data_6866_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 6866
_Entry.PDB_ID 2ETT
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 7 7 HIS HA H 7 4.623 4.617 0.006 1
1 4 . 1 1 1 A 7 7 HIS C C 7 174.747 173.966 0.781 1
1 5 . 1 1 1 A 7 7 HIS CA C 7 56.189 54.755 1.434 1
1 6 . 1 1 1 A 7 7 HIS CB C 7 30.028 28.901 1.127 1
1 7 . 1 1 1 A 8 8 LEU H H 8 8.283 8.424 -0.141 1
1 8 . 1 1 1 A 8 8 LEU HA H 8 4.249 4.569 -0.320 1
1 10 . 1 1 1 A 8 8 LEU C C 8 176.700 175.833 0.867 1
1 11 . 1 1 1 A 8 8 LEU CA C 8 55.498 53.963 1.535 1
1 12 . 1 1 1 A 8 8 LEU CB C 8 42.568 41.430 1.138 1
1 13 . 1 1 1 A 8 8 LEU N N 8 122.916 121.148 1.768 1
1 14 . 1 1 1 A 9 9 GLU H H 9 8.623 9.004 -0.381 1
1 15 . 1 1 1 A 9 9 GLU HA H 9 4.311 4.760 -0.449 1
1 16 . 1 1 1 A 9 9 GLU C C 9 174.811 175.311 -0.500 1
1 17 . 1 1 1 A 9 9 GLU CA C 9 56.377 55.705 0.672 1
1 18 . 1 1 1 A 9 9 GLU CB C 9 29.557 30.777 -1.220 1
1 20 . 1 1 1 A 9 9 GLU N N 9 121.512 124.674 -3.162 1
1 21 . 1 1 1 A 10 10 LEU H H 10 7.853 8.856 -1.003 1
1 22 . 1 1 1 A 10 10 LEU HA H 10 5.225 5.447 -0.222 1
1 31 . 1 1 1 A 10 10 LEU C C 10 174.637 174.573 0.064 1
1 32 . 1 1 1 A 10 10 LEU CA C 10 54.513 53.736 0.777 1
1 33 . 1 1 1 A 10 10 LEU CB C 10 45.187 45.286 -0.099 1
1 36 . 1 1 1 A 10 10 LEU N N 10 123.592 129.093 -5.501 1
1 37 . 1 1 1 A 11 11 GLU H H 11 8.894 9.106 -0.212 1
1 38 . 1 1 1 A 11 11 GLU HA H 11 4.765 5.108 -0.343 1
1 43 . 1 1 1 A 11 11 GLU C C 11 174.563 175.396 -0.833 1
1 44 . 1 1 1 A 11 11 GLU CA C 11 55.047 55.010 0.037 1
1 45 . 1 1 1 A 11 11 GLU CB C 11 33.760 32.411 1.349 1
1 47 . 1 1 1 A 11 11 GLU N N 11 124.055 125.648 -1.593 1
1 48 . 1 1 1 A 12 12 VAL H H 12 8.607 8.912 -0.305 1
1 49 . 1 1 1 A 12 12 VAL HA H 12 5.174 5.052 0.122 1
1 57 . 1 1 1 A 12 12 VAL C C 12 173.573 175.424 -1.851 1
1 58 . 1 1 1 A 12 12 VAL CA C 12 60.296 61.212 -0.916 1
1 59 . 1 1 1 A 12 12 VAL CB C 12 35.689 33.366 2.323 1
1 62 . 1 1 1 A 12 12 VAL N N 12 120.878 125.114 -4.236 1
1 63 . 1 1 1 A 13 13 HIS H H 13 8.982 8.914 0.068 1
1 64 . 1 1 1 A 13 13 HIS HA H 13 4.824 5.181 -0.357 1
1 69 . 1 1 1 A 13 13 HIS C C 13 173.236 171.769 1.467 1
1 70 . 1 1 1 A 13 13 HIS CA C 13 54.906 54.067 0.839 1
1 71 . 1 1 1 A 13 13 HIS CB C 13 33.496 32.262 1.234 1
1 72 . 1 1 1 A 13 13 HIS N N 13 121.504 121.854 -0.350 1
1 73 . 1 1 1 A 14 14 ILE H H 14 10.442 9.217 1.225 1
1 74 . 1 1 1 A 14 14 ILE HA H 14 5.458 4.588 0.870 1
1 84 . 1 1 1 A 14 14 ILE CA C 14 58.386 57.855 0.531 1
1 85 . 1 1 1 A 14 14 ILE CB C 14 38.596 38.284 0.312 1
1 88 . 1 1 1 A 14 14 ILE N N 14 119.923 121.428 -1.505 1
1 89 . 1 1 1 A 15 15 PRO HA H 15 4.560 4.573 -0.013 1
1 95 . 1 1 1 A 15 15 PRO C C 15 176.907 176.374 0.533 1
1 96 . 1 1 1 A 15 15 PRO CA C 15 64.342 64.301 0.041 1
1 97 . 1 1 1 A 15 15 PRO CB C 15 32.924 32.119 0.805 1
1 100 . 1 1 1 A 16 16 SER H H 16 7.331 7.300 0.031 1
1 101 . 1 1 1 A 16 16 SER HA H 16 4.822 5.076 -0.254 1
1 104 . 1 1 1 A 16 16 SER C C 16 171.253 172.600 -1.347 1
1 105 . 1 1 1 A 16 16 SER CA C 16 57.135 57.816 -0.681 1
1 106 . 1 1 1 A 16 16 SER CB C 16 65.947 67.176 -1.229 1
1 107 . 1 1 1 A 16 16 SER N N 16 107.745 114.310 -6.565 1
1 108 . 1 1 1 A 17 17 VAL H H 17 8.350 8.443 -0.093 1
1 109 . 1 1 1 A 17 17 VAL HA H 17 4.926 4.978 -0.052 1
1 117 . 1 1 1 A 17 17 VAL C C 17 173.692 174.965 -1.273 1
1 118 . 1 1 1 A 17 17 VAL CA C 17 58.721 60.752 -2.031 1
1 119 . 1 1 1 A 17 17 VAL CB C 17 34.420 34.816 -0.396 1
1 122 . 1 1 1 A 17 17 VAL N N 17 118.680 122.756 -4.076 1
1 123 . 1 1 1 A 18 18 GLY H H 18 8.332 8.898 -0.566 1
1 124 . 1 1 1 A 18 18 GLY HA2 H 18 4.189 4.355 -0.166 1
1 125 . 1 1 1 A 18 18 GLY HA3 H 18 4.011 4.356 -0.345 1
1 126 . 1 1 1 A 18 18 GLY CA C 18 45.356 44.595 0.761 1
1 127 . 1 1 1 A 18 18 GLY N N 18 112.549 114.392 -1.843 1
1 128 . 1 1 1 A 19 19 PRO HA H 19 4.757 4.745 0.012 1
1 134 . 1 1 1 A 19 19 PRO C C 19 177.482 176.465 1.017 1
1 135 . 1 1 1 A 19 19 PRO CA C 19 62.848 62.623 0.225 1
1 136 . 1 1 1 A 19 19 PRO CB C 19 32.283 30.710 1.573 1
1 139 . 1 1 1 A 20 20 GLU H H 20 8.588 8.559 0.029 1
1 140 . 1 1 1 A 20 20 GLU HA H 20 4.147 4.614 -0.467 1
1 144 . 1 1 1 A 20 20 GLU C C 20 175.857 176.268 -0.411 1
1 145 . 1 1 1 A 20 20 GLU CA C 20 57.150 55.889 1.261 1
1 146 . 1 1 1 A 20 20 GLU CB C 20 30.923 30.669 0.254 1
1 148 . 1 1 1 A 20 20 GLU N N 20 122.087 117.425 4.662 1
1 149 . 1 1 1 A 21 21 ALA H H 21 8.352 7.498 0.854 1
1 150 . 1 1 1 A 21 21 ALA HA H 21 4.391 4.169 0.222 1
1 154 . 1 1 1 A 21 21 ALA C C 21 174.910 176.522 -1.612 1
1 155 . 1 1 1 A 21 21 ALA CA C 21 52.166 52.195 -0.029 1
1 156 . 1 1 1 A 21 21 ALA CB C 21 19.915 19.462 0.453 1
1 157 . 1 1 1 A 21 21 ALA N N 21 124.593 123.005 1.588 1
1 158 . 1 1 1 A 22 22 GLU H H 22 8.398 8.230 0.168 1
1 159 . 1 1 1 A 22 22 GLU HA H 22 4.331 4.412 -0.081 1
1 163 . 1 1 1 A 22 22 GLU C C 22 176.389 176.540 -0.151 1
1 164 . 1 1 1 A 22 22 GLU CA C 22 56.316 56.420 -0.104 1
1 165 . 1 1 1 A 22 22 GLU CB C 22 30.713 30.438 0.275 1
1 167 . 1 1 1 A 22 22 GLU N N 22 120.159 120.859 -0.700 1
1 168 . 1 1 1 A 23 23 GLY H H 23 8.246 8.825 -0.579 1
1 169 . 1 1 1 A 23 23 GLY HA2 H 23 4.162 4.052 0.110 1
1 170 . 1 1 1 A 23 23 GLY HA3 H 23 4.061 4.093 -0.032 1
1 171 . 1 1 1 A 23 23 GLY CA C 23 44.801 45.284 -0.483 1
1 172 . 1 1 1 A 23 23 GLY N N 23 110.080 113.288 -3.208 1
1 173 . 1 1 1 A 24 24 PRO HA H 24 4.417 4.620 -0.203 1
1 178 . 1 1 1 A 24 24 PRO C C 24 177.135 176.306 0.829 1
1 179 . 1 1 1 A 24 24 PRO CA C 24 63.520 62.408 1.112 1
1 180 . 1 1 1 A 24 24 PRO CB C 24 32.124 32.928 -0.804 1
1 183 . 1 1 1 A 25 25 ARG H H 25 8.409 8.537 -0.128 1
1 184 . 1 1 1 A 25 25 ARG HA H 25 4.298 4.342 -0.044 1
1 187 . 1 1 1 A 25 25 ARG C C 25 176.217 175.865 0.352 1
1 188 . 1 1 1 A 25 25 ARG CA C 25 56.237 55.571 0.666 1
1 189 . 1 1 1 A 25 25 ARG CB C 25 30.467 31.391 -0.924 1
1 192 . 1 1 1 A 25 25 ARG N N 25 120.147 121.547 -1.400 1
1 193 . 1 1 1 A 26 26 GLN H H 26 8.278 8.479 -0.201 1
1 194 . 1 1 1 A 26 26 GLN HA H 26 4.336 4.231 0.105 1
1 200 . 1 1 1 A 26 26 GLN C C 26 175.566 176.002 -0.436 1
1 201 . 1 1 1 A 26 26 GLN CA C 26 55.788 56.246 -0.458 1
1 202 . 1 1 1 A 26 26 GLN CB C 26 29.714 28.473 1.241 1
1 204 . 1 1 1 A 26 26 GLN N N 26 120.460 121.860 -1.400 1
1 206 . 1 1 1 A 27 27 SER H H 27 8.298 8.546 -0.248 1
1 208 . 1 1 1 A 27 27 SER CA C 27 56.156 55.631 0.525 1
1 209 . 1 1 1 A 27 27 SER CB C 27 63.813 64.931 -1.118 1
1 210 . 1 1 1 A 27 27 SER N N 27 117.382 120.662 -3.280 1
1 211 . 1 1 1 A 28 28 PRO HA H 28 4.366 4.361 0.005 1
1 216 . 1 1 1 A 28 28 PRO C C 28 177.555 178.322 -0.767 1
1 217 . 1 1 1 A 28 28 PRO CA C 28 64.486 65.694 -1.208 1
1 218 . 1 1 1 A 28 28 PRO CB C 28 31.892 31.700 0.192 1
1 221 . 1 1 1 A 29 29 GLU H H 29 8.582 8.020 0.562 1
1 222 . 1 1 1 A 29 29 GLU HA H 29 4.218 4.241 -0.023 1
1 226 . 1 1 1 A 29 29 GLU CA C 29 57.261 58.935 -1.674 1
1 227 . 1 1 1 A 29 29 GLU CB C 29 29.633 30.646 -1.013 1
1 229 . 1 1 1 A 29 29 GLU N N 29 118.309 115.432 2.877 1
1 230 . 1 1 1 A 30 30 LYS H H 30 7.955 7.861 0.094 1
1 231 . 1 1 1 A 30 30 LYS HA H 30 4.328 3.828 0.500 1
1 236 . 1 1 1 A 30 30 LYS C C 30 176.222 175.220 1.002 1
1 237 . 1 1 1 A 30 30 LYS CA C 30 56.247 57.287 -1.040 1
1 238 . 1 1 1 A 30 30 LYS CB C 30 32.720 29.534 3.186 1
1 242 . 1 1 1 A 30 30 LYS N N 30 120.129 116.174 3.955 1
1 243 . 1 1 1 A 31 31 SER H H 31 7.883 7.807 0.076 1
1 244 . 1 1 1 A 31 31 SER HA H 31 4.458 4.440 0.018 1
1 246 . 1 1 1 A 31 31 SER C C 31 174.129 175.584 -1.455 1
1 247 . 1 1 1 A 31 31 SER CA C 31 58.477 58.382 0.095 1
1 248 . 1 1 1 A 31 31 SER CB C 31 64.042 64.055 -0.013 1
1 249 . 1 1 1 A 31 31 SER N N 31 115.366 113.206 2.160 1
1 250 . 1 1 1 A 32 32 HIS H H 32 8.485 8.850 -0.365 1
1 251 . 1 1 1 A 32 32 HIS HA H 32 4.450 4.677 -0.227 1
1 255 . 1 1 1 A 32 32 HIS CA C 32 56.009 56.798 -0.789 1
1 256 . 1 1 1 A 32 32 HIS CB C 32 31.122 30.099 1.023 1
1 257 . 1 1 1 A 32 32 HIS N N 32 121.500 126.903 -5.403 1
1 258 . 1 1 1 A 33 33 MET H H 33 8.392 7.248 1.144 1
1 259 . 1 1 1 A 33 33 MET HA H 33 4.601 4.957 -0.356 1
1 265 . 1 1 1 A 33 33 MET C C 33 175.842 174.239 1.603 1
1 266 . 1 1 1 A 33 33 MET CA C 33 54.533 53.957 0.576 1
1 267 . 1 1 1 A 33 33 MET CB C 33 32.868 35.772 -2.904 1
1 270 . 1 1 1 A 33 33 MET N N 33 120.204 119.462 0.742 1
1 271 . 1 1 1 A 34 34 VAL H H 34 8.938 9.180 -0.242 1
1 272 . 1 1 1 A 34 34 VAL HA H 34 4.430 4.697 -0.267 1
1 280 . 1 1 1 A 34 34 VAL C C 34 174.149 173.866 0.283 1
1 281 . 1 1 1 A 34 34 VAL CA C 34 60.703 59.564 1.139 1
1 282 . 1 1 1 A 34 34 VAL CB C 34 34.319 35.558 -1.239 1
1 285 . 1 1 1 A 34 34 VAL N N 34 118.512 121.732 -3.220 1
1 286 . 1 1 1 A 35 35 PHE H H 35 9.242 7.850 1.392 1
1 287 . 1 1 1 A 35 35 PHE HA H 35 4.439 5.614 -1.175 1
1 294 . 1 1 1 A 35 35 PHE C C 35 174.831 173.274 1.557 1
1 295 . 1 1 1 A 35 35 PHE CA C 35 57.754 55.005 2.749 1
1 296 . 1 1 1 A 35 35 PHE CB C 35 38.959 41.719 -2.760 1
1 297 . 1 1 1 A 35 35 PHE N N 35 124.912 124.277 0.635 1
1 298 . 1 1 1 A 36 36 ARG H H 36 8.475 9.519 -1.044 1
1 299 . 1 1 1 A 36 36 ARG HA H 36 4.135 4.799 -0.664 1
1 304 . 1 1 1 A 36 36 ARG C C 36 172.865 175.669 -2.804 1
1 305 . 1 1 1 A 36 36 ARG CA C 36 56.895 54.859 2.036 1
1 306 . 1 1 1 A 36 36 ARG CB C 36 28.962 31.967 -3.005 1
1 308 . 1 1 1 A 36 36 ARG N N 36 125.680 122.186 3.494 1
1 309 . 1 1 1 A 37 37 VAL H H 37 8.066 8.944 -0.878 1
1 310 . 1 1 1 A 37 37 VAL HA H 37 4.292 4.762 -0.470 1
1 318 . 1 1 1 A 37 37 VAL C C 37 174.595 174.807 -0.212 1
1 319 . 1 1 1 A 37 37 VAL CA C 37 62.727 60.596 2.131 1
1 320 . 1 1 1 A 37 37 VAL CB C 37 31.102 33.404 -2.302 1
1 323 . 1 1 1 A 37 37 VAL N N 37 125.403 123.114 2.289 1
1 324 . 1 1 1 A 38 38 GLU H H 38 9.532 8.790 0.742 1
1 325 . 1 1 1 A 38 38 GLU HA H 38 4.895 5.197 -0.302 1
1 329 . 1 1 1 A 38 38 GLU C C 38 174.509 174.369 0.140 1
1 330 . 1 1 1 A 38 38 GLU CA C 38 55.650 55.370 0.280 1
1 331 . 1 1 1 A 38 38 GLU CB C 38 32.214 32.864 -0.650 1
1 333 . 1 1 1 A 38 38 GLU N N 38 129.885 121.431 8.454 1
1 334 . 1 1 1 A 39 39 VAL H H 39 9.035 8.640 0.395 1
1 335 . 1 1 1 A 39 39 VAL HA H 39 4.446 4.745 -0.299 1
1 343 . 1 1 1 A 39 39 VAL C C 39 173.661 173.594 0.067 1
1 344 . 1 1 1 A 39 39 VAL CA C 39 61.258 61.412 -0.154 1
1 345 . 1 1 1 A 39 39 VAL CB C 39 33.533 33.160 0.373 1
1 348 . 1 1 1 A 39 39 VAL N N 39 127.941 126.504 1.437 1
1 349 . 1 1 1 A 40 40 LEU H H 40 8.843 9.453 -0.610 1
1 350 . 1 1 1 A 40 40 LEU HA H 40 5.130 5.572 -0.442 1
1 360 . 1 1 1 A 40 40 LEU C C 40 175.581 175.166 0.415 1
1 361 . 1 1 1 A 40 40 LEU CA C 40 53.702 53.665 0.037 1
1 362 . 1 1 1 A 40 40 LEU CB C 40 43.989 44.647 -0.658 1
1 366 . 1 1 1 A 40 40 LEU N N 40 128.413 129.723 -1.310 1
1 367 . 1 1 1 A 41 41 CYS H H 41 8.959 8.754 0.205 1
1 368 . 1 1 1 A 41 41 CYS HA H 41 5.174 5.234 -0.060 1
1 371 . 1 1 1 A 41 41 CYS C C 41 175.043 173.620 1.423 1
1 372 . 1 1 1 A 41 41 CYS CA C 41 57.483 57.519 -0.036 1
1 373 . 1 1 1 A 41 41 CYS CB C 41 28.472 31.108 -2.636 1
1 374 . 1 1 1 A 41 41 CYS N N 41 124.738 123.509 1.229 1
1 375 . 1 1 1 A 42 42 SER H H 42 9.527 8.935 0.592 1
1 376 . 1 1 1 A 42 42 SER HA H 42 4.149 4.338 -0.189 1
1 379 . 1 1 1 A 42 42 SER C C 42 175.014 174.471 0.543 1
1 380 . 1 1 1 A 42 42 SER CA C 42 59.058 59.554 -0.496 1
1 381 . 1 1 1 A 42 42 SER CB C 42 62.287 61.843 0.444 1
1 382 . 1 1 1 A 42 42 SER N N 42 125.889 116.981 8.908 1
1 383 . 1 1 1 A 43 43 GLY H H 43 8.685 8.449 0.236 1
1 384 . 1 1 1 A 43 43 GLY HA2 H 43 3.594 3.960 -0.366 1
1 385 . 1 1 1 A 43 43 GLY HA3 H 43 4.210 3.986 0.224 1
1 386 . 1 1 1 A 43 43 GLY C C 43 173.664 173.730 -0.066 1
1 387 . 1 1 1 A 43 43 GLY CA C 43 45.404 45.110 0.294 1
1 388 . 1 1 1 A 43 43 GLY N N 43 104.633 106.326 -1.693 1
1 389 . 1 1 1 A 44 44 ARG H H 44 7.926 7.838 0.088 1
1 390 . 1 1 1 A 44 44 ARG HA H 44 4.678 4.665 0.013 1
1 395 . 1 1 1 A 44 44 ARG C C 44 175.261 175.533 -0.272 1
1 396 . 1 1 1 A 44 44 ARG CA C 44 55.011 54.878 0.133 1
1 397 . 1 1 1 A 44 44 ARG CB C 44 32.138 31.798 0.340 1
1 400 . 1 1 1 A 44 44 ARG N N 44 121.239 121.964 -0.725 1
1 401 . 1 1 1 A 45 45 ARG H H 45 8.775 9.008 -0.233 1
1 402 . 1 1 1 A 45 45 ARG HA H 45 5.770 5.166 0.604 1
1 409 . 1 1 1 A 45 45 ARG C C 45 176.064 175.669 0.395 1
1 410 . 1 1 1 A 45 45 ARG CA C 45 54.683 54.811 -0.128 1
1 411 . 1 1 1 A 45 45 ARG CB C 45 33.748 32.756 0.992 1
1 414 . 1 1 1 A 45 45 ARG N N 45 125.948 124.364 1.584 1
1 415 . 1 1 1 A 46 46 HIS H H 46 8.912 8.714 0.198 1
1 416 . 1 1 1 A 46 46 HIS HA H 46 4.927 5.783 -0.856 1
1 420 . 1 1 1 A 46 46 HIS C C 46 172.634 173.463 -0.829 1
1 421 . 1 1 1 A 46 46 HIS CA C 46 56.480 53.921 2.559 1
1 422 . 1 1 1 A 46 46 HIS CB C 46 33.608 32.315 1.293 1
1 423 . 1 1 1 A 46 46 HIS N N 46 121.825 117.438 4.387 1
1 424 . 1 1 1 A 47 47 THR H H 47 8.532 8.445 0.087 1
1 425 . 1 1 1 A 47 47 THR HA H 47 5.472 5.030 0.442 1
1 430 . 1 1 1 A 47 47 THR C C 47 174.442 174.160 0.282 1
1 431 . 1 1 1 A 47 47 THR CA C 47 61.093 62.278 -1.185 1
1 432 . 1 1 1 A 47 47 THR CB C 47 71.041 69.187 1.854 1
1 434 . 1 1 1 A 47 47 THR N N 47 115.450 120.397 -4.947 1
