data_15348_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15348
_Entry.PDB_ID 2JRZ
_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 5 . 1 1 1 A 2 2 MET HA H 2 4.534 4.308 0.226 1
1 13 . 1 1 1 A 2 2 MET C C 2 174.355 178.148 -3.793 1
1 14 . 1 1 1 A 2 2 MET CA C 2 56.247 57.682 -1.435 1
1 15 . 1 1 1 A 2 2 MET CB C 2 32.855 32.559 0.296 1
1 18 . 1 1 1 A 3 3 ASN H H 3 8.600 8.235 0.365 1
1 19 . 1 1 1 A 3 3 ASN HA H 3 4.711 4.462 0.249 1
1 24 . 1 1 1 A 3 3 ASN C C 3 173.983 177.370 -3.387 1
1 25 . 1 1 1 A 3 3 ASN CA C 3 53.650 56.607 -2.957 1
1 26 . 1 1 1 A 3 3 ASN CB C 3 38.624 39.767 -1.143 1
1 27 . 1 1 1 A 3 3 ASN N N 3 120.149 117.999 2.150 1
1 29 . 1 1 1 A 4 4 GLU H H 4 8.495 8.325 0.170 1
1 30 . 1 1 1 A 4 4 GLU HA H 4 4.235 4.031 0.204 1
1 35 . 1 1 1 A 4 4 GLU C C 4 175.752 178.826 -3.074 1
1 36 . 1 1 1 A 4 4 GLU CA C 4 58.075 59.266 -1.191 1
1 37 . 1 1 1 A 4 4 GLU CB C 4 30.125 29.174 0.951 1
1 38 . 1 1 1 A 4 4 GLU N N 4 121.543 118.391 3.152 1
1 39 . 1 1 1 A 5 5 LEU HA H 5 4.073 4.072 0.001 1
1 47 . 1 1 1 A 5 5 LEU CB C 5 41.897 42.436 -0.539 1
1 50 . 1 1 1 A 6 6 GLU H H 6 8.332 8.504 -0.172 1
1 51 . 1 1 1 A 6 6 GLU HA H 6 3.621 4.283 -0.662 1
1 52 . 1 1 1 A 6 6 GLU C C 6 176.402 177.559 -1.157 1
1 53 . 1 1 1 A 6 6 GLU CA C 6 58.461 58.530 -0.069 1
1 54 . 1 1 1 A 6 6 GLU CB C 6 29.730 29.380 0.350 1
1 55 . 1 1 1 A 6 6 GLU N N 6 121.462 119.289 2.173 1
1 56 . 1 1 1 A 7 7 ALA H H 7 8.244 7.669 0.575 1
1 57 . 1 1 1 A 7 7 ALA HA H 7 4.185 4.059 0.126 1
1 61 . 1 1 1 A 7 7 ALA C C 7 177.982 178.500 -0.518 1
1 62 . 1 1 1 A 7 7 ALA CA C 7 54.791 55.281 -0.490 1
1 63 . 1 1 1 A 7 7 ALA CB C 7 18.836 18.913 -0.077 1
1 64 . 1 1 1 A 7 7 ALA N N 7 123.078 121.599 1.479 1
1 65 . 1 1 1 A 8 8 GLN H H 8 8.274 7.780 0.494 1
1 66 . 1 1 1 A 8 8 GLN HA H 8 4.219 4.385 -0.166 1
1 73 . 1 1 1 A 8 8 GLN C C 8 176.325 175.446 0.879 1
1 74 . 1 1 1 A 8 8 GLN CA C 8 57.864 55.637 2.227 1
1 75 . 1 1 1 A 8 8 GLN CB C 8 28.768 28.734 0.034 1
1 77 . 1 1 1 A 8 8 GLN N N 8 117.452 116.482 0.970 1
1 79 . 1 1 1 A 9 9 THR H H 9 8.043 8.607 -0.564 1
1 80 . 1 1 1 A 9 9 THR HA H 9 3.998 4.679 -0.681 1
1 85 . 1 1 1 A 9 9 THR C C 9 173.904 174.724 -0.820 1
1 86 . 1 1 1 A 9 9 THR CA C 9 65.435 61.604 3.831 1
1 87 . 1 1 1 A 9 9 THR CB C 9 68.870 69.921 -1.051 1
1 89 . 1 1 1 A 9 9 THR N N 9 116.135 119.223 -3.088 1
1 90 . 1 1 1 A 10 10 ARG H H 10 8.095 8.959 -0.864 1
1 91 . 1 1 1 A 10 10 ARG HA H 10 4.040 3.941 0.099 1
1 98 . 1 1 1 A 10 10 ARG C C 10 176.583 175.541 1.042 1
1 99 . 1 1 1 A 10 10 ARG CA C 10 59.262 57.376 1.886 1
1 100 . 1 1 1 A 10 10 ARG CB C 10 29.900 27.515 2.385 1
1 101 . 1 1 1 A 10 10 ARG N N 10 121.157 123.644 -2.487 1
1 102 . 1 1 1 A 11 11 VAL H H 11 7.657 7.850 -0.193 1
1 103 . 1 1 1 A 11 11 VAL HA H 11 3.769 4.412 -0.643 1
1 111 . 1 1 1 A 11 11 VAL C C 11 176.662 177.357 -0.695 1
1 112 . 1 1 1 A 11 11 VAL CA C 11 65.914 63.493 2.421 1
1 113 . 1 1 1 A 11 11 VAL CB C 11 31.745 33.511 -1.766 1
1 114 . 1 1 1 A 11 11 VAL N N 11 118.580 118.341 0.239 1
1 115 . 1 1 1 A 12 12 LYS H H 12 7.471 8.052 -0.581 1
1 116 . 1 1 1 A 12 12 LYS HA H 12 3.366 4.293 -0.927 1
1 123 . 1 1 1 A 12 12 LYS C C 12 176.457 179.167 -2.710 1
1 124 . 1 1 1 A 12 12 LYS CA C 12 59.545 59.016 0.529 1
1 125 . 1 1 1 A 12 12 LYS CB C 12 32.206 32.802 -0.596 1
1 126 . 1 1 1 A 12 12 LYS N N 12 121.835 121.696 0.139 1
1 127 . 1 1 1 A 13 13 LEU H H 13 8.144 8.192 -0.048 1
1 128 . 1 1 1 A 13 13 LEU HA H 13 4.093 4.034 0.059 1
1 137 . 1 1 1 A 13 13 LEU C C 13 178.254 179.458 -1.204 1
1 138 . 1 1 1 A 13 13 LEU CA C 13 58.023 58.181 -0.158 1
1 139 . 1 1 1 A 13 13 LEU CB C 13 41.283 41.406 -0.123 1
1 140 . 1 1 1 A 13 13 LEU N N 13 118.688 119.420 -0.732 1
1 141 . 1 1 1 A 14 14 ASN H H 14 8.384 8.409 -0.025 1
1 142 . 1 1 1 A 14 14 ASN HA H 14 4.567 4.432 0.135 1
1 147 . 1 1 1 A 14 14 ASN C C 14 175.397 177.656 -2.259 1
1 148 . 1 1 1 A 14 14 ASN CA C 14 56.239 56.610 -0.371 1
1 149 . 1 1 1 A 14 14 ASN CB C 14 38.432 38.288 0.144 1
1 150 . 1 1 1 A 14 14 ASN N N 14 118.175 117.582 0.593 1
1 152 . 1 1 1 A 15 15 TYR H H 15 7.982 8.281 -0.299 1
1 153 . 1 1 1 A 15 15 TYR HA H 15 4.249 4.127 0.122 1
1 160 . 1 1 1 A 15 15 TYR C C 15 175.503 177.364 -1.861 1
1 161 . 1 1 1 A 15 15 TYR CA C 15 62.450 61.491 0.959 1
1 162 . 1 1 1 A 15 15 TYR CB C 15 39.399 38.681 0.718 1
1 163 . 1 1 1 A 15 15 TYR N N 15 121.955 122.215 -0.260 1
1 164 . 1 1 1 A 16 16 LEU H H 16 8.198 8.781 -0.583 1
1 165 . 1 1 1 A 16 16 LEU HA H 16 4.470 4.108 0.362 1
1 175 . 1 1 1 A 16 16 LEU C C 16 177.125 178.067 -0.942 1
1 176 . 1 1 1 A 16 16 LEU CA C 16 57.374 58.300 -0.926 1
1 177 . 1 1 1 A 16 16 LEU CB C 16 41.443 41.755 -0.312 1
1 178 . 1 1 1 A 16 16 LEU N N 16 117.642 121.749 -4.107 1
1 179 . 1 1 1 A 17 17 ASP H H 17 8.061 8.553 -0.492 1
1 180 . 1 1 1 A 17 17 ASP C C 17 177.836 178.315 -0.479 1
1 181 . 1 1 1 A 17 17 ASP CA C 17 57.486 58.079 -0.593 1
1 182 . 1 1 1 A 17 17 ASP CB C 17 41.433 42.028 -0.595 1
1 183 . 1 1 1 A 17 17 ASP N N 17 118.700 119.045 -0.345 1
1 184 . 1 1 1 A 18 18 GLN H H 18 8.111 7.785 0.326 1
1 185 . 1 1 1 A 18 18 GLN HA H 18 4.002 4.051 -0.049 1
1 190 . 1 1 1 A 18 18 GLN CA C 18 59.046 58.716 0.330 1
1 191 . 1 1 1 A 18 18 GLN CB C 18 28.700 28.342 0.358 1
1 193 . 1 1 1 A 18 18 GLN N N 18 119.539 119.246 0.293 1
1 195 . 1 1 1 A 19 19 ILE H H 19 8.330 8.306 0.024 1
1 196 . 1 1 1 A 19 19 ILE HA H 19 3.306 3.860 -0.554 1
1 204 . 1 1 1 A 19 19 ILE C C 19 175.608 177.533 -1.925 1
1 205 . 1 1 1 A 19 19 ILE CA C 19 64.760 62.988 1.772 1
1 206 . 1 1 1 A 19 19 ILE CB C 19 37.148 37.342 -0.194 1
1 209 . 1 1 1 A 19 19 ILE N N 19 121.490 120.053 1.437 1
1 210 . 1 1 1 A 20 20 ALA H H 20 8.057 8.014 0.043 1
1 211 . 1 1 1 A 20 20 ALA HA H 20 4.349 4.244 0.105 1
1 215 . 1 1 1 A 20 20 ALA C C 20 179.297 179.687 -0.390 1
1 216 . 1 1 1 A 20 20 ALA CA C 20 56.150 55.337 0.813 1
1 217 . 1 1 1 A 20 20 ALA CB C 20 18.104 18.908 -0.804 1
1 218 . 1 1 1 A 20 20 ALA N N 20 124.441 124.358 0.083 1
1 219 . 1 1 1 A 21 21 LYS H H 21 8.116 8.176 -0.060 1
1 220 . 1 1 1 A 21 21 LYS HA H 21 4.108 3.995 0.113 1
1 229 . 1 1 1 A 21 21 LYS C C 21 176.720 179.068 -2.348 1
1 230 . 1 1 1 A 21 21 LYS CA C 21 59.166 59.179 -0.013 1
1 231 . 1 1 1 A 21 21 LYS CB C 21 32.085 32.267 -0.182 1
1 233 . 1 1 1 A 21 21 LYS N N 21 119.865 117.453 2.412 1
1 234 . 1 1 1 A 22 22 PHE H H 22 7.875 8.087 -0.212 1
1 235 . 1 1 1 A 22 22 PHE HA H 22 4.012 4.161 -0.149 1
1 242 . 1 1 1 A 22 22 PHE C C 22 175.545 177.575 -2.030 1
1 243 . 1 1 1 A 22 22 PHE CA C 22 61.070 61.338 -0.268 1
1 244 . 1 1 1 A 22 22 PHE CB C 22 39.072 38.612 0.460 1
1 249 . 1 1 1 A 22 22 PHE N N 22 119.729 120.120 -0.391 1
1 250 . 1 1 1 A 23 23 TRP H H 23 7.841 7.716 0.125 1
1 251 . 1 1 1 A 23 23 TRP HA H 23 4.149 4.257 -0.108 1
1 260 . 1 1 1 A 23 23 TRP C C 23 176.668 178.425 -1.757 1
1 261 . 1 1 1 A 23 23 TRP CB C 23 28.543 29.747 -1.204 1
1 267 . 1 1 1 A 23 23 TRP N N 23 119.440 120.565 -1.125 1
1 269 . 1 1 1 A 24 24 GLU H H 24 8.261 8.957 -0.696 1
1 270 . 1 1 1 A 24 24 GLU HA H 24 4.265 4.336 -0.071 1
1 275 . 1 1 1 A 24 24 GLU C C 24 179.679 177.997 1.682 1
1 276 . 1 1 1 A 24 24 GLU CA C 24 59.706 58.965 0.741 1
1 277 . 1 1 1 A 24 24 GLU CB C 24 29.720 29.367 0.353 1
1 279 . 1 1 1 A 24 24 GLU N N 24 121.376 117.545 3.831 1
1 280 . 1 1 1 A 25 25 ILE H H 25 8.071 7.954 0.117 1
1 281 . 1 1 1 A 25 25 ILE HA H 25 3.815 3.891 -0.076 1
1 291 . 1 1 1 A 25 25 ILE C C 25 176.343 177.645 -1.302 1
1 292 . 1 1 1 A 25 25 ILE CA C 25 64.464 61.931 2.533 1
1 293 . 1 1 1 A 25 25 ILE CB C 25 37.371 37.734 -0.363 1
1 296 . 1 1 1 A 25 25 ILE N N 25 121.499 121.378 0.121 1
1 297 . 1 1 1 A 26 26 GLN H H 26 7.327 7.484 -0.157 1
1 298 . 1 1 1 A 26 26 GLN HA H 26 4.074 4.198 -0.124 1
1 305 . 1 1 1 A 26 26 GLN C C 26 174.906 175.768 -0.862 1
1 306 . 1 1 1 A 26 26 GLN CA C 26 55.450 55.645 -0.195 1
1 307 . 1 1 1 A 26 26 GLN CB C 26 28.458 28.954 -0.496 1
1 309 . 1 1 1 A 26 26 GLN N N 26 116.532 120.444 -3.912 1
1 311 . 1 1 1 A 27 27 GLY H H 27 7.861 8.398 -0.537 1
1 312 . 1 1 1 A 27 27 GLY HA2 H 27 4.297 3.757 0.540 1
1 313 . 1 1 1 A 27 27 GLY HA3 H 27 3.823 3.759 0.064 1
1 314 . 1 1 1 A 27 27 GLY C C 27 172.698 173.281 -0.583 1
1 315 . 1 1 1 A 27 27 GLY CA C 27 45.608 45.543 0.065 1
1 316 . 1 1 1 A 27 27 GLY N N 27 106.837 108.411 -1.574 1
1 317 . 1 1 1 A 28 28 SER H H 28 8.083 7.008 1.075 1
1 318 . 1 1 1 A 28 28 SER HA H 28 4.777 4.721 0.056 1
1 321 . 1 1 1 A 28 28 SER C C 28 171.196 171.638 -0.442 1
1 322 . 1 1 1 A 28 28 SER CA C 28 56.041 56.912 -0.871 1
1 323 . 1 1 1 A 28 28 SER CB C 28 64.539 66.610 -2.071 1
1 324 . 1 1 1 A 28 28 SER N N 28 116.151 114.362 1.789 1
1 325 . 1 1 1 A 29 29 SER H H 29 8.354 8.559 -0.205 1
1 326 . 1 1 1 A 29 29 SER HA H 29 4.389 5.068 -0.679 1
1 329 . 1 1 1 A 29 29 SER C C 29 172.166 172.875 -0.709 1
1 330 . 1 1 1 A 29 29 SER CA C 29 58.107 56.306 1.801 1
1 331 . 1 1 1 A 29 29 SER CB C 29 63.853 65.757 -1.904 1
1 332 . 1 1 1 A 29 29 SER N N 29 116.596 114.672 1.924 1
1 333 . 1 1 1 A 30 30 LEU H H 30 8.990 8.560 0.430 1
1 334 . 1 1 1 A 30 30 LEU HA H 30 3.964 4.918 -0.954 1
1 344 . 1 1 1 A 30 30 LEU C C 30 173.752 175.051 -1.299 1
1 345 . 1 1 1 A 30 30 LEU CA C 30 55.193 54.966 0.227 1
1 346 . 1 1 1 A 30 30 LEU CB C 30 42.869 42.233 0.636 1
1 349 . 1 1 1 A 30 30 LEU N N 30 125.860 127.127 -1.267 1
1 350 . 1 1 1 A 31 31 LYS H H 31 8.118 8.965 -0.847 1
1 351 . 1 1 1 A 31 31 LYS HA H 31 4.498 4.780 -0.282 1
1 360 . 1 1 1 A 31 31 LYS C C 31 173.555 174.843 -1.288 1
1 361 . 1 1 1 A 31 31 LYS CA C 31 54.372 55.381 -1.009 1
1 362 . 1 1 1 A 31 31 LYS CB C 31 32.814 32.456 0.358 1
1 365 . 1 1 1 A 31 31 LYS N N 31 129.965 127.130 2.835 1
1 366 . 1 1 1 A 32 32 ILE H H 32 8.717 8.540 0.177 1
1 367 . 1 1 1 A 32 32 ILE HA H 32 4.011 4.578 -0.567 1
1 377 . 1 1 1 A 32 32 ILE C C 32 173.038 174.505 -1.467 1
1 378 . 1 1 1 A 32 32 ILE CA C 32 59.921 58.288 1.633 1
1 379 . 1 1 1 A 32 32 ILE CB C 32 38.139 38.631 -0.492 1
1 382 . 1 1 1 A 32 32 ILE N N 32 127.091 120.868 6.223 1
1 383 . 1 1 1 A 33 33 PRO HA H 33 4.412 4.604 -0.192 1
1 390 . 1 1 1 A 33 33 PRO C C 33 172.724 175.391 -2.667 1
1 391 . 1 1 1 A 33 33 PRO CA C 33 62.565 62.241 0.324 1
1 392 . 1 1 1 A 33 33 PRO CB C 33 32.728 32.892 -0.164 1
1 394 . 1 1 1 A 34 34 ASN H H 34 8.265 8.543 -0.278 1
1 395 . 1 1 1 A 34 34 ASN HA H 34 5.147 5.479 -0.332 1
1 400 . 1 1 1 A 34 34 ASN C C 34 174.079 174.486 -0.407 1
1 401 . 1 1 1 A 34 34 ASN CA C 34 52.088 51.739 0.349 1
1 402 . 1 1 1 A 34 34 ASN CB C 34 40.387 42.084 -1.697 1
1 403 . 1 1 1 A 34 34 ASN N N 34 116.424 118.311 -1.887 1
1 405 . 1 1 1 A 35 35 VAL H H 35 8.904 9.144 -0.240 1
1 406 . 1 1 1 A 35 35 VAL HA H 35 4.159 4.493 -0.334 1
1 414 . 1 1 1 A 35 35 VAL C C 35 173.834 174.767 -0.933 1
1 415 . 1 1 1 A 35 35 VAL CA C 35 61.953 60.240 1.713 1
1 416 . 1 1 1 A 35 35 VAL CB C 35 34.432 34.952 -0.520 1
1 419 . 1 1 1 A 35 35 VAL N N 35 122.778 119.728 3.050 1
1 420 . 1 1 1 A 36 36 GLU H H 36 9.560 9.497 0.063 1
1 421 . 1 1 1 A 36 36 GLU HA H 36 3.819 4.047 -0.228 1
1 426 . 1 1 1 A 36 36 GLU C C 36 173.604 175.861 -2.257 1
1 427 . 1 1 1 A 36 36 GLU CA C 36 57.131 58.059 -0.928 1
1 428 . 1 1 1 A 36 36 GLU CB C 36 27.464 28.097 -0.633 1
1 430 . 1 1 1 A 36 36 GLU N N 36 127.014 129.536 -2.522 1
1 431 . 1 1 1 A 37 37 ARG H H 37 8.578 8.496 0.082 1
1 432 . 1 1 1 A 37 37 ARG HA H 37 3.792 3.959 -0.167 1
1 439 . 1 1 1 A 37 37 ARG C C 37 173.371 174.325 -0.954 1
1 440 . 1 1 1 A 37 37 ARG CA C 37 57.952 57.659 0.293 1
1 441 . 1 1 1 A 37 37 ARG CB C 37 27.657 27.667 -0.010 1
1 443 . 1 1 1 A 37 37 ARG N N 37 108.362 110.758 -2.396 1
1 444 . 1 1 1 A 38 38 ARG H H 38 7.696 8.074 -0.378 1
1 445 . 1 1 1 A 38 38 ARG HA H 38 4.743 5.237 -0.494 1
1 452 . 1 1 1 A 38 38 ARG C C 38 173.513 175.393 -1.880 1
1 453 . 1 1 1 A 38 38 ARG CA C 38 54.507 54.456 0.051 1
1 454 . 1 1 1 A 38 38 ARG CB C 38 33.751 33.434 0.317 1
1 456 . 1 1 1 A 38 38 ARG N N 38 118.370 119.073 -0.703 1
1 457 . 1 1 1 A 39 39 ILE H H 39 8.463 8.657 -0.194 1
1 458 . 1 1 1 A 39 39 ILE HA H 39 4.184 4.249 -0.065 1
1 468 . 1 1 1 A 39 39 ILE C C 39 175.150 175.771 -0.621 1
1 469 . 1 1 1 A 39 39 ILE CA C 39 62.076 61.667 0.409 1
1 470 . 1 1 1 A 39 39 ILE CB C 39 38.864 39.340 -0.476 1
1 473 . 1 1 1 A 39 39 ILE N N 39 123.604 127.155 -3.551 1
1 474 . 1 1 1 A 40 40 LEU H H 40 8.239 8.126 0.113 1
1 475 . 1 1 1 A 40 40 LEU HA H 40 4.259 4.505 -0.246 1
1 485 . 1 1 1 A 40 40 LEU C C 40 173.152 175.377 -2.225 1
1 486 . 1 1 1 A 40 40 LEU CA C 40 55.305 54.719 0.586 1
1 487 . 1 1 1 A 40 40 LEU CB C 40 43.113 41.744 1.369 1
1 490 . 1 1 1 A 40 40 LEU N N 40 129.550 128.896 0.654 1
1 491 . 1 1 1 A 41 41 ASP H H 41 8.992 8.546 0.446 1
1 492 . 1 1 1 A 41 41 ASP HA H 41 4.798 4.847 -0.049 1
1 495 . 1 1 1 A 41 41 ASP C C 41 173.837 176.289 -2.452 1
1 496 . 1 1 1 A 41 41 ASP CA C 41 52.077 53.506 -1.429 1
1 497 . 1 1 1 A 41 41 ASP CB C 41 39.454 40.519 -1.065 1
1 498 . 1 1 1 A 41 41 ASP N N 41 127.022 127.757 -0.735 1
1 499 . 1 1 1 A 42 42 LEU H H 42 7.912 8.732 -0.820 1
1 500 . 1 1 1 A 42 42 LEU HA H 42 3.970 4.158 -0.188 1
1 510 . 1 1 1 A 42 42 LEU C C 42 176.305 178.082 -1.777 1
1 511 . 1 1 1 A 42 42 LEU CA C 42 58.128 57.738 0.390 1
1 512 . 1 1 1 A 42 42 LEU CB C 42 43.043 41.903 1.140 1
1 514 . 1 1 1 A 42 42 LEU N N 42 125.064 128.167 -3.103 1
1 515 . 1 1 1 A 43 43 TYR H H 43 8.565 8.206 0.359 1
1 516 . 1 1 1 A 43 43 TYR HA H 43 3.728 4.016 -0.288 1
1 523 . 1 1 1 A 43 43 TYR C C 43 175.757 178.320 -2.563 1
1 524 . 1 1 1 A 43 43 TYR CA C 43 61.774 60.241 1.533 1
1 525 . 1 1 1 A 43 43 TYR CB C 43 38.235 38.072 0.163 1
1 528 . 1 1 1 A 43 43 TYR N N 43 117.822 119.321 -1.499 1
1 529 . 1 1 1 A 44 44 SER H H 44 8.115 8.318 -0.203 1
1 530 . 1 1 1 A 44 44 SER HA H 44 3.854 4.207 -0.353 1
1 533 . 1 1 1 A 44 44 SER C C 44 174.080 176.146 -2.066 1
1 534 . 1 1 1 A 44 44 SER CA C 44 61.873 61.814 0.059 1
1 535 . 1 1 1 A 44 44 SER CB C 44 64.350 62.971 1.379 1
1 536 . 1 1 1 A 44 44 SER N N 44 116.835 116.169 0.666 1
1 537 . 1 1 1 A 45 45 LEU H H 45 8.401 7.760 0.641 1
1 538 . 1 1 1 A 45 45 LEU HA H 45 4.102 4.155 -0.053 1
1 548 . 1 1 1 A 45 45 LEU C C 45 175.081 178.507 -3.426 1
1 549 . 1 1 1 A 45 45 LEU CA C 45 58.896 58.119 0.777 1
1 550 . 1 1 1 A 45 45 LEU CB C 45 41.741 41.717 0.024 1
1 553 . 1 1 1 A 45 45 LEU N N 45 120.621 123.315 -2.694 1
1 554 . 1 1 1 A 46 46 SER H H 46 8.110 8.726 -0.616 1
1 555 . 1 1 1 A 46 46 SER HA H 46 4.300 4.247 0.053 1
1 558 . 1 1 1 A 46 46 SER C C 46 175.019 176.706 -1.687 1
1 559 . 1 1 1 A 46 46 SER CA C 46 62.610 61.430 1.180 1
1 560 . 1 1 1 A 46 46 SER CB C 46 64.092 62.757 1.335 1
1 561 . 1 1 1 A 46 46 SER N N 46 112.826 113.903 -1.077 1
1 562 . 1 1 1 A 47 47 LYS H H 47 7.732 7.990 -0.258 1
1 563 . 1 1 1 A 47 47 LYS HA H 47 3.900 4.137 -0.237 1
1 572 . 1 1 1 A 47 47 LYS C C 47 177.441 179.064 -1.623 1
1 573 . 1 1 1 A 47 47 LYS CA C 47 58.575 59.073 -0.498 1
1 574 . 1 1 1 A 47 47 LYS CB C 47 32.351 31.650 0.701 1
1 576 . 1 1 1 A 47 47 LYS N N 47 121.210 119.157 2.053 1
1 577 . 1 1 1 A 48 48 ILE H H 48 8.672 8.111 0.561 1
1 578 . 1 1 1 A 48 48 ILE HA H 48 3.628 3.720 -0.092 1
1 588 . 1 1 1 A 48 48 ILE C C 48 175.861 177.942 -2.081 1
1 589 . 1 1 1 A 48 48 ILE CA C 48 64.188 65.133 -0.945 1
1 590 . 1 1 1 A 48 48 ILE CB C 48 37.954 37.893 0.061 1
1 593 . 1 1 1 A 48 48 ILE N N 48 120.810 121.071 -0.261 1
1 594 . 1 1 1 A 49 49 VAL H H 49 8.030 8.301 -0.271 1
1 595 . 1 1 1 A 49 49 VAL HA H 49 3.195 3.721 -0.526 1
1 603 . 1 1 1 A 49 49 VAL C C 49 176.513 178.618 -2.105 1
1 604 . 1 1 1 A 49 49 VAL CA C 49 66.760 67.082 -0.322 1
1 605 . 1 1 1 A 49 49 VAL CB C 49 30.935 31.749 -0.814 1
1 608 . 1 1 1 A 49 49 VAL N N 49 119.350 119.701 -0.351 1
1 609 . 1 1 1 A 50 50 VAL H H 50 7.336 8.344 -1.008 1
1 610 . 1 1 1 A 50 50 VAL HA H 50 3.497 3.616 -0.119 1
1 618 . 1 1 1 A 50 50 VAL C C 50 178.745 178.550 0.195 1
1 619 . 1 1 1 A 50 50 VAL CA C 50 67.384 66.661 0.723 1
1 620 . 1 1 1 A 50 50 VAL CB C 50 31.832 31.578 0.254 1
1 621 . 1 1 1 A 50 50 VAL N N 50 118.610 120.854 -2.244 1
1 622 . 1 1 1 A 51 51 GLU H H 51 8.318 8.220 0.098 1
1 623 . 1 1 1 A 51 51 GLU HA H 51 3.953 4.038 -0.085 1
1 628 . 1 1 1 A 51 51 GLU C C 51 177.281 179.265 -1.984 1
1 629 . 1 1 1 A 51 51 GLU CA C 51 59.668 59.175 0.493 1
1 630 . 1 1 1 A 51 51 GLU CB C 51 30.131 29.320 0.811 1
1 632 . 1 1 1 A 51 51 GLU N N 51 122.096 119.954 2.142 1
1 633 . 1 1 1 A 52 52 GLU H H 52 8.065 8.128 -0.063 1
1 634 . 1 1 1 A 52 52 GLU HA H 52 4.229 4.194 0.035 1
1 639 . 1 1 1 A 52 52 GLU C C 52 173.534 176.885 -3.351 1
1 640 . 1 1 1 A 52 52 GLU CA C 52 55.547 56.723 -1.176 1
1 641 . 1 1 1 A 52 52 GLU CB C 52 28.716 29.612 -0.896 1
1 643 . 1 1 1 A 52 52 GLU N N 52 114.992 116.270 -1.278 1
1 644 . 1 1 1 A 53 53 GLY H H 53 7.459 8.789 -1.330 1
1 645 . 1 1 1 A 53 53 GLY HA2 H 53 3.630 3.959 -0.329 1
1 646 . 1 1 1 A 53 53 GLY HA3 H 53 3.630 3.976 -0.346 1
1 647 . 1 1 1 A 53 53 GLY C C 53 173.214 173.787 -0.573 1
1 648 . 1 1 1 A 53 53 GLY CA C 53 44.962 45.171 -0.209 1
1 649 . 1 1 1 A 53 53 GLY N N 53 104.909 108.006 -3.097 1
1 650 . 1 1 1 A 54 54 GLY H H 54 8.533 7.781 0.752 1
1 651 . 1 1 1 A 54 54 GLY HA2 H 54 3.548 4.064 -0.516 1
1 652 . 1 1 1 A 54 54 GLY HA3 H 54 4.521 4.117 0.404 1
1 653 . 1 1 1 A 54 54 GLY C C 54 169.966 174.181 -4.215 1
1 654 . 1 1 1 A 54 54 GLY CA C 54 43.988 45.866 -1.878 1
1 655 . 1 1 1 A 54 54 GLY N N 54 110.587 107.532 3.055 1
1 656 . 1 1 1 A 55 55 TYR H H 55 8.704 9.010 -0.306 1
1 657 . 1 1 1 A 55 55 TYR HA H 55 3.618 4.011 -0.393 1
1 664 . 1 1 1 A 55 55 TYR C C 55 174.807 177.426 -2.619 1
1 665 . 1 1 1 A 55 55 TYR CA C 55 62.540 61.397 1.143 1
1 666 . 1 1 1 A 55 55 TYR CB C 55 39.669 39.451 0.218 1
1 669 . 1 1 1 A 55 55 TYR N N 55 119.168 125.734 -6.566 1
1 670 . 1 1 1 A 56 56 GLU H H 56 9.006 8.340 0.666 1
1 671 . 1 1 1 A 56 56 GLU HA H 56 3.638 3.611 0.027 1
1 676 . 1 1 1 A 56 56 GLU C C 56 177.400 178.281 -0.881 1
1 677 . 1 1 1 A 56 56 GLU CA C 56 60.530 59.545 0.985 1
1 678 . 1 1 1 A 56 56 GLU CB C 56 29.168 29.449 -0.281 1
1 679 . 1 1 1 A 56 56 GLU N N 56 118.969 119.460 -0.491 1
1 680 . 1 1 1 A 57 57 ALA H H 57 8.235 7.671 0.564 1
1 681 . 1 1 1 A 57 57 ALA HA H 57 3.980 4.031 -0.051 1
1 685 . 1 1 1 A 57 57 ALA C C 57 177.678 179.704 -2.026 1
1 686 . 1 1 1 A 57 57 ALA CA C 57 54.910 55.164 -0.254 1
1 687 . 1 1 1 A 57 57 ALA CB C 57 18.122 18.480 -0.358 1
1 688 . 1 1 1 A 57 57 ALA N N 57 122.860 121.787 1.073 1
1 689 . 1 1 1 A 58 58 ILE H H 58 7.831 7.690 0.141 1
1 690 . 1 1 1 A 58 58 ILE HA H 58 3.189 3.348 -0.159 1
1 700 . 1 1 1 A 58 58 ILE C C 58 177.818 177.705 0.113 1
1 701 . 1 1 1 A 58 58 ILE CA C 58 65.074 64.415 0.659 1
1 702 . 1 1 1 A 58 58 ILE CB C 58 38.178 36.546 1.632 1
1 706 . 1 1 1 A 58 58 ILE N N 58 117.418 117.479 -0.061 1
1 707 . 1 1 1 A 59 59 CYS H H 59 7.760 7.719 0.041 1
1 708 . 1 1 1 A 59 59 CYS HA H 59 4.203 4.181 0.022 1
1 711 . 1 1 1 A 59 59 CYS C C 59 176.357 176.849 -0.492 1
1 712 . 1 1 1 A 59 59 CYS CA C 59 63.760 63.171 0.589 1
1 713 . 1 1 1 A 59 59 CYS CB C 59 27.638 27.378 0.260 1
1 714 . 1 1 1 A 59 59 CYS N N 59 115.302 119.482 -4.180 1
1 715 . 1 1 1 A 60 60 LYS H H 60 8.350 7.920 0.430 1
1 716 . 1 1 1 A 60 60 LYS HA H 60 3.972 4.073 -0.101 1
1 725 . 1 1 1 A 60 60 LYS C C 60 176.373 176.961 -0.588 1
1 726 . 1 1 1 A 60 60 LYS CA C 60 59.796 58.103 1.693 1
1 727 . 1 1 1 A 60 60 LYS CB C 60 32.560 32.360 0.200 1
1 729 . 1 1 1 A 60 60 LYS N N 60 122.343 119.974 2.369 1
1 730 . 1 1 1 A 61 61 ASP H H 61 8.157 7.796 0.361 1
1 731 . 1 1 1 A 61 61 ASP HA H 61 4.616 4.665 -0.049 1
1 734 . 1 1 1 A 61 61 ASP C C 61 173.246 175.699 -2.453 1
1 735 . 1 1 1 A 61 61 ASP CA C 61 54.272 53.660 0.612 1
1 736 . 1 1 1 A 61 61 ASP CB C 61 41.023 41.054 -0.031 1
1 737 . 1 1 1 A 61 61 ASP N N 61 116.173 117.852 -1.679 1
1 738 . 1 1 1 A 62 62 ARG H H 62 7.655 7.768 -0.113 1
1 739 . 1 1 1 A 62 62 ARG HA H 62 4.149 3.975 0.174 1
1 746 . 1 1 1 A 62 62 ARG C C 62 175.891 176.303 -0.412 1
1 747 . 1 1 1 A 62 62 ARG CA C 62 57.381 57.170 0.211 1
1 748 . 1 1 1 A 62 62 ARG CB C 62 26.538 29.330 -2.792 1
1 750 . 1 1 1 A 62 62 ARG N N 62 117.213 118.701 -1.488 1
1 751 . 1 1 1 A 63 63 ARG H H 63 8.302 7.871 0.431 1
1 752 . 1 1 1 A 63 63 ARG HA H 63 4.240 4.241 -0.001 1
1 757 . 1 1 1 A 63 63 ARG C C 63 175.775 177.245 -1.470 1
1 758 . 1 1 1 A 63 63 ARG CA C 63 55.718 56.680 -0.962 1
1 760 . 1 1 1 A 63 63 ARG N N 63 116.292 117.687 -1.395 1
1 761 . 1 1 1 A 64 64 TRP H H 64 8.161 7.392 0.769 1
1 762 . 1 1 1 A 64 64 TRP HA H 64 3.836 4.351 -0.515 1
1 771 . 1 1 1 A 64 64 TRP C C 64 176.862 178.552 -1.690 1
1 772 . 1 1 1 A 64 64 TRP CA C 64 62.036 60.010 2.026 1
1 773 . 1 1 1 A 64 64 TRP CB C 64 27.028 28.668 -1.640 1
1 779 . 1 1 1 A 64 64 TRP N N 64 121.486 120.344 1.142 1
1 781 . 1 1 1 A 65 65 ALA H H 65 8.954 8.344 0.610 1
1 782 . 1 1 1 A 65 65 ALA HA H 65 4.290 4.032 0.258 1
1 786 . 1 1 1 A 65 65 ALA C C 65 178.986 179.669 -0.683 1
1 787 . 1 1 1 A 65 65 ALA CA C 65 55.314 55.425 -0.111 1
1 788 . 1 1 1 A 65 65 ALA CB C 65 18.119 18.431 -0.312 1
1 789 . 1 1 1 A 65 65 ALA N N 65 121.559 122.974 -1.415 1
1 790 . 1 1 1 A 66 66 ARG H H 66 7.473 8.113 -0.640 1
1 791 . 1 1 1 A 66 66 ARG HA H 66 4.221 4.113 0.108 1
1 798 . 1 1 1 A 66 66 ARG C C 66 176.670 178.719 -2.049 1
1 799 . 1 1 1 A 66 66 ARG CA C 66 57.871 59.033 -1.162 1
1 800 . 1 1 1 A 66 66 ARG CB C 66 29.097 29.783 -0.686 1
1 801 . 1 1 1 A 66 66 ARG N N 66 119.915 117.294 2.621 1
1 802 . 1 1 1 A 67 67 VAL H H 67 7.134 7.962 -0.828 1
1 803 . 1 1 1 A 67 67 VAL HA H 67 3.304 3.674 -0.370 1
1 811 . 1 1 1 A 67 67 VAL C C 67 175.341 178.084 -2.743 1
1 812 . 1 1 1 A 67 67 VAL CA C 67 66.722 66.553 0.169 1
1 813 . 1 1 1 A 67 67 VAL CB C 67 31.108 31.817 -0.709 1
1 816 . 1 1 1 A 67 67 VAL N N 67 119.970 120.746 -0.776 1
1 817 . 1 1 1 A 68 68 ALA H H 68 7.745 8.627 -0.882 1
1 818 . 1 1 1 A 68 68 ALA HA H 68 4.076 4.201 -0.125 1
1 822 . 1 1 1 A 68 68 ALA C C 68 177.358 180.052 -2.694 1
1 823 . 1 1 1 A 68 68 ALA CA C 68 55.607 55.938 -0.331 1
1 824 . 1 1 1 A 68 68 ALA CB C 68 18.061 18.558 -0.497 1
1 825 . 1 1 1 A 68 68 ALA N N 68 118.239 121.752 -3.513 1
1 826 . 1 1 1 A 69 69 GLN H H 69 7.979 8.137 -0.158 1
1 827 . 1 1 1 A 69 69 GLN HA H 69 4.310 4.133 0.177 1
1 834 . 1 1 1 A 69 69 GLN C C 69 179.370 178.832 0.538 1
1 835 . 1 1 1 A 69 69 GLN CA C 69 59.307 58.129 1.178 1
1 836 . 1 1 1 A 69 69 GLN CB C 69 29.257 28.217 1.040 1
1 838 . 1 1 1 A 69 69 GLN N N 69 118.484 117.410 1.074 1
1 840 . 1 1 1 A 70 70 ARG H H 70 8.374 7.974 0.400 1
1 841 . 1 1 1 A 70 70 ARG HA H 70 4.148 4.164 -0.016 1
1 848 . 1 1 1 A 70 70 ARG C C 70 175.850 178.178 -2.328 1
1 849 . 1 1 1 A 70 70 ARG CA C 70 58.957 58.521 0.436 1
1 850 . 1 1 1 A 70 70 ARG CB C 70 29.799 29.756 0.043 1
1 852 . 1 1 1 A 70 70 ARG N N 70 120.309 121.379 -1.070 1
1 853 . 1 1 1 A 71 71 LEU H H 71 7.413 7.797 -0.384 1
1 854 . 1 1 1 A 71 71 LEU HA H 71 4.341 4.189 0.152 1
1 864 . 1 1 1 A 71 71 LEU C C 71 173.391 175.783 -2.392 1
1 865 . 1 1 1 A 71 71 LEU CA C 71 54.911 54.835 0.076 1
1 866 . 1 1 1 A 71 71 LEU CB C 71 42.693 41.862 0.831 1
1 867 . 1 1 1 A 71 71 LEU N N 71 118.841 117.482 1.359 1
1 868 . 1 1 1 A 72 72 ASN H H 72 8.038 8.000 0.038 1
1 869 . 1 1 1 A 72 72 ASN HA H 72 4.394 4.404 -0.010 1
1 874 . 1 1 1 A 72 72 ASN C C 72 173.042 174.113 -1.071 1
1 875 . 1 1 1 A 72 72 ASN CB C 72 36.412 36.743 -0.331 1
1 876 . 1 1 1 A 72 72 ASN N N 72 112.919 114.675 -1.756 1
1 878 . 1 1 1 A 73 73 TYR H H 73 7.874 7.647 0.227 1
1 879 . 1 1 1 A 73 73 TYR HA H 73 4.868 4.582 0.286 1
1 886 . 1 1 1 A 73 73 TYR C C 73 172.194 174.085 -1.891 1
1 887 . 1 1 1 A 73 73 TYR CA C 73 57.105 56.646 0.459 1
1 888 . 1 1 1 A 73 73 TYR CB C 73 37.918 38.337 -0.419 1
1 889 . 1 1 1 A 73 73 TYR N N 73 117.432 119.107 -1.675 1
1 897 . 1 1 1 A 75 75 PRO HA H 75 4.626 4.261 0.365 1
1 902 . 1 1 1 A 75 75 PRO C C 75 175.728 177.209 -1.481 1
1 903 . 1 1 1 A 75 75 PRO CA C 75 62.502 63.780 -1.278 1
1 904 . 1 1 1 A 75 75 PRO CB C 75 32.339 32.190 0.149 1
1 905 . 1 1 1 A 76 76 GLY H H 76 8.369 8.865 -0.496 1
1 906 . 1 1 1 A 76 76 GLY HA2 H 76 4.057 3.905 0.152 1
1 907 . 1 1 1 A 76 76 GLY HA3 H 76 4.556 3.906 0.650 1
1 908 . 1 1 1 A 76 76 GLY C C 76 173.248 174.815 -1.567 1
1 909 . 1 1 1 A 76 76 GLY CA C 76 46.180 45.259 0.921 1
1 910 . 1 1 1 A 76 76 GLY N N 76 106.185 110.765 -4.580 1
1 911 . 1 1 1 A 77 77 LYS H H 77 8.632 8.652 -0.020 1
1 912 . 1 1 1 A 77 77 LYS HA H 77 4.433 4.094 0.339 1
1 921 . 1 1 1 A 77 77 LYS C C 77 174.924 176.666 -1.742 1
1 922 . 1 1 1 A 77 77 LYS CA C 77 56.453 57.383 -0.930 1
1 923 . 1 1 1 A 77 77 LYS CB C 77 33.170 30.187 2.983 1
1 925 . 1 1 1 A 77 77 LYS N N 77 119.592 119.335 0.257 1
1 926 . 1 1 1 A 78 78 ASN H H 78 8.865 8.033 0.832 1
1 927 . 1 1 1 A 78 78 ASN HA H 78 4.654 4.585 0.069 1
1 932 . 1 1 1 A 78 78 ASN C C 78 174.869 176.708 -1.839 1
1 933 . 1 1 1 A 78 78 ASN CA C 78 54.117 55.379 -1.262 1
1 934 . 1 1 1 A 78 78 ASN CB C 78 37.841 38.142 -0.301 1
1 935 . 1 1 1 A 78 78 ASN N N 78 116.880 117.548 -0.668 1
1 937 . 1 1 1 A 79 79 ILE H H 79 8.008 8.127 -0.119 1
1 938 . 1 1 1 A 79 79 ILE HA H 79 3.718 3.724 -0.006 1
1 948 . 1 1 1 A 79 79 ILE C C 79 175.921 178.370 -2.449 1
1 949 . 1 1 1 A 79 79 ILE CA C 79 63.618 64.494 -0.876 1
1 950 . 1 1 1 A 79 79 ILE CB C 79 37.158 36.840 0.318 1
1 952 . 1 1 1 A 79 79 ILE N N 79 119.688 120.516 -0.828 1
1 953 . 1 1 1 A 80 80 GLY H H 80 9.062 8.067 0.995 1
1 954 . 1 1 1 A 80 80 GLY HA2 H 80 3.739 3.760 -0.021 1
1 955 . 1 1 1 A 80 80 GLY HA3 H 80 3.739 3.803 -0.064 1
1 956 . 1 1 1 A 80 80 GLY C C 80 173.185 175.927 -2.742 1
1 957 . 1 1 1 A 80 80 GLY CA C 80 48.166 47.491 0.675 1
1 958 . 1 1 1 A 80 80 GLY N N 80 110.338 109.006 1.332 1
1 959 . 1 1 1 A 81 81 SER H H 81 7.460 8.083 -0.623 1
1 960 . 1 1 1 A 81 81 SER HA H 81 3.904 4.116 -0.212 1
1 963 . 1 1 1 A 81 81 SER C C 81 174.999 177.202 -2.203 1
1 964 . 1 1 1 A 81 81 SER CA C 81 61.138 61.083 0.055 1
1 965 . 1 1 1 A 81 81 SER CB C 81 62.740 62.680 0.060 1
1 966 . 1 1 1 A 81 81 SER N N 81 115.348 116.582 -1.234 1
1 967 . 1 1 1 A 82 82 LEU H H 82 7.367 7.940 -0.573 1
1 968 . 1 1 1 A 82 82 LEU HA H 82 3.946 3.756 0.190 1
1 977 . 1 1 1 A 82 82 LEU C C 82 176.969 177.840 -0.871 1
1 978 . 1 1 1 A 82 82 LEU CA C 82 57.504 58.177 -0.673 1
1 979 . 1 1 1 A 82 82 LEU CB C 82 42.185 41.274 0.911 1
1 980 . 1 1 1 A 82 82 LEU N N 82 124.267 122.666 1.601 1
1 981 . 1 1 1 A 83 83 LEU H H 83 8.330 8.112 0.218 1
1 982 . 1 1 1 A 83 83 LEU HA H 83 3.924 3.911 0.013 1
1 991 . 1 1 1 A 83 83 LEU C C 83 176.303 178.608 -2.305 1
1 992 . 1 1 1 A 83 83 LEU CA C 83 58.067 58.337 -0.270 1
1 993 . 1 1 1 A 83 83 LEU CB C 83 41.061 41.432 -0.371 1
1 994 . 1 1 1 A 83 83 LEU N N 83 117.452 119.564 -2.112 1
1 995 . 1 1 1 A 84 84 ARG H H 84 7.651 8.465 -0.814 1
1 996 . 1 1 1 A 84 84 ARG HA H 84 2.230 3.702 -1.472 1
1 1003 . 1 1 1 A 84 84 ARG C C 84 175.902 178.993 -3.091 1
1 1004 . 1 1 1 A 84 84 ARG CA C 84 59.112 59.642 -0.530 1
1 1005 . 1 1 1 A 84 84 ARG CB C 84 28.579 29.858 -1.279 1
1 1007 . 1 1 1 A 84 84 ARG N N 84 119.586 118.586 1.000 1
1 1008 . 1 1 1 A 85 85 SER H H 85 7.291 8.323 -1.032 1
1 1009 . 1 1 1 A 85 85 SER HA H 85 4.189 4.143 0.046 1
1 1012 . 1 1 1 A 85 85 SER C C 85 175.546 176.636 -1.090 1
1 1013 . 1 1 1 A 85 85 SER CA C 85 61.376 62.152 -0.776 1
1 1014 . 1 1 1 A 85 85 SER CB C 85 62.805 63.302 -0.497 1
1 1015 . 1 1 1 A 85 85 SER N N 85 112.921 116.662 -3.741 1
1 1016 . 1 1 1 A 86 86 HIS H H 86 8.156 7.418 0.738 1
1 1017 . 1 1 1 A 86 86 HIS HA H 86 4.782 4.244 0.538 1
1 1022 . 1 1 1 A 86 86 HIS C C 86 176.851 177.573 -0.722 1
1 1023 . 1 1 1 A 86 86 HIS CA C 86 58.898 59.853 -0.955 1
1 1024 . 1 1 1 A 86 86 HIS CB C 86 31.110 30.304 0.806 1
1 1027 . 1 1 1 A 86 86 HIS N N 86 119.258 119.316 -0.058 1
1 1028 . 1 1 1 A 87 87 TYR H H 87 9.180 8.404 0.776 1
1 1029 . 1 1 1 A 87 87 TYR HA H 87 3.913 3.948 -0.035 1
1 1036 . 1 1 1 A 87 87 TYR C C 87 176.841 177.862 -1.021 1
1 1037 . 1 1 1 A 87 87 TYR CA C 87 63.526 61.283 2.243 1
1 1038 . 1 1 1 A 87 87 TYR CB C 87 39.431 38.412 1.019 1
1 1041 . 1 1 1 A 87 87 TYR N N 87 120.625 119.931 0.694 1
1 1042 . 1 1 1 A 88 88 GLU H H 88 9.028 8.975 0.053 1
1 1043 . 1 1 1 A 88 88 GLU HA H 88 3.682 4.184 -0.502 1
1 1048 . 1 1 1 A 88 88 GLU C C 88 175.833 177.884 -2.051 1
1 1049 . 1 1 1 A 88 88 GLU CA C 88 59.730 59.950 -0.220 1
1 1050 . 1 1 1 A 88 88 GLU CB C 88 30.009 29.172 0.837 1
1 1052 . 1 1 1 A 88 88 GLU N N 88 119.531 118.360 1.171 1
1 1053 . 1 1 1 A 89 89 ARG H H 89 8.052 8.066 -0.014 1
1 1054 . 1 1 1 A 89 89 ARG HA H 89 4.292 4.592 -0.300 1
1 1061 . 1 1 1 A 89 89 ARG C C 89 176.045 176.895 -0.850 1
1 1062 . 1 1 1 A 89 89 ARG CA C 89 58.538 56.745 1.793 1
1 1063 . 1 1 1 A 89 89 ARG CB C 89 31.841 31.379 0.462 1
1 1065 . 1 1 1 A 89 89 ARG N N 89 114.741 117.266 -2.525 1
1 1066 . 1 1 1 A 90 90 ILE H H 90 8.141 7.679 0.462 1
1 1067 . 1 1 1 A 90 90 ILE HA H 90 4.296 3.644 0.652 1
1 1075 . 1 1 1 A 90 90 ILE C C 90 174.461 176.890 -2.429 1
1 1076 . 1 1 1 A 90 90 ILE CA C 90 63.649 62.758 0.891 1
1 1077 . 1 1 1 A 90 90 ILE CB C 90 40.626 39.170 1.456 1
1 1079 . 1 1 1 A 90 90 ILE N N 90 113.421 117.574 -4.153 1
1 1080 . 1 1 1 A 91 91 VAL H H 91 7.350 7.699 -0.349 1
1 1081 . 1 1 1 A 91 91 VAL HA H 91 4.144 3.501 0.643 1
1 1089 . 1 1 1 A 91 91 VAL C C 91 175.422 177.158 -1.736 1
1 1090 . 1 1 1 A 91 91 VAL CA C 91 65.042 64.924 0.118 1
1 1091 . 1 1 1 A 91 91 VAL CB C 91 33.215 30.795 2.420 1
1 1092 . 1 1 1 A 91 91 VAL N N 91 118.215 120.416 -2.201 1
1 1093 . 1 1 1 A 92 92 TYR H H 92 8.565 8.462 0.103 1
1 1094 . 1 1 1 A 92 92 TYR HA H 92 4.217 4.283 -0.066 1
1 1099 . 1 1 1 A 92 92 TYR C C 92 171.495 175.300 -3.805 1
1 1100 . 1 1 1 A 92 92 TYR CA C 92 61.558 62.339 -0.781 1
1 1101 . 1 1 1 A 92 92 TYR CB C 92 36.757 37.756 -0.999 1
1 1102 . 1 1 1 A 92 92 TYR N N 92 121.370 121.890 -0.520 1
1 1103 . 1 1 1 A 93 93 PRO HA H 93 4.136 4.269 -0.133 1
1 1108 . 1 1 1 A 93 93 PRO C C 93 177.077 178.510 -1.433 1
1 1109 . 1 1 1 A 93 93 PRO CA C 93 66.037 65.962 0.075 1
1 1110 . 1 1 1 A 93 93 PRO CB C 93 31.482 30.857 0.625 1
1 1111 . 1 1 1 A 94 94 TYR H H 94 6.517 7.298 -0.781 1
1 1112 . 1 1 1 A 94 94 TYR HA H 94 2.798 4.294 -1.496 1
1 1119 . 1 1 1 A 94 94 TYR C C 94 174.985 178.107 -3.122 1
1 1120 . 1 1 1 A 94 94 TYR CA C 94 59.356 59.071 0.285 1
1 1121 . 1 1 1 A 94 94 TYR CB C 94 37.987 36.911 1.076 1
1 1124 . 1 1 1 A 94 94 TYR N N 94 115.987 117.423 -1.436 1
1 1125 . 1 1 1 A 95 95 GLU H H 95 8.205 8.286 -0.081 1
1 1126 . 1 1 1 A 95 95 GLU HA H 95 3.682 4.043 -0.361 1
1 1131 . 1 1 1 A 95 95 GLU C C 95 178.530 178.843 -0.313 1
1 1132 . 1 1 1 A 95 95 GLU CA C 95 58.910 59.748 -0.838 1
1 1133 . 1 1 1 A 95 95 GLU CB C 95 29.187 29.251 -0.064 1
1 1134 . 1 1 1 A 95 95 GLU N N 95 119.946 121.260 -1.314 1
1 1135 . 1 1 1 A 96 96 MET H H 96 8.248 8.049 0.199 1
1 1136 . 1 1 1 A 96 96 MET HA H 96 4.172 4.139 0.033 1
1 1142 . 1 1 1 A 96 96 MET C C 96 176.874 177.958 -1.084 1
1 1143 . 1 1 1 A 96 96 MET CA C 96 57.159 59.123 -1.964 1
1 1144 . 1 1 1 A 96 96 MET CB C 96 31.829 32.102 -0.273 1
1 1146 . 1 1 1 A 96 96 MET N N 96 117.570 119.270 -1.700 1
1 1147 . 1 1 1 A 97 97 TYR H H 97 7.445 8.417 -0.972 1
1 1148 . 1 1 1 A 97 97 TYR HA H 97 4.248 3.998 0.250 1
1 1155 . 1 1 1 A 97 97 TYR C C 97 176.476 177.041 -0.565 1
1 1156 . 1 1 1 A 97 97 TYR CA C 97 60.470 61.728 -1.258 1
1 1157 . 1 1 1 A 97 97 TYR CB C 97 38.612 38.435 0.177 1
1 1160 . 1 1 1 A 97 97 TYR N N 97 122.246 120.871 1.375 1
1 1161 . 1 1 1 A 98 98 GLN H H 98 8.087 8.701 -0.614 1
1 1162 . 1 1 1 A 98 98 GLN HA H 98 3.793 3.555 0.238 1
1 1169 . 1 1 1 A 98 98 GLN C C 98 175.549 178.043 -2.494 1
1 1170 . 1 1 1 A 98 98 GLN CA C 98 57.365 58.635 -1.270 1
1 1171 . 1 1 1 A 98 98 GLN CB C 98 28.901 28.859 0.042 1
1 1173 . 1 1 1 A 98 98 GLN N N 98 118.769 119.593 -0.824 1
1 1175 . 1 1 1 A 99 99 SER H H 99 7.724 8.217 -0.493 1
1 1176 . 1 1 1 A 99 99 SER HA H 99 4.293 4.225 0.068 1
1 1179 . 1 1 1 A 99 99 SER C C 99 173.696 177.311 -3.615 1
1 1180 . 1 1 1 A 99 99 SER CA C 99 59.566 61.163 -1.597 1
1 1181 . 1 1 1 A 99 99 SER CB C 99 63.847 62.822 1.025 1
1 1182 . 1 1 1 A 99 99 SER N N 99 113.257 114.161 -0.904 1
1 1183 . 1 1 1 A 100 100 GLY H H 100 7.751 8.291 -0.540 1
1 1184 . 1 1 1 A 100 100 GLY HA2 H 100 3.813 3.854 -0.041 1
1 1185 . 1 1 1 A 100 100 GLY HA3 H 100 3.934 3.860 0.074 1
1 1186 . 1 1 1 A 100 100 GLY C C 100 172.643 176.247 -3.604 1
1 1187 . 1 1 1 A 100 100 GLY CA C 100 45.570 46.991 -1.421 1
1 1188 . 1 1 1 A 100 100 GLY N N 100 109.750 108.634 1.116 1
1 1189 . 1 1 1 A 101 101 ALA H H 101 7.824 7.762 0.062 1
1 1190 . 1 1 1 A 101 101 ALA HA H 101 4.221 3.909 0.312 1
1 1194 . 1 1 1 A 101 101 ALA C C 101 175.639 179.527 -3.888 1
1 1195 . 1 1 1 A 101 101 ALA CA C 101 52.745 54.501 -1.756 1
1 1196 . 1 1 1 A 101 101 ALA CB C 101 19.437 18.581 0.856 1
1 1197 . 1 1 1 A 101 101 ALA N N 101 123.241 124.715 -1.474 1
1 1198 . 1 1 1 A 102 102 ASN H H 102 8.191 7.807 0.384 1
1 1199 . 1 1 1 A 102 102 ASN HA H 102 4.658 4.702 -0.044 1
1 1204 . 1 1 1 A 102 102 ASN C C 102 173.337 175.854 -2.517 1
1 1205 . 1 1 1 A 102 102 ASN CA C 102 53.374 55.540 -2.166 1
1 1206 . 1 1 1 A 102 102 ASN CB C 102 38.819 39.306 -0.487 1
1 1207 . 1 1 1 A 102 102 ASN N N 102 116.572 114.410 2.162 1
1 1209 . 1 1 1 A 103 103 LEU H H 103 8.065 7.665 0.400 1
1 1210 . 1 1 1 A 103 103 LEU HA H 103 4.363 4.647 -0.284 1
1 1219 . 1 1 1 A 103 103 LEU C C 103 175.637 174.960 0.677 1
1 1220 . 1 1 1 A 103 103 LEU CA C 103 55.292 53.591 1.701 1
1 1221 . 1 1 1 A 103 103 LEU CB C 103 42.433 45.270 -2.837 1
1 1222 . 1 1 1 A 103 103 LEU N N 103 122.074 114.579 7.495 1
1 1223 . 1 1 1 A 104 104 VAL H H 104 8.055 8.992 -0.937 1
1 1224 . 1 1 1 A 104 104 VAL HA H 104 4.131 5.226 -1.095 1
1 1232 . 1 1 1 A 104 104 VAL C C 104 174.364 175.220 -0.856 1
1 1233 . 1 1 1 A 104 104 VAL CA C 104 62.552 61.751 0.801 1
1 1234 . 1 1 1 A 104 104 VAL CB C 104 32.766 31.917 0.849 1
1 1235 . 1 1 1 A 104 104 VAL N N 104 120.606 123.767 -3.161 1
1 1236 . 1 1 1 A 105 105 CYS H H 105 8.392 8.485 -0.093 1
1 1237 . 1 1 1 A 105 105 CYS HA H 105 4.535 4.613 -0.078 1
1 1240 . 1 1 1 A 105 105 CYS C C 105 172.593 175.265 -2.672 1
1 1241 . 1 1 1 A 105 105 CYS CA C 105 58.449 60.752 -2.303 1
1 1242 . 1 1 1 A 105 105 CYS CB C 105 27.952 28.767 -0.815 1
1 1243 . 1 1 1 A 105 105 CYS N N 105 122.791 127.584 -4.793 1
1 1244 . 1 1 1 A 106 106 ASN H H 106 8.575 8.060 0.515 1
1 1245 . 1 1 1 A 106 106 ASN HA H 106 4.843 5.101 -0.258 1
1 1250 . 1 1 1 A 106 106 ASN C C 106 173.594 175.749 -2.155 1
1 1251 . 1 1 1 A 106 106 ASN CA C 106 53.337 53.318 0.019 1
1 1252 . 1 1 1 A 106 106 ASN CB C 106 39.088 39.247 -0.159 1
1 1253 . 1 1 1 A 106 106 ASN N N 106 122.001 117.808 4.193 1
1 1255 . 1 1 1 A 107 107 THR H H 107 8.090 7.714 0.376 1
1 1256 . 1 1 1 A 107 107 THR HA H 107 4.348 4.134 0.214 1
1 1261 . 1 1 1 A 107 107 THR C C 107 172.516 176.178 -3.662 1
1 1262 . 1 1 1 A 107 107 THR CA C 107 61.803 65.247 -3.444 1
1 1263 . 1 1 1 A 107 107 THR CB C 107 69.812 68.719 1.093 1
1 1265 . 1 1 1 A 107 107 THR N N 107 114.374 115.333 -0.959 1
1 1266 . 1 1 1 A 108 108 ARG H H 108 8.322 7.872 0.450 1
1 1267 . 1 1 1 A 108 108 ARG HA H 108 4.634 4.384 0.250 1
1 1274 . 1 1 1 A 108 108 ARG C C 108 172.608 177.243 -4.635 1
1 1275 . 1 1 1 A 108 108 ARG CA C 108 54.026 59.763 -5.737 1
1 1276 . 1 1 1 A 108 108 ARG CB C 108 30.246 30.956 -0.710 1
1 1278 . 1 1 1 A 108 108 ARG N N 108 124.017 121.748 2.269 1
1 1279 . 1 1 1 A 109 109 PRO HA H 109 4.354 4.485 -0.131 1
1 1286 . 1 1 1 A 109 109 PRO C C 109 174.978 178.224 -3.246 1
1 1287 . 1 1 1 A 109 109 PRO CA C 109 63.396 64.391 -0.995 1
1 1288 . 1 1 1 A 109 109 PRO CB C 109 32.046 31.872 0.174 1
1 1290 . 1 1 1 A 110 110 PHE H H 110 8.123 7.592 0.531 1
1 1291 . 1 1 1 A 110 110 PHE HA H 110 4.619 4.357 0.262 1
1 1296 . 1 1 1 A 110 110 PHE C C 110 173.856 177.264 -3.408 1
1 1297 . 1 1 1 A 110 110 PHE CA C 110 57.353 61.956 -4.603 1
1 1298 . 1 1 1 A 110 110 PHE CB C 110 39.364 39.704 -0.340 1
1 1301 . 1 1 1 A 110 110 PHE N N 110 119.265 119.982 -0.717 1
1 1302 . 1 1 1 A 111 111 ASP H H 111 8.161 8.123 0.038 1
1 1303 . 1 1 1 A 111 111 ASP HA H 111 4.613 4.467 0.146 1
1 1306 . 1 1 1 A 111 111 ASP C C 111 174.114 178.202 -4.088 1
1 1307 . 1 1 1 A 111 111 ASP CA C 111 54.350 57.889 -3.539 1
1 1308 . 1 1 1 A 111 111 ASP CB C 111 41.413 42.138 -0.725 1
1 1309 . 1 1 1 A 111 111 ASP N N 111 121.764 118.528 3.236 1
1 1310 . 1 1 1 A 112 112 ASN H H 112 8.307 8.157 0.150 1
1 1311 . 1 1 1 A 112 112 ASN HA H 112 4.662 5.069 -0.407 1
1 1316 . 1 1 1 A 112 112 ASN C C 112 173.595 177.479 -3.884 1
1 1317 . 1 1 1 A 112 112 ASN CA C 112 53.486 55.454 -1.968 1
1 1318 . 1 1 1 A 112 112 ASN CB C 112 39.225 38.340 0.885 1
1 1319 . 1 1 1 A 112 112 ASN N N 112 119.154 115.989 3.165 1
1 1321 . 1 1 1 A 113 113 GLU H H 113 8.404 8.034 0.370 1
1 1322 . 1 1 1 A 113 113 GLU HA H 113 4.264 4.128 0.136 1
1 1327 . 1 1 1 A 113 113 GLU C C 113 174.886 179.454 -4.568 1
1 1328 . 1 1 1 A 113 113 GLU CA C 113 56.681 59.115 -2.434 1
1 1329 . 1 1 1 A 113 113 GLU CB C 113 30.403 29.944 0.459 1
1 1331 . 1 1 1 A 113 113 GLU N N 113 120.943 119.470 1.473 1
1 1332 . 1 1 1 A 114 114 GLU H H 114 8.388 8.052 0.336 1
1 1333 . 1 1 1 A 114 114 GLU HA H 114 4.262 4.202 0.060 1
1 1338 . 1 1 1 A 114 114 GLU C C 114 174.819 176.809 -1.990 1
1 1339 . 1 1 1 A 114 114 GLU CA C 114 56.769 59.105 -2.336 1
1 1340 . 1 1 1 A 114 114 GLU CB C 114 30.125 29.792 0.333 1
1 1342 . 1 1 1 A 114 114 GLU N N 114 121.869 119.929 1.940 1
1 1343 . 1 1 1 A 115 115 LYS H H 115 8.236 8.079 0.157 1
1 1344 . 1 1 1 A 115 115 LYS HA H 115 4.347 4.665 -0.318 1
1 1353 . 1 1 1 A 115 115 LYS C C 115 174.633 174.531 0.102 1
1 1354 . 1 1 1 A 115 115 LYS CA C 115 56.426 55.007 1.419 1
1 1355 . 1 1 1 A 115 115 LYS CB C 115 33.277 33.335 -0.058 1
1 1359 . 1 1 1 A 115 115 LYS N N 115 121.997 119.352 2.645 1
1 1360 . 1 1 1 A 116 116 ASP H H 116 8.386 8.972 -0.586 1
1 1361 . 1 1 1 A 116 116 ASP HA H 116 4.600 4.775 -0.175 1
1 1364 . 1 1 1 A 116 116 ASP C C 116 173.448 175.023 -1.575 1
1 1365 . 1 1 1 A 116 116 ASP CA C 116 54.773 53.149 1.624 1
1 1366 . 1 1 1 A 116 116 ASP CB C 116 41.029 39.141 1.888 1
1 1367 . 1 1 1 A 116 116 ASP N N 116 121.057 127.601 -6.544 1
1 5 . 2 1 1 A 2 2 MET HA H 2 4.534 4.058 0.476 1
1 13 . 2 1 1 A 2 2 MET C C 2 174.355 178.039 -3.684 1
1 14 . 2 1 1 A 2 2 MET CA C 2 56.247 58.123 -1.876 1
1 15 . 2 1 1 A 2 2 MET CB C 2 32.855 32.018 0.837 1
1 18 . 2 1 1 A 3 3 ASN H H 3 8.600 8.298 0.302 1
1 19 . 2 1 1 A 3 3 ASN HA H 3 4.711 4.475 0.236 1
1 24 . 2 1 1 A 3 3 ASN C C 3 173.983 177.574 -3.591 1
1 25 . 2 1 1 A 3 3 ASN CA C 3 53.650 56.591 -2.941 1
1 26 . 2 1 1 A 3 3 ASN CB C 3 38.624 39.608 -0.984 1
1 27 . 2 1 1 A 3 3 ASN N N 3 120.149 118.095 2.054 1
1 29 . 2 1 1 A 4 4 GLU H H 4 8.495 8.114 0.381 1
1 30 . 2 1 1 A 4 4 GLU HA H 4 4.235 4.066 0.169 1
1 35 . 2 1 1 A 4 4 GLU C C 4 175.752 178.309 -2.557 1
1 36 . 2 1 1 A 4 4 GLU CA C 4 58.075 59.242 -1.167 1
1 37 . 2 1 1 A 4 4 GLU CB C 4 30.125 29.329 0.796 1
1 38 . 2 1 1 A 4 4 GLU N N 4 121.543 118.724 2.819 1
1 39 . 2 1 1 A 5 5 LEU HA H 5 4.073 4.257 -0.184 1
1 47 . 2 1 1 A 5 5 LEU CB C 5 41.897 42.883 -0.986 1
1 50 . 2 1 1 A 6 6 GLU H H 6 8.332 8.251 0.081 1
1 51 . 2 1 1 A 6 6 GLU HA H 6 3.621 4.158 -0.537 1
1 52 . 2 1 1 A 6 6 GLU C C 6 176.402 178.576 -2.174 1
1 53 . 2 1 1 A 6 6 GLU CA C 6 58.461 58.735 -0.274 1
1 54 . 2 1 1 A 6 6 GLU CB C 6 29.730 29.751 -0.021 1
1 55 . 2 1 1 A 6 6 GLU N N 6 121.462 119.246 2.216 1
1 56 . 2 1 1 A 7 7 ALA H H 7 8.244 7.674 0.570 1
1 57 . 2 1 1 A 7 7 ALA HA H 7 4.185 4.087 0.098 1
1 61 . 2 1 1 A 7 7 ALA C C 7 177.982 178.152 -0.170 1
1 62 . 2 1 1 A 7 7 ALA CA C 7 54.791 55.390 -0.599 1
1 63 . 2 1 1 A 7 7 ALA CB C 7 18.836 18.999 -0.163 1
1 64 . 2 1 1 A 7 7 ALA N N 7 123.078 122.169 0.909 1
1 65 . 2 1 1 A 8 8 GLN H H 8 8.274 7.793 0.481 1
1 66 . 2 1 1 A 8 8 GLN HA H 8 4.219 4.580 -0.361 1
1 73 . 2 1 1 A 8 8 GLN C C 8 176.325 175.171 1.154 1
1 74 . 2 1 1 A 8 8 GLN CA C 8 57.864 55.366 2.498 1
1 75 . 2 1 1 A 8 8 GLN CB C 8 28.768 29.812 -1.044 1
1 77 . 2 1 1 A 8 8 GLN N N 8 117.452 115.628 1.824 1
1 79 . 2 1 1 A 9 9 THR H H 9 8.043 8.575 -0.532 1
1 80 . 2 1 1 A 9 9 THR HA H 9 3.998 4.676 -0.678 1
1 85 . 2 1 1 A 9 9 THR C C 9 173.904 175.312 -1.408 1
1 86 . 2 1 1 A 9 9 THR CA C 9 65.435 61.272 4.163 1
1 87 . 2 1 1 A 9 9 THR CB C 9 68.870 69.846 -0.976 1
1 89 . 2 1 1 A 9 9 THR N N 9 116.135 118.785 -2.650 1
1 90 . 2 1 1 A 10 10 ARG H H 10 8.095 8.991 -0.896 1
1 91 . 2 1 1 A 10 10 ARG HA H 10 4.040 4.106 -0.066 1
1 98 . 2 1 1 A 10 10 ARG C C 10 176.583 176.263 0.320 1
1 99 . 2 1 1 A 10 10 ARG CA C 10 59.262 57.489 1.773 1
1 100 . 2 1 1 A 10 10 ARG CB C 10 29.900 30.128 -0.228 1
1 101 . 2 1 1 A 10 10 ARG N N 10 121.157 125.257 -4.100 1
1 102 . 2 1 1 A 11 11 VAL H H 11 7.657 7.891 -0.234 1
1 103 . 2 1 1 A 11 11 VAL HA H 11 3.769 4.395 -0.626 1
1 111 . 2 1 1 A 11 11 VAL C C 11 176.662 177.739 -1.077 1
1 112 . 2 1 1 A 11 11 VAL CA C 11 65.914 63.835 2.079 1
1 113 . 2 1 1 A 11 11 VAL CB C 11 31.745 33.523 -1.778 1
1 114 . 2 1 1 A 11 11 VAL N N 11 118.580 118.033 0.547 1
1 115 . 2 1 1 A 12 12 LYS H H 12 7.471 8.413 -0.942 1
1 116 . 2 1 1 A 12 12 LYS HA H 12 3.366 4.287 -0.921 1
1 123 . 2 1 1 A 12 12 LYS C C 12 176.457 179.067 -2.610 1
1 124 . 2 1 1 A 12 12 LYS CA C 12 59.545 59.421 0.124 1
1 125 . 2 1 1 A 12 12 LYS CB C 12 32.206 32.582 -0.376 1
1 126 . 2 1 1 A 12 12 LYS N N 12 121.835 122.597 -0.762 1
1 127 . 2 1 1 A 13 13 LEU H H 13 8.144 8.024 0.120 1
1 128 . 2 1 1 A 13 13 LEU HA H 13 4.093 4.040 0.053 1
1 137 . 2 1 1 A 13 13 LEU C C 13 178.254 179.122 -0.868 1
1 138 . 2 1 1 A 13 13 LEU CA C 13 58.023 58.138 -0.115 1
1 139 . 2 1 1 A 13 13 LEU CB C 13 41.283 41.177 0.106 1
1 140 . 2 1 1 A 13 13 LEU N N 13 118.688 120.630 -1.942 1
1 141 . 2 1 1 A 14 14 ASN H H 14 8.384 8.309 0.075 1
1 142 . 2 1 1 A 14 14 ASN HA H 14 4.567 4.452 0.115 1
1 147 . 2 1 1 A 14 14 ASN C C 14 175.397 177.130 -1.733 1
1 148 . 2 1 1 A 14 14 ASN CA C 14 56.239 56.358 -0.119 1
1 149 . 2 1 1 A 14 14 ASN CB C 14 38.432 39.179 -0.747 1
1 150 . 2 1 1 A 14 14 ASN N N 14 118.175 117.694 0.481 1
1 152 . 2 1 1 A 15 15 TYR H H 15 7.982 7.685 0.297 1
1 153 . 2 1 1 A 15 15 TYR HA H 15 4.249 4.083 0.166 1
1 160 . 2 1 1 A 15 15 TYR C C 15 175.503 177.235 -1.732 1
1 161 . 2 1 1 A 15 15 TYR CA C 15 62.450 61.503 0.947 1
1 162 . 2 1 1 A 15 15 TYR CB C 15 39.399 38.425 0.974 1
1 163 . 2 1 1 A 15 15 TYR N N 15 121.955 120.651 1.304 1
1 164 . 2 1 1 A 16 16 LEU H H 16 8.198 9.087 -0.889 1
1 165 . 2 1 1 A 16 16 LEU HA H 16 4.470 3.885 0.585 1
1 175 . 2 1 1 A 16 16 LEU C C 16 177.125 178.338 -1.213 1
1 176 . 2 1 1 A 16 16 LEU CA C 16 57.374 58.003 -0.629 1
1 177 . 2 1 1 A 16 16 LEU CB C 16 41.443 41.323 0.120 1
1 178 . 2 1 1 A 16 16 LEU N N 16 117.642 120.145 -2.503 1
1 179 . 2 1 1 A 17 17 ASP H H 17 8.061 8.348 -0.287 1
1 180 . 2 1 1 A 17 17 ASP C C 17 177.836 178.144 -0.308 1
1 181 . 2 1 1 A 17 17 ASP CA C 17 57.486 57.685 -0.199 1
1 182 . 2 1 1 A 17 17 ASP CB C 17 41.433 41.935 -0.502 1
1 183 . 2 1 1 A 17 17 ASP N N 17 118.700 119.135 -0.435 1
1 184 . 2 1 1 A 18 18 GLN H H 18 8.111 8.113 -0.002 1
1 185 . 2 1 1 A 18 18 GLN HA H 18 4.002 4.135 -0.133 1
1 190 . 2 1 1 A 18 18 GLN CA C 18 59.046 58.626 0.420 1
1 191 . 2 1 1 A 18 18 GLN CB C 18 28.700 28.121 0.579 1
1 193 . 2 1 1 A 18 18 GLN N N 18 119.539 116.974 2.565 1
1 195 . 2 1 1 A 19 19 ILE H H 19 8.330 8.049 0.281 1
1 196 . 2 1 1 A 19 19 ILE HA H 19 3.306 3.934 -0.628 1
1 204 . 2 1 1 A 19 19 ILE C C 19 175.608 177.480 -1.872 1
1 205 . 2 1 1 A 19 19 ILE CA C 19 64.760 63.080 1.680 1
1 206 . 2 1 1 A 19 19 ILE CB C 19 37.148 37.071 0.077 1
1 209 . 2 1 1 A 19 19 ILE N N 19 121.490 121.595 -0.105 1
1 210 . 2 1 1 A 20 20 ALA H H 20 8.057 7.993 0.064 1
1 211 . 2 1 1 A 20 20 ALA HA H 20 4.349 4.286 0.063 1
1 215 . 2 1 1 A 20 20 ALA C C 20 179.297 179.304 -0.007 1
1 216 . 2 1 1 A 20 20 ALA CA C 20 56.150 55.029 1.121 1
1 217 . 2 1 1 A 20 20 ALA CB C 20 18.104 19.179 -1.075 1
1 218 . 2 1 1 A 20 20 ALA N N 20 124.441 123.851 0.590 1
1 219 . 2 1 1 A 21 21 LYS H H 21 8.116 7.943 0.173 1
1 220 . 2 1 1 A 21 21 LYS HA H 21 4.108 4.042 0.066 1
1 229 . 2 1 1 A 21 21 LYS C C 21 176.720 178.470 -1.750 1
1 230 . 2 1 1 A 21 21 LYS CA C 21 59.166 59.704 -0.538 1
1 231 . 2 1 1 A 21 21 LYS CB C 21 32.085 32.364 -0.279 1
1 233 . 2 1 1 A 21 21 LYS N N 21 119.865 119.245 0.620 1
1 234 . 2 1 1 A 22 22 PHE H H 22 7.875 7.946 -0.071 1
1 235 . 2 1 1 A 22 22 PHE HA H 22 4.012 4.135 -0.123 1
1 242 . 2 1 1 A 22 22 PHE C C 22 175.545 177.565 -2.020 1
1 243 . 2 1 1 A 22 22 PHE CA C 22 61.070 61.380 -0.310 1
1 244 . 2 1 1 A 22 22 PHE CB C 22 39.072 39.103 -0.031 1
1 249 . 2 1 1 A 22 22 PHE N N 22 119.729 119.982 -0.253 1
1 250 . 2 1 1 A 23 23 TRP H H 23 7.841 7.860 -0.019 1
1 251 . 2 1 1 A 23 23 TRP HA H 23 4.149 3.961 0.188 1
1 260 . 2 1 1 A 23 23 TRP C C 23 176.668 178.269 -1.601 1
1 261 . 2 1 1 A 23 23 TRP CB C 23 28.543 29.777 -1.234 1
1 267 . 2 1 1 A 23 23 TRP N N 23 119.440 120.679 -1.239 1
1 269 . 2 1 1 A 24 24 GLU H H 24 8.261 8.489 -0.228 1
1 270 . 2 1 1 A 24 24 GLU HA H 24 4.265 4.086 0.179 1
1 275 . 2 1 1 A 24 24 GLU C C 24 179.679 178.039 1.640 1
1 276 . 2 1 1 A 24 24 GLU CA C 24 59.706 58.659 1.047 1
1 277 . 2 1 1 A 24 24 GLU CB C 24 29.720 29.484 0.236 1
1 279 . 2 1 1 A 24 24 GLU N N 24 121.376 118.529 2.847 1
1 280 . 2 1 1 A 25 25 ILE H H 25 8.071 7.293 0.778 1
1 281 . 2 1 1 A 25 25 ILE HA H 25 3.815 3.974 -0.159 1
1 291 . 2 1 1 A 25 25 ILE C C 25 176.343 176.699 -0.356 1
1 292 . 2 1 1 A 25 25 ILE CA C 25 64.464 61.331 3.133 1
1 293 . 2 1 1 A 25 25 ILE CB C 25 37.371 37.959 -0.588 1
1 296 . 2 1 1 A 25 25 ILE N N 25 121.499 118.367 3.132 1
1 297 . 2 1 1 A 26 26 GLN H H 26 7.327 6.946 0.381 1
1 298 . 2 1 1 A 26 26 GLN HA H 26 4.074 4.110 -0.036 1
1 305 . 2 1 1 A 26 26 GLN C C 26 174.906 175.238 -0.332 1
1 306 . 2 1 1 A 26 26 GLN CA C 26 55.450 54.911 0.539 1
1 307 . 2 1 1 A 26 26 GLN CB C 26 28.458 28.314 0.144 1
1 309 . 2 1 1 A 26 26 GLN N N 26 116.532 120.303 -3.771 1
1 311 . 2 1 1 A 27 27 GLY H H 27 7.861 8.080 -0.219 1
1 312 . 2 1 1 A 27 27 GLY HA2 H 27 4.297 3.744 0.553 1
1 313 . 2 1 1 A 27 27 GLY HA3 H 27 3.823 3.746 0.077 1
1 314 . 2 1 1 A 27 27 GLY C C 27 172.698 173.183 -0.485 1
1 315 . 2 1 1 A 27 27 GLY CA C 27 45.608 45.952 -0.344 1
1 316 . 2 1 1 A 27 27 GLY N N 27 106.837 108.893 -2.056 1
1 317 . 2 1 1 A 28 28 SER H H 28 8.083 7.301 0.782 1
1 318 . 2 1 1 A 28 28 SER HA H 28 4.777 4.743 0.034 1
1 321 . 2 1 1 A 28 28 SER C C 28 171.196 171.732 -0.536 1
1 322 . 2 1 1 A 28 28 SER CA C 28 56.041 56.847 -0.806 1
1 323 . 2 1 1 A 28 28 SER CB C 28 64.539 66.716 -2.177 1
1 324 . 2 1 1 A 28 28 SER N N 28 116.151 114.355 1.796 1
1 325 . 2 1 1 A 29 29 SER H H 29 8.354 8.530 -0.176 1
1 326 . 2 1 1 A 29 29 SER HA H 29 4.389 5.073 -0.684 1
1 329 . 2 1 1 A 29 29 SER C C 29 172.166 172.733 -0.567 1
1 330 . 2 1 1 A 29 29 SER CA C 29 58.107 56.532 1.575 1
1 331 . 2 1 1 A 29 29 SER CB C 29 63.853 66.077 -2.224 1
1 332 . 2 1 1 A 29 29 SER N N 29 116.596 114.478 2.118 1
1 333 . 2 1 1 A 30 30 LEU H H 30 8.990 8.532 0.458 1
1 334 . 2 1 1 A 30 30 LEU HA H 30 3.964 4.954 -0.990 1
1 344 . 2 1 1 A 30 30 LEU C C 30 173.752 175.720 -1.968 1
1 345 . 2 1 1 A 30 30 LEU CA C 30 55.193 55.685 -0.492 1
1 346 . 2 1 1 A 30 30 LEU CB C 30 42.869 42.610 0.259 1
1 349 . 2 1 1 A 30 30 LEU N N 30 125.860 127.071 -1.211 1
1 350 . 2 1 1 A 31 31 LYS H H 31 8.118 9.083 -0.965 1
1 351 . 2 1 1 A 31 31 LYS HA H 31 4.498 4.995 -0.497 1
1 360 . 2 1 1 A 31 31 LYS C C 31 173.555 174.948 -1.393 1
1 361 . 2 1 1 A 31 31 LYS CA C 31 54.372 54.966 -0.594 1
1 362 . 2 1 1 A 31 31 LYS CB C 31 32.814 34.097 -1.283 1
1 365 . 2 1 1 A 31 31 LYS N N 31 129.965 128.182 1.783 1
1 366 . 2 1 1 A 32 32 ILE H H 32 8.717 8.679 0.038 1
1 367 . 2 1 1 A 32 32 ILE HA H 32 4.011 4.569 -0.558 1
1 377 . 2 1 1 A 32 32 ILE C C 32 173.038 174.230 -1.192 1
1 378 . 2 1 1 A 32 32 ILE CA C 32 59.921 58.015 1.906 1
1 379 . 2 1 1 A 32 32 ILE CB C 32 38.139 38.470 -0.331 1
1 382 . 2 1 1 A 32 32 ILE N N 32 127.091 121.850 5.241 1
1 383 . 2 1 1 A 33 33 PRO HA H 33 4.412 4.521 -0.109 1
1 390 . 2 1 1 A 33 33 PRO C C 33 172.724 176.249 -3.525 1
1 391 . 2 1 1 A 33 33 PRO CA C 33 62.565 62.349 0.216 1
1 392 . 2 1 1 A 33 33 PRO CB C 33 32.728 32.564 0.164 1
1 394 . 2 1 1 A 34 34 ASN H H 34 8.265 8.482 -0.217 1
1 395 . 2 1 1 A 34 34 ASN HA H 34 5.147 5.327 -0.180 1
1 400 . 2 1 1 A 34 34 ASN C C 34 174.079 173.468 0.611 1
1 401 . 2 1 1 A 34 34 ASN CA C 34 52.088 51.780 0.308 1
1 402 . 2 1 1 A 34 34 ASN CB C 34 40.387 40.878 -0.491 1
1 403 . 2 1 1 A 34 34 ASN N N 34 116.424 117.313 -0.889 1
1 405 . 2 1 1 A 35 35 VAL H H 35 8.904 9.145 -0.241 1
1 406 . 2 1 1 A 35 35 VAL HA H 35 4.159 4.617 -0.458 1
1 414 . 2 1 1 A 35 35 VAL C C 35 173.834 175.066 -1.232 1
1 415 . 2 1 1 A 35 35 VAL CA C 35 61.953 59.553 2.400 1
1 416 . 2 1 1 A 35 35 VAL CB C 35 34.432 34.527 -0.095 1
1 419 . 2 1 1 A 35 35 VAL N N 35 122.778 122.410 0.368 1
1 420 . 2 1 1 A 36 36 GLU H H 36 9.560 9.533 0.027 1
1 421 . 2 1 1 A 36 36 GLU HA H 36 3.819 4.030 -0.211 1
1 426 . 2 1 1 A 36 36 GLU C C 36 173.604 176.354 -2.750 1
1 427 . 2 1 1 A 36 36 GLU CA C 36 57.131 58.016 -0.885 1
1 428 . 2 1 1 A 36 36 GLU CB C 36 27.464 28.098 -0.634 1
1 430 . 2 1 1 A 36 36 GLU N N 36 127.014 128.849 -1.835 1
1 431 . 2 1 1 A 37 37 ARG H H 37 8.578 8.649 -0.071 1
1 432 . 2 1 1 A 37 37 ARG HA H 37 3.792 3.989 -0.197 1
1 439 . 2 1 1 A 37 37 ARG C C 37 173.371 175.322 -1.951 1
1 440 . 2 1 1 A 37 37 ARG CA C 37 57.952 57.387 0.565 1
1 441 . 2 1 1 A 37 37 ARG CB C 37 27.657 27.964 -0.307 1
1 443 . 2 1 1 A 37 37 ARG N N 37 108.362 117.435 -9.073 1
1 444 . 2 1 1 A 38 38 ARG H H 38 7.696 7.861 -0.165 1
1 445 . 2 1 1 A 38 38 ARG HA H 38 4.743 4.942 -0.199 1
1 452 . 2 1 1 A 38 38 ARG C C 38 173.513 175.437 -1.924 1
1 453 . 2 1 1 A 38 38 ARG CA C 38 54.507 54.608 -0.101 1
1 454 . 2 1 1 A 38 38 ARG CB C 38 33.751 33.416 0.335 1
1 456 . 2 1 1 A 38 38 ARG N N 38 118.370 121.223 -2.853 1
1 457 . 2 1 1 A 39 39 ILE H H 39 8.463 8.435 0.028 1
1 458 . 2 1 1 A 39 39 ILE HA H 39 4.184 4.212 -0.028 1
1 468 . 2 1 1 A 39 39 ILE C C 39 175.150 175.797 -0.647 1
1 469 . 2 1 1 A 39 39 ILE CA C 39 62.076 61.905 0.171 1
1 470 . 2 1 1 A 39 39 ILE CB C 39 38.864 39.416 -0.552 1
1 473 . 2 1 1 A 39 39 ILE N N 39 123.604 126.311 -2.707 1
1 474 . 2 1 1 A 40 40 LEU H H 40 8.239 8.189 0.050 1
1 475 . 2 1 1 A 40 40 LEU HA H 40 4.259 4.683 -0.424 1
1 485 . 2 1 1 A 40 40 LEU C C 40 173.152 174.701 -1.549 1
1 486 . 2 1 1 A 40 40 LEU CA C 40 55.305 55.005 0.300 1
1 487 . 2 1 1 A 40 40 LEU CB C 40 43.113 42.492 0.621 1
1 490 . 2 1 1 A 40 40 LEU N N 40 129.550 128.744 0.806 1
1 491 . 2 1 1 A 41 41 ASP H H 41 8.992 9.068 -0.076 1
1 492 . 2 1 1 A 41 41 ASP HA H 41 4.798 4.790 0.008 1
1 495 . 2 1 1 A 41 41 ASP C C 41 173.837 176.175 -2.338 1
1 496 . 2 1 1 A 41 41 ASP CA C 41 52.077 53.757 -1.680 1
1 497 . 2 1 1 A 41 41 ASP CB C 41 39.454 38.982 0.472 1
1 498 . 2 1 1 A 41 41 ASP N N 41 127.022 127.355 -0.333 1
1 499 . 2 1 1 A 42 42 LEU H H 42 7.912 8.244 -0.332 1
1 500 . 2 1 1 A 42 42 LEU HA H 42 3.970 4.091 -0.121 1
1 510 . 2 1 1 A 42 42 LEU C C 42 176.305 177.639 -1.334 1
1 511 . 2 1 1 A 42 42 LEU CA C 42 58.128 57.867 0.261 1
1 512 . 2 1 1 A 42 42 LEU CB C 42 43.043 41.642 1.401 1
1 514 . 2 1 1 A 42 42 LEU N N 42 125.064 125.844 -0.780 1
1 515 . 2 1 1 A 43 43 TYR H H 43 8.565 8.272 0.293 1
1 516 . 2 1 1 A 43 43 TYR HA H 43 3.728 3.823 -0.095 1
1 523 . 2 1 1 A 43 43 TYR C C 43 175.757 176.784 -1.027 1
1 524 . 2 1 1 A 43 43 TYR CA C 43 61.774 61.880 -0.106 1
1 525 . 2 1 1 A 43 43 TYR CB C 43 38.235 38.499 -0.264 1
1 528 . 2 1 1 A 43 43 TYR N N 43 117.822 120.254 -2.432 1
1 529 . 2 1 1 A 44 44 SER H H 44 8.115 8.161 -0.046 1
1 530 . 2 1 1 A 44 44 SER HA H 44 3.854 4.128 -0.274 1
1 533 . 2 1 1 A 44 44 SER C C 44 174.080 176.136 -2.056 1
1 534 . 2 1 1 A 44 44 SER CA C 44 61.873 61.892 -0.019 1
1 535 . 2 1 1 A 44 44 SER CB C 44 64.350 62.876 1.474 1
1 536 . 2 1 1 A 44 44 SER N N 44 116.835 115.361 1.474 1
1 537 . 2 1 1 A 45 45 LEU H H 45 8.401 8.224 0.177 1
1 538 . 2 1 1 A 45 45 LEU HA H 45 4.102 4.199 -0.097 1
1 548 . 2 1 1 A 45 45 LEU C C 45 175.081 178.630 -3.549 1
1 549 . 2 1 1 A 45 45 LEU CA C 45 58.896 58.080 0.816 1
1 550 . 2 1 1 A 45 45 LEU CB C 45 41.741 41.608 0.133 1
1 553 . 2 1 1 A 45 45 LEU N N 45 120.621 123.248 -2.627 1
1 554 . 2 1 1 A 46 46 SER H H 46 8.110 8.505 -0.395 1
1 555 . 2 1 1 A 46 46 SER HA H 46 4.300 4.288 0.012 1
1 558 . 2 1 1 A 46 46 SER C C 46 175.019 176.564 -1.545 1
1 559 . 2 1 1 A 46 46 SER CA C 46 62.610 61.548 1.062 1
1 560 . 2 1 1 A 46 46 SER CB C 46 64.092 62.652 1.440 1
1 561 . 2 1 1 A 46 46 SER N N 46 112.826 113.789 -0.963 1
1 562 . 2 1 1 A 47 47 LYS H H 47 7.732 8.023 -0.291 1
1 563 . 2 1 1 A 47 47 LYS HA H 47 3.900 4.148 -0.248 1
1 572 . 2 1 1 A 47 47 LYS C C 47 177.441 178.865 -1.424 1
1 573 . 2 1 1 A 47 47 LYS CA C 47 58.575 59.114 -0.539 1
1 574 . 2 1 1 A 47 47 LYS CB C 47 32.351 31.735 0.616 1
1 576 . 2 1 1 A 47 47 LYS N N 47 121.210 119.238 1.972 1
1 577 . 2 1 1 A 48 48 ILE H H 48 8.672 8.269 0.403 1
1 578 . 2 1 1 A 48 48 ILE HA H 48 3.628 3.748 -0.120 1
1 588 . 2 1 1 A 48 48 ILE C C 48 175.861 178.324 -2.463 1
1 589 . 2 1 1 A 48 48 ILE CA C 48 64.188 64.934 -0.746 1
1 590 . 2 1 1 A 48 48 ILE CB C 48 37.954 37.262 0.692 1
1 593 . 2 1 1 A 48 48 ILE N N 48 120.810 121.029 -0.219 1
1 594 . 2 1 1 A 49 49 VAL H H 49 8.030 8.152 -0.122 1
1 595 . 2 1 1 A 49 49 VAL HA H 49 3.195 3.640 -0.445 1
1 603 . 2 1 1 A 49 49 VAL C C 49 176.513 178.648 -2.135 1
1 604 . 2 1 1 A 49 49 VAL CA C 49 66.760 67.102 -0.342 1
1 605 . 2 1 1 A 49 49 VAL CB C 49 30.935 31.696 -0.761 1
1 608 . 2 1 1 A 49 49 VAL N N 49 119.350 119.965 -0.615 1
1 609 . 2 1 1 A 50 50 VAL H H 50 7.336 8.276 -0.940 1
1 610 . 2 1 1 A 50 50 VAL HA H 50 3.497 3.517 -0.020 1
1 618 . 2 1 1 A 50 50 VAL C C 50 178.745 177.411 1.334 1
1 619 . 2 1 1 A 50 50 VAL CA C 50 67.384 66.841 0.543 1
1 620 . 2 1 1 A 50 50 VAL CB C 50 31.832 31.412 0.420 1
1 621 . 2 1 1 A 50 50 VAL N N 50 118.610 120.420 -1.810 1
1 622 . 2 1 1 A 51 51 GLU H H 51 8.318 8.594 -0.276 1
1 623 . 2 1 1 A 51 51 GLU HA H 51 3.953 4.032 -0.079 1
1 628 . 2 1 1 A 51 51 GLU C C 51 177.281 179.174 -1.893 1
1 629 . 2 1 1 A 51 51 GLU CA C 51 59.668 59.492 0.176 1
1 630 . 2 1 1 A 51 51 GLU CB C 51 30.131 29.106 1.025 1
1 632 . 2 1 1 A 51 51 GLU N N 51 122.096 118.694 3.402 1
1 633 . 2 1 1 A 52 52 GLU H H 52 8.065 7.968 0.097 1
1 634 . 2 1 1 A 52 52 GLU HA H 52 4.229 4.316 -0.087 1
1 639 . 2 1 1 A 52 52 GLU C C 52 173.534 176.536 -3.002 1
1 640 . 2 1 1 A 52 52 GLU CA C 52 55.547 57.225 -1.678 1
1 641 . 2 1 1 A 52 52 GLU CB C 52 28.716 30.182 -1.466 1
1 643 . 2 1 1 A 52 52 GLU N N 52 114.992 117.895 -2.903 1
1 644 . 2 1 1 A 53 53 GLY H H 53 7.459 8.573 -1.114 1
1 645 . 2 1 1 A 53 53 GLY HA2 H 53 3.630 3.953 -0.323 1
1 646 . 2 1 1 A 53 53 GLY HA3 H 53 3.630 3.969 -0.339 1
1 647 . 2 1 1 A 53 53 GLY C C 53 173.214 173.732 -0.518 1
1 648 . 2 1 1 A 53 53 GLY CA C 53 44.962 45.116 -0.154 1
1 649 . 2 1 1 A 53 53 GLY N N 53 104.909 107.794 -2.885 1
1 650 . 2 1 1 A 54 54 GLY H H 54 8.533 7.725 0.808 1
1 651 . 2 1 1 A 54 54 GLY HA2 H 54 3.548 4.041 -0.493 1
1 652 . 2 1 1 A 54 54 GLY HA3 H 54 4.521 4.083 0.438 1
1 653 . 2 1 1 A 54 54 GLY C C 54 169.966 174.504 -4.538 1
1 654 . 2 1 1 A 54 54 GLY CA C 54 43.988 45.729 -1.741 1
1 655 . 2 1 1 A 54 54 GLY N N 54 110.587 108.333 2.254 1
1 656 . 2 1 1 A 55 55 TYR H H 55 8.704 9.066 -0.362 1
1 657 . 2 1 1 A 55 55 TYR HA H 55 3.618 3.925 -0.307 1
1 664 . 2 1 1 A 55 55 TYR C C 55 174.807 177.384 -2.577 1
1 665 . 2 1 1 A 55 55 TYR CA C 55 62.540 61.360 1.180 1
1 666 . 2 1 1 A 55 55 TYR CB C 55 39.669 39.215 0.454 1
1 669 . 2 1 1 A 55 55 TYR N N 55 119.168 123.600 -4.432 1
1 670 . 2 1 1 A 56 56 GLU H H 56 9.006 8.088 0.918 1
1 671 . 2 1 1 A 56 56 GLU HA H 56 3.638 3.811 -0.173 1
1 676 . 2 1 1 A 56 56 GLU C C 56 177.400 178.501 -1.101 1
1 677 . 2 1 1 A 56 56 GLU CA C 56 60.530 59.178 1.352 1
1 678 . 2 1 1 A 56 56 GLU CB C 56 29.168 29.222 -0.054 1
1 679 . 2 1 1 A 56 56 GLU N N 56 118.969 119.535 -0.566 1
1 680 . 2 1 1 A 57 57 ALA H H 57 8.235 7.839 0.396 1
1 681 . 2 1 1 A 57 57 ALA HA H 57 3.980 4.005 -0.025 1
1 685 . 2 1 1 A 57 57 ALA C C 57 177.678 179.657 -1.979 1
1 686 . 2 1 1 A 57 57 ALA CA C 57 54.910 55.002 -0.092 1
1 687 . 2 1 1 A 57 57 ALA CB C 57 18.122 18.270 -0.148 1
1 688 . 2 1 1 A 57 57 ALA N N 57 122.860 121.862 0.998 1
1 689 . 2 1 1 A 58 58 ILE H H 58 7.831 7.468 0.363 1
1 690 . 2 1 1 A 58 58 ILE HA H 58 3.189 3.105 0.084 1
1 700 . 2 1 1 A 58 58 ILE C C 58 177.818 176.663 1.155 1
1 701 . 2 1 1 A 58 58 ILE CA C 58 65.074 65.706 -0.632 1
1 702 . 2 1 1 A 58 58 ILE CB C 58 38.178 37.287 0.891 1
1 706 . 2 1 1 A 58 58 ILE N N 58 117.418 119.154 -1.736 1
1 707 . 2 1 1 A 59 59 CYS H H 59 7.760 8.056 -0.296 1
1 708 . 2 1 1 A 59 59 CYS HA H 59 4.203 4.182 0.021 1
1 711 . 2 1 1 A 59 59 CYS C C 59 176.357 176.792 -0.435 1
1 712 . 2 1 1 A 59 59 CYS CA C 59 63.760 62.647 1.113 1
1 713 . 2 1 1 A 59 59 CYS CB C 59 27.638 26.839 0.799 1
1 714 . 2 1 1 A 59 59 CYS N N 59 115.302 120.752 -5.450 1
1 715 . 2 1 1 A 60 60 LYS H H 60 8.350 8.057 0.293 1
1 716 . 2 1 1 A 60 60 LYS HA H 60 3.972 3.910 0.062 1
1 725 . 2 1 1 A 60 60 LYS C C 60 176.373 177.875 -1.502 1
1 726 . 2 1 1 A 60 60 LYS CA C 60 59.796 59.519 0.277 1
1 727 . 2 1 1 A 60 60 LYS CB C 60 32.560 32.376 0.184 1
1 729 . 2 1 1 A 60 60 LYS N N 60 122.343 120.883 1.460 1
1 730 . 2 1 1 A 61 61 ASP H H 61 8.157 7.601 0.556 1
1 731 . 2 1 1 A 61 61 ASP HA H 61 4.616 4.650 -0.034 1
1 734 . 2 1 1 A 61 61 ASP C C 61 173.246 175.500 -2.254 1
1 735 . 2 1 1 A 61 61 ASP CA C 61 54.272 53.841 0.431 1
1 736 . 2 1 1 A 61 61 ASP CB C 61 41.023 40.990 0.033 1
1 737 . 2 1 1 A 61 61 ASP N N 61 116.173 118.434 -2.261 1
1 738 . 2 1 1 A 62 62 ARG H H 62 7.655 7.597 0.058 1
1 739 . 2 1 1 A 62 62 ARG HA H 62 4.149 3.990 0.159 1
1 746 . 2 1 1 A 62 62 ARG C C 62 175.891 176.057 -0.166 1
1 747 . 2 1 1 A 62 62 ARG CA C 62 57.381 57.084 0.297 1
1 748 . 2 1 1 A 62 62 ARG CB C 62 26.538 27.164 -0.626 1
1 750 . 2 1 1 A 62 62 ARG N N 62 117.213 115.843 1.370 1
1 751 . 2 1 1 A 63 63 ARG H H 63 8.302 7.972 0.330 1
1 752 . 2 1 1 A 63 63 ARG HA H 63 4.240 4.180 0.060 1
1 757 . 2 1 1 A 63 63 ARG C C 63 175.775 177.858 -2.083 1
1 758 . 2 1 1 A 63 63 ARG CA C 63 55.718 57.273 -1.555 1
1 760 . 2 1 1 A 63 63 ARG N N 63 116.292 117.068 -0.776 1
1 761 . 2 1 1 A 64 64 TRP H H 64 8.161 7.406 0.755 1
1 762 . 2 1 1 A 64 64 TRP HA H 64 3.836 4.413 -0.577 1
1 771 . 2 1 1 A 64 64 TRP C C 64 176.862 178.579 -1.717 1
1 772 . 2 1 1 A 64 64 TRP CA C 64 62.036 59.717 2.319 1
1 773 . 2 1 1 A 64 64 TRP CB C 64 27.028 29.102 -2.074 1
1 779 . 2 1 1 A 64 64 TRP N N 64 121.486 120.123 1.363 1
1 781 . 2 1 1 A 65 65 ALA H H 65 8.954 8.007 0.947 1
1 782 . 2 1 1 A 65 65 ALA HA H 65 4.290 4.102 0.188 1
1 786 . 2 1 1 A 65 65 ALA C C 65 178.986 179.576 -0.590 1
1 787 . 2 1 1 A 65 65 ALA CA C 65 55.314 55.396 -0.082 1
1 788 . 2 1 1 A 65 65 ALA CB C 65 18.119 18.211 -0.092 1
1 789 . 2 1 1 A 65 65 ALA N N 65 121.559 122.733 -1.174 1
1 790 . 2 1 1 A 66 66 ARG H H 66 7.473 7.777 -0.304 1
1 791 . 2 1 1 A 66 66 ARG HA H 66 4.221 4.114 0.107 1
1 798 . 2 1 1 A 66 66 ARG C C 66 176.670 178.623 -1.953 1
1 799 . 2 1 1 A 66 66 ARG CA C 66 57.871 59.017 -1.146 1
1 800 . 2 1 1 A 66 66 ARG CB C 66 29.097 29.843 -0.746 1
1 801 . 2 1 1 A 66 66 ARG N N 66 119.915 117.277 2.638 1
1 802 . 2 1 1 A 67 67 VAL H H 67 7.134 7.838 -0.704 1
1 803 . 2 1 1 A 67 67 VAL HA H 67 3.304 3.651 -0.347 1
1 811 . 2 1 1 A 67 67 VAL C C 67 175.341 177.951 -2.610 1
1 812 . 2 1 1 A 67 67 VAL CA C 67 66.722 66.779 -0.057 1
1 813 . 2 1 1 A 67 67 VAL CB C 67 31.108 31.660 -0.552 1
1 816 . 2 1 1 A 67 67 VAL N N 67 119.970 120.855 -0.885 1
1 817 . 2 1 1 A 68 68 ALA H H 68 7.745 8.494 -0.749 1
1 818 . 2 1 1 A 68 68 ALA HA H 68 4.076 4.238 -0.162 1
1 822 . 2 1 1 A 68 68 ALA C C 68 177.358 180.291 -2.933 1
1 823 . 2 1 1 A 68 68 ALA CA C 68 55.607 56.061 -0.454 1
1 824 . 2 1 1 A 68 68 ALA CB C 68 18.061 18.752 -0.691 1
1 825 . 2 1 1 A 68 68 ALA N N 68 118.239 122.124 -3.885 1
1 826 . 2 1 1 A 69 69 GLN H H 69 7.979 8.344 -0.365 1
1 827 . 2 1 1 A 69 69 GLN HA H 69 4.310 4.094 0.216 1
1 834 . 2 1 1 A 69 69 GLN C C 69 179.370 178.667 0.703 1
1 835 . 2 1 1 A 69 69 GLN CA C 69 59.307 58.749 0.558 1
1 836 . 2 1 1 A 69 69 GLN CB C 69 29.257 28.633 0.624 1
1 838 . 2 1 1 A 69 69 GLN N N 69 118.484 117.489 0.995 1
1 840 . 2 1 1 A 70 70 ARG H H 70 8.374 8.011 0.363 1
1 841 . 2 1 1 A 70 70 ARG HA H 70 4.148 4.088 0.060 1
1 848 . 2 1 1 A 70 70 ARG C C 70 175.850 177.817 -1.967 1
1 849 . 2 1 1 A 70 70 ARG CA C 70 58.957 58.615 0.342 1
1 850 . 2 1 1 A 70 70 ARG CB C 70 29.799 30.276 -0.477 1
1 852 . 2 1 1 A 70 70 ARG N N 70 120.309 120.424 -0.115 1
1 853 . 2 1 1 A 71 71 LEU H H 71 7.413 7.700 -0.287 1
1 854 . 2 1 1 A 71 71 LEU HA H 71 4.341 4.159 0.182 1
1 864 . 2 1 1 A 71 71 LEU C C 71 173.391 176.270 -2.879 1
1 865 . 2 1 1 A 71 71 LEU CA C 71 54.911 54.606 0.305 1
1 866 . 2 1 1 A 71 71 LEU CB C 71 42.693 41.544 1.149 1
1 867 . 2 1 1 A 71 71 LEU N N 71 118.841 117.483 1.358 1
1 868 . 2 1 1 A 72 72 ASN H H 72 8.038 8.010 0.028 1
1 869 . 2 1 1 A 72 72 ASN HA H 72 4.394 4.440 -0.046 1
1 874 . 2 1 1 A 72 72 ASN C C 72 173.042 174.350 -1.308 1
1 875 . 2 1 1 A 72 72 ASN CB C 72 36.412 36.399 0.013 1
1 876 . 2 1 1 A 72 72 ASN N N 72 112.919 116.564 -3.645 1
1 878 . 2 1 1 A 73 73 TYR H H 73 7.874 7.551 0.323 1
1 879 . 2 1 1 A 73 73 TYR HA H 73 4.868 4.574 0.294 1
1 886 . 2 1 1 A 73 73 TYR C C 73 172.194 174.124 -1.930 1
1 887 . 2 1 1 A 73 73 TYR CA C 73 57.105 56.857 0.248 1
1 888 . 2 1 1 A 73 73 TYR CB C 73 37.918 38.080 -0.162 1
1 889 . 2 1 1 A 73 73 TYR N N 73 117.432 120.170 -2.738 1
1 897 . 2 1 1 A 75 75 PRO HA H 75 4.626 4.251 0.375 1
1 902 . 2 1 1 A 75 75 PRO C C 75 175.728 177.273 -1.545 1
1 903 . 2 1 1 A 75 75 PRO CA C 75 62.502 63.782 -1.280 1
1 904 . 2 1 1 A 75 75 PRO CB C 75 32.339 31.936 0.403 1
1 905 . 2 1 1 A 76 76 GLY H H 76 8.369 8.889 -0.520 1
1 906 . 2 1 1 A 76 76 GLY HA2 H 76 4.057 3.928 0.129 1
1 907 . 2 1 1 A 76 76 GLY HA3 H 76 4.556 3.929 0.627 1
1 908 . 2 1 1 A 76 76 GLY C C 76 173.248 175.011 -1.763 1
1 909 . 2 1 1 A 76 76 GLY CA C 76 46.180 45.399 0.781 1
1 910 . 2 1 1 A 76 76 GLY N N 76 106.185 111.128 -4.943 1
1 911 . 2 1 1 A 77 77 LYS H H 77 8.632 8.247 0.385 1
1 912 . 2 1 1 A 77 77 LYS HA H 77 4.433 4.081 0.352 1
1 921 . 2 1 1 A 77 77 LYS C C 77 174.924 176.215 -1.291 1
1 922 . 2 1 1 A 77 77 LYS CA C 77 56.453 57.641 -1.188 1
1 923 . 2 1 1 A 77 77 LYS CB C 77 33.170 29.225 3.945 1
1 925 . 2 1 1 A 77 77 LYS N N 77 119.592 116.025 3.567 1
1 926 . 2 1 1 A 78 78 ASN H H 78 8.865 8.087 0.778 1
1 927 . 2 1 1 A 78 78 ASN HA H 78 4.654 4.522 0.132 1
1 932 . 2 1 1 A 78 78 ASN C C 78 174.869 177.573 -2.704 1
1 933 . 2 1 1 A 78 78 ASN CA C 78 54.117 56.388 -2.271 1
1 934 . 2 1 1 A 78 78 ASN CB C 78 37.841 38.984 -1.143 1
1 935 . 2 1 1 A 78 78 ASN N N 78 116.880 116.858 0.022 1
1 937 . 2 1 1 A 79 79 ILE H H 79 8.008 8.263 -0.255 1
1 938 . 2 1 1 A 79 79 ILE HA H 79 3.718 3.759 -0.041 1
1 948 . 2 1 1 A 79 79 ILE C C 79 175.921 178.260 -2.339 1
1 949 . 2 1 1 A 79 79 ILE CA C 79 63.618 64.649 -1.031 1
1 950 . 2 1 1 A 79 79 ILE CB C 79 37.158 36.908 0.250 1
1 952 . 2 1 1 A 79 79 ILE N N 79 119.688 118.819 0.869 1
1 953 . 2 1 1 A 80 80 GLY H H 80 9.062 8.114 0.948 1
1 954 . 2 1 1 A 80 80 GLY HA2 H 80 3.739 3.854 -0.115 1
1 955 . 2 1 1 A 80 80 GLY HA3 H 80 3.739 3.859 -0.120 1
1 956 . 2 1 1 A 80 80 GLY C C 80 173.185 176.065 -2.880 1
1 957 . 2 1 1 A 80 80 GLY CA C 80 48.166 47.590 0.576 1
1 958 . 2 1 1 A 80 80 GLY N N 80 110.338 109.052 1.286 1
1 959 . 2 1 1 A 81 81 SER H H 81 7.460 8.259 -0.799 1
1 960 . 2 1 1 A 81 81 SER HA H 81 3.904 4.092 -0.188 1
1 963 . 2 1 1 A 81 81 SER C C 81 174.999 176.511 -1.512 1
1 964 . 2 1 1 A 81 81 SER CA C 81 61.138 61.540 -0.402 1
1 965 . 2 1 1 A 81 81 SER CB C 81 62.740 62.368 0.372 1
1 966 . 2 1 1 A 81 81 SER N N 81 115.348 117.244 -1.896 1
1 967 . 2 1 1 A 82 82 LEU H H 82 7.367 8.008 -0.641 1
1 968 . 2 1 1 A 82 82 LEU HA H 82 3.946 4.063 -0.117 1
1 977 . 2 1 1 A 82 82 LEU C C 82 176.969 178.132 -1.163 1
1 978 . 2 1 1 A 82 82 LEU CA C 82 57.504 58.194 -0.690 1
1 979 . 2 1 1 A 82 82 LEU CB C 82 42.185 41.464 0.721 1
1 980 . 2 1 1 A 82 82 LEU N N 82 124.267 124.237 0.030 1
1 981 . 2 1 1 A 83 83 LEU H H 83 8.330 8.239 0.091 1
1 982 . 2 1 1 A 83 83 LEU HA H 83 3.924 3.981 -0.057 1
1 991 . 2 1 1 A 83 83 LEU C C 83 176.303 178.432 -2.129 1
1 992 . 2 1 1 A 83 83 LEU CA C 83 58.067 58.600 -0.533 1
1 993 . 2 1 1 A 83 83 LEU CB C 83 41.061 41.595 -0.534 1
1 994 . 2 1 1 A 83 83 LEU N N 83 117.452 119.905 -2.453 1
1 995 . 2 1 1 A 84 84 ARG H H 84 7.651 8.396 -0.745 1
1 996 . 2 1 1 A 84 84 ARG HA H 84 2.230 3.376 -1.146 1
1 1003 . 2 1 1 A 84 84 ARG C C 84 175.902 178.040 -2.138 1
1 1004 . 2 1 1 A 84 84 ARG CA C 84 59.112 59.344 -0.232 1
1 1005 . 2 1 1 A 84 84 ARG CB C 84 28.579 29.390 -0.811 1
1 1007 . 2 1 1 A 84 84 ARG N N 84 119.586 119.568 0.018 1
1 1008 . 2 1 1 A 85 85 SER H H 85 7.291 7.924 -0.633 1
1 1009 . 2 1 1 A 85 85 SER HA H 85 4.189 4.119 0.070 1
1 1012 . 2 1 1 A 85 85 SER C C 85 175.546 177.352 -1.806 1
1 1013 . 2 1 1 A 85 85 SER CA C 85 61.376 61.639 -0.263 1
1 1014 . 2 1 1 A 85 85 SER CB C 85 62.805 63.132 -0.327 1
1 1015 . 2 1 1 A 85 85 SER N N 85 112.921 113.979 -1.058 1
1 1016 . 2 1 1 A 86 86 HIS H H 86 8.156 7.853 0.303 1
1 1017 . 2 1 1 A 86 86 HIS HA H 86 4.782 4.173 0.609 1
1 1022 . 2 1 1 A 86 86 HIS C C 86 176.851 177.465 -0.614 1
1 1023 . 2 1 1 A 86 86 HIS CA C 86 58.898 59.284 -0.386 1
1 1024 . 2 1 1 A 86 86 HIS CB C 86 31.110 29.631 1.479 1
1 1027 . 2 1 1 A 86 86 HIS N N 86 119.258 118.423 0.835 1
1 1028 . 2 1 1 A 87 87 TYR H H 87 9.180 8.031 1.149 1
1 1029 . 2 1 1 A 87 87 TYR HA H 87 3.913 3.889 0.024 1
1 1036 . 2 1 1 A 87 87 TYR C C 87 176.841 177.364 -0.523 1
1 1037 . 2 1 1 A 87 87 TYR CA C 87 63.526 61.403 2.123 1
1 1038 . 2 1 1 A 87 87 TYR CB C 87 39.431 38.436 0.995 1
1 1041 . 2 1 1 A 87 87 TYR N N 87 120.625 120.042 0.583 1
1 1042 . 2 1 1 A 88 88 GLU H H 88 9.028 8.629 0.399 1
1 1043 . 2 1 1 A 88 88 GLU HA H 88 3.682 4.005 -0.323 1
1 1048 . 2 1 1 A 88 88 GLU C C 88 175.833 178.267 -2.434 1
1 1049 . 2 1 1 A 88 88 GLU CA C 88 59.730 60.357 -0.627 1
1 1050 . 2 1 1 A 88 88 GLU CB C 88 30.009 29.520 0.489 1
1 1052 . 2 1 1 A 88 88 GLU N N 88 119.531 118.233 1.298 1
1 1053 . 2 1 1 A 89 89 ARG H H 89 8.052 7.888 0.164 1
1 1054 . 2 1 1 A 89 89 ARG HA H 89 4.292 4.557 -0.265 1
1 1061 . 2 1 1 A 89 89 ARG C C 89 176.045 176.955 -0.910 1
1 1062 . 2 1 1 A 89 89 ARG CA C 89 58.538 57.046 1.492 1
1 1063 . 2 1 1 A 89 89 ARG CB C 89 31.841 31.075 0.766 1
1 1065 . 2 1 1 A 89 89 ARG N N 89 114.741 116.894 -2.153 1
1 1066 . 2 1 1 A 90 90 ILE H H 90 8.141 7.615 0.526 1
1 1067 . 2 1 1 A 90 90 ILE HA H 90 4.296 3.642 0.654 1
1 1075 . 2 1 1 A 90 90 ILE C C 90 174.461 176.746 -2.285 1
1 1076 . 2 1 1 A 90 90 ILE CA C 90 63.649 62.534 1.115 1
1 1077 . 2 1 1 A 90 90 ILE CB C 90 40.626 39.681 0.945 1
1 1079 . 2 1 1 A 90 90 ILE N N 90 113.421 117.235 -3.814 1
1 1080 . 2 1 1 A 91 91 VAL H H 91 7.350 7.841 -0.491 1
1 1081 . 2 1 1 A 91 91 VAL HA H 91 4.144 3.682 0.462 1
1 1089 . 2 1 1 A 91 91 VAL C C 91 175.422 177.031 -1.609 1
1 1090 . 2 1 1 A 91 91 VAL CA C 91 65.042 64.148 0.894 1
1 1091 . 2 1 1 A 91 91 VAL CB C 91 33.215 31.396 1.819 1
1 1092 . 2 1 1 A 91 91 VAL N N 91 118.215 120.492 -2.277 1
1 1093 . 2 1 1 A 92 92 TYR H H 92 8.565 8.204 0.361 1
1 1094 . 2 1 1 A 92 92 TYR HA H 92 4.217 4.182 0.035 1
1 1099 . 2 1 1 A 92 92 TYR C C 92 171.495 175.123 -3.628 1
1 1100 . 2 1 1 A 92 92 TYR CA C 92 61.558 62.355 -0.797 1
1 1101 . 2 1 1 A 92 92 TYR CB C 92 36.757 37.018 -0.261 1
1 1102 . 2 1 1 A 92 92 TYR N N 92 121.370 121.727 -0.357 1
1 1103 . 2 1 1 A 93 93 PRO HA H 93 4.136 4.409 -0.273 1
1 1108 . 2 1 1 A 93 93 PRO C C 93 177.077 178.341 -1.264 1
1 1109 . 2 1 1 A 93 93 PRO CA C 93 66.037 65.811 0.226 1
1 1110 . 2 1 1 A 93 93 PRO CB C 93 31.482 31.157 0.325 1
1 1111 . 2 1 1 A 94 94 TYR H H 94 6.517 7.522 -1.005 1
1 1112 . 2 1 1 A 94 94 TYR HA H 94 2.798 4.380 -1.582 1
1 1119 . 2 1 1 A 94 94 TYR C C 94 174.985 177.967 -2.982 1
1 1120 . 2 1 1 A 94 94 TYR CA C 94 59.356 60.218 -0.862 1
1 1121 . 2 1 1 A 94 94 TYR CB C 94 37.987 37.193 0.794 1
1 1124 . 2 1 1 A 94 94 TYR N N 94 115.987 117.104 -1.117 1
1 1125 . 2 1 1 A 95 95 GLU H H 95 8.205 8.095 0.110 1
1 1126 . 2 1 1 A 95 95 GLU HA H 95 3.682 4.044 -0.362 1
1 1131 . 2 1 1 A 95 95 GLU C C 95 178.530 178.737 -0.207 1
1 1132 . 2 1 1 A 95 95 GLU CA C 95 58.910 59.548 -0.638 1
1 1133 . 2 1 1 A 95 95 GLU CB C 95 29.187 29.291 -0.104 1
1 1134 . 2 1 1 A 95 95 GLU N N 95 119.946 121.138 -1.192 1
1 1135 . 2 1 1 A 96 96 MET H H 96 8.248 8.323 -0.075 1
1 1136 . 2 1 1 A 96 96 MET HA H 96 4.172 4.156 0.016 1
1 1142 . 2 1 1 A 96 96 MET C C 96 176.874 178.285 -1.411 1
1 1143 . 2 1 1 A 96 96 MET CA C 96 57.159 58.956 -1.797 1
1 1144 . 2 1 1 A 96 96 MET CB C 96 31.829 32.792 -0.963 1
1 1146 . 2 1 1 A 96 96 MET N N 96 117.570 119.163 -1.593 1
1 1147 . 2 1 1 A 97 97 TYR H H 97 7.445 8.233 -0.788 1
1 1148 . 2 1 1 A 97 97 TYR HA H 97 4.248 3.988 0.260 1
1 1155 . 2 1 1 A 97 97 TYR C C 97 176.476 176.979 -0.503 1
1 1156 . 2 1 1 A 97 97 TYR CA C 97 60.470 62.044 -1.574 1
1 1157 . 2 1 1 A 97 97 TYR CB C 97 38.612 38.352 0.260 1
1 1160 . 2 1 1 A 97 97 TYR N N 97 122.246 121.669 0.577 1
1 1161 . 2 1 1 A 98 98 GLN H H 98 8.087 8.463 -0.376 1
1 1162 . 2 1 1 A 98 98 GLN HA H 98 3.793 3.503 0.290 1
1 1169 . 2 1 1 A 98 98 GLN C C 98 175.549 178.440 -2.891 1
1 1170 . 2 1 1 A 98 98 GLN CA C 98 57.365 58.415 -1.050 1
1 1171 . 2 1 1 A 98 98 GLN CB C 98 28.901 28.834 0.067 1
1 1173 . 2 1 1 A 98 98 GLN N N 98 118.769 119.801 -1.032 1
1 1175 . 2 1 1 A 99 99 SER H H 99 7.724 8.052 -0.328 1
1 1176 . 2 1 1 A 99 99 SER HA H 99 4.293 4.248 0.045 1
1 1179 . 2 1 1 A 99 99 SER C C 99 173.696 177.120 -3.424 1
1 1180 . 2 1 1 A 99 99 SER CA C 99 59.566 62.644 -3.078 1
1 1181 . 2 1 1 A 99 99 SER CB C 99 63.847 62.600 1.247 1
1 1182 . 2 1 1 A 99 99 SER N N 99 113.257 117.742 -4.485 1
1 1183 . 2 1 1 A 100 100 GLY H H 100 7.751 8.177 -0.426 1
1 1184 . 2 1 1 A 100 100 GLY HA2 H 100 3.813 3.840 -0.027 1
1 1185 . 2 1 1 A 100 100 GLY HA3 H 100 3.934 3.853 0.081 1
1 1186 . 2 1 1 A 100 100 GLY C C 100 172.643 176.292 -3.649 1
1 1187 . 2 1 1 A 100 100 GLY CA C 100 45.570 47.066 -1.496 1
1 1188 . 2 1 1 A 100 100 GLY N N 100 109.750 108.494 1.256 1
1 1189 . 2 1 1 A 101 101 ALA H H 101 7.824 7.831 -0.007 1
1 1190 . 2 1 1 A 101 101 ALA HA H 101 4.221 3.888 0.333 1
1 1194 . 2 1 1 A 101 101 ALA C C 101 175.639 178.909 -3.270 1
1 1195 . 2 1 1 A 101 101 ALA CA C 101 52.745 54.505 -1.760 1
1 1196 . 2 1 1 A 101 101 ALA CB C 101 19.437 18.662 0.775 1
1 1197 . 2 1 1 A 101 101 ALA N N 101 123.241 124.720 -1.479 1
1 1198 . 2 1 1 A 102 102 ASN H H 102 8.191 7.662 0.529 1
1 1199 . 2 1 1 A 102 102 ASN HA H 102 4.658 4.580 0.078 1
1 1204 . 2 1 1 A 102 102 ASN C C 102 173.337 175.065 -1.728 1
1 1205 . 2 1 1 A 102 102 ASN CA C 102 53.374 55.434 -2.060 1
1 1206 . 2 1 1 A 102 102 ASN CB C 102 38.819 38.985 -0.166 1
1 1207 . 2 1 1 A 102 102 ASN N N 102 116.572 116.063 0.509 1
1 1209 . 2 1 1 A 103 103 LEU H H 103 8.065 7.725 0.340 1
1 1210 . 2 1 1 A 103 103 LEU HA H 103 4.363 4.590 -0.227 1
1 1219 . 2 1 1 A 103 103 LEU C C 103 175.637 174.706 0.931 1
1 1220 . 2 1 1 A 103 103 LEU CA C 103 55.292 53.947 1.345 1
1 1221 . 2 1 1 A 103 103 LEU CB C 103 42.433 44.792 -2.359 1
1 1222 . 2 1 1 A 103 103 LEU N N 103 122.074 113.523 8.551 1
1 1223 . 2 1 1 A 104 104 VAL H H 104 8.055 9.030 -0.975 1
1 1224 . 2 1 1 A 104 104 VAL HA H 104 4.131 4.513 -0.382 1
1 1232 . 2 1 1 A 104 104 VAL C C 104 174.364 174.921 -0.557 1
1 1233 . 2 1 1 A 104 104 VAL CA C 104 62.552 61.596 0.956 1
1 1234 . 2 1 1 A 104 104 VAL CB C 104 32.766 32.065 0.701 1
1 1235 . 2 1 1 A 104 104 VAL N N 104 120.606 123.510 -2.904 1
1 1236 . 2 1 1 A 105 105 CYS H H 105 8.392 8.638 -0.246 1
1 1237 . 2 1 1 A 105 105 CYS HA H 105 4.535 4.732 -0.197 1
1 1240 . 2 1 1 A 105 105 CYS C C 105 172.593 175.335 -2.742 1
1 1241 . 2 1 1 A 105 105 CYS CA C 105 58.449 59.471 -1.022 1
1 1242 . 2 1 1 A 105 105 CYS CB C 105 27.952 29.408 -1.456 1
1 1243 . 2 1 1 A 105 105 CYS N N 105 122.791 127.331 -4.540 1
1 1244 . 2 1 1 A 106 106 ASN H H 106 8.575 7.825 0.750 1
1 1245 . 2 1 1 A 106 106 ASN HA H 106 4.843 4.914 -0.071 1
1 1250 . 2 1 1 A 106 106 ASN C C 106 173.594 175.993 -2.399 1
1 1251 . 2 1 1 A 106 106 ASN CA C 106 53.337 53.816 -0.479 1
1 1252 . 2 1 1 A 106 106 ASN CB C 106 39.088 39.054 0.034 1
1 1253 . 2 1 1 A 106 106 ASN N N 106 122.001 119.336 2.665 1
1 1255 . 2 1 1 A 107 107 THR H H 107 8.090 7.806 0.284 1
1 1256 . 2 1 1 A 107 107 THR HA H 107 4.348 4.196 0.152 1
1 1261 . 2 1 1 A 107 107 THR C C 107 172.516 176.952 -4.436 1
1 1262 . 2 1 1 A 107 107 THR CA C 107 61.803 65.305 -3.502 1
1 1263 . 2 1 1 A 107 107 THR CB C 107 69.812 69.008 0.804 1
1 1265 . 2 1 1 A 107 107 THR N N 107 114.374 115.012 -0.638 1
1 1266 . 2 1 1 A 108 108 ARG H H 108 8.322 8.116 0.206 1
1 1267 . 2 1 1 A 108 108 ARG HA H 108 4.634 4.239 0.395 1
1 1274 . 2 1 1 A 108 108 ARG C C 108 172.608 176.543 -3.935 1
1 1275 . 2 1 1 A 108 108 ARG CA C 108 54.026 60.717 -6.691 1
1 1276 . 2 1 1 A 108 108 ARG CB C 108 30.246 29.616 0.630 1
1 1278 . 2 1 1 A 108 108 ARG N N 108 124.017 121.913 2.104 1
1 1279 . 2 1 1 A 109 109 PRO HA H 109 4.354 4.433 -0.079 1
1 1286 . 2 1 1 A 109 109 PRO C C 109 174.978 178.768 -3.790 1
1 1287 . 2 1 1 A 109 109 PRO CA C 109 63.396 65.584 -2.188 1
1 1288 . 2 1 1 A 109 109 PRO CB C 109 32.046 31.160 0.886 1
1 1290 . 2 1 1 A 110 110 PHE H H 110 8.123 7.882 0.241 1
1 1291 . 2 1 1 A 110 110 PHE HA H 110 4.619 4.263 0.356 1
1 1296 . 2 1 1 A 110 110 PHE C C 110 173.856 177.143 -3.287 1
1 1297 . 2 1 1 A 110 110 PHE CA C 110 57.353 61.986 -4.633 1
1 1298 . 2 1 1 A 110 110 PHE CB C 110 39.364 39.711 -0.347 1
1 1301 . 2 1 1 A 110 110 PHE N N 110 119.265 118.825 0.440 1
1 1302 . 2 1 1 A 111 111 ASP H H 111 8.161 8.663 -0.502 1
1 1303 . 2 1 1 A 111 111 ASP HA H 111 4.613 4.356 0.257 1
1 1306 . 2 1 1 A 111 111 ASP C C 111 174.114 178.161 -4.047 1
1 1307 . 2 1 1 A 111 111 ASP CA C 111 54.350 57.897 -3.547 1
1 1308 . 2 1 1 A 111 111 ASP CB C 111 41.413 41.728 -0.315 1
1 1309 . 2 1 1 A 111 111 ASP N N 111 121.764 118.681 3.083 1
1 1310 . 2 1 1 A 112 112 ASN H H 112 8.307 7.992 0.315 1
1 1311 . 2 1 1 A 112 112 ASN HA H 112 4.662 4.664 -0.002 1
1 1316 . 2 1 1 A 112 112 ASN C C 112 173.595 177.171 -3.576 1
1 1317 . 2 1 1 A 112 112 ASN CA C 112 53.486 55.527 -2.041 1
1 1318 . 2 1 1 A 112 112 ASN CB C 112 39.225 38.421 0.804 1
1 1319 . 2 1 1 A 112 112 ASN N N 112 119.154 115.958 3.196 1
1 1321 . 2 1 1 A 113 113 GLU H H 113 8.404 8.059 0.345 1
1 1322 . 2 1 1 A 113 113 GLU HA H 113 4.264 4.273 -0.009 1
1 1327 . 2 1 1 A 113 113 GLU C C 113 174.886 178.570 -3.684 1
1 1328 . 2 1 1 A 113 113 GLU CA C 113 56.681 58.722 -2.041 1
1 1329 . 2 1 1 A 113 113 GLU CB C 113 30.403 30.394 0.009 1
1 1331 . 2 1 1 A 113 113 GLU N N 113 120.943 119.714 1.229 1
1 1332 . 2 1 1 A 114 114 GLU H H 114 8.388 8.611 -0.223 1
1 1333 . 2 1 1 A 114 114 GLU HA H 114 4.262 4.291 -0.029 1
1 1338 . 2 1 1 A 114 114 GLU C C 114 174.819 177.752 -2.933 1
1 1339 . 2 1 1 A 114 114 GLU CA C 114 56.769 59.316 -2.547 1
1 1340 . 2 1 1 A 114 114 GLU CB C 114 30.125 29.908 0.217 1
1 1342 . 2 1 1 A 114 114 GLU N N 114 121.869 120.276 1.593 1
1 1343 . 2 1 1 A 115 115 LYS H H 115 8.236 7.796 0.440 1
1 1344 . 2 1 1 A 115 115 LYS HA H 115 4.347 4.710 -0.363 1
1 1353 . 2 1 1 A 115 115 LYS C C 115 174.633 176.480 -1.847 1
1 1354 . 2 1 1 A 115 115 LYS CA C 115 56.426 55.129 1.297 1
1 1355 . 2 1 1 A 115 115 LYS CB C 115 33.277 32.730 0.547 1
1 1359 . 2 1 1 A 115 115 LYS N N 115 121.997 117.950 4.047 1
1 1360 . 2 1 1 A 116 116 ASP H H 116 8.386 7.934 0.452 1
1 1361 . 2 1 1 A 116 116 ASP HA H 116 4.600 4.352 0.248 1
1 1364 . 2 1 1 A 116 116 ASP C C 116 173.448 177.656 -4.208 1
1 1365 . 2 1 1 A 116 116 ASP CA C 116 54.773 57.882 -3.109 1
1 1366 . 2 1 1 A 116 116 ASP CB C 116 41.029 41.579 -0.550 1
1 1367 . 2 1 1 A 116 116 ASP N N 116 121.057 121.348 -0.291 1
1 5 . 3 1 1 A 2 2 MET HA H 2 4.534 4.541 -0.007 1
1 13 . 3 1 1 A 2 2 MET C C 2 174.355 178.197 -3.842 1
1 14 . 3 1 1 A 2 2 MET CA C 2 56.247 57.097 -0.850 1
1 15 . 3 1 1 A 2 2 MET CB C 2 32.855 32.559 0.296 1
1 18 . 3 1 1 A 3 3 ASN H H 3 8.600 8.424 0.176 1
1 19 . 3 1 1 A 3 3 ASN HA H 3 4.711 4.436 0.275 1
1 24 . 3 1 1 A 3 3 ASN C C 3 173.983 177.466 -3.483 1
1 25 . 3 1 1 A 3 3 ASN CA C 3 53.650 56.837 -3.187 1
1 26 . 3 1 1 A 3 3 ASN CB C 3 38.624 40.032 -1.408 1
1 27 . 3 1 1 A 3 3 ASN N N 3 120.149 119.534 0.615 1
1 29 . 3 1 1 A 4 4 GLU H H 4 8.495 8.202 0.293 1
1 30 . 3 1 1 A 4 4 GLU HA H 4 4.235 4.040 0.195 1
1 35 . 3 1 1 A 4 4 GLU C C 4 175.752 178.552 -2.800 1
1 36 . 3 1 1 A 4 4 GLU CA C 4 58.075 59.312 -1.237 1
1 37 . 3 1 1 A 4 4 GLU CB C 4 30.125 29.288 0.837 1
1 38 . 3 1 1 A 4 4 GLU N N 4 121.543 118.526 3.017 1
1 39 . 3 1 1 A 5 5 LEU HA H 5 4.073 4.165 -0.092 1
1 47 . 3 1 1 A 5 5 LEU CB C 5 41.897 42.184 -0.287 1
1 50 . 3 1 1 A 6 6 GLU H H 6 8.332 8.685 -0.353 1
1 51 . 3 1 1 A 6 6 GLU HA H 6 3.621 4.202 -0.581 1
1 52 . 3 1 1 A 6 6 GLU C C 6 176.402 178.653 -2.251 1
1 53 . 3 1 1 A 6 6 GLU CA C 6 58.461 58.531 -0.070 1
1 54 . 3 1 1 A 6 6 GLU CB C 6 29.730 29.818 -0.088 1
1 55 . 3 1 1 A 6 6 GLU N N 6 121.462 118.853 2.609 1
1 56 . 3 1 1 A 7 7 ALA H H 7 8.244 7.696 0.548 1
1 57 . 3 1 1 A 7 7 ALA HA H 7 4.185 4.087 0.098 1
1 61 . 3 1 1 A 7 7 ALA C C 7 177.982 178.224 -0.242 1
1 62 . 3 1 1 A 7 7 ALA CA C 7 54.791 55.191 -0.400 1
1 63 . 3 1 1 A 7 7 ALA CB C 7 18.836 18.788 0.048 1
1 64 . 3 1 1 A 7 7 ALA N N 7 123.078 121.892 1.186 1
1 65 . 3 1 1 A 8 8 GLN H H 8 8.274 7.492 0.782 1
1 66 . 3 1 1 A 8 8 GLN HA H 8 4.219 4.458 -0.239 1
1 73 . 3 1 1 A 8 8 GLN C C 8 176.325 175.205 1.120 1
1 74 . 3 1 1 A 8 8 GLN CA C 8 57.864 55.860 2.004 1
1 75 . 3 1 1 A 8 8 GLN CB C 8 28.768 29.148 -0.380 1
1 77 . 3 1 1 A 8 8 GLN N N 8 117.452 116.178 1.274 1
1 79 . 3 1 1 A 9 9 THR H H 9 8.043 8.676 -0.633 1
1 80 . 3 1 1 A 9 9 THR HA H 9 3.998 4.768 -0.770 1
1 85 . 3 1 1 A 9 9 THR C C 9 173.904 174.401 -0.497 1
1 86 . 3 1 1 A 9 9 THR CA C 9 65.435 60.860 4.575 1
1 87 . 3 1 1 A 9 9 THR CB C 9 68.870 70.618 -1.748 1
1 89 . 3 1 1 A 9 9 THR N N 9 116.135 118.497 -2.362 1
1 90 . 3 1 1 A 10 10 ARG H H 10 8.095 8.964 -0.869 1
1 91 . 3 1 1 A 10 10 ARG HA H 10 4.040 3.964 0.076 1
1 98 . 3 1 1 A 10 10 ARG C C 10 176.583 175.521 1.062 1
1 99 . 3 1 1 A 10 10 ARG CA C 10 59.262 57.409 1.853 1
1 100 . 3 1 1 A 10 10 ARG CB C 10 29.900 27.516 2.384 1
1 101 . 3 1 1 A 10 10 ARG N N 10 121.157 123.343 -2.186 1
1 102 . 3 1 1 A 11 11 VAL H H 11 7.657 7.858 -0.201 1
1 103 . 3 1 1 A 11 11 VAL HA H 11 3.769 4.420 -0.651 1
1 111 . 3 1 1 A 11 11 VAL C C 11 176.662 177.576 -0.914 1
1 112 . 3 1 1 A 11 11 VAL CA C 11 65.914 63.656 2.258 1
1 113 . 3 1 1 A 11 11 VAL CB C 11 31.745 33.600 -1.855 1
1 114 . 3 1 1 A 11 11 VAL N N 11 118.580 117.882 0.698 1
1 115 . 3 1 1 A 12 12 LYS H H 12 7.471 8.211 -0.740 1
1 116 . 3 1 1 A 12 12 LYS HA H 12 3.366 4.480 -1.114 1
1 123 . 3 1 1 A 12 12 LYS C C 12 176.457 179.454 -2.997 1
1 124 . 3 1 1 A 12 12 LYS CA C 12 59.545 59.180 0.365 1
1 125 . 3 1 1 A 12 12 LYS CB C 12 32.206 32.149 0.057 1
1 126 . 3 1 1 A 12 12 LYS N N 12 121.835 122.312 -0.477 1
1 127 . 3 1 1 A 13 13 LEU H H 13 8.144 8.081 0.063 1
1 128 . 3 1 1 A 13 13 LEU HA H 13 4.093 4.058 0.035 1
1 137 . 3 1 1 A 13 13 LEU C C 13 178.254 178.714 -0.460 1
1 138 . 3 1 1 A 13 13 LEU CA C 13 58.023 58.049 -0.026 1
1 139 . 3 1 1 A 13 13 LEU CB C 13 41.283 41.500 -0.217 1
1 140 . 3 1 1 A 13 13 LEU N N 13 118.688 120.562 -1.874 1
1 141 . 3 1 1 A 14 14 ASN H H 14 8.384 8.495 -0.111 1
1 142 . 3 1 1 A 14 14 ASN HA H 14 4.567 4.403 0.164 1
1 147 . 3 1 1 A 14 14 ASN C C 14 175.397 176.966 -1.569 1
1 148 . 3 1 1 A 14 14 ASN CA C 14 56.239 56.334 -0.095 1
1 149 . 3 1 1 A 14 14 ASN CB C 14 38.432 39.650 -1.218 1
1 150 . 3 1 1 A 14 14 ASN N N 14 118.175 117.214 0.961 1
1 152 . 3 1 1 A 15 15 TYR H H 15 7.982 8.138 -0.156 1
1 153 . 3 1 1 A 15 15 TYR HA H 15 4.249 4.026 0.223 1
1 160 . 3 1 1 A 15 15 TYR C C 15 175.503 177.362 -1.859 1
1 161 . 3 1 1 A 15 15 TYR CA C 15 62.450 61.374 1.076 1
1 162 . 3 1 1 A 15 15 TYR CB C 15 39.399 38.253 1.146 1
1 163 . 3 1 1 A 15 15 TYR N N 15 121.955 120.460 1.495 1
1 164 . 3 1 1 A 16 16 LEU H H 16 8.198 8.461 -0.263 1
1 165 . 3 1 1 A 16 16 LEU HA H 16 4.470 3.967 0.503 1
1 175 . 3 1 1 A 16 16 LEU C C 16 177.125 177.965 -0.840 1
1 176 . 3 1 1 A 16 16 LEU CA C 16 57.374 58.077 -0.703 1
1 177 . 3 1 1 A 16 16 LEU CB C 16 41.443 41.514 -0.071 1
1 178 . 3 1 1 A 16 16 LEU N N 16 117.642 121.637 -3.995 1
1 179 . 3 1 1 A 17 17 ASP H H 17 8.061 8.489 -0.428 1
1 180 . 3 1 1 A 17 17 ASP C C 17 177.836 178.113 -0.277 1
1 181 . 3 1 1 A 17 17 ASP CA C 17 57.486 57.887 -0.401 1
1 182 . 3 1 1 A 17 17 ASP CB C 17 41.433 41.921 -0.488 1
1 183 . 3 1 1 A 17 17 ASP N N 17 118.700 119.075 -0.375 1
1 184 . 3 1 1 A 18 18 GLN H H 18 8.111 8.191 -0.080 1
1 185 . 3 1 1 A 18 18 GLN HA H 18 4.002 4.136 -0.134 1
1 190 . 3 1 1 A 18 18 GLN CA C 18 59.046 58.637 0.409 1
1 191 . 3 1 1 A 18 18 GLN CB C 18 28.700 27.962 0.738 1
1 193 . 3 1 1 A 18 18 GLN N N 18 119.539 117.087 2.452 1
1 195 . 3 1 1 A 19 19 ILE H H 19 8.330 8.014 0.316 1
1 196 . 3 1 1 A 19 19 ILE HA H 19 3.306 3.818 -0.512 1
1 204 . 3 1 1 A 19 19 ILE C C 19 175.608 177.621 -2.013 1
1 205 . 3 1 1 A 19 19 ILE CA C 19 64.760 63.011 1.749 1
1 206 . 3 1 1 A 19 19 ILE CB C 19 37.148 37.126 0.022 1
1 209 . 3 1 1 A 19 19 ILE N N 19 121.490 121.734 -0.244 1
1 210 . 3 1 1 A 20 20 ALA H H 20 8.057 7.936 0.121 1
1 211 . 3 1 1 A 20 20 ALA HA H 20 4.349 4.148 0.201 1
1 215 . 3 1 1 A 20 20 ALA C C 20 179.297 179.889 -0.592 1
1 216 . 3 1 1 A 20 20 ALA CA C 20 56.150 55.343 0.807 1
1 217 . 3 1 1 A 20 20 ALA CB C 20 18.104 19.165 -1.061 1
1 218 . 3 1 1 A 20 20 ALA N N 20 124.441 124.230 0.211 1
1 219 . 3 1 1 A 21 21 LYS H H 21 8.116 8.085 0.031 1
1 220 . 3 1 1 A 21 21 LYS HA H 21 4.108 3.999 0.109 1
1 229 . 3 1 1 A 21 21 LYS C C 21 176.720 178.933 -2.213 1
1 230 . 3 1 1 A 21 21 LYS CA C 21 59.166 59.189 -0.023 1
1 231 . 3 1 1 A 21 21 LYS CB C 21 32.085 32.282 -0.197 1
1 233 . 3 1 1 A 21 21 LYS N N 21 119.865 117.402 2.463 1
1 234 . 3 1 1 A 22 22 PHE H H 22 7.875 8.015 -0.140 1
1 235 . 3 1 1 A 22 22 PHE HA H 22 4.012 4.134 -0.122 1
1 242 . 3 1 1 A 22 22 PHE C C 22 175.545 177.286 -1.741 1
1 243 . 3 1 1 A 22 22 PHE CA C 22 61.070 61.407 -0.337 1
1 244 . 3 1 1 A 22 22 PHE CB C 22 39.072 39.121 -0.049 1
1 249 . 3 1 1 A 22 22 PHE N N 22 119.729 119.996 -0.267 1
1 250 . 3 1 1 A 23 23 TRP H H 23 7.841 8.196 -0.355 1
1 251 . 3 1 1 A 23 23 TRP HA H 23 4.149 4.004 0.145 1
1 260 . 3 1 1 A 23 23 TRP C C 23 176.668 178.673 -2.005 1
1 261 . 3 1 1 A 23 23 TRP CB C 23 28.543 29.836 -1.293 1
1 267 . 3 1 1 A 23 23 TRP N N 23 119.440 120.818 -1.378 1
1 269 . 3 1 1 A 24 24 GLU H H 24 8.261 8.795 -0.534 1
1 270 . 3 1 1 A 24 24 GLU HA H 24 4.265 4.160 0.105 1
1 275 . 3 1 1 A 24 24 GLU C C 24 179.679 178.223 1.456 1
1 276 . 3 1 1 A 24 24 GLU CA C 24 59.706 59.014 0.692 1
1 277 . 3 1 1 A 24 24 GLU CB C 24 29.720 29.127 0.593 1
1 279 . 3 1 1 A 24 24 GLU N N 24 121.376 117.657 3.719 1
1 280 . 3 1 1 A 25 25 ILE H H 25 8.071 7.967 0.104 1
1 281 . 3 1 1 A 25 25 ILE HA H 25 3.815 3.952 -0.137 1
1 291 . 3 1 1 A 25 25 ILE C C 25 176.343 176.504 -0.161 1
1 292 . 3 1 1 A 25 25 ILE CA C 25 64.464 61.510 2.954 1
1 293 . 3 1 1 A 25 25 ILE CB C 25 37.371 37.474 -0.103 1
1 296 . 3 1 1 A 25 25 ILE N N 25 121.499 119.744 1.755 1
1 297 . 3 1 1 A 26 26 GLN H H 26 7.327 7.002 0.325 1
1 298 . 3 1 1 A 26 26 GLN HA H 26 4.074 4.124 -0.050 1
1 305 . 3 1 1 A 26 26 GLN C C 26 174.906 175.875 -0.969 1
1 306 . 3 1 1 A 26 26 GLN CA C 26 55.450 55.426 0.024 1
1 307 . 3 1 1 A 26 26 GLN CB C 26 28.458 28.574 -0.116 1
1 309 . 3 1 1 A 26 26 GLN N N 26 116.532 119.815 -3.283 1
1 311 . 3 1 1 A 27 27 GLY H H 27 7.861 8.073 -0.212 1
1 312 . 3 1 1 A 27 27 GLY HA2 H 27 4.297 3.707 0.590 1
1 313 . 3 1 1 A 27 27 GLY HA3 H 27 3.823 3.713 0.110 1
1 314 . 3 1 1 A 27 27 GLY C C 27 172.698 173.406 -0.708 1
1 315 . 3 1 1 A 27 27 GLY CA C 27 45.608 45.130 0.478 1
1 316 . 3 1 1 A 27 27 GLY N N 27 106.837 108.155 -1.318 1
1 317 . 3 1 1 A 28 28 SER H H 28 8.083 7.400 0.683 1
1 318 . 3 1 1 A 28 28 SER HA H 28 4.777 4.660 0.117 1
1 321 . 3 1 1 A 28 28 SER C C 28 171.196 171.843 -0.647 1
1 322 . 3 1 1 A 28 28 SER CA C 28 56.041 56.592 -0.551 1
1 323 . 3 1 1 A 28 28 SER CB C 28 64.539 65.970 -1.431 1
1 324 . 3 1 1 A 28 28 SER N N 28 116.151 116.000 0.151 1
1 325 . 3 1 1 A 29 29 SER H H 29 8.354 8.544 -0.190 1
1 326 . 3 1 1 A 29 29 SER HA H 29 4.389 5.061 -0.672 1
1 329 . 3 1 1 A 29 29 SER C C 29 172.166 172.606 -0.440 1
1 330 . 3 1 1 A 29 29 SER CA C 29 58.107 56.483 1.624 1
1 331 . 3 1 1 A 29 29 SER CB C 29 63.853 65.728 -1.875 1
1 332 . 3 1 1 A 29 29 SER N N 29 116.596 114.298 2.298 1
1 333 . 3 1 1 A 30 30 LEU H H 30 8.990 8.535 0.455 1
1 334 . 3 1 1 A 30 30 LEU HA H 30 3.964 4.962 -0.998 1
1 344 . 3 1 1 A 30 30 LEU C C 30 173.752 175.563 -1.811 1
1 345 . 3 1 1 A 30 30 LEU CA C 30 55.193 55.570 -0.377 1
1 346 . 3 1 1 A 30 30 LEU CB C 30 42.869 42.597 0.272 1
1 349 . 3 1 1 A 30 30 LEU N N 30 125.860 127.181 -1.321 1
1 350 . 3 1 1 A 31 31 LYS H H 31 8.118 8.983 -0.865 1
1 351 . 3 1 1 A 31 31 LYS HA H 31 4.498 5.054 -0.556 1
1 360 . 3 1 1 A 31 31 LYS C C 31 173.555 174.799 -1.244 1
1 361 . 3 1 1 A 31 31 LYS CA C 31 54.372 54.916 -0.544 1
1 362 . 3 1 1 A 31 31 LYS CB C 31 32.814 35.292 -2.478 1
1 365 . 3 1 1 A 31 31 LYS N N 31 129.965 127.759 2.206 1
1 366 . 3 1 1 A 32 32 ILE H H 32 8.717 8.685 0.032 1
1 367 . 3 1 1 A 32 32 ILE HA H 32 4.011 4.881 -0.870 1
1 377 . 3 1 1 A 32 32 ILE C C 32 173.038 174.712 -1.674 1
1 378 . 3 1 1 A 32 32 ILE CA C 32 59.921 58.047 1.874 1
1 379 . 3 1 1 A 32 32 ILE CB C 32 38.139 39.309 -1.170 1
1 382 . 3 1 1 A 32 32 ILE N N 32 127.091 122.950 4.141 1
1 383 . 3 1 1 A 33 33 PRO HA H 33 4.412 4.582 -0.170 1
1 390 . 3 1 1 A 33 33 PRO C C 33 172.724 175.190 -2.466 1
1 391 . 3 1 1 A 33 33 PRO CA C 33 62.565 62.234 0.331 1
1 392 . 3 1 1 A 33 33 PRO CB C 33 32.728 32.727 0.001 1
1 394 . 3 1 1 A 34 34 ASN H H 34 8.265 8.433 -0.168 1
1 395 . 3 1 1 A 34 34 ASN HA H 34 5.147 5.378 -0.231 1
1 400 . 3 1 1 A 34 34 ASN C C 34 174.079 174.241 -0.162 1
1 401 . 3 1 1 A 34 34 ASN CA C 34 52.088 51.638 0.450 1
1 402 . 3 1 1 A 34 34 ASN CB C 34 40.387 42.521 -2.134 1
1 403 . 3 1 1 A 34 34 ASN N N 34 116.424 117.384 -0.960 1
1 405 . 3 1 1 A 35 35 VAL H H 35 8.904 9.066 -0.162 1
1 406 . 3 1 1 A 35 35 VAL HA H 35 4.159 4.498 -0.339 1
1 414 . 3 1 1 A 35 35 VAL C C 35 173.834 175.500 -1.666 1
1 415 . 3 1 1 A 35 35 VAL CA C 35 61.953 60.065 1.888 1
1 416 . 3 1 1 A 35 35 VAL CB C 35 34.432 34.837 -0.405 1
1 419 . 3 1 1 A 35 35 VAL N N 35 122.778 119.884 2.894 1
1 420 . 3 1 1 A 36 36 GLU H H 36 9.560 9.170 0.390 1
1 421 . 3 1 1 A 36 36 GLU HA H 36 3.819 4.136 -0.317 1
1 426 . 3 1 1 A 36 36 GLU C C 36 173.604 175.866 -2.262 1
1 427 . 3 1 1 A 36 36 GLU CA C 36 57.131 57.354 -0.223 1
1 428 . 3 1 1 A 36 36 GLU CB C 36 27.464 27.383 0.081 1
1 430 . 3 1 1 A 36 36 GLU N N 36 127.014 128.163 -1.149 1
1 431 . 3 1 1 A 37 37 ARG H H 37 8.578 8.485 0.093 1
1 432 . 3 1 1 A 37 37 ARG HA H 37 3.792 3.938 -0.146 1
1 439 . 3 1 1 A 37 37 ARG C C 37 173.371 174.557 -1.186 1
1 440 . 3 1 1 A 37 37 ARG CA C 37 57.952 57.855 0.097 1
1 441 . 3 1 1 A 37 37 ARG CB C 37 27.657 27.733 -0.076 1
1 443 . 3 1 1 A 37 37 ARG N N 37 108.362 113.396 -5.034 1
1 444 . 3 1 1 A 38 38 ARG H H 38 7.696 7.815 -0.119 1
1 445 . 3 1 1 A 38 38 ARG HA H 38 4.743 4.950 -0.207 1
1 452 . 3 1 1 A 38 38 ARG C C 38 173.513 174.724 -1.211 1
1 453 . 3 1 1 A 38 38 ARG CA C 38 54.507 54.623 -0.116 1
1 454 . 3 1 1 A 38 38 ARG CB C 38 33.751 33.546 0.205 1
1 456 . 3 1 1 A 38 38 ARG N N 38 118.370 115.694 2.676 1
1 457 . 3 1 1 A 39 39 ILE H H 39 8.463 8.289 0.174 1
1 458 . 3 1 1 A 39 39 ILE HA H 39 4.184 4.596 -0.412 1
1 468 . 3 1 1 A 39 39 ILE C C 39 175.150 175.865 -0.715 1
1 469 . 3 1 1 A 39 39 ILE CA C 39 62.076 62.046 0.030 1
1 470 . 3 1 1 A 39 39 ILE CB C 39 38.864 39.388 -0.524 1
1 473 . 3 1 1 A 39 39 ILE N N 39 123.604 123.957 -0.353 1
1 474 . 3 1 1 A 40 40 LEU H H 40 8.239 8.185 0.054 1
1 475 . 3 1 1 A 40 40 LEU HA H 40 4.259 4.575 -0.316 1
1 485 . 3 1 1 A 40 40 LEU C C 40 173.152 175.839 -2.687 1
1 486 . 3 1 1 A 40 40 LEU CA C 40 55.305 55.408 -0.103 1
1 487 . 3 1 1 A 40 40 LEU CB C 40 43.113 42.494 0.619 1
1 490 . 3 1 1 A 40 40 LEU N N 40 129.550 128.789 0.761 1
1 491 . 3 1 1 A 41 41 ASP H H 41 8.992 8.732 0.260 1
1 492 . 3 1 1 A 41 41 ASP HA H 41 4.798 4.716 0.082 1
1 495 . 3 1 1 A 41 41 ASP C C 41 173.837 176.153 -2.316 1
1 496 . 3 1 1 A 41 41 ASP CA C 41 52.077 53.236 -1.159 1
1 497 . 3 1 1 A 41 41 ASP CB C 41 39.454 40.347 -0.893 1
1 498 . 3 1 1 A 41 41 ASP N N 41 127.022 127.743 -0.721 1
1 499 . 3 1 1 A 42 42 LEU H H 42 7.912 8.255 -0.343 1
1 500 . 3 1 1 A 42 42 LEU HA H 42 3.970 4.123 -0.153 1
1 510 . 3 1 1 A 42 42 LEU C C 42 176.305 177.745 -1.440 1
1 511 . 3 1 1 A 42 42 LEU CA C 42 58.128 57.871 0.257 1
1 512 . 3 1 1 A 42 42 LEU CB C 42 43.043 42.049 0.994 1
1 514 . 3 1 1 A 42 42 LEU N N 42 125.064 127.355 -2.291 1
1 515 . 3 1 1 A 43 43 TYR H H 43 8.565 8.381 0.184 1
1 516 . 3 1 1 A 43 43 TYR HA H 43 3.728 3.365 0.363 1
1 523 . 3 1 1 A 43 43 TYR C C 43 175.757 176.776 -1.019 1
1 524 . 3 1 1 A 43 43 TYR CA C 43 61.774 61.595 0.179 1
1 525 . 3 1 1 A 43 43 TYR CB C 43 38.235 38.299 -0.064 1
1 528 . 3 1 1 A 43 43 TYR N N 43 117.822 120.226 -2.404 1
1 529 . 3 1 1 A 44 44 SER H H 44 8.115 8.399 -0.284 1
1 530 . 3 1 1 A 44 44 SER HA H 44 3.854 4.159 -0.305 1
1 533 . 3 1 1 A 44 44 SER C C 44 174.080 176.116 -2.036 1
1 534 . 3 1 1 A 44 44 SER CA C 44 61.873 61.873 0.000 1
1 535 . 3 1 1 A 44 44 SER CB C 44 64.350 62.853 1.497 1
1 536 . 3 1 1 A 44 44 SER N N 44 116.835 116.095 0.740 1
1 537 . 3 1 1 A 45 45 LEU H H 45 8.401 7.778 0.623 1
1 538 . 3 1 1 A 45 45 LEU HA H 45 4.102 4.202 -0.100 1
1 548 . 3 1 1 A 45 45 LEU C C 45 175.081 179.103 -4.022 1
1 549 . 3 1 1 A 45 45 LEU CA C 45 58.896 57.821 1.075 1
1 550 . 3 1 1 A 45 45 LEU CB C 45 41.741 41.418 0.323 1
1 553 . 3 1 1 A 45 45 LEU N N 45 120.621 123.355 -2.734 1
1 554 . 3 1 1 A 46 46 SER H H 46 8.110 8.268 -0.158 1
1 555 . 3 1 1 A 46 46 SER HA H 46 4.300 4.205 0.095 1
1 558 . 3 1 1 A 46 46 SER C C 46 175.019 176.560 -1.541 1
1 559 . 3 1 1 A 46 46 SER CA C 46 62.610 61.993 0.617 1
1 560 . 3 1 1 A 46 46 SER CB C 46 64.092 62.962 1.130 1
1 561 . 3 1 1 A 46 46 SER N N 46 112.826 116.546 -3.720 1
1 562 . 3 1 1 A 47 47 LYS H H 47 7.732 8.024 -0.292 1
1 563 . 3 1 1 A 47 47 LYS HA H 47 3.900 4.122 -0.222 1
1 572 . 3 1 1 A 47 47 LYS C C 47 177.441 179.084 -1.643 1
1 573 . 3 1 1 A 47 47 LYS CA C 47 58.575 59.006 -0.431 1
1 574 . 3 1 1 A 47 47 LYS CB C 47 32.351 32.396 -0.045 1
1 576 . 3 1 1 A 47 47 LYS N N 47 121.210 119.624 1.586 1
1 577 . 3 1 1 A 48 48 ILE H H 48 8.672 8.141 0.531 1
1 578 . 3 1 1 A 48 48 ILE HA H 48 3.628 3.755 -0.127 1
1 588 . 3 1 1 A 48 48 ILE C C 48 175.861 178.059 -2.198 1
1 589 . 3 1 1 A 48 48 ILE CA C 48 64.188 65.298 -1.110 1
1 590 . 3 1 1 A 48 48 ILE CB C 48 37.954 37.841 0.113 1
1 593 . 3 1 1 A 48 48 ILE N N 48 120.810 121.090 -0.280 1
1 594 . 3 1 1 A 49 49 VAL H H 49 8.030 8.216 -0.186 1
1 595 . 3 1 1 A 49 49 VAL HA H 49 3.195 3.640 -0.445 1
1 603 . 3 1 1 A 49 49 VAL C C 49 176.513 178.485 -1.972 1
1 604 . 3 1 1 A 49 49 VAL CA C 49 66.760 67.069 -0.309 1
1 605 . 3 1 1 A 49 49 VAL CB C 49 30.935 31.774 -0.839 1
1 608 . 3 1 1 A 49 49 VAL N N 49 119.350 119.620 -0.270 1
1 609 . 3 1 1 A 50 50 VAL H H 50 7.336 8.186 -0.850 1
1 610 . 3 1 1 A 50 50 VAL HA H 50 3.497 3.648 -0.151 1
1 618 . 3 1 1 A 50 50 VAL C C 50 178.745 178.377 0.368 1
1 619 . 3 1 1 A 50 50 VAL CA C 50 67.384 66.907 0.477 1
1 620 . 3 1 1 A 50 50 VAL CB C 50 31.832 31.363 0.469 1
1 621 . 3 1 1 A 50 50 VAL N N 50 118.610 120.745 -2.135 1
1 622 . 3 1 1 A 51 51 GLU H H 51 8.318 8.319 -0.001 1
1 623 . 3 1 1 A 51 51 GLU HA H 51 3.953 4.080 -0.127 1
1 628 . 3 1 1 A 51 51 GLU C C 51 177.281 178.658 -1.377 1
1 629 . 3 1 1 A 51 51 GLU CA C 51 59.668 59.076 0.592 1
1 630 . 3 1 1 A 51 51 GLU CB C 51 30.131 29.217 0.914 1
1 632 . 3 1 1 A 51 51 GLU N N 51 122.096 119.430 2.666 1
1 633 . 3 1 1 A 52 52 GLU H H 52 8.065 8.105 -0.040 1
1 634 . 3 1 1 A 52 52 GLU HA H 52 4.229 4.318 -0.089 1
1 639 . 3 1 1 A 52 52 GLU C C 52 173.534 176.604 -3.070 1
1 640 . 3 1 1 A 52 52 GLU CA C 52 55.547 56.457 -0.910 1
1 641 . 3 1 1 A 52 52 GLU CB C 52 28.716 30.273 -1.557 1
1 643 . 3 1 1 A 52 52 GLU N N 52 114.992 117.384 -2.392 1
1 644 . 3 1 1 A 53 53 GLY H H 53 7.459 9.022 -1.563 1
1 645 . 3 1 1 A 53 53 GLY HA2 H 53 3.630 3.957 -0.327 1
1 646 . 3 1 1 A 53 53 GLY HA3 H 53 3.630 3.977 -0.347 1
1 647 . 3 1 1 A 53 53 GLY C C 53 173.214 173.676 -0.462 1
1 648 . 3 1 1 A 53 53 GLY CA C 53 44.962 45.119 -0.157 1
1 649 . 3 1 1 A 53 53 GLY N N 53 104.909 107.994 -3.085 1
1 650 . 3 1 1 A 54 54 GLY H H 54 8.533 7.645 0.888 1
1 651 . 3 1 1 A 54 54 GLY HA2 H 54 3.548 4.068 -0.520 1
1 652 . 3 1 1 A 54 54 GLY HA3 H 54 4.521 4.119 0.402 1
1 653 . 3 1 1 A 54 54 GLY C C 54 169.966 174.628 -4.662 1
1 654 . 3 1 1 A 54 54 GLY CA C 54 43.988 45.710 -1.722 1
1 655 . 3 1 1 A 54 54 GLY N N 54 110.587 108.161 2.426 1
1 656 . 3 1 1 A 55 55 TYR H H 55 8.704 9.068 -0.364 1
1 657 . 3 1 1 A 55 55 TYR HA H 55 3.618 3.963 -0.345 1
1 664 . 3 1 1 A 55 55 TYR C C 55 174.807 176.991 -2.184 1
1 665 . 3 1 1 A 55 55 TYR CA C 55 62.540 61.870 0.670 1
1 666 . 3 1 1 A 55 55 TYR CB C 55 39.669 39.465 0.204 1
1 669 . 3 1 1 A 55 55 TYR N N 55 119.168 122.180 -3.012 1
1 670 . 3 1 1 A 56 56 GLU H H 56 9.006 8.411 0.595 1
1 671 . 3 1 1 A 56 56 GLU HA H 56 3.638 3.576 0.062 1
1 676 . 3 1 1 A 56 56 GLU C C 56 177.400 178.681 -1.281 1
1 677 . 3 1 1 A 56 56 GLU CA C 56 60.530 59.449 1.081 1
1 678 . 3 1 1 A 56 56 GLU CB C 56 29.168 29.061 0.107 1
1 679 . 3 1 1 A 56 56 GLU N N 56 118.969 117.624 1.345 1
1 680 . 3 1 1 A 57 57 ALA H H 57 8.235 7.835 0.400 1
1 681 . 3 1 1 A 57 57 ALA HA H 57 3.980 3.991 -0.011 1
1 685 . 3 1 1 A 57 57 ALA C C 57 177.678 179.686 -2.008 1
1 686 . 3 1 1 A 57 57 ALA CA C 57 54.910 55.075 -0.165 1
1 687 . 3 1 1 A 57 57 ALA CB C 57 18.122 18.606 -0.484 1
1 688 . 3 1 1 A 57 57 ALA N N 57 122.860 122.335 0.525 1
1 689 . 3 1 1 A 58 58 ILE H H 58 7.831 7.862 -0.031 1
1 690 . 3 1 1 A 58 58 ILE HA H 58 3.189 3.367 -0.178 1
1 700 . 3 1 1 A 58 58 ILE C C 58 177.818 177.386 0.432 1
1 701 . 3 1 1 A 58 58 ILE CA C 58 65.074 64.401 0.673 1
1 702 . 3 1 1 A 58 58 ILE CB C 58 38.178 36.537 1.641 1
1 706 . 3 1 1 A 58 58 ILE N N 58 117.418 117.009 0.409 1
1 707 . 3 1 1 A 59 59 CYS H H 59 7.760 8.026 -0.266 1
1 708 . 3 1 1 A 59 59 CYS HA H 59 4.203 4.087 0.116 1
1 711 . 3 1 1 A 59 59 CYS C C 59 176.357 177.204 -0.847 1
1 712 . 3 1 1 A 59 59 CYS CA C 59 63.760 62.352 1.408 1
1 713 . 3 1 1 A 59 59 CYS CB C 59 27.638 26.640 0.998 1
1 714 . 3 1 1 A 59 59 CYS N N 59 115.302 120.314 -5.012 1
1 715 . 3 1 1 A 60 60 LYS H H 60 8.350 7.963 0.387 1
1 716 . 3 1 1 A 60 60 LYS HA H 60 3.972 4.005 -0.033 1
1 725 . 3 1 1 A 60 60 LYS C C 60 176.373 177.521 -1.148 1
1 726 . 3 1 1 A 60 60 LYS CA C 60 59.796 58.915 0.881 1
1 727 . 3 1 1 A 60 60 LYS CB C 60 32.560 32.469 0.091 1
1 729 . 3 1 1 A 60 60 LYS N N 60 122.343 120.389 1.954 1
1 730 . 3 1 1 A 61 61 ASP H H 61 8.157 8.016 0.141 1
1 731 . 3 1 1 A 61 61 ASP HA H 61 4.616 4.612 0.004 1
1 734 . 3 1 1 A 61 61 ASP C C 61 173.246 175.409 -2.163 1
1 735 . 3 1 1 A 61 61 ASP CA C 61 54.272 53.544 0.728 1
1 736 . 3 1 1 A 61 61 ASP CB C 61 41.023 40.418 0.605 1
1 737 . 3 1 1 A 61 61 ASP N N 61 116.173 117.123 -0.950 1
1 738 . 3 1 1 A 62 62 ARG H H 62 7.655 7.667 -0.012 1
1 739 . 3 1 1 A 62 62 ARG HA H 62 4.149 3.960 0.189 1
1 746 . 3 1 1 A 62 62 ARG C C 62 175.891 176.265 -0.374 1
1 747 . 3 1 1 A 62 62 ARG CA C 62 57.381 57.144 0.237 1
1 748 . 3 1 1 A 62 62 ARG CB C 62 26.538 29.320 -2.782 1
1 750 . 3 1 1 A 62 62 ARG N N 62 117.213 118.037 -0.824 1
1 751 . 3 1 1 A 63 63 ARG H H 63 8.302 7.858 0.444 1
1 752 . 3 1 1 A 63 63 ARG HA H 63 4.240 4.150 0.090 1
1 757 . 3 1 1 A 63 63 ARG C C 63 175.775 178.109 -2.334 1
1 758 . 3 1 1 A 63 63 ARG CA C 63 55.718 57.180 -1.462 1
1 760 . 3 1 1 A 63 63 ARG N N 63 116.292 117.830 -1.538 1
1 761 . 3 1 1 A 64 64 TRP H H 64 8.161 7.374 0.787 1
1 762 . 3 1 1 A 64 64 TRP HA H 64 3.836 4.342 -0.506 1
1 771 . 3 1 1 A 64 64 TRP C C 64 176.862 178.584 -1.722 1
1 772 . 3 1 1 A 64 64 TRP CA C 64 62.036 59.751 2.285 1
1 773 . 3 1 1 A 64 64 TRP CB C 64 27.028 28.741 -1.713 1
1 779 . 3 1 1 A 64 64 TRP N N 64 121.486 120.059 1.427 1
1 781 . 3 1 1 A 65 65 ALA H H 65 8.954 7.944 1.010 1
1 782 . 3 1 1 A 65 65 ALA HA H 65 4.290 4.054 0.236 1
1 786 . 3 1 1 A 65 65 ALA C C 65 178.986 179.295 -0.309 1
1 787 . 3 1 1 A 65 65 ALA CA C 65 55.314 55.450 -0.136 1
1 788 . 3 1 1 A 65 65 ALA CB C 65 18.119 18.098 0.021 1
1 789 . 3 1 1 A 65 65 ALA N N 65 121.559 122.543 -0.984 1
1 790 . 3 1 1 A 66 66 ARG H H 66 7.473 7.599 -0.126 1
1 791 . 3 1 1 A 66 66 ARG HA H 66 4.221 4.127 0.094 1
1 798 . 3 1 1 A 66 66 ARG C C 66 176.670 178.193 -1.523 1
1 799 . 3 1 1 A 66 66 ARG CA C 66 57.871 58.887 -1.016 1
1 800 . 3 1 1 A 66 66 ARG CB C 66 29.097 29.895 -0.798 1
1 801 . 3 1 1 A 66 66 ARG N N 66 119.915 117.132 2.783 1
1 802 . 3 1 1 A 67 67 VAL H H 67 7.134 7.479 -0.345 1
1 803 . 3 1 1 A 67 67 VAL HA H 67 3.304 3.924 -0.620 1
1 811 . 3 1 1 A 67 67 VAL C C 67 175.341 178.162 -2.821 1
1 812 . 3 1 1 A 67 67 VAL CA C 67 66.722 63.934 2.788 1
1 813 . 3 1 1 A 67 67 VAL CB C 67 31.108 32.017 -0.909 1
1 816 . 3 1 1 A 67 67 VAL N N 67 119.970 116.453 3.517 1
1 817 . 3 1 1 A 68 68 ALA H H 68 7.745 8.324 -0.579 1
1 818 . 3 1 1 A 68 68 ALA HA H 68 4.076 4.274 -0.198 1
1 822 . 3 1 1 A 68 68 ALA C C 68 177.358 179.379 -2.021 1
1 823 . 3 1 1 A 68 68 ALA CA C 68 55.607 55.812 -0.205 1
1 824 . 3 1 1 A 68 68 ALA CB C 68 18.061 17.954 0.107 1
1 825 . 3 1 1 A 68 68 ALA N N 68 118.239 125.015 -6.776 1
1 826 . 3 1 1 A 69 69 GLN H H 69 7.979 8.104 -0.125 1
1 827 . 3 1 1 A 69 69 GLN HA H 69 4.310 3.977 0.333 1
1 834 . 3 1 1 A 69 69 GLN C C 69 179.370 178.313 1.057 1
1 835 . 3 1 1 A 69 69 GLN CA C 69 59.307 59.202 0.105 1
1 836 . 3 1 1 A 69 69 GLN CB C 69 29.257 28.410 0.847 1
1 838 . 3 1 1 A 69 69 GLN N N 69 118.484 117.956 0.528 1
1 840 . 3 1 1 A 70 70 ARG H H 70 8.374 8.149 0.225 1
1 841 . 3 1 1 A 70 70 ARG HA H 70 4.148 4.085 0.063 1
1 848 . 3 1 1 A 70 70 ARG C C 70 175.850 177.980 -2.130 1
1 849 . 3 1 1 A 70 70 ARG CA C 70 58.957 58.728 0.229 1
1 850 . 3 1 1 A 70 70 ARG CB C 70 29.799 30.174 -0.375 1
1 852 . 3 1 1 A 70 70 ARG N N 70 120.309 120.249 0.060 1
1 853 . 3 1 1 A 71 71 LEU H H 71 7.413 7.760 -0.347 1
1 854 . 3 1 1 A 71 71 LEU HA H 71 4.341 4.162 0.179 1
1 864 . 3 1 1 A 71 71 LEU C C 71 173.391 175.506 -2.115 1
1 865 . 3 1 1 A 71 71 LEU CA C 71 54.911 54.661 0.250 1
1 866 . 3 1 1 A 71 71 LEU CB C 71 42.693 41.562 1.131 1
1 867 . 3 1 1 A 71 71 LEU N N 71 118.841 117.647 1.194 1
1 868 . 3 1 1 A 72 72 ASN H H 72 8.038 7.980 0.058 1
1 869 . 3 1 1 A 72 72 ASN HA H 72 4.394 4.307 0.087 1
1 874 . 3 1 1 A 72 72 ASN C C 72 173.042 174.172 -1.130 1
1 875 . 3 1 1 A 72 72 ASN CB C 72 36.412 37.006 -0.594 1
1 876 . 3 1 1 A 72 72 ASN N N 72 112.919 114.476 -1.557 1
1 878 . 3 1 1 A 73 73 TYR H H 73 7.874 7.673 0.201 1
1 879 . 3 1 1 A 73 73 TYR HA H 73 4.868 4.554 0.314 1
1 886 . 3 1 1 A 73 73 TYR C C 73 172.194 174.130 -1.936 1
1 887 . 3 1 1 A 73 73 TYR CA C 73 57.105 56.779 0.326 1
1 888 . 3 1 1 A 73 73 TYR CB C 73 37.918 38.267 -0.349 1
1 889 . 3 1 1 A 73 73 TYR N N 73 117.432 119.024 -1.592 1
1 897 . 3 1 1 A 75 75 PRO HA H 75 4.626 4.248 0.378 1
1 902 . 3 1 1 A 75 75 PRO C C 75 175.728 177.337 -1.609 1
1 903 . 3 1 1 A 75 75 PRO CA C 75 62.502 63.960 -1.458 1
1 904 . 3 1 1 A 75 75 PRO CB C 75 32.339 31.559 0.780 1
1 905 . 3 1 1 A 76 76 GLY H H 76 8.369 8.880 -0.511 1
1 906 . 3 1 1 A 76 76 GLY HA2 H 76 4.057 3.917 0.140 1
1 907 . 3 1 1 A 76 76 GLY HA3 H 76 4.556 3.918 0.638 1
1 908 . 3 1 1 A 76 76 GLY C C 76 173.248 175.048 -1.800 1
1 909 . 3 1 1 A 76 76 GLY CA C 76 46.180 45.386 0.794 1
1 910 . 3 1 1 A 76 76 GLY N N 76 106.185 111.441 -5.256 1
1 911 . 3 1 1 A 77 77 LYS H H 77 8.632 7.821 0.811 1
1 912 . 3 1 1 A 77 77 LYS HA H 77 4.433 4.042 0.391 1
1 921 . 3 1 1 A 77 77 LYS C C 77 174.924 176.864 -1.940 1
1 922 . 3 1 1 A 77 77 LYS CA C 77 56.453 57.536 -1.083 1
1 923 . 3 1 1 A 77 77 LYS CB C 77 33.170 29.472 3.698 1
1 925 . 3 1 1 A 77 77 LYS N N 77 119.592 115.786 3.806 1
1 926 . 3 1 1 A 78 78 ASN H H 78 8.865 8.228 0.637 1
1 927 . 3 1 1 A 78 78 ASN HA H 78 4.654 4.424 0.230 1
1 932 . 3 1 1 A 78 78 ASN C C 78 174.869 176.805 -1.936 1
1 933 . 3 1 1 A 78 78 ASN CA C 78 54.117 55.585 -1.468 1
1 934 . 3 1 1 A 78 78 ASN CB C 78 37.841 37.035 0.806 1
1 935 . 3 1 1 A 78 78 ASN N N 78 116.880 116.574 0.306 1
1 937 . 3 1 1 A 79 79 ILE H H 79 8.008 8.146 -0.138 1
1 938 . 3 1 1 A 79 79 ILE HA H 79 3.718 3.637 0.081 1
1 948 . 3 1 1 A 79 79 ILE C C 79 175.921 178.513 -2.592 1
1 949 . 3 1 1 A 79 79 ILE CA C 79 63.618 64.506 -0.888 1
