO CA C 199 62.399 62.470 -0.071 1 1 1132 . 10 1 1 A 199 199 PRO CB C 199 30.949 30.256 0.693 1 1 1135 . 10 1 1 A 200 200 VAL H H 200 8.026 8.183 -0.157 1 1 1142 . 10 1 1 A 200 200 VAL C C 200 176.034 174.590 1.444 1 1 1143 . 10 1 1 A 200 200 VAL CA C 200 61.944 61.137 0.807 1 1 1144 . 10 1 1 A 200 200 VAL CB C 200 31.734 31.497 0.237 1 1 1147 . 10 1 1 A 200 200 VAL N N 200 120.635 123.557 -2.922 1 1 1148 . 10 1 1 A 201 201 VAL H H 201 7.966 7.520 0.446 1 1 1155 . 10 1 1 A 201 201 VAL C C 201 175.128 175.725 -0.597 1 1 1156 . 10 1 1 A 201 201 VAL CA C 201 61.249 59.487 1.762 1 1 1157 . 10 1 1 A 201 201 VAL CB C 201 31.917 34.776 -2.859 1 1 1160 . 10 1 1 A 201 201 VAL N N 201 124.053 120.096 3.957 1 1 1161 . 10 1 1 A 202 202 ALA H H 202 8.159 8.706 -0.547 1 1 1162 . 10 1 1 A 202 202 ALA C C 202 175.153 177.908 -2.755 1 1 1163 . 10 1 1 A 202 202 ALA CA C 202 49.742 56.602 -6.860 1 1 1164 . 10 1 1 A 202 202 ALA CB C 202 17.532 17.910 -0.378 1 1 1165 . 10 1 1 A 202 202 ALA N N 202 129.251 125.327 3.924 1 1 1166 . 10 1 1 A 203 203 PRO C C 203 176.273 177.027 -0.754 1 1 1167 . 10 1 1 A 203 203 PRO CA C 203 62.324 62.790 -0.466 1 1 1168 . 10 1 1 A 203 203 PRO CB C 203 31.042 31.951 -0.909 1 1 1170 . 10 1 1 A 204 204 ALA H H 204 8.137 8.310 -0.173 1 1 1171 . 10 1 1 A 204 204 ALA C C 204 175.697 175.742 -0.045 1 1 1172 . 10 1 1 A 204 204 ALA CA C 204 49.865 50.468 -0.603 1 1 1173 . 10 1 1 A 204 204 ALA CB C 204 17.364 17.924 -0.560 1 1 1174 . 10 1 1 A 204 204 ALA N N 204 125.510 124.911 0.599 1 1 1175 . 10 1 1 A 205 205 PRO C C 205 175.430 176.225 -0.795 1 1 1176 . 10 1 1 A 205 205 PRO CA C 205 62.511 62.445 0.066 1 1 1177 . 10 1 1 A 205 205 PRO CB C 205 31.056 32.200 -1.144 1 1 1179 . 10 1 1 A 206 206 ALA H H 206 7.847 8.384 -0.537 1 1 1180 . 10 1 1 A 206 206 ALA C C 206 175.565 177.585 -2.020 1 1 1181 . 10 1 1 A 206 206 ALA CA C 206 49.487 50.304 -0.817 1 1 1182 . 10 1 1 A 206 206 ALA CB C 206 18.843 19.079 -0.236 1 1 1183 . 10 1 1 A 206 206 ALA N N 206 123.663 124.150 -0.487 1 1 1184 . 10 1 1 A 207 207 PRO C C 207 174.397 176.391 -1.994 1 1 1185 . 10 1 1 A 207 207 PRO CA C 207 61.454 65.830 -4.376 1 1 1186 . 10 1 1 A 207 207 PRO CB C 207 31.929 31.523 0.406 1 1 1187 . 10 1 1 A 208 208 ALA H H 208 7.898 7.709 0.189 1 1 1188 . 10 1 1 A 208 208 ALA C C 208 175.411 175.646 -0.235 1 1 1189 . 10 1 1 A 208 208 ALA CA C 208 49.472 50.021 -0.549 1 1 1190 . 10 1 1 A 208 208 ALA CB C 208 19.082 20.597 -1.515 1 1 1191 . 10 1 1 A 208 208 ALA N N 208 127.450 117.917 9.533 1 1 1192 . 10 1 1 A 209 209 PRO C C 209 176.932 175.190 1.742 1 1 1193 . 10 1 1 A 209 209 PRO CA C 209 62.736 62.640 0.096 1 1 1194 . 10 1 1 A 209 209 PRO CB C 209 31.012 33.358 -2.346 1 1 1 . 11 1 1 A 2 2 ARG C C 2 175.857 176.083 -0.226 1 1 2 . 11 1 1 A 2 2 ARG CA C 2 55.872 56.741 -0.869 1 1 3 . 11 1 1 A 2 2 ARG CB C 2 29.983 31.734 -1.751 1 1 5 . 11 1 1 A 3 3 ILE H H 3 8.238 7.437 0.801 1 1 9 . 11 1 1 A 3 3 ILE C C 3 175.763 173.496 2.267 1 1 10 . 11 1 1 A 3 3 ILE CA C 3 60.779 60.470 0.309 1 1 11 . 11 1 1 A 3 3 ILE CB C 3 37.664 41.229 -3.565 1 1 15 . 11 1 1 A 3 3 ILE N N 3 122.580 118.571 4.009 1 1 16 . 11 1 1 A 4 4 MET H H 4 8.261 8.676 -0.415 1 1 17 . 11 1 1 A 4 4 MET C C 4 175.660 175.080 0.580 1 1 18 . 11 1 1 A 4 4 MET CA C 4 54.893 54.073 0.820 1 1 19 . 11 1 1 A 4 4 MET CB C 4 32.060 35.666 -3.606 1 1 22 . 11 1 1 A 4 4 MET N N 4 123.988 125.268 -1.280 1 1 23 . 11 1 1 A 5 5 LYS H H 5 8.041 8.847 -0.806 1 1 24 . 11 1 1 A 5 5 LYS C C 5 175.850 176.666 -0.816 1 1 25 . 11 1 1 A 5 5 LYS CA C 5 56.081 56.770 -0.689 1 1 26 . 11 1 1 A 5 5 LYS CB C 5 32.220 35.419 -3.199 1 1 29 . 11 1 1 A 5 5 LYS N N 5 122.015 120.615 1.400 1 1 30 . 11 1 1 A 6 6 ALA H H 6 8.042 7.369 0.673 1 1 34 . 11 1 1 A 6 6 ALA C C 6 177.160 177.539 -0.379 1 1 35 . 11 1 1 A 6 6 ALA CA C 6 52.109 52.167 -0.058 1 1 36 . 11 1 1 A 6 6 ALA CB C 6 18.637 18.483 0.154 1 1 37 . 11 1 1 A 6 6 ALA N N 6 123.943 120.979 2.964 1 1 38 . 11 1 1 A 7 7 ILE H H 7 7.916 8.680 -0.764 1 1 42 . 11 1 1 A 7 7 ILE C C 7 175.611 175.984 -0.373 1 1 43 . 11 1 1 A 7 7 ILE CA C 7 61.181 63.624 -2.443 1 1 44 . 11 1 1 A 7 7 ILE CB C 7 37.910 38.650 -0.740 1 1 48 . 11 1 1 A 7 7 ILE N N 7 118.380 126.706 -8.326 1 1 49 . 11 1 1 A 8 8 PHE H H 8 8.167 7.513 0.654 1 1 50 . 11 1 1 A 8 8 PHE C C 8 175.363 174.547 0.816 1 1 51 . 11 1 1 A 8 8 PHE CA C 8 57.286 56.746 0.540 1 1 52 . 11 1 1 A 8 8 PHE CB C 8 39.008 42.378 -3.370 1 1 53 . 11 1 1 A 8 8 PHE N N 8 121.971 116.668 5.303 1 1 54 . 11 1 1 A 9 9 VAL H H 9 7.872 8.896 -1.024 1 1 61 . 11 1 1 A 9 9 VAL C C 9 175.405 175.205 0.200 1 1 62 . 11 1 1 A 9 9 VAL CA C 9 61.662 62.079 -0.417 1 1 63 . 11 1 1 A 9 9 VAL CB C 9 32.026 32.137 -0.111 1 1 66 . 11 1 1 A 9 9 VAL N N 9 120.864 121.065 -0.201 1 1 67 . 11 1 1 A 10 10 LEU H H 10 8.077 8.765 -0.688 1 1 74 . 11 1 1 A 10 10 LEU C C 10 176.652 176.101 0.551 1 1 75 . 11 1 1 A 10 10 LEU CA C 10 54.856 56.458 -1.602 1 1 76 . 11 1 1 A 10 10 LEU CB C 10 41.401 43.882 -2.481 1 1 80 . 11 1 1 A 10 10 LEU N N 10 124.826 126.366 -1.540 1 1 81 . 11 1 1 A 11 11 ASN H H 11 8.177 8.074 0.103 1 1 82 . 11 1 1 A 11 11 ASN C C 11 174.394 175.099 -0.705 1 1 83 . 11 1 1 A 11 11 ASN CA C 11 52.704 53.302 -0.598 1 1 84 . 11 1 1 A 11 11 ASN CB C 11 38.468 38.965 -0.497 1 1 85 . 11 1 1 A 11 11 ASN N N 11 119.029 118.349 0.680 1 1 86 . 11 1 1 A 12 12 ALA H H 12 7.991 8.705 -0.714 1 1 90 . 11 1 1 A 12 12 ALA C C 12 176.649 176.652 -0.003 1 1 91 . 11 1 1 A 12 12 ALA CA C 12 51.950 54.576 -2.626 1 1 92 . 11 1 1 A 12 12 ALA CB C 12 18.659 19.157 -0.498 1 1 93 . 11 1 1 A 12 12 ALA N N 12 123.695 125.950 -2.255 1 1 94 . 11 1 1 A 13 13 ALA H H 13 8.083 7.805 0.278 1 1 95 . 11 1 1 A 13 13 ALA C C 13 175.395 176.721 -1.326 1 1 96 . 11 1 1 A 13 13 ALA CA C 13 49.797 49.294 0.503 1 1 97 . 11 1 1 A 13 13 ALA CB C 13 17.486 20.199 -2.713 1 1 98 . 11 1 1 A 13 13 ALA N N 13 124.281 119.100 5.181 1 1 99 . 11 1 1 A 14 14 PRO C C 14 176.641 177.220 -0.579 1 1 100 . 11 1 1 A 14 14 PRO CA C 14 62.675 65.043 -2.368 1 1 101 . 11 1 1 A 14 14 PRO CB C 14 31.000 31.771 -0.771 1 1 103 . 11 1 1 A 15 15 LYS H H 15 8.283 8.442 -0.159 1 1 104 . 11 1 1 A 15 15 LYS C C 15 175.683 176.011 -0.328 1 1 105 . 11 1 1 A 15 15 LYS CA C 15 55.429 55.498 -0.069 1 1 106 . 11 1 1 A 15 15 LYS CB C 15 32.246 31.248 0.998 1 1 109 . 11 1 1 A 15 15 LYS N N 15 119.069 116.965 2.104 1 1 110 . 11 1 1 A 16 16 ASP H H 16 7.880 8.221 -0.341 1 1 111 . 11 1 1 A 16 16 ASP C C 16 175.419 176.533 -1.114 1 1 112 . 11 1 1 A 16 16 ASP CA C 16 54.413 56.652 -2.239 1 1 113 . 11 1 1 A 16 16 ASP CB C 16 40.224 40.662 -0.438 1 1 114 . 11 1 1 A 16 16 ASP N N 16 119.625 121.891 -2.266 1 1 115 . 11 1 1 A 17 17 ASN H H 17 7.973 7.999 -0.026 1 1 116 . 11 1 1 A 17 17 ASN C C 17 174.231 175.154 -0.923 1 1 117 . 11 1 1 A 17 17 ASN CA C 17 53.948 53.093 0.855 1 1 118 . 11 1 1 A 17 17 ASN CB C 17 37.009 39.927 -2.918 1 1 119 . 11 1 1 A 17 17 ASN N N 17 118.063 117.699 0.364 1 1 120 . 11 1 1 A 18 18 THR H H 18 7.318 8.643 -1.325 1 1 121 . 11 1 1 A 18 18 THR C C 18 172.323 174.229 -1.906 1 1 122 . 11 1 1 A 18 18 THR CA C 18 60.153 59.503 0.650 1 1 123 . 11 1 1 A 18 18 THR CB C 18 71.534 71.704 -0.170 1 1 125 . 11 1 1 A 18 18 THR N N 18 109.092 111.316 -2.224 1 1 126 . 11 1 1 A 19 19 TRP H H 19 8.541 7.929 0.612 1 1 127 . 11 1 1 A 19 19 TRP C C 19 175.969 173.167 2.802 1 1 128 . 11 1 1 A 19 19 TRP CA C 19 55.700 55.230 0.470 1 1 129 . 11 1 1 A 19 19 TRP CB C 19 31.471 32.506 -1.035 1 1 130 . 11 1 1 A 19 19 TRP N N 19 121.992 119.036 2.956 1 1 131 . 11 1 1 A 20 20 TYR H H 20 8.691 9.430 -0.739 1 1 132 . 11 1 1 A 20 20 TYR C C 20 173.684 175.519 -1.835 1 1 133 . 11 1 1 A 20 20 TYR CA C 20 55.805 56.145 -0.340 1 1 134 . 11 1 1 A 20 20 TYR CB C 20 40.513 41.471 -0.958 1 1 135 . 11 1 1 A 20 20 TYR N N 20 116.519 121.297 -4.778 1 1 136 . 11 1 1 A 21 21 ALA H H 21 8.876 8.970 -0.094 1 1 137 . 11 1 1 A 21 21 ALA C C 21 175.395 176.316 -0.921 1 1 138 . 11 1 1 A 21 21 ALA CA C 21 50.970 51.554 -0.584 1 1 139 . 11 1 1 A 21 21 ALA CB C 21 22.142 23.822 -1.680 1 1 140 . 11 1 1 A 21 21 ALA N N 21 119.359 123.288 -3.929 1 1 141 . 11 1 1 A 22 22 GLY H H 22 8.613 8.459 0.154 1 1 142 . 11 1 1 A 22 22 GLY C C 22 171.458 172.321 -0.863 1 1 143 . 11 1 1 A 22 22 GLY CA C 22 45.608 46.190 -0.582 1 1 144 . 11 1 1 A 22 22 GLY N N 22 106.678 106.586 0.092 1 1 145 . 11 1 1 A 23 23 GLY H H 23 7.911 8.544 -0.633 1 1 146 . 11 1 1 A 23 23 GLY C C 23 170.563 172.462 -1.899 1 1 147 . 11 1 1 A 23 23 GLY CA C 23 44.026 44.478 -0.452 1 1 148 . 11 1 1 A 23 23 GLY N N 23 103.399 108.853 -5.454 1 1 149 . 11 1 1 A 24 24 LYS H H 24 9.001 9.737 -0.736 1 1 150 . 11 1 1 A 24 24 LYS C C 24 172.965 174.248 -1.283 1 1 151 . 11 1 1 A 24 24 LYS CA C 24 54.062 54.242 -0.180 1 1 152 . 11 1 1 A 24 24 LYS CB C 24 36.774 36.484 0.290 1 1 156 . 11 1 1 A 24 24 LYS N N 24 116.402 120.715 -4.313 1 1 157 . 11 1 1 A 25 25 LEU H H 25 8.587 9.128 -0.541 1 1 164 . 11 1 1 A 25 25 LEU C C 25 175.205 175.421 -0.216 1 1 165 . 11 1 1 A 25 25 LEU CA C 25 53.446 53.194 0.252 1 1 166 . 11 1 1 A 25 25 LEU CB C 25 46.287 46.608 -0.321 1 1 170 . 11 1 1 A 25 25 LEU N N 25 119.932 121.982 -2.050 1 1 171 . 11 1 1 A 26 26 GLY H H 26 8.637 8.270 0.367 1 1 172 . 11 1 1 A 26 26 GLY C C 26 170.804 172.180 -1.376 1 1 173 . 11 1 1 A 26 26 GLY CA C 26 45.669 46.116 -0.447 1 1 174 . 11 1 1 A 26 26 GLY N N 26 108.136 109.932 -1.796 1 1 175 . 11 1 1 A 27 27 TRP H H 27 8.642 8.414 0.228 1 1 177 . 11 1 1 A 27 27 TRP C C 27 174.820 176.091 -1.271 1 1 178 . 11 1 1 A 27 27 TRP CB C 27 30.883 30.187 0.696 1 1 179 . 11 1 1 A 27 27 TRP N N 27 120.887 122.024 -1.137 1 1 181 . 11 1 1 A 32 32 ASP C C 32 176.315 175.344 0.971 1 1 182 . 11 1 1 A 32 32 ASP CA C 32 53.737 53.577 0.160 1 1 183 . 11 1 1 A 32 32 ASP CB C 32 41.230 39.529 1.701 1 1 184 . 11 1 1 A 33 33 THR H H 33 8.190 8.319 -0.129 1 1 188 . 11 1 1 A 33 33 THR C C 33 175.291 175.066 0.225 1 1 189 . 11 1 1 A 33 33 THR CA C 33 61.909 64.588 -2.679 1 1 190 . 11 1 1 A 33 33 THR CB C 33 68.961 68.804 0.157 1 1 192 . 11 1 1 A 33 33 THR N N 33 114.235 119.444 -5.209 1 1 193 . 11 1 1 A 34 34 GLY H H 34 8.341 8.423 -0.082 1 1 194 . 11 1 1 A 34 34 GLY C C 34 173.766 173.810 -0.044 1 1 195 . 11 1 1 A 34 34 GLY CA C 34 44.941 43.921 1.020 1 1 196 . 11 1 1 A 34 34 GLY N N 34 110.678 111.597 -0.919 1 1 197 . 11 1 1 A 35 35 PHE H H 35 7.945 7.595 0.350 1 1 198 . 11 1 1 A 35 35 PHE C C 35 175.411 175.634 -0.223 1 1 199 . 11 1 1 A 35 35 PHE CA C 35 57.921 57.393 0.528 1 1 200 . 11 1 1 A 35 35 PHE CB C 35 38.806 39.770 -0.964 1 1 201 . 11 1 1 A 35 35 PHE N N 35 120.533 119.531 1.002 1 1 202 . 11 1 1 A 36 36 TYR H H 36 7.967 8.372 -0.405 1 1 203 . 11 1 1 A 36 36 TYR C C 36 176.104 177.232 -1.128 1 1 204 . 11 1 1 A 36 36 TYR CA C 36 57.568 57.594 -0.026 1 1 205 . 11 1 1 A 36 36 TYR CB C 36 37.727 40.028 -2.301 1 1 206 . 11 1 1 A 36 36 TYR N N 36 120.254 119.387 0.867 1 1 207 . 11 1 1 A 37 37 GLY H H 37 7.666 7.043 0.623 1 1 208 . 11 1 1 A 37 37 GLY C C 37 173.794 173.956 -0.162 1 1 209 . 11 1 1 A 37 37 GLY CA C 37 45.007 45.956 -0.949 1 1 210 . 11 1 1 A 37 37 GLY N N 37 108.995 108.545 0.450 1 1 211 . 11 1 1 A 38 38 ASN H H 38 8.109 7.358 0.751 1 1 212 . 11 1 1 A 38 38 ASN C C 38 175.612 174.934 0.678 1 1 213 . 11 1 1 A 38 38 ASN CA C 38 52.954 53.115 -0.161 1 1 214 . 11 1 1 A 38 38 ASN CB C 38 38.425 38.539 -0.114 1 1 215 . 11 1 1 A 38 38 ASN N N 38 118.603 118.240 0.363 1 1 216 . 11 1 1 A 39 39 GLY H H 39 8.202 7.757 0.445 1 1 217 . 11 1 1 A 39 39 GLY C C 39 173.958 171.128 2.830 1 1 218 . 11 1 1 A 39 39 GLY CA C 39 45.012 45.125 -0.113 1 1 219 . 11 1 1 A 39 39 GLY N N 39 108.897 109.860 -0.963 1 1 220 . 11 1 1 A 40 40 PHE H H 40 7.960 8.296 -0.336 1 1 221 . 11 1 1 A 40 40 PHE C C 40 175.653 175.015 0.638 1 1 222 . 11 1 1 A 40 40 PHE CA C 40 57.556 56.485 1.071 1 1 223 . 11 1 1 A 40 40 PHE CB C 40 38.513 43.658 -5.145 1 1 224 . 11 1 1 A 40 40 PHE N N 40 119.829 119.090 0.739 1 1 225 . 11 1 1 A 41 41 GLN H H 41 8.173 8.703 -0.530 1 1 226 . 11 1 1 A 41 41 GLN C C 41 175.234 175.382 -0.148 1 1 227 . 11 1 1 A 41 41 GLN CA C 41 55.488 55.867 -0.379 1 1 228 . 11 1 1 A 41 41 GLN CB C 41 28.523 30.330 -1.807 1 1 230 . 11 1 1 A 41 41 GLN N N 41 120.810 120.303 0.507 1 1 231 . 11 1 1 A 42 42 ASN H H 42 8.193 8.831 -0.638 1 1 232 . 11 1 1 A 42 42 ASN C C 42 174.618 175.785 -1.167 1 1 233 . 11 1 1 A 42 42 ASN CA C 42 52.924 55.033 -2.109 1 1 234 . 11 1 1 A 42 42 ASN CB C 42 38.333 39.561 -1.228 1 1 235 . 11 1 1 A 42 42 ASN N N 42 119.679 123.949 -4.270 1 1 236 . 11 1 1 A 43 43 ASN H H 43 8.255 8.266 -0.011 1 1 237 . 11 1 1 A 43 43 ASN C C 43 173.873 173.674 0.199 1 1 238 . 11 1 1 A 43 43 ASN CA C 43 52.919 52.365 0.554 1 1 239 . 11 1 1 A 43 43 ASN CB C 43 38.580 39.990 -1.410 1 1 240 . 11 1 1 A 43 43 ASN N N 43 119.773 115.700 4.073 1 1 241 . 11 1 1 A 44 44 ASN H H 44 7.865 9.041 -1.176 1 1 242 . 11 1 1 A 44 44 ASN C C 44 175.518 174.873 0.645 1 1 243 . 11 1 1 A 44 44 ASN CA C 44 54.528 51.683 2.845 1 1 244 . 11 1 1 A 44 44 ASN CB C 44 40.170 41.745 -1.575 1 1 246 . 11 1 1 A 44 44 ASN N N 44 124.152 123.651 0.501 1 1 247 . 11 1 1 A 46 46 PRO C C 46 177.228 177.226 0.002 1 1 248 . 11 1 1 A 46 46 PRO CA C 46 62.794 63.151 -0.357 1 1 249 . 11 1 1 A 46 46 PRO CB C 46 31.283 31.665 -0.382 1 1 251 . 11 1 1 A 47 47 THR H H 47 8.165 8.572 -0.407 1 1 255 . 11 1 1 A 47 47 THR C C 47 174.573 174.858 -0.285 1 1 256 . 11 1 1 A 47 47 THR CA C 47 61.346 63.129 -1.783 1 1 257 . 11 1 1 A 47 47 THR CB C 47 69.573 69.523 0.050 1 1 259 . 11 1 1 A 47 47 THR N N 47 114.265 115.431 -1.166 1 1 260 . 11 1 1 A 48 48 ARG H H 48 8.237 7.837 0.400 1 1 261 . 11 1 1 A 48 48 ARG C C 48 175.898 174.785 1.113 1 1 262 . 11 1 1 A 48 48 ARG CA C 48 55.717 54.995 0.722 1 1 263 . 11 1 1 A 48 48 ARG CB C 48 30.151 30.861 -0.710 1 1 266 . 11 1 1 A 48 48 ARG N N 48 122.795 119.880 2.915 1 1 267 . 11 1 1 A 49 49 ASN H H 49 8.369 9.091 -0.722 1 1 268 . 11 1 1 A 49 49 ASN C C 49 174.560 174.676 -0.116 1 1 269 . 11 1 1 A 49 49 ASN CA C 49 53.005 52.267 0.738 1 1 270 . 11 1 1 A 49 49 ASN CB C 49 38.761 38.478 0.283 1 1 271 . 11 1 1 A 49 49 ASN N N 49 119.837 123.813 -3.976 1 1 272 . 11 1 1 A 50 50 ASP H H 50 8.192 7.885 0.307 1 1 273 . 11 1 1 A 50 50 ASP C C 50 175.699 174.576 1.123 1 1 274 . 11 1 1 A 50 50 ASP CA C 50 54.289 52.690 1.599 1 1 275 . 11 1 1 A 50 50 ASP CB C 50 41.264 41.066 0.198 1 1 276 . 11 1 1 A 50 50 ASP N N 50 120.403 123.319 -2.916 1 1 277 . 11 1 1 A 51 51 GLN H H 51 8.428 8.385 0.043 1 1 278 . 11 1 1 A 51 51 GLN C C 51 175.186 175.893 -0.707 1 1 279 . 11 1 1 A 51 51 GLN CA C 51 54.512 56.260 -1.748 1 1 280 . 11 1 1 A 51 51 GLN CB C 51 30.424 29.303 1.121 1 1 282 . 11 1 1 A 51 51 GLN N N 51 118.959 125.034 -6.075 1 1 289 . 11 1 1 A 52 52 LEU C C 52 176.018 175.399 0.619 1 1 290 . 11 1 1 A 52 52 LEU CA C 52 54.332 52.987 1.345 1 1 291 . 11 1 1 A 52 52 LEU CB C 52 43.022 45.568 -2.546 1 1 294 . 11 1 1 A 53 53 GLY H H 53 8.639 8.954 -0.315 1 1 295 . 11 1 1 A 53 53 GLY C C 53 171.931 172.347 -0.416 1 1 296 . 11 1 1 A 53 53 GLY CA C 53 43.501 44.099 -0.598 1 1 297 . 11 1 1 A 53 53 GLY N N 53 109.964 108.140 1.824 1 1 298 . 11 1 1 A 54 54 ALA H H 54 8.881 8.683 0.198 1 1 299 . 11 1 1 A 54 54 ALA C C 54 175.543 176.973 -1.430 1 1 300 . 11 1 1 A 54 54 ALA CA C 54 50.710 50.869 -0.159 1 1 301 . 11 1 1 A 54 54 ALA CB C 54 22.914 22.657 0.257 1 1 302 . 11 1 1 A 54 54 ALA N N 54 120.413 122.790 -2.377 1 1 303 . 11 1 1 A 55 55 GLY H H 55 8.346 8.594 -0.248 1 1 304 . 11 1 1 A 55 55 GLY C C 55 170.960 171.648 -0.688 1 1 305 . 11 1 1 A 55 55 GLY CA C 55 46.704 45.956 0.748 1 1 306 . 11 1 1 A 55 55 GLY N N 55 104.688 105.587 -0.899 1 1 307 . 11 1 1 A 56 56 ALA H H 56 9.116 8.291 0.825 1 1 308 . 11 1 1 A 56 56 ALA C C 56 176.472 175.727 0.745 1 1 309 . 11 1 1 A 56 56 ALA CA C 56 49.638 50.290 -0.652 1 1 310 . 11 1 1 A 56 56 ALA CB C 56 22.275 22.584 -0.309 1 1 311 . 11 1 1 A 56 56 ALA N N 56 120.608 122.777 -2.169 1 1 312 . 11 1 1 A 57 57 PHE H H 57 8.688 9.033 -0.345 1 1 313 . 11 1 1 A 57 57 PHE C C 57 172.816 175.597 -2.781 1 1 314 . 11 1 1 A 57 57 PHE CA C 57 56.066 55.944 0.122 1 1 315 . 11 1 1 A 57 57 PHE CB C 57 41.770 42.225 -0.455 1 1 316 . 11 1 1 A 57 57 PHE N N 57 120.027 119.386 0.641 1 1 317 . 11 1 1 A 58 58 GLY H H 58 9.034 9.194 -0.160 1 1 318 . 11 1 1 A 58 58 GLY C C 58 170.860 172.685 -1.825 1 1 319 . 11 1 1 A 58 58 GLY CA C 58 44.954 44.884 0.070 1 1 320 . 11 1 1 A 58 58 GLY N N 58 105.817 110.416 -4.599 1 1 321 . 11 1 1 A 59 59 GLY H H 59 8.382 8.912 -0.530 1 1 322 . 11 1 1 A 59 59 GLY C C 59 169.284 172.553 -3.269 1 1 323 . 11 1 1 A 59 59 GLY CA C 59 45.840 44.848 0.992 1 1 324 . 11 1 1 A 59 59 GLY N N 59 109.059 110.725 -1.666 1 1 325 . 11 1 1 A 60 60 TYR H H 60 8.430 8.902 -0.472 1 1 326 . 11 1 1 A 60 60 TYR C C 60 173.453 172.322 1.131 1 1 327 . 11 1 1 A 60 60 TYR CA C 60 55.282 56.045 -0.763 1 1 328 . 11 1 1 A 60 60 TYR CB C 60 41.712 42.333 -0.621 1 1 329 . 11 1 1 A 60 60 TYR N N 60 118.352 115.779 2.573 1 1 330 . 11 1 1 A 61 61 GLN H H 61 8.833 8.904 -0.071 1 1 331 . 11 1 1 A 61 61 GLN C C 61 174.365 175.162 -0.797 1 1 332 . 11 1 1 A 61 61 GLN CA C 61 54.125 54.638 -0.513 1 1 333 . 11 1 1 A 61 61 GLN CB C 61 28.033 31.614 -3.581 1 1 335 . 11 1 1 A 61 61 GLN N N 61 129.628 121.308 8.320 1 1 336 . 11 1 1 A 62 62 VAL H H 62 8.714 8.772 -0.058 1 1 343 . 11 1 1 A 62 62 VAL C C 62 175.758 175.870 -0.112 1 1 344 . 11 1 1 A 62 62 VAL CA C 62 64.649 63.303 1.346 1 1 345 . 11 1 1 A 62 62 VAL CB C 62 31.900 34.421 -2.521 1 1 348 . 11 1 1 A 62 62 VAL N N 62 127.666 125.785 1.881 1 1 349 . 11 1 1 A 63 63 ASN H H 63 8.062 7.385 0.677 1 1 350 . 11 1 1 A 63 63 ASN C C 63 172.827 175.018 -2.191 1 1 351 . 11 1 1 A 63 63 ASN CA C 63 51.575 51.847 -0.272 1 1 352 . 11 1 1 A 63 63 ASN CB C 63 37.194 37.823 -0.629 1 1 353 . 11 1 1 A 63 63 ASN N N 63 116.310 118.789 -2.479 1 1 354 . 11 1 1 A 64 64 PRO C C 64 175.071 176.626 -1.555 1 1 355 . 11 1 1 A 64 64 PRO CA C 64 65.296 64.923 0.373 1 1 356 . 11 1 1 A 64 64 PRO CB C 64 30.428 32.117 -1.689 1 1 357 . 11 1 1 A 65 65 TYR H H 65 7.873 7.767 0.106 1 1 358 . 11 1 1 A 65 65 TYR C C 65 175.145 174.237 0.908 1 1 359 . 11 1 1 A 65 65 TYR CA C 65 56.125 57.237 -1.112 1 1 360 . 11 1 1 A 65 65 TYR CB C 65 39.189 38.890 0.299 1 1 361 . 11 1 1 A 65 65 TYR N N 65 112.894 115.955 -3.061 1 1 362 . 11 1 1 A 66 66 LEU H H 66 7.308 7.613 -0.305 1 1 369 . 11 1 1 A 66 66 LEU C C 66 173.866 174.885 -1.019 1 1 370 . 11 1 1 A 66 66 LEU CA C 66 53.431 54.221 -0.790 1 1 371 . 11 1 1 A 66 66 LEU CB C 66 44.958 45.306 -0.348 1 1 375 . 11 1 1 A 66 66 LEU N N 66 120.270 123.594 -3.324 1 1 376 . 11 1 1 A 67 67 GLY H H 67 8.855 9.049 -0.194 1 1 377 . 11 1 1 A 67 67 GLY C C 67 170.698 171.569 -0.871 1 1 378 . 11 1 1 A 67 67 GLY CA C 67 44.008 44.001 0.007 1 1 379 . 11 1 1 A 67 67 GLY N N 67 114.388 113.522 0.866 1 1 380 . 11 1 1 A 68 68 PHE H H 68 8.770 8.372 0.398 1 1 381 . 11 1 1 A 68 68 PHE C C 68 173.386 173.902 -0.516 1 1 382 . 11 1 1 A 68 68 PHE CA C 68 56.507 56.604 -0.097 1 1 383 . 11 1 1 A 68 68 PHE CB C 68 42.428 41.191 1.237 1 1 384 . 11 1 1 A 68 68 PHE N N 68 117.510 119.286 -1.776 1 1 385 . 11 1 1 A 69 69 GLU H H 69 9.079 9.161 -0.082 1 1 386 . 11 1 1 A 69 69 GLU C C 69 174.556 174.041 0.515 1 1 387 . 11 1 1 A 69 69 GLU CA C 69 54.939 54.717 0.222 1 1 388 . 11 1 1 A 69 69 GLU CB C 69 33.963 33.416 0.547 1 1 390 . 11 1 1 A 69 69 GLU N N 69 120.562 122.621 -2.059 1 1 391 . 11 1 1 A 70 70 MET H H 70 9.481 9.757 -0.276 1 1 392 . 11 1 1 A 70 70 MET C C 70 174.595 175.397 -0.802 1 1 393 . 11 1 1 A 70 70 MET CA C 70 53.091 53.849 -0.758 1 1 394 . 11 1 1 A 70 70 MET CB C 70 36.159 35.823 0.336 1 1 397 . 11 1 1 A 70 70 MET N N 70 124.928 127.008 -2.080 1 1 398 . 11 1 1 A 71 71 GLY H H 71 8.845 8.914 -0.069 1 1 399 . 11 1 1 A 71 71 GLY C C 71 170.811 171.274 -0.463 1 1 400 . 11 1 1 A 71 71 GLY CA C 71 44.624 43.694 0.930 1 1 401 . 11 1 1 A 71 71 GLY N N 71 108.896 112.300 -3.404 1 1 402 . 11 1 1 A 72 72 TYR H H 72 8.925 8.461 0.464 1 1 403 . 11 1 1 A 72 72 TYR C C 72 173.278 173.850 -0.572 1 1 404 . 11 1 1 A 72 72 TYR CA C 72 55.912 56.183 -0.271 1 1 405 . 11 1 1 A 72 72 TYR CB C 72 41.611 40.971 0.640 1 1 406 . 11 1 1 A 72 72 TYR N N 72 123.253 120.385 2.868 1 1 407 . 11 1 1 A 73 73 ASP H H 73 8.665 9.190 -0.525 1 1 408 . 11 1 1 A 73 73 ASP C C 73 173.598 175.493 -1.895 1 1 409 . 11 1 1 A 73 73 ASP CA C 73 52.857 53.557 -0.700 1 1 410 . 11 1 1 A 73 73 ASP CB C 73 42.774 42.293 0.481 1 1 411 . 11 1 1 A 73 73 ASP N N 73 126.178 125.067 1.111 1 1 412 . 11 1 1 A 74 74 TRP H H 74 9.080 8.704 0.376 1 1 413 . 11 1 1 A 74 74 TRP C C 74 174.868 176.140 -1.272 1 1 414 . 11 1 1 A 74 74 TRP CB C 74 30.083 32.587 -2.504 1 1 415 . 11 1 1 A 74 74 TRP N N 74 121.824 127.588 -5.764 1 1 416 . 11 1 1 A 78 78 MET C C 78 174.548 175.819 -1.271 1 1 417 . 11 1 1 A 78 78 MET CA C 78 54.388 55.597 -1.209 1 1 418 . 11 1 1 A 78 78 MET CB C 78 32.542 31.820 0.722 1 1 419 . 11 1 1 A 79 79 ALA H H 79 8.105 8.128 -0.023 1 1 420 . 11 1 1 A 79 79 ALA C C 79 176.629 176.819 -0.190 1 1 421 . 11 1 1 A 79 79 ALA CA C 79 51.210 52.884 -1.674 1 1 422 . 11 1 1 A 79 79 ALA CB C 79 19.106 21.032 -1.926 1 1 423 . 11 1 1 A 79 79 ALA N N 79 125.778 124.870 0.908 1 1 424 . 11 1 1 A 80 80 TYR H H 80 8.035 7.649 0.386 1 1 425 . 11 1 1 A 80 80 TYR C C 80 175.604 175.234 0.370 1 1 426 . 11 1 1 A 80 80 TYR CA C 80 57.021 58.393 -1.372 1 1 427 . 11 1 1 A 80 80 TYR CB C 80 38.416 37.855 0.561 1 1 428 . 11 1 1 A 80 80 TYR N N 80 120.045 117.635 2.410 1 1 429 . 11 1 1 A 81 81 LYS H H 81 8.295 8.388 -0.093 1 1 430 . 11 1 1 A 81 81 LYS C C 81 176.647 176.062 0.585 1 1 431 . 11 1 1 A 81 81 LYS CA C 81 56.285 54.632 1.653 1 1 432 . 11 1 1 A 81 81 LYS CB C 81 31.571 35.607 -4.036 1 1 434 . 11 1 1 A 81 81 LYS N N 81 123.191 125.550 -2.359 1 1 435 . 11 1 1 A 82 82 GLY H H 82 8.117 8.476 -0.359 1 1 436 . 11 1 1 A 82 82 GLY C C 82 174.010 173.373 0.637 1 1 437 . 11 1 1 A 82 82 GLY CA C 82 44.982 45.552 -0.570 1 1 438 . 11 1 1 A 82 82 GLY N N 82 110.014 109.701 0.313 1 1 439 . 11 1 1 A 83 83 SER H H 83 7.938 8.804 -0.866 1 1 440 . 11 1 1 A 83 83 SER C C 83 174.634 175.612 -0.978 1 1 441 . 11 1 1 A 83 83 SER CA C 83 57.685 59.481 -1.796 1 1 442 . 11 1 1 A 83 83 SER CB C 83 63.303 65.535 -2.232 1 1 443 . 11 1 1 A 83 83 SER N N 83 115.655 120.325 -4.670 1 1 444 . 11 1 1 A 84 84 VAL H H 84 8.008 8.117 -0.109 1 1 451 . 11 1 1 A 84 84 VAL C C 84 175.525 175.756 -0.231 1 1 452 . 11 1 1 A 84 84 VAL CA C 84 61.769 63.675 -1.906 1 1 453 . 11 1 1 A 84 84 VAL CB C 84 31.711 33.191 -1.480 1 1 456 . 11 1 1 A 84 84 VAL N N 84 120.054 118.403 1.651 1 1 457 . 11 1 1 A 85 85 ASP H H 85 8.140 7.705 0.435 1 1 458 . 11 1 1 A 85 85 ASP C C 85 174.740 174.018 0.722 1 1 459 . 11 1 1 A 85 85 ASP CA C 85 53.983 54.075 -0.092 1 1 460 . 11 1 1 A 85 85 ASP CB C 85 40.633 45.077 -4.444 1 1 461 . 11 1 1 A 85 85 ASP N N 85 122.510 116.038 6.472 1 1 462 . 11 1 1 A 86 86 ASN H H 86 7.736 8.638 -0.902 1 1 463 . 11 1 1 A 86 86 ASN C C 86 175.970 175.779 0.191 1 1 464 . 11 1 1 A 86 86 ASN CA C 86 54.349 53.179 1.170 1 1 465 . 11 1 1 A 86 86 ASN CB C 86 40.490 38.018 2.472 1 1 467 . 11 1 1 A 86 86 ASN N N 86 124.290 123.422 0.868 1 1 468 . 11 1 1 A 87 87 GLY H H 87 8.000 8.658 -0.658 1 1 469 . 11 1 1 A 87 87 GLY C C 87 173.456 173.068 0.388 1 1 470 . 11 1 1 A 87 87 GLY CA C 87 44.973 45.776 -0.803 1 1 471 . 11 1 1 A 87 87 GLY N N 87 113.494 111.819 1.675 1 1 472 . 11 1 1 A 88 88 ALA H H 88 8.024 7.352 0.672 1 1 473 . 11 1 1 A 88 88 ALA C C 88 176.833 175.677 1.156 1 1 474 . 11 1 1 A 88 88 ALA CA C 88 51.734 50.900 0.834 1 1 475 . 11 1 1 A 88 88 ALA CB C 88 19.818 22.624 -2.806 1 1 476 . 11 1 1 A 88 88 ALA N N 88 122.676 122.037 0.639 1 1 477 . 11 1 1 A 91 91 ALA C C 91 174.781 175.778 -0.997 1 1 478 . 11 1 1 A 91 91 ALA CA C 91 50.537 50.913 -0.376 1 1 479 . 11 1 1 A 91 91 ALA CB C 91 21.324 23.805 -2.481 1 1 480 . 11 1 1 A 92 92 GLN H H 92 8.451 8.873 -0.422 1 1 481 . 11 1 1 A 92 92 GLN C C 92 173.557 174.662 -1.105 1 1 482 . 11 1 1 A 92 92 GLN CA C 92 53.380 55.851 -2.471 1 1 484 . 11 1 1 A 92 92 GLN N N 92 116.847 120.060 -3.213 1 1 485 . 11 1 1 A 93 93 GLY C C 93 170.631 172.645 -2.014 1 1 486 . 11 1 1 A 93 93 GLY CA C 93 45.718 45.272 0.446 1 1 487 . 11 1 1 A 94 94 VAL H H 94 8.686 9.538 -0.852 1 1 494 . 11 1 1 A 94 94 VAL C C 94 173.698 173.804 -0.106 1 1 495 . 11 1 1 A 94 94 VAL CA C 94 58.997 59.974 -0.977 1 1 496 . 11 1 1 A 94 94 VAL CB C 94 33.311 34.361 -1.050 1 1 499 . 11 1 1 A 94 94 VAL N N 94 118.489 120.148 -1.659 1 1 500 . 11 1 1 A 95 95 GLN H H 95 9.468 9.680 -0.212 1 1 501 . 11 1 1 A 95 95 GLN C C 95 174.028 173.911 0.117 1 1 502 . 11 1 1 A 95 95 GLN CA C 95 52.547 54.578 -2.031 1 1 503 . 11 1 1 A 95 95 GLN CB C 95 33.816 31.990 1.826 1 1 505 . 11 1 1 A 95 95 GLN N N 95 122.106 126.049 -3.943 1 1 506 . 11 1 1 A 96 96 LEU H H 96 8.484 8.872 -0.388 1 1 513 . 11 1 1 A 96 96 LEU C C 96 175.322 175.178 0.144 1 1 514 . 11 1 1 A 96 96 LEU CA C 96 53.736 54.291 -0.555 1 1 515 . 11 1 1 A 96 96 LEU CB C 96 41.088 45.759 -4.671 1 1 519 . 11 1 1 A 96 96 LEU N N 96 123.224 124.804 -1.580 1 1 520 . 11 1 1 A 97 97 THR H H 97 9.116 8.954 0.162 1 1 521 . 11 1 1 A 97 97 THR C C 97 173.251 171.484 1.767 1 1 522 . 11 1 1 A 97 97 THR CA C 97 58.931 59.672 -0.741 1 1 523 . 11 1 1 A 97 97 THR CB C 97 72.984 72.105 0.879 1 1 525 . 11 1 1 A 97 97 THR N N 97 112.504 115.837 -3.333 1 1 526 . 11 1 1 A 98 98 ALA H H 98 8.603 8.385 0.218 1 1 527 . 11 1 1 A 98 98 ALA C C 98 174.948 176.888 -1.940 1 1 528 . 11 1 1 A 98 98 ALA CA C 98 49.980 49.967 0.013 1 1 529 . 11 1 1 A 98 98 ALA CB C 98 19.157 20.324 -1.167 1 1 530 . 11 1 1 A 98 98 ALA N N 98 121.608 123.612 -2.004 1 1 531 . 11 1 1 A 99 99 LYS H H 99 8.890 9.352 -0.462 1 1 532 . 11 1 1 A 99 99 LYS C C 99 174.294 175.589 -1.295 1 1 533 . 11 1 1 A 99 99 LYS CA C 99 54.019 54.934 -0.915 1 1 534 . 11 1 1 A 99 99 LYS CB C 99 33.018 34.657 -1.639 1 1 538 . 11 1 1 A 99 99 LYS N N 99 124.522 120.911 3.611 1 1 539 . 11 1 1 A 100 100 LEU H H 100 8.985 8.697 0.288 1 1 546 . 11 1 1 A 100 100 LEU C C 100 175.265 175.449 -0.184 1 1 547 . 11 1 1 A 100 100 LEU CA C 100 52.698 53.128 -0.430 1 1 548 . 11 1 1 A 100 100 LEU CB C 100 42.889 44.544 -1.655 1 1 552 . 11 1 1 A 100 100 LEU N N 100 131.876 121.718 10.158 1 1 553 . 11 1 1 A 101 101 GLY H H 101 9.137 8.184 0.953 1 1 554 . 11 1 1 A 101 101 GLY C C 101 170.798 171.450 -0.652 1 1 555 . 11 1 1 A 101 101 GLY CA C 101 44.429 46.130 -1.701 1 1 556 . 11 1 1 A 101 101 GLY N N 101 111.928 107.812 4.116 1 1 557 . 11 1 1 A 102 102 TYR H H 102 8.779 8.730 0.049 1 1 558 . 11 1 1 A 102 102 TYR C C 102 173.402 173.397 0.005 1 1 559 . 11 1 1 A 102 102 TYR CA C 102 54.444 56.448 -2.004 1 1 560 . 11 1 1 A 102 102 TYR CB C 102 42.239 42.950 -0.711 1 1 561 . 11 1 1 A 102 102 TYR N N 102 116.664 119.887 -3.223 1 1 562 . 11 1 1 A 103 103 PRO C C 103 175.676 175.733 -0.057 1 1 563 . 11 1 1 A 103 103 PRO CA C 103 61.462 62.115 -0.653 1 1 564 . 11 1 1 A 103 103 PRO CB C 103 30.073 32.947 -2.874 1 1 565 . 11 1 1 A 104 104 ILE H H 104 8.670 8.645 0.025 1 1 569 . 11 1 1 A 104 104 ILE C C 104 176.646 175.311 1.335 1 1 570 . 11 1 1 A 104 104 ILE CA C 104 62.054 60.092 1.962 1 1 571 . 11 1 1 A 104 104 ILE CB C 104 37.678 38.735 -1.057 1 1 574 . 11 1 1 A 104 104 ILE N N 104 125.939 121.080 4.859 1 1 575 . 11 1 1 A 105 105 THR H H 105 8.129 8.261 -0.132 1 1 576 . 11 1 1 A 105 105 THR C C 105 174.344 173.458 0.886 1 1 577 . 11 1 1 A 105 105 THR CA C 105 59.176 62.015 -2.839 1 1 578 . 11 1 1 A 105 105 THR CB C 105 71.049 68.576 2.473 1 1 580 . 11 1 1 A 105 105 THR N N 105 109.853 118.324 -8.471 1 1 581 . 11 1 1 A 106 106 ASP H H 106 8.424 8.921 -0.497 1 1 582 . 11 1 1 A 106 106 ASP C C 106 175.692 175.251 0.441 1 1 583 . 11 1 1 A 106 106 ASP CA C 106 56.465 56.411 0.054 1 1 584 . 11 1 1 A 106 106 ASP CB C 106 40.032 40.506 -0.474 1 1 585 . 11 1 1 A 106 106 ASP N N 106 117.156 122.220 -5.064 1 1 586 . 11 1 1 A 107 107 ASP H H 107 8.124 8.296 -0.172 1 1 587 . 11 1 1 A 107 107 ASP C C 107 174.174 174.368 -0.194 1 1 588 . 11 1 1 A 107 107 ASP CA C 107 52.907 53.318 -0.411 1 1 589 . 11 1 1 A 107 107 ASP CB C 107 41.661 41.330 0.331 1 1 590 . 11 1 1 A 107 107 ASP N N 107 113.591 120.746 -7.155 1 1 591 . 11 1 1 A 108 108 LEU H H 108 7.336 7.036 0.300 1 1 598 . 11 1 1 A 108 108 LEU C C 108 174.321 174.999 -0.678 1 1 599 . 11 1 1 A 108 108 LEU CA C 108 54.449 53.082 1.367 1 1 600 . 11 1 1 A 108 108 LEU CB C 108 44.754 43.357 1.397 1 1 604 . 11 1 1 A 108 108 LEU N N 108 123.244 120.007 3.237 1 1 605 . 11 1 1 A 109 109 ASP H H 109 8.943 8.963 -0.020 1 1 606 . 11 1 1 A 109 109 ASP C C 109 176.248 174.566 1.682 1 1 607 . 11 1 1 A 109 109 ASP CA C 109 52.376 52.143 0.233 1 1 608 . 11 1 1 A 109 109 ASP CB C 109 42.764 44.959 -2.195 1 1 609 . 11 1 1 A 109 109 ASP N N 109 124.634 122.450 2.184 1 1 610 . 11 1 1 A 110 110 ILE H H 110 8.372 8.708 -0.336 1 1 614 . 11 1 1 A 110 110 ILE C C 110 173.735 174.379 -0.644 1 1 615 . 11 1 1 A 110 110 ILE CA C 110 59.129 59.144 -0.015 1 1 616 . 11 1 1 A 110 110 ILE CB C 110 39.402 40.820 -1.418 1 1 620 . 11 1 1 A 110 110 ILE N N 110 119.135 117.236 1.899 1 1 621 . 11 1 1 A 111 111 TYR H H 111 8.695 8.398 0.297 1 1 622 . 11 1 1 A 111 111 TYR C C 111 172.838 173.003 -0.165 1 1 623 . 11 1 1 A 111 111 TYR CA C 111 56.182 56.258 -0.076 1 1 624 . 11 1 1 A 111 111 TYR CB C 111 41.489 40.846 0.643 1 1 625 . 11 1 1 A 111 111 TYR N N 111 121.248 119.070 2.178 1 1 626 . 11 1 1 A 112 112 THR H H 112 9.172 8.890 0.282 1 1 627 . 11 1 1 A 112 112 THR C C 112 173.850 173.562 0.288 1 1 628 . 11 1 1 A 112 112 THR CA C 112 58.246 61.137 -2.891 1 1 629 . 11 1 1 A 112 112 THR CB C 112 71.676 72.806 -1.130 1 1 631 . 11 1 1 A 112 112 THR N N 112 110.671 115.181 -4.510 1 1 632 . 11 1 1 A 113 113 ARG H H 113 8.732 9.677 -0.945 1 1 633 . 11 1 1 A 113 113 ARG C C 113 175.037 174.623 0.414 1 1 634 . 11 1 1 A 113 113 ARG CA C 113 53.995 54.788 -0.793 1 1 635 . 11 1 1 A 113 113 ARG CB C 113 32.266 32.788 -0.522 1 1 638 . 11 1 1 A 113 113 ARG N N 113 120.642 123.801 -3.159 1 1 639 . 11 1 1 A 114 114 LEU H H 114 8.449 8.975 -0.526 1 1 646 . 11 1 1 A 114 114 LEU C C 114 175.812 175.861 -0.049 1 1 647 . 11 1 1 A 114 114 LEU CA C 114 53.335 53.560 -0.225 1 1 648 . 11 1 1 A 114 114 LEU CB C 114 45.182 44.776 0.406 1 1 652 . 11 1 1 A 114 114 LEU N N 114 119.078 124.450 -5.372 1 1 653 . 11 1 1 A 115 115 GLY H H 115 8.232 8.573 -0.341 1 1 654 . 11 1 1 A 115 115 GLY C C 115 171.343 172.475 -1.132 1 1 655 . 11 1 1 A 115 115 GLY CA C 115 46.217 46.109 0.108 1 1 656 . 11 1 1 A 115 115 GLY N N 115 108.966 112.417 -3.451 1 1 657 . 11 1 1 A 116 116 GLY H H 116 8.293 8.393 -0.100 1 1 658 . 11 1 1 A 116 116 GLY C C 116 169.856 172.420 -2.564 1 1 659 . 11 1 1 A 116 116 GLY CA C 116 44.084 45.363 -1.279 1 1 660 . 11 1 1 A 116 116 GLY N N 116 109.676 110.903 -1.227 1 1 661 . 11 1 1 A 117 117 MET H H 117 9.286 9.197 0.089 1 1 662 . 11 1 1 A 117 117 MET C C 117 174.557 175.096 -0.539 1 1 663 . 11 1 1 A 117 117 MET CA C 117 53.258 53.161 0.097 1 1 664 . 11 1 1 A 117 117 MET CB C 117 37.195 35.282 1.913 1 1 667 . 11 1 1 A 117 117 MET N N 117 120.425 116.974 3.451 1 1 668 . 11 1 1 A 118 118 VAL H H 118 9.062 9.213 -0.151 1 1 675 . 11 1 1 A 118 118 VAL C C 118 173.993 174.597 -0.604 1 1 676 . 11 1 1 A 118 118 VAL CA C 118 59.883 60.666 -0.783 1 1 677 . 11 1 1 A 118 118 VAL CB C 118 31.782 35.346 -3.564 1 1 680 . 11 1 1 A 118 118 VAL N N 118 126.948 119.554 7.394 1 1 681 . 11 1 1 A 119 119 TRP H H 119 8.482 9.282 -0.800 1 1 682 . 11 1 1 A 119 119 TRP C C 119 174.608 173.975 0.633 1 1 683 . 11 1 1 A 119 119 TRP CA C 119 53.332 55.809 -2.477 1 1 684 . 11 1 1 A 119 119 TRP CB C 119 33.569 33.386 0.183 1 1 685 . 11 1 1 A 119 119 TRP N N 119 124.631 129.266 -4.635 1 1 686 . 11 1 1 A 120 120 ARG H H 120 9.113 8.831 0.282 1 1 687 . 11 1 1 A 120 120 ARG C C 120 174.951 174.102 0.849 1 1 688 . 11 1 1 A 120 120 ARG CA C 120 54.684 53.963 0.721 1 1 689 . 11 1 1 A 120 120 ARG CB C 120 33.424 33.773 -0.349 1 1 690 . 11 1 1 A 120 120 ARG N N 120 117.899 127.181 -9.282 1 1 691 . 11 1 1 A 121 121 ALA H H 121 9.299 8.426 0.873 1 1 692 . 11 1 1 A 121 121 ALA C C 121 175.954 174.454 1.500 1 1 693 . 11 1 1 A 121 121 ALA CA C 121 50.368 51.242 -0.874 1 1 694 . 11 1 1 A 121 121 ALA CB C 121 21.141 22.935 -1.794 1 1 695 . 11 1 1 A 121 121 ALA N N 121 128.863 126.110 2.753 1 1 696 . 11 1 1 A 122 122 ASP H H 122 8.488 8.726 -0.238 1 1 697 . 11 1 1 A 122 122 ASP C C 122 175.635 174.867 0.768 1 1 698 . 11 1 1 A 122 122 ASP CA C 122 53.891 52.829 1.062 1 1 699 . 11 1 1 A 122 122 ASP CB C 122 42.492 44.321 -1.829 1 1 700 . 11 1 1 A 122 122 ASP N N 122 121.721 121.763 -0.042 1 1 701 . 11 1 1 A 123 123 SER H H 123 8.466 8.718 -0.252 1 1 702 . 11 1 1 A 123 123 SER C C 123 174.325 173.791 0.534 1 1 703 . 11 1 1 A 123 123 SER CA C 123 57.325 57.573 -0.248 1 1 704 . 11 1 1 A 123 123 SER CB C 123 63.988 63.790 0.198 1 1 705 . 11 1 1 A 123 123 SER N N 123 117.374 123.463 -6.089 1 1 706 . 11 1 1 A 124 124 LYS H H 124 8.389 8.909 -0.520 1 1 707 . 11 1 1 A 124 124 LYS C C 124 176.840 176.122 0.718 1 1 708 . 11 1 1 A 124 124 LYS CA C 124 56.036 54.396 1.640 1 1 709 . 11 1 1 A 124 124 LYS CB C 124 32.397 36.431 -4.034 1 1 711 . 11 1 1 A 124 124 LYS N N 124 122.883 126.488 -3.605 1 1 712 . 11 1 1 A 125 125 GLY H H 125 8.281 8.706 -0.425 1 1 713 . 11 1 1 A 125 125 GLY C C 125 173.592 174.689 -1.097 1 1 714 . 11 1 1 A 125 125 GLY CA C 125 44.924 44.267 0.657 1 1 715 . 11 1 1 A 125 125 GLY N N 125 109.541 107.284 2.257 1 1 716 . 11 1 1 A 126 126 ASN H H 126 8.185 8.957 -0.772 1 1 717 . 11 1 1 A 126 126 ASN C C 126 176.649 175.094 1.555 1 1 718 . 11 1 1 A 126 126 ASN CA C 126 52.763 55.238 -2.475 1 1 719 . 11 1 1 A 126 126 ASN CB C 126 38.439 38.110 0.329 1 1 720 . 11 1 1 A 126 126 ASN N N 126 119.019 116.683 2.336 1 1 721 . 11 1 1 A 127 127 TYR C C 127 176.913 175.866 1.047 1 1 722 . 11 1 1 A 127 127 TYR CA C 127 57.757 58.794 -1.037 1 1 723 . 11 1 1 A 127 127 TYR CB C 127 37.703 39.827 -2.124 1 1 724 . 11 1 1 A 128 128 ALA H H 128 8.050 8.823 -0.773 1 1 728 . 11 1 1 A 128 128 ALA C C 128 177.756 175.970 1.786 1 1 729 . 11 1 1 A 128 128 ALA CA C 128 52.321 50.676 1.645 1 1 730 . 11 1 1 A 128 128 ALA CB C 128 18.273 19.502 -1.229 1 1 731 . 11 1 1 A 128 128 ALA N N 128 124.529 127.000 -2.471 1 1 732 . 11 1 1 A 129 129 SER H H 129 8.063 8.540 -0.477 1 1 733 . 11 1 1 A 129 129 SER C C 129 174.938 174.092 0.846 1 1 734 . 11 1 1 A 129 129 SER CA C 129 58.202 58.812 -0.610 1 1 735 . 11 1 1 A 129 129 SER CB C 129 62.974 63.943 -0.969 1 1 736 . 11 1 1 A 129 129 SER N N 129 114.374 119.015 -4.641 1 1 737 . 11 1 1 A 130 130 THR H H 130 7.875 8.628 -0.753 1 1 741 . 11 1 1 A 130 130 THR C C 130 175.198 173.037 2.161 1 1 742 . 11 1 1 A 130 130 THR CA C 130 61.520 60.456 1.064 1 1 743 . 11 1 1 A 130 130 THR CB C 130 69.312 71.470 -2.158 1 1 745 . 11 1 1 A 130 130 THR N N 130 113.608 117.527 -3.919 1 1 746 . 11 1 1 A 131 131 GLY H H 131 8.219 8.647 -0.428 1 1 747 . 11 1 1 A 131 131 GLY C C 131 173.979 174.079 -0.100 1 1 748 . 11 1 1 A 131 131 GLY CA C 131 44.991 45.697 -0.706 1 1 749 . 11 1 1 A 131 131 GLY N N 131 110.848 111.020 -0.172 1 1 750 . 11 1 1 A 132 132 VAL H H 132 7.729 8.080 -0.351 1 1 757 . 11 1 1 A 132 132 VAL C C 132 175.988 174.862 1.126 1 1 758 . 11 1 1 A 132 132 VAL CA C 132 61.643 60.474 1.169 1 1 759 . 11 1 1 A 132 132 VAL CB C 132 31.941 32.141 -0.200 1 1 762 . 11 1 1 A 132 132 VAL N N 132 118.932 120.908 -1.976 1 1 763 . 11 1 1 A 133 133 SER H H 133 8.224 7.584 0.640 1 1 764 . 11 1 1 A 133 133 SER C C 133 174.320 172.636 1.684 1 1 765 . 11 1 1 A 133 133 SER CA C 133 57.756 56.170 1.586 1 1 766 . 11 1 1 A 133 133 SER CB C 133 63.140 66.564 -3.424 1 1 767 . 11 1 1 A 133 133 SER N N 133 119.260 116.589 2.671 1 1 768 . 11 1 1 A 134 134 ARG H H 134 8.199 8.426 -0.227 1 1 769 . 11 1 1 A 134 134 ARG C C 134 175.923 176.270 -0.347 1 1 770 . 11 1 1 A 134 134 ARG CA C 134 55.461 54.580 0.881 1 1 771 . 11 1 1 A 134 134 ARG CB C 134 30.195 32.127 -1.932 1 1 774 . 11 1 1 A 134 134 ARG N N 134 123.262 122.547 0.715 1 1 775 . 11 1 1 A 135 135 SER H H 135 8.256 8.881 -0.625 1 1 776 . 11 1 1 A 135 135 SER C C 135 174.360 174.436 -0.076 1 1 777 . 11 1 1 A 135 135 SER CA C 135 57.730 58.917 -1.187 1 1 778 . 11 1 1 A 135 135 SER CB C 135 63.275 63.827 -0.552 1 1 779 . 11 1 1 A 135 135 SER N N 135 117.155 117.714 -0.559 1 1 780 . 11 1 1 A 136 136 GLU H H 136 8.374 8.611 -0.237 1 1 781 . 11 1 1 A 136 136 GLU C C 136 176.284 175.816 0.468 1 1 782 . 11 1 1 A 136 136 GLU CA C 136 56.082 55.798 0.284 1 1 783 . 11 1 1 A 136 136 GLU CB C 136 29.820 31.591 -1.771 1 1 785 . 11 1 1 A 136 136 GLU N N 136 122.812 122.528 0.284 1 1 786 . 11 1 1 A 137 137 HIS H H 137 8.118 9.158 -1.040 1 1 787 . 11 1 1 A 137 137 HIS C C 137 173.529 173.819 -0.290 1 1 788 . 11 1 1 A 137 137 HIS CA C 137 54.793 54.691 0.102 1 1 789 . 11 1 1 A 137 137 HIS CB C 137 30.191 31.994 -1.803 1 1 790 . 11 1 1 A 137 137 HIS N N 137 118.002 120.819 -2.817 1 1 791 . 11 1 1 A 138 138 ASP H H 138 8.572 8.806 -0.234 1 1 792 . 11 1 1 A 138 138 ASP C C 138 174.940 175.633 -0.693 1 1 793 . 11 1 1 A 138 138 ASP CA C 138 53.594 53.019 0.575 1 1 794 . 11 1 1 A 138 138 ASP CB C 138 42.165 43.823 -1.658 1 1 795 . 11 1 1 A 138 138 ASP N N 138 121.536 123.656 -2.120 1 1 796 . 11 1 1 A 139 139 THR H H 139 7.857 8.878 -1.021 1 1 797 . 11 1 1 A 139 139 THR C C 139 172.822 173.029 -0.207 1 1 798 . 11 1 1 A 139 139 THR CA C 139 59.197 60.495 -1.298 1 1 799 . 11 1 1 A 139 139 THR CB C 139 71.457 71.719 -0.262 1 1 801 . 11 1 1 A 139 139 THR N N 139 113.598 114.764 -1.166 1 1 802 . 11 1 1 A 140 140 GLY C C 140 169.622 171.986 -2.364 1 1 803 . 11 1 1 A 140 140 GLY CA C 140 44.287 45.070 -0.783 1 1 804 . 11 1 1 A 141 141 VAL H H 141 7.815 8.771 -0.956 1 1 811 . 11 1 1 A 141 141 VAL C C 141 176.038 173.574 2.464 1 1 812 . 11 1 1 A 141 141 VAL CA C 141 59.739 59.383 0.356 1 1 813 . 11 1 1 A 141 141 VAL CB C 141 33.308 35.531 -2.223 1 1 816 . 11 1 1 A 141 141 VAL N N 141 116.224 123.583 -7.359 1 1 817 . 11 1 1 A 142 142 SER H H 142 9.284 8.900 0.384 1 1 818 . 11 1 1 A 142 142 SER C C 142 171.050 172.495 -1.445 1 1 819 . 11 1 1 A 142 142 SER CB C 142 67.608 66.066 1.542 1 1 820 . 11 1 1 A 142 142 SER N N 142 123.223 122.689 0.534 1 1 821 . 11 1 1 A 143 143 PRO C C 143 174.032 176.478 -2.446 1 1 822 . 11 1 1 A 143 143 PRO CA C 143 62.350 62.777 -0.427 1 1 823 . 11 1 1 A 143 143 PRO CB C 143 31.774 32.016 -0.242 1 1 825 . 11 1 1 A 144 144 VAL H H 144 7.785 8.680 -0.895 1 1 832 . 11 1 1 A 144 144 VAL C C 144 172.826 174.285 -1.459 1 1 833 . 11 1 1 A 144 144 VAL CA C 144 59.770 59.790 -0.020 1 1 834 . 11 1 1 A 144 144 VAL CB C 144 34.407 36.139 -1.732 1 1 837 . 11 1 1 A 144 144 VAL N N 144 120.214 117.066 3.148 1 1 838 . 11 1 1 A 145 145 PHE H H 145 8.623 8.744 -0.121 1 1 839 . 11 1 1 A 145 145 PHE C C 145 173.658 172.774 0.884 1 1 840 . 11 1 1 A 145 145 PHE CA C 145 54.942 55.857 -0.915 1 1 841 . 11 1 1 A 145 145 PHE CB C 145 42.692 42.312 0.380 1 1 842 . 11 1 1 A 145 145 PHE N N 145 123.914 119.042 4.872 1 1 843 . 11 1 1 A 146 146 ALA H H 146 8.886 8.973 -0.087 1 1 844 . 11 1 1 A 146 146 ALA C C 146 176.258 176.225 0.033 1 1 845 . 11 1 1 A 146 146 ALA CA C 146 49.734 50.178 -0.444 1 1 846 . 11 1 1 A 146 146 ALA CB C 146 22.244 22.485 -0.241 1 1 847 . 11 1 1 A 146 146 ALA N N 146 125.243 123.993 1.250 1 1 848 . 11 1 1 A 147 147 GLY H H 147 8.470 8.751 -0.281 1 1 849 . 11 1 1 A 147 147 GLY C C 147 170.940 173.128 -2.188 1 1 850 . 11 1 1 A 147 147 GLY CA C 147 44.063 44.624 -0.561 1 1 851 . 11 1 1 A 147 147 GLY N N 147 106.669 107.989 -1.320 1 1 852 . 11 1 1 A 148 148 GLY H H 148 8.008 8.688 -0.680 1 1 853 . 11 1 1 A 148 148 GLY C C 148 170.181 172.174 -1.993 1 1 854 . 11 1 1 A 148 148 GLY CA C 148 45.736 46.228 -0.492 1 1 855 . 11 1 1 A 148 148 GLY N N 148 109.475 110.114 -0.639 1 1 856 . 11 1 1 A 149 149 VAL H H 149 8.426 8.453 -0.027 1 1 863 . 11 1 1 A 149 149 VAL C C 149 174.157 173.252 0.905 1 1 864 . 11 1 1 A 149 149 VAL CA C 149 58.200 58.682 -0.482 1 1 865 . 11 1 1 A 149 149 VAL CB C 149 34.464 35.621 -1.157 1 1 868 . 11 1 1 A 149 149 VAL N N 149 112.651 117.632 -4.981 1 1 869 . 11 1 1 A 150 150 GLU H H 150 9.070 8.973 0.097 1 1 870 . 11 1 1 A 150 150 GLU C C 150 173.892 174.125 -0.233 1 1 871 . 11 1 1 A 150 150 GLU CA C 150 54.617 54.734 -0.117 1 1 872 . 11 1 1 A 150 150 GLU CB C 150 32.911 33.327 -0.416 1 1 874 . 11 1 1 A 150 150 GLU N N 150 124.471 120.792 3.679 1 1 875 . 11 1 1 A 151 151 TRP H H 151 9.461 9.144 0.317 1 1 877 . 11 1 1 A 151 151 TRP C C 151 174.370 174.302 0.068 1 1 878 . 11 1 1 A 151 151 TRP CA C 151 54.113 55.543 -1.430 1 1 879 . 11 1 1 A 151 151 TRP CB C 151 31.688 33.140 -1.452 1 1 880 . 11 1 1 A 151 151 TRP N N 151 129.611 129.315 0.296 1 1 882 . 11 1 1 A 152 152 ALA H H 152 8.771 8.930 -0.159 1 1 883 . 11 1 1 A 152 152 ALA C C 152 175.079 177.686 -2.607 1 1 884 . 11 1 1 A 152 152 ALA CA C 152 51.417 50.470 0.947 1 1 885 . 11 1 1 A 152 152 ALA CB C 152 17.209 21.014 -3.805 1 1 886 . 11 1 1 A 152 152 ALA N N 152 130.502 131.100 -0.598 1 1 887 . 11 1 1 A 153 153 VAL H H 153 7.893 8.682 -0.789 1 1 894 . 11 1 1 A 153 153 VAL C C 153 176.612 175.584 1.028 1 1 895 . 11 1 1 A 153 153 VAL CA C 153 63.600 61.257 2.343 1 1 896 . 11 1 1 A 153 153 VAL CB C 153 31.280 31.773 -0.493 1 1 899 . 11 1 1 A 153 153 VAL N N 153 124.360 123.263 1.097 1 1 900 . 11 1 1 A 154 154 THR H H 154 7.950 8.218 -0.268 1 1 904 . 11 1 1 A 154 154 THR C C 154 173.884 174.096 -0.212 1 1 905 . 11 1 1 A 154 154 THR CA C 154 58.655 63.867 -5.212 1 1 906 . 11 1 1 A 154 154 THR CB C 154 71.262 67.556 3.706 1 1 908 . 11 1 1 A 154 154 THR N N 154 109.176 113.360 -4.184 1 1 909 . 11 1 1 A 155 155 ARG H H 155 8.310 8.993 -0.683 1 1 910 . 11 1 1 A 155 155 ARG C C 155 176.753 175.395 1.358 1 1 911 . 11 1 1 A 155 155 ARG CA C 155 58.456 57.240 1.216 1 1 912 . 11 1 1 A 155 155 ARG CB C 155 29.043 28.113 0.930 1 1 915 . 11 1 1 A 155 155 ARG N N 155 116.576 119.601 -3.025 1 1 916 . 11 1 1 A 156 156 ASP H H 156 7.783 8.495 -0.712 1 1 917 . 11 1 1 A 156 156 ASP C C 156 174.222 174.638 -0.416 1 1 918 . 11 1 1 A 156 156 ASP CA C 156 53.540 55.664 -2.124 1 1 919 . 11 1 1 A 156 156 ASP CB C 156 42.327 39.581 2.746 1 1 920 . 11 1 1 A 156 156 ASP N N 156 112.950 110.255 2.695 1 1 921 . 11 1 1 A 157 157 ILE H H 157 7.233 7.481 -0.248 1 1 925 . 11 1 1 A 157 157 ILE C C 157 174.178 174.114 0.064 1 1 926 . 11 1 1 A 157 157 ILE CA C 157 59.350 60.735 -1.385 1 1 927 . 11 1 1 A 157 157 ILE CB C 157 38.969 39.788 -0.819 1 1 930 . 11 1 1 A 157 157 ILE N N 157 119.732 118.817 0.915 1 1 931 . 11 1 1 A 158 158 ALA H H 158 8.729 9.324 -0.595 1 1 932 . 11 1 1 A 158 158 ALA C C 158 176.567 175.916 0.651 1 1 933 . 11 1 1 A 158 158 ALA CA C 158 49.418 50.153 -0.735 1 1 934 . 11 1 1 A 158 158 ALA CB C 158 21.430 23.189 -1.759 1 1 935 . 11 1 1 A 158 158 ALA N N 158 128.564 130.756 -2.192 1 1 936 . 11 1 1 A 159 159 THR H H 159 8.972 9.307 -0.335 1 1 940 . 11 1 1 A 159 159 THR C C 159 172.213 173.427 -1.214 1 1 941 . 11 1 1 A 159 159 THR CA C 159 59.504 61.502 -1.998 1 1 942 . 11 1 1 A 159 159 THR CB C 159 70.728 70.975 -0.247 1 1 944 . 11 1 1 A 159 159 THR N N 159 114.901 115.963 -1.062 1 1 945 . 11 1 1 A 160 160 ARG H H 160 8.924 9.399 -0.475 1 1 946 . 11 1 1 A 160 160 ARG C C 160 174.097 174.160 -0.063 1 1 947 . 11 1 1 A 160 160 ARG CA C 160 53.066 54.520 -1.454 1 1 948 . 11 1 1 A 160 160 ARG CB C 160 32.922 33.664 -0.742 1 1 951 . 11 1 1 A 160 160 ARG N N 160 121.507 122.411 -0.904 1 1 952 . 11 1 1 A 161 161 LEU H H 161 8.611 9.088 -0.477 1 1 959 . 11 1 1 A 161 161 LEU C C 161 174.389 174.346 0.043 1 1 960 . 11 1 1 A 161 161 LEU CA C 161 53.355 53.600 -0.245 1 1 961 . 11 1 1 A 161 161 LEU CB C 161 44.360 45.328 -0.968 1 1 964 . 11 1 1 A 161 161 LEU N N 161 124.711 124.188 0.523 1 1 965 . 11 1 1 A 162 162 GLU H H 162 8.746 8.732 0.014 1 1 966 . 11 1 1 A 162 162 GLU C C 162 173.376 174.793 -1.417 1 1 967 . 11 1 1 A 162 162 GLU CA C 162 53.904 54.599 -0.695 1 1 968 . 11 1 1 A 162 162 GLU CB C 162 33.773 33.231 0.542 1 1 970 . 11 1 1 A 162 162 GLU N N 162 122.300 126.279 -3.979 1 1 971 . 11 1 1 A 163 163 TYR H H 163 8.872 9.806 -0.934 1 1 972 . 11 1 1 A 163 163 TYR C C 163 173.425 174.480 -1.055 1 1 973 . 11 1 1 A 163 163 TYR CA C 163 56.192 56.892 -0.700 1 1 974 . 11 1 1 A 163 163 TYR CB C 163 40.870 43.309 -2.439 1 1 975 . 11 1 1 A 163 163 TYR N N 163 124.618 121.835 2.783 1 1 976 . 11 1 1 A 171 171 ASP C C 171 175.753 176.156 -0.403 1 1 977 . 11 1 1 A 171 171 ASP CA C 171 53.517 53.760 -0.243 1 1 978 . 11 1 1 A 171 171 ASP CB C 171 41.353 42.195 -0.842 1 1 979 . 11 1 1 A 172 172 ALA H H 172 8.336 8.587 -0.251 1 1 983 . 11 1 1 A 172 172 ALA C C 172 178.110 177.905 0.205 1 1 984 . 11 1 1 A 172 172 ALA CA C 172 52.190 54.501 -2.311 1 1 985 . 11 1 1 A 172 172 ALA CB C 172 18.305 19.958 -1.653 1 1 986 . 11 1 1 A 172 172 ALA N N 172 125.294 125.243 0.051 1 1 987 . 11 1 1 A 173 173 GLY H H 173 8.300 7.832 0.468 1 1 988 . 11 1 1 A 173 173 GLY C C 173 174.437 174.834 -0.397 1 1 989 . 11 1 1 A 173 173 GLY CA C 173 45.083 45.041 0.042 1 1 990 . 11 1 1 A 173 173 GLY N N 173 107.268 106.842 0.426 1 1 991 . 11 1 1 A 174 174 THR H H 174 7.754 8.347 -0.593 1 1 992 . 11 1 1 A 174 174 THR C C 174 174.738 173.938 0.800 1 1 993 . 11 1 1 A 174 174 THR CA C 174 61.310 62.431 -1.121 1 1 994 . 11 1 1 A 174 174 THR CB C 174 69.310 69.856 -0.546 1 1 996 . 11 1 1 A 174 174 THR N N 174 113.472 112.388 1.084 1 1 997 . 11 1 1 A 175 175 VAL H H 175 7.993 7.755 0.238 1 1 1004 . 11 1 1 A 175 175 VAL C C 175 176.535 174.045 2.490 1 1 1005 . 11 1 1 A 175 175 VAL CA C 175 62.126 59.565 2.561 1 1 1006 . 11 1 1 A 175 175 VAL CB C 175 31.282 35.097 -3.815 1 1 1009 . 11 1 1 A 175 175 VAL N N 175 121.643 121.305 0.338 1 1 1010 . 11 1 1 A 176 176 GLY H H 176 8.056 8.592 -0.536 1 1 1011 . 11 1 1 A 176 176 GLY C C 176 173.930 173.931 -0.001 1 1 1012 . 11 1 1 A 176 176 GLY CA C 176 44.983 44.799 0.184 1 1 1013 . 11 1 1 A 176 176 GLY N N 176 110.460 114.398 -3.938 1 1 1014 . 11 1 1 A 177 177 THR H H 177 7.520 8.525 -1.005 1 1 1015 . 11 1 1 A 177 177 THR C C 177 173.574 174.157 -0.583 1 1 1016 . 11 1 1 A 177 177 THR CA C 177 60.609 63.501 -2.892 1 1 1017 . 11 1 1 A 177 177 THR CB C 177 69.506 70.839 -1.333 1 1 1019 . 11 1 1 A 177 177 THR N N 177 113.390 119.085 -5.695 1 1 1020 . 11 1 1 A 178 178 ARG H H 178 8.261 7.772 0.489 1 1 1021 . 11 1 1 A 178 178 ARG C C 178 173.932 174.050 -0.118 1 1 1022 . 11 1 1 A 178 178 ARG CA C 178 53.683 53.036 0.647 1 1 1023 . 11 1 1 A 178 178 ARG CB C 178 29.224 30.252 -1.028 1 1 1026 . 11 1 1 A 178 178 ARG N N 178 123.906 118.900 5.006 1 1 1027 . 11 1 1 A 183 183 MET C C 183 174.053 174.392 -0.339 1 1 1028 . 11 1 1 A 183 183 MET CA C 183 53.700 54.721 -1.021 1 1 1029 . 11 1 1 A 183 183 MET CB C 183 35.908 35.748 0.160 1 1 1032 . 11 1 1 A 184 184 LEU H H 184 8.319 9.082 -0.763 1 1 1033 . 11 1 1 A 184 184 LEU C C 184 175.235 175.565 -0.330 1 1 1034 . 11 1 1 A 184 184 LEU CA C 184 53.120 53.445 -0.325 1 1 1035 . 11 1 1 A 184 184 LEU CB C 184 42.857 44.516 -1.659 1 1 1038 . 11 1 1 A 184 184 LEU N N 184 131.293 128.123 3.170 1 1 1039 . 11 1 1 A 185 185 SER H H 185 9.603 8.733 0.870 1 1 1040 . 11 1 1 A 185 185 SER C C 185 171.293 172.886 -1.593 1 1 1041 . 11 1 1 A 185 185 SER CA C 185 56.504 56.863 -0.359 1 1 1042 . 11 1 1 A 185 185 SER CB C 185 66.585 65.869 0.716 1 1 1043 . 11 1 1 A 185 185 SER N N 185 119.338 122.130 -2.792 1 1 1044 . 11 1 1 A 186 186 LEU H H 186 8.583 8.816 -0.233 1 1 1051 . 11 1 1 A 186 186 LEU C C 186 175.328 176.126 -0.798 1 1 1052 . 11 1 1 A 186 186 LEU CA C 186 52.729 53.075 -0.346 1 1 1053 . 11 1 1 A 186 186 LEU CB C 186 44.996 45.434 -0.438 1 1 1056 . 11 1 1 A 186 186 LEU N N 186 122.719 122.038 0.681 1 1 1057 . 11 1 1 A 187 187 GLY H H 187 9.287 8.306 0.981 1 1 1058 . 11 1 1 A 187 187 GLY C C 187 172.315 172.801 -0.486 1 1 1059 . 11 1 1 A 187 187 GLY CA C 187 43.502 45.535 -2.033 1 1 1060 . 11 1 1 A 187 187 GLY N N 187 110.265 108.320 1.945 1 1 1061 . 11 1 1 A 188 188 VAL H H 188 8.825 8.479 0.346 1 1 1068 . 11 1 1 A 188 188 VAL C C 188 173.125 173.774 -0.649 1 1 1069 . 11 1 1 A 188 188 VAL CA C 188 59.739 59.201 0.538 1 1 1070 . 11 1 1 A 188 188 VAL CB C 188 34.532 34.850 -0.318 1 1 1073 . 11 1 1 A 188 188 VAL N N 188 119.161 116.187 2.974 1 1 1074 . 11 1 1 A 189 189 SER H H 189 9.051 9.213 -0.162 1 1 1075 . 11 1 1 A 189 189 SER C C 189 171.698 172.400 -0.702 1 1 1076 . 11 1 1 A 189 189 SER CA C 189 55.997 56.176 -0.179 1 1 1077 . 11 1 1 A 189 189 SER CB C 189 66.094 66.808 -0.714 1 1 1078 . 11 1 1 A 189 189 SER N N 189 117.810 119.297 -1.487 1 1 1079 . 11 1 1 A 190 190 TYR H H 190 9.145 9.281 -0.136 1 1 1080 . 11 1 1 A 190 190 TYR C C 190 174.063 174.574 -0.511 1 1 1081 . 11 1 1 A 190 190 TYR CA C 190 55.375 56.386 -1.011 1 1 1082 . 11 1 1 A 190 190 TYR CB C 190 41.183 42.037 -0.854 1 1 1083 . 11 1 1 A 190 190 TYR N N 190 123.690 122.171 1.519 1 1 1084 . 11 1 1 A 191 191 ARG H H 191 8.211 8.832 -0.621 1 1 1085 . 11 1 1 A 191 191 ARG C C 191 174.826 174.754 0.072 1 1 1086 . 11 1 1 A 191 191 ARG CA C 191 54.464 54.301 0.163 1 1 1087 . 11 1 1 A 191 191 ARG CB C 191 30.507 33.707 -3.200 1 1 1090 . 11 1 1 A 191 191 ARG N N 191 125.366 120.421 4.945 1 1 1091 . 11 1 1 A 192 192 PHE H H 192 8.496 7.835 0.661 1 1 1092 . 11 1 1 A 192 192 PHE C C 192 176.384 174.741 1.643 1 1 1093 . 11 1 1 A 192 192 PHE CA C 192 57.179 56.056 1.123 1 1 1094 . 11 1 1 A 192 192 PHE CB C 192 39.430 42.268 -2.838 1 1 1095 . 11 1 1 A 192 192 PHE N N 192 121.586 118.693 2.893 1 1 1096 . 11 1 1 A 193 193 GLY H H 193 8.643 8.399 0.244 1 1 1097 . 11 1 1 A 193 193 GLY C C 193 174.466 171.847 2.619 1 1 1098 . 11 1 1 A 193 193 GLY CA C 193 45.126 45.178 -0.052 1 1 1099 . 11 1 1 A 193 193 GLY N N 193 109.499 110.059 -0.560 1 1 1100 . 11 1 1 A 194 194 GLN H H 194 8.512 8.459 0.053 1 1 1101 . 11 1 1 A 194 194 GLN C C 194 176.201 174.212 1.989 1 1 1102 . 11 1 1 A 194 194 GLN CA C 194 55.433 53.836 1.597 1 1 1103 . 11 1 1 A 194 194 GLN CB C 194 28.729 32.180 -3.451 1 1 1105 . 11 1 1 A 194 194 GLN N N 194 119.448 120.580 -1.132 1 1 1106 . 11 1 1 A 195 195 GLU H H 195 8.530 8.644 -0.114 1 1 1107 . 11 1 1 A 195 195 GLU C C 195 176.151 175.623 0.528 1 1 1108 . 11 1 1 A 195 195 GLU CA C 195 56.256 55.133 1.123 1 1 1109 . 11 1 1 A 195 195 GLU CB C 195 29.486 31.626 -2.140 1 1 1111 . 11 1 1 A 195 195 GLU N N 195 121.959 122.301 -0.342 1 1 1112 . 11 1 1 A 196 196 ASP H H 196 8.253 8.528 -0.275 1 1 1113 . 11 1 1 A 196 196 ASP C C 196 175.667 176.956 -1.289 1 1 1114 . 11 1 1 A 196 196 ASP CA C 196 53.981 53.423 0.558 1 1 1115 . 11 1 1 A 196 196 ASP CB C 196 40.700 41.976 -1.276 1 1 1116 . 11 1 1 A 196 196 ASP N N 196 121.819 122.526 -0.707 1 1 1117 . 11 1 1 A 197 197 ALA H H 197 7.999 8.366 -0.367 1 1 1121 . 11 1 1 A 197 197 ALA C C 197 176.847 175.974 0.873 1 1 1122 . 11 1 1 A 197 197 ALA CA C 197 51.612 51.771 -0.159 1 1 1123 . 11 1 1 A 197 197 ALA CB C 197 18.192 19.119 -0.927 1 1 1124 . 11 1 1 A 197 197 ALA N N 197 124.262 123.504 0.758 1 1 1125 . 11 1 1 A 198 198 ALA H H 198 8.042 7.526 0.516 1 1 1126 . 11 1 1 A 198 198 ALA C C 198 176.865 175.505 1.360 1 1 1127 . 11 1 1 A 198 198 ALA CA C 198 49.999 49.094 0.905 1 1 1128 . 11 1 1 A 198 198 ALA CB C 198 17.327 21.840 -4.513 1 1 1129 . 11 1 1 A 198 198 ALA N N 198 124.724 120.832 3.892 1 1 1130 . 11 1 1 A 199 199 PRO C C 199 176.727 176.212 0.515 1 1 1131 . 11 1 1 A 199 199 PRO CA C 199 62.399 62.238 0.161 1 1 1132 . 11 1 1 A 199 199 PRO CB C 199 30.949 33.236 -2.287 1 1 1135 . 11 1 1 A 200 200 VAL H H 200 8.026 8.403 -0.377 1 1 1142 . 11 1 1 A 200 200 VAL C C 200 176.034 178.133 -2.099 1 1 1143 . 11 1 1 A 200 200 VAL CA C 200 61.944 64.487 -2.543 1 1 1144 . 11 1 1 A 200 200 VAL CB C 200 31.734 32.002 -0.268 1 1 1147 . 11 1 1 A 200 200 VAL N N 200 120.635 118.171 2.464 1 1 1148 . 11 1 1 A 201 201 VAL H H 201 7.966 7.659 0.307 1 1 1155 . 11 1 1 A 201 201 VAL C C 201 175.128 176.251 -1.123 1 1 1156 . 11 1 1 A 201 201 VAL CA C 201 61.249 65.514 -4.265 1 1 1157 . 11 1 1 A 201 201 VAL CB C 201 31.917 32.059 -0.142 1 1 1160 . 11 1 1 A 201 201 VAL N N 201 124.053 120.570 3.483 1 1 1161 . 11 1 1 A 202 202 ALA H H 202 8.159 7.639 0.520 1 1 1162 . 11 1 1 A 202 202 ALA C C 202 175.153 175.691 -0.538 1 1 1163 . 11 1 1 A 202 202 ALA CA C 202 49.742 50.626 -0.884 1 1 1164 . 11 1 1 A 202 202 ALA CB C 202 17.532 19.304 -1.772 1 1 1165 . 11 1 1 A 202 202 ALA N N 202 129.251 123.787 5.464 1 1 1166 . 11 1 1 A 203 203 PRO C C 203 176.273 177.396 -1.123 1 1 1167 . 11 1 1 A 203 203 PRO CA C 203 62.324 62.761 -0.437 1 1 1168 . 11 1 1 A 203 203 PRO CB C 203 31.042 32.123 -1.081 1 1 1170 . 11 1 1 A 204 204 ALA H H 204 8.137 8.607 -0.470 1 1 1171 . 11 1 1 A 204 204 ALA C C 204 175.697 178.840 -3.143 1 1 1172 . 11 1 1 A 204 204 ALA CA C 204 49.865 55.731 -5.866 1 1 1173 . 11 1 1 A 204 204 ALA CB C 204 17.364 18.413 -1.049 1 1 1174 . 11 1 1 A 204 204 ALA N N 204 125.510 125.702 -0.192 1 1 1175 . 11 1 1 A 205 205 PRO C C 205 175.430 175.909 -0.479 1 1 1176 . 11 1 1 A 205 205 PRO CA C 205 62.511 62.450 0.061 1 1 1177 . 11 1 1 A 205 205 PRO CB C 205 31.056 33.226 -2.170 1 1 1179 . 11 1 1 A 206 206 ALA H H 206 7.847 8.213 -0.366 1 1 1180 . 11 1 1 A 206 206 ALA C C 206 175.565 175.836 -0.271 1 1 1181 . 11 1 1 A 206 206 ALA CA C 206 49.487 49.768 -0.281 1 1 1182 . 11 1 1 A 206 206 ALA CB C 206 18.843 20.327 -1.484 1 1 1183 . 11 1 1 A 206 206 ALA N N 206 123.663 122.339 1.324 1 1 1184 . 11 1 1 A 207 207 PRO C C 207 174.397 175.655 -1.258 1 1 1185 . 11 1 1 A 207 207 PRO CA C 207 61.454 62.202 -0.748 1 1 1186 . 11 1 1 A 207 207 PRO CB C 207 31.929 29.811 2.118 1 1 1187 . 11 1 1 A 208 208 ALA H H 208 7.898 7.944 -0.046 1 1 1188 . 11 1 1 A 208 208 ALA C C 208 175.411 176.081 -0.670 1 1 1189 . 11 1 1 A 208 208 ALA CA C 208 49.472 50.421 -0.949 1 1 1190 . 11 1 1 A 208 208 ALA CB C 208 19.082 18.344 0.738 1 1 1191 . 11 1 1 A 208 208 ALA N N 208 127.450 125.361 2.089 1 1 1192 . 11 1 1 A 209 209 PRO C C 209 176.932 175.518 1.414 1 1 1193 . 11 1 1 A 209 209 PRO CA C 209 62.736 62.424 0.312 1 1 1194 . 11 1 1 A 209 209 PRO CB C 209 31.012 30.204 0.808 1 1 1 . 12 1 1 A 2 2 ARG C C 2 175.857 174.643 1.214 1 1 2 . 12 1 1 A 2 2 ARG CA C 2 55.872 55.303 0.569 1 1 3 . 12 1 1 A 2 2 ARG CB C 2 29.983 31.116 -1.133 1 1 5 . 12 1 1 A 3 3 ILE H H 3 8.238 7.498 0.740 1 1 9 . 12 1 1 A 3 3 ILE C C 3 175.763 174.367 1.396 1 1 10 . 12 1 1 A 3 3 ILE CA C 3 60.779 59.923 0.856 1 1 11 . 12 1 1 A 3 3 ILE CB C 3 37.664 43.309 -5.645 1 1 15 . 12 1 1 A 3 3 ILE N N 3 122.580 120.498 2.082 1 1 16 . 12 1 1 A 4 4 MET H H 4 8.261 8.599 -0.338 1 1 17 . 12 1 1 A 4 4 MET C C 4 175.660 174.686 0.974 1 1 18 . 12 1 1 A 4 4 MET CA C 4 54.893 55.236 -0.343 1 1 19 . 12 1 1 A 4 4 MET CB C 4 32.060 36.565 -4.505 1 1 22 . 12 1 1 A 4 4 MET N N 4 123.988 124.938 -0.950 1 1 23 . 12 1 1 A 5 5 LYS H H 5 8.041 8.636 -0.595 1 1 24 . 12 1 1 A 5 5 LYS C C 5 175.850 175.687 0.163 1 1 25 . 12 1 1 A 5 5 LYS CA C 5 56.081 57.097 -1.016 1 1 26 . 12 1 1 A 5 5 LYS CB C 5 32.220 33.054 -0.834 1 1 29 . 12 1 1 A 5 5 LYS N N 5 122.015 124.210 -2.195 1 1 30 . 12 1 1 A 6 6 ALA H H 6 8.042 8.451 -0.409 1 1 34 . 12 1 1 A 6 6 ALA C C 6 177.160 176.543 0.617 1 1 35 . 12 1 1 A 6 6 ALA CA C 6 52.109 50.747 1.362 1 1 36 . 12 1 1 A 6 6 ALA CB C 6 18.637 19.737 -1.100 1 1 37 . 12 1 1 A 6 6 ALA N N 6 123.943 127.075 -3.132 1 1 38 . 12 1 1 A 7 7 ILE H H 7 7.916 8.352 -0.436 1 1 42 . 12 1 1 A 7 7 ILE C C 7 175.611 176.254 -0.643 1 1 43 . 12 1 1 A 7 7 ILE CA C 7 61.181 60.343 0.838 1 1 44 . 12 1 1 A 7 7 ILE CB C 7 37.910 39.172 -1.262 1 1 48 . 12 1 1 A 7 7 ILE N N 7 118.380 123.329 -4.949 1 1 49 . 12 1 1 A 8 8 PHE H H 8 8.167 8.132 0.035 1 1 50 . 12 1 1 A 8 8 PHE C C 8 175.363 175.441 -0.078 1 1 51 . 12 1 1 A 8 8 PHE CA C 8 57.286 59.418 -2.132 1 1 52 . 12 1 1 A 8 8 PHE CB C 8 39.008 40.756 -1.748 1 1 53 . 12 1 1 A 8 8 PHE N N 8 121.971 123.428 -1.457 1 1 54 . 12 1 1 A 9 9 VAL H H 9 7.872 7.858 0.014 1 1 61 . 12 1 1 A 9 9 VAL C C 9 175.405 175.099 0.306 1 1 62 . 12 1 1 A 9 9 VAL CA C 9 61.662 59.529 2.133 1 1 63 . 12 1 1 A 9 9 VAL CB C 9 32.026 35.724 -3.698 1 1 66 . 12 1 1 A 9 9 VAL N N 9 120.864 114.025 6.839 1 1 67 . 12 1 1 A 10 10 LEU H H 10 8.077 8.893 -0.816 1 1 74 . 12 1 1 A 10 10 LEU C C 10 176.652 176.234 0.418 1 1 75 . 12 1 1 A 10 10 LEU CA C 10 54.856 55.966 -1.110 1 1 76 . 12 1 1 A 10 10 LEU CB C 10 41.401 45.234 -3.833 1 1 80 . 12 1 1 A 10 10 LEU N N 10 124.826 125.306 -0.480 1 1 81 . 12 1 1 A 11 11 ASN H H 11 8.177 8.006 0.171 1 1 82 . 12 1 1 A 11 11 ASN C C 11 174.394 175.380 -0.986 1 1 83 . 12 1 1 A 11 11 ASN CA C 11 52.704 53.359 -0.655 1 1 84 . 12 1 1 A 11 11 ASN CB C 11 38.468 38.727 -0.259 1 1 85 . 12 1 1 A 11 11 ASN N N 11 119.029 117.995 1.034 1 1 86 . 12 1 1 A 12 12 ALA H H 12 7.991 8.544 -0.553 1 1 90 . 12 1 1 A 12 12 ALA C C 12 176.649 176.824 -0.175 1 1 91 . 12 1 1 A 12 12 ALA CA C 12 51.950 50.960 0.990 1 1 92 . 12 1 1 A 12 12 ALA CB C 12 18.659 19.679 -1.020 1 1 93 . 12 1 1 A 12 12 ALA N N 12 123.695 129.282 -5.587 1 1 94 . 12 1 1 A 13 13 ALA H H 13 8.083 7.554 0.529 1 1 95 . 12 1 1 A 13 13 ALA C C 13 175.395 176.070 -0.675 1 1 96 . 12 1 1 A 13 13 ALA CA C 13 49.797 49.304 0.493 1 1 97 . 12 1 1 A 13 13 ALA CB C 13 17.486 19.706 -2.220 1 1 98 . 12 1 1 A 13 13 ALA N N 13 124.281 121.627 2.654 1 1 99 . 12 1 1 A 14 14 PRO C C 14 176.641 175.621 1.020 1 1 100 . 12 1 1 A 14 14 PRO CA C 14 62.675 62.454 0.221 1 1 101 . 12 1 1 A 14 14 PRO CB C 14 31.000 33.300 -2.300 1 1 103 . 12 1 1 A 15 15 LYS H H 15 8.283 8.525 -0.242 1 1 104 . 12 1 1 A 15 15 LYS C C 15 175.683 175.189 0.494 1 1 105 . 12 1 1 A 15 15 LYS CA C 15 55.429 55.542 -0.113 1 1 106 . 12 1 1 A 15 15 LYS CB C 15 32.246 31.674 0.572 1 1 109 . 12 1 1 A 15 15 LYS N N 15 119.069 121.189 -2.120 1 1 110 . 12 1 1 A 16 16 ASP H H 16 7.880 8.746 -0.866 1 1 111 . 12 1 1 A 16 16 ASP C C 16 175.419 175.746 -0.327 1 1 112 . 12 1 1 A 16 16 ASP CA C 16 54.413 53.750 0.663 1 1 113 . 12 1 1 A 16 16 ASP CB C 16 40.224 42.439 -2.215 1 1 114 . 12 1 1 A 16 16 ASP N N 16 119.625 124.422 -4.797 1 1 115 . 12 1 1 A 17 17 ASN H H 17 7.973 8.848 -0.875 1 1 116 . 12 1 1 A 17 17 ASN C C 17 174.231 174.519 -0.288 1 1 117 . 12 1 1 A 17 17 ASN CA C 17 53.948 52.594 1.354 1 1 118 . 12 1 1 A 17 17 ASN CB C 17 37.009 39.153 -2.144 1 1 119 . 12 1 1 A 17 17 ASN N N 17 118.063 120.634 -2.571 1 1 120 . 12 1 1 A 18 18 THR H H 18 7.318 9.346 -2.028 1 1 121 . 12 1 1 A 18 18 THR C C 18 172.323 174.371 -2.048 1 1 122 . 12 1 1 A 18 18 THR CA C 18 60.153 61.996 -1.843 1 1 123 . 12 1 1 A 18 18 THR CB C 18 71.534 70.685 0.849 1 1 125 . 12 1 1 A 18 18 THR N N 18 109.092 120.871 -11.779 1 1 126 . 12 1 1 A 19 19 TRP H H 19 8.541 9.359 -0.818 1 1 127 . 12 1 1 A 19 19 TRP C C 19 175.969 175.135 0.834 1 1 128 . 12 1 1 A 19 19 TRP CA C 19 55.700 55.987 -0.287 1 1 129 . 12 1 1 A 19 19 TRP CB C 19 31.471 32.993 -1.522 1 1 130 . 12 1 1 A 19 19 TRP N N 19 121.992 126.274 -4.282 1 1 131 . 12 1 1 A 20 20 TYR H H 20 8.691 9.105 -0.414 1 1 132 . 12 1 1 A 20 20 TYR C C 20 173.684 174.383 -0.699 1 1 133 . 12 1 1 A 20 20 TYR CA C 20 55.805 56.728 -0.923 1 1 134 . 12 1 1 A 20 20 TYR CB C 20 40.513 42.866 -2.353 1 1 135 . 12 1 1 A 20 20 TYR N N 20 116.519 123.097 -6.578 1 1 136 . 12 1 1 A 21 21 ALA H H 21 8.876 9.079 -0.203 1 1 137 . 12 1 1 A 21 21 ALA C C 21 175.395 176.173 -0.778 1 1 138 . 12 1 1 A 21 21 ALA CA C 21 50.970 51.335 -0.365 1 1 139 . 12 1 1 A 21 21 ALA CB C 21 22.142 23.445 -1.303 1 1 140 . 12 1 1 A 21 21 ALA N N 21 119.359 127.432 -8.073 1 1 141 . 12 1 1 A 22 22 GLY H H 22 8.613 7.994 0.619 1 1 142 . 12 1 1 A 22 22 GLY C C 22 171.458 171.311 0.147 1 1 143 . 12 1 1 A 22 22 GLY CA C 22 45.608 45.878 -0.270 1 1 144 . 12 1 1 A 22 22 GLY N N 22 106.678 106.096 0.582 1 1 145 . 12 1 1 A 23 23 GLY H H 23 7.911 8.276 -0.365 1 1 146 . 12 1 1 A 23 23 GLY C C 23 170.563 171.891 -1.328 1 1 147 . 12 1 1 A 23 23 GLY CA C 23 44.026 44.309 -0.283 1 1 148 . 12 1 1 A 23 23 GLY N N 23 103.399 108.394 -4.995 1 1 149 . 12 1 1 A 24 24 LYS H H 24 9.001 9.529 -0.528 1 1 150 . 12 1 1 A 24 24 LYS C C 24 172.965 174.494 -1.529 1 1 151 . 12 1 1 A 24 24 LYS CA C 24 54.062 54.933 -0.871 1 1 152 . 12 1 1 A 24 24 LYS CB C 24 36.774 36.339 0.435 1 1 156 . 12 1 1 A 24 24 LYS N N 24 116.402 122.723 -6.321 1 1 157 . 12 1 1 A 25 25 LEU H H 25 8.587 8.972 -0.385 1 1 164 . 12 1 1 A 25 25 LEU C C 25 175.205 175.365 -0.160 1 1 165 . 12 1 1 A 25 25 LEU CA C 25 53.446 53.561 -0.115 1 1 166 . 12 1 1 A 25 25 LEU CB C 25 46.287 46.797 -0.510 1 1 170 . 12 1 1 A 25 25 LEU N N 25 119.932 125.876 -5.944 1 1 171 . 12 1 1 A 26 26 GLY H H 26 8.637 8.369 0.268 1 1 172 . 12 1 1 A 26 26 GLY C C 26 170.804 171.721 -0.917 1 1 173 . 12 1 1 A 26 26 GLY CA C 26 45.669 46.087 -0.418 1 1 174 . 12 1 1 A 26 26 GLY N N 26 108.136 110.906 -2.770 1 1 175 . 12 1 1 A 27 27 TRP H H 27 8.642 8.623 0.019 1 1 177 . 12 1 1 A 27 27 TRP C C 27 174.820 175.780 -0.960 1 1 178 . 12 1 1 A 27 27 TRP CB C 27 30.883 31.702 -0.819 1 1 179 . 12 1 1 A 27 27 TRP N N 27 120.887 120.816 0.071 1 1 181 . 12 1 1 A 32 32 ASP C C 32 176.315 175.403 0.912 1 1 182 . 12 1 1 A 32 32 ASP CA C 32 53.737 54.614 -0.877 1 1 183 . 12 1 1 A 32 32 ASP CB C 32 41.230 42.797 -1.567 1 1 184 . 12 1 1 A 33 33 THR H H 33 8.190 7.996 0.194 1 1 188 . 12 1 1 A 33 33 THR C C 33 175.291 174.500 0.791 1 1 189 . 12 1 1 A 33 33 THR CA C 33 61.909 60.293 1.616 1 1 190 . 12 1 1 A 33 33 THR CB C 33 68.961 71.180 -2.219 1 1 192 . 12 1 1 A 33 33 THR N N 33 114.235 110.226 4.009 1 1 193 . 12 1 1 A 34 34 GLY H H 34 8.341 8.849 -0.508 1 1 194 . 12 1 1 A 34 34 GLY C C 34 173.766 174.415 -0.649 1 1 195 . 12 1 1 A 34 34 GLY CA C 34 44.941 46.116 -1.175 1 1 196 . 12 1 1 A 34 34 GLY N N 34 110.678 112.390 -1.712 1 1 197 . 12 1 1 A 35 35 PHE H H 35 7.945 7.856 0.089 1 1 198 . 12 1 1 A 35 35 PHE C C 35 175.411 174.407 1.004 1 1 199 . 12 1 1 A 35 35 PHE CA C 35 57.921 57.503 0.418 1 1 200 . 12 1 1 A 35 35 PHE CB C 35 38.806 39.443 -0.637 1 1 201 . 12 1 1 A 35 35 PHE N N 35 120.533 119.205 1.328 1 1 202 . 12 1 1 A 36 36 TYR H H 36 7.967 7.793 0.174 1 1 203 . 12 1 1 A 36 36 TYR C C 36 176.104 175.892 0.212 1 1 204 . 12 1 1 A 36 36 TYR CA C 36 57.568 58.075 -0.507 1 1 205 . 12 1 1 A 36 36 TYR CB C 36 37.727 39.531 -1.804 1 1 206 . 12 1 1 A 36 36 TYR N N 36 120.254 118.180 2.074 1 1 207 . 12 1 1 A 37 37 GLY H H 37 7.666 8.562 -0.896 1 1 208 . 12 1 1 A 37 37 GLY C C 37 173.794 174.838 -1.044 1 1 209 . 12 1 1 A 37 37 GLY CA C 37 45.007 45.865 -0.858 1 1 210 . 12 1 1 A 37 37 GLY N N 37 108.995 107.624 1.371 1 1 211 . 12 1 1 A 38 38 ASN H H 38 8.109 8.758 -0.649 1 1 212 . 12 1 1 A 38 38 ASN C C 38 175.612 176.928 -1.316 1 1 213 . 12 1 1 A 38 38 ASN CA C 38 52.954 55.873 -2.919 1 1 214 . 12 1 1 A 38 38 ASN CB C 38 38.425 37.965 0.460 1 1 215 . 12 1 1 A 38 38 ASN N N 38 118.603 117.667 0.936 1 1 216 . 12 1 1 A 39 39 GLY H H 39 8.202 7.765 0.437 1 1 217 . 12 1 1 A 39 39 GLY C C 39 173.958 172.873 1.085 1 1 218 . 12 1 1 A 39 39 GLY CA C 39 45.012 44.231 0.781 1 1 219 . 12 1 1 A 39 39 GLY N N 39 108.897 108.015 0.882 1 1 220 . 12 1 1 A 40 40 PHE H H 40 7.960 7.851 0.109 1 1 221 . 12 1 1 A 40 40 PHE C C 40 175.653 173.478 2.175 1 1 222 . 12 1 1 A 40 40 PHE CA C 40 57.556 55.120 2.436 1 1 223 . 12 1 1 A 40 40 PHE CB C 40 38.513 42.559 -4.046 1 1 224 . 12 1 1 A 40 40 PHE N N 40 119.829 118.714 1.115 1 1 225 . 12 1 1 A 41 41 GLN H H 41 8.173 8.725 -0.552 1 1 226 . 12 1 1 A 41 41 GLN C C 41 175.234 175.652 -0.418 1 1 227 . 12 1 1 A 41 41 GLN CA C 41 55.488 54.475 1.013 1 1 228 . 12 1 1 A 41 41 GLN CB C 41 28.523 29.601 -1.078 1 1 230 . 12 1 1 A 41 41 GLN N N 41 120.810 121.195 -0.385 1 1 231 . 12 1 1 A 42 42 ASN H H 42 8.193 8.470 -0.277 1 1 232 . 12 1 1 A 42 42 ASN C C 42 174.618 175.677 -1.059 1 1 233 . 12 1 1 A 42 42 ASN CA C 42 52.924 53.992 -1.068 1 1 234 . 12 1 1 A 42 42 ASN CB C 42 38.333 39.931 -1.598 1 1 235 . 12 1 1 A 42 42 ASN N N 42 119.679 124.966 -5.287 1 1 236 . 12 1 1 A 43 43 ASN H H 43 8.255 7.942 0.313 1 1 237 . 12 1 1 A 43 43 ASN C C 43 173.873 174.334 -0.461 1 1 238 . 12 1 1 A 43 43 ASN CA C 43 52.919 54.065 -1.146 1 1 239 . 12 1 1 A 43 43 ASN CB C 43 38.580 39.077 -0.497 1 1 240 . 12 1 1 A 43 43 ASN N N 43 119.773 117.814 1.959 1 1 241 . 12 1 1 A 44 44 ASN H H 44 7.865 8.616 -0.751 1 1 242 . 12 1 1 A 44 44 ASN C C 44 175.518 174.179 1.339 1 1 243 . 12 1 1 A 44 44 ASN CA C 44 54.528 51.748 2.780 1 1 244 . 12 1 1 A 44 44 ASN CB C 44 40.170 42.435 -2.265 1 1 246 . 12 1 1 A 44 44 ASN N N 44 124.152 118.408 5.744 1 1 247 . 12 1 1 A 46 46 PRO C C 46 177.228 176.183 1.045 1 1 248 . 12 1 1 A 46 46 PRO CA C 46 62.794 65.372 -2.578 1 1 249 . 12 1 1 A 46 46 PRO CB C 46 31.283 31.715 -0.432 1 1 251 . 12 1 1 A 47 47 THR H H 47 8.165 7.488 0.677 1 1 255 . 12 1 1 A 47 47 THR C C 47 174.573 172.903 1.670 1 1 256 . 12 1 1 A 47 47 THR CA C 47 61.346 59.799 1.547 1 1 257 . 12 1 1 A 47 47 THR CB C 47 69.573 72.207 -2.634 1 1 259 . 12 1 1 A 47 47 THR N N 47 114.265 105.977 8.288 1 1 260 . 12 1 1 A 48 48 ARG H H 48 8.237 8.206 0.031 1 1 261 . 12 1 1 A 48 48 ARG C C 48 175.898 176.169 -0.271 1 1 262 . 12 1 1 A 48 48 ARG CA C 48 55.717 55.998 -0.281 1 1 263 . 12 1 1 A 48 48 ARG CB C 48 30.151 31.557 -1.406 1 1 266 . 12 1 1 A 48 48 ARG N N 48 122.795 120.893 1.902 1 1 267 . 12 1 1 A 49 49 ASN H H 49 8.369 8.856 -0.487 1 1 268 . 12 1 1 A 49 49 ASN C C 49 174.560 174.648 -0.088 1 1 269 . 12 1 1 A 49 49 ASN CA C 49 53.005 52.298 0.707 1 1 270 . 12 1 1 A 49 49 ASN CB C 49 38.761 39.146 -0.385 1 1 271 . 12 1 1 A 49 49 ASN N N 49 119.837 121.323 -1.486 1 1 272 . 12 1 1 A 50 50 ASP H H 50 8.192 8.875 -0.683 1 1 273 . 12 1 1 A 50 50 ASP C C 50 175.699 174.956 0.743 1 1 274 . 12 1 1 A 50 50 ASP CA C 50 54.289 53.141 1.148 1 1 275 . 12 1 1 A 50 50 ASP CB C 50 41.264 43.217 -1.953 1 1 276 . 12 1 1 A 50 50 ASP N N 50 120.403 125.000 -4.597 1 1 277 . 12 1 1 A 51 51 GLN H H 51 8.428 8.234 0.194 1 1 278 . 12 1 1 A 51 51 GLN C C 51 175.186 174.824 0.362 1 1 279 . 12 1 1 A 51 51 GLN CA C 51 54.512 54.445 0.067 1 1 280 . 12 1 1 A 51 51 GLN CB C 51 30.424 29.612 0.812 1 1 282 . 12 1 1 A 51 51 GLN N N 51 118.959 118.722 0.237 1 1 289 . 12 1 1 A 52 52 LEU C C 52 176.018 175.727 0.291 1 1 290 . 12 1 1 A 52 52 LEU CA C 52 54.332 52.643 1.689 1 1 291 . 12 1 1 A 52 52 LEU CB C 52 43.022 43.792 -0.770 1 1 294 . 12 1 1 A 53 53 GLY H H 53 8.639 8.515 0.124 1 1 295 . 12 1 1 A 53 53 GLY C C 53 171.931 172.076 -0.145 1 1 296 . 12 1 1 A 53 53 GLY CA C 53 43.501 44.230 -0.729 1 1 297 . 12 1 1 A 53 53 GLY N N 53 109.964 106.695 3.269 1 1 298 . 12 1 1 A 54 54 ALA H H 54 8.881 8.808 0.073 1 1 299 . 12 1 1 A 54 54 ALA C C 54 175.543 176.787 -1.244 1 1 300 . 12 1 1 A 54 54 ALA CA C 54 50.710 51.196 -0.486 1 1 301 . 12 1 1 A 54 54 ALA CB C 54 22.914 24.071 -1.157 1 1 302 . 12 1 1 A 54 54 ALA N N 54 120.413 123.251 -2.838 1 1 303 . 12 1 1 A 55 55 GLY H H 55 8.346 8.610 -0.264 1 1 304 . 12 1 1 A 55 55 GLY C C 55 170.960 172.047 -1.087 1 1 305 . 12 1 1 A 55 55 GLY CA C 55 46.704 45.827 0.877 1 1 306 . 12 1 1 A 55 55 GLY N N 55 104.688 106.126 -1.438 1 1 307 . 12 1 1 A 56 56 ALA H H 56 9.116 8.640 0.476 1 1 308 . 12 1 1 A 56 56 ALA C C 56 176.472 176.306 0.166 1 1 309 . 12 1 1 A 56 56 ALA CA C 56 49.638 50.821 -1.183 1 1 310 . 12 1 1 A 56 56 ALA CB C 56 22.275 21.340 0.935 1 1 311 . 12 1 1 A 56 56 ALA N N 56 120.608 123.242 -2.634 1 1 312 . 12 1 1 A 57 57 PHE H H 57 8.688 8.334 0.354 1 1 313 . 12 1 1 A 57 57 PHE C C 57 172.816 174.346 -1.530 1 1 314 . 12 1 1 A 57 57 PHE CA C 57 56.066 55.005 1.061 1 1 315 . 12 1 1 A 57 57 PHE CB C 57 41.770 42.130 -0.360 1 1 316 . 12 1 1 A 57 57 PHE N N 57 120.027 119.016 1.011 1 1 317 . 12 1 1 A 58 58 GLY H H 58 9.034 8.836 0.198 1 1 318 . 12 1 1 A 58 58 GLY C C 58 170.860 172.765 -1.905 1 1 319 . 12 1 1 A 58 58 GLY CA C 58 44.954 44.904 0.050 1 1 320 . 12 1 1 A 58 58 GLY N N 58 105.817 106.781 -0.964 1 1 321 . 12 1 1 A 59 59 GLY H H 59 8.382 8.687 -0.305 1 1 322 . 12 1 1 A 59 59 GLY C C 59 169.284 172.139 -2.855 1 1 323 . 12 1 1 A 59 59 GLY CA C 59 45.840 45.587 0.253 1 1 324 . 12 1 1 A 59 59 GLY N N 59 109.059 109.869 -0.810 1 1 325 . 12 1 1 A 60 60 TYR H H 60 8.430 8.688 -0.258 1 1 326 . 12 1 1 A 60 60 TYR C C 60 173.453 172.151 1.302 1 1 327 . 12 1 1 A 60 60 TYR CA C 60 55.282 56.132 -0.850 1 1 328 . 12 1 1 A 60 60 TYR CB C 60 41.712 40.369 1.343 1 1 329 . 12 1 1 A 60 60 TYR N N 60 118.352 115.104 3.248 1 1 330 . 12 1 1 A 61 61 GLN H H 61 8.833 8.486 0.347 1 1 331 . 12 1 1 A 61 61 GLN C C 61 174.365 175.092 -0.727 1 1 332 . 12 1 1 A 61 61 GLN CA C 61 54.125 54.896 -0.771 1 1 333 . 12 1 1 A 61 61 GLN CB C 61 28.033 31.064 -3.031 1 1 335 . 12 1 1 A 61 61 GLN N N 61 129.628 120.586 9.042 1 1 336 . 12 1 1 A 62 62 VAL H H 62 8.714 8.649 0.065 1 1 343 . 12 1 1 A 62 62 VAL C C 62 175.758 175.516 0.242 1 1 344 . 12 1 1 A 62 62 VAL CA C 62 64.649 63.582 1.067 1 1 345 . 12 1 1 A 62 62 VAL CB C 62 31.900 33.707 -1.807 1 1 348 . 12 1 1 A 62 62 VAL N N 62 127.666 123.615 4.051 1 1 349 . 12 1 1 A 63 63 ASN H H 63 8.062 7.926 0.136 1 1 350 . 12 1 1 A 63 63 ASN C C 63 172.827 174.127 -1.300 1 1 351 . 12 1 1 A 63 63 ASN CA C 63 51.575 50.829 0.746 1 1 352 . 12 1 1 A 63 63 ASN CB C 63 37.194 38.874 -1.680 1 1 353 . 12 1 1 A 63 63 ASN N N 63 116.310 117.465 -1.155 1 1 354 . 12 1 1 A 64 64 PRO C C 64 175.071 174.858 0.213 1 1 355 . 12 1 1 A 64 64 PRO CA C 64 65.296 62.431 2.865 1 1 356 . 12 1 1 A 64 64 PRO CB C 64 30.428 29.080 1.348 1 1 357 . 12 1 1 A 65 65 TYR H H 65 7.873 8.817 -0.944 1 1 358 . 12 1 1 A 65 65 TYR C C 65 175.145 175.566 -0.421 1 1 359 . 12 1 1 A 65 65 TYR CA C 65 56.125 58.911 -2.786 1 1 360 . 12 1 1 A 65 65 TYR CB C 65 39.189 41.012 -1.823 1 1 361 . 12 1 1 A 65 65 TYR N N 65 112.894 121.921 -9.027 1 1 362 . 12 1 1 A 66 66 LEU H H 66 7.308 7.731 -0.423 1 1 369 . 12 1 1 A 66 66 LEU C C 66 173.866 174.644 -0.778 1 1 370 . 12 1 1 A 66 66 LEU CA C 66 53.431 54.031 -0.600 1 1 371 . 12 1 1 A 66 66 LEU CB C 66 44.958 44.214 0.744 1 1 375 . 12 1 1 A 66 66 LEU N N 66 120.270 115.977 4.293 1 1 376 . 12 1 1 A 67 67 GLY H H 67 8.855 8.534 0.321 1 1 377 . 12 1 1 A 67 67 GLY C C 67 170.698 171.794 -1.096 1 1 378 . 12 1 1 A 67 67 GLY CA C 67 44.008 44.560 -0.552 1 1 379 . 12 1 1 A 67 67 GLY N N 67 114.388 106.703 7.685 1 1 380 . 12 1 1 A 68 68 PHE H H 68 8.770 8.254 0.516 1 1 381 . 12 1 1 A 68 68 PHE C C 68 173.386 174.309 -0.923 1 1 382 . 12 1 1 A 68 68 PHE CA C 68 56.507 56.455 0.052 1 1 383 . 12 1 1 A 68 68 PHE CB C 68 42.428 42.089 0.339 1 1 384 . 12 1 1 A 68 68 PHE N N 68 117.510 121.295 -3.785 1 1 385 . 12 1 1 A 69 69 GLU H H 69 9.079 8.626 0.453 1 1 386 . 12 1 1 A 69 69 GLU C C 69 174.556 175.188 -0.632 1 1 387 . 12 1 1 A 69 69 GLU CA C 69 54.939 54.643 0.296 1 1 388 . 12 1 1 A 69 69 GLU CB C 69 33.963 32.820 1.143 1 1 390 . 12 1 1 A 69 69 GLU N N 69 120.562 125.839 -5.277 1 1 391 . 12 1 1 A 70 70 MET H H 70 9.481 9.252 0.229 1 1 392 . 12 1 1 A 70 70 MET C C 70 174.595 175.867 -1.272 1 1 393 . 12 1 1 A 70 70 MET CA C 70 53.091 54.417 -1.326 1 1 394 . 12 1 1 A 70 70 MET CB C 70 36.159 34.787 1.372 1 1 397 . 12 1 1 A 70 70 MET N N 70 124.928 123.280 1.648 1 1 398 . 12 1 1 A 71 71 GLY H H 71 8.845 8.963 -0.118 1 1 399 . 12 1 1 A 71 71 GLY C C 71 170.811 171.586 -0.775 1 1 400 . 12 1 1 A 71 71 GLY CA C 71 44.624 43.995 0.629 1 1 401 . 12 1 1 A 71 71 GLY N N 71 108.896 112.017 -3.121 1 1 402 . 12 1 1 A 72 72 TYR H H 72 8.925 9.051 -0.126 1 1 403 . 