1 435 . 1 1 1 A 48 48 VAL H H 48 9.695 9.365 0.330 1
1 436 . 1 1 1 A 48 48 VAL HA H 48 4.677 4.650 0.027 1
1 444 . 1 1 1 A 48 48 VAL CA C 48 58.172 59.188 -1.016 1
1 445 . 1 1 1 A 48 48 VAL CB C 48 34.990 34.704 0.286 1
1 448 . 1 1 1 A 48 48 VAL N N 48 126.721 126.294 0.427 1
1 449 . 1 1 1 A 49 49 PRO HA H 49 5.087 4.782 0.305 1
1 453 . 1 1 1 A 49 49 PRO CA C 49 61.671 62.468 -0.797 1
1 454 . 1 1 1 A 49 49 PRO CB C 49 31.923 31.667 0.256 1
1 457 . 1 1 1 A 50 50 ARG H H 50 9.125 8.816 0.309 1
1 458 . 1 1 1 A 50 50 ARG HA H 50 4.974 4.593 0.381 1
1 464 . 1 1 1 A 50 50 ARG C C 50 176.187 174.362 1.825 1
1 465 . 1 1 1 A 50 50 ARG CA C 50 53.015 53.842 -0.827 1
1 466 . 1 1 1 A 50 50 ARG CB C 50 36.553 33.295 3.258 1
1 468 . 1 1 1 A 50 50 ARG N N 50 124.189 123.614 0.575 1
1 469 . 1 1 1 A 51 51 ARG H H 51 10.105 8.536 1.569 1
1 470 . 1 1 1 A 51 51 ARG HA H 51 5.196 3.947 1.249 1
1 475 . 1 1 1 A 51 51 ARG C C 51 178.865 176.720 2.145 1
1 476 . 1 1 1 A 51 51 ARG CA C 51 55.961 56.103 -0.142 1
1 477 . 1 1 1 A 51 51 ARG CB C 51 32.539 31.795 0.744 1
1 480 . 1 1 1 A 51 51 ARG N N 51 124.521 125.727 -1.206 1
1 481 . 1 1 1 A 52 52 TYR H H 52 10.397 8.972 1.425 1
1 482 . 1 1 1 A 52 52 TYR HA H 52 4.360 4.264 0.096 1
1 487 . 1 1 1 A 52 52 TYR C C 52 178.143 177.523 0.620 1
1 488 . 1 1 1 A 52 52 TYR CA C 52 63.538 62.669 0.869 1
1 489 . 1 1 1 A 52 52 TYR CB C 52 38.784 38.800 -0.016 1
1 490 . 1 1 1 A 52 52 TYR N N 52 124.772 128.300 -3.528 1
1 491 . 1 1 1 A 53 53 SER H H 53 9.231 8.347 0.884 1
1 492 . 1 1 1 A 53 53 SER HA H 53 4.175 4.669 -0.494 1
1 493 . 1 1 1 A 53 53 SER C C 53 177.220 177.561 -0.341 1
1 494 . 1 1 1 A 53 53 SER CA C 53 61.606 61.519 0.087 1
1 495 . 1 1 1 A 53 53 SER N N 53 113.262 114.085 -0.823 1
1 496 . 1 1 1 A 54 54 GLU H H 54 7.807 7.643 0.164 1
1 497 . 1 1 1 A 54 54 GLU HA H 54 4.392 4.081 0.311 1
1 501 . 1 1 1 A 54 54 GLU C C 54 180.361 179.641 0.720 1
1 502 . 1 1 1 A 54 54 GLU CA C 54 59.497 59.139 0.358 1
1 503 . 1 1 1 A 54 54 GLU CB C 54 30.708 29.649 1.059 1
1 504 . 1 1 1 A 54 54 GLU N N 54 121.949 123.068 -1.119 1
1 505 . 1 1 1 A 55 55 PHE H H 55 8.133 7.644 0.489 1
1 506 . 1 1 1 A 55 55 PHE HA H 55 4.007 4.235 -0.228 1
1 513 . 1 1 1 A 55 55 PHE C C 55 176.531 178.474 -1.943 1
1 514 . 1 1 1 A 55 55 PHE CA C 55 61.848 60.294 1.554 1
1 515 . 1 1 1 A 55 55 PHE CB C 55 38.847 38.524 0.323 1
1 516 . 1 1 1 A 55 55 PHE N N 55 119.998 119.890 0.108 1
1 517 . 1 1 1 A 56 56 HIS H H 56 7.907 8.539 -0.632 1
1 518 . 1 1 1 A 56 56 HIS HA H 56 3.324 4.345 -1.021 1
1 522 . 1 1 1 A 56 56 HIS C C 56 176.748 177.321 -0.573 1
1 523 . 1 1 1 A 56 56 HIS CA C 56 58.770 60.320 -1.550 1
1 524 . 1 1 1 A 56 56 HIS CB C 56 30.404 29.869 0.535 1
1 525 . 1 1 1 A 56 56 HIS N N 56 119.173 119.091 0.082 1
1 526 . 1 1 1 A 57 57 ALA H H 57 7.962 8.601 -0.639 1
1 527 . 1 1 1 A 57 57 ALA HA H 57 3.865 3.924 -0.059 1
1 531 . 1 1 1 A 57 57 ALA C C 57 180.075 179.868 0.207 1
1 532 . 1 1 1 A 57 57 ALA CA C 57 54.996 55.107 -0.111 1
1 533 . 1 1 1 A 57 57 ALA CB C 57 18.226 17.918 0.308 1
1 534 . 1 1 1 A 57 57 ALA N N 57 120.094 120.964 -0.870 1
1 535 . 1 1 1 A 58 58 LEU H H 58 7.295 8.274 -0.979 1
1 536 . 1 1 1 A 58 58 LEU HA H 58 3.994 4.006 -0.012 1
1 546 . 1 1 1 A 58 58 LEU C C 58 177.428 178.588 -1.160 1
1 547 . 1 1 1 A 58 58 LEU CA C 58 58.342 57.980 0.362 1
1 548 . 1 1 1 A 58 58 LEU CB C 58 40.851 41.621 -0.770 1
1 552 . 1 1 1 A 58 58 LEU N N 58 119.404 120.485 -1.081 1
1 553 . 1 1 1 A 59 59 HIS H H 59 7.805 8.490 -0.685 1
1 554 . 1 1 1 A 59 59 HIS HA H 59 4.286 4.057 0.229 1
1 558 . 1 1 1 A 59 59 HIS C C 59 177.001 177.289 -0.288 1
1 559 . 1 1 1 A 59 59 HIS CA C 59 60.141 59.888 0.253 1
1 560 . 1 1 1 A 59 59 HIS CB C 59 31.072 29.875 1.197 1
1 561 . 1 1 1 A 59 59 HIS N N 59 119.040 118.161 0.879 1
1 562 . 1 1 1 A 60 60 LYS H H 60 7.715 7.886 -0.171 1
1 563 . 1 1 1 A 60 60 LYS HA H 60 3.456 3.873 -0.417 1
1 570 . 1 1 1 A 60 60 LYS C C 60 178.464 179.241 -0.777 1
1 571 . 1 1 1 A 60 60 LYS CA C 60 59.629 58.899 0.730 1
1 572 . 1 1 1 A 60 60 LYS CB C 60 32.354 32.010 0.344 1
1 576 . 1 1 1 A 60 60 LYS N N 60 114.225 118.755 -4.530 1
1 577 . 1 1 1 A 61 61 ARG H H 61 7.486 7.824 -0.338 1
1 578 . 1 1 1 A 61 61 ARG HA H 61 4.202 4.033 0.169 1
1 584 . 1 1 1 A 61 61 ARG C C 61 178.995 178.886 0.109 1
1 585 . 1 1 1 A 61 61 ARG CA C 61 58.387 58.760 -0.373 1
1 586 . 1 1 1 A 61 61 ARG CB C 61 31.216 30.018 1.198 1
1 589 . 1 1 1 A 61 61 ARG N N 61 115.929 120.066 -4.137 1
1 590 . 1 1 1 A 62 62 ILE H H 62 8.066 7.552 0.514 1
1 591 . 1 1 1 A 62 62 ILE HA H 62 4.491 3.917 0.574 1
1 601 . 1 1 1 A 62 62 ILE C C 62 177.838 177.324 0.514 1
1 602 . 1 1 1 A 62 62 ILE CA C 62 63.399 63.749 -0.350 1
1 603 . 1 1 1 A 62 62 ILE CB C 62 39.699 37.357 2.342 1
1 606 . 1 1 1 A 62 62 ILE N N 62 111.456 118.431 -6.975 1
1 607 . 1 1 1 A 63 63 LYS H H 63 8.158 8.467 -0.309 1
1 608 . 1 1 1 A 63 63 LYS HA H 63 4.136 3.812 0.324 1
1 615 . 1 1 1 A 63 63 LYS C C 63 176.358 178.678 -2.320 1
1 616 . 1 1 1 A 63 63 LYS CA C 63 58.753 58.590 0.163 1
1 617 . 1 1 1 A 63 63 LYS CB C 63 30.825 31.372 -0.547 1
1 621 . 1 1 1 A 63 63 LYS N N 63 120.800 123.289 -2.489 1
1 622 . 1 1 1 A 64 64 LYS H H 64 7.687 7.815 -0.128 1
1 623 . 1 1 1 A 64 64 LYS HA H 64 4.301 4.073 0.228 1
1 628 . 1 1 1 A 64 64 LYS C C 64 177.084 178.440 -1.356 1
1 629 . 1 1 1 A 64 64 LYS CA C 64 57.237 58.724 -1.487 1
1 630 . 1 1 1 A 64 64 LYS CB C 64 32.502 32.147 0.355 1
1 634 . 1 1 1 A 64 64 LYS N N 64 116.548 119.740 -3.192 1
1 635 . 1 1 1 A 65 65 LEU H H 65 7.476 7.873 -0.397 1
1 636 . 1 1 1 A 65 65 LEU HA H 65 4.219 4.194 0.025 1
1 645 . 1 1 1 A 65 65 LEU C C 65 175.886 176.072 -0.186 1
1 646 . 1 1 1 A 65 65 LEU CA C 65 55.542 57.115 -1.573 1
1 647 . 1 1 1 A 65 65 LEU CB C 65 45.493 42.991 2.502 1
1 650 . 1 1 1 A 65 65 LEU N N 65 118.000 120.737 -2.737 1
1 651 . 1 1 1 A 66 66 TYR H H 66 7.672 8.250 -0.578 1
1 652 . 1 1 1 A 66 66 TYR HA H 66 4.762 5.091 -0.329 1
1 660 . 1 1 1 A 66 66 TYR C C 66 174.199 174.726 -0.527 1
1 661 . 1 1 1 A 66 66 TYR CA C 66 56.013 55.270 0.743 1
1 662 . 1 1 1 A 66 66 TYR CB C 66 40.380 41.173 -0.793 1
1 663 . 1 1 1 A 66 66 TYR N N 66 116.805 113.713 3.092 1
1 664 . 1 1 1 A 67 67 LYS H H 67 8.547 8.511 0.036 1
1 665 . 1 1 1 A 67 67 LYS HA H 67 4.436 4.267 0.169 1
1 670 . 1 1 1 A 67 67 LYS C C 67 175.727 176.124 -0.397 1
1 671 . 1 1 1 A 67 67 LYS CA C 67 56.598 56.800 -0.202 1
1 672 . 1 1 1 A 67 67 LYS CB C 67 32.743 32.439 0.304 1
1 676 . 1 1 1 A 67 67 LYS N N 67 120.929 120.135 0.794 1
1 677 . 1 1 1 A 68 68 VAL H H 68 8.168 8.130 0.038 1
1 678 . 1 1 1 A 68 68 VAL HA H 68 4.869 4.373 0.496 1
1 686 . 1 1 1 A 68 68 VAL CA C 68 57.389 58.816 -1.427 1
1 687 . 1 1 1 A 68 68 VAL CB C 68 34.017 35.222 -1.205 1
1 690 . 1 1 1 A 68 68 VAL N N 68 116.467 123.745 -7.278 1
1 691 . 1 1 1 A 69 69 PRO HA H 69 4.674 4.636 0.038 1
1 696 . 1 1 1 A 69 69 PRO C C 69 178.013 176.072 1.941 1
1 697 . 1 1 1 A 69 69 PRO CA C 69 61.443 62.274 -0.831 1
1 698 . 1 1 1 A 69 69 PRO CB C 69 32.231 32.909 -0.678 1
1 701 . 1 1 1 A 70 70 ASP H H 70 8.167 8.460 -0.293 1
1 702 . 1 1 1 A 70 70 ASP HA H 70 4.531 4.398 0.133 1
1 705 . 1 1 1 A 70 70 ASP C C 70 175.660 176.325 -0.665 1
1 706 . 1 1 1 A 70 70 ASP CA C 70 55.148 54.970 0.178 1
1 707 . 1 1 1 A 70 70 ASP CB C 70 40.876 40.991 -0.115 1
1 708 . 1 1 1 A 70 70 ASP N N 70 116.671 120.688 -4.017 1
1 709 . 1 1 1 A 71 71 PHE H H 71 8.387 8.129 0.258 1
1 710 . 1 1 1 A 71 71 PHE HA H 71 4.076 4.346 -0.270 1
1 717 . 1 1 1 A 71 71 PHE CA C 71 55.672 54.295 1.377 1
1 718 . 1 1 1 A 71 71 PHE CB C 71 39.155 40.658 -1.503 1
1 719 . 1 1 1 A 71 71 PHE N N 71 126.533 119.689 6.844 1
1 720 . 1 1 1 A 72 72 PRO HA H 72 4.156 4.912 -0.756 1
1 727 . 1 1 1 A 72 72 PRO CA C 72 63.079 62.528 0.551 1
1 728 . 1 1 1 A 72 72 PRO CB C 72 32.107 32.622 -0.515 1
1 731 . 1 1 1 A 73 73 SER H H 73 8.468 8.361 0.107 1
1 733 . 1 1 1 A 73 73 SER CA C 73 56.133 57.412 -1.279 1
1 734 . 1 1 1 A 73 73 SER CB C 73 63.991 64.619 -0.628 1
1 735 . 1 1 1 A 73 73 SER N N 73 121.533 117.818 3.715 1
1 736 . 1 1 1 A 74 74 LYS HA H 74 4.574 4.138 0.436 1
1 739 . 1 1 1 A 74 74 LYS CA C 74 55.659 57.539 -1.880 1
1 740 . 1 1 1 A 74 74 LYS CB C 74 30.550 33.414 -2.864 1
1 741 . 1 1 1 A 75 75 ARG H H 75 7.962 7.429 0.533 1
1 742 . 1 1 1 A 75 75 ARG HA H 75 4.162 4.745 -0.583 1
1 746 . 1 1 1 A 75 75 ARG CA C 75 56.123 54.915 1.208 1
1 747 . 1 1 1 A 75 75 ARG CB C 75 31.179 31.553 -0.374 1
1 749 . 1 1 1 A 75 75 ARG N N 75 121.665 120.212 1.453 1
1 750 . 1 1 1 A 76 76 LEU H H 76 8.071 8.477 -0.406 1
1 751 . 1 1 1 A 76 76 LEU HA H 76 4.618 4.565 0.053 1
1 759 . 1 1 1 A 76 76 LEU CA C 76 52.764 51.120 1.644 1
1 760 . 1 1 1 A 76 76 LEU CB C 76 41.918 43.955 -2.037 1
1 762 . 1 1 1 A 76 76 LEU N N 76 124.196 124.874 -0.678 1
1 763 . 1 1 1 A 77 77 PRO HA H 77 4.393 4.350 0.043 1
1 767 . 1 1 1 A 77 77 PRO CA C 77 63.746 62.110 1.636 1
1 770 . 1 1 1 A 78 78 ASN H H 78 8.379 8.790 -0.411 1
1 771 . 1 1 1 A 78 78 ASN HA H 78 4.586 4.378 0.208 1
1 776 . 1 1 1 A 78 78 ASN C C 78 175.648 174.941 0.707 1
1 777 . 1 1 1 A 78 78 ASN CA C 78 53.591 54.425 -0.834 1
1 778 . 1 1 1 A 78 78 ASN CB C 78 37.826 38.946 -1.120 1
1 779 . 1 1 1 A 78 78 ASN N N 78 115.292 121.157 -5.865 1
1 781 . 1 1 1 A 79 79 TRP H H 79 7.900 7.837 0.063 1
1 782 . 1 1 1 A 79 79 TRP HA H 79 4.326 4.379 -0.053 1
1 788 . 1 1 1 A 79 79 TRP CA C 79 58.825 58.696 0.129 1
1 789 . 1 1 1 A 79 79 TRP CB C 79 29.090 26.810 2.280 1
1 790 . 1 1 1 A 79 79 TRP N N 79 119.525 118.312 1.213 1
1 792 . 1 1 1 A 80 80 ARG H H 80 8.060 8.176 -0.116 1
1 793 . 1 1 1 A 80 80 ARG HA H 80 3.913 4.226 -0.313 1
1 798 . 1 1 1 A 80 80 ARG C C 80 177.024 178.368 -1.344 1
1 799 . 1 1 1 A 80 80 ARG CA C 80 58.292 58.626 -0.334 1
1 800 . 1 1 1 A 80 80 ARG CB C 80 30.146 29.703 0.443 1
1 803 . 1 1 1 A 80 80 ARG N N 80 118.864 118.931 -0.067 1
1 804 . 1 1 1 A 81 81 THR H H 81 7.725 7.876 -0.151 1
1 805 . 1 1 1 A 81 81 THR HA H 81 4.297 3.912 0.385 1
1 809 . 1 1 1 A 81 81 THR CA C 81 62.481 66.924 -4.443 1
1 811 . 1 1 1 A 81 81 THR N N 81 109.863 115.990 -6.127 1
1 812 . 1 1 1 A 82 82 ARG HA H 82 4.341 4.709 -0.368 1
1 816 . 1 1 1 A 82 82 ARG C C 82 177.261 175.489 1.772 1
1 817 . 1 1 1 A 82 82 ARG CA C 82 56.846 53.888 2.958 1
1 818 . 1 1 1 A 82 82 ARG CB C 82 30.288 32.922 -2.634 1
1 820 . 1 1 1 A 83 83 GLY H H 83 8.321 8.763 -0.442 1
1 821 . 1 1 1 A 83 83 GLY HA2 H 83 3.957 4.230 -0.273 1
1 822 . 1 1 1 A 83 83 GLY C C 83 175.185 175.047 0.138 1
1 823 . 1 1 1 A 83 83 GLY CA C 83 46.297 44.127 2.170 1
1 824 . 1 1 1 A 83 83 GLY N N 83 109.146 107.368 1.778 1
1 825 . 1 1 1 A 84 84 LEU H H 84 8.303 8.773 -0.470 1
1 826 . 1 1 1 A 84 84 LEU HA H 84 4.018 3.844 0.174 1
1 835 . 1 1 1 A 84 84 LEU C C 84 178.552 178.411 0.141 1
1 836 . 1 1 1 A 84 84 LEU CA C 84 58.236 56.953 1.283 1
1 837 . 1 1 1 A 84 84 LEU CB C 84 41.837 41.294 0.543 1
1 840 . 1 1 1 A 84 84 LEU N N 84 122.662 119.701 2.961 1
1 841 . 1 1 1 A 85 85 GLU H H 85 8.233 8.201 0.032 1
1 842 . 1 1 1 A 85 85 GLU HA H 85 4.371 3.914 0.457 1
1 846 . 1 1 1 A 85 85 GLU C C 85 178.555 179.326 -0.771 1
1 847 . 1 1 1 A 85 85 GLU CA C 85 58.377 59.582 -1.205 1
1 848 . 1 1 1 A 85 85 GLU CB C 85 28.675 29.075 -0.400 1
1 850 . 1 1 1 A 85 85 GLU N N 85 119.781 119.190 0.591 1
1 851 . 1 1 1 A 86 86 GLN H H 86 7.877 7.759 0.118 1
1 852 . 1 1 1 A 86 86 GLN HA H 86 4.100 3.977 0.123 1
1 858 . 1 1 1 A 86 86 GLN C C 86 179.557 178.555 1.002 1
1 859 . 1 1 1 A 86 86 GLN CA C 86 58.955 59.215 -0.260 1
1 860 . 1 1 1 A 86 86 GLN CB C 86 28.191 28.403 -0.212 1
1 862 . 1 1 1 A 86 86 GLN N N 86 118.042 120.145 -2.103 1
1 863 . 1 1 1 A 87 87 ARG H H 87 8.169 7.978 0.191 1
1 864 . 1 1 1 A 87 87 ARG HA H 87 3.975 4.019 -0.044 1
1 868 . 1 1 1 A 87 87 ARG C C 87 177.051 178.229 -1.178 1
1 869 . 1 1 1 A 87 87 ARG CA C 87 59.006 59.349 -0.343 1
1 870 . 1 1 1 A 87 87 ARG CB C 87 30.383 29.161 1.222 1
1 872 . 1 1 1 A 87 87 ARG N N 87 121.381 119.676 1.705 1
1 873 . 1 1 1 A 88 88 ARG H H 88 8.593 8.220 0.373 1
1 874 . 1 1 1 A 88 88 ARG HA H 88 3.726 3.730 -0.004 1
1 876 . 1 1 1 A 88 88 ARG C C 88 177.520 178.722 -1.202 1
1 877 . 1 1 1 A 88 88 ARG CA C 88 60.751 59.480 1.271 1
1 878 . 1 1 1 A 88 88 ARG CB C 88 30.153 30.181 -0.028 1
1 879 . 1 1 1 A 88 88 ARG N N 88 120.863 119.539 1.324 1
1 880 . 1 1 1 A 89 89 GLN H H 89 8.355 8.255 0.100 1
1 881 . 1 1 1 A 89 89 GLN HA H 89 3.887 3.928 -0.041 1
1 887 . 1 1 1 A 89 89 GLN C C 89 179.499 178.247 1.252 1
1 888 . 1 1 1 A 89 89 GLN CA C 89 59.603 59.215 0.388 1
1 889 . 1 1 1 A 89 89 GLN CB C 89 28.464 27.965 0.499 1
1 891 . 1 1 1 A 89 89 GLN N N 89 116.860 119.252 -2.392 1
1 893 . 1 1 1 A 90 90 GLY H H 90 8.406 8.185 0.221 1
1 894 . 1 1 1 A 90 90 GLY HA2 H 90 3.672 3.385 0.287 1
1 895 . 1 1 1 A 90 90 GLY HA3 H 90 3.871 3.491 0.380 1
1 896 . 1 1 1 A 90 90 GLY C C 90 177.033 175.247 1.786 1
1 897 . 1 1 1 A 90 90 GLY CA C 90 46.813 46.913 -0.100 1
1 898 . 1 1 1 A 90 90 GLY N N 90 107.679 107.304 0.375 1
1 899 . 1 1 1 A 91 91 LEU H H 91 8.504 7.664 0.840 1