1 950 . 3 1 1 A 79 79 ILE CB C 79 37.158 37.011 0.147 1
1 952 . 3 1 1 A 79 79 ILE N N 79 119.688 120.062 -0.374 1
1 953 . 3 1 1 A 80 80 GLY H H 80 9.062 8.343 0.719 1
1 954 . 3 1 1 A 80 80 GLY HA2 H 80 3.739 3.804 -0.065 1
1 955 . 3 1 1 A 80 80 GLY HA3 H 80 3.739 3.847 -0.108 1
1 956 . 3 1 1 A 80 80 GLY C C 80 173.185 176.014 -2.829 1
1 957 . 3 1 1 A 80 80 GLY CA C 80 48.166 47.478 0.688 1
1 958 . 3 1 1 A 80 80 GLY N N 80 110.338 108.808 1.530 1
1 959 . 3 1 1 A 81 81 SER H H 81 7.460 8.105 -0.645 1
1 960 . 3 1 1 A 81 81 SER HA H 81 3.904 4.085 -0.181 1
1 963 . 3 1 1 A 81 81 SER C C 81 174.999 177.019 -2.020 1
1 964 . 3 1 1 A 81 81 SER CA C 81 61.138 61.045 0.093 1
1 965 . 3 1 1 A 81 81 SER CB C 81 62.740 62.650 0.090 1
1 966 . 3 1 1 A 81 81 SER N N 81 115.348 116.972 -1.624 1
1 967 . 3 1 1 A 82 82 LEU H H 82 7.367 7.495 -0.128 1
1 968 . 3 1 1 A 82 82 LEU HA H 82 3.946 3.794 0.152 1
1 977 . 3 1 1 A 82 82 LEU C C 82 176.969 177.742 -0.773 1
1 978 . 3 1 1 A 82 82 LEU CA C 82 57.504 58.060 -0.556 1
1 979 . 3 1 1 A 82 82 LEU CB C 82 42.185 41.245 0.940 1
1 980 . 3 1 1 A 82 82 LEU N N 82 124.267 122.718 1.549 1
1 981 . 3 1 1 A 83 83 LEU H H 83 8.330 8.231 0.099 1
1 982 . 3 1 1 A 83 83 LEU HA H 83 3.924 3.915 0.009 1
1 991 . 3 1 1 A 83 83 LEU C C 83 176.303 178.338 -2.035 1
1 992 . 3 1 1 A 83 83 LEU CA C 83 58.067 58.349 -0.282 1
1 993 . 3 1 1 A 83 83 LEU CB C 83 41.061 41.531 -0.470 1
1 994 . 3 1 1 A 83 83 LEU N N 83 117.452 119.670 -2.218 1
1 995 . 3 1 1 A 84 84 ARG H H 84 7.651 8.093 -0.442 1
1 996 . 3 1 1 A 84 84 ARG HA H 84 2.230 3.439 -1.209 1
1 1003 . 3 1 1 A 84 84 ARG C C 84 175.902 178.563 -2.661 1
1 1004 . 3 1 1 A 84 84 ARG CA C 84 59.112 59.346 -0.234 1
1 1005 . 3 1 1 A 84 84 ARG CB C 84 28.579 29.610 -1.031 1
1 1007 . 3 1 1 A 84 84 ARG N N 84 119.586 119.784 -0.198 1
1 1008 . 3 1 1 A 85 85 SER H H 85 7.291 8.359 -1.068 1
1 1009 . 3 1 1 A 85 85 SER HA H 85 4.189 4.134 0.055 1
1 1012 . 3 1 1 A 85 85 SER C C 85 175.546 176.664 -1.118 1
1 1013 . 3 1 1 A 85 85 SER CA C 85 61.376 61.969 -0.593 1
1 1014 . 3 1 1 A 85 85 SER CB C 85 62.805 63.194 -0.389 1
1 1015 . 3 1 1 A 85 85 SER N N 85 112.921 115.801 -2.880 1
1 1016 . 3 1 1 A 86 86 HIS H H 86 8.156 7.429 0.727 1
1 1017 . 3 1 1 A 86 86 HIS HA H 86 4.782 4.188 0.594 1
1 1022 . 3 1 1 A 86 86 HIS C C 86 176.851 177.547 -0.696 1
1 1023 . 3 1 1 A 86 86 HIS CA C 86 58.898 59.714 -0.816 1
1 1024 . 3 1 1 A 86 86 HIS CB C 86 31.110 29.617 1.493 1
1 1027 . 3 1 1 A 86 86 HIS N N 86 119.258 119.316 -0.058 1
1 1028 . 3 1 1 A 87 87 TYR H H 87 9.180 8.324 0.856 1
1 1029 . 3 1 1 A 87 87 TYR HA H 87 3.913 3.926 -0.013 1
1 1036 . 3 1 1 A 87 87 TYR C C 87 176.841 177.748 -0.907 1
1 1037 . 3 1 1 A 87 87 TYR CA C 87 63.526 61.643 1.883 1
1 1038 . 3 1 1 A 87 87 TYR CB C 87 39.431 38.360 1.071 1
1 1041 . 3 1 1 A 87 87 TYR N N 87 120.625 120.041 0.584 1
1 1042 . 3 1 1 A 88 88 GLU H H 88 9.028 8.283 0.745 1
1 1043 . 3 1 1 A 88 88 GLU HA H 88 3.682 3.976 -0.294 1
1 1048 . 3 1 1 A 88 88 GLU C C 88 175.833 178.888 -3.055 1
1 1049 . 3 1 1 A 88 88 GLU CA C 88 59.730 59.751 -0.021 1
1 1050 . 3 1 1 A 88 88 GLU CB C 88 30.009 29.516 0.493 1
1 1052 . 3 1 1 A 88 88 GLU N N 88 119.531 119.688 -0.157 1
1 1053 . 3 1 1 A 89 89 ARG H H 89 8.052 7.475 0.577 1
1 1054 . 3 1 1 A 89 89 ARG HA H 89 4.292 4.309 -0.017 1
1 1061 . 3 1 1 A 89 89 ARG C C 89 176.045 177.918 -1.873 1
1 1062 . 3 1 1 A 89 89 ARG CA C 89 58.538 58.216 0.322 1
1 1063 . 3 1 1 A 89 89 ARG CB C 89 31.841 30.906 0.935 1
1 1065 . 3 1 1 A 89 89 ARG N N 89 114.741 119.266 -4.525 1
1 1066 . 3 1 1 A 90 90 ILE H H 90 8.141 7.979 0.162 1
1 1067 . 3 1 1 A 90 90 ILE HA H 90 4.296 3.427 0.869 1
1 1075 . 3 1 1 A 90 90 ILE C C 90 174.461 176.940 -2.479 1
1 1076 . 3 1 1 A 90 90 ILE CA C 90 63.649 63.600 0.049 1
1 1077 . 3 1 1 A 90 90 ILE CB C 90 40.626 38.465 2.161 1
1 1079 . 3 1 1 A 90 90 ILE N N 90 113.421 119.167 -5.746 1
1 1080 . 3 1 1 A 91 91 VAL H H 91 7.350 7.485 -0.135 1
1 1081 . 3 1 1 A 91 91 VAL HA H 91 4.144 3.693 0.451 1
1 1089 . 3 1 1 A 91 91 VAL C C 91 175.422 177.107 -1.685 1
1 1090 . 3 1 1 A 91 91 VAL CA C 91 65.042 64.430 0.612 1
1 1091 . 3 1 1 A 91 91 VAL CB C 91 33.215 31.319 1.896 1
1 1092 . 3 1 1 A 91 91 VAL N N 91 118.215 121.509 -3.294 1
1 1093 . 3 1 1 A 92 92 TYR H H 92 8.565 8.184 0.381 1
1 1094 . 3 1 1 A 92 92 TYR HA H 92 4.217 4.289 -0.072 1
1 1099 . 3 1 1 A 92 92 TYR C C 92 171.495 174.988 -3.493 1
1 1100 . 3 1 1 A 92 92 TYR CA C 92 61.558 62.397 -0.839 1
1 1101 . 3 1 1 A 92 92 TYR CB C 92 36.757 37.177 -0.420 1
1 1102 . 3 1 1 A 92 92 TYR N N 92 121.370 121.812 -0.442 1
1 1103 . 3 1 1 A 93 93 PRO HA H 93 4.136 4.309 -0.173 1
1 1108 . 3 1 1 A 93 93 PRO C C 93 177.077 178.465 -1.388 1
1 1109 . 3 1 1 A 93 93 PRO CA C 93 66.037 66.034 0.003 1
1 1110 . 3 1 1 A 93 93 PRO CB C 93 31.482 30.805 0.677 1
1 1111 . 3 1 1 A 94 94 TYR H H 94 6.517 7.498 -0.981 1
1 1112 . 3 1 1 A 94 94 TYR HA H 94 2.798 4.350 -1.552 1
1 1119 . 3 1 1 A 94 94 TYR C C 94 174.985 178.193 -3.208 1
1 1120 . 3 1 1 A 94 94 TYR CA C 94 59.356 59.746 -0.390 1
1 1121 . 3 1 1 A 94 94 TYR CB C 94 37.987 37.075 0.912 1
1 1124 . 3 1 1 A 94 94 TYR N N 94 115.987 117.353 -1.366 1
1 1125 . 3 1 1 A 95 95 GLU H H 95 8.205 8.389 -0.184 1
1 1126 . 3 1 1 A 95 95 GLU HA H 95 3.682 4.167 -0.485 1
1 1131 . 3 1 1 A 95 95 GLU C C 95 178.530 179.055 -0.525 1
1 1132 . 3 1 1 A 95 95 GLU CA C 95 58.910 59.711 -0.801 1
1 1133 . 3 1 1 A 95 95 GLU CB C 95 29.187 29.583 -0.396 1
1 1134 . 3 1 1 A 95 95 GLU N N 95 119.946 121.255 -1.309 1
1 1135 . 3 1 1 A 96 96 MET H H 96 8.248 7.859 0.389 1
1 1136 . 3 1 1 A 96 96 MET HA H 96 4.172 4.180 -0.008 1
1 1142 . 3 1 1 A 96 96 MET C C 96 176.874 178.136 -1.262 1
1 1143 . 3 1 1 A 96 96 MET CA C 96 57.159 59.103 -1.944 1
1 1144 . 3 1 1 A 96 96 MET CB C 96 31.829 32.208 -0.379 1
1 1146 . 3 1 1 A 96 96 MET N N 96 117.570 118.913 -1.343 1
1 1147 . 3 1 1 A 97 97 TYR H H 97 7.445 8.280 -0.835 1
1 1148 . 3 1 1 A 97 97 TYR HA H 97 4.248 3.993 0.255 1
1 1155 . 3 1 1 A 97 97 TYR C C 97 176.476 177.533 -1.057 1
1 1156 . 3 1 1 A 97 97 TYR CA C 97 60.470 61.655 -1.185 1
1 1157 . 3 1 1 A 97 97 TYR CB C 97 38.612 38.428 0.184 1
1 1160 . 3 1 1 A 97 97 TYR N N 97 122.246 121.056 1.190 1
1 1161 . 3 1 1 A 98 98 GLN H H 98 8.087 8.696 -0.609 1
1 1162 . 3 1 1 A 98 98 GLN HA H 98 3.793 3.507 0.286 1
1 1169 . 3 1 1 A 98 98 GLN C C 98 175.549 178.881 -3.332 1
1 1170 . 3 1 1 A 98 98 GLN CA C 98 57.365 59.044 -1.679 1
1 1171 . 3 1 1 A 98 98 GLN CB C 98 28.901 28.404 0.497 1
1 1173 . 3 1 1 A 98 98 GLN N N 98 118.769 118.406 0.363 1
1 1175 . 3 1 1 A 99 99 SER H H 99 7.724 8.228 -0.504 1
1 1176 . 3 1 1 A 99 99 SER HA H 99 4.293 4.248 0.045 1
1 1179 . 3 1 1 A 99 99 SER C C 99 173.696 176.951 -3.255 1
1 1180 . 3 1 1 A 99 99 SER CA C 99 59.566 62.754 -3.188 1
1 1181 . 3 1 1 A 99 99 SER CB C 99 63.847 62.498 1.349 1
1 1182 . 3 1 1 A 99 99 SER N N 99 113.257 116.633 -3.376 1
1 1183 . 3 1 1 A 100 100 GLY H H 100 7.751 8.305 -0.554 1
1 1184 . 3 1 1 A 100 100 GLY HA2 H 100 3.813 3.864 -0.051 1
1 1185 . 3 1 1 A 100 100 GLY HA3 H 100 3.934 3.867 0.067 1
1 1186 . 3 1 1 A 100 100 GLY C C 100 172.643 176.355 -3.712 1
1 1187 . 3 1 1 A 100 100 GLY CA C 100 45.570 46.995 -1.425 1
1 1188 . 3 1 1 A 100 100 GLY N N 100 109.750 108.765 0.985 1
1 1189 . 3 1 1 A 101 101 ALA H H 101 7.824 7.819 0.005 1
1 1190 . 3 1 1 A 101 101 ALA HA H 101 4.221 3.911 0.310 1
1 1194 . 3 1 1 A 101 101 ALA C C 101 175.639 179.603 -3.964 1
1 1195 . 3 1 1 A 101 101 ALA CA C 101 52.745 54.486 -1.741 1
1 1196 . 3 1 1 A 101 101 ALA CB C 101 19.437 18.516 0.921 1
1 1197 . 3 1 1 A 101 101 ALA N N 101 123.241 124.646 -1.405 1
1 1198 . 3 1 1 A 102 102 ASN H H 102 8.191 7.737 0.454 1
1 1199 . 3 1 1 A 102 102 ASN HA H 102 4.658 4.681 -0.023 1
1 1204 . 3 1 1 A 102 102 ASN C C 102 173.337 175.765 -2.428 1
1 1205 . 3 1 1 A 102 102 ASN CA C 102 53.374 55.517 -2.143 1
1 1206 . 3 1 1 A 102 102 ASN CB C 102 38.819 39.075 -0.256 1
1 1207 . 3 1 1 A 102 102 ASN N N 102 116.572 114.363 2.209 1
1 1209 . 3 1 1 A 103 103 LEU H H 103 8.065 7.636 0.429 1
1 1210 . 3 1 1 A 103 103 LEU HA H 103 4.363 4.643 -0.280 1
1 1219 . 3 1 1 A 103 103 LEU C C 103 175.637 174.822 0.815 1
1 1220 . 3 1 1 A 103 103 LEU CA C 103 55.292 53.955 1.337 1
1 1221 . 3 1 1 A 103 103 LEU CB C 103 42.433 44.732 -2.299 1
1 1222 . 3 1 1 A 103 103 LEU N N 103 122.074 113.771 8.303 1
1 1223 . 3 1 1 A 104 104 VAL H H 104 8.055 8.620 -0.565 1
1 1224 . 3 1 1 A 104 104 VAL HA H 104 4.131 4.816 -0.685 1
1 1232 . 3 1 1 A 104 104 VAL C C 104 174.364 174.724 -0.360 1
1 1233 . 3 1 1 A 104 104 VAL CA C 104 62.552 60.338 2.214 1
1 1234 . 3 1 1 A 104 104 VAL CB C 104 32.766 35.107 -2.341 1
1 1235 . 3 1 1 A 104 104 VAL N N 104 120.606 119.000 1.606 1
1 1236 . 3 1 1 A 105 105 CYS H H 105 8.392 8.959 -0.567 1
1 1237 . 3 1 1 A 105 105 CYS HA H 105 4.535 4.927 -0.392 1
1 1240 . 3 1 1 A 105 105 CYS C C 105 172.593 175.370 -2.777 1
1 1241 . 3 1 1 A 105 105 CYS CA C 105 58.449 58.411 0.038 1
1 1242 . 3 1 1 A 105 105 CYS CB C 105 27.952 28.724 -0.772 1
1 1243 . 3 1 1 A 105 105 CYS N N 105 122.791 127.834 -5.043 1
1 1244 . 3 1 1 A 106 106 ASN H H 106 8.575 8.364 0.211 1
1 1245 . 3 1 1 A 106 106 ASN HA H 106 4.843 4.697 0.146 1
1 1250 . 3 1 1 A 106 106 ASN C C 106 173.594 176.624 -3.030 1
1 1251 . 3 1 1 A 106 106 ASN CA C 106 53.337 54.338 -1.001 1
1 1252 . 3 1 1 A 106 106 ASN CB C 106 39.088 38.671 0.417 1
1 1253 . 3 1 1 A 106 106 ASN N N 106 122.001 118.125 3.876 1
1 1255 . 3 1 1 A 107 107 THR H H 107 8.090 8.031 0.059 1
1 1256 . 3 1 1 A 107 107 THR HA H 107 4.348 4.914 -0.566 1
1 1261 . 3 1 1 A 107 107 THR C C 107 172.516 176.060 -3.544 1
1 1262 . 3 1 1 A 107 107 THR CA C 107 61.803 63.261 -1.458 1
1 1263 . 3 1 1 A 107 107 THR CB C 107 69.812 69.342 0.470 1
1 1265 . 3 1 1 A 107 107 THR N N 107 114.374 112.937 1.437 1
1 1266 . 3 1 1 A 108 108 ARG H H 108 8.322 7.999 0.323 1
1 1267 . 3 1 1 A 108 108 ARG HA H 108 4.634 4.153 0.481 1
1 1274 . 3 1 1 A 108 108 ARG C C 108 172.608 177.739 -5.131 1
1 1275 . 3 1 1 A 108 108 ARG CA C 108 54.026 61.272 -7.246 1
1 1276 . 3 1 1 A 108 108 ARG CB C 108 30.246 28.700 1.546 1
1 1278 . 3 1 1 A 108 108 ARG N N 108 124.017 122.916 1.101 1
1 1279 . 3 1 1 A 109 109 PRO HA H 109 4.354 4.585 -0.231 1
1 1286 . 3 1 1 A 109 109 PRO C C 109 174.978 177.525 -2.547 1
1 1287 . 3 1 1 A 109 109 PRO CA C 109 63.396 63.913 -0.517 1
1 1288 . 3 1 1 A 109 109 PRO CB C 109 32.046 33.008 -0.962 1
1 1290 . 3 1 1 A 110 110 PHE H H 110 8.123 7.871 0.252 1
1 1291 . 3 1 1 A 110 110 PHE HA H 110 4.619 4.404 0.215 1
1 1296 . 3 1 1 A 110 110 PHE C C 110 173.856 176.529 -2.673 1
1 1297 . 3 1 1 A 110 110 PHE CA C 110 57.353 62.340 -4.987 1
1 1298 . 3 1 1 A 110 110 PHE CB C 110 39.364 39.399 -0.035 1
1 1301 . 3 1 1 A 110 110 PHE N N 110 119.265 120.136 -0.871 1
1 1302 . 3 1 1 A 111 111 ASP H H 111 8.161 8.724 -0.563 1
1 1303 . 3 1 1 A 111 111 ASP HA H 111 4.613 4.523 0.090 1
1 1306 . 3 1 1 A 111 111 ASP C C 111 174.114 178.486 -4.372 1
1 1307 . 3 1 1 A 111 111 ASP CA C 111 54.350 57.908 -3.558 1
1 1308 . 3 1 1 A 111 111 ASP CB C 111 41.413 41.463 -0.050 1
1 1309 . 3 1 1 A 111 111 ASP N N 111 121.764 119.156 2.608 1
1 1310 . 3 1 1 A 112 112 ASN H H 112 8.307 8.401 -0.094 1
1 1311 . 3 1 1 A 112 112 ASN HA H 112 4.662 4.487 0.175 1
1 1316 . 3 1 1 A 112 112 ASN C C 112 173.595 176.961 -3.366 1
1 1317 . 3 1 1 A 112 112 ASN CA C 112 53.486 56.999 -3.513 1
1 1318 . 3 1 1 A 112 112 ASN CB C 112 39.225 39.566 -0.341 1
1 1319 . 3 1 1 A 112 112 ASN N N 112 119.154 117.733 1.421 1
1 1321 . 3 1 1 A 113 113 GLU H H 113 8.404 8.262 0.142 1
1 1322 . 3 1 1 A 113 113 GLU HA H 113 4.264 4.382 -0.118 1
1 1327 . 3 1 1 A 113 113 GLU C C 113 174.886 178.038 -3.152 1
1 1328 . 3 1 1 A 113 113 GLU CA C 113 56.681 56.817 -0.136 1
1 1329 . 3 1 1 A 113 113 GLU CB C 113 30.403 30.460 -0.057 1
1 1331 . 3 1 1 A 113 113 GLU N N 113 120.943 116.801 4.142 1
1 1332 . 3 1 1 A 114 114 GLU H H 114 8.388 8.093 0.295 1
1 1333 . 3 1 1 A 114 114 GLU HA H 114 4.262 4.139 0.123 1
1 1338 . 3 1 1 A 114 114 GLU C C 114 174.819 177.392 -2.573 1
1 1339 . 3 1 1 A 114 114 GLU CA C 114 56.769 59.456 -2.687 1
1 1340 . 3 1 1 A 114 114 GLU CB C 114 30.125 29.685 0.440 1
1 1342 . 3 1 1 A 114 114 GLU N N 114 121.869 120.959 0.910 1
1 1343 . 3 1 1 A 115 115 LYS H H 115 8.236 7.888 0.348 1
1 1344 . 3 1 1 A 115 115 LYS HA H 115 4.347 4.567 -0.220 1
1 1353 . 3 1 1 A 115 115 LYS C C 115 174.633 175.959 -1.326 1
1 1354 . 3 1 1 A 115 115 LYS CA C 115 56.426 54.706 1.720 1
1 1355 . 3 1 1 A 115 115 LYS CB C 115 33.277 32.644 0.633 1
1 1359 . 3 1 1 A 115 115 LYS N N 115 121.997 119.043 2.954 1
1 1360 . 3 1 1 A 116 116 ASP H H 116 8.386 8.530 -0.144 1
1 1361 . 3 1 1 A 116 116 ASP HA H 116 4.600 4.392 0.208 1
1 1364 . 3 1 1 A 116 116 ASP C C 116 173.448 176.170 -2.722 1
1 1365 . 3 1 1 A 116 116 ASP CA C 116 54.773 57.308 -2.535 1
1 1366 . 3 1 1 A 116 116 ASP CB C 116 41.029 41.410 -0.381 1
1 1367 . 3 1 1 A 116 116 ASP N N 116 121.057 126.190 -5.133 1
1 5 . 4 1 1 A 2 2 MET HA H 2 4.534 4.192 0.342 1
1 13 . 4 1 1 A 2 2 MET C C 2 174.355 178.537 -4.182 1
1 14 . 4 1 1 A 2 2 MET CA C 2 56.247 58.490 -2.243 1
1 15 . 4 1 1 A 2 2 MET CB C 2 32.855 32.443 0.412 1
1 18 . 4 1 1 A 3 3 ASN H H 3 8.600 8.487 0.113 1
1 19 . 4 1 1 A 3 3 ASN HA H 3 4.711 4.524 0.187 1
1 24 . 4 1 1 A 3 3 ASN C C 3 173.983 177.884 -3.901 1
1 25 . 4 1 1 A 3 3 ASN CA C 3 53.650 56.414 -2.764 1
1 26 . 4 1 1 A 3 3 ASN CB C 3 38.624 39.640 -1.016 1
1 27 . 4 1 1 A 3 3 ASN N N 3 120.149 119.008 1.141 1
1 29 . 4 1 1 A 4 4 GLU H H 4 8.495 8.438 0.057 1
1 30 . 4 1 1 A 4 4 GLU HA H 4 4.235 4.086 0.149 1
1 35 . 4 1 1 A 4 4 GLU C C 4 175.752 178.877 -3.125 1
1 36 . 4 1 1 A 4 4 GLU CA C 4 58.075 58.909 -0.834 1
1 37 . 4 1 1 A 4 4 GLU CB C 4 30.125 29.739 0.386 1
1 38 . 4 1 1 A 4 4 GLU N N 4 121.543 118.626 2.917 1
1 39 . 4 1 1 A 5 5 LEU HA H 5 4.073 4.237 -0.164 1
1 47 . 4 1 1 A 5 5 LEU CB C 5 41.897 42.653 -0.756 1
1 50 . 4 1 1 A 6 6 GLU H H 6 8.332 8.490 -0.158 1
1 51 . 4 1 1 A 6 6 GLU HA H 6 3.621 4.199 -0.578 1
1 52 . 4 1 1 A 6 6 GLU C C 6 176.402 178.766 -2.364 1
1 53 . 4 1 1 A 6 6 GLU CA C 6 58.461 58.623 -0.162 1
1 54 . 4 1 1 A 6 6 GLU CB C 6 29.730 29.836 -0.106 1
1 55 . 4 1 1 A 6 6 GLU N N 6 121.462 119.111 2.351 1
1 56 . 4 1 1 A 7 7 ALA H H 7 8.244 7.674 0.570 1
1 57 . 4 1 1 A 7 7 ALA HA H 7 4.185 4.094 0.091 1
1 61 . 4 1 1 A 7 7 ALA C C 7 177.982 177.556 0.426 1
1 62 . 4 1 1 A 7 7 ALA CA C 7 54.791 55.075 -0.284 1
1 63 . 4 1 1 A 7 7 ALA CB C 7 18.836 18.781 0.055 1
1 64 . 4 1 1 A 7 7 ALA N N 7 123.078 122.016 1.062 1
1 65 . 4 1 1 A 8 8 GLN H H 8 8.274 7.269 1.005 1
1 66 . 4 1 1 A 8 8 GLN HA H 8 4.219 4.676 -0.457 1
1 73 . 4 1 1 A 8 8 GLN C C 8 176.325 174.870 1.455 1
1 74 . 4 1 1 A 8 8 GLN CA C 8 57.864 55.153 2.711 1
1 75 . 4 1 1 A 8 8 GLN CB C 8 28.768 30.559 -1.791 1
1 77 . 4 1 1 A 8 8 GLN N N 8 117.452 117.621 -0.169 1
1 79 . 4 1 1 A 9 9 THR H H 9 8.043 8.639 -0.596 1
1 80 . 4 1 1 A 9 9 THR HA H 9 3.998 4.724 -0.726 1
1 85 . 4 1 1 A 9 9 THR C C 9 173.904 174.554 -0.650 1
1 86 . 4 1 1 A 9 9 THR CA C 9 65.435 60.899 4.536 1
1 87 . 4 1 1 A 9 9 THR CB C 9 68.870 69.974 -1.104 1
1 89 . 4 1 1 A 9 9 THR N N 9 116.135 119.118 -2.983 1
1 90 . 4 1 1 A 10 10 ARG H H 10 8.095 8.962 -0.867 1
1 91 . 4 1 1 A 10 10 ARG HA H 10 4.040 3.984 0.056 1
1 98 . 4 1 1 A 10 10 ARG C C 10 176.583 175.614 0.969 1
1 99 . 4 1 1 A 10 10 ARG CA C 10 59.262 57.553 1.709 1
1 100 . 4 1 1 A 10 10 ARG CB C 10 29.900 27.952 1.948 1
1 101 . 4 1 1 A 10 10 ARG N N 10 121.157 119.955 1.202 1
1 102 . 4 1 1 A 11 11 VAL H H 11 7.657 7.910 -0.253 1
1 103 . 4 1 1 A 11 11 VAL HA H 11 3.769 4.431 -0.662 1
1 111 . 4 1 1 A 11 11 VAL C C 11 176.662 177.779 -1.117 1
1 112 . 4 1 1 A 11 11 VAL CA C 11 65.914 64.034 1.880 1
1 113 . 4 1 1 A 11 11 VAL CB C 11 31.745 33.507 -1.762 1
1 114 . 4 1 1 A 11 11 VAL N N 11 118.580 118.208 0.372 1
1 115 . 4 1 1 A 12 12 LYS H H 12 7.471 8.383 -0.912 1
1 116 . 4 1 1 A 12 12 LYS HA H 12 3.366 4.332 -0.966 1
1 123 . 4 1 1 A 12 12 LYS C C 12 176.457 179.143 -2.686 1
1 124 . 4 1 1 A 12 12 LYS CA C 12 59.545 59.096 0.449 1
1 125 . 4 1 1 A 12 12 LYS CB C 12 32.206 32.530 -0.324 1
1 126 . 4 1 1 A 12 12 LYS N N 12 121.835 122.275 -0.440 1
1 127 . 4 1 1 A 13 13 LEU H H 13 8.144 8.000 0.144 1
1 128 . 4 1 1 A 13 13 LEU HA H 13 4.093 4.033 0.060 1
1 137 . 4 1 1 A 13 13 LEU C C 13 178.254 178.834 -0.580 1
1 138 . 4 1 1 A 13 13 LEU CA C 13 58.023 57.952 0.071 1
1 139 . 4 1 1 A 13 13 LEU CB C 13 41.283 41.669 -0.386 1
1 140 . 4 1 1 A 13 13 LEU N N 13 118.688 120.695 -2.007 1
1 141 . 4 1 1 A 14 14 ASN H H 14 8.384 9.106 -0.722 1
1 142 . 4 1 1 A 14 14 ASN HA H 14 4.567 4.415 0.152 1
1 147 . 4 1 1 A 14 14 ASN C C 14 175.397 177.049 -1.652 1
1 148 . 4 1 1 A 14 14 ASN CA C 14 56.239 55.971 0.268 1
1 149 . 4 1 1 A 14 14 ASN CB C 14 38.432 39.307 -0.875 1
1 150 . 4 1 1 A 14 14 ASN N N 14 118.175 118.441 -0.266 1
1 152 . 4 1 1 A 15 15 TYR H H 15 7.982 7.807 0.175 1
1 153 . 4 1 1 A 15 15 TYR HA H 15 4.249 4.090 0.159 1
1 160 . 4 1 1 A 15 15 TYR C C 15 175.503 177.303 -1.800 1
1 161 . 4 1 1 A 15 15 TYR CA C 15 62.450 61.423 1.027 1
1 162 . 4 1 1 A 15 15 TYR CB C 15 39.399 38.408 0.991 1
1 163 . 4 1 1 A 15 15 TYR N N 15 121.955 120.526 1.429 1
1 164 . 4 1 1 A 16 16 LEU H H 16 8.198 8.374 -0.176 1
1 165 . 4 1 1 A 16 16 LEU HA H 16 4.470 3.971 0.499 1
1 175 . 4 1 1 A 16 16 LEU C C 16 177.125 178.254 -1.129 1
1 176 . 4 1 1 A 16 16 LEU CA C 16 57.374 58.081 -0.707 1
1 177 . 4 1 1 A 16 16 LEU CB C 16 41.443 41.652 -0.209 1
1 178 . 4 1 1 A 16 16 LEU N N 16 117.642 121.649 -4.007 1
1 179 . 4 1 1 A 17 17 ASP H H 17 8.061 8.748 -0.687 1
1 180 . 4 1 1 A 17 17 ASP C C 17 177.836 178.798 -0.962 1
1 181 . 4 1 1 A 17 17 ASP CA C 17 57.486 57.398 0.088 1
1 182 . 4 1 1 A 17 17 ASP CB C 17 41.433 40.509 0.924 1
1 183 . 4 1 1 A 17 17 ASP N N 17 118.700 117.797 0.903 1
1 184 . 4 1 1 A 18 18 GLN H H 18 8.111 7.802 0.309 1
1 185 . 4 1 1 A 18 18 GLN HA H 18 4.002 4.030 -0.028 1
1 190 . 4 1 1 A 18 18 GLN CA C 18 59.046 58.813 0.233 1
1 191 . 4 1 1 A 18 18 GLN CB C 18 28.700 28.514 0.186 1
1 193 . 4 1 1 A 18 18 GLN N N 18 119.539 119.779 -0.240 1
1 195 . 4 1 1 A 19 19 ILE H H 19 8.330 8.195 0.135 1
1 196 . 4 1 1 A 19 19 ILE HA H 19 3.306 3.912 -0.606 1
1 204 . 4 1 1 A 19 19 ILE C C 19 175.608 177.707 -2.099 1
1 205 . 4 1 1 A 19 19 ILE CA C 19 64.760 63.745 1.015 1
1 206 . 4 1 1 A 19 19 ILE CB C 19 37.148 36.769 0.379 1
1 209 . 4 1 1 A 19 19 ILE N N 19 121.490 119.931 1.559 1
1 210 . 4 1 1 A 20 20 ALA H H 20 8.057 8.154 -0.097 1
1 211 . 4 1 1 A 20 20 ALA HA H 20 4.349 4.110 0.239 1
1 215 . 4 1 1 A 20 20 ALA C C 20 179.297 179.193 0.104 1
1 216 . 4 1 1 A 20 20 ALA CA C 20 56.150 55.613 0.537 1
1 217 . 4 1 1 A 20 20 ALA CB C 20 18.104 18.321 -0.217 1
1 218 . 4 1 1 A 20 20 ALA N N 20 124.441 123.867 0.574 1
1 219 . 4 1 1 A 21 21 LYS H H 21 8.116 7.871 0.245 1
1 220 . 4 1 1 A 21 21 LYS HA H 21 4.108 4.005 0.103 1
1 229 . 4 1 1 A 21 21 LYS C C 21 176.720 178.520 -1.800 1
1 230 . 4 1 1 A 21 21 LYS CA C 21 59.166 59.293 -0.127 1
1 231 . 4 1 1 A 21 21 LYS CB C 21 32.085 32.036 0.049 1
1 233 . 4 1 1 A 21 21 LYS N N 21 119.865 119.173 0.692 1
1 234 . 4 1 1 A 22 22 PHE H H 22 7.875 8.036 -0.161 1
1 235 . 4 1 1 A 22 22 PHE HA H 22 4.012 4.079 -0.067 1
1 242 . 4 1 1 A 22 22 PHE C C 22 175.545 177.543 -1.998 1
1 243 . 4 1 1 A 22 22 PHE CA C 22 61.070 61.536 -0.466 1
1 244 . 4 1 1 A 22 22 PHE CB C 22 39.072 39.320 -0.248 1
1 249 . 4 1 1 A 22 22 PHE N N 22 119.729 119.828 -0.099 1
1 250 . 4 1 1 A 23 23 TRP H H 23 7.841 7.606 0.235 1
1 251 . 4 1 1 A 23 23 TRP HA H 23 4.149 3.785 0.364 1
1 260 . 4 1 1 A 23 23 TRP C C 23 176.668 177.980 -1.312 1
1 261 . 4 1 1 A 23 23 TRP CB C 23 28.543 29.532 -0.989 1
1 267 . 4 1 1 A 23 23 TRP N N 23 119.440 120.636 -1.196 1
1 269 . 4 1 1 A 24 24 GLU H H 24 8.261 8.343 -0.082 1
1 270 . 4 1 1 A 24 24 GLU HA H 24 4.265 4.297 -0.032 1
1 275 . 4 1 1 A 24 24 GLU C C 24 179.679 179.332 0.347 1
1 276 . 4 1 1 A 24 24 GLU CA C 24 59.706 59.041 0.665 1
1 277 . 4 1 1 A 24 24 GLU CB C 24 29.720 29.394 0.326 1
1 279 . 4 1 1 A 24 24 GLU N N 24 121.376 118.713 2.663 1
1 280 . 4 1 1 A 25 25 ILE H H 25 8.071 7.717 0.354 1
1 281 . 4 1 1 A 25 25 ILE HA H 25 3.815 3.808 0.007 1
1 291 . 4 1 1 A 25 25 ILE C C 25 176.343 177.865 -1.522 1
1 292 . 4 1 1 A 25 25 ILE CA C 25 64.464 62.200 2.264 1
1 293 . 4 1 1 A 25 25 ILE CB C 25 37.371 37.608 -0.237 1
1 296 . 4 1 1 A 25 25 ILE N N 25 121.499 119.819 1.680 1
1 297 . 4 1 1 A 26 26 GLN H H 26 7.327 7.223 0.104 1
1 298 . 4 1 1 A 26 26 GLN HA H 26 4.074 4.113 -0.039 1
1 305 . 4 1 1 A 26 26 GLN C C 26 174.906 175.677 -0.771 1
1 306 . 4 1 1 A 26 26 GLN CA C 26 55.450 55.894 -0.444 1
1 307 . 4 1 1 A 26 26 GLN CB C 26 28.458 28.958 -0.500 1
1 309 . 4 1 1 A 26 26 GLN N N 26 116.532 120.592 -4.060 1
1 311 . 4 1 1 A 27 27 GLY H H 27 7.861 8.071 -0.210 1
1 312 . 4 1 1 A 27 27 GLY HA2 H 27 4.297 3.798 0.499 1
1 313 . 4 1 1 A 27 27 GLY HA3 H 27 3.823 3.803 0.020 1
1 314 . 4 1 1 A 27 27 GLY C C 27 172.698 173.149 -0.451 1
1 315 . 4 1 1 A 27 27 GLY CA C 27 45.608 45.114 0.494 1
1 316 . 4 1 1 A 27 27 GLY N N 27 106.837 108.066 -1.229 1
1 317 . 4 1 1 A 28 28 SER H H 28 8.083 6.969 1.114 1
1 318 . 4 1 1 A 28 28 SER HA H 28 4.777 4.740 0.037 1
1 321 . 4 1 1 A 28 28 SER C C 28 171.196 171.773 -0.577 1
1 322 . 4 1 1 A 28 28 SER CA C 28 56.041 56.872 -0.831 1
1 323 . 4 1 1 A 28 28 SER CB C 28 64.539 66.551 -2.012 1
1 324 . 4 1 1 A 28 28 SER N N 28 116.151 114.269 1.882 1
1 325 . 4 1 1 A 29 29 SER H H 29 8.354 8.577 -0.223 1
1 326 . 4 1 1 A 29 29 SER HA H 29 4.389 5.152 -0.763 1
1 329 . 4 1 1 A 29 29 SER C C 29 172.166 172.079 0.087 1
1 330 . 4 1 1 A 29 29 SER CA C 29 58.107 56.163 1.944 1
1 331 . 4 1 1 A 29 29 SER CB C 29 63.853 66.072 -2.219 1
1 332 . 4 1 1 A 29 29 SER N N 29 116.596 114.599 1.997 1
1 333 . 4 1 1 A 30 30 LEU H H 30 8.990 8.968 0.022 1
1 334 . 4 1 1 A 30 30 LEU HA H 30 3.964 5.346 -1.382 1
1 344 . 4 1 1 A 30 30 LEU C C 30 173.752 175.026 -1.274 1
1 345 . 4 1 1 A 30 30 LEU CA C 30 55.193 53.943 1.250 1
1 346 . 4 1 1 A 30 30 LEU CB C 30 42.869 44.384 -1.515 1
1 349 . 4 1 1 A 30 30 LEU N N 30 125.860 125.802 0.058 1
1 350 . 4 1 1 A 31 31 LYS H H 31 8.118 8.988 -0.870 1
1 351 . 4 1 1 A 31 31 LYS HA H 31 4.498 4.893 -0.395 1
1 360 . 4 1 1 A 31 31 LYS C C 31 173.555 175.286 -1.731 1
1 361 . 4 1 1 A 31 31 LYS CA C 31 54.372 55.186 -0.814 1
1 362 . 4 1 1 A 31 31 LYS CB C 31 32.814 33.421 -0.607 1
1 365 . 4 1 1 A 31 31 LYS N N 31 129.965 126.645 3.320 1
1 366 . 4 1 1 A 32 32 ILE H H 32 8.717 8.388 0.329 1
1 367 . 4 1 1 A 32 32 ILE HA H 32 4.011 4.377 -0.366 1
1 377 . 4 1 1 A 32 32 ILE C C 32 173.038 175.309 -2.271 1
1 378 . 4 1 1 A 32 32 ILE CA C 32 59.921 59.312 0.609 1
1 379 . 4 1 1 A 32 32 ILE CB C 32 38.139 37.921 0.218 1
1 382 . 4 1 1 A 32 32 ILE N N 32 127.091 123.228 3.863 1
1 383 . 4 1 1 A 33 33 PRO HA H 33 4.412 4.506 -0.094 1
1 390 . 4 1 1 A 33 33 PRO C C 33 172.724 175.662 -2.938 1
1 391 . 4 1 1 A 33 33 PRO CA C 33 62.565 62.211 0.354 1
1 392 . 4 1 1 A 33 33 PRO CB C 33 32.728 32.601 0.127 1
1 394 . 4 1 1 A 34 34 ASN H H 34 8.265 8.475 -0.210 1
1 395 . 4 1 1 A 34 34 ASN HA H 34 5.147 5.496 -0.349 1
1 400 . 4 1 1 A 34 34 ASN C C 34 174.079 173.448 0.631 1
1 401 . 4 1 1 A 34 34 ASN CA C 34 52.088 51.612 0.476 1
1 402 . 4 1 1 A 34 34 ASN CB C 34 40.387 43.132 -2.745 1
1 403 . 4 1 1 A 34 34 ASN N N 34 116.424 115.041 1.383 1
1 405 . 4 1 1 A 35 35 VAL H H 35 8.904 8.890 0.014 1
1 406 . 4 1 1 A 35 35 VAL HA H 35 4.159 4.412 -0.253 1
1 414 . 4 1 1 A 35 35 VAL C C 35 173.834 174.529 -0.695 1
1 415 . 4 1 1 A 35 35 VAL CA C 35 61.953 59.934 2.019 1
1 416 . 4 1 1 A 35 35 VAL CB C 35 34.432 34.719 -0.287 1
1 419 . 4 1 1 A 35 35 VAL N N 35 122.778 118.509 4.269 1
1 420 . 4 1 1 A 36 36 GLU H H 36 9.560 9.386 0.174 1
1 421 . 4 1 1 A 36 36 GLU HA H 36 3.819 3.970 -0.151 1
1 426 . 4 1 1 A 36 36 GLU C C 36 173.604 176.318 -2.714 1
1 427 . 4 1 1 A 36 36 GLU CA C 36 57.131 57.968 -0.837 1
1 428 . 4 1 1 A 36 36 GLU CB C 36 27.464 27.939 -0.475 1
1 430 . 4 1 1 A 36 36 GLU N N 36 127.014 128.520 -1.506 1
1 431 . 4 1 1 A 37 37 ARG H H 37 8.578 8.621 -0.043 1
1 432 . 4 1 1 A 37 37 ARG HA H 37 3.792 4.008 -0.216 1
1 439 . 4 1 1 A 37 37 ARG C C 37 173.371 175.204 -1.833 1
1 440 . 4 1 1 A 37 37 ARG CA C 37 57.952 57.389 0.563 1
1 441 . 4 1 1 A 37 37 ARG CB C 37 27.657 27.973 -0.316 1
1 443 . 4 1 1 A 37 37 ARG N N 37 108.362 117.437 -9.075 1
1 444 . 4 1 1 A 38 38 ARG H H 38 7.696 7.782 -0.086 1
1 445 . 4 1 1 A 38 38 ARG HA H 38 4.743 4.923 -0.180 1
1 452 . 4 1 1 A 38 38 ARG C C 38 173.513 175.416 -1.903 1
1 453 . 4 1 1 A 38 38 ARG CA C 38 54.507 54.604 -0.097 1
1 454 . 4 1 1 A 38 38 ARG CB C 38 33.751 33.428 0.323 1
1 456 . 4 1 1 A 38 38 ARG N N 38 118.370 121.199 -2.829 1
1 457 . 4 1 1 A 39 39 ILE H H 39 8.463 8.448 0.015 1
1 458 . 4 1 1 A 39 39 ILE HA H 39 4.184 4.251 -0.067 1
1 468 . 4 1 1 A 39 39 ILE C C 39 175.150 175.770 -0.620 1
1 469 . 4 1 1 A 39 39 ILE CA C 39 62.076 62.283 -0.207 1
1 470 . 4 1 1 A 39 39 ILE CB C 39 38.864 39.258 -0.394 1
1 473 . 4 1 1 A 39 39 ILE N N 39 123.604 126.190 -2.586 1
1 474 . 4 1 1 A 40 40 LEU H H 40 8.239 8.091 0.148 1
1 475 . 4 1 1 A 40 40 LEU HA H 40 4.259 4.615 -0.356 1
1 485 . 4 1 1 A 40 40 LEU C C 40 173.152 175.618 -2.466 1
1 486 . 4 1 1 A 40 40 LEU CA C 40 55.305 55.595 -0.290 1
1 487 . 4 1 1 A 40 40 LEU CB C 40 43.113 42.306 0.807 1
1 490 . 4 1 1 A 40 40 LEU N N 40 129.550 129.062 0.488 1
1 491 . 4 1 1 A 41 41 ASP H H 41 8.992 8.904 0.088 1
1 492 . 4 1 1 A 41 41 ASP HA H 41 4.798 4.775 0.023 1
1 495 . 4 1 1 A 41 41 ASP C C 41 173.837 176.174 -2.337 1
1 496 . 4 1 1 A 41 41 ASP CA C 41 52.077 54.122 -2.045 1
1 497 . 4 1 1 A 41 41 ASP CB C 41 39.454 39.309 0.145 1
1 498 . 4 1 1 A 41 41 ASP N N 41 127.022 127.268 -0.246 1
1 499 . 4 1 1 A 42 42 LEU H H 42 7.912 8.301 -0.389 1
1 500 . 4 1 1 A 42 42 LEU HA H 42 3.970 4.108 -0.138 1
1 510 . 4 1 1 A 42 42 LEU C C 42 176.305 177.617 -1.312 1
1 511 . 4 1 1 A 42 42 LEU CA C 42 58.128 57.961 0.167 1
1 512 . 4 1 1 A 42 42 LEU CB C 42 43.043 41.550 1.493 1
1 514 . 4 1 1 A 42 42 LEU N N 42 125.064 126.122 -1.058 1
1 515 . 4 1 1 A 43 43 TYR H H 43 8.565 8.315 0.250 1
1 516 . 4 1 1 A 43 43 TYR HA H 43 3.728 3.779 -0.051 1
1 523 . 4 1 1 A 43 43 TYR C C 43 175.757 176.916 -1.159 1
1 524 . 4 1 1 A 43 43 TYR CA C 43 61.774 61.890 -0.116 1
1 525 . 4 1 1 A 43 43 TYR CB C 43 38.235 38.545 -0.310 1
1 528 . 4 1 1 A 43 43 TYR N N 43 117.822 120.174 -2.352 1
1 529 . 4 1 1 A 44 44 SER H H 44 8.115 8.236 -0.121 1
1 530 . 4 1 1 A 44 44 SER HA H 44 3.854 4.146 -0.292 1
1 533 . 4 1 1 A 44 44 SER C C 44 174.080 177.273 -3.193 1
1 534 . 4 1 1 A 44 44 SER CA C 44 61.873 61.528 0.345 1
1 535 . 4 1 1 A 44 44 SER CB C 44 64.350 62.910 1.440 1
1 536 . 4 1 1 A 44 44 SER N N 44 116.835 113.919 2.916 1
1 537 . 4 1 1 A 45 45 LEU H H 45 8.401 8.277 0.124 1
1 538 . 4 1 1 A 45 45 LEU HA H 45 4.102 4.215 -0.113 1
1 548 . 4 1 1 A 45 45 LEU C C 45 175.081 179.071 -3.990 1
1 549 . 4 1 1 A 45 45 LEU CA C 45 58.896 57.904 0.992 1
1 550 . 4 1 1 A 45 45 LEU CB C 45 41.741 41.488 0.253 1
1 553 . 4 1 1 A 45 45 LEU N N 45 120.621 122.829 -2.208 1
1 554 . 4 1 1 A 46 46 SER H H 46 8.110 8.281 -0.171 1
1 555 . 4 1 1 A 46 46 SER HA H 46 4.300 4.227 0.073 1
1 558 . 4 1 1 A 46 46 SER C C 46 175.019 176.833 -1.814 1
1 559 . 4 1 1 A 46 46 SER CA C 46 62.610 62.050 0.560 1
1 560 . 4 1 1 A 46 46 SER CB C 46 64.092 62.936 1.156 1
1 561 . 4 1 1 A 46 46 SER N N 46 112.826 116.426 -3.600 1
1 562 . 4 1 1 A 47 47 LYS H H 47 7.732 8.120 -0.388 1
1 563 . 4 1 1 A 47 47 LYS HA H 47 3.900 4.145 -0.245 1
1 572 . 4 1 1 A 47 47 LYS C C 47 177.441 178.837 -1.396 1
1 573 . 4 1 1 A 47 47 LYS CA C 47 58.575 59.258 -0.683 1
1 574 . 4 1 1 A 47 47 LYS CB C 47 32.351 31.638 0.713 1
1 576 . 4 1 1 A 47 47 LYS N N 47 121.210 119.359 1.851 1
1 577 . 4 1 1 A 48 48 ILE H H 48 8.672 8.286 0.386 1
1 578 . 4 1 1 A 48 48 ILE HA H 48 3.628 3.745 -0.117 1
1 588 . 4 1 1 A 48 48 ILE C C 48 175.861 178.137 -2.276 1
1 589 . 4 1 1 A 48 48 ILE CA C 48 64.188 65.145 -0.957 1
1 590 . 4 1 1 A 48 48 ILE CB C 48 37.954 37.934 0.020 1
1 593 . 4 1 1 A 48 48 ILE N N 48 120.810 121.295 -0.485 1
1 594 . 4 1 1 A 49 49 VAL H H 49 8.030 8.355 -0.325 1
1 595 . 4 1 1 A 49 49 VAL HA H 49 3.195 3.662 -0.467 1
1 603 . 4 1 1 A 49 49 VAL C C 49 176.513 178.476 -1.963 1
1 604 . 4 1 1 A 49 49 VAL CA C 49 66.760 67.061 -0.301 1
1 605 . 4 1 1 A 49 49 VAL CB C 49 30.935 31.696 -0.761 1
1 608 . 4 1 1 A 49 49 VAL N N 49 119.350 119.643 -0.293 1
1 609 . 4 1 1 A 50 50 VAL H H 50 7.336 8.284 -0.948 1
1 610 . 4 1 1 A 50 50 VAL HA H 50 3.497 3.604 -0.107 1
1 618 . 4 1 1 A 50 50 VAL C C 50 178.745 178.444 0.301 1
1 619 . 4 1 1 A 50 50 VAL CA C 50 67.384 66.537 0.847 1
1 620 . 4 1 1 A 50 50 VAL CB C 50 31.832 31.572 0.260 1
1 621 . 4 1 1 A 50 50 VAL N N 50 118.610 120.843 -2.233 1
1 622 . 4 1 1 A 51 51 GLU H H 51 8.318 8.367 -0.049 1
1 623 . 4 1 1 A 51 51 GLU HA H 51 3.953 3.988 -0.035 1
1 628 . 4 1 1 A 51 51 GLU C C 51 177.281 178.729 -1.448 1
1 629 . 4 1 1 A 51 51 GLU CA C 51 59.668 59.443 0.225 1
1 630 . 4 1 1 A 51 51 GLU CB C 51 30.131 29.255 0.876 1
1 632 . 4 1 1 A 51 51 GLU N N 51 122.096 120.086 2.010 1
1 633 . 4 1 1 A 52 52 GLU H H 52 8.065 8.310 -0.245 1
1 634 . 4 1 1 A 52 52 GLU HA H 52 4.229 4.241 -0.012 1
1 639 . 4 1 1 A 52 52 GLU C C 52 173.534 176.598 -3.064 1
1 640 . 4 1 1 A 52 52 GLU CA C 52 55.547 56.501 -0.954 1
1 641 . 4 1 1 A 52 52 GLU CB C 52 28.716 30.074 -1.358 1
1 643 . 4 1 1 A 52 52 GLU N N 52 114.992 115.821 -0.829 1
1 644 . 4 1 1 A 53 53 GLY H H 53 7.459 9.115 -1.656 1
1 645 . 4 1 1 A 53 53 GLY HA2 H 53 3.630 3.953 -0.323 1
1 646 . 4 1 1 A 53 53 GLY HA3 H 53 3.630 3.971 -0.341 1
1 647 . 4 1 1 A 53 53 GLY C C 53 173.214 173.720 -0.506 1
1 648 . 4 1 1 A 53 53 GLY CA C 53 44.962 45.114 -0.152 1
1 649 . 4 1 1 A 53 53 GLY N N 53 104.909 108.018 -3.109 1
1 650 . 4 1 1 A 54 54 GLY H H 54 8.533 7.654 0.879 1
1 651 . 4 1 1 A 54 54 GLY HA2 H 54 3.548 4.052 -0.504 1
1 652 . 4 1 1 A 54 54 GLY HA3 H 54 4.521 4.101 0.420 1
1 653 . 4 1 1 A 54 54 GLY C C 54 169.966 174.517 -4.551 1
1 654 . 4 1 1 A 54 54 GLY CA C 54 43.988 45.745 -1.757 1
1 655 . 4 1 1 A 54 54 GLY N N 54 110.587 108.387 2.200 1
1 656 . 4 1 1 A 55 55 TYR H H 55 8.704 9.191 -0.487 1
1 657 . 4 1 1 A 55 55 TYR HA H 55 3.618 3.933 -0.315 1
1 664 . 4 1 1 A 55 55 TYR C C 55 174.807 177.320 -2.513 1
1 665 . 4 1 1 A 55 55 TYR CA C 55 62.540 61.523 1.017 1
1 666 . 4 1 1 A 55 55 TYR CB C 55 39.669 39.318 0.351 1
1 669 . 4 1 1 A 55 55 TYR N N 55 119.168 123.555 -4.387 1
1 670 . 4 1 1 A 56 56 GLU H H 56 9.006 8.344 0.662 1
1 671 . 4 1 1 A 56 56 GLU HA H 56 3.638 3.481 0.157 1
1 676 . 4 1 1 A 56 56 GLU C C 56 177.400 178.034 -0.634 1
1 677 . 4 1 1 A 56 56 GLU CA C 56 60.530 59.578 0.952 1
1 678 . 4 1 1 A 56 56 GLU CB C 56 29.168 29.367 -0.199 1
1 679 . 4 1 1 A 56 56 GLU N N 56 118.969 119.391 -0.422 1
1 680 . 4 1 1 A 57 57 ALA H H 57 8.235 7.743 0.492 1
1 681 . 4 1 1 A 57 57 ALA HA H 57 3.980 3.995 -0.015 1
1 685 . 4 1 1 A 57 57 ALA C C 57 177.678 179.564 -1.886 1
1 686 . 4 1 1 A 57 57 ALA CA C 57 54.910 55.196 -0.286 1
1 687 . 4 1 1 A 57 57 ALA CB C 57 18.122 18.187 -0.065 1
1 688 . 4 1 1 A 57 57 ALA N N 57 122.860 121.554 1.306 1
1 689 . 4 1 1 A 58 58 ILE H H 58 7.831 7.564 0.267 1
1 690 . 4 1 1 A 58 58 ILE HA H 58 3.189 3.316 -0.127 1
1 700 . 4 1 1 A 58 58 ILE C C 58 177.818 177.696 0.122 1
1 701 . 4 1 1 A 58 58 ILE CA C 58 65.074 64.187 0.887 1
1 702 . 4 1 1 A 58 58 ILE CB C 58 38.178 36.441 1.737 1
1 706 . 4 1 1 A 58 58 ILE N N 58 117.418 117.706 -0.288 1
1 707 . 4 1 1 A 59 59 CYS H H 59 7.760 7.890 -0.130 1
1 708 . 4 1 1 A 59 59 CYS HA H 59 4.203 4.282 -0.079 1
1 711 . 4 1 1 A 59 59 CYS C C 59 176.357 177.079 -0.722 1
1 712 . 4 1 1 A 59 59 CYS CA C 59 63.760 62.458 1.302 1
1 713 . 4 1 1 A 59 59 CYS CB C 59 27.638 26.866 0.772 1
1 714 . 4 1 1 A 59 59 CYS N N 59 115.302 120.420 -5.118 1
1 715 . 4 1 1 A 60 60 LYS H H 60 8.350 8.183 0.167 1
1 716 . 4 1 1 A 60 60 LYS HA H 60 3.972 4.002 -0.030 1
1 725 . 4 1 1 A 60 60 LYS C C 60 176.373 178.299 -1.926 1
1 726 . 4 1 1 A 60 60 LYS CA C 60 59.796 59.413 0.383 1
1 727 . 4 1 1 A 60 60 LYS CB C 60 32.560 32.050 0.510 1
1 729 . 4 1 1 A 60 60 LYS N N 60 122.343 120.038 2.305 1
1 730 . 4 1 1 A 61 61 ASP H H 61 8.157 7.917 0.240 1
1 731 . 4 1 1 A 61 61 ASP HA H 61 4.616 4.581 0.035 1
1 734 . 4 1 1 A 61 61 ASP C C 61 173.246 175.561 -2.315 1
1 735 . 4 1 1 A 61 61 ASP CA C 61 54.272 53.955 0.317 1
1 736 . 4 1 1 A 61 61 ASP CB C 61 41.023 40.943 0.080 1
1 737 . 4 1 1 A 61 61 ASP N N 61 116.173 116.880 -0.707 1
1 738 . 4 1 1 A 62 62 ARG H H 62 7.655 7.638 0.017 1
1 739 . 4 1 1 A 62 62 ARG HA H 62 4.149 4.011 0.138 1
1 746 . 4 1 1 A 62 62 ARG C C 62 175.891 176.550 -0.659 1
1 747 . 4 1 1 A 62 62 ARG CA C 62 57.381 57.118 0.263 1
1 748 . 4 1 1 A 62 62 ARG CB C 62 26.538 29.221 -2.683 1
1 750 . 4 1 1 A 62 62 ARG N N 62 117.213 118.081 -0.868 1
1 751 . 4 1 1 A 63 63 ARG H H 63 8.302 7.745 0.557 1
1 752 . 4 1 1 A 63 63 ARG HA H 63 4.240 4.033 0.207 1
1 757 . 4 1 1 A 63 63 ARG C C 63 175.775 178.390 -2.615 1
1 758 . 4 1 1 A 63 63 ARG CA C 63 55.718 58.238 -2.520 1
1 760 . 4 1 1 A 63 63 ARG N N 63 116.292 119.131 -2.839 1
1 761 . 4 1 1 A 64 64 TRP H H 64 8.161 7.538 0.623 1
1 762 . 4 1 1 A 64 64 TRP HA H 64 3.836 4.437 -0.601 1
1 771 . 4 1 1 A 64 64 TRP C C 64 176.862 178.584 -1.722 1
1 772 . 4 1 1 A 64 64 TRP CA C 64 62.036 59.832 2.204 1
1 773 . 4 1 1 A 64 64 TRP CB C 64 27.028 29.183 -2.155 1
1 779 . 4 1 1 A 64 64 TRP N N 64 121.486 120.027 1.459 1
1 781 . 4 1 1 A 65 65 ALA H H 65 8.954 7.897 1.057 1
1 782 . 4 1 1 A 65 65 ALA HA H 65 4.290 4.137 0.153 1
1 786 . 4 1 1 A 65 65 ALA C C 65 178.986 179.444 -0.458 1
1 787 . 4 1 1 A 65 65 ALA CA C 65 55.314 55.409 -0.095 1
1 788 . 4 1 1 A 65 65 ALA CB C 65 18.119 18.175 -0.056 1
1 789 . 4 1 1 A 65 65 ALA N N 65 121.559 122.633 -1.074 1
1 790 . 4 1 1 A 66 66 ARG H H 66 7.473 7.822 -0.349 1
1 791 . 4 1 1 A 66 66 ARG HA H 66 4.221 4.100 0.121 1
1 798 . 4 1 1 A 66 66 ARG C C 66 176.670 178.566 -1.896 1
1 799 . 4 1 1 A 66 66 ARG CA C 66 57.871 58.958 -1.087 1
1 800 . 4 1 1 A 66 66 ARG CB C 66 29.097 29.809 -0.712 1
1 801 . 4 1 1 A 66 66 ARG N N 66 119.915 117.283 2.632 1
1 802 . 4 1 1 A 67 67 VAL H H 67 7.134 7.564 -0.430 1
1 803 . 4 1 1 A 67 67 VAL HA H 67 3.304 3.629 -0.325 1
1 811 . 4 1 1 A 67 67 VAL C C 67 175.341 177.885 -2.544 1
1 812 . 4 1 1 A 67 67 VAL CA C 67 66.722 66.750 -0.028 1
1 813 . 4 1 1 A 67 67 VAL CB C 67 31.108 31.845 -0.737 1
1 816 . 4 1 1 A 67 67 VAL N N 67 119.970 120.873 -0.903 1
1 817 . 4 1 1 A 68 68 ALA H H 68 7.745 8.669 -0.924 1
1 818 . 4 1 1 A 68 68 ALA HA H 68 4.076 4.093 -0.017 1
1 822 . 4 1 1 A 68 68 ALA C C 68 177.358 179.386 -2.028 1
1 823 . 4 1 1 A 68 68 ALA CA C 68 55.607 55.971 -0.364 1
1 824 . 4 1 1 A 68 68 ALA CB C 68 18.061 18.754 -0.693 1
1 825 . 4 1 1 A 68 68 ALA N N 68 118.239 121.954 -3.715 1
1 826 . 4 1 1 A 69 69 GLN H H 69 7.979 8.008 -0.029 1
1 827 . 4 1 1 A 69 69 GLN HA H 69 4.310 3.976 0.334 1
1 834 . 4 1 1 A 69 69 GLN C C 69 179.370 178.401 0.969 1
1 835 . 4 1 1 A 69 69 GLN CA C 69 59.307 59.192 0.115 1
1 836 . 4 1 1 A 69 69 GLN CB C 69 29.257 28.406 0.851 1
1 838 . 4 1 1 A 69 69 GLN N N 69 118.484 117.892 0.592 1
1 840 . 4 1 1 A 70 70 ARG H H 70 8.374 8.037 0.337 1
1 841 . 4 1 1 A 70 70 ARG HA H 70 4.148 4.077 0.071 1
1 848 . 4 1 1 A 70 70 ARG C C 70 175.850 177.733 -1.883 1
1 849 . 4 1 1 A 70 70 ARG CA C 70 58.957 58.623 0.334 1
1 850 . 4 1 1 A 70 70 ARG CB C 70 29.799 29.986 -0.187 1
1 852 . 4 1 1 A 70 70 ARG N N 70 120.309 120.710 -0.401 1
1 853 . 4 1 1 A 71 71 LEU H H 71 7.413 7.576 -0.163 1
1 854 . 4 1 1 A 71 71 LEU HA H 71 4.341 4.140 0.201 1
1 864 . 4 1 1 A 71 71 LEU C C 71 173.391 176.308 -2.917 1
1 865 . 4 1 1 A 71 71 LEU CA C 71 54.911 54.501 0.410 1
1 866 . 4 1 1 A 71 71 LEU CB C 71 42.693 41.532 1.161 1
1 867 . 4 1 1 A 71 71 LEU N N 71 118.841 117.620 1.221 1
1 868 . 4 1 1 A 72 72 ASN H H 72 8.038 7.863 0.175 1
1 869 . 4 1 1 A 72 72 ASN HA H 72 4.394 4.479 -0.085 1
1 874 . 4 1 1 A 72 72 ASN C C 72 173.042 174.359 -1.317 1
1 875 . 4 1 1 A 72 72 ASN CB C 72 36.412 36.429 -0.017 1
1 876 . 4 1 1 A 72 72 ASN N N 72 112.919 116.433 -3.514 1
1 878 . 4 1 1 A 73 73 TYR H H 73 7.874 7.340 0.534 1
1 879 . 4 1 1 A 73 73 TYR HA H 73 4.868 4.544 0.324 1
1 886 . 4 1 1 A 73 73 TYR C C 73 172.194 174.138 -1.944 1
1 887 . 4 1 1 A 73 73 TYR CA C 73 57.105 56.765 0.340 1
1 888 . 4 1 1 A 73 73 TYR CB C 73 37.918 38.351 -0.433 1
1 889 . 4 1 1 A 73 73 TYR N N 73 117.432 119.968 -2.536 1
1 897 . 4 1 1 A 75 75 PRO HA H 75 4.626 4.251 0.375 1
1 902 . 4 1 1 A 75 75 PRO C C 75 175.728 177.263 -1.535 1
1 903 . 4 1 1 A 75 75 PRO CA C 75 62.502 63.734 -1.232 1
1 904 . 4 1 1 A 75 75 PRO CB C 75 32.339 32.126 0.213 1
1 905 . 4 1 1 A 76 76 GLY H H 76 8.369 8.880 -0.511 1
1 906 . 4 1 1 A 76 76 GLY HA2 H 76 4.057 3.915 0.142 1
1 907 . 4 1 1 A 76 76 GLY HA3 H 76 4.556 3.917 0.639 1
1 908 . 4 1 1 A 76 76 GLY C C 76 173.248 175.068 -1.820 1
1 909 . 4 1 1 A 76 76 GLY CA C 76 46.180 45.407 0.773 1
1 910 . 4 1 1 A 76 76 GLY N N 76 106.185 111.051 -4.866 1
1 911 . 4 1 1 A 77 77 LYS H H 77 8.632 8.227 0.405 1
1 912 . 4 1 1 A 77 77 LYS HA H 77 4.433 4.001 0.432 1
1 921 . 4 1 1 A 77 77 LYS C C 77 174.924 176.935 -2.011 1
1 922 . 4 1 1 A 77 77 LYS CA C 77 56.453 57.891 -1.438 1
1 923 . 4 1 1 A 77 77 LYS CB C 77 33.170 29.724 3.446 1
1 925 . 4 1 1 A 77 77 LYS N N 77 119.592 115.013 4.579 1
1 926 . 4 1 1 A 78 78 ASN H H 78 8.865 8.307 0.558 1
1 927 . 4 1 1 A 78 78 ASN HA H 78 4.654 4.478 0.176 1
1 932 . 4 1 1 A 78 78 ASN C C 78 174.869 176.745 -1.876 1
1 933 . 4 1 1 A 78 78 ASN CA C 78 54.117 55.611 -1.494 1
1 934 . 4 1 1 A 78 78 ASN CB C 78 37.841 37.072 0.769 1
1 935 . 4 1 1 A 78 78 ASN N N 78 116.880 116.648 0.232 1
1 937 . 4 1 1 A 79 79 ILE H H 79 8.008 8.241 -0.233 1
1 938 . 4 1 1 A 79 79 ILE HA H 79 3.718 3.769 -0.051 1
1 948 . 4 1 1 A 79 79 ILE C C 79 175.921 178.351 -2.430 1
1 949 . 4 1 1 A 79 79 ILE CA C 79 63.618 64.758 -1.140 1
1 950 . 4 1 1 A 79 79 ILE CB C 79 37.158 37.217 -0.059 1
1 952 . 4 1 1 A 79 79 ILE N N 79 119.688 120.283 -0.595 1
1 953 . 4 1 1 A 80 80 GLY H H 80 9.062 8.183 0.879 1
1 954 . 4 1 1 A 80 80 GLY HA2 H 80 3.739 3.856 -0.117 1
1 955 . 4 1 1 A 80 80 GLY HA3 H 80 3.739 3.882 -0.143 1
1 956 . 4 1 1 A 80 80 GLY C C 80 173.185 176.410 -3.225 1
1 957 . 4 1 1 A 80 80 GLY CA C 80 48.166 47.660 0.506 1
1 958 . 4 1 1 A 80 80 GLY N N 80 110.338 109.111 1.227 1
1 959 . 4 1 1 A 81 81 SER H H 81 7.460 7.735 -0.275 1
1 960 . 4 1 1 A 81 81 SER HA H 81 3.904 4.151 -0.247 1
1 963 . 4 1 1 A 81 81 SER C C 81 174.999 175.840 -0.841 1
1 964 . 4 1 1 A 81 81 SER CA C 81 61.138 62.520 -1.382 1
1 965 . 4 1 1 A 81 81 SER CB C 81 62.740 62.909 -0.169 1
1 966 . 4 1 1 A 81 81 SER N N 81 115.348 119.650 -4.302 1
1 967 . 4 1 1 A 82 82 LEU H H 82 7.367 7.932 -0.565 1
1 968 . 4 1 1 A 82 82 LEU HA H 82 3.946 3.893 0.053 1
1 977 . 4 1 1 A 82 82 LEU C C 82 176.969 178.067 -1.098 1
1 978 . 4 1 1 A 82 82 LEU CA C 82 57.504 57.949 -0.445 1
1 979 . 4 1 1 A 82 82 LEU CB C 82 42.185 41.330 0.855 1
1 980 . 4 1 1 A 82 82 LEU N N 82 124.267 122.530 1.737 1
1 981 . 4 1 1 A 83 83 LEU H H 83 8.330 8.329 0.001 1
1 982 . 4 1 1 A 83 83 LEU HA H 83 3.924 3.958 -0.034 1
1 991 . 4 1 1 A 83 83 LEU C C 83 176.303 178.163 -1.860 1
1 992 . 4 1 1 A 83 83 LEU CA C 83 58.067 58.306 -0.239 1
1 993 . 4 1 1 A 83 83 LEU CB C 83 41.061 41.626 -0.565 1
1 994 . 4 1 1 A 83 83 LEU N N 83 117.452 119.883 -2.431 1
1 995 . 4 1 1 A 84 84 ARG H H 84 7.651 8.064 -0.413 1
1 996 . 4 1 1 A 84 84 ARG HA H 84 2.230 3.413 -1.183 1
1 1003 . 4 1 1 A 84 84 ARG C C 84 175.902 178.176 -2.274 1
1 1004 . 4 1 1 A 84 84 ARG CA C 84 59.112 59.322 -0.210 1
1 1005 . 4 1 1 A 84 84 ARG CB C 84 28.579 29.651 -1.072 1
1 1007 . 4 1 1 A 84 84 ARG N N 84 119.586 119.514 0.072 1
1 1008 . 4 1 1 A 85 85 SER H H 85 7.291 8.254 -0.963 1
1 1009 . 4 1 1 A 85 85 SER HA H 85 4.189 4.151 0.038 1
1 1012 . 4 1 1 A 85 85 SER C C 85 175.546 177.360 -1.814 1
1 1013 . 4 1 1 A 85 85 SER CA C 85 61.376 61.088 0.288 1
1 1014 . 4 1 1 A 85 85 SER CB C 85 62.805 62.081 0.724 1
1 1015 . 4 1 1 A 85 85 SER N N 85 112.921 115.279 -2.358 1
1 1016 . 4 1 1 A 86 86 HIS H H 86 8.156 7.765 0.391 1
1 1017 . 4 1 1 A 86 86 HIS HA H 86 4.782 4.177 0.605 1
1 1022 . 4 1 1 A 86 86 HIS C C 86 176.851 177.429 -0.578 1
1 1023 . 4 1 1 A 86 86 HIS CA C 86 58.898 59.552 -0.654 1
1 1024 . 4 1 1 A 86 86 HIS CB C 86 31.110 29.586 1.524 1
1 1027 . 4 1 1 A 86 86 HIS N N 86 119.258 118.596 0.662 1
1 1028 . 4 1 1 A 87 87 TYR H H 87 9.180 8.225 0.955 1
1 1029 . 4 1 1 A 87 87 TYR HA H 87 3.913 3.911 0.002 1
1 1036 . 4 1 1 A 87 87 TYR C C 87 176.841 177.249 -0.408 1
1 1037 . 4 1 1 A 87 87 TYR CA C 87 63.526 61.365 2.161 1
1 1038 . 4 1 1 A 87 87 TYR CB C 87 39.431 38.430 1.001 1
1 1041 . 4 1 1 A 87 87 TYR N N 87 120.625 119.994 0.631 1
1 1042 . 4 1 1 A 88 88 GLU H H 88 9.028 8.463 0.565 1
1 1043 . 4 1 1 A 88 88 GLU HA H 88 3.682 3.838 -0.156 1
1 1048 . 4 1 1 A 88 88 GLU C C 88 175.833 179.383 -3.550 1
1 1049 . 4 1 1 A 88 88 GLU CA C 88 59.730 60.101 -0.371 1
1 1050 . 4 1 1 A 88 88 GLU CB C 88 30.009 28.942 1.067 1
1 1052 . 4 1 1 A 88 88 GLU N N 88 119.531 119.733 -0.202 1
1 1053 . 4 1 1 A 89 89 ARG H H 89 8.052 7.551 0.501 1
1 1054 . 4 1 1 A 89 89 ARG HA H 89 4.292 4.158 0.134 1
1 1061 . 4 1 1 A 89 89 ARG C C 89 176.045 178.319 -2.274 1
1 1062 . 4 1 1 A 89 89 ARG CA C 89 58.538 59.264 -0.726 1
1 1063 . 4 1 1 A 89 89 ARG CB C 89 31.841 30.663 1.178 1
1 1065 . 4 1 1 A 89 89 ARG N N 89 114.741 119.229 -4.488 1
1 1066 . 4 1 1 A 90 90 ILE H H 90 8.141 7.828 0.313 1
1 1067 . 4 1 1 A 90 90 ILE HA H 90 4.296 3.666 0.630 1
1 1075 . 4 1 1 A 90 90 ILE C C 90 174.461 177.083 -2.622 1
1 1076 . 4 1 1 A 90 90 ILE CA C 90 63.649 63.149 0.500 1
1 1077 . 4 1 1 A 90 90 ILE CB C 90 40.626 38.650 1.976 1
1 1079 . 4 1 1 A 90 90 ILE N N 90 113.421 118.346 -4.925 1
1 1080 . 4 1 1 A 91 91 VAL H H 91 7.350 7.735 -0.385 1
1 1081 . 4 1 1 A 91 91 VAL HA H 91 4.144 3.871 0.273 1
1 1089 . 4 1 1 A 91 91 VAL C C 91 175.422 176.590 -1.168 1
1 1090 . 4 1 1 A 91 91 VAL CA C 91 65.042 63.019 2.023 1
1 1091 . 4 1 1 A 91 91 VAL CB C 91 33.215 31.392 1.823 1
1 1092 . 4 1 1 A 91 91 VAL N N 91 118.215 120.920 -2.705 1
1 1093 . 4 1 1 A 92 92 TYR H H 92 8.565 7.938 0.627 1
1 1094 . 4 1 1 A 92 92 TYR HA H 92 4.217 4.204 0.013 1
1 1099 . 4 1 1 A 92 92 TYR C C 92 171.495 175.108 -3.613 1
1 1100 . 4 1 1 A 92 92 TYR CA C 92 61.558 62.333 -0.775 1
1 1101 . 4 1 1 A 92 92 TYR CB C 92 36.757 37.313 -0.556 1
1 1102 . 4 1 1 A 92 92 TYR N N 92 121.370 122.602 -1.232 1
1 1103 . 4 1 1 A 93 93 PRO HA H 93 4.136 4.365 -0.229 1
1 1108 . 4 1 1 A 93 93 PRO C C 93 177.077 178.511 -1.434 1
1 1109 . 4 1 1 A 93 93 PRO CA C 93 66.037 65.956 0.081 1
1 1110 . 4 1 1 A 93 93 PRO CB C 93 31.482 30.843 0.639 1
1 1111 . 4 1 1 A 94 94 TYR H H 94 6.517 7.645 -1.128 1
1 1112 . 4 1 1 A 94 94 TYR HA H 94 2.798 4.397 -1.599 1
1 1119 . 4 1 1 A 94 94 TYR C C 94 174.985 178.093 -3.108 1
1 1120 . 4 1 1 A 94 94 TYR CA C 94 59.356 60.029 -0.673 1
1 1121 . 4 1 1 A 94 94 TYR CB C 94 37.987 37.185 0.802 1
1 1124 . 4 1 1 A 94 94 TYR N N 94 115.987 117.382 -1.395 1
1 1125 . 4 1 1 A 95 95 GLU H H 95 8.205 8.313 -0.108 1
1 1126 . 4 1 1 A 95 95 GLU HA H 95 3.682 4.176 -0.494 1
1 1131 . 4 1 1 A 95 95 GLU C C 95 178.530 178.766 -0.236 1
1 1132 . 4 1 1 A 95 95 GLU CA C 95 58.910 59.700 -0.790 1
1 1133 . 4 1 1 A 95 95 GLU CB C 95 29.187 29.492 -0.305 1
1 1134 . 4 1 1 A 95 95 GLU N N 95 119.946 121.204 -1.258 1
1 1135 . 4 1 1 A 96 96 MET H H 96 8.248 7.979 0.269 1
1 1136 . 4 1 1 A 96 96 MET HA H 96 4.172 4.163 0.009 1
1 1142 . 4 1 1 A 96 96 MET C C 96 176.874 178.129 -1.255 1
1 1143 . 4 1 1 A 96 96 MET CA C 96 57.159 58.890 -1.731 1
1 1144 . 4 1 1 A 96 96 MET CB C 96 31.829 32.636 -0.807 1
1 1146 . 4 1 1 A 96 96 MET N N 96 117.570 119.554 -1.984 1
1 1147 . 4 1 1 A 97 97 TYR H H 97 7.445 8.504 -1.059 1
1 1148 . 4 1 1 A 97 97 TYR HA H 97 4.248 4.004 0.244 1
1 1155 . 4 1 1 A 97 97 TYR C C 97 176.476 176.903 -0.427 1
1 1156 . 4 1 1 A 97 97 TYR CA C 97 60.470 62.151 -1.681 1
1 1157 . 4 1 1 A 97 97 TYR CB C 97 38.612 38.476 0.136 1
1 1160 . 4 1 1 A 97 97 TYR N N 97 122.246 121.666 0.580 1
1 1161 . 4 1 1 A 98 98 GLN H H 98 8.087 8.443 -0.356 1
1 1162 . 4 1 1 A 98 98 GLN HA H 98 3.793 3.498 0.295 1
1 1169 . 4 1 1 A 98 98 GLN C C 98 175.549 177.621 -2.072 1
1 1170 . 4 1 1 A 98 98 GLN CA C 98 57.365 58.685 -1.320 1
1 1171 . 4 1 1 A 98 98 GLN CB C 98 28.901 28.675 0.226 1
1 1173 . 4 1 1 A 98 98 GLN N N 98 118.769 119.699 -0.930 1
1 1175 . 4 1 1 A 99 99 SER H H 99 7.724 7.963 -0.239 1
1 1176 . 4 1 1 A 99 99 SER HA H 99 4.293 4.216 0.077 1
1 1179 . 4 1 1 A 99 99 SER C C 99 173.696 177.241 -3.545 1
1 1180 . 4 1 1 A 99 99 SER CA C 99 59.566 61.146 -1.580 1
1 1181 . 4 1 1 A 99 99 SER CB C 99 63.847 62.851 0.996 1
1 1182 . 4 1 1 A 99 99 SER N N 99 113.257 114.942 -1.685 1
1 1183 . 4 1 1 A 100 100 GLY H H 100 7.751 8.260 -0.509 1
1 1184 . 4 1 1 A 100 100 GLY HA2 H 100 3.813 3.876 -0.063 1
1 1185 . 4 1 1 A 100 100 GLY HA3 H 100 3.934 3.879 0.055 1
1 1186 . 4 1 1 A 100 100 GLY C C 100 172.643 176.392 -3.749 1
1 1187 . 4 1 1 A 100 100 GLY CA C 100 45.570 47.012 -1.442 1
1 1188 . 4 1 1 A 100 100 GLY N N 100 109.750 108.635 1.115 1
1 1189 . 4 1 1 A 101 101 ALA H H 101 7.824 7.824 0.000 1
1 1190 . 4 1 1 A 101 101 ALA HA H 101 4.221 3.963 0.258 1
1 1194 . 4 1 1 A 101 101 ALA C C 101 175.639 179.597 -3.958 1
1 1195 . 4 1 1 A 101 101 ALA CA C 101 52.745 54.483 -1.738 1
1 1196 . 4 1 1 A 101 101 ALA CB C 101 19.437 18.653 0.784 1
1 1197 . 4 1 1 A 101 101 ALA N N 101 123.241 124.690 -1.449 1
1 1198 . 4 1 1 A 102 102 ASN H H 102 8.191 7.928 0.263 1
1 1199 . 4 1 1 A 102 102 ASN HA H 102 4.658 4.717 -0.059 1
1 1204 . 4 1 1 A 102 102 ASN C C 102 173.337 175.769 -2.432 1
1 1205 . 4 1 1 A 102 102 ASN CA C 102 53.374 55.655 -2.281 1
1 1206 . 4 1 1 A 102 102 ASN CB C 102 38.819 39.249 -0.430 1
1 1207 . 4 1 1 A 102 102 ASN N N 102 116.572 114.217 2.355 1
1 1209 . 4 1 1 A 103 103 LEU H H 103 8.065 7.801 0.264 1
1 1210 . 4 1 1 A 103 103 LEU HA H 103 4.363 4.634 -0.271 1
1 1219 . 4 1 1 A 103 103 LEU C C 103 175.637 174.960 0.677 1
1 1220 . 4 1 1 A 103 103 LEU CA C 103 55.292 54.004 1.288 1
1 1221 . 4 1 1 A 103 103 LEU CB C 103 42.433 44.823 -2.390 1
1 1222 . 4 1 1 A 103 103 LEU N N 103 122.074 114.478 7.596 1
1 1223 . 4 1 1 A 104 104 VAL H H 104 8.055 8.757 -0.702 1
1 1224 . 4 1 1 A 104 104 VAL HA H 104 4.131 4.833 -0.702 1
1 1232 . 4 1 1 A 104 104 VAL C C 104 174.364 174.407 -0.043 1
1 1233 . 4 1 1 A 104 104 VAL CA C 104 62.552 60.456 2.096 1
1 1234 . 4 1 1 A 104 104 VAL CB C 104 32.766 35.280 -2.514 1
1 1235 . 4 1 1 A 104 104 VAL N N 104 120.606 119.268 1.338 1
1 1236 . 4 1 1 A 105 105 CYS H H 105 8.392 8.695 -0.303 1
1 1237 . 4 1 1 A 105 105 CYS HA H 105 4.535 4.860 -0.325 1
1 1240 . 4 1 1 A 105 105 CYS C C 105 172.593 175.627 -3.034 1
1 1241 . 4 1 1 A 105 105 CYS CA C 105 58.449 57.980 0.469 1
1 1242 . 4 1 1 A 105 105 CYS CB C 105 27.952 28.444 -0.492 1
1 1243 . 4 1 1 A 105 105 CYS N N 105 122.791 127.763 -4.972 1
1 1244 . 4 1 1 A 106 106 ASN H H 106 8.575 8.167 0.408 1
1 1245 . 4 1 1 A 106 106 ASN HA H 106 4.843 4.820 0.023 1
1 1250 . 4 1 1 A 106 106 ASN C C 106 173.594 177.409 -3.815 1
1 1251 . 4 1 1 A 106 106 ASN CA C 106 53.337 54.116 -0.779 1
1 1252 . 4 1 1 A 106 106 ASN CB C 106 39.088 39.031 0.057 1
1 1253 . 4 1 1 A 106 106 ASN N N 106 122.001 119.891 2.110 1
1 1255 . 4 1 1 A 107 107 THR H H 107 8.090 8.053 0.037 1
1 1256 . 4 1 1 A 107 107 THR HA H 107 4.348 4.098 0.250 1
1 1261 . 4 1 1 A 107 107 THR C C 107 172.516 177.467 -4.951 1
1 1262 . 4 1 1 A 107 107 THR CA C 107 61.803 65.742 -3.939 1
1 1263 . 4 1 1 A 107 107 THR CB C 107 69.812 68.247 1.565 1
1 1265 . 4 1 1 A 107 107 THR N N 107 114.374 113.312 1.062 1
1 1266 . 4 1 1 A 108 108 ARG H H 108 8.322 7.898 0.424 1
1 1267 . 4 1 1 A 108 108 ARG HA H 108 4.634 4.251 0.383 1
1 1274 . 4 1 1 A 108 108 ARG C C 108 172.608 176.276 -3.668 1
1 1275 . 4 1 1 A 108 108 ARG CA C 108 54.026 61.029 -7.003 1
1 1276 . 4 1 1 A 108 108 ARG CB C 108 30.246 29.894 0.352 1
1 1278 . 4 1 1 A 108 108 ARG N N 108 124.017 121.784 2.233 1
1 1279 . 4 1 1 A 109 109 PRO HA H 109 4.354 4.658 -0.304 1
1 1286 . 4 1 1 A 109 109 PRO C C 109 174.978 178.705 -3.727 1
1 1287 . 4 1 1 A 109 109 PRO CA C 109 63.396 65.459 -2.063 1
1 1288 . 4 1 1 A 109 109 PRO CB C 109 32.046 31.476 0.570 1
1 1290 . 4 1 1 A 110 110 PHE H H 110 8.123 8.015 0.108 1
1 1291 . 4 1 1 A 110 110 PHE HA H 110 4.619 4.519 0.100 1
1 1296 . 4 1 1 A 110 110 PHE C C 110 173.856 177.501 -3.645 1
1 1297 . 4 1 1 A 110 110 PHE CA C 110 57.353 62.085 -4.732 1
1 1298 . 4 1 1 A 110 110 PHE CB C 110 39.364 39.208 0.156 1
1 1301 . 4 1 1 A 110 110 PHE N N 110 119.265 118.987 0.278 1
1 1302 . 4 1 1 A 111 111 ASP H H 111 8.161 8.582 -0.421 1
1 1303 . 4 1 1 A 111 111 ASP HA H 111 4.613 4.648 -0.035 1
1 1306 . 4 1 1 A 111 111 ASP C C 111 174.114 178.333 -4.219 1
1 1307 . 4 1 1 A 111 111 ASP CA C 111 54.350 57.102 -2.752 1
1 1308 . 4 1 1 A 111 111 ASP CB C 111 41.413 39.789 1.624 1
1 1309 . 4 1 1 A 111 111 ASP N N 111 121.764 119.066 2.698 1
1 1310 . 4 1 1 A 112 112 ASN H H 112 8.307 8.404 -0.097 1
1 1311 . 4 1 1 A 112 112 ASN HA H 112 4.662 4.491 0.171 1
1 1316 . 4 1 1 A 112 112 ASN C C 112 173.595 177.747 -4.152 1
1 1317 . 4 1 1 A 112 112 ASN CA C 112 53.486 56.562 -3.076 1
1 1318 . 4 1 1 A 112 112 ASN CB C 112 39.225 37.662 1.563 1
1 1319 . 4 1 1 A 112 112 ASN N N 112 119.154 119.551 -0.397 1
1 1321 . 4 1 1 A 113 113 GLU H H 113 8.404 8.232 0.172 1
1 1322 . 4 1 1 A 113 113 GLU HA H 113 4.264 4.025 0.239 1
1 1327 . 4 1 1 A 113 113 GLU C C 113 174.886 178.848 -3.962 1
1 1328 . 4 1 1 A 113 113 GLU CA C 113 56.681 59.400 -2.719 1
1 1329 . 4 1 1 A 113 113 GLU CB C 113 30.403 29.433 0.970 1
1 1331 . 4 1 1 A 113 113 GLU N N 113 120.943 120.036 0.907 1
1 1332 . 4 1 1 A 114 114 GLU H H 114 8.388 8.286 0.102 1
1 1333 . 4 1 1 A 114 114 GLU HA H 114 4.262 4.120 0.142 1
1 1338 . 4 1 1 A 114 114 GLU C C 114 174.819 178.920 -4.101 1
1 1339 . 4 1 1 A 114 114 GLU CA C 114 56.769 59.354 -2.585 1
1 1340 . 4 1 1 A 114 114 GLU CB C 114 30.125 29.541 0.584 1
1 1342 . 4 1 1 A 114 114 GLU N N 114 121.869 118.929 2.940 1
1 1343 . 4 1 1 A 115 115 LYS H H 115 8.236 8.420 -0.184 1
1 1344 . 4 1 1 A 115 115 LYS HA H 115 4.347 4.279 0.068 1
1 1353 . 4 1 1 A 115 115 LYS C C 115 174.633 176.397 -1.764 1
1 1354 . 4 1 1 A 115 115 LYS CA C 115 56.426 58.427 -2.001 1
1 1355 . 4 1 1 A 115 115 LYS CB C 115 33.277 32.630 0.647 1
1 1359 . 4 1 1 A 115 115 LYS N N 115 121.997 118.056 3.941 1
1 1360 . 4 1 1 A 116 116 ASP H H 116 8.386 7.417 0.969 1
1 1361 . 4 1 1 A 116 116 ASP HA H 116 4.600 4.744 -0.144 1
1 1364 . 4 1 1 A 116 116 ASP C C 116 173.448 175.010 -1.562 1
1 1365 . 4 1 1 A 116 116 ASP CA C 116 54.773 55.534 -0.761 1
1 1366 . 4 1 1 A 116 116 ASP CB C 116 41.029 43.331 -2.302 1
1 1367 . 4 1 1 A 116 116 ASP N N 116 121.057 113.303 7.754 1
1 5 . 5 1 1 A 2 2 MET HA H 2 4.534 4.165 0.369 1
1 13 . 5 1 1 A 2 2 MET C C 2 174.355 177.896 -3.541 1
1 14 . 5 1 1 A 2 2 MET CA C 2 56.247 58.116 -1.869 1
1 15 . 5 1 1 A 2 2 MET CB C 2 32.855 32.160 0.695 1
1 18 . 5 1 1 A 3 3 ASN H H 3 8.600 8.390 0.210 1
1 19 . 5 1 1 A 3 3 ASN HA H 3 4.711 4.501 0.210 1
1 24 . 5 1 1 A 3 3 ASN C C 3 173.983 177.672 -3.689 1
1 25 . 5 1 1 A 3 3 ASN CA C 3 53.650 56.501 -2.851 1
1 26 . 5 1 1 A 3 3 ASN CB C 3 38.624 39.444 -0.820 1
1 27 . 5 1 1 A 3 3 ASN N N 3 120.149 118.127 2.022 1
1 29 . 5 1 1 A 4 4 GLU H H 4 8.495 8.146 0.349 1
1 30 . 5 1 1 A 4 4 GLU HA H 4 4.235 4.085 0.150 1
1 35 . 5 1 1 A 4 4 GLU C C 4 175.752 178.589 -2.837 1
1 36 . 5 1 1 A 4 4 GLU CA C 4 58.075 59.248 -1.173 1
1 37 . 5 1 1 A 4 4 GLU CB C 4 30.125 29.410 0.715 1
1 38 . 5 1 1 A 4 4 GLU N N 4 121.543 118.993 2.550 1
1 39 . 5 1 1 A 5 5 LEU HA H 5 4.073 4.186 -0.113 1
1 47 . 5 1 1 A 5 5 LEU CB C 5 41.897 41.553 0.344 1
1 50 . 5 1 1 A 6 6 GLU H H 6 8.332 8.423 -0.091 1
1 51 . 5 1 1 A 6 6 GLU HA H 6 3.621 4.158 -0.537 1
1 52 . 5 1 1 A 6 6 GLU C C 6 176.402 178.378 -1.976 1
1 53 . 5 1 1 A 6 6 GLU CA C 6 58.461 58.964 -0.503 1
1 54 . 5 1 1 A 6 6 GLU CB C 6 29.730 29.812 -0.082 1
1 55 . 5 1 1 A 6 6 GLU N N 6 121.462 118.800 2.662 1
1 56 . 5 1 1 A 7 7 ALA H H 7 8.244 7.752 0.492 1
1 57 . 5 1 1 A 7 7 ALA HA H 7 4.185 4.099 0.086 1
1 61 . 5 1 1 A 7 7 ALA C C 7 177.982 178.400 -0.418 1
1 62 . 5 1 1 A 7 7 ALA CA C 7 54.791 55.569 -0.778 1
1 63 . 5 1 1 A 7 7 ALA CB C 7 18.836 19.040 -0.204 1
1 64 . 5 1 1 A 7 7 ALA N N 7 123.078 122.650 0.428 1
1 65 . 5 1 1 A 8 8 GLN H H 8 8.274 7.864 0.410 1
1 66 . 5 1 1 A 8 8 GLN HA H 8 4.219 4.480 -0.261 1
1 73 . 5 1 1 A 8 8 GLN C C 8 176.325 175.332 0.993 1
1 74 . 5 1 1 A 8 8 GLN CA C 8 57.864 55.662 2.202 1
1 75 . 5 1 1 A 8 8 GLN CB C 8 28.768 29.234 -0.466 1
1 77 . 5 1 1 A 8 8 GLN N N 8 117.452 115.852 1.600 1
1 79 . 5 1 1 A 9 9 THR H H 9 8.043 8.574 -0.531 1
1 80 . 5 1 1 A 9 9 THR HA H 9 3.998 4.617 -0.619 1
1 85 . 5 1 1 A 9 9 THR C C 9 173.904 175.383 -1.479 1
1 86 . 5 1 1 A 9 9 THR CA C 9 65.435 61.892 3.543 1
1 87 . 5 1 1 A 9 9 THR CB C 9 68.870 69.822 -0.952 1
1 89 . 5 1 1 A 9 9 THR N N 9 116.135 119.124 -2.989 1
1 90 . 5 1 1 A 10 10 ARG H H 10 8.095 8.995 -0.900 1
1 91 . 5 1 1 A 10 10 ARG HA H 10 4.040 4.113 -0.073 1
1 98 . 5 1 1 A 10 10 ARG C C 10 176.583 176.269 0.314 1
1 99 . 5 1 1 A 10 10 ARG CA C 10 59.262 57.512 1.750 1
1 100 . 5 1 1 A 10 10 ARG CB C 10 29.900 30.124 -0.224 1
1 101 . 5 1 1 A 10 10 ARG N N 10 121.157 125.089 -3.932 1
1 102 . 5 1 1 A 11 11 VAL H H 11 7.657 7.802 -0.145 1
1 103 . 5 1 1 A 11 11 VAL HA H 11 3.769 4.399 -0.630 1
1 111 . 5 1 1 A 11 11 VAL C C 11 176.662 177.749 -1.087 1
1 112 . 5 1 1 A 11 11 VAL CA C 11 65.914 64.134 1.780 1
1 113 . 5 1 1 A 11 11 VAL CB C 11 31.745 33.323 -1.578 1
1 114 . 5 1 1 A 11 11 VAL N N 11 118.580 118.050 0.530 1
1 115 . 5 1 1 A 12 12 LYS H H 12 7.471 8.038 -0.567 1
1 116 . 5 1 1 A 12 12 LYS HA H 12 3.366 4.356 -0.990 1
1 123 . 5 1 1 A 12 12 LYS C C 12 176.457 179.518 -3.061 1
1 124 . 5 1 1 A 12 12 LYS CA C 12 59.545 59.005 0.540 1
1 125 . 5 1 1 A 12 12 LYS CB C 12 32.206 32.229 -0.023 1
1 126 . 5 1 1 A 12 12 LYS N N 12 121.835 122.271 -0.436 1
1 127 . 5 1 1 A 13 13 LEU H H 13 8.144 8.068 0.076 1
1 128 . 5 1 1 A 13 13 LEU HA H 13 4.093 4.047 0.046 1
1 137 . 5 1 1 A 13 13 LEU C C 13 178.254 179.236 -0.982 1
1 138 . 5 1 1 A 13 13 LEU CA C 13 58.023 57.996 0.027 1
1 139 . 5 1 1 A 13 13 LEU CB C 13 41.283 41.716 -0.433 1
1 140 . 5 1 1 A 13 13 LEU N N 13 118.688 120.873 -2.185 1
1 141 . 5 1 1 A 14 14 ASN H H 14 8.384 8.312 0.072 1
1 142 . 5 1 1 A 14 14 ASN HA H 14 4.567 4.429 0.138 1
1 147 . 5 1 1 A 14 14 ASN C C 14 175.397 177.702 -2.305 1
1 148 . 5 1 1 A 14 14 ASN CA C 14 56.239 56.608 -0.369 1
1 149 . 5 1 1 A 14 14 ASN CB C 14 38.432 37.486 0.946 1
1 150 . 5 1 1 A 14 14 ASN N N 14 118.175 116.462 1.713 1
1 152 . 5 1 1 A 15 15 TYR H H 15 7.982 7.840 0.142 1
1 153 . 5 1 1 A 15 15 TYR HA H 15 4.249 4.223 0.026 1
1 160 . 5 1 1 A 15 15 TYR C C 15 175.503 177.753 -2.250 1
1 161 . 5 1 1 A 15 15 TYR CA C 15 62.450 61.525 0.925 1
1 162 . 5 1 1 A 15 15 TYR CB C 15 39.399 38.580 0.819 1
1 163 . 5 1 1 A 15 15 TYR N N 15 121.955 123.105 -1.150 1
1 164 . 5 1 1 A 16 16 LEU H H 16 8.198 8.440 -0.242 1
1 165 . 5 1 1 A 16 16 LEU HA H 16 4.470 3.910 0.560 1
1 175 . 5 1 1 A 16 16 LEU C C 16 177.125 178.084 -0.959 1
1 176 . 5 1 1 A 16 16 LEU CA C 16 57.374 58.196 -0.822 1
1 177 . 5 1 1 A 16 16 LEU CB C 16 41.443 41.446 -0.003 1
1 178 . 5 1 1 A 16 16 LEU N N 16 117.642 120.881 -3.239 1
1 179 . 5 1 1 A 17 17 ASP H H 17 8.061 8.199 -0.138 1
1 180 . 5 1 1 A 17 17 ASP C C 17 177.836 177.898 -0.062 1
1 181 . 5 1 1 A 17 17 ASP CA C 17 57.486 57.462 0.024 1
1 182 . 5 1 1 A 17 17 ASP CB C 17 41.433 41.848 -0.415 1
1 183 . 5 1 1 A 17 17 ASP N N 17 118.700 118.555 0.145 1
1 184 . 5 1 1 A 18 18 GLN H H 18 8.111 7.883 0.228 1
1 185 . 5 1 1 A 18 18 GLN HA H 18 4.002 4.071 -0.069 1
1 190 . 5 1 1 A 18 18 GLN CA C 18 59.046 58.849 0.197 1
1 191 . 5 1 1 A 18 18 GLN CB C 18 28.700 28.282 0.418 1
1 193 . 5 1 1 A 18 18 GLN N N 18 119.539 118.617 0.922 1
1 195 . 5 1 1 A 19 19 ILE H H 19 8.330 8.229 0.101 1
1 196 . 5 1 1 A 19 19 ILE HA H 19 3.306 3.912 -0.606 1
1 204 . 5 1 1 A 19 19 ILE C C 19 175.608 177.813 -2.205 1
1 205 . 5 1 1 A 19 19 ILE CA C 19 64.760 63.172 1.588 1
1 206 . 5 1 1 A 19 19 ILE CB C 19 37.148 36.887 0.261 1
1 209 . 5 1 1 A 19 19 ILE N N 19 121.490 119.928 1.562 1
1 210 . 5 1 1 A 20 20 ALA H H 20 8.057 7.916 0.141 1
1 211 . 5 1 1 A 20 20 ALA HA H 20 4.349 4.149 0.200 1
1 215 . 5 1 1 A 20 20 ALA C C 20 179.297 179.478 -0.181 1
1 216 . 5 1 1 A 20 20 ALA CA C 20 56.150 55.308 0.842 1
1 217 . 5 1 1 A 20 20 ALA CB C 20 18.104 18.169 -0.065 1
1 218 . 5 1 1 A 20 20 ALA N N 20 124.441 123.948 0.493 1
1 219 . 5 1 1 A 21 21 LYS H H 21 8.116 8.056 0.060 1
1 220 . 5 1 1 A 21 21 LYS HA H 21 4.108 3.954 0.154 1
1 229 . 5 1 1 A 21 21 LYS C C 21 176.720 178.977 -2.257 1
1 230 . 5 1 1 A 21 21 LYS CA C 21 59.166 59.369 -0.203 1
1 231 . 5 1 1 A 21 21 LYS CB C 21 32.085 32.274 -0.189 1
1 233 . 5 1 1 A 21 21 LYS N N 21 119.865 117.283 2.582 1
1 234 . 5 1 1 A 22 22 PHE H H 22 7.875 8.091 -0.216 1
1 235 . 5 1 1 A 22 22 PHE HA H 22 4.012 4.181 -0.169 1
1 242 . 5 1 1 A 22 22 PHE C C 22 175.545 177.594 -2.049 1
1 243 . 5 1 1 A 22 22 PHE CA C 22 61.070 61.339 -0.269 1
1 244 . 5 1 1 A 22 22 PHE CB C 22 39.072 38.885 0.187 1
1 249 . 5 1 1 A 22 22 PHE N N 22 119.729 120.136 -0.407 1
1 250 . 5 1 1 A 23 23 TRP H H 23 7.841 7.834 0.007 1
1 251 . 5 1 1 A 23 23 TRP HA H 23 4.149 3.972 0.177 1
1 260 . 5 1 1 A 23 23 TRP C C 23 176.668 178.088 -1.420 1
1 261 . 5 1 1 A 23 23 TRP CB C 23 28.543 29.782 -1.239 1
1 267 . 5 1 1 A 23 23 TRP N N 23 119.440 120.665 -1.225 1
1 269 . 5 1 1 A 24 24 GLU H H 24 8.261 8.426 -0.165 1
1 270 . 5 1 1 A 24 24 GLU HA H 24 4.265 4.313 -0.048 1
1 275 . 5 1 1 A 24 24 GLU C C 24 179.679 179.315 0.364 1
1 276 . 5 1 1 A 24 24 GLU CA C 24 59.706 59.035 0.671 1
1 277 . 5 1 1 A 24 24 GLU CB C 24 29.720 29.391 0.329 1
1 279 . 5 1 1 A 24 24 GLU N N 24 121.376 118.643 2.733 1
1 280 . 5 1 1 A 25 25 ILE H H 25 8.071 8.048 0.023 1
1 281 . 5 1 1 A 25 25 ILE HA H 25 3.815 3.783 0.032 1
1 291 . 5 1 1 A 25 25 ILE C C 25 176.343 177.900 -1.557 1
1 292 . 5 1 1 A 25 25 ILE CA C 25 64.464 62.298 2.166 1
1 293 . 5 1 1 A 25 25 ILE CB C 25 37.371 37.499 -0.128 1
1 296 . 5 1 1 A 25 25 ILE N N 25 121.499 119.853 1.646 1
1 297 . 5 1 1 A 26 26 GLN H H 26 7.327 7.246 0.081 1
1 298 . 5 1 1 A 26 26 GLN HA H 26 4.074 4.134 -0.060 1
1 305 . 5 1 1 A 26 26 GLN C C 26 174.906 175.710 -0.804 1
1 306 . 5 1 1 A 26 26 GLN CA C 26 55.450 55.703 -0.253 1
1 307 . 5 1 1 A 26 26 GLN CB C 26 28.458 28.921 -0.463 1
1 309 . 5 1 1 A 26 26 GLN N N 26 116.532 120.424 -3.892 1
1 311 . 5 1 1 A 27 27 GLY H H 27 7.861 8.573 -0.712 1
1 312 . 5 1 1 A 27 27 GLY HA2 H 27 4.297 3.711 0.586 1
1 313 . 5 1 1 A 27 27 GLY HA3 H 27 3.823 3.716 0.107 1
1 314 . 5 1 1 A 27 27 GLY C C 27 172.698 173.268 -0.570 1
1 315 . 5 1 1 A 27 27 GLY CA C 27 45.608 45.417 0.191 1
1 316 . 5 1 1 A 27 27 GLY N N 27 106.837 108.395 -1.558 1
1 317 . 5 1 1 A 28 28 SER H H 28 8.083 7.098 0.985 1
1 318 . 5 1 1 A 28 28 SER HA H 28 4.777 4.709 0.068 1
1 321 . 5 1 1 A 28 28 SER C C 28 171.196 171.627 -0.431 1
1 322 . 5 1 1 A 28 28 SER CA C 28 56.041 56.886 -0.845 1
1 323 . 5 1 1 A 28 28 SER CB C 28 64.539 66.533 -1.994 1
1 324 . 5 1 1 A 28 28 SER N N 28 116.151 114.321 1.830 1
1 325 . 5 1 1 A 29 29 SER H H 29 8.354 8.526 -0.172 1
1 326 . 5 1 1 A 29 29 SER HA H 29 4.389 5.215 -0.826 1
1 329 . 5 1 1 A 29 29 SER C C 29 172.166 171.922 0.244 1
1 330 . 5 1 1 A 29 29 SER CA C 29 58.107 56.263 1.844 1
1 331 . 5 1 1 A 29 29 SER CB C 29 63.853 65.982 -2.129 1
1 332 . 5 1 1 A 29 29 SER N N 29 116.596 114.520 2.076 1
1 333 . 5 1 1 A 30 30 LEU H H 30 8.990 8.945 0.045 1
1 334 . 5 1 1 A 30 30 LEU HA H 30 3.964 5.341 -1.377 1
1 344 . 5 1 1 A 30 30 LEU C C 30 173.752 175.616 -1.864 1
1 345 . 5 1 1 A 30 30 LEU CA C 30 55.193 53.879 1.314 1
1 346 . 5 1 1 A 30 30 LEU CB C 30 42.869 44.440 -1.571 1
1 349 . 5 1 1 A 30 30 LEU N N 30 125.860 126.089 -0.229 1
1 350 . 5 1 1 A 31 31 LYS H H 31 8.118 8.929 -0.811 1
1 351 . 5 1 1 A 31 31 LYS HA H 31 4.498 4.852 -0.354 1
1 360 . 5 1 1 A 31 31 LYS C C 31 173.555 175.008 -1.453 1
1 361 . 5 1 1 A 31 31 LYS CA C 31 54.372 55.232 -0.860 1
1 362 . 5 1 1 A 31 31 LYS CB C 31 32.814 35.243 -2.429 1
1 365 . 5 1 1 A 31 31 LYS N N 31 129.965 127.519 2.446 1
1 366 . 5 1 1 A 32 32 ILE H H 32 8.717 8.560 0.157 1
1 367 . 5 1 1 A 32 32 ILE HA H 32 4.011 4.578 -0.567 1
1 377 . 5 1 1 A 32 32 ILE C C 32 173.038 175.122 -2.084 1
1 378 . 5 1 1 A 32 32 ILE CA C 32 59.921 58.805 1.116 1
1 379 . 5 1 1 A 32 32 ILE CB C 32 38.139 38.589 -0.450 1
1 382 . 5 1 1 A 32 32 ILE N N 32 127.091 123.358 3.733 1
1 383 . 5 1 1 A 33 33 PRO HA H 33 4.412 4.545 -0.133 1
1 390 . 5 1 1 A 33 33 PRO C C 33 172.724 175.479 -2.755 1
1 391 . 5 1 1 A 33 33 PRO CA C 33 62.565 62.072 0.493 1
1 392 . 5 1 1 A 33 33 PRO CB C 33 32.728 32.613 0.115 1
1 394 . 5 1 1 A 34 34 ASN H H 34 8.265 8.528 -0.263 1
1 395 . 5 1 1 A 34 34 ASN HA H 34 5.147 5.601 -0.454 1
1 400 . 5 1 1 A 34 34 ASN C C 34 174.079 174.492 -0.413 1
1 401 . 5 1 1 A 34 34 ASN CA C 34 52.088 51.815 0.273 1
1 402 . 5 1 1 A 34 34 ASN CB C 34 40.387 41.110 -0.723 1
1 403 . 5 1 1 A 34 34 ASN N N 34 116.424 118.356 -1.932 1
1 405 . 5 1 1 A 35 35 VAL H H 35 8.904 9.253 -0.349 1
1 406 . 5 1 1 A 35 35 VAL HA H 35 4.159 4.467 -0.308 1
1 414 . 5 1 1 A 35 35 VAL C C 35 173.834 174.881 -1.047 1
1 415 . 5 1 1 A 35 35 VAL CA C 35 61.953 59.925 2.028 1
1 416 . 5 1 1 A 35 35 VAL CB C 35 34.432 34.868 -0.436 1
1 419 . 5 1 1 A 35 35 VAL N N 35 122.778 119.727 3.051 1
1 420 . 5 1 1 A 36 36 GLU H H 36 9.560 9.550 0.010 1
1 421 . 5 1 1 A 36 36 GLU HA H 36 3.819 4.038 -0.219 1
1 426 . 5 1 1 A 36 36 GLU C C 36 173.604 176.376 -2.772 1
1 427 . 5 1 1 A 36 36 GLU CA C 36 57.131 58.051 -0.920 1
1 428 . 5 1 1 A 36 36 GLU CB C 36 27.464 28.108 -0.644 1
1 430 . 5 1 1 A 36 36 GLU N N 36 127.014 129.680 -2.666 1
1 431 . 5 1 1 A 37 37 ARG H H 37 8.578 8.650 -0.072 1
1 432 . 5 1 1 A 37 37 ARG HA H 37 3.792 4.004 -0.212 1
1 439 . 5 1 1 A 37 37 ARG C C 37 173.371 175.342 -1.971 1
1 440 . 5 1 1 A 37 37 ARG CA C 37 57.952 57.373 0.579 1
1 441 . 5 1 1 A 37 37 ARG CB C 37 27.657 27.914 -0.257 1
1 443 . 5 1 1 A 37 37 ARG N N 37 108.362 117.447 -9.085 1
1 444 . 5 1 1 A 38 38 ARG H H 38 7.696 7.849 -0.153 1
1 445 . 5 1 1 A 38 38 ARG HA H 38 4.743 5.161 -0.418 1
1 452 . 5 1 1 A 38 38 ARG C C 38 173.513 175.424 -1.911 1
1 453 . 5 1 1 A 38 38 ARG CA C 38 54.507 54.739 -0.232 1
1 454 . 5 1 1 A 38 38 ARG CB C 38 33.751 33.020 0.731 1
1 456 . 5 1 1 A 38 38 ARG N N 38 118.370 121.683 -3.313 1
1 457 . 5 1 1 A 39 39 ILE H H 39 8.463 8.625 -0.162 1
1 458 . 5 1 1 A 39 39 ILE HA H 39 4.184 4.202 -0.018 1
1 468 . 5 1 1 A 39 39 ILE C C 39 175.150 175.772 -0.622 1
1 469 . 5 1 1 A 39 39 ILE CA C 39 62.076 61.891 0.185 1
1 470 . 5 1 1 A 39 39 ILE CB C 39 38.864 39.437 -0.573 1
1 473 . 5 1 1 A 39 39 ILE N N 39 123.604 126.831 -3.227 1
1 474 . 5 1 1 A 40 40 LEU H H 40 8.239 8.122 0.117 1
1 475 . 5 1 1 A 40 40 LEU HA H 40 4.259 4.394 -0.135 1
1 485 . 5 1 1 A 40 40 LEU C C 40 173.152 175.342 -2.190 1
1 486 . 5 1 1 A 40 40 LEU CA C 40 55.305 54.667 0.638 1
1 487 . 5 1 1 A 40 40 LEU CB C 40 43.113 41.752 1.361 1
1 490 . 5 1 1 A 40 40 LEU N N 40 129.550 128.803 0.747 1
1 491 . 5 1 1 A 41 41 ASP H H 41 8.992 8.501 0.491 1
1 492 . 5 1 1 A 41 41 ASP HA H 41 4.798 4.768 0.030 1
1 495 . 5 1 1 A 41 41 ASP C C 41 173.837 176.213 -2.376 1
1 496 . 5 1 1 A 41 41 ASP CA C 41 52.077 53.424 -1.347 1
1 497 . 5 1 1 A 41 41 ASP CB C 41 39.454 40.620 -1.166 1
1 498 . 5 1 1 A 41 41 ASP N N 41 127.022 127.754 -0.732 1
1 499 . 5 1 1 A 42 42 LEU H H 42 7.912 8.179 -0.267 1
1 500 . 5 1 1 A 42 42 LEU HA H 42 3.970 4.090 -0.120 1
1 510 . 5 1 1 A 42 42 LEU C C 42 176.305 178.157 -1.852 1
1 511 . 5 1 1 A 42 42 LEU CA C 42 58.128 57.898 0.230 1
1 512 . 5 1 1 A 42 42 LEU CB C 42 43.043 41.794 1.249 1
1 514 . 5 1 1 A 42 42 LEU N N 42 125.064 127.835 -2.771 1
1 515 . 5 1 1 A 43 43 TYR H H 43 8.565 8.031 0.534 1
1 516 . 5 1 1 A 43 43 TYR HA H 43 3.728 4.260 -0.532 1
1 523 . 5 1 1 A 43 43 TYR C C 43 175.757 178.504 -2.747 1
1 524 . 5 1 1 A 43 43 TYR CA C 43 61.774 60.442 1.332 1
1 525 . 5 1 1 A 43 43 TYR CB C 43 38.235 38.280 -0.045 1
1 528 . 5 1 1 A 43 43 TYR N N 43 117.822 119.758 -1.936 1
1 529 . 5 1 1 A 44 44 SER H H 44 8.115 8.603 -0.488 1
1 530 . 5 1 1 A 44 44 SER HA H 44 3.854 4.248 -0.394 1
1 533 . 5 1 1 A 44 44 SER C C 44 174.080 176.937 -2.857 1
1 534 . 5 1 1 A 44 44 SER CA C 44 61.873 61.805 0.068 1
1 535 . 5 1 1 A 44 44 SER CB C 44 64.350 62.489 1.861 1
1 536 . 5 1 1 A 44 44 SER N N 44 116.835 115.251 1.584 1
1 537 . 5 1 1 A 45 45 LEU H H 45 8.401 7.859 0.542 1
1 538 . 5 1 1 A 45 45 LEU HA H 45 4.102 4.181 -0.079 1
1 548 . 5 1 1 A 45 45 LEU C C 45 175.081 178.803 -3.722 1
1 549 . 5 1 1 A 45 45 LEU CA C 45 58.896 57.828 1.068 1
1 550 . 5 1 1 A 45 45 LEU CB C 45 41.741 41.429 0.312 1
1 553 . 5 1 1 A 45 45 LEU N N 45 120.621 124.232 -3.611 1
1 554 . 5 1 1 A 46 46 SER H H 46 8.110 8.356 -0.246 1
1 555 . 5 1 1 A 46 46 SER HA H 46 4.300 4.228 0.072 1
1 558 . 5 1 1 A 46 46 SER C C 46 175.019 176.600 -1.581 1
1 559 . 5 1 1 A 46 46 SER CA C 46 62.610 61.623 0.987 1
1 560 . 5 1 1 A 46 46 SER CB C 46 64.092 63.120 0.972 1
1 561 . 5 1 1 A 46 46 SER N N 46 112.826 114.821 -1.995 1
1 562 . 5 1 1 A 47 47 LYS H H 47 7.732 8.192 -0.460 1
1 563 . 5 1 1 A 47 47 LYS HA H 47 3.900 4.149 -0.249 1
1 572 . 5 1 1 A 47 47 LYS C C 47 177.441 178.953 -1.512 1
1 573 . 5 1 1 A 47 47 LYS CA C 47 58.575 59.199 -0.624 1
1 574 . 5 1 1 A 47 47 LYS CB C 47 32.351 31.539 0.812 1
1 576 . 5 1 1 A 47 47 LYS N N 47 121.210 119.042 2.168 1
1 577 . 5 1 1 A 48 48 ILE H H 48 8.672 8.174 0.498 1
1 578 . 5 1 1 A 48 48 ILE HA H 48 3.628 3.697 -0.069 1
1 588 . 5 1 1 A 48 48 ILE C C 48 175.861 178.163 -2.302 1
1 589 . 5 1 1 A 48 48 ILE CA C 48 64.188 65.127 -0.939 1
1 590 . 5 1 1 A 48 48 ILE CB C 48 37.954 37.667 0.287 1
1 593 . 5 1 1 A 48 48 ILE N N 48 120.810 121.134 -0.324 1
1 594 . 5 1 1 A 49 49 VAL H H 49 8.030 8.216 -0.186 1
1 595 . 5 1 1 A 49 49 VAL HA H 49 3.195 3.656 -0.461 1
1 603 . 5 1 1 A 49 49 VAL C C 49 176.513 178.429 -1.916 1
1 604 . 5 1 1 A 49 49 VAL CA C 49 66.760 67.007 -0.247 1
1 605 . 5 1 1 A 49 49 VAL CB C 49 30.935 31.782 -0.847 1
1 608 . 5 1 1 A 49 49 VAL N N 49 119.350 119.732 -0.382 1
1 609 . 5 1 1 A 50 50 VAL H H 50 7.336 8.459 -1.123 1
1 610 . 5 1 1 A 50 50 VAL HA H 50 3.497 3.594 -0.097 1
1 618 . 5 1 1 A 50 50 VAL C C 50 178.745 178.308 0.437 1
1 619 . 5 1 1 A 50 50 VAL CA C 50 67.384 66.632 0.752 1
1 620 . 5 1 1 A 50 50 VAL CB C 50 31.832 31.586 0.246 1
1 621 . 5 1 1 A 50 50 VAL N N 50 118.610 120.401 -1.791 1
1 622 . 5 1 1 A 51 51 GLU H H 51 8.318 8.175 0.143 1
1 623 . 5 1 1 A 51 51 GLU HA H 51 3.953 4.010 -0.057 1
1 628 . 5 1 1 A 51 51 GLU C C 51 177.281 179.419 -2.138 1
1 629 . 5 1 1 A 51 51 GLU CA C 51 59.668 59.204 0.464 1
1 630 . 5 1 1 A 51 51 GLU CB C 51 30.131 29.389 0.742 1
1 632 . 5 1 1 A 51 51 GLU N N 51 122.096 119.933 2.163 1
1 633 . 5 1 1 A 52 52 GLU H H 52 8.065 8.250 -0.185 1
1 634 . 5 1 1 A 52 52 GLU HA H 52 4.229 4.256 -0.027 1
1 639 . 5 1 1 A 52 52 GLU C C 52 173.534 176.692 -3.158 1
1 640 . 5 1 1 A 52 52 GLU CA C 52 55.547 56.453 -0.906 1
1 641 . 5 1 1 A 52 52 GLU CB C 52 28.716 29.807 -1.091 1
1 643 . 5 1 1 A 52 52 GLU N N 52 114.992 116.225 -1.233 1
1 644 . 5 1 1 A 53 53 GLY H H 53 7.459 8.995 -1.536 1
1 645 . 5 1 1 A 53 53 GLY HA2 H 53 3.630 3.957 -0.327 1
1 646 . 5 1 1 A 53 53 GLY HA3 H 53 3.630 3.976 -0.346 1
1 647 . 5 1 1 A 53 53 GLY C C 53 173.214 173.678 -0.464 1
1 648 . 5 1 1 A 53 53 GLY CA C 53 44.962 45.156 -0.194 1
1 649 . 5 1 1 A 53 53 GLY N N 53 104.909 107.613 -2.704 1
1 650 . 5 1 1 A 54 54 GLY H H 54 8.533 7.322 1.211 1
1 651 . 5 1 1 A 54 54 GLY HA2 H 54 3.548 4.074 -0.526 1
1 652 . 5 1 1 A 54 54 GLY HA3 H 54 4.521 4.120 0.401 1
1 653 . 5 1 1 A 54 54 GLY C C 54 169.966 174.542 -4.576 1
1 654 . 5 1 1 A 54 54 GLY CA C 54 43.988 45.727 -1.739 1
1 655 . 5 1 1 A 54 54 GLY N N 54 110.587 107.927 2.660 1
1 656 . 5 1 1 A 55 55 TYR H H 55 8.704 9.143 -0.439 1
1 657 . 5 1 1 A 55 55 TYR HA H 55 3.618 3.989 -0.371 1
1 664 . 5 1 1 A 55 55 TYR C C 55 174.807 177.256 -2.449 1
1 665 . 5 1 1 A 55 55 TYR CA C 55 62.540 61.459 1.081 1
1 666 . 5 1 1 A 55 55 TYR CB C 55 39.669 39.113 0.556 1
1 669 . 5 1 1 A 55 55 TYR N N 55 119.168 122.121 -2.953 1
1 670 . 5 1 1 A 56 56 GLU H H 56 9.006 8.062 0.944 1
1 671 . 5 1 1 A 56 56 GLU HA H 56 3.638 3.617 0.021 1
1 676 . 5 1 1 A 56 56 GLU C C 56 177.400 178.196 -0.796 1
1 677 . 5 1 1 A 56 56 GLU CA C 56 60.530 59.695 0.835 1
1 678 . 5 1 1 A 56 56 GLU CB C 56 29.168 29.660 -0.492 1
1 679 . 5 1 1 A 56 56 GLU N N 56 118.969 119.450 -0.481 1
1 680 . 5 1 1 A 57 57 ALA H H 57 8.235 7.788 0.447 1
1 681 . 5 1 1 A 57 57 ALA HA H 57 3.980 4.020 -0.040 1
1 685 . 5 1 1 A 57 57 ALA C C 57 177.678 179.765 -2.087 1
1 686 . 5 1 1 A 57 57 ALA CA C 57 54.910 55.114 -0.204 1
1 687 . 5 1 1 A 57 57 ALA CB C 57 18.122 18.530 -0.408 1
1 688 . 5 1 1 A 57 57 ALA N N 57 122.860 121.671 1.189 1
1 689 . 5 1 1 A 58 58 ILE H H 58 7.831 7.540 0.291 1
1 690 . 5 1 1 A 58 58 ILE HA H 58 3.189 3.330 -0.141 1
1 700 . 5 1 1 A 58 58 ILE C C 58 177.818 177.039 0.779 1
1 701 . 5 1 1 A 58 58 ILE CA C 58 65.074 64.526 0.548 1
1 702 . 5 1 1 A 58 58 ILE CB C 58 38.178 36.716 1.462 1
1 706 . 5 1 1 A 58 58 ILE N N 58 117.418 116.962 0.456 1
1 707 . 5 1 1 A 59 59 CYS H H 59 7.760 8.026 -0.266 1
1 708 . 5 1 1 A 59 59 CYS HA H 59 4.203 4.238 -0.035 1
1 711 . 5 1 1 A 59 59 CYS C C 59 176.357 176.839 -0.482 1
1 712 . 5 1 1 A 59 59 CYS CA C 59 63.760 62.612 1.148 1
1 713 . 5 1 1 A 59 59 CYS CB C 59 27.638 26.524 1.114 1
1 714 . 5 1 1 A 59 59 CYS N N 59 115.302 120.648 -5.346 1
1 715 . 5 1 1 A 60 60 LYS H H 60 8.350 7.854 0.496 1
1 716 . 5 1 1 A 60 60 LYS HA H 60 3.972 4.014 -0.042 1
1 725 . 5 1 1 A 60 60 LYS C C 60 176.373 177.617 -1.244 1
1 726 . 5 1 1 A 60 60 LYS CA C 60 59.796 58.876 0.920 1
1 727 . 5 1 1 A 60 60 LYS CB C 60 32.560 31.884 0.676 1
1 729 . 5 1 1 A 60 60 LYS N N 60 122.343 121.015 1.328 1
1 730 . 5 1 1 A 61 61 ASP H H 61 8.157 7.712 0.445 1
1 731 . 5 1 1 A 61 61 ASP HA H 61 4.616 4.631 -0.015 1
1 734 . 5 1 1 A 61 61 ASP C C 61 173.246 175.693 -2.447 1
1 735 . 5 1 1 A 61 61 ASP CA C 61 54.272 54.207 0.065 1
1 736 . 5 1 1 A 61 61 ASP CB C 61 41.023 41.025 -0.002 1
1 737 . 5 1 1 A 61 61 ASP N N 61 116.173 118.486 -2.313 1
1 738 . 5 1 1 A 62 62 ARG H H 62 7.655 7.724 -0.069 1
1 739 . 5 1 1 A 62 62 ARG HA H 62 4.149 3.969 0.180 1
1 746 . 5 1 1 A 62 62 ARG C C 62 175.891 176.435 -0.544 1
1 747 . 5 1 1 A 62 62 ARG CA C 62 57.381 57.203 0.178 1
1 748 . 5 1 1 A 62 62 ARG CB C 62 26.538 29.189 -2.651 1
1 750 . 5 1 1 A 62 62 ARG N N 62 117.213 118.677 -1.464 1
1 751 . 5 1 1 A 63 63 ARG H H 63 8.302 7.655 0.647 1
1 752 . 5 1 1 A 63 63 ARG HA H 63 4.240 4.277 -0.037 1
1 757 . 5 1 1 A 63 63 ARG C C 63 175.775 176.780 -1.005 1
1 758 . 5 1 1 A 63 63 ARG CA C 63 55.718 56.314 -0.596 1
1 760 . 5 1 1 A 63 63 ARG N N 63 116.292 118.403 -2.111 1
1 761 . 5 1 1 A 64 64 TRP H H 64 8.161 7.435 0.726 1
1 762 . 5 1 1 A 64 64 TRP HA H 64 3.836 4.392 -0.556 1
1 771 . 5 1 1 A 64 64 TRP C C 64 176.862 178.378 -1.516 1
1 772 . 5 1 1 A 64 64 TRP CA C 64 62.036 60.041 1.995 1
1 773 . 5 1 1 A 64 64 TRP CB C 64 27.028 28.523 -1.495 1
1 779 . 5 1 1 A 64 64 TRP N N 64 121.486 120.687 0.799 1
1 781 . 5 1 1 A 65 65 ALA H H 65 8.954 8.343 0.611 1
1 782 . 5 1 1 A 65 65 ALA HA H 65 4.290 4.038 0.252 1
1 786 . 5 1 1 A 65 65 ALA C C 65 178.986 179.398 -0.412 1
1 787 . 5 1 1 A 65 65 ALA CA C 65 55.314 55.460 -0.146 1
1 788 . 5 1 1 A 65 65 ALA CB C 65 18.119 18.080 0.039 1
1 789 . 5 1 1 A 65 65 ALA N N 65 121.559 122.782 -1.223 1
1 790 . 5 1 1 A 66 66 ARG H H 66 7.473 7.650 -0.177 1
1 791 . 5 1 1 A 66 66 ARG HA H 66 4.221 4.113 0.108 1
1 798 . 5 1 1 A 66 66 ARG C C 66 176.670 178.703 -2.033 1
1 799 . 5 1 1 A 66 66 ARG CA C 66 57.871 58.938 -1.067 1
1 800 . 5 1 1 A 66 66 ARG CB C 66 29.097 30.087 -0.990 1
1 801 . 5 1 1 A 66 66 ARG N N 66 119.915 117.307 2.608 1
1 802 . 5 1 1 A 67 67 VAL H H 67 7.134 8.171 -1.037 1
1 803 . 5 1 1 A 67 67 VAL HA H 67 3.304 3.651 -0.347 1
1 811 . 5 1 1 A 67 67 VAL C C 67 175.341 178.105 -2.764 1
1 812 . 5 1 1 A 67 67 VAL CA C 67 66.722 66.727 -0.005 1
1 813 . 5 1 1 A 67 67 VAL CB C 67 31.108 31.983 -0.875 1
1 816 . 5 1 1 A 67 67 VAL N N 67 119.970 120.770 -0.800 1
1 817 . 5 1 1 A 68 68 ALA H H 68 7.745 8.459 -0.714 1
1 818 . 5 1 1 A 68 68 ALA HA H 68 4.076 4.253 -0.177 1
1 822 . 5 1 1 A 68 68 ALA C C 68 177.358 179.371 -2.013 1
1 823 . 5 1 1 A 68 68 ALA CA C 68 55.607 55.849 -0.242 1
1 824 . 5 1 1 A 68 68 ALA CB C 68 18.061 18.500 -0.439 1
1 825 . 5 1 1 A 68 68 ALA N N 68 118.239 121.911 -3.672 1
1 826 . 5 1 1 A 69 69 GLN H H 69 7.979 8.132 -0.153 1
1 827 . 5 1 1 A 69 69 GLN HA H 69 4.310 3.975 0.335 1
1 834 . 5 1 1 A 69 69 GLN C C 69 179.370 178.412 0.958 1
1 835 . 5 1 1 A 69 69 GLN CA C 69 59.307 59.201 0.106 1
1 836 . 5 1 1 A 69 69 GLN CB C 69 29.257 28.447 0.810 1
1 838 . 5 1 1 A 69 69 GLN N N 69 118.484 117.929 0.555 1
1 840 . 5 1 1 A 70 70 ARG H H 70 8.374 8.009 0.365 1
1 841 . 5 1 1 A 70 70 ARG HA H 70 4.148 4.104 0.044 1
1 848 . 5 1 1 A 70 70 ARG C C 70 175.850 178.195 -2.345 1
1 849 . 5 1 1 A 70 70 ARG CA C 70 58.957 58.913 0.044 1
1 850 . 5 1 1 A 70 70 ARG CB C 70 29.799 30.145 -0.346 1
1 852 . 5 1 1 A 70 70 ARG N N 70 120.309 120.060 0.249 1
1 853 . 5 1 1 A 71 71 LEU H H 71 7.413 7.717 -0.304 1
1 854 . 5 1 1 A 71 71 LEU HA H 71 4.341 4.162 0.179 1
1 864 . 5 1 1 A 71 71 LEU C C 71 173.391 175.549 -2.158 1
1 865 . 5 1 1 A 71 71 LEU CA C 71 54.911 54.614 0.297 1
1 866 . 5 1 1 A 71 71 LEU CB C 71 42.693 41.494 1.199 1
1 867 . 5 1 1 A 71 71 LEU N N 71 118.841 117.554 1.287 1
1 868 . 5 1 1 A 72 72 ASN H H 72 8.038 7.973 0.065 1
1 869 . 5 1 1 A 72 72 ASN HA H 72 4.394 4.336 0.058 1
1 874 . 5 1 1 A 72 72 ASN C C 72 173.042 174.168 -1.126 1
1 875 . 5 1 1 A 72 72 ASN CB C 72 36.412 36.772 -0.360 1
1 876 . 5 1 1 A 72 72 ASN N N 72 112.919 114.557 -1.638 1
1 878 . 5 1 1 A 73 73 TYR H H 73 7.874 7.847 0.027 1
1 879 . 5 1 1 A 73 73 TYR HA H 73 4.868 4.578 0.290 1
1 886 . 5 1 1 A 73 73 TYR C C 73 172.194 174.143 -1.949 1
1 887 . 5 1 1 A 73 73 TYR CA C 73 57.105 56.775 0.330 1
1 888 . 5 1 1 A 73 73 TYR CB C 73 37.918 38.301 -0.383 1
1 889 . 5 1 1 A 73 73 TYR N N 73 117.432 119.017 -1.585 1
1 897 . 5 1 1 A 75 75 PRO HA H 75 4.626 4.252 0.374 1
1 902 . 5 1 1 A 75 75 PRO C C 75 175.728 177.272 -1.544 1
1 903 . 5 1 1 A 75 75 PRO CA C 75 62.502 63.777 -1.275 1
1 904 . 5 1 1 A 75 75 PRO CB C 75 32.339 31.800 0.539 1
1 905 . 5 1 1 A 76 76 GLY H H 76 8.369 8.888 -0.519 1
1 906 . 5 1 1 A 76 76 GLY HA2 H 76 4.057 3.912 0.145 1
1 907 . 5 1 1 A 76 76 GLY HA3 H 76 4.556 3.913 0.643 1
1 908 . 5 1 1 A 76 76 GLY C C 76 173.248 174.897 -1.649 1
1 909 . 5 1 1 A 76 76 GLY CA C 76 46.180 45.311 0.869 1
1 910 . 5 1 1 A 76 76 GLY N N 76 106.185 111.359 -5.174 1
1 911 . 5 1 1 A 77 77 LYS H H 77 8.632 8.546 0.086 1
1 912 . 5 1 1 A 77 77 LYS HA H 77 4.433 4.096 0.337 1
1 921 . 5 1 1 A 77 77 LYS C C 77 174.924 176.621 -1.697 1
1 922 . 5 1 1 A 77 77 LYS CA C 77 56.453 57.389 -0.936 1
1 923 . 5 1 1 A 77 77 LYS CB C 77 33.170 30.188 2.982 1
1 925 . 5 1 1 A 77 77 LYS N N 77 119.592 119.297 0.295 1
1 926 . 5 1 1 A 78 78 ASN H H 78 8.865 8.067 0.798 1
1 927 . 5 1 1 A 78 78 ASN HA H 78 4.654 4.484 0.170 1
1 932 . 5 1 1 A 78 78 ASN C C 78 174.869 178.183 -3.314 1
1 933 . 5 1 1 A 78 78 ASN CA C 78 54.117 55.836 -1.719 1
1 934 . 5 1 1 A 78 78 ASN CB C 78 37.841 37.805 0.036 1
1 935 . 5 1 1 A 78 78 ASN N N 78 116.880 119.086 -2.206 1
1 937 . 5 1 1 A 79 79 ILE H H 79 8.008 8.194 -0.186 1
1 938 . 5 1 1 A 79 79 ILE HA H 79 3.718 3.635 0.083 1
1 948 . 5 1 1 A 79 79 ILE C C 79 175.921 178.126 -2.205 1
1 949 . 5 1 1 A 79 79 ILE CA C 79 63.618 64.624 -1.006 1
1 950 . 5 1 1 A 79 79 ILE CB C 79 37.158 37.143 0.015 1
1 952 . 5 1 1 A 79 79 ILE N N 79 119.688 121.478 -1.790 1
1 953 . 5 1 1 A 80 80 GLY H H 80 9.062 8.288 0.774 1
1 954 . 5 1 1 A 80 80 GLY HA2 H 80 3.739 3.740 -0.001 1
1 955 . 5 1 1 A 80 80 GLY HA3 H 80 3.739 3.811 -0.072 1
1 956 . 5 1 1 A 80 80 GLY C C 80 173.185 176.403 -3.218 1
1 957 . 5 1 1 A 80 80 GLY CA C 80 48.166 47.574 0.592 1
1 958 . 5 1 1 A 80 80 GLY N N 80 110.338 109.083 1.255 1
1 959 . 5 1 1 A 81 81 SER H H 81 7.460 8.044 -0.584 1
1 960 . 5 1 1 A 81 81 SER HA H 81 3.904 4.115 -0.211 1
1 963 . 5 1 1 A 81 81 SER C C 81 174.999 175.933 -0.934 1
1 964 . 5 1 1 A 81 81 SER CA C 81 61.138 62.597 -1.459 1
1 965 . 5 1 1 A 81 81 SER CB C 81 62.740 62.974 -0.234 1
1 966 . 5 1 1 A 81 81 SER N N 81 115.348 119.650 -4.302 1
1 967 . 5 1 1 A 82 82 LEU H H 82 7.367 7.666 -0.299 1
1 968 . 5 1 1 A 82 82 LEU HA H 82 3.946 3.986 -0.040 1
1 977 . 5 1 1 A 82 82 LEU C C 82 176.969 178.200 -1.231 1
1 978 . 5 1 1 A 82 82 LEU CA C 82 57.504 58.232 -0.728 1
1 979 . 5 1 1 A 82 82 LEU CB C 82 42.185 41.346 0.839 1
1 980 . 5 1 1 A 82 82 LEU N N 82 124.267 122.480 1.787 1
1 981 . 5 1 1 A 83 83 LEU H H 83 8.330 8.402 -0.072 1
1 982 . 5 1 1 A 83 83 LEU HA H 83 3.924 3.944 -0.020 1
1 991 . 5 1 1 A 83 83 LEU C C 83 176.303 178.406 -2.103 1
1 992 . 5 1 1 A 83 83 LEU CA C 83 58.067 58.411 -0.344 1
1 993 . 5 1 1 A 83 83 LEU CB C 83 41.061 41.447 -0.386 1
1 994 . 5 1 1 A 83 83 LEU N N 83 117.452 119.699 -2.247 1
1 995 . 5 1 1 A 84 84 ARG H H 84 7.651 8.260 -0.609 1
1 996 . 5 1 1 A 84 84 ARG HA H 84 2.230 3.685 -1.455 1
1 1003 . 5 1 1 A 84 84 ARG C C 84 175.902 178.521 -2.619 1
1 1004 . 5 1 1 A 84 84 ARG CA C 84 59.112 59.490 -0.378 1
1 1005 . 5 1 1 A 84 84 ARG CB C 84 28.579 29.582 -1.003 1
1 1007 . 5 1 1 A 84 84 ARG N N 84 119.586 119.585 0.001 1
1 1008 . 5 1 1 A 85 85 SER H H 85 7.291 8.129 -0.838 1
1 1009 . 5 1 1 A 85 85 SER HA H 85 4.189 4.060 0.129 1
1 1012 . 5 1 1 A 85 85 SER C C 85 175.546 176.473 -0.927 1
1 1013 . 5 1 1 A 85 85 SER CA C 85 61.376 62.229 -0.853 1
1 1014 . 5 1 1 A 85 85 SER CB C 85 62.805 63.027 -0.222 1
1 1015 . 5 1 1 A 85 85 SER N N 85 112.921 116.691 -3.770 1
1 1016 . 5 1 1 A 86 86 HIS H H 86 8.156 7.480 0.676 1
1 1017 . 5 1 1 A 86 86 HIS HA H 86 4.782 4.198 0.584 1
1 1022 . 5 1 1 A 86 86 HIS C C 86 176.851 177.683 -0.832 1
1 1023 . 5 1 1 A 86 86 HIS CA C 86 58.898 59.751 -0.853 1
1 1024 . 5 1 1 A 86 86 HIS CB C 86 31.110 30.120 0.990 1
1 1027 . 5 1 1 A 86 86 HIS N N 86 119.258 119.152 0.106 1
1 1028 . 5 1 1 A 87 87 TYR H H 87 9.180 8.230 0.950 1
1 1029 . 5 1 1 A 87 87 TYR HA H 87 3.913 3.872 0.041 1
1 1036 . 5 1 1 A 87 87 TYR C C 87 176.841 177.800 -0.959 1
1 1037 . 5 1 1 A 87 87 TYR CA C 87 63.526 61.294 2.232 1
1 1038 . 5 1 1 A 87 87 TYR CB C 87 39.431 38.139 1.292 1
1 1041 . 5 1 1 A 87 87 TYR N N 87 120.625 119.997 0.628 1
1 1042 . 5 1 1 A 88 88 GLU H H 88 9.028 8.456 0.572 1
1 1043 . 5 1 1 A 88 88 GLU HA H 88 3.682 3.966 -0.284 1
1 1048 . 5 1 1 A 88 88 GLU C C 88 175.833 178.639 -2.806 1
1 1049 . 5 1 1 A 88 88 GLU CA C 88 59.730 59.565 0.165 1
1 1050 . 5 1 1 A 88 88 GLU CB C 88 30.009 29.498 0.511 1
1 1052 . 5 1 1 A 88 88 GLU N N 88 119.531 119.072 0.459 1
1 1053 . 5 1 1 A 89 89 ARG H H 89 8.052 7.867 0.185 1
1 1054 . 5 1 1 A 89 89 ARG HA H 89 4.292 4.579 -0.287 1
1 1061 . 5 1 1 A 89 89 ARG C C 89 176.045 178.430 -2.385 1
1 1062 . 5 1 1 A 89 89 ARG CA C 89 58.538 57.750 0.788 1
1 1063 . 5 1 1 A 89 89 ARG CB C 89 31.841 32.184 -0.343 1
1 1065 . 5 1 1 A 89 89 ARG N N 89 114.741 119.424 -4.683 1
1 1066 . 5 1 1 A 90 90 ILE H H 90 8.141 8.193 -0.052 1
1 1067 . 5 1 1 A 90 90 ILE HA H 90 4.296 3.593 0.703 1
1 1075 . 5 1 1 A 90 90 ILE C C 90 174.461 176.879 -2.418 1
1 1076 . 5 1 1 A 90 90 ILE CA C 90 63.649 64.182 -0.533 1
1 1077 . 5 1 1 A 90 90 ILE CB C 90 40.626 38.436 2.190 1
1 1079 . 5 1 1 A 90 90 ILE N N 90 113.421 119.153 -5.732 1
1 1080 . 5 1 1 A 91 91 VAL H H 91 7.350 7.185 0.165 1
1 1081 . 5 1 1 A 91 91 VAL HA H 91 4.144 3.669 0.475 1
1 1089 . 5 1 1 A 91 91 VAL C C 91 175.422 176.703 -1.281 1
1 1090 . 5 1 1 A 91 91 VAL CA C 91 65.042 63.724 1.318 1
1 1091 . 5 1 1 A 91 91 VAL CB C 91 33.215 31.418 1.797 1
1 1092 . 5 1 1 A 91 91 VAL N N 91 118.215 120.644 -2.429 1
1 1093 . 5 1 1 A 92 92 TYR H H 92 8.565 7.953 0.612 1
1 1094 . 5 1 1 A 92 92 TYR HA H 92 4.217 4.199 0.018 1
1 1099 . 5 1 1 A 92 92 TYR C C 92 171.495 175.137 -3.642 1
1 1100 . 5 1 1 A 92 92 TYR CA C 92 61.558 62.339 -0.781 1
1 1101 . 5 1 1 A 92 92 TYR CB C 92 36.757 36.810 -0.053 1
1 1102 . 5 1 1 A 92 92 TYR N N 92 121.370 122.380 -1.010 1
1 1103 . 5 1 1 A 93 93 PRO HA H 93 4.136 4.432 -0.296 1
1 1108 . 5 1 1 A 93 93 PRO C C 93 177.077 178.392 -1.315 1
1 1109 . 5 1 1 A 93 93 PRO CA C 93 66.037 65.976 0.061 1
1 1110 . 5 1 1 A 93 93 PRO CB C 93 31.482 30.898 0.584 1
1 1111 . 5 1 1 A 94 94 TYR H H 94 6.517 7.427 -0.910 1
1 1112 . 5 1 1 A 94 94 TYR HA H 94 2.798 4.502 -1.704 1
1 1119 . 5 1 1 A 94 94 TYR C C 94 174.985 178.223 -3.238 1
1 1120 . 5 1 1 A 94 94 TYR CA C 94 59.356 59.299 0.057 1
1 1121 . 5 1 1 A 94 94 TYR CB C 94 37.987 37.023 0.964 1
1 1124 . 5 1 1 A 94 94 TYR N N 94 115.987 117.679 -1.692 1
1 1125 . 5 1 1 A 95 95 GLU H H 95 8.205 8.401 -0.196 1
1 1126 . 5 1 1 A 95 95 GLU HA H 95 3.682 4.155 -0.473 1
1 1131 . 5 1 1 A 95 95 GLU C C 95 178.530 178.891 -0.361 1
1 1132 . 5 1 1 A 95 95 GLU CA C 95 58.910 59.666 -0.756 1
1 1133 . 5 1 1 A 95 95 GLU CB C 95 29.187 29.213 -0.026 1
1 1134 . 5 1 1 A 95 95 GLU N N 95 119.946 121.333 -1.387 1
1 1135 . 5 1 1 A 96 96 MET H H 96 8.248 7.980 0.268 1
1 1136 . 5 1 1 A 96 96 MET HA H 96 4.172 4.216 -0.044 1
1 1142 . 5 1 1 A 96 96 MET C C 96 176.874 178.131 -1.257 1
1 1143 . 5 1 1 A 96 96 MET CA C 96 57.159 59.156 -1.997 1
1 1144 . 5 1 1 A 96 96 MET CB C 96 31.829 32.115 -0.286 1
1 1146 . 5 1 1 A 96 96 MET N N 96 117.570 119.202 -1.632 1
1 1147 . 5 1 1 A 97 97 TYR H H 97 7.445 8.301 -0.856 1
1 1148 . 5 1 1 A 97 97 TYR HA H 97 4.248 4.076 0.172 1
1 1155 . 5 1 1 A 97 97 TYR C C 97 176.476 177.812 -1.336 1
1 1156 . 5 1 1 A 97 97 TYR CA C 97 60.470 61.590 -1.120 1
1 1157 . 5 1 1 A 97 97 TYR CB C 97 38.612 38.477 0.135 1
1 1160 . 5 1 1 A 97 97 TYR N N 97 122.246 121.070 1.176 1
1 1161 . 5 1 1 A 98 98 GLN H H 98 8.087 8.669 -0.582 1
1 1162 . 5 1 1 A 98 98 GLN HA H 98 3.793 3.606 0.187 1
1 1169 . 5 1 1 A 98 98 GLN C C 98 175.549 178.494 -2.945 1
1 1170 . 5 1 1 A 98 98 GLN CA C 98 57.365 58.917 -1.552 1
1 1171 . 5 1 1 A 98 98 GLN CB C 98 28.901 28.635 0.266 1
1 1173 . 5 1 1 A 98 98 GLN N N 98 118.769 118.343 0.426 1
1 1175 . 5 1 1 A 99 99 SER H H 99 7.724 8.222 -0.498 1
1 1176 . 5 1 1 A 99 99 SER HA H 99 4.293 4.253 0.040 1
1 1179 . 5 1 1 A 99 99 SER C C 99 173.696 177.372 -3.676 1
1 1180 . 5 1 1 A 99 99 SER CA C 99 59.566 61.211 -1.645 1
1 1181 . 5 1 1 A 99 99 SER CB C 99 63.847 62.873 0.974 1
1 1182 . 5 1 1 A 99 99 SER N N 99 113.257 115.557 -2.300 1
1 1183 . 5 1 1 A 100 100 GLY H H 100 7.751 8.466 -0.715 1
1 1184 . 5 1 1 A 100 100 GLY HA2 H 100 3.813 3.876 -0.063 1
1 1185 . 5 1 1 A 100 100 GLY HA3 H 100 3.934 3.882 0.052 1
1 1186 . 5 1 1 A 100 100 GLY C C 100 172.643 176.262 -3.619 1
1 1187 . 5 1 1 A 100 100 GLY CA C 100 45.570 46.973 -1.403 1
1 1188 . 5 1 1 A 100 100 GLY N N 100 109.750 108.670 1.080 1
1 1189 . 5 1 1 A 101 101 ALA H H 101 7.824 7.958 -0.134 1
1 1190 . 5 1 1 A 101 101 ALA HA H 101 4.221 4.037 0.184 1
1 1194 . 5 1 1 A 101 101 ALA C C 101 175.639 178.965 -3.326 1
1 1195 . 5 1 1 A 101 101 ALA CA C 101 52.745 54.361 -1.616 1
1 1196 . 5 1 1 A 101 101 ALA CB C 101 19.437 18.356 1.081 1
1 1197 . 5 1 1 A 101 101 ALA N N 101 123.241 124.530 -1.289 1
1 1198 . 5 1 1 A 102 102 ASN H H 102 8.191 8.299 -0.108 1
1 1199 . 5 1 1 A 102 102 ASN HA H 102 4.658 4.754 -0.096 1
1 1204 . 5 1 1 A 102 102 ASN C C 102 173.337 175.669 -2.332 1
1 1205 . 5 1 1 A 102 102 ASN CA C 102 53.374 55.075 -1.701 1
1 1206 . 5 1 1 A 102 102 ASN CB C 102 38.819 39.610 -0.791 1
1 1207 . 5 1 1 A 102 102 ASN N N 102 116.572 114.096 2.476 1
1 1209 . 5 1 1 A 103 103 LEU H H 103 8.065 7.587 0.478 1
1 1210 . 5 1 1 A 103 103 LEU HA H 103 4.363 4.660 -0.297 1
1 1219 . 5 1 1 A 103 103 LEU C C 103 175.637 174.727 0.910 1
1 1220 . 5 1 1 A 103 103 LEU CA C 103 55.292 53.626 1.666 1
1 1221 . 5 1 1 A 103 103 LEU CB C 103 42.433 44.997 -2.564 1
1 1222 . 5 1 1 A 103 103 LEU N N 103 122.074 114.974 7.100 1
1 1223 . 5 1 1 A 104 104 VAL H H 104 8.055 8.994 -0.939 1
1 1224 . 5 1 1 A 104 104 VAL HA H 104 4.131 5.214 -1.083 1
1 1232 . 5 1 1 A 104 104 VAL C C 104 174.364 175.110 -0.746 1
1 1233 . 5 1 1 A 104 104 VAL CA C 104 62.552 60.654 1.898 1
1 1234 . 5 1 1 A 104 104 VAL CB C 104 32.766 33.505 -0.739 1
1 1235 . 5 1 1 A 104 104 VAL N N 104 120.606 122.383 -1.777 1
1 1236 . 5 1 1 A 105 105 CYS H H 105 8.392 8.644 -0.252 1
1 1237 . 5 1 1 A 105 105 CYS HA H 105 4.535 4.764 -0.229 1
1 1240 . 5 1 1 A 105 105 CYS C C 105 172.593 176.249 -3.656 1
1 1241 . 5 1 1 A 105 105 CYS CA C 105 58.449 59.863 -1.414 1
1 1242 . 5 1 1 A 105 105 CYS CB C 105 27.952 30.433 -2.481 1
1 1243 . 5 1 1 A 105 105 CYS N N 105 122.791 129.292 -6.501 1
1 1244 . 5 1 1 A 106 106 ASN H H 106 8.575 8.226 0.349 1
1 1245 . 5 1 1 A 106 106 ASN HA H 106 4.843 4.705 0.138 1
1 1250 . 5 1 1 A 106 106 ASN C C 106 173.594 177.789 -4.195 1
1 1251 . 5 1 1 A 106 106 ASN CA C 106 53.337 55.666 -2.329 1
1 1252 . 5 1 1 A 106 106 ASN CB C 106 39.088 38.699 0.389 1
1 1253 . 5 1 1 A 106 106 ASN N N 106 122.001 116.997 5.004 1
1 1255 . 5 1 1 A 107 107 THR H H 107 8.090 8.091 -0.001 1
1 1256 . 5 1 1 A 107 107 THR HA H 107 4.348 4.496 -0.148 1
1 1261 . 5 1 1 A 107 107 THR C C 107 172.516 175.747 -3.231 1
1 1262 . 5 1 1 A 107 107 THR CA C 107 61.803 63.504 -1.701 1
1 1263 . 5 1 1 A 107 107 THR CB C 107 69.812 68.821 0.991 1
1 1265 . 5 1 1 A 107 107 THR N N 107 114.374 114.376 -0.002 1
1 1266 . 5 1 1 A 108 108 ARG H H 108 8.322 8.012 0.310 1
1 1267 . 5 1 1 A 108 108 ARG HA H 108 4.634 4.172 0.462 1
1 1274 . 5 1 1 A 108 108 ARG C C 108 172.608 177.282 -4.674 1
1 1275 . 5 1 1 A 108 108 ARG CA C 108 54.026 61.163 -7.137 1
1 1276 . 5 1 1 A 108 108 ARG CB C 108 30.246 29.076 1.170 1
1 1278 . 5 1 1 A 108 108 ARG N N 108 124.017 121.914 2.103 1
1 1279 . 5 1 1 A 109 109 PRO HA H 109 4.354 4.486 -0.132 1
1 1286 . 5 1 1 A 109 109 PRO C C 109 174.978 178.120 -3.142 1
1 1287 . 5 1 1 A 109 109 PRO CA C 109 63.396 64.021 -0.625 1
1 1288 . 5 1 1 A 109 109 PRO CB C 109 32.046 32.193 -0.147 1
1 1290 . 5 1 1 A 110 110 PHE H H 110 8.123 7.582 0.541 1
1 1291 . 5 1 1 A 110 110 PHE HA H 110 4.619 4.519 0.100 1
1 1296 . 5 1 1 A 110 110 PHE C C 110 173.856 177.063 -3.207 1
1 1297 . 5 1 1 A 110 110 PHE CA C 110 57.353 62.164 -4.811 1
1 1298 . 5 1 1 A 110 110 PHE CB C 110 39.364 39.197 0.167 1
1 1301 . 5 1 1 A 110 110 PHE N N 110 119.265 120.084 -0.819 1
1 1302 . 5 1 1 A 111 111 ASP H H 111 8.161 8.564 -0.403 1
1 1303 . 5 1 1 A 111 111 ASP HA H 111 4.613 4.422 0.191 1
1 1306 . 5 1 1 A 111 111 ASP C C 111 174.114 178.722 -4.608 1
1 1307 . 5 1 1 A 111 111 ASP CA C 111 54.350 57.438 -3.088 1
1 1308 . 5 1 1 A 111 111 ASP CB C 111 41.413 40.037 1.376 1
1 1309 . 5 1 1 A 111 111 ASP N N 111 121.764 119.231 2.533 1
1 1310 . 5 1 1 A 112 112 ASN H H 112 8.307 8.342 -0.035 1
1 1311 . 5 1 1 A 112 112 ASN HA H 112 4.662 4.484 0.178 1
1 1316 . 5 1 1 A 112 112 ASN C C 112 173.595 177.925 -4.330 1
1 1317 . 5 1 1 A 112 112 ASN CA C 112 53.486 56.839 -3.353 1
1 1318 . 5 1 1 A 112 112 ASN CB C 112 39.225 38.937 0.288 1
1 1319 . 5 1 1 A 112 112 ASN N N 112 119.154 117.534 1.620 1
1 1321 . 5 1 1 A 113 113 GLU H H 113 8.404 8.266 0.138 1
1 1322 . 5 1 1 A 113 113 GLU HA H 113 4.264 4.138 0.126 1
1 1327 . 5 1 1 A 113 113 GLU C C 113 174.886 179.863 -4.977 1
1 1328 . 5 1 1 A 113 113 GLU CA C 113 56.681 59.172 -2.491 1
1 1329 . 5 1 1 A 113 113 GLU CB C 113 30.403 29.438 0.965 1
1 1331 . 5 1 1 A 113 113 GLU N N 113 120.943 118.835 2.108 1
1 1332 . 5 1 1 A 114 114 GLU H H 114 8.388 8.044 0.344 1
1 1333 . 5 1 1 A 114 114 GLU HA H 114 4.262 4.217 0.045 1
1 1338 . 5 1 1 A 114 114 GLU C C 114 174.819 177.173 -2.354 1
1 1339 . 5 1 1 A 114 114 GLU CA C 114 56.769 59.084 -2.315 1
1 1340 . 5 1 1 A 114 114 GLU CB C 114 30.125 29.728 0.397 1
1 1342 . 5 1 1 A 114 114 GLU N N 114 121.869 119.521 2.348 1
1 1343 . 5 1 1 A 115 115 LYS H H 115 8.236 7.891 0.345 1
1 1344 . 5 1 1 A 115 115 LYS HA H 115 4.347 4.628 -0.281 1
1 1353 . 5 1 1 A 115 115 LYS C C 115 174.633 176.644 -2.011 1
1 1354 . 5 1 1 A 115 115 LYS CA C 115 56.426 55.197 1.229 1
1 1355 . 5 1 1 A 115 115 LYS CB C 115 33.277 32.987 0.290 1
1 1359 . 5 1 1 A 115 115 LYS N N 115 121.997 118.106 3.891 1
1 1360 . 5 1 1 A 116 116 ASP H H 116 8.386 8.090 0.296 1
1 1361 . 5 1 1 A 116 116 ASP HA H 116 4.600 4.378 0.222 1
1 1364 . 5 1 1 A 116 116 ASP C C 116 173.448 175.869 -2.421 1
1 1365 . 5 1 1 A 116 116 ASP CA C 116 54.773 56.779 -2.006 1
1 1366 . 5 1 1 A 116 116 ASP CB C 116 41.029 41.480 -0.451 1
1 1367 . 5 1 1 A 116 116 ASP N N 116 121.057 121.088 -0.031 1
1 5 . 6 1 1 A 2 2 MET HA H 2 4.534 4.201 0.333 1
1 13 . 6 1 1 A 2 2 MET C C 2 174.355 177.955 -3.600 1
1 14 . 6 1 1 A 2 2 MET CA C 2 56.247 58.128 -1.881 1
1 15 . 6 1 1 A 2 2 MET CB C 2 32.855 32.044 0.811 1
1 18 . 6 1 1 A 3 3 ASN H H 3 8.600 7.945 0.655 1
1 19 . 6 1 1 A 3 3 ASN HA H 3 4.711 4.528 0.183 1
1 24 . 6 1 1 A 3 3 ASN C C 3 173.983 177.465 -3.482 1
1 25 . 6 1 1 A 3 3 ASN CA C 3 53.650 56.417 -2.767 1
1 26 . 6 1 1 A 3 3 ASN CB C 3 38.624 39.665 -1.041 1
1 27 . 6 1 1 A 3 3 ASN N N 3 120.149 118.063 2.086 1
1 29 . 6 1 1 A 4 4 GLU H H 4 8.495 8.080 0.415 1
1 30 . 6 1 1 A 4 4 GLU HA H 4 4.235 4.040 0.195 1
1 35 . 6 1 1 A 4 4 GLU C C 4 175.752 179.117 -3.365 1
1 36 . 6 1 1 A 4 4 GLU CA C 4 58.075 59.114 -1.039 1
1 37 . 6 1 1 A 4 4 GLU CB C 4 30.125 29.374 0.751 1
1 38 . 6 1 1 A 4 4 GLU N N 4 121.543 118.809 2.734 1
1 39 . 6 1 1 A 5 5 LEU HA H 5 4.073 4.151 -0.078 1
1 47 . 6 1 1 A 5 5 LEU CB C 5 41.897 41.630 0.267 1
1 50 . 6 1 1 A 6 6 GLU H H 6 8.332 8.253 0.079 1
1 51 . 6 1 1 A 6 6 GLU HA H 6 3.621 4.175 -0.554 1
1 52 . 6 1 1 A 6 6 GLU C C 6 176.402 178.812 -2.410 1
1 53 . 6 1 1 A 6 6 GLU CA C 6 58.461 58.596 -0.135 1
1 54 . 6 1 1 A 6 6 GLU CB C 6 29.730 29.826 -0.096 1
1 55 . 6 1 1 A 6 6 GLU N N 6 121.462 118.781 2.681 1
1 56 . 6 1 1 A 7 7 ALA H H 7 8.244 7.761 0.483 1
1 57 . 6 1 1 A 7 7 ALA HA H 7 4.185 4.098 0.087 1
1 61 . 6 1 1 A 7 7 ALA C C 7 177.982 178.500 -0.518 1
1 62 . 6 1 1 A 7 7 ALA CA C 7 54.791 55.239 -0.448 1
1 63 . 6 1 1 A 7 7 ALA CB C 7 18.836 18.985 -0.149 1
1 64 . 6 1 1 A 7 7 ALA N N 7 123.078 122.165 0.913 1
1 65 . 6 1 1 A 8 8 GLN H H 8 8.274 7.856 0.418 1
1 66 . 6 1 1 A 8 8 GLN HA H 8 4.219 4.414 -0.195 1
1 73 . 6 1 1 A 8 8 GLN C C 8 176.325 175.479 0.846 1
1 74 . 6 1 1 A 8 8 GLN CA C 8 57.864 55.809 2.055 1
1 75 . 6 1 1 A 8 8 GLN CB C 8 28.768 28.866 -0.098 1
1 77 . 6 1 1 A 8 8 GLN N N 8 117.452 116.593 0.859 1
1 79 . 6 1 1 A 9 9 THR H H 9 8.043 8.612 -0.569 1
1 80 . 6 1 1 A 9 9 THR HA H 9 3.998 4.636 -0.638 1
1 85 . 6 1 1 A 9 9 THR C C 9 173.904 175.021 -1.117 1
1 86 . 6 1 1 A 9 9 THR CA C 9 65.435 61.822 3.613 1
1 87 . 6 1 1 A 9 9 THR CB C 9 68.870 69.780 -0.910 1
1 89 . 6 1 1 A 9 9 THR N N 9 116.135 119.258 -3.123 1
1 90 . 6 1 1 A 10 10 ARG H H 10 8.095 8.969 -0.874 1
1 91 . 6 1 1 A 10 10 ARG HA H 10 4.040 3.971 0.069 1
1 98 . 6 1 1 A 10 10 ARG C C 10 176.583 175.516 1.067 1
1 99 . 6 1 1 A 10 10 ARG CA C 10 59.262 57.407 1.855 1
1 100 . 6 1 1 A 10 10 ARG CB C 10 29.900 27.511 2.389 1
1 101 . 6 1 1 A 10 10 ARG N N 10 121.157 122.390 -1.233 1
1 102 . 6 1 1 A 11 11 VAL H H 11 7.657 7.834 -0.177 1
1 103 . 6 1 1 A 11 11 VAL HA H 11 3.769 4.412 -0.643 1
1 111 . 6 1 1 A 11 11 VAL C C 11 176.662 177.889 -1.227 1
1 112 . 6 1 1 A 11 11 VAL CA C 11 65.914 63.631 2.283 1
1 113 . 6 1 1 A 11 11 VAL CB C 11 31.745 33.494 -1.749 1
1 114 . 6 1 1 A 11 11 VAL N N 11 118.580 117.864 0.716 1
1 115 . 6 1 1 A 12 12 LYS H H 12 7.471 7.847 -0.376 1
1 116 . 6 1 1 A 12 12 LYS HA H 12 3.366 4.442 -1.076 1
1 123 . 6 1 1 A 12 12 LYS C C 12 176.457 179.225 -2.768 1
1 124 . 6 1 1 A 12 12 LYS CA C 12 59.545 58.520 1.025 1
1 125 . 6 1 1 A 12 12 LYS CB C 12 32.206 32.629 -0.423 1
1 126 . 6 1 1 A 12 12 LYS N N 12 121.835 122.279 -0.444 1
1 127 . 6 1 1 A 13 13 LEU H H 13 8.144 8.131 0.013 1
1 128 . 6 1 1 A 13 13 LEU HA H 13 4.093 4.092 0.001 1
1 137 . 6 1 1 A 13 13 LEU C C 13 178.254 179.136 -0.882 1
1 138 . 6 1 1 A 13 13 LEU CA C 13 58.023 57.999 0.024 1
1 139 . 6 1 1 A 13 13 LEU CB C 13 41.283 41.280 0.003 1
1 140 . 6 1 1 A 13 13 LEU N N 13 118.688 120.635 -1.947 1
1 141 . 6 1 1 A 14 14 ASN H H 14 8.384 8.458 -0.074 1
1 142 . 6 1 1 A 14 14 ASN HA H 14 4.567 4.427 0.140 1
1 147 . 6 1 1 A 14 14 ASN C C 14 175.397 177.596 -2.199 1
1 148 . 6 1 1 A 14 14 ASN CA C 14 56.239 56.598 -0.359 1
1 149 . 6 1 1 A 14 14 ASN CB C 14 38.432 38.305 0.127 1
1 150 . 6 1 1 A 14 14 ASN N N 14 118.175 117.557 0.618 1
1 152 . 6 1 1 A 15 15 TYR H H 15 7.982 7.771 0.211 1
1 153 . 6 1 1 A 15 15 TYR HA H 15 4.249 4.118 0.131 1
1 160 . 6 1 1 A 15 15 TYR C C 15 175.503 177.631 -2.128 1
1 161 . 6 1 1 A 15 15 TYR CA C 15 62.450 61.664 0.786 1
1 162 . 6 1 1 A 15 15 TYR CB C 15 39.399 38.536 0.863 1
1 163 . 6 1 1 A 15 15 TYR N N 15 121.955 123.005 -1.050 1
1 164 . 6 1 1 A 16 16 LEU H H 16 8.198 8.533 -0.335 1
1 165 . 6 1 1 A 16 16 LEU HA H 16 4.470 3.951 0.519 1
1 175 . 6 1 1 A 16 16 LEU C C 16 177.125 178.075 -0.950 1
1 176 . 6 1 1 A 16 16 LEU CA C 16 57.374 58.277 -0.903 1
1 177 . 6 1 1 A 16 16 LEU CB C 16 41.443 41.610 -0.167 1
1 178 . 6 1 1 A 16 16 LEU N N 16 117.642 120.881 -3.239 1
1 179 . 6 1 1 A 17 17 ASP H H 17 8.061 8.155 -0.094 1
1 180 . 6 1 1 A 17 17 ASP C C 17 177.836 177.979 -0.143 1
1 181 . 6 1 1 A 17 17 ASP CA C 17 57.486 57.490 -0.004 1
1 182 . 6 1 1 A 17 17 ASP CB C 17 41.433 41.749 -0.316 1
1 183 . 6 1 1 A 17 17 ASP N N 17 118.700 118.697 0.003 1
1 184 . 6 1 1 A 18 18 GLN H H 18 8.111 7.788 0.323 1
1 185 . 6 1 1 A 18 18 GLN HA H 18 4.002 4.036 -0.034 1
1 190 . 6 1 1 A 18 18 GLN CA C 18 59.046 58.720 0.326 1
1 191 . 6 1 1 A 18 18 GLN CB C 18 28.700 29.088 -0.388 1
1 193 . 6 1 1 A 18 18 GLN N N 18 119.539 118.479 1.060 1
1 195 . 6 1 1 A 19 19 ILE H H 19 8.330 8.233 0.097 1
1 196 . 6 1 1 A 19 19 ILE HA H 19 3.306 3.905 -0.599 1
1 204 . 6 1 1 A 19 19 ILE C C 19 175.608 177.540 -1.932 1
1 205 . 6 1 1 A 19 19 ILE CA C 19 64.760 63.812 0.948 1
1 206 . 6 1 1 A 19 19 ILE CB C 19 37.148 36.742 0.406 1
1 209 . 6 1 1 A 19 19 ILE N N 19 121.490 119.917 1.573 1
1 210 . 6 1 1 A 20 20 ALA H H 20 8.057 8.286 -0.229 1
1 211 . 6 1 1 A 20 20 ALA HA H 20 4.349 4.081 0.268 1
1 215 . 6 1 1 A 20 20 ALA C C 20 179.297 179.805 -0.508 1
1 216 . 6 1 1 A 20 20 ALA CA C 20 56.150 55.603 0.547 1
1 217 . 6 1 1 A 20 20 ALA CB C 20 18.104 18.443 -0.339 1
1 218 . 6 1 1 A 20 20 ALA N N 20 124.441 123.530 0.911 1
1 219 . 6 1 1 A 21 21 LYS H H 21 8.116 8.132 -0.016 1
1 220 . 6 1 1 A 21 21 LYS HA H 21 4.108 4.075 0.033 1
1 229 . 6 1 1 A 21 21 LYS C C 21 176.720 178.415 -1.695 1
1 230 . 6 1 1 A 21 21 LYS CA C 21 59.166 58.703 0.463 1
1 231 . 6 1 1 A 21 21 LYS CB C 21 32.085 32.147 -0.062 1
1 233 . 6 1 1 A 21 21 LYS N N 21 119.865 117.068 2.797 1
1 234 . 6 1 1 A 22 22 PHE H H 22 7.875 8.128 -0.253 1
1 235 . 6 1 1 A 22 22 PHE HA H 22 4.012 4.143 -0.131 1
1 242 . 6 1 1 A 22 22 PHE C C 22 175.545 177.596 -2.051 1
1 243 . 6 1 1 A 22 22 PHE CA C 22 61.070 61.401 -0.331 1
1 244 . 6 1 1 A 22 22 PHE CB C 22 39.072 39.327 -0.255 1
1 249 . 6 1 1 A 22 22 PHE N N 22 119.729 121.515 -1.786 1
1 250 . 6 1 1 A 23 23 TRP H H 23 7.841 7.592 0.249 1
1 251 . 6 1 1 A 23 23 TRP HA H 23 4.149 4.016 0.133 1
1 260 . 6 1 1 A 23 23 TRP C C 23 176.668 178.199 -1.531 1
1 261 . 6 1 1 A 23 23 TRP CB C 23 28.543 29.628 -1.085 1
1 267 . 6 1 1 A 23 23 TRP N N 23 119.440 120.752 -1.312 1
1 269 . 6 1 1 A 24 24 GLU H H 24 8.261 8.618 -0.357 1
1 270 . 6 1 1 A 24 24 GLU HA H 24 4.265 4.237 0.028 1
1 275 . 6 1 1 A 24 24 GLU C C 24 179.679 177.515 2.164 1
1 276 . 6 1 1 A 24 24 GLU CA C 24 59.706 58.770 0.936 1
1 277 . 6 1 1 A 24 24 GLU CB C 24 29.720 29.301 0.419 1
1 279 . 6 1 1 A 24 24 GLU N N 24 121.376 118.840 2.536 1
1 280 . 6 1 1 A 25 25 ILE H H 25 8.071 7.524 0.547 1
1 281 . 6 1 1 A 25 25 ILE HA H 25 3.815 4.084 -0.269 1
1 291 . 6 1 1 A 25 25 ILE C C 25 176.343 177.162 -0.819 1
1 292 . 6 1 1 A 25 25 ILE CA C 25 64.464 61.381 3.083 1
1 293 . 6 1 1 A 25 25 ILE CB C 25 37.371 38.381 -1.010 1
1 296 . 6 1 1 A 25 25 ILE N N 25 121.499 117.854 3.645 1
1 297 . 6 1 1 A 26 26 GLN H H 26 7.327 7.275 0.052 1
1 298 . 6 1 1 A 26 26 GLN HA H 26 4.074 3.881 0.193 1
1 305 . 6 1 1 A 26 26 GLN C C 26 174.906 175.722 -0.816 1
1 306 . 6 1 1 A 26 26 GLN CA C 26 55.450 57.418 -1.968 1
1 307 . 6 1 1 A 26 26 GLN CB C 26 28.458 28.671 -0.213 1
1 309 . 6 1 1 A 26 26 GLN N N 26 116.532 120.874 -4.342 1
1 311 . 6 1 1 A 27 27 GLY H H 27 7.861 7.941 -0.080 1
1 312 . 6 1 1 A 27 27 GLY HA2 H 27 4.297 3.877 0.420 1
1 313 . 6 1 1 A 27 27 GLY HA3 H 27 3.823 3.882 -0.059 1
1 314 . 6 1 1 A 27 27 GLY C C 27 172.698 173.237 -0.539 1
1 315 . 6 1 1 A 27 27 GLY CA C 27 45.608 44.893 0.715 1
1 316 . 6 1 1 A 27 27 GLY N N 27 106.837 107.621 -0.784 1
1 317 . 6 1 1 A 28 28 SER H H 28 8.083 7.394 0.689 1
1 318 . 6 1 1 A 28 28 SER HA H 28 4.777 4.685 0.092 1
1 321 . 6 1 1 A 28 28 SER C C 28 171.196 172.289 -1.093 1
1 322 . 6 1 1 A 28 28 SER CA C 28 56.041 57.133 -1.092 1
1 323 . 6 1 1 A 28 28 SER CB C 28 64.539 66.626 -2.087 1
1 324 . 6 1 1 A 28 28 SER N N 28 116.151 114.596 1.555 1
1 325 . 6 1 1 A 29 29 SER H H 29 8.354 8.346 0.008 1
1 326 . 6 1 1 A 29 29 SER HA H 29 4.389 5.043 -0.654 1
1 329 . 6 1 1 A 29 29 SER C C 29 172.166 173.667 -1.501 1
1 330 . 6 1 1 A 29 29 SER CA C 29 58.107 55.590 2.517 1
1 331 . 6 1 1 A 29 29 SER CB C 29 63.853 65.122 -1.269 1
1 332 . 6 1 1 A 29 29 SER N N 29 116.596 115.700 0.896 1
1 333 . 6 1 1 A 30 30 LEU H H 30 8.990 8.477 0.513 1
1 334 . 6 1 1 A 30 30 LEU HA H 30 3.964 5.022 -1.058 1
1 344 . 6 1 1 A 30 30 LEU C C 30 173.752 175.647 -1.895 1
1 345 . 6 1 1 A 30 30 LEU CA C 30 55.193 55.416 -0.223 1
1 346 . 6 1 1 A 30 30 LEU CB C 30 42.869 43.005 -0.136 1
1 349 . 6 1 1 A 30 30 LEU N N 30 125.860 126.663 -0.803 1
1 350 . 6 1 1 A 31 31 LYS H H 31 8.118 8.824 -0.706 1
1 351 . 6 1 1 A 31 31 LYS HA H 31 4.498 4.978 -0.480 1
1 360 . 6 1 1 A 31 31 LYS C C 31 173.555 174.240 -0.685 1
1 361 . 6 1 1 A 31 31 LYS CA C 31 54.372 55.012 -0.640 1
1 362 . 6 1 1 A 31 31 LYS CB C 31 32.814 35.394 -2.580 1
1 365 . 6 1 1 A 31 31 LYS N N 31 129.965 126.750 3.215 1
1 366 . 6 1 1 A 32 32 ILE H H 32 8.717 8.689 0.028 1
1 367 . 6 1 1 A 32 32 ILE HA H 32 4.011 4.662 -0.651 1
1 377 . 6 1 1 A 32 32 ILE C C 32 173.038 174.130 -1.092 1
1 378 . 6 1 1 A 32 32 ILE CA C 32 59.921 57.971 1.950 1
1 379 . 6 1 1 A 32 32 ILE CB C 32 38.139 38.545 -0.406 1
1 382 . 6 1 1 A 32 32 ILE N N 32 127.091 122.838 4.253 1
1 383 . 6 1 1 A 33 33 PRO HA H 33 4.412 4.551 -0.139 1
1 390 . 6 1 1 A 33 33 PRO C C 33 172.724 175.226 -2.502 1
1 391 . 6 1 1 A 33 33 PRO CA C 33 62.565 62.275 0.290 1
1 392 . 6 1 1 A 33 33 PRO CB C 33 32.728 33.059 -0.331 1
1 394 . 6 1 1 A 34 34 ASN H H 34 8.265 8.415 -0.150 1
1 395 . 6 1 1 A 34 34 ASN HA H 34 5.147 5.441 -0.294 1
1 400 . 6 1 1 A 34 34 ASN C C 34 174.079 174.322 -0.243 1
1 401 . 6 1 1 A 34 34 ASN CA C 34 52.088 51.729 0.359 1
1 402 . 6 1 1 A 34 34 ASN CB C 34 40.387 42.009 -1.622 1
1 403 . 6 1 1 A 34 34 ASN N N 34 116.424 117.577 -1.153 1
1 405 . 6 1 1 A 35 35 VAL H H 35 8.904 9.050 -0.146 1
1 406 . 6 1 1 A 35 35 VAL HA H 35 4.159 4.507 -0.348 1
1 414 . 6 1 1 A 35 35 VAL C C 35 173.834 174.961 -1.127 1
1 415 . 6 1 1 A 35 35 VAL CA C 35 61.953 60.054 1.899 1
1 416 . 6 1 1 A 35 35 VAL CB C 35 34.432 34.937 -0.505 1
1 419 . 6 1 1 A 35 35 VAL N N 35 122.778 120.497 2.281 1
1 420 . 6 1 1 A 36 36 GLU H H 36 9.560 9.577 -0.017 1
1 421 . 6 1 1 A 36 36 GLU HA H 36 3.819 4.045 -0.226 1
1 426 . 6 1 1 A 36 36 GLU C C 36 173.604 175.808 -2.204 1
1 427 . 6 1 1 A 36 36 GLU CA C 36 57.131 58.074 -0.943 1
1 428 . 6 1 1 A 36 36 GLU CB C 36 27.464 28.141 -0.677 1
1 430 . 6 1 1 A 36 36 GLU N N 36 127.014 129.796 -2.782 1
1 431 . 6 1 1 A 37 37 ARG H H 37 8.578 8.509 0.069 1
1 432 . 6 1 1 A 37 37 ARG HA H 37 3.792 3.962 -0.170 1
1 439 . 6 1 1 A 37 37 ARG C C 37 173.371 174.327 -0.956 1
1 440 . 6 1 1 A 37 37 ARG CA C 37 57.952 57.626 0.326 1
1 441 . 6 1 1 A 37 37 ARG CB C 37 27.657 27.429 0.228 1
1 443 . 6 1 1 A 37 37 ARG N N 37 108.362 110.785 -2.423 1
1 444 . 6 1 1 A 38 38 ARG H H 38 7.696 7.967 -0.271 1
1 445 . 6 1 1 A 38 38 ARG HA H 38 4.743 4.942 -0.199 1
1 452 . 6 1 1 A 38 38 ARG C C 38 173.513 175.407 -1.894 1
1 453 . 6 1 1 A 38 38 ARG CA C 38 54.507 54.479 0.028 1
1 454 . 6 1 1 A 38 38 ARG CB C 38 33.751 33.074 0.677 1
1 456 . 6 1 1 A 38 38 ARG N N 38 118.370 118.994 -0.624 1
1 457 . 6 1 1 A 39 39 ILE H H 39 8.463 8.571 -0.108 1
1 458 . 6 1 1 A 39 39 ILE HA H 39 4.184 4.258 -0.074 1
1 468 . 6 1 1 A 39 39 ILE C C 39 175.150 175.784 -0.634 1
1 469 . 6 1 1 A 39 39 ILE CA C 39 62.076 61.745 0.331 1
1 470 . 6 1 1 A 39 39 ILE CB C 39 38.864 39.357 -0.493 1
1 473 . 6 1 1 A 39 39 ILE N N 39 123.604 127.308 -3.704 1
1 474 . 6 1 1 A 40 40 LEU H H 40 8.239 8.252 -0.013 1