12 1 1 A 72 72 TYR C C 72 173.278 173.857 -0.579 1 1 404 . 12 1 1 A 72 72 TYR CA C 72 55.912 56.714 -0.802 1 1 405 . 12 1 1 A 72 72 TYR CB C 72 41.611 40.990 0.621 1 1 406 . 12 1 1 A 72 72 TYR N N 72 123.253 121.104 2.149 1 1 407 . 12 1 1 A 73 73 ASP H H 73 8.665 9.185 -0.520 1 1 408 . 12 1 1 A 73 73 ASP C C 73 173.598 175.521 -1.923 1 1 409 . 12 1 1 A 73 73 ASP CA C 73 52.857 53.437 -0.580 1 1 410 . 12 1 1 A 73 73 ASP CB C 73 42.774 41.648 1.126 1 1 411 . 12 1 1 A 73 73 ASP N N 73 126.178 125.667 0.511 1 1 412 . 12 1 1 A 74 74 TRP H H 74 9.080 8.938 0.142 1 1 413 . 12 1 1 A 74 74 TRP C C 74 174.868 174.310 0.558 1 1 414 . 12 1 1 A 74 74 TRP CB C 74 30.083 33.543 -3.460 1 1 415 . 12 1 1 A 74 74 TRP N N 74 121.824 127.293 -5.469 1 1 416 . 12 1 1 A 78 78 MET C C 78 174.548 175.067 -0.519 1 1 417 . 12 1 1 A 78 78 MET CA C 78 54.388 54.301 0.087 1 1 418 . 12 1 1 A 78 78 MET CB C 78 32.542 34.313 -1.771 1 1 419 . 12 1 1 A 79 79 ALA H H 79 8.105 8.739 -0.634 1 1 420 . 12 1 1 A 79 79 ALA C C 79 176.629 176.758 -0.129 1 1 421 . 12 1 1 A 79 79 ALA CA C 79 51.210 50.779 0.431 1 1 422 . 12 1 1 A 79 79 ALA CB C 79 19.106 22.397 -3.291 1 1 423 . 12 1 1 A 79 79 ALA N N 79 125.778 122.299 3.479 1 1 424 . 12 1 1 A 80 80 TYR H H 80 8.035 9.092 -1.057 1 1 425 . 12 1 1 A 80 80 TYR C C 80 175.604 175.303 0.301 1 1 426 . 12 1 1 A 80 80 TYR CA C 80 57.021 57.041 -0.020 1 1 427 . 12 1 1 A 80 80 TYR CB C 80 38.416 38.271 0.145 1 1 428 . 12 1 1 A 80 80 TYR N N 80 120.045 122.197 -2.152 1 1 429 . 12 1 1 A 81 81 LYS H H 81 8.295 7.596 0.699 1 1 430 . 12 1 1 A 81 81 LYS C C 81 176.647 175.725 0.922 1 1 431 . 12 1 1 A 81 81 LYS CA C 81 56.285 55.663 0.622 1 1 432 . 12 1 1 A 81 81 LYS CB C 81 31.571 31.539 0.032 1 1 434 . 12 1 1 A 81 81 LYS N N 81 123.191 120.390 2.801 1 1 435 . 12 1 1 A 82 82 GLY H H 82 8.117 8.387 -0.270 1 1 436 . 12 1 1 A 82 82 GLY C C 82 174.010 174.035 -0.025 1 1 437 . 12 1 1 A 82 82 GLY CA C 82 44.982 45.515 -0.533 1 1 438 . 12 1 1 A 82 82 GLY N N 82 110.014 111.741 -1.727 1 1 439 . 12 1 1 A 83 83 SER H H 83 7.938 8.638 -0.700 1 1 440 . 12 1 1 A 83 83 SER C C 83 174.634 175.317 -0.683 1 1 441 . 12 1 1 A 83 83 SER CA C 83 57.685 59.710 -2.025 1 1 442 . 12 1 1 A 83 83 SER CB C 83 63.303 65.249 -1.946 1 1 443 . 12 1 1 A 83 83 SER N N 83 115.655 118.683 -3.028 1 1 444 . 12 1 1 A 84 84 VAL H H 84 8.008 7.747 0.261 1 1 451 . 12 1 1 A 84 84 VAL C C 84 175.525 175.003 0.522 1 1 452 . 12 1 1 A 84 84 VAL CA C 84 61.769 60.386 1.383 1 1 453 . 12 1 1 A 84 84 VAL CB C 84 31.711 32.233 -0.522 1 1 456 . 12 1 1 A 84 84 VAL N N 84 120.054 112.646 7.408 1 1 457 . 12 1 1 A 85 85 ASP H H 85 8.140 7.822 0.318 1 1 458 . 12 1 1 A 85 85 ASP C C 85 174.740 174.575 0.165 1 1 459 . 12 1 1 A 85 85 ASP CA C 85 53.983 53.305 0.678 1 1 460 . 12 1 1 A 85 85 ASP CB C 85 40.633 43.756 -3.123 1 1 461 . 12 1 1 A 85 85 ASP N N 85 122.510 121.262 1.248 1 1 462 . 12 1 1 A 86 86 ASN H H 86 7.736 8.879 -1.143 1 1 463 . 12 1 1 A 86 86 ASN C C 86 175.970 175.328 0.642 1 1 464 . 12 1 1 A 86 86 ASN CA C 86 54.349 52.590 1.759 1 1 465 . 12 1 1 A 86 86 ASN CB C 86 40.490 39.312 1.178 1 1 467 . 12 1 1 A 86 86 ASN N N 86 124.290 123.383 0.907 1 1 468 . 12 1 1 A 87 87 GLY H H 87 8.000 8.475 -0.475 1 1 469 . 12 1 1 A 87 87 GLY C C 87 173.456 173.649 -0.193 1 1 470 . 12 1 1 A 87 87 GLY CA C 87 44.973 45.334 -0.361 1 1 471 . 12 1 1 A 87 87 GLY N N 87 113.494 111.746 1.748 1 1 472 . 12 1 1 A 88 88 ALA H H 88 8.024 7.757 0.267 1 1 473 . 12 1 1 A 88 88 ALA C C 88 176.833 175.494 1.339 1 1 474 . 12 1 1 A 88 88 ALA CA C 88 51.734 50.123 1.611 1 1 475 . 12 1 1 A 88 88 ALA CB C 88 19.818 22.885 -3.067 1 1 476 . 12 1 1 A 88 88 ALA N N 88 122.676 122.809 -0.133 1 1 477 . 12 1 1 A 91 91 ALA C C 91 174.781 175.490 -0.709 1 1 478 . 12 1 1 A 91 91 ALA CA C 91 50.537 51.481 -0.944 1 1 479 . 12 1 1 A 91 91 ALA CB C 91 21.324 23.497 -2.173 1 1 480 . 12 1 1 A 92 92 GLN H H 92 8.451 8.818 -0.367 1 1 481 . 12 1 1 A 92 92 GLN C C 92 173.557 174.166 -0.609 1 1 482 . 12 1 1 A 92 92 GLN CA C 92 53.380 55.292 -1.912 1 1 484 . 12 1 1 A 92 92 GLN N N 92 116.847 118.679 -1.832 1 1 485 . 12 1 1 A 93 93 GLY C C 93 170.631 172.398 -1.767 1 1 486 . 12 1 1 A 93 93 GLY CA C 93 45.718 44.277 1.441 1 1 487 . 12 1 1 A 94 94 VAL H H 94 8.686 8.991 -0.305 1 1 494 . 12 1 1 A 94 94 VAL C C 94 173.698 174.631 -0.933 1 1 495 . 12 1 1 A 94 94 VAL CA C 94 58.997 59.984 -0.987 1 1 496 . 12 1 1 A 94 94 VAL CB C 94 33.311 34.013 -0.702 1 1 499 . 12 1 1 A 94 94 VAL N N 94 118.489 120.512 -2.023 1 1 500 . 12 1 1 A 95 95 GLN H H 95 9.468 9.542 -0.074 1 1 501 . 12 1 1 A 95 95 GLN C C 95 174.028 174.797 -0.769 1 1 502 . 12 1 1 A 95 95 GLN CA C 95 52.547 54.369 -1.822 1 1 503 . 12 1 1 A 95 95 GLN CB C 95 33.816 31.878 1.938 1 1 505 . 12 1 1 A 95 95 GLN N N 95 122.106 126.142 -4.036 1 1 506 . 12 1 1 A 96 96 LEU H H 96 8.484 8.865 -0.381 1 1 513 . 12 1 1 A 96 96 LEU C C 96 175.322 175.302 0.020 1 1 514 . 12 1 1 A 96 96 LEU CA C 96 53.736 54.074 -0.338 1 1 515 . 12 1 1 A 96 96 LEU CB C 96 41.088 45.463 -4.375 1 1 519 . 12 1 1 A 96 96 LEU N N 96 123.224 124.687 -1.463 1 1 520 . 12 1 1 A 97 97 THR H H 97 9.116 8.773 0.343 1 1 521 . 12 1 1 A 97 97 THR C C 97 173.251 171.895 1.356 1 1 522 . 12 1 1 A 97 97 THR CA C 97 58.931 59.218 -0.287 1 1 523 . 12 1 1 A 97 97 THR CB C 97 72.984 72.180 0.804 1 1 525 . 12 1 1 A 97 97 THR N N 97 112.504 115.553 -3.049 1 1 526 . 12 1 1 A 98 98 ALA H H 98 8.603 8.709 -0.106 1 1 527 . 12 1 1 A 98 98 ALA C C 98 174.948 174.957 -0.009 1 1 528 . 12 1 1 A 98 98 ALA CA C 98 49.980 49.662 0.318 1 1 529 . 12 1 1 A 98 98 ALA CB C 98 19.157 21.991 -2.834 1 1 530 . 12 1 1 A 98 98 ALA N N 98 121.608 123.055 -1.447 1 1 531 . 12 1 1 A 99 99 LYS H H 99 8.890 8.870 0.020 1 1 532 . 12 1 1 A 99 99 LYS C C 99 174.294 175.303 -1.009 1 1 533 . 12 1 1 A 99 99 LYS CA C 99 54.019 54.757 -0.738 1 1 534 . 12 1 1 A 99 99 LYS CB C 99 33.018 35.207 -2.189 1 1 538 . 12 1 1 A 99 99 LYS N N 99 124.522 123.250 1.272 1 1 539 . 12 1 1 A 100 100 LEU H H 100 8.985 8.934 0.051 1 1 546 . 12 1 1 A 100 100 LEU C C 100 175.265 175.490 -0.225 1 1 547 . 12 1 1 A 100 100 LEU CA C 100 52.698 53.114 -0.416 1 1 548 . 12 1 1 A 100 100 LEU CB C 100 42.889 44.580 -1.691 1 1 552 . 12 1 1 A 100 100 LEU N N 100 131.876 123.385 8.491 1 1 553 . 12 1 1 A 101 101 GLY H H 101 9.137 8.180 0.957 1 1 554 . 12 1 1 A 101 101 GLY C C 101 170.798 171.176 -0.378 1 1 555 . 12 1 1 A 101 101 GLY CA C 101 44.429 45.431 -1.002 1 1 556 . 12 1 1 A 101 101 GLY N N 101 111.928 107.263 4.665 1 1 557 . 12 1 1 A 102 102 TYR H H 102 8.779 7.998 0.781 1 1 558 . 12 1 1 A 102 102 TYR C C 102 173.402 172.793 0.609 1 1 559 . 12 1 1 A 102 102 TYR CA C 102 54.444 55.746 -1.302 1 1 560 . 12 1 1 A 102 102 TYR CB C 102 42.239 39.541 2.698 1 1 561 . 12 1 1 A 102 102 TYR N N 102 116.664 115.826 0.838 1 1 562 . 12 1 1 A 103 103 PRO C C 103 175.676 175.640 0.036 1 1 563 . 12 1 1 A 103 103 PRO CA C 103 61.462 62.451 -0.989 1 1 564 . 12 1 1 A 103 103 PRO CB C 103 30.073 33.092 -3.019 1 1 565 . 12 1 1 A 104 104 ILE H H 104 8.670 9.375 -0.705 1 1 569 . 12 1 1 A 104 104 ILE C C 104 176.646 176.029 0.617 1 1 570 . 12 1 1 A 104 104 ILE CA C 104 62.054 59.871 2.183 1 1 571 . 12 1 1 A 104 104 ILE CB C 104 37.678 40.600 -2.922 1 1 574 . 12 1 1 A 104 104 ILE N N 104 125.939 120.801 5.138 1 1 575 . 12 1 1 A 105 105 THR H H 105 8.129 8.912 -0.783 1 1 576 . 12 1 1 A 105 105 THR C C 105 174.344 173.495 0.849 1 1 577 . 12 1 1 A 105 105 THR CA C 105 59.176 65.468 -6.292 1 1 578 . 12 1 1 A 105 105 THR CB C 105 71.049 67.383 3.666 1 1 580 . 12 1 1 A 105 105 THR N N 105 109.853 117.962 -8.109 1 1 581 . 12 1 1 A 106 106 ASP H H 106 8.424 8.703 -0.279 1 1 582 . 12 1 1 A 106 106 ASP C C 106 175.692 176.428 -0.736 1 1 583 . 12 1 1 A 106 106 ASP CA C 106 56.465 55.189 1.276 1 1 584 . 12 1 1 A 106 106 ASP CB C 106 40.032 43.612 -3.580 1 1 585 . 12 1 1 A 106 106 ASP N N 106 117.156 120.065 -2.909 1 1 586 . 12 1 1 A 107 107 ASP H H 107 8.124 8.836 -0.712 1 1 587 . 12 1 1 A 107 107 ASP C C 107 174.174 174.381 -0.207 1 1 588 . 12 1 1 A 107 107 ASP CA C 107 52.907 54.127 -1.220 1 1 589 . 12 1 1 A 107 107 ASP CB C 107 41.661 42.092 -0.431 1 1 590 . 12 1 1 A 107 107 ASP N N 107 113.591 117.090 -3.499 1 1 591 . 12 1 1 A 108 108 LEU H H 108 7.336 7.221 0.115 1 1 598 . 12 1 1 A 108 108 LEU C C 108 174.321 175.491 -1.170 1 1 599 . 12 1 1 A 108 108 LEU CA C 108 54.449 54.277 0.172 1 1 600 . 12 1 1 A 108 108 LEU CB C 108 44.754 44.745 0.009 1 1 604 . 12 1 1 A 108 108 LEU N N 108 123.244 121.480 1.764 1 1 605 . 12 1 1 A 109 109 ASP H H 109 8.943 9.147 -0.204 1 1 606 . 12 1 1 A 109 109 ASP C C 109 176.248 175.117 1.131 1 1 607 . 12 1 1 A 109 109 ASP CA C 109 52.376 52.527 -0.151 1 1 608 . 12 1 1 A 109 109 ASP CB C 109 42.764 44.621 -1.857 1 1 609 . 12 1 1 A 109 109 ASP N N 109 124.634 123.419 1.215 1 1 610 . 12 1 1 A 110 110 ILE H H 110 8.372 8.696 -0.324 1 1 614 . 12 1 1 A 110 110 ILE C C 110 173.735 174.177 -0.442 1 1 615 . 12 1 1 A 110 110 ILE CA C 110 59.129 59.059 0.070 1 1 616 . 12 1 1 A 110 110 ILE CB C 110 39.402 40.394 -0.992 1 1 620 . 12 1 1 A 110 110 ILE N N 110 119.135 117.696 1.439 1 1 621 . 12 1 1 A 111 111 TYR H H 111 8.695 8.994 -0.299 1 1 622 . 12 1 1 A 111 111 TYR C C 111 172.838 174.651 -1.813 1 1 623 . 12 1 1 A 111 111 TYR CA C 111 56.182 55.983 0.199 1 1 624 . 12 1 1 A 111 111 TYR CB C 111 41.489 43.013 -1.524 1 1 625 . 12 1 1 A 111 111 TYR N N 111 121.248 121.949 -0.701 1 1 626 . 12 1 1 A 112 112 THR H H 112 9.172 8.815 0.357 1 1 627 . 12 1 1 A 112 112 THR C C 112 173.850 172.837 1.013 1 1 628 . 12 1 1 A 112 112 THR CA C 112 58.246 60.955 -2.709 1 1 629 . 12 1 1 A 112 112 THR CB C 112 71.676 71.775 -0.099 1 1 631 . 12 1 1 A 112 112 THR N N 112 110.671 115.455 -4.784 1 1 632 . 12 1 1 A 113 113 ARG H H 113 8.732 9.603 -0.871 1 1 633 . 12 1 1 A 113 113 ARG C C 113 175.037 174.155 0.882 1 1 634 . 12 1 1 A 113 113 ARG CA C 113 53.995 54.451 -0.456 1 1 635 . 12 1 1 A 113 113 ARG CB C 113 32.266 33.270 -1.004 1 1 638 . 12 1 1 A 113 113 ARG N N 113 120.642 127.532 -6.890 1 1 639 . 12 1 1 A 114 114 LEU H H 114 8.449 8.879 -0.430 1 1 646 . 12 1 1 A 114 114 LEU C C 114 175.812 175.738 0.074 1 1 647 . 12 1 1 A 114 114 LEU CA C 114 53.335 54.159 -0.824 1 1 648 . 12 1 1 A 114 114 LEU CB C 114 45.182 45.734 -0.552 1 1 652 . 12 1 1 A 114 114 LEU N N 114 119.078 128.101 -9.023 1 1 653 . 12 1 1 A 115 115 GLY H H 115 8.232 8.547 -0.315 1 1 654 . 12 1 1 A 115 115 GLY C C 115 171.343 172.422 -1.079 1 1 655 . 12 1 1 A 115 115 GLY CA C 115 46.217 46.107 0.110 1 1 656 . 12 1 1 A 115 115 GLY N N 115 108.966 112.377 -3.411 1 1 657 . 12 1 1 A 116 116 GLY H H 116 8.293 8.352 -0.059 1 1 658 . 12 1 1 A 116 116 GLY C C 116 169.856 172.161 -2.305 1 1 659 . 12 1 1 A 116 116 GLY CA C 116 44.084 44.854 -0.770 1 1 660 . 12 1 1 A 116 116 GLY N N 116 109.676 110.374 -0.698 1 1 661 . 12 1 1 A 117 117 MET H H 117 9.286 8.910 0.376 1 1 662 . 12 1 1 A 117 117 MET C C 117 174.557 174.633 -0.076 1 1 663 . 12 1 1 A 117 117 MET CA C 117 53.258 54.530 -1.272 1 1 664 . 12 1 1 A 117 117 MET CB C 117 37.195 35.906 1.289 1 1 667 . 12 1 1 A 117 117 MET N N 117 120.425 119.688 0.737 1 1 668 . 12 1 1 A 118 118 VAL H H 118 9.062 8.971 0.091 1 1 675 . 12 1 1 A 118 118 VAL C C 118 173.993 173.881 0.112 1 1 676 . 12 1 1 A 118 118 VAL CA C 118 59.883 61.265 -1.382 1 1 677 . 12 1 1 A 118 118 VAL CB C 118 31.782 34.289 -2.507 1 1 680 . 12 1 1 A 118 118 VAL N N 118 126.948 124.730 2.218 1 1 681 . 12 1 1 A 119 119 TRP H H 119 8.482 9.892 -1.410 1 1 682 . 12 1 1 A 119 119 TRP C C 119 174.608 174.738 -0.130 1 1 683 . 12 1 1 A 119 119 TRP CA C 119 53.332 55.068 -1.736 1 1 684 . 12 1 1 A 119 119 TRP CB C 119 33.569 32.798 0.771 1 1 685 . 12 1 1 A 119 119 TRP N N 119 124.631 130.204 -5.573 1 1 686 . 12 1 1 A 120 120 ARG H H 120 9.113 8.885 0.228 1 1 687 . 12 1 1 A 120 120 ARG C C 120 174.951 174.689 0.262 1 1 688 . 12 1 1 A 120 120 ARG CA C 120 54.684 54.419 0.265 1 1 689 . 12 1 1 A 120 120 ARG CB C 120 33.424 32.214 1.210 1 1 690 . 12 1 1 A 120 120 ARG N N 120 117.899 126.659 -8.760 1 1 691 . 12 1 1 A 121 121 ALA H H 121 9.299 8.871 0.428 1 1 692 . 12 1 1 A 121 121 ALA C C 121 175.954 175.075 0.879 1 1 693 . 12 1 1 A 121 121 ALA CA C 121 50.368 49.795 0.573 1 1 694 . 12 1 1 A 121 121 ALA CB C 121 21.141 22.884 -1.743 1 1 695 . 12 1 1 A 121 121 ALA N N 121 128.863 126.994 1.869 1 1 696 . 12 1 1 A 122 122 ASP H H 122 8.488 8.836 -0.348 1 1 697 . 12 1 1 A 122 122 ASP C C 122 175.635 175.120 0.515 1 1 698 . 12 1 1 A 122 122 ASP CA C 122 53.891 52.612 1.279 1 1 699 . 12 1 1 A 122 122 ASP CB C 122 42.492 44.286 -1.794 1 1 700 . 12 1 1 A 122 122 ASP N N 122 121.721 122.174 -0.453 1 1 701 . 12 1 1 A 123 123 SER H H 123 8.466 8.699 -0.233 1 1 702 . 12 1 1 A 123 123 SER C C 123 174.325 172.736 1.589 1 1 703 . 12 1 1 A 123 123 SER CA C 123 57.325 57.390 -0.065 1 1 704 . 12 1 1 A 123 123 SER CB C 123 63.988 64.088 -0.100 1 1 705 . 12 1 1 A 123 123 SER N N 123 117.374 121.090 -3.716 1 1 706 . 12 1 1 A 124 124 LYS H H 124 8.389 7.497 0.892 1 1 707 . 12 1 1 A 124 124 LYS C C 124 176.840 175.408 1.432 1 1 708 . 12 1 1 A 124 124 LYS CA C 124 56.036 55.234 0.802 1 1 709 . 12 1 1 A 124 124 LYS CB C 124 32.397 35.777 -3.380 1 1 711 . 12 1 1 A 124 124 LYS N N 124 122.883 122.968 -0.085 1 1 712 . 12 1 1 A 125 125 GLY H H 125 8.281 8.474 -0.193 1 1 713 . 12 1 1 A 125 125 GLY C C 125 173.592 173.884 -0.292 1 1 714 . 12 1 1 A 125 125 GLY CA C 125 44.924 45.722 -0.798 1 1 715 . 12 1 1 A 125 125 GLY N N 125 109.541 113.017 -3.476 1 1 716 . 12 1 1 A 126 126 ASN H H 126 8.185 8.191 -0.006 1 1 717 . 12 1 1 A 126 126 ASN C C 126 176.649 175.460 1.189 1 1 718 . 12 1 1 A 126 126 ASN CA C 126 52.763 51.892 0.871 1 1 719 . 12 1 1 A 126 126 ASN CB C 126 38.439 40.412 -1.973 1 1 720 . 12 1 1 A 126 126 ASN N N 126 119.019 120.201 -1.182 1 1 721 . 12 1 1 A 127 127 TYR C C 127 176.913 176.183 0.730 1 1 722 . 12 1 1 A 127 127 TYR CA C 127 57.757 61.928 -4.171 1 1 723 . 12 1 1 A 127 127 TYR CB C 127 37.703 38.541 -0.838 1 1 724 . 12 1 1 A 128 128 ALA H H 128 8.050 7.691 0.359 1 1 728 . 12 1 1 A 128 128 ALA C C 128 177.756 176.801 0.955 1 1 729 . 12 1 1 A 128 128 ALA CA C 128 52.321 52.358 -0.037 1 1 730 . 12 1 1 A 128 128 ALA CB C 128 18.273 20.054 -1.781 1 1 731 . 12 1 1 A 128 128 ALA N N 128 124.529 121.471 3.058 1 1 732 . 12 1 1 A 129 129 SER H H 129 8.063 8.634 -0.571 1 1 733 . 12 1 1 A 129 129 SER C C 129 174.938 172.495 2.443 1 1 734 . 12 1 1 A 129 129 SER CA C 129 58.202 56.549 1.653 1 1 735 . 12 1 1 A 129 129 SER CB C 129 62.974 64.906 -1.932 1 1 736 . 12 1 1 A 129 129 SER N N 129 114.374 113.154 1.220 1 1 737 . 12 1 1 A 130 130 THR H H 130 7.875 8.562 -0.687 1 1 741 . 12 1 1 A 130 130 THR C C 130 175.198 173.896 1.302 1 1 742 . 12 1 1 A 130 130 THR CA C 130 61.520 60.420 1.100 1 1 743 . 12 1 1 A 130 130 THR CB C 130 69.312 67.545 1.767 1 1 745 . 12 1 1 A 130 130 THR N N 130 113.608 118.593 -4.985 1 1 746 . 12 1 1 A 131 131 GLY H H 131 8.219 8.037 0.182 1 1 747 . 12 1 1 A 131 131 GLY C C 131 173.979 174.120 -0.141 1 1 748 . 12 1 1 A 131 131 GLY CA C 131 44.991 45.702 -0.711 1 1 749 . 12 1 1 A 131 131 GLY N N 131 110.848 111.114 -0.266 1 1 750 . 12 1 1 A 132 132 VAL H H 132 7.729 8.621 -0.892 1 1 757 . 12 1 1 A 132 132 VAL C C 132 175.988 177.005 -1.017 1 1 758 . 12 1 1 A 132 132 VAL CA C 132 61.643 63.958 -2.315 1 1 759 . 12 1 1 A 132 132 VAL CB C 132 31.941 33.558 -1.617 1 1 762 . 12 1 1 A 132 132 VAL N N 132 118.932 121.959 -3.027 1 1 763 . 12 1 1 A 133 133 SER H H 133 8.224 7.899 0.325 1 1 764 . 12 1 1 A 133 133 SER C C 133 174.320 174.706 -0.386 1 1 765 . 12 1 1 A 133 133 SER CA C 133 57.756 58.591 -0.835 1 1 766 . 12 1 1 A 133 133 SER CB C 133 63.140 64.746 -1.606 1 1 767 . 12 1 1 A 133 133 SER N N 133 119.260 112.065 7.195 1 1 768 . 12 1 1 A 134 134 ARG H H 134 8.199 7.631 0.568 1 1 769 . 12 1 1 A 134 134 ARG C C 134 175.923 175.400 0.523 1 1 770 . 12 1 1 A 134 134 ARG CA C 134 55.461 54.681 0.780 1 1 771 . 12 1 1 A 134 134 ARG CB C 134 30.195 32.987 -2.792 1 1 774 . 12 1 1 A 134 134 ARG N N 134 123.262 120.175 3.087 1 1 775 . 12 1 1 A 135 135 SER H H 135 8.256 8.767 -0.511 1 1 776 . 12 1 1 A 135 135 SER C C 135 174.360 174.084 0.276 1 1 777 . 12 1 1 A 135 135 SER CA C 135 57.730 58.729 -0.999 1 1 778 . 12 1 1 A 135 135 SER CB C 135 63.275 63.122 0.153 1 1 779 . 12 1 1 A 135 135 SER N N 135 117.155 119.996 -2.841 1 1 780 . 12 1 1 A 136 136 GLU H H 136 8.374 8.544 -0.170 1 1 781 . 12 1 1 A 136 136 GLU C C 136 176.284 176.133 0.151 1 1 782 . 12 1 1 A 136 136 GLU CA C 136 56.082 56.641 -0.559 1 1 783 . 12 1 1 A 136 136 GLU CB C 136 29.820 29.656 0.164 1 1 785 . 12 1 1 A 136 136 GLU N N 136 122.812 124.496 -1.684 1 1 786 . 12 1 1 A 137 137 HIS H H 137 8.118 8.649 -0.531 1 1 787 . 12 1 1 A 137 137 HIS C C 137 173.529 175.061 -1.532 1 1 788 . 12 1 1 A 137 137 HIS CA C 137 54.793 55.897 -1.104 1 1 789 . 12 1 1 A 137 137 HIS CB C 137 30.191 30.288 -0.097 1 1 790 . 12 1 1 A 137 137 HIS N N 137 118.002 120.175 -2.173 1 1 791 . 12 1 1 A 138 138 ASP H H 138 8.572 8.636 -0.064 1 1 792 . 12 1 1 A 138 138 ASP C C 138 174.940 175.664 -0.724 1 1 793 . 12 1 1 A 138 138 ASP CA C 138 53.594 52.960 0.634 1 1 794 . 12 1 1 A 138 138 ASP CB C 138 42.165 44.390 -2.225 1 1 795 . 12 1 1 A 138 138 ASP N N 138 121.536 121.209 0.327 1 1 796 . 12 1 1 A 139 139 THR H H 139 7.857 8.779 -0.922 1 1 797 . 12 1 1 A 139 139 THR C C 139 172.822 173.306 -0.484 1 1 798 . 12 1 1 A 139 139 THR CA C 139 59.197 60.517 -1.320 1 1 799 . 12 1 1 A 139 139 THR CB C 139 71.457 71.810 -0.353 1 1 801 . 12 1 1 A 139 139 THR N N 139 113.598 114.524 -0.926 1 1 802 . 12 1 1 A 140 140 GLY C C 140 169.622 172.157 -2.535 1 1 803 . 12 1 1 A 140 140 GLY CA C 140 44.287 45.693 -1.406 1 1 804 . 12 1 1 A 141 141 VAL H H 141 7.815 8.995 -1.180 1 1 811 . 12 1 1 A 141 141 VAL C C 141 176.038 173.958 2.080 1 1 812 . 12 1 1 A 141 141 VAL CA C 141 59.739 59.982 -0.243 1 1 813 . 12 1 1 A 141 141 VAL CB C 141 33.308 34.362 -1.054 1 1 816 . 12 1 1 A 141 141 VAL N N 141 116.224 125.219 -8.995 1 1 817 . 12 1 1 A 142 142 SER H H 142 9.284 8.969 0.315 1 1 818 . 12 1 1 A 142 142 SER C C 142 171.050 172.440 -1.390 1 1 819 . 12 1 1 A 142 142 SER CB C 142 67.608 66.248 1.360 1 1 820 . 12 1 1 A 142 142 SER N N 142 123.223 122.444 0.779 1 1 821 . 12 1 1 A 143 143 PRO C C 143 174.032 176.274 -2.242 1 1 822 . 12 1 1 A 143 143 PRO CA C 143 62.350 62.535 -0.185 1 1 823 . 12 1 1 A 143 143 PRO CB C 143 31.774 32.475 -0.701 1 1 825 . 12 1 1 A 144 144 VAL H H 144 7.785 8.763 -0.978 1 1 832 . 12 1 1 A 144 144 VAL C C 144 172.826 174.322 -1.496 1 1 833 . 12 1 1 A 144 144 VAL CA C 144 59.770 59.884 -0.114 1 1 834 . 12 1 1 A 144 144 VAL CB C 144 34.407 35.891 -1.484 1 1 837 . 12 1 1 A 144 144 VAL N N 144 120.214 117.294 2.920 1 1 838 . 12 1 1 A 145 145 PHE H H 145 8.623 8.607 0.016 1 1 839 . 12 1 1 A 145 145 PHE C C 145 173.658 172.659 0.999 1 1 840 . 12 1 1 A 145 145 PHE CA C 145 54.942 55.918 -0.976 1 1 841 . 12 1 1 A 145 145 PHE CB C 145 42.692 42.429 0.263 1 1 842 . 12 1 1 A 145 145 PHE N N 145 123.914 119.168 4.746 1 1 843 . 12 1 1 A 146 146 ALA H H 146 8.886 8.870 0.016 1 1 844 . 12 1 1 A 146 146 ALA C C 146 176.258 176.125 0.133 1 1 845 . 12 1 1 A 146 146 ALA CA C 146 49.734 50.296 -0.562 1 1 846 . 12 1 1 A 146 146 ALA CB C 146 22.244 22.596 -0.352 1 1 847 . 12 1 1 A 146 146 ALA N N 146 125.243 123.248 1.995 1 1 848 . 12 1 1 A 147 147 GLY H H 147 8.470 8.692 -0.222 1 1 849 . 12 1 1 A 147 147 GLY C C 147 170.940 172.998 -2.058 1 1 850 . 12 1 1 A 147 147 GLY CA C 147 44.063 44.456 -0.393 1 1 851 . 12 1 1 A 147 147 GLY N N 147 106.669 108.145 -1.476 1 1 852 . 12 1 1 A 148 148 GLY H H 148 8.008 8.539 -0.531 1 1 853 . 12 1 1 A 148 148 GLY C C 148 170.181 172.316 -2.135 1 1 854 . 12 1 1 A 148 148 GLY CA C 148 45.736 45.989 -0.253 1 1 855 . 12 1 1 A 148 148 GLY N N 148 109.475 109.787 -0.312 1 1 856 . 12 1 1 A 149 149 VAL H H 149 8.426 8.171 0.255 1 1 863 . 12 1 1 A 149 149 VAL C C 149 174.157 174.051 0.106 1 1 864 . 12 1 1 A 149 149 VAL CA C 149 58.200 58.690 -0.490 1 1 865 . 12 1 1 A 149 149 VAL CB C 149 34.464 35.640 -1.176 1 1 868 . 12 1 1 A 149 149 VAL N N 149 112.651 117.069 -4.418 1 1 869 . 12 1 1 A 150 150 GLU H H 150 9.070 9.049 0.021 1 1 870 . 12 1 1 A 150 150 GLU C C 150 173.892 175.199 -1.307 1 1 871 . 12 1 1 A 150 150 GLU CA C 150 54.617 54.405 0.212 1 1 872 . 12 1 1 A 150 150 GLU CB C 150 32.911 33.953 -1.042 1 1 874 . 12 1 1 A 150 150 GLU N N 150 124.471 119.958 4.513 1 1 875 . 12 1 1 A 151 151 TRP H H 151 9.461 9.513 -0.052 1 1 877 . 12 1 1 A 151 151 TRP C C 151 174.370 175.552 -1.182 1 1 878 . 12 1 1 A 151 151 TRP CA C 151 54.113 55.812 -1.699 1 1 879 . 12 1 1 A 151 151 TRP CB C 151 31.688 32.391 -0.703 1 1 880 . 12 1 1 A 151 151 TRP N N 151 129.611 121.996 7.615 1 1 882 . 12 1 1 A 152 152 ALA H H 152 8.771 8.871 -0.100 1 1 883 . 12 1 1 A 152 152 ALA C C 152 175.079 176.804 -1.725 1 1 884 . 12 1 1 A 152 152 ALA CA C 152 51.417 51.527 -0.110 1 1 885 . 12 1 1 A 152 152 ALA CB C 152 17.209 19.531 -2.322 1 1 886 . 12 1 1 A 152 152 ALA N N 152 130.502 127.009 3.493 1 1 887 . 12 1 1 A 153 153 VAL H H 153 7.893 8.587 -0.694 1 1 894 . 12 1 1 A 153 153 VAL C C 153 176.612 176.181 0.431 1 1 895 . 12 1 1 A 153 153 VAL CA C 153 63.600 63.689 -0.089 1 1 896 . 12 1 1 A 153 153 VAL CB C 153 31.280 32.496 -1.216 1 1 899 . 12 1 1 A 153 153 VAL N N 153 124.360 123.022 1.338 1 1 900 . 12 1 1 A 154 154 THR H H 154 7.950 7.452 0.498 1 1 904 . 12 1 1 A 154 154 THR C C 154 173.884 174.400 -0.516 1 1 905 . 12 1 1 A 154 154 THR CA C 154 58.655 60.278 -1.623 1 1 906 . 12 1 1 A 154 154 THR CB C 154 71.262 71.396 -0.134 1 1 908 . 12 1 1 A 154 154 THR N N 154 109.176 112.337 -3.161 1 1 909 . 12 1 1 A 155 155 ARG H H 155 8.310 8.691 -0.381 1 1 910 . 12 1 1 A 155 155 ARG C C 155 176.753 176.498 0.255 1 1 911 . 12 1 1 A 155 155 ARG CA C 155 58.456 57.237 1.219 1 1 912 . 12 1 1 A 155 155 ARG CB C 155 29.043 30.179 -1.136 1 1 915 . 12 1 1 A 155 155 ARG N N 155 116.576 122.914 -6.338 1 1 916 . 12 1 1 A 156 156 ASP H H 156 7.783 9.059 -1.276 1 1 917 . 12 1 1 A 156 156 ASP C C 156 174.222 174.850 -0.628 1 1 918 . 12 1 1 A 156 156 ASP CA C 156 53.540 55.526 -1.986 1 1 919 . 12 1 1 A 156 156 ASP CB C 156 42.327 39.589 2.738 1 1 920 . 12 1 1 A 156 156 ASP N N 156 112.950 119.901 -6.951 1 1 921 . 12 1 1 A 157 157 ILE H H 157 7.233 7.159 0.074 1 1 925 . 12 1 1 A 157 157 ILE C C 157 174.178 174.611 -0.433 1 1 926 . 12 1 1 A 157 157 ILE CA C 157 59.350 60.912 -1.562 1 1 927 . 12 1 1 A 157 157 ILE CB C 157 38.969 40.003 -1.034 1 1 930 . 12 1 1 A 157 157 ILE N N 157 119.732 118.711 1.021 1 1 931 . 12 1 1 A 158 158 ALA H H 158 8.729 8.840 -0.111 1 1 932 . 12 1 1 A 158 158 ALA C C 158 176.567 175.515 1.052 1 1 933 . 12 1 1 A 158 158 ALA CA C 158 49.418 50.216 -0.798 1 1 934 . 12 1 1 A 158 158 ALA CB C 158 21.430 23.974 -2.544 1 1 935 . 12 1 1 A 158 158 ALA N N 158 128.564 129.043 -0.479 1 1 936 . 12 1 1 A 159 159 THR H H 159 8.972 8.638 0.334 1 1 940 . 12 1 1 A 159 159 THR C C 159 172.213 173.274 -1.061 1 1 941 . 12 1 1 A 159 159 THR CA C 159 59.504 60.817 -1.313 1 1 942 . 12 1 1 A 159 159 THR CB C 159 70.728 71.524 -0.796 1 1 944 . 12 1 1 A 159 159 THR N N 159 114.901 115.084 -0.183 1 1 945 . 12 1 1 A 160 160 ARG H H 160 8.924 9.264 -0.340 1 1 946 . 12 1 1 A 160 160 ARG C C 160 174.097 173.910 0.187 1 1 947 . 12 1 1 A 160 160 ARG CA C 160 53.066 54.225 -1.159 1 1 948 . 12 1 1 A 160 160 ARG CB C 160 32.922 33.778 -0.856 1 1 951 . 12 1 1 A 160 160 ARG N N 160 121.507 122.859 -1.352 1 1 952 . 12 1 1 A 161 161 LEU H H 161 8.611 8.778 -0.167 1 1 959 . 12 1 1 A 161 161 LEU C C 161 174.389 174.763 -0.374 1 1 960 . 12 1 1 A 161 161 LEU CA C 161 53.355 53.257 0.098 1 1 961 . 12 1 1 A 161 161 LEU CB C 161 44.360 45.666 -1.306 1 1 964 . 12 1 1 A 161 161 LEU N N 161 124.711 123.010 1.701 1 1 965 . 12 1 1 A 162 162 GLU H H 162 8.746 8.654 0.092 1 1 966 . 12 1 1 A 162 162 GLU C C 162 173.376 174.799 -1.423 1 1 967 . 12 1 1 A 162 162 GLU CA C 162 53.904 54.571 -0.667 1 1 968 . 12 1 1 A 162 162 GLU CB C 162 33.773 32.728 1.045 1 1 970 . 12 1 1 A 162 162 GLU N N 162 122.300 125.503 -3.203 1 1 971 . 12 1 1 A 163 163 TYR H H 163 8.872 9.339 -0.467 1 1 972 . 12 1 1 A 163 163 TYR C C 163 173.425 175.259 -1.834 1 1 973 . 12 1 1 A 163 163 TYR CA C 163 56.192 56.700 -0.508 1 1 974 . 12 1 1 A 163 163 TYR CB C 163 40.870 43.572 -2.702 1 1 975 . 12 1 1 A 163 163 TYR N N 163 124.618 121.079 3.539 1 1 976 . 12 1 1 A 171 171 ASP C C 171 175.753 174.569 1.184 1 1 977 . 12 1 1 A 171 171 ASP CA C 171 53.517 53.912 -0.395 1 1 978 . 12 1 1 A 171 171 ASP CB C 171 41.353 41.723 -0.370 1 1 979 . 12 1 1 A 172 172 ALA H H 172 8.336 7.768 0.568 1 1 983 . 12 1 1 A 172 172 ALA C C 172 178.110 175.501 2.609 1 1 984 . 12 1 1 A 172 172 ALA CA C 172 52.190 51.341 0.849 1 1 985 . 12 1 1 A 172 172 ALA CB C 172 18.305 23.629 -5.324 1 1 986 . 12 1 1 A 172 172 ALA N N 172 125.294 119.895 5.399 1 1 987 . 12 1 1 A 173 173 GLY H H 173 8.300 8.421 -0.121 1 1 988 . 12 1 1 A 173 173 GLY C C 173 174.437 172.369 2.068 1 1 989 . 12 1 1 A 173 173 GLY CA C 173 45.083 45.736 -0.653 1 1 990 . 12 1 1 A 173 173 GLY N N 173 107.268 105.827 1.441 1 1 991 . 12 1 1 A 174 174 THR H H 174 7.754 8.330 -0.576 1 1 992 . 12 1 1 A 174 174 THR C C 174 174.738 173.501 1.237 1 1 993 . 12 1 1 A 174 174 THR CA C 174 61.310 61.614 -0.304 1 1 994 . 12 1 1 A 174 174 THR CB C 174 69.310 70.379 -1.069 1 1 996 . 12 1 1 A 174 174 THR N N 174 113.472 114.657 -1.185 1 1 997 . 12 1 1 A 175 175 VAL H H 175 7.993 8.651 -0.658 1 1 1004 . 12 1 1 A 175 175 VAL C C 175 176.535 176.086 0.449 1 1 1005 . 12 1 1 A 175 175 VAL CA C 175 62.126 62.045 0.081 1 1 1006 . 12 1 1 A 175 175 VAL CB C 175 31.282 33.458 -2.176 1 1 1009 . 12 1 1 A 175 175 VAL N N 175 121.643 120.275 1.368 1 1 1010 . 12 1 1 A 176 176 GLY H H 176 8.056 7.390 0.666 1 1 1011 . 12 1 1 A 176 176 GLY C C 176 173.930 173.035 0.895 1 1 1012 . 12 1 1 A 176 176 GLY CA C 176 44.983 45.938 -0.955 1 1 1013 . 12 1 1 A 176 176 GLY N N 176 110.460 108.963 1.497 1 1 1014 . 12 1 1 A 177 177 THR H H 177 7.520 8.561 -1.041 1 1 1015 . 12 1 1 A 177 177 THR C C 177 173.574 175.735 -2.161 1 1 1016 . 12 1 1 A 177 177 THR CA C 177 60.609 62.395 -1.786 1 1 1017 . 12 1 1 A 177 177 THR CB C 177 69.506 70.215 -0.709 1 1 1019 . 12 1 1 A 177 177 THR N N 177 113.390 111.935 1.455 1 1 1020 . 12 1 1 A 178 178 ARG H H 178 8.261 8.604 -0.343 1 1 1021 . 12 1 1 A 178 178 ARG C C 178 173.932 175.309 -1.377 1 1 1022 . 12 1 1 A 178 178 ARG CA C 178 53.683 61.467 -7.784 1 1 1023 . 12 1 1 A 178 178 ARG CB C 178 29.224 28.544 0.680 1 1 1026 . 12 1 1 A 178 178 ARG N N 178 123.906 121.996 1.910 1 1 1027 . 12 1 1 A 183 183 MET C C 183 174.053 174.551 -0.498 1 1 1028 . 12 1 1 A 183 183 MET CA C 183 53.700 55.024 -1.324 1 1 1029 . 12 1 1 A 183 183 MET CB C 183 35.908 35.535 0.373 1 1 1032 . 12 1 1 A 184 184 LEU H H 184 8.319 9.109 -0.790 1 1 1033 . 12 1 1 A 184 184 LEU C C 184 175.235 175.573 -0.338 1 1 1034 . 12 1 1 A 184 184 LEU CA C 184 53.120 53.654 -0.534 1 1 1035 . 12 1 1 A 184 184 LEU CB C 184 42.857 44.190 -1.333 1 1 1038 . 12 1 1 A 184 184 LEU N N 184 131.293 125.902 5.391 1 1 1039 . 12 1 1 A 185 185 SER H H 185 9.603 8.866 0.737 1 1 1040 . 12 1 1 A 185 185 SER C C 185 171.293 172.959 -1.666 1 1 1041 . 12 1 1 A 185 185 SER CA C 185 56.504 57.007 -0.503 1 1 1042 . 12 1 1 A 185 185 SER CB C 185 66.585 66.172 0.413 1 1 1043 . 12 1 1 A 185 185 SER N N 185 119.338 121.846 -2.508 1 1 1044 . 12 1 1 A 186 186 LEU H H 186 8.583 8.731 -0.148 1 1 1051 . 12 1 1 A 186 186 LEU C C 186 175.328 176.188 -0.860 1 1 1052 . 12 1 1 A 186 186 LEU CA C 186 52.729 53.012 -0.283 1 1 1053 . 12 1 1 A 186 186 LEU CB C 186 44.996 44.878 0.118 1 1 1056 . 12 1 1 A 186 186 LEU N N 186 122.719 123.855 -1.136 1 1 1057 . 12 1 1 A 187 187 GLY H H 187 9.287 8.598 0.689 1 1 1058 . 12 1 1 A 187 187 GLY C C 187 172.315 173.713 -1.398 1 1 1059 . 12 1 1 A 187 187 GLY CA C 187 43.502 44.816 -1.314 1 1 1060 . 12 1 1 A 187 187 GLY N N 187 110.265 111.331 -1.066 1 1 1061 . 12 1 1 A 188 188 VAL H H 188 8.825 8.718 0.107 1 1 1068 . 12 1 1 A 188 188 VAL C C 188 173.125 174.600 -1.475 1 1 1069 . 12 1 1 A 188 188 VAL CA C 188 59.739 59.325 0.414 1 1 1070 . 12 1 1 A 188 188 VAL CB C 188 34.532 34.736 -0.204 1 1 1073 . 12 1 1 A 188 188 VAL N N 188 119.161 116.756 2.405 1 1 1074 . 12 1 1 A 189 189 SER H H 189 9.051 8.873 0.178 1 1 1075 . 12 1 1 A 189 189 SER C C 189 171.698 172.488 -0.790 1 1 1076 . 12 1 1 A 189 189 SER CA C 189 55.997 56.819 -0.822 1 1 1077 . 12 1 1 A 189 189 SER CB C 189 66.094 67.023 -0.929 1 1 1078 . 12 1 1 A 189 189 SER N N 189 117.810 118.481 -0.671 1 1 1079 . 12 1 1 A 190 190 TYR H H 190 9.145 9.803 -0.658 1 1 1080 . 12 1 1 A 190 190 TYR C C 190 174.063 174.838 -0.775 1 1 1081 . 12 1 1 A 190 190 TYR CA C 190 55.375 56.564 -1.189 1 1 1082 . 12 1 1 A 190 190 TYR CB C 190 41.183 43.361 -2.178 1 1 1083 . 12 1 1 A 190 190 TYR N N 190 123.690 118.586 5.104 1 1 1084 . 12 1 1 A 191 191 ARG H H 191 8.211 8.720 -0.509 1 1 1085 . 12 1 1 A 191 191 ARG C C 191 174.826 175.601 -0.775 1 1 1086 . 12 1 1 A 191 191 ARG CA C 191 54.464 55.104 -0.640 1 1 1087 . 12 1 1 A 191 191 ARG CB C 191 30.507 31.698 -1.191 1 1 1090 . 12 1 1 A 191 191 ARG N N 191 125.366 121.439 3.927 1 1 1091 . 12 1 1 A 192 192 PHE H H 192 8.496 9.342 -0.846 1 1 1092 . 12 1 1 A 192 192 PHE C C 192 176.384 175.413 0.971 1 1 1093 . 12 1 1 A 192 192 PHE CA C 192 57.179 56.208 0.971 1 1 1094 . 12 1 1 A 192 192 PHE CB C 192 39.430 40.270 -0.840 1 1 1095 . 12 1 1 A 192 192 PHE N N 192 121.586 122.191 -0.605 1 1 1096 . 12 1 1 A 193 193 GLY H H 193 8.643 8.623 0.020 1 1 1097 . 12 1 1 A 193 193 GLY C C 193 174.466 171.820 2.646 1 1 1098 . 12 1 1 A 193 193 GLY CA C 193 45.126 44.251 0.875 1 1 1099 . 12 1 1 A 193 193 GLY N N 193 109.499 111.192 -1.693 1 1 1100 . 12 1 1 A 194 194 GLN H H 194 8.512 8.484 0.028 1 1 1101 . 12 1 1 A 194 194 GLN C C 194 176.201 175.368 0.833 1 1 1102 . 12 1 1 A 194 194 GLN CA C 194 55.433 54.678 0.755 1 1 1103 . 12 1 1 A 194 194 GLN CB C 194 28.729 30.093 -1.364 1 1 1105 . 12 1 1 A 194 194 GLN N N 194 119.448 121.136 -1.688 1 1 1106 . 12 1 1 A 195 195 GLU H H 195 8.530 8.638 -0.108 1 1 1107 . 12 1 1 A 195 195 GLU C C 195 176.151 175.514 0.637 1 1 1108 . 12 1 1 A 195 195 GLU CA C 195 56.256 56.545 -0.289 1 1 1109 . 12 1 1 A 195 195 GLU CB C 195 29.486 31.158 -1.672 1 1 1111 . 12 1 1 A 195 195 GLU N N 195 121.959 126.809 -4.850 1 1 1112 . 12 1 1 A 196 196 ASP H H 196 8.253 8.704 -0.451 1 1 1113 . 12 1 1 A 196 196 ASP C C 196 175.667 175.966 -0.299 1 1 1114 . 12 1 1 A 196 196 ASP CA C 196 53.981 52.722 1.259 1 1 1115 . 12 1 1 A 196 196 ASP CB C 196 40.700 43.592 -2.892 1 1 1116 . 12 1 1 A 196 196 ASP N N 196 121.819 120.658 1.161 1 1 1117 . 12 1 1 A 197 197 ALA H H 197 7.999 8.714 -0.715 1 1 1121 . 12 1 1 A 197 197 ALA C C 197 176.847 176.946 -0.099 1 1 1122 . 12 1 1 A 197 197 ALA CA C 197 51.612 54.441 -2.829 1 1 1123 . 12 1 1 A 197 197 ALA CB C 197 18.192 19.325 -1.133 1 1 1124 . 12 1 1 A 197 197 ALA N N 197 124.262 124.796 -0.534 1 1 1125 . 12 1 1 A 198 198 ALA H H 198 8.042 7.612 0.430 1 1 1126 . 12 1 1 A 198 198 ALA C C 198 176.865 175.820 1.045 1 1 1127 . 12 1 1 A 198 198 ALA CA C 198 49.999 49.072 0.927 1 1 1128 . 12 1 1 A 198 198 ALA CB C 198 17.327 19.809 -2.482 1 1 1129 . 12 1 1 A 198 198 ALA N N 198 124.724 119.974 4.750 1 1 1130 . 12 1 1 A 199 199 PRO C C 199 176.727 176.958 -0.231 1 1 1131 . 12 1 1 A 199 199 PRO CA C 199 62.399 62.285 0.114 1 1 1132 . 12 1 1 A 199 199 PRO CB C 199 30.949 30.088 0.861 1 1 1135 . 12 1 1 A 200 200 VAL H H 200 8.026 8.036 -0.010 1 1 1142 . 12 1 1 A 200 200 VAL C C 200 176.034 176.607 -0.573 1 1 1143 . 12 1 1 A 200 200 VAL CA C 200 61.944 64.325 -2.381 1 1 1144 . 12 1 1 A 200 200 VAL CB C 200 31.734 31.536 0.198 1 1 1147 . 12 1 1 A 200 200 VAL N N 200 120.635 122.312 -1.677 1 1 1148 . 12 1 1 A 201 201 VAL H H 201 7.966 7.795 0.171 1 1 1155 . 12 1 1 A 201 201 VAL C C 201 175.128 176.303 -1.175 1 1 1156 . 12 1 1 A 201 201 VAL CA C 201 61.249 62.535 -1.286 1 1 1157 . 12 1 1 A 201 201 VAL CB C 201 31.917 32.118 -0.201 1 1 1160 . 12 1 1 A 201 201 VAL N N 201 124.053 120.491 3.562 1 1 1161 . 12 1 1 A 202 202 ALA H H 202 8.159 7.908 0.251 1 1 1162 . 12 1 1 A 202 202 ALA C C 202 175.153 174.374 0.779 1 1 1163 . 12 1 1 A 202 202 ALA CA C 202 49.742 49.888 -0.146 1 1 1164 . 12 1 1 A 202 202 ALA CB C 202 17.532 19.362 -1.830 1 1 1165 . 12 1 1 A 202 202 ALA N N 202 129.251 124.822 4.429 1 1 1166 . 12 1 1 A 203 203 PRO C C 203 176.273 175.087 1.186 1 1 1167 . 12 1 1 A 203 203 PRO CA C 203 62.324 62.533 -0.209 1 1 1168 . 12 1 1 A 203 203 PRO CB C 203 31.042 33.335 -2.293 1 1 1170 . 12 1 1 A 204 204 ALA H H 204 8.137 8.165 -0.028 1 1 1171 . 12 1 1 A 204 204 ALA C C 204 175.697 175.627 0.070 1 1 1172 . 12 1 1 A 204 204 ALA CA C 204 49.865 48.918 0.947 1 1 1173 . 12 1 1 A 204 204 ALA CB C 204 17.364 21.297 -3.933 1 1 1174 . 12 1 1 A 204 204 ALA N N 204 125.510 121.567 3.943 1 1 1175 . 12 1 1 A 205 205 PRO C C 205 175.430 177.338 -1.908 1 1 1176 . 12 1 1 A 205 205 PRO CA C 205 62.511 62.929 -0.418 1 1 1177 . 12 1 1 A 205 205 PRO CB C 205 31.056 32.748 -1.692 1 1 1179 . 12 1 1 A 206 206 ALA H H 206 7.847 8.638 -0.791 1 1 1180 . 12 1 1 A 206 206 ALA C C 206 175.565 177.917 -2.352 1 1 1181 . 12 1 1 A 206 206 ALA CA C 206 49.487 56.096 -6.609 1 1 1182 . 12 1 1 A 206 206 ALA CB C 206 18.843 18.538 0.305 1 1 1183 . 12 1 1 A 206 206 ALA N N 206 123.663 123.407 0.256 1 1 1184 . 12 1 1 A 207 207 PRO C C 207 174.397 176.325 -1.928 1 1 1185 . 12 1 1 A 207 207 PRO CA C 207 61.454 62.513 -1.059 1 1 1186 . 12 1 1 A 207 207 PRO CB C 207 31.929 32.174 -0.245 1 1 1187 . 12 1 1 A 208 208 ALA H H 208 7.898 8.367 -0.469 1 1 1188 . 12 1 1 A 208 208 ALA C C 208 175.411 177.189 -1.778 1 1 1189 . 12 1 1 A 208 208 ALA CA C 208 49.472 50.047 -0.575 1 1 1190 . 12 1 1 A 208 208 ALA CB C 208 19.082 20.331 -1.249 1 1 1191 . 12 1 1 A 208 208 ALA N N 208 127.450 123.813 3.637 1 1 1192 . 12 1 1 A 209 209 PRO C C 209 176.932 178.456 -1.524 1 1 1193 . 12 1 1 A 209 209 PRO CA C 209 62.736 65.729 -2.993 1 1 1194 . 12 1 1 A 209 209 PRO CB C 209 31.012 31.696 -0.684 1 1 1 . 13 1 1 A 2 2 ARG C C 2 175.857 176.274 -0.417 1 1 2 . 13 1 1 A 2 2 ARG CA C 2 55.872 56.767 -0.895 1 1 3 . 13 1 1 A 2 2 ARG CB C 2 29.983 31.679 -1.696 1 1 5 . 13 1 1 A 3 3 ILE H H 3 8.238 7.611 0.627 1 1 9 . 13 1 1 A 3 3 ILE C C 3 175.763 174.939 0.824 1 1 10 . 13 1 1 A 3 3 ILE CA C 3 60.779 60.157 0.622 1 1 11 . 13 1 1 A 3 3 ILE CB C 3 37.664 39.149 -1.485 1 1 15 . 13 1 1 A 3 3 ILE N N 3 122.580 115.346 7.234 1 1 16 . 13 1 1 A 4 4 MET H H 4 8.261 8.753 -0.492 1 1 17 . 13 1 1 A 4 4 MET C C 4 175.660 175.393 0.267 1 1 18 . 13 1 1 A 4 4 MET CA C 4 54.893 56.795 -1.902 1 1 19 . 13 1 1 A 4 4 MET CB C 4 32.060 34.922 -2.862 1 1 22 . 13 1 1 A 4 4 MET N N 4 123.988 123.739 0.249 1 1 23 . 13 1 1 A 5 5 LYS H H 5 8.041 7.756 0.285 1 1 24 . 13 1 1 A 5 5 LYS C C 5 175.850 175.483 0.367 1 1 25 . 13 1 1 A 5 5 LYS CA C 5 56.081 55.437 0.644 1 1 26 . 13 1 1 A 5 5 LYS CB C 5 32.220 33.116 -0.896 1 1 29 . 13 1 1 A 5 5 LYS N N 5 122.015 118.784 3.231 1 1 30 . 13 1 1 A 6 6 ALA H H 6 8.042 8.565 -0.523 1 1 34 . 13 1 1 A 6 6 ALA C C 6 177.160 176.171 0.989 1 1 35 . 13 1 1 A 6 6 ALA CA C 6 52.109 53.611 -1.502 1 1 36 . 13 1 1 A 6 6 ALA CB C 6 18.637 19.974 -1.337 1 1 37 . 13 1 1 A 6 6 ALA N N 6 123.943 129.175 -5.232 1 1 38 . 13 1 1 A 7 7 ILE H H 7 7.916 7.569 0.347 1 1 42 . 13 1 1 A 7 7 ILE C C 7 175.611 174.597 1.014 1 1 43 . 13 1 1 A 7 7 ILE CA C 7 61.181 59.740 1.441 1 1 44 . 13 1 1 A 7 7 ILE CB C 7 37.910 41.425 -3.515 1 1 48 . 13 1 1 A 7 7 ILE N N 7 118.380 115.846 2.534 1 1 49 . 13 1 1 A 8 8 PHE H H 8 8.167 9.087 -0.920 1 1 50 . 13 1 1 A 8 8 PHE C C 8 175.363 175.654 -0.291 1 1 51 . 13 1 1 A 8 8 PHE CA C 8 57.286 56.294 0.992 1 1 52 . 13 1 1 A 8 8 PHE CB C 8 39.008 42.951 -3.943 1 1 53 . 13 1 1 A 8 8 PHE N N 8 121.971 123.419 -1.448 1 1 54 . 13 1 1 A 9 9 VAL H H 9 7.872 8.874 -1.002 1 1 61 . 13 1 1 A 9 9 VAL C C 9 175.405 176.107 -0.702 1 1 62 . 13 1 1 A 9 9 VAL CA C 9 61.662 63.357 -1.695 1 1 63 . 13 1 1 A 9 9 VAL CB C 9 32.026 31.650 0.376 1 1 66 . 13 1 1 A 9 9 VAL N N 9 120.864 122.757 -1.893 1 1 67 . 13 1 1 A 10 10 LEU H H 10 8.077 8.776 -0.699 1 1 74 . 13 1 1 A 10 10 LEU C C 10 176.652 174.437 2.215 1 1 75 . 13 1 1 A 10 10 LEU CA C 10 54.856 53.483 1.373 1 1 76 . 13 1 1 A 10 10 LEU CB C 10 41.401 46.536 -5.135 1 1 80 . 13 1 1 A 10 10 LEU N N 10 124.826 126.868 -2.042 1 1 81 . 13 1 1 A 11 11 ASN H H 11 8.177 8.736 -0.559 1 1 82 . 13 1 1 A 11 11 ASN C C 11 174.394 175.456 -1.062 1 1 83 . 13 1 1 A 11 11 ASN CA C 11 52.704 52.783 -0.079 1 1 84 . 13 1 1 A 11 11 ASN CB C 11 38.468 39.678 -1.210 1 1 85 . 13 1 1 A 11 11 ASN N N 11 119.029 118.770 0.259 1 1 86 . 13 1 1 A 12 12 ALA H H 12 7.991 8.711 -0.720 1 1 90 . 13 1 1 A 12 12 ALA C C 12 176.649 177.505 -0.856 1 1 91 . 13 1 1 A 12 12 ALA CA C 12 51.950 52.072 -0.122 1 1 92 . 13 1 1 A 12 12 ALA CB C 12 18.659 19.521 -0.862 1 1 93 . 13 1 1 A 12 12 ALA N N 12 123.695 127.261 -3.566 1 1 94 . 13 1 1 A 13 13 ALA H H 13 8.083 8.719 -0.636 1 1 95 . 13 1 1 A 13 13 ALA C C 13 175.395 178.322 -2.927 1 1 96 . 13 1 1 A 13 13 ALA CA C 13 49.797 56.316 -6.519 1 1 97 . 13 1 1 A 13 13 ALA CB C 13 17.486 19.265 -1.779 1 1 98 . 13 1 1 A 13 13 ALA N N 13 124.281 121.331 2.950 1 1 99 . 13 1 1 A 14 14 PRO C C 14 176.641 175.830 0.811 1 1 100 . 13 1 1 A 14 14 PRO CA C 14 62.675 63.212 -0.537 1 1 101 . 13 1 1 A 14 14 PRO CB C 14 31.000 31.429 -0.429 1 1 103 . 13 1 1 A 15 15 LYS H H 15 8.283 8.608 -0.325 1 1 104 . 13 1 1 A 15 15 LYS C C 15 175.683 176.660 -0.977 1 1 105 . 13 1 1 A 15 15 LYS CA C 15 55.429 55.504 -0.075 1 1 106 . 13 1 1 A 15 15 LYS CB C 15 32.246 33.240 -0.994 1 1 109 . 13 1 1 A 15 15 LYS N N 15 119.069 122.280 -3.211 1 1 110 . 13 1 1 A 16 16 ASP H H 16 7.880 8.332 -0.452 1 1 111 . 13 1 1 A 16 16 ASP C C 16 175.419 176.076 -0.657 1 1 112 . 13 1 1 A 16 16 ASP CA C 16 54.413 55.858 -1.445 1 1 113 . 13 1 1 A 16 16 ASP CB C 16 40.224 42.159 -1.935 1 1 114 . 13 1 1 A 16 16 ASP N N 16 119.625 121.830 -2.205 1 1 115 . 13 1 1 A 17 17 ASN H H 17 7.973 7.625 0.348 1 1 116 . 13 1 1 A 17 17 ASN C C 17 174.231 174.648 -0.417 1 1 117 . 13 1 1 A 17 17 ASN CA C 17 53.948 52.446 1.502 1 1 118 . 13 1 1 A 17 17 ASN CB C 17 37.009 39.820 -2.811 1 1 119 . 13 1 1 A 17 17 ASN N N 17 118.063 113.860 4.203 1 1 120 . 13 1 1 A 18 18 THR H H 18 7.318 8.742 -1.424 1 1 121 . 13 1 1 A 18 18 THR C C 18 172.323 172.465 -0.142 1 1 122 . 13 1 1 A 18 18 THR CA C 18 60.153 59.712 0.441 1 1 123 . 13 1 1 A 18 18 THR CB C 18 71.534 72.461 -0.927 1 1 125 . 13 1 1 A 18 18 THR N N 18 109.092 112.559 -3.467 1 1 126 . 13 1 1 A 19 19 TRP H H 19 8.541 8.480 0.061 1 1 127 . 13 1 1 A 19 19 TRP C C 19 175.969 174.915 1.054 1 1 128 . 13 1 1 A 19 19 TRP CA C 19 55.700 55.279 0.421 1 1 129 . 13 1 1 A 19 19 TRP CB C 19 31.471 32.736 -1.265 1 1 130 . 13 1 1 A 19 19 TRP N N 19 121.992 120.550 1.442 1 1 131 . 13 1 1 A 20 20 TYR H H 20 8.691 9.881 -1.190 1 1 132 . 13 1 1 A 20 20 TYR C C 20 173.684 175.117 -1.433 1 1 133 . 13 1 1 A 20 20 TYR CA C 20 55.805 56.127 -0.322 1 1 134 . 13 1 1 A 20 20 TYR CB C 20 40.513 41.603 -1.090 1 1 135 . 13 1 1 A 20 20 TYR N N 20 116.519 121.911 -5.392 1 1 136 . 13 1 1 A 21 21 ALA H H 21 8.876 8.661 0.215 1 1 137 . 13 1 1 A 21 21 ALA C C 21 175.395 176.439 -1.044 1 1 138 . 13 1 1 A 21 21 ALA CA C 21 50.970 51.041 -0.071 1 1 139 . 13 1 1 A 21 21 ALA CB C 21 22.142 23.389 -1.247 1 1 140 . 13 1 1 A 21 21 ALA N N 21 119.359 124.056 -4.697 1 1 141 . 13 1 1 A 22 22 GLY H H 22 8.613 8.422 0.191 1 1 142 . 13 1 1 A 22 22 GLY C C 22 171.458 171.821 -0.363 1 1 143 . 13 1 1 A 22 22 GLY CA C 22 45.608 46.137 -0.529 1 1 144 . 13 1 1 A 22 22 GLY N N 22 106.678 106.630 0.048 1 1 145 . 13 1 1 A 23 23 GLY H H 23 7.911 8.316 -0.405 1 1 146 . 13 1 1 A 23 23 GLY C C 23 170.563 172.002 -1.439 1 1 147 . 13 1 1 A 23 23 GLY CA C 23 44.026 45.299 -1.273 1 1 148 . 13 1 1 A 23 23 GLY N N 23 103.399 108.797 -5.398 1 1 149 . 13 1 1 A 24 24 LYS H H 24 9.001 8.804 0.197 1 1 150 . 13 1 1 A 24 24 LYS C C 24 172.965 174.192 -1.227 1 1 151 . 13 1 1 A 24 24 LYS CA C 24 54.062 54.133 -0.071 1 1 152 . 13 1 1 A 24 24 LYS CB C 24 36.774 36.735 0.039 1 1 156 . 13 1 1 A 24 24 LYS N N 24 116.402 117.279 -0.877 1 1 157 . 13 1 1 A 25 25 LEU H H 25 8.587 9.210 -0.623 1 1 164 . 13 1 1 A 25 25 LEU C C 25 175.205 175.297 -0.092 1 1 165 . 13 1 1 A 25 25 LEU CA C 25 53.446 53.264 0.182 1 1 166 . 13 1 1 A 25 25 LEU CB C 25 46.287 46.903 -0.616 1 1 170 . 13 1 1 A 25 25 LEU N N 25 119.932 121.650 -1.718 1 1 171 . 13 1 1 A 26 26 GLY H H 26 8.637 8.557 0.080 1 1 172 . 13 1 1 A 26 26 GLY C C 26 170.804 172.868 -2.064 1 1 173 . 13 1 1 A 26 26 GLY CA C 26 45.669 45.752 -0.083 1 1 174 . 13 1 1 A 26 26 GLY N N 26 108.136 110.566 -2.430 1 1 175 . 13 1 1 A 27 27 TRP H H 27 8.642 8.999 -0.357 1 1 177 . 13 1 1 A 27 27 TRP C C 27 174.820 173.175 1.645 1 1 178 . 13 1 1 A 27 27 TRP CB C 27 30.883 33.038 -2.155 1 1 179 . 13 1 1 A 27 27 TRP N N 27 120.887 116.869 4.018 1 1 181 . 13 1 1 A 32 32 ASP C C 32 176.315 175.385 0.930 1 1 182 . 13 1 1 A 32 32 ASP CA C 32 53.737 52.631 1.106 1 1 183 . 13 1 1 A 32 32 ASP CB C 32 41.230 44.272 -3.042 1 1 184 . 13 1 1 A 33 33 THR H H 33 8.190 8.575 -0.385 1 1 188 . 13 1 1 A 33 33 THR C C 33 175.291 175.238 0.053 1 1 189 . 13 1 1 A 33 33 THR CA C 33 61.909 61.134 0.775 1 1 190 . 13 1 1 A 33 33 THR CB C 33 68.961 69.984 -1.023 1 1 192 . 13 1 1 A 33 33 THR N N 33 114.235 113.784 0.451 1 1 193 . 13 1 1 A 34 34 GLY H H 34 8.341 8.847 -0.506 1 1 194 . 13 1 1 A 34 34 GLY C C 34 173.766 173.329 0.437 1 1 195 . 13 1 1 A 34 34 GLY CA C 34 44.941 45.785 -0.844 1 1 196 . 13 1 1 A 34 34 GLY N N 34 110.678 114.233 -3.555 1 1 197 . 13 1 1 A 35 35 PHE H H 35 7.945 7.700 0.245 1 1 198 . 13 1 1 A 35 35 PHE C C 35 175.411 172.877 2.534 1 1 199 . 13 1 1 A 35 35 PHE CA C 35 57.921 56.931 0.990 1 1 200 . 13 1 1 A 35 35 PHE CB C 35 38.806 42.703 -3.897 1 1 201 . 13 1 1 A 35 35 PHE N N 35 120.533 119.271 1.262 1 1 202 . 13 1 1 A 36 36 TYR H H 36 7.967 8.040 -0.073 1 1 203 . 13 1 1 A 36 36 TYR C C 36 176.104 173.391 2.713 1 1 204 . 13 1 1 A 36 36 TYR CA C 36 57.568 55.859 1.709 1 1 205 . 13 1 1 A 36 36 TYR CB C 36 37.727 40.630 -2.903 1 1 206 . 13 1 1 A 36 36 TYR N N 36 120.254 120.655 -0.401 1 1 207 . 13 1 1 A 37 37 GLY H H 37 7.666 8.535 -0.869 1 1 208 . 13 1 1 A 37 37 GLY C C 37 173.794 173.648 0.146 1 1 209 . 13 1 1 A 37 37 GLY CA C 37 45.007 45.188 -0.181 1 1 210 . 13 1 1 A 37 37 GLY N N 37 108.995 106.305 2.690 1 1 211 . 13 1 1 A 38 38 ASN H H 38 8.109 9.050 -0.941 1 1 212 . 13 1 1 A 38 38 ASN C C 38 175.612 174.523 1.089 1 1 213 . 13 1 1 A 38 38 ASN CA C 38 52.954 52.900 0.054 1 1 214 . 13 1 1 A 38 38 ASN CB C 38 38.425 39.235 -0.810 1 1 215 . 13 1 1 A 38 38 ASN N N 38 118.603 123.096 -4.493 1 1 216 . 13 1 1 A 39 39 GLY H H 39 8.202 8.063 0.139 1 1 217 . 13 1 1 A 39 39 GLY C C 39 173.958 172.524 1.434 1 1 218 . 13 1 1 A 39 39 GLY CA C 39 45.012 44.059 0.953 1 1 219 . 13 1 1 A 39 39 GLY N N 39 108.897 108.203 0.694 1 1 220 . 13 1 1 A 40 40 PHE H H 40 7.960 8.620 -0.660 1 1 221 . 13 1 1 A 40 40 PHE C C 40 175.653 175.075 0.578 1 1 222 . 13 1 1 A 40 40 PHE CA C 40 57.556 58.624 -1.068 1 1 223 . 13 1 1 A 40 40 PHE CB C 40 38.513 39.244 -0.731 1 1 224 . 13 1 1 A 40 40 PHE N N 40 119.829 120.551 -0.722 1 1 225 . 13 1 1 A 41 41 GLN H H 41 8.173 8.539 -0.366 1 1 226 . 13 1 1 A 41 41 GLN C C 41 175.234 175.904 -0.670 1 1 227 . 13 1 1 A 41 41 GLN CA C 41 55.488 54.652 0.836 1 1 228 . 13 1 1 A 41 41 GLN CB C 41 28.523 29.274 -0.751 1 1 230 . 13 1 1 A 41 41 GLN N N 41 120.810 125.690 -4.880 1 1 231 . 13 1 1 A 42 42 ASN H H 42 8.193 8.978 -0.785 1 1 232 . 13 1 1 A 42 42 ASN C C 42 174.618 175.449 -0.831 1 1 233 . 13 1 1 A 42 42 ASN CA C 42 52.924 55.801 -2.877 1 1 234 . 13 1 1 A 42 42 ASN CB C 42 38.333 38.939 -0.606 1 1 235 . 13 1 1 A 42 42 ASN N N 42 119.679 124.268 -4.589 1 1 236 . 13 1 1 A 43 43 ASN H H 43 8.255 8.064 0.191 1 1 237 . 13 1 1 A 43 43 ASN C C 43 173.873 174.548 -0.675 1 1 238 . 13 1 1 A 43 43 ASN CA C 43 52.919 52.353 0.566 1 1 239 . 13 1 1 A 43 43 ASN CB C 43 38.580 39.081 -0.501 1 1 240 . 13 1 1 A 43 43 ASN N N 43 119.773 116.573 3.200 1 1 241 . 13 1 1 A 44 44 ASN H H 44 7.865 8.801 -0.936 1 1 242 . 13 1 1 A 44 44 ASN C C 44 175.518 174.866 0.652 1 1 243 . 13 1 1 A 44 44 ASN CA C 44 54.528 54.947 -0.419 1 1 244 . 13 1 1 A 44 44 ASN CB C 44 40.170 41.446 -1.276 1 1 246 . 13 1 1 A 44 44 ASN N N 44 124.152 126.905 -2.753 1 1 247 . 13 1 1 A 46 46 PRO C C 46 177.228 176.612 0.616 1 1 248 . 13 1 1 A 46 46 PRO CA C 46 62.794 62.787 0.007 1 1 249 . 13 1 1 A 46 46 PRO CB C 46 31.283 30.850 0.433 1 1 251 . 13 1 1 A 47 47 THR H H 47 8.165 8.280 -0.115 1 1 255 . 13 1 1 A 47 47 THR C C 47 174.573 174.670 -0.097 1 1 256 . 13 1 1 A 47 47 THR CA C 47 61.346 63.815 -2.469 1 1 257 . 13 1 1 A 47 47 THR CB C 47 69.573 69.973 -0.400 1 1 259 . 13 1 1 A 47 47 THR N N 47 114.265 115.534 -1.269 1 1 260 . 13 1 1 A 48 48 ARG H H 48 8.237 7.840 0.397 1 1 261 . 13 1 1 A 48 48 ARG C C 48 175.898 175.368 0.530 1 1 262 . 13 1 1 A 48 48 ARG CA C 48 55.717 56.456 -0.739 1 1 263 . 13 1 1 A 48 48 ARG CB C 48 30.151 30.799 -0.648 1 1 266 . 13 1 1 A 48 48 ARG N N 48 122.795 121.246 1.549 1 1 267 . 13 1 1 A 49 49 ASN H H 49 8.369 8.932 -0.563 1 1 268 . 13 1 1 A 49 49 ASN C C 49 174.560 173.448 1.112 1 1 269 . 13 1 1 A 49 49 ASN CA C 49 53.005 51.931 1.074 1 1 270 . 13 1 1 A 49 49 ASN CB C 49 38.761 39.860 -1.099 1 1 271 . 13 1 1 A 49 49 ASN N N 49 119.837 125.602 -5.765 1 1 272 . 13 1 1 A 50 50 ASP H H 50 8.192 9.120 -0.928 1 1 273 . 13 1 1 A 50 50 ASP C C 50 175.699 175.361 0.338 1 1 274 . 13 1 1 A 50 50 ASP CA C 50 54.289 53.434 0.855 1 1 275 . 13 1 1 A 50 50 ASP CB C 50 41.264 41.493 -0.229 1 1 276 . 13 1 1 A 50 50 ASP N N 50 120.403 128.025 -7.622 1 1 277 . 13 1 1 A 51 51 GLN H H 51 8.428 8.582 -0.154 1 1 278 . 13 1 1 A 51 51 GLN C C 51 175.186 174.266 0.920 1 1 279 . 13 1 1 A 51 51 GLN CA C 51 54.512 55.384 -0.872 1 1 280 . 13 1 1 A 51 51 GLN CB C 51 30.424 28.860 1.564 1 1 282 . 13 1 1 A 51 51 GLN N N 51 118.959 126.386 -7.427 1 1 289 . 13 1 1 A 52 52 LEU C C 52 176.018 175.960 0.058 1 1 290 . 13 1 1 A 52 52 LEU CA C 52 54.332 53.627 0.705 1 1 291 . 13 1 1 A 52 52 LEU CB C 52 43.022 43.246 -0.224 1 1 294 . 13 1 1 A 53 53 GLY H H 53 8.639 8.883 -0.244 1 1 295 . 13 1 1 A 53 53 GLY C C 53 171.931 171.754 0.177 1 1 296 . 13 1 1 A 53 53 GLY CA C 53 43.501 44.212 -0.711 1 1 297 . 13 1 1 A 53 53 GLY N N 53 109.964 112.125 -2.161 1 1 298 . 13 1 1 A 54 54 ALA H H 54 8.881 9.130 -0.249 1 1 299 . 13 1 1 A 54 54 ALA C C 54 175.543 176.245 -0.702 1 1 300 . 13 1 1 A 54 54 ALA CA C 54 50.710 50.970 -0.260 1 1 301 . 13 1 1 A 54 54 ALA CB C 54 22.914 22.413 0.501 1 1 302 . 13 1 1 A 54 54 ALA N N 54 120.413 125.871 -5.458 1 1 303 . 13 1 1 A 55 55 GLY H H 55 8.346 8.873 -0.527 1 1 304 . 13 1 1 A 55 55 GLY C C 55 170.960 171.991 -1.031 1 1 305 . 13 1 1 A 55 55 GLY CA C 55 46.704 44.969 1.735 1 1 306 . 13 1 1 A 55 55 GLY N N 55 104.688 109.040 -4.352 1 1 307 . 13 1 1 A 56 56 ALA H H 56 9.116 8.983 0.133 1 1 308 . 13 1 1 A 56 56 ALA C C 56 176.472 175.943 0.529 1 1 309 . 13 1 1 A 56 56 ALA CA C 56 49.638 50.877 -1.239 1 1 310 . 13 1 1 A 56 56 ALA CB C 56 22.275 22.206 0.069 1 1 311 . 13 1 1 A 56 56 ALA N N 56 120.608 122.900 -2.292 1 1 312 . 13 1 1 A 57 57 PHE H H 57 8.688 8.560 0.128 1 1 313 . 13 1 1 A 57 57 PHE C C 57 172.816 173.143 -0.327 1 1 314 . 13 1 1 A 57 57 PHE CA C 57 56.066 55.560 0.506 1 1 315 . 13 1 1 A 57 57 PHE CB C 57 41.770 42.653 -0.883 1 1 316 . 13 1 1 A 57 57 PHE N N 57 120.027 117.275 2.752 1 1 317 . 13 1 1 A 58 58 GLY H H 58 9.034 9.107 -0.073 1 1 318 . 13 1 1 A 58 58 GLY C C 58 170.860 172.482 -1.622 1 1 319 . 13 1 1 A 58 58 GLY CA C 58 44.954 44.821 0.133 1 1 320 . 13 1 1 A 58 58 GLY N N 58 105.817 106.321 -0.504 1 1 321 . 13 1 1 A 59 59 GLY H H 59 8.382 9.109 -0.727 1 1 322 . 13 1 1 A 59 59 GLY C C 59 169.284 172.517 -3.233 1 1 323 . 13 1 1 A 59 59 GLY CA C 59 45.840 44.158 1.682 1 1 324 . 13 1 1 A 59 59 GLY N N 59 109.059 110.651 -1.592 1 1 325 . 13 1 1 A 60 60 TYR H H 60 8.430 8.646 -0.216 1 1 326 . 13 1 1 A 60 60 TYR C C 60 173.453 172.663 0.790 1 1 327 . 13 1 1 A 60 60 TYR CA C 60 55.282 55.685 -0.403 1 1 328 . 13 1 1 A 60 60 TYR CB C 60 41.712 41.861 -0.149 1 1 329 . 13 1 1 A 60 60 TYR N N 60 118.352 117.704 0.648 1 1 330 . 13 1 1 A 61 61 GLN H H 61 8.833 8.764 0.069 1 1 331 . 13 1 1 A 61 61 GLN C C 61 174.365 175.188 -0.823 1 1 332 . 13 1 1 A 61 61 GLN CA C 61 54.125 55.128 -1.003 1 1 333 . 13 1 1 A 61 61 GLN CB C 61 28.033 30.198 -2.165 1 1 335 . 13 1 1 A 61 61 GLN N N 61 129.628 124.288 5.340 1 1 336 . 13 1 1 A 62 62 VAL H H 62 8.714 8.693 0.021 1 1 343 . 13 1 1 A 62 62 VAL C C 62 175.758 175.291 0.467 1 1 344 . 13 1 1 A 62 62 VAL CA C 62 64.649 63.349 1.300 1 1 345 . 13 1 1 A 62 62 VAL CB C 62 31.900 33.894 -1.994 1 1 348 . 13 1 1 A 62 62 VAL N N 62 127.666 125.443 2.223 1 1 349 . 13 1 1 A 63 63 ASN H H 63 8.062 7.971 0.091 1 1 350 . 13 1 1 A 63 63 ASN C C 63 172.827 173.897 -1.070 1 1 351 . 13 1 1 A 63 63 ASN CA C 63 51.575 49.852 1.723 1 1 352 . 13 1 1 A 63 63 ASN CB C 63 37.194 39.294 -2.100 1 1 353 . 13 1 1 A 63 63 ASN N N 63 116.310 117.906 -1.596 1 1 354 . 13 1 1 A 64 64 PRO C C 64 175.071 176.042 -0.971 1 1 355 . 13 1 1 A 64 64 PRO CA C 64 65.296 62.432 2.864 1 1 356 . 13 1 1 A 64 64 PRO CB C 64 30.428 29.634 0.794 1 1 357 . 13 1 1 A 65 65 TYR H H 65 7.873 8.474 -0.601 1 1 358 . 13 1 1 A 65 65 TYR C C 65 175.145 174.737 0.408 1 1 359 . 13 1 1 A 65 65 TYR CA C 65 56.125 58.589 -2.464 1 1 360 . 13 1 1 A 65 65 TYR CB C 65 39.189 41.018 -1.829 1 1 361 . 13 1 1 A 65 65 TYR N N 65 112.894 123.128 -10.234 1 1 362 . 13 1 1 A 66 66 LEU H H 66 7.308 7.816 -0.508 1 1 369 . 13 1 1 A 66 66 LEU C C 66 173.866 174.444 -0.578 1 1 370 . 13 1 1 A 66 66 LEU CA C 66 53.431 54.059 -0.628 1 1 371 . 13 1 1 A 66 66 LEU CB C 66 44.958 44.162 0.796 1 1 375 . 13 1 1 A 66 66 LEU N N 66 120.270 117.174 3.096 1 1 376 . 13 1 1 A 67 67 GLY H H 67 8.855 8.441 0.414 1 1 377 . 13 1 1 A 67 67 GLY C C 67 170.698 171.835 -1.137 1 1 378 . 13 1 1 A 67 67 GLY CA C 67 44.008 44.179 -0.171 1 1 379 . 13 1 1 A 67 67 GLY N N 67 114.388 106.494 7.894 1 1 380 . 13 1 1 A 68 68 PHE H H 68 8.770 8.317 0.453 1 1 381 . 13 1 1 A 68 68 PHE C C 68 173.386 173.867 -0.481 1 1 382 . 13 1 1 A 68 68 PHE CA C 68 56.507 56.608 -0.101 1 1 383 . 13 1 1 A 68 68 PHE CB C 68 42.428 41.486 0.942 1 1 384 . 13 1 1 A 68 68 PHE N N 68 117.510 121.710 -4.200 1 1 385 . 13 1 1 A 69 69 GLU H H 69 9.079 9.015 0.064 1 1 386 . 13 1 1 A 69 69 GLU C C 69 174.556 175.088 -0.532 1 1 387 . 13 1 1 A 69 69 GLU CA C 69 54.939 54.761 0.178 1 1 388 . 13 1 1 A 69 69 GLU CB C 69 33.963 32.158 1.805 1 1 390 . 13 1 1 A 69 69 GLU N N 69 120.562 126.000 -5.438 1 1 391 . 13 1 1 A 70 70 MET H H 70 9.481 9.175 0.306 1 1 392 . 13 1 1 A 70 70 MET C C 70 174.595 175.842 -1.247 1 1 393 . 13 1 1 A 70 70 MET CA C 70 53.091 54.222 -1.131 1 1 394 . 13 1 1 A 70 70 MET CB C 70 36.159 34.928 1.231 1 1 397 . 13 1 1 A 70 70 MET N N 70 124.928 123.964 0.964 1 1 398 . 13 1 1 A 71 71 GLY H H 71 8.845 8.541 0.304 1 1 399 . 13 1 1 A 71 71 GLY C C 71 170.811 171.215 -0.404 1 1 400 . 13 1 1 A 71 71 GLY CA C 71 44.624 44.324 0.300 1 1 401 . 13 1 1 A 71 71 GLY N N 71 108.896 109.775 -0.879 1 1 402 . 13 1 1 A 72 72 TYR H H 72 8.925 9.059 -0.134 1 1 403 . 13 1 1 A 72 72 TYR C C 72 173.278 174.043 -0.765 1 1 404 . 13 1 1 A 72 72 TYR CA C 72 55.912 56.324 -0.412 1 1 405 . 13 1 1 A 72 72 TYR CB C 72 41.611 41.099 0.512 1 1 406 . 13 1 1 A 72 72 TYR N N 72 123.253 119.982 3.271 1 1 407 . 13 1 1 A 73 73 ASP H H 73 8.665 9.315 -0.650 1 1 408 . 13 1 1 A 73 73 ASP C C 73 173.598 175.045 -1.447 1 1 409 . 13 1 1 A 73 73 ASP CA C 73 52.857 54.104 -1.247 1 1 410 . 13 1 1 A 73 73 ASP CB C 73 42.774 42.287 0.487 1 1 411 . 13 1 1 A 73 73 ASP N N 73 126.178 125.168 1.010 1 1 412 . 13 1 1 A 74 74 TRP H H 74 9.080 8.924 0.156 1 1 413 . 13 1 1 A 74 74 TRP C C 74 174.868 174.963 -0.095 1 1 414 . 13 1 1 A 74 74 TRP CB C 74 30.083 33.187 -3.104 1 1 415 . 13 1 1 A 74 74 TRP N N 74 121.824 125.691 -3.867 1 1 416 . 13 1 1 A 78 78 MET C C 78 174.548 175.872 -1.324 1 1 417 . 13 1 1 A 78 78 MET CA C 78 54.388 54.032 0.356 1 1 418 . 13 1 1 A 78 78 MET CB C 78 32.542 33.469 -0.927 1 1 419 . 13 1 1 A 79 79 ALA H H 79 8.105 8.372 -0.267 1 1 420 . 13 1 1 A 79 79 ALA C C 79 176.629 175.813 0.816 1 1 421 . 13 1 1 A 79 79 ALA CA C 79 51.210 51.353 -0.143 1 1 422 . 13 1 1 A 79 79 ALA CB C 79 19.106 19.547 -0.441 1 1 423 . 13 1 1 A 79 79 ALA N N 79 125.778 127.387 -1.609 1 1 424 . 13 1 1 A 80 80 TYR H H 80 8.035 7.911 0.124 1 1 425 . 13 1 1 A 80 80 TYR C C 80 175.604 173.953 1.651 1 1 426 . 13 1 1 A 80 80 TYR CA C 80 57.021 56.682 0.339 1 1 427 . 13 1 1 A 80 80 TYR CB C 80 38.416 42.180 -3.764 1 1 428 . 13 1 1 A 80 80 TYR N N 80 120.045 120.278 -0.233 1 1 429 . 13 1 1 A 81 81 LYS H H 81 8.295 8.397 -0.102 1 1 430 . 13 1 1 A 81 81 LYS C C 81 176.647 175.808 0.839 1 1 431 . 13 1 1 A 81 81 LYS CA C 81 56.285 55.312 0.973 1 1 432 . 13 1 1 A 81 81 LYS CB C 81 31.571 32.059 -0.488 1 1 434 . 13 1 1 A 81 81 LYS N N 81 123.191 126.250 -3.059 1 1 435 . 13 1 1 A 82 82 GLY H H 82 8.117 8.599 -0.482 1 1 436 . 13 1 1 A 82 82 GLY C C 82 174.010 173.456 0.554 1 1 437 . 13 1 1 A 82 82 GLY CA C 82 44.982 43.983 0.999 1 1 438 . 13 1 1 A 82 82 GLY N N 82 110.014 112.897 -2.883 1 1 439 . 13 1 1 A 83 83 SER H H 83 7.938 8.814 -0.876 1 1 440 . 13 1 1 A 83 83 SER C C 83 174.634 173.551 1.083 1 1 441 . 13 1 1 A 83 83 SER CA C 83 57.685 59.446 -1.761 1 1 442 . 13 1 1 A 83 83 SER CB C 83 63.303 65.335 -2.032 1 1 443 . 13 1 1 A 83 83 SER N N 83 115.655 114.910 0.745 1 1 444 . 13 1 1 A 84 84 VAL H H 84 8.008 8.066 -0.058 1 1 451 . 13 1 1 A 84 84 VAL C C 84 175.525 174.324 1.201 1 1 452 . 13 1 1 A 84 84 VAL CA C 84 61.769 60.004 1.765 1 1 453 . 13 1 1 A 84 84 VAL CB C 84 31.711 34.757 -3.046 1 1 456 . 13 1 1 A 84 84 VAL N N 84 120.054 116.370 3.684 1 1 457 . 13 1 1 A 85 85 ASP H H 85 8.140 8.756 -0.616 1 1 458 . 13 1 1 A 85 85 ASP C C 85 174.740 173.890 0.850 1 1 459 . 13 1 1 A 85 85 ASP CA C 85 53.983 53.558 0.425 1 1 460 . 13 1 1 A 85 85 ASP CB C 85 40.633 44.978 -4.345 1 1 461 . 13 1 1 A 85 85 ASP N N 85 122.510 123.495 -0.985 1 1 462 . 13 1 1 A 86 86 ASN H H 86 7.736 8.431 -0.695 1 1 463 . 13 1 1 A 86 86 ASN C C 86 175.970 174.672 1.298 1 1 464 . 13 1 1 A 86 86 ASN CA C 86 54.349 51.935 2.414 1 1 465 . 13 1 1 A 86 86 ASN CB C 86 40.490 40.605 -0.115 1 1 467 . 13 1 1 A 86 86 ASN N N 86 124.290 118.784 5.506 1 1 468 . 13 1 1 A 87 87 GLY H H 87 8.000 8.300 -0.300 1 1 469 . 13 1 1 A 87 87 GLY C C 87 173.456 172.890 0.566 1 1 470 . 13 1 1 A 87 87 GLY CA C 87 44.973 44.655 0.318 1 1 471 . 13 1 1 A 87 87 GLY N N 87 113.494 110.620 2.874 1 1 472 . 13 1 1 A 88 88 ALA H H 88 8.024 8.031 -0.007 1 1 473 . 13 1 1 A 88 88 ALA C C 88 176.833 175.937 0.896 1 1 474 . 13 1 1 A 88 88 ALA CA C 88 51.734 50.541 1.193 1 1 475 . 13 1 1 A 88 88 ALA CB C 88 19.818 19.339 0.479 1 1 476 . 13 1 1 A 88 88 ALA N N 88 122.676 126.234 -3.558 1 1 477 . 13 1 1 A 91 91 ALA C C 91 174.781 175.524 -0.743 1 1 478 . 13 1 1 A 91 91 ALA CA C 91 50.537 50.192 0.345 1 1 479 . 13 1 1 A 91 91 ALA CB C 91 21.324 23.581 -2.257 1 1 480 . 13 1 1 A 92 92 GLN H H 92 8.451 8.839 -0.388 1 1 481 . 13 1 1 A 92 92 GLN C C 92 173.557 174.076 -0.519 1 1 482 . 13 1 1 A 92 92 GLN CA C 92 53.380 54.261 -0.881 1 1 484 . 13 1 1 A 92 92 GLN N N 92 116.847 115.933 0.914 1 1 485 . 13 1 1 A 93 93 GLY C C 93 170.631 172.856 -2.225 1 1 486 . 13 1 1 A 93 93 GLY CA C 93 45.718 44.389 1.329 1 1 487 . 13 1 1 A 94 94 VAL H H 94 8.686 9.814 -1.128 1 1 494 . 13 1 1 A 94 94 VAL C C 94 173.698 174.022 -0.324 1 1 495 . 13 1 1 A 94 94 VAL CA C 94 58.997 60.231 -1.234 1 1 496 . 13 1 1 A 94 94 VAL CB C 94 33.311 34.212 -0.901 1 1 499 . 13 1 1 A 94 94 VAL N N 94 118.489 119.474 -0.985 1 1 500 . 13 1 1 A 95 95 GLN H H 95 9.468 9.528 -0.060 1 1 501 . 13 1 1 A 95 95 GLN C C 95 174.028 174.137 -0.109 1 1 502 . 13 1 1 A 95 95 GLN CA C 95 52.547 54.505 -1.958 1 1 503 . 13 1 1 A 95 95 GLN CB C 95 33.816 31.709 2.107 1 1 505 . 13 1 1 A 95 95 GLN N N 95 122.106 126.233 -4.127 1 1 506 . 13 1 1 A 96 96 LEU H H 96 8.484 8.772 -0.288 1 1 513 . 13 1 1 A 96 96 LEU C C 96 175.322 174.743 0.579 1 1 514 . 13 1 1 A 96 96 LEU CA C 96 53.736 54.251 -0.515 1 1 515 . 13 1 1 A 96 96 LEU CB C 96 41.088 45.775 -4.687 1 1 519 . 13 1 1 A 96 96 LEU N N 96 123.224 125.314 -2.090 1 1 520 . 13 1 1 A 97 97 THR H H 97 9.116 8.559 0.557 1 1 521 . 13 1 1 A 97 97 THR C C 97 173.251 171.945 1.306 1 1 522 . 13 1 1 A 97 97 THR CA C 97 58.931 60.510 -1.579 1 1 523 . 13 1 1 A 97 97 THR CB C 97 72.984 70.268 2.716 1 1 525 . 13 1 1 A 97 97 THR N N 97 112.504 118.274 -5.770 1 1 526 . 13 1 1 A 98 98 ALA H H 98 8.603 8.542 0.061 1 1 527 . 13 1 1 A 98 98 ALA C C 98 174.948 175.200 -0.252 1 1 528 . 13 1 1 A 98 98 ALA CA C 98 49.980 49.890 0.090 1 1 529 . 13 1 1 A 98 98 ALA CB C 98 19.157 21.262 -2.105 1 1 530 . 13 1 1 A 98 98 ALA N N 98 121.608 125.986 -4.378 1 1 531 . 13 1 1 A 99 99 LYS H H 99 8.890 8.916 -0.026 1 1 532 . 13 1 1 A 99 99 LYS C C 99 174.294 174.794 -0.500 1 1 533 . 13 1 1 A 99 99 LYS CA C 99 54.019 54.575 -0.556 1 1 534 . 13 1 1 A 99 99 LYS CB C 99 33.018 35.590 -2.572 1 1 538 . 13 1 1 A 99 99 LYS N N 99 124.522 122.705 1.817 1 1 539 . 13 1 1 A 100 100 LEU H H 100 8.985 8.742 0.243 1 1 546 . 13 1 1 A 100 100 LEU C C 100 175.265 175.669 -0.404 1 1 547 . 13 1 1 A 100 100 LEU CA C 100 52.698 52.970 -0.272 1 1 548 . 13 1 1 A 100 100 LEU CB C 100 42.889 44.566 -1.677 1 1 552 . 13 1 1 A 100 100 LEU N N 100 131.876 122.854 9.022 1 1 553 . 13 1 1 A 101 101 GLY H H 101 9.137 7.939 1.198 1 1 554 . 13 1 1 A 101 101 GLY C C 101 170.798 171.120 -0.322 1 1 555 . 13 1 1 A 101 101 GLY CA C 101 44.429 45.856 -1.427 1 1 556 . 13 1 1 A 101 101 GLY N N 101 111.928 107.256 4.672 1 1 557 . 13 1 1 A 102 102 TYR H H 102 8.779 8.670 0.109 1 1 558 . 13 1 1 A 102 102 TYR C C 102 173.402 173.397 0.005 1 1 559 . 13 1 1 A 102 102 TYR CA C 102 54.444 56.191 -1.747 1 1 560 . 13 1 1 A 102 102 TYR CB C 102 42.239 42.235 0.004 1 1 561 . 13 1 1 A 102 102 TYR N N 102 116.664 119.054 -2.390 1 1 562 . 13 1 1 A 103 103 PRO C C 103 175.676 175.934 -0.258 1 1 563 . 13 1 1 A 103 103 PRO CA C 103 61.462 62.734 -1.272 1 1 564 . 13 1 1 A 103 103 PRO CB C 103 30.073 33.580 -3.507 1 1 565 . 13 1 1 A 104 104 ILE H H 104 8.670 9.074 -0.404 1 1 569 . 13 1 1 A 104 104 ILE C C 104 176.646 177.048 -0.402 1 1 570 . 13 1 1 A 104 104 ILE CA C 104 62.054 62.171 -0.117 1 1 571 . 13 1 1 A 104 104 ILE CB C 104 37.678 40.798 -3.120 1 1 574 . 13 1 1 A 104 104 ILE N N 104 125.939 120.768 5.171 1 1 575 . 13 1 1 A 105 105 THR H H 105 8.129 7.723 0.406 1 1 576 . 13 1 1 A 105 105 THR C C 105 174.344 173.863 0.481 1 1 577 . 13 1 1 A 105 105 THR CA C 105 59.176 62.038 -2.862 1 1 578 . 13 1 1 A 105 105 THR CB C 105 71.049 70.522 0.527 1 1 580 . 13 1 1 A 105 105 THR N N 105 109.853 111.013 -1.160 1 1 581 . 13 1 1 A 106 106 ASP H H 106 8.424 7.710 0.714 1 1 582 . 13 1 1 A 106 106 ASP C C 106 175.692 176.088 -0.396 1 1 583 . 13 1 1 A 106 106 ASP CA C 106 56.465 55.661 0.804 1 1 584 . 13 1 1 A 106 106 ASP CB C 106 40.032 42.347 -2.315 1 1 585 . 13 1 1 A 106 106 ASP N N 106 117.156 120.275 -3.119 1 1 586 . 13 1 1 A 107 107 ASP H H 107 8.124 8.726 -0.602 1 1 587 . 13 1 1 A 107 107 ASP C C 107 174.174 174.743 -0.569 1 1 588 . 13 1 1 A 107 107 ASP CA C 107 52.907 54.134 -1.227 1 1 589 . 13 1 1 A 107 107 ASP CB C 107 41.661 41.690 -0.029 1 1 590 . 13 1 1 A 107 107 ASP N N 107 113.591 119.375 -5.784 1 1 591 . 13 1 1 A 108 108 LEU H H 108 7.336 7.641 -0.305 1 1 598 . 13 1 1 A 108 108 LEU C C 108 174.321 175.100 -0.779 1 1 599 . 13 1 1 A 108 108 LEU CA C 108 54.449 53.406 1.043 1 1 600 . 13 1 1 A 108 108 LEU CB C 108 44.754 44.695 0.059 1 1 604 . 13 1 1 A 108 108 LEU N N 108 123.244 119.619 3.625 1 1 605 . 13 1 1 A 109 109 ASP H H 109 8.943 9.127 -0.184 1 1 606 . 13 1 1 A 109 109 ASP C C 109 176.248 174.819 1.429 1 1 607 . 13 1 1 A 109 109 ASP CA C 109 52.376 52.210 0.166 1 1 608 . 13 1 1 A 109 109 ASP CB C 109 42.764 45.104 -2.340 1 1 609 . 13 1 1 A 109 109 ASP N N 109 124.634 122.559 2.075 1 1 610 . 13 1 1 A 110 110 ILE H H 110 8.372 8.740 -0.368 1 1 614 . 13 1 1 A 110 110 ILE C C 110 173.735 174.450 -0.715 1 1 615 . 13 1 1 A 110 110 ILE CA C 110 59.129 59.195 -0.066 1 1 616 . 13 1 1 A 110 110 ILE CB C 110 39.402 40.643 -1.241 1 1 620 . 13 1 1 A 110 110 ILE N N 110 119.135 116.582 2.553 1 1 621 . 13 1 1 A 111 111 TYR H H 111 8.695 8.721 -0.026 1 1 622 . 13 1 1 A 111 111 TYR C C 111 172.838 173.016 -0.178 1 1 623 . 13 1 1 A 111 111 TYR CA C 111 56.182 55.992 0.190 1 1 624 . 13 1 1 A 111 111 TYR CB C 111 41.489 41.681 -0.192 1 1 625 . 13 1 1 A 111 111 TYR N N 111 121.248 119.541 1.707 1 1 626 . 13 1 1 A 112 112 THR H H 112 9.172 8.974 0.198 1 1 627 . 13 1 1 A 112 112 THR C C 112 173.850 173.542 0.308 1 1 628 . 13 1 1 A 112 112 THR CA C 112 58.246 60.131 -1.885 1 1 629 . 13 1 1 A 112 112 THR CB C 112 71.676 72.141 -0.465 1 1 631 . 13 1 1 A 112 112 THR N N 112 110.671 112.333 -1.662 1 1 632 . 13 1 1 A 113 113 ARG H H 113 8.732 9.631 -0.899 1 1 633 . 13 1 1 A 113 113 ARG C C 113 175.037 174.569 0.468 1 1 634 . 13 1 1 A 113 113 ARG CA C 113 53.995 54.697 -0.702 1 1 635 . 13 1 1 A 113 113 ARG CB C 113 32.266 33.039 -0.773 1 1 638 . 13 1 1 A 113 113 ARG N N 113 120.642 121.256 -0.614 1 1 639 . 13 1 1 A 114 114 LEU H H 114 8.449 8.971 -0.522 1 1 646 . 13 1 1 A 114 114 LEU C C 114 175.812 175.540 0.272 1 1 647 . 13 1 1 A 114 114 LEU CA C 114 53.335 53.516 -0.181 1 1 648 . 13 1 1 A 114 114 LEU CB C 114 45.182 44.781 0.401 1 1 652 . 13 1 1 A 114 114 LEU N N 114 119.078 124.247 -5.169 1 1 653 . 13 1 1 A 115 115 GLY H H 115 8.232 8.576 -0.344 1 1 654 . 13 1 1 A 115 115 GLY C C 115 171.343 172.217 -0.874 1 1 655 . 13 1 1 A 115 115 GLY CA C 115 46.217 46.043 0.174 1 1 656 . 13 1 1 A 115 115 GLY N N 115 108.966 112.411 -3.445 1 1 657 . 13 1 1 A 116 116 GLY H H 116 8.293 8.320 -0.027 1 1 658 . 13 1 1 A 116 116 GLY C C 116 169.856 172.390 -2.534 1 1 659 . 13 1 1 A 116 116 GLY CA C 116 44.084 45.548 -1.464 1 1 660 . 13 1 1 A 116 116 GLY N N 116 109.676 110.780 -1.104 1 1 661 . 13 1 1 A 117 117 MET H H 117 9.286 8.998 0.288 1 1 662 . 13 1 1 A 117 117 MET C C 117 174.557 175.071 -0.514 1 1 663 . 13 1 1 A 117 117 MET CA C 117 53.258 53.224 0.034 1 1 664 . 13 1 1 A 117 117 MET CB C 117 37.195 35.335 1.860 1 1 667 . 13 1 1 A 117 117 MET N N 117 120.425 117.083 3.342 1 1 668 . 13 1 1 A 118 118 VAL H H 118 9.062 9.169 -0.107 1 1 675 . 13 1 1 A 118 118 VAL C C 118 173.993 175.131 -1.138 1 1 676 . 13 1 1 A 118 118 VAL CA C 118 59.883 61.046 -1.163 1 1 677 . 13 1 1 A 118 118 VAL CB C 118 31.782 34.415 -2.633 1 1 680 . 13 1 1 A 118 118 VAL N N 118 126.948 120.122 6.826 1 1 681 . 13 1 1 A 119 119 TRP H H 119 8.482 8.787 -0.305 1 1 682 . 13 1 1 A 119 119 TRP C C 119 174.608 173.453 1.155 1 1 683 . 13 1 1 A 119 119 TRP CA C 119 53.332 54.836 -1.504 1 1 684 . 13 1 1 A 119 119 TRP CB C 119 33.569 32.731 0.838 1 1 685 . 13 1 1 A 119 119 TRP N N 119 124.631 125.018 -0.387 1 1 686 . 13 1 1 A 120 120 ARG H H 120 9.113 9.174 -0.061 1 1 687 . 13 1 1 A 120 120 ARG C C 120 174.951 174.560 0.391 1 1 688 . 13 1 1 A 120 120 ARG CA C 120 54.684 54.622 0.062 1 1 689 . 13 1 1 A 120 120 ARG CB C 120 33.424 34.281 -0.857 1 1 690 . 13 1 1 A 120 120 ARG N N 120 117.899 118.791 -0.892 1 1 691 . 13 1 1 A 121 121 ALA H H 121 9.299 8.355 0.944 1 1 692 . 13 1 1 A 121 121 ALA C C 121 175.954 175.484 0.470 1 1 693 . 13 1 1 A 121 121 ALA CA C 121 50.368 51.264 -0.896 1 1 694 . 13 1 1 A 121 121 ALA CB C 121 21.141 23.261 -2.120 1 1 695 . 13 1 1 A 121 121 ALA N N 121 128.863 121.128 7.735 1 1 696 . 13 1 1 A 122 122 ASP H H 122 8.488 8.718 -0.230 1 1 697 . 13 1 1 A 122 122 ASP C C 122 175.635 175.385 0.250 1 1 698 . 13 1 1 A 122 122 ASP CA C 122 53.891 53.124 0.767 1 1 699 . 13 1 1 A 122 122 ASP CB C 122 42.492 42.380 0.112 1 1 700 . 13 1 1 A 122 122 ASP N N 122 121.721 119.767 1.954 1 1 701 . 13 1 1 A 123 123 SER H H 123 8.466 9.117 -0.651 1 1 702 . 13 1 1 A 123 123 SER C C 123 174.325 173.329 0.996 1 1 703 . 13 1 1 A 123 123 SER CA C 123 57.325 59.648 -2.323 1 1 704 . 13 1 1 A 123 123 SER CB C 123 63.988 65.840 -1.852 1 1 705 . 13 1 1 A 123 123 SER N N 123 117.374 116.123 1.251 1 1 706 . 13 1 1 A 124 124 LYS H H 124 8.389 7.972 0.417 1 1 707 . 13 1 1 A 124 124 LYS C C 124 176.840 176.175 0.665 1 1 708 . 13 1 1 A 124 124 LYS CA C 124 56.036 55.205 0.831 1 1 709 . 13 1 1 A 124 124 LYS CB C 124 32.397 33.584 -1.187 1 1 711 . 13 1 1 A 124 124 LYS N N 124 122.883 119.685 3.198 1 1 712 . 13 1 1 A 125 125 GLY H H 125 8.281 8.609 -0.328 1 1 713 . 13 1 1 A 125 125 GLY C C 125 173.592 174.748 -1.156 1 1 714 . 13 1 1 A 125 125 GLY CA C 125 44.924 46.432 -1.508 1 1 715 . 13 1 1 A 125 125 GLY N N 125 109.541 112.653 -3.112 1 1 716 . 13 1 1 A 126 126 ASN H H 126 8.185 8.223 -0.038 1 1 717 . 13 1 1 A 126 126 ASN C C 126 176.649 175.165 1.484 1 1 718 . 13 1 1 A 126 126 ASN CA C 126 52.763 52.464 0.299 1 1 719 . 13 1 1 A 126 126 ASN CB C 126 38.439 39.253 -0.814 1 1 720 . 13 1 1 A 126 126 ASN N N 126 119.019 117.786 1.233 1 1 721 . 13 1 1 A 127 127 TYR C C 127 176.913 174.881 2.032 1 1 722 . 13 1 1 A 127 127 TYR CA C 127 57.757 57.088 0.669 1 1 723 . 13 1 1 A 127 127 TYR CB C 127 37.703 37.810 -0.107 1 1 724 . 13 1 1 A 128 128 ALA H H 128 8.050 7.665 0.385 1 1 728 . 13 1 1 A 128 128 ALA C C 128 177.756 176.296 1.460 1 1 729 . 13 1 1 A 128 128 ALA CA C 128 52.321 50.418 1.903 1 1 730 . 13 1 1 A 128 128 ALA CB C 128 18.273 21.364 -3.091 1 1 731 . 13 1 1 A 128 128 ALA N N 128 124.529 125.178 -0.649 1 1 732 . 13 1 1 A 129 129 SER H H 129 8.063 8.898 -0.835 1 1 733 . 13 1 1 A 129 129 SER C C 129 174.938 175.397 -0.459 1 1 734 . 13 1 1 A 129 129 SER CA C 129 58.202 59.593 -1.391 1 1 735 . 13 1 1 A 129 129 SER CB C 129 62.974 65.611 -2.637 1 1 736 . 13 1 1 A 129 129 SER N N 129 114.374 114.487 -0.113 1 1 737 . 13 1 1 A 130 130 THR H H 130 7.875 7.981 -0.106 1 1 741 . 13 1 1 A 130 130 THR C C 130 175.198 175.081 0.117 1 1 742 . 13 1 1 A 130 130 THR CA C 130 61.520 63.924 -2.404 1 1 743 . 13 1 1 A 130 130 THR CB C 130 69.312 69.620 -0.308 1 1 745 . 13 1 1 A 130 130 THR N N 130 113.608 110.598 3.010 1 1 746 . 13 1 1 A 131 131 GLY H H 131 8.219 7.925 0.294 1 1 747 . 13 1 1 A 131 131 GLY C C 131 173.979 173.731 0.248 1 1 748 . 13 1 1 A 131 131 GLY CA C 131 44.991 45.151 -0.160 1 1 749 . 13 1 1 A 131 131 GLY N N 131 110.848 109.567 1.281 1 1 750 . 13 1 1 A 132 132 VAL H H 132 7.729 8.662 -0.933 1 1 757 . 13 1 1 A 132 132 VAL C C 132 175.988 177.317 -1.329 1 1 758 . 13 1 1 A 132 132 VAL CA C 132 61.643 63.384 -1.741 1 1 759 . 13 1 1 A 132 132 VAL CB C 132 31.941 34.416 -2.475 1 1 762 . 13 1 1 A 132 132 VAL N N 132 118.932 125.885 -6.953 1 1 763 . 13 1 1 A 133 133 SER H H 133 8.224 7.825 0.399 1 1 764 . 13 1 1 A 133 133 SER C C 133 174.320 174.188 0.132 1 1 765 . 13 1 1 A 133 133 SER CA C 133 57.756 59.866 -2.110 1 1 766 . 13 1 1 A 133 133 SER CB C 133 63.140 64.163 -1.023 1 1 767 . 13 1 1 A 133 133 SER N N 133 119.260 113.461 5.799 1 1 768 . 13 1 1 A 134 134 ARG H H 134 8.199 7.707 0.492 1 1 769 . 13 1 1 A 134 134 ARG C C 134 175.923 175.488 0.435 1 1 770 . 13 1 1 A 134 134 ARG CA C 134 55.461 55.707 -0.246 1 1 771 . 13 1 1 A 134 134 ARG CB C 134 30.195 31.388 -1.193 1 1 774 . 13 1 1 A 134 134 ARG N N 134 123.262 123.206 0.056 1 1 775 . 13 1 1 A 135 135 SER H H 135 8.256 8.852 -0.596 1 1 776 . 13 1 1 A 135 135 SER C C 135 174.360 172.811 1.549 1 1 777 . 13 1 1 A 135 135 SER CA C 135 57.730 56.740 0.990 1 1 778 . 13 1 1 A 135 135 SER CB C 135 63.275 66.792 -3.517 1 1 779 . 13 1 1 A 135 135 SER N N 135 117.155 118.936 -1.781 1 1 780 . 13 1 1 A 136 136 GLU H H 136 8.374 8.601 -0.227 1 1 781 . 13 1 1 A 136 136 GLU C C 136 176.284 174.507 1.777 1 1 782 . 13 1 1 A 136 136 GLU CA C 136 56.082 54.556 1.526 1 1 783 . 13 1 1 A 136 136 GLU CB C 136 29.820 33.995 -4.175 1 1 785 . 13 1 1 A 136 136 GLU N N 136 122.812 120.548 2.264 1 1 786 . 13 1 1 A 137 137 HIS H H 137 8.118 8.555 -0.437 1 1 787 . 13 1 1 A 137 137 HIS C C 137 173.529 173.621 -0.092 1 1 788 . 13 1 1 A 137 137 HIS CA C 137 54.793 55.027 -0.234 1 1 789 . 13 1 1 A 137 137 HIS CB C 137 30.191 32.692 -2.501 1 1 790 . 13 1 1 A 137 137 HIS N N 137 118.002 120.063 -2.061 1 1 791 . 13 1 1 A 138 138 ASP H H 138 8.572 8.964 -0.392 1 1 792 . 13 1 1 A 138 138 ASP C C 138 174.940 174.804 0.136 1 1 793 . 13 1 1 A 138 138 ASP CA C 138 53.594 52.870 0.724 1 1 794 . 13 1 1 A 138 138 ASP CB C 138 42.165 43.376 -1.211 1 1 795 . 13 1 1 A 138 138 ASP N N 138 121.536 123.396 -1.860 1 1 796 . 13 1 1 A 139 139 THR H H 139 7.857 8.509 -0.652 1 1 797 . 13 1 1 A 139 139 THR C C 139 172.822 172.233 0.589 1 1 798 . 13 1 1 A 139 139 THR CA C 139 59.197 59.523 -0.326 1 1 799 . 13 1 1 A 139 139 THR CB C 139 71.457 71.587 -0.130 1 1 801 . 13 1 1 A 139 139 THR N N 139 113.598 116.084 -2.486 1 1 802 . 13 1 1 A 140 140 GLY C C 140 169.622 171.426 -1.804 1 1 803 . 13 1 1 A 140 140 GLY CA C 140 44.287 43.811 0.476 1 1 804 . 13 1 1 A 141 141 VAL H H 141 7.815 8.501 -0.686 1 1 811 . 13 1 1 A 141 141 VAL C C 141 176.038 173.735 2.303 1 1 812 . 13 1 1 A 141 141 VAL CA C 141 59.739 59.532 0.207 1 1 813 . 13 1 1 A 141 141 VAL CB C 141 33.308 34.881 -1.573 1 1 816 . 13 1 1 A 141 141 VAL N N 141 116.224 122.977 -6.753 1 1 817 . 13 1 1 A 142 142 SER H H 142 9.284 8.808 0.476 1 1 818 . 13 1 1 A 142 142 SER C C 142 171.050 172.383 -1.333 1 1 819 . 13 1 1 A 142 142 SER CB C 142 67.608 66.301 1.307 1 1 820 . 13 1 1 A 142 142 SER N N 142 123.223 121.887 1.336 1 1 821 . 13 1 1 A 143 143 PRO C C 143 174.032 176.154 -2.122 1 1 822 . 13 1 1 A 143 143 PRO CA C 143 62.350 62.498 -0.148 1 1 823 . 13 1 1 A 143 143 PRO CB C 143 31.774 32.558 -0.784 1 1 825 . 13 1 1 A 144 144 VAL H H 144 7.785 8.805 -1.020 1 1 832 . 13 1 1 A 144 144 VAL C C 144 172.826 174.244 -1.418 1 1 833 . 13 1 1 A 144 144 VAL CA C 144 59.770 59.776 -0.006 1 1 834 . 13 1 1 A 144 144 VAL CB C 144 34.407 35.933 -1.526 1 1 837 . 13 1 1 A 144 144 VAL N N 144 120.214 117.144 3.070 1 1 838 . 13 1 1 A 145 145 PHE H H 145 8.623 8.416 0.207 1 1 839 . 13 1 1 A 145 145 PHE C C 145 173.658 172.769 0.889 1 1 840 . 13 1 1 A 145 145 PHE CA C 145 54.942 55.786 -0.844 1 1 841 . 13 1 1 A 145 145 PHE CB C 145 42.692 42.130 0.562 1 1 842 . 13 1 1 A 145 145 PHE N N 145 123.914 118.980 4.934 1 1 843 . 13 1 1 A 146 146 ALA H H 146 8.886 8.828 0.058 1 1 844 . 13 1 1 A 146 146 ALA C C 146 176.258 175.732 0.526 1 1 845 . 13 1 1 A 146 146 ALA CA C 146 49.734 50.382 -0.648 1 1 846 . 13 1 1 A 146 146 ALA CB C 146 22.244 23.561 -1.317 1 1 847 . 13 1 1 A 146 146 ALA N N 146 125.243 123.262 1.981 1 1 848 . 13 1 1 A 147 147 GLY H H 147 8.470 8.609 -0.139 1 1 849 . 13 1 1 A 147 147 GLY C C 147 170.940 172.611 -1.671 1 1 850 . 13 1 1 A 147 147 GLY CA C 147 44.063 44.293 -0.230 1 1 851 . 13 1 1 A 147 147 GLY N N 147 106.669 105.946 0.723 1 1 852 . 13 1 1 A 148 148 GLY H H 148 8.008 8.196 -0.188 1 1 853 . 13 1 1 A 148 148 GLY C C 148 170.181 172.159 -1.978 1 1 854 . 13 1 1 A 148 148 GLY CA C 148 45.736 45.239 0.497 1 1 855 . 13 1 1 A 148 148 GLY N N 148 109.475 108.767 0.708 1 1 856 . 13 1 1 A 149 149 VAL H H 149 8.426 8.423 0.003 1 1 863 . 13 1 1 A 149 149 VAL C C 149 174.157 173.388 0.769 1 1 864 . 