1 900 . 1 1 1 A 91 91 LEU HA H 91 3.784 3.808 -0.024 1
1 910 . 1 1 1 A 91 91 LEU C C 91 178.003 179.237 -1.234 1
1 911 . 1 1 1 A 91 91 LEU CA C 91 57.354 57.459 -0.105 1
1 912 . 1 1 1 A 91 91 LEU CB C 91 40.359 40.980 -0.621 1
1 916 . 1 1 1 A 91 91 LEU N N 91 123.959 121.373 2.586 1
1 917 . 1 1 1 A 92 92 GLU H H 92 8.324 8.274 0.050 1
1 918 . 1 1 1 A 92 92 GLU HA H 92 3.732 3.943 -0.211 1
1 922 . 1 1 1 A 92 92 GLU C C 92 177.272 178.465 -1.193 1
1 923 . 1 1 1 A 92 92 GLU CA C 92 60.651 59.878 0.773 1
1 924 . 1 1 1 A 92 92 GLU CB C 92 30.843 29.230 1.613 1
1 926 . 1 1 1 A 92 92 GLU N N 92 121.991 121.126 0.865 1
1 927 . 1 1 1 A 93 93 ALA H H 93 8.126 7.833 0.293 1
1 928 . 1 1 1 A 93 93 ALA HA H 93 4.160 4.080 0.080 1
1 932 . 1 1 1 A 93 93 ALA C C 93 180.818 179.282 1.536 1
1 933 . 1 1 1 A 93 93 ALA CA C 93 54.828 54.970 -0.142 1
1 934 . 1 1 1 A 93 93 ALA CB C 93 18.032 18.067 -0.035 1
1 935 . 1 1 1 A 93 93 ALA N N 93 120.066 121.488 -1.422 1
1 936 . 1 1 1 A 94 94 TYR H H 94 7.916 7.448 0.468 1
1 937 . 1 1 1 A 94 94 TYR HA H 94 4.139 4.352 -0.213 1
1 942 . 1 1 1 A 94 94 TYR C C 94 175.895 178.446 -2.551 1
1 943 . 1 1 1 A 94 94 TYR CA C 94 61.915 61.597 0.318 1
1 944 . 1 1 1 A 94 94 TYR CB C 94 38.740 38.078 0.662 1
1 945 . 1 1 1 A 94 94 TYR N N 94 121.179 116.114 5.065 1
1 946 . 1 1 1 A 95 95 ILE H H 95 7.983 8.690 -0.707 1
1 947 . 1 1 1 A 95 95 ILE HA H 95 3.614 3.655 -0.041 1
1 957 . 1 1 1 A 95 95 ILE C C 95 174.678 178.148 -3.470 1
1 958 . 1 1 1 A 95 95 ILE CA C 95 63.461 64.967 -1.506 1
1 959 . 1 1 1 A 95 95 ILE CB C 95 36.625 37.419 -0.794 1
1 963 . 1 1 1 A 95 95 ILE N N 95 116.397 120.169 -3.772 1
1 964 . 1 1 1 A 96 96 GLN H H 96 8.175 8.365 -0.190 1
1 965 . 1 1 1 A 96 96 GLN HA H 96 3.763 4.069 -0.306 1
1 970 . 1 1 1 A 96 96 GLN C C 96 179.042 178.525 0.517 1
1 971 . 1 1 1 A 96 96 GLN CA C 96 59.270 59.511 -0.241 1
1 972 . 1 1 1 A 96 96 GLN CB C 96 27.696 28.253 -0.557 1
1 974 . 1 1 1 A 96 96 GLN N N 96 116.631 120.524 -3.893 1
1 976 . 1 1 1 A 97 97 GLY H H 97 8.222 8.382 -0.160 1
1 977 . 1 1 1 A 97 97 GLY HA2 H 97 3.661 3.764 -0.103 1
1 978 . 1 1 1 A 97 97 GLY HA3 H 97 3.806 3.775 0.031 1
1 979 . 1 1 1 A 97 97 GLY C C 97 175.449 176.101 -0.652 1
1 980 . 1 1 1 A 97 97 GLY CA C 97 46.917 47.401 -0.484 1
1 981 . 1 1 1 A 97 97 GLY N N 97 107.315 106.894 0.421 1
1 982 . 1 1 1 A 98 98 ILE H H 98 7.630 8.073 -0.443 1
1 983 . 1 1 1 A 98 98 ILE HA H 98 3.399 3.900 -0.501 1
1 993 . 1 1 1 A 98 98 ILE C C 98 178.683 177.952 0.731 1
1 994 . 1 1 1 A 98 98 ILE CA C 98 66.402 64.734 1.668 1
1 995 . 1 1 1 A 98 98 ILE CB C 98 38.037 37.437 0.600 1
1 999 . 1 1 1 A 98 98 ILE N N 98 120.644 120.622 0.022 1
1 1000 . 1 1 1 A 99 99 LEU H H 99 7.076 7.859 -0.783 1
1 1001 . 1 1 1 A 99 99 LEU HA H 99 4.133 4.040 0.093 1
1 1010 . 1 1 1 A 99 99 LEU C C 99 178.128 178.028 0.100 1
1 1011 . 1 1 1 A 99 99 LEU CA C 99 57.129 57.985 -0.856 1
1 1012 . 1 1 1 A 99 99 LEU CB C 99 41.108 41.715 -0.607 1
1 1014 . 1 1 1 A 99 99 LEU N N 99 116.844 123.878 -7.034 1
1 1015 . 1 1 1 A 100 100 TYR H H 100 7.890 8.277 -0.387 1
1 1016 . 1 1 1 A 100 100 TYR HA H 100 4.550 4.250 0.300 1
1 1021 . 1 1 1 A 100 100 TYR C C 100 178.210 177.559 0.651 1
1 1022 . 1 1 1 A 100 100 TYR CA C 100 59.452 60.848 -1.396 1
1 1023 . 1 1 1 A 100 100 TYR CB C 100 38.786 38.884 -0.098 1
1 1024 . 1 1 1 A 100 100 TYR N N 100 116.427 120.236 -3.809 1
1 1025 . 1 1 1 A 101 101 LEU H H 101 8.041 8.428 -0.387 1
1 1026 . 1 1 1 A 101 101 LEU HA H 101 4.158 3.875 0.283 1
1 1036 . 1 1 1 A 101 101 LEU C C 101 176.808 177.514 -0.706 1
1 1037 . 1 1 1 A 101 101 LEU CA C 101 56.156 58.261 -2.105 1
1 1038 . 1 1 1 A 101 101 LEU CB C 101 44.307 41.826 2.481 1
1 1041 . 1 1 1 A 101 101 LEU N N 101 116.493 120.488 -3.995 1
1 1042 . 1 1 1 A 102 102 ASN H H 102 7.146 8.189 -1.043 1
1 1043 . 1 1 1 A 102 102 ASN HA H 102 5.056 5.042 0.014 1
1 1046 . 1 1 1 A 102 102 ASN CA C 102 52.704 54.698 -1.994 1
1 1047 . 1 1 1 A 102 102 ASN CB C 102 42.424 39.873 2.551 1
1 1048 . 1 1 1 A 102 102 ASN N N 102 114.922 113.648 1.274 1
1 1049 . 1 1 1 A 103 103 GLN H H 103 8.477 8.206 0.271 1
1 1050 . 1 1 1 A 103 103 GLN HA H 103 3.866 4.300 -0.434 1
1 1054 . 1 1 1 A 103 103 GLN C C 103 176.110 176.121 -0.011 1
1 1055 . 1 1 1 A 103 103 GLN CA C 103 58.451 55.357 3.094 1
1 1056 . 1 1 1 A 103 103 GLN CB C 103 28.896 28.528 0.368 1
1 1058 . 1 1 1 A 103 103 GLN N N 103 120.252 118.123 2.129 1
1 1059 . 1 1 1 A 104 104 GLU H H 104 7.930 8.211 -0.281 1
1 1060 . 1 1 1 A 104 104 GLU HA H 104 4.591 4.625 -0.034 1
1 1064 . 1 1 1 A 104 104 GLU C C 104 175.397 176.088 -0.691 1
1 1065 . 1 1 1 A 104 104 GLU CA C 104 54.058 58.498 -4.440 1
1 1066 . 1 1 1 A 104 104 GLU CB C 104 31.272 28.168 3.104 1
1 1068 . 1 1 1 A 104 104 GLU N N 104 117.295 118.079 -0.784 1
1 1069 . 1 1 1 A 105 105 VAL H H 105 8.546 8.233 0.313 1
1 1070 . 1 1 1 A 105 105 VAL HA H 105 3.823 4.235 -0.412 1
1 1078 . 1 1 1 A 105 105 VAL CA C 105 60.706 60.859 -0.153 1
1 1079 . 1 1 1 A 105 105 VAL CB C 105 32.126 32.860 -0.734 1
1 1082 . 1 1 1 A 105 105 VAL N N 105 124.511 124.250 0.261 1
1 1083 . 1 1 1 A 106 106 PRO HA H 106 3.997 4.477 -0.480 1
1 1089 . 1 1 1 A 106 106 PRO C C 106 178.240 177.819 0.421 1
1 1090 . 1 1 1 A 106 106 PRO CA C 106 62.961 63.413 -0.452 1
1 1091 . 1 1 1 A 106 106 PRO CB C 106 32.321 32.141 0.180 1
1 1094 . 1 1 1 A 107 107 LYS H H 107 9.122 8.937 0.185 1
1 1095 . 1 1 1 A 107 107 LYS HA H 107 3.813 3.971 -0.158 1
1 1101 . 1 1 1 A 107 107 LYS C C 107 178.563 177.684 0.879 1
1 1102 . 1 1 1 A 107 107 LYS CA C 107 60.085 59.385 0.700 1
1 1103 . 1 1 1 A 107 107 LYS CB C 107 31.632 32.461 -0.829 1
1 1106 . 1 1 1 A 107 107 LYS N N 107 129.017 125.125 3.892 1
1 1107 . 1 1 1 A 108 108 GLU H H 108 10.370 7.946 2.424 1
1 1108 . 1 1 1 A 108 108 GLU HA H 108 3.991 4.174 -0.183 1
1 1111 . 1 1 1 A 108 108 GLU C C 108 180.366 178.759 1.607 1
1 1112 . 1 1 1 A 108 108 GLU CA C 108 60.337 58.927 1.410 1
1 1113 . 1 1 1 A 108 108 GLU CB C 108 29.178 29.512 -0.334 1
1 1115 . 1 1 1 A 108 108 GLU N N 108 118.335 118.879 -0.544 1
1 1116 . 1 1 1 A 109 109 LEU H H 109 7.393 7.830 -0.437 1
1 1117 . 1 1 1 A 109 109 LEU HA H 109 4.220 4.227 -0.007 1
1 1126 . 1 1 1 A 109 109 LEU C C 109 177.378 178.248 -0.870 1
1 1127 . 1 1 1 A 109 109 LEU CA C 109 56.618 57.520 -0.902 1
1 1128 . 1 1 1 A 109 109 LEU CB C 109 41.898 41.911 -0.013 1
1 1131 . 1 1 1 A 109 109 LEU N N 109 118.285 120.732 -2.447 1
1 1132 . 1 1 1 A 110 110 LEU H H 110 7.641 7.891 -0.250 1
1 1133 . 1 1 1 A 110 110 LEU HA H 110 3.796 3.947 -0.151 1
1 1142 . 1 1 1 A 110 110 LEU C C 110 179.103 178.257 0.846 1
1 1143 . 1 1 1 A 110 110 LEU CA C 110 59.046 58.410 0.636 1
1 1144 . 1 1 1 A 110 110 LEU CB C 110 40.228 41.452 -1.224 1
1 1147 . 1 1 1 A 110 110 LEU N N 110 120.162 120.065 0.097 1
1 1148 . 1 1 1 A 111 111 GLU H H 111 7.916 8.309 -0.393 1
1 1149 . 1 1 1 A 111 111 GLU HA H 111 4.080 4.098 -0.018 1
1 1153 . 1 1 1 A 111 111 GLU C C 111 179.967 178.978 0.989 1
1 1154 . 1 1 1 A 111 111 GLU CA C 111 59.243 59.036 0.207 1
1 1155 . 1 1 1 A 111 111 GLU CB C 111 29.576 29.137 0.439 1
1 1157 . 1 1 1 A 111 111 GLU N N 111 117.360 118.634 -1.274 1
1 1158 . 1 1 1 A 112 112 PHE H H 112 7.712 7.898 -0.186 1
1 1159 . 1 1 1 A 112 112 PHE HA H 112 4.224 4.224 0.000 1
1 1164 . 1 1 1 A 112 112 PHE C C 112 177.180 177.019 0.161 1
1 1165 . 1 1 1 A 112 112 PHE CA C 112 61.407 61.242 0.165 1
1 1166 . 1 1 1 A 112 112 PHE CB C 112 40.172 39.651 0.521 1
1 1167 . 1 1 1 A 112 112 PHE N N 112 123.042 120.861 2.181 1
1 1168 . 1 1 1 A 113 113 LEU H H 113 8.056 7.991 0.065 1
1 1169 . 1 1 1 A 113 113 LEU HA H 113 4.147 4.258 -0.111 1
1 1175 . 1 1 1 A 113 113 LEU C C 113 173.717 176.018 -2.301 1
1 1176 . 1 1 1 A 113 113 LEU CA C 113 54.093 54.320 -0.227 1
1 1177 . 1 1 1 A 113 113 LEU CB C 113 41.517 42.289 -0.772 1
1 1179 . 1 1 1 A 113 113 LEU N N 113 115.595 116.852 -1.257 1
1 1180 . 1 1 1 A 114 114 ARG H H 114 7.902 8.043 -0.141 1
1 1181 . 1 1 1 A 114 114 ARG HA H 114 3.817 4.253 -0.436 1
1 1182 . 1 1 1 A 114 114 ARG C C 114 174.566 176.343 -1.777 1
1 1183 . 1 1 1 A 114 114 ARG CA C 114 57.233 57.119 0.114 1
1 1184 . 1 1 1 A 114 114 ARG CB C 114 27.788 28.758 -0.970 1
1 1185 . 1 1 1 A 114 114 ARG N N 114 116.021 118.862 -2.841 1
1 1186 . 1 1 1 A 115 115 LEU H H 115 8.160 7.949 0.211 1
1 1187 . 1 1 1 A 115 115 LEU HA H 115 4.462 4.294 0.168 1
1 1195 . 1 1 1 A 115 115 LEU C C 115 176.374 176.398 -0.024 1
1 1196 . 1 1 1 A 115 115 LEU CA C 115 53.965 55.089 -1.124 1
1 1197 . 1 1 1 A 115 115 LEU CB C 115 44.077 40.946 3.131 1
1 1199 . 1 1 1 A 115 115 LEU N N 115 118.089 119.068 -0.979 1
1 1200 . 1 1 1 A 116 116 ARG H H 116 8.066 7.722 0.344 1
1 1201 . 1 1 1 A 116 116 ARG HA H 116 4.172 4.044 0.128 1
1 1203 . 1 1 1 A 116 116 ARG CA C 116 55.961 57.078 -1.117 1
1 1204 . 1 1 1 A 116 116 ARG CB C 116 31.379 30.502 0.877 1
1 1205 . 1 1 1 A 116 116 ARG N N 116 120.852 122.215 -1.363 1
1 1206 . 1 1 1 A 117 117 HIS H H 117 7.928 9.055 -1.127 1
1 1207 . 1 1 1 A 117 117 HIS HA H 117 4.557 4.243 0.314 1
1 1211 . 1 1 1 A 117 117 HIS CA C 117 55.937 57.024 -1.087 1
1 1212 . 1 1 1 A 117 117 HIS CB C 117 30.875 29.076 1.799 1
1 1213 . 1 1 1 A 118 118 PHE H H 118 8.183 7.633 0.550 1
1 1214 . 1 1 1 A 118 118 PHE HA H 118 4.730 4.330 0.400 1
1 1219 . 1 1 1 A 118 118 PHE CA C 118 55.716 57.564 -1.848 1
1 1220 . 1 1 1 A 118 118 PHE CB C 118 39.263 39.838 -0.575 1
1 1221 . 1 1 1 A 118 118 PHE N N 118 123.480 120.840 2.640 1
1 1222 . 1 1 1 A 119 119 PRO HA H 119 4.398 4.464 -0.066 1
1 1227 . 1 1 1 A 119 119 PRO C C 119 176.666 175.359 1.307 1
1 1228 . 1 1 1 A 119 119 PRO CA C 119 63.377 62.359 1.018 1
1 1229 . 1 1 1 A 119 119 PRO CB C 119 32.059 32.408 -0.349 1
1 1232 . 1 1 1 A 120 120 THR H H 120 8.054 8.536 -0.482 1
1 1233 . 1 1 1 A 120 120 THR HA H 120 4.273 5.010 -0.737 1
1 1238 . 1 1 1 A 120 120 THR C C 120 174.154 171.880 2.274 1
1 1239 . 1 1 1 A 120 120 THR CA C 120 61.893 59.712 2.181 1
1 1240 . 1 1 1 A 120 120 THR CB C 120 69.736 71.226 -1.490 1
1 1242 . 1 1 1 A 120 120 THR N N 120 113.088 115.015 -1.927 1
1 1243 . 1 1 1 A 121 121 ASP H H 121 8.209 8.380 -0.171 1
1 1244 . 1 1 1 A 121 121 ASP HA H 121 4.876 5.206 -0.330 1
1 1247 . 1 1 1 A 121 121 ASP CA C 121 52.126 50.427 1.699 1
1 1248 . 1 1 1 A 121 121 ASP CB C 121 41.553 42.797 -1.244 1
1 1249 . 1 1 1 A 121 121 ASP N N 121 123.630 122.542 1.088 1
1 1250 . 1 1 1 A 122 122 PRO HA H 122 4.363 4.362 0.001 1
1 1255 . 1 1 1 A 122 122 PRO C C 122 177.344 176.991 0.353 1
1 1256 . 1 1 1 A 122 122 PRO CA C 122 63.913 64.843 -0.930 1
1 1257 . 1 1 1 A 122 122 PRO CB C 122 32.116 31.812 0.304 1
1 1260 . 1 1 1 A 123 123 LYS H H 123 8.344 8.275 0.069 1
1 1261 . 1 1 1 A 123 123 LYS HA H 123 4.244 4.511 -0.267 1
1 1266 . 1 1 1 A 123 123 LYS C C 123 176.637 176.193 0.444 1
1 1267 . 1 1 1 A 123 123 LYS CA C 123 56.359 55.048 1.311 1
1 1268 . 1 1 1 A 123 123 LYS CB C 123 32.367 30.574 1.793 1
1 1272 . 1 1 1 A 123 123 LYS N N 123 119.110 118.288 0.822 1
1 1273 . 1 1 1 A 124 124 ALA H H 124 7.929 7.823 0.106 1
1 1274 . 1 1 1 A 124 124 ALA HA H 124 4.248 4.586 -0.338 1
1 1278 . 1 1 1 A 124 124 ALA C C 124 177.648 176.887 0.761 1
1 1279 . 1 1 1 A 124 124 ALA CA C 124 52.618 51.505 1.113 1
1 1280 . 1 1 1 A 124 124 ALA CB C 124 19.379 20.416 -1.037 1
1 1281 . 1 1 1 A 124 124 ALA N N 124 123.825 125.456 -1.631 1
1 1282 . 1 1 1 A 125 125 SER H H 125 8.134 7.642 0.492 1
1 1283 . 1 1 1 A 125 125 SER HA H 125 4.341 4.901 -0.560 1
1 1286 . 1 1 1 A 125 125 SER C C 125 174.172 174.713 -0.541 1
1 1287 . 1 1 1 A 125 125 SER CA C 125 58.391 56.048 2.343 1
1 1288 . 1 1 1 A 125 125 SER CB C 125 63.748 66.344 -2.596 1
1 1289 . 1 1 1 A 125 125 SER N N 125 114.454 110.686 3.768 1
1 1290 . 1 1 1 A 126 126 ASN H H 126 8.242 9.082 -0.840 1
1 1291 . 1 1 1 A 126 126 ASN HA H 126 4.657 4.777 -0.120 1
1 1294 . 1 1 1 A 126 126 ASN C C 126 174.624 176.494 -1.870 1
1 1295 . 1 1 1 A 126 126 ASN CA C 126 53.292 54.894 -1.602 1
1 1296 . 1 1 1 A 126 126 ASN CB C 126 38.797 39.870 -1.073 1
1 1297 . 1 1 1 A 126 126 ASN N N 126 120.102 119.394 0.708 1
1 1298 . 1 1 1 A 127 127 TRP H H 127 8.051 8.169 -0.118 1
1 1299 . 1 1 1 A 127 127 TRP HA H 127 4.694 4.917 -0.223 1
1 1302 . 1 1 1 A 127 127 TRP C C 127 175.479 175.975 -0.496 1
1 1303 . 1 1 1 A 127 127 TRP CA C 127 57.096 57.274 -0.178 1
1 1304 . 1 1 1 A 127 127 TRP CB C 127 29.820 30.673 -0.853 1
1 1305 . 1 1 1 A 127 127 TRP N N 127 121.198 117.142 4.056 1
1 1 . 2 1 1 A 7 7 HIS HA H 7 4.623 4.011 0.612 1
1 4 . 2 1 1 A 7 7 HIS C C 7 174.747 173.842 0.905 1
1 5 . 2 1 1 A 7 7 HIS CA C 7 56.189 56.520 -0.331 1
1 6 . 2 1 1 A 7 7 HIS CB C 7 30.028 28.039 1.989 1
1 7 . 2 1 1 A 8 8 LEU H H 8 8.283 7.699 0.584 1
1 8 . 2 1 1 A 8 8 LEU HA H 8 4.249 4.311 -0.062 1
1 10 . 2 1 1 A 8 8 LEU C C 8 176.700 176.487 0.213 1
1 11 . 2 1 1 A 8 8 LEU CA C 8 55.498 54.049 1.449 1
1 12 . 2 1 1 A 8 8 LEU CB C 8 42.568 43.510 -0.942 1
1 13 . 2 1 1 A 8 8 LEU N N 8 122.916 119.900 3.016 1
1 14 . 2 1 1 A 9 9 GLU H H 9 8.623 8.692 -0.069 1