1 475 . 6 1 1 A 40 40 LEU HA H 40 4.259 4.490 -0.231 1
1 485 . 6 1 1 A 40 40 LEU C C 40 173.152 174.716 -1.564 1
1 486 . 6 1 1 A 40 40 LEU CA C 40 55.305 54.805 0.500 1
1 487 . 6 1 1 A 40 40 LEU CB C 40 43.113 41.870 1.243 1
1 490 . 6 1 1 A 40 40 LEU N N 40 129.550 128.810 0.740 1
1 491 . 6 1 1 A 41 41 ASP H H 41 8.992 8.860 0.132 1
1 492 . 6 1 1 A 41 41 ASP HA H 41 4.798 4.809 -0.011 1
1 495 . 6 1 1 A 41 41 ASP C C 41 173.837 175.871 -2.034 1
1 496 . 6 1 1 A 41 41 ASP CA C 41 52.077 53.485 -1.408 1
1 497 . 6 1 1 A 41 41 ASP CB C 41 39.454 38.894 0.560 1
1 498 . 6 1 1 A 41 41 ASP N N 41 127.022 126.903 0.119 1
1 499 . 6 1 1 A 42 42 LEU H H 42 7.912 8.279 -0.367 1
1 500 . 6 1 1 A 42 42 LEU HA H 42 3.970 4.066 -0.096 1
1 510 . 6 1 1 A 42 42 LEU C C 42 176.305 178.080 -1.775 1
1 511 . 6 1 1 A 42 42 LEU CA C 42 58.128 58.027 0.101 1
1 512 . 6 1 1 A 42 42 LEU CB C 42 43.043 41.572 1.471 1
1 514 . 6 1 1 A 42 42 LEU N N 42 125.064 125.306 -0.242 1
1 515 . 6 1 1 A 43 43 TYR H H 43 8.565 8.168 0.397 1
1 516 . 6 1 1 A 43 43 TYR HA H 43 3.728 3.921 -0.193 1
1 523 . 6 1 1 A 43 43 TYR C C 43 175.757 177.227 -1.470 1
1 524 . 6 1 1 A 43 43 TYR CA C 43 61.774 61.915 -0.141 1
1 525 . 6 1 1 A 43 43 TYR CB C 43 38.235 38.647 -0.412 1
1 528 . 6 1 1 A 43 43 TYR N N 43 117.822 119.970 -2.148 1
1 529 . 6 1 1 A 44 44 SER H H 44 8.115 8.148 -0.033 1
1 530 . 6 1 1 A 44 44 SER HA H 44 3.854 4.251 -0.397 1
1 533 . 6 1 1 A 44 44 SER C C 44 174.080 177.297 -3.217 1
1 534 . 6 1 1 A 44 44 SER CA C 44 61.873 61.217 0.656 1
1 535 . 6 1 1 A 44 44 SER CB C 44 64.350 62.908 1.442 1
1 536 . 6 1 1 A 44 44 SER N N 44 116.835 113.895 2.940 1
1 537 . 6 1 1 A 45 45 LEU H H 45 8.401 8.259 0.142 1
1 538 . 6 1 1 A 45 45 LEU HA H 45 4.102 4.213 -0.111 1
1 548 . 6 1 1 A 45 45 LEU C C 45 175.081 178.780 -3.699 1
1 549 . 6 1 1 A 45 45 LEU CA C 45 58.896 57.978 0.918 1
1 550 . 6 1 1 A 45 45 LEU CB C 45 41.741 41.717 0.024 1
1 553 . 6 1 1 A 45 45 LEU N N 45 120.621 123.412 -2.791 1
1 554 . 6 1 1 A 46 46 SER H H 46 8.110 8.462 -0.352 1
1 555 . 6 1 1 A 46 46 SER HA H 46 4.300 4.210 0.090 1
1 558 . 6 1 1 A 46 46 SER C C 46 175.019 176.700 -1.681 1
1 559 . 6 1 1 A 46 46 SER CA C 46 62.610 61.596 1.014 1
1 560 . 6 1 1 A 46 46 SER CB C 46 64.092 63.106 0.986 1
1 561 . 6 1 1 A 46 46 SER N N 46 112.826 114.994 -2.168 1
1 562 . 6 1 1 A 47 47 LYS H H 47 7.732 8.011 -0.279 1
1 563 . 6 1 1 A 47 47 LYS HA H 47 3.900 4.127 -0.227 1
1 572 . 6 1 1 A 47 47 LYS C C 47 177.441 179.079 -1.638 1
1 573 . 6 1 1 A 47 47 LYS CA C 47 58.575 59.015 -0.440 1
1 574 . 6 1 1 A 47 47 LYS CB C 47 32.351 32.282 0.069 1
1 576 . 6 1 1 A 47 47 LYS N N 47 121.210 118.892 2.318 1
1 577 . 6 1 1 A 48 48 ILE H H 48 8.672 8.038 0.634 1
1 578 . 6 1 1 A 48 48 ILE HA H 48 3.628 3.752 -0.124 1
1 588 . 6 1 1 A 48 48 ILE C C 48 175.861 178.011 -2.150 1
1 589 . 6 1 1 A 48 48 ILE CA C 48 64.188 65.561 -1.373 1
1 590 . 6 1 1 A 48 48 ILE CB C 48 37.954 37.973 -0.019 1
1 593 . 6 1 1 A 48 48 ILE N N 48 120.810 121.140 -0.330 1
1 594 . 6 1 1 A 49 49 VAL H H 49 8.030 8.198 -0.168 1
1 595 . 6 1 1 A 49 49 VAL HA H 49 3.195 3.691 -0.496 1
1 603 . 6 1 1 A 49 49 VAL C C 49 176.513 178.662 -2.149 1
1 604 . 6 1 1 A 49 49 VAL CA C 49 66.760 66.932 -0.172 1
1 605 . 6 1 1 A 49 49 VAL CB C 49 30.935 31.892 -0.957 1
1 608 . 6 1 1 A 49 49 VAL N N 49 119.350 119.895 -0.545 1
1 609 . 6 1 1 A 50 50 VAL H H 50 7.336 8.289 -0.953 1
1 610 . 6 1 1 A 50 50 VAL HA H 50 3.497 3.555 -0.058 1
1 618 . 6 1 1 A 50 50 VAL C C 50 178.745 177.972 0.773 1
1 619 . 6 1 1 A 50 50 VAL CA C 50 67.384 66.731 0.653 1
1 620 . 6 1 1 A 50 50 VAL CB C 50 31.832 31.404 0.428 1
1 621 . 6 1 1 A 50 50 VAL N N 50 118.610 120.764 -2.154 1
1 622 . 6 1 1 A 51 51 GLU H H 51 8.318 8.533 -0.215 1
1 623 . 6 1 1 A 51 51 GLU HA H 51 3.953 4.113 -0.160 1
1 628 . 6 1 1 A 51 51 GLU C C 51 177.281 178.132 -0.851 1
1 629 . 6 1 1 A 51 51 GLU CA C 51 59.668 59.147 0.521 1
1 630 . 6 1 1 A 51 51 GLU CB C 51 30.131 29.116 1.015 1
1 632 . 6 1 1 A 51 51 GLU N N 51 122.096 118.630 3.466 1
1 633 . 6 1 1 A 52 52 GLU H H 52 8.065 8.011 0.054 1
1 634 . 6 1 1 A 52 52 GLU HA H 52 4.229 4.312 -0.083 1
1 639 . 6 1 1 A 52 52 GLU C C 52 173.534 176.690 -3.156 1
1 640 . 6 1 1 A 52 52 GLU CA C 52 55.547 56.397 -0.850 1
1 641 . 6 1 1 A 52 52 GLU CB C 52 28.716 30.158 -1.442 1
1 643 . 6 1 1 A 52 52 GLU N N 52 114.992 117.721 -2.729 1
1 644 . 6 1 1 A 53 53 GLY H H 53 7.459 9.162 -1.703 1
1 645 . 6 1 1 A 53 53 GLY HA2 H 53 3.630 3.938 -0.308 1
1 646 . 6 1 1 A 53 53 GLY HA3 H 53 3.630 3.956 -0.326 1
1 647 . 6 1 1 A 53 53 GLY C C 53 173.214 173.677 -0.463 1
1 648 . 6 1 1 A 53 53 GLY CA C 53 44.962 45.103 -0.141 1
1 649 . 6 1 1 A 53 53 GLY N N 53 104.909 108.119 -3.210 1
1 650 . 6 1 1 A 54 54 GLY H H 54 8.533 7.395 1.138 1
1 651 . 6 1 1 A 54 54 GLY HA2 H 54 3.548 4.055 -0.507 1
1 652 . 6 1 1 A 54 54 GLY HA3 H 54 4.521 4.108 0.413 1
1 653 . 6 1 1 A 54 54 GLY C C 54 169.966 174.380 -4.414 1
1 654 . 6 1 1 A 54 54 GLY CA C 54 43.988 45.728 -1.740 1
1 655 . 6 1 1 A 54 54 GLY N N 54 110.587 107.969 2.618 1
1 656 . 6 1 1 A 55 55 TYR H H 55 8.704 9.195 -0.491 1
1 657 . 6 1 1 A 55 55 TYR HA H 55 3.618 4.025 -0.407 1
1 664 . 6 1 1 A 55 55 TYR C C 55 174.807 177.025 -2.218 1
1 665 . 6 1 1 A 55 55 TYR CA C 55 62.540 61.631 0.909 1
1 666 . 6 1 1 A 55 55 TYR CB C 55 39.669 39.127 0.542 1
1 669 . 6 1 1 A 55 55 TYR N N 55 119.168 122.499 -3.331 1
1 670 . 6 1 1 A 56 56 GLU H H 56 9.006 8.303 0.703 1
1 671 . 6 1 1 A 56 56 GLU HA H 56 3.638 3.389 0.249 1
1 676 . 6 1 1 A 56 56 GLU C C 56 177.400 178.420 -1.020 1
1 677 . 6 1 1 A 56 56 GLU CA C 56 60.530 59.233 1.297 1
1 678 . 6 1 1 A 56 56 GLU CB C 56 29.168 29.201 -0.033 1
1 679 . 6 1 1 A 56 56 GLU N N 56 118.969 117.498 1.471 1
1 680 . 6 1 1 A 57 57 ALA H H 57 8.235 7.702 0.533 1
1 681 . 6 1 1 A 57 57 ALA HA H 57 3.980 3.991 -0.011 1
1 685 . 6 1 1 A 57 57 ALA C C 57 177.678 179.601 -1.923 1
1 686 . 6 1 1 A 57 57 ALA CA C 57 54.910 55.035 -0.125 1
1 687 . 6 1 1 A 57 57 ALA CB C 57 18.122 18.603 -0.481 1
1 688 . 6 1 1 A 57 57 ALA N N 57 122.860 121.534 1.326 1
1 689 . 6 1 1 A 58 58 ILE H H 58 7.831 7.492 0.339 1
1 690 . 6 1 1 A 58 58 ILE HA H 58 3.189 3.288 -0.099 1
1 700 . 6 1 1 A 58 58 ILE C C 58 177.818 177.234 0.584 1
1 701 . 6 1 1 A 58 58 ILE CA C 58 65.074 64.430 0.644 1
1 702 . 6 1 1 A 58 58 ILE CB C 58 38.178 36.613 1.565 1
1 706 . 6 1 1 A 58 58 ILE N N 58 117.418 116.923 0.495 1
1 707 . 6 1 1 A 59 59 CYS H H 59 7.760 8.074 -0.314 1
1 708 . 6 1 1 A 59 59 CYS HA H 59 4.203 4.210 -0.007 1
1 711 . 6 1 1 A 59 59 CYS C C 59 176.357 177.214 -0.857 1
1 712 . 6 1 1 A 59 59 CYS CA C 59 63.760 62.244 1.516 1
1 713 . 6 1 1 A 59 59 CYS CB C 59 27.638 26.600 1.038 1
1 714 . 6 1 1 A 59 59 CYS N N 59 115.302 120.236 -4.934 1
1 715 . 6 1 1 A 60 60 LYS H H 60 8.350 7.983 0.367 1
1 716 . 6 1 1 A 60 60 LYS HA H 60 3.972 3.991 -0.019 1
1 725 . 6 1 1 A 60 60 LYS C C 60 176.373 178.220 -1.847 1
1 726 . 6 1 1 A 60 60 LYS CA C 60 59.796 59.358 0.438 1
1 727 . 6 1 1 A 60 60 LYS CB C 60 32.560 32.155 0.405 1
1 729 . 6 1 1 A 60 60 LYS N N 60 122.343 119.662 2.681 1
1 730 . 6 1 1 A 61 61 ASP H H 61 8.157 7.983 0.174 1
1 731 . 6 1 1 A 61 61 ASP HA H 61 4.616 4.603 0.013 1
1 734 . 6 1 1 A 61 61 ASP C C 61 173.246 175.321 -2.075 1
1 735 . 6 1 1 A 61 61 ASP CA C 61 54.272 53.556 0.716 1
1 736 . 6 1 1 A 61 61 ASP CB C 61 41.023 40.460 0.563 1
1 737 . 6 1 1 A 61 61 ASP N N 61 116.173 116.704 -0.531 1
1 738 . 6 1 1 A 62 62 ARG H H 62 7.655 7.521 0.134 1
1 739 . 6 1 1 A 62 62 ARG HA H 62 4.149 3.954 0.195 1
1 746 . 6 1 1 A 62 62 ARG C C 62 175.891 176.461 -0.570 1
1 747 . 6 1 1 A 62 62 ARG CA C 62 57.381 56.958 0.423 1
1 748 . 6 1 1 A 62 62 ARG CB C 62 26.538 28.691 -2.153 1
1 750 . 6 1 1 A 62 62 ARG N N 62 117.213 117.314 -0.101 1
1 751 . 6 1 1 A 63 63 ARG H H 63 8.302 7.774 0.528 1
1 752 . 6 1 1 A 63 63 ARG HA H 63 4.240 4.102 0.138 1
1 757 . 6 1 1 A 63 63 ARG C C 63 175.775 178.831 -3.056 1
1 758 . 6 1 1 A 63 63 ARG CA C 63 55.718 58.073 -2.355 1
1 760 . 6 1 1 A 63 63 ARG N N 63 116.292 118.819 -2.527 1
1 761 . 6 1 1 A 64 64 TRP H H 64 8.161 7.491 0.670 1
1 762 . 6 1 1 A 64 64 TRP HA H 64 3.836 4.459 -0.623 1
1 771 . 6 1 1 A 64 64 TRP C C 64 176.862 178.563 -1.701 1
1 772 . 6 1 1 A 64 64 TRP CA C 64 62.036 59.924 2.112 1
1 773 . 6 1 1 A 64 64 TRP CB C 64 27.028 28.904 -1.876 1
1 779 . 6 1 1 A 64 64 TRP N N 64 121.486 119.815 1.671 1
1 781 . 6 1 1 A 65 65 ALA H H 65 8.954 7.766 1.188 1
1 782 . 6 1 1 A 65 65 ALA HA H 65 4.290 4.066 0.224 1
1 786 . 6 1 1 A 65 65 ALA C C 65 178.986 179.910 -0.924 1
1 787 . 6 1 1 A 65 65 ALA CA C 65 55.314 55.465 -0.151 1
1 788 . 6 1 1 A 65 65 ALA CB C 65 18.119 18.056 0.063 1
1 789 . 6 1 1 A 65 65 ALA N N 65 121.559 122.554 -0.995 1
1 790 . 6 1 1 A 66 66 ARG H H 66 7.473 7.684 -0.211 1
1 791 . 6 1 1 A 66 66 ARG HA H 66 4.221 4.204 0.017 1
1 798 . 6 1 1 A 66 66 ARG C C 66 176.670 178.403 -1.733 1
1 799 . 6 1 1 A 66 66 ARG CA C 66 57.871 58.829 -0.958 1
1 800 . 6 1 1 A 66 66 ARG CB C 66 29.097 30.064 -0.967 1
1 801 . 6 1 1 A 66 66 ARG N N 66 119.915 119.456 0.459 1
1 802 . 6 1 1 A 67 67 VAL H H 67 7.134 7.770 -0.636 1
1 803 . 6 1 1 A 67 67 VAL HA H 67 3.304 3.913 -0.609 1
1 811 . 6 1 1 A 67 67 VAL C C 67 175.341 178.076 -2.735 1
1 812 . 6 1 1 A 67 67 VAL CA C 67 66.722 64.075 2.647 1
1 813 . 6 1 1 A 67 67 VAL CB C 67 31.108 31.911 -0.803 1
1 816 . 6 1 1 A 67 67 VAL N N 67 119.970 118.791 1.179 1
1 817 . 6 1 1 A 68 68 ALA H H 68 7.745 8.453 -0.708 1
1 818 . 6 1 1 A 68 68 ALA HA H 68 4.076 4.313 -0.237 1
1 822 . 6 1 1 A 68 68 ALA C C 68 177.358 180.382 -3.024 1
1 823 . 6 1 1 A 68 68 ALA CA C 68 55.607 55.976 -0.369 1
1 824 . 6 1 1 A 68 68 ALA CB C 68 18.061 18.480 -0.419 1
1 825 . 6 1 1 A 68 68 ALA N N 68 118.239 124.751 -6.512 1
1 826 . 6 1 1 A 69 69 GLN H H 69 7.979 8.411 -0.432 1
1 827 . 6 1 1 A 69 69 GLN HA H 69 4.310 4.433 -0.123 1
1 834 . 6 1 1 A 69 69 GLN C C 69 179.370 178.182 1.188 1
1 835 . 6 1 1 A 69 69 GLN CA C 69 59.307 58.157 1.150 1
1 836 . 6 1 1 A 69 69 GLN CB C 69 29.257 28.381 0.876 1
1 838 . 6 1 1 A 69 69 GLN N N 69 118.484 116.984 1.500 1
1 840 . 6 1 1 A 70 70 ARG H H 70 8.374 8.014 0.360 1
1 841 . 6 1 1 A 70 70 ARG HA H 70 4.148 4.103 0.045 1
1 848 . 6 1 1 A 70 70 ARG C C 70 175.850 178.199 -2.349 1
1 849 . 6 1 1 A 70 70 ARG CA C 70 58.957 58.390 0.567 1
1 850 . 6 1 1 A 70 70 ARG CB C 70 29.799 29.973 -0.174 1
1 852 . 6 1 1 A 70 70 ARG N N 70 120.309 120.800 -0.491 1
1 853 . 6 1 1 A 71 71 LEU H H 71 7.413 7.770 -0.357 1
1 854 . 6 1 1 A 71 71 LEU HA H 71 4.341 4.386 -0.045 1
1 864 . 6 1 1 A 71 71 LEU C C 71 173.391 176.262 -2.871 1
1 865 . 6 1 1 A 71 71 LEU CA C 71 54.911 54.806 0.105 1
1 866 . 6 1 1 A 71 71 LEU CB C 71 42.693 42.270 0.423 1
1 867 . 6 1 1 A 71 71 LEU N N 71 118.841 120.431 -1.590 1
1 868 . 6 1 1 A 72 72 ASN H H 72 8.038 8.102 -0.064 1
1 869 . 6 1 1 A 72 72 ASN HA H 72 4.394 4.432 -0.038 1
1 874 . 6 1 1 A 72 72 ASN C C 72 173.042 174.500 -1.458 1
1 875 . 6 1 1 A 72 72 ASN CB C 72 36.412 36.057 0.355 1
1 876 . 6 1 1 A 72 72 ASN N N 72 112.919 117.654 -4.735 1
1 878 . 6 1 1 A 73 73 TYR H H 73 7.874 7.556 0.318 1
1 879 . 6 1 1 A 73 73 TYR HA H 73 4.868 4.646 0.222 1
1 886 . 6 1 1 A 73 73 TYR C C 73 172.194 174.140 -1.946 1
1 887 . 6 1 1 A 73 73 TYR CA C 73 57.105 56.692 0.413 1
1 888 . 6 1 1 A 73 73 TYR CB C 73 37.918 38.470 -0.552 1
1 889 . 6 1 1 A 73 73 TYR N N 73 117.432 119.762 -2.330 1
1 897 . 6 1 1 A 75 75 PRO HA H 75 4.626 4.268 0.358 1
1 902 . 6 1 1 A 75 75 PRO C C 75 175.728 177.238 -1.510 1
1 903 . 6 1 1 A 75 75 PRO CA C 75 62.502 63.684 -1.182 1
1 904 . 6 1 1 A 75 75 PRO CB C 75 32.339 32.239 0.100 1
1 905 . 6 1 1 A 76 76 GLY H H 76 8.369 8.885 -0.516 1
1 906 . 6 1 1 A 76 76 GLY HA2 H 76 4.057 3.892 0.165 1
1 907 . 6 1 1 A 76 76 GLY HA3 H 76 4.556 3.892 0.664 1
1 908 . 6 1 1 A 76 76 GLY C C 76 173.248 175.000 -1.752 1
1 909 . 6 1 1 A 76 76 GLY CA C 76 46.180 45.387 0.793 1
1 910 . 6 1 1 A 76 76 GLY N N 76 106.185 111.033 -4.848 1
1 911 . 6 1 1 A 77 77 LYS H H 77 8.632 8.282 0.350 1
1 912 . 6 1 1 A 77 77 LYS HA H 77 4.433 3.914 0.519 1
1 921 . 6 1 1 A 77 77 LYS C C 77 174.924 176.339 -1.415 1
1 922 . 6 1 1 A 77 77 LYS CA C 77 56.453 58.042 -1.589 1
1 923 . 6 1 1 A 77 77 LYS CB C 77 33.170 30.187 2.983 1
1 925 . 6 1 1 A 77 77 LYS N N 77 119.592 115.890 3.702 1
1 926 . 6 1 1 A 78 78 ASN H H 78 8.865 8.321 0.544 1
1 927 . 6 1 1 A 78 78 ASN HA H 78 4.654 4.462 0.192 1
1 932 . 6 1 1 A 78 78 ASN C C 78 174.869 177.673 -2.804 1
1 933 . 6 1 1 A 78 78 ASN CA C 78 54.117 56.245 -2.128 1
1 934 . 6 1 1 A 78 78 ASN CB C 78 37.841 39.433 -1.592 1
1 935 . 6 1 1 A 78 78 ASN N N 78 116.880 117.438 -0.558 1
1 937 . 6 1 1 A 79 79 ILE H H 79 8.008 8.266 -0.258 1
1 938 . 6 1 1 A 79 79 ILE HA H 79 3.718 3.704 0.014 1
1 948 . 6 1 1 A 79 79 ILE C C 79 175.921 178.290 -2.369 1
1 949 . 6 1 1 A 79 79 ILE CA C 79 63.618 64.655 -1.037 1
1 950 . 6 1 1 A 79 79 ILE CB C 79 37.158 37.032 0.126 1
1 952 . 6 1 1 A 79 79 ILE N N 79 119.688 119.512 0.176 1
1 953 . 6 1 1 A 80 80 GLY H H 80 9.062 8.422 0.640 1
1 954 . 6 1 1 A 80 80 GLY HA2 H 80 3.739 3.832 -0.093 1
1 955 . 6 1 1 A 80 80 GLY HA3 H 80 3.739 3.860 -0.121 1
1 956 . 6 1 1 A 80 80 GLY C C 80 173.185 176.579 -3.394 1
1 957 . 6 1 1 A 80 80 GLY CA C 80 48.166 47.623 0.543 1
1 958 . 6 1 1 A 80 80 GLY N N 80 110.338 109.050 1.288 1
1 959 . 6 1 1 A 81 81 SER H H 81 7.460 7.867 -0.407 1
1 960 . 6 1 1 A 81 81 SER HA H 81 3.904 4.082 -0.178 1
1 963 . 6 1 1 A 81 81 SER C C 81 174.999 175.872 -0.873 1
1 964 . 6 1 1 A 81 81 SER CA C 81 61.138 62.647 -1.509 1
1 965 . 6 1 1 A 81 81 SER CB C 81 62.740 62.905 -0.165 1
1 966 . 6 1 1 A 81 81 SER N N 81 115.348 119.524 -4.176 1
1 967 . 6 1 1 A 82 82 LEU H H 82 7.367 7.893 -0.526 1
1 968 . 6 1 1 A 82 82 LEU HA H 82 3.946 3.836 0.110 1
1 977 . 6 1 1 A 82 82 LEU C C 82 176.969 177.787 -0.818 1
1 978 . 6 1 1 A 82 82 LEU CA C 82 57.504 57.964 -0.460 1
1 979 . 6 1 1 A 82 82 LEU CB C 82 42.185 41.237 0.948 1
1 980 . 6 1 1 A 82 82 LEU N N 82 124.267 122.657 1.610 1
1 981 . 6 1 1 A 83 83 LEU H H 83 8.330 8.129 0.201 1
1 982 . 6 1 1 A 83 83 LEU HA H 83 3.924 3.885 0.039 1
1 991 . 6 1 1 A 83 83 LEU C C 83 176.303 178.251 -1.948 1
1 992 . 6 1 1 A 83 83 LEU CA C 83 58.067 58.303 -0.236 1
1 993 . 6 1 1 A 83 83 LEU CB C 83 41.061 41.688 -0.627 1
1 994 . 6 1 1 A 83 83 LEU N N 83 117.452 119.800 -2.348 1
1 995 . 6 1 1 A 84 84 ARG H H 84 7.651 8.295 -0.644 1
1 996 . 6 1 1 A 84 84 ARG HA H 84 2.230 3.463 -1.233 1
1 1003 . 6 1 1 A 84 84 ARG C C 84 175.902 177.976 -2.074 1
1 1004 . 6 1 1 A 84 84 ARG CA C 84 59.112 59.430 -0.318 1
1 1005 . 6 1 1 A 84 84 ARG CB C 84 28.579 29.530 -0.951 1
1 1007 . 6 1 1 A 84 84 ARG N N 84 119.586 119.595 -0.009 1
1 1008 . 6 1 1 A 85 85 SER H H 85 7.291 7.781 -0.490 1
1 1009 . 6 1 1 A 85 85 SER HA H 85 4.189 4.136 0.053 1
1 1012 . 6 1 1 A 85 85 SER C C 85 175.546 177.399 -1.853 1
1 1013 . 6 1 1 A 85 85 SER CA C 85 61.376 61.467 -0.091 1
1 1014 . 6 1 1 A 85 85 SER CB C 85 62.805 63.016 -0.211 1
1 1015 . 6 1 1 A 85 85 SER N N 85 112.921 113.702 -0.781 1
1 1016 . 6 1 1 A 86 86 HIS H H 86 8.156 7.710 0.446 1
1 1017 . 6 1 1 A 86 86 HIS HA H 86 4.782 4.195 0.587 1
1 1022 . 6 1 1 A 86 86 HIS C C 86 176.851 177.497 -0.646 1
1 1023 . 6 1 1 A 86 86 HIS CA C 86 58.898 59.474 -0.576 1
1 1024 . 6 1 1 A 86 86 HIS CB C 86 31.110 29.947 1.163 1
1 1027 . 6 1 1 A 86 86 HIS N N 86 119.258 119.036 0.222 1
1 1028 . 6 1 1 A 87 87 TYR H H 87 9.180 8.172 1.008 1
1 1029 . 6 1 1 A 87 87 TYR HA H 87 3.913 3.915 -0.002 1
1 1036 . 6 1 1 A 87 87 TYR C C 87 176.841 177.560 -0.719 1
1 1037 . 6 1 1 A 87 87 TYR CA C 87 63.526 61.734 1.792 1
1 1038 . 6 1 1 A 87 87 TYR CB C 87 39.431 38.264 1.167 1
1 1041 . 6 1 1 A 87 87 TYR N N 87 120.625 119.288 1.337 1
1 1042 . 6 1 1 A 88 88 GLU H H 88 9.028 8.327 0.701 1
1 1043 . 6 1 1 A 88 88 GLU HA H 88 3.682 4.037 -0.355 1
1 1048 . 6 1 1 A 88 88 GLU C C 88 175.833 178.038 -2.205 1
1 1049 . 6 1 1 A 88 88 GLU CA C 88 59.730 60.022 -0.292 1
1 1050 . 6 1 1 A 88 88 GLU CB C 88 30.009 29.426 0.583 1
1 1052 . 6 1 1 A 88 88 GLU N N 88 119.531 119.395 0.136 1
1 1053 . 6 1 1 A 89 89 ARG H H 89 8.052 7.635 0.417 1
1 1054 . 6 1 1 A 89 89 ARG HA H 89 4.292 4.525 -0.233 1
1 1061 . 6 1 1 A 89 89 ARG C C 89 176.045 176.782 -0.737 1
1 1062 . 6 1 1 A 89 89 ARG CA C 89 58.538 57.029 1.509 1
1 1063 . 6 1 1 A 89 89 ARG CB C 89 31.841 31.160 0.681 1
1 1065 . 6 1 1 A 89 89 ARG N N 89 114.741 116.920 -2.179 1
1 1066 . 6 1 1 A 90 90 ILE H H 90 8.141 7.447 0.694 1
1 1067 . 6 1 1 A 90 90 ILE HA H 90 4.296 3.908 0.388 1
1 1075 . 6 1 1 A 90 90 ILE C C 90 174.461 176.970 -2.509 1
1 1076 . 6 1 1 A 90 90 ILE CA C 90 63.649 62.619 1.030 1
1 1077 . 6 1 1 A 90 90 ILE CB C 90 40.626 39.462 1.164 1
1 1079 . 6 1 1 A 90 90 ILE N N 90 113.421 119.258 -5.837 1
1 1080 . 6 1 1 A 91 91 VAL H H 91 7.350 7.667 -0.317 1
1 1081 . 6 1 1 A 91 91 VAL HA H 91 4.144 3.762 0.382 1
1 1089 . 6 1 1 A 91 91 VAL C C 91 175.422 176.765 -1.343 1
1 1090 . 6 1 1 A 91 91 VAL CA C 91 65.042 63.789 1.253 1
1 1091 . 6 1 1 A 91 91 VAL CB C 91 33.215 31.419 1.796 1
1 1092 . 6 1 1 A 91 91 VAL N N 91 118.215 120.152 -1.937 1
1 1093 . 6 1 1 A 92 92 TYR H H 92 8.565 8.115 0.450 1
1 1094 . 6 1 1 A 92 92 TYR HA H 92 4.217 4.198 0.019 1
1 1099 . 6 1 1 A 92 92 TYR C C 92 171.495 175.196 -3.701 1
1 1100 . 6 1 1 A 92 92 TYR CA C 92 61.558 62.356 -0.798 1
1 1101 . 6 1 1 A 92 92 TYR CB C 92 36.757 37.063 -0.306 1
1 1102 . 6 1 1 A 92 92 TYR N N 92 121.370 122.256 -0.886 1
1 1103 . 6 1 1 A 93 93 PRO HA H 93 4.136 4.370 -0.234 1
1 1108 . 6 1 1 A 93 93 PRO C C 93 177.077 178.506 -1.429 1
1 1109 . 6 1 1 A 93 93 PRO CA C 93 66.037 65.746 0.291 1
1 1110 . 6 1 1 A 93 93 PRO CB C 93 31.482 31.194 0.288 1
1 1111 . 6 1 1 A 94 94 TYR H H 94 6.517 7.479 -0.962 1
1 1112 . 6 1 1 A 94 94 TYR HA H 94 2.798 4.369 -1.571 1
1 1119 . 6 1 1 A 94 94 TYR C C 94 174.985 178.187 -3.202 1
1 1120 . 6 1 1 A 94 94 TYR CA C 94 59.356 59.384 -0.028 1
1 1121 . 6 1 1 A 94 94 TYR CB C 94 37.987 37.244 0.743 1
1 1124 . 6 1 1 A 94 94 TYR N N 94 115.987 117.424 -1.437 1
1 1125 . 6 1 1 A 95 95 GLU H H 95 8.205 8.287 -0.082 1
1 1126 . 6 1 1 A 95 95 GLU HA H 95 3.682 4.039 -0.357 1
1 1131 . 6 1 1 A 95 95 GLU C C 95 178.530 178.543 -0.013 1
1 1132 . 6 1 1 A 95 95 GLU CA C 95 58.910 59.935 -1.025 1
1 1133 . 6 1 1 A 95 95 GLU CB C 95 29.187 29.461 -0.274 1
1 1134 . 6 1 1 A 95 95 GLU N N 95 119.946 121.482 -1.536 1
1 1135 . 6 1 1 A 96 96 MET H H 96 8.248 7.976 0.272 1
1 1136 . 6 1 1 A 96 96 MET HA H 96 4.172 4.121 0.051 1
1 1142 . 6 1 1 A 96 96 MET C C 96 176.874 177.751 -0.877 1
1 1143 . 6 1 1 A 96 96 MET CA C 96 57.159 59.138 -1.979 1
1 1144 . 6 1 1 A 96 96 MET CB C 96 31.829 32.205 -0.376 1
1 1146 . 6 1 1 A 96 96 MET N N 96 117.570 119.035 -1.465 1
1 1147 . 6 1 1 A 97 97 TYR H H 97 7.445 8.454 -1.009 1
1 1148 . 6 1 1 A 97 97 TYR HA H 97 4.248 4.041 0.207 1
1 1155 . 6 1 1 A 97 97 TYR C C 97 176.476 177.129 -0.653 1
1 1156 . 6 1 1 A 97 97 TYR CA C 97 60.470 61.913 -1.443 1
1 1157 . 6 1 1 A 97 97 TYR CB C 97 38.612 38.558 0.054 1
1 1160 . 6 1 1 A 97 97 TYR N N 97 122.246 120.792 1.454 1
1 1161 . 6 1 1 A 98 98 GLN H H 98 8.087 8.528 -0.441 1
1 1162 . 6 1 1 A 98 98 GLN HA H 98 3.793 3.376 0.417 1
1 1169 . 6 1 1 A 98 98 GLN C C 98 175.549 178.153 -2.604 1
1 1170 . 6 1 1 A 98 98 GLN CA C 98 57.365 58.793 -1.428 1
1 1171 . 6 1 1 A 98 98 GLN CB C 98 28.901 28.582 0.319 1
1 1173 . 6 1 1 A 98 98 GLN N N 98 118.769 119.390 -0.621 1
1 1175 . 6 1 1 A 99 99 SER H H 99 7.724 8.057 -0.333 1
1 1176 . 6 1 1 A 99 99 SER HA H 99 4.293 4.199 0.094 1
1 1179 . 6 1 1 A 99 99 SER C C 99 173.696 177.166 -3.470 1
1 1180 . 6 1 1 A 99 99 SER CA C 99 59.566 60.983 -1.417 1
1 1181 . 6 1 1 A 99 99 SER CB C 99 63.847 62.812 1.035 1
1 1182 . 6 1 1 A 99 99 SER N N 99 113.257 114.348 -1.091 1
1 1183 . 6 1 1 A 100 100 GLY H H 100 7.751 8.245 -0.494 1
1 1184 . 6 1 1 A 100 100 GLY HA2 H 100 3.813 3.873 -0.060 1
1 1185 . 6 1 1 A 100 100 GLY HA3 H 100 3.934 3.880 0.054 1
1 1186 . 6 1 1 A 100 100 GLY C C 100 172.643 176.299 -3.656 1
1 1187 . 6 1 1 A 100 100 GLY CA C 100 45.570 47.090 -1.520 1
1 1188 . 6 1 1 A 100 100 GLY N N 100 109.750 108.705 1.045 1
1 1189 . 6 1 1 A 101 101 ALA H H 101 7.824 8.044 -0.220 1
1 1190 . 6 1 1 A 101 101 ALA HA H 101 4.221 3.984 0.237 1
1 1194 . 6 1 1 A 101 101 ALA C C 101 175.639 179.288 -3.649 1
1 1195 . 6 1 1 A 101 101 ALA CA C 101 52.745 54.455 -1.710 1
1 1196 . 6 1 1 A 101 101 ALA CB C 101 19.437 18.378 1.059 1
1 1197 . 6 1 1 A 101 101 ALA N N 101 123.241 124.764 -1.523 1
1 1198 . 6 1 1 A 102 102 ASN H H 102 8.191 7.882 0.309 1
1 1199 . 6 1 1 A 102 102 ASN HA H 102 4.658 4.722 -0.064 1
1 1204 . 6 1 1 A 102 102 ASN C C 102 173.337 175.758 -2.421 1
1 1205 . 6 1 1 A 102 102 ASN CA C 102 53.374 55.400 -2.026 1
1 1206 . 6 1 1 A 102 102 ASN CB C 102 38.819 39.551 -0.732 1
1 1207 . 6 1 1 A 102 102 ASN N N 102 116.572 114.070 2.502 1
1 1209 . 6 1 1 A 103 103 LEU H H 103 8.065 7.647 0.418 1
1 1210 . 6 1 1 A 103 103 LEU HA H 103 4.363 4.686 -0.323 1
1 1219 . 6 1 1 A 103 103 LEU C C 103 175.637 174.737 0.900 1
1 1220 . 6 1 1 A 103 103 LEU CA C 103 55.292 53.889 1.403 1
1 1221 . 6 1 1 A 103 103 LEU CB C 103 42.433 44.888 -2.455 1
1 1222 . 6 1 1 A 103 103 LEU N N 103 122.074 114.450 7.624 1
1 1223 . 6 1 1 A 104 104 VAL H H 104 8.055 8.812 -0.757 1
1 1224 . 6 1 1 A 104 104 VAL HA H 104 4.131 5.249 -1.118 1
1 1232 . 6 1 1 A 104 104 VAL C C 104 174.364 174.775 -0.411 1
1 1233 . 6 1 1 A 104 104 VAL CA C 104 62.552 59.594 2.958 1
1 1234 . 6 1 1 A 104 104 VAL CB C 104 32.766 35.896 -3.130 1
1 1235 . 6 1 1 A 104 104 VAL N N 104 120.606 118.669 1.937 1
1 1236 . 6 1 1 A 105 105 CYS H H 105 8.392 8.336 0.056 1
1 1237 . 6 1 1 A 105 105 CYS HA H 105 4.535 4.641 -0.106 1
1 1240 . 6 1 1 A 105 105 CYS C C 105 172.593 176.421 -3.828 1
1 1241 . 6 1 1 A 105 105 CYS CA C 105 58.449 59.463 -1.014 1
1 1242 . 6 1 1 A 105 105 CYS CB C 105 27.952 29.606 -1.654 1
1 1243 . 6 1 1 A 105 105 CYS N N 105 122.791 124.933 -2.142 1
1 1244 . 6 1 1 A 106 106 ASN H H 106 8.575 8.313 0.262 1
1 1245 . 6 1 1 A 106 106 ASN HA H 106 4.843 4.589 0.254 1
1 1250 . 6 1 1 A 106 106 ASN C C 106 173.594 177.597 -4.003 1
1 1251 . 6 1 1 A 106 106 ASN CA C 106 53.337 55.597 -2.260 1
1 1252 . 6 1 1 A 106 106 ASN CB C 106 39.088 38.121 0.967 1
1 1253 . 6 1 1 A 106 106 ASN N N 106 122.001 120.589 1.412 1
1 1255 . 6 1 1 A 107 107 THR H H 107 8.090 8.212 -0.122 1
1 1256 . 6 1 1 A 107 107 THR HA H 107 4.348 4.140 0.208 1
1 1261 . 6 1 1 A 107 107 THR C C 107 172.516 176.294 -3.778 1
1 1262 . 6 1 1 A 107 107 THR CA C 107 61.803 65.225 -3.422 1
1 1263 . 6 1 1 A 107 107 THR CB C 107 69.812 68.925 0.887 1
1 1265 . 6 1 1 A 107 107 THR N N 107 114.374 115.062 -0.688 1
1 1266 . 6 1 1 A 108 108 ARG H H 108 8.322 7.435 0.887 1
1 1267 . 6 1 1 A 108 108 ARG HA H 108 4.634 4.284 0.350 1
1 1274 . 6 1 1 A 108 108 ARG C C 108 172.608 177.114 -4.506 1
1 1275 . 6 1 1 A 108 108 ARG CA C 108 54.026 60.425 -6.399 1
1 1276 . 6 1 1 A 108 108 ARG CB C 108 30.246 30.621 -0.375 1
1 1278 . 6 1 1 A 108 108 ARG N N 108 124.017 121.595 2.422 1
1 1279 . 6 1 1 A 109 109 PRO HA H 109 4.354 4.457 -0.103 1
1 1286 . 6 1 1 A 109 109 PRO C C 109 174.978 178.736 -3.758 1
1 1287 . 6 1 1 A 109 109 PRO CA C 109 63.396 65.536 -2.140 1
1 1288 . 6 1 1 A 109 109 PRO CB C 109 32.046 31.467 0.579 1
1 1290 . 6 1 1 A 110 110 PHE H H 110 8.123 8.110 0.013 1
1 1291 . 6 1 1 A 110 110 PHE HA H 110 4.619 4.242 0.377 1
1 1296 . 6 1 1 A 110 110 PHE C C 110 173.856 177.401 -3.545 1
1 1297 . 6 1 1 A 110 110 PHE CA C 110 57.353 62.095 -4.742 1
1 1298 . 6 1 1 A 110 110 PHE CB C 110 39.364 39.167 0.197 1
1 1301 . 6 1 1 A 110 110 PHE N N 110 119.265 119.143 0.122 1
1 1302 . 6 1 1 A 111 111 ASP H H 111 8.161 8.340 -0.179 1
1 1303 . 6 1 1 A 111 111 ASP HA H 111 4.613 4.451 0.162 1
1 1306 . 6 1 1 A 111 111 ASP C C 111 174.114 178.563 -4.449 1
1 1307 . 6 1 1 A 111 111 ASP CA C 111 54.350 57.773 -3.423 1
1 1308 . 6 1 1 A 111 111 ASP CB C 111 41.413 41.869 -0.456 1
1 1309 . 6 1 1 A 111 111 ASP N N 111 121.764 119.387 2.377 1
1 1310 . 6 1 1 A 112 112 ASN H H 112 8.307 8.269 0.038 1
1 1311 . 6 1 1 A 112 112 ASN HA H 112 4.662 4.502 0.160 1
1 1316 . 6 1 1 A 112 112 ASN C C 112 173.595 177.697 -4.102 1
1 1317 . 6 1 1 A 112 112 ASN CA C 112 53.486 56.265 -2.779 1
1 1318 . 6 1 1 A 112 112 ASN CB C 112 39.225 39.063 0.162 1
1 1319 . 6 1 1 A 112 112 ASN N N 112 119.154 117.761 1.393 1
1 1321 . 6 1 1 A 113 113 GLU H H 113 8.404 8.306 0.098 1
1 1322 . 6 1 1 A 113 113 GLU HA H 113 4.264 4.093 0.171 1
1 1327 . 6 1 1 A 113 113 GLU C C 113 174.886 178.720 -3.834 1
1 1328 . 6 1 1 A 113 113 GLU CA C 113 56.681 59.604 -2.923 1
1 1329 . 6 1 1 A 113 113 GLU CB C 113 30.403 28.973 1.430 1
1 1331 . 6 1 1 A 113 113 GLU N N 113 120.943 119.213 1.730 1
1 1332 . 6 1 1 A 114 114 GLU H H 114 8.388 8.163 0.225 1
1 1333 . 6 1 1 A 114 114 GLU HA H 114 4.262 4.200 0.062 1
1 1338 . 6 1 1 A 114 114 GLU C C 114 174.819 178.636 -3.817 1
1 1339 . 6 1 1 A 114 114 GLU CA C 114 56.769 59.454 -2.685 1
1 1340 . 6 1 1 A 114 114 GLU CB C 114 30.125 29.398 0.727 1
1 1342 . 6 1 1 A 114 114 GLU N N 114 121.869 120.287 1.582 1
1 1343 . 6 1 1 A 115 115 LYS H H 115 8.236 8.079 0.157 1
1 1344 . 6 1 1 A 115 115 LYS HA H 115 4.347 4.481 -0.134 1
1 1353 . 6 1 1 A 115 115 LYS C C 115 174.633 176.060 -1.427 1
1 1354 . 6 1 1 A 115 115 LYS CA C 115 56.426 56.133 0.293 1
1 1355 . 6 1 1 A 115 115 LYS CB C 115 33.277 32.873 0.404 1
1 1359 . 6 1 1 A 115 115 LYS N N 115 121.997 119.695 2.302 1
1 1360 . 6 1 1 A 116 116 ASP H H 116 8.386 8.178 0.208 1
1 1361 . 6 1 1 A 116 116 ASP HA H 116 4.600 4.247 0.353 1
1 1364 . 6 1 1 A 116 116 ASP C C 116 173.448 175.038 -1.590 1
1 1365 . 6 1 1 A 116 116 ASP CA C 116 54.773 56.928 -2.155 1
1 1366 . 6 1 1 A 116 116 ASP CB C 116 41.029 38.756 2.273 1
1 1367 . 6 1 1 A 116 116 ASP N N 116 121.057 116.132 4.925 1
1 5 . 7 1 1 A 2 2 MET HA H 2 4.534 4.206 0.328 1
1 13 . 7 1 1 A 2 2 MET C C 2 174.355 178.091 -3.736 1
1 14 . 7 1 1 A 2 2 MET CA C 2 56.247 57.959 -1.712 1
1 15 . 7 1 1 A 2 2 MET CB C 2 32.855 32.391 0.464 1
1 18 . 7 1 1 A 3 3 ASN H H 3 8.600 8.239 0.361 1
1 19 . 7 1 1 A 3 3 ASN HA H 3 4.711 4.423 0.288 1
1 24 . 7 1 1 A 3 3 ASN C C 3 173.983 177.391 -3.408 1
1 25 . 7 1 1 A 3 3 ASN CA C 3 53.650 56.754 -3.104 1
1 26 . 7 1 1 A 3 3 ASN CB C 3 38.624 39.917 -1.293 1
1 27 . 7 1 1 A 3 3 ASN N N 3 120.149 118.171 1.978 1
1 29 . 7 1 1 A 4 4 GLU H H 4 8.495 7.918 0.577 1
1 30 . 7 1 1 A 4 4 GLU HA H 4 4.235 4.037 0.198 1
1 35 . 7 1 1 A 4 4 GLU C C 4 175.752 178.805 -3.053 1
1 36 . 7 1 1 A 4 4 GLU CA C 4 58.075 59.134 -1.059 1
1 37 . 7 1 1 A 4 4 GLU CB C 4 30.125 29.061 1.064 1
1 38 . 7 1 1 A 4 4 GLU N N 4 121.543 118.248 3.295 1
1 39 . 7 1 1 A 5 5 LEU HA H 5 4.073 4.279 -0.206 1
1 47 . 7 1 1 A 5 5 LEU CB C 5 41.897 41.865 0.032 1
1 50 . 7 1 1 A 6 6 GLU H H 6 8.332 8.291 0.041 1
1 51 . 7 1 1 A 6 6 GLU HA H 6 3.621 4.281 -0.660 1
1 52 . 7 1 1 A 6 6 GLU C C 6 176.402 178.600 -2.198 1
1 53 . 7 1 1 A 6 6 GLU CA C 6 58.461 58.731 -0.270 1
1 54 . 7 1 1 A 6 6 GLU CB C 6 29.730 29.241 0.489 1
1 55 . 7 1 1 A 6 6 GLU N N 6 121.462 117.971 3.491 1
1 56 . 7 1 1 A 7 7 ALA H H 7 8.244 7.708 0.536 1
1 57 . 7 1 1 A 7 7 ALA HA H 7 4.185 4.144 0.041 1
1 61 . 7 1 1 A 7 7 ALA C C 7 177.982 178.401 -0.419 1
1 62 . 7 1 1 A 7 7 ALA CA C 7 54.791 55.248 -0.457 1
1 63 . 7 1 1 A 7 7 ALA CB C 7 18.836 18.781 0.055 1
1 64 . 7 1 1 A 7 7 ALA N N 7 123.078 121.478 1.600 1
1 65 . 7 1 1 A 8 8 GLN H H 8 8.274 7.860 0.414 1
1 66 . 7 1 1 A 8 8 GLN HA H 8 4.219 4.422 -0.203 1
1 73 . 7 1 1 A 8 8 GLN C C 8 176.325 175.488 0.837 1
1 74 . 7 1 1 A 8 8 GLN CA C 8 57.864 55.866 1.998 1
1 75 . 7 1 1 A 8 8 GLN CB C 8 28.768 28.932 -0.164 1
1 77 . 7 1 1 A 8 8 GLN N N 8 117.452 116.691 0.761 1
1 79 . 7 1 1 A 9 9 THR H H 9 8.043 8.610 -0.567 1
1 80 . 7 1 1 A 9 9 THR HA H 9 3.998 4.621 -0.623 1
1 85 . 7 1 1 A 9 9 THR C C 9 173.904 175.334 -1.430 1
1 86 . 7 1 1 A 9 9 THR CA C 9 65.435 61.756 3.679 1
1 87 . 7 1 1 A 9 9 THR CB C 9 68.870 69.947 -1.077 1
1 89 . 7 1 1 A 9 9 THR N N 9 116.135 118.908 -2.773 1
1 90 . 7 1 1 A 10 10 ARG H H 10 8.095 8.992 -0.897 1
1 91 . 7 1 1 A 10 10 ARG HA H 10 4.040 4.111 -0.071 1
1 98 . 7 1 1 A 10 10 ARG C C 10 176.583 176.276 0.307 1
1 99 . 7 1 1 A 10 10 ARG CA C 10 59.262 57.493 1.769 1
1 100 . 7 1 1 A 10 10 ARG CB C 10 29.900 30.127 -0.227 1
1 101 . 7 1 1 A 10 10 ARG N N 10 121.157 125.314 -4.157 1
1 102 . 7 1 1 A 11 11 VAL H H 11 7.657 7.913 -0.256 1
1 103 . 7 1 1 A 11 11 VAL HA H 11 3.769 4.421 -0.652 1
1 111 . 7 1 1 A 11 11 VAL C C 11 176.662 177.813 -1.151 1
1 112 . 7 1 1 A 11 11 VAL CA C 11 65.914 63.853 2.061 1
1 113 . 7 1 1 A 11 11 VAL CB C 11 31.745 33.496 -1.751 1
1 114 . 7 1 1 A 11 11 VAL N N 11 118.580 118.047 0.533 1
1 115 . 7 1 1 A 12 12 LYS H H 12 7.471 7.976 -0.505 1
1 116 . 7 1 1 A 12 12 LYS HA H 12 3.366 4.366 -1.000 1
1 123 . 7 1 1 A 12 12 LYS C C 12 176.457 179.383 -2.926 1
1 124 . 7 1 1 A 12 12 LYS CA C 12 59.545 59.267 0.278 1
1 125 . 7 1 1 A 12 12 LYS CB C 12 32.206 32.378 -0.172 1
1 126 . 7 1 1 A 12 12 LYS N N 12 121.835 122.622 -0.787 1
1 127 . 7 1 1 A 13 13 LEU H H 13 8.144 8.101 0.043 1
1 128 . 7 1 1 A 13 13 LEU HA H 13 4.093 4.067 0.026 1
1 137 . 7 1 1 A 13 13 LEU C C 13 178.254 178.922 -0.668 1
1 138 . 7 1 1 A 13 13 LEU CA C 13 58.023 58.076 -0.053 1
1 139 . 7 1 1 A 13 13 LEU CB C 13 41.283 41.614 -0.331 1
1 140 . 7 1 1 A 13 13 LEU N N 13 118.688 120.503 -1.815 1
1 141 . 7 1 1 A 14 14 ASN H H 14 8.384 8.472 -0.088 1
1 142 . 7 1 1 A 14 14 ASN HA H 14 4.567 4.445 0.122 1
1 147 . 7 1 1 A 14 14 ASN C C 14 175.397 177.149 -1.752 1
1 148 . 7 1 1 A 14 14 ASN CA C 14 56.239 56.356 -0.117 1
1 149 . 7 1 1 A 14 14 ASN CB C 14 38.432 39.400 -0.968 1
1 150 . 7 1 1 A 14 14 ASN N N 14 118.175 117.256 0.919 1
1 152 . 7 1 1 A 15 15 TYR H H 15 7.982 7.883 0.099 1
1 153 . 7 1 1 A 15 15 TYR HA H 15 4.249 4.068 0.181 1
1 160 . 7 1 1 A 15 15 TYR C C 15 175.503 177.531 -2.028 1
1 161 . 7 1 1 A 15 15 TYR CA C 15 62.450 61.378 1.072 1
1 162 . 7 1 1 A 15 15 TYR CB C 15 39.399 38.659 0.740 1
1 163 . 7 1 1 A 15 15 TYR N N 15 121.955 120.480 1.475 1
1 164 . 7 1 1 A 16 16 LEU H H 16 8.198 8.437 -0.239 1
1 165 . 7 1 1 A 16 16 LEU HA H 16 4.470 4.010 0.460 1
1 175 . 7 1 1 A 16 16 LEU C C 16 177.125 177.982 -0.857 1
1 176 . 7 1 1 A 16 16 LEU CA C 16 57.374 58.200 -0.826 1
1 177 . 7 1 1 A 16 16 LEU CB C 16 41.443 41.447 -0.004 1
1 178 . 7 1 1 A 16 16 LEU N N 16 117.642 121.214 -3.572 1
1 179 . 7 1 1 A 17 17 ASP H H 17 8.061 8.265 -0.204 1
1 180 . 7 1 1 A 17 17 ASP C C 17 177.836 178.066 -0.230 1
1 181 . 7 1 1 A 17 17 ASP CA C 17 57.486 57.975 -0.489 1
1 182 . 7 1 1 A 17 17 ASP CB C 17 41.433 42.041 -0.608 1
1 183 . 7 1 1 A 17 17 ASP N N 17 118.700 118.754 -0.054 1
1 184 . 7 1 1 A 18 18 GLN H H 18 8.111 7.734 0.377 1
1 185 . 7 1 1 A 18 18 GLN HA H 18 4.002 4.055 -0.053 1
1 190 . 7 1 1 A 18 18 GLN CA C 18 59.046 58.789 0.257 1
1 191 . 7 1 1 A 18 18 GLN CB C 18 28.700 28.634 0.066 1
1 193 . 7 1 1 A 18 18 GLN N N 18 119.539 118.733 0.806 1
1 195 . 7 1 1 A 19 19 ILE H H 19 8.330 8.266 0.064 1
1 196 . 7 1 1 A 19 19 ILE HA H 19 3.306 3.840 -0.534 1
1 204 . 7 1 1 A 19 19 ILE C C 19 175.608 177.716 -2.108 1
1 205 . 7 1 1 A 19 19 ILE CA C 19 64.760 63.043 1.717 1
1 206 . 7 1 1 A 19 19 ILE CB C 19 37.148 37.054 0.094 1
1 209 . 7 1 1 A 19 19 ILE N N 19 121.490 119.922 1.568 1
1 210 . 7 1 1 A 20 20 ALA H H 20 8.057 7.975 0.082 1
1 211 . 7 1 1 A 20 20 ALA HA H 20 4.349 4.139 0.210 1
1 215 . 7 1 1 A 20 20 ALA C C 20 179.297 180.066 -0.769 1
1 216 . 7 1 1 A 20 20 ALA CA C 20 56.150 55.356 0.794 1
1 217 . 7 1 1 A 20 20 ALA CB C 20 18.104 18.869 -0.765 1
1 218 . 7 1 1 A 20 20 ALA N N 20 124.441 124.270 0.171 1
1 219 . 7 1 1 A 21 21 LYS H H 21 8.116 8.192 -0.076 1
1 220 . 7 1 1 A 21 21 LYS HA H 21 4.108 4.107 0.001 1
1 229 . 7 1 1 A 21 21 LYS C C 21 176.720 178.756 -2.036 1
1 230 . 7 1 1 A 21 21 LYS CA C 21 59.166 58.430 0.736 1
1 231 . 7 1 1 A 21 21 LYS CB C 21 32.085 32.302 -0.217 1
1 233 . 7 1 1 A 21 21 LYS N N 21 119.865 117.242 2.623 1
1 234 . 7 1 1 A 22 22 PHE H H 22 7.875 8.138 -0.263 1
1 235 . 7 1 1 A 22 22 PHE HA H 22 4.012 4.122 -0.110 1
1 242 . 7 1 1 A 22 22 PHE C C 22 175.545 177.756 -2.211 1
1 243 . 7 1 1 A 22 22 PHE CA C 22 61.070 61.329 -0.259 1
1 244 . 7 1 1 A 22 22 PHE CB C 22 39.072 38.693 0.379 1
1 249 . 7 1 1 A 22 22 PHE N N 22 119.729 121.014 -1.285 1
1 250 . 7 1 1 A 23 23 TRP H H 23 7.841 8.177 -0.336 1
1 251 . 7 1 1 A 23 23 TRP HA H 23 4.149 4.251 -0.102 1
1 260 . 7 1 1 A 23 23 TRP C C 23 176.668 178.060 -1.392 1
1 261 . 7 1 1 A 23 23 TRP CB C 23 28.543 30.018 -1.475 1
1 267 . 7 1 1 A 23 23 TRP N N 23 119.440 120.678 -1.238 1
1 269 . 7 1 1 A 24 24 GLU H H 24 8.261 8.559 -0.298 1
1 270 . 7 1 1 A 24 24 GLU HA H 24 4.265 4.088 0.177 1
1 275 . 7 1 1 A 24 24 GLU C C 24 179.679 179.158 0.521 1
1 276 . 7 1 1 A 24 24 GLU CA C 24 59.706 59.211 0.495 1
1 277 . 7 1 1 A 24 24 GLU CB C 24 29.720 29.431 0.289 1
1 279 . 7 1 1 A 24 24 GLU N N 24 121.376 119.275 2.101 1
1 280 . 7 1 1 A 25 25 ILE H H 25 8.071 7.536 0.535 1
1 281 . 7 1 1 A 25 25 ILE HA H 25 3.815 3.860 -0.045 1
1 291 . 7 1 1 A 25 25 ILE C C 25 176.343 177.806 -1.463 1
1 292 . 7 1 1 A 25 25 ILE CA C 25 64.464 62.218 2.246 1
1 293 . 7 1 1 A 25 25 ILE CB C 25 37.371 37.409 -0.038 1
1 296 . 7 1 1 A 25 25 ILE N N 25 121.499 119.818 1.681 1
1 297 . 7 1 1 A 26 26 GLN H H 26 7.327 7.294 0.033 1
1 298 . 7 1 1 A 26 26 GLN HA H 26 4.074 4.266 -0.192 1
1 305 . 7 1 1 A 26 26 GLN C C 26 174.906 175.800 -0.894 1
1 306 . 7 1 1 A 26 26 GLN CA C 26 55.450 55.696 -0.246 1
1 307 . 7 1 1 A 26 26 GLN CB C 26 28.458 29.006 -0.548 1
1 309 . 7 1 1 A 26 26 GLN N N 26 116.532 120.495 -3.963 1
1 311 . 7 1 1 A 27 27 GLY H H 27 7.861 8.477 -0.616 1
1 312 . 7 1 1 A 27 27 GLY HA2 H 27 4.297 3.770 0.527 1
1 313 . 7 1 1 A 27 27 GLY HA3 H 27 3.823 3.772 0.051 1
1 314 . 7 1 1 A 27 27 GLY C C 27 172.698 173.265 -0.567 1
1 315 . 7 1 1 A 27 27 GLY CA C 27 45.608 45.648 -0.040 1
1 316 . 7 1 1 A 27 27 GLY N N 27 106.837 108.429 -1.592 1
1 317 . 7 1 1 A 28 28 SER H H 28 8.083 7.136 0.947 1
1 318 . 7 1 1 A 28 28 SER HA H 28 4.777 4.507 0.270 1
1 321 . 7 1 1 A 28 28 SER C C 28 171.196 172.118 -0.922 1
1 322 . 7 1 1 A 28 28 SER CA C 28 56.041 55.939 0.102 1
1 323 . 7 1 1 A 28 28 SER CB C 28 64.539 63.798 0.741 1
1 324 . 7 1 1 A 28 28 SER N N 28 116.151 114.222 1.929 1
1 325 . 7 1 1 A 29 29 SER H H 29 8.354 8.570 -0.216 1
1 326 . 7 1 1 A 29 29 SER HA H 29 4.389 5.253 -0.864 1
1 329 . 7 1 1 A 29 29 SER C C 29 172.166 172.692 -0.526 1
1 330 . 7 1 1 A 29 29 SER CA C 29 58.107 56.719 1.388 1
1 331 . 7 1 1 A 29 29 SER CB C 29 63.853 65.950 -2.097 1
1 332 . 7 1 1 A 29 29 SER N N 29 116.596 115.396 1.200 1
1 333 . 7 1 1 A 30 30 LEU H H 30 8.990 8.762 0.228 1
1 334 . 7 1 1 A 30 30 LEU HA H 30 3.964 4.755 -0.791 1
1 344 . 7 1 1 A 30 30 LEU C C 30 173.752 175.783 -2.031 1
1 345 . 7 1 1 A 30 30 LEU CA C 30 55.193 54.824 0.369 1
1 346 . 7 1 1 A 30 30 LEU CB C 30 42.869 41.836 1.033 1
1 349 . 7 1 1 A 30 30 LEU N N 30 125.860 127.425 -1.565 1
1 350 . 7 1 1 A 31 31 LYS H H 31 8.118 8.795 -0.677 1
1 351 . 7 1 1 A 31 31 LYS HA H 31 4.498 4.696 -0.198 1
1 360 . 7 1 1 A 31 31 LYS C C 31 173.555 175.363 -1.808 1
1 361 . 7 1 1 A 31 31 LYS CA C 31 54.372 55.431 -1.059 1
1 362 . 7 1 1 A 31 31 LYS CB C 31 32.814 32.483 0.331 1
1 365 . 7 1 1 A 31 31 LYS N N 31 129.965 127.894 2.071 1
1 366 . 7 1 1 A 32 32 ILE H H 32 8.717 8.043 0.674 1
1 367 . 7 1 1 A 32 32 ILE HA H 32 4.011 4.785 -0.774 1
1 377 . 7 1 1 A 32 32 ILE C C 32 173.038 175.153 -2.115 1
1 378 . 7 1 1 A 32 32 ILE CA C 32 59.921 58.115 1.806 1
1 379 . 7 1 1 A 32 32 ILE CB C 32 38.139 39.508 -1.369 1
1 382 . 7 1 1 A 32 32 ILE N N 32 127.091 122.724 4.367 1
1 383 . 7 1 1 A 33 33 PRO HA H 33 4.412 4.630 -0.218 1
1 390 . 7 1 1 A 33 33 PRO C C 33 172.724 176.161 -3.437 1
1 391 . 7 1 1 A 33 33 PRO CA C 33 62.565 62.169 0.396 1
1 392 . 7 1 1 A 33 33 PRO CB C 33 32.728 32.843 -0.115 1
1 394 . 7 1 1 A 34 34 ASN H H 34 8.265 8.492 -0.227 1
1 395 . 7 1 1 A 34 34 ASN HA H 34 5.147 5.532 -0.385 1
1 400 . 7 1 1 A 34 34 ASN C C 34 174.079 173.296 0.783 1
1 401 . 7 1 1 A 34 34 ASN CA C 34 52.088 51.550 0.538 1
1 402 . 7 1 1 A 34 34 ASN CB C 34 40.387 42.193 -1.806 1
1 403 . 7 1 1 A 34 34 ASN N N 34 116.424 116.215 0.209 1
1 405 . 7 1 1 A 35 35 VAL H H 35 8.904 9.295 -0.391 1
1 406 . 7 1 1 A 35 35 VAL HA H 35 4.159 4.469 -0.310 1
1 414 . 7 1 1 A 35 35 VAL C C 35 173.834 174.677 -0.843 1
1 415 . 7 1 1 A 35 35 VAL CA C 35 61.953 59.901 2.052 1
1 416 . 7 1 1 A 35 35 VAL CB C 35 34.432 34.681 -0.249 1
1 419 . 7 1 1 A 35 35 VAL N N 35 122.778 119.116 3.662 1
1 420 . 7 1 1 A 36 36 GLU H H 36 9.560 9.461 0.099 1
1 421 . 7 1 1 A 36 36 GLU HA H 36 3.819 4.007 -0.188 1
1 426 . 7 1 1 A 36 36 GLU C C 36 173.604 175.861 -2.257 1
1 427 . 7 1 1 A 36 36 GLU CA C 36 57.131 58.058 -0.927 1
1 428 . 7 1 1 A 36 36 GLU CB C 36 27.464 27.952 -0.488 1
1 430 . 7 1 1 A 36 36 GLU N N 36 127.014 129.056 -2.042 1
1 431 . 7 1 1 A 37 37 ARG H H 37 8.578 8.483 0.095 1
1 432 . 7 1 1 A 37 37 ARG HA H 37 3.792 3.966 -0.174 1
1 439 . 7 1 1 A 37 37 ARG C C 37 173.371 174.384 -1.013 1
1 440 . 7 1 1 A 37 37 ARG CA C 37 57.952 57.663 0.289 1
1 441 . 7 1 1 A 37 37 ARG CB C 37 27.657 27.805 -0.148 1
1 443 . 7 1 1 A 37 37 ARG N N 37 108.362 110.613 -2.251 1
1 444 . 7 1 1 A 38 38 ARG H H 38 7.696 7.759 -0.063 1
1 445 . 7 1 1 A 38 38 ARG HA H 38 4.743 4.980 -0.237 1
1 452 . 7 1 1 A 38 38 ARG C C 38 173.513 174.380 -0.867 1
1 453 . 7 1 1 A 38 38 ARG CA C 38 54.507 54.723 -0.216 1
1 454 . 7 1 1 A 38 38 ARG CB C 38 33.751 33.665 0.086 1
1 456 . 7 1 1 A 38 38 ARG N N 38 118.370 118.546 -0.176 1
1 457 . 7 1 1 A 39 39 ILE H H 39 8.463 8.239 0.224 1
1 458 . 7 1 1 A 39 39 ILE HA H 39 4.184 4.234 -0.050 1
1 468 . 7 1 1 A 39 39 ILE C C 39 175.150 175.684 -0.534 1
1 469 . 7 1 1 A 39 39 ILE CA C 39 62.076 61.773 0.303 1
1 470 . 7 1 1 A 39 39 ILE CB C 39 38.864 39.254 -0.390 1
1 473 . 7 1 1 A 39 39 ILE N N 39 123.604 126.395 -2.791 1
1 474 . 7 1 1 A 40 40 LEU H H 40 8.239 8.263 -0.024 1
1 475 . 7 1 1 A 40 40 LEU HA H 40 4.259 4.463 -0.204 1
1 485 . 7 1 1 A 40 40 LEU C C 40 173.152 175.364 -2.212 1
1 486 . 7 1 1 A 40 40 LEU CA C 40 55.305 54.682 0.623 1
1 487 . 7 1 1 A 40 40 LEU CB C 40 43.113 41.674 1.439 1
1 490 . 7 1 1 A 40 40 LEU N N 40 129.550 128.820 0.730 1
1 491 . 7 1 1 A 41 41 ASP H H 41 8.992 8.418 0.574 1
1 492 . 7 1 1 A 41 41 ASP HA H 41 4.798 4.774 0.024 1
1 495 . 7 1 1 A 41 41 ASP C C 41 173.837 176.185 -2.348 1
1 496 . 7 1 1 A 41 41 ASP CA C 41 52.077 53.374 -1.297 1
1 497 . 7 1 1 A 41 41 ASP CB C 41 39.454 40.566 -1.112 1
1 498 . 7 1 1 A 41 41 ASP N N 41 127.022 127.766 -0.744 1
1 499 . 7 1 1 A 42 42 LEU H H 42 7.912 8.223 -0.311 1
1 500 . 7 1 1 A 42 42 LEU HA H 42 3.970 4.116 -0.146 1
1 510 . 7 1 1 A 42 42 LEU C C 42 176.305 177.732 -1.427 1
1 511 . 7 1 1 A 42 42 LEU CA C 42 58.128 57.887 0.241 1
1 512 . 7 1 1 A 42 42 LEU CB C 42 43.043 41.909 1.134 1
1 514 . 7 1 1 A 42 42 LEU N N 42 125.064 127.540 -2.476 1
1 515 . 7 1 1 A 43 43 TYR H H 43 8.565 8.419 0.146 1
1 516 . 7 1 1 A 43 43 TYR HA H 43 3.728 3.592 0.136 1
1 523 . 7 1 1 A 43 43 TYR C C 43 175.757 177.360 -1.603 1
1 524 . 7 1 1 A 43 43 TYR CA C 43 61.774 61.733 0.041 1
1 525 . 7 1 1 A 43 43 TYR CB C 43 38.235 37.986 0.249 1
1 528 . 7 1 1 A 43 43 TYR N N 43 117.822 120.328 -2.506 1
1 529 . 7 1 1 A 44 44 SER H H 44 8.115 8.248 -0.133 1
1 530 . 7 1 1 A 44 44 SER HA H 44 3.854 4.169 -0.315 1
1 533 . 7 1 1 A 44 44 SER C C 44 174.080 176.045 -1.965 1
1 534 . 7 1 1 A 44 44 SER CA C 44 61.873 61.892 -0.019 1
1 535 . 7 1 1 A 44 44 SER CB C 44 64.350 62.849 1.501 1
1 536 . 7 1 1 A 44 44 SER N N 44 116.835 115.809 1.026 1
1 537 . 7 1 1 A 45 45 LEU H H 45 8.401 7.834 0.567 1
1 538 . 7 1 1 A 45 45 LEU HA H 45 4.102 4.200 -0.098 1
1 548 . 7 1 1 A 45 45 LEU C C 45 175.081 179.000 -3.919 1
1 549 . 7 1 1 A 45 45 LEU CA C 45 58.896 57.868 1.028 1
1 550 . 7 1 1 A 45 45 LEU CB C 45 41.741 41.625 0.116 1
1 553 . 7 1 1 A 45 45 LEU N N 45 120.621 123.350 -2.729 1
1 554 . 7 1 1 A 46 46 SER H H 46 8.110 8.293 -0.183 1
1 555 . 7 1 1 A 46 46 SER HA H 46 4.300 4.183 0.117 1
1 558 . 7 1 1 A 46 46 SER C C 46 175.019 176.678 -1.659 1
1 559 . 7 1 1 A 46 46 SER CA C 46 62.610 62.035 0.575 1
1 560 . 7 1 1 A 46 46 SER CB C 46 64.092 62.847 1.245 1
1 561 . 7 1 1 A 46 46 SER N N 46 112.826 116.398 -3.572 1
1 562 . 7 1 1 A 47 47 LYS H H 47 7.732 8.025 -0.293 1
1 563 . 7 1 1 A 47 47 LYS HA H 47 3.900 4.135 -0.235 1
1 572 . 7 1 1 A 47 47 LYS C C 47 177.441 179.005 -1.564 1
1 573 . 7 1 1 A 47 47 LYS CA C 47 58.575 58.978 -0.403 1
1 574 . 7 1 1 A 47 47 LYS CB C 47 32.351 32.099 0.252 1
1 576 . 7 1 1 A 47 47 LYS N N 47 121.210 119.592 1.618 1
1 577 . 7 1 1 A 48 48 ILE H H 48 8.672 8.002 0.670 1
1 578 . 7 1 1 A 48 48 ILE HA H 48 3.628 3.666 -0.038 1
1 588 . 7 1 1 A 48 48 ILE C C 48 175.861 177.976 -2.115 1
1 589 . 7 1 1 A 48 48 ILE CA C 48 64.188 65.227 -1.039 1
1 590 . 7 1 1 A 48 48 ILE CB C 48 37.954 37.606 0.348 1
1 593 . 7 1 1 A 48 48 ILE N N 48 120.810 121.162 -0.352 1
1 594 . 7 1 1 A 49 49 VAL H H 49 8.030 8.297 -0.267 1
1 595 . 7 1 1 A 49 49 VAL HA H 49 3.195 3.659 -0.464 1
1 603 . 7 1 1 A 49 49 VAL C C 49 176.513 178.513 -2.000 1
1 604 . 7 1 1 A 49 49 VAL CA C 49 66.760 67.038 -0.278 1
1 605 . 7 1 1 A 49 49 VAL CB C 49 30.935 31.677 -0.742 1
1 608 . 7 1 1 A 49 49 VAL N N 49 119.350 119.665 -0.315 1
1 609 . 7 1 1 A 50 50 VAL H H 50 7.336 8.192 -0.856 1
1 610 . 7 1 1 A 50 50 VAL HA H 50 3.497 3.613 -0.116 1
1 618 . 7 1 1 A 50 50 VAL C C 50 178.745 178.123 0.622 1
1 619 . 7 1 1 A 50 50 VAL CA C 50 67.384 66.562 0.822 1
1 620 . 7 1 1 A 50 50 VAL CB C 50 31.832 31.568 0.264 1
1 621 . 7 1 1 A 50 50 VAL N N 50 118.610 120.865 -2.255 1
1 622 . 7 1 1 A 51 51 GLU H H 51 8.318 8.342 -0.024 1
1 623 . 7 1 1 A 51 51 GLU HA H 51 3.953 4.075 -0.122 1
1 628 . 7 1 1 A 51 51 GLU C C 51 177.281 179.178 -1.897 1
1 629 . 7 1 1 A 51 51 GLU CA C 51 59.668 59.101 0.567 1
1 630 . 7 1 1 A 51 51 GLU CB C 51 30.131 29.073 1.058 1
1 632 . 7 1 1 A 51 51 GLU N N 51 122.096 118.840 3.256 1
1 633 . 7 1 1 A 52 52 GLU H H 52 8.065 7.827 0.238 1
1 634 . 7 1 1 A 52 52 GLU HA H 52 4.229 4.312 -0.083 1
1 639 . 7 1 1 A 52 52 GLU C C 52 173.534 176.494 -2.960 1
1 640 . 7 1 1 A 52 52 GLU CA C 52 55.547 57.375 -1.828 1
1 641 . 7 1 1 A 52 52 GLU CB C 52 28.716 30.256 -1.540 1
1 643 . 7 1 1 A 52 52 GLU N N 52 114.992 117.840 -2.848 1
1 644 . 7 1 1 A 53 53 GLY H H 53 7.459 8.943 -1.484 1
1 645 . 7 1 1 A 53 53 GLY HA2 H 53 3.630 3.953 -0.323 1
1 646 . 7 1 1 A 53 53 GLY HA3 H 53 3.630 3.972 -0.342 1
1 647 . 7 1 1 A 53 53 GLY C C 53 173.214 173.677 -0.463 1
1 648 . 7 1 1 A 53 53 GLY CA C 53 44.962 45.142 -0.180 1
1 649 . 7 1 1 A 53 53 GLY N N 53 104.909 107.756 -2.847 1
1 650 . 7 1 1 A 54 54 GLY H H 54 8.533 7.646 0.887 1
1 651 . 7 1 1 A 54 54 GLY HA2 H 54 3.548 4.046 -0.498 1
1 652 . 7 1 1 A 54 54 GLY HA3 H 54 4.521 4.092 0.429 1
1 653 . 7 1 1 A 54 54 GLY C C 54 169.966 174.535 -4.569 1
1 654 . 7 1 1 A 54 54 GLY CA C 54 43.988 45.720 -1.732 1
1 655 . 7 1 1 A 54 54 GLY N N 54 110.587 107.967 2.620 1
1 656 . 7 1 1 A 55 55 TYR H H 55 8.704 8.773 -0.069 1
1 657 . 7 1 1 A 55 55 TYR HA H 55 3.618 3.873 -0.255 1
1 664 . 7 1 1 A 55 55 TYR C C 55 174.807 177.265 -2.458 1
1 665 . 7 1 1 A 55 55 TYR CA C 55 62.540 61.746 0.794 1
1 666 . 7 1 1 A 55 55 TYR CB C 55 39.669 39.427 0.242 1
1 669 . 7 1 1 A 55 55 TYR N N 55 119.168 122.180 -3.012 1
1 670 . 7 1 1 A 56 56 GLU H H 56 9.006 8.260 0.746 1
1 671 . 7 1 1 A 56 56 GLU HA H 56 3.638 3.595 0.043 1
1 676 . 7 1 1 A 56 56 GLU C C 56 177.400 178.257 -0.857 1
1 677 . 7 1 1 A 56 56 GLU CA C 56 60.530 59.499 1.031 1
1 678 . 7 1 1 A 56 56 GLU CB C 56 29.168 29.449 -0.281 1
1 679 . 7 1 1 A 56 56 GLU N N 56 118.969 119.360 -0.391 1
1 680 . 7 1 1 A 57 57 ALA H H 57 8.235 7.652 0.583 1
1 681 . 7 1 1 A 57 57 ALA HA H 57 3.980 3.942 0.038 1
1 685 . 7 1 1 A 57 57 ALA C C 57 177.678 179.833 -2.155 1
1 686 . 7 1 1 A 57 57 ALA CA C 57 54.910 55.103 -0.193 1
1 687 . 7 1 1 A 57 57 ALA CB C 57 18.122 17.874 0.248 1
1 688 . 7 1 1 A 57 57 ALA N N 57 122.860 121.405 1.455 1
1 689 . 7 1 1 A 58 58 ILE H H 58 7.831 7.309 0.522 1
1 690 . 7 1 1 A 58 58 ILE HA H 58 3.189 3.218 -0.029 1
1 700 . 7 1 1 A 58 58 ILE C C 58 177.818 177.458 0.360 1
1 701 . 7 1 1 A 58 58 ILE CA C 58 65.074 64.617 0.457 1
1 702 . 7 1 1 A 58 58 ILE CB C 58 38.178 36.840 1.338 1
1 706 . 7 1 1 A 58 58 ILE N N 58 117.418 118.835 -1.417 1
1 707 . 7 1 1 A 59 59 CYS H H 59 7.760 7.842 -0.082 1
1 708 . 7 1 1 A 59 59 CYS HA H 59 4.203 4.106 0.097 1
1 711 . 7 1 1 A 59 59 CYS C C 59 176.357 177.093 -0.736 1
1 712 . 7 1 1 A 59 59 CYS CA C 59 63.760 62.446 1.314 1
1 713 . 7 1 1 A 59 59 CYS CB C 59 27.638 26.631 1.007 1
1 714 . 7 1 1 A 59 59 CYS N N 59 115.302 120.528 -5.226 1
1 715 . 7 1 1 A 60 60 LYS H H 60 8.350 8.181 0.169 1
1 716 . 7 1 1 A 60 60 LYS HA H 60 3.972 3.988 -0.016 1
1 725 . 7 1 1 A 60 60 LYS C C 60 176.373 177.994 -1.621 1
1 726 . 7 1 1 A 60 60 LYS CA C 60 59.796 59.078 0.718 1
1 727 . 7 1 1 A 60 60 LYS CB C 60 32.560 32.049 0.511 1
1 729 . 7 1 1 A 60 60 LYS N N 60 122.343 120.030 2.313 1
1 730 . 7 1 1 A 61 61 ASP H H 61 8.157 7.994 0.163 1
1 731 . 7 1 1 A 61 61 ASP HA H 61 4.616 4.640 -0.024 1
1 734 . 7 1 1 A 61 61 ASP C C 61 173.246 175.082 -1.836 1
1 735 . 7 1 1 A 61 61 ASP CA C 61 54.272 53.652 0.620 1
1 736 . 7 1 1 A 61 61 ASP CB C 61 41.023 40.681 0.342 1
1 737 . 7 1 1 A 61 61 ASP N N 61 116.173 116.677 -0.504 1
1 738 . 7 1 1 A 62 62 ARG H H 62 7.655 7.816 -0.161 1
1 739 . 7 1 1 A 62 62 ARG HA H 62 4.149 3.995 0.154 1
1 746 . 7 1 1 A 62 62 ARG C C 62 175.891 176.006 -0.115 1
1 747 . 7 1 1 A 62 62 ARG CA C 62 57.381 57.168 0.213 1
1 748 . 7 1 1 A 62 62 ARG CB C 62 26.538 26.775 -0.237 1
1 750 . 7 1 1 A 62 62 ARG N N 62 117.213 115.295 1.918 1
1 751 . 7 1 1 A 63 63 ARG H H 63 8.302 7.982 0.320 1
1 752 . 7 1 1 A 63 63 ARG HA H 63 4.240 4.169 0.071 1
1 757 . 7 1 1 A 63 63 ARG C C 63 175.775 177.426 -1.651 1
1 758 . 7 1 1 A 63 63 ARG CA C 63 55.718 57.404 -1.686 1
1 760 . 7 1 1 A 63 63 ARG N N 63 116.292 117.757 -1.465 1
1 761 . 7 1 1 A 64 64 TRP H H 64 8.161 7.434 0.727 1
1 762 . 7 1 1 A 64 64 TRP HA H 64 3.836 4.344 -0.508 1
1 771 . 7 1 1 A 64 64 TRP C C 64 176.862 178.798 -1.936 1
1 772 . 7 1 1 A 64 64 TRP CA C 64 62.036 59.829 2.207 1
1 773 . 7 1 1 A 64 64 TRP CB C 64 27.028 28.880 -1.852 1
1 779 . 7 1 1 A 64 64 TRP N N 64 121.486 120.315 1.171 1
1 781 . 7 1 1 A 65 65 ALA H H 65 8.954 8.136 0.818 1
1 782 . 7 1 1 A 65 65 ALA HA H 65 4.290 4.075 0.215 1
1 786 . 7 1 1 A 65 65 ALA C C 65 178.986 180.031 -1.045 1
1 787 . 7 1 1 A 65 65 ALA CA C 65 55.314 55.479 -0.165 1
1 788 . 7 1 1 A 65 65 ALA CB C 65 18.119 18.070 0.049 1
1 789 . 7 1 1 A 65 65 ALA N N 65 121.559 122.719 -1.160 1
1 790 . 7 1 1 A 66 66 ARG H H 66 7.473 7.826 -0.353 1
1 791 . 7 1 1 A 66 66 ARG HA H 66 4.221 4.093 0.128 1
1 798 . 7 1 1 A 66 66 ARG C C 66 176.670 178.228 -1.558 1
1 799 . 7 1 1 A 66 66 ARG CA C 66 57.871 59.267 -1.396 1
1 800 . 7 1 1 A 66 66 ARG CB C 66 29.097 29.766 -0.669 1
1 801 . 7 1 1 A 66 66 ARG N N 66 119.915 119.431 0.484 1
1 802 . 7 1 1 A 67 67 VAL H H 67 7.134 7.963 -0.829 1
1 803 . 7 1 1 A 67 67 VAL HA H 67 3.304 3.867 -0.563 1
1 811 . 7 1 1 A 67 67 VAL C C 67 175.341 178.116 -2.775 1
1 812 . 7 1 1 A 67 67 VAL CA C 67 66.722 64.230 2.492 1
1 813 . 7 1 1 A 67 67 VAL CB C 67 31.108 31.919 -0.811 1
1 816 . 7 1 1 A 67 67 VAL N N 67 119.970 118.808 1.162 1
1 817 . 7 1 1 A 68 68 ALA H H 68 7.745 8.442 -0.697 1
1 818 . 7 1 1 A 68 68 ALA HA H 68 4.076 4.305 -0.229 1
1 822 . 7 1 1 A 68 68 ALA C C 68 177.358 179.944 -2.586 1
1 823 . 7 1 1 A 68 68 ALA CA C 68 55.607 56.022 -0.415 1
1 824 . 7 1 1 A 68 68 ALA CB C 68 18.061 18.204 -0.143 1
1 825 . 7 1 1 A 68 68 ALA N N 68 118.239 124.655 -6.416 1
1 826 . 7 1 1 A 69 69 GLN H H 69 7.979 8.195 -0.216 1
1 827 . 7 1 1 A 69 69 GLN HA H 69 4.310 4.133 0.177 1
1 834 . 7 1 1 A 69 69 GLN C C 69 179.370 177.673 1.697 1
1 835 . 7 1 1 A 69 69 GLN CA C 69 59.307 58.027 1.280 1
1 836 . 7 1 1 A 69 69 GLN CB C 69 29.257 28.506 0.751 1
1 838 . 7 1 1 A 69 69 GLN N N 69 118.484 117.112 1.372 1
1 840 . 7 1 1 A 70 70 ARG H H 70 8.374 8.036 0.338 1
1 841 . 7 1 1 A 70 70 ARG HA H 70 4.148 4.116 0.032 1
1 848 . 7 1 1 A 70 70 ARG C C 70 175.850 177.970 -2.120 1
1 849 . 7 1 1 A 70 70 ARG CA C 70 58.957 58.431 0.526 1
1 850 . 7 1 1 A 70 70 ARG CB C 70 29.799 30.100 -0.301 1
1 852 . 7 1 1 A 70 70 ARG N N 70 120.309 120.433 -0.124 1
1 853 . 7 1 1 A 71 71 LEU H H 71 7.413 7.704 -0.291 1
1 854 . 7 1 1 A 71 71 LEU HA H 71 4.341 4.379 -0.038 1
1 864 . 7 1 1 A 71 71 LEU C C 71 173.391 176.318 -2.927 1
1 865 . 7 1 1 A 71 71 LEU CA C 71 54.911 54.273 0.638 1
1 866 . 7 1 1 A 71 71 LEU CB C 71 42.693 42.133 0.560 1
1 867 . 7 1 1 A 71 71 LEU N N 71 118.841 119.862 -1.021 1
1 868 . 7 1 1 A 72 72 ASN H H 72 8.038 8.102 -0.064 1
1 869 . 7 1 1 A 72 72 ASN HA H 72 4.394 4.445 -0.051 1
1 874 . 7 1 1 A 72 72 ASN C C 72 173.042 174.468 -1.426 1
1 875 . 7 1 1 A 72 72 ASN CB C 72 36.412 36.385 0.027 1
1 876 . 7 1 1 A 72 72 ASN N N 72 112.919 117.883 -4.964 1
1 878 . 7 1 1 A 73 73 TYR H H 73 7.874 7.810 0.064 1
1 879 . 7 1 1 A 73 73 TYR HA H 73 4.868 4.577 0.291 1
1 886 . 7 1 1 A 73 73 TYR C C 73 172.194 174.225 -2.031 1
1 887 . 7 1 1 A 73 73 TYR CA C 73 57.105 56.816 0.289 1
1 888 . 7 1 1 A 73 73 TYR CB C 73 37.918 38.325 -0.407 1
1 889 . 7 1 1 A 73 73 TYR N N 73 117.432 120.162 -2.730 1
1 897 . 7 1 1 A 75 75 PRO HA H 75 4.626 4.247 0.379 1
1 902 . 7 1 1 A 75 75 PRO C C 75 175.728 177.267 -1.539 1
1 903 . 7 1 1 A 75 75 PRO CA C 75 62.502 63.735 -1.233 1
1 904 . 7 1 1 A 75 75 PRO CB C 75 32.339 31.967 0.372 1
1 905 . 7 1 1 A 76 76 GLY H H 76 8.369 8.876 -0.507 1
1 906 . 7 1 1 A 76 76 GLY HA2 H 76 4.057 3.916 0.141 1
1 907 . 7 1 1 A 76 76 GLY HA3 H 76 4.556 3.918 0.638 1
1 908 . 7 1 1 A 76 76 GLY C C 76 173.248 175.054 -1.806 1
1 909 . 7 1 1 A 76 76 GLY CA C 76 46.180 45.430 0.750 1
1 910 . 7 1 1 A 76 76 GLY N N 76 106.185 111.032 -4.847 1
1 911 . 7 1 1 A 77 77 LYS H H 77 8.632 8.171 0.461 1
1 912 . 7 1 1 A 77 77 LYS HA H 77 4.433 4.037 0.396 1
1 921 . 7 1 1 A 77 77 LYS C C 77 174.924 176.832 -1.908 1
1 922 . 7 1 1 A 77 77 LYS CA C 77 56.453 57.860 -1.407 1
1 923 . 7 1 1 A 77 77 LYS CB C 77 33.170 29.458 3.712 1
1 925 . 7 1 1 A 77 77 LYS N N 77 119.592 115.385 4.207 1
1 926 . 7 1 1 A 78 78 ASN H H 78 8.865 8.268 0.597 1
1 927 . 7 1 1 A 78 78 ASN HA H 78 4.654 4.454 0.200 1
1 932 . 7 1 1 A 78 78 ASN C C 78 174.869 176.845 -1.976 1
1 933 . 7 1 1 A 78 78 ASN CA C 78 54.117 55.611 -1.494 1
1 934 . 7 1 1 A 78 78 ASN CB C 78 37.841 37.042 0.799 1
1 935 . 7 1 1 A 78 78 ASN N N 78 116.880 116.469 0.411 1
1 937 . 7 1 1 A 79 79 ILE H H 79 8.008 8.164 -0.156 1
1 938 . 7 1 1 A 79 79 ILE HA H 79 3.718 3.672 0.046 1
1 948 . 7 1 1 A 79 79 ILE C C 79 175.921 178.356 -2.435 1
1 949 . 7 1 1 A 79 79 ILE CA C 79 63.618 64.597 -0.979 1
1 950 . 7 1 1 A 79 79 ILE CB C 79 37.158 37.173 -0.015 1
1 952 . 7 1 1 A 79 79 ILE N N 79 119.688 120.178 -0.490 1
1 953 . 7 1 1 A 80 80 GLY H H 80 9.062 8.103 0.959 1
1 954 . 7 1 1 A 80 80 GLY HA2 H 80 3.739 3.827 -0.088 1
1 955 . 7 1 1 A 80 80 GLY HA3 H 80 3.739 3.874 -0.135 1
1 956 . 7 1 1 A 80 80 GLY C C 80 173.185 175.977 -2.792 1
1 957 . 7 1 1 A 80 80 GLY CA C 80 48.166 47.546 0.620 1
1 958 . 7 1 1 A 80 80 GLY N N 80 110.338 109.070 1.268 1
1 959 . 7 1 1 A 81 81 SER H H 81 7.460 8.119 -0.659 1
1 960 . 7 1 1 A 81 81 SER HA H 81 3.904 4.148 -0.244 1
1 963 . 7 1 1 A 81 81 SER C C 81 174.999 177.184 -2.185 1
1 964 . 7 1 1 A 81 81 SER CA C 81 61.138 61.045 0.093 1
1 965 . 7 1 1 A 81 81 SER CB C 81 62.740 62.848 -0.108 1
1 966 . 7 1 1 A 81 81 SER N N 81 115.348 117.021 -1.673 1
1 967 . 7 1 1 A 82 82 LEU H H 82 7.367 7.566 -0.199 1
1 968 . 7 1 1 A 82 82 LEU HA H 82 3.946 4.140 -0.194 1
1 977 . 7 1 1 A 82 82 LEU C C 82 176.969 178.154 -1.185 1
1 978 . 7 1 1 A 82 82 LEU CA C 82 57.504 58.370 -0.866 1
1 979 . 7 1 1 A 82 82 LEU CB C 82 42.185 41.489 0.696 1
1 980 . 7 1 1 A 82 82 LEU N N 82 124.267 122.514 1.753 1
1 981 . 7 1 1 A 83 83 LEU H H 83 8.330 8.427 -0.097 1
1 982 . 7 1 1 A 83 83 LEU HA H 83 3.924 3.948 -0.024 1
1 991 . 7 1 1 A 83 83 LEU C C 83 176.303 178.265 -1.962 1
1 992 . 7 1 1 A 83 83 LEU CA C 83 58.067 58.450 -0.383 1
1 993 . 7 1 1 A 83 83 LEU CB C 83 41.061 41.547 -0.486 1
1 994 . 7 1 1 A 83 83 LEU N N 83 117.452 119.717 -2.265 1
1 995 . 7 1 1 A 84 84 ARG H H 84 7.651 8.162 -0.511 1
1 996 . 7 1 1 A 84 84 ARG HA H 84 2.230 3.537 -1.307 1
1 1003 . 7 1 1 A 84 84 ARG C C 84 175.902 178.210 -2.308 1
1 1004 . 7 1 1 A 84 84 ARG CA C 84 59.112 59.119 -0.007 1
1 1005 . 7 1 1 A 84 84 ARG CB C 84 28.579 29.370 -0.791 1
1 1007 . 7 1 1 A 84 84 ARG N N 84 119.586 119.597 -0.011 1
1 1008 . 7 1 1 A 85 85 SER H H 85 7.291 8.421 -1.130 1
1 1009 . 7 1 1 A 85 85 SER HA H 85 4.189 4.134 0.055 1
1 1012 . 7 1 1 A 85 85 SER C C 85 175.546 177.202 -1.656 1
1 1013 . 7 1 1 A 85 85 SER CA C 85 61.376 61.155 0.221 1
1 1014 . 7 1 1 A 85 85 SER CB C 85 62.805 62.124 0.681 1
1 1015 . 7 1 1 A 85 85 SER N N 85 112.921 115.326 -2.405 1
1 1016 . 7 1 1 A 86 86 HIS H H 86 8.156 7.723 0.433 1
1 1017 . 7 1 1 A 86 86 HIS HA H 86 4.782 4.181 0.601 1
1 1022 . 7 1 1 A 86 86 HIS C C 86 176.851 177.520 -0.669 1
1 1023 . 7 1 1 A 86 86 HIS CA C 86 58.898 59.648 -0.750 1
1 1024 . 7 1 1 A 86 86 HIS CB C 86 31.110 29.930 1.180 1
1 1027 . 7 1 1 A 86 86 HIS N N 86 119.258 118.663 0.595 1
1 1028 . 7 1 1 A 87 87 TYR H H 87 9.180 8.331 0.849 1
1 1029 . 7 1 1 A 87 87 TYR HA H 87 3.913 3.924 -0.011 1
1 1036 . 7 1 1 A 87 87 TYR C C 87 176.841 177.588 -0.747 1
1 1037 . 7 1 1 A 87 87 TYR CA C 87 63.526 61.821 1.705 1
1 1038 . 7 1 1 A 87 87 TYR CB C 87 39.431 38.312 1.119 1
1 1041 . 7 1 1 A 87 87 TYR N N 87 120.625 119.610 1.015 1
1 1042 . 7 1 1 A 88 88 GLU H H 88 9.028 8.554 0.474 1
1 1043 . 7 1 1 A 88 88 GLU HA H 88 3.682 3.963 -0.281 1
1 1048 . 7 1 1 A 88 88 GLU C C 88 175.833 177.657 -1.824 1
1 1049 . 7 1 1 A 88 88 GLU CA C 88 59.730 59.735 -0.005 1
1 1050 . 7 1 1 A 88 88 GLU CB C 88 30.009 29.520 0.489 1
1 1052 . 7 1 1 A 88 88 GLU N N 88 119.531 119.727 -0.196 1
1 1053 . 7 1 1 A 89 89 ARG H H 89 8.052 8.222 -0.170 1
1 1054 . 7 1 1 A 89 89 ARG HA H 89 4.292 4.627 -0.335 1
1 1061 . 7 1 1 A 89 89 ARG C C 89 176.045 176.536 -0.491 1
1 1062 . 7 1 1 A 89 89 ARG CA C 89 58.538 55.795 2.743 1
1 1063 . 7 1 1 A 89 89 ARG CB C 89 31.841 31.718 0.123 1
1 1065 . 7 1 1 A 89 89 ARG N N 89 114.741 117.429 -2.688 1
1 1066 . 7 1 1 A 90 90 ILE H H 90 8.141 7.602 0.539 1
1 1067 . 7 1 1 A 90 90 ILE HA H 90 4.296 3.789 0.507 1
1 1075 . 7 1 1 A 90 90 ILE C C 90 174.461 176.841 -2.380 1
1 1076 . 7 1 1 A 90 90 ILE CA C 90 63.649 62.551 1.098 1
1 1077 . 7 1 1 A 90 90 ILE CB C 90 40.626 39.806 0.820 1
1 1079 . 7 1 1 A 90 90 ILE N N 90 113.421 117.179 -3.758 1
1 1080 . 7 1 1 A 91 91 VAL H H 91 7.350 7.801 -0.451 1
1 1081 . 7 1 1 A 91 91 VAL HA H 91 4.144 3.923 0.221 1
1 1089 . 7 1 1 A 91 91 VAL C C 91 175.422 176.661 -1.239 1
1 1090 . 7 1 1 A 91 91 VAL CA C 91 65.042 63.191 1.851 1
1 1091 . 7 1 1 A 91 91 VAL CB C 91 33.215 31.644 1.571 1
1 1092 . 7 1 1 A 91 91 VAL N N 91 118.215 120.222 -2.007 1
1 1093 . 7 1 1 A 92 92 TYR H H 92 8.565 8.049 0.516 1
1 1094 . 7 1 1 A 92 92 TYR HA H 92 4.217 4.071 0.146 1
1 1099 . 7 1 1 A 92 92 TYR C C 92 171.495 175.178 -3.683 1
1 1100 . 7 1 1 A 92 92 TYR CA C 92 61.558 62.252 -0.694 1
1 1101 . 7 1 1 A 92 92 TYR CB C 92 36.757 37.499 -0.742 1
1 1102 . 7 1 1 A 92 92 TYR N N 92 121.370 122.618 -1.248 1
1 1103 . 7 1 1 A 93 93 PRO HA H 93 4.136 4.362 -0.226 1
1 1108 . 7 1 1 A 93 93 PRO C C 93 177.077 178.346 -1.269 1
1 1109 . 7 1 1 A 93 93 PRO CA C 93 66.037 65.964 0.073 1
1 1110 . 7 1 1 A 93 93 PRO CB C 93 31.482 30.785 0.697 1
1 1111 . 7 1 1 A 94 94 TYR H H 94 6.517 7.362 -0.845 1
1 1112 . 7 1 1 A 94 94 TYR HA H 94 2.798 4.294 -1.496 1
1 1119 . 7 1 1 A 94 94 TYR C C 94 174.985 178.071 -3.086 1
1 1120 . 7 1 1 A 94 94 TYR CA C 94 59.356 59.353 0.003 1
1 1121 . 7 1 1 A 94 94 TYR CB C 94 37.987 36.988 0.999 1
1 1124 . 7 1 1 A 94 94 TYR N N 94 115.987 117.572 -1.585 1
1 1125 . 7 1 1 A 95 95 GLU H H 95 8.205 8.222 -0.017 1
1 1126 . 7 1 1 A 95 95 GLU HA H 95 3.682 4.127 -0.445 1
1 1131 . 7 1 1 A 95 95 GLU C C 95 178.530 178.971 -0.441 1
1 1132 . 7 1 1 A 95 95 GLU CA C 95 58.910 59.707 -0.797 1
1 1133 . 7 1 1 A 95 95 GLU CB C 95 29.187 29.124 0.063 1
1 1134 . 7 1 1 A 95 95 GLU N N 95 119.946 121.365 -1.419 1
1 1135 . 7 1 1 A 96 96 MET H H 96 8.248 8.058 0.190 1
1 1136 . 7 1 1 A 96 96 MET HA H 96 4.172 4.418 -0.246 1
1 1142 . 7 1 1 A 96 96 MET C C 96 176.874 178.093 -1.219 1
1 1143 . 7 1 1 A 96 96 MET CA C 96 57.159 58.831 -1.672 1
1 1144 . 7 1 1 A 96 96 MET CB C 96 31.829 32.109 -0.280 1
1 1146 . 7 1 1 A 96 96 MET N N 96 117.570 119.262 -1.692 1
1 1147 . 7 1 1 A 97 97 TYR H H 97 7.445 8.217 -0.772 1
1 1148 . 7 1 1 A 97 97 TYR HA H 97 4.248 4.079 0.169 1
1 1155 . 7 1 1 A 97 97 TYR C C 97 176.476 177.310 -0.834 1
1 1156 . 7 1 1 A 97 97 TYR CA C 97 60.470 61.543 -1.073 1
1 1157 . 7 1 1 A 97 97 TYR CB C 97 38.612 38.271 0.341 1
1 1160 . 7 1 1 A 97 97 TYR N N 97 122.246 121.376 0.870 1
1 1161 . 7 1 1 A 98 98 GLN H H 98 8.087 8.681 -0.594 1
1 1162 . 7 1 1 A 98 98 GLN HA H 98 3.793 3.571 0.222 1
1 1169 . 7 1 1 A 98 98 GLN C C 98 175.549 178.003 -2.454 1
1 1170 . 7 1 1 A 98 98 GLN CA C 98 57.365 58.666 -1.301 1
1 1171 . 7 1 1 A 98 98 GLN CB C 98 28.901 28.864 0.037 1
1 1173 . 7 1 1 A 98 98 GLN N N 98 118.769 119.762 -0.993 1
1 1175 . 7 1 1 A 99 99 SER H H 99 7.724 8.655 -0.931 1
1 1176 . 7 1 1 A 99 99 SER HA H 99 4.293 4.152 0.141 1
1 1179 . 7 1 1 A 99 99 SER C C 99 173.696 177.113 -3.417 1
1 1180 . 7 1 1 A 99 99 SER CA C 99 59.566 61.300 -1.734 1
1 1181 . 7 1 1 A 99 99 SER CB C 99 63.847 62.285 1.562 1
1 1182 . 7 1 1 A 99 99 SER N N 99 113.257 115.505 -2.248 1
1 1183 . 7 1 1 A 100 100 GLY H H 100 7.751 8.343 -0.592 1
1 1184 . 7 1 1 A 100 100 GLY HA2 H 100 3.813 3.820 -0.007 1
1 1185 . 7 1 1 A 100 100 GLY HA3 H 100 3.934 3.822 0.112 1
1 1186 . 7 1 1 A 100 100 GLY C C 100 172.643 176.309 -3.666 1
1 1187 . 7 1 1 A 100 100 GLY CA C 100 45.570 47.122 -1.552 1
1 1188 . 7 1 1 A 100 100 GLY N N 100 109.750 110.386 -0.636 1
1 1189 . 7 1 1 A 101 101 ALA H H 101 7.824 7.829 -0.005 1
1 1190 . 7 1 1 A 101 101 ALA HA H 101 4.221 3.944 0.277 1
1 1194 . 7 1 1 A 101 101 ALA C C 101 175.639 178.577 -2.938 1
1 1195 . 7 1 1 A 101 101 ALA CA C 101 52.745 54.478 -1.733 1
1 1196 . 7 1 1 A 101 101 ALA CB C 101 19.437 18.462 0.975 1
1 1197 . 7 1 1 A 101 101 ALA N N 101 123.241 124.691 -1.450 1
1 1198 . 7 1 1 A 102 102 ASN H H 102 8.191 7.919 0.272 1
1 1199 . 7 1 1 A 102 102 ASN HA H 102 4.658 4.618 0.040 1
1 1204 . 7 1 1 A 102 102 ASN C C 102 173.337 175.051 -1.714 1
1 1205 . 7 1 1 A 102 102 ASN CA C 102 53.374 55.342 -1.968 1
1 1206 . 7 1 1 A 102 102 ASN CB C 102 38.819 39.227 -0.408 1
1 1207 . 7 1 1 A 102 102 ASN N N 102 116.572 115.891 0.681 1
1 1209 . 7 1 1 A 103 103 LEU H H 103 8.065 7.563 0.502 1
1 1210 . 7 1 1 A 103 103 LEU HA H 103 4.363 4.648 -0.285 1
1 1219 . 7 1 1 A 103 103 LEU C C 103 175.637 174.507 1.130 1
1 1220 . 7 1 1 A 103 103 LEU CA C 103 55.292 53.916 1.376 1
1 1221 . 7 1 1 A 103 103 LEU CB C 103 42.433 44.941 -2.508 1
1 1222 . 7 1 1 A 103 103 LEU N N 103 122.074 113.339 8.735 1
1 1223 . 7 1 1 A 104 104 VAL H H 104 8.055 9.081 -1.026 1
1 1224 . 7 1 1 A 104 104 VAL HA H 104 4.131 4.798 -0.667 1
1 1232 . 7 1 1 A 104 104 VAL C C 104 174.364 175.327 -0.963 1
1 1233 . 7 1 1 A 104 104 VAL CA C 104 62.552 60.464 2.088 1
1 1234 . 7 1 1 A 104 104 VAL CB C 104 32.766 34.261 -1.495 1
1 1235 . 7 1 1 A 104 104 VAL N N 104 120.606 122.035 -1.429 1
1 1236 . 7 1 1 A 105 105 CYS H H 105 8.392 8.944 -0.552 1
1 1237 . 7 1 1 A 105 105 CYS HA H 105 4.535 4.818 -0.283 1
1 1240 . 7 1 1 A 105 105 CYS C C 105 172.593 175.480 -2.887 1
1 1241 . 7 1 1 A 105 105 CYS CA C 105 58.449 58.274 0.175 1
1 1242 . 7 1 1 A 105 105 CYS CB C 105 27.952 29.063 -1.111 1
1 1243 . 7 1 1 A 105 105 CYS N N 105 122.791 129.825 -7.034 1
1 1244 . 7 1 1 A 106 106 ASN H H 106 8.575 8.074 0.501 1
1 1245 . 7 1 1 A 106 106 ASN HA H 106 4.843 5.114 -0.271 1
1 1250 . 7 1 1 A 106 106 ASN C C 106 173.594 176.188 -2.594 1
1 1251 . 7 1 1 A 106 106 ASN CA C 106 53.337 53.084 0.253 1
1 1252 . 7 1 1 A 106 106 ASN CB C 106 39.088 39.164 -0.076 1
1 1253 . 7 1 1 A 106 106 ASN N N 106 122.001 119.262 2.739 1
1 1255 . 7 1 1 A 107 107 THR H H 107 8.090 8.191 -0.101 1
1 1256 . 7 1 1 A 107 107 THR HA H 107 4.348 4.021 0.327 1
1 1261 . 7 1 1 A 107 107 THR C C 107 172.516 177.275 -4.759 1
1 1262 . 7 1 1 A 107 107 THR CA C 107 61.803 65.749 -3.946 1
1 1263 . 7 1 1 A 107 107 THR CB C 107 69.812 68.460 1.352 1
1 1265 . 7 1 1 A 107 107 THR N N 107 114.374 113.356 1.018 1
1 1266 . 7 1 1 A 108 108 ARG H H 108 8.322 8.086 0.236 1
1 1267 . 7 1 1 A 108 108 ARG HA H 108 4.634 4.229 0.405 1
1 1274 . 7 1 1 A 108 108 ARG C C 108 172.608 176.749 -4.141 1
1 1275 . 7 1 1 A 108 108 ARG CA C 108 54.026 61.206 -7.180 1
1 1276 . 7 1 1 A 108 108 ARG CB C 108 30.246 29.567 0.679 1
1 1278 . 7 1 1 A 108 108 ARG N N 108 124.017 121.902 2.115 1
1 1279 . 7 1 1 A 109 109 PRO HA H 109 4.354 4.491 -0.137 1
1 1286 . 7 1 1 A 109 109 PRO C C 109 174.978 179.412 -4.434 1
1 1287 . 7 1 1 A 109 109 PRO CA C 109 63.396 65.909 -2.513 1
1 1288 . 7 1 1 A 109 109 PRO CB C 109 32.046 31.214 0.832 1
1 1290 . 7 1 1 A 110 110 PHE H H 110 8.123 8.050 0.073 1
1 1291 . 7 1 1 A 110 110 PHE HA H 110 4.619 4.805 -0.186 1
1 1296 . 7 1 1 A 110 110 PHE C C 110 173.856 178.193 -4.337 1
1 1297 . 7 1 1 A 110 110 PHE CA C 110 57.353 61.311 -3.958 1
1 1298 . 7 1 1 A 110 110 PHE CB C 110 39.364 38.292 1.072 1
1 1301 . 7 1 1 A 110 110 PHE N N 110 119.265 116.825 2.440 1
1 1302 . 7 1 1 A 111 111 ASP H H 111 8.161 8.674 -0.513 1
1 1303 . 7 1 1 A 111 111 ASP HA H 111 4.613 4.382 0.231 1
1 1306 . 7 1 1 A 111 111 ASP C C 111 174.114 178.544 -4.430 1
1 1307 . 7 1 1 A 111 111 ASP CA C 111 54.350 57.786 -3.436 1
1 1308 . 7 1 1 A 111 111 ASP CB C 111 41.413 41.353 0.060 1
1 1309 . 7 1 1 A 111 111 ASP N N 111 121.764 119.789 1.975 1
1 1310 . 7 1 1 A 112 112 ASN H H 112 8.307 8.798 -0.491 1
1 1311 . 7 1 1 A 112 112 ASN HA H 112 4.662 4.457 0.205 1
1 1316 . 7 1 1 A 112 112 ASN C C 112 173.595 177.770 -4.175 1
1 1317 . 7 1 1 A 112 112 ASN CA C 112 53.486 56.662 -3.176 1
1 1318 . 7 1 1 A 112 112 ASN CB C 112 39.225 38.691 0.534 1
1 1319 . 7 1 1 A 112 112 ASN N N 112 119.154 117.746 1.408 1
1 1321 . 7 1 1 A 113 113 GLU H H 113 8.404 8.602 -0.198 1
1 1322 . 7 1 1 A 113 113 GLU HA H 113 4.264 4.114 0.150 1
1 1327 . 7 1 1 A 113 113 GLU C C 113 174.886 179.360 -4.474 1
1 1328 . 7 1 1 A 113 113 GLU CA C 113 56.681 59.393 -2.712 1
1 1329 . 7 1 1 A 113 113 GLU CB C 113 30.403 29.259 1.144 1
1 1331 . 7 1 1 A 113 113 GLU N N 113 120.943 118.930 2.013 1
1 1332 . 7 1 1 A 114 114 GLU H H 114 8.388 7.984 0.404 1
1 1333 . 7 1 1 A 114 114 GLU HA H 114 4.262 4.175 0.087 1
1 1338 . 7 1 1 A 114 114 GLU C C 114 174.819 176.490 -1.671 1
1 1339 . 7 1 1 A 114 114 GLU CA C 114 56.769 59.214 -2.445 1
1 1340 . 7 1 1 A 114 114 GLU CB C 114 30.125 30.322 -0.197 1
1 1342 . 7 1 1 A 114 114 GLU N N 114 121.869 119.303 2.566 1
1 1343 . 7 1 1 A 115 115 LYS H H 115 8.236 8.287 -0.051 1
1 1344 . 7 1 1 A 115 115 LYS HA H 115 4.347 4.520 -0.173 1
1 1353 . 7 1 1 A 115 115 LYS C C 115 174.633 175.825 -1.192 1
1 1354 . 7 1 1 A 115 115 LYS CA C 115 56.426 54.969 1.457 1
1 1355 . 7 1 1 A 115 115 LYS CB C 115 33.277 33.042 0.235 1
1 1359 . 7 1 1 A 115 115 LYS N N 115 121.997 117.393 4.604 1
1 1360 . 7 1 1 A 116 116 ASP H H 116 8.386 8.973 -0.587 1
1 1361 . 7 1 1 A 116 116 ASP HA H 116 4.600 4.627 -0.027 1
1 1364 . 7 1 1 A 116 116 ASP C C 116 173.448 176.653 -3.205 1
1 1365 . 7 1 1 A 116 116 ASP CA C 116 54.773 53.895 0.878 1
1 1366 . 7 1 1 A 116 116 ASP CB C 116 41.029 40.229 0.800 1
1 1367 . 7 1 1 A 116 116 ASP N N 116 121.057 124.932 -3.875 1
1 5 . 8 1 1 A 2 2 MET HA H 2 4.534 4.243 0.291 1
1 13 . 8 1 1 A 2 2 MET C C 2 174.355 178.156 -3.801 1
1 14 . 8 1 1 A 2 2 MET CA C 2 56.247 57.350 -1.103 1
1 15 . 8 1 1 A 2 2 MET CB C 2 32.855 30.673 2.182 1
1 18 . 8 1 1 A 3 3 ASN H H 3 8.600 8.295 0.305 1
1 19 . 8 1 1 A 3 3 ASN HA H 3 4.711 4.407 0.304 1
1 24 . 8 1 1 A 3 3 ASN C C 3 173.983 177.847 -3.864 1
1 25 . 8 1 1 A 3 3 ASN CA C 3 53.650 56.714 -3.064 1
1 26 . 8 1 1 A 3 3 ASN CB C 3 38.624 39.796 -1.172 1
1 27 . 8 1 1 A 3 3 ASN N N 3 120.149 118.929 1.220 1
1 29 . 8 1 1 A 4 4 GLU H H 4 8.495 7.955 0.540 1
1 30 . 8 1 1 A 4 4 GLU HA H 4 4.235 4.111 0.124 1
1 35 . 8 1 1 A 4 4 GLU C C 4 175.752 178.746 -2.994 1
1 36 . 8 1 1 A 4 4 GLU CA C 4 58.075 58.957 -0.882 1
1 37 . 8 1 1 A 4 4 GLU CB C 4 30.125 29.364 0.761 1
1 38 . 8 1 1 A 4 4 GLU N N 4 121.543 118.077 3.466 1
1 39 . 8 1 1 A 5 5 LEU HA H 5 4.073 4.227 -0.154 1
1 47 . 8 1 1 A 5 5 LEU CB C 5 41.897 42.377 -0.480 1
1 50 . 8 1 1 A 6 6 GLU H H 6 8.332 8.790 -0.458 1
1 51 . 8 1 1 A 6 6 GLU HA H 6 3.621 4.187 -0.566 1
1 52 . 8 1 1 A 6 6 GLU C C 6 176.402 179.469 -3.067 1
1 53 . 8 1 1 A 6 6 GLU CA C 6 58.461 58.978 -0.517 1
1 54 . 8 1 1 A 6 6 GLU CB C 6 29.730 29.124 0.606 1
1 55 . 8 1 1 A 6 6 GLU N N 6 121.462 118.122 3.340 1
1 56 . 8 1 1 A 7 7 ALA H H 7 8.244 7.673 0.571 1
1 57 . 8 1 1 A 7 7 ALA HA H 7 4.185 4.081 0.104 1
1 61 . 8 1 1 A 7 7 ALA C C 7 177.982 177.952 0.030 1
1 62 . 8 1 1 A 7 7 ALA CA C 7 54.791 55.133 -0.342 1
1 63 . 8 1 1 A 7 7 ALA CB C 7 18.836 18.913 -0.077 1
1 64 . 8 1 1 A 7 7 ALA N N 7 123.078 121.064 2.014 1
1 65 . 8 1 1 A 8 8 GLN H H 8 8.274 7.629 0.645 1
1 66 . 8 1 1 A 8 8 GLN HA H 8 4.219 4.787 -0.568 1
1 73 . 8 1 1 A 8 8 GLN C C 8 176.325 174.888 1.437 1
1 74 . 8 1 1 A 8 8 GLN CA C 8 57.864 54.425 3.439 1
1 75 . 8 1 1 A 8 8 GLN CB C 8 28.768 30.645 -1.877 1
1 77 . 8 1 1 A 8 8 GLN N N 8 117.452 116.075 1.377 1
1 79 . 8 1 1 A 9 9 THR H H 9 8.043 8.647 -0.604 1
1 80 . 8 1 1 A 9 9 THR HA H 9 3.998 4.761 -0.763 1
1 85 . 8 1 1 A 9 9 THR C C 9 173.904 174.366 -0.462 1
1 86 . 8 1 1 A 9 9 THR CA C 9 65.435 60.564 4.871 1
1 87 . 8 1 1 A 9 9 THR CB C 9 68.870 70.637 -1.767 1
1 89 . 8 1 1 A 9 9 THR N N 9 116.135 118.471 -2.336 1
1 90 . 8 1 1 A 10 10 ARG H H 10 8.095 8.953 -0.858 1
1 91 . 8 1 1 A 10 10 ARG HA H 10 4.040 3.947 0.093 1
1 98 . 8 1 1 A 10 10 ARG C C 10 176.583 175.516 1.067 1
1 99 . 8 1 1 A 10 10 ARG CA C 10 59.262 57.405 1.857 1
1 100 . 8 1 1 A 10 10 ARG CB C 10 29.900 27.510 2.390 1
1 101 . 8 1 1 A 10 10 ARG N N 10 121.157 122.133 -0.976 1
1 102 . 8 1 1 A 11 11 VAL H H 11 7.657 7.847 -0.190 1
1 103 . 8 1 1 A 11 11 VAL HA H 11 3.769 4.410 -0.641 1
1 111 . 8 1 1 A 11 11 VAL C C 11 176.662 177.755 -1.093 1
1 112 . 8 1 1 A 11 11 VAL CA C 11 65.914 63.830 2.084 1
1 113 . 8 1 1 A 11 11 VAL CB C 11 31.745 33.503 -1.758 1
1 114 . 8 1 1 A 11 11 VAL N N 11 118.580 117.770 0.810 1
1 115 . 8 1 1 A 12 12 LYS H H 12 7.471 8.373 -0.902 1
1 116 . 8 1 1 A 12 12 LYS HA H 12 3.366 4.337 -0.971 1
1 123 . 8 1 1 A 12 12 LYS C C 12 176.457 179.120 -2.663 1
1 124 . 8 1 1 A 12 12 LYS CA C 12 59.545 59.272 0.273 1
1 125 . 8 1 1 A 12 12 LYS CB C 12 32.206 32.225 -0.019 1
1 126 . 8 1 1 A 12 12 LYS N N 12 121.835 122.687 -0.852 1
1 127 . 8 1 1 A 13 13 LEU H H 13 8.144 7.963 0.181 1
1 128 . 8 1 1 A 13 13 LEU HA H 13 4.093 3.948 0.145 1
1 137 . 8 1 1 A 13 13 LEU C C 13 178.254 179.013 -0.759 1
1 138 . 8 1 1 A 13 13 LEU CA C 13 58.023 57.855 0.168 1
1 139 . 8 1 1 A 13 13 LEU CB C 13 41.283 41.930 -0.647 1
1 140 . 8 1 1 A 13 13 LEU N N 13 118.688 120.553 -1.865 1
1 141 . 8 1 1 A 14 14 ASN H H 14 8.384 8.630 -0.246 1
1 142 . 8 1 1 A 14 14 ASN HA H 14 4.567 4.431 0.136 1
1 147 . 8 1 1 A 14 14 ASN C C 14 175.397 177.078 -1.681 1
1 148 . 8 1 1 A 14 14 ASN CA C 14 56.239 56.507 -0.268 1
1 149 . 8 1 1 A 14 14 ASN CB C 14 38.432 39.214 -0.782 1
1 150 . 8 1 1 A 14 14 ASN N N 14 118.175 117.451 0.724 1
1 152 . 8 1 1 A 15 15 TYR H H 15 7.982 7.875 0.107 1
1 153 . 8 1 1 A 15 15 TYR HA H 15 4.249 4.132 0.117 1
1 160 . 8 1 1 A 15 15 TYR C C 15 175.503 177.383 -1.880 1
1 161 . 8 1 1 A 15 15 TYR CA C 15 62.450 61.468 0.982 1
1 162 . 8 1 1 A 15 15 TYR CB C 15 39.399 38.632 0.767 1
1 163 . 8 1 1 A 15 15 TYR N N 15 121.955 120.325 1.630 1
1 164 . 8 1 1 A 16 16 LEU H H 16 8.198 8.656 -0.458 1
1 165 . 8 1 1 A 16 16 LEU HA H 16 4.470 3.916 0.554 1
1 175 . 8 1 1 A 16 16 LEU C C 16 177.125 177.750 -0.625 1
1 176 . 8 1 1 A 16 16 LEU CA C 16 57.374 58.074 -0.700 1
1 177 . 8 1 1 A 16 16 LEU CB C 16 41.443 41.538 -0.095 1
1 178 . 8 1 1 A 16 16 LEU N N 16 117.642 121.538 -3.896 1
1 179 . 8 1 1 A 17 17 ASP H H 17 8.061 8.115 -0.054 1
1 180 . 8 1 1 A 17 17 ASP C C 17 177.836 178.077 -0.241 1
1 181 . 8 1 1 A 17 17 ASP CA C 17 57.486 57.821 -0.335 1
1 182 . 8 1 1 A 17 17 ASP CB C 17 41.433 42.150 -0.717 1
1 183 . 8 1 1 A 17 17 ASP N N 17 118.700 119.014 -0.314 1
1 184 . 8 1 1 A 18 18 GLN H H 18 8.111 7.764 0.347 1
1 185 . 8 1 1 A 18 18 GLN HA H 18 4.002 4.061 -0.059 1
1 190 . 8 1 1 A 18 18 GLN CA C 18 59.046 58.731 0.315 1
1 191 . 8 1 1 A 18 18 GLN CB C 18 28.700 28.552 0.148 1
1 193 . 8 1 1 A 18 18 GLN N N 18 119.539 118.690 0.849 1
1 195 . 8 1 1 A 19 19 ILE H H 19 8.330 8.140 0.190 1
1 196 . 8 1 1 A 19 19 ILE HA H 19 3.306 3.740 -0.434 1
1 204 . 8 1 1 A 19 19 ILE C C 19 175.608 177.535 -1.927 1
1 205 . 8 1 1 A 19 19 ILE CA C 19 64.760 63.196 1.564 1
1 206 . 8 1 1 A 19 19 ILE CB C 19 37.148 37.032 0.116 1
1 209 . 8 1 1 A 19 19 ILE N N 19 121.490 119.852 1.638 1
1 210 . 8 1 1 A 20 20 ALA H H 20 8.057 7.935 0.122 1
1 211 . 8 1 1 A 20 20 ALA HA H 20 4.349 4.284 0.065 1
1 215 . 8 1 1 A 20 20 ALA C C 20 179.297 179.552 -0.255 1
1 216 . 8 1 1 A 20 20 ALA CA C 20 56.150 54.782 1.368 1
1 217 . 8 1 1 A 20 20 ALA CB C 20 18.104 18.653 -0.549 1
1 218 . 8 1 1 A 20 20 ALA N N 20 124.441 123.837 0.604 1
1 219 . 8 1 1 A 21 21 LYS H H 21 8.116 7.869 0.247 1
1 220 . 8 1 1 A 21 21 LYS HA H 21 4.108 4.109 -0.001 1
1 229 . 8 1 1 A 21 21 LYS C C 21 176.720 178.395 -1.675 1
1 230 . 8 1 1 A 21 21 LYS CA C 21 59.166 59.357 -0.191 1
1 231 . 8 1 1 A 21 21 LYS CB C 21 32.085 32.502 -0.417 1
1 233 . 8 1 1 A 21 21 LYS N N 21 119.865 118.523 1.342 1
1 234 . 8 1 1 A 22 22 PHE H H 22 7.875 8.368 -0.493 1
1 235 . 8 1 1 A 22 22 PHE HA H 22 4.012 4.070 -0.058 1
1 242 . 8 1 1 A 22 22 PHE C C 22 175.545 177.367 -1.822 1
1 243 . 8 1 1 A 22 22 PHE CA C 22 61.070 61.487 -0.417 1
1 244 . 8 1 1 A 22 22 PHE CB C 22 39.072 38.677 0.395 1
1 249 . 8 1 1 A 22 22 PHE N N 22 119.729 120.017 -0.288 1
1 250 . 8 1 1 A 23 23 TRP H H 23 7.841 7.890 -0.049 1
1 251 . 8 1 1 A 23 23 TRP HA H 23 4.149 4.147 0.002 1
1 260 . 8 1 1 A 23 23 TRP C C 23 176.668 178.024 -1.356 1
1 261 . 8 1 1 A 23 23 TRP CB C 23 28.543 29.681 -1.138 1
1 267 . 8 1 1 A 23 23 TRP N N 23 119.440 120.742 -1.302 1
1 269 . 8 1 1 A 24 24 GLU H H 24 8.261 8.021 0.240 1
1 270 . 8 1 1 A 24 24 GLU HA H 24 4.265 4.314 -0.049 1
1 275 . 8 1 1 A 24 24 GLU C C 24 179.679 178.877 0.802 1
1 276 . 8 1 1 A 24 24 GLU CA C 24 59.706 59.050 0.656 1
1 277 . 8 1 1 A 24 24 GLU CB C 24 29.720 29.437 0.283 1
1 279 . 8 1 1 A 24 24 GLU N N 24 121.376 118.683 2.693 1
1 280 . 8 1 1 A 25 25 ILE H H 25 8.071 8.040 0.031 1
1 281 . 8 1 1 A 25 25 ILE HA H 25 3.815 3.839 -0.024 1
1 291 . 8 1 1 A 25 25 ILE C C 25 176.343 176.683 -0.340 1
1 292 . 8 1 1 A 25 25 ILE CA C 25 64.464 62.671 1.793 1
1 293 . 8 1 1 A 25 25 ILE CB C 25 37.371 37.476 -0.105 1
1 296 . 8 1 1 A 25 25 ILE N N 25 121.499 119.302 2.197 1
1 297 . 8 1 1 A 26 26 GLN H H 26 7.327 7.379 -0.052 1
1 298 . 8 1 1 A 26 26 GLN HA H 26 4.074 4.173 -0.099 1
1 305 . 8 1 1 A 26 26 GLN C C 26 174.906 175.775 -0.869 1
1 306 . 8 1 1 A 26 26 GLN CA C 26 55.450 55.361 0.089 1
1 307 . 8 1 1 A 26 26 GLN CB C 26 28.458 28.220 0.238 1
1 309 . 8 1 1 A 26 26 GLN N N 26 116.532 119.128 -2.596 1
1 311 . 8 1 1 A 27 27 GLY H H 27 7.861 8.062 -0.201 1
1 312 . 8 1 1 A 27 27 GLY HA2 H 27 4.297 3.798 0.499 1
1 313 . 8 1 1 A 27 27 GLY HA3 H 27 3.823 3.802 0.021 1
1 314 . 8 1 1 A 27 27 GLY C C 27 172.698 173.323 -0.625 1
1 315 . 8 1 1 A 27 27 GLY CA C 27 45.608 46.182 -0.574 1
1 316 . 8 1 1 A 27 27 GLY N N 27 106.837 109.334 -2.497 1
1 317 . 8 1 1 A 28 28 SER H H 28 8.083 7.095 0.988 1
1 318 . 8 1 1 A 28 28 SER HA H 28 4.777 4.750 0.027 1
1 321 . 8 1 1 A 28 28 SER C C 28 171.196 171.869 -0.673 1
1 322 . 8 1 1 A 28 28 SER CA C 28 56.041 56.925 -0.884 1
1 323 . 8 1 1 A 28 28 SER CB C 28 64.539 66.816 -2.277 1
1 324 . 8 1 1 A 28 28 SER N N 28 116.151 114.519 1.632 1
1 325 . 8 1 1 A 29 29 SER H H 29 8.354 8.308 0.046 1
1 326 . 8 1 1 A 29 29 SER HA H 29 4.389 4.977 -0.588 1
1 329 . 8 1 1 A 29 29 SER C C 29 172.166 172.437 -0.271 1
1 330 . 8 1 1 A 29 29 SER CA C 29 58.107 56.764 1.343 1
1 331 . 8 1 1 A 29 29 SER CB C 29 63.853 66.110 -2.257 1
1 332 . 8 1 1 A 29 29 SER N N 29 116.596 114.314 2.282 1
1 333 . 8 1 1 A 30 30 LEU H H 30 8.990 8.490 0.500 1
1 334 . 8 1 1 A 30 30 LEU HA H 30 3.964 5.093 -1.129 1
1 344 . 8 1 1 A 30 30 LEU C C 30 173.752 175.641 -1.889 1
1 345 . 8 1 1 A 30 30 LEU CA C 30 55.193 55.241 -0.048 1
1 346 . 8 1 1 A 30 30 LEU CB C 30 42.869 43.290 -0.421 1
1 349 . 8 1 1 A 30 30 LEU N N 30 125.860 126.983 -1.123 1
1 350 . 8 1 1 A 31 31 LYS H H 31 8.118 8.764 -0.646 1
1 351 . 8 1 1 A 31 31 LYS HA H 31 4.498 4.831 -0.333 1
1 360 . 8 1 1 A 31 31 LYS C C 31 173.555 174.796 -1.241 1
1 361 . 8 1 1 A 31 31 LYS CA C 31 54.372 55.266 -0.894 1
1 362 . 8 1 1 A 31 31 LYS CB C 31 32.814 34.636 -1.822 1
1 365 . 8 1 1 A 31 31 LYS N N 31 129.965 127.058 2.907 1
1 366 . 8 1 1 A 32 32 ILE H H 32 8.717 8.653 0.064 1
1 367 . 8 1 1 A 32 32 ILE HA H 32 4.011 4.808 -0.797 1
1 377 . 8 1 1 A 32 32 ILE C C 32 173.038 175.276 -2.238 1
1 378 . 8 1 1 A 32 32 ILE CA C 32 59.921 57.242 2.679 1
1 379 . 8 1 1 A 32 32 ILE CB C 32 38.139 39.764 -1.625 1
1 382 . 8 1 1 A 32 32 ILE N N 32 127.091 122.813 4.278 1
1 383 . 8 1 1 A 33 33 PRO HA H 33 4.412 4.579 -0.167 1
1 390 . 8 1 1 A 33 33 PRO C C 33 172.724 175.715 -2.991 1
1 391 . 8 1 1 A 33 33 PRO CA C 33 62.565 62.113 0.452 1
1 392 . 8 1 1 A 33 33 PRO CB C 33 32.728 32.878 -0.150 1
1 394 . 8 1 1 A 34 34 ASN H H 34 8.265 8.628 -0.363 1
1 395 . 8 1 1 A 34 34 ASN HA H 34 5.147 5.559 -0.412 1
1 400 . 8 1 1 A 34 34 ASN C C 34 174.079 173.404 0.675 1
1 401 . 8 1 1 A 34 34 ASN CA C 34 52.088 51.429 0.659 1
1 402 . 8 1 1 A 34 34 ASN CB C 34 40.387 43.245 -2.858 1
1 403 . 8 1 1 A 34 34 ASN N N 34 116.424 115.748 0.676 1
1 405 . 8 1 1 A 35 35 VAL H H 35 8.904 8.862 0.042 1
1 406 . 8 1 1 A 35 35 VAL HA H 35 4.159 4.336 -0.177 1
1 414 . 8 1 1 A 35 35 VAL C C 35 173.834 174.480 -0.646 1
1 415 . 8 1 1 A 35 35 VAL CA C 35 61.953 60.216 1.737 1
1 416 . 8 1 1 A 35 35 VAL CB C 35 34.432 34.741 -0.309 1
1 419 . 8 1 1 A 35 35 VAL N N 35 122.778 118.307 4.471 1
1 420 . 8 1 1 A 36 36 GLU H H 36 9.560 9.438 0.122 1
1 421 . 8 1 1 A 36 36 GLU HA H 36 3.819 4.046 -0.227 1
1 426 . 8 1 1 A 36 36 GLU C C 36 173.604 176.456 -2.852 1
1 427 . 8 1 1 A 36 36 GLU CA C 36 57.131 57.972 -0.841 1
1 428 . 8 1 1 A 36 36 GLU CB C 36 27.464 28.055 -0.591 1
1 430 . 8 1 1 A 36 36 GLU N N 36 127.014 127.839 -0.825 1
1 431 . 8 1 1 A 37 37 ARG H H 37 8.578 8.603 -0.025 1
1 432 . 8 1 1 A 37 37 ARG HA H 37 3.792 3.997 -0.205 1
1 439 . 8 1 1 A 37 37 ARG C C 37 173.371 175.447 -2.076 1
1 440 . 8 1 1 A 37 37 ARG CA C 37 57.952 57.316 0.636 1
1 441 . 8 1 1 A 37 37 ARG CB C 37 27.657 27.957 -0.300 1
1 443 . 8 1 1 A 37 37 ARG N N 37 108.362 117.682 -9.320 1
1 444 . 8 1 1 A 38 38 ARG H H 38 7.696 7.985 -0.289 1
1 445 . 8 1 1 A 38 38 ARG HA H 38 4.743 5.019 -0.276 1
1 452 . 8 1 1 A 38 38 ARG C C 38 173.513 175.400 -1.887 1
1 453 . 8 1 1 A 38 38 ARG CA C 38 54.507 54.467 0.040 1
1 454 . 8 1 1 A 38 38 ARG CB C 38 33.751 33.279 0.472 1
1 456 . 8 1 1 A 38 38 ARG N N 38 118.370 120.990 -2.620 1
1 457 . 8 1 1 A 39 39 ILE H H 39 8.463 8.537 -0.074 1
1 458 . 8 1 1 A 39 39 ILE HA H 39 4.184 4.202 -0.018 1
1 468 . 8 1 1 A 39 39 ILE C C 39 175.150 175.832 -0.682 1
1 469 . 8 1 1 A 39 39 ILE CA C 39 62.076 61.795 0.281 1
1 470 . 8 1 1 A 39 39 ILE CB C 39 38.864 39.408 -0.544 1
1 473 . 8 1 1 A 39 39 ILE N N 39 123.604 127.106 -3.502 1
1 474 . 8 1 1 A 40 40 LEU H H 40 8.239 8.195 0.044 1
1 475 . 8 1 1 A 40 40 LEU HA H 40 4.259 4.761 -0.502 1
1 485 . 8 1 1 A 40 40 LEU C C 40 173.152 175.388 -2.236 1
1 486 . 8 1 1 A 40 40 LEU CA C 40 55.305 54.669 0.636 1
1 487 . 8 1 1 A 40 40 LEU CB C 40 43.113 41.640 1.473 1
1 490 . 8 1 1 A 40 40 LEU N N 40 129.550 128.973 0.577 1
1 491 . 8 1 1 A 41 41 ASP H H 41 8.992 8.484 0.508 1
1 492 . 8 1 1 A 41 41 ASP HA H 41 4.798 4.733 0.065 1
1 495 . 8 1 1 A 41 41 ASP C C 41 173.837 176.196 -2.359 1
1 496 . 8 1 1 A 41 41 ASP CA C 41 52.077 53.428 -1.351 1
1 497 . 8 1 1 A 41 41 ASP CB C 41 39.454 40.596 -1.142 1
1 498 . 8 1 1 A 41 41 ASP N N 41 127.022 127.761 -0.739 1
1 499 . 8 1 1 A 42 42 LEU H H 42 7.912 8.206 -0.294 1
1 500 . 8 1 1 A 42 42 LEU HA H 42 3.970 4.100 -0.130 1
1 510 . 8 1 1 A 42 42 LEU C C 42 176.305 177.818 -1.513 1
1 511 . 8 1 1 A 42 42 LEU CA C 42 58.128 57.860 0.268 1
1 512 . 8 1 1 A 42 42 LEU CB C 42 43.043 41.853 1.190 1
1 514 . 8 1 1 A 42 42 LEU N N 42 125.064 127.535 -2.471 1
1 515 . 8 1 1 A 43 43 TYR H H 43 8.565 8.451 0.114 1
1 516 . 8 1 1 A 43 43 TYR HA H 43 3.728 3.839 -0.111 1
1 523 . 8 1 1 A 43 43 TYR C C 43 175.757 177.289 -1.532 1
1 524 . 8 1 1 A 43 43 TYR CA C 43 61.774 61.754 0.020 1
1 525 . 8 1 1 A 43 43 TYR CB C 43 38.235 38.259 -0.024 1
1 528 . 8 1 1 A 43 43 TYR N N 43 117.822 120.536 -2.714 1
1 529 . 8 1 1 A 44 44 SER H H 44 8.115 8.268 -0.153 1
1 530 . 8 1 1 A 44 44 SER HA H 44 3.854 4.164 -0.310 1
1 533 . 8 1 1 A 44 44 SER C C 44 174.080 177.280 -3.200 1
1 534 . 8 1 1 A 44 44 SER CA C 44 61.873 61.353 0.520 1
1 535 . 8 1 1 A 44 44 SER CB C 44 64.350 62.894 1.456 1
1 536 . 8 1 1 A 44 44 SER N N 44 116.835 114.009 2.826 1
1 537 . 8 1 1 A 45 45 LEU H H 45 8.401 8.229 0.172 1
1 538 . 8 1 1 A 45 45 LEU HA H 45 4.102 4.191 -0.089 1
1 548 . 8 1 1 A 45 45 LEU C C 45 175.081 178.751 -3.670 1
1 549 . 8 1 1 A 45 45 LEU CA C 45 58.896 57.827 1.069 1
1 550 . 8 1 1 A 45 45 LEU CB C 45 41.741 41.510 0.231 1
1 553 . 8 1 1 A 45 45 LEU N N 45 120.621 122.861 -2.240 1
1 554 . 8 1 1 A 46 46 SER H H 46 8.110 8.471 -0.361 1
1 555 . 8 1 1 A 46 46 SER HA H 46 4.300 4.208 0.092 1
1 558 . 8 1 1 A 46 46 SER C C 46 175.019 176.705 -1.686 1
1 559 . 8 1 1 A 46 46 SER CA C 46 62.610 61.727 0.883 1
1 560 . 8 1 1 A 46 46 SER CB C 46 64.092 63.135 0.957 1
1 561 . 8 1 1 A 46 46 SER N N 46 112.826 114.881 -2.055 1
1 562 . 8 1 1 A 47 47 LYS H H 47 7.732 8.019 -0.287 1
1 563 . 8 1 1 A 47 47 LYS HA H 47 3.900 4.147 -0.247 1
1 572 . 8 1 1 A 47 47 LYS C C 47 177.441 179.023 -1.582 1
1 573 . 8 1 1 A 47 47 LYS CA C 47 58.575 59.033 -0.458 1
1 574 . 8 1 1 A 47 47 LYS CB C 47 32.351 32.267 0.084 1
1 576 . 8 1 1 A 47 47 LYS N N 47 121.210 119.078 2.132 1
1 577 . 8 1 1 A 48 48 ILE H H 48 8.672 8.070 0.602 1
1 578 . 8 1 1 A 48 48 ILE HA H 48 3.628 3.685 -0.057 1
1 588 . 8 1 1 A 48 48 ILE C C 48 175.861 177.940 -2.079 1
1 589 . 8 1 1 A 48 48 ILE CA C 48 64.188 65.246 -1.058 1
1 590 . 8 1 1 A 48 48 ILE CB C 48 37.954 37.671 0.283 1
1 593 . 8 1 1 A 48 48 ILE N N 48 120.810 121.187 -0.377 1
1 594 . 8 1 1 A 49 49 VAL H H 49 8.030 8.328 -0.298 1
1 595 . 8 1 1 A 49 49 VAL HA H 49 3.195 3.685 -0.490 1
1 603 . 8 1 1 A 49 49 VAL C C 49 176.513 178.510 -1.997 1
1 604 . 8 1 1 A 49 49 VAL CA C 49 66.760 66.831 -0.071 1
1 605 . 8 1 1 A 49 49 VAL CB C 49 30.935 31.788 -0.853 1
1 608 . 8 1 1 A 49 49 VAL N N 49 119.350 119.674 -0.324 1
1 609 . 8 1 1 A 50 50 VAL H H 50 7.336 8.260 -0.924 1
1 610 . 8 1 1 A 50 50 VAL HA H 50 3.497 3.612 -0.115 1
1 618 . 8 1 1 A 50 50 VAL C C 50 178.745 177.533 1.212 1
1 619 . 8 1 1 A 50 50 VAL CA C 50 67.384 66.615 0.769 1
1 620 . 8 1 1 A 50 50 VAL CB C 50 31.832 31.384 0.448 1
1 621 . 8 1 1 A 50 50 VAL N N 50 118.610 120.844 -2.234 1
1 622 . 8 1 1 A 51 51 GLU H H 51 8.318 8.726 -0.408 1
1 623 . 8 1 1 A 51 51 GLU HA H 51 3.953 3.952 0.001 1
1 628 . 8 1 1 A 51 51 GLU C C 51 177.281 179.428 -2.147 1
1 629 . 8 1 1 A 51 51 GLU CA C 51 59.668 59.899 -0.231 1
1 630 . 8 1 1 A 51 51 GLU CB C 51 30.131 29.271 0.860 1
1 632 . 8 1 1 A 51 51 GLU N N 51 122.096 118.497 3.599 1
1 633 . 8 1 1 A 52 52 GLU H H 52 8.065 8.122 -0.057 1
1 634 . 8 1 1 A 52 52 GLU HA H 52 4.229 4.206 0.023 1
1 639 . 8 1 1 A 52 52 GLU C C 52 173.534 176.816 -3.282 1
1 640 . 8 1 1 A 52 52 GLU CA C 52 55.547 56.537 -0.990 1
1 641 . 8 1 1 A 52 52 GLU CB C 52 28.716 29.825 -1.109 1
1 643 . 8 1 1 A 52 52 GLU N N 52 114.992 117.196 -2.204 1
1 644 . 8 1 1 A 53 53 GLY H H 53 7.459 9.279 -1.820 1
1 645 . 8 1 1 A 53 53 GLY HA2 H 53 3.630 3.966 -0.336 1
1 646 . 8 1 1 A 53 53 GLY HA3 H 53 3.630 3.987 -0.357 1
1 647 . 8 1 1 A 53 53 GLY C C 53 173.214 173.684 -0.470 1
1 648 . 8 1 1 A 53 53 GLY CA C 53 44.962 45.160 -0.198 1
1 649 . 8 1 1 A 53 53 GLY N N 53 104.909 107.845 -2.936 1
1 650 . 8 1 1 A 54 54 GLY H H 54 8.533 7.702 0.831 1
1 651 . 8 1 1 A 54 54 GLY HA2 H 54 3.548 4.078 -0.530 1
1 652 . 8 1 1 A 54 54 GLY HA3 H 54 4.521 4.135 0.386 1
1 653 . 8 1 1 A 54 54 GLY C C 54 169.966 174.600 -4.634 1
1 654 . 8 1 1 A 54 54 GLY CA C 54 43.988 45.778 -1.790 1
1 655 . 8 1 1 A 54 54 GLY N N 54 110.587 108.418 2.169 1
1 656 . 8 1 1 A 55 55 TYR H H 55 8.704 9.210 -0.506 1
1 657 . 8 1 1 A 55 55 TYR HA H 55 3.618 3.895 -0.277 1
1 664 . 8 1 1 A 55 55 TYR C C 55 174.807 177.310 -2.503 1
1 665 . 8 1 1 A 55 55 TYR CA C 55 62.540 61.590 0.950 1
1 666 . 8 1 1 A 55 55 TYR CB C 55 39.669 39.277 0.392 1
1 669 . 8 1 1 A 55 55 TYR N N 55 119.168 123.607 -4.439 1
1 670 . 8 1 1 A 56 56 GLU H H 56 9.006 8.368 0.638 1
1 671 . 8 1 1 A 56 56 GLU HA H 56 3.638 3.536 0.102 1
1 676 . 8 1 1 A 56 56 GLU C C 56 177.400 178.347 -0.947 1
1 677 . 8 1 1 A 56 56 GLU CA C 56 60.530 59.459 1.071 1
1 678 . 8 1 1 A 56 56 GLU CB C 56 29.168 29.590 -0.422 1
1 679 . 8 1 1 A 56 56 GLU N N 56 118.969 119.583 -0.614 1
1 680 . 8 1 1 A 57 57 ALA H H 57 8.235 7.640 0.595 1
1 681 . 8 1 1 A 57 57 ALA HA H 57 3.980 4.021 -0.041 1
1 685 . 8 1 1 A 57 57 ALA C C 57 177.678 179.778 -2.100 1
1 686 . 8 1 1 A 57 57 ALA CA C 57 54.910 55.152 -0.242 1
1 687 . 8 1 1 A 57 57 ALA CB C 57 18.122 18.368 -0.246 1
1 688 . 8 1 1 A 57 57 ALA N N 57 122.860 122.089 0.771 1
1 689 . 8 1 1 A 58 58 ILE H H 58 7.831 7.485 0.346 1
1 690 . 8 1 1 A 58 58 ILE HA H 58 3.189 3.222 -0.033 1
1 700 . 8 1 1 A 58 58 ILE C C 58 177.818 177.009 0.809 1
1 701 . 8 1 1 A 58 58 ILE CA C 58 65.074 64.914 0.160 1
1 702 . 8 1 1 A 58 58 ILE CB C 58 38.178 36.988 1.190 1
1 706 . 8 1 1 A 58 58 ILE N N 58 117.418 117.562 -0.144 1
1 707 . 8 1 1 A 59 59 CYS H H 59 7.760 8.006 -0.246 1
1 708 . 8 1 1 A 59 59 CYS HA H 59 4.203 4.025 0.178 1
1 711 . 8 1 1 A 59 59 CYS C C 59 176.357 176.802 -0.445 1
1 712 . 8 1 1 A 59 59 CYS CA C 59 63.760 62.574 1.186 1
1 713 . 8 1 1 A 59 59 CYS CB C 59 27.638 26.553 1.085 1
1 714 . 8 1 1 A 59 59 CYS N N 59 115.302 120.421 -5.119 1
1 715 . 8 1 1 A 60 60 LYS H H 60 8.350 7.769 0.581 1
1 716 . 8 1 1 A 60 60 LYS HA H 60 3.972 4.077 -0.105 1
1 725 . 8 1 1 A 60 60 LYS C C 60 176.373 178.069 -1.696 1
1 726 . 8 1 1 A 60 60 LYS CA C 60 59.796 58.791 1.005 1
1 727 . 8 1 1 A 60 60 LYS CB C 60 32.560 31.917 0.643 1
1 729 . 8 1 1 A 60 60 LYS N N 60 122.343 121.158 1.185 1
1 730 . 8 1 1 A 61 61 ASP H H 61 8.157 7.651 0.506 1
1 731 . 8 1 1 A 61 61 ASP HA H 61 4.616 4.609 0.007 1
1 734 . 8 1 1 A 61 61 ASP C C 61 173.246 175.528 -2.282 1
1 735 . 8 1 1 A 61 61 ASP CA C 61 54.272 54.609 -0.337 1
1 736 . 8 1 1 A 61 61 ASP CB C 61 41.023 41.252 -0.229 1
1 737 . 8 1 1 A 61 61 ASP N N 61 116.173 119.381 -3.208 1
1 738 . 8 1 1 A 62 62 ARG H H 62 7.655 7.570 0.085 1
1 739 . 8 1 1 A 62 62 ARG HA H 62 4.149 4.030 0.119 1
1 746 . 8 1 1 A 62 62 ARG C C 62 175.891 175.658 0.233 1
1 747 . 8 1 1 A 62 62 ARG CA C 62 57.381 57.101 0.280 1
1 748 . 8 1 1 A 62 62 ARG CB C 62 26.538 26.697 -0.159 1
1 750 . 8 1 1 A 62 62 ARG N N 62 117.213 116.654 0.559 1
1 751 . 8 1 1 A 63 63 ARG H H 63 8.302 7.952 0.350 1
1 752 . 8 1 1 A 63 63 ARG HA H 63 4.240 4.009 0.231 1
1 757 . 8 1 1 A 63 63 ARG C C 63 175.775 178.680 -2.905 1
1 758 . 8 1 1 A 63 63 ARG CA C 63 55.718 58.195 -2.477 1
1 760 . 8 1 1 A 63 63 ARG N N 63 116.292 118.244 -1.952 1
1 761 . 8 1 1 A 64 64 TRP H H 64 8.161 7.615 0.546 1
1 762 . 8 1 1 A 64 64 TRP HA H 64 3.836 4.350 -0.514 1
1 771 . 8 1 1 A 64 64 TRP C C 64 176.862 178.722 -1.860 1
1 772 . 8 1 1 A 64 64 TRP CA C 64 62.036 59.774 2.262 1
1 773 . 8 1 1 A 64 64 TRP CB C 64 27.028 28.730 -1.702 1
1 779 . 8 1 1 A 64 64 TRP N N 64 121.486 120.003 1.483 1
1 781 . 8 1 1 A 65 65 ALA H H 65 8.954 8.183 0.771 1
1 782 . 8 1 1 A 65 65 ALA HA H 65 4.290 4.180 0.110 1
1 786 . 8 1 1 A 65 65 ALA C C 65 178.986 179.571 -0.585 1
1 787 . 8 1 1 A 65 65 ALA CA C 65 55.314 55.303 0.011 1
1 788 . 8 1 1 A 65 65 ALA CB C 65 18.119 18.461 -0.342 1
1 789 . 8 1 1 A 65 65 ALA N N 65 121.559 122.557 -0.998 1
1 790 . 8 1 1 A 66 66 ARG H H 66 7.473 7.952 -0.479 1
1 791 . 8 1 1 A 66 66 ARG HA H 66 4.221 4.180 0.041 1
1 798 . 8 1 1 A 66 66 ARG C C 66 176.670 178.439 -1.769 1
1 799 . 8 1 1 A 66 66 ARG CA C 66 57.871 58.721 -0.850 1
1 800 . 8 1 1 A 66 66 ARG CB C 66 29.097 29.696 -0.599 1
1 801 . 8 1 1 A 66 66 ARG N N 66 119.915 116.805 3.110 1
1 802 . 8 1 1 A 67 67 VAL H H 67 7.134 7.861 -0.727 1
1 803 . 8 1 1 A 67 67 VAL HA H 67 3.304 3.604 -0.300 1
1 811 . 8 1 1 A 67 67 VAL C C 67 175.341 177.874 -2.533 1
1 812 . 8 1 1 A 67 67 VAL CA C 67 66.722 66.709 0.013 1
1 813 . 8 1 1 A 67 67 VAL CB C 67 31.108 31.946 -0.838 1
1 816 . 8 1 1 A 67 67 VAL N N 67 119.970 120.983 -1.013 1
1 817 . 8 1 1 A 68 68 ALA H H 68 7.745 8.762 -1.017 1
1 818 . 8 1 1 A 68 68 ALA HA H 68 4.076 4.034 0.042 1
1 822 . 8 1 1 A 68 68 ALA C C 68 177.358 179.286 -1.928 1
1 823 . 8 1 1 A 68 68 ALA CA C 68 55.607 55.569 0.038 1
1 824 . 8 1 1 A 68 68 ALA CB C 68 18.061 18.407 -0.346 1
1 825 . 8 1 1 A 68 68 ALA N N 68 118.239 121.504 -3.265 1
1 826 . 8 1 1 A 69 69 GLN H H 69 7.979 8.089 -0.110 1
1 827 . 8 1 1 A 69 69 GLN HA H 69 4.310 4.117 0.193 1
1 834 . 8 1 1 A 69 69 GLN C C 69 179.370 177.959 1.411 1
1 835 . 8 1 1 A 69 69 GLN CA C 69 59.307 59.250 0.057 1
1 836 . 8 1 1 A 69 69 GLN CB C 69 29.257 28.258 0.999 1
1 838 . 8 1 1 A 69 69 GLN N N 69 118.484 118.072 0.412 1
1 840 . 8 1 1 A 70 70 ARG H H 70 8.374 8.031 0.343 1
1 841 . 8 1 1 A 70 70 ARG HA H 70 4.148 4.110 0.038 1
1 848 . 8 1 1 A 70 70 ARG C C 70 175.850 177.881 -2.031 1
1 849 . 8 1 1 A 70 70 ARG CA C 70 58.957 58.681 0.276 1
1 850 . 8 1 1 A 70 70 ARG CB C 70 29.799 30.019 -0.220 1
1 852 . 8 1 1 A 70 70 ARG N N 70 120.309 120.681 -0.372 1
1 853 . 8 1 1 A 71 71 LEU H H 71 7.413 7.579 -0.166 1
1 854 . 8 1 1 A 71 71 LEU HA H 71 4.341 4.141 0.200 1
1 864 . 8 1 1 A 71 71 LEU C C 71 173.391 176.057 -2.666 1
1 865 . 8 1 1 A 71 71 LEU CA C 71 54.911 54.592 0.319 1
1 866 . 8 1 1 A 71 71 LEU CB C 71 42.693 41.408 1.285 1
1 867 . 8 1 1 A 71 71 LEU N N 71 118.841 117.711 1.130 1
1 868 . 8 1 1 A 72 72 ASN H H 72 8.038 7.992 0.046 1
1 869 . 8 1 1 A 72 72 ASN HA H 72 4.394 4.419 -0.025 1
1 874 . 8 1 1 A 72 72 ASN C C 72 173.042 174.124 -1.082 1
1 875 . 8 1 1 A 72 72 ASN CB C 72 36.412 36.084 0.328 1
1 876 . 8 1 1 A 72 72 ASN N N 72 112.919 116.164 -3.245 1
1 878 . 8 1 1 A 73 73 TYR H H 73 7.874 8.016 -0.142 1
1 879 . 8 1 1 A 73 73 TYR HA H 73 4.868 4.622 0.246 1
1 886 . 8 1 1 A 73 73 TYR C C 73 172.194 173.994 -1.800 1
1 887 . 8 1 1 A 73 73 TYR CA C 73 57.105 56.422 0.683 1
1 888 . 8 1 1 A 73 73 TYR CB C 73 37.918 38.740 -0.822 1
1 889 . 8 1 1 A 73 73 TYR N N 73 117.432 119.747 -2.315 1
1 897 . 8 1 1 A 75 75 PRO HA H 75 4.626 4.460 0.166 1
1 902 . 8 1 1 A 75 75 PRO C C 75 175.728 177.054 -1.326 1
1 903 . 8 1 1 A 75 75 PRO CA C 75 62.502 63.243 -0.741 1
1 904 . 8 1 1 A 75 75 PRO CB C 75 32.339 32.497 -0.158 1
1 905 . 8 1 1 A 76 76 GLY H H 76 8.369 8.857 -0.488 1
1 906 . 8 1 1 A 76 76 GLY HA2 H 76 4.057 3.954 0.103 1
1 907 . 8 1 1 A 76 76 GLY HA3 H 76 4.556 3.954 0.602 1
1 908 . 8 1 1 A 76 76 GLY C C 76 173.248 174.829 -1.581 1
1 909 . 8 1 1 A 76 76 GLY CA C 76 46.180 45.719 0.461 1
1 910 . 8 1 1 A 76 76 GLY N N 76 106.185 110.796 -4.611 1
1 911 . 8 1 1 A 77 77 LYS H H 77 8.632 8.523 0.109 1
1 912 . 8 1 1 A 77 77 LYS HA H 77 4.433 4.162 0.271 1
1 921 . 8 1 1 A 77 77 LYS C C 77 174.924 177.158 -2.234 1
1 922 . 8 1 1 A 77 77 LYS CA C 77 56.453 57.694 -1.241 1
1 923 . 8 1 1 A 77 77 LYS CB C 77 33.170 32.430 0.740 1
1 925 . 8 1 1 A 77 77 LYS N N 77 119.592 119.135 0.457 1
1 926 . 8 1 1 A 78 78 ASN H H 78 8.865 7.891 0.974 1
1 927 . 8 1 1 A 78 78 ASN HA H 78 4.654 4.439 0.215 1
1 932 . 8 1 1 A 78 78 ASN C C 78 174.869 176.976 -2.107 1
1 933 . 8 1 1 A 78 78 ASN CA C 78 54.117 56.233 -2.116 1
1 934 . 8 1 1 A 78 78 ASN CB C 78 37.841 38.183 -0.342 1
1 935 . 8 1 1 A 78 78 ASN N N 78 116.880 118.367 -1.487 1
1 937 . 8 1 1 A 79 79 ILE H H 79 8.008 7.420 0.588 1
1 938 . 8 1 1 A 79 79 ILE HA H 79 3.718 4.153 -0.435 1
1 948 . 8 1 1 A 79 79 ILE C C 79 175.921 177.887 -1.966 1
1 949 . 8 1 1 A 79 79 ILE CA C 79 63.618 62.237 1.381 1
1 950 . 8 1 1 A 79 79 ILE CB C 79 37.158 38.410 -1.252 1
1 952 . 8 1 1 A 79 79 ILE N N 79 119.688 118.340 1.348 1
1 953 . 8 1 1 A 80 80 GLY H H 80 9.062 8.436 0.626 1
1 954 . 8 1 1 A 80 80 GLY HA2 H 80 3.739 3.827 -0.088 1
1 955 . 8 1 1 A 80 80 GLY HA3 H 80 3.739 3.865 -0.126 1
1 956 . 8 1 1 A 80 80 GLY C C 80 173.185 175.859 -2.674 1
1 957 . 8 1 1 A 80 80 GLY CA C 80 48.166 47.605 0.561 1
1 958 . 8 1 1 A 80 80 GLY N N 80 110.338 109.642 0.696 1
1 959 . 8 1 1 A 81 81 SER H H 81 7.460 8.032 -0.572 1
1 960 . 8 1 1 A 81 81 SER HA H 81 3.904 4.172 -0.268 1
1 963 . 8 1 1 A 81 81 SER C C 81 174.999 177.269 -2.270 1
1 964 . 8 1 1 A 81 81 SER CA C 81 61.138 61.210 -0.072 1
1 965 . 8 1 1 A 81 81 SER CB C 81 62.740 62.735 0.005 1
1 966 . 8 1 1 A 81 81 SER N N 81 115.348 116.734 -1.386 1
1 967 . 8 1 1 A 82 82 LEU H H 82 7.367 8.060 -0.693 1
1 968 . 8 1 1 A 82 82 LEU HA H 82 3.946 4.016 -0.070 1
1 977 . 8 1 1 A 82 82 LEU C C 82 176.969 178.150 -1.181 1
1 978 . 8 1 1 A 82 82 LEU CA C 82 57.504 58.523 -1.019 1
1 979 . 8 1 1 A 82 82 LEU CB C 82 42.185 41.490 0.695 1
1 980 . 8 1 1 A 82 82 LEU N N 82 124.267 122.959 1.308 1
1 981 . 8 1 1 A 83 83 LEU H H 83 8.330 8.186 0.144 1
1 982 . 8 1 1 A 83 83 LEU HA H 83 3.924 3.918 0.006 1
1 991 . 8 1 1 A 83 83 LEU C C 83 176.303 178.322 -2.019 1
1 992 . 8 1 1 A 83 83 LEU CA C 83 58.067 58.462 -0.395 1
1 993 . 8 1 1 A 83 83 LEU CB C 83 41.061 41.419 -0.358 1
1 994 . 8 1 1 A 83 83 LEU N N 83 117.452 119.603 -2.151 1
1 995 . 8 1 1 A 84 84 ARG H H 84 7.651 8.104 -0.453 1
1 996 . 8 1 1 A 84 84 ARG HA H 84 2.230 3.642 -1.412 1
1 1003 . 8 1 1 A 84 84 ARG C C 84 175.902 178.589 -2.687 1
1 1004 . 8 1 1 A 84 84 ARG CA C 84 59.112 59.474 -0.362 1
1 1005 . 8 1 1 A 84 84 ARG CB C 84 28.579 29.843 -1.264 1
1 1007 . 8 1 1 A 84 84 ARG N N 84 119.586 119.593 -0.007 1
1 1008 . 8 1 1 A 85 85 SER H H 85 7.291 8.406 -1.115 1
1 1009 . 8 1 1 A 85 85 SER HA H 85 4.189 4.110 0.079 1
1 1012 . 8 1 1 A 85 85 SER C C 85 175.546 176.281 -0.735 1
1 1013 . 8 1 1 A 85 85 SER CA C 85 61.376 62.372 -0.996 1
1 1014 . 8 1 1 A 85 85 SER CB C 85 62.805 63.023 -0.218 1
1 1015 . 8 1 1 A 85 85 SER N N 85 112.921 116.597 -3.676 1
1 1016 . 8 1 1 A 86 86 HIS H H 86 8.156 7.488 0.668 1
1 1017 . 8 1 1 A 86 86 HIS HA H 86 4.782 4.208 0.574 1
1 1022 . 8 1 1 A 86 86 HIS C C 86 176.851 177.581 -0.730 1
1 1023 . 8 1 1 A 86 86 HIS CA C 86 58.898 59.536 -0.638 1
1 1024 . 8 1 1 A 86 86 HIS CB C 86 31.110 30.228 0.882 1
1 1027 . 8 1 1 A 86 86 HIS N N 86 119.258 119.075 0.183 1
1 1028 . 8 1 1 A 87 87 TYR H H 87 9.180 8.347 0.833 1
1 1029 . 8 1 1 A 87 87 TYR HA H 87 3.913 3.931 -0.018 1
1 1036 . 8 1 1 A 87 87 TYR C C 87 176.841 177.679 -0.838 1
1 1037 . 8 1 1 A 87 87 TYR CA C 87 63.526 61.579 1.947 1
1 1038 . 8 1 1 A 87 87 TYR CB C 87 39.431 38.348 1.083 1
1 1041 . 8 1 1 A 87 87 TYR N N 87 120.625 120.180 0.445 1
1 1042 . 8 1 1 A 88 88 GLU H H 88 9.028 8.288 0.740 1
1 1043 . 8 1 1 A 88 88 GLU HA H 88 3.682 3.827 -0.145 1
1 1048 . 8 1 1 A 88 88 GLU C C 88 175.833 178.672 -2.839 1
1 1049 . 8 1 1 A 88 88 GLU CA C 88 59.730 59.872 -0.142 1
1 1050 . 8 1 1 A 88 88 GLU CB C 88 30.009 29.284 0.725 1
1 1052 . 8 1 1 A 88 88 GLU N N 88 119.531 118.927 0.604 1
1 1053 . 8 1 1 A 89 89 ARG H H 89 8.052 7.494 0.558 1
1 1054 . 8 1 1 A 89 89 ARG HA H 89 4.292 4.461 -0.169 1
1 1061 . 8 1 1 A 89 89 ARG C C 89 176.045 178.349 -2.304 1
1 1062 . 8 1 1 A 89 89 ARG CA C 89 58.538 57.710 0.828 1
1 1063 . 8 1 1 A 89 89 ARG CB C 89 31.841 31.125 0.716 1
1 1065 . 8 1 1 A 89 89 ARG N N 89 114.741 119.536 -4.795 1
1 1066 . 8 1 1 A 90 90 ILE H H 90 8.141 8.069 0.072 1
1 1067 . 8 1 1 A 90 90 ILE HA H 90 4.296 3.460 0.836 1
1 1075 . 8 1 1 A 90 90 ILE C C 90 174.461 176.990 -2.529 1
1 1076 . 8 1 1 A 90 90 ILE CA C 90 63.649 63.856 -0.207 1
1 1077 . 8 1 1 A 90 90 ILE CB C 90 40.626 38.224 2.402 1
1 1079 . 8 1 1 A 90 90 ILE N N 90 113.421 119.747 -6.326 1
1 1080 . 8 1 1 A 91 91 VAL H H 91 7.350 7.198 0.152 1
1 1081 . 8 1 1 A 91 91 VAL HA H 91 4.144 3.812 0.332 1
1 1089 . 8 1 1 A 91 91 VAL C C 91 175.422 176.735 -1.313 1
1 1090 . 8 1 1 A 91 91 VAL CA C 91 65.042 63.367 1.675 1
1 1091 . 8 1 1 A 91 91 VAL CB C 91 33.215 31.645 1.570 1
1 1092 . 8 1 1 A 91 91 VAL N N 91 118.215 120.334 -2.119 1
1 1093 . 8 1 1 A 92 92 TYR H H 92 8.565 8.016 0.549 1
1 1094 . 8 1 1 A 92 92 TYR HA H 92 4.217 4.214 0.003 1
1 1099 . 8 1 1 A 92 92 TYR C C 92 171.495 175.151 -3.656 1
1 1100 . 8 1 1 A 92 92 TYR CA C 92 61.558 62.387 -0.829 1
1 1101 . 8 1 1 A 92 92 TYR CB C 92 36.757 36.650 0.107 1
1 1102 . 8 1 1 A 92 92 TYR N N 92 121.370 122.237 -0.867 1
1 1103 . 8 1 1 A 93 93 PRO HA H 93 4.136 4.485 -0.349 1
1 1108 . 8 1 1 A 93 93 PRO C C 93 177.077 178.366 -1.289 1
1 1109 . 8 1 1 A 93 93 PRO CA C 93 66.037 66.029 0.008 1
1 1110 . 8 1 1 A 93 93 PRO CB C 93 31.482 30.934 0.548 1
1 1111 . 8 1 1 A 94 94 TYR H H 94 6.517 7.565 -1.048 1
1 1112 . 8 1 1 A 94 94 TYR HA H 94 2.798 4.378 -1.580 1
1 1119 . 8 1 1 A 94 94 TYR C C 94 174.985 178.127 -3.142 1
1 1120 . 8 1 1 A 94 94 TYR CA C 94 59.356 60.063 -0.707 1
1 1121 . 8 1 1 A 94 94 TYR CB C 94 37.987 37.252 0.735 1
1 1124 . 8 1 1 A 94 94 TYR N N 94 115.987 117.562 -1.575 1
1 1125 . 8 1 1 A 95 95 GLU H H 95 8.205 8.546 -0.341 1
1 1126 . 8 1 1 A 95 95 GLU HA H 95 3.682 4.179 -0.497 1
1 1131 . 8 1 1 A 95 95 GLU C C 95 178.530 178.779 -0.249 1
1 1132 . 8 1 1 A 95 95 GLU CA C 95 58.910 59.839 -0.929 1
1 1133 . 8 1 1 A 95 95 GLU CB C 95 29.187 29.466 -0.279 1
1 1134 . 8 1 1 A 95 95 GLU N N 95 119.946 121.825 -1.879 1
1 1135 . 8 1 1 A 96 96 MET H H 96 8.248 7.880 0.368 1
1 1136 . 8 1 1 A 96 96 MET HA H 96 4.172 4.164 0.008 1
1 1142 . 8 1 1 A 96 96 MET C C 96 176.874 178.027 -1.153 1
1 1143 . 8 1 1 A 96 96 MET CA C 96 57.159 58.910 -1.751 1
1 1144 . 8 1 1 A 96 96 MET CB C 96 31.829 32.195 -0.366 1
1 1146 . 8 1 1 A 96 96 MET N N 96 117.570 119.359 -1.789 1
1 1147 . 8 1 1 A 97 97 TYR H H 97 7.445 8.349 -0.904 1
1 1148 . 8 1 1 A 97 97 TYR HA H 97 4.248 3.995 0.253 1
1 1155 . 8 1 1 A 97 97 TYR C C 97 176.476 177.263 -0.787 1
1 1156 . 8 1 1 A 97 97 TYR CA C 97 60.470 61.868 -1.398 1
1 1157 . 8 1 1 A 97 97 TYR CB C 97 38.612 38.498 0.114 1
1 1160 . 8 1 1 A 97 97 TYR N N 97 122.246 121.341 0.905 1
1 1161 . 8 1 1 A 98 98 GLN H H 98 8.087 8.510 -0.423 1
1 1162 . 8 1 1 A 98 98 GLN HA H 98 3.793 3.632 0.161 1
1 1169 . 8 1 1 A 98 98 GLN C C 98 175.549 177.814 -2.265 1
1 1170 . 8 1 1 A 98 98 GLN CA C 98 57.365 58.734 -1.369 1
1 1171 . 8 1 1 A 98 98 GLN CB C 98 28.901 28.879 0.022 1
1 1173 . 8 1 1 A 98 98 GLN N N 98 118.769 119.602 -0.833 1
1 1175 . 8 1 1 A 99 99 SER H H 99 7.724 8.210 -0.486 1
1 1176 . 8 1 1 A 99 99 SER HA H 99 4.293 4.232 0.061 1
1 1179 . 8 1 1 A 99 99 SER C C 99 173.696 177.395 -3.699 1
1 1180 . 8 1 1 A 99 99 SER CA C 99 59.566 61.123 -1.557 1
1 1181 . 8 1 1 A 99 99 SER CB C 99 63.847 62.877 0.970 1
1 1182 . 8 1 1 A 99 99 SER N N 99 113.257 114.860 -1.603 1
1 1183 . 8 1 1 A 100 100 GLY H H 100 7.751 8.496 -0.745 1
1 1184 . 8 1 1 A 100 100 GLY HA2 H 100 3.813 3.820 -0.007 1
1 1185 . 8 1 1 A 100 100 GLY HA3 H 100 3.934 3.836 0.098 1
1 1186 . 8 1 1 A 100 100 GLY C C 100 172.643 176.200 -3.557 1
1 1187 . 8 1 1 A 100 100 GLY CA C 100 45.570 46.984 -1.414 1
1 1188 . 8 1 1 A 100 100 GLY N N 100 109.750 108.636 1.114 1
1 1189 . 8 1 1 A 101 101 ALA H H 101 7.824 7.700 0.124 1
1 1190 . 8 1 1 A 101 101 ALA HA H 101 4.221 3.896 0.325 1
1 1194 . 8 1 1 A 101 101 ALA C C 101 175.639 179.671 -4.032 1
1 1195 . 8 1 1 A 101 101 ALA CA C 101 52.745 54.646 -1.901 1
1 1196 . 8 1 1 A 101 101 ALA CB C 101 19.437 18.715 0.722 1
1 1197 . 8 1 1 A 101 101 ALA N N 101 123.241 124.669 -1.428 1
1 1198 . 8 1 1 A 102 102 ASN H H 102 8.191 7.846 0.345 1
1 1199 . 8 1 1 A 102 102 ASN HA H 102 4.658 4.672 -0.014 1
1 1204 . 8 1 1 A 102 102 ASN C C 102 173.337 175.846 -2.509 1
1 1205 . 8 1 1 A 102 102 ASN CA C 102 53.374 55.904 -2.530 1
1 1206 . 8 1 1 A 102 102 ASN CB C 102 38.819 39.139 -0.320 1
1 1207 . 8 1 1 A 102 102 ASN N N 102 116.572 115.207 1.365 1
1 1209 . 8 1 1 A 103 103 LEU H H 103 8.065 7.618 0.447 1
1 1210 . 8 1 1 A 103 103 LEU HA H 103 4.363 4.642 -0.279 1
1 1219 . 8 1 1 A 103 103 LEU C C 103 175.637 174.786 0.851 1
1 1220 . 8 1 1 A 103 103 LEU CA C 103 55.292 53.548 1.744 1
1 1221 . 8 1 1 A 103 103 LEU CB C 103 42.433 45.246 -2.813 1
1 1222 . 8 1 1 A 103 103 LEU N N 103 122.074 114.397 7.677 1
1 1223 . 8 1 1 A 104 104 VAL H H 104 8.055 9.015 -0.960 1
1 1224 . 8 1 1 A 104 104 VAL HA H 104 4.131 4.839 -0.708 1
1 1232 . 8 1 1 A 104 104 VAL C C 104 174.364 175.650 -1.286 1
1 1233 . 8 1 1 A 104 104 VAL CA C 104 62.552 60.826 1.726 1
1 1234 . 8 1 1 A 104 104 VAL CB C 104 32.766 33.114 -0.348 1
1 1235 . 8 1 1 A 104 104 VAL N N 104 120.606 124.236 -3.630 1
1 1236 . 8 1 1 A 105 105 CYS H H 105 8.392 8.781 -0.389 1
1 1237 . 8 1 1 A 105 105 CYS HA H 105 4.535 4.908 -0.373 1
1 1240 . 8 1 1 A 105 105 CYS C C 105 172.593 175.290 -2.697 1
1 1241 . 8 1 1 A 105 105 CYS CA C 105 58.449 58.360 0.089 1
1 1242 . 8 1 1 A 105 105 CYS CB C 105 27.952 29.102 -1.150 1
1 1243 . 8 1 1 A 105 105 CYS N N 105 122.791 128.593 -5.802 1
1 1244 . 8 1 1 A 106 106 ASN H H 106 8.575 8.460 0.115 1
1 1245 . 8 1 1 A 106 106 ASN HA H 106 4.843 4.759 0.084 1
1 1250 . 8 1 1 A 106 106 ASN C C 106 173.594 177.567 -3.973 1
1 1251 . 8 1 1 A 106 106 ASN CA C 106 53.337 53.487 -0.150 1
1 1252 . 8 1 1 A 106 106 ASN CB C 106 39.088 38.190 0.898 1
1 1253 . 8 1 1 A 106 106 ASN N N 106 122.001 118.575 3.426 1
1 1255 . 8 1 1 A 107 107 THR H H 107 8.090 8.084 0.006 1
1 1256 . 8 1 1 A 107 107 THR HA H 107 4.348 3.986 0.362 1
1 1261 . 8 1 1 A 107 107 THR C C 107 172.516 177.345 -4.829 1
1 1262 . 8 1 1 A 107 107 THR CA C 107 61.803 65.853 -4.050 1
1 1263 . 8 1 1 A 107 107 THR CB C 107 69.812 68.365 1.447 1
1 1265 . 8 1 1 A 107 107 THR N N 107 114.374 114.009 0.365 1
1 1266 . 8 1 1 A 108 108 ARG H H 108 8.322 7.957 0.365 1
1 1267 . 8 1 1 A 108 108 ARG HA H 108 4.634 4.226 0.408 1
1 1274 . 8 1 1 A 108 108 ARG C C 108 172.608 176.952 -4.344 1
1 1275 . 8 1 1 A 108 108 ARG CA C 108 54.026 60.628 -6.602 1
1 1276 . 8 1 1 A 108 108 ARG CB C 108 30.246 30.359 -0.113 1
1 1278 . 8 1 1 A 108 108 ARG N N 108 124.017 122.102 1.915 1
1 1279 . 8 1 1 A 109 109 PRO HA H 109 4.354 4.306 0.048 1
1 1286 . 8 1 1 A 109 109 PRO C C 109 174.978 179.283 -4.305 1
1 1287 . 8 1 1 A 109 109 PRO CA C 109 63.396 65.911 -2.515 1
1 1288 . 8 1 1 A 109 109 PRO CB C 109 32.046 30.778 1.268 1
1 1290 . 8 1 1 A 110 110 PHE H H 110 8.123 8.129 -0.006 1
1 1291 . 8 1 1 A 110 110 PHE HA H 110 4.619 4.793 -0.174 1
1 1296 . 8 1 1 A 110 110 PHE C C 110 173.856 177.489 -3.633 1
1 1297 . 8 1 1 A 110 110 PHE CA C 110 57.353 62.103 -4.750 1
1 1298 . 8 1 1 A 110 110 PHE CB C 110 39.364 39.539 -0.175 1
1 1301 . 8 1 1 A 110 110 PHE N N 110 119.265 118.773 0.492 1
1 1302 . 8 1 1 A 111 111 ASP H H 111 8.161 8.360 -0.199 1
1 1303 . 8 1 1 A 111 111 ASP HA H 111 4.613 4.482 0.131 1
1 1306 . 8 1 1 A 111 111 ASP C C 111 174.114 178.364 -4.250 1
1 1307 . 8 1 1 A 111 111 ASP CA C 111 54.350 57.788 -3.438 1
1 1308 . 8 1 1 A 111 111 ASP CB C 111 41.413 41.911 -0.498 1
1 1309 . 8 1 1 A 111 111 ASP N N 111 121.764 119.507 2.257 1
1 1310 . 8 1 1 A 112 112 ASN H H 112 8.307 9.028 -0.721 1
1 1311 . 8 1 1 A 112 112 ASN HA H 112 4.662 4.501 0.161 1
1 1316 . 8 1 1 A 112 112 ASN C C 112 173.595 177.547 -3.952 1
1 1317 . 8 1 1 A 112 112 ASN CA C 112 53.486 56.828 -3.342 1
1 1318 . 8 1 1 A 112 112 ASN CB C 112 39.225 39.085 0.140 1
1 1319 . 8 1 1 A 112 112 ASN N N 112 119.154 117.727 1.427 1
1 1321 . 8 1 1 A 113 113 GLU H H 113 8.404 8.056 0.348 1
1 1322 . 8 1 1 A 113 113 GLU HA H 113 4.264 4.173 0.091 1
1 1327 . 8 1 1 A 113 113 GLU C C 113 174.886 178.847 -3.961 1
1 1328 . 8 1 1 A 113 113 GLU CA C 113 56.681 59.061 -2.380 1
1 1329 . 8 1 1 A 113 113 GLU CB C 113 30.403 29.615 0.788 1
1 1331 . 8 1 1 A 113 113 GLU N N 113 120.943 119.547 1.396 1
1 1332 . 8 1 1 A 114 114 GLU H H 114 8.388 8.124 0.264 1
1 1333 . 8 1 1 A 114 114 GLU HA H 114 4.262 4.257 0.005 1
1 1338 . 8 1 1 A 114 114 GLU C C 114 174.819 179.045 -4.226 1
1 1339 . 8 1 1 A 114 114 GLU CA C 114 56.769 59.399 -2.630 1
1 1340 . 8 1 1 A 114 114 GLU CB C 114 30.125 29.581 0.544 1
1 1342 . 8 1 1 A 114 114 GLU N N 114 121.869 119.690 2.179 1
1 1343 . 8 1 1 A 115 115 LYS H H 115 8.236 7.970 0.266 1