13 1 1 A 149 149 VAL CA C 149 58.200 58.782 -0.582 1 1 865 . 13 1 1 A 149 149 VAL CB C 149 34.464 35.619 -1.155 1 1 868 . 13 1 1 A 149 149 VAL N N 149 112.651 115.340 -2.689 1 1 869 . 13 1 1 A 150 150 GLU H H 150 9.070 9.280 -0.210 1 1 870 . 13 1 1 A 150 150 GLU C C 150 173.892 174.295 -0.403 1 1 871 . 13 1 1 A 150 150 GLU CA C 150 54.617 54.883 -0.266 1 1 872 . 13 1 1 A 150 150 GLU CB C 150 32.911 33.847 -0.936 1 1 874 . 13 1 1 A 150 150 GLU N N 150 124.471 121.829 2.642 1 1 875 . 13 1 1 A 151 151 TRP H H 151 9.461 9.657 -0.196 1 1 877 . 13 1 1 A 151 151 TRP C C 151 174.370 174.453 -0.083 1 1 878 . 13 1 1 A 151 151 TRP CA C 151 54.113 55.755 -1.642 1 1 879 . 13 1 1 A 151 151 TRP CB C 151 31.688 32.968 -1.280 1 1 880 . 13 1 1 A 151 151 TRP N N 151 129.611 128.555 1.056 1 1 882 . 13 1 1 A 152 152 ALA H H 152 8.771 9.244 -0.473 1 1 883 . 13 1 1 A 152 152 ALA C C 152 175.079 177.021 -1.942 1 1 884 . 13 1 1 A 152 152 ALA CA C 152 51.417 52.236 -0.819 1 1 885 . 13 1 1 A 152 152 ALA CB C 152 17.209 19.334 -2.125 1 1 886 . 13 1 1 A 152 152 ALA N N 152 130.502 130.502 0.000 1 1 887 . 13 1 1 A 153 153 VAL H H 153 7.893 8.437 -0.544 1 1 894 . 13 1 1 A 153 153 VAL C C 153 176.612 177.911 -1.299 1 1 895 . 13 1 1 A 153 153 VAL CA C 153 63.600 64.116 -0.516 1 1 896 . 13 1 1 A 153 153 VAL CB C 153 31.280 31.973 -0.693 1 1 899 . 13 1 1 A 153 153 VAL N N 153 124.360 122.953 1.407 1 1 900 . 13 1 1 A 154 154 THR H H 154 7.950 8.059 -0.109 1 1 904 . 13 1 1 A 154 154 THR C C 154 173.884 175.348 -1.464 1 1 905 . 13 1 1 A 154 154 THR CA C 154 58.655 64.190 -5.535 1 1 906 . 13 1 1 A 154 154 THR CB C 154 71.262 68.492 2.770 1 1 908 . 13 1 1 A 154 154 THR N N 154 109.176 111.353 -2.177 1 1 909 . 13 1 1 A 155 155 ARG H H 155 8.310 7.869 0.441 1 1 910 . 13 1 1 A 155 155 ARG C C 155 176.753 176.680 0.073 1 1 911 . 13 1 1 A 155 155 ARG CA C 155 58.456 57.256 1.200 1 1 912 . 13 1 1 A 155 155 ARG CB C 155 29.043 33.187 -4.144 1 1 915 . 13 1 1 A 155 155 ARG N N 155 116.576 119.991 -3.415 1 1 916 . 13 1 1 A 156 156 ASP H H 156 7.783 8.402 -0.619 1 1 917 . 13 1 1 A 156 156 ASP C C 156 174.222 175.353 -1.131 1 1 918 . 13 1 1 A 156 156 ASP CA C 156 53.540 54.538 -0.998 1 1 919 . 13 1 1 A 156 156 ASP CB C 156 42.327 42.395 -0.068 1 1 920 . 13 1 1 A 156 156 ASP N N 156 112.950 118.523 -5.573 1 1 921 . 13 1 1 A 157 157 ILE H H 157 7.233 7.711 -0.478 1 1 925 . 13 1 1 A 157 157 ILE C C 157 174.178 174.552 -0.374 1 1 926 . 13 1 1 A 157 157 ILE CA C 157 59.350 59.679 -0.329 1 1 927 . 13 1 1 A 157 157 ILE CB C 157 38.969 40.117 -1.148 1 1 930 . 13 1 1 A 157 157 ILE N N 157 119.732 119.093 0.639 1 1 931 . 13 1 1 A 158 158 ALA H H 158 8.729 9.108 -0.379 1 1 932 . 13 1 1 A 158 158 ALA C C 158 176.567 175.088 1.479 1 1 933 . 13 1 1 A 158 158 ALA CA C 158 49.418 50.468 -1.050 1 1 934 . 13 1 1 A 158 158 ALA CB C 158 21.430 24.204 -2.774 1 1 935 . 13 1 1 A 158 158 ALA N N 158 128.564 128.179 0.385 1 1 936 . 13 1 1 A 159 159 THR H H 159 8.972 9.054 -0.082 1 1 940 . 13 1 1 A 159 159 THR C C 159 172.213 173.293 -1.080 1 1 941 . 13 1 1 A 159 159 THR CA C 159 59.504 60.021 -0.517 1 1 942 . 13 1 1 A 159 159 THR CB C 159 70.728 72.146 -1.418 1 1 944 . 13 1 1 A 159 159 THR N N 159 114.901 113.180 1.721 1 1 945 . 13 1 1 A 160 160 ARG H H 160 8.924 9.378 -0.454 1 1 946 . 13 1 1 A 160 160 ARG C C 160 174.097 173.994 0.103 1 1 947 . 13 1 1 A 160 160 ARG CA C 160 53.066 54.436 -1.370 1 1 948 . 13 1 1 A 160 160 ARG CB C 160 32.922 34.211 -1.289 1 1 951 . 13 1 1 A 160 160 ARG N N 160 121.507 126.084 -4.577 1 1 952 . 13 1 1 A 161 161 LEU H H 161 8.611 9.073 -0.462 1 1 959 . 13 1 1 A 161 161 LEU C C 161 174.389 174.865 -0.476 1 1 960 . 13 1 1 A 161 161 LEU CA C 161 53.355 53.526 -0.171 1 1 961 . 13 1 1 A 161 161 LEU CB C 161 44.360 45.562 -1.202 1 1 964 . 13 1 1 A 161 161 LEU N N 161 124.711 123.188 1.523 1 1 965 . 13 1 1 A 162 162 GLU H H 162 8.746 9.020 -0.274 1 1 966 . 13 1 1 A 162 162 GLU C C 162 173.376 174.919 -1.543 1 1 967 . 13 1 1 A 162 162 GLU CA C 162 53.904 54.576 -0.672 1 1 968 . 13 1 1 A 162 162 GLU CB C 162 33.773 32.893 0.880 1 1 970 . 13 1 1 A 162 162 GLU N N 162 122.300 125.696 -3.396 1 1 971 . 13 1 1 A 163 163 TYR H H 163 8.872 8.922 -0.050 1 1 972 . 13 1 1 A 163 163 TYR C C 163 173.425 172.815 0.610 1 1 973 . 13 1 1 A 163 163 TYR CA C 163 56.192 55.277 0.915 1 1 974 . 13 1 1 A 163 163 TYR CB C 163 40.870 42.116 -1.246 1 1 975 . 13 1 1 A 163 163 TYR N N 163 124.618 119.077 5.541 1 1 976 . 13 1 1 A 171 171 ASP C C 171 175.753 175.702 0.051 1 1 977 . 13 1 1 A 171 171 ASP CA C 171 53.517 53.736 -0.219 1 1 978 . 13 1 1 A 171 171 ASP CB C 171 41.353 42.646 -1.293 1 1 979 . 13 1 1 A 172 172 ALA H H 172 8.336 8.739 -0.403 1 1 983 . 13 1 1 A 172 172 ALA C C 172 178.110 176.394 1.716 1 1 984 . 13 1 1 A 172 172 ALA CA C 172 52.190 50.949 1.241 1 1 985 . 13 1 1 A 172 172 ALA CB C 172 18.305 21.861 -3.556 1 1 986 . 13 1 1 A 172 172 ALA N N 172 125.294 123.319 1.975 1 1 987 . 13 1 1 A 173 173 GLY H H 173 8.300 8.439 -0.139 1 1 988 . 13 1 1 A 173 173 GLY C C 173 174.437 175.398 -0.961 1 1 989 . 13 1 1 A 173 173 GLY CA C 173 45.083 46.025 -0.942 1 1 990 . 13 1 1 A 173 173 GLY N N 173 107.268 111.519 -4.251 1 1 991 . 13 1 1 A 174 174 THR H H 174 7.754 8.019 -0.265 1 1 992 . 13 1 1 A 174 174 THR C C 174 174.738 174.675 0.063 1 1 993 . 13 1 1 A 174 174 THR CA C 174 61.310 63.385 -2.075 1 1 994 . 13 1 1 A 174 174 THR CB C 174 69.310 71.354 -2.044 1 1 996 . 13 1 1 A 174 174 THR N N 174 113.472 110.742 2.730 1 1 997 . 13 1 1 A 175 175 VAL H H 175 7.993 7.839 0.154 1 1 1004 . 13 1 1 A 175 175 VAL C C 175 176.535 174.300 2.235 1 1 1005 . 13 1 1 A 175 175 VAL CA C 175 62.126 59.863 2.263 1 1 1006 . 13 1 1 A 175 175 VAL CB C 175 31.282 34.564 -3.282 1 1 1009 . 13 1 1 A 175 175 VAL N N 175 121.643 115.351 6.292 1 1 1010 . 13 1 1 A 176 176 GLY H H 176 8.056 8.213 -0.157 1 1 1011 . 13 1 1 A 176 176 GLY C C 176 173.930 173.625 0.305 1 1 1012 . 13 1 1 A 176 176 GLY CA C 176 44.983 45.077 -0.094 1 1 1013 . 13 1 1 A 176 176 GLY N N 176 110.460 108.856 1.604 1 1 1014 . 13 1 1 A 177 177 THR H H 177 7.520 8.447 -0.927 1 1 1015 . 13 1 1 A 177 177 THR C C 177 173.574 174.603 -1.029 1 1 1016 . 13 1 1 A 177 177 THR CA C 177 60.609 63.484 -2.875 1 1 1017 . 13 1 1 A 177 177 THR CB C 177 69.506 70.873 -1.367 1 1 1019 . 13 1 1 A 177 177 THR N N 177 113.390 112.728 0.662 1 1 1020 . 13 1 1 A 178 178 ARG H H 178 8.261 7.965 0.296 1 1 1021 . 13 1 1 A 178 178 ARG C C 178 173.932 174.016 -0.084 1 1 1022 . 13 1 1 A 178 178 ARG CA C 178 53.683 52.517 1.166 1 1 1023 . 13 1 1 A 178 178 ARG CB C 178 29.224 33.358 -4.134 1 1 1026 . 13 1 1 A 178 178 ARG N N 178 123.906 119.423 4.483 1 1 1027 . 13 1 1 A 183 183 MET C C 183 174.053 174.260 -0.207 1 1 1028 . 13 1 1 A 183 183 MET CA C 183 53.700 54.576 -0.876 1 1 1029 . 13 1 1 A 183 183 MET CB C 183 35.908 35.500 0.408 1 1 1032 . 13 1 1 A 184 184 LEU H H 184 8.319 8.845 -0.526 1 1 1033 . 13 1 1 A 184 184 LEU C C 184 175.235 175.406 -0.171 1 1 1034 . 13 1 1 A 184 184 LEU CA C 184 53.120 53.465 -0.345 1 1 1035 . 13 1 1 A 184 184 LEU CB C 184 42.857 45.576 -2.719 1 1 1038 . 13 1 1 A 184 184 LEU N N 184 131.293 127.882 3.411 1 1 1039 . 13 1 1 A 185 185 SER H H 185 9.603 8.950 0.653 1 1 1040 . 13 1 1 A 185 185 SER C C 185 171.293 173.122 -1.829 1 1 1041 . 13 1 1 A 185 185 SER CA C 185 56.504 57.382 -0.878 1 1 1042 . 13 1 1 A 185 185 SER CB C 185 66.585 66.744 -0.159 1 1 1043 . 13 1 1 A 185 185 SER N N 185 119.338 118.289 1.049 1 1 1044 . 13 1 1 A 186 186 LEU H H 186 8.583 8.539 0.044 1 1 1051 . 13 1 1 A 186 186 LEU C C 186 175.328 176.561 -1.233 1 1 1052 . 13 1 1 A 186 186 LEU CA C 186 52.729 53.156 -0.427 1 1 1053 . 13 1 1 A 186 186 LEU CB C 186 44.996 45.091 -0.095 1 1 1056 . 13 1 1 A 186 186 LEU N N 186 122.719 124.028 -1.309 1 1 1057 . 13 1 1 A 187 187 GLY H H 187 9.287 8.563 0.724 1 1 1058 . 13 1 1 A 187 187 GLY C C 187 172.315 173.485 -1.170 1 1 1059 . 13 1 1 A 187 187 GLY CA C 187 43.502 45.145 -1.643 1 1 1060 . 13 1 1 A 187 187 GLY N N 187 110.265 110.493 -0.228 1 1 1061 . 13 1 1 A 188 188 VAL H H 188 8.825 8.583 0.242 1 1 1068 . 13 1 1 A 188 188 VAL C C 188 173.125 174.638 -1.513 1 1 1069 . 13 1 1 A 188 188 VAL CA C 188 59.739 59.334 0.405 1 1 1070 . 13 1 1 A 188 188 VAL CB C 188 34.532 35.902 -1.370 1 1 1073 . 13 1 1 A 188 188 VAL N N 188 119.161 116.256 2.905 1 1 1074 . 13 1 1 A 189 189 SER H H 189 9.051 8.825 0.226 1 1 1075 . 13 1 1 A 189 189 SER C C 189 171.698 172.941 -1.243 1 1 1076 . 13 1 1 A 189 189 SER CA C 189 55.997 57.408 -1.411 1 1 1077 . 13 1 1 A 189 189 SER CB C 189 66.094 66.481 -0.387 1 1 1078 . 13 1 1 A 189 189 SER N N 189 117.810 117.246 0.564 1 1 1079 . 13 1 1 A 190 190 TYR H H 190 9.145 9.187 -0.042 1 1 1080 . 13 1 1 A 190 190 TYR C C 190 174.063 172.472 1.591 1 1 1081 . 13 1 1 A 190 190 TYR CA C 190 55.375 55.847 -0.472 1 1 1082 . 13 1 1 A 190 190 TYR CB C 190 41.183 41.584 -0.401 1 1 1083 . 13 1 1 A 190 190 TYR N N 190 123.690 117.882 5.808 1 1 1084 . 13 1 1 A 191 191 ARG H H 191 8.211 8.487 -0.276 1 1 1085 . 13 1 1 A 191 191 ARG C C 191 174.826 175.971 -1.145 1 1 1086 . 13 1 1 A 191 191 ARG CA C 191 54.464 54.268 0.196 1 1 1087 . 13 1 1 A 191 191 ARG CB C 191 30.507 31.691 -1.184 1 1 1090 . 13 1 1 A 191 191 ARG N N 191 125.366 120.772 4.594 1 1 1091 . 13 1 1 A 192 192 PHE H H 192 8.496 9.219 -0.723 1 1 1092 . 13 1 1 A 192 192 PHE C C 192 176.384 176.082 0.302 1 1 1093 . 13 1 1 A 192 192 PHE CA C 192 57.179 57.905 -0.726 1 1 1094 . 13 1 1 A 192 192 PHE CB C 192 39.430 38.867 0.563 1 1 1095 . 13 1 1 A 192 192 PHE N N 192 121.586 125.825 -4.239 1 1 1096 . 13 1 1 A 193 193 GLY H H 193 8.643 8.568 0.075 1 1 1097 . 13 1 1 A 193 193 GLY C C 193 174.466 171.740 2.726 1 1 1098 . 13 1 1 A 193 193 GLY CA C 193 45.126 44.632 0.494 1 1 1099 . 13 1 1 A 193 193 GLY N N 193 109.499 111.259 -1.760 1 1 1100 . 13 1 1 A 194 194 GLN H H 194 8.512 8.533 -0.021 1 1 1101 . 13 1 1 A 194 194 GLN C C 194 176.201 175.560 0.641 1 1 1102 . 13 1 1 A 194 194 GLN CA C 194 55.433 54.793 0.640 1 1 1103 . 13 1 1 A 194 194 GLN CB C 194 28.729 30.766 -2.037 1 1 1105 . 13 1 1 A 194 194 GLN N N 194 119.448 119.910 -0.462 1 1 1106 . 13 1 1 A 195 195 GLU H H 195 8.530 9.107 -0.577 1 1 1107 . 13 1 1 A 195 195 GLU C C 195 176.151 175.375 0.776 1 1 1108 . 13 1 1 A 195 195 GLU CA C 195 56.256 57.682 -1.426 1 1 1109 . 13 1 1 A 195 195 GLU CB C 195 29.486 31.477 -1.991 1 1 1111 . 13 1 1 A 195 195 GLU N N 195 121.959 127.213 -5.254 1 1 1112 . 13 1 1 A 196 196 ASP H H 196 8.253 8.200 0.053 1 1 1113 . 13 1 1 A 196 196 ASP C C 196 175.667 175.198 0.469 1 1 1114 . 13 1 1 A 196 196 ASP CA C 196 53.981 53.164 0.817 1 1 1115 . 13 1 1 A 196 196 ASP CB C 196 40.700 41.174 -0.474 1 1 1116 . 13 1 1 A 196 196 ASP N N 196 121.819 117.536 4.283 1 1 1117 . 13 1 1 A 197 197 ALA H H 197 7.999 8.778 -0.779 1 1 1121 . 13 1 1 A 197 197 ALA C C 197 176.847 176.657 0.190 1 1 1122 . 13 1 1 A 197 197 ALA CA C 197 51.612 51.552 0.060 1 1 1123 . 13 1 1 A 197 197 ALA CB C 197 18.192 18.310 -0.118 1 1 1124 . 13 1 1 A 197 197 ALA N N 197 124.262 128.007 -3.745 1 1 1125 . 13 1 1 A 198 198 ALA H H 198 8.042 7.452 0.590 1 1 1126 . 13 1 1 A 198 198 ALA C C 198 176.865 175.725 1.140 1 1 1127 . 13 1 1 A 198 198 ALA CA C 198 49.999 51.069 -1.070 1 1 1128 . 13 1 1 A 198 198 ALA CB C 198 17.327 18.157 -0.830 1 1 1129 . 13 1 1 A 198 198 ALA N N 198 124.724 121.265 3.459 1 1 1130 . 13 1 1 A 199 199 PRO C C 199 176.727 175.741 0.986 1 1 1131 . 13 1 1 A 199 199 PRO CA C 199 62.399 62.586 -0.187 1 1 1132 . 13 1 1 A 199 199 PRO CB C 199 30.949 30.673 0.276 1 1 1135 . 13 1 1 A 200 200 VAL H H 200 8.026 8.347 -0.321 1 1 1142 . 13 1 1 A 200 200 VAL C C 200 176.034 175.235 0.799 1 1 1143 . 13 1 1 A 200 200 VAL CA C 200 61.944 60.284 1.660 1 1 1144 . 13 1 1 A 200 200 VAL CB C 200 31.734 35.344 -3.610 1 1 1147 . 13 1 1 A 200 200 VAL N N 200 120.635 124.566 -3.931 1 1 1148 . 13 1 1 A 201 201 VAL H H 201 7.966 8.603 -0.637 1 1 1155 . 13 1 1 A 201 201 VAL C C 201 175.128 175.109 0.019 1 1 1156 . 13 1 1 A 201 201 VAL CA C 201 61.249 60.641 0.608 1 1 1157 . 13 1 1 A 201 201 VAL CB C 201 31.917 31.618 0.299 1 1 1160 . 13 1 1 A 201 201 VAL N N 201 124.053 121.772 2.281 1 1 1161 . 13 1 1 A 202 202 ALA H H 202 8.159 7.882 0.277 1 1 1162 . 13 1 1 A 202 202 ALA C C 202 175.153 175.972 -0.819 1 1 1163 . 13 1 1 A 202 202 ALA CA C 202 49.742 48.733 1.009 1 1 1164 . 13 1 1 A 202 202 ALA CB C 202 17.532 20.082 -2.550 1 1 1165 . 13 1 1 A 202 202 ALA N N 202 129.251 126.066 3.185 1 1 1166 . 13 1 1 A 203 203 PRO C C 203 176.273 175.305 0.968 1 1 1167 . 13 1 1 A 203 203 PRO CA C 203 62.324 62.781 -0.457 1 1 1168 . 13 1 1 A 203 203 PRO CB C 203 31.042 32.370 -1.328 1 1 1170 . 13 1 1 A 204 204 ALA H H 204 8.137 8.225 -0.088 1 1 1171 . 13 1 1 A 204 204 ALA C C 204 175.697 175.344 0.353 1 1 1172 . 13 1 1 A 204 204 ALA CA C 204 49.865 49.094 0.771 1 1 1173 . 13 1 1 A 204 204 ALA CB C 204 17.364 22.102 -4.738 1 1 1174 . 13 1 1 A 204 204 ALA N N 204 125.510 122.806 2.704 1 1 1175 . 13 1 1 A 205 205 PRO C C 205 175.430 177.123 -1.693 1 1 1176 . 13 1 1 A 205 205 PRO CA C 205 62.511 63.012 -0.501 1 1 1177 . 13 1 1 A 205 205 PRO CB C 205 31.056 31.593 -0.537 1 1 1179 . 13 1 1 A 206 206 ALA H H 206 7.847 8.242 -0.395 1 1 1180 . 13 1 1 A 206 206 ALA C C 206 175.565 175.860 -0.295 1 1 1181 . 13 1 1 A 206 206 ALA CA C 206 49.487 50.971 -1.484 1 1 1182 . 13 1 1 A 206 206 ALA CB C 206 18.843 17.991 0.852 1 1 1183 . 13 1 1 A 206 206 ALA N N 206 123.663 125.304 -1.641 1 1 1184 . 13 1 1 A 207 207 PRO C C 207 174.397 176.285 -1.888 1 1 1185 . 13 1 1 A 207 207 PRO CA C 207 61.454 62.820 -1.366 1 1 1186 . 13 1 1 A 207 207 PRO CB C 207 31.929 31.797 0.132 1 1 1187 . 13 1 1 A 208 208 ALA H H 208 7.898 8.424 -0.526 1 1 1188 . 13 1 1 A 208 208 ALA C C 208 175.411 177.276 -1.865 1 1 1189 . 13 1 1 A 208 208 ALA CA C 208 49.472 53.293 -3.821 1 1 1190 . 13 1 1 A 208 208 ALA CB C 208 19.082 20.394 -1.312 1 1 1191 . 13 1 1 A 208 208 ALA N N 208 127.450 120.223 7.227 1 1 1192 . 13 1 1 A 209 209 PRO C C 209 176.932 176.784 0.148 1 1 1193 . 13 1 1 A 209 209 PRO CA C 209 62.736 62.949 -0.213 1 1 1194 . 13 1 1 A 209 209 PRO CB C 209 31.012 30.476 0.536 1 1 1 . 14 1 1 A 2 2 ARG C C 2 175.857 175.140 0.717 1 1 2 . 14 1 1 A 2 2 ARG CA C 2 55.872 55.333 0.539 1 1 3 . 14 1 1 A 2 2 ARG CB C 2 29.983 30.936 -0.953 1 1 5 . 14 1 1 A 3 3 ILE H H 3 8.238 7.634 0.604 1 1 9 . 14 1 1 A 3 3 ILE C C 3 175.763 174.712 1.051 1 1 10 . 14 1 1 A 3 3 ILE CA C 3 60.779 59.096 1.683 1 1 11 . 14 1 1 A 3 3 ILE CB C 3 37.664 41.976 -4.312 1 1 15 . 14 1 1 A 3 3 ILE N N 3 122.580 116.694 5.886 1 1 16 . 14 1 1 A 4 4 MET H H 4 8.261 8.612 -0.351 1 1 17 . 14 1 1 A 4 4 MET C C 4 175.660 174.400 1.260 1 1 18 . 14 1 1 A 4 4 MET CA C 4 54.893 54.292 0.601 1 1 19 . 14 1 1 A 4 4 MET CB C 4 32.060 35.272 -3.212 1 1 22 . 14 1 1 A 4 4 MET N N 4 123.988 121.715 2.273 1 1 23 . 14 1 1 A 5 5 LYS H H 5 8.041 8.814 -0.773 1 1 24 . 14 1 1 A 5 5 LYS C C 5 175.850 175.800 0.050 1 1 25 . 14 1 1 A 5 5 LYS CA C 5 56.081 56.864 -0.783 1 1 26 . 14 1 1 A 5 5 LYS CB C 5 32.220 35.363 -3.143 1 1 29 . 14 1 1 A 5 5 LYS N N 5 122.015 121.601 0.414 1 1 30 . 14 1 1 A 6 6 ALA H H 6 8.042 7.954 0.088 1 1 34 . 14 1 1 A 6 6 ALA C C 6 177.160 175.917 1.243 1 1 35 . 14 1 1 A 6 6 ALA CA C 6 52.109 50.165 1.944 1 1 36 . 14 1 1 A 6 6 ALA CB C 6 18.637 21.195 -2.558 1 1 37 . 14 1 1 A 6 6 ALA N N 6 123.943 120.844 3.099 1 1 38 . 14 1 1 A 7 7 ILE H H 7 7.916 8.787 -0.871 1 1 42 . 14 1 1 A 7 7 ILE C C 7 175.611 174.375 1.236 1 1 43 . 14 1 1 A 7 7 ILE CA C 7 61.181 59.748 1.433 1 1 44 . 14 1 1 A 7 7 ILE CB C 7 37.910 42.252 -4.342 1 1 48 . 14 1 1 A 7 7 ILE N N 7 118.380 122.637 -4.257 1 1 49 . 14 1 1 A 8 8 PHE H H 8 8.167 8.607 -0.440 1 1 50 . 14 1 1 A 8 8 PHE C C 8 175.363 176.059 -0.696 1 1 51 . 14 1 1 A 8 8 PHE CA C 8 57.286 57.179 0.107 1 1 52 . 14 1 1 A 8 8 PHE CB C 8 39.008 40.534 -1.526 1 1 53 . 14 1 1 A 8 8 PHE N N 8 121.971 126.185 -4.214 1 1 54 . 14 1 1 A 9 9 VAL H H 9 7.872 8.859 -0.987 1 1 61 . 14 1 1 A 9 9 VAL C C 9 175.405 175.489 -0.084 1 1 62 . 14 1 1 A 9 9 VAL CA C 9 61.662 61.810 -0.148 1 1 63 . 14 1 1 A 9 9 VAL CB C 9 32.026 32.975 -0.949 1 1 66 . 14 1 1 A 9 9 VAL N N 9 120.864 123.245 -2.381 1 1 67 . 14 1 1 A 10 10 LEU H H 10 8.077 8.910 -0.833 1 1 74 . 14 1 1 A 10 10 LEU C C 10 176.652 177.476 -0.824 1 1 75 . 14 1 1 A 10 10 LEU CA C 10 54.856 55.974 -1.118 1 1 76 . 14 1 1 A 10 10 LEU CB C 10 41.401 43.800 -2.399 1 1 80 . 14 1 1 A 10 10 LEU N N 10 124.826 122.678 2.148 1 1 81 . 14 1 1 A 11 11 ASN H H 11 8.177 8.128 0.049 1 1 82 . 14 1 1 A 11 11 ASN C C 11 174.394 174.522 -0.128 1 1 83 . 14 1 1 A 11 11 ASN CA C 11 52.704 53.328 -0.624 1 1 84 . 14 1 1 A 11 11 ASN CB C 11 38.468 37.587 0.881 1 1 85 . 14 1 1 A 11 11 ASN N N 11 119.029 113.408 5.621 1 1 86 . 14 1 1 A 12 12 ALA H H 12 7.991 7.589 0.402 1 1 90 . 14 1 1 A 12 12 ALA C C 12 176.649 176.080 0.569 1 1 91 . 14 1 1 A 12 12 ALA CA C 12 51.950 52.228 -0.278 1 1 92 . 14 1 1 A 12 12 ALA CB C 12 18.659 21.159 -2.500 1 1 93 . 14 1 1 A 12 12 ALA N N 12 123.695 122.267 1.428 1 1 94 . 14 1 1 A 13 13 ALA H H 13 8.083 8.632 -0.549 1 1 95 . 14 1 1 A 13 13 ALA C C 13 175.395 177.816 -2.421 1 1 96 . 14 1 1 A 13 13 ALA CA C 13 49.797 50.587 -0.790 1 1 97 . 14 1 1 A 13 13 ALA CB C 13 17.486 18.781 -1.295 1 1 98 . 14 1 1 A 13 13 ALA N N 13 124.281 126.830 -2.549 1 1 99 . 14 1 1 A 14 14 PRO C C 14 176.641 176.741 -0.100 1 1 100 . 14 1 1 A 14 14 PRO CA C 14 62.675 64.783 -2.108 1 1 101 . 14 1 1 A 14 14 PRO CB C 14 31.000 31.988 -0.988 1 1 103 . 14 1 1 A 15 15 LYS H H 15 8.283 8.056 0.227 1 1 104 . 14 1 1 A 15 15 LYS C C 15 175.683 176.078 -0.395 1 1 105 . 14 1 1 A 15 15 LYS CA C 15 55.429 55.135 0.294 1 1 106 . 14 1 1 A 15 15 LYS CB C 15 32.246 34.287 -2.041 1 1 109 . 14 1 1 A 15 15 LYS N N 15 119.069 118.539 0.530 1 1 110 . 14 1 1 A 16 16 ASP H H 16 7.880 8.556 -0.676 1 1 111 . 14 1 1 A 16 16 ASP C C 16 175.419 176.326 -0.907 1 1 112 . 14 1 1 A 16 16 ASP CA C 16 54.413 56.371 -1.958 1 1 113 . 14 1 1 A 16 16 ASP CB C 16 40.224 42.306 -2.082 1 1 114 . 14 1 1 A 16 16 ASP N N 16 119.625 124.969 -5.344 1 1 115 . 14 1 1 A 17 17 ASN H H 17 7.973 7.980 -0.007 1 1 116 . 14 1 1 A 17 17 ASN C C 17 174.231 174.832 -0.601 1 1 117 . 14 1 1 A 17 17 ASN CA C 17 53.948 52.929 1.019 1 1 118 . 14 1 1 A 17 17 ASN CB C 17 37.009 38.902 -1.893 1 1 119 . 14 1 1 A 17 17 ASN N N 17 118.063 117.263 0.800 1 1 120 . 14 1 1 A 18 18 THR H H 18 7.318 9.006 -1.688 1 1 121 . 14 1 1 A 18 18 THR C C 18 172.323 173.391 -1.068 1 1 122 . 14 1 1 A 18 18 THR CA C 18 60.153 60.028 0.125 1 1 123 . 14 1 1 A 18 18 THR CB C 18 71.534 71.739 -0.205 1 1 125 . 14 1 1 A 18 18 THR N N 18 109.092 114.098 -5.006 1 1 126 . 14 1 1 A 19 19 TRP H H 19 8.541 8.720 -0.179 1 1 127 . 14 1 1 A 19 19 TRP C C 19 175.969 173.799 2.170 1 1 128 . 14 1 1 A 19 19 TRP CA C 19 55.700 56.146 -0.446 1 1 129 . 14 1 1 A 19 19 TRP CB C 19 31.471 33.257 -1.786 1 1 130 . 14 1 1 A 19 19 TRP N N 19 121.992 126.852 -4.860 1 1 131 . 14 1 1 A 20 20 TYR H H 20 8.691 9.123 -0.432 1 1 132 . 14 1 1 A 20 20 TYR C C 20 173.684 175.061 -1.377 1 1 133 . 14 1 1 A 20 20 TYR CA C 20 55.805 56.444 -0.639 1 1 134 . 14 1 1 A 20 20 TYR CB C 20 40.513 42.455 -1.942 1 1 135 . 14 1 1 A 20 20 TYR N N 20 116.519 125.584 -9.065 1 1 136 . 14 1 1 A 21 21 ALA H H 21 8.876 8.775 0.101 1 1 137 . 14 1 1 A 21 21 ALA C C 21 175.395 175.995 -0.600 1 1 138 . 14 1 1 A 21 21 ALA CA C 21 50.970 51.330 -0.360 1 1 139 . 14 1 1 A 21 21 ALA CB C 21 22.142 23.599 -1.457 1 1 140 . 14 1 1 A 21 21 ALA N N 21 119.359 122.733 -3.374 1 1 141 . 14 1 1 A 22 22 GLY H H 22 8.613 8.466 0.147 1 1 142 . 14 1 1 A 22 22 GLY C C 22 171.458 172.136 -0.678 1 1 143 . 14 1 1 A 22 22 GLY CA C 22 45.608 46.176 -0.568 1 1 144 . 14 1 1 A 22 22 GLY N N 22 106.678 106.427 0.251 1 1 145 . 14 1 1 A 23 23 GLY H H 23 7.911 8.509 -0.598 1 1 146 . 14 1 1 A 23 23 GLY C C 23 170.563 172.022 -1.459 1 1 147 . 14 1 1 A 23 23 GLY CA C 23 44.026 44.752 -0.726 1 1 148 . 14 1 1 A 23 23 GLY N N 23 103.399 108.963 -5.564 1 1 149 . 14 1 1 A 24 24 LYS H H 24 9.001 9.180 -0.179 1 1 150 . 14 1 1 A 24 24 LYS C C 24 172.965 174.242 -1.277 1 1 151 . 14 1 1 A 24 24 LYS CA C 24 54.062 54.960 -0.898 1 1 152 . 14 1 1 A 24 24 LYS CB C 24 36.774 36.353 0.421 1 1 156 . 14 1 1 A 24 24 LYS N N 24 116.402 122.421 -6.019 1 1 157 . 14 1 1 A 25 25 LEU H H 25 8.587 9.230 -0.643 1 1 164 . 14 1 1 A 25 25 LEU C C 25 175.205 175.207 -0.002 1 1 165 . 14 1 1 A 25 25 LEU CA C 25 53.446 53.423 0.023 1 1 166 . 14 1 1 A 25 25 LEU CB C 25 46.287 46.941 -0.654 1 1 170 . 14 1 1 A 25 25 LEU N N 25 119.932 125.514 -5.582 1 1 171 . 14 1 1 A 26 26 GLY H H 26 8.637 8.752 -0.115 1 1 172 . 14 1 1 A 26 26 GLY C C 26 170.804 172.000 -1.196 1 1 173 . 14 1 1 A 26 26 GLY CA C 26 45.669 45.264 0.405 1 1 174 . 14 1 1 A 26 26 GLY N N 26 108.136 110.649 -2.513 1 1 175 . 14 1 1 A 27 27 TRP H H 27 8.642 8.412 0.230 1 1 177 . 14 1 1 A 27 27 TRP C C 27 174.820 176.004 -1.184 1 1 178 . 14 1 1 A 27 27 TRP CB C 27 30.883 32.502 -1.619 1 1 179 . 14 1 1 A 27 27 TRP N N 27 120.887 120.750 0.137 1 1 181 . 14 1 1 A 32 32 ASP C C 32 176.315 176.681 -0.366 1 1 182 . 14 1 1 A 32 32 ASP CA C 32 53.737 53.030 0.707 1 1 183 . 14 1 1 A 32 32 ASP CB C 32 41.230 42.746 -1.516 1 1 184 . 14 1 1 A 33 33 THR H H 33 8.190 8.916 -0.726 1 1 188 . 14 1 1 A 33 33 THR C C 33 175.291 175.123 0.168 1 1 189 . 14 1 1 A 33 33 THR CA C 33 61.909 64.601 -2.692 1 1 190 . 14 1 1 A 33 33 THR CB C 33 68.961 69.408 -0.447 1 1 192 . 14 1 1 A 33 33 THR N N 33 114.235 118.635 -4.400 1 1 193 . 14 1 1 A 34 34 GLY H H 34 8.341 7.347 0.994 1 1 194 . 14 1 1 A 34 34 GLY C C 34 173.766 172.311 1.455 1 1 195 . 14 1 1 A 34 34 GLY CA C 34 44.941 44.325 0.616 1 1 196 . 14 1 1 A 34 34 GLY N N 34 110.678 106.948 3.730 1 1 197 . 14 1 1 A 35 35 PHE H H 35 7.945 8.730 -0.785 1 1 198 . 14 1 1 A 35 35 PHE C C 35 175.411 175.135 0.276 1 1 199 . 14 1 1 A 35 35 PHE CA C 35 57.921 56.676 1.245 1 1 200 . 14 1 1 A 35 35 PHE CB C 35 38.806 43.182 -4.376 1 1 201 . 14 1 1 A 35 35 PHE N N 35 120.533 121.845 -1.312 1 1 202 . 14 1 1 A 36 36 TYR H H 36 7.967 8.846 -0.879 1 1 203 . 14 1 1 A 36 36 TYR C C 36 176.104 176.340 -0.236 1 1 204 . 14 1 1 A 36 36 TYR CA C 36 57.568 60.586 -3.018 1 1 205 . 14 1 1 A 36 36 TYR CB C 36 37.727 39.817 -2.090 1 1 206 . 14 1 1 A 36 36 TYR N N 36 120.254 122.164 -1.910 1 1 207 . 14 1 1 A 37 37 GLY H H 37 7.666 7.980 -0.314 1 1 208 . 14 1 1 A 37 37 GLY C C 37 173.794 172.618 1.176 1 1 209 . 14 1 1 A 37 37 GLY CA C 37 45.007 46.094 -1.087 1 1 210 . 14 1 1 A 37 37 GLY N N 37 108.995 107.255 1.740 1 1 211 . 14 1 1 A 38 38 ASN H H 38 8.109 8.976 -0.867 1 1 212 . 14 1 1 A 38 38 ASN C C 38 175.612 174.552 1.060 1 1 213 . 14 1 1 A 38 38 ASN CA C 38 52.954 52.416 0.538 1 1 214 . 14 1 1 A 38 38 ASN CB C 38 38.425 39.427 -1.002 1 1 215 . 14 1 1 A 38 38 ASN N N 38 118.603 124.489 -5.886 1 1 216 . 14 1 1 A 39 39 GLY H H 39 8.202 8.565 -0.363 1 1 217 . 14 1 1 A 39 39 GLY C C 39 173.958 171.880 2.078 1 1 218 . 14 1 1 A 39 39 GLY CA C 39 45.012 46.150 -1.138 1 1 219 . 14 1 1 A 39 39 GLY N N 39 108.897 112.598 -3.701 1 1 220 . 14 1 1 A 40 40 PHE H H 40 7.960 8.593 -0.633 1 1 221 . 14 1 1 A 40 40 PHE C C 40 175.653 173.639 2.014 1 1 222 . 14 1 1 A 40 40 PHE CA C 40 57.556 55.878 1.678 1 1 223 . 14 1 1 A 40 40 PHE CB C 40 38.513 40.025 -1.512 1 1 224 . 14 1 1 A 40 40 PHE N N 40 119.829 122.015 -2.186 1 1 225 . 14 1 1 A 41 41 GLN H H 41 8.173 8.246 -0.073 1 1 226 . 14 1 1 A 41 41 GLN C C 41 175.234 175.228 0.006 1 1 227 . 14 1 1 A 41 41 GLN CA C 41 55.488 54.034 1.454 1 1 228 . 14 1 1 A 41 41 GLN CB C 41 28.523 32.414 -3.891 1 1 230 . 14 1 1 A 41 41 GLN N N 41 120.810 124.706 -3.896 1 1 231 . 14 1 1 A 42 42 ASN H H 42 8.193 8.694 -0.501 1 1 232 . 14 1 1 A 42 42 ASN C C 42 174.618 174.429 0.189 1 1 233 . 14 1 1 A 42 42 ASN CA C 42 52.924 53.618 -0.694 1 1 234 . 14 1 1 A 42 42 ASN CB C 42 38.333 38.454 -0.121 1 1 235 . 14 1 1 A 42 42 ASN N N 42 119.679 122.048 -2.369 1 1 236 . 14 1 1 A 43 43 ASN H H 43 8.255 8.594 -0.339 1 1 237 . 14 1 1 A 43 43 ASN C C 43 173.873 173.788 0.085 1 1 238 . 14 1 1 A 43 43 ASN CA C 43 52.919 52.197 0.722 1 1 239 . 14 1 1 A 43 43 ASN CB C 43 38.580 39.919 -1.339 1 1 240 . 14 1 1 A 43 43 ASN N N 43 119.773 123.910 -4.137 1 1 241 . 14 1 1 A 44 44 ASN H H 44 7.865 8.886 -1.021 1 1 242 . 14 1 1 A 44 44 ASN C C 44 175.518 175.419 0.099 1 1 243 . 14 1 1 A 44 44 ASN CA C 44 54.528 52.901 1.627 1 1 244 . 14 1 1 A 44 44 ASN CB C 44 40.170 38.740 1.430 1 1 246 . 14 1 1 A 44 44 ASN N N 44 124.152 124.314 -0.162 1 1 247 . 14 1 1 A 46 46 PRO C C 46 177.228 177.550 -0.322 1 1 248 . 14 1 1 A 46 46 PRO CA C 46 62.794 65.015 -2.221 1 1 249 . 14 1 1 A 46 46 PRO CB C 46 31.283 31.670 -0.387 1 1 251 . 14 1 1 A 47 47 THR H H 47 8.165 7.964 0.201 1 1 255 . 14 1 1 A 47 47 THR C C 47 174.573 174.749 -0.176 1 1 256 . 14 1 1 A 47 47 THR CA C 47 61.346 60.883 0.463 1 1 257 . 14 1 1 A 47 47 THR CB C 47 69.573 68.763 0.810 1 1 259 . 14 1 1 A 47 47 THR N N 47 114.265 108.438 5.827 1 1 260 . 14 1 1 A 48 48 ARG H H 48 8.237 8.183 0.054 1 1 261 . 14 1 1 A 48 48 ARG C C 48 175.898 175.862 0.036 1 1 262 . 14 1 1 A 48 48 ARG CA C 48 55.717 57.387 -1.670 1 1 263 . 14 1 1 A 48 48 ARG CB C 48 30.151 33.605 -3.454 1 1 266 . 14 1 1 A 48 48 ARG N N 48 122.795 120.470 2.325 1 1 267 . 14 1 1 A 49 49 ASN H H 49 8.369 7.764 0.605 1 1 268 . 14 1 1 A 49 49 ASN C C 49 174.560 173.902 0.658 1 1 269 . 14 1 1 A 49 49 ASN CA C 49 53.005 51.006 1.999 1 1 270 . 14 1 1 A 49 49 ASN CB C 49 38.761 40.073 -1.312 1 1 271 . 14 1 1 A 49 49 ASN N N 49 119.837 114.148 5.689 1 1 272 . 14 1 1 A 50 50 ASP H H 50 8.192 8.579 -0.387 1 1 273 . 14 1 1 A 50 50 ASP C C 50 175.699 175.227 0.472 1 1 274 . 14 1 1 A 50 50 ASP CA C 50 54.289 52.968 1.321 1 1 275 . 14 1 1 A 50 50 ASP CB C 50 41.264 44.471 -3.207 1 1 276 . 14 1 1 A 50 50 ASP N N 50 120.403 118.714 1.689 1 1 277 . 14 1 1 A 51 51 GLN H H 51 8.428 8.407 0.021 1 1 278 . 14 1 1 A 51 51 GLN C C 51 175.186 174.116 1.070 1 1 279 . 14 1 1 A 51 51 GLN CA C 51 54.512 54.508 0.004 1 1 280 . 14 1 1 A 51 51 GLN CB C 51 30.424 31.118 -0.694 1 1 282 . 14 1 1 A 51 51 GLN N N 51 118.959 118.746 0.213 1 1 289 . 14 1 1 A 52 52 LEU C C 52 176.018 175.443 0.575 1 1 290 . 14 1 1 A 52 52 LEU CA C 52 54.332 52.287 2.045 1 1 291 . 14 1 1 A 52 52 LEU CB C 52 43.022 45.240 -2.218 1 1 294 . 14 1 1 A 53 53 GLY H H 53 8.639 8.483 0.156 1 1 295 . 14 1 1 A 53 53 GLY C C 53 171.931 172.064 -0.133 1 1 296 . 14 1 1 A 53 53 GLY CA C 53 43.501 44.196 -0.695 1 1 297 . 14 1 1 A 53 53 GLY N N 53 109.964 106.843 3.121 1 1 298 . 14 1 1 A 54 54 ALA H H 54 8.881 8.910 -0.029 1 1 299 . 14 1 1 A 54 54 ALA C C 54 175.543 176.549 -1.006 1 1 300 . 14 1 1 A 54 54 ALA CA C 54 50.710 51.217 -0.507 1 1 301 . 14 1 1 A 54 54 ALA CB C 54 22.914 23.787 -0.873 1 1 302 . 14 1 1 A 54 54 ALA N N 54 120.413 123.522 -3.109 1 1 303 . 14 1 1 A 55 55 GLY H H 55 8.346 8.588 -0.242 1 1 304 . 14 1 1 A 55 55 GLY C C 55 170.960 171.689 -0.729 1 1 305 . 14 1 1 A 55 55 GLY CA C 55 46.704 45.968 0.736 1 1 306 . 14 1 1 A 55 55 GLY N N 55 104.688 105.139 -0.451 1 1 307 . 14 1 1 A 56 56 ALA H H 56 9.116 8.237 0.879 1 1 308 . 14 1 1 A 56 56 ALA C C 56 176.472 176.822 -0.350 1 1 309 . 14 1 1 A 56 56 ALA CA C 56 49.638 51.027 -1.389 1 1 310 . 14 1 1 A 56 56 ALA CB C 56 22.275 20.970 1.305 1 1 311 . 14 1 1 A 56 56 ALA N N 56 120.608 122.059 -1.451 1 1 312 . 14 1 1 A 57 57 PHE H H 57 8.688 9.145 -0.457 1 1 313 . 14 1 1 A 57 57 PHE C C 57 172.816 175.319 -2.503 1 1 314 . 14 1 1 A 57 57 PHE CA C 57 56.066 56.911 -0.845 1 1 315 . 14 1 1 A 57 57 PHE CB C 57 41.770 43.057 -1.287 1 1 316 . 14 1 1 A 57 57 PHE N N 57 120.027 117.790 2.237 1 1 317 . 14 1 1 A 58 58 GLY H H 58 9.034 8.707 0.327 1 1 318 . 14 1 1 A 58 58 GLY C C 58 170.860 172.759 -1.899 1 1 319 . 14 1 1 A 58 58 GLY CA C 58 44.954 45.285 -0.331 1 1 320 . 14 1 1 A 58 58 GLY N N 58 105.817 110.015 -4.198 1 1 321 . 14 1 1 A 59 59 GLY H H 59 8.382 8.087 0.295 1 1 322 . 14 1 1 A 59 59 GLY C C 59 169.284 171.036 -1.752 1 1 323 . 14 1 1 A 59 59 GLY CA C 59 45.840 45.668 0.172 1 1 324 . 14 1 1 A 59 59 GLY N N 59 109.059 109.097 -0.038 1 1 325 . 14 1 1 A 60 60 TYR H H 60 8.430 8.830 -0.400 1 1 326 . 14 1 1 A 60 60 TYR C C 60 173.453 172.540 0.913 1 1 327 . 14 1 1 A 60 60 TYR CA C 60 55.282 55.716 -0.434 1 1 328 . 14 1 1 A 60 60 TYR CB C 60 41.712 41.924 -0.212 1 1 329 . 14 1 1 A 60 60 TYR N N 60 118.352 115.601 2.751 1 1 330 . 14 1 1 A 61 61 GLN H H 61 8.833 8.782 0.051 1 1 331 . 14 1 1 A 61 61 GLN C C 61 174.365 175.030 -0.665 1 1 332 . 14 1 1 A 61 61 GLN CA C 61 54.125 54.239 -0.114 1 1 333 . 14 1 1 A 61 61 GLN CB C 61 28.033 31.637 -3.604 1 1 335 . 14 1 1 A 61 61 GLN N N 61 129.628 119.907 9.721 1 1 336 . 14 1 1 A 62 62 VAL H H 62 8.714 7.966 0.748 1 1 343 . 14 1 1 A 62 62 VAL C C 62 175.758 175.553 0.205 1 1 344 . 14 1 1 A 62 62 VAL CA C 62 64.649 63.487 1.162 1 1 345 . 14 1 1 A 62 62 VAL CB C 62 31.900 33.862 -1.962 1 1 348 . 14 1 1 A 62 62 VAL N N 62 127.666 123.294 4.372 1 1 349 . 14 1 1 A 63 63 ASN H H 63 8.062 7.301 0.761 1 1 350 . 14 1 1 A 63 63 ASN C C 63 172.827 174.902 -2.075 1 1 351 . 14 1 1 A 63 63 ASN CA C 63 51.575 51.476 0.099 1 1 352 . 14 1 1 A 63 63 ASN CB C 63 37.194 37.789 -0.595 1 1 353 . 14 1 1 A 63 63 ASN N N 63 116.310 118.684 -2.374 1 1 354 . 14 1 1 A 64 64 PRO C C 64 175.071 176.638 -1.567 1 1 355 . 14 1 1 A 64 64 PRO CA C 64 65.296 64.573 0.723 1 1 356 . 14 1 1 A 64 64 PRO CB C 64 30.428 31.837 -1.409 1 1 357 . 14 1 1 A 65 65 TYR H H 65 7.873 7.761 0.112 1 1 358 . 14 1 1 A 65 65 TYR C C 65 175.145 173.863 1.282 1 1 359 . 14 1 1 A 65 65 TYR CA C 65 56.125 57.125 -1.000 1 1 360 . 14 1 1 A 65 65 TYR CB C 65 39.189 39.794 -0.605 1 1 361 . 14 1 1 A 65 65 TYR N N 65 112.894 117.059 -4.165 1 1 362 . 14 1 1 A 66 66 LEU H H 66 7.308 7.493 -0.185 1 1 369 . 14 1 1 A 66 66 LEU C C 66 173.866 175.287 -1.421 1 1 370 . 14 1 1 A 66 66 LEU CA C 66 53.431 53.942 -0.511 1 1 371 . 14 1 1 A 66 66 LEU CB C 66 44.958 45.745 -0.787 1 1 375 . 14 1 1 A 66 66 LEU N N 66 120.270 121.931 -1.661 1 1 376 . 14 1 1 A 67 67 GLY H H 67 8.855 8.952 -0.097 1 1 377 . 14 1 1 A 67 67 GLY C C 67 170.698 171.993 -1.295 1 1 378 . 14 1 1 A 67 67 GLY CA C 67 44.008 43.958 0.050 1 1 379 . 14 1 1 A 67 67 GLY N N 67 114.388 111.760 2.628 1 1 380 . 14 1 1 A 68 68 PHE H H 68 8.770 8.407 0.363 1 1 381 . 14 1 1 A 68 68 PHE C C 68 173.386 174.121 -0.735 1 1 382 . 14 1 1 A 68 68 PHE CA C 68 56.507 56.105 0.402 1 1 383 . 14 1 1 A 68 68 PHE CB C 68 42.428 42.231 0.197 1 1 384 . 14 1 1 A 68 68 PHE N N 68 117.510 122.925 -5.415 1 1 385 . 14 1 1 A 69 69 GLU H H 69 9.079 8.760 0.319 1 1 386 . 14 1 1 A 69 69 GLU C C 69 174.556 174.503 0.053 1 1 387 . 14 1 1 A 69 69 GLU CA C 69 54.939 54.568 0.371 1 1 388 . 14 1 1 A 69 69 GLU CB C 69 33.963 33.540 0.423 1 1 390 . 14 1 1 A 69 69 GLU N N 69 120.562 123.891 -3.329 1 1 391 . 14 1 1 A 70 70 MET H H 70 9.481 9.741 -0.260 1 1 392 . 14 1 1 A 70 70 MET C C 70 174.595 175.055 -0.460 1 1 393 . 14 1 1 A 70 70 MET CA C 70 53.091 53.682 -0.591 1 1 394 . 14 1 1 A 70 70 MET CB C 70 36.159 35.011 1.148 1 1 397 . 14 1 1 A 70 70 MET N N 70 124.928 119.570 5.358 1 1 398 . 14 1 1 A 71 71 GLY H H 71 8.845 8.688 0.157 1 1 399 . 14 1 1 A 71 71 GLY C C 71 170.811 171.721 -0.910 1 1 400 . 14 1 1 A 71 71 GLY CA C 71 44.624 43.633 0.991 1 1 401 . 14 1 1 A 71 71 GLY N N 71 108.896 108.624 0.272 1 1 402 . 14 1 1 A 72 72 TYR H H 72 8.925 8.923 0.002 1 1 403 . 14 1 1 A 72 72 TYR C C 72 173.278 174.016 -0.738 1 1 404 . 14 1 1 A 72 72 TYR CA C 72 55.912 56.300 -0.388 1 1 405 . 14 1 1 A 72 72 TYR CB C 72 41.611 40.860 0.751 1 1 406 . 14 1 1 A 72 72 TYR N N 72 123.253 118.899 4.354 1 1 407 . 14 1 1 A 73 73 ASP H H 73 8.665 9.374 -0.709 1 1 408 . 14 1 1 A 73 73 ASP C C 73 173.598 175.039 -1.441 1 1 409 . 14 1 1 A 73 73 ASP CA C 73 52.857 54.265 -1.408 1 1 410 . 14 1 1 A 73 73 ASP CB C 73 42.774 41.919 0.855 1 1 411 . 14 1 1 A 73 73 ASP N N 73 126.178 125.415 0.763 1 1 412 . 14 1 1 A 74 74 TRP H H 74 9.080 8.922 0.158 1 1 413 . 14 1 1 A 74 74 TRP C C 74 174.868 176.310 -1.442 1 1 414 . 14 1 1 A 74 74 TRP CB C 74 30.083 31.704 -1.621 1 1 415 . 14 1 1 A 74 74 TRP N N 74 121.824 125.909 -4.085 1 1 416 . 14 1 1 A 78 78 MET C C 78 174.548 175.185 -0.637 1 1 417 . 14 1 1 A 78 78 MET CA C 78 54.388 54.269 0.119 1 1 418 . 14 1 1 A 78 78 MET CB C 78 32.542 35.278 -2.736 1 1 419 . 14 1 1 A 79 79 ALA H H 79 8.105 8.454 -0.349 1 1 420 . 14 1 1 A 79 79 ALA C C 79 176.629 175.658 0.971 1 1 421 . 14 1 1 A 79 79 ALA CA C 79 51.210 51.598 -0.388 1 1 422 . 14 1 1 A 79 79 ALA CB C 79 19.106 22.960 -3.854 1 1 423 . 14 1 1 A 79 79 ALA N N 79 125.778 121.144 4.634 1 1 424 . 14 1 1 A 80 80 TYR H H 80 8.035 8.953 -0.918 1 1 425 . 14 1 1 A 80 80 TYR C C 80 175.604 175.481 0.123 1 1 426 . 14 1 1 A 80 80 TYR CA C 80 57.021 57.310 -0.289 1 1 427 . 14 1 1 A 80 80 TYR CB C 80 38.416 40.137 -1.721 1 1 428 . 14 1 1 A 80 80 TYR N N 80 120.045 121.831 -1.786 1 1 429 . 14 1 1 A 81 81 LYS H H 81 8.295 9.216 -0.921 1 1 430 . 14 1 1 A 81 81 LYS C C 81 176.647 178.053 -1.406 1 1 431 . 14 1 1 A 81 81 LYS CA C 81 56.285 56.673 -0.388 1 1 432 . 14 1 1 A 81 81 LYS CB C 81 31.571 34.920 -3.349 1 1 434 . 14 1 1 A 81 81 LYS N N 81 123.191 122.947 0.244 1 1 435 . 14 1 1 A 82 82 GLY H H 82 8.117 8.015 0.102 1 1 436 . 14 1 1 A 82 82 GLY C C 82 174.010 173.677 0.333 1 1 437 . 14 1 1 A 82 82 GLY CA C 82 44.982 45.910 -0.928 1 1 438 . 14 1 1 A 82 82 GLY N N 82 110.014 107.962 2.052 1 1 439 . 14 1 1 A 83 83 SER H H 83 7.938 7.924 0.014 1 1 440 . 14 1 1 A 83 83 SER C C 83 174.634 172.836 1.798 1 1 441 . 14 1 1 A 83 83 SER CA C 83 57.685 56.964 0.721 1 1 442 . 14 1 1 A 83 83 SER CB C 83 63.303 62.710 0.593 1 1 443 . 14 1 1 A 83 83 SER N N 83 115.655 115.408 0.247 1 1 444 . 14 1 1 A 84 84 VAL H H 84 8.008 8.668 -0.660 1 1 451 . 14 1 1 A 84 84 VAL C C 84 175.525 175.071 0.454 1 1 452 . 14 1 1 A 84 84 VAL CA C 84 61.769 61.236 0.533 1 1 453 . 14 1 1 A 84 84 VAL CB C 84 31.711 32.845 -1.134 1 1 456 . 14 1 1 A 84 84 VAL N N 84 120.054 123.877 -3.823 1 1 457 . 14 1 1 A 85 85 ASP H H 85 8.140 8.593 -0.453 1 1 458 . 14 1 1 A 85 85 ASP C C 85 174.740 174.815 -0.075 1 1 459 . 14 1 1 A 85 85 ASP CA C 85 53.983 52.806 1.177 1 1 460 . 14 1 1 A 85 85 ASP CB C 85 40.633 45.590 -4.957 1 1 461 . 14 1 1 A 85 85 ASP N N 85 122.510 125.063 -2.553 1 1 462 . 14 1 1 A 86 86 ASN H H 86 7.736 8.729 -0.993 1 1 463 . 14 1 1 A 86 86 ASN C C 86 175.970 176.192 -0.222 1 1 464 . 14 1 1 A 86 86 ASN CA C 86 54.349 53.656 0.693 1 1 465 . 14 1 1 A 86 86 ASN CB C 86 40.490 39.177 1.313 1 1 467 . 14 1 1 A 86 86 ASN N N 86 124.290 120.270 4.020 1 1 468 . 14 1 1 A 87 87 GLY H H 87 8.000 8.960 -0.960 1 1 469 . 14 1 1 A 87 87 GLY C C 87 173.456 174.986 -1.530 1 1 470 . 14 1 1 A 87 87 GLY CA C 87 44.973 46.397 -1.424 1 1 471 . 14 1 1 A 87 87 GLY N N 87 113.494 111.234 2.260 1 1 472 . 14 1 1 A 88 88 ALA H H 88 8.024 8.106 -0.082 1 1 473 . 14 1 1 A 88 88 ALA C C 88 176.833 176.951 -0.118 1 1 474 . 14 1 1 A 88 88 ALA CA C 88 51.734 52.524 -0.790 1 1 475 . 14 1 1 A 88 88 ALA CB C 88 19.818 19.109 0.709 1 1 476 . 14 1 1 A 88 88 ALA N N 88 122.676 123.710 -1.034 1 1 477 . 14 1 1 A 91 91 ALA C C 91 174.781 176.029 -1.248 1 1 478 . 14 1 1 A 91 91 ALA CA C 91 50.537 51.727 -1.190 1 1 479 . 14 1 1 A 91 91 ALA CB C 91 21.324 20.215 1.109 1 1 480 . 14 1 1 A 92 92 GLN H H 92 8.451 8.750 -0.299 1 1 481 . 14 1 1 A 92 92 GLN C C 92 173.557 174.166 -0.609 1 1 482 . 14 1 1 A 92 92 GLN CA C 92 53.380 54.491 -1.111 1 1 484 . 14 1 1 A 92 92 GLN N N 92 116.847 115.188 1.659 1 1 485 . 14 1 1 A 93 93 GLY C C 93 170.631 172.648 -2.017 1 1 486 . 14 1 1 A 93 93 GLY CA C 93 45.718 44.297 1.421 1 1 487 . 14 1 1 A 94 94 VAL H H 94 8.686 9.445 -0.759 1 1 494 . 14 1 1 A 94 94 VAL C C 94 173.698 174.689 -0.991 1 1 495 . 14 1 1 A 94 94 VAL CA C 94 58.997 59.800 -0.803 1 1 496 . 14 1 1 A 94 94 VAL CB C 94 33.311 33.933 -0.622 1 1 499 . 14 1 1 A 94 94 VAL N N 94 118.489 119.237 -0.748 1 1 500 . 14 1 1 A 95 95 GLN H H 95 9.468 9.276 0.192 1 1 501 . 14 1 1 A 95 95 GLN C C 95 174.028 174.849 -0.821 1 1 502 . 14 1 1 A 95 95 GLN CA C 95 52.547 54.335 -1.788 1 1 503 . 14 1 1 A 95 95 GLN CB C 95 33.816 31.817 1.999 1 1 505 . 14 1 1 A 95 95 GLN N N 95 122.106 125.292 -3.186 1 1 506 . 14 1 1 A 96 96 LEU H H 96 8.484 8.763 -0.279 1 1 513 . 14 1 1 A 96 96 LEU C C 96 175.322 174.779 0.543 1 1 514 . 14 1 1 A 96 96 LEU CA C 96 53.736 54.190 -0.454 1 1 515 . 14 1 1 A 96 96 LEU CB C 96 41.088 45.670 -4.582 1 1 519 . 14 1 1 A 96 96 LEU N N 96 123.224 124.538 -1.314 1 1 520 . 14 1 1 A 97 97 THR H H 97 9.116 8.581 0.535 1 1 521 . 14 1 1 A 97 97 THR C C 97 173.251 171.906 1.345 1 1 522 . 14 1 1 A 97 97 THR CA C 97 58.931 60.455 -1.524 1 1 523 . 14 1 1 A 97 97 THR CB C 97 72.984 70.413 2.571 1 1 525 . 14 1 1 A 97 97 THR N N 97 112.504 118.406 -5.902 1 1 526 . 14 1 1 A 98 98 ALA H H 98 8.603 8.825 -0.222 1 1 527 . 14 1 1 A 98 98 ALA C C 98 174.948 175.398 -0.450 1 1 528 . 14 1 1 A 98 98 ALA CA C 98 49.980 49.965 0.015 1 1 529 . 14 1 1 A 98 98 ALA CB C 98 19.157 22.770 -3.613 1 1 530 . 14 1 1 A 98 98 ALA N N 98 121.608 126.165 -4.557 1 1 531 . 14 1 1 A 99 99 LYS H H 99 8.890 9.299 -0.409 1 1 532 . 14 1 1 A 99 99 LYS C C 99 174.294 174.812 -0.518 1 1 533 . 14 1 1 A 99 99 LYS CA C 99 54.019 54.645 -0.626 1 1 534 . 14 1 1 A 99 99 LYS CB C 99 33.018 36.062 -3.044 1 1 538 . 14 1 1 A 99 99 LYS N N 99 124.522 122.535 1.987 1 1 539 . 14 1 1 A 100 100 LEU H H 100 8.985 8.694 0.291 1 1 546 . 14 1 1 A 100 100 LEU C C 100 175.265 175.484 -0.219 1 1 547 . 14 1 1 A 100 100 LEU CA C 100 52.698 52.962 -0.264 1 1 548 . 14 1 1 A 100 100 LEU CB C 100 42.889 44.057 -1.168 1 1 552 . 14 1 1 A 100 100 LEU N N 100 131.876 122.855 9.021 1 1 553 . 14 1 1 A 101 101 GLY H H 101 9.137 8.389 0.748 1 1 554 . 14 1 1 A 101 101 GLY C C 101 170.798 171.639 -0.841 1 1 555 . 14 1 1 A 101 101 GLY CA C 101 44.429 46.282 -1.853 1 1 556 . 14 1 1 A 101 101 GLY N N 101 111.928 107.679 4.249 1 1 557 . 14 1 1 A 102 102 TYR H H 102 8.779 8.702 0.077 1 1 558 . 14 1 1 A 102 102 TYR C C 102 173.402 174.033 -0.631 1 1 559 . 14 1 1 A 102 102 TYR CA C 102 54.444 56.089 -1.645 1 1 560 . 14 1 1 A 102 102 TYR CB C 102 42.239 43.213 -0.974 1 1 561 . 14 1 1 A 102 102 TYR N N 102 116.664 118.590 -1.926 1 1 562 . 14 1 1 A 103 103 PRO C C 103 175.676 176.716 -1.040 1 1 563 . 14 1 1 A 103 103 PRO CA C 103 61.462 62.404 -0.942 1 1 564 . 14 1 1 A 103 103 PRO CB C 103 30.073 33.385 -3.312 1 1 565 . 14 1 1 A 104 104 ILE H H 104 8.670 9.042 -0.372 1 1 569 . 14 1 1 A 104 104 ILE C C 104 176.646 176.438 0.208 1 1 570 . 14 1 1 A 104 104 ILE CA C 104 62.054 62.260 -0.206 1 1 571 . 14 1 1 A 104 104 ILE CB C 104 37.678 39.733 -2.055 1 1 574 . 14 1 1 A 104 104 ILE N N 104 125.939 119.498 6.441 1 1 575 . 14 1 1 A 105 105 THR H H 105 8.129 7.663 0.466 1 1 576 . 14 1 1 A 105 105 THR C C 105 174.344 173.859 0.485 1 1 577 . 14 1 1 A 105 105 THR CA C 105 59.176 60.525 -1.349 1 1 578 . 14 1 1 A 105 105 THR CB C 105 71.049 68.892 2.157 1 1 580 . 14 1 1 A 105 105 THR N N 105 109.853 111.058 -1.205 1 1 581 . 14 1 1 A 106 106 ASP H H 106 8.424 8.249 0.175 1 1 582 . 14 1 1 A 106 106 ASP C C 106 175.692 174.999 0.693 1 1 583 . 14 1 1 A 106 106 ASP CA C 106 56.465 55.393 1.072 1 1 584 . 14 1 1 A 106 106 ASP CB C 106 40.032 39.096 0.936 1 1 585 . 14 1 1 A 106 106 ASP N N 106 117.156 116.337 0.819 1 1 586 . 14 1 1 A 107 107 ASP H H 107 8.124 7.955 0.169 1 1 587 . 14 1 1 A 107 107 ASP C C 107 174.174 174.603 -0.429 1 1 588 . 14 1 1 A 107 107 ASP CA C 107 52.907 55.372 -2.465 1 1 589 . 14 1 1 A 107 107 ASP CB C 107 41.661 43.796 -2.135 1 1 590 . 14 1 1 A 107 107 ASP N N 107 113.591 117.309 -3.718 1 1 591 . 14 1 1 A 108 108 LEU H H 108 7.336 7.962 -0.626 1 1 598 . 14 1 1 A 108 108 LEU C C 108 174.321 175.272 -0.951 1 1 599 . 14 1 1 A 108 108 LEU CA C 108 54.449 53.520 0.929 1 1 600 . 14 1 1 A 108 108 LEU CB C 108 44.754 43.787 0.967 1 1 604 . 14 1 1 A 108 108 LEU N N 108 123.244 119.465 3.779 1 1 605 . 14 1 1 A 109 109 ASP H H 109 8.943 9.209 -0.266 1 1 606 . 14 1 1 A 109 109 ASP C C 109 176.248 174.962 1.286 1 1 607 . 14 1 1 A 109 109 ASP CA C 109 52.376 52.310 0.066 1 1 608 . 14 1 1 A 109 109 ASP CB C 109 42.764 45.006 -2.242 1 1 609 . 14 1 1 A 109 109 ASP N N 109 124.634 122.722 1.912 1 1 610 . 14 1 1 A 110 110 ILE H H 110 8.372 8.938 -0.566 1 1 614 . 14 1 1 A 110 110 ILE C C 110 173.735 174.766 -1.031 1 1 615 . 14 1 1 A 110 110 ILE CA C 110 59.129 59.437 -0.308 1 1 616 . 14 1 1 A 110 110 ILE CB C 110 39.402 40.709 -1.307 1 1 620 . 14 1 1 A 110 110 ILE N N 110 119.135 118.311 0.824 1 1 621 . 14 1 1 A 111 111 TYR H H 111 8.695 8.754 -0.059 1 1 622 . 14 1 1 A 111 111 TYR C C 111 172.838 173.147 -0.309 1 1 623 . 14 1 1 A 111 111 TYR CA C 111 56.182 56.232 -0.050 1 1 624 . 14 1 1 A 111 111 TYR CB C 111 41.489 41.138 0.351 1 1 625 . 14 1 1 A 111 111 TYR N N 111 121.248 119.183 2.065 1 1 626 . 14 1 1 A 112 112 THR H H 112 9.172 8.854 0.318 1 1 627 . 14 1 1 A 112 112 THR C C 112 173.850 173.336 0.514 1 1 628 . 14 1 1 A 112 112 THR CA C 112 58.246 61.069 -2.823 1 1 629 . 14 1 1 A 112 112 THR CB C 112 71.676 72.160 -0.484 1 1 631 . 14 1 1 A 112 112 THR N N 112 110.671 114.979 -4.308 1 1 632 . 14 1 1 A 113 113 ARG H H 113 8.732 9.654 -0.922 1 1 633 . 14 1 1 A 113 113 ARG C C 113 175.037 174.653 0.384 1 1 634 . 14 1 1 A 113 113 ARG CA C 113 53.995 54.727 -0.732 1 1 635 . 14 1 1 A 113 113 ARG CB C 113 32.266 32.504 -0.238 1 1 638 . 14 1 1 A 113 113 ARG N N 113 120.642 125.265 -4.623 1 1 639 . 14 1 1 A 114 114 LEU H H 114 8.449 8.883 -0.434 1 1 646 . 14 1 1 A 114 114 LEU C C 114 175.812 175.684 0.128 1 1 647 . 14 1 1 A 114 114 LEU CA C 114 53.335 53.903 -0.568 1 1 648 . 14 1 1 A 114 114 LEU CB C 114 45.182 45.866 -0.684 1 1 652 . 14 1 1 A 114 114 LEU N N 114 119.078 125.770 -6.692 1 1 653 . 14 1 1 A 115 115 GLY H H 115 8.232 8.482 -0.250 1 1 654 . 14 1 1 A 115 115 GLY C C 115 171.343 172.374 -1.031 1 1 655 . 14 1 1 A 115 115 GLY CA C 115 46.217 46.152 0.065 1 1 656 . 14 1 1 A 115 115 GLY N N 115 108.966 112.326 -3.360 1 1 657 . 14 1 1 A 116 116 GLY H H 116 8.293 8.419 -0.126 1 1 658 . 14 1 1 A 116 116 GLY C C 116 169.856 172.523 -2.667 1 1 659 . 14 1 1 A 116 116 GLY CA C 116 44.084 45.568 -1.484 1 1 660 . 14 1 1 A 116 116 GLY N N 116 109.676 110.811 -1.135 1 1 661 . 14 1 1 A 117 117 MET H H 117 9.286 9.105 0.181 1 1 662 . 14 1 1 A 117 117 MET C C 117 174.557 175.155 -0.598 1 1 663 . 14 1 1 A 117 117 MET CA C 117 53.258 53.453 -0.195 1 1 664 . 14 1 1 A 117 117 MET CB C 117 37.195 35.338 1.857 1 1 667 . 14 1 1 A 117 117 MET N N 117 120.425 116.825 3.600 1 1 668 . 14 1 1 A 118 118 VAL H H 118 9.062 9.147 -0.085 1 1 675 . 14 1 1 A 118 118 VAL C C 118 173.993 175.266 -1.273 1 1 676 . 14 1 1 A 118 118 VAL CA C 118 59.883 61.544 -1.661 1 1 677 . 14 1 1 A 118 118 VAL CB C 118 31.782 34.228 -2.446 1 1 680 . 14 1 1 A 118 118 VAL N N 118 126.948 120.440 6.508 1 1 681 . 14 1 1 A 119 119 TRP H H 119 8.482 9.511 -1.029 1 1 682 . 14 1 1 A 119 119 TRP C C 119 174.608 173.890 0.718 1 1 683 . 14 1 1 A 119 119 TRP CA C 119 53.332 54.478 -1.146 1 1 684 . 14 1 1 A 119 119 TRP CB C 119 33.569 32.218 1.351 1 1 685 . 14 1 1 A 119 119 TRP N N 119 124.631 125.668 -1.037 1 1 686 . 14 1 1 A 120 120 ARG H H 120 9.113 8.804 0.309 1 1 687 . 14 1 1 A 120 120 ARG C C 120 174.951 175.198 -0.247 1 1 688 . 14 1 1 A 120 120 ARG CA C 120 54.684 54.100 0.584 1 1 689 . 14 1 1 A 120 120 ARG CB C 120 33.424 32.899 0.525 1 1 690 . 14 1 1 A 120 120 ARG N N 120 117.899 119.073 -1.174 1 1 691 . 14 1 1 A 121 121 ALA H H 121 9.299 8.381 0.918 1 1 692 . 14 1 1 A 121 121 ALA C C 121 175.954 176.009 -0.055 1 1 693 . 14 1 1 A 121 121 ALA CA C 121 50.368 50.841 -0.473 1 1 694 . 14 1 1 A 121 121 ALA CB C 121 21.141 20.242 0.899 1 1 695 . 14 1 1 A 121 121 ALA N N 121 128.863 127.775 1.088 1 1 696 . 14 1 1 A 122 122 ASP H H 122 8.488 8.893 -0.405 1 1 697 . 14 1 1 A 122 122 ASP C C 122 175.635 174.418 1.217 1 1 698 . 14 1 1 A 122 122 ASP CA C 122 53.891 52.725 1.166 1 1 699 . 14 1 1 A 122 122 ASP CB C 122 42.492 45.032 -2.540 1 1 700 . 14 1 1 A 122 122 ASP N N 122 121.721 121.066 0.655 1 1 701 . 14 1 1 A 123 123 SER H H 123 8.466 8.662 -0.196 1 1 702 . 14 1 1 A 123 123 SER C C 123 174.325 173.258 1.067 1 1 703 . 14 1 1 A 123 123 SER CA C 123 57.325 58.275 -0.950 1 1 704 . 14 1 1 A 123 123 SER CB C 123 63.988 64.959 -0.971 1 1 705 . 14 1 1 A 123 123 SER N N 123 117.374 116.247 1.127 1 1 706 . 14 1 1 A 124 124 LYS H H 124 8.389 7.841 0.548 1 1 707 . 14 1 1 A 124 124 LYS C C 124 176.840 175.547 1.293 1 1 708 . 14 1 1 A 124 124 LYS CA C 124 56.036 54.387 1.649 1 1 709 . 14 1 1 A 124 124 LYS CB C 124 32.397 35.572 -3.175 1 1 711 . 14 1 1 A 124 124 LYS N N 124 122.883 118.414 4.469 1 1 712 . 14 1 1 A 125 125 GLY H H 125 8.281 8.391 -0.110 1 1 713 . 14 1 1 A 125 125 GLY C C 125 173.592 172.212 1.380 1 1 714 . 14 1 1 A 125 125 GLY CA C 125 44.924 46.057 -1.133 1 1 715 . 14 1 1 A 125 125 GLY N N 125 109.541 106.793 2.748 1 1 716 . 14 1 1 A 126 126 ASN H H 126 8.185 8.287 -0.102 1 1 717 . 14 1 1 A 126 126 ASN C C 126 176.649 175.855 0.794 1 1 718 . 14 1 1 A 126 126 ASN CA C 126 52.763 53.138 -0.375 1 1 719 . 14 1 1 A 126 126 ASN CB C 126 38.439 39.309 -0.870 1 1 720 . 14 1 1 A 126 126 ASN N N 126 119.019 120.451 -1.432 1 1 721 . 14 1 1 A 127 127 TYR C C 127 176.913 176.450 0.463 1 1 722 . 14 1 1 A 127 127 TYR CA C 127 57.757 61.639 -3.882 1 1 723 . 14 1 1 A 127 127 TYR CB C 127 37.703 39.853 -2.150 1 1 724 . 14 1 1 A 128 128 ALA H H 128 8.050 7.950 0.100 1 1 728 . 14 1 1 A 128 128 ALA C C 128 177.756 176.327 1.429 1 1 729 . 14 1 1 A 128 128 ALA CA C 128 52.321 53.572 -1.251 1 1 730 . 14 1 1 A 128 128 ALA CB C 128 18.273 21.309 -3.036 1 1 731 . 14 1 1 A 128 128 ALA N N 128 124.529 117.604 6.925 1 1 732 . 14 1 1 A 129 129 SER H H 129 8.063 7.843 0.220 1 1 733 . 14 1 1 A 129 129 SER C C 129 174.938 173.098 1.840 1 1 734 . 14 1 1 A 129 129 SER CA C 129 58.202 57.666 0.536 1 1 735 . 14 1 1 A 129 129 SER CB C 129 62.974 65.658 -2.684 1 1 736 . 14 1 1 A 129 129 SER N N 129 114.374 110.357 4.017 1 1 737 . 14 1 1 A 130 130 THR H H 130 7.875 8.584 -0.709 1 1 741 . 14 1 1 A 130 130 THR C C 130 175.198 174.102 1.096 1 1 742 . 14 1 1 A 130 130 THR CA C 130 61.520 60.837 0.683 1 1 743 . 14 1 1 A 130 130 THR CB C 130 69.312 72.658 -3.346 1 1 745 . 14 1 1 A 130 130 THR N N 130 113.608 116.700 -3.092 1 1 746 . 14 1 1 A 131 131 GLY H H 131 8.219 8.229 -0.010 1 1 747 . 14 1 1 A 131 131 GLY C C 131 173.979 174.205 -0.226 1 1 748 . 14 1 1 A 131 131 GLY CA C 131 44.991 46.024 -1.033 1 1 749 . 14 1 1 A 131 131 GLY N N 131 110.848 111.512 -0.664 1 1 750 . 14 1 1 A 132 132 VAL H H 132 7.729 7.858 -0.129 1 1 757 . 14 1 1 A 132 132 VAL C C 132 175.988 173.704 2.284 1 1 758 . 14 1 1 A 132 132 VAL CA C 132 61.643 59.304 2.339 1 1 759 . 14 1 1 A 132 132 VAL CB C 132 31.941 35.651 -3.710 1 1 762 . 14 1 1 A 132 132 VAL N N 132 118.932 119.429 -0.497 1 1 763 . 14 1 1 A 133 133 SER H H 133 8.224 8.829 -0.605 1 1 764 . 14 1 1 A 133 133 SER C C 133 174.320 174.562 -0.242 1 1 765 . 14 1 1 A 133 133 SER CA C 133 57.756 56.166 1.590 1 1 766 . 14 1 1 A 133 133 SER CB C 133 63.140 65.996 -2.856 1 1 767 . 14 1 1 A 133 133 SER N N 133 119.260 123.111 -3.851 1 1 768 . 14 1 1 A 134 134 ARG H H 134 8.199 8.921 -0.722 1 1 769 . 14 1 1 A 134 134 ARG C C 134 175.923 175.608 0.315 1 1 770 . 14 1 1 A 134 134 ARG CA C 134 55.461 58.236 -2.775 1 1 771 . 14 1 1 A 134 134 ARG CB C 134 30.195 30.307 -0.112 1 1 774 . 14 1 1 A 134 134 ARG N N 134 123.262 123.403 -0.141 1 1 775 . 14 1 1 A 135 135 SER H H 135 8.256 7.646 0.610 1 1 776 . 14 1 1 A 135 135 SER C C 135 174.360 174.233 0.127 1 1 777 . 14 1 1 A 135 135 SER CA C 135 57.730 57.424 0.306 1 1 778 . 14 1 1 A 135 135 SER CB C 135 63.275 63.770 -0.495 1 1 779 . 14 1 1 A 135 135 SER N N 135 117.155 116.371 0.784 1 1 780 . 14 1 1 A 136 136 GLU H H 136 8.374 8.391 -0.017 1 1 781 . 14 1 1 A 136 136 GLU C C 136 176.284 177.115 -0.831 1 1 782 . 14 1 1 A 136 136 GLU CA C 136 56.082 55.567 0.515 1 1 783 . 14 1 1 A 136 136 GLU CB C 136 29.820 30.697 -0.877 1 1 785 . 14 1 1 A 136 136 GLU N N 136 122.812 128.736 -5.924 1 1 786 . 14 1 1 A 137 137 HIS H H 137 8.118 8.557 -0.439 1 1 787 . 14 1 1 A 137 137 HIS C C 137 173.529 174.734 -1.205 1 1 788 . 14 1 1 A 137 137 HIS CA C 137 54.793 56.486 -1.693 1 1 789 . 14 1 1 A 137 137 HIS CB C 137 30.191 30.011 0.180 1 1 790 . 14 1 1 A 137 137 HIS N N 137 118.002 120.198 -2.196 1 1 791 . 14 1 1 A 138 138 ASP H H 138 8.572 8.383 0.189 1 1 792 . 14 1 1 A 138 138 ASP C C 138 174.940 175.992 -1.052 1 1 793 . 14 1 1 A 138 138 ASP CA C 138 53.594 54.550 -0.956 1 1 794 . 14 1 1 A 138 138 ASP CB C 138 42.165 41.831 0.334 1 1 795 . 14 1 1 A 138 138 ASP N N 138 121.536 120.842 0.694 1 1 796 . 14 1 1 A 139 139 THR H H 139 7.857 8.680 -0.823 1 1 797 . 14 1 1 A 139 139 THR C C 139 172.822 172.910 -0.088 1 1 798 . 14 1 1 A 139 139 THR CA C 139 59.197 59.710 -0.513 1 1 799 . 14 1 1 A 139 139 THR CB C 139 71.457 71.589 -0.132 1 1 801 . 14 1 1 A 139 139 THR N N 139 113.598 114.896 -1.298 1 1 802 . 14 1 1 A 140 140 GLY C C 140 169.622 171.862 -2.240 1 1 803 . 14 1 1 A 140 140 GLY CA C 140 44.287 44.099 0.188 1 1 804 . 14 1 1 A 141 141 VAL H H 141 7.815 8.695 -0.880 1 1 811 . 14 1 1 A 141 141 VAL C C 141 176.038 173.841 2.197 1 1 812 . 14 1 1 A 141 141 VAL CA C 141 59.739 60.099 -0.360 1 1 813 . 14 1 1 A 141 141 VAL CB C 141 33.308 35.106 -1.798 1 1 816 . 14 1 1 A 141 141 VAL N N 141 116.224 123.199 -6.975 1 1 817 . 14 1 1 A 142 142 SER H H 142 9.284 9.108 0.176 1 1 818 . 14 1 1 A 142 142 SER C C 142 171.050 171.720 -0.670 1 1 819 . 14 1 1 A 142 142 SER CB C 142 67.608 65.750 1.858 1 1 820 . 14 1 1 A 142 142 SER N N 142 123.223 121.895 1.328 1 1 821 . 14 1 1 A 143 143 PRO C C 143 174.032 176.187 -2.155 1 1 822 . 14 1 1 A 143 143 PRO CA C 143 62.350 62.632 -0.282 1 1 823 . 14 1 1 A 143 143 PRO CB C 143 31.774 32.566 -0.792 1 1 825 . 14 1 1 A 144 144 VAL H H 144 7.785 8.562 -0.777 1 1 832 . 14 1 1 A 144 144 VAL C C 144 172.826 174.361 -1.535 1 1 833 . 14 1 1 A 144 144 VAL CA C 144 59.770 59.910 -0.140 1 1 834 . 14 1 1 A 144 144 VAL CB C 144 34.407 36.036 -1.629 1 1 837 . 14 1 1 A 144 144 VAL N N 144 120.214 116.477 3.737 1 1 838 . 14 1 1 A 145 145 PHE H H 145 8.623 8.659 -0.036 1 1 839 . 14 1 1 A 145 145 PHE C C 145 173.658 172.577 1.081 1 1 840 . 14 1 1 A 145 145 PHE CA C 145 54.942 55.928 -0.986 1 1 841 . 14 1 1 A 145 145 PHE CB C 145 42.692 42.379 0.313 1 1 842 . 14 1 1 A 145 145 PHE N N 145 123.914 119.224 4.690 1 1 843 . 14 1 1 A 146 146 ALA H H 146 8.886 8.970 -0.084 1 1 844 . 14 1 1 A 146 146 ALA C C 146 176.258 176.258 0.000 1 1 845 . 14 1 1 A 146 146 ALA CA C 146 49.734 50.217 -0.483 1 1 846 . 14 1 1 A 146 146 ALA CB C 146 22.244 21.358 0.886 1 1 847 . 14 1 1 A 146 146 ALA N N 146 125.243 124.065 1.178 1 1 848 . 14 1 1 A 147 147 GLY H H 147 8.470 8.927 -0.457 1 1 849 . 14 1 1 A 147 147 GLY C C 147 170.940 172.927 -1.987 1 1 850 . 14 1 1 A 147 147 GLY CA C 147 44.063 44.439 -0.376 1 1 851 . 14 1 1 A 147 147 GLY N N 147 106.669 110.634 -3.965 1 1 852 . 14 1 1 A 148 148 GLY H H 148 8.008 8.217 -0.209 1 1 853 . 14 1 1 A 148 148 GLY C C 148 170.181 172.131 -1.950 1 1 854 . 14 1 1 A 148 148 GLY CA C 148 45.736 45.634 0.102 1 1 855 . 14 1 1 A 148 148 GLY N N 148 109.475 109.846 -0.371 1 1 856 . 14 1 1 A 149 149 VAL H H 149 8.426 8.287 0.139 1 1 863 . 14 1 1 A 149 149 VAL C C 149 174.157 173.541 0.616 1 1 864 . 14 1 1 A 149 149 VAL CA C 149 58.200 58.956 -0.756 1 1 865 . 14 1 1 A 149 149 VAL CB C 149 34.464 36.212 -1.748 1 1 868 . 14 1 1 A 149 149 VAL N N 149 112.651 118.372 -5.721 1 1 869 . 14 1 1 A 150 150 GLU H H 150 9.070 9.357 -0.287 1 1 870 . 14 1 1 A 150 150 GLU C C 150 173.892 174.223 -0.331 1 1 871 . 14 1 1 A 150 150 GLU CA C 150 54.617 54.932 -0.315 1 1 872 . 14 1 1 A 150 150 GLU CB C 150 32.911 33.685 -0.774 1 1 874 . 14 1 1 A 150 150 GLU N N 150 124.471 120.688 3.783 1 1 875 . 14 1 1 A 151 151 TRP H H 151 9.461 9.326 0.135 1 1 877 . 14 1 1 A 151 151 TRP C C 151 174.370 174.555 -0.185 1 1 878 . 14 1 1 A 151 151 TRP CA C 151 54.113 55.682 -1.569 1 1 879 . 14 1 1 A 151 151 TRP CB C 151 31.688 33.106 -1.418 1 1 880 . 14 1 1 A 151 151 TRP N N 151 129.611 129.173 0.438 1 1 882 . 14 1 1 A 152 152 ALA H H 152 8.771 8.557 0.214 1 1 883 . 14 1 1 A 152 152 ALA C C 152 175.079 176.574 -1.495 1 1 884 . 14 1 1 A 152 152 ALA CA C 152 51.417 50.794 0.623 1 1 885 . 14 1 1 A 152 152 ALA CB C 152 17.209 20.160 -2.951 1 1 886 . 14 1 1 A 152 152 ALA N N 152 130.502 130.055 0.447 1 1 887 . 14 1 1 A 153 153 VAL H H 153 7.893 8.356 -0.463 1 1 894 . 14 1 1 A 153 153 VAL C C 153 176.612 176.022 0.590 1 1 895 . 14 1 1 A 153 153 VAL CA C 153 63.600 63.841 -0.241 1 1 896 . 14 1 1 A 153 153 VAL CB C 153 31.280 32.431 -1.151 1 1 899 . 14 1 1 A 153 153 VAL N N 153 124.360 123.114 1.246 1 1 900 . 14 1 1 A 154 154 THR H H 154 7.950 7.776 0.174 1 1 904 . 14 1 1 A 154 154 THR C C 154 173.884 175.289 -1.405 1 1 905 . 14 1 1 A 154 154 THR CA C 154 58.655 61.692 -3.037 1 1 906 . 14 1 1 A 154 154 THR CB C 154 71.262 69.551 1.711 1 1 908 . 14 1 1 A 154 154 THR N N 154 109.176 114.191 -5.015 1 1 909 . 14 1 1 A 155 155 ARG H H 155 8.310 8.597 -0.287 1 1 910 . 14 1 1 A 155 155 ARG C C 155 176.753 177.029 -0.276 1 1 911 . 14 1 1 A 155 155 ARG CA C 155 58.456 58.041 0.415 1 1 912 . 14 1 1 A 155 155 ARG CB C 155 29.043 31.006 -1.963 1 1 915 . 14 1 1 A 155 155 ARG N N 155 116.576 123.473 -6.897 1 1 916 . 14 1 1 A 156 156 ASP H H 156 7.783 8.159 -0.376 1 1 917 . 14 1 1 A 156 156 ASP C C 156 174.222 175.561 -1.339 1 1 918 . 14 1 1 A 156 156 ASP CA C 156 53.540 53.158 0.382 1 1 919 . 14 1 1 A 156 156 ASP CB C 156 42.327 41.184 1.143 1 1 920 . 14 1 1 A 156 156 ASP N N 156 112.950 114.119 -1.169 1 1 921 . 14 1 1 A 157 157 ILE H H 157 7.233 7.479 -0.246 1 1 925 . 14 1 1 A 157 157 ILE C C 157 174.178 174.733 -0.555 1 1 926 . 14 1 1 A 157 157 ILE CA C 157 59.350 60.495 -1.145 1 1 927 . 14 1 1 A 157 157 ILE CB C 157 38.969 41.602 -2.633 1 1 930 . 14 1 1 A 157 157 ILE N N 157 119.732 119.777 -0.045 1 1 931 . 14 1 1 A 158 158 ALA H H 158 8.729 9.076 -0.347 1 1 932 . 14 1 1 A 158 158 ALA C C 158 176.567 175.792 0.775 1 1 933 . 14 1 1 A 158 158 ALA CA C 158 49.418 50.403 -0.985 1 1 934 . 14 1 1 A 158 158 ALA CB C 158 21.430 24.030 -2.600 1 1 935 . 14 1 1 A 158 158 ALA N N 158 128.564 128.715 -0.151 1 1 936 . 14 1 1 A 159 159 THR H H 159 8.972 8.732 0.240 1 1 940 . 14 1 1 A 159 159 THR C C 159 172.213 173.320 -1.107 1 1 941 . 14 1 1 A 159 159 THR CA C 159 59.504 61.047 -1.543 1 1 942 . 14 1 1 A 159 159 THR CB C 159 70.728 71.192 -0.464 1 1 944 . 14 1 1 A 159 159 THR N N 159 114.901 115.131 -0.230 1 1 945 . 14 1 1 A 160 160 ARG H H 160 8.924 9.524 -0.600 1 1 946 . 14 1 1 A 160 160 ARG C C 160 174.097 174.300 -0.203 1 1 947 . 14 1 1 A 160 160 ARG CA C 160 53.066 54.502 -1.436 1 1 948 . 14 1 1 A 160 160 ARG CB C 160 32.922 33.783 -0.861 1 1 951 . 14 1 1 A 160 160 ARG N N 160 121.507 122.739 -1.232 1 1 952 . 14 1 1 A 161 161 LEU H H 161 8.611 9.099 -0.488 1 1 959 . 14 1 1 A 161 161 LEU C C 161 174.389 174.722 -0.333 1 1 960 . 14 1 1 A 161 161 LEU CA C 161 53.355 53.413 -0.058 1 1 961 . 14 1 1 A 161 161 LEU CB C 161 44.360 45.468 -1.108 1 1 964 . 14 1 1 A 161 161 LEU N N 161 124.711 124.223 0.488 1 1 965 . 14 1 1 A 162 162 GLU H H 162 8.746 8.942 -0.196 1 1 966 . 14 1 1 A 162 162 GLU C C 162 173.376 174.588 -1.212 1 1 967 . 14 1 1 A 162 162 GLU CA C 162 53.904 54.180 -0.276 1 1 968 . 14 1 1 A 162 162 GLU CB C 162 33.773 32.713 1.060 1 1 970 . 14 1 1 A 162 162 GLU N N 162 122.300 125.950 -3.650 1 1 971 . 14 1 1 A 163 163 TYR H H 163 8.872 8.932 -0.060 1 1 972 . 14 1 1 A 163 163 TYR C C 163 173.425 174.927 -1.502 1 1 973 . 14 1 1 A 163 163 TYR CA C 163 56.192 56.699 -0.507 1 1 974 . 14 1 1 A 163 163 TYR CB C 163 40.870 42.750 -1.880 1 1 975 . 14 1 1 A 163 163 TYR N N 163 124.618 120.660 3.958 1 1 976 . 14 1 1 A 171 171 ASP C C 171 175.753 176.819 -1.066 1 1 977 . 14 1 1 A 171 171 ASP CA C 171 53.517 55.173 -1.656 1 1 978 . 14 1 1 A 171 171 ASP CB C 171 41.353 43.602 -2.249 1 1 979 . 14 1 1 A 172 172 ALA H H 172 8.336 7.590 0.746 1 1 983 . 14 1 1 A 172 172 ALA C C 172 178.110 176.747 1.363 1 1 984 . 14 1 1 A 172 172 ALA CA C 172 52.190 53.433 -1.243 1 1 985 . 14 1 1 A 172 172 ALA CB C 172 18.305 20.926 -2.621 1 1 986 . 14 1 1 A 172 172 ALA N N 172 125.294 118.048 7.246 1 1 987 . 14 1 1 A 173 173 GLY H H 173 8.300 7.950 0.350 1 1 988 . 14 1 1 A 173 173 GLY C C 173 174.437 172.766 1.671 1 1 989 . 14 1 1 A 173 173 GLY CA C 173 45.083 43.843 1.240 1 1 990 . 14 1 1 A 173 173 GLY N N 173 107.268 105.991 1.277 1 1 991 . 14 1 1 A 174 174 THR H H 174 7.754 8.710 -0.956 1 1 992 . 14 1 1 A 174 174 THR C C 174 174.738 173.700 1.038 1 1 993 . 14 1 1 A 174 174 THR CA C 174 61.310 60.752 0.558 1 1 994 . 14 1 1 A 174 174 THR CB C 174 69.310 70.442 -1.132 1 1 996 . 14 1 1 A 174 174 THR N N 174 113.472 112.414 1.058 1 1 997 . 14 1 1 A 175 175 VAL H H 175 7.993 9.006 -1.013 1 1 1004 . 14 1 1 A 175 175 VAL C C 175 176.535 174.663 1.872 1 1 1005 . 14 1 1 A 175 175 VAL CA C 175 62.126 60.763 1.363 1 1 1006 . 14 1 1 A 175 175 VAL CB C 175 31.282 36.132 -4.850 1 1 1009 . 14 1 1 A 175 175 VAL N N 175 121.643 126.001 -4.358 1 1 1010 . 14 1 1 A 176 176 GLY H H 176 8.056 8.919 -0.863 1 1 1011 . 14 1 1 A 176 176 GLY C C 176 173.930 173.970 -0.040 1 1 1012 . 14 1 1 A 176 176 GLY CA C 176 44.983 44.346 0.637 1 1 1013 . 14 1 1 A 176 176 GLY N N 176 110.460 115.098 -4.638 1 1 1014 . 14 1 1 A 177 177 THR H H 177 7.520 8.491 -0.971 1 1 1015 . 14 1 1 A 177 177 THR C C 177 173.574 174.419 -0.845 1 1 1016 . 14 1 1 A 177 177 THR CA C 177 60.609 62.240 -1.631 1 1 1017 . 14 1 1 A 177 177 THR CB C 177 69.506 70.354 -0.848 1 1 1019 . 14 1 1 A 177 177 THR N N 177 113.390 112.643 0.747 1 1 1020 . 14 1 1 A 178 178 ARG H H 178 8.261 7.698 0.563 1 1 1021 . 14 1 1 A 178 178 ARG C C 178 173.932 176.104 -2.172 1 1 1022 . 14 1 1 A 178 178 ARG CA C 178 53.683 54.465 -0.782 1 1 1023 . 14 1 1 A 178 178 ARG CB C 178 29.224 30.593 -1.369 1 1 1026 . 14 1 1 A 178 178 ARG N N 178 123.906 120.327 3.579 1 1 1027 . 14 1 1 A 183 183 MET C C 183 174.053 174.311 -0.258 1 1 1028 . 14 1 1 A 183 183 MET CA C 183 53.700 54.922 -1.222 1 1 1029 . 14 1 1 A 183 183 MET CB C 183 35.908 35.237 0.671 1 1 1032 . 14 1 1 A 184 184 LEU H H 184 8.319 8.976 -0.657 1 1 1033 . 14 1 1 A 184 184 LEU C C 184 175.235 175.326 -0.091 1 1 1034 . 14 1 1 A 184 184 LEU CA C 184 53.120 53.691 -0.571 1 1 1035 . 14 1 1 A 184 184 LEU CB C 184 42.857 46.548 -3.691 1 1 1038 . 14 1 1 A 184 184 LEU N N 184 131.293 128.113 3.180 1 1 1039 . 14 1 1 A 185 185 SER H H 185 9.603 8.982 0.621 1 1 1040 . 14 1 1 A 185 185 SER C C 185 171.293 173.177 -1.884 1 1 1041 . 14 1 1 A 185 185 SER CA C 185 56.504 57.397 -0.893 1 1 1042 . 14 1 1 A 185 185 SER CB C 185 66.585 67.382 -0.797 1 1 1043 . 14 1 1 A 185 185 SER N N 185 119.338 116.535 2.803 1 1 1044 . 14 1 1 A 186 186 LEU H H 186 8.583 8.653 -0.070 1 1 1051 . 14 1 1 A 186 186 LEU C C 186 175.328 176.616 -1.288 1 1 1052 . 14 1 1 A 186 186 LEU CA C 186 52.729 53.130 -0.401 1 1 1053 . 14 1 1 A 186 186 LEU CB C 186 44.996 45.035 -0.039 1 1 1056 . 14 1 1 A 186 186 LEU N N 186 122.719 124.201 -1.482 1 1 1057 . 14 1 1 A 187 187 GLY H H 187 9.287 8.512 0.775 1 1 1058 . 14 1 1 A 187 187 GLY C C 187 172.315 173.254 -0.939 1 1 1059 . 14 1 1 A 187 187 GLY CA C 187 43.502 45.180 -1.678 1 1 1060 . 14 1 1 A 187 187 GLY N N 187 110.265 110.380 -0.115 1 1 1061 . 14 1 1 A 188 188 VAL H H 188 8.825 8.568 0.257 1 1 1068 . 14 1 1 A 188 188 VAL C C 188 173.125 174.769 -1.644 1 1 1069 . 14 1 1 A 188 188 VAL CA C 188 59.739 59.304 0.435 1 1 1070 . 14 1 1 A 188 188 VAL CB C 188 34.532 35.316 -0.784 1 1 1073 . 14 1 1 A 188 188 VAL N N 188 119.161 116.688 2.473 1 1 1074 . 14 1 1 A 189 189 SER H H 189 9.051 8.978 0.073 1 1 1075 . 14 1 1 A 189 189 SER C C 189 171.698 172.812 -1.114 1 1 1076 . 14 1 1 A 189 189 SER CA C 189 55.997 57.234 -1.237 1 1 1077 . 14 1 1 A 189 189 SER CB C 189 66.094 66.866 -0.772 1 1 1078 . 14 1 1 A 189 189 SER N N 189 117.810 118.312 -0.502 1 1 1079 . 14 1 1 A 190 190 TYR H H 190 9.145 8.798 0.347 1 1 1080 . 14 1 1 A 190 190 TYR C C 190 174.063 172.956 1.107 1 1 1081 . 14 1 1 A 190 190 TYR CA C 190 55.375 55.724 -0.349 1 1 1082 . 14 1 1 A 190 190 TYR CB C 190 41.183 41.722 -0.539 1 1 1083 . 14 1 1 A 190 190 TYR N N 190 123.690 118.126 5.564 1 1 1084 . 14 1 1 A 191 191 ARG H H 191 8.211 8.636 -0.425 1 1 1085 . 14 1 1 A 191 191 ARG C C 191 174.826 175.197 -0.371 1 1 1086 . 14 1 1 A 191 191 ARG CA C 191 54.464 54.592 -0.128 1 1 1087 . 14 1 1 A 191 191 ARG CB C 191 30.507 31.655 -1.148 1 1 1090 . 14 1 1 A 191 191 ARG N N 191 125.366 119.018 6.348 1 1 1091 . 14 1 1 A 192 192 PHE H H 192 8.496 9.369 -0.873 1 1 1092 . 14 1 1 A 192 192 PHE C C 192 176.384 175.174 1.210 1 1 1093 . 14 1 1 A 192 192 PHE CA C 192 57.179 56.088 1.091 1 1 1094 . 14 1 1 A 192 192 PHE CB C 192 39.430 44.335 -4.905 1 1 1095 . 14 1 1 A 192 192 PHE N N 192 121.586 119.788 1.798 1 1 1096 . 14 1 1 A 193 193 GLY H H 193 8.643 8.664 -0.021 1 1 1097 . 14 1 1 A 193 193 GLY C C 193 174.466 172.932 1.534 1 1 1098 . 14 1 1 A 193 193 GLY CA C 193 45.126 45.864 -0.738 1 1 1099 . 14 1 1 A 193 193 GLY N N 193 109.499 108.356 1.143 1 1 1100 . 14 1 1 A 194 194 GLN H H 194 8.512 8.549 -0.037 1 1 1101 . 14 1 1 A 194 194 GLN C C 194 176.201 175.500 0.701 1 1 1102 . 14 1 1 A 194 194 GLN CA C 194 55.433 54.667 0.766 1 1 1103 . 14 1 1 A 194 194 GLN CB C 194 28.729 29.909 -1.180 1 1 1105 . 14 1 1 A 194 194 GLN N N 194 119.448 116.778 2.670 1 1 1106 . 14 1 1 A 195 195 GLU H H 195 8.530 8.523 0.007 1 1 1107 . 14 1 1 A 195 195 GLU C C 195 176.151 176.328 -0.177 1 1 1108 . 14 1 1 A 195 195 GLU CA C 195 56.256 57.535 -1.279 1 1 1109 . 14 1 1 A 195 195 GLU CB C 195 29.486 30.833 -1.347 1 1 1111 . 14 1 1 A 195 195 GLU N N 195 121.959 124.052 -2.093 1 1 1112 . 14 1 1 A 196 196 ASP H H 196 8.253 7.756 0.497 1 1 1113 . 14 1 1 A 196 196 ASP C C 196 175.667 176.040 -0.373 1 1 1114 . 14 1 1 A 196 196 ASP CA C 196 53.981 54.198 -0.217 1 1 1115 . 14 1 1 A 196 196 ASP CB C 196 40.700 41.431 -0.731 1 1 1116 . 14 1 1 A 196 196 ASP N N 196 121.819 119.170 2.649 1 1 1117 . 14 1 1 A 197 197 ALA H H 197 7.999 8.431 -0.432 1 1 1121 . 14 1 1 A 197 197 ALA C C 197 176.847 176.594 0.253 1 1 1122 . 14 1 1 A 197 197 ALA CA C 197 51.612 51.621 -0.009 1 1 1123 . 14 1 1 A 197 197 ALA CB C 197 18.192 20.388 -2.196 1 1 1124 . 14 1 1 A 197 197 ALA N N 197 124.262 126.790 -2.528 1 1 1125 . 14 1 1 A 198 198 ALA H H 198 8.042 8.531 -0.489 1 1 1126 . 14 1 1 A 198 198 ALA C C 198 176.865 174.464 2.401 1 1 1127 . 14 1 1 A 198 198 ALA CA C 198 49.999 50.153 -0.154 1 1 1128 . 14 1 1 A 198 198 ALA CB C 198 17.327 18.999 -1.672 1 1 1129 . 14 1 1 A 198 198 ALA N N 198 124.724 118.593 6.131 1 1 1130 . 14 1 1 A 199 199 PRO C C 199 176.727 175.277 1.450 1 1 1131 . 14 1 1 A 199 199 PRO CA C 199 62.399 62.438 -0.039 1 1 1132 . 14 1 1 A 199 199 PRO CB C 199 30.949 33.288 -2.339 1 1 1135 . 14 1 1 A 200 200 VAL H H 200 8.026 8.531 -0.505 1 1 1142 . 14 1 1 A 200 200 VAL C C 200 176.034 174.760 1.274 1 1 1143 . 14 1 1 A 200 200 VAL CA C 200 61.944 60.068 1.876 1 1 1144 . 14 1 1 A 200 200 VAL CB C 200 31.734 35.425 -3.691 1 1 1147 . 14 1 1 A 200 200 VAL N N 200 120.635 120.894 -0.259 1 1 1148 . 14 1 1 A 201 201 VAL H H 201 7.966 8.469 -0.503 1 1 1155 . 14 1 1 A 201 201 VAL C C 201 175.128 175.329 -0.201 1 1 1156 . 14 1 1 A 201 201 VAL CA C 201 61.249 61.042 0.207 1 1 1157 . 14 1 1 A 201 201 VAL CB C 201 31.917 31.713 0.204 1 1 1160 . 14 1 1 A 201 201 VAL N N 201 124.053 123.092 0.961 1 1 1161 . 14 1 1 A 202 202 ALA H H 202 8.159 7.541 0.618 1 1 1162 . 14 1 1 A 202 202 ALA C C 202 175.153 175.353 -0.200 1 1 1163 . 14 1 1 A 202 202 ALA CA C 202 49.742 49.542 0.200 1 1 1164 . 14 1 1 A 202 202 ALA CB C 202 17.532 18.962 -1.430 1 1 1165 . 14 1 1 A 202 202 ALA N N 202 129.251 123.237 6.014 1 1 1166 . 14 1 1 A 203 203 PRO C C 203 176.273 176.293 -0.020 1 1 1167 . 14 1 1 A 203 203 PRO CA C 203 62.324 64.767 -2.443 1 1 1168 . 14 1 1 A 203 203 PRO CB C 203 31.042 31.963 -0.921 1 1 1170 . 14 1 1 A 204 204 ALA H H 204 8.137 7.453 0.684 1 1 1171 . 14 1 1 A 204 204 ALA C C 204 175.697 174.639 1.058 1 1 1172 . 14 1 1 A 204 204 ALA CA C 204 49.865 49.907 -0.042 1 1 1173 . 14 1 1 A 204 204 ALA CB C 204 17.364 21.219 -3.855 1 1 1174 . 14 1 1 A 204 204 ALA N N 204 125.510 118.294 7.216 1 1 1175 . 14 1 1 A 205 205 PRO C C 205 175.430 177.093 -1.663 1 1 1176 . 14 1 1 A 205 205 PRO CA C 205 62.511 62.397 0.114 1 1 1177 . 14 1 1 A 205 205 PRO CB C 205 31.056 32.543 -1.487 1 1 1179 . 14 1 1 A 206 206 ALA H H 206 7.847 8.368 -0.521 1 1 1180 . 14 1 1 A 206 206 ALA C C 206 175.565 177.641 -2.076 1 1 1181 . 14 1 1 A 206 206 ALA CA C 206 49.487 50.688 -1.201 1 1 1182 . 14 1 1 A 206 206 ALA CB C 206 18.843 18.032 0.811 1 1 1183 . 14 1 1 A 206 206 ALA N N 206 123.663 124.126 -0.463 1 1 1184 . 14 1 1 A 207 207 PRO C C 207 174.397 176.751 -2.354 1 1 1185 . 14 1 1 A 207 207 PRO CA C 207 61.454 65.080 -3.626 1 1 1186 . 14 1 1 A 207 207 PRO CB C 207 31.929 32.034 -0.105 1 1 1187 . 14 1 1 A 208 208 ALA H H 208 7.898 7.893 0.005 1 1 1188 . 14 1 1 A 208 208 ALA C C 208 175.411 174.439 0.972 1 1 1189 . 14 1 1 A 208 208 ALA CA C 208 49.472 49.531 -0.059 1 1 1190 . 14 1 1 A 208 208 ALA CB C 208 19.082 19.180 -0.098 1 1 1191 . 14 1 1 A 208 208 ALA N N 208 127.450 119.613 7.837 1 1 1192 . 14 1 1 A 209 209 PRO C C 209 176.932 176.223 0.709 1 1 1193 . 14 1 1 A 209 209 PRO CA C 209 62.736 62.505 0.231 1 1 1194 . 14 1 1 A 209 209 PRO CB C 209 31.012 33.195 -2.183 1 1 1 . 15 1 1 A 2 2 ARG C C 2 175.857 175.235 0.622 1 1 2 . 15 1 1 A 2 2 ARG CA C 2 55.872 54.184 1.688 1 1 3 . 15 1 1 A 2 2 ARG CB C 2 29.983 33.409 -3.426 1 1 5 . 15 1 1 A 3 3 ILE H H 3 8.238 8.612 -0.374 1 1 9 . 15 1 1 A 3 3 ILE C C 3 175.763 174.831 0.932 1 1 10 . 15 1 1 A 3 3 ILE CA C 3 60.779 59.060 1.719 1 1 11 . 15 1 1 A 3 3 ILE CB C 3 37.664 41.581 -3.917 1 1 15 . 15 1 1 A 3 3 ILE N N 3 122.580 120.493 2.087 1 1 16 . 15 1 1 A 4 4 MET H H 4 8.261 8.902 -0.641 1 1 17 . 15 1 1 A 4 4 MET C C 4 175.660 175.061 0.599 1 1 18 . 15 1 1 A 4 4 MET CA C 4 54.893 53.470 1.423 1 1 19 . 15 1 1 A 4 4 MET CB C 4 32.060 34.713 -2.653 1 1 22 . 15 1 1 A 4 4 MET N N 4 123.988 124.302 -0.314 1 1 23 . 15 1 1 A 5 5 LYS H H 5 8.041 8.945 -0.904 1 1 24 . 15 1 1 A 5 5 LYS C C 5 175.850 175.656 0.194 1 1 25 . 15 1 1 A 5 5 LYS CA C 5 56.081 54.721 1.360 1 1 26 . 15 1 1 A 5 5 LYS CB C 5 32.220 36.226 -4.006 1 1 29 . 15 1 1 A 5 5 LYS N N 5 122.015 121.838 0.177 1 1 30 . 15 1 1 A 6 6 ALA H H 6 8.042 8.887 -0.845 1 1 34 . 15 1 1 A 6 6 ALA C C 6 177.160 175.849 1.311 1 1 35 . 15 1 1 A 6 6 ALA CA C 6 52.109 50.330 1.779 1 1 36 . 15 1 1 A 6 6 ALA CB C 6 18.637 21.229 -2.592 1 1 37 . 15 1 1 A 6 6 ALA N N 6 123.943 123.133 0.810 1 1 38 . 15 1 1 A 7 7 ILE H H 7 7.916 8.409 -0.493 1 1 42 . 15 1 1 A 7 7 ILE C C 7 175.611 175.670 -0.059 1 1 43 . 15 1 1 A 7 7 ILE CA C 7 61.181 59.884 1.297 1 1 44 . 15 1 1 A 7 7 ILE CB C 7 37.910 40.279 -2.369 1 1 48 . 15 1 1 A 7 7 ILE N N 7 118.380 119.881 -1.501 1 1 49 . 15 1 1 A 8 8 PHE H H 8 8.167 9.035 -0.868 1 1 50 . 15 1 1 A 8 8 PHE C C 8 175.363 174.946 0.417 1 1 51 . 15 1 1 A 8 8 PHE CA C 8 57.286 58.301 -1.015 1 1 52 . 15 1 1 A 8 8 PHE CB C 8 39.008 39.383 -0.375 1 1 53 . 15 1 1 A 8 8 PHE N N 8 121.971 130.247 -8.276 1 1 54 . 15 1 1 A 9 9 VAL H H 9 7.872 7.507 0.365 1 1 61 . 15 1 1 A 9 9 VAL C C 9 175.405 175.488 -0.083 1 1 62 . 15 1 1 A 9 9 VAL CA C 9 61.662 61.691 -0.029 1 1 63 . 15 1 1 A 9 9 VAL CB C 9 32.026 31.105 0.921 1 1 66 . 15 1 1 A 9 9 VAL N N 9 120.864 118.099 2.765 1 1 67 . 15 1 1 A 10 10 LEU H H 10 8.077 8.428 -0.351 1 1 74 . 15 1 1 A 10 10 LEU C C 10 176.652 175.808 0.844 1 1 75 . 15 1 1 A 10 10 LEU CA C 10 54.856 53.566 1.290 1 1 76 . 15 1 1 A 10 10 LEU CB C 10 41.401 44.234 -2.833 1 1 80 . 15 1 1 A 10 10 LEU N N 10 124.826 125.460 -0.634 1 1 81 . 15 1 1 A 11 11 ASN H H 11 8.177 8.859 -0.682 1 1 82 . 15 1 1 A 11 11 ASN C C 11 174.394 175.149 -0.755 1 1 83 . 15 1 1 A 11 11 ASN CA C 11 52.704 53.458 -0.754 1 1 84 . 15 1 1 A 11 11 ASN CB C 11 38.468 38.996 -0.528 1 1 85 . 15 1 1 A 11 11 ASN N N 11 119.029 122.414 -3.385 1 1 86 . 15 1 1 A 12 12 ALA H H 12 7.991 8.782 -0.791 1 1 90 . 15 1 1 A 12 12 ALA C C 12 176.649 175.922 0.727 1 1 91 . 15 1 1 A 12 12 ALA CA C 12 51.950 51.761 0.189 1 1 92 . 15 1 1 A 12 12 ALA CB C 12 18.659 19.831 -1.172 1 1 93 . 15 1 1 A 12 12 ALA N N 12 123.695 123.116 0.579 1 1 94 . 15 1 1 A 13 13 ALA H H 13 8.083 8.523 -0.440 1 1 95 . 15 1 1 A 13 13 ALA C C 13 175.395 175.966 -0.571 1 1 96 . 15 1 1 A 13 13 ALA CA C 13 49.797 49.681 0.116 1 1 97 . 15 1 1 A 13 13 ALA CB C 13 17.486 19.373 -1.887 1 1 98 . 15 1 1 A 13 13 ALA N N 13 124.281 127.270 -2.989 1 1 99 . 15 1 1 A 14 14 PRO C C 14 176.641 179.151 -2.510 1 1 100 . 15 1 1 A 14 14 PRO CA C 14 62.675 65.522 -2.847 1 1 101 . 15 1 1 A 14 14 PRO CB C 14 31.000 31.975 -0.975 1 1 103 . 15 1 1 A 15 15 LYS H H 15 8.283 8.645 -0.362 1 1 104 . 15 1 1 A 15 15 LYS C C 15 175.683 176.918 -1.235 1 1 105 . 15 1 1 A 15 15 LYS CA C 15 55.429 58.931 -3.502 1 1 106 . 15 1 1 A 15 15 LYS CB C 15 32.246 32.770 -0.524 1 1 109 . 15 1 1 A 15 15 LYS N N 15 119.069 117.332 1.737 1 1 110 . 15 1 1 A 16 16 ASP H H 16 7.880 7.747 0.133 1 1 111 . 15 1 1 A 16 16 ASP C C 16 175.419 176.013 -0.594 1 1 112 . 15 1 1 A 16 16 ASP CA C 16 54.413 53.964 0.449 1 1 113 . 15 1 1 A 16 16 ASP CB C 16 40.224 41.928 -1.704 1 1 114 . 15 1 1 A 16 16 ASP N N 16 119.625 119.318 0.307 1 1 115 . 15 1 1 A 17 17 ASN H H 17 7.973 8.705 -0.732 1 1 116 . 15 1 1 A 17 17 ASN C C 17 174.231 174.872 -0.641 1 1 117 . 15 1 1 A 17 17 ASN CA C 17 53.948 52.049 1.899 1 1 118 . 15 1 1 A 17 17 ASN CB C 17 37.009 40.014 -3.005 1 1 119 . 15 1 1 A 17 17 ASN N N 17 118.063 124.387 -6.324 1 1 120 . 15 1 1 A 18 18 THR H H 18 7.318 9.021 -1.703 1 1 121 . 15 1 1 A 18 18 THR C C 18 172.323 173.548 -1.225 1 1 122 . 15 1 1 A 18 18 THR CA C 18 60.153 59.831 0.322 1 1 123 . 15 1 1 A 18 18 THR CB C 18 71.534 72.708 -1.174 1 1 125 . 15 1 1 A 18 18 THR N N 18 109.092 107.743 1.349 1 1 126 . 15 1 1 A 19 19 TRP H H 19 8.541 8.520 0.021 1 1 127 . 15 1 1 A 19 19 TRP C C 19 175.969 173.802 2.167 1 1 128 . 15 1 1 A 19 19 TRP CA C 19 55.700 56.844 -1.144 1 1 129 . 15 1 1 A 19 19 TRP CB C 19 31.471 33.101 -1.630 1 1 130 . 15 1 1 A 19 19 TRP N N 19 121.992 121.784 0.208 1 1 131 . 15 1 1 A 20 20 TYR H H 20 8.691 8.799 -0.108 1 1 132 . 15 1 1 A 20 20 TYR C C 20 173.684 174.614 -0.930 1 1 133 . 15 1 1 A 20 20 TYR CA C 20 55.805 55.978 -0.173 1 1 134 . 15 1 1 A 20 20 TYR CB C 20 40.513 42.133 -1.620 1 1 135 . 15 1 1 A 20 20 TYR N N 20 116.519 124.528 -8.009 1 1 136 . 15 1 1 A 21 21 ALA H H 21 8.876 8.665 0.211 1 1 137 . 15 1 1 A 21 21 ALA C C 21 175.395 176.012 -0.617 1 1 138 . 15 1 1 A 21 21 ALA CA C 21 50.970 51.245 -0.275 1 1 139 . 15 1 1 A 21 21 ALA CB C 21 22.142 22.737 -0.595 1 1 140 . 15 1 1 A 21 21 ALA N N 21 119.359 122.652 -3.293 1 1 141 . 15 1 1 A 22 22 GLY H H 22 8.613 7.699 0.914 1 1 142 . 15 1 1 A 22 22 GLY C C 22 171.458 172.003 -0.545 1 1 143 . 15 1 1 A 22 22 GLY CA C 22 45.608 45.477 0.131 1 1 144 . 15 1 1 A 22 22 GLY N N 22 106.678 105.638 1.040 1 1 145 . 15 1 1 A 23 23 GLY H H 23 7.911 8.469 -0.558 1 1 146 . 15 1 1 A 23 23 GLY C C 23 170.563 172.628 -2.065 1 1 147 . 15 1 1 A 23 23 GLY CA C 23 44.026 44.478 -0.452 1 1 148 . 