1 15 . 2 1 1 A 9 9 GLU HA H 9 4.311 3.846 0.465 1
1 16 . 2 1 1 A 9 9 GLU C C 9 174.811 175.114 -0.303 1
1 17 . 2 1 1 A 9 9 GLU CA C 9 56.377 56.996 -0.619 1
1 18 . 2 1 1 A 9 9 GLU CB C 9 29.557 28.290 1.267 1
1 20 . 2 1 1 A 9 9 GLU N N 9 121.512 117.735 3.777 1
1 21 . 2 1 1 A 10 10 LEU H H 10 7.853 7.988 -0.135 1
1 22 . 2 1 1 A 10 10 LEU HA H 10 5.225 4.931 0.294 1
1 31 . 2 1 1 A 10 10 LEU C C 10 174.637 175.304 -0.667 1
1 32 . 2 1 1 A 10 10 LEU CA C 10 54.513 53.792 0.721 1
1 33 . 2 1 1 A 10 10 LEU CB C 10 45.187 45.076 0.111 1
1 36 . 2 1 1 A 10 10 LEU N N 10 123.592 121.739 1.853 1
1 37 . 2 1 1 A 11 11 GLU H H 11 8.894 8.868 0.026 1
1 38 . 2 1 1 A 11 11 GLU HA H 11 4.765 5.039 -0.274 1
1 43 . 2 1 1 A 11 11 GLU C C 11 174.563 175.458 -0.895 1
1 44 . 2 1 1 A 11 11 GLU CA C 11 55.047 54.989 0.058 1
1 45 . 2 1 1 A 11 11 GLU CB C 11 33.760 31.603 2.157 1
1 47 . 2 1 1 A 11 11 GLU N N 11 124.055 123.723 0.332 1
1 48 . 2 1 1 A 12 12 VAL H H 12 8.607 8.945 -0.338 1
1 49 . 2 1 1 A 12 12 VAL HA H 12 5.174 5.572 -0.398 1
1 57 . 2 1 1 A 12 12 VAL C C 12 173.573 175.332 -1.759 1
1 58 . 2 1 1 A 12 12 VAL CA C 12 60.296 61.198 -0.902 1
1 59 . 2 1 1 A 12 12 VAL CB C 12 35.689 33.940 1.749 1
1 62 . 2 1 1 A 12 12 VAL N N 12 120.878 125.268 -4.390 1
1 63 . 2 1 1 A 13 13 HIS H H 13 8.982 8.810 0.172 1
1 64 . 2 1 1 A 13 13 HIS HA H 13 4.824 5.236 -0.412 1
1 69 . 2 1 1 A 13 13 HIS C C 13 173.236 171.829 1.407 1
1 70 . 2 1 1 A 13 13 HIS CA C 13 54.906 54.295 0.611 1
1 71 . 2 1 1 A 13 13 HIS CB C 13 33.496 32.105 1.391 1
1 72 . 2 1 1 A 13 13 HIS N N 13 121.504 121.717 -0.213 1
1 73 . 2 1 1 A 14 14 ILE H H 14 10.442 9.032 1.410 1
1 74 . 2 1 1 A 14 14 ILE HA H 14 5.458 4.744 0.714 1
1 84 . 2 1 1 A 14 14 ILE CA C 14 58.386 57.857 0.529 1
1 85 . 2 1 1 A 14 14 ILE CB C 14 38.596 38.722 -0.126 1
1 88 . 2 1 1 A 14 14 ILE N N 14 119.923 118.726 1.197 1
1 89 . 2 1 1 A 15 15 PRO HA H 15 4.560 4.602 -0.042 1
1 95 . 2 1 1 A 15 15 PRO C C 15 176.907 175.863 1.044 1
1 96 . 2 1 1 A 15 15 PRO CA C 15 64.342 64.142 0.200 1
1 97 . 2 1 1 A 15 15 PRO CB C 15 32.924 32.011 0.913 1
1 100 . 2 1 1 A 16 16 SER H H 16 7.331 7.610 -0.279 1
1 101 . 2 1 1 A 16 16 SER HA H 16 4.822 4.938 -0.116 1
1 104 . 2 1 1 A 16 16 SER C C 16 171.253 172.470 -1.217 1
1 105 . 2 1 1 A 16 16 SER CA C 16 57.135 57.514 -0.379 1
1 106 . 2 1 1 A 16 16 SER CB C 16 65.947 65.537 0.410 1
1 107 . 2 1 1 A 16 16 SER N N 16 107.745 108.446 -0.701 1
1 108 . 2 1 1 A 17 17 VAL H H 17 8.350 8.412 -0.062 1
1 109 . 2 1 1 A 17 17 VAL HA H 17 4.926 4.915 0.011 1
1 117 . 2 1 1 A 17 17 VAL C C 17 173.692 174.573 -0.881 1
1 118 . 2 1 1 A 17 17 VAL CA C 17 58.721 60.566 -1.845 1
1 119 . 2 1 1 A 17 17 VAL CB C 17 34.420 36.201 -1.781 1
1 122 . 2 1 1 A 17 17 VAL N N 17 118.680 121.233 -2.553 1
1 123 . 2 1 1 A 18 18 GLY H H 18 8.332 8.583 -0.251 1
1 124 . 2 1 1 A 18 18 GLY HA2 H 18 4.189 4.329 -0.140 1
1 125 . 2 1 1 A 18 18 GLY HA3 H 18 4.011 4.347 -0.336 1
1 126 . 2 1 1 A 18 18 GLY CA C 18 45.356 44.763 0.593 1
1 127 . 2 1 1 A 18 18 GLY N N 18 112.549 113.559 -1.010 1
1 128 . 2 1 1 A 19 19 PRO HA H 19 4.757 4.604 0.153 1
1 134 . 2 1 1 A 19 19 PRO C C 19 177.482 177.275 0.207 1
1 135 . 2 1 1 A 19 19 PRO CA C 19 62.848 62.668 0.180 1
1 136 . 2 1 1 A 19 19 PRO CB C 19 32.283 31.990 0.293 1
1 139 . 2 1 1 A 20 20 GLU H H 20 8.588 8.647 -0.059 1
1 140 . 2 1 1 A 20 20 GLU HA H 20 4.147 4.311 -0.164 1
1 144 . 2 1 1 A 20 20 GLU C C 20 175.857 175.232 0.625 1
1 145 . 2 1 1 A 20 20 GLU CA C 20 57.150 58.292 -1.142 1
1 146 . 2 1 1 A 20 20 GLU CB C 20 30.923 30.112 0.811 1
1 148 . 2 1 1 A 20 20 GLU N N 20 122.087 122.514 -0.427 1
1 149 . 2 1 1 A 21 21 ALA H H 21 8.352 7.522 0.830 1
1 150 . 2 1 1 A 21 21 ALA HA H 21 4.391 4.920 -0.529 1
1 154 . 2 1 1 A 21 21 ALA C C 21 174.910 175.794 -0.884 1
1 155 . 2 1 1 A 21 21 ALA CA C 21 52.166 50.344 1.822 1
1 156 . 2 1 1 A 21 21 ALA CB C 21 19.915 22.885 -2.970 1
1 157 . 2 1 1 A 21 21 ALA N N 21 124.593 119.844 4.749 1
1 158 . 2 1 1 A 22 22 GLU H H 22 8.398 8.547 -0.149 1
1 159 . 2 1 1 A 22 22 GLU HA H 22 4.331 4.635 -0.304 1
1 163 . 2 1 1 A 22 22 GLU C C 22 176.389 176.830 -0.441 1
1 164 . 2 1 1 A 22 22 GLU CA C 22 56.316 56.308 0.008 1
1 165 . 2 1 1 A 22 22 GLU CB C 22 30.713 29.725 0.988 1
1 167 . 2 1 1 A 22 22 GLU N N 22 120.159 120.105 0.054 1
1 168 . 2 1 1 A 23 23 GLY H H 23 8.246 8.758 -0.512 1
1 169 . 2 1 1 A 23 23 GLY HA2 H 23 4.162 3.894 0.268 1
1 170 . 2 1 1 A 23 23 GLY HA3 H 23 4.061 3.898 0.163 1
1 171 . 2 1 1 A 23 23 GLY CA C 23 44.801 46.927 -2.126 1
1 172 . 2 1 1 A 23 23 GLY N N 23 110.080 112.610 -2.530 1
1 173 . 2 1 1 A 24 24 PRO HA H 24 4.417 4.564 -0.147 1
1 178 . 2 1 1 A 24 24 PRO C C 24 177.135 176.235 0.900 1
1 179 . 2 1 1 A 24 24 PRO CA C 24 63.520 62.364 1.156 1
1 180 . 2 1 1 A 24 24 PRO CB C 24 32.124 32.912 -0.788 1
1 183 . 2 1 1 A 25 25 ARG H H 25 8.409 8.397 0.012 1
1 184 . 2 1 1 A 25 25 ARG HA H 25 4.298 4.293 0.005 1
1 187 . 2 1 1 A 25 25 ARG C C 25 176.217 175.895 0.322 1
1 188 . 2 1 1 A 25 25 ARG CA C 25 56.237 55.705 0.532 1
1 189 . 2 1 1 A 25 25 ARG CB C 25 30.467 30.975 -0.508 1
1 192 . 2 1 1 A 25 25 ARG N N 25 120.147 121.439 -1.292 1
1 193 . 2 1 1 A 26 26 GLN H H 26 8.278 8.137 0.141 1
1 194 . 2 1 1 A 26 26 GLN HA H 26 4.336 4.323 0.013 1
1 200 . 2 1 1 A 26 26 GLN C C 26 175.566 174.793 0.773 1
1 201 . 2 1 1 A 26 26 GLN CA C 26 55.788 56.541 -0.753 1
1 202 . 2 1 1 A 26 26 GLN CB C 26 29.714 29.209 0.505 1
1 204 . 2 1 1 A 26 26 GLN N N 26 120.460 125.828 -5.368 1
1 206 . 2 1 1 A 27 27 SER H H 27 8.298 8.517 -0.219 1
1 208 . 2 1 1 A 27 27 SER CA C 27 56.156 55.569 0.587 1
1 209 . 2 1 1 A 27 27 SER CB C 27 63.813 64.980 -1.167 1
1 210 . 2 1 1 A 27 27 SER N N 27 117.382 123.245 -5.863 1
1 211 . 2 1 1 A 28 28 PRO HA H 28 4.366 4.418 -0.052 1
1 216 . 2 1 1 A 28 28 PRO C C 28 177.555 176.533 1.022 1
1 217 . 2 1 1 A 28 28 PRO CA C 28 64.486 64.786 -0.300 1
1 218 . 2 1 1 A 28 28 PRO CB C 28 31.892 31.933 -0.041 1
1 221 . 2 1 1 A 29 29 GLU H H 29 8.582 7.796 0.786 1
1 222 . 2 1 1 A 29 29 GLU HA H 29 4.218 4.903 -0.685 1
1 226 . 2 1 1 A 29 29 GLU CA C 29 57.261 55.686 1.575 1
1 227 . 2 1 1 A 29 29 GLU CB C 29 29.633 32.763 -3.130 1
1 229 . 2 1 1 A 29 29 GLU N N 29 118.309 116.943 1.366 1
1 230 . 2 1 1 A 30 30 LYS H H 30 7.955 8.594 -0.639 1
1 231 . 2 1 1 A 30 30 LYS HA H 30 4.328 4.391 -0.063 1
1 236 . 2 1 1 A 30 30 LYS C C 30 176.222 176.509 -0.287 1
1 237 . 2 1 1 A 30 30 LYS CA C 30 56.247 57.209 -0.962 1
1 238 . 2 1 1 A 30 30 LYS CB C 30 32.720 32.755 -0.035 1
1 242 . 2 1 1 A 30 30 LYS N N 30 120.129 126.719 -6.590 1
1 243 . 2 1 1 A 31 31 SER H H 31 7.883 8.929 -1.046 1
1 244 . 2 1 1 A 31 31 SER HA H 31 4.458 4.468 -0.010 1
1 246 . 2 1 1 A 31 31 SER C C 31 174.129 174.304 -0.175 1
1 247 . 2 1 1 A 31 31 SER CA C 31 58.477 58.162 0.315 1
1 248 . 2 1 1 A 31 31 SER CB C 31 64.042 61.399 2.643 1
1 249 . 2 1 1 A 31 31 SER N N 31 115.366 120.372 -5.006 1
1 250 . 2 1 1 A 32 32 HIS H H 32 8.485 8.689 -0.204 1
1 251 . 2 1 1 A 32 32 HIS HA H 32 4.450 4.882 -0.432 1
1 255 . 2 1 1 A 32 32 HIS CA C 32 56.009 56.211 -0.202 1
1 256 . 2 1 1 A 32 32 HIS CB C 32 31.122 31.533 -0.411 1
1 257 . 2 1 1 A 32 32 HIS N N 32 121.500 126.475 -4.975 1
1 258 . 2 1 1 A 33 33 MET H H 33 8.392 7.767 0.625 1
1 259 . 2 1 1 A 33 33 MET HA H 33 4.601 4.681 -0.080 1
1 265 . 2 1 1 A 33 33 MET C C 33 175.842 173.793 2.049 1
1 266 . 2 1 1 A 33 33 MET CA C 33 54.533 53.991 0.542 1
1 267 . 2 1 1 A 33 33 MET CB C 33 32.868 35.232 -2.364 1
1 270 . 2 1 1 A 33 33 MET N N 33 120.204 118.458 1.746 1
1 271 . 2 1 1 A 34 34 VAL H H 34 8.938 9.058 -0.120 1
1 272 . 2 1 1 A 34 34 VAL HA H 34 4.430 4.753 -0.323 1
1 280 . 2 1 1 A 34 34 VAL C C 34 174.149 174.735 -0.586 1
1 281 . 2 1 1 A 34 34 VAL CA C 34 60.703 60.217 0.486 1
1 282 . 2 1 1 A 34 34 VAL CB C 34 34.319 33.920 0.399 1
1 285 . 2 1 1 A 34 34 VAL N N 34 118.512 127.419 -8.907 1
1 286 . 2 1 1 A 35 35 PHE H H 35 9.242 8.418 0.824 1
1 287 . 2 1 1 A 35 35 PHE HA H 35 4.439 5.368 -0.929 1
1 294 . 2 1 1 A 35 35 PHE C C 35 174.831 174.606 0.225 1
1 295 . 2 1 1 A 35 35 PHE CA C 35 57.754 55.171 2.583 1
1 296 . 2 1 1 A 35 35 PHE CB C 35 38.959 41.885 -2.926 1
1 297 . 2 1 1 A 35 35 PHE N N 35 124.912 126.679 -1.767 1
1 298 . 2 1 1 A 36 36 ARG H H 36 8.475 8.934 -0.459 1
1 299 . 2 1 1 A 36 36 ARG HA H 36 4.135 4.780 -0.645 1
1 304 . 2 1 1 A 36 36 ARG C C 36 172.865 175.454 -2.589 1
1 305 . 2 1 1 A 36 36 ARG CA C 36 56.895 55.432 1.463 1
1 306 . 2 1 1 A 36 36 ARG CB C 36 28.962 30.656 -1.694 1
1 308 . 2 1 1 A 36 36 ARG N N 36 125.680 120.674 5.006 1
1 309 . 2 1 1 A 37 37 VAL H H 37 8.066 9.122 -1.056 1
1 310 . 2 1 1 A 37 37 VAL HA H 37 4.292 4.640 -0.348 1
1 318 . 2 1 1 A 37 37 VAL C C 37 174.595 174.328 0.267 1
1 319 . 2 1 1 A 37 37 VAL CA C 37 62.727 61.470 1.257 1
1 320 . 2 1 1 A 37 37 VAL CB C 37 31.102 32.910 -1.808 1
1 323 . 2 1 1 A 37 37 VAL N N 37 125.403 121.126 4.277 1
1 324 . 2 1 1 A 38 38 GLU H H 38 9.532 9.215 0.317 1
1 325 . 2 1 1 A 38 38 GLU HA H 38 4.895 4.968 -0.073 1
1 329 . 2 1 1 A 38 38 GLU C C 38 174.509 175.392 -0.883 1
1 330 . 2 1 1 A 38 38 GLU CA C 38 55.650 55.208 0.442 1
1 331 . 2 1 1 A 38 38 GLU CB C 38 32.214 30.405 1.809 1
1 333 . 2 1 1 A 38 38 GLU N N 38 129.885 126.716 3.169 1
1 334 . 2 1 1 A 39 39 VAL H H 39 9.035 8.802 0.233 1
1 335 . 2 1 1 A 39 39 VAL HA H 39 4.446 4.517 -0.071 1
1 343 . 2 1 1 A 39 39 VAL C C 39 173.661 174.218 -0.557 1
1 344 . 2 1 1 A 39 39 VAL CA C 39 61.258 61.846 -0.588 1
1 345 . 2 1 1 A 39 39 VAL CB C 39 33.533 32.705 0.828 1
1 348 . 2 1 1 A 39 39 VAL N N 39 127.941 127.446 0.495 1
1 349 . 2 1 1 A 40 40 LEU H H 40 8.843 9.393 -0.550 1
1 350 . 2 1 1 A 40 40 LEU HA H 40 5.130 5.197 -0.067 1
1 360 . 2 1 1 A 40 40 LEU C C 40 175.581 175.320 0.261 1
1 361 . 2 1 1 A 40 40 LEU CA C 40 53.702 53.823 -0.121 1
1 362 . 2 1 1 A 40 40 LEU CB C 40 43.989 43.659 0.330 1
1 366 . 2 1 1 A 40 40 LEU N N 40 128.413 129.764 -1.351 1
1 367 . 2 1 1 A 41 41 CYS H H 41 8.959 9.016 -0.057 1
1 368 . 2 1 1 A 41 41 CYS HA H 41 5.174 4.737 0.437 1
1 371 . 2 1 1 A 41 41 CYS C C 41 175.043 174.880 0.163 1
1 372 . 2 1 1 A 41 41 CYS CA C 41 57.483 57.074 0.409 1
1 373 . 2 1 1 A 41 41 CYS CB C 41 28.472 28.956 -0.484 1
1 374 . 2 1 1 A 41 41 CYS N N 41 124.738 126.753 -2.015 1
1 375 . 2 1 1 A 42 42 SER H H 42 9.527 8.459 1.068 1
1 376 . 2 1 1 A 42 42 SER HA H 42 4.149 5.061 -0.912 1
1 379 . 2 1 1 A 42 42 SER C C 42 175.014 174.198 0.816 1
1 380 . 2 1 1 A 42 42 SER CA C 42 59.058 59.861 -0.803 1
1 381 . 2 1 1 A 42 42 SER CB C 42 62.287 61.417 0.870 1
1 382 . 2 1 1 A 42 42 SER N N 42 125.889 122.589 3.300 1
1 383 . 2 1 1 A 43 43 GLY H H 43 8.685 8.487 0.198 1
1 384 . 2 1 1 A 43 43 GLY HA2 H 43 3.594 4.089 -0.495 1
1 385 . 2 1 1 A 43 43 GLY HA3 H 43 4.210 4.095 0.115 1
1 386 . 2 1 1 A 43 43 GLY C C 43 173.664 173.260 0.404 1
1 387 . 2 1 1 A 43 43 GLY CA C 43 45.404 45.409 -0.005 1
1 388 . 2 1 1 A 43 43 GLY N N 43 104.633 108.048 -3.415 1
1 389 . 2 1 1 A 44 44 ARG H H 44 7.926 7.439 0.487 1
1 390 . 2 1 1 A 44 44 ARG HA H 44 4.678 4.847 -0.169 1
1 395 . 2 1 1 A 44 44 ARG C C 44 175.261 174.510 0.751 1
1 396 . 2 1 1 A 44 44 ARG CA C 44 55.011 54.469 0.542 1
1 397 . 2 1 1 A 44 44 ARG CB C 44 32.138 33.867 -1.729 1
1 400 . 2 1 1 A 44 44 ARG N N 44 121.239 120.125 1.114 1
1 401 . 2 1 1 A 45 45 ARG H H 45 8.775 8.917 -0.142 1
1 402 . 2 1 1 A 45 45 ARG HA H 45 5.770 5.498 0.272 1
1 409 . 2 1 1 A 45 45 ARG C C 45 176.064 174.371 1.693 1
1 410 . 2 1 1 A 45 45 ARG CA C 45 54.683 54.504 0.179 1
1 411 . 2 1 1 A 45 45 ARG CB C 45 33.748 33.982 -0.234 1
1 414 . 2 1 1 A 45 45 ARG N N 45 125.948 121.363 4.585 1
1 415 . 2 1 1 A 46 46 HIS H H 46 8.912 8.742 0.170 1
1 416 . 2 1 1 A 46 46 HIS HA H 46 4.927 5.340 -0.413 1
1 420 . 2 1 1 A 46 46 HIS C C 46 172.634 173.446 -0.812 1
1 421 . 2 1 1 A 46 46 HIS CA C 46 56.480 54.753 1.727 1
1 422 . 2 1 1 A 46 46 HIS CB C 46 33.608 33.127 0.481 1
1 423 . 2 1 1 A 46 46 HIS N N 46 121.825 121.420 0.405 1
1 424 . 2 1 1 A 47 47 THR H H 47 8.532 8.611 -0.079 1
1 425 . 2 1 1 A 47 47 THR HA H 47 5.472 4.498 0.974 1
1 430 . 2 1 1 A 47 47 THR C C 47 174.442 174.090 0.352 1
1 431 . 2 1 1 A 47 47 THR CA C 47 61.093 62.596 -1.503 1
1 432 . 2 1 1 A 47 47 THR CB C 47 71.041 68.665 2.376 1
1 434 . 2 1 1 A 47 47 THR N N 47 115.450 122.322 -6.872 1
1 435 . 2 1 1 A 48 48 VAL H H 48 9.695 9.329 0.366 1
1 436 . 2 1 1 A 48 48 VAL HA H 48 4.677 4.666 0.011 1
1 444 . 2 1 1 A 48 48 VAL CA C 48 58.172 59.425 -1.253 1
1 445 . 2 1 1 A 48 48 VAL CB C 48 34.990 32.792 2.198 1
1 448 . 2 1 1 A 48 48 VAL N N 48 126.721 127.974 -1.253 1
1 449 . 2 1 1 A 49 49 PRO HA H 49 5.087 5.293 -0.206 1
1 453 . 2 1 1 A 49 49 PRO CA C 49 61.671 62.624 -0.953 1
1 454 . 2 1 1 A 49 49 PRO CB C 49 31.923 31.863 0.060 1
1 457 . 2 1 1 A 50 50 ARG H H 50 9.125 8.970 0.155 1
1 458 . 2 1 1 A 50 50 ARG HA H 50 4.974 5.025 -0.051 1
1 464 . 2 1 1 A 50 50 ARG C C 50 176.187 174.797 1.390 1
1 465 . 2 1 1 A 50 50 ARG CA C 50 53.015 54.287 -1.272 1