1 1344 . 8 1 1 A 115 115 LYS HA H 115 4.347 4.344 0.003 1
1 1353 . 8 1 1 A 115 115 LYS C C 115 174.633 176.286 -1.653 1
1 1354 . 8 1 1 A 115 115 LYS CA C 115 56.426 56.461 -0.035 1
1 1355 . 8 1 1 A 115 115 LYS CB C 115 33.277 32.903 0.374 1
1 1359 . 8 1 1 A 115 115 LYS N N 115 121.997 116.328 5.669 1
1 1360 . 8 1 1 A 116 116 ASP H H 116 8.386 7.958 0.428 1
1 1361 . 8 1 1 A 116 116 ASP HA H 116 4.600 4.367 0.233 1
1 1364 . 8 1 1 A 116 116 ASP C C 116 173.448 175.082 -1.634 1
1 1365 . 8 1 1 A 116 116 ASP CA C 116 54.773 54.840 -0.067 1
1 1366 . 8 1 1 A 116 116 ASP CB C 116 41.029 40.004 1.025 1
1 1367 . 8 1 1 A 116 116 ASP N N 116 121.057 118.960 2.097 1
1 5 . 9 1 1 A 2 2 MET HA H 2 4.534 4.351 0.183 1
1 13 . 9 1 1 A 2 2 MET C C 2 174.355 177.987 -3.632 1
1 14 . 9 1 1 A 2 2 MET CA C 2 56.247 57.103 -0.856 1
1 15 . 9 1 1 A 2 2 MET CB C 2 32.855 31.754 1.101 1
1 18 . 9 1 1 A 3 3 ASN H H 3 8.600 8.376 0.224 1
1 19 . 9 1 1 A 3 3 ASN HA H 3 4.711 4.491 0.220 1
1 24 . 9 1 1 A 3 3 ASN C C 3 173.983 177.265 -3.282 1
1 25 . 9 1 1 A 3 3 ASN CA C 3 53.650 56.608 -2.958 1
1 26 . 9 1 1 A 3 3 ASN CB C 3 38.624 39.946 -1.322 1
1 27 . 9 1 1 A 3 3 ASN N N 3 120.149 119.450 0.699 1
1 29 . 9 1 1 A 4 4 GLU H H 4 8.495 8.241 0.254 1
1 30 . 9 1 1 A 4 4 GLU HA H 4 4.235 4.064 0.171 1
1 35 . 9 1 1 A 4 4 GLU C C 4 175.752 178.188 -2.436 1
1 36 . 9 1 1 A 4 4 GLU CA C 4 58.075 59.333 -1.258 1
1 37 . 9 1 1 A 4 4 GLU CB C 4 30.125 29.775 0.350 1
1 38 . 9 1 1 A 4 4 GLU N N 4 121.543 118.530 3.013 1
1 39 . 9 1 1 A 5 5 LEU HA H 5 4.073 4.293 -0.220 1
1 47 . 9 1 1 A 5 5 LEU CB C 5 41.897 43.455 -1.558 1
1 50 . 9 1 1 A 6 6 GLU H H 6 8.332 8.398 -0.066 1
1 51 . 9 1 1 A 6 6 GLU HA H 6 3.621 4.110 -0.489 1
1 52 . 9 1 1 A 6 6 GLU C C 6 176.402 178.356 -1.954 1
1 53 . 9 1 1 A 6 6 GLU CA C 6 58.461 59.071 -0.610 1
1 54 . 9 1 1 A 6 6 GLU CB C 6 29.730 29.367 0.363 1
1 55 . 9 1 1 A 6 6 GLU N N 6 121.462 118.848 2.614 1
1 56 . 9 1 1 A 7 7 ALA H H 7 8.244 7.804 0.440 1
1 57 . 9 1 1 A 7 7 ALA HA H 7 4.185 4.107 0.078 1
1 61 . 9 1 1 A 7 7 ALA C C 7 177.982 178.467 -0.485 1
1 62 . 9 1 1 A 7 7 ALA CA C 7 54.791 55.656 -0.865 1
1 63 . 9 1 1 A 7 7 ALA CB C 7 18.836 18.890 -0.054 1
1 64 . 9 1 1 A 7 7 ALA N N 7 123.078 122.231 0.847 1
1 65 . 9 1 1 A 8 8 GLN H H 8 8.274 7.860 0.414 1
1 66 . 9 1 1 A 8 8 GLN HA H 8 4.219 4.456 -0.237 1
1 73 . 9 1 1 A 8 8 GLN C C 8 176.325 175.438 0.887 1
1 74 . 9 1 1 A 8 8 GLN CA C 8 57.864 55.722 2.142 1
1 75 . 9 1 1 A 8 8 GLN CB C 8 28.768 28.966 -0.198 1
1 77 . 9 1 1 A 8 8 GLN N N 8 117.452 116.073 1.379 1
1 79 . 9 1 1 A 9 9 THR H H 9 8.043 8.614 -0.571 1
1 80 . 9 1 1 A 9 9 THR HA H 9 3.998 4.626 -0.628 1
1 85 . 9 1 1 A 9 9 THR C C 9 173.904 174.858 -0.954 1
1 86 . 9 1 1 A 9 9 THR CA C 9 65.435 61.484 3.951 1
1 87 . 9 1 1 A 9 9 THR CB C 9 68.870 69.847 -0.977 1
1 89 . 9 1 1 A 9 9 THR N N 9 116.135 118.873 -2.738 1
1 90 . 9 1 1 A 10 10 ARG H H 10 8.095 8.947 -0.852 1
1 91 . 9 1 1 A 10 10 ARG HA H 10 4.040 3.965 0.075 1
1 98 . 9 1 1 A 10 10 ARG C C 10 176.583 175.519 1.064 1
1 99 . 9 1 1 A 10 10 ARG CA C 10 59.262 57.498 1.764 1
1 100 . 9 1 1 A 10 10 ARG CB C 10 29.900 27.590 2.310 1
1 101 . 9 1 1 A 10 10 ARG N N 10 121.157 120.115 1.042 1
1 102 . 9 1 1 A 11 11 VAL H H 11 7.657 7.846 -0.189 1
1 103 . 9 1 1 A 11 11 VAL HA H 11 3.769 4.389 -0.620 1
1 111 . 9 1 1 A 11 11 VAL C C 11 176.662 177.585 -0.923 1
1 112 . 9 1 1 A 11 11 VAL CA C 11 65.914 63.809 2.105 1
1 113 . 9 1 1 A 11 11 VAL CB C 11 31.745 33.528 -1.783 1
1 114 . 9 1 1 A 11 11 VAL N N 11 118.580 117.922 0.658 1
1 115 . 9 1 1 A 12 12 LYS H H 12 7.471 8.328 -0.857 1
1 116 . 9 1 1 A 12 12 LYS HA H 12 3.366 4.256 -0.890 1
1 123 . 9 1 1 A 12 12 LYS C C 12 176.457 179.134 -2.677 1
1 124 . 9 1 1 A 12 12 LYS CA C 12 59.545 59.368 0.177 1
1 125 . 9 1 1 A 12 12 LYS CB C 12 32.206 32.584 -0.378 1
1 126 . 9 1 1 A 12 12 LYS N N 12 121.835 122.930 -1.095 1
1 127 . 9 1 1 A 13 13 LEU H H 13 8.144 8.195 -0.051 1
1 128 . 9 1 1 A 13 13 LEU HA H 13 4.093 4.023 0.070 1
1 137 . 9 1 1 A 13 13 LEU C C 13 178.254 179.094 -0.840 1
1 138 . 9 1 1 A 13 13 LEU CA C 13 58.023 58.153 -0.130 1
1 139 . 9 1 1 A 13 13 LEU CB C 13 41.283 41.358 -0.075 1
1 140 . 9 1 1 A 13 13 LEU N N 13 118.688 120.416 -1.728 1
1 141 . 9 1 1 A 14 14 ASN H H 14 8.384 8.359 0.025 1
1 142 . 9 1 1 A 14 14 ASN HA H 14 4.567 4.484 0.083 1
1 147 . 9 1 1 A 14 14 ASN C C 14 175.397 177.206 -1.809 1
1 148 . 9 1 1 A 14 14 ASN CA C 14 56.239 56.469 -0.230 1
1 149 . 9 1 1 A 14 14 ASN CB C 14 38.432 39.215 -0.783 1
1 150 . 9 1 1 A 14 14 ASN N N 14 118.175 117.311 0.864 1
1 152 . 9 1 1 A 15 15 TYR H H 15 7.982 8.289 -0.307 1
1 153 . 9 1 1 A 15 15 TYR HA H 15 4.249 4.151 0.098 1
1 160 . 9 1 1 A 15 15 TYR C C 15 175.503 177.416 -1.913 1
1 161 . 9 1 1 A 15 15 TYR CA C 15 62.450 61.462 0.988 1
1 162 . 9 1 1 A 15 15 TYR CB C 15 39.399 38.682 0.717 1
1 163 . 9 1 1 A 15 15 TYR N N 15 121.955 120.529 1.426 1
1 164 . 9 1 1 A 16 16 LEU H H 16 8.198 8.730 -0.532 1
1 165 . 9 1 1 A 16 16 LEU HA H 16 4.470 4.094 0.376 1
1 175 . 9 1 1 A 16 16 LEU C C 16 177.125 178.020 -0.895 1
1 176 . 9 1 1 A 16 16 LEU CA C 16 57.374 58.208 -0.834 1
1 177 . 9 1 1 A 16 16 LEU CB C 16 41.443 41.566 -0.123 1
1 178 . 9 1 1 A 16 16 LEU N N 16 117.642 121.803 -4.161 1
1 179 . 9 1 1 A 17 17 ASP H H 17 8.061 8.501 -0.440 1
1 180 . 9 1 1 A 17 17 ASP C C 17 177.836 178.310 -0.474 1
1 181 . 9 1 1 A 17 17 ASP CA C 17 57.486 57.875 -0.389 1
1 182 . 9 1 1 A 17 17 ASP CB C 17 41.433 42.040 -0.607 1
1 183 . 9 1 1 A 17 17 ASP N N 17 118.700 119.218 -0.518 1
1 184 . 9 1 1 A 18 18 GLN H H 18 8.111 7.748 0.363 1
1 185 . 9 1 1 A 18 18 GLN HA H 18 4.002 4.054 -0.052 1
1 190 . 9 1 1 A 18 18 GLN CA C 18 59.046 58.766 0.280 1
1 191 . 9 1 1 A 18 18 GLN CB C 18 28.700 28.374 0.326 1
1 193 . 9 1 1 A 18 18 GLN N N 18 119.539 118.783 0.756 1
1 195 . 9 1 1 A 19 19 ILE H H 19 8.330 8.255 0.075 1
1 196 . 9 1 1 A 19 19 ILE HA H 19 3.306 4.040 -0.734 1
1 204 . 9 1 1 A 19 19 ILE C C 19 175.608 177.914 -2.306 1
1 205 . 9 1 1 A 19 19 ILE CA C 19 64.760 63.429 1.331 1
1 206 . 9 1 1 A 19 19 ILE CB C 19 37.148 36.992 0.156 1
1 209 . 9 1 1 A 19 19 ILE N N 19 121.490 120.371 1.119 1
1 210 . 9 1 1 A 20 20 ALA H H 20 8.057 8.133 -0.076 1
1 211 . 9 1 1 A 20 20 ALA HA H 20 4.349 4.132 0.217 1
1 215 . 9 1 1 A 20 20 ALA C C 20 179.297 179.386 -0.089 1
1 216 . 9 1 1 A 20 20 ALA CA C 20 56.150 55.540 0.610 1
1 217 . 9 1 1 A 20 20 ALA CB C 20 18.104 18.788 -0.684 1
1 218 . 9 1 1 A 20 20 ALA N N 20 124.441 123.936 0.505 1
1 219 . 9 1 1 A 21 21 LYS H H 21 8.116 8.186 -0.070 1
1 220 . 9 1 1 A 21 21 LYS HA H 21 4.108 4.031 0.077 1
1 229 . 9 1 1 A 21 21 LYS C C 21 176.720 178.398 -1.678 1
1 230 . 9 1 1 A 21 21 LYS CA C 21 59.166 59.675 -0.509 1
1 231 . 9 1 1 A 21 21 LYS CB C 21 32.085 32.533 -0.448 1
1 233 . 9 1 1 A 21 21 LYS N N 21 119.865 118.943 0.922 1
1 234 . 9 1 1 A 22 22 PHE H H 22 7.875 8.120 -0.245 1
1 235 . 9 1 1 A 22 22 PHE HA H 22 4.012 4.169 -0.157 1
1 242 . 9 1 1 A 22 22 PHE C C 22 175.545 177.750 -2.205 1
1 243 . 9 1 1 A 22 22 PHE CA C 22 61.070 61.293 -0.223 1
1 244 . 9 1 1 A 22 22 PHE CB C 22 39.072 38.504 0.568 1
1 249 . 9 1 1 A 22 22 PHE N N 22 119.729 120.022 -0.293 1
1 250 . 9 1 1 A 23 23 TRP H H 23 7.841 8.255 -0.414 1
1 251 . 9 1 1 A 23 23 TRP HA H 23 4.149 4.247 -0.098 1
1 260 . 9 1 1 A 23 23 TRP C C 23 176.668 178.625 -1.957 1
1 261 . 9 1 1 A 23 23 TRP CB C 23 28.543 29.531 -0.988 1
1 267 . 9 1 1 A 23 23 TRP N N 23 119.440 120.608 -1.168 1
1 269 . 9 1 1 A 24 24 GLU H H 24 8.261 8.904 -0.643 1
1 270 . 9 1 1 A 24 24 GLU HA H 24 4.265 4.062 0.203 1
1 275 . 9 1 1 A 24 24 GLU C C 24 179.679 178.696 0.983 1
1 276 . 9 1 1 A 24 24 GLU CA C 24 59.706 59.220 0.486 1
1 277 . 9 1 1 A 24 24 GLU CB C 24 29.720 29.164 0.556 1
1 279 . 9 1 1 A 24 24 GLU N N 24 121.376 117.913 3.463 1
1 280 . 9 1 1 A 25 25 ILE H H 25 8.071 7.662 0.409 1
1 281 . 9 1 1 A 25 25 ILE HA H 25 3.815 3.856 -0.041 1
1 291 . 9 1 1 A 25 25 ILE C C 25 176.343 176.775 -0.432 1
1 292 . 9 1 1 A 25 25 ILE CA C 25 64.464 62.104 2.360 1
1 293 . 9 1 1 A 25 25 ILE CB C 25 37.371 37.610 -0.239 1
1 296 . 9 1 1 A 25 25 ILE N N 25 121.499 119.875 1.624 1
1 297 . 9 1 1 A 26 26 GLN H H 26 7.327 6.991 0.336 1
1 298 . 9 1 1 A 26 26 GLN HA H 26 4.074 4.118 -0.044 1
1 305 . 9 1 1 A 26 26 GLN C C 26 174.906 175.913 -1.007 1
1 306 . 9 1 1 A 26 26 GLN CA C 26 55.450 55.476 -0.026 1
1 307 . 9 1 1 A 26 26 GLN CB C 26 28.458 28.622 -0.164 1
1 309 . 9 1 1 A 26 26 GLN N N 26 116.532 119.249 -2.717 1
1 311 . 9 1 1 A 27 27 GLY H H 27 7.861 8.592 -0.731 1
1 312 . 9 1 1 A 27 27 GLY HA2 H 27 4.297 3.747 0.550 1
1 313 . 9 1 1 A 27 27 GLY HA3 H 27 3.823 3.750 0.073 1
1 314 . 9 1 1 A 27 27 GLY C C 27 172.698 173.348 -0.650 1
1 315 . 9 1 1 A 27 27 GLY CA C 27 45.608 46.125 -0.517 1
1 316 . 9 1 1 A 27 27 GLY N N 27 106.837 108.740 -1.903 1
1 317 . 9 1 1 A 28 28 SER H H 28 8.083 6.984 1.099 1
1 318 . 9 1 1 A 28 28 SER HA H 28 4.777 4.761 0.016 1
1 321 . 9 1 1 A 28 28 SER C C 28 171.196 171.641 -0.445 1
1 322 . 9 1 1 A 28 28 SER CA C 28 56.041 56.923 -0.882 1
1 323 . 9 1 1 A 28 28 SER CB C 28 64.539 66.859 -2.320 1
1 324 . 9 1 1 A 28 28 SER N N 28 116.151 114.315 1.836 1
1 325 . 9 1 1 A 29 29 SER H H 29 8.354 8.493 -0.139 1
1 326 . 9 1 1 A 29 29 SER HA H 29 4.389 5.094 -0.705 1
1 329 . 9 1 1 A 29 29 SER C C 29 172.166 172.778 -0.612 1
1 330 . 9 1 1 A 29 29 SER CA C 29 58.107 56.660 1.447 1
1 331 . 9 1 1 A 29 29 SER CB C 29 63.853 65.843 -1.990 1
1 332 . 9 1 1 A 29 29 SER N N 29 116.596 114.539 2.057 1
1 333 . 9 1 1 A 30 30 LEU H H 30 8.990 8.945 0.045 1
1 334 . 9 1 1 A 30 30 LEU HA H 30 3.964 4.834 -0.870 1
1 344 . 9 1 1 A 30 30 LEU C C 30 173.752 175.188 -1.436 1
1 345 . 9 1 1 A 30 30 LEU CA C 30 55.193 54.788 0.405 1
1 346 . 9 1 1 A 30 30 LEU CB C 30 42.869 41.611 1.258 1
1 349 . 9 1 1 A 30 30 LEU N N 30 125.860 127.503 -1.643 1
1 350 . 9 1 1 A 31 31 LYS H H 31 8.118 8.613 -0.495 1
1 351 . 9 1 1 A 31 31 LYS HA H 31 4.498 4.792 -0.294 1
1 360 . 9 1 1 A 31 31 LYS C C 31 173.555 175.211 -1.656 1
1 361 . 9 1 1 A 31 31 LYS CA C 31 54.372 55.099 -0.727 1
1 362 . 9 1 1 A 31 31 LYS CB C 31 32.814 33.128 -0.314 1
1 365 . 9 1 1 A 31 31 LYS N N 31 129.965 126.476 3.489 1
1 366 . 9 1 1 A 32 32 ILE H H 32 8.717 8.217 0.500 1
1 367 . 9 1 1 A 32 32 ILE HA H 32 4.011 4.498 -0.487 1
1 377 . 9 1 1 A 32 32 ILE C C 32 173.038 175.222 -2.184 1
1 378 . 9 1 1 A 32 32 ILE CA C 32 59.921 58.807 1.114 1
1 379 . 9 1 1 A 32 32 ILE CB C 32 38.139 38.362 -0.223 1
1 382 . 9 1 1 A 32 32 ILE N N 32 127.091 121.972 5.119 1
1 383 . 9 1 1 A 33 33 PRO HA H 33 4.412 4.559 -0.147 1
1 390 . 9 1 1 A 33 33 PRO C C 33 172.724 175.789 -3.065 1
1 391 . 9 1 1 A 33 33 PRO CA C 33 62.565 62.267 0.298 1
1 392 . 9 1 1 A 33 33 PRO CB C 33 32.728 32.873 -0.145 1
1 394 . 9 1 1 A 34 34 ASN H H 34 8.265 8.554 -0.289 1
1 395 . 9 1 1 A 34 34 ASN HA H 34 5.147 5.599 -0.452 1
1 400 . 9 1 1 A 34 34 ASN C C 34 174.079 173.170 0.909 1
1 401 . 9 1 1 A 34 34 ASN CA C 34 52.088 51.583 0.505 1
1 402 . 9 1 1 A 34 34 ASN CB C 34 40.387 42.310 -1.923 1
1 403 . 9 1 1 A 34 34 ASN N N 34 116.424 115.155 1.269 1
1 405 . 9 1 1 A 35 35 VAL H H 35 8.904 8.917 -0.013 1
1 406 . 9 1 1 A 35 35 VAL HA H 35 4.159 4.617 -0.458 1
1 414 . 9 1 1 A 35 35 VAL C C 35 173.834 175.063 -1.229 1
1 415 . 9 1 1 A 35 35 VAL CA C 35 61.953 59.490 2.463 1
1 416 . 9 1 1 A 35 35 VAL CB C 35 34.432 34.456 -0.024 1
1 419 . 9 1 1 A 35 35 VAL N N 35 122.778 118.766 4.012 1
1 420 . 9 1 1 A 36 36 GLU H H 36 9.560 9.525 0.035 1
1 421 . 9 1 1 A 36 36 GLU HA H 36 3.819 4.018 -0.199 1
1 426 . 9 1 1 A 36 36 GLU C C 36 173.604 175.848 -2.244 1
1 427 . 9 1 1 A 36 36 GLU CA C 36 57.131 58.020 -0.889 1
1 428 . 9 1 1 A 36 36 GLU CB C 36 27.464 27.974 -0.510 1
1 430 . 9 1 1 A 36 36 GLU N N 36 127.014 129.264 -2.250 1
1 431 . 9 1 1 A 37 37 ARG H H 37 8.578 8.443 0.135 1
1 432 . 9 1 1 A 37 37 ARG HA H 37 3.792 3.916 -0.124 1
1 439 . 9 1 1 A 37 37 ARG C C 37 173.371 174.839 -1.468 1
1 440 . 9 1 1 A 37 37 ARG CA C 37 57.952 57.898 0.054 1
1 441 . 9 1 1 A 37 37 ARG CB C 37 27.657 27.953 -0.296 1
1 443 . 9 1 1 A 37 37 ARG N N 37 108.362 110.741 -2.379 1
1 444 . 9 1 1 A 38 38 ARG H H 38 7.696 7.950 -0.254 1
1 445 . 9 1 1 A 38 38 ARG HA H 38 4.743 4.630 0.113 1
1 452 . 9 1 1 A 38 38 ARG C C 38 173.513 175.573 -2.060 1
1 453 . 9 1 1 A 38 38 ARG CA C 38 54.507 56.003 -1.496 1
1 454 . 9 1 1 A 38 38 ARG CB C 38 33.751 31.668 2.083 1
1 456 . 9 1 1 A 38 38 ARG N N 38 118.370 120.637 -2.267 1
1 457 . 9 1 1 A 39 39 ILE H H 39 8.463 8.408 0.055 1
1 458 . 9 1 1 A 39 39 ILE HA H 39 4.184 4.237 -0.053 1
1 468 . 9 1 1 A 39 39 ILE C C 39 175.150 175.733 -0.583 1
1 469 . 9 1 1 A 39 39 ILE CA C 39 62.076 62.489 -0.413 1
1 470 . 9 1 1 A 39 39 ILE CB C 39 38.864 39.072 -0.208 1
1 473 . 9 1 1 A 39 39 ILE N N 39 123.604 127.657 -4.053 1
1 474 . 9 1 1 A 40 40 LEU H H 40 8.239 8.227 0.012 1
1 475 . 9 1 1 A 40 40 LEU HA H 40 4.259 4.674 -0.415 1
1 485 . 9 1 1 A 40 40 LEU C C 40 173.152 175.604 -2.452 1
1 486 . 9 1 1 A 40 40 LEU CA C 40 55.305 54.830 0.475 1
1 487 . 9 1 1 A 40 40 LEU CB C 40 43.113 42.642 0.471 1
1 490 . 9 1 1 A 40 40 LEU N N 40 129.550 130.111 -0.561 1
1 491 . 9 1 1 A 41 41 ASP H H 41 8.992 8.374 0.618 1
1 492 . 9 1 1 A 41 41 ASP HA H 41 4.798 4.870 -0.072 1
1 495 . 9 1 1 A 41 41 ASP C C 41 173.837 176.305 -2.468 1
1 496 . 9 1 1 A 41 41 ASP CA C 41 52.077 54.153 -2.076 1
1 497 . 9 1 1 A 41 41 ASP CB C 41 39.454 41.453 -1.999 1
1 498 . 9 1 1 A 41 41 ASP N N 41 127.022 126.297 0.725 1
1 499 . 9 1 1 A 42 42 LEU H H 42 7.912 8.947 -1.035 1
1 500 . 9 1 1 A 42 42 LEU HA H 42 3.970 4.409 -0.439 1
1 510 . 9 1 1 A 42 42 LEU C C 42 176.305 177.622 -1.317 1
1 511 . 9 1 1 A 42 42 LEU CA C 42 58.128 55.483 2.645 1
1 512 . 9 1 1 A 42 42 LEU CB C 42 43.043 42.475 0.568 1
1 514 . 9 1 1 A 42 42 LEU N N 42 125.064 124.005 1.059 1
1 515 . 9 1 1 A 43 43 TYR H H 43 8.565 8.025 0.540 1
1 516 . 9 1 1 A 43 43 TYR HA H 43 3.728 3.934 -0.206 1
1 523 . 9 1 1 A 43 43 TYR C C 43 175.757 178.347 -2.590 1
1 524 . 9 1 1 A 43 43 TYR CA C 43 61.774 60.190 1.584 1
1 525 . 9 1 1 A 43 43 TYR CB C 43 38.235 38.040 0.195 1
1 528 . 9 1 1 A 43 43 TYR N N 43 117.822 119.369 -1.547 1
1 529 . 9 1 1 A 44 44 SER H H 44 8.115 8.413 -0.298 1
1 530 . 9 1 1 A 44 44 SER HA H 44 3.854 4.264 -0.410 1
1 533 . 9 1 1 A 44 44 SER C C 44 174.080 176.143 -2.063 1
1 534 . 9 1 1 A 44 44 SER CA C 44 61.873 61.807 0.066 1
1 535 . 9 1 1 A 44 44 SER CB C 44 64.350 63.016 1.334 1
1 536 . 9 1 1 A 44 44 SER N N 44 116.835 116.168 0.667 1
1 537 . 9 1 1 A 45 45 LEU H H 45 8.401 8.034 0.367 1
1 538 . 9 1 1 A 45 45 LEU HA H 45 4.102 4.199 -0.097 1
1 548 . 9 1 1 A 45 45 LEU C C 45 175.081 178.604 -3.523 1
1 549 . 9 1 1 A 45 45 LEU CA C 45 58.896 57.854 1.042 1
1 550 . 9 1 1 A 45 45 LEU CB C 45 41.741 41.502 0.239 1
1 553 . 9 1 1 A 45 45 LEU N N 45 120.621 123.332 -2.711 1
1 554 . 9 1 1 A 46 46 SER H H 46 8.110 8.706 -0.596 1
1 555 . 9 1 1 A 46 46 SER HA H 46 4.300 4.284 0.016 1
1 558 . 9 1 1 A 46 46 SER C C 46 175.019 176.655 -1.636 1
1 559 . 9 1 1 A 46 46 SER CA C 46 62.610 61.471 1.139 1
1 560 . 9 1 1 A 46 46 SER CB C 46 64.092 62.821 1.271 1
1 561 . 9 1 1 A 46 46 SER N N 46 112.826 114.164 -1.338 1
1 562 . 9 1 1 A 47 47 LYS H H 47 7.732 7.967 -0.235 1
1 563 . 9 1 1 A 47 47 LYS HA H 47 3.900 4.153 -0.253 1
1 572 . 9 1 1 A 47 47 LYS C C 47 177.441 179.014 -1.573 1
1 573 . 9 1 1 A 47 47 LYS CA C 47 58.575 59.117 -0.542 1
1 574 . 9 1 1 A 47 47 LYS CB C 47 32.351 31.667 0.684 1
1 576 . 9 1 1 A 47 47 LYS N N 47 121.210 119.003 2.207 1
1 577 . 9 1 1 A 48 48 ILE H H 48 8.672 8.181 0.491 1
1 578 . 9 1 1 A 48 48 ILE HA H 48 3.628 3.710 -0.082 1
1 588 . 9 1 1 A 48 48 ILE C C 48 175.861 177.926 -2.065 1
1 589 . 9 1 1 A 48 48 ILE CA C 48 64.188 65.126 -0.938 1
1 590 . 9 1 1 A 48 48 ILE CB C 48 37.954 37.732 0.222 1
1 593 . 9 1 1 A 48 48 ILE N N 48 120.810 121.037 -0.227 1
1 594 . 9 1 1 A 49 49 VAL H H 49 8.030 8.302 -0.272 1
1 595 . 9 1 1 A 49 49 VAL HA H 49 3.195 3.590 -0.395 1
1 603 . 9 1 1 A 49 49 VAL C C 49 176.513 178.507 -1.994 1
1 604 . 9 1 1 A 49 49 VAL CA C 49 66.760 66.874 -0.114 1
1 605 . 9 1 1 A 49 49 VAL CB C 49 30.935 31.810 -0.875 1
1 608 . 9 1 1 A 49 49 VAL N N 49 119.350 119.756 -0.406 1
1 609 . 9 1 1 A 50 50 VAL H H 50 7.336 8.304 -0.968 1
1 610 . 9 1 1 A 50 50 VAL HA H 50 3.497 3.574 -0.077 1
1 618 . 9 1 1 A 50 50 VAL C C 50 178.745 178.458 0.287 1
1 619 . 9 1 1 A 50 50 VAL CA C 50 67.384 66.540 0.844 1
1 620 . 9 1 1 A 50 50 VAL CB C 50 31.832 31.537 0.295 1
1 621 . 9 1 1 A 50 50 VAL N N 50 118.610 120.645 -2.035 1
1 622 . 9 1 1 A 51 51 GLU H H 51 8.318 8.196 0.122 1
1 623 . 9 1 1 A 51 51 GLU HA H 51 3.953 4.032 -0.079 1
1 628 . 9 1 1 A 51 51 GLU C C 51 177.281 178.827 -1.546 1
1 629 . 9 1 1 A 51 51 GLU CA C 51 59.668 58.914 0.754 1
1 630 . 9 1 1 A 51 51 GLU CB C 51 30.131 29.418 0.713 1
1 632 . 9 1 1 A 51 51 GLU N N 51 122.096 119.929 2.167 1
1 633 . 9 1 1 A 52 52 GLU H H 52 8.065 8.190 -0.125 1
1 634 . 9 1 1 A 52 52 GLU HA H 52 4.229 4.238 -0.009 1
1 639 . 9 1 1 A 52 52 GLU C C 52 173.534 176.604 -3.070 1
1 640 . 9 1 1 A 52 52 GLU CA C 52 55.547 56.486 -0.939 1
1 641 . 9 1 1 A 52 52 GLU CB C 52 28.716 30.098 -1.382 1
1 643 . 9 1 1 A 52 52 GLU N N 52 114.992 116.122 -1.130 1
1 644 . 9 1 1 A 53 53 GLY H H 53 7.459 9.027 -1.568 1
1 645 . 9 1 1 A 53 53 GLY HA2 H 53 3.630 3.951 -0.321 1
1 646 . 9 1 1 A 53 53 GLY HA3 H 53 3.630 3.969 -0.339 1
1 647 . 9 1 1 A 53 53 GLY C C 53 173.214 173.667 -0.453 1
1 648 . 9 1 1 A 53 53 GLY CA C 53 44.962 45.085 -0.123 1
1 649 . 9 1 1 A 53 53 GLY N N 53 104.909 108.037 -3.128 1
1 650 . 9 1 1 A 54 54 GLY H H 54 8.533 7.647 0.886 1
1 651 . 9 1 1 A 54 54 GLY HA2 H 54 3.548 4.054 -0.506 1
1 652 . 9 1 1 A 54 54 GLY HA3 H 54 4.521 4.100 0.421 1
1 653 . 9 1 1 A 54 54 GLY C C 54 169.966 174.551 -4.585 1
1 654 . 9 1 1 A 54 54 GLY CA C 54 43.988 45.690 -1.702 1
1 655 . 9 1 1 A 54 54 GLY N N 54 110.587 107.957 2.630 1
1 656 . 9 1 1 A 55 55 TYR H H 55 8.704 9.092 -0.388 1
1 657 . 9 1 1 A 55 55 TYR HA H 55 3.618 3.900 -0.282 1
1 664 . 9 1 1 A 55 55 TYR C C 55 174.807 177.242 -2.435 1
1 665 . 9 1 1 A 55 55 TYR CA C 55 62.540 61.594 0.946 1
1 666 . 9 1 1 A 55 55 TYR CB C 55 39.669 39.403 0.266 1
1 669 . 9 1 1 A 55 55 TYR N N 55 119.168 122.134 -2.966 1
1 670 . 9 1 1 A 56 56 GLU H H 56 9.006 8.298 0.708 1
1 671 . 9 1 1 A 56 56 GLU HA H 56 3.638 3.455 0.183 1
1 676 . 9 1 1 A 56 56 GLU C C 56 177.400 178.057 -0.657 1
1 677 . 9 1 1 A 56 56 GLU CA C 56 60.530 59.559 0.971 1
1 678 . 9 1 1 A 56 56 GLU CB C 56 29.168 29.192 -0.024 1
1 679 . 9 1 1 A 56 56 GLU N N 56 118.969 119.208 -0.239 1
1 680 . 9 1 1 A 57 57 ALA H H 57 8.235 7.755 0.480 1
1 681 . 9 1 1 A 57 57 ALA HA H 57 3.980 3.970 0.010 1
1 685 . 9 1 1 A 57 57 ALA C C 57 177.678 179.868 -2.190 1
1 686 . 9 1 1 A 57 57 ALA CA C 57 54.910 55.111 -0.201 1
1 687 . 9 1 1 A 57 57 ALA CB C 57 18.122 18.207 -0.085 1
1 688 . 9 1 1 A 57 57 ALA N N 57 122.860 121.538 1.322 1
1 689 . 9 1 1 A 58 58 ILE H H 58 7.831 7.417 0.414 1
1 690 . 9 1 1 A 58 58 ILE HA H 58 3.189 3.194 -0.005 1
1 700 . 9 1 1 A 58 58 ILE C C 58 177.818 177.167 0.651 1
1 701 . 9 1 1 A 58 58 ILE CA C 58 65.074 65.075 -0.001 1
1 702 . 9 1 1 A 58 58 ILE CB C 58 38.178 37.079 1.099 1
1 706 . 9 1 1 A 58 58 ILE N N 58 117.418 117.610 -0.192 1
1 707 . 9 1 1 A 59 59 CYS H H 59 7.760 7.954 -0.194 1
1 708 . 9 1 1 A 59 59 CYS HA H 59 4.203 4.154 0.049 1
1 711 . 9 1 1 A 59 59 CYS C C 59 176.357 177.352 -0.995 1
1 712 . 9 1 1 A 59 59 CYS CA C 59 63.760 62.087 1.673 1
1 713 . 9 1 1 A 59 59 CYS CB C 59 27.638 26.567 1.071 1
1 714 . 9 1 1 A 59 59 CYS N N 59 115.302 120.513 -5.211 1
1 715 . 9 1 1 A 60 60 LYS H H 60 8.350 7.820 0.530 1
1 716 . 9 1 1 A 60 60 LYS HA H 60 3.972 4.002 -0.030 1
1 725 . 9 1 1 A 60 60 LYS C C 60 176.373 177.587 -1.214 1
1 726 . 9 1 1 A 60 60 LYS CA C 60 59.796 58.552 1.244 1
1 727 . 9 1 1 A 60 60 LYS CB C 60 32.560 32.234 0.326 1
1 729 . 9 1 1 A 60 60 LYS N N 60 122.343 120.482 1.861 1
1 730 . 9 1 1 A 61 61 ASP H H 61 8.157 7.644 0.513 1
1 731 . 9 1 1 A 61 61 ASP HA H 61 4.616 4.662 -0.046 1
1 734 . 9 1 1 A 61 61 ASP C C 61 173.246 175.698 -2.452 1
1 735 . 9 1 1 A 61 61 ASP CA C 61 54.272 53.612 0.660 1
1 736 . 9 1 1 A 61 61 ASP CB C 61 41.023 41.131 -0.108 1
1 737 . 9 1 1 A 61 61 ASP N N 61 116.173 118.796 -2.623 1
1 738 . 9 1 1 A 62 62 ARG H H 62 7.655 7.693 -0.038 1
1 739 . 9 1 1 A 62 62 ARG HA H 62 4.149 3.966 0.183 1
1 746 . 9 1 1 A 62 62 ARG C C 62 175.891 176.281 -0.390 1
1 747 . 9 1 1 A 62 62 ARG CA C 62 57.381 57.112 0.269 1
1 748 . 9 1 1 A 62 62 ARG CB C 62 26.538 29.297 -2.759 1
1 750 . 9 1 1 A 62 62 ARG N N 62 117.213 118.584 -1.371 1
1 751 . 9 1 1 A 63 63 ARG H H 63 8.302 8.049 0.253 1
1 752 . 9 1 1 A 63 63 ARG HA H 63 4.240 4.146 0.094 1
1 757 . 9 1 1 A 63 63 ARG C C 63 175.775 178.058 -2.283 1
1 758 . 9 1 1 A 63 63 ARG CA C 63 55.718 57.380 -1.662 1
1 760 . 9 1 1 A 63 63 ARG N N 63 116.292 117.772 -1.480 1
1 761 . 9 1 1 A 64 64 TRP H H 64 8.161 7.532 0.629 1
1 762 . 9 1 1 A 64 64 TRP HA H 64 3.836 4.387 -0.551 1
1 771 . 9 1 1 A 64 64 TRP C C 64 176.862 178.634 -1.772 1
1 772 . 9 1 1 A 64 64 TRP CA C 64 62.036 59.700 2.336 1
1 773 . 9 1 1 A 64 64 TRP CB C 64 27.028 29.080 -2.052 1
1 779 . 9 1 1 A 64 64 TRP N N 64 121.486 119.975 1.511 1
1 781 . 9 1 1 A 65 65 ALA H H 65 8.954 7.883 1.071 1
1 782 . 9 1 1 A 65 65 ALA HA H 65 4.290 4.131 0.159 1
1 786 . 9 1 1 A 65 65 ALA C C 65 178.986 179.753 -0.767 1
1 787 . 9 1 1 A 65 65 ALA CA C 65 55.314 55.343 -0.029 1
1 788 . 9 1 1 A 65 65 ALA CB C 65 18.119 18.390 -0.271 1
1 789 . 9 1 1 A 65 65 ALA N N 65 121.559 122.711 -1.152 1
1 790 . 9 1 1 A 66 66 ARG H H 66 7.473 8.015 -0.542 1
1 791 . 9 1 1 A 66 66 ARG HA H 66 4.221 4.116 0.105 1
1 798 . 9 1 1 A 66 66 ARG C C 66 176.670 178.627 -1.957 1
1 799 . 9 1 1 A 66 66 ARG CA C 66 57.871 58.949 -1.078 1
1 800 . 9 1 1 A 66 66 ARG CB C 66 29.097 29.619 -0.522 1
1 801 . 9 1 1 A 66 66 ARG N N 66 119.915 117.160 2.755 1
1 802 . 9 1 1 A 67 67 VAL H H 67 7.134 7.847 -0.713 1
1 803 . 9 1 1 A 67 67 VAL HA H 67 3.304 3.655 -0.351 1
1 811 . 9 1 1 A 67 67 VAL C C 67 175.341 177.923 -2.582 1
1 812 . 9 1 1 A 67 67 VAL CA C 67 66.722 66.631 0.091 1
1 813 . 9 1 1 A 67 67 VAL CB C 67 31.108 31.913 -0.805 1
1 816 . 9 1 1 A 67 67 VAL N N 67 119.970 120.849 -0.879 1
1 817 . 9 1 1 A 68 68 ALA H H 68 7.745 8.659 -0.914 1
1 818 . 9 1 1 A 68 68 ALA HA H 68 4.076 4.173 -0.097 1
1 822 . 9 1 1 A 68 68 ALA C C 68 177.358 179.789 -2.431 1
1 823 . 9 1 1 A 68 68 ALA CA C 68 55.607 55.673 -0.066 1
1 824 . 9 1 1 A 68 68 ALA CB C 68 18.061 18.244 -0.183 1
1 825 . 9 1 1 A 68 68 ALA N N 68 118.239 121.496 -3.257 1
1 826 . 9 1 1 A 69 69 GLN H H 69 7.979 8.022 -0.043 1
1 827 . 9 1 1 A 69 69 GLN HA H 69 4.310 4.018 0.292 1
1 834 . 9 1 1 A 69 69 GLN C C 69 179.370 178.113 1.257 1
1 835 . 9 1 1 A 69 69 GLN CA C 69 59.307 59.211 0.096 1
1 836 . 9 1 1 A 69 69 GLN CB C 69 29.257 28.453 0.804 1
1 838 . 9 1 1 A 69 69 GLN N N 69 118.484 118.244 0.240 1
1 840 . 9 1 1 A 70 70 ARG H H 70 8.374 8.101 0.273 1
1 841 . 9 1 1 A 70 70 ARG HA H 70 4.148 4.157 -0.009 1
1 848 . 9 1 1 A 70 70 ARG C C 70 175.850 178.088 -2.238 1
1 849 . 9 1 1 A 70 70 ARG CA C 70 58.957 58.527 0.430 1
1 850 . 9 1 1 A 70 70 ARG CB C 70 29.799 29.913 -0.114 1
1 852 . 9 1 1 A 70 70 ARG N N 70 120.309 120.678 -0.369 1
1 853 . 9 1 1 A 71 71 LEU H H 71 7.413 7.697 -0.284 1
1 854 . 9 1 1 A 71 71 LEU HA H 71 4.341 4.152 0.189 1
1 864 . 9 1 1 A 71 71 LEU C C 71 173.391 175.438 -2.047 1
1 865 . 9 1 1 A 71 71 LEU CA C 71 54.911 54.704 0.207 1
1 866 . 9 1 1 A 71 71 LEU CB C 71 42.693 41.790 0.903 1
1 867 . 9 1 1 A 71 71 LEU N N 71 118.841 117.610 1.231 1
1 868 . 9 1 1 A 72 72 ASN H H 72 8.038 7.844 0.194 1
1 869 . 9 1 1 A 72 72 ASN HA H 72 4.394 4.290 0.104 1
1 874 . 9 1 1 A 72 72 ASN C C 72 173.042 173.739 -0.697 1
1 875 . 9 1 1 A 72 72 ASN CB C 72 36.412 36.674 -0.262 1
1 876 . 9 1 1 A 72 72 ASN N N 72 112.919 114.541 -1.622 1
1 878 . 9 1 1 A 73 73 TYR H H 73 7.874 7.536 0.338 1
1 879 . 9 1 1 A 73 73 TYR HA H 73 4.868 4.771 0.097 1
1 886 . 9 1 1 A 73 73 TYR C C 73 172.194 173.918 -1.724 1
1 887 . 9 1 1 A 73 73 TYR CA C 73 57.105 56.003 1.102 1
1 888 . 9 1 1 A 73 73 TYR CB C 73 37.918 39.149 -1.231 1
1 889 . 9 1 1 A 73 73 TYR N N 73 117.432 119.376 -1.944 1
1 897 . 9 1 1 A 75 75 PRO HA H 75 4.626 4.251 0.375 1
1 902 . 9 1 1 A 75 75 PRO C C 75 175.728 177.239 -1.511 1
1 903 . 9 1 1 A 75 75 PRO CA C 75 62.502 63.737 -1.235 1
1 904 . 9 1 1 A 75 75 PRO CB C 75 32.339 32.160 0.179 1
1 905 . 9 1 1 A 76 76 GLY H H 76 8.369 8.862 -0.493 1
1 906 . 9 1 1 A 76 76 GLY HA2 H 76 4.057 3.907 0.150 1
1 907 . 9 1 1 A 76 76 GLY HA3 H 76 4.556 3.908 0.648 1
1 908 . 9 1 1 A 76 76 GLY C C 76 173.248 175.044 -1.796 1
1 909 . 9 1 1 A 76 76 GLY CA C 76 46.180 45.244 0.936 1
1 910 . 9 1 1 A 76 76 GLY N N 76 106.185 110.858 -4.673 1
1 911 . 9 1 1 A 77 77 LYS H H 77 8.632 8.289 0.343 1
1 912 . 9 1 1 A 77 77 LYS HA H 77 4.433 3.985 0.448 1
1 921 . 9 1 1 A 77 77 LYS C C 77 174.924 176.437 -1.513 1
1 922 . 9 1 1 A 77 77 LYS CA C 77 56.453 57.953 -1.500 1
1 923 . 9 1 1 A 77 77 LYS CB C 77 33.170 29.773 3.397 1
1 925 . 9 1 1 A 77 77 LYS N N 77 119.592 115.800 3.792 1
1 926 . 9 1 1 A 78 78 ASN H H 78 8.865 8.145 0.720 1
1 927 . 9 1 1 A 78 78 ASN HA H 78 4.654 4.452 0.202 1
1 932 . 9 1 1 A 78 78 ASN C C 78 174.869 177.493 -2.624 1
1 933 . 9 1 1 A 78 78 ASN CA C 78 54.117 56.041 -1.924 1
1 934 . 9 1 1 A 78 78 ASN CB C 78 37.841 39.520 -1.679 1
1 935 . 9 1 1 A 78 78 ASN N N 78 116.880 117.586 -0.706 1
1 937 . 9 1 1 A 79 79 ILE H H 79 8.008 8.263 -0.255 1
1 938 . 9 1 1 A 79 79 ILE HA H 79 3.718 3.666 0.052 1
1 948 . 9 1 1 A 79 79 ILE C C 79 175.921 178.515 -2.594 1
1 949 . 9 1 1 A 79 79 ILE CA C 79 63.618 64.610 -0.992 1
1 950 . 9 1 1 A 79 79 ILE CB C 79 37.158 37.263 -0.105 1
1 952 . 9 1 1 A 79 79 ILE N N 79 119.688 119.866 -0.178 1
1 953 . 9 1 1 A 80 80 GLY H H 80 9.062 8.286 0.776 1
1 954 . 9 1 1 A 80 80 GLY HA2 H 80 3.739 3.815 -0.076 1
1 955 . 9 1 1 A 80 80 GLY HA3 H 80 3.739 3.876 -0.137 1
1 956 . 9 1 1 A 80 80 GLY C C 80 173.185 176.407 -3.222 1
1 957 . 9 1 1 A 80 80 GLY CA C 80 48.166 47.312 0.854 1
1 958 . 9 1 1 A 80 80 GLY N N 80 110.338 108.987 1.351 1
1 959 . 9 1 1 A 81 81 SER H H 81 7.460 7.999 -0.539 1
1 960 . 9 1 1 A 81 81 SER HA H 81 3.904 4.118 -0.214 1
1 963 . 9 1 1 A 81 81 SER C C 81 174.999 175.830 -0.831 1
1 964 . 9 1 1 A 81 81 SER CA C 81 61.138 62.587 -1.449 1
1 965 . 9 1 1 A 81 81 SER CB C 81 62.740 62.941 -0.201 1
1 966 . 9 1 1 A 81 81 SER N N 81 115.348 119.790 -4.442 1
1 967 . 9 1 1 A 82 82 LEU H H 82 7.367 7.404 -0.037 1
1 968 . 9 1 1 A 82 82 LEU HA H 82 3.946 3.764 0.182 1
1 977 . 9 1 1 A 82 82 LEU C C 82 176.969 177.717 -0.748 1
1 978 . 9 1 1 A 82 82 LEU CA C 82 57.504 57.967 -0.463 1
1 979 . 9 1 1 A 82 82 LEU CB C 82 42.185 41.307 0.878 1
1 980 . 9 1 1 A 82 82 LEU N N 82 124.267 122.423 1.844 1
1 981 . 9 1 1 A 83 83 LEU H H 83 8.330 8.176 0.154 1
1 982 . 9 1 1 A 83 83 LEU HA H 83 3.924 3.869 0.055 1
1 991 . 9 1 1 A 83 83 LEU C C 83 176.303 178.221 -1.918 1
1 992 . 9 1 1 A 83 83 LEU CA C 83 58.067 58.293 -0.226 1
1 993 . 9 1 1 A 83 83 LEU CB C 83 41.061 41.462 -0.401 1
1 994 . 9 1 1 A 83 83 LEU N N 83 117.452 119.642 -2.190 1
1 995 . 9 1 1 A 84 84 ARG H H 84 7.651 8.135 -0.484 1
1 996 . 9 1 1 A 84 84 ARG HA H 84 2.230 3.467 -1.237 1
1 1003 . 9 1 1 A 84 84 ARG C C 84 175.902 178.904 -3.002 1
1 1004 . 9 1 1 A 84 84 ARG CA C 84 59.112 59.653 -0.541 1
1 1005 . 9 1 1 A 84 84 ARG CB C 84 28.579 29.828 -1.249 1
1 1007 . 9 1 1 A 84 84 ARG N N 84 119.586 119.665 -0.079 1
1 1008 . 9 1 1 A 85 85 SER H H 85 7.291 8.118 -0.827 1
1 1009 . 9 1 1 A 85 85 SER HA H 85 4.189 4.444 -0.255 1
1 1012 . 9 1 1 A 85 85 SER C C 85 175.546 176.686 -1.140 1
1 1013 . 9 1 1 A 85 85 SER CA C 85 61.376 62.306 -0.930 1
1 1014 . 9 1 1 A 85 85 SER CB C 85 62.805 63.069 -0.264 1
1 1015 . 9 1 1 A 85 85 SER N N 85 112.921 115.794 -2.873 1
1 1016 . 9 1 1 A 86 86 HIS H H 86 8.156 7.619 0.537 1
1 1017 . 9 1 1 A 86 86 HIS HA H 86 4.782 4.176 0.606 1
1 1022 . 9 1 1 A 86 86 HIS C C 86 176.851 177.521 -0.670 1
1 1023 . 9 1 1 A 86 86 HIS CA C 86 58.898 59.593 -0.695 1
1 1024 . 9 1 1 A 86 86 HIS CB C 86 31.110 29.639 1.471 1
1 1027 . 9 1 1 A 86 86 HIS N N 86 119.258 119.141 0.117 1
1 1028 . 9 1 1 A 87 87 TYR H H 87 9.180 8.318 0.862 1
1 1029 . 9 1 1 A 87 87 TYR HA H 87 3.913 3.950 -0.037 1
1 1036 . 9 1 1 A 87 87 TYR C C 87 176.841 177.288 -0.447 1
1 1037 . 9 1 1 A 87 87 TYR CA C 87 63.526 61.453 2.073 1
1 1038 . 9 1 1 A 87 87 TYR CB C 87 39.431 38.444 0.987 1
1 1041 . 9 1 1 A 87 87 TYR N N 87 120.625 120.065 0.560 1
1 1042 . 9 1 1 A 88 88 GLU H H 88 9.028 8.243 0.785 1
1 1043 . 9 1 1 A 88 88 GLU HA H 88 3.682 4.023 -0.341 1
1 1048 . 9 1 1 A 88 88 GLU C C 88 175.833 178.441 -2.608 1
1 1049 . 9 1 1 A 88 88 GLU CA C 88 59.730 60.140 -0.410 1
1 1050 . 9 1 1 A 88 88 GLU CB C 88 30.009 29.468 0.541 1
1 1052 . 9 1 1 A 88 88 GLU N N 88 119.531 117.784 1.747 1
1 1053 . 9 1 1 A 89 89 ARG H H 89 8.052 7.817 0.235 1
1 1054 . 9 1 1 A 89 89 ARG HA H 89 4.292 4.280 0.012 1
1 1061 . 9 1 1 A 89 89 ARG C C 89 176.045 177.669 -1.624 1
1 1062 . 9 1 1 A 89 89 ARG CA C 89 58.538 58.425 0.113 1
1 1063 . 9 1 1 A 89 89 ARG CB C 89 31.841 30.464 1.377 1
1 1065 . 9 1 1 A 89 89 ARG N N 89 114.741 119.463 -4.722 1
1 1066 . 9 1 1 A 90 90 ILE H H 90 8.141 7.648 0.493 1
1 1067 . 9 1 1 A 90 90 ILE HA H 90 4.296 3.675 0.621 1
1 1075 . 9 1 1 A 90 90 ILE C C 90 174.461 176.984 -2.523 1
1 1076 . 9 1 1 A 90 90 ILE CA C 90 63.649 63.091 0.558 1
1 1077 . 9 1 1 A 90 90 ILE CB C 90 40.626 38.766 1.860 1
1 1079 . 9 1 1 A 90 90 ILE N N 90 113.421 118.883 -5.462 1
1 1080 . 9 1 1 A 91 91 VAL H H 91 7.350 7.669 -0.319 1
1 1081 . 9 1 1 A 91 91 VAL HA H 91 4.144 3.645 0.499 1
1 1089 . 9 1 1 A 91 91 VAL C C 91 175.422 176.896 -1.474 1
1 1090 . 9 1 1 A 91 91 VAL CA C 91 65.042 63.835 1.207 1
1 1091 . 9 1 1 A 91 91 VAL CB C 91 33.215 31.648 1.567 1
1 1092 . 9 1 1 A 91 91 VAL N N 91 118.215 120.403 -2.188 1
1 1093 . 9 1 1 A 92 92 TYR H H 92 8.565 8.163 0.402 1
1 1094 . 9 1 1 A 92 92 TYR HA H 92 4.217 4.235 -0.018 1
1 1099 . 9 1 1 A 92 92 TYR C C 92 171.495 175.230 -3.735 1
1 1100 . 9 1 1 A 92 92 TYR CA C 92 61.558 62.339 -0.781 1
1 1101 . 9 1 1 A 92 92 TYR CB C 92 36.757 37.545 -0.788 1
1 1102 . 9 1 1 A 92 92 TYR N N 92 121.370 121.823 -0.453 1
1 1103 . 9 1 1 A 93 93 PRO HA H 93 4.136 4.383 -0.247 1
1 1108 . 9 1 1 A 93 93 PRO C C 93 177.077 178.167 -1.090 1
1 1109 . 9 1 1 A 93 93 PRO CA C 93 66.037 65.968 0.069 1
1 1110 . 9 1 1 A 93 93 PRO CB C 93 31.482 30.978 0.504 1
1 1111 . 9 1 1 A 94 94 TYR H H 94 6.517 7.376 -0.859 1
1 1112 . 9 1 1 A 94 94 TYR HA H 94 2.798 4.402 -1.604 1
1 1119 . 9 1 1 A 94 94 TYR C C 94 174.985 178.112 -3.127 1
1 1120 . 9 1 1 A 94 94 TYR CA C 94 59.356 59.928 -0.572 1
1 1121 . 9 1 1 A 94 94 TYR CB C 94 37.987 37.376 0.611 1
1 1124 . 9 1 1 A 94 94 TYR N N 94 115.987 117.470 -1.483 1
1 1125 . 9 1 1 A 95 95 GLU H H 95 8.205 8.472 -0.267 1
1 1126 . 9 1 1 A 95 95 GLU HA H 95 3.682 4.145 -0.463 1
1 1131 . 9 1 1 A 95 95 GLU C C 95 178.530 179.042 -0.512 1
1 1132 . 9 1 1 A 95 95 GLU CA C 95 58.910 59.719 -0.809 1
1 1133 . 9 1 1 A 95 95 GLU CB C 95 29.187 29.244 -0.057 1
1 1134 . 9 1 1 A 95 95 GLU N N 95 119.946 121.732 -1.786 1
1 1135 . 9 1 1 A 96 96 MET H H 96 8.248 7.991 0.257 1
1 1136 . 9 1 1 A 96 96 MET HA H 96 4.172 4.262 -0.090 1
1 1142 . 9 1 1 A 96 96 MET C C 96 176.874 178.309 -1.435 1
1 1143 . 9 1 1 A 96 96 MET CA C 96 57.159 58.783 -1.624 1
1 1144 . 9 1 1 A 96 96 MET CB C 96 31.829 32.917 -1.088 1
1 1146 . 9 1 1 A 96 96 MET N N 96 117.570 119.383 -1.813 1
1 1147 . 9 1 1 A 97 97 TYR H H 97 7.445 8.463 -1.018 1
1 1148 . 9 1 1 A 97 97 TYR HA H 97 4.248 3.953 0.295 1
1 1155 . 9 1 1 A 97 97 TYR C C 97 176.476 176.920 -0.444 1
1 1156 . 9 1 1 A 97 97 TYR CA C 97 60.470 62.136 -1.666 1
1 1157 . 9 1 1 A 97 97 TYR CB C 97 38.612 38.483 0.129 1
1 1160 . 9 1 1 A 97 97 TYR N N 97 122.246 121.694 0.552 1
1 1161 . 9 1 1 A 98 98 GLN H H 98 8.087 8.813 -0.726 1
1 1162 . 9 1 1 A 98 98 GLN HA H 98 3.793 3.752 0.041 1
1 1169 . 9 1 1 A 98 98 GLN C C 98 175.549 178.778 -3.229 1
1 1170 . 9 1 1 A 98 98 GLN CA C 98 57.365 59.098 -1.733 1
1 1171 . 9 1 1 A 98 98 GLN CB C 98 28.901 28.825 0.076 1
1 1173 . 9 1 1 A 98 98 GLN N N 98 118.769 118.878 -0.109 1
1 1175 . 9 1 1 A 99 99 SER H H 99 7.724 8.075 -0.351 1
1 1176 . 9 1 1 A 99 99 SER HA H 99 4.293 4.285 0.008 1
1 1179 . 9 1 1 A 99 99 SER C C 99 173.696 176.952 -3.256 1
1 1180 . 9 1 1 A 99 99 SER CA C 99 59.566 62.499 -2.933 1
1 1181 . 9 1 1 A 99 99 SER CB C 99 63.847 62.983 0.864 1
1 1182 . 9 1 1 A 99 99 SER N N 99 113.257 117.507 -4.250 1
1 1183 . 9 1 1 A 100 100 GLY H H 100 7.751 8.316 -0.565 1
1 1184 . 9 1 1 A 100 100 GLY HA2 H 100 3.813 3.857 -0.044 1
1 1185 . 9 1 1 A 100 100 GLY HA3 H 100 3.934 3.863 0.071 1
1 1186 . 9 1 1 A 100 100 GLY C C 100 172.643 176.097 -3.454 1
1 1187 . 9 1 1 A 100 100 GLY CA C 100 45.570 47.242 -1.672 1
1 1188 . 9 1 1 A 100 100 GLY N N 100 109.750 108.681 1.069 1
1 1189 . 9 1 1 A 101 101 ALA H H 101 7.824 7.801 0.023 1
1 1190 . 9 1 1 A 101 101 ALA HA H 101 4.221 3.915 0.306 1
1 1194 . 9 1 1 A 101 101 ALA C C 101 175.639 178.899 -3.260 1
1 1195 . 9 1 1 A 101 101 ALA CA C 101 52.745 54.450 -1.705 1
1 1196 . 9 1 1 A 101 101 ALA CB C 101 19.437 17.948 1.489 1
1 1197 . 9 1 1 A 101 101 ALA N N 101 123.241 124.766 -1.525 1
1 1198 . 9 1 1 A 102 102 ASN H H 102 8.191 7.692 0.499 1
1 1199 . 9 1 1 A 102 102 ASN HA H 102 4.658 4.537 0.121 1
1 1204 . 9 1 1 A 102 102 ASN C C 102 173.337 175.196 -1.859 1
1 1205 . 9 1 1 A 102 102 ASN CA C 102 53.374 55.759 -2.385 1
1 1206 . 9 1 1 A 102 102 ASN CB C 102 38.819 39.346 -0.527 1
1 1207 . 9 1 1 A 102 102 ASN N N 102 116.572 116.684 -0.112 1
1 1209 . 9 1 1 A 103 103 LEU H H 103 8.065 8.128 -0.063 1
1 1210 . 9 1 1 A 103 103 LEU HA H 103 4.363 4.718 -0.355 1
1 1219 . 9 1 1 A 103 103 LEU C C 103 175.637 175.012 0.625 1
1 1220 . 9 1 1 A 103 103 LEU CA C 103 55.292 53.392 1.900 1
1 1221 . 9 1 1 A 103 103 LEU CB C 103 42.433 45.005 -2.572 1
1 1222 . 9 1 1 A 103 103 LEU N N 103 122.074 114.471 7.603 1
1 1223 . 9 1 1 A 104 104 VAL H H 104 8.055 9.071 -1.016 1
1 1224 . 9 1 1 A 104 104 VAL HA H 104 4.131 4.392 -0.261 1
1 1232 . 9 1 1 A 104 104 VAL C C 104 174.364 175.821 -1.457 1
1 1233 . 9 1 1 A 104 104 VAL CA C 104 62.552 61.380 1.172 1
1 1234 . 9 1 1 A 104 104 VAL CB C 104 32.766 31.163 1.603 1
1 1235 . 9 1 1 A 104 104 VAL N N 104 120.606 124.350 -3.744 1
1 1236 . 9 1 1 A 105 105 CYS H H 105 8.392 8.366 0.026 1
1 1237 . 9 1 1 A 105 105 CYS HA H 105 4.535 4.931 -0.396 1
1 1240 . 9 1 1 A 105 105 CYS C C 105 172.593 175.590 -2.997 1
1 1241 . 9 1 1 A 105 105 CYS CA C 105 58.449 58.397 0.052 1
1 1242 . 9 1 1 A 105 105 CYS CB C 105 27.952 28.838 -0.886 1
1 1243 . 9 1 1 A 105 105 CYS N N 105 122.791 127.501 -4.710 1
1 1244 . 9 1 1 A 106 106 ASN H H 106 8.575 8.449 0.126 1
1 1245 . 9 1 1 A 106 106 ASN HA H 106 4.843 4.707 0.136 1
1 1250 . 9 1 1 A 106 106 ASN C C 106 173.594 178.234 -4.640 1
1 1251 . 9 1 1 A 106 106 ASN CA C 106 53.337 55.728 -2.391 1
1 1252 . 9 1 1 A 106 106 ASN CB C 106 39.088 38.337 0.751 1
1 1253 . 9 1 1 A 106 106 ASN N N 106 122.001 118.577 3.424 1
1 1255 . 9 1 1 A 107 107 THR H H 107 8.090 8.053 0.037 1
1 1256 . 9 1 1 A 107 107 THR HA H 107 4.348 4.367 -0.019 1
1 1261 . 9 1 1 A 107 107 THR C C 107 172.516 176.354 -3.838 1
1 1262 . 9 1 1 A 107 107 THR CA C 107 61.803 64.353 -2.550 1
1 1263 . 9 1 1 A 107 107 THR CB C 107 69.812 68.824 0.988 1
1 1265 . 9 1 1 A 107 107 THR N N 107 114.374 115.054 -0.680 1
1 1266 . 9 1 1 A 108 108 ARG H H 108 8.322 8.134 0.188 1
1 1267 . 9 1 1 A 108 108 ARG HA H 108 4.634 4.191 0.443 1
1 1274 . 9 1 1 A 108 108 ARG C C 108 172.608 177.764 -5.156 1
1 1275 . 9 1 1 A 108 108 ARG CA C 108 54.026 60.738 -6.712 1
1 1276 . 9 1 1 A 108 108 ARG CB C 108 30.246 29.752 0.494 1
1 1278 . 9 1 1 A 108 108 ARG N N 108 124.017 122.511 1.506 1
1 1279 . 9 1 1 A 109 109 PRO HA H 109 4.354 4.520 -0.166 1
1 1286 . 9 1 1 A 109 109 PRO C C 109 174.978 177.686 -2.708 1
1 1287 . 9 1 1 A 109 109 PRO CA C 109 63.396 63.929 -0.533 1
1 1288 . 9 1 1 A 109 109 PRO CB C 109 32.046 32.849 -0.803 1
1 1290 . 9 1 1 A 110 110 PHE H H 110 8.123 7.953 0.170 1
1 1291 . 9 1 1 A 110 110 PHE HA H 110 4.619 4.234 0.385 1
1 1296 . 9 1 1 A 110 110 PHE C C 110 173.856 176.892 -3.036 1
1 1297 . 9 1 1 A 110 110 PHE CA C 110 57.353 62.065 -4.712 1
1 1298 . 9 1 1 A 110 110 PHE CB C 110 39.364 39.482 -0.118 1
1 1301 . 9 1 1 A 110 110 PHE N N 110 119.265 120.011 -0.746 1
1 1302 . 9 1 1 A 111 111 ASP H H 111 8.161 8.618 -0.457 1
1 1303 . 9 1 1 A 111 111 ASP HA H 111 4.613 4.358 0.255 1
1 1306 . 9 1 1 A 111 111 ASP C C 111 174.114 179.642 -5.528 1
1 1307 . 9 1 1 A 111 111 ASP CA C 111 54.350 57.461 -3.111 1
1 1308 . 9 1 1 A 111 111 ASP CB C 111 41.413 40.158 1.255 1
1 1309 . 9 1 1 A 111 111 ASP N N 111 121.764 119.455 2.309 1
1 1310 . 9 1 1 A 112 112 ASN H H 112 8.307 8.396 -0.089 1
1 1311 . 9 1 1 A 112 112 ASN HA H 112 4.662 4.796 -0.134 1
1 1316 . 9 1 1 A 112 112 ASN C C 112 173.595 178.244 -4.649 1
1 1317 . 9 1 1 A 112 112 ASN CA C 112 53.486 55.979 -2.493 1
1 1318 . 9 1 1 A 112 112 ASN CB C 112 39.225 38.323 0.902 1
1 1319 . 9 1 1 A 112 112 ASN N N 112 119.154 117.891 1.263 1
1 1321 . 9 1 1 A 113 113 GLU H H 113 8.404 8.155 0.249 1
1 1322 . 9 1 1 A 113 113 GLU HA H 113 4.264 4.026 0.238 1
1 1327 . 9 1 1 A 113 113 GLU C C 113 174.886 179.339 -4.453 1
1 1328 . 9 1 1 A 113 113 GLU CA C 113 56.681 59.407 -2.726 1
1 1329 . 9 1 1 A 113 113 GLU CB C 113 30.403 29.908 0.495 1
1 1331 . 9 1 1 A 113 113 GLU N N 113 120.943 120.411 0.532 1
1 1332 . 9 1 1 A 114 114 GLU H H 114 8.388 8.100 0.288 1
1 1333 . 9 1 1 A 114 114 GLU HA H 114 4.262 4.390 -0.128 1
1 1338 . 9 1 1 A 114 114 GLU C C 114 174.819 176.848 -2.029 1
1 1339 . 9 1 1 A 114 114 GLU CA C 114 56.769 58.811 -2.042 1
1 1340 . 9 1 1 A 114 114 GLU CB C 114 30.125 30.448 -0.323 1
1 1342 . 9 1 1 A 114 114 GLU N N 114 121.869 119.364 2.505 1
1 1343 . 9 1 1 A 115 115 LYS H H 115 8.236 8.014 0.222 1
1 1344 . 9 1 1 A 115 115 LYS HA H 115 4.347 4.764 -0.417 1
1 1353 . 9 1 1 A 115 115 LYS C C 115 174.633 175.798 -1.165 1
1 1354 . 9 1 1 A 115 115 LYS CA C 115 56.426 55.937 0.489 1
1 1355 . 9 1 1 A 115 115 LYS CB C 115 33.277 35.482 -2.205 1
1 1359 . 9 1 1 A 115 115 LYS N N 115 121.997 120.086 1.911 1
1 1360 . 9 1 1 A 116 116 ASP H H 116 8.386 8.770 -0.384 1
1 1361 . 9 1 1 A 116 116 ASP HA H 116 4.600 4.384 0.216 1
1 1364 . 9 1 1 A 116 116 ASP C C 116 173.448 176.219 -2.771 1
1 1365 . 9 1 1 A 116 116 ASP CA C 116 54.773 56.924 -2.151 1
1 1366 . 9 1 1 A 116 116 ASP CB C 116 41.029 41.090 -0.061 1
1 1367 . 9 1 1 A 116 116 ASP N N 116 121.057 124.712 -3.655 1
1 5 . 10 1 1 A 2 2 MET HA H 2 4.534 4.754 -0.220 1
1 13 . 10 1 1 A 2 2 MET C C 2 174.355 176.469 -2.114 1
1 14 . 10 1 1 A 2 2 MET CA C 2 56.247 54.667 1.580 1
1 15 . 10 1 1 A 2 2 MET CB C 2 32.855 33.058 -0.203 1
1 18 . 10 1 1 A 3 3 ASN H H 3 8.600 7.607 0.993 1
1 19 . 10 1 1 A 3 3 ASN HA H 3 4.711 4.405 0.306 1
1 24 . 10 1 1 A 3 3 ASN C C 3 173.983 177.491 -3.508 1
1 25 . 10 1 1 A 3 3 ASN CA C 3 53.650 56.600 -2.950 1
1 26 . 10 1 1 A 3 3 ASN CB C 3 38.624 39.840 -1.216 1
1 27 . 10 1 1 A 3 3 ASN N N 3 120.149 119.809 0.340 1
1 29 . 10 1 1 A 4 4 GLU H H 4 8.495 8.187 0.308 1
1 30 . 10 1 1 A 4 4 GLU HA H 4 4.235 4.053 0.182 1
1 35 . 10 1 1 A 4 4 GLU C C 4 175.752 178.349 -2.597 1
1 36 . 10 1 1 A 4 4 GLU CA C 4 58.075 59.215 -1.140 1
1 37 . 10 1 1 A 4 4 GLU CB C 4 30.125 29.639 0.486 1
1 38 . 10 1 1 A 4 4 GLU N N 4 121.543 118.436 3.107 1
1 39 . 10 1 1 A 5 5 LEU HA H 5 4.073 4.157 -0.084 1
1 47 . 10 1 1 A 5 5 LEU CB C 5 41.897 42.835 -0.938 1
1 50 . 10 1 1 A 6 6 GLU H H 6 8.332 8.502 -0.170 1
1 51 . 10 1 1 A 6 6 GLU HA H 6 3.621 4.152 -0.531 1
1 52 . 10 1 1 A 6 6 GLU C C 6 176.402 178.705 -2.303 1
1 53 . 10 1 1 A 6 6 GLU CA C 6 58.461 57.236 1.225 1
1 54 . 10 1 1 A 6 6 GLU CB C 6 29.730 29.388 0.342 1
1 55 . 10 1 1 A 6 6 GLU N N 6 121.462 118.965 2.497 1
1 56 . 10 1 1 A 7 7 ALA H H 7 8.244 7.696 0.548 1
1 57 . 10 1 1 A 7 7 ALA HA H 7 4.185 4.080 0.105 1
1 61 . 10 1 1 A 7 7 ALA C C 7 177.982 178.494 -0.512 1
1 62 . 10 1 1 A 7 7 ALA CA C 7 54.791 55.310 -0.519 1
1 63 . 10 1 1 A 7 7 ALA CB C 7 18.836 18.884 -0.048 1
1 64 . 10 1 1 A 7 7 ALA N N 7 123.078 122.325 0.753 1
1 65 . 10 1 1 A 8 8 GLN H H 8 8.274 7.827 0.447 1
1 66 . 10 1 1 A 8 8 GLN HA H 8 4.219 4.398 -0.179 1
1 73 . 10 1 1 A 8 8 GLN C C 8 176.325 175.539 0.786 1
1 74 . 10 1 1 A 8 8 GLN CA C 8 57.864 55.766 2.098 1
1 75 . 10 1 1 A 8 8 GLN CB C 8 28.768 28.849 -0.081 1
1 77 . 10 1 1 A 8 8 GLN N N 8 117.452 116.495 0.957 1
1 79 . 10 1 1 A 9 9 THR H H 9 8.043 8.610 -0.567 1
1 80 . 10 1 1 A 9 9 THR HA H 9 3.998 4.674 -0.676 1
1 85 . 10 1 1 A 9 9 THR C C 9 173.904 175.370 -1.466 1
1 86 . 10 1 1 A 9 9 THR CA C 9 65.435 61.204 4.231 1
1 87 . 10 1 1 A 9 9 THR CB C 9 68.870 69.878 -1.008 1
1 89 . 10 1 1 A 9 9 THR N N 9 116.135 119.230 -3.095 1
1 90 . 10 1 1 A 10 10 ARG H H 10 8.095 8.992 -0.897 1
1 91 . 10 1 1 A 10 10 ARG HA H 10 4.040 4.128 -0.088 1
1 98 . 10 1 1 A 10 10 ARG C C 10 176.583 176.211 0.372 1
1 99 . 10 1 1 A 10 10 ARG CA C 10 59.262 57.508 1.754 1
1 100 . 10 1 1 A 10 10 ARG CB C 10 29.900 30.132 -0.232 1
1 101 . 10 1 1 A 10 10 ARG N N 10 121.157 125.141 -3.984 1
1 102 . 10 1 1 A 11 11 VAL H H 11 7.657 7.847 -0.190 1
1 103 . 10 1 1 A 11 11 VAL HA H 11 3.769 4.400 -0.631 1
1 111 . 10 1 1 A 11 11 VAL C C 11 176.662 177.822 -1.160 1
1 112 . 10 1 1 A 11 11 VAL CA C 11 65.914 63.961 1.953 1
1 113 . 10 1 1 A 11 11 VAL CB C 11 31.745 33.380 -1.635 1
1 114 . 10 1 1 A 11 11 VAL N N 11 118.580 118.053 0.527 1
1 115 . 10 1 1 A 12 12 LYS H H 12 7.471 7.859 -0.388 1
1 116 . 10 1 1 A 12 12 LYS HA H 12 3.366 4.390 -1.024 1
1 123 . 10 1 1 A 12 12 LYS C C 12 176.457 179.052 -2.595 1
1 124 . 10 1 1 A 12 12 LYS CA C 12 59.545 59.282 0.263 1
1 125 . 10 1 1 A 12 12 LYS CB C 12 32.206 32.474 -0.268 1
1 126 . 10 1 1 A 12 12 LYS N N 12 121.835 122.841 -1.006 1
1 127 . 10 1 1 A 13 13 LEU H H 13 8.144 8.107 0.037 1
1 128 . 10 1 1 A 13 13 LEU HA H 13 4.093 3.991 0.102 1
1 137 . 10 1 1 A 13 13 LEU C C 13 178.254 178.854 -0.600 1
1 138 . 10 1 1 A 13 13 LEU CA C 13 58.023 57.646 0.377 1
1 139 . 10 1 1 A 13 13 LEU CB C 13 41.283 41.967 -0.684 1
1 140 . 10 1 1 A 13 13 LEU N N 13 118.688 120.684 -1.996 1
1 141 . 10 1 1 A 14 14 ASN H H 14 8.384 8.439 -0.055 1
1 142 . 10 1 1 A 14 14 ASN HA H 14 4.567 4.444 0.123 1
1 147 . 10 1 1 A 14 14 ASN C C 14 175.397 177.675 -2.278 1
1 148 . 10 1 1 A 14 14 ASN CA C 14 56.239 56.682 -0.443 1
1 149 . 10 1 1 A 14 14 ASN CB C 14 38.432 38.395 0.037 1
1 150 . 10 1 1 A 14 14 ASN N N 14 118.175 116.417 1.758 1
1 152 . 10 1 1 A 15 15 TYR H H 15 7.982 8.223 -0.241 1
1 153 . 10 1 1 A 15 15 TYR HA H 15 4.249 4.112 0.137 1
1 160 . 10 1 1 A 15 15 TYR C C 15 175.503 177.376 -1.873 1
1 161 . 10 1 1 A 15 15 TYR CA C 15 62.450 61.457 0.993 1
1 162 . 10 1 1 A 15 15 TYR CB C 15 39.399 38.555 0.844 1
1 163 . 10 1 1 A 15 15 TYR N N 15 121.955 122.502 -0.547 1
1 164 . 10 1 1 A 16 16 LEU H H 16 8.198 8.574 -0.376 1
1 165 . 10 1 1 A 16 16 LEU HA H 16 4.470 4.103 0.367 1
1 175 . 10 1 1 A 16 16 LEU C C 16 177.125 177.987 -0.862 1
1 176 . 10 1 1 A 16 16 LEU CA C 16 57.374 58.270 -0.896 1
1 177 . 10 1 1 A 16 16 LEU CB C 16 41.443 41.721 -0.278 1
1 178 . 10 1 1 A 16 16 LEU N N 16 117.642 122.147 -4.505 1
1 179 . 10 1 1 A 17 17 ASP H H 17 8.061 8.379 -0.318 1
1 180 . 10 1 1 A 17 17 ASP C C 17 177.836 178.424 -0.588 1
1 181 . 10 1 1 A 17 17 ASP CA C 17 57.486 58.092 -0.606 1
1 182 . 10 1 1 A 17 17 ASP CB C 17 41.433 42.098 -0.665 1
1 183 . 10 1 1 A 17 17 ASP N N 17 118.700 119.103 -0.403 1
1 184 . 10 1 1 A 18 18 GLN H H 18 8.111 7.782 0.329 1
1 185 . 10 1 1 A 18 18 GLN HA H 18 4.002 4.100 -0.098 1
1 190 . 10 1 1 A 18 18 GLN CA C 18 59.046 58.756 0.290 1
1 191 . 10 1 1 A 18 18 GLN CB C 18 28.700 28.418 0.282 1
1 193 . 10 1 1 A 18 18 GLN N N 18 119.539 119.539 0.000 1
1 195 . 10 1 1 A 19 19 ILE H H 19 8.330 8.272 0.058 1
1 196 . 10 1 1 A 19 19 ILE HA H 19 3.306 3.894 -0.588 1
1 204 . 10 1 1 A 19 19 ILE C C 19 175.608 177.501 -1.893 1
1 205 . 10 1 1 A 19 19 ILE CA C 19 64.760 63.076 1.684 1
1 206 . 10 1 1 A 19 19 ILE CB C 19 37.148 37.375 -0.227 1
1 209 . 10 1 1 A 19 19 ILE N N 19 121.490 119.994 1.496 1
1 210 . 10 1 1 A 20 20 ALA H H 20 8.057 8.037 0.020 1
1 211 . 10 1 1 A 20 20 ALA HA H 20 4.349 4.283 0.066 1
1 215 . 10 1 1 A 20 20 ALA C C 20 179.297 179.845 -0.548 1
1 216 . 10 1 1 A 20 20 ALA CA C 20 56.150 55.205 0.945 1
1 217 . 10 1 1 A 20 20 ALA CB C 20 18.104 19.452 -1.348 1
1 218 . 10 1 1 A 20 20 ALA N N 20 124.441 124.036 0.405 1
1 219 . 10 1 1 A 21 21 LYS H H 21 8.116 8.041 0.075 1
1 220 . 10 1 1 A 21 21 LYS HA H 21 4.108 4.015 0.093 1
1 229 . 10 1 1 A 21 21 LYS C C 21 176.720 178.952 -2.232 1
1 230 . 10 1 1 A 21 21 LYS CA C 21 59.166 59.207 -0.041 1
1 231 . 10 1 1 A 21 21 LYS CB C 21 32.085 32.316 -0.231 1
1 233 . 10 1 1 A 21 21 LYS N N 21 119.865 117.321 2.544 1
1 234 . 10 1 1 A 22 22 PHE H H 22 7.875 7.974 -0.099 1
1 235 . 10 1 1 A 22 22 PHE HA H 22 4.012 4.132 -0.120 1
1 242 . 10 1 1 A 22 22 PHE C C 22 175.545 177.282 -1.737 1
1 243 . 10 1 1 A 22 22 PHE CA C 22 61.070 61.447 -0.377 1
1 244 . 10 1 1 A 22 22 PHE CB C 22 39.072 39.292 -0.220 1
1 249 . 10 1 1 A 22 22 PHE N N 22 119.729 120.022 -0.293 1
1 250 . 10 1 1 A 23 23 TRP H H 23 7.841 8.178 -0.337 1
1 251 . 10 1 1 A 23 23 TRP HA H 23 4.149 4.023 0.126 1
1 260 . 10 1 1 A 23 23 TRP C C 23 176.668 178.778 -2.110 1
1 261 . 10 1 1 A 23 23 TRP CB C 23 28.543 29.764 -1.221 1
1 267 . 10 1 1 A 23 23 TRP N N 23 119.440 120.845 -1.405 1
1 269 . 10 1 1 A 24 24 GLU H H 24 8.261 8.692 -0.431 1
1 270 . 10 1 1 A 24 24 GLU HA H 24 4.265 4.216 0.049 1
1 275 . 10 1 1 A 24 24 GLU C C 24 179.679 178.067 1.612 1
1 276 . 10 1 1 A 24 24 GLU CA C 24 59.706 58.935 0.771 1
1 277 . 10 1 1 A 24 24 GLU CB C 24 29.720 29.220 0.500 1
1 279 . 10 1 1 A 24 24 GLU N N 24 121.376 117.739 3.637 1
1 280 . 10 1 1 A 25 25 ILE H H 25 8.071 7.950 0.121 1
1 281 . 10 1 1 A 25 25 ILE HA H 25 3.815 3.853 -0.038 1
1 291 . 10 1 1 A 25 25 ILE C C 25 176.343 176.873 -0.530 1
1 292 . 10 1 1 A 25 25 ILE CA C 25 64.464 62.178 2.286 1
1 293 . 10 1 1 A 25 25 ILE CB C 25 37.371 37.682 -0.311 1
1 296 . 10 1 1 A 25 25 ILE N N 25 121.499 120.930 0.569 1
1 297 . 10 1 1 A 26 26 GLN H H 26 7.327 7.102 0.225 1
1 298 . 10 1 1 A 26 26 GLN HA H 26 4.074 4.118 -0.044 1
1 305 . 10 1 1 A 26 26 GLN C C 26 174.906 175.872 -0.966 1
1 306 . 10 1 1 A 26 26 GLN CA C 26 55.450 55.477 -0.027 1
1 307 . 10 1 1 A 26 26 GLN CB C 26 28.458 28.497 -0.039 1
1 309 . 10 1 1 A 26 26 GLN N N 26 116.532 119.165 -2.633 1
1 311 . 10 1 1 A 27 27 GLY H H 27 7.861 8.667 -0.806 1
1 312 . 10 1 1 A 27 27 GLY HA2 H 27 4.297 3.721 0.576 1
1 313 . 10 1 1 A 27 27 GLY HA3 H 27 3.823 3.723 0.100 1
1 314 . 10 1 1 A 27 27 GLY C C 27 172.698 173.102 -0.404 1
1 315 . 10 1 1 A 27 27 GLY CA C 27 45.608 46.008 -0.400 1
1 316 . 10 1 1 A 27 27 GLY N N 27 106.837 108.544 -1.707 1
1 317 . 10 1 1 A 28 28 SER H H 28 8.083 6.866 1.217 1
1 318 . 10 1 1 A 28 28 SER HA H 28 4.777 4.445 0.332 1
1 321 . 10 1 1 A 28 28 SER C C 28 171.196 172.035 -0.839 1
1 322 . 10 1 1 A 28 28 SER CA C 28 56.041 55.837 0.204 1
1 323 . 10 1 1 A 28 28 SER CB C 28 64.539 63.853 0.686 1
1 324 . 10 1 1 A 28 28 SER N N 28 116.151 114.185 1.966 1
1 325 . 10 1 1 A 29 29 SER H H 29 8.354 8.547 -0.193 1
1 326 . 10 1 1 A 29 29 SER HA H 29 4.389 5.216 -0.827 1
1 329 . 10 1 1 A 29 29 SER C C 29 172.166 172.829 -0.663 1
1 330 . 10 1 1 A 29 29 SER CA C 29 58.107 56.642 1.465 1
1 331 . 10 1 1 A 29 29 SER CB C 29 63.853 65.928 -2.075 1
1 332 . 10 1 1 A 29 29 SER N N 29 116.596 115.397 1.199 1
1 333 . 10 1 1 A 30 30 LEU H H 30 8.990 8.890 0.100 1
1 334 . 10 1 1 A 30 30 LEU HA H 30 3.964 4.825 -0.861 1
1 344 . 10 1 1 A 30 30 LEU C C 30 173.752 175.685 -1.933 1
1 345 . 10 1 1 A 30 30 LEU CA C 30 55.193 56.312 -1.119 1
1 346 . 10 1 1 A 30 30 LEU CB C 30 42.869 42.371 0.498 1
1 349 . 10 1 1 A 30 30 LEU N N 30 125.860 127.672 -1.812 1
1 350 . 10 1 1 A 31 31 LYS H H 31 8.118 8.822 -0.704 1
1 351 . 10 1 1 A 31 31 LYS HA H 31 4.498 5.049 -0.551 1
1 360 . 10 1 1 A 31 31 LYS C C 31 173.555 174.511 -0.956 1
1 361 . 10 1 1 A 31 31 LYS CA C 31 54.372 54.835 -0.463 1
1 362 . 10 1 1 A 31 31 LYS CB C 31 32.814 35.795 -2.981 1
1 365 . 10 1 1 A 31 31 LYS N N 31 129.965 127.392 2.573 1
1 366 . 10 1 1 A 32 32 ILE H H 32 8.717 8.737 -0.020 1
1 367 . 10 1 1 A 32 32 ILE HA H 32 4.011 4.830 -0.819 1
1 377 . 10 1 1 A 32 32 ILE C C 32 173.038 174.732 -1.694 1
1 378 . 10 1 1 A 32 32 ILE CA C 32 59.921 58.280 1.641 1
1 379 . 10 1 1 A 32 32 ILE CB C 32 38.139 39.059 -0.920 1
1 382 . 10 1 1 A 32 32 ILE N N 32 127.091 123.595 3.496 1
1 383 . 10 1 1 A 33 33 PRO HA H 33 4.412 4.562 -0.150 1
1 390 . 10 1 1 A 33 33 PRO C C 33 172.724 175.886 -3.162 1
1 391 . 10 1 1 A 33 33 PRO CA C 33 62.565 62.180 0.385 1
1 392 . 10 1 1 A 33 33 PRO CB C 33 32.728 32.728 0.000 1
1 394 . 10 1 1 A 34 34 ASN H H 34 8.265 8.480 -0.215 1
1 395 . 10 1 1 A 34 34 ASN HA H 34 5.147 5.626 -0.479 1
1 400 . 10 1 1 A 34 34 ASN C C 34 174.079 173.379 0.700 1
1 401 . 10 1 1 A 34 34 ASN CA C 34 52.088 51.476 0.612 1
1 402 . 10 1 1 A 34 34 ASN CB C 34 40.387 41.908 -1.521 1
1 403 . 10 1 1 A 34 34 ASN N N 34 116.424 115.601 0.823 1
1 405 . 10 1 1 A 35 35 VAL H H 35 8.904 8.994 -0.090 1
1 406 . 10 1 1 A 35 35 VAL HA H 35 4.159 4.436 -0.277 1
1 414 . 10 1 1 A 35 35 VAL C C 35 173.834 174.768 -0.934 1
1 415 . 10 1 1 A 35 35 VAL CA C 35 61.953 59.646 2.307 1
1 416 . 10 1 1 A 35 35 VAL CB C 35 34.432 34.496 -0.064 1
1 419 . 10 1 1 A 35 35 VAL N N 35 122.778 118.957 3.821 1
1 420 . 10 1 1 A 36 36 GLU H H 36 9.560 9.394 0.166 1
1 421 . 10 1 1 A 36 36 GLU HA H 36 3.819 3.974 -0.155 1
1 426 . 10 1 1 A 36 36 GLU C C 36 173.604 176.317 -2.713 1
1 427 . 10 1 1 A 36 36 GLU CA C 36 57.131 57.962 -0.831 1
1 428 . 10 1 1 A 36 36 GLU CB C 36 27.464 27.985 -0.521 1
1 430 . 10 1 1 A 36 36 GLU N N 36 127.014 129.014 -2.000 1
1 431 . 10 1 1 A 37 37 ARG H H 37 8.578 8.616 -0.038 1
1 432 . 10 1 1 A 37 37 ARG HA H 37 3.792 3.995 -0.203 1
1 439 . 10 1 1 A 37 37 ARG C C 37 173.371 175.267 -1.896 1
1 440 . 10 1 1 A 37 37 ARG CA C 37 57.952 57.362 0.590 1
1 441 . 10 1 1 A 37 37 ARG CB C 37 27.657 27.915 -0.258 1
1 443 . 10 1 1 A 37 37 ARG N N 37 108.362 117.386 -9.024 1
1 444 . 10 1 1 A 38 38 ARG H H 38 7.696 7.781 -0.085 1
1 445 . 10 1 1 A 38 38 ARG HA H 38 4.743 4.943 -0.200 1
1 452 . 10 1 1 A 38 38 ARG C C 38 173.513 175.256 -1.743 1
1 453 . 10 1 1 A 38 38 ARG CA C 38 54.507 54.364 0.143 1
1 454 . 10 1 1 A 38 38 ARG CB C 38 33.751 33.541 0.210 1
1 456 . 10 1 1 A 38 38 ARG N N 38 118.370 121.074 -2.704 1
1 457 . 10 1 1 A 39 39 ILE H H 39 8.463 8.371 0.092 1
1 458 . 10 1 1 A 39 39 ILE HA H 39 4.184 4.271 -0.087 1
1 468 . 10 1 1 A 39 39 ILE C C 39 175.150 175.945 -0.795 1
1 469 . 10 1 1 A 39 39 ILE CA C 39 62.076 61.578 0.498 1
1 470 . 10 1 1 A 39 39 ILE CB C 39 38.864 39.190 -0.326 1
1 473 . 10 1 1 A 39 39 ILE N N 39 123.604 126.103 -2.499 1
1 474 . 10 1 1 A 40 40 LEU H H 40 8.239 8.102 0.137 1
1 475 . 10 1 1 A 40 40 LEU HA H 40 4.259 4.560 -0.301 1
1 485 . 10 1 1 A 40 40 LEU C C 40 173.152 174.631 -1.479 1
1 486 . 10 1 1 A 40 40 LEU CA C 40 55.305 54.870 0.435 1
1 487 . 10 1 1 A 40 40 LEU CB C 40 43.113 42.356 0.757 1
1 490 . 10 1 1 A 40 40 LEU N N 40 129.550 128.982 0.568 1
1 491 . 10 1 1 A 41 41 ASP H H 41 8.992 8.570 0.422 1
1 492 . 10 1 1 A 41 41 ASP HA H 41 4.798 4.829 -0.031 1
1 495 . 10 1 1 A 41 41 ASP C C 41 173.837 176.304 -2.467 1
1 496 . 10 1 1 A 41 41 ASP CA C 41 52.077 54.197 -2.120 1
1 497 . 10 1 1 A 41 41 ASP CB C 41 39.454 39.553 -0.099 1
1 498 . 10 1 1 A 41 41 ASP N N 41 127.022 127.706 -0.684 1
1 499 . 10 1 1 A 42 42 LEU H H 42 7.912 8.297 -0.385 1
1 500 . 10 1 1 A 42 42 LEU HA H 42 3.970 4.086 -0.116 1
1 510 . 10 1 1 A 42 42 LEU C C 42 176.305 178.182 -1.877 1
1 511 . 10 1 1 A 42 42 LEU CA C 42 58.128 57.914 0.214 1
1 512 . 10 1 1 A 42 42 LEU CB C 42 43.043 41.952 1.091 1
1 514 . 10 1 1 A 42 42 LEU N N 42 125.064 126.504 -1.440 1
1 515 . 10 1 1 A 43 43 TYR H H 43 8.565 8.247 0.318 1
1 516 . 10 1 1 A 43 43 TYR HA H 43 3.728 3.954 -0.226 1
1 523 . 10 1 1 A 43 43 TYR C C 43 175.757 178.326 -2.569 1
1 524 . 10 1 1 A 43 43 TYR CA C 43 61.774 60.256 1.518 1
1 525 . 10 1 1 A 43 43 TYR CB C 43 38.235 38.126 0.109 1
1 528 . 10 1 1 A 43 43 TYR N N 43 117.822 119.316 -1.494 1
1 529 . 10 1 1 A 44 44 SER H H 44 8.115 7.773 0.342 1
1 530 . 10 1 1 A 44 44 SER HA H 44 3.854 4.167 -0.313 1
1 533 . 10 1 1 A 44 44 SER C C 44 174.080 177.241 -3.161 1
1 534 . 10 1 1 A 44 44 SER CA C 44 61.873 61.539 0.334 1
1 535 . 10 1 1 A 44 44 SER CB C 44 64.350 62.923 1.427 1
1 536 . 10 1 1 A 44 44 SER N N 44 116.835 115.294 1.541 1
1 537 . 10 1 1 A 45 45 LEU H H 45 8.401 7.875 0.526 1
1 538 . 10 1 1 A 45 45 LEU HA H 45 4.102 4.208 -0.106 1
1 548 . 10 1 1 A 45 45 LEU C C 45 175.081 178.725 -3.644 1
1 549 . 10 1 1 A 45 45 LEU CA C 45 58.896 57.753 1.143 1
1 550 . 10 1 1 A 45 45 LEU CB C 45 41.741 41.471 0.270 1
1 553 . 10 1 1 A 45 45 LEU N N 45 120.621 122.748 -2.127 1
1 554 . 10 1 1 A 46 46 SER H H 46 8.110 8.388 -0.278 1
1 555 . 10 1 1 A 46 46 SER HA H 46 4.300 4.158 0.142 1
1 558 . 10 1 1 A 46 46 SER C C 46 175.019 176.627 -1.608 1
1 559 . 10 1 1 A 46 46 SER CA C 46 62.610 61.734 0.876 1
1 560 . 10 1 1 A 46 46 SER CB C 46 64.092 63.208 0.884 1
1 561 . 10 1 1 A 46 46 SER N N 46 112.826 114.874 -2.048 1
1 562 . 10 1 1 A 47 47 LYS H H 47 7.732 8.075 -0.343 1
1 563 . 10 1 1 A 47 47 LYS HA H 47 3.900 4.107 -0.207 1
1 572 . 10 1 1 A 47 47 LYS C C 47 177.441 178.973 -1.532 1
1 573 . 10 1 1 A 47 47 LYS CA C 47 58.575 59.090 -0.515 1
1 574 . 10 1 1 A 47 47 LYS CB C 47 32.351 31.936 0.415 1
1 576 . 10 1 1 A 47 47 LYS N N 47 121.210 118.900 2.310 1
1 577 . 10 1 1 A 48 48 ILE H H 48 8.672 8.186 0.486 1
1 578 . 10 1 1 A 48 48 ILE HA H 48 3.628 3.696 -0.068 1
1 588 . 10 1 1 A 48 48 ILE C C 48 175.861 177.962 -2.101 1
1 589 . 10 1 1 A 48 48 ILE CA C 48 64.188 65.129 -0.941 1
1 590 . 10 1 1 A 48 48 ILE CB C 48 37.954 37.761 0.193 1
1 593 . 10 1 1 A 48 48 ILE N N 48 120.810 120.988 -0.178 1
1 594 . 10 1 1 A 49 49 VAL H H 49 8.030 8.304 -0.274 1
1 595 . 10 1 1 A 49 49 VAL HA H 49 3.195 3.678 -0.483 1
1 603 . 10 1 1 A 49 49 VAL C C 49 176.513 178.426 -1.913 1
1 604 . 10 1 1 A 49 49 VAL CA C 49 66.760 67.145 -0.385 1
1 605 . 10 1 1 A 49 49 VAL CB C 49 30.935 31.707 -0.772 1
1 608 . 10 1 1 A 49 49 VAL N N 49 119.350 119.696 -0.346 1
1 609 . 10 1 1 A 50 50 VAL H H 50 7.336 8.228 -0.892 1
1 610 . 10 1 1 A 50 50 VAL HA H 50 3.497 3.592 -0.095 1
1 618 . 10 1 1 A 50 50 VAL C C 50 178.745 178.435 0.310 1
1 619 . 10 1 1 A 50 50 VAL CA C 50 67.384 66.759 0.625 1
1 620 . 10 1 1 A 50 50 VAL CB C 50 31.832 31.475 0.357 1
1 621 . 10 1 1 A 50 50 VAL N N 50 118.610 120.622 -2.012 1
1 622 . 10 1 1 A 51 51 GLU H H 51 8.318 8.124 0.194 1
1 623 . 10 1 1 A 51 51 GLU HA H 51 3.953 4.014 -0.061 1
1 628 . 10 1 1 A 51 51 GLU C C 51 177.281 179.167 -1.886 1
1 629 . 10 1 1 A 51 51 GLU CA C 51 59.668 58.819 0.849 1
1 630 . 10 1 1 A 51 51 GLU CB C 51 30.131 28.997 1.134 1
1 632 . 10 1 1 A 51 51 GLU N N 51 122.096 119.797 2.299 1
1 633 . 10 1 1 A 52 52 GLU H H 52 8.065 8.280 -0.215 1
1 634 . 10 1 1 A 52 52 GLU HA H 52 4.229 4.242 -0.013 1
1 639 . 10 1 1 A 52 52 GLU C C 52 173.534 176.611 -3.077 1
1 640 . 10 1 1 A 52 52 GLU CA C 52 55.547 56.498 -0.951 1
1 641 . 10 1 1 A 52 52 GLU CB C 52 28.716 29.940 -1.224 1
1 643 . 10 1 1 A 52 52 GLU N N 52 114.992 116.149 -1.157 1
1 644 . 10 1 1 A 53 53 GLY H H 53 7.459 8.906 -1.447 1
1 645 . 10 1 1 A 53 53 GLY HA2 H 53 3.630 3.952 -0.322 1
1 646 . 10 1 1 A 53 53 GLY HA3 H 53 3.630 3.970 -0.340 1
1 647 . 10 1 1 A 53 53 GLY C C 53 173.214 173.675 -0.461 1
1 648 . 10 1 1 A 53 53 GLY CA C 53 44.962 45.116 -0.154 1
1 649 . 10 1 1 A 53 53 GLY N N 53 104.909 107.783 -2.874 1
1 650 . 10 1 1 A 54 54 GLY H H 54 8.533 7.703 0.830 1
1 651 . 10 1 1 A 54 54 GLY HA2 H 54 3.548 4.041 -0.493 1
1 652 . 10 1 1 A 54 54 GLY HA3 H 54 4.521 4.087 0.434 1
1 653 . 10 1 1 A 54 54 GLY C C 54 169.966 174.525 -4.559 1
1 654 . 10 1 1 A 54 54 GLY CA C 54 43.988 45.722 -1.734 1
1 655 . 10 1 1 A 54 54 GLY N N 54 110.587 107.966 2.621 1
1 656 . 10 1 1 A 55 55 TYR H H 55 8.704 9.044 -0.340 1
1 657 . 10 1 1 A 55 55 TYR HA H 55 3.618 3.905 -0.287 1
1 664 . 10 1 1 A 55 55 TYR C C 55 174.807 176.946 -2.139 1
1 665 . 10 1 1 A 55 55 TYR CA C 55 62.540 61.584 0.956 1
1 666 . 10 1 1 A 55 55 TYR CB C 55 39.669 39.236 0.433 1
1 669 . 10 1 1 A 55 55 TYR N N 55 119.168 122.138 -2.970 1
1 670 . 10 1 1 A 56 56 GLU H H 56 9.006 8.270 0.736 1
1 671 . 10 1 1 A 56 56 GLU HA H 56 3.638 3.457 0.181 1
1 676 . 10 1 1 A 56 56 GLU C C 56 177.400 178.412 -1.012 1
1 677 . 10 1 1 A 56 56 GLU CA C 56 60.530 59.201 1.329 1
1 678 . 10 1 1 A 56 56 GLU CB C 56 29.168 29.127 0.041 1
1 679 . 10 1 1 A 56 56 GLU N N 56 118.969 117.601 1.368 1
1 680 . 10 1 1 A 57 57 ALA H H 57 8.235 7.742 0.493 1
1 681 . 10 1 1 A 57 57 ALA HA H 57 3.980 3.988 -0.008 1
1 685 . 10 1 1 A 57 57 ALA C C 57 177.678 179.706 -2.028 1
1 686 . 10 1 1 A 57 57 ALA CA C 57 54.910 55.123 -0.213 1
1 687 . 10 1 1 A 57 57 ALA CB C 57 18.122 18.356 -0.234 1
1 688 . 10 1 1 A 57 57 ALA N N 57 122.860 121.416 1.444 1
1 689 . 10 1 1 A 58 58 ILE H H 58 7.831 7.306 0.525 1
1 690 . 10 1 1 A 58 58 ILE HA H 58 3.189 3.234 -0.045 1
1 700 . 10 1 1 A 58 58 ILE C C 58 177.818 177.375 0.443 1
1 701 . 10 1 1 A 58 58 ILE CA C 58 65.074 64.574 0.500 1
1 702 . 10 1 1 A 58 58 ILE CB C 58 38.178 36.788 1.390 1
1 706 . 10 1 1 A 58 58 ILE N N 58 117.418 117.597 -0.179 1
1 707 . 10 1 1 A 59 59 CYS H H 59 7.760 7.963 -0.203 1
1 708 . 10 1 1 A 59 59 CYS HA H 59 4.203 4.320 -0.117 1
1 711 . 10 1 1 A 59 59 CYS C C 59 176.357 177.297 -0.940 1
1 712 . 10 1 1 A 59 59 CYS CA C 59 63.760 62.206 1.554 1
1 713 . 10 1 1 A 59 59 CYS CB C 59 27.638 26.576 1.062 1
1 714 . 10 1 1 A 59 59 CYS N N 59 115.302 120.313 -5.011 1
1 715 . 10 1 1 A 60 60 LYS H H 60 8.350 8.092 0.258 1
1 716 . 10 1 1 A 60 60 LYS HA H 60 3.972 4.043 -0.071 1
1 725 . 10 1 1 A 60 60 LYS C C 60 176.373 178.033 -1.660 1
1 726 . 10 1 1 A 60 60 LYS CA C 60 59.796 59.081 0.715 1
1 727 . 10 1 1 A 60 60 LYS CB C 60 32.560 32.548 0.012 1
1 729 . 10 1 1 A 60 60 LYS N N 60 122.343 119.953 2.390 1
1 730 . 10 1 1 A 61 61 ASP H H 61 8.157 7.876 0.281 1
1 731 . 10 1 1 A 61 61 ASP HA H 61 4.616 4.581 0.035 1
1 734 . 10 1 1 A 61 61 ASP C C 61 173.246 175.220 -1.974 1
1 735 . 10 1 1 A 61 61 ASP CA C 61 54.272 53.696 0.576 1
1 736 . 10 1 1 A 61 61 ASP CB C 61 41.023 40.943 0.080 1
1 737 . 10 1 1 A 61 61 ASP N N 61 116.173 116.856 -0.683 1
1 738 . 10 1 1 A 62 62 ARG H H 62 7.655 7.533 0.122 1
1 739 . 10 1 1 A 62 62 ARG HA H 62 4.149 4.015 0.134 1
1 746 . 10 1 1 A 62 62 ARG C C 62 175.891 175.667 0.224 1
1 747 . 10 1 1 A 62 62 ARG CA C 62 57.381 57.108 0.273 1
1 748 . 10 1 1 A 62 62 ARG CB C 62 26.538 27.054 -0.516 1
1 750 . 10 1 1 A 62 62 ARG N N 62 117.213 115.322 1.891 1
1 751 . 10 1 1 A 63 63 ARG H H 63 8.302 7.809 0.493 1
1 752 . 10 1 1 A 63 63 ARG HA H 63 4.240 4.098 0.142 1
1 757 . 10 1 1 A 63 63 ARG C C 63 175.775 178.729 -2.954 1
1 758 . 10 1 1 A 63 63 ARG CA C 63 55.718 58.092 -2.374 1
1 760 . 10 1 1 A 63 63 ARG N N 63 116.292 117.704 -1.412 1
1 761 . 10 1 1 A 64 64 TRP H H 64 8.161 7.589 0.572 1
1 762 . 10 1 1 A 64 64 TRP HA H 64 3.836 4.455 -0.619 1
1 771 . 10 1 1 A 64 64 TRP C C 64 176.862 178.588 -1.726 1
1 772 . 10 1 1 A 64 64 TRP CA C 64 62.036 59.833 2.203 1
1 773 . 10 1 1 A 64 64 TRP CB C 64 27.028 29.191 -2.163 1
1 779 . 10 1 1 A 64 64 TRP N N 64 121.486 119.827 1.659 1
1 781 . 10 1 1 A 65 65 ALA H H 65 8.954 7.962 0.992 1
1 782 . 10 1 1 A 65 65 ALA HA H 65 4.290 4.103 0.187 1
1 786 . 10 1 1 A 65 65 ALA C C 65 178.986 179.416 -0.430 1
1 787 . 10 1 1 A 65 65 ALA CA C 65 55.314 55.463 -0.149 1
1 788 . 10 1 1 A 65 65 ALA CB C 65 18.119 18.140 -0.021 1
1 789 . 10 1 1 A 65 65 ALA N N 65 121.559 122.508 -0.949 1
1 790 . 10 1 1 A 66 66 ARG H H 66 7.473 7.808 -0.335 1
1 791 . 10 1 1 A 66 66 ARG HA H 66 4.221 4.130 0.091 1
1 798 . 10 1 1 A 66 66 ARG C C 66 176.670 178.587 -1.917 1
1 799 . 10 1 1 A 66 66 ARG CA C 66 57.871 58.899 -1.028 1
1 800 . 10 1 1 A 66 66 ARG CB C 66 29.097 29.750 -0.653 1
1 801 . 10 1 1 A 66 66 ARG N N 66 119.915 117.306 2.609 1
1 802 . 10 1 1 A 67 67 VAL H H 67 7.134 7.627 -0.493 1
1 803 . 10 1 1 A 67 67 VAL HA H 67 3.304 3.613 -0.309 1
1 811 . 10 1 1 A 67 67 VAL C C 67 175.341 177.790 -2.449 1
1 812 . 10 1 1 A 67 67 VAL CA C 67 66.722 66.701 0.021 1
1 813 . 10 1 1 A 67 67 VAL CB C 67 31.108 31.927 -0.819 1
1 816 . 10 1 1 A 67 67 VAL N N 67 119.970 121.034 -1.064 1
1 817 . 10 1 1 A 68 68 ALA H H 68 7.745 8.680 -0.935 1
1 818 . 10 1 1 A 68 68 ALA HA H 68 4.076 4.076 0.000 1
1 822 . 10 1 1 A 68 68 ALA C C 68 177.358 179.179 -1.821 1
1 823 . 10 1 1 A 68 68 ALA CA C 68 55.607 56.000 -0.393 1
1 824 . 10 1 1 A 68 68 ALA CB C 68 18.061 18.729 -0.668 1
1 825 . 10 1 1 A 68 68 ALA N N 68 118.239 121.708 -3.469 1
1 826 . 10 1 1 A 69 69 GLN H H 69 7.979 8.121 -0.142 1
1 827 . 10 1 1 A 69 69 GLN HA H 69 4.310 4.220 0.090 1
1 834 . 10 1 1 A 69 69 GLN C C 69 179.370 178.135 1.235 1
1 835 . 10 1 1 A 69 69 GLN CA C 69 59.307 59.254 0.053 1
1 836 . 10 1 1 A 69 69 GLN CB C 69 29.257 28.292 0.965 1
1 838 . 10 1 1 A 69 69 GLN N N 69 118.484 117.805 0.679 1
1 840 . 10 1 1 A 70 70 ARG H H 70 8.374 7.944 0.430 1
1 841 . 10 1 1 A 70 70 ARG HA H 70 4.148 4.120 0.028 1
1 848 . 10 1 1 A 70 70 ARG C C 70 175.850 178.072 -2.222 1
1 849 . 10 1 1 A 70 70 ARG CA C 70 58.957 58.598 0.359 1
1 850 . 10 1 1 A 70 70 ARG CB C 70 29.799 29.970 -0.171 1
1 852 . 10 1 1 A 70 70 ARG N N 70 120.309 120.476 -0.167 1
1 853 . 10 1 1 A 71 71 LEU H H 71 7.413 7.590 -0.177 1
1 854 . 10 1 1 A 71 71 LEU HA H 71 4.341 4.098 0.243 1
1 864 . 10 1 1 A 71 71 LEU C C 71 173.391 176.123 -2.732 1
1 865 . 10 1 1 A 71 71 LEU CA C 71 54.911 54.547 0.364 1
1 866 . 10 1 1 A 71 71 LEU CB C 71 42.693 41.414 1.279 1
1 867 . 10 1 1 A 71 71 LEU N N 71 118.841 117.499 1.342 1
1 868 . 10 1 1 A 72 72 ASN H H 72 8.038 7.999 0.039 1
1 869 . 10 1 1 A 72 72 ASN HA H 72 4.394 4.296 0.098 1
1 874 . 10 1 1 A 72 72 ASN C C 72 173.042 173.956 -0.914 1
1 875 . 10 1 1 A 72 72 ASN CB C 72 36.412 38.159 -1.747 1
1 876 . 10 1 1 A 72 72 ASN N N 72 112.919 116.789 -3.870 1
1 878 . 10 1 1 A 73 73 TYR H H 73 7.874 7.519 0.355 1
1 879 . 10 1 1 A 73 73 TYR HA H 73 4.868 4.567 0.301 1
1 886 . 10 1 1 A 73 73 TYR C C 73 172.194 174.185 -1.991 1
1 887 . 10 1 1 A 73 73 TYR CA C 73 57.105 56.728 0.377 1
1 888 . 10 1 1 A 73 73 TYR CB C 73 37.918 38.262 -0.344 1
1 889 . 10 1 1 A 73 73 TYR N N 73 117.432 120.105 -2.673 1
1 897 . 10 1 1 A 75 75 PRO HA H 75 4.626 4.362 0.264 1
1 902 . 10 1 1 A 75 75 PRO C C 75 175.728 177.159 -1.431 1
1 903 . 10 1 1 A 75 75 PRO CA C 75 62.502 63.693 -1.191 1
1 904 . 10 1 1 A 75 75 PRO CB C 75 32.339 32.583 -0.244 1
1 905 . 10 1 1 A 76 76 GLY H H 76 8.369 8.891 -0.522 1
1 906 . 10 1 1 A 76 76 GLY HA2 H 76 4.057 3.919 0.138 1
1 907 . 10 1 1 A 76 76 GLY HA3 H 76 4.556 3.921 0.635 1
1 908 . 10 1 1 A 76 76 GLY C C 76 173.248 175.019 -1.771 1
1 909 . 10 1 1 A 76 76 GLY CA C 76 46.180 45.298 0.882 1
1 910 . 10 1 1 A 76 76 GLY N N 76 106.185 110.916 -4.731 1
1 911 . 10 1 1 A 77 77 LYS H H 77 8.632 8.293 0.339 1
1 912 . 10 1 1 A 77 77 LYS HA H 77 4.433 4.077 0.356 1
1 921 . 10 1 1 A 77 77 LYS C C 77 174.924 176.142 -1.218 1
1 922 . 10 1 1 A 77 77 LYS CA C 77 56.453 57.736 -1.283 1
1 923 . 10 1 1 A 77 77 LYS CB C 77 33.170 29.297 3.873 1
1 925 . 10 1 1 A 77 77 LYS N N 77 119.592 116.087 3.505 1
1 926 . 10 1 1 A 78 78 ASN H H 78 8.865 8.076 0.789 1
1 927 . 10 1 1 A 78 78 ASN HA H 78 4.654 4.505 0.149 1
1 932 . 10 1 1 A 78 78 ASN C C 78 174.869 177.906 -3.037 1
1 933 . 10 1 1 A 78 78 ASN CA C 78 54.117 56.481 -2.364 1
1 934 . 10 1 1 A 78 78 ASN CB C 78 37.841 38.672 -0.831 1
1 935 . 10 1 1 A 78 78 ASN N N 78 116.880 116.607 0.273 1
1 937 . 10 1 1 A 79 79 ILE H H 79 8.008 8.305 -0.297 1
1 938 . 10 1 1 A 79 79 ILE HA H 79 3.718 3.761 -0.043 1
1 948 . 10 1 1 A 79 79 ILE C C 79 175.921 178.410 -2.489 1
1 949 . 10 1 1 A 79 79 ILE CA C 79 63.618 64.778 -1.160 1
1 950 . 10 1 1 A 79 79 ILE CB C 79 37.158 37.347 -0.189 1
1 952 . 10 1 1 A 79 79 ILE N N 79 119.688 119.322 0.366 1
1 953 . 10 1 1 A 80 80 GLY H H 80 9.062 8.256 0.806 1
1 954 . 10 1 1 A 80 80 GLY HA2 H 80 3.739 3.908 -0.169 1
1 955 . 10 1 1 A 80 80 GLY HA3 H 80 3.739 3.925 -0.186 1
1 956 . 10 1 1 A 80 80 GLY C C 80 173.185 176.482 -3.297 1
1 957 . 10 1 1 A 80 80 GLY CA C 80 48.166 47.718 0.448 1
1 958 . 10 1 1 A 80 80 GLY N N 80 110.338 108.975 1.363 1
1 959 . 10 1 1 A 81 81 SER H H 81 7.460 7.913 -0.453 1
1 960 . 10 1 1 A 81 81 SER HA H 81 3.904 4.184 -0.280 1
1 963 . 10 1 1 A 81 81 SER C C 81 174.999 175.950 -0.951 1
1 964 . 10 1 1 A 81 81 SER CA C 81 61.138 62.636 -1.498 1
1 965 . 10 1 1 A 81 81 SER CB C 81 62.740 62.898 -0.158 1
1 966 . 10 1 1 A 81 81 SER N N 81 115.348 119.736 -4.388 1
1 967 . 10 1 1 A 82 82 LEU H H 82 7.367 7.524 -0.157 1
1 968 . 10 1 1 A 82 82 LEU HA H 82 3.946 3.888 0.058 1
1 977 . 10 1 1 A 82 82 LEU C C 82 176.969 177.985 -1.016 1
1 978 . 10 1 1 A 82 82 LEU CA C 82 57.504 58.158 -0.654 1
1 979 . 10 1 1 A 82 82 LEU CB C 82 42.185 41.334 0.851 1
1 980 . 10 1 1 A 82 82 LEU N N 82 124.267 122.515 1.752 1
1 981 . 10 1 1 A 83 83 LEU H H 83 8.330 8.399 -0.069 1
1 982 . 10 1 1 A 83 83 LEU HA H 83 3.924 3.992 -0.068 1
1 991 . 10 1 1 A 83 83 LEU C C 83 176.303 178.298 -1.995 1
1 992 . 10 1 1 A 83 83 LEU CA C 83 58.067 58.376 -0.309 1
1 993 . 10 1 1 A 83 83 LEU CB C 83 41.061 41.575 -0.514 1
1 994 . 10 1 1 A 83 83 LEU N N 83 117.452 119.745 -2.293 1
1 995 . 10 1 1 A 84 84 ARG H H 84 7.651 7.934 -0.283 1
1 996 . 10 1 1 A 84 84 ARG HA H 84 2.230 3.553 -1.323 1
1 1003 . 10 1 1 A 84 84 ARG C C 84 175.902 178.650 -2.748 1
1 1004 . 10 1 1 A 84 84 ARG CA C 84 59.112 59.491 -0.379 1
1 1005 . 10 1 1 A 84 84 ARG CB C 84 28.579 29.740 -1.161 1
1 1007 . 10 1 1 A 84 84 ARG N N 84 119.586 119.772 -0.186 1
1 1008 . 10 1 1 A 85 85 SER H H 85 7.291 8.212 -0.921 1
1 1009 . 10 1 1 A 85 85 SER HA H 85 4.189 4.311 -0.122 1
1 1012 . 10 1 1 A 85 85 SER C C 85 175.546 176.560 -1.014 1
1 1013 . 10 1 1 A 85 85 SER CA C 85 61.376 62.325 -0.949 1
1 1014 . 10 1 1 A 85 85 SER CB C 85 62.805 63.016 -0.211 1
1 1015 . 10 1 1 A 85 85 SER N N 85 112.921 115.981 -3.060 1
1 1016 . 10 1 1 A 86 86 HIS H H 86 8.156 7.517 0.639 1
1 1017 . 10 1 1 A 86 86 HIS HA H 86 4.782 4.192 0.590 1
1 1022 . 10 1 1 A 86 86 HIS C C 86 176.851 177.424 -0.573 1
1 1023 . 10 1 1 A 86 86 HIS CA C 86 58.898 59.585 -0.687 1
1 1024 . 10 1 1 A 86 86 HIS CB C 86 31.110 29.635 1.475 1
1 1027 . 10 1 1 A 86 86 HIS N N 86 119.258 119.366 -0.108 1
1 1028 . 10 1 1 A 87 87 TYR H H 87 9.180 8.166 1.014 1
1 1029 . 10 1 1 A 87 87 TYR HA H 87 3.913 3.869 0.044 1
1 1036 . 10 1 1 A 87 87 TYR C C 87 176.841 177.293 -0.452 1
1 1037 . 10 1 1 A 87 87 TYR CA C 87 63.526 61.381 2.145 1
1 1038 . 10 1 1 A 87 87 TYR CB C 87 39.431 38.413 1.018 1
1 1041 . 10 1 1 A 87 87 TYR N N 87 120.625 119.981 0.644 1
1 1042 . 10 1 1 A 88 88 GLU H H 88 9.028 8.651 0.377 1
1 1043 . 10 1 1 A 88 88 GLU HA H 88 3.682 4.030 -0.348 1
1 1048 . 10 1 1 A 88 88 GLU C C 88 175.833 178.021 -2.188 1
1 1049 . 10 1 1 A 88 88 GLU CA C 88 59.730 60.345 -0.615 1
1 1050 . 10 1 1 A 88 88 GLU CB C 88 30.009 29.530 0.479 1
1 1052 . 10 1 1 A 88 88 GLU N N 88 119.531 117.967 1.564 1
1 1053 . 10 1 1 A 89 89 ARG H H 89 8.052 7.825 0.227 1
1 1054 . 10 1 1 A 89 89 ARG HA H 89 4.292 4.564 -0.272 1
1 1061 . 10 1 1 A 89 89 ARG C C 89 176.045 176.677 -0.632 1
1 1062 . 10 1 1 A 89 89 ARG CA C 89 58.538 56.519 2.019 1
1 1063 . 10 1 1 A 89 89 ARG CB C 89 31.841 31.237 0.604 1
1 1065 . 10 1 1 A 89 89 ARG N N 89 114.741 115.587 -0.846 1
1 1066 . 10 1 1 A 90 90 ILE H H 90 8.141 7.469 0.672 1
1 1067 . 10 1 1 A 90 90 ILE HA H 90 4.296 3.607 0.689 1
1 1075 . 10 1 1 A 90 90 ILE C C 90 174.461 176.852 -2.391 1
1 1076 . 10 1 1 A 90 90 ILE CA C 90 63.649 62.557 1.092 1
1 1077 . 10 1 1 A 90 90 ILE CB C 90 40.626 39.454 1.172 1
1 1079 . 10 1 1 A 90 90 ILE N N 90 113.421 117.438 -4.017 1
1 1080 . 10 1 1 A 91 91 VAL H H 91 7.350 7.584 -0.234 1
1 1081 . 10 1 1 A 91 91 VAL HA H 91 4.144 3.516 0.628 1
1 1089 . 10 1 1 A 91 91 VAL C C 91 175.422 177.198 -1.776 1
1 1090 . 10 1 1 A 91 91 VAL CA C 91 65.042 65.105 -0.063 1
1 1091 . 10 1 1 A 91 91 VAL CB C 91 33.215 31.115 2.100 1
1 1092 . 10 1 1 A 91 91 VAL N N 91 118.215 120.503 -2.288 1
1 1093 . 10 1 1 A 92 92 TYR H H 92 8.565 8.327 0.238 1
1 1094 . 10 1 1 A 92 92 TYR HA H 92 4.217 4.207 0.010 1
1 1099 . 10 1 1 A 92 92 TYR C C 92 171.495 175.125 -3.630 1
1 1100 . 10 1 1 A 92 92 TYR CA C 92 61.558 62.343 -0.785 1
1 1101 . 10 1 1 A 92 92 TYR CB C 92 36.757 37.445 -0.688 1
1 1102 . 10 1 1 A 92 92 TYR N N 92 121.370 121.597 -0.227 1
1 1103 . 10 1 1 A 93 93 PRO HA H 93 4.136 4.375 -0.239 1
1 1108 . 10 1 1 A 93 93 PRO C C 93 177.077 178.335 -1.258 1
1 1109 . 10 1 1 A 93 93 PRO CA C 93 66.037 66.032 0.005 1
1 1110 . 10 1 1 A 93 93 PRO CB C 93 31.482 30.958 0.524 1
1 1111 . 10 1 1 A 94 94 TYR H H 94 6.517 7.463 -0.946 1
1 1112 . 10 1 1 A 94 94 TYR HA H 94 2.798 4.429 -1.631 1
1 1119 . 10 1 1 A 94 94 TYR C C 94 174.985 178.157 -3.172 1
1 1120 . 10 1 1 A 94 94 TYR CA C 94 59.356 59.464 -0.108 1
1 1121 . 10 1 1 A 94 94 TYR CB C 94 37.987 37.194 0.793 1
1 1124 . 10 1 1 A 94 94 TYR N N 94 115.987 117.298 -1.311 1
1 1125 . 10 1 1 A 95 95 GLU H H 95 8.205 8.392 -0.187 1
1 1126 . 10 1 1 A 95 95 GLU HA H 95 3.682 4.104 -0.422 1
1 1131 . 10 1 1 A 95 95 GLU C C 95 178.530 179.111 -0.581 1
1 1132 . 10 1 1 A 95 95 GLU CA C 95 58.910 59.675 -0.765 1
1 1133 . 10 1 1 A 95 95 GLU CB C 95 29.187 29.487 -0.300 1
1 1134 . 10 1 1 A 95 95 GLU N N 95 119.946 121.263 -1.317 1
1 1135 . 10 1 1 A 96 96 MET H H 96 8.248 7.895 0.353 1
1 1136 . 10 1 1 A 96 96 MET HA H 96 4.172 4.159 0.013 1
1 1142 . 10 1 1 A 96 96 MET C C 96 176.874 177.992 -1.118 1
1 1143 . 10 1 1 A 96 96 MET CA C 96 57.159 59.101 -1.942 1
1 1144 . 10 1 1 A 96 96 MET CB C 96 31.829 31.981 -0.152 1
1 1146 . 10 1 1 A 96 96 MET N N 96 117.570 118.932 -1.362 1
1 1147 . 10 1 1 A 97 97 TYR H H 97 7.445 8.388 -0.943 1
1 1148 . 10 1 1 A 97 97 TYR HA H 97 4.248 3.993 0.255 1
1 1155 . 10 1 1 A 97 97 TYR C C 97 176.476 177.044 -0.568 1
1 1156 . 10 1 1 A 97 97 TYR CA C 97 60.470 61.948 -1.478 1
1 1157 . 10 1 1 A 97 97 TYR CB C 97 38.612 38.405 0.207 1
1 1160 . 10 1 1 A 97 97 TYR N N 97 122.246 120.867 1.379 1
1 1161 . 10 1 1 A 98 98 GLN H H 98 8.087 8.515 -0.428 1
1 1162 . 10 1 1 A 98 98 GLN HA H 98 3.793 3.421 0.372 1
1 1169 . 10 1 1 A 98 98 GLN C C 98 175.549 178.114 -2.565 1
1 1170 . 10 1 1 A 98 98 GLN CA C 98 57.365 58.751 -1.386 1
1 1171 . 10 1 1 A 98 98 GLN CB C 98 28.901 28.479 0.422 1
1 1173 . 10 1 1 A 98 98 GLN N N 98 118.769 119.418 -0.649 1
1 1175 . 10 1 1 A 99 99 SER H H 99 7.724 8.074 -0.350 1
1 1176 . 10 1 1 A 99 99 SER HA H 99 4.293 4.249 0.044 1
1 1179 . 10 1 1 A 99 99 SER C C 99 173.696 177.146 -3.450 1
1 1180 . 10 1 1 A 99 99 SER CA C 99 59.566 62.685 -3.119 1
1 1181 . 10 1 1 A 99 99 SER CB C 99 63.847 62.541 1.306 1
1 1182 . 10 1 1 A 99 99 SER N N 99 113.257 117.176 -3.919 1
1 1183 . 10 1 1 A 100 100 GLY H H 100 7.751 8.237 -0.486 1
1 1184 . 10 1 1 A 100 100 GLY HA2 H 100 3.813 3.871 -0.058 1
1 1185 . 10 1 1 A 100 100 GLY HA3 H 100 3.934 3.877 0.057 1
1 1186 . 10 1 1 A 100 100 GLY C C 100 172.643 176.178 -3.535 1
1 1187 . 10 1 1 A 100 100 GLY CA C 100 45.570 46.905 -1.335 1
1 1188 . 10 1 1 A 100 100 GLY N N 100 109.750 108.380 1.370 1
1 1189 . 10 1 1 A 101 101 ALA H H 101 7.824 7.922 -0.098 1
1 1190 . 10 1 1 A 101 101 ALA HA H 101 4.221 4.028 0.193 1
1 1194 . 10 1 1 A 101 101 ALA C C 101 175.639 178.952 -3.313 1
1 1195 . 10 1 1 A 101 101 ALA CA C 101 52.745 54.357 -1.612 1
1 1196 . 10 1 1 A 101 101 ALA CB C 101 19.437 18.441 0.996 1
1 1197 . 10 1 1 A 101 101 ALA N N 101 123.241 124.321 -1.080 1
1 1198 . 10 1 1 A 102 102 ASN H H 102 8.191 8.020 0.171 1
1 1199 . 10 1 1 A 102 102 ASN HA H 102 4.658 4.748 -0.090 1
1 1204 . 10 1 1 A 102 102 ASN C C 102 173.337 175.595 -2.258 1
1 1205 . 10 1 1 A 102 102 ASN CA C 102 53.374 55.047 -1.673 1
1 1206 . 10 1 1 A 102 102 ASN CB C 102 38.819 39.578 -0.759 1
1 1207 . 10 1 1 A 102 102 ASN N N 102 116.572 114.083 2.489 1
1 1209 . 10 1 1 A 103 103 LEU H H 103 8.065 7.614 0.451 1
1 1210 . 10 1 1 A 103 103 LEU HA H 103 4.363 4.682 -0.319 1
1 1219 . 10 1 1 A 103 103 LEU C C 103 175.637 174.690 0.947 1
1 1220 . 10 1 1 A 103 103 LEU CA C 103 55.292 53.891 1.401 1
1 1221 . 10 1 1 A 103 103 LEU CB C 103 42.433 45.038 -2.605 1
1 1222 . 10 1 1 A 103 103 LEU N N 103 122.074 114.622 7.452 1
1 1223 . 10 1 1 A 104 104 VAL H H 104 8.055 8.907 -0.852 1
1 1224 . 10 1 1 A 104 104 VAL HA H 104 4.131 4.971 -0.840 1
1 1232 . 10 1 1 A 104 104 VAL C C 104 174.364 175.616 -1.252 1
1 1233 . 10 1 1 A 104 104 VAL CA C 104 62.552 59.560 2.992 1
1 1234 . 10 1 1 A 104 104 VAL CB C 104 32.766 34.870 -2.104 1
1 1235 . 10 1 1 A 104 104 VAL N N 104 120.606 120.612 -0.006 1
1 1236 . 10 1 1 A 105 105 CYS H H 105 8.392 8.500 -0.108 1
1 1237 . 10 1 1 A 105 105 CYS HA H 105 4.535 4.566 -0.031 1
1 1240 . 10 1 1 A 105 105 CYS C C 105 172.593 175.094 -2.501 1
1 1241 . 10 1 1 A 105 105 CYS CA C 105 58.449 59.378 -0.929 1
1 1242 . 10 1 1 A 105 105 CYS CB C 105 27.952 28.920 -0.968 1
1 1243 . 10 1 1 A 105 105 CYS N N 105 122.791 126.459 -3.668 1
1 1244 . 10 1 1 A 106 106 ASN H H 106 8.575 8.143 0.432 1
1 1245 . 10 1 1 A 106 106 ASN HA H 106 4.843 5.084 -0.241 1
1 1250 . 10 1 1 A 106 106 ASN C C 106 173.594 175.964 -2.370 1
1 1251 . 10 1 1 A 106 106 ASN CA C 106 53.337 53.064 0.273 1
1 1252 . 10 1 1 A 106 106 ASN CB C 106 39.088 39.223 -0.135 1
1 1253 . 10 1 1 A 106 106 ASN N N 106 122.001 119.333 2.668 1
1 1255 . 10 1 1 A 107 107 THR H H 107 8.090 7.924 0.166 1
1 1256 . 10 1 1 A 107 107 THR HA H 107 4.348 4.064 0.284 1
1 1261 . 10 1 1 A 107 107 THR C C 107 172.516 175.966 -3.450 1
1 1262 . 10 1 1 A 107 107 THR CA C 107 61.803 66.920 -5.117 1
1 1263 . 10 1 1 A 107 107 THR CB C 107 69.812 68.379 1.433 1
1 1265 . 10 1 1 A 107 107 THR N N 107 114.374 114.488 -0.114 1
1 1266 . 10 1 1 A 108 108 ARG H H 108 8.322 7.814 0.508 1
1 1267 . 10 1 1 A 108 108 ARG HA H 108 4.634 4.374 0.260 1
1 1274 . 10 1 1 A 108 108 ARG C C 108 172.608 177.274 -4.666 1
1 1275 . 10 1 1 A 108 108 ARG CA C 108 54.026 59.738 -5.712 1
1 1276 . 10 1 1 A 108 108 ARG CB C 108 30.246 30.886 -0.640 1
1 1278 . 10 1 1 A 108 108 ARG N N 108 124.017 120.382 3.635 1
1 1279 . 10 1 1 A 109 109 PRO HA H 109 4.354 4.472 -0.118 1
1 1286 . 10 1 1 A 109 109 PRO C C 109 174.978 178.570 -3.592 1
1 1287 . 10 1 1 A 109 109 PRO CA C 109 63.396 65.094 -1.698 1
1 1288 . 10 1 1 A 109 109 PRO CB C 109 32.046 31.652 0.394 1
1 1290 . 10 1 1 A 110 110 PHE H H 110 8.123 8.055 0.068 1
1 1291 . 10 1 1 A 110 110 PHE HA H 110 4.619 4.569 0.050 1
1 1296 . 10 1 1 A 110 110 PHE C C 110 173.856 176.916 -3.060 1
1 1297 . 10 1 1 A 110 110 PHE CA C 110 57.353 62.209 -4.856 1
1 1298 . 10 1 1 A 110 110 PHE CB C 110 39.364 39.254 0.110 1
1 1301 . 10 1 1 A 110 110 PHE N N 110 119.265 119.452 -0.187 1
1 1302 . 10 1 1 A 111 111 ASP H H 111 8.161 8.206 -0.045 1
1 1303 . 10 1 1 A 111 111 ASP HA H 111 4.613 4.524 0.089 1
1 1306 . 10 1 1 A 111 111 ASP C C 111 174.114 178.922 -4.808 1
1 1307 . 10 1 1 A 111 111 ASP CA C 111 54.350 57.440 -3.090 1
1 1308 . 10 1 1 A 111 111 ASP CB C 111 41.413 40.209 1.204 1
1 1309 . 10 1 1 A 111 111 ASP N N 111 121.764 119.567 2.197 1
1 1310 . 10 1 1 A 112 112 ASN H H 112 8.307 8.542 -0.235 1
1 1311 . 10 1 1 A 112 112 ASN HA H 112 4.662 4.482 0.180 1
1 1316 . 10 1 1 A 112 112 ASN C C 112 173.595 177.585 -3.990 1
1 1317 . 10 1 1 A 112 112 ASN CA C 112 53.486 56.093 -2.607 1
1 1318 . 10 1 1 A 112 112 ASN CB C 112 39.225 38.614 0.611 1
1 1319 . 10 1 1 A 112 112 ASN N N 112 119.154 117.723 1.431 1
1 1321 . 10 1 1 A 113 113 GLU H H 113 8.404 8.140 0.264 1
1 1322 . 10 1 1 A 113 113 GLU HA H 113 4.264 4.010 0.254 1
1 1327 . 10 1 1 A 113 113 GLU C C 113 174.886 178.794 -3.908 1
1 1328 . 10 1 1 A 113 113 GLU CA C 113 56.681 59.300 -2.619 1
1 1329 . 10 1 1 A 113 113 GLU CB C 113 30.403 29.738 0.665 1
1 1331 . 10 1 1 A 113 113 GLU N N 113 120.943 119.351 1.592 1
1 1332 . 10 1 1 A 114 114 GLU H H 114 8.388 8.454 -0.066 1
1 1333 . 10 1 1 A 114 114 GLU HA H 114 4.262 4.160 0.102 1
1 1338 . 10 1 1 A 114 114 GLU C C 114 174.819 178.161 -3.342 1
1 1339 . 10 1 1 A 114 114 GLU CA C 114 56.769 59.500 -2.731 1
1 1340 . 10 1 1 A 114 114 GLU CB C 114 30.125 29.698 0.427 1
1 1342 . 10 1 1 A 114 114 GLU N N 114 121.869 120.074 1.795 1
1 1343 . 10 1 1 A 115 115 LYS H H 115 8.236 8.114 0.122 1
1 1344 . 10 1 1 A 115 115 LYS HA H 115 4.347 4.615 -0.268 1
1 1353 . 10 1 1 A 115 115 LYS C C 115 174.633 176.029 -1.396 1
1 1354 . 10 1 1 A 115 115 LYS CA C 115 56.426 54.722 1.704 1
1 1355 . 10 1 1 A 115 115 LYS CB C 115 33.277 30.387 2.890 1
1 1359 . 10 1 1 A 115 115 LYS N N 115 121.997 118.370 3.627 1
1 1360 . 10 1 1 A 116 116 ASP H H 116 8.386 7.799 0.587 1
1 1361 . 10 1 1 A 116 116 ASP HA H 116 4.600 4.220 0.380 1
1 1364 . 10 1 1 A 116 116 ASP C C 116 173.448 176.615 -3.167 1
1 1365 . 10 1 1 A 116 116 ASP CA C 116 54.773 57.738 -2.965 1
1 1366 . 10 1 1 A 116 116 ASP CB C 116 41.029 41.011 0.018 1
1 1367 . 10 1 1 A 116 116 ASP N N 116 121.057 123.023 -1.966 1
1 5 . 11 1 1 A 2 2 MET HA H 2 4.534 4.294 0.240 1
1 13 . 11 1 1 A 2 2 MET C C 2 174.355 177.950 -3.595 1
1 14 . 11 1 1 A 2 2 MET CA C 2 56.247 57.039 -0.792 1
1 15 . 11 1 1 A 2 2 MET CB C 2 32.855 31.787 1.068 1
1 18 . 11 1 1 A 3 3 ASN H H 3 8.600 8.358 0.242 1
1 19 . 11 1 1 A 3 3 ASN HA H 3 4.711 4.462 0.249 1
1 24 . 11 1 1 A 3 3 ASN C C 3 173.983 177.564 -3.581 1
1 25 . 11 1 1 A 3 3 ASN CA C 3 53.650 56.678 -3.028 1
1 26 . 11 1 1 A 3 3 ASN CB C 3 38.624 39.817 -1.193 1
1 27 . 11 1 1 A 3 3 ASN N N 3 120.149 119.488 0.661 1
1 29 . 11 1 1 A 4 4 GLU H H 4 8.495 8.040 0.455 1
1 30 . 11 1 1 A 4 4 GLU HA H 4 4.235 4.061 0.174 1
1 35 . 11 1 1 A 4 4 GLU C C 4 175.752 178.757 -3.005 1
1 36 . 11 1 1 A 4 4 GLU CA C 4 58.075 59.256 -1.181 1
1 37 . 11 1 1 A 4 4 GLU CB C 4 30.125 29.396 0.729 1
1 38 . 11 1 1 A 4 4 GLU N N 4 121.543 118.674 2.869 1
1 39 . 11 1 1 A 5 5 LEU HA H 5 4.073 4.142 -0.069 1
1 47 . 11 1 1 A 5 5 LEU CB C 5 41.897 42.515 -0.618 1
1 50 . 11 1 1 A 6 6 GLU H H 6 8.332 8.398 -0.066 1
1 51 . 11 1 1 A 6 6 GLU HA H 6 3.621 4.356 -0.735 1
1 52 . 11 1 1 A 6 6 GLU C C 6 176.402 178.625 -2.223 1
1 53 . 11 1 1 A 6 6 GLU CA C 6 58.461 58.367 0.094 1
1 54 . 11 1 1 A 6 6 GLU CB C 6 29.730 29.479 0.251 1
1 55 . 11 1 1 A 6 6 GLU N N 6 121.462 118.750 2.712 1
1 56 . 11 1 1 A 7 7 ALA H H 7 8.244 7.748 0.496 1
1 57 . 11 1 1 A 7 7 ALA HA H 7 4.185 4.072 0.113 1
1 61 . 11 1 1 A 7 7 ALA C C 7 177.982 178.155 -0.173 1
1 62 . 11 1 1 A 7 7 ALA CA C 7 54.791 55.088 -0.297 1
1 63 . 11 1 1 A 7 7 ALA CB C 7 18.836 18.805 0.031 1
1 64 . 11 1 1 A 7 7 ALA N N 7 123.078 122.274 0.804 1
1 65 . 11 1 1 A 8 8 GLN H H 8 8.274 7.484 0.790 1
1 66 . 11 1 1 A 8 8 GLN HA H 8 4.219 4.460 -0.241 1
1 73 . 11 1 1 A 8 8 GLN C C 8 176.325 175.262 1.063 1
1 74 . 11 1 1 A 8 8 GLN CA C 8 57.864 55.834 2.030 1
1 75 . 11 1 1 A 8 8 GLN CB C 8 28.768 29.262 -0.494 1
1 77 . 11 1 1 A 8 8 GLN N N 8 117.452 116.314 1.138 1
1 79 . 11 1 1 A 9 9 THR H H 9 8.043 8.661 -0.618 1
1 80 . 11 1 1 A 9 9 THR HA H 9 3.998 4.778 -0.780 1
1 85 . 11 1 1 A 9 9 THR C C 9 173.904 175.147 -1.243 1
1 86 . 11 1 1 A 9 9 THR CA C 9 65.435 60.723 4.712 1
1 87 . 11 1 1 A 9 9 THR CB C 9 68.870 70.669 -1.799 1
1 89 . 11 1 1 A 9 9 THR N N 9 116.135 118.324 -2.189 1
1 90 . 11 1 1 A 10 10 ARG H H 10 8.095 8.938 -0.843 1
1 91 . 11 1 1 A 10 10 ARG HA H 10 4.040 4.118 -0.078 1
1 98 . 11 1 1 A 10 10 ARG C C 10 176.583 176.084 0.499 1
1 99 . 11 1 1 A 10 10 ARG CA C 10 59.262 57.517 1.745 1
1 100 . 11 1 1 A 10 10 ARG CB C 10 29.900 30.096 -0.196 1
1 101 . 11 1 1 A 10 10 ARG N N 10 121.157 125.111 -3.954 1
1 102 . 11 1 1 A 11 11 VAL H H 11 7.657 7.852 -0.195 1
1 103 . 11 1 1 A 11 11 VAL HA H 11 3.769 4.381 -0.612 1
1 111 . 11 1 1 A 11 11 VAL C C 11 176.662 177.892 -1.230 1
1 112 . 11 1 1 A 11 11 VAL CA C 11 65.914 63.353 2.561 1
1 113 . 11 1 1 A 11 11 VAL CB C 11 31.745 33.409 -1.664 1
1 114 . 11 1 1 A 11 11 VAL N N 11 118.580 118.031 0.549 1
1 115 . 11 1 1 A 12 12 LYS H H 12 7.471 8.171 -0.700 1
1 116 . 11 1 1 A 12 12 LYS HA H 12 3.366 4.360 -0.994 1
1 123 . 11 1 1 A 12 12 LYS C C 12 176.457 178.838 -2.381 1
1 124 . 11 1 1 A 12 12 LYS CA C 12 59.545 59.310 0.235 1
1 125 . 11 1 1 A 12 12 LYS CB C 12 32.206 32.704 -0.498 1
1 126 . 11 1 1 A 12 12 LYS N N 12 121.835 121.437 0.398 1
1 127 . 11 1 1 A 13 13 LEU H H 13 8.144 7.684 0.460 1
1 128 . 11 1 1 A 13 13 LEU HA H 13 4.093 3.993 0.100 1
1 137 . 11 1 1 A 13 13 LEU C C 13 178.254 179.288 -1.034 1
1 138 . 11 1 1 A 13 13 LEU CA C 13 58.023 57.702 0.321 1
1 139 . 11 1 1 A 13 13 LEU CB C 13 41.283 41.680 -0.397 1
1 140 . 11 1 1 A 13 13 LEU N N 13 118.688 120.176 -1.488 1
1 141 . 11 1 1 A 14 14 ASN H H 14 8.384 8.416 -0.032 1
1 142 . 11 1 1 A 14 14 ASN HA H 14 4.567 4.403 0.164 1
1 147 . 11 1 1 A 14 14 ASN C C 14 175.397 177.022 -1.625 1
1 148 . 11 1 1 A 14 14 ASN CA C 14 56.239 56.306 -0.067 1
1 149 . 11 1 1 A 14 14 ASN CB C 14 38.432 39.564 -1.132 1
1 150 . 11 1 1 A 14 14 ASN N N 14 118.175 117.011 1.164 1
1 152 . 11 1 1 A 15 15 TYR H H 15 7.982 8.229 -0.247 1
1 153 . 11 1 1 A 15 15 TYR HA H 15 4.249 4.097 0.152 1
1 160 . 11 1 1 A 15 15 TYR C C 15 175.503 176.609 -1.106 1
1 161 . 11 1 1 A 15 15 TYR CA C 15 62.450 61.425 1.025 1
1 162 . 11 1 1 A 15 15 TYR CB C 15 39.399 38.629 0.770 1
1 163 . 11 1 1 A 15 15 TYR N N 15 121.955 120.551 1.404 1
1 164 . 11 1 1 A 16 16 LEU H H 16 8.198 8.901 -0.703 1
1 165 . 11 1 1 A 16 16 LEU HA H 16 4.470 3.885 0.585 1
1 175 . 11 1 1 A 16 16 LEU C C 16 177.125 178.807 -1.682 1
1 176 . 11 1 1 A 16 16 LEU CA C 16 57.374 57.772 -0.398 1
1 177 . 11 1 1 A 16 16 LEU CB C 16 41.443 41.393 0.050 1
1 178 . 11 1 1 A 16 16 LEU N N 16 117.642 120.113 -2.471 1
1 179 . 11 1 1 A 17 17 ASP H H 17 8.061 8.429 -0.368 1
1 180 . 11 1 1 A 17 17 ASP C C 17 177.836 178.146 -0.310 1
1 181 . 11 1 1 A 17 17 ASP CA C 17 57.486 57.703 -0.217 1
1 182 . 11 1 1 A 17 17 ASP CB C 17 41.433 41.883 -0.450 1
1 183 . 11 1 1 A 17 17 ASP N N 17 118.700 119.665 -0.965 1
1 184 . 11 1 1 A 18 18 GLN H H 18 8.111 7.751 0.360 1
1 185 . 11 1 1 A 18 18 GLN HA H 18 4.002 4.020 -0.018 1
1 190 . 11 1 1 A 18 18 GLN CA C 18 59.046 58.795 0.251 1
1 191 . 11 1 1 A 18 18 GLN CB C 18 28.700 28.301 0.399 1
1 193 . 11 1 1 A 18 18 GLN N N 18 119.539 118.643 0.896 1
1 195 . 11 1 1 A 19 19 ILE H H 19 8.330 8.230 0.100 1
1 196 . 11 1 1 A 19 19 ILE HA H 19 3.306 3.932 -0.626 1
1 204 . 11 1 1 A 19 19 ILE C C 19 175.608 177.974 -2.366 1
1 205 . 11 1 1 A 19 19 ILE CA C 19 64.760 63.571 1.189 1
1 206 . 11 1 1 A 19 19 ILE CB C 19 37.148 36.825 0.323 1
1 209 . 11 1 1 A 19 19 ILE N N 19 121.490 120.280 1.210 1
1 210 . 11 1 1 A 20 20 ALA H H 20 8.057 7.911 0.146 1
1 211 . 11 1 1 A 20 20 ALA HA H 20 4.349 4.143 0.206 1
1 215 . 11 1 1 A 20 20 ALA C C 20 179.297 179.817 -0.520 1
1 216 . 11 1 1 A 20 20 ALA CA C 20 56.150 55.405 0.745 1
1 217 . 11 1 1 A 20 20 ALA CB C 20 18.104 18.422 -0.318 1
1 218 . 11 1 1 A 20 20 ALA N N 20 124.441 123.896 0.545 1
1 219 . 11 1 1 A 21 21 LYS H H 21 8.116 8.137 -0.021 1
1 220 . 11 1 1 A 21 21 LYS HA H 21 4.108 4.068 0.040 1
1 229 . 11 1 1 A 21 21 LYS C C 21 176.720 178.460 -1.740 1
1 230 . 11 1 1 A 21 21 LYS CA C 21 59.166 58.642 0.524 1
1 231 . 11 1 1 A 21 21 LYS CB C 21 32.085 31.898 0.187 1
1 233 . 11 1 1 A 21 21 LYS N N 21 119.865 117.070 2.795 1
1 234 . 11 1 1 A 22 22 PHE H H 22 7.875 8.031 -0.156 1
1 235 . 11 1 1 A 22 22 PHE HA H 22 4.012 4.139 -0.127 1
1 242 . 11 1 1 A 22 22 PHE C C 22 175.545 177.457 -1.912 1
1 243 . 11 1 1 A 22 22 PHE CA C 22 61.070 61.630 -0.560 1
1 244 . 11 1 1 A 22 22 PHE CB C 22 39.072 39.453 -0.381 1
1 249 . 11 1 1 A 22 22 PHE N N 22 119.729 121.035 -1.306 1
1 250 . 11 1 1 A 23 23 TRP H H 23 7.841 7.757 0.084 1
1 251 . 11 1 1 A 23 23 TRP HA H 23 4.149 3.977 0.172 1
1 260 . 11 1 1 A 23 23 TRP C C 23 176.668 178.043 -1.375 1
1 261 . 11 1 1 A 23 23 TRP CB C 23 28.543 29.491 -0.948 1
1 267 . 11 1 1 A 23 23 TRP N N 23 119.440 120.778 -1.338 1
1 269 . 11 1 1 A 24 24 GLU H H 24 8.261 8.414 -0.153 1
1 270 . 11 1 1 A 24 24 GLU HA H 24 4.265 4.074 0.191 1
1 275 . 11 1 1 A 24 24 GLU C C 24 179.679 179.082 0.597 1
1 276 . 11 1 1 A 24 24 GLU CA C 24 59.706 58.827 0.879 1
1 277 . 11 1 1 A 24 24 GLU CB C 24 29.720 29.521 0.199 1
1 279 . 11 1 1 A 24 24 GLU N N 24 121.376 118.922 2.454 1
1 280 . 11 1 1 A 25 25 ILE H H 25 8.071 7.715 0.356 1
1 281 . 11 1 1 A 25 25 ILE HA H 25 3.815 3.848 -0.033 1
1 291 . 11 1 1 A 25 25 ILE C C 25 176.343 177.733 -1.390 1
1 292 . 11 1 1 A 25 25 ILE CA C 25 64.464 62.274 2.190 1
1 293 . 11 1 1 A 25 25 ILE CB C 25 37.371 37.638 -0.267 1
1 296 . 11 1 1 A 25 25 ILE N N 25 121.499 119.692 1.807 1
1 297 . 11 1 1 A 26 26 GLN H H 26 7.327 7.151 0.176 1
1 298 . 11 1 1 A 26 26 GLN HA H 26 4.074 4.246 -0.172 1
1 305 . 11 1 1 A 26 26 GLN C C 26 174.906 175.779 -0.873 1
1 306 . 11 1 1 A 26 26 GLN CA C 26 55.450 55.565 -0.115 1
1 307 . 11 1 1 A 26 26 GLN CB C 26 28.458 28.960 -0.502 1
1 309 . 11 1 1 A 26 26 GLN N N 26 116.532 120.398 -3.866 1
1 311 . 11 1 1 A 27 27 GLY H H 27 7.861 8.362 -0.501 1
1 312 . 11 1 1 A 27 27 GLY HA2 H 27 4.297 3.749 0.548 1
1 313 . 11 1 1 A 27 27 GLY HA3 H 27 3.823 3.757 0.066 1
1 314 . 11 1 1 A 27 27 GLY C C 27 172.698 173.229 -0.531 1
1 315 . 11 1 1 A 27 27 GLY CA C 27 45.608 45.653 -0.045 1
1 316 . 11 1 1 A 27 27 GLY N N 27 106.837 108.408 -1.571 1
1 317 . 11 1 1 A 28 28 SER H H 28 8.083 7.322 0.761 1
1 318 . 11 1 1 A 28 28 SER HA H 28 4.777 4.465 0.312 1
1 321 . 11 1 1 A 28 28 SER C C 28 171.196 172.215 -1.019 1
1 322 . 11 1 1 A 28 28 SER CA C 28 56.041 56.073 -0.032 1
1 323 . 11 1 1 A 28 28 SER CB C 28 64.539 63.779 0.760 1
1 324 . 11 1 1 A 28 28 SER N N 28 116.151 114.234 1.917 1
1 325 . 11 1 1 A 29 29 SER H H 29 8.354 8.552 -0.198 1
1 326 . 11 1 1 A 29 29 SER HA H 29 4.389 5.181 -0.792 1
1 329 . 11 1 1 A 29 29 SER C C 29 172.166 172.547 -0.381 1
1 330 . 11 1 1 A 29 29 SER CA C 29 58.107 56.641 1.466 1
1 331 . 11 1 1 A 29 29 SER CB C 29 63.853 65.139 -1.286 1
1 332 . 11 1 1 A 29 29 SER N N 29 116.596 115.660 0.936 1
1 333 . 11 1 1 A 30 30 LEU H H 30 8.990 8.898 0.092 1
1 334 . 11 1 1 A 30 30 LEU HA H 30 3.964 4.812 -0.848 1
1 344 . 11 1 1 A 30 30 LEU C C 30 173.752 175.975 -2.223 1
1 345 . 11 1 1 A 30 30 LEU CA C 30 55.193 55.103 0.090 1
1 346 . 11 1 1 A 30 30 LEU CB C 30 42.869 42.484 0.385 1
1 349 . 11 1 1 A 30 30 LEU N N 30 125.860 128.814 -2.954 1
1 350 . 11 1 1 A 31 31 LYS H H 31 8.118 9.007 -0.889 1
1 351 . 11 1 1 A 31 31 LYS HA H 31 4.498 5.057 -0.559 1
1 360 . 11 1 1 A 31 31 LYS C C 31 173.555 175.558 -2.003 1
1 361 . 11 1 1 A 31 31 LYS CA C 31 54.372 55.300 -0.928 1
1 362 . 11 1 1 A 31 31 LYS CB C 31 32.814 33.394 -0.580 1
1 365 . 11 1 1 A 31 31 LYS N N 31 129.965 123.612 6.353 1
1 366 . 11 1 1 A 32 32 ILE H H 32 8.717 8.454 0.263 1
1 367 . 11 1 1 A 32 32 ILE HA H 32 4.011 4.549 -0.538 1
1 377 . 11 1 1 A 32 32 ILE C C 32 173.038 175.655 -2.617 1
1 378 . 11 1 1 A 32 32 ILE CA C 32 59.921 59.168 0.753 1
1 379 . 11 1 1 A 32 32 ILE CB C 32 38.139 38.018 0.121 1
1 382 . 11 1 1 A 32 32 ILE N N 32 127.091 122.138 4.953 1
1 383 . 11 1 1 A 33 33 PRO HA H 33 4.412 4.630 -0.218 1
1 390 . 11 1 1 A 33 33 PRO C C 33 172.724 176.129 -3.405 1
1 391 . 11 1 1 A 33 33 PRO CA C 33 62.565 62.147 0.418 1
1 392 . 11 1 1 A 33 33 PRO CB C 33 32.728 32.742 -0.014 1
1 394 . 11 1 1 A 34 34 ASN H H 34 8.265 8.525 -0.260 1
1 395 . 11 1 1 A 34 34 ASN HA H 34 5.147 5.526 -0.379 1
1 400 . 11 1 1 A 34 34 ASN C C 34 174.079 173.471 0.608 1
1 401 . 11 1 1 A 34 34 ASN CA C 34 52.088 51.530 0.558 1
1 402 . 11 1 1 A 34 34 ASN CB C 34 40.387 42.030 -1.643 1
1 403 . 11 1 1 A 34 34 ASN N N 34 116.424 116.072 0.352 1
1 405 . 11 1 1 A 35 35 VAL H H 35 8.904 9.035 -0.131 1
1 406 . 11 1 1 A 35 35 VAL HA H 35 4.159 4.590 -0.431 1
1 414 . 11 1 1 A 35 35 VAL C C 35 173.834 175.082 -1.248 1
1 415 . 11 1 1 A 35 35 VAL CA C 35 61.953 59.749 2.204 1
1 416 . 11 1 1 A 35 35 VAL CB C 35 34.432 34.693 -0.261 1
1 419 . 11 1 1 A 35 35 VAL N N 35 122.778 118.833 3.945 1
1 420 . 11 1 1 A 36 36 GLU H H 36 9.560 9.564 -0.004 1
1 421 . 11 1 1 A 36 36 GLU HA H 36 3.819 4.040 -0.221 1
1 426 . 11 1 1 A 36 36 GLU C C 36 173.604 175.886 -2.282 1
1 427 . 11 1 1 A 36 36 GLU CA C 36 57.131 58.052 -0.921 1
1 428 . 11 1 1 A 36 36 GLU CB C 36 27.464 28.026 -0.562 1
1 430 . 11 1 1 A 36 36 GLU N N 36 127.014 129.654 -2.640 1
1 431 . 11 1 1 A 37 37 ARG H H 37 8.578 8.480 0.098 1
1 432 . 11 1 1 A 37 37 ARG HA H 37 3.792 3.915 -0.123 1
1 439 . 11 1 1 A 37 37 ARG C C 37 173.371 174.529 -1.158 1
1 440 . 11 1 1 A 37 37 ARG CA C 37 57.952 57.931 0.021 1
1 441 . 11 1 1 A 37 37 ARG CB C 37 27.657 27.626 0.031 1
1 443 . 11 1 1 A 37 37 ARG N N 37 108.362 110.818 -2.456 1
1 444 . 11 1 1 A 38 38 ARG H H 38 7.696 7.957 -0.261 1
1 445 . 11 1 1 A 38 38 ARG HA H 38 4.743 4.777 -0.034 1
1 452 . 11 1 1 A 38 38 ARG C C 38 173.513 175.704 -2.191 1
1 453 . 11 1 1 A 38 38 ARG CA C 38 54.507 55.239 -0.732 1
1 454 . 11 1 1 A 38 38 ARG CB C 38 33.751 32.268 1.483 1
1 456 . 11 1 1 A 38 38 ARG N N 38 118.370 120.099 -1.729 1
1 457 . 11 1 1 A 39 39 ILE H H 39 8.463 8.540 -0.077 1
1 458 . 11 1 1 A 39 39 ILE HA H 39 4.184 4.211 -0.027 1
1 468 . 11 1 1 A 39 39 ILE C C 39 175.150 175.646 -0.496 1
1 469 . 11 1 1 A 39 39 ILE CA C 39 62.076 61.794 0.282 1
1 470 . 11 1 1 A 39 39 ILE CB C 39 38.864 39.418 -0.554 1
1 473 . 11 1 1 A 39 39 ILE N N 39 123.604 127.501 -3.897 1
1 474 . 11 1 1 A 40 40 LEU H H 40 8.239 8.155 0.084 1
1 475 . 11 1 1 A 40 40 LEU HA H 40 4.259 4.576 -0.317 1
1 485 . 11 1 1 A 40 40 LEU C C 40 173.152 175.499 -2.347 1
1 486 . 11 1 1 A 40 40 LEU CA C 40 55.305 55.138 0.167 1
1 487 . 11 1 1 A 40 40 LEU CB C 40 43.113 42.440 0.673 1
1 490 . 11 1 1 A 40 40 LEU N N 40 129.550 128.727 0.823 1
1 491 . 11 1 1 A 41 41 ASP H H 41 8.992 8.676 0.316 1
1 492 . 11 1 1 A 41 41 ASP HA H 41 4.798 4.776 0.022 1
1 495 . 11 1 1 A 41 41 ASP C C 41 173.837 176.961 -3.124 1
1 496 . 11 1 1 A 41 41 ASP CA C 41 52.077 53.442 -1.365 1
1 497 . 11 1 1 A 41 41 ASP CB C 41 39.454 40.423 -0.969 1
1 498 . 11 1 1 A 41 41 ASP N N 41 127.022 127.669 -0.647 1
1 499 . 11 1 1 A 42 42 LEU H H 42 7.912 8.580 -0.668 1
1 500 . 11 1 1 A 42 42 LEU HA H 42 3.970 4.054 -0.084 1
1 510 . 11 1 1 A 42 42 LEU C C 42 176.305 178.876 -2.571 1
1 511 . 11 1 1 A 42 42 LEU CA C 42 58.128 57.701 0.427 1
1 512 . 11 1 1 A 42 42 LEU CB C 42 43.043 41.254 1.789 1
1 514 . 11 1 1 A 42 42 LEU N N 42 125.064 126.157 -1.093 1
1 515 . 11 1 1 A 43 43 TYR H H 43 8.565 8.082 0.483 1
1 516 . 11 1 1 A 43 43 TYR HA H 43 3.728 4.071 -0.343 1
1 523 . 11 1 1 A 43 43 TYR C C 43 175.757 178.263 -2.506 1
1 524 . 11 1 1 A 43 43 TYR CA C 43 61.774 60.459 1.315 1
1 525 . 11 1 1 A 43 43 TYR CB C 43 38.235 38.349 -0.114 1
1 528 . 11 1 1 A 43 43 TYR N N 43 117.822 119.891 -2.069 1
1 529 . 11 1 1 A 44 44 SER H H 44 8.115 8.382 -0.267 1
1 530 . 11 1 1 A 44 44 SER HA H 44 3.854 4.208 -0.354 1
1 533 . 11 1 1 A 44 44 SER C C 44 174.080 176.133 -2.053 1
1 534 . 11 1 1 A 44 44 SER CA C 44 61.873 61.880 -0.007 1
1 535 . 11 1 1 A 44 44 SER CB C 44 64.350 63.038 1.312 1
1 536 . 11 1 1 A 44 44 SER N N 44 116.835 116.472 0.363 1
1 537 . 11 1 1 A 45 45 LEU H H 45 8.401 7.822 0.579 1
1 538 . 11 1 1 A 45 45 LEU HA H 45 4.102 4.202 -0.100 1
1 548 . 11 1 1 A 45 45 LEU C C 45 175.081 178.699 -3.618 1
1 549 . 11 1 1 A 45 45 LEU CA C 45 58.896 57.868 1.028 1
1 550 . 11 1 1 A 45 45 LEU CB C 45 41.741 41.452 0.289 1
1 553 . 11 1 1 A 45 45 LEU N N 45 120.621 123.203 -2.582 1
1 554 . 11 1 1 A 46 46 SER H H 46 8.110 8.388 -0.278 1
1 555 . 11 1 1 A 46 46 SER HA H 46 4.300 4.175 0.125 1
1 558 . 11 1 1 A 46 46 SER C C 46 175.019 176.632 -1.613 1
1 559 . 11 1 1 A 46 46 SER CA C 46 62.610 61.523 1.087 1
1 560 . 11 1 1 A 46 46 SER CB C 46 64.092 63.062 1.030 1
1 561 . 11 1 1 A 46 46 SER N N 46 112.826 114.775 -1.949 1
1 562 . 11 1 1 A 47 47 LYS H H 47 7.732 8.036 -0.304 1
1 563 . 11 1 1 A 47 47 LYS HA H 47 3.900 4.125 -0.225 1
1 572 . 11 1 1 A 47 47 LYS C C 47 177.441 179.069 -1.628 1
1 573 . 11 1 1 A 47 47 LYS CA C 47 58.575 59.040 -0.465 1
1 574 . 11 1 1 A 47 47 LYS CB C 47 32.351 31.747 0.604 1
1 576 . 11 1 1 A 47 47 LYS N N 47 121.210 119.009 2.201 1
1 577 . 11 1 1 A 48 48 ILE H H 48 8.672 8.245 0.427 1
1 578 . 11 1 1 A 48 48 ILE HA H 48 3.628 3.693 -0.065 1
1 588 . 11 1 1 A 48 48 ILE C C 48 175.861 177.917 -2.056 1
1 589 . 11 1 1 A 48 48 ILE CA C 48 64.188 65.099 -0.911 1
1 590 . 11 1 1 A 48 48 ILE CB C 48 37.954 37.759 0.195 1
1 593 . 11 1 1 A 48 48 ILE N N 48 120.810 120.975 -0.165 1
1 594 . 11 1 1 A 49 49 VAL H H 49 8.030 8.166 -0.136 1
1 595 . 11 1 1 A 49 49 VAL HA H 49 3.195 3.642 -0.447 1
1 603 . 11 1 1 A 49 49 VAL C C 49 176.513 178.457 -1.944 1
1 604 . 11 1 1 A 49 49 VAL CA C 49 66.760 67.027 -0.267 1
1 605 . 11 1 1 A 49 49 VAL CB C 49 30.935 31.696 -0.761 1
1 608 . 11 1 1 A 49 49 VAL N N 49 119.350 119.631 -0.281 1
1 609 . 11 1 1 A 50 50 VAL H H 50 7.336 8.244 -0.908 1
1 610 . 11 1 1 A 50 50 VAL HA H 50 3.497 3.628 -0.131 1
1 618 . 11 1 1 A 50 50 VAL C C 50 178.745 178.380 0.365 1
1 619 . 11 1 1 A 50 50 VAL CA C 50 67.384 66.625 0.759 1
1 620 . 11 1 1 A 50 50 VAL CB C 50 31.832 31.605 0.227 1
1 621 . 11 1 1 A 50 50 VAL N N 50 118.610 120.889 -2.279 1
1 622 . 11 1 1 A 51 51 GLU H H 51 8.318 8.417 -0.099 1
1 623 . 11 1 1 A 51 51 GLU HA H 51 3.953 3.997 -0.044 1
1 628 . 11 1 1 A 51 51 GLU C C 51 177.281 178.965 -1.684 1
1 629 . 11 1 1 A 51 51 GLU CA C 51 59.668 59.341 0.327 1
1 630 . 11 1 1 A 51 51 GLU CB C 51 30.131 29.283 0.848 1
1 632 . 11 1 1 A 51 51 GLU N N 51 122.096 120.118 1.978 1
1 633 . 11 1 1 A 52 52 GLU H H 52 8.065 8.230 -0.165 1
1 634 . 11 1 1 A 52 52 GLU HA H 52 4.229 4.193 0.036 1
1 639 . 11 1 1 A 52 52 GLU C C 52 173.534 177.581 -4.047 1
1 640 . 11 1 1 A 52 52 GLU CA C 52 55.547 56.742 -1.195 1
1 641 . 11 1 1 A 52 52 GLU CB C 52 28.716 29.932 -1.216 1
1 643 . 11 1 1 A 52 52 GLU N N 52 114.992 116.270 -1.278 1
1 644 . 11 1 1 A 53 53 GLY H H 53 7.459 8.927 -1.468 1
1 645 . 11 1 1 A 53 53 GLY HA2 H 53 3.630 3.902 -0.272 1
1 646 . 11 1 1 A 53 53 GLY HA3 H 53 3.630 3.918 -0.288 1
1 647 . 11 1 1 A 53 53 GLY C C 53 173.214 173.716 -0.502 1
1 648 . 11 1 1 A 53 53 GLY CA C 53 44.962 46.486 -1.524 1
1 649 . 11 1 1 A 53 53 GLY N N 53 104.909 109.223 -4.314 1
1 650 . 11 1 1 A 54 54 GLY H H 54 8.533 7.323 1.210 1
1 651 . 11 1 1 A 54 54 GLY HA2 H 54 3.548 4.094 -0.546 1
1 652 . 11 1 1 A 54 54 GLY HA3 H 54 4.521 4.151 0.370 1
1 653 . 11 1 1 A 54 54 GLY C C 54 169.966 174.281 -4.315 1
1 654 . 11 1 1 A 54 54 GLY CA C 54 43.988 45.801 -1.813 1
1 655 . 11 1 1 A 54 54 GLY N N 54 110.587 106.453 4.134 1
1 656 . 11 1 1 A 55 55 TYR H H 55 8.704 8.764 -0.060 1
1 657 . 11 1 1 A 55 55 TYR HA H 55 3.618 4.037 -0.419 1
1 664 . 11 1 1 A 55 55 TYR C C 55 174.807 177.330 -2.523 1
1 665 . 11 1 1 A 55 55 TYR CA C 55 62.540 61.350 1.190 1
1 666 . 11 1 1 A 55 55 TYR CB C 55 39.669 39.601 0.068 1
1 669 . 11 1 1 A 55 55 TYR N N 55 119.168 126.312 -7.144 1
1 670 . 11 1 1 A 56 56 GLU H H 56 9.006 8.324 0.682 1
1 671 . 11 1 1 A 56 56 GLU HA H 56 3.638 3.606 0.032 1
1 676 . 11 1 1 A 56 56 GLU C C 56 177.400 178.180 -0.780 1
1 677 . 11 1 1 A 56 56 GLU CA C 56 60.530 59.557 0.973 1
1 678 . 11 1 1 A 56 56 GLU CB C 56 29.168 29.432 -0.264 1
1 679 . 11 1 1 A 56 56 GLU N N 56 118.969 119.192 -0.223 1
1 680 . 11 1 1 A 57 57 ALA H H 57 8.235 7.726 0.509 1
1 681 . 11 1 1 A 57 57 ALA HA H 57 3.980 4.010 -0.030 1
1 685 . 11 1 1 A 57 57 ALA C C 57 177.678 179.805 -2.127 1
1 686 . 11 1 1 A 57 57 ALA CA C 57 54.910 55.182 -0.272 1
1 687 . 11 1 1 A 57 57 ALA CB C 57 18.122 18.341 -0.219 1
1 688 . 11 1 1 A 57 57 ALA N N 57 122.860 121.712 1.148 1
1 689 . 11 1 1 A 58 58 ILE H H 58 7.831 7.594 0.237 1
1 690 . 11 1 1 A 58 58 ILE HA H 58 3.189 3.222 -0.033 1
1 700 . 11 1 1 A 58 58 ILE C C 58 177.818 177.114 0.704 1
1 701 . 11 1 1 A 58 58 ILE CA C 58 65.074 65.014 0.060 1
1 702 . 11 1 1 A 58 58 ILE CB C 58 38.178 37.091 1.087 1
1 706 . 11 1 1 A 58 58 ILE N N 58 117.418 117.635 -0.217 1
1 707 . 11 1 1 A 59 59 CYS H H 59 7.760 7.989 -0.229 1
1 708 . 11 1 1 A 59 59 CYS HA H 59 4.203 4.278 -0.075 1
1 711 . 11 1 1 A 59 59 CYS C C 59 176.357 177.192 -0.835 1
1 712 . 11 1 1 A 59 59 CYS CA C 59 63.760 62.539 1.221 1
1 713 . 11 1 1 A 59 59 CYS CB C 59 27.638 26.569 1.069 1
1 714 . 11 1 1 A 59 59 CYS N N 59 115.302 120.791 -5.489 1
1 715 . 11 1 1 A 60 60 LYS H H 60 8.350 8.050 0.300 1
1 716 . 11 1 1 A 60 60 LYS HA H 60 3.972 4.039 -0.067 1
1 725 . 11 1 1 A 60 60 LYS C C 60 176.373 177.463 -1.090 1
1 726 . 11 1 1 A 60 60 LYS CA C 60 59.796 58.986 0.810 1
1 727 . 11 1 1 A 60 60 LYS CB C 60 32.560 31.802 0.758 1
1 729 . 11 1 1 A 60 60 LYS N N 60 122.343 120.432 1.911 1
1 730 . 11 1 1 A 61 61 ASP H H 61 8.157 7.854 0.303 1
1 731 . 11 1 1 A 61 61 ASP HA H 61 4.616 4.621 -0.005 1
1 734 . 11 1 1 A 61 61 ASP C C 61 173.246 175.487 -2.241 1
1 735 . 11 1 1 A 61 61 ASP CA C 61 54.272 55.149 -0.877 1
1 736 . 11 1 1 A 61 61 ASP CB C 61 41.023 41.257 -0.234 1
1 737 . 11 1 1 A 61 61 ASP N N 61 116.173 119.369 -3.196 1
1 738 . 11 1 1 A 62 62 ARG H H 62 7.655 7.703 -0.048 1
1 739 . 11 1 1 A 62 62 ARG HA H 62 4.149 4.038 0.111 1
1 746 . 11 1 1 A 62 62 ARG C C 62 175.891 175.576 0.315 1
1 747 . 11 1 1 A 62 62 ARG CA C 62 57.381 57.112 0.269 1
1 748 . 11 1 1 A 62 62 ARG CB C 62 26.538 26.830 -0.292 1
1 750 . 11 1 1 A 62 62 ARG N N 62 117.213 116.670 0.543 1
1 751 . 11 1 1 A 63 63 ARG H H 63 8.302 7.795 0.507 1
1 752 . 11 1 1 A 63 63 ARG HA H 63 4.240 4.203 0.037 1
1 757 . 11 1 1 A 63 63 ARG C C 63 175.775 177.888 -2.113 1
1 758 . 11 1 1 A 63 63 ARG CA C 63 55.718 57.461 -1.743 1
1 760 . 11 1 1 A 63 63 ARG N N 63 116.292 118.337 -2.045 1
1 761 . 11 1 1 A 64 64 TRP H H 64 8.161 7.436 0.725 1
1 762 . 11 1 1 A 64 64 TRP HA H 64 3.836 4.370 -0.534 1
1 771 . 11 1 1 A 64 64 TRP C C 64 176.862 178.348 -1.486 1
1 772 . 11 1 1 A 64 64 TRP CA C 64 62.036 59.910 2.126 1
1 773 . 11 1 1 A 64 64 TRP CB C 64 27.028 28.789 -1.761 1
1 779 . 11 1 1 A 64 64 TRP N N 64 121.486 120.314 1.172 1
1 781 . 11 1 1 A 65 65 ALA H H 65 8.954 7.891 1.063 1
1 782 . 11 1 1 A 65 65 ALA HA H 65 4.290 4.115 0.175 1
1 786 . 11 1 1 A 65 65 ALA C C 65 178.986 179.466 -0.480 1
1 787 . 11 1 1 A 65 65 ALA CA C 65 55.314 55.417 -0.103 1
1 788 . 11 1 1 A 65 65 ALA CB C 65 18.119 18.195 -0.076 1
1 789 . 11 1 1 A 65 65 ALA N N 65 121.559 122.734 -1.175 1
1 790 . 11 1 1 A 66 66 ARG H H 66 7.473 7.778 -0.305 1
1 791 . 11 1 1 A 66 66 ARG HA H 66 4.221 4.165 0.056 1
1 798 . 11 1 1 A 66 66 ARG C C 66 176.670 178.355 -1.685 1
1 799 . 11 1 1 A 66 66 ARG CA C 66 57.871 58.560 -0.689 1
1 800 . 11 1 1 A 66 66 ARG CB C 66 29.097 29.663 -0.566 1
1 801 . 11 1 1 A 66 66 ARG N N 66 119.915 117.041 2.874 1
1 802 . 11 1 1 A 67 67 VAL H H 67 7.134 7.956 -0.822 1
1 803 . 11 1 1 A 67 67 VAL HA H 67 3.304 3.687 -0.383 1
1 811 . 11 1 1 A 67 67 VAL C C 67 175.341 178.095 -2.754 1
1 812 . 11 1 1 A 67 67 VAL CA C 67 66.722 66.402 0.320 1
1 813 . 11 1 1 A 67 67 VAL CB C 67 31.108 31.725 -0.617 1
1 816 . 11 1 1 A 67 67 VAL N N 67 119.970 120.967 -0.997 1
1 817 . 11 1 1 A 68 68 ALA H H 68 7.745 8.693 -0.948 1
1 818 . 11 1 1 A 68 68 ALA HA H 68 4.076 4.330 -0.254 1
1 822 . 11 1 1 A 68 68 ALA C C 68 177.358 179.365 -2.007 1
1 823 . 11 1 1 A 68 68 ALA CA C 68 55.607 56.006 -0.399 1
1 824 . 11 1 1 A 68 68 ALA CB C 68 18.061 18.471 -0.410 1
1 825 . 11 1 1 A 68 68 ALA N N 68 118.239 122.621 -4.382 1
1 826 . 11 1 1 A 69 69 GLN H H 69 7.979 8.101 -0.122 1
1 827 . 11 1 1 A 69 69 GLN HA H 69 4.310 3.998 0.312 1
1 834 . 11 1 1 A 69 69 GLN C C 69 179.370 177.717 1.653 1
1 835 . 11 1 1 A 69 69 GLN CA C 69 59.307 59.221 0.086 1
1 836 . 11 1 1 A 69 69 GLN CB C 69 29.257 28.442 0.815 1
1 838 . 11 1 1 A 69 69 GLN N N 69 118.484 117.881 0.603 1
1 840 . 11 1 1 A 70 70 ARG H H 70 8.374 8.110 0.264 1
1 841 . 11 1 1 A 70 70 ARG HA H 70 4.148 4.052 0.096 1
1 848 . 11 1 1 A 70 70 ARG C C 70 175.850 178.360 -2.510 1
1 849 . 11 1 1 A 70 70 ARG CA C 70 58.957 58.935 0.022 1
1 850 . 11 1 1 A 70 70 ARG CB C 70 29.799 29.982 -0.183 1
1 852 . 11 1 1 A 70 70 ARG N N 70 120.309 120.519 -0.210 1
1 853 . 11 1 1 A 71 71 LEU H H 71 7.413 7.774 -0.361 1
1 854 . 11 1 1 A 71 71 LEU HA H 71 4.341 4.159 0.182 1
1 864 . 11 1 1 A 71 71 LEU C C 71 173.391 175.455 -2.064 1
1 865 . 11 1 1 A 71 71 LEU CA C 71 54.911 54.708 0.203 1
1 866 . 11 1 1 A 71 71 LEU CB C 71 42.693 41.517 1.176 1
1 867 . 11 1 1 A 71 71 LEU N N 71 118.841 117.745 1.096 1
1 868 . 11 1 1 A 72 72 ASN H H 72 8.038 7.957 0.081 1
1 869 . 11 1 1 A 72 72 ASN HA H 72 4.394 4.261 0.133 1
1 874 . 11 1 1 A 72 72 ASN C C 72 173.042 174.177 -1.135 1
1 875 . 11 1 1 A 72 72 ASN CB C 72 36.412 36.785 -0.373 1
1 876 . 11 1 1 A 72 72 ASN N N 72 112.919 114.939 -2.020 1
1 878 . 11 1 1 A 73 73 TYR H H 73 7.874 7.820 0.054 1
1 879 . 11 1 1 A 73 73 TYR HA H 73 4.868 4.549 0.319 1
1 886 . 11 1 1 A 73 73 TYR C C 73 172.194 174.087 -1.893 1