15 1 1 A 23 23 GLY N N 23 103.399 107.656 -4.257 1 1 149 . 15 1 1 A 24 24 LYS H H 24 9.001 9.593 -0.592 1 1 150 . 15 1 1 A 24 24 LYS C C 24 172.965 174.333 -1.368 1 1 151 . 15 1 1 A 24 24 LYS CA C 24 54.062 54.331 -0.269 1 1 152 . 15 1 1 A 24 24 LYS CB C 24 36.774 36.389 0.385 1 1 156 . 15 1 1 A 24 24 LYS N N 24 116.402 121.179 -4.777 1 1 157 . 15 1 1 A 25 25 LEU H H 25 8.587 9.132 -0.545 1 1 164 . 15 1 1 A 25 25 LEU C C 25 175.205 175.118 0.087 1 1 165 . 15 1 1 A 25 25 LEU CA C 25 53.446 53.204 0.242 1 1 166 . 15 1 1 A 25 25 LEU CB C 25 46.287 46.882 -0.595 1 1 170 . 15 1 1 A 25 25 LEU N N 25 119.932 122.166 -2.234 1 1 171 . 15 1 1 A 26 26 GLY H H 26 8.637 8.459 0.178 1 1 172 . 15 1 1 A 26 26 GLY C C 26 170.804 172.558 -1.754 1 1 173 . 15 1 1 A 26 26 GLY CA C 26 45.669 45.219 0.450 1 1 174 . 15 1 1 A 26 26 GLY N N 26 108.136 109.881 -1.745 1 1 175 . 15 1 1 A 27 27 TRP H H 27 8.642 8.277 0.365 1 1 177 . 15 1 1 A 27 27 TRP C C 27 174.820 174.108 0.712 1 1 178 . 15 1 1 A 27 27 TRP CB C 27 30.883 32.758 -1.875 1 1 179 . 15 1 1 A 27 27 TRP N N 27 120.887 117.367 3.520 1 1 181 . 15 1 1 A 32 32 ASP C C 32 176.315 178.186 -1.871 1 1 182 . 15 1 1 A 32 32 ASP CA C 32 53.737 56.427 -2.690 1 1 183 . 15 1 1 A 32 32 ASP CB C 32 41.230 41.585 -0.355 1 1 184 . 15 1 1 A 33 33 THR H H 33 8.190 8.042 0.148 1 1 188 . 15 1 1 A 33 33 THR C C 33 175.291 175.686 -0.395 1 1 189 . 15 1 1 A 33 33 THR CA C 33 61.909 65.260 -3.351 1 1 190 . 15 1 1 A 33 33 THR CB C 33 68.961 69.293 -0.332 1 1 192 . 15 1 1 A 33 33 THR N N 33 114.235 113.404 0.831 1 1 193 . 15 1 1 A 34 34 GLY H H 34 8.341 7.864 0.477 1 1 194 . 15 1 1 A 34 34 GLY C C 34 173.766 172.403 1.363 1 1 195 . 15 1 1 A 34 34 GLY CA C 34 44.941 45.045 -0.104 1 1 196 . 15 1 1 A 34 34 GLY N N 34 110.678 107.391 3.287 1 1 197 . 15 1 1 A 35 35 PHE H H 35 7.945 8.565 -0.620 1 1 198 . 15 1 1 A 35 35 PHE C C 35 175.411 173.819 1.592 1 1 199 . 15 1 1 A 35 35 PHE CA C 35 57.921 56.233 1.688 1 1 200 . 15 1 1 A 35 35 PHE CB C 35 38.806 42.239 -3.433 1 1 201 . 15 1 1 A 35 35 PHE N N 35 120.533 120.768 -0.235 1 1 202 . 15 1 1 A 36 36 TYR H H 36 7.967 8.639 -0.672 1 1 203 . 15 1 1 A 36 36 TYR C C 36 176.104 174.743 1.361 1 1 204 . 15 1 1 A 36 36 TYR CA C 36 57.568 57.143 0.425 1 1 205 . 15 1 1 A 36 36 TYR CB C 36 37.727 39.690 -1.963 1 1 206 . 15 1 1 A 36 36 TYR N N 36 120.254 127.677 -7.423 1 1 207 . 15 1 1 A 37 37 GLY H H 37 7.666 8.223 -0.557 1 1 208 . 15 1 1 A 37 37 GLY C C 37 173.794 172.771 1.023 1 1 209 . 15 1 1 A 37 37 GLY CA C 37 45.007 44.438 0.569 1 1 210 . 15 1 1 A 37 37 GLY N N 37 108.995 109.602 -0.607 1 1 211 . 15 1 1 A 38 38 ASN H H 38 8.109 8.372 -0.263 1 1 212 . 15 1 1 A 38 38 ASN C C 38 175.612 175.203 0.409 1 1 213 . 15 1 1 A 38 38 ASN CA C 38 52.954 52.531 0.423 1 1 214 . 15 1 1 A 38 38 ASN CB C 38 38.425 40.172 -1.747 1 1 215 . 15 1 1 A 38 38 ASN N N 38 118.603 118.253 0.350 1 1 216 . 15 1 1 A 39 39 GLY H H 39 8.202 8.325 -0.123 1 1 217 . 15 1 1 A 39 39 GLY C C 39 173.958 173.009 0.949 1 1 218 . 15 1 1 A 39 39 GLY CA C 39 45.012 45.999 -0.987 1 1 219 . 15 1 1 A 39 39 GLY N N 39 108.897 109.653 -0.756 1 1 220 . 15 1 1 A 40 40 PHE H H 40 7.960 7.824 0.136 1 1 221 . 15 1 1 A 40 40 PHE C C 40 175.653 175.060 0.593 1 1 222 . 15 1 1 A 40 40 PHE CA C 40 57.556 55.593 1.963 1 1 223 . 15 1 1 A 40 40 PHE CB C 40 38.513 43.206 -4.693 1 1 224 . 15 1 1 A 40 40 PHE N N 40 119.829 114.752 5.077 1 1 225 . 15 1 1 A 41 41 GLN H H 41 8.173 9.086 -0.913 1 1 226 . 15 1 1 A 41 41 GLN C C 41 175.234 176.228 -0.994 1 1 227 . 15 1 1 A 41 41 GLN CA C 41 55.488 55.043 0.445 1 1 228 . 15 1 1 A 41 41 GLN CB C 41 28.523 29.769 -1.246 1 1 230 . 15 1 1 A 41 41 GLN N N 41 120.810 118.218 2.592 1 1 231 . 15 1 1 A 42 42 ASN H H 42 8.193 8.397 -0.204 1 1 232 . 15 1 1 A 42 42 ASN C C 42 174.618 176.205 -1.587 1 1 233 . 15 1 1 A 42 42 ASN CA C 42 52.924 55.228 -2.304 1 1 234 . 15 1 1 A 42 42 ASN CB C 42 38.333 39.445 -1.112 1 1 235 . 15 1 1 A 42 42 ASN N N 42 119.679 117.223 2.456 1 1 236 . 15 1 1 A 43 43 ASN H H 43 8.255 7.991 0.264 1 1 237 . 15 1 1 A 43 43 ASN C C 43 173.873 175.098 -1.225 1 1 238 . 15 1 1 A 43 43 ASN CA C 43 52.919 52.804 0.115 1 1 239 . 15 1 1 A 43 43 ASN CB C 43 38.580 39.616 -1.036 1 1 240 . 15 1 1 A 43 43 ASN N N 43 119.773 116.332 3.441 1 1 241 . 15 1 1 A 44 44 ASN H H 44 7.865 8.635 -0.770 1 1 242 . 15 1 1 A 44 44 ASN C C 44 175.518 175.355 0.163 1 1 243 . 15 1 1 A 44 44 ASN CA C 44 54.528 52.618 1.910 1 1 244 . 15 1 1 A 44 44 ASN CB C 44 40.170 38.924 1.246 1 1 246 . 15 1 1 A 44 44 ASN N N 44 124.152 118.345 5.807 1 1 247 . 15 1 1 A 46 46 PRO C C 46 177.228 176.046 1.182 1 1 248 . 15 1 1 A 46 46 PRO CA C 46 62.794 63.222 -0.428 1 1 249 . 15 1 1 A 46 46 PRO CB C 46 31.283 32.105 -0.822 1 1 251 . 15 1 1 A 47 47 THR H H 47 8.165 8.467 -0.302 1 1 255 . 15 1 1 A 47 47 THR C C 47 174.573 173.502 1.071 1 1 256 . 15 1 1 A 47 47 THR CA C 47 61.346 61.005 0.341 1 1 257 . 15 1 1 A 47 47 THR CB C 47 69.573 69.923 -0.350 1 1 259 . 15 1 1 A 47 47 THR N N 47 114.265 118.174 -3.909 1 1 260 . 15 1 1 A 48 48 ARG H H 48 8.237 7.574 0.663 1 1 261 . 15 1 1 A 48 48 ARG C C 48 175.898 175.086 0.812 1 1 262 . 15 1 1 A 48 48 ARG CA C 48 55.717 54.792 0.925 1 1 263 . 15 1 1 A 48 48 ARG CB C 48 30.151 31.905 -1.754 1 1 266 . 15 1 1 A 48 48 ARG N N 48 122.795 119.922 2.873 1 1 267 . 15 1 1 A 49 49 ASN H H 49 8.369 8.744 -0.375 1 1 268 . 15 1 1 A 49 49 ASN C C 49 174.560 173.693 0.867 1 1 269 . 15 1 1 A 49 49 ASN CA C 49 53.005 51.544 1.461 1 1 270 . 15 1 1 A 49 49 ASN CB C 49 38.761 40.036 -1.275 1 1 271 . 15 1 1 A 49 49 ASN N N 49 119.837 117.417 2.420 1 1 272 . 15 1 1 A 50 50 ASP H H 50 8.192 8.696 -0.504 1 1 273 . 15 1 1 A 50 50 ASP C C 50 175.699 175.198 0.501 1 1 274 . 15 1 1 A 50 50 ASP CA C 50 54.289 53.799 0.490 1 1 275 . 15 1 1 A 50 50 ASP CB C 50 41.264 39.620 1.644 1 1 276 . 15 1 1 A 50 50 ASP N N 50 120.403 125.317 -4.914 1 1 277 . 15 1 1 A 51 51 GLN H H 51 8.428 8.355 0.073 1 1 278 . 15 1 1 A 51 51 GLN C C 51 175.186 175.842 -0.656 1 1 279 . 15 1 1 A 51 51 GLN CA C 51 54.512 54.352 0.160 1 1 280 . 15 1 1 A 51 51 GLN CB C 51 30.424 32.108 -1.684 1 1 282 . 15 1 1 A 51 51 GLN N N 51 118.959 123.738 -4.779 1 1 289 . 15 1 1 A 52 52 LEU C C 52 176.018 176.640 -0.622 1 1 290 . 15 1 1 A 52 52 LEU CA C 52 54.332 53.559 0.773 1 1 291 . 15 1 1 A 52 52 LEU CB C 52 43.022 43.826 -0.804 1 1 294 . 15 1 1 A 53 53 GLY H H 53 8.639 8.699 -0.060 1 1 295 . 15 1 1 A 53 53 GLY C C 53 171.931 171.796 0.135 1 1 296 . 15 1 1 A 53 53 GLY CA C 53 43.501 44.329 -0.828 1 1 297 . 15 1 1 A 53 53 GLY N N 53 109.964 107.076 2.888 1 1 298 . 15 1 1 A 54 54 ALA H H 54 8.881 8.875 0.006 1 1 299 . 15 1 1 A 54 54 ALA C C 54 175.543 176.858 -1.315 1 1 300 . 15 1 1 A 54 54 ALA CA C 54 50.710 50.721 -0.011 1 1 301 . 15 1 1 A 54 54 ALA CB C 54 22.914 22.730 0.184 1 1 302 . 15 1 1 A 54 54 ALA N N 54 120.413 124.321 -3.908 1 1 303 . 15 1 1 A 55 55 GLY H H 55 8.346 8.801 -0.455 1 1 304 . 15 1 1 A 55 55 GLY C C 55 170.960 172.066 -1.106 1 1 305 . 15 1 1 A 55 55 GLY CA C 55 46.704 45.717 0.987 1 1 306 . 15 1 1 A 55 55 GLY N N 55 104.688 106.759 -2.071 1 1 307 . 15 1 1 A 56 56 ALA H H 56 9.116 8.628 0.488 1 1 308 . 15 1 1 A 56 56 ALA C C 56 176.472 176.463 0.009 1 1 309 . 15 1 1 A 56 56 ALA CA C 56 49.638 50.459 -0.821 1 1 310 . 15 1 1 A 56 56 ALA CB C 56 22.275 22.726 -0.451 1 1 311 . 15 1 1 A 56 56 ALA N N 56 120.608 123.153 -2.545 1 1 312 . 15 1 1 A 57 57 PHE H H 57 8.688 8.955 -0.267 1 1 313 . 15 1 1 A 57 57 PHE C C 57 172.816 173.913 -1.097 1 1 314 . 15 1 1 A 57 57 PHE CA C 57 56.066 55.403 0.663 1 1 315 . 15 1 1 A 57 57 PHE CB C 57 41.770 41.801 -0.031 1 1 316 . 15 1 1 A 57 57 PHE N N 57 120.027 115.885 4.142 1 1 317 . 15 1 1 A 58 58 GLY H H 58 9.034 8.975 0.059 1 1 318 . 15 1 1 A 58 58 GLY C C 58 170.860 172.616 -1.756 1 1 319 . 15 1 1 A 58 58 GLY CA C 58 44.954 44.552 0.402 1 1 320 . 15 1 1 A 58 58 GLY N N 58 105.817 108.614 -2.797 1 1 321 . 15 1 1 A 59 59 GLY H H 59 8.382 8.766 -0.384 1 1 322 . 15 1 1 A 59 59 GLY C C 59 169.284 172.651 -3.367 1 1 323 . 15 1 1 A 59 59 GLY CA C 59 45.840 44.639 1.201 1 1 324 . 15 1 1 A 59 59 GLY N N 59 109.059 110.229 -1.170 1 1 325 . 15 1 1 A 60 60 TYR H H 60 8.430 8.987 -0.557 1 1 326 . 15 1 1 A 60 60 TYR C C 60 173.453 172.974 0.479 1 1 327 . 15 1 1 A 60 60 TYR CA C 60 55.282 55.829 -0.547 1 1 328 . 15 1 1 A 60 60 TYR CB C 60 41.712 42.346 -0.634 1 1 329 . 15 1 1 A 60 60 TYR N N 60 118.352 115.671 2.681 1 1 330 . 15 1 1 A 61 61 GLN H H 61 8.833 9.076 -0.243 1 1 331 . 15 1 1 A 61 61 GLN C C 61 174.365 175.410 -1.045 1 1 332 . 15 1 1 A 61 61 GLN CA C 61 54.125 56.054 -1.929 1 1 333 . 15 1 1 A 61 61 GLN CB C 61 28.033 29.870 -1.837 1 1 335 . 15 1 1 A 61 61 GLN N N 61 129.628 122.709 6.919 1 1 336 . 15 1 1 A 62 62 VAL H H 62 8.714 8.742 -0.028 1 1 343 . 15 1 1 A 62 62 VAL C C 62 175.758 175.617 0.141 1 1 344 . 15 1 1 A 62 62 VAL CA C 62 64.649 63.463 1.186 1 1 345 . 15 1 1 A 62 62 VAL CB C 62 31.900 34.782 -2.882 1 1 348 . 15 1 1 A 62 62 VAL N N 62 127.666 126.082 1.584 1 1 349 . 15 1 1 A 63 63 ASN H H 63 8.062 7.452 0.610 1 1 350 . 15 1 1 A 63 63 ASN C C 63 172.827 174.402 -1.575 1 1 351 . 15 1 1 A 63 63 ASN CA C 63 51.575 51.361 0.214 1 1 352 . 15 1 1 A 63 63 ASN CB C 63 37.194 38.194 -1.000 1 1 353 . 15 1 1 A 63 63 ASN N N 63 116.310 118.420 -2.110 1 1 354 . 15 1 1 A 64 64 PRO C C 64 175.071 176.087 -1.016 1 1 355 . 15 1 1 A 64 64 PRO CA C 64 65.296 62.641 2.655 1 1 356 . 15 1 1 A 64 64 PRO CB C 64 30.428 29.468 0.960 1 1 357 . 15 1 1 A 65 65 TYR H H 65 7.873 8.776 -0.903 1 1 358 . 15 1 1 A 65 65 TYR C C 65 175.145 174.824 0.321 1 1 359 . 15 1 1 A 65 65 TYR CA C 65 56.125 58.362 -2.237 1 1 360 . 15 1 1 A 65 65 TYR CB C 65 39.189 41.280 -2.091 1 1 361 . 15 1 1 A 65 65 TYR N N 65 112.894 122.322 -9.428 1 1 362 . 15 1 1 A 66 66 LEU H H 66 7.308 7.773 -0.465 1 1 369 . 15 1 1 A 66 66 LEU C C 66 173.866 174.638 -0.772 1 1 370 . 15 1 1 A 66 66 LEU CA C 66 53.431 53.711 -0.280 1 1 371 . 15 1 1 A 66 66 LEU CB C 66 44.958 44.414 0.544 1 1 375 . 15 1 1 A 66 66 LEU N N 66 120.270 117.379 2.891 1 1 376 . 15 1 1 A 67 67 GLY H H 67 8.855 8.434 0.421 1 1 377 . 15 1 1 A 67 67 GLY C C 67 170.698 172.070 -1.372 1 1 378 . 15 1 1 A 67 67 GLY CA C 67 44.008 44.269 -0.261 1 1 379 . 15 1 1 A 67 67 GLY N N 67 114.388 106.567 7.821 1 1 380 . 15 1 1 A 68 68 PHE H H 68 8.770 8.355 0.415 1 1 381 . 15 1 1 A 68 68 PHE C C 68 173.386 174.905 -1.519 1 1 382 . 15 1 1 A 68 68 PHE CA C 68 56.507 57.842 -1.335 1 1 383 . 15 1 1 A 68 68 PHE CB C 68 42.428 39.817 2.611 1 1 384 . 15 1 1 A 68 68 PHE N N 68 117.510 118.942 -1.432 1 1 385 . 15 1 1 A 69 69 GLU H H 69 9.079 9.493 -0.414 1 1 386 . 15 1 1 A 69 69 GLU C C 69 174.556 174.295 0.261 1 1 387 . 15 1 1 A 69 69 GLU CA C 69 54.939 54.944 -0.005 1 1 388 . 15 1 1 A 69 69 GLU CB C 69 33.963 33.169 0.794 1 1 390 . 15 1 1 A 69 69 GLU N N 69 120.562 121.340 -0.778 1 1 391 . 15 1 1 A 70 70 MET H H 70 9.481 9.715 -0.234 1 1 392 . 15 1 1 A 70 70 MET C C 70 174.595 175.064 -0.469 1 1 393 . 15 1 1 A 70 70 MET CA C 70 53.091 53.982 -0.891 1 1 394 . 15 1 1 A 70 70 MET CB C 70 36.159 35.468 0.691 1 1 397 . 15 1 1 A 70 70 MET N N 70 124.928 127.096 -2.168 1 1 398 . 15 1 1 A 71 71 GLY H H 71 8.845 9.182 -0.337 1 1 399 . 15 1 1 A 71 71 GLY C C 71 170.811 171.400 -0.589 1 1 400 . 15 1 1 A 71 71 GLY CA C 71 44.624 43.988 0.636 1 1 401 . 15 1 1 A 71 71 GLY N N 71 108.896 112.810 -3.914 1 1 402 . 15 1 1 A 72 72 TYR H H 72 8.925 9.433 -0.508 1 1 403 . 15 1 1 A 72 72 TYR C C 72 173.278 173.868 -0.590 1 1 404 . 15 1 1 A 72 72 TYR CA C 72 55.912 56.776 -0.864 1 1 405 . 15 1 1 A 72 72 TYR CB C 72 41.611 41.040 0.571 1 1 406 . 15 1 1 A 72 72 TYR N N 72 123.253 122.270 0.983 1 1 407 . 15 1 1 A 73 73 ASP H H 73 8.665 9.043 -0.378 1 1 408 . 15 1 1 A 73 73 ASP C C 73 173.598 174.895 -1.297 1 1 409 . 15 1 1 A 73 73 ASP CA C 73 52.857 53.356 -0.499 1 1 410 . 15 1 1 A 73 73 ASP CB C 73 42.774 42.644 0.130 1 1 411 . 15 1 1 A 73 73 ASP N N 73 126.178 125.115 1.063 1 1 412 . 15 1 1 A 74 74 TRP H H 74 9.080 9.120 -0.040 1 1 413 . 15 1 1 A 74 74 TRP C C 74 174.868 175.214 -0.346 1 1 414 . 15 1 1 A 74 74 TRP CB C 74 30.083 32.251 -2.168 1 1 415 . 15 1 1 A 74 74 TRP N N 74 121.824 126.137 -4.313 1 1 416 . 15 1 1 A 78 78 MET C C 78 174.548 175.787 -1.239 1 1 417 . 15 1 1 A 78 78 MET CA C 78 54.388 55.925 -1.537 1 1 418 . 15 1 1 A 78 78 MET CB C 78 32.542 34.112 -1.570 1 1 419 . 15 1 1 A 79 79 ALA H H 79 8.105 8.652 -0.547 1 1 420 . 15 1 1 A 79 79 ALA C C 79 176.629 176.415 0.214 1 1 421 . 15 1 1 A 79 79 ALA CA C 79 51.210 50.986 0.224 1 1 422 . 15 1 1 A 79 79 ALA CB C 79 19.106 21.878 -2.772 1 1 423 . 15 1 1 A 79 79 ALA N N 79 125.778 123.678 2.100 1 1 424 . 15 1 1 A 80 80 TYR H H 80 8.035 8.757 -0.722 1 1 425 . 15 1 1 A 80 80 TYR C C 80 175.604 172.672 2.932 1 1 426 . 15 1 1 A 80 80 TYR CA C 80 57.021 56.188 0.833 1 1 427 . 15 1 1 A 80 80 TYR CB C 80 38.416 41.116 -2.700 1 1 428 . 15 1 1 A 80 80 TYR N N 80 120.045 116.086 3.959 1 1 429 . 15 1 1 A 81 81 LYS H H 81 8.295 8.547 -0.252 1 1 430 . 15 1 1 A 81 81 LYS C C 81 176.647 176.081 0.566 1 1 431 . 15 1 1 A 81 81 LYS CA C 81 56.285 55.767 0.518 1 1 432 . 15 1 1 A 81 81 LYS CB C 81 31.571 31.689 -0.118 1 1 434 . 15 1 1 A 81 81 LYS N N 81 123.191 122.648 0.543 1 1 435 . 15 1 1 A 82 82 GLY H H 82 8.117 8.270 -0.153 1 1 436 . 15 1 1 A 82 82 GLY C C 82 174.010 173.642 0.368 1 1 437 . 15 1 1 A 82 82 GLY CA C 82 44.982 45.486 -0.504 1 1 438 . 15 1 1 A 82 82 GLY N N 82 110.014 113.493 -3.479 1 1 439 . 15 1 1 A 83 83 SER H H 83 7.938 7.804 0.134 1 1 440 . 15 1 1 A 83 83 SER C C 83 174.634 172.344 2.290 1 1 441 . 15 1 1 A 83 83 SER CA C 83 57.685 57.736 -0.051 1 1 442 . 15 1 1 A 83 83 SER CB C 83 63.303 66.439 -3.136 1 1 443 . 15 1 1 A 83 83 SER N N 83 115.655 112.848 2.807 1 1 444 . 15 1 1 A 84 84 VAL H H 84 8.008 8.616 -0.608 1 1 451 . 15 1 1 A 84 84 VAL C C 84 175.525 175.435 0.090 1 1 452 . 15 1 1 A 84 84 VAL CA C 84 61.769 60.859 0.910 1 1 453 . 15 1 1 A 84 84 VAL CB C 84 31.711 32.762 -1.051 1 1 456 . 15 1 1 A 84 84 VAL N N 84 120.054 119.050 1.004 1 1 457 . 15 1 1 A 85 85 ASP H H 85 8.140 8.877 -0.737 1 1 458 . 15 1 1 A 85 85 ASP C C 85 174.740 175.337 -0.597 1 1 459 . 15 1 1 A 85 85 ASP CA C 85 53.983 54.852 -0.869 1 1 460 . 15 1 1 A 85 85 ASP CB C 85 40.633 43.162 -2.529 1 1 461 . 15 1 1 A 85 85 ASP N N 85 122.510 125.404 -2.894 1 1 462 . 15 1 1 A 86 86 ASN H H 86 7.736 8.339 -0.603 1 1 463 . 15 1 1 A 86 86 ASN C C 86 175.970 175.280 0.690 1 1 464 . 15 1 1 A 86 86 ASN CA C 86 54.349 52.152 2.197 1 1 465 . 15 1 1 A 86 86 ASN CB C 86 40.490 41.419 -0.929 1 1 467 . 15 1 1 A 86 86 ASN N N 86 124.290 114.800 9.490 1 1 468 . 15 1 1 A 87 87 GLY H H 87 8.000 8.494 -0.494 1 1 469 . 15 1 1 A 87 87 GLY C C 87 173.456 174.143 -0.687 1 1 470 . 15 1 1 A 87 87 GLY CA C 87 44.973 44.500 0.473 1 1 471 . 15 1 1 A 87 87 GLY N N 87 113.494 109.354 4.140 1 1 472 . 15 1 1 A 88 88 ALA H H 88 8.024 8.290 -0.266 1 1 473 . 15 1 1 A 88 88 ALA C C 88 176.833 177.024 -0.191 1 1 474 . 15 1 1 A 88 88 ALA CA C 88 51.734 50.851 0.883 1 1 475 . 15 1 1 A 88 88 ALA CB C 88 19.818 19.713 0.105 1 1 476 . 15 1 1 A 88 88 ALA N N 88 122.676 121.013 1.663 1 1 477 . 15 1 1 A 91 91 ALA C C 91 174.781 175.817 -1.036 1 1 478 . 15 1 1 A 91 91 ALA CA C 91 50.537 51.853 -1.316 1 1 479 . 15 1 1 A 91 91 ALA CB C 91 21.324 20.729 0.595 1 1 480 . 15 1 1 A 92 92 GLN H H 92 8.451 8.601 -0.150 1 1 481 . 15 1 1 A 92 92 GLN C C 92 173.557 173.913 -0.356 1 1 482 . 15 1 1 A 92 92 GLN CA C 92 53.380 55.425 -2.045 1 1 484 . 15 1 1 A 92 92 GLN N N 92 116.847 121.154 -4.307 1 1 485 . 15 1 1 A 93 93 GLY C C 93 170.631 172.635 -2.004 1 1 486 . 15 1 1 A 93 93 GLY CA C 93 45.718 44.477 1.241 1 1 487 . 15 1 1 A 94 94 VAL H H 94 8.686 9.231 -0.545 1 1 494 . 15 1 1 A 94 94 VAL C C 94 173.698 174.034 -0.336 1 1 495 . 15 1 1 A 94 94 VAL CA C 94 58.997 59.929 -0.932 1 1 496 . 15 1 1 A 94 94 VAL CB C 94 33.311 34.436 -1.125 1 1 499 . 15 1 1 A 94 94 VAL N N 94 118.489 119.241 -0.752 1 1 500 . 15 1 1 A 95 95 GLN H H 95 9.468 9.571 -0.103 1 1 501 . 15 1 1 A 95 95 GLN C C 95 174.028 174.000 0.028 1 1 502 . 15 1 1 A 95 95 GLN CA C 95 52.547 54.465 -1.918 1 1 503 . 15 1 1 A 95 95 GLN CB C 95 33.816 31.299 2.517 1 1 505 . 15 1 1 A 95 95 GLN N N 95 122.106 125.416 -3.310 1 1 506 . 15 1 1 A 96 96 LEU H H 96 8.484 9.074 -0.590 1 1 513 . 15 1 1 A 96 96 LEU C C 96 175.322 175.493 -0.171 1 1 514 . 15 1 1 A 96 96 LEU CA C 96 53.736 53.863 -0.127 1 1 515 . 15 1 1 A 96 96 LEU CB C 96 41.088 44.245 -3.157 1 1 519 . 15 1 1 A 96 96 LEU N N 96 123.224 126.578 -3.354 1 1 520 . 15 1 1 A 97 97 THR H H 97 9.116 9.043 0.073 1 1 521 . 15 1 1 A 97 97 THR C C 97 173.251 171.994 1.257 1 1 522 . 15 1 1 A 97 97 THR CA C 97 58.931 59.525 -0.594 1 1 523 . 15 1 1 A 97 97 THR CB C 97 72.984 72.736 0.248 1 1 525 . 15 1 1 A 97 97 THR N N 97 112.504 115.643 -3.139 1 1 526 . 15 1 1 A 98 98 ALA H H 98 8.603 8.799 -0.196 1 1 527 . 15 1 1 A 98 98 ALA C C 98 174.948 175.431 -0.483 1 1 528 . 15 1 1 A 98 98 ALA CA C 98 49.980 49.928 0.052 1 1 529 . 15 1 1 A 98 98 ALA CB C 98 19.157 20.855 -1.698 1 1 530 . 15 1 1 A 98 98 ALA N N 98 121.608 123.609 -2.001 1 1 531 . 15 1 1 A 99 99 LYS H H 99 8.890 9.164 -0.274 1 1 532 . 15 1 1 A 99 99 LYS C C 99 174.294 174.932 -0.638 1 1 533 . 15 1 1 A 99 99 LYS CA C 99 54.019 54.640 -0.621 1 1 534 . 15 1 1 A 99 99 LYS CB C 99 33.018 35.453 -2.435 1 1 538 . 15 1 1 A 99 99 LYS N N 99 124.522 123.422 1.100 1 1 539 . 15 1 1 A 100 100 LEU H H 100 8.985 9.003 -0.018 1 1 546 . 15 1 1 A 100 100 LEU C C 100 175.265 175.125 0.140 1 1 547 . 15 1 1 A 100 100 LEU CA C 100 52.698 53.121 -0.423 1 1 548 . 15 1 1 A 100 100 LEU CB C 100 42.889 44.843 -1.954 1 1 552 . 15 1 1 A 100 100 LEU N N 100 131.876 123.092 8.784 1 1 553 . 15 1 1 A 101 101 GLY H H 101 9.137 8.665 0.472 1 1 554 . 15 1 1 A 101 101 GLY C C 101 170.798 171.930 -1.132 1 1 555 . 15 1 1 A 101 101 GLY CA C 101 44.429 44.413 0.016 1 1 556 . 15 1 1 A 101 101 GLY N N 101 111.928 108.918 3.010 1 1 557 . 15 1 1 A 102 102 TYR H H 102 8.779 8.357 0.422 1 1 558 . 15 1 1 A 102 102 TYR C C 102 173.402 173.493 -0.091 1 1 559 . 15 1 1 A 102 102 TYR CA C 102 54.444 56.304 -1.860 1 1 560 . 15 1 1 A 102 102 TYR CB C 102 42.239 42.533 -0.294 1 1 561 . 15 1 1 A 102 102 TYR N N 102 116.664 119.686 -3.022 1 1 562 . 15 1 1 A 103 103 PRO C C 103 175.676 176.350 -0.674 1 1 563 . 15 1 1 A 103 103 PRO CA C 103 61.462 62.480 -1.018 1 1 564 . 15 1 1 A 103 103 PRO CB C 103 30.073 33.348 -3.275 1 1 565 . 15 1 1 A 104 104 ILE H H 104 8.670 9.085 -0.415 1 1 569 . 15 1 1 A 104 104 ILE C C 104 176.646 177.648 -1.002 1 1 570 . 15 1 1 A 104 104 ILE CA C 104 62.054 62.253 -0.199 1 1 571 . 15 1 1 A 104 104 ILE CB C 104 37.678 39.267 -1.589 1 1 574 . 15 1 1 A 104 104 ILE N N 104 125.939 120.321 5.618 1 1 575 . 15 1 1 A 105 105 THR H H 105 8.129 7.903 0.226 1 1 576 . 15 1 1 A 105 105 THR C C 105 174.344 174.218 0.126 1 1 577 . 15 1 1 A 105 105 THR CA C 105 59.176 62.158 -2.982 1 1 578 . 15 1 1 A 105 105 THR CB C 105 71.049 70.532 0.517 1 1 580 . 15 1 1 A 105 105 THR N N 105 109.853 110.084 -0.231 1 1 581 . 15 1 1 A 106 106 ASP H H 106 8.424 7.803 0.621 1 1 582 . 15 1 1 A 106 106 ASP C C 106 175.692 176.479 -0.787 1 1 583 . 15 1 1 A 106 106 ASP CA C 106 56.465 55.161 1.304 1 1 584 . 15 1 1 A 106 106 ASP CB C 106 40.032 43.605 -3.573 1 1 585 . 15 1 1 A 106 106 ASP N N 106 117.156 120.707 -3.551 1 1 586 . 15 1 1 A 107 107 ASP H H 107 8.124 8.346 -0.222 1 1 587 . 15 1 1 A 107 107 ASP C C 107 174.174 175.366 -1.192 1 1 588 . 15 1 1 A 107 107 ASP CA C 107 52.907 53.446 -0.539 1 1 589 . 15 1 1 A 107 107 ASP CB C 107 41.661 41.270 0.391 1 1 590 . 15 1 1 A 107 107 ASP N N 107 113.591 115.382 -1.791 1 1 591 . 15 1 1 A 108 108 LEU H H 108 7.336 7.522 -0.186 1 1 598 . 15 1 1 A 108 108 LEU C C 108 174.321 175.333 -1.012 1 1 599 . 15 1 1 A 108 108 LEU CA C 108 54.449 53.887 0.562 1 1 600 . 15 1 1 A 108 108 LEU CB C 108 44.754 45.295 -0.541 1 1 604 . 15 1 1 A 108 108 LEU N N 108 123.244 120.478 2.766 1 1 605 . 15 1 1 A 109 109 ASP H H 109 8.943 8.977 -0.034 1 1 606 . 15 1 1 A 109 109 ASP C C 109 176.248 174.104 2.144 1 1 607 . 15 1 1 A 109 109 ASP CA C 109 52.376 52.683 -0.307 1 1 608 . 15 1 1 A 109 109 ASP CB C 109 42.764 45.437 -2.673 1 1 609 . 15 1 1 A 109 109 ASP N N 109 124.634 123.088 1.546 1 1 610 . 15 1 1 A 110 110 ILE H H 110 8.372 9.093 -0.721 1 1 614 . 15 1 1 A 110 110 ILE C C 110 173.735 172.793 0.942 1 1 615 . 15 1 1 A 110 110 ILE CA C 110 59.129 58.554 0.575 1 1 616 . 15 1 1 A 110 110 ILE CB C 110 39.402 41.562 -2.160 1 1 620 . 15 1 1 A 110 110 ILE N N 110 119.135 121.679 -2.544 1 1 621 . 15 1 1 A 111 111 TYR H H 111 8.695 9.042 -0.347 1 1 622 . 15 1 1 A 111 111 TYR C C 111 172.838 175.439 -2.601 1 1 623 . 15 1 1 A 111 111 TYR CA C 111 56.182 56.609 -0.427 1 1 624 . 15 1 1 A 111 111 TYR CB C 111 41.489 42.906 -1.417 1 1 625 . 15 1 1 A 111 111 TYR N N 111 121.248 126.622 -5.374 1 1 626 . 15 1 1 A 112 112 THR H H 112 9.172 8.819 0.353 1 1 627 . 15 1 1 A 112 112 THR C C 112 173.850 173.564 0.286 1 1 628 . 15 1 1 A 112 112 THR CA C 112 58.246 61.231 -2.985 1 1 629 . 15 1 1 A 112 112 THR CB C 112 71.676 71.781 -0.105 1 1 631 . 15 1 1 A 112 112 THR N N 112 110.671 116.750 -6.079 1 1 632 . 15 1 1 A 113 113 ARG H H 113 8.732 9.427 -0.695 1 1 633 . 15 1 1 A 113 113 ARG C C 113 175.037 174.564 0.473 1 1 634 . 15 1 1 A 113 113 ARG CA C 113 53.995 54.712 -0.717 1 1 635 . 15 1 1 A 113 113 ARG CB C 113 32.266 32.705 -0.439 1 1 638 . 15 1 1 A 113 113 ARG N N 113 120.642 125.155 -4.513 1 1 639 . 15 1 1 A 114 114 LEU H H 114 8.449 8.836 -0.387 1 1 646 . 15 1 1 A 114 114 LEU C C 114 175.812 175.678 0.134 1 1 647 . 15 1 1 A 114 114 LEU CA C 114 53.335 54.046 -0.711 1 1 648 . 15 1 1 A 114 114 LEU CB C 114 45.182 45.710 -0.528 1 1 652 . 15 1 1 A 114 114 LEU N N 114 119.078 125.544 -6.466 1 1 653 . 15 1 1 A 115 115 GLY H H 115 8.232 8.522 -0.290 1 1 654 . 15 1 1 A 115 115 GLY C C 115 171.343 172.388 -1.045 1 1 655 . 15 1 1 A 115 115 GLY CA C 115 46.217 46.158 0.059 1 1 656 . 15 1 1 A 115 115 GLY N N 115 108.966 112.407 -3.441 1 1 657 . 15 1 1 A 116 116 GLY H H 116 8.293 8.428 -0.135 1 1 658 . 15 1 1 A 116 116 GLY C C 116 169.856 172.795 -2.939 1 1 659 . 15 1 1 A 116 116 GLY CA C 116 44.084 44.617 -0.533 1 1 660 . 15 1 1 A 116 116 GLY N N 116 109.676 110.813 -1.137 1 1 661 . 15 1 1 A 117 117 MET H H 117 9.286 9.527 -0.241 1 1 662 . 15 1 1 A 117 117 MET C C 117 174.557 175.303 -0.746 1 1 663 . 15 1 1 A 117 117 MET CA C 117 53.258 53.459 -0.201 1 1 664 . 15 1 1 A 117 117 MET CB C 117 37.195 35.112 2.083 1 1 667 . 15 1 1 A 117 117 MET N N 117 120.425 117.495 2.930 1 1 668 . 15 1 1 A 118 118 VAL H H 118 9.062 9.170 -0.108 1 1 675 . 15 1 1 A 118 118 VAL C C 118 173.993 175.286 -1.293 1 1 676 . 15 1 1 A 118 118 VAL CA C 118 59.883 61.479 -1.596 1 1 677 . 15 1 1 A 118 118 VAL CB C 118 31.782 34.249 -2.467 1 1 680 . 15 1 1 A 118 118 VAL N N 118 126.948 121.148 5.800 1 1 681 . 15 1 1 A 119 119 TRP H H 119 8.482 9.443 -0.961 1 1 682 . 15 1 1 A 119 119 TRP C C 119 174.608 173.109 1.499 1 1 683 . 15 1 1 A 119 119 TRP CA C 119 53.332 54.712 -1.380 1 1 684 . 15 1 1 A 119 119 TRP CB C 119 33.569 32.732 0.837 1 1 685 . 15 1 1 A 119 119 TRP N N 119 124.631 125.110 -0.479 1 1 686 . 15 1 1 A 120 120 ARG H H 120 9.113 8.828 0.285 1 1 687 . 15 1 1 A 120 120 ARG C C 120 174.951 174.372 0.579 1 1 688 . 15 1 1 A 120 120 ARG CA C 120 54.684 53.937 0.747 1 1 689 . 15 1 1 A 120 120 ARG CB C 120 33.424 34.102 -0.678 1 1 690 . 15 1 1 A 120 120 ARG N N 120 117.899 120.535 -2.636 1 1 691 . 15 1 1 A 121 121 ALA H H 121 9.299 8.899 0.400 1 1 692 . 15 1 1 A 121 121 ALA C C 121 175.954 174.952 1.002 1 1 693 . 15 1 1 A 121 121 ALA CA C 121 50.368 50.173 0.195 1 1 694 . 15 1 1 A 121 121 ALA CB C 121 21.141 21.370 -0.229 1 1 695 . 15 1 1 A 121 121 ALA N N 121 128.863 127.791 1.072 1 1 696 . 15 1 1 A 122 122 ASP H H 122 8.488 8.930 -0.442 1 1 697 . 15 1 1 A 122 122 ASP C C 122 175.635 175.943 -0.308 1 1 698 . 15 1 1 A 122 122 ASP CA C 122 53.891 53.187 0.704 1 1 699 . 15 1 1 A 122 122 ASP CB C 122 42.492 42.808 -0.316 1 1 700 . 15 1 1 A 122 122 ASP N N 122 121.721 124.139 -2.418 1 1 701 . 15 1 1 A 123 123 SER H H 123 8.466 8.894 -0.428 1 1 702 . 15 1 1 A 123 123 SER C C 123 174.325 175.161 -0.836 1 1 703 . 15 1 1 A 123 123 SER CA C 123 57.325 57.177 0.148 1 1 704 . 15 1 1 A 123 123 SER CB C 123 63.988 65.606 -1.618 1 1 705 . 15 1 1 A 123 123 SER N N 123 117.374 118.122 -0.748 1 1 706 . 15 1 1 A 124 124 LYS H H 124 8.389 8.927 -0.538 1 1 707 . 15 1 1 A 124 124 LYS C C 124 176.840 177.195 -0.355 1 1 708 . 15 1 1 A 124 124 LYS CA C 124 56.036 58.443 -2.407 1 1 709 . 15 1 1 A 124 124 LYS CB C 124 32.397 32.917 -0.520 1 1 711 . 15 1 1 A 124 124 LYS N N 124 122.883 120.184 2.699 1 1 712 . 15 1 1 A 125 125 GLY H H 125 8.281 7.518 0.763 1 1 713 . 15 1 1 A 125 125 GLY C C 125 173.592 172.629 0.963 1 1 714 . 15 1 1 A 125 125 GLY CA C 125 44.924 45.756 -0.832 1 1 715 . 15 1 1 A 125 125 GLY N N 125 109.541 103.288 6.253 1 1 716 . 15 1 1 A 126 126 ASN H H 126 8.185 8.696 -0.511 1 1 717 . 15 1 1 A 126 126 ASN C C 126 176.649 174.716 1.933 1 1 718 . 15 1 1 A 126 126 ASN CA C 126 52.763 53.231 -0.468 1 1 719 . 15 1 1 A 126 126 ASN CB C 126 38.439 39.403 -0.964 1 1 720 . 15 1 1 A 126 126 ASN N N 126 119.019 116.624 2.395 1 1 721 . 15 1 1 A 127 127 TYR C C 127 176.913 173.451 3.462 1 1 722 . 15 1 1 A 127 127 TYR CA C 127 57.757 58.233 -0.476 1 1 723 . 15 1 1 A 127 127 TYR CB C 127 37.703 41.708 -4.005 1 1 724 . 15 1 1 A 128 128 ALA H H 128 8.050 8.652 -0.602 1 1 728 . 15 1 1 A 128 128 ALA C C 128 177.756 176.620 1.136 1 1 729 . 15 1 1 A 128 128 ALA CA C 128 52.321 50.473 1.848 1 1 730 . 15 1 1 A 128 128 ALA CB C 128 18.273 21.870 -3.597 1 1 731 . 15 1 1 A 128 128 ALA N N 128 124.529 129.582 -5.053 1 1 732 . 15 1 1 A 129 129 SER H H 129 8.063 9.006 -0.943 1 1 733 . 15 1 1 A 129 129 SER C C 129 174.938 175.417 -0.479 1 1 734 . 15 1 1 A 129 129 SER CA C 129 58.202 59.741 -1.539 1 1 735 . 15 1 1 A 129 129 SER CB C 129 62.974 65.157 -2.183 1 1 736 . 15 1 1 A 129 129 SER N N 129 114.374 117.395 -3.021 1 1 737 . 15 1 1 A 130 130 THR H H 130 7.875 8.023 -0.148 1 1 741 . 15 1 1 A 130 130 THR C C 130 175.198 174.738 0.460 1 1 742 . 15 1 1 A 130 130 THR CA C 130 61.520 62.222 -0.702 1 1 743 . 15 1 1 A 130 130 THR CB C 130 69.312 70.702 -1.390 1 1 745 . 15 1 1 A 130 130 THR N N 130 113.608 109.658 3.950 1 1 746 . 15 1 1 A 131 131 GLY H H 131 8.219 7.459 0.760 1 1 747 . 15 1 1 A 131 131 GLY C C 131 173.979 172.262 1.717 1 1 748 . 15 1 1 A 131 131 GLY CA C 131 44.991 45.767 -0.776 1 1 749 . 15 1 1 A 131 131 GLY N N 131 110.848 108.084 2.764 1 1 750 . 15 1 1 A 132 132 VAL H H 132 7.729 8.938 -1.209 1 1 757 . 15 1 1 A 132 132 VAL C C 132 175.988 175.041 0.947 1 1 758 . 15 1 1 A 132 132 VAL CA C 132 61.643 60.475 1.168 1 1 759 . 15 1 1 A 132 132 VAL CB C 132 31.941 34.173 -2.232 1 1 762 . 15 1 1 A 132 132 VAL N N 132 118.932 125.564 -6.632 1 1 763 . 15 1 1 A 133 133 SER H H 133 8.224 8.776 -0.552 1 1 764 . 15 1 1 A 133 133 SER C C 133 174.320 172.797 1.523 1 1 765 . 15 1 1 A 133 133 SER CA C 133 57.756 57.240 0.516 1 1 766 . 15 1 1 A 133 133 SER CB C 133 63.140 62.583 0.557 1 1 767 . 15 1 1 A 133 133 SER N N 133 119.260 124.518 -5.258 1 1 768 . 15 1 1 A 134 134 ARG H H 134 8.199 7.613 0.586 1 1 769 . 15 1 1 A 134 134 ARG C C 134 175.923 175.076 0.847 1 1 770 . 15 1 1 A 134 134 ARG CA C 134 55.461 54.557 0.904 1 1 771 . 15 1 1 A 134 134 ARG CB C 134 30.195 32.260 -2.065 1 1 774 . 15 1 1 A 134 134 ARG N N 134 123.262 124.280 -1.018 1 1 775 . 15 1 1 A 135 135 SER H H 135 8.256 8.732 -0.476 1 1 776 . 15 1 1 A 135 135 SER C C 135 174.360 173.008 1.352 1 1 777 . 15 1 1 A 135 135 SER CA C 135 57.730 57.533 0.197 1 1 778 . 15 1 1 A 135 135 SER CB C 135 63.275 64.424 -1.149 1 1 779 . 15 1 1 A 135 135 SER N N 135 117.155 122.190 -5.035 1 1 780 . 15 1 1 A 136 136 GLU H H 136 8.374 7.812 0.562 1 1 781 . 15 1 1 A 136 136 GLU C C 136 176.284 175.852 0.432 1 1 782 . 15 1 1 A 136 136 GLU CA C 136 56.082 55.135 0.947 1 1 783 . 15 1 1 A 136 136 GLU CB C 136 29.820 32.395 -2.575 1 1 785 . 15 1 1 A 136 136 GLU N N 136 122.812 118.851 3.961 1 1 786 . 15 1 1 A 137 137 HIS H H 137 8.118 8.724 -0.606 1 1 787 . 15 1 1 A 137 137 HIS C C 137 173.529 175.266 -1.737 1 1 788 . 15 1 1 A 137 137 HIS CA C 137 54.793 56.549 -1.756 1 1 789 . 15 1 1 A 137 137 HIS CB C 137 30.191 30.152 0.039 1 1 790 . 15 1 1 A 137 137 HIS N N 137 118.002 119.911 -1.909 1 1 791 . 15 1 1 A 138 138 ASP H H 138 8.572 8.955 -0.383 1 1 792 . 15 1 1 A 138 138 ASP C C 138 174.940 175.748 -0.808 1 1 793 . 15 1 1 A 138 138 ASP CA C 138 53.594 54.219 -0.625 1 1 794 . 15 1 1 A 138 138 ASP CB C 138 42.165 41.942 0.223 1 1 795 . 15 1 1 A 138 138 ASP N N 138 121.536 124.917 -3.381 1 1 796 . 15 1 1 A 139 139 THR H H 139 7.857 8.751 -0.894 1 1 797 . 15 1 1 A 139 139 THR C C 139 172.822 172.883 -0.061 1 1 798 . 15 1 1 A 139 139 THR CA C 139 59.197 60.553 -1.356 1 1 799 . 15 1 1 A 139 139 THR CB C 139 71.457 70.861 0.596 1 1 801 . 15 1 1 A 139 139 THR N N 139 113.598 114.204 -0.606 1 1 802 . 15 1 1 A 140 140 GLY C C 140 169.622 171.616 -1.994 1 1 803 . 15 1 1 A 140 140 GLY CA C 140 44.287 44.457 -0.170 1 1 804 . 15 1 1 A 141 141 VAL H H 141 7.815 8.673 -0.858 1 1 811 . 15 1 1 A 141 141 VAL C C 141 176.038 173.539 2.499 1 1 812 . 15 1 1 A 141 141 VAL CA C 141 59.739 59.900 -0.161 1 1 813 . 15 1 1 A 141 141 VAL CB C 141 33.308 35.215 -1.907 1 1 816 . 15 1 1 A 141 141 VAL N N 141 116.224 123.493 -7.269 1 1 817 . 15 1 1 A 142 142 SER H H 142 9.284 8.790 0.494 1 1 818 . 15 1 1 A 142 142 SER C C 142 171.050 172.176 -1.126 1 1 819 . 15 1 1 A 142 142 SER CB C 142 67.608 66.720 0.888 1 1 820 . 15 1 1 A 142 142 SER N N 142 123.223 122.387 0.836 1 1 821 . 15 1 1 A 143 143 PRO C C 143 174.032 176.321 -2.289 1 1 822 . 15 1 1 A 143 143 PRO CA C 143 62.350 62.468 -0.118 1 1 823 . 15 1 1 A 143 143 PRO CB C 143 31.774 32.355 -0.581 1 1 825 . 15 1 1 A 144 144 VAL H H 144 7.785 8.623 -0.838 1 1 832 . 15 1 1 A 144 144 VAL C C 144 172.826 174.145 -1.319 1 1 833 . 15 1 1 A 144 144 VAL CA C 144 59.770 59.746 0.024 1 1 834 . 15 1 1 A 144 144 VAL CB C 144 34.407 35.945 -1.538 1 1 837 . 15 1 1 A 144 144 VAL N N 144 120.214 117.314 2.900 1 1 838 . 15 1 1 A 145 145 PHE H H 145 8.623 8.480 0.143 1 1 839 . 15 1 1 A 145 145 PHE C C 145 173.658 172.582 1.076 1 1 840 . 15 1 1 A 145 145 PHE CA C 145 54.942 55.912 -0.970 1 1 841 . 15 1 1 A 145 145 PHE CB C 145 42.692 42.444 0.248 1 1 842 . 15 1 1 A 145 145 PHE N N 145 123.914 119.238 4.676 1 1 843 . 15 1 1 A 146 146 ALA H H 146 8.886 8.998 -0.112 1 1 844 . 15 1 1 A 146 146 ALA C C 146 176.258 176.183 0.075 1 1 845 . 15 1 1 A 146 146 ALA CA C 146 49.734 50.418 -0.684 1 1 846 . 15 1 1 A 146 146 ALA CB C 146 22.244 22.791 -0.547 1 1 847 . 15 1 1 A 146 146 ALA N N 146 125.243 123.525 1.718 1 1 848 . 15 1 1 A 147 147 GLY H H 147 8.470 8.568 -0.098 1 1 849 . 15 1 1 A 147 147 GLY C C 147 170.940 173.129 -2.189 1 1 850 . 15 1 1 A 147 147 GLY CA C 147 44.063 44.847 -0.784 1 1 851 . 15 1 1 A 147 147 GLY N N 147 106.669 106.299 0.370 1 1 852 . 15 1 1 A 148 148 GLY H H 148 8.008 8.649 -0.641 1 1 853 . 15 1 1 A 148 148 GLY C C 148 170.181 172.544 -2.363 1 1 854 . 15 1 1 A 148 148 GLY CA C 148 45.736 46.007 -0.271 1 1 855 . 15 1 1 A 148 148 GLY N N 148 109.475 109.652 -0.177 1 1 856 . 15 1 1 A 149 149 VAL H H 149 8.426 8.362 0.064 1 1 863 . 15 1 1 A 149 149 VAL C C 149 174.157 173.701 0.456 1 1 864 . 15 1 1 A 149 149 VAL CA C 149 58.200 59.041 -0.841 1 1 865 . 15 1 1 A 149 149 VAL CB C 149 34.464 36.374 -1.910 1 1 868 . 15 1 1 A 149 149 VAL N N 149 112.651 117.302 -4.651 1 1 869 . 15 1 1 A 150 150 GLU H H 150 9.070 8.727 0.343 1 1 870 . 15 1 1 A 150 150 GLU C C 150 173.892 174.760 -0.868 1 1 871 . 15 1 1 A 150 150 GLU CA C 150 54.617 55.349 -0.732 1 1 872 . 15 1 1 A 150 150 GLU CB C 150 32.911 33.793 -0.882 1 1 874 . 15 1 1 A 150 150 GLU N N 150 124.471 120.079 4.392 1 1 875 . 15 1 1 A 151 151 TRP H H 151 9.461 8.350 1.111 1 1 877 . 15 1 1 A 151 151 TRP C C 151 174.370 173.871 0.499 1 1 878 . 15 1 1 A 151 151 TRP CA C 151 54.113 55.170 -1.057 1 1 879 . 15 1 1 A 151 151 TRP CB C 151 31.688 32.880 -1.192 1 1 880 . 15 1 1 A 151 151 TRP N N 151 129.611 120.978 8.633 1 1 882 . 15 1 1 A 152 152 ALA H H 152 8.771 8.883 -0.112 1 1 883 . 15 1 1 A 152 152 ALA C C 152 175.079 176.903 -1.824 1 1 884 . 15 1 1 A 152 152 ALA CA C 152 51.417 52.005 -0.588 1 1 885 . 15 1 1 A 152 152 ALA CB C 152 17.209 19.254 -2.045 1 1 886 . 15 1 1 A 152 152 ALA N N 152 130.502 125.072 5.430 1 1 887 . 15 1 1 A 153 153 VAL H H 153 7.893 8.668 -0.775 1 1 894 . 15 1 1 A 153 153 VAL C C 153 176.612 176.259 0.353 1 1 895 . 15 1 1 A 153 153 VAL CA C 153 63.600 63.726 -0.126 1 1 896 . 15 1 1 A 153 153 VAL CB C 153 31.280 32.673 -1.393 1 1 899 . 15 1 1 A 153 153 VAL N N 153 124.360 122.876 1.484 1 1 900 . 15 1 1 A 154 154 THR H H 154 7.950 7.505 0.445 1 1 904 . 15 1 1 A 154 154 THR C C 154 173.884 173.861 0.023 1 1 905 . 15 1 1 A 154 154 THR CA C 154 58.655 60.190 -1.535 1 1 906 . 15 1 1 A 154 154 THR CB C 154 71.262 70.434 0.828 1 1 908 . 15 1 1 A 154 154 THR N N 154 109.176 111.936 -2.760 1 1 909 . 15 1 1 A 155 155 ARG H H 155 8.310 8.559 -0.249 1 1 910 . 15 1 1 A 155 155 ARG C C 155 176.753 176.459 0.294 1 1 911 . 15 1 1 A 155 155 ARG CA C 155 58.456 57.114 1.342 1 1 912 . 15 1 1 A 155 155 ARG CB C 155 29.043 30.319 -1.276 1 1 915 . 15 1 1 A 155 155 ARG N N 155 116.576 123.185 -6.609 1 1 916 . 15 1 1 A 156 156 ASP H H 156 7.783 9.025 -1.242 1 1 917 . 15 1 1 A 156 156 ASP C C 156 174.222 174.697 -0.475 1 1 918 . 15 1 1 A 156 156 ASP CA C 156 53.540 55.600 -2.060 1 1 919 . 15 1 1 A 156 156 ASP CB C 156 42.327 39.292 3.035 1 1 920 . 15 1 1 A 156 156 ASP N N 156 112.950 121.223 -8.273 1 1 921 . 15 1 1 A 157 157 ILE H H 157 7.233 6.928 0.305 1 1 925 . 15 1 1 A 157 157 ILE C C 157 174.178 174.989 -0.811 1 1 926 . 15 1 1 A 157 157 ILE CA C 157 59.350 60.805 -1.455 1 1 927 . 15 1 1 A 157 157 ILE CB C 157 38.969 40.102 -1.133 1 1 930 . 15 1 1 A 157 157 ILE N N 157 119.732 118.061 1.671 1 1 931 . 15 1 1 A 158 158 ALA H H 158 8.729 8.664 0.065 1 1 932 . 15 1 1 A 158 158 ALA C C 158 176.567 175.450 1.117 1 1 933 . 15 1 1 A 158 158 ALA CA C 158 49.418 50.147 -0.729 1 1 934 . 15 1 1 A 158 158 ALA CB C 158 21.430 23.583 -2.153 1 1 935 . 15 1 1 A 158 158 ALA N N 158 128.564 129.681 -1.117 1 1 936 . 15 1 1 A 159 159 THR H H 159 8.972 8.253 0.719 1 1 940 . 15 1 1 A 159 159 THR C C 159 172.213 172.702 -0.489 1 1 941 . 15 1 1 A 159 159 THR CA C 159 59.504 60.981 -1.477 1 1 942 . 15 1 1 A 159 159 THR CB C 159 70.728 70.772 -0.044 1 1 944 . 15 1 1 A 159 159 THR N N 159 114.901 114.507 0.394 1 1 945 . 15 1 1 A 160 160 ARG H H 160 8.924 8.998 -0.074 1 1 946 . 15 1 1 A 160 160 ARG C C 160 174.097 173.311 0.786 1 1 947 . 15 1 1 A 160 160 ARG CA C 160 53.066 54.081 -1.015 1 1 948 . 15 1 1 A 160 160 ARG CB C 160 32.922 33.441 -0.519 1 1 951 . 15 1 1 A 160 160 ARG N N 160 121.507 126.144 -4.637 1 1 952 . 15 1 1 A 161 161 LEU H H 161 8.611 8.883 -0.272 1 1 959 . 15 1 1 A 161 161 LEU C C 161 174.389 175.058 -0.669 1 1 960 . 15 1 1 A 161 161 LEU CA C 161 53.355 53.413 -0.058 1 1 961 . 15 1 1 A 161 161 LEU CB C 161 44.360 45.442 -1.082 1 1 964 . 15 1 1 A 161 161 LEU N N 161 124.711 127.746 -3.035 1 1 965 . 15 1 1 A 162 162 GLU H H 162 8.746 8.913 -0.167 1 1 966 . 15 1 1 A 162 162 GLU C C 162 173.376 175.180 -1.804 1 1 967 . 15 1 1 A 162 162 GLU CA C 162 53.904 54.826 -0.922 1 1 968 . 15 1 1 A 162 162 GLU CB C 162 33.773 32.752 1.021 1 1 970 . 15 1 1 A 162 162 GLU N N 162 122.300 125.805 -3.505 1 1 971 . 15 1 1 A 163 163 TYR H H 163 8.872 9.423 -0.551 1 1 972 . 15 1 1 A 163 163 TYR C C 163 173.425 173.153 0.272 1 1 973 . 15 1 1 A 163 163 TYR CA C 163 56.192 56.361 -0.169 1 1 974 . 15 1 1 A 163 163 TYR CB C 163 40.870 42.355 -1.485 1 1 975 . 15 1 1 A 163 163 TYR N N 163 124.618 124.602 0.016 1 1 976 . 15 1 1 A 171 171 ASP C C 171 175.753 176.459 -0.706 1 1 977 . 15 1 1 A 171 171 ASP CA C 171 53.517 54.825 -1.308 1 1 978 . 15 1 1 A 171 171 ASP CB C 171 41.353 43.029 -1.676 1 1 979 . 15 1 1 A 172 172 ALA H H 172 8.336 7.558 0.778 1 1 983 . 15 1 1 A 172 172 ALA C C 172 178.110 177.077 1.033 1 1 984 . 15 1 1 A 172 172 ALA CA C 172 52.190 52.222 -0.032 1 1 985 . 15 1 1 A 172 172 ALA CB C 172 18.305 20.060 -1.755 1 1 986 . 15 1 1 A 172 172 ALA N N 172 125.294 121.172 4.122 1 1 987 . 15 1 1 A 173 173 GLY H H 173 8.300 8.442 -0.142 1 1 988 . 15 1 1 A 173 173 GLY C C 173 174.437 172.254 2.183 1 1 989 . 15 1 1 A 173 173 GLY CA C 173 45.083 46.030 -0.947 1 1 990 . 15 1 1 A 173 173 GLY N N 173 107.268 106.028 1.240 1 1 991 . 15 1 1 A 174 174 THR H H 174 7.754 8.147 -0.393 1 1 992 . 15 1 1 A 174 174 THR C C 174 174.738 173.449 1.289 1 1 993 . 15 1 1 A 174 174 THR CA C 174 61.310 61.547 -0.237 1 1 994 . 15 1 1 A 174 174 THR CB C 174 69.310 70.768 -1.458 1 1 996 . 15 1 1 A 174 174 THR N N 174 113.472 113.377 0.095 1 1 997 . 15 1 1 A 175 175 VAL H H 175 7.993 8.788 -0.795 1 1 1004 . 15 1 1 A 175 175 VAL C C 175 176.535 176.286 0.249 1 1 1005 . 15 1 1 A 175 175 VAL CA C 175 62.126 60.495 1.631 1 1 1006 . 15 1 1 A 175 175 VAL CB C 175 31.282 31.957 -0.675 1 1 1009 . 15 1 1 A 175 175 VAL N N 175 121.643 118.804 2.839 1 1 1010 . 15 1 1 A 176 176 GLY H H 176 8.056 7.558 0.498 1 1 1011 . 15 1 1 A 176 176 GLY C C 176 173.930 172.365 1.565 1 1 1012 . 15 1 1 A 176 176 GLY CA C 176 44.983 46.112 -1.129 1 1 1013 . 15 1 1 A 176 176 GLY N N 176 110.460 111.256 -0.796 1 1 1014 . 15 1 1 A 177 177 THR H H 177 7.520 8.390 -0.870 1 1 1015 . 15 1 1 A 177 177 THR C C 177 173.574 174.679 -1.105 1 1 1016 . 15 1 1 A 177 177 THR CA C 177 60.609 61.865 -1.256 1 1 1017 . 15 1 1 A 177 177 THR CB C 177 69.506 70.440 -0.934 1 1 1019 . 15 1 1 A 177 177 THR N N 177 113.390 113.676 -0.286 1 1 1020 . 15 1 1 A 178 178 ARG H H 178 8.261 8.859 -0.598 1 1 1021 . 15 1 1 A 178 178 ARG C C 178 173.932 177.404 -3.472 1 1 1022 . 15 1 1 A 178 178 ARG CA C 178 53.683 61.241 -7.558 1 1 1023 . 15 1 1 A 178 178 ARG CB C 178 29.224 28.987 0.237 1 1 1026 . 15 1 1 A 178 178 ARG N N 178 123.906 126.711 -2.805 1 1 1027 . 15 1 1 A 183 183 MET C C 183 174.053 174.409 -0.356 1 1 1028 . 15 1 1 A 183 183 MET CA C 183 53.700 54.029 -0.329 1 1 1029 . 15 1 1 A 183 183 MET CB C 183 35.908 35.512 0.396 1 1 1032 . 15 1 1 A 184 184 LEU H H 184 8.319 8.816 -0.497 1 1 1033 . 15 1 1 A 184 184 LEU C C 184 175.235 174.684 0.551 1 1 1034 . 15 1 1 A 184 184 LEU CA C 184 53.120 53.337 -0.217 1 1 1035 . 15 1 1 A 184 184 LEU CB C 184 42.857 45.066 -2.209 1 1 1038 . 15 1 1 A 184 184 LEU N N 184 131.293 127.144 4.149 1 1 1039 . 15 1 1 A 185 185 SER H H 185 9.603 8.879 0.724 1 1 1040 . 15 1 1 A 185 185 SER C C 185 171.293 173.246 -1.953 1 1 1041 . 15 1 1 A 185 185 SER CA C 185 56.504 56.772 -0.268 1 1 1042 . 15 1 1 A 185 185 SER CB C 185 66.585 65.605 0.980 1 1 1043 . 15 1 1 A 185 185 SER N N 185 119.338 119.654 -0.316 1 1 1044 . 15 1 1 A 186 186 LEU H H 186 8.583 8.683 -0.100 1 1 1051 . 15 1 1 A 186 186 LEU C C 186 175.328 175.995 -0.667 1 1 1052 . 15 1 1 A 186 186 LEU CA C 186 52.729 53.200 -0.471 1 1 1053 . 15 1 1 A 186 186 LEU CB C 186 44.996 45.736 -0.740 1 1 1056 . 15 1 1 A 186 186 LEU N N 186 122.719 124.483 -1.764 1 1 1057 . 15 1 1 A 187 187 GLY H H 187 9.287 8.329 0.958 1 1 1058 . 15 1 1 A 187 187 GLY C C 187 172.315 172.957 -0.642 1 1 1059 . 15 1 1 A 187 187 GLY CA C 187 43.502 45.572 -2.070 1 1 1060 . 15 1 1 A 187 187 GLY N N 187 110.265 107.942 2.323 1 1 1061 . 15 1 1 A 188 188 VAL H H 188 8.825 8.583 0.242 1 1 1068 . 15 1 1 A 188 188 VAL C C 188 173.125 174.752 -1.627 1 1 1069 . 15 1 1 A 188 188 VAL CA C 188 59.739 59.512 0.227 1 1 1070 . 15 1 1 A 188 188 VAL CB C 188 34.532 34.601 -0.069 1 1 1073 . 15 1 1 A 188 188 VAL N N 188 119.161 116.238 2.923 1 1 1074 . 15 1 1 A 189 189 SER H H 189 9.051 8.915 0.136 1 1 1075 . 15 1 1 A 189 189 SER C C 189 171.698 172.725 -1.027 1 1 1076 . 15 1 1 A 189 189 SER CA C 189 55.997 56.165 -0.168 1 1 1077 . 15 1 1 A 189 189 SER CB C 189 66.094 66.579 -0.485 1 1 1078 . 15 1 1 A 189 189 SER N N 189 117.810 119.507 -1.697 1 1 1079 . 15 1 1 A 190 190 TYR H H 190 9.145 9.676 -0.531 1 1 1080 . 15 1 1 A 190 190 TYR C C 190 174.063 175.420 -1.357 1 1 1081 . 15 1 1 A 190 190 TYR CA C 190 55.375 56.304 -0.929 1 1 1082 . 15 1 1 A 190 190 TYR CB C 190 41.183 42.328 -1.145 1 1 1083 . 15 1 1 A 190 190 TYR N N 190 123.690 118.919 4.771 1 1 1084 . 15 1 1 A 191 191 ARG H H 191 8.211 8.879 -0.668 1 1 1085 . 15 1 1 A 191 191 ARG C C 191 174.826 175.047 -0.221 1 1 1086 . 15 1 1 A 191 191 ARG CA C 191 54.464 54.820 -0.356 1 1 1087 . 15 1 1 A 191 191 ARG CB C 191 30.507 33.626 -3.119 1 1 1090 . 15 1 1 A 191 191 ARG N N 191 125.366 121.319 4.047 1 1 1091 . 15 1 1 A 192 192 PHE H H 192 8.496 9.116 -0.620 1 1 1092 . 15 1 1 A 192 192 PHE C C 192 176.384 175.424 0.960 1 1 1093 . 15 1 1 A 192 192 PHE CA C 192 57.179 55.731 1.448 1 1 1094 . 15 1 1 A 192 192 PHE CB C 192 39.430 41.094 -1.664 1 1 1095 . 15 1 1 A 192 192 PHE N N 192 121.586 121.149 0.437 1 1 1096 . 15 1 1 A 193 193 GLY H H 193 8.643 8.952 -0.309 1 1 1097 . 15 1 1 A 193 193 GLY C C 193 174.466 175.273 -0.807 1 1 1098 . 15 1 1 A 193 193 GLY CA C 193 45.126 43.763 1.363 1 1 1099 . 15 1 1 A 193 193 GLY N N 193 109.499 109.188 0.311 1 1 1100 . 15 1 1 A 194 194 GLN H H 194 8.512 8.794 -0.282 1 1 1101 . 15 1 1 A 194 194 GLN C C 194 176.201 175.602 0.599 1 1 1102 . 15 1 1 A 194 194 GLN CA C 194 55.433 57.938 -2.505 1 1 1103 . 15 1 1 A 194 194 GLN CB C 194 28.729 28.850 -0.121 1 1 1105 . 15 1 1 A 194 194 GLN N N 194 119.448 120.080 -0.632 1 1 1106 . 15 1 1 A 195 195 GLU H H 195 8.530 7.853 0.677 1 1 1107 . 15 1 1 A 195 195 GLU C C 195 176.151 175.936 0.215 1 1 1108 . 15 1 1 A 195 195 GLU CA C 195 56.256 55.017 1.239 1 1 1109 . 15 1 1 A 195 195 GLU CB C 195 29.486 31.968 -2.482 1 1 1111 . 15 1 1 A 195 195 GLU N N 195 121.959 119.729 2.230 1 1 1112 . 15 1 1 A 196 196 ASP H H 196 8.253 9.123 -0.870 1 1 1113 . 15 1 1 A 196 196 ASP C C 196 175.667 175.696 -0.029 1 1 1114 . 15 1 1 A 196 196 ASP CA C 196 53.981 55.552 -1.571 1 1 1115 . 15 1 1 A 196 196 ASP CB C 196 40.700 42.627 -1.927 1 1 1116 . 15 1 1 A 196 196 ASP N N 196 121.819 123.398 -1.579 1 1 1117 . 15 1 1 A 197 197 ALA H H 197 7.999 7.686 0.313 1 1 1121 . 15 1 1 A 197 197 ALA C C 197 176.847 174.927 1.920 1 1 1122 . 15 1 1 A 197 197 ALA CA C 197 51.612 51.204 0.408 1 1 1123 . 15 1 1 A 197 197 ALA CB C 197 18.192 23.409 -5.217 1 1 1124 . 15 1 1 A 197 197 ALA N N 197 124.262 118.544 5.718 1 1 1125 . 15 1 1 A 198 198 ALA H H 198 8.042 8.782 -0.740 1 1 1126 . 15 1 1 A 198 198 ALA C C 198 176.865 174.955 1.910 1 1 1127 . 15 1 1 A 198 198 ALA CA C 198 49.999 48.815 1.184 1 1 1128 . 15 1 1 A 198 198 ALA CB C 198 17.327 21.954 -4.627 1 1 1129 . 15 1 1 A 198 198 ALA N N 198 124.724 121.679 3.045 1 1 1130 . 15 1 1 A 199 199 PRO C C 199 176.727 176.099 0.628 1 1 1131 . 15 1 1 A 199 199 PRO CA C 199 62.399 62.701 -0.302 1 1 1132 . 15 1 1 A 199 199 PRO CB C 199 30.949 32.502 -1.553 1 1 1135 . 15 1 1 A 200 200 VAL H H 200 8.026 8.181 -0.155 1 1 1142 . 15 1 1 A 200 200 VAL C C 200 176.034 176.176 -0.142 1 1 1143 . 15 1 1 A 200 200 VAL CA C 200 61.944 60.581 1.363 1 1 1144 . 15 1 1 A 200 200 VAL CB C 200 31.734 32.684 -0.950 1 1 1147 . 15 1 1 A 200 200 VAL N N 200 120.635 116.496 4.139 1 1 1148 . 15 1 1 A 201 201 VAL H H 201 7.966 8.635 -0.669 1 1 1155 . 15 1 1 A 201 201 VAL C C 201 175.128 175.159 -0.031 1 1 1156 . 15 1 1 A 201 201 VAL CA C 201 61.249 62.016 -0.767 1 1 1157 . 15 1 1 A 201 201 VAL CB C 201 31.917 33.546 -1.629 1 1 1160 . 15 1 1 A 201 201 VAL N N 201 124.053 121.958 2.095 1 1 1161 . 15 1 1 A 202 202 ALA H H 202 8.159 7.683 0.476 1 1 1162 . 15 1 1 A 202 202 ALA C C 202 175.153 176.289 -1.136 1 1 1163 . 15 1 1 A 202 202 ALA CA C 202 49.742 48.788 0.954 1 1 1164 . 15 1 1 A 202 202 ALA CB C 202 17.532 20.278 -2.746 1 1 1165 . 15 1 1 A 202 202 ALA N N 202 129.251 125.075 4.176 1 1 1166 . 15 1 1 A 203 203 PRO C C 203 176.273 176.804 -0.531 1 1 1167 . 15 1 1 A 203 203 PRO CA C 203 62.324 64.948 -2.624 1 1 1168 . 15 1 1 A 203 203 PRO CB C 203 31.042 32.068 -1.026 1 1 1170 . 15 1 1 A 204 204 ALA H H 204 8.137 7.919 0.218 1 1 1171 . 15 1 1 A 204 204 ALA C C 204 175.697 175.876 -0.179 1 1 1172 . 15 1 1 A 204 204 ALA CA C 204 49.865 49.353 0.512 1 1 1173 . 15 1 1 A 204 204 ALA CB C 204 17.364 19.364 -2.000 1 1 1174 . 15 1 1 A 204 204 ALA N N 204 125.510 119.368 6.142 1 1 1175 . 15 1 1 A 205 205 PRO C C 205 175.430 176.583 -1.153 1 1 1176 . 15 1 1 A 205 205 PRO CA C 205 62.511 65.040 -2.529 1 1 1177 . 15 1 1 A 205 205 PRO CB C 205 31.056 32.032 -0.976 1 1 1179 . 15 1 1 A 206 206 ALA H H 206 7.847 7.642 0.205 1 1 1180 . 15 1 1 A 206 206 ALA C C 206 175.565 174.812 0.753 1 1 1181 . 15 1 1 A 206 206 ALA CA C 206 49.487 49.080 0.407 1 1 1182 . 15 1 1 A 206 206 ALA CB C 206 18.843 20.711 -1.868 1 1 1183 . 15 1 1 A 206 206 ALA N N 206 123.663 118.862 4.801 1 1 1184 . 15 1 1 A 207 207 PRO C C 207 174.397 176.538 -2.141 1 1 1185 . 15 1 1 A 207 207 PRO CA C 207 61.454 62.994 -1.540 1 1 1186 . 15 1 1 A 207 207 PRO CB C 207 31.929 32.846 -0.917 1 1 1187 . 15 1 1 A 208 208 ALA H H 208 7.898 8.323 -0.425 1 1 1188 . 15 1 1 A 208 208 ALA C C 208 175.411 177.285 -1.874 1 1 1189 . 15 1 1 A 208 208 ALA CA C 208 49.472 53.305 -3.833 1 1 1190 . 15 1 1 A 208 208 ALA CB C 208 19.082 20.645 -1.563 1 1 1191 . 15 1 1 A 208 208 ALA N N 208 127.450 119.523 7.927 1 1 1192 . 15 1 1 A 209 209 PRO C C 209 176.932 177.310 -0.378 1 1 1193 . 15 1 1 A 209 209 PRO CA C 209 62.736 63.666 -0.930 1 1 1194 . 15 1 1 A 209 209 PRO CB C 209 31.012 31.300 -0.288 1 1 1 . 16 1 1 A 2 2 ARG C C 2 175.857 174.129 1.728 1 1 2 . 16 1 1 A 2 2 ARG CA C 2 55.872 54.944 0.928 1 1 3 . 16 1 1 A 2 2 ARG CB C 2 29.983 32.370 -2.387 1 1 5 . 16 1 1 A 3 3 ILE H H 3 8.238 8.991 -0.753 1 1 9 . 16 1 1 A 3 3 ILE C C 3 175.763 174.516 1.247 1 1 10 . 16 1 1 A 3 3 ILE CA C 3 60.779 60.877 -0.098 1 1 11 . 16 1 1 A 3 3 ILE CB C 3 37.664 39.761 -2.097 1 1 15 . 16 1 1 A 3 3 ILE N N 3 122.580 126.133 -3.553 1 1 16 . 16 1 1 A 4 4 MET H H 4 8.261 8.962 -0.701 1 1 17 . 16 1 1 A 4 4 MET C C 4 175.660 174.696 0.964 1 1 18 . 16 1 1 A 4 4 MET CA C 4 54.893 54.461 0.432 1 1 19 . 16 1 1 A 4 4 MET CB C 4 32.060 35.547 -3.487 1 1 22 . 16 1 1 A 4 4 MET N N 4 123.988 127.787 -3.799 1 1 23 . 16 1 1 A 5 5 LYS H H 5 8.041 8.639 -0.598 1 1 24 . 16 1 1 A 5 5 LYS C C 5 175.850 175.477 0.373 1 1 25 . 16 1 1 A 5 5 LYS CA C 5 56.081 55.705 0.376 1 1 26 . 16 1 1 A 5 5 LYS CB C 5 32.220 32.313 -0.093 1 1 29 . 16 1 1 A 5 5 LYS N N 5 122.015 124.532 -2.517 1 1 30 . 16 1 1 A 6 6 ALA H H 6 8.042 8.706 -0.664 1 1 34 . 16 1 1 A 6 6 ALA C C 6 177.160 177.158 0.002 1 1 35 . 16 1 1 A 6 6 ALA CA C 6 52.109 51.864 0.245 1 1 36 . 16 1 1 A 6 6 ALA CB C 6 18.637 17.364 1.273 1 1 37 . 16 1 1 A 6 6 ALA N N 6 123.943 129.679 -5.736 1 1 38 . 16 1 1 A 7 7 ILE H H 7 7.916 8.281 -0.365 1 1 42 . 16 1 1 A 7 7 ILE C C 7 175.611 175.290 0.321 1 1 43 . 16 1 1 A 7 7 ILE CA C 7 61.181 62.532 -1.351 1 1 44 . 16 1 1 A 7 7 ILE CB C 7 37.910 41.090 -3.180 1 1 48 . 16 1 1 A 7 7 ILE N N 7 118.380 122.625 -4.245 1 1 49 . 16 1 1 A 8 8 PHE H H 8 8.167 7.704 0.463 1 1 50 . 16 1 1 A 8 8 PHE C C 8 175.363 173.214 2.149 1 1 51 . 16 1 1 A 8 8 PHE CA C 8 57.286 57.914 -0.628 1 1 52 . 16 1 1 A 8 8 PHE CB C 8 39.008 42.424 -3.416 1 1 53 . 16 1 1 A 8 8 PHE N N 8 121.971 120.253 1.718 1 1 54 . 16 1 1 A 9 9 VAL H H 9 7.872 8.382 -0.510 1 1 61 . 16 1 1 A 9 9 VAL C C 9 175.405 175.245 0.160 1 1 62 . 16 1 1 A 9 9 VAL CA C 9 61.662 61.111 0.551 1 1 63 . 16 1 1 A 9 9 VAL CB C 9 32.026 33.601 -1.575 1 1 66 . 16 1 1 A 9 9 VAL N N 9 120.864 124.111 -3.247 1 1 67 . 16 1 1 A 10 10 LEU H H 10 8.077 8.582 -0.505 1 1 74 . 16 1 1 A 10 10 LEU C C 10 176.652 176.595 0.057 1 1 75 . 16 1 1 A 10 10 LEU CA C 10 54.856 55.535 -0.679 1 1 76 . 16 1 1 A 10 10 LEU CB C 10 41.401 43.697 -2.296 1 1 80 . 16 1 1 A 10 10 LEU N N 10 124.826 126.555 -1.729 1 1 81 . 16 1 1 A 11 11 ASN H H 11 8.177 7.617 0.560 1 1 82 . 16 1 1 A 11 11 ASN C C 11 174.394 175.268 -0.874 1 1 83 . 16 1 1 A 11 11 ASN CA C 11 52.704 53.542 -0.838 1 1 84 . 16 1 1 A 11 11 ASN CB C 11 38.468 38.590 -0.122 1 1 85 . 16 1 1 A 11 11 ASN N N 11 119.029 117.017 2.012 1 1 86 . 16 1 1 A 12 12 ALA H H 12 7.991 8.546 -0.555 1 1 90 . 16 1 1 A 12 12 ALA C C 12 176.649 175.972 0.677 1 1 91 . 16 1 1 A 12 12 ALA CA C 12 51.950 50.432 1.518 1 1 92 . 16 1 1 A 12 12 ALA CB C 12 18.659 20.508 -1.849 1 1 93 . 16 1 1 A 12 12 ALA N N 12 123.695 123.887 -0.192 1 1 94 . 16 1 1 A 13 13 ALA H H 13 8.083 8.374 -0.291 1 1 95 . 16 1 1 A 13 13 ALA C C 13 175.395 176.040 -0.645 1 1 96 . 16 1 1 A 13 13 ALA CA C 13 49.797 49.561 0.236 1 1 97 . 16 1 1 A 13 13 ALA CB C 13 17.486 19.477 -1.991 1 1 98 . 16 1 1 A 13 13 ALA N N 13 124.281 126.811 -2.530 1 1 99 . 16 1 1 A 14 14 PRO C C 14 176.641 176.488 0.153 1 1 100 . 16 1 1 A 14 14 PRO CA C 14 62.675 64.589 -1.914 1 1 101 . 16 1 1 A 14 14 PRO CB C 14 31.000 32.175 -1.175 1 1 103 . 16 1 1 A 15 15 LYS H H 15 8.283 7.638 0.645 1 1 104 . 16 1 1 A 15 15 LYS C C 15 175.683 174.299 1.384 1 1 105 . 16 1 1 A 15 15 LYS CA C 15 55.429 55.465 -0.036 1 1 106 . 16 1 1 A 15 15 LYS CB C 15 32.246 35.396 -3.150 1 1 109 . 16 1 1 A 15 15 LYS N N 15 119.069 116.834 2.235 1 1 110 . 16 1 1 A 16 16 ASP H H 16 7.880 8.865 -0.985 1 1 111 . 16 1 1 A 16 16 ASP C C 16 175.419 175.089 0.330 1 1 112 . 16 1 1 A 16 16 ASP CA C 16 54.413 53.924 0.489 1 1 113 . 16 1 1 A 16 16 ASP CB C 16 40.224 41.463 -1.239 1 1 114 . 16 1 1 A 16 16 ASP N N 16 119.625 126.979 -7.354 1 1 115 . 16 1 1 A 17 17 ASN H H 17 7.973 8.969 -0.996 1 1 116 . 16 1 1 A 17 17 ASN C C 17 174.231 174.671 -0.440 1 1 117 . 16 1 1 A 17 17 ASN CA C 17 53.948 52.301 1.647 1 1 118 . 16 1 1 A 17 17 ASN CB C 17 37.009 41.539 -4.530 1 1 119 . 16 1 1 A 17 17 ASN N N 17 118.063 123.929 -5.866 1 1 120 . 16 1 1 A 18 18 THR H H 18 7.318 8.946 -1.628 1 1 121 . 16 1 1 A 18 18 THR C C 18 172.323 172.478 -0.155 1 1 122 . 16 1 1 A 18 18 THR CA C 18 60.153 59.692 0.461 1 1 123 . 16 1 1 A 18 18 THR CB C 18 71.534 72.235 -0.701 1 1 125 . 16 1 1 A 18 18 THR N N 18 109.092 114.618 -5.526 1 1 126 . 16 1 1 A 19 19 TRP H H 19 8.541 8.879 -0.338 1 1 127 . 16 1 1 A 19 19 TRP C C 19 175.969 174.249 1.720 1 1 128 . 16 1 1 A 19 19 TRP CA C 19 55.700 55.365 0.335 1 1 129 . 16 1 1 A 19 19 TRP CB C 19 31.471 32.989 -1.518 1 1 130 . 16 1 1 A 19 19 TRP N N 19 121.992 126.360 -4.368 1 1 131 . 16 1 1 A 20 20 TYR H H 20 8.691 8.621 0.070 1 1 132 . 16 1 1 A 20 20 TYR C C 20 173.684 174.152 -0.468 1 1 133 . 16 1 1 A 20 20 TYR CA C 20 55.805 55.906 -0.101 1 1 134 . 16 1 1 A 20 20 TYR CB C 20 40.513 42.004 -1.491 1 1 135 . 16 1 1 A 20 20 TYR N N 20 116.519 129.283 -12.764 1 1 136 . 16 1 1 A 21 21 ALA H H 21 8.876 7.916 0.960 1 1 137 . 16 1 1 A 21 21 ALA C C 21 175.395 175.255 0.140 1 1 138 . 16 1 1 A 21 21 ALA CA C 21 50.970 50.623 0.347 1 1 139 . 16 1 1 A 21 21 ALA CB C 21 22.142 22.337 -0.195 1 1 140 . 16 1 1 A 21 21 ALA N N 21 119.359 127.390 -8.031 1 1 141 . 16 1 1 A 22 22 GLY H H 22 8.613 7.682 0.931 1 1 142 . 16 1 1 A 22 22 GLY C C 22 171.458 171.192 0.266 1 1 143 . 16 1 1 A 22 22 GLY CA C 22 45.608 45.334 0.274 1 1 144 . 16 1 1 A 22 22 GLY N N 22 106.678 105.449 1.229 1 1 145 . 16 1 1 A 23 23 GLY H H 23 7.911 8.150 -0.239 1 1 146 . 16 1 1 A 23 23 GLY C C 23 170.563 172.313 -1.750 1 1 147 . 16 1 1 A 23 23 GLY CA C 23 44.026 44.815 -0.789 1 1 148 . 16 1 1 A 23 23 GLY N N 23 103.399 108.227 -4.828 1 1 149 . 16 1 1 A 24 24 LYS H H 24 9.001 9.479 -0.478 1 1 150 . 16 1 1 A 24 24 LYS C C 24 172.965 174.087 -1.122 1 1 151 . 16 1 1 A 24 24 LYS CA C 24 54.062 54.196 -0.134 1 1 152 . 16 1 1 A 24 24 LYS CB C 24 36.774 36.520 0.254 1 1 156 . 16 1 1 A 24 24 LYS N N 24 116.402 119.281 -2.879 1 1 157 . 16 1 1 A 25 25 LEU H H 25 8.587 9.266 -0.679 1 1 164 . 16 1 1 A 25 25 LEU C C 25 175.205 174.965 0.240 1 1 165 . 16 1 1 A 25 25 LEU CA C 25 53.446 53.336 0.110 1 1 166 . 16 1 1 A 25 25 LEU CB C 25 46.287 46.577 -0.290 1 1 170 . 16 1 1 A 25 25 LEU N N 25 119.932 122.321 -2.389 1 1 171 . 16 1 1 A 26 26 GLY H H 26 8.637 8.424 0.213 1 1 172 . 16 1 1 A 26 26 GLY C C 26 170.804 172.113 -1.309 1 1 173 . 16 1 1 A 26 26 GLY CA C 26 45.669 45.108 0.561 1 1 174 . 16 1 1 A 26 26 GLY N N 26 108.136 111.455 -3.319 1 1 175 . 16 1 1 A 27 27 TRP H H 27 8.642 8.549 0.093 1 1 177 . 16 1 1 A 27 27 TRP C C 27 174.820 176.181 -1.361 1 1 178 . 16 1 1 A 27 27 TRP CB C 27 30.883 32.330 -1.447 1 1 179 . 16 1 1 A 27 27 TRP N N 27 120.887 120.806 0.081 1 1 181 . 16 1 1 A 32 32 ASP C C 32 176.315 177.918 -1.603 1 1 182 . 16 1 1 A 32 32 ASP CA C 32 53.737 57.172 -3.435 1 1 183 . 16 1 1 A 32 32 ASP CB C 32 41.230 41.458 -0.228 1 1 184 . 16 1 1 A 33 33 THR H H 33 8.190 7.970 0.220 1 1 188 . 16 1 1 A 33 33 THR C C 33 175.291 174.575 0.716 1 1 189 . 16 1 1 A 33 33 THR CA C 33 61.909 63.417 -1.508 1 1 190 . 16 1 1 A 33 33 THR CB C 33 68.961 69.439 -0.478 1 1 192 . 16 1 1 A 33 33 THR N N 33 114.235 109.321 4.914 1 1 193 . 16 1 1 A 34 34 GLY H H 34 8.341 7.786 0.555 1 1 194 . 16 1 1 A 34 34 GLY C C 34 173.766 173.325 0.441 1 1 195 . 16 1 1 A 34 34 GLY CA C 34 44.941 44.614 0.327 1 1 196 . 16 1 1 A 34 34 GLY N N 34 110.678 109.734 0.944 1 1 197 . 16 1 1 A 35 35 PHE H H 35 7.945 8.434 -0.489 1 1 198 . 16 1 1 A 35 35 PHE C C 35 175.411 174.480 0.931 1 1 199 . 16 1 1 A 35 35 PHE CA C 35 57.921 57.738 0.183 1 1 200 . 16 1 1 A 35 35 PHE CB C 35 38.806 39.894 -1.088 1 1 201 . 16 1 1 A 35 35 PHE N N 35 120.533 119.908 0.625 1 1 202 . 16 1 1 A 36 36 TYR H H 36 7.967 8.888 -0.921 1 1 203 . 16 1 1 A 36 36 TYR C C 36 176.104 175.086 1.018 1 1 204 . 16 1 1 A 36 36 TYR CA C 36 57.568 55.633 1.935 1 1 205 . 16 1 1 A 36 36 TYR CB C 36 37.727 40.398 -2.671 1 1 206 . 16 1 1 A 36 36 TYR N N 36 120.254 118.432 1.822 1 1 207 . 16 1 1 A 37 37 GLY H H 37 7.666 8.652 -0.986 1 1 208 . 16 1 1 A 37 37 GLY C C 37 173.794 174.605 -0.811 1 1 209 . 16 1 1 A 37 37 GLY CA C 37 45.007 44.201 0.806 1 1 210 . 16 1 1 A 37 37 GLY N N 37 108.995 111.504 -2.509 1 1 211 . 16 1 1 A 38 38 ASN H H 38 8.109 9.086 -0.977 1 1 212 . 16 1 1 A 38 38 ASN C C 38 175.612 175.761 -0.149 1 1 213 . 16 1 1 A 38 38 ASN CA C 38 52.954 54.822 -1.868 1 1 214 . 16 1 1 A 38 38 ASN CB C 38 38.425 38.937 -0.512 1 1 215 . 16 1 1 A 38 38 ASN N N 38 118.603 116.664 1.939 1 1 216 . 16 1 1 A 39 39 GLY H H 39 8.202 7.637 0.565 1 1 217 . 16 1 1 A 39 39 GLY C C 39 173.958 172.762 1.196 1 1 218 . 16 1 1 A 39 39 GLY CA C 39 45.012 44.967 0.045 1 1 219 . 16 1 1 A 39 39 GLY N N 39 108.897 106.296 2.601 1 1 220 . 16 1 1 A 40 40 PHE H H 40 7.960 9.041 -1.081 1 1 221 . 16 1 1 A 40 40 PHE C C 40 175.653 176.088 -0.435 1 1 222 . 16 1 1 A 40 40 PHE CA C 40 57.556 56.906 0.650 1 1 223 . 16 1 1 A 40 40 PHE CB C 40 38.513 39.639 -1.126 1 1 224 . 16 1 1 A 40 40 PHE N N 40 119.829 126.635 -6.806 1 1 225 . 16 1 1 A 41 41 GLN H H 41 8.173 7.961 0.212 1 1 226 . 16 1 1 A 41 41 GLN C C 41 175.234 177.437 -2.203 1 1 227 . 16 1 1 A 41 41 GLN CA C 41 55.488 56.449 -0.961 1 1 228 . 16 1 1 A 41 41 GLN CB C 41 28.523 30.551 -2.028 1 1 230 . 16 1 1 A 41 41 GLN N N 41 120.810 117.230 3.580 1 1 231 . 16 1 1 A 42 42 ASN H H 42 8.193 8.254 -0.061 1 1 232 . 16 1 1 A 42 42 ASN C C 42 174.618 178.080 -3.462 1 1 233 . 16 1 1 A 42 42 ASN CA C 42 52.924 56.699 -3.775 1 1 234 . 16 1 1 A 42 42 ASN CB C 42 38.333 39.130 -0.797 1 1 235 . 16 1 1 A 42 42 ASN N N 42 119.679 118.620 1.059 1 1 236 . 16 1 1 A 43 43 ASN H H 43 8.255 8.489 -0.234 1 1 237 . 16 1 1 A 43 43 ASN C C 43 173.873 176.876 -3.003 1 1 238 . 16 1 1 A 43 43 ASN CA C 43 52.919 55.606 -2.687 1 1 239 . 16 1 1 A 43 43 ASN CB C 43 38.580 38.018 0.562 1 1 240 . 16 1 1 A 43 43 ASN N N 43 119.773 117.433 2.340 1 1 241 . 16 1 1 A 44 44 ASN H H 44 7.865 8.046 -0.181 1 1 242 . 16 1 1 A 44 44 ASN C C 44 175.518 175.478 0.040 1 1 243 . 16 1 1 A 44 44 ASN CA C 44 54.528 52.900 1.628 1 1 244 . 16 1 1 A 44 44 ASN CB C 44 40.170 38.889 1.281 1 1 246 . 16 1 1 A 44 44 ASN N N 44 124.152 114.420 9.732 1 1 247 . 16 1 1 A 46 46 PRO C C 46 177.228 175.431 1.797 1 1 248 . 16 1 1 A 46 46 PRO CA C 46 62.794 62.811 -0.017 1 1 249 . 16 1 1 A 46 46 PRO CB C 46 31.283 29.643 1.640 1 1 251 . 16 1 1 A 47 47 THR H H 47 8.165 7.891 0.274 1 1 255 . 16 1 1 A 47 47 THR C C 47 174.573 174.368 0.205 1 1 256 . 16 1 1 A 47 47 THR CA C 47 61.346 62.889 -1.543 1 1 257 . 16 1 1 A 47 47 THR CB C 47 69.573 71.048 -1.475 1 1 259 . 16 1 1 A 47 47 THR N N 47 114.265 115.701 -1.436 1 1 260 . 16 1 1 A 48 48 ARG H H 48 8.237 7.735 0.502 1 1 261 . 16 1 1 A 48 48 ARG C C 48 175.898 175.683 0.215 1 1 262 . 16 1 1 A 48 48 ARG CA C 48 55.717 56.277 -0.560 1 1 263 . 16 1 1 A 48 48 ARG CB C 48 30.151 30.761 -0.610 1 1 266 . 16 1 1 A 48 48 ARG N N 48 122.795 122.195 0.600 1 1 267 . 16 1 1 A 49 49 ASN H H 49 8.369 8.670 -0.301 1 1 268 . 16 1 1 A 49 49 ASN C C 49 174.560 174.170 0.390 1 1 269 . 16 1 1 A 49 49 ASN CA C 49 53.005 51.964 1.041 1 1 270 . 16 1 1 A 49 49 ASN CB C 49 38.761 41.045 -2.284 1 1 271 . 16 1 1 A 49 49 ASN N N 49 119.837 122.727 -2.890 1 1 272 . 16 1 1 A 50 50 ASP H H 50 8.192 8.789 -0.597 1 1 273 . 16 1 1 A 50 50 ASP C C 50 175.699 175.059 0.640 1 1 274 . 16 1 1 A 50 50 ASP CA C 50 54.289 53.170 1.119 1 1 275 . 16 1 1 A 50 50 ASP CB C 50 41.264 43.441 -2.177 1 1 276 . 16 1 1 A 50 50 ASP N N 50 120.403 121.138 -0.735 1 1 277 . 16 1 1 A 51 51 GLN H H 51 8.428 8.737 -0.309 1 1 278 . 16 1 1 A 51 51 GLN C C 51 175.186 174.893 0.293 1 1 279 . 16 1 1 A 51 51 GLN CA C 51 54.512 54.578 -0.066 1 1 280 . 16 1 1 A 51 51 GLN CB C 51 30.424 30.514 -0.090 1 1 282 . 16 1 1 A 51 51 GLN N N 51 118.959 122.290 -3.331 1 1 289 . 16 1 1 A 52 52 LEU C C 52 176.018 175.497 0.521 1 1 290 . 16 1 1 A 52 52 LEU CA C 52 54.332 53.020 1.312 1 1 291 . 16 1 1 A 52 52 LEU CB C 52 43.022 46.020 -2.998 1 1 294 . 16 1 1 A 53 53 GLY H H 53 8.639 8.612 0.027 1 1 295 . 16 1 1 A 53 53 GLY C C 53 171.931 171.744 0.187 1 1 296 . 16 1 1 A 53 53 GLY CA C 53 43.501 44.550 -1.049 1 1 297 . 16 1 1 A 53 53 GLY N N 53 109.964 106.834 3.130 1 1 298 . 16 1 1 A 54 54 ALA H H 54 8.881 8.663 0.218 1 1 299 . 16 1 1 A 54 54 ALA C C 54 175.543 176.786 -1.243 1 1 300 . 16 1 1 A 54 54 ALA CA C 54 50.710 50.280 0.430 1 1 301 . 16 1 1 A 54 54 ALA CB C 54 22.914 22.361 0.553 1 1 302 . 16 1 1 A 54 54 ALA N N 54 120.413 122.894 -2.481 1 1 303 . 16 1 1 A 55 55 GLY H H 55 8.346 8.595 -0.249 1 1 304 . 16 1 1 A 55 55 GLY C C 55 170.960 172.014 -1.054 1 1 305 . 16 1 1 A 55 55 GLY CA C 55 46.704 45.311 1.393 1 1 306 . 16 1 1 A 55 55 GLY N N 55 104.688 107.608 -2.920 1 1 307 . 16 1 1 A 56 56 ALA H H 56 9.116 8.523 0.593 1 1 308 . 16 1 1 A 56 56 ALA C C 56 176.472 176.800 -0.328 1 1 309 . 16 1 1 A 56 56 ALA CA C 56 49.638 50.997 -1.359 1 1 310 . 16 1 1 A 56 56 ALA CB C 56 22.275 21.302 0.973 1 1 311 . 16 1 1 A 56 56 ALA N N 56 120.608 123.013 -2.405 1 1 312 . 16 1 1 A 57 57 PHE H H 57 8.688 8.426 0.262 1 1 313 . 16 1 1 A 57 57 PHE C C 57 172.816 173.041 -0.225 1 1 314 . 16 1 1 A 57 57 PHE CA C 57 56.066 55.291 0.775 1 1 315 . 16 1 1 A 57 57 PHE CB C 57 41.770 41.499 0.271 1 1 316 . 16 1 1 A 57 57 PHE N N 57 120.027 114.967 5.060 1 1 317 . 16 1 1 A 58 58 GLY H H 58 9.034 9.366 -0.332 1 1 318 . 16 1 1 A 58 58 GLY C C 58 170.860 172.036 -1.176 1 1 319 . 16 1 1 A 58 58 GLY CA C 58 44.954 44.609 0.345 1 1 320 . 16 1 1 A 58 58 GLY N N 58 105.817 107.027 -1.210 1 1 321 . 16 1 1 A 59 59 GLY H H 59 8.382 9.352 -0.970 1 1 322 . 16 1 1 A 59 59 GLY C C 59 169.284 171.692 -2.408 1 1 323 . 16 1 1 A 59 59 GLY CA C 59 45.840 44.873 0.967 1 1 324 . 16 1 1 A 59 59 GLY N N 59 109.059 113.222 -4.163 1 1 325 . 16 1 1 A 60 60 TYR H H 60 8.430 9.318 -0.888 1 1 326 . 16 1 1 A 60 60 TYR C C 60 173.453 174.354 -0.901 1 1 327 . 16 1 1 A 60 60 TYR CA C 60 55.282 56.049 -0.767 1 1 328 . 16 1 1 A 60 60 TYR CB C 60 41.712 41.868 -0.156 1 1 329 . 16 1 1 A 60 60 TYR N N 60 118.352 123.666 -5.314 1 1 330 . 16 1 1 A 61 61 GLN H H 61 8.833 8.574 0.259 1 1 331 . 16 1 1 A 61 61 GLN C C 61 174.365 175.466 -1.101 1 1 332 . 16 1 1 A 61 61 GLN CA C 61 54.125 56.077 -1.952 1 1 333 . 16 1 1 A 61 61 GLN CB C 61 28.033 30.555 -2.522 1 1 335 . 16 1 1 A 61 61 GLN N N 61 129.628 124.879 4.749 1 1 336 . 16 1 1 A 62 62 VAL H H 62 8.714 8.524 0.190 1 1 343 . 16 1 1 A 62 62 VAL C C 62 175.758 174.520 1.238 1 1 344 . 16 1 1 A 62 62 VAL CA C 62 64.649 61.530 3.119 1 1 345 . 16 1 1 A 62 62 VAL CB C 62 31.900 32.820 -0.920 1 1 348 . 16 1 1 A 62 62 VAL N N 62 127.666 124.374 3.292 1 1 349 . 16 1 1 A 63 63 ASN H H 63 8.062 7.847 0.215 1 1 350 . 16 1 1 A 63 63 ASN C C 63 172.827 172.917 -0.090 1 1 351 . 16 1 1 A 63 63 ASN CA C 63 51.575 51.755 -0.180 1 1 352 . 16 1 1 A 63 63 ASN CB C 63 37.194 42.234 -5.040 1 1 353 . 16 1 1 A 63 63 ASN N N 63 116.310 118.078 -1.768 1 1 354 . 16 1 1 A 64 64 PRO C C 64 175.071 175.985 -0.914 1 1 355 . 16 1 1 A 64 64 PRO CA C 64 65.296 62.414 2.882 1 1 356 . 16 1 1 A 64 64 PRO CB C 64 30.428 29.282 1.146 1 1 357 . 16 1 1 A 65 65 TYR H H 65 7.873 8.644 -0.771 1 1 358 . 16 1 1 A 65 65 TYR C C 65 175.145 174.839 0.306 1 1 359 . 16 1 1 A 65 65 TYR CA C 65 56.125 58.536 -2.411 1 1 360 . 16 1 1 A 65 65 TYR CB C 65 39.189 40.805 -1.616 1 1 361 . 16 1 1 A 65 65 TYR N N 65 112.894 122.956 -10.062 1 1 362 . 16 1 1 A 66 66 LEU H H 66 7.308 7.596 -0.288 1 1 369 . 16 1 1 A 66 66 LEU C C 66 173.866 174.569 -0.703 1 1 370 . 16 1 1 A 66 66 LEU CA C 66 53.431 53.769 -0.338 1 1 371 . 16 1 1 A 66 66 LEU CB C 66 44.958 44.235 0.723 1 1 375 . 16 1 1 A 66 66 LEU N N 66 120.270 116.512 3.758 1 1 376 . 16 1 1 A 67 67 GLY H H 67 8.855 8.328 0.527 1 1 377 . 16 1 1 A 67 67 GLY C C 67 170.698 171.792 -1.094 1 1 378 . 16 1 1 A 67 67 GLY CA C 67 44.008 44.525 -0.517 1 1 379 . 16 1 1 A 67 67 GLY N N 67 114.388 106.216 8.172 1 1 380 . 16 1 1 A 68 68 PHE H H 68 8.770 8.916 -0.146 1 1 381 . 16 1 1 A 68 68 PHE C C 68 173.386 175.115 -1.729 1 1 382 . 16 1 1 A 68 68 PHE CA C 68 56.507 58.437 -1.930 1 1 383 . 16 1 1 A 68 68 PHE CB C 68 42.428 40.244 2.184 1 1 384 . 16 1 1 A 68 68 PHE N N 68 117.510 119.338 -1.828 1 1 385 . 16 1 1 A 69 69 GLU H H 69 9.079 9.730 -0.651 1 1 386 . 16 1 1 A 69 69 GLU C C 69 174.556 175.073 -0.517 1 1 387 . 16 1 1 A 69 69 GLU CA C 69 54.939 54.984 -0.045 1 1 388 . 16 1 1 A 69 69 GLU CB C 69 33.963 33.062 0.901 1 1 390 . 16 1 1 A 69 69 GLU N N 69 120.562 124.501 -3.939 1 1 391 . 16 1 1 A 70 70 MET H H 70 9.481 9.744 -0.263 1 1 392 . 16 1 1 A 70 70 MET C C 70 174.595 175.920 -1.325 1 1 393 . 16 1 1 A 70 70 MET CA C 70 53.091 54.271 -1.180 1 1 394 . 16 1 1 A 70 70 MET CB C 70 36.159 34.090 2.069 1 1 397 . 16 1 1 A 70 70 MET N N 70 124.928 126.542 -1.614 1 1 398 . 16 1 1 A 71 71 GLY H H 71 8.845 9.004 -0.159 1 1 399 . 16 1 1 A 71 71 GLY C C 71 170.811 171.642 -0.831 1 1 400 . 16 1 1 A 71 71 GLY CA C 71 44.624 44.039 0.585 1 1 401 . 16 1 1 A 71 71 GLY N N 71 108.896 112.579 -3.683 1 1 402 . 16 1 1 A 72 72 TYR H H 72 8.925 9.605 -0.680 1 1 403 . 16 1 1 A 72 72 TYR C C 72 173.278 174.223 -0.945 1 1 404 . 16 1 1 A 72 72 TYR CA C 72 55.912 56.369 -0.457 1 1 405 . 16 1 1 A 72 72 TYR CB C 72 41.611 41.428 0.183 1 1 406 . 16 1 1 A 72 72 TYR N N 72 123.253 121.062 2.191 1 1 407 . 16 1 1 A 73 73 ASP H H 73 8.665 9.130 -0.465 1 1 408 . 16 1 1 A 73 73 ASP C C 73 173.598 175.444 -1.846 1 1 409 . 16 1 1 A 73 73 ASP CA C 73 52.857 53.298 -0.441 1 1 410 . 16 1 1 A 73 73 ASP CB C 73 42.774 42.803 -0.029 1 1 411 . 16 1 1 A 73 73 ASP N N 73 126.178 124.883 1.295 1 1 412 . 16 1 1 A 74 74 TRP H H 74 9.080 8.940 0.140 1 1 413 . 16 1 1 A 74 74 TRP C C 74 174.868 174.668 0.200 1 1 414 . 16 1 1 A 74 74 TRP CB C 74 30.083 32.936 -2.853 1 1 415 . 16 1 1 A 74 74 TRP N N 74 121.824 127.306 -5.482 1 1 416 . 16 1 1 A 78 78 MET C C 78 174.548 174.793 -0.245 1 1 417 . 16 1 1 A 78 78 MET CA C 78 54.388 53.746 0.642 1 1 418 . 16 1 1 A 78 78 MET CB C 78 32.542 37.312 -4.770 1 1 419 . 16 1 1 A 79 79 ALA H H 79 8.105 8.489 -0.384 1 1 420 . 16 1 1 A 79 79 ALA C C 79 176.629 176.511 0.118 1 1 421 . 16 1 1 A 79 79 ALA CA C 79 51.210 50.898 0.312 1 1 422 . 16 1 1 A 79 79 ALA CB C 79 19.106 21.655 -2.549 1 1 423 . 16 1 1 A 79 79 ALA N N 79 125.778 122.512 3.266 1 1 424 . 16 1 1 A 80 80 TYR H H 80 8.035 9.019 -0.984 1 1 425 . 16 1 1 A 80 80 TYR C C 80 175.604 174.794 0.810 1 1 426 . 16 1 1 A 80 80 TYR CA C 80 57.021 59.317 -2.296 1 1 427 . 16 1 1 A 80 80 TYR CB C 80 38.416 41.014 -2.598 1 1 428 . 16 1 1 A 80 80 TYR N N 80 120.045 120.690 -0.645 1 1 429 . 16 1 1 A 81 81 LYS H H 81 8.295 7.855 0.440 1 1 430 . 16 1 1 A 81 81 LYS C C 81 176.647 175.658 0.989 1 1 431 . 16 1 1 A 81 81 LYS CA C 81 56.285 55.154 1.131 1 1 432 . 16 1 1 A 81 81 LYS CB C 81 31.571 34.123 -2.552 1 1 434 . 16 1 1 A 81 81 LYS N N 81 123.191 119.239 3.952 1 1 435 . 16 1 1 A 82 82 GLY H H 82 8.117 8.342 -0.225 1 1 436 . 16 1 1 A 82 82 GLY C C 82 174.010 174.645 -0.635 1 1 437 . 16 1 1 A 82 82 GLY CA C 82 44.982 45.877 -0.895 1 1 438 . 16 1 1 A 82 82 GLY N N 82 110.014 113.853 -3.839 1 1 439 . 16 1 1 A 83 83 SER H H 83 7.938 8.646 -0.708 1 1 440 . 16 1 1 A 83 83 SER C C 83 174.634 175.212 -0.578 1 1 441 . 16 1 1 A 83 83 SER CA C 83 57.685 61.592 -3.907 1 1 442 . 16 1 1 A 83 83 SER CB C 83 63.303 63.304 -0.001 1 1 443 . 16 1 1 A 83 83 SER N N 83 115.655 116.084 -0.429 1 1 444 . 16 1 1 A 84 84 VAL H H 84 8.008 8.092 -0.084 1 1 451 . 16 1 1 A 84 84 VAL C C 84 175.525 174.325 1.200 1 1 452 . 16 1 1 A 84 84 VAL CA C 84 61.769 61.151 0.618 1 1 453 . 16 1 1 A 84 84 VAL CB C 84 31.711 32.239 -0.528 1 1 456 . 16 1 1 A 84 84 VAL N N 84 120.054 117.830 2.224 1 1 457 . 16 1 1 A 85 85 ASP H H 85 8.140 7.813 0.327 1 1 458 . 16 1 1 A 85 85 ASP C C 85 174.740 175.336 -0.596 1 1 459 . 16 1 1 A 85 85 ASP CA C 85 53.983 52.348 1.635 1 1 460 . 16 1 1 A 85 85 ASP CB C 85 40.633 45.494 -4.861 1 1 461 . 16 1 1 A 85 85 ASP N N 85 122.510 120.153 2.357 1 1 462 . 16 1 1 A 86 86 ASN H H 86 7.736 8.595 -0.859 1 1 463 . 16 1 1 A 86 86 ASN C C 86 175.970 176.050 -0.080 1 1 464 . 16 1 1 A 86 86 ASN CA C 86 54.349 54.057 0.292 1 1 465 . 16 1 1 A 86 86 ASN CB C 86 40.490 39.328 1.162 1 1 467 . 16 1 1 A 86 86 ASN N N 86 124.290 118.274 6.016 1 1 468 . 16 1 1 A 87 87 GLY H H 87 8.000 8.315 -0.315 1 1 469 . 16 1 1 A 87 87 GLY C C 87 173.456 173.810 -0.354 1 1 470 . 16 1 1 A 87 87 GLY CA C 87 44.973 44.466 0.507 1 1 471 . 16 1 1 A 87 87 GLY N N 87 113.494 108.522 4.972 1 1 472 . 16 1 1 A 88 88 ALA H H 88 8.024 8.168 -0.144 1 1 473 . 16 1 1 A 88 88 ALA C C 88 176.833 176.687 0.146 1 1 474 . 16 1 1 A 88 88 ALA CA C 88 51.734 52.986 -1.252 1 1 475 . 16 1 1 A 88 88 ALA CB C 88 19.818 21.532 -1.714 1 1 476 . 16 1 1 A 88 88 ALA N N 88 122.676 123.190 -0.514 1 1 477 . 16 1 1 A 91 91 ALA C C 91 174.781 175.173 -0.392 1 1 478 . 16 1 1 A 91 91 ALA CA C 91 50.537 51.229 -0.692 1 1 479 . 16 1 1 A 91 91 ALA CB C 91 21.324 22.790 -1.466 1 1 480 . 16 1 1 A 92 92 GLN H H 92 8.451 8.606 -0.155 1 1 481 . 16 1 1 A 92 92 GLN C C 92 173.557 175.608 -2.051 1 1 482 . 16 1 1 A 92 92 GLN CA C 92 53.380 54.454 -1.074 1 1 484 . 16 1 1 A 92 92 GLN N N 92 116.847 116.800 0.047 1 1 485 . 16 1 1 A 93 93 GLY C C 93 170.631 172.535 -1.904 1 1 486 . 16 1 1 A 93 93 GLY CA C 93 45.718 45.337 0.381 1 1 487 . 16 1 1 A 94 94 VAL H H 94 8.686 9.067 -0.381 1 1 494 . 16 1 1 A 94 94 VAL C C 94 173.698 174.690 -0.992 1 1 495 . 16 1 1 A 94 94 VAL CA C 94 58.997 59.927 -0.930 1 1 496 . 16 1 1 A 94 94 VAL CB C 94 33.311 34.241 -0.930 1 1 499 . 16 1 1 A 94 94 VAL N N 94 118.489 120.538 -2.049 1 1 500 . 16 1 1 A 95 95 GLN H H 95 9.468 8.916 0.552 1 1 501 . 16 1 1 A 95 95 GLN C C 95 174.028 173.643 0.385 1 1 502 . 16 1 1 A 95 95 GLN CA C 95 52.547 53.746 -1.199 1 1 503 . 16 1 1 A 95 95 GLN CB C 95 33.816 32.452 1.364 1 1 505 . 16 1 1 A 95 95 GLN N N 95 122.106 124.719 -2.613 1 1 506 . 16 1 1 A 96 96 LEU H H 96 8.484 8.884 -0.400 1 1 513 . 16 1 1 A 96 96 LEU C C 96 175.322 175.469 -0.147 1 1 514 . 16 1 1 A 96 96 LEU CA C 96 53.736 53.592 0.144 1 1 515 . 16 1 1 A 96 96 LEU CB C 96 41.088 45.184 -4.096 1 1 519 . 16 1 1 A 96 96 LEU N N 96 123.224 123.261 -0.037 1 1 520 . 16 1 1 A 97 97 THR H H 97 9.116 9.073 0.043 1 1 521 . 16 1 1 A 97 97 THR C C 97 173.251 171.945 1.306 1 1 522 . 16 1 1 A 97 97 THR CA C 97 58.931 59.566 -0.635 1 1 523 . 16 1 1 A 97 97 THR CB C 97 72.984 72.439 0.545 1 1 525 . 16 1 1 A 97 97 THR N N 97 112.504 115.807 -3.303 1 1 526 . 16 1 1 A 98 98 ALA H H 98 8.603 8.892 -0.289 1 1 527 . 16 1 1 A 98 98 ALA C C 98 174.948 175.365 -0.417 1 1 528 . 16 1 1 A 98 98 ALA CA C 98 49.980 50.187 -0.207 1 1 529 . 16 1 1 A 98 98 ALA CB C 98 19.157 20.842 -1.685 1 1 530 . 16 1 1 A 98 98 ALA N N 98 121.608 123.756 -2.148 1 1 531 . 16 1 1 A 99 99 LYS H H 99 8.890 9.601 -0.711 1 1 532 . 16 1 1 A 99 99 LYS C C 99 174.294 174.794 -0.500 1 1 533 . 16 1 1 A 99 99 LYS CA C 99 54.019 54.652 -0.633 1 1 534 . 16 1 1 A 99 99 LYS CB C 99 33.018 35.493 -2.475 1 1 538 . 16 1 1 A 99 99 LYS N N 99 124.522 123.974 0.548 1 1 539 . 16 1 1 A 100 100 LEU H H 100 8.985 9.033 -0.048 1 1 546 . 16 1 1 A 100 100 LEU C C 100 175.265 175.081 0.184 1 1 547 . 16 1 1 A 100 100 LEU CA C 100 52.698 52.940 -0.242 1 1 548 . 16 1 1 A 100 100 LEU CB C 100 42.889 44.246 -1.357 1 1 552 . 16 1 1 A 100 100 LEU N N 100 131.876 123.330 8.546 1 1 553 . 16 1 1 A 101 101 GLY H H 101 9.137 8.239 0.898 1 1 554 . 16 1 1 A 101 101 GLY C C 101 170.798 171.457 -0.659 1 1 555 . 16 1 1 A 101 101 GLY CA C 101 44.429 44.195 0.234 1 1 556 . 16 1 1 A 101 101 GLY N N 101 111.928 108.225 3.703 1 1 557 . 16 1 1 A 102 102 TYR H H 102 8.779 8.496 0.283 1 1 558 . 16 1 1 A 102 102 TYR C C 102 173.402 173.350 0.052 1 1 559 . 16 1 1 A 102 102 TYR CA C 102 54.444 56.392 -1.948 1 1 560 . 16 1 1 A 102 102 TYR CB C 102 42.239 42.343 -0.104 1 1 561 . 16 1 1 A 102 102 TYR N N 102 116.664 121.248 -4.584 1 1 562 . 16 1 1 A 103 103 PRO C C 103 175.676 176.236 -0.560 1 1 563 . 16 1 1 A 103 103 PRO CA C 103 61.462 62.428 -0.966 1 1 564 . 16 1 1 A 103 103 PRO CB C 103 30.073 33.415 -3.342 1 1 565 . 16 1 1 A 104 104 ILE H H 104 8.670 8.427 0.243 1 1 569 . 16 1 1 A 104 104 ILE C C 104 176.646 177.151 -0.505 1 1 570 . 16 1 1 A 104 104 ILE CA C 104 62.054 62.086 -0.032 1 1 571 . 16 1 1 A 104 104 ILE CB C 104 37.678 39.007 -1.329 1 1 574 . 16 1 1 A 104 104 ILE N N 104 125.939 119.746 6.193 1 1 575 . 16 1 1 A 105 105 THR H H 105 8.129 8.115 0.014 1 1 576 . 16 1 1 A 105 105 THR C C 105 174.344 175.824 -1.480 1 1 577 . 16 1 1 A 105 105 THR CA C 105 59.176 64.615 -5.439 1 1 578 . 16 1 1 A 105 105 THR CB C 105 71.049 69.444 1.605 1 1 580 . 16 1 1 A 105 105 THR N N 105 109.853 115.432 -5.579 1 1 581 . 16 1 1 A 106 106 ASP H H 106 8.424 8.317 0.107 1 1 582 . 16 1 1 A 106 106 ASP C C 106 175.692 177.013 -1.321 1 1 583 . 16 1 1 A 106 106 ASP CA C 106 56.465 55.095 1.370 1 1 584 . 16 1 1 A 106 106 ASP CB C 106 40.032 43.723 -3.691 1 1 585 . 16 1 1 A 106 106 ASP N N 106 117.156 116.297 0.859 1 1 586 . 16 1 1 A 107 107 ASP H H 107 8.124 8.826 -0.702 1 1 587 . 16 1 1 A 107 107 ASP C C 107 174.174 174.218 -0.044 1 1 588 . 16 1 1 A 107 107 ASP CA C 107 52.907 53.924 -1.017 1 1 589 . 16 1 1 A 107 107 ASP CB C 107 41.661 41.872 -0.211 1 1 590 . 16 1 1 A 107 107 ASP N N 107 113.591 116.089 -2.498 1 1 591 . 16 1 1 A 108 108 LEU H H 108 7.336 7.555 -0.219 1 1 598 . 16 1 1 A 108 108 LEU C C 108 174.321 175.258 -0.937 1 1 599 . 16 1 1 A 108 108 LEU CA C 108 54.449 53.829 0.620 1 1 600 . 16 1 1 A 108 108 LEU CB C 108 44.754 43.973 0.781 1 1 604 . 