1 466 . 2 1 1 A 50 50 ARG CB C 50 36.553 33.941 2.612 1
1 468 . 2 1 1 A 50 50 ARG N N 50 124.189 118.267 5.922 1
1 469 . 2 1 1 A 51 51 ARG H H 51 10.105 8.545 1.560 1
1 470 . 2 1 1 A 51 51 ARG HA H 51 5.196 4.373 0.823 1
1 475 . 2 1 1 A 51 51 ARG C C 51 178.865 177.240 1.625 1
1 476 . 2 1 1 A 51 51 ARG CA C 51 55.961 55.780 0.181 1
1 477 . 2 1 1 A 51 51 ARG CB C 51 32.539 30.820 1.719 1
1 480 . 2 1 1 A 51 51 ARG N N 51 124.521 120.948 3.573 1
1 481 . 2 1 1 A 52 52 TYR H H 52 10.397 8.470 1.927 1
1 482 . 2 1 1 A 52 52 TYR HA H 52 4.360 4.022 0.338 1
1 487 . 2 1 1 A 52 52 TYR C C 52 178.143 177.666 0.477 1
1 488 . 2 1 1 A 52 52 TYR CA C 52 63.538 62.038 1.500 1
1 489 . 2 1 1 A 52 52 TYR CB C 52 38.784 38.712 0.072 1
1 490 . 2 1 1 A 52 52 TYR N N 52 124.772 123.911 0.861 1
1 491 . 2 1 1 A 53 53 SER H H 53 9.231 8.498 0.733 1
1 492 . 2 1 1 A 53 53 SER HA H 53 4.175 4.396 -0.221 1
1 493 . 2 1 1 A 53 53 SER C C 53 177.220 177.406 -0.186 1
1 494 . 2 1 1 A 53 53 SER CA C 53 61.606 61.690 -0.084 1
1 495 . 2 1 1 A 53 53 SER N N 53 113.262 114.441 -1.179 1
1 496 . 2 1 1 A 54 54 GLU H H 54 7.807 8.070 -0.263 1
1 497 . 2 1 1 A 54 54 GLU HA H 54 4.392 3.998 0.394 1
1 501 . 2 1 1 A 54 54 GLU C C 54 180.361 178.689 1.672 1
1 502 . 2 1 1 A 54 54 GLU CA C 54 59.497 59.484 0.013 1
1 503 . 2 1 1 A 54 54 GLU CB C 54 30.708 29.533 1.175 1
1 504 . 2 1 1 A 54 54 GLU N N 54 121.949 121.029 0.920 1
1 505 . 2 1 1 A 55 55 PHE H H 55 8.133 7.842 0.291 1
1 506 . 2 1 1 A 55 55 PHE HA H 55 4.007 4.298 -0.291 1
1 513 . 2 1 1 A 55 55 PHE C C 55 176.531 177.649 -1.118 1
1 514 . 2 1 1 A 55 55 PHE CA C 55 61.848 61.350 0.498 1
1 515 . 2 1 1 A 55 55 PHE CB C 55 38.847 39.272 -0.425 1
1 516 . 2 1 1 A 55 55 PHE N N 55 119.998 120.798 -0.800 1
1 517 . 2 1 1 A 56 56 HIS H H 56 7.907 8.348 -0.441 1
1 518 . 2 1 1 A 56 56 HIS HA H 56 3.324 4.064 -0.740 1
1 522 . 2 1 1 A 56 56 HIS C C 56 176.748 177.170 -0.422 1
1 523 . 2 1 1 A 56 56 HIS CA C 56 58.770 58.414 0.356 1
1 524 . 2 1 1 A 56 56 HIS CB C 56 30.404 28.527 1.877 1
1 525 . 2 1 1 A 56 56 HIS N N 56 119.173 117.206 1.967 1
1 526 . 2 1 1 A 57 57 ALA H H 57 7.962 7.645 0.317 1
1 527 . 2 1 1 A 57 57 ALA HA H 57 3.865 3.850 0.015 1
1 531 . 2 1 1 A 57 57 ALA C C 57 180.075 179.674 0.401 1
1 532 . 2 1 1 A 57 57 ALA CA C 57 54.996 54.959 0.037 1
1 533 . 2 1 1 A 57 57 ALA CB C 57 18.226 17.960 0.266 1
1 534 . 2 1 1 A 57 57 ALA N N 57 120.094 123.377 -3.283 1
1 535 . 2 1 1 A 58 58 LEU H H 58 7.295 7.534 -0.239 1
1 536 . 2 1 1 A 58 58 LEU HA H 58 3.994 3.882 0.112 1
1 546 . 2 1 1 A 58 58 LEU C C 58 177.428 178.595 -1.167 1
1 547 . 2 1 1 A 58 58 LEU CA C 58 58.342 57.789 0.553 1
1 548 . 2 1 1 A 58 58 LEU CB C 58 40.851 40.655 0.196 1
1 552 . 2 1 1 A 58 58 LEU N N 58 119.404 117.469 1.935 1
1 553 . 2 1 1 A 59 59 HIS H H 59 7.805 8.128 -0.323 1
1 554 . 2 1 1 A 59 59 HIS HA H 59 4.286 3.812 0.474 1
1 558 . 2 1 1 A 59 59 HIS C C 59 177.001 177.329 -0.328 1
1 559 . 2 1 1 A 59 59 HIS CA C 59 60.141 60.207 -0.066 1
1 560 . 2 1 1 A 59 59 HIS CB C 59 31.072 29.444 1.628 1
1 561 . 2 1 1 A 59 59 HIS N N 59 119.040 120.234 -1.194 1
1 562 . 2 1 1 A 60 60 LYS H H 60 7.715 7.991 -0.276 1
1 563 . 2 1 1 A 60 60 LYS HA H 60 3.456 4.063 -0.607 1
1 570 . 2 1 1 A 60 60 LYS C C 60 178.464 178.794 -0.330 1
1 571 . 2 1 1 A 60 60 LYS CA C 60 59.629 59.083 0.546 1
1 572 . 2 1 1 A 60 60 LYS CB C 60 32.354 32.009 0.345 1
1 576 . 2 1 1 A 60 60 LYS N N 60 114.225 118.002 -3.777 1
1 577 . 2 1 1 A 61 61 ARG H H 61 7.486 7.577 -0.091 1
1 578 . 2 1 1 A 61 61 ARG HA H 61 4.202 4.104 0.098 1
1 584 . 2 1 1 A 61 61 ARG C C 61 178.995 178.803 0.192 1
1 585 . 2 1 1 A 61 61 ARG CA C 61 58.387 58.723 -0.336 1
1 586 . 2 1 1 A 61 61 ARG CB C 61 31.216 30.028 1.188 1
1 589 . 2 1 1 A 61 61 ARG N N 61 115.929 119.308 -3.379 1
1 590 . 2 1 1 A 62 62 ILE H H 62 8.066 8.087 -0.021 1
1 591 . 2 1 1 A 62 62 ILE HA H 62 4.491 3.963 0.528 1
1 601 . 2 1 1 A 62 62 ILE C C 62 177.838 177.193 0.645 1
1 602 . 2 1 1 A 62 62 ILE CA C 62 63.399 63.876 -0.477 1
1 603 . 2 1 1 A 62 62 ILE CB C 62 39.699 37.368 2.331 1
1 606 . 2 1 1 A 62 62 ILE N N 62 111.456 118.108 -6.652 1
1 607 . 2 1 1 A 63 63 LYS H H 63 8.158 8.347 -0.189 1
1 608 . 2 1 1 A 63 63 LYS HA H 63 4.136 3.890 0.246 1
1 615 . 2 1 1 A 63 63 LYS C C 63 176.358 178.885 -2.527 1
1 616 . 2 1 1 A 63 63 LYS CA C 63 58.753 58.749 0.004 1
1 617 . 2 1 1 A 63 63 LYS CB C 63 30.825 31.845 -1.020 1
1 621 . 2 1 1 A 63 63 LYS N N 63 120.800 123.466 -2.666 1
1 622 . 2 1 1 A 64 64 LYS H H 64 7.687 7.554 0.133 1
1 623 . 2 1 1 A 64 64 LYS HA H 64 4.301 4.082 0.219 1
1 628 . 2 1 1 A 64 64 LYS C C 64 177.084 178.317 -1.233 1
1 629 . 2 1 1 A 64 64 LYS CA C 64 57.237 58.498 -1.261 1
1 630 . 2 1 1 A 64 64 LYS CB C 64 32.502 32.095 0.407 1
1 634 . 2 1 1 A 64 64 LYS N N 64 116.548 119.645 -3.097 1
1 635 . 2 1 1 A 65 65 LEU H H 65 7.476 7.897 -0.421 1
1 636 . 2 1 1 A 65 65 LEU HA H 65 4.219 4.367 -0.148 1
1 645 . 2 1 1 A 65 65 LEU C C 65 175.886 175.995 -0.109 1
1 646 . 2 1 1 A 65 65 LEU CA C 65 55.542 56.854 -1.312 1
1 647 . 2 1 1 A 65 65 LEU CB C 65 45.493 43.717 1.776 1
1 650 . 2 1 1 A 65 65 LEU N N 65 118.000 120.476 -2.476 1
1 651 . 2 1 1 A 66 66 TYR H H 66 7.672 8.799 -1.127 1
1 652 . 2 1 1 A 66 66 TYR HA H 66 4.762 5.064 -0.302 1
1 660 . 2 1 1 A 66 66 TYR C C 66 174.199 174.269 -0.070 1
1 661 . 2 1 1 A 66 66 TYR CA C 66 56.013 55.434 0.579 1
1 662 . 2 1 1 A 66 66 TYR CB C 66 40.380 41.082 -0.702 1
1 663 . 2 1 1 A 66 66 TYR N N 66 116.805 113.680 3.125 1
1 664 . 2 1 1 A 67 67 LYS H H 67 8.547 8.500 0.047 1
1 665 . 2 1 1 A 67 67 LYS HA H 67 4.436 4.331 0.105 1
1 670 . 2 1 1 A 67 67 LYS C C 67 175.727 175.483 0.244 1
1 671 . 2 1 1 A 67 67 LYS CA C 67 56.598 56.412 0.186 1
1 672 . 2 1 1 A 67 67 LYS CB C 67 32.743 32.489 0.254 1
1 676 . 2 1 1 A 67 67 LYS N N 67 120.929 120.080 0.849 1
1 677 . 2 1 1 A 68 68 VAL H H 68 8.168 8.001 0.167 1
1 678 . 2 1 1 A 68 68 VAL HA H 68 4.869 4.353 0.516 1
1 686 . 2 1 1 A 68 68 VAL CA C 68 57.389 58.794 -1.405 1
1 687 . 2 1 1 A 68 68 VAL CB C 68 34.017 35.114 -1.097 1
1 690 . 2 1 1 A 68 68 VAL N N 68 116.467 123.734 -7.267 1
1 691 . 2 1 1 A 69 69 PRO HA H 69 4.674 4.646 0.028 1
1 696 . 2 1 1 A 69 69 PRO C C 69 178.013 175.960 2.053 1
1 697 . 2 1 1 A 69 69 PRO CA C 69 61.443 62.284 -0.841 1
1 698 . 2 1 1 A 69 69 PRO CB C 69 32.231 33.044 -0.813 1
1 701 . 2 1 1 A 70 70 ASP H H 70 8.167 8.569 -0.402 1
1 702 . 2 1 1 A 70 70 ASP HA H 70 4.531 4.697 -0.166 1
1 705 . 2 1 1 A 70 70 ASP C C 70 175.660 175.440 0.220 1
1 706 . 2 1 1 A 70 70 ASP CA C 70 55.148 53.018 2.130 1
1 707 . 2 1 1 A 70 70 ASP CB C 70 40.876 41.897 -1.021 1
1 708 . 2 1 1 A 70 70 ASP N N 70 116.671 121.253 -4.582 1
1 709 . 2 1 1 A 71 71 PHE H H 71 8.387 8.520 -0.133 1
1 710 . 2 1 1 A 71 71 PHE HA H 71 4.076 4.808 -0.732 1
1 717 . 2 1 1 A 71 71 PHE CA C 71 55.672 54.575 1.097 1
1 718 . 2 1 1 A 71 71 PHE CB C 71 39.155 41.434 -2.279 1
1 719 . 2 1 1 A 71 71 PHE N N 71 126.533 118.219 8.314 1
1 720 . 2 1 1 A 72 72 PRO HA H 72 4.156 4.704 -0.548 1
1 727 . 2 1 1 A 72 72 PRO CA C 72 63.079 63.279 -0.200 1
1 728 . 2 1 1 A 72 72 PRO CB C 72 32.107 33.148 -1.041 1
1 731 . 2 1 1 A 73 73 SER H H 73 8.468 8.543 -0.075 1
1 733 . 2 1 1 A 73 73 SER CA C 73 56.133 55.676 0.457 1
1 734 . 2 1 1 A 73 73 SER CB C 73 63.991 65.524 -1.533 1
1 735 . 2 1 1 A 73 73 SER N N 73 121.533 116.889 4.644 1
1 736 . 2 1 1 A 74 74 LYS HA H 74 4.574 4.136 0.438 1
1 739 . 2 1 1 A 74 74 LYS CA C 74 55.659 59.334 -3.675 1
1 740 . 2 1 1 A 74 74 LYS CB C 74 30.550 31.932 -1.382 1
1 741 . 2 1 1 A 75 75 ARG H H 75 7.962 7.491 0.471 1
1 742 . 2 1 1 A 75 75 ARG HA H 75 4.162 4.601 -0.439 1
1 746 . 2 1 1 A 75 75 ARG CA C 75 56.123 55.667 0.456 1
1 747 . 2 1 1 A 75 75 ARG CB C 75 31.179 31.259 -0.080 1
1 749 . 2 1 1 A 75 75 ARG N N 75 121.665 121.691 -0.026 1
1 750 . 2 1 1 A 76 76 LEU H H 76 8.071 8.508 -0.437 1
1 751 . 2 1 1 A 76 76 LEU HA H 76 4.618 4.911 -0.293 1
1 759 . 2 1 1 A 76 76 LEU CA C 76 52.764 51.315 1.449 1
1 760 . 2 1 1 A 76 76 LEU CB C 76 41.918 46.143 -4.225 1
1 762 . 2 1 1 A 76 76 LEU N N 76 124.196 127.176 -2.980 1
1 763 . 2 1 1 A 77 77 PRO HA H 77 4.393 4.227 0.166 1
1 767 . 2 1 1 A 77 77 PRO CA C 77 63.746 62.327 1.419 1
1 770 . 2 1 1 A 78 78 ASN H H 78 8.379 8.671 -0.292 1
1 771 . 2 1 1 A 78 78 ASN HA H 78 4.586 4.351 0.235 1
1 776 . 2 1 1 A 78 78 ASN C C 78 175.648 174.976 0.672 1
1 777 . 2 1 1 A 78 78 ASN CA C 78 53.591 53.218 0.373 1
1 778 . 2 1 1 A 78 78 ASN CB C 78 37.826 38.889 -1.063 1
1 779 . 2 1 1 A 78 78 ASN N N 78 115.292 120.808 -5.516 1
1 781 . 2 1 1 A 79 79 TRP H H 79 7.900 7.943 -0.043 1
1 782 . 2 1 1 A 79 79 TRP HA H 79 4.326 4.072 0.254 1
1 788 . 2 1 1 A 79 79 TRP CA C 79 58.825 61.694 -2.869 1
1 789 . 2 1 1 A 79 79 TRP CB C 79 29.090 27.452 1.638 1
1 790 . 2 1 1 A 79 79 TRP N N 79 119.525 118.512 1.013 1
1 792 . 2 1 1 A 80 80 ARG H H 80 8.060 8.401 -0.341 1
1 793 . 2 1 1 A 80 80 ARG HA H 80 3.913 4.114 -0.201 1
1 798 . 2 1 1 A 80 80 ARG C C 80 177.024 177.847 -0.823 1
1 799 . 2 1 1 A 80 80 ARG CA C 80 58.292 59.347 -1.055 1
1 800 . 2 1 1 A 80 80 ARG CB C 80 30.146 29.881 0.265 1
1 803 . 2 1 1 A 80 80 ARG N N 80 118.864 119.826 -0.962 1
1 804 . 2 1 1 A 81 81 THR H H 81 7.725 7.682 0.043 1
1 805 . 2 1 1 A 81 81 THR HA H 81 4.297 4.521 -0.224 1
1 809 . 2 1 1 A 81 81 THR CA C 81 62.481 61.958 0.523 1
1 811 . 2 1 1 A 81 81 THR N N 81 109.863 109.779 0.084 1
1 812 . 2 1 1 A 82 82 ARG HA H 82 4.341 4.543 -0.202 1
1 816 . 2 1 1 A 82 82 ARG C C 82 177.261 176.472 0.789 1
1 817 . 2 1 1 A 82 82 ARG CA C 82 56.846 56.673 0.173 1
1 818 . 2 1 1 A 82 82 ARG CB C 82 30.288 33.014 -2.726 1
1 820 . 2 1 1 A 83 83 GLY H H 83 8.321 8.387 -0.066 1
1 821 . 2 1 1 A 83 83 GLY HA2 H 83 3.957 4.130 -0.173 1
1 822 . 2 1 1 A 83 83 GLY C C 83 175.185 174.565 0.620 1
1 823 . 2 1 1 A 83 83 GLY CA C 83 46.297 44.654 1.643 1
1 824 . 2 1 1 A 83 83 GLY N N 83 109.146 107.358 1.788 1
1 825 . 2 1 1 A 84 84 LEU H H 84 8.303 8.681 -0.378 1
1 826 . 2 1 1 A 84 84 LEU HA H 84 4.018 4.188 -0.170 1
1 835 . 2 1 1 A 84 84 LEU C C 84 178.552 177.705 0.847 1
1 836 . 2 1 1 A 84 84 LEU CA C 84 58.236 56.623 1.613 1
1 837 . 2 1 1 A 84 84 LEU CB C 84 41.837 42.388 -0.551 1
1 840 . 2 1 1 A 84 84 LEU N N 84 122.662 122.721 -0.059 1
1 841 . 2 1 1 A 85 85 GLU H H 85 8.233 8.324 -0.091 1
1 842 . 2 1 1 A 85 85 GLU HA H 85 4.371 3.904 0.467 1
1 846 . 2 1 1 A 85 85 GLU C C 85 178.555 178.657 -0.102 1
1 847 . 2 1 1 A 85 85 GLU CA C 85 58.377 59.738 -1.361 1
1 848 . 2 1 1 A 85 85 GLU CB C 85 28.675 29.267 -0.592 1
1 850 . 2 1 1 A 85 85 GLU N N 85 119.781 119.316 0.465 1
1 851 . 2 1 1 A 86 86 GLN H H 86 7.877 8.069 -0.192 1
1 852 . 2 1 1 A 86 86 GLN HA H 86 4.100 4.074 0.026 1
1 858 . 2 1 1 A 86 86 GLN C C 86 179.557 177.863 1.694 1
1 859 . 2 1 1 A 86 86 GLN CA C 86 58.955 59.109 -0.154 1
1 860 . 2 1 1 A 86 86 GLN CB C 86 28.191 28.331 -0.140 1
1 862 . 2 1 1 A 86 86 GLN N N 86 118.042 118.764 -0.722 1
1 863 . 2 1 1 A 87 87 ARG H H 87 8.169 8.166 0.003 1
1 864 . 2 1 1 A 87 87 ARG HA H 87 3.975 4.163 -0.188 1
1 868 . 2 1 1 A 87 87 ARG C C 87 177.051 178.579 -1.528 1
1 869 . 2 1 1 A 87 87 ARG CA C 87 59.006 59.282 -0.276 1
1 870 . 2 1 1 A 87 87 ARG CB C 87 30.383 29.688 0.695 1
1 872 . 2 1 1 A 87 87 ARG N N 87 121.381 119.997 1.384 1
1 873 . 2 1 1 A 88 88 ARG H H 88 8.593 7.872 0.721 1
1 874 . 2 1 1 A 88 88 ARG HA H 88 3.726 3.855 -0.129 1
1 876 . 2 1 1 A 88 88 ARG C C 88 177.520 178.684 -1.164 1
1 877 . 2 1 1 A 88 88 ARG CA C 88 60.751 60.063 0.688 1
1 878 . 2 1 1 A 88 88 ARG CB C 88 30.153 29.945 0.208 1
1 879 . 2 1 1 A 88 88 ARG N N 88 120.863 118.579 2.284 1
1 880 . 2 1 1 A 89 89 GLN H H 89 8.355 8.130 0.225 1
1 881 . 2 1 1 A 89 89 GLN HA H 89 3.887 3.966 -0.079 1
1 887 . 2 1 1 A 89 89 GLN C C 89 179.499 178.655 0.844 1
1 888 . 2 1 1 A 89 89 GLN CA C 89 59.603 59.440 0.163 1
1 889 . 2 1 1 A 89 89 GLN CB C 89 28.464 28.450 0.014 1
1 891 . 2 1 1 A 89 89 GLN N N 89 116.860 119.340 -2.480 1
1 893 . 2 1 1 A 90 90 GLY H H 90 8.406 8.140 0.266 1
1 894 . 2 1 1 A 90 90 GLY HA2 H 90 3.672 3.576 0.096 1
1 895 . 2 1 1 A 90 90 GLY HA3 H 90 3.871 3.708 0.163 1
1 896 . 2 1 1 A 90 90 GLY C C 90 177.033 175.503 1.530 1
1 897 . 2 1 1 A 90 90 GLY CA C 90 46.813 47.219 -0.406 1
1 898 . 2 1 1 A 90 90 GLY N N 90 107.679 107.246 0.433 1
1 899 . 2 1 1 A 91 91 LEU H H 91 8.504 8.283 0.221 1
1 900 . 2 1 1 A 91 91 LEU HA H 91 3.784 4.119 -0.335 1
1 910 . 2 1 1 A 91 91 LEU C C 91 178.003 179.259 -1.256 1
1 911 . 2 1 1 A 91 91 LEU CA C 91 57.354 57.604 -0.250 1
1 912 . 2 1 1 A 91 91 LEU CB C 91 40.359 41.142 -0.783 1
1 916 . 2 1 1 A 91 91 LEU N N 91 123.959 121.250 2.709 1
1 917 . 2 1 1 A 92 92 GLU H H 92 8.324 8.699 -0.375 1
1 918 . 2 1 1 A 92 92 GLU HA H 92 3.732 4.042 -0.310 1
1 922 . 2 1 1 A 92 92 GLU C C 92 177.272 178.459 -1.187 1
1 923 . 2 1 1 A 92 92 GLU CA C 92 60.651 59.620 1.031 1
1 924 . 2 1 1 A 92 92 GLU CB C 92 30.843 29.346 1.497 1
1 926 . 2 1 1 A 92 92 GLU N N 92 121.991 121.506 0.485 1
1 927 . 2 1 1 A 93 93 ALA H H 93 8.126 7.785 0.341 1