1 887 . 11 1 1 A 73 73 TYR CA C 73 57.105 56.666 0.439 1
1 888 . 11 1 1 A 73 73 TYR CB C 73 37.918 38.125 -0.207 1
1 889 . 11 1 1 A 73 73 TYR N N 73 117.432 119.023 -1.591 1
1 897 . 11 1 1 A 75 75 PRO HA H 75 4.626 4.255 0.371 1
1 902 . 11 1 1 A 75 75 PRO C C 75 175.728 177.277 -1.549 1
1 903 . 11 1 1 A 75 75 PRO CA C 75 62.502 63.736 -1.234 1
1 904 . 11 1 1 A 75 75 PRO CB C 75 32.339 32.026 0.313 1
1 905 . 11 1 1 A 76 76 GLY H H 76 8.369 8.881 -0.512 1
1 906 . 11 1 1 A 76 76 GLY HA2 H 76 4.057 3.927 0.130 1
1 907 . 11 1 1 A 76 76 GLY HA3 H 76 4.556 3.928 0.628 1
1 908 . 11 1 1 A 76 76 GLY C C 76 173.248 175.065 -1.817 1
1 909 . 11 1 1 A 76 76 GLY CA C 76 46.180 45.414 0.766 1
1 910 . 11 1 1 A 76 76 GLY N N 76 106.185 111.099 -4.914 1
1 911 . 11 1 1 A 77 77 LYS H H 77 8.632 8.252 0.380 1
1 912 . 11 1 1 A 77 77 LYS HA H 77 4.433 3.992 0.441 1
1 921 . 11 1 1 A 77 77 LYS C C 77 174.924 176.270 -1.346 1
1 922 . 11 1 1 A 77 77 LYS CA C 77 56.453 57.868 -1.415 1
1 923 . 11 1 1 A 77 77 LYS CB C 77 33.170 29.607 3.563 1
1 925 . 11 1 1 A 77 77 LYS N N 77 119.592 114.787 4.805 1
1 926 . 11 1 1 A 78 78 ASN H H 78 8.865 8.272 0.593 1
1 927 . 11 1 1 A 78 78 ASN HA H 78 4.654 4.473 0.181 1
1 932 . 11 1 1 A 78 78 ASN C C 78 174.869 178.170 -3.301 1
1 933 . 11 1 1 A 78 78 ASN CA C 78 54.117 55.684 -1.567 1
1 934 . 11 1 1 A 78 78 ASN CB C 78 37.841 38.028 -0.187 1
1 935 . 11 1 1 A 78 78 ASN N N 78 116.880 117.495 -0.615 1
1 937 . 11 1 1 A 79 79 ILE H H 79 8.008 8.162 -0.154 1
1 938 . 11 1 1 A 79 79 ILE HA H 79 3.718 3.669 0.049 1
1 948 . 11 1 1 A 79 79 ILE C C 79 175.921 178.096 -2.175 1
1 949 . 11 1 1 A 79 79 ILE CA C 79 63.618 64.695 -1.077 1
1 950 . 11 1 1 A 79 79 ILE CB C 79 37.158 37.157 0.001 1
1 952 . 11 1 1 A 79 79 ILE N N 79 119.688 121.322 -1.634 1
1 953 . 11 1 1 A 80 80 GLY H H 80 9.062 8.280 0.782 1
1 954 . 11 1 1 A 80 80 GLY HA2 H 80 3.739 3.704 0.035 1
1 955 . 11 1 1 A 80 80 GLY HA3 H 80 3.739 3.765 -0.026 1
1 956 . 11 1 1 A 80 80 GLY C C 80 173.185 176.332 -3.147 1
1 957 . 11 1 1 A 80 80 GLY CA C 80 48.166 47.529 0.637 1
1 958 . 11 1 1 A 80 80 GLY N N 80 110.338 108.942 1.396 1
1 959 . 11 1 1 A 81 81 SER H H 81 7.460 7.657 -0.197 1
1 960 . 11 1 1 A 81 81 SER HA H 81 3.904 4.049 -0.145 1
1 963 . 11 1 1 A 81 81 SER C C 81 174.999 175.947 -0.948 1
1 964 . 11 1 1 A 81 81 SER CA C 81 61.138 62.571 -1.433 1
1 965 . 11 1 1 A 81 81 SER CB C 81 62.740 62.760 -0.020 1
1 966 . 11 1 1 A 81 81 SER N N 81 115.348 119.577 -4.229 1
1 967 . 11 1 1 A 82 82 LEU H H 82 7.367 7.912 -0.545 1
1 968 . 11 1 1 A 82 82 LEU HA H 82 3.946 3.993 -0.047 1
1 977 . 11 1 1 A 82 82 LEU C C 82 176.969 177.988 -1.019 1
1 978 . 11 1 1 A 82 82 LEU CA C 82 57.504 57.876 -0.372 1
1 979 . 11 1 1 A 82 82 LEU CB C 82 42.185 41.380 0.805 1
1 980 . 11 1 1 A 82 82 LEU N N 82 124.267 122.868 1.399 1
1 981 . 11 1 1 A 83 83 LEU H H 83 8.330 8.179 0.151 1
1 982 . 11 1 1 A 83 83 LEU HA H 83 3.924 3.962 -0.038 1
1 991 . 11 1 1 A 83 83 LEU C C 83 176.303 178.500 -2.197 1
1 992 . 11 1 1 A 83 83 LEU CA C 83 58.067 58.539 -0.472 1
1 993 . 11 1 1 A 83 83 LEU CB C 83 41.061 41.469 -0.408 1
1 994 . 11 1 1 A 83 83 LEU N N 83 117.452 119.863 -2.411 1
1 995 . 11 1 1 A 84 84 ARG H H 84 7.651 8.272 -0.621 1
1 996 . 11 1 1 A 84 84 ARG HA H 84 2.230 3.721 -1.491 1
1 1003 . 11 1 1 A 84 84 ARG C C 84 175.902 178.085 -2.183 1
1 1004 . 11 1 1 A 84 84 ARG CA C 84 59.112 59.514 -0.402 1
1 1005 . 11 1 1 A 84 84 ARG CB C 84 28.579 29.646 -1.067 1
1 1007 . 11 1 1 A 84 84 ARG N N 84 119.586 119.626 -0.040 1
1 1008 . 11 1 1 A 85 85 SER H H 85 7.291 7.757 -0.466 1
1 1009 . 11 1 1 A 85 85 SER HA H 85 4.189 4.067 0.122 1
1 1012 . 11 1 1 A 85 85 SER C C 85 175.546 176.785 -1.239 1
1 1013 . 11 1 1 A 85 85 SER CA C 85 61.376 61.559 -0.183 1
1 1014 . 11 1 1 A 85 85 SER CB C 85 62.805 62.932 -0.127 1
1 1015 . 11 1 1 A 85 85 SER N N 85 112.921 113.973 -1.052 1
1 1016 . 11 1 1 A 86 86 HIS H H 86 8.156 7.387 0.769 1
1 1017 . 11 1 1 A 86 86 HIS HA H 86 4.782 4.301 0.481 1
1 1022 . 11 1 1 A 86 86 HIS C C 86 176.851 177.660 -0.809 1
1 1023 . 11 1 1 A 86 86 HIS CA C 86 58.898 59.116 -0.218 1
1 1024 . 11 1 1 A 86 86 HIS CB C 86 31.110 29.830 1.280 1
1 1027 . 11 1 1 A 86 86 HIS N N 86 119.258 117.701 1.557 1
1 1028 . 11 1 1 A 87 87 TYR H H 87 9.180 8.507 0.673 1
1 1029 . 11 1 1 A 87 87 TYR HA H 87 3.913 3.958 -0.045 1
1 1036 . 11 1 1 A 87 87 TYR C C 87 176.841 177.278 -0.437 1
1 1037 . 11 1 1 A 87 87 TYR CA C 87 63.526 61.511 2.015 1
1 1038 . 11 1 1 A 87 87 TYR CB C 87 39.431 38.252 1.179 1
1 1041 . 11 1 1 A 87 87 TYR N N 87 120.625 120.216 0.409 1
1 1042 . 11 1 1 A 88 88 GLU H H 88 9.028 8.522 0.506 1
1 1043 . 11 1 1 A 88 88 GLU HA H 88 3.682 4.123 -0.441 1
1 1048 . 11 1 1 A 88 88 GLU C C 88 175.833 178.373 -2.540 1
1 1049 . 11 1 1 A 88 88 GLU CA C 88 59.730 60.045 -0.315 1
1 1050 . 11 1 1 A 88 88 GLU CB C 88 30.009 29.198 0.811 1
1 1052 . 11 1 1 A 88 88 GLU N N 88 119.531 118.492 1.039 1
1 1053 . 11 1 1 A 89 89 ARG H H 89 8.052 7.717 0.335 1
1 1054 . 11 1 1 A 89 89 ARG HA H 89 4.292 4.446 -0.154 1
1 1061 . 11 1 1 A 89 89 ARG C C 89 176.045 178.400 -2.355 1
1 1062 . 11 1 1 A 89 89 ARG CA C 89 58.538 57.817 0.721 1
1 1063 . 11 1 1 A 89 89 ARG CB C 89 31.841 31.630 0.211 1
1 1065 . 11 1 1 A 89 89 ARG N N 89 114.741 117.696 -2.955 1
1 1066 . 11 1 1 A 90 90 ILE H H 90 8.141 8.155 -0.014 1
1 1067 . 11 1 1 A 90 90 ILE HA H 90 4.296 3.694 0.602 1
1 1075 . 11 1 1 A 90 90 ILE C C 90 174.461 177.037 -2.576 1
1 1076 . 11 1 1 A 90 90 ILE CA C 90 63.649 63.760 -0.111 1
1 1077 . 11 1 1 A 90 90 ILE CB C 90 40.626 38.310 2.316 1
1 1079 . 11 1 1 A 90 90 ILE N N 90 113.421 120.527 -7.106 1
1 1080 . 11 1 1 A 91 91 VAL H H 91 7.350 7.648 -0.298 1
1 1081 . 11 1 1 A 91 91 VAL HA H 91 4.144 3.656 0.488 1
1 1089 . 11 1 1 A 91 91 VAL C C 91 175.422 176.896 -1.474 1
1 1090 . 11 1 1 A 91 91 VAL CA C 91 65.042 64.007 1.035 1
1 1091 . 11 1 1 A 91 91 VAL CB C 91 33.215 31.564 1.651 1
1 1092 . 11 1 1 A 91 91 VAL N N 91 118.215 120.715 -2.500 1
1 1093 . 11 1 1 A 92 92 TYR H H 92 8.565 8.033 0.532 1
1 1094 . 11 1 1 A 92 92 TYR HA H 92 4.217 4.091 0.126 1
1 1099 . 11 1 1 A 92 92 TYR C C 92 171.495 174.979 -3.484 1
1 1100 . 11 1 1 A 92 92 TYR CA C 92 61.558 62.239 -0.681 1
1 1101 . 11 1 1 A 92 92 TYR CB C 92 36.757 37.173 -0.416 1
1 1102 . 11 1 1 A 92 92 TYR N N 92 121.370 121.769 -0.399 1
1 1103 . 11 1 1 A 93 93 PRO HA H 93 4.136 4.356 -0.220 1
1 1108 . 11 1 1 A 93 93 PRO C C 93 177.077 178.528 -1.451 1
1 1109 . 11 1 1 A 93 93 PRO CA C 93 66.037 65.932 0.105 1
1 1110 . 11 1 1 A 93 93 PRO CB C 93 31.482 30.783 0.699 1
1 1111 . 11 1 1 A 94 94 TYR H H 94 6.517 7.465 -0.948 1
1 1112 . 11 1 1 A 94 94 TYR HA H 94 2.798 4.450 -1.652 1
1 1119 . 11 1 1 A 94 94 TYR C C 94 174.985 178.112 -3.127 1
1 1120 . 11 1 1 A 94 94 TYR CA C 94 59.356 59.688 -0.332 1
1 1121 . 11 1 1 A 94 94 TYR CB C 94 37.987 37.195 0.792 1
1 1124 . 11 1 1 A 94 94 TYR N N 94 115.987 117.408 -1.421 1
1 1125 . 11 1 1 A 95 95 GLU H H 95 8.205 8.127 0.078 1
1 1126 . 11 1 1 A 95 95 GLU HA H 95 3.682 4.082 -0.400 1
1 1131 . 11 1 1 A 95 95 GLU C C 95 178.530 178.994 -0.464 1
1 1132 . 11 1 1 A 95 95 GLU CA C 95 58.910 59.625 -0.715 1
1 1133 . 11 1 1 A 95 95 GLU CB C 95 29.187 29.292 -0.105 1
1 1134 . 11 1 1 A 95 95 GLU N N 95 119.946 120.905 -0.959 1
1 1135 . 11 1 1 A 96 96 MET H H 96 8.248 7.786 0.462 1
1 1136 . 11 1 1 A 96 96 MET HA H 96 4.172 4.167 0.005 1
1 1142 . 11 1 1 A 96 96 MET C C 96 176.874 178.153 -1.279 1
1 1143 . 11 1 1 A 96 96 MET CA C 96 57.159 58.921 -1.762 1
1 1144 . 11 1 1 A 96 96 MET CB C 96 31.829 32.298 -0.469 1
1 1146 . 11 1 1 A 96 96 MET N N 96 117.570 118.960 -1.390 1
1 1147 . 11 1 1 A 97 97 TYR H H 97 7.445 8.294 -0.849 1
1 1148 . 11 1 1 A 97 97 TYR HA H 97 4.248 4.102 0.146 1
1 1155 . 11 1 1 A 97 97 TYR C C 97 176.476 177.177 -0.701 1
1 1156 . 11 1 1 A 97 97 TYR CA C 97 60.470 61.625 -1.155 1
1 1157 . 11 1 1 A 97 97 TYR CB C 97 38.612 38.613 -0.001 1
1 1160 . 11 1 1 A 97 97 TYR N N 97 122.246 121.121 1.125 1
1 1161 . 11 1 1 A 98 98 GLN H H 98 8.087 8.470 -0.383 1
1 1162 . 11 1 1 A 98 98 GLN HA H 98 3.793 3.389 0.404 1
1 1169 . 11 1 1 A 98 98 GLN C C 98 175.549 178.351 -2.802 1
1 1170 . 11 1 1 A 98 98 GLN CA C 98 57.365 58.794 -1.429 1
1 1171 . 11 1 1 A 98 98 GLN CB C 98 28.901 28.299 0.602 1
1 1173 . 11 1 1 A 98 98 GLN N N 98 118.769 119.373 -0.604 1
1 1175 . 11 1 1 A 99 99 SER H H 99 7.724 8.189 -0.465 1
1 1176 . 11 1 1 A 99 99 SER HA H 99 4.293 4.247 0.046 1
1 1179 . 11 1 1 A 99 99 SER C C 99 173.696 177.092 -3.396 1
1 1180 . 11 1 1 A 99 99 SER CA C 99 59.566 62.724 -3.158 1
1 1181 . 11 1 1 A 99 99 SER CB C 99 63.847 62.490 1.357 1
1 1182 . 11 1 1 A 99 99 SER N N 99 113.257 117.099 -3.842 1
1 1183 . 11 1 1 A 100 100 GLY H H 100 7.751 8.272 -0.521 1
1 1184 . 11 1 1 A 100 100 GLY HA2 H 100 3.813 3.928 -0.115 1
1 1185 . 11 1 1 A 100 100 GLY HA3 H 100 3.934 3.937 -0.003 1
1 1186 . 11 1 1 A 100 100 GLY C C 100 172.643 175.503 -2.860 1
1 1187 . 11 1 1 A 100 100 GLY CA C 100 45.570 46.856 -1.286 1
1 1188 . 11 1 1 A 100 100 GLY N N 100 109.750 108.393 1.357 1
1 1189 . 11 1 1 A 101 101 ALA H H 101 7.824 7.917 -0.093 1
1 1190 . 11 1 1 A 101 101 ALA HA H 101 4.221 4.213 0.008 1
1 1194 . 11 1 1 A 101 101 ALA C C 101 175.639 178.493 -2.854 1
1 1195 . 11 1 1 A 101 101 ALA CA C 101 52.745 54.089 -1.344 1
1 1196 . 11 1 1 A 101 101 ALA CB C 101 19.437 18.767 0.670 1
1 1197 . 11 1 1 A 101 101 ALA N N 101 123.241 123.374 -0.133 1
1 1198 . 11 1 1 A 102 102 ASN H H 102 8.191 8.016 0.175 1
1 1199 . 11 1 1 A 102 102 ASN HA H 102 4.658 4.716 -0.058 1
1 1204 . 11 1 1 A 102 102 ASN C C 102 173.337 175.714 -2.377 1
1 1205 . 11 1 1 A 102 102 ASN CA C 102 53.374 55.103 -1.729 1
1 1206 . 11 1 1 A 102 102 ASN CB C 102 38.819 39.705 -0.886 1
1 1207 . 11 1 1 A 102 102 ASN N N 102 116.572 114.372 2.200 1
1 1209 . 11 1 1 A 103 103 LEU H H 103 8.065 7.767 0.298 1
1 1210 . 11 1 1 A 103 103 LEU HA H 103 4.363 4.698 -0.335 1
1 1219 . 11 1 1 A 103 103 LEU C C 103 175.637 175.136 0.501 1
1 1220 . 11 1 1 A 103 103 LEU CA C 103 55.292 53.557 1.735 1
1 1221 . 11 1 1 A 103 103 LEU CB C 103 42.433 44.911 -2.478 1
1 1222 . 11 1 1 A 103 103 LEU N N 103 122.074 114.737 7.337 1
1 1223 . 11 1 1 A 104 104 VAL H H 104 8.055 9.068 -1.013 1
1 1224 . 11 1 1 A 104 104 VAL HA H 104 4.131 4.914 -0.783 1
1 1232 . 11 1 1 A 104 104 VAL C C 104 174.364 174.929 -0.565 1
1 1233 . 11 1 1 A 104 104 VAL CA C 104 62.552 59.977 2.575 1
1 1234 . 11 1 1 A 104 104 VAL CB C 104 32.766 34.598 -1.832 1
1 1235 . 11 1 1 A 104 104 VAL N N 104 120.606 122.458 -1.852 1
1 1236 . 11 1 1 A 105 105 CYS H H 105 8.392 8.767 -0.375 1
1 1237 . 11 1 1 A 105 105 CYS HA H 105 4.535 4.826 -0.291 1
1 1240 . 11 1 1 A 105 105 CYS C C 105 172.593 175.460 -2.867 1
1 1241 . 11 1 1 A 105 105 CYS CA C 105 58.449 58.413 0.036 1
1 1242 . 11 1 1 A 105 105 CYS CB C 105 27.952 29.449 -1.497 1
1 1243 . 11 1 1 A 105 105 CYS N N 105 122.791 129.526 -6.735 1
1 1244 . 11 1 1 A 106 106 ASN H H 106 8.575 8.005 0.570 1
1 1245 . 11 1 1 A 106 106 ASN HA H 106 4.843 5.079 -0.236 1
1 1250 . 11 1 1 A 106 106 ASN C C 106 173.594 175.894 -2.300 1
1 1251 . 11 1 1 A 106 106 ASN CA C 106 53.337 53.255 0.082 1
1 1252 . 11 1 1 A 106 106 ASN CB C 106 39.088 39.163 -0.075 1
1 1253 . 11 1 1 A 106 106 ASN N N 106 122.001 118.814 3.187 1
1 1255 . 11 1 1 A 107 107 THR H H 107 8.090 7.818 0.272 1
1 1256 . 11 1 1 A 107 107 THR HA H 107 4.348 3.987 0.361 1
1 1261 . 11 1 1 A 107 107 THR C C 107 172.516 176.268 -3.752 1
1 1262 . 11 1 1 A 107 107 THR CA C 107 61.803 67.086 -5.283 1
1 1263 . 11 1 1 A 107 107 THR CB C 107 69.812 68.329 1.483 1
1 1265 . 11 1 1 A 107 107 THR N N 107 114.374 114.635 -0.261 1
1 1266 . 11 1 1 A 108 108 ARG H H 108 8.322 7.959 0.363 1
1 1267 . 11 1 1 A 108 108 ARG HA H 108 4.634 4.211 0.423 1
1 1274 . 11 1 1 A 108 108 ARG C C 108 172.608 177.457 -4.849 1
1 1275 . 11 1 1 A 108 108 ARG CA C 108 54.026 60.489 -6.463 1
1 1276 . 11 1 1 A 108 108 ARG CB C 108 30.246 30.492 -0.246 1
1 1278 . 11 1 1 A 108 108 ARG N N 108 124.017 120.371 3.646 1
1 1279 . 11 1 1 A 109 109 PRO HA H 109 4.354 4.738 -0.384 1
1 1286 . 11 1 1 A 109 109 PRO C C 109 174.978 179.156 -4.178 1
1 1287 . 11 1 1 A 109 109 PRO CA C 109 63.396 65.904 -2.508 1
1 1288 . 11 1 1 A 109 109 PRO CB C 109 32.046 31.248 0.798 1
1 1290 . 11 1 1 A 110 110 PHE H H 110 8.123 7.630 0.493 1
1 1291 . 11 1 1 A 110 110 PHE HA H 110 4.619 4.508 0.111 1
1 1296 . 11 1 1 A 110 110 PHE C C 110 173.856 176.903 -3.047 1
1 1297 . 11 1 1 A 110 110 PHE CA C 110 57.353 62.068 -4.715 1
1 1298 . 11 1 1 A 110 110 PHE CB C 110 39.364 39.570 -0.206 1
1 1301 . 11 1 1 A 110 110 PHE N N 110 119.265 118.530 0.735 1
1 1302 . 11 1 1 A 111 111 ASP H H 111 8.161 8.555 -0.394 1
1 1303 . 11 1 1 A 111 111 ASP HA H 111 4.613 4.433 0.180 1
1 1306 . 11 1 1 A 111 111 ASP C C 111 174.114 178.483 -4.369 1
1 1307 . 11 1 1 A 111 111 ASP CA C 111 54.350 57.469 -3.119 1
1 1308 . 11 1 1 A 111 111 ASP CB C 111 41.413 40.355 1.058 1
1 1309 . 11 1 1 A 111 111 ASP N N 111 121.764 119.604 2.160 1
1 1310 . 11 1 1 A 112 112 ASN H H 112 8.307 7.986 0.321 1
1 1311 . 11 1 1 A 112 112 ASN HA H 112 4.662 4.728 -0.066 1
1 1316 . 11 1 1 A 112 112 ASN C C 112 173.595 177.591 -3.996 1
1 1317 . 11 1 1 A 112 112 ASN CA C 112 53.486 55.508 -2.022 1
1 1318 . 11 1 1 A 112 112 ASN CB C 112 39.225 38.549 0.676 1
1 1319 . 11 1 1 A 112 112 ASN N N 112 119.154 117.206 1.948 1
1 1321 . 11 1 1 A 113 113 GLU H H 113 8.404 7.997 0.407 1
1 1322 . 11 1 1 A 113 113 GLU HA H 113 4.264 4.106 0.158 1
1 1327 . 11 1 1 A 113 113 GLU C C 113 174.886 178.678 -3.792 1
1 1328 . 11 1 1 A 113 113 GLU CA C 113 56.681 58.987 -2.306 1
1 1329 . 11 1 1 A 113 113 GLU CB C 113 30.403 30.003 0.400 1
1 1331 . 11 1 1 A 113 113 GLU N N 113 120.943 119.729 1.214 1
1 1332 . 11 1 1 A 114 114 GLU H H 114 8.388 8.940 -0.552 1
1 1333 . 11 1 1 A 114 114 GLU HA H 114 4.262 4.218 0.044 1
1 1338 . 11 1 1 A 114 114 GLU C C 114 174.819 176.572 -1.753 1
1 1339 . 11 1 1 A 114 114 GLU CA C 114 56.769 59.315 -2.546 1
1 1340 . 11 1 1 A 114 114 GLU CB C 114 30.125 29.255 0.870 1
1 1342 . 11 1 1 A 114 114 GLU N N 114 121.869 117.388 4.481 1
1 1343 . 11 1 1 A 115 115 LYS H H 115 8.236 8.113 0.123 1
1 1344 . 11 1 1 A 115 115 LYS HA H 115 4.347 4.570 -0.223 1
1 1353 . 11 1 1 A 115 115 LYS C C 115 174.633 175.957 -1.324 1
1 1354 . 11 1 1 A 115 115 LYS CA C 115 56.426 54.653 1.773 1
1 1355 . 11 1 1 A 115 115 LYS CB C 115 33.277 32.618 0.659 1
1 1359 . 11 1 1 A 115 115 LYS N N 115 121.997 119.592 2.405 1
1 1360 . 11 1 1 A 116 116 ASP H H 116 8.386 8.456 -0.070 1
1 1361 . 11 1 1 A 116 116 ASP HA H 116 4.600 4.621 -0.021 1
1 1364 . 11 1 1 A 116 116 ASP C C 116 173.448 177.209 -3.761 1
1 1365 . 11 1 1 A 116 116 ASP CA C 116 54.773 56.986 -2.213 1
1 1366 . 11 1 1 A 116 116 ASP CB C 116 41.029 41.413 -0.384 1
1 1367 . 11 1 1 A 116 116 ASP N N 116 121.057 126.322 -5.265 1
1 5 . 12 1 1 A 2 2 MET HA H 2 4.534 4.396 0.138 1
1 13 . 12 1 1 A 2 2 MET C C 2 174.355 178.028 -3.673 1
1 14 . 12 1 1 A 2 2 MET CA C 2 56.247 56.639 -0.392 1
1 15 . 12 1 1 A 2 2 MET CB C 2 32.855 31.859 0.996 1
1 18 . 12 1 1 A 3 3 ASN H H 3 8.600 8.249 0.351 1
1 19 . 12 1 1 A 3 3 ASN HA H 3 4.711 4.434 0.277 1
1 24 . 12 1 1 A 3 3 ASN C C 3 173.983 177.653 -3.670 1
1 25 . 12 1 1 A 3 3 ASN CA C 3 53.650 56.628 -2.978 1
1 26 . 12 1 1 A 3 3 ASN CB C 3 38.624 38.964 -0.340 1
1 27 . 12 1 1 A 3 3 ASN N N 3 120.149 119.562 0.587 1
1 29 . 12 1 1 A 4 4 GLU H H 4 8.495 8.153 0.342 1
1 30 . 12 1 1 A 4 4 GLU HA H 4 4.235 4.032 0.203 1
1 35 . 12 1 1 A 4 4 GLU C C 4 175.752 179.155 -3.403 1
1 36 . 12 1 1 A 4 4 GLU CA C 4 58.075 59.180 -1.105 1
1 37 . 12 1 1 A 4 4 GLU CB C 4 30.125 29.035 1.090 1
1 38 . 12 1 1 A 4 4 GLU N N 4 121.543 118.718 2.825 1
1 39 . 12 1 1 A 5 5 LEU HA H 5 4.073 4.114 -0.041 1
1 47 . 12 1 1 A 5 5 LEU CB C 5 41.897 41.813 0.084 1
1 50 . 12 1 1 A 6 6 GLU H H 6 8.332 8.351 -0.019 1
1 51 . 12 1 1 A 6 6 GLU HA H 6 3.621 4.375 -0.754 1
1 52 . 12 1 1 A 6 6 GLU C C 6 176.402 177.566 -1.164 1
1 53 . 12 1 1 A 6 6 GLU CA C 6 58.461 58.406 0.055 1
1 54 . 12 1 1 A 6 6 GLU CB C 6 29.730 29.172 0.558 1
1 55 . 12 1 1 A 6 6 GLU N N 6 121.462 117.679 3.783 1
1 56 . 12 1 1 A 7 7 ALA H H 7 8.244 7.698 0.546 1
1 57 . 12 1 1 A 7 7 ALA HA H 7 4.185 4.084 0.101 1
1 61 . 12 1 1 A 7 7 ALA C C 7 177.982 178.140 -0.158 1
1 62 . 12 1 1 A 7 7 ALA CA C 7 54.791 55.517 -0.726 1
1 63 . 12 1 1 A 7 7 ALA CB C 7 18.836 18.949 -0.113 1
1 64 . 12 1 1 A 7 7 ALA N N 7 123.078 121.898 1.180 1
1 65 . 12 1 1 A 8 8 GLN H H 8 8.274 7.340 0.934 1
1 66 . 12 1 1 A 8 8 GLN HA H 8 4.219 4.700 -0.481 1
1 73 . 12 1 1 A 8 8 GLN C C 8 176.325 175.175 1.150 1
1 74 . 12 1 1 A 8 8 GLN CA C 8 57.864 55.420 2.444 1
1 75 . 12 1 1 A 8 8 GLN CB C 8 28.768 30.064 -1.296 1
1 77 . 12 1 1 A 8 8 GLN N N 8 117.452 115.776 1.676 1
1 79 . 12 1 1 A 9 9 THR H H 9 8.043 8.621 -0.578 1
1 80 . 12 1 1 A 9 9 THR HA H 9 3.998 4.773 -0.775 1
1 85 . 12 1 1 A 9 9 THR C C 9 173.904 175.095 -1.191 1
1 86 . 12 1 1 A 9 9 THR CA C 9 65.435 60.608 4.827 1
1 87 . 12 1 1 A 9 9 THR CB C 9 68.870 70.573 -1.703 1
1 89 . 12 1 1 A 9 9 THR N N 9 116.135 118.496 -2.361 1
1 90 . 12 1 1 A 10 10 ARG H H 10 8.095 8.710 -0.615 1
1 91 . 12 1 1 A 10 10 ARG HA H 10 4.040 4.129 -0.089 1
1 98 . 12 1 1 A 10 10 ARG C C 10 176.583 176.156 0.427 1
1 99 . 12 1 1 A 10 10 ARG CA C 10 59.262 57.518 1.744 1
1 100 . 12 1 1 A 10 10 ARG CB C 10 29.900 30.081 -0.181 1
1 101 . 12 1 1 A 10 10 ARG N N 10 121.157 125.004 -3.847 1
1 102 . 12 1 1 A 11 11 VAL H H 11 7.657 7.867 -0.210 1
1 103 . 12 1 1 A 11 11 VAL HA H 11 3.769 4.392 -0.623 1
1 111 . 12 1 1 A 11 11 VAL C C 11 176.662 177.953 -1.291 1
1 112 . 12 1 1 A 11 11 VAL CA C 11 65.914 63.483 2.431 1
1 113 . 12 1 1 A 11 11 VAL CB C 11 31.745 33.458 -1.713 1
1 114 . 12 1 1 A 11 11 VAL N N 11 118.580 118.082 0.498 1
1 115 . 12 1 1 A 12 12 LYS H H 12 7.471 7.842 -0.371 1
1 116 . 12 1 1 A 12 12 LYS HA H 12 3.366 4.268 -0.902 1
1 123 . 12 1 1 A 12 12 LYS C C 12 176.457 178.670 -2.213 1
1 124 . 12 1 1 A 12 12 LYS CA C 12 59.545 59.139 0.406 1
1 125 . 12 1 1 A 12 12 LYS CB C 12 32.206 32.461 -0.255 1
1 126 . 12 1 1 A 12 12 LYS N N 12 121.835 122.331 -0.496 1
1 127 . 12 1 1 A 13 13 LEU H H 13 8.144 7.829 0.315 1
1 128 . 12 1 1 A 13 13 LEU HA H 13 4.093 3.978 0.115 1
1 137 . 12 1 1 A 13 13 LEU C C 13 178.254 179.011 -0.757 1
1 138 . 12 1 1 A 13 13 LEU CA C 13 58.023 57.788 0.235 1
1 139 . 12 1 1 A 13 13 LEU CB C 13 41.283 41.685 -0.402 1
1 140 . 12 1 1 A 13 13 LEU N N 13 118.688 120.400 -1.712 1
1 141 . 12 1 1 A 14 14 ASN H H 14 8.384 8.408 -0.024 1
1 142 . 12 1 1 A 14 14 ASN HA H 14 4.567 4.430 0.137 1
1 147 . 12 1 1 A 14 14 ASN C C 14 175.397 177.193 -1.796 1
1 148 . 12 1 1 A 14 14 ASN CA C 14 56.239 56.341 -0.102 1
1 149 . 12 1 1 A 14 14 ASN CB C 14 38.432 39.285 -0.853 1
1 150 . 12 1 1 A 14 14 ASN N N 14 118.175 117.404 0.771 1
1 152 . 12 1 1 A 15 15 TYR H H 15 7.982 8.198 -0.216 1
1 153 . 12 1 1 A 15 15 TYR HA H 15 4.249 3.981 0.268 1
1 160 . 12 1 1 A 15 15 TYR C C 15 175.503 177.359 -1.856 1
1 161 . 12 1 1 A 15 15 TYR CA C 15 62.450 61.246 1.204 1
1 162 . 12 1 1 A 15 15 TYR CB C 15 39.399 38.586 0.813 1
1 163 . 12 1 1 A 15 15 TYR N N 15 121.955 120.519 1.436 1
1 164 . 12 1 1 A 16 16 LEU H H 16 8.198 8.662 -0.464 1
1 165 . 12 1 1 A 16 16 LEU HA H 16 4.470 3.937 0.533 1
1 175 . 12 1 1 A 16 16 LEU C C 16 177.125 177.760 -0.635 1
1 176 . 12 1 1 A 16 16 LEU CA C 16 57.374 58.084 -0.710 1
1 177 . 12 1 1 A 16 16 LEU CB C 16 41.443 41.712 -0.269 1
1 178 . 12 1 1 A 16 16 LEU N N 16 117.642 121.319 -3.677 1
1 179 . 12 1 1 A 17 17 ASP H H 17 8.061 8.368 -0.307 1
1 180 . 12 1 1 A 17 17 ASP C C 17 177.836 178.205 -0.369 1
1 181 . 12 1 1 A 17 17 ASP CA C 17 57.486 57.977 -0.491 1
1 182 . 12 1 1 A 17 17 ASP CB C 17 41.433 42.260 -0.827 1
1 183 . 12 1 1 A 17 17 ASP N N 17 118.700 118.938 -0.238 1
1 184 . 12 1 1 A 18 18 GLN H H 18 8.111 7.749 0.362 1
1 185 . 12 1 1 A 18 18 GLN HA H 18 4.002 4.029 -0.027 1
1 190 . 12 1 1 A 18 18 GLN CA C 18 59.046 58.739 0.307 1
1 191 . 12 1 1 A 18 18 GLN CB C 18 28.700 28.519 0.181 1
1 193 . 12 1 1 A 18 18 GLN N N 18 119.539 118.916 0.623 1
1 195 . 12 1 1 A 19 19 ILE H H 19 8.330 7.937 0.393 1
1 196 . 12 1 1 A 19 19 ILE HA H 19 3.306 3.837 -0.531 1
1 204 . 12 1 1 A 19 19 ILE C C 19 175.608 177.383 -1.775 1
1 205 . 12 1 1 A 19 19 ILE CA C 19 64.760 63.024 1.736 1
1 206 . 12 1 1 A 19 19 ILE CB C 19 37.148 37.142 0.006 1
1 209 . 12 1 1 A 19 19 ILE N N 19 121.490 119.903 1.587 1
1 210 . 12 1 1 A 20 20 ALA H H 20 8.057 7.752 0.305 1
1 211 . 12 1 1 A 20 20 ALA HA H 20 4.349 4.394 -0.045 1
1 215 . 12 1 1 A 20 20 ALA C C 20 179.297 179.440 -0.143 1
1 216 . 12 1 1 A 20 20 ALA CA C 20 56.150 54.501 1.649 1
1 217 . 12 1 1 A 20 20 ALA CB C 20 18.104 19.269 -1.165 1
1 218 . 12 1 1 A 20 20 ALA N N 20 124.441 124.087 0.354 1
1 219 . 12 1 1 A 21 21 LYS H H 21 8.116 8.079 0.037 1
1 220 . 12 1 1 A 21 21 LYS HA H 21 4.108 4.065 0.043 1
1 229 . 12 1 1 A 21 21 LYS C C 21 176.720 178.373 -1.653 1
1 230 . 12 1 1 A 21 21 LYS CA C 21 59.166 59.650 -0.484 1
1 231 . 12 1 1 A 21 21 LYS CB C 21 32.085 32.336 -0.251 1
1 233 . 12 1 1 A 21 21 LYS N N 21 119.865 119.508 0.357 1
1 234 . 12 1 1 A 22 22 PHE H H 22 7.875 8.071 -0.196 1
1 235 . 12 1 1 A 22 22 PHE HA H 22 4.012 4.159 -0.147 1
1 242 . 12 1 1 A 22 22 PHE C C 22 175.545 177.473 -1.928 1
1 243 . 12 1 1 A 22 22 PHE CA C 22 61.070 61.296 -0.226 1
1 244 . 12 1 1 A 22 22 PHE CB C 22 39.072 38.734 0.338 1
1 249 . 12 1 1 A 22 22 PHE N N 22 119.729 120.068 -0.339 1
1 250 . 12 1 1 A 23 23 TRP H H 23 7.841 8.078 -0.237 1
1 251 . 12 1 1 A 23 23 TRP HA H 23 4.149 4.050 0.099 1
1 260 . 12 1 1 A 23 23 TRP C C 23 176.668 177.959 -1.291 1
1 261 . 12 1 1 A 23 23 TRP CB C 23 28.543 29.605 -1.062 1
1 267 . 12 1 1 A 23 23 TRP N N 23 119.440 120.813 -1.373 1
1 269 . 12 1 1 A 24 24 GLU H H 24 8.261 8.360 -0.099 1
1 270 . 12 1 1 A 24 24 GLU HA H 24 4.265 4.321 -0.056 1
1 275 . 12 1 1 A 24 24 GLU C C 24 179.679 179.058 0.621 1
1 276 . 12 1 1 A 24 24 GLU CA C 24 59.706 58.911 0.795 1
1 277 . 12 1 1 A 24 24 GLU CB C 24 29.720 29.460 0.260 1
1 279 . 12 1 1 A 24 24 GLU N N 24 121.376 118.614 2.762 1
1 280 . 12 1 1 A 25 25 ILE H H 25 8.071 8.007 0.064 1
1 281 . 12 1 1 A 25 25 ILE HA H 25 3.815 3.759 0.056 1
1 291 . 12 1 1 A 25 25 ILE C C 25 176.343 177.250 -0.907 1
1 292 . 12 1 1 A 25 25 ILE CA C 25 64.464 62.820 1.644 1
1 293 . 12 1 1 A 25 25 ILE CB C 25 37.371 37.270 0.101 1
1 296 . 12 1 1 A 25 25 ILE N N 25 121.499 119.601 1.898 1
1 297 . 12 1 1 A 26 26 GLN H H 26 7.327 6.949 0.378 1
1 298 . 12 1 1 A 26 26 GLN HA H 26 4.074 4.162 -0.088 1
1 305 . 12 1 1 A 26 26 GLN C C 26 174.906 175.980 -1.074 1
1 306 . 12 1 1 A 26 26 GLN CA C 26 55.450 55.518 -0.068 1
1 307 . 12 1 1 A 26 26 GLN CB C 26 28.458 28.656 -0.198 1
1 309 . 12 1 1 A 26 26 GLN N N 26 116.532 119.206 -2.674 1
1 311 . 12 1 1 A 27 27 GLY H H 27 7.861 8.710 -0.849 1
1 312 . 12 1 1 A 27 27 GLY HA2 H 27 4.297 3.718 0.579 1
1 313 . 12 1 1 A 27 27 GLY HA3 H 27 3.823 3.720 0.103 1
1 314 . 12 1 1 A 27 27 GLY C C 27 172.698 173.097 -0.399 1
1 315 . 12 1 1 A 27 27 GLY CA C 27 45.608 45.838 -0.230 1
1 316 . 12 1 1 A 27 27 GLY N N 27 106.837 108.261 -1.424 1
1 317 . 12 1 1 A 28 28 SER H H 28 8.083 7.004 1.079 1
1 318 . 12 1 1 A 28 28 SER HA H 28 4.777 4.447 0.330 1
1 321 . 12 1 1 A 28 28 SER C C 28 171.196 171.964 -0.768 1
1 322 . 12 1 1 A 28 28 SER CA C 28 56.041 55.821 0.220 1
1 323 . 12 1 1 A 28 28 SER CB C 28 64.539 63.789 0.750 1
1 324 . 12 1 1 A 28 28 SER N N 28 116.151 114.281 1.870 1
1 325 . 12 1 1 A 29 29 SER H H 29 8.354 8.443 -0.089 1
1 326 . 12 1 1 A 29 29 SER HA H 29 4.389 5.077 -0.688 1
1 329 . 12 1 1 A 29 29 SER C C 29 172.166 172.521 -0.355 1
1 330 . 12 1 1 A 29 29 SER CA C 29 58.107 56.601 1.506 1
1 331 . 12 1 1 A 29 29 SER CB C 29 63.853 66.298 -2.445 1
1 332 . 12 1 1 A 29 29 SER N N 29 116.596 115.259 1.337 1
1 333 . 12 1 1 A 30 30 LEU H H 30 8.990 8.636 0.354 1
1 334 . 12 1 1 A 30 30 LEU HA H 30 3.964 5.090 -1.126 1
1 344 . 12 1 1 A 30 30 LEU C C 30 173.752 174.945 -1.193 1
1 345 . 12 1 1 A 30 30 LEU CA C 30 55.193 54.582 0.611 1
1 346 . 12 1 1 A 30 30 LEU CB C 30 42.869 43.352 -0.483 1
1 349 . 12 1 1 A 30 30 LEU N N 30 125.860 126.472 -0.612 1
1 350 . 12 1 1 A 31 31 LYS H H 31 8.118 9.011 -0.893 1
1 351 . 12 1 1 A 31 31 LYS HA H 31 4.498 4.839 -0.341 1
1 360 . 12 1 1 A 31 31 LYS C C 31 173.555 175.144 -1.589 1
1 361 . 12 1 1 A 31 31 LYS CA C 31 54.372 55.083 -0.711 1
1 362 . 12 1 1 A 31 31 LYS CB C 31 32.814 33.472 -0.658 1
1 365 . 12 1 1 A 31 31 LYS N N 31 129.965 127.238 2.727 1
1 366 . 12 1 1 A 32 32 ILE H H 32 8.717 8.341 0.376 1
1 367 . 12 1 1 A 32 32 ILE HA H 32 4.011 4.592 -0.581 1
1 377 . 12 1 1 A 32 32 ILE C C 32 173.038 174.746 -1.708 1
1 378 . 12 1 1 A 32 32 ILE CA C 32 59.921 58.701 1.220 1
1 379 . 12 1 1 A 32 32 ILE CB C 32 38.139 38.402 -0.263 1
1 382 . 12 1 1 A 32 32 ILE N N 32 127.091 121.877 5.214 1
1 383 . 12 1 1 A 33 33 PRO HA H 33 4.412 4.459 -0.047 1
1 390 . 12 1 1 A 33 33 PRO C C 33 172.724 175.874 -3.150 1
1 391 . 12 1 1 A 33 33 PRO CA C 33 62.565 62.480 0.085 1
1 392 . 12 1 1 A 33 33 PRO CB C 33 32.728 32.343 0.385 1
1 394 . 12 1 1 A 34 34 ASN H H 34 8.265 8.416 -0.151 1
1 395 . 12 1 1 A 34 34 ASN HA H 34 5.147 5.453 -0.306 1
1 400 . 12 1 1 A 34 34 ASN C C 34 174.079 173.462 0.617 1
1 401 . 12 1 1 A 34 34 ASN CA C 34 52.088 51.516 0.572 1
1 402 . 12 1 1 A 34 34 ASN CB C 34 40.387 42.506 -2.119 1
1 403 . 12 1 1 A 34 34 ASN N N 34 116.424 115.038 1.386 1
1 405 . 12 1 1 A 35 35 VAL H H 35 8.904 8.878 0.026 1
1 406 . 12 1 1 A 35 35 VAL HA H 35 4.159 4.474 -0.315 1
1 414 . 12 1 1 A 35 35 VAL C C 35 173.834 174.651 -0.817 1
1 415 . 12 1 1 A 35 35 VAL CA C 35 61.953 59.796 2.157 1
1 416 . 12 1 1 A 35 35 VAL CB C 35 34.432 34.699 -0.267 1
1 419 . 12 1 1 A 35 35 VAL N N 35 122.778 118.819 3.959 1
1 420 . 12 1 1 A 36 36 GLU H H 36 9.560 9.463 0.097 1
1 421 . 12 1 1 A 36 36 GLU HA H 36 3.819 4.029 -0.210 1
1 426 . 12 1 1 A 36 36 GLU C C 36 173.604 176.384 -2.780 1
1 427 . 12 1 1 A 36 36 GLU CA C 36 57.131 58.006 -0.875 1
1 428 . 12 1 1 A 36 36 GLU CB C 36 27.464 28.117 -0.653 1
1 430 . 12 1 1 A 36 36 GLU N N 36 127.014 127.774 -0.760 1
1 431 . 12 1 1 A 37 37 ARG H H 37 8.578 8.602 -0.024 1
1 432 . 12 1 1 A 37 37 ARG HA H 37 3.792 3.976 -0.184 1
1 439 . 12 1 1 A 37 37 ARG C C 37 173.371 175.321 -1.950 1
1 440 . 12 1 1 A 37 37 ARG CA C 37 57.952 57.357 0.595 1
1 441 . 12 1 1 A 37 37 ARG CB C 37 27.657 27.935 -0.278 1
1 443 . 12 1 1 A 37 37 ARG N N 37 108.362 117.545 -9.183 1
1 444 . 12 1 1 A 38 38 ARG H H 38 7.696 7.936 -0.240 1
1 445 . 12 1 1 A 38 38 ARG HA H 38 4.743 4.932 -0.189 1
1 452 . 12 1 1 A 38 38 ARG C C 38 173.513 175.413 -1.900 1
1 453 . 12 1 1 A 38 38 ARG CA C 38 54.507 54.794 -0.287 1
1 454 . 12 1 1 A 38 38 ARG CB C 38 33.751 33.241 0.510 1
1 456 . 12 1 1 A 38 38 ARG N N 38 118.370 120.984 -2.614 1
1 457 . 12 1 1 A 39 39 ILE H H 39 8.463 8.359 0.104 1
1 458 . 12 1 1 A 39 39 ILE HA H 39 4.184 4.217 -0.033 1
1 468 . 12 1 1 A 39 39 ILE C C 39 175.150 175.817 -0.667 1
1 469 . 12 1 1 A 39 39 ILE CA C 39 62.076 61.802 0.274 1
1 470 . 12 1 1 A 39 39 ILE CB C 39 38.864 39.545 -0.681 1
1 473 . 12 1 1 A 39 39 ILE N N 39 123.604 126.108 -2.504 1
1 474 . 12 1 1 A 40 40 LEU H H 40 8.239 8.144 0.095 1
1 475 . 12 1 1 A 40 40 LEU HA H 40 4.259 4.418 -0.159 1
1 485 . 12 1 1 A 40 40 LEU C C 40 173.152 175.404 -2.252 1
1 486 . 12 1 1 A 40 40 LEU CA C 40 55.305 54.684 0.621 1
1 487 . 12 1 1 A 40 40 LEU CB C 40 43.113 41.770 1.343 1
1 490 . 12 1 1 A 40 40 LEU N N 40 129.550 128.753 0.797 1
1 491 . 12 1 1 A 41 41 ASP H H 41 8.992 8.448 0.544 1
1 492 . 12 1 1 A 41 41 ASP HA H 41 4.798 4.762 0.036 1
1 495 . 12 1 1 A 41 41 ASP C C 41 173.837 176.202 -2.365 1
1 496 . 12 1 1 A 41 41 ASP CA C 41 52.077 53.397 -1.320 1
1 497 . 12 1 1 A 41 41 ASP CB C 41 39.454 40.599 -1.145 1
1 498 . 12 1 1 A 41 41 ASP N N 41 127.022 127.699 -0.677 1
1 499 . 12 1 1 A 42 42 LEU H H 42 7.912 8.209 -0.297 1
1 500 . 12 1 1 A 42 42 LEU HA H 42 3.970 4.163 -0.193 1
1 510 . 12 1 1 A 42 42 LEU C C 42 176.305 177.823 -1.518 1
1 511 . 12 1 1 A 42 42 LEU CA C 42 58.128 57.817 0.311 1
1 512 . 12 1 1 A 42 42 LEU CB C 42 43.043 41.671 1.372 1
1 514 . 12 1 1 A 42 42 LEU N N 42 125.064 127.871 -2.807 1
1 515 . 12 1 1 A 43 43 TYR H H 43 8.565 8.470 0.095 1
1 516 . 12 1 1 A 43 43 TYR HA H 43 3.728 3.919 -0.191 1
1 523 . 12 1 1 A 43 43 TYR C C 43 175.757 177.054 -1.297 1
1 524 . 12 1 1 A 43 43 TYR CA C 43 61.774 61.640 0.134 1
1 525 . 12 1 1 A 43 43 TYR CB C 43 38.235 38.392 -0.157 1
1 528 . 12 1 1 A 43 43 TYR N N 43 117.822 120.431 -2.609 1
1 529 . 12 1 1 A 44 44 SER H H 44 8.115 8.448 -0.333 1
1 530 . 12 1 1 A 44 44 SER HA H 44 3.854 4.118 -0.264 1
1 533 . 12 1 1 A 44 44 SER C C 44 174.080 176.040 -1.960 1
1 534 . 12 1 1 A 44 44 SER CA C 44 61.873 61.862 0.011 1
1 535 . 12 1 1 A 44 44 SER CB C 44 64.350 62.829 1.521 1
1 536 . 12 1 1 A 44 44 SER N N 44 116.835 116.190 0.645 1
1 537 . 12 1 1 A 45 45 LEU H H 45 8.401 8.219 0.182 1
1 538 . 12 1 1 A 45 45 LEU HA H 45 4.102 4.204 -0.102 1
1 548 . 12 1 1 A 45 45 LEU C C 45 175.081 178.849 -3.768 1
1 549 . 12 1 1 A 45 45 LEU CA C 45 58.896 57.801 1.095 1
1 550 . 12 1 1 A 45 45 LEU CB C 45 41.741 41.454 0.287 1
1 553 . 12 1 1 A 45 45 LEU N N 45 120.621 123.304 -2.683 1
1 554 . 12 1 1 A 46 46 SER H H 46 8.110 8.415 -0.305 1
1 555 . 12 1 1 A 46 46 SER HA H 46 4.300 4.184 0.116 1
1 558 . 12 1 1 A 46 46 SER C C 46 175.019 176.636 -1.617 1
1 559 . 12 1 1 A 46 46 SER CA C 46 62.610 61.715 0.895 1
1 560 . 12 1 1 A 46 46 SER CB C 46 64.092 63.219 0.873 1
1 561 . 12 1 1 A 46 46 SER N N 46 112.826 114.940 -2.114 1
1 562 . 12 1 1 A 47 47 LYS H H 47 7.732 8.015 -0.283 1
1 563 . 12 1 1 A 47 47 LYS HA H 47 3.900 4.111 -0.211 1
1 572 . 12 1 1 A 47 47 LYS C C 47 177.441 178.853 -1.412 1
1 573 . 12 1 1 A 47 47 LYS CA C 47 58.575 59.069 -0.494 1
1 574 . 12 1 1 A 47 47 LYS CB C 47 32.351 31.894 0.457 1
1 576 . 12 1 1 A 47 47 LYS N N 47 121.210 119.042 2.168 1
1 577 . 12 1 1 A 48 48 ILE H H 48 8.672 8.071 0.601 1
1 578 . 12 1 1 A 48 48 ILE HA H 48 3.628 3.765 -0.137 1
1 588 . 12 1 1 A 48 48 ILE C C 48 175.861 178.278 -2.417 1
1 589 . 12 1 1 A 48 48 ILE CA C 48 64.188 64.665 -0.477 1
1 590 . 12 1 1 A 48 48 ILE CB C 48 37.954 37.148 0.806 1
1 593 . 12 1 1 A 48 48 ILE N N 48 120.810 120.977 -0.167 1
1 594 . 12 1 1 A 49 49 VAL H H 49 8.030 8.455 -0.425 1
1 595 . 12 1 1 A 49 49 VAL HA H 49 3.195 3.662 -0.467 1
1 603 . 12 1 1 A 49 49 VAL C C 49 176.513 178.343 -1.830 1
1 604 . 12 1 1 A 49 49 VAL CA C 49 66.760 66.885 -0.125 1
1 605 . 12 1 1 A 49 49 VAL CB C 49 30.935 31.744 -0.809 1
1 608 . 12 1 1 A 49 49 VAL N N 49 119.350 120.077 -0.727 1
1 609 . 12 1 1 A 50 50 VAL H H 50 7.336 8.197 -0.861 1
1 610 . 12 1 1 A 50 50 VAL HA H 50 3.497 3.614 -0.117 1
1 618 . 12 1 1 A 50 50 VAL C C 50 178.745 178.487 0.258 1
1 619 . 12 1 1 A 50 50 VAL CA C 50 67.384 66.696 0.688 1
1 620 . 12 1 1 A 50 50 VAL CB C 50 31.832 31.508 0.324 1
1 621 . 12 1 1 A 50 50 VAL N N 50 118.610 121.022 -2.412 1
1 622 . 12 1 1 A 51 51 GLU H H 51 8.318 8.299 0.019 1
1 623 . 12 1 1 A 51 51 GLU HA H 51 3.953 3.992 -0.039 1
1 628 . 12 1 1 A 51 51 GLU C C 51 177.281 178.663 -1.382 1
1 629 . 12 1 1 A 51 51 GLU CA C 51 59.668 59.212 0.456 1
1 630 . 12 1 1 A 51 51 GLU CB C 51 30.131 29.252 0.879 1
1 632 . 12 1 1 A 51 51 GLU N N 51 122.096 119.931 2.165 1
1 633 . 12 1 1 A 52 52 GLU H H 52 8.065 8.136 -0.071 1
1 634 . 12 1 1 A 52 52 GLU HA H 52 4.229 4.300 -0.071 1
1 639 . 12 1 1 A 52 52 GLU C C 52 173.534 176.760 -3.226 1
1 640 . 12 1 1 A 52 52 GLU CA C 52 55.547 56.328 -0.781 1
1 641 . 12 1 1 A 52 52 GLU CB C 52 28.716 29.974 -1.258 1
1 643 . 12 1 1 A 52 52 GLU N N 52 114.992 116.221 -1.229 1
1 644 . 12 1 1 A 53 53 GLY H H 53 7.459 9.473 -2.014 1
1 645 . 12 1 1 A 53 53 GLY HA2 H 53 3.630 3.940 -0.310 1
1 646 . 12 1 1 A 53 53 GLY HA3 H 53 3.630 3.954 -0.324 1
1 647 . 12 1 1 A 53 53 GLY C C 53 173.214 173.656 -0.442 1
1 648 . 12 1 1 A 53 53 GLY CA C 53 44.962 45.171 -0.209 1
1 649 . 12 1 1 A 53 53 GLY N N 53 104.909 108.390 -3.481 1
1 650 . 12 1 1 A 54 54 GLY H H 54 8.533 7.729 0.804 1
1 651 . 12 1 1 A 54 54 GLY HA2 H 54 3.548 4.045 -0.497 1
1 652 . 12 1 1 A 54 54 GLY HA3 H 54 4.521 4.077 0.444 1
1 653 . 12 1 1 A 54 54 GLY C C 54 169.966 174.649 -4.683 1
1 654 . 12 1 1 A 54 54 GLY CA C 54 43.988 45.712 -1.724 1
1 655 . 12 1 1 A 54 54 GLY N N 54 110.587 108.484 2.103 1
1 656 . 12 1 1 A 55 55 TYR H H 55 8.704 9.074 -0.370 1
1 657 . 12 1 1 A 55 55 TYR HA H 55 3.618 3.977 -0.359 1
1 664 . 12 1 1 A 55 55 TYR C C 55 174.807 177.015 -2.208 1
1 665 . 12 1 1 A 55 55 TYR CA C 55 62.540 61.775 0.765 1
1 666 . 12 1 1 A 55 55 TYR CB C 55 39.669 39.406 0.263 1
1 669 . 12 1 1 A 55 55 TYR N N 55 119.168 123.544 -4.376 1
1 670 . 12 1 1 A 56 56 GLU H H 56 9.006 8.424 0.582 1
1 671 . 12 1 1 A 56 56 GLU HA H 56 3.638 3.797 -0.159 1
1 676 . 12 1 1 A 56 56 GLU C C 56 177.400 179.070 -1.670 1
1 677 . 12 1 1 A 56 56 GLU CA C 56 60.530 59.471 1.059 1
1 678 . 12 1 1 A 56 56 GLU CB C 56 29.168 29.032 0.136 1
1 679 . 12 1 1 A 56 56 GLU N N 56 118.969 118.229 0.740 1
1 680 . 12 1 1 A 57 57 ALA H H 57 8.235 7.992 0.243 1
1 681 . 12 1 1 A 57 57 ALA HA H 57 3.980 4.038 -0.058 1
1 685 . 12 1 1 A 57 57 ALA C C 57 177.678 179.746 -2.068 1
1 686 . 12 1 1 A 57 57 ALA CA C 57 54.910 55.169 -0.259 1
1 687 . 12 1 1 A 57 57 ALA CB C 57 18.122 18.351 -0.229 1
1 688 . 12 1 1 A 57 57 ALA N N 57 122.860 122.768 0.092 1
1 689 . 12 1 1 A 58 58 ILE H H 58 7.831 7.423 0.408 1
1 690 . 12 1 1 A 58 58 ILE HA H 58 3.189 3.177 0.012 1
1 700 . 12 1 1 A 58 58 ILE C C 58 177.818 176.892 0.926 1
1 701 . 12 1 1 A 58 58 ILE CA C 58 65.074 65.101 -0.027 1
1 702 . 12 1 1 A 58 58 ILE CB C 58 38.178 36.969 1.209 1
1 706 . 12 1 1 A 58 58 ILE N N 58 117.418 117.811 -0.393 1
1 707 . 12 1 1 A 59 59 CYS H H 59 7.760 7.945 -0.185 1
1 708 . 12 1 1 A 59 59 CYS HA H 59 4.203 4.254 -0.051 1
1 711 . 12 1 1 A 59 59 CYS C C 59 176.357 176.872 -0.515 1
1 712 . 12 1 1 A 59 59 CYS CA C 59 63.760 62.712 1.048 1
1 713 . 12 1 1 A 59 59 CYS CB C 59 27.638 26.802 0.836 1
1 714 . 12 1 1 A 59 59 CYS N N 59 115.302 120.858 -5.556 1
1 715 . 12 1 1 A 60 60 LYS H H 60 8.350 8.013 0.337 1
1 716 . 12 1 1 A 60 60 LYS HA H 60 3.972 4.089 -0.117 1
1 725 . 12 1 1 A 60 60 LYS C C 60 176.373 178.113 -1.740 1
1 726 . 12 1 1 A 60 60 LYS CA C 60 59.796 59.233 0.563 1
1 727 . 12 1 1 A 60 60 LYS CB C 60 32.560 32.196 0.364 1
1 729 . 12 1 1 A 60 60 LYS N N 60 122.343 121.145 1.198 1
1 730 . 12 1 1 A 61 61 ASP H H 61 8.157 7.919 0.238 1
1 731 . 12 1 1 A 61 61 ASP HA H 61 4.616 4.654 -0.038 1
1 734 . 12 1 1 A 61 61 ASP C C 61 173.246 175.020 -1.774 1
1 735 . 12 1 1 A 61 61 ASP CA C 61 54.272 53.615 0.657 1
1 736 . 12 1 1 A 61 61 ASP CB C 61 41.023 40.641 0.382 1
1 737 . 12 1 1 A 61 61 ASP N N 61 116.173 116.083 0.090 1
1 738 . 12 1 1 A 62 62 ARG H H 62 7.655 7.523 0.132 1
1 739 . 12 1 1 A 62 62 ARG HA H 62 4.149 4.046 0.103 1
1 746 . 12 1 1 A 62 62 ARG C C 62 175.891 175.590 0.301 1
1 747 . 12 1 1 A 62 62 ARG CA C 62 57.381 57.198 0.183 1
1 748 . 12 1 1 A 62 62 ARG CB C 62 26.538 26.930 -0.392 1
1 750 . 12 1 1 A 62 62 ARG N N 62 117.213 115.360 1.853 1
1 751 . 12 1 1 A 63 63 ARG H H 63 8.302 8.084 0.218 1
1 752 . 12 1 1 A 63 63 ARG HA H 63 4.240 4.183 0.057 1
1 757 . 12 1 1 A 63 63 ARG C C 63 175.775 177.980 -2.205 1
1 758 . 12 1 1 A 63 63 ARG CA C 63 55.718 57.664 -1.946 1
1 760 . 12 1 1 A 63 63 ARG N N 63 116.292 118.311 -2.019 1
1 761 . 12 1 1 A 64 64 TRP H H 64 8.161 7.399 0.762 1
1 762 . 12 1 1 A 64 64 TRP HA H 64 3.836 4.384 -0.548 1
1 771 . 12 1 1 A 64 64 TRP C C 64 176.862 178.494 -1.632 1
1 772 . 12 1 1 A 64 64 TRP CA C 64 62.036 60.092 1.944 1
1 773 . 12 1 1 A 64 64 TRP CB C 64 27.028 28.626 -1.598 1
1 779 . 12 1 1 A 64 64 TRP N N 64 121.486 120.076 1.410 1
1 781 . 12 1 1 A 65 65 ALA H H 65 8.954 7.864 1.090 1
1 782 . 12 1 1 A 65 65 ALA HA H 65 4.290 4.102 0.188 1
1 786 . 12 1 1 A 65 65 ALA C C 65 178.986 179.496 -0.510 1
1 787 . 12 1 1 A 65 65 ALA CA C 65 55.314 55.420 -0.106 1
1 788 . 12 1 1 A 65 65 ALA CB C 65 18.119 18.232 -0.113 1
1 789 . 12 1 1 A 65 65 ALA N N 65 121.559 122.702 -1.143 1
1 790 . 12 1 1 A 66 66 ARG H H 66 7.473 7.720 -0.247 1
1 791 . 12 1 1 A 66 66 ARG HA H 66 4.221 4.155 0.066 1
1 798 . 12 1 1 A 66 66 ARG C C 66 176.670 178.351 -1.681 1
1 799 . 12 1 1 A 66 66 ARG CA C 66 57.871 58.682 -0.811 1
1 800 . 12 1 1 A 66 66 ARG CB C 66 29.097 29.685 -0.588 1
1 801 . 12 1 1 A 66 66 ARG N N 66 119.915 117.089 2.826 1
1 802 . 12 1 1 A 67 67 VAL H H 67 7.134 7.519 -0.385 1
1 803 . 12 1 1 A 67 67 VAL HA H 67 3.304 3.691 -0.387 1
1 811 . 12 1 1 A 67 67 VAL C C 67 175.341 178.025 -2.684 1
1 812 . 12 1 1 A 67 67 VAL CA C 67 66.722 66.552 0.170 1
1 813 . 12 1 1 A 67 67 VAL CB C 67 31.108 31.549 -0.441 1
1 816 . 12 1 1 A 67 67 VAL N N 67 119.970 120.892 -0.922 1
1 817 . 12 1 1 A 68 68 ALA H H 68 7.745 8.597 -0.852 1
1 818 . 12 1 1 A 68 68 ALA HA H 68 4.076 4.278 -0.202 1
1 822 . 12 1 1 A 68 68 ALA C C 68 177.358 179.192 -1.834 1
1 823 . 12 1 1 A 68 68 ALA CA C 68 55.607 55.839 -0.232 1
1 824 . 12 1 1 A 68 68 ALA CB C 68 18.061 18.151 -0.090 1
1 825 . 12 1 1 A 68 68 ALA N N 68 118.239 122.202 -3.963 1
1 826 . 12 1 1 A 69 69 GLN H H 69 7.979 8.109 -0.130 1
1 827 . 12 1 1 A 69 69 GLN HA H 69 4.310 3.966 0.344 1
1 834 . 12 1 1 A 69 69 GLN C C 69 179.370 177.992 1.378 1
1 835 . 12 1 1 A 69 69 GLN CA C 69 59.307 59.251 0.056 1
1 836 . 12 1 1 A 69 69 GLN CB C 69 29.257 28.283 0.974 1
1 838 . 12 1 1 A 69 69 GLN N N 69 118.484 117.753 0.731 1
1 840 . 12 1 1 A 70 70 ARG H H 70 8.374 8.163 0.211 1
1 841 . 12 1 1 A 70 70 ARG HA H 70 4.148 4.096 0.052 1
1 848 . 12 1 1 A 70 70 ARG C C 70 175.850 178.327 -2.477 1
1 849 . 12 1 1 A 70 70 ARG CA C 70 58.957 58.942 0.015 1
1 850 . 12 1 1 A 70 70 ARG CB C 70 29.799 29.931 -0.132 1
1 852 . 12 1 1 A 70 70 ARG N N 70 120.309 119.762 0.547 1
1 853 . 12 1 1 A 71 71 LEU H H 71 7.413 7.695 -0.282 1
1 854 . 12 1 1 A 71 71 LEU HA H 71 4.341 4.131 0.210 1
1 864 . 12 1 1 A 71 71 LEU C C 71 173.391 176.199 -2.808 1
1 865 . 12 1 1 A 71 71 LEU CA C 71 54.911 54.553 0.358 1
1 866 . 12 1 1 A 71 71 LEU CB C 71 42.693 41.399 1.294 1
1 867 . 12 1 1 A 71 71 LEU N N 71 118.841 117.711 1.130 1
1 868 . 12 1 1 A 72 72 ASN H H 72 8.038 8.040 -0.002 1
1 869 . 12 1 1 A 72 72 ASN HA H 72 4.394 4.266 0.128 1
1 874 . 12 1 1 A 72 72 ASN C C 72 173.042 173.874 -0.832 1
1 875 . 12 1 1 A 72 72 ASN CB C 72 36.412 37.908 -1.496 1
1 876 . 12 1 1 A 72 72 ASN N N 72 112.919 117.016 -4.097 1
1 878 . 12 1 1 A 73 73 TYR H H 73 7.874 7.956 -0.082 1
1 879 . 12 1 1 A 73 73 TYR HA H 73 4.868 4.579 0.289 1
1 886 . 12 1 1 A 73 73 TYR C C 73 172.194 174.119 -1.925 1
1 887 . 12 1 1 A 73 73 TYR CA C 73 57.105 56.662 0.443 1
1 888 . 12 1 1 A 73 73 TYR CB C 73 37.918 38.341 -0.423 1
1 889 . 12 1 1 A 73 73 TYR N N 73 117.432 120.286 -2.854 1
1 897 . 12 1 1 A 75 75 PRO HA H 75 4.626 4.333 0.293 1
1 902 . 12 1 1 A 75 75 PRO C C 75 175.728 177.176 -1.448 1
1 903 . 12 1 1 A 75 75 PRO CA C 75 62.502 63.707 -1.205 1
1 904 . 12 1 1 A 75 75 PRO CB C 75 32.339 32.402 -0.063 1
1 905 . 12 1 1 A 76 76 GLY H H 76 8.369 8.892 -0.523 1
1 906 . 12 1 1 A 76 76 GLY HA2 H 76 4.057 3.933 0.124 1
1 907 . 12 1 1 A 76 76 GLY HA3 H 76 4.556 3.933 0.623 1
1 908 . 12 1 1 A 76 76 GLY C C 76 173.248 174.829 -1.581 1
1 909 . 12 1 1 A 76 76 GLY CA C 76 46.180 45.297 0.883 1
1 910 . 12 1 1 A 76 76 GLY N N 76 106.185 110.824 -4.639 1
1 911 . 12 1 1 A 77 77 LYS H H 77 8.632 8.686 -0.054 1
1 912 . 12 1 1 A 77 77 LYS HA H 77 4.433 4.157 0.276 1
1 921 . 12 1 1 A 77 77 LYS C C 77 174.924 176.918 -1.994 1
1 922 . 12 1 1 A 77 77 LYS CA C 77 56.453 57.444 -0.991 1
1 923 . 12 1 1 A 77 77 LYS CB C 77 33.170 30.226 2.944 1
1 925 . 12 1 1 A 77 77 LYS N N 77 119.592 119.239 0.353 1
1 926 . 12 1 1 A 78 78 ASN H H 78 8.865 8.046 0.819 1
1 927 . 12 1 1 A 78 78 ASN HA H 78 4.654 4.504 0.150 1
1 932 . 12 1 1 A 78 78 ASN C C 78 174.869 177.637 -2.768 1
1 933 . 12 1 1 A 78 78 ASN CA C 78 54.117 56.764 -2.647 1
1 934 . 12 1 1 A 78 78 ASN CB C 78 37.841 39.253 -1.412 1
1 935 . 12 1 1 A 78 78 ASN N N 78 116.880 119.338 -2.458 1
1 937 . 12 1 1 A 79 79 ILE H H 79 8.008 8.283 -0.275 1
1 938 . 12 1 1 A 79 79 ILE HA H 79 3.718 3.762 -0.044 1
1 948 . 12 1 1 A 79 79 ILE C C 79 175.921 178.384 -2.463 1
1 949 . 12 1 1 A 79 79 ILE CA C 79 63.618 64.589 -0.971 1
1 950 . 12 1 1 A 79 79 ILE CB C 79 37.158 36.897 0.261 1
1 952 . 12 1 1 A 79 79 ILE N N 79 119.688 119.232 0.456 1
1 953 . 12 1 1 A 80 80 GLY H H 80 9.062 8.205 0.857 1
1 954 . 12 1 1 A 80 80 GLY HA2 H 80 3.739 3.760 -0.021 1
1 955 . 12 1 1 A 80 80 GLY HA3 H 80 3.739 3.854 -0.115 1
1 956 . 12 1 1 A 80 80 GLY C C 80 173.185 176.570 -3.385 1
1 957 . 12 1 1 A 80 80 GLY CA C 80 48.166 47.588 0.578 1
1 958 . 12 1 1 A 80 80 GLY N N 80 110.338 109.013 1.325 1
1 959 . 12 1 1 A 81 81 SER H H 81 7.460 7.690 -0.230 1
1 960 . 12 1 1 A 81 81 SER HA H 81 3.904 4.101 -0.197 1
1 963 . 12 1 1 A 81 81 SER C C 81 174.999 176.016 -1.017 1
1 964 . 12 1 1 A 81 81 SER CA C 81 61.138 62.628 -1.490 1
1 965 . 12 1 1 A 81 81 SER CB C 81 62.740 62.867 -0.127 1
1 966 . 12 1 1 A 81 81 SER N N 81 115.348 119.692 -4.344 1
1 967 . 12 1 1 A 82 82 LEU H H 82 7.367 8.115 -0.748 1
1 968 . 12 1 1 A 82 82 LEU HA H 82 3.946 4.040 -0.094 1
1 977 . 12 1 1 A 82 82 LEU C C 82 176.969 178.304 -1.335 1
1 978 . 12 1 1 A 82 82 LEU CA C 82 57.504 58.718 -1.214 1
1 979 . 12 1 1 A 82 82 LEU CB C 82 42.185 41.715 0.470 1
1 980 . 12 1 1 A 82 82 LEU N N 82 124.267 122.604 1.663 1
1 981 . 12 1 1 A 83 83 LEU H H 83 8.330 8.194 0.136 1
1 982 . 12 1 1 A 83 83 LEU HA H 83 3.924 3.944 -0.020 1
1 991 . 12 1 1 A 83 83 LEU C C 83 176.303 178.394 -2.091 1
1 992 . 12 1 1 A 83 83 LEU CA C 83 58.067 58.424 -0.357 1
1 993 . 12 1 1 A 83 83 LEU CB C 83 41.061 41.427 -0.366 1
1 994 . 12 1 1 A 83 83 LEU N N 83 117.452 119.620 -2.168 1
1 995 . 12 1 1 A 84 84 ARG H H 84 7.651 8.279 -0.628 1
1 996 . 12 1 1 A 84 84 ARG HA H 84 2.230 3.690 -1.460 1
1 1003 . 12 1 1 A 84 84 ARG C C 84 175.902 178.145 -2.243 1
1 1004 . 12 1 1 A 84 84 ARG CA C 84 59.112 59.460 -0.348 1
1 1005 . 12 1 1 A 84 84 ARG CB C 84 28.579 29.720 -1.141 1
1 1007 . 12 1 1 A 84 84 ARG N N 84 119.586 119.575 0.011 1
1 1008 . 12 1 1 A 85 85 SER H H 85 7.291 7.764 -0.473 1
1 1009 . 12 1 1 A 85 85 SER HA H 85 4.189 4.165 0.024 1
1 1012 . 12 1 1 A 85 85 SER C C 85 175.546 177.360 -1.814 1
1 1013 . 12 1 1 A 85 85 SER CA C 85 61.376 61.396 -0.020 1
1 1014 . 12 1 1 A 85 85 SER CB C 85 62.805 62.877 -0.072 1
1 1015 . 12 1 1 A 85 85 SER N N 85 112.921 113.764 -0.843 1
1 1016 . 12 1 1 A 86 86 HIS H H 86 8.156 7.620 0.536 1
1 1017 . 12 1 1 A 86 86 HIS HA H 86 4.782 4.199 0.583 1
1 1022 . 12 1 1 A 86 86 HIS C C 86 176.851 177.599 -0.748 1
1 1023 . 12 1 1 A 86 86 HIS CA C 86 58.898 59.731 -0.833 1
1 1024 . 12 1 1 A 86 86 HIS CB C 86 31.110 29.987 1.123 1
1 1027 . 12 1 1 A 86 86 HIS N N 86 119.258 118.628 0.630 1
1 1028 . 12 1 1 A 87 87 TYR H H 87 9.180 8.425 0.755 1
1 1029 . 12 1 1 A 87 87 TYR HA H 87 3.913 3.912 0.001 1
1 1036 . 12 1 1 A 87 87 TYR C C 87 176.841 177.644 -0.803 1
1 1037 . 12 1 1 A 87 87 TYR CA C 87 63.526 61.768 1.758 1
1 1038 . 12 1 1 A 87 87 TYR CB C 87 39.431 38.467 0.964 1
1 1041 . 12 1 1 A 87 87 TYR N N 87 120.625 119.820 0.805 1
1 1042 . 12 1 1 A 88 88 GLU H H 88 9.028 8.220 0.808 1
1 1043 . 12 1 1 A 88 88 GLU HA H 88 3.682 4.169 -0.487 1
1 1048 . 12 1 1 A 88 88 GLU C C 88 175.833 177.782 -1.949 1
1 1049 . 12 1 1 A 88 88 GLU CA C 88 59.730 59.868 -0.138 1
1 1050 . 12 1 1 A 88 88 GLU CB C 88 30.009 29.643 0.366 1
1 1052 . 12 1 1 A 88 88 GLU N N 88 119.531 119.758 -0.227 1
1 1053 . 12 1 1 A 89 89 ARG H H 89 8.052 7.867 0.185 1
1 1054 . 12 1 1 A 89 89 ARG HA H 89 4.292 4.624 -0.332 1
1 1061 . 12 1 1 A 89 89 ARG C C 89 176.045 176.598 -0.553 1
1 1062 . 12 1 1 A 89 89 ARG CA C 89 58.538 56.004 2.534 1
1 1063 . 12 1 1 A 89 89 ARG CB C 89 31.841 31.631 0.210 1
1 1065 . 12 1 1 A 89 89 ARG N N 89 114.741 117.376 -2.635 1
1 1066 . 12 1 1 A 90 90 ILE H H 90 8.141 7.366 0.775 1
1 1067 . 12 1 1 A 90 90 ILE HA H 90 4.296 3.893 0.403 1
1 1075 . 12 1 1 A 90 90 ILE C C 90 174.461 177.005 -2.544 1
1 1076 . 12 1 1 A 90 90 ILE CA C 90 63.649 62.618 1.031 1
1 1077 . 12 1 1 A 90 90 ILE CB C 90 40.626 39.627 0.999 1
1 1079 . 12 1 1 A 90 90 ILE N N 90 113.421 117.325 -3.904 1
1 1080 . 12 1 1 A 91 91 VAL H H 91 7.350 7.828 -0.478 1
1 1081 . 12 1 1 A 91 91 VAL HA H 91 4.144 3.922 0.222 1
1 1089 . 12 1 1 A 91 91 VAL C C 91 175.422 176.390 -0.968 1
1 1090 . 12 1 1 A 91 91 VAL CA C 91 65.042 62.752 2.290 1
1 1091 . 12 1 1 A 91 91 VAL CB C 91 33.215 31.457 1.758 1
1 1092 . 12 1 1 A 91 91 VAL N N 91 118.215 121.055 -2.840 1
1 1093 . 12 1 1 A 92 92 TYR H H 92 8.565 7.923 0.642 1
1 1094 . 12 1 1 A 92 92 TYR HA H 92 4.217 4.523 -0.306 1
1 1099 . 12 1 1 A 92 92 TYR C C 92 171.495 175.396 -3.901 1
1 1100 . 12 1 1 A 92 92 TYR CA C 92 61.558 61.713 -0.155 1
1 1101 . 12 1 1 A 92 92 TYR CB C 92 36.757 37.209 -0.452 1
1 1102 . 12 1 1 A 92 92 TYR N N 92 121.370 122.217 -0.847 1
1 1103 . 12 1 1 A 93 93 PRO HA H 93 4.136 4.322 -0.186 1
1 1108 . 12 1 1 A 93 93 PRO C C 93 177.077 178.587 -1.510 1
1 1109 . 12 1 1 A 93 93 PRO CA C 93 66.037 66.130 -0.093 1
1 1110 . 12 1 1 A 93 93 PRO CB C 93 31.482 30.831 0.651 1
1 1111 . 12 1 1 A 94 94 TYR H H 94 6.517 7.577 -1.060 1
1 1112 . 12 1 1 A 94 94 TYR HA H 94 2.798 4.398 -1.600 1
1 1119 . 12 1 1 A 94 94 TYR C C 94 174.985 178.060 -3.075 1
1 1120 . 12 1 1 A 94 94 TYR CA C 94 59.356 59.482 -0.126 1
1 1121 . 12 1 1 A 94 94 TYR CB C 94 37.987 37.111 0.876 1
1 1124 . 12 1 1 A 94 94 TYR N N 94 115.987 117.159 -1.172 1
1 1125 . 12 1 1 A 95 95 GLU H H 95 8.205 8.446 -0.241 1
1 1126 . 12 1 1 A 95 95 GLU HA H 95 3.682 4.068 -0.386 1
1 1131 . 12 1 1 A 95 95 GLU C C 95 178.530 179.038 -0.508 1
1 1132 . 12 1 1 A 95 95 GLU CA C 95 58.910 59.645 -0.735 1
1 1133 . 12 1 1 A 95 95 GLU CB C 95 29.187 29.047 0.140 1
1 1134 . 12 1 1 A 95 95 GLU N N 95 119.946 121.385 -1.439 1
1 1135 . 12 1 1 A 96 96 MET H H 96 8.248 8.394 -0.146 1
1 1136 . 12 1 1 A 96 96 MET HA H 96 4.172 4.201 -0.029 1
1 1142 . 12 1 1 A 96 96 MET C C 96 176.874 178.220 -1.346 1
1 1143 . 12 1 1 A 96 96 MET CA C 96 57.159 58.581 -1.422 1
1 1144 . 12 1 1 A 96 96 MET CB C 96 31.829 32.526 -0.697 1
1 1146 . 12 1 1 A 96 96 MET N N 96 117.570 118.783 -1.213 1
1 1147 . 12 1 1 A 97 97 TYR H H 97 7.445 8.300 -0.855 1
1 1148 . 12 1 1 A 97 97 TYR HA H 97 4.248 3.947 0.301 1
1 1155 . 12 1 1 A 97 97 TYR C C 97 176.476 177.394 -0.918 1
1 1156 . 12 1 1 A 97 97 TYR CA C 97 60.470 61.785 -1.315 1
1 1157 . 12 1 1 A 97 97 TYR CB C 97 38.612 38.333 0.279 1
1 1160 . 12 1 1 A 97 97 TYR N N 97 122.246 121.957 0.289 1
1 1161 . 12 1 1 A 98 98 GLN H H 98 8.087 8.818 -0.731 1
1 1162 . 12 1 1 A 98 98 GLN HA H 98 3.793 3.660 0.133 1
1 1169 . 12 1 1 A 98 98 GLN C C 98 175.549 178.860 -3.311 1
1 1170 . 12 1 1 A 98 98 GLN CA C 98 57.365 58.927 -1.562 1
1 1171 . 12 1 1 A 98 98 GLN CB C 98 28.901 28.754 0.147 1
1 1173 . 12 1 1 A 98 98 GLN N N 98 118.769 118.489 0.280 1
1 1175 . 12 1 1 A 99 99 SER H H 99 7.724 8.267 -0.543 1
1 1176 . 12 1 1 A 99 99 SER HA H 99 4.293 4.269 0.024 1
1 1179 . 12 1 1 A 99 99 SER C C 99 173.696 177.042 -3.346 1
1 1180 . 12 1 1 A 99 99 SER CA C 99 59.566 62.772 -3.206 1
1 1181 . 12 1 1 A 99 99 SER CB C 99 63.847 62.498 1.349 1
1 1182 . 12 1 1 A 99 99 SER N N 99 113.257 116.941 -3.684 1
1 1183 . 12 1 1 A 100 100 GLY H H 100 7.751 8.292 -0.541 1
1 1184 . 12 1 1 A 100 100 GLY HA2 H 100 3.813 3.859 -0.046 1
1 1185 . 12 1 1 A 100 100 GLY HA3 H 100 3.934 3.865 0.069 1
1 1186 . 12 1 1 A 100 100 GLY C C 100 172.643 176.331 -3.688 1
1 1187 . 12 1 1 A 100 100 GLY CA C 100 45.570 46.999 -1.429 1
1 1188 . 12 1 1 A 100 100 GLY N N 100 109.750 108.533 1.217 1
1 1189 . 12 1 1 A 101 101 ALA H H 101 7.824 7.815 0.009 1
1 1190 . 12 1 1 A 101 101 ALA HA H 101 4.221 3.926 0.295 1
1 1194 . 12 1 1 A 101 101 ALA C C 101 175.639 178.890 -3.251 1
1 1195 . 12 1 1 A 101 101 ALA CA C 101 52.745 54.395 -1.650 1
1 1196 . 12 1 1 A 101 101 ALA CB C 101 19.437 18.123 1.314 1
1 1197 . 12 1 1 A 101 101 ALA N N 101 123.241 124.757 -1.516 1
1 1198 . 12 1 1 A 102 102 ASN H H 102 8.191 7.711 0.480 1
1 1199 . 12 1 1 A 102 102 ASN HA H 102 4.658 4.619 0.039 1
1 1204 . 12 1 1 A 102 102 ASN C C 102 173.337 175.035 -1.698 1
1 1205 . 12 1 1 A 102 102 ASN CA C 102 53.374 55.228 -1.854 1
1 1206 . 12 1 1 A 102 102 ASN CB C 102 38.819 39.269 -0.450 1
1 1207 . 12 1 1 A 102 102 ASN N N 102 116.572 116.632 -0.060 1
1 1209 . 12 1 1 A 103 103 LEU H H 103 8.065 8.011 0.054 1
1 1210 . 12 1 1 A 103 103 LEU HA H 103 4.363 4.596 -0.233 1
1 1219 . 12 1 1 A 103 103 LEU C C 103 175.637 174.564 1.073 1
1 1220 . 12 1 1 A 103 103 LEU CA C 103 55.292 53.891 1.401 1
1 1221 . 12 1 1 A 103 103 LEU CB C 103 42.433 44.859 -2.426 1
1 1222 . 12 1 1 A 103 103 LEU N N 103 122.074 113.383 8.691 1
1 1223 . 12 1 1 A 104 104 VAL H H 104 8.055 9.000 -0.945 1
1 1224 . 12 1 1 A 104 104 VAL HA H 104 4.131 4.506 -0.375 1
1 1232 . 12 1 1 A 104 104 VAL C C 104 174.364 175.689 -1.325 1
1 1233 . 12 1 1 A 104 104 VAL CA C 104 62.552 61.191 1.361 1
1 1234 . 12 1 1 A 104 104 VAL CB C 104 32.766 31.127 1.639 1
1 1235 . 12 1 1 A 104 104 VAL N N 104 120.606 123.126 -2.520 1
1 1236 . 12 1 1 A 105 105 CYS H H 105 8.392 8.172 0.220 1
1 1237 . 12 1 1 A 105 105 CYS HA H 105 4.535 4.957 -0.422 1
1 1240 . 12 1 1 A 105 105 CYS C C 105 172.593 175.300 -2.707 1
1 1241 . 12 1 1 A 105 105 CYS CA C 105 58.449 58.349 0.100 1
1 1242 . 12 1 1 A 105 105 CYS CB C 105 27.952 28.982 -1.030 1
1 1243 . 12 1 1 A 105 105 CYS N N 105 122.791 127.555 -4.764 1
1 1244 . 12 1 1 A 106 106 ASN H H 106 8.575 8.467 0.108 1
1 1245 . 12 1 1 A 106 106 ASN HA H 106 4.843 4.701 0.142 1
1 1250 . 12 1 1 A 106 106 ASN C C 106 173.594 177.533 -3.939 1
1 1251 . 12 1 1 A 106 106 ASN CA C 106 53.337 54.916 -1.579 1
1 1252 . 12 1 1 A 106 106 ASN CB C 106 39.088 38.886 0.202 1
1 1253 . 12 1 1 A 106 106 ASN N N 106 122.001 118.847 3.154 1
1 1255 . 12 1 1 A 107 107 THR H H 107 8.090 8.104 -0.014 1
1 1256 . 12 1 1 A 107 107 THR HA H 107 4.348 4.223 0.125 1
1 1261 . 12 1 1 A 107 107 THR C C 107 172.516 176.731 -4.215 1
1 1262 . 12 1 1 A 107 107 THR CA C 107 61.803 66.990 -5.187 1
1 1263 . 12 1 1 A 107 107 THR CB C 107 69.812 68.127 1.685 1
1 1265 . 12 1 1 A 107 107 THR N N 107 114.374 116.758 -2.384 1
1 1266 . 12 1 1 A 108 108 ARG H H 108 8.322 8.271 0.051 1
1 1267 . 12 1 1 A 108 108 ARG HA H 108 4.634 4.156 0.478 1
1 1274 . 12 1 1 A 108 108 ARG C C 108 172.608 175.982 -3.374 1
1 1275 . 12 1 1 A 108 108 ARG CA C 108 54.026 61.070 -7.044 1
1 1276 . 12 1 1 A 108 108 ARG CB C 108 30.246 28.660 1.586 1
1 1278 . 12 1 1 A 108 108 ARG N N 108 124.017 120.922 3.095 1
1 1279 . 12 1 1 A 109 109 PRO HA H 109 4.354 4.345 0.009 1
1 1286 . 12 1 1 A 109 109 PRO C C 109 174.978 179.272 -4.294 1
1 1287 . 12 1 1 A 109 109 PRO CA C 109 63.396 65.946 -2.550 1
1 1288 . 12 1 1 A 109 109 PRO CB C 109 32.046 30.870 1.176 1
1 1290 . 12 1 1 A 110 110 PHE H H 110 8.123 7.722 0.401 1
1 1291 . 12 1 1 A 110 110 PHE HA H 110 4.619 4.137 0.482 1
1 1296 . 12 1 1 A 110 110 PHE C C 110 173.856 177.276 -3.420 1
1 1297 . 12 1 1 A 110 110 PHE CA C 110 57.353 61.849 -4.496 1
1 1298 . 12 1 1 A 110 110 PHE CB C 110 39.364 39.401 -0.037 1
1 1301 . 12 1 1 A 110 110 PHE N N 110 119.265 118.579 0.686 1
1 1302 . 12 1 1 A 111 111 ASP H H 111 8.161 8.270 -0.109 1
1 1303 . 12 1 1 A 111 111 ASP HA H 111 4.613 4.115 0.498 1
1 1306 . 12 1 1 A 111 111 ASP C C 111 174.114 178.255 -4.141 1
1 1307 . 12 1 1 A 111 111 ASP CA C 111 54.350 57.896 -3.546 1
1 1308 . 12 1 1 A 111 111 ASP CB C 111 41.413 41.760 -0.347 1
1 1309 . 12 1 1 A 111 111 ASP N N 111 121.764 119.146 2.618 1
1 1310 . 12 1 1 A 112 112 ASN H H 112 8.307 8.239 0.068 1
1 1311 . 12 1 1 A 112 112 ASN HA H 112 4.662 4.445 0.217 1
1 1316 . 12 1 1 A 112 112 ASN C C 112 173.595 177.742 -4.147 1
1 1317 . 12 1 1 A 112 112 ASN CA C 112 53.486 56.800 -3.314 1
1 1318 . 12 1 1 A 112 112 ASN CB C 112 39.225 38.640 0.585 1
1 1319 . 12 1 1 A 112 112 ASN N N 112 119.154 117.529 1.625 1
1 1321 . 12 1 1 A 113 113 GLU H H 113 8.404 8.664 -0.260 1
1 1322 . 12 1 1 A 113 113 GLU HA H 113 4.264 4.120 0.144 1
1 1327 . 12 1 1 A 113 113 GLU C C 113 174.886 179.184 -4.298 1
1 1328 . 12 1 1 A 113 113 GLU CA C 113 56.681 59.533 -2.852 1
1 1329 . 12 1 1 A 113 113 GLU CB C 113 30.403 29.306 1.097 1
1 1331 . 12 1 1 A 113 113 GLU N N 113 120.943 119.353 1.590 1
1 1332 . 12 1 1 A 114 114 GLU H H 114 8.388 8.284 0.104 1
1 1333 . 12 1 1 A 114 114 GLU HA H 114 4.262 4.148 0.114 1
1 1338 . 12 1 1 A 114 114 GLU C C 114 174.819 178.858 -4.039 1
1 1339 . 12 1 1 A 114 114 GLU CA C 114 56.769 59.351 -2.582 1
1 1340 . 12 1 1 A 114 114 GLU CB C 114 30.125 29.413 0.712 1
1 1342 . 12 1 1 A 114 114 GLU N N 114 121.869 120.270 1.599 1
1 1343 . 12 1 1 A 115 115 LYS H H 115 8.236 7.641 0.595 1
1 1344 . 12 1 1 A 115 115 LYS HA H 115 4.347 4.274 0.073 1
1 1353 . 12 1 1 A 115 115 LYS C C 115 174.633 176.344 -1.711 1
1 1354 . 12 1 1 A 115 115 LYS CA C 115 56.426 56.419 0.007 1
1 1355 . 12 1 1 A 115 115 LYS CB C 115 33.277 32.733 0.544 1
1 1359 . 12 1 1 A 115 115 LYS N N 115 121.997 117.606 4.391 1
1 1360 . 12 1 1 A 116 116 ASP H H 116 8.386 8.125 0.261 1
1 1361 . 12 1 1 A 116 116 ASP HA H 116 4.600 4.293 0.307 1
1 1364 . 12 1 1 A 116 116 ASP C C 116 173.448 176.278 -2.830 1
1 1365 . 12 1 1 A 116 116 ASP CA C 116 54.773 56.930 -2.157 1
1 1366 . 12 1 1 A 116 116 ASP CB C 116 41.029 38.602 2.427 1
1 1367 . 12 1 1 A 116 116 ASP N N 116 121.057 115.800 5.257 1
1 5 . 13 1 1 A 2 2 MET HA H 2 4.534 4.227 0.307 1
1 13 . 13 1 1 A 2 2 MET C C 2 174.355 178.402 -4.047 1
1 14 . 13 1 1 A 2 2 MET CA C 2 56.247 58.651 -2.404 1
1 15 . 13 1 1 A 2 2 MET CB C 2 32.855 31.718 1.137 1
1 18 . 13 1 1 A 3 3 ASN H H 3 8.600 8.362 0.238 1
1 19 . 13 1 1 A 3 3 ASN HA H 3 4.711 4.499 0.212 1
1 24 . 13 1 1 A 3 3 ASN C C 3 173.983 177.501 -3.518 1
1 25 . 13 1 1 A 3 3 ASN CA C 3 53.650 56.744 -3.094 1
1 26 . 13 1 1 A 3 3 ASN CB C 3 38.624 39.895 -1.271 1
1 27 . 13 1 1 A 3 3 ASN N N 3 120.149 118.904 1.245 1
1 29 . 13 1 1 A 4 4 GLU H H 4 8.495 8.097 0.398 1
1 30 . 13 1 1 A 4 4 GLU HA H 4 4.235 4.057 0.178 1
1 35 . 13 1 1 A 4 4 GLU C C 4 175.752 178.467 -2.715 1
1 36 . 13 1 1 A 4 4 GLU CA C 4 58.075 59.169 -1.094 1
1 37 . 13 1 1 A 4 4 GLU CB C 4 30.125 29.400 0.725 1
1 38 . 13 1 1 A 4 4 GLU N N 4 121.543 118.604 2.939 1
1 39 . 13 1 1 A 5 5 LEU HA H 5 4.073 4.159 -0.086 1
1 47 . 13 1 1 A 5 5 LEU CB C 5 41.897 42.626 -0.729 1
1 50 . 13 1 1 A 6 6 GLU H H 6 8.332 8.444 -0.112 1
1 51 . 13 1 1 A 6 6 GLU HA H 6 3.621 4.184 -0.563 1
1 52 . 13 1 1 A 6 6 GLU C C 6 176.402 178.276 -1.874 1
1 53 . 13 1 1 A 6 6 GLU CA C 6 58.461 57.354 1.107 1
1 54 . 13 1 1 A 6 6 GLU CB C 6 29.730 29.585 0.145 1
1 55 . 13 1 1 A 6 6 GLU N N 6 121.462 118.992 2.470 1
1 56 . 13 1 1 A 7 7 ALA H H 7 8.244 7.754 0.490 1
1 57 . 13 1 1 A 7 7 ALA HA H 7 4.185 4.086 0.099 1
1 61 . 13 1 1 A 7 7 ALA C C 7 177.982 178.210 -0.228 1
1 62 . 13 1 1 A 7 7 ALA CA C 7 54.791 55.536 -0.745 1
1 63 . 13 1 1 A 7 7 ALA CB C 7 18.836 18.964 -0.128 1
1 64 . 13 1 1 A 7 7 ALA N N 7 123.078 122.225 0.853 1
1 65 . 13 1 1 A 8 8 GLN H H 8 8.274 7.808 0.466 1
1 66 . 13 1 1 A 8 8 GLN HA H 8 4.219 4.526 -0.307 1
1 73 . 13 1 1 A 8 8 GLN C C 8 176.325 175.141 1.184 1
1 74 . 13 1 1 A 8 8 GLN CA C 8 57.864 55.683 2.181 1
1 75 . 13 1 1 A 8 8 GLN CB C 8 28.768 29.590 -0.822 1
1 77 . 13 1 1 A 8 8 GLN N N 8 117.452 115.673 1.779 1
1 79 . 13 1 1 A 9 9 THR H H 9 8.043 8.604 -0.561 1
1 80 . 13 1 1 A 9 9 THR HA H 9 3.998 4.745 -0.747 1
1 85 . 13 1 1 A 9 9 THR C C 9 173.904 175.170 -1.266 1
1 86 . 13 1 1 A 9 9 THR CA C 9 65.435 60.632 4.803 1
1 87 . 13 1 1 A 9 9 THR CB C 9 68.870 70.576 -1.706 1
1 89 . 13 1 1 A 9 9 THR N N 9 116.135 118.542 -2.407 1
1 90 . 13 1 1 A 10 10 ARG H H 10 8.095 9.009 -0.914 1
1 91 . 13 1 1 A 10 10 ARG HA H 10 4.040 4.118 -0.078 1
1 98 . 13 1 1 A 10 10 ARG C C 10 176.583 176.195 0.388 1
1 99 . 13 1 1 A 10 10 ARG CA C 10 59.262 57.520 1.742 1
1 100 . 13 1 1 A 10 10 ARG CB C 10 29.900 30.089 -0.189 1
1 101 . 13 1 1 A 10 10 ARG N N 10 121.157 125.097 -3.940 1
1 102 . 13 1 1 A 11 11 VAL H H 11 7.657 7.822 -0.165 1
1 103 . 13 1 1 A 11 11 VAL HA H 11 3.769 4.394 -0.625 1
1 111 . 13 1 1 A 11 11 VAL C C 11 176.662 177.751 -1.089 1
1 112 . 13 1 1 A 11 11 VAL CA C 11 65.914 63.843 2.071 1
1 113 . 13 1 1 A 11 11 VAL CB C 11 31.745 33.479 -1.734 1
1 114 . 13 1 1 A 11 11 VAL N N 11 118.580 118.074 0.506 1
1 115 . 13 1 1 A 12 12 LYS H H 12 7.471 8.446 -0.975 1
1 116 . 13 1 1 A 12 12 LYS HA H 12 3.366 4.364 -0.998 1
1 123 . 13 1 1 A 12 12 LYS C C 12 176.457 179.431 -2.974 1
1 124 . 13 1 1 A 12 12 LYS CA C 12 59.545 59.284 0.261 1
1 125 . 13 1 1 A 12 12 LYS CB C 12 32.206 32.277 -0.071 1
1 126 . 13 1 1 A 12 12 LYS N N 12 121.835 122.753 -0.918 1
1 127 . 13 1 1 A 13 13 LEU H H 13 8.144 7.970 0.174 1
1 128 . 13 1 1 A 13 13 LEU HA H 13 4.093 4.064 0.029 1
1 137 . 13 1 1 A 13 13 LEU C C 13 178.254 178.660 -0.406 1
1 138 . 13 1 1 A 13 13 LEU CA C 13 58.023 58.149 -0.126 1
1 139 . 13 1 1 A 13 13 LEU CB C 13 41.283 41.502 -0.219 1
1 140 . 13 1 1 A 13 13 LEU N N 13 118.688 120.723 -2.035 1
1 141 . 13 1 1 A 14 14 ASN H H 14 8.384 8.383 0.001 1
1 142 . 13 1 1 A 14 14 ASN HA H 14 4.567 4.401 0.166 1
1 147 . 13 1 1 A 14 14 ASN C C 14 175.397 177.067 -1.670 1
1 148 . 13 1 1 A 14 14 ASN CA C 14 56.239 56.373 -0.134 1
1 149 . 13 1 1 A 14 14 ASN CB C 14 38.432 39.604 -1.172 1
1 150 . 13 1 1 A 14 14 ASN N N 14 118.175 117.475 0.700 1
1 152 . 13 1 1 A 15 15 TYR H H 15 7.982 8.188 -0.206 1
1 153 . 13 1 1 A 15 15 TYR HA H 15 4.249 4.020 0.229 1
1 160 . 13 1 1 A 15 15 TYR C C 15 175.503 177.485 -1.982 1
1 161 . 13 1 1 A 15 15 TYR CA C 15 62.450 61.290 1.160 1
1 162 . 13 1 1 A 15 15 TYR CB C 15 39.399 38.509 0.890 1
1 163 . 13 1 1 A 15 15 TYR N N 15 121.955 120.383 1.572 1
1 164 . 13 1 1 A 16 16 LEU H H 16 8.198 8.379 -0.181 1
1 165 . 13 1 1 A 16 16 LEU HA H 16 4.470 3.944 0.526 1
1 175 . 13 1 1 A 16 16 LEU C C 16 177.125 178.241 -1.116 1
1 176 . 13 1 1 A 16 16 LEU CA C 16 57.374 58.186 -0.812 1
1 177 . 13 1 1 A 16 16 LEU CB C 16 41.443 41.559 -0.116 1
1 178 . 13 1 1 A 16 16 LEU N N 16 117.642 121.243 -3.601 1
1 179 . 13 1 1 A 17 17 ASP H H 17 8.061 8.694 -0.633 1
1 180 . 13 1 1 A 17 17 ASP C C 17 177.836 178.818 -0.982 1
1 181 . 13 1 1 A 17 17 ASP CA C 17 57.486 57.459 0.027 1
1 182 . 13 1 1 A 17 17 ASP CB C 17 41.433 40.010 1.423 1
1 183 . 13 1 1 A 17 17 ASP N N 17 118.700 117.880 0.820 1
1 184 . 13 1 1 A 18 18 GLN H H 18 8.111 7.717 0.394 1
1 185 . 13 1 1 A 18 18 GLN HA H 18 4.002 4.085 -0.083 1
1 190 . 13 1 1 A 18 18 GLN CA C 18 59.046 58.892 0.154 1
1 191 . 13 1 1 A 18 18 GLN CB C 18 28.700 28.546 0.154 1
1 193 . 13 1 1 A 18 18 GLN N N 18 119.539 119.018 0.521 1
1 195 . 13 1 1 A 19 19 ILE H H 19 8.330 8.193 0.137 1
1 196 . 13 1 1 A 19 19 ILE HA H 19 3.306 3.806 -0.500 1
1 204 . 13 1 1 A 19 19 ILE C C 19 175.608 177.404 -1.796 1
1 205 . 13 1 1 A 19 19 ILE CA C 19 64.760 62.990 1.770 1
1 206 . 13 1 1 A 19 19 ILE CB C 19 37.148 37.160 -0.012 1
1 209 . 13 1 1 A 19 19 ILE N N 19 121.490 119.976 1.514 1
1 210 . 13 1 1 A 20 20 ALA H H 20 8.057 7.870 0.187 1
1 211 . 13 1 1 A 20 20 ALA HA H 20 4.349 4.376 -0.027 1
1 215 . 13 1 1 A 20 20 ALA C C 20 179.297 179.386 -0.089 1
1 216 . 13 1 1 A 20 20 ALA CA C 20 56.150 54.812 1.338 1
1 217 . 13 1 1 A 20 20 ALA CB C 20 18.104 19.348 -1.244 1
1 218 . 13 1 1 A 20 20 ALA N N 20 124.441 123.958 0.483 1
1 219 . 13 1 1 A 21 21 LYS H H 21 8.116 8.041 0.075 1
1 220 . 13 1 1 A 21 21 LYS HA H 21 4.108 4.073 0.035 1
1 229 . 13 1 1 A 21 21 LYS C C 21 176.720 178.412 -1.692 1
1 230 . 13 1 1 A 21 21 LYS CA C 21 59.166 59.608 -0.442 1
1 231 . 13 1 1 A 21 21 LYS CB C 21 32.085 32.331 -0.246 1
1 233 . 13 1 1 A 21 21 LYS N N 21 119.865 119.412 0.453 1
1 234 . 13 1 1 A 22 22 PHE H H 22 7.875 8.088 -0.213 1
1 235 . 13 1 1 A 22 22 PHE HA H 22 4.012 4.171 -0.159 1
1 242 . 13 1 1 A 22 22 PHE C C 22 175.545 177.313 -1.768 1
1 243 . 13 1 1 A 22 22 PHE CA C 22 61.070 61.308 -0.238 1
1 244 . 13 1 1 A 22 22 PHE CB C 22 39.072 38.832 0.240 1
1 249 . 13 1 1 A 22 22 PHE N N 22 119.729 120.006 -0.277 1
1 250 . 13 1 1 A 23 23 TRP H H 23 7.841 8.338 -0.497 1
1 251 . 13 1 1 A 23 23 TRP HA H 23 4.149 4.040 0.109 1
1 260 . 13 1 1 A 23 23 TRP C C 23 176.668 177.911 -1.243 1
1 261 . 13 1 1 A 23 23 TRP CB C 23 28.543 29.776 -1.233 1
1 267 . 13 1 1 A 23 23 TRP N N 23 119.440 120.766 -1.326 1
1 269 . 13 1 1 A 24 24 GLU H H 24 8.261 8.288 -0.027 1
1 270 . 13 1 1 A 24 24 GLU HA H 24 4.265 4.244 0.021 1
1 275 . 13 1 1 A 24 24 GLU C C 24 179.679 179.516 0.163 1
1 276 . 13 1 1 A 24 24 GLU CA C 24 59.706 59.003 0.703 1
1 277 . 13 1 1 A 24 24 GLU CB C 24 29.720 29.475 0.245 1
1 279 . 13 1 1 A 24 24 GLU N N 24 121.376 118.584 2.792 1
1 280 . 13 1 1 A 25 25 ILE H H 25 8.071 7.814 0.257 1
1 281 . 13 1 1 A 25 25 ILE HA H 25 3.815 3.729 0.086 1
1 291 . 13 1 1 A 25 25 ILE C C 25 176.343 177.812 -1.469 1
1 292 . 13 1 1 A 25 25 ILE CA C 25 64.464 62.895 1.569 1
1 293 . 13 1 1 A 25 25 ILE CB C 25 37.371 37.144 0.227 1
1 296 . 13 1 1 A 25 25 ILE N N 25 121.499 119.711 1.788 1
1 297 . 13 1 1 A 26 26 GLN H H 26 7.327 7.263 0.064 1
1 298 . 13 1 1 A 26 26 GLN HA H 26 4.074 4.034 0.040 1
1 305 . 13 1 1 A 26 26 GLN C C 26 174.906 175.710 -0.804 1
1 306 . 13 1 1 A 26 26 GLN CA C 26 55.450 55.885 -0.435 1
1 307 . 13 1 1 A 26 26 GLN CB C 26 28.458 28.843 -0.385 1
1 309 . 13 1 1 A 26 26 GLN N N 26 116.532 120.024 -3.492 1
1 311 . 13 1 1 A 27 27 GLY H H 27 7.861 8.157 -0.296 1
1 312 . 13 1 1 A 27 27 GLY HA2 H 27 4.297 3.802 0.495 1
1 313 . 13 1 1 A 27 27 GLY HA3 H 27 3.823 3.804 0.019 1
1 314 . 13 1 1 A 27 27 GLY C C 27 172.698 173.144 -0.446 1
1 315 . 13 1 1 A 27 27 GLY CA C 27 45.608 45.177 0.431 1
1 316 . 13 1 1 A 27 27 GLY N N 27 106.837 108.075 -1.238 1
1 317 . 13 1 1 A 28 28 SER H H 28 8.083 6.873 1.210 1
1 318 . 13 1 1 A 28 28 SER HA H 28 4.777 4.445 0.332 1
1 321 . 13 1 1 A 28 28 SER C C 28 171.196 171.375 -0.179 1
1 322 . 13 1 1 A 28 28 SER CA C 28 56.041 55.822 0.219 1
1 323 . 13 1 1 A 28 28 SER CB C 28 64.539 63.960 0.579 1
1 324 . 13 1 1 A 28 28 SER N N 28 116.151 114.273 1.878 1
1 325 . 13 1 1 A 29 29 SER H H 29 8.354 8.608 -0.254 1
1 326 . 13 1 1 A 29 29 SER HA H 29 4.389 5.153 -0.764 1
1 329 . 13 1 1 A 29 29 SER C C 29 172.166 172.619 -0.453 1
1 330 . 13 1 1 A 29 29 SER CA C 29 58.107 56.343 1.764 1
1 331 . 13 1 1 A 29 29 SER CB C 29 63.853 65.975 -2.122 1
1 332 . 13 1 1 A 29 29 SER N N 29 116.596 117.070 -0.474 1
1 333 . 13 1 1 A 30 30 LEU H H 30 8.990 8.570 0.420 1
1 334 . 13 1 1 A 30 30 LEU HA H 30 3.964 5.009 -1.045 1
1 344 . 13 1 1 A 30 30 LEU C C 30 173.752 175.697 -1.945 1
1 345 . 13 1 1 A 30 30 LEU CA C 30 55.193 56.023 -0.830 1
1 346 . 13 1 1 A 30 30 LEU CB C 30 42.869 42.597 0.272 1
1 349 . 13 1 1 A 30 30 LEU N N 30 125.860 128.016 -2.156 1
1 350 . 13 1 1 A 31 31 LYS H H 31 8.118 8.812 -0.694 1
1 351 . 13 1 1 A 31 31 LYS HA H 31 4.498 4.927 -0.429 1
1 360 . 13 1 1 A 31 31 LYS C C 31 173.555 174.708 -1.153 1
1 361 . 13 1 1 A 31 31 LYS CA C 31 54.372 55.207 -0.835 1
1 362 . 13 1 1 A 31 31 LYS CB C 31 32.814 35.411 -2.597 1
1 365 . 13 1 1 A 31 31 LYS N N 31 129.965 127.381 2.584 1
1 366 . 13 1 1 A 32 32 ILE H H 32 8.717 8.893 -0.176 1
1 367 . 13 1 1 A 32 32 ILE HA H 32 4.011 4.925 -0.914 1
1 377 . 13 1 1 A 32 32 ILE C C 32 173.038 175.270 -2.232 1
1 378 . 13 1 1 A 32 32 ILE CA C 32 59.921 57.240 2.681 1
1 379 . 13 1 1 A 32 32 ILE CB C 32 38.139 40.492 -2.353 1
1 382 . 13 1 1 A 32 32 ILE N N 32 127.091 122.803 4.288 1
1 383 . 13 1 1 A 33 33 PRO HA H 33 4.412 4.621 -0.209 1
1 390 . 13 1 1 A 33 33 PRO C C 33 172.724 175.797 -3.073 1
1 391 . 13 1 1 A 33 33 PRO CA C 33 62.565 62.182 0.383 1
1 392 . 13 1 1 A 33 33 PRO CB C 33 32.728 32.868 -0.140 1
1 394 . 13 1 1 A 34 34 ASN H H 34 8.265 8.551 -0.286 1
1 395 . 13 1 1 A 34 34 ASN HA H 34 5.147 5.443 -0.296 1
1 400 . 13 1 1 A 34 34 ASN C C 34 174.079 173.418 0.661 1
1 401 . 13 1 1 A 34 34 ASN CA C 34 52.088 51.413 0.675 1
1 402 . 13 1 1 A 34 34 ASN CB C 34 40.387 42.359 -1.972 1
1 403 . 13 1 1 A 34 34 ASN N N 34 116.424 115.750 0.674 1
1 405 . 13 1 1 A 35 35 VAL H H 35 8.904 9.106 -0.202 1
1 406 . 13 1 1 A 35 35 VAL HA H 35 4.159 4.478 -0.319 1
1 414 . 13 1 1 A 35 35 VAL C C 35 173.834 174.889 -1.055 1
1 415 . 13 1 1 A 35 35 VAL CA C 35 61.953 59.839 2.114 1
1 416 . 13 1 1 A 35 35 VAL CB C 35 34.432 34.625 -0.193 1
1 419 . 13 1 1 A 35 35 VAL N N 35 122.778 118.544 4.234 1
1 420 . 13 1 1 A 36 36 GLU H H 36 9.560 9.449 0.111 1
1 421 . 13 1 1 A 36 36 GLU HA H 36 3.819 4.015 -0.196 1
1 426 . 13 1 1 A 36 36 GLU C C 36 173.604 175.855 -2.251 1
1 427 . 13 1 1 A 36 36 GLU CA C 36 57.131 58.016 -0.885 1
1 428 . 13 1 1 A 36 36 GLU CB C 36 27.464 28.079 -0.615 1
1 430 . 13 1 1 A 36 36 GLU N N 36 127.014 128.630 -1.616 1
1 431 . 13 1 1 A 37 37 ARG H H 37 8.578 8.465 0.113 1
1 432 . 13 1 1 A 37 37 ARG HA H 37 3.792 3.913 -0.121 1
1 439 . 13 1 1 A 37 37 ARG C C 37 173.371 174.315 -0.944 1
1 440 . 13 1 1 A 37 37 ARG CA C 37 57.952 57.729 0.223 1
1 441 . 13 1 1 A 37 37 ARG CB C 37 27.657 27.634 0.023 1
1 443 . 13 1 1 A 37 37 ARG N N 37 108.362 110.769 -2.407 1
1 444 . 13 1 1 A 38 38 ARG H H 38 7.696 7.984 -0.288 1
1 445 . 13 1 1 A 38 38 ARG HA H 38 4.743 4.944 -0.201 1
1 452 . 13 1 1 A 38 38 ARG C C 38 173.513 175.449 -1.936 1
1 453 . 13 1 1 A 38 38 ARG CA C 38 54.507 54.617 -0.110 1
1 454 . 13 1 1 A 38 38 ARG CB C 38 33.751 33.421 0.330 1
1 456 . 13 1 1 A 38 38 ARG N N 38 118.370 119.194 -0.824 1
1 457 . 13 1 1 A 39 39 ILE H H 39 8.463 8.434 0.029 1
1 458 . 13 1 1 A 39 39 ILE HA H 39 4.184 4.212 -0.028 1
1 468 . 13 1 1 A 39 39 ILE C C 39 175.150 175.944 -0.794 1
1 469 . 13 1 1 A 39 39 ILE CA C 39 62.076 61.938 0.138 1
1 470 . 13 1 1 A 39 39 ILE CB C 39 38.864 39.366 -0.502 1
1 473 . 13 1 1 A 39 39 ILE N N 39 123.604 126.334 -2.730 1
1 474 . 13 1 1 A 40 40 LEU H H 40 8.239 8.188 0.051 1
1 475 . 13 1 1 A 40 40 LEU HA H 40 4.259 4.672 -0.413 1
1 485 . 13 1 1 A 40 40 LEU C C 40 173.152 174.600 -1.448 1
1 486 . 13 1 1 A 40 40 LEU CA C 40 55.305 54.730 0.575 1
1 487 . 13 1 1 A 40 40 LEU CB C 40 43.113 41.740 1.373 1
1 490 . 13 1 1 A 40 40 LEU N N 40 129.550 128.942 0.608 1
1 491 . 13 1 1 A 41 41 ASP H H 41 8.992 8.606 0.386 1
1 492 . 13 1 1 A 41 41 ASP HA H 41 4.798 4.751 0.047 1
1 495 . 13 1 1 A 41 41 ASP C C 41 173.837 176.201 -2.364 1
1 496 . 13 1 1 A 41 41 ASP CA C 41 52.077 53.801 -1.724 1
1 497 . 13 1 1 A 41 41 ASP CB C 41 39.454 39.230 0.224 1
1 498 . 13 1 1 A 41 41 ASP N N 41 127.022 127.564 -0.542 1
1 499 . 13 1 1 A 42 42 LEU H H 42 7.912 8.236 -0.324 1
1 500 . 13 1 1 A 42 42 LEU HA H 42 3.970 4.128 -0.158 1
1 510 . 13 1 1 A 42 42 LEU C C 42 176.305 177.566 -1.261 1
1 511 . 13 1 1 A 42 42 LEU CA C 42 58.128 57.914 0.214 1
1 512 . 13 1 1 A 42 42 LEU CB C 42 43.043 41.608 1.435 1
1 514 . 13 1 1 A 42 42 LEU N N 42 125.064 126.278 -1.214 1
1 515 . 13 1 1 A 43 43 TYR H H 43 8.565 8.440 0.125 1
1 516 . 13 1 1 A 43 43 TYR HA H 43 3.728 3.648 0.080 1
1 523 . 13 1 1 A 43 43 TYR C C 43 175.757 176.978 -1.221 1
1 524 . 13 1 1 A 43 43 TYR CA C 43 61.774 61.548 0.226 1
1 525 . 13 1 1 A 43 43 TYR CB C 43 38.235 38.053 0.182 1
1 528 . 13 1 1 A 43 43 TYR N N 43 117.822 120.031 -2.209 1
1 529 . 13 1 1 A 44 44 SER H H 44 8.115 8.192 -0.077 1
1 530 . 13 1 1 A 44 44 SER HA H 44 3.854 4.077 -0.223 1
1 533 . 13 1 1 A 44 44 SER C C 44 174.080 175.949 -1.869 1
1 534 . 13 1 1 A 44 44 SER CA C 44 61.873 61.849 0.024 1
1 535 . 13 1 1 A 44 44 SER CB C 44 64.350 62.895 1.455 1
1 536 . 13 1 1 A 44 44 SER N N 44 116.835 115.919 0.916 1
1 537 . 13 1 1 A 45 45 LEU H H 45 8.401 8.241 0.160 1
1 538 . 13 1 1 A 45 45 LEU HA H 45 4.102 4.139 -0.037 1
1 548 . 13 1 1 A 45 45 LEU C C 45 175.081 179.137 -4.056 1
1 549 . 13 1 1 A 45 45 LEU CA C 45 58.896 57.900 0.996 1
1 550 . 13 1 1 A 45 45 LEU CB C 45 41.741 41.730 0.011 1
1 553 . 13 1 1 A 45 45 LEU N N 45 120.621 123.215 -2.594 1
1 554 . 13 1 1 A 46 46 SER H H 46 8.110 8.353 -0.243 1
1 555 . 13 1 1 A 46 46 SER HA H 46 4.300 4.231 0.069 1
1 558 . 13 1 1 A 46 46 SER C C 46 175.019 176.685 -1.666 1
1 559 . 13 1 1 A 46 46 SER CA C 46 62.610 62.053 0.557 1
1 560 . 13 1 1 A 46 46 SER CB C 46 64.092 62.944 1.148 1
1 561 . 13 1 1 A 46 46 SER N N 46 112.826 116.866 -4.040 1
1 562 . 13 1 1 A 47 47 LYS H H 47 7.732 7.967 -0.235 1
1 563 . 13 1 1 A 47 47 LYS HA H 47 3.900 4.132 -0.232 1
1 572 . 13 1 1 A 47 47 LYS C C 47 177.441 178.971 -1.530 1
1 573 . 13 1 1 A 47 47 LYS CA C 47 58.575 58.994 -0.419 1
1 574 . 13 1 1 A 47 47 LYS CB C 47 32.351 31.908 0.443 1
1 576 . 13 1 1 A 47 47 LYS N N 47 121.210 119.588 1.622 1
1 577 . 13 1 1 A 48 48 ILE H H 48 8.672 7.857 0.815 1
1 578 . 13 1 1 A 48 48 ILE HA H 48 3.628 3.667 -0.039 1
1 588 . 13 1 1 A 48 48 ILE C C 48 175.861 177.844 -1.983 1
1 589 . 13 1 1 A 48 48 ILE CA C 48 64.188 65.094 -0.906 1
1 590 . 13 1 1 A 48 48 ILE CB C 48 37.954 37.741 0.213 1
1 593 . 13 1 1 A 48 48 ILE N N 48 120.810 121.164 -0.354 1
1 594 . 13 1 1 A 49 49 VAL H H 49 8.030 8.291 -0.261 1
1 595 . 13 1 1 A 49 49 VAL HA H 49 3.195 3.626 -0.431 1
1 603 . 13 1 1 A 49 49 VAL C C 49 176.513 178.510 -1.997 1
1 604 . 13 1 1 A 49 49 VAL CA C 49 66.760 66.896 -0.136 1
1 605 . 13 1 1 A 49 49 VAL CB C 49 30.935 31.883 -0.948 1
1 608 . 13 1 1 A 49 49 VAL N N 49 119.350 119.787 -0.437 1
1 609 . 13 1 1 A 50 50 VAL H H 50 7.336 8.233 -0.897 1
1 610 . 13 1 1 A 50 50 VAL HA H 50 3.497 3.599 -0.102 1
1 618 . 13 1 1 A 50 50 VAL C C 50 178.745 178.579 0.166 1
1 619 . 13 1 1 A 50 50 VAL CA C 50 67.384 66.708 0.676 1
1 620 . 13 1 1 A 50 50 VAL CB C 50 31.832 31.514 0.318 1
1 621 . 13 1 1 A 50 50 VAL N N 50 118.610 120.656 -2.046 1
1 622 . 13 1 1 A 51 51 GLU H H 51 8.318 8.197 0.121 1
1 623 . 13 1 1 A 51 51 GLU HA H 51 3.953 4.046 -0.093 1
1 628 . 13 1 1 A 51 51 GLU C C 51 177.281 178.207 -0.926 1
1 629 . 13 1 1 A 51 51 GLU CA C 51 59.668 58.717 0.951 1
1 630 . 13 1 1 A 51 51 GLU CB C 51 30.131 29.220 0.911 1
1 632 . 13 1 1 A 51 51 GLU N N 51 122.096 119.703 2.393 1
1 633 . 13 1 1 A 52 52 GLU H H 52 8.065 8.119 -0.054 1
1 634 . 13 1 1 A 52 52 GLU HA H 52 4.229 4.310 -0.081 1
1 639 . 13 1 1 A 52 52 GLU C C 52 173.534 176.674 -3.140 1
1 640 . 13 1 1 A 52 52 GLU CA C 52 55.547 56.329 -0.782 1
1 641 . 13 1 1 A 52 52 GLU CB C 52 28.716 30.383 -1.667 1
1 643 . 13 1 1 A 52 52 GLU N N 52 114.992 116.347 -1.355 1
1 644 . 13 1 1 A 53 53 GLY H H 53 7.459 9.068 -1.609 1
1 645 . 13 1 1 A 53 53 GLY HA2 H 53 3.630 3.954 -0.324 1
1 646 . 13 1 1 A 53 53 GLY HA3 H 53 3.630 3.972 -0.342 1
1 647 . 13 1 1 A 53 53 GLY C C 53 173.214 173.673 -0.459 1
1 648 . 13 1 1 A 53 53 GLY CA C 53 44.962 45.157 -0.195 1
1 649 . 13 1 1 A 53 53 GLY N N 53 104.909 107.630 -2.721 1
1 650 . 13 1 1 A 54 54 GLY H H 54 8.533 7.197 1.336 1
1 651 . 13 1 1 A 54 54 GLY HA2 H 54 3.548 4.061 -0.513 1
1 652 . 13 1 1 A 54 54 GLY HA3 H 54 4.521 4.105 0.416 1
1 653 . 13 1 1 A 54 54 GLY C C 54 169.966 174.542 -4.576 1
1 654 . 13 1 1 A 54 54 GLY CA C 54 43.988 45.707 -1.719 1
1 655 . 13 1 1 A 54 54 GLY N N 54 110.587 108.162 2.425 1
1 656 . 13 1 1 A 55 55 TYR H H 55 8.704 8.625 0.079 1
1 657 . 13 1 1 A 55 55 TYR HA H 55 3.618 3.981 -0.363 1
1 664 . 13 1 1 A 55 55 TYR C C 55 174.807 176.990 -2.183 1
1 665 . 13 1 1 A 55 55 TYR CA C 55 62.540 61.730 0.810 1
1 666 . 13 1 1 A 55 55 TYR CB C 55 39.669 39.322 0.347 1
1 669 . 13 1 1 A 55 55 TYR N N 55 119.168 122.137 -2.969 1
1 670 . 13 1 1 A 56 56 GLU H H 56 9.006 8.335 0.671 1
1 671 . 13 1 1 A 56 56 GLU HA H 56 3.638 3.606 0.032 1
1 676 . 13 1 1 A 56 56 GLU C C 56 177.400 178.336 -0.936 1
1 677 . 13 1 1 A 56 56 GLU CA C 56 60.530 59.413 1.117 1
1 678 . 13 1 1 A 56 56 GLU CB C 56 29.168 29.391 -0.223 1
1 679 . 13 1 1 A 56 56 GLU N N 56 118.969 117.769 1.200 1
1 680 . 13 1 1 A 57 57 ALA H H 57 8.235 7.827 0.408 1
1 681 . 13 1 1 A 57 57 ALA HA H 57 3.980 4.000 -0.020 1
1 685 . 13 1 1 A 57 57 ALA C C 57 177.678 179.662 -1.984 1
1 686 . 13 1 1 A 57 57 ALA CA C 57 54.910 55.159 -0.249 1
1 687 . 13 1 1 A 57 57 ALA CB C 57 18.122 18.326 -0.204 1
1 688 . 13 1 1 A 57 57 ALA N N 57 122.860 121.634 1.226 1
1 689 . 13 1 1 A 58 58 ILE H H 58 7.831 7.470 0.361 1
1 690 . 13 1 1 A 58 58 ILE HA H 58 3.189 3.310 -0.121 1
1 700 . 13 1 1 A 58 58 ILE C C 58 177.818 178.102 -0.284 1
1 701 . 13 1 1 A 58 58 ILE CA C 58 65.074 64.277 0.797 1
1 702 . 13 1 1 A 58 58 ILE CB C 58 38.178 36.319 1.859 1
1 706 . 13 1 1 A 58 58 ILE N N 58 117.418 117.435 -0.017 1
1 707 . 13 1 1 A 59 59 CYS H H 59 7.760 7.881 -0.121 1
1 708 . 13 1 1 A 59 59 CYS HA H 59 4.203 4.069 0.134 1
1 711 . 13 1 1 A 59 59 CYS C C 59 176.357 176.883 -0.526 1
1 712 . 13 1 1 A 59 59 CYS CA C 59 63.760 63.304 0.456 1
1 713 . 13 1 1 A 59 59 CYS CB C 59 27.638 27.572 0.066 1
1 714 . 13 1 1 A 59 59 CYS N N 59 115.302 119.887 -4.585 1
1 715 . 13 1 1 A 60 60 LYS H H 60 8.350 8.372 -0.022 1
1 716 . 13 1 1 A 60 60 LYS HA H 60 3.972 4.009 -0.037 1
1 725 . 13 1 1 A 60 60 LYS C C 60 176.373 177.776 -1.403 1
1 726 . 13 1 1 A 60 60 LYS CA C 60 59.796 58.891 0.905 1
1 727 . 13 1 1 A 60 60 LYS CB C 60 32.560 31.900 0.660 1
1 729 . 13 1 1 A 60 60 LYS N N 60 122.343 119.674 2.669 1
1 730 . 13 1 1 A 61 61 ASP H H 61 8.157 7.641 0.516 1
1 731 . 13 1 1 A 61 61 ASP HA H 61 4.616 4.608 0.008 1
1 734 . 13 1 1 A 61 61 ASP C C 61 173.246 175.462 -2.216 1
1 735 . 13 1 1 A 61 61 ASP CA C 61 54.272 55.134 -0.862 1
1 736 . 13 1 1 A 61 61 ASP CB C 61 41.023 41.235 -0.212 1
1 737 . 13 1 1 A 61 61 ASP N N 61 116.173 118.176 -2.003 1
1 738 . 13 1 1 A 62 62 ARG H H 62 7.655 7.459 0.196 1
1 739 . 13 1 1 A 62 62 ARG HA H 62 4.149 3.967 0.182 1
1 746 . 13 1 1 A 62 62 ARG C C 62 175.891 175.541 0.350 1
1 747 . 13 1 1 A 62 62 ARG CA C 62 57.381 57.138 0.243 1
1 748 . 13 1 1 A 62 62 ARG CB C 62 26.538 26.995 -0.457 1
1 750 . 13 1 1 A 62 62 ARG N N 62 117.213 116.302 0.911 1
1 751 . 13 1 1 A 63 63 ARG H H 63 8.302 8.012 0.290 1
1 752 . 13 1 1 A 63 63 ARG HA H 63 4.240 4.146 0.094 1
1 757 . 13 1 1 A 63 63 ARG C C 63 175.775 177.993 -2.218 1
1 758 . 13 1 1 A 63 63 ARG CA C 63 55.718 57.763 -2.045 1
1 760 . 13 1 1 A 63 63 ARG N N 63 116.292 118.128 -1.836 1
1 761 . 13 1 1 A 64 64 TRP H H 64 8.161 7.310 0.851 1
1 762 . 13 1 1 A 64 64 TRP HA H 64 3.836 4.390 -0.554 1
1 771 . 13 1 1 A 64 64 TRP C C 64 176.862 178.434 -1.572 1
1 772 . 13 1 1 A 64 64 TRP CA C 64 62.036 60.053 1.983 1
1 773 . 13 1 1 A 64 64 TRP CB C 64 27.028 28.480 -1.452 1
1 779 . 13 1 1 A 64 64 TRP N N 64 121.486 120.060 1.426 1
1 781 . 13 1 1 A 65 65 ALA H H 65 8.954 7.884 1.070 1
1 782 . 13 1 1 A 65 65 ALA HA H 65 4.290 4.022 0.268 1
1 786 . 13 1 1 A 65 65 ALA C C 65 178.986 179.678 -0.692 1
1 787 . 13 1 1 A 65 65 ALA CA C 65 55.314 55.493 -0.179 1
1 788 . 13 1 1 A 65 65 ALA CB C 65 18.119 18.098 0.021 1
1 789 . 13 1 1 A 65 65 ALA N N 65 121.559 123.019 -1.460 1
1 790 . 13 1 1 A 66 66 ARG H H 66 7.473 7.546 -0.073 1
1 791 . 13 1 1 A 66 66 ARG HA H 66 4.221 4.122 0.099 1
1 798 . 13 1 1 A 66 66 ARG C C 66 176.670 178.219 -1.549 1
1 799 . 13 1 1 A 66 66 ARG CA C 66 57.871 59.042 -1.171 1
1 800 . 13 1 1 A 66 66 ARG CB C 66 29.097 29.834 -0.737 1
1 801 . 13 1 1 A 66 66 ARG N N 66 119.915 119.307 0.608 1
1 802 . 13 1 1 A 67 67 VAL H H 67 7.134 7.451 -0.317 1
1 803 . 13 1 1 A 67 67 VAL HA H 67 3.304 3.984 -0.680 1
1 811 . 13 1 1 A 67 67 VAL C C 67 175.341 178.111 -2.770 1
1 812 . 13 1 1 A 67 67 VAL CA C 67 66.722 63.691 3.031 1
1 813 . 13 1 1 A 67 67 VAL CB C 67 31.108 32.179 -1.071 1
1 816 . 13 1 1 A 67 67 VAL N N 67 119.970 118.766 1.204 1
1 817 . 13 1 1 A 68 68 ALA H H 68 7.745 8.411 -0.666 1
1 818 . 13 1 1 A 68 68 ALA HA H 68 4.076 4.327 -0.251 1
1 822 . 13 1 1 A 68 68 ALA C C 68 177.358 180.389 -3.031 1
1 823 . 13 1 1 A 68 68 ALA CA C 68 55.607 56.021 -0.414 1
1 824 . 13 1 1 A 68 68 ALA CB C 68 18.061 18.534 -0.473 1
1 825 . 13 1 1 A 68 68 ALA N N 68 118.239 124.632 -6.393 1
1 826 . 13 1 1 A 69 69 GLN H H 69 7.979 8.368 -0.389 1
1 827 . 13 1 1 A 69 69 GLN HA H 69 4.310 4.120 0.190 1
1 834 . 13 1 1 A 69 69 GLN C C 69 179.370 178.520 0.850 1
1 835 . 13 1 1 A 69 69 GLN CA C 69 59.307 58.246 1.061 1
1 836 . 13 1 1 A 69 69 GLN CB C 69 29.257 28.532 0.725 1
1 838 . 13 1 1 A 69 69 GLN N N 69 118.484 116.914 1.570 1
1 840 . 13 1 1 A 70 70 ARG H H 70 8.374 8.043 0.331 1
1 841 . 13 1 1 A 70 70 ARG HA H 70 4.148 4.117 0.031 1
1 848 . 13 1 1 A 70 70 ARG C C 70 175.850 177.960 -2.110 1
1 849 . 13 1 1 A 70 70 ARG CA C 70 58.957 58.537 0.420 1
1 850 . 13 1 1 A 70 70 ARG CB C 70 29.799 30.014 -0.215 1
1 852 . 13 1 1 A 70 70 ARG N N 70 120.309 120.735 -0.426 1
1 853 . 13 1 1 A 71 71 LEU H H 71 7.413 7.717 -0.304 1
1 854 . 13 1 1 A 71 71 LEU HA H 71 4.341 4.144 0.197 1
1 864 . 13 1 1 A 71 71 LEU C C 71 173.391 175.546 -2.155 1
1 865 . 13 1 1 A 71 71 LEU CA C 71 54.911 54.591 0.320 1
1 866 . 13 1 1 A 71 71 LEU CB C 71 42.693 41.477 1.216 1
1 867 . 13 1 1 A 71 71 LEU N N 71 118.841 117.516 1.325 1
1 868 . 13 1 1 A 72 72 ASN H H 72 8.038 7.694 0.344 1
1 869 . 13 1 1 A 72 72 ASN HA H 72 4.394 4.318 0.076 1
1 874 . 13 1 1 A 72 72 ASN C C 72 173.042 174.182 -1.140 1
1 875 . 13 1 1 A 72 72 ASN CB C 72 36.412 36.839 -0.427 1
1 876 . 13 1 1 A 72 72 ASN N N 72 112.919 114.442 -1.523 1
1 878 . 13 1 1 A 73 73 TYR H H 73 7.874 7.846 0.028 1
1 879 . 13 1 1 A 73 73 TYR HA H 73 4.868 4.633 0.235 1
1 886 . 13 1 1 A 73 73 TYR C C 73 172.194 174.092 -1.898 1
1 887 . 13 1 1 A 73 73 TYR CA C 73 57.105 56.728 0.377 1
1 888 . 13 1 1 A 73 73 TYR CB C 73 37.918 38.293 -0.375 1
1 889 . 13 1 1 A 73 73 TYR N N 73 117.432 118.996 -1.564 1
1 897 . 13 1 1 A 75 75 PRO HA H 75 4.626 4.258 0.368 1
1 902 . 13 1 1 A 75 75 PRO C C 75 175.728 177.193 -1.465 1
1 903 . 13 1 1 A 75 75 PRO CA C 75 62.502 63.681 -1.179 1
1 904 . 13 1 1 A 75 75 PRO CB C 75 32.339 32.387 -0.048 1
1 905 . 13 1 1 A 76 76 GLY H H 76 8.369 8.900 -0.531 1
1 906 . 13 1 1 A 76 76 GLY HA2 H 76 4.057 3.891 0.166 1
1 907 . 13 1 1 A 76 76 GLY HA3 H 76 4.556 3.891 0.665 1
1 908 . 13 1 1 A 76 76 GLY C C 76 173.248 174.848 -1.600 1
1 909 . 13 1 1 A 76 76 GLY CA C 76 46.180 45.414 0.766 1
1 910 . 13 1 1 A 76 76 GLY N N 76 106.185 110.839 -4.654 1
1 911 . 13 1 1 A 77 77 LYS H H 77 8.632 8.463 0.169 1
1 912 . 13 1 1 A 77 77 LYS HA H 77 4.433 4.201 0.232 1
1 921 . 13 1 1 A 77 77 LYS C C 77 174.924 176.954 -2.030 1
1 922 . 13 1 1 A 77 77 LYS CA C 77 56.453 57.876 -1.423 1
1 923 . 13 1 1 A 77 77 LYS CB C 77 33.170 32.455 0.715 1
1 925 . 13 1 1 A 77 77 LYS N N 77 119.592 119.837 -0.245 1
1 926 . 13 1 1 A 78 78 ASN H H 78 8.865 8.450 0.415 1
1 927 . 13 1 1 A 78 78 ASN HA H 78 4.654 4.484 0.170 1
1 932 . 13 1 1 A 78 78 ASN C C 78 174.869 177.285 -2.416 1
1 933 . 13 1 1 A 78 78 ASN CA C 78 54.117 55.974 -1.857 1
1 934 . 13 1 1 A 78 78 ASN CB C 78 37.841 39.285 -1.444 1
1 935 . 13 1 1 A 78 78 ASN N N 78 116.880 116.528 0.352 1
1 937 . 13 1 1 A 79 79 ILE H H 79 8.008 8.247 -0.239 1
1 938 . 13 1 1 A 79 79 ILE HA H 79 3.718 3.699 0.019 1
1 948 . 13 1 1 A 79 79 ILE C C 79 175.921 178.354 -2.433 1
1 949 . 13 1 1 A 79 79 ILE CA C 79 63.618 64.649 -1.031 1
1 950 . 13 1 1 A 79 79 ILE CB C 79 37.158 37.280 -0.122 1
1 952 . 13 1 1 A 79 79 ILE N N 79 119.688 119.305 0.383 1
1 953 . 13 1 1 A 80 80 GLY H H 80 9.062 8.333 0.729 1
1 954 . 13 1 1 A 80 80 GLY HA2 H 80 3.739 3.834 -0.095 1
1 955 . 13 1 1 A 80 80 GLY HA3 H 80 3.739 3.899 -0.160 1
1 956 . 13 1 1 A 80 80 GLY C C 80 173.185 176.518 -3.333 1
1 957 . 13 1 1 A 80 80 GLY CA C 80 48.166 47.616 0.550 1
1 958 . 13 1 1 A 80 80 GLY N N 80 110.338 109.054 1.284 1
1 959 . 13 1 1 A 81 81 SER H H 81 7.460 7.955 -0.495 1
1 960 . 13 1 1 A 81 81 SER HA H 81 3.904 4.121 -0.217 1
1 963 . 13 1 1 A 81 81 SER C C 81 174.999 176.048 -1.049 1
1 964 . 13 1 1 A 81 81 SER CA C 81 61.138 62.583 -1.445 1
1 965 . 13 1 1 A 81 81 SER CB C 81 62.740 62.899 -0.159 1
1 966 . 13 1 1 A 81 81 SER N N 81 115.348 119.743 -4.395 1
1 967 . 13 1 1 A 82 82 LEU H H 82 7.367 7.691 -0.324 1
1 968 . 13 1 1 A 82 82 LEU HA H 82 3.946 4.065 -0.119 1
1 977 . 13 1 1 A 82 82 LEU C C 82 176.969 178.174 -1.205 1
1 978 . 13 1 1 A 82 82 LEU CA C 82 57.504 58.475 -0.971 1
1 979 . 13 1 1 A 82 82 LEU CB C 82 42.185 41.543 0.642 1
1 980 . 13 1 1 A 82 82 LEU N N 82 124.267 122.778 1.489 1
1 981 . 13 1 1 A 83 83 LEU H H 83 8.330 8.112 0.218 1
1 982 . 13 1 1 A 83 83 LEU HA H 83 3.924 3.962 -0.038 1
1 991 . 13 1 1 A 83 83 LEU C C 83 176.303 178.366 -2.063 1
1 992 . 13 1 1 A 83 83 LEU CA C 83 58.067 58.520 -0.453 1
1 993 . 13 1 1 A 83 83 LEU CB C 83 41.061 41.425 -0.364 1
1 994 . 13 1 1 A 83 83 LEU N N 83 117.452 119.706 -2.254 1
1 995 . 13 1 1 A 84 84 ARG H H 84 7.651 8.298 -0.647 1
1 996 . 13 1 1 A 84 84 ARG HA H 84 2.230 3.603 -1.373 1
1 1003 . 13 1 1 A 84 84 ARG C C 84 175.902 178.114 -2.212 1
1 1004 . 13 1 1 A 84 84 ARG CA C 84 59.112 59.442 -0.330 1
1 1005 . 13 1 1 A 84 84 ARG CB C 84 28.579 29.843 -1.264 1
1 1007 . 13 1 1 A 84 84 ARG N N 84 119.586 119.651 -0.065 1
1 1008 . 13 1 1 A 85 85 SER H H 85 7.291 7.866 -0.575 1
1 1009 . 13 1 1 A 85 85 SER HA H 85 4.189 4.156 0.033 1
1 1012 . 13 1 1 A 85 85 SER C C 85 175.546 177.312 -1.766 1
1 1013 . 13 1 1 A 85 85 SER CA C 85 61.376 61.406 -0.030 1
1 1014 . 13 1 1 A 85 85 SER CB C 85 62.805 62.871 -0.066 1
1 1015 . 13 1 1 A 85 85 SER N N 85 112.921 113.896 -0.975 1
1 1016 . 13 1 1 A 86 86 HIS H H 86 8.156 7.546 0.610 1
1 1017 . 13 1 1 A 86 86 HIS HA H 86 4.782 4.174 0.608 1
1 1022 . 13 1 1 A 86 86 HIS C C 86 176.851 177.564 -0.713 1
1 1023 . 13 1 1 A 86 86 HIS CA C 86 58.898 59.425 -0.527 1
1 1024 . 13 1 1 A 86 86 HIS CB C 86 31.110 29.991 1.119 1
1 1027 . 13 1 1 A 86 86 HIS N N 86 119.258 118.694 0.564 1
1 1028 . 13 1 1 A 87 87 TYR H H 87 9.180 8.316 0.864 1
1 1029 . 13 1 1 A 87 87 TYR HA H 87 3.913 3.906 0.007 1
1 1036 . 13 1 1 A 87 87 TYR C C 87 176.841 177.839 -0.998 1
1 1037 . 13 1 1 A 87 87 TYR CA C 87 63.526 61.245 2.281 1
1 1038 . 13 1 1 A 87 87 TYR CB C 87 39.431 38.417 1.014 1
1 1041 . 13 1 1 A 87 87 TYR N N 87 120.625 120.105 0.520 1
1 1042 . 13 1 1 A 88 88 GLU H H 88 9.028 8.574 0.454 1
1 1043 . 13 1 1 A 88 88 GLU HA H 88 3.682 3.996 -0.314 1
1 1048 . 13 1 1 A 88 88 GLU C C 88 175.833 178.147 -2.314 1
1 1049 . 13 1 1 A 88 88 GLU CA C 88 59.730 59.511 0.219 1
1 1050 . 13 1 1 A 88 88 GLU CB C 88 30.009 29.562 0.447 1
1 1052 . 13 1 1 A 88 88 GLU N N 88 119.531 119.956 -0.425 1
1 1053 . 13 1 1 A 89 89 ARG H H 89 8.052 7.942 0.110 1
1 1054 . 13 1 1 A 89 89 ARG HA H 89 4.292 4.511 -0.219 1
1 1061 . 13 1 1 A 89 89 ARG C C 89 176.045 177.703 -1.658 1
1 1062 . 13 1 1 A 89 89 ARG CA C 89 58.538 57.455 1.083 1
1 1063 . 13 1 1 A 89 89 ARG CB C 89 31.841 31.470 0.371 1
1 1065 . 13 1 1 A 89 89 ARG N N 89 114.741 118.337 -3.596 1
1 1066 . 13 1 1 A 90 90 ILE H H 90 8.141 8.185 -0.044 1
1 1067 . 13 1 1 A 90 90 ILE HA H 90 4.296 3.329 0.967 1
1 1075 . 13 1 1 A 90 90 ILE C C 90 174.461 176.760 -2.299 1
1 1076 . 13 1 1 A 90 90 ILE CA C 90 63.649 63.947 -0.298 1
1 1077 . 13 1 1 A 90 90 ILE CB C 90 40.626 38.310 2.316 1
1 1079 . 13 1 1 A 90 90 ILE N N 90 113.421 119.700 -6.279 1
1 1080 . 13 1 1 A 91 91 VAL H H 91 7.350 7.181 0.169 1
1 1081 . 13 1 1 A 91 91 VAL HA H 91 4.144 3.843 0.301 1
1 1089 . 13 1 1 A 91 91 VAL C C 91 175.422 176.740 -1.318 1
1 1090 . 13 1 1 A 91 91 VAL CA C 91 65.042 63.537 1.505 1
1 1091 . 13 1 1 A 91 91 VAL CB C 91 33.215 31.649 1.566 1
1 1092 . 13 1 1 A 91 91 VAL N N 91 118.215 120.995 -2.780 1
1 1093 . 13 1 1 A 92 92 TYR H H 92 8.565 8.137 0.428 1
1 1094 . 13 1 1 A 92 92 TYR HA H 92 4.217 4.327 -0.110 1
1 1099 . 13 1 1 A 92 92 TYR C C 92 171.495 174.884 -3.389 1
1 1100 . 13 1 1 A 92 92 TYR CA C 92 61.558 62.445 -0.887 1
1 1101 . 13 1 1 A 92 92 TYR CB C 92 36.757 37.055 -0.298 1
1 1102 . 13 1 1 A 92 92 TYR N N 92 121.370 121.896 -0.526 1
1 1103 . 13 1 1 A 93 93 PRO HA H 93 4.136 4.389 -0.253 1
1 1108 . 13 1 1 A 93 93 PRO C C 93 177.077 178.652 -1.575 1
1 1109 . 13 1 1 A 93 93 PRO CA C 93 66.037 65.989 0.048 1
1 1110 . 13 1 1 A 93 93 PRO CB C 93 31.482 31.113 0.369 1
1 1111 . 13 1 1 A 94 94 TYR H H 94 6.517 7.458 -0.941 1
1 1112 . 13 1 1 A 94 94 TYR HA H 94 2.798 4.327 -1.529 1
1 1119 . 13 1 1 A 94 94 TYR C C 94 174.985 178.134 -3.149 1
1 1120 . 13 1 1 A 94 94 TYR CA C 94 59.356 59.786 -0.430 1
1 1121 . 13 1 1 A 94 94 TYR CB C 94 37.987 37.407 0.580 1
1 1124 . 13 1 1 A 94 94 TYR N N 94 115.987 117.599 -1.612 1
1 1125 . 13 1 1 A 95 95 GLU H H 95 8.205 8.266 -0.061 1
1 1126 . 13 1 1 A 95 95 GLU HA H 95 3.682 4.126 -0.444 1
1 1131 . 13 1 1 A 95 95 GLU C C 95 178.530 179.047 -0.517 1
1 1132 . 13 1 1 A 95 95 GLU CA C 95 58.910 59.626 -0.716 1
1 1133 . 13 1 1 A 95 95 GLU CB C 95 29.187 29.284 -0.097 1
1 1134 . 13 1 1 A 95 95 GLU N N 95 119.946 121.412 -1.466 1
1 1135 . 13 1 1 A 96 96 MET H H 96 8.248 8.211 0.037 1
1 1136 . 13 1 1 A 96 96 MET HA H 96 4.172 4.209 -0.037 1
1 1142 . 13 1 1 A 96 96 MET C C 96 176.874 178.357 -1.483 1
1 1143 . 13 1 1 A 96 96 MET CA C 96 57.159 58.751 -1.592 1
1 1144 . 13 1 1 A 96 96 MET CB C 96 31.829 32.342 -0.513 1
1 1146 . 13 1 1 A 96 96 MET N N 96 117.570 119.058 -1.488 1
1 1147 . 13 1 1 A 97 97 TYR H H 97 7.445 8.328 -0.883 1
1 1148 . 13 1 1 A 97 97 TYR HA H 97 4.248 4.063 0.185 1
1 1155 . 13 1 1 A 97 97 TYR C C 97 176.476 177.742 -1.266 1
1 1156 . 13 1 1 A 97 97 TYR CA C 97 60.470 61.480 -1.010 1
1 1157 . 13 1 1 A 97 97 TYR CB C 97 38.612 38.163 0.449 1
1 1160 . 13 1 1 A 97 97 TYR N N 97 122.246 121.831 0.415 1
1 1161 . 13 1 1 A 98 98 GLN H H 98 8.087 8.667 -0.580 1
1 1162 . 13 1 1 A 98 98 GLN HA H 98 3.793 3.553 0.240 1
1 1169 . 13 1 1 A 98 98 GLN C C 98 175.549 178.144 -2.595 1
1 1170 . 13 1 1 A 98 98 GLN CA C 98 57.365 59.010 -1.645 1
1 1171 . 13 1 1 A 98 98 GLN CB C 98 28.901 28.521 0.380 1
1 1173 . 13 1 1 A 98 98 GLN N N 98 118.769 118.481 0.288 1
1 1175 . 13 1 1 A 99 99 SER H H 99 7.724 8.509 -0.785 1
1 1176 . 13 1 1 A 99 99 SER HA H 99 4.293 4.166 0.127 1
1 1179 . 13 1 1 A 99 99 SER C C 99 173.696 177.144 -3.448 1
1 1180 . 13 1 1 A 99 99 SER CA C 99 59.566 61.294 -1.728 1
1 1181 . 13 1 1 A 99 99 SER CB C 99 63.847 62.285 1.562 1
1 1182 . 13 1 1 A 99 99 SER N N 99 113.257 114.512 -1.255 1
1 1183 . 13 1 1 A 100 100 GLY H H 100 7.751 8.322 -0.571 1
1 1184 . 13 1 1 A 100 100 GLY HA2 H 100 3.813 3.916 -0.103 1
1 1185 . 13 1 1 A 100 100 GLY HA3 H 100 3.934 3.926 0.008 1
1 1186 . 13 1 1 A 100 100 GLY C C 100 172.643 176.101 -3.458 1
1 1187 . 13 1 1 A 100 100 GLY CA C 100 45.570 46.893 -1.323 1
1 1188 . 13 1 1 A 100 100 GLY N N 100 109.750 110.146 -0.396 1
1 1189 . 13 1 1 A 101 101 ALA H H 101 7.824 7.982 -0.158 1
1 1190 . 13 1 1 A 101 101 ALA HA H 101 4.221 4.090 0.131 1
1 1194 . 13 1 1 A 101 101 ALA C C 101 175.639 178.820 -3.181 1
1 1195 . 13 1 1 A 101 101 ALA CA C 101 52.745 54.236 -1.491 1
1 1196 . 13 1 1 A 101 101 ALA CB C 101 19.437 18.367 1.070 1
1 1197 . 13 1 1 A 101 101 ALA N N 101 123.241 124.074 -0.833 1
1 1198 . 13 1 1 A 102 102 ASN H H 102 8.191 7.993 0.198 1
1 1199 . 13 1 1 A 102 102 ASN HA H 102 4.658 4.734 -0.076 1
1 1204 . 13 1 1 A 102 102 ASN C C 102 173.337 175.605 -2.268 1
1 1205 . 13 1 1 A 102 102 ASN CA C 102 53.374 55.074 -1.700 1
1 1206 . 13 1 1 A 102 102 ASN CB C 102 38.819 39.414 -0.595 1
1 1207 . 13 1 1 A 102 102 ASN N N 102 116.572 114.177 2.395 1
1 1209 . 13 1 1 A 103 103 LEU H H 103 8.065 7.608 0.457 1
1 1210 . 13 1 1 A 103 103 LEU HA H 103 4.363 4.618 -0.255 1
1 1219 . 13 1 1 A 103 103 LEU C C 103 175.637 174.606 1.031 1
1 1220 . 13 1 1 A 103 103 LEU CA C 103 55.292 53.657 1.635 1
1 1221 . 13 1 1 A 103 103 LEU CB C 103 42.433 44.839 -2.406 1
1 1222 . 13 1 1 A 103 103 LEU N N 103 122.074 114.649 7.425 1
1 1223 . 13 1 1 A 104 104 VAL H H 104 8.055 9.044 -0.989 1
1 1224 . 13 1 1 A 104 104 VAL HA H 104 4.131 4.618 -0.487 1
1 1232 . 13 1 1 A 104 104 VAL C C 104 174.364 175.496 -1.132 1
1 1233 . 13 1 1 A 104 104 VAL CA C 104 62.552 60.888 1.664 1
1 1234 . 13 1 1 A 104 104 VAL CB C 104 32.766 32.884 -0.118 1
1 1235 . 13 1 1 A 104 104 VAL N N 104 120.606 123.757 -3.151 1
1 1236 . 13 1 1 A 105 105 CYS H H 105 8.392 8.945 -0.553 1
1 1237 . 13 1 1 A 105 105 CYS HA H 105 4.535 4.671 -0.136 1
1 1240 . 13 1 1 A 105 105 CYS C C 105 172.593 175.269 -2.676 1
1 1241 . 13 1 1 A 105 105 CYS CA C 105 58.449 58.792 -0.343 1
1 1242 . 13 1 1 A 105 105 CYS CB C 105 27.952 29.078 -1.126 1
1 1243 . 13 1 1 A 105 105 CYS N N 105 122.791 129.345 -6.554 1
1 1244 . 13 1 1 A 106 106 ASN H H 106 8.575 8.143 0.432 1
1 1245 . 13 1 1 A 106 106 ASN HA H 106 4.843 4.783 0.060 1
1 1250 . 13 1 1 A 106 106 ASN C C 106 173.594 176.483 -2.889 1
1 1251 . 13 1 1 A 106 106 ASN CA C 106 53.337 52.711 0.626 1
1 1252 . 13 1 1 A 106 106 ASN CB C 106 39.088 37.785 1.303 1
1 1253 . 13 1 1 A 106 106 ASN N N 106 122.001 116.682 5.319 1
1 1255 . 13 1 1 A 107 107 THR H H 107 8.090 7.826 0.264 1
1 1256 . 13 1 1 A 107 107 THR HA H 107 4.348 3.920 0.428 1
1 1261 . 13 1 1 A 107 107 THR C C 107 172.516 176.306 -3.790 1
1 1262 . 13 1 1 A 107 107 THR CA C 107 61.803 67.137 -5.334 1
1 1263 . 13 1 1 A 107 107 THR CB C 107 69.812 68.686 1.126 1
1 1265 . 13 1 1 A 107 107 THR N N 107 114.374 115.588 -1.214 1
1 1266 . 13 1 1 A 108 108 ARG H H 108 8.322 7.819 0.503 1
1 1267 . 13 1 1 A 108 108 ARG HA H 108 4.634 4.207 0.427 1
1 1274 . 13 1 1 A 108 108 ARG C C 108 172.608 176.560 -3.952 1
1 1275 . 13 1 1 A 108 108 ARG CA C 108 54.026 60.744 -6.718 1
1 1276 . 13 1 1 A 108 108 ARG CB C 108 30.246 30.301 -0.055 1
1 1278 . 13 1 1 A 108 108 ARG N N 108 124.017 120.745 3.272 1
1 1279 . 13 1 1 A 109 109 PRO HA H 109 4.354 4.399 -0.045 1
1 1286 . 13 1 1 A 109 109 PRO C C 109 174.978 178.929 -3.951 1
1 1287 . 13 1 1 A 109 109 PRO CA C 109 63.396 65.659 -2.263 1
1 1288 . 13 1 1 A 109 109 PRO CB C 109 32.046 31.055 0.991 1
1 1290 . 13 1 1 A 110 110 PHE H H 110 8.123 7.821 0.302 1
1 1291 . 13 1 1 A 110 110 PHE HA H 110 4.619 4.228 0.391 1
1 1296 . 13 1 1 A 110 110 PHE C C 110 173.856 176.902 -3.046 1
1 1297 . 13 1 1 A 110 110 PHE CA C 110 57.353 61.956 -4.603 1
1 1298 . 13 1 1 A 110 110 PHE CB C 110 39.364 39.317 0.047 1
1 1301 . 13 1 1 A 110 110 PHE N N 110 119.265 118.690 0.575 1
1 1302 . 13 1 1 A 111 111 ASP H H 111 8.161 8.393 -0.232 1
1 1303 . 13 1 1 A 111 111 ASP HA H 111 4.613 4.445 0.168 1
1 1306 . 13 1 1 A 111 111 ASP C C 111 174.114 178.948 -4.834 1
1 1307 . 13 1 1 A 111 111 ASP CA C 111 54.350 57.464 -3.114 1
1 1308 . 13 1 1 A 111 111 ASP CB C 111 41.413 40.085 1.328 1
1 1309 . 13 1 1 A 111 111 ASP N N 111 121.764 119.683 2.081 1
1 1310 . 13 1 1 A 112 112 ASN H H 112 8.307 8.058 0.249 1
1 1311 . 13 1 1 A 112 112 ASN HA H 112 4.662 4.487 0.175 1
1 1316 . 13 1 1 A 112 112 ASN C C 112 173.595 177.248 -3.653 1
1 1317 . 13 1 1 A 112 112 ASN CA C 112 53.486 56.010 -2.524 1
1 1318 . 13 1 1 A 112 112 ASN CB C 112 39.225 38.703 0.522 1
1 1319 . 13 1 1 A 112 112 ASN N N 112 119.154 117.779 1.375 1
1 1321 . 13 1 1 A 113 113 GLU H H 113 8.404 7.775 0.629 1
1 1322 . 13 1 1 A 113 113 GLU HA H 113 4.264 4.244 0.020 1
1 1327 . 13 1 1 A 113 113 GLU C C 113 174.886 178.657 -3.771 1
1 1328 . 13 1 1 A 113 113 GLU CA C 113 56.681 58.635 -1.954 1
1 1329 . 13 1 1 A 113 113 GLU CB C 113 30.403 30.253 0.150 1
1 1331 . 13 1 1 A 113 113 GLU N N 113 120.943 119.318 1.625 1
1 1332 . 13 1 1 A 114 114 GLU H H 114 8.388 8.531 -0.143 1
1 1333 . 13 1 1 A 114 114 GLU HA H 114 4.262 4.271 -0.009 1
1 1338 . 13 1 1 A 114 114 GLU C C 114 174.819 176.674 -1.855 1
1 1339 . 13 1 1 A 114 114 GLU CA C 114 56.769 59.322 -2.553 1
1 1340 . 13 1 1 A 114 114 GLU CB C 114 30.125 29.830 0.295 1
1 1342 . 13 1 1 A 114 114 GLU N N 114 121.869 120.528 1.341 1
1 1343 . 13 1 1 A 115 115 LYS H H 115 8.236 8.429 -0.193 1
1 1344 . 13 1 1 A 115 115 LYS HA H 115 4.347 4.502 -0.155 1
1 1353 . 13 1 1 A 115 115 LYS C C 115 174.633 174.241 0.392 1
1 1354 . 13 1 1 A 115 115 LYS CA C 115 56.426 54.798 1.628 1
1 1355 . 13 1 1 A 115 115 LYS CB C 115 33.277 32.538 0.739 1
1 1359 . 13 1 1 A 115 115 LYS N N 115 121.997 117.339 4.658 1
1 1360 . 13 1 1 A 116 116 ASP H H 116 8.386 8.984 -0.598 1
1 1361 . 13 1 1 A 116 116 ASP HA H 116 4.600 4.730 -0.130 1
1 1364 . 13 1 1 A 116 116 ASP C C 116 173.448 174.738 -1.290 1
1 1365 . 13 1 1 A 116 116 ASP CA C 116 54.773 53.209 1.564 1
1 1366 . 13 1 1 A 116 116 ASP CB C 116 41.029 39.300 1.729 1
1 1367 . 13 1 1 A 116 116 ASP N N 116 121.057 125.859 -4.802 1
1 5 . 14 1 1 A 2 2 MET HA H 2 4.534 4.251 0.283 1
1 13 . 14 1 1 A 2 2 MET C C 2 174.355 178.176 -3.821 1
1 14 . 14 1 1 A 2 2 MET CA C 2 56.247 57.788 -1.541 1
1 15 . 14 1 1 A 2 2 MET CB C 2 32.855 32.444 0.411 1
1 18 . 14 1 1 A 3 3 ASN H H 3 8.600 8.112 0.488 1
1 19 . 14 1 1 A 3 3 ASN HA H 3 4.711 4.405 0.306 1
1 24 . 14 1 1 A 3 3 ASN C C 3 173.983 178.220 -4.237 1
1 25 . 14 1 1 A 3 3 ASN CA C 3 53.650 56.316 -2.666 1
1 26 . 14 1 1 A 3 3 ASN CB C 3 38.624 38.172 0.452 1
1 27 . 14 1 1 A 3 3 ASN N N 3 120.149 116.868 3.281 1
1 29 . 14 1 1 A 4 4 GLU H H 4 8.495 7.722 0.773 1
1 30 . 14 1 1 A 4 4 GLU HA H 4 4.235 4.043 0.192 1
1 35 . 14 1 1 A 4 4 GLU C C 4 175.752 178.685 -2.933 1
1 36 . 14 1 1 A 4 4 GLU CA C 4 58.075 59.173 -1.098 1
1 37 . 14 1 1 A 4 4 GLU CB C 4 30.125 29.311 0.814 1
1 38 . 14 1 1 A 4 4 GLU N N 4 121.543 119.830 1.713 1
1 39 . 14 1 1 A 5 5 LEU HA H 5 4.073 4.157 -0.084 1
1 47 . 14 1 1 A 5 5 LEU CB C 5 41.897 42.600 -0.703 1
1 50 . 14 1 1 A 6 6 GLU H H 6 8.332 8.516 -0.184 1
1 51 . 14 1 1 A 6 6 GLU HA H 6 3.621 4.170 -0.549 1
1 52 . 14 1 1 A 6 6 GLU C C 6 176.402 179.347 -2.945 1
1 53 . 14 1 1 A 6 6 GLU CA C 6 58.461 59.089 -0.628 1
1 54 . 14 1 1 A 6 6 GLU CB C 6 29.730 28.986 0.744 1
1 55 . 14 1 1 A 6 6 GLU N N 6 121.462 118.717 2.745 1
1 56 . 14 1 1 A 7 7 ALA H H 7 8.244 7.774 0.470 1
1 57 . 14 1 1 A 7 7 ALA HA H 7 4.185 4.134 0.051 1
1 61 . 14 1 1 A 7 7 ALA C C 7 177.982 178.147 -0.165 1
1 62 . 14 1 1 A 7 7 ALA CA C 7 54.791 54.753 0.038 1
1 63 . 14 1 1 A 7 7 ALA CB C 7 18.836 18.729 0.107 1
1 64 . 14 1 1 A 7 7 ALA N N 7 123.078 121.304 1.774 1
1 65 . 14 1 1 A 8 8 GLN H H 8 8.274 7.826 0.448 1
1 66 . 14 1 1 A 8 8 GLN HA H 8 4.219 4.504 -0.285 1
1 73 . 14 1 1 A 8 8 GLN C C 8 176.325 175.216 1.109 1
1 74 . 14 1 1 A 8 8 GLN CA C 8 57.864 55.626 2.238 1
1 75 . 14 1 1 A 8 8 GLN CB C 8 28.768 29.536 -0.768 1
1 77 . 14 1 1 A 8 8 GLN N N 8 117.452 116.099 1.353 1
1 79 . 14 1 1 A 9 9 THR H H 9 8.043 8.667 -0.624 1
1 80 . 14 1 1 A 9 9 THR HA H 9 3.998 4.780 -0.782 1
1 85 . 14 1 1 A 9 9 THR C C 9 173.904 174.256 -0.352 1
1 86 . 14 1 1 A 9 9 THR CA C 9 65.435 60.400 5.035 1
1 87 . 14 1 1 A 9 9 THR CB C 9 68.870 70.750 -1.880 1
1 89 . 14 1 1 A 9 9 THR N N 9 116.135 118.432 -2.297 1
1 90 . 14 1 1 A 10 10 ARG H H 10 8.095 8.929 -0.834 1
1 91 . 14 1 1 A 10 10 ARG HA H 10 4.040 4.035 0.005 1
1 98 . 14 1 1 A 10 10 ARG C C 10 176.583 175.603 0.980 1
1 99 . 14 1 1 A 10 10 ARG CA C 10 59.262 57.407 1.855 1
1 100 . 14 1 1 A 10 10 ARG CB C 10 29.900 27.550 2.350 1
1 101 . 14 1 1 A 10 10 ARG N N 10 121.157 121.126 0.031 1
1 102 . 14 1 1 A 11 11 VAL H H 11 7.657 7.849 -0.192 1
1 103 . 14 1 1 A 11 11 VAL HA H 11 3.769 4.406 -0.637 1
1 111 . 14 1 1 A 11 11 VAL C C 11 176.662 177.706 -1.044 1
1 112 . 14 1 1 A 11 11 VAL CA C 11 65.914 64.190 1.724 1
1 113 . 14 1 1 A 11 11 VAL CB C 11 31.745 33.444 -1.699 1
1 114 . 14 1 1 A 11 11 VAL N N 11 118.580 117.764 0.816 1
1 115 . 14 1 1 A 12 12 LYS H H 12 7.471 8.258 -0.787 1
1 116 . 14 1 1 A 12 12 LYS HA H 12 3.366 4.506 -1.140 1
1 123 . 14 1 1 A 12 12 LYS C C 12 176.457 178.279 -1.822 1
1 124 . 14 1 1 A 12 12 LYS CA C 12 59.545 57.428 2.117 1
1 125 . 14 1 1 A 12 12 LYS CB C 12 32.206 32.626 -0.420 1
1 126 . 14 1 1 A 12 12 LYS N N 12 121.835 121.679 0.156 1
1 127 . 14 1 1 A 13 13 LEU H H 13 8.144 7.880 0.264 1
1 128 . 14 1 1 A 13 13 LEU HA H 13 4.093 4.253 -0.160 1
1 137 . 14 1 1 A 13 13 LEU C C 13 178.254 179.423 -1.169 1
1 138 . 14 1 1 A 13 13 LEU CA C 13 58.023 56.950 1.073 1
1 139 . 14 1 1 A 13 13 LEU CB C 13 41.283 41.337 -0.054 1
1 140 . 14 1 1 A 13 13 LEU N N 13 118.688 118.399 0.289 1
1 141 . 14 1 1 A 14 14 ASN H H 14 8.384 8.371 0.013 1
1 142 . 14 1 1 A 14 14 ASN HA H 14 4.567 4.431 0.136 1
1 147 . 14 1 1 A 14 14 ASN C C 14 175.397 177.586 -2.189 1
1 148 . 14 1 1 A 14 14 ASN CA C 14 56.239 56.539 -0.300 1
1 149 . 14 1 1 A 14 14 ASN CB C 14 38.432 38.446 -0.014 1
1 150 . 14 1 1 A 14 14 ASN N N 14 118.175 118.549 -0.374 1
1 152 . 14 1 1 A 15 15 TYR H H 15 7.982 8.010 -0.028 1
1 153 . 14 1 1 A 15 15 TYR HA H 15 4.249 4.107 0.142 1
1 160 . 14 1 1 A 15 15 TYR C C 15 175.503 177.461 -1.958 1
1 161 . 14 1 1 A 15 15 TYR CA C 15 62.450 61.512 0.938 1
1 162 . 14 1 1 A 15 15 TYR CB C 15 39.399 38.481 0.918 1
1 163 . 14 1 1 A 15 15 TYR N N 15 121.955 122.690 -0.735 1
1 164 . 14 1 1 A 16 16 LEU H H 16 8.198 8.446 -0.248 1
1 165 . 14 1 1 A 16 16 LEU HA H 16 4.470 3.977 0.493 1
1 175 . 14 1 1 A 16 16 LEU C C 16 177.125 178.114 -0.989 1
1 176 . 14 1 1 A 16 16 LEU CA C 16 57.374 58.168 -0.794 1
1 177 . 14 1 1 A 16 16 LEU CB C 16 41.443 41.389 0.054 1
1 178 . 14 1 1 A 16 16 LEU N N 16 117.642 121.174 -3.532 1
1 179 . 14 1 1 A 17 17 ASP H H 17 8.061 8.332 -0.271 1
1 180 . 14 1 1 A 17 17 ASP C C 17 177.836 178.107 -0.271 1
1 181 . 14 1 1 A 17 17 ASP CA C 17 57.486 57.760 -0.274 1
1 182 . 14 1 1 A 17 17 ASP CB C 17 41.433 42.007 -0.574 1
1 183 . 14 1 1 A 17 17 ASP N N 17 118.700 118.846 -0.146 1
1 184 . 14 1 1 A 18 18 GLN H H 18 8.111 8.156 -0.045 1
1 185 . 14 1 1 A 18 18 GLN HA H 18 4.002 4.122 -0.120 1
1 190 . 14 1 1 A 18 18 GLN CA C 18 59.046 58.742 0.304 1
1 191 . 14 1 1 A 18 18 GLN CB C 18 28.700 27.952 0.748 1
1 193 . 14 1 1 A 18 18 GLN N N 18 119.539 117.057 2.482 1
1 195 . 14 1 1 A 19 19 ILE H H 19 8.330 8.011 0.319 1
1 196 . 14 1 1 A 19 19 ILE HA H 19 3.306 3.818 -0.512 1
1 204 . 14 1 1 A 19 19 ILE C C 19 175.608 177.472 -1.864 1
1 205 . 14 1 1 A 19 19 ILE CA C 19 64.760 62.977 1.783 1
1 206 . 14 1 1 A 19 19 ILE CB C 19 37.148 37.138 0.010 1
1 209 . 14 1 1 A 19 19 ILE N N 19 121.490 121.512 -0.022 1
1 210 . 14 1 1 A 20 20 ALA H H 20 8.057 7.902 0.155 1
1 211 . 14 1 1 A 20 20 ALA HA H 20 4.349 4.296 0.053 1
1 215 . 14 1 1 A 20 20 ALA C C 20 179.297 179.195 0.102 1
1 216 . 14 1 1 A 20 20 ALA CA C 20 56.150 54.999 1.151 1
1 217 . 14 1 1 A 20 20 ALA CB C 20 18.104 18.793 -0.689 1
1 218 . 14 1 1 A 20 20 ALA N N 20 124.441 123.827 0.614 1
1 219 . 14 1 1 A 21 21 LYS H H 21 8.116 7.905 0.211 1
1 220 . 14 1 1 A 21 21 LYS HA H 21 4.108 4.042 0.066 1
1 229 . 14 1 1 A 21 21 LYS C C 21 176.720 178.689 -1.969 1
1 230 . 14 1 1 A 21 21 LYS CA C 21 59.166 59.593 -0.427 1
1 231 . 14 1 1 A 21 21 LYS CB C 21 32.085 32.579 -0.494 1
1 233 . 14 1 1 A 21 21 LYS N N 21 119.865 119.064 0.801 1
1 234 . 14 1 1 A 22 22 PHE H H 22 7.875 8.116 -0.241 1
1 235 . 14 1 1 A 22 22 PHE HA H 22 4.012 4.152 -0.140 1
1 242 . 14 1 1 A 22 22 PHE C C 22 175.545 177.367 -1.822 1
1 243 . 14 1 1 A 22 22 PHE CA C 22 61.070 61.233 -0.163 1
1 244 . 14 1 1 A 22 22 PHE CB C 22 39.072 38.575 0.497 1
1 249 . 14 1 1 A 22 22 PHE N N 22 119.729 119.843 -0.114 1
1 250 . 14 1 1 A 23 23 TRP H H 23 7.841 8.103 -0.262 1
1 251 . 14 1 1 A 23 23 TRP HA H 23 4.149 4.010 0.139 1
1 260 . 14 1 1 A 23 23 TRP C C 23 176.668 178.143 -1.475 1
1 261 . 14 1 1 A 23 23 TRP CB C 23 28.543 29.770 -1.227 1
1 267 . 14 1 1 A 23 23 TRP N N 23 119.440 120.645 -1.205 1
1 269 . 14 1 1 A 24 24 GLU H H 24 8.261 8.300 -0.039 1
1 270 . 14 1 1 A 24 24 GLU HA H 24 4.265 4.266 -0.001 1
1 275 . 14 1 1 A 24 24 GLU C C 24 179.679 178.833 0.846 1
1 276 . 14 1 1 A 24 24 GLU CA C 24 59.706 58.590 1.116 1
1 277 . 14 1 1 A 24 24 GLU CB C 24 29.720 29.605 0.115 1
1 279 . 14 1 1 A 24 24 GLU N N 24 121.376 118.644 2.732 1
1 280 . 14 1 1 A 25 25 ILE H H 25 8.071 8.082 -0.011 1
1 281 . 14 1 1 A 25 25 ILE HA H 25 3.815 3.805 0.010 1
1 291 . 14 1 1 A 25 25 ILE C C 25 176.343 177.108 -0.765 1
1 292 . 14 1 1 A 25 25 ILE CA C 25 64.464 62.497 1.967 1
1 293 . 14 1 1 A 25 25 ILE CB C 25 37.371 37.562 -0.191 1
1 296 . 14 1 1 A 25 25 ILE N N 25 121.499 119.496 2.003 1
1 297 . 14 1 1 A 26 26 GLN H H 26 7.327 7.142 0.185 1
1 298 . 14 1 1 A 26 26 GLN HA H 26 4.074 4.205 -0.131 1
1 305 . 14 1 1 A 26 26 GLN C C 26 174.906 175.582 -0.676 1
1 306 . 14 1 1 A 26 26 GLN CA C 26 55.450 55.010 0.440 1
1 307 . 14 1 1 A 26 26 GLN CB C 26 28.458 28.592 -0.134 1
1 309 . 14 1 1 A 26 26 GLN N N 26 116.532 119.704 -3.172 1
1 311 . 14 1 1 A 27 27 GLY H H 27 7.861 8.080 -0.219 1
1 312 . 14 1 1 A 27 27 GLY HA2 H 27 4.297 3.784 0.513 1
1 313 . 14 1 1 A 27 27 GLY HA3 H 27 3.823 3.785 0.038 1
1 314 . 14 1 1 A 27 27 GLY C C 27 172.698 173.253 -0.555 1
1 315 . 14 1 1 A 27 27 GLY CA C 27 45.608 45.995 -0.387 1
1 316 . 14 1 1 A 27 27 GLY N N 27 106.837 108.587 -1.750 1
1 317 . 14 1 1 A 28 28 SER H H 28 8.083 7.310 0.773 1
1 318 . 14 1 1 A 28 28 SER HA H 28 4.777 4.735 0.042 1
1 321 . 14 1 1 A 28 28 SER C C 28 171.196 171.770 -0.574 1
1 322 . 14 1 1 A 28 28 SER CA C 28 56.041 56.926 -0.885 1
1 323 . 14 1 1 A 28 28 SER CB C 28 64.539 66.827 -2.288 1
1 324 . 14 1 1 A 28 28 SER N N 28 116.151 114.316 1.835 1
1 325 . 14 1 1 A 29 29 SER H H 29 8.354 8.410 -0.056 1
1 326 . 14 1 1 A 29 29 SER HA H 29 4.389 4.971 -0.582 1
1 329 . 14 1 1 A 29 29 SER C C 29 172.166 172.563 -0.397 1
1 330 . 14 1 1 A 29 29 SER CA C 29 58.107 56.532 1.575 1
1 331 . 14 1 1 A 29 29 SER CB C 29 63.853 65.989 -2.136 1
1 332 . 14 1 1 A 29 29 SER N N 29 116.596 114.317 2.279 1