16 1 1 A 108 108 LEU N N 108 123.244 122.017 1.227 1 1 605 . 16 1 1 A 109 109 ASP H H 109 8.943 9.318 -0.375 1 1 606 . 16 1 1 A 109 109 ASP C C 109 176.248 175.580 0.668 1 1 607 . 16 1 1 A 109 109 ASP CA C 109 52.376 52.918 -0.542 1 1 608 . 16 1 1 A 109 109 ASP CB C 109 42.764 44.698 -1.934 1 1 609 . 16 1 1 A 109 109 ASP N N 109 124.634 123.937 0.697 1 1 610 . 16 1 1 A 110 110 ILE H H 110 8.372 8.955 -0.583 1 1 614 . 16 1 1 A 110 110 ILE C C 110 173.735 174.396 -0.661 1 1 615 . 16 1 1 A 110 110 ILE CA C 110 59.129 59.365 -0.236 1 1 616 . 16 1 1 A 110 110 ILE CB C 110 39.402 40.771 -1.369 1 1 620 . 16 1 1 A 110 110 ILE N N 110 119.135 117.470 1.665 1 1 621 . 16 1 1 A 111 111 TYR H H 111 8.695 9.079 -0.384 1 1 622 . 16 1 1 A 111 111 TYR C C 111 172.838 174.950 -2.112 1 1 623 . 16 1 1 A 111 111 TYR CA C 111 56.182 56.408 -0.226 1 1 624 . 16 1 1 A 111 111 TYR CB C 111 41.489 42.760 -1.271 1 1 625 . 16 1 1 A 111 111 TYR N N 111 121.248 121.511 -0.263 1 1 626 . 16 1 1 A 112 112 THR H H 112 9.172 8.618 0.554 1 1 627 . 16 1 1 A 112 112 THR C C 112 173.850 173.614 0.236 1 1 628 . 16 1 1 A 112 112 THR CA C 112 58.246 61.076 -2.830 1 1 629 . 16 1 1 A 112 112 THR CB C 112 71.676 71.633 0.043 1 1 631 . 16 1 1 A 112 112 THR N N 112 110.671 115.243 -4.572 1 1 632 . 16 1 1 A 113 113 ARG H H 113 8.732 9.144 -0.412 1 1 633 . 16 1 1 A 113 113 ARG C C 113 175.037 174.518 0.519 1 1 634 . 16 1 1 A 113 113 ARG CA C 113 53.995 54.527 -0.532 1 1 635 . 16 1 1 A 113 113 ARG CB C 113 32.266 33.189 -0.923 1 1 638 . 16 1 1 A 113 113 ARG N N 113 120.642 124.427 -3.785 1 1 639 . 16 1 1 A 114 114 LEU H H 114 8.449 8.961 -0.512 1 1 646 . 16 1 1 A 114 114 LEU C C 114 175.812 175.792 0.020 1 1 647 . 16 1 1 A 114 114 LEU CA C 114 53.335 53.878 -0.543 1 1 648 . 16 1 1 A 114 114 LEU CB C 114 45.182 45.606 -0.424 1 1 652 . 16 1 1 A 114 114 LEU N N 114 119.078 123.222 -4.144 1 1 653 . 16 1 1 A 115 115 GLY H H 115 8.232 8.466 -0.234 1 1 654 . 16 1 1 A 115 115 GLY C C 115 171.343 172.494 -1.151 1 1 655 . 16 1 1 A 115 115 GLY CA C 115 46.217 46.167 0.050 1 1 656 . 16 1 1 A 115 115 GLY N N 115 108.966 112.179 -3.213 1 1 657 . 16 1 1 A 116 116 GLY H H 116 8.293 8.374 -0.081 1 1 658 . 16 1 1 A 116 116 GLY C C 116 169.856 172.066 -2.210 1 1 659 . 16 1 1 A 116 116 GLY CA C 116 44.084 44.903 -0.819 1 1 660 . 16 1 1 A 116 116 GLY N N 116 109.676 110.666 -0.990 1 1 661 . 16 1 1 A 117 117 MET H H 117 9.286 9.068 0.218 1 1 662 . 16 1 1 A 117 117 MET C C 117 174.557 174.558 -0.001 1 1 663 . 16 1 1 A 117 117 MET CA C 117 53.258 54.239 -0.981 1 1 664 . 16 1 1 A 117 117 MET CB C 117 37.195 35.773 1.422 1 1 667 . 16 1 1 A 117 117 MET N N 117 120.425 120.322 0.103 1 1 668 . 16 1 1 A 118 118 VAL H H 118 9.062 9.060 0.002 1 1 675 . 16 1 1 A 118 118 VAL C C 118 173.993 174.450 -0.457 1 1 676 . 16 1 1 A 118 118 VAL CA C 118 59.883 60.388 -0.505 1 1 677 . 16 1 1 A 118 118 VAL CB C 118 31.782 35.313 -3.531 1 1 680 . 16 1 1 A 118 118 VAL N N 118 126.948 123.890 3.058 1 1 681 . 16 1 1 A 119 119 TRP H H 119 8.482 9.400 -0.918 1 1 682 . 16 1 1 A 119 119 TRP C C 119 174.608 174.531 0.077 1 1 683 . 16 1 1 A 119 119 TRP CA C 119 53.332 55.639 -2.307 1 1 684 . 16 1 1 A 119 119 TRP CB C 119 33.569 33.419 0.150 1 1 685 . 16 1 1 A 119 119 TRP N N 119 124.631 128.791 -4.160 1 1 686 . 16 1 1 A 120 120 ARG H H 120 9.113 8.569 0.544 1 1 687 . 16 1 1 A 120 120 ARG C C 120 174.951 174.368 0.583 1 1 688 . 16 1 1 A 120 120 ARG CA C 120 54.684 53.914 0.770 1 1 689 . 16 1 1 A 120 120 ARG CB C 120 33.424 34.424 -1.000 1 1 690 . 16 1 1 A 120 120 ARG N N 120 117.899 127.011 -9.112 1 1 691 . 16 1 1 A 121 121 ALA H H 121 9.299 8.636 0.663 1 1 692 . 16 1 1 A 121 121 ALA C C 121 175.954 175.182 0.772 1 1 693 . 16 1 1 A 121 121 ALA CA C 121 50.368 50.531 -0.163 1 1 694 . 16 1 1 A 121 121 ALA CB C 121 21.141 21.923 -0.782 1 1 695 . 16 1 1 A 121 121 ALA N N 121 128.863 123.315 5.548 1 1 696 . 16 1 1 A 122 122 ASP H H 122 8.488 8.500 -0.012 1 1 697 . 16 1 1 A 122 122 ASP C C 122 175.635 175.141 0.494 1 1 698 . 16 1 1 A 122 122 ASP CA C 122 53.891 52.458 1.433 1 1 699 . 16 1 1 A 122 122 ASP CB C 122 42.492 44.135 -1.643 1 1 700 . 16 1 1 A 122 122 ASP N N 122 121.721 120.740 0.981 1 1 701 . 16 1 1 A 123 123 SER H H 123 8.466 8.762 -0.296 1 1 702 . 16 1 1 A 123 123 SER C C 123 174.325 174.268 0.057 1 1 703 . 16 1 1 A 123 123 SER CA C 123 57.325 58.868 -1.543 1 1 704 . 16 1 1 A 123 123 SER CB C 123 63.988 63.728 0.260 1 1 705 . 16 1 1 A 123 123 SER N N 123 117.374 121.724 -4.350 1 1 706 . 16 1 1 A 124 124 LYS H H 124 8.389 8.476 -0.087 1 1 707 . 16 1 1 A 124 124 LYS C C 124 176.840 176.326 0.514 1 1 708 . 16 1 1 A 124 124 LYS CA C 124 56.036 56.041 -0.005 1 1 709 . 16 1 1 A 124 124 LYS CB C 124 32.397 32.886 -0.489 1 1 711 . 16 1 1 A 124 124 LYS N N 124 122.883 123.413 -0.530 1 1 712 . 16 1 1 A 125 125 GLY H H 125 8.281 8.519 -0.238 1 1 713 . 16 1 1 A 125 125 GLY C C 125 173.592 174.615 -1.023 1 1 714 . 16 1 1 A 125 125 GLY CA C 125 44.924 45.472 -0.548 1 1 715 . 16 1 1 A 125 125 GLY N N 125 109.541 109.531 0.010 1 1 716 . 16 1 1 A 126 126 ASN H H 126 8.185 8.941 -0.756 1 1 717 . 16 1 1 A 126 126 ASN C C 126 176.649 174.320 2.329 1 1 718 . 16 1 1 A 126 126 ASN CA C 126 52.763 55.747 -2.984 1 1 719 . 16 1 1 A 126 126 ASN CB C 126 38.439 38.387 0.052 1 1 720 . 16 1 1 A 126 126 ASN N N 126 119.019 123.376 -4.357 1 1 721 . 16 1 1 A 127 127 TYR C C 127 176.913 174.901 2.012 1 1 722 . 16 1 1 A 127 127 TYR CA C 127 57.757 56.561 1.196 1 1 723 . 16 1 1 A 127 127 TYR CB C 127 37.703 41.764 -4.061 1 1 724 . 16 1 1 A 128 128 ALA H H 128 8.050 8.850 -0.800 1 1 728 . 16 1 1 A 128 128 ALA C C 128 177.756 176.411 1.345 1 1 729 . 16 1 1 A 128 128 ALA CA C 128 52.321 50.395 1.926 1 1 730 . 16 1 1 A 128 128 ALA CB C 128 18.273 22.729 -4.456 1 1 731 . 16 1 1 A 128 128 ALA N N 128 124.529 126.921 -2.392 1 1 732 . 16 1 1 A 129 129 SER H H 129 8.063 8.858 -0.795 1 1 733 . 16 1 1 A 129 129 SER C C 129 174.938 174.672 0.266 1 1 734 . 16 1 1 A 129 129 SER CA C 129 58.202 59.931 -1.729 1 1 735 . 16 1 1 A 129 129 SER CB C 129 62.974 64.779 -1.805 1 1 736 . 16 1 1 A 129 129 SER N N 129 114.374 115.314 -0.940 1 1 737 . 16 1 1 A 130 130 THR H H 130 7.875 7.700 0.175 1 1 741 . 16 1 1 A 130 130 THR C C 130 175.198 174.488 0.710 1 1 742 . 16 1 1 A 130 130 THR CA C 130 61.520 59.932 1.588 1 1 743 . 16 1 1 A 130 130 THR CB C 130 69.312 72.652 -3.340 1 1 745 . 16 1 1 A 130 130 THR N N 130 113.608 110.304 3.304 1 1 746 . 16 1 1 A 131 131 GLY H H 131 8.219 8.427 -0.208 1 1 747 . 16 1 1 A 131 131 GLY C C 131 173.979 172.752 1.227 1 1 748 . 16 1 1 A 131 131 GLY CA C 131 44.991 44.413 0.578 1 1 749 . 16 1 1 A 131 131 GLY N N 131 110.848 108.594 2.254 1 1 750 . 16 1 1 A 132 132 VAL H H 132 7.729 8.264 -0.535 1 1 757 . 16 1 1 A 132 132 VAL C C 132 175.988 175.499 0.489 1 1 758 . 16 1 1 A 132 132 VAL CA C 132 61.643 59.642 2.001 1 1 759 . 16 1 1 A 132 132 VAL CB C 132 31.941 35.058 -3.117 1 1 762 . 16 1 1 A 132 132 VAL N N 132 118.932 117.367 1.565 1 1 763 . 16 1 1 A 133 133 SER H H 133 8.224 8.613 -0.389 1 1 764 . 16 1 1 A 133 133 SER C C 133 174.320 175.168 -0.848 1 1 765 . 16 1 1 A 133 133 SER CA C 133 57.756 60.609 -2.853 1 1 766 . 16 1 1 A 133 133 SER CB C 133 63.140 64.030 -0.890 1 1 767 . 16 1 1 A 133 133 SER N N 133 119.260 118.973 0.287 1 1 768 . 16 1 1 A 134 134 ARG H H 134 8.199 7.872 0.327 1 1 769 . 16 1 1 A 134 134 ARG C C 134 175.923 174.529 1.394 1 1 770 . 16 1 1 A 134 134 ARG CA C 134 55.461 55.760 -0.299 1 1 771 . 16 1 1 A 134 134 ARG CB C 134 30.195 29.146 1.049 1 1 774 . 16 1 1 A 134 134 ARG N N 134 123.262 121.434 1.828 1 1 775 . 16 1 1 A 135 135 SER H H 135 8.256 8.957 -0.701 1 1 776 . 16 1 1 A 135 135 SER C C 135 174.360 173.116 1.244 1 1 777 . 16 1 1 A 135 135 SER CA C 135 57.730 58.712 -0.982 1 1 778 . 16 1 1 A 135 135 SER CB C 135 63.275 63.102 0.173 1 1 779 . 16 1 1 A 135 135 SER N N 135 117.155 121.239 -4.084 1 1 780 . 16 1 1 A 136 136 GLU H H 136 8.374 8.614 -0.240 1 1 781 . 16 1 1 A 136 136 GLU C C 136 176.284 174.944 1.340 1 1 782 . 16 1 1 A 136 136 GLU CA C 136 56.082 55.853 0.229 1 1 783 . 16 1 1 A 136 136 GLU CB C 136 29.820 32.002 -2.182 1 1 785 . 16 1 1 A 136 136 GLU N N 136 122.812 126.954 -4.142 1 1 786 . 16 1 1 A 137 137 HIS H H 137 8.118 8.937 -0.819 1 1 787 . 16 1 1 A 137 137 HIS C C 137 173.529 173.298 0.231 1 1 788 . 16 1 1 A 137 137 HIS CA C 137 54.793 54.533 0.260 1 1 789 . 16 1 1 A 137 137 HIS CB C 137 30.191 35.042 -4.851 1 1 790 . 16 1 1 A 137 137 HIS N N 137 118.002 124.100 -6.098 1 1 791 . 16 1 1 A 138 138 ASP H H 138 8.572 8.577 -0.005 1 1 792 . 16 1 1 A 138 138 ASP C C 138 174.940 173.880 1.060 1 1 793 . 16 1 1 A 138 138 ASP CA C 138 53.594 53.090 0.504 1 1 794 . 16 1 1 A 138 138 ASP CB C 138 42.165 44.605 -2.440 1 1 795 . 16 1 1 A 138 138 ASP N N 138 121.536 120.087 1.449 1 1 796 . 16 1 1 A 139 139 THR H H 139 7.857 8.942 -1.085 1 1 797 . 16 1 1 A 139 139 THR C C 139 172.822 173.175 -0.353 1 1 798 . 16 1 1 A 139 139 THR CA C 139 59.197 59.774 -0.577 1 1 799 . 16 1 1 A 139 139 THR CB C 139 71.457 71.590 -0.133 1 1 801 . 16 1 1 A 139 139 THR N N 139 113.598 120.584 -6.986 1 1 802 . 16 1 1 A 140 140 GLY C C 140 169.622 172.117 -2.495 1 1 803 . 16 1 1 A 140 140 GLY CA C 140 44.287 44.655 -0.368 1 1 804 . 16 1 1 A 141 141 VAL H H 141 7.815 8.653 -0.838 1 1 811 . 16 1 1 A 141 141 VAL C C 141 176.038 173.754 2.284 1 1 812 . 16 1 1 A 141 141 VAL CA C 141 59.739 59.747 -0.008 1 1 813 . 16 1 1 A 141 141 VAL CB C 141 33.308 35.163 -1.855 1 1 816 . 16 1 1 A 141 141 VAL N N 141 116.224 122.463 -6.239 1 1 817 . 16 1 1 A 142 142 SER H H 142 9.284 8.834 0.450 1 1 818 . 16 1 1 A 142 142 SER C C 142 171.050 172.122 -1.072 1 1 819 . 16 1 1 A 142 142 SER CB C 142 67.608 66.911 0.697 1 1 820 . 16 1 1 A 142 142 SER N N 142 123.223 121.920 1.303 1 1 821 . 16 1 1 A 143 143 PRO C C 143 174.032 176.321 -2.289 1 1 822 . 16 1 1 A 143 143 PRO CA C 143 62.350 62.721 -0.371 1 1 823 . 16 1 1 A 143 143 PRO CB C 143 31.774 32.472 -0.698 1 1 825 . 16 1 1 A 144 144 VAL H H 144 7.785 8.534 -0.749 1 1 832 . 16 1 1 A 144 144 VAL C C 144 172.826 174.377 -1.551 1 1 833 . 16 1 1 A 144 144 VAL CA C 144 59.770 59.857 -0.087 1 1 834 . 16 1 1 A 144 144 VAL CB C 144 34.407 36.008 -1.601 1 1 837 . 16 1 1 A 144 144 VAL N N 144 120.214 116.659 3.555 1 1 838 . 16 1 1 A 145 145 PHE H H 145 8.623 8.892 -0.269 1 1 839 . 16 1 1 A 145 145 PHE C C 145 173.658 172.672 0.986 1 1 840 . 16 1 1 A 145 145 PHE CA C 145 54.942 55.849 -0.907 1 1 841 . 16 1 1 A 145 145 PHE CB C 145 42.692 42.347 0.345 1 1 842 . 16 1 1 A 145 145 PHE N N 145 123.914 119.121 4.793 1 1 843 . 16 1 1 A 146 146 ALA H H 146 8.886 8.832 0.054 1 1 844 . 16 1 1 A 146 146 ALA C C 146 176.258 175.604 0.654 1 1 845 . 16 1 1 A 146 146 ALA CA C 146 49.734 49.930 -0.196 1 1 846 . 16 1 1 A 146 146 ALA CB C 146 22.244 22.461 -0.217 1 1 847 . 16 1 1 A 146 146 ALA N N 146 125.243 123.753 1.490 1 1 848 . 16 1 1 A 147 147 GLY H H 147 8.470 8.117 0.353 1 1 849 . 16 1 1 A 147 147 GLY C C 147 170.940 172.226 -1.286 1 1 850 . 16 1 1 A 147 147 GLY CA C 147 44.063 44.109 -0.046 1 1 851 . 16 1 1 A 147 147 GLY N N 147 106.669 106.686 -0.017 1 1 852 . 16 1 1 A 148 148 GLY H H 148 8.008 8.321 -0.313 1 1 853 . 16 1 1 A 148 148 GLY C C 148 170.181 172.439 -2.258 1 1 854 . 16 1 1 A 148 148 GLY CA C 148 45.736 45.759 -0.023 1 1 855 . 16 1 1 A 148 148 GLY N N 148 109.475 109.494 -0.019 1 1 856 . 16 1 1 A 149 149 VAL H H 149 8.426 8.459 -0.033 1 1 863 . 16 1 1 A 149 149 VAL C C 149 174.157 174.115 0.042 1 1 864 . 16 1 1 A 149 149 VAL CA C 149 58.200 59.030 -0.830 1 1 865 . 16 1 1 A 149 149 VAL CB C 149 34.464 36.368 -1.904 1 1 868 . 16 1 1 A 149 149 VAL N N 149 112.651 118.448 -5.797 1 1 869 . 16 1 1 A 150 150 GLU H H 150 9.070 9.741 -0.671 1 1 870 . 16 1 1 A 150 150 GLU C C 150 173.892 174.648 -0.756 1 1 871 . 16 1 1 A 150 150 GLU CA C 150 54.617 54.601 0.016 1 1 872 . 16 1 1 A 150 150 GLU CB C 150 32.911 33.477 -0.566 1 1 874 . 16 1 1 A 150 150 GLU N N 150 124.471 119.940 4.531 1 1 875 . 16 1 1 A 151 151 TRP H H 151 9.461 8.364 1.097 1 1 877 . 16 1 1 A 151 151 TRP C C 151 174.370 173.925 0.445 1 1 878 . 16 1 1 A 151 151 TRP CA C 151 54.113 54.671 -0.558 1 1 879 . 16 1 1 A 151 151 TRP CB C 151 31.688 33.000 -1.312 1 1 880 . 16 1 1 A 151 151 TRP N N 151 129.611 119.260 10.351 1 1 882 . 16 1 1 A 152 152 ALA H H 152 8.771 8.487 0.284 1 1 883 . 16 1 1 A 152 152 ALA C C 152 175.079 176.867 -1.788 1 1 884 . 16 1 1 A 152 152 ALA CA C 152 51.417 51.322 0.095 1 1 885 . 16 1 1 A 152 152 ALA CB C 152 17.209 20.206 -2.997 1 1 886 . 16 1 1 A 152 152 ALA N N 152 130.502 125.275 5.227 1 1 887 . 16 1 1 A 153 153 VAL H H 153 7.893 8.611 -0.718 1 1 894 . 16 1 1 A 153 153 VAL C C 153 176.612 175.899 0.713 1 1 895 . 16 1 1 A 153 153 VAL CA C 153 63.600 63.894 -0.294 1 1 896 . 16 1 1 A 153 153 VAL CB C 153 31.280 33.096 -1.816 1 1 899 . 16 1 1 A 153 153 VAL N N 153 124.360 122.632 1.728 1 1 900 . 16 1 1 A 154 154 THR H H 154 7.950 7.590 0.360 1 1 904 . 16 1 1 A 154 154 THR C C 154 173.884 174.248 -0.364 1 1 905 . 16 1 1 A 154 154 THR CA C 154 58.655 60.159 -1.504 1 1 906 . 16 1 1 A 154 154 THR CB C 154 71.262 70.502 0.760 1 1 908 . 16 1 1 A 154 154 THR N N 154 109.176 111.533 -2.357 1 1 909 . 16 1 1 A 155 155 ARG H H 155 8.310 8.570 -0.260 1 1 910 . 16 1 1 A 155 155 ARG C C 155 176.753 175.768 0.985 1 1 911 . 16 1 1 A 155 155 ARG CA C 155 58.456 55.627 2.829 1 1 912 . 16 1 1 A 155 155 ARG CB C 155 29.043 30.096 -1.053 1 1 915 . 16 1 1 A 155 155 ARG N N 155 116.576 123.895 -7.319 1 1 916 . 16 1 1 A 156 156 ASP H H 156 7.783 8.225 -0.442 1 1 917 . 16 1 1 A 156 156 ASP C C 156 174.222 174.752 -0.530 1 1 918 . 16 1 1 A 156 156 ASP CA C 156 53.540 55.027 -1.487 1 1 919 . 16 1 1 A 156 156 ASP CB C 156 42.327 43.900 -1.573 1 1 920 . 16 1 1 A 156 156 ASP N N 156 112.950 120.808 -7.858 1 1 921 . 16 1 1 A 157 157 ILE H H 157 7.233 7.836 -0.603 1 1 925 . 16 1 1 A 157 157 ILE C C 157 174.178 174.532 -0.354 1 1 926 . 16 1 1 A 157 157 ILE CA C 157 59.350 59.780 -0.430 1 1 927 . 16 1 1 A 157 157 ILE CB C 157 38.969 40.442 -1.473 1 1 930 . 16 1 1 A 157 157 ILE N N 157 119.732 120.214 -0.482 1 1 931 . 16 1 1 A 158 158 ALA H H 158 8.729 8.953 -0.224 1 1 932 . 16 1 1 A 158 158 ALA C C 158 176.567 175.716 0.851 1 1 933 . 16 1 1 A 158 158 ALA CA C 158 49.418 50.395 -0.977 1 1 934 . 16 1 1 A 158 158 ALA CB C 158 21.430 23.954 -2.524 1 1 935 . 16 1 1 A 158 158 ALA N N 158 128.564 127.875 0.689 1 1 936 . 16 1 1 A 159 159 THR H H 159 8.972 8.413 0.559 1 1 940 . 16 1 1 A 159 159 THR C C 159 172.213 172.851 -0.638 1 1 941 . 16 1 1 A 159 159 THR CA C 159 59.504 60.769 -1.265 1 1 942 . 16 1 1 A 159 159 THR CB C 159 70.728 70.592 0.136 1 1 944 . 16 1 1 A 159 159 THR N N 159 114.901 114.432 0.469 1 1 945 . 16 1 1 A 160 160 ARG H H 160 8.924 8.829 0.095 1 1 946 . 16 1 1 A 160 160 ARG C C 160 174.097 173.156 0.941 1 1 947 . 16 1 1 A 160 160 ARG CA C 160 53.066 53.931 -0.865 1 1 948 . 16 1 1 A 160 160 ARG CB C 160 32.922 33.789 -0.867 1 1 951 . 16 1 1 A 160 160 ARG N N 160 121.507 124.428 -2.921 1 1 952 . 16 1 1 A 161 161 LEU H H 161 8.611 9.417 -0.806 1 1 959 . 16 1 1 A 161 161 LEU C C 161 174.389 175.120 -0.731 1 1 960 . 16 1 1 A 161 161 LEU CA C 161 53.355 53.691 -0.336 1 1 961 . 16 1 1 A 161 161 LEU CB C 161 44.360 45.266 -0.906 1 1 964 . 16 1 1 A 161 161 LEU N N 161 124.711 127.605 -2.894 1 1 965 . 16 1 1 A 162 162 GLU H H 162 8.746 8.853 -0.107 1 1 966 . 16 1 1 A 162 162 GLU C C 162 173.376 175.388 -2.012 1 1 967 . 16 1 1 A 162 162 GLU CA C 162 53.904 54.972 -1.068 1 1 968 . 16 1 1 A 162 162 GLU CB C 162 33.773 32.381 1.392 1 1 970 . 16 1 1 A 162 162 GLU N N 162 122.300 126.078 -3.778 1 1 971 . 16 1 1 A 163 163 TYR H H 163 8.872 8.645 0.227 1 1 972 . 16 1 1 A 163 163 TYR C C 163 173.425 173.504 -0.079 1 1 973 . 16 1 1 A 163 163 TYR CA C 163 56.192 55.346 0.846 1 1 974 . 16 1 1 A 163 163 TYR CB C 163 40.870 41.195 -0.325 1 1 975 . 16 1 1 A 163 163 TYR N N 163 124.618 118.003 6.615 1 1 976 . 16 1 1 A 171 171 ASP C C 171 175.753 176.410 -0.657 1 1 977 . 16 1 1 A 171 171 ASP CA C 171 53.517 55.342 -1.825 1 1 978 . 16 1 1 A 171 171 ASP CB C 171 41.353 42.952 -1.599 1 1 979 . 16 1 1 A 172 172 ALA H H 172 8.336 7.782 0.554 1 1 983 . 16 1 1 A 172 172 ALA C C 172 178.110 177.439 0.671 1 1 984 . 16 1 1 A 172 172 ALA CA C 172 52.190 52.363 -0.173 1 1 985 . 16 1 1 A 172 172 ALA CB C 172 18.305 20.039 -1.734 1 1 986 . 16 1 1 A 172 172 ALA N N 172 125.294 121.744 3.550 1 1 987 . 16 1 1 A 173 173 GLY H H 173 8.300 8.258 0.042 1 1 988 . 16 1 1 A 173 173 GLY C C 173 174.437 174.418 0.019 1 1 989 . 16 1 1 A 173 173 GLY CA C 173 45.083 45.564 -0.481 1 1 990 . 16 1 1 A 173 173 GLY N N 173 107.268 106.398 0.870 1 1 991 . 16 1 1 A 174 174 THR H H 174 7.754 8.159 -0.405 1 1 992 . 16 1 1 A 174 174 THR C C 174 174.738 176.269 -1.531 1 1 993 . 16 1 1 A 174 174 THR CA C 174 61.310 64.690 -3.380 1 1 994 . 16 1 1 A 174 174 THR CB C 174 69.310 70.451 -1.141 1 1 996 . 16 1 1 A 174 174 THR N N 174 113.472 116.178 -2.706 1 1 997 . 16 1 1 A 175 175 VAL H H 175 7.993 7.947 0.046 1 1 1004 . 16 1 1 A 175 175 VAL C C 175 176.535 176.333 0.202 1 1 1005 . 16 1 1 A 175 175 VAL CA C 175 62.126 65.168 -3.042 1 1 1006 . 16 1 1 A 175 175 VAL CB C 175 31.282 31.541 -0.259 1 1 1009 . 16 1 1 A 175 175 VAL N N 175 121.643 114.500 7.143 1 1 1010 . 16 1 1 A 176 176 GLY H H 176 8.056 8.115 -0.059 1 1 1011 . 16 1 1 A 176 176 GLY C C 176 173.930 174.179 -0.249 1 1 1012 . 16 1 1 A 176 176 GLY CA C 176 44.983 47.020 -2.037 1 1 1013 . 16 1 1 A 176 176 GLY N N 176 110.460 108.948 1.512 1 1 1014 . 16 1 1 A 177 177 THR H H 177 7.520 7.937 -0.417 1 1 1015 . 16 1 1 A 177 177 THR C C 177 173.574 172.819 0.755 1 1 1016 . 16 1 1 A 177 177 THR CA C 177 60.609 59.912 0.697 1 1 1017 . 16 1 1 A 177 177 THR CB C 177 69.506 69.229 0.277 1 1 1019 . 16 1 1 A 177 177 THR N N 177 113.390 113.353 0.037 1 1 1020 . 16 1 1 A 178 178 ARG H H 178 8.261 8.685 -0.424 1 1 1021 . 16 1 1 A 178 178 ARG C C 178 173.932 173.895 0.037 1 1 1022 . 16 1 1 A 178 178 ARG CA C 178 53.683 52.782 0.901 1 1 1023 . 16 1 1 A 178 178 ARG CB C 178 29.224 31.836 -2.612 1 1 1026 . 16 1 1 A 178 178 ARG N N 178 123.906 126.866 -2.960 1 1 1027 . 16 1 1 A 183 183 MET C C 183 174.053 174.402 -0.349 1 1 1028 . 16 1 1 A 183 183 MET CA C 183 53.700 54.436 -0.736 1 1 1029 . 16 1 1 A 183 183 MET CB C 183 35.908 37.070 -1.162 1 1 1032 . 16 1 1 A 184 184 LEU H H 184 8.319 8.611 -0.292 1 1 1033 . 16 1 1 A 184 184 LEU C C 184 175.235 175.610 -0.375 1 1 1034 . 16 1 1 A 184 184 LEU CA C 184 53.120 53.733 -0.613 1 1 1035 . 16 1 1 A 184 184 LEU CB C 184 42.857 43.388 -0.531 1 1 1038 . 16 1 1 A 184 184 LEU N N 184 131.293 123.282 8.011 1 1 1039 . 16 1 1 A 185 185 SER H H 185 9.603 9.096 0.507 1 1 1040 . 16 1 1 A 185 185 SER C C 185 171.293 172.967 -1.674 1 1 1041 . 16 1 1 A 185 185 SER CA C 185 56.504 57.065 -0.561 1 1 1042 . 16 1 1 A 185 185 SER CB C 185 66.585 66.307 0.278 1 1 1043 . 16 1 1 A 185 185 SER N N 185 119.338 122.311 -2.973 1 1 1044 . 16 1 1 A 186 186 LEU H H 186 8.583 8.553 0.030 1 1 1051 . 16 1 1 A 186 186 LEU C C 186 175.328 176.634 -1.306 1 1 1052 . 16 1 1 A 186 186 LEU CA C 186 52.729 53.064 -0.335 1 1 1053 . 16 1 1 A 186 186 LEU CB C 186 44.996 45.317 -0.321 1 1 1056 . 16 1 1 A 186 186 LEU N N 186 122.719 124.060 -1.341 1 1 1057 . 16 1 1 A 187 187 GLY H H 187 9.287 8.281 1.006 1 1 1058 . 16 1 1 A 187 187 GLY C C 187 172.315 172.921 -0.606 1 1 1059 . 16 1 1 A 187 187 GLY CA C 187 43.502 45.309 -1.807 1 1 1060 . 16 1 1 A 187 187 GLY N N 187 110.265 110.590 -0.325 1 1 1061 . 16 1 1 A 188 188 VAL H H 188 8.825 8.590 0.235 1 1 1068 . 16 1 1 A 188 188 VAL C C 188 173.125 174.802 -1.677 1 1 1069 . 16 1 1 A 188 188 VAL CA C 188 59.739 59.386 0.353 1 1 1070 . 16 1 1 A 188 188 VAL CB C 188 34.532 34.560 -0.028 1 1 1073 . 16 1 1 A 188 188 VAL N N 188 119.161 116.530 2.631 1 1 1074 . 16 1 1 A 189 189 SER H H 189 9.051 9.027 0.024 1 1 1075 . 16 1 1 A 189 189 SER C C 189 171.698 172.823 -1.125 1 1 1076 . 16 1 1 A 189 189 SER CA C 189 55.997 56.755 -0.758 1 1 1077 . 16 1 1 A 189 189 SER CB C 189 66.094 66.946 -0.852 1 1 1078 . 16 1 1 A 189 189 SER N N 189 117.810 118.557 -0.747 1 1 1079 . 16 1 1 A 190 190 TYR H H 190 9.145 8.356 0.789 1 1 1080 . 16 1 1 A 190 190 TYR C C 190 174.063 172.412 1.651 1 1 1081 . 16 1 1 A 190 190 TYR CA C 190 55.375 55.441 -0.066 1 1 1082 . 16 1 1 A 190 190 TYR CB C 190 41.183 41.721 -0.538 1 1 1083 . 16 1 1 A 190 190 TYR N N 190 123.690 117.228 6.462 1 1 1084 . 16 1 1 A 191 191 ARG H H 191 8.211 8.211 0.000 1 1 1085 . 16 1 1 A 191 191 ARG C C 191 174.826 174.648 0.178 1 1 1086 . 16 1 1 A 191 191 ARG CA C 191 54.464 54.112 0.352 1 1 1087 . 16 1 1 A 191 191 ARG CB C 191 30.507 34.578 -4.071 1 1 1090 . 16 1 1 A 191 191 ARG N N 191 125.366 119.651 5.715 1 1 1091 . 16 1 1 A 192 192 PHE H H 192 8.496 9.182 -0.686 1 1 1092 . 16 1 1 A 192 192 PHE C C 192 176.384 175.115 1.269 1 1 1093 . 16 1 1 A 192 192 PHE CA C 192 57.179 56.440 0.739 1 1 1094 . 16 1 1 A 192 192 PHE CB C 192 39.430 44.184 -4.754 1 1 1095 . 16 1 1 A 192 192 PHE N N 192 121.586 117.829 3.757 1 1 1096 . 16 1 1 A 193 193 GLY H H 193 8.643 8.532 0.111 1 1 1097 . 16 1 1 A 193 193 GLY C C 193 174.466 172.096 2.370 1 1 1098 . 16 1 1 A 193 193 GLY CA C 193 45.126 44.948 0.178 1 1 1099 . 16 1 1 A 193 193 GLY N N 193 109.499 108.901 0.598 1 1 1100 . 16 1 1 A 194 194 GLN H H 194 8.512 8.570 -0.058 1 1 1101 . 16 1 1 A 194 194 GLN C C 194 176.201 174.625 1.576 1 1 1102 . 16 1 1 A 194 194 GLN CA C 194 55.433 54.714 0.719 1 1 1103 . 16 1 1 A 194 194 GLN CB C 194 28.729 32.517 -3.788 1 1 1105 . 16 1 1 A 194 194 GLN N N 194 119.448 123.407 -3.959 1 1 1106 . 16 1 1 A 195 195 GLU H H 195 8.530 8.876 -0.346 1 1 1107 . 16 1 1 A 195 195 GLU C C 195 176.151 175.714 0.437 1 1 1108 . 16 1 1 A 195 195 GLU CA C 195 56.256 55.550 0.706 1 1 1109 . 16 1 1 A 195 195 GLU CB C 195 29.486 31.570 -2.084 1 1 1111 . 16 1 1 A 195 195 GLU N N 195 121.959 127.230 -5.271 1 1 1112 . 16 1 1 A 196 196 ASP H H 196 8.253 8.548 -0.295 1 1 1113 . 16 1 1 A 196 196 ASP C C 196 175.667 175.241 0.426 1 1 1114 . 16 1 1 A 196 196 ASP CA C 196 53.981 54.798 -0.817 1 1 1115 . 16 1 1 A 196 196 ASP CB C 196 40.700 41.397 -0.697 1 1 1116 . 16 1 1 A 196 196 ASP N N 196 121.819 122.345 -0.526 1 1 1117 . 16 1 1 A 197 197 ALA H H 197 7.999 8.612 -0.613 1 1 1121 . 16 1 1 A 197 197 ALA C C 197 176.847 176.149 0.698 1 1 1122 . 16 1 1 A 197 197 ALA CA C 197 51.612 50.594 1.018 1 1 1123 . 16 1 1 A 197 197 ALA CB C 197 18.192 20.810 -2.618 1 1 1124 . 16 1 1 A 197 197 ALA N N 197 124.262 128.823 -4.561 1 1 1125 . 16 1 1 A 198 198 ALA H H 198 8.042 8.724 -0.682 1 1 1126 . 16 1 1 A 198 198 ALA C C 198 176.865 176.990 -0.125 1 1 1127 . 16 1 1 A 198 198 ALA CA C 198 49.999 53.396 -3.397 1 1 1128 . 16 1 1 A 198 198 ALA CB C 198 17.327 20.302 -2.975 1 1 1129 . 16 1 1 A 198 198 ALA N N 198 124.724 125.673 -0.949 1 1 1130 . 16 1 1 A 199 199 PRO C C 199 176.727 176.732 -0.005 1 1 1131 . 16 1 1 A 199 199 PRO CA C 199 62.399 62.583 -0.184 1 1 1132 . 16 1 1 A 199 199 PRO CB C 199 30.949 32.092 -1.143 1 1 1135 . 16 1 1 A 200 200 VAL H H 200 8.026 8.433 -0.407 1 1 1142 . 16 1 1 A 200 200 VAL C C 200 176.034 175.536 0.498 1 1 1143 . 16 1 1 A 200 200 VAL CA C 200 61.944 62.364 -0.420 1 1 1144 . 16 1 1 A 200 200 VAL CB C 200 31.734 30.550 1.184 1 1 1147 . 16 1 1 A 200 200 VAL N N 200 120.635 122.651 -2.016 1 1 1148 . 16 1 1 A 201 201 VAL H H 201 7.966 8.378 -0.412 1 1 1155 . 16 1 1 A 201 201 VAL C C 201 175.128 176.555 -1.427 1 1 1156 . 16 1 1 A 201 201 VAL CA C 201 61.249 61.130 0.119 1 1 1157 . 16 1 1 A 201 201 VAL CB C 201 31.917 32.359 -0.442 1 1 1160 . 16 1 1 A 201 201 VAL N N 201 124.053 128.097 -4.044 1 1 1161 . 16 1 1 A 202 202 ALA H H 202 8.159 7.956 0.203 1 1 1162 . 16 1 1 A 202 202 ALA C C 202 175.153 177.810 -2.657 1 1 1163 . 16 1 1 A 202 202 ALA CA C 202 49.742 56.370 -6.628 1 1 1164 . 16 1 1 A 202 202 ALA CB C 202 17.532 19.058 -1.526 1 1 1165 . 16 1 1 A 202 202 ALA N N 202 129.251 124.664 4.587 1 1 1166 . 16 1 1 A 203 203 PRO C C 203 176.273 175.617 0.656 1 1 1167 . 16 1 1 A 203 203 PRO CA C 203 62.324 62.466 -0.142 1 1 1168 . 16 1 1 A 203 203 PRO CB C 203 31.042 32.766 -1.724 1 1 1170 . 16 1 1 A 204 204 ALA H H 204 8.137 8.520 -0.383 1 1 1171 . 16 1 1 A 204 204 ALA C C 204 175.697 176.123 -0.426 1 1 1172 . 16 1 1 A 204 204 ALA CA C 204 49.865 49.511 0.354 1 1 1173 . 16 1 1 A 204 204 ALA CB C 204 17.364 19.584 -2.220 1 1 1174 . 16 1 1 A 204 204 ALA N N 204 125.510 125.312 0.198 1 1 1175 . 16 1 1 A 205 205 PRO C C 205 175.430 176.662 -1.232 1 1 1176 . 16 1 1 A 205 205 PRO CA C 205 62.511 64.041 -1.530 1 1 1177 . 16 1 1 A 205 205 PRO CB C 205 31.056 31.787 -0.731 1 1 1179 . 16 1 1 A 206 206 ALA H H 206 7.847 7.852 -0.005 1 1 1180 . 16 1 1 A 206 206 ALA C C 206 175.565 176.159 -0.594 1 1 1181 . 16 1 1 A 206 206 ALA CA C 206 49.487 51.052 -1.565 1 1 1182 . 16 1 1 A 206 206 ALA CB C 206 18.843 18.480 0.363 1 1 1183 . 16 1 1 A 206 206 ALA N N 206 123.663 122.784 0.879 1 1 1184 . 16 1 1 A 207 207 PRO C C 207 174.397 175.400 -1.003 1 1 1185 . 16 1 1 A 207 207 PRO CA C 207 61.454 62.747 -1.293 1 1 1186 . 16 1 1 A 207 207 PRO CB C 207 31.929 33.058 -1.129 1 1 1187 . 16 1 1 A 208 208 ALA H H 208 7.898 8.186 -0.288 1 1 1188 . 16 1 1 A 208 208 ALA C C 208 175.411 175.033 0.378 1 1 1189 . 16 1 1 A 208 208 ALA CA C 208 49.472 49.395 0.077 1 1 1190 . 16 1 1 A 208 208 ALA CB C 208 19.082 20.379 -1.297 1 1 1191 . 16 1 1 A 208 208 ALA N N 208 127.450 122.114 5.336 1 1 1192 . 16 1 1 A 209 209 PRO C C 209 176.932 177.022 -0.090 1 1 1193 . 16 1 1 A 209 209 PRO CA C 209 62.736 62.458 0.278 1 1 1194 . 16 1 1 A 209 209 PRO CB C 209 31.012 32.474 -1.462 1 1 1 . 17 1 1 A 2 2 ARG C C 2 175.857 176.158 -0.301 1 1 2 . 17 1 1 A 2 2 ARG CA C 2 55.872 55.003 0.869 1 1 3 . 17 1 1 A 2 2 ARG CB C 2 29.983 32.593 -2.610 1 1 5 . 17 1 1 A 3 3 ILE H H 3 8.238 8.418 -0.180 1 1 9 . 17 1 1 A 3 3 ILE C C 3 175.763 175.733 0.030 1 1 10 . 17 1 1 A 3 3 ILE CA C 3 60.779 61.094 -0.315 1 1 11 . 17 1 1 A 3 3 ILE CB C 3 37.664 38.606 -0.942 1 1 15 . 17 1 1 A 3 3 ILE N N 3 122.580 121.241 1.339 1 1 16 . 17 1 1 A 4 4 MET H H 4 8.261 8.774 -0.513 1 1 17 . 17 1 1 A 4 4 MET C C 4 175.660 174.444 1.216 1 1 18 . 17 1 1 A 4 4 MET CA C 4 54.893 54.363 0.530 1 1 19 . 17 1 1 A 4 4 MET CB C 4 32.060 33.746 -1.686 1 1 22 . 17 1 1 A 4 4 MET N N 4 123.988 123.839 0.149 1 1 23 . 17 1 1 A 5 5 LYS H H 5 8.041 7.564 0.477 1 1 24 . 17 1 1 A 5 5 LYS C C 5 175.850 175.413 0.437 1 1 25 . 17 1 1 A 5 5 LYS CA C 5 56.081 54.233 1.848 1 1 26 . 17 1 1 A 5 5 LYS CB C 5 32.220 36.082 -3.862 1 1 29 . 17 1 1 A 5 5 LYS N N 5 122.015 118.455 3.560 1 1 30 . 17 1 1 A 6 6 ALA H H 6 8.042 8.403 -0.361 1 1 34 . 17 1 1 A 6 6 ALA C C 6 177.160 175.903 1.257 1 1 35 . 17 1 1 A 6 6 ALA CA C 6 52.109 51.486 0.623 1 1 36 . 17 1 1 A 6 6 ALA CB C 6 18.637 19.076 -0.439 1 1 37 . 17 1 1 A 6 6 ALA N N 6 123.943 123.332 0.611 1 1 38 . 17 1 1 A 7 7 ILE H H 7 7.916 8.720 -0.804 1 1 42 . 17 1 1 A 7 7 ILE C C 7 175.611 175.436 0.175 1 1 43 . 17 1 1 A 7 7 ILE CA C 7 61.181 60.263 0.918 1 1 44 . 17 1 1 A 7 7 ILE CB C 7 37.910 37.319 0.591 1 1 48 . 17 1 1 A 7 7 ILE N N 7 118.380 124.575 -6.195 1 1 49 . 17 1 1 A 8 8 PHE H H 8 8.167 8.578 -0.411 1 1 50 . 17 1 1 A 8 8 PHE C C 8 175.363 175.876 -0.513 1 1 51 . 17 1 1 A 8 8 PHE CA C 8 57.286 59.020 -1.734 1 1 52 . 17 1 1 A 8 8 PHE CB C 8 39.008 40.371 -1.363 1 1 53 . 17 1 1 A 8 8 PHE N N 8 121.971 128.160 -6.189 1 1 54 . 17 1 1 A 9 9 VAL H H 9 7.872 7.846 0.026 1 1 61 . 17 1 1 A 9 9 VAL C C 9 175.405 174.806 0.599 1 1 62 . 17 1 1 A 9 9 VAL CA C 9 61.662 59.721 1.941 1 1 63 . 17 1 1 A 9 9 VAL CB C 9 32.026 34.156 -2.130 1 1 66 . 17 1 1 A 9 9 VAL N N 9 120.864 117.989 2.875 1 1 67 . 17 1 1 A 10 10 LEU H H 10 8.077 8.794 -0.717 1 1 74 . 17 1 1 A 10 10 LEU C C 10 176.652 177.486 -0.834 1 1 75 . 17 1 1 A 10 10 LEU CA C 10 54.856 56.023 -1.167 1 1 76 . 17 1 1 A 10 10 LEU CB C 10 41.401 44.564 -3.163 1 1 80 . 17 1 1 A 10 10 LEU N N 10 124.826 129.542 -4.716 1 1 81 . 17 1 1 A 11 11 ASN H H 11 8.177 8.639 -0.462 1 1 82 . 17 1 1 A 11 11 ASN C C 11 174.394 175.242 -0.848 1 1 83 . 17 1 1 A 11 11 ASN CA C 11 52.704 54.967 -2.263 1 1 84 . 17 1 1 A 11 11 ASN CB C 11 38.468 39.604 -1.136 1 1 85 . 17 1 1 A 11 11 ASN N N 11 119.029 116.494 2.535 1 1 86 . 17 1 1 A 12 12 ALA H H 12 7.991 7.493 0.498 1 1 90 . 17 1 1 A 12 12 ALA C C 12 176.649 176.114 0.535 1 1 91 . 17 1 1 A 12 12 ALA CA C 12 51.950 50.661 1.289 1 1 92 . 17 1 1 A 12 12 ALA CB C 12 18.659 19.682 -1.023 1 1 93 . 17 1 1 A 12 12 ALA N N 12 123.695 122.285 1.410 1 1 94 . 17 1 1 A 13 13 ALA H H 13 8.083 8.609 -0.526 1 1 95 . 17 1 1 A 13 13 ALA C C 13 175.395 175.947 -0.552 1 1 96 . 17 1 1 A 13 13 ALA CA C 13 49.797 50.675 -0.878 1 1 97 . 17 1 1 A 13 13 ALA CB C 13 17.486 18.753 -1.267 1 1 98 . 17 1 1 A 13 13 ALA N N 13 124.281 127.000 -2.719 1 1 99 . 17 1 1 A 14 14 PRO C C 14 176.641 177.205 -0.564 1 1 100 . 17 1 1 A 14 14 PRO CA C 14 62.675 62.430 0.245 1 1 101 . 17 1 1 A 14 14 PRO CB C 14 31.000 29.596 1.404 1 1 103 . 17 1 1 A 15 15 LYS H H 15 8.283 8.817 -0.534 1 1 104 . 17 1 1 A 15 15 LYS C C 15 175.683 177.983 -2.300 1 1 105 . 17 1 1 A 15 15 LYS CA C 15 55.429 58.213 -2.784 1 1 106 . 17 1 1 A 15 15 LYS CB C 15 32.246 32.556 -0.310 1 1 109 . 17 1 1 A 15 15 LYS N N 15 119.069 125.628 -6.559 1 1 110 . 17 1 1 A 16 16 ASP H H 16 7.880 7.957 -0.077 1 1 111 . 17 1 1 A 16 16 ASP C C 16 175.419 175.099 0.320 1 1 112 . 17 1 1 A 16 16 ASP CA C 16 54.413 53.977 0.436 1 1 113 . 17 1 1 A 16 16 ASP CB C 16 40.224 40.268 -0.044 1 1 114 . 17 1 1 A 16 16 ASP N N 16 119.625 118.123 1.502 1 1 115 . 17 1 1 A 17 17 ASN H H 17 7.973 7.753 0.220 1 1 116 . 17 1 1 A 17 17 ASN C C 17 174.231 174.830 -0.599 1 1 117 . 17 1 1 A 17 17 ASN CA C 17 53.948 51.909 2.039 1 1 118 . 17 1 1 A 17 17 ASN CB C 17 37.009 41.194 -4.185 1 1 119 . 17 1 1 A 17 17 ASN N N 17 118.063 116.989 1.074 1 1 120 . 17 1 1 A 18 18 THR H H 18 7.318 8.543 -1.225 1 1 121 . 17 1 1 A 18 18 THR C C 18 172.323 172.145 0.178 1 1 122 . 17 1 1 A 18 18 THR CA C 18 60.153 60.037 0.116 1 1 123 . 17 1 1 A 18 18 THR CB C 18 71.534 71.830 -0.296 1 1 125 . 17 1 1 A 18 18 THR N N 18 109.092 114.698 -5.606 1 1 126 . 17 1 1 A 19 19 TRP H H 19 8.541 9.094 -0.553 1 1 127 . 17 1 1 A 19 19 TRP C C 19 175.969 175.149 0.820 1 1 128 . 17 1 1 A 19 19 TRP CA C 19 55.700 56.109 -0.409 1 1 129 . 17 1 1 A 19 19 TRP CB C 19 31.471 33.084 -1.613 1 1 130 . 17 1 1 A 19 19 TRP N N 19 121.992 126.967 -4.975 1 1 131 . 17 1 1 A 20 20 TYR H H 20 8.691 9.293 -0.602 1 1 132 . 17 1 1 A 20 20 TYR C C 20 173.684 175.334 -1.650 1 1 133 . 17 1 1 A 20 20 TYR CA C 20 55.805 56.217 -0.412 1 1 134 . 17 1 1 A 20 20 TYR CB C 20 40.513 41.777 -1.264 1 1 135 . 17 1 1 A 20 20 TYR N N 20 116.519 122.534 -6.015 1 1 136 . 17 1 1 A 21 21 ALA H H 21 8.876 8.715 0.161 1 1 137 . 17 1 1 A 21 21 ALA C C 21 175.395 175.910 -0.515 1 1 138 . 17 1 1 A 21 21 ALA CA C 21 50.970 51.234 -0.264 1 1 139 . 17 1 1 A 21 21 ALA CB C 21 22.142 23.393 -1.251 1 1 140 . 17 1 1 A 21 21 ALA N N 21 119.359 124.078 -4.719 1 1 141 . 17 1 1 A 22 22 GLY H H 22 8.613 8.442 0.171 1 1 142 . 17 1 1 A 22 22 GLY C C 22 171.458 172.372 -0.914 1 1 143 . 17 1 1 A 22 22 GLY CA C 22 45.608 46.186 -0.578 1 1 144 . 17 1 1 A 22 22 GLY N N 22 106.678 106.342 0.336 1 1 145 . 17 1 1 A 23 23 GLY H H 23 7.911 8.424 -0.513 1 1 146 . 17 1 1 A 23 23 GLY C C 23 170.563 172.297 -1.734 1 1 147 . 17 1 1 A 23 23 GLY CA C 23 44.026 45.209 -1.183 1 1 148 . 17 1 1 A 23 23 GLY N N 23 103.399 109.251 -5.852 1 1 149 . 17 1 1 A 24 24 LYS H H 24 9.001 9.357 -0.356 1 1 150 . 17 1 1 A 24 24 LYS C C 24 172.965 174.336 -1.371 1 1 151 . 17 1 1 A 24 24 LYS CA C 24 54.062 54.105 -0.043 1 1 152 . 17 1 1 A 24 24 LYS CB C 24 36.774 36.740 0.034 1 1 156 . 17 1 1 A 24 24 LYS N N 24 116.402 118.935 -2.533 1 1 157 . 17 1 1 A 25 25 LEU H H 25 8.587 9.474 -0.887 1 1 164 . 17 1 1 A 25 25 LEU C C 25 175.205 175.189 0.016 1 1 165 . 17 1 1 A 25 25 LEU CA C 25 53.446 53.505 -0.059 1 1 166 . 17 1 1 A 25 25 LEU CB C 25 46.287 46.752 -0.465 1 1 170 . 17 1 1 A 25 25 LEU N N 25 119.932 122.141 -2.209 1 1 171 . 17 1 1 A 26 26 GLY H H 26 8.637 8.548 0.089 1 1 172 . 17 1 1 A 26 26 GLY C C 26 170.804 171.789 -0.985 1 1 173 . 17 1 1 A 26 26 GLY CA C 26 45.669 45.149 0.520 1 1 174 . 17 1 1 A 26 26 GLY N N 26 108.136 111.716 -3.580 1 1 175 . 17 1 1 A 27 27 TRP H H 27 8.642 8.632 0.010 1 1 177 . 17 1 1 A 27 27 TRP C C 27 174.820 175.767 -0.947 1 1 178 . 17 1 1 A 27 27 TRP CB C 27 30.883 31.222 -0.339 1 1 179 . 17 1 1 A 27 27 TRP N N 27 120.887 120.923 -0.036 1 1 181 . 17 1 1 A 32 32 ASP C C 32 176.315 173.997 2.318 1 1 182 . 17 1 1 A 32 32 ASP CA C 32 53.737 53.862 -0.125 1 1 183 . 17 1 1 A 32 32 ASP CB C 32 41.230 44.436 -3.206 1 1 184 . 17 1 1 A 33 33 THR H H 33 8.190 8.596 -0.406 1 1 188 . 17 1 1 A 33 33 THR C C 33 175.291 174.668 0.623 1 1 189 . 17 1 1 A 33 33 THR CA C 33 61.909 61.602 0.307 1 1 190 . 17 1 1 A 33 33 THR CB C 33 68.961 69.693 -0.732 1 1 192 . 17 1 1 A 33 33 THR N N 33 114.235 114.826 -0.591 1 1 193 . 17 1 1 A 34 34 GLY H H 34 8.341 8.632 -0.291 1 1 194 . 17 1 1 A 34 34 GLY C C 34 173.766 172.428 1.338 1 1 195 . 17 1 1 A 34 34 GLY CA C 34 44.941 45.058 -0.117 1 1 196 . 17 1 1 A 34 34 GLY N N 34 110.678 111.862 -1.184 1 1 197 . 17 1 1 A 35 35 PHE H H 35 7.945 8.450 -0.505 1 1 198 . 17 1 1 A 35 35 PHE C C 35 175.411 173.511 1.900 1 1 199 . 17 1 1 A 35 35 PHE CA C 35 57.921 56.773 1.148 1 1 200 . 17 1 1 A 35 35 PHE CB C 35 38.806 42.950 -4.144 1 1 201 . 17 1 1 A 35 35 PHE N N 35 120.533 120.581 -0.048 1 1 202 . 17 1 1 A 36 36 TYR H H 36 7.967 8.449 -0.482 1 1 203 . 17 1 1 A 36 36 TYR C C 36 176.104 174.319 1.785 1 1 204 . 17 1 1 A 36 36 TYR CA C 36 57.568 57.343 0.225 1 1 205 . 17 1 1 A 36 36 TYR CB C 36 37.727 38.329 -0.602 1 1 206 . 17 1 1 A 36 36 TYR N N 36 120.254 127.775 -7.521 1 1 207 . 17 1 1 A 37 37 GLY H H 37 7.666 7.705 -0.039 1 1 208 . 17 1 1 A 37 37 GLY C C 37 173.794 172.534 1.260 1 1 209 . 17 1 1 A 37 37 GLY CA C 37 45.007 44.195 0.812 1 1 210 . 17 1 1 A 37 37 GLY N N 37 108.995 108.278 0.717 1 1 211 . 17 1 1 A 38 38 ASN H H 38 8.109 8.806 -0.697 1 1 212 . 17 1 1 A 38 38 ASN C C 38 175.612 174.461 1.151 1 1 213 . 17 1 1 A 38 38 ASN CA C 38 52.954 51.455 1.499 1 1 214 . 17 1 1 A 38 38 ASN CB C 38 38.425 42.109 -3.684 1 1 215 . 17 1 1 A 38 38 ASN N N 38 118.603 120.961 -2.358 1 1 216 . 17 1 1 A 39 39 GLY H H 39 8.202 8.788 -0.586 1 1 217 . 17 1 1 A 39 39 GLY C C 39 173.958 174.001 -0.043 1 1 218 . 17 1 1 A 39 39 GLY CA C 39 45.012 44.062 0.950 1 1 219 . 17 1 1 A 39 39 GLY N N 39 108.897 107.813 1.084 1 1 220 . 17 1 1 A 40 40 PHE H H 40 7.960 9.228 -1.268 1 1 221 . 17 1 1 A 40 40 PHE C C 40 175.653 176.788 -1.135 1 1 222 . 17 1 1 A 40 40 PHE CA C 40 57.556 59.175 -1.619 1 1 223 . 17 1 1 A 40 40 PHE CB C 40 38.513 40.964 -2.451 1 1 224 . 17 1 1 A 40 40 PHE N N 40 119.829 120.469 -0.640 1 1 225 . 17 1 1 A 41 41 GLN H H 41 8.173 8.751 -0.578 1 1 226 . 17 1 1 A 41 41 GLN C C 41 175.234 175.573 -0.339 1 1 227 . 17 1 1 A 41 41 GLN CA C 41 55.488 57.027 -1.539 1 1 228 . 17 1 1 A 41 41 GLN CB C 41 28.523 31.289 -2.766 1 1 230 . 17 1 1 A 41 41 GLN N N 41 120.810 114.978 5.832 1 1 231 . 17 1 1 A 42 42 ASN H H 42 8.193 7.862 0.331 1 1 232 . 17 1 1 A 42 42 ASN C C 42 174.618 175.061 -0.443 1 1 233 . 17 1 1 A 42 42 ASN CA C 42 52.924 52.650 0.274 1 1 234 . 17 1 1 A 42 42 ASN CB C 42 38.333 40.122 -1.789 1 1 235 . 17 1 1 A 42 42 ASN N N 42 119.679 117.027 2.652 1 1 236 . 17 1 1 A 43 43 ASN H H 43 8.255 8.654 -0.399 1 1 237 . 17 1 1 A 43 43 ASN C C 43 173.873 175.412 -1.539 1 1 238 . 17 1 1 A 43 43 ASN CA C 43 52.919 54.131 -1.212 1 1 239 . 17 1 1 A 43 43 ASN CB C 43 38.580 41.453 -2.873 1 1 240 . 17 1 1 A 43 43 ASN N N 43 119.773 118.153 1.620 1 1 241 . 17 1 1 A 44 44 ASN H H 44 7.865 8.034 -0.169 1 1 242 . 17 1 1 A 44 44 ASN C C 44 175.518 175.171 0.347 1 1 243 . 17 1 1 A 44 44 ASN CA C 44 54.528 53.724 0.804 1 1 244 . 17 1 1 A 44 44 ASN CB C 44 40.170 39.429 0.741 1 1 246 . 17 1 1 A 44 44 ASN N N 44 124.152 116.904 7.248 1 1 247 . 17 1 1 A 46 46 PRO C C 46 177.228 176.428 0.800 1 1 248 . 17 1 1 A 46 46 PRO CA C 46 62.794 65.718 -2.924 1 1 249 . 17 1 1 A 46 46 PRO CB C 46 31.283 31.623 -0.340 1 1 251 . 17 1 1 A 47 47 THR H H 47 8.165 7.867 0.298 1 1 255 . 17 1 1 A 47 47 THR C C 47 174.573 174.900 -0.327 1 1 256 . 17 1 1 A 47 47 THR CA C 47 61.346 62.808 -1.462 1 1 257 . 17 1 1 A 47 47 THR CB C 47 69.573 69.515 0.058 1 1 259 . 17 1 1 A 47 47 THR N N 47 114.265 113.054 1.211 1 1 260 . 17 1 1 A 48 48 ARG H H 48 8.237 8.457 -0.220 1 1 261 . 17 1 1 A 48 48 ARG C C 48 175.898 176.847 -0.949 1 1 262 . 17 1 1 A 48 48 ARG CA C 48 55.717 55.319 0.398 1 1 263 . 17 1 1 A 48 48 ARG CB C 48 30.151 32.529 -2.378 1 1 266 . 17 1 1 A 48 48 ARG N N 48 122.795 125.871 -3.076 1 1 267 . 17 1 1 A 49 49 ASN H H 49 8.369 8.860 -0.491 1 1 268 . 17 1 1 A 49 49 ASN C C 49 174.560 175.067 -0.507 1 1 269 . 17 1 1 A 49 49 ASN CA C 49 53.005 54.978 -1.973 1 1 270 . 17 1 1 A 49 49 ASN CB C 49 38.761 39.570 -0.809 1 1 271 . 17 1 1 A 49 49 ASN N N 49 119.837 120.380 -0.543 1 1 272 . 17 1 1 A 50 50 ASP H H 50 8.192 7.750 0.442 1 1 273 . 17 1 1 A 50 50 ASP C C 50 175.699 174.908 0.791 1 1 274 . 17 1 1 A 50 50 ASP CA C 50 54.289 53.252 1.037 1 1 275 . 17 1 1 A 50 50 ASP CB C 50 41.264 43.136 -1.872 1 1 276 . 17 1 1 A 50 50 ASP N N 50 120.403 116.116 4.287 1 1 277 . 17 1 1 A 51 51 GLN H H 51 8.428 8.455 -0.027 1 1 278 . 17 1 1 A 51 51 GLN C C 51 175.186 174.110 1.076 1 1 279 . 17 1 1 A 51 51 GLN CA C 51 54.512 55.061 -0.549 1 1 280 . 17 1 1 A 51 51 GLN CB C 51 30.424 32.805 -2.381 1 1 282 . 17 1 1 A 51 51 GLN N N 51 118.959 120.177 -1.218 1 1 289 . 17 1 1 A 52 52 LEU C C 52 176.018 176.075 -0.057 1 1 290 . 17 1 1 A 52 52 LEU CA C 52 54.332 52.599 1.733 1 1 291 . 17 1 1 A 52 52 LEU CB C 52 43.022 43.530 -0.508 1 1 294 . 17 1 1 A 53 53 GLY H H 53 8.639 8.494 0.145 1 1 295 . 17 1 1 A 53 53 GLY C C 53 171.931 171.939 -0.008 1 1 296 . 17 1 1 A 53 53 GLY CA C 53 43.501 44.274 -0.773 1 1 297 . 17 1 1 A 53 53 GLY N N 53 109.964 106.836 3.128 1 1 298 . 17 1 1 A 54 54 ALA H H 54 8.881 9.055 -0.174 1 1 299 . 17 1 1 A 54 54 ALA C C 54 175.543 176.399 -0.856 1 1 300 . 17 1 1 A 54 54 ALA CA C 54 50.710 50.906 -0.196 1 1 301 . 17 1 1 A 54 54 ALA CB C 54 22.914 22.829 0.085 1 1 302 . 17 1 1 A 54 54 ALA N N 54 120.413 123.864 -3.451 1 1 303 . 17 1 1 A 55 55 GLY H H 55 8.346 8.681 -0.335 1 1 304 . 17 1 1 A 55 55 GLY C C 55 170.960 171.833 -0.873 1 1 305 . 17 1 1 A 55 55 GLY CA C 55 46.704 45.266 1.438 1 1 306 . 17 1 1 A 55 55 GLY N N 55 104.688 107.959 -3.271 1 1 307 . 17 1 1 A 56 56 ALA H H 56 9.116 8.430 0.686 1 1 308 . 17 1 1 A 56 56 ALA C C 56 176.472 175.975 0.497 1 1 309 . 17 1 1 A 56 56 ALA CA C 56 49.638 50.456 -0.818 1 1 310 . 17 1 1 A 56 56 ALA CB C 56 22.275 21.743 0.532 1 1 311 . 17 1 1 A 56 56 ALA N N 56 120.608 122.394 -1.786 1 1 312 . 17 1 1 A 57 57 PHE H H 57 8.688 9.180 -0.492 1 1 313 . 17 1 1 A 57 57 PHE C C 57 172.816 175.432 -2.616 1 1 314 . 17 1 1 A 57 57 PHE CA C 57 56.066 56.123 -0.057 1 1 315 . 17 1 1 A 57 57 PHE CB C 57 41.770 41.990 -0.220 1 1 316 . 17 1 1 A 57 57 PHE N N 57 120.027 119.567 0.460 1 1 317 . 17 1 1 A 58 58 GLY H H 58 9.034 9.274 -0.240 1 1 318 . 17 1 1 A 58 58 GLY C C 58 170.860 172.543 -1.683 1 1 319 . 17 1 1 A 58 58 GLY CA C 58 44.954 44.900 0.054 1 1 320 . 17 1 1 A 58 58 GLY N N 58 105.817 110.726 -4.909 1 1 321 . 17 1 1 A 59 59 GLY H H 59 8.382 8.953 -0.571 1 1 322 . 17 1 1 A 59 59 GLY C C 59 169.284 172.564 -3.280 1 1 323 . 17 1 1 A 59 59 GLY CA C 59 45.840 44.389 1.451 1 1 324 . 17 1 1 A 59 59 GLY N N 59 109.059 110.915 -1.856 1 1 325 . 17 1 1 A 60 60 TYR H H 60 8.430 8.863 -0.433 1 1 326 . 17 1 1 A 60 60 TYR C C 60 173.453 172.086 1.367 1 1 327 . 17 1 1 A 60 60 TYR CA C 60 55.282 55.989 -0.707 1 1 328 . 17 1 1 A 60 60 TYR CB C 60 41.712 40.855 0.857 1 1 329 . 17 1 1 A 60 60 TYR N N 60 118.352 115.398 2.954 1 1 330 . 17 1 1 A 61 61 GLN H H 61 8.833 8.259 0.574 1 1 331 . 17 1 1 A 61 61 GLN C C 61 174.365 174.894 -0.529 1 1 332 . 17 1 1 A 61 61 GLN CA C 61 54.125 55.544 -1.419 1 1 333 . 17 1 1 A 61 61 GLN CB C 61 28.033 30.671 -2.638 1 1 335 . 17 1 1 A 61 61 GLN N N 61 129.628 121.520 8.108 1 1 336 . 17 1 1 A 62 62 VAL H H 62 8.714 8.738 -0.024 1 1 343 . 17 1 1 A 62 62 VAL C C 62 175.758 175.976 -0.218 1 1 344 . 17 1 1 A 62 62 VAL CA C 62 64.649 63.449 1.200 1 1 345 . 17 1 1 A 62 62 VAL CB C 62 31.900 33.625 -1.725 1 1 348 . 17 1 1 A 62 62 VAL N N 62 127.666 123.450 4.216 1 1 349 . 17 1 1 A 63 63 ASN H H 63 8.062 8.089 -0.027 1 1 350 . 17 1 1 A 63 63 ASN C C 63 172.827 173.825 -0.998 1 1 351 . 17 1 1 A 63 63 ASN CA C 63 51.575 50.231 1.344 1 1 352 . 17 1 1 A 63 63 ASN CB C 63 37.194 40.101 -2.907 1 1 353 . 17 1 1 A 63 63 ASN N N 63 116.310 117.600 -1.290 1 1 354 . 17 1 1 A 64 64 PRO C C 64 175.071 175.070 0.001 1 1 355 . 17 1 1 A 64 64 PRO CA C 64 65.296 62.406 2.890 1 1 356 . 17 1 1 A 64 64 PRO CB C 64 30.428 29.110 1.318 1 1 357 . 17 1 1 A 65 65 TYR H H 65 7.873 8.827 -0.954 1 1 358 . 17 1 1 A 65 65 TYR C C 65 175.145 175.487 -0.342 1 1 359 . 17 1 1 A 65 65 TYR CA C 65 56.125 59.064 -2.939 1 1 360 . 17 1 1 A 65 65 TYR CB C 65 39.189 41.232 -2.043 1 1 361 . 17 1 1 A 65 65 TYR N N 65 112.894 121.718 -8.824 1 1 362 . 17 1 1 A 66 66 LEU H H 66 7.308 7.613 -0.305 1 1 369 . 17 1 1 A 66 66 LEU C C 66 173.866 174.499 -0.633 1 1 370 . 17 1 1 A 66 66 LEU CA C 66 53.431 54.007 -0.576 1 1 371 . 17 1 1 A 66 66 LEU CB C 66 44.958 44.107 0.851 1 1 375 . 17 1 1 A 66 66 LEU N N 66 120.270 115.917 4.353 1 1 376 . 17 1 1 A 67 67 GLY H H 67 8.855 8.389 0.466 1 1 377 . 17 1 1 A 67 67 GLY C C 67 170.698 172.040 -1.342 1 1 378 . 17 1 1 A 67 67 GLY CA C 67 44.008 44.150 -0.142 1 1 379 . 17 1 1 A 67 67 GLY N N 67 114.388 106.513 7.875 1 1 380 . 17 1 1 A 68 68 PHE H H 68 8.770 8.328 0.442 1 1 381 . 17 1 1 A 68 68 PHE C C 68 173.386 174.799 -1.413 1 1 382 . 17 1 1 A 68 68 PHE CA C 68 56.507 57.349 -0.842 1 1 383 . 17 1 1 A 68 68 PHE CB C 68 42.428 40.254 2.174 1 1 384 . 17 1 1 A 68 68 PHE N N 68 117.510 118.662 -1.152 1 1 385 . 17 1 1 A 69 69 GLU H H 69 9.079 9.738 -0.659 1 1 386 . 17 1 1 A 69 69 GLU C C 69 174.556 174.894 -0.338 1 1 387 . 17 1 1 A 69 69 GLU CA C 69 54.939 54.948 -0.009 1 1 388 . 17 1 1 A 69 69 GLU CB C 69 33.963 33.145 0.818 1 1 390 . 17 1 1 A 69 69 GLU N N 69 120.562 122.964 -2.402 1 1 391 . 17 1 1 A 70 70 MET H H 70 9.481 9.862 -0.381 1 1 392 . 17 1 1 A 70 70 MET C C 70 174.595 175.524 -0.929 1 1 393 . 17 1 1 A 70 70 MET CA C 70 53.091 54.383 -1.292 1 1 394 . 17 1 1 A 70 70 MET CB C 70 36.159 35.501 0.658 1 1 397 . 17 1 1 A 70 70 MET N N 70 124.928 124.674 0.254 1 1 398 . 17 1 1 A 71 71 GLY H H 71 8.845 9.108 -0.263 1 1 399 . 17 1 1 A 71 71 GLY C C 71 170.811 171.274 -0.463 1 1 400 . 17 1 1 A 71 71 GLY CA C 71 44.624 43.895 0.729 1 1 401 . 17 1 1 A 71 71 GLY N N 71 108.896 112.444 -3.548 1 1 402 . 17 1 1 A 72 72 TYR H H 72 8.925 9.058 -0.133 1 1 403 . 17 1 1 A 72 72 TYR C C 72 173.278 174.428 -1.150 1 1 404 . 17 1 1 A 72 72 TYR CA C 72 55.912 56.546 -0.634 1 1 405 . 17 1 1 A 72 72 TYR CB C 72 41.611 40.610 1.001 1 1 406 . 17 1 1 A 72 72 TYR N N 72 123.253 121.596 1.657 1 1 407 . 17 1 1 A 73 73 ASP H H 73 8.665 9.039 -0.374 1 1 408 . 17 1 1 A 73 73 ASP C C 73 173.598 176.079 -2.481 1 1 409 . 17 1 1 A 73 73 ASP CA C 73 52.857 53.968 -1.111 1 1 410 . 17 1 1 A 73 73 ASP CB C 73 42.774 42.318 0.456 1 1 411 . 17 1 1 A 73 73 ASP N N 73 126.178 124.882 1.296 1 1 412 . 17 1 1 A 74 74 TRP H H 74 9.080 9.099 -0.019 1 1 413 . 17 1 1 A 74 74 TRP C C 74 174.868 174.902 -0.034 1 1 414 . 17 1 1 A 74 74 TRP CB C 74 30.083 33.616 -3.533 1 1 415 . 17 1 1 A 74 74 TRP N N 74 121.824 123.958 -2.134 1 1 416 . 17 1 1 A 78 78 MET C C 78 174.548 176.034 -1.486 1 1 417 . 17 1 1 A 78 78 MET CA C 78 54.388 56.047 -1.659 1 1 418 . 17 1 1 A 78 78 MET CB C 78 32.542 33.742 -1.200 1 1 419 . 17 1 1 A 79 79 ALA H H 79 8.105 8.211 -0.106 1 1 420 . 17 1 1 A 79 79 ALA C C 79 176.629 178.790 -2.161 1 1 421 . 17 1 1 A 79 79 ALA CA C 79 51.210 50.054 1.156 1 1 422 . 17 1 1 A 79 79 ALA CB C 79 19.106 22.039 -2.933 1 1 423 . 17 1 1 A 79 79 ALA N N 79 125.778 123.376 2.402 1 1 424 . 17 1 1 A 80 80 TYR H H 80 8.035 8.840 -0.805 1 1 425 . 17 1 1 A 80 80 TYR C C 80 175.604 176.353 -0.749 1 1 426 . 17 1 1 A 80 80 TYR CA C 80 57.021 60.478 -3.457 1 1 427 . 17 1 1 A 80 80 TYR CB C 80 38.416 37.838 0.578 1 1 428 . 17 1 1 A 80 80 TYR N N 80 120.045 117.726 2.319 1 1 429 . 17 1 1 A 81 81 LYS H H 81 8.295 7.082 1.213 1 1 430 . 17 1 1 A 81 81 LYS C C 81 176.647 176.488 0.159 1 1 431 . 17 1 1 A 81 81 LYS CA C 81 56.285 56.098 0.187 1 1 432 . 17 1 1 A 81 81 LYS CB C 81 31.571 33.516 -1.945 1 1 434 . 17 1 1 A 81 81 LYS N N 81 123.191 121.126 2.065 1 1 435 . 17 1 1 A 82 82 GLY H H 82 8.117 8.202 -0.085 1 1 436 . 17 1 1 A 82 82 GLY C C 82 174.010 172.108 1.902 1 1 437 . 17 1 1 A 82 82 GLY CA C 82 44.982 45.380 -0.398 1 1 438 . 17 1 1 A 82 82 GLY N N 82 110.014 108.861 1.153 1 1 439 . 17 1 1 A 83 83 SER H H 83 7.938 8.481 -0.543 1 1 440 . 17 1 1 A 83 83 SER C C 83 174.634 175.000 -0.366 1 1 441 . 17 1 1 A 83 83 SER CA C 83 57.685 58.180 -0.495 1 1 442 . 17 1 1 A 83 83 SER CB C 83 63.303 64.522 -1.219 1 1 443 . 17 1 1 A 83 83 SER N N 83 115.655 113.771 1.884 1 1 444 . 17 1 1 A 84 84 VAL H H 84 8.008 8.345 -0.337 1 1 451 . 17 1 1 A 84 84 VAL C C 84 175.525 175.242 0.283 1 1 452 . 17 1 1 A 84 84 VAL CA C 84 61.769 61.117 0.652 1 1 453 . 17 1 1 A 84 84 VAL CB C 84 31.711 32.026 -0.315 1 1 456 . 17 1 1 A 84 84 VAL N N 84 120.054 119.590 0.464 1 1 457 . 17 1 1 A 85 85 ASP H H 85 8.140 8.334 -0.194 1 1 458 . 17 1 1 A 85 85 ASP C C 85 174.740 175.253 -0.513 1 1 459 . 17 1 1 A 85 85 ASP CA C 85 53.983 55.697 -1.714 1 1 460 . 17 1 1 A 85 85 ASP CB C 85 40.633 42.602 -1.969 1 1 461 . 17 1 1 A 85 85 ASP N N 85 122.510 122.133 0.377 1 1 462 . 17 1 1 A 86 86 ASN H H 86 7.736 8.004 -0.268 1 1 463 . 17 1 1 A 86 86 ASN C C 86 175.970 175.387 0.583 1 1 464 . 17 1 1 A 86 86 ASN CA C 86 54.349 52.495 1.854 1 1 465 . 17 1 1 A 86 86 ASN CB C 86 40.490 38.222 2.268 1 1 467 . 17 1 1 A 86 86 ASN N N 86 124.290 117.433 6.857 1 1 468 . 17 1 1 A 87 87 GLY H H 87 8.000 8.436 -0.436 1 1 469 . 17 1 1 A 87 87 GLY C C 87 173.456 175.024 -1.568 1 1 470 . 17 1 1 A 87 87 GLY CA C 87 44.973 45.723 -0.750 1 1 471 . 17 1 1 A 87 87 GLY N N 87 113.494 114.244 -0.750 1 1 472 . 17 1 1 A 88 88 ALA H H 88 8.024 7.794 0.230 1 1 473 . 17 1 1 A 88 88 ALA C C 88 176.833 177.434 -0.601 1 1 474 . 17 1 1 A 88 88 ALA CA C 88 51.734 54.597 -2.863 1 1 475 . 17 1 1 A 88 88 ALA CB C 88 19.818 19.715 0.103 1 1 476 . 17 1 1 A 88 88 ALA N N 88 122.676 121.174 1.502 1 1 477 . 17 1 1 A 91 91 ALA C C 91 174.781 175.642 -0.861 1 1 478 . 17 1 1 A 91 91 ALA CA C 91 50.537 49.906 0.631 1 1 479 . 17 1 1 A 91 91 ALA CB C 91 21.324 22.613 -1.289 1 1 480 . 17 1 1 A 92 92 GLN H H 92 8.451 8.316 0.135 1 1 481 . 17 1 1 A 92 92 GLN C C 92 173.557 174.246 -0.689 1 1 482 . 17 1 1 A 92 92 GLN CA C 92 53.380 54.440 -1.060 1 1 484 . 17 1 1 A 92 92 GLN N N 92 116.847 117.252 -0.405 1 1 485 . 17 1 1 A 93 93 GLY C C 93 170.631 172.715 -2.084 1 1 486 . 17 1 1 A 93 93 GLY CA C 93 45.718 45.336 0.382 1 1 487 . 17 1 1 A 94 94 VAL H H 94 8.686 9.565 -0.879 1 1 494 . 17 1 1 A 94 94 VAL C C 94 173.698 173.832 -0.134 1 1 495 . 17 1 1 A 94 94 VAL CA C 94 58.997 60.021 -1.024 1 1 496 . 17 1 1 A 94 94 VAL CB C 94 33.311 34.232 -0.921 1 1 499 . 17 1 1 A 94 94 VAL N N 94 118.489 120.796 -2.307 1 1 500 . 17 1 1 A 95 95 GLN H H 95 9.468 9.580 -0.112 1 1 501 . 17 1 1 A 95 95 GLN C C 95 174.028 173.785 0.243 1 1 502 . 17 1 1 A 95 95 GLN CA C 95 52.547 54.311 -1.764 1 1 503 . 17 1 1 A 95 95 GLN CB C 95 33.816 31.442 2.374 1 1 505 . 17 1 1 A 95 95 GLN N N 95 122.106 126.091 -3.985 1 1 506 . 17 1 1 A 96 96 LEU H H 96 8.484 9.084 -0.600 1 1 513 . 17 1 1 A 96 96 LEU C C 96 175.322 174.912 0.410 1 1 514 . 17 1 1 A 96 96 LEU CA C 96 53.736 54.050 -0.314 1 1 515 . 17 1 1 A 96 96 LEU CB C 96 41.088 44.862 -3.774 1 1 519 . 17 1 1 A 96 96 LEU N N 96 123.224 125.468 -2.244 1 1 520 . 17 1 1 A 97 97 THR H H 97 9.116 8.995 0.121 1 1 521 . 17 1 1 A 97 97 THR C C 97 173.251 172.601 0.650 1 1 522 . 17 1 1 A 97 97 THR CA C 97 58.931 60.437 -1.506 1 1 523 . 17 1 1 A 97 97 THR CB C 97 72.984 70.716 2.268 1 1 525 . 17 1 1 A 97 97 THR N N 97 112.504 118.662 -6.158 1 1 526 . 17 1 1 A 98 98 ALA H H 98 8.603 8.758 -0.155 1 1 527 . 17 1 1 A 98 98 ALA C C 98 174.948 175.395 -0.447 1 1 528 . 17 1 1 A 98 98 ALA CA C 98 49.980 49.959 0.021 1 1 529 . 17 1 1 A 98 98 ALA CB C 98 19.157 20.404 -1.247 1 1 530 . 17 1 1 A 98 98 ALA N N 98 121.608 126.271 -4.663 1 1 531 . 17 1 1 A 99 99 LYS H H 99 8.890 8.820 0.070 1 1 532 . 17 1 1 A 99 99 LYS C C 99 174.294 175.284 -0.990 1 1 533 . 17 1 1 A 99 99 LYS CA C 99 54.019 54.738 -0.719 1 1 534 . 17 1 1 A 99 99 LYS CB C 99 33.018 34.627 -1.609 1 1 538 . 17 1 1 A 99 99 LYS N N 99 124.522 124.088 0.434 1 1 539 . 17 1 1 A 100 100 LEU H H 100 8.985 8.741 0.244 1 1 546 . 17 1 1 A 100 100 LEU C C 100 175.265 175.642 -0.377 1 1 547 . 17 1 1 A 100 100 LEU CA C 100 52.698 53.371 -0.673 1 1 548 . 17 1 1 A 100 100 LEU CB C 100 42.889 44.270 -1.381 1 1 552 . 17 1 1 A 100 100 LEU N N 100 131.876 123.170 8.706 1 1 553 . 17 1 1 A 101 101 GLY H H 101 9.137 8.159 0.978 1 1 554 . 17 1 1 A 101 101 GLY C C 101 170.798 171.206 -0.408 1 1 555 . 17 1 1 A 101 101 GLY CA C 101 44.429 45.615 -1.186 1 1 556 . 17 1 1 A 101 101 GLY N N 101 111.928 108.484 3.444 1 1 557 . 17 1 1 A 102 102 TYR H H 102 8.779 8.694 0.085 1 1 558 . 17 1 1 A 102 102 TYR C C 102 173.402 173.638 -0.236 1 1 559 . 17 1 1 A 102 102 TYR CA C 102 54.444 56.412 -1.968 1 1 560 . 17 1 1 A 102 102 TYR CB C 102 42.239 42.119 0.120 1 1 561 . 17 1 1 A 102 102 TYR N N 102 116.664 119.465 -2.801 1 1 562 . 17 1 1 A 103 103 PRO C C 103 175.676 176.166 -0.490 1 1 563 . 17 1 1 A 103 103 PRO CA C 103 61.462 62.880 -1.418 1 1 564 . 17 1 1 A 103 103 PRO CB C 103 30.073 33.370 -3.297 1 1 565 . 17 1 1 A 104 104 ILE H H 104 8.670 9.030 -0.360 1 1 569 . 17 1 1 A 104 104 ILE C C 104 176.646 176.817 -0.171 1 1 570 . 17 1 1 A 104 104 ILE CA C 104 62.054 62.334 -0.280 1 1 571 . 17 1 1 A 104 104 ILE CB C 104 37.678 40.656 -2.978 1 1 574 . 17 1 1 A 104 104 ILE N N 104 125.939 121.141 4.798 1 1 575 . 17 1 1 A 105 105 THR H H 105 8.129 7.835 0.294 1 1 576 . 17 1 1 A 105 105 THR C C 105 174.344 174.051 0.293 1 1 577 . 17 1 1 A 105 105 THR CA C 105 59.176 62.221 -3.045 1 1 578 . 17 1 1 A 105 105 THR CB C 105 71.049 70.302 0.747 1 1 580 . 17 1 1 A 105 105 THR N N 105 109.853 109.698 0.155 1 1 581 . 17 1 1 A 106 106 ASP H H 106 8.424 7.854 0.570 1 1 582 . 17 1 1 A 106 106 ASP C C 106 175.692 174.554 1.138 1 1 583 . 17 1 1 A 106 106 ASP CA C 106 56.465 54.071 2.394 1 1 584 . 17 1 1 A 106 106 ASP CB C 106 40.032 42.832 -2.800 1 1 585 . 17 1 1 A 106 106 ASP N N 106 117.156 119.691 -2.535 1 1 586 . 17 1 1 A 107 107 ASP H H 107 8.124 8.851 -0.727 1 1 587 . 17 1 1 A 107 107 ASP C C 107 174.174 173.948 0.226 1 1 588 . 17 1 1 A 107 107 ASP CA C 107 52.907 55.185 -2.278 1 1 589 . 17 1 1 A 107 107 ASP CB C 107 41.661 39.105 2.556 1 1 590 . 17 1 1 A 107 107 ASP N N 107 113.591 125.122 -11.531 1 1 591 . 17 1 1 A 108 108 LEU H H 108 7.336 7.246 0.090 1 1 598 . 17 1 1 A 108 108 LEU C C 108 174.321 175.086 -0.765 1 1 599 . 17 1 1 A 108 108 LEU CA C 108 54.449 53.893 0.556 1 1 600 . 17 1 1 A 108 108 LEU CB C 108 44.754 44.728 0.026 1 1 604 . 17 1 1 A 108 108 LEU N N 108 123.244 118.898 4.346 1 1 605 . 17 1 1 A 109 109 ASP H H 109 8.943 9.141 -0.198 1 1 606 . 17 1 1 A 109 109 ASP C C 109 176.248 174.605 1.643 1 1 607 . 17 1 1 A 109 109 ASP CA C 109 52.376 52.727 -0.351 1 1 608 . 17 1 1 A 109 109 ASP CB C 109 42.764 44.379 -1.615 1 1 609 . 17 1 1 A 109 109 ASP N N 109 124.634 123.812 0.822 1 1 610 . 17 1 1 A 110 110 ILE H H 110 8.372 8.959 -0.587 1 1 614 . 17 1 1 A 110 110 ILE C C 110 173.735 173.910 -0.175 1 1 615 . 17 1 1 A 110 110 ILE CA C 110 59.129 58.800 0.329 1 1 616 . 17 1 1 A 110 110 ILE CB C 110 39.402 41.371 -1.969 1 1 620 . 17 1 1 A 110 110 ILE N N 110 119.135 122.384 -3.249 1 1 621 . 17 1 1 A 111 111 TYR H H 111 8.695 8.712 -0.017 1 1 622 . 17 1 1 A 111 111 TYR C C 111 172.838 172.582 0.256 1 1 623 . 17 1 1 A 111 111 TYR CA C 111 56.182 55.833 0.349 1 1 624 . 17 1 1 A 111 111 TYR CB C 111 41.489 42.464 -0.975 1 1 625 . 17 1 1 A 111 111 TYR N N 111 121.248 123.582 -2.334 1 1 626 . 17 1 1 A 112 112 THR H H 112 9.172 8.825 0.347 1 1 627 . 17 1 1 A 112 112 THR C C 112 173.850 172.473 1.377 1 1 628 . 17 1 1 A 112 112 THR CA C 112 58.246 60.285 -2.039 1 1 629 . 17 1 1 A 112 112 THR CB C 112 71.676 71.494 0.182 1 1 631 . 17 1 1 A 112 112 THR N N 112 110.671 115.285 -4.614 1 1 632 . 17 1 1 A 113 113 ARG H H 113 8.732 9.651 -0.919 1 1 633 . 17 1 1 A 113 113 ARG C C 113 175.037 174.737 0.300 1 1 634 . 17 1 1 A 113 113 ARG CA C 113 53.995 54.867 -0.872 1 1 635 . 17 1 1 A 113 113 ARG CB C 113 32.266 32.733 -0.467 1 1 638 . 17 1 1 A 113 113 ARG N N 113 120.642 126.492 -5.850 1 1 639 . 17 1 1 A 114 114 LEU H H 114 8.449 9.023 -0.574 1 1 646 . 17 1 1 A 114 114 LEU C C 114 175.812 175.731 0.081 1 1 647 . 17 1 1 A 114 114 LEU CA C 114 53.335 53.602 -0.267 1 1 648 . 17 1 1 A 114 114 LEU CB C 114 45.182 44.721 0.461 1 1 652 . 17 1 1 A 114 114 LEU N N 114 119.078 125.126 -6.048 1 1 653 . 17 1 1 A 115 115 GLY H H 115 8.232 8.584 -0.352 1 1 654 . 17 1 1 A 115 115 GLY C C 115 171.343 172.373 -1.030 1 1 655 . 17 1 1 A 115 115 GLY CA C 115 46.217 46.132 0.085 1 1 656 . 17 1 1 A 115 115 GLY N N 115 108.966 112.507 -3.541 1 1 657 . 17 1 1 A 116 116 GLY H H 116 8.293 8.468 -0.175 1 1 658 . 17 1 1 A 116 116 GLY C C 116 169.856 172.435 -2.579 1 1 659 . 17 1 1 A 116 116 GLY CA C 116 44.084 45.432 -1.348 1 1 660 . 17 1 1 A 116 116 GLY N N 116 109.676 111.179 -1.503 1 1 661 . 17 1 1 A 117 117 MET H H 117 9.286 9.031 0.255 1 1 662 . 17 1 1 A 117 117 MET C C 117 174.557 174.841 -0.284 1 1 663 . 17 1 1 A 117 117 MET CA C 117 53.258 53.514 -0.256 1 1 664 . 17 1 1 A 117 117 MET CB C 117 37.195 35.371 1.824 1 1 667 . 17 1 1 A 117 117 MET N N 117 120.425 116.909 3.516 1 1 668 . 17 1 1 A 118 118 VAL H H 118 9.062 9.077 -0.015 1 1 675 . 17 1 1 A 118 118 VAL C C 118 173.993 174.463 -0.470 1 1 676 . 17 1 1 A 118 118 VAL CA C 118 59.883 60.869 -0.986 1 1 677 . 17 1 1 A 118 118 VAL CB C 118 31.782 34.748 -2.966 1 1 680 . 17 1 1 A 118 118 VAL N N 118 126.948 120.480 6.468 1 1 681 . 17 1 1 A 119 119 TRP H H 119 8.482 9.201 -0.719 1 1 682 . 17 1 1 A 119 119 TRP C C 119 174.608 174.400 0.208 1 1 683 . 17 1 1 A 119 119 TRP CA C 119 53.332 55.703 -2.371 1 1 684 . 17 1 1 A 119 119 TRP CB C 119 33.569 33.285 0.284 1 1 685 . 17 1 1 A 119 119 TRP N N 119 124.631 129.515 -4.884 1 1 686 . 17 1 1 A 120 120 ARG H H 120 9.113 7.980 1.133 1 1 687 . 17 1 1 A 120 120 ARG C C 120 174.951 173.810 1.141 1 1 688 . 17 1 1 A 120 120 ARG CA C 120 54.684 53.847 0.837 1 1 689 . 17 1 1 A 120 120 ARG CB C 120 33.424 33.241 0.183 1 1 690 . 17 1 1 A 120 120 ARG N N 120 117.899 126.275 -8.376 1 1 691 . 17 1 1 A 121 121 ALA H H 121 9.299 8.638 0.661 1 1 692 . 17 1 1 A 121 121 ALA C C 121 175.954 176.446 -0.492 1 1 693 . 17 1 1 A 121 121 ALA CA C 121 50.368 50.101 0.267 1 1 694 . 17 1 1 A 121 121 ALA CB C 121 21.141 20.977 0.164 1 1 695 . 17 1 1 A 121 121 ALA N N 121 128.863 122.799 6.064 1 1 696 . 17 1 1 A 122 122 ASP H H 122 8.488 8.501 -0.013 1 1 697 . 17 1 1 A 122 122 ASP C C 122 175.635 175.510 0.125 1 1 698 . 17 1 1 A 122 122 ASP CA C 122 53.891 54.742 -0.851 1 1 699 . 17 1 1 A 122 122 ASP CB C 122 42.492 41.258 1.234 1 1 700 . 17 1 1 A 122 122 ASP N N 122 121.721 122.120 -0.399 1 1 701 . 17 1 1 A 123 123 SER H H 123 8.466 8.490 -0.024 1 1 702 . 17 1 1 A 123 123 SER C C 123 174.325 173.214 1.111 1 1 703 . 17 1 1 A 123 123 SER CA C 123 57.325 57.802 -0.477 1 1 704 . 17 1 1 A 123 123 SER CB C 123 63.988 64.612 -0.624 1 1 705 . 17 1 1 A 123 123 SER N N 123 117.374 123.736 -6.362 1 1 706 . 17 1 1 A 124 124 LYS H H 124 8.389 8.515 -0.126 1 1 707 . 17 1 1 A 124 124 LYS C C 124 176.840 175.290 1.550 1 1 708 . 17 1 1 A 124 124 LYS CA C 124 56.036 55.019 1.017 1 1 709 . 17 1 1 A 124 124 LYS CB C 124 32.397 36.264 -3.867 1 1 711 . 17 1 1 A 124 124 LYS N N 124 122.883 125.510 -2.627 1 1 712 . 17 1 1 A 125 125 GLY H H 125 8.281 8.749 -0.468 1 1 713 . 17 1 1 A 125 125 GLY C C 125 173.592 174.578 -0.986 1 1 714 . 17 1 1 A 125 125 GLY CA C 125 44.924 45.598 -0.674 1 1 715 . 17 1 1 A 125 125 GLY N N 125 109.541 114.201 -4.660 1 1 716 . 17 1 1 A 126 126 ASN H H 126 8.185 8.334 -0.149 1 1 717 . 17 1 1 A 126 126 ASN C C 126 176.649 174.128 2.521 1 1 718 . 17 1 1 A 126 126 ASN CA C 126 52.763 52.212 0.551 1 1 719 . 17 1 1 A 126 126 ASN CB C 126 38.439 38.774 -0.335 1 1 720 . 17 1 1 A 126 126 ASN N N 126 119.019 119.816 -0.797 1 1 721 . 17 1 1 A 127 127 TYR C C 127 176.913 175.868 1.045 1 1 722 . 17 1 1 A 127 127 TYR CA C 127 57.757 57.836 -0.079 1 1 723 . 17 1 1 A 127 127 TYR CB C 127 37.703 38.585 -0.882 1 1 724 . 17 1 1 A 128 128 ALA H H 128 8.050 8.667 -0.617 1 1 728 . 17 1 1 A 128 128 ALA C C 128 177.756 176.455 1.301 1 1 729 . 17 1 1 A 128 128 ALA CA C 128 52.321 51.981 0.340 1 1 730 . 17 1 1 A 128 128 ALA CB C 128 18.273 19.320 -1.047 1 1 731 . 17 1 1 A 128 128 ALA N N 128 124.529 128.327 -3.798 1 1 732 . 17 1 1 A 129 129 SER H H 129 8.063 7.700 0.363 1 1 733 . 17 1 1 A 129 129 SER C C 129 174.938 172.579 2.359 1 1 734 . 17 1 1 A 129 129 SER CA C 129 58.202 57.420 0.782 1 1 735 . 17 1 1 A 129 129 SER CB C 129 62.974 65.529 -2.555 1 1 736 . 17 1 1 A 129 129 SER N N 129 114.374 111.844 2.530 1 1 737 . 17 1 1 A 130 130 THR H H 130 7.875 8.740 -0.865 1 1 741 . 17 1 1 A 130 130 THR C C 130 175.198 175.039 0.159 1 1 742 . 17 1 1 A 130 130 THR CA C 130 61.520 60.353 1.167 1 1 743 . 17 1 1 A 130 130 THR CB C 130 69.312 68.457 0.855 1 1 745 . 17 1 1 A 130 130 THR N N 130 113.608 117.369 -3.761 1 1 746 . 17 1 1 A 131 131 GLY H H 131 8.219 8.007 0.212 1 1 747 . 17 1 1 A 131 131 GLY C C 131 173.979 174.685 -0.706 1 1 748 . 17 1 1 A 131 131 GLY CA C 131 44.991 45.743 -0.752 1 1 749 . 17 1 1 A 131 131 GLY N N 131 110.848 110.438 0.410 1 1 750 . 17 1 1 A 132 132 VAL H H 132 7.729 7.665 0.064 1 1 757 . 17 1 1 A 132 132 VAL C C 132 175.988 175.412 0.576 1 1 758 . 17 1 1 A 132 132 VAL CA C 132 61.643 62.270 -0.627 1 1 759 . 17 1 1 A 132 132 VAL CB C 132 31.941 33.470 -1.529 1 1 762 . 17 1 1 A 132 132 VAL N N 132 118.932 114.631 4.301 1 1 763 . 17 1 1 A 133 133 SER H H 133 8.224 8.120 0.104 1 1 764 . 17 1 1 A 133 133 SER C C 133 174.320 173.291 1.029 1 1 765 . 17 1 1 A 133 133 SER CA C 133 57.756 56.825 0.931 1 1 766 . 17 1 1 A 133 133 SER CB C 133 63.140 65.248 -2.108 1 1 767 . 17 1 1 A 133 133 SER N N 133 119.260 117.726 1.534 1 1 768 . 17 1 1 A 134 134 ARG H H 134 8.199 9.163 -0.964 1 1 769 . 17 1 1 A 134 134 ARG C C 134 175.923 173.757 2.166 1 1 770 . 17 1 1 A 134 134 ARG CA C 134 55.461 54.337 1.124 1 1 771 . 17 1 1 A 134 134 ARG CB C 134 30.195 34.226 -4.031 1 1 774 . 17 1 1 A 134 134 ARG N N 134 123.262 120.577 2.685 1 1 775 . 17 1 1 A 135 135 SER H H 135 8.256 8.758 -0.502 1 1 776 . 17 1 1 A 135 135 SER C C 135 174.360 173.061 1.299 1 1 777 . 17 1 1 A 135 135 SER CA C 135 57.730 56.504 1.226 1 1 778 . 17 1 1 A 135 135 SER CB C 135 63.275 64.441 -1.166 1 1 779 . 17 1 1 A 135 135 SER N N 135 117.155 115.662 1.493 1 1 780 . 17 1 1 A 136 136 GLU H H 136 8.374 8.925 -0.551 1 1 781 . 17 1 1 A 136 136 GLU C C 136 176.284 175.213 1.071 1 1 782 . 17 1 1 A 136 136 GLU CA C 136 56.082 55.991 0.091 1 1 783 . 17 1 1 A 136 136 GLU CB C 136 29.820 29.408 0.412 1 1 785 . 17 1 1 A 136 136 GLU N N 136 122.812 127.657 -4.845 1 1 786 . 17 1 1 A 137 137 HIS H H 137 8.118 8.575 -0.457 1 1 787 . 17 1 1 A 137 137 HIS C C 137 173.529 173.952 -0.423 1 1 788 . 17 1 1 A 137 137 HIS CA C 137 54.793 54.728 0.065 1 1 789 . 17 1 1 A 137 137 HIS CB C 137 30.191 31.285 -1.094 1 1 790 . 17 1 1 A 137 137 HIS N N 137 118.002 125.437 -7.435 1 1 791 . 17 1 1 A 138 138 ASP H H 138 8.572 9.342 -0.770 1 1 792 . 17 1 1 A 138 138 ASP C C 138 174.940 174.345 0.595 1 1 793 . 17 1 1 A 138 138 ASP CA C 138 53.594 52.778 0.816 1 1 794 . 17 1 1 A 138 138 ASP CB C 138 42.165 45.032 -2.867 1 1 795 . 17 1 1 A 138 138 ASP N N 138 121.536 124.865 -3.329 1 1 796 . 17 1 1 A 139 139 THR H H 139 7.857 8.611 -0.754 1 1 797 . 17 1 1 A 139 139 THR C C 139 172.822 173.474 -0.652 1 1 798 . 17 1 1 A 139 139 THR CA C 139 59.197 59.870 -0.673 1 1 799 . 17 1 1 A 139 139 THR CB C 139 71.457 71.868 -0.411 1 1 801 . 17 1 1 A 139 139 THR N N 139 113.598 111.116 2.482 1 1 802 . 17 1 1 A 140 140 GLY C C 140 169.622 172.135 -2.513 1 1 803 . 17 1 1 A 140 140 GLY CA C 140 44.287 45.061 -0.774 1 1 804 . 17 1 1 A 141 141 VAL H H 141 7.815 8.951 -1.136 1 1 811 . 17 1 1 A 141 141 VAL C C 141 176.038 173.643 2.395 1 1 812 . 17 1 1 A 141 141 VAL CA C 141 59.739 59.876 -0.137 1 1 813 . 17 1 1 A 141 141 VAL CB C 141 33.308 35.238 -1.930 1 1 816 . 17 1 1 A 141 141 VAL N N 141 116.224 124.526 -8.302 1 1 817 . 17 1 1 A 142 142 SER H H 142 9.284 8.801 0.483 1 1 818 . 17 1 1 A 142 142 SER C C 142 171.050 172.188 -1.138 1 1 819 . 17 1 1 A 142 142 SER CB C 142 67.608 66.415 1.193 1 1 820 . 17 1 1 A 142 142 SER N N 142 123.223 121.752 1.471 1 1 821 . 17 1 1 A 143 143 PRO C C 143 174.032 176.353 -2.321 1 1 822 . 17 1 1 A 143 143 PRO CA C 143 62.350 62.482 -0.132 1 1 823 . 17 1 1 A 143 143 PRO CB C 143 31.774 32.353 -0.579 1 1 825 . 17 1 1 A 144 144 VAL H H 144 7.785 8.901 -1.116 1 1 832 . 17 1 1 A 144 144 VAL C C 144 172.826 174.411 -1.585 1 1 833 . 17 1 1 A 144 144 VAL CA C 144 59.770 59.869 -0.099 1 1 834 . 17 1 1 A 144 144 VAL CB C 144 34.407 36.124 -1.717 1 1 837 . 17 1 1 A 144 144 VAL N N 144 120.214 117.360 2.854 1 1 838 . 17 1 1 A 145 145 PHE H H 145 8.623 8.678 -0.055 1 1 839 . 17 1 1 A 145 145 PHE C C 145 173.658 173.002 0.656 1 1 840 . 17 1 1 A 145 145 PHE CA C 145 54.942 55.361 -0.419 1 1 841 . 17 1 1 A 145 145 PHE CB C 145 42.692 42.409 0.283 1 1 842 . 17 1 1 A 145 145 PHE N N 145 123.914 119.342 4.572 1 1 843 . 17 1 1 A 146 146 ALA H H 146 8.886 8.945 -0.059 1 1 844 . 17 1 1 A 146 146 ALA C C 146 176.258 176.237 0.021 1 1 845 . 17 1 1 A 146 146 ALA CA C 146 49.734 50.006 -0.272 1 1 846 . 17 1 1 A 146 146 ALA CB C 146 22.244 21.880 0.364 1 1 847 . 17 1 1 A 146 146 ALA N N 146 125.243 124.360 0.883 1 1 848 . 17 1 1 A 147 147 GLY H H 147 8.470 8.558 -0.088 1 1 849 . 17 1 1 A 147 147 GLY C C 147 170.940 172.323 -1.383 1 1 850 . 17 1 1 A 147 147 GLY CA C 147 44.063 44.139 -0.076 1 1 851 . 17 1 1 A 147 147 GLY N N 147 106.669 109.345 -2.676 1 1 852 . 17 1 1 A 148 148 GLY H H 148 8.008 8.168 -0.160 1 1 853 . 17 1 1 A 148 148 GLY C C 148 170.181 172.087 -1.906 1 1 854 . 17 1 1 A 148 148 GLY CA C 148 45.736 45.554 0.182 1 1 855 . 17 1 1 A 148 148 GLY N N 148 109.475 109.367 0.108 1 1 856 . 17 1 1 A 149 149 VAL H H 149 8.426 8.228 0.198 1 1 863 . 17 1 1 A 149 149 VAL C C 149 174.157 174.240 -0.083 1 1 864 . 17 1 1 A 149 149 VAL CA C 149 58.200 58.876 -0.676 1 1 865 . 17 1 1 A 149 149 VAL CB C 149 34.464 36.026 -1.562 1 1 868 . 17 1 1 A 149 149 VAL N N 149 112.651 117.019 -4.368 1 1 869 . 17 1 1 A 150 150 GLU H H 150 9.070 9.312 -0.242 1 1 870 . 17 1 1 A 150 150 GLU C C 150 173.892 174.373 -0.481 1 1 871 . 17 1 1 A 150 150 GLU CA C 150 54.617 54.655 -0.038 1 1 872 . 17 1 1 A 150 150 GLU CB C 150 32.911 33.537 -0.626 1 1 874 . 17 1 1 A 150 150 GLU N N 150 124.471 119.901 4.570 1 1 875 . 17 1 1 A 151 151 TRP H H 151 9.461 9.826 -0.365 1 1 877 . 17 1 1 A 151 151 TRP C C 151 174.370 175.217 -0.847 1 1 878 . 17 1 1 A 151 151 TRP CA C 151 54.113 55.514 -1.401 1 1 879 . 17 1 1 A 151 151 TRP CB C 151 31.688 32.727 -1.039 1 1 880 . 17 1 1 A 151 151 TRP N N 151 129.611 124.368 5.243 1 1 882 . 17 1 1 A 152 152 ALA H H 152 8.771 8.179 0.592 1 1 883 . 17 1 1 A 152 152 ALA C C 152 175.079 177.002 -1.923 1 1 884 . 17 1 1 A 152 152 ALA CA C 152 51.417 52.117 -0.700 1 1 885 . 17 1 1 A 152 152 ALA CB C 152 17.209 19.061 -1.852 1 1 886 . 17 1 1 A 152 152 ALA N N 152 130.502 129.199 1.303 1 1 887 . 17 1 1 A 153 153 VAL H H 153 7.893 9.233 -1.340 1 1 894 . 17 1 1 A 153 153 VAL C C 153 176.612 175.747 0.865 1 1 895 . 17 1 1 A 153 153 VAL CA C 153 63.600 63.859 -0.259 1 1 896 . 17 1 1 A 153 153 VAL CB C 153 31.280 32.446 -1.166 1 1 899 . 17 1 1 A 153 153 VAL N N 153 124.360 123.190 1.170 1 1 900 . 17 1 1 A 154 154 THR H H 154 7.950 7.700 0.250 1 1 904 . 17 1 1 A 154 154 THR C C 154 173.884 173.547 0.337 1 1 905 . 17 1 1 A 154 154 THR CA C 154 58.655 60.822 -2.167 1 1 906 . 17 1 1 A 154 154 THR CB C 154 71.262 70.498 0.764 1 1 908 . 17 1 1 A 154 154 THR N N 154 109.176 110.763 -1.587 1 1 909 . 17 1 1 A 155 155 ARG H H 155 8.310 9.113 -0.803 1 1 910 . 17 1 1 A 155 155 ARG C C 155 176.753 175.256 1.497 1 1 911 . 17 1 1 A 155 155 ARG CA C 155 58.456 58.438 0.018 1 1 912 . 17 1 1 A 155 155 ARG CB C 155 29.043 30.070 -1.027 1 1 915 . 17 1 1 A 155 155 ARG N N 155 116.576 126.510 -9.934 1 1 916 . 17 1 1 A 156 156 ASP H H 156 7.783 8.296 -0.513 1 1 917 . 17 1 1 A 156 156 ASP C C 156 174.222 174.505 -0.283 1 1 918 . 17 1 1 A 156 156 ASP CA C 156 53.540 53.647 -0.107 1 1 919 . 17 1 1 A 156 156 ASP CB C 156 42.327 41.275 1.052 1 1 920 . 17 1 1 A 156 156 ASP N N 156 112.950 119.097 -6.147 1 1 921 . 17 1 1 A 157 157 ILE H H 157 7.233 7.393 -0.160 1 1 925 . 17 1 1 A 157 157 ILE C C 157 174.178 175.162 -0.984 1 1 926 . 17 1 1 A 157 157 ILE CA C 157 59.350 60.739 -1.389 1 1 927 . 17 1 1 A 157 157 ILE CB C 157 38.969 41.270 -2.301 1 1 930 . 17 1 1 A 157 157 ILE N N 157 119.732 120.043 -0.311 1 1 931 . 17 1 1 A 158 158 ALA H H 158 8.729 9.456 -0.727 1 1 932 . 17 1 1 A 158 158 ALA C C 158 176.567 175.324 1.243 1 1 933 . 17 1 1 A 158 158 ALA CA C 158 49.418 50.305 -0.887 1 1 934 . 17 1 1 A 158 158 ALA CB C 158 21.430 23.214 -1.784 1 1 935 . 17 1 1 A 158 158 ALA N N 158 128.564 130.369 -1.805 1 1 936 . 17 1 1 A 159 159 THR H H 159 8.972 9.112 -0.140 1 1 940 . 17 1 1 A 159 159 THR C C 159 172.213 173.510 -1.297 1 1 941 . 17 1 1 A 159 159 THR CA C 159 59.504 60.098 -0.594 1 1 942 . 17 1 1 A 159 159 THR CB C 159 70.728 71.932 -1.204 1 1 944 . 17 1 1 A 159 159 THR N N 159 114.901 113.907 0.994 1 1 945 . 17 1 1 A 160 160 ARG H H 160 8.924 9.603 -0.679 1 1 946 . 17 1 1 A 160 160 ARG C C 160 174.097 174.094 0.003 1 1 947 . 17 1 1 A 160 160 ARG CA C 160 53.066 54.443 -1.377 1 1 948 . 17 1 1 A 160 160 ARG CB C 160 32.922 34.127 -1.205 1 1 951 . 17 1 1 A 160 160 ARG N N 160 121.507 126.220 -4.713 1 1 952 . 17 1 1 A 161 161 LEU H H 161 8.611 9.061 -0.450 1 1 959 . 17 1 1 A 161 161 LEU C C 161 174.389 175.074 -0.685 1 1 960 . 17 1 1 A 161 161 LEU CA C 161 53.355 53.476 -0.121 1 1 961 . 17 1 1 A 161 161 LEU CB C 161 44.360 45.705 -1.345 1 1 964 . 17 1 1 A 161 161 LEU N N 161 124.711 123.137 1.574 1 1 965 . 17 1 1 A 162 162 GLU H H 162 8.746 8.960 -0.214 1 1 966 . 17 1 1 A 162 162 GLU C C 162 173.376 175.186 -1.810 1 1 967 . 17 1 1 A 162 162 GLU CA C 162 53.904 54.746 -0.842 1 1 968 . 17 1 1 A 162 162 GLU CB C 162 33.773 33.402 0.371 1 1 970 . 17 1 1 A 162 162 GLU N N 162 122.300 125.097 -2.797 1 1 971 . 17 1 1 A 163 163 TYR H H 163 8.872 8.708 0.164 1 1 972 . 17 1 1 A 163 163 TYR C C 163 173.425 175.048 -1.623 1 1 973 . 17 1 1 A 163 163 TYR CA C 163 56.192 55.505 0.687 1 1 974 . 17 1 1 A 163 163 TYR CB C 163 40.870 41.400 -0.530 1 1 975 . 17 1 1 A 163 163 TYR N N 163 124.618 117.728 6.890 1 1 976 . 17 1 1 A 171 171 ASP C C 171 175.753 176.819 -1.066 1 1 977 . 17 1 1 A 171 171 ASP CA C 171 53.517 52.689 0.828 1 1 978 . 17 1 1 A 171 171 ASP CB C 171 41.353 40.638 0.715 1 1 979 . 17 1 1 A 172 172 ALA H H 172 8.336 7.792 0.544 1 1 983 . 17 1 1 A 172 172 ALA C C 172 178.110 178.295 -0.185 1 1 984 . 17 1 1 A 172 172 ALA CA C 172 52.190 53.114 -0.924 1 1 985 . 17 1 1 A 172 172 ALA CB C 172 18.305 19.818 -1.513 1 1 986 . 17 1 1 A 172 172 ALA N N 172 125.294 124.239 1.055 1 1 987 . 17 1 1 A 173 173 GLY H H 173 8.300 7.616 0.684 1 1 988 . 17 1 1 A 173 173 GLY C C 173 174.437 174.387 0.050 1 1 989 . 17 1 1 A 173 173 GLY CA C 173 45.083 45.100 -0.017 1 1 990 . 17 1 1 A 173 173 GLY N N 173 107.268 103.572 3.696 1 1 991 . 17 1 1 A 174 174 THR H H 174 7.754 8.617 -0.863 1 1 992 . 17 1 1 A 174 174 THR C C 174 174.738 174.536 0.202 1 1 993 . 17 1 1 A 174 174 THR CA C 174 61.310 64.624 -3.314 1 1 994 . 17 1 1 A 174 174 THR CB C 174 69.310 69.469 -0.159 1 1 996 . 17 1 1 A 174 174 THR N N 174 113.472 117.958 -4.486 1 1 997 . 17 1 1 A 175 175 VAL H H 175 7.993 7.865 0.128 1 1 1004 . 17 1 1 A 175 175 VAL C C 175 176.535 175.266 1.269 1 1 1005 . 17 1 1 A 175 175 VAL CA C 175 62.126 60.927 1.199 1 1 1006 . 17 1 1 A 175 175 VAL CB C 175 31.282 32.662 -1.380 1 1 1009 . 17 1 1 A 175 175 VAL N N 175 121.643 119.648 1.995 1 1 1010 . 17 1 1 A 176 176 GLY H H 176 8.056 8.530 -0.474 1 1 1011 . 17 1 1 A 176 176 GLY C C 176 173.930 174.353 -0.423 1 1 1012 . 17 1 1 A 176 176 GLY CA C 176 44.983 44.938 0.045 1 1 1013 . 17 1 1 A 176 176 GLY N N 176 110.460 115.147 -4.687 1 1 1014 . 17 1 1 A 177 177 THR H H 177 7.520 7.848 -0.328 1 1 1015 . 17 1 1 A 177 177 THR C C 177 173.574 173.754 -0.180 1 1 1016 . 17 1 1 A 177 177 THR CA C 177 60.609 63.636 -3.027 1 1 1017 . 17 1 1 A 177 177 THR CB C 177 69.506 70.408 -0.902 1 1 1019 . 17 1 1 A 177 177 THR N N 177 113.390 115.421 -2.031 1 1 1020 . 17 1 1 A 178 178 ARG H H 178 8.261 7.877 0.384 1 1 1021 . 17 1 1 A 178 178 ARG C C 178 173.932 173.158 0.774 1 1 1022 . 17 1 1 A 178 178 ARG CA C 178 53.683 53.143 0.540 1 1 1023 . 17 1 1 A 178 178 ARG CB C 178 29.224 30.963 -1.739 1 1 1026 . 17 1 1 A 178 178 ARG N N 178 123.906 119.643 4.263 1 1 1027 . 17 1 1 A 183 183 MET C C 183 174.053 175.234 -1.181 1 1 1028 . 17 1 1 A 183 183 MET CA C 183 53.700 54.260 -0.560 1 1 1029 . 17 1 1 A 183 183 MET CB C 183 35.908 34.312 1.596 1 1 1032 . 17 1 1 A 184 184 LEU H H 184 8.319 9.062 -0.743 1 1 1033 . 17 1 1 A 184 184 LEU C C 184 175.235 175.302 -0.067 1 1 1034 . 17 1 1 A 184 184 LEU CA C 184 53.120 53.442 -0.322 1 1 1035 . 17 1 1 A 184 184 LEU CB C 184 42.857 45.661 -2.804 1 1 1038 . 17 1 1 A 184 184 LEU N N 184 131.293 127.899 3.394 1 1 1039 . 17 1 1 A 185 185 SER H H 185 9.603 9.059 0.544 1 1 1040 . 17 1 1 A 185 185 SER C C 185 171.293 172.614 -1.321 1 1 1041 . 17 1 1 A 185 185 SER CA C 185 56.504 57.012 -0.508 1 1 1042 . 17 1 1 A 185 185 SER CB C 185 66.585 66.364 0.221 1 1 1043 . 17 1 1 A 185 185 SER N N 185 119.338 117.906 1.432 1 1 1044 . 17 1 1 A 186 186 LEU H H 186 8.583 8.557 0.026 1 1 1051 . 17 1 1 A 186 186 LEU C C 186 175.328 176.650 -1.322 1 1 1052 . 17 1 1 A 186 186 LEU CA C 186 52.729 53.238 -0.509 1 1 1053 . 17 1 1 A 186 186 LEU CB C 186 44.996 44.938 0.058 1 1 1056 . 17 1 1 A 186 186 LEU N N 186 122.719 123.767 -1.048 1 1 1057 . 17 1 1 A 187 187 GLY H H 187 9.287 8.497 0.790 1 1 1058 . 17 1 1 A 187 187 GLY C C 187 172.315 173.123 -0.808 1 1 1059 . 17 1 1 A 187 187 GLY CA C 187 43.502 45.238 -1.736 1 1 1060 . 17 1 1 A 187 187 GLY N N 187 110.265 110.582 -0.317 1 1 1061 . 17 1 1 A 188 188 VAL H H 188 8.825 8.698 0.127 1 1 1068 . 17 1 1 A 188 188 VAL C C 188 173.125 174.880 -1.755 1 1 1069 . 17 1 1 A 188 188 VAL CA C 188 59.739 59.453 0.286 1 1 1070 . 17 1 1 A 188 188 VAL CB C 188 34.532 34.971 -0.439 1 1 1073 . 17 1 1 A 188 188 VAL N N 188 119.161 116.675 2.486 1 1 1074 . 17 1 1 A 189 189 SER H H 189 9.051 9.198 -0.147 1 1 1075 . 17 1 1 A 189 189 SER C C 189 171.698 173.095 -1.397 1 1 1076 . 