1 928 . 2 1 1 A 93 93 ALA HA H 93 4.160 4.058 0.102 1
1 932 . 2 1 1 A 93 93 ALA C C 93 180.818 179.103 1.715 1
1 933 . 2 1 1 A 93 93 ALA CA C 93 54.828 54.780 0.048 1
1 934 . 2 1 1 A 93 93 ALA CB C 93 18.032 17.901 0.131 1
1 935 . 2 1 1 A 93 93 ALA N N 93 120.066 122.069 -2.003 1
1 936 . 2 1 1 A 94 94 TYR H H 94 7.916 7.486 0.430 1
1 937 . 2 1 1 A 94 94 TYR HA H 94 4.139 4.446 -0.307 1
1 942 . 2 1 1 A 94 94 TYR C C 94 175.895 178.528 -2.633 1
1 943 . 2 1 1 A 94 94 TYR CA C 94 61.915 61.499 0.416 1
1 944 . 2 1 1 A 94 94 TYR CB C 94 38.740 38.527 0.213 1
1 945 . 2 1 1 A 94 94 TYR N N 94 121.179 115.858 5.321 1
1 946 . 2 1 1 A 95 95 ILE H H 95 7.983 7.949 0.034 1
1 947 . 2 1 1 A 95 95 ILE HA H 95 3.614 3.673 -0.059 1
1 957 . 2 1 1 A 95 95 ILE C C 95 174.678 177.956 -3.278 1
1 958 . 2 1 1 A 95 95 ILE CA C 95 63.461 64.772 -1.311 1
1 959 . 2 1 1 A 95 95 ILE CB C 95 36.625 37.475 -0.850 1
1 963 . 2 1 1 A 95 95 ILE N N 95 116.397 120.483 -4.086 1
1 964 . 2 1 1 A 96 96 GLN H H 96 8.175 8.866 -0.691 1
1 965 . 2 1 1 A 96 96 GLN HA H 96 3.763 4.021 -0.258 1
1 970 . 2 1 1 A 96 96 GLN C C 96 179.042 178.551 0.491 1
1 971 . 2 1 1 A 96 96 GLN CA C 96 59.270 60.012 -0.742 1
1 972 . 2 1 1 A 96 96 GLN CB C 96 27.696 27.933 -0.237 1
1 974 . 2 1 1 A 96 96 GLN N N 96 116.631 120.464 -3.833 1
1 976 . 2 1 1 A 97 97 GLY H H 97 8.222 8.360 -0.138 1
1 977 . 2 1 1 A 97 97 GLY HA2 H 97 3.661 3.762 -0.101 1
1 978 . 2 1 1 A 97 97 GLY HA3 H 97 3.806 3.796 0.010 1
1 979 . 2 1 1 A 97 97 GLY C C 97 175.449 176.111 -0.662 1
1 980 . 2 1 1 A 97 97 GLY CA C 97 46.917 47.388 -0.471 1
1 981 . 2 1 1 A 97 97 GLY N N 97 107.315 106.948 0.367 1
1 982 . 2 1 1 A 98 98 ILE H H 98 7.630 8.037 -0.407 1
1 983 . 2 1 1 A 98 98 ILE HA H 98 3.399 3.947 -0.548 1
1 993 . 2 1 1 A 98 98 ILE C C 98 178.683 178.048 0.635 1
1 994 . 2 1 1 A 98 98 ILE CA C 98 66.402 64.739 1.663 1
1 995 . 2 1 1 A 98 98 ILE CB C 98 38.037 37.267 0.770 1
1 999 . 2 1 1 A 98 98 ILE N N 98 120.644 120.462 0.182 1
1 1000 . 2 1 1 A 99 99 LEU H H 99 7.076 8.381 -1.305 1
1 1001 . 2 1 1 A 99 99 LEU HA H 99 4.133 4.495 -0.362 1
1 1010 . 2 1 1 A 99 99 LEU C C 99 178.128 178.024 0.104 1
1 1011 . 2 1 1 A 99 99 LEU CA C 99 57.129 58.023 -0.894 1
1 1012 . 2 1 1 A 99 99 LEU CB C 99 41.108 41.317 -0.209 1
1 1014 . 2 1 1 A 99 99 LEU N N 99 116.844 123.816 -6.972 1
1 1015 . 2 1 1 A 100 100 TYR H H 100 7.890 8.087 -0.197 1
1 1016 . 2 1 1 A 100 100 TYR HA H 100 4.550 4.253 0.297 1
1 1021 . 2 1 1 A 100 100 TYR C C 100 178.210 177.460 0.750 1
1 1022 . 2 1 1 A 100 100 TYR CA C 100 59.452 61.012 -1.560 1
1 1023 . 2 1 1 A 100 100 TYR CB C 100 38.786 38.787 -0.001 1
1 1024 . 2 1 1 A 100 100 TYR N N 100 116.427 120.292 -3.865 1
1 1025 . 2 1 1 A 101 101 LEU H H 101 8.041 8.574 -0.533 1
1 1026 . 2 1 1 A 101 101 LEU HA H 101 4.158 3.989 0.169 1
1 1036 . 2 1 1 A 101 101 LEU C C 101 176.808 177.579 -0.771 1
1 1037 . 2 1 1 A 101 101 LEU CA C 101 56.156 58.246 -2.090 1
1 1038 . 2 1 1 A 101 101 LEU CB C 101 44.307 41.795 2.512 1
1 1041 . 2 1 1 A 101 101 LEU N N 101 116.493 120.409 -3.916 1
1 1042 . 2 1 1 A 102 102 ASN H H 102 7.146 7.915 -0.769 1
1 1043 . 2 1 1 A 102 102 ASN HA H 102 5.056 5.063 -0.007 1
1 1046 . 2 1 1 A 102 102 ASN CA C 102 52.704 54.776 -2.072 1
1 1047 . 2 1 1 A 102 102 ASN CB C 102 42.424 40.058 2.366 1
1 1048 . 2 1 1 A 102 102 ASN N N 102 114.922 113.384 1.538 1
1 1049 . 2 1 1 A 103 103 GLN H H 103 8.477 8.200 0.277 1
1 1050 . 2 1 1 A 103 103 GLN HA H 103 3.866 4.185 -0.319 1
1 1054 . 2 1 1 A 103 103 GLN C C 103 176.110 176.272 -0.162 1
1 1055 . 2 1 1 A 103 103 GLN CA C 103 58.451 55.794 2.657 1
1 1056 . 2 1 1 A 103 103 GLN CB C 103 28.896 28.733 0.163 1
1 1058 . 2 1 1 A 103 103 GLN N N 103 120.252 118.542 1.710 1
1 1059 . 2 1 1 A 104 104 GLU H H 104 7.930 7.511 0.419 1
1 1060 . 2 1 1 A 104 104 GLU HA H 104 4.591 4.397 0.194 1
1 1064 . 2 1 1 A 104 104 GLU C C 104 175.397 175.480 -0.083 1
1 1065 . 2 1 1 A 104 104 GLU CA C 104 54.058 58.979 -4.921 1
1 1066 . 2 1 1 A 104 104 GLU CB C 104 31.272 28.327 2.945 1
1 1068 . 2 1 1 A 104 104 GLU N N 104 117.295 117.026 0.269 1
1 1069 . 2 1 1 A 105 105 VAL H H 105 8.546 7.869 0.677 1
1 1070 . 2 1 1 A 105 105 VAL HA H 105 3.823 4.555 -0.732 1
1 1078 . 2 1 1 A 105 105 VAL CA C 105 60.706 58.693 2.013 1
1 1079 . 2 1 1 A 105 105 VAL CB C 105 32.126 33.161 -1.035 1
1 1082 . 2 1 1 A 105 105 VAL N N 105 124.511 120.855 3.656 1
1 1083 . 2 1 1 A 106 106 PRO HA H 106 3.997 4.449 -0.452 1
1 1089 . 2 1 1 A 106 106 PRO C C 106 178.240 178.062 0.178 1
1 1090 . 2 1 1 A 106 106 PRO CA C 106 62.961 63.093 -0.132 1
1 1091 . 2 1 1 A 106 106 PRO CB C 106 32.321 32.498 -0.177 1
1 1094 . 2 1 1 A 107 107 LYS H H 107 9.122 8.988 0.134 1
1 1095 . 2 1 1 A 107 107 LYS HA H 107 3.813 3.965 -0.152 1
1 1101 . 2 1 1 A 107 107 LYS C C 107 178.563 177.723 0.840 1
1 1102 . 2 1 1 A 107 107 LYS CA C 107 60.085 59.415 0.670 1
1 1103 . 2 1 1 A 107 107 LYS CB C 107 31.632 32.296 -0.664 1
1 1106 . 2 1 1 A 107 107 LYS N N 107 129.017 124.882 4.135 1
1 1107 . 2 1 1 A 108 108 GLU H H 108 10.370 8.061 2.309 1
1 1108 . 2 1 1 A 108 108 GLU HA H 108 3.991 4.109 -0.118 1
1 1111 . 2 1 1 A 108 108 GLU C C 108 180.366 179.286 1.080 1
1 1112 . 2 1 1 A 108 108 GLU CA C 108 60.337 59.002 1.335 1
1 1113 . 2 1 1 A 108 108 GLU CB C 108 29.178 29.380 -0.202 1
1 1115 . 2 1 1 A 108 108 GLU N N 108 118.335 119.003 -0.668 1
1 1116 . 2 1 1 A 109 109 LEU H H 109 7.393 8.274 -0.881 1
1 1117 . 2 1 1 A 109 109 LEU HA H 109 4.220 4.160 0.060 1
1 1126 . 2 1 1 A 109 109 LEU C C 109 177.378 179.667 -2.289 1
1 1127 . 2 1 1 A 109 109 LEU CA C 109 56.618 58.041 -1.423 1
1 1128 . 2 1 1 A 109 109 LEU CB C 109 41.898 41.085 0.813 1
1 1131 . 2 1 1 A 109 109 LEU N N 109 118.285 119.708 -1.423 1
1 1132 . 2 1 1 A 110 110 LEU H H 110 7.641 8.325 -0.684 1
1 1133 . 2 1 1 A 110 110 LEU HA H 110 3.796 3.908 -0.112 1
1 1142 . 2 1 1 A 110 110 LEU C C 110 179.103 179.305 -0.202 1
1 1143 . 2 1 1 A 110 110 LEU CA C 110 59.046 58.042 1.004 1
1 1144 . 2 1 1 A 110 110 LEU CB C 110 40.228 40.975 -0.747 1
1 1147 . 2 1 1 A 110 110 LEU N N 110 120.162 119.897 0.265 1
1 1148 . 2 1 1 A 111 111 GLU H H 111 7.916 7.923 -0.007 1
1 1149 . 2 1 1 A 111 111 GLU HA H 111 4.080 4.195 -0.115 1
1 1153 . 2 1 1 A 111 111 GLU C C 111 179.967 178.655 1.312 1
1 1154 . 2 1 1 A 111 111 GLU CA C 111 59.243 58.449 0.794 1
1 1155 . 2 1 1 A 111 111 GLU CB C 111 29.576 29.680 -0.104 1
1 1157 . 2 1 1 A 111 111 GLU N N 111 117.360 118.134 -0.774 1
1 1158 . 2 1 1 A 112 112 PHE H H 112 7.712 8.006 -0.294 1
1 1159 . 2 1 1 A 112 112 PHE HA H 112 4.224 4.177 0.047 1
1 1164 . 2 1 1 A 112 112 PHE C C 112 177.180 177.224 -0.044 1
1 1165 . 2 1 1 A 112 112 PHE CA C 112 61.407 61.181 0.226 1
1 1166 . 2 1 1 A 112 112 PHE CB C 112 40.172 39.668 0.504 1
1 1167 . 2 1 1 A 112 112 PHE N N 112 123.042 122.869 0.173 1
1 1168 . 2 1 1 A 113 113 LEU H H 113 8.056 8.202 -0.146 1
1 1169 . 2 1 1 A 113 113 LEU HA H 113 4.147 4.359 -0.212 1
1 1175 . 2 1 1 A 113 113 LEU C C 113 173.717 176.088 -2.371 1
1 1176 . 2 1 1 A 113 113 LEU CA C 113 54.093 54.392 -0.299 1
1 1177 . 2 1 1 A 113 113 LEU CB C 113 41.517 42.640 -1.123 1
1 1179 . 2 1 1 A 113 113 LEU N N 113 115.595 116.952 -1.357 1
1 1180 . 2 1 1 A 114 114 ARG H H 114 7.902 8.071 -0.169 1
1 1181 . 2 1 1 A 114 114 ARG HA H 114 3.817 4.764 -0.947 1
1 1182 . 2 1 1 A 114 114 ARG C C 114 174.566 176.260 -1.694 1
1 1183 . 2 1 1 A 114 114 ARG CA C 114 57.233 56.982 0.251 1
1 1184 . 2 1 1 A 114 114 ARG CB C 114 27.788 28.601 -0.813 1
1 1185 . 2 1 1 A 114 114 ARG N N 114 116.021 118.839 -2.818 1
1 1186 . 2 1 1 A 115 115 LEU H H 115 8.160 7.893 0.267 1
1 1187 . 2 1 1 A 115 115 LEU HA H 115 4.462 4.174 0.288 1
1 1195 . 2 1 1 A 115 115 LEU C C 115 176.374 176.003 0.371 1
1 1196 . 2 1 1 A 115 115 LEU CA C 115 53.965 54.074 -0.109 1
1 1197 . 2 1 1 A 115 115 LEU CB C 115 44.077 41.676 2.401 1
1 1199 . 2 1 1 A 115 115 LEU N N 115 118.089 118.678 -0.589 1
1 1200 . 2 1 1 A 116 116 ARG H H 116 8.066 7.074 0.992 1
1 1201 . 2 1 1 A 116 116 ARG HA H 116 4.172 3.783 0.389 1
1 1203 . 2 1 1 A 116 116 ARG CA C 116 55.961 58.190 -2.229 1
1 1204 . 2 1 1 A 116 116 ARG CB C 116 31.379 29.839 1.540 1
1 1205 . 2 1 1 A 116 116 ARG N N 116 120.852 121.219 -0.367 1
1 1206 . 2 1 1 A 117 117 HIS H H 117 7.928 8.732 -0.804 1
1 1207 . 2 1 1 A 117 117 HIS HA H 117 4.557 4.168 0.389 1
1 1211 . 2 1 1 A 117 117 HIS CA C 117 55.937 56.732 -0.795 1
1 1212 . 2 1 1 A 117 117 HIS CB C 117 30.875 28.117 2.758 1
1 1213 . 2 1 1 A 118 118 PHE H H 118 8.183 8.497 -0.314 1
1 1214 . 2 1 1 A 118 118 PHE HA H 118 4.730 4.612 0.118 1
1 1219 . 2 1 1 A 118 118 PHE CA C 118 55.716 55.744 -0.028 1
1 1220 . 2 1 1 A 118 118 PHE CB C 118 39.263 39.962 -0.699 1
1 1221 . 2 1 1 A 118 118 PHE N N 118 123.480 124.582 -1.102 1
1 1222 . 2 1 1 A 119 119 PRO HA H 119 4.398 4.666 -0.268 1
1 1227 . 2 1 1 A 119 119 PRO C C 119 176.666 177.209 -0.543 1
1 1228 . 2 1 1 A 119 119 PRO CA C 119 63.377 62.615 0.762 1
1 1229 . 2 1 1 A 119 119 PRO CB C 119 32.059 31.770 0.289 1
1 1232 . 2 1 1 A 120 120 THR H H 120 8.054 8.648 -0.594 1
1 1233 . 2 1 1 A 120 120 THR HA H 120 4.273 4.725 -0.452 1
1 1238 . 2 1 1 A 120 120 THR C C 120 174.154 173.850 0.304 1
1 1239 . 2 1 1 A 120 120 THR CA C 120 61.893 62.830 -0.937 1
1 1240 . 2 1 1 A 120 120 THR CB C 120 69.736 69.198 0.538 1
1 1242 . 2 1 1 A 120 120 THR N N 120 113.088 119.397 -6.309 1
1 1243 . 2 1 1 A 121 121 ASP H H 121 8.209 7.668 0.541 1
1 1244 . 2 1 1 A 121 121 ASP HA H 121 4.876 4.798 0.078 1
1 1247 . 2 1 1 A 121 121 ASP CA C 121 52.126 52.282 -0.156 1
1 1248 . 2 1 1 A 121 121 ASP CB C 121 41.553 40.965 0.588 1
1 1249 . 2 1 1 A 121 121 ASP N N 121 123.630 120.160 3.470 1
1 1250 . 2 1 1 A 122 122 PRO HA H 122 4.363 4.851 -0.488 1
1 1255 . 2 1 1 A 122 122 PRO C C 122 177.344 175.656 1.688 1
1 1256 . 2 1 1 A 122 122 PRO CA C 122 63.913 62.412 1.501 1
1 1257 . 2 1 1 A 122 122 PRO CB C 122 32.116 31.991 0.125 1
1 1260 . 2 1 1 A 123 123 LYS H H 123 8.344 9.103 -0.759 1
1 1261 . 2 1 1 A 123 123 LYS HA H 123 4.244 4.597 -0.353 1
1 1266 . 2 1 1 A 123 123 LYS C C 123 176.637 174.392 2.245 1
1 1267 . 2 1 1 A 123 123 LYS CA C 123 56.359 56.093 0.266 1
1 1268 . 2 1 1 A 123 123 LYS CB C 123 32.367 34.164 -1.797 1
1 1272 . 2 1 1 A 123 123 LYS N N 123 119.110 122.566 -3.456 1
1 1273 . 2 1 1 A 124 124 ALA H H 124 7.929 8.828 -0.899 1
1 1274 . 2 1 1 A 124 124 ALA HA H 124 4.248 4.998 -0.750 1
1 1278 . 2 1 1 A 124 124 ALA C C 124 177.648 175.627 2.021 1
1 1279 . 2 1 1 A 124 124 ALA CA C 124 52.618 51.084 1.534 1
1 1280 . 2 1 1 A 124 124 ALA CB C 124 19.379 20.695 -1.316 1
1 1281 . 2 1 1 A 124 124 ALA N N 124 123.825 128.785 -4.960 1
1 1282 . 2 1 1 A 125 125 SER H H 125 8.134 8.753 -0.619 1
1 1283 . 2 1 1 A 125 125 SER HA H 125 4.341 4.749 -0.408 1
1 1286 . 2 1 1 A 125 125 SER C C 125 174.172 173.216 0.956 1
1 1287 . 2 1 1 A 125 125 SER CA C 125 58.391 59.173 -0.782 1
1 1288 . 2 1 1 A 125 125 SER CB C 125 63.748 62.766 0.982 1
1 1289 . 2 1 1 A 125 125 SER N N 125 114.454 119.883 -5.429 1
1 1290 . 2 1 1 A 126 126 ASN H H 126 8.242 8.180 0.062 1
1 1291 . 2 1 1 A 126 126 ASN HA H 126 4.657 5.436 -0.779 1
1 1294 . 2 1 1 A 126 126 ASN C C 126 174.624 173.512 1.112 1
1 1295 . 2 1 1 A 126 126 ASN CA C 126 53.292 52.498 0.794 1
1 1296 . 2 1 1 A 126 126 ASN CB C 126 38.797 41.436 -2.639 1
1 1297 . 2 1 1 A 126 126 ASN N N 126 120.102 125.082 -4.980 1
1 1298 . 2 1 1 A 127 127 TRP H H 127 8.051 9.037 -0.986 1
1 1299 . 2 1 1 A 127 127 TRP HA H 127 4.694 5.569 -0.875 1
1 1302 . 2 1 1 A 127 127 TRP C C 127 175.479 174.949 0.530 1
1 1303 . 2 1 1 A 127 127 TRP CA C 127 57.096 55.054 2.042 1
1 1304 . 2 1 1 A 127 127 TRP CB C 127 29.820 33.373 -3.553 1
1 1305 . 2 1 1 A 127 127 TRP N N 127 121.198 127.903 -6.705 1
1 1 . 3 1 1 A 7 7 HIS HA H 7 4.623 5.113 -0.490 1
1 4 . 3 1 1 A 7 7 HIS C C 7 174.747 174.372 0.375 1
1 5 . 3 1 1 A 7 7 HIS CA C 7 56.189 54.377 1.812 1
1 6 . 3 1 1 A 7 7 HIS CB C 7 30.028 32.275 -2.247 1
1 7 . 3 1 1 A 8 8 LEU H H 8 8.283 8.638 -0.355 1
1 8 . 3 1 1 A 8 8 LEU HA H 8 4.249 4.151 0.098 1
1 10 . 3 1 1 A 8 8 LEU C C 8 176.700 177.314 -0.614 1
1 11 . 3 1 1 A 8 8 LEU CA C 8 55.498 54.859 0.639 1
1 12 . 3 1 1 A 8 8 LEU CB C 8 42.568 42.973 -0.405 1
1 13 . 3 1 1 A 8 8 LEU N N 8 122.916 128.261 -5.345 1
1 14 . 3 1 1 A 9 9 GLU H H 9 8.623 9.101 -0.478 1
1 15 . 3 1 1 A 9 9 GLU HA H 9 4.311 3.964 0.347 1
1 16 . 3 1 1 A 9 9 GLU C C 9 174.811 175.353 -0.542 1
1 17 . 3 1 1 A 9 9 GLU CA C 9 56.377 57.338 -0.961 1
1 18 . 3 1 1 A 9 9 GLU CB C 9 29.557 28.204 1.353 1
1 20 . 3 1 1 A 9 9 GLU N N 9 121.512 122.459 -0.947 1
1 21 . 3 1 1 A 10 10 LEU H H 10 7.853 8.504 -0.651 1
1 22 . 3 1 1 A 10 10 LEU HA H 10 5.225 5.460 -0.235 1
1 31 . 3 1 1 A 10 10 LEU C C 10 174.637 175.747 -1.110 1
1 32 . 3 1 1 A 10 10 LEU CA C 10 54.513 53.689 0.824 1
1 33 . 3 1 1 A 10 10 LEU CB C 10 45.187 45.332 -0.145 1
1 36 . 3 1 1 A 10 10 LEU N N 10 123.592 126.364 -2.772 1
1 37 . 3 1 1 A 11 11 GLU H H 11 8.894 9.072 -0.178 1