1 333 . 14 1 1 A 30 30 LEU H H 30 8.990 8.557 0.433 1
1 334 . 14 1 1 A 30 30 LEU HA H 30 3.964 4.938 -0.974 1
1 344 . 14 1 1 A 30 30 LEU C C 30 173.752 175.789 -2.037 1
1 345 . 14 1 1 A 30 30 LEU CA C 30 55.193 55.842 -0.649 1
1 346 . 14 1 1 A 30 30 LEU CB C 30 42.869 42.574 0.295 1
1 349 . 14 1 1 A 30 30 LEU N N 30 125.860 126.898 -1.038 1
1 350 . 14 1 1 A 31 31 LYS H H 31 8.118 8.764 -0.646 1
1 351 . 14 1 1 A 31 31 LYS HA H 31 4.498 4.771 -0.273 1
1 360 . 14 1 1 A 31 31 LYS C C 31 173.555 174.927 -1.372 1
1 361 . 14 1 1 A 31 31 LYS CA C 31 54.372 55.395 -1.023 1
1 362 . 14 1 1 A 31 31 LYS CB C 31 32.814 32.980 -0.166 1
1 365 . 14 1 1 A 31 31 LYS N N 31 129.965 127.038 2.927 1
1 366 . 14 1 1 A 32 32 ILE H H 32 8.717 8.171 0.546 1
1 367 . 14 1 1 A 32 32 ILE HA H 32 4.011 4.437 -0.426 1
1 377 . 14 1 1 A 32 32 ILE C C 32 173.038 175.231 -2.193 1
1 378 . 14 1 1 A 32 32 ILE CA C 32 59.921 59.139 0.782 1
1 379 . 14 1 1 A 32 32 ILE CB C 32 38.139 37.882 0.257 1
1 382 . 14 1 1 A 32 32 ILE N N 32 127.091 123.100 3.991 1
1 383 . 14 1 1 A 33 33 PRO HA H 33 4.412 4.476 -0.064 1
1 390 . 14 1 1 A 33 33 PRO C C 33 172.724 175.768 -3.044 1
1 391 . 14 1 1 A 33 33 PRO CA C 33 62.565 62.262 0.303 1
1 392 . 14 1 1 A 33 33 PRO CB C 33 32.728 32.535 0.193 1
1 394 . 14 1 1 A 34 34 ASN H H 34 8.265 8.446 -0.181 1
1 395 . 14 1 1 A 34 34 ASN HA H 34 5.147 5.565 -0.418 1
1 400 . 14 1 1 A 34 34 ASN C C 34 174.079 173.495 0.584 1
1 401 . 14 1 1 A 34 34 ASN CA C 34 52.088 51.462 0.626 1
1 402 . 14 1 1 A 34 34 ASN CB C 34 40.387 42.655 -2.268 1
1 403 . 14 1 1 A 34 34 ASN N N 34 116.424 114.928 1.496 1
1 405 . 14 1 1 A 35 35 VAL H H 35 8.904 8.983 -0.079 1
1 406 . 14 1 1 A 35 35 VAL HA H 35 4.159 4.357 -0.198 1
1 414 . 14 1 1 A 35 35 VAL C C 35 173.834 174.469 -0.635 1
1 415 . 14 1 1 A 35 35 VAL CA C 35 61.953 60.164 1.789 1
1 416 . 14 1 1 A 35 35 VAL CB C 35 34.432 34.776 -0.344 1
1 419 . 14 1 1 A 35 35 VAL N N 35 122.778 118.659 4.119 1
1 420 . 14 1 1 A 36 36 GLU H H 36 9.560 9.427 0.133 1
1 421 . 14 1 1 A 36 36 GLU HA H 36 3.819 4.035 -0.216 1
1 426 . 14 1 1 A 36 36 GLU C C 36 173.604 175.840 -2.236 1
1 427 . 14 1 1 A 36 36 GLU CA C 36 57.131 58.041 -0.910 1
1 428 . 14 1 1 A 36 36 GLU CB C 36 27.464 28.095 -0.631 1
1 430 . 14 1 1 A 36 36 GLU N N 36 127.014 127.844 -0.830 1
1 431 . 14 1 1 A 37 37 ARG H H 37 8.578 8.476 0.102 1
1 432 . 14 1 1 A 37 37 ARG HA H 37 3.792 3.885 -0.093 1
1 439 . 14 1 1 A 37 37 ARG C C 37 173.371 174.337 -0.966 1
1 440 . 14 1 1 A 37 37 ARG CA C 37 57.952 57.726 0.226 1
1 441 . 14 1 1 A 37 37 ARG CB C 37 27.657 27.667 -0.010 1
1 443 . 14 1 1 A 37 37 ARG N N 37 108.362 110.709 -2.347 1
1 444 . 14 1 1 A 38 38 ARG H H 38 7.696 7.835 -0.139 1
1 445 . 14 1 1 A 38 38 ARG HA H 38 4.743 5.184 -0.441 1
1 452 . 14 1 1 A 38 38 ARG C C 38 173.513 175.065 -1.552 1
1 453 . 14 1 1 A 38 38 ARG CA C 38 54.507 54.265 0.242 1
1 454 . 14 1 1 A 38 38 ARG CB C 38 33.751 33.526 0.225 1
1 456 . 14 1 1 A 38 38 ARG N N 38 118.370 118.912 -0.542 1
1 457 . 14 1 1 A 39 39 ILE H H 39 8.463 7.914 0.549 1
1 458 . 14 1 1 A 39 39 ILE HA H 39 4.184 4.206 -0.022 1
1 468 . 14 1 1 A 39 39 ILE C C 39 175.150 175.800 -0.650 1
1 469 . 14 1 1 A 39 39 ILE CA C 39 62.076 62.163 -0.087 1
1 470 . 14 1 1 A 39 39 ILE CB C 39 38.864 39.354 -0.490 1
1 473 . 14 1 1 A 39 39 ILE N N 39 123.604 126.021 -2.417 1
1 474 . 14 1 1 A 40 40 LEU H H 40 8.239 8.193 0.046 1
1 475 . 14 1 1 A 40 40 LEU HA H 40 4.259 4.470 -0.211 1
1 485 . 14 1 1 A 40 40 LEU C C 40 173.152 175.641 -2.489 1
1 486 . 14 1 1 A 40 40 LEU CA C 40 55.305 54.951 0.354 1
1 487 . 14 1 1 A 40 40 LEU CB C 40 43.113 42.333 0.780 1
1 490 . 14 1 1 A 40 40 LEU N N 40 129.550 128.904 0.646 1
1 491 . 14 1 1 A 41 41 ASP H H 41 8.992 8.823 0.169 1
1 492 . 14 1 1 A 41 41 ASP HA H 41 4.798 4.717 0.081 1
1 495 . 14 1 1 A 41 41 ASP C C 41 173.837 176.234 -2.397 1
1 496 . 14 1 1 A 41 41 ASP CA C 41 52.077 53.417 -1.340 1
1 497 . 14 1 1 A 41 41 ASP CB C 41 39.454 40.382 -0.928 1
1 498 . 14 1 1 A 41 41 ASP N N 41 127.022 127.681 -0.659 1
1 499 . 14 1 1 A 42 42 LEU H H 42 7.912 8.245 -0.333 1
1 500 . 14 1 1 A 42 42 LEU HA H 42 3.970 4.065 -0.095 1
1 510 . 14 1 1 A 42 42 LEU C C 42 176.305 178.001 -1.696 1
1 511 . 14 1 1 A 42 42 LEU CA C 42 58.128 57.826 0.302 1
1 512 . 14 1 1 A 42 42 LEU CB C 42 43.043 42.099 0.944 1
1 514 . 14 1 1 A 42 42 LEU N N 42 125.064 127.505 -2.441 1
1 515 . 14 1 1 A 43 43 TYR H H 43 8.565 8.059 0.506 1
1 516 . 14 1 1 A 43 43 TYR HA H 43 3.728 3.800 -0.072 1
1 523 . 14 1 1 A 43 43 TYR C C 43 175.757 177.056 -1.299 1
1 524 . 14 1 1 A 43 43 TYR CA C 43 61.774 61.913 -0.139 1
1 525 . 14 1 1 A 43 43 TYR CB C 43 38.235 38.513 -0.278 1
1 528 . 14 1 1 A 43 43 TYR N N 43 117.822 120.443 -2.621 1
1 529 . 14 1 1 A 44 44 SER H H 44 8.115 8.326 -0.211 1
1 530 . 14 1 1 A 44 44 SER HA H 44 3.854 4.196 -0.342 1
1 533 . 14 1 1 A 44 44 SER C C 44 174.080 176.160 -2.080 1
1 534 . 14 1 1 A 44 44 SER CA C 44 61.873 61.890 -0.017 1
1 535 . 14 1 1 A 44 44 SER CB C 44 64.350 62.961 1.389 1
1 536 . 14 1 1 A 44 44 SER N N 44 116.835 115.700 1.135 1
1 537 . 14 1 1 A 45 45 LEU H H 45 8.401 7.630 0.771 1
1 538 . 14 1 1 A 45 45 LEU HA H 45 4.102 4.199 -0.097 1
1 548 . 14 1 1 A 45 45 LEU C C 45 175.081 178.576 -3.495 1
1 549 . 14 1 1 A 45 45 LEU CA C 45 58.896 58.081 0.815 1
1 550 . 14 1 1 A 45 45 LEU CB C 45 41.741 41.560 0.181 1
1 553 . 14 1 1 A 45 45 LEU N N 45 120.621 123.255 -2.634 1
1 554 . 14 1 1 A 46 46 SER H H 46 8.110 8.705 -0.595 1
1 555 . 14 1 1 A 46 46 SER HA H 46 4.300 4.259 0.041 1
1 558 . 14 1 1 A 46 46 SER C C 46 175.019 176.693 -1.674 1
1 559 . 14 1 1 A 46 46 SER CA C 46 62.610 61.581 1.029 1
1 560 . 14 1 1 A 46 46 SER CB C 46 64.092 62.493 1.599 1
1 561 . 14 1 1 A 46 46 SER N N 46 112.826 113.670 -0.844 1
1 562 . 14 1 1 A 47 47 LYS H H 47 7.732 8.058 -0.326 1
1 563 . 14 1 1 A 47 47 LYS HA H 47 3.900 4.168 -0.268 1
1 572 . 14 1 1 A 47 47 LYS C C 47 177.441 178.903 -1.462 1
1 573 . 14 1 1 A 47 47 LYS CA C 47 58.575 59.200 -0.625 1
1 574 . 14 1 1 A 47 47 LYS CB C 47 32.351 31.831 0.520 1
1 576 . 14 1 1 A 47 47 LYS N N 47 121.210 119.304 1.906 1
1 577 . 14 1 1 A 48 48 ILE H H 48 8.672 8.335 0.337 1
1 578 . 14 1 1 A 48 48 ILE HA H 48 3.628 3.785 -0.157 1
1 588 . 14 1 1 A 48 48 ILE C C 48 175.861 178.343 -2.482 1
1 589 . 14 1 1 A 48 48 ILE CA C 48 64.188 64.790 -0.602 1
1 590 . 14 1 1 A 48 48 ILE CB C 48 37.954 37.682 0.272 1
1 593 . 14 1 1 A 48 48 ILE N N 48 120.810 121.319 -0.509 1
1 594 . 14 1 1 A 49 49 VAL H H 49 8.030 8.240 -0.210 1
1 595 . 14 1 1 A 49 49 VAL HA H 49 3.195 3.681 -0.486 1
1 603 . 14 1 1 A 49 49 VAL C C 49 176.513 178.616 -2.103 1
1 604 . 14 1 1 A 49 49 VAL CA C 49 66.760 67.086 -0.326 1
1 605 . 14 1 1 A 49 49 VAL CB C 49 30.935 31.733 -0.798 1
1 608 . 14 1 1 A 49 49 VAL N N 49 119.350 119.683 -0.333 1
1 609 . 14 1 1 A 50 50 VAL H H 50 7.336 8.338 -1.002 1
1 610 . 14 1 1 A 50 50 VAL HA H 50 3.497 3.622 -0.125 1
1 618 . 14 1 1 A 50 50 VAL C C 50 178.745 178.392 0.353 1
1 619 . 14 1 1 A 50 50 VAL CA C 50 67.384 66.653 0.731 1
1 620 . 14 1 1 A 50 50 VAL CB C 50 31.832 31.566 0.266 1
1 621 . 14 1 1 A 50 50 VAL N N 50 118.610 120.854 -2.244 1
1 622 . 14 1 1 A 51 51 GLU H H 51 8.318 8.411 -0.093 1
1 623 . 14 1 1 A 51 51 GLU HA H 51 3.953 4.012 -0.059 1
1 628 . 14 1 1 A 51 51 GLU C C 51 177.281 178.828 -1.547 1
1 629 . 14 1 1 A 51 51 GLU CA C 51 59.668 59.354 0.314 1
1 630 . 14 1 1 A 51 51 GLU CB C 51 30.131 29.270 0.861 1
1 632 . 14 1 1 A 51 51 GLU N N 51 122.096 119.851 2.245 1
1 633 . 14 1 1 A 52 52 GLU H H 52 8.065 8.320 -0.255 1
1 634 . 14 1 1 A 52 52 GLU HA H 52 4.229 4.270 -0.041 1
1 639 . 14 1 1 A 52 52 GLU C C 52 173.534 176.727 -3.193 1
1 640 . 14 1 1 A 52 52 GLU CA C 52 55.547 56.534 -0.987 1
1 641 . 14 1 1 A 52 52 GLU CB C 52 28.716 29.935 -1.219 1
1 643 . 14 1 1 A 52 52 GLU N N 52 114.992 116.206 -1.214 1
1 644 . 14 1 1 A 53 53 GLY H H 53 7.459 8.984 -1.525 1
1 645 . 14 1 1 A 53 53 GLY HA2 H 53 3.630 3.971 -0.341 1
1 646 . 14 1 1 A 53 53 GLY HA3 H 53 3.630 3.989 -0.359 1
1 647 . 14 1 1 A 53 53 GLY C C 53 173.214 173.702 -0.488 1
1 648 . 14 1 1 A 53 53 GLY CA C 53 44.962 45.136 -0.174 1
1 649 . 14 1 1 A 53 53 GLY N N 53 104.909 107.789 -2.880 1
1 650 . 14 1 1 A 54 54 GLY H H 54 8.533 7.368 1.165 1
1 651 . 14 1 1 A 54 54 GLY HA2 H 54 3.548 4.080 -0.532 1
1 652 . 14 1 1 A 54 54 GLY HA3 H 54 4.521 4.136 0.385 1
1 653 . 14 1 1 A 54 54 GLY C C 54 169.966 174.551 -4.585 1
1 654 . 14 1 1 A 54 54 GLY CA C 54 43.988 45.796 -1.808 1
1 655 . 14 1 1 A 54 54 GLY N N 54 110.587 107.840 2.747 1
1 656 . 14 1 1 A 55 55 TYR H H 55 8.704 9.234 -0.530 1
1 657 . 14 1 1 A 55 55 TYR HA H 55 3.618 4.039 -0.421 1
1 664 . 14 1 1 A 55 55 TYR C C 55 174.807 177.398 -2.591 1
1 665 . 14 1 1 A 55 55 TYR CA C 55 62.540 61.287 1.253 1
1 666 . 14 1 1 A 55 55 TYR CB C 55 39.669 38.735 0.934 1
1 669 . 14 1 1 A 55 55 TYR N N 55 119.168 122.223 -3.055 1
1 670 . 14 1 1 A 56 56 GLU H H 56 9.006 8.230 0.776 1
1 671 . 14 1 1 A 56 56 GLU HA H 56 3.638 3.454 0.184 1
1 676 . 14 1 1 A 56 56 GLU C C 56 177.400 178.293 -0.893 1
1 677 . 14 1 1 A 56 56 GLU CA C 56 60.530 59.542 0.988 1
1 678 . 14 1 1 A 56 56 GLU CB C 56 29.168 29.408 -0.240 1
1 679 . 14 1 1 A 56 56 GLU N N 56 118.969 119.118 -0.149 1
1 680 . 14 1 1 A 57 57 ALA H H 57 8.235 7.755 0.480 1
1 681 . 14 1 1 A 57 57 ALA HA H 57 3.980 3.997 -0.017 1
1 685 . 14 1 1 A 57 57 ALA C C 57 177.678 179.672 -1.994 1
1 686 . 14 1 1 A 57 57 ALA CA C 57 54.910 55.025 -0.115 1
1 687 . 14 1 1 A 57 57 ALA CB C 57 18.122 18.580 -0.458 1
1 688 . 14 1 1 A 57 57 ALA N N 57 122.860 121.283 1.577 1
1 689 . 14 1 1 A 58 58 ILE H H 58 7.831 7.280 0.551 1
1 690 . 14 1 1 A 58 58 ILE HA H 58 3.189 3.309 -0.120 1
1 700 . 14 1 1 A 58 58 ILE C C 58 177.818 177.522 0.296 1
1 701 . 14 1 1 A 58 58 ILE CA C 58 65.074 64.447 0.627 1
1 702 . 14 1 1 A 58 58 ILE CB C 58 38.178 36.627 1.551 1
1 706 . 14 1 1 A 58 58 ILE N N 58 117.418 117.053 0.365 1
1 707 . 14 1 1 A 59 59 CYS H H 59 7.760 7.883 -0.123 1
1 708 . 14 1 1 A 59 59 CYS HA H 59 4.203 4.450 -0.247 1
1 711 . 14 1 1 A 59 59 CYS C C 59 176.357 176.799 -0.442 1
1 712 . 14 1 1 A 59 59 CYS CA C 59 63.760 61.725 2.035 1
1 713 . 14 1 1 A 59 59 CYS CB C 59 27.638 27.017 0.621 1
1 714 . 14 1 1 A 59 59 CYS N N 59 115.302 120.422 -5.120 1
1 715 . 14 1 1 A 60 60 LYS H H 60 8.350 8.035 0.315 1
1 716 . 14 1 1 A 60 60 LYS HA H 60 3.972 3.968 0.004 1
1 725 . 14 1 1 A 60 60 LYS C C 60 176.373 177.489 -1.116 1
1 726 . 14 1 1 A 60 60 LYS CA C 60 59.796 59.097 0.699 1
1 727 . 14 1 1 A 60 60 LYS CB C 60 32.560 32.116 0.444 1
1 729 . 14 1 1 A 60 60 LYS N N 60 122.343 120.228 2.115 1
1 730 . 14 1 1 A 61 61 ASP H H 61 8.157 7.563 0.594 1
1 731 . 14 1 1 A 61 61 ASP HA H 61 4.616 4.623 -0.007 1
1 734 . 14 1 1 A 61 61 ASP C C 61 173.246 175.705 -2.459 1
1 735 . 14 1 1 A 61 61 ASP CA C 61 54.272 54.479 -0.207 1
1 736 . 14 1 1 A 61 61 ASP CB C 61 41.023 41.221 -0.198 1
1 737 . 14 1 1 A 61 61 ASP N N 61 116.173 118.548 -2.375 1
1 738 . 14 1 1 A 62 62 ARG H H 62 7.655 7.789 -0.134 1
1 739 . 14 1 1 A 62 62 ARG HA H 62 4.149 4.031 0.118 1
1 746 . 14 1 1 A 62 62 ARG C C 62 175.891 176.555 -0.664 1
1 747 . 14 1 1 A 62 62 ARG CA C 62 57.381 57.223 0.158 1
1 748 . 14 1 1 A 62 62 ARG CB C 62 26.538 29.376 -2.838 1
1 750 . 14 1 1 A 62 62 ARG N N 62 117.213 118.463 -1.250 1
1 751 . 14 1 1 A 63 63 ARG H H 63 8.302 7.798 0.504 1
1 752 . 14 1 1 A 63 63 ARG HA H 63 4.240 4.171 0.069 1
1 757 . 14 1 1 A 63 63 ARG C C 63 175.775 178.118 -2.343 1
1 758 . 14 1 1 A 63 63 ARG CA C 63 55.718 57.845 -2.127 1
1 760 . 14 1 1 A 63 63 ARG N N 63 116.292 119.153 -2.861 1
1 761 . 14 1 1 A 64 64 TRP H H 64 8.161 7.375 0.786 1
1 762 . 14 1 1 A 64 64 TRP HA H 64 3.836 4.389 -0.553 1
1 771 . 14 1 1 A 64 64 TRP C C 64 176.862 178.434 -1.572 1
1 772 . 14 1 1 A 64 64 TRP CA C 64 62.036 59.792 2.244 1
1 773 . 14 1 1 A 64 64 TRP CB C 64 27.028 28.877 -1.849 1
1 779 . 14 1 1 A 64 64 TRP N N 64 121.486 119.685 1.801 1
1 781 . 14 1 1 A 65 65 ALA H H 65 8.954 7.900 1.054 1
1 782 . 14 1 1 A 65 65 ALA HA H 65 4.290 4.120 0.170 1
1 786 . 14 1 1 A 65 65 ALA C C 65 178.986 179.481 -0.495 1
1 787 . 14 1 1 A 65 65 ALA CA C 65 55.314 55.420 -0.106 1
1 788 . 14 1 1 A 65 65 ALA CB C 65 18.119 18.195 -0.076 1
1 789 . 14 1 1 A 65 65 ALA N N 65 121.559 122.874 -1.315 1
1 790 . 14 1 1 A 66 66 ARG H H 66 7.473 7.930 -0.457 1
1 791 . 14 1 1 A 66 66 ARG HA H 66 4.221 4.109 0.112 1
1 798 . 14 1 1 A 66 66 ARG C C 66 176.670 178.752 -2.082 1
1 799 . 14 1 1 A 66 66 ARG CA C 66 57.871 59.028 -1.157 1
1 800 . 14 1 1 A 66 66 ARG CB C 66 29.097 29.747 -0.650 1
1 801 . 14 1 1 A 66 66 ARG N N 66 119.915 117.190 2.725 1
1 802 . 14 1 1 A 67 67 VAL H H 67 7.134 7.688 -0.554 1
1 803 . 14 1 1 A 67 67 VAL HA H 67 3.304 3.639 -0.335 1
1 811 . 14 1 1 A 67 67 VAL C C 67 175.341 178.030 -2.689 1
1 812 . 14 1 1 A 67 67 VAL CA C 67 66.722 66.665 0.057 1
1 813 . 14 1 1 A 67 67 VAL CB C 67 31.108 31.976 -0.868 1
1 816 . 14 1 1 A 67 67 VAL N N 67 119.970 120.709 -0.739 1
1 817 . 14 1 1 A 68 68 ALA H H 68 7.745 8.654 -0.909 1
1 818 . 14 1 1 A 68 68 ALA HA H 68 4.076 4.176 -0.100 1
1 822 . 14 1 1 A 68 68 ALA C C 68 177.358 179.441 -2.083 1
1 823 . 14 1 1 A 68 68 ALA CA C 68 55.607 55.602 0.005 1
1 824 . 14 1 1 A 68 68 ALA CB C 68 18.061 18.247 -0.186 1
1 825 . 14 1 1 A 68 68 ALA N N 68 118.239 121.639 -3.400 1
1 826 . 14 1 1 A 69 69 GLN H H 69 7.979 8.007 -0.028 1
1 827 . 14 1 1 A 69 69 GLN HA H 69 4.310 3.978 0.332 1
1 834 . 14 1 1 A 69 69 GLN C C 69 179.370 178.176 1.194 1
1 835 . 14 1 1 A 69 69 GLN CA C 69 59.307 59.257 0.050 1
1 836 . 14 1 1 A 69 69 GLN CB C 69 29.257 28.480 0.777 1
1 838 . 14 1 1 A 69 69 GLN N N 69 118.484 118.028 0.456 1
1 840 . 14 1 1 A 70 70 ARG H H 70 8.374 8.001 0.373 1
1 841 . 14 1 1 A 70 70 ARG HA H 70 4.148 4.095 0.053 1
1 848 . 14 1 1 A 70 70 ARG C C 70 175.850 178.358 -2.508 1
1 849 . 14 1 1 A 70 70 ARG CA C 70 58.957 58.884 0.073 1
1 850 . 14 1 1 A 70 70 ARG CB C 70 29.799 30.032 -0.233 1
1 852 . 14 1 1 A 70 70 ARG N N 70 120.309 120.577 -0.268 1
1 853 . 14 1 1 A 71 71 LEU H H 71 7.413 7.742 -0.329 1
1 854 . 14 1 1 A 71 71 LEU HA H 71 4.341 4.104 0.237 1
1 864 . 14 1 1 A 71 71 LEU C C 71 173.391 175.447 -2.056 1
1 865 . 14 1 1 A 71 71 LEU CA C 71 54.911 54.685 0.226 1
1 866 . 14 1 1 A 71 71 LEU CB C 71 42.693 41.595 1.098 1
1 867 . 14 1 1 A 71 71 LEU N N 71 118.841 117.666 1.175 1
1 868 . 14 1 1 A 72 72 ASN H H 72 8.038 7.882 0.156 1
1 869 . 14 1 1 A 72 72 ASN HA H 72 4.394 4.313 0.081 1
1 874 . 14 1 1 A 72 72 ASN C C 72 173.042 174.038 -0.996 1
1 875 . 14 1 1 A 72 72 ASN CB C 72 36.412 36.806 -0.394 1
1 876 . 14 1 1 A 72 72 ASN N N 72 112.919 114.696 -1.777 1
1 878 . 14 1 1 A 73 73 TYR H H 73 7.874 7.861 0.013 1
1 879 . 14 1 1 A 73 73 TYR HA H 73 4.868 4.606 0.262 1
1 886 . 14 1 1 A 73 73 TYR C C 73 172.194 174.008 -1.814 1
1 887 . 14 1 1 A 73 73 TYR CA C 73 57.105 56.426 0.679 1
1 888 . 14 1 1 A 73 73 TYR CB C 73 37.918 38.540 -0.622 1
1 889 . 14 1 1 A 73 73 TYR N N 73 117.432 119.163 -1.731 1
1 897 . 14 1 1 A 75 75 PRO HA H 75 4.626 4.282 0.344 1
1 902 . 14 1 1 A 75 75 PRO C C 75 175.728 177.249 -1.521 1
1 903 . 14 1 1 A 75 75 PRO CA C 75 62.502 63.747 -1.245 1
1 904 . 14 1 1 A 75 75 PRO CB C 75 32.339 32.303 0.036 1
1 905 . 14 1 1 A 76 76 GLY H H 76 8.369 8.890 -0.521 1
1 906 . 14 1 1 A 76 76 GLY HA2 H 76 4.057 3.907 0.150 1
1 907 . 14 1 1 A 76 76 GLY HA3 H 76 4.556 3.908 0.648 1
1 908 . 14 1 1 A 76 76 GLY C C 76 173.248 174.979 -1.731 1
1 909 . 14 1 1 A 76 76 GLY CA C 76 46.180 45.284 0.896 1
1 910 . 14 1 1 A 76 76 GLY N N 76 106.185 110.859 -4.674 1
1 911 . 14 1 1 A 77 77 LYS H H 77 8.632 8.286 0.346 1
1 912 . 14 1 1 A 77 77 LYS HA H 77 4.433 4.051 0.382 1
1 921 . 14 1 1 A 77 77 LYS C C 77 174.924 176.468 -1.544 1
1 922 . 14 1 1 A 77 77 LYS CA C 77 56.453 57.927 -1.474 1
1 923 . 14 1 1 A 77 77 LYS CB C 77 33.170 29.354 3.816 1
1 925 . 14 1 1 A 77 77 LYS N N 77 119.592 115.583 4.009 1
1 926 . 14 1 1 A 78 78 ASN H H 78 8.865 8.106 0.759 1
1 927 . 14 1 1 A 78 78 ASN HA H 78 4.654 4.478 0.176 1
1 932 . 14 1 1 A 78 78 ASN C C 78 174.869 177.923 -3.054 1
1 933 . 14 1 1 A 78 78 ASN CA C 78 54.117 56.742 -2.625 1
1 934 . 14 1 1 A 78 78 ASN CB C 78 37.841 39.121 -1.280 1
1 935 . 14 1 1 A 78 78 ASN N N 78 116.880 117.387 -0.507 1
1 937 . 14 1 1 A 79 79 ILE H H 79 8.008 8.157 -0.149 1
1 938 . 14 1 1 A 79 79 ILE HA H 79 3.718 3.756 -0.038 1
1 948 . 14 1 1 A 79 79 ILE C C 79 175.921 178.344 -2.423 1
1 949 . 14 1 1 A 79 79 ILE CA C 79 63.618 64.734 -1.116 1
1 950 . 14 1 1 A 79 79 ILE CB C 79 37.158 37.430 -0.272 1
1 952 . 14 1 1 A 79 79 ILE N N 79 119.688 119.460 0.228 1
1 953 . 14 1 1 A 80 80 GLY H H 80 9.062 8.203 0.859 1
1 954 . 14 1 1 A 80 80 GLY HA2 H 80 3.739 3.795 -0.056 1
1 955 . 14 1 1 A 80 80 GLY HA3 H 80 3.739 3.837 -0.098 1
1 956 . 14 1 1 A 80 80 GLY C C 80 173.185 176.113 -2.928 1
1 957 . 14 1 1 A 80 80 GLY CA C 80 48.166 47.530 0.636 1
1 958 . 14 1 1 A 80 80 GLY N N 80 110.338 108.933 1.405 1
1 959 . 14 1 1 A 81 81 SER H H 81 7.460 8.041 -0.581 1
1 960 . 14 1 1 A 81 81 SER HA H 81 3.904 4.068 -0.164 1
1 963 . 14 1 1 A 81 81 SER C C 81 174.999 176.380 -1.381 1
1 964 . 14 1 1 A 81 81 SER CA C 81 61.138 61.586 -0.448 1
1 965 . 14 1 1 A 81 81 SER CB C 81 62.740 62.438 0.302 1
1 966 . 14 1 1 A 81 81 SER N N 81 115.348 117.277 -1.929 1
1 967 . 14 1 1 A 82 82 LEU H H 82 7.367 8.052 -0.685 1
1 968 . 14 1 1 A 82 82 LEU HA H 82 3.946 3.930 0.016 1
1 977 . 14 1 1 A 82 82 LEU C C 82 176.969 178.139 -1.170 1
1 978 . 14 1 1 A 82 82 LEU CA C 82 57.504 58.555 -1.051 1
1 979 . 14 1 1 A 82 82 LEU CB C 82 42.185 41.523 0.662 1
1 980 . 14 1 1 A 82 82 LEU N N 82 124.267 123.964 0.303 1
1 981 . 14 1 1 A 83 83 LEU H H 83 8.330 8.129 0.201 1
1 982 . 14 1 1 A 83 83 LEU HA H 83 3.924 3.965 -0.041 1
1 991 . 14 1 1 A 83 83 LEU C C 83 176.303 178.421 -2.118 1
1 992 . 14 1 1 A 83 83 LEU CA C 83 58.067 58.495 -0.428 1
1 993 . 14 1 1 A 83 83 LEU CB C 83 41.061 41.448 -0.387 1
1 994 . 14 1 1 A 83 83 LEU N N 83 117.452 119.490 -2.038 1
1 995 . 14 1 1 A 84 84 ARG H H 84 7.651 8.391 -0.740 1
1 996 . 14 1 1 A 84 84 ARG HA H 84 2.230 3.548 -1.318 1
1 1003 . 14 1 1 A 84 84 ARG C C 84 175.902 178.524 -2.622 1
1 1004 . 14 1 1 A 84 84 ARG CA C 84 59.112 59.401 -0.289 1
1 1005 . 14 1 1 A 84 84 ARG CB C 84 28.579 29.823 -1.244 1
1 1007 . 14 1 1 A 84 84 ARG N N 84 119.586 119.792 -0.206 1
1 1008 . 14 1 1 A 85 85 SER H H 85 7.291 7.987 -0.696 1
1 1009 . 14 1 1 A 85 85 SER HA H 85 4.189 4.478 -0.289 1
1 1012 . 14 1 1 A 85 85 SER C C 85 175.546 175.237 0.309 1
1 1013 . 14 1 1 A 85 85 SER CA C 85 61.376 60.854 0.522 1
1 1014 . 14 1 1 A 85 85 SER CB C 85 62.805 63.433 -0.628 1
1 1015 . 14 1 1 A 85 85 SER N N 85 112.921 116.326 -3.405 1
1 1016 . 14 1 1 A 86 86 HIS H H 86 8.156 7.601 0.555 1
1 1017 . 14 1 1 A 86 86 HIS HA H 86 4.782 4.402 0.380 1
1 1022 . 14 1 1 A 86 86 HIS C C 86 176.851 177.076 -0.225 1
1 1023 . 14 1 1 A 86 86 HIS CA C 86 58.898 58.507 0.391 1
1 1024 . 14 1 1 A 86 86 HIS CB C 86 31.110 29.852 1.258 1
1 1027 . 14 1 1 A 86 86 HIS N N 86 119.258 118.159 1.099 1
1 1028 . 14 1 1 A 87 87 TYR H H 87 9.180 8.107 1.073 1
1 1029 . 14 1 1 A 87 87 TYR HA H 87 3.913 3.921 -0.008 1
1 1036 . 14 1 1 A 87 87 TYR C C 87 176.841 177.057 -0.216 1
1 1037 . 14 1 1 A 87 87 TYR CA C 87 63.526 62.047 1.479 1
1 1038 . 14 1 1 A 87 87 TYR CB C 87 39.431 38.337 1.094 1
1 1041 . 14 1 1 A 87 87 TYR N N 87 120.625 119.871 0.754 1
1 1042 . 14 1 1 A 88 88 GLU H H 88 9.028 8.439 0.589 1
1 1043 . 14 1 1 A 88 88 GLU HA H 88 3.682 3.991 -0.309 1
1 1048 . 14 1 1 A 88 88 GLU C C 88 175.833 179.226 -3.393 1
1 1049 . 14 1 1 A 88 88 GLU CA C 88 59.730 60.275 -0.545 1
1 1050 . 14 1 1 A 88 88 GLU CB C 88 30.009 29.137 0.872 1
1 1052 . 14 1 1 A 88 88 GLU N N 88 119.531 118.231 1.300 1
1 1053 . 14 1 1 A 89 89 ARG H H 89 8.052 7.776 0.276 1
1 1054 . 14 1 1 A 89 89 ARG HA H 89 4.292 4.290 0.002 1
1 1061 . 14 1 1 A 89 89 ARG C C 89 176.045 177.418 -1.373 1
1 1062 . 14 1 1 A 89 89 ARG CA C 89 58.538 58.631 -0.093 1
1 1063 . 14 1 1 A 89 89 ARG CB C 89 31.841 30.835 1.006 1
1 1065 . 14 1 1 A 89 89 ARG N N 89 114.741 118.756 -4.015 1
1 1066 . 14 1 1 A 90 90 ILE H H 90 8.141 7.322 0.819 1
1 1067 . 14 1 1 A 90 90 ILE HA H 90 4.296 3.609 0.687 1
1 1075 . 14 1 1 A 90 90 ILE C C 90 174.461 176.749 -2.288 1
1 1076 . 14 1 1 A 90 90 ILE CA C 90 63.649 62.551 1.098 1
1 1077 . 14 1 1 A 90 90 ILE CB C 90 40.626 39.904 0.722 1
1 1079 . 14 1 1 A 90 90 ILE N N 90 113.421 117.086 -3.665 1
1 1080 . 14 1 1 A 91 91 VAL H H 91 7.350 7.912 -0.562 1
1 1081 . 14 1 1 A 91 91 VAL HA H 91 4.144 3.504 0.640 1
1 1089 . 14 1 1 A 91 91 VAL C C 91 175.422 177.406 -1.984 1
1 1090 . 14 1 1 A 91 91 VAL CA C 91 65.042 64.936 0.106 1
1 1091 . 14 1 1 A 91 91 VAL CB C 91 33.215 30.116 3.099 1
1 1092 . 14 1 1 A 91 91 VAL N N 91 118.215 121.201 -2.986 1
1 1093 . 14 1 1 A 92 92 TYR H H 92 8.565 8.141 0.424 1
1 1094 . 14 1 1 A 92 92 TYR HA H 92 4.217 4.311 -0.094 1
1 1099 . 14 1 1 A 92 92 TYR C C 92 171.495 174.825 -3.330 1
1 1100 . 14 1 1 A 92 92 TYR CA C 92 61.558 62.658 -1.100 1
1 1101 . 14 1 1 A 92 92 TYR CB C 92 36.757 36.708 0.049 1
1 1102 . 14 1 1 A 92 92 TYR N N 92 121.370 121.399 -0.029 1
1 1103 . 14 1 1 A 93 93 PRO HA H 93 4.136 4.470 -0.334 1
1 1108 . 14 1 1 A 93 93 PRO C C 93 177.077 178.210 -1.133 1
1 1109 . 14 1 1 A 93 93 PRO CA C 93 66.037 66.001 0.036 1
1 1110 . 14 1 1 A 93 93 PRO CB C 93 31.482 30.953 0.529 1
1 1111 . 14 1 1 A 94 94 TYR H H 94 6.517 7.440 -0.923 1
1 1112 . 14 1 1 A 94 94 TYR HA H 94 2.798 4.412 -1.614 1
1 1119 . 14 1 1 A 94 94 TYR C C 94 174.985 178.128 -3.143 1
1 1120 . 14 1 1 A 94 94 TYR CA C 94 59.356 59.337 0.019 1
1 1121 . 14 1 1 A 94 94 TYR CB C 94 37.987 37.189 0.798 1
1 1124 . 14 1 1 A 94 94 TYR N N 94 115.987 117.733 -1.746 1
1 1125 . 14 1 1 A 95 95 GLU H H 95 8.205 8.447 -0.242 1
1 1126 . 14 1 1 A 95 95 GLU HA H 95 3.682 4.106 -0.424 1
1 1131 . 14 1 1 A 95 95 GLU C C 95 178.530 178.783 -0.253 1
1 1132 . 14 1 1 A 95 95 GLU CA C 95 58.910 59.670 -0.760 1
1 1133 . 14 1 1 A 95 95 GLU CB C 95 29.187 29.084 0.103 1
1 1134 . 14 1 1 A 95 95 GLU N N 95 119.946 121.445 -1.499 1
1 1135 . 14 1 1 A 96 96 MET H H 96 8.248 7.990 0.258 1
1 1136 . 14 1 1 A 96 96 MET HA H 96 4.172 4.185 -0.013 1
1 1142 . 14 1 1 A 96 96 MET C C 96 176.874 178.121 -1.247 1
1 1143 . 14 1 1 A 96 96 MET CA C 96 57.159 59.128 -1.969 1
1 1144 . 14 1 1 A 96 96 MET CB C 96 31.829 32.173 -0.344 1
1 1146 . 14 1 1 A 96 96 MET N N 96 117.570 119.151 -1.581 1
1 1147 . 14 1 1 A 97 97 TYR H H 97 7.445 8.241 -0.796 1
1 1148 . 14 1 1 A 97 97 TYR HA H 97 4.248 3.999 0.249 1
1 1155 . 14 1 1 A 97 97 TYR C C 97 176.476 177.633 -1.157 1
1 1156 . 14 1 1 A 97 97 TYR CA C 97 60.470 61.608 -1.138 1
1 1157 . 14 1 1 A 97 97 TYR CB C 97 38.612 38.375 0.237 1
1 1160 . 14 1 1 A 97 97 TYR N N 97 122.246 121.119 1.127 1
1 1161 . 14 1 1 A 98 98 GLN H H 98 8.087 8.551 -0.464 1
1 1162 . 14 1 1 A 98 98 GLN HA H 98 3.793 3.617 0.176 1
1 1169 . 14 1 1 A 98 98 GLN C C 98 175.549 178.695 -3.146 1
1 1170 . 14 1 1 A 98 98 GLN CA C 98 57.365 58.966 -1.601 1
1 1171 . 14 1 1 A 98 98 GLN CB C 98 28.901 28.646 0.255 1
1 1173 . 14 1 1 A 98 98 GLN N N 98 118.769 118.732 0.037 1
1 1175 . 14 1 1 A 99 99 SER H H 99 7.724 8.525 -0.801 1
1 1176 . 14 1 1 A 99 99 SER HA H 99 4.293 4.239 0.054 1
1 1179 . 14 1 1 A 99 99 SER C C 99 173.696 177.118 -3.422 1
1 1180 . 14 1 1 A 99 99 SER CA C 99 59.566 62.754 -3.188 1
1 1181 . 14 1 1 A 99 99 SER CB C 99 63.847 62.511 1.336 1
1 1182 . 14 1 1 A 99 99 SER N N 99 113.257 116.480 -3.223 1
1 1183 . 14 1 1 A 100 100 GLY H H 100 7.751 8.305 -0.554 1
1 1184 . 14 1 1 A 100 100 GLY HA2 H 100 3.813 3.838 -0.025 1
1 1185 . 14 1 1 A 100 100 GLY HA3 H 100 3.934 3.852 0.082 1
1 1186 . 14 1 1 A 100 100 GLY C C 100 172.643 176.159 -3.516 1
1 1187 . 14 1 1 A 100 100 GLY CA C 100 45.570 46.898 -1.328 1
1 1188 . 14 1 1 A 100 100 GLY N N 100 109.750 108.683 1.067 1
1 1189 . 14 1 1 A 101 101 ALA H H 101 7.824 7.807 0.017 1
1 1190 . 14 1 1 A 101 101 ALA HA H 101 4.221 3.936 0.285 1
1 1194 . 14 1 1 A 101 101 ALA C C 101 175.639 179.489 -3.850 1
1 1195 . 14 1 1 A 101 101 ALA CA C 101 52.745 54.532 -1.787 1
1 1196 . 14 1 1 A 101 101 ALA CB C 101 19.437 18.839 0.598 1
1 1197 . 14 1 1 A 101 101 ALA N N 101 123.241 124.491 -1.250 1
1 1198 . 14 1 1 A 102 102 ASN H H 102 8.191 7.878 0.313 1
1 1199 . 14 1 1 A 102 102 ASN HA H 102 4.658 4.705 -0.047 1
1 1204 . 14 1 1 A 102 102 ASN C C 102 173.337 175.897 -2.560 1
1 1205 . 14 1 1 A 102 102 ASN CA C 102 53.374 55.639 -2.265 1
1 1206 . 14 1 1 A 102 102 ASN CB C 102 38.819 39.325 -0.506 1
1 1207 . 14 1 1 A 102 102 ASN N N 102 116.572 114.779 1.793 1
1 1209 . 14 1 1 A 103 103 LEU H H 103 8.065 7.704 0.361 1
1 1210 . 14 1 1 A 103 103 LEU HA H 103 4.363 4.634 -0.271 1
1 1219 . 14 1 1 A 103 103 LEU C C 103 175.637 174.941 0.696 1
1 1220 . 14 1 1 A 103 103 LEU CA C 103 55.292 53.577 1.715 1
1 1221 . 14 1 1 A 103 103 LEU CB C 103 42.433 44.989 -2.556 1
1 1222 . 14 1 1 A 103 103 LEU N N 103 122.074 114.675 7.399 1
1 1223 . 14 1 1 A 104 104 VAL H H 104 8.055 8.900 -0.845 1
1 1224 . 14 1 1 A 104 104 VAL HA H 104 4.131 4.538 -0.407 1
1 1232 . 14 1 1 A 104 104 VAL C C 104 174.364 175.138 -0.774 1
1 1233 . 14 1 1 A 104 104 VAL CA C 104 62.552 60.857 1.695 1
1 1234 . 14 1 1 A 104 104 VAL CB C 104 32.766 32.929 -0.163 1
1 1235 . 14 1 1 A 104 104 VAL N N 104 120.606 123.073 -2.467 1
1 1236 . 14 1 1 A 105 105 CYS H H 105 8.392 8.749 -0.357 1
1 1237 . 14 1 1 A 105 105 CYS HA H 105 4.535 4.573 -0.038 1
1 1240 . 14 1 1 A 105 105 CYS C C 105 172.593 175.453 -2.860 1
1 1241 . 14 1 1 A 105 105 CYS CA C 105 58.449 59.758 -1.309 1
1 1242 . 14 1 1 A 105 105 CYS CB C 105 27.952 28.210 -0.258 1
1 1243 . 14 1 1 A 105 105 CYS N N 105 122.791 126.465 -3.674 1
1 1244 . 14 1 1 A 106 106 ASN H H 106 8.575 8.111 0.464 1
1 1245 . 14 1 1 A 106 106 ASN HA H 106 4.843 4.935 -0.092 1
1 1250 . 14 1 1 A 106 106 ASN C C 106 173.594 175.463 -1.869 1
1 1251 . 14 1 1 A 106 106 ASN CA C 106 53.337 53.733 -0.396 1
1 1252 . 14 1 1 A 106 106 ASN CB C 106 39.088 38.888 0.200 1
1 1253 . 14 1 1 A 106 106 ASN N N 106 122.001 118.654 3.347 1
1 1255 . 14 1 1 A 107 107 THR H H 107 8.090 7.700 0.390 1
1 1256 . 14 1 1 A 107 107 THR HA H 107 4.348 4.043 0.305 1
1 1261 . 14 1 1 A 107 107 THR C C 107 172.516 176.292 -3.776 1
1 1262 . 14 1 1 A 107 107 THR CA C 107 61.803 65.288 -3.485 1
1 1263 . 14 1 1 A 107 107 THR CB C 107 69.812 68.792 1.020 1
1 1265 . 14 1 1 A 107 107 THR N N 107 114.374 115.125 -0.751 1
1 1266 . 14 1 1 A 108 108 ARG H H 108 8.322 7.791 0.531 1
1 1267 . 14 1 1 A 108 108 ARG HA H 108 4.634 4.355 0.279 1
1 1274 . 14 1 1 A 108 108 ARG C C 108 172.608 177.782 -5.174 1
1 1275 . 14 1 1 A 108 108 ARG CA C 108 54.026 59.368 -5.342 1
1 1276 . 14 1 1 A 108 108 ARG CB C 108 30.246 31.231 -0.985 1
1 1278 . 14 1 1 A 108 108 ARG N N 108 124.017 121.964 2.053 1
1 1279 . 14 1 1 A 109 109 PRO HA H 109 4.354 4.342 0.012 1
1 1286 . 14 1 1 A 109 109 PRO C C 109 174.978 179.148 -4.170 1
1 1287 . 14 1 1 A 109 109 PRO CA C 109 63.396 65.885 -2.489 1
1 1288 . 14 1 1 A 109 109 PRO CB C 109 32.046 31.249 0.797 1
1 1290 . 14 1 1 A 110 110 PHE H H 110 8.123 7.748 0.375 1
1 1291 . 14 1 1 A 110 110 PHE HA H 110 4.619 4.664 -0.045 1
1 1296 . 14 1 1 A 110 110 PHE C C 110 173.856 177.022 -3.166 1
1 1297 . 14 1 1 A 110 110 PHE CA C 110 57.353 62.046 -4.693 1
1 1298 . 14 1 1 A 110 110 PHE CB C 110 39.364 39.366 -0.002 1
1 1301 . 14 1 1 A 110 110 PHE N N 110 119.265 118.454 0.811 1
1 1302 . 14 1 1 A 111 111 ASP H H 111 8.161 8.579 -0.418 1
1 1303 . 14 1 1 A 111 111 ASP HA H 111 4.613 4.424 0.189 1
1 1306 . 14 1 1 A 111 111 ASP C C 111 174.114 178.126 -4.012 1
1 1307 . 14 1 1 A 111 111 ASP CA C 111 54.350 58.119 -3.769 1
1 1308 . 14 1 1 A 111 111 ASP CB C 111 41.413 42.202 -0.789 1
1 1309 . 14 1 1 A 111 111 ASP N N 111 121.764 119.644 2.120 1
1 1310 . 14 1 1 A 112 112 ASN H H 112 8.307 8.905 -0.598 1
1 1311 . 14 1 1 A 112 112 ASN HA H 112 4.662 4.433 0.229 1
1 1316 . 14 1 1 A 112 112 ASN C C 112 173.595 177.883 -4.288 1
1 1317 . 14 1 1 A 112 112 ASN CA C 112 53.486 56.821 -3.335 1
1 1318 . 14 1 1 A 112 112 ASN CB C 112 39.225 39.707 -0.482 1
1 1319 . 14 1 1 A 112 112 ASN N N 112 119.154 117.607 1.547 1
1 1321 . 14 1 1 A 113 113 GLU H H 113 8.404 8.623 -0.219 1
1 1322 . 14 1 1 A 113 113 GLU HA H 113 4.264 4.073 0.191 1
1 1327 . 14 1 1 A 113 113 GLU C C 113 174.886 178.980 -4.094 1
1 1328 . 14 1 1 A 113 113 GLU CA C 113 56.681 59.563 -2.882 1
1 1329 . 14 1 1 A 113 113 GLU CB C 113 30.403 29.156 1.247 1
1 1331 . 14 1 1 A 113 113 GLU N N 113 120.943 119.189 1.754 1
1 1332 . 14 1 1 A 114 114 GLU H H 114 8.388 8.145 0.243 1
1 1333 . 14 1 1 A 114 114 GLU HA H 114 4.262 4.192 0.070 1
1 1338 . 14 1 1 A 114 114 GLU C C 114 174.819 178.265 -3.446 1
1 1339 . 14 1 1 A 114 114 GLU CA C 114 56.769 59.181 -2.412 1
1 1340 . 14 1 1 A 114 114 GLU CB C 114 30.125 29.658 0.467 1
1 1342 . 14 1 1 A 114 114 GLU N N 114 121.869 120.258 1.611 1
1 1343 . 14 1 1 A 115 115 LYS H H 115 8.236 7.759 0.477 1
1 1344 . 14 1 1 A 115 115 LYS HA H 115 4.347 4.424 -0.077 1
1 1353 . 14 1 1 A 115 115 LYS C C 115 174.633 176.490 -1.857 1
1 1354 . 14 1 1 A 115 115 LYS CA C 115 56.426 56.300 0.126 1
1 1355 . 14 1 1 A 115 115 LYS CB C 115 33.277 32.781 0.496 1
1 1359 . 14 1 1 A 115 115 LYS N N 115 121.997 116.761 5.236 1
1 1360 . 14 1 1 A 116 116 ASP H H 116 8.386 8.350 0.036 1
1 1361 . 14 1 1 A 116 116 ASP HA H 116 4.600 4.566 0.034 1
1 1364 . 14 1 1 A 116 116 ASP C C 116 173.448 174.689 -1.241 1
1 1365 . 14 1 1 A 116 116 ASP CA C 116 54.773 55.700 -0.927 1
1 1366 . 14 1 1 A 116 116 ASP CB C 116 41.029 41.011 0.018 1
1 1367 . 14 1 1 A 116 116 ASP N N 116 121.057 118.560 2.497 1
1 5 . 15 1 1 A 2 2 MET HA H 2 4.534 4.584 -0.050 1
1 13 . 15 1 1 A 2 2 MET C C 2 174.355 177.788 -3.433 1
1 14 . 15 1 1 A 2 2 MET CA C 2 56.247 56.679 -0.432 1
1 15 . 15 1 1 A 2 2 MET CB C 2 32.855 31.752 1.103 1
1 18 . 15 1 1 A 3 3 ASN H H 3 8.600 8.150 0.450 1
1 19 . 15 1 1 A 3 3 ASN HA H 3 4.711 4.367 0.344 1
1 24 . 15 1 1 A 3 3 ASN C C 3 173.983 177.560 -3.577 1
1 25 . 15 1 1 A 3 3 ASN CA C 3 53.650 56.905 -3.255 1
1 26 . 15 1 1 A 3 3 ASN CB C 3 38.624 39.379 -0.755 1
1 27 . 15 1 1 A 3 3 ASN N N 3 120.149 119.884 0.265 1
1 29 . 15 1 1 A 4 4 GLU H H 4 8.495 8.419 0.076 1
1 30 . 15 1 1 A 4 4 GLU HA H 4 4.235 4.067 0.168 1
1 35 . 15 1 1 A 4 4 GLU C C 4 175.752 178.730 -2.978 1
1 36 . 15 1 1 A 4 4 GLU CA C 4 58.075 59.289 -1.214 1
1 37 . 15 1 1 A 4 4 GLU CB C 4 30.125 29.432 0.693 1
1 38 . 15 1 1 A 4 4 GLU N N 4 121.543 117.331 4.212 1
1 39 . 15 1 1 A 5 5 LEU HA H 5 4.073 4.186 -0.113 1
1 47 . 15 1 1 A 5 5 LEU CB C 5 41.897 42.698 -0.801 1
1 50 . 15 1 1 A 6 6 GLU H H 6 8.332 8.596 -0.264 1
1 51 . 15 1 1 A 6 6 GLU HA H 6 3.621 4.152 -0.531 1
1 52 . 15 1 1 A 6 6 GLU C C 6 176.402 178.539 -2.137 1
1 53 . 15 1 1 A 6 6 GLU CA C 6 58.461 57.370 1.091 1
1 54 . 15 1 1 A 6 6 GLU CB C 6 29.730 29.619 0.111 1
1 55 . 15 1 1 A 6 6 GLU N N 6 121.462 118.746 2.716 1
1 56 . 15 1 1 A 7 7 ALA H H 7 8.244 7.605 0.639 1
1 57 . 15 1 1 A 7 7 ALA HA H 7 4.185 4.069 0.116 1
1 61 . 15 1 1 A 7 7 ALA C C 7 177.982 177.670 0.312 1
1 62 . 15 1 1 A 7 7 ALA CA C 7 54.791 55.166 -0.375 1
1 63 . 15 1 1 A 7 7 ALA CB C 7 18.836 18.756 0.080 1
1 64 . 15 1 1 A 7 7 ALA N N 7 123.078 121.814 1.264 1
1 65 . 15 1 1 A 8 8 GLN H H 8 8.274 7.380 0.894 1
1 66 . 15 1 1 A 8 8 GLN HA H 8 4.219 4.868 -0.649 1
1 73 . 15 1 1 A 8 8 GLN C C 8 176.325 174.948 1.377 1
1 74 . 15 1 1 A 8 8 GLN CA C 8 57.864 54.574 3.290 1
1 75 . 15 1 1 A 8 8 GLN CB C 8 28.768 31.138 -2.370 1
1 77 . 15 1 1 A 8 8 GLN N N 8 117.452 115.809 1.643 1
1 79 . 15 1 1 A 9 9 THR H H 9 8.043 8.733 -0.690 1
1 80 . 15 1 1 A 9 9 THR HA H 9 3.998 5.227 -1.229 1
1 85 . 15 1 1 A 9 9 THR C C 9 173.904 174.857 -0.953 1
1 86 . 15 1 1 A 9 9 THR CA C 9 65.435 60.591 4.844 1
1 87 . 15 1 1 A 9 9 THR CB C 9 68.870 71.819 -2.949 1
1 89 . 15 1 1 A 9 9 THR N N 9 116.135 118.298 -2.163 1
1 90 . 15 1 1 A 10 10 ARG H H 10 8.095 9.051 -0.956 1
1 91 . 15 1 1 A 10 10 ARG HA H 10 4.040 4.117 -0.077 1
1 98 . 15 1 1 A 10 10 ARG C C 10 176.583 176.041 0.542 1
1 99 . 15 1 1 A 10 10 ARG CA C 10 59.262 57.514 1.748 1
1 100 . 15 1 1 A 10 10 ARG CB C 10 29.900 30.095 -0.195 1
1 101 . 15 1 1 A 10 10 ARG N N 10 121.157 125.177 -4.020 1
1 102 . 15 1 1 A 11 11 VAL H H 11 7.657 7.877 -0.220 1
1 103 . 15 1 1 A 11 11 VAL HA H 11 3.769 4.391 -0.622 1
1 111 . 15 1 1 A 11 11 VAL C C 11 176.662 177.714 -1.052 1
1 112 . 15 1 1 A 11 11 VAL CA C 11 65.914 63.325 2.589 1
1 113 . 15 1 1 A 11 11 VAL CB C 11 31.745 33.598 -1.853 1
1 114 . 15 1 1 A 11 11 VAL N N 11 118.580 118.013 0.567 1
1 115 . 15 1 1 A 12 12 LYS H H 12 7.471 8.035 -0.564 1
1 116 . 15 1 1 A 12 12 LYS HA H 12 3.366 4.353 -0.987 1
1 123 . 15 1 1 A 12 12 LYS C C 12 176.457 179.633 -3.176 1
1 124 . 15 1 1 A 12 12 LYS CA C 12 59.545 59.012 0.533 1
1 125 . 15 1 1 A 12 12 LYS CB C 12 32.206 32.098 0.108 1
1 126 . 15 1 1 A 12 12 LYS N N 12 121.835 122.004 -0.169 1
1 127 . 15 1 1 A 13 13 LEU H H 13 8.144 7.941 0.203 1
1 128 . 15 1 1 A 13 13 LEU HA H 13 4.093 3.927 0.166 1
1 137 . 15 1 1 A 13 13 LEU C C 13 178.254 178.685 -0.431 1
1 138 . 15 1 1 A 13 13 LEU CA C 13 58.023 57.807 0.216 1
1 139 . 15 1 1 A 13 13 LEU CB C 13 41.283 41.806 -0.523 1
1 140 . 15 1 1 A 13 13 LEU N N 13 118.688 120.826 -2.138 1
1 141 . 15 1 1 A 14 14 ASN H H 14 8.384 8.476 -0.092 1
1 142 . 15 1 1 A 14 14 ASN HA H 14 4.567 4.397 0.170 1
1 147 . 15 1 1 A 14 14 ASN C C 14 175.397 177.732 -2.335 1
1 148 . 15 1 1 A 14 14 ASN CA C 14 56.239 56.742 -0.503 1
1 149 . 15 1 1 A 14 14 ASN CB C 14 38.432 38.304 0.128 1
1 150 . 15 1 1 A 14 14 ASN N N 14 118.175 116.748 1.427 1
1 152 . 15 1 1 A 15 15 TYR H H 15 7.982 8.099 -0.117 1
1 153 . 15 1 1 A 15 15 TYR HA H 15 4.249 4.089 0.160 1
1 160 . 15 1 1 A 15 15 TYR C C 15 175.503 177.434 -1.931 1
1 161 . 15 1 1 A 15 15 TYR CA C 15 62.450 61.480 0.970 1
1 162 . 15 1 1 A 15 15 TYR CB C 15 39.399 38.650 0.749 1
1 163 . 15 1 1 A 15 15 TYR N N 15 121.955 122.574 -0.619 1
1 164 . 15 1 1 A 16 16 LEU H H 16 8.198 8.500 -0.302 1
1 165 . 15 1 1 A 16 16 LEU HA H 16 4.470 3.731 0.739 1
1 175 . 15 1 1 A 16 16 LEU C C 16 177.125 178.088 -0.963 1
1 176 . 15 1 1 A 16 16 LEU CA C 16 57.374 58.124 -0.750 1
1 177 . 15 1 1 A 16 16 LEU CB C 16 41.443 41.327 0.116 1
1 178 . 15 1 1 A 16 16 LEU N N 16 117.642 120.648 -3.006 1
1 179 . 15 1 1 A 17 17 ASP H H 17 8.061 8.145 -0.084 1
1 180 . 15 1 1 A 17 17 ASP C C 17 177.836 178.222 -0.386 1
1 181 . 15 1 1 A 17 17 ASP CA C 17 57.486 57.557 -0.071 1
1 182 . 15 1 1 A 17 17 ASP CB C 17 41.433 41.849 -0.416 1
1 183 . 15 1 1 A 17 17 ASP N N 17 118.700 118.683 0.017 1
1 184 . 15 1 1 A 18 18 GLN H H 18 8.111 7.837 0.274 1
1 185 . 15 1 1 A 18 18 GLN HA H 18 4.002 4.060 -0.058 1
1 190 . 15 1 1 A 18 18 GLN CA C 18 59.046 58.743 0.303 1
1 191 . 15 1 1 A 18 18 GLN CB C 18 28.700 28.672 0.028 1
1 193 . 15 1 1 A 18 18 GLN N N 18 119.539 118.643 0.896 1
1 195 . 15 1 1 A 19 19 ILE H H 19 8.330 8.233 0.097 1
1 196 . 15 1 1 A 19 19 ILE HA H 19 3.306 3.822 -0.516 1
1 204 . 15 1 1 A 19 19 ILE C C 19 175.608 177.724 -2.116 1
1 205 . 15 1 1 A 19 19 ILE CA C 19 64.760 63.654 1.106 1
1 206 . 15 1 1 A 19 19 ILE CB C 19 37.148 36.746 0.402 1
1 209 . 15 1 1 A 19 19 ILE N N 19 121.490 119.863 1.627 1
1 210 . 15 1 1 A 20 20 ALA H H 20 8.057 7.859 0.198 1
1 211 . 15 1 1 A 20 20 ALA HA H 20 4.349 4.059 0.290 1
1 215 . 15 1 1 A 20 20 ALA C C 20 179.297 179.503 -0.206 1
1 216 . 15 1 1 A 20 20 ALA CA C 20 56.150 55.486 0.664 1
1 217 . 15 1 1 A 20 20 ALA CB C 20 18.104 18.204 -0.100 1
1 218 . 15 1 1 A 20 20 ALA N N 20 124.441 123.902 0.539 1
1 219 . 15 1 1 A 21 21 LYS H H 21 8.116 8.036 0.080 1
1 220 . 15 1 1 A 21 21 LYS HA H 21 4.108 3.971 0.137 1
1 229 . 15 1 1 A 21 21 LYS C C 21 176.720 178.607 -1.887 1
1 230 . 15 1 1 A 21 21 LYS CA C 21 59.166 59.471 -0.305 1
1 231 . 15 1 1 A 21 21 LYS CB C 21 32.085 32.180 -0.095 1
1 233 . 15 1 1 A 21 21 LYS N N 21 119.865 119.008 0.857 1
1 234 . 15 1 1 A 22 22 PHE H H 22 7.875 8.017 -0.142 1
1 235 . 15 1 1 A 22 22 PHE HA H 22 4.012 4.259 -0.247 1
1 242 . 15 1 1 A 22 22 PHE C C 22 175.545 177.787 -2.242 1
1 243 . 15 1 1 A 22 22 PHE CA C 22 61.070 61.624 -0.554 1
1 244 . 15 1 1 A 22 22 PHE CB C 22 39.072 39.718 -0.646 1
1 249 . 15 1 1 A 22 22 PHE N N 22 119.729 119.939 -0.210 1
1 250 . 15 1 1 A 23 23 TRP H H 23 7.841 7.565 0.276 1
1 251 . 15 1 1 A 23 23 TRP HA H 23 4.149 4.005 0.144 1
1 260 . 15 1 1 A 23 23 TRP C C 23 176.668 178.205 -1.537 1
1 261 . 15 1 1 A 23 23 TRP CB C 23 28.543 30.073 -1.530 1
1 267 . 15 1 1 A 23 23 TRP N N 23 119.440 120.865 -1.425 1
1 269 . 15 1 1 A 24 24 GLU H H 24 8.261 8.650 -0.389 1
1 270 . 15 1 1 A 24 24 GLU HA H 24 4.265 3.924 0.341 1
1 275 . 15 1 1 A 24 24 GLU C C 24 179.679 177.501 2.178 1
1 276 . 15 1 1 A 24 24 GLU CA C 24 59.706 58.664 1.042 1
1 277 . 15 1 1 A 24 24 GLU CB C 24 29.720 29.419 0.301 1
1 279 . 15 1 1 A 24 24 GLU N N 24 121.376 118.611 2.765 1
1 280 . 15 1 1 A 25 25 ILE H H 25 8.071 7.482 0.589 1
1 281 . 15 1 1 A 25 25 ILE HA H 25 3.815 4.088 -0.273 1
1 291 . 15 1 1 A 25 25 ILE C C 25 176.343 176.323 0.020 1
1 292 . 15 1 1 A 25 25 ILE CA C 25 64.464 61.223 3.241 1
1 293 . 15 1 1 A 25 25 ILE CB C 25 37.371 38.281 -0.910 1
1 296 . 15 1 1 A 25 25 ILE N N 25 121.499 117.954 3.545 1
1 297 . 15 1 1 A 26 26 GLN H H 26 7.327 6.881 0.446 1
1 298 . 15 1 1 A 26 26 GLN HA H 26 4.074 4.176 -0.102 1
1 305 . 15 1 1 A 26 26 GLN C C 26 174.906 175.061 -0.155 1
1 306 . 15 1 1 A 26 26 GLN CA C 26 55.450 55.047 0.403 1
1 307 . 15 1 1 A 26 26 GLN CB C 26 28.458 27.250 1.208 1
1 309 . 15 1 1 A 26 26 GLN N N 26 116.532 119.995 -3.463 1
1 311 . 15 1 1 A 27 27 GLY H H 27 7.861 8.264 -0.403 1
1 312 . 15 1 1 A 27 27 GLY HA2 H 27 4.297 3.770 0.527 1
1 313 . 15 1 1 A 27 27 GLY HA3 H 27 3.823 3.771 0.052 1
1 314 . 15 1 1 A 27 27 GLY C C 27 172.698 173.235 -0.537 1
1 315 . 15 1 1 A 27 27 GLY CA C 27 45.608 46.131 -0.523 1
1 316 . 15 1 1 A 27 27 GLY N N 27 106.837 108.047 -1.210 1
1 317 . 15 1 1 A 28 28 SER H H 28 8.083 7.273 0.810 1
1 318 . 15 1 1 A 28 28 SER HA H 28 4.777 4.718 0.059 1
1 321 . 15 1 1 A 28 28 SER C C 28 171.196 171.667 -0.471 1
1 322 . 15 1 1 A 28 28 SER CA C 28 56.041 56.912 -0.871 1
1 323 . 15 1 1 A 28 28 SER CB C 28 64.539 66.676 -2.137 1
1 324 . 15 1 1 A 28 28 SER N N 28 116.151 114.328 1.823 1
1 325 . 15 1 1 A 29 29 SER H H 29 8.354 8.376 -0.022 1
1 326 . 15 1 1 A 29 29 SER HA H 29 4.389 5.159 -0.770 1
1 329 . 15 1 1 A 29 29 SER C C 29 172.166 172.035 0.131 1
1 330 . 15 1 1 A 29 29 SER CA C 29 58.107 56.675 1.432 1
1 331 . 15 1 1 A 29 29 SER CB C 29 63.853 66.112 -2.259 1
1 332 . 15 1 1 A 29 29 SER N N 29 116.596 114.498 2.098 1
1 333 . 15 1 1 A 30 30 LEU H H 30 8.990 8.960 0.030 1
1 334 . 15 1 1 A 30 30 LEU HA H 30 3.964 4.963 -0.999 1
1 344 . 15 1 1 A 30 30 LEU C C 30 173.752 174.908 -1.156 1
1 345 . 15 1 1 A 30 30 LEU CA C 30 55.193 54.101 1.092 1
1 346 . 15 1 1 A 30 30 LEU CB C 30 42.869 43.135 -0.266 1
1 349 . 15 1 1 A 30 30 LEU N N 30 125.860 127.117 -1.257 1
1 350 . 15 1 1 A 31 31 LYS H H 31 8.118 8.873 -0.755 1
1 351 . 15 1 1 A 31 31 LYS HA H 31 4.498 4.835 -0.337 1
1 360 . 15 1 1 A 31 31 LYS C C 31 173.555 175.301 -1.746 1
1 361 . 15 1 1 A 31 31 LYS CA C 31 54.372 55.123 -0.751 1
1 362 . 15 1 1 A 31 31 LYS CB C 31 32.814 33.285 -0.471 1
1 365 . 15 1 1 A 31 31 LYS N N 31 129.965 126.884 3.081 1
1 366 . 15 1 1 A 32 32 ILE H H 32 8.717 8.359 0.358 1
1 367 . 15 1 1 A 32 32 ILE HA H 32 4.011 4.380 -0.369 1
1 377 . 15 1 1 A 32 32 ILE C C 32 173.038 175.378 -2.340 1
1 378 . 15 1 1 A 32 32 ILE CA C 32 59.921 59.489 0.432 1
1 379 . 15 1 1 A 32 32 ILE CB C 32 38.139 37.910 0.229 1
1 382 . 15 1 1 A 32 32 ILE N N 32 127.091 123.270 3.821 1
1 383 . 15 1 1 A 33 33 PRO HA H 33 4.412 4.584 -0.172 1
1 390 . 15 1 1 A 33 33 PRO C C 33 172.724 175.884 -3.160 1
1 391 . 15 1 1 A 33 33 PRO CA C 33 62.565 62.334 0.231 1
1 392 . 15 1 1 A 33 33 PRO CB C 33 32.728 32.870 -0.142 1
1 394 . 15 1 1 A 34 34 ASN H H 34 8.265 8.529 -0.264 1
1 395 . 15 1 1 A 34 34 ASN HA H 34 5.147 5.657 -0.510 1
1 400 . 15 1 1 A 34 34 ASN C C 34 174.079 173.174 0.905 1
1 401 . 15 1 1 A 34 34 ASN CA C 34 52.088 51.667 0.421 1
1 402 . 15 1 1 A 34 34 ASN CB C 34 40.387 42.849 -2.462 1
1 403 . 15 1 1 A 34 34 ASN N N 34 116.424 115.015 1.409 1
1 405 . 15 1 1 A 35 35 VAL H H 35 8.904 9.160 -0.256 1
1 406 . 15 1 1 A 35 35 VAL HA H 35 4.159 4.570 -0.411 1
1 414 . 15 1 1 A 35 35 VAL C C 35 173.834 175.624 -1.790 1
1 415 . 15 1 1 A 35 35 VAL CA C 35 61.953 59.606 2.347 1
1 416 . 15 1 1 A 35 35 VAL CB C 35 34.432 34.595 -0.163 1
1 419 . 15 1 1 A 35 35 VAL N N 35 122.778 118.987 3.791 1
1 420 . 15 1 1 A 36 36 GLU H H 36 9.560 9.116 0.444 1
1 421 . 15 1 1 A 36 36 GLU HA H 36 3.819 4.131 -0.312 1
1 426 . 15 1 1 A 36 36 GLU C C 36 173.604 175.871 -2.267 1
1 427 . 15 1 1 A 36 36 GLU CA C 36 57.131 57.355 -0.224 1
1 428 . 15 1 1 A 36 36 GLU CB C 36 27.464 27.375 0.089 1
1 430 . 15 1 1 A 36 36 GLU N N 36 127.014 128.219 -1.205 1
1 431 . 15 1 1 A 37 37 ARG H H 37 8.578 8.467 0.111 1
1 432 . 15 1 1 A 37 37 ARG HA H 37 3.792 3.948 -0.156 1
1 439 . 15 1 1 A 37 37 ARG C C 37 173.371 175.082 -1.711 1
1 440 . 15 1 1 A 37 37 ARG CA C 37 57.952 58.005 -0.053 1
1 441 . 15 1 1 A 37 37 ARG CB C 37 27.657 27.927 -0.270 1
1 443 . 15 1 1 A 37 37 ARG N N 37 108.362 113.396 -5.034 1
1 444 . 15 1 1 A 38 38 ARG H H 38 7.696 8.193 -0.497 1
1 445 . 15 1 1 A 38 38 ARG HA H 38 4.743 4.685 0.058 1
1 452 . 15 1 1 A 38 38 ARG C C 38 173.513 175.304 -1.791 1
1 453 . 15 1 1 A 38 38 ARG CA C 38 54.507 55.394 -0.887 1
1 454 . 15 1 1 A 38 38 ARG CB C 38 33.751 31.884 1.867 1
1 456 . 15 1 1 A 38 38 ARG N N 38 118.370 119.299 -0.929 1
1 457 . 15 1 1 A 39 39 ILE H H 39 8.463 8.547 -0.084 1
1 458 . 15 1 1 A 39 39 ILE HA H 39 4.184 4.390 -0.206 1
1 468 . 15 1 1 A 39 39 ILE C C 39 175.150 175.814 -0.664 1
1 469 . 15 1 1 A 39 39 ILE CA C 39 62.076 61.500 0.576 1
1 470 . 15 1 1 A 39 39 ILE CB C 39 38.864 39.314 -0.450 1
1 473 . 15 1 1 A 39 39 ILE N N 39 123.604 126.641 -3.037 1
1 474 . 15 1 1 A 40 40 LEU H H 40 8.239 8.246 -0.007 1
1 475 . 15 1 1 A 40 40 LEU HA H 40 4.259 4.556 -0.297 1
1 485 . 15 1 1 A 40 40 LEU C C 40 173.152 175.433 -2.281 1
1 486 . 15 1 1 A 40 40 LEU CA C 40 55.305 54.718 0.587 1
1 487 . 15 1 1 A 40 40 LEU CB C 40 43.113 42.041 1.072 1
1 490 . 15 1 1 A 40 40 LEU N N 40 129.550 129.100 0.450 1
1 491 . 15 1 1 A 41 41 ASP H H 41 8.992 8.406 0.586 1
1 492 . 15 1 1 A 41 41 ASP HA H 41 4.798 4.794 0.004 1
1 495 . 15 1 1 A 41 41 ASP C C 41 173.837 176.398 -2.561 1
1 496 . 15 1 1 A 41 41 ASP CA C 41 52.077 53.517 -1.440 1
1 497 . 15 1 1 A 41 41 ASP CB C 41 39.454 40.487 -1.033 1
1 498 . 15 1 1 A 41 41 ASP N N 41 127.022 127.840 -0.818 1
1 499 . 15 1 1 A 42 42 LEU H H 42 7.912 8.273 -0.361 1
1 500 . 15 1 1 A 42 42 LEU HA H 42 3.970 4.117 -0.147 1
1 510 . 15 1 1 A 42 42 LEU C C 42 176.305 178.118 -1.813 1
1 511 . 15 1 1 A 42 42 LEU CA C 42 58.128 57.699 0.429 1
1 512 . 15 1 1 A 42 42 LEU CB C 42 43.043 41.931 1.112 1
1 514 . 15 1 1 A 42 42 LEU N N 42 125.064 128.459 -3.395 1
1 515 . 15 1 1 A 43 43 TYR H H 43 8.565 7.885 0.680 1
1 516 . 15 1 1 A 43 43 TYR HA H 43 3.728 4.216 -0.488 1
1 523 . 15 1 1 A 43 43 TYR C C 43 175.757 178.285 -2.528 1
1 524 . 15 1 1 A 43 43 TYR CA C 43 61.774 60.420 1.354 1
1 525 . 15 1 1 A 43 43 TYR CB C 43 38.235 38.105 0.130 1
1 528 . 15 1 1 A 43 43 TYR N N 43 117.822 119.469 -1.647 1
1 529 . 15 1 1 A 44 44 SER H H 44 8.115 8.315 -0.200 1
1 530 . 15 1 1 A 44 44 SER HA H 44 3.854 4.179 -0.325 1
1 533 . 15 1 1 A 44 44 SER C C 44 174.080 177.237 -3.157 1
1 534 . 15 1 1 A 44 44 SER CA C 44 61.873 61.351 0.522 1
1 535 . 15 1 1 A 44 44 SER CB C 44 64.350 62.922 1.428 1
1 536 . 15 1 1 A 44 44 SER N N 44 116.835 115.315 1.520 1
1 537 . 15 1 1 A 45 45 LEU H H 45 8.401 7.823 0.578 1
1 538 . 15 1 1 A 45 45 LEU HA H 45 4.102 4.208 -0.106 1
1 548 . 15 1 1 A 45 45 LEU C C 45 175.081 178.632 -3.551 1
1 549 . 15 1 1 A 45 45 LEU CA C 45 58.896 57.878 1.018 1
1 550 . 15 1 1 A 45 45 LEU CB C 45 41.741 41.436 0.305 1
1 553 . 15 1 1 A 45 45 LEU N N 45 120.621 123.011 -2.390 1
1 554 . 15 1 1 A 46 46 SER H H 46 8.110 8.464 -0.354 1
1 555 . 15 1 1 A 46 46 SER HA H 46 4.300 4.255 0.045 1
1 558 . 15 1 1 A 46 46 SER C C 46 175.019 176.532 -1.513 1
1 559 . 15 1 1 A 46 46 SER CA C 46 62.610 61.517 1.093 1
1 560 . 15 1 1 A 46 46 SER CB C 46 64.092 62.658 1.434 1
1 561 . 15 1 1 A 46 46 SER N N 46 112.826 115.087 -2.261 1
1 562 . 15 1 1 A 47 47 LYS H H 47 7.732 8.031 -0.299 1
1 563 . 15 1 1 A 47 47 LYS HA H 47 3.900 4.157 -0.257 1
1 572 . 15 1 1 A 47 47 LYS C C 47 177.441 178.924 -1.483 1
1 573 . 15 1 1 A 47 47 LYS CA C 47 58.575 59.006 -0.431 1
1 574 . 15 1 1 A 47 47 LYS CB C 47 32.351 32.142 0.209 1
1 576 . 15 1 1 A 47 47 LYS N N 47 121.210 119.281 1.929 1
1 577 . 15 1 1 A 48 48 ILE H H 48 8.672 8.091 0.581 1
1 578 . 15 1 1 A 48 48 ILE HA H 48 3.628 3.713 -0.085 1
1 588 . 15 1 1 A 48 48 ILE C C 48 175.861 178.245 -2.384 1
1 589 . 15 1 1 A 48 48 ILE CA C 48 64.188 65.122 -0.934 1
1 590 . 15 1 1 A 48 48 ILE CB C 48 37.954 37.733 0.221 1
1 593 . 15 1 1 A 48 48 ILE N N 48 120.810 121.103 -0.293 1
1 594 . 15 1 1 A 49 49 VAL H H 49 8.030 8.152 -0.122 1
1 595 . 15 1 1 A 49 49 VAL HA H 49 3.195 3.747 -0.552 1
1 603 . 15 1 1 A 49 49 VAL C C 49 176.513 178.230 -1.717 1
1 604 . 15 1 1 A 49 49 VAL CA C 49 66.760 67.030 -0.270 1
1 605 . 15 1 1 A 49 49 VAL CB C 49 30.935 31.776 -0.841 1
1 608 . 15 1 1 A 49 49 VAL N N 49 119.350 119.532 -0.182 1
1 609 . 15 1 1 A 50 50 VAL H H 50 7.336 8.206 -0.870 1
1 610 . 15 1 1 A 50 50 VAL HA H 50 3.497 3.679 -0.182 1
1 618 . 15 1 1 A 50 50 VAL C C 50 178.745 178.383 0.362 1
1 619 . 15 1 1 A 50 50 VAL CA C 50 67.384 66.794 0.590 1
1 620 . 15 1 1 A 50 50 VAL CB C 50 31.832 31.447 0.385 1
1 621 . 15 1 1 A 50 50 VAL N N 50 118.610 120.889 -2.279 1
1 622 . 15 1 1 A 51 51 GLU H H 51 8.318 8.419 -0.101 1
1 623 . 15 1 1 A 51 51 GLU HA H 51 3.953 3.995 -0.042 1
1 628 . 15 1 1 A 51 51 GLU C C 51 177.281 179.379 -2.098 1
1 629 . 15 1 1 A 51 51 GLU CA C 51 59.668 59.226 0.442 1
1 630 . 15 1 1 A 51 51 GLU CB C 51 30.131 29.308 0.823 1
1 632 . 15 1 1 A 51 51 GLU N N 51 122.096 119.819 2.277 1
1 633 . 15 1 1 A 52 52 GLU H H 52 8.065 8.372 -0.307 1
1 634 . 15 1 1 A 52 52 GLU HA H 52 4.229 4.257 -0.028 1
1 639 . 15 1 1 A 52 52 GLU C C 52 173.534 176.724 -3.190 1
1 640 . 15 1 1 A 52 52 GLU CA C 52 55.547 56.536 -0.989 1
1 641 . 15 1 1 A 52 52 GLU CB C 52 28.716 29.950 -1.234 1
1 643 . 15 1 1 A 52 52 GLU N N 52 114.992 116.136 -1.144 1
1 644 . 15 1 1 A 53 53 GLY H H 53 7.459 9.050 -1.591 1
1 645 . 15 1 1 A 53 53 GLY HA2 H 53 3.630 3.971 -0.341 1
1 646 . 15 1 1 A 53 53 GLY HA3 H 53 3.630 3.989 -0.359 1
1 647 . 15 1 1 A 53 53 GLY C C 53 173.214 173.694 -0.480 1
1 648 . 15 1 1 A 53 53 GLY CA C 53 44.962 45.118 -0.156 1
1 649 . 15 1 1 A 53 53 GLY N N 53 104.909 108.038 -3.129 1
1 650 . 15 1 1 A 54 54 GLY H H 54 8.533 7.253 1.280 1
1 651 . 15 1 1 A 54 54 GLY HA2 H 54 3.548 4.072 -0.524 1
1 652 . 15 1 1 A 54 54 GLY HA3 H 54 4.521 4.123 0.398 1
1 653 . 15 1 1 A 54 54 GLY C C 54 169.966 174.661 -4.695 1
1 654 . 15 1 1 A 54 54 GLY CA C 54 43.988 45.750 -1.762 1
1 655 . 15 1 1 A 54 54 GLY N N 54 110.587 107.986 2.601 1
1 656 . 15 1 1 A 55 55 TYR H H 55 8.704 8.676 0.028 1
1 657 . 15 1 1 A 55 55 TYR HA H 55 3.618 3.977 -0.359 1
1 664 . 15 1 1 A 55 55 TYR C C 55 174.807 177.302 -2.495 1
1 665 . 15 1 1 A 55 55 TYR CA C 55 62.540 61.785 0.755 1
1 666 . 15 1 1 A 55 55 TYR CB C 55 39.669 39.411 0.258 1
1 669 . 15 1 1 A 55 55 TYR N N 55 119.168 122.161 -2.993 1
1 670 . 15 1 1 A 56 56 GLU H H 56 9.006 8.304 0.702 1
1 671 . 15 1 1 A 56 56 GLU HA H 56 3.638 3.536 0.102 1
1 676 . 15 1 1 A 56 56 GLU C C 56 177.400 178.186 -0.786 1
1 677 . 15 1 1 A 56 56 GLU CA C 56 60.530 59.594 0.936 1
1 678 . 15 1 1 A 56 56 GLU CB C 56 29.168 29.420 -0.252 1
1 679 . 15 1 1 A 56 56 GLU N N 56 118.969 119.478 -0.509 1
1 680 . 15 1 1 A 57 57 ALA H H 57 8.235 7.806 0.429 1
1 681 . 15 1 1 A 57 57 ALA HA H 57 3.980 3.995 -0.015 1
1 685 . 15 1 1 A 57 57 ALA C C 57 177.678 179.641 -1.963 1
1 686 . 15 1 1 A 57 57 ALA CA C 57 54.910 55.094 -0.184 1
1 687 . 15 1 1 A 57 57 ALA CB C 57 18.122 18.225 -0.103 1
1 688 . 15 1 1 A 57 57 ALA N N 57 122.860 121.627 1.233 1
1 689 . 15 1 1 A 58 58 ILE H H 58 7.831 7.359 0.472 1
1 690 . 15 1 1 A 58 58 ILE HA H 58 3.189 3.153 0.036 1
1 700 . 15 1 1 A 58 58 ILE C C 58 177.818 177.090 0.728 1
1 701 . 15 1 1 A 58 58 ILE CA C 58 65.074 65.163 -0.089 1
1 702 . 15 1 1 A 58 58 ILE CB C 58 38.178 37.111 1.067 1
1 706 . 15 1 1 A 58 58 ILE N N 58 117.418 117.641 -0.223 1
1 707 . 15 1 1 A 59 59 CYS H H 59 7.760 8.002 -0.242 1
1 708 . 15 1 1 A 59 59 CYS HA H 59 4.203 4.184 0.019 1
1 711 . 15 1 1 A 59 59 CYS C C 59 176.357 177.079 -0.722 1
1 712 . 15 1 1 A 59 59 CYS CA C 59 63.760 61.850 1.910 1
1 713 . 15 1 1 A 59 59 CYS CB C 59 27.638 27.034 0.604 1
1 714 . 15 1 1 A 59 59 CYS N N 59 115.302 120.278 -4.976 1
1 715 . 15 1 1 A 60 60 LYS H H 60 8.350 8.107 0.243 1
1 716 . 15 1 1 A 60 60 LYS HA H 60 3.972 4.027 -0.055 1
1 725 . 15 1 1 A 60 60 LYS C C 60 176.373 177.542 -1.169 1
1 726 . 15 1 1 A 60 60 LYS CA C 60 59.796 58.972 0.824 1
1 727 . 15 1 1 A 60 60 LYS CB C 60 32.560 32.243 0.317 1
1 729 . 15 1 1 A 60 60 LYS N N 60 122.343 121.086 1.257 1
1 730 . 15 1 1 A 61 61 ASP H H 61 8.157 7.601 0.556 1
1 731 . 15 1 1 A 61 61 ASP HA H 61 4.616 4.644 -0.028 1
1 734 . 15 1 1 A 61 61 ASP C C 61 173.246 175.659 -2.413 1
1 735 . 15 1 1 A 61 61 ASP CA C 61 54.272 54.282 -0.010 1
1 736 . 15 1 1 A 61 61 ASP CB C 61 41.023 41.066 -0.043 1
1 737 . 15 1 1 A 61 61 ASP N N 61 116.173 118.581 -2.408 1
1 738 . 15 1 1 A 62 62 ARG H H 62 7.655 7.765 -0.110 1
1 739 . 15 1 1 A 62 62 ARG HA H 62 4.149 3.936 0.213 1
1 746 . 15 1 1 A 62 62 ARG C C 62 175.891 176.159 -0.268 1
1 747 . 15 1 1 A 62 62 ARG CA C 62 57.381 57.147 0.234 1
1 748 . 15 1 1 A 62 62 ARG CB C 62 26.538 29.325 -2.787 1
1 750 . 15 1 1 A 62 62 ARG N N 62 117.213 118.467 -1.254 1
1 751 . 15 1 1 A 63 63 ARG H H 63 8.302 7.966 0.336 1
1 752 . 15 1 1 A 63 63 ARG HA H 63 4.240 4.067 0.173 1
1 757 . 15 1 1 A 63 63 ARG C C 63 175.775 178.628 -2.853 1
1 758 . 15 1 1 A 63 63 ARG CA C 63 55.718 57.550 -1.832 1
1 760 . 15 1 1 A 63 63 ARG N N 63 116.292 117.824 -1.532 1
1 761 . 15 1 1 A 64 64 TRP H H 64 8.161 7.577 0.584 1
1 762 . 15 1 1 A 64 64 TRP HA H 64 3.836 4.486 -0.650 1
1 771 . 15 1 1 A 64 64 TRP C C 64 176.862 178.679 -1.817 1
1 772 . 15 1 1 A 64 64 TRP CA C 64 62.036 59.961 2.075 1
1 773 . 15 1 1 A 64 64 TRP CB C 64 27.028 28.721 -1.693 1
1 779 . 15 1 1 A 64 64 TRP N N 64 121.486 119.948 1.538 1
1 781 . 15 1 1 A 65 65 ALA H H 65 8.954 7.955 0.999 1
1 782 . 15 1 1 A 65 65 ALA HA H 65 4.290 4.082 0.208 1
1 786 . 15 1 1 A 65 65 ALA C C 65 178.986 179.372 -0.386 1
1 787 . 15 1 1 A 65 65 ALA CA C 65 55.314 55.403 -0.089 1
1 788 . 15 1 1 A 65 65 ALA CB C 65 18.119 18.170 -0.051 1
1 789 . 15 1 1 A 65 65 ALA N N 65 121.559 122.338 -0.779 1
1 790 . 15 1 1 A 66 66 ARG H H 66 7.473 7.974 -0.501 1
1 791 . 15 1 1 A 66 66 ARG HA H 66 4.221 4.119 0.102 1
1 798 . 15 1 1 A 66 66 ARG C C 66 176.670 178.630 -1.960 1
1 799 . 15 1 1 A 66 66 ARG CA C 66 57.871 59.056 -1.185 1
1 800 . 15 1 1 A 66 66 ARG CB C 66 29.097 29.742 -0.645 1
1 801 . 15 1 1 A 66 66 ARG N N 66 119.915 117.276 2.639 1
1 802 . 15 1 1 A 67 67 VAL H H 67 7.134 8.006 -0.872 1
1 803 . 15 1 1 A 67 67 VAL HA H 67 3.304 3.653 -0.349 1
1 811 . 15 1 1 A 67 67 VAL C C 67 175.341 178.032 -2.691 1
1 812 . 15 1 1 A 67 67 VAL CA C 67 66.722 66.480 0.242 1
1 813 . 15 1 1 A 67 67 VAL CB C 67 31.108 31.750 -0.642 1
1 816 . 15 1 1 A 67 67 VAL N N 67 119.970 120.850 -0.880 1
1 817 . 15 1 1 A 68 68 ALA H H 68 7.745 8.579 -0.834 1
1 818 . 15 1 1 A 68 68 ALA HA H 68 4.076 4.240 -0.164 1
1 822 . 15 1 1 A 68 68 ALA C C 68 177.358 180.488 -3.130 1
1 823 . 15 1 1 A 68 68 ALA CA C 68 55.607 56.083 -0.476 1
1 824 . 15 1 1 A 68 68 ALA CB C 68 18.061 18.261 -0.200 1
1 825 . 15 1 1 A 68 68 ALA N N 68 118.239 122.622 -4.383 1
1 826 . 15 1 1 A 69 69 GLN H H 69 7.979 8.360 -0.381 1
1 827 . 15 1 1 A 69 69 GLN HA H 69 4.310 4.137 0.173 1
1 834 . 15 1 1 A 69 69 GLN C C 69 179.370 178.804 0.566 1
1 835 . 15 1 1 A 69 69 GLN CA C 69 59.307 58.468 0.839 1
1 836 . 15 1 1 A 69 69 GLN CB C 69 29.257 28.447 0.810 1
1 838 . 15 1 1 A 69 69 GLN N N 69 118.484 117.120 1.364 1
1 840 . 15 1 1 A 70 70 ARG H H 70 8.374 8.065 0.309 1
1 841 . 15 1 1 A 70 70 ARG HA H 70 4.148 4.105 0.043 1
1 848 . 15 1 1 A 70 70 ARG C C 70 175.850 177.975 -2.125 1
1 849 . 15 1 1 A 70 70 ARG CA C 70 58.957 58.557 0.400 1
1 850 . 15 1 1 A 70 70 ARG CB C 70 29.799 30.010 -0.211 1
1 852 . 15 1 1 A 70 70 ARG N N 70 120.309 120.812 -0.503 1
1 853 . 15 1 1 A 71 71 LEU H H 71 7.413 7.701 -0.288 1
1 854 . 15 1 1 A 71 71 LEU HA H 71 4.341 4.200 0.141 1
1 864 . 15 1 1 A 71 71 LEU C C 71 173.391 175.531 -2.140 1
1 865 . 15 1 1 A 71 71 LEU CA C 71 54.911 54.741 0.170 1
1 866 . 15 1 1 A 71 71 LEU CB C 71 42.693 41.622 1.071 1
1 867 . 15 1 1 A 71 71 LEU N N 71 118.841 117.602 1.239 1
1 868 . 15 1 1 A 72 72 ASN H H 72 8.038 7.940 0.098 1
1 869 . 15 1 1 A 72 72 ASN HA H 72 4.394 4.316 0.078 1
1 874 . 15 1 1 A 72 72 ASN C C 72 173.042 174.206 -1.164 1
1 875 . 15 1 1 A 72 72 ASN CB C 72 36.412 36.775 -0.363 1
1 876 . 15 1 1 A 72 72 ASN N N 72 112.919 114.536 -1.617 1
1 878 . 15 1 1 A 73 73 TYR H H 73 7.874 7.507 0.367 1
1 879 . 15 1 1 A 73 73 TYR HA H 73 4.868 4.862 0.006 1
1 886 . 15 1 1 A 73 73 TYR C C 73 172.194 173.954 -1.760 1
1 887 . 15 1 1 A 73 73 TYR CA C 73 57.105 56.608 0.497 1
1 888 . 15 1 1 A 73 73 TYR CB C 73 37.918 38.303 -0.385 1
1 889 . 15 1 1 A 73 73 TYR N N 73 117.432 118.976 -1.544 1
1 897 . 15 1 1 A 75 75 PRO HA H 75 4.626 4.253 0.373 1
1 902 . 15 1 1 A 75 75 PRO C C 75 175.728 177.274 -1.546 1
1 903 . 15 1 1 A 75 75 PRO CA C 75 62.502 63.733 -1.231 1
1 904 . 15 1 1 A 75 75 PRO CB C 75 32.339 31.945 0.394 1
1 905 . 15 1 1 A 76 76 GLY H H 76 8.369 8.883 -0.514 1
1 906 . 15 1 1 A 76 76 GLY HA2 H 76 4.057 3.920 0.137 1
1 907 . 15 1 1 A 76 76 GLY HA3 H 76 4.556 3.921 0.635 1
1 908 . 15 1 1 A 76 76 GLY C C 76 173.248 174.999 -1.751 1
1 909 . 15 1 1 A 76 76 GLY CA C 76 46.180 45.391 0.789 1
1 910 . 15 1 1 A 76 76 GLY N N 76 106.185 111.120 -4.935 1
1 911 . 15 1 1 A 77 77 LYS H H 77 8.632 8.052 0.580 1
1 912 . 15 1 1 A 77 77 LYS HA H 77 4.433 4.282 0.151 1
1 921 . 15 1 1 A 77 77 LYS C C 77 174.924 176.192 -1.268 1
1 922 . 15 1 1 A 77 77 LYS CA C 77 56.453 57.697 -1.244 1
1 923 . 15 1 1 A 77 77 LYS CB C 77 33.170 29.324 3.846 1
1 925 . 15 1 1 A 77 77 LYS N N 77 119.592 116.008 3.584 1
1 926 . 15 1 1 A 78 78 ASN H H 78 8.865 8.132 0.733 1
1 927 . 15 1 1 A 78 78 ASN HA H 78 4.654 4.494 0.160 1
1 932 . 15 1 1 A 78 78 ASN C C 78 174.869 178.199 -3.330 1
1 933 . 15 1 1 A 78 78 ASN CA C 78 54.117 56.442 -2.325 1
1 934 . 15 1 1 A 78 78 ASN CB C 78 37.841 38.299 -0.458 1
1 935 . 15 1 1 A 78 78 ASN N N 78 116.880 116.566 0.314 1
1 937 . 15 1 1 A 79 79 ILE H H 79 8.008 8.228 -0.220 1
1 938 . 15 1 1 A 79 79 ILE HA H 79 3.718 3.671 0.047 1
1 948 . 15 1 1 A 79 79 ILE C C 79 175.921 178.045 -2.124 1
1 949 . 15 1 1 A 79 79 ILE CA C 79 63.618 64.567 -0.949 1
1 950 . 15 1 1 A 79 79 ILE CB C 79 37.158 36.912 0.246 1
1 952 . 15 1 1 A 79 79 ILE N N 79 119.688 120.751 -1.063 1
1 953 . 15 1 1 A 80 80 GLY H H 80 9.062 8.116 0.946 1
1 954 . 15 1 1 A 80 80 GLY HA2 H 80 3.739 3.839 -0.100 1
1 955 . 15 1 1 A 80 80 GLY HA3 H 80 3.739 3.839 -0.100 1
1 956 . 15 1 1 A 80 80 GLY C C 80 173.185 176.128 -2.943 1
1 957 . 15 1 1 A 80 80 GLY CA C 80 48.166 47.483 0.683 1
1 958 . 15 1 1 A 80 80 GLY N N 80 110.338 109.003 1.335 1
1 959 . 15 1 1 A 81 81 SER H H 81 7.460 7.570 -0.110 1
1 960 . 15 1 1 A 81 81 SER HA H 81 3.904 4.140 -0.236 1
1 963 . 15 1 1 A 81 81 SER C C 81 174.999 176.012 -1.013 1
1 964 . 15 1 1 A 81 81 SER CA C 81 61.138 62.562 -1.424 1
1 965 . 15 1 1 A 81 81 SER CB C 81 62.740 62.867 -0.127 1
1 966 . 15 1 1 A 81 81 SER N N 81 115.348 119.636 -4.288 1
1 967 . 15 1 1 A 82 82 LEU H H 82 7.367 7.340 0.027 1
1 968 . 15 1 1 A 82 82 LEU HA H 82 3.946 3.807 0.139 1
1 977 . 15 1 1 A 82 82 LEU C C 82 176.969 177.799 -0.830 1
1 978 . 15 1 1 A 82 82 LEU CA C 82 57.504 57.878 -0.374 1
1 979 . 15 1 1 A 82 82 LEU CB C 82 42.185 41.029 1.156 1
1 980 . 15 1 1 A 82 82 LEU N N 82 124.267 122.632 1.635 1
1 981 . 15 1 1 A 83 83 LEU H H 83 8.330 8.536 -0.206 1
1 982 . 15 1 1 A 83 83 LEU HA H 83 3.924 3.846 0.078 1
1 991 . 15 1 1 A 83 83 LEU C C 83 176.303 178.202 -1.899 1
1 992 . 15 1 1 A 83 83 LEU CA C 83 58.067 58.120 -0.053 1
1 993 . 15 1 1 A 83 83 LEU CB C 83 41.061 41.390 -0.329 1
1 994 . 15 1 1 A 83 83 LEU N N 83 117.452 119.691 -2.239 1
1 995 . 15 1 1 A 84 84 ARG H H 84 7.651 7.978 -0.327 1
1 996 . 15 1 1 A 84 84 ARG HA H 84 2.230 3.509 -1.279 1
1 1003 . 15 1 1 A 84 84 ARG C C 84 175.902 178.072 -2.170 1
1 1004 . 15 1 1 A 84 84 ARG CA C 84 59.112 59.387 -0.275 1
1 1005 . 15 1 1 A 84 84 ARG CB C 84 28.579 29.785 -1.206 1
1 1007 . 15 1 1 A 84 84 ARG N N 84 119.586 119.936 -0.350 1
1 1008 . 15 1 1 A 85 85 SER H H 85 7.291 8.370 -1.079 1
1 1009 . 15 1 1 A 85 85 SER HA H 85 4.189 4.269 -0.080 1
1 1012 . 15 1 1 A 85 85 SER C C 85 175.546 177.411 -1.865 1
1 1013 . 15 1 1 A 85 85 SER CA C 85 61.376 61.363 0.013 1
1 1014 . 15 1 1 A 85 85 SER CB C 85 62.805 62.260 0.545 1
1 1015 . 15 1 1 A 85 85 SER N N 85 112.921 115.013 -2.092 1
1 1016 . 15 1 1 A 86 86 HIS H H 86 8.156 7.730 0.426 1
1 1017 . 15 1 1 A 86 86 HIS HA H 86 4.782 4.179 0.603 1
1 1022 . 15 1 1 A 86 86 HIS C C 86 176.851 177.554 -0.703 1
1 1023 . 15 1 1 A 86 86 HIS CA C 86 58.898 59.625 -0.727 1
1 1024 . 15 1 1 A 86 86 HIS CB C 86 31.110 29.728 1.382 1
1 1027 . 15 1 1 A 86 86 HIS N N 86 119.258 119.218 0.040 1
1 1028 . 15 1 1 A 87 87 TYR H H 87 9.180 8.342 0.838 1
1 1029 . 15 1 1 A 87 87 TYR HA H 87 3.913 3.859 0.054 1
1 1036 . 15 1 1 A 87 87 TYR C C 87 176.841 177.195 -0.354 1
1 1037 . 15 1 1 A 87 87 TYR CA C 87 63.526 61.239 2.287 1
1 1038 . 15 1 1 A 87 87 TYR CB C 87 39.431 38.210 1.221 1
1 1041 . 15 1 1 A 87 87 TYR N N 87 120.625 119.771 0.854 1
1 1042 . 15 1 1 A 88 88 GLU H H 88 9.028 8.301 0.727 1
1 1043 . 15 1 1 A 88 88 GLU HA H 88 3.682 3.943 -0.261 1
1 1048 . 15 1 1 A 88 88 GLU C C 88 175.833 179.411 -3.578 1
1 1049 . 15 1 1 A 88 88 GLU CA C 88 59.730 60.249 -0.519 1
1 1050 . 15 1 1 A 88 88 GLU CB C 88 30.009 29.414 0.595 1
1 1052 . 15 1 1 A 88 88 GLU N N 88 119.531 117.917 1.614 1
1 1053 . 15 1 1 A 89 89 ARG H H 89 8.052 7.905 0.147 1
1 1054 . 15 1 1 A 89 89 ARG HA H 89 4.292 4.299 -0.007 1
1 1061 . 15 1 1 A 89 89 ARG C C 89 176.045 177.616 -1.571 1
1 1062 . 15 1 1 A 89 89 ARG CA C 89 58.538 58.445 0.093 1
1 1063 . 15 1 1 A 89 89 ARG CB C 89 31.841 30.933 0.908 1
1 1065 . 15 1 1 A 89 89 ARG N N 89 114.741 118.071 -3.330 1
1 1066 . 15 1 1 A 90 90 ILE H H 90 8.141 7.666 0.475 1
1 1067 . 15 1 1 A 90 90 ILE HA H 90 4.296 3.689 0.607 1
1 1075 . 15 1 1 A 90 90 ILE C C 90 174.461 177.139 -2.678 1
1 1076 . 15 1 1 A 90 90 ILE CA C 90 63.649 62.892 0.757 1
1 1077 . 15 1 1 A 90 90 ILE CB C 90 40.626 38.864 1.762 1
1 1079 . 15 1 1 A 90 90 ILE N N 90 113.421 118.537 -5.116 1
1 1080 . 15 1 1 A 91 91 VAL H H 91 7.350 7.687 -0.337 1
1 1081 . 15 1 1 A 91 91 VAL HA H 91 4.144 3.733 0.411 1
1 1089 . 15 1 1 A 91 91 VAL C C 91 175.422 176.985 -1.563 1
1 1090 . 15 1 1 A 91 91 VAL CA C 91 65.042 63.854 1.188 1
1 1091 . 15 1 1 A 91 91 VAL CB C 91 33.215 31.415 1.800 1
1 1092 . 15 1 1 A 91 91 VAL N N 91 118.215 120.386 -2.171 1
1 1093 . 15 1 1 A 92 92 TYR H H 92 8.565 8.149 0.416 1
1 1094 . 15 1 1 A 92 92 TYR HA H 92 4.217 4.243 -0.026 1
1 1099 . 15 1 1 A 92 92 TYR C C 92 171.495 175.067 -3.572 1
1 1100 . 15 1 1 A 92 92 TYR CA C 92 61.558 62.397 -0.839 1
1 1101 . 15 1 1 A 92 92 TYR CB C 92 36.757 37.467 -0.710 1
1 1102 . 15 1 1 A 92 92 TYR N N 92 121.370 122.008 -0.638 1
1 1103 . 15 1 1 A 93 93 PRO HA H 93 4.136 4.294 -0.158 1
1 1108 . 15 1 1 A 93 93 PRO C C 93 177.077 178.474 -1.397 1
1 1109 . 15 1 1 A 93 93 PRO CA C 93 66.037 65.973 0.064 1
1 1110 . 15 1 1 A 93 93 PRO CB C 93 31.482 30.705 0.777 1
1 1111 . 15 1 1 A 94 94 TYR H H 94 6.517 7.481 -0.964 1
1 1112 . 15 1 1 A 94 94 TYR HA H 94 2.798 4.279 -1.481 1
1 1119 . 15 1 1 A 94 94 TYR C C 94 174.985 178.047 -3.062 1
1 1120 . 15 1 1 A 94 94 TYR CA C 94 59.356 60.033 -0.677 1
1 1121 . 15 1 1 A 94 94 TYR CB C 94 37.987 37.095 0.892 1
1 1124 . 15 1 1 A 94 94 TYR N N 94 115.987 117.595 -1.608 1
1 1125 . 15 1 1 A 95 95 GLU H H 95 8.205 8.464 -0.259 1
1 1126 . 15 1 1 A 95 95 GLU HA H 95 3.682 4.153 -0.471 1
1 1131 . 15 1 1 A 95 95 GLU C C 95 178.530 179.427 -0.897 1
1 1132 . 15 1 1 A 95 95 GLU CA C 95 58.910 59.989 -1.079 1
1 1133 . 15 1 1 A 95 95 GLU CB C 95 29.187 29.631 -0.444 1
1 1134 . 15 1 1 A 95 95 GLU N N 95 119.946 121.355 -1.409 1
1 1135 . 15 1 1 A 96 96 MET H H 96 8.248 7.996 0.252 1
1 1136 . 15 1 1 A 96 96 MET HA H 96 4.172 4.253 -0.081 1
1 1142 . 15 1 1 A 96 96 MET C C 96 176.874 178.196 -1.322 1
1 1143 . 15 1 1 A 96 96 MET CA C 96 57.159 58.321 -1.162 1
1 1144 . 15 1 1 A 96 96 MET CB C 96 31.829 31.657 0.172 1
1 1146 . 15 1 1 A 96 96 MET N N 96 117.570 118.510 -0.940 1
1 1147 . 15 1 1 A 97 97 TYR H H 97 7.445 8.246 -0.801 1
1 1148 . 15 1 1 A 97 97 TYR HA H 97 4.248 3.957 0.291 1
1 1155 . 15 1 1 A 97 97 TYR C C 97 176.476 177.515 -1.039 1
1 1156 . 15 1 1 A 97 97 TYR CA C 97 60.470 61.660 -1.190 1
1 1157 . 15 1 1 A 97 97 TYR CB C 97 38.612 38.434 0.178 1
1 1160 . 15 1 1 A 97 97 TYR N N 97 122.246 122.414 -0.168 1
1 1161 . 15 1 1 A 98 98 GLN H H 98 8.087 8.780 -0.693 1
1 1162 . 15 1 1 A 98 98 GLN HA H 98 3.793 3.862 -0.069 1
1 1169 . 15 1 1 A 98 98 GLN C C 98 175.549 178.183 -2.634 1
1 1170 . 15 1 1 A 98 98 GLN CA C 98 57.365 58.828 -1.463 1
1 1171 . 15 1 1 A 98 98 GLN CB C 98 28.901 28.896 0.005 1
1 1173 . 15 1 1 A 98 98 GLN N N 98 118.769 119.956 -1.187 1
1 1175 . 15 1 1 A 99 99 SER H H 99 7.724 8.460 -0.736 1
1 1176 . 15 1 1 A 99 99 SER HA H 99 4.293 4.244 0.049 1
1 1179 . 15 1 1 A 99 99 SER C C 99 173.696 176.703 -3.007 1
1 1180 . 15 1 1 A 99 99 SER CA C 99 59.566 62.846 -3.280 1
1 1181 . 15 1 1 A 99 99 SER CB C 99 63.847 62.392 1.455 1
1 1182 . 15 1 1 A 99 99 SER N N 99 113.257 117.275 -4.018 1
1 1183 . 15 1 1 A 100 100 GLY H H 100 7.751 8.454 -0.703 1
1 1184 . 15 1 1 A 100 100 GLY HA2 H 100 3.813 3.756 0.057 1
1 1185 . 15 1 1 A 100 100 GLY HA3 H 100 3.934 3.790 0.144 1
1 1186 . 15 1 1 A 100 100 GLY C C 100 172.643 176.303 -3.660 1
1 1187 . 15 1 1 A 100 100 GLY CA C 100 45.570 47.096 -1.526 1
1 1188 . 15 1 1 A 100 100 GLY N N 100 109.750 108.912 0.838 1
1 1189 . 15 1 1 A 101 101 ALA H H 101 7.824 7.804 0.020 1
1 1190 . 15 1 1 A 101 101 ALA HA H 101 4.221 3.887 0.334 1
1 1194 . 15 1 1 A 101 101 ALA C C 101 175.639 179.002 -3.363 1
1 1195 . 15 1 1 A 101 101 ALA CA C 101 52.745 54.424 -1.679 1
1 1196 . 15 1 1 A 101 101 ALA CB C 101 19.437 18.382 1.055 1
1 1197 . 15 1 1 A 101 101 ALA N N 101 123.241 124.729 -1.488 1
1 1198 . 15 1 1 A 102 102 ASN H H 102 8.191 7.979 0.212 1
1 1199 . 15 1 1 A 102 102 ASN HA H 102 4.658 4.736 -0.078 1
1 1204 . 15 1 1 A 102 102 ASN C C 102 173.337 174.922 -1.585 1
1 1205 . 15 1 1 A 102 102 ASN CA C 102 53.374 54.932 -1.558 1
1 1206 . 15 1 1 A 102 102 ASN CB C 102 38.819 39.947 -1.128 1
1 1207 . 15 1 1 A 102 102 ASN N N 102 116.572 115.978 0.594 1
1 1209 . 15 1 1 A 103 103 LEU H H 103 8.065 7.580 0.485 1
1 1210 . 15 1 1 A 103 103 LEU HA H 103 4.363 4.660 -0.297 1
1 1219 . 15 1 1 A 103 103 LEU C C 103 175.637 174.648 0.989 1
1 1220 . 15 1 1 A 103 103 LEU CA C 103 55.292 53.763 1.529 1
1 1221 . 15 1 1 A 103 103 LEU CB C 103 42.433 44.908 -2.475 1
1 1222 . 15 1 1 A 103 103 LEU N N 103 122.074 113.589 8.485 1
1 1223 . 15 1 1 A 104 104 VAL H H 104 8.055 9.027 -0.972 1
1 1224 . 15 1 1 A 104 104 VAL HA H 104 4.131 4.719 -0.588 1
1 1232 . 15 1 1 A 104 104 VAL C C 104 174.364 175.962 -1.598 1
1 1233 . 15 1 1 A 104 104 VAL CA C 104 62.552 60.498 2.054 1
1 1234 . 15 1 1 A 104 104 VAL CB C 104 32.766 33.758 -0.992 1
1 1235 . 15 1 1 A 104 104 VAL N N 104 120.606 122.274 -1.668 1
1 1236 . 15 1 1 A 105 105 CYS H H 105 8.392 8.489 -0.097 1
1 1237 . 15 1 1 A 105 105 CYS HA H 105 4.535 4.756 -0.221 1
1 1240 . 15 1 1 A 105 105 CYS C C 105 172.593 175.852 -3.259 1
1 1241 . 15 1 1 A 105 105 CYS CA C 105 58.449 58.628 -0.179 1
1 1242 . 15 1 1 A 105 105 CYS CB C 105 27.952 29.890 -1.938 1
1 1243 . 15 1 1 A 105 105 CYS N N 105 122.791 126.206 -3.415 1
1 1244 . 15 1 1 A 106 106 ASN H H 106 8.575 8.150 0.425 1
1 1245 . 15 1 1 A 106 106 ASN HA H 106 4.843 4.830 0.013 1
1 1250 . 15 1 1 A 106 106 ASN C C 106 173.594 176.886 -3.292 1
1 1251 . 15 1 1 A 106 106 ASN CA C 106 53.337 54.370 -1.033 1
1 1252 . 15 1 1 A 106 106 ASN CB C 106 39.088 38.597 0.491 1
1 1253 . 15 1 1 A 106 106 ASN N N 106 122.001 119.477 2.524 1
1 1255 . 15 1 1 A 107 107 THR H H 107 8.090 8.032 0.058 1
1 1256 . 15 1 1 A 107 107 THR HA H 107 4.348 4.027 0.321 1
1 1261 . 15 1 1 A 107 107 THR C C 107 172.516 176.938 -4.422 1
1 1262 . 15 1 1 A 107 107 THR CA C 107 61.803 66.023 -4.220 1
1 1263 . 15 1 1 A 107 107 THR CB C 107 69.812 68.423 1.389 1
1 1265 . 15 1 1 A 107 107 THR N N 107 114.374 115.390 -1.016 1
1 1266 . 15 1 1 A 108 108 ARG H H 108 8.322 7.481 0.841 1
1 1267 . 15 1 1 A 108 108 ARG HA H 108 4.634 4.212 0.422 1
1 1274 . 15 1 1 A 108 108 ARG C C 108 172.608 176.969 -4.361 1
1 1275 . 15 1 1 A 108 108 ARG CA C 108 54.026 60.804 -6.778 1
1 1276 . 15 1 1 A 108 108 ARG CB C 108 30.246 30.001 0.245 1
1 1278 . 15 1 1 A 108 108 ARG N N 108 124.017 120.797 3.220 1
1 1279 . 15 1 1 A 109 109 PRO HA H 109 4.354 4.486 -0.132 1
1 1286 . 15 1 1 A 109 109 PRO C C 109 174.978 179.302 -4.324 1
1 1287 . 15 1 1 A 109 109 PRO CA C 109 63.396 65.926 -2.530 1
1 1288 . 15 1 1 A 109 109 PRO CB C 109 32.046 31.344 0.702 1
1 1290 . 15 1 1 A 110 110 PHE H H 110 8.123 8.316 -0.193 1
1 1291 . 15 1 1 A 110 110 PHE HA H 110 4.619 4.575 0.044 1
1 1296 . 15 1 1 A 110 110 PHE C C 110 173.856 178.043 -4.187 1
1 1297 . 15 1 1 A 110 110 PHE CA C 110 57.353 61.487 -4.134 1
1 1298 . 15 1 1 A 110 110 PHE CB C 110 39.364 38.863 0.501 1
1 1301 . 15 1 1 A 110 110 PHE N N 110 119.265 116.777 2.488 1
1 1302 . 15 1 1 A 111 111 ASP H H 111 8.161 8.405 -0.244 1
1 1303 . 15 1 1 A 111 111 ASP HA H 111 4.613 4.394 0.219 1
1 1306 . 15 1 1 A 111 111 ASP C C 111 174.114 178.793 -4.679 1
1 1307 . 15 1 1 A 111 111 ASP CA C 111 54.350 57.407 -3.057 1
1 1308 . 15 1 1 A 111 111 ASP CB C 111 41.413 40.599 0.814 1
1 1309 . 15 1 1 A 111 111 ASP N N 111 121.764 118.604 3.160 1
1 1310 . 15 1 1 A 112 112 ASN H H 112 8.307 8.554 -0.247 1
1 1311 . 15 1 1 A 112 112 ASN HA H 112 4.662 4.437 0.225 1
1 1316 . 15 1 1 A 112 112 ASN C C 112 173.595 177.675 -4.080 1
1 1317 . 15 1 1 A 112 112 ASN CA C 112 53.486 56.719 -3.233 1
1 1318 . 15 1 1 A 112 112 ASN CB C 112 39.225 39.279 -0.054 1
1 1319 . 15 1 1 A 112 112 ASN N N 112 119.154 118.486 0.668 1
1 1321 . 15 1 1 A 113 113 GLU H H 113 8.404 8.583 -0.179 1
1 1322 . 15 1 1 A 113 113 GLU HA H 113 4.264 4.008 0.256 1
1 1327 . 15 1 1 A 113 113 GLU C C 113 174.886 179.027 -4.141 1
1 1328 . 15 1 1 A 113 113 GLU CA C 113 56.681 59.383 -2.702 1
1 1329 . 15 1 1 A 113 113 GLU CB C 113 30.403 29.340 1.063 1
1 1331 . 15 1 1 A 113 113 GLU N N 113 120.943 119.214 1.729 1
1 1332 . 15 1 1 A 114 114 GLU H H 114 8.388 8.056 0.332 1
1 1333 . 15 1 1 A 114 114 GLU HA H 114 4.262 4.138 0.124 1
1 1338 . 15 1 1 A 114 114 GLU C C 114 174.819 178.906 -4.087 1
1 1339 . 15 1 1 A 114 114 GLU CA C 114 56.769 58.843 -2.074 1
1 1340 . 15 1 1 A 114 114 GLU CB C 114 30.125 29.924 0.201 1
1 1342 . 15 1 1 A 114 114 GLU N N 114 121.869 119.734 2.135 1
1 1343 . 15 1 1 A 115 115 LYS H H 115 8.236 7.708 0.528 1
1 1344 . 15 1 1 A 115 115 LYS HA H 115 4.347 4.272 0.075 1
1 1353 . 15 1 1 A 115 115 LYS C C 115 174.633 176.133 -1.500 1
1 1354 . 15 1 1 A 115 115 LYS CA C 115 56.426 58.925 -2.499 1
1 1355 . 15 1 1 A 115 115 LYS CB C 115 33.277 33.249 0.028 1
1 1359 . 15 1 1 A 115 115 LYS N N 115 121.997 118.831 3.166 1
1 1360 . 15 1 1 A 116 116 ASP H H 116 8.386 8.465 -0.079 1
1 1361 . 15 1 1 A 116 116 ASP HA H 116 4.600 4.385 0.215 1
1 1364 . 15 1 1 A 116 116 ASP C C 116 173.448 174.903 -1.455 1
1 1365 . 15 1 1 A 116 116 ASP CA C 116 54.773 55.369 -0.596 1
1 1366 . 15 1 1 A 116 116 ASP CB C 116 41.029 39.804 1.225 1
1 1367 . 15 1 1 A 116 116 ASP N N 116 121.057 118.465 2.592 1
1 5 . 16 1 1 A 2 2 MET HA H 2 4.534 4.181 0.353 1
1 13 . 16 1 1 A 2 2 MET C C 2 174.355 178.147 -3.792 1
1 14 . 16 1 1 A 2 2 MET CA C 2 56.247 58.167 -1.920 1
1 15 . 16 1 1 A 2 2 MET CB C 2 32.855 32.493 0.362 1
1 18 . 16 1 1 A 3 3 ASN H H 3 8.600 8.141 0.459 1
1 19 . 16 1 1 A 3 3 ASN HA H 3 4.711 4.413 0.298 1
1 24 . 16 1 1 A 3 3 ASN C C 3 173.983 177.573 -3.590 1
1 25 . 16 1 1 A 3 3 ASN CA C 3 53.650 56.738 -3.088 1
1 26 . 16 1 1 A 3 3 ASN CB C 3 38.624 39.712 -1.088 1
1 27 . 16 1 1 A 3 3 ASN N N 3 120.149 117.927 2.222 1
1 29 . 16 1 1 A 4 4 GLU H H 4 8.495 8.174 0.321 1
1 30 . 16 1 1 A 4 4 GLU HA H 4 4.235 4.022 0.213 1
1 35 . 16 1 1 A 4 4 GLU C C 4 175.752 178.878 -3.126 1
1 36 . 16 1 1 A 4 4 GLU CA C 4 58.075 59.280 -1.205 1
1 37 . 16 1 1 A 4 4 GLU CB C 4 30.125 29.390 0.735 1
1 38 . 16 1 1 A 4 4 GLU N N 4 121.543 118.033 3.510 1
1 39 . 16 1 1 A 5 5 LEU HA H 5 4.073 4.139 -0.066 1
1 47 . 16 1 1 A 5 5 LEU CB C 5 41.897 42.028 -0.131 1
1 50 . 16 1 1 A 6 6 GLU H H 6 8.332 8.230 0.102 1
1 51 . 16 1 1 A 6 6 GLU HA H 6 3.621 4.213 -0.592 1
1 52 . 16 1 1 A 6 6 GLU C C 6 176.402 178.496 -2.094 1
1 53 . 16 1 1 A 6 6 GLU CA C 6 58.461 57.589 0.872 1
1 54 . 16 1 1 A 6 6 GLU CB C 6 29.730 29.286 0.444 1
1 55 . 16 1 1 A 6 6 GLU N N 6 121.462 117.535 3.927 1
1 56 . 16 1 1 A 7 7 ALA H H 7 8.244 7.870 0.374 1
1 57 . 16 1 1 A 7 7 ALA HA H 7 4.185 4.092 0.093 1
1 61 . 16 1 1 A 7 7 ALA C C 7 177.982 178.209 -0.227 1
1 62 . 16 1 1 A 7 7 ALA CA C 7 54.791 55.236 -0.445 1
1 63 . 16 1 1 A 7 7 ALA CB C 7 18.836 19.000 -0.164 1
1 64 . 16 1 1 A 7 7 ALA N N 7 123.078 123.518 -0.440 1
1 65 . 16 1 1 A 8 8 GLN H H 8 8.274 7.840 0.434 1
1 66 . 16 1 1 A 8 8 GLN HA H 8 4.219 4.415 -0.196 1
1 73 . 16 1 1 A 8 8 GLN C C 8 176.325 175.411 0.914 1
1 74 . 16 1 1 A 8 8 GLN CA C 8 57.864 55.856 2.008 1
1 75 . 16 1 1 A 8 8 GLN CB C 8 28.768 29.191 -0.423 1
1 77 . 16 1 1 A 8 8 GLN N N 8 117.452 115.997 1.455 1
1 79 . 16 1 1 A 9 9 THR H H 9 8.043 8.561 -0.518 1
1 80 . 16 1 1 A 9 9 THR HA H 9 3.998 4.762 -0.764 1
1 85 . 16 1 1 A 9 9 THR C C 9 173.904 174.435 -0.531 1
1 86 . 16 1 1 A 9 9 THR CA C 9 65.435 60.450 4.985 1
1 87 . 16 1 1 A 9 9 THR CB C 9 68.870 70.229 -1.359 1
1 89 . 16 1 1 A 9 9 THR N N 9 116.135 118.734 -2.599 1
1 90 . 16 1 1 A 10 10 ARG H H 10 8.095 8.953 -0.858 1
1 91 . 16 1 1 A 10 10 ARG HA H 10 4.040 3.965 0.075 1
1 98 . 16 1 1 A 10 10 ARG C C 10 176.583 175.589 0.994 1
1 99 . 16 1 1 A 10 10 ARG CA C 10 59.262 57.475 1.787 1
1 100 . 16 1 1 A 10 10 ARG CB C 10 29.900 27.637 2.263 1
1 101 . 16 1 1 A 10 10 ARG N N 10 121.157 121.216 -0.059 1
1 102 . 16 1 1 A 11 11 VAL H H 11 7.657 7.938 -0.281 1
1 103 . 16 1 1 A 11 11 VAL HA H 11 3.769 4.408 -0.639 1
1 111 . 16 1 1 A 11 11 VAL C C 11 176.662 177.731 -1.069 1
1 112 . 16 1 1 A 11 11 VAL CA C 11 65.914 64.040 1.874 1
1 113 . 16 1 1 A 11 11 VAL CB C 11 31.745 33.431 -1.686 1
1 114 . 16 1 1 A 11 11 VAL N N 11 118.580 117.779 0.801 1
1 115 . 16 1 1 A 12 12 LYS H H 12 7.471 8.476 -1.005 1
1 116 . 16 1 1 A 12 12 LYS HA H 12 3.366 4.336 -0.970 1
1 123 . 16 1 1 A 12 12 LYS C C 12 176.457 179.403 -2.946 1
1 124 . 16 1 1 A 12 12 LYS CA C 12 59.545 59.274 0.271 1
1 125 . 16 1 1 A 12 12 LYS CB C 12 32.206 32.213 -0.007 1
1 126 . 16 1 1 A 12 12 LYS N N 12 121.835 122.123 -0.288 1
1 127 . 16 1 1 A 13 13 LEU H H 13 8.144 8.100 0.044 1
1 128 . 16 1 1 A 13 13 LEU HA H 13 4.093 4.080 0.013 1
1 137 . 16 1 1 A 13 13 LEU C C 13 178.254 179.335 -1.081 1
1 138 . 16 1 1 A 13 13 LEU CA C 13 58.023 57.892 0.131 1
1 139 . 16 1 1 A 13 13 LEU CB C 13 41.283 40.883 0.400 1
1 140 . 16 1 1 A 13 13 LEU N N 13 118.688 120.685 -1.997 1
1 141 . 16 1 1 A 14 14 ASN H H 14 8.384 8.413 -0.029 1
1 142 . 16 1 1 A 14 14 ASN HA H 14 4.567 4.416 0.151 1
1 147 . 16 1 1 A 14 14 ASN C C 14 175.397 177.827 -2.430 1
1 148 . 16 1 1 A 14 14 ASN CA C 14 56.239 56.582 -0.343 1
1 149 . 16 1 1 A 14 14 ASN CB C 14 38.432 38.307 0.125 1
1 150 . 16 1 1 A 14 14 ASN N N 14 118.175 118.451 -0.276 1
1 152 . 16 1 1 A 15 15 TYR H H 15 7.982 7.745 0.237 1
1 153 . 16 1 1 A 15 15 TYR HA H 15 4.249 4.080 0.169 1
1 160 . 16 1 1 A 15 15 TYR C C 15 175.503 177.509 -2.006 1
1 161 . 16 1 1 A 15 15 TYR CA C 15 62.450 60.964 1.486 1
1 162 . 16 1 1 A 15 15 TYR CB C 15 39.399 38.544 0.855 1
1 163 . 16 1 1 A 15 15 TYR N N 15 121.955 121.839 0.116 1
1 164 . 16 1 1 A 16 16 LEU H H 16 8.198 8.567 -0.369 1
1 165 . 16 1 1 A 16 16 LEU HA H 16 4.470 4.034 0.436 1
1 175 . 16 1 1 A 16 16 LEU C C 16 177.125 177.943 -0.818 1
1 176 . 16 1 1 A 16 16 LEU CA C 16 57.374 58.201 -0.827 1
1 177 . 16 1 1 A 16 16 LEU CB C 16 41.443 41.664 -0.221 1
1 178 . 16 1 1 A 16 16 LEU N N 16 117.642 121.290 -3.648 1
1 179 . 16 1 1 A 17 17 ASP H H 17 8.061 8.268 -0.207 1
1 180 . 16 1 1 A 17 17 ASP C C 17 177.836 178.041 -0.205 1
1 181 . 16 1 1 A 17 17 ASP CA C 17 57.486 57.881 -0.395 1
1 182 . 16 1 1 A 17 17 ASP CB C 17 41.433 42.159 -0.726 1
1 183 . 16 1 1 A 17 17 ASP N N 17 118.700 118.865 -0.165 1
1 184 . 16 1 1 A 18 18 GLN H H 18 8.111 7.737 0.374 1
1 185 . 16 1 1 A 18 18 GLN HA H 18 4.002 4.068 -0.066 1
1 190 . 16 1 1 A 18 18 GLN CA C 18 59.046 58.842 0.204 1
1 191 . 16 1 1 A 18 18 GLN CB C 18 28.700 28.617 0.083 1
1 193 . 16 1 1 A 18 18 GLN N N 18 119.539 118.590 0.949 1
1 195 . 16 1 1 A 19 19 ILE H H 19 8.330 8.230 0.100 1
1 196 . 16 1 1 A 19 19 ILE HA H 19 3.306 4.006 -0.700 1
1 204 . 16 1 1 A 19 19 ILE C C 19 175.608 177.783 -2.175 1
1 205 . 16 1 1 A 19 19 ILE CA C 19 64.760 63.495 1.265 1
1 206 . 16 1 1 A 19 19 ILE CB C 19 37.148 37.102 0.046 1
1 209 . 16 1 1 A 19 19 ILE N N 19 121.490 120.093 1.397 1
1 210 . 16 1 1 A 20 20 ALA H H 20 8.057 7.999 0.058 1
1 211 . 16 1 1 A 20 20 ALA HA H 20 4.349 4.161 0.188 1
1 215 . 16 1 1 A 20 20 ALA C C 20 179.297 179.233 0.064 1
1 216 . 16 1 1 A 20 20 ALA CA C 20 56.150 55.348 0.802 1
1 217 . 16 1 1 A 20 20 ALA CB C 20 18.104 18.637 -0.533 1
1 218 . 16 1 1 A 20 20 ALA N N 20 124.441 124.138 0.303 1
1 219 . 16 1 1 A 21 21 LYS H H 21 8.116 7.873 0.243 1
1 220 . 16 1 1 A 21 21 LYS HA H 21 4.108 4.074 0.034 1
1 229 . 16 1 1 A 21 21 LYS C C 21 176.720 178.435 -1.715 1
1 230 . 16 1 1 A 21 21 LYS CA C 21 59.166 59.579 -0.413 1
1 231 . 16 1 1 A 21 21 LYS CB C 21 32.085 32.412 -0.327 1
1 233 . 16 1 1 A 21 21 LYS N N 21 119.865 119.388 0.477 1
1 234 . 16 1 1 A 22 22 PHE H H 22 7.875 8.175 -0.300 1
1 235 . 16 1 1 A 22 22 PHE HA H 22 4.012 4.060 -0.048 1
1 242 . 16 1 1 A 22 22 PHE C C 22 175.545 177.208 -1.663 1
1 243 . 16 1 1 A 22 22 PHE CA C 22 61.070 61.378 -0.308 1
1 244 . 16 1 1 A 22 22 PHE CB C 22 39.072 38.609 0.463 1
1 249 . 16 1 1 A 22 22 PHE N N 22 119.729 119.877 -0.148 1
1 250 . 16 1 1 A 23 23 TRP H H 23 7.841 8.326 -0.485 1
1 251 . 16 1 1 A 23 23 TRP HA H 23 4.149 4.109 0.040 1
1 260 . 16 1 1 A 23 23 TRP C C 23 176.668 177.937 -1.269 1
1 261 . 16 1 1 A 23 23 TRP CB C 23 28.543 29.837 -1.294 1
1 267 . 16 1 1 A 23 23 TRP N N 23 119.440 120.646 -1.206 1
1 269 . 16 1 1 A 24 24 GLU H H 24 8.261 7.932 0.329 1
1 270 . 16 1 1 A 24 24 GLU HA H 24 4.265 4.135 0.130 1
1 275 . 16 1 1 A 24 24 GLU C C 24 179.679 178.672 1.007 1
1 276 . 16 1 1 A 24 24 GLU CA C 24 59.706 58.573 1.133 1
1 277 . 16 1 1 A 24 24 GLU CB C 24 29.720 29.615 0.105 1
1 279 . 16 1 1 A 24 24 GLU N N 24 121.376 119.295 2.081 1
1 280 . 16 1 1 A 25 25 ILE H H 25 8.071 8.224 -0.153 1
1 281 . 16 1 1 A 25 25 ILE HA H 25 3.815 3.808 0.007 1
1 291 . 16 1 1 A 25 25 ILE C C 25 176.343 177.362 -1.019 1
1 292 . 16 1 1 A 25 25 ILE CA C 25 64.464 62.458 2.006 1
1 293 . 16 1 1 A 25 25 ILE CB C 25 37.371 37.651 -0.280 1
1 296 . 16 1 1 A 25 25 ILE N N 25 121.499 119.313 2.186 1
1 297 . 16 1 1 A 26 26 GLN H H 26 7.327 7.060 0.267 1
1 298 . 16 1 1 A 26 26 GLN HA H 26 4.074 4.175 -0.101 1
1 305 . 16 1 1 A 26 26 GLN C C 26 174.906 175.717 -0.811 1
1 306 . 16 1 1 A 26 26 GLN CA C 26 55.450 55.220 0.230 1
1 307 . 16 1 1 A 26 26 GLN CB C 26 28.458 28.774 -0.316 1
1 309 . 16 1 1 A 26 26 GLN N N 26 116.532 119.688 -3.156 1
1 311 . 16 1 1 A 27 27 GLY H H 27 7.861 8.776 -0.915 1
1 312 . 16 1 1 A 27 27 GLY HA2 H 27 4.297 3.723 0.574 1
1 313 . 16 1 1 A 27 27 GLY HA3 H 27 3.823 3.723 0.100 1
1 314 . 16 1 1 A 27 27 GLY C C 27 172.698 173.115 -0.417 1
1 315 . 16 1 1 A 27 27 GLY CA C 27 45.608 45.989 -0.381 1
1 316 . 16 1 1 A 27 27 GLY N N 27 106.837 108.826 -1.989 1
1 317 . 16 1 1 A 28 28 SER H H 28 8.083 6.852 1.231 1
1 318 . 16 1 1 A 28 28 SER HA H 28 4.777 4.438 0.339 1
1 321 . 16 1 1 A 28 28 SER C C 28 171.196 172.131 -0.935 1
1 322 . 16 1 1 A 28 28 SER CA C 28 56.041 55.922 0.119 1
1 323 . 16 1 1 A 28 28 SER CB C 28 64.539 63.830 0.709 1
1 324 . 16 1 1 A 28 28 SER N N 28 116.151 114.175 1.976 1
1 325 . 16 1 1 A 29 29 SER H H 29 8.354 8.543 -0.189 1
1 326 . 16 1 1 A 29 29 SER HA H 29 4.389 5.093 -0.704 1
1 329 . 16 1 1 A 29 29 SER C C 29 172.166 172.934 -0.768 1
1 330 . 16 1 1 A 29 29 SER CA C 29 58.107 56.511 1.596 1
1 331 . 16 1 1 A 29 29 SER CB C 29 63.853 65.810 -1.957 1
1 332 . 16 1 1 A 29 29 SER N N 29 116.596 115.215 1.381 1
1 333 . 16 1 1 A 30 30 LEU H H 30 8.990 8.560 0.430 1
1 334 . 16 1 1 A 30 30 LEU HA H 30 3.964 4.754 -0.790 1
1 344 . 16 1 1 A 30 30 LEU C C 30 173.752 175.178 -1.426 1
1 345 . 16 1 1 A 30 30 LEU CA C 30 55.193 55.100 0.093 1
1 346 . 16 1 1 A 30 30 LEU CB C 30 42.869 42.092 0.777 1
1 349 . 16 1 1 A 30 30 LEU N N 30 125.860 127.335 -1.475 1
1 350 . 16 1 1 A 31 31 LYS H H 31 8.118 9.128 -1.010 1
1 351 . 16 1 1 A 31 31 LYS HA H 31 4.498 4.808 -0.310 1
1 360 . 16 1 1 A 31 31 LYS C C 31 173.555 174.872 -1.317 1
1 361 . 16 1 1 A 31 31 LYS CA C 31 54.372 55.121 -0.749 1
1 362 . 16 1 1 A 31 31 LYS CB C 31 32.814 32.382 0.432 1
1 365 . 16 1 1 A 31 31 LYS N N 31 129.965 127.647 2.318 1
1 366 . 16 1 1 A 32 32 ILE H H 32 8.717 8.482 0.235 1
1 367 . 16 1 1 A 32 32 ILE HA H 32 4.011 4.858 -0.847 1
1 377 . 16 1 1 A 32 32 ILE C C 32 173.038 174.904 -1.866 1
1 378 . 16 1 1 A 32 32 ILE CA C 32 59.921 58.455 1.466 1
1 379 . 16 1 1 A 32 32 ILE CB C 32 38.139 39.133 -0.994 1
1 382 . 16 1 1 A 32 32 ILE N N 32 127.091 120.725 6.366 1
1 383 . 16 1 1 A 33 33 PRO HA H 33 4.412 4.573 -0.161 1
1 390 . 16 1 1 A 33 33 PRO C C 33 172.724 175.636 -2.912 1
1 391 . 16 1 1 A 33 33 PRO CA C 33 62.565 62.236 0.329 1
1 392 . 16 1 1 A 33 33 PRO CB C 33 32.728 32.860 -0.132 1
1 394 . 16 1 1 A 34 34 ASN H H 34 8.265 8.526 -0.261 1
1 395 . 16 1 1 A 34 34 ASN HA H 34 5.147 5.495 -0.348 1
1 400 . 16 1 1 A 34 34 ASN C C 34 174.079 173.518 0.561 1
1 401 . 16 1 1 A 34 34 ASN CA C 34 52.088 51.531 0.557 1
1 402 . 16 1 1 A 34 34 ASN CB C 34 40.387 43.097 -2.710 1
1 403 . 16 1 1 A 34 34 ASN N N 34 116.424 114.965 1.459 1
1 405 . 16 1 1 A 35 35 VAL H H 35 8.904 9.016 -0.112 1
1 406 . 16 1 1 A 35 35 VAL HA H 35 4.159 4.478 -0.319 1
1 414 . 16 1 1 A 35 35 VAL C C 35 173.834 174.802 -0.968 1
1 415 . 16 1 1 A 35 35 VAL CA C 35 61.953 59.905 2.048 1
1 416 . 16 1 1 A 35 35 VAL CB C 35 34.432 34.749 -0.317 1
1 419 . 16 1 1 A 35 35 VAL N N 35 122.778 118.487 4.291 1
1 420 . 16 1 1 A 36 36 GLU H H 36 9.560 9.470 0.090 1
1 421 . 16 1 1 A 36 36 GLU HA H 36 3.819 4.031 -0.212 1
1 426 . 16 1 1 A 36 36 GLU C C 36 173.604 176.418 -2.814 1
1 427 . 16 1 1 A 36 36 GLU CA C 36 57.131 58.012 -0.881 1
1 428 . 16 1 1 A 36 36 GLU CB C 36 27.464 28.093 -0.629 1
1 430 . 16 1 1 A 36 36 GLU N N 36 127.014 128.728 -1.714 1
1 431 . 16 1 1 A 37 37 ARG H H 37 8.578 8.612 -0.034 1
1 432 . 16 1 1 A 37 37 ARG HA H 37 3.792 4.022 -0.230 1
1 439 . 16 1 1 A 37 37 ARG C C 37 173.371 174.808 -1.437 1
1 440 . 16 1 1 A 37 37 ARG CA C 37 57.952 57.359 0.593 1
1 441 . 16 1 1 A 37 37 ARG CB C 37 27.657 27.940 -0.283 1
1 443 . 16 1 1 A 37 37 ARG N N 37 108.362 117.550 -9.188 1
1 444 . 16 1 1 A 38 38 ARG H H 38 7.696 7.767 -0.071 1
1 445 . 16 1 1 A 38 38 ARG HA H 38 4.743 5.319 -0.576 1
1 452 . 16 1 1 A 38 38 ARG C C 38 173.513 175.050 -1.537 1
1 453 . 16 1 1 A 38 38 ARG CA C 38 54.507 54.652 -0.145 1
1 454 . 16 1 1 A 38 38 ARG CB C 38 33.751 32.958 0.793 1
1 456 . 16 1 1 A 38 38 ARG N N 38 118.370 119.515 -1.145 1
1 457 . 16 1 1 A 39 39 ILE H H 39 8.463 8.515 -0.052 1
1 458 . 16 1 1 A 39 39 ILE HA H 39 4.184 4.253 -0.069 1
1 468 . 16 1 1 A 39 39 ILE C C 39 175.150 175.822 -0.672 1
1 469 . 16 1 1 A 39 39 ILE CA C 39 62.076 61.517 0.559 1
1 470 . 16 1 1 A 39 39 ILE CB C 39 38.864 39.189 -0.325 1
1 473 . 16 1 1 A 39 39 ILE N N 39 123.604 125.895 -2.291 1
1 474 . 16 1 1 A 40 40 LEU H H 40 8.239 8.150 0.089 1
1 475 . 16 1 1 A 40 40 LEU HA H 40 4.259 4.483 -0.224 1
1 485 . 16 1 1 A 40 40 LEU C C 40 173.152 175.390 -2.238 1
1 486 . 16 1 1 A 40 40 LEU CA C 40 55.305 54.740 0.565 1
1 487 . 16 1 1 A 40 40 LEU CB C 40 43.113 42.275 0.838 1
1 490 . 16 1 1 A 40 40 LEU N N 40 129.550 128.930 0.620 1
1 491 . 16 1 1 A 41 41 ASP H H 41 8.992 8.362 0.630 1
1 492 . 16 1 1 A 41 41 ASP HA H 41 4.798 4.742 0.056 1
1 495 . 16 1 1 A 41 41 ASP C C 41 173.837 176.201 -2.364 1
1 496 . 16 1 1 A 41 41 ASP CA C 41 52.077 53.375 -1.298 1
1 497 . 16 1 1 A 41 41 ASP CB C 41 39.454 40.593 -1.139 1
1 498 . 16 1 1 A 41 41 ASP N N 41 127.022 127.645 -0.623 1
1 499 . 16 1 1 A 42 42 LEU H H 42 7.912 8.213 -0.301 1
1 500 . 16 1 1 A 42 42 LEU HA H 42 3.970 4.086 -0.116 1
1 510 . 16 1 1 A 42 42 LEU C C 42 176.305 177.607 -1.302 1
1 511 . 16 1 1 A 42 42 LEU CA C 42 58.128 58.021 0.107 1
1 512 . 16 1 1 A 42 42 LEU CB C 42 43.043 41.733 1.310 1
1 514 . 16 1 1 A 42 42 LEU N N 42 125.064 127.598 -2.534 1
1 515 . 16 1 1 A 43 43 TYR H H 43 8.565 8.423 0.142 1
1 516 . 16 1 1 A 43 43 TYR HA H 43 3.728 3.626 0.102 1
1 523 . 16 1 1 A 43 43 TYR C C 43 175.757 176.929 -1.172 1
1 524 . 16 1 1 A 43 43 TYR CA C 43 61.774 61.598 0.176 1
1 525 . 16 1 1 A 43 43 TYR CB C 43 38.235 38.066 0.169 1
1 528 . 16 1 1 A 43 43 TYR N N 43 117.822 120.449 -2.627 1
1 529 . 16 1 1 A 44 44 SER H H 44 8.115 8.288 -0.173 1
1 530 . 16 1 1 A 44 44 SER HA H 44 3.854 4.179 -0.325 1
1 533 . 16 1 1 A 44 44 SER C C 44 174.080 176.141 -2.061 1
1 534 . 16 1 1 A 44 44 SER CA C 44 61.873 61.836 0.037 1
1 535 . 16 1 1 A 44 44 SER CB C 44 64.350 62.860 1.490 1
1 536 . 16 1 1 A 44 44 SER N N 44 116.835 116.059 0.776 1
1 537 . 16 1 1 A 45 45 LEU H H 45 8.401 7.933 0.468 1
1 538 . 16 1 1 A 45 45 LEU HA H 45 4.102 4.168 -0.066 1
1 548 . 16 1 1 A 45 45 LEU C C 45 175.081 178.607 -3.526 1
1 549 . 16 1 1 A 45 45 LEU CA C 45 58.896 57.870 1.026 1
1 550 . 16 1 1 A 45 45 LEU CB C 45 41.741 41.490 0.251 1
1 553 . 16 1 1 A 45 45 LEU N N 45 120.621 123.343 -2.722 1
1 554 . 16 1 1 A 46 46 SER H H 46 8.110 8.378 -0.268 1
1 555 . 16 1 1 A 46 46 SER HA H 46 4.300 4.181 0.119 1
1 558 . 16 1 1 A 46 46 SER C C 46 175.019 176.588 -1.569 1
1 559 . 16 1 1 A 46 46 SER CA C 46 62.610 61.752 0.858 1
1 560 . 16 1 1 A 46 46 SER CB C 46 64.092 63.157 0.935 1
1 561 . 16 1 1 A 46 46 SER N N 46 112.826 114.774 -1.948 1
1 562 . 16 1 1 A 47 47 LYS H H 47 7.732 8.082 -0.350 1
1 563 . 16 1 1 A 47 47 LYS HA H 47 3.900 4.152 -0.252 1
1 572 . 16 1 1 A 47 47 LYS C C 47 177.441 178.991 -1.550 1
1 573 . 16 1 1 A 47 47 LYS CA C 47 58.575 59.124 -0.549 1
1 574 . 16 1 1 A 47 47 LYS CB C 47 32.351 31.671 0.680 1
1 576 . 16 1 1 A 47 47 LYS N N 47 121.210 119.063 2.147 1
1 577 . 16 1 1 A 48 48 ILE H H 48 8.672 8.182 0.490 1
1 578 . 16 1 1 A 48 48 ILE HA H 48 3.628 3.732 -0.104 1
1 588 . 16 1 1 A 48 48 ILE C C 48 175.861 178.218 -2.357 1
1 589 . 16 1 1 A 48 48 ILE CA C 48 64.188 65.046 -0.858 1
1 590 . 16 1 1 A 48 48 ILE CB C 48 37.954 37.544 0.410 1
1 593 . 16 1 1 A 48 48 ILE N N 48 120.810 121.030 -0.220 1
1 594 . 16 1 1 A 49 49 VAL H H 49 8.030 8.232 -0.202 1
1 595 . 16 1 1 A 49 49 VAL HA H 49 3.195 3.657 -0.462 1
1 603 . 16 1 1 A 49 49 VAL C C 49 176.513 178.470 -1.957 1
1 604 . 16 1 1 A 49 49 VAL CA C 49 66.760 67.034 -0.274 1
1 605 . 16 1 1 A 49 49 VAL CB C 49 30.935 31.697 -0.762 1
1 608 . 16 1 1 A 49 49 VAL N N 49 119.350 119.547 -0.197 1
1 609 . 16 1 1 A 50 50 VAL H H 50 7.336 8.206 -0.870 1
1 610 . 16 1 1 A 50 50 VAL HA H 50 3.497 3.630 -0.133 1
1 618 . 16 1 1 A 50 50 VAL C C 50 178.745 178.607 0.138 1
1 619 . 16 1 1 A 50 50 VAL CA C 50 67.384 66.722 0.662 1
1 620 . 16 1 1 A 50 50 VAL CB C 50 31.832 31.571 0.261 1
1 621 . 16 1 1 A 50 50 VAL N N 50 118.610 120.934 -2.324 1
1 622 . 16 1 1 A 51 51 GLU H H 51 8.318 8.352 -0.034 1
1 623 . 16 1 1 A 51 51 GLU HA H 51 3.953 4.014 -0.061 1
1 628 . 16 1 1 A 51 51 GLU C C 51 177.281 178.707 -1.426 1
1 629 . 16 1 1 A 51 51 GLU CA C 51 59.668 58.898 0.770 1
1 630 . 16 1 1 A 51 51 GLU CB C 51 30.131 29.370 0.761 1
1 632 . 16 1 1 A 51 51 GLU N N 51 122.096 119.970 2.126 1
1 633 . 16 1 1 A 52 52 GLU H H 52 8.065 8.190 -0.125 1
1 634 . 16 1 1 A 52 52 GLU HA H 52 4.229 4.263 -0.034 1
1 639 . 16 1 1 A 52 52 GLU C C 52 173.534 176.715 -3.181 1
1 640 . 16 1 1 A 52 52 GLU CA C 52 55.547 56.481 -0.934 1
1 641 . 16 1 1 A 52 52 GLU CB C 52 28.716 30.197 -1.481 1
1 643 . 16 1 1 A 52 52 GLU N N 52 114.992 116.122 -1.130 1
1 644 . 16 1 1 A 53 53 GLY H H 53 7.459 9.073 -1.614 1
1 645 . 16 1 1 A 53 53 GLY HA2 H 53 3.630 3.934 -0.304 1
1 646 . 16 1 1 A 53 53 GLY HA3 H 53 3.630 3.953 -0.323 1
1 647 . 16 1 1 A 53 53 GLY C C 53 173.214 173.672 -0.458 1
1 648 . 16 1 1 A 53 53 GLY CA C 53 44.962 45.123 -0.161 1
1 649 . 16 1 1 A 53 53 GLY N N 53 104.909 108.038 -3.129 1
1 650 . 16 1 1 A 54 54 GLY H H 54 8.533 7.645 0.888 1
1 651 . 16 1 1 A 54 54 GLY HA2 H 54 3.548 4.044 -0.496 1
1 652 . 16 1 1 A 54 54 GLY HA3 H 54 4.521 4.091 0.430 1
1 653 . 16 1 1 A 54 54 GLY C C 54 169.966 174.522 -4.556 1
1 654 . 16 1 1 A 54 54 GLY CA C 54 43.988 45.714 -1.726 1
1 655 . 16 1 1 A 54 54 GLY N N 54 110.587 107.962 2.625 1
1 656 . 16 1 1 A 55 55 TYR H H 55 8.704 9.146 -0.442 1
1 657 . 16 1 1 A 55 55 TYR HA H 55 3.618 3.844 -0.226 1
1 664 . 16 1 1 A 55 55 TYR C C 55 174.807 177.213 -2.406 1
1 665 . 16 1 1 A 55 55 TYR CA C 55 62.540 61.652 0.888 1
1 666 . 16 1 1 A 55 55 TYR CB C 55 39.669 39.331 0.338 1
1 669 . 16 1 1 A 55 55 TYR N N 55 119.168 122.137 -2.969 1
1 670 . 16 1 1 A 56 56 GLU H H 56 9.006 8.248 0.758 1
1 671 . 16 1 1 A 56 56 GLU HA H 56 3.638 3.465 0.173 1
1 676 . 16 1 1 A 56 56 GLU C C 56 177.400 178.159 -0.759 1
1 677 . 16 1 1 A 56 56 GLU CA C 56 60.530 59.489 1.041 1
1 678 . 16 1 1 A 56 56 GLU CB C 56 29.168 29.543 -0.375 1
1 679 . 16 1 1 A 56 56 GLU N N 56 118.969 119.286 -0.317 1
1 680 . 16 1 1 A 57 57 ALA H H 57 8.235 7.687 0.548 1
1 681 . 16 1 1 A 57 57 ALA HA H 57 3.980 3.965 0.015 1
1 685 . 16 1 1 A 57 57 ALA C C 57 177.678 179.740 -2.062 1
1 686 . 16 1 1 A 57 57 ALA CA C 57 54.910 55.180 -0.270 1
1 687 . 16 1 1 A 57 57 ALA CB C 57 18.122 18.226 -0.104 1
1 688 . 16 1 1 A 57 57 ALA N N 57 122.860 121.126 1.734 1
1 689 . 16 1 1 A 58 58 ILE H H 58 7.831 7.341 0.490 1
1 690 . 16 1 1 A 58 58 ILE HA H 58 3.189 3.264 -0.075 1
1 700 . 16 1 1 A 58 58 ILE C C 58 177.818 177.469 0.349 1
1 701 . 16 1 1 A 58 58 ILE CA C 58 65.074 64.500 0.574 1
1 702 . 16 1 1 A 58 58 ILE CB C 58 38.178 36.763 1.415 1
1 706 . 16 1 1 A 58 58 ILE N N 58 117.418 117.825 -0.407 1
1 707 . 16 1 1 A 59 59 CYS H H 59 7.760 7.838 -0.078 1
1 708 . 16 1 1 A 59 59 CYS HA H 59 4.203 4.211 -0.008 1
1 711 . 16 1 1 A 59 59 CYS C C 59 176.357 176.945 -0.588 1
1 712 . 16 1 1 A 59 59 CYS CA C 59 63.760 62.179 1.581 1
1 713 . 16 1 1 A 59 59 CYS CB C 59 27.638 26.874 0.764 1
1 714 . 16 1 1 A 59 59 CYS N N 59 115.302 120.150 -4.848 1
1 715 . 16 1 1 A 60 60 LYS H H 60 8.350 8.111 0.239 1
1 716 . 16 1 1 A 60 60 LYS HA H 60 3.972 4.073 -0.101 1
1 725 . 16 1 1 A 60 60 LYS C C 60 176.373 176.756 -0.383 1
1 726 . 16 1 1 A 60 60 LYS CA C 60 59.796 58.072 1.724 1
1 727 . 16 1 1 A 60 60 LYS CB C 60 32.560 32.439 0.121 1
1 729 . 16 1 1 A 60 60 LYS N N 60 122.343 120.974 1.369 1
1 730 . 16 1 1 A 61 61 ASP H H 61 8.157 7.688 0.469 1
1 731 . 16 1 1 A 61 61 ASP HA H 61 4.616 4.720 -0.104 1
1 734 . 16 1 1 A 61 61 ASP C C 61 173.246 175.591 -2.345 1
1 735 . 16 1 1 A 61 61 ASP CA C 61 54.272 53.360 0.912 1
1 736 . 16 1 1 A 61 61 ASP CB C 61 41.023 40.654 0.369 1
1 737 . 16 1 1 A 61 61 ASP N N 61 116.173 118.007 -1.834 1
1 738 . 16 1 1 A 62 62 ARG H H 62 7.655 7.832 -0.177 1
1 739 . 16 1 1 A 62 62 ARG HA H 62 4.149 3.978 0.171 1
1 746 . 16 1 1 A 62 62 ARG C C 62 175.891 176.129 -0.238 1
1 747 . 16 1 1 A 62 62 ARG CA C 62 57.381 57.068 0.313 1
1 748 . 16 1 1 A 62 62 ARG CB C 62 26.538 27.093 -0.555 1
1 750 . 16 1 1 A 62 62 ARG N N 62 117.213 115.899 1.314 1
1 751 . 16 1 1 A 63 63 ARG H H 63 8.302 8.030 0.272 1
1 752 . 16 1 1 A 63 63 ARG HA H 63 4.240 4.145 0.095 1
1 757 . 16 1 1 A 63 63 ARG C C 63 175.775 177.982 -2.207 1
1 758 . 16 1 1 A 63 63 ARG CA C 63 55.718 57.077 -1.359 1
1 760 . 16 1 1 A 63 63 ARG N N 63 116.292 117.083 -0.791 1
1 761 . 16 1 1 A 64 64 TRP H H 64 8.161 7.462 0.699 1
1 762 . 16 1 1 A 64 64 TRP HA H 64 3.836 4.455 -0.619 1
1 771 . 16 1 1 A 64 64 TRP C C 64 176.862 178.657 -1.795 1
1 772 . 16 1 1 A 64 64 TRP CA C 64 62.036 59.956 2.080 1
1 773 . 16 1 1 A 64 64 TRP CB C 64 27.028 28.809 -1.781 1
1 779 . 16 1 1 A 64 64 TRP N N 64 121.486 119.967 1.519 1
1 781 . 16 1 1 A 65 65 ALA H H 65 8.954 8.273 0.681 1
1 782 . 16 1 1 A 65 65 ALA HA H 65 4.290 4.086 0.204 1
1 786 . 16 1 1 A 65 65 ALA C C 65 178.986 179.234 -0.248 1
1 787 . 16 1 1 A 65 65 ALA CA C 65 55.314 55.470 -0.156 1
1 788 . 16 1 1 A 65 65 ALA CB C 65 18.119 18.015 0.104 1
1 789 . 16 1 1 A 65 65 ALA N N 65 121.559 122.548 -0.989 1
1 790 . 16 1 1 A 66 66 ARG H H 66 7.473 8.017 -0.544 1
1 791 . 16 1 1 A 66 66 ARG HA H 66 4.221 4.109 0.112 1
1 798 . 16 1 1 A 66 66 ARG C C 66 176.670 178.726 -2.056 1
1 799 . 16 1 1 A 66 66 ARG CA C 66 57.871 59.016 -1.145 1
1 800 . 16 1 1 A 66 66 ARG CB C 66 29.097 29.882 -0.785 1
1 801 . 16 1 1 A 66 66 ARG N N 66 119.915 117.414 2.501 1
1 802 . 16 1 1 A 67 67 VAL H H 67 7.134 7.896 -0.762 1
1 803 . 16 1 1 A 67 67 VAL HA H 67 3.304 3.647 -0.343 1
1 811 . 16 1 1 A 67 67 VAL C C 67 175.341 177.989 -2.648 1
1 812 . 16 1 1 A 67 67 VAL CA C 67 66.722 66.553 0.169 1
1 813 . 16 1 1 A 67 67 VAL CB C 67 31.108 31.925 -0.817 1
1 816 . 16 1 1 A 67 67 VAL N N 67 119.970 120.809 -0.839 1
1 817 . 16 1 1 A 68 68 ALA H H 68 7.745 8.630 -0.885 1
1 818 . 16 1 1 A 68 68 ALA HA H 68 4.076 4.213 -0.137 1
1 822 . 16 1 1 A 68 68 ALA C C 68 177.358 180.255 -2.897 1
1 823 . 16 1 1 A 68 68 ALA CA C 68 55.607 56.052 -0.445 1
1 824 . 16 1 1 A 68 68 ALA CB C 68 18.061 18.774 -0.713 1
1 825 . 16 1 1 A 68 68 ALA N N 68 118.239 122.134 -3.895 1
1 826 . 16 1 1 A 69 69 GLN H H 69 7.979 8.336 -0.357 1
1 827 . 16 1 1 A 69 69 GLN HA H 69 4.310 4.098 0.212 1
1 834 . 16 1 1 A 69 69 GLN C C 69 179.370 178.497 0.873 1
1 835 . 16 1 1 A 69 69 GLN CA C 69 59.307 58.555 0.752 1
1 836 . 16 1 1 A 69 69 GLN CB C 69 29.257 28.494 0.763 1
1 838 . 16 1 1 A 69 69 GLN N N 69 118.484 117.488 0.996 1
1 840 . 16 1 1 A 70 70 ARG H H 70 8.374 7.987 0.387 1
1 841 . 16 1 1 A 70 70 ARG HA H 70 4.148 4.107 0.041 1
1 848 . 16 1 1 A 70 70 ARG C C 70 175.850 177.890 -2.040 1
1 849 . 16 1 1 A 70 70 ARG CA C 70 58.957 58.539 0.418 1
1 850 . 16 1 1 A 70 70 ARG CB C 70 29.799 30.143 -0.344 1
1 852 . 16 1 1 A 70 70 ARG N N 70 120.309 120.682 -0.373 1
1 853 . 16 1 1 A 71 71 LEU H H 71 7.413 7.743 -0.330 1
1 854 . 16 1 1 A 71 71 LEU HA H 71 4.341 4.152 0.189 1
1 864 . 16 1 1 A 71 71 LEU C C 71 173.391 175.497 -2.106 1
1 865 . 16 1 1 A 71 71 LEU CA C 71 54.911 54.722 0.189 1
1 866 . 16 1 1 A 71 71 LEU CB C 71 42.693 41.425 1.268 1
1 867 . 16 1 1 A 71 71 LEU N N 71 118.841 117.502 1.339 1
1 868 . 16 1 1 A 72 72 ASN H H 72 8.038 7.912 0.126 1
1 869 . 16 1 1 A 72 72 ASN HA H 72 4.394 4.302 0.092 1
1 874 . 16 1 1 A 72 72 ASN C C 72 173.042 174.123 -1.081 1
1 875 . 16 1 1 A 72 72 ASN CB C 72 36.412 36.788 -0.376 1
1 876 . 16 1 1 A 72 72 ASN N N 72 112.919 114.551 -1.632 1
1 878 . 16 1 1 A 73 73 TYR H H 73 7.874 7.783 0.091 1
1 879 . 16 1 1 A 73 73 TYR HA H 73 4.868 4.571 0.297 1
1 886 . 16 1 1 A 73 73 TYR C C 73 172.194 174.115 -1.921 1
1 887 . 16 1 1 A 73 73 TYR CA C 73 57.105 56.535 0.570 1
1 888 . 16 1 1 A 73 73 TYR CB C 73 37.918 38.430 -0.512 1
1 889 . 16 1 1 A 73 73 TYR N N 73 117.432 119.147 -1.715 1
1 897 . 16 1 1 A 75 75 PRO HA H 75 4.626 4.255 0.371 1
1 902 . 16 1 1 A 75 75 PRO C C 75 175.728 177.262 -1.534 1
1 903 . 16 1 1 A 75 75 PRO CA C 75 62.502 63.739 -1.237 1
1 904 . 16 1 1 A 75 75 PRO CB C 75 32.339 32.101 0.238 1
1 905 . 16 1 1 A 76 76 GLY H H 76 8.369 8.884 -0.515 1
1 906 . 16 1 1 A 76 76 GLY HA2 H 76 4.057 3.914 0.143 1
1 907 . 16 1 1 A 76 76 GLY HA3 H 76 4.556 3.914 0.642 1
1 908 . 16 1 1 A 76 76 GLY C C 76 173.248 174.988 -1.740 1
1 909 . 16 1 1 A 76 76 GLY CA C 76 46.180 45.401 0.779 1
1 910 . 16 1 1 A 76 76 GLY N N 76 106.185 111.074 -4.889 1
1 911 . 16 1 1 A 77 77 LYS H H 77 8.632 8.240 0.392 1
1 912 . 16 1 1 A 77 77 LYS HA H 77 4.433 4.023 0.410 1
1 921 . 16 1 1 A 77 77 LYS C C 77 174.924 176.395 -1.471 1
1 922 . 16 1 1 A 77 77 LYS CA C 77 56.453 57.879 -1.426 1
1 923 . 16 1 1 A 77 77 LYS CB C 77 33.170 29.607 3.563 1
1 925 . 16 1 1 A 77 77 LYS N N 77 119.592 115.881 3.711 1
1 926 . 16 1 1 A 78 78 ASN H H 78 8.865 8.134 0.731 1
1 927 . 16 1 1 A 78 78 ASN HA H 78 4.654 4.482 0.172 1
1 932 . 16 1 1 A 78 78 ASN C C 78 174.869 177.584 -2.715 1
1 933 . 16 1 1 A 78 78 ASN CA C 78 54.117 56.849 -2.732 1
1 934 . 16 1 1 A 78 78 ASN CB C 78 37.841 39.361 -1.520 1
1 935 . 16 1 1 A 78 78 ASN N N 78 116.880 117.563 -0.683 1
1 937 . 16 1 1 A 79 79 ILE H H 79 8.008 8.364 -0.356 1
1 938 . 16 1 1 A 79 79 ILE HA H 79 3.718 3.724 -0.006 1
1 948 . 16 1 1 A 79 79 ILE C C 79 175.921 178.326 -2.405 1
1 949 . 16 1 1 A 79 79 ILE CA C 79 63.618 64.700 -1.082 1
1 950 . 16 1 1 A 79 79 ILE CB C 79 37.158 37.132 0.026 1
1 952 . 16 1 1 A 79 79 ILE N N 79 119.688 119.607 0.081 1
1 953 . 16 1 1 A 80 80 GLY H H 80 9.062 8.101 0.961 1
1 954 . 16 1 1 A 80 80 GLY HA2 H 80 3.739 3.845 -0.106 1
1 955 . 16 1 1 A 80 80 GLY HA3 H 80 3.739 3.876 -0.137 1
1 956 . 16 1 1 A 80 80 GLY C C 80 173.185 176.090 -2.905 1
1 957 . 16 1 1 A 80 80 GLY CA C 80 48.166 47.692 0.474 1
1 958 . 16 1 1 A 80 80 GLY N N 80 110.338 108.945 1.393 1
1 959 . 16 1 1 A 81 81 SER H H 81 7.460 7.879 -0.419 1
1 960 . 16 1 1 A 81 81 SER HA H 81 3.904 4.169 -0.265 1
1 963 . 16 1 1 A 81 81 SER C C 81 174.999 177.165 -2.166 1
1 964 . 16 1 1 A 81 81 SER CA C 81 61.138 61.146 -0.008 1
1 965 . 16 1 1 A 81 81 SER CB C 81 62.740 62.816 -0.076 1
1 966 . 16 1 1 A 81 81 SER N N 81 115.348 116.784 -1.436 1
1 967 . 16 1 1 A 82 82 LEU H H 82 7.367 7.658 -0.291 1
1 968 . 16 1 1 A 82 82 LEU HA H 82 3.946 4.064 -0.118 1
1 977 . 16 1 1 A 82 82 LEU C C 82 176.969 178.247 -1.278 1
1 978 . 16 1 1 A 82 82 LEU CA C 82 57.504 58.392 -0.888 1
1 979 . 16 1 1 A 82 82 LEU CB C 82 42.185 41.462 0.723 1
1 980 . 16 1 1 A 82 82 LEU N N 82 124.267 122.609 1.658 1
1 981 . 16 1 1 A 83 83 LEU H H 83 8.330 8.244 0.086 1
1 982 . 16 1 1 A 83 83 LEU HA H 83 3.924 3.918 0.006 1
1 991 . 16 1 1 A 83 83 LEU C C 83 176.303 178.245 -1.942 1
1 992 . 16 1 1 A 83 83 LEU CA C 83 58.067 58.445 -0.378 1
1 993 . 16 1 1 A 83 83 LEU CB C 83 41.061 41.460 -0.399 1
1 994 . 16 1 1 A 83 83 LEU N N 83 117.452 119.689 -2.237 1
1 995 . 16 1 1 A 84 84 ARG H H 84 7.651 8.007 -0.356 1
1 996 . 16 1 1 A 84 84 ARG HA H 84 2.230 3.264 -1.034 1
1 1003 . 16 1 1 A 84 84 ARG C C 84 175.902 178.415 -2.513 1
1 1004 . 16 1 1 A 84 84 ARG CA C 84 59.112 59.173 -0.061 1
1 1005 . 16 1 1 A 84 84 ARG CB C 84 28.579 29.694 -1.115 1
1 1007 . 16 1 1 A 84 84 ARG N N 84 119.586 119.482 0.104 1
1 1008 . 16 1 1 A 85 85 SER H H 85 7.291 8.186 -0.895 1
1 1009 . 16 1 1 A 85 85 SER HA H 85 4.189 4.267 -0.078 1
1 1012 . 16 1 1 A 85 85 SER C C 85 175.546 176.378 -0.832 1
1 1013 . 16 1 1 A 85 85 SER CA C 85 61.376 62.288 -0.912 1
1 1014 . 16 1 1 A 85 85 SER CB C 85 62.805 63.045 -0.240 1
1 1015 . 16 1 1 A 85 85 SER N N 85 112.921 116.171 -3.250 1
1 1016 . 16 1 1 A 86 86 HIS H H 86 8.156 7.702 0.454 1
1 1017 . 16 1 1 A 86 86 HIS HA H 86 4.782 4.165 0.617 1
1 1022 . 16 1 1 A 86 86 HIS C C 86 176.851 177.375 -0.524 1
1 1023 . 16 1 1 A 86 86 HIS CA C 86 58.898 59.425 -0.527 1
1 1024 . 16 1 1 A 86 86 HIS CB C 86 31.110 29.848 1.262 1
1 1027 . 16 1 1 A 86 86 HIS N N 86 119.258 119.164 0.094 1
1 1028 . 16 1 1 A 87 87 TYR H H 87 9.180 8.158 1.022 1
1 1029 . 16 1 1 A 87 87 TYR HA H 87 3.913 3.925 -0.012 1
1 1036 . 16 1 1 A 87 87 TYR C C 87 176.841 177.184 -0.343 1
1 1037 . 16 1 1 A 87 87 TYR CA C 87 63.526 61.483 2.043 1
1 1038 . 16 1 1 A 87 87 TYR CB C 87 39.431 38.186 1.245 1
1 1041 . 16 1 1 A 87 87 TYR N N 87 120.625 120.116 0.509 1
1 1042 . 16 1 1 A 88 88 GLU H H 88 9.028 8.171 0.857 1
1 1043 . 16 1 1 A 88 88 GLU HA H 88 3.682 3.897 -0.215 1
1 1048 . 16 1 1 A 88 88 GLU C C 88 175.833 178.541 -2.708 1
1 1049 . 16 1 1 A 88 88 GLU CA C 88 59.730 60.114 -0.384 1
1 1050 . 16 1 1 A 88 88 GLU CB C 88 30.009 29.511 0.498 1
1 1052 . 16 1 1 A 88 88 GLU N N 88 119.531 117.801 1.730 1
1 1053 . 16 1 1 A 89 89 ARG H H 89 8.052 7.755 0.297 1
1 1054 . 16 1 1 A 89 89 ARG HA H 89 4.292 4.168 0.124 1
1 1061 . 16 1 1 A 89 89 ARG C C 89 176.045 178.075 -2.030 1
1 1062 . 16 1 1 A 89 89 ARG CA C 89 58.538 58.595 -0.057 1
1 1063 . 16 1 1 A 89 89 ARG CB C 89 31.841 30.437 1.404 1
1 1065 . 16 1 1 A 89 89 ARG N N 89 114.741 119.850 -5.109 1
1 1066 . 16 1 1 A 90 90 ILE H H 90 8.141 7.995 0.146 1
1 1067 . 16 1 1 A 90 90 ILE HA H 90 4.296 3.622 0.674 1
1 1075 . 16 1 1 A 90 90 ILE C C 90 174.461 176.911 -2.450 1
1 1076 . 16 1 1 A 90 90 ILE CA C 90 63.649 63.365 0.284 1
1 1077 . 16 1 1 A 90 90 ILE CB C 90 40.626 38.768 1.858 1
1 1079 . 16 1 1 A 90 90 ILE N N 90 113.421 119.666 -6.245 1
1 1080 . 16 1 1 A 91 91 VAL H H 91 7.350 7.575 -0.225 1
1 1081 . 16 1 1 A 91 91 VAL HA H 91 4.144 3.706 0.438 1
1 1089 . 16 1 1 A 91 91 VAL C C 91 175.422 176.922 -1.500 1
1 1090 . 16 1 1 A 91 91 VAL CA C 91 65.042 63.724 1.318 1
1 1091 . 16 1 1 A 91 91 VAL CB C 91 33.215 31.631 1.584 1
1 1092 . 16 1 1 A 91 91 VAL N N 91 118.215 120.398 -2.183 1
1 1093 . 16 1 1 A 92 92 TYR H H 92 8.565 8.136 0.429 1
1 1094 . 16 1 1 A 92 92 TYR HA H 92 4.217 4.162 0.055 1
1 1099 . 16 1 1 A 92 92 TYR C C 92 171.495 175.163 -3.668 1
1 1100 . 16 1 1 A 92 92 TYR CA C 92 61.558 62.224 -0.666 1
1 1101 . 16 1 1 A 92 92 TYR CB C 92 36.757 37.578 -0.821 1
1 1102 . 16 1 1 A 92 92 TYR N N 92 121.370 121.900 -0.530 1
1 1103 . 16 1 1 A 93 93 PRO HA H 93 4.136 4.372 -0.236 1
1 1108 . 16 1 1 A 93 93 PRO C C 93 177.077 178.356 -1.279 1
1 1109 . 16 1 1 A 93 93 PRO CA C 93 66.037 65.971 0.066 1
1 1110 . 16 1 1 A 93 93 PRO CB C 93 31.482 30.962 0.520 1
1 1111 . 16 1 1 A 94 94 TYR H H 94 6.517 7.527 -1.010 1
1 1112 . 16 1 1 A 94 94 TYR HA H 94 2.798 4.519 -1.721 1
1 1119 . 16 1 1 A 94 94 TYR C C 94 174.985 178.118 -3.133 1
1 1120 . 16 1 1 A 94 94 TYR CA C 94 59.356 59.668 -0.312 1
1 1121 . 16 1 1 A 94 94 TYR CB C 94 37.987 37.062 0.925 1
1 1124 . 16 1 1 A 94 94 TYR N N 94 115.987 117.561 -1.574 1
1 1125 . 16 1 1 A 95 95 GLU H H 95 8.205 8.401 -0.196 1
1 1126 . 16 1 1 A 95 95 GLU HA H 95 3.682 4.139 -0.457 1
1 1131 . 16 1 1 A 95 95 GLU C C 95 178.530 179.004 -0.474 1
1 1132 . 16 1 1 A 95 95 GLU CA C 95 58.910 59.690 -0.780 1
1 1133 . 16 1 1 A 95 95 GLU CB C 95 29.187 29.194 -0.007 1
1 1134 . 16 1 1 A 95 95 GLU N N 95 119.946 121.427 -1.481 1
1 1135 . 16 1 1 A 96 96 MET H H 96 8.248 8.087 0.161 1
1 1136 . 16 1 1 A 96 96 MET HA H 96 4.172 4.192 -0.020 1
1 1142 . 16 1 1 A 96 96 MET C C 96 176.874 178.161 -1.287 1
1 1143 . 16 1 1 A 96 96 MET CA C 96 57.159 58.994 -1.835 1
1 1144 . 16 1 1 A 96 96 MET CB C 96 31.829 32.528 -0.699 1
1 1146 . 16 1 1 A 96 96 MET N N 96 117.570 118.898 -1.328 1
1 1147 . 16 1 1 A 97 97 TYR H H 97 7.445 8.500 -1.055 1
1 1148 . 16 1 1 A 97 97 TYR HA H 97 4.248 3.975 0.273 1
1 1155 . 16 1 1 A 97 97 TYR C C 97 176.476 177.351 -0.875 1
1 1156 . 16 1 1 A 97 97 TYR CA C 97 60.470 61.789 -1.319 1
1 1157 . 16 1 1 A 97 97 TYR CB C 97 38.612 38.503 0.109 1
1 1160 . 16 1 1 A 97 97 TYR N N 97 122.246 121.520 0.726 1
1 1161 . 16 1 1 A 98 98 GLN H H 98 8.087 8.636 -0.549 1
1 1162 . 16 1 1 A 98 98 GLN HA H 98 3.793 3.445 0.348 1
1 1169 . 16 1 1 A 98 98 GLN C C 98 175.549 177.765 -2.216 1
1 1170 . 16 1 1 A 98 98 GLN CA C 98 57.365 58.433 -1.068 1
1 1171 . 16 1 1 A 98 98 GLN CB C 98 28.901 28.756 0.145 1
1 1173 . 16 1 1 A 98 98 GLN N N 98 118.769 119.612 -0.843 1
1 1175 . 16 1 1 A 99 99 SER H H 99 7.724 8.064 -0.340 1
1 1176 . 16 1 1 A 99 99 SER HA H 99 4.293 4.231 0.062 1
1 1179 . 16 1 1 A 99 99 SER C C 99 173.696 177.382 -3.686 1
1 1180 . 16 1 1 A 99 99 SER CA C 99 59.566 61.163 -1.597 1
1 1181 . 16 1 1 A 99 99 SER CB C 99 63.847 62.803 1.044 1
1 1182 . 16 1 1 A 99 99 SER N N 99 113.257 114.938 -1.681 1
1 1183 . 16 1 1 A 100 100 GLY H H 100 7.751 8.461 -0.710 1
1 1184 . 16 1 1 A 100 100 GLY HA2 H 100 3.813 3.883 -0.070 1
1 1185 . 16 1 1 A 100 100 GLY HA3 H 100 3.934 3.886 0.048 1
1 1186 . 16 1 1 A 100 100 GLY C C 100 172.643 176.159 -3.516 1
1 1187 . 16 1 1 A 100 100 GLY CA C 100 45.570 46.923 -1.353 1