17 1 1 A 189 189 SER CA C 189 55.997 57.164 -1.167 1 1 1077 . 17 1 1 A 189 189 SER CB C 189 66.094 67.099 -1.005 1 1 1078 . 17 1 1 A 189 189 SER N N 189 117.810 118.543 -0.733 1 1 1079 . 17 1 1 A 190 190 TYR H H 190 9.145 8.923 0.222 1 1 1080 . 17 1 1 A 190 190 TYR C C 190 174.063 172.765 1.298 1 1 1081 . 17 1 1 A 190 190 TYR CA C 190 55.375 55.513 -0.138 1 1 1082 . 17 1 1 A 190 190 TYR CB C 190 41.183 42.245 -1.062 1 1 1083 . 17 1 1 A 190 190 TYR N N 190 123.690 118.199 5.491 1 1 1084 . 17 1 1 A 191 191 ARG H H 191 8.211 8.776 -0.565 1 1 1085 . 17 1 1 A 191 191 ARG C C 191 174.826 175.038 -0.212 1 1 1086 . 17 1 1 A 191 191 ARG CA C 191 54.464 54.384 0.080 1 1 1087 . 17 1 1 A 191 191 ARG CB C 191 30.507 32.251 -1.744 1 1 1090 . 17 1 1 A 191 191 ARG N N 191 125.366 119.278 6.088 1 1 1091 . 17 1 1 A 192 192 PHE H H 192 8.496 9.340 -0.844 1 1 1092 . 17 1 1 A 192 192 PHE C C 192 176.384 175.570 0.814 1 1 1093 . 17 1 1 A 192 192 PHE CA C 192 57.179 57.962 -0.783 1 1 1094 . 17 1 1 A 192 192 PHE CB C 192 39.430 38.229 1.201 1 1 1095 . 17 1 1 A 192 192 PHE N N 192 121.586 123.851 -2.265 1 1 1096 . 17 1 1 A 193 193 GLY H H 193 8.643 8.435 0.208 1 1 1097 . 17 1 1 A 193 193 GLY C C 193 174.466 172.813 1.653 1 1 1098 . 17 1 1 A 193 193 GLY CA C 193 45.126 44.435 0.691 1 1 1099 . 17 1 1 A 193 193 GLY N N 193 109.499 111.229 -1.730 1 1 1100 . 17 1 1 A 194 194 GLN H H 194 8.512 8.587 -0.075 1 1 1101 . 17 1 1 A 194 194 GLN C C 194 176.201 174.762 1.439 1 1 1102 . 17 1 1 A 194 194 GLN CA C 194 55.433 54.885 0.548 1 1 1103 . 17 1 1 A 194 194 GLN CB C 194 28.729 29.541 -0.812 1 1 1105 . 17 1 1 A 194 194 GLN N N 194 119.448 123.128 -3.680 1 1 1106 . 17 1 1 A 195 195 GLU H H 195 8.530 7.862 0.668 1 1 1107 . 17 1 1 A 195 195 GLU C C 195 176.151 174.720 1.431 1 1 1108 . 17 1 1 A 195 195 GLU CA C 195 56.256 54.545 1.711 1 1 1109 . 17 1 1 A 195 195 GLU CB C 195 29.486 33.548 -4.062 1 1 1111 . 17 1 1 A 195 195 GLU N N 195 121.959 117.989 3.970 1 1 1112 . 17 1 1 A 196 196 ASP H H 196 8.253 8.771 -0.518 1 1 1113 . 17 1 1 A 196 196 ASP C C 196 175.667 175.514 0.153 1 1 1114 . 17 1 1 A 196 196 ASP CA C 196 53.981 52.727 1.254 1 1 1115 . 17 1 1 A 196 196 ASP CB C 196 40.700 44.512 -3.812 1 1 1116 . 17 1 1 A 196 196 ASP N N 196 121.819 120.696 1.123 1 1 1117 . 17 1 1 A 197 197 ALA H H 197 7.999 8.675 -0.676 1 1 1121 . 17 1 1 A 197 197 ALA C C 197 176.847 176.651 0.196 1 1 1122 . 17 1 1 A 197 197 ALA CA C 197 51.612 53.060 -1.448 1 1 1123 . 17 1 1 A 197 197 ALA CB C 197 18.192 18.878 -0.686 1 1 1124 . 17 1 1 A 197 197 ALA N N 197 124.262 125.761 -1.499 1 1 1125 . 17 1 1 A 198 198 ALA H H 198 8.042 8.747 -0.705 1 1 1126 . 17 1 1 A 198 198 ALA C C 198 176.865 177.831 -0.966 1 1 1127 . 17 1 1 A 198 198 ALA CA C 198 49.999 53.377 -3.378 1 1 1128 . 17 1 1 A 198 198 ALA CB C 198 17.327 20.196 -2.869 1 1 1129 . 17 1 1 A 198 198 ALA N N 198 124.724 126.038 -1.314 1 1 1130 . 17 1 1 A 199 199 PRO C C 199 176.727 176.144 0.583 1 1 1131 . 17 1 1 A 199 199 PRO CA C 199 62.399 65.971 -3.572 1 1 1132 . 17 1 1 A 199 199 PRO CB C 199 30.949 31.246 -0.297 1 1 1135 . 17 1 1 A 200 200 VAL H H 200 8.026 7.329 0.697 1 1 1142 . 17 1 1 A 200 200 VAL C C 200 176.034 173.621 2.413 1 1 1143 . 17 1 1 A 200 200 VAL CA C 200 61.944 59.595 2.349 1 1 1144 . 17 1 1 A 200 200 VAL CB C 200 31.734 36.162 -4.428 1 1 1147 . 17 1 1 A 200 200 VAL N N 200 120.635 111.676 8.959 1 1 1148 . 17 1 1 A 201 201 VAL H H 201 7.966 8.429 -0.463 1 1 1155 . 17 1 1 A 201 201 VAL C C 201 175.128 176.666 -1.538 1 1 1156 . 17 1 1 A 201 201 VAL CA C 201 61.249 59.062 2.187 1 1 1157 . 17 1 1 A 201 201 VAL CB C 201 31.917 34.838 -2.921 1 1 1160 . 17 1 1 A 201 201 VAL N N 201 124.053 115.165 8.888 1 1 1161 . 17 1 1 A 202 202 ALA H H 202 8.159 8.525 -0.366 1 1 1162 . 17 1 1 A 202 202 ALA C C 202 175.153 178.040 -2.887 1 1 1163 . 17 1 1 A 202 202 ALA CA C 202 49.742 56.821 -7.079 1 1 1164 . 17 1 1 A 202 202 ALA CB C 202 17.532 17.273 0.259 1 1 1165 . 17 1 1 A 202 202 ALA N N 202 129.251 123.533 5.718 1 1 1166 . 17 1 1 A 203 203 PRO C C 203 176.273 176.272 0.001 1 1 1167 . 17 1 1 A 203 203 PRO CA C 203 62.324 62.444 -0.120 1 1 1168 . 17 1 1 A 203 203 PRO CB C 203 31.042 32.690 -1.648 1 1 1170 . 17 1 1 A 204 204 ALA H H 204 8.137 8.325 -0.188 1 1 1171 . 17 1 1 A 204 204 ALA C C 204 175.697 174.599 1.098 1 1 1172 . 17 1 1 A 204 204 ALA CA C 204 49.865 49.750 0.115 1 1 1173 . 17 1 1 A 204 204 ALA CB C 204 17.364 22.040 -4.676 1 1 1174 . 17 1 1 A 204 204 ALA N N 204 125.510 122.836 2.674 1 1 1175 . 17 1 1 A 205 205 PRO C C 205 175.430 175.747 -0.317 1 1 1176 . 17 1 1 A 205 205 PRO CA C 205 62.511 62.356 0.155 1 1 1177 . 17 1 1 A 205 205 PRO CB C 205 31.056 31.774 -0.718 1 1 1179 . 17 1 1 A 206 206 ALA H H 206 7.847 8.531 -0.684 1 1 1180 . 17 1 1 A 206 206 ALA C C 206 175.565 176.189 -0.624 1 1 1181 . 17 1 1 A 206 206 ALA CA C 206 49.487 49.621 -0.134 1 1 1182 . 17 1 1 A 206 206 ALA CB C 206 18.843 19.376 -0.533 1 1 1183 . 17 1 1 A 206 206 ALA N N 206 123.663 125.912 -2.249 1 1 1184 . 17 1 1 A 207 207 PRO C C 207 174.397 176.523 -2.126 1 1 1185 . 17 1 1 A 207 207 PRO CA C 207 61.454 65.680 -4.226 1 1 1186 . 17 1 1 A 207 207 PRO CB C 207 31.929 31.461 0.468 1 1 1187 . 17 1 1 A 208 208 ALA H H 208 7.898 7.983 -0.085 1 1 1188 . 17 1 1 A 208 208 ALA C C 208 175.411 177.101 -1.690 1 1 1189 . 17 1 1 A 208 208 ALA CA C 208 49.472 50.355 -0.883 1 1 1190 . 17 1 1 A 208 208 ALA CB C 208 19.082 19.214 -0.132 1 1 1191 . 17 1 1 A 208 208 ALA N N 208 127.450 119.783 7.667 1 1 1192 . 17 1 1 A 209 209 PRO C C 209 176.932 176.946 -0.014 1 1 1193 . 17 1 1 A 209 209 PRO CA C 209 62.736 64.755 -2.019 1 1 1194 . 17 1 1 A 209 209 PRO CB C 209 31.012 31.924 -0.912 1 1 1 . 18 1 1 A 2 2 ARG C C 2 175.857 178.009 -2.152 1 1 2 . 18 1 1 A 2 2 ARG CA C 2 55.872 57.526 -1.654 1 1 3 . 18 1 1 A 2 2 ARG CB C 2 29.983 32.699 -2.716 1 1 5 . 18 1 1 A 3 3 ILE H H 3 8.238 8.145 0.093 1 1 9 . 18 1 1 A 3 3 ILE C C 3 175.763 175.576 0.187 1 1 10 . 18 1 1 A 3 3 ILE CA C 3 60.779 62.460 -1.681 1 1 11 . 18 1 1 A 3 3 ILE CB C 3 37.664 40.923 -3.259 1 1 15 . 18 1 1 A 3 3 ILE N N 3 122.580 119.056 3.524 1 1 16 . 18 1 1 A 4 4 MET H H 4 8.261 7.851 0.410 1 1 17 . 18 1 1 A 4 4 MET C C 4 175.660 175.341 0.319 1 1 18 . 18 1 1 A 4 4 MET CA C 4 54.893 54.405 0.488 1 1 19 . 18 1 1 A 4 4 MET CB C 4 32.060 33.681 -1.621 1 1 22 . 18 1 1 A 4 4 MET N N 4 123.988 118.646 5.342 1 1 23 . 18 1 1 A 5 5 LYS H H 5 8.041 8.501 -0.460 1 1 24 . 18 1 1 A 5 5 LYS C C 5 175.850 176.362 -0.512 1 1 25 . 18 1 1 A 5 5 LYS CA C 5 56.081 56.833 -0.752 1 1 26 . 18 1 1 A 5 5 LYS CB C 5 32.220 34.476 -2.256 1 1 29 . 18 1 1 A 5 5 LYS N N 5 122.015 119.834 2.181 1 1 30 . 18 1 1 A 6 6 ALA H H 6 8.042 7.680 0.362 1 1 34 . 18 1 1 A 6 6 ALA C C 6 177.160 177.818 -0.658 1 1 35 . 18 1 1 A 6 6 ALA CA C 6 52.109 51.484 0.625 1 1 36 . 18 1 1 A 6 6 ALA CB C 6 18.637 17.342 1.295 1 1 37 . 18 1 1 A 6 6 ALA N N 6 123.943 120.515 3.428 1 1 38 . 18 1 1 A 7 7 ILE H H 7 7.916 8.538 -0.622 1 1 42 . 18 1 1 A 7 7 ILE C C 7 175.611 175.975 -0.364 1 1 43 . 18 1 1 A 7 7 ILE CA C 7 61.181 63.008 -1.827 1 1 44 . 18 1 1 A 7 7 ILE CB C 7 37.910 38.624 -0.714 1 1 48 . 18 1 1 A 7 7 ILE N N 7 118.380 122.797 -4.417 1 1 49 . 18 1 1 A 8 8 PHE H H 8 8.167 7.645 0.522 1 1 50 . 18 1 1 A 8 8 PHE C C 8 175.363 174.649 0.714 1 1 51 . 18 1 1 A 8 8 PHE CA C 8 57.286 58.084 -0.798 1 1 52 . 18 1 1 A 8 8 PHE CB C 8 39.008 42.282 -3.274 1 1 53 . 18 1 1 A 8 8 PHE N N 8 121.971 116.928 5.043 1 1 54 . 18 1 1 A 9 9 VAL H H 9 7.872 8.298 -0.426 1 1 61 . 18 1 1 A 9 9 VAL C C 9 175.405 176.913 -1.508 1 1 62 . 18 1 1 A 9 9 VAL CA C 9 61.662 63.318 -1.656 1 1 63 . 18 1 1 A 9 9 VAL CB C 9 32.026 34.748 -2.722 1 1 66 . 18 1 1 A 9 9 VAL N N 9 120.864 125.461 -4.597 1 1 67 . 18 1 1 A 10 10 LEU H H 10 8.077 7.984 0.093 1 1 74 . 18 1 1 A 10 10 LEU C C 10 176.652 176.120 0.532 1 1 75 . 18 1 1 A 10 10 LEU CA C 10 54.856 56.094 -1.238 1 1 76 . 18 1 1 A 10 10 LEU CB C 10 41.401 44.311 -2.910 1 1 80 . 18 1 1 A 10 10 LEU N N 10 124.826 119.197 5.629 1 1 81 . 18 1 1 A 11 11 ASN H H 11 8.177 7.807 0.370 1 1 82 . 18 1 1 A 11 11 ASN C C 11 174.394 174.287 0.107 1 1 83 . 18 1 1 A 11 11 ASN CA C 11 52.704 53.702 -0.998 1 1 84 . 18 1 1 A 11 11 ASN CB C 11 38.468 39.031 -0.563 1 1 85 . 18 1 1 A 11 11 ASN N N 11 119.029 117.580 1.449 1 1 86 . 18 1 1 A 12 12 ALA H H 12 7.991 8.596 -0.605 1 1 90 . 18 1 1 A 12 12 ALA C C 12 176.649 175.373 1.276 1 1 91 . 18 1 1 A 12 12 ALA CA C 12 51.950 50.268 1.682 1 1 92 . 18 1 1 A 12 12 ALA CB C 12 18.659 22.573 -3.914 1 1 93 . 18 1 1 A 12 12 ALA N N 12 123.695 129.123 -5.428 1 1 94 . 18 1 1 A 13 13 ALA H H 13 8.083 8.742 -0.659 1 1 95 . 18 1 1 A 13 13 ALA C C 13 175.395 176.009 -0.614 1 1 96 . 18 1 1 A 13 13 ALA CA C 13 49.797 50.312 -0.515 1 1 97 . 18 1 1 A 13 13 ALA CB C 13 17.486 18.463 -0.977 1 1 98 . 18 1 1 A 13 13 ALA N N 13 124.281 124.543 -0.262 1 1 99 . 18 1 1 A 14 14 PRO C C 14 176.641 176.410 0.231 1 1 100 . 18 1 1 A 14 14 PRO CA C 14 62.675 62.237 0.438 1 1 101 . 18 1 1 A 14 14 PRO CB C 14 31.000 33.017 -2.017 1 1 103 . 18 1 1 A 15 15 LYS H H 15 8.283 8.350 -0.067 1 1 104 . 18 1 1 A 15 15 LYS C C 15 175.683 175.796 -0.113 1 1 105 . 18 1 1 A 15 15 LYS CA C 15 55.429 55.423 0.006 1 1 106 . 18 1 1 A 15 15 LYS CB C 15 32.246 33.489 -1.243 1 1 109 . 18 1 1 A 15 15 LYS N N 15 119.069 117.105 1.964 1 1 110 . 18 1 1 A 16 16 ASP H H 16 7.880 8.495 -0.615 1 1 111 . 18 1 1 A 16 16 ASP C C 16 175.419 176.100 -0.681 1 1 112 . 18 1 1 A 16 16 ASP CA C 16 54.413 54.995 -0.582 1 1 113 . 18 1 1 A 16 16 ASP CB C 16 40.224 41.401 -1.177 1 1 114 . 18 1 1 A 16 16 ASP N N 16 119.625 125.987 -6.362 1 1 115 . 18 1 1 A 17 17 ASN H H 17 7.973 8.843 -0.870 1 1 116 . 18 1 1 A 17 17 ASN C C 17 174.231 175.337 -1.106 1 1 117 . 18 1 1 A 17 17 ASN CA C 17 53.948 51.940 2.008 1 1 118 . 18 1 1 A 17 17 ASN CB C 17 37.009 41.379 -4.370 1 1 119 . 18 1 1 A 17 17 ASN N N 17 118.063 119.375 -1.312 1 1 120 . 18 1 1 A 18 18 THR H H 18 7.318 9.069 -1.751 1 1 121 . 18 1 1 A 18 18 THR C C 18 172.323 173.568 -1.245 1 1 122 . 18 1 1 A 18 18 THR CA C 18 60.153 59.331 0.822 1 1 123 . 18 1 1 A 18 18 THR CB C 18 71.534 72.264 -0.730 1 1 125 . 18 1 1 A 18 18 THR N N 18 109.092 110.742 -1.650 1 1 126 . 18 1 1 A 19 19 TRP H H 19 8.541 8.731 -0.190 1 1 127 . 18 1 1 A 19 19 TRP C C 19 175.969 174.986 0.983 1 1 128 . 18 1 1 A 19 19 TRP CA C 19 55.700 55.989 -0.289 1 1 129 . 18 1 1 A 19 19 TRP CB C 19 31.471 33.523 -2.052 1 1 130 . 18 1 1 A 19 19 TRP N N 19 121.992 121.130 0.862 1 1 131 . 18 1 1 A 20 20 TYR H H 20 8.691 9.194 -0.503 1 1 132 . 18 1 1 A 20 20 TYR C C 20 173.684 174.786 -1.102 1 1 133 . 18 1 1 A 20 20 TYR CA C 20 55.805 56.104 -0.299 1 1 134 . 18 1 1 A 20 20 TYR CB C 20 40.513 42.098 -1.585 1 1 135 . 18 1 1 A 20 20 TYR N N 20 116.519 121.299 -4.780 1 1 136 . 18 1 1 A 21 21 ALA H H 21 8.876 8.524 0.352 1 1 137 . 18 1 1 A 21 21 ALA C C 21 175.395 175.950 -0.555 1 1 138 . 18 1 1 A 21 21 ALA CA C 21 50.970 51.173 -0.203 1 1 139 . 18 1 1 A 21 21 ALA CB C 21 22.142 23.369 -1.227 1 1 140 . 18 1 1 A 21 21 ALA N N 21 119.359 122.679 -3.320 1 1 141 . 18 1 1 A 22 22 GLY H H 22 8.613 8.379 0.234 1 1 142 . 18 1 1 A 22 22 GLY C C 22 171.458 172.098 -0.640 1 1 143 . 18 1 1 A 22 22 GLY CA C 22 45.608 46.125 -0.517 1 1 144 . 18 1 1 A 22 22 GLY N N 22 106.678 106.233 0.445 1 1 145 . 18 1 1 A 23 23 GLY H H 23 7.911 8.472 -0.561 1 1 146 . 18 1 1 A 23 23 GLY C C 23 170.563 172.185 -1.622 1 1 147 . 18 1 1 A 23 23 GLY CA C 23 44.026 44.558 -0.532 1 1 148 . 18 1 1 A 23 23 GLY N N 23 103.399 108.637 -5.238 1 1 149 . 18 1 1 A 24 24 LYS H H 24 9.001 8.761 0.240 1 1 150 . 18 1 1 A 24 24 LYS C C 24 172.965 174.830 -1.865 1 1 151 . 18 1 1 A 24 24 LYS CA C 24 54.062 54.501 -0.439 1 1 152 . 18 1 1 A 24 24 LYS CB C 24 36.774 36.735 0.039 1 1 156 . 18 1 1 A 24 24 LYS N N 24 116.402 121.468 -5.066 1 1 157 . 18 1 1 A 25 25 LEU H H 25 8.587 9.245 -0.658 1 1 164 . 18 1 1 A 25 25 LEU C C 25 175.205 175.036 0.169 1 1 165 . 18 1 1 A 25 25 LEU CA C 25 53.446 53.194 0.252 1 1 166 . 18 1 1 A 25 25 LEU CB C 25 46.287 46.587 -0.300 1 1 170 . 18 1 1 A 25 25 LEU N N 25 119.932 124.222 -4.290 1 1 171 . 18 1 1 A 26 26 GLY H H 26 8.637 8.144 0.493 1 1 172 . 18 1 1 A 26 26 GLY C C 26 170.804 171.653 -0.849 1 1 173 . 18 1 1 A 26 26 GLY CA C 26 45.669 45.202 0.467 1 1 174 . 18 1 1 A 26 26 GLY N N 26 108.136 110.440 -2.304 1 1 175 . 18 1 1 A 27 27 TRP H H 27 8.642 8.459 0.183 1 1 177 . 18 1 1 A 27 27 TRP C C 27 174.820 175.087 -0.267 1 1 178 . 18 1 1 A 27 27 TRP CB C 27 30.883 33.045 -2.162 1 1 179 . 18 1 1 A 27 27 TRP N N 27 120.887 120.570 0.317 1 1 181 . 18 1 1 A 32 32 ASP C C 32 176.315 176.066 0.249 1 1 182 . 18 1 1 A 32 32 ASP CA C 32 53.737 52.393 1.344 1 1 183 . 18 1 1 A 32 32 ASP CB C 32 41.230 41.670 -0.440 1 1 184 . 18 1 1 A 33 33 THR H H 33 8.190 8.713 -0.523 1 1 188 . 18 1 1 A 33 33 THR C C 33 175.291 176.017 -0.726 1 1 189 . 18 1 1 A 33 33 THR CA C 33 61.909 62.545 -0.636 1 1 190 . 18 1 1 A 33 33 THR CB C 33 68.961 70.522 -1.561 1 1 192 . 18 1 1 A 33 33 THR N N 33 114.235 118.524 -4.289 1 1 193 . 18 1 1 A 34 34 GLY H H 34 8.341 8.396 -0.055 1 1 194 . 18 1 1 A 34 34 GLY C C 34 173.766 173.957 -0.191 1 1 195 . 18 1 1 A 34 34 GLY CA C 34 44.941 46.047 -1.106 1 1 196 . 18 1 1 A 34 34 GLY N N 34 110.678 111.582 -0.904 1 1 197 . 18 1 1 A 35 35 PHE H H 35 7.945 7.790 0.155 1 1 198 . 18 1 1 A 35 35 PHE C C 35 175.411 174.706 0.705 1 1 199 . 18 1 1 A 35 35 PHE CA C 35 57.921 57.157 0.764 1 1 200 . 18 1 1 A 35 35 PHE CB C 35 38.806 40.095 -1.289 1 1 201 . 18 1 1 A 35 35 PHE N N 35 120.533 121.495 -0.962 1 1 202 . 18 1 1 A 36 36 TYR H H 36 7.967 7.852 0.115 1 1 203 . 18 1 1 A 36 36 TYR C C 36 176.104 175.008 1.096 1 1 204 . 18 1 1 A 36 36 TYR CA C 36 57.568 56.920 0.648 1 1 205 . 18 1 1 A 36 36 TYR CB C 36 37.727 40.164 -2.437 1 1 206 . 18 1 1 A 36 36 TYR N N 36 120.254 122.647 -2.393 1 1 207 . 18 1 1 A 37 37 GLY H H 37 7.666 6.998 0.668 1 1 208 . 18 1 1 A 37 37 GLY C C 37 173.794 174.450 -0.656 1 1 209 . 18 1 1 A 37 37 GLY CA C 37 45.007 44.528 0.479 1 1 210 . 18 1 1 A 37 37 GLY N N 37 108.995 108.073 0.922 1 1 211 . 18 1 1 A 38 38 ASN H H 38 8.109 8.768 -0.659 1 1 212 . 18 1 1 A 38 38 ASN C C 38 175.612 176.908 -1.296 1 1 213 . 18 1 1 A 38 38 ASN CA C 38 52.954 56.324 -3.370 1 1 214 . 18 1 1 A 38 38 ASN CB C 38 38.425 38.627 -0.202 1 1 215 . 18 1 1 A 38 38 ASN N N 38 118.603 121.834 -3.231 1 1 216 . 18 1 1 A 39 39 GLY H H 39 8.202 7.963 0.239 1 1 217 . 18 1 1 A 39 39 GLY C C 39 173.958 173.586 0.372 1 1 218 . 18 1 1 A 39 39 GLY CA C 39 45.012 45.904 -0.892 1 1 219 . 18 1 1 A 39 39 GLY N N 39 108.897 106.732 2.165 1 1 220 . 18 1 1 A 40 40 PHE H H 40 7.960 7.812 0.148 1 1 221 . 18 1 1 A 40 40 PHE C C 40 175.653 174.038 1.615 1 1 222 . 18 1 1 A 40 40 PHE CA C 40 57.556 56.606 0.950 1 1 223 . 18 1 1 A 40 40 PHE CB C 40 38.513 42.427 -3.914 1 1 224 . 18 1 1 A 40 40 PHE N N 40 119.829 119.745 0.084 1 1 225 . 18 1 1 A 41 41 GLN H H 41 8.173 8.197 -0.024 1 1 226 . 18 1 1 A 41 41 GLN C C 41 175.234 173.651 1.583 1 1 227 . 18 1 1 A 41 41 GLN CA C 41 55.488 54.376 1.112 1 1 228 . 18 1 1 A 41 41 GLN CB C 41 28.523 32.527 -4.004 1 1 230 . 18 1 1 A 41 41 GLN N N 41 120.810 119.157 1.653 1 1 231 . 18 1 1 A 42 42 ASN H H 42 8.193 9.156 -0.963 1 1 232 . 18 1 1 A 42 42 ASN C C 42 174.618 174.907 -0.289 1 1 233 . 18 1 1 A 42 42 ASN CA C 42 52.924 51.726 1.198 1 1 234 . 18 1 1 A 42 42 ASN CB C 42 38.333 41.407 -3.074 1 1 235 . 18 1 1 A 42 42 ASN N N 42 119.679 122.673 -2.994 1 1 236 . 18 1 1 A 43 43 ASN H H 43 8.255 8.923 -0.668 1 1 237 . 18 1 1 A 43 43 ASN C C 43 173.873 175.451 -1.578 1 1 238 . 18 1 1 A 43 43 ASN CA C 43 52.919 52.672 0.247 1 1 239 . 18 1 1 A 43 43 ASN CB C 43 38.580 39.207 -0.627 1 1 240 . 18 1 1 A 43 43 ASN N N 43 119.773 118.216 1.557 1 1 241 . 18 1 1 A 44 44 ASN H H 44 7.865 8.070 -0.205 1 1 242 . 18 1 1 A 44 44 ASN C C 44 175.518 175.271 0.247 1 1 243 . 18 1 1 A 44 44 ASN CA C 44 54.528 53.093 1.435 1 1 244 . 18 1 1 A 44 44 ASN CB C 44 40.170 39.372 0.798 1 1 246 . 18 1 1 A 44 44 ASN N N 44 124.152 118.429 5.723 1 1 247 . 18 1 1 A 46 46 PRO C C 46 177.228 176.012 1.216 1 1 248 . 18 1 1 A 46 46 PRO CA C 46 62.794 62.838 -0.044 1 1 249 . 18 1 1 A 46 46 PRO CB C 46 31.283 33.069 -1.786 1 1 251 . 18 1 1 A 47 47 THR H H 47 8.165 8.419 -0.254 1 1 255 . 18 1 1 A 47 47 THR C C 47 174.573 173.203 1.370 1 1 256 . 18 1 1 A 47 47 THR CA C 47 61.346 60.140 1.206 1 1 257 . 18 1 1 A 47 47 THR CB C 47 69.573 71.355 -1.782 1 1 259 . 18 1 1 A 47 47 THR N N 47 114.265 111.266 2.999 1 1 260 . 18 1 1 A 48 48 ARG H H 48 8.237 8.701 -0.464 1 1 261 . 18 1 1 A 48 48 ARG C C 48 175.898 175.883 0.015 1 1 262 . 18 1 1 A 48 48 ARG CA C 48 55.717 56.312 -0.595 1 1 263 . 18 1 1 A 48 48 ARG CB C 48 30.151 30.858 -0.707 1 1 266 . 18 1 1 A 48 48 ARG N N 48 122.795 125.814 -3.019 1 1 267 . 18 1 1 A 49 49 ASN H H 49 8.369 8.750 -0.381 1 1 268 . 18 1 1 A 49 49 ASN C C 49 174.560 174.236 0.324 1 1 269 . 18 1 1 A 49 49 ASN CA C 49 53.005 51.736 1.269 1 1 270 . 18 1 1 A 49 49 ASN CB C 49 38.761 40.798 -2.037 1 1 271 . 18 1 1 A 49 49 ASN N N 49 119.837 121.151 -1.314 1 1 272 . 18 1 1 A 50 50 ASP H H 50 8.192 8.269 -0.077 1 1 273 . 18 1 1 A 50 50 ASP C C 50 175.699 175.976 -0.277 1 1 274 . 18 1 1 A 50 50 ASP CA C 50 54.289 54.188 0.101 1 1 275 . 18 1 1 A 50 50 ASP CB C 50 41.264 41.552 -0.288 1 1 276 . 18 1 1 A 50 50 ASP N N 50 120.403 122.954 -2.551 1 1 277 . 18 1 1 A 51 51 GLN H H 51 8.428 8.657 -0.229 1 1 278 . 18 1 1 A 51 51 GLN C C 51 175.186 176.195 -1.009 1 1 279 . 18 1 1 A 51 51 GLN CA C 51 54.512 56.499 -1.987 1 1 280 . 18 1 1 A 51 51 GLN CB C 51 30.424 29.105 1.319 1 1 282 . 18 1 1 A 51 51 GLN N N 51 118.959 122.444 -3.485 1 1 289 . 18 1 1 A 52 52 LEU C C 52 176.018 175.675 0.343 1 1 290 . 18 1 1 A 52 52 LEU CA C 52 54.332 52.744 1.588 1 1 291 . 18 1 1 A 52 52 LEU CB C 52 43.022 43.718 -0.696 1 1 294 . 18 1 1 A 53 53 GLY H H 53 8.639 8.669 -0.030 1 1 295 . 18 1 1 A 53 53 GLY C C 53 171.931 171.516 0.415 1 1 296 . 18 1 1 A 53 53 GLY CA C 53 43.501 44.322 -0.821 1 1 297 . 18 1 1 A 53 53 GLY N N 53 109.964 107.276 2.688 1 1 298 . 18 1 1 A 54 54 ALA H H 54 8.881 8.860 0.021 1 1 299 . 18 1 1 A 54 54 ALA C C 54 175.543 176.717 -1.174 1 1 300 . 18 1 1 A 54 54 ALA CA C 54 50.710 50.395 0.315 1 1 301 . 18 1 1 A 54 54 ALA CB C 54 22.914 21.590 1.324 1 1 302 . 18 1 1 A 54 54 ALA N N 54 120.413 125.046 -4.633 1 1 303 . 18 1 1 A 55 55 GLY H H 55 8.346 8.775 -0.429 1 1 304 . 18 1 1 A 55 55 GLY C C 55 170.960 171.239 -0.279 1 1 305 . 18 1 1 A 55 55 GLY CA C 55 46.704 44.457 2.247 1 1 306 . 18 1 1 A 55 55 GLY N N 55 104.688 109.881 -5.193 1 1 307 . 18 1 1 A 56 56 ALA H H 56 9.116 8.685 0.431 1 1 308 . 18 1 1 A 56 56 ALA C C 56 176.472 176.211 0.261 1 1 309 . 18 1 1 A 56 56 ALA CA C 56 49.638 50.338 -0.700 1 1 310 . 18 1 1 A 56 56 ALA CB C 56 22.275 21.748 0.527 1 1 311 . 18 1 1 A 56 56 ALA N N 56 120.608 123.982 -3.374 1 1 312 . 18 1 1 A 57 57 PHE H H 57 8.688 9.233 -0.545 1 1 313 . 18 1 1 A 57 57 PHE C C 57 172.816 175.620 -2.804 1 1 314 . 18 1 1 A 57 57 PHE CA C 57 56.066 55.914 0.152 1 1 315 . 18 1 1 A 57 57 PHE CB C 57 41.770 42.866 -1.096 1 1 316 . 18 1 1 A 57 57 PHE N N 57 120.027 118.707 1.320 1 1 317 . 18 1 1 A 58 58 GLY H H 58 9.034 8.615 0.419 1 1 318 . 18 1 1 A 58 58 GLY C C 58 170.860 172.061 -1.201 1 1 319 . 18 1 1 A 58 58 GLY CA C 58 44.954 44.861 0.093 1 1 320 . 18 1 1 A 58 58 GLY N N 58 105.817 109.936 -4.119 1 1 321 . 18 1 1 A 59 59 GLY H H 59 8.382 8.890 -0.508 1 1 322 . 18 1 1 A 59 59 GLY C C 59 169.284 172.389 -3.105 1 1 323 . 18 1 1 A 59 59 GLY CA C 59 45.840 43.951 1.889 1 1 324 . 18 1 1 A 59 59 GLY N N 59 109.059 110.996 -1.937 1 1 325 . 18 1 1 A 60 60 TYR H H 60 8.430 8.777 -0.347 1 1 326 . 18 1 1 A 60 60 TYR C C 60 173.453 172.580 0.873 1 1 327 . 18 1 1 A 60 60 TYR CA C 60 55.282 55.622 -0.340 1 1 328 . 18 1 1 A 60 60 TYR CB C 60 41.712 40.988 0.724 1 1 329 . 18 1 1 A 60 60 TYR N N 60 118.352 115.276 3.076 1 1 330 . 18 1 1 A 61 61 GLN H H 61 8.833 8.566 0.267 1 1 331 . 18 1 1 A 61 61 GLN C C 61 174.365 175.316 -0.951 1 1 332 . 18 1 1 A 61 61 GLN CA C 61 54.125 55.930 -1.805 1 1 333 . 18 1 1 A 61 61 GLN CB C 61 28.033 30.056 -2.023 1 1 335 . 18 1 1 A 61 61 GLN N N 61 129.628 122.240 7.388 1 1 336 . 18 1 1 A 62 62 VAL H H 62 8.714 8.755 -0.041 1 1 343 . 18 1 1 A 62 62 VAL C C 62 175.758 175.272 0.486 1 1 344 . 18 1 1 A 62 62 VAL CA C 62 64.649 63.311 1.338 1 1 345 . 18 1 1 A 62 62 VAL CB C 62 31.900 34.176 -2.276 1 1 348 . 18 1 1 A 62 62 VAL N N 62 127.666 126.014 1.652 1 1 349 . 18 1 1 A 63 63 ASN H H 63 8.062 8.206 -0.144 1 1 350 . 18 1 1 A 63 63 ASN C C 63 172.827 173.996 -1.169 1 1 351 . 18 1 1 A 63 63 ASN CA C 63 51.575 49.989 1.586 1 1 352 . 18 1 1 A 63 63 ASN CB C 63 37.194 39.580 -2.386 1 1 353 . 18 1 1 A 63 63 ASN N N 63 116.310 117.319 -1.009 1 1 354 . 18 1 1 A 64 64 PRO C C 64 175.071 174.846 0.225 1 1 355 . 18 1 1 A 64 64 PRO CA C 64 65.296 62.405 2.891 1 1 356 . 18 1 1 A 64 64 PRO CB C 64 30.428 29.105 1.323 1 1 357 . 18 1 1 A 65 65 TYR H H 65 7.873 8.702 -0.829 1 1 358 . 18 1 1 A 65 65 TYR C C 65 175.145 175.646 -0.501 1 1 359 . 18 1 1 A 65 65 TYR CA C 65 56.125 58.897 -2.772 1 1 360 . 18 1 1 A 65 65 TYR CB C 65 39.189 41.026 -1.837 1 1 361 . 18 1 1 A 65 65 TYR N N 65 112.894 121.438 -8.544 1 1 362 . 18 1 1 A 66 66 LEU H H 66 7.308 7.741 -0.433 1 1 369 . 18 1 1 A 66 66 LEU C C 66 173.866 174.564 -0.698 1 1 370 . 18 1 1 A 66 66 LEU CA C 66 53.431 53.771 -0.340 1 1 371 . 18 1 1 A 66 66 LEU CB C 66 44.958 44.577 0.381 1 1 375 . 18 1 1 A 66 66 LEU N N 66 120.270 116.071 4.199 1 1 376 . 18 1 1 A 67 67 GLY H H 67 8.855 8.513 0.342 1 1 377 . 18 1 1 A 67 67 GLY C C 67 170.698 172.108 -1.410 1 1 378 . 18 1 1 A 67 67 GLY CA C 67 44.008 44.045 -0.037 1 1 379 . 18 1 1 A 67 67 GLY N N 67 114.388 106.614 7.774 1 1 380 . 18 1 1 A 68 68 PHE H H 68 8.770 8.256 0.514 1 1 381 . 18 1 1 A 68 68 PHE C C 68 173.386 174.452 -1.066 1 1 382 . 18 1 1 A 68 68 PHE CA C 68 56.507 58.116 -1.609 1 1 383 . 18 1 1 A 68 68 PHE CB C 68 42.428 39.921 2.507 1 1 384 . 18 1 1 A 68 68 PHE N N 68 117.510 121.602 -4.092 1 1 385 . 18 1 1 A 69 69 GLU H H 69 9.079 8.832 0.247 1 1 386 . 18 1 1 A 69 69 GLU C C 69 174.556 174.693 -0.137 1 1 387 . 18 1 1 A 69 69 GLU CA C 69 54.939 54.678 0.261 1 1 388 . 18 1 1 A 69 69 GLU CB C 69 33.963 33.300 0.663 1 1 390 . 18 1 1 A 69 69 GLU N N 69 120.562 125.820 -5.258 1 1 391 . 18 1 1 A 70 70 MET H H 70 9.481 9.642 -0.161 1 1 392 . 18 1 1 A 70 70 MET C C 70 174.595 175.321 -0.726 1 1 393 . 18 1 1 A 70 70 MET CA C 70 53.091 53.694 -0.603 1 1 394 . 18 1 1 A 70 70 MET CB C 70 36.159 34.549 1.610 1 1 397 . 18 1 1 A 70 70 MET N N 70 124.928 123.819 1.109 1 1 398 . 18 1 1 A 71 71 GLY H H 71 8.845 8.884 -0.039 1 1 399 . 18 1 1 A 71 71 GLY C C 71 170.811 171.364 -0.553 1 1 400 . 18 1 1 A 71 71 GLY CA C 71 44.624 43.983 0.641 1 1 401 . 18 1 1 A 71 71 GLY N N 71 108.896 109.243 -0.347 1 1 402 . 18 1 1 A 72 72 TYR H H 72 8.925 9.010 -0.085 1 1 403 . 18 1 1 A 72 72 TYR C C 72 173.278 174.193 -0.915 1 1 404 . 18 1 1 A 72 72 TYR CA C 72 55.912 56.427 -0.515 1 1 405 . 18 1 1 A 72 72 TYR CB C 72 41.611 40.763 0.848 1 1 406 . 18 1 1 A 72 72 TYR N N 72 123.253 121.725 1.528 1 1 407 . 18 1 1 A 73 73 ASP H H 73 8.665 9.217 -0.552 1 1 408 . 18 1 1 A 73 73 ASP C C 73 173.598 175.430 -1.832 1 1 409 . 18 1 1 A 73 73 ASP CA C 73 52.857 53.439 -0.582 1 1 410 . 18 1 1 A 73 73 ASP CB C 73 42.774 42.730 0.044 1 1 411 . 18 1 1 A 73 73 ASP N N 73 126.178 125.046 1.132 1 1 412 . 18 1 1 A 74 74 TRP H H 74 9.080 8.609 0.471 1 1 413 . 18 1 1 A 74 74 TRP C C 74 174.868 175.644 -0.776 1 1 414 . 18 1 1 A 74 74 TRP CB C 74 30.083 32.346 -2.263 1 1 415 . 18 1 1 A 74 74 TRP N N 74 121.824 127.987 -6.163 1 1 416 . 18 1 1 A 78 78 MET C C 78 174.548 175.339 -0.791 1 1 417 . 18 1 1 A 78 78 MET CA C 78 54.388 56.782 -2.394 1 1 418 . 18 1 1 A 78 78 MET CB C 78 32.542 34.522 -1.980 1 1 419 . 18 1 1 A 79 79 ALA H H 79 8.105 7.864 0.241 1 1 420 . 18 1 1 A 79 79 ALA C C 79 176.629 177.532 -0.903 1 1 421 . 18 1 1 A 79 79 ALA CA C 79 51.210 52.078 -0.868 1 1 422 . 18 1 1 A 79 79 ALA CB C 79 19.106 19.492 -0.386 1 1 423 . 18 1 1 A 79 79 ALA N N 79 125.778 122.772 3.006 1 1 424 . 18 1 1 A 80 80 TYR H H 80 8.035 8.968 -0.933 1 1 425 . 18 1 1 A 80 80 TYR C C 80 175.604 174.405 1.199 1 1 426 . 18 1 1 A 80 80 TYR CA C 80 57.021 56.183 0.838 1 1 427 . 18 1 1 A 80 80 TYR CB C 80 38.416 36.184 2.232 1 1 428 . 18 1 1 A 80 80 TYR N N 80 120.045 123.790 -3.745 1 1 429 . 18 1 1 A 81 81 LYS H H 81 8.295 7.630 0.665 1 1 430 . 18 1 1 A 81 81 LYS C C 81 176.647 175.287 1.360 1 1 431 . 18 1 1 A 81 81 LYS CA C 81 56.285 55.170 1.115 1 1 432 . 18 1 1 A 81 81 LYS CB C 81 31.571 35.883 -4.312 1 1 434 . 18 1 1 A 81 81 LYS N N 81 123.191 122.037 1.154 1 1 435 . 18 1 1 A 82 82 GLY H H 82 8.117 8.724 -0.607 1 1 436 . 18 1 1 A 82 82 GLY C C 82 174.010 172.014 1.996 1 1 437 . 18 1 1 A 82 82 GLY CA C 82 44.982 45.118 -0.136 1 1 438 . 18 1 1 A 82 82 GLY N N 82 110.014 112.387 -2.373 1 1 439 . 18 1 1 A 83 83 SER H H 83 7.938 8.670 -0.732 1 1 440 . 18 1 1 A 83 83 SER C C 83 174.634 174.011 0.623 1 1 441 . 18 1 1 A 83 83 SER CA C 83 57.685 59.157 -1.472 1 1 442 . 18 1 1 A 83 83 SER CB C 83 63.303 63.463 -0.160 1 1 443 . 18 1 1 A 83 83 SER N N 83 115.655 116.391 -0.736 1 1 444 . 18 1 1 A 84 84 VAL H H 84 8.008 8.587 -0.579 1 1 451 . 18 1 1 A 84 84 VAL C C 84 175.525 175.709 -0.184 1 1 452 . 18 1 1 A 84 84 VAL CA C 84 61.769 61.316 0.453 1 1 453 . 18 1 1 A 84 84 VAL CB C 84 31.711 32.003 -0.292 1 1 456 . 18 1 1 A 84 84 VAL N N 84 120.054 126.970 -6.916 1 1 457 . 18 1 1 A 85 85 ASP H H 85 8.140 8.012 0.128 1 1 458 . 18 1 1 A 85 85 ASP C C 85 174.740 176.127 -1.387 1 1 459 . 18 1 1 A 85 85 ASP CA C 85 53.983 55.799 -1.816 1 1 460 . 18 1 1 A 85 85 ASP CB C 85 40.633 41.485 -0.852 1 1 461 . 18 1 1 A 85 85 ASP N N 85 122.510 120.406 2.104 1 1 462 . 18 1 1 A 86 86 ASN H H 86 7.736 8.255 -0.519 1 1 463 . 18 1 1 A 86 86 ASN C C 86 175.970 174.526 1.444 1 1 464 . 18 1 1 A 86 86 ASN CA C 86 54.349 51.734 2.615 1 1 465 . 18 1 1 A 86 86 ASN CB C 86 40.490 39.860 0.630 1 1 467 . 18 1 1 A 86 86 ASN N N 86 124.290 114.009 10.281 1 1 468 . 18 1 1 A 87 87 GLY H H 87 8.000 8.319 -0.319 1 1 469 . 18 1 1 A 87 87 GLY C C 87 173.456 172.527 0.929 1 1 470 . 18 1 1 A 87 87 GLY CA C 87 44.973 44.497 0.476 1 1 471 . 18 1 1 A 87 87 GLY N N 87 113.494 113.337 0.157 1 1 472 . 18 1 1 A 88 88 ALA H H 88 8.024 8.320 -0.296 1 1 473 . 18 1 1 A 88 88 ALA C C 88 176.833 175.746 1.087 1 1 474 . 18 1 1 A 88 88 ALA CA C 88 51.734 51.060 0.674 1 1 475 . 18 1 1 A 88 88 ALA CB C 88 19.818 23.733 -3.915 1 1 476 . 18 1 1 A 88 88 ALA N N 88 122.676 121.284 1.392 1 1 477 . 18 1 1 A 91 91 ALA C C 91 174.781 175.495 -0.714 1 1 478 . 18 1 1 A 91 91 ALA CA C 91 50.537 51.554 -1.017 1 1 479 . 18 1 1 A 91 91 ALA CB C 91 21.324 20.701 0.623 1 1 480 . 18 1 1 A 92 92 GLN H H 92 8.451 8.948 -0.497 1 1 481 . 18 1 1 A 92 92 GLN C C 92 173.557 174.182 -0.625 1 1 482 . 18 1 1 A 92 92 GLN CA C 92 53.380 54.085 -0.705 1 1 484 . 18 1 1 A 92 92 GLN N N 92 116.847 121.036 -4.189 1 1 485 . 18 1 1 A 93 93 GLY C C 93 170.631 172.897 -2.266 1 1 486 . 18 1 1 A 93 93 GLY CA C 93 45.718 44.687 1.031 1 1 487 . 18 1 1 A 94 94 VAL H H 94 8.686 9.449 -0.763 1 1 494 . 18 1 1 A 94 94 VAL C C 94 173.698 174.454 -0.756 1 1 495 . 18 1 1 A 94 94 VAL CA C 94 58.997 60.184 -1.187 1 1 496 . 18 1 1 A 94 94 VAL CB C 94 33.311 34.449 -1.138 1 1 499 . 18 1 1 A 94 94 VAL N N 94 118.489 120.195 -1.706 1 1 500 . 18 1 1 A 95 95 GLN H H 95 9.468 9.427 0.041 1 1 501 . 18 1 1 A 95 95 GLN C C 95 174.028 174.602 -0.574 1 1 502 . 18 1 1 A 95 95 GLN CA C 95 52.547 54.394 -1.847 1 1 503 . 18 1 1 A 95 95 GLN CB C 95 33.816 32.019 1.797 1 1 505 . 18 1 1 A 95 95 GLN N N 95 122.106 125.880 -3.774 1 1 506 . 18 1 1 A 96 96 LEU H H 96 8.484 9.083 -0.599 1 1 513 . 18 1 1 A 96 96 LEU C C 96 175.322 175.324 -0.002 1 1 514 . 18 1 1 A 96 96 LEU CA C 96 53.736 54.003 -0.267 1 1 515 . 18 1 1 A 96 96 LEU CB C 96 41.088 44.910 -3.822 1 1 519 . 18 1 1 A 96 96 LEU N N 96 123.224 124.912 -1.688 1 1 520 . 18 1 1 A 97 97 THR H H 97 9.116 8.734 0.382 1 1 521 . 18 1 1 A 97 97 THR C C 97 173.251 171.605 1.646 1 1 522 . 18 1 1 A 97 97 THR CA C 97 58.931 59.385 -0.454 1 1 523 . 18 1 1 A 97 97 THR CB C 97 72.984 71.996 0.988 1 1 525 . 18 1 1 A 97 97 THR N N 97 112.504 115.461 -2.957 1 1 526 . 18 1 1 A 98 98 ALA H H 98 8.603 8.512 0.091 1 1 527 . 18 1 1 A 98 98 ALA C C 98 174.948 175.398 -0.450 1 1 528 . 18 1 1 A 98 98 ALA CA C 98 49.980 49.925 0.055 1 1 529 . 18 1 1 A 98 98 ALA CB C 98 19.157 20.816 -1.659 1 1 530 . 18 1 1 A 98 98 ALA N N 98 121.608 123.337 -1.729 1 1 531 . 18 1 1 A 99 99 LYS H H 99 8.890 9.262 -0.372 1 1 532 . 18 1 1 A 99 99 LYS C C 99 174.294 174.852 -0.558 1 1 533 . 18 1 1 A 99 99 LYS CA C 99 54.019 54.570 -0.551 1 1 534 . 18 1 1 A 99 99 LYS CB C 99 33.018 35.586 -2.568 1 1 538 . 18 1 1 A 99 99 LYS N N 99 124.522 122.777 1.745 1 1 539 . 18 1 1 A 100 100 LEU H H 100 8.985 8.961 0.024 1 1 546 . 18 1 1 A 100 100 LEU C C 100 175.265 175.196 0.069 1 1 547 . 18 1 1 A 100 100 LEU CA C 100 52.698 53.426 -0.728 1 1 548 . 18 1 1 A 100 100 LEU CB C 100 42.889 44.505 -1.616 1 1 552 . 18 1 1 A 100 100 LEU N N 100 131.876 122.789 9.087 1 1 553 . 18 1 1 A 101 101 GLY H H 101 9.137 9.047 0.090 1 1 554 . 18 1 1 A 101 101 GLY C C 101 170.798 172.071 -1.273 1 1 555 . 18 1 1 A 101 101 GLY CA C 101 44.429 44.164 0.265 1 1 556 . 18 1 1 A 101 101 GLY N N 101 111.928 109.237 2.691 1 1 557 . 18 1 1 A 102 102 TYR H H 102 8.779 8.367 0.412 1 1 558 . 18 1 1 A 102 102 TYR C C 102 173.402 173.596 -0.194 1 1 559 . 18 1 1 A 102 102 TYR CA C 102 54.444 56.754 -2.310 1 1 560 . 18 1 1 A 102 102 TYR CB C 102 42.239 41.971 0.268 1 1 561 . 18 1 1 A 102 102 TYR N N 102 116.664 119.726 -3.062 1 1 562 . 18 1 1 A 103 103 PRO C C 103 175.676 176.544 -0.868 1 1 563 . 18 1 1 A 103 103 PRO CA C 103 61.462 62.672 -1.210 1 1 564 . 18 1 1 A 103 103 PRO CB C 103 30.073 33.566 -3.493 1 1 565 . 18 1 1 A 104 104 ILE H H 104 8.670 9.019 -0.349 1 1 569 . 18 1 1 A 104 104 ILE C C 104 176.646 176.470 0.176 1 1 570 . 18 1 1 A 104 104 ILE CA C 104 62.054 62.249 -0.195 1 1 571 . 18 1 1 A 104 104 ILE CB C 104 37.678 39.422 -1.744 1 1 574 . 18 1 1 A 104 104 ILE N N 104 125.939 119.504 6.435 1 1 575 . 18 1 1 A 105 105 THR H H 105 8.129 8.142 -0.013 1 1 576 . 18 1 1 A 105 105 THR C C 105 174.344 174.268 0.076 1 1 577 . 18 1 1 A 105 105 THR CA C 105 59.176 62.112 -2.936 1 1 578 . 18 1 1 A 105 105 THR CB C 105 71.049 69.612 1.437 1 1 580 . 18 1 1 A 105 105 THR N N 105 109.853 112.219 -2.366 1 1 581 . 18 1 1 A 106 106 ASP H H 106 8.424 7.872 0.552 1 1 582 . 18 1 1 A 106 106 ASP C C 106 175.692 175.850 -0.158 1 1 583 . 18 1 1 A 106 106 ASP CA C 106 56.465 53.831 2.634 1 1 584 . 18 1 1 A 106 106 ASP CB C 106 40.032 42.470 -2.438 1 1 585 . 18 1 1 A 106 106 ASP N N 106 117.156 120.067 -2.911 1 1 586 . 18 1 1 A 107 107 ASP H H 107 8.124 7.840 0.284 1 1 587 . 18 1 1 A 107 107 ASP C C 107 174.174 175.378 -1.204 1 1 588 . 18 1 1 A 107 107 ASP CA C 107 52.907 53.327 -0.420 1 1 589 . 18 1 1 A 107 107 ASP CB C 107 41.661 41.431 0.230 1 1 590 . 18 1 1 A 107 107 ASP N N 107 113.591 117.341 -3.750 1 1 591 . 18 1 1 A 108 108 LEU H H 108 7.336 7.600 -0.264 1 1 598 . 18 1 1 A 108 108 LEU C C 108 174.321 175.168 -0.847 1 1 599 . 18 1 1 A 108 108 LEU CA C 108 54.449 54.231 0.218 1 1 600 . 18 1 1 A 108 108 LEU CB C 108 44.754 45.563 -0.809 1 1 604 . 18 1 1 A 108 108 LEU N N 108 123.244 120.825 2.419 1 1 605 . 18 1 1 A 109 109 ASP H H 109 8.943 8.930 0.013 1 1 606 . 18 1 1 A 109 109 ASP C C 109 176.248 174.831 1.417 1 1 607 . 18 1 1 A 109 109 ASP CA C 109 52.376 52.751 -0.375 1 1 608 . 18 1 1 A 109 109 ASP CB C 109 42.764 45.643 -2.879 1 1 609 . 18 1 1 A 109 109 ASP N N 109 124.634 123.053 1.581 1 1 610 . 18 1 1 A 110 110 ILE H H 110 8.372 8.564 -0.192 1 1 614 . 18 1 1 A 110 110 ILE C C 110 173.735 174.078 -0.343 1 1 615 . 18 1 1 A 110 110 ILE CA C 110 59.129 59.131 -0.002 1 1 616 . 18 1 1 A 110 110 ILE CB C 110 39.402 40.775 -1.373 1 1 620 . 18 1 1 A 110 110 ILE N N 110 119.135 116.908 2.227 1 1 621 . 18 1 1 A 111 111 TYR H H 111 8.695 9.043 -0.348 1 1 622 . 18 1 1 A 111 111 TYR C C 111 172.838 175.371 -2.533 1 1 623 . 18 1 1 A 111 111 TYR CA C 111 56.182 56.638 -0.456 1 1 624 . 18 1 1 A 111 111 TYR CB C 111 41.489 42.974 -1.485 1 1 625 . 18 1 1 A 111 111 TYR N N 111 121.248 121.568 -0.320 1 1 626 . 18 1 1 A 112 112 THR H H 112 9.172 8.878 0.294 1 1 627 . 18 1 1 A 112 112 THR C C 112 173.850 173.364 0.486 1 1 628 . 18 1 1 A 112 112 THR CA C 112 58.246 61.422 -3.176 1 1 629 . 18 1 1 A 112 112 THR CB C 112 71.676 70.917 0.759 1 1 631 . 18 1 1 A 112 112 THR N N 112 110.671 117.464 -6.793 1 1 632 . 18 1 1 A 113 113 ARG H H 113 8.732 9.751 -1.019 1 1 633 . 18 1 1 A 113 113 ARG C C 113 175.037 174.298 0.739 1 1 634 . 18 1 1 A 113 113 ARG CA C 113 53.995 54.573 -0.578 1 1 635 . 18 1 1 A 113 113 ARG CB C 113 32.266 32.890 -0.624 1 1 638 . 18 1 1 A 113 113 ARG N N 113 120.642 127.053 -6.411 1 1 639 . 18 1 1 A 114 114 LEU H H 114 8.449 8.733 -0.284 1 1 646 . 18 1 1 A 114 114 LEU C C 114 175.812 175.606 0.206 1 1 647 . 18 1 1 A 114 114 LEU CA C 114 53.335 54.201 -0.866 1 1 648 . 18 1 1 A 114 114 LEU CB C 114 45.182 45.773 -0.591 1 1 652 . 18 1 1 A 114 114 LEU N N 114 119.078 126.198 -7.120 1 1 653 . 18 1 1 A 115 115 GLY H H 115 8.232 8.433 -0.201 1 1 654 . 18 1 1 A 115 115 GLY C C 115 171.343 172.390 -1.047 1 1 655 . 18 1 1 A 115 115 GLY CA C 115 46.217 46.054 0.163 1 1 656 . 18 1 1 A 115 115 GLY N N 115 108.966 112.402 -3.436 1 1 657 . 18 1 1 A 116 116 GLY H H 116 8.293 8.353 -0.060 1 1 658 . 18 1 1 A 116 116 GLY C C 116 169.856 172.650 -2.794 1 1 659 . 18 1 1 A 116 116 GLY CA C 116 44.084 44.824 -0.740 1 1 660 . 18 1 1 A 116 116 GLY N N 116 109.676 110.712 -1.036 1 1 661 . 18 1 1 A 117 117 MET H H 117 9.286 9.537 -0.251 1 1 662 . 18 1 1 A 117 117 MET C C 117 174.557 175.124 -0.567 1 1 663 . 18 1 1 A 117 117 MET CA C 117 53.258 53.419 -0.161 1 1 664 . 18 1 1 A 117 117 MET CB C 117 37.195 35.316 1.879 1 1 667 . 18 1 1 A 117 117 MET N N 117 120.425 117.264 3.161 1 1 668 . 18 1 1 A 118 118 VAL H H 118 9.062 9.101 -0.039 1 1 675 . 18 1 1 A 118 118 VAL C C 118 173.993 175.227 -1.234 1 1 676 . 18 1 1 A 118 118 VAL CA C 118 59.883 60.776 -0.893 1 1 677 . 18 1 1 A 118 118 VAL CB C 118 31.782 34.550 -2.768 1 1 680 . 18 1 1 A 118 118 VAL N N 118 126.948 119.950 6.998 1 1 681 . 18 1 1 A 119 119 TRP H H 119 8.482 8.623 -0.141 1 1 682 . 18 1 1 A 119 119 TRP C C 119 174.608 173.451 1.157 1 1 683 . 18 1 1 A 119 119 TRP CA C 119 53.332 54.749 -1.417 1 1 684 . 18 1 1 A 119 119 TRP CB C 119 33.569 32.761 0.808 1 1 685 . 18 1 1 A 119 119 TRP N N 119 124.631 125.584 -0.953 1 1 686 . 18 1 1 A 120 120 ARG H H 120 9.113 9.136 -0.023 1 1 687 . 18 1 1 A 120 120 ARG C C 120 174.951 174.789 0.162 1 1 688 . 18 1 1 A 120 120 ARG CA C 120 54.684 54.217 0.467 1 1 689 . 18 1 1 A 120 120 ARG CB C 120 33.424 34.599 -1.175 1 1 690 . 18 1 1 A 120 120 ARG N N 120 117.899 119.594 -1.695 1 1 691 . 18 1 1 A 121 121 ALA H H 121 9.299 8.742 0.557 1 1 692 . 18 1 1 A 121 121 ALA C C 121 175.954 174.661 1.293 1 1 693 . 18 1 1 A 121 121 ALA CA C 121 50.368 51.625 -1.257 1 1 694 . 18 1 1 A 121 121 ALA CB C 121 21.141 23.378 -2.237 1 1 695 . 18 1 1 A 121 121 ALA N N 121 128.863 120.876 7.987 1 1 696 . 18 1 1 A 122 122 ASP H H 122 8.488 8.781 -0.293 1 1 697 . 18 1 1 A 122 122 ASP C C 122 175.635 175.524 0.111 1 1 698 . 18 1 1 A 122 122 ASP CA C 122 53.891 52.554 1.337 1 1 699 . 18 1 1 A 122 122 ASP CB C 122 42.492 43.590 -1.098 1 1 700 . 18 1 1 A 122 122 ASP N N 122 121.721 121.106 0.615 1 1 701 . 18 1 1 A 123 123 SER H H 123 8.466 8.653 -0.187 1 1 702 . 18 1 1 A 123 123 SER C C 123 174.325 173.504 0.821 1 1 703 . 18 1 1 A 123 123 SER CA C 123 57.325 57.407 -0.082 1 1 704 . 18 1 1 A 123 123 SER CB C 123 63.988 63.453 0.535 1 1 705 . 18 1 1 A 123 123 SER N N 123 117.374 118.936 -1.562 1 1 706 . 18 1 1 A 124 124 LYS H H 124 8.389 7.559 0.830 1 1 707 . 18 1 1 A 124 124 LYS C C 124 176.840 176.014 0.826 1 1 708 . 18 1 1 A 124 124 LYS CA C 124 56.036 54.838 1.198 1 1 709 . 18 1 1 A 124 124 LYS CB C 124 32.397 35.605 -3.208 1 1 711 . 18 1 1 A 124 124 LYS N N 124 122.883 121.005 1.878 1 1 712 . 18 1 1 A 125 125 GLY H H 125 8.281 8.546 -0.265 1 1 713 . 18 1 1 A 125 125 GLY C C 125 173.592 173.061 0.531 1 1 714 . 18 1 1 A 125 125 GLY CA C 125 44.924 45.815 -0.891 1 1 715 . 18 1 1 A 125 125 GLY N N 125 109.541 110.886 -1.345 1 1 716 . 18 1 1 A 126 126 ASN H H 126 8.185 8.131 0.054 1 1 717 . 18 1 1 A 126 126 ASN C C 126 176.649 174.128 2.521 1 1 718 . 18 1 1 A 126 126 ASN CA C 126 52.763 52.177 0.586 1 1 719 . 18 1 1 A 126 126 ASN CB C 126 38.439 36.605 1.834 1 1 720 . 18 1 1 A 126 126 ASN N N 126 119.019 121.826 -2.807 1 1 721 . 18 1 1 A 127 127 TYR C C 127 176.913 175.226 1.687 1 1 722 . 18 1 1 A 127 127 TYR CA C 127 57.757 57.558 0.199 1 1 723 . 18 1 1 A 127 127 TYR CB C 127 37.703 38.849 -1.146 1 1 724 . 18 1 1 A 128 128 ALA H H 128 8.050 7.720 0.330 1 1 728 . 18 1 1 A 128 128 ALA C C 128 177.756 178.211 -0.455 1 1 729 . 18 1 1 A 128 128 ALA CA C 128 52.321 52.914 -0.593 1 1 730 . 18 1 1 A 128 128 ALA CB C 128 18.273 19.002 -0.729 1 1 731 . 18 1 1 A 128 128 ALA N N 128 124.529 124.158 0.371 1 1 732 . 18 1 1 A 129 129 SER H H 129 8.063 9.027 -0.964 1 1 733 . 18 1 1 A 129 129 SER C C 129 174.938 175.086 -0.148 1 1 734 . 18 1 1 A 129 129 SER CA C 129 58.202 60.399 -2.197 1 1 735 . 18 1 1 A 129 129 SER CB C 129 62.974 63.272 -0.298 1 1 736 . 18 1 1 A 129 129 SER N N 129 114.374 119.654 -5.280 1 1 737 . 18 1 1 A 130 130 THR H H 130 7.875 7.828 0.047 1 1 741 . 18 1 1 A 130 130 THR C C 130 175.198 175.479 -0.281 1 1 742 . 18 1 1 A 130 130 THR CA C 130 61.520 62.296 -0.776 1 1 743 . 18 1 1 A 130 130 THR CB C 130 69.312 70.587 -1.275 1 1 745 . 18 1 1 A 130 130 THR N N 130 113.608 110.216 3.392 1 1 746 . 18 1 1 A 131 131 GLY H H 131 8.219 7.436 0.783 1 1 747 . 18 1 1 A 131 131 GLY C C 131 173.979 173.939 0.040 1 1 748 . 18 1 1 A 131 131 GLY CA C 131 44.991 45.689 -0.698 1 1 749 . 18 1 1 A 131 131 GLY N N 131 110.848 107.890 2.958 1 1 750 . 18 1 1 A 132 132 VAL H H 132 7.729 7.975 -0.246 1 1 757 . 18 1 1 A 132 132 VAL C C 132 175.988 174.656 1.332 1 1 758 . 18 1 1 A 132 132 VAL CA C 132 61.643 62.313 -0.670 1 1 759 . 18 1 1 A 132 132 VAL CB C 132 31.941 32.159 -0.218 1 1 762 . 18 1 1 A 132 132 VAL N N 132 118.932 122.108 -3.176 1 1 763 . 18 1 1 A 133 133 SER H H 133 8.224 8.768 -0.544 1 1 764 . 18 1 1 A 133 133 SER C C 133 174.320 173.267 1.053 1 1 765 . 18 1 1 A 133 133 SER CA C 133 57.756 56.475 1.281 1 1 766 . 18 1 1 A 133 133 SER CB C 133 63.140 65.863 -2.723 1 1 767 . 18 1 1 A 133 133 SER N N 133 119.260 120.590 -1.330 1 1 768 . 18 1 1 A 134 134 ARG H H 134 8.199 8.703 -0.504 1 1 769 . 18 1 1 A 134 134 ARG C C 134 175.923 175.617 0.306 1 1 770 . 18 1 1 A 134 134 ARG CA C 134 55.461 55.031 0.430 1 1 771 . 18 1 1 A 134 134 ARG CB C 134 30.195 30.034 0.161 1 1 774 . 18 1 1 A 134 134 ARG N N 134 123.262 122.360 0.902 1 1 775 . 18 1 1 A 135 135 SER H H 135 8.256 8.786 -0.530 1 1 776 . 18 1 1 A 135 135 SER C C 135 174.360 174.804 -0.444 1 1 777 . 18 1 1 A 135 135 SER CA C 135 57.730 59.907 -2.177 1 1 778 . 18 1 1 A 135 135 SER CB C 135 63.275 64.373 -1.098 1 1 779 . 18 1 1 A 135 135 SER N N 135 117.155 119.954 -2.799 1 1 780 . 18 1 1 A 136 136 GLU H H 136 8.374 7.737 0.637 1 1 781 . 18 1 1 A 136 136 GLU C C 136 176.284 174.941 1.343 1 1 782 . 18 1 1 A 136 136 GLU CA C 136 56.082 55.681 0.401 1 1 783 . 18 1 1 A 136 136 GLU CB C 136 29.820 32.564 -2.744 1 1 785 . 18 1 1 A 136 136 GLU N N 136 122.812 118.920 3.892 1 1 786 . 18 1 1 A 137 137 HIS H H 137 8.118 8.603 -0.485 1 1 787 . 18 1 1 A 137 137 HIS C C 137 173.529 174.525 -0.996 1 1 788 . 18 1 1 A 137 137 HIS CA C 137 54.793 56.554 -1.761 1 1 789 . 18 1 1 A 137 137 HIS CB C 137 30.191 30.042 0.149 1 1 790 . 18 1 1 A 137 137 HIS N N 137 118.002 123.236 -5.234 1 1 791 . 18 1 1 A 138 138 ASP H H 138 8.572 8.767 -0.195 1 1 792 . 18 1 1 A 138 138 ASP C C 138 174.940 174.797 0.143 1 1 793 . 18 1 1 A 138 138 ASP CA C 138 53.594 52.333 1.261 1 1 794 . 18 1 1 A 138 138 ASP CB C 138 42.165 43.688 -1.523 1 1 795 . 18 1 1 A 138 138 ASP N N 138 121.536 118.992 2.544 1 1 796 . 18 1 1 A 139 139 THR H H 139 7.857 8.952 -1.095 1 1 797 . 18 1 1 A 139 139 THR C C 139 172.822 173.744 -0.922 1 1 798 . 18 1 1 A 139 139 THR CA C 139 59.197 60.295 -1.098 1 1 799 . 18 1 1 A 139 139 THR CB C 139 71.457 71.611 -0.154 1 1 801 . 18 1 1 A 139 139 THR N N 139 113.598 117.128 -3.530 1 1 802 . 18 1 1 A 140 140 GLY C C 140 169.622 171.341 -1.719 1 1 803 . 18 1 1 A 140 140 GLY CA C 140 44.287 44.439 -0.152 1 1 804 . 18 1 1 A 141 141 VAL H H 141 7.815 8.342 -0.527 1 1 811 . 18 1 1 A 141 141 VAL C C 141 176.038 173.325 2.713 1 1 812 . 18 1 1 A 141 141 VAL CA C 141 59.739 59.610 0.129 1 1 813 . 18 1 1 A 141 141 VAL CB C 141 33.308 35.157 -1.849 1 1 816 . 18 1 1 A 141 141 VAL N N 141 116.224 122.153 -5.929 1 1 817 . 18 1 1 A 142 142 SER H H 142 9.284 8.767 0.517 1 1 818 . 18 1 1 A 142 142 SER C C 142 171.050 172.293 -1.243 1 1 819 . 18 1 1 A 142 142 SER CB C 142 67.608 66.603 1.005 1 1 820 . 18 1 1 A 142 142 SER N N 142 123.223 122.637 0.586 1 1 821 . 18 1 1 A 143 143 PRO C C 143 174.032 176.281 -2.249 1 1 822 . 18 1 1 A 143 143 PRO CA C 143 62.350 62.440 -0.090 1 1 823 . 18 1 1 A 143 143 PRO CB C 143 31.774 32.328 -0.554 1 1 825 . 18 1 1 A 144 144 VAL H H 144 7.785 8.529 -0.744 1 1 832 . 18 1 1 A 144 144 VAL C C 144 172.826 174.214 -1.388 1 1 833 . 18 1 1 A 144 144 VAL CA C 144 59.770 59.732 0.038 1 1 834 . 18 1 1 A 144 144 VAL CB C 144 34.407 36.078 -1.671 1 1 837 . 18 1 1 A 144 144 VAL N N 144 120.214 117.306 2.908 1 1 838 . 18 1 1 A 145 145 PHE H H 145 8.623 8.508 0.115 1 1 839 . 18 1 1 A 145 145 PHE C C 145 173.658 172.612 1.046 1 1 840 . 18 1 1 A 145 145 PHE CA C 145 54.942 55.881 -0.939 1 1 841 . 18 1 1 A 145 145 PHE CB C 145 42.692 42.423 0.269 1 1 842 . 18 1 1 A 145 145 PHE N N 145 123.914 118.981 4.933 1 1 843 . 18 1 1 A 146 146 ALA H H 146 8.886 8.904 -0.018 1 1 844 . 18 1 1 A 146 146 ALA C C 146 176.258 176.046 0.212 1 1 845 . 18 1 1 A 146 146 ALA CA C 146 49.734 50.100 -0.366 1 1 846 . 18 1 1 A 146 146 ALA CB C 146 22.244 22.273 -0.029 1 1 847 . 18 1 1 A 146 146 ALA N N 146 125.243 123.679 1.564 1 1 848 . 18 1 1 A 147 147 GLY H H 147 8.470 8.253 0.217 1 1 849 . 18 1 1 A 147 147 GLY C C 147 170.940 172.197 -1.257 1 1 850 . 18 1 1 A 147 147 GLY CA C 147 44.063 44.490 -0.427 1 1 851 . 18 1 1 A 147 147 GLY N N 147 106.669 106.269 0.400 1 1 852 . 18 1 1 A 148 148 GLY H H 148 8.008 8.318 -0.310 1 1 853 . 18 1 1 A 148 148 GLY C C 148 170.181 172.536 -2.355 1 1 854 . 18 1 1 A 148 148 GLY CA C 148 45.736 45.590 0.146 1 1 855 . 18 1 1 A 148 148 GLY N N 148 109.475 109.644 -0.169 1 1 856 . 18 1 1 A 149 149 VAL H H 149 8.426 8.397 0.029 1 1 863 . 18 1 1 A 149 149 VAL C C 149 174.157 173.604 0.553 1 1 864 . 18 1 1 A 149 149 VAL CA C 149 58.200 59.047 -0.847 1 1 865 . 18 1 1 A 149 149 VAL CB C 149 34.464 36.113 -1.649 1 1 868 . 18 1 1 A 149 149 VAL N N 149 112.651 117.944 -5.293 1 1 869 . 18 1 1 A 150 150 GLU H H 150 9.070 9.473 -0.403 1 1 870 . 18 1 1 A 150 150 GLU C C 150 173.892 174.217 -0.325 1 1 871 . 18 1 1 A 150 150 GLU CA C 150 54.617 54.951 -0.334 1 1 872 . 18 1 1 A 150 150 GLU CB C 150 32.911 33.754 -0.843 1 1 874 . 18 1 1 A 150 150 GLU N N 150 124.471 120.543 3.928 1 1 875 . 18 1 1 A 151 151 TRP H H 151 9.461 9.255 0.206 1 1 877 . 18 1 1 A 151 151 TRP C C 151 174.370 174.593 -0.223 1 1 878 . 18 1 1 A 151 151 TRP CA C 151 54.113 55.669 -1.556 1 1 879 . 18 1 1 A 151 151 TRP CB C 151 31.688 32.533 -0.845 1 1 880 . 18 1 1 A 151 151 TRP N N 151 129.611 129.238 0.373 1 1 882 . 18 1 1 A 152 152 ALA H H 152 8.771 8.186 0.585 1 1 883 . 18 1 1 A 152 152 ALA C C 152 175.079 176.371 -1.292 1 1 884 . 18 1 1 A 152 152 ALA CA C 152 51.417 51.039 0.378 1 1 885 . 18 1 1 A 152 152 ALA CB C 152 17.209 19.657 -2.448 1 1 886 . 18 1 1 A 152 152 ALA N N 152 130.502 130.978 -0.476 1 1 887 . 18 1 1 A 153 153 VAL H H 153 7.893 8.739 -0.846 1 1 894 . 18 1 1 A 153 153 VAL C C 153 176.612 175.969 0.643 1 1 895 . 18 1 1 A 153 153 VAL CA C 153 63.600 63.682 -0.082 1 1 896 . 18 1 1 A 153 153 VAL CB C 153 31.280 33.115 -1.835 1 1 899 . 18 1 1 A 153 153 VAL N N 153 124.360 122.678 1.682 1 1 900 . 18 1 1 A 154 154 THR H H 154 7.950 7.703 0.247 1 1 904 . 18 1 1 A 154 154 THR C C 154 173.884 175.306 -1.422 1 1 905 . 18 1 1 A 154 154 THR CA C 154 58.655 60.942 -2.287 1 1 906 . 18 1 1 A 154 154 THR CB C 154 71.262 69.632 1.630 1 1 908 . 18 1 1 A 154 154 THR N N 154 109.176 113.372 -4.196 1 1 909 . 18 1 1 A 155 155 ARG H H 155 8.310 8.866 -0.556 1 1 910 . 18 1 1 A 155 155 ARG C C 155 176.753 176.415 0.338 1 1 911 . 18 1 1 A 155 155 ARG CA C 155 58.456 58.110 0.346 1 1 912 . 18 1 1 A 155 155 ARG CB C 155 29.043 30.894 -1.851 1 1 915 . 18 1 1 A 155 155 ARG N N 155 116.576 124.363 -7.787 1 1 916 . 18 1 1 A 156 156 ASP H H 156 7.783 8.143 -0.360 1 1 917 . 18 1 1 A 156 156 ASP C C 156 174.222 174.800 -0.578 1 1 918 . 18 1 1 A 156 156 ASP CA C 156 53.540 53.483 0.057 1 1 919 . 18 1 1 A 156 156 ASP CB C 156 42.327 41.615 0.712 1 1 920 . 18 1 1 A 156 156 ASP N N 156 112.950 118.559 -5.609 1 1 921 . 18 1 1 A 157 157 ILE H H 157 7.233 7.601 -0.368 1 1 925 . 18 1 1 A 157 157 ILE C C 157 174.178 174.851 -0.673 1 1 926 . 18 1 1 A 157 157 ILE CA C 157 59.350 60.684 -1.334 1 1 927 . 18 1 1 A 157 157 ILE CB C 157 38.969 40.819 -1.850 1 1 930 . 18 1 1 A 157 157 ILE N N 157 119.732 119.910 -0.178 1 1 931 . 18 1 1 A 158 158 ALA H H 158 8.729 9.059 -0.330 1 1 932 . 18 1 1 A 158 158 ALA C C 158 176.567 176.303 0.264 1 1 933 . 18 1 1 A 158 158 ALA CA C 158 49.418 50.551 -1.133 1 1 934 . 18 1 1 A 158 158 ALA CB C 158 21.430 24.232 -2.802 1 1 935 . 18 1 1 A 158 158 ALA N N 158 128.564 128.896 -0.332 1 1 936 . 18 1 1 A 159 159 THR H H 159 8.972 8.981 -0.009 1 1 940 . 18 1 1 A 159 159 THR C C 159 172.213 174.223 -2.010 1 1 941 . 18 1 1 A 159 159 THR CA C 159 59.504 59.776 -0.272 1 1 942 . 18 1 1 A 159 159 THR CB C 159 70.728 71.998 -1.270 1 1 944 . 18 1 1 A 159 159 THR N N 159 114.901 110.531 4.370 1 1 945 . 18 1 1 A 160 160 ARG H H 160 8.924 9.335 -0.411 1 1 946 . 18 1 1 A 160 160 ARG C C 160 174.097 174.206 -0.109 1 1 947 . 18 1 1 A 160 160 ARG CA C 160 53.066 54.419 -1.353 1 1 948 . 18 1 1 A 160 160 ARG CB C 160 32.922 33.967 -1.045 1 1 951 . 18 1 1 A 160 160 ARG N N 160 121.507 120.492 1.015 1 1 952 . 18 1 1 A 161 161 LEU H H 161 8.611 9.223 -0.612 1 1 959 . 18 1 1 A 161 161 LEU C C 161 174.389 174.030 0.359 1 1 960 . 18 1 1 A 161 161 LEU CA C 161 53.355 53.646 -0.291 1 1 961 . 18 1 1 A 161 161 LEU CB C 161 44.360 45.060 -0.700 1 1 964 . 18 1 1 A 161 161 LEU N N 161 124.711 123.374 1.337 1 1 965 . 18 1 1 A 162 162 GLU H H 162 8.746 9.003 -0.257 1 1 966 . 18 1 1 A 162 162 GLU C C 162 173.376 175.039 -1.663 1 1 967 . 18 1 1 A 162 162 GLU CA C 162 53.904 54.655 -0.751 1 1 968 . 18 1 1 A 162 162 GLU CB C 162 33.773 32.851 0.922 1 1 970 . 18 1 1 A 162 162 GLU N N 162 122.300 127.744 -5.444 1 1 971 . 18 1 1 A 163 163 TYR H H 163 8.872 8.696 0.176 1 1 972 . 18 1 1 A 163 163 TYR C C 163 173.425 175.192 -1.767 1 1 973 . 18 1 1 A 163 163 TYR CA C 163 56.192 55.479 0.713 1 1 974 . 18 1 1 A 163 163 TYR CB C 163 40.870 41.526 -0.656 1 1 975 . 18 1 1 A 163 163 TYR N N 163 124.618 122.162 2.456 1 1 976 . 18 1 1 A 171 171 ASP C C 171 175.753 176.618 -0.865 1 1 977 . 18 1 1 A 171 171 ASP CA C 171 53.517 56.195 -2.678 1 1 978 . 18 1 1 A 171 171 ASP CB C 171 41.353 41.647 -0.294 1 1 979 . 18 1 1 A 172 172 ALA H H 172 8.336 7.699 0.637 1 1 983 . 18 1 1 A 172 172 ALA C C 172 178.110 177.266 0.844 1 1 984 . 18 1 1 A 172 172 ALA CA C 172 52.190 52.015 0.175 1 1 985 . 18 1 1 A 172 172 ALA CB C 172 18.305 20.515 -2.210 1 1 986 . 18 1 1 A 172 172 ALA N N 172 125.294 120.417 4.877 1 1 987 . 18 1 1 A 173 173 GLY H H 173 8.300 8.430 -0.130 1 1 988 . 18 1 1 A 173 173 GLY C C 173 174.437 174.468 -0.031 1 1 989 . 18 1 1 A 173 173 GLY CA C 173 45.083 44.752 0.331 1 1 990 . 18 1 1 A 173 173 GLY N N 173 107.268 105.777 1.491 1 1 991 . 18 1 1 A 174 174 THR H H 174 7.754 8.104 -0.350 1 1 992 . 18 1 1 A 174 174 THR C C 174 174.738 174.891 -0.153 1 1 993 . 18 1 1 A 174 174 THR CA C 174 61.310 65.578 -4.268 1 1 994 . 18 1 1 A 174 174 THR CB C 174 69.310 69.425 -0.115 1 1 996 . 18 1 1 A 174 174 THR N N 174 113.472 114.986 -1.514 1 1 997 . 18 1 1 A 175 175 VAL H H 175 7.993 7.767 0.226 1 1 1004 . 18 1 1 A 175 175 VAL C C 175 176.535 175.282 1.253 1 1 1005 . 18 1 1 A 175 175 VAL CA C 175 62.126 61.265 0.861 1 1 1006 . 18 1 1 A 175 175 VAL CB C 175 31.282 32.958 -1.676 1 1 1009 . 18 1 1 A 175 175 VAL N N 175 121.643 116.467 5.176 1 1 1010 . 18 1 1 A 176 176 GLY H H 176 8.056 8.840 -0.784 1 1 1011 . 18 1 1 A 176 176 GLY C C 176 173.930 173.758 0.172 1 1 1012 . 18 1 1 A 176 176 GLY CA C 176 44.983 45.186 -0.203 1 1 1013 . 18 1 1 A 176 176 GLY N N 176 110.460 112.318 -1.858 1 1 1014 . 18 1 1 A 177 177 THR H H 177 7.520 8.286 -0.766 1 1 1015 . 18 1 1 A 177 177 THR C C 177 173.574 175.529 -1.955 1 1 1016 . 18 1 1 A 177 177 THR CA C 177 60.609 64.902 -4.293 1 1 1017 . 18 1 1 A 177 177 THR CB C 177 69.506 69.287 0.219 1 1 1019 . 18 1 1 A 177 177 THR N N 177 113.390 118.214 -4.824 1 1 1020 . 18 1 1 A 178 178 ARG H H 178 8.261 8.257 0.004 1 1 1021 . 18 1 1 A 178 178 ARG C C 178 173.932 177.505 -3.573 1 1 1022 . 18 1 1 A 178 178 ARG CA C 178 53.683 61.304 -7.621 1 1 1023 . 18 1 1 A 178 178 ARG CB C 178 29.224 28.957 0.267 1 1 1026 . 18 1 1 A 178 178 ARG N N 178 123.906 120.694 3.212 1 1 1027 . 18 1 1 A 183 183 MET C C 183 174.053 174.915 -0.862 1 1 1028 . 18 1 1 A 183 183 MET CA C 183 53.700 54.248 -0.548 1 1 1029 . 18 1 1 A 183 183 MET CB C 183 35.908 34.327 1.581 1 1 1032 . 18 1 1 A 184 184 LEU H H 184 8.319 8.976 -0.657 1 1 1033 . 18 1 1 A 184 184 LEU C C 184 175.235 175.243 -0.008 1 1 1034 . 18 1 1 A 184 184 LEU CA C 184 53.120 53.516 -0.396 1 1 1035 . 18 1 1 A 184 184 LEU CB C 184 42.857 42.961 -0.104 1 1 1038 . 18 1 1 A 184 184 LEU N N 184 131.293 128.054 3.239 1 1 1039 . 18 1 1 A 185 185 SER H H 185 9.603 9.129 0.474 1 1 1040 . 18 1 1 A 185 185 SER C C 185 171.293 173.668 -2.375 1 1 1041 . 18 1 1 A 185 185 SER CA C 185 56.504 56.543 -0.039 1 1 1042 . 18 1 1 A 185 185 SER CB C 185 66.585 66.194 0.391 1 1 1043 . 18 1 1 A 185 185 SER N N 185 119.338 120.528 -1.190 1 1 1044 . 18 1 1 A 186 186 LEU H H 186 8.583 8.834 -0.251 1 1 1051 . 18 1 1 A 186 186 LEU C C 186 175.328 176.461 -1.133 1 1 1052 . 18 1 1 A 186 186 LEU CA C 186 52.729 53.205 -0.476 1 1 1053 . 18 1 1 A 186 186 LEU CB C 186 44.996 45.231 -0.235 1 1 1056 . 18 1 1 A 186 186 LEU N N 186 122.719 125.886 -3.167 1 1 1057 . 18 1 1 A 187 187 GLY H H 187 9.287 8.401 0.886 1 1 1058 . 18 1 1 A 187 187 GLY C C 187 172.315 172.919 -0.604 1 1 1059 . 18 1 1 A 187 187 GLY CA C 187 43.502 45.556 -2.054 1 1 1060 . 18 1 1 A 187 187 GLY N N 187 110.265 109.320 0.945 1 1 1061 . 18 1 1 A 188 188 VAL H H 188 8.825 8.501 0.324 1 1 1068 . 18 1 1 A 188 188 VAL C C 188 173.125 174.783 -1.658 1 1 1069 . 18 1 1 A 188 188 VAL CA C 188 59.739 59.228 0.511 1 1 1070 . 18 1 1 A 188 188 VAL CB C 188 34.532 35.552 -1.020 1 1 1073 . 18 1 1 A 188 188 VAL N N 188 119.161 116.386 2.775 1 1 1074 . 18 1 1 A 189 189 SER H H 189 9.051 9.086 -0.035 1 1 1075 . 18 1 1 A 189 189 SER C C 189 171.698 173.040 -1.342 1 1 1076 . 18 1 1 A 189 189 SER CA C 189 55.997 57.231 -1.234 1 1 1077 . 18 1 1 A 189 189 SER CB C 189 66.094 66.901 -0.807 1 1 1078 . 18 1 1 A 189 189 SER N N 189 117.810 118.256 -0.446 1 1 1079 . 18 1 1 A 190 190 TYR H H 190 9.145 9.083 0.062 1 1 1080 . 18 1 1 A 190 190 TYR C C 190 174.063 173.078 0.985 1 1 1081 . 18 1 1 A 190 190 TYR CA C 190 55.375 55.566 -0.191 1 1 1082 . 18 1 1 A 190 190 TYR CB C 190 41.183 42.758 -1.575 1 1 1083 . 18 1 1 A 190 190 TYR N N 190 123.690 118.064 5.626 1 1 1084 . 18 1 1 A 191 191 ARG H H 191 8.211 8.998 -0.787 1 1 1085 . 18 1 1 A 191 191 ARG C C 191 174.826 174.234 0.592 1 1 1086 . 18 1 1 A 191 191 ARG CA C 191 54.464 54.281 0.183 1 1 1087 . 18 1 1 A 191 191 ARG CB C 191 30.507 34.351 -3.844 1 1 1090 . 18 1 1 A 191 191 ARG N N 191 125.366 119.808 5.558 1 1 1091 . 18 1 1 A 192 192 PHE H H 192 8.496 8.534 -0.038 1 1 1092 . 18 1 1 A 192 192 PHE C C 192 176.384 175.336 1.048 1 1 1093 . 18 1 1 A 192 192 PHE CA C 192 57.179 56.166 1.013 1 1 1094 . 18 1 1 A 192 192 PHE CB C 192 39.430 39.470 -0.040 1 1 1095 . 18 1 1 A 192 192 PHE N N 192 121.586 122.896 -1.310 1 1 1096 . 18 1 1 A 193 193 GLY H H 193 8.643 8.550 0.093 1 1 1097 . 18 1 1 A 193 193 GLY C C 193 174.466 172.187 2.279 1 1 1098 . 18 1 1 A 193 193 GLY CA C 193 45.126 44.169 0.957 1 1 1099 . 18 1 1 A 193 193 GLY N N 193 109.499 112.975 -3.476 1 1 1100 . 18 1 1 A 194 194 GLN H H 194 8.512 8.182 0.330 1 1 1101 . 18 1 1 A 194 194 GLN C C 194 176.201 175.821 0.380 1 1 1102 . 18 1 1 A 194 194 GLN CA C 194 55.433 54.655 0.778 1 1 1103 . 18 1 1 A 194 194 GLN CB C 194 28.729 30.563 -1.834 1 1 1105 . 18 1 1 A 194 194 GLN N N 194 119.448 120.318 -0.870 1 1 1106 . 18 1 1 A 195 195 GLU H H 195 8.530 8.499 0.031 1 1 1107 . 18 1 1 A 195 195 GLU C C 195 176.151 175.131 1.020 1 1 1108 . 18 1 1 A 195 195 GLU CA C 195 56.256 56.337 -0.081 1 1 1109 . 18 1 1 A 195 195 GLU CB C 195 29.486 30.870 -1.384 1 1 1111 . 18 1 1 A 195 195 GLU N N 195 121.959 126.182 -4.223 1 1 1112 . 18 1 1 A 196 196 ASP H H 196 8.253 8.603 -0.350 1 1 1113 . 18 1 1 A 196 196 ASP C C 196 175.667 174.681 0.986 1 1 1114 . 18 1 1 A 196 196 ASP CA C 196 53.981 52.708 1.273 1 1 1115 . 18 1 1 A 196 196 ASP CB C 196 40.700 44.808 -4.108 1 1 1116 . 18 1 1 A 196 196 ASP N N 196 121.819 118.601 3.218 1 1 1117 . 18 1 1 A 197 197 ALA H H 197 7.999 8.487 -0.488 1 1 1121 . 18 1 1 A 197 197 ALA C C 197 176.847 176.905 -0.058 1 1 1122 . 18 1 1 A 197 197 ALA CA C 197 51.612 50.996 0.616 1 1 1123 . 18 1 1 A 197 197 ALA CB C 197 18.192 19.501 -1.309 1 1 1124 . 18 1 1 A 197 197 ALA N N 197 124.262 123.140 1.122 1 1 1125 . 18 1 1 A 198 198 ALA H H 198 8.042 7.384 0.658 1 1 1126 . 18 1 1 A 198 198 ALA C C 198 176.865 176.464 0.401 1 1 1127 . 18 1 1 A 198 198 ALA CA C 198 49.999 48.841 1.158 1 1 1128 . 18 1 1 A 198 198 ALA CB C 198 17.327 20.207 -2.880 1 1 1129 . 18 1 1 A 198 198 ALA N N 198 124.724 122.027 2.697 1 1 1130 . 18 1 1 A 199 199 PRO C C 199 176.727 176.356 0.371 1 1 1131 . 18 1 1 A 199 199 PRO CA C 199 62.399 64.776 -2.377 1 1 1132 . 18 1 1 A 199 199 PRO CB C 199 30.949 32.078 -1.129 1 1 1135 . 18 1 1 A 200 200 VAL H H 200 8.026 7.628 0.398 1 1 1142 . 18 1 1 A 200 200 VAL C C 200 176.034 175.010 1.024 1 1 1143 . 18 1 1 A 200 200 VAL CA C 200 61.944 59.999 1.945 1 1 1144 . 18 1 1 A 200 200 VAL CB C 200 31.734 35.001 -3.267 1 1 1147 . 18 1 1 A 200 200 VAL N N 200 120.635 116.025 4.610 1 1 1148 . 18 1 1 A 201 201 VAL H H 201 7.966 8.972 -1.006 1 1 1155 . 18 1 1 A 201 201 VAL C C 201 175.128 174.823 0.305 1 1 1156 . 18 1 1 A 201 201 VAL CA C 201 61.249 61.617 -0.368 1 1 1157 . 18 1 1 A 201 201 VAL CB C 201 31.917 31.641 0.276 1 1 1160 . 18 1 1 A 201 201 VAL N N 201 124.053 129.675 -5.622 1 1 1161 . 18 1 1 A 202 202 ALA H H 202 8.159 7.540 0.619 1 1 1162 . 18 1 1 A 202 202 ALA C C 202 175.153 175.791 -0.638 1 1 1163 . 18 1 1 A 202 202 ALA CA C 202 49.742 49.450 0.292 1 1 1164 . 18 1 1 A 202 202 ALA CB C 202 17.532 19.227 -1.695 1 1 1165 . 18 1 1 A 202 202 ALA N N 202 129.251 125.757 3.494 1 1 1166 . 18 1 1 A 203 203 PRO C C 203 176.273 178.818 -2.545 1 1 1167 . 18 1 1 A 203 203 PRO CA C 203 62.324 66.034 -3.710 1 1 1168 . 18 1 1 A 203 203 PRO CB C 203 31.042 31.212 -0.170 1 1 1170 . 18 1 1 A 204 204 ALA H H 204 8.137 8.040 0.097 1 1 1171 . 18 1 1 A 204 204 ALA C C 204 175.697 177.791 -2.094 1 1 1172 . 18 1 1 A 204 204 ALA CA C 204 49.865 56.117 -6.252 1 1 1173 . 18 1 1 A 204 204 ALA CB C 204 17.364 18.346 -0.982 1 1 1174 . 18 1 1 A 204 204 ALA N N 204 125.510 119.444 6.066 1 1 1175 . 18 1 1 A 205 205 PRO C C 205 175.430 175.708 -0.278 1 1 1176 . 18 1 1 A 205 205 PRO CA C 205 62.511 62.350 0.161 1 1 1177 . 18 1 1 A 205 205 PRO CB C 205 31.056 32.773 -1.717 1 1 1179 . 18 1 1 A 206 206 ALA H H 206 7.847 8.347 -0.500 1 1 1180 . 18 1 1 A 206 206 ALA C C 206 175.565 177.168 -1.603 1 1 1181 . 18 1 1 A 206 206 ALA CA C 206 49.487 49.782 -0.295 1 1 1182 . 18 1 1 A 206 206 ALA CB C 206 18.843 20.604 -1.761 1 1 1183 . 18 1 1 A 206 206 ALA N N 206 123.663 122.618 1.045 1 1 1184 . 18 1 1 A 207 207 PRO C C 207 174.397 176.242 -1.845 1 1 1185 . 18 1 1 A 207 207 PRO CA C 207 61.454 64.802 -3.348 1 1 1186 . 18 1 1 A 207 207 PRO CB C 207 31.929 32.102 -0.173 1 1 1187 . 18 1 1 A 208 208 ALA H H 208 7.898 7.300 0.598 1 1 1188 . 18 1 1 A 208 208 ALA C C 208 175.411 174.334 1.077 1 1 1189 . 18 1 1 A 208 208 ALA CA C 208 49.472 49.688 -0.216 1 1 1190 . 18 1 1 A 208 208 ALA CB C 208 19.082 21.529 -2.447 1 1 1191 . 18 1 1 A 208 208 ALA N N 208 127.450 116.713 10.737 1 1 1192 . 18 1 1 A 209 209 PRO C C 209 176.932 177.326 -0.394 1 1 1193 . 18 1 1 A 209 209 PRO CA C 209 62.736 63.550 -0.814 1 1 1194 . 18 1 1 A 209 209 PRO CB C 209 31.012 31.721 -0.709 1 1 1 . 19 1 1 A 2 2 ARG C C 2 175.857 175.333 0.524 1 1 2 . 19 1 1 A 2 2 ARG CA C 2 55.872 55.709 0.163 1 1 3 . 19 1 1 A 2 2 ARG CB C 2 29.983 31.807 -1.824 1 1 5 . 19 1 1 A 3 3 ILE H H 3 8.238 8.492 -0.254 1 1 9 . 19 1 1 A 3 3 ILE C C 3 175.763 174.313 1.450 1 1 10 . 19 1 1 A 3 3 ILE CA C 3 60.779 59.300 1.479 1 1 11 . 19 1 1 A 3 3 ILE CB C 3 37.664 41.261 -3.597 1 1 15 . 19 1 1 A 3 3 ILE N N 3 122.580 123.828 -1.248 1 1 16 . 19 1 1 A 4 4 MET H H 4 8.261 8.848 -0.587 1 1 17 . 19 1 1 A 4 4 MET C C 4 175.660 176.288 -0.628 1 1 18 . 19 1 1 A 4 4 MET CA C 4 54.893 56.533 -1.640 1 1 19 . 19 1 1 A 4 4 MET CB C 4 32.060 34.513 -2.453 1 1 22 . 19 1 1 A 4 4 MET N N 4 123.988 124.242 -0.254 1 1 23 . 19 1 1 A 5 5 LYS H H 5 8.041 7.670 0.371 1 1 24 . 19 1 1 A 5 5 LYS C C 5 175.850 174.659 1.191 1 1 25 . 19 1 1 A 5 5 LYS CA C 5 56.081 56.034 0.047 1 1 26 . 19 1 1 A 5 5 LYS CB C 5 32.220 36.001 -3.781 1 1 29 . 19 1 1 A 5 5 LYS N N 5 122.015 117.018 4.997 1 1 30 . 19 1 1 A 6 6 ALA H H 6 8.042 8.500 -0.458 1 1 34 . 19 1 1 A 6 6 ALA C C 6 177.160 177.343 -0.183 1 1 35 . 19 1 1 A 6 6 ALA CA C 6 52.109 52.605 -0.496 1 1 36 . 19 1 1 A 6 6 ALA CB C 6 18.637 21.011 -2.374 1 1 37 . 19 1 1 A 6 6 ALA N N 6 123.943 125.633 -1.690 1 1 38 . 19 1 1 A 7 7 ILE H H 7 7.916 7.459 0.457 1 1 42 . 19 1 1 A 7 7 ILE C C 7 175.611 175.911 -0.300 1 1 43 . 19 1 1 A 7 7 ILE CA C 7 61.181 62.820 -1.639 1 1 44 . 19 1 1 A 7 7 ILE CB C 7 37.910 37.857 0.053 1 1 48 . 19 1 1 A 7 7 ILE N N 7 118.380 119.725 -1.345 1 1 49 . 19 1 1 A 8 8 PHE H H 8 8.167 9.291 -1.124 1 1 50 . 19 1 1 A 8 8 PHE C C 8 175.363 174.220 1.143 1 1 51 . 19 1 1 A 8 8 PHE CA C 8 57.286 56.383 0.903 1 1 52 . 19 1 1 A 8 8 PHE CB C 8 39.008 44.368 -5.360 1 1 53 . 19 1 1 A 8 8 PHE N N 8 121.971 126.212 -4.241 1 1 54 . 19 1 1 A 9 9 VAL H H 9 7.872 9.012 -1.140 1 1 61 . 19 1 1 A 9 9 VAL C C 9 175.405 174.537 0.868 1 1 62 . 19 1 1 A 9 9 VAL CA C 9 61.662 60.199 1.463 1 1 63 . 19 1 1 A 9 9 VAL CB C 9 32.026 33.952 -1.926 1 1 66 . 19 1 1 A 9 9 VAL N N 9 120.864 121.057 -0.193 1 1 67 . 19 1 1 A 10 10 LEU H H 10 8.077 8.764 -0.687 1 1 74 . 19 1 1 A 10 10 LEU C C 10 176.652 175.500 1.152 1 1 75 . 19 1 1 A 10 10 LEU CA C 10 54.856 53.954 0.902 1 1 76 . 19 1 1 A 10 10 LEU CB C 10 41.401 44.830 -3.429 1 1 80 . 19 1 1 A 10 10 LEU N N 10 124.826 126.200 -1.374 1 1 81 . 19 1 1 A 11 11 ASN H H 11 8.177 8.894 -0.717 1 1 82 . 19 1 1 A 11 11 ASN C C 11 174.394 175.722 -1.328 1 1 83 . 19 1 1 A 11 11 ASN CA C 11 52.704 53.807 -1.103 1 1 84 . 19 1 1 A 11 11 ASN CB C 11 38.468 39.271 -0.803 1 1 85 . 19 1 1 A 11 11 ASN N N 11 119.029 120.297 -1.268 1 1 86 . 19 1 1 A 12 12 ALA H H 12 7.991 8.622 -0.631 1 1 90 . 19 1 1 A 12 12 ALA C C 12 176.649 177.454 -0.805 1 1 91 . 19 1 1 A 12 12 ALA CA C 12 51.950 51.796 0.154 1 1 92 . 19 1 1 A 12 12 ALA CB C 12 18.659 17.927 0.732 1 1 93 . 19 1 1 A 12 12 ALA N N 12 123.695 124.441 -0.746 1 1 94 . 19 1 1 A 13 13 ALA H H 13 8.083 8.552 -0.469 1 1 95 . 19 1 1 A 13 13 ALA C C 13 175.395 178.454 -3.059 1 1 96 . 19 1 1 A 13 13 ALA CA C 13 49.797 56.563 -6.766 1 1 97 . 19 1 1 A 13 13 ALA CB C 13 17.486 18.809 -1.323 1 1 98 . 19 1 1 A 13 13 ALA N N 13 124.281 126.733 -2.452 1 1 99 . 19 1 1 A 14 14 PRO C C 14 176.641 176.625 0.016 1 1 100 . 19 1 1 A 14 14 PRO CA C 14 62.675 62.584 0.091 1 1 101 . 19 1 1 A 14 14 PRO CB C 14 31.000 30.098 0.902 1 1 103 . 19 1 1 A 15 15 LYS H H 15 8.283 7.894 0.389 1 1 104 . 19 1 1 A 15 15 LYS C C 15 175.683 176.131 -0.448 1 1 105 . 19 1 1 A 15 15 LYS CA C 15 55.429 55.988 -0.559 1 1 106 . 19 1 1 A 15 15 LYS CB C 15 32.246 31.686 0.560 1 1 109 . 19 1 1 A 15 15 LYS N N 15 119.069 118.940 0.129 1 1 110 . 19 1 1 A 16 16 ASP H H 16 7.880 7.911 -0.031 1 1 111 . 19 1 1 A 16 16 ASP C C 16 175.419 176.275 -0.856 1 1 112 . 19 1 1 A 16 16 ASP CA C 16 54.413 54.456 -0.043 1 1 113 . 19 1 1 A 16 16 ASP CB C 16 40.224 41.268 -1.044 1 1 114 . 19 1 1 A 16 16 ASP N N 16 119.625 120.827 -1.202 1 1 115 . 19 1 1 A 17 17 ASN H H 17 7.973 8.691 -0.718 1 1 116 . 19 1 1 A 17 17 ASN C C 17 174.231 174.966 -0.735 1 1 117 . 19 1 1 A 17 17 ASN CA C 17 53.948 53.471 0.477 1 1 118 . 19 1 1 A 17 17 ASN CB C 17 37.009 39.655 -2.646 1 1 119 . 19 1 1 A 17 17 ASN N N 17 118.063 119.650 -1.587 1 1 120 . 19 1 1 A 18 18 THR H H 18 7.318 8.676 -1.358 1 1 121 . 19 1 1 A 18 18 THR C C 18 172.323 172.033 0.290 1 1 122 . 19 1 1 A 18 18 THR CA C 18 60.153 60.445 -0.292 1 1 123 . 19 1 1 A 18 18 THR CB C 18 71.534 70.165 1.369 1 1 125 . 19 1 1 A 18 18 THR N N 18 109.092 114.064 -4.972 1 1 126 . 19 1 1 A 19 19 TRP H H 19 8.541 8.750 -0.209 1 1 127 . 19 1 1 A 19 19 TRP C C 19 175.969 173.897 2.072 1 1 128 . 19 1 1 A 19 19 TRP CA C 19 55.700 57.063 -1.363 1 1 129 . 19 1 1 A 19 19 TRP CB C 19 31.471 33.500 -2.029 1 1 130 . 19 1 1 A 19 19 TRP N N 19 121.992 124.843 -2.851 1 1 131 . 19 1 1 A 20 20 TYR H H 20 8.691 9.446 -0.755 1 1 132 . 19 1 1 A 20 20 TYR C C 20 173.684 174.773 -1.089 1 1 133 . 19 1 1 A 20 20 TYR CA C 20 55.805 56.128 -0.323 1 1 134 . 19 1 1 A 20 20 TYR CB C 20 40.513 42.111 -1.598 1 1 135 . 19 1 1 A 20 20 TYR N N 20 116.519 125.847 -9.328 1 1 136 . 19 1 1 A 21 21 ALA H H 21 8.876 8.406 0.470 1 1 137 . 19 1 1 A 21 21 ALA C C 21 175.395 175.684 -0.289 1 1 138 . 19 1 1 A 21 21 ALA CA C 21 50.970 50.992 -0.022 1 1 139 . 19 1 1 A 21 21 ALA CB C 21 22.142 23.085 -0.943 1 1 140 . 19 1 1 A 21 21 ALA N N 21 119.359 122.780 -3.421 1 1 141 . 19 1 1 A 22 22 GLY H H 22 8.613 7.848 0.765 1 1 142 . 19 1 1 A 22 22 GLY C C 22 171.458 171.672 -0.214 1 1 143 . 19 1 1 A 22 22 GLY CA C 22 45.608 45.298 0.310 1 1 144 . 19 1 1 A 22 22 GLY N N 22 106.678 105.864 0.814 1 1 145 . 19 1 1 A 23 23 GLY H H 23 7.911 8.386 -0.475 1 1 146 . 19 1 1 A 23 23 GLY C C 23 170.563 172.641 -2.078 1 1 147 . 19 1 1 A 23 23 GLY CA C 23 44.026 44.472 -0.446 1 1 148 . 19 1 1 A 23 23 GLY N N 23 103.399 107.444 -4.045 1 1 149 . 19 1 1 A 24 24 LYS H H 24 9.001 9.857 -0.856 1 1 150 . 19 1 1 A 24 24 LYS C C 24 172.965 174.300 -1.335 1 1 151 . 19 1 1 A 24 24 LYS CA C 24 54.062 54.360 -0.298 1 1 152 . 19 1 1 A 24 24 LYS CB C 24 36.774 36.398 0.376 1 1 156 . 19 1 1 A 24 24 LYS N N 24 116.402 120.620 -4.218 1 1 157 . 19 1 1 A 25 25 LEU H H 25 8.587 9.456 -0.869 1 1 164 . 19 1 1 A 25 25 LEU C C 25 175.205 175.355 -0.150 1 1 165 . 19 1 1 A 25 25 LEU CA C 25 53.446 53.158 0.288 1 1 166 . 19 1 1 A 25 25 LEU CB C 25 46.287 46.518 -0.231 1 1 170 . 19 1 1 A 25 25 LEU N N 25 119.932 122.437 -2.505 1 1 171 . 19 1 1 A 26 26 GLY H H 26 8.637 8.201 0.436 1 1 172 . 19 1 1 A 26 26 GLY C C 26 170.804 172.657 -1.853 1 1 173 . 19 1 1 A 26 26 GLY CA C 26 45.669 46.028 -0.359 1 1 174 . 19 1 1 A 26 26 GLY N N 26 108.136 109.693 -1.557 1 1 175 . 19 1 1 A 27 27 TRP H H 27 8.642 7.867 0.775 1 1 177 . 19 1 1 A 27 27 TRP C C 27 174.820 175.129 -0.309 1 1 178 . 19 1 1 A 27 27 TRP CB C 27 30.883 32.051 -1.168 1 1 179 . 19 1 1 A 27 27 TRP N N 27 120.887 118.647 2.240 1 1 181 . 19 1 1 A 32 32 ASP C C 32 176.315 175.059 1.256 1 1 182 . 19 1 1 A 32 32 ASP CA C 32 53.737 52.496 1.241 1 1 183 . 19 1 1 A 32 32 ASP CB C 32 41.230 41.074 0.156 1 1 184 . 19 1 1 A 33 33 THR H H 33 8.190 8.787 -0.597 1 1 188 . 19 1 1 A 33 33 THR C C 33 175.291 175.683 -0.392 1 1 189 . 19 1 1 A 33 33 THR CA C 33 61.909 63.375 -1.466 1 1 190 . 19 1 1 A 33 33 THR CB C 33 68.961 70.852 -1.891 1 1 192 . 19 1 1 A 33 33 THR N N 33 114.235 119.962 -5.727 1 1 193 . 19 1 1 A 34 34 GLY H H 34 8.341 8.179 0.162 1 1 194 . 19 1 1 A 34 34 GLY C C 34 173.766 174.313 -0.547 1 1 195 . 19 1 1 A 34 34 GLY CA C 34 44.941 45.139 -0.198 1 1 196 . 19 1 1 A 34 34 GLY N N 34 110.678 109.469 1.209 1 1 197 . 19 1 1 A 35 35 PHE H H 35 7.945 8.244 -0.299 1 1 198 . 19 1 1 A 35 35 PHE C C 35 175.411 174.447 0.964 1 1 199 . 19 1 1 A 35 35 PHE CA C 35 57.921 58.694 -0.773 1 1 200 . 19 1 1 A 35 35 PHE CB C 35 38.806 40.246 -1.440 1 1 201 . 19 1 1 A 35 35 PHE N N 35 120.533 121.315 -0.782 1 1 202 . 19 1 1 A 36 36 TYR H H 36 7.967 8.991 -1.024 1 1 203 . 19 1 1 A 36 36 TYR C C 36 176.104 175.439 0.665 1 1 204 . 19 1 1 A 36 36 TYR CA C 36 57.568 56.230 1.338 1 1 205 . 19 1 1 A 36 36 TYR CB C 36 37.727 43.409 -5.682 1 1 206 . 19 1 1 A 36 36 TYR N N 36 120.254 122.477 -2.223 1 1 207 . 19 1 1 A 37 37 GLY H H 37 7.666 8.580 -0.914 1 1 208 . 19 1 1 A 37 37 GLY C C 37 173.794 173.711 0.083 1 1 209 . 19 1 1 A 37 37 GLY CA C 37 45.007 45.852 -0.845 1 1 210 . 19 1 1 A 37 37 GLY N N 37 108.995 111.576 -2.581 1 1 211 . 19 1 1 A 38 38 ASN H H 38 8.109 8.115 -0.006 1 1 212 . 19 1 1 A 38 38 ASN C C 38 175.612 174.695 0.917 1 1 213 . 19 1 1 A 38 38 ASN CA C 38 52.954 52.007 0.947 1 1 214 . 19 1 1 A 38 38 ASN CB C 38 38.425 39.930 -1.505 1 1 215 . 19 1 1 A 38 38 ASN N N 38 118.603 120.069 -1.466 1 1 216 . 19 1 1 A 39 39 GLY H H 39 8.202 8.564 -0.362 1 1 217 . 19 1 1 A 39 39 GLY C C 39 173.958 173.270 0.688 1 1 218 . 19 1 1 A 39 39 GLY CA C 39 45.012 46.170 -1.158 1 1 219 . 19 1 1 A 39 39 GLY N N 39 108.897 111.261 -2.364 1 1 220 . 19 1 1 A 40 40 PHE H H 40 7.960 8.186 -0.226 1 1 221 . 19 1 1 A 40 40 PHE C C 40 175.653 174.503 1.150 1 1 222 . 19 1 1 A 40 40 PHE CA C 40 57.556 56.550 1.006 1 1 223 . 19 1 1 A 40 40 PHE CB C 40 38.513 42.063 -3.550 1 1 224 . 19 1 1 A 40 40 PHE N N 40 119.829 120.797 -0.968 1 1 225 . 19 1 1 A 41 41 GLN H H 41 8.173 7.077 1.096 1 1 226 . 19 1 1 A 41 41 GLN C C 41 175.234 175.847 -0.613 1 1 227 . 19 1 1 A 41 41 GLN CA C 41 55.488 56.205 -0.717 1 1 228 . 19 1 1 A 41 41 GLN CB C 41 28.523 28.820 -0.297 1 1 230 . 19 1 1 A 41 41 GLN N N 41 120.810 123.519 -2.709 1 1 231 . 19 1 1 A 42 42 ASN H H 42 8.193 8.836 -0.643 1 1 232 . 19 1 1 A 42 42 ASN C C 42 174.618 174.980 -0.362 1 1 233 . 19 1 1 A 42 42 ASN CA C 42 52.924 53.425 -0.501 1 1 234 . 19 1 1 A 42 42 ASN CB C 42 38.333 39.624 -1.291 1 1 235 . 19 1 1 A 42 42 ASN N N 42 119.679 126.251 -6.572 1 1 236 . 19 1 1 A 43 43 ASN H H 43 8.255 9.070 -0.815 1 1 237 . 19 1 1 A 43 43 ASN C C 43 173.873 174.954 -1.081 1 1 238 . 19 1 1 A 43 43 ASN CA C 43 52.919 54.519 -1.600 1 1 239 . 19 1 1 A 43 43 ASN CB C 43 38.580 40.501 -1.921 1 1 240 . 19 1 1 A 43 43 ASN N N 43 119.773 120.418 -0.645 1 1 241 . 19 1 1 A 44 44 ASN H H 44 7.865 7.853 0.012 1 1 242 . 19 1 1 A 44 44 ASN C C 44 175.518 175.630 -0.112 1 1 243 . 19 1 1 A 44 44 ASN CA C 44 54.528 52.801 1.727 1 1 244 . 19 1 1 A 44 44 ASN CB C 44 40.170 39.685 0.485 1 1 246 . 19 1 1 A 44 44 ASN N N 44 124.152 117.418 6.734 1 1 247 . 19 1 1 A 46 46 PRO C C 46 177.228 176.301 0.927 1 1 248 . 19 1 1 A 46 46 PRO CA C 46 62.794 62.978 -0.184 1 1 249 . 19 1 1 A 46 46 PRO CB C 46 31.283 31.653 -0.370 1 1 251 . 19 1 1 A 47 47 THR H H 47 8.165 8.452 -0.287 1 1 255 . 19 1 1 A 47 47 THR C C 47 174.573 172.793 1.780 1 1 256 . 19 1 1 A 47 47 THR CA C 47 61.346 60.338 1.008 1 1 257 . 19 1 1 A 47 47 THR CB C 47 69.573 70.577 -1.004 1 1 259 . 19 1 1 A 47 47 THR N N 47 114.265 113.094 1.171 1 1 260 . 19 1 1 A 48 48 ARG H H 48 8.237 8.895 -0.658 1 1 261 . 19 1 1 A 48 48 ARG C C 48 175.898 176.120 -0.222 1 1 262 . 19 1 1 A 48 48 ARG CA C 48 55.717 56.133 -0.416 1 1 263 . 19 1 1 A 48 48 ARG CB C 48 30.151 31.100 -0.949 1 1 266 . 19 1 1 A 48 48 ARG N N 48 122.795 127.341 -4.546 1 1 267 . 19 1 1 A 49 49 ASN H H 49 8.369 8.697 -0.328 1 1 268 . 19 1 1 A 49 49 ASN C C 49 174.560 175.011 -0.451 1 1 269 . 19 1 1 A 49 49 ASN CA C 49 53.005 53.148 -0.143 1 1 270 . 19 1 1 A 49 49 ASN CB C 49 38.761 39.594 -0.833 1 1 271 . 19 1 1 A 49 49 ASN N N 49 119.837 120.817 -0.980 1 1 272 . 19 1 1 A 50 50 ASP H H 50 8.192 8.782 -0.590 1 1 273 . 19 1 1 A 50 50 ASP C C 50 175.699 175.172 0.527 1 1 274 . 19 1 1 A 50 50 ASP CA C 50 54.289 53.161 1.128 1 1 275 . 19 1 1 A 50 50 ASP CB C 50 41.264 40.663 0.601 1 1 276 . 19 1 1 A 50 50 ASP N N 50 120.403 122.271 -1.868 1 1 277 . 19 1 1 A 51 51 GLN H H 51 8.428 8.565 -0.137 1 1 278 . 19 1 1 A 51 51 GLN C C 51 175.186 176.163 -0.977 1 1 279 . 19 1 1 A 51 51 GLN CA C 51 54.512 55.848 -1.336 1 1 280 . 19 1 1 A 51 51 GLN CB C 51 30.424 29.379 1.045 1 1 282 . 19 1 1 A 51 51 GLN N N 51 118.959 123.539 -4.580 1 1 289 . 19 1 1 A 52 52 LEU C C 52 176.018 176.342 -0.324 1 1 290 . 19 1 1 A 52 52 LEU CA C 52 54.332 52.987 1.345 1 1 291 . 19 1 1 A 52 52 LEU CB C 52 43.022 43.687 -0.665 1 1 294 . 19 1 1 A 53 53 GLY H H 53 8.639 8.761 -0.122 1 1 295 . 19 1 1 A 53 53 GLY C C 53 171.931 172.305 -0.374 1 1 296 . 19 1 1 A 53 53 GLY CA C 53 43.501 44.504 -1.003 1 1 297 . 19 1 1 A 53 53 GLY N N 53 109.964 108.569 1.395 1 1 298 . 19 1 1 A 54 54 ALA H H 54 8.881 8.455 0.426 1 1 299 . 19 1 1 A 54 54 ALA C C 54 175.543 176.133 -0.590 1 1 300 . 19 1 1 A 54 54 ALA CA C 54 50.710 50.088 0.622 1 1 301 . 19 1 1 A 54 54 ALA CB C 54 22.914 22.541 0.373 1 1 302 . 19 1 1 A 54 54 ALA N N 54 120.413 122.515 -2.102 1 1 303 . 19 1 1 A 55 55 GLY H H 55 8.346 9.434 -1.088 1 1 304 . 19 1 1 A 55 55 GLY C C 55 170.960 172.092 -1.132 1 1 305 . 19 1 1 A 55 55 GLY CA C 55 46.704 44.956 1.748 1 1 306 . 19 1 1 A 55 55 GLY N N 55 104.688 107.532 -2.844 1 1 307 . 19 1 1 A 56 56 ALA H H 56 9.116 9.222 -0.106 1 1 308 . 19 1 1 A 56 56 ALA C C 56 176.472 177.139 -0.667 1 1 309 . 19 1 1 A 56 56 ALA CA C 56 49.638 51.011 -1.373 1 1 310 . 19 1 1 A 56 56 ALA CB C 56 22.275 21.389 0.886 1 1 311 . 19 1 1 A 56 56 ALA N N 56 120.608 126.786 -6.178 1 1 312 . 19 1 1 A 57 57 PHE H H 57 8.688 9.098 -0.410 1 1 313 . 19 1 1 A 57 57 PHE C C 57 172.816 174.098 -1.282 1 1 314 . 19 1 1 A 57 57 PHE CA C 57 56.066 55.146 0.920 1 1 315 . 19 1 1 A 57 57 PHE CB C 57 41.770 41.950 -0.180 1 1 316 . 19 1 1 A 57 57 PHE N N 57 120.027 117.573 2.454 1 1 317 . 19 1 1 A 58 58 GLY H H 58 9.034 8.580 0.454 1 1 318 . 19 1 1 A 58 58 GLY C C 58 170.860 172.785 -1.925 1 1 319 . 19 1 1 A 58 58 GLY CA C 58 44.954 44.898 0.056 1 1 320 . 19 1 1 A 58 58 GLY N N 58 105.817 107.687 -1.870 1 1 321 . 19 1 1 A 59 59 GLY H H 59 8.382 8.794 -0.412 1 1 322 . 19 1 1 A 59 59 GLY C C 59 169.284 172.441 -3.157 1 1 323 . 19 1 1 A 59 59 GLY CA C 59 45.840 45.613 0.227 1 1 324 . 19 1 1 A 59 59 GLY N N 59 109.059 110.131 -1.072 1 1 325 . 19 1 1 A 60 60 TYR H H 60 8.430 8.770 -0.340 1 1 326 . 19 1 1 A 60 60 TYR C C 60 173.453 172.236 1.217 1 1 327 . 19 1 1 A 60 60 TYR CA C 60 55.282 56.128 -0.846 1 1 328 . 19 1 1 A 60 60 TYR CB C 60 41.712 41.148 0.564 1 1 329 . 19 1 1 A 60 60 TYR N N 60 118.352 115.611 2.741 1 1 330 . 