1 38 . 3 1 1 A 11 11 GLU HA H 11 4.765 5.130 -0.365 1
1 43 . 3 1 1 A 11 11 GLU C C 11 174.563 175.372 -0.809 1
1 44 . 3 1 1 A 11 11 GLU CA C 11 55.047 54.961 0.086 1
1 45 . 3 1 1 A 11 11 GLU CB C 11 33.760 32.766 0.994 1
1 47 . 3 1 1 A 11 11 GLU N N 11 124.055 123.326 0.729 1
1 48 . 3 1 1 A 12 12 VAL H H 12 8.607 9.035 -0.428 1
1 49 . 3 1 1 A 12 12 VAL HA H 12 5.174 5.324 -0.150 1
1 57 . 3 1 1 A 12 12 VAL C C 12 173.573 175.295 -1.722 1
1 58 . 3 1 1 A 12 12 VAL CA C 12 60.296 61.232 -0.936 1
1 59 . 3 1 1 A 12 12 VAL CB C 12 35.689 32.996 2.693 1
1 62 . 3 1 1 A 12 12 VAL N N 12 120.878 125.159 -4.281 1
1 63 . 3 1 1 A 13 13 HIS H H 13 8.982 8.688 0.294 1
1 64 . 3 1 1 A 13 13 HIS HA H 13 4.824 5.559 -0.735 1
1 69 . 3 1 1 A 13 13 HIS C C 13 173.236 172.186 1.050 1
1 70 . 3 1 1 A 13 13 HIS CA C 13 54.906 53.573 1.333 1
1 71 . 3 1 1 A 13 13 HIS CB C 13 33.496 33.426 0.070 1
1 72 . 3 1 1 A 13 13 HIS N N 13 121.504 122.647 -1.143 1
1 73 . 3 1 1 A 14 14 ILE H H 14 10.442 9.508 0.934 1
1 74 . 3 1 1 A 14 14 ILE HA H 14 5.458 5.112 0.346 1
1 84 . 3 1 1 A 14 14 ILE CA C 14 58.386 58.088 0.298 1
1 85 . 3 1 1 A 14 14 ILE CB C 14 38.596 38.583 0.013 1
1 88 . 3 1 1 A 14 14 ILE N N 14 119.923 121.556 -1.633 1
1 89 . 3 1 1 A 15 15 PRO HA H 15 4.560 4.600 -0.040 1
1 95 . 3 1 1 A 15 15 PRO C C 15 176.907 176.388 0.519 1
1 96 . 3 1 1 A 15 15 PRO CA C 15 64.342 64.286 0.056 1
1 97 . 3 1 1 A 15 15 PRO CB C 15 32.924 32.197 0.727 1
1 100 . 3 1 1 A 16 16 SER H H 16 7.331 7.809 -0.478 1
1 101 . 3 1 1 A 16 16 SER HA H 16 4.822 5.020 -0.198 1
1 104 . 3 1 1 A 16 16 SER C C 16 171.253 172.557 -1.304 1
1 105 . 3 1 1 A 16 16 SER CA C 16 57.135 57.726 -0.591 1
1 106 . 3 1 1 A 16 16 SER CB C 16 65.947 67.004 -1.057 1
1 107 . 3 1 1 A 16 16 SER N N 16 107.745 114.110 -6.365 1
1 108 . 3 1 1 A 17 17 VAL H H 17 8.350 8.462 -0.112 1
1 109 . 3 1 1 A 17 17 VAL HA H 17 4.926 4.932 -0.006 1
1 117 . 3 1 1 A 17 17 VAL C C 17 173.692 174.728 -1.036 1
1 118 . 3 1 1 A 17 17 VAL CA C 17 58.721 60.836 -2.115 1
1 119 . 3 1 1 A 17 17 VAL CB C 17 34.420 35.287 -0.867 1
1 122 . 3 1 1 A 17 17 VAL N N 17 118.680 122.664 -3.984 1
1 123 . 3 1 1 A 18 18 GLY H H 18 8.332 8.863 -0.531 1
1 124 . 3 1 1 A 18 18 GLY HA2 H 18 4.189 4.345 -0.156 1
1 125 . 3 1 1 A 18 18 GLY HA3 H 18 4.011 4.346 -0.335 1
1 126 . 3 1 1 A 18 18 GLY CA C 18 45.356 44.166 1.190 1
1 127 . 3 1 1 A 18 18 GLY N N 18 112.549 114.921 -2.372 1
1 128 . 3 1 1 A 19 19 PRO HA H 19 4.757 4.778 -0.021 1
1 134 . 3 1 1 A 19 19 PRO C C 19 177.482 176.234 1.248 1
1 135 . 3 1 1 A 19 19 PRO CA C 19 62.848 62.581 0.267 1
1 136 . 3 1 1 A 19 19 PRO CB C 19 32.283 31.977 0.306 1
1 139 . 3 1 1 A 20 20 GLU H H 20 8.588 8.743 -0.155 1
1 140 . 3 1 1 A 20 20 GLU HA H 20 4.147 4.600 -0.453 1
1 144 . 3 1 1 A 20 20 GLU C C 20 175.857 175.992 -0.135 1
1 145 . 3 1 1 A 20 20 GLU CA C 20 57.150 56.996 0.154 1
1 146 . 3 1 1 A 20 20 GLU CB C 20 30.923 33.142 -2.219 1
1 148 . 3 1 1 A 20 20 GLU N N 20 122.087 123.163 -1.076 1
1 149 . 3 1 1 A 21 21 ALA H H 21 8.352 7.246 1.106 1
1 150 . 3 1 1 A 21 21 ALA HA H 21 4.391 4.332 0.059 1
1 154 . 3 1 1 A 21 21 ALA C C 21 174.910 177.469 -2.559 1
1 155 . 3 1 1 A 21 21 ALA CA C 21 52.166 52.414 -0.248 1
1 156 . 3 1 1 A 21 21 ALA CB C 21 19.915 19.877 0.038 1
1 157 . 3 1 1 A 21 21 ALA N N 21 124.593 122.784 1.809 1
1 158 . 3 1 1 A 22 22 GLU H H 22 8.398 8.606 -0.208 1
1 159 . 3 1 1 A 22 22 GLU HA H 22 4.331 4.504 -0.173 1
1 163 . 3 1 1 A 22 22 GLU C C 22 176.389 176.574 -0.185 1
1 164 . 3 1 1 A 22 22 GLU CA C 22 56.316 56.706 -0.390 1
1 165 . 3 1 1 A 22 22 GLU CB C 22 30.713 29.973 0.740 1
1 167 . 3 1 1 A 22 22 GLU N N 22 120.159 120.340 -0.181 1
1 168 . 3 1 1 A 23 23 GLY H H 23 8.246 8.688 -0.442 1
1 169 . 3 1 1 A 23 23 GLY HA2 H 23 4.162 4.377 -0.215 1
1 170 . 3 1 1 A 23 23 GLY HA3 H 23 4.061 4.439 -0.378 1
1 171 . 3 1 1 A 23 23 GLY CA C 23 44.801 44.726 0.075 1
1 172 . 3 1 1 A 23 23 GLY N N 23 110.080 113.005 -2.925 1
1 173 . 3 1 1 A 24 24 PRO HA H 24 4.417 4.611 -0.194 1
1 178 . 3 1 1 A 24 24 PRO C C 24 177.135 176.256 0.879 1
1 179 . 3 1 1 A 24 24 PRO CA C 24 63.520 62.393 1.127 1
1 180 . 3 1 1 A 24 24 PRO CB C 24 32.124 32.845 -0.721 1
1 183 . 3 1 1 A 25 25 ARG H H 25 8.409 8.404 0.005 1
1 184 . 3 1 1 A 25 25 ARG HA H 25 4.298 4.224 0.074 1
1 187 . 3 1 1 A 25 25 ARG C C 25 176.217 175.857 0.360 1
1 188 . 3 1 1 A 25 25 ARG CA C 25 56.237 55.703 0.534 1
1 189 . 3 1 1 A 25 25 ARG CB C 25 30.467 30.970 -0.503 1
1 192 . 3 1 1 A 25 25 ARG N N 25 120.147 121.421 -1.274 1
1 193 . 3 1 1 A 26 26 GLN H H 26 8.278 8.428 -0.150 1
1 194 . 3 1 1 A 26 26 GLN HA H 26 4.336 4.239 0.097 1
1 200 . 3 1 1 A 26 26 GLN C C 26 175.566 176.104 -0.538 1
1 201 . 3 1 1 A 26 26 GLN CA C 26 55.788 56.250 -0.462 1
1 202 . 3 1 1 A 26 26 GLN CB C 26 29.714 28.493 1.221 1
1 204 . 3 1 1 A 26 26 GLN N N 26 120.460 123.197 -2.737 1
1 206 . 3 1 1 A 27 27 SER H H 27 8.298 8.617 -0.319 1
1 208 . 3 1 1 A 27 27 SER CA C 27 56.156 55.544 0.612 1
1 209 . 3 1 1 A 27 27 SER CB C 27 63.813 65.068 -1.255 1
1 210 . 3 1 1 A 27 27 SER N N 27 117.382 120.862 -3.480 1
1 211 . 3 1 1 A 28 28 PRO HA H 28 4.366 4.498 -0.132 1
1 216 . 3 1 1 A 28 28 PRO C C 28 177.555 176.313 1.242 1
1 217 . 3 1 1 A 28 28 PRO CA C 28 64.486 64.266 0.220 1
1 218 . 3 1 1 A 28 28 PRO CB C 28 31.892 32.241 -0.349 1
1 221 . 3 1 1 A 29 29 GLU H H 29 8.582 7.955 0.627 1
1 222 . 3 1 1 A 29 29 GLU HA H 29 4.218 4.627 -0.409 1
1 226 . 3 1 1 A 29 29 GLU CA C 29 57.261 55.226 2.035 1
1 227 . 3 1 1 A 29 29 GLU CB C 29 29.633 31.951 -2.318 1
1 229 . 3 1 1 A 29 29 GLU N N 29 118.309 118.984 -0.675 1
1 230 . 3 1 1 A 30 30 LYS H H 30 7.955 8.818 -0.863 1
1 231 . 3 1 1 A 30 30 LYS HA H 30 4.328 4.218 0.110 1
1 236 . 3 1 1 A 30 30 LYS C C 30 176.222 174.637 1.585 1
1 237 . 3 1 1 A 30 30 LYS CA C 30 56.247 58.466 -2.219 1
1 238 . 3 1 1 A 30 30 LYS CB C 30 32.720 31.369 1.351 1
1 242 . 3 1 1 A 30 30 LYS N N 30 120.129 118.746 1.383 1
1 243 . 3 1 1 A 31 31 SER H H 31 7.883 8.229 -0.346 1
1 244 . 3 1 1 A 31 31 SER HA H 31 4.458 5.147 -0.689 1
1 246 . 3 1 1 A 31 31 SER C C 31 174.129 173.147 0.982 1
1 247 . 3 1 1 A 31 31 SER CA C 31 58.477 56.862 1.615 1
1 248 . 3 1 1 A 31 31 SER CB C 31 64.042 64.959 -0.917 1
1 249 . 3 1 1 A 31 31 SER N N 31 115.366 115.220 0.146 1
1 250 . 3 1 1 A 32 32 HIS H H 32 8.485 8.527 -0.042 1
1 251 . 3 1 1 A 32 32 HIS HA H 32 4.450 4.702 -0.252 1
1 255 . 3 1 1 A 32 32 HIS CA C 32 56.009 55.919 0.090 1
1 256 . 3 1 1 A 32 32 HIS CB C 32 31.122 30.119 1.003 1
1 257 . 3 1 1 A 32 32 HIS N N 32 121.500 121.808 -0.308 1
1 258 . 3 1 1 A 33 33 MET H H 33 8.392 7.108 1.284 1
1 259 . 3 1 1 A 33 33 MET HA H 33 4.601 4.634 -0.033 1
1 265 . 3 1 1 A 33 33 MET C C 33 175.842 175.249 0.593 1
1 266 . 3 1 1 A 33 33 MET CA C 33 54.533 54.030 0.503 1
1 267 . 3 1 1 A 33 33 MET CB C 33 32.868 34.224 -1.356 1
1 270 . 3 1 1 A 33 33 MET N N 33 120.204 120.403 -0.199 1
1 271 . 3 1 1 A 34 34 VAL H H 34 8.938 8.504 0.434 1
1 272 . 3 1 1 A 34 34 VAL HA H 34 4.430 4.592 -0.162 1
1 280 . 3 1 1 A 34 34 VAL C C 34 174.149 173.911 0.238 1
1 281 . 3 1 1 A 34 34 VAL CA C 34 60.703 59.911 0.792 1
1 282 . 3 1 1 A 34 34 VAL CB C 34 34.319 34.908 -0.589 1
1 285 . 3 1 1 A 34 34 VAL N N 34 118.512 124.521 -6.009 1
1 286 . 3 1 1 A 35 35 PHE H H 35 9.242 8.166 1.076 1
1 287 . 3 1 1 A 35 35 PHE HA H 35 4.439 5.425 -0.986 1
1 294 . 3 1 1 A 35 35 PHE C C 35 174.831 174.805 0.026 1
1 295 . 3 1 1 A 35 35 PHE CA C 35 57.754 55.239 2.515 1
1 296 . 3 1 1 A 35 35 PHE CB C 35 38.959 41.784 -2.825 1
1 297 . 3 1 1 A 35 35 PHE N N 35 124.912 125.786 -0.874 1
1 298 . 3 1 1 A 36 36 ARG H H 36 8.475 8.925 -0.450 1
1 299 . 3 1 1 A 36 36 ARG HA H 36 4.135 4.732 -0.597 1
1 304 . 3 1 1 A 36 36 ARG C C 36 172.865 175.678 -2.813 1
1 305 . 3 1 1 A 36 36 ARG CA C 36 56.895 55.878 1.017 1
1 306 . 3 1 1 A 36 36 ARG CB C 36 28.962 30.545 -1.583 1
1 308 . 3 1 1 A 36 36 ARG N N 36 125.680 120.638 5.042 1
1 309 . 3 1 1 A 37 37 VAL H H 37 8.066 8.998 -0.932 1
1 310 . 3 1 1 A 37 37 VAL HA H 37 4.292 4.850 -0.558 1
1 318 . 3 1 1 A 37 37 VAL C C 37 174.595 175.002 -0.407 1
1 319 . 3 1 1 A 37 37 VAL CA C 37 62.727 61.157 1.570 1
1 320 . 3 1 1 A 37 37 VAL CB C 37 31.102 33.460 -2.358 1
1 323 . 3 1 1 A 37 37 VAL N N 37 125.403 120.374 5.029 1
1 324 . 3 1 1 A 38 38 GLU H H 38 9.532 9.382 0.150 1
1 325 . 3 1 1 A 38 38 GLU HA H 38 4.895 5.186 -0.291 1
1 329 . 3 1 1 A 38 38 GLU C C 38 174.509 175.220 -0.711 1
1 330 . 3 1 1 A 38 38 GLU CA C 38 55.650 55.616 0.034 1
1 331 . 3 1 1 A 38 38 GLU CB C 38 32.214 30.074 2.140 1
1 333 . 3 1 1 A 38 38 GLU N N 38 129.885 126.660 3.225 1
1 334 . 3 1 1 A 39 39 VAL H H 39 9.035 8.298 0.737 1
1 335 . 3 1 1 A 39 39 VAL HA H 39 4.446 4.396 0.050 1
1 343 . 3 1 1 A 39 39 VAL C C 39 173.661 174.777 -1.116 1
1 344 . 3 1 1 A 39 39 VAL CA C 39 61.258 62.580 -1.322 1
1 345 . 3 1 1 A 39 39 VAL CB C 39 33.533 31.114 2.419 1
1 348 . 3 1 1 A 39 39 VAL N N 39 127.941 126.474 1.467 1
1 349 . 3 1 1 A 40 40 LEU H H 40 8.843 9.127 -0.284 1
1 350 . 3 1 1 A 40 40 LEU HA H 40 5.130 5.382 -0.252 1
1 360 . 3 1 1 A 40 40 LEU C C 40 175.581 175.448 0.133 1
1 361 . 3 1 1 A 40 40 LEU CA C 40 53.702 53.825 -0.123 1
1 362 . 3 1 1 A 40 40 LEU CB C 40 43.989 43.793 0.196 1
1 366 . 3 1 1 A 40 40 LEU N N 40 128.413 130.070 -1.657 1
1 367 . 3 1 1 A 41 41 CYS H H 41 8.959 9.310 -0.351 1
1 368 . 3 1 1 A 41 41 CYS HA H 41 5.174 5.675 -0.501 1
1 371 . 3 1 1 A 41 41 CYS C C 41 175.043 174.100 0.943 1
1 372 . 3 1 1 A 41 41 CYS CA C 41 57.483 58.283 -0.800 1
1 373 . 3 1 1 A 41 41 CYS CB C 41 28.472 30.253 -1.781 1
1 374 . 3 1 1 A 41 41 CYS N N 41 124.738 124.972 -0.234 1
1 375 . 3 1 1 A 42 42 SER H H 42 9.527 9.344 0.183 1
1 376 . 3 1 1 A 42 42 SER HA H 42 4.149 4.137 0.012 1
1 379 . 3 1 1 A 42 42 SER C C 42 175.014 173.603 1.411 1
1 380 . 3 1 1 A 42 42 SER CA C 42 59.058 59.212 -0.154 1
1 381 . 3 1 1 A 42 42 SER CB C 42 62.287 62.285 0.002 1
1 382 . 3 1 1 A 42 42 SER N N 42 125.889 123.052 2.837 1
1 383 . 3 1 1 A 43 43 GLY H H 43 8.685 8.420 0.265 1
1 384 . 3 1 1 A 43 43 GLY HA2 H 43 3.594 3.871 -0.277 1
1 385 . 3 1 1 A 43 43 GLY HA3 H 43 4.210 3.877 0.333 1
1 386 . 3 1 1 A 43 43 GLY C C 43 173.664 173.665 -0.001 1
1 387 . 3 1 1 A 43 43 GLY CA C 43 45.404 45.233 0.171 1
1 388 . 3 1 1 A 43 43 GLY N N 43 104.633 106.278 -1.645 1
1 389 . 3 1 1 A 44 44 ARG H H 44 7.926 7.665 0.261 1
1 390 . 3 1 1 A 44 44 ARG HA H 44 4.678 4.575 0.103 1
1 395 . 3 1 1 A 44 44 ARG C C 44 175.261 175.293 -0.032 1
1 396 . 3 1 1 A 44 44 ARG CA C 44 55.011 55.463 -0.452 1
1 397 . 3 1 1 A 44 44 ARG CB C 44 32.138 31.825 0.313 1
1 400 . 3 1 1 A 44 44 ARG N N 44 121.239 120.464 0.775 1
1 401 . 3 1 1 A 45 45 ARG H H 45 8.775 9.146 -0.371 1
1 402 . 3 1 1 A 45 45 ARG HA H 45 5.770 5.665 0.105 1
1 409 . 3 1 1 A 45 45 ARG C C 45 176.064 174.409 1.655 1
1 410 . 3 1 1 A 45 45 ARG CA C 45 54.683 54.486 0.197 1
1 411 . 3 1 1 A 45 45 ARG CB C 45 33.748 33.254 0.494 1
1 414 . 3 1 1 A 45 45 ARG N N 45 125.948 120.478 5.470 1
1 415 . 3 1 1 A 46 46 HIS H H 46 8.912 8.798 0.114 1
1 416 . 3 1 1 A 46 46 HIS HA H 46 4.927 5.256 -0.329 1
1 420 . 3 1 1 A 46 46 HIS C C 46 172.634 173.839 -1.205 1
1 421 . 3 1 1 A 46 46 HIS CA C 46 56.480 54.416 2.064 1
1 422 . 3 1 1 A 46 46 HIS CB C 46 33.608 32.800 0.808 1
1 423 . 3 1 1 A 46 46 HIS N N 46 121.825 123.567 -1.742 1
1 424 . 3 1 1 A 47 47 THR H H 47 8.532 8.585 -0.053 1
1 425 . 3 1 1 A 47 47 THR HA H 47 5.472 4.516 0.956 1
1 430 . 3 1 1 A 47 47 THR C C 47 174.442 174.115 0.327 1
1 431 . 3 1 1 A 47 47 THR CA C 47 61.093 62.654 -1.561 1
1 432 . 3 1 1 A 47 47 THR CB C 47 71.041 68.853 2.188 1
1 434 . 3 1 1 A 47 47 THR N N 47 115.450 121.408 -5.958 1
1 435 . 3 1 1 A 48 48 VAL H H 48 9.695 9.211 0.484 1
1 436 . 3 1 1 A 48 48 VAL HA H 48 4.677 4.618 0.059 1
1 444 . 3 1 1 A 48 48 VAL CA C 48 58.172 59.392 -1.220 1
1 445 . 3 1 1 A 48 48 VAL CB C 48 34.990 32.838 2.152 1
1 448 . 3 1 1 A 48 48 VAL N N 48 126.721 127.471 -0.750 1
1 449 . 3 1 1 A 49 49 PRO HA H 49 5.087 4.652 0.435 1
1 453 . 3 1 1 A 49 49 PRO CA C 49 61.671 63.129 -1.458 1
1 454 . 3 1 1 A 49 49 PRO CB C 49 31.923 31.910 0.013 1
1 457 . 3 1 1 A 50 50 ARG H H 50 9.125 9.234 -0.109 1
1 458 . 3 1 1 A 50 50 ARG HA H 50 4.974 4.709 0.265 1
1 464 . 3 1 1 A 50 50 ARG C C 50 176.187 174.794 1.393 1
1 465 . 3 1 1 A 50 50 ARG CA C 50 53.015 54.988 -1.973 1
1 466 . 3 1 1 A 50 50 ARG CB C 50 36.553 33.241 3.312 1
1 468 . 3 1 1 A 50 50 ARG N N 50 124.189 122.878 1.311 1
1 469 . 3 1 1 A 51 51 ARG H H 51 10.105 8.291 1.814 1
1 470 . 3 1 1 A 51 51 ARG HA H 51 5.196 4.182 1.014 1
1 475 . 3 1 1 A 51 51 ARG C C 51 178.865 176.773 2.092 1
1 476 . 3 1 1 A 51 51 ARG CA C 51 55.961 56.511 -0.550 1
1 477 . 3 1 1 A 51 51 ARG CB C 51 32.539 31.081 1.458 1
1 480 . 3 1 1 A 51 51 ARG N N 51 124.521 127.983 -3.462 1
1 481 . 3 1 1 A 52 52 TYR H H 52 10.397 8.766 1.631 1
1 482 . 3 1 1 A 52 52 TYR HA H 52 4.360 4.079 0.281 1
1 487 . 3 1 1 A 52 52 TYR C C 52 178.143 177.664 0.479 1
1 488 . 3 1 1 A 52 52 TYR CA C 52 63.538 62.549 0.989 1