1 1188 . 16 1 1 A 100 100 GLY N N 100 109.750 108.484 1.266 1
1 1189 . 16 1 1 A 101 101 ALA H H 101 7.824 7.932 -0.108 1
1 1190 . 16 1 1 A 101 101 ALA HA H 101 4.221 4.019 0.202 1
1 1194 . 16 1 1 A 101 101 ALA C C 101 175.639 178.761 -3.122 1
1 1195 . 16 1 1 A 101 101 ALA CA C 101 52.745 54.319 -1.574 1
1 1196 . 16 1 1 A 101 101 ALA CB C 101 19.437 18.217 1.220 1
1 1197 . 16 1 1 A 101 101 ALA N N 101 123.241 124.127 -0.886 1
1 1198 . 16 1 1 A 102 102 ASN H H 102 8.191 7.953 0.238 1
1 1199 . 16 1 1 A 102 102 ASN HA H 102 4.658 4.720 -0.062 1
1 1204 . 16 1 1 A 102 102 ASN C C 102 173.337 175.017 -1.680 1
1 1205 . 16 1 1 A 102 102 ASN CA C 102 53.374 54.905 -1.531 1
1 1206 . 16 1 1 A 102 102 ASN CB C 102 38.819 39.941 -1.122 1
1 1207 . 16 1 1 A 102 102 ASN N N 102 116.572 115.514 1.058 1
1 1209 . 16 1 1 A 103 103 LEU H H 103 8.065 7.652 0.413 1
1 1210 . 16 1 1 A 103 103 LEU HA H 103 4.363 4.605 -0.242 1
1 1219 . 16 1 1 A 103 103 LEU C C 103 175.637 174.434 1.203 1
1 1220 . 16 1 1 A 103 103 LEU CA C 103 55.292 54.054 1.238 1
1 1221 . 16 1 1 A 103 103 LEU CB C 103 42.433 44.576 -2.143 1
1 1222 . 16 1 1 A 103 103 LEU N N 103 122.074 113.341 8.733 1
1 1223 . 16 1 1 A 104 104 VAL H H 104 8.055 9.009 -0.954 1
1 1224 . 16 1 1 A 104 104 VAL HA H 104 4.131 5.374 -1.243 1
1 1232 . 16 1 1 A 104 104 VAL C C 104 174.364 175.086 -0.722 1
1 1233 . 16 1 1 A 104 104 VAL CA C 104 62.552 59.922 2.630 1
1 1234 . 16 1 1 A 104 104 VAL CB C 104 32.766 34.381 -1.615 1
1 1235 . 16 1 1 A 104 104 VAL N N 104 120.606 119.852 0.754 1
1 1236 . 16 1 1 A 105 105 CYS H H 105 8.392 8.749 -0.357 1
1 1237 . 16 1 1 A 105 105 CYS HA H 105 4.535 4.738 -0.203 1
1 1240 . 16 1 1 A 105 105 CYS C C 105 172.593 175.547 -2.954 1
1 1241 . 16 1 1 A 105 105 CYS CA C 105 58.449 58.915 -0.466 1
1 1242 . 16 1 1 A 105 105 CYS CB C 105 27.952 29.286 -1.334 1
1 1243 . 16 1 1 A 105 105 CYS N N 105 122.791 128.822 -6.031 1
1 1244 . 16 1 1 A 106 106 ASN H H 106 8.575 8.130 0.445 1
1 1245 . 16 1 1 A 106 106 ASN HA H 106 4.843 4.761 0.082 1
1 1250 . 16 1 1 A 106 106 ASN C C 106 173.594 177.564 -3.970 1
1 1251 . 16 1 1 A 106 106 ASN CA C 106 53.337 55.013 -1.676 1
1 1252 . 16 1 1 A 106 106 ASN CB C 106 39.088 38.431 0.657 1
1 1253 . 16 1 1 A 106 106 ASN N N 106 122.001 119.145 2.856 1
1 1255 . 16 1 1 A 107 107 THR H H 107 8.090 8.017 0.073 1
1 1256 . 16 1 1 A 107 107 THR HA H 107 4.348 4.161 0.187 1
1 1261 . 16 1 1 A 107 107 THR C C 107 172.516 176.457 -3.941 1
1 1262 . 16 1 1 A 107 107 THR CA C 107 61.803 65.354 -3.551 1
1 1263 . 16 1 1 A 107 107 THR CB C 107 69.812 68.760 1.052 1
1 1265 . 16 1 1 A 107 107 THR N N 107 114.374 115.122 -0.748 1
1 1266 . 16 1 1 A 108 108 ARG H H 108 8.322 7.626 0.696 1
1 1267 . 16 1 1 A 108 108 ARG HA H 108 4.634 4.279 0.355 1
1 1274 . 16 1 1 A 108 108 ARG C C 108 172.608 176.433 -3.825 1
1 1275 . 16 1 1 A 108 108 ARG CA C 108 54.026 60.914 -6.888 1
1 1276 . 16 1 1 A 108 108 ARG CB C 108 30.246 30.150 0.096 1
1 1278 . 16 1 1 A 108 108 ARG N N 108 124.017 122.108 1.909 1
1 1279 . 16 1 1 A 109 109 PRO HA H 109 4.354 4.471 -0.117 1
1 1286 . 16 1 1 A 109 109 PRO C C 109 174.978 178.717 -3.739 1
1 1287 . 16 1 1 A 109 109 PRO CA C 109 63.396 65.138 -1.742 1
1 1288 . 16 1 1 A 109 109 PRO CB C 109 32.046 31.549 0.497 1
1 1290 . 16 1 1 A 110 110 PHE H H 110 8.123 7.794 0.329 1
1 1291 . 16 1 1 A 110 110 PHE HA H 110 4.619 4.305 0.314 1
1 1296 . 16 1 1 A 110 110 PHE C C 110 173.856 176.763 -2.907 1
1 1297 . 16 1 1 A 110 110 PHE CA C 110 57.353 62.231 -4.878 1
1 1298 . 16 1 1 A 110 110 PHE CB C 110 39.364 39.291 0.073 1
1 1301 . 16 1 1 A 110 110 PHE N N 110 119.265 119.412 -0.147 1
1 1302 . 16 1 1 A 111 111 ASP H H 111 8.161 8.084 0.077 1
1 1303 . 16 1 1 A 111 111 ASP HA H 111 4.613 4.574 0.039 1
1 1306 . 16 1 1 A 111 111 ASP C C 111 174.114 178.946 -4.832 1
1 1307 . 16 1 1 A 111 111 ASP CA C 111 54.350 57.168 -2.818 1
1 1308 . 16 1 1 A 111 111 ASP CB C 111 41.413 40.293 1.120 1
1 1309 . 16 1 1 A 111 111 ASP N N 111 121.764 119.742 2.022 1
1 1310 . 16 1 1 A 112 112 ASN H H 112 8.307 8.521 -0.214 1
1 1311 . 16 1 1 A 112 112 ASN HA H 112 4.662 4.516 0.146 1
1 1316 . 16 1 1 A 112 112 ASN C C 112 173.595 177.729 -4.134 1
1 1317 . 16 1 1 A 112 112 ASN CA C 112 53.486 56.950 -3.464 1
1 1318 . 16 1 1 A 112 112 ASN CB C 112 39.225 39.368 -0.143 1
1 1319 . 16 1 1 A 112 112 ASN N N 112 119.154 117.886 1.268 1
1 1321 . 16 1 1 A 113 113 GLU H H 113 8.404 8.043 0.361 1
1 1322 . 16 1 1 A 113 113 GLU HA H 113 4.264 4.039 0.225 1
1 1327 . 16 1 1 A 113 113 GLU C C 113 174.886 178.728 -3.842 1
1 1328 . 16 1 1 A 113 113 GLU CA C 113 56.681 59.266 -2.585 1
1 1329 . 16 1 1 A 113 113 GLU CB C 113 30.403 29.735 0.668 1
1 1331 . 16 1 1 A 113 113 GLU N N 113 120.943 119.594 1.349 1
1 1332 . 16 1 1 A 114 114 GLU H H 114 8.388 8.627 -0.239 1
1 1333 . 16 1 1 A 114 114 GLU HA H 114 4.262 4.273 -0.011 1
1 1338 . 16 1 1 A 114 114 GLU C C 114 174.819 178.041 -3.222 1
1 1339 . 16 1 1 A 114 114 GLU CA C 114 56.769 59.286 -2.517 1
1 1340 . 16 1 1 A 114 114 GLU CB C 114 30.125 29.786 0.339 1
1 1342 . 16 1 1 A 114 114 GLU N N 114 121.869 120.281 1.588 1
1 1343 . 16 1 1 A 115 115 LYS H H 115 8.236 8.037 0.199 1
1 1344 . 16 1 1 A 115 115 LYS HA H 115 4.347 4.456 -0.109 1
1 1353 . 16 1 1 A 115 115 LYS C C 115 174.633 175.636 -1.003 1
1 1354 . 16 1 1 A 115 115 LYS CA C 115 56.426 55.922 0.504 1
1 1355 . 16 1 1 A 115 115 LYS CB C 115 33.277 33.464 -0.187 1
1 1359 . 16 1 1 A 115 115 LYS N N 115 121.997 116.573 5.424 1
1 1360 . 16 1 1 A 116 116 ASP H H 116 8.386 8.202 0.184 1
1 1361 . 16 1 1 A 116 116 ASP HA H 116 4.600 4.493 0.107 1
1 1364 . 16 1 1 A 116 116 ASP C C 116 173.448 175.016 -1.568 1
1 1365 . 16 1 1 A 116 116 ASP CA C 116 54.773 54.933 -0.160 1
1 1366 . 16 1 1 A 116 116 ASP CB C 116 41.029 39.456 1.573 1
1 1367 . 16 1 1 A 116 116 ASP N N 116 121.057 118.987 2.070 1
1 5 . 17 1 1 A 2 2 MET HA H 2 4.534 4.476 0.058 1
1 13 . 17 1 1 A 2 2 MET C C 2 174.355 177.680 -3.325 1
1 14 . 17 1 1 A 2 2 MET CA C 2 56.247 56.843 -0.596 1
1 15 . 17 1 1 A 2 2 MET CB C 2 32.855 32.742 0.113 1
1 18 . 17 1 1 A 3 3 ASN H H 3 8.600 8.011 0.589 1
1 19 . 17 1 1 A 3 3 ASN HA H 3 4.711 4.375 0.336 1
1 24 . 17 1 1 A 3 3 ASN C C 3 173.983 177.600 -3.617 1
1 25 . 17 1 1 A 3 3 ASN CA C 3 53.650 56.746 -3.096 1
1 26 . 17 1 1 A 3 3 ASN CB C 3 38.624 38.642 -0.018 1
1 27 . 17 1 1 A 3 3 ASN N N 3 120.149 118.325 1.824 1
1 29 . 17 1 1 A 4 4 GLU H H 4 8.495 8.371 0.124 1
1 30 . 17 1 1 A 4 4 GLU HA H 4 4.235 4.106 0.129 1
1 35 . 17 1 1 A 4 4 GLU C C 4 175.752 178.724 -2.972 1
1 36 . 17 1 1 A 4 4 GLU CA C 4 58.075 59.200 -1.125 1
1 37 . 17 1 1 A 4 4 GLU CB C 4 30.125 29.384 0.741 1
1 38 . 17 1 1 A 4 4 GLU N N 4 121.543 118.985 2.558 1
1 39 . 17 1 1 A 5 5 LEU HA H 5 4.073 4.228 -0.155 1
1 47 . 17 1 1 A 5 5 LEU CB C 5 41.897 42.555 -0.658 1
1 50 . 17 1 1 A 6 6 GLU H H 6 8.332 7.988 0.344 1
1 51 . 17 1 1 A 6 6 GLU HA H 6 3.621 4.376 -0.755 1
1 52 . 17 1 1 A 6 6 GLU C C 6 176.402 178.560 -2.158 1
1 53 . 17 1 1 A 6 6 GLU CA C 6 58.461 56.456 2.005 1
1 54 . 17 1 1 A 6 6 GLU CB C 6 29.730 29.746 -0.016 1
1 55 . 17 1 1 A 6 6 GLU N N 6 121.462 118.746 2.716 1
1 56 . 17 1 1 A 7 7 ALA H H 7 8.244 7.776 0.468 1
1 57 . 17 1 1 A 7 7 ALA HA H 7 4.185 4.113 0.072 1
1 61 . 17 1 1 A 7 7 ALA C C 7 177.982 178.428 -0.446 1
1 62 . 17 1 1 A 7 7 ALA CA C 7 54.791 55.222 -0.431 1
1 63 . 17 1 1 A 7 7 ALA CB C 7 18.836 18.820 0.016 1
1 64 . 17 1 1 A 7 7 ALA N N 7 123.078 122.165 0.913 1
1 65 . 17 1 1 A 8 8 GLN H H 8 8.274 7.890 0.384 1
1 66 . 17 1 1 A 8 8 GLN HA H 8 4.219 4.419 -0.200 1
1 73 . 17 1 1 A 8 8 GLN C C 8 176.325 175.545 0.780 1
1 74 . 17 1 1 A 8 8 GLN CA C 8 57.864 56.349 1.515 1
1 75 . 17 1 1 A 8 8 GLN CB C 8 28.768 29.166 -0.398 1
1 77 . 17 1 1 A 8 8 GLN N N 8 117.452 117.134 0.318 1
1 79 . 17 1 1 A 9 9 THR H H 9 8.043 8.527 -0.484 1
1 80 . 17 1 1 A 9 9 THR HA H 9 3.998 4.733 -0.735 1
1 85 . 17 1 1 A 9 9 THR C C 9 173.904 175.223 -1.319 1
1 86 . 17 1 1 A 9 9 THR CA C 9 65.435 60.875 4.560 1
1 87 . 17 1 1 A 9 9 THR CB C 9 68.870 69.954 -1.084 1
1 89 . 17 1 1 A 9 9 THR N N 9 116.135 118.828 -2.693 1
1 90 . 17 1 1 A 10 10 ARG H H 10 8.095 8.994 -0.899 1
1 91 . 17 1 1 A 10 10 ARG HA H 10 4.040 4.388 -0.348 1
1 98 . 17 1 1 A 10 10 ARG C C 10 176.583 176.155 0.428 1
1 99 . 17 1 1 A 10 10 ARG CA C 10 59.262 57.521 1.741 1
1 100 . 17 1 1 A 10 10 ARG CB C 10 29.900 30.112 -0.212 1
1 101 . 17 1 1 A 10 10 ARG N N 10 121.157 125.205 -4.048 1
1 102 . 17 1 1 A 11 11 VAL H H 11 7.657 7.892 -0.235 1
1 103 . 17 1 1 A 11 11 VAL HA H 11 3.769 4.413 -0.644 1
1 111 . 17 1 1 A 11 11 VAL C C 11 176.662 177.727 -1.065 1
1 112 . 17 1 1 A 11 11 VAL CA C 11 65.914 64.236 1.678 1
1 113 . 17 1 1 A 11 11 VAL CB C 11 31.745 33.403 -1.658 1
1 114 . 17 1 1 A 11 11 VAL N N 11 118.580 118.016 0.564 1
1 115 . 17 1 1 A 12 12 LYS H H 12 7.471 8.445 -0.974 1
1 116 . 17 1 1 A 12 12 LYS HA H 12 3.366 4.430 -1.064 1
1 123 . 17 1 1 A 12 12 LYS C C 12 176.457 179.357 -2.900 1
1 124 . 17 1 1 A 12 12 LYS CA C 12 59.545 59.155 0.390 1
1 125 . 17 1 1 A 12 12 LYS CB C 12 32.206 32.419 -0.213 1
1 126 . 17 1 1 A 12 12 LYS N N 12 121.835 121.864 -0.029 1
1 127 . 17 1 1 A 13 13 LEU H H 13 8.144 8.175 -0.031 1
1 128 . 17 1 1 A 13 13 LEU HA H 13 4.093 4.121 -0.028 1
1 137 . 17 1 1 A 13 13 LEU C C 13 178.254 179.289 -1.035 1
1 138 . 17 1 1 A 13 13 LEU CA C 13 58.023 57.943 0.080 1
1 139 . 17 1 1 A 13 13 LEU CB C 13 41.283 41.157 0.126 1
1 140 . 17 1 1 A 13 13 LEU N N 13 118.688 120.628 -1.940 1
1 141 . 17 1 1 A 14 14 ASN H H 14 8.384 8.459 -0.075 1
1 142 . 17 1 1 A 14 14 ASN HA H 14 4.567 4.433 0.134 1
1 147 . 17 1 1 A 14 14 ASN C C 14 175.397 177.566 -2.169 1
1 148 . 17 1 1 A 14 14 ASN CA C 14 56.239 56.594 -0.355 1
1 149 . 17 1 1 A 14 14 ASN CB C 14 38.432 38.407 0.025 1
1 150 . 17 1 1 A 14 14 ASN N N 14 118.175 117.886 0.289 1
1 152 . 17 1 1 A 15 15 TYR H H 15 7.982 7.731 0.251 1
1 153 . 17 1 1 A 15 15 TYR HA H 15 4.249 4.124 0.125 1
1 160 . 17 1 1 A 15 15 TYR C C 15 175.503 177.540 -2.037 1
1 161 . 17 1 1 A 15 15 TYR CA C 15 62.450 61.441 1.009 1
1 162 . 17 1 1 A 15 15 TYR CB C 15 39.399 38.517 0.882 1
1 163 . 17 1 1 A 15 15 TYR N N 15 121.955 122.651 -0.696 1
1 164 . 17 1 1 A 16 16 LEU H H 16 8.198 8.530 -0.332 1
1 165 . 17 1 1 A 16 16 LEU HA H 16 4.470 4.020 0.450 1
1 175 . 17 1 1 A 16 16 LEU C C 16 177.125 178.038 -0.913 1
1 176 . 17 1 1 A 16 16 LEU CA C 16 57.374 58.345 -0.971 1
1 177 . 17 1 1 A 16 16 LEU CB C 16 41.443 41.490 -0.047 1
1 178 . 17 1 1 A 16 16 LEU N N 16 117.642 121.071 -3.429 1
1 179 . 17 1 1 A 17 17 ASP H H 17 8.061 8.343 -0.282 1
1 180 . 17 1 1 A 17 17 ASP C C 17 177.836 178.399 -0.563 1
1 181 . 17 1 1 A 17 17 ASP CA C 17 57.486 57.947 -0.461 1
1 182 . 17 1 1 A 17 17 ASP CB C 17 41.433 41.827 -0.394 1
1 183 . 17 1 1 A 17 17 ASP N N 17 118.700 118.615 0.085 1
1 184 . 17 1 1 A 18 18 GLN H H 18 8.111 7.693 0.418 1
1 185 . 17 1 1 A 18 18 GLN HA H 18 4.002 4.061 -0.059 1
1 190 . 17 1 1 A 18 18 GLN CA C 18 59.046 58.730 0.316 1
1 191 . 17 1 1 A 18 18 GLN CB C 18 28.700 28.420 0.280 1
1 193 . 17 1 1 A 18 18 GLN N N 18 119.539 119.042 0.497 1
1 195 . 17 1 1 A 19 19 ILE H H 19 8.330 8.065 0.265 1
1 196 . 17 1 1 A 19 19 ILE HA H 19 3.306 3.931 -0.625 1
1 204 . 17 1 1 A 19 19 ILE C C 19 175.608 177.733 -2.125 1
1 205 . 17 1 1 A 19 19 ILE CA C 19 64.760 63.276 1.484 1
1 206 . 17 1 1 A 19 19 ILE CB C 19 37.148 37.032 0.116 1
1 209 . 17 1 1 A 19 19 ILE N N 19 121.490 120.097 1.393 1
1 210 . 17 1 1 A 20 20 ALA H H 20 8.057 7.993 0.064 1
1 211 . 17 1 1 A 20 20 ALA HA H 20 4.349 4.067 0.282 1
1 215 . 17 1 1 A 20 20 ALA C C 20 179.297 179.895 -0.598 1
1 216 . 17 1 1 A 20 20 ALA CA C 20 56.150 55.627 0.523 1
1 217 . 17 1 1 A 20 20 ALA CB C 20 18.104 18.723 -0.619 1
1 218 . 17 1 1 A 20 20 ALA N N 20 124.441 124.040 0.401 1
1 219 . 17 1 1 A 21 21 LYS H H 21 8.116 8.237 -0.121 1
1 220 . 17 1 1 A 21 21 LYS HA H 21 4.108 3.955 0.153 1
1 229 . 17 1 1 A 21 21 LYS C C 21 176.720 179.103 -2.383 1
1 230 . 17 1 1 A 21 21 LYS CA C 21 59.166 59.441 -0.275 1
1 231 . 17 1 1 A 21 21 LYS CB C 21 32.085 32.319 -0.234 1
1 233 . 17 1 1 A 21 21 LYS N N 21 119.865 117.526 2.339 1
1 234 . 17 1 1 A 22 22 PHE H H 22 7.875 8.155 -0.280 1
1 235 . 17 1 1 A 22 22 PHE HA H 22 4.012 4.166 -0.154 1
1 242 . 17 1 1 A 22 22 PHE C C 22 175.545 177.787 -2.242 1
1 243 . 17 1 1 A 22 22 PHE CA C 22 61.070 61.362 -0.292 1
1 244 . 17 1 1 A 22 22 PHE CB C 22 39.072 38.980 0.092 1
1 249 . 17 1 1 A 22 22 PHE N N 22 119.729 120.001 -0.272 1
1 250 . 17 1 1 A 23 23 TRP H H 23 7.841 8.050 -0.209 1
1 251 . 17 1 1 A 23 23 TRP HA H 23 4.149 4.190 -0.041 1
1 260 . 17 1 1 A 23 23 TRP C C 23 176.668 178.269 -1.601 1
1 261 . 17 1 1 A 23 23 TRP CB C 23 28.543 30.053 -1.510 1
1 267 . 17 1 1 A 23 23 TRP N N 23 119.440 120.432 -0.992 1
1 269 . 17 1 1 A 24 24 GLU H H 24 8.261 8.753 -0.492 1
1 270 . 17 1 1 A 24 24 GLU HA H 24 4.265 4.198 0.067 1
1 275 . 17 1 1 A 24 24 GLU C C 24 179.679 178.023 1.656 1
1 276 . 17 1 1 A 24 24 GLU CA C 24 59.706 58.518 1.188 1
1 277 . 17 1 1 A 24 24 GLU CB C 24 29.720 29.459 0.261 1
1 279 . 17 1 1 A 24 24 GLU N N 24 121.376 118.650 2.726 1
1 280 . 17 1 1 A 25 25 ILE H H 25 8.071 7.628 0.443 1
1 281 . 17 1 1 A 25 25 ILE HA H 25 3.815 4.024 -0.209 1
1 291 . 17 1 1 A 25 25 ILE C C 25 176.343 176.584 -0.241 1
1 292 . 17 1 1 A 25 25 ILE CA C 25 64.464 61.072 3.392 1
1 293 . 17 1 1 A 25 25 ILE CB C 25 37.371 37.753 -0.382 1
1 296 . 17 1 1 A 25 25 ILE N N 25 121.499 118.318 3.181 1
1 297 . 17 1 1 A 26 26 GLN H H 26 7.327 7.438 -0.111 1
1 298 . 17 1 1 A 26 26 GLN HA H 26 4.074 4.268 -0.194 1
1 305 . 17 1 1 A 26 26 GLN C C 26 174.906 175.743 -0.837 1
1 306 . 17 1 1 A 26 26 GLN CA C 26 55.450 54.899 0.551 1
1 307 . 17 1 1 A 26 26 GLN CB C 26 28.458 28.500 -0.042 1
1 309 . 17 1 1 A 26 26 GLN N N 26 116.532 121.297 -4.765 1
1 311 . 17 1 1 A 27 27 GLY H H 27 7.861 8.051 -0.190 1
1 312 . 17 1 1 A 27 27 GLY HA2 H 27 4.297 3.783 0.514 1
1 313 . 17 1 1 A 27 27 GLY HA3 H 27 3.823 3.783 0.040 1
1 314 . 17 1 1 A 27 27 GLY C C 27 172.698 173.203 -0.505 1
1 315 . 17 1 1 A 27 27 GLY CA C 27 45.608 45.872 -0.264 1
1 316 . 17 1 1 A 27 27 GLY N N 27 106.837 109.363 -2.526 1
1 317 . 17 1 1 A 28 28 SER H H 28 8.083 7.300 0.783 1
1 318 . 17 1 1 A 28 28 SER HA H 28 4.777 4.771 0.006 1
1 321 . 17 1 1 A 28 28 SER C C 28 171.196 172.295 -1.099 1
1 322 . 17 1 1 A 28 28 SER CA C 28 56.041 57.122 -1.081 1
1 323 . 17 1 1 A 28 28 SER CB C 28 64.539 66.721 -2.182 1
1 324 . 17 1 1 A 28 28 SER N N 28 116.151 114.455 1.696 1
1 325 . 17 1 1 A 29 29 SER H H 29 8.354 8.388 -0.034 1
1 326 . 17 1 1 A 29 29 SER HA H 29 4.389 5.337 -0.948 1
1 329 . 17 1 1 A 29 29 SER C C 29 172.166 173.804 -1.638 1
1 330 . 17 1 1 A 29 29 SER CA C 29 58.107 55.442 2.665 1
1 331 . 17 1 1 A 29 29 SER CB C 29 63.853 65.816 -1.963 1
1 332 . 17 1 1 A 29 29 SER N N 29 116.596 115.656 0.940 1
1 333 . 17 1 1 A 30 30 LEU H H 30 8.990 8.367 0.623 1
1 334 . 17 1 1 A 30 30 LEU HA H 30 3.964 4.800 -0.836 1
1 344 . 17 1 1 A 30 30 LEU C C 30 173.752 174.962 -1.210 1
1 345 . 17 1 1 A 30 30 LEU CA C 30 55.193 55.084 0.109 1
1 346 . 17 1 1 A 30 30 LEU CB C 30 42.869 42.264 0.605 1
1 349 . 17 1 1 A 30 30 LEU N N 30 125.860 126.612 -0.752 1
1 350 . 17 1 1 A 31 31 LYS H H 31 8.118 8.977 -0.859 1
1 351 . 17 1 1 A 31 31 LYS HA H 31 4.498 4.806 -0.308 1
1 360 . 17 1 1 A 31 31 LYS C C 31 173.555 174.819 -1.264 1
1 361 . 17 1 1 A 31 31 LYS CA C 31 54.372 55.557 -1.185 1
1 362 . 17 1 1 A 31 31 LYS CB C 31 32.814 32.337 0.477 1
1 365 . 17 1 1 A 31 31 LYS N N 31 129.965 127.635 2.330 1
1 366 . 17 1 1 A 32 32 ILE H H 32 8.717 8.425 0.292 1
1 367 . 17 1 1 A 32 32 ILE HA H 32 4.011 4.880 -0.869 1
1 377 . 17 1 1 A 32 32 ILE C C 32 173.038 174.310 -1.272 1
1 378 . 17 1 1 A 32 32 ILE CA C 32 59.921 58.284 1.637 1
1 379 . 17 1 1 A 32 32 ILE CB C 32 38.139 39.193 -1.054 1
1 382 . 17 1 1 A 32 32 ILE N N 32 127.091 119.547 7.544 1
1 383 . 17 1 1 A 33 33 PRO HA H 33 4.412 4.574 -0.162 1
1 390 . 17 1 1 A 33 33 PRO C C 33 172.724 175.923 -3.199 1
1 391 . 17 1 1 A 33 33 PRO CA C 33 62.565 62.203 0.362 1
1 392 . 17 1 1 A 33 33 PRO CB C 33 32.728 32.703 0.025 1
1 394 . 17 1 1 A 34 34 ASN H H 34 8.265 8.480 -0.215 1
1 395 . 17 1 1 A 34 34 ASN HA H 34 5.147 5.727 -0.580 1
1 400 . 17 1 1 A 34 34 ASN C C 34 174.079 173.475 0.604 1
1 401 . 17 1 1 A 34 34 ASN CA C 34 52.088 51.366 0.722 1
1 402 . 17 1 1 A 34 34 ASN CB C 34 40.387 42.530 -2.143 1
1 403 . 17 1 1 A 34 34 ASN N N 34 116.424 115.591 0.833 1
1 405 . 17 1 1 A 35 35 VAL H H 35 8.904 9.237 -0.333 1
1 406 . 17 1 1 A 35 35 VAL HA H 35 4.159 4.325 -0.166 1
1 414 . 17 1 1 A 35 35 VAL C C 35 173.834 174.698 -0.864 1
1 415 . 17 1 1 A 35 35 VAL CA C 35 61.953 60.304 1.649 1
1 416 . 17 1 1 A 35 35 VAL CB C 35 34.432 34.739 -0.307 1
1 419 . 17 1 1 A 35 35 VAL N N 35 122.778 118.415 4.363 1
1 420 . 17 1 1 A 36 36 GLU H H 36 9.560 9.464 0.096 1
1 421 . 17 1 1 A 36 36 GLU HA H 36 3.819 4.028 -0.209 1
1 426 . 17 1 1 A 36 36 GLU C C 36 173.604 175.890 -2.286 1
1 427 . 17 1 1 A 36 36 GLU CA C 36 57.131 58.091 -0.960 1
1 428 . 17 1 1 A 36 36 GLU CB C 36 27.464 28.104 -0.640 1
1 430 . 17 1 1 A 36 36 GLU N N 36 127.014 129.478 -2.464 1
1 431 . 17 1 1 A 37 37 ARG H H 37 8.578 8.481 0.097 1
1 432 . 17 1 1 A 37 37 ARG HA H 37 3.792 3.934 -0.142 1
1 439 . 17 1 1 A 37 37 ARG C C 37 173.371 174.827 -1.456 1
1 440 . 17 1 1 A 37 37 ARG CA C 37 57.952 57.783 0.169 1
1 441 . 17 1 1 A 37 37 ARG CB C 37 27.657 27.608 0.049 1
1 443 . 17 1 1 A 37 37 ARG N N 37 108.362 110.677 -2.315 1
1 444 . 17 1 1 A 38 38 ARG H H 38 7.696 7.798 -0.102 1
1 445 . 17 1 1 A 38 38 ARG HA H 38 4.743 4.906 -0.163 1
1 452 . 17 1 1 A 38 38 ARG C C 38 173.513 174.805 -1.292 1
1 453 . 17 1 1 A 38 38 ARG CA C 38 54.507 54.228 0.279 1
1 454 . 17 1 1 A 38 38 ARG CB C 38 33.751 33.221 0.530 1
1 456 . 17 1 1 A 38 38 ARG N N 38 118.370 118.280 0.090 1
1 457 . 17 1 1 A 39 39 ILE H H 39 8.463 8.320 0.143 1
1 458 . 17 1 1 A 39 39 ILE HA H 39 4.184 4.244 -0.060 1
1 468 . 17 1 1 A 39 39 ILE C C 39 175.150 175.913 -0.763 1
1 469 . 17 1 1 A 39 39 ILE CA C 39 62.076 61.575 0.501 1
1 470 . 17 1 1 A 39 39 ILE CB C 39 38.864 39.203 -0.339 1
1 473 . 17 1 1 A 39 39 ILE N N 39 123.604 124.650 -1.046 1
1 474 . 17 1 1 A 40 40 LEU H H 40 8.239 8.153 0.086 1
1 475 . 17 1 1 A 40 40 LEU HA H 40 4.259 4.518 -0.259 1
1 485 . 17 1 1 A 40 40 LEU C C 40 173.152 175.398 -2.246 1
1 486 . 17 1 1 A 40 40 LEU CA C 40 55.305 54.775 0.530 1
1 487 . 17 1 1 A 40 40 LEU CB C 40 43.113 41.878 1.235 1
1 490 . 17 1 1 A 40 40 LEU N N 40 129.550 128.895 0.655 1
1 491 . 17 1 1 A 41 41 ASP H H 41 8.992 8.391 0.601 1
1 492 . 17 1 1 A 41 41 ASP HA H 41 4.798 4.780 0.018 1
1 495 . 17 1 1 A 41 41 ASP C C 41 173.837 176.762 -2.925 1
1 496 . 17 1 1 A 41 41 ASP CA C 41 52.077 53.471 -1.394 1
1 497 . 17 1 1 A 41 41 ASP CB C 41 39.454 40.825 -1.371 1
1 498 . 17 1 1 A 41 41 ASP N N 41 127.022 127.664 -0.642 1
1 499 . 17 1 1 A 42 42 LEU H H 42 7.912 8.760 -0.848 1
1 500 . 17 1 1 A 42 42 LEU HA H 42 3.970 4.138 -0.168 1
1 510 . 17 1 1 A 42 42 LEU C C 42 176.305 178.072 -1.767 1
1 511 . 17 1 1 A 42 42 LEU CA C 42 58.128 57.014 1.114 1
1 512 . 17 1 1 A 42 42 LEU CB C 42 43.043 41.776 1.267 1
1 514 . 17 1 1 A 42 42 LEU N N 42 125.064 128.172 -3.108 1
1 515 . 17 1 1 A 43 43 TYR H H 43 8.565 8.005 0.560 1
1 516 . 17 1 1 A 43 43 TYR HA H 43 3.728 3.718 0.010 1
1 523 . 17 1 1 A 43 43 TYR C C 43 175.757 177.099 -1.342 1
1 524 . 17 1 1 A 43 43 TYR CA C 43 61.774 61.831 -0.057 1
1 525 . 17 1 1 A 43 43 TYR CB C 43 38.235 38.694 -0.459 1
1 528 . 17 1 1 A 43 43 TYR N N 43 117.822 120.719 -2.897 1
1 529 . 17 1 1 A 44 44 SER H H 44 8.115 8.335 -0.220 1
1 530 . 17 1 1 A 44 44 SER HA H 44 3.854 4.157 -0.303 1
1 533 . 17 1 1 A 44 44 SER C C 44 174.080 176.096 -2.016 1
1 534 . 17 1 1 A 44 44 SER CA C 44 61.873 61.915 -0.042 1
1 535 . 17 1 1 A 44 44 SER CB C 44 64.350 62.909 1.441 1
1 536 . 17 1 1 A 44 44 SER N N 44 116.835 115.055 1.780 1
1 537 . 17 1 1 A 45 45 LEU H H 45 8.401 7.509 0.892 1
1 538 . 17 1 1 A 45 45 LEU HA H 45 4.102 4.163 -0.061 1
1 548 . 17 1 1 A 45 45 LEU C C 45 175.081 178.531 -3.450 1
1 549 . 17 1 1 A 45 45 LEU CA C 45 58.896 58.528 0.368 1
1 550 . 17 1 1 A 45 45 LEU CB C 45 41.741 41.686 0.055 1
1 553 . 17 1 1 A 45 45 LEU N N 45 120.621 123.354 -2.733 1
1 554 . 17 1 1 A 46 46 SER H H 46 8.110 8.737 -0.627 1
1 555 . 17 1 1 A 46 46 SER HA H 46 4.300 4.273 0.027 1
1 558 . 17 1 1 A 46 46 SER C C 46 175.019 176.684 -1.665 1
1 559 . 17 1 1 A 46 46 SER CA C 46 62.610 61.499 1.111 1
1 560 . 17 1 1 A 46 46 SER CB C 46 64.092 62.544 1.548 1
1 561 . 17 1 1 A 46 46 SER N N 46 112.826 113.120 -0.294 1
1 562 . 17 1 1 A 47 47 LYS H H 47 7.732 8.080 -0.348 1
1 563 . 17 1 1 A 47 47 LYS HA H 47 3.900 4.177 -0.277 1
1 572 . 17 1 1 A 47 47 LYS C C 47 177.441 178.794 -1.353 1
1 573 . 17 1 1 A 47 47 LYS CA C 47 58.575 59.186 -0.611 1
1 574 . 17 1 1 A 47 47 LYS CB C 47 32.351 31.763 0.588 1
1 576 . 17 1 1 A 47 47 LYS N N 47 121.210 118.955 2.255 1
1 577 . 17 1 1 A 48 48 ILE H H 48 8.672 8.299 0.373 1
1 578 . 17 1 1 A 48 48 ILE HA H 48 3.628 3.821 -0.193 1
1 588 . 17 1 1 A 48 48 ILE C C 48 175.861 178.281 -2.420 1
1 589 . 17 1 1 A 48 48 ILE CA C 48 64.188 64.714 -0.526 1
1 590 . 17 1 1 A 48 48 ILE CB C 48 37.954 36.653 1.301 1
1 593 . 17 1 1 A 48 48 ILE N N 48 120.810 121.307 -0.497 1
1 594 . 17 1 1 A 49 49 VAL H H 49 8.030 8.309 -0.279 1
1 595 . 17 1 1 A 49 49 VAL HA H 49 3.195 3.756 -0.561 1
1 603 . 17 1 1 A 49 49 VAL C C 49 176.513 178.500 -1.987 1
1 604 . 17 1 1 A 49 49 VAL CA C 49 66.760 66.577 0.183 1
1 605 . 17 1 1 A 49 49 VAL CB C 49 30.935 31.730 -0.795 1
1 608 . 17 1 1 A 49 49 VAL N N 49 119.350 120.520 -1.170 1
1 609 . 17 1 1 A 50 50 VAL H H 50 7.336 8.258 -0.922 1
1 610 . 17 1 1 A 50 50 VAL HA H 50 3.497 3.663 -0.166 1
1 618 . 17 1 1 A 50 50 VAL C C 50 178.745 177.882 0.863 1
1 619 . 17 1 1 A 50 50 VAL CA C 50 67.384 66.542 0.842 1
1 620 . 17 1 1 A 50 50 VAL CB C 50 31.832 31.678 0.154 1
1 621 . 17 1 1 A 50 50 VAL N N 50 118.610 121.215 -2.605 1
1 622 . 17 1 1 A 51 51 GLU H H 51 8.318 8.621 -0.303 1
1 623 . 17 1 1 A 51 51 GLU HA H 51 3.953 3.918 0.035 1
1 628 . 17 1 1 A 51 51 GLU C C 51 177.281 179.254 -1.973 1
1 629 . 17 1 1 A 51 51 GLU CA C 51 59.668 60.047 -0.379 1
1 630 . 17 1 1 A 51 51 GLU CB C 51 30.131 29.211 0.920 1
1 632 . 17 1 1 A 51 51 GLU N N 51 122.096 120.256 1.840 1
1 633 . 17 1 1 A 52 52 GLU H H 52 8.065 7.939 0.126 1
1 634 . 17 1 1 A 52 52 GLU HA H 52 4.229 4.252 -0.023 1
1 639 . 17 1 1 A 52 52 GLU C C 52 173.534 177.608 -4.074 1
1 640 . 17 1 1 A 52 52 GLU CA C 52 55.547 56.469 -0.922 1
1 641 . 17 1 1 A 52 52 GLU CB C 52 28.716 30.104 -1.388 1
1 643 . 17 1 1 A 52 52 GLU N N 52 114.992 115.885 -0.893 1
1 644 . 17 1 1 A 53 53 GLY H H 53 7.459 9.046 -1.587 1
1 645 . 17 1 1 A 53 53 GLY HA2 H 53 3.630 3.904 -0.274 1
1 646 . 17 1 1 A 53 53 GLY HA3 H 53 3.630 3.921 -0.291 1
1 647 . 17 1 1 A 53 53 GLY C C 53 173.214 173.674 -0.460 1
1 648 . 17 1 1 A 53 53 GLY CA C 53 44.962 46.582 -1.620 1
1 649 . 17 1 1 A 53 53 GLY N N 53 104.909 109.132 -4.223 1
1 650 . 17 1 1 A 54 54 GLY H H 54 8.533 7.567 0.966 1
1 651 . 17 1 1 A 54 54 GLY HA2 H 54 3.548 4.128 -0.580 1
1 652 . 17 1 1 A 54 54 GLY HA3 H 54 4.521 4.177 0.344 1
1 653 . 17 1 1 A 54 54 GLY C C 54 169.966 174.276 -4.310 1
1 654 . 17 1 1 A 54 54 GLY CA C 54 43.988 45.762 -1.774 1
1 655 . 17 1 1 A 54 54 GLY N N 54 110.587 106.552 4.035 1
1 656 . 17 1 1 A 55 55 TYR H H 55 8.704 9.014 -0.310 1
1 657 . 17 1 1 A 55 55 TYR HA H 55 3.618 3.984 -0.366 1
1 664 . 17 1 1 A 55 55 TYR C C 55 174.807 177.143 -2.336 1
1 665 . 17 1 1 A 55 55 TYR CA C 55 62.540 61.848 0.692 1
1 666 . 17 1 1 A 55 55 TYR CB C 55 39.669 39.397 0.272 1
1 669 . 17 1 1 A 55 55 TYR N N 55 119.168 124.975 -5.807 1
1 670 . 17 1 1 A 56 56 GLU H H 56 9.006 8.321 0.685 1
1 671 . 17 1 1 A 56 56 GLU HA H 56 3.638 3.630 0.008 1
1 676 . 17 1 1 A 56 56 GLU C C 56 177.400 179.101 -1.701 1
1 677 . 17 1 1 A 56 56 GLU CA C 56 60.530 59.308 1.222 1
1 678 . 17 1 1 A 56 56 GLU CB C 56 29.168 29.105 0.063 1
1 679 . 17 1 1 A 56 56 GLU N N 56 118.969 118.034 0.935 1
1 680 . 17 1 1 A 57 57 ALA H H 57 8.235 8.093 0.142 1
1 681 . 17 1 1 A 57 57 ALA HA H 57 3.980 3.996 -0.016 1
1 685 . 17 1 1 A 57 57 ALA C C 57 177.678 180.148 -2.470 1
1 686 . 17 1 1 A 57 57 ALA CA C 57 54.910 54.978 -0.068 1
1 687 . 17 1 1 A 57 57 ALA CB C 57 18.122 18.061 0.061 1
1 688 . 17 1 1 A 57 57 ALA N N 57 122.860 122.459 0.401 1
1 689 . 17 1 1 A 58 58 ILE H H 58 7.831 7.594 0.237 1
1 690 . 17 1 1 A 58 58 ILE HA H 58 3.189 3.234 -0.045 1
1 700 . 17 1 1 A 58 58 ILE C C 58 177.818 177.231 0.587 1
1 701 . 17 1 1 A 58 58 ILE CA C 58 65.074 64.988 0.086 1
1 702 . 17 1 1 A 58 58 ILE CB C 58 38.178 36.657 1.521 1
1 706 . 17 1 1 A 58 58 ILE N N 58 117.418 118.177 -0.759 1
1 707 . 17 1 1 A 59 59 CYS H H 59 7.760 7.897 -0.137 1
1 708 . 17 1 1 A 59 59 CYS HA H 59 4.203 3.997 0.206 1
1 711 . 17 1 1 A 59 59 CYS C C 59 176.357 177.006 -0.649 1
1 712 . 17 1 1 A 59 59 CYS CA C 59 63.760 63.473 0.287 1
1 713 . 17 1 1 A 59 59 CYS CB C 59 27.638 26.988 0.650 1
1 714 . 17 1 1 A 59 59 CYS N N 59 115.302 119.278 -3.976 1
1 715 . 17 1 1 A 60 60 LYS H H 60 8.350 7.856 0.494 1
1 716 . 17 1 1 A 60 60 LYS HA H 60 3.972 3.998 -0.026 1
1 725 . 17 1 1 A 60 60 LYS C C 60 176.373 177.663 -1.290 1
1 726 . 17 1 1 A 60 60 LYS CA C 60 59.796 59.251 0.545 1
1 727 . 17 1 1 A 60 60 LYS CB C 60 32.560 32.262 0.298 1
1 729 . 17 1 1 A 60 60 LYS N N 60 122.343 120.915 1.428 1
1 730 . 17 1 1 A 61 61 ASP H H 61 8.157 7.591 0.566 1
1 731 . 17 1 1 A 61 61 ASP HA H 61 4.616 4.632 -0.016 1
1 734 . 17 1 1 A 61 61 ASP C C 61 173.246 175.663 -2.417 1
1 735 . 17 1 1 A 61 61 ASP CA C 61 54.272 54.996 -0.724 1
1 736 . 17 1 1 A 61 61 ASP CB C 61 41.023 41.196 -0.173 1
1 737 . 17 1 1 A 61 61 ASP N N 61 116.173 118.843 -2.670 1
1 738 . 17 1 1 A 62 62 ARG H H 62 7.655 7.853 -0.198 1
1 739 . 17 1 1 A 62 62 ARG HA H 62 4.149 3.921 0.228 1
1 746 . 17 1 1 A 62 62 ARG C C 62 175.891 176.538 -0.647 1
1 747 . 17 1 1 A 62 62 ARG CA C 62 57.381 57.140 0.241 1
1 748 . 17 1 1 A 62 62 ARG CB C 62 26.538 29.315 -2.777 1
1 750 . 17 1 1 A 62 62 ARG N N 62 117.213 118.397 -1.184 1
1 751 . 17 1 1 A 63 63 ARG H H 63 8.302 7.747 0.555 1
1 752 . 17 1 1 A 63 63 ARG HA H 63 4.240 4.141 0.099 1
1 757 . 17 1 1 A 63 63 ARG C C 63 175.775 178.147 -2.372 1
1 758 . 17 1 1 A 63 63 ARG CA C 63 55.718 57.946 -2.228 1
1 760 . 17 1 1 A 63 63 ARG N N 63 116.292 119.128 -2.836 1
1 761 . 17 1 1 A 64 64 TRP H H 64 8.161 7.333 0.828 1
1 762 . 17 1 1 A 64 64 TRP HA H 64 3.836 4.375 -0.539 1
1 771 . 17 1 1 A 64 64 TRP C C 64 176.862 178.509 -1.647 1
1 772 . 17 1 1 A 64 64 TRP CA C 64 62.036 59.844 2.192 1
1 773 . 17 1 1 A 64 64 TRP CB C 64 27.028 28.667 -1.639 1
1 779 . 17 1 1 A 64 64 TRP N N 64 121.486 119.984 1.502 1
1 781 . 17 1 1 A 65 65 ALA H H 65 8.954 8.023 0.931 1
1 782 . 17 1 1 A 65 65 ALA HA H 65 4.290 4.044 0.246 1
1 786 . 17 1 1 A 65 65 ALA C C 65 178.986 179.306 -0.320 1
1 787 . 17 1 1 A 65 65 ALA CA C 65 55.314 55.464 -0.150 1
1 788 . 17 1 1 A 65 65 ALA CB C 65 18.119 18.171 -0.052 1
1 789 . 17 1 1 A 65 65 ALA N N 65 121.559 123.020 -1.461 1
1 790 . 17 1 1 A 66 66 ARG H H 66 7.473 7.964 -0.491 1
1 791 . 17 1 1 A 66 66 ARG HA H 66 4.221 4.071 0.150 1
1 798 . 17 1 1 A 66 66 ARG C C 66 176.670 178.276 -1.606 1
1 799 . 17 1 1 A 66 66 ARG CA C 66 57.871 59.478 -1.607 1
1 800 . 17 1 1 A 66 66 ARG CB C 66 29.097 29.803 -0.706 1
1 801 . 17 1 1 A 66 66 ARG N N 66 119.915 119.369 0.546 1
1 802 . 17 1 1 A 67 67 VAL H H 67 7.134 7.731 -0.597 1
1 803 . 17 1 1 A 67 67 VAL HA H 67 3.304 4.008 -0.704 1
1 811 . 17 1 1 A 67 67 VAL C C 67 175.341 178.198 -2.857 1
1 812 . 17 1 1 A 67 67 VAL CA C 67 66.722 63.787 2.935 1
1 813 . 17 1 1 A 67 67 VAL CB C 67 31.108 32.136 -1.028 1
1 816 . 17 1 1 A 67 67 VAL N N 67 119.970 117.261 2.709 1
1 817 . 17 1 1 A 68 68 ALA H H 68 7.745 8.408 -0.663 1
1 818 . 17 1 1 A 68 68 ALA HA H 68 4.076 4.219 -0.143 1
1 822 . 17 1 1 A 68 68 ALA C C 68 177.358 179.580 -2.222 1
1 823 . 17 1 1 A 68 68 ALA CA C 68 55.607 55.703 -0.096 1
1 824 . 17 1 1 A 68 68 ALA CB C 68 18.061 18.369 -0.308 1
1 825 . 17 1 1 A 68 68 ALA N N 68 118.239 124.872 -6.633 1
1 826 . 17 1 1 A 69 69 GLN H H 69 7.979 8.157 -0.178 1
1 827 . 17 1 1 A 69 69 GLN HA H 69 4.310 3.974 0.336 1
1 834 . 17 1 1 A 69 69 GLN C C 69 179.370 177.825 1.545 1
1 835 . 17 1 1 A 69 69 GLN CA C 69 59.307 59.324 -0.017 1
1 836 . 17 1 1 A 69 69 GLN CB C 69 29.257 28.489 0.768 1
1 838 . 17 1 1 A 69 69 GLN N N 69 118.484 118.274 0.210 1
1 840 . 17 1 1 A 70 70 ARG H H 70 8.374 7.992 0.382 1
1 841 . 17 1 1 A 70 70 ARG HA H 70 4.148 4.080 0.068 1
1 848 . 17 1 1 A 70 70 ARG C C 70 175.850 178.575 -2.725 1
1 849 . 17 1 1 A 70 70 ARG CA C 70 58.957 58.931 0.026 1
1 850 . 17 1 1 A 70 70 ARG CB C 70 29.799 29.915 -0.116 1
1 852 . 17 1 1 A 70 70 ARG N N 70 120.309 120.777 -0.468 1
1 853 . 17 1 1 A 71 71 LEU H H 71 7.413 7.774 -0.361 1
1 854 . 17 1 1 A 71 71 LEU HA H 71 4.341 4.067 0.274 1
1 864 . 17 1 1 A 71 71 LEU C C 71 173.391 175.802 -2.411 1
1 865 . 17 1 1 A 71 71 LEU CA C 71 54.911 54.860 0.051 1
1 866 . 17 1 1 A 71 71 LEU CB C 71 42.693 42.041 0.652 1
1 867 . 17 1 1 A 71 71 LEU N N 71 118.841 117.988 0.853 1
1 868 . 17 1 1 A 72 72 ASN H H 72 8.038 7.775 0.263 1
1 869 . 17 1 1 A 72 72 ASN HA H 72 4.394 4.296 0.098 1
1 874 . 17 1 1 A 72 72 ASN C C 72 173.042 174.137 -1.095 1
1 875 . 17 1 1 A 72 72 ASN CB C 72 36.412 36.691 -0.279 1
1 876 . 17 1 1 A 72 72 ASN N N 72 112.919 114.741 -1.822 1
1 878 . 17 1 1 A 73 73 TYR H H 73 7.874 7.799 0.075 1
1 879 . 17 1 1 A 73 73 TYR HA H 73 4.868 4.584 0.284 1
1 886 . 17 1 1 A 73 73 TYR C C 73 172.194 174.132 -1.938 1
1 887 . 17 1 1 A 73 73 TYR CA C 73 57.105 56.796 0.309 1
1 888 . 17 1 1 A 73 73 TYR CB C 73 37.918 38.242 -0.324 1
1 889 . 17 1 1 A 73 73 TYR N N 73 117.432 119.127 -1.695 1
1 897 . 17 1 1 A 75 75 PRO HA H 75 4.626 4.253 0.373 1
1 902 . 17 1 1 A 75 75 PRO C C 75 175.728 177.197 -1.469 1
1 903 . 17 1 1 A 75 75 PRO CA C 75 62.502 63.857 -1.355 1
1 904 . 17 1 1 A 75 75 PRO CB C 75 32.339 31.697 0.642 1
1 905 . 17 1 1 A 76 76 GLY H H 76 8.369 8.875 -0.506 1
1 906 . 17 1 1 A 76 76 GLY HA2 H 76 4.057 3.915 0.142 1
1 907 . 17 1 1 A 76 76 GLY HA3 H 76 4.556 3.915 0.641 1
1 908 . 17 1 1 A 76 76 GLY C C 76 173.248 174.986 -1.738 1
1 909 . 17 1 1 A 76 76 GLY CA C 76 46.180 45.342 0.838 1
1 910 . 17 1 1 A 76 76 GLY N N 76 106.185 110.899 -4.714 1
1 911 . 17 1 1 A 77 77 LYS H H 77 8.632 8.013 0.619 1
1 912 . 17 1 1 A 77 77 LYS HA H 77 4.433 4.079 0.354 1
1 921 . 17 1 1 A 77 77 LYS C C 77 174.924 176.310 -1.386 1
1 922 . 17 1 1 A 77 77 LYS CA C 77 56.453 57.241 -0.788 1
1 923 . 17 1 1 A 77 77 LYS CB C 77 33.170 29.238 3.932 1
1 925 . 17 1 1 A 77 77 LYS N N 77 119.592 115.911 3.681 1
1 926 . 17 1 1 A 78 78 ASN H H 78 8.865 8.157 0.708 1
1 927 . 17 1 1 A 78 78 ASN HA H 78 4.654 4.480 0.174 1
1 932 . 17 1 1 A 78 78 ASN C C 78 174.869 178.217 -3.348 1
1 933 . 17 1 1 A 78 78 ASN CA C 78 54.117 56.327 -2.210 1
1 934 . 17 1 1 A 78 78 ASN CB C 78 37.841 38.364 -0.523 1
1 935 . 17 1 1 A 78 78 ASN N N 78 116.880 116.219 0.661 1
1 937 . 17 1 1 A 79 79 ILE H H 79 8.008 8.207 -0.199 1
1 938 . 17 1 1 A 79 79 ILE HA H 79 3.718 3.725 -0.007 1
1 948 . 17 1 1 A 79 79 ILE C C 79 175.921 178.242 -2.321 1
1 949 . 17 1 1 A 79 79 ILE CA C 79 63.618 64.486 -0.868 1
1 950 . 17 1 1 A 79 79 ILE CB C 79 37.158 36.635 0.523 1
1 952 . 17 1 1 A 79 79 ILE N N 79 119.688 121.012 -1.324 1
1 953 . 17 1 1 A 80 80 GLY H H 80 9.062 8.296 0.766 1
1 954 . 17 1 1 A 80 80 GLY HA2 H 80 3.739 3.837 -0.098 1
1 955 . 17 1 1 A 80 80 GLY HA3 H 80 3.739 3.882 -0.143 1
1 956 . 17 1 1 A 80 80 GLY C C 80 173.185 176.419 -3.234 1
1 957 . 17 1 1 A 80 80 GLY CA C 80 48.166 47.568 0.598 1
1 958 . 17 1 1 A 80 80 GLY N N 80 110.338 108.899 1.439 1
1 959 . 17 1 1 A 81 81 SER H H 81 7.460 7.689 -0.229 1
1 960 . 17 1 1 A 81 81 SER HA H 81 3.904 4.162 -0.258 1
1 963 . 17 1 1 A 81 81 SER C C 81 174.999 176.088 -1.089 1
1 964 . 17 1 1 A 81 81 SER CA C 81 61.138 62.553 -1.415 1
1 965 . 17 1 1 A 81 81 SER CB C 81 62.740 62.847 -0.107 1
1 966 . 17 1 1 A 81 81 SER N N 81 115.348 119.808 -4.460 1
1 967 . 17 1 1 A 82 82 LEU H H 82 7.367 8.079 -0.712 1
1 968 . 17 1 1 A 82 82 LEU HA H 82 3.946 4.055 -0.109 1
1 977 . 17 1 1 A 82 82 LEU C C 82 176.969 178.226 -1.257 1
1 978 . 17 1 1 A 82 82 LEU CA C 82 57.504 58.604 -1.100 1
1 979 . 17 1 1 A 82 82 LEU CB C 82 42.185 41.623 0.562 1
1 980 . 17 1 1 A 82 82 LEU N N 82 124.267 122.595 1.672 1
1 981 . 17 1 1 A 83 83 LEU H H 83 8.330 8.449 -0.119 1
1 982 . 17 1 1 A 83 83 LEU HA H 83 3.924 3.929 -0.005 1
1 991 . 17 1 1 A 83 83 LEU C C 83 176.303 178.421 -2.118 1
1 992 . 17 1 1 A 83 83 LEU CA C 83 58.067 58.399 -0.332 1
1 993 . 17 1 1 A 83 83 LEU CB C 83 41.061 41.376 -0.315 1
1 994 . 17 1 1 A 83 83 LEU N N 83 117.452 119.617 -2.165 1
1 995 . 17 1 1 A 84 84 ARG H H 84 7.651 7.977 -0.326 1
1 996 . 17 1 1 A 84 84 ARG HA H 84 2.230 3.555 -1.325 1
1 1003 . 17 1 1 A 84 84 ARG C C 84 175.902 178.839 -2.937 1
1 1004 . 17 1 1 A 84 84 ARG CA C 84 59.112 59.360 -0.248 1
1 1005 . 17 1 1 A 84 84 ARG CB C 84 28.579 29.745 -1.166 1
1 1007 . 17 1 1 A 84 84 ARG N N 84 119.586 119.860 -0.274 1
1 1008 . 17 1 1 A 85 85 SER H H 85 7.291 8.328 -1.037 1
1 1009 . 17 1 1 A 85 85 SER HA H 85 4.189 4.130 0.059 1
1 1012 . 17 1 1 A 85 85 SER C C 85 175.546 176.517 -0.971 1
1 1013 . 17 1 1 A 85 85 SER CA C 85 61.376 62.171 -0.795 1
1 1014 . 17 1 1 A 85 85 SER CB C 85 62.805 63.199 -0.394 1
1 1015 . 17 1 1 A 85 85 SER N N 85 112.921 116.279 -3.358 1
1 1016 . 17 1 1 A 86 86 HIS H H 86 8.156 7.680 0.476 1
1 1017 . 17 1 1 A 86 86 HIS HA H 86 4.782 4.248 0.534 1
1 1022 . 17 1 1 A 86 86 HIS C C 86 176.851 177.488 -0.637 1
1 1023 . 17 1 1 A 86 86 HIS CA C 86 58.898 59.796 -0.898 1
1 1024 . 17 1 1 A 86 86 HIS CB C 86 31.110 30.237 0.873 1
1 1027 . 17 1 1 A 86 86 HIS N N 86 119.258 119.399 -0.141 1
1 1028 . 17 1 1 A 87 87 TYR H H 87 9.180 8.342 0.838 1
1 1029 . 17 1 1 A 87 87 TYR HA H 87 3.913 3.873 0.040 1
1 1036 . 17 1 1 A 87 87 TYR C C 87 176.841 177.686 -0.845 1
1 1037 . 17 1 1 A 87 87 TYR CA C 87 63.526 61.655 1.871 1
1 1038 . 17 1 1 A 87 87 TYR CB C 87 39.431 38.222 1.209 1
1 1041 . 17 1 1 A 87 87 TYR N N 87 120.625 119.914 0.711 1
1 1042 . 17 1 1 A 88 88 GLU H H 88 9.028 8.255 0.773 1
1 1043 . 17 1 1 A 88 88 GLU HA H 88 3.682 3.969 -0.287 1
1 1048 . 17 1 1 A 88 88 GLU C C 88 175.833 178.121 -2.288 1
1 1049 . 17 1 1 A 88 88 GLU CA C 88 59.730 59.624 0.106 1
1 1050 . 17 1 1 A 88 88 GLU CB C 88 30.009 29.504 0.505 1
1 1052 . 17 1 1 A 88 88 GLU N N 88 119.531 119.719 -0.188 1
1 1053 . 17 1 1 A 89 89 ARG H H 89 8.052 7.634 0.418 1
1 1054 . 17 1 1 A 89 89 ARG HA H 89 4.292 4.575 -0.283 1
1 1061 . 17 1 1 A 89 89 ARG C C 89 176.045 176.862 -0.817 1
1 1062 . 17 1 1 A 89 89 ARG CA C 89 58.538 57.039 1.499 1
1 1063 . 17 1 1 A 89 89 ARG CB C 89 31.841 31.165 0.676 1
1 1065 . 17 1 1 A 89 89 ARG N N 89 114.741 116.763 -2.022 1
1 1066 . 17 1 1 A 90 90 ILE H H 90 8.141 7.431 0.710 1
1 1067 . 17 1 1 A 90 90 ILE HA H 90 4.296 4.046 0.250 1
1 1075 . 17 1 1 A 90 90 ILE C C 90 174.461 176.925 -2.464 1
1 1076 . 17 1 1 A 90 90 ILE CA C 90 63.649 62.682 0.967 1
1 1077 . 17 1 1 A 90 90 ILE CB C 90 40.626 39.836 0.790 1
1 1079 . 17 1 1 A 90 90 ILE N N 90 113.421 119.177 -5.756 1
1 1080 . 17 1 1 A 91 91 VAL H H 91 7.350 7.831 -0.481 1
1 1081 . 17 1 1 A 91 91 VAL HA H 91 4.144 3.751 0.393 1
1 1089 . 17 1 1 A 91 91 VAL C C 91 175.422 176.551 -1.129 1
1 1090 . 17 1 1 A 91 91 VAL CA C 91 65.042 63.096 1.946 1
1 1091 . 17 1 1 A 91 91 VAL CB C 91 33.215 31.473 1.742 1
1 1092 . 17 1 1 A 91 91 VAL N N 91 118.215 120.386 -2.171 1
1 1093 . 17 1 1 A 92 92 TYR H H 92 8.565 8.044 0.521 1
1 1094 . 17 1 1 A 92 92 TYR HA H 92 4.217 4.420 -0.203 1
1 1099 . 17 1 1 A 92 92 TYR C C 92 171.495 174.751 -3.256 1
1 1100 . 17 1 1 A 92 92 TYR CA C 92 61.558 62.463 -0.905 1
1 1101 . 17 1 1 A 92 92 TYR CB C 92 36.757 37.111 -0.354 1
1 1102 . 17 1 1 A 92 92 TYR N N 92 121.370 122.390 -1.020 1
1 1103 . 17 1 1 A 93 93 PRO HA H 93 4.136 4.374 -0.238 1
1 1108 . 17 1 1 A 93 93 PRO C C 93 177.077 178.202 -1.125 1
1 1109 . 17 1 1 A 93 93 PRO CA C 93 66.037 65.945 0.092 1
1 1110 . 17 1 1 A 93 93 PRO CB C 93 31.482 30.876 0.606 1
1 1111 . 17 1 1 A 94 94 TYR H H 94 6.517 7.431 -0.914 1
1 1112 . 17 1 1 A 94 94 TYR HA H 94 2.798 4.344 -1.546 1
1 1119 . 17 1 1 A 94 94 TYR C C 94 174.985 178.086 -3.101 1
1 1120 . 17 1 1 A 94 94 TYR CA C 94 59.356 59.102 0.254 1
1 1121 . 17 1 1 A 94 94 TYR CB C 94 37.987 36.949 1.038 1
1 1124 . 17 1 1 A 94 94 TYR N N 94 115.987 117.818 -1.831 1
1 1125 . 17 1 1 A 95 95 GLU H H 95 8.205 8.220 -0.015 1
1 1126 . 17 1 1 A 95 95 GLU HA H 95 3.682 4.137 -0.455 1
1 1131 . 17 1 1 A 95 95 GLU C C 95 178.530 179.067 -0.537 1
1 1132 . 17 1 1 A 95 95 GLU CA C 95 58.910 59.787 -0.877 1
1 1133 . 17 1 1 A 95 95 GLU CB C 95 29.187 29.324 -0.137 1
1 1134 . 17 1 1 A 95 95 GLU N N 95 119.946 121.495 -1.549 1
1 1135 . 17 1 1 A 96 96 MET H H 96 8.248 8.142 0.106 1
1 1136 . 17 1 1 A 96 96 MET HA H 96 4.172 4.198 -0.026 1
1 1142 . 17 1 1 A 96 96 MET C C 96 176.874 178.216 -1.342 1
1 1143 . 17 1 1 A 96 96 MET CA C 96 57.159 58.708 -1.549 1
1 1144 . 17 1 1 A 96 96 MET CB C 96 31.829 32.643 -0.814 1
1 1146 . 17 1 1 A 96 96 MET N N 96 117.570 118.738 -1.168 1
1 1147 . 17 1 1 A 97 97 TYR H H 97 7.445 8.453 -1.008 1
1 1148 . 17 1 1 A 97 97 TYR HA H 97 4.248 4.003 0.245 1
1 1155 . 17 1 1 A 97 97 TYR C C 97 176.476 177.096 -0.620 1
1 1156 . 17 1 1 A 97 97 TYR CA C 97 60.470 62.080 -1.610 1
1 1157 . 17 1 1 A 97 97 TYR CB C 97 38.612 38.425 0.187 1
1 1160 . 17 1 1 A 97 97 TYR N N 97 122.246 121.875 0.371 1
1 1161 . 17 1 1 A 98 98 GLN H H 98 8.087 8.659 -0.572 1
1 1162 . 17 1 1 A 98 98 GLN HA H 98 3.793 3.650 0.143 1
1 1169 . 17 1 1 A 98 98 GLN C C 98 175.549 178.456 -2.907 1
1 1170 . 17 1 1 A 98 98 GLN CA C 98 57.365 58.793 -1.428 1
1 1171 . 17 1 1 A 98 98 GLN CB C 98 28.901 28.892 0.009 1
1 1173 . 17 1 1 A 98 98 GLN N N 98 118.769 119.638 -0.869 1
1 1175 . 17 1 1 A 99 99 SER H H 99 7.724 8.234 -0.510 1
1 1176 . 17 1 1 A 99 99 SER HA H 99 4.293 4.279 0.014 1
1 1179 . 17 1 1 A 99 99 SER C C 99 173.696 176.659 -2.963 1
1 1180 . 17 1 1 A 99 99 SER CA C 99 59.566 62.729 -3.163 1
1 1181 . 17 1 1 A 99 99 SER CB C 99 63.847 62.494 1.353 1
1 1182 . 17 1 1 A 99 99 SER N N 99 113.257 117.071 -3.814 1
1 1183 . 17 1 1 A 100 100 GLY H H 100 7.751 8.287 -0.536 1
1 1184 . 17 1 1 A 100 100 GLY HA2 H 100 3.813 3.852 -0.039 1
1 1185 . 17 1 1 A 100 100 GLY HA3 H 100 3.934 3.854 0.080 1
1 1186 . 17 1 1 A 100 100 GLY C C 100 172.643 176.376 -3.733 1
1 1187 . 17 1 1 A 100 100 GLY CA C 100 45.570 47.146 -1.576 1
1 1188 . 17 1 1 A 100 100 GLY N N 100 109.750 108.877 0.873 1
1 1189 . 17 1 1 A 101 101 ALA H H 101 7.824 7.853 -0.029 1
1 1190 . 17 1 1 A 101 101 ALA HA H 101 4.221 4.025 0.196 1
1 1194 . 17 1 1 A 101 101 ALA C C 101 175.639 178.772 -3.133 1
1 1195 . 17 1 1 A 101 101 ALA CA C 101 52.745 54.388 -1.643 1
1 1196 . 17 1 1 A 101 101 ALA CB C 101 19.437 18.422 1.015 1
1 1197 . 17 1 1 A 101 101 ALA N N 101 123.241 124.746 -1.505 1
1 1198 . 17 1 1 A 102 102 ASN H H 102 8.191 8.013 0.178 1
1 1199 . 17 1 1 A 102 102 ASN HA H 102 4.658 4.770 -0.112 1
1 1204 . 17 1 1 A 102 102 ASN C C 102 173.337 174.940 -1.603 1
1 1205 . 17 1 1 A 102 102 ASN CA C 102 53.374 54.915 -1.541 1
1 1206 . 17 1 1 A 102 102 ASN CB C 102 38.819 39.718 -0.899 1
1 1207 . 17 1 1 A 102 102 ASN N N 102 116.572 116.292 0.280 1
1 1209 . 17 1 1 A 103 103 LEU H H 103 8.065 7.813 0.252 1
1 1210 . 17 1 1 A 103 103 LEU HA H 103 4.363 4.800 -0.437 1
1 1219 . 17 1 1 A 103 103 LEU C C 103 175.637 175.258 0.379 1
1 1220 . 17 1 1 A 103 103 LEU CA C 103 55.292 53.347 1.945 1
1 1221 . 17 1 1 A 103 103 LEU CB C 103 42.433 44.838 -2.405 1
1 1222 . 17 1 1 A 103 103 LEU N N 103 122.074 114.576 7.498 1
1 1223 . 17 1 1 A 104 104 VAL H H 104 8.055 9.059 -1.004 1
1 1224 . 17 1 1 A 104 104 VAL HA H 104 4.131 4.563 -0.432 1
1 1232 . 17 1 1 A 104 104 VAL C C 104 174.364 175.687 -1.323 1
1 1233 . 17 1 1 A 104 104 VAL CA C 104 62.552 61.086 1.466 1
1 1234 . 17 1 1 A 104 104 VAL CB C 104 32.766 32.443 0.323 1
1 1235 . 17 1 1 A 104 104 VAL N N 104 120.606 124.152 -3.546 1
1 1236 . 17 1 1 A 105 105 CYS H H 105 8.392 8.739 -0.347 1
1 1237 . 17 1 1 A 105 105 CYS HA H 105 4.535 4.920 -0.385 1
1 1240 . 17 1 1 A 105 105 CYS C C 105 172.593 175.552 -2.959 1
1 1241 . 17 1 1 A 105 105 CYS CA C 105 58.449 58.628 -0.179 1
1 1242 . 17 1 1 A 105 105 CYS CB C 105 27.952 29.043 -1.091 1
1 1243 . 17 1 1 A 105 105 CYS N N 105 122.791 128.583 -5.792 1
1 1244 . 17 1 1 A 106 106 ASN H H 106 8.575 8.303 0.272 1
1 1245 . 17 1 1 A 106 106 ASN HA H 106 4.843 4.805 0.038 1
1 1250 . 17 1 1 A 106 106 ASN C C 106 173.594 177.460 -3.866 1
1 1251 . 17 1 1 A 106 106 ASN CA C 106 53.337 55.237 -1.900 1
1 1252 . 17 1 1 A 106 106 ASN CB C 106 39.088 39.119 -0.031 1
1 1253 . 17 1 1 A 106 106 ASN N N 106 122.001 118.847 3.154 1
1 1255 . 17 1 1 A 107 107 THR H H 107 8.090 8.091 -0.001 1
1 1256 . 17 1 1 A 107 107 THR HA H 107 4.348 3.950 0.398 1
1 1261 . 17 1 1 A 107 107 THR C C 107 172.516 175.956 -3.440 1
1 1262 . 17 1 1 A 107 107 THR CA C 107 61.803 66.996 -5.193 1
1 1263 . 17 1 1 A 107 107 THR CB C 107 69.812 68.826 0.986 1
1 1265 . 17 1 1 A 107 107 THR N N 107 114.374 116.696 -2.322 1
1 1266 . 17 1 1 A 108 108 ARG H H 108 8.322 7.869 0.453 1
1 1267 . 17 1 1 A 108 108 ARG HA H 108 4.634 4.287 0.347 1
1 1274 . 17 1 1 A 108 108 ARG C C 108 172.608 177.196 -4.588 1
1 1275 . 17 1 1 A 108 108 ARG CA C 108 54.026 59.842 -5.816 1
1 1276 . 17 1 1 A 108 108 ARG CB C 108 30.246 30.892 -0.646 1
1 1278 . 17 1 1 A 108 108 ARG N N 108 124.017 119.882 4.135 1
1 1279 . 17 1 1 A 109 109 PRO HA H 109 4.354 4.362 -0.008 1
1 1286 . 17 1 1 A 109 109 PRO C C 109 174.978 178.846 -3.868 1
1 1287 . 17 1 1 A 109 109 PRO CA C 109 63.396 65.655 -2.259 1
1 1288 . 17 1 1 A 109 109 PRO CB C 109 32.046 31.013 1.033 1
1 1290 . 17 1 1 A 110 110 PHE H H 110 8.123 7.853 0.270 1
1 1291 . 17 1 1 A 110 110 PHE HA H 110 4.619 4.353 0.266 1
1 1296 . 17 1 1 A 110 110 PHE C C 110 173.856 177.026 -3.170 1
1 1297 . 17 1 1 A 110 110 PHE CA C 110 57.353 62.082 -4.729 1
1 1298 . 17 1 1 A 110 110 PHE CB C 110 39.364 39.285 0.079 1
1 1301 . 17 1 1 A 110 110 PHE N N 110 119.265 118.573 0.692 1
1 1302 . 17 1 1 A 111 111 ASP H H 111 8.161 8.598 -0.437 1
1 1303 . 17 1 1 A 111 111 ASP HA H 111 4.613 4.438 0.175 1
1 1306 . 17 1 1 A 111 111 ASP C C 111 174.114 178.574 -4.460 1
1 1307 . 17 1 1 A 111 111 ASP CA C 111 54.350 57.680 -3.330 1
1 1308 . 17 1 1 A 111 111 ASP CB C 111 41.413 41.029 0.384 1
1 1309 . 17 1 1 A 111 111 ASP N N 111 121.764 119.393 2.371 1
1 1310 . 17 1 1 A 112 112 ASN H H 112 8.307 8.787 -0.480 1
1 1311 . 17 1 1 A 112 112 ASN HA H 112 4.662 4.499 0.163 1
1 1316 . 17 1 1 A 112 112 ASN C C 112 173.595 177.027 -3.432 1
1 1317 . 17 1 1 A 112 112 ASN CA C 112 53.486 56.717 -3.231 1
1 1318 . 17 1 1 A 112 112 ASN CB C 112 39.225 39.015 0.210 1
1 1319 . 17 1 1 A 112 112 ASN N N 112 119.154 117.684 1.470 1
1 1321 . 17 1 1 A 113 113 GLU H H 113 8.404 8.080 0.324 1
1 1322 . 17 1 1 A 113 113 GLU HA H 113 4.264 4.229 0.035 1
1 1327 . 17 1 1 A 113 113 GLU C C 113 174.886 178.948 -4.062 1
1 1328 . 17 1 1 A 113 113 GLU CA C 113 56.681 58.288 -1.607 1
1 1329 . 17 1 1 A 113 113 GLU CB C 113 30.403 29.750 0.653 1
1 1331 . 17 1 1 A 113 113 GLU N N 113 120.943 117.931 3.012 1
1 1332 . 17 1 1 A 114 114 GLU H H 114 8.388 8.118 0.270 1
1 1333 . 17 1 1 A 114 114 GLU HA H 114 4.262 4.164 0.098 1
1 1338 . 17 1 1 A 114 114 GLU C C 114 174.819 177.390 -2.571 1
1 1339 . 17 1 1 A 114 114 GLU CA C 114 56.769 58.982 -2.213 1
1 1340 . 17 1 1 A 114 114 GLU CB C 114 30.125 29.781 0.344 1
1 1342 . 17 1 1 A 114 114 GLU N N 114 121.869 119.791 2.078 1
1 1343 . 17 1 1 A 115 115 LYS H H 115 8.236 7.875 0.361 1
1 1344 . 17 1 1 A 115 115 LYS HA H 115 4.347 4.670 -0.323 1
1 1353 . 17 1 1 A 115 115 LYS C C 115 174.633 176.365 -1.732 1
1 1354 . 17 1 1 A 115 115 LYS CA C 115 56.426 54.973 1.453 1
1 1355 . 17 1 1 A 115 115 LYS CB C 115 33.277 30.858 2.419 1
1 1359 . 17 1 1 A 115 115 LYS N N 115 121.997 118.362 3.635 1
1 1360 . 17 1 1 A 116 116 ASP H H 116 8.386 8.361 0.025 1
1 1361 . 17 1 1 A 116 116 ASP HA H 116 4.600 4.453 0.147 1
1 1364 . 17 1 1 A 116 116 ASP C C 116 173.448 175.842 -2.394 1
1 1365 . 17 1 1 A 116 116 ASP CA C 116 54.773 55.653 -0.880 1
1 1366 . 17 1 1 A 116 116 ASP CB C 116 41.029 39.678 1.351 1
1 1367 . 17 1 1 A 116 116 ASP N N 116 121.057 121.147 -0.090 1
1 5 . 18 1 1 A 2 2 MET HA H 2 4.534 4.501 0.033 1
1 13 . 18 1 1 A 2 2 MET C C 2 174.355 177.088 -2.733 1
1 14 . 18 1 1 A 2 2 MET CA C 2 56.247 56.081 0.166 1
1 15 . 18 1 1 A 2 2 MET CB C 2 32.855 33.081 -0.226 1
1 18 . 18 1 1 A 3 3 ASN H H 3 8.600 8.039 0.561 1
1 19 . 18 1 1 A 3 3 ASN HA H 3 4.711 4.479 0.232 1
1 24 . 18 1 1 A 3 3 ASN C C 3 173.983 177.508 -3.525 1
1 25 . 18 1 1 A 3 3 ASN CA C 3 53.650 56.611 -2.961 1
1 26 . 18 1 1 A 3 3 ASN CB C 3 38.624 39.786 -1.162 1
1 27 . 18 1 1 A 3 3 ASN N N 3 120.149 120.157 -0.008 1
1 29 . 18 1 1 A 4 4 GLU H H 4 8.495 8.273 0.222 1
1 30 . 18 1 1 A 4 4 GLU HA H 4 4.235 4.033 0.202 1
1 35 . 18 1 1 A 4 4 GLU C C 4 175.752 179.031 -3.279 1
1 36 . 18 1 1 A 4 4 GLU CA C 4 58.075 59.197 -1.122 1
1 37 . 18 1 1 A 4 4 GLU CB C 4 30.125 29.157 0.968 1
1 38 . 18 1 1 A 4 4 GLU N N 4 121.543 118.564 2.979 1
1 39 . 18 1 1 A 5 5 LEU HA H 5 4.073 4.191 -0.118 1
1 47 . 18 1 1 A 5 5 LEU CB C 5 41.897 41.835 0.062 1
1 50 . 18 1 1 A 6 6 GLU H H 6 8.332 8.312 0.020 1
1 51 . 18 1 1 A 6 6 GLU HA H 6 3.621 4.324 -0.703 1
1 52 . 18 1 1 A 6 6 GLU C C 6 176.402 178.294 -1.892 1
1 53 . 18 1 1 A 6 6 GLU CA C 6 58.461 58.602 -0.141 1
1 54 . 18 1 1 A 6 6 GLU CB C 6 29.730 29.152 0.578 1
1 55 . 18 1 1 A 6 6 GLU N N 6 121.462 117.885 3.577 1
1 56 . 18 1 1 A 7 7 ALA H H 7 8.244 7.665 0.579 1
1 57 . 18 1 1 A 7 7 ALA HA H 7 4.185 4.079 0.106 1
1 61 . 18 1 1 A 7 7 ALA C C 7 177.982 178.059 -0.077 1
1 62 . 18 1 1 A 7 7 ALA CA C 7 54.791 55.399 -0.608 1
1 63 . 18 1 1 A 7 7 ALA CB C 7 18.836 19.024 -0.188 1
1 64 . 18 1 1 A 7 7 ALA N N 7 123.078 121.366 1.712 1
1 65 . 18 1 1 A 8 8 GLN H H 8 8.274 7.807 0.467 1
1 66 . 18 1 1 A 8 8 GLN HA H 8 4.219 4.666 -0.447 1
1 73 . 18 1 1 A 8 8 GLN C C 8 176.325 175.137 1.188 1
1 74 . 18 1 1 A 8 8 GLN CA C 8 57.864 54.685 3.179 1
1 75 . 18 1 1 A 8 8 GLN CB C 8 28.768 30.354 -1.586 1
1 77 . 18 1 1 A 8 8 GLN N N 8 117.452 115.405 2.047 1
1 79 . 18 1 1 A 9 9 THR H H 9 8.043 8.623 -0.580 1
1 80 . 18 1 1 A 9 9 THR HA H 9 3.998 4.711 -0.713 1
1 85 . 18 1 1 A 9 9 THR C C 9 173.904 174.503 -0.599 1
1 86 . 18 1 1 A 9 9 THR CA C 9 65.435 60.870 4.565 1
1 87 . 18 1 1 A 9 9 THR CB C 9 68.870 69.833 -0.963 1
1 89 . 18 1 1 A 9 9 THR N N 9 116.135 118.897 -2.762 1
1 90 . 18 1 1 A 10 10 ARG H H 10 8.095 8.934 -0.839 1
1 91 . 18 1 1 A 10 10 ARG HA H 10 4.040 3.965 0.075 1
1 98 . 18 1 1 A 10 10 ARG C C 10 176.583 175.604 0.979 1
1 99 . 18 1 1 A 10 10 ARG CA C 10 59.262 57.544 1.718 1
1 100 . 18 1 1 A 10 10 ARG CB C 10 29.900 27.941 1.959 1
1 101 . 18 1 1 A 10 10 ARG N N 10 121.157 119.910 1.247 1
1 102 . 18 1 1 A 11 11 VAL H H 11 7.657 7.895 -0.238 1
1 103 . 18 1 1 A 11 11 VAL HA H 11 3.769 4.414 -0.645 1
1 111 . 18 1 1 A 11 11 VAL C C 11 176.662 177.741 -1.079 1
1 112 . 18 1 1 A 11 11 VAL CA C 11 65.914 64.250 1.664 1
1 113 . 18 1 1 A 11 11 VAL CB C 11 31.745 33.419 -1.674 1
1 114 . 18 1 1 A 11 11 VAL N N 11 118.580 118.000 0.580 1
1 115 . 18 1 1 A 12 12 LYS H H 12 7.471 8.440 -0.969 1
1 116 . 18 1 1 A 12 12 LYS HA H 12 3.366 4.416 -1.050 1
1 123 . 18 1 1 A 12 12 LYS C C 12 176.457 179.461 -3.004 1
1 124 . 18 1 1 A 12 12 LYS CA C 12 59.545 59.390 0.155 1
1 125 . 18 1 1 A 12 12 LYS CB C 12 32.206 31.985 0.221 1
1 126 . 18 1 1 A 12 12 LYS N N 12 121.835 122.015 -0.180 1
1 127 . 18 1 1 A 13 13 LEU H H 13 8.144 8.199 -0.055 1
1 128 . 18 1 1 A 13 13 LEU HA H 13 4.093 4.097 -0.004 1
1 137 . 18 1 1 A 13 13 LEU C C 13 178.254 178.699 -0.445 1
1 138 . 18 1 1 A 13 13 LEU CA C 13 58.023 57.893 0.130 1
1 139 . 18 1 1 A 13 13 LEU CB C 13 41.283 41.599 -0.316 1
1 140 . 18 1 1 A 13 13 LEU N N 13 118.688 120.206 -1.518 1
1 141 . 18 1 1 A 14 14 ASN H H 14 8.384 8.509 -0.125 1
1 142 . 18 1 1 A 14 14 ASN HA H 14 4.567 4.444 0.123 1
1 147 . 18 1 1 A 14 14 ASN C C 14 175.397 177.187 -1.790 1
1 148 . 18 1 1 A 14 14 ASN CA C 14 56.239 56.445 -0.206 1
1 149 . 18 1 1 A 14 14 ASN CB C 14 38.432 39.175 -0.743 1
1 150 . 18 1 1 A 14 14 ASN N N 14 118.175 117.163 1.012 1
1 152 . 18 1 1 A 15 15 TYR H H 15 7.982 8.028 -0.046 1
1 153 . 18 1 1 A 15 15 TYR HA H 15 4.249 4.088 0.161 1
1 160 . 18 1 1 A 15 15 TYR C C 15 175.503 177.423 -1.920 1
1 161 . 18 1 1 A 15 15 TYR CA C 15 62.450 61.409 1.041 1
1 162 . 18 1 1 A 15 15 TYR CB C 15 39.399 38.483 0.916 1
1 163 . 18 1 1 A 15 15 TYR N N 15 121.955 120.528 1.427 1
1 164 . 18 1 1 A 16 16 LEU H H 16 8.198 8.330 -0.132 1
1 165 . 18 1 1 A 16 16 LEU HA H 16 4.470 3.952 0.518 1
1 175 . 18 1 1 A 16 16 LEU C C 16 177.125 177.984 -0.859 1
1 176 . 18 1 1 A 16 16 LEU CA C 16 57.374 58.158 -0.784 1
1 177 . 18 1 1 A 16 16 LEU CB C 16 41.443 41.651 -0.208 1
1 178 . 18 1 1 A 16 16 LEU N N 16 117.642 121.541 -3.899 1
1 179 . 18 1 1 A 17 17 ASP H H 17 8.061 8.290 -0.229 1
1 180 . 18 1 1 A 17 17 ASP C C 17 177.836 178.278 -0.442 1
1 181 . 18 1 1 A 17 17 ASP CA C 17 57.486 57.882 -0.396 1
1 182 . 18 1 1 A 17 17 ASP CB C 17 41.433 42.258 -0.825 1
1 183 . 18 1 1 A 17 17 ASP N N 17 118.700 118.891 -0.191 1
1 184 . 18 1 1 A 18 18 GLN H H 18 8.111 7.761 0.350 1
1 185 . 18 1 1 A 18 18 GLN HA H 18 4.002 4.056 -0.054 1
1 190 . 18 1 1 A 18 18 GLN CA C 18 59.046 58.759 0.287 1
1 191 . 18 1 1 A 18 18 GLN CB C 18 28.700 28.543 0.157 1
1 193 . 18 1 1 A 18 18 GLN N N 18 119.539 118.670 0.869 1
1 195 . 18 1 1 A 19 19 ILE H H 19 8.330 8.275 0.055 1
1 196 . 18 1 1 A 19 19 ILE HA H 19 3.306 3.746 -0.440 1
1 204 . 18 1 1 A 19 19 ILE C C 19 175.608 177.394 -1.786 1
1 205 . 18 1 1 A 19 19 ILE CA C 19 64.760 63.004 1.756 1
1 206 . 18 1 1 A 19 19 ILE CB C 19 37.148 37.081 0.067 1
1 209 . 18 1 1 A 19 19 ILE N N 19 121.490 119.974 1.516 1
1 210 . 18 1 1 A 20 20 ALA H H 20 8.057 7.732 0.325 1
1 211 . 18 1 1 A 20 20 ALA HA H 20 4.349 4.456 -0.107 1
1 215 . 18 1 1 A 20 20 ALA C C 20 179.297 179.376 -0.079 1
1 216 . 18 1 1 A 20 20 ALA CA C 20 56.150 54.539 1.611 1
1 217 . 18 1 1 A 20 20 ALA CB C 20 18.104 19.345 -1.241 1
1 218 . 18 1 1 A 20 20 ALA N N 20 124.441 124.091 0.350 1
1 219 . 18 1 1 A 21 21 LYS H H 21 8.116 7.803 0.313 1
1 220 . 18 1 1 A 21 21 LYS HA H 21 4.108 4.085 0.023 1
1 229 . 18 1 1 A 21 21 LYS C C 21 176.720 178.584 -1.864 1
1 230 . 18 1 1 A 21 21 LYS CA C 21 59.166 59.382 -0.216 1
1 231 . 18 1 1 A 21 21 LYS CB C 21 32.085 32.279 -0.194 1
1 233 . 18 1 1 A 21 21 LYS N N 21 119.865 119.404 0.461 1
1 234 . 18 1 1 A 22 22 PHE H H 22 7.875 8.064 -0.189 1
1 235 . 18 1 1 A 22 22 PHE HA H 22 4.012 4.153 -0.141 1
1 242 . 18 1 1 A 22 22 PHE C C 22 175.545 177.367 -1.822 1
1 243 . 18 1 1 A 22 22 PHE CA C 22 61.070 61.357 -0.287 1
1 244 . 18 1 1 A 22 22 PHE CB C 22 39.072 39.036 0.036 1
1 249 . 18 1 1 A 22 22 PHE N N 22 119.729 119.894 -0.165 1
1 250 . 18 1 1 A 23 23 TRP H H 23 7.841 8.435 -0.594 1
1 251 . 18 1 1 A 23 23 TRP HA H 23 4.149 3.940 0.209 1
1 260 . 18 1 1 A 23 23 TRP C C 23 176.668 177.826 -1.158 1
1 261 . 18 1 1 A 23 23 TRP CB C 23 28.543 29.572 -1.029 1
1 267 . 18 1 1 A 23 23 TRP N N 23 119.440 120.910 -1.470 1
1 269 . 18 1 1 A 24 24 GLU H H 24 8.261 8.335 -0.074 1
1 270 . 18 1 1 A 24 24 GLU HA H 24 4.265 4.278 -0.013 1
1 275 . 18 1 1 A 24 24 GLU C C 24 179.679 179.464 0.215 1
1 276 . 18 1 1 A 24 24 GLU CA C 24 59.706 59.150 0.556 1
1 277 . 18 1 1 A 24 24 GLU CB C 24 29.720 29.108 0.612 1
1 279 . 18 1 1 A 24 24 GLU N N 24 121.376 118.645 2.731 1
1 280 . 18 1 1 A 25 25 ILE H H 25 8.071 7.753 0.318 1
1 281 . 18 1 1 A 25 25 ILE HA H 25 3.815 3.758 0.057 1
1 291 . 18 1 1 A 25 25 ILE C C 25 176.343 177.831 -1.488 1
1 292 . 18 1 1 A 25 25 ILE CA C 25 64.464 62.585 1.879 1
1 293 . 18 1 1 A 25 25 ILE CB C 25 37.371 37.243 0.128 1
1 296 . 18 1 1 A 25 25 ILE N N 25 121.499 119.649 1.850 1
1 297 . 18 1 1 A 26 26 GLN H H 26 7.327 7.240 0.087 1
1 298 . 18 1 1 A 26 26 GLN HA H 26 4.074 4.126 -0.052 1
1 305 . 18 1 1 A 26 26 GLN C C 26 174.906 175.712 -0.806 1
1 306 . 18 1 1 A 26 26 GLN CA C 26 55.450 55.634 -0.184 1
1 307 . 18 1 1 A 26 26 GLN CB C 26 28.458 28.885 -0.427 1
1 309 . 18 1 1 A 26 26 GLN N N 26 116.532 120.402 -3.870 1
1 311 . 18 1 1 A 27 27 GLY H H 27 7.861 8.573 -0.712 1
1 312 . 18 1 1 A 27 27 GLY HA2 H 27 4.297 3.712 0.585 1
1 313 . 18 1 1 A 27 27 GLY HA3 H 27 3.823 3.714 0.109 1
1 314 . 18 1 1 A 27 27 GLY C C 27 172.698 173.228 -0.530 1
1 315 . 18 1 1 A 27 27 GLY CA C 27 45.608 45.448 0.160 1
1 316 . 18 1 1 A 27 27 GLY N N 27 106.837 108.377 -1.540 1
1 317 . 18 1 1 A 28 28 SER H H 28 8.083 7.114 0.969 1
1 318 . 18 1 1 A 28 28 SER HA H 28 4.777 4.761 0.016 1
1 321 . 18 1 1 A 28 28 SER C C 28 171.196 171.865 -0.669 1
1 322 . 18 1 1 A 28 28 SER CA C 28 56.041 56.897 -0.856 1
1 323 . 18 1 1 A 28 28 SER CB C 28 64.539 66.560 -2.021 1
1 324 . 18 1 1 A 28 28 SER N N 28 116.151 114.324 1.827 1
1 325 . 18 1 1 A 29 29 SER H H 29 8.354 8.576 -0.222 1
1 326 . 18 1 1 A 29 29 SER HA H 29 4.389 5.047 -0.658 1
1 329 . 18 1 1 A 29 29 SER C C 29 172.166 172.843 -0.677 1
1 330 . 18 1 1 A 29 29 SER CA C 29 58.107 56.557 1.550 1
1 331 . 18 1 1 A 29 29 SER CB C 29 63.853 66.040 -2.187 1
1 332 . 18 1 1 A 29 29 SER N N 29 116.596 114.281 2.315 1
1 333 . 18 1 1 A 30 30 LEU H H 30 8.990 8.559 0.431 1
1 334 . 18 1 1 A 30 30 LEU HA H 30 3.964 5.138 -1.174 1
1 344 . 18 1 1 A 30 30 LEU C C 30 173.752 174.937 -1.185 1
1 345 . 18 1 1 A 30 30 LEU CA C 30 55.193 54.930 0.263 1
1 346 . 18 1 1 A 30 30 LEU CB C 30 42.869 43.053 -0.184 1
1 349 . 18 1 1 A 30 30 LEU N N 30 125.860 126.764 -0.904 1
1 350 . 18 1 1 A 31 31 LYS H H 31 8.118 8.963 -0.845 1
1 351 . 18 1 1 A 31 31 LYS HA H 31 4.498 4.890 -0.392 1
1 360 . 18 1 1 A 31 31 LYS C C 31 173.555 174.952 -1.397 1
1 361 . 18 1 1 A 31 31 LYS CA C 31 54.372 55.208 -0.836 1
1 362 . 18 1 1 A 31 31 LYS CB C 31 32.814 33.587 -0.773 1
1 365 . 18 1 1 A 31 31 LYS N N 31 129.965 127.231 2.734 1
1 366 . 18 1 1 A 32 32 ILE H H 32 8.717 8.615 0.102 1
1 367 . 18 1 1 A 32 32 ILE HA H 32 4.011 4.706 -0.695 1
1 377 . 18 1 1 A 32 32 ILE C C 32 173.038 174.903 -1.865 1
1 378 . 18 1 1 A 32 32 ILE CA C 32 59.921 58.383 1.538 1
1 379 . 18 1 1 A 32 32 ILE CB C 32 38.139 38.902 -0.763 1
1 382 . 18 1 1 A 32 32 ILE N N 32 127.091 121.565 5.526 1
1 383 . 18 1 1 A 33 33 PRO HA H 33 4.412 4.554 -0.142 1
1 390 . 18 1 1 A 33 33 PRO C C 33 172.724 175.700 -2.976 1
1 391 . 18 1 1 A 33 33 PRO CA C 33 62.565 62.206 0.359 1
1 392 . 18 1 1 A 33 33 PRO CB C 33 32.728 32.840 -0.112 1
1 394 . 18 1 1 A 34 34 ASN H H 34 8.265 8.508 -0.243 1
1 395 . 18 1 1 A 34 34 ASN HA H 34 5.147 5.450 -0.303 1
1 400 . 18 1 1 A 34 34 ASN C C 34 174.079 173.457 0.622 1
1 401 . 18 1 1 A 34 34 ASN CA C 34 52.088 51.512 0.576 1
1 402 . 18 1 1 A 34 34 ASN CB C 34 40.387 42.515 -2.128 1
1 403 . 18 1 1 A 34 34 ASN N N 34 116.424 115.015 1.409 1
1 405 . 18 1 1 A 35 35 VAL H H 35 8.904 8.942 -0.038 1
1 406 . 18 1 1 A 35 35 VAL HA H 35 4.159 4.464 -0.305 1
1 414 . 18 1 1 A 35 35 VAL C C 35 173.834 174.853 -1.019 1
1 415 . 18 1 1 A 35 35 VAL CA C 35 61.953 59.742 2.211 1
1 416 . 18 1 1 A 35 35 VAL CB C 35 34.432 34.479 -0.047 1
1 419 . 18 1 1 A 35 35 VAL N N 35 122.778 118.493 4.285 1
1 420 . 18 1 1 A 36 36 GLU H H 36 9.560 9.468 0.092 1
1 421 . 18 1 1 A 36 36 GLU HA H 36 3.819 4.036 -0.217 1
1 426 . 18 1 1 A 36 36 GLU C C 36 173.604 175.884 -2.280 1
1 427 . 18 1 1 A 36 36 GLU CA C 36 57.131 58.044 -0.913 1
1 428 . 18 1 1 A 36 36 GLU CB C 36 27.464 28.113 -0.649 1
1 430 . 18 1 1 A 36 36 GLU N N 36 127.014 128.614 -1.600 1
1 431 . 18 1 1 A 37 37 ARG H H 37 8.578 8.463 0.115 1
1 432 . 18 1 1 A 37 37 ARG HA H 37 3.792 3.903 -0.111 1
1 439 . 18 1 1 A 37 37 ARG C C 37 173.371 174.426 -1.055 1
1 440 . 18 1 1 A 37 37 ARG CA C 37 57.952 57.916 0.036 1
1 441 . 18 1 1 A 37 37 ARG CB C 37 27.657 27.634 0.023 1
1 443 . 18 1 1 A 37 37 ARG N N 37 108.362 110.739 -2.377 1
1 444 . 18 1 1 A 38 38 ARG H H 38 7.696 7.970 -0.274 1
1 445 . 18 1 1 A 38 38 ARG HA H 38 4.743 4.943 -0.200 1
1 452 . 18 1 1 A 38 38 ARG C C 38 173.513 175.594 -2.081 1
1 453 . 18 1 1 A 38 38 ARG CA C 38 54.507 54.910 -0.403 1
1 454 . 18 1 1 A 38 38 ARG CB C 38 33.751 32.987 0.764 1
1 456 . 18 1 1 A 38 38 ARG N N 38 118.370 119.852 -1.482 1
1 457 . 18 1 1 A 39 39 ILE H H 39 8.463 8.518 -0.055 1
1 458 . 18 1 1 A 39 39 ILE HA H 39 4.184 4.214 -0.030 1
1 468 . 18 1 1 A 39 39 ILE C C 39 175.150 175.753 -0.603 1
1 469 . 18 1 1 A 39 39 ILE CA C 39 62.076 61.654 0.422 1
1 470 . 18 1 1 A 39 39 ILE CB C 39 38.864 39.327 -0.463 1
1 473 . 18 1 1 A 39 39 ILE N N 39 123.604 127.069 -3.465 1
1 474 . 18 1 1 A 40 40 LEU H H 40 8.239 8.252 -0.013 1
1 475 . 18 1 1 A 40 40 LEU HA H 40 4.259 4.449 -0.190 1
1 485 . 18 1 1 A 40 40 LEU C C 40 173.152 175.408 -2.256 1
1 486 . 18 1 1 A 40 40 LEU CA C 40 55.305 54.643 0.662 1
1 487 . 18 1 1 A 40 40 LEU CB C 40 43.113 41.607 1.506 1
1 490 . 18 1 1 A 40 40 LEU N N 40 129.550 128.841 0.709 1
1 491 . 18 1 1 A 41 41 ASP H H 41 8.992 8.532 0.460 1
1 492 . 18 1 1 A 41 41 ASP HA H 41 4.798 4.794 0.004 1
1 495 . 18 1 1 A 41 41 ASP C C 41 173.837 176.223 -2.386 1
1 496 . 18 1 1 A 41 41 ASP CA C 41 52.077 53.359 -1.282 1
1 497 . 18 1 1 A 41 41 ASP CB C 41 39.454 40.581 -1.127 1
1 498 . 18 1 1 A 41 41 ASP N N 41 127.022 127.565 -0.543 1
1 499 . 18 1 1 A 42 42 LEU H H 42 7.912 8.195 -0.283 1
1 500 . 18 1 1 A 42 42 LEU HA H 42 3.970 4.164 -0.194 1
1 510 . 18 1 1 A 42 42 LEU C C 42 176.305 178.099 -1.794 1
1 511 . 18 1 1 A 42 42 LEU CA C 42 58.128 57.812 0.316 1
1 512 . 18 1 1 A 42 42 LEU CB C 42 43.043 41.889 1.154 1
1 514 . 18 1 1 A 42 42 LEU N N 42 125.064 127.609 -2.545 1
1 515 . 18 1 1 A 43 43 TYR H H 43 8.565 8.405 0.160 1
1 516 . 18 1 1 A 43 43 TYR HA H 43 3.728 3.677 0.051 1
1 523 . 18 1 1 A 43 43 TYR C C 43 175.757 177.641 -1.884 1
1 524 . 18 1 1 A 43 43 TYR CA C 43 61.774 61.792 -0.018 1
1 525 . 18 1 1 A 43 43 TYR CB C 43 38.235 38.311 -0.076 1
1 528 . 18 1 1 A 43 43 TYR N N 43 117.822 121.139 -3.317 1
1 529 . 18 1 1 A 44 44 SER H H 44 8.115 8.320 -0.205 1
1 530 . 18 1 1 A 44 44 SER HA H 44 3.854 4.228 -0.374 1
1 533 . 18 1 1 A 44 44 SER C C 44 174.080 175.971 -1.891 1
1 534 . 18 1 1 A 44 44 SER CA C 44 61.873 61.914 -0.041 1
1 535 . 18 1 1 A 44 44 SER CB C 44 64.350 62.852 1.498 1
1 536 . 18 1 1 A 44 44 SER N N 44 116.835 115.864 0.971 1
1 537 . 18 1 1 A 45 45 LEU H H 45 8.401 7.912 0.489 1
1 538 . 18 1 1 A 45 45 LEU HA H 45 4.102 4.124 -0.022 1
1 548 . 18 1 1 A 45 45 LEU C C 45 175.081 179.060 -3.979 1
1 549 . 18 1 1 A 45 45 LEU CA C 45 58.896 57.873 1.023 1
1 550 . 18 1 1 A 45 45 LEU CB C 45 41.741 41.631 0.110 1
1 553 . 18 1 1 A 45 45 LEU N N 45 120.621 123.242 -2.621 1
1 554 . 18 1 1 A 46 46 SER H H 46 8.110 8.406 -0.296 1
1 555 . 18 1 1 A 46 46 SER HA H 46 4.300 4.190 0.110 1
1 558 . 18 1 1 A 46 46 SER C C 46 175.019 176.678 -1.659 1
1 559 . 18 1 1 A 46 46 SER CA C 46 62.610 62.031 0.579 1
1 560 . 18 1 1 A 46 46 SER CB C 46 64.092 62.903 1.189 1
1 561 . 18 1 1 A 46 46 SER N N 46 112.826 116.964 -4.138 1
1 562 . 18 1 1 A 47 47 LYS H H 47 7.732 8.037 -0.305 1
1 563 . 18 1 1 A 47 47 LYS HA H 47 3.900 4.125 -0.225 1
1 572 . 18 1 1 A 47 47 LYS C C 47 177.441 178.995 -1.554 1
1 573 . 18 1 1 A 47 47 LYS CA C 47 58.575 58.994 -0.419 1
1 574 . 18 1 1 A 47 47 LYS CB C 47 32.351 32.299 0.052 1
1 576 . 18 1 1 A 47 47 LYS N N 47 121.210 119.617 1.593 1
1 577 . 18 1 1 A 48 48 ILE H H 48 8.672 7.959 0.713 1
1 578 . 18 1 1 A 48 48 ILE HA H 48 3.628 3.669 -0.041 1
1 588 . 18 1 1 A 48 48 ILE C C 48 175.861 177.887 -2.026 1
1 589 . 18 1 1 A 48 48 ILE CA C 48 64.188 65.067 -0.879 1
1 590 . 18 1 1 A 48 48 ILE CB C 48 37.954 37.940 0.014 1
1 593 . 18 1 1 A 48 48 ILE N N 48 120.810 121.206 -0.396 1
1 594 . 18 1 1 A 49 49 VAL H H 49 8.030 8.210 -0.180 1
1 595 . 18 1 1 A 49 49 VAL HA H 49 3.195 3.670 -0.475 1
1 603 . 18 1 1 A 49 49 VAL C C 49 176.513 178.384 -1.871 1
1 604 . 18 1 1 A 49 49 VAL CA C 49 66.760 67.065 -0.305 1
1 605 . 18 1 1 A 49 49 VAL CB C 49 30.935 31.644 -0.709 1
1 608 . 18 1 1 A 49 49 VAL N N 49 119.350 119.620 -0.270 1
1 609 . 18 1 1 A 50 50 VAL H H 50 7.336 8.352 -1.016 1
1 610 . 18 1 1 A 50 50 VAL HA H 50 3.497 3.581 -0.084 1
1 618 . 18 1 1 A 50 50 VAL C C 50 178.745 178.341 0.404 1
1 619 . 18 1 1 A 50 50 VAL CA C 50 67.384 66.686 0.698 1
1 620 . 18 1 1 A 50 50 VAL CB C 50 31.832 31.538 0.294 1
1 621 . 18 1 1 A 50 50 VAL N N 50 118.610 120.609 -1.999 1
1 622 . 18 1 1 A 51 51 GLU H H 51 8.318 8.212 0.106 1
1 623 . 18 1 1 A 51 51 GLU HA H 51 3.953 3.995 -0.042 1
1 628 . 18 1 1 A 51 51 GLU C C 51 177.281 179.347 -2.066 1
1 629 . 18 1 1 A 51 51 GLU CA C 51 59.668 59.313 0.355 1
1 630 . 18 1 1 A 51 51 GLU CB C 51 30.131 29.226 0.905 1
1 632 . 18 1 1 A 51 51 GLU N N 51 122.096 120.111 1.985 1
1 633 . 18 1 1 A 52 52 GLU H H 52 8.065 8.106 -0.041 1
1 634 . 18 1 1 A 52 52 GLU HA H 52 4.229 4.199 0.030 1
1 639 . 18 1 1 A 52 52 GLU C C 52 173.534 176.747 -3.213 1
1 640 . 18 1 1 A 52 52 GLU CA C 52 55.547 56.607 -1.060 1
1 641 . 18 1 1 A 52 52 GLU CB C 52 28.716 29.780 -1.064 1
1 643 . 18 1 1 A 52 52 GLU N N 52 114.992 116.063 -1.071 1
1 644 . 18 1 1 A 53 53 GLY H H 53 7.459 9.239 -1.780 1
1 645 . 18 1 1 A 53 53 GLY HA2 H 53 3.630 3.945 -0.315 1
1 646 . 18 1 1 A 53 53 GLY HA3 H 53 3.630 3.962 -0.332 1
1 647 . 18 1 1 A 53 53 GLY C C 53 173.214 173.679 -0.465 1
1 648 . 18 1 1 A 53 53 GLY CA C 53 44.962 45.211 -0.249 1
1 649 . 18 1 1 A 53 53 GLY N N 53 104.909 108.446 -3.537 1
1 650 . 18 1 1 A 54 54 GLY H H 54 8.533 7.761 0.772 1
1 651 . 18 1 1 A 54 54 GLY HA2 H 54 3.548 4.075 -0.527 1
1 652 . 18 1 1 A 54 54 GLY HA3 H 54 4.521 4.123 0.398 1
1 653 . 18 1 1 A 54 54 GLY C C 54 169.966 174.714 -4.748 1
1 654 . 18 1 1 A 54 54 GLY CA C 54 43.988 45.765 -1.777 1
1 655 . 18 1 1 A 54 54 GLY N N 54 110.587 108.518 2.069 1
1 656 . 18 1 1 A 55 55 TYR H H 55 8.704 9.094 -0.390 1
1 657 . 18 1 1 A 55 55 TYR HA H 55 3.618 3.931 -0.313 1
1 664 . 18 1 1 A 55 55 TYR C C 55 174.807 177.255 -2.448 1
1 665 . 18 1 1 A 55 55 TYR CA C 55 62.540 61.569 0.971 1
1 666 . 18 1 1 A 55 55 TYR CB C 55 39.669 39.324 0.345 1
1 669 . 18 1 1 A 55 55 TYR N N 55 119.168 123.571 -4.403 1
1 670 . 18 1 1 A 56 56 GLU H H 56 9.006 8.191 0.815 1
1 671 . 18 1 1 A 56 56 GLU HA H 56 3.638 3.492 0.146 1
1 676 . 18 1 1 A 56 56 GLU C C 56 177.400 178.389 -0.989 1
1 677 . 18 1 1 A 56 56 GLU CA C 56 60.530 59.378 1.152 1
1 678 . 18 1 1 A 56 56 GLU CB C 56 29.168 29.386 -0.218 1
1 679 . 18 1 1 A 56 56 GLU N N 56 118.969 119.169 -0.200 1
1 680 . 18 1 1 A 57 57 ALA H H 57 8.235 7.684 0.551 1
1 681 . 18 1 1 A 57 57 ALA HA H 57 3.980 3.953 0.027 1
1 685 . 18 1 1 A 57 57 ALA C C 57 177.678 180.029 -2.351 1
1 686 . 18 1 1 A 57 57 ALA CA C 57 54.910 55.096 -0.186 1
1 687 . 18 1 1 A 57 57 ALA CB C 57 18.122 18.054 0.068 1
1 688 . 18 1 1 A 57 57 ALA N N 57 122.860 121.387 1.473 1
1 689 . 18 1 1 A 58 58 ILE H H 58 7.831 7.434 0.397 1
1 690 . 18 1 1 A 58 58 ILE HA H 58 3.189 3.231 -0.042 1
1 700 . 18 1 1 A 58 58 ILE C C 58 177.818 176.866 0.952 1
1 701 . 18 1 1 A 58 58 ILE CA C 58 65.074 65.148 -0.074 1
1 702 . 18 1 1 A 58 58 ILE CB C 58 38.178 37.269 0.909 1
1 706 . 18 1 1 A 58 58 ILE N N 58 117.418 119.313 -1.895 1
1 707 . 18 1 1 A 59 59 CYS H H 59 7.760 8.095 -0.335 1
1 708 . 18 1 1 A 59 59 CYS HA H 59 4.203 4.143 0.060 1
1 711 . 18 1 1 A 59 59 CYS C C 59 176.357 176.777 -0.420 1
1 712 . 18 1 1 A 59 59 CYS CA C 59 63.760 62.804 0.956 1
1 713 . 18 1 1 A 59 59 CYS CB C 59 27.638 26.596 1.042 1
1 714 . 18 1 1 A 59 59 CYS N N 59 115.302 121.009 -5.707 1
1 715 . 18 1 1 A 60 60 LYS H H 60 8.350 7.900 0.450 1
1 716 . 18 1 1 A 60 60 LYS HA H 60 3.972 3.954 0.018 1
1 725 . 18 1 1 A 60 60 LYS C C 60 176.373 179.042 -2.669 1
1 726 . 18 1 1 A 60 60 LYS CA C 60 59.796 59.573 0.223 1
1 727 . 18 1 1 A 60 60 LYS CB C 60 32.560 32.317 0.243 1
1 729 . 18 1 1 A 60 60 LYS N N 60 122.343 119.731 2.612 1
1 730 . 18 1 1 A 61 61 ASP H H 61 8.157 7.981 0.176 1
1 731 . 18 1 1 A 61 61 ASP HA H 61 4.616 4.594 0.022 1
1 734 . 18 1 1 A 61 61 ASP C C 61 173.246 175.098 -1.852 1
1 735 . 18 1 1 A 61 61 ASP CA C 61 54.272 53.731 0.541 1
1 736 . 18 1 1 A 61 61 ASP CB C 61 41.023 40.848 0.175 1
1 737 . 18 1 1 A 61 61 ASP N N 61 116.173 117.173 -1.000 1
1 738 . 18 1 1 A 62 62 ARG H H 62 7.655 7.778 -0.123 1
1 739 . 18 1 1 A 62 62 ARG HA H 62 4.149 3.988 0.161 1
1 746 . 18 1 1 A 62 62 ARG C C 62 175.891 175.984 -0.093 1
1 747 . 18 1 1 A 62 62 ARG CA C 62 57.381 57.033 0.348 1
1 748 . 18 1 1 A 62 62 ARG CB C 62 26.538 27.201 -0.663 1
1 750 . 18 1 1 A 62 62 ARG N N 62 117.213 115.178 2.035 1
1 751 . 18 1 1 A 63 63 ARG H H 63 8.302 7.630 0.672 1
1 752 . 18 1 1 A 63 63 ARG HA H 63 4.240 4.075 0.165 1
1 757 . 18 1 1 A 63 63 ARG C C 63 175.775 178.382 -2.607 1
1 758 . 18 1 1 A 63 63 ARG CA C 63 55.718 57.488 -1.770 1
1 760 . 18 1 1 A 63 63 ARG N N 63 116.292 117.110 -0.818 1
1 761 . 18 1 1 A 64 64 TRP H H 64 8.161 7.475 0.686 1
1 762 . 18 1 1 A 64 64 TRP HA H 64 3.836 4.451 -0.615 1
1 771 . 18 1 1 A 64 64 TRP C C 64 176.862 178.590 -1.728 1
1 772 . 18 1 1 A 64 64 TRP CA C 64 62.036 59.832 2.204 1
1 773 . 18 1 1 A 64 64 TRP CB C 64 27.028 29.192 -2.164 1
1 779 . 18 1 1 A 64 64 TRP N N 64 121.486 119.963 1.523 1
1 781 . 18 1 1 A 65 65 ALA H H 65 8.954 8.030 0.924 1
1 782 . 18 1 1 A 65 65 ALA HA H 65 4.290 4.078 0.212 1
1 786 . 18 1 1 A 65 65 ALA C C 65 178.986 179.402 -0.416 1
1 787 . 18 1 1 A 65 65 ALA CA C 65 55.314 55.460 -0.146 1
1 788 . 18 1 1 A 65 65 ALA CB C 65 18.119 18.108 0.011 1
1 789 . 18 1 1 A 65 65 ALA N N 65 121.559 122.519 -0.960 1
1 790 . 18 1 1 A 66 66 ARG H H 66 7.473 7.763 -0.290 1
1 791 . 18 1 1 A 66 66 ARG HA H 66 4.221 4.142 0.079 1
1 798 . 18 1 1 A 66 66 ARG C C 66 176.670 178.491 -1.821 1
1 799 . 18 1 1 A 66 66 ARG CA C 66 57.871 58.816 -0.945 1
1 800 . 18 1 1 A 66 66 ARG CB C 66 29.097 29.757 -0.660 1
1 801 . 18 1 1 A 66 66 ARG N N 66 119.915 117.028 2.887 1
1 802 . 18 1 1 A 67 67 VAL H H 67 7.134 7.808 -0.674 1
1 803 . 18 1 1 A 67 67 VAL HA H 67 3.304 3.627 -0.323 1
1 811 . 18 1 1 A 67 67 VAL C C 67 175.341 177.796 -2.455 1
1 812 . 18 1 1 A 67 67 VAL CA C 67 66.722 66.663 0.059 1
1 813 . 18 1 1 A 67 67 VAL CB C 67 31.108 31.917 -0.809 1
1 816 . 18 1 1 A 67 67 VAL N N 67 119.970 120.844 -0.874 1
1 817 . 18 1 1 A 68 68 ALA H H 68 7.745 8.598 -0.853 1
1 818 . 18 1 1 A 68 68 ALA HA H 68 4.076 4.062 0.014 1
1 822 . 18 1 1 A 68 68 ALA C C 68 177.358 179.113 -1.755 1
1 823 . 18 1 1 A 68 68 ALA CA C 68 55.607 55.972 -0.365 1
1 824 . 18 1 1 A 68 68 ALA CB C 68 18.061 18.754 -0.693 1
1 825 . 18 1 1 A 68 68 ALA N N 68 118.239 121.543 -3.304 1
1 826 . 18 1 1 A 69 69 GLN H H 69 7.979 8.167 -0.188 1
1 827 . 18 1 1 A 69 69 GLN HA H 69 4.310 3.933 0.377 1
1 834 . 18 1 1 A 69 69 GLN C C 69 179.370 177.985 1.385 1
1 835 . 18 1 1 A 69 69 GLN CA C 69 59.307 59.231 0.076 1
1 836 . 18 1 1 A 69 69 GLN CB C 69 29.257 28.230 1.027 1
1 838 . 18 1 1 A 69 69 GLN N N 69 118.484 117.807 0.677 1
1 840 . 18 1 1 A 70 70 ARG H H 70 8.374 8.153 0.221 1
1 841 . 18 1 1 A 70 70 ARG HA H 70 4.148 4.044 0.104 1
1 848 . 18 1 1 A 70 70 ARG C C 70 175.850 178.015 -2.165 1
1 849 . 18 1 1 A 70 70 ARG CA C 70 58.957 58.818 0.139 1
1 850 . 18 1 1 A 70 70 ARG CB C 70 29.799 30.142 -0.343 1
1 852 . 18 1 1 A 70 70 ARG N N 70 120.309 120.536 -0.227 1
1 853 . 18 1 1 A 71 71 LEU H H 71 7.413 7.570 -0.157 1
1 854 . 18 1 1 A 71 71 LEU HA H 71 4.341 4.090 0.251 1
1 864 . 18 1 1 A 71 71 LEU C C 71 173.391 175.552 -2.161 1
1 865 . 18 1 1 A 71 71 LEU CA C 71 54.911 54.660 0.251 1
1 866 . 18 1 1 A 71 71 LEU CB C 71 42.693 41.431 1.262 1
1 867 . 18 1 1 A 71 71 LEU N N 71 118.841 117.478 1.363 1
1 868 . 18 1 1 A 72 72 ASN H H 72 8.038 7.957 0.081 1
1 869 . 18 1 1 A 72 72 ASN HA H 72 4.394 4.409 -0.015 1
1 874 . 18 1 1 A 72 72 ASN C C 72 173.042 173.977 -0.935 1
1 875 . 18 1 1 A 72 72 ASN CB C 72 36.412 36.918 -0.506 1
1 876 . 18 1 1 A 72 72 ASN N N 72 112.919 114.503 -1.584 1
1 878 . 18 1 1 A 73 73 TYR H H 73 7.874 7.983 -0.109 1
1 879 . 18 1 1 A 73 73 TYR HA H 73 4.868 4.639 0.229 1
1 886 . 18 1 1 A 73 73 TYR C C 73 172.194 173.870 -1.676 1
1 887 . 18 1 1 A 73 73 TYR CA C 73 57.105 56.274 0.831 1
1 888 . 18 1 1 A 73 73 TYR CB C 73 37.918 38.659 -0.741 1
1 889 . 18 1 1 A 73 73 TYR N N 73 117.432 119.120 -1.688 1
1 897 . 18 1 1 A 75 75 PRO HA H 75 4.626 4.468 0.158 1
1 902 . 18 1 1 A 75 75 PRO C C 75 175.728 177.045 -1.317 1
1 903 . 18 1 1 A 75 75 PRO CA C 75 62.502 63.194 -0.692 1
1 904 . 18 1 1 A 75 75 PRO CB C 75 32.339 32.338 0.001 1
1 905 . 18 1 1 A 76 76 GLY H H 76 8.369 8.863 -0.494 1
1 906 . 18 1 1 A 76 76 GLY HA2 H 76 4.057 3.956 0.101 1
1 907 . 18 1 1 A 76 76 GLY HA3 H 76 4.556 3.956 0.600 1
1 908 . 18 1 1 A 76 76 GLY C C 76 173.248 174.609 -1.361 1
1 909 . 18 1 1 A 76 76 GLY CA C 76 46.180 45.682 0.498 1
1 910 . 18 1 1 A 76 76 GLY N N 76 106.185 110.596 -4.411 1
1 911 . 18 1 1 A 77 77 LYS H H 77 8.632 8.342 0.290 1
1 912 . 18 1 1 A 77 77 LYS HA H 77 4.433 4.021 0.412 1
1 921 . 18 1 1 A 77 77 LYS C C 77 174.924 176.217 -1.293 1
1 922 . 18 1 1 A 77 77 LYS CA C 77 56.453 57.785 -1.332 1
1 923 . 18 1 1 A 77 77 LYS CB C 77 33.170 29.508 3.662 1
1 925 . 18 1 1 A 77 77 LYS N N 77 119.592 112.549 7.043 1
1 926 . 18 1 1 A 78 78 ASN H H 78 8.865 7.982 0.883 1
1 927 . 18 1 1 A 78 78 ASN HA H 78 4.654 4.538 0.116 1
1 932 . 18 1 1 A 78 78 ASN C C 78 174.869 177.329 -2.460 1
1 933 . 18 1 1 A 78 78 ASN CA C 78 54.117 56.109 -1.992 1
1 934 . 18 1 1 A 78 78 ASN CB C 78 37.841 38.499 -0.658 1
1 935 . 18 1 1 A 78 78 ASN N N 78 116.880 117.364 -0.484 1
1 937 . 18 1 1 A 79 79 ILE H H 79 8.008 8.137 -0.129 1
1 938 . 18 1 1 A 79 79 ILE HA H 79 3.718 3.923 -0.205 1
1 948 . 18 1 1 A 79 79 ILE C C 79 175.921 178.500 -2.579 1
1 949 . 18 1 1 A 79 79 ILE CA C 79 63.618 64.666 -1.048 1
1 950 . 18 1 1 A 79 79 ILE CB C 79 37.158 37.879 -0.721 1
1 952 . 18 1 1 A 79 79 ILE N N 79 119.688 119.536 0.152 1
1 953 . 18 1 1 A 80 80 GLY H H 80 9.062 8.275 0.787 1
1 954 . 18 1 1 A 80 80 GLY HA2 H 80 3.739 3.887 -0.148 1
1 955 . 18 1 1 A 80 80 GLY HA3 H 80 3.739 3.924 -0.185 1
1 956 . 18 1 1 A 80 80 GLY C C 80 173.185 176.519 -3.334 1
1 957 . 18 1 1 A 80 80 GLY CA C 80 48.166 47.724 0.442 1
1 958 . 18 1 1 A 80 80 GLY N N 80 110.338 109.354 0.984 1
1 959 . 18 1 1 A 81 81 SER H H 81 7.460 8.094 -0.634 1
1 960 . 18 1 1 A 81 81 SER HA H 81 3.904 4.090 -0.186 1
1 963 . 18 1 1 A 81 81 SER C C 81 174.999 175.908 -0.909 1
1 964 . 18 1 1 A 81 81 SER CA C 81 61.138 62.629 -1.491 1
1 965 . 18 1 1 A 81 81 SER CB C 81 62.740 62.978 -0.238 1
1 966 . 18 1 1 A 81 81 SER N N 81 115.348 119.561 -4.213 1
1 967 . 18 1 1 A 82 82 LEU H H 82 7.367 7.984 -0.617 1
1 968 . 18 1 1 A 82 82 LEU HA H 82 3.946 4.023 -0.077 1
1 977 . 18 1 1 A 82 82 LEU C C 82 176.969 178.168 -1.199 1
1 978 . 18 1 1 A 82 82 LEU CA C 82 57.504 58.144 -0.640 1
1 979 . 18 1 1 A 82 82 LEU CB C 82 42.185 41.383 0.802 1
1 980 . 18 1 1 A 82 82 LEU N N 82 124.267 122.610 1.657 1
1 981 . 18 1 1 A 83 83 LEU H H 83 8.330 8.258 0.072 1
1 982 . 18 1 1 A 83 83 LEU HA H 83 3.924 3.937 -0.013 1
1 991 . 18 1 1 A 83 83 LEU C C 83 176.303 178.287 -1.984 1
1 992 . 18 1 1 A 83 83 LEU CA C 83 58.067 58.377 -0.310 1
1 993 . 18 1 1 A 83 83 LEU CB C 83 41.061 41.655 -0.594 1
1 994 . 18 1 1 A 83 83 LEU N N 83 117.452 119.916 -2.464 1
1 995 . 18 1 1 A 84 84 ARG H H 84 7.651 8.019 -0.368 1
1 996 . 18 1 1 A 84 84 ARG HA H 84 2.230 3.422 -1.192 1
1 1003 . 18 1 1 A 84 84 ARG C C 84 175.902 178.348 -2.446 1
1 1004 . 18 1 1 A 84 84 ARG CA C 84 59.112 59.352 -0.240 1
1 1005 . 18 1 1 A 84 84 ARG CB C 84 28.579 29.587 -1.008 1
1 1007 . 18 1 1 A 84 84 ARG N N 84 119.586 119.506 0.080 1
1 1008 . 18 1 1 A 85 85 SER H H 85 7.291 8.104 -0.813 1
1 1009 . 18 1 1 A 85 85 SER HA H 85 4.189 4.088 0.101 1
1 1012 . 18 1 1 A 85 85 SER C C 85 175.546 176.481 -0.935 1
1 1013 . 18 1 1 A 85 85 SER CA C 85 61.376 62.039 -0.663 1
1 1014 . 18 1 1 A 85 85 SER CB C 85 62.805 62.795 0.010 1
1 1015 . 18 1 1 A 85 85 SER N N 85 112.921 117.062 -4.141 1
1 1016 . 18 1 1 A 86 86 HIS H H 86 8.156 7.688 0.468 1
1 1017 . 18 1 1 A 86 86 HIS HA H 86 4.782 4.125 0.657 1
1 1022 . 18 1 1 A 86 86 HIS C C 86 176.851 177.349 -0.498 1
1 1023 . 18 1 1 A 86 86 HIS CA C 86 58.898 59.289 -0.391 1
1 1024 . 18 1 1 A 86 86 HIS CB C 86 31.110 29.600 1.510 1
1 1027 . 18 1 1 A 86 86 HIS N N 86 119.258 119.151 0.107 1
1 1028 . 18 1 1 A 87 87 TYR H H 87 9.180 8.099 1.081 1
1 1029 . 18 1 1 A 87 87 TYR HA H 87 3.913 3.853 0.060 1
1 1036 . 18 1 1 A 87 87 TYR C C 87 176.841 177.328 -0.487 1
1 1037 . 18 1 1 A 87 87 TYR CA C 87 63.526 61.371 2.155 1
1 1038 . 18 1 1 A 87 87 TYR CB C 87 39.431 38.311 1.120 1
1 1041 . 18 1 1 A 87 87 TYR N N 87 120.625 120.048 0.577 1
1 1042 . 18 1 1 A 88 88 GLU H H 88 9.028 8.293 0.735 1
1 1043 . 18 1 1 A 88 88 GLU HA H 88 3.682 4.141 -0.459 1
1 1048 . 18 1 1 A 88 88 GLU C C 88 175.833 178.968 -3.135 1
1 1049 . 18 1 1 A 88 88 GLU CA C 88 59.730 60.132 -0.402 1
1 1050 . 18 1 1 A 88 88 GLU CB C 88 30.009 29.119 0.890 1
1 1052 . 18 1 1 A 88 88 GLU N N 88 119.531 119.423 0.108 1
1 1053 . 18 1 1 A 89 89 ARG H H 89 8.052 7.806 0.246 1
1 1054 . 18 1 1 A 89 89 ARG HA H 89 4.292 4.165 0.127 1
1 1061 . 18 1 1 A 89 89 ARG C C 89 176.045 178.449 -2.404 1
1 1062 . 18 1 1 A 89 89 ARG CA C 89 58.538 58.662 -0.124 1
1 1063 . 18 1 1 A 89 89 ARG CB C 89 31.841 30.505 1.336 1
1 1065 . 18 1 1 A 89 89 ARG N N 89 114.741 119.743 -5.002 1
1 1066 . 18 1 1 A 90 90 ILE H H 90 8.141 7.965 0.176 1
1 1067 . 18 1 1 A 90 90 ILE HA H 90 4.296 2.987 1.309 1
1 1075 . 18 1 1 A 90 90 ILE C C 90 174.461 176.940 -2.479 1
1 1076 . 18 1 1 A 90 90 ILE CA C 90 63.649 63.846 -0.197 1
1 1077 . 18 1 1 A 90 90 ILE CB C 90 40.626 38.324 2.302 1
1 1079 . 18 1 1 A 90 90 ILE N N 90 113.421 119.369 -5.948 1
1 1080 . 18 1 1 A 91 91 VAL H H 91 7.350 7.405 -0.055 1
1 1081 . 18 1 1 A 91 91 VAL HA H 91 4.144 3.598 0.546 1
1 1089 . 18 1 1 A 91 91 VAL C C 91 175.422 176.959 -1.537 1
1 1090 . 18 1 1 A 91 91 VAL CA C 91 65.042 64.667 0.375 1
1 1091 . 18 1 1 A 91 91 VAL CB C 91 33.215 31.163 2.052 1
1 1092 . 18 1 1 A 91 91 VAL N N 91 118.215 120.636 -2.421 1
1 1093 . 18 1 1 A 92 92 TYR H H 92 8.565 8.084 0.481 1
1 1094 . 18 1 1 A 92 92 TYR HA H 92 4.217 3.858 0.359 1
1 1099 . 18 1 1 A 92 92 TYR C C 92 171.495 175.215 -3.720 1
1 1100 . 18 1 1 A 92 92 TYR CA C 92 61.558 62.154 -0.596 1
1 1101 . 18 1 1 A 92 92 TYR CB C 92 36.757 37.566 -0.809 1
1 1102 . 18 1 1 A 92 92 TYR N N 92 121.370 121.454 -0.084 1
1 1103 . 18 1 1 A 93 93 PRO HA H 93 4.136 4.383 -0.247 1
1 1108 . 18 1 1 A 93 93 PRO C C 93 177.077 178.217 -1.140 1
1 1109 . 18 1 1 A 93 93 PRO CA C 93 66.037 66.055 -0.018 1
1 1110 . 18 1 1 A 93 93 PRO CB C 93 31.482 30.905 0.577 1
1 1111 . 18 1 1 A 94 94 TYR H H 94 6.517 7.517 -1.000 1
1 1112 . 18 1 1 A 94 94 TYR HA H 94 2.798 4.366 -1.568 1
1 1119 . 18 1 1 A 94 94 TYR C C 94 174.985 178.158 -3.173 1
1 1120 . 18 1 1 A 94 94 TYR CA C 94 59.356 59.922 -0.566 1
1 1121 . 18 1 1 A 94 94 TYR CB C 94 37.987 37.411 0.576 1
1 1124 . 18 1 1 A 94 94 TYR N N 94 115.987 117.447 -1.460 1
1 1125 . 18 1 1 A 95 95 GLU H H 95 8.205 8.385 -0.180 1
1 1126 . 18 1 1 A 95 95 GLU HA H 95 3.682 4.139 -0.457 1
1 1131 . 18 1 1 A 95 95 GLU C C 95 178.530 179.127 -0.597 1
1 1132 . 18 1 1 A 95 95 GLU CA C 95 58.910 59.698 -0.788 1
1 1133 . 18 1 1 A 95 95 GLU CB C 95 29.187 29.284 -0.097 1
1 1134 . 18 1 1 A 95 95 GLU N N 95 119.946 121.554 -1.608 1
1 1135 . 18 1 1 A 96 96 MET H H 96 8.248 8.040 0.208 1
1 1136 . 18 1 1 A 96 96 MET HA H 96 4.172 4.195 -0.023 1
1 1142 . 18 1 1 A 96 96 MET C C 96 176.874 178.185 -1.311 1
1 1143 . 18 1 1 A 96 96 MET CA C 96 57.159 59.029 -1.870 1
1 1144 . 18 1 1 A 96 96 MET CB C 96 31.829 32.987 -1.158 1
1 1146 . 18 1 1 A 96 96 MET N N 96 117.570 119.008 -1.438 1
1 1147 . 18 1 1 A 97 97 TYR H H 97 7.445 8.381 -0.936 1
1 1148 . 18 1 1 A 97 97 TYR HA H 97 4.248 3.919 0.329 1
1 1155 . 18 1 1 A 97 97 TYR C C 97 176.476 177.102 -0.626 1
1 1156 . 18 1 1 A 97 97 TYR CA C 97 60.470 61.933 -1.463 1
1 1157 . 18 1 1 A 97 97 TYR CB C 97 38.612 38.212 0.400 1
1 1160 . 18 1 1 A 97 97 TYR N N 97 122.246 121.507 0.739 1
1 1161 . 18 1 1 A 98 98 GLN H H 98 8.087 8.597 -0.510 1
1 1162 . 18 1 1 A 98 98 GLN HA H 98 3.793 3.546 0.247 1
1 1169 . 18 1 1 A 98 98 GLN C C 98 175.549 178.438 -2.889 1
1 1170 . 18 1 1 A 98 98 GLN CA C 98 57.365 58.819 -1.454 1
1 1171 . 18 1 1 A 98 98 GLN CB C 98 28.901 28.633 0.268 1
1 1173 . 18 1 1 A 98 98 GLN N N 98 118.769 119.521 -0.752 1
1 1175 . 18 1 1 A 99 99 SER H H 99 7.724 8.096 -0.372 1
1 1176 . 18 1 1 A 99 99 SER HA H 99 4.293 4.254 0.039 1
1 1179 . 18 1 1 A 99 99 SER C C 99 173.696 177.316 -3.620 1
1 1180 . 18 1 1 A 99 99 SER CA C 99 59.566 62.577 -3.011 1
1 1181 . 18 1 1 A 99 99 SER CB C 99 63.847 62.625 1.222 1
1 1182 . 18 1 1 A 99 99 SER N N 99 113.257 117.219 -3.962 1
1 1183 . 18 1 1 A 100 100 GLY H H 100 7.751 8.403 -0.652 1
1 1184 . 18 1 1 A 100 100 GLY HA2 H 100 3.813 3.881 -0.068 1
1 1185 . 18 1 1 A 100 100 GLY HA3 H 100 3.934 3.897 0.037 1
1 1186 . 18 1 1 A 100 100 GLY C C 100 172.643 175.370 -2.727 1
1 1187 . 18 1 1 A 100 100 GLY CA C 100 45.570 46.836 -1.266 1
1 1188 . 18 1 1 A 100 100 GLY N N 100 109.750 108.118 1.632 1
1 1189 . 18 1 1 A 101 101 ALA H H 101 7.824 7.860 -0.036 1
1 1190 . 18 1 1 A 101 101 ALA HA H 101 4.221 4.114 0.107 1
1 1194 . 18 1 1 A 101 101 ALA C C 101 175.639 178.515 -2.876 1
1 1195 . 18 1 1 A 101 101 ALA CA C 101 52.745 54.052 -1.307 1
1 1196 . 18 1 1 A 101 101 ALA CB C 101 19.437 18.752 0.685 1
1 1197 . 18 1 1 A 101 101 ALA N N 101 123.241 122.816 0.425 1
1 1198 . 18 1 1 A 102 102 ASN H H 102 8.191 8.068 0.123 1
1 1199 . 18 1 1 A 102 102 ASN HA H 102 4.658 4.765 -0.107 1
1 1204 . 18 1 1 A 102 102 ASN C C 102 173.337 175.549 -2.212 1
1 1205 . 18 1 1 A 102 102 ASN CA C 102 53.374 54.933 -1.559 1
1 1206 . 18 1 1 A 102 102 ASN CB C 102 38.819 39.589 -0.770 1
1 1207 . 18 1 1 A 102 102 ASN N N 102 116.572 114.018 2.554 1
1 1209 . 18 1 1 A 103 103 LEU H H 103 8.065 7.731 0.334 1
1 1210 . 18 1 1 A 103 103 LEU HA H 103 4.363 4.647 -0.284 1
1 1219 . 18 1 1 A 103 103 LEU C C 103 175.637 174.813 0.824 1
1 1220 . 18 1 1 A 103 103 LEU CA C 103 55.292 54.020 1.272 1
1 1221 . 18 1 1 A 103 103 LEU CB C 103 42.433 44.370 -1.937 1
1 1222 . 18 1 1 A 103 103 LEU N N 103 122.074 114.387 7.687 1
1 1223 . 18 1 1 A 104 104 VAL H H 104 8.055 8.654 -0.599 1
1 1224 . 18 1 1 A 104 104 VAL HA H 104 4.131 4.860 -0.729 1
1 1232 . 18 1 1 A 104 104 VAL C C 104 174.364 174.502 -0.138 1
1 1233 . 18 1 1 A 104 104 VAL CA C 104 62.552 59.977 2.575 1
1 1234 . 18 1 1 A 104 104 VAL CB C 104 32.766 35.722 -2.956 1
1 1235 . 18 1 1 A 104 104 VAL N N 104 120.606 117.944 2.662 1
1 1236 . 18 1 1 A 105 105 CYS H H 105 8.392 8.990 -0.598 1
1 1237 . 18 1 1 A 105 105 CYS HA H 105 4.535 4.820 -0.285 1
1 1240 . 18 1 1 A 105 105 CYS C C 105 172.593 175.447 -2.854 1
1 1241 . 18 1 1 A 105 105 CYS CA C 105 58.449 59.167 -0.718 1
1 1242 . 18 1 1 A 105 105 CYS CB C 105 27.952 29.916 -1.964 1
1 1243 . 18 1 1 A 105 105 CYS N N 105 122.791 126.734 -3.943 1
1 1244 . 18 1 1 A 106 106 ASN H H 106 8.575 8.228 0.347 1
1 1245 . 18 1 1 A 106 106 ASN HA H 106 4.843 4.767 0.076 1
1 1250 . 18 1 1 A 106 106 ASN C C 106 173.594 176.361 -2.767 1
1 1251 . 18 1 1 A 106 106 ASN CA C 106 53.337 52.572 0.765 1
1 1252 . 18 1 1 A 106 106 ASN CB C 106 39.088 37.780 1.308 1
1 1253 . 18 1 1 A 106 106 ASN N N 106 122.001 117.403 4.598 1
1 1255 . 18 1 1 A 107 107 THR H H 107 8.090 7.843 0.247 1
1 1256 . 18 1 1 A 107 107 THR HA H 107 4.348 3.977 0.371 1
1 1261 . 18 1 1 A 107 107 THR C C 107 172.516 176.220 -3.704 1
1 1262 . 18 1 1 A 107 107 THR CA C 107 61.803 67.068 -5.265 1
1 1263 . 18 1 1 A 107 107 THR CB C 107 69.812 68.634 1.178 1
1 1265 . 18 1 1 A 107 107 THR N N 107 114.374 116.304 -1.930 1
1 1266 . 18 1 1 A 108 108 ARG H H 108 8.322 7.844 0.478 1
1 1267 . 18 1 1 A 108 108 ARG HA H 108 4.634 4.265 0.369 1
1 1274 . 18 1 1 A 108 108 ARG C C 108 172.608 176.576 -3.968 1
1 1275 . 18 1 1 A 108 108 ARG CA C 108 54.026 60.598 -6.572 1
1 1276 . 18 1 1 A 108 108 ARG CB C 108 30.246 30.466 -0.220 1
1 1278 . 18 1 1 A 108 108 ARG N N 108 124.017 120.119 3.898 1
1 1279 . 18 1 1 A 109 109 PRO HA H 109 4.354 4.460 -0.106 1
1 1286 . 18 1 1 A 109 109 PRO C C 109 174.978 178.686 -3.708 1
1 1287 . 18 1 1 A 109 109 PRO CA C 109 63.396 65.103 -1.707 1
1 1288 . 18 1 1 A 109 109 PRO CB C 109 32.046 31.636 0.410 1
1 1290 . 18 1 1 A 110 110 PHE H H 110 8.123 7.602 0.521 1
1 1291 . 18 1 1 A 110 110 PHE HA H 110 4.619 4.433 0.186 1
1 1296 . 18 1 1 A 110 110 PHE C C 110 173.856 177.299 -3.443 1
1 1297 . 18 1 1 A 110 110 PHE CA C 110 57.353 62.161 -4.808 1
1 1298 . 18 1 1 A 110 110 PHE CB C 110 39.364 39.309 0.055 1
1 1301 . 18 1 1 A 110 110 PHE N N 110 119.265 119.391 -0.126 1
1 1302 . 18 1 1 A 111 111 ASP H H 111 8.161 8.249 -0.088 1
1 1303 . 18 1 1 A 111 111 ASP HA H 111 4.613 4.494 0.119 1
1 1306 . 18 1 1 A 111 111 ASP C C 111 174.114 178.296 -4.182 1
1 1307 . 18 1 1 A 111 111 ASP CA C 111 54.350 57.935 -3.585 1
1 1308 . 18 1 1 A 111 111 ASP CB C 111 41.413 42.169 -0.756 1
1 1309 . 18 1 1 A 111 111 ASP N N 111 121.764 119.483 2.281 1
1 1310 . 18 1 1 A 112 112 ASN H H 112 8.307 8.440 -0.133 1
1 1311 . 18 1 1 A 112 112 ASN HA H 112 4.662 4.550 0.112 1
1 1316 . 18 1 1 A 112 112 ASN C C 112 173.595 177.435 -3.840 1
1 1317 . 18 1 1 A 112 112 ASN CA C 112 53.486 55.885 -2.399 1
1 1318 . 18 1 1 A 112 112 ASN CB C 112 39.225 37.780 1.445 1
1 1319 . 18 1 1 A 112 112 ASN N N 112 119.154 116.351 2.803 1
1 1321 . 18 1 1 A 113 113 GLU H H 113 8.404 8.257 0.147 1
1 1322 . 18 1 1 A 113 113 GLU HA H 113 4.264 4.090 0.174 1
1 1327 . 18 1 1 A 113 113 GLU C C 113 174.886 179.071 -4.185 1
1 1328 . 18 1 1 A 113 113 GLU CA C 113 56.681 59.291 -2.610 1
1 1329 . 18 1 1 A 113 113 GLU CB C 113 30.403 29.175 1.228 1
1 1331 . 18 1 1 A 113 113 GLU N N 113 120.943 118.641 2.302 1
1 1332 . 18 1 1 A 114 114 GLU H H 114 8.388 8.328 0.060 1
1 1333 . 18 1 1 A 114 114 GLU HA H 114 4.262 4.186 0.076 1
1 1338 . 18 1 1 A 114 114 GLU C C 114 174.819 179.293 -4.474 1
1 1339 . 18 1 1 A 114 114 GLU CA C 114 56.769 59.163 -2.394 1
1 1340 . 18 1 1 A 114 114 GLU CB C 114 30.125 29.491 0.634 1
1 1342 . 18 1 1 A 114 114 GLU N N 114 121.869 119.861 2.008 1
1 1343 . 18 1 1 A 115 115 LYS H H 115 8.236 7.935 0.301 1
1 1344 . 18 1 1 A 115 115 LYS HA H 115 4.347 4.256 0.091 1
1 1353 . 18 1 1 A 115 115 LYS C C 115 174.633 175.960 -1.327 1
1 1354 . 18 1 1 A 115 115 LYS CA C 115 56.426 59.082 -2.656 1
1 1355 . 18 1 1 A 115 115 LYS CB C 115 33.277 32.721 0.556 1
1 1359 . 18 1 1 A 115 115 LYS N N 115 121.997 119.157 2.840 1
1 1360 . 18 1 1 A 116 116 ASP H H 116 8.386 8.239 0.147 1
1 1361 . 18 1 1 A 116 116 ASP HA H 116 4.600 4.327 0.273 1
1 1364 . 18 1 1 A 116 116 ASP C C 116 173.448 175.308 -1.860 1
1 1365 . 18 1 1 A 116 116 ASP CA C 116 54.773 54.862 -0.089 1
1 1366 . 18 1 1 A 116 116 ASP CB C 116 41.029 39.364 1.665 1
1 1367 . 18 1 1 A 116 116 ASP N N 116 121.057 118.924 2.133 1
1 5 . 19 1 1 A 2 2 MET HA H 2 4.534 4.630 -0.096 1
1 13 . 19 1 1 A 2 2 MET C C 2 174.355 176.890 -2.535 1
1 14 . 19 1 1 A 2 2 MET CA C 2 56.247 55.430 0.817 1
1 15 . 19 1 1 A 2 2 MET CB C 2 32.855 31.713 1.142 1
1 18 . 19 1 1 A 3 3 ASN H H 3 8.600 7.867 0.733 1
1 19 . 19 1 1 A 3 3 ASN HA H 3 4.711 4.361 0.350 1
1 24 . 19 1 1 A 3 3 ASN C C 3 173.983 177.816 -3.833 1
1 25 . 19 1 1 A 3 3 ASN CA C 3 53.650 56.665 -3.015 1
1 26 . 19 1 1 A 3 3 ASN CB C 3 38.624 38.614 0.010 1
1 27 . 19 1 1 A 3 3 ASN N N 3 120.149 119.721 0.428 1
1 29 . 19 1 1 A 4 4 GLU H H 4 8.495 8.242 0.253 1
1 30 . 19 1 1 A 4 4 GLU HA H 4 4.235 4.134 0.101 1
1 35 . 19 1 1 A 4 4 GLU C C 4 175.752 178.709 -2.957 1
1 36 . 19 1 1 A 4 4 GLU CA C 4 58.075 58.934 -0.859 1
1 37 . 19 1 1 A 4 4 GLU CB C 4 30.125 29.657 0.468 1
1 38 . 19 1 1 A 4 4 GLU N N 4 121.543 118.982 2.561 1
1 39 . 19 1 1 A 5 5 LEU HA H 5 4.073 4.261 -0.188 1
1 47 . 19 1 1 A 5 5 LEU CB C 5 41.897 41.710 0.187 1
1 50 . 19 1 1 A 6 6 GLU H H 6 8.332 7.913 0.419 1
1 51 . 19 1 1 A 6 6 GLU HA H 6 3.621 4.510 -0.889 1
1 52 . 19 1 1 A 6 6 GLU C C 6 176.402 178.019 -1.617 1
1 53 . 19 1 1 A 6 6 GLU CA C 6 58.461 56.433 2.028 1
1 54 . 19 1 1 A 6 6 GLU CB C 6 29.730 30.791 -1.061 1
1 55 . 19 1 1 A 6 6 GLU N N 6 121.462 119.133 2.329 1
1 56 . 19 1 1 A 7 7 ALA H H 7 8.244 7.815 0.429 1
1 57 . 19 1 1 A 7 7 ALA HA H 7 4.185 4.114 0.071 1
1 61 . 19 1 1 A 7 7 ALA C C 7 177.982 178.419 -0.437 1
1 62 . 19 1 1 A 7 7 ALA CA C 7 54.791 55.192 -0.401 1
1 63 . 19 1 1 A 7 7 ALA CB C 7 18.836 18.948 -0.112 1
1 64 . 19 1 1 A 7 7 ALA N N 7 123.078 121.562 1.516 1
1 65 . 19 1 1 A 8 8 GLN H H 8 8.274 7.947 0.327 1
1 66 . 19 1 1 A 8 8 GLN HA H 8 4.219 4.416 -0.197 1
1 73 . 19 1 1 A 8 8 GLN C C 8 176.325 175.630 0.695 1
1 74 . 19 1 1 A 8 8 GLN CA C 8 57.864 56.514 1.350 1
1 75 . 19 1 1 A 8 8 GLN CB C 8 28.768 29.169 -0.401 1
1 77 . 19 1 1 A 8 8 GLN N N 8 117.452 117.177 0.275 1
1 79 . 19 1 1 A 9 9 THR H H 9 8.043 8.593 -0.550 1
1 80 . 19 1 1 A 9 9 THR HA H 9 3.998 4.667 -0.669 1
1 85 . 19 1 1 A 9 9 THR C C 9 173.904 174.937 -1.033 1
1 86 . 19 1 1 A 9 9 THR CA C 9 65.435 61.246 4.189 1
1 87 . 19 1 1 A 9 9 THR CB C 9 68.870 69.886 -1.016 1
1 89 . 19 1 1 A 9 9 THR N N 9 116.135 118.672 -2.537 1
1 90 . 19 1 1 A 10 10 ARG H H 10 8.095 8.959 -0.864 1
1 91 . 19 1 1 A 10 10 ARG HA H 10 4.040 3.997 0.043 1
1 98 . 19 1 1 A 10 10 ARG C C 10 176.583 175.593 0.990 1
1 99 . 19 1 1 A 10 10 ARG CA C 10 59.262 57.547 1.715 1
1 100 . 19 1 1 A 10 10 ARG CB C 10 29.900 27.927 1.973 1
1 101 . 19 1 1 A 10 10 ARG N N 10 121.157 122.339 -1.182 1
1 102 . 19 1 1 A 11 11 VAL H H 11 7.657 7.946 -0.289 1
1 103 . 19 1 1 A 11 11 VAL HA H 11 3.769 4.414 -0.645 1
1 111 . 19 1 1 A 11 11 VAL C C 11 176.662 177.794 -1.132 1
1 112 . 19 1 1 A 11 11 VAL CA C 11 65.914 64.040 1.874 1
1 113 . 19 1 1 A 11 11 VAL CB C 11 31.745 33.471 -1.726 1
1 114 . 19 1 1 A 11 11 VAL N N 11 118.580 117.947 0.633 1
1 115 . 19 1 1 A 12 12 LYS H H 12 7.471 7.963 -0.492 1
1 116 . 19 1 1 A 12 12 LYS HA H 12 3.366 4.336 -0.970 1
1 123 . 19 1 1 A 12 12 LYS C C 12 176.457 179.343 -2.886 1
1 124 . 19 1 1 A 12 12 LYS CA C 12 59.545 59.661 -0.116 1
1 125 . 19 1 1 A 12 12 LYS CB C 12 32.206 32.305 -0.099 1
1 126 . 19 1 1 A 12 12 LYS N N 12 121.835 122.261 -0.426 1
1 127 . 19 1 1 A 13 13 LEU H H 13 8.144 8.117 0.027 1
1 128 . 19 1 1 A 13 13 LEU HA H 13 4.093 3.996 0.097 1
1 137 . 19 1 1 A 13 13 LEU C C 13 178.254 179.371 -1.117 1
1 138 . 19 1 1 A 13 13 LEU CA C 13 58.023 57.898 0.125 1
1 139 . 19 1 1 A 13 13 LEU CB C 13 41.283 41.829 -0.546 1
1 140 . 19 1 1 A 13 13 LEU N N 13 118.688 120.932 -2.244 1
1 141 . 19 1 1 A 14 14 ASN H H 14 8.384 8.368 0.016 1
1 142 . 19 1 1 A 14 14 ASN HA H 14 4.567 4.417 0.150 1
1 147 . 19 1 1 A 14 14 ASN C C 14 175.397 177.744 -2.347 1
1 148 . 19 1 1 A 14 14 ASN CA C 14 56.239 56.698 -0.459 1
1 149 . 19 1 1 A 14 14 ASN CB C 14 38.432 38.174 0.258 1
1 150 . 19 1 1 A 14 14 ASN N N 14 118.175 116.763 1.412 1
1 152 . 19 1 1 A 15 15 TYR H H 15 7.982 7.853 0.129 1
1 153 . 19 1 1 A 15 15 TYR HA H 15 4.249 4.092 0.157 1
1 160 . 19 1 1 A 15 15 TYR C C 15 175.503 177.445 -1.942 1
1 161 . 19 1 1 A 15 15 TYR CA C 15 62.450 61.383 1.067 1
1 162 . 19 1 1 A 15 15 TYR CB C 15 39.399 38.590 0.809 1
1 163 . 19 1 1 A 15 15 TYR N N 15 121.955 122.900 -0.945 1
1 164 . 19 1 1 A 16 16 LEU H H 16 8.198 8.576 -0.378 1
1 165 . 19 1 1 A 16 16 LEU HA H 16 4.470 3.977 0.493 1
1 175 . 19 1 1 A 16 16 LEU C C 16 177.125 178.058 -0.933 1
1 176 . 19 1 1 A 16 16 LEU CA C 16 57.374 58.161 -0.787 1
1 177 . 19 1 1 A 16 16 LEU CB C 16 41.443 41.547 -0.104 1
1 178 . 19 1 1 A 16 16 LEU N N 16 117.642 121.401 -3.759 1
1 179 . 19 1 1 A 17 17 ASP H H 17 8.061 8.259 -0.198 1
1 180 . 19 1 1 A 17 17 ASP C C 17 177.836 178.253 -0.417 1
1 181 . 19 1 1 A 17 17 ASP CA C 17 57.486 57.772 -0.286 1
1 182 . 19 1 1 A 17 17 ASP CB C 17 41.433 42.010 -0.577 1
1 183 . 19 1 1 A 17 17 ASP N N 17 118.700 118.969 -0.269 1
1 184 . 19 1 1 A 18 18 GLN H H 18 8.111 8.253 -0.142 1
1 185 . 19 1 1 A 18 18 GLN HA H 18 4.002 4.097 -0.095 1
1 190 . 19 1 1 A 18 18 GLN CA C 18 59.046 58.362 0.684 1
1 191 . 19 1 1 A 18 18 GLN CB C 18 28.700 27.609 1.091 1
1 193 . 19 1 1 A 18 18 GLN N N 18 119.539 116.887 2.652 1
1 195 . 19 1 1 A 19 19 ILE H H 19 8.330 7.966 0.364 1
1 196 . 19 1 1 A 19 19 ILE HA H 19 3.306 3.933 -0.627 1
1 204 . 19 1 1 A 19 19 ILE C C 19 175.608 177.974 -2.366 1
1 205 . 19 1 1 A 19 19 ILE CA C 19 64.760 63.193 1.567 1
1 206 . 19 1 1 A 19 19 ILE CB C 19 37.148 37.279 -0.131 1
1 209 . 19 1 1 A 19 19 ILE N N 19 121.490 122.165 -0.675 1
1 210 . 19 1 1 A 20 20 ALA H H 20 8.057 7.943 0.114 1
1 211 . 19 1 1 A 20 20 ALA HA H 20 4.349 4.168 0.181 1
1 215 . 19 1 1 A 20 20 ALA C C 20 179.297 179.828 -0.531 1
1 216 . 19 1 1 A 20 20 ALA CA C 20 56.150 55.201 0.949 1
1 217 . 19 1 1 A 20 20 ALA CB C 20 18.104 18.194 -0.090 1
1 218 . 19 1 1 A 20 20 ALA N N 20 124.441 124.310 0.131 1
1 219 . 19 1 1 A 21 21 LYS H H 21 8.116 7.784 0.332 1
1 220 . 19 1 1 A 21 21 LYS HA H 21 4.108 3.979 0.129 1
1 229 . 19 1 1 A 21 21 LYS C C 21 176.720 179.143 -2.423 1
1 230 . 19 1 1 A 21 21 LYS CA C 21 59.166 59.356 -0.190 1
1 231 . 19 1 1 A 21 21 LYS CB C 21 32.085 32.265 -0.180 1
1 233 . 19 1 1 A 21 21 LYS N N 21 119.865 118.097 1.768 1
1 234 . 19 1 1 A 22 22 PHE H H 22 7.875 8.307 -0.432 1
1 235 . 19 1 1 A 22 22 PHE HA H 22 4.012 4.108 -0.096 1
1 242 . 19 1 1 A 22 22 PHE C C 22 175.545 177.689 -2.144 1
1 243 . 19 1 1 A 22 22 PHE CA C 22 61.070 61.324 -0.254 1
1 244 . 19 1 1 A 22 22 PHE CB C 22 39.072 38.815 0.257 1
1 249 . 19 1 1 A 22 22 PHE N N 22 119.729 119.737 -0.008 1
1 250 . 19 1 1 A 23 23 TRP H H 23 7.841 8.163 -0.322 1
1 251 . 19 1 1 A 23 23 TRP HA H 23 4.149 4.156 -0.007 1
1 260 . 19 1 1 A 23 23 TRP C C 23 176.668 178.222 -1.554 1
1 261 . 19 1 1 A 23 23 TRP CB C 23 28.543 29.581 -1.038 1
1 267 . 19 1 1 A 23 23 TRP N N 23 119.440 120.477 -1.037 1
1 269 . 19 1 1 A 24 24 GLU H H 24 8.261 7.959 0.302 1
1 270 . 19 1 1 A 24 24 GLU HA H 24 4.265 4.142 0.123 1
1 275 . 19 1 1 A 24 24 GLU C C 24 179.679 178.839 0.840 1
1 276 . 19 1 1 A 24 24 GLU CA C 24 59.706 58.701 1.005 1
1 277 . 19 1 1 A 24 24 GLU CB C 24 29.720 29.630 0.090 1
1 279 . 19 1 1 A 24 24 GLU N N 24 121.376 118.640 2.736 1
1 280 . 19 1 1 A 25 25 ILE H H 25 8.071 7.814 0.257 1
1 281 . 19 1 1 A 25 25 ILE HA H 25 3.815 3.795 0.020 1
1 291 . 19 1 1 A 25 25 ILE C C 25 176.343 176.707 -0.364 1
1 292 . 19 1 1 A 25 25 ILE CA C 25 64.464 62.605 1.859 1
1 293 . 19 1 1 A 25 25 ILE CB C 25 37.371 37.528 -0.157 1
1 296 . 19 1 1 A 25 25 ILE N N 25 121.499 119.619 1.880 1
1 297 . 19 1 1 A 26 26 GLN H H 26 7.327 6.989 0.338 1
1 298 . 19 1 1 A 26 26 GLN HA H 26 4.074 4.176 -0.102 1
1 305 . 19 1 1 A 26 26 GLN C C 26 174.906 175.547 -0.641 1
1 306 . 19 1 1 A 26 26 GLN CA C 26 55.450 54.532 0.918 1
1 307 . 19 1 1 A 26 26 GLN CB C 26 28.458 28.054 0.404 1
1 309 . 19 1 1 A 26 26 GLN N N 26 116.532 120.771 -4.239 1
1 311 . 19 1 1 A 27 27 GLY H H 27 7.861 8.085 -0.224 1
1 312 . 19 1 1 A 27 27 GLY HA2 H 27 4.297 3.739 0.558 1
1 313 . 19 1 1 A 27 27 GLY HA3 H 27 3.823 3.739 0.084 1
1 314 . 19 1 1 A 27 27 GLY C C 27 172.698 173.246 -0.548 1
1 315 . 19 1 1 A 27 27 GLY CA C 27 45.608 45.994 -0.386 1
1 316 . 19 1 1 A 27 27 GLY N N 27 106.837 108.410 -1.573 1
1 317 . 19 1 1 A 28 28 SER H H 28 8.083 7.291 0.792 1
1 318 . 19 1 1 A 28 28 SER HA H 28 4.777 4.726 0.051 1
1 321 . 19 1 1 A 28 28 SER C C 28 171.196 171.752 -0.556 1
1 322 . 19 1 1 A 28 28 SER CA C 28 56.041 56.916 -0.875 1
1 323 . 19 1 1 A 28 28 SER CB C 28 64.539 66.757 -2.218 1
1 324 . 19 1 1 A 28 28 SER N N 28 116.151 114.337 1.814 1
1 325 . 19 1 1 A 29 29 SER H H 29 8.354 8.474 -0.120 1
1 326 . 19 1 1 A 29 29 SER HA H 29 4.389 4.977 -0.588 1
1 329 . 19 1 1 A 29 29 SER C C 29 172.166 172.816 -0.650 1
1 330 . 19 1 1 A 29 29 SER CA C 29 58.107 56.469 1.638 1
1 331 . 19 1 1 A 29 29 SER CB C 29 63.853 66.058 -2.205 1
1 332 . 19 1 1 A 29 29 SER N N 29 116.596 114.228 2.368 1
1 333 . 19 1 1 A 30 30 LEU H H 30 8.990 8.483 0.507 1
1 334 . 19 1 1 A 30 30 LEU HA H 30 3.964 5.090 -1.126 1
1 344 . 19 1 1 A 30 30 LEU C C 30 173.752 175.183 -1.431 1
1 345 . 19 1 1 A 30 30 LEU CA C 30 55.193 55.104 0.089 1
1 346 . 19 1 1 A 30 30 LEU CB C 30 42.869 42.726 0.143 1
1 349 . 19 1 1 A 30 30 LEU N N 30 125.860 126.816 -0.956 1
1 350 . 19 1 1 A 31 31 LYS H H 31 8.118 8.851 -0.733 1
1 351 . 19 1 1 A 31 31 LYS HA H 31 4.498 5.037 -0.539 1
1 360 . 19 1 1 A 31 31 LYS C C 31 173.555 174.958 -1.403 1
1 361 . 19 1 1 A 31 31 LYS CA C 31 54.372 54.949 -0.577 1
1 362 . 19 1 1 A 31 31 LYS CB C 31 32.814 34.770 -1.956 1
1 365 . 19 1 1 A 31 31 LYS N N 31 129.965 126.135 3.830 1
1 366 . 19 1 1 A 32 32 ILE H H 32 8.717 8.696 0.021 1
1 367 . 19 1 1 A 32 32 ILE HA H 32 4.011 4.881 -0.870 1
1 377 . 19 1 1 A 32 32 ILE C C 32 173.038 174.176 -1.138 1
1 378 . 19 1 1 A 32 32 ILE CA C 32 59.921 57.801 2.120 1
1 379 . 19 1 1 A 32 32 ILE CB C 32 38.139 39.866 -1.727 1
1 382 . 19 1 1 A 32 32 ILE N N 32 127.091 119.997 7.094 1
1 383 . 19 1 1 A 33 33 PRO HA H 33 4.412 4.466 -0.054 1
1 390 . 19 1 1 A 33 33 PRO C C 33 172.724 176.165 -3.441 1
1 391 . 19 1 1 A 33 33 PRO CA C 33 62.565 62.562 0.003 1
1 392 . 19 1 1 A 33 33 PRO CB C 33 32.728 32.291 0.437 1
1 394 . 19 1 1 A 34 34 ASN H H 34 8.265 8.430 -0.165 1
1 395 . 19 1 1 A 34 34 ASN HA H 34 5.147 5.398 -0.251 1
1 400 . 19 1 1 A 34 34 ASN C C 34 174.079 173.319 0.760 1
1 401 . 19 1 1 A 34 34 ASN CA C 34 52.088 51.485 0.603 1
1 402 . 19 1 1 A 34 34 ASN CB C 34 40.387 41.836 -1.449 1
1 403 . 19 1 1 A 34 34 ASN N N 34 116.424 115.571 0.853 1
1 405 . 19 1 1 A 35 35 VAL H H 35 8.904 9.115 -0.211 1
1 406 . 19 1 1 A 35 35 VAL HA H 35 4.159 4.441 -0.282 1
1 414 . 19 1 1 A 35 35 VAL C C 35 173.834 174.691 -0.857 1
1 415 . 19 1 1 A 35 35 VAL CA C 35 61.953 59.742 2.211 1
1 416 . 19 1 1 A 35 35 VAL CB C 35 34.432 34.583 -0.151 1
1 419 . 19 1 1 A 35 35 VAL N N 35 122.778 119.056 3.722 1
1 420 . 19 1 1 A 36 36 GLU H H 36 9.560 9.439 0.121 1
1 421 . 19 1 1 A 36 36 GLU HA H 36 3.819 4.013 -0.194 1
1 426 . 19 1 1 A 36 36 GLU C C 36 173.604 175.872 -2.268 1
1 427 . 19 1 1 A 36 36 GLU CA C 36 57.131 58.048 -0.917 1
1 428 . 19 1 1 A 36 36 GLU CB C 36 27.464 28.056 -0.592 1
1 430 . 19 1 1 A 36 36 GLU N N 36 127.014 128.572 -1.558 1
1 431 . 19 1 1 A 37 37 ARG H H 37 8.578 8.459 0.119 1
1 432 . 19 1 1 A 37 37 ARG HA H 37 3.792 3.930 -0.138 1
1 439 . 19 1 1 A 37 37 ARG C C 37 173.371 174.734 -1.363 1
1 440 . 19 1 1 A 37 37 ARG CA C 37 57.952 57.800 0.152 1
1 441 . 19 1 1 A 37 37 ARG CB C 37 27.657 27.680 -0.023 1
1 443 . 19 1 1 A 37 37 ARG N N 37 108.362 110.692 -2.330 1
1 444 . 19 1 1 A 38 38 ARG H H 38 7.696 7.756 -0.060 1
1 445 . 19 1 1 A 38 38 ARG HA H 38 4.743 4.879 -0.136 1
1 452 . 19 1 1 A 38 38 ARG C C 38 173.513 174.867 -1.354 1
1 453 . 19 1 1 A 38 38 ARG CA C 38 54.507 54.466 0.041 1
1 454 . 19 1 1 A 38 38 ARG CB C 38 33.751 33.217 0.534 1
1 456 . 19 1 1 A 38 38 ARG N N 38 118.370 118.257 0.113 1
1 457 . 19 1 1 A 39 39 ILE H H 39 8.463 8.423 0.040 1
1 458 . 19 1 1 A 39 39 ILE HA H 39 4.184 4.201 -0.017 1
1 468 . 19 1 1 A 39 39 ILE C C 39 175.150 175.833 -0.683 1
1 469 . 19 1 1 A 39 39 ILE CA C 39 62.076 61.684 0.392 1
1 470 . 19 1 1 A 39 39 ILE CB C 39 38.864 39.304 -0.440 1
1 473 . 19 1 1 A 39 39 ILE N N 39 123.604 125.454 -1.850 1
1 474 . 19 1 1 A 40 40 LEU H H 40 8.239 8.176 0.063 1
1 475 . 19 1 1 A 40 40 LEU HA H 40 4.259 4.506 -0.247 1
1 485 . 19 1 1 A 40 40 LEU C C 40 173.152 175.422 -2.270 1
1 486 . 19 1 1 A 40 40 LEU CA C 40 55.305 54.821 0.484 1
1 487 . 19 1 1 A 40 40 LEU CB C 40 43.113 41.794 1.319 1
1 490 . 19 1 1 A 40 40 LEU N N 40 129.550 128.796 0.754 1
1 491 . 19 1 1 A 41 41 ASP H H 41 8.992 8.475 0.517 1
1 492 . 19 1 1 A 41 41 ASP HA H 41 4.798 4.765 0.033 1
1 495 . 19 1 1 A 41 41 ASP C C 41 173.837 176.227 -2.390 1
1 496 . 19 1 1 A 41 41 ASP CA C 41 52.077 53.516 -1.439 1
1 497 . 19 1 1 A 41 41 ASP CB C 41 39.454 40.642 -1.188 1
1 498 . 19 1 1 A 41 41 ASP N N 41 127.022 127.725 -0.703 1
1 499 . 19 1 1 A 42 42 LEU H H 42 7.912 8.243 -0.331 1
1 500 . 19 1 1 A 42 42 LEU HA H 42 3.970 4.148 -0.178 1
1 510 . 19 1 1 A 42 42 LEU C C 42 176.305 177.726 -1.421 1
1 511 . 19 1 1 A 42 42 LEU CA C 42 58.128 57.791 0.337 1
1 512 . 19 1 1 A 42 42 LEU CB C 42 43.043 41.857 1.186 1
1 514 . 19 1 1 A 42 42 LEU N N 42 125.064 127.949 -2.885 1
1 515 . 19 1 1 A 43 43 TYR H H 43 8.565 8.356 0.209 1
1 516 . 19 1 1 A 43 43 TYR HA H 43 3.728 3.732 -0.004 1
1 523 . 19 1 1 A 43 43 TYR C C 43 175.757 177.084 -1.327 1
1 524 . 19 1 1 A 43 43 TYR CA C 43 61.774 61.603 0.171 1
1 525 . 19 1 1 A 43 43 TYR CB C 43 38.235 38.303 -0.068 1
1 528 . 19 1 1 A 43 43 TYR N N 43 117.822 120.945 -3.123 1
1 529 . 19 1 1 A 44 44 SER H H 44 8.115 8.665 -0.550 1
1 530 . 19 1 1 A 44 44 SER HA H 44 3.854 4.254 -0.400 1
1 533 . 19 1 1 A 44 44 SER C C 44 174.080 177.111 -3.031 1
1 534 . 19 1 1 A 44 44 SER CA C 44 61.873 61.727 0.146 1
1 535 . 19 1 1 A 44 44 SER CB C 44 64.350 62.287 2.063 1
1 536 . 19 1 1 A 44 44 SER N N 44 116.835 114.256 2.579 1
1 537 . 19 1 1 A 45 45 LEU H H 45 8.401 7.928 0.473 1
1 538 . 19 1 1 A 45 45 LEU HA H 45 4.102 4.184 -0.082 1
1 548 . 19 1 1 A 45 45 LEU C C 45 175.081 178.831 -3.750 1
1 549 . 19 1 1 A 45 45 LEU CA C 45 58.896 57.806 1.090 1
1 550 . 19 1 1 A 45 45 LEU CB C 45 41.741 41.392 0.349 1
1 553 . 19 1 1 A 45 45 LEU N N 45 120.621 124.735 -4.114 1
1 554 . 19 1 1 A 46 46 SER H H 46 8.110 8.471 -0.361 1
1 555 . 19 1 1 A 46 46 SER HA H 46 4.300 4.214 0.086 1
1 558 . 19 1 1 A 46 46 SER C C 46 175.019 176.684 -1.665 1
1 559 . 19 1 1 A 46 46 SER CA C 46 62.610 61.706 0.904 1
1 560 . 19 1 1 A 46 46 SER CB C 46 64.092 63.133 0.959 1
1 561 . 19 1 1 A 46 46 SER N N 46 112.826 114.919 -2.093 1
1 562 . 19 1 1 A 47 47 LYS H H 47 7.732 8.025 -0.293 1
1 563 . 19 1 1 A 47 47 LYS HA H 47 3.900 4.159 -0.259 1
1 572 . 19 1 1 A 47 47 LYS C C 47 177.441 178.959 -1.518 1
1 573 . 19 1 1 A 47 47 LYS CA C 47 58.575 59.006 -0.431 1
1 574 . 19 1 1 A 47 47 LYS CB C 47 32.351 32.138 0.213 1
1 576 . 19 1 1 A 47 47 LYS N N 47 121.210 119.055 2.155 1
1 577 . 19 1 1 A 48 48 ILE H H 48 8.672 7.886 0.786 1
1 578 . 19 1 1 A 48 48 ILE HA H 48 3.628 3.666 -0.038 1
1 588 . 19 1 1 A 48 48 ILE C C 48 175.861 178.020 -2.159 1
1 589 . 19 1 1 A 48 48 ILE CA C 48 64.188 65.228 -1.040 1
1 590 . 19 1 1 A 48 48 ILE CB C 48 37.954 37.632 0.322 1
1 593 . 19 1 1 A 48 48 ILE N N 48 120.810 121.152 -0.342 1
1 594 . 19 1 1 A 49 49 VAL H H 49 8.030 8.352 -0.322 1
1 595 . 19 1 1 A 49 49 VAL HA H 49 3.195 3.684 -0.489 1
1 603 . 19 1 1 A 49 49 VAL C C 49 176.513 178.453 -1.940 1
1 604 . 19 1 1 A 49 49 VAL CA C 49 66.760 67.030 -0.270 1
1 605 . 19 1 1 A 49 49 VAL CB C 49 30.935 31.743 -0.808 1
1 608 . 19 1 1 A 49 49 VAL N N 49 119.350 119.622 -0.272 1
1 609 . 19 1 1 A 50 50 VAL H H 50 7.336 8.326 -0.990 1
1 610 . 19 1 1 A 50 50 VAL HA H 50 3.497 3.590 -0.093 1
1 618 . 19 1 1 A 50 50 VAL C C 50 178.745 177.710 1.035 1
1 619 . 19 1 1 A 50 50 VAL CA C 50 67.384 66.605 0.779 1
1 620 . 19 1 1 A 50 50 VAL CB C 50 31.832 31.345 0.487 1
1 621 . 19 1 1 A 50 50 VAL N N 50 118.610 120.852 -2.242 1
1 622 . 19 1 1 A 51 51 GLU H H 51 8.318 8.947 -0.629 1
1 623 . 19 1 1 A 51 51 GLU HA H 51 3.953 3.923 0.030 1
1 628 . 19 1 1 A 51 51 GLU C C 51 177.281 179.432 -2.151 1
1 629 . 19 1 1 A 51 51 GLU CA C 51 59.668 60.052 -0.384 1
1 630 . 19 1 1 A 51 51 GLU CB C 51 30.131 29.345 0.786 1
1 632 . 19 1 1 A 51 51 GLU N N 51 122.096 118.544 3.552 1
1 633 . 19 1 1 A 52 52 GLU H H 52 8.065 8.259 -0.194 1
1 634 . 19 1 1 A 52 52 GLU HA H 52 4.229 4.255 -0.026 1
1 639 . 19 1 1 A 52 52 GLU C C 52 173.534 176.710 -3.176 1
1 640 . 19 1 1 A 52 52 GLU CA C 52 55.547 56.478 -0.931 1
1 641 . 19 1 1 A 52 52 GLU CB C 52 28.716 29.830 -1.114 1
1 643 . 19 1 1 A 52 52 GLU N N 52 114.992 116.915 -1.923 1
1 644 . 19 1 1 A 53 53 GLY H H 53 7.459 9.555 -2.096 1
1 645 . 19 1 1 A 53 53 GLY HA2 H 53 3.630 3.943 -0.313 1
1 646 . 19 1 1 A 53 53 GLY HA3 H 53 3.630 3.960 -0.330 1
1 647 . 19 1 1 A 53 53 GLY C C 53 173.214 173.710 -0.496 1
1 648 . 19 1 1 A 53 53 GLY CA C 53 44.962 45.204 -0.242 1
1 649 . 19 1 1 A 53 53 GLY N N 53 104.909 108.543 -3.634 1
1 650 . 19 1 1 A 54 54 GLY H H 54 8.533 7.299 1.234 1
1 651 . 19 1 1 A 54 54 GLY HA2 H 54 3.548 4.086 -0.538 1
1 652 . 19 1 1 A 54 54 GLY HA3 H 54 4.521 4.132 0.389 1
1 653 . 19 1 1 A 54 54 GLY C C 54 169.966 174.594 -4.628 1
1 654 . 19 1 1 A 54 54 GLY CA C 54 43.988 45.727 -1.739 1
1 655 . 19 1 1 A 54 54 GLY N N 54 110.587 108.250 2.337 1
1 656 . 19 1 1 A 55 55 TYR H H 55 8.704 9.272 -0.568 1
1 657 . 19 1 1 A 55 55 TYR HA H 55 3.618 4.029 -0.411 1
1 664 . 19 1 1 A 55 55 TYR C C 55 174.807 177.022 -2.215 1
1 665 . 19 1 1 A 55 55 TYR CA C 55 62.540 61.614 0.926 1
1 666 . 19 1 1 A 55 55 TYR CB C 55 39.669 39.262 0.407 1
1 669 . 19 1 1 A 55 55 TYR N N 55 119.168 122.149 -2.981 1
1 670 . 19 1 1 A 56 56 GLU H H 56 9.006 8.314 0.692 1
1 671 . 19 1 1 A 56 56 GLU HA H 56 3.638 3.619 0.019 1