19 1 1 A 61 61 GLN H H 61 8.833 8.964 -0.131 1 1 331 . 19 1 1 A 61 61 GLN C C 61 174.365 175.359 -0.994 1 1 332 . 19 1 1 A 61 61 GLN CA C 61 54.125 55.189 -1.064 1 1 333 . 19 1 1 A 61 61 GLN CB C 61 28.033 30.495 -2.462 1 1 335 . 19 1 1 A 61 61 GLN N N 61 129.628 121.023 8.605 1 1 336 . 19 1 1 A 62 62 VAL H H 62 8.714 8.723 -0.009 1 1 343 . 19 1 1 A 62 62 VAL C C 62 175.758 175.510 0.248 1 1 344 . 19 1 1 A 62 62 VAL CA C 62 64.649 63.504 1.145 1 1 345 . 19 1 1 A 62 62 VAL CB C 62 31.900 33.963 -2.063 1 1 348 . 19 1 1 A 62 62 VAL N N 62 127.666 124.282 3.384 1 1 349 . 19 1 1 A 63 63 ASN H H 63 8.062 8.048 0.014 1 1 350 . 19 1 1 A 63 63 ASN C C 63 172.827 174.268 -1.441 1 1 351 . 19 1 1 A 63 63 ASN CA C 63 51.575 51.097 0.478 1 1 352 . 19 1 1 A 63 63 ASN CB C 63 37.194 38.671 -1.477 1 1 353 . 19 1 1 A 63 63 ASN N N 63 116.310 118.107 -1.797 1 1 354 . 19 1 1 A 64 64 PRO C C 64 175.071 176.020 -0.949 1 1 355 . 19 1 1 A 64 64 PRO CA C 64 65.296 62.544 2.752 1 1 356 . 19 1 1 A 64 64 PRO CB C 64 30.428 29.313 1.115 1 1 357 . 19 1 1 A 65 65 TYR H H 65 7.873 8.787 -0.914 1 1 358 . 19 1 1 A 65 65 TYR C C 65 175.145 174.864 0.281 1 1 359 . 19 1 1 A 65 65 TYR CA C 65 56.125 58.477 -2.352 1 1 360 . 19 1 1 A 65 65 TYR CB C 65 39.189 41.143 -1.954 1 1 361 . 19 1 1 A 65 65 TYR N N 65 112.894 122.592 -9.698 1 1 362 . 19 1 1 A 66 66 LEU H H 66 7.308 7.814 -0.506 1 1 369 . 19 1 1 A 66 66 LEU C C 66 173.866 174.687 -0.821 1 1 370 . 19 1 1 A 66 66 LEU CA C 66 53.431 53.762 -0.331 1 1 371 . 19 1 1 A 66 66 LEU CB C 66 44.958 44.464 0.494 1 1 375 . 19 1 1 A 66 66 LEU N N 66 120.270 117.558 2.712 1 1 376 . 19 1 1 A 67 67 GLY H H 67 8.855 8.449 0.406 1 1 377 . 19 1 1 A 67 67 GLY C C 67 170.698 172.104 -1.406 1 1 378 . 19 1 1 A 67 67 GLY CA C 67 44.008 44.471 -0.463 1 1 379 . 19 1 1 A 67 67 GLY N N 67 114.388 106.712 7.676 1 1 380 . 19 1 1 A 68 68 PHE H H 68 8.770 8.627 0.143 1 1 381 . 19 1 1 A 68 68 PHE C C 68 173.386 174.271 -0.885 1 1 382 . 19 1 1 A 68 68 PHE CA C 68 56.507 57.381 -0.874 1 1 383 . 19 1 1 A 68 68 PHE CB C 68 42.428 40.523 1.905 1 1 384 . 19 1 1 A 68 68 PHE N N 68 117.510 118.815 -1.305 1 1 385 . 19 1 1 A 69 69 GLU H H 69 9.079 9.308 -0.229 1 1 386 . 19 1 1 A 69 69 GLU C C 69 174.556 174.084 0.472 1 1 387 . 19 1 1 A 69 69 GLU CA C 69 54.939 54.734 0.205 1 1 388 . 19 1 1 A 69 69 GLU CB C 69 33.963 33.391 0.572 1 1 390 . 19 1 1 A 69 69 GLU N N 69 120.562 123.186 -2.624 1 1 391 . 19 1 1 A 70 70 MET H H 70 9.481 9.033 0.448 1 1 392 . 19 1 1 A 70 70 MET C C 70 174.595 174.859 -0.264 1 1 393 . 19 1 1 A 70 70 MET CA C 70 53.091 53.740 -0.649 1 1 394 . 19 1 1 A 70 70 MET CB C 70 36.159 35.682 0.477 1 1 397 . 19 1 1 A 70 70 MET N N 70 124.928 126.422 -1.494 1 1 398 . 19 1 1 A 71 71 GLY H H 71 8.845 8.852 -0.007 1 1 399 . 19 1 1 A 71 71 GLY C C 71 170.811 171.366 -0.555 1 1 400 . 19 1 1 A 71 71 GLY CA C 71 44.624 43.771 0.853 1 1 401 . 19 1 1 A 71 71 GLY N N 71 108.896 112.454 -3.558 1 1 402 . 19 1 1 A 72 72 TYR H H 72 8.925 8.938 -0.013 1 1 403 . 19 1 1 A 72 72 TYR C C 72 173.278 173.964 -0.686 1 1 404 . 19 1 1 A 72 72 TYR CA C 72 55.912 56.302 -0.390 1 1 405 . 19 1 1 A 72 72 TYR CB C 72 41.611 40.655 0.956 1 1 406 . 19 1 1 A 72 72 TYR N N 72 123.253 121.668 1.585 1 1 407 . 19 1 1 A 73 73 ASP H H 73 8.665 9.140 -0.475 1 1 408 . 19 1 1 A 73 73 ASP C C 73 173.598 175.210 -1.612 1 1 409 . 19 1 1 A 73 73 ASP CA C 73 52.857 53.551 -0.694 1 1 410 . 19 1 1 A 73 73 ASP CB C 73 42.774 42.615 0.159 1 1 411 . 19 1 1 A 73 73 ASP N N 73 126.178 124.855 1.323 1 1 412 . 19 1 1 A 74 74 TRP H H 74 9.080 9.249 -0.169 1 1 413 . 19 1 1 A 74 74 TRP C C 74 174.868 175.561 -0.693 1 1 414 . 19 1 1 A 74 74 TRP CB C 74 30.083 33.982 -3.899 1 1 415 . 19 1 1 A 74 74 TRP N N 74 121.824 125.610 -3.786 1 1 416 . 19 1 1 A 78 78 MET C C 78 174.548 176.403 -1.855 1 1 417 . 19 1 1 A 78 78 MET CA C 78 54.388 54.379 0.009 1 1 418 . 19 1 1 A 78 78 MET CB C 78 32.542 33.832 -1.290 1 1 419 . 19 1 1 A 79 79 ALA H H 79 8.105 8.439 -0.334 1 1 420 . 19 1 1 A 79 79 ALA C C 79 176.629 176.888 -0.259 1 1 421 . 19 1 1 A 79 79 ALA CA C 79 51.210 51.787 -0.577 1 1 422 . 19 1 1 A 79 79 ALA CB C 79 19.106 20.132 -1.026 1 1 423 . 19 1 1 A 79 79 ALA N N 79 125.778 124.363 1.415 1 1 424 . 19 1 1 A 80 80 TYR H H 80 8.035 9.048 -1.013 1 1 425 . 19 1 1 A 80 80 TYR C C 80 175.604 175.233 0.371 1 1 426 . 19 1 1 A 80 80 TYR CA C 80 57.021 57.127 -0.106 1 1 427 . 19 1 1 A 80 80 TYR CB C 80 38.416 39.282 -0.866 1 1 428 . 19 1 1 A 80 80 TYR N N 80 120.045 120.463 -0.418 1 1 429 . 19 1 1 A 81 81 LYS H H 81 8.295 8.555 -0.260 1 1 430 . 19 1 1 A 81 81 LYS C C 81 176.647 176.387 0.260 1 1 431 . 19 1 1 A 81 81 LYS CA C 81 56.285 56.674 -0.389 1 1 432 . 19 1 1 A 81 81 LYS CB C 81 31.571 34.302 -2.731 1 1 434 . 19 1 1 A 81 81 LYS N N 81 123.191 121.721 1.470 1 1 435 . 19 1 1 A 82 82 GLY H H 82 8.117 8.153 -0.036 1 1 436 . 19 1 1 A 82 82 GLY C C 82 174.010 174.604 -0.594 1 1 437 . 19 1 1 A 82 82 GLY CA C 82 44.982 44.000 0.982 1 1 438 . 19 1 1 A 82 82 GLY N N 82 110.014 109.411 0.603 1 1 439 . 19 1 1 A 83 83 SER H H 83 7.938 8.757 -0.819 1 1 440 . 19 1 1 A 83 83 SER C C 83 174.634 174.906 -0.272 1 1 441 . 19 1 1 A 83 83 SER CA C 83 57.685 59.963 -2.278 1 1 442 . 19 1 1 A 83 83 SER CB C 83 63.303 63.752 -0.449 1 1 443 . 19 1 1 A 83 83 SER N N 83 115.655 114.417 1.238 1 1 444 . 19 1 1 A 84 84 VAL H H 84 8.008 7.647 0.361 1 1 451 . 19 1 1 A 84 84 VAL C C 84 175.525 174.576 0.949 1 1 452 . 19 1 1 A 84 84 VAL CA C 84 61.769 61.813 -0.044 1 1 453 . 19 1 1 A 84 84 VAL CB C 84 31.711 30.730 0.981 1 1 456 . 19 1 1 A 84 84 VAL N N 84 120.054 117.288 2.766 1 1 457 . 19 1 1 A 85 85 ASP H H 85 8.140 8.286 -0.146 1 1 458 . 19 1 1 A 85 85 ASP C C 85 174.740 175.637 -0.897 1 1 459 . 19 1 1 A 85 85 ASP CA C 85 53.983 54.110 -0.127 1 1 460 . 19 1 1 A 85 85 ASP CB C 85 40.633 42.815 -2.182 1 1 461 . 19 1 1 A 85 85 ASP N N 85 122.510 124.891 -2.381 1 1 462 . 19 1 1 A 86 86 ASN H H 86 7.736 8.953 -1.217 1 1 463 . 19 1 1 A 86 86 ASN C C 86 175.970 175.611 0.359 1 1 464 . 19 1 1 A 86 86 ASN CA C 86 54.349 55.205 -0.856 1 1 465 . 19 1 1 A 86 86 ASN CB C 86 40.490 38.898 1.592 1 1 467 . 19 1 1 A 86 86 ASN N N 86 124.290 124.070 0.220 1 1 468 . 19 1 1 A 87 87 GLY H H 87 8.000 7.334 0.666 1 1 469 . 19 1 1 A 87 87 GLY C C 87 173.456 171.812 1.644 1 1 470 . 19 1 1 A 87 87 GLY CA C 87 44.973 45.770 -0.797 1 1 471 . 19 1 1 A 87 87 GLY N N 87 113.494 103.739 9.755 1 1 472 . 19 1 1 A 88 88 ALA H H 88 8.024 8.261 -0.237 1 1 473 . 19 1 1 A 88 88 ALA C C 88 176.833 176.046 0.787 1 1 474 . 19 1 1 A 88 88 ALA CA C 88 51.734 50.899 0.835 1 1 475 . 19 1 1 A 88 88 ALA CB C 88 19.818 20.202 -0.384 1 1 476 . 19 1 1 A 88 88 ALA N N 88 122.676 123.603 -0.927 1 1 477 . 19 1 1 A 91 91 ALA C C 91 174.781 174.851 -0.070 1 1 478 . 19 1 1 A 91 91 ALA CA C 91 50.537 51.800 -1.263 1 1 479 . 19 1 1 A 91 91 ALA CB C 91 21.324 22.462 -1.138 1 1 480 . 19 1 1 A 92 92 GLN H H 92 8.451 8.580 -0.129 1 1 481 . 19 1 1 A 92 92 GLN C C 92 173.557 175.817 -2.260 1 1 482 . 19 1 1 A 92 92 GLN CA C 92 53.380 54.218 -0.838 1 1 484 . 19 1 1 A 92 92 GLN N N 92 116.847 118.536 -1.689 1 1 485 . 19 1 1 A 93 93 GLY C C 93 170.631 172.805 -2.174 1 1 486 . 19 1 1 A 93 93 GLY CA C 93 45.718 44.777 0.941 1 1 487 . 19 1 1 A 94 94 VAL H H 94 8.686 9.314 -0.628 1 1 494 . 19 1 1 A 94 94 VAL C C 94 173.698 174.816 -1.118 1 1 495 . 19 1 1 A 94 94 VAL CA C 94 58.997 60.140 -1.143 1 1 496 . 19 1 1 A 94 94 VAL CB C 94 33.311 34.329 -1.018 1 1 499 . 19 1 1 A 94 94 VAL N N 94 118.489 120.949 -2.460 1 1 500 . 19 1 1 A 95 95 GLN H H 95 9.468 9.483 -0.015 1 1 501 . 19 1 1 A 95 95 GLN C C 95 174.028 174.706 -0.678 1 1 502 . 19 1 1 A 95 95 GLN CA C 95 52.547 54.223 -1.676 1 1 503 . 19 1 1 A 95 95 GLN CB C 95 33.816 32.036 1.780 1 1 505 . 19 1 1 A 95 95 GLN N N 95 122.106 126.097 -3.991 1 1 506 . 19 1 1 A 96 96 LEU H H 96 8.484 8.872 -0.388 1 1 513 . 19 1 1 A 96 96 LEU C C 96 175.322 175.289 0.033 1 1 514 . 19 1 1 A 96 96 LEU CA C 96 53.736 54.175 -0.439 1 1 515 . 19 1 1 A 96 96 LEU CB C 96 41.088 45.470 -4.382 1 1 519 . 19 1 1 A 96 96 LEU N N 96 123.224 124.616 -1.392 1 1 520 . 19 1 1 A 97 97 THR H H 97 9.116 8.967 0.149 1 1 521 . 19 1 1 A 97 97 THR C C 97 173.251 171.808 1.443 1 1 522 . 19 1 1 A 97 97 THR CA C 97 58.931 59.705 -0.774 1 1 523 . 19 1 1 A 97 97 THR CB C 97 72.984 71.745 1.239 1 1 525 . 19 1 1 A 97 97 THR N N 97 112.504 115.694 -3.190 1 1 526 . 19 1 1 A 98 98 ALA H H 98 8.603 8.593 0.010 1 1 527 . 19 1 1 A 98 98 ALA C C 98 174.948 175.579 -0.631 1 1 528 . 19 1 1 A 98 98 ALA CA C 98 49.980 50.003 -0.023 1 1 529 . 19 1 1 A 98 98 ALA CB C 98 19.157 20.446 -1.289 1 1 530 . 19 1 1 A 98 98 ALA N N 98 121.608 123.609 -2.001 1 1 531 . 19 1 1 A 99 99 LYS H H 99 8.890 9.148 -0.258 1 1 532 . 19 1 1 A 99 99 LYS C C 99 174.294 174.952 -0.658 1 1 533 . 19 1 1 A 99 99 LYS CA C 99 54.019 54.628 -0.609 1 1 534 . 19 1 1 A 99 99 LYS CB C 99 33.018 35.629 -2.611 1 1 538 . 19 1 1 A 99 99 LYS N N 99 124.522 123.277 1.245 1 1 539 . 19 1 1 A 100 100 LEU H H 100 8.985 8.847 0.138 1 1 546 . 19 1 1 A 100 100 LEU C C 100 175.265 175.425 -0.160 1 1 547 . 19 1 1 A 100 100 LEU CA C 100 52.698 53.098 -0.400 1 1 548 . 19 1 1 A 100 100 LEU CB C 100 42.889 45.193 -2.304 1 1 552 . 19 1 1 A 100 100 LEU N N 100 131.876 122.948 8.928 1 1 553 . 19 1 1 A 101 101 GLY H H 101 9.137 8.192 0.945 1 1 554 . 19 1 1 A 101 101 GLY C C 101 170.798 171.052 -0.254 1 1 555 . 19 1 1 A 101 101 GLY CA C 101 44.429 45.070 -0.641 1 1 556 . 19 1 1 A 101 101 GLY N N 101 111.928 107.657 4.271 1 1 557 . 19 1 1 A 102 102 TYR H H 102 8.779 8.193 0.586 1 1 558 . 19 1 1 A 102 102 TYR C C 102 173.402 173.304 0.098 1 1 559 . 19 1 1 A 102 102 TYR CA C 102 54.444 55.962 -1.518 1 1 560 . 19 1 1 A 102 102 TYR CB C 102 42.239 42.569 -0.330 1 1 561 . 19 1 1 A 102 102 TYR N N 102 116.664 118.828 -2.164 1 1 562 . 19 1 1 A 103 103 PRO C C 103 175.676 176.542 -0.866 1 1 563 . 19 1 1 A 103 103 PRO CA C 103 61.462 62.581 -1.119 1 1 564 . 19 1 1 A 103 103 PRO CB C 103 30.073 33.714 -3.641 1 1 565 . 19 1 1 A 104 104 ILE H H 104 8.670 9.114 -0.444 1 1 569 . 19 1 1 A 104 104 ILE C C 104 176.646 177.193 -0.547 1 1 570 . 19 1 1 A 104 104 ILE CA C 104 62.054 62.202 -0.148 1 1 571 . 19 1 1 A 104 104 ILE CB C 104 37.678 39.387 -1.709 1 1 574 . 19 1 1 A 104 104 ILE N N 104 125.939 120.213 5.726 1 1 575 . 19 1 1 A 105 105 THR H H 105 8.129 7.732 0.397 1 1 576 . 19 1 1 A 105 105 THR C C 105 174.344 173.863 0.481 1 1 577 . 19 1 1 A 105 105 THR CA C 105 59.176 63.215 -4.039 1 1 578 . 19 1 1 A 105 105 THR CB C 105 71.049 71.240 -0.191 1 1 580 . 19 1 1 A 105 105 THR N N 105 109.853 111.906 -2.053 1 1 581 . 19 1 1 A 106 106 ASP H H 106 8.424 7.744 0.680 1 1 582 . 19 1 1 A 106 106 ASP C C 106 175.692 176.296 -0.604 1 1 583 . 19 1 1 A 106 106 ASP CA C 106 56.465 55.141 1.324 1 1 584 . 19 1 1 A 106 106 ASP CB C 106 40.032 43.545 -3.513 1 1 585 . 19 1 1 A 106 106 ASP N N 106 117.156 117.785 -0.629 1 1 586 . 19 1 1 A 107 107 ASP H H 107 8.124 8.838 -0.714 1 1 587 . 19 1 1 A 107 107 ASP C C 107 174.174 174.140 0.034 1 1 588 . 19 1 1 A 107 107 ASP CA C 107 52.907 54.021 -1.114 1 1 589 . 19 1 1 A 107 107 ASP CB C 107 41.661 41.762 -0.101 1 1 590 . 19 1 1 A 107 107 ASP N N 107 113.591 117.485 -3.894 1 1 591 . 19 1 1 A 108 108 LEU H H 108 7.336 7.327 0.009 1 1 598 . 19 1 1 A 108 108 LEU C C 108 174.321 174.472 -0.151 1 1 599 . 19 1 1 A 108 108 LEU CA C 108 54.449 53.582 0.867 1 1 600 . 19 1 1 A 108 108 LEU CB C 108 44.754 45.086 -0.332 1 1 604 . 19 1 1 A 108 108 LEU N N 108 123.244 120.250 2.994 1 1 605 . 19 1 1 A 109 109 ASP H H 109 8.943 8.542 0.401 1 1 606 . 19 1 1 A 109 109 ASP C C 109 176.248 173.260 2.988 1 1 607 . 19 1 1 A 109 109 ASP CA C 109 52.376 53.054 -0.678 1 1 608 . 19 1 1 A 109 109 ASP CB C 109 42.764 45.132 -2.368 1 1 609 . 19 1 1 A 109 109 ASP N N 109 124.634 123.455 1.179 1 1 610 . 19 1 1 A 110 110 ILE H H 110 8.372 8.738 -0.366 1 1 614 . 19 1 1 A 110 110 ILE C C 110 173.735 173.140 0.595 1 1 615 . 19 1 1 A 110 110 ILE CA C 110 59.129 58.693 0.436 1 1 616 . 19 1 1 A 110 110 ILE CB C 110 39.402 41.185 -1.783 1 1 620 . 19 1 1 A 110 110 ILE N N 110 119.135 121.745 -2.610 1 1 621 . 19 1 1 A 111 111 TYR H H 111 8.695 9.011 -0.316 1 1 622 . 19 1 1 A 111 111 TYR C C 111 172.838 174.460 -1.622 1 1 623 . 19 1 1 A 111 111 TYR CA C 111 56.182 56.347 -0.165 1 1 624 . 19 1 1 A 111 111 TYR CB C 111 41.489 42.935 -1.446 1 1 625 . 19 1 1 A 111 111 TYR N N 111 121.248 127.218 -5.970 1 1 626 . 19 1 1 A 112 112 THR H H 112 9.172 9.117 0.055 1 1 627 . 19 1 1 A 112 112 THR C C 112 173.850 173.349 0.501 1 1 628 . 19 1 1 A 112 112 THR CA C 112 58.246 60.339 -2.093 1 1 629 . 19 1 1 A 112 112 THR CB C 112 71.676 71.665 0.011 1 1 631 . 19 1 1 A 112 112 THR N N 112 110.671 113.144 -2.473 1 1 632 . 19 1 1 A 113 113 ARG H H 113 8.732 9.794 -1.062 1 1 633 . 19 1 1 A 113 113 ARG C C 113 175.037 174.515 0.522 1 1 634 . 19 1 1 A 113 113 ARG CA C 113 53.995 54.682 -0.687 1 1 635 . 19 1 1 A 113 113 ARG CB C 113 32.266 32.840 -0.574 1 1 638 . 19 1 1 A 113 113 ARG N N 113 120.642 122.988 -2.346 1 1 639 . 19 1 1 A 114 114 LEU H H 114 8.449 8.901 -0.452 1 1 646 . 19 1 1 A 114 114 LEU C C 114 175.812 175.769 0.043 1 1 647 . 19 1 1 A 114 114 LEU CA C 114 53.335 54.037 -0.702 1 1 648 . 19 1 1 A 114 114 LEU CB C 114 45.182 45.683 -0.501 1 1 652 . 19 1 1 A 114 114 LEU N N 114 119.078 125.457 -6.379 1 1 653 . 19 1 1 A 115 115 GLY H H 115 8.232 8.489 -0.257 1 1 654 . 19 1 1 A 115 115 GLY C C 115 171.343 172.470 -1.127 1 1 655 . 19 1 1 A 115 115 GLY CA C 115 46.217 46.111 0.106 1 1 656 . 19 1 1 A 115 115 GLY N N 115 108.966 112.396 -3.430 1 1 657 . 19 1 1 A 116 116 GLY H H 116 8.293 8.355 -0.062 1 1 658 . 19 1 1 A 116 116 GLY C C 116 169.856 171.995 -2.139 1 1 659 . 19 1 1 A 116 116 GLY CA C 116 44.084 44.908 -0.824 1 1 660 . 19 1 1 A 116 116 GLY N N 116 109.676 110.879 -1.203 1 1 661 . 19 1 1 A 117 117 MET H H 117 9.286 9.271 0.015 1 1 662 . 19 1 1 A 117 117 MET C C 117 174.557 174.569 -0.012 1 1 663 . 19 1 1 A 117 117 MET CA C 117 53.258 54.336 -1.078 1 1 664 . 19 1 1 A 117 117 MET CB C 117 37.195 35.790 1.405 1 1 667 . 19 1 1 A 117 117 MET N N 117 120.425 120.473 -0.048 1 1 668 . 19 1 1 A 118 118 VAL H H 118 9.062 9.191 -0.129 1 1 675 . 19 1 1 A 118 118 VAL C C 118 173.993 174.673 -0.680 1 1 676 . 19 1 1 A 118 118 VAL CA C 118 59.883 60.512 -0.629 1 1 677 . 19 1 1 A 118 118 VAL CB C 118 31.782 35.012 -3.230 1 1 680 . 19 1 1 A 118 118 VAL N N 118 126.948 124.395 2.553 1 1 681 . 19 1 1 A 119 119 TRP H H 119 8.482 8.837 -0.355 1 1 682 . 19 1 1 A 119 119 TRP C C 119 174.608 173.728 0.880 1 1 683 . 19 1 1 A 119 119 TRP CA C 119 53.332 55.195 -1.863 1 1 684 . 19 1 1 A 119 119 TRP CB C 119 33.569 32.882 0.687 1 1 685 . 19 1 1 A 119 119 TRP N N 119 124.631 124.355 0.276 1 1 686 . 19 1 1 A 120 120 ARG H H 120 9.113 8.980 0.133 1 1 687 . 19 1 1 A 120 120 ARG C C 120 174.951 174.528 0.423 1 1 688 . 19 1 1 A 120 120 ARG CA C 120 54.684 54.248 0.436 1 1 689 . 19 1 1 A 120 120 ARG CB C 120 33.424 34.004 -0.580 1 1 690 . 19 1 1 A 120 120 ARG N N 120 117.899 119.817 -1.918 1 1 691 . 19 1 1 A 121 121 ALA H H 121 9.299 8.908 0.391 1 1 692 . 19 1 1 A 121 121 ALA C C 121 175.954 176.098 -0.144 1 1 693 . 19 1 1 A 121 121 ALA CA C 121 50.368 50.521 -0.153 1 1 694 . 19 1 1 A 121 121 ALA CB C 121 21.141 21.371 -0.230 1 1 695 . 19 1 1 A 121 121 ALA N N 121 128.863 123.762 5.101 1 1 696 . 19 1 1 A 122 122 ASP H H 122 8.488 8.819 -0.331 1 1 697 . 19 1 1 A 122 122 ASP C C 122 175.635 174.003 1.632 1 1 698 . 19 1 1 A 122 122 ASP CA C 122 53.891 53.816 0.075 1 1 699 . 19 1 1 A 122 122 ASP CB C 122 42.492 45.404 -2.912 1 1 700 . 19 1 1 A 122 122 ASP N N 122 121.721 121.663 0.058 1 1 701 . 19 1 1 A 123 123 SER H H 123 8.466 8.516 -0.050 1 1 702 . 19 1 1 A 123 123 SER C C 123 174.325 173.622 0.703 1 1 703 . 19 1 1 A 123 123 SER CA C 123 57.325 56.957 0.368 1 1 704 . 19 1 1 A 123 123 SER CB C 123 63.988 66.425 -2.437 1 1 705 . 19 1 1 A 123 123 SER N N 123 117.374 120.095 -2.721 1 1 706 . 19 1 1 A 124 124 LYS H H 124 8.389 8.754 -0.365 1 1 707 . 19 1 1 A 124 124 LYS C C 124 176.840 175.461 1.379 1 1 708 . 19 1 1 A 124 124 LYS CA C 124 56.036 55.673 0.363 1 1 709 . 19 1 1 A 124 124 LYS CB C 124 32.397 35.639 -3.242 1 1 711 . 19 1 1 A 124 124 LYS N N 124 122.883 124.559 -1.676 1 1 712 . 19 1 1 A 125 125 GLY H H 125 8.281 8.502 -0.221 1 1 713 . 19 1 1 A 125 125 GLY C C 125 173.592 171.773 1.819 1 1 714 . 19 1 1 A 125 125 GLY CA C 125 44.924 46.116 -1.192 1 1 715 . 19 1 1 A 125 125 GLY N N 125 109.541 112.986 -3.445 1 1 716 . 19 1 1 A 126 126 ASN H H 126 8.185 8.522 -0.337 1 1 717 . 19 1 1 A 126 126 ASN C C 126 176.649 174.138 2.511 1 1 718 . 19 1 1 A 126 126 ASN CA C 126 52.763 52.972 -0.209 1 1 719 . 19 1 1 A 126 126 ASN CB C 126 38.439 39.363 -0.924 1 1 720 . 19 1 1 A 126 126 ASN N N 126 119.019 120.806 -1.787 1 1 721 . 19 1 1 A 127 127 TYR C C 127 176.913 174.221 2.692 1 1 722 . 19 1 1 A 127 127 TYR CA C 127 57.757 56.775 0.982 1 1 723 . 19 1 1 A 127 127 TYR CB C 127 37.703 41.674 -3.971 1 1 724 . 19 1 1 A 128 128 ALA H H 128 8.050 9.171 -1.121 1 1 728 . 19 1 1 A 128 128 ALA C C 128 177.756 175.510 2.246 1 1 729 . 19 1 1 A 128 128 ALA CA C 128 52.321 50.720 1.601 1 1 730 . 19 1 1 A 128 128 ALA CB C 128 18.273 20.746 -2.473 1 1 731 . 19 1 1 A 128 128 ALA N N 128 124.529 123.331 1.198 1 1 732 . 19 1 1 A 129 129 SER H H 129 8.063 9.145 -1.082 1 1 733 . 19 1 1 A 129 129 SER C C 129 174.938 174.789 0.149 1 1 734 . 19 1 1 A 129 129 SER CA C 129 58.202 58.681 -0.479 1 1 735 . 19 1 1 A 129 129 SER CB C 129 62.974 63.724 -0.750 1 1 736 . 19 1 1 A 129 129 SER N N 129 114.374 122.235 -7.861 1 1 737 . 19 1 1 A 130 130 THR H H 130 7.875 8.748 -0.873 1 1 741 . 19 1 1 A 130 130 THR C C 130 175.198 176.126 -0.928 1 1 742 . 19 1 1 A 130 130 THR CA C 130 61.520 62.988 -1.468 1 1 743 . 19 1 1 A 130 130 THR CB C 130 69.312 69.720 -0.408 1 1 745 . 19 1 1 A 130 130 THR N N 130 113.608 115.913 -2.305 1 1 746 . 19 1 1 A 131 131 GLY H H 131 8.219 7.852 0.367 1 1 747 . 19 1 1 A 131 131 GLY C C 131 173.979 174.600 -0.621 1 1 748 . 19 1 1 A 131 131 GLY CA C 131 44.991 46.767 -1.776 1 1 749 . 19 1 1 A 131 131 GLY N N 131 110.848 110.975 -0.127 1 1 750 . 19 1 1 A 132 132 VAL H H 132 7.729 7.927 -0.198 1 1 757 . 19 1 1 A 132 132 VAL C C 132 175.988 174.597 1.391 1 1 758 . 19 1 1 A 132 132 VAL CA C 132 61.643 59.227 2.416 1 1 759 . 19 1 1 A 132 132 VAL CB C 132 31.941 35.963 -4.022 1 1 762 . 19 1 1 A 132 132 VAL N N 132 118.932 113.678 5.254 1 1 763 . 19 1 1 A 133 133 SER H H 133 8.224 8.704 -0.480 1 1 764 . 19 1 1 A 133 133 SER C C 133 174.320 174.569 -0.249 1 1 765 . 19 1 1 A 133 133 SER CA C 133 57.756 58.599 -0.843 1 1 766 . 19 1 1 A 133 133 SER CB C 133 63.140 64.171 -1.031 1 1 767 . 19 1 1 A 133 133 SER N N 133 119.260 115.518 3.742 1 1 768 . 19 1 1 A 134 134 ARG H H 134 8.199 7.548 0.651 1 1 769 . 19 1 1 A 134 134 ARG C C 134 175.923 175.747 0.176 1 1 770 . 19 1 1 A 134 134 ARG CA C 134 55.461 54.260 1.201 1 1 771 . 19 1 1 A 134 134 ARG CB C 134 30.195 34.194 -3.999 1 1 774 . 19 1 1 A 134 134 ARG N N 134 123.262 120.097 3.165 1 1 775 . 19 1 1 A 135 135 SER H H 135 8.256 8.793 -0.537 1 1 776 . 19 1 1 A 135 135 SER C C 135 174.360 173.900 0.460 1 1 777 . 19 1 1 A 135 135 SER CA C 135 57.730 60.368 -2.638 1 1 778 . 19 1 1 A 135 135 SER CB C 135 63.275 64.121 -0.846 1 1 779 . 19 1 1 A 135 135 SER N N 135 117.155 116.440 0.715 1 1 780 . 19 1 1 A 136 136 GLU H H 136 8.374 7.678 0.696 1 1 781 . 19 1 1 A 136 136 GLU C C 136 176.284 174.932 1.352 1 1 782 . 19 1 1 A 136 136 GLU CA C 136 56.082 54.867 1.215 1 1 783 . 19 1 1 A 136 136 GLU CB C 136 29.820 32.922 -3.102 1 1 785 . 19 1 1 A 136 136 GLU N N 136 122.812 118.505 4.307 1 1 786 . 19 1 1 A 137 137 HIS H H 137 8.118 8.675 -0.557 1 1 787 . 19 1 1 A 137 137 HIS C C 137 173.529 174.460 -0.931 1 1 788 . 19 1 1 A 137 137 HIS CA C 137 54.793 54.823 -0.030 1 1 789 . 19 1 1 A 137 137 HIS CB C 137 30.191 32.556 -2.365 1 1 790 . 19 1 1 A 137 137 HIS N N 137 118.002 117.248 0.754 1 1 791 . 19 1 1 A 138 138 ASP H H 138 8.572 9.096 -0.524 1 1 792 . 19 1 1 A 138 138 ASP C C 138 174.940 175.536 -0.596 1 1 793 . 19 1 1 A 138 138 ASP CA C 138 53.594 53.821 -0.227 1 1 794 . 19 1 1 A 138 138 ASP CB C 138 42.165 42.384 -0.219 1 1 795 . 19 1 1 A 138 138 ASP N N 138 121.536 123.775 -2.239 1 1 796 . 19 1 1 A 139 139 THR H H 139 7.857 8.865 -1.008 1 1 797 . 19 1 1 A 139 139 THR C C 139 172.822 172.813 0.009 1 1 798 . 19 1 1 A 139 139 THR CA C 139 59.197 60.309 -1.112 1 1 799 . 19 1 1 A 139 139 THR CB C 139 71.457 71.388 0.069 1 1 801 . 19 1 1 A 139 139 THR N N 139 113.598 114.702 -1.104 1 1 802 . 19 1 1 A 140 140 GLY C C 140 169.622 171.723 -2.101 1 1 803 . 19 1 1 A 140 140 GLY CA C 140 44.287 43.504 0.783 1 1 804 . 19 1 1 A 141 141 VAL H H 141 7.815 8.683 -0.868 1 1 811 . 19 1 1 A 141 141 VAL C C 141 176.038 173.660 2.378 1 1 812 . 19 1 1 A 141 141 VAL CA C 141 59.739 59.693 0.046 1 1 813 . 19 1 1 A 141 141 VAL CB C 141 33.308 35.413 -2.105 1 1 816 . 19 1 1 A 141 141 VAL N N 141 116.224 122.523 -6.299 1 1 817 . 19 1 1 A 142 142 SER H H 142 9.284 9.040 0.244 1 1 818 . 19 1 1 A 142 142 SER C C 142 171.050 171.854 -0.804 1 1 819 . 19 1 1 A 142 142 SER CB C 142 67.608 66.560 1.048 1 1 820 . 19 1 1 A 142 142 SER N N 142 123.223 122.073 1.150 1 1 821 . 19 1 1 A 143 143 PRO C C 143 174.032 176.364 -2.332 1 1 822 . 19 1 1 A 143 143 PRO CA C 143 62.350 62.629 -0.279 1 1 823 . 19 1 1 A 143 143 PRO CB C 143 31.774 32.270 -0.496 1 1 825 . 19 1 1 A 144 144 VAL H H 144 7.785 8.533 -0.748 1 1 832 . 19 1 1 A 144 144 VAL C C 144 172.826 174.365 -1.539 1 1 833 . 19 1 1 A 144 144 VAL CA C 144 59.770 59.764 0.006 1 1 834 . 19 1 1 A 144 144 VAL CB C 144 34.407 35.918 -1.511 1 1 837 . 19 1 1 A 144 144 VAL N N 144 120.214 116.856 3.358 1 1 838 . 19 1 1 A 145 145 PHE H H 145 8.623 8.587 0.036 1 1 839 . 19 1 1 A 145 145 PHE C C 145 173.658 172.700 0.958 1 1 840 . 19 1 1 A 145 145 PHE CA C 145 54.942 55.780 -0.838 1 1 841 . 19 1 1 A 145 145 PHE CB C 145 42.692 42.357 0.335 1 1 842 . 19 1 1 A 145 145 PHE N N 145 123.914 119.290 4.624 1 1 843 . 19 1 1 A 146 146 ALA H H 146 8.886 8.913 -0.027 1 1 844 . 19 1 1 A 146 146 ALA C C 146 176.258 176.137 0.121 1 1 845 . 19 1 1 A 146 146 ALA CA C 146 49.734 50.114 -0.380 1 1 846 . 19 1 1 A 146 146 ALA CB C 146 22.244 22.078 0.166 1 1 847 . 19 1 1 A 146 146 ALA N N 146 125.243 123.863 1.380 1 1 848 . 19 1 1 A 147 147 GLY H H 147 8.470 8.772 -0.302 1 1 849 . 19 1 1 A 147 147 GLY C C 147 170.940 173.007 -2.067 1 1 850 . 19 1 1 A 147 147 GLY CA C 147 44.063 44.688 -0.625 1 1 851 . 19 1 1 A 147 147 GLY N N 147 106.669 109.186 -2.517 1 1 852 . 19 1 1 A 148 148 GLY H H 148 8.008 8.654 -0.646 1 1 853 . 19 1 1 A 148 148 GLY C C 148 170.181 172.673 -2.492 1 1 854 . 19 1 1 A 148 148 GLY CA C 148 45.736 45.886 -0.150 1 1 855 . 19 1 1 A 148 148 GLY N N 148 109.475 110.079 -0.604 1 1 856 . 19 1 1 A 149 149 VAL H H 149 8.426 8.473 -0.047 1 1 863 . 19 1 1 A 149 149 VAL C C 149 174.157 173.501 0.656 1 1 864 . 19 1 1 A 149 149 VAL CA C 149 58.200 59.047 -0.847 1 1 865 . 19 1 1 A 149 149 VAL CB C 149 34.464 36.100 -1.636 1 1 868 . 19 1 1 A 149 149 VAL N N 149 112.651 118.000 -5.349 1 1 869 . 19 1 1 A 150 150 GLU H H 150 9.070 8.849 0.221 1 1 870 . 19 1 1 A 150 150 GLU C C 150 173.892 174.807 -0.915 1 1 871 . 19 1 1 A 150 150 GLU CA C 150 54.617 54.891 -0.274 1 1 872 . 19 1 1 A 150 150 GLU CB C 150 32.911 33.799 -0.888 1 1 874 . 19 1 1 A 150 150 GLU N N 150 124.471 120.656 3.815 1 1 875 . 19 1 1 A 151 151 TRP H H 151 9.461 9.841 -0.380 1 1 877 . 19 1 1 A 151 151 TRP C C 151 174.370 175.881 -1.511 1 1 878 . 19 1 1 A 151 151 TRP CA C 151 54.113 56.192 -2.079 1 1 879 . 19 1 1 A 151 151 TRP CB C 151 31.688 32.599 -0.911 1 1 880 . 19 1 1 A 151 151 TRP N N 151 129.611 126.594 3.017 1 1 882 . 19 1 1 A 152 152 ALA H H 152 8.771 8.725 0.046 1 1 883 . 19 1 1 A 152 152 ALA C C 152 175.079 176.906 -1.827 1 1 884 . 19 1 1 A 152 152 ALA CA C 152 51.417 51.700 -0.283 1 1 885 . 19 1 1 A 152 152 ALA CB C 152 17.209 19.719 -2.510 1 1 886 . 19 1 1 A 152 152 ALA N N 152 130.502 126.669 3.833 1 1 887 . 19 1 1 A 153 153 VAL H H 153 7.893 8.423 -0.530 1 1 894 . 19 1 1 A 153 153 VAL C C 153 176.612 177.905 -1.293 1 1 895 . 19 1 1 A 153 153 VAL CA C 153 63.600 63.960 -0.360 1 1 896 . 19 1 1 A 153 153 VAL CB C 153 31.280 32.078 -0.798 1 1 899 . 19 1 1 A 153 153 VAL N N 153 124.360 122.813 1.547 1 1 900 . 19 1 1 A 154 154 THR H H 154 7.950 8.067 -0.117 1 1 904 . 19 1 1 A 154 154 THR C C 154 173.884 175.422 -1.538 1 1 905 . 19 1 1 A 154 154 THR CA C 154 58.655 63.277 -4.622 1 1 906 . 19 1 1 A 154 154 THR CB C 154 71.262 68.879 2.383 1 1 908 . 19 1 1 A 154 154 THR N N 154 109.176 111.501 -2.325 1 1 909 . 19 1 1 A 155 155 ARG H H 155 8.310 7.713 0.597 1 1 910 . 19 1 1 A 155 155 ARG C C 155 176.753 176.838 -0.085 1 1 911 . 19 1 1 A 155 155 ARG CA C 155 58.456 57.471 0.985 1 1 912 . 19 1 1 A 155 155 ARG CB C 155 29.043 32.657 -3.614 1 1 915 . 19 1 1 A 155 155 ARG N N 155 116.576 120.481 -3.905 1 1 916 . 19 1 1 A 156 156 ASP H H 156 7.783 8.909 -1.126 1 1 917 . 19 1 1 A 156 156 ASP C C 156 174.222 174.506 -0.284 1 1 918 . 19 1 1 A 156 156 ASP CA C 156 53.540 54.062 -0.522 1 1 919 . 19 1 1 A 156 156 ASP CB C 156 42.327 41.762 0.565 1 1 920 . 19 1 1 A 156 156 ASP N N 156 112.950 117.813 -4.863 1 1 921 . 19 1 1 A 157 157 ILE H H 157 7.233 7.450 -0.217 1 1 925 . 19 1 1 A 157 157 ILE C C 157 174.178 174.985 -0.807 1 1 926 . 19 1 1 A 157 157 ILE CA C 157 59.350 61.099 -1.749 1 1 927 . 19 1 1 A 157 157 ILE CB C 157 38.969 39.873 -0.904 1 1 930 . 19 1 1 A 157 157 ILE N N 157 119.732 120.872 -1.140 1 1 931 . 19 1 1 A 158 158 ALA H H 158 8.729 9.110 -0.381 1 1 932 . 19 1 1 A 158 158 ALA C C 158 176.567 176.421 0.146 1 1 933 . 19 1 1 A 158 158 ALA CA C 158 49.418 50.327 -0.909 1 1 934 . 19 1 1 A 158 158 ALA CB C 158 21.430 23.209 -1.779 1 1 935 . 19 1 1 A 158 158 ALA N N 158 128.564 130.347 -1.783 1 1 936 . 19 1 1 A 159 159 THR H H 159 8.972 9.360 -0.388 1 1 940 . 19 1 1 A 159 159 THR C C 159 172.213 173.482 -1.269 1 1 941 . 19 1 1 A 159 159 THR CA C 159 59.504 60.150 -0.646 1 1 942 . 19 1 1 A 159 159 THR CB C 159 70.728 71.123 -0.395 1 1 944 . 19 1 1 A 159 159 THR N N 159 114.901 110.123 4.778 1 1 945 . 19 1 1 A 160 160 ARG H H 160 8.924 9.267 -0.343 1 1 946 . 19 1 1 A 160 160 ARG C C 160 174.097 173.661 0.436 1 1 947 . 19 1 1 A 160 160 ARG CA C 160 53.066 54.555 -1.489 1 1 948 . 19 1 1 A 160 160 ARG CB C 160 32.922 33.852 -0.930 1 1 951 . 19 1 1 A 160 160 ARG N N 160 121.507 121.938 -0.431 1 1 952 . 19 1 1 A 161 161 LEU H H 161 8.611 9.180 -0.569 1 1 959 . 19 1 1 A 161 161 LEU C C 161 174.389 175.065 -0.676 1 1 960 . 19 1 1 A 161 161 LEU CA C 161 53.355 53.519 -0.164 1 1 961 . 19 1 1 A 161 161 LEU CB C 161 44.360 45.494 -1.134 1 1 964 . 19 1 1 A 161 161 LEU N N 161 124.711 127.932 -3.221 1 1 965 . 19 1 1 A 162 162 GLU H H 162 8.746 8.993 -0.247 1 1 966 . 19 1 1 A 162 162 GLU C C 162 173.376 175.164 -1.788 1 1 967 . 19 1 1 A 162 162 GLU CA C 162 53.904 54.755 -0.851 1 1 968 . 19 1 1 A 162 162 GLU CB C 162 33.773 32.870 0.903 1 1 970 . 19 1 1 A 162 162 GLU N N 162 122.300 125.623 -3.323 1 1 971 . 19 1 1 A 163 163 TYR H H 163 8.872 8.962 -0.090 1 1 972 . 19 1 1 A 163 163 TYR C C 163 173.425 175.459 -2.034 1 1 973 . 19 1 1 A 163 163 TYR CA C 163 56.192 56.506 -0.314 1 1 974 . 19 1 1 A 163 163 TYR CB C 163 40.870 41.955 -1.085 1 1 975 . 19 1 1 A 163 163 TYR N N 163 124.618 123.444 1.174 1 1 976 . 19 1 1 A 171 171 ASP C C 171 175.753 174.651 1.102 1 1 977 . 19 1 1 A 171 171 ASP CA C 171 53.517 52.569 0.948 1 1 978 . 19 1 1 A 171 171 ASP CB C 171 41.353 43.478 -2.125 1 1 979 . 19 1 1 A 172 172 ALA H H 172 8.336 8.464 -0.128 1 1 983 . 19 1 1 A 172 172 ALA C C 172 178.110 176.826 1.284 1 1 984 . 19 1 1 A 172 172 ALA CA C 172 52.190 50.765 1.425 1 1 985 . 19 1 1 A 172 172 ALA CB C 172 18.305 22.441 -4.136 1 1 986 . 19 1 1 A 172 172 ALA N N 172 125.294 123.025 2.269 1 1 987 . 19 1 1 A 173 173 GLY H H 173 8.300 8.296 0.004 1 1 988 . 19 1 1 A 173 173 GLY C C 173 174.437 172.168 2.269 1 1 989 . 19 1 1 A 173 173 GLY CA C 173 45.083 46.234 -1.151 1 1 990 . 19 1 1 A 173 173 GLY N N 173 107.268 106.239 1.029 1 1 991 . 19 1 1 A 174 174 THR H H 174 7.754 8.364 -0.610 1 1 992 . 19 1 1 A 174 174 THR C C 174 174.738 173.640 1.098 1 1 993 . 19 1 1 A 174 174 THR CA C 174 61.310 60.973 0.337 1 1 994 . 19 1 1 A 174 174 THR CB C 174 69.310 70.584 -1.274 1 1 996 . 19 1 1 A 174 174 THR N N 174 113.472 116.621 -3.149 1 1 997 . 19 1 1 A 175 175 VAL H H 175 7.993 8.770 -0.777 1 1 1004 . 19 1 1 A 175 175 VAL C C 175 176.535 175.549 0.986 1 1 1005 . 19 1 1 A 175 175 VAL CA C 175 62.126 60.730 1.396 1 1 1006 . 19 1 1 A 175 175 VAL CB C 175 31.282 34.609 -3.327 1 1 1009 . 19 1 1 A 175 175 VAL N N 175 121.643 127.756 -6.113 1 1 1010 . 19 1 1 A 176 176 GLY H H 176 8.056 8.557 -0.501 1 1 1011 . 19 1 1 A 176 176 GLY C C 176 173.930 173.788 0.142 1 1 1012 . 19 1 1 A 176 176 GLY CA C 176 44.983 46.008 -1.025 1 1 1013 . 19 1 1 A 176 176 GLY N N 176 110.460 113.941 -3.481 1 1 1014 . 19 1 1 A 177 177 THR H H 177 7.520 7.793 -0.273 1 1 1015 . 19 1 1 A 177 177 THR C C 177 173.574 174.701 -1.127 1 1 1016 . 19 1 1 A 177 177 THR CA C 177 60.609 60.683 -0.074 1 1 1017 . 19 1 1 A 177 177 THR CB C 177 69.506 69.285 0.221 1 1 1019 . 19 1 1 A 177 177 THR N N 177 113.390 113.409 -0.019 1 1 1020 . 19 1 1 A 178 178 ARG H H 178 8.261 8.799 -0.538 1 1 1021 . 19 1 1 A 178 178 ARG C C 178 173.932 177.295 -3.363 1 1 1022 . 19 1 1 A 178 178 ARG CA C 178 53.683 60.989 -7.306 1 1 1023 . 19 1 1 A 178 178 ARG CB C 178 29.224 29.622 -0.398 1 1 1026 . 19 1 1 A 178 178 ARG N N 178 123.906 126.201 -2.295 1 1 1027 . 19 1 1 A 183 183 MET C C 183 174.053 175.401 -1.348 1 1 1028 . 19 1 1 A 183 183 MET CA C 183 53.700 53.368 0.332 1 1 1029 . 19 1 1 A 183 183 MET CB C 183 35.908 34.638 1.270 1 1 1032 . 19 1 1 A 184 184 LEU H H 184 8.319 8.899 -0.580 1 1 1033 . 19 1 1 A 184 184 LEU C C 184 175.235 175.418 -0.183 1 1 1034 . 19 1 1 A 184 184 LEU CA C 184 53.120 53.401 -0.281 1 1 1035 . 19 1 1 A 184 184 LEU CB C 184 42.857 44.271 -1.414 1 1 1038 . 19 1 1 A 184 184 LEU N N 184 131.293 125.427 5.866 1 1 1039 . 19 1 1 A 185 185 SER H H 185 9.603 9.035 0.568 1 1 1040 . 19 1 1 A 185 185 SER C C 185 171.293 173.570 -2.277 1 1 1041 . 19 1 1 A 185 185 SER CA C 185 56.504 55.717 0.787 1 1 1042 . 19 1 1 A 185 185 SER CB C 185 66.585 65.978 0.607 1 1 1043 . 19 1 1 A 185 185 SER N N 185 119.338 118.107 1.231 1 1 1044 . 19 1 1 A 186 186 LEU H H 186 8.583 8.608 -0.025 1 1 1051 . 19 1 1 A 186 186 LEU C C 186 175.328 176.541 -1.213 1 1 1052 . 19 1 1 A 186 186 LEU CA C 186 52.729 53.184 -0.455 1 1 1053 . 19 1 1 A 186 186 LEU CB C 186 44.996 45.547 -0.551 1 1 1056 . 19 1 1 A 186 186 LEU N N 186 122.719 124.395 -1.676 1 1 1057 . 19 1 1 A 187 187 GLY H H 187 9.287 8.249 1.038 1 1 1058 . 19 1 1 A 187 187 GLY C C 187 172.315 172.868 -0.553 1 1 1059 . 19 1 1 A 187 187 GLY CA C 187 43.502 45.650 -2.148 1 1 1060 . 19 1 1 A 187 187 GLY N N 187 110.265 111.058 -0.793 1 1 1061 . 19 1 1 A 188 188 VAL H H 188 8.825 8.609 0.216 1 1 1068 . 19 1 1 A 188 188 VAL C C 188 173.125 174.896 -1.771 1 1 1069 . 19 1 1 A 188 188 VAL CA C 188 59.739 59.366 0.373 1 1 1070 . 19 1 1 A 188 188 VAL CB C 188 34.532 35.139 -0.607 1 1 1073 . 19 1 1 A 188 188 VAL N N 188 119.161 116.377 2.784 1 1 1074 . 19 1 1 A 189 189 SER H H 189 9.051 9.234 -0.183 1 1 1075 . 19 1 1 A 189 189 SER C C 189 171.698 173.139 -1.441 1 1 1076 . 19 1 1 A 189 189 SER CA C 189 55.997 57.039 -1.042 1 1 1077 . 19 1 1 A 189 189 SER CB C 189 66.094 67.283 -1.189 1 1 1078 . 19 1 1 A 189 189 SER N N 189 117.810 118.506 -0.696 1 1 1079 . 19 1 1 A 190 190 TYR H H 190 9.145 9.113 0.032 1 1 1080 . 19 1 1 A 190 190 TYR C C 190 174.063 172.898 1.165 1 1 1081 . 19 1 1 A 190 190 TYR CA C 190 55.375 55.629 -0.254 1 1 1082 . 19 1 1 A 190 190 TYR CB C 190 41.183 42.243 -1.060 1 1 1083 . 19 1 1 A 190 190 TYR N N 190 123.690 117.362 6.328 1 1 1084 . 19 1 1 A 191 191 ARG H H 191 8.211 8.840 -0.629 1 1 1085 . 19 1 1 A 191 191 ARG C C 191 174.826 174.599 0.227 1 1 1086 . 19 1 1 A 191 191 ARG CA C 191 54.464 53.948 0.516 1 1 1087 . 19 1 1 A 191 191 ARG CB C 191 30.507 33.575 -3.068 1 1 1090 . 19 1 1 A 191 191 ARG N N 191 125.366 119.802 5.564 1 1 1091 . 19 1 1 A 192 192 PHE H H 192 8.496 8.533 -0.037 1 1 1092 . 19 1 1 A 192 192 PHE C C 192 176.384 175.472 0.912 1 1 1093 . 19 1 1 A 192 192 PHE CA C 192 57.179 57.498 -0.319 1 1 1094 . 19 1 1 A 192 192 PHE CB C 192 39.430 38.513 0.917 1 1 1095 . 19 1 1 A 192 192 PHE N N 192 121.586 122.050 -0.464 1 1 1096 . 19 1 1 A 193 193 GLY H H 193 8.643 8.312 0.331 1 1 1097 . 19 1 1 A 193 193 GLY C C 193 174.466 173.194 1.272 1 1 1098 . 19 1 1 A 193 193 GLY CA C 193 45.126 44.891 0.235 1 1 1099 . 19 1 1 A 193 193 GLY N N 193 109.499 112.382 -2.883 1 1 1100 . 19 1 1 A 194 194 GLN H H 194 8.512 8.604 -0.092 1 1 1101 . 19 1 1 A 194 194 GLN C C 194 176.201 175.588 0.613 1 1 1102 . 19 1 1 A 194 194 GLN CA C 194 55.433 54.233 1.200 1 1 1103 . 19 1 1 A 194 194 GLN CB C 194 28.729 32.471 -3.742 1 1 1105 . 19 1 1 A 194 194 GLN N N 194 119.448 120.358 -0.910 1 1 1106 . 19 1 1 A 195 195 GLU H H 195 8.530 8.706 -0.176 1 1 1107 . 19 1 1 A 195 195 GLU C C 195 176.151 176.421 -0.270 1 1 1108 . 19 1 1 A 195 195 GLU CA C 195 56.256 56.868 -0.612 1 1 1109 . 19 1 1 A 195 195 GLU CB C 195 29.486 29.962 -0.476 1 1 1111 . 19 1 1 A 195 195 GLU N N 195 121.959 122.692 -0.733 1 1 1112 . 19 1 1 A 196 196 ASP H H 196 8.253 9.127 -0.874 1 1 1113 . 19 1 1 A 196 196 ASP C C 196 175.667 176.396 -0.729 1 1 1114 . 19 1 1 A 196 196 ASP CA C 196 53.981 56.655 -2.674 1 1 1115 . 19 1 1 A 196 196 ASP CB C 196 40.700 41.083 -0.383 1 1 1116 . 19 1 1 A 196 196 ASP N N 196 121.819 126.924 -5.105 1 1 1117 . 19 1 1 A 197 197 ALA H H 197 7.999 7.659 0.340 1 1 1121 . 19 1 1 A 197 197 ALA C C 197 176.847 176.560 0.287 1 1 1122 . 19 1 1 A 197 197 ALA CA C 197 51.612 50.847 0.765 1 1 1123 . 19 1 1 A 197 197 ALA CB C 197 18.192 20.365 -2.173 1 1 1124 . 19 1 1 A 197 197 ALA N N 197 124.262 121.413 2.849 1 1 1125 . 19 1 1 A 198 198 ALA H H 198 8.042 8.681 -0.639 1 1 1126 . 19 1 1 A 198 198 ALA C C 198 176.865 175.082 1.783 1 1 1127 . 19 1 1 A 198 198 ALA CA C 198 49.999 49.694 0.305 1 1 1128 . 19 1 1 A 198 198 ALA CB C 198 17.327 19.419 -2.092 1 1 1129 . 19 1 1 A 198 198 ALA N N 198 124.724 126.592 -1.868 1 1 1130 . 19 1 1 A 199 199 PRO C C 199 176.727 176.102 0.625 1 1 1131 . 19 1 1 A 199 199 PRO CA C 199 62.399 62.742 -0.343 1 1 1132 . 19 1 1 A 199 199 PRO CB C 199 30.949 30.533 0.416 1 1 1135 . 19 1 1 A 200 200 VAL H H 200 8.026 8.107 -0.081 1 1 1142 . 19 1 1 A 200 200 VAL C C 200 176.034 174.360 1.674 1 1 1143 . 19 1 1 A 200 200 VAL CA C 200 61.944 59.503 2.441 1 1 1144 . 19 1 1 A 200 200 VAL CB C 200 31.734 36.670 -4.936 1 1 1147 . 19 1 1 A 200 200 VAL N N 200 120.635 117.377 3.258 1 1 1148 . 19 1 1 A 201 201 VAL H H 201 7.966 8.315 -0.349 1 1 1155 . 19 1 1 A 201 201 VAL C C 201 175.128 174.491 0.637 1 1 1156 . 19 1 1 A 201 201 VAL CA C 201 61.249 61.837 -0.588 1 1 1157 . 19 1 1 A 201 201 VAL CB C 201 31.917 33.467 -1.550 1 1 1160 . 19 1 1 A 201 201 VAL N N 201 124.053 120.787 3.266 1 1 1161 . 19 1 1 A 202 202 ALA H H 202 8.159 8.105 0.054 1 1 1162 . 19 1 1 A 202 202 ALA C C 202 175.153 176.618 -1.465 1 1 1163 . 19 1 1 A 202 202 ALA CA C 202 49.742 48.477 1.265 1 1 1164 . 19 1 1 A 202 202 ALA CB C 202 17.532 20.687 -3.155 1 1 1165 . 19 1 1 A 202 202 ALA N N 202 129.251 129.029 0.222 1 1 1166 . 19 1 1 A 203 203 PRO C C 203 176.273 176.655 -0.382 1 1 1167 . 19 1 1 A 203 203 PRO CA C 203 62.324 65.592 -3.268 1 1 1168 . 19 1 1 A 203 203 PRO CB C 203 31.042 31.622 -0.580 1 1 1170 . 19 1 1 A 204 204 ALA H H 204 8.137 7.668 0.469 1 1 1171 . 19 1 1 A 204 204 ALA C C 204 175.697 175.213 0.484 1 1 1172 . 19 1 1 A 204 204 ALA CA C 204 49.865 49.080 0.785 1 1 1173 . 19 1 1 A 204 204 ALA CB C 204 17.364 21.322 -3.958 1 1 1174 . 19 1 1 A 204 204 ALA N N 204 125.510 117.657 7.853 1 1 1175 . 19 1 1 A 205 205 PRO C C 205 175.430 176.254 -0.824 1 1 1176 . 19 1 1 A 205 205 PRO CA C 205 62.511 62.535 -0.024 1 1 1177 . 19 1 1 A 205 205 PRO CB C 205 31.056 32.429 -1.373 1 1 1179 . 19 1 1 A 206 206 ALA H H 206 7.847 8.381 -0.534 1 1 1180 . 19 1 1 A 206 206 ALA C C 206 175.565 176.592 -1.027 1 1 1181 . 19 1 1 A 206 206 ALA CA C 206 49.487 49.352 0.135 1 1 1182 . 19 1 1 A 206 206 ALA CB C 206 18.843 22.233 -3.390 1 1 1183 . 19 1 1 A 206 206 ALA N N 206 123.663 123.918 -0.255 1 1 1184 . 19 1 1 A 207 207 PRO C C 207 174.397 176.647 -2.250 1 1 1185 . 19 1 1 A 207 207 PRO CA C 207 61.454 64.737 -3.283 1 1 1186 . 19 1 1 A 207 207 PRO CB C 207 31.929 32.156 -0.227 1 1 1187 . 19 1 1 A 208 208 ALA H H 208 7.898 7.992 -0.094 1 1 1188 . 19 1 1 A 208 208 ALA C C 208 175.411 175.968 -0.557 1 1 1189 . 19 1 1 A 208 208 ALA CA C 208 49.472 49.084 0.388 1 1 1190 . 19 1 1 A 208 208 ALA CB C 208 19.082 19.763 -0.681 1 1 1191 . 19 1 1 A 208 208 ALA N N 208 127.450 120.275 7.175 1 1 1192 . 19 1 1 A 209 209 PRO C C 209 176.932 177.320 -0.388 1 1 1193 . 19 1 1 A 209 209 PRO CA C 209 62.736 65.034 -2.298 1 1 1194 . 19 1 1 A 209 209 PRO CB C 209 31.012 31.840 -0.828 1 1 1 . 20 1 1 A 2 2 ARG C C 2 175.857 175.024 0.833 1 1 2 . 20 1 1 A 2 2 ARG CA C 2 55.872 55.393 0.479 1 1 3 . 20 1 1 A 2 2 ARG CB C 2 29.983 28.718 1.265 1 1 5 . 20 1 1 A 3 3 ILE H H 3 8.238 8.076 0.162 1 1 9 . 20 1 1 A 3 3 ILE C C 3 175.763 174.238 1.525 1 1 10 . 20 1 1 A 3 3 ILE CA C 3 60.779 59.957 0.822 1 1 11 . 20 1 1 A 3 3 ILE CB C 3 37.664 41.549 -3.885 1 1 15 . 20 1 1 A 3 3 ILE N N 3 122.580 124.130 -1.550 1 1 16 . 20 1 1 A 4 4 MET H H 4 8.261 8.787 -0.526 1 1 17 . 20 1 1 A 4 4 MET C C 4 175.660 175.942 -0.282 1 1 18 . 20 1 1 A 4 4 MET CA C 4 54.893 56.413 -1.520 1 1 19 . 20 1 1 A 4 4 MET CB C 4 32.060 35.357 -3.297 1 1 22 . 20 1 1 A 4 4 MET N N 4 123.988 127.624 -3.636 1 1 23 . 20 1 1 A 5 5 LYS H H 5 8.041 7.892 0.149 1 1 24 . 20 1 1 A 5 5 LYS C C 5 175.850 177.397 -1.547 1 1 25 . 20 1 1 A 5 5 LYS CA C 5 56.081 55.492 0.589 1 1 26 . 20 1 1 A 5 5 LYS CB C 5 32.220 32.532 -0.312 1 1 29 . 20 1 1 A 5 5 LYS N N 5 122.015 118.932 3.083 1 1 30 . 20 1 1 A 6 6 ALA H H 6 8.042 7.923 0.119 1 1 34 . 20 1 1 A 6 6 ALA C C 6 177.160 177.749 -0.589 1 1 35 . 20 1 1 A 6 6 ALA CA C 6 52.109 55.160 -3.051 1 1 36 . 20 1 1 A 6 6 ALA CB C 6 18.637 19.238 -0.601 1 1 37 . 20 1 1 A 6 6 ALA N N 6 123.943 122.994 0.949 1 1 38 . 20 1 1 A 7 7 ILE H H 7 7.916 7.696 0.220 1 1 42 . 20 1 1 A 7 7 ILE C C 7 175.611 175.354 0.257 1 1 43 . 20 1 1 A 7 7 ILE CA C 7 61.181 61.160 0.021 1 1 44 . 20 1 1 A 7 7 ILE CB C 7 37.910 38.849 -0.939 1 1 48 . 20 1 1 A 7 7 ILE N N 7 118.380 115.298 3.082 1 1 49 . 20 1 1 A 8 8 PHE H H 8 8.167 8.987 -0.820 1 1 50 . 20 1 1 A 8 8 PHE C C 8 175.363 174.948 0.415 1 1 51 . 20 1 1 A 8 8 PHE CA C 8 57.286 59.211 -1.925 1 1 52 . 20 1 1 A 8 8 PHE CB C 8 39.008 41.732 -2.724 1 1 53 . 20 1 1 A 8 8 PHE N N 8 121.971 124.162 -2.191 1 1 54 . 20 1 1 A 9 9 VAL H H 9 7.872 7.856 0.016 1 1 61 . 20 1 1 A 9 9 VAL C C 9 175.405 176.057 -0.652 1 1 62 . 20 1 1 A 9 9 VAL CA C 9 61.662 61.733 -0.071 1 1 63 . 20 1 1 A 9 9 VAL CB C 9 32.026 33.161 -1.135 1 1 66 . 20 1 1 A 9 9 VAL N N 9 120.864 118.457 2.407 1 1 67 . 20 1 1 A 10 10 LEU H H 10 8.077 8.655 -0.578 1 1 74 . 20 1 1 A 10 10 LEU C C 10 176.652 176.409 0.243 1 1 75 . 20 1 1 A 10 10 LEU CA C 10 54.856 55.041 -0.185 1 1 76 . 20 1 1 A 10 10 LEU CB C 10 41.401 41.014 0.387 1 1 80 . 20 1 1 A 10 10 LEU N N 10 124.826 128.542 -3.716 1 1 81 . 20 1 1 A 11 11 ASN H H 11 8.177 8.872 -0.695 1 1 82 . 20 1 1 A 11 11 ASN C C 11 174.394 175.238 -0.844 1 1 83 . 20 1 1 A 11 11 ASN CA C 11 52.704 53.422 -0.718 1 1 84 . 20 1 1 A 11 11 ASN CB C 11 38.468 39.654 -1.186 1 1 85 . 20 1 1 A 11 11 ASN N N 11 119.029 123.695 -4.666 1 1 86 . 20 1 1 A 12 12 ALA H H 12 7.991 8.662 -0.671 1 1 90 . 20 1 1 A 12 12 ALA C C 12 176.649 177.638 -0.989 1 1 91 . 20 1 1 A 12 12 ALA CA C 12 51.950 51.234 0.716 1 1 92 . 20 1 1 A 12 12 ALA CB C 12 18.659 17.989 0.670 1 1 93 . 20 1 1 A 12 12 ALA N N 12 123.695 127.399 -3.704 1 1 94 . 20 1 1 A 13 13 ALA H H 13 8.083 8.169 -0.086 1 1 95 . 20 1 1 A 13 13 ALA C C 13 175.395 178.005 -2.610 1 1 96 . 20 1 1 A 13 13 ALA CA C 13 49.797 56.649 -6.852 1 1 97 . 20 1 1 A 13 13 ALA CB C 13 17.486 18.652 -1.166 1 1 98 . 20 1 1 A 13 13 ALA N N 13 124.281 125.770 -1.489 1 1 99 . 20 1 1 A 14 14 PRO C C 14 176.641 175.957 0.684 1 1 100 . 20 1 1 A 14 14 PRO CA C 14 62.675 62.576 0.099 1 1 101 . 20 1 1 A 14 14 PRO CB C 14 31.000 29.761 1.239 1 1 103 . 20 1 1 A 15 15 LYS H H 15 8.283 8.370 -0.087 1 1 104 . 20 1 1 A 15 15 LYS C C 15 175.683 174.872 0.811 1 1 105 . 20 1 1 A 15 15 LYS CA C 15 55.429 55.326 0.103 1 1 106 . 20 1 1 A 15 15 LYS CB C 15 32.246 34.463 -2.217 1 1 109 . 20 1 1 A 15 15 LYS N N 15 119.069 123.337 -4.268 1 1 110 . 20 1 1 A 16 16 ASP H H 16 7.880 8.963 -1.083 1 1 111 . 20 1 1 A 16 16 ASP C C 16 175.419 175.358 0.061 1 1 112 . 20 1 1 A 16 16 ASP CA C 16 54.413 54.649 -0.236 1 1 113 . 20 1 1 A 16 16 ASP CB C 16 40.224 40.818 -0.594 1 1 114 . 20 1 1 A 16 16 ASP N N 16 119.625 128.234 -8.609 1 1 115 . 20 1 1 A 17 17 ASN H H 17 7.973 9.067 -1.094 1 1 116 . 20 1 1 A 17 17 ASN C C 17 174.231 174.618 -0.387 1 1 117 . 20 1 1 A 17 17 ASN CA C 17 53.948 52.266 1.682 1 1 118 . 20 1 1 A 17 17 ASN CB C 17 37.009 40.008 -2.999 1 1 119 . 20 1 1 A 17 17 ASN N N 17 118.063 124.381 -6.318 1 1 120 . 20 1 1 A 18 18 THR H H 18 7.318 8.464 -1.146 1 1 121 . 20 1 1 A 18 18 THR C C 18 172.323 172.497 -0.174 1 1 122 . 20 1 1 A 18 18 THR CA C 18 60.153 59.951 0.202 1 1 123 . 20 1 1 A 18 18 THR CB C 18 71.534 72.046 -0.512 1 1 125 . 20 1 1 A 18 18 THR N N 18 109.092 116.526 -7.434 1 1 126 . 20 1 1 A 19 19 TRP H H 19 8.541 8.944 -0.403 1 1 127 . 20 1 1 A 19 19 TRP C C 19 175.969 173.991 1.978 1 1 128 . 20 1 1 A 19 19 TRP CA C 19 55.700 56.946 -1.246 1 1 129 . 20 1 1 A 19 19 TRP CB C 19 31.471 33.255 -1.784 1 1 130 . 20 1 1 A 19 19 TRP N N 19 121.992 128.440 -6.448 1 1 131 . 20 1 1 A 20 20 TYR H H 20 8.691 8.562 0.129 1 1 132 . 20 1 1 A 20 20 TYR C C 20 173.684 173.265 0.419 1 1 133 . 20 1 1 A 20 20 TYR CA C 20 55.805 55.940 -0.135 1 1 134 . 20 1 1 A 20 20 TYR CB C 20 40.513 42.450 -1.937 1 1 135 . 20 1 1 A 20 20 TYR N N 20 116.519 122.644 -6.125 1 1 136 . 20 1 1 A 21 21 ALA H H 21 8.876 8.994 -0.118 1 1 137 . 20 1 1 A 21 21 ALA C C 21 175.395 176.680 -1.285 1 1 138 . 20 1 1 A 21 21 ALA CA C 21 50.970 51.421 -0.451 1 1 139 . 20 1 1 A 21 21 ALA CB C 21 22.142 23.733 -1.591 1 1 140 . 20 1 1 A 21 21 ALA N N 21 119.359 122.644 -3.285 1 1 141 . 20 1 1 A 22 22 GLY H H 22 8.613 8.713 -0.100 1 1 142 . 20 1 1 A 22 22 GLY C C 22 171.458 172.542 -1.084 1 1 143 . 20 1 1 A 22 22 GLY CA C 22 45.608 46.214 -0.606 1 1 144 . 20 1 1 A 22 22 GLY N N 22 106.678 106.514 0.164 1 1 145 . 20 1 1 A 23 23 GLY H H 23 7.911 8.492 -0.581 1 1 146 . 20 1 1 A 23 23 GLY C C 23 170.563 171.686 -1.123 1 1 147 . 20 1 1 A 23 23 GLY CA C 23 44.026 44.850 -0.824 1 1 148 . 20 1 1 A 23 23 GLY N N 23 103.399 109.275 -5.876 1 1 149 . 20 1 1 A 24 24 LYS H H 24 9.001 9.355 -0.354 1 1 150 . 20 1 1 A 24 24 LYS C C 24 172.965 174.483 -1.518 1 1 151 . 20 1 1 A 24 24 LYS CA C 24 54.062 54.724 -0.662 1 1 152 . 20 1 1 A 24 24 LYS CB C 24 36.774 35.969 0.805 1 1 156 . 20 1 1 A 24 24 LYS N N 24 116.402 122.448 -6.046 1 1 157 . 20 1 1 A 25 25 LEU H H 25 8.587 8.949 -0.362 1 1 164 . 20 1 1 A 25 25 LEU C C 25 175.205 174.704 0.501 1 1 165 . 20 1 1 A 25 25 LEU CA C 25 53.446 53.792 -0.346 1 1 166 . 20 1 1 A 25 25 LEU CB C 25 46.287 46.364 -0.077 1 1 170 . 20 1 1 A 25 25 LEU N N 25 119.932 124.183 -4.251 1 1 171 . 20 1 1 A 26 26 GLY H H 26 8.637 9.130 -0.493 1 1 172 . 20 1 1 A 26 26 GLY C C 26 170.804 172.016 -1.212 1 1 173 . 20 1 1 A 26 26 GLY CA C 26 45.669 44.129 1.540 1 1 174 . 20 1 1 A 26 26 GLY N N 26 108.136 111.830 -3.694 1 1 175 . 20 1 1 A 27 27 TRP H H 27 8.642 8.702 -0.060 1 1 177 . 20 1 1 A 27 27 TRP C C 27 174.820 174.658 0.162 1 1 178 . 20 1 1 A 27 27 TRP CB C 27 30.883 31.699 -0.816 1 1 179 . 20 1 1 A 27 27 TRP N N 27 120.887 124.644 -3.757 1 1 181 . 20 1 1 A 32 32 ASP C C 32 176.315 175.350 0.965 1 1 182 . 20 1 1 A 32 32 ASP CA C 32 53.737 54.620 -0.883 1 1 183 . 20 1 1 A 32 32 ASP CB C 32 41.230 41.467 -0.237 1 1 184 . 20 1 1 A 33 33 THR H H 33 8.190 8.689 -0.499 1 1 188 . 20 1 1 A 33 33 THR C C 33 175.291 175.264 0.027 1 1 189 . 20 1 1 A 33 33 THR CA C 33 61.909 61.633 0.276 1 1 190 . 20 1 1 A 33 33 THR CB C 33 68.961 70.623 -1.662 1 1 192 . 20 1 1 A 33 33 THR N N 33 114.235 119.043 -4.808 1 1 193 . 20 1 1 A 34 34 GLY H H 34 8.341 8.925 -0.584 1 1 194 . 20 1 1 A 34 34 GLY C C 34 173.766 174.421 -0.655 1 1 195 . 20 1 1 A 34 34 GLY CA C 34 44.941 46.711 -1.770 1 1 196 . 20 1 1 A 34 34 GLY N N 34 110.678 113.052 -2.374 1 1 197 . 20 1 1 A 35 35 PHE H H 35 7.945 8.018 -0.073 1 1 198 . 20 1 1 A 35 35 PHE C C 35 175.411 174.603 0.808 1 1 199 . 20 1 1 A 35 35 PHE CA C 35 57.921 56.533 1.388 1 1 200 . 20 1 1 A 35 35 PHE CB C 35 38.806 40.100 -1.294 1 1 201 . 20 1 1 A 35 35 PHE N N 35 120.533 119.960 0.573 1 1 202 . 20 1 1 A 36 36 TYR H H 36 7.967 7.910 0.057 1 1 203 . 20 1 1 A 36 36 TYR C C 36 176.104 175.524 0.580 1 1 204 . 20 1 1 A 36 36 TYR CA C 36 57.568 57.227 0.341 1 1 205 . 20 1 1 A 36 36 TYR CB C 36 37.727 40.551 -2.824 1 1 206 . 20 1 1 A 36 36 TYR N N 36 120.254 123.073 -2.819 1 1 207 . 20 1 1 A 37 37 GLY H H 37 7.666 6.933 0.733 1 1 208 . 20 1 1 A 37 37 GLY C C 37 173.794 172.168 1.626 1 1 209 . 20 1 1 A 37 37 GLY CA C 37 45.007 45.678 -0.671 1 1 210 . 20 1 1 A 37 37 GLY N N 37 108.995 107.695 1.300 1 1 211 . 20 1 1 A 38 38 ASN H H 38 8.109 8.515 -0.406 1 1 212 . 20 1 1 A 38 38 ASN C C 38 175.612 175.720 -0.108 1 1 213 . 20 1 1 A 38 38 ASN CA C 38 52.954 52.237 0.717 1 1 214 . 20 1 1 A 38 38 ASN CB C 38 38.425 39.598 -1.173 1 1 215 . 20 1 1 A 38 38 ASN N N 38 118.603 119.264 -0.661 1 1 216 . 20 1 1 A 39 39 GLY H H 39 8.202 8.443 -0.241 1 1 217 . 20 1 1 A 39 39 GLY C C 39 173.958 173.339 0.619 1 1 218 . 20 1 1 A 39 39 GLY CA C 39 45.012 44.107 0.905 1 1 219 . 20 1 1 A 39 39 GLY N N 39 108.897 107.768 1.129 1 1 220 . 20 1 1 A 40 40 PHE H H 40 7.960 8.643 -0.683 1 1 221 . 20 1 1 A 40 40 PHE C C 40 175.653 175.002 0.651 1 1 222 . 20 1 1 A 40 40 PHE CA C 40 57.556 58.667 -1.111 1 1 223 . 20 1 1 A 40 40 PHE CB C 40 38.513 39.805 -1.292 1 1 224 . 20 1 1 A 40 40 PHE N N 40 119.829 120.472 -0.643 1 1 225 . 20 1 1 A 41 41 GLN H H 41 8.173 8.831 -0.658 1 1 226 . 20 1 1 A 41 41 GLN C C 41 175.234 175.504 -0.270 1 1 227 . 20 1 1 A 41 41 GLN CA C 41 55.488 55.265 0.223 1 1 228 . 20 1 1 A 41 41 GLN CB C 41 28.523 29.134 -0.611 1 1 230 . 20 1 1 A 41 41 GLN N N 41 120.810 124.376 -3.566 1 1 231 . 20 1 1 A 42 42 ASN H H 42 8.193 8.905 -0.712 1 1 232 . 20 1 1 A 42 42 ASN C C 42 174.618 176.595 -1.977 1 1 233 . 20 1 1 A 42 42 ASN CA C 42 52.924 55.074 -2.150 1 1 234 . 20 1 1 A 42 42 ASN CB C 42 38.333 39.697 -1.364 1 1 235 . 20 1 1 A 42 42 ASN N N 42 119.679 124.374 -4.695 1 1 236 . 20 1 1 A 43 43 ASN H H 43 8.255 8.198 0.057 1 1 237 . 20 1 1 A 43 43 ASN C C 43 173.873 175.129 -1.256 1 1 238 . 20 1 1 A 43 43 ASN CA C 43 52.919 54.550 -1.631 1 1 239 . 20 1 1 A 43 43 ASN CB C 43 38.580 41.060 -2.480 1 1 240 . 20 1 1 A 43 43 ASN N N 43 119.773 116.348 3.425 1 1 241 . 20 1 1 A 44 44 ASN H H 44 7.865 8.047 -0.182 1 1 242 . 20 1 1 A 44 44 ASN C C 44 175.518 174.584 0.934 1 1 243 . 20 1 1 A 44 44 ASN CA C 44 54.528 52.619 1.909 1 1 244 . 20 1 1 A 44 44 ASN CB C 44 40.170 37.918 2.252 1 1 246 . 20 1 1 A 44 44 ASN N N 44 124.152 118.133 6.019 1 1 247 . 20 1 1 A 46 46 PRO C C 46 177.228 176.850 0.378 1 1 248 . 20 1 1 A 46 46 PRO CA C 46 62.794 62.931 -0.137 1 1 249 . 20 1 1 A 46 46 PRO CB C 46 31.283 33.311 -2.028 1 1 251 . 20 1 1 A 47 47 THR H H 47 8.165 8.582 -0.417 1 1 255 . 20 1 1 A 47 47 THR C C 47 174.573 174.941 -0.368 1 1 256 . 20 1 1 A 47 47 THR CA C 47 61.346 61.243 0.103 1 1 257 . 20 1 1 A 47 47 THR CB C 47 69.573 68.346 1.227 1 1 259 . 20 1 1 A 47 47 THR N N 47 114.265 116.039 -1.774 1 1 260 . 20 1 1 A 48 48 ARG H H 48 8.237 7.862 0.375 1 1 261 . 20 1 1 A 48 48 ARG C C 48 175.898 176.745 -0.847 1 1 262 . 20 1 1 A 48 48 ARG CA C 48 55.717 58.872 -3.155 1 1 263 . 20 1 1 A 48 48 ARG CB C 48 30.151 30.236 -0.085 1 1 266 . 20 1 1 A 48 48 ARG N N 48 122.795 122.362 0.433 1 1 267 . 20 1 1 A 49 49 ASN H H 49 8.369 7.752 0.617 1 1 268 . 20 1 1 A 49 49 ASN C C 49 174.560 175.077 -0.517 1 1 269 . 20 1 1 A 49 49 ASN CA C 49 53.005 52.938 0.067 1 1 270 . 20 1 1 A 49 49 ASN CB C 49 38.761 39.480 -0.719 1 1 271 . 20 1 1 A 49 49 ASN N N 49 119.837 118.624 1.213 1 1 272 . 20 1 1 A 50 50 ASP H H 50 8.192 8.717 -0.525 1 1 273 . 20 1 1 A 50 50 ASP C C 50 175.699 175.560 0.139 1 1 274 . 20 1 1 A 50 50 ASP CA C 50 54.289 54.007 0.282 1 1 275 . 20 1 1 A 50 50 ASP CB C 50 41.264 42.166 -0.902 1 1 276 . 20 1 1 A 50 50 ASP N N 50 120.403 122.971 -2.568 1 1 277 . 20 1 1 A 51 51 GLN H H 51 8.428 8.288 0.140 1 1 278 . 20 1 1 A 51 51 GLN C C 51 175.186 174.274 0.912 1 1 279 . 20 1 1 A 51 51 GLN CA C 51 54.512 54.380 0.132 1 1 280 . 20 1 1 A 51 51 GLN CB C 51 30.424 32.688 -2.264 1 1 282 . 20 1 1 A 51 51 GLN N N 51 118.959 121.004 -2.045 1 1 289 . 20 1 1 A 52 52 LEU C C 52 176.018 175.810 0.208 1 1 290 . 20 1 1 A 52 52 LEU CA C 52 54.332 52.696 1.636 1 1 291 . 20 1 1 A 52 52 LEU CB C 52 43.022 44.246 -1.224 1 1 294 . 20 1 1 A 53 53 GLY H H 53 8.639 8.835 -0.196 1 1 295 . 20 1 1 A 53 53 GLY C C 53 171.931 172.583 -0.652 1 1 296 . 20 1 1 A 53 53 GLY CA C 53 43.501 44.333 -0.832 1 1 297 . 20 1 1 A 53 53 GLY N N 53 109.964 107.152 2.812 1 1 298 . 20 1 1 A 54 54 ALA H H 54 8.881 9.007 -0.126 1 1 299 . 20 1 1 A 54 54 ALA C C 54 175.543 176.449 -0.906 1 1 300 . 20 1 1 A 54 54 ALA CA C 54 50.710 51.253 -0.543 1 1 301 . 20 1 1 A 54 54 ALA CB C 54 22.914 24.042 -1.128 1 1 302 . 20 1 1 A 54 54 ALA N N 54 120.413 123.496 -3.083 1 1 303 . 20 1 1 A 55 55 GLY H H 55 8.346 8.687 -0.341 1 1 304 . 20 1 1 A 55 55 GLY C C 55 170.960 171.821 -0.861 1 1 305 . 20 1 1 A 55 55 GLY CA C 55 46.704 45.914 0.790 1 1 306 . 20 1 1 A 55 55 GLY N N 55 104.688 106.107 -1.419 1 1 307 . 20 1 1 A 56 56 ALA H H 56 9.116 8.476 0.640 1 1 308 . 20 1 1 A 56 56 ALA C C 56 176.472 176.230 0.242 1 1 309 . 20 1 1 A 56 56 ALA CA C 56 49.638 50.954 -1.316 1 1 310 . 20 1 1 A 56 56 ALA CB C 56 22.275 20.712 1.563 1 1 311 . 20 1 1 A 56 56 ALA N N 56 120.608 122.416 -1.808 1 1 312 . 20 1 1 A 57 57 PHE H H 57 8.688 9.454 -0.766 1 1 313 . 20 1 1 A 57 57 PHE C C 57 172.816 175.203 -2.387 1 1 314 . 20 1 1 A 57 57 PHE CA C 57 56.066 56.137 -0.071 1 1 315 . 20 1 1 A 57 57 PHE CB C 57 41.770 41.358 0.412 1 1 316 . 20 1 1 A 57 57 PHE N N 57 120.027 121.660 -1.633 1 1 317 . 20 1 1 A 58 58 GLY H H 58 9.034 9.019 0.015 1 1 318 . 20 1 1 A 58 58 GLY C C 58 170.860 172.563 -1.703 1 1 319 . 20 1 1 A 58 58 GLY CA C 58 44.954 44.713 0.241 1 1 320 . 20 1 1 A 58 58 GLY N N 58 105.817 111.240 -5.423 1 1 321 . 20 1 1 A 59 59 GLY H H 59 8.382 8.550 -0.168 1 1 322 . 20 1 1 A 59 59 GLY C C 59 169.284 171.668 -2.384 1 1 323 . 20 1 1 A 59 59 GLY CA C 59 45.840 44.410 1.430 1 1 324 . 20 1 1 A 59 59 GLY N N 59 109.059 110.278 -1.219 1 1 325 . 20 1 1 A 60 60 TYR H H 60 8.430 8.462 -0.032 1 1 326 . 20 1 1 A 60 60 TYR C C 60 173.453 172.314 1.139 1 1 327 . 20 1 1 A 60 60 TYR CA C 60 55.282 55.911 -0.629 1 1 328 . 20 1 1 A 60 60 TYR CB C 60 41.712 41.078 0.634 1 1 329 . 20 1 1 A 60 60 TYR N N 60 118.352 115.129 3.223 1 1 330 . 20 1 1 A 61 61 GLN H H 61 8.833 8.891 -0.058 1 1 331 . 20 1 1 A 61 61 GLN C C 61 174.365 175.041 -0.676 1 1 332 . 20 1 1 A 61 61 GLN CA C 61 54.125 54.703 -0.578 1 1 333 . 20 1 1 A 61 61 GLN CB C 61 28.033 30.864 -2.831 1 1 335 . 20 1 1 A 61 61 GLN N N 61 129.628 121.048 8.580 1 1 336 . 20 1 1 A 62 62 VAL H H 62 8.714 9.062 -0.348 1 1 343 . 20 1 1 A 62 62 VAL C C 62 175.758 175.968 -0.210 1 1 344 . 20 1 1 A 62 62 VAL CA C 62 64.649 63.299 1.350 1 1 345 . 20 1 1 A 62 62 VAL CB C 62 31.900 33.490 -1.590 1 1 348 . 20 1 1 A 62 62 VAL N N 62 127.666 124.175 3.491 1 1 349 . 20 1 1 A 63 63 ASN H H 63 8.062 8.051 0.011 1 1 350 . 20 1 1 A 63 63 ASN C C 63 172.827 172.811 0.016 1 1 351 . 20 1 1 A 63 63 ASN CA C 63 51.575 50.084 1.491 1 1 352 . 20 1 1 A 63 63 ASN CB C 63 37.194 41.922 -4.728 1 1 353 . 20 1 1 A 63 63 ASN N N 63 116.310 117.220 -0.910 1 1 354 . 20 1 1 A 64 64 PRO C C 64 175.071 175.148 -0.077 1 1 355 . 20 1 1 A 64 64 PRO CA C 64 65.296 62.345 2.951 1 1 356 . 20 1 1 A 64 64 PRO CB C 64 30.428 29.191 1.237 1 1 357 . 20 1 1 A 65 65 TYR H H 65 7.873 8.724 -0.851 1 1 358 . 20 1 1 A 65 65 TYR C C 65 175.145 175.623 -0.478 1 1 359 . 20 1 1 A 65 65 TYR CA C 65 56.125 59.153 -3.028 1 1 360 . 20 1 1 A 65 65 TYR CB C 65 39.189 40.980 -1.791 1 1 361 . 20 1 1 A 65 65 TYR N N 65 112.894 122.525 -9.631 1 1 362 . 20 1 1 A 66 66 LEU H H 66 7.308 7.454 -0.146 1 1 369 . 20 1 1 A 66 66 LEU C C 66 173.866 174.381 -0.515 1 1 370 . 20 1 1 A 66 66 LEU CA C 66 53.431 54.122 -0.691 1 1 371 . 20 1 1 A 66 66 LEU CB C 66 44.958 44.240 0.718 1 1 375 . 20 1 1 A 66 66 LEU N N 66 120.270 115.728 4.542 1 1 376 . 20 1 1 A 67 67 GLY H H 67 8.855 9.036 -0.181 1 1 377 . 20 1 1 A 67 67 GLY C C 67 170.698 172.213 -1.515 1 1 378 . 20 1 1 A 67 67 GLY CA C 67 44.008 43.987 0.021 1 1 379 . 20 1 1 A 67 67 GLY N N 67 114.388 106.992 7.396 1 1 380 . 20 1 1 A 68 68 PHE H H 68 8.770 8.395 0.375 1 1 381 . 20 1 1 A 68 68 PHE C C 68 173.386 174.741 -1.355 1 1 382 . 20 1 1 A 68 68 PHE CA C 68 56.507 57.673 -1.166 1 1 383 . 20 1 1 A 68 68 PHE CB C 68 42.428 39.641 2.787 1 1 384 . 20 1 1 A 68 68 PHE N N 68 117.510 118.883 -1.373 1 1 385 . 20 1 1 A 69 69 GLU H H 69 9.079 9.355 -0.276 1 1 386 . 20 1 1 A 69 69 GLU C C 69 174.556 174.949 -0.393 1 1 387 . 20 1 1 A 69 69 GLU CA C 69 54.939 54.923 0.016 1 1 388 . 20 1 1 A 69 69 GLU CB C 69 33.963 32.189 1.774 1 1 390 . 20 1 1 A 69 69 GLU N N 69 120.562 123.524 -2.962 1 1 391 . 20 1 1 A 70 70 MET H H 70 9.481 9.658 -0.177 1 1 392 . 20 1 1 A 70 70 MET C C 70 174.595 175.948 -1.353 1 1 393 . 20 1 1 A 70 70 MET CA C 70 53.091 54.058 -0.967 1 1 394 . 20 1 1 A 70 70 MET CB C 70 36.159 33.795 2.364 1 1 397 . 20 1 1 A 70 70 MET N N 70 124.928 126.270 -1.342 1 1 398 . 20 1 1 A 71 71 GLY H H 71 8.845 8.996 -0.151 1 1 399 . 20 1 1 A 71 71 GLY C C 71 170.811 171.478 -0.667 1 1 400 . 20 1 1 A 71 71 GLY CA C 71 44.624 43.787 0.837 1 1 401 . 20 1 1 A 71 71 GLY N N 71 108.896 112.917 -4.021 1 1 402 . 20 1 1 A 72 72 TYR H H 72 8.925 8.840 0.085 1 1 403 . 20 1 1 A 72 72 TYR C C 72 173.278 174.443 -1.165 1 1 404 . 20 1 1 A 72 72 TYR CA C 72 55.912 56.578 -0.666 1 1 405 . 20 1 1 A 72 72 TYR CB C 72 41.611 40.697 0.914 1 1 406 . 20 1 1 A 72 72 TYR N N 72 123.253 121.677 1.576 1 1 407 . 20 1 1 A 73 73 ASP H H 73 8.665 9.096 -0.431 1 1 408 . 20 1 1 A 73 73 ASP C C 73 173.598 175.412 -1.814 1 1 409 . 20 1 1 A 73 73 ASP CA C 73 52.857 54.096 -1.239 1 1 410 . 20 1 1 A 73 73 ASP CB C 73 42.774 41.719 1.055 1 1 411 . 20 1 1 A 73 73 ASP N N 73 126.178 124.842 1.336 1 1 412 . 20 1 1 A 74 74 TRP H H 74 9.080 9.091 -0.011 1 1 413 . 20 1 1 A 74 74 TRP C C 74 174.868 174.291 0.577 1 1 414 . 20 1 1 A 74 74 TRP CB C 74 30.083 32.388 -2.305 1 1 415 . 20 1 1 A 74 74 TRP N N 74 121.824 126.870 -5.046 1 1 416 . 20 1 1 A 78 78 MET C C 78 174.548 175.834 -1.286 1 1 417 . 20 1 1 A 78 78 MET CA C 78 54.388 54.193 0.195 1 1 418 . 20 1 1 A 78 78 MET CB C 78 32.542 32.498 0.044 1 1 419 . 20 1 1 A 79 79 ALA H H 79 8.105 8.564 -0.459 1 1 420 . 20 1 1 A 79 79 ALA C C 79 176.629 175.345 1.284 1 1 421 . 20 1 1 A 79 79 ALA CA C 79 51.210 51.997 -0.787 1 1 422 . 20 1 1 A 79 79 ALA CB C 79 19.106 20.948 -1.842 1 1 423 . 20 1 1 A 79 79 ALA N N 79 125.778 126.513 -0.735 1 1 424 . 20 1 1 A 80 80 TYR H H 80 8.035 8.761 -0.726 1 1 425 . 20 1 1 A 80 80 TYR C C 80 175.604 172.723 2.881 1 1 426 . 20 1 1 A 80 80 TYR CA C 80 57.021 56.609 0.412 1 1 427 . 20 1 1 A 80 80 TYR CB C 80 38.416 40.257 -1.841 1 1 428 . 20 1 1 A 80 80 TYR N N 80 120.045 118.140 1.905 1 1 429 . 20 1 1 A 81 81 LYS H H 81 8.295 8.512 -0.217 1 1 430 . 20 1 1 A 81 81 LYS C C 81 176.647 177.146 -0.499 1 1 431 . 20 1 1 A 81 81 LYS CA C 81 56.285 54.565 1.720 1 1 432 . 20 1 1 A 81 81 LYS CB C 81 31.571 35.557 -3.986 1 1 434 . 20 1 1 A 81 81 LYS N N 81 123.191 119.961 3.230 1 1 435 . 20 1 1 A 82 82 GLY H H 82 8.117 8.675 -0.558 1 1 436 . 20 1 1 A 82 82 GLY C C 82 174.010 174.832 -0.822 1 1 437 . 20 1 1 A 82 82 GLY CA C 82 44.982 47.205 -2.223 1 1 438 . 20 1 1 A 82 82 GLY N N 82 110.014 111.626 -1.612 1 1 439 . 20 1 1 A 83 83 SER H H 83 7.938 7.868 0.070 1 1 440 . 20 1 1 A 83 83 SER C C 83 174.634 173.837 0.797 1 1 441 . 20 1 1 A 83 83 SER CA C 83 57.685 58.328 -0.643 1 1 442 . 20 1 1 A 83 83 SER CB C 83 63.303 64.293 -0.990 1 1 443 . 20 1 1 A 83 83 SER N N 83 115.655 116.527 -0.872 1 1 444 . 20 1 1 A 84 84 VAL H H 84 8.008 8.435 -0.427 1 1 451 . 20 1 1 A 84 84 VAL C C 84 175.525 175.821 -0.296 1 1 452 . 20 1 1 A 84 84 VAL CA C 84 61.769 61.843 -0.074 1 1 453 . 20 1 1 A 84 84 VAL CB C 84 31.711 31.737 -0.026 1 1 456 . 20 1 1 A 84 84 VAL N N 84 120.054 122.546 -2.492 1 1 457 . 20 1 1 A 85 85 ASP H H 85 8.140 8.532 -0.392 1 1 458 . 20 1 1 A 85 85 ASP C C 85 174.740 174.565 0.175 1 1 459 . 20 1 1 A 85 85 ASP CA C 85 53.983 52.835 1.148 1 1 460 . 20 1 1 A 85 85 ASP CB C 85 40.633 45.803 -5.170 1 1 461 . 20 1 1 A 85 85 ASP N N 85 122.510 126.187 -3.677 1 1 462 . 20 1 1 A 86 86 ASN H H 86 7.736 8.615 -0.879 1 1 463 . 20 1 1 A 86 86 ASN C C 86 175.970 174.881 1.089 1 1 464 . 20 1 1 A 86 86 ASN CA C 86 54.349 52.069 2.280 1 1 465 . 20 1 1 A 86 86 ASN CB C 86 40.490 40.900 -0.410 1 1 467 . 20 1 1 A 86 86 ASN N N 86 124.290 118.727 5.563 1 1 468 . 20 1 1 A 87 87 GLY H H 87 8.000 7.925 0.075 1 1 469 . 20 1 1 A 87 87 GLY C C 87 173.456 172.201 1.255 1 1 470 . 20 1 1 A 87 87 GLY CA C 87 44.973 45.965 -0.992 1 1 471 . 20 1 1 A 87 87 GLY N N 87 113.494 107.891 5.603 1 1 472 . 20 1 1 A 88 88 ALA H H 88 8.024 8.035 -0.011 1 1 473 . 20 1 1 A 88 88 ALA C C 88 176.833 176.193 0.640 1 1 474 . 20 1 1 A 88 88 ALA CA C 88 51.734 50.373 1.361 1 1 475 . 20 1 1 A 88 88 ALA CB C 88 19.818 21.333 -1.515 1 1 476 . 20 1 1 A 88 88 ALA N N 88 122.676 123.698 -1.022 1 1 477 . 20 1 1 A 91 91 ALA C C 91 174.781 175.764 -0.983 1 1 478 . 20 1 1 A 91 91 ALA CA C 91 50.537 51.854 -1.317 1 1 479 . 20 1 1 A 91 91 ALA CB C 91 21.324 20.699 0.625 1 1 480 . 20 1 1 A 92 92 GLN H H 92 8.451 8.550 -0.099 1 1 481 . 20 1 1 A 92 92 GLN C C 92 173.557 173.932 -0.375 1 1 482 . 20 1 1 A 92 92 GLN CA C 92 53.380 55.206 -1.826 1 1 484 . 20 1 1 A 92 92 GLN N N 92 116.847 121.563 -4.716 1 1 485 . 20 1 1 A 93 93 GLY C C 93 170.631 172.558 -1.927 1 1 486 . 20 1 1 A 93 93 GLY CA C 93 45.718 44.517 1.201 1 1 487 . 20 1 1 A 94 94 VAL H H 94 8.686 9.554 -0.868 1 1 494 . 20 1 1 A 94 94 VAL C C 94 173.698 173.852 -0.154 1 1 495 . 20 1 1 A 94 94 VAL CA C 94 58.997 59.953 -0.956 1 1 496 . 20 1 1 A 94 94 VAL CB C 94 33.311 33.910 -0.599 1 1 499 . 20 1 1 A 94 94 VAL N N 94 118.489 120.181 -1.692 1 1 500 . 20 1 1 A 95 95 GLN H H 95 9.468 9.723 -0.255 1 1 501 . 20 1 1 A 95 95 GLN C C 95 174.028 173.944 0.084 1 1 502 . 20 1 1 A 95 95 GLN CA C 95 52.547 54.209 -1.662 1 1 503 . 20 1 1 A 95 95 GLN CB C 95 33.816 31.429 2.387 1 1 505 . 20 1 1 A 95 95 GLN N N 95 122.106 126.122 -4.016 1 1 506 . 20 1 1 A 96 96 LEU H H 96 8.484 8.976 -0.492 1 1 513 . 20 1 1 A 96 96 LEU C C 96 175.322 175.535 -0.213 1 1 514 . 20 1 1 A 96 96 LEU CA C 96 53.736 53.866 -0.130 1 1 515 . 20 1 1 A 96 96 LEU CB C 96 41.088 44.729 -3.641 1 1 519 . 20 1 1 A 96 96 LEU N N 96 123.224 127.887 -4.663 1 1 520 . 20 1 1 A 97 97 THR H H 97 9.116 8.979 0.137 1 1 521 . 20 1 1 A 97 97 THR C C 97 173.251 171.770 1.481 1 1 522 . 20 1 1 A 97 97 THR CA C 97 58.931 59.707 -0.776 1 1 523 . 20 1 1 A 97 97 THR CB C 97 72.984 72.168 0.816 1 1 525 . 20 1 1 A 97 97 THR N N 97 112.504 115.686 -3.182 1 1 526 . 20 1 1 A 98 98 ALA H H 98 8.603 8.747 -0.144 1 1 527 . 20 1 1 A 98 98 ALA C C 98 174.948 176.591 -1.643 1 1 528 . 20 1 1 A 98 98 ALA CA C 98 49.980 50.004 -0.024 1 1 529 . 20 1 1 A 98 98 ALA CB C 98 19.157 20.583 -1.426 1 1 530 . 20 1 1 A 98 98 ALA N N 98 121.608 123.749 -2.141 1 1 531 . 20 1 1 A 99 99 LYS H H 99 8.890 9.264 -0.374 1 1 532 . 20 1 1 A 99 99 LYS C C 99 174.294 175.649 -1.355 1 1 533 . 20 1 1 A 99 99 LYS CA C 99 54.019 54.747 -0.728 1 1 534 . 20 1 1 A 99 99 LYS CB C 99 33.018 35.512 -2.494 1 1 538 . 20 1 1 A 99 99 LYS N N 99 124.522 120.478 4.044 1 1 539 . 20 1 1 A 100 100 LEU H H 100 8.985 8.919 0.066 1 1 546 . 20 1 1 A 100 100 LEU C C 100 175.265 175.726 -0.461 1 1 547 . 20 1 1 A 100 100 LEU CA C 100 52.698 53.092 -0.394 1 1 548 . 20 1 1 A 100 100 LEU CB C 100 42.889 44.675 -1.786 1 1 552 . 20 1 1 A 100 100 LEU N N 100 131.876 121.832 10.044 1 1 553 . 20 1 1 A 101 101 GLY H H 101 9.137 8.433 0.704 1 1 554 . 20 1 1 A 101 101 GLY C C 101 170.798 172.124 -1.326 1 1 555 . 20 1 1 A 101 101 GLY CA C 101 44.429 45.909 -1.480 1 1 556 . 20 1 1 A 101 101 GLY N N 101 111.928 107.762 4.166 1 1 557 . 20 1 1 A 102 102 TYR H H 102 8.779 8.712 0.067 1 1 558 . 20 1 1 A 102 102 TYR C C 102 173.402 172.851 0.551 1 1 559 . 20 1 1 A 102 102 TYR CA C 102 54.444 56.072 -1.628 1 1 560 . 20 1 1 A 102 102 TYR CB C 102 42.239 39.453 2.786 1 1 561 . 20 1 1 A 102 102 TYR N N 102 116.664 116.429 0.235 1 1 562 . 20 1 1 A 103 103 PRO C C 103 175.676 176.626 -0.950 1 1 563 . 20 1 1 A 103 103 PRO CA C 103 61.462 62.331 -0.869 1 1 564 . 20 1 1 A 103 103 PRO CB C 103 30.073 33.290 -3.217 1 1 565 . 20 1 1 A 104 104 ILE H H 104 8.670 9.184 -0.514 1 1 569 . 20 1 1 A 104 104 ILE C C 104 176.646 177.078 -0.432 1 1 570 . 20 1 1 A 104 104 ILE CA C 104 62.054 62.508 -0.454 1 1 571 . 20 1 1 A 104 104 ILE CB C 104 37.678 38.918 -1.240 1 1 574 . 20 1 1 A 104 104 ILE N N 104 125.939 120.054 5.885 1 1 575 . 20 1 1 A 105 105 THR H H 105 8.129 7.926 0.203 1 1 576 . 20 1 1 A 105 105 THR C C 105 174.344 174.973 -0.629 1 1 577 . 20 1 1 A 105 105 THR CA C 105 59.176 63.522 -4.346 1 1 578 . 20 1 1 A 105 105 THR CB C 105 71.049 71.265 -0.216 1 1 580 . 20 1 1 A 105 105 THR N N 105 109.853 111.264 -1.411 1 1 581 . 20 1 1 A 106 106 ASP H H 106 8.424 7.843 0.581 1 1 582 . 20 1 1 A 106 106 ASP C C 106 175.692 175.125 0.567 1 1 583 . 20 1 1 A 106 106 ASP CA C 106 56.465 53.223 3.242 1 1 584 . 20 1 1 A 106 106 ASP CB C 106 40.032 41.015 -0.983 1 1 585 . 20 1 1 A 106 106 ASP N N 106 117.156 115.654 1.502 1 1 586 . 20 1 1 A 107 107 ASP H H 107 8.124 7.931 0.193 1 1 587 . 20 1 1 A 107 107 ASP C C 107 174.174 175.815 -1.641 1 1 588 . 20 1 1 A 107 107 ASP CA C 107 52.907 54.620 -1.713 1 1 589 . 20 1 1 A 107 107 ASP CB C 107 41.661 43.048 -1.387 1 1 590 . 20 1 1 A 107 107 ASP N N 107 113.591 117.998 -4.407 1 1 591 . 20 1 1 A 108 108 LEU H H 108 7.336 7.923 -0.587 1 1 598 . 20 1 1 A 108 108 LEU C C 108 174.321 175.178 -0.857 1 1 599 . 20 1 1 A 108 108 LEU CA C 108 54.449 53.399 1.050 1 1 600 . 20 1 1 A 108 108 LEU CB C 108 44.754 44.017 0.737 1 1 604 . 20 1 1 A 108 108 LEU N N 108 123.244 120.438 2.806 1 1 605 . 20 1 1 A 109 109 ASP H H 109 8.943 8.739 0.204 1 1 606 . 20 1 1 A 109 109 ASP C C 109 176.248 174.442 1.806 1 1 607 . 20 1 1 A 109 109 ASP CA C 109 52.376 52.476 -0.100 1 1 608 . 20 1 1 A 109 109 ASP CB C 109 42.764 44.754 -1.990 1 1 609 . 20 1 1 A 109 109 ASP N N 109 124.634 121.273 3.361 1 1 610 . 20 1 1 A 110 110 ILE H H 110 8.372 8.348 0.024 1 1 614 . 20 1 1 A 110 110 ILE C C 110 173.735 174.304 -0.569 1 1 615 . 20 1 1 A 110 110 ILE CA C 110 59.129 59.047 0.082 1 1 616 . 20 1 1 A 110 110 ILE CB C 110 39.402 40.628 -1.226 1 1 620 . 20 1 1 A 110 110 ILE N N 110 119.135 116.292 2.843 1 1 621 . 20 1 1 A 111 111 TYR H H 111 8.695 8.939 -0.244 1 1 622 . 20 1 1 A 111 111 TYR C C 111 172.838 172.979 -0.141 1 1 623 . 20 1 1 A 111 111 TYR CA C 111 56.182 56.007 0.175 1 1 624 . 20 1 1 A 111 111 TYR CB C 111 41.489 42.058 -0.569 1 1 625 . 20 1 1 A 111 111 TYR N N 111 121.248 119.209 2.039 1 1 626 . 20 1 1 A 112 112 THR H H 112 9.172 8.975 0.197 1 1 627 . 20 1 1 A 112 112 THR C C 112 173.850 173.790 0.060 1 1 628 . 20 1 1 A 112 112 THR CA C 112 58.246 60.055 -1.809 1 1 629 . 20 1 1 A 112 112 THR CB C 112 71.676 71.580 0.096 1 1 631 . 20 1 1 A 112 112 THR N N 112 110.671 112.612 -1.941 1 1 632 . 20 1 1 A 113 113 ARG H H 113 8.732 9.334 -0.602 1 1 633 . 20 1 1 A 113 113 ARG C C 113 175.037 174.251 0.786 1 1 634 . 20 1 1 A 113 113 ARG CA C 113 53.995 54.454 -0.459 1 1 635 . 20 1 1 A 113 113 ARG CB C 113 32.266 32.880 -0.614 1 1 638 . 20 1 1 A 113 113 ARG N N 113 120.642 122.558 -1.916 1 1 639 . 20 1 1 A 114 114 LEU H H 114 8.449 9.014 -0.565 1 1 646 . 20 1 1 A 114 114 LEU C C 114 175.812 175.785 0.027 1 1 647 . 20 1 1 A 114 114 LEU CA C 114 53.335 53.524 -0.189 1 1 648 . 20 1 1 A 114 114 LEU CB C 114 45.182 44.831 0.351 1 1 652 . 20 1 1 A 114 114 LEU N N 114 119.078 123.981 -4.903 1 1 653 . 20 1 1 A 115 115 GLY H H 115 8.232 8.386 -0.154 1 1 654 . 20 1 1 A 115 115 GLY C C 115 171.343 172.448 -1.105 1 1 655 . 20 1 1 A 115 115 GLY CA C 115 46.217 46.139 0.078 1 1 656 . 20 1 1 A 115 115 GLY N N 115 108.966 112.432 -3.466 1 1 657 . 20 1 1 A 116 116 GLY H H 116 8.293 8.365 -0.072 1 1 658 . 20 1 1 A 116 116 GLY C C 116 169.856 171.943 -2.087 1 1 659 . 20 1 1 A 116 116 GLY CA C 116 44.084 44.870 -0.786 1 1 660 . 20 1 1 A 116 116 GLY N N 116 109.676 110.371 -0.695 1 1 661 . 20 1 1 A 117 117 MET H H 117 9.286 8.904 0.382 1 1 662 . 20 1 1 A 117 117 MET C C 117 174.557 174.529 0.028 1 1 663 . 20 1 1 A 117 117 MET CA C 117 53.258 54.320 -1.062 1 1 664 . 20 1 1 A 117 117 MET CB C 117 37.195 35.798 1.397 1 1 667 . 20 1 1 A 117 117 MET N N 117 120.425 119.239 1.186 1 1 668 . 20 1 1 A 118 118 VAL H H 118 9.062 9.172 -0.110 1 1 675 . 20 1 1 A 118 118 VAL C C 118 173.993 175.157 -1.164 1 1 676 . 20 1 1 A 118 118 VAL CA C 118 59.883 61.097 -1.214 1 1 677 . 20 1 1 A 118 118 VAL CB C 118 31.782 34.427 -2.645 1 1 680 . 20 1 1 A 118 118 VAL N N 118 126.948 124.821 2.127 1 1 681 . 20 1 1 A 119 119 TRP H H 119 8.482 9.763 -1.281 1 1 682 . 20 1 1 A 119 119 TRP C C 119 174.608 173.575 1.033 1 1 683 . 20 1 1 A 119 119 TRP CA C 119 53.332 54.960 -1.628 1 1 684 . 20 1 1 A 119 119 TRP CB C 119 33.569 32.932 0.637 1 1 685 . 20 1 1 A 119 119 TRP N N 119 124.631 124.908 -0.277 1 1 686 . 20 1 1 A 120 120 ARG H H 120 9.113 8.579 0.534 1 1 687 . 20 1 1 A 120 120 ARG C C 120 174.951 174.560 0.391 1 1 688 . 20 1 1 A 120 120 ARG CA C 120 54.684 54.111 0.573 1 1 689 . 20 1 1 A 120 120 ARG CB C 120 33.424 34.052 -0.628 1 1 690 . 20 1 1 A 120 120 ARG N N 120 117.899 119.621 -1.722 1 1 691 . 20 1 1 A 121 121 ALA H H 121 9.299 8.238 1.061 1 1 692 . 20 1 1 A 121 121 ALA C C 121 175.954 174.905 1.049 1 1 693 . 20 1 1 A 121 121 ALA CA C 121 50.368 50.073 0.295 1 1 694 . 20 1 1 A 121 121 ALA CB C 121 21.141 23.193 -2.052 1 1 695 . 20 1 1 A 121 121 ALA N N 121 128.863 122.140 6.723 1 1 696 . 20 1 1 A 122 122 ASP H H 122 8.488 8.817 -0.329 1 1 697 . 20 1 1 A 122 122 ASP C C 122 175.635 174.267 1.368 1 1 698 . 20 1 1 A 122 122 ASP CA C 122 53.891 52.785 1.106 1 1 699 . 20 1 1 A 122 122 ASP CB C 122 42.492 44.894 -2.402 1 1 700 . 20 1 1 A 122 122 ASP N N 122 121.721 119.391 2.330 1 1 701 . 20 1 1 A 123 123 SER H H 123 8.466 8.881 -0.415 1 1 702 . 20 1 1 A 123 123 SER C C 123 174.325 172.127 2.198 1 1 703 . 20 1 1 A 123 123 SER CA C 123 57.325 56.758 0.567 1 1 704 . 20 1 1 A 123 123 SER CB C 123 63.988 63.135 0.853 1 1 705 . 20 1 1 A 123 123 SER N N 123 117.374 115.700 1.674 1 1 706 . 20 1 1 A 124 124 LYS H H 124 8.389 8.819 -0.430 1 1 707 . 20 1 1 A 124 124 LYS C C 124 176.840 174.676 2.164 1 1 708 . 20 1 1 A 124 124 LYS CA C 124 56.036 55.038 0.998 1 1 709 . 20 1 1 A 124 124 LYS CB C 124 32.397 33.290 -0.893 1 1 711 . 20 1 1 A 124 124 LYS N N 124 122.883 125.887 -3.004 1 1 712 . 20 1 1 A 125 125 GLY H H 125 8.281 8.807 -0.526 1 1 713 . 20 1 1 A 125 125 GLY C C 125 173.592 172.282 1.310 1 1 714 . 20 1 1 A 125 125 GLY CA C 125 44.924 44.545 0.379 1 1 715 . 20 1 1 A 125 125 GLY N N 125 109.541 114.002 -4.461 1 1 716 . 20 1 1 A 126 126 ASN H H 126 8.185 8.692 -0.507 1 1 717 . 20 1 1 A 126 126 ASN C C 126 176.649 174.405 2.244 1 1 718 . 20 1 1 A 126 126 ASN CA C 126 52.763 52.016 0.747 1 1 719 . 20 1 1 A 126 126 ASN CB C 126 38.439 39.550 -1.111 1 1 720 . 20 1 1 A 126 126 ASN N N 126 119.019 118.163 0.856 1 1 721 . 20 1 1 A 127 127 TYR C C 127 176.913 176.392 0.521 1 1 722 . 20 1 1 A 127 127 TYR CA C 127 57.757 59.352 -1.595 1 1 723 . 20 1 1 A 127 127 TYR CB C 127 37.703 40.717 -3.014 1 1 724 . 20 1 1 A 128 128 ALA H H 128 8.050 8.418 -0.368 1 1 728 . 20 1 1 A 128 128 ALA C C 128 177.756 176.766 0.990 1 1 729 . 20 1 1 A 128 128 ALA CA C 128 52.321 52.874 -0.553 1 1 730 . 20 1 1 A 128 128 ALA CB C 128 18.273 21.294 -3.021 1 1 731 . 20 1 1 A 128 128 ALA N N 128 124.529 119.881 4.648 1 1 732 . 20 1 1 A 129 129 SER H H 129 8.063 8.238 -0.175 1 1 733 . 20 1 1 A 129 129 SER C C 129 174.938 173.535 1.403 1 1 734 . 20 1 1 A 129 129 SER CA C 129 58.202 57.997 0.205 1 1 735 . 20 1 1 A 129 129 SER CB C 129 62.974 64.807 -1.833 1 1 736 . 20 1 1 A 129 129 SER N N 129 114.374 113.014 1.360 1 1 737 . 20 1 1 A 130 130 THR H H 130 7.875 8.688 -0.813 1 1 741 . 20 1 1 A 130 130 THR C C 130 175.198 174.626 0.572 1 1 742 . 20 1 1 A 130 130 THR CA C 130 61.520 63.804 -2.284 1 1 743 . 20 1 1 A 130 130 THR CB C 130 69.312 70.332 -1.020 1 1 745 . 20 1 1 A 130 130 THR N N 130 113.608 119.426 -5.818 1 1 746 . 20 1 1 A 131 131 GLY H H 131 8.219 7.787 0.432 1 1 747 . 20 1 1 A 131 131 GLY C C 131 173.979 172.854 1.125 1 1 748 . 20 1 1 A 131 131 GLY CA C 131 44.991 44.329 0.662 1 1 749 . 20 1 1 A 131 131 GLY N N 131 110.848 108.757 2.091 1 1 750 . 20 1 1 A 132 132 VAL H H 132 7.729 8.480 -0.751 1 1 757 . 20 1 1 A 132 132 VAL C C 132 175.988 176.175 -0.187 1 1 758 . 20 1 1 A 132 132 VAL CA C 132 61.643 61.156 0.487 1 1 759 . 20 1 1 A 132 132 VAL CB C 132 31.941 33.295 -1.354 1 1 762 . 20 1 1 A 132 132 VAL N N 132 118.932 120.829 -1.897 1 1 763 . 20 1 1 A 133 133 SER H H 133 8.224 8.920 -0.696 1 1 764 . 20 1 1 A 133 133 SER C C 133 174.320 174.629 -0.309 1 1 765 . 20 1 1 A 133 133 SER CA C 133 57.756 58.565 -0.809 1 1 766 . 20 1 1 A 133 133 SER CB C 133 63.140 64.230 -1.090 1 1 767 . 20 1 1 A 133 133 SER N N 133 119.260 118.629 0.631 1 1 768 . 20 1 1 A 134 134 ARG H H 134 8.199 7.860 0.339 1 1 769 . 20 1 1 A 134 134 ARG C C 134 175.923 175.945 -0.022 1 1 770 . 20 1 1 A 134 134 ARG CA C 134 55.461 55.432 0.029 1 1 771 . 20 1 1 A 134 134 ARG CB C 134 30.195 30.582 -0.387 1 1 774 . 20 1 1 A 134 134 ARG N N 134 123.262 117.144 6.118 1 1 775 . 20 1 1 A 135 135 SER H H 135 8.256 7.725 0.531 1 1 776 . 20 1 1 A 135 135 SER C C 135 174.360 173.120 1.240 1 1 777 . 20 1 1 A 135 135 SER CA C 135 57.730 56.530 1.200 1 1 778 . 20 1 1 A 135 135 SER CB C 135 63.275 64.875 -1.600 1 1 779 . 20 1 1 A 135 135 SER N N 135 117.155 114.039 3.116 1 1 780 . 20 1 1 A 136 136 GLU H H 136 8.374 8.873 -0.499 1 1 781 . 20 1 1 A 136 136 GLU C C 136 176.284 175.432 0.852 1 1 782 . 20 1 1 A 136 136 GLU CA C 136 56.082 54.254 1.828 1 1 783 . 20 1 1 A 136 136 GLU CB C 136 29.820 32.964 -3.144 1 1 785 . 20 1 1 A 136 136 GLU N N 136 122.812 122.542 0.270 1 1 786 . 20 1 1 A 137 137 HIS H H 137 8.118 8.421 -0.303 1 1 787 . 20 1 1 A 137 137 HIS C C 137 173.529 174.447 -0.918 1 1 788 . 20 1 1 A 137 137 HIS CA C 137 54.793 57.182 -2.389 1 1 789 . 20 1 1 A 137 137 HIS CB C 137 30.191 30.624 -0.433 1 1 790 . 20 1 1 A 137 137 HIS N N 137 118.002 119.467 -1.465 1 1 791 . 20 1 1 A 138 138 ASP H H 138 8.572 8.593 -0.021 1 1 792 . 20 1 1 A 138 138 ASP C C 138 174.940 174.446 0.494 1 1 793 . 20 1 1 A 138 138 ASP CA C 138 53.594 52.805 0.789 1 1 794 . 20 1 1 A 138 138 ASP CB C 138 42.165 43.922 -1.757 1 1 795 . 20 1 1 A 138 138 ASP N N 138 121.536 122.253 -0.717 1 1 796 . 20 1 1 A 139 139 THR H H 139 7.857 8.814 -0.957 1 1 797 . 20 1 1 A 139 139 THR C C 139 172.822 172.849 -0.027 1 1 798 . 20 1 1 A 139 139 THR CA C 139 59.197 59.400 -0.203 1 1 799 . 20 1 1 A 139 139 THR CB C 139 71.457 71.576 -0.119 1 1 801 . 20 1 1 A 139 139 THR N N 139 113.598 116.607 -3.009 1 1 802 . 20 1 1 A 140 140 GLY C C 140 169.622 172.114 -2.492 1 1 803 . 20 1 1 A 140 140 GLY CA C 140 44.287 44.278 0.009 1 1 804 . 20 1 1 A 141 141 VAL H H 141 7.815 8.885 -1.070 1 1 811 . 20 1 1 A 141 141 VAL C C 141 176.038 173.737 2.301 1 1 812 . 20 1 1 A 141 141 VAL CA C 141 59.739 60.129 -0.390 1 1 813 . 20 1 1 A 141 141 VAL CB C 141 33.308 35.190 -1.882 1 1 816 . 20 1 1 A 141 141 VAL N N 141 116.224 123.691 -7.467 1 1 817 . 20 1 1 A 142 142 SER H H 142 9.284 9.077 0.207 1 1 818 . 20 1 1 A 142 142 SER C C 142 171.050 171.595 -0.545 1 1 819 . 20 1 1 A 142 142 SER CB C 142 67.608 66.006 1.602 1 1 820 . 20 1 1 A 142 142 SER N N 142 123.223 121.731 1.492 1 1 821 . 20 1 1 A 143 143 PRO C C 143 174.032 176.126 -2.094 1 1 822 . 20 1 1 A 143 143 PRO CA C 143 62.350 62.742 -0.392 1 1 823 . 20 1 1 A 143 143 PRO CB C 143 31.774 32.892 -1.118 1 1 825 . 20 1 1 A 144 144 VAL H H 144 7.785 8.766 -0.981 1 1 832 . 20 1 1 A 144 144 VAL C C 144 172.826 174.063 -1.237 1 1 833 . 20 1 1 A 144 144 VAL CA C 144 59.770 59.754 0.016 1 1 834 . 20 1 1 A 144 144 VAL CB C 144 34.407 36.105 -1.698 1 1 837 . 20 1 1 A 144 144 VAL N N 144 120.214 116.254 3.960 1 1 838 . 20 1 1 A 145 145 PHE H H 145 8.623 8.862 -0.239 1 1 839 . 20 1 1 A 145 145 PHE C C 145 173.658 173.196 0.462 1 1 840 . 20 1 1 A 145 145 PHE CA C 145 54.942 57.186 -2.244 1 1 841 . 20 1 1 A 145 145 PHE CB C 145 42.692 42.486 0.206 1 1 842 . 20 1 1 A 145 145 PHE N N 145 123.914 123.151 0.763 1 1 843 . 20 1 1 A 146 146 ALA H H 146 8.886 8.778 0.108 1 1 844 . 20 1 1 A 146 146 ALA C C 146 176.258 175.896 0.362 1 1 845 . 20 1 1 A 146 146 ALA CA C 146 49.734 50.117 -0.383 1 1 846 . 20 1 1 A 146 146 ALA CB C 146 22.244 22.456 -0.212 1 1 847 . 20 1 1 A 146 146 ALA N N 146 125.243 130.239 -4.996 1 1 848 . 20 1 1 A 147 147 GLY H H 147 8.470 8.694 -0.224 1 1 849 . 20 1 1 A 147 147 GLY C C 147 170.940 172.891 -1.951 1 1 850 . 20 1 1 A 147 147 GLY CA C 147 44.063 44.668 -0.605 1 1 851 . 20 1 1 A 147 147 GLY N N 147 106.669 107.951 -1.282 1 1 852 . 20 1 1 A 148 148 GLY H H 148 8.008 8.153 -0.145 1 1 853 . 20 1 1 A 148 148 GLY C C 148 170.181 172.337 -2.156 1 1 854 . 20 1 1 A 148 148 GLY CA C 148 45.736 45.633 0.103 1 1 855 . 20 1 1 A 148 148 GLY N N 148 109.475 109.472 0.003 1 1 856 . 20 1 1 A 149 149 VAL H H 149 8.426 8.610 -0.184 1 1 863 . 20 1 1 A 149 149 VAL C C 149 174.157 173.446 0.711 1 1 864 . 20 1 1 A 149 149 VAL CA C 149 58.200 58.685 -0.485 1 1 865 . 20 1 1 A 149 149 VAL CB C 149 34.464 35.267 -0.803 1 1 868 . 20 1 1 A 149 149 VAL N N 149 112.651 116.632 -3.981 1 1 869 . 20 1 1 A 150 150 GLU H H 150 9.070 9.316 -0.246 1 1 870 . 20 1 1 A 150 150 GLU C C 150 173.892 174.436 -0.544 1 1 871 . 20 1 1 A 150 150 GLU CA C 150 54.617 54.579 0.038 1 1 872 . 20 1 1 A 150 150 GLU CB C 150 32.911 33.021 -0.110 1 1 874 . 20 1 1 A 150 150 GLU N N 150 124.471 121.203 3.268 1 1 875 . 20 1 1 A 151 151 TRP H H 151 9.461 9.401 0.060 1 1 877 . 20 1 1 A 151 151 TRP C C 151 174.370 175.356 -0.986 1 1 878 . 20 1 1 A 151 151 TRP CA C 151 54.113 56.059 -1.946 1 1 879 . 20 1 1 A 151 151 TRP CB C 151 31.688 31.948 -0.260 1 1 880 . 20 1 1 A 151 151 TRP N N 151 129.611 126.337 3.274 1 1 882 . 20 1 1 A 152 152 ALA H H 152 8.771 9.353 -0.582 1 1 883 . 20 1 1 A 152 152 ALA C C 152 175.079 176.038 -0.959 1 1 884 . 20 1 1 A 152 152 ALA CA C 152 51.417 50.717 0.700 1 1 885 . 20 1 1 A 152 152 ALA CB C 152 17.209 20.390 -3.181 1 1 886 . 20 1 1 A 152 152 ALA N N 152 130.502 127.497 3.005 1 1 887 . 20 1 1 A 153 153 VAL H H 153 7.893 8.851 -0.958 1 1 894 . 20 1 1 A 153 153 VAL C C 153 176.612 175.838 0.774 1 1 895 . 20 1 1 A 153 153 VAL CA C 153 63.600 61.048 2.552 1 1 896 . 20 1 1 A 153 153 VAL CB C 153 31.280 32.448 -1.168 1 1 899 . 20 1 1 A 153 153 VAL N N 153 124.360 124.072 0.288 1 1 900 . 20 1 1 A 154 154 THR H H 154 7.950 8.414 -0.464 1 1 904 . 20 1 1 A 154 154 THR C C 154 173.884 173.860 0.024 1 1 905 . 20 1 1 A 154 154 THR CA C 154 58.655 62.961 -4.306 1 1 906 . 20 1 1 A 154 154 THR CB C 154 71.262 67.892 3.370 1 1 908 . 20 1 1 A 154 154 THR N N 154 109.176 119.282 -10.106 1 1 909 . 20 1 1 A 155 155 ARG H H 155 8.310 8.693 -0.383 1 1 910 . 20 1 1 A 155 155 ARG C C 155 176.753 175.684 1.069 1 1 911 . 20 1 1 A 155 155 ARG CA C 155 58.456 56.202 2.254 1 1 912 . 20 1 1 A 155 155 ARG CB C 155 29.043 28.937 0.106 1 1 915 . 20 1 1 A 155 155 ARG N N 155 116.576 126.497 -9.921 1 1 916 . 20 1 1 A 156 156 ASP H H 156 7.783 8.435 -0.652 1 1 917 . 20 1 1 A 156 156 ASP C C 156 174.222 174.516 -0.294 1 1 918 . 20 1 1 A 156 156 ASP CA C 156 53.540 55.621 -2.081 1 1 919 . 20 1 1 A 156 156 ASP CB C 156 42.327 42.923 -0.596 1 1 920 . 20 1 1 A 156 156 ASP N N 156 112.950 125.044 -12.094 1 1 921 . 20 1 1 A 157 157 ILE H H 157 7.233 7.242 -0.009 1 1 925 . 20 1 1 A 157 157 ILE C C 157 174.178 174.786 -0.608 1 1 926 . 20 1 1 A 157 157 ILE CA C 157 59.350 60.175 -0.825 1 1 927 . 20 1 1 A 157 157 ILE CB C 157 38.969 42.365 -3.396 1 1 930 . 20 1 1 A 157 157 ILE N N 157 119.732 118.050 1.682 1 1 931 . 20 1 1 A 158 158 ALA H H 158 8.729 9.049 -0.320 1 1 932 . 20 1 1 A 158 158 ALA C C 158 176.567 175.231 1.336 1 1 933 . 20 1 1 A 158 158 ALA CA C 158 49.418 50.173 -0.755 1 1 934 . 20 1 1 A 158 158 ALA CB C 158 21.430 22.839 -1.409 1 1 935 . 20 1 1 A 158 158 ALA N N 158 128.564 129.363 -0.799 1 1 936 . 20 1 1 A 159 159 THR H H 159 8.972 9.003 -0.031 1 1 940 . 20 1 1 A 159 159 THR C C 159 172.213 172.744 -0.531 1 1 941 . 20 1 1 A 159 159 THR CA C 159 59.504 60.074 -0.570 1 1 942 . 20 1 1 A 159 159 THR CB C 159 70.728 72.117 -1.389 1 1 944 . 20 1 1 A 159 159 THR N N 159 114.901 113.076 1.825 1 1 945 . 20 1 1 A 160 160 ARG H H 160 8.924 9.264 -0.340 1 1 946 . 20 1 1 A 160 160 ARG C C 160 174.097 174.036 0.061 1 1 947 . 20 1 1 A 160 160 ARG CA C 160 53.066 54.228 -1.162 1 1 948 . 20 1 1 A 160 160 ARG CB C 160 32.922 34.199 -1.277 1 1 951 . 20 1 1 A 160 160 ARG N N 160 121.507 125.757 -4.250 1 1 952 . 20 1 1 A 161 161 LEU H H 161 8.611 8.971 -0.360 1 1 959 . 20 1 1 A 161 161 LEU C C 161 174.389 175.094 -0.705 1 1 960 . 20 1 1 A 161 161 LEU CA C 161 53.355 53.589 -0.234 1 1 961 . 20 1 1 A 161 161 LEU CB C 161 44.360 45.619 -1.259 1 1 964 . 20 1 1 A 161 161 LEU N N 161 124.711 123.185 1.526 1 1 965 . 20 1 1 A 162 162 GLU H H 162 8.746 8.818 -0.072 1 1 966 . 20 1 1 A 162 162 GLU C C 162 173.376 175.130 -1.754 1 1 967 . 20 1 1 A 162 162 GLU CA C 162 53.904 54.815 -0.911 1 1 968 . 20 1 1 A 162 162 GLU CB C 162 33.773 32.755 1.018 1 1 970 . 20 1 1 A 162 162 GLU N N 162 122.300 125.587 -3.287 1 1 971 . 20 1 1 A 163 163 TYR H H 163 8.872 9.498 -0.626 1 1 972 . 20 1 1 A 163 163 TYR C C 163 173.425 174.538 -1.113 1 1 973 . 20 1 1 A 163 163 TYR CA C 163 56.192 56.523 -0.331 1 1 974 . 20 1 1 A 163 163 TYR CB C 163 40.870 43.300 -2.430 1 1 975 . 20 1 1 A 163 163 TYR N N 163 124.618 121.456 3.162 1 1 976 . 20 1 1 A 171 171 ASP C C 171 175.753 174.724 1.029 1 1 977 . 20 1 1 A 171 171 ASP CA C 171 53.517 53.255 0.262 1 1 978 . 20 1 1 A 171 171 ASP CB C 171 41.353 41.800 -0.447 1 1 979 . 20 1 1 A 172 172 ALA H H 172 8.336 7.627 0.709 1 1 983 . 20 1 1 A 172 172 ALA C C 172 178.110 175.551 2.559 1 1 984 . 20 1 1 A 172 172 ALA CA C 172 52.190 51.461 0.729 1 1 985 . 20 1 1 A 172 172 ALA CB C 172 18.305 22.134 -3.829 1 1 986 . 20 1 1 A 172 172 ALA N N 172 125.294 119.667 5.627 1 1 987 . 20 1 1 A 173 173 GLY H H 173 8.300 8.411 -0.111 1 1 988 . 20 1 1 A 173 173 GLY C C 173 174.437 172.217 2.220 1 1 989 . 20 1 1 A 173 173 GLY CA C 173 45.083 45.402 -0.319 1 1 990 . 20 1 1 A 173 173 GLY N N 173 107.268 104.993 2.275 1 1 991 . 20 1 1 A 174 174 THR H H 174 7.754 8.680 -0.926 1 1 992 . 20 1 1 A 174 174 THR C C 174 174.738 173.023 1.715 1 1 993 . 20 1 1 A 174 174 THR CA C 174 61.310 60.570 0.740 1 1 994 . 20 1 1 A 174 174 THR CB C 174 69.310 68.348 0.962 1 1 996 . 20 1 1 A 174 174 THR N N 174 113.472 118.813 -5.341 1 1 997 . 20 1 1 A 175 175 VAL H H 175 7.993 8.344 -0.351 1 1 1004 . 20 1 1 A 175 175 VAL C C 175 176.535 174.119 2.416 1 1 1005 . 20 1 1 A 175 175 VAL CA C 175 62.126 59.788 2.338 1 1 1006 . 20 1 1 A 175 175 VAL CB C 175 31.282 35.397 -4.115 1 1 1009 . 20 1 1 A 175 175 VAL N N 175 121.643 122.470 -0.827 1 1 1010 . 20 1 1 A 176 176 GLY H H 176 8.056 8.300 -0.244 1 1 1011 . 20 1 1 A 176 176 GLY C C 176 173.930 173.216 0.714 1 1 1012 . 20 1 1 A 176 176 GLY CA C 176 44.983 45.921 -0.938 1 1 1013 . 20 1 1 A 176 176 GLY N N 176 110.460 110.839 -0.379 1 1 1014 . 20 1 1 A 177 177 THR H H 177 7.520 8.393 -0.873 1 1 1015 . 20 1 1 A 177 177 THR C C 177 173.574 174.576 -1.002 1 1 1016 . 20 1 1 A 177 177 THR CA C 177 60.609 62.481 -1.872 1 1 1017 . 20 1 1 A 177 177 THR CB C 177 69.506 69.296 0.210 1 1 1019 . 20 1 1 A 177 177 THR N N 177 113.390 116.938 -3.548 1 1 1020 . 20 1 1 A 178 178 ARG H H 178 8.261 7.751 0.510 1 1 1021 . 20 1 1 A 178 178 ARG C C 178 173.932 174.770 -0.838 1 1 1022 . 20 1 1 A 178 178 ARG CA C 178 53.683 54.156 -0.473 1 1 1023 . 20 1 1 A 178 178 ARG CB C 178 29.224 31.419 -2.195 1 1 1026 . 20 1 1 A 178 178 ARG N N 178 123.906 120.425 3.481 1 1 1027 . 20 1 1 A 183 183 MET C C 183 174.053 174.338 -0.285 1 1 1028 . 20 1 1 A 183 183 MET CA C 183 53.700 54.702 -1.002 1 1 1029 . 20 1 1 A 183 183 MET CB C 183 35.908 34.333 1.575 1 1 1032 . 20 1 1 A 184 184 LEU H H 184 8.319 8.960 -0.641 1 1 1033 . 20 1 1 A 184 184 LEU C C 184 175.235 175.603 -0.368 1 1 1034 . 20 1 1 A 184 184 LEU CA C 184 53.120 53.264 -0.144 1 1 1035 . 20 1 1 A 184 184 LEU CB C 184 42.857 45.301 -2.444 1 1 1038 . 20 1 1 A 184 184 LEU N N 184 131.293 128.028 3.265 1 1 1039 . 20 1 1 A 185 185 SER H H 185 9.603 8.608 0.995 1 1 1040 . 20 1 1 A 185 185 SER C C 185 171.293 172.853 -1.560 1 1 1041 . 20 1 1 A 185 185 SER CA C 185 56.504 56.798 -0.294 1 1 1042 . 20 1 1 A 185 185 SER CB C 185 66.585 65.869 0.716 1 1 1043 . 20 1 1 A 185 185 SER N N 185 119.338 121.937 -2.599 1 1 1044 . 20 1 1 A 186 186 LEU H H 186 8.583 8.712 -0.129 1 1 1051 . 20 1 1 A 186 186 LEU C C 186 175.328 176.174 -0.846 1 1 1052 . 20 1 1 A 186 186 LEU CA C 186 52.729 53.020 -0.291 1 1 1053 . 20 1 1 A 186 186 LEU CB C 186 44.996 45.143 -0.147 1 1 1056 . 20 1 1 A 186 186 LEU N N 186 122.719 124.093 -1.374 1 1 1057 . 20 1 1 A 187 187 GLY H H 187 9.287 8.455 0.832 1 1 1058 . 20 1 1 A 187 187 GLY C C 187 172.315 173.418 -1.103 1 1 1059 . 20 1 1 A 187 187 GLY CA C 187 43.502 44.955 -1.453 1 1 1060 . 20 1 1 A 187 187 GLY N N 187 110.265 110.499 -0.234 1 1 1061 . 20 1 1 A 188 188 VAL H H 188 8.825 8.570 0.255 1 1 1068 . 20 1 1 A 188 188 VAL C C 188 173.125 174.451 -1.326 1 1 1069 . 20 1 1 A 188 188 VAL CA C 188 59.739 59.100 0.639 1 1 1070 . 20 1 1 A 188 188 VAL CB C 188 34.532 34.781 -0.249 1 1 1073 . 20 1 1 A 188 188 VAL N N 188 119.161 116.724 2.437 1 1 1074 . 20 1 1 A 189 189 SER H H 189 9.051 8.486 0.565 1 1 1075 . 20 1 1 A 189 189 SER C C 189 171.698 172.590 -0.892 1 1 1076 . 20 1 1 A 189 189 SER CA C 189 55.997 57.096 -1.099 1 1 1077 . 20 1 1 A 189 189 SER CB C 189 66.094 67.008 -0.914 1 1 1078 . 20 1 1 A 189 189 SER N N 189 117.810 119.710 -1.900 1 1 1079 . 20 1 1 A 190 190 TYR H H 190 9.145 9.045 0.100 1 1 1080 . 20 1 1 A 190 190 TYR C C 190 174.063 175.313 -1.250 1 1 1081 . 20 1 1 A 190 190 TYR CA C 190 55.375 56.415 -1.040 1 1 1082 . 20 1 1 A 190 190 TYR CB C 190 41.183 42.208 -1.025 1 1 1083 . 20 1 1 A 190 190 TYR N N 190 123.690 119.984 3.706 1 1 1084 . 20 1 1 A 191 191 ARG H H 191 8.211 8.931 -0.720 1 1 1085 . 20 1 1 A 191 191 ARG C C 191 174.826 175.357 -0.531 1 1 1086 . 20 1 1 A 191 191 ARG CA C 191 54.464 54.967 -0.503 1 1 1087 . 20 1 1 A 191 191 ARG CB C 191 30.507 33.338 -2.831 1 1 1090 . 20 1 1 A 191 191 ARG N N 191 125.366 122.013 3.353 1 1 1091 . 20 1 1 A 192 192 PHE H H 192 8.496 9.278 -0.782 1 1 1092 . 20 1 1 A 192 192 PHE C C 192 176.384 175.274 1.110 1 1 1093 . 20 1 1 A 192 192 PHE CA C 192 57.179 55.895 1.284 1 1 1094 . 20 1 1 A 192 192 PHE CB C 192 39.430 43.394 -3.964 1 1 1095 . 20 1 1 A 192 192 PHE N N 192 121.586 119.882 1.704 1 1 1096 . 20 1 1 A 193 193 GLY H H 193 8.643 8.689 -0.046 1 1 1097 . 20 1 1 A 193 193 GLY C C 193 174.466 174.958 -0.492 1 1 1098 . 20 1 1 A 193 193 GLY CA C 193 45.126 45.050 0.076 1 1 1099 . 20 1 1 A 193 193 GLY N N 193 109.499 108.478 1.021 1 1 1100 . 20 1 1 A 194 194 GLN H H 194 8.512 8.953 -0.441 1 1 1101 . 20 1 1 A 194 194 GLN C C 194 176.201 175.498 0.703 1 1 1102 . 20 1 1 A 194 194 GLN CA C 194 55.433 57.385 -1.952 1 1 1103 . 20 1 1 A 194 194 GLN CB C 194 28.729 29.668 -0.939 1 1 1105 . 20 1 1 A 194 194 GLN N N 194 119.448 119.288 0.160 1 1 1106 . 20 1 1 A 195 195 GLU H H 195 8.530 8.094 0.436 1 1 1107 . 20 1 1 A 195 195 GLU C C 195 176.151 175.239 0.912 1 1 1108 . 20 1 1 A 195 195 GLU CA C 195 56.256 54.889 1.367 1 1 1109 . 20 1 1 A 195 195 GLU CB C 195 29.486 32.059 -2.573 1 1 1111 . 20 1 1 A 195 195 GLU N N 195 121.959 117.407 4.552 1 1 1112 . 20 1 1 A 196 196 ASP H H 196 8.253 8.909 -0.656 1 1 1113 . 20 1 1 A 196 196 ASP C C 196 175.667 176.431 -0.764 1 1 1114 . 20 1 1 A 196 196 ASP CA C 196 53.981 54.892 -0.911 1 1 1115 . 20 1 1 A 196 196 ASP CB C 196 40.700 43.439 -2.739 1 1 1116 . 20 1 1 A 196 196 ASP N N 196 121.819 120.765 1.054 1 1 1117 . 20 1 1 A 197 197 ALA H H 197 7.999 7.823 0.176 1 1 1121 . 20 1 1 A 197 197 ALA C C 197 176.847 175.660 1.187 1 1 1122 . 20 1 1 A 197 197 ALA CA C 197 51.612 51.101 0.511 1 1 1123 . 20 1 1 A 197 197 ALA CB C 197 18.192 20.815 -2.623 1 1 1124 . 20 1 1 A 197 197 ALA N N 197 124.262 119.784 4.478 1 1 1125 . 20 1 1 A 198 198 ALA H H 198 8.042 8.674 -0.632 1 1 1126 . 20 1 1 A 198 198 ALA C C 198 176.865 175.601 1.264 1 1 1127 . 20 1 1 A 198 198 ALA CA C 198 49.999 49.284 0.715 1 1 1128 . 20 1 1 A 198 198 ALA CB C 198 17.327 19.993 -2.666 1 1 1129 . 20 1 1 A 198 198 ALA N N 198 124.724 126.026 -1.302 1 1 1130 . 20 1 1 A 199 199 PRO C C 199 176.727 176.215 0.512 1 1 1131 . 20 1 1 A 199 199 PRO CA C 199 62.399 62.332 0.067 1 1 1132 . 20 1 1 A 199 199 PRO CB C 199 30.949 33.331 -2.382 1 1 1135 . 20 1 1 A 200 200 VAL H H 200 8.026 8.115 -0.089 1 1 1142 . 20 1 1 A 200 200 VAL C C 200 176.034 176.696 -0.662 1 1 1143 . 20 1 1 A 200 200 VAL CA C 200 61.944 63.057 -1.113 1 1 1144 . 20 1 1 A 200 200 VAL CB C 200 31.734 32.345 -0.611 1 1 1147 . 20 1 1 A 200 200 VAL N N 200 120.635 116.568 4.067 1 1 1148 . 20 1 1 A 201 201 VAL H H 201 7.966 7.575 0.391 1 1 1155 . 20 1 1 A 201 201 VAL C C 201 175.128 175.565 -0.437 1 1 1156 . 20 1 1 A 201 201 VAL CA C 201 61.249 63.211 -1.962 1 1 1157 . 20 1 1 A 201 201 VAL CB C 201 31.917 31.879 0.038 1 1 1160 . 20 1 1 A 201 201 VAL N N 201 124.053 123.655 0.398 1 1 1161 . 20 1 1 A 202 202 ALA H H 202 8.159 8.630 -0.471 1 1 1162 . 20 1 1 A 202 202 ALA C C 202 175.153 178.357 -3.204 1 1 1163 . 20 1 1 A 202 202 ALA CA C 202 49.742 56.185 -6.443 1 1 1164 . 20 1 1 A 202 202 ALA CB C 202 17.532 19.569 -2.037 1 1 1165 . 20 1 1 A 202 202 ALA N N 202 129.251 128.126 1.125 1 1 1166 . 20 1 1 A 203 203 PRO C C 203 176.273 175.617 0.656 1 1 1167 . 20 1 1 A 203 203 PRO CA C 203 62.324 62.977 -0.653 1 1 1168 . 20 1 1 A 203 203 PRO CB C 203 31.042 32.156 -1.114 1 1 1170 . 20 1 1 A 204 204 ALA H H 204 8.137 8.605 -0.468 1 1 1171 . 20 1 1 A 204 204 ALA C C 204 175.697 175.993 -0.296 1 1 1172 . 20 1 1 A 204 204 ALA CA C 204 49.865 49.559 0.306 1 1 1173 . 20 1 1 A 204 204 ALA CB C 204 17.364 19.280 -1.916 1 1 1174 . 20 1 1 A 204 204 ALA N N 204 125.510 125.990 -0.480 1 1 1175 . 20 1 1 A 205 205 PRO C C 205 175.430 176.387 -0.957 1 1 1176 . 20 1 1 A 205 205 PRO CA C 205 62.511 64.809 -2.298 1 1 1177 . 20 1 1 A 205 205 PRO CB C 205 31.056 32.036 -0.980 1 1 1179 . 20 1 1 A 206 206 ALA H H 206 7.847 7.364 0.483 1 1 1180 . 20 1 1 A 206 206 ALA C C 206 175.565 176.807 -1.242 1 1 1181 . 20 1 1 A 206 206 ALA CA C 206 49.487 49.562 -0.075 1 1 1182 . 20 1 1 A 206 206 ALA CB C 206 18.843 21.055 -2.212 1 1 1183 . 20 1 1 A 206 206 ALA N N 206 123.663 116.497 7.166 1 1 1184 . 20 1 1 A 207 207 PRO C C 207 174.397 176.316 -1.919 1 1 1185 . 20 1 1 A 207 207 PRO CA C 207 61.454 64.689 -3.235 1 1 1186 . 20 1 1 A 207 207 PRO CB C 207 31.929 32.151 -0.222 1 1 1187 . 20 1 1 A 208 208 ALA H H 208 7.898 7.317 0.581 1 1 1188 . 20 1 1 A 208 208 ALA C C 208 175.411 176.961 -1.550 1 1 1189 . 20 1 1 A 208 208 ALA CA C 208 49.472 49.463 0.009 1 1 1190 . 20 1 1 A 208 208 ALA CB C 208 19.082 21.715 -2.633 1 1 1191 . 20 1 1 A 208 208 ALA N N 208 127.450 116.222 11.228 1 1 1192 . 20 1 1 A 209 209 PRO C C 209 176.932 176.642 0.290 1 1 1193 . 20 1 1 A 209 209 PRO CA C 209 62.736 65.260 -2.524 1 1 1194 . 20 1 1 A 209 209 PRO CB C 209 31.012 31.822 -0.810 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 187 1.208 1 2 1 1 1 "RMS(OBS, PRED)" CA 184 1.625 1 3 1 1 1 "RMS(OBS, PRED)" CB 159 1.909 1 4 1 1 1 "RMS(OBS, PRED)" H 167 0.512 1 5 1 1 1 "RMS(OBS, PRED)" HA 0 0.000 1 6 1 1 1 "RMS(OBS, PRED)" N 167 3.574 1 7 1 2 1 "RMS(OBS, PRED)" C 187 1.167 1 8 1 2 1 "RMS(OBS, PRED)" CA 184 1.363 1 9 1 2 1 "RMS(OBS, PRED)" CB 159 1.858 1 10 1 2 1 "RMS(OBS, PRED)" H 167 0.527 1 11 1 2 1 "RMS(OBS, PRED)" HA 0 0.000 1 12 1 2 1 "RMS(OBS, PRED)" N 167 3.892 1 13 1 3 1 "RMS(OBS, PRED)" C 187 1.132 1 14 1 3 1 "RMS(OBS, PRED)" CA 184 1.365 1 15 1 3 1 "RMS(OBS, PRED)" CB 159 1.907 1 16 1 3 1 "RMS(OBS, PRED)" H 167 0.508 1 17 1 3 1 "RMS(OBS, PRED)" HA 0 0.000 1 18 1 3 1 "RMS(OBS, PRED)" N 167 3.615 1 19 1 4 1 "RMS(OBS, PRED)" C 187 1.085 1 20 1 4 1 "RMS(OBS, PRED)" CA 184 1.415 1 21 1 4 1 "RMS(OBS, PRED)" CB 159 1.776 1 22 1 4 1 "RMS(OBS, PRED)" H 167 0.543 1 23 1 4 1 "RMS(OBS, PRED)" HA 0 0.000 1 24 1 4 1 "RMS(OBS, PRED)" N 167 3.570 1 25 1 5 1 "RMS(OBS, PRED)" C 187 1.106 1 26 1 5 1 "RMS(OBS, PRED)" CA 184 1.360 1 27 1 5 1 "RMS(OBS, PRED)" CB 159 1.671 1 28 1 5 1 "RMS(OBS, PRED)" H 167 0.507 1 29 1 5 1 "RMS(OBS, PRED)" HA 0 0.000 1 30 1 5 1 "RMS(OBS, PRED)" N 167 3.580 1 31 1 6 1 "RMS(OBS, PRED)" C 187 1.143 1 32 1 6 1 "RMS(OBS, PRED)" CA 184 1.393 1 33 1 6 1 "RMS(OBS, PRED)" CB 159 1.829 1 34 1 6 1 "RMS(OBS, PRED)" H 167 0.532 1 35 1 6 1 "RMS(OBS, PRED)" HA 0 0.000 1 36 1 6 1 "RMS(OBS, PRED)" N 167 3.583 1 37 1 7 1 "RMS(OBS, PRED)" C 187 1.180 1 38 1 7 1 "RMS(OBS, PRED)" CA 184 1.475 1 39 1 7 1 "RMS(OBS, PRED)" CB 159 1.734 1 40 1 7 1 "RMS(OBS, PRED)" H 167 0.506 1 41 1 7 1 "RMS(OBS, PRED)" HA 0 0.000 1 42 1 7 1 "RMS(OBS, PRED)" N 167 3.635 1 43 1 8 1 "RMS(OBS, PRED)" C 187 1.176 1 44 1 8 1 "RMS(OBS, PRED)" CA 184 1.314 1 45 1 8 1 "RMS(OBS, PRED)" CB 159 1.783 1 46 1 8 1 "RMS(OBS, PRED)" H 167 0.534 1 47 1 8 1 "RMS(OBS, PRED)" HA 0 0.000 1 48 1 8 1 "RMS(OBS, PRED)" N 167 3.885 1 49 1 9 1 "RMS(OBS, PRED)" C 187 1.235 1 50 1 9 1 "RMS(OBS, PRED)" CA 184 1.413 1 51 1 9 1 "RMS(OBS, PRED)" CB 159 1.933 1 52 1 9 1 "RMS(OBS, PRED)" H 167 0.542 1 53 1 9 1 "RMS(OBS, PRED)" HA 0 0.000 1 54 1 9 1 "RMS(OBS, PRED)" N 167 3.599 1 55 1 10 1 "RMS(OBS, PRED)" C 187 1.238 1 56 1 10 1 "RMS(OBS, PRED)" CA 184 1.410 1 57 1 10 1 "RMS(OBS, PRED)" CB 159 1.922 1 58 1 10 1 "RMS(OBS, PRED)" H 167 0.508 1 59 1 10 1 "RMS(OBS, PRED)" HA 0 0.000 1 60 1 10 1 "RMS(OBS, PRED)" N 167 3.495 1 61 1 11 1 "RMS(OBS, PRED)" C 187 1.174 1 62 1 11 1 "RMS(OBS, PRED)" CA 184 1.330 1 63 1 11 1 "RMS(OBS, PRED)" CB 159 1.850 1 64 1 11 1 "RMS(OBS, PRED)" H 167 0.519 1 65 1 11 1 "RMS(OBS, PRED)" HA 0 0.000 1 66 1 11 1 "RMS(OBS, PRED)" N 167 3.377 1 67 1 12 1 "RMS(OBS, PRED)" C 187 1.111 1 68 1 12 1 "RMS(OBS, PRED)" CA 184 1.472 1 69 1 12 1 "RMS(OBS, PRED)" CB 159 1.876 1 70 1 12 1 "RMS(OBS, PRED)" H 167 0.533 1 71 1 12 1 "RMS(OBS, PRED)" HA 0 0.000 1 72 1 12 1 "RMS(OBS, PRED)" N 167 3.885 1 73 1 13 1 "RMS(OBS, PRED)" C 187 1.108 1 74 1 13 1 "RMS(OBS, PRED)" CA 184 1.310 1 75 1 13 1 "RMS(OBS, PRED)" CB 159 1.904 1 76 1 13 1 "RMS(OBS, PRED)" H 167 0.493 1 77 1 13 1 "RMS(OBS, PRED)" HA 0 0.000 1 78 1 13 1 "RMS(OBS, PRED)" N 167 3.597 1 79 1 14 1 "RMS(OBS, PRED)" C 187 1.126 1 80 1 14 1 "RMS(OBS, PRED)" CA 184 1.165 1 81 1 14 1 "RMS(OBS, PRED)" CB 159 2.030 1 82 1 14 1 "RMS(OBS, PRED)" H 167 0.521 1 83 1 14 1 "RMS(OBS, PRED)" HA 0 0.000 1 84 1 14 1 "RMS(OBS, PRED)" N 167 3.686 1 85 1 15 1 "RMS(OBS, PRED)" C 187 1.212 1 86 1 15 1 "RMS(OBS, PRED)" CA 184 1.345 1 87 1 15 1 "RMS(OBS, PRED)" CB 159 1.821 1 88 1 15 1 "RMS(OBS, PRED)" H 167 0.537 1 89 1 15 1 "RMS(OBS, PRED)" HA 0 0.000 1 90 1 15 1 "RMS(OBS, PRED)" N 167 3.785 1 91 1 16 1 "RMS(OBS, PRED)" C 187 1.104 1 92 1 16 1 "RMS(OBS, PRED)" CA 184 1.399 1 93 1 16 1 "RMS(OBS, PRED)" CB 159 1.961 1 94 1 16 1 "RMS(OBS, PRED)" H 167 0.528 1 95 1 16 1 "RMS(OBS, PRED)" HA 0 0.000 1 96 1 16 1 "RMS(OBS, PRED)" N 167 4.058 1 97 1 17 1 "RMS(OBS, PRED)" C 187 1.163 1 98 1 17 1 "RMS(OBS, PRED)" CA 184 1.391 1 99 1 17 1 "RMS(OBS, PRED)" CB 159 1.830 1 100 1 17 1 "RMS(OBS, PRED)" H 167 0.519 1 101 1 17 1 "RMS(OBS, PRED)" HA 0 0.000 1 102 1 17 1 "RMS(OBS, PRED)" N 167 4.069 1 103 1 18 1 "RMS(OBS, PRED)" C 187 1.160 1 104 1 18 1 "RMS(OBS, PRED)" CA 184 1.470 1 105 1 18 1 "RMS(OBS, PRED)" CB 159 1.812 1 106 1 18 1 "RMS(OBS, PRED)" H 167 0.478 1 107 1 18 1 "RMS(OBS, PRED)" HA 0 0.000 1 108 1 18 1 "RMS(OBS, PRED)" N 167 3.849 1 109 1 19 1 "RMS(OBS, PRED)" C 187 1.202 1 110 1 19 1 "RMS(OBS, PRED)" CA 184 1.370 1 111 1 19 1 "RMS(OBS, PRED)" CB 159 1.969 1 112 1 19 1 "RMS(OBS, PRED)" H 167 0.539 1 113 1 19 1 "RMS(OBS, PRED)" HA 0 0.000 1 114 1 19 1 "RMS(OBS, PRED)" N 167 3.524 1 115 1 20 1 "RMS(OBS, PRED)" C 187 1.150 1 116 1 20 1 "RMS(OBS, PRED)" CA 184 1.454 1 117 1 20 1 "RMS(OBS, PRED)" CB 159 1.856 1 118 1 20 1 "RMS(OBS, PRED)" H 167 0.497 1 119 1 20 1 "RMS(OBS, PRED)" HA 0 0.000 1 120 1 20 1 "RMS(OBS, PRED)" N 167 3.961 1 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Conformer_type "average" _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Assigned_chem_shift_list_ID _Delta_CS.Atom_chem_shift_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.PDB_asym_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entity_delta_chem_shifts_ID 1 1 . 1 1 A 2 2 ARG C C 2 175.857 175.491 0.366 2 1 2 . 1 1 A 2 2 ARG CA C 2 55.872 55.735 0.137 2 1 3 . 1 1 A 2 2 ARG CB C 2 29.983 32.052 -2.069 2 1 5 . 1 1 A 3 3 ILE H H 3 8.238 8.114 0.124 2 1 9 . 1 1 A 3 3 ILE C C 3 175.763 174.835 0.928 2 1 10 . 1 1 A 3 3 ILE CA C 3 60.779 60.243 0.536 2 1 11 . 1 1 A 3 3 ILE CB C 3 37.664 40.586 -2.922 2 1 15 . 1 1 A 3 3 ILE N N 3 122.580 119.861 2.720 2 1 16 . 1 1 A 4 4 MET H H 4 8.261 8.735 -0.474 2 1 17 . 1 1 A 4 4 MET C C 4 175.660 175.016 0.644 2 1 18 . 1 1 A 4 4 MET CA C 4 54.893 54.774 0.119 2 1 19 . 1 1 A 4 4 MET CB C 4 32.060 34.683 -2.623 2 1 22 . 1 1 A 4 4 MET N N 4 123.988 124.318 -0.330 2 1 23 . 1 1 A 5 5 LYS H H 5 8.041 8.345 -0.304 2 1 24 . 1 1 A 5 5 LYS C C 5 175.850 175.846 0.004 2 1 25 . 1 1 A 5 5 LYS CA C 5 56.081 55.572 0.509 2 1 26 . 1 1 A 5 5 LYS CB C 5 32.220 34.137 -1.917 2 1 29 . 1 1 A 5 5 LYS N N 5 122.015 121.267 0.748 2 1 30 . 1 1 A 6 6 ALA H H 6 8.042 8.325 -0.283 2 1 34 . 1 1 A 6 6 ALA C C 6 177.160 177.070 0.090 2 1 35 . 1 1 A 6 6 ALA CA C 6 52.109 51.961 0.148 2 1 36 . 1 1 A 6 6 ALA CB C 6 18.637 19.745 -1.108 2 1 37 . 1 1 A 6 6 ALA N N 6 123.943 124.550 -0.607 2 1 38 . 1 1 A 7 7 ILE H H 7 7.916 8.231 -0.315 2 1 42 . 1 1 A 7 7 ILE C C 7 175.611 175.468 0.143 2 1 43 . 1 1 A 7 7 ILE CA C 7 61.181 61.283 -0.102 2 1 44 . 1 1 A 7 7 ILE CB C 7 37.910 39.266 -1.356 2 1 48 . 1 1 A 7 7 ILE N N 7 118.380 120.182 -1.802 2 1 49 . 1 1 A 8 8 PHE H H 8 8.167 8.358 -0.191 2 1 50 . 1 1 A 8 8 PHE C C 8 175.363 174.826 0.537 2 1 51 . 1 1 A 8 8 PHE CA C 8 57.286 57.316 -0.030 2 1 52 . 1 1 A 8 8 PHE CB C 8 39.008 41.419 -2.411 2 1 53 . 1 1 A 8 8 PHE N N 8 121.971 122.757 -0.786 2 1 54 . 1 1 A 9 9 VAL H H 9 7.872 8.463 -0.591 2 1 61 . 1 1 A 9 9 VAL C C 9 175.405 175.560 -0.155 2 1 62 . 1 1 A 9 9 VAL CA C 9 61.662 61.801 -0.139 2 1 63 . 1 1 A 9 9 VAL CB C 9 32.026 32.993 -0.967 2 1 66 . 1 1 A 9 9 VAL N N 9 120.864 120.938 -0.074 2 1 67 . 1 1 A 10 10 LEU H H 10 8.077 8.415 -0.338 2 1 74 . 1 1 A 10 10 LEU C C 10 176.652 176.422 0.230 2 1 75 . 1 1 A 10 10 LEU CA C 10 54.856 54.832 0.024 2 1 76 . 1 1 A 10 10 LEU CB C 10 41.401 43.627 -2.226 2 1 80 . 1 1 A 10 10 LEU N N 10 124.826 124.533 0.293 2 1 81 . 1 1 A 11 11 ASN H H 11 8.177 8.401 -0.224 2 1 82 . 1 1 A 11 11 ASN C C 11 174.394 175.219 -0.825 2 1 83 . 1 1 A 11 11 ASN CA C 11 52.704 53.870 -1.166 2 1 84 . 1 1 A 11 11 ASN CB C 11 38.468 38.825 -0.357 2 1 85 . 1 1 A 11 11 ASN N N 11 119.029 119.297 -0.268 2 1 86 . 1 1 A 12 12 ALA H H 12 7.991 8.270 -0.279 2 1 90 . 1 1 A 12 12 ALA C C 12 176.649 176.483 0.165 2 1 91 . 1 1 A 12 12 ALA CA C 12 51.950 51.963 -0.013 2 1 92 . 1 1 A 12 12 ALA CB C 12 18.659 20.033 -1.374 2 1 93 . 1 1 A 12 12 ALA N N 12 123.695 124.407 -0.712 2 1 94 . 1 1 A 13 13 ALA H H 13 8.083 8.272 -0.189 2 1 95 . 1 1 A 13 13 ALA C C 13 175.395 176.773 -1.377 2 1 96 . 1 1 A 13 13 ALA CA C 13 49.797 51.220 -1.423 2 1 97 . 1 1 A 13 13 ALA CB C 13 17.486 19.229 -1.743 2 1 98 . 1 1 A 13 13 ALA N N 13 124.281 123.634 0.647 2 1 99 . 1 1 A 14 14 PRO C C 14 176.641 176.538 0.103 2 1 100 . 1 1 A 14 14 PRO CA C 14 62.675 63.474 -0.799 2 1 101 . 1 1 A 14 14 PRO CB C 14 31.000 31.291 -0.291 2 1 103 . 1 1 A 15 15 LYS H H 15 8.283 8.365 -0.082 2 1 104 . 1 1 A 15 15 LYS C C 15 175.683 175.989 -0.306 2 1 105 . 1 1 A 15 15 LYS CA C 15 55.429 55.943 -0.514 2 1 106 . 1 1 A 15 15 LYS CB C 15 32.246 33.450 -1.204 2 1 109 . 1 1 A 15 15 LYS N N 15 119.069 119.808 -0.739 2 1 110 . 1 1 A 16 16 ASP H H 16 7.880 8.409 -0.529 2 1 111 . 1 1 A 16 16 ASP C C 16 175.419 175.861 -0.442 2 1 112 . 1 1 A 16 16 ASP CA C 16 54.413 54.666 -0.253 2 1 113 . 1 1 A 16 16 ASP CB C 16 40.224 41.027 -0.803 2 1 114 . 1 1 A 16 16 ASP N N 16 119.625 123.259 -3.634 2 1 115 . 1 1 A 17 17 ASN H H 17 7.973 8.379 -0.406 2 1 116 . 1 1 A 17 17 ASN C C 17 174.231 174.818 -0.587 2 1 117 . 1 1 A 17 17 ASN CA C 17 53.948 52.871 1.077 2 1 118 . 1 1 A 17 17 ASN CB C 17 37.009 39.922 -2.913 2 1 119 . 1 1 A 17 17 ASN N N 17 118.063 119.747 -1.684 2 1 120 . 1 1 A 18 18 THR H H 18 7.318 8.672 -1.354 2 1 121 . 1 1 A 18 18 THR C C 18 172.323 172.966 -0.643 2 1 122 . 1 1 A 18 18 THR CA C 18 60.153 60.388 -0.235 2 1 123 . 1 1 A 18 18 THR CB C 18 71.534 71.727 -0.193 2 1 125 . 1 1 A 18 18 THR N N 18 109.092 114.313 -5.221 2 1 126 . 1 1 A 19 19 TRP H H 19 8.541 8.674 -0.133 2 1 127 . 1 1 A 19 19 TRP C C 19 175.969 174.374 1.595 2 1 128 . 1 1 A 19 19 TRP CA C 19 55.700 55.968 -0.268 2 1 129 . 1 1 A 19 19 TRP CB C 19 31.471 33.137 -1.666 2 1 130 . 1 1 A 19 19 TRP N N 19 121.992 124.260 -2.268 2 1 131 . 1 1 A 20 20 TYR H H 20 8.691 9.082 -0.391 2 1 132 . 1 1 A 20 20 TYR C C 20 173.684 174.497 -0.813 2 1 133 . 1 1 A 20 20 TYR CA C 20 55.805 56.081 -0.276 2 1 134 . 1 1 A 20 20 TYR CB C 20 40.513 42.135 -1.622 2 1 135 . 1 1 A 20 20 TYR N N 20 116.519 122.570 -6.051 2 1 136 . 1 1 A 21 21 ALA H H 21 8.876 8.652 0.224 2 1 137 . 1 1 A 21 21 ALA C C 21 175.395 176.137 -0.742 2 1 138 . 1 1 A 21 21 ALA CA C 21 50.970 51.117 -0.147 2 1 139 . 1 1 A 21 21 ALA CB C 21 22.142 23.388 -1.246 2 1 140 . 1 1 A 21 21 ALA N N 21 119.359 123.728 -4.369 2 1 141 . 1 1 A 22 22 GLY H H 22 8.613 8.312 0.301 2 1 142 . 1 1 A 22 22 GLY C C 22 171.458 172.082 -0.624 2 1 143 . 1 1 A 22 22 GLY CA C 22 45.608 46.001 -0.393 2 1 144 . 1 1 A 22 22 GLY N N 22 106.678 106.202 0.476 2 1 145 . 1 1 A 23 23 GLY H H 23 7.911 8.415 -0.504 2 1 146 . 1 1 A 23 23 GLY C C 23 170.563 172.236 -1.673 2 1 147 . 1 1 A 23 23 GLY CA C 23 44.026 44.912 -0.886 2 1 148 . 1 1 A 23 23 GLY N N 23 103.399 108.757 -5.358 2 1 149 . 1 1 A 24 24 LYS H H 24 9.001 9.459 -0.458 2 1 150 . 1 1 A 24 24 LYS C C 24 172.965 174.348 -1.383 2 1 151 . 1 1 A 24 24 LYS CA C 24 54.062 54.359 -0.297 2 1 152 . 1 1 A 24 24 LYS CB C 24 36.774 36.468 0.306 2 1 156 . 1 1 A 24 24 LYS N N 24 116.402 120.268 -3.866 2 1 157 . 1 1 A 25 25 LEU H H 25 8.587 9.205 -0.618 2 1 164 . 1 1 A 25 25 LEU C C 25 175.205 175.248 -0.043 2 1 165 . 1 1 A 25 25 LEU CA C 25 53.446 53.391 0.055 2 1 166 . 1 1 A 25 25 LEU CB C 25 46.287 46.715 -0.428 2 1 170 . 1 1 A 25 25 LEU N N 25 119.932 122.814 -2.882 2 1 171 . 1 1 A 26 26 GLY H H 26 8.637 8.380 0.257 2 1 172 . 1 1 A 26 26 GLY C C 26 170.804 172.047 -1.243 2 1 173 . 1 1 A 26 26 GLY CA C 26 45.669 45.609 0.060 2 1 174 . 1 1 A 26 26 GLY N N 26 108.136 110.705 -2.569 2 1 175 . 1 1 A 27 27 TRP H H 27 8.642 8.573 0.069 2 1 177 . 1 1 A 27 27 TRP C C 27 174.820 175.298 -0.478 2 1 178 . 1 1 A 27 27 TRP CB C 27 30.883 31.993 -1.110 2 1 179 . 1 1 A 27 27 TRP N N 27 120.887 120.454 0.433 2 1 181 . 1 1 A 32 32 ASP C C 32 176.315 176.088 0.227 2 1 182 . 1 1 A 32 32 ASP CA C 32 53.737 53.843 -0.106 2 1 183 . 1 1 A 32 32 ASP CB C 32 41.230 42.685 -1.455 2 1 184 . 1 1 A 33 33 THR H H 33 8.190 8.376 -0.186 2 1 188 . 1 1 A 33 33 THR C C 33 175.291 175.153 0.138 2 1 189 . 1 1 A 33 33 THR CA C 33 61.909 63.071 -1.162 2 1 190 . 1 1 A 33 33 THR CB C 33 68.961 69.896 -0.935 2 1 192 . 1 1 A 33 33 THR N N 33 114.235 115.338 -1.103 2 1 193 . 1 1 A 34 34 GLY H H 34 8.341 8.193 0.148 2 1 194 . 1 1 A 34 34 GLY C C 34 173.766 173.587 0.179 2 1 195 . 1 1 A 34 34 GLY CA C 34 44.941 45.284 -0.343 2 1 196 . 1 1 A 34 34 GLY N N 34 110.678 110.445 0.233 2 1 197 . 1 1 A 35 35 PHE H H 35 7.945 8.306 -0.361 2 1 198 . 1 1 A 35 35 PHE C C 35 175.411 174.549 0.862 2 1 199 . 1 1 A 35 35 PHE CA C 35 57.921 57.403 0.518 2 1 200 . 1 1 A 35 35 PHE CB C 35 38.806 40.995 -2.189 2 1 201 . 1 1 A 35 35 PHE N N 35 120.533 120.751 -0.217 2 1 202 . 1 1 A 36 36 TYR H H 36 7.967 8.460 -0.493 2 1 203 . 1 1 A 36 36 TYR C C 36 176.104 175.352 0.752 2 1 204 . 1 1 A 36 36 TYR CA C 36 57.568 57.189 0.379 2 1 205 . 1 1 A 36 36 TYR CB C 36 37.727 40.326 -2.599 2 1 206 . 1 1 A 36 36 TYR N N 36 120.254 121.443 -1.189 2 1 207 . 1 1 A 37 37 GLY H H 37 7.666 8.261 -0.595 2 1 208 . 1 1 A 37 37 GLY C C 37 173.794 173.534 0.260 2 1 209 . 1 1 A 37 37 GLY CA C 37 45.007 45.326 -0.319 2 1 210 . 1 1 A 37 37 GLY N N 37 108.995 109.256 -0.261 2 1 211 . 1 1 A 38 38 ASN H H 38 8.109 8.568 -0.459 2 1 212 . 1 1 A 38 38 ASN C C 38 175.612 175.500 0.112 2 1 213 . 1 1 A 38 38 ASN CA C 38 52.954 53.460 -0.506 2 1 214 . 1 1 A 38 38 ASN CB C 38 38.425 39.652 -1.227 2 1 215 . 1 1 A 38 38 ASN N N 38 118.603 120.532 -1.929 2 1 216 . 1 1 A 39 39 GLY H H 39 8.202 8.224 -0.022 2 1 217 . 1 1 A 39 39 GLY C C 39 173.958 173.037 0.921 2 1 218 . 1 1 A 39 39 GLY CA C 39 45.012 45.398 -0.385 2 1 219 . 1 1 A 39 39 GLY N N 39 108.897 108.933 -0.036 2 1 220 . 1 1 A 40 40 PHE H H 40 7.960 8.410 -0.450 2 1 221 . 1 1 A 40 40 PHE C C 40 175.653 174.999 0.654 2 1 222 . 1 1 A 40 40 PHE CA C 40 57.556 57.350 0.206 2 1 223 . 1 1 A 40 40 PHE CB C 40 38.513 41.012 -2.499 2 1 224 . 1 1 A 40 40 PHE N N 40 119.829 120.526 -0.697 2 1 225 . 1 1 A 41 41 GLN H H 41 8.173 8.463 -0.290 2 1 226 . 1 1 A 41 41 GLN C C 41 175.234 175.353 -0.119 2 1 227 . 1 1 A 41 41 GLN CA C 41 55.488 55.393 0.095 2 1 228 . 1 1 A 41 41 GLN CB C 41 28.523 30.337 -1.814 2 1 230 . 1 1 A 41 41 GLN N N 41 120.810 121.539 -0.729 2 1 231 . 1 1 A 42 42 ASN H H 42 8.193 8.611 -0.418 2 1 232 . 1 1 A 42 42 ASN C C 42 174.618 175.248 -0.630 2 1 233 . 1 1 A 42 42 ASN CA C 42 52.924 53.448 -0.524 2 1 234 . 1 1 A 42 42 ASN CB C 42 38.333 39.437 -1.104 2 1 235 . 1 1 A 42 42 ASN N N 42 119.679 121.726 -2.047 2 1 236 . 1 1 A 43 43 ASN H H 43 8.255 8.513 -0.258 2 1 237 . 1 1 A 43 43 ASN C C 43 173.873 174.791 -0.918 2 1 238 . 1 1 A 43 43 ASN CA C 43 52.919 53.426 -0.507 2 1 239 . 1 1 A 43 43 ASN CB C 43 38.580 39.908 -1.328 2 1 240 . 1 1 A 43 43 ASN N N 43 119.773 119.728 0.045 2 1 241 . 1 1 A 44 44 ASN H H 44 7.865 8.463 -0.598 2 1 242 . 1 1 A 44 44 ASN C C 44 175.518 175.035 0.483 2 1 243 . 1 1 A 44 44 ASN CA C 44 54.528 52.439 2.089 2 1 244 . 1 1 A 44 44 ASN CB C 44 40.170 40.059 0.111 2 1 246 . 1 1 A 44 44 ASN N N 44 124.152 119.465 4.687 2 1 247 . 1 1 A 46 46 PRO C C 46 177.228 176.451 0.777 2 1 248 . 1 1 A 46 46 PRO CA C 46 62.794 63.673 -0.879 2 1 249 . 1 1 A 46 46 PRO CB C 46 31.283 32.174 -0.891 2 1 251 . 1 1 A 47 47 THR H H 47 8.165 8.127 0.038 2 1 255 . 1 1 A 47 47 THR C C 47 174.573 173.993 0.580 2 1 256 . 1 1 A 47 47 THR CA C 47 61.346 61.648 -0.302 2 1 257 . 1 1 A 47 47 THR CB C 47 69.573 70.164 -0.591 2 1 259 . 1 1 A 47 47 THR N N 47 114.265 112.614 1.651 2 1 260 . 1 1 A 48 48 ARG H H 48 8.237 8.193 0.045 2 1 261 . 1 1 A 48 48 ARG C C 48 175.898 175.680 0.218 2 1 262 . 1 1 A 48 48 ARG CA C 48 55.717 55.860 -0.143 2 1 263 . 1 1 A 48 48 ARG CB C 48 30.151 31.741 -1.590 2 1 266 . 1 1 A 48 48 ARG N N 48 122.795 122.826 -0.031 2 1 267 . 1 1 A 49 49 ASN H H 49 8.369 8.546 -0.177 2 1 268 . 1 1 A 49 49 ASN C C 49 174.560 174.507 0.053 2 1 269 . 1 1 A 49 49 ASN CA C 49 53.005 52.295 0.710 2 1 270 . 1 1 A 49 49 ASN CB C 49 38.761 40.093 -1.332 2 1 271 . 1 1 A 49 49 ASN N N 49 119.837 120.340 -0.503 2 1 272 . 1 1 A 50 50 ASP H H 50 8.192 8.552 -0.360 2 1 273 . 1 1 A 50 50 ASP C C 50 175.699 175.406 0.293 2 1 274 . 1 1 A 50 50 ASP CA C 50 54.289 53.555 0.734 2 1 275 . 1 1 A 50 50 ASP CB C 50 41.264 41.854 -0.590 2 1 276 . 1 1 A 50 50 ASP N N 50 120.403 122.056 -1.653 2 1 277 . 1 1 A 51 51 GLN H H 51 8.428 8.495 -0.067 2 1 278 . 1 1 A 51 51 GLN C C 51 175.186 174.931 0.255 2 1 279 . 1 1 A 51 51 GLN CA C 51 54.512 55.052 -0.540 2 1 280 . 1 1 A 51 51 GLN CB C 51 30.424 30.236 0.188 2 1 282 . 1 1 A 51 51 GLN N N 51 118.959 121.664 -2.705 2 1 289 . 1 1 A 52 52 LEU C C 52 176.018 175.829 0.189 2 1 290 . 1 1 A 52 52 LEU CA C 52 54.332 52.965 1.367 2 1 291 . 1 1 A 52 52 LEU CB C 52 43.022 44.636 -1.614 2 1 294 . 1 1 A 53 53 GLY H H 53 8.639 8.745 -0.106 2 1 295 . 1 1 A 53 53 GLY C C 53 171.931 171.915 0.016 2 1 296 . 1 1 A 53 53 GLY CA C 53 43.501 44.381 -0.880 2 1 297 . 1 1 A 53 53 GLY N N 53 109.964 108.090 1.874 2 1 298 . 1 1 A 54 54 ALA H H 54 8.881 8.800 0.081 2 1 299 . 1 1 A 54 54 ALA C C 54 175.543 176.567 -1.024 2 1 300 . 1 1 A 54 54 ALA CA C 54 50.710 50.698 0.012 2 1 301 . 1 1 A 54 54 ALA CB C 54 22.914 22.589 0.325 2 1 302 . 1 1 A 54 54 ALA N N 54 120.413 123.845 -3.432 2 1 303 . 1 1 A 55 55 GLY H H 55 8.346 8.785 -0.439 2 1 304 . 1 1 A 55 55 GLY C C 55 170.960 171.890 -0.930 2 1 305 . 1 1 A 55 55 GLY CA C 55 46.704 45.340 1.364 2 1 306 . 1 1 A 55 55 GLY N N 55 104.688 107.481 -2.793 2 1 307 . 1 1 A 56 56 ALA H H 56 9.116 8.741 0.375 2 1 308 . 1 1 A 56 56 ALA C C 56 176.472 176.563 -0.091 2 1 309 . 1 1 A 56 56 ALA CA C 56 49.638 50.821 -1.183 2 1 310 . 1 1 A 56 56 ALA CB C 56 22.275 21.534 0.741 2 1 311 . 1 1 A 56 56 ALA N N 56 120.608 124.023 -3.415 2 1 312 . 1 1 A 57 57 PHE H H 57 8.688 9.059 -0.371 2 1 313 . 1 1 A 57 57 PHE C C 57 172.816 174.861 -2.045 2 1 314 . 1 1 A 57 57 PHE CA C 57 56.066 55.808 0.258 2 1 315 . 1 1 A 57 57 PHE CB C 57 41.770 42.184 -0.414 2 1 316 . 1 1 A 57 57 PHE N N 57 120.027 118.573 1.454 2 1 317 . 1 1 A 58 58 GLY H H 58 9.034 8.854 0.180 2 1 318 . 1 1 A 58 58 GLY C C 58 170.860 172.480 -1.620 2 1 319 . 1 1 A 58 58 GLY CA C 58 44.954 44.856 0.098 2 1 320 . 1 1 A 58 58 GLY N N 58 105.817 109.169 -3.352 2 1 321 . 1 1 A 59 59 GLY H H 59 8.382 8.871 -0.489 2 1 322 . 1 1 A 59 59 GLY C C 59 169.284 172.096 -2.812 2 1 323 . 1 1 A 59 59 GLY CA C 59 45.840 44.852 0.988 2 1 324 . 1 1 A 59 59 GLY N N 59 109.059 110.938 -1.879 2 1 325 . 1 1 A 60 60 TYR H H 60 8.430 8.850 -0.420 2 1 326 . 1 1 A 60 60 TYR C C 60 173.453 172.819 0.634 2 1 327 . 1 1 A 60 60 TYR CA C 60 55.282 56.016 -0.734 2 1 328 . 1 1 A 60 60 TYR CB C 60 41.712 41.309 0.403 2 1 329 . 1 1 A 60 60 TYR N N 60 118.352 117.421 0.931 2 1 330 . 1 1 A 61 61 GLN H H 61 8.833 8.756 0.077 2 1 331 . 1 1 A 61 61 GLN C C 61 174.365 175.227 -0.862 2 1 332 . 1 1 A 61 61 GLN CA C 61 54.125 55.217 -1.092 2 1 333 . 1 1 A 61 61 GLN CB C 61 28.033 30.645 -2.612 2 1 335 . 1 1 A 61 61 GLN N N 61 129.628 122.137 7.491 2 1 336 . 1 1 A 62 62 VAL H H 62 8.714 8.662 0.052 2 1 343 . 1 1 A 62 62 VAL C C 62 175.758 175.513 0.245 2 1 344 . 1 1 A 62 62 VAL CA C 62 64.649 63.080 1.569 2 1 345 . 1 1 A 62 62 VAL CB C 62 31.900 33.839 -1.939 2 1 348 . 1 1 A 62 62 VAL N N 62 127.666 124.606 3.060 2 1 349 . 1 1 A 63 63 ASN H H 63 8.062 7.831 0.231 2 1 350 . 1 1 A 63 63 ASN C C 63 172.827 174.011 -1.184 2 1 351 . 1 1 A 63 63 ASN CA C 63 51.575 50.861 0.714 2 1 352 . 1 1 A 63 63 ASN CB C 63 37.194 39.645 -2.451 2 1 353 . 1 1 A 63 63 ASN N N 63 116.310 118.045 -1.735 2 1 354 . 1 1 A 64 64 PRO C C 64 175.071 175.934 -0.863 2 1 355 . 1 1 A 64 64 PRO CA C 64 65.296 63.127 2.169 2 1 356 . 1 1 A 64 64 PRO CB C 64 30.428 30.006 0.422 2 1 357 . 1 1 A 65 65 TYR H H 65 7.873 8.512 -0.639 2 1 358 . 1 1 A 65 65 TYR C C 65 175.145 174.815 0.330 2 1 359 . 1 1 A 65 65 TYR CA C 65 56.125 58.388 -2.263 2 1 360 . 1 1 A 65 65 TYR CB C 65 39.189 40.337 -1.148 2 1 361 . 1 1 A 65 65 TYR N N 65 112.894 120.808 -7.914 2 1 362 . 1 1 A 66 66 LEU H H 66 7.308 7.609 -0.301 2 1 369 . 1 1 A 66 66 LEU C C 66 173.866 174.589 -0.723 2 1 370 . 1 1 A 66 66 LEU CA C 66 53.431 53.957 -0.526 2 1 371 . 1 1 A 66 66 LEU CB C 66 44.958 44.489 0.469 2 1 375 . 1 1 A 66 66 LEU N N 66 120.270 117.968 2.302 2 1 376 . 1 1 A 67 67 GLY H H 67 8.855 8.624 0.231 2 1 377 . 1 1 A 67 67 GLY C C 67 170.698 171.933 -1.235 2 1 378 . 1 1 A 67 67 GLY CA C 67 44.008 44.161 -0.153 2 1 379 . 1 1 A 67 67 GLY N N 67 114.388 107.874 6.514 2 1 380 . 1 1 A 68 68 PHE H H 68 8.770 8.494 0.276 2 1 381 . 1 1 A 68 68 PHE C C 68 173.386 174.560 -1.174 2 1 382 . 1 1 A 68 68 PHE CA C 68 56.507 57.316 -0.809 2 1 383 . 1 1 A 68 68 PHE CB C 68 42.428 40.647 1.781 2 1 384 . 1 1 A 68 68 PHE N N 68 117.510 119.888 -2.378 2 1 385 . 1 1 A 69 69 GLU H H 69 9.079 9.353 -0.274 2 1 386 . 1 1 A 69 69 GLU C C 69 174.556 174.724 -0.168 2 1 387 . 1 1 A 69 69 GLU CA C 69 54.939 54.822 0.117 2 1 388 . 1 1 A 69 69 GLU CB C 69 33.963 32.844 1.119 2 1 390 . 1 1 A 69 69 GLU N N 69 120.562 123.355 -2.793 2 1 391 . 1 1 A 70 70 MET H H 70 9.481 9.464 0.017 2 1 392 . 1 1 A 70 70 MET C C 70 174.595 175.470 -0.875 2 1 393 . 1 1 A 70 70 MET CA C 70 53.091 54.047 -0.956 2 1 394 . 1 1 A 70 70 MET CB C 70 36.159 34.858 1.302 2 1 397 . 1 1 A 70 70 MET N N 70 124.928 125.232 -0.304 2 1 398 . 1 1 A 71 71 GLY H H 71 8.845 8.877 -0.033 2 1 399 . 1 1 A 71 71 GLY C C 71 170.811 171.387 -0.576 2 1 400 . 1 1 A 71 71 GLY CA C 71 44.624 43.777 0.847 2 1 401 . 1 1 A 71 71 GLY N N 71 108.896 111.752 -2.856 2 1 402 . 1 1 A 72 72 TYR H H 72 8.925 9.020 -0.095 2 1 403 . 1 1 A 72 72 TYR C C 72 173.278 174.089 -0.811 2 1 404 . 1 1 A 72 72 TYR CA C 72 55.912 56.422 -0.510 2 1 405 . 1 1 A 72 72 TYR CB C 72 41.611 40.972 0.639 2 1 406 . 1 1 A 72 72 TYR N N 72 123.253 121.273 1.980 2 1 407 . 1 1 A 73 73 ASP H H 73 8.665 9.111 -0.446 2 1 408 . 1 1 A 73 73 ASP C C 73 173.598 175.419 -1.821 2 1 409 . 1 1 A 73 73 ASP CA C 73 52.857 53.753 -0.896 2 1 410 . 1 1 A 73 73 ASP CB C 73 42.774 42.108 0.666 2 1 411 . 1 1 A 73 73 ASP N N 73 126.178 125.205 0.973 2 1 412 . 1 1 A 74 74 TRP H H 74 9.080 8.984 0.096 2 1 413 . 1 1 A 74 74 TRP C C 74 174.868 175.067 -0.199 2 1 414 . 1 1 A 74 74 TRP CB C 74 30.083 32.771 -2.688 2 1 415 . 1 1 A 74 74 TRP N N 74 121.824 126.332 -4.508 2 1 416 . 1 1 A 78 78 MET C C 78 174.548 175.648 -1.100 2 1 417 . 1 1 A 78 78 MET CA C 78 54.388 54.998 -0.610 2 1 418 . 1 1 A 78 78 MET CB C 78 32.542 34.049 -1.507 2 1 419 . 1 1 A 79 79 ALA H H 79 8.105 8.224 -0.119 2 1 420 . 1 1 A 79 79 ALA C C 79 176.629 176.559 0.070 2 1 421 . 1 1 A 79 79 ALA CA C 79 51.210 51.943 -0.733 2 1 422 . 1 1 A 79 79 ALA CB C 79 19.106 20.889 -1.782 2 1 423 . 1 1 A 79 79 ALA N N 79 125.778 123.572 2.206 2 1 424 . 1 1 A 80 80 TYR H H 80 8.035 8.488 -0.453 2 1 425 . 1 1 A 80 80 TYR C C 80 175.604 175.092 0.512 2 1 426 . 1 1 A 80 80 TYR CA C 80 57.021 57.598 -0.577 2 1 427 . 1 1 A 80 80 TYR CB C 80 38.416 39.716 -1.300 2 1 428 . 1 1 A 80 80 TYR N N 80 120.045 119.098 0.947 2 1 429 . 1 1 A 81 81 LYS H H 81 8.295 8.132 0.163 2 1 430 . 1 1 A 81 81 LYS C C 81 176.647 176.184 0.463 2 1 431 . 1 1 A 81 81 LYS CA C 81 56.285 55.710 0.575 2 1 432 . 1 1 A 81 81 LYS CB C 81 31.571 33.748 -2.177 2 1 434 . 1 1 A 81 81 LYS N N 81 123.191 121.911 1.280 2 1 435 . 1 1 A 82 82 GLY H H 82 8.117 8.318 -0.201 2 1 436 . 1 1 A 82 82 GLY C C 82 174.010 173.652 0.358 2 1 437 . 1 1 A 82 82 GLY CA C 82 44.982 45.474 -0.492 2 1 438 . 1 1 A 82 82 GLY N N 82 110.014 110.765 -0.751 2 1 439 . 1 1 A 83 83 SER H H 83 7.938 8.473 -0.535 2 1 440 . 1 1 A 83 83 SER C C 83 174.634 174.257 0.377 2 1 441 . 1 1 A 83 83 SER CA C 83 57.685 58.803 -1.118 2 1 442 . 1 1 A 83 83 SER CB C 83 63.303 64.651 -1.348 2 1 443 . 1 1 A 83 83 SER N N 83 115.655 116.322 -0.667 2 1 444 . 1 1 A 84 84 VAL H H 84 8.008 8.196 -0.188 2 1 451 . 1 1 A 84 84 VAL C C 84 175.525 174.899 0.626 2 1 452 . 1 1 A 84 84 VAL CA C 84 61.769 61.128 0.641 2 1 453 . 1 1 A 84 84 VAL CB C 84 31.711 32.549 -0.838 2 1 456 . 1 1 A 84 84 VAL N N 84 120.054 119.327 0.727 2 1 457 . 1 1 A 85 85 ASP H H 85 8.140 8.284 -0.144 2 1 458 . 1 1 A 85 85 ASP C C 85 174.740 175.315 -0.575 2 1 459 . 1 1 A 85 85 ASP CA C 85 53.983 53.626 0.357 2 1 460 . 1 1 A 85 85 ASP CB C 85 40.633 43.749 -3.116 2 1 461 . 1 1 A 85 85 ASP N N 85 122.510 122.640 -0.130 2 1 462 . 1 1 A 86 86 ASN H H 86 7.736 8.587 -0.851 2 1 463 . 1 1 A 86 86 ASN C C 86 175.970 175.488 0.482 2 1 464 . 1 1 A 86 86 ASN CA C 86 54.349 53.154 1.194 2 1 465 . 1 1 A 86 86 ASN CB C 86 40.490 39.857 0.633 2 1 467 . 1 1 A 86 86 ASN N N 86 124.290 118.747 5.543 2 1 468 . 1 1 A 87 87 GLY H H 87 8.000 8.230 -0.230 2 1 469 . 1 1 A 87 87 GLY C C 87 173.456 173.714 -0.258 2 1 470 . 1 1 A 87 87 GLY CA C 87 44.973 45.277 -0.304 2 1 471 . 1 1 A 87 87 GLY N N 87 113.494 109.510 3.984 2 1 472 . 1 1 A 88 88 ALA H H 88 8.024 8.138 -0.114 2 1 473 . 1 1 A 88 88 ALA C C 88 176.833 176.674 0.159 2 1 474 . 1 1 A 88 88 ALA CA C 88 51.734 52.103 -0.369 2 1 475 . 1 1 A 88 88 ALA CB C 88 19.818 20.836 -1.018 2 1 476 . 1 1 A 88 88 ALA N N 88 122.676 123.228 -0.552 2 1 477 . 1 1 A 91 91 ALA C C 91 174.781 175.649 -0.867 2 1 478 . 1 1 A 91 91 ALA CA C 91 50.537 51.196 -0.659 2 1 479 . 1 1 A 91 91 ALA CB C 91 21.324 22.460 -1.136 2 1 480 . 1 1 A 92 92 GLN H H 92 8.451 8.653 -0.202 2 1 481 . 1 1 A 92 92 GLN C C 92 173.557 174.516 -0.959 2 1 482 . 1 1 A 92 92 GLN CA C 92 53.380 54.791 -1.411 2 1 484 . 1 1 A 92 92 GLN N N 92 116.847 118.695 -1.848 2 1 485 . 1 1 A 93 93 GLY C C 93 170.631 172.572 -1.941 2 1 486 . 1 1 A 93 93 GLY CA C 93 45.718 44.630 1.088 2 1 487 . 1 1 A 94 94 VAL H H 94 8.686 9.375 -0.689 2 1 494 . 1 1 A 94 94 VAL C C 94 173.698 174.284 -0.586 2 1 495 . 1 1 A 94 94 VAL CA C 94 58.997 60.010 -1.013 2 1 496 . 1 1 A 94 94 VAL CB C 94 33.311 34.193 -0.882 2 1 499 . 1 1 A 94 94 VAL N N 94 118.489 120.094 -1.605 2 1 500 . 1 1 A 95 95 GLN H H 95 9.468 9.464 0.004 2 1 501 . 1 1 A 95 95 GLN C C 95 174.028 174.205 -0.177 2 1 502 . 1 1 A 95 95 GLN CA C 95 52.547 54.316 -1.769 2 1 503 . 1 1 A 95 95 GLN CB C 95 33.816 31.700 2.117 2 1 505 . 1 1 A 95 95 GLN N N 95 122.106 125.855 -3.749 2 1 506 . 1 1 A 96 96 LEU H H 96 8.484 8.945 -0.461 2 1 513 . 1 1 A 96 96 LEU C C 96 175.322 175.163 0.159 2 1 514 . 1 1 A 96 96 LEU CA C 96 53.736 53.987 -0.251 2 1 515 . 1 1 A 96 96 LEU CB C 96 41.088 45.088 -4.000 2 1 519 . 1 1 A 96 96 LEU N N 96 123.224 125.343 -2.119 2 1 520 . 1 1 A 97 97 THR H H 97 9.116 8.873 0.243 2 1 521 . 1 1 A 97 97 THR C C 97 173.251 172.092 1.159 2 1 522 . 1 1 A 97 97 THR CA C 97 58.931 59.998 -1.067 2 1 523 . 1 1 A 97 97 THR CB C 97 72.984 71.584 1.400 2 1 525 . 1 1 A 97 97 THR N N 97 112.504 116.797 -4.293 2 1 526 . 1 1 A 98 98 ALA H H 98 8.603 8.701 -0.098 2 1 527 . 1 1 A 98 98 ALA C C 98 174.948 175.849 -0.901 2 1 528 . 1 1 A 98 98 ALA CA C 98 49.980 50.030 -0.050 2 1 529 . 1 1 A 98 98 ALA CB C 98 19.157 20.957 -1.800 2 1 530 . 1 1 A 98 98 ALA N N 98 121.608 124.699 -3.091 2 1 531 . 1 1 A 99 99 LYS H H 99 8.890 9.187 -0.297 2 1 532 . 1 1 A 99 99 LYS C C 99 174.294 175.268 -0.974 2 1 533 . 1 1 A 99 99 LYS CA C 99 54.019 54.754 -0.735 2 1 534 . 1 1 A 99 99 LYS CB C 99 33.018 35.267 -2.249 2 1 538 . 1 1 A 99 99 LYS N N 99 124.522 122.460 2.062 2 1 539 . 1 1 A 100 100 LEU H H 100 8.985 8.896 0.089 2 1 546 . 1 1 A 100 100 LEU C C 100 175.265 175.428 -0.163 2 1 547 . 1 1 A 100 100 LEU CA C 100 52.698 53.153 -0.455 2 1 548 . 1 1 A 100 100 LEU CB C 100 42.889 44.643 -1.754 2 1 552 . 1 1 A 100 100 LEU N N 100 131.876 122.703 9.173 2 1 553 . 1 1 A 101 101 GLY H H 101 9.137 8.405 0.732 2 1 554 . 1 1 A 101 101 GLY C C 101 170.798 171.652 -0.854 2 1 555 . 1 1 A 101 101 GLY CA C 101 44.429 45.327 -0.898 2 1 556 . 1 1 A 101 101 GLY N N 101 111.928 108.135 3.793 2 1 557 . 1 1 A 102 102 TYR H H 102 8.779 8.555 0.224 2 1 558 . 1 1 A 102 102 TYR C C 102 173.402 173.361 0.041 2 1 559 . 1 1 A 102 102 TYR CA C 102 54.444 56.318 -1.874 2 1 560 . 1 1 A 102 102 TYR CB C 102 42.239 41.637 0.602 2 1 561 . 1 1 A 102 102 TYR N N 102 116.664 118.813 -2.149 2 1 562 . 1 1 A 103 103 PRO C C 103 175.676 176.221 -0.545 2 1 563 . 1 1 A 103 103 PRO CA C 103 61.462 62.537 -1.075 2 1 564 . 1 1 A 103 103 PRO CB C 103 30.073 33.340 -3.267 2 1 565 . 1 1 A 104 104 ILE H H 104 8.670 9.041 -0.371 2 1 569 . 1 1 A 104 104 ILE C C 104 176.646 176.692 -0.046 2 1 570 . 1 1 A 104 104 ILE CA C 104 62.054 61.826 0.228 2 1 571 . 1 1 A 104 104 ILE CB C 104 37.678 39.668 -1.990 2 1 574 . 1 1 A 104 104 ILE N N 104 125.939 120.318 5.621 2 1 575 . 1 1 A 105 105 THR H H 105 8.129 7.974 0.155 2 1 576 . 1 1 A 105 105 THR C C 105 174.344 174.225 0.119 2 1 577 . 1 1 A 105 105 THR CA C 105 59.176 62.697 -3.521 2 1 578 . 1 1 A 105 105 THR CB C 105 71.049 69.942 1.107 2 1 580 . 1 1 A 105 105 THR N N 105 109.853 112.363 -2.510 2 1 581 . 1 1 A 106 106 ASP H H 106 8.424 8.113 0.311 2 1 582 . 1 1 A 106 106 ASP C C 106 175.692 175.756 -0.064 2 1 583 . 1 1 A 106 106 ASP CA C 106 56.465 54.951 1.514 2 1 584 . 1 1 A 106 106 ASP CB C 106 40.032 42.000 -1.968 2 1 585 . 1 1 A 106 106 ASP N N 106 117.156 119.079 -1.923 2 1 586 . 1 1 A 107 107 ASP H H 107 8.124 8.402 -0.278 2 1 587 . 1 1 A 107 107 ASP C C 107 174.174 174.760 -0.586 2 1 588 . 1 1 A 107 107 ASP CA C 107 52.907 54.184 -1.277 2 1 589 . 1 1 A 107 107 ASP CB C 107 41.661 41.796 -0.135 2 1 590 . 1 1 A 107 107 ASP N N 107 113.591 117.458 -3.867 2 1 591 . 1 1 A 108 108 LEU H H 108 7.336 7.606 -0.270 2 1 598 . 1 1 A 108 108 LEU C C 108 174.321 175.107 -0.786 2 1 599 . 1 1 A 108 108 LEU CA C 108 54.449 53.665 0.784 2 1 600 . 1 1 A 108 108 LEU CB C 108 44.754 44.550 0.204 2 1 604 . 1 1 A 108 108 LEU N N 108 123.244 119.822 3.422 2 1 605 . 1 1 A 109 109 ASP H H 109 8.943 9.023 -0.080 2 1 606 . 1 1 A 109 109 ASP C C 109 176.248 174.693 1.555 2 1 607 . 1 1 A 109 109 ASP CA C 109 52.376 52.558 -0.182 2 1 608 . 1 1 A 109 109 ASP CB C 109 42.764 44.901 -2.137 2 1 609 . 1 1 A 109 109 ASP N N 109 124.634 122.933 1.701 2 1 610 . 1 1 A 110 110 ILE H H 110 8.372 8.758 -0.386 2 1 614 . 1 1 A 110 110 ILE C C 110 173.735 174.227 -0.492 2 1 615 . 1 1 A 110 110 ILE CA C 110 59.129 59.118 0.011 2 1 616 . 1 1 A 110 110 ILE CB C 110 39.402 40.797 -1.395 2 1 620 . 1 1 A 110 110 ILE N N 110 119.135 117.775 1.360 2 1 621 . 1 1 A 111 111 TYR H H 111 8.695 8.812 -0.117 2 1 622 . 1 1 A 111 111 TYR C C 111 172.838 173.660 -0.822 2 1 623 . 1 1 A 111 111 TYR CA C 111 56.182 56.207 -0.025 2 1 624 . 1 1 A 111 111 TYR CB C 111 41.489 42.188 -0.699 2 1 625 . 1 1 A 111 111 TYR N N 111 121.248 121.251 -0.003 2 1 626 . 1 1 A 112 112 THR H H 112 9.172 8.902 0.270 2 1 627 . 1 1 A 112 112 THR C C 112 173.850 173.258 0.592 2 1 628 . 1 1 A 112 112 THR CA C 112 58.246 60.482 -2.236 2 1 629 . 1 1 A 112 112 THR CB C 112 71.676 71.678 -0.002 2 1 631 . 1 1 A 112 112 THR N N 112 110.671 114.265 -3.594 2 1 632 . 1 1 A 113 113 ARG H H 113 8.732 9.505 -0.773 2 1 633 . 1 1 A 113 113 ARG C C 113 175.037 174.475 0.562 2 1 634 . 1 1 A 113 113 ARG CA C 113 53.995 54.627 -0.632 2 1 635 . 1 1 A 113 113 ARG CB C 113 32.266 33.007 -0.741 2 1 638 . 1 1 A 113 113 ARG N N 113 120.642 124.272 -3.630 2 1 639 . 1 1 A 114 114 LEU H H 114 8.449 8.951 -0.502 2 1 646 . 1 1 A 114 114 LEU C C 114 175.812 175.762 0.050 2 1 647 . 1 1 A 114 114 LEU CA C 114 53.335 53.764 -0.429 2 1 648 . 1 1 A 114 114 LEU CB C 114 45.182 45.226 -0.044 2 1 652 . 1 1 A 114 114 LEU N N 114 119.078 124.781 -5.703 2 1 653 . 1 1 A 115 115 GLY H H 115 8.232 8.501 -0.269 2 1 654 . 1 1 A 115 115 GLY C C 115 171.343 172.395 -1.052 2 1 655 . 1 1 A 115 115 GLY CA C 115 46.217 46.122 0.095 2 1 656 . 1 1 A 115 115 GLY N N 115 108.966 112.405 -3.439 2 1 657 . 1 1 A 116 116 GLY H H 116 8.293 8.387 -0.094 2 1 658 . 1 1 A 116 116 GLY C C 116 169.856 172.363 -2.507 2 1 659 . 1 1 A 116 116 GLY CA C 116 44.084 45.146 -1.062 2 1 660 . 1 1 A 116 116 GLY N N 116 109.676 110.744 -1.068 2 1 661 . 1 1 A 117 117 MET H H 117 9.286 9.197 0.089 2 1 662 . 1 1 A 117 117 MET C C 117 174.557 174.897 -0.340 2 1 663 . 1 1 A 117 117 MET CA C 117 53.258 53.684 -0.426 2 1 664 . 1 1 A 117 117 MET CB C 117 37.195 35.493 1.702 2 1 667 . 1 1 A 117 117 MET N N 117 120.425 117.973 2.452 2 1 668 . 1 1 A 118 118 VAL H H 118 9.062 9.085 -0.023 2 1 675 . 1 1 A 118 118 VAL C C 118 173.993 174.846 -0.853 2 1 676 . 1 1 A 118 118 VAL CA C 118 59.883 60.939 -1.056 2 1 677 . 1 1 A 118 118 VAL CB C 118 31.782 34.657 -2.875 2 1 680 . 1 1 A 118 118 VAL N N 118 126.948 121.561 5.387 2 1 681 . 1 1 A 119 119 TRP H H 119 8.482 9.316 -0.834 2 1 682 . 1 1 A 119 119 TRP C C 119 174.608 174.125 0.483 2 1 683 . 1 1 A 119 119 TRP CA C 119 53.332 55.296 -1.964 2 1 684 . 1 1 A 119 119 TRP CB C 119 33.569 32.893 0.676 2 1 685 . 1 1 A 119 119 TRP N N 119 124.631 127.051 -2.420 2 1 686 . 1 1 A 120 120 ARG H H 120 9.113 8.806 0.307 2 1 687 . 1 1 A 120 120 ARG C C 120 174.951 174.679 0.272 2 1 688 . 1 1 A 120 120 ARG CA C 120 54.684 54.382 0.302 2 1 689 . 1 1 A 120 120 ARG CB C 120 33.424 33.527 -0.103 2 1 690 . 1 1 A 120 120 ARG N N 120 117.899 122.651 -4.752 2 1 691 . 1 1 A 121 121 ALA H H 121 9.299 8.645 0.654 2 1 692 . 1 1 A 121 121 ALA C C 121 175.954 175.414 0.540 2 1 693 . 1 1 A 121 121 ALA CA C 121 50.368 50.578 -0.210 2 1 694 . 1 1 A 121 121 ALA CB C 121 21.141 22.198 -1.057 2 1 695 . 1 1 A 121 121 ALA N N 121 128.863 124.597 4.266 2 1 696 . 1 1 A 122 122 ASP H H 122 8.488 8.708 -0.220 2 1 697 . 1 1 A 122 122 ASP C C 122 175.635 174.722 0.913 2 1 698 . 1 1 A 122 122 ASP CA C 122 53.891 53.140 0.751 2 1 699 . 1 1 A 122 122 ASP CB C 122 42.492 44.191 -1.699 2 1 700 . 1 1 A 122 122 ASP N N 122 121.721 121.064 0.657 2 1 701 . 1 1 A 123 123 SER H H 123 8.466 8.736 -0.271 2 1 702 . 1 1 A 123 123 SER C C 123 174.325 173.685 0.640 2 1 703 . 1 1 A 123 123 SER CA C 123 57.325 57.572 -0.247 2 1 704 . 1 1 A 123 123 SER CB C 123 63.988 64.381 -0.393 2 1 705 . 1 1 A 123 123 SER N N 123 117.374 118.862 -1.488 2 1 706 . 1 1 A 124 124 LYS H H 124 8.389 8.347 0.042 2 1 707 . 1 1 A 124 124 LYS C C 124 176.840 176.005 0.835 2 1 708 . 1 1 A 124 124 LYS CA C 124 56.036 55.488 0.548 2 1 709 . 1 1 A 124 124 LYS CB C 124 32.397 34.172 -1.775 2 1 711 . 1 1 A 124 124 LYS N N 124 122.883 123.407 -0.524 2 1 712 . 1 1 A 125 125 GLY H H 125 8.281 8.429 -0.148 2 1 713 . 1 1 A 125 125 GLY C C 125 173.592 173.404 0.188 2 1 714 . 1 1 A 125 125 GLY CA C 125 44.924 45.660 -0.736 2 1 715 . 1 1 A 125 125 GLY N N 125 109.541 110.559 -1.018 2 1 716 . 1 1 A 126 126 ASN H H 126 8.185 8.517 -0.332 2 1 717 . 1 1 A 126 126 ASN C C 126 176.649 174.559 2.090 2 1 718 . 1 1 A 126 126 ASN CA C 126 52.763 52.955 -0.191 2 1 719 . 1 1 A 126 126 ASN CB C 126 38.439 39.223 -0.784 2 1 720 . 1 1 A 126 126 ASN N N 126 119.019 119.629 -0.610 2 1 721 . 1 1 A 127 127 TYR C C 127 176.913 175.195 1.718 2 1 722 . 1 1 A 127 127 TYR CA C 127 57.757 58.416 -0.659 2 1 723 . 1 1 A 127 127 TYR CB C 127 37.703 39.920 -2.217 2 1 724 . 1 1 A 128 128 ALA H H 128 8.050 8.353 -0.303 2 1 728 . 1 1 A 128 128 ALA C C 128 177.756 176.623 1.133 2 1 729 . 1 1 A 128 128 ALA CA C 128 52.321 51.547 0.774 2 1 730 . 1 1 A 128 128 ALA CB C 128 18.273 20.910 -2.637 2 1 731 . 1 1 A 128 128 ALA N N 128 124.529 124.542 -0.013 2 1 732 . 1 1 A 129 129 SER H H 129 8.063 8.605 -0.542 2 1 733 . 1 1 A 129 129 SER C C 129 174.938 174.013 0.925 2 1 734 . 1 1 A 129 129 SER CA C 129 58.202 58.517 -0.315 2 1 735 . 1 1 A 129 129 SER CB C 129 62.974 64.713 -1.739 2 1 736 . 1 1 A 129 129 SER N N 129 114.374 115.369 -0.995 2 1 737 . 1 1 A 130 130 THR H H 130 7.875 8.283 -0.408 2 1 741 . 1 1 A 130 130 THR C C 130 175.198 174.597 0.601 2 1 742 . 1 1 A 130 130 THR CA C 130 61.520 61.977 -0.457 2 1 743 . 1 1 A 130 130 THR CB C 130 69.312 69.999 -0.687 2 1 745 . 1 1 A 130 130 THR N N 130 113.608 115.386 -1.778 2 1 746 . 1 1 A 131 131 GLY H H 131 8.219 8.008 0.211 2 1 747 . 1 1 A 131 131 GLY C C 131 173.979 173.685 0.294 2 1 748 . 1 1 A 131 131 GLY CA C 131 44.991 45.440 -0.449 2 1 749 . 1 1 A 131 131 GLY N N 131 110.848 110.035 0.813 2 1 750 . 1 1 A 132 132 VAL H H 132 7.729 8.298 -0.569 2 1 757 . 1 1 A 132 132 VAL C C 132 175.988 175.441 0.547 2 1 758 . 1 1 A 132 132 VAL CA C 132 61.643 61.220 0.423 2 1 759 . 1 1 A 132 132 VAL CB C 132 31.941 33.691 -1.750 2 1 762 . 1 1 A 132 132 VAL N N 132 118.932 119.894 -0.962 2 1 763 . 1 1 A 133 133 SER H H 133 8.224 8.469 -0.245 2 1 764 . 1 1 A 133 133 SER C C 133 174.320 174.034 0.286 2 1 765 . 1 1 A 133 133 SER CA C 133 57.756 58.199 -0.443 2 1 766 . 1 1 A 133 133 SER CB C 133 63.140 64.672 -1.532 2 1 767 . 1 1 A 133 133 SER N N 133 119.260 119.039 0.221 2 1 768 . 1 1 A 134 134 ARG H H 134 8.199 8.275 -0.076 2 1 769 . 1 1 A 134 134 ARG C C 134 175.923 175.685 0.238 2 1 770 . 1 1 A 134 134 ARG CA C 134 55.461 55.877 -0.416 2 1 771 . 1 1 A 134 134 ARG CB C 134 30.195 31.646 -1.451 2 1 774 . 1 1 A 134 134 ARG N N 134 123.262 122.442 0.820 2 1 775 . 1 1 A 135 135 SER H H 135 8.256 8.490 -0.234 2 1 776 . 1 1 A 135 135 SER C C 135 174.360 173.664 0.696 2 1 777 . 1 1 A 135 135 SER CA C 135 57.730 57.904 -0.174 2 1 778 . 1 1 A 135 135 SER CB C 135 63.275 64.326 -1.051 2 1 779 . 1 1 A 135 135 SER N N 135 117.155 117.709 -0.554 2 1 780 . 1 1 A 136 136 GLU H H 136 8.374 8.337 0.037 2 1 781 . 1 1 A 136 136 GLU C C 136 176.284 175.393 0.891 2 1 782 . 1 1 A 136 136 GLU CA C 136 56.082 55.481 0.601 2 1 783 . 1 1 A 136 136 GLU CB C 136 29.820 31.510 -1.690 2 1 785 . 1 1 A 136 136 GLU N N 136 122.812 123.170 -0.358 2 1 786 . 1 1 A 137 137 HIS H H 137 8.118 8.675 -0.557 2 1 787 . 1 1 A 137 137 HIS C C 137 173.529 173.935 -0.406 2 1 788 . 1 1 A 137 137 HIS CA C 137 54.793 55.027 -0.234 2 1 789 . 1 1 A 137 137 HIS CB C 137 30.191 31.831 -1.640 2 1 790 . 1 1 A 137 137 HIS N N 137 118.002 121.272 -3.270 2 1 791 . 1 1 A 138 138 ASP H H 138 8.572 8.845 -0.273 2 1 792 . 1 1 A 138 138 ASP C C 138 174.940 175.050 -0.110 2 1 793 . 1 1 A 138 138 ASP CA C 138 53.594 53.223 0.371 2 1 794 . 1 1 A 138 138 ASP CB C 138 42.165 43.726 -1.561 2 1 795 . 1 1 A 138 138 ASP N N 138 121.536 122.729 -1.193 2 1 796 . 1 1 A 139 139 THR H H 139 7.857 8.769 -0.912 2 1 797 . 1 1 A 139 139 THR C C 139 172.822 173.195 -0.373 2 1 798 . 1 1 A 139 139 THR CA C 139 59.197 60.120 -0.923 2 1 799 . 1 1 A 139 139 THR CB C 139 71.457 71.529 -0.072 2 1 801 . 1 1 A 139 139 THR N N 139 113.598 114.953 -1.355 2 1 802 . 1 1 A 140 140 GLY C C 140 169.622 171.904 -2.282 2 1 803 . 1 1 A 140 140 GLY CA C 140 44.287 44.523 -0.236 2 1 804 . 1 1 A 141 141 VAL H H 141 7.815 8.743 -0.928 2 1 811 . 1 1 A 141 141 VAL C C 141 176.038 173.704 2.334 2 1 812 . 1 1 A 141 141 VAL CA C 141 59.739 59.828 -0.089 2 1 813 . 1 1 A 141 141 VAL CB C 141 33.308 35.096 -1.788 2 1 816 . 1 1 A 141 141 VAL N N 141 116.224 123.405 -7.181 2 1 817 . 1 1 A 142 142 SER H H 142 9.284 8.902 0.382 2 1 818 . 1 1 A 142 142 SER C C 142 171.050 172.100 -1.050 2 1 819 . 1 1 A 142 142 SER CB C 142 67.608 66.367 1.241 2 1 820 . 1 1 A 142 142 SER N N 142 123.223 122.074 1.149 2 1 821 . 1 1 A 143 143 PRO C C 143 174.032 176.243 -2.211 2 1 822 . 1 1 A 143 143 PRO CA C 143 62.350 62.579 -0.229 2 1 823 . 1 1 A 143 143 PRO CB C 143 31.774 32.557 -0.783 2 1 825 . 1 1 A 144 144 VAL H H 144 7.785 8.701 -0.916 2 1 832 . 1 1 A 144 144 VAL C C 144 172.826 174.218 -1.392 2 1 833 . 1 1 A 144 144 VAL CA C 144 59.770 59.803 -0.033 2 1 834 . 1 1 A 144 144 VAL CB C 144 34.407 36.019 -1.612 2 1 837 . 1 1 A 144 144 VAL N N 144 120.214 116.915 3.299 2 1 838 . 1 1 A 145 145 PHE H H 145 8.623 8.660 -0.037 2 1 839 . 1 1 A 145 145 PHE C C 145 173.658 172.863 0.795 2 1 840 . 1 1 A 145 145 PHE CA C 145 54.942 56.119 -1.177 2 1 841 . 1 1 A 145 145 PHE CB C 145 42.692 42.339 0.353 2 1 842 . 1 1 A 145 145 PHE N N 145 123.914 120.212 3.702 2 1 843 . 1 1 A 146 146 ALA H H 146 8.886 8.870 0.016 2 1 844 . 1 1 A 146 146 ALA C C 146 176.258 176.076 0.182 2 1 845 . 1 1 A 146 146 ALA CA C 146 49.734 50.252 -0.518 2 1 846 . 1 1 A 146 146 ALA CB C 146 22.244 22.327 -0.083 2 1 847 . 1 1 A 146 146 ALA N N 146 125.243 125.386 -0.143 2 1 848 . 1 1 A 147 147 GLY H H 147 8.470 8.589 -0.119 2 1 849 . 1 1 A 147 147 GLY C C 147 170.940 172.652 -1.712 2 1 850 . 1 1 A 147 147 GLY CA C 147 44.063 44.492 -0.429 2 1 851 . 1 1 A 147 147 GLY N N 147 106.669 107.918 -1.248 2 1 852 . 1 1 A 148 148 GLY H H 148 8.008 8.351 -0.343 2 1 853 . 1 1 A 148 148 GLY C C 148 170.181 172.306 -2.125 2 1 854 . 1 1 A 148 148 GLY CA C 148 45.736 45.641 0.095 2 1 855 . 1 1 A 148 148 GLY N N 148 109.475 109.587 -0.112 2 1 856 . 1 1 A 149 149 VAL H H 149 8.426 8.367 0.059 2 1 863 . 1 1 A 149 149 VAL C C 149 174.157 173.539 0.618 2 1 864 . 1 1 A 149 149 VAL CA C 149 58.200 58.850 -0.650 2 1 865 . 1 1 A 149 149 VAL CB C 149 34.464 35.862 -1.398 2 1 868 . 1 1 A 149 149 VAL N N 149 112.651 117.239 -4.588 2 1 869 . 1 1 A 150 150 GLU H H 150 9.070 9.226 -0.156 2 1 870 . 1 1 A 150 150 GLU C C 150 173.892 174.542 -0.650 2 1 871 . 1 1 A 150 150 GLU CA C 150 54.617 54.835 -0.218 2 1 872 . 1 1 A 150 150 GLU CB C 150 32.911 33.564 -0.653 2 1 874 . 1 1 A 150 150 GLU N N 150 124.471 120.805 3.666 2 1 875 . 1 1 A 151 151 TRP H H 151 9.461 9.386 0.075 2 1 877 . 1 1 A 151 151 TRP C C 151 174.370 174.971 -0.601 2 1 878 . 1 1 A 151 151 TRP CA C 151 54.113 55.685 -1.572 2 1 879 . 1 1 A 151 151 TRP CB C 151 31.688 32.655 -0.967 2 1 880 . 1 1 A 151 151 TRP N N 151 129.611 126.374 3.237 2 1 882 . 1 1 A 152 152 ALA H H 152 8.771 8.777 -0.006 2 1 883 . 1 1 A 152 152 ALA C C 152 175.079 176.796 -1.717 2 1 884 . 1 1 A 152 152 ALA CA C 152 51.417 51.445 -0.028 2 1 885 . 1 1 A 152 152 ALA CB C 152 17.209 19.796 -2.587 2 1 886 . 1 1 A 152 152 ALA N N 152 130.502 128.439 2.063 2 1 887 . 1 1 A 153 153 VAL H H 153 7.893 8.657 -0.764 2 1 894 . 1 1 A 153 153 VAL C C 153 176.612 176.274 0.338 2 1 895 . 1 1 A 153 153 VAL CA C 153 63.600 63.433 0.167 2 1 896 . 1 1 A 153 153 VAL CB C 153 31.280 32.479 -1.199 2 1 899 . 1 1 A 153 153 VAL N N 153 124.360 123.130 1.230 2 1 900 . 1 1 A 154 154 THR H H 154 7.950 7.825 0.125 2 1 904 . 1 1 A 154 154 THR C C 154 173.884 174.734 -0.850 2 1 905 . 1 1 A 154 154 THR CA C 154 58.655 61.845 -3.190 2 1 906 . 1 1 A 154 154 THR CB C 154 71.262 69.652 1.610 2 1 908 . 1 1 A 154 154 THR N N 154 109.176 113.498 -4.322 2 1 909 . 1 1 A 155 155 ARG H H 155 8.310 8.568 -0.258 2 1 910 . 1 1 A 155 155 ARG C C 155 176.753 176.173 0.580 2 1 911 . 1 1 A 155 155 ARG CA C 155 58.456 57.277 1.179 2 1 912 . 1 1 A 155 155 ARG CB C 155 29.043 30.704 -1.661 2 1 915 . 1 1 A 155 155 ARG N N 155 116.576 122.322 -5.746 2 1 916 . 1 1 A 156 156 ASP H H 156 7.783 8.384 -0.601 2 1 917 . 1 1 A 156 156 ASP C C 156 174.222 175.013 -0.791 2 1 918 . 1 1 A 156 156 ASP CA C 156 53.540 54.435 -0.895 2 1 919 . 1 1 A 156 156 ASP CB C 156 42.327 41.771 0.556 2 1 920 . 1 1 A 156 156 ASP N N 156 112.950 117.524 -4.574 2 1 921 . 1 1 A 157 157 ILE H H 157 7.233 7.547 -0.314 2 1 925 . 1 1 A 157 157 ILE C C 157 174.178 174.793 -0.615 2 1 926 . 1 1 A 157 157 ILE CA C 157 59.350 60.492 -1.142 2 1 927 . 1 1 A 157 157 ILE CB C 157 38.969 40.331 -1.362 2 1 930 . 1 1 A 157 157 ILE N N 157 119.732 119.593 0.139 2 1 931 . 1 1 A 158 158 ALA H H 158 8.729 9.092 -0.363 2 1 932 . 1 1 A 158 158 ALA C C 158 176.567 175.625 0.942 2 1 933 . 1 1 A 158 158 ALA CA C 158 49.418 50.297 -0.879 2 1 934 . 1 1 A 158 158 ALA CB C 158 21.430 23.524 -2.094 2 1 935 . 1 1 A 158 158 ALA N N 158 128.564 129.340 -0.776 2 1 936 . 1 1 A 159 159 THR H H 159 8.972 8.968 0.004 2 1 940 . 1 1 A 159 159 THR C C 159 172.213 173.390 -1.177 2 1 941 . 1 1 A 159 159 THR CA C 159 59.504 60.506 -1.002 2 1 942 . 1 1 A 159 159 THR CB C 159 70.728 71.550 -0.822 2 1 944 . 1 1 A 159 159 THR N N 159 114.901 113.442 1.459 2 1 945 . 1 1 A 160 160 ARG H H 160 8.924 9.310 -0.386 2 1 946 . 1 1 A 160 160 ARG C C 160 174.097 173.912 0.185 2 1 947 . 1 1 A 160 160 ARG CA C 160 53.066 54.383 -1.317 2 1 948 . 1 1 A 160 160 ARG CB C 160 32.922 33.871 -0.949 2 1 951 . 1 1 A 160 160 ARG N N 160 121.507 124.233 -2.726 2 1 952 . 1 1 A 161 161 LEU H H 161 8.611 9.056 -0.445 2 1 959 . 1 1 A 161 161 LEU C C 161 174.389 174.770 -0.381 2 1 960 . 1 1 A 161 161 LEU CA C 161 53.355 53.520 -0.165 2 1 961 . 1 1 A 161 161 LEU CB C 161 44.360 45.527 -1.167 2 1 964 . 1 1 A 161 161 LEU N N 161 124.711 124.702 0.009 2 1 965 . 1 1 A 162 162 GLU H H 162 8.746 8.872 -0.126 2 1 966 . 1 1 A 162 162 GLU C C 162 173.376 175.007 -1.631 2 1 967 . 1 1 A 162 162 GLU CA C 162 53.904 54.698 -0.794 2 1 968 . 1 1 A 162 162 GLU CB C 162 33.773 32.924 0.849 2 1 970 . 1 1 A 162 162 GLU N N 162 122.300 125.955 -3.655 2 1 971 . 1 1 A 163 163 TYR H H 163 8.872 8.970 -0.098 2 1 972 . 1 1 A 163 163 TYR C C 163 173.425 174.602 -1.177 2 1 973 . 1 1 A 163 163 TYR CA C 163 56.192 56.050 0.142 2 1 974 . 1 1 A 163 163 TYR CB C 163 40.870 42.147 -1.277 2 1 975 . 1 1 A 163 163 TYR N N 163 124.618 121.120 3.498 2 1 976 . 1 1 A 171 171 ASP C C 171 175.753 175.599 0.154 2 1 977 . 1 1 A 171 171 ASP CA C 171 53.517 53.798 -0.281 2 1 978 . 1 1 A 171 171 ASP CB C 171 41.353 42.771 -1.418 2 1 979 . 1 1 A 172 172 ALA H H 172 8.336 8.190 0.146 2 1 983 . 1 1 A 172 172 ALA C C 172 178.110 177.142 0.968 2 1 984 . 1 1 A 172 172 ALA CA C 172 52.190 51.980 0.211 2 1 985 . 1 1 A 172 172 ALA CB C 172 18.305 20.866 -2.561 2 1 986 . 1 1 A 172 172 ALA N N 172 125.294 122.726 2.568 2 1 987 . 1 1 A 173 173 GLY H H 173 8.300 8.257 0.043 2 1 988 . 1 1 A 173 173 GLY C C 173 174.437 173.742 0.695 2 1 989 . 1 1 A 173 173 GLY CA C 173 45.083 45.516 -0.433 2 1 990 . 1 1 A 173 173 GLY N N 173 107.268 107.714 -0.446 2 1 991 . 1 1 A 174 174 THR H H 174 7.754 8.261 -0.507 2 1 992 . 1 1 A 174 174 THR C C 174 174.738 174.006 0.732 2 1 993 . 1 1 A 174 174 THR CA C 174 61.310 62.216 -0.906 2 1 994 . 1 1 A 174 174 THR CB C 174 69.310 70.167 -0.857 2 1 996 . 1 1 A 174 174 THR N N 174 113.472 114.242 -0.770 2 1 997 . 1 1 A 175 175 VAL H H 175 7.993 8.146 -0.153 2 1 1004 . 1 1 A 175 175 VAL C C 175 176.535 175.292 1.242 2 1 1005 . 1 1 A 175 175 VAL CA C 175 62.126 61.005 1.121 2 1 1006 . 1 1 A 175 175 VAL CB C 175 31.282 34.037 -2.755 2 1 1009 . 1 1 A 175 175 VAL N N 175 121.643 120.103 1.540 2 1 1010 . 1 1 A 176 176 GLY H H 176 8.056 8.360 -0.304 2 1 1011 . 1 1 A 176 176 GLY C C 176 173.930 173.519 0.411 2 1 1012 . 1 1 A 176 176 GLY CA C 176 44.983 45.467 -0.484 2 1 1013 . 1 1 A 176 176 GLY N N 176 110.460 111.437 -0.977 2 1 1014 . 1 1 A 177 177 THR H H 177 7.520 8.226 -0.706 2 1 1015 . 1 1 A 177 177 THR C C 177 173.574 174.272 -0.697 2 1 1016 . 1 1 A 177 177 THR CA C 177 60.609 61.775 -1.166 2 1 1017 . 1 1 A 177 177 THR CB C 177 69.506 70.395 -0.889 2 1 1019 . 1 1 A 177 177 THR N N 177 113.390 114.043 -0.653 2 1 1020 . 1 1 A 178 178 ARG H H 178 8.261 8.330 -0.069 2 1 1021 . 1 1 A 178 178 ARG C C 178 173.932 175.186 -1.254 2 1 1022 . 1 1 A 178 178 ARG CA C 178 53.683 56.458 -2.775 2 1 1023 . 1 1 A 178 178 ARG CB C 178 29.224 30.303 -1.079 2 1 1026 . 1 1 A 178 178 ARG N N 178 123.906 123.011 0.895 2 1 1027 . 1 1 A 183 183 MET C C 183 174.053 174.544 -0.491 2 1 1028 . 1 1 A 183 183 MET CA C 183 53.700 54.505 -0.805 2 1 1029 . 1 1 A 183 183 MET CB C 183 35.908 35.380 0.528 2 1 1032 . 1 1 A 184 184 LEU H H 184 8.319 8.902 -0.583 2 1 1033 . 1 1 A 184 184 LEU C C 184 175.235 175.410 -0.175 2 1 1034 . 1 1 A 184 184 LEU CA C 184 53.120 53.521 -0.401 2 1 1035 . 1 1 A 184 184 LEU CB C 184 42.857 44.860 -2.003 2 1 1038 . 1 1 A 184 184 LEU N N 184 131.293 126.400 4.893 2 1 1039 . 1 1 A 185 185 SER H H 185 9.603 8.903 0.700 2 1 1040 . 1 1 A 185 185 SER C C 185 171.293 173.012 -1.720 2 1 1041 . 1 1 A 185 185 SER CA C 185 56.504 56.984 -0.480 2 1 1042 . 1 1 A 185 185 SER CB C 185 66.585 66.373 0.212 2 1 1043 . 1 1 A 185 185 SER N N 185 119.338 119.002 0.336 2 1 1044 . 1 1 A 186 186 LEU H H 186 8.583 8.609 -0.026 2 1 1051 . 1 1 A 186 186 LEU C C 186 175.328 176.365 -1.037 2 1 1052 . 1 1 A 186 186 LEU CA C 186 52.729 53.100 -0.371 2 1 1053 . 1 1 A 186 186 LEU CB C 186 44.996 45.155 -0.159 2 1 1056 . 1 1 A 186 186 LEU N N 186 122.719 123.771 -1.052 2 1 1057 . 1 1 A 187 187 GLY H H 187 9.287 8.441 0.846 2 1 1058 . 1 1 A 187 187 GLY C C 187 172.315 173.234 -0.919 2 1 1059 . 1 1 A 187 187 GLY CA C 187 43.502 45.231 -1.729 2 1 1060 . 1 1 A 187 187 GLY N N 187 110.265 110.171 0.094 2 1 1061 . 1 1 A 188 188 VAL H H 188 8.825 8.620 0.205 2 1 1068 . 1 1 A 188 188 VAL C C 188 173.125 174.648 -1.523 2 1 1069 . 1 1 A 188 188 VAL CA C 188 59.739 59.335 0.404 2 1 1070 . 1 1 A 188 188 VAL CB C 188 34.532 34.994 -0.462 2 1 1073 . 1 1 A 188 188 VAL N N 188 119.161 116.543 2.618 2 1 1074 . 1 1 A 189 189 SER H H 189 9.051 8.958 0.093 2 1 1075 . 1 1 A 189 189 SER C C 189 171.698 172.807 -1.109 2 1 1076 . 1 1 A 189 189 SER CA C 189 55.997 56.996 -0.999 2 1 1077 . 1 1 A 189 189 SER CB C 189 66.094 67.028 -0.934 2 1 1078 . 1 1 A 189 189 SER N N 189 117.810 118.713 -0.903 2 1 1079 . 1 1 A 190 190 TYR H H 190 9.145 9.082 0.063 2 1 1080 . 1 1 A 190 190 TYR C C 190 174.063 173.431 0.632 2 1 1081 . 1 1 A 190 190 TYR CA C 190 55.375 55.939 -0.564 2 1 1082 . 1 1 A 190 190 TYR CB C 190 41.183 41.982 -0.799 2 1 1083 . 1 1 A 190 190 TYR N N 190 123.690 118.974 4.716 2 1 1084 . 1 1 A 191 191 ARG H H 191 8.211 8.608 -0.397 2 1 1085 . 1 1 A 191 191 ARG C C 191 174.826 175.203 -0.377 2 1 1086 . 1 1 A 191 191 ARG CA C 191 54.464 54.752 -0.288 2 1 1087 . 1 1 A 191 191 ARG CB C 191 30.507 32.382 -1.875 2 1 1090 . 1 1 A 191 191 ARG N N 191 125.366 120.506 4.860 2 1 1091 . 1 1 A 192 192 PHE H H 192 8.496 8.975 -0.479 2 1 1092 . 1 1 A 192 192 PHE C C 192 176.384 175.024 1.360 2 1 1093 . 1 1 A 192 192 PHE CA C 192 57.179 56.811 0.368 2 1 1094 . 1 1 A 192 192 PHE CB C 192 39.430 40.799 -1.369 2 1 1095 . 1 1 A 192 192 PHE N N 192 121.586 122.226 -0.640 2 1 1096 . 1 1 A 193 193 GLY H H 193 8.643 8.470 0.172 2 1 1097 . 1 1 A 193 193 GLY C C 193 174.466 172.704 1.761 2 1 1098 . 1 1 A 193 193 GLY CA C 193 45.126 44.667 0.459 2 1 1099 . 1 1 A 193 193 GLY N N 193 109.499 111.102 -1.603 2 1 1100 . 1 1 A 194 194 GLN H H 194 8.512 8.569 -0.057 2 1 1101 . 1 1 A 194 194 GLN C C 194 176.201 175.200 1.001 2 1 1102 . 1 1 A 194 194 GLN CA C 194 55.433 55.256 0.177 2 1 1103 . 1 1 A 194 194 GLN CB C 194 28.729 30.406 -1.677 2 1 1105 . 1 1 A 194 194 GLN N N 194 119.448 120.238 -0.790 2 1 1106 . 1 1 A 195 195 GLU H H 195 8.530 8.596 -0.066 2 1 1107 . 1 1 A 195 195 GLU C C 195 176.151 175.759 0.392 2 1 1108 . 1 1 A 195 195 GLU CA C 195 56.256 56.147 0.110 2 1 1109 . 1 1 A 195 195 GLU CB C 195 29.486 31.321 -1.835 2 1 1111 . 1 1 A 195 195 GLU N N 195 121.959 123.410 -1.451 2 1 1112 . 1 1 A 196 196 ASP H H 196 8.253 8.617 -0.364 2 1 1113 . 1 1 A 196 196 ASP C C 196 175.667 175.609 0.058 2 1 1114 . 1 1 A 196 196 ASP CA C 196 53.981 54.283 -0.302 2 1 1115 . 1 1 A 196 196 ASP CB C 196 40.700 42.447 -1.747 2 1 1116 . 1 1 A 196 196 ASP N N 196 121.819 121.970 -0.151 2 1 1117 . 1 1 A 197 197 ALA H H 197 7.999 8.359 -0.360 2 1 1121 . 1 1 A 197 197 ALA C C 197 176.847 176.432 0.415 2 1 1122 . 1 1 A 197 197 ALA CA C 197 51.612 51.518 0.094 2 1 1123 . 1 1 A 197 197 ALA CB C 197 18.192 20.239 -2.047 2 1 1124 . 1 1 A 197 197 ALA N N 197 124.262 123.802 0.460 2 1 1125 . 1 1 A 198 198 ALA H H 198 8.042 8.283 -0.241 2 1 1126 . 1 1 A 198 198 ALA C C 198 176.865 175.679 1.186 2 1 1127 . 1 1 A 198 198 ALA CA C 198 49.999 50.554 -0.555 2 1 1128 . 1 1 A 198 198 ALA CB C 198 17.327 19.777 -2.450 2 1 1129 . 1 1 A 198 198 ALA N N 198 124.724 123.277 1.447 2 1 1130 . 1 1 A 199 199 PRO C C 199 176.727 176.204 0.523 2 1 1131 . 1 1 A 199 199 PRO CA C 199 62.399 63.008 -0.609 2 1 1132 . 1 1 A 199 199 PRO CB C 199 30.949 31.406 -0.457 2 1 1135 . 1 1 A 200 200 VAL H H 200 8.026 8.174 -0.148 2 1 1142 . 1 1 A 200 200 VAL C C 200 176.034 175.296 0.738 2 1 1143 . 1 1 A 200 200 VAL CA C 200 61.944 61.601 0.343 2 1 1144 . 1 1 A 200 200 VAL CB C 200 31.734 33.474 -1.740 2 1 1147 . 1 1 A 200 200 VAL N N 200 120.635 119.799 0.836 2 1 1148 . 1 1 A 201 201 VAL H H 201 7.966 8.230 -0.264 2 1 1155 . 1 1 A 201 201 VAL C C 201 175.128 175.261 -0.133 2 1 1156 . 1 1 A 201 201 VAL CA C 201 61.249 61.198 0.051 2 1 1157 . 1 1 A 201 201 VAL CB C 201 31.917 32.884 -0.967 2 1 1160 . 1 1 A 201 201 VAL N N 201 124.053 121.941 2.112 2 1 1161 . 1 1 A 202 202 ALA H H 202 8.159 8.211 -0.052 2 1 1162 . 1 1 A 202 202 ALA C C 202 175.153 176.601 -1.448 2 1 1163 . 1 1 A 202 202 ALA CA C 202 49.742 51.836 -2.094 2 1 1164 . 1 1 A 202 202 ALA CB C 202 17.532 19.525 -1.993 2 1 1165 . 1 1 A 202 202 ALA N N 202 129.251 126.462 2.789 2 1 1166 . 1 1 A 203 203 PRO C C 203 176.273 176.418 -0.145 2 1 1167 . 1 1 A 203 203 PRO CA C 203 62.324 63.540 -1.216 2 1 1168 . 1 1 A 203 203 PRO CB C 203 31.042 31.881 -0.839 2 1 1170 . 1 1 A 204 204 ALA H H 204 8.137 8.216 -0.079 2 1 1171 . 1 1 A 204 204 ALA C C 204 175.697 176.119 -0.422 2 1 1172 . 1 1 A 204 204 ALA CA C 204 49.865 50.958 -1.093 2 1 1173 . 1 1 A 204 204 ALA CB C 204 17.364 19.693 -2.329 2 1 1174 . 1 1 A 204 204 ALA N N 204 125.510 122.978 2.533 2 1 1175 . 1 1 A 205 205 PRO C C 205 175.430 176.472 -1.042 2 1 1176 . 1 1 A 205 205 PRO CA C 205 62.511 62.964 -0.453 2 1 1177 . 1 1 A 205 205 PRO CB C 205 31.056 32.113 -1.057 2 1 1179 . 1 1 A 206 206 ALA H H 206 7.847 8.306 -0.459 2 1 1180 . 1 1 A 206 206 ALA C C 206 175.565 177.127 -1.562 2 1 1181 . 1 1 A 206 206 ALA CA C 206 49.487 52.279 -2.792 2 1 1182 . 1 1 A 206 206 ALA CB C 206 18.843 19.524 -0.681 2 1 1183 . 1 1 A 206 206 ALA N N 206 123.663 123.626 0.037 2 1 1184 . 1 1 A 207 207 PRO C C 207 174.397 176.289 -1.892 2 1 1185 . 1 1 A 207 207 PRO CA C 207 61.454 63.678 -2.224 2 1 1186 . 1 1 A 207 207 PRO CB C 207 31.929 31.694 0.235 2 1 1187 . 1 1 A 208 208 ALA H H 208 7.898 8.049 -0.151 2 1 1188 . 1 1 A 208 208 ALA C C 208 175.411 176.431 -1.020 2 1 1189 . 1 1 A 208 208 ALA CA C 208 49.472 50.973 -1.501 2 1 1190 . 1 1 A 208 208 ALA CB C 208 19.082 20.308 -1.226 2 1 1191 . 1 1 A 208 208 ALA N N 208 127.450 121.799 5.651 2 1 1192 . 1 1 A 209 209 PRO C C 209 176.932 177.001 -0.069 2 1 1193 . 1 1 A 209 209 PRO CA C 209 62.736 63.855 -1.119 2 1 1194 . 1 1 A 209 209 PRO CB C 209 31.012 32.068 -1.056 2 stop_ save_