1 676 . 19 1 1 A 56 56 GLU C C 56 177.400 178.285 -0.885 1
1 677 . 19 1 1 A 56 56 GLU CA C 56 60.530 59.400 1.130 1
1 678 . 19 1 1 A 56 56 GLU CB C 56 29.168 29.440 -0.272 1
1 679 . 19 1 1 A 56 56 GLU N N 56 118.969 117.965 1.004 1
1 680 . 19 1 1 A 57 57 ALA H H 57 8.235 7.766 0.469 1
1 681 . 19 1 1 A 57 57 ALA HA H 57 3.980 3.979 0.001 1
1 685 . 19 1 1 A 57 57 ALA C C 57 177.678 179.633 -1.955 1
1 686 . 19 1 1 A 57 57 ALA CA C 57 54.910 55.068 -0.158 1
1 687 . 19 1 1 A 57 57 ALA CB C 57 18.122 18.619 -0.497 1
1 688 . 19 1 1 A 57 57 ALA N N 57 122.860 121.722 1.138 1
1 689 . 19 1 1 A 58 58 ILE H H 58 7.831 7.443 0.388 1
1 690 . 19 1 1 A 58 58 ILE HA H 58 3.189 3.275 -0.086 1
1 700 . 19 1 1 A 58 58 ILE C C 58 177.818 177.247 0.571 1
1 701 . 19 1 1 A 58 58 ILE CA C 58 65.074 64.413 0.661 1
1 702 . 19 1 1 A 58 58 ILE CB C 58 38.178 36.489 1.689 1
1 706 . 19 1 1 A 58 58 ILE N N 58 117.418 116.965 0.453 1
1 707 . 19 1 1 A 59 59 CYS H H 59 7.760 8.182 -0.422 1
1 708 . 19 1 1 A 59 59 CYS HA H 59 4.203 4.188 0.015 1
1 711 . 19 1 1 A 59 59 CYS C C 59 176.357 177.116 -0.759 1
1 712 . 19 1 1 A 59 59 CYS CA C 59 63.760 62.248 1.512 1
1 713 . 19 1 1 A 59 59 CYS CB C 59 27.638 26.398 1.240 1
1 714 . 19 1 1 A 59 59 CYS N N 59 115.302 120.334 -5.032 1
1 715 . 19 1 1 A 60 60 LYS H H 60 8.350 7.869 0.481 1
1 716 . 19 1 1 A 60 60 LYS HA H 60 3.972 4.006 -0.034 1
1 725 . 19 1 1 A 60 60 LYS C C 60 176.373 177.459 -1.086 1
1 726 . 19 1 1 A 60 60 LYS CA C 60 59.796 58.742 1.054 1
1 727 . 19 1 1 A 60 60 LYS CB C 60 32.560 32.142 0.418 1
1 729 . 19 1 1 A 60 60 LYS N N 60 122.343 120.805 1.538 1
1 730 . 19 1 1 A 61 61 ASP H H 61 8.157 7.726 0.431 1
1 731 . 19 1 1 A 61 61 ASP HA H 61 4.616 4.643 -0.027 1
1 734 . 19 1 1 A 61 61 ASP C C 61 173.246 175.032 -1.786 1
1 735 . 19 1 1 A 61 61 ASP CA C 61 54.272 53.581 0.691 1
1 736 . 19 1 1 A 61 61 ASP CB C 61 41.023 41.340 -0.317 1
1 737 . 19 1 1 A 61 61 ASP N N 61 116.173 116.197 -0.024 1
1 738 . 19 1 1 A 62 62 ARG H H 62 7.655 7.668 -0.013 1
1 739 . 19 1 1 A 62 62 ARG HA H 62 4.149 3.982 0.167 1
1 746 . 19 1 1 A 62 62 ARG C C 62 175.891 175.966 -0.075 1
1 747 . 19 1 1 A 62 62 ARG CA C 62 57.381 57.159 0.222 1
1 748 . 19 1 1 A 62 62 ARG CB C 62 26.538 26.781 -0.243 1
1 750 . 19 1 1 A 62 62 ARG N N 62 117.213 115.285 1.928 1
1 751 . 19 1 1 A 63 63 ARG H H 63 8.302 7.593 0.709 1
1 752 . 19 1 1 A 63 63 ARG HA H 63 4.240 4.178 0.062 1
1 757 . 19 1 1 A 63 63 ARG C C 63 175.775 177.601 -1.826 1
1 758 . 19 1 1 A 63 63 ARG CA C 63 55.718 57.300 -1.582 1
1 760 . 19 1 1 A 63 63 ARG N N 63 116.292 117.685 -1.393 1
1 761 . 19 1 1 A 64 64 TRP H H 64 8.161 7.295 0.866 1
1 762 . 19 1 1 A 64 64 TRP HA H 64 3.836 4.356 -0.520 1
1 771 . 19 1 1 A 64 64 TRP C C 64 176.862 178.598 -1.736 1
1 772 . 19 1 1 A 64 64 TRP CA C 64 62.036 60.071 1.965 1
1 773 . 19 1 1 A 64 64 TRP CB C 64 27.028 28.658 -1.630 1
1 779 . 19 1 1 A 64 64 TRP N N 64 121.486 120.357 1.129 1
1 781 . 19 1 1 A 65 65 ALA H H 65 8.954 7.957 0.997 1
1 782 . 19 1 1 A 65 65 ALA HA H 65 4.290 4.073 0.217 1
1 786 . 19 1 1 A 65 65 ALA C C 65 178.986 179.442 -0.456 1
1 787 . 19 1 1 A 65 65 ALA CA C 65 55.314 55.395 -0.081 1
1 788 . 19 1 1 A 65 65 ALA CB C 65 18.119 18.171 -0.052 1
1 789 . 19 1 1 A 65 65 ALA N N 65 121.559 122.717 -1.158 1
1 790 . 19 1 1 A 66 66 ARG H H 66 7.473 7.626 -0.153 1
1 791 . 19 1 1 A 66 66 ARG HA H 66 4.221 4.109 0.112 1
1 798 . 19 1 1 A 66 66 ARG C C 66 176.670 178.706 -2.036 1
1 799 . 19 1 1 A 66 66 ARG CA C 66 57.871 59.046 -1.175 1
1 800 . 19 1 1 A 66 66 ARG CB C 66 29.097 29.713 -0.616 1
1 801 . 19 1 1 A 66 66 ARG N N 66 119.915 117.298 2.617 1
1 802 . 19 1 1 A 67 67 VAL H H 67 7.134 7.730 -0.596 1
1 803 . 19 1 1 A 67 67 VAL HA H 67 3.304 3.654 -0.350 1
1 811 . 19 1 1 A 67 67 VAL C C 67 175.341 178.081 -2.740 1
1 812 . 19 1 1 A 67 67 VAL CA C 67 66.722 66.625 0.097 1
1 813 . 19 1 1 A 67 67 VAL CB C 67 31.108 31.953 -0.845 1
1 816 . 19 1 1 A 67 67 VAL N N 67 119.970 120.733 -0.763 1
1 817 . 19 1 1 A 68 68 ALA H H 68 7.745 8.470 -0.725 1
1 818 . 19 1 1 A 68 68 ALA HA H 68 4.076 4.138 -0.062 1
1 822 . 19 1 1 A 68 68 ALA C C 68 177.358 179.539 -2.181 1
1 823 . 19 1 1 A 68 68 ALA CA C 68 55.607 55.305 0.302 1
1 824 . 19 1 1 A 68 68 ALA CB C 68 18.061 18.465 -0.404 1
1 825 . 19 1 1 A 68 68 ALA N N 68 118.239 121.387 -3.148 1
1 826 . 19 1 1 A 69 69 GLN H H 69 7.979 8.077 -0.098 1
1 827 . 19 1 1 A 69 69 GLN HA H 69 4.310 3.951 0.359 1
1 834 . 19 1 1 A 69 69 GLN C C 69 179.370 178.001 1.369 1
1 835 . 19 1 1 A 69 69 GLN CA C 69 59.307 59.215 0.092 1
1 836 . 19 1 1 A 69 69 GLN CB C 69 29.257 28.435 0.822 1
1 838 . 19 1 1 A 69 69 GLN N N 69 118.484 118.361 0.123 1
1 840 . 19 1 1 A 70 70 ARG H H 70 8.374 8.071 0.303 1
1 841 . 19 1 1 A 70 70 ARG HA H 70 4.148 4.146 0.002 1
1 848 . 19 1 1 A 70 70 ARG C C 70 175.850 178.107 -2.257 1
1 849 . 19 1 1 A 70 70 ARG CA C 70 58.957 58.473 0.484 1
1 850 . 19 1 1 A 70 70 ARG CB C 70 29.799 29.972 -0.173 1
1 852 . 19 1 1 A 70 70 ARG N N 70 120.309 120.267 0.042 1
1 853 . 19 1 1 A 71 71 LEU H H 71 7.413 7.755 -0.342 1
1 854 . 19 1 1 A 71 71 LEU HA H 71 4.341 4.139 0.202 1
1 864 . 19 1 1 A 71 71 LEU C C 71 173.391 175.878 -2.487 1
1 865 . 19 1 1 A 71 71 LEU CA C 71 54.911 54.696 0.215 1
1 866 . 19 1 1 A 71 71 LEU CB C 71 42.693 41.598 1.095 1
1 867 . 19 1 1 A 71 71 LEU N N 71 118.841 117.761 1.080 1
1 868 . 19 1 1 A 72 72 ASN H H 72 8.038 7.886 0.152 1
1 869 . 19 1 1 A 72 72 ASN HA H 72 4.394 4.329 0.065 1
1 874 . 19 1 1 A 72 72 ASN C C 72 173.042 173.789 -0.747 1
1 875 . 19 1 1 A 72 72 ASN CB C 72 36.412 36.016 0.396 1
1 876 . 19 1 1 A 72 72 ASN N N 72 112.919 116.289 -3.370 1
1 878 . 19 1 1 A 73 73 TYR H H 73 7.874 7.774 0.100 1
1 879 . 19 1 1 A 73 73 TYR HA H 73 4.868 4.793 0.075 1
1 886 . 19 1 1 A 73 73 TYR C C 73 172.194 174.330 -2.136 1
1 887 . 19 1 1 A 73 73 TYR CA C 73 57.105 56.133 0.972 1
1 888 . 19 1 1 A 73 73 TYR CB C 73 37.918 39.418 -1.500 1
1 889 . 19 1 1 A 73 73 TYR N N 73 117.432 119.494 -2.062 1
1 897 . 19 1 1 A 75 75 PRO HA H 75 4.626 4.377 0.249 1
1 902 . 19 1 1 A 75 75 PRO C C 75 175.728 177.856 -2.128 1
1 903 . 19 1 1 A 75 75 PRO CA C 75 62.502 65.954 -3.452 1
1 904 . 19 1 1 A 75 75 PRO CB C 75 32.339 31.397 0.942 1
1 905 . 19 1 1 A 76 76 GLY H H 76 8.369 8.011 0.358 1
1 906 . 19 1 1 A 76 76 GLY HA2 H 76 4.057 3.925 0.132 1
1 907 . 19 1 1 A 76 76 GLY HA3 H 76 4.556 3.926 0.630 1
1 908 . 19 1 1 A 76 76 GLY C C 76 173.248 174.651 -1.403 1
1 909 . 19 1 1 A 76 76 GLY CA C 76 46.180 45.752 0.428 1
1 910 . 19 1 1 A 76 76 GLY N N 76 106.185 108.186 -2.001 1
1 911 . 19 1 1 A 77 77 LYS H H 77 8.632 8.511 0.121 1
1 912 . 19 1 1 A 77 77 LYS HA H 77 4.433 4.132 0.301 1
1 921 . 19 1 1 A 77 77 LYS C C 77 174.924 176.964 -2.040 1
1 922 . 19 1 1 A 77 77 LYS CA C 77 56.453 57.703 -1.250 1
1 923 . 19 1 1 A 77 77 LYS CB C 77 33.170 32.433 0.737 1
1 925 . 19 1 1 A 77 77 LYS N N 77 119.592 119.213 0.379 1
1 926 . 19 1 1 A 78 78 ASN H H 78 8.865 8.077 0.788 1
1 927 . 19 1 1 A 78 78 ASN HA H 78 4.654 4.573 0.081 1
1 932 . 19 1 1 A 78 78 ASN C C 78 174.869 177.742 -2.873 1
1 933 . 19 1 1 A 78 78 ASN CA C 78 54.117 56.035 -1.918 1
1 934 . 19 1 1 A 78 78 ASN CB C 78 37.841 38.414 -0.573 1
1 935 . 19 1 1 A 78 78 ASN N N 78 116.880 117.700 -0.820 1
1 937 . 19 1 1 A 79 79 ILE H H 79 8.008 7.805 0.203 1
1 938 . 19 1 1 A 79 79 ILE HA H 79 3.718 3.783 -0.065 1
1 948 . 19 1 1 A 79 79 ILE C C 79 175.921 178.299 -2.378 1
1 949 . 19 1 1 A 79 79 ILE CA C 79 63.618 64.866 -1.248 1
1 950 . 19 1 1 A 79 79 ILE CB C 79 37.158 37.404 -0.246 1
1 952 . 19 1 1 A 79 79 ILE N N 79 119.688 119.702 -0.014 1
1 953 . 19 1 1 A 80 80 GLY H H 80 9.062 8.267 0.795 1
1 954 . 19 1 1 A 80 80 GLY HA2 H 80 3.739 3.861 -0.122 1
1 955 . 19 1 1 A 80 80 GLY HA3 H 80 3.739 3.907 -0.168 1
1 956 . 19 1 1 A 80 80 GLY C C 80 173.185 176.555 -3.370 1
1 957 . 19 1 1 A 80 80 GLY CA C 80 48.166 47.564 0.602 1
1 958 . 19 1 1 A 80 80 GLY N N 80 110.338 108.998 1.340 1
1 959 . 19 1 1 A 81 81 SER H H 81 7.460 7.886 -0.426 1
1 960 . 19 1 1 A 81 81 SER HA H 81 3.904 4.125 -0.221 1
1 963 . 19 1 1 A 81 81 SER C C 81 174.999 175.989 -0.990 1
1 964 . 19 1 1 A 81 81 SER CA C 81 61.138 62.652 -1.514 1
1 965 . 19 1 1 A 81 81 SER CB C 81 62.740 62.871 -0.131 1
1 966 . 19 1 1 A 81 81 SER N N 81 115.348 119.568 -4.220 1
1 967 . 19 1 1 A 82 82 LEU H H 82 7.367 8.125 -0.758 1
1 968 . 19 1 1 A 82 82 LEU HA H 82 3.946 3.991 -0.045 1
1 977 . 19 1 1 A 82 82 LEU C C 82 176.969 178.231 -1.262 1
1 978 . 19 1 1 A 82 82 LEU CA C 82 57.504 58.492 -0.988 1
1 979 . 19 1 1 A 82 82 LEU CB C 82 42.185 41.584 0.601 1
1 980 . 19 1 1 A 82 82 LEU N N 82 124.267 122.620 1.647 1
1 981 . 19 1 1 A 83 83 LEU H H 83 8.330 8.431 -0.101 1
1 982 . 19 1 1 A 83 83 LEU HA H 83 3.924 3.932 -0.008 1
1 991 . 19 1 1 A 83 83 LEU C C 83 176.303 178.346 -2.043 1
1 992 . 19 1 1 A 83 83 LEU CA C 83 58.067 58.400 -0.333 1
1 993 . 19 1 1 A 83 83 LEU CB C 83 41.061 41.472 -0.411 1
1 994 . 19 1 1 A 83 83 LEU N N 83 117.452 119.696 -2.244 1
1 995 . 19 1 1 A 84 84 ARG H H 84 7.651 8.037 -0.386 1
1 996 . 19 1 1 A 84 84 ARG HA H 84 2.230 3.656 -1.426 1
1 1003 . 19 1 1 A 84 84 ARG C C 84 175.902 178.681 -2.779 1
1 1004 . 19 1 1 A 84 84 ARG CA C 84 59.112 59.551 -0.439 1
1 1005 . 19 1 1 A 84 84 ARG CB C 84 28.579 29.826 -1.247 1
1 1007 . 19 1 1 A 84 84 ARG N N 84 119.586 119.738 -0.152 1
1 1008 . 19 1 1 A 85 85 SER H H 85 7.291 8.326 -1.035 1
1 1009 . 19 1 1 A 85 85 SER HA H 85 4.189 4.079 0.110 1
1 1012 . 19 1 1 A 85 85 SER C C 85 175.546 176.306 -0.760 1
1 1013 . 19 1 1 A 85 85 SER CA C 85 61.376 62.375 -0.999 1
1 1014 . 19 1 1 A 85 85 SER CB C 85 62.805 63.003 -0.198 1
1 1015 . 19 1 1 A 85 85 SER N N 85 112.921 116.296 -3.375 1
1 1016 . 19 1 1 A 86 86 HIS H H 86 8.156 7.453 0.703 1
1 1017 . 19 1 1 A 86 86 HIS HA H 86 4.782 4.190 0.592 1
1 1022 . 19 1 1 A 86 86 HIS C C 86 176.851 177.457 -0.606 1
1 1023 . 19 1 1 A 86 86 HIS CA C 86 58.898 59.421 -0.523 1
1 1024 . 19 1 1 A 86 86 HIS CB C 86 31.110 30.037 1.073 1
1 1027 . 19 1 1 A 86 86 HIS N N 86 119.258 119.084 0.174 1
1 1028 . 19 1 1 A 87 87 TYR H H 87 9.180 8.216 0.964 1
1 1029 . 19 1 1 A 87 87 TYR HA H 87 3.913 3.885 0.028 1
1 1036 . 19 1 1 A 87 87 TYR C C 87 176.841 177.666 -0.825 1
1 1037 . 19 1 1 A 87 87 TYR CA C 87 63.526 61.348 2.178 1
1 1038 . 19 1 1 A 87 87 TYR CB C 87 39.431 38.344 1.087 1
1 1041 . 19 1 1 A 87 87 TYR N N 87 120.625 120.091 0.534 1
1 1042 . 19 1 1 A 88 88 GLU H H 88 9.028 8.521 0.507 1
1 1043 . 19 1 1 A 88 88 GLU HA H 88 3.682 3.865 -0.183 1
1 1048 . 19 1 1 A 88 88 GLU C C 88 175.833 177.999 -2.166 1
1 1049 . 19 1 1 A 88 88 GLU CA C 88 59.730 59.536 0.194 1
1 1050 . 19 1 1 A 88 88 GLU CB C 88 30.009 29.535 0.474 1
1 1052 . 19 1 1 A 88 88 GLU N N 88 119.531 119.766 -0.235 1
1 1053 . 19 1 1 A 89 89 ARG H H 89 8.052 7.942 0.110 1
1 1054 . 19 1 1 A 89 89 ARG HA H 89 4.292 4.442 -0.150 1
1 1061 . 19 1 1 A 89 89 ARG C C 89 176.045 178.056 -2.011 1
1 1062 . 19 1 1 A 89 89 ARG CA C 89 58.538 57.627 0.911 1
1 1063 . 19 1 1 A 89 89 ARG CB C 89 31.841 31.100 0.741 1
1 1065 . 19 1 1 A 89 89 ARG N N 89 114.741 118.841 -4.100 1
1 1066 . 19 1 1 A 90 90 ILE H H 90 8.141 7.963 0.178 1
1 1067 . 19 1 1 A 90 90 ILE HA H 90 4.296 4.190 0.106 1
1 1075 . 19 1 1 A 90 90 ILE C C 90 174.461 177.062 -2.601 1
1 1076 . 19 1 1 A 90 90 ILE CA C 90 63.649 63.214 0.435 1
1 1077 . 19 1 1 A 90 90 ILE CB C 90 40.626 38.792 1.834 1
1 1079 . 19 1 1 A 90 90 ILE N N 90 113.421 118.744 -5.323 1
1 1080 . 19 1 1 A 91 91 VAL H H 91 7.350 7.572 -0.222 1
1 1081 . 19 1 1 A 91 91 VAL HA H 91 4.144 3.596 0.548 1
1 1089 . 19 1 1 A 91 91 VAL C C 91 175.422 176.547 -1.125 1
1 1090 . 19 1 1 A 91 91 VAL CA C 91 65.042 62.916 2.126 1
1 1091 . 19 1 1 A 91 91 VAL CB C 91 33.215 31.302 1.913 1
1 1092 . 19 1 1 A 91 91 VAL N N 91 118.215 120.612 -2.397 1
1 1093 . 19 1 1 A 92 92 TYR H H 92 8.565 8.001 0.564 1
1 1094 . 19 1 1 A 92 92 TYR HA H 92 4.217 4.235 -0.018 1
1 1099 . 19 1 1 A 92 92 TYR C C 92 171.495 175.141 -3.646 1
1 1100 . 19 1 1 A 92 92 TYR CA C 92 61.558 62.314 -0.756 1
1 1101 . 19 1 1 A 92 92 TYR CB C 92 36.757 37.433 -0.676 1
1 1102 . 19 1 1 A 92 92 TYR N N 92 121.370 122.638 -1.268 1
1 1103 . 19 1 1 A 93 93 PRO HA H 93 4.136 4.407 -0.271 1
1 1108 . 19 1 1 A 93 93 PRO C C 93 177.077 178.733 -1.656 1
1 1109 . 19 1 1 A 93 93 PRO CA C 93 66.037 66.045 -0.008 1
1 1110 . 19 1 1 A 93 93 PRO CB C 93 31.482 31.146 0.336 1
1 1111 . 19 1 1 A 94 94 TYR H H 94 6.517 7.480 -0.963 1
1 1112 . 19 1 1 A 94 94 TYR HA H 94 2.798 4.472 -1.674 1
1 1119 . 19 1 1 A 94 94 TYR C C 94 174.985 178.240 -3.255 1
1 1120 . 19 1 1 A 94 94 TYR CA C 94 59.356 60.028 -0.672 1
1 1121 . 19 1 1 A 94 94 TYR CB C 94 37.987 37.337 0.650 1
1 1124 . 19 1 1 A 94 94 TYR N N 94 115.987 117.494 -1.507 1
1 1125 . 19 1 1 A 95 95 GLU H H 95 8.205 8.486 -0.281 1
1 1126 . 19 1 1 A 95 95 GLU HA H 95 3.682 4.140 -0.458 1
1 1131 . 19 1 1 A 95 95 GLU C C 95 178.530 178.860 -0.330 1
1 1132 . 19 1 1 A 95 95 GLU CA C 95 58.910 60.175 -1.265 1
1 1133 . 19 1 1 A 95 95 GLU CB C 95 29.187 29.561 -0.374 1
1 1134 . 19 1 1 A 95 95 GLU N N 95 119.946 121.028 -1.082 1
1 1135 . 19 1 1 A 96 96 MET H H 96 8.248 7.991 0.257 1
1 1136 . 19 1 1 A 96 96 MET HA H 96 4.172 4.231 -0.059 1
1 1142 . 19 1 1 A 96 96 MET C C 96 176.874 178.346 -1.472 1
1 1143 . 19 1 1 A 96 96 MET CA C 96 57.159 58.950 -1.791 1
1 1144 . 19 1 1 A 96 96 MET CB C 96 31.829 32.519 -0.690 1
1 1146 . 19 1 1 A 96 96 MET N N 96 117.570 119.165 -1.595 1
1 1147 . 19 1 1 A 97 97 TYR H H 97 7.445 8.279 -0.834 1
1 1148 . 19 1 1 A 97 97 TYR HA H 97 4.248 4.084 0.164 1
1 1155 . 19 1 1 A 97 97 TYR C C 97 176.476 177.213 -0.737 1
1 1156 . 19 1 1 A 97 97 TYR CA C 97 60.470 61.399 -0.929 1
1 1157 . 19 1 1 A 97 97 TYR CB C 97 38.612 38.430 0.182 1
1 1160 . 19 1 1 A 97 97 TYR N N 97 122.246 121.335 0.911 1
1 1161 . 19 1 1 A 98 98 GLN H H 98 8.087 8.789 -0.702 1
1 1162 . 19 1 1 A 98 98 GLN HA H 98 3.793 3.711 0.082 1
1 1169 . 19 1 1 A 98 98 GLN C C 98 175.549 177.720 -2.171 1
1 1170 . 19 1 1 A 98 98 GLN CA C 98 57.365 58.544 -1.179 1
1 1171 . 19 1 1 A 98 98 GLN CB C 98 28.901 28.910 -0.009 1
1 1173 . 19 1 1 A 98 98 GLN N N 98 118.769 119.569 -0.800 1
1 1175 . 19 1 1 A 99 99 SER H H 99 7.724 8.247 -0.523 1
1 1176 . 19 1 1 A 99 99 SER HA H 99 4.293 4.256 0.037 1
1 1179 . 19 1 1 A 99 99 SER C C 99 173.696 177.370 -3.674 1
1 1180 . 19 1 1 A 99 99 SER CA C 99 59.566 61.181 -1.615 1
1 1181 . 19 1 1 A 99 99 SER CB C 99 63.847 62.837 1.010 1
1 1182 . 19 1 1 A 99 99 SER N N 99 113.257 115.031 -1.774 1
1 1183 . 19 1 1 A 100 100 GLY H H 100 7.751 8.308 -0.557 1
1 1184 . 19 1 1 A 100 100 GLY HA2 H 100 3.813 3.850 -0.037 1
1 1185 . 19 1 1 A 100 100 GLY HA3 H 100 3.934 3.854 0.080 1
1 1186 . 19 1 1 A 100 100 GLY C C 100 172.643 176.220 -3.577 1
1 1187 . 19 1 1 A 100 100 GLY CA C 100 45.570 47.006 -1.436 1
1 1188 . 19 1 1 A 100 100 GLY N N 100 109.750 108.961 0.789 1
1 1189 . 19 1 1 A 101 101 ALA H H 101 7.824 7.859 -0.035 1
1 1190 . 19 1 1 A 101 101 ALA HA H 101 4.221 3.891 0.330 1
1 1194 . 19 1 1 A 101 101 ALA C C 101 175.639 178.644 -3.005 1
1 1195 . 19 1 1 A 101 101 ALA CA C 101 52.745 54.439 -1.694 1
1 1196 . 19 1 1 A 101 101 ALA CB C 101 19.437 18.588 0.849 1
1 1197 . 19 1 1 A 101 101 ALA N N 101 123.241 124.716 -1.475 1
1 1198 . 19 1 1 A 102 102 ASN H H 102 8.191 7.791 0.400 1
1 1199 . 19 1 1 A 102 102 ASN HA H 102 4.658 4.630 0.028 1
1 1204 . 19 1 1 A 102 102 ASN C C 102 173.337 175.082 -1.745 1
1 1205 . 19 1 1 A 102 102 ASN CA C 102 53.374 55.299 -1.925 1
1 1206 . 19 1 1 A 102 102 ASN CB C 102 38.819 39.277 -0.458 1
1 1207 . 19 1 1 A 102 102 ASN N N 102 116.572 116.552 0.020 1
1 1209 . 19 1 1 A 103 103 LEU H H 103 8.065 7.708 0.357 1
1 1210 . 19 1 1 A 103 103 LEU HA H 103 4.363 4.638 -0.275 1
1 1219 . 19 1 1 A 103 103 LEU C C 103 175.637 174.868 0.769 1
1 1220 . 19 1 1 A 103 103 LEU CA C 103 55.292 53.494 1.798 1
1 1221 . 19 1 1 A 103 103 LEU CB C 103 42.433 45.362 -2.929 1
1 1222 . 19 1 1 A 103 103 LEU N N 103 122.074 113.984 8.090 1
1 1223 . 19 1 1 A 104 104 VAL H H 104 8.055 9.084 -1.029 1
1 1224 . 19 1 1 A 104 104 VAL HA H 104 4.131 4.696 -0.565 1
1 1232 . 19 1 1 A 104 104 VAL C C 104 174.364 176.110 -1.746 1
1 1233 . 19 1 1 A 104 104 VAL CA C 104 62.552 61.448 1.104 1
1 1234 . 19 1 1 A 104 104 VAL CB C 104 32.766 32.108 0.658 1
1 1235 . 19 1 1 A 104 104 VAL N N 104 120.606 123.341 -2.735 1
1 1236 . 19 1 1 A 105 105 CYS H H 105 8.392 7.911 0.481 1
1 1237 . 19 1 1 A 105 105 CYS HA H 105 4.535 4.858 -0.323 1
1 1240 . 19 1 1 A 105 105 CYS C C 105 172.593 175.855 -3.262 1
1 1241 . 19 1 1 A 105 105 CYS CA C 105 58.449 57.974 0.475 1
1 1242 . 19 1 1 A 105 105 CYS CB C 105 27.952 29.026 -1.074 1
1 1243 . 19 1 1 A 105 105 CYS N N 105 122.791 126.502 -3.711 1
1 1244 . 19 1 1 A 106 106 ASN H H 106 8.575 8.386 0.189 1
1 1245 . 19 1 1 A 106 106 ASN HA H 106 4.843 4.679 0.164 1
1 1250 . 19 1 1 A 106 106 ASN C C 106 173.594 178.005 -4.411 1
1 1251 . 19 1 1 A 106 106 ASN CA C 106 53.337 54.975 -1.638 1
1 1252 . 19 1 1 A 106 106 ASN CB C 106 39.088 38.639 0.449 1
1 1253 . 19 1 1 A 106 106 ASN N N 106 122.001 120.394 1.607 1
1 1255 . 19 1 1 A 107 107 THR H H 107 8.090 8.087 0.003 1
1 1256 . 19 1 1 A 107 107 THR HA H 107 4.348 3.938 0.410 1
1 1261 . 19 1 1 A 107 107 THR C C 107 172.516 175.977 -3.461 1
1 1262 . 19 1 1 A 107 107 THR CA C 107 61.803 64.934 -3.131 1
1 1263 . 19 1 1 A 107 107 THR CB C 107 69.812 68.944 0.868 1
1 1265 . 19 1 1 A 107 107 THR N N 107 114.374 115.774 -1.400 1
1 1266 . 19 1 1 A 108 108 ARG H H 108 8.322 7.846 0.476 1
1 1267 . 19 1 1 A 108 108 ARG HA H 108 4.634 4.416 0.218 1
1 1274 . 19 1 1 A 108 108 ARG C C 108 172.608 177.751 -5.143 1
1 1275 . 19 1 1 A 108 108 ARG CA C 108 54.026 58.715 -4.689 1
1 1276 . 19 1 1 A 108 108 ARG CB C 108 30.246 31.350 -1.104 1
1 1278 . 19 1 1 A 108 108 ARG N N 108 124.017 121.287 2.730 1
1 1279 . 19 1 1 A 109 109 PRO HA H 109 4.354 4.442 -0.088 1
1 1286 . 19 1 1 A 109 109 PRO C C 109 174.978 178.864 -3.886 1
1 1287 . 19 1 1 A 109 109 PRO CA C 109 63.396 65.662 -2.266 1
1 1288 . 19 1 1 A 109 109 PRO CB C 109 32.046 31.306 0.740 1
1 1290 . 19 1 1 A 110 110 PHE H H 110 8.123 8.100 0.023 1
1 1291 . 19 1 1 A 110 110 PHE HA H 110 4.619 4.466 0.153 1
1 1296 . 19 1 1 A 110 110 PHE C C 110 173.856 176.878 -3.022 1
1 1297 . 19 1 1 A 110 110 PHE CA C 110 57.353 62.168 -4.815 1
1 1298 . 19 1 1 A 110 110 PHE CB C 110 39.364 39.095 0.269 1
1 1301 . 19 1 1 A 110 110 PHE N N 110 119.265 118.749 0.516 1
1 1302 . 19 1 1 A 111 111 ASP H H 111 8.161 8.714 -0.553 1
1 1303 . 19 1 1 A 111 111 ASP HA H 111 4.613 4.493 0.120 1
1 1306 . 19 1 1 A 111 111 ASP C C 111 174.114 178.781 -4.667 1
1 1307 . 19 1 1 A 111 111 ASP CA C 111 54.350 57.304 -2.954 1
1 1308 . 19 1 1 A 111 111 ASP CB C 111 41.413 40.380 1.033 1
1 1309 . 19 1 1 A 111 111 ASP N N 111 121.764 119.317 2.447 1
1 1310 . 19 1 1 A 112 112 ASN H H 112 8.307 8.732 -0.425 1
1 1311 . 19 1 1 A 112 112 ASN HA H 112 4.662 4.473 0.189 1
1 1316 . 19 1 1 A 112 112 ASN C C 112 173.595 178.035 -4.440 1
1 1317 . 19 1 1 A 112 112 ASN CA C 112 53.486 56.740 -3.254 1
1 1318 . 19 1 1 A 112 112 ASN CB C 112 39.225 38.850 0.375 1
1 1319 . 19 1 1 A 112 112 ASN N N 112 119.154 117.769 1.385 1
1 1321 . 19 1 1 A 113 113 GLU H H 113 8.404 8.441 -0.037 1
1 1322 . 19 1 1 A 113 113 GLU HA H 113 4.264 4.091 0.173 1
1 1327 . 19 1 1 A 113 113 GLU C C 113 174.886 178.856 -3.970 1
1 1328 . 19 1 1 A 113 113 GLU CA C 113 56.681 59.108 -2.427 1
1 1329 . 19 1 1 A 113 113 GLU CB C 113 30.403 29.194 1.209 1
1 1331 . 19 1 1 A 113 113 GLU N N 113 120.943 119.623 1.320 1
1 1332 . 19 1 1 A 114 114 GLU H H 114 8.388 8.503 -0.115 1
1 1333 . 19 1 1 A 114 114 GLU HA H 114 4.262 4.206 0.056 1
1 1338 . 19 1 1 A 114 114 GLU C C 114 174.819 179.439 -4.620 1
1 1339 . 19 1 1 A 114 114 GLU CA C 114 56.769 59.382 -2.613 1
1 1340 . 19 1 1 A 114 114 GLU CB C 114 30.125 29.412 0.713 1
1 1342 . 19 1 1 A 114 114 GLU N N 114 121.869 119.740 2.129 1
1 1343 . 19 1 1 A 115 115 LYS H H 115 8.236 7.971 0.265 1
1 1344 . 19 1 1 A 115 115 LYS HA H 115 4.347 4.095 0.252 1
1 1353 . 19 1 1 A 115 115 LYS C C 115 174.633 176.555 -1.922 1
1 1354 . 19 1 1 A 115 115 LYS CA C 115 56.426 59.378 -2.952 1
1 1355 . 19 1 1 A 115 115 LYS CB C 115 33.277 32.661 0.616 1
1 1359 . 19 1 1 A 115 115 LYS N N 115 121.997 119.275 2.722 1
1 1360 . 19 1 1 A 116 116 ASP H H 116 8.386 8.461 -0.075 1
1 1361 . 19 1 1 A 116 116 ASP HA H 116 4.600 4.273 0.327 1
1 1364 . 19 1 1 A 116 116 ASP C C 116 173.448 175.061 -1.613 1
1 1365 . 19 1 1 A 116 116 ASP CA C 116 54.773 55.409 -0.636 1
1 1366 . 19 1 1 A 116 116 ASP CB C 116 41.029 40.121 0.908 1
1 1367 . 19 1 1 A 116 116 ASP N N 116 121.057 119.301 1.756 1
1 5 . 20 1 1 A 2 2 MET HA H 2 4.534 4.191 0.343 1
1 13 . 20 1 1 A 2 2 MET C C 2 174.355 178.423 -4.068 1
1 14 . 20 1 1 A 2 2 MET CA C 2 56.247 58.416 -2.169 1
1 15 . 20 1 1 A 2 2 MET CB C 2 32.855 32.035 0.820 1
1 18 . 20 1 1 A 3 3 ASN H H 3 8.600 8.321 0.279 1
1 19 . 20 1 1 A 3 3 ASN HA H 3 4.711 4.489 0.222 1
1 24 . 20 1 1 A 3 3 ASN C C 3 173.983 177.652 -3.669 1
1 25 . 20 1 1 A 3 3 ASN CA C 3 53.650 56.691 -3.041 1
1 26 . 20 1 1 A 3 3 ASN CB C 3 38.624 40.069 -1.445 1
1 27 . 20 1 1 A 3 3 ASN N N 3 120.149 118.827 1.322 1
1 29 . 20 1 1 A 4 4 GLU H H 4 8.495 8.113 0.382 1
1 30 . 20 1 1 A 4 4 GLU HA H 4 4.235 4.078 0.157 1
1 35 . 20 1 1 A 4 4 GLU C C 4 175.752 178.949 -3.197 1
1 36 . 20 1 1 A 4 4 GLU CA C 4 58.075 59.183 -1.108 1
1 37 . 20 1 1 A 4 4 GLU CB C 4 30.125 29.578 0.547 1
1 38 . 20 1 1 A 4 4 GLU N N 4 121.543 118.783 2.760 1
1 39 . 20 1 1 A 5 5 LEU HA H 5 4.073 4.167 -0.094 1
1 47 . 20 1 1 A 5 5 LEU CB C 5 41.897 42.394 -0.497 1
1 50 . 20 1 1 A 6 6 GLU H H 6 8.332 8.264 0.068 1
1 51 . 20 1 1 A 6 6 GLU HA H 6 3.621 4.285 -0.664 1
1 52 . 20 1 1 A 6 6 GLU C C 6 176.402 178.477 -2.075 1
1 53 . 20 1 1 A 6 6 GLU CA C 6 58.461 57.881 0.580 1
1 54 . 20 1 1 A 6 6 GLU CB C 6 29.730 29.639 0.091 1
1 55 . 20 1 1 A 6 6 GLU N N 6 121.462 118.579 2.883 1
1 56 . 20 1 1 A 7 7 ALA H H 7 8.244 7.669 0.575 1
1 57 . 20 1 1 A 7 7 ALA HA H 7 4.185 4.075 0.110 1
1 61 . 20 1 1 A 7 7 ALA C C 7 177.982 178.088 -0.106 1
1 62 . 20 1 1 A 7 7 ALA CA C 7 54.791 55.120 -0.329 1
1 63 . 20 1 1 A 7 7 ALA CB C 7 18.836 18.862 -0.026 1
1 64 . 20 1 1 A 7 7 ALA N N 7 123.078 122.184 0.894 1
1 65 . 20 1 1 A 8 8 GLN H H 8 8.274 7.505 0.769 1
1 66 . 20 1 1 A 8 8 GLN HA H 8 4.219 4.835 -0.616 1
1 73 . 20 1 1 A 8 8 GLN C C 8 176.325 175.169 1.156 1
1 74 . 20 1 1 A 8 8 GLN CA C 8 57.864 54.840 3.024 1
1 75 . 20 1 1 A 8 8 GLN CB C 8 28.768 30.643 -1.875 1
1 77 . 20 1 1 A 8 8 GLN N N 8 117.452 116.042 1.410 1
1 79 . 20 1 1 A 9 9 THR H H 9 8.043 8.718 -0.675 1
1 80 . 20 1 1 A 9 9 THR HA H 9 3.998 4.939 -0.941 1
1 85 . 20 1 1 A 9 9 THR C C 9 173.904 174.920 -1.016 1
1 86 . 20 1 1 A 9 9 THR CA C 9 65.435 60.550 4.885 1
1 87 . 20 1 1 A 9 9 THR CB C 9 68.870 71.286 -2.416 1
1 89 . 20 1 1 A 9 9 THR N N 9 116.135 118.060 -1.925 1
1 90 . 20 1 1 A 10 10 ARG H H 10 8.095 9.033 -0.938 1
1 91 . 20 1 1 A 10 10 ARG HA H 10 4.040 4.117 -0.077 1
1 98 . 20 1 1 A 10 10 ARG C C 10 176.583 176.189 0.394 1
1 99 . 20 1 1 A 10 10 ARG CA C 10 59.262 57.523 1.739 1
1 100 . 20 1 1 A 10 10 ARG CB C 10 29.900 30.124 -0.224 1
1 101 . 20 1 1 A 10 10 ARG N N 10 121.157 125.113 -3.956 1
1 102 . 20 1 1 A 11 11 VAL H H 11 7.657 7.938 -0.281 1
1 103 . 20 1 1 A 11 11 VAL HA H 11 3.769 4.404 -0.635 1
1 111 . 20 1 1 A 11 11 VAL C C 11 176.662 177.737 -1.075 1
1 112 . 20 1 1 A 11 11 VAL CA C 11 65.914 63.627 2.287 1
1 113 . 20 1 1 A 11 11 VAL CB C 11 31.745 33.566 -1.821 1
1 114 . 20 1 1 A 11 11 VAL N N 11 118.580 118.023 0.557 1
1 115 . 20 1 1 A 12 12 LYS H H 12 7.471 8.340 -0.869 1
1 116 . 20 1 1 A 12 12 LYS HA H 12 3.366 4.334 -0.968 1
1 123 . 20 1 1 A 12 12 LYS C C 12 176.457 179.160 -2.703 1
1 124 . 20 1 1 A 12 12 LYS CA C 12 59.545 58.903 0.642 1
1 125 . 20 1 1 A 12 12 LYS CB C 12 32.206 32.247 -0.041 1
1 126 . 20 1 1 A 12 12 LYS N N 12 121.835 122.427 -0.592 1
1 127 . 20 1 1 A 13 13 LEU H H 13 8.144 7.948 0.196 1
1 128 . 20 1 1 A 13 13 LEU HA H 13 4.093 4.009 0.084 1
1 137 . 20 1 1 A 13 13 LEU C C 13 178.254 178.883 -0.629 1
1 138 . 20 1 1 A 13 13 LEU CA C 13 58.023 57.873 0.150 1
1 139 . 20 1 1 A 13 13 LEU CB C 13 41.283 41.756 -0.473 1
1 140 . 20 1 1 A 13 13 LEU N N 13 118.688 120.538 -1.850 1
1 141 . 20 1 1 A 14 14 ASN H H 14 8.384 8.724 -0.340 1
1 142 . 20 1 1 A 14 14 ASN HA H 14 4.567 4.396 0.171 1
1 147 . 20 1 1 A 14 14 ASN C C 14 175.397 177.052 -1.655 1
1 148 . 20 1 1 A 14 14 ASN CA C 14 56.239 56.446 -0.207 1
1 149 . 20 1 1 A 14 14 ASN CB C 14 38.432 39.526 -1.094 1
1 150 . 20 1 1 A 14 14 ASN N N 14 118.175 117.899 0.276 1
1 152 . 20 1 1 A 15 15 TYR H H 15 7.982 8.201 -0.219 1
1 153 . 20 1 1 A 15 15 TYR HA H 15 4.249 4.102 0.147 1
1 160 . 20 1 1 A 15 15 TYR C C 15 175.503 177.311 -1.808 1
1 161 . 20 1 1 A 15 15 TYR CA C 15 62.450 61.485 0.965 1
1 162 . 20 1 1 A 15 15 TYR CB C 15 39.399 38.477 0.922 1
1 163 . 20 1 1 A 15 15 TYR N N 15 121.955 120.485 1.470 1
1 164 . 20 1 1 A 16 16 LEU H H 16 8.198 8.678 -0.480 1
1 165 . 20 1 1 A 16 16 LEU HA H 16 4.470 4.068 0.402 1
1 175 . 20 1 1 A 16 16 LEU C C 16 177.125 177.694 -0.569 1
1 176 . 20 1 1 A 16 16 LEU CA C 16 57.374 58.129 -0.755 1
1 177 . 20 1 1 A 16 16 LEU CB C 16 41.443 41.611 -0.168 1
1 178 . 20 1 1 A 16 16 LEU N N 16 117.642 121.380 -3.738 1
1 179 . 20 1 1 A 17 17 ASP H H 17 8.061 8.438 -0.377 1
1 180 . 20 1 1 A 17 17 ASP C C 17 177.836 178.417 -0.581 1
1 181 . 20 1 1 A 17 17 ASP CA C 17 57.486 57.912 -0.426 1
1 182 . 20 1 1 A 17 17 ASP CB C 17 41.433 42.286 -0.853 1
1 183 . 20 1 1 A 17 17 ASP N N 17 118.700 119.072 -0.372 1
1 184 . 20 1 1 A 18 18 GLN H H 18 8.111 7.773 0.338 1
1 185 . 20 1 1 A 18 18 GLN HA H 18 4.002 4.108 -0.106 1
1 190 . 20 1 1 A 18 18 GLN CA C 18 59.046 58.802 0.244 1
1 191 . 20 1 1 A 18 18 GLN CB C 18 28.700 28.324 0.376 1
1 193 . 20 1 1 A 18 18 GLN N N 18 119.539 118.868 0.671 1
1 195 . 20 1 1 A 19 19 ILE H H 19 8.330 8.138 0.192 1
1 196 . 20 1 1 A 19 19 ILE HA H 19 3.306 3.919 -0.613 1
1 204 . 20 1 1 A 19 19 ILE C C 19 175.608 177.467 -1.859 1
1 205 . 20 1 1 A 19 19 ILE CA C 19 64.760 63.109 1.651 1
1 206 . 20 1 1 A 19 19 ILE CB C 19 37.148 37.267 -0.119 1
1 209 . 20 1 1 A 19 19 ILE N N 19 121.490 120.093 1.397 1
1 210 . 20 1 1 A 20 20 ALA H H 20 8.057 7.918 0.139 1
1 211 . 20 1 1 A 20 20 ALA HA H 20 4.349 4.309 0.040 1
1 215 . 20 1 1 A 20 20 ALA C C 20 179.297 179.370 -0.073 1
1 216 . 20 1 1 A 20 20 ALA CA C 20 56.150 55.030 1.120 1
1 217 . 20 1 1 A 20 20 ALA CB C 20 18.104 18.826 -0.722 1
1 218 . 20 1 1 A 20 20 ALA N N 20 124.441 123.927 0.514 1
1 219 . 20 1 1 A 21 21 LYS H H 21 8.116 8.132 -0.016 1
1 220 . 20 1 1 A 21 21 LYS HA H 21 4.108 4.040 0.068 1
1 229 . 20 1 1 A 21 21 LYS C C 21 176.720 178.604 -1.884 1
1 230 . 20 1 1 A 21 21 LYS CA C 21 59.166 59.673 -0.507 1
1 231 . 20 1 1 A 21 21 LYS CB C 21 32.085 32.605 -0.520 1
1 233 . 20 1 1 A 21 21 LYS N N 21 119.865 119.290 0.575 1
1 234 . 20 1 1 A 22 22 PHE H H 22 7.875 8.229 -0.354 1
1 235 . 20 1 1 A 22 22 PHE HA H 22 4.012 4.125 -0.113 1
1 242 . 20 1 1 A 22 22 PHE C C 22 175.545 177.627 -2.082 1
1 243 . 20 1 1 A 22 22 PHE CA C 22 61.070 61.353 -0.283 1
1 244 . 20 1 1 A 22 22 PHE CB C 22 39.072 38.915 0.157 1
1 249 . 20 1 1 A 22 22 PHE N N 22 119.729 119.979 -0.250 1
1 250 . 20 1 1 A 23 23 TRP H H 23 7.841 8.119 -0.278 1
1 251 . 20 1 1 A 23 23 TRP HA H 23 4.149 4.141 0.008 1
1 260 . 20 1 1 A 23 23 TRP C C 23 176.668 178.605 -1.937 1
1 261 . 20 1 1 A 23 23 TRP CB C 23 28.543 29.718 -1.175 1
1 267 . 20 1 1 A 23 23 TRP N N 23 119.440 120.428 -0.988 1
1 269 . 20 1 1 A 24 24 GLU H H 24 8.261 8.513 -0.252 1
1 270 . 20 1 1 A 24 24 GLU HA H 24 4.265 4.422 -0.157 1
1 275 . 20 1 1 A 24 24 GLU C C 24 179.679 178.319 1.360 1
1 276 . 20 1 1 A 24 24 GLU CA C 24 59.706 58.848 0.858 1
1 277 . 20 1 1 A 24 24 GLU CB C 24 29.720 29.751 -0.031 1
1 279 . 20 1 1 A 24 24 GLU N N 24 121.376 117.956 3.420 1
1 280 . 20 1 1 A 25 25 ILE H H 25 8.071 8.168 -0.097 1
1 281 . 20 1 1 A 25 25 ILE HA H 25 3.815 3.896 -0.081 1
1 291 . 20 1 1 A 25 25 ILE C C 25 176.343 177.118 -0.775 1
1 292 . 20 1 1 A 25 25 ILE CA C 25 64.464 62.077 2.387 1
1 293 . 20 1 1 A 25 25 ILE CB C 25 37.371 37.336 0.035 1
1 296 . 20 1 1 A 25 25 ILE N N 25 121.499 120.077 1.422 1
1 297 . 20 1 1 A 26 26 GLN H H 26 7.327 7.451 -0.124 1
1 298 . 20 1 1 A 26 26 GLN HA H 26 4.074 4.210 -0.136 1
1 305 . 20 1 1 A 26 26 GLN C C 26 174.906 175.845 -0.939 1
1 306 . 20 1 1 A 26 26 GLN CA C 26 55.450 55.299 0.151 1
1 307 . 20 1 1 A 26 26 GLN CB C 26 28.458 28.909 -0.451 1
1 309 . 20 1 1 A 26 26 GLN N N 26 116.532 120.265 -3.733 1
1 311 . 20 1 1 A 27 27 GLY H H 27 7.861 8.529 -0.668 1
1 312 . 20 1 1 A 27 27 GLY HA2 H 27 4.297 3.728 0.569 1
1 313 . 20 1 1 A 27 27 GLY HA3 H 27 3.823 3.729 0.094 1
1 314 . 20 1 1 A 27 27 GLY C C 27 172.698 173.305 -0.607 1
1 315 . 20 1 1 A 27 27 GLY CA C 27 45.608 45.994 -0.386 1
1 316 . 20 1 1 A 27 27 GLY N N 27 106.837 108.901 -2.064 1
1 317 . 20 1 1 A 28 28 SER H H 28 8.083 7.233 0.850 1
1 318 . 20 1 1 A 28 28 SER HA H 28 4.777 4.724 0.053 1
1 321 . 20 1 1 A 28 28 SER C C 28 171.196 171.997 -0.801 1
1 322 . 20 1 1 A 28 28 SER CA C 28 56.041 56.752 -0.711 1
1 323 . 20 1 1 A 28 28 SER CB C 28 64.539 66.759 -2.220 1
1 324 . 20 1 1 A 28 28 SER N N 28 116.151 114.392 1.759 1
1 325 . 20 1 1 A 29 29 SER H H 29 8.354 8.426 -0.072 1
1 326 . 20 1 1 A 29 29 SER HA H 29 4.389 5.011 -0.622 1
1 329 . 20 1 1 A 29 29 SER C C 29 172.166 172.860 -0.694 1
1 330 . 20 1 1 A 29 29 SER CA C 29 58.107 56.551 1.556 1
1 331 . 20 1 1 A 29 29 SER CB C 29 63.853 66.025 -2.172 1
1 332 . 20 1 1 A 29 29 SER N N 29 116.596 114.237 2.359 1
1 333 . 20 1 1 A 30 30 LEU H H 30 8.990 8.533 0.457 1
1 334 . 20 1 1 A 30 30 LEU HA H 30 3.964 4.811 -0.847 1
1 344 . 20 1 1 A 30 30 LEU C C 30 173.752 175.796 -2.044 1
1 345 . 20 1 1 A 30 30 LEU CA C 30 55.193 54.740 0.453 1
1 346 . 20 1 1 A 30 30 LEU CB C 30 42.869 41.624 1.245 1
1 349 . 20 1 1 A 30 30 LEU N N 30 125.860 127.010 -1.150 1
1 350 . 20 1 1 A 31 31 LYS H H 31 8.118 8.807 -0.689 1
1 351 . 20 1 1 A 31 31 LYS HA H 31 4.498 4.752 -0.254 1
1 360 . 20 1 1 A 31 31 LYS C C 31 173.555 175.080 -1.525 1
1 361 . 20 1 1 A 31 31 LYS CA C 31 54.372 55.169 -0.797 1
1 362 . 20 1 1 A 31 31 LYS CB C 31 32.814 33.264 -0.450 1
1 365 . 20 1 1 A 31 31 LYS N N 31 129.965 127.743 2.222 1
1 366 . 20 1 1 A 32 32 ILE H H 32 8.717 8.527 0.190 1
1 367 . 20 1 1 A 32 32 ILE HA H 32 4.011 4.877 -0.866 1
1 377 . 20 1 1 A 32 32 ILE C C 32 173.038 174.821 -1.783 1
1 378 . 20 1 1 A 32 32 ILE CA C 32 59.921 58.312 1.609 1
1 379 . 20 1 1 A 32 32 ILE CB C 32 38.139 39.069 -0.930 1
1 382 . 20 1 1 A 32 32 ILE N N 32 127.091 122.602 4.489 1
1 383 . 20 1 1 A 33 33 PRO HA H 33 4.412 4.533 -0.121 1
1 390 . 20 1 1 A 33 33 PRO C C 33 172.724 175.790 -3.066 1
1 391 . 20 1 1 A 33 33 PRO CA C 33 62.565 62.259 0.306 1
1 392 . 20 1 1 A 33 33 PRO CB C 33 32.728 32.749 -0.021 1
1 394 . 20 1 1 A 34 34 ASN H H 34 8.265 8.489 -0.224 1
1 395 . 20 1 1 A 34 34 ASN HA H 34 5.147 5.533 -0.386 1
1 400 . 20 1 1 A 34 34 ASN C C 34 174.079 173.531 0.548 1
1 401 . 20 1 1 A 34 34 ASN CA C 34 52.088 51.569 0.519 1
1 402 . 20 1 1 A 34 34 ASN CB C 34 40.387 43.072 -2.685 1
1 403 . 20 1 1 A 34 34 ASN N N 34 116.424 114.811 1.613 1
1 405 . 20 1 1 A 35 35 VAL H H 35 8.904 9.037 -0.133 1
1 406 . 20 1 1 A 35 35 VAL HA H 35 4.159 4.450 -0.291 1
1 414 . 20 1 1 A 35 35 VAL C C 35 173.834 174.727 -0.893 1
1 415 . 20 1 1 A 35 35 VAL CA C 35 61.953 59.980 1.973 1
1 416 . 20 1 1 A 35 35 VAL CB C 35 34.432 34.670 -0.238 1
1 419 . 20 1 1 A 35 35 VAL N N 35 122.778 118.407 4.371 1
1 420 . 20 1 1 A 36 36 GLU H H 36 9.560 9.447 0.113 1
1 421 . 20 1 1 A 36 36 GLU HA H 36 3.819 4.023 -0.204 1
1 426 . 20 1 1 A 36 36 GLU C C 36 173.604 175.823 -2.219 1
1 427 . 20 1 1 A 36 36 GLU CA C 36 57.131 58.041 -0.910 1
1 428 . 20 1 1 A 36 36 GLU CB C 36 27.464 28.082 -0.618 1
1 430 . 20 1 1 A 36 36 GLU N N 36 127.014 128.681 -1.667 1
1 431 . 20 1 1 A 37 37 ARG H H 37 8.578 8.463 0.115 1
1 432 . 20 1 1 A 37 37 ARG HA H 37 3.792 3.893 -0.101 1
1 439 . 20 1 1 A 37 37 ARG C C 37 173.371 174.353 -0.982 1
1 440 . 20 1 1 A 37 37 ARG CA C 37 57.952 57.758 0.194 1
1 441 . 20 1 1 A 37 37 ARG CB C 37 27.657 27.624 0.033 1
1 443 . 20 1 1 A 37 37 ARG N N 37 108.362 110.734 -2.372 1
1 444 . 20 1 1 A 38 38 ARG H H 38 7.696 7.940 -0.244 1
1 445 . 20 1 1 A 38 38 ARG HA H 38 4.743 4.899 -0.156 1
1 452 . 20 1 1 A 38 38 ARG C C 38 173.513 175.681 -2.168 1
1 453 . 20 1 1 A 38 38 ARG CA C 38 54.507 55.056 -0.549 1
1 454 . 20 1 1 A 38 38 ARG CB C 38 33.751 32.621 1.130 1
1 456 . 20 1 1 A 38 38 ARG N N 38 118.370 119.807 -1.437 1
1 457 . 20 1 1 A 39 39 ILE H H 39 8.463 8.485 -0.022 1
1 458 . 20 1 1 A 39 39 ILE HA H 39 4.184 4.222 -0.038 1
1 468 . 20 1 1 A 39 39 ILE C C 39 175.150 175.784 -0.634 1
1 469 . 20 1 1 A 39 39 ILE CA C 39 62.076 62.111 -0.035 1
1 470 . 20 1 1 A 39 39 ILE CB C 39 38.864 39.447 -0.583 1
1 473 . 20 1 1 A 39 39 ILE N N 39 123.604 127.043 -3.439 1
1 474 . 20 1 1 A 40 40 LEU H H 40 8.239 8.252 -0.013 1
1 475 . 20 1 1 A 40 40 LEU HA H 40 4.259 4.566 -0.307 1
1 485 . 20 1 1 A 40 40 LEU C C 40 173.152 175.494 -2.342 1
1 486 . 20 1 1 A 40 40 LEU CA C 40 55.305 54.764 0.541 1
1 487 . 20 1 1 A 40 40 LEU CB C 40 43.113 41.795 1.318 1
1 490 . 20 1 1 A 40 40 LEU N N 40 129.550 129.012 0.538 1
1 491 . 20 1 1 A 41 41 ASP H H 41 8.992 8.445 0.547 1
1 492 . 20 1 1 A 41 41 ASP HA H 41 4.798 4.872 -0.074 1
1 495 . 20 1 1 A 41 41 ASP C C 41 173.837 176.400 -2.563 1
1 496 . 20 1 1 A 41 41 ASP CA C 41 52.077 53.637 -1.560 1
1 497 . 20 1 1 A 41 41 ASP CB C 41 39.454 39.936 -0.482 1
1 498 . 20 1 1 A 41 41 ASP N N 41 127.022 124.472 2.550 1
1 499 . 20 1 1 A 42 42 LEU H H 42 7.912 8.231 -0.319 1
1 500 . 20 1 1 A 42 42 LEU HA H 42 3.970 4.096 -0.126 1
1 510 . 20 1 1 A 42 42 LEU C C 42 176.305 177.504 -1.199 1
1 511 . 20 1 1 A 42 42 LEU CA C 42 58.128 58.200 -0.072 1
1 512 . 20 1 1 A 42 42 LEU CB C 42 43.043 41.639 1.404 1
1 514 . 20 1 1 A 42 42 LEU N N 42 125.064 125.933 -0.869 1
1 515 . 20 1 1 A 43 43 TYR H H 43 8.565 8.234 0.331 1
1 516 . 20 1 1 A 43 43 TYR HA H 43 3.728 3.781 -0.053 1
1 523 . 20 1 1 A 43 43 TYR C C 43 175.757 177.042 -1.285 1
1 524 . 20 1 1 A 43 43 TYR CA C 43 61.774 62.093 -0.319 1
1 525 . 20 1 1 A 43 43 TYR CB C 43 38.235 38.158 0.077 1
1 528 . 20 1 1 A 43 43 TYR N N 43 117.822 120.093 -2.271 1
1 529 . 20 1 1 A 44 44 SER H H 44 8.115 7.772 0.343 1
1 530 . 20 1 1 A 44 44 SER HA H 44 3.854 4.232 -0.378 1
1 533 . 20 1 1 A 44 44 SER C C 44 174.080 175.933 -1.853 1
1 534 . 20 1 1 A 44 44 SER CA C 44 61.873 61.831 0.042 1
1 535 . 20 1 1 A 44 44 SER CB C 44 64.350 62.935 1.415 1
1 536 . 20 1 1 A 44 44 SER N N 44 116.835 116.025 0.810 1
1 537 . 20 1 1 A 45 45 LEU H H 45 8.401 7.663 0.738 1
1 538 . 20 1 1 A 45 45 LEU HA H 45 4.102 4.154 -0.052 1
1 548 . 20 1 1 A 45 45 LEU C C 45 175.081 179.156 -4.075 1
1 549 . 20 1 1 A 45 45 LEU CA C 45 58.896 57.696 1.200 1
1 550 . 20 1 1 A 45 45 LEU CB C 45 41.741 41.767 -0.026 1
1 553 . 20 1 1 A 45 45 LEU N N 45 120.621 123.208 -2.587 1
1 554 . 20 1 1 A 46 46 SER H H 46 8.110 8.556 -0.446 1
1 555 . 20 1 1 A 46 46 SER HA H 46 4.300 4.223 0.077 1
1 558 . 20 1 1 A 46 46 SER C C 46 175.019 176.740 -1.721 1
1 559 . 20 1 1 A 46 46 SER CA C 46 62.610 61.992 0.618 1
1 560 . 20 1 1 A 46 46 SER CB C 46 64.092 63.029 1.063 1
1 561 . 20 1 1 A 46 46 SER N N 46 112.826 116.771 -3.945 1
1 562 . 20 1 1 A 47 47 LYS H H 47 7.732 8.123 -0.391 1
1 563 . 20 1 1 A 47 47 LYS HA H 47 3.900 4.158 -0.258 1
1 572 . 20 1 1 A 47 47 LYS C C 47 177.441 178.840 -1.399 1
1 573 . 20 1 1 A 47 47 LYS CA C 47 58.575 59.265 -0.690 1
1 574 . 20 1 1 A 47 47 LYS CB C 47 32.351 31.657 0.694 1
1 576 . 20 1 1 A 47 47 LYS N N 47 121.210 119.455 1.755 1
1 577 . 20 1 1 A 48 48 ILE H H 48 8.672 8.055 0.617 1
1 578 . 20 1 1 A 48 48 ILE HA H 48 3.628 3.783 -0.155 1
1 588 . 20 1 1 A 48 48 ILE C C 48 175.861 178.293 -2.432 1
1 589 . 20 1 1 A 48 48 ILE CA C 48 64.188 64.710 -0.522 1
1 590 . 20 1 1 A 48 48 ILE CB C 48 37.954 37.799 0.155 1
1 593 . 20 1 1 A 48 48 ILE N N 48 120.810 121.464 -0.654 1
1 594 . 20 1 1 A 49 49 VAL H H 49 8.030 8.371 -0.341 1
1 595 . 20 1 1 A 49 49 VAL HA H 49 3.195 3.643 -0.448 1
1 603 . 20 1 1 A 49 49 VAL C C 49 176.513 178.418 -1.905 1
1 604 . 20 1 1 A 49 49 VAL CA C 49 66.760 66.679 0.081 1
1 605 . 20 1 1 A 49 49 VAL CB C 49 30.935 31.784 -0.849 1
1 608 . 20 1 1 A 49 49 VAL N N 49 119.350 119.578 -0.228 1
1 609 . 20 1 1 A 50 50 VAL H H 50 7.336 8.284 -0.948 1
1 610 . 20 1 1 A 50 50 VAL HA H 50 3.497 3.663 -0.166 1
1 618 . 20 1 1 A 50 50 VAL C C 50 178.745 178.221 0.524 1
1 619 . 20 1 1 A 50 50 VAL CA C 50 67.384 66.640 0.744 1
1 620 . 20 1 1 A 50 50 VAL CB C 50 31.832 31.640 0.192 1
1 621 . 20 1 1 A 50 50 VAL N N 50 118.610 121.179 -2.569 1
1 622 . 20 1 1 A 51 51 GLU H H 51 8.318 8.516 -0.198 1
1 623 . 20 1 1 A 51 51 GLU HA H 51 3.953 3.959 -0.006 1
1 628 . 20 1 1 A 51 51 GLU C C 51 177.281 179.193 -1.912 1
1 629 . 20 1 1 A 51 51 GLU CA C 51 59.668 59.765 -0.097 1
1 630 . 20 1 1 A 51 51 GLU CB C 51 30.131 29.189 0.942 1
1 632 . 20 1 1 A 51 51 GLU N N 51 122.096 120.154 1.942 1
1 633 . 20 1 1 A 52 52 GLU H H 52 8.065 8.205 -0.140 1
1 634 . 20 1 1 A 52 52 GLU HA H 52 4.229 4.235 -0.006 1
1 639 . 20 1 1 A 52 52 GLU C C 52 173.534 176.755 -3.221 1
1 640 . 20 1 1 A 52 52 GLU CA C 52 55.547 56.516 -0.969 1
1 641 . 20 1 1 A 52 52 GLU CB C 52 28.716 29.919 -1.203 1
1 643 . 20 1 1 A 52 52 GLU N N 52 114.992 116.033 -1.041 1
1 644 . 20 1 1 A 53 53 GLY H H 53 7.459 9.356 -1.897 1
1 645 . 20 1 1 A 53 53 GLY HA2 H 53 3.630 3.942 -0.312 1
1 646 . 20 1 1 A 53 53 GLY HA3 H 53 3.630 3.962 -0.332 1
1 647 . 20 1 1 A 53 53 GLY C C 53 173.214 173.732 -0.518 1
1 648 . 20 1 1 A 53 53 GLY CA C 53 44.962 45.072 -0.110 1
1 649 . 20 1 1 A 53 53 GLY N N 53 104.909 108.070 -3.161 1
1 650 . 20 1 1 A 54 54 GLY H H 54 8.533 7.671 0.862 1
1 651 . 20 1 1 A 54 54 GLY HA2 H 54 3.548 4.073 -0.525 1
1 652 . 20 1 1 A 54 54 GLY HA3 H 54 4.521 4.122 0.399 1
1 653 . 20 1 1 A 54 54 GLY C C 54 169.966 174.627 -4.661 1
1 654 . 20 1 1 A 54 54 GLY CA C 54 43.988 45.682 -1.694 1
1 655 . 20 1 1 A 54 54 GLY N N 54 110.587 108.433 2.154 1
1 656 . 20 1 1 A 55 55 TYR H H 55 8.704 8.961 -0.257 1
1 657 . 20 1 1 A 55 55 TYR HA H 55 3.618 3.986 -0.368 1
1 664 . 20 1 1 A 55 55 TYR C C 55 174.807 177.264 -2.457 1
1 665 . 20 1 1 A 55 55 TYR CA C 55 62.540 61.602 0.938 1
1 666 . 20 1 1 A 55 55 TYR CB C 55 39.669 39.361 0.308 1
1 669 . 20 1 1 A 55 55 TYR N N 55 119.168 123.621 -4.453 1
1 670 . 20 1 1 A 56 56 GLU H H 56 9.006 8.413 0.593 1
1 671 . 20 1 1 A 56 56 GLU HA H 56 3.638 3.650 -0.012 1
1 676 . 20 1 1 A 56 56 GLU C C 56 177.400 177.981 -0.581 1
1 677 . 20 1 1 A 56 56 GLU CA C 56 60.530 59.640 0.890 1
1 678 . 20 1 1 A 56 56 GLU CB C 56 29.168 29.732 -0.564 1
1 679 . 20 1 1 A 56 56 GLU N N 56 118.969 119.387 -0.418 1
1 680 . 20 1 1 A 57 57 ALA H H 57 8.235 7.734 0.501 1
1 681 . 20 1 1 A 57 57 ALA HA H 57 3.980 4.009 -0.029 1
1 685 . 20 1 1 A 57 57 ALA C C 57 177.678 179.749 -2.071 1
1 686 . 20 1 1 A 57 57 ALA CA C 57 54.910 55.057 -0.147 1
1 687 . 20 1 1 A 57 57 ALA CB C 57 18.122 18.131 -0.009 1
1 688 . 20 1 1 A 57 57 ALA N N 57 122.860 121.849 1.011 1
1 689 . 20 1 1 A 58 58 ILE H H 58 7.831 7.605 0.226 1
1 690 . 20 1 1 A 58 58 ILE HA H 58 3.189 3.231 -0.042 1
1 700 . 20 1 1 A 58 58 ILE C C 58 177.818 177.048 0.770 1
1 701 . 20 1 1 A 58 58 ILE CA C 58 65.074 64.849 0.225 1
1 702 . 20 1 1 A 58 58 ILE CB C 58 38.178 36.940 1.238 1
1 706 . 20 1 1 A 58 58 ILE N N 58 117.418 119.487 -2.069 1
1 707 . 20 1 1 A 59 59 CYS H H 59 7.760 7.936 -0.176 1
1 708 . 20 1 1 A 59 59 CYS HA H 59 4.203 4.029 0.174 1
1 711 . 20 1 1 A 59 59 CYS C C 59 176.357 176.981 -0.624 1
1 712 . 20 1 1 A 59 59 CYS CA C 59 63.760 62.546 1.214 1
1 713 . 20 1 1 A 59 59 CYS CB C 59 27.638 26.611 1.027 1
1 714 . 20 1 1 A 59 59 CYS N N 59 115.302 120.848 -5.546 1
1 715 . 20 1 1 A 60 60 LYS H H 60 8.350 7.986 0.364 1
1 716 . 20 1 1 A 60 60 LYS HA H 60 3.972 3.995 -0.023 1
1 725 . 20 1 1 A 60 60 LYS C C 60 176.373 177.159 -0.786 1
1 726 . 20 1 1 A 60 60 LYS CA C 60 59.796 58.898 0.898 1
1 727 . 20 1 1 A 60 60 LYS CB C 60 32.560 31.898 0.662 1
1 729 . 20 1 1 A 60 60 LYS N N 60 122.343 119.920 2.423 1
1 730 . 20 1 1 A 61 61 ASP H H 61 8.157 7.649 0.508 1
1 731 . 20 1 1 A 61 61 ASP HA H 61 4.616 4.659 -0.043 1
1 734 . 20 1 1 A 61 61 ASP C C 61 173.246 175.521 -2.275 1
1 735 . 20 1 1 A 61 61 ASP CA C 61 54.272 53.657 0.615 1
1 736 . 20 1 1 A 61 61 ASP CB C 61 41.023 40.936 0.087 1
1 737 . 20 1 1 A 61 61 ASP N N 61 116.173 117.328 -1.155 1
1 738 . 20 1 1 A 62 62 ARG H H 62 7.655 7.574 0.081 1
1 739 . 20 1 1 A 62 62 ARG HA H 62 4.149 3.942 0.207 1
1 746 . 20 1 1 A 62 62 ARG C C 62 175.891 176.096 -0.205 1
1 747 . 20 1 1 A 62 62 ARG CA C 62 57.381 57.040 0.341 1
1 748 . 20 1 1 A 62 62 ARG CB C 62 26.538 27.022 -0.484 1
1 750 . 20 1 1 A 62 62 ARG N N 62 117.213 115.899 1.314 1
1 751 . 20 1 1 A 63 63 ARG H H 63 8.302 7.931 0.371 1
1 752 . 20 1 1 A 63 63 ARG HA H 63 4.240 4.168 0.072 1
1 757 . 20 1 1 A 63 63 ARG C C 63 175.775 178.002 -2.227 1
1 758 . 20 1 1 A 63 63 ARG CA C 63 55.718 56.886 -1.168 1
1 760 . 20 1 1 A 63 63 ARG N N 63 116.292 117.032 -0.740 1
1 761 . 20 1 1 A 64 64 TRP H H 64 8.161 7.514 0.647 1
1 762 . 20 1 1 A 64 64 TRP HA H 64 3.836 4.386 -0.550 1
1 771 . 20 1 1 A 64 64 TRP C C 64 176.862 178.559 -1.697 1
1 772 . 20 1 1 A 64 64 TRP CA C 64 62.036 59.706 2.330 1
1 773 . 20 1 1 A 64 64 TRP CB C 64 27.028 29.080 -2.052 1
1 779 . 20 1 1 A 64 64 TRP N N 64 121.486 119.924 1.562 1
1 781 . 20 1 1 A 65 65 ALA H H 65 8.954 8.307 0.647 1
1 782 . 20 1 1 A 65 65 ALA HA H 65 4.290 4.087 0.203 1
1 786 . 20 1 1 A 65 65 ALA C C 65 178.986 179.478 -0.492 1
1 787 . 20 1 1 A 65 65 ALA CA C 65 55.314 55.396 -0.082 1
1 788 . 20 1 1 A 65 65 ALA CB C 65 18.119 18.165 -0.046 1
1 789 . 20 1 1 A 65 65 ALA N N 65 121.559 122.539 -0.980 1
1 790 . 20 1 1 A 66 66 ARG H H 66 7.473 7.587 -0.114 1
1 791 . 20 1 1 A 66 66 ARG HA H 66 4.221 4.150 0.071 1
1 798 . 20 1 1 A 66 66 ARG C C 66 176.670 178.338 -1.668 1
1 799 . 20 1 1 A 66 66 ARG CA C 66 57.871 58.628 -0.757 1
1 800 . 20 1 1 A 66 66 ARG CB C 66 29.097 29.647 -0.550 1
1 801 . 20 1 1 A 66 66 ARG N N 66 119.915 117.113 2.802 1
1 802 . 20 1 1 A 67 67 VAL H H 67 7.134 7.725 -0.591 1
1 803 . 20 1 1 A 67 67 VAL HA H 67 3.304 3.611 -0.307 1
1 811 . 20 1 1 A 67 67 VAL C C 67 175.341 177.869 -2.528 1
1 812 . 20 1 1 A 67 67 VAL CA C 67 66.722 66.677 0.045 1
1 813 . 20 1 1 A 67 67 VAL CB C 67 31.108 31.869 -0.761 1
1 816 . 20 1 1 A 67 67 VAL N N 67 119.970 120.965 -0.995 1
1 817 . 20 1 1 A 68 68 ALA H H 68 7.745 8.579 -0.834 1
1 818 . 20 1 1 A 68 68 ALA HA H 68 4.076 4.064 0.012 1
1 822 . 20 1 1 A 68 68 ALA C C 68 177.358 179.294 -1.936 1
1 823 . 20 1 1 A 68 68 ALA CA C 68 55.607 55.789 -0.182 1
1 824 . 20 1 1 A 68 68 ALA CB C 68 18.061 18.249 -0.188 1
1 825 . 20 1 1 A 68 68 ALA N N 68 118.239 122.141 -3.902 1
1 826 . 20 1 1 A 69 69 GLN H H 69 7.979 8.123 -0.144 1
1 827 . 20 1 1 A 69 69 GLN HA H 69 4.310 3.984 0.326 1
1 834 . 20 1 1 A 69 69 GLN C C 69 179.370 177.828 1.542 1
1 835 . 20 1 1 A 69 69 GLN CA C 69 59.307 59.211 0.096 1
1 836 . 20 1 1 A 69 69 GLN CB C 69 29.257 28.485 0.772 1
1 838 . 20 1 1 A 69 69 GLN N N 69 118.484 117.672 0.812 1
1 840 . 20 1 1 A 70 70 ARG H H 70 8.374 8.032 0.342 1
1 841 . 20 1 1 A 70 70 ARG HA H 70 4.148 4.041 0.107 1
1 848 . 20 1 1 A 70 70 ARG C C 70 175.850 178.161 -2.311 1
1 849 . 20 1 1 A 70 70 ARG CA C 70 58.957 58.911 0.046 1
1 850 . 20 1 1 A 70 70 ARG CB C 70 29.799 29.978 -0.179 1
1 852 . 20 1 1 A 70 70 ARG N N 70 120.309 119.473 0.836 1
1 853 . 20 1 1 A 71 71 LEU H H 71 7.413 7.692 -0.279 1
1 854 . 20 1 1 A 71 71 LEU HA H 71 4.341 4.151 0.190 1
1 864 . 20 1 1 A 71 71 LEU C C 71 173.391 175.866 -2.475 1
1 865 . 20 1 1 A 71 71 LEU CA C 71 54.911 54.511 0.400 1
1 866 . 20 1 1 A 71 71 LEU CB C 71 42.693 41.308 1.385 1
1 867 . 20 1 1 A 71 71 LEU N N 71 118.841 117.542 1.299 1
1 868 . 20 1 1 A 72 72 ASN H H 72 8.038 7.960 0.078 1
1 869 . 20 1 1 A 72 72 ASN HA H 72 4.394 4.402 -0.008 1
1 874 . 20 1 1 A 72 72 ASN C C 72 173.042 174.088 -1.046 1
1 875 . 20 1 1 A 72 72 ASN CB C 72 36.412 36.035 0.377 1
1 876 . 20 1 1 A 72 72 ASN N N 72 112.919 116.224 -3.305 1
1 878 . 20 1 1 A 73 73 TYR H H 73 7.874 7.973 -0.099 1
1 879 . 20 1 1 A 73 73 TYR HA H 73 4.868 4.634 0.234 1
1 886 . 20 1 1 A 73 73 TYR C C 73 172.194 173.907 -1.713 1
1 887 . 20 1 1 A 73 73 TYR CA C 73 57.105 56.335 0.770 1
1 888 . 20 1 1 A 73 73 TYR CB C 73 37.918 38.489 -0.571 1
1 889 . 20 1 1 A 73 73 TYR N N 73 117.432 119.628 -2.196 1
1 897 . 20 1 1 A 75 75 PRO HA H 75 4.626 4.424 0.202 1
1 902 . 20 1 1 A 75 75 PRO C C 75 175.728 177.046 -1.318 1
1 903 . 20 1 1 A 75 75 PRO CA C 75 62.502 63.302 -0.800 1
1 904 . 20 1 1 A 75 75 PRO CB C 75 32.339 32.551 -0.212 1
1 905 . 20 1 1 A 76 76 GLY H H 76 8.369 8.811 -0.442 1
1 906 . 20 1 1 A 76 76 GLY HA2 H 76 4.057 3.930 0.127 1
1 907 . 20 1 1 A 76 76 GLY HA3 H 76 4.556 3.930 0.626 1
1 908 . 20 1 1 A 76 76 GLY C C 76 173.248 174.630 -1.382 1
1 909 . 20 1 1 A 76 76 GLY CA C 76 46.180 45.681 0.499 1
1 910 . 20 1 1 A 76 76 GLY N N 76 106.185 110.688 -4.503 1
1 911 . 20 1 1 A 77 77 LYS H H 77 8.632 8.559 0.073 1
1 912 . 20 1 1 A 77 77 LYS HA H 77 4.433 4.123 0.310 1
1 921 . 20 1 1 A 77 77 LYS C C 77 174.924 176.513 -1.589 1
1 922 . 20 1 1 A 77 77 LYS CA C 77 56.453 57.405 -0.952 1
1 923 . 20 1 1 A 77 77 LYS CB C 77 33.170 30.180 2.990 1
1 925 . 20 1 1 A 77 77 LYS N N 77 119.592 118.089 1.503 1
1 926 . 20 1 1 A 78 78 ASN H H 78 8.865 8.089 0.776 1
1 927 . 20 1 1 A 78 78 ASN HA H 78 4.654 4.532 0.122 1
1 932 . 20 1 1 A 78 78 ASN C C 78 174.869 177.318 -2.449 1
1 933 . 20 1 1 A 78 78 ASN CA C 78 54.117 55.998 -1.881 1
1 934 . 20 1 1 A 78 78 ASN CB C 78 37.841 38.629 -0.788 1
1 935 . 20 1 1 A 78 78 ASN N N 78 116.880 119.422 -2.542 1
1 937 . 20 1 1 A 79 79 ILE H H 79 8.008 8.141 -0.133 1
1 938 . 20 1 1 A 79 79 ILE HA H 79 3.718 3.832 -0.114 1
1 948 . 20 1 1 A 79 79 ILE C C 79 175.921 178.313 -2.392 1
1 949 . 20 1 1 A 79 79 ILE CA C 79 63.618 64.554 -0.936 1
1 950 . 20 1 1 A 79 79 ILE CB C 79 37.158 37.443 -0.285 1
1 952 . 20 1 1 A 79 79 ILE N N 79 119.688 119.479 0.209 1
1 953 . 20 1 1 A 80 80 GLY H H 80 9.062 8.323 0.739 1
1 954 . 20 1 1 A 80 80 GLY HA2 H 80 3.739 3.814 -0.075 1
1 955 . 20 1 1 A 80 80 GLY HA3 H 80 3.739 3.858 -0.119 1
1 956 . 20 1 1 A 80 80 GLY C C 80 173.185 176.256 -3.071 1
1 957 . 20 1 1 A 80 80 GLY CA C 80 48.166 47.648 0.518 1
1 958 . 20 1 1 A 80 80 GLY N N 80 110.338 109.469 0.869 1
1 959 . 20 1 1 A 81 81 SER H H 81 7.460 7.741 -0.281 1
1 960 . 20 1 1 A 81 81 SER HA H 81 3.904 4.032 -0.128 1
1 963 . 20 1 1 A 81 81 SER C C 81 174.999 176.470 -1.471 1
1 964 . 20 1 1 A 81 81 SER CA C 81 61.138 61.402 -0.264 1
1 965 . 20 1 1 A 81 81 SER CB C 81 62.740 62.490 0.250 1
1 966 . 20 1 1 A 81 81 SER N N 81 115.348 116.874 -1.526 1
1 967 . 20 1 1 A 82 82 LEU H H 82 7.367 7.910 -0.543 1
1 968 . 20 1 1 A 82 82 LEU HA H 82 3.946 3.809 0.137 1
1 977 . 20 1 1 A 82 82 LEU C C 82 176.969 177.894 -0.925 1
1 978 . 20 1 1 A 82 82 LEU CA C 82 57.504 57.810 -0.306 1
1 979 . 20 1 1 A 82 82 LEU CB C 82 42.185 41.242 0.943 1
1 980 . 20 1 1 A 82 82 LEU N N 82 124.267 124.081 0.186 1
1 981 . 20 1 1 A 83 83 LEU H H 83 8.330 8.336 -0.006 1
1 982 . 20 1 1 A 83 83 LEU HA H 83 3.924 3.836 0.088 1
1 991 . 20 1 1 A 83 83 LEU C C 83 176.303 178.175 -1.872 1
1 992 . 20 1 1 A 83 83 LEU CA C 83 58.067 58.165 -0.098 1
1 993 . 20 1 1 A 83 83 LEU CB C 83 41.061 41.717 -0.656 1
1 994 . 20 1 1 A 83 83 LEU N N 83 117.452 119.799 -2.347 1
1 995 . 20 1 1 A 84 84 ARG H H 84 7.651 8.052 -0.401 1
1 996 . 20 1 1 A 84 84 ARG HA H 84 2.230 3.547 -1.317 1
1 1003 . 20 1 1 A 84 84 ARG C C 84 175.902 178.210 -2.308 1
1 1004 . 20 1 1 A 84 84 ARG CA C 84 59.112 59.410 -0.298 1
1 1005 . 20 1 1 A 84 84 ARG CB C 84 28.579 29.782 -1.203 1
1 1007 . 20 1 1 A 84 84 ARG N N 84 119.586 119.689 -0.103 1
1 1008 . 20 1 1 A 85 85 SER H H 85 7.291 7.686 -0.395 1
1 1009 . 20 1 1 A 85 85 SER HA H 85 4.189 4.127 0.062 1
1 1012 . 20 1 1 A 85 85 SER C C 85 175.546 177.515 -1.969 1
1 1013 . 20 1 1 A 85 85 SER CA C 85 61.376 61.671 -0.295 1
1 1014 . 20 1 1 A 85 85 SER CB C 85 62.805 63.160 -0.355 1
1 1015 . 20 1 1 A 85 85 SER N N 85 112.921 114.002 -1.081 1
1 1016 . 20 1 1 A 86 86 HIS H H 86 8.156 8.066 0.090 1
1 1017 . 20 1 1 A 86 86 HIS HA H 86 4.782 4.200 0.582 1
1 1022 . 20 1 1 A 86 86 HIS C C 86 176.851 177.548 -0.697 1
1 1023 . 20 1 1 A 86 86 HIS CA C 86 58.898 59.538 -0.640 1
1 1024 . 20 1 1 A 86 86 HIS CB C 86 31.110 29.711 1.399 1
1 1027 . 20 1 1 A 86 86 HIS N N 86 119.258 118.940 0.318 1
1 1028 . 20 1 1 A 87 87 TYR H H 87 9.180 8.164 1.016 1
1 1029 . 20 1 1 A 87 87 TYR HA H 87 3.913 3.890 0.023 1
1 1036 . 20 1 1 A 87 87 TYR C C 87 176.841 177.415 -0.574 1
1 1037 . 20 1 1 A 87 87 TYR CA C 87 63.526 61.364 2.162 1
1 1038 . 20 1 1 A 87 87 TYR CB C 87 39.431 38.181 1.250 1
1 1041 . 20 1 1 A 87 87 TYR N N 87 120.625 119.834 0.791 1
1 1042 . 20 1 1 A 88 88 GLU H H 88 9.028 8.397 0.631 1
1 1043 . 20 1 1 A 88 88 GLU HA H 88 3.682 3.935 -0.253 1
1 1048 . 20 1 1 A 88 88 GLU C C 88 175.833 179.016 -3.183 1
1 1049 . 20 1 1 A 88 88 GLU CA C 88 59.730 60.032 -0.302 1
1 1050 . 20 1 1 A 88 88 GLU CB C 88 30.009 29.299 0.710 1
1 1052 . 20 1 1 A 88 88 GLU N N 88 119.531 119.915 -0.384 1
1 1053 . 20 1 1 A 89 89 ARG H H 89 8.052 7.725 0.327 1
1 1054 . 20 1 1 A 89 89 ARG HA H 89 4.292 4.280 0.012 1
1 1061 . 20 1 1 A 89 89 ARG C C 89 176.045 177.489 -1.444 1
1 1062 . 20 1 1 A 89 89 ARG CA C 89 58.538 58.718 -0.180 1
1 1063 . 20 1 1 A 89 89 ARG CB C 89 31.841 30.793 1.048 1
1 1065 . 20 1 1 A 89 89 ARG N N 89 114.741 118.300 -3.559 1
1 1066 . 20 1 1 A 90 90 ILE H H 90 8.141 7.430 0.711 1
1 1067 . 20 1 1 A 90 90 ILE HA H 90 4.296 3.891 0.405 1
1 1075 . 20 1 1 A 90 90 ILE C C 90 174.461 176.768 -2.307 1
1 1076 . 20 1 1 A 90 90 ILE CA C 90 63.649 62.718 0.931 1
1 1077 . 20 1 1 A 90 90 ILE CB C 90 40.626 39.326 1.300 1
1 1079 . 20 1 1 A 90 90 ILE N N 90 113.421 117.578 -4.157 1
1 1080 . 20 1 1 A 91 91 VAL H H 91 7.350 7.867 -0.517 1
1 1081 . 20 1 1 A 91 91 VAL HA H 91 4.144 3.544 0.600 1
1 1089 . 20 1 1 A 91 91 VAL C C 91 175.422 177.019 -1.597 1
1 1090 . 20 1 1 A 91 91 VAL CA C 91 65.042 64.420 0.622 1
1 1091 . 20 1 1 A 91 91 VAL CB C 91 33.215 31.270 1.945 1
1 1092 . 20 1 1 A 91 91 VAL N N 91 118.215 120.512 -2.297 1
1 1093 . 20 1 1 A 92 92 TYR H H 92 8.565 8.008 0.557 1
1 1094 . 20 1 1 A 92 92 TYR HA H 92 4.217 4.217 0.000 1
1 1099 . 20 1 1 A 92 92 TYR C C 92 171.495 175.042 -3.547 1
1 1100 . 20 1 1 A 92 92 TYR CA C 92 61.558 62.346 -0.788 1
1 1101 . 20 1 1 A 92 92 TYR CB C 92 36.757 37.108 -0.351 1
1 1102 . 20 1 1 A 92 92 TYR N N 92 121.370 121.777 -0.407 1
1 1103 . 20 1 1 A 93 93 PRO HA H 93 4.136 4.355 -0.219 1
1 1108 . 20 1 1 A 93 93 PRO C C 93 177.077 178.499 -1.422 1
1 1109 . 20 1 1 A 93 93 PRO CA C 93 66.037 66.043 -0.006 1
1 1110 . 20 1 1 A 93 93 PRO CB C 93 31.482 30.957 0.525 1
1 1111 . 20 1 1 A 94 94 TYR H H 94 6.517 7.671 -1.154 1
1 1112 . 20 1 1 A 94 94 TYR HA H 94 2.798 4.486 -1.688 1
1 1119 . 20 1 1 A 94 94 TYR C C 94 174.985 178.097 -3.112 1
1 1120 . 20 1 1 A 94 94 TYR CA C 94 59.356 59.794 -0.438 1
1 1121 . 20 1 1 A 94 94 TYR CB C 94 37.987 37.115 0.872 1
1 1124 . 20 1 1 A 94 94 TYR N N 94 115.987 117.430 -1.443 1
1 1125 . 20 1 1 A 95 95 GLU H H 95 8.205 8.298 -0.093 1
1 1126 . 20 1 1 A 95 95 GLU HA H 95 3.682 4.229 -0.547 1
1 1131 . 20 1 1 A 95 95 GLU C C 95 178.530 179.048 -0.518 1
1 1132 . 20 1 1 A 95 95 GLU CA C 95 58.910 59.732 -0.822 1
1 1133 . 20 1 1 A 95 95 GLU CB C 95 29.187 29.425 -0.238 1
1 1134 . 20 1 1 A 95 95 GLU N N 95 119.946 121.346 -1.400 1
1 1135 . 20 1 1 A 96 96 MET H H 96 8.248 7.899 0.349 1
1 1136 . 20 1 1 A 96 96 MET HA H 96 4.172 4.179 -0.007 1
1 1142 . 20 1 1 A 96 96 MET C C 96 176.874 178.068 -1.194 1
1 1143 . 20 1 1 A 96 96 MET CA C 96 57.159 59.120 -1.961 1
1 1144 . 20 1 1 A 96 96 MET CB C 96 31.829 32.123 -0.294 1
1 1146 . 20 1 1 A 96 96 MET N N 96 117.570 119.259 -1.689 1
1 1147 . 20 1 1 A 97 97 TYR H H 97 7.445 8.310 -0.865 1
1 1148 . 20 1 1 A 97 97 TYR HA H 97 4.248 3.975 0.273 1
1 1155 . 20 1 1 A 97 97 TYR C C 97 176.476 177.130 -0.654 1
1 1156 . 20 1 1 A 97 97 TYR CA C 97 60.470 61.895 -1.425 1
1 1157 . 20 1 1 A 97 97 TYR CB C 97 38.612 38.542 0.070 1
1 1160 . 20 1 1 A 97 97 TYR N N 97 122.246 120.874 1.372 1
1 1161 . 20 1 1 A 98 98 GLN H H 98 8.087 8.685 -0.598 1
1 1162 . 20 1 1 A 98 98 GLN HA H 98 3.793 3.680 0.113 1
1 1169 . 20 1 1 A 98 98 GLN C C 98 175.549 178.469 -2.920 1
1 1170 . 20 1 1 A 98 98 GLN CA C 98 57.365 59.053 -1.688 1
1 1171 . 20 1 1 A 98 98 GLN CB C 98 28.901 28.760 0.141 1
1 1173 . 20 1 1 A 98 98 GLN N N 98 118.769 119.594 -0.825 1
1 1175 . 20 1 1 A 99 99 SER H H 99 7.724 8.261 -0.537 1
1 1176 . 20 1 1 A 99 99 SER HA H 99 4.293 4.274 0.019 1
1 1179 . 20 1 1 A 99 99 SER C C 99 173.696 177.109 -3.413 1
1 1180 . 20 1 1 A 99 99 SER CA C 99 59.566 62.748 -3.182 1
1 1181 . 20 1 1 A 99 99 SER CB C 99 63.847 62.476 1.371 1
1 1182 . 20 1 1 A 99 99 SER N N 99 113.257 117.071 -3.814 1
1 1183 . 20 1 1 A 100 100 GLY H H 100 7.751 8.354 -0.603 1
1 1184 . 20 1 1 A 100 100 GLY HA2 H 100 3.813 3.858 -0.045 1
1 1185 . 20 1 1 A 100 100 GLY HA3 H 100 3.934 3.867 0.067 1
1 1186 . 20 1 1 A 100 100 GLY C C 100 172.643 176.136 -3.493 1
1 1187 . 20 1 1 A 100 100 GLY CA C 100 45.570 46.906 -1.336 1
1 1188 . 20 1 1 A 100 100 GLY N N 100 109.750 108.911 0.839 1
1 1189 . 20 1 1 A 101 101 ALA H H 101 7.824 7.831 -0.007 1
1 1190 . 20 1 1 A 101 101 ALA HA H 101 4.221 4.013 0.208 1
1 1194 . 20 1 1 A 101 101 ALA C C 101 175.639 178.893 -3.254 1
1 1195 . 20 1 1 A 101 101 ALA CA C 101 52.745 54.428 -1.683 1
1 1196 . 20 1 1 A 101 101 ALA CB C 101 19.437 18.511 0.926 1
1 1197 . 20 1 1 A 101 101 ALA N N 101 123.241 124.164 -0.923 1
1 1198 . 20 1 1 A 102 102 ASN H H 102 8.191 7.848 0.343 1
1 1199 . 20 1 1 A 102 102 ASN HA H 102 4.658 4.687 -0.029 1
1 1204 . 20 1 1 A 102 102 ASN C C 102 173.337 175.025 -1.688 1
1 1205 . 20 1 1 A 102 102 ASN CA C 102 53.374 54.934 -1.560 1
1 1206 . 20 1 1 A 102 102 ASN CB C 102 38.819 39.503 -0.684 1
1 1207 . 20 1 1 A 102 102 ASN N N 102 116.572 115.529 1.043 1
1 1209 . 20 1 1 A 103 103 LEU H H 103 8.065 7.704 0.361 1
1 1210 . 20 1 1 A 103 103 LEU HA H 103 4.363 4.678 -0.315 1
1 1219 . 20 1 1 A 103 103 LEU C C 103 175.637 174.775 0.862 1
1 1220 . 20 1 1 A 103 103 LEU CA C 103 55.292 53.749 1.543 1
1 1221 . 20 1 1 A 103 103 LEU CB C 103 42.433 45.096 -2.663 1
1 1222 . 20 1 1 A 103 103 LEU N N 103 122.074 113.909 8.165 1
1 1223 . 20 1 1 A 104 104 VAL H H 104 8.055 8.719 -0.664 1
1 1224 . 20 1 1 A 104 104 VAL HA H 104 4.131 4.701 -0.570 1
1 1232 . 20 1 1 A 104 104 VAL C C 104 174.364 176.230 -1.866 1
1 1233 . 20 1 1 A 104 104 VAL CA C 104 62.552 60.164 2.388 1
1 1234 . 20 1 1 A 104 104 VAL CB C 104 32.766 34.491 -1.725 1
1 1235 . 20 1 1 A 104 104 VAL N N 104 120.606 118.930 1.676 1
1 1236 . 20 1 1 A 105 105 CYS H H 105 8.392 8.890 -0.498 1
1 1237 . 20 1 1 A 105 105 CYS HA H 105 4.535 4.445 0.090 1
1 1240 . 20 1 1 A 105 105 CYS C C 105 172.593 175.211 -2.618 1
1 1241 . 20 1 1 A 105 105 CYS CA C 105 58.449 60.166 -1.717 1
1 1242 . 20 1 1 A 105 105 CYS CB C 105 27.952 28.825 -0.873 1
1 1243 . 20 1 1 A 105 105 CYS N N 105 122.791 127.469 -4.678 1
1 1244 . 20 1 1 A 106 106 ASN H H 106 8.575 8.254 0.321 1
1 1245 . 20 1 1 A 106 106 ASN HA H 106 4.843 4.733 0.110 1
1 1250 . 20 1 1 A 106 106 ASN C C 106 173.594 176.490 -2.896 1
1 1251 . 20 1 1 A 106 106 ASN CA C 106 53.337 52.595 0.742 1
1 1252 . 20 1 1 A 106 106 ASN CB C 106 39.088 37.764 1.324 1
1 1253 . 20 1 1 A 106 106 ASN N N 106 122.001 116.925 5.076 1
1 1255 . 20 1 1 A 107 107 THR H H 107 8.090 7.657 0.433 1
1 1256 . 20 1 1 A 107 107 THR HA H 107 4.348 4.033 0.315 1
1 1261 . 20 1 1 A 107 107 THR C C 107 172.516 177.015 -4.499 1
1 1262 . 20 1 1 A 107 107 THR CA C 107 61.803 65.229 -3.426 1
1 1263 . 20 1 1 A 107 107 THR CB C 107 69.812 69.071 0.741 1
1 1265 . 20 1 1 A 107 107 THR N N 107 114.374 115.273 -0.899 1
1 1266 . 20 1 1 A 108 108 ARG H H 108 8.322 8.108 0.214 1
1 1267 . 20 1 1 A 108 108 ARG HA H 108 4.634 4.219 0.415 1
1 1274 . 20 1 1 A 108 108 ARG C C 108 172.608 177.392 -4.784 1
1 1275 . 20 1 1 A 108 108 ARG CA C 108 54.026 60.778 -6.752 1
1 1276 . 20 1 1 A 108 108 ARG CB C 108 30.246 29.405 0.841 1
1 1278 . 20 1 1 A 108 108 ARG N N 108 124.017 121.545 2.472 1
1 1279 . 20 1 1 A 109 109 PRO HA H 109 4.354 4.501 -0.147 1
1 1286 . 20 1 1 A 109 109 PRO C C 109 174.978 178.421 -3.443 1
1 1287 . 20 1 1 A 109 109 PRO CA C 109 63.396 64.727 -1.331 1
1 1288 . 20 1 1 A 109 109 PRO CB C 109 32.046 31.731 0.315 1
1 1290 . 20 1 1 A 110 110 PHE H H 110 8.123 8.029 0.094 1
1 1291 . 20 1 1 A 110 110 PHE HA H 110 4.619 4.277 0.342 1
1 1296 . 20 1 1 A 110 110 PHE C C 110 173.856 177.402 -3.546 1
1 1297 . 20 1 1 A 110 110 PHE CA C 110 57.353 62.014 -4.661 1
1 1298 . 20 1 1 A 110 110 PHE CB C 110 39.364 39.454 -0.090 1
1 1301 . 20 1 1 A 110 110 PHE N N 110 119.265 119.999 -0.734 1
1 1302 . 20 1 1 A 111 111 ASP H H 111 8.161 8.402 -0.241 1
1 1303 . 20 1 1 A 111 111 ASP HA H 111 4.613 4.580 0.033 1
1 1306 . 20 1 1 A 111 111 ASP C C 111 174.114 179.136 -5.022 1
1 1307 . 20 1 1 A 111 111 ASP CA C 111 54.350 57.023 -2.673 1
1 1308 . 20 1 1 A 111 111 ASP CB C 111 41.413 39.849 1.564 1
1 1309 . 20 1 1 A 111 111 ASP N N 111 121.764 119.031 2.733 1
1 1310 . 20 1 1 A 112 112 ASN H H 112 8.307 8.506 -0.199 1
1 1311 . 20 1 1 A 112 112 ASN HA H 112 4.662 4.564 0.098 1
1 1316 . 20 1 1 A 112 112 ASN C C 112 173.595 177.649 -4.054 1
1 1317 . 20 1 1 A 112 112 ASN CA C 112 53.486 56.519 -3.033 1
1 1318 . 20 1 1 A 112 112 ASN CB C 112 39.225 39.356 -0.131 1
1 1319 . 20 1 1 A 112 112 ASN N N 112 119.154 118.657 0.497 1
1 1321 . 20 1 1 A 113 113 GLU H H 113 8.404 8.133 0.271 1
1 1322 . 20 1 1 A 113 113 GLU HA H 113 4.264 4.077 0.187 1
1 1327 . 20 1 1 A 113 113 GLU C C 113 174.886 178.884 -3.998 1
1 1328 . 20 1 1 A 113 113 GLU CA C 113 56.681 59.035 -2.354 1
1 1329 . 20 1 1 A 113 113 GLU CB C 113 30.403 29.752 0.651 1
1 1331 . 20 1 1 A 113 113 GLU N N 113 120.943 119.395 1.548 1
1 1332 . 20 1 1 A 114 114 GLU H H 114 8.388 8.183 0.205 1
1 1333 . 20 1 1 A 114 114 GLU HA H 114 4.262 4.303 -0.041 1
1 1338 . 20 1 1 A 114 114 GLU C C 114 174.819 177.824 -3.005 1
1 1339 . 20 1 1 A 114 114 GLU CA C 114 56.769 58.904 -2.135 1
1 1340 . 20 1 1 A 114 114 GLU CB C 114 30.125 29.759 0.366 1
1 1342 . 20 1 1 A 114 114 GLU N N 114 121.869 120.758 1.111 1
1 1343 . 20 1 1 A 115 115 LYS H H 115 8.236 8.037 0.199 1
1 1344 . 20 1 1 A 115 115 LYS HA H 115 4.347 4.687 -0.340 1
1 1353 . 20 1 1 A 115 115 LYS C C 115 174.633 176.730 -2.097 1
1 1354 . 20 1 1 A 115 115 LYS CA C 115 56.426 55.173 1.253 1
1 1355 . 20 1 1 A 115 115 LYS CB C 115 33.277 32.430 0.847 1
1 1359 . 20 1 1 A 115 115 LYS N N 115 121.997 117.854 4.143 1
1 1360 . 20 1 1 A 116 116 ASP H H 116 8.386 8.126 0.260 1
1 1361 . 20 1 1 A 116 116 ASP HA H 116 4.600 4.465 0.135 1
1 1364 . 20 1 1 A 116 116 ASP C C 116 173.448 178.251 -4.803 1
1 1365 . 20 1 1 A 116 116 ASP CA C 116 54.773 56.611 -1.838 1
1 1366 . 20 1 1 A 116 116 ASP CB C 116 41.029 41.276 -0.247 1
1 1367 . 20 1 1 A 116 116 ASP N N 116 121.057 121.574 -0.517 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 112 2.166 1
2 1 1 1 "RMS(OBS, PRED)" CA 111 1.484 1
3 1 1 1 "RMS(OBS, PRED)" CB 107 0.976 1
4 1 1 1 "RMS(OBS, PRED)" H 108 0.509 1
5 1 1 1 "RMS(OBS, PRED)" HA 119 0.377 1
6 1 1 1 "RMS(OBS, PRED)" N 108 2.448 1
7 1 2 1 "RMS(OBS, PRED)" C 112 2.195 1
8 1 2 1 "RMS(OBS, PRED)" CA 111 1.590 1
9 1 2 1 "RMS(OBS, PRED)" CB 107 0.925 1
10 1 2 1 "RMS(OBS, PRED)" H 108 0.498 1
11 1 2 1 "RMS(OBS, PRED)" HA 119 0.360 1
12 1 2 1 "RMS(OBS, PRED)" N 108 2.520 1
13 1 3 1 "RMS(OBS, PRED)" C 112 2.170 1
14 1 3 1 "RMS(OBS, PRED)" CA 111 1.579 1
15 1 3 1 "RMS(OBS, PRED)" CB 107 1.064 1
16 1 3 1 "RMS(OBS, PRED)" H 108 0.480 1
17 1 3 1 "RMS(OBS, PRED)" HA 119 0.387 1
18 1 3 1 "RMS(OBS, PRED)" N 108 2.540 1
19 1 4 1 "RMS(OBS, PRED)" C 112 2.289 1
20 1 4 1 "RMS(OBS, PRED)" CA 111 1.583 1
21 1 4 1 "RMS(OBS, PRED)" CB 107 1.096 1
22 1 4 1 "RMS(OBS, PRED)" H 108 0.506 1
23 1 4 1 "RMS(OBS, PRED)" HA 119 0.373 1
24 1 4 1 "RMS(OBS, PRED)" N 108 2.641 1
25 1 5 1 "RMS(OBS, PRED)" C 112 2.294 1
26 1 5 1 "RMS(OBS, PRED)" CA 111 1.512 1
27 1 5 1 "RMS(OBS, PRED)" CB 107 0.996 1
28 1 5 1 "RMS(OBS, PRED)" H 108 0.501 1
29 1 5 1 "RMS(OBS, PRED)" HA 119 0.400 1
30 1 5 1 "RMS(OBS, PRED)" N 108 2.600 1
31 1 6 1 "RMS(OBS, PRED)" C 112 2.261 1
32 1 6 1 "RMS(OBS, PRED)" CA 111 1.625 1
33 1 6 1 "RMS(OBS, PRED)" CB 107 1.041 1
34 1 6 1 "RMS(OBS, PRED)" H 108 0.485 1
35 1 6 1 "RMS(OBS, PRED)" HA 119 0.378 1
36 1 6 1 "RMS(OBS, PRED)" N 108 2.420 1
37 1 7 1 "RMS(OBS, PRED)" C 112 2.234 1
38 1 7 1 "RMS(OBS, PRED)" CA 111 1.581 1
39 1 7 1 "RMS(OBS, PRED)" CB 107 0.927 1
40 1 7 1 "RMS(OBS, PRED)" H 108 0.500 1
41 1 7 1 "RMS(OBS, PRED)" HA 119 0.362 1
42 1 7 1 "RMS(OBS, PRED)" N 108 2.538 1
43 1 8 1 "RMS(OBS, PRED)" C 112 2.307 1
44 1 8 1 "RMS(OBS, PRED)" CA 111 1.601 1
45 1 8 1 "RMS(OBS, PRED)" CB 107 1.016 1
46 1 8 1 "RMS(OBS, PRED)" H 108 0.522 1
47 1 8 1 "RMS(OBS, PRED)" HA 119 0.376 1
48 1 8 1 "RMS(OBS, PRED)" N 108 2.630 1
49 1 9 1 "RMS(OBS, PRED)" C 112 2.259 1
50 1 9 1 "RMS(OBS, PRED)" CA 111 1.574 1
51 1 9 1 "RMS(OBS, PRED)" CB 107 1.077 1
52 1 9 1 "RMS(OBS, PRED)" H 108 0.514 1
53 1 9 1 "RMS(OBS, PRED)" HA 119 0.361 1
54 1 9 1 "RMS(OBS, PRED)" N 108 2.398 1
55 1 10 1 "RMS(OBS, PRED)" C 112 2.203 1
56 1 10 1 "RMS(OBS, PRED)" CA 111 1.636 1
57 1 10 1 "RMS(OBS, PRED)" CB 107 1.028 1
58 1 10 1 "RMS(OBS, PRED)" H 108 0.489 1
59 1 10 1 "RMS(OBS, PRED)" HA 119 0.378 1
60 1 10 1 "RMS(OBS, PRED)" N 108 2.452 1
61 1 11 1 "RMS(OBS, PRED)" C 112 2.237 1
62 1 11 1 "RMS(OBS, PRED)" CA 111 1.590 1
63 1 11 1 "RMS(OBS, PRED)" CB 107 0.931 1
64 1 11 1 "RMS(OBS, PRED)" H 108 0.495 1
65 1 11 1 "RMS(OBS, PRED)" HA 119 0.384 1
66 1 11 1 "RMS(OBS, PRED)" N 108 2.721 1
67 1 12 1 "RMS(OBS, PRED)" C 112 2.232 1
68 1 12 1 "RMS(OBS, PRED)" CA 111 1.660 1
69 1 12 1 "RMS(OBS, PRED)" CB 107 0.976 1
70 1 12 1 "RMS(OBS, PRED)" H 108 0.509 1
71 1 12 1 "RMS(OBS, PRED)" HA 119 0.375 1
72 1 12 1 "RMS(OBS, PRED)" N 108 2.608 1
73 1 13 1 "RMS(OBS, PRED)" C 112 2.139 1
74 1 13 1 "RMS(OBS, PRED)" CA 111 1.633 1
75 1 13 1 "RMS(OBS, PRED)" CB 107 0.973 1
76 1 13 1 "RMS(OBS, PRED)" H 108 0.499 1
77 1 13 1 "RMS(OBS, PRED)" HA 119 0.379 1
78 1 13 1 "RMS(OBS, PRED)" N 108 2.477 1
79 1 14 1 "RMS(OBS, PRED)" C 112 2.234 1
80 1 14 1 "RMS(OBS, PRED)" CA 111 1.565 1
81 1 14 1 "RMS(OBS, PRED)" CB 107 1.036 1
82 1 14 1 "RMS(OBS, PRED)" H 108 0.526 1
83 1 14 1 "RMS(OBS, PRED)" HA 119 0.362 1
84 1 14 1 "RMS(OBS, PRED)" N 108 2.273 1
85 1 15 1 "RMS(OBS, PRED)" C 112 2.318 1
86 1 15 1 "RMS(OBS, PRED)" CA 111 1.634 1
87 1 15 1 "RMS(OBS, PRED)" CB 107 1.092 1
88 1 15 1 "RMS(OBS, PRED)" H 108 0.526 1
89 1 15 1 "RMS(OBS, PRED)" HA 119 0.383 1
90 1 15 1 "RMS(OBS, PRED)" N 108 2.421 1
91 1 16 1 "RMS(OBS, PRED)" C 112 2.192 1
92 1 16 1 "RMS(OBS, PRED)" CA 111 1.569 1
93 1 16 1 "RMS(OBS, PRED)" CB 107 0.983 1
94 1 16 1 "RMS(OBS, PRED)" H 108 0.517 1
95 1 16 1 "RMS(OBS, PRED)" HA 119 0.380 1
96 1 16 1 "RMS(OBS, PRED)" N 108 2.574 1
97 1 17 1 "RMS(OBS, PRED)" C 112 2.224 1
98 1 17 1 "RMS(OBS, PRED)" CA 111 1.644 1
99 1 17 1 "RMS(OBS, PRED)" CB 107 0.996 1
100 1 17 1 "RMS(OBS, PRED)" H 108 0.523 1
101 1 17 1 "RMS(OBS, PRED)" HA 119 0.378 1
102 1 17 1 "RMS(OBS, PRED)" N 108 2.638 1
103 1 18 1 "RMS(OBS, PRED)" C 112 2.186 1
104 1 18 1 "RMS(OBS, PRED)" CA 111 1.593 1
105 1 18 1 "RMS(OBS, PRED)" CB 107 1.075 1
106 1 18 1 "RMS(OBS, PRED)" H 108 0.506 1
107 1 18 1 "RMS(OBS, PRED)" HA 119 0.388 1
108 1 18 1 "RMS(OBS, PRED)" N 108 2.606 1
109 1 19 1 "RMS(OBS, PRED)" C 112 2.271 1
110 1 19 1 "RMS(OBS, PRED)" CA 111 1.523 1
111 1 19 1 "RMS(OBS, PRED)" CB 107 0.950 1
112 1 19 1 "RMS(OBS, PRED)" H 108 0.532 1
113 1 19 1 "RMS(OBS, PRED)" HA 119 0.375 1
114 1 19 1 "RMS(OBS, PRED)" N 108 2.360 1
115 1 20 1 "RMS(OBS, PRED)" C 112 2.273 1
116 1 20 1 "RMS(OBS, PRED)" CA 111 1.563 1
117 1 20 1 "RMS(OBS, PRED)" CB 107 1.024 1
118 1 20 1 "RMS(OBS, PRED)" H 108 0.499 1
119 1 20 1 "RMS(OBS, PRED)" HA 119 0.372 1
120 1 20 1 "RMS(OBS, PRED)" N 108 2.383 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 5 . 1 1 A 2 2 MET HA H 2 4.534 4.338 0.197 2
1 13 . 1 1 A 2 2 MET C C 2 174.355 177.902 -3.547 2
1 14 . 1 1 A 2 2 MET CA C 2 56.247 57.322 -1.075 2
1 15 . 1 1 A 2 2 MET CB C 2 32.855 32.164 0.691 2
1 18 . 1 1 A 3 3 ASN H H 3 8.600 8.195 0.405 2
1 19 . 1 1 A 3 3 ASN HA H 3 4.711 4.447 0.264 2
1 24 . 1 1 A 3 3 ASN C C 3 173.983 177.604 -3.621 2
1 25 . 1 1 A 3 3 ASN CA C 3 53.650 56.638 -2.988 2
1 26 . 1 1 A 3 3 ASN CB C 3 38.624 39.535 -0.911 2
1 27 . 1 1 A 3 3 ASN N N 3 120.149 118.842 1.307 2
1 29 . 1 1 A 4 4 GLU H H 4 8.495 8.161 0.335 2
1 30 . 1 1 A 4 4 GLU HA H 4 4.235 4.062 0.173 2
1 35 . 1 1 A 4 4 GLU C C 4 175.752 178.722 -2.970 2
1 36 . 1 1 A 4 4 GLU CA C 4 58.075 59.180 -1.105 2
1 37 . 1 1 A 4 4 GLU CB C 4 30.125 29.395 0.730 2
1 38 . 1 1 A 4 4 GLU N N 4 121.543 118.593 2.950 2
1 39 . 1 1 A 5 5 LEU HA H 5 4.073 4.188 -0.115 2
1 47 . 1 1 A 5 5 LEU CB C 5 41.897 42.332 -0.435 2
1 50 . 1 1 A 6 6 GLU H H 6 8.332 8.380 -0.048 2
1 51 . 1 1 A 6 6 GLU HA H 6 3.621 4.242 -0.622 2
1 52 . 1 1 A 6 6 GLU C C 6 176.402 178.504 -2.102 2
1 53 . 1 1 A 6 6 GLU CA C 6 58.461 58.177 0.284 2
1 54 . 1 1 A 6 6 GLU CB C 6 29.730 29.550 0.180 2
1 55 . 1 1 A 6 6 GLU N N 6 121.462 118.637 2.825 2
1 56 . 1 1 A 7 7 ALA H H 7 8.244 7.724 0.520 2
1 57 . 1 1 A 7 7 ALA HA H 7 4.185 4.093 0.092 2
1 61 . 1 1 A 7 7 ALA C C 7 177.982 178.209 -0.227 2
1 62 . 1 1 A 7 7 ALA CA C 7 54.791 55.266 -0.475 2
1 63 . 1 1 A 7 7 ALA CB C 7 18.836 18.892 -0.056 2
1 64 . 1 1 A 7 7 ALA N N 7 123.078 121.995 1.083 2
1 65 . 1 1 A 8 8 GLN H H 8 8.274 7.703 0.571 2
1 66 . 1 1 A 8 8 GLN HA H 8 4.219 4.543 -0.324 2
1 73 . 1 1 A 8 8 GLN C C 8 176.325 175.274 1.050 2
1 74 . 1 1 A 8 8 GLN CA C 8 57.864 55.532 2.332 2
1 75 . 1 1 A 8 8 GLN CB C 8 28.768 29.593 -0.825 2
1 77 . 1 1 A 8 8 GLN N N 8 117.452 116.256 1.196 2
1 79 . 1 1 A 9 9 THR H H 9 8.043 8.624 -0.581 2
1 80 . 1 1 A 9 9 THR HA H 9 3.998 4.745 -0.747 2
1 85 . 1 1 A 9 9 THR C C 9 173.904 174.893 -0.989 2
1 86 . 1 1 A 9 9 THR CA C 9 65.435 61.015 4.420 2
1 87 . 1 1 A 9 9 THR CB C 9 68.870 70.292 -1.422 2
1 89 . 1 1 A 9 9 THR N N 9 116.135 118.739 -2.603 2
1 90 . 1 1 A 10 10 ARG H H 10 8.095 8.962 -0.867 2
1 91 . 1 1 A 10 10 ARG HA H 10 4.040 4.059 -0.019 2
1 98 . 1 1 A 10 10 ARG C C 10 176.583 175.873 0.710 2
1 99 . 1 1 A 10 10 ARG CA C 10 59.262 57.487 1.775 2
1 100 . 1 1 A 10 10 ARG CB C 10 29.900 28.888 1.012 2
1 101 . 1 1 A 10 10 ARG N N 10 121.157 123.384 -2.227 2
1 102 . 1 1 A 11 11 VAL H H 11 7.657 7.874 -0.217 2
1 103 . 1 1 A 11 11 VAL HA H 11 3.769 4.405 -0.636 2
1 111 . 1 1 A 11 11 VAL C C 11 176.662 177.740 -1.079 2
1 112 . 1 1 A 11 11 VAL CA C 11 65.914 63.831 2.083 2
1 113 . 1 1 A 11 11 VAL CB C 11 31.745 33.477 -1.732 2
1 114 . 1 1 A 11 11 VAL N N 11 118.580 117.995 0.585 2
1 115 . 1 1 A 12 12 LYS H H 12 7.471 8.195 -0.724 2
1 116 . 1 1 A 12 12 LYS HA H 12 3.366 4.362 -0.996 2
1 123 . 1 1 A 12 12 LYS C C 12 176.457 179.192 -2.735 2
1 124 . 1 1 A 12 12 LYS CA C 12 59.545 59.099 0.446 2
1 125 . 1 1 A 12 12 LYS CB C 12 32.206 32.396 -0.190 2
1 126 . 1 1 A 12 12 LYS N N 12 121.835 122.270 -0.435 2
1 127 . 1 1 A 13 13 LEU H H 13 8.144 8.035 0.109 2
1 128 . 1 1 A 13 13 LEU HA H 13 4.093 4.043 0.050 2
1 137 . 1 1 A 13 13 LEU C C 13 178.254 179.051 -0.797 2
1 138 . 1 1 A 13 13 LEU CA C 13 58.023 57.897 0.126 2
1 139 . 1 1 A 13 13 LEU CB C 13 41.283 41.543 -0.260 2
1 140 . 1 1 A 13 13 LEU N N 13 118.688 120.424 -1.736 2
1 141 . 1 1 A 14 14 ASN H H 14 8.384 8.476 -0.092 2
1 142 . 1 1 A 14 14 ASN HA H 14 4.567 4.426 0.141 2
1 147 . 1 1 A 14 14 ASN C C 14 175.397 177.359 -1.962 2
1 148 . 1 1 A 14 14 ASN CA C 14 56.239 56.478 -0.239 2
1 149 . 1 1 A 14 14 ASN CB C 14 38.432 38.862 -0.430 2
1 150 . 1 1 A 14 14 ASN N N 14 118.175 117.437 0.738 2
1 152 . 1 1 A 15 15 TYR H H 15 7.982 8.004 -0.022 2
1 153 . 1 1 A 15 15 TYR HA H 15 4.249 4.096 0.153 2
1 160 . 1 1 A 15 15 TYR C C 15 175.503 177.397 -1.894 2
1 161 . 1 1 A 15 15 TYR CA C 15 62.450 61.419 1.031 2
1 162 . 1 1 A 15 15 TYR CB C 15 39.399 38.544 0.855 2
1 163 . 1 1 A 15 15 TYR N N 15 121.955 121.446 0.509 2
1 164 . 1 1 A 16 16 LEU H H 16 8.198 8.582 -0.384 2
1 165 . 1 1 A 16 16 LEU HA H 16 4.470 3.972 0.498 2
1 175 . 1 1 A 16 16 LEU C C 16 177.125 178.062 -0.937 2
1 176 . 1 1 A 16 16 LEU CA C 16 57.374 58.151 -0.777 2
1 177 . 1 1 A 16 16 LEU CB C 16 41.443 41.546 -0.103 2
1 178 . 1 1 A 16 16 LEU N N 16 117.642 121.241 -3.599 2
1 179 . 1 1 A 17 17 ASP H H 17 8.061 8.366 -0.305 2
1 180 . 1 1 A 17 17 ASP C C 17 177.836 178.250 -0.415 2
1 181 . 1 1 A 17 17 ASP CA C 17 57.486 57.781 -0.295 2
1 182 . 1 1 A 17 17 ASP CB C 17 41.433 41.843 -0.410 2
1 183 . 1 1 A 17 17 ASP N N 17 118.700 118.841 -0.141 2
1 184 . 1 1 A 18 18 GLN H H 18 8.111 7.851 0.260 2
1 185 . 1 1 A 18 18 GLN HA H 18 4.002 4.072 -0.070 2
1 190 . 1 1 A 18 18 GLN CA C 18 59.046 58.740 0.306 2
1 191 . 1 1 A 18 18 GLN CB C 18 28.700 28.390 0.311 2
1 193 . 1 1 A 18 18 GLN N N 18 119.539 118.513 1.026 2
1 195 . 1 1 A 19 19 ILE H H 19 8.330 8.162 0.168 2
1 196 . 1 1 A 19 19 ILE HA H 19 3.306 3.880 -0.574 2
1 204 . 1 1 A 19 19 ILE C C 19 175.608 177.633 -2.025 2
1 205 . 1 1 A 19 19 ILE CA C 19 64.760 63.242 1.518 2
1 206 . 1 1 A 19 19 ILE CB C 19 37.148 37.058 0.090 2
1 209 . 1 1 A 19 19 ILE N N 19 121.490 120.363 1.127 2
1 210 . 1 1 A 20 20 ALA H H 20 8.057 7.963 0.094 2
1 211 . 1 1 A 20 20 ALA HA H 20 4.349 4.214 0.135 2
1 215 . 1 1 A 20 20 ALA C C 20 179.297 179.562 -0.265 2
1 216 . 1 1 A 20 20 ALA CA C 20 56.150 55.203 0.947 2
1 217 . 1 1 A 20 20 ALA CB C 20 18.104 18.785 -0.681 2
1 218 . 1 1 A 20 20 ALA N N 20 124.441 124.002 0.439 2
1 219 . 1 1 A 21 21 LYS H H 21 8.116 8.029 0.087 2
1 220 . 1 1 A 21 21 LYS HA H 21 4.108 4.034 0.074 2
1 229 . 1 1 A 21 21 LYS C C 21 176.720 178.665 -1.945 2
1 230 . 1 1 A 21 21 LYS CA C 21 59.166 59.325 -0.159 2
1 231 . 1 1 A 21 21 LYS CB C 21 32.085 32.311 -0.226 2
1 233 . 1 1 A 21 21 LYS N N 21 119.865 118.371 1.494 2
1 234 . 1 1 A 22 22 PHE H H 22 7.875 8.108 -0.233 2
1 235 . 1 1 A 22 22 PHE HA H 22 4.012 4.141 -0.129 2
1 242 . 1 1 A 22 22 PHE C C 22 175.545 177.519 -1.974 2
1 243 . 1 1 A 22 22 PHE CA C 22 61.070 61.391 -0.321 2
1 244 . 1 1 A 22 22 PHE CB C 22 39.072 38.960 0.112 2
1 249 . 1 1 A 22 22 PHE N N 22 119.729 120.152 -0.423 2
1 250 . 1 1 A 23 23 TRP H H 23 7.841 8.012 -0.171 2
1 251 . 1 1 A 23 23 TRP HA H 23 4.149 4.064 0.085 2
1 260 . 1 1 A 23 23 TRP C C 23 176.668 178.212 -1.544 2
1 261 . 1 1 A 23 23 TRP CB C 23 28.543 29.739 -1.196 2
1 267 . 1 1 A 23 23 TRP N N 23 119.440 120.687 -1.247 2
1 269 . 1 1 A 24 24 GLU H H 24 8.261 8.465 -0.204 2
1 270 . 1 1 A 24 24 GLU HA H 24 4.265 4.206 0.059 2
1 275 . 1 1 A 24 24 GLU C C 24 179.679 178.626 1.053 2
1 276 . 1 1 A 24 24 GLU CA C 24 59.706 58.884 0.822 2
1 277 . 1 1 A 24 24 GLU CB C 24 29.720 29.418 0.302 2
1 279 . 1 1 A 24 24 GLU N N 24 121.376 118.505 2.871 2
1 280 . 1 1 A 25 25 ILE H H 25 8.071 7.819 0.252 2
1 281 . 1 1 A 25 25 ILE HA H 25 3.815 3.870 -0.055 2
1 291 . 1 1 A 25 25 ILE C C 25 176.343 177.187 -0.844 2
1 292 . 1 1 A 25 25 ILE CA C 25 64.464 62.116 2.348 2
1 293 . 1 1 A 25 25 ILE CB C 25 37.371 37.612 -0.241 2
1 296 . 1 1 A 25 25 ILE N N 25 121.499 119.519 1.980 2
1 297 . 1 1 A 26 26 GLN H H 26 7.327 7.175 0.152 2
1 298 . 1 1 A 26 26 GLN HA H 26 4.074 4.151 -0.077 2
1 305 . 1 1 A 26 26 GLN C C 26 174.906 175.701 -0.795 2
1 306 . 1 1 A 26 26 GLN CA C 26 55.450 55.481 -0.031 2
1 307 . 1 1 A 26 26 GLN CB C 26 28.458 28.608 -0.150 2
1 309 . 1 1 A 26 26 GLN N N 26 116.532 120.112 -3.580 2
1 311 . 1 1 A 27 27 GLY H H 27 7.861 8.326 -0.465 2
1 312 . 1 1 A 27 27 GLY HA2 H 27 4.297 3.757 0.540 2
1 313 . 1 1 A 27 27 GLY HA3 H 27 3.823 3.760 0.063 2
1 314 . 1 1 A 27 27 GLY C C 27 172.698 173.231 -0.533 2
1 315 . 1 1 A 27 27 GLY CA C 27 45.608 45.705 -0.097 2
1 316 . 1 1 A 27 27 GLY N N 27 106.837 108.492 -1.655 2
1 317 . 1 1 A 28 28 SER H H 28 8.083 7.141 0.942 2
1 318 . 1 1 A 28 28 SER HA H 28 4.777 4.648 0.129 2
1 321 . 1 1 A 28 28 SER C C 28 171.196 171.880 -0.684 2
1 322 . 1 1 A 28 28 SER CA C 28 56.041 56.601 -0.560 2
1 323 . 1 1 A 28 28 SER CB C 28 64.539 65.799 -1.260 2
1 324 . 1 1 A 28 28 SER N N 28 116.151 114.413 1.738 2
1 325 . 1 1 A 29 29 SER H H 29 8.354 8.490 -0.136 2
1 326 . 1 1 A 29 29 SER HA H 29 4.389 5.108 -0.719 2
1 329 . 1 1 A 29 29 SER C C 29 172.166 172.708 -0.542 2
1 330 . 1 1 A 29 29 SER CA C 29 58.107 56.422 1.685 2
1 331 . 1 1 A 29 29 SER CB C 29 63.853 65.892 -2.039 2
1 332 . 1 1 A 29 29 SER N N 29 116.596 114.917 1.679 2
1 333 . 1 1 A 30 30 LEU H H 30 8.990 8.661 0.329 2
1 334 . 1 1 A 30 30 LEU HA H 30 3.964 4.973 -1.009 2
1 344 . 1 1 A 30 30 LEU C C 30 173.752 175.415 -1.662 2
1 345 . 1 1 A 30 30 LEU CA C 30 55.193 55.062 0.131 2
1 346 . 1 1 A 30 30 LEU CB C 30 42.869 42.714 0.155 2
1 349 . 1 1 A 30 30 LEU N N 30 125.860 127.069 -1.208 2
1 350 . 1 1 A 31 31 LYS H H 31 8.118 8.898 -0.780 2
1 351 . 1 1 A 31 31 LYS HA H 31 4.498 4.882 -0.384 2
1 360 . 1 1 A 31 31 LYS C C 31 173.555 174.966 -1.411 2
1 361 . 1 1 A 31 31 LYS CA C 31 54.372 55.172 -0.800 2
1 362 . 1 1 A 31 31 LYS CB C 31 32.814 33.841 -1.027 2
1 365 . 1 1 A 31 31 LYS N N 31 129.965 127.067 2.898 2
1 366 . 1 1 A 32 32 ILE H H 32 8.717 8.508 0.209 2
1 367 . 1 1 A 32 32 ILE HA H 32 4.011 4.683 -0.672 2
1 377 . 1 1 A 32 32 ILE C C 32 173.038 174.889 -1.851 2
1 378 . 1 1 A 32 32 ILE CA C 32 59.921 58.393 1.528 2
1 379 . 1 1 A 32 32 ILE CB C 32 38.139 38.851 -0.712 2
1 382 . 1 1 A 32 32 ILE N N 32 127.091 122.191 4.900 2
1 383 . 1 1 A 33 33 PRO HA H 33 4.412 4.555 -0.143 2
1 390 . 1 1 A 33 33 PRO C C 33 172.724 175.771 -3.047 2
1 391 . 1 1 A 33 33 PRO CA C 33 62.565 62.249 0.316 2
1 392 . 1 1 A 33 33 PRO CB C 33 32.728 32.729 -0.001 2
1 394 . 1 1 A 34 34 ASN H H 34 8.265 8.496 -0.232 2
1 395 . 1 1 A 34 34 ASN HA H 34 5.147 5.514 -0.367 2
1 400 . 1 1 A 34 34 ASN C C 34 174.079 173.601 0.478 2
1 401 . 1 1 A 34 34 ASN CA C 34 52.088 51.570 0.518 2
1 402 . 1 1 A 34 34 ASN CB C 34 40.387 42.342 -1.955 2
1 403 . 1 1 A 34 34 ASN N N 34 116.424 115.973 0.451 2
1 405 . 1 1 A 35 35 VAL H H 35 8.904 9.056 -0.152 2
1 406 . 1 1 A 35 35 VAL HA H 35 4.159 4.474 -0.315 2
1 414 . 1 1 A 35 35 VAL C C 35 173.834 174.859 -1.025 2
1 415 . 1 1 A 35 35 VAL CA C 35 61.953 59.893 2.060 2
1 416 . 1 1 A 35 35 VAL CB C 35 34.432 34.691 -0.259 2
1 419 . 1 1 A 35 35 VAL N N 35 122.778 119.130 3.648 2
1 420 . 1 1 A 36 36 GLU H H 36 9.560 9.442 0.118 2
1 421 . 1 1 A 36 36 GLU HA H 36 3.819 4.035 -0.216 2
1 426 . 1 1 A 36 36 GLU C C 36 173.604 176.039 -2.435 2
1 427 . 1 1 A 36 36 GLU CA C 36 57.131 57.962 -0.831 2
1 428 . 1 1 A 36 36 GLU CB C 36 27.464 27.994 -0.530 2
1 430 . 1 1 A 36 36 GLU N N 36 127.014 128.796 -1.782 2
1 431 . 1 1 A 37 37 ARG H H 37 8.578 8.526 0.052 2
1 432 . 1 1 A 37 37 ARG HA H 37 3.792 3.953 -0.161 2
1 439 . 1 1 A 37 37 ARG C C 37 173.371 174.787 -1.416 2
1 440 . 1 1 A 37 37 ARG CA C 37 57.952 57.645 0.307 2
1 441 . 1 1 A 37 37 ARG CB C 37 27.657 27.779 -0.122 2
1 443 . 1 1 A 37 37 ARG N N 37 108.362 113.365 -5.003 2
1 444 . 1 1 A 38 38 ARG H H 38 7.696 7.898 -0.202 2
1 445 . 1 1 A 38 38 ARG HA H 38 4.743 4.960 -0.217 2
1 452 . 1 1 A 38 38 ARG C C 38 173.513 175.267 -1.754 2
1 453 . 1 1 A 38 38 ARG CA C 38 54.507 54.734 -0.227 2
1 454 . 1 1 A 38 38 ARG CB C 38 33.751 33.071 0.680 2
1 456 . 1 1 A 38 38 ARG N N 38 118.370 119.666 -1.296 2
1 457 . 1 1 A 39 39 ILE H H 39 8.463 8.432 0.031 2
1 458 . 1 1 A 39 39 ILE HA H 39 4.184 4.254 -0.070 2
1 468 . 1 1 A 39 39 ILE C C 39 175.150 175.804 -0.654 2
1 469 . 1 1 A 39 39 ILE CA C 39 62.076 61.846 0.230 2
1 470 . 1 1 A 39 39 ILE CB C 39 38.864 39.329 -0.465 2
1 473 . 1 1 A 39 39 ILE N N 39 123.604 126.386 -2.782 2
1 474 . 1 1 A 40 40 LEU H H 40 8.239 8.183 0.056 2
1 475 . 1 1 A 40 40 LEU HA H 40 4.259 4.547 -0.288 2
1 485 . 1 1 A 40 40 LEU C C 40 173.152 175.313 -2.161 2
1 486 . 1 1 A 40 40 LEU CA C 40 55.305 54.861 0.444 2
1 487 . 1 1 A 40 40 LEU CB C 40 43.113 42.032 1.081 2
1 490 . 1 1 A 40 40 LEU N N 40 129.550 128.945 0.606 2
1 491 . 1 1 A 41 41 ASP H H 41 8.992 8.581 0.411 2
1 492 . 1 1 A 41 41 ASP HA H 41 4.798 4.783 0.015 2
1 495 . 1 1 A 41 41 ASP C C 41 173.837 176.284 -2.447 2
1 496 . 1 1 A 41 41 ASP CA C 41 52.077 53.581 -1.504 2
1 497 . 1 1 A 41 41 ASP CB C 41 39.454 40.227 -0.773 2
1 498 . 1 1 A 41 41 ASP N N 41 127.022 127.392 -0.370 2
1 499 . 1 1 A 42 42 LEU H H 42 7.912 8.342 -0.430 2
1 500 . 1 1 A 42 42 LEU HA H 42 3.970 4.125 -0.155 2
1 510 . 1 1 A 42 42 LEU C C 42 176.305 177.903 -1.598 2
1 511 . 1 1 A 42 42 LEU CA C 42 58.128 57.715 0.413 2
1 512 . 1 1 A 42 42 LEU CB C 42 43.043 41.808 1.235 2
1 514 . 1 1 A 42 42 LEU N N 42 125.064 126.987 -1.923 2
1 515 . 1 1 A 43 43 TYR H H 43 8.565 8.244 0.321 2
1 516 . 1 1 A 43 43 TYR HA H 43 3.728 3.834 -0.106 2
1 523 . 1 1 A 43 43 TYR C C 43 175.757 177.464 -1.707 2
1 524 . 1 1 A 43 43 TYR CA C 43 61.774 61.340 0.434 2
1 525 . 1 1 A 43 43 TYR CB C 43 38.235 38.285 -0.050 2
1 528 . 1 1 A 43 43 TYR N N 43 117.822 120.143 -2.321 2
1 529 . 1 1 A 44 44 SER H H 44 8.115 8.280 -0.166 2
1 530 . 1 1 A 44 44 SER HA H 44 3.854 4.187 -0.333 2
1 533 . 1 1 A 44 44 SER C C 44 174.080 176.469 -2.389 2
1 534 . 1 1 A 44 44 SER CA C 44 61.873 61.739 0.134 2
1 535 . 1 1 A 44 44 SER CB C 44 64.350 62.859 1.491 2
1 536 . 1 1 A 44 44 SER N N 44 116.835 115.441 1.394 2
1 537 . 1 1 A 45 45 LEU H H 45 8.401 7.940 0.461 2
1 538 . 1 1 A 45 45 LEU HA H 45 4.102 4.185 -0.083 2
1 548 . 1 1 A 45 45 LEU C C 45 175.081 178.803 -3.722 2
1 549 . 1 1 A 45 45 LEU CA C 45 58.896 57.917 0.979 2
1 550 . 1 1 A 45 45 LEU CB C 45 41.741 41.554 0.187 2
1 553 . 1 1 A 45 45 LEU N N 45 120.621 123.328 -2.707 2
1 554 . 1 1 A 46 46 SER H H 46 8.110 8.466 -0.356 2
1 555 . 1 1 A 46 46 SER HA H 46 4.300 4.221 0.079 2
1 558 . 1 1 A 46 46 SER C C 46 175.019 176.659 -1.640 2
1 559 . 1 1 A 46 46 SER CA C 46 62.610 61.729 0.881 2
1 560 . 1 1 A 46 46 SER CB C 46 64.092 62.934 1.158 2
1 561 . 1 1 A 46 46 SER N N 46 112.826 115.134 -2.308 2
1 562 . 1 1 A 47 47 LYS H H 47 7.732 8.045 -0.313 2
1 563 . 1 1 A 47 47 LYS HA H 47 3.900 4.142 -0.242 2
1 572 . 1 1 A 47 47 LYS C C 47 177.441 178.960 -1.519 2
1 573 . 1 1 A 47 47 LYS CA C 47 58.575 59.088 -0.513 2
1 574 . 1 1 A 47 47 LYS CB C 47 32.351 31.913 0.438 2
1 576 . 1 1 A 47 47 LYS N N 47 121.210 119.213 1.997 2
1 577 . 1 1 A 48 48 ILE H H 48 8.672 8.122 0.550 2
1 578 . 1 1 A 48 48 ILE HA H 48 3.628 3.723 -0.095 2
1 588 . 1 1 A 48 48 ILE C C 48 175.861 178.088 -2.227 2
1 589 . 1 1 A 48 48 ILE CA C 48 64.188 65.073 -0.885 2
1 590 . 1 1 A 48 48 ILE CB C 48 37.954 37.649 0.305 2
1 593 . 1 1 A 48 48 ILE N N 48 120.810 121.141 -0.331 2
1 594 . 1 1 A 49 49 VAL H H 49 8.030 8.272 -0.242 2
1 595 . 1 1 A 49 49 VAL HA H 49 3.195 3.670 -0.474 2
1 603 . 1 1 A 49 49 VAL C C 49 176.513 178.483 -1.970 2
1 604 . 1 1 A 49 49 VAL CA C 49 66.760 66.972 -0.212 2
1 605 . 1 1 A 49 49 VAL CB C 49 30.935 31.750 -0.815 2
1 608 . 1 1 A 49 49 VAL N N 49 119.350 119.747 -0.397 2
1 609 . 1 1 A 50 50 VAL H H 50 7.336 8.273 -0.937 2
1 610 . 1 1 A 50 50 VAL HA H 50 3.497 3.610 -0.113 2
1 618 . 1 1 A 50 50 VAL C C 50 178.745 178.230 0.515 2
1 619 . 1 1 A 50 50 VAL CA C 50 67.384 66.673 0.711 2
1 620 . 1 1 A 50 50 VAL CB C 50 31.832 31.515 0.317 2
1 621 . 1 1 A 50 50 VAL N N 50 118.610 120.805 -2.195 2
1 622 . 1 1 A 51 51 GLU H H 51 8.318 8.399 -0.081 2
1 623 . 1 1 A 51 51 GLU HA H 51 3.953 4.009 -0.056 2
1 628 . 1 1 A 51 51 GLU C C 51 177.281 178.998 -1.717 2
1 629 . 1 1 A 51 51 GLU CA C 51 59.668 59.310 0.358 2
1 630 . 1 1 A 51 51 GLU CB C 51 30.131 29.242 0.889 2
1 632 . 1 1 A 51 51 GLU N N 51 122.096 119.612 2.484 2
1 633 . 1 1 A 52 52 GLU H H 52 8.065 8.153 -0.088 2
1 634 . 1 1 A 52 52 GLU HA H 52 4.229 4.258 -0.029 2
1 639 . 1 1 A 52 52 GLU C C 52 173.534 176.777 -3.243 2
1 640 . 1 1 A 52 52 GLU CA C 52 55.547 56.584 -1.037 2
1 641 . 1 1 A 52 52 GLU CB C 52 28.716 30.011 -1.295 2
1 643 . 1 1 A 52 52 GLU N N 52 114.992 116.541 -1.549 2
1 644 . 1 1 A 53 53 GLY H H 53 7.459 9.079 -1.620 2
1 645 . 1 1 A 53 53 GLY HA2 H 53 3.630 3.947 -0.317 2
1 646 . 1 1 A 53 53 GLY HA3 H 53 3.630 3.965 -0.335 2
1 647 . 1 1 A 53 53 GLY C C 53 173.214 173.694 -0.480 2
1 648 . 1 1 A 53 53 GLY CA C 53 44.962 45.277 -0.315 2
1 649 . 1 1 A 53 53 GLY N N 53 104.909 108.113 -3.204 2
1 650 . 1 1 A 54 54 GLY H H 54 8.533 7.552 0.981 2
1 651 . 1 1 A 54 54 GLY HA2 H 54 3.548 4.067 -0.519 2
1 652 . 1 1 A 54 54 GLY HA3 H 54 4.521 4.115 0.406 2
1 653 . 1 1 A 54 54 GLY C C 54 169.966 174.519 -4.553 2
1 654 . 1 1 A 54 54 GLY CA C 54 43.988 45.742 -1.754 2
1 655 . 1 1 A 54 54 GLY N N 54 110.587 107.963 2.624 2
1 656 . 1 1 A 55 55 TYR H H 55 8.704 9.033 -0.329 2
1 657 . 1 1 A 55 55 TYR HA H 55 3.618 3.960 -0.342 2
1 664 . 1 1 A 55 55 TYR C C 55 174.807 177.205 -2.398 2
1 665 . 1 1 A 55 55 TYR CA C 55 62.540 61.598 0.942 2
1 666 . 1 1 A 55 55 TYR CB C 55 39.669 39.309 0.360 2
1 669 . 1 1 A 55 55 TYR N N 55 119.168 123.129 -3.961 2
1 670 . 1 1 A 56 56 GLU H H 56 9.006 8.292 0.714 2
1 671 . 1 1 A 56 56 GLU HA H 56 3.638 3.569 0.069 2
1 676 . 1 1 A 56 56 GLU C C 56 177.400 178.358 -0.958 2
1 677 . 1 1 A 56 56 GLU CA C 56 60.530 59.459 1.071 2
1 678 . 1 1 A 56 56 GLU CB C 56 29.168 29.360 -0.192 2
1 679 . 1 1 A 56 56 GLU N N 56 118.969 118.817 0.152 2
1 680 . 1 1 A 57 57 ALA H H 57 8.235 7.772 0.463 2
1 681 . 1 1 A 57 57 ALA HA H 57 3.980 3.995 -0.015 2
1 685 . 1 1 A 57 57 ALA C C 57 177.678 179.749 -2.071 2
1 686 . 1 1 A 57 57 ALA CA C 57 54.910 55.104 -0.194 2
1 687 . 1 1 A 57 57 ALA CB C 57 18.122 18.320 -0.198 2
1 688 . 1 1 A 57 57 ALA N N 57 122.860 121.738 1.122 2
1 689 . 1 1 A 58 58 ILE H H 58 7.831 7.484 0.347 2
1 690 . 1 1 A 58 58 ILE HA H 58 3.189 3.251 -0.062 2
1 700 . 1 1 A 58 58 ILE C C 58 177.818 177.266 0.552 2
1 701 . 1 1 A 58 58 ILE CA C 58 65.074 64.737 0.337 2
1 702 . 1 1 A 58 58 ILE CB C 58 38.178 36.803 1.374 2
1 706 . 1 1 A 58 58 ILE N N 58 117.418 117.809 -0.391 2
1 707 . 1 1 A 59 59 CYS H H 59 7.760 7.960 -0.200 2
1 708 . 1 1 A 59 59 CYS HA H 59 4.203 4.179 0.024 2
1 711 . 1 1 A 59 59 CYS C C 59 176.357 177.009 -0.652 2
1 712 . 1 1 A 59 59 CYS CA C 59 63.760 62.509 1.251 2
1 713 . 1 1 A 59 59 CYS CB C 59 27.638 26.782 0.856 2
1 714 . 1 1 A 59 59 CYS N N 59 115.302 120.374 -5.072 2
1 715 . 1 1 A 60 60 LYS H H 60 8.350 8.006 0.344 2
1 716 . 1 1 A 60 60 LYS HA H 60 3.972 4.013 -0.041 2
1 725 . 1 1 A 60 60 LYS C C 60 176.373 177.732 -1.359 2
1 726 . 1 1 A 60 60 LYS CA C 60 59.796 58.970 0.826 2
1 727 . 1 1 A 60 60 LYS CB C 60 32.560 32.168 0.392 2
1 729 . 1 1 A 60 60 LYS N N 60 122.343 120.425 1.918 2
1 730 . 1 1 A 61 61 ASP H H 61 8.157 7.770 0.387 2
1 731 . 1 1 A 61 61 ASP HA H 61 4.616 4.632 -0.016 2
1 734 . 1 1 A 61 61 ASP C C 61 173.246 175.447 -2.201 2
1 735 . 1 1 A 61 61 ASP CA C 61 54.272 54.016 0.256 2
1 736 . 1 1 A 61 61 ASP CB C 61 41.023 40.965 0.058 2
1 737 . 1 1 A 61 61 ASP N N 61 116.173 117.775 -1.602 2
1 738 . 1 1 A 62 62 ARG H H 62 7.655 7.674 -0.019 2
1 739 . 1 1 A 62 62 ARG HA H 62 4.149 3.985 0.164 2
1 746 . 1 1 A 62 62 ARG C C 62 175.891 176.091 -0.200 2
1 747 . 1 1 A 62 62 ARG CA C 62 57.381 57.121 0.260 2
1 748 . 1 1 A 62 62 ARG CB C 62 26.538 27.980 -1.442 2
1 750 . 1 1 A 62 62 ARG N N 62 117.213 116.921 0.292 2
1 751 . 1 1 A 63 63 ARG H H 63 8.302 7.863 0.439 2
1 752 . 1 1 A 63 63 ARG HA H 63 4.240 4.144 0.096 2
1 757 . 1 1 A 63 63 ARG C C 63 175.775 178.041 -2.266 2
1 758 . 1 1 A 63 63 ARG CA C 63 55.718 57.490 -1.772 2
1 760 . 1 1 A 63 63 ARG N N 63 116.292 118.010 -1.718 2
1 761 . 1 1 A 64 64 TRP H H 64 8.161 7.449 0.712 2
1 762 . 1 1 A 64 64 TRP HA H 64 3.836 4.399 -0.563 2
1 771 . 1 1 A 64 64 TRP C C 64 176.862 178.564 -1.702 2
1 772 . 1 1 A 64 64 TRP CA C 64 62.036 59.881 2.155 2
1 773 . 1 1 A 64 64 TRP CB C 64 27.028 28.845 -1.817 2
1 779 . 1 1 A 64 64 TRP N N 64 121.486 120.073 1.413 2
1 781 . 1 1 A 65 65 ALA H H 65 8.954 8.027 0.927 2
1 782 . 1 1 A 65 65 ALA HA H 65 4.290 4.086 0.204 2
1 786 . 1 1 A 65 65 ALA C C 65 178.986 179.521 -0.535 2
1 787 . 1 1 A 65 65 ALA CA C 65 55.314 55.427 -0.113 2
1 788 . 1 1 A 65 65 ALA CB C 65 18.119 18.182 -0.063 2
1 789 . 1 1 A 65 65 ALA N N 65 121.559 122.686 -1.127 2
1 790 . 1 1 A 66 66 ARG H H 66 7.473 7.808 -0.335 2
1 791 . 1 1 A 66 66 ARG HA H 66 4.221 4.127 0.094 2
1 798 . 1 1 A 66 66 ARG C C 66 176.670 178.497 -1.827 2
1 799 . 1 1 A 66 66 ARG CA C 66 57.871 58.943 -1.071 2
1 800 . 1 1 A 66 66 ARG CB C 66 29.097 29.789 -0.692 2
1 801 . 1 1 A 66 66 ARG N N 66 119.915 117.629 2.286 2
1 802 . 1 1 A 67 67 VAL H H 67 7.134 7.780 -0.646 2
1 803 . 1 1 A 67 67 VAL HA H 67 3.304 3.719 -0.415 2
1 811 . 1 1 A 67 67 VAL C C 67 175.341 178.010 -2.669 2
1 812 . 1 1 A 67 67 VAL CA C 67 66.722 65.959 0.763 2
1 813 . 1 1 A 67 67 VAL CB C 67 31.108 31.896 -0.788 2
1 816 . 1 1 A 67 67 VAL N N 67 119.970 120.148 -0.178 2
1 817 . 1 1 A 68 68 ALA H H 68 7.745 8.559 -0.814 2
1 818 . 1 1 A 68 68 ALA HA H 68 4.076 4.200 -0.124 2
1 822 . 1 1 A 68 68 ALA C C 68 177.358 179.686 -2.328 2
1 823 . 1 1 A 68 68 ALA CA C 68 55.607 55.862 -0.255 2
1 824 . 1 1 A 68 68 ALA CB C 68 18.061 18.443 -0.382 2
1 825 . 1 1 A 68 68 ALA N N 68 118.239 122.633 -4.394 2
1 826 . 1 1 A 69 69 GLN H H 69 7.979 8.168 -0.189 2
1 827 . 1 1 A 69 69 GLN HA H 69 4.310 4.061 0.249 2
1 834 . 1 1 A 69 69 GLN C C 69 179.370 178.202 1.168 2
1 835 . 1 1 A 69 69 GLN CA C 69 59.307 58.918 0.389 2
1 836 . 1 1 A 69 69 GLN CB C 69 29.257 28.416 0.841 2
1 838 . 1 1 A 69 69 GLN N N 69 118.484 117.710 0.774 2
1 840 . 1 1 A 70 70 ARG H H 70 8.374 8.046 0.328 2
1 841 . 1 1 A 70 70 ARG HA H 70 4.148 4.100 0.048 2
1 848 . 1 1 A 70 70 ARG C C 70 175.850 178.092 -2.242 2
1 849 . 1 1 A 70 70 ARG CA C 70 58.957 58.678 0.279 2
1 850 . 1 1 A 70 70 ARG CB C 70 29.799 30.022 -0.223 2
1 852 . 1 1 A 70 70 ARG N N 70 120.309 120.501 -0.192 2
1 853 . 1 1 A 71 71 LEU H H 71 7.413 7.703 -0.290 2
1 854 . 1 1 A 71 71 LEU HA H 71 4.341 4.165 0.176 2
1 864 . 1 1 A 71 71 LEU C C 71 173.391 175.819 -2.428 2
1 865 . 1 1 A 71 71 LEU CA C 71 54.911 54.643 0.268 2
1 866 . 1 1 A 71 71 LEU CB C 71 42.693 41.621 1.072 2
1 867 . 1 1 A 71 71 LEU N N 71 118.841 117.871 0.970 2
1 868 . 1 1 A 72 72 ASN H H 72 8.038 7.943 0.095 2
1 869 . 1 1 A 72 72 ASN HA H 72 4.394 4.353 0.041 2
1 874 . 1 1 A 72 72 ASN C C 72 173.042 174.127 -1.085 2
1 875 . 1 1 A 72 72 ASN CB C 72 36.412 36.713 -0.301 2
1 876 . 1 1 A 72 72 ASN N N 72 112.919 115.584 -2.665 2
1 878 . 1 1 A 73 73 TYR H H 73 7.874 7.740 0.134 2
1 879 . 1 1 A 73 73 TYR HA H 73 4.868 4.623 0.245 2
1 886 . 1 1 A 73 73 TYR C C 73 172.194 174.085 -1.891 2
1 887 . 1 1 A 73 73 TYR CA C 73 57.105 56.582 0.523 2
1 888 . 1 1 A 73 73 TYR CB C 73 37.918 38.456 -0.538 2
1 889 . 1 1 A 73 73 TYR N N 73 117.432 119.470 -2.038 2
1 897 . 1 1 A 75 75 PRO HA H 75 4.626 4.300 0.326 2
1 902 . 1 1 A 75 75 PRO C C 75 175.728 177.244 -1.516 2
1 903 . 1 1 A 75 75 PRO CA C 75 62.502 63.789 -1.287 2
1 904 . 1 1 A 75 75 PRO CB C 75 32.339 32.110 0.229 2
1 905 . 1 1 A 76 76 GLY H H 76 8.369 8.833 -0.464 2
1 906 . 1 1 A 76 76 GLY HA2 H 76 4.057 3.919 0.138 2
1 907 . 1 1 A 76 76 GLY HA3 H 76 4.556 3.920 0.636 2
1 908 . 1 1 A 76 76 GLY C C 76 173.248 174.918 -1.670 2
1 909 . 1 1 A 76 76 GLY CA C 76 46.180 45.425 0.755 2
1 910 . 1 1 A 76 76 GLY N N 76 106.185 110.828 -4.643 2
1 911 . 1 1 A 77 77 LYS H H 77 8.632 8.323 0.309 2
1 912 . 1 1 A 77 77 LYS HA H 77 4.433 4.077 0.355 2
1 921 . 1 1 A 77 77 LYS C C 77 174.924 176.571 -1.646 2
1 922 . 1 1 A 77 77 LYS CA C 77 56.453 57.697 -1.244 2
1 923 . 1 1 A 77 77 LYS CB C 77 33.170 30.094 3.076 2
1 925 . 1 1 A 77 77 LYS N N 77 119.592 116.743 2.849 2
1 926 . 1 1 A 78 78 ASN H H 78 8.865 8.143 0.722 2
1 927 . 1 1 A 78 78 ASN HA H 78 4.654 4.492 0.162 2
1 932 . 1 1 A 78 78 ASN C C 78 174.869 177.516 -2.647 2
1 933 . 1 1 A 78 78 ASN CA C 78 54.117 56.117 -2.000 2
1 934 . 1 1 A 78 78 ASN CB C 78 37.841 38.457 -0.616 2
1 935 . 1 1 A 78 78 ASN N N 78 116.880 117.438 -0.558 2
1 937 . 1 1 A 79 79 ILE H H 79 8.008 8.156 -0.148 2
1 938 . 1 1 A 79 79 ILE HA H 79 3.718 3.751 -0.033 2
1 948 . 1 1 A 79 79 ILE C C 79 175.921 178.299 -2.378 2
1 949 . 1 1 A 79 79 ILE CA C 79 63.618 64.521 -0.903 2
1 950 . 1 1 A 79 79 ILE CB C 79 37.158 37.226 -0.068 2
1 952 . 1 1 A 79 79 ILE N N 79 119.688 119.889 -0.201 2
1 953 . 1 1 A 80 80 GLY H H 80 9.062 8.245 0.817 2
1 954 . 1 1 A 80 80 GLY HA2 H 80 3.739 3.820 -0.081 2
1 955 . 1 1 A 80 80 GLY HA3 H 80 3.739 3.862 -0.123 2
1 956 . 1 1 A 80 80 GLY C C 80 173.185 176.281 -3.096 2
1 957 . 1 1 A 80 80 GLY CA C 80 48.166 47.577 0.589 2
1 958 . 1 1 A 80 80 GLY N N 80 110.338 109.070 1.268 2
1 959 . 1 1 A 81 81 SER H H 81 7.460 7.918 -0.458 2
1 960 . 1 1 A 81 81 SER HA H 81 3.904 4.116 -0.212 2
1 963 . 1 1 A 81 81 SER C C 81 174.999 176.332 -1.333 2
1 964 . 1 1 A 81 81 SER CA C 81 61.138 62.061 -0.923 2
1 965 . 1 1 A 81 81 SER CB C 81 62.740 62.787 -0.047 2
1 966 . 1 1 A 81 81 SER N N 81 115.348 118.571 -3.223 2
1 967 . 1 1 A 82 82 LEU H H 82 7.367 7.818 -0.451 2
1 968 . 1 1 A 82 82 LEU HA H 82 3.946 3.946 0.000 2
1 977 . 1 1 A 82 82 LEU C C 82 176.969 178.047 -1.078 2
1 978 . 1 1 A 82 82 LEU CA C 82 57.504 58.227 -0.723 2
1 979 . 1 1 A 82 82 LEU CB C 82 42.185 41.400 0.785 2
1 980 . 1 1 A 82 82 LEU N N 82 124.267 122.853 1.414 2
1 981 . 1 1 A 83 83 LEU H H 83 8.330 8.275 0.055 2
1 982 . 1 1 A 83 83 LEU HA H 83 3.924 3.928 -0.004 2
1 991 . 1 1 A 83 83 LEU C C 83 176.303 178.333 -2.030 2
1 992 . 1 1 A 83 83 LEU CA C 83 58.067 58.389 -0.322 2
1 993 . 1 1 A 83 83 LEU CB C 83 41.061 41.508 -0.447 2
1 994 . 1 1 A 83 83 LEU N N 83 117.452 119.716 -2.264 2
1 995 . 1 1 A 84 84 ARG H H 84 7.651 8.161 -0.510 2
1 996 . 1 1 A 84 84 ARG HA H 84 2.230 3.540 -1.310 2
1 1003 . 1 1 A 84 84 ARG C C 84 175.902 178.403 -2.501 2
1 1004 . 1 1 A 84 84 ARG CA C 84 59.112 59.418 -0.306 2
1 1005 . 1 1 A 84 84 ARG CB C 84 28.579 29.693 -1.114 2
1 1007 . 1 1 A 84 84 ARG N N 84 119.586 119.606 -0.020 2
1 1008 . 1 1 A 85 85 SER H H 85 7.291 8.115 -0.824 2
1 1009 . 1 1 A 85 85 SER HA H 85 4.189 4.178 0.011 2
1 1012 . 1 1 A 85 85 SER C C 85 175.546 176.796 -1.250 2
1 1013 . 1 1 A 85 85 SER CA C 85 61.376 61.791 -0.415 2
1 1014 . 1 1 A 85 85 SER CB C 85 62.805 62.928 -0.123 2
1 1015 . 1 1 A 85 85 SER N N 85 112.921 115.430 -2.509 2
1 1016 . 1 1 A 86 86 HIS H H 86 8.156 7.624 0.532 2
1 1017 . 1 1 A 86 86 HIS HA H 86 4.782 4.206 0.576 2
1 1022 . 1 1 A 86 86 HIS C C 86 176.851 177.495 -0.644 2
1 1023 . 1 1 A 86 86 HIS CA C 86 58.898 59.493 -0.595 2
1 1024 . 1 1 A 86 86 HIS CB C 86 31.110 29.873 1.237 2
1 1027 . 1 1 A 86 86 HIS N N 86 119.258 118.911 0.347 2
1 1028 . 1 1 A 87 87 TYR H H 87 9.180 8.261 0.919 2
1 1029 . 1 1 A 87 87 TYR HA H 87 3.913 3.906 0.007 2
1 1036 . 1 1 A 87 87 TYR C C 87 176.841 177.486 -0.645 2
1 1037 . 1 1 A 87 87 TYR CA C 87 63.526 61.499 2.027 2
1 1038 . 1 1 A 87 87 TYR CB C 87 39.431 38.324 1.107 2
1 1041 . 1 1 A 87 87 TYR N N 87 120.625 119.946 0.679 2
1 1042 . 1 1 A 88 88 GLU H H 88 9.028 8.428 0.600 2
1 1043 . 1 1 A 88 88 GLU HA H 88 3.682 3.994 -0.312 2
1 1048 . 1 1 A 88 88 GLU C C 88 175.833 178.474 -2.641 2
1 1049 . 1 1 A 88 88 GLU CA C 88 59.730 59.961 -0.231 2
1 1050 . 1 1 A 88 88 GLU CB C 88 30.009 29.390 0.619 2
1 1052 . 1 1 A 88 88 GLU N N 88 119.531 118.993 0.538 2
1 1053 . 1 1 A 89 89 ARG H H 89 8.052 7.795 0.257 2
1 1054 . 1 1 A 89 89 ARG HA H 89 4.292 4.423 -0.131 2
1 1061 . 1 1 A 89 89 ARG C C 89 176.045 177.560 -1.515 2
1 1062 . 1 1 A 89 89 ARG CA C 89 58.538 57.675 0.863 2
1 1063 . 1 1 A 89 89 ARG CB C 89 31.841 31.120 0.720 2
1 1065 . 1 1 A 89 89 ARG N N 89 114.741 118.237 -3.496 2
1 1066 . 1 1 A 90 90 ILE H H 90 8.141 7.750 0.391 2
1 1067 . 1 1 A 90 90 ILE HA H 90 4.296 3.668 0.628 2
1 1075 . 1 1 A 90 90 ILE C C 90 174.461 176.924 -2.463 2
1 1076 . 1 1 A 90 90 ILE CA C 90 63.649 63.124 0.525 2
1 1077 . 1 1 A 90 90 ILE CB C 90 40.626 39.009 1.617 2
1 1079 . 1 1 A 90 90 ILE N N 90 113.421 118.584 -5.163 2
1 1080 . 1 1 A 91 91 VAL H H 91 7.350 7.619 -0.269 2
1 1081 . 1 1 A 91 91 VAL HA H 91 4.144 3.696 0.448 2
1 1089 . 1 1 A 91 91 VAL C C 91 175.422 176.863 -1.441 2
1 1090 . 1 1 A 91 91 VAL CA C 91 65.042 63.872 1.170 2
1 1091 . 1 1 A 91 91 VAL CB C 91 33.215 31.342 1.873 2
1 1092 . 1 1 A 91 91 VAL N N 91 118.215 120.625 -2.410 2
1 1093 . 1 1 A 92 92 TYR H H 92 8.565 8.103 0.462 2
1 1094 . 1 1 A 92 92 TYR HA H 92 4.217 4.223 -0.006 2
1 1099 . 1 1 A 92 92 TYR C C 92 171.495 175.100 -3.605 2
1 1100 . 1 1 A 92 92 TYR CA C 92 61.558 62.320 -0.762 2
1 1101 . 1 1 A 92 92 TYR CB C 92 36.757 37.234 -0.477 2
1 1102 . 1 1 A 92 92 TYR N N 92 121.370 122.019 -0.650 2
1 1103 . 1 1 A 93 93 PRO HA H 93 4.136 4.374 -0.238 2
1 1108 . 1 1 A 93 93 PRO C C 93 177.077 178.420 -1.343 2
1 1109 . 1 1 A 93 93 PRO CA C 93 66.037 65.978 0.059 2
1 1110 . 1 1 A 93 93 PRO CB C 93 31.482 30.932 0.550 2
1 1111 . 1 1 A 94 94 TYR H H 94 6.517 7.484 -0.967 2
1 1112 . 1 1 A 94 94 TYR HA H 94 2.798 4.392 -1.594 2
1 1119 . 1 1 A 94 94 TYR C C 94 174.985 178.121 -3.136 2
1 1120 . 1 1 A 94 94 TYR CA C 94 59.356 59.670 -0.314 2
1 1121 . 1 1 A 94 94 TYR CB C 94 37.987 37.166 0.821 2
1 1124 . 1 1 A 94 94 TYR N N 94 115.987 117.476 -1.489 2
1 1125 . 1 1 A 95 95 GLU H H 95 8.205 8.347 -0.142 2
1 1126 . 1 1 A 95 95 GLU HA H 95 3.682 4.125 -0.443 2
1 1131 . 1 1 A 95 95 GLU C C 95 178.530 178.957 -0.427 2
1 1132 . 1 1 A 95 95 GLU CA C 95 58.910 59.744 -0.834 2
1 1133 . 1 1 A 95 95 GLU CB C 95 29.187 29.337 -0.150 2
1 1134 . 1 1 A 95 95 GLU N N 95 119.946 121.360 -1.414 2
1 1135 . 1 1 A 96 96 MET H H 96 8.248 8.026 0.222 2
1 1136 . 1 1 A 96 96 MET HA H 96 4.172 4.199 -0.027 2
1 1142 . 1 1 A 96 96 MET C C 96 176.874 178.142 -1.268 2
1 1143 . 1 1 A 96 96 MET CA C 96 57.159 58.925 -1.766 2
1 1144 . 1 1 A 96 96 MET CB C 96 31.829 32.353 -0.524 2
1 1146 . 1 1 A 96 96 MET N N 96 117.570 119.080 -1.510 2
1 1147 . 1 1 A 97 97 TYR H H 97 7.445 8.347 -0.902 2
1 1148 . 1 1 A 97 97 TYR HA H 97 4.248 4.007 0.241 2
1 1155 . 1 1 A 97 97 TYR C C 97 176.476 177.264 -0.788 2
1 1156 . 1 1 A 97 97 TYR CA C 97 60.470 61.791 -1.321 2
1 1157 . 1 1 A 97 97 TYR CB C 97 38.612 38.421 0.191 2
1 1160 . 1 1 A 97 97 TYR N N 97 122.246 121.398 0.848 2
1 1161 . 1 1 A 98 98 GLN H H 98 8.087 8.634 -0.547 2
1 1162 . 1 1 A 98 98 GLN HA H 98 3.793 3.577 0.216 2
1 1169 . 1 1 A 98 98 GLN C C 98 175.549 178.271 -2.722 2
1 1170 . 1 1 A 98 98 GLN CA C 98 57.365 58.795 -1.430 2
1 1171 . 1 1 A 98 98 GLN CB C 98 28.901 28.705 0.196 2
1 1173 . 1 1 A 98 98 GLN N N 98 118.769 119.293 -0.524 2
1 1175 . 1 1 A 99 99 SER H H 99 7.724 8.230 -0.506 2
1 1176 . 1 1 A 99 99 SER HA H 99 4.293 4.238 0.055 2
1 1179 . 1 1 A 99 99 SER C C 99 173.696 177.135 -3.439 2
1 1180 . 1 1 A 99 99 SER CA C 99 59.566 62.015 -2.449 2
1 1181 . 1 1 A 99 99 SER CB C 99 63.847 62.628 1.219 2
1 1182 . 1 1 A 99 99 SER N N 99 113.257 116.103 -2.846 2
1 1183 . 1 1 A 100 100 GLY H H 100 7.751 8.330 -0.579 2
1 1184 . 1 1 A 100 100 GLY HA2 H 100 3.813 3.859 -0.046 2
1 1185 . 1 1 A 100 100 GLY HA3 H 100 3.934 3.867 0.067 2
1 1186 . 1 1 A 100 100 GLY C C 100 172.643 176.164 -3.521 2
1 1187 . 1 1 A 100 100 GLY CA C 100 45.570 46.997 -1.427 2
1 1188 . 1 1 A 100 100 GLY N N 100 109.750 108.800 0.950 2
1 1189 . 1 1 A 101 101 ALA H H 101 7.824 7.857 -0.034 2
1 1190 . 1 1 A 101 101 ALA HA H 101 4.221 3.979 0.242 2
1 1194 . 1 1 A 101 101 ALA C C 101 175.639 179.013 -3.374 2
1 1195 . 1 1 A 101 101 ALA CA C 101 52.745 54.401 -1.656 2
1 1196 . 1 1 A 101 101 ALA CB C 101 19.437 18.484 0.953 2
1 1197 . 1 1 A 101 101 ALA N N 101 123.241 124.425 -1.184 2
1 1198 . 1 1 A 102 102 ASN H H 102 8.191 7.902 0.289 2
1 1199 . 1 1 A 102 102 ASN HA H 102 4.658 4.691 -0.033 2
1 1204 . 1 1 A 102 102 ASN C C 102 173.337 175.418 -2.081 2
1 1205 . 1 1 A 102 102 ASN CA C 102 53.374 55.282 -1.908 2
1 1206 . 1 1 A 102 102 ASN CB C 102 38.819 39.438 -0.619 2
1 1207 . 1 1 A 102 102 ASN N N 102 116.572 115.146 1.426 2
1 1209 . 1 1 A 103 103 LEU H H 103 8.065 7.713 0.352 2
1 1210 . 1 1 A 103 103 LEU HA H 103 4.363 4.656 -0.293 2
1 1219 . 1 1 A 103 103 LEU C C 103 175.637 174.798 0.840 2
1 1220 . 1 1 A 103 103 LEU CA C 103 55.292 53.743 1.549 2
1 1221 . 1 1 A 103 103 LEU CB C 103 42.433 44.924 -2.491 2
1 1222 . 1 1 A 103 103 LEU N N 103 122.074 114.192 7.882 2
1 1223 . 1 1 A 104 104 VAL H H 104 8.055 8.942 -0.887 2
1 1224 . 1 1 A 104 104 VAL HA H 104 4.131 4.817 -0.686 2
1 1232 . 1 1 A 104 104 VAL C C 104 174.364 175.320 -0.956 2
1 1233 . 1 1 A 104 104 VAL CA C 104 62.552 60.631 1.921 2
1 1234 . 1 1 A 104 104 VAL CB C 104 32.766 33.581 -0.815 2
1 1235 . 1 1 A 104 104 VAL N N 104 120.606 121.837 -1.231 2
1 1236 . 1 1 A 105 105 CYS H H 105 8.392 8.637 -0.245 2
1 1237 . 1 1 A 105 105 CYS HA H 105 4.535 4.766 -0.231 2
1 1240 . 1 1 A 105 105 CYS C C 105 172.593 175.533 -2.940 2
1 1241 . 1 1 A 105 105 CYS CA C 105 58.449 58.957 -0.508 2
1 1242 . 1 1 A 105 105 CYS CB C 105 27.952 29.151 -1.198 2
1 1243 . 1 1 A 105 105 CYS N N 105 122.791 127.716 -4.925 2
1 1244 . 1 1 A 106 106 ASN H H 106 8.575 8.213 0.362 2
1 1245 . 1 1 A 106 106 ASN HA H 106 4.843 4.828 0.015 2
1 1250 . 1 1 A 106 106 ASN C C 106 173.594 176.863 -3.269 2
1 1251 . 1 1 A 106 106 ASN CA C 106 53.337 54.080 -0.743 2
1 1252 . 1 1 A 106 106 ASN CB C 106 39.088 38.639 0.449 2
1 1253 . 1 1 A 106 106 ASN N N 106 122.001 118.684 3.317 2
1 1255 . 1 1 A 107 107 THR H H 107 8.090 7.967 0.123 2
1 1256 . 1 1 A 107 107 THR HA H 107 4.348 4.134 0.214 2
1 1261 . 1 1 A 107 107 THR C C 107 172.516 176.490 -3.974 2
1 1262 . 1 1 A 107 107 THR CA C 107 61.803 65.663 -3.860 2
1 1263 . 1 1 A 107 107 THR CB C 107 69.812 68.684 1.128 2
1 1265 . 1 1 A 107 107 THR N N 107 114.374 114.980 -0.606 2
1 1266 . 1 1 A 108 108 ARG H H 108 8.322 7.897 0.425 2
1 1267 . 1 1 A 108 108 ARG HA H 108 4.634 4.255 0.379 2
1 1274 . 1 1 A 108 108 ARG C C 108 172.608 177.052 -4.444 2
1 1275 . 1 1 A 108 108 ARG CA C 108 54.026 60.500 -6.474 2
1 1276 . 1 1 A 108 108 ARG CB C 108 30.246 30.119 0.127 2
1 1278 . 1 1 A 108 108 ARG N N 108 124.017 121.425 2.592 2
1 1279 . 1 1 A 109 109 PRO HA H 109 4.354 4.472 -0.118 2
1 1286 . 1 1 A 109 109 PRO C C 109 174.978 178.719 -3.740 2
1 1287 . 1 1 A 109 109 PRO CA C 109 63.396 65.268 -1.872 2
1 1288 . 1 1 A 109 109 PRO CB C 109 32.046 31.534 0.513 2
1 1290 . 1 1 A 110 110 PHE H H 110 8.123 7.893 0.230 2
1 1291 . 1 1 A 110 110 PHE HA H 110 4.619 4.433 0.186 2
1 1296 . 1 1 A 110 110 PHE C C 110 173.856 177.195 -3.339 2
1 1297 . 1 1 A 110 110 PHE CA C 110 57.353 62.019 -4.666 2
1 1298 . 1 1 A 110 110 PHE CB C 110 39.364 39.295 0.069 2
1 1301 . 1 1 A 110 110 PHE N N 110 119.265 118.969 0.296 2
1 1302 . 1 1 A 111 111 ASP H H 111 8.161 8.455 -0.294 2
1 1303 . 1 1 A 111 111 ASP HA H 111 4.613 4.450 0.163 2
1 1306 . 1 1 A 111 111 ASP C C 111 174.114 178.614 -4.500 2
1 1307 . 1 1 A 111 111 ASP CA C 111 54.350 57.597 -3.247 2
1 1308 . 1 1 A 111 111 ASP CB C 111 41.413 40.969 0.444 2
1 1309 . 1 1 A 111 111 ASP N N 111 121.764 119.301 2.463 2
1 1310 . 1 1 A 112 112 ASN H H 112 8.307 8.453 -0.146 2
1 1311 . 1 1 A 112 112 ASN HA H 112 4.662 4.553 0.109 2
1 1316 . 1 1 A 112 112 ASN C C 112 173.595 177.607 -4.012 2
1 1317 . 1 1 A 112 112 ASN CA C 112 53.486 56.394 -2.908 2
1 1318 . 1 1 A 112 112 ASN CB C 112 39.225 38.797 0.428 2
1 1319 . 1 1 A 112 112 ASN N N 112 119.154 117.628 1.526 2
1 1321 . 1 1 A 113 113 GLU H H 113 8.404 8.235 0.169 2
1 1322 . 1 1 A 113 113 GLU HA H 113 4.264 4.122 0.142 2
1 1327 . 1 1 A 113 113 GLU C C 113 174.886 178.942 -4.056 2
1 1328 . 1 1 A 113 113 GLU CA C 113 56.681 59.054 -2.373 2
1 1329 . 1 1 A 113 113 GLU CB C 113 30.403 29.641 0.762 2
1 1331 . 1 1 A 113 113 GLU N N 113 120.943 119.215 1.728 2
1 1332 . 1 1 A 114 114 GLU H H 114 8.388 8.281 0.107 2
1 1333 . 1 1 A 114 114 GLU HA H 114 4.262 4.213 0.050 2
1 1338 . 1 1 A 114 114 GLU C C 114 174.819 177.924 -3.105 2
1 1339 . 1 1 A 114 114 GLU CA C 114 56.769 59.221 -2.452 2
1 1340 . 1 1 A 114 114 GLU CB C 114 30.125 29.721 0.405 2
1 1342 . 1 1 A 114 114 GLU N N 114 121.869 119.847 2.022 2
1 1343 . 1 1 A 115 115 LYS H H 115 8.236 8.002 0.234 2
1 1344 . 1 1 A 115 115 LYS HA H 115 4.347 4.489 -0.142 2
1 1353 . 1 1 A 115 115 LYS C C 115 174.633 176.021 -1.388 2
1 1354 . 1 1 A 115 115 LYS CA C 115 56.426 56.116 0.310 2
1 1355 . 1 1 A 115 115 LYS CB C 115 33.277 32.753 0.524 2
1 1359 . 1 1 A 115 115 LYS N N 115 121.997 118.286 3.711 2
1 1360 . 1 1 A 116 116 ASP H H 116 8.386 8.319 0.066 2
1 1361 . 1 1 A 116 116 ASP HA H 116 4.600 4.455 0.145 2
1 1364 . 1 1 A 116 116 ASP C C 116 173.448 175.832 -2.384 2
1 1365 . 1 1 A 116 116 ASP CA C 116 54.773 55.832 -1.059 2
1 1366 . 1 1 A 116 116 ASP CB C 116 41.029 40.403 0.626 2
1 1367 . 1 1 A 116 116 ASP N N 116 121.057 121.111 -0.054 2
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