1 489 . 3 1 1 A 52 52 TYR CB C 52 38.784 39.063 -0.279 1
1 490 . 3 1 1 A 52 52 TYR N N 52 124.772 128.627 -3.855 1
1 491 . 3 1 1 A 53 53 SER H H 53 9.231 8.215 1.016 1
1 492 . 3 1 1 A 53 53 SER HA H 53 4.175 4.281 -0.106 1
1 493 . 3 1 1 A 53 53 SER C C 53 177.220 177.010 0.210 1
1 494 . 3 1 1 A 53 53 SER CA C 53 61.606 61.412 0.194 1
1 495 . 3 1 1 A 53 53 SER N N 53 113.262 114.587 -1.325 1
1 496 . 3 1 1 A 54 54 GLU H H 54 7.807 7.706 0.101 1
1 497 . 3 1 1 A 54 54 GLU HA H 54 4.392 4.245 0.147 1
1 501 . 3 1 1 A 54 54 GLU C C 54 180.361 178.983 1.378 1
1 502 . 3 1 1 A 54 54 GLU CA C 54 59.497 58.893 0.604 1
1 503 . 3 1 1 A 54 54 GLU CB C 54 30.708 29.588 1.120 1
1 504 . 3 1 1 A 54 54 GLU N N 54 121.949 121.890 0.059 1
1 505 . 3 1 1 A 55 55 PHE H H 55 8.133 8.221 -0.088 1
1 506 . 3 1 1 A 55 55 PHE HA H 55 4.007 4.213 -0.206 1
1 513 . 3 1 1 A 55 55 PHE C C 55 176.531 177.595 -1.064 1
1 514 . 3 1 1 A 55 55 PHE CA C 55 61.848 61.407 0.441 1
1 515 . 3 1 1 A 55 55 PHE CB C 55 38.847 39.008 -0.161 1
1 516 . 3 1 1 A 55 55 PHE N N 55 119.998 121.910 -1.912 1
1 517 . 3 1 1 A 56 56 HIS H H 56 7.907 7.894 0.013 1
1 518 . 3 1 1 A 56 56 HIS HA H 56 3.324 3.953 -0.629 1
1 522 . 3 1 1 A 56 56 HIS C C 56 176.748 177.427 -0.679 1
1 523 . 3 1 1 A 56 56 HIS CA C 56 58.770 59.924 -1.154 1
1 524 . 3 1 1 A 56 56 HIS CB C 56 30.404 29.072 1.332 1
1 525 . 3 1 1 A 56 56 HIS N N 56 119.173 118.138 1.035 1
1 526 . 3 1 1 A 57 57 ALA H H 57 7.962 7.952 0.010 1
1 527 . 3 1 1 A 57 57 ALA HA H 57 3.865 3.806 0.059 1
1 531 . 3 1 1 A 57 57 ALA C C 57 180.075 179.775 0.300 1
1 532 . 3 1 1 A 57 57 ALA CA C 57 54.996 54.991 0.005 1
1 533 . 3 1 1 A 57 57 ALA CB C 57 18.226 18.008 0.218 1
1 534 . 3 1 1 A 57 57 ALA N N 57 120.094 121.173 -1.079 1
1 535 . 3 1 1 A 58 58 LEU H H 58 7.295 8.365 -1.070 1
1 536 . 3 1 1 A 58 58 LEU HA H 58 3.994 3.557 0.437 1
1 546 . 3 1 1 A 58 58 LEU C C 58 177.428 178.271 -0.843 1
1 547 . 3 1 1 A 58 58 LEU CA C 58 58.342 57.597 0.745 1
1 548 . 3 1 1 A 58 58 LEU CB C 58 40.851 41.149 -0.298 1
1 552 . 3 1 1 A 58 58 LEU N N 58 119.404 120.147 -0.743 1
1 553 . 3 1 1 A 59 59 HIS H H 59 7.805 8.281 -0.476 1
1 554 . 3 1 1 A 59 59 HIS HA H 59 4.286 3.631 0.655 1
1 558 . 3 1 1 A 59 59 HIS C C 59 177.001 176.939 0.062 1
1 559 . 3 1 1 A 59 59 HIS CA C 59 60.141 59.954 0.187 1
1 560 . 3 1 1 A 59 59 HIS CB C 59 31.072 29.468 1.604 1
1 561 . 3 1 1 A 59 59 HIS N N 59 119.040 117.597 1.443 1
1 562 . 3 1 1 A 60 60 LYS H H 60 7.715 7.538 0.177 1
1 563 . 3 1 1 A 60 60 LYS HA H 60 3.456 3.743 -0.287 1
1 570 . 3 1 1 A 60 60 LYS C C 60 178.464 179.227 -0.763 1
1 571 . 3 1 1 A 60 60 LYS CA C 60 59.629 58.833 0.796 1
1 572 . 3 1 1 A 60 60 LYS CB C 60 32.354 31.731 0.623 1
1 576 . 3 1 1 A 60 60 LYS N N 60 114.225 118.299 -4.074 1
1 577 . 3 1 1 A 61 61 ARG H H 61 7.486 7.431 0.055 1
1 578 . 3 1 1 A 61 61 ARG HA H 61 4.202 4.032 0.170 1
1 584 . 3 1 1 A 61 61 ARG C C 61 178.995 178.541 0.454 1
1 585 . 3 1 1 A 61 61 ARG CA C 61 58.387 58.593 -0.206 1
1 586 . 3 1 1 A 61 61 ARG CB C 61 31.216 29.947 1.269 1
1 589 . 3 1 1 A 61 61 ARG N N 61 115.929 120.407 -4.478 1
1 590 . 3 1 1 A 62 62 ILE H H 62 8.066 7.360 0.706 1
1 591 . 3 1 1 A 62 62 ILE HA H 62 4.491 3.956 0.535 1
1 601 . 3 1 1 A 62 62 ILE C C 62 177.838 177.603 0.235 1
1 602 . 3 1 1 A 62 62 ILE CA C 62 63.399 62.740 0.659 1
1 603 . 3 1 1 A 62 62 ILE CB C 62 39.699 37.763 1.936 1
1 606 . 3 1 1 A 62 62 ILE N N 62 111.456 116.689 -5.233 1
1 607 . 3 1 1 A 63 63 LYS H H 63 8.158 8.372 -0.214 1
1 608 . 3 1 1 A 63 63 LYS HA H 63 4.136 3.804 0.332 1
1 615 . 3 1 1 A 63 63 LYS C C 63 176.358 177.837 -1.479 1
1 616 . 3 1 1 A 63 63 LYS CA C 63 58.753 58.736 0.017 1
1 617 . 3 1 1 A 63 63 LYS CB C 63 30.825 31.950 -1.125 1
1 621 . 3 1 1 A 63 63 LYS N N 63 120.800 123.335 -2.535 1
1 622 . 3 1 1 A 64 64 LYS H H 64 7.687 7.795 -0.108 1
1 623 . 3 1 1 A 64 64 LYS HA H 64 4.301 4.169 0.132 1
1 628 . 3 1 1 A 64 64 LYS C C 64 177.084 178.340 -1.256 1
1 629 . 3 1 1 A 64 64 LYS CA C 64 57.237 58.073 -0.836 1
1 630 . 3 1 1 A 64 64 LYS CB C 64 32.502 32.678 -0.176 1
1 634 . 3 1 1 A 64 64 LYS N N 64 116.548 119.422 -2.874 1
1 635 . 3 1 1 A 65 65 LEU H H 65 7.476 7.767 -0.291 1
1 636 . 3 1 1 A 65 65 LEU HA H 65 4.219 4.197 0.022 1
1 645 . 3 1 1 A 65 65 LEU C C 65 175.886 176.034 -0.148 1
1 646 . 3 1 1 A 65 65 LEU CA C 65 55.542 57.180 -1.638 1
1 647 . 3 1 1 A 65 65 LEU CB C 65 45.493 42.751 2.742 1
1 650 . 3 1 1 A 65 65 LEU N N 65 118.000 120.407 -2.407 1
1 651 . 3 1 1 A 66 66 TYR H H 66 7.672 8.100 -0.428 1
1 652 . 3 1 1 A 66 66 TYR HA H 66 4.762 5.165 -0.403 1
1 660 . 3 1 1 A 66 66 TYR C C 66 174.199 174.216 -0.017 1
1 661 . 3 1 1 A 66 66 TYR CA C 66 56.013 55.395 0.618 1
1 662 . 3 1 1 A 66 66 TYR CB C 66 40.380 41.099 -0.719 1
1 663 . 3 1 1 A 66 66 TYR N N 66 116.805 113.620 3.185 1
1 664 . 3 1 1 A 67 67 LYS H H 67 8.547 8.503 0.044 1
1 665 . 3 1 1 A 67 67 LYS HA H 67 4.436 4.470 -0.034 1
1 670 . 3 1 1 A 67 67 LYS C C 67 175.727 175.911 -0.184 1
1 671 . 3 1 1 A 67 67 LYS CA C 67 56.598 56.546 0.052 1
1 672 . 3 1 1 A 67 67 LYS CB C 67 32.743 32.733 0.010 1
1 676 . 3 1 1 A 67 67 LYS N N 67 120.929 120.359 0.570 1
1 677 . 3 1 1 A 68 68 VAL H H 68 8.168 8.143 0.025 1
1 678 . 3 1 1 A 68 68 VAL HA H 68 4.869 4.424 0.445 1
1 686 . 3 1 1 A 68 68 VAL CA C 68 57.389 58.724 -1.335 1
1 687 . 3 1 1 A 68 68 VAL CB C 68 34.017 35.272 -1.255 1
1 690 . 3 1 1 A 68 68 VAL N N 68 116.467 123.444 -6.977 1
1 691 . 3 1 1 A 69 69 PRO HA H 69 4.674 4.707 -0.033 1
1 696 . 3 1 1 A 69 69 PRO C C 69 178.013 176.077 1.936 1
1 697 . 3 1 1 A 69 69 PRO CA C 69 61.443 62.235 -0.792 1
1 698 . 3 1 1 A 69 69 PRO CB C 69 32.231 33.142 -0.911 1
1 701 . 3 1 1 A 70 70 ASP H H 70 8.167 8.599 -0.432 1
1 702 . 3 1 1 A 70 70 ASP HA H 70 4.531 5.020 -0.489 1
1 705 . 3 1 1 A 70 70 ASP C C 70 175.660 175.481 0.179 1
1 706 . 3 1 1 A 70 70 ASP CA C 70 55.148 53.904 1.244 1
1 707 . 3 1 1 A 70 70 ASP CB C 70 40.876 41.951 -1.075 1
1 708 . 3 1 1 A 70 70 ASP N N 70 116.671 121.011 -4.340 1
1 709 . 3 1 1 A 71 71 PHE H H 71 8.387 8.543 -0.156 1
1 710 . 3 1 1 A 71 71 PHE HA H 71 4.076 4.678 -0.602 1
1 717 . 3 1 1 A 71 71 PHE CA C 71 55.672 54.731 0.941 1
1 718 . 3 1 1 A 71 71 PHE CB C 71 39.155 41.332 -2.177 1
1 719 . 3 1 1 A 71 71 PHE N N 71 126.533 116.906 9.627 1
1 720 . 3 1 1 A 72 72 PRO HA H 72 4.156 4.615 -0.459 1
1 727 . 3 1 1 A 72 72 PRO CA C 72 63.079 62.276 0.803 1
1 728 . 3 1 1 A 72 72 PRO CB C 72 32.107 32.549 -0.442 1
1 731 . 3 1 1 A 73 73 SER H H 73 8.468 8.490 -0.022 1
1 733 . 3 1 1 A 73 73 SER CA C 73 56.133 58.478 -2.345 1
1 734 . 3 1 1 A 73 73 SER CB C 73 63.991 63.620 0.371 1
1 735 . 3 1 1 A 73 73 SER N N 73 121.533 116.576 4.957 1
1 736 . 3 1 1 A 74 74 LYS HA H 74 4.574 4.100 0.474 1
1 739 . 3 1 1 A 74 74 LYS CA C 74 55.659 58.529 -2.870 1
1 740 . 3 1 1 A 74 74 LYS CB C 74 30.550 32.206 -1.656 1
1 741 . 3 1 1 A 75 75 ARG H H 75 7.962 7.195 0.767 1
1 742 . 3 1 1 A 75 75 ARG HA H 75 4.162 4.712 -0.550 1
1 746 . 3 1 1 A 75 75 ARG CA C 75 56.123 55.780 0.343 1
1 747 . 3 1 1 A 75 75 ARG CB C 75 31.179 31.308 -0.129 1
1 749 . 3 1 1 A 75 75 ARG N N 75 121.665 121.553 0.112 1
1 750 . 3 1 1 A 76 76 LEU H H 76 8.071 8.708 -0.637 1
1 751 . 3 1 1 A 76 76 LEU HA H 76 4.618 4.916 -0.298 1
1 759 . 3 1 1 A 76 76 LEU CA C 76 52.764 51.125 1.639 1
1 760 . 3 1 1 A 76 76 LEU CB C 76 41.918 46.255 -4.337 1
1 762 . 3 1 1 A 76 76 LEU N N 76 124.196 128.109 -3.913 1
1 763 . 3 1 1 A 77 77 PRO HA H 77 4.393 4.562 -0.169 1
1 767 . 3 1 1 A 77 77 PRO CA C 77 63.746 63.144 0.602 1
1 770 . 3 1 1 A 78 78 ASN H H 78 8.379 8.827 -0.448 1
1 771 . 3 1 1 A 78 78 ASN HA H 78 4.586 4.444 0.142 1
1 776 . 3 1 1 A 78 78 ASN C C 78 175.648 175.639 0.009 1
1 777 . 3 1 1 A 78 78 ASN CA C 78 53.591 55.635 -2.044 1
1 778 . 3 1 1 A 78 78 ASN CB C 78 37.826 38.596 -0.770 1
1 779 . 3 1 1 A 78 78 ASN N N 78 115.292 120.833 -5.541 1
1 781 . 3 1 1 A 79 79 TRP H H 79 7.900 7.957 -0.057 1
1 782 . 3 1 1 A 79 79 TRP HA H 79 4.326 4.284 0.042 1
1 788 . 3 1 1 A 79 79 TRP CA C 79 58.825 58.100 0.725 1
1 789 . 3 1 1 A 79 79 TRP CB C 79 29.090 28.849 0.241 1
1 790 . 3 1 1 A 79 79 TRP N N 79 119.525 118.637 0.888 1
1 792 . 3 1 1 A 80 80 ARG H H 80 8.060 8.064 -0.004 1
1 793 . 3 1 1 A 80 80 ARG HA H 80 3.913 4.174 -0.261 1
1 798 . 3 1 1 A 80 80 ARG C C 80 177.024 177.541 -0.517 1
1 799 . 3 1 1 A 80 80 ARG CA C 80 58.292 58.761 -0.469 1
1 800 . 3 1 1 A 80 80 ARG CB C 80 30.146 30.210 -0.064 1
1 803 . 3 1 1 A 80 80 ARG N N 80 118.864 119.510 -0.646 1
1 804 . 3 1 1 A 81 81 THR H H 81 7.725 7.513 0.212 1
1 805 . 3 1 1 A 81 81 THR HA H 81 4.297 4.487 -0.190 1
1 809 . 3 1 1 A 81 81 THR CA C 81 62.481 62.956 -0.475 1
1 811 . 3 1 1 A 81 81 THR N N 81 109.863 109.421 0.442 1
1 812 . 3 1 1 A 82 82 ARG HA H 82 4.341 4.101 0.240 1
1 816 . 3 1 1 A 82 82 ARG C C 82 177.261 175.943 1.318 1
1 817 . 3 1 1 A 82 82 ARG CA C 82 56.846 55.465 1.381 1
1 818 . 3 1 1 A 82 82 ARG CB C 82 30.288 30.245 0.043 1
1 820 . 3 1 1 A 83 83 GLY H H 83 8.321 8.422 -0.101 1
1 821 . 3 1 1 A 83 83 GLY HA2 H 83 3.957 4.110 -0.153 1
1 822 . 3 1 1 A 83 83 GLY C C 83 175.185 175.290 -0.105 1
1 823 . 3 1 1 A 83 83 GLY CA C 83 46.297 45.475 0.822 1
1 824 . 3 1 1 A 83 83 GLY N N 83 109.146 112.416 -3.270 1
1 825 . 3 1 1 A 84 84 LEU H H 84 8.303 8.796 -0.493 1
1 826 . 3 1 1 A 84 84 LEU HA H 84 4.018 4.375 -0.357 1
1 835 . 3 1 1 A 84 84 LEU C C 84 178.552 178.988 -0.436 1
1 836 . 3 1 1 A 84 84 LEU CA C 84 58.236 57.638 0.598 1
1 837 . 3 1 1 A 84 84 LEU CB C 84 41.837 41.498 0.339 1
1 840 . 3 1 1 A 84 84 LEU N N 84 122.662 123.162 -0.500 1
1 841 . 3 1 1 A 85 85 GLU H H 85 8.233 8.468 -0.235 1
1 842 . 3 1 1 A 85 85 GLU HA H 85 4.371 3.894 0.477 1
1 846 . 3 1 1 A 85 85 GLU C C 85 178.555 178.492 0.063 1
1 847 . 3 1 1 A 85 85 GLU CA C 85 58.377 59.852 -1.475 1
1 848 . 3 1 1 A 85 85 GLU CB C 85 28.675 29.264 -0.589 1
1 850 . 3 1 1 A 85 85 GLU N N 85 119.781 120.749 -0.968 1
1 851 . 3 1 1 A 86 86 GLN H H 86 7.877 7.615 0.262 1
1 852 . 3 1 1 A 86 86 GLN HA H 86 4.100 4.180 -0.080 1
1 858 . 3 1 1 A 86 86 GLN C C 86 179.557 178.413 1.144 1
1 859 . 3 1 1 A 86 86 GLN CA C 86 58.955 59.018 -0.063 1
1 860 . 3 1 1 A 86 86 GLN CB C 86 28.191 28.784 -0.593 1
1 862 . 3 1 1 A 86 86 GLN N N 86 118.042 119.271 -1.229 1
1 863 . 3 1 1 A 87 87 ARG H H 87 8.169 8.351 -0.182 1
1 864 . 3 1 1 A 87 87 ARG HA H 87 3.975 3.922 0.053 1
1 868 . 3 1 1 A 87 87 ARG C C 87 177.051 178.421 -1.370 1
1 869 . 3 1 1 A 87 87 ARG CA C 87 59.006 59.395 -0.389 1
1 870 . 3 1 1 A 87 87 ARG CB C 87 30.383 29.161 1.222 1
1 872 . 3 1 1 A 87 87 ARG N N 87 121.381 120.109 1.272 1
1 873 . 3 1 1 A 88 88 ARG H H 88 8.593 8.185 0.408 1
1 874 . 3 1 1 A 88 88 ARG HA H 88 3.726 3.725 0.001 1
1 876 . 3 1 1 A 88 88 ARG C C 88 177.520 178.325 -0.805 1
1 877 . 3 1 1 A 88 88 ARG CA C 88 60.751 59.426 1.325 1
1 878 . 3 1 1 A 88 88 ARG CB C 88 30.153 29.895 0.258 1
1 879 . 3 1 1 A 88 88 ARG N N 88 120.863 119.463 1.400 1
1 880 . 3 1 1 A 89 89 GLN H H 89 8.355 8.038 0.317 1
1 881 . 3 1 1 A 89 89 GLN HA H 89 3.887 3.908 -0.021 1
1 887 . 3 1 1 A 89 89 GLN C C 89 179.499 178.453 1.046 1
1 888 . 3 1 1 A 89 89 GLN CA C 89 59.603 59.512 0.091 1
1 889 . 3 1 1 A 89 89 GLN CB C 89 28.464 28.103 0.361 1
1 891 . 3 1 1 A 89 89 GLN N N 89 116.860 118.630 -1.770 1
1 893 . 3 1 1 A 90 90 GLY H H 90 8.406 7.956 0.450 1
1 894 . 3 1 1 A 90 90 GLY HA2 H 90 3.672 3.499 0.173 1
1 895 . 3 1 1 A 90 90 GLY HA3 H 90 3.871 3.606 0.265 1
1 896 . 3 1 1 A 90 90 GLY C C 90 177.033 175.524 1.509 1
1 897 . 3 1 1 A 90 90 GLY CA C 90 46.813 47.109 -0.296 1
1 898 . 3 1 1 A 90 90 GLY N N 90 107.679 107.161 0.518 1
1 899 . 3 1 1 A 91 91 LEU H H 91 8.504 8.235 0.269 1
1 900 . 3 1 1 A 91 91 LEU HA H 91 3.784 4.009 -0.225 1
1 910 . 3 1 1 A 91 91 LEU C C 91 178.003 179.309 -1.306 1
1 911 . 3 1 1 A 91 91 LEU CA C 91 57.354 57.694 -0.340 1
1 912 . 3 1 1 A 91 91 LEU CB C 91 40.359 41.359 -1.000 1
1 916 . 3 1 1 A 91 91 LEU N N 91 123.959 121.216 2.743 1
1 917 . 3 1 1 A 92 92 GLU H H 92 8.324 8.627 -0.303 1
1 918 . 3 1 1 A 92 92 GLU HA H 92 3.732 3.815 -0.083 1
1 922 . 3 1 1 A 92 92 GLU C C 92 177.272 178.269 -0.997 1
1 923 . 3 1 1 A 92 92 GLU CA C 92 60.651 59.612 1.039 1
1 924 . 3 1 1 A 92 92 GLU CB C 92 30.843 28.962 1.881 1
1 926 . 3 1 1 A 92 92 GLU N N 92 121.991 120.986 1.005 1
1 927 . 3 1 1 A 93 93 ALA H H 93 8.126 7.791 0.335 1
1 928 . 3 1 1 A 93 93 ALA HA H 93 4.160 4.068 0.092 1
1 932 . 3 1 1 A 93 93 ALA C C 93 180.818 179.314 1.504 1
1 933 . 3 1 1 A 93 93 ALA CA C 93 54.828 54.781 0.047 1
1 934 . 3 1 1 A 93 93 ALA CB C 93 18.032 17.990 0.042 1
1 935 . 3 1 1 A 93 93 ALA N N 93 120.066 122.202 -2.136 1
1 936 . 3 1 1 A 94 94 TYR H H 94 7.916 7.341 0.575 1
1 937 . 3 1 1 A 94 94 TYR HA H 94 4.139 4.395 -0.256 1
1 942 . 3 1 1 A 94 94 TYR C C 94 175.895 178.430 -2.535 1
1 943 . 3 1 1 A 94 94 TYR CA C 94 61.915 61.442 0.473 1
1 944 . 3 1 1 A 94 94 TYR CB C 94 38.740 38.519 0.221 1
1 945 . 3 1 1 A 94 94 TYR N N 94 121.179 115.782 5.397 1
1 946 . 3 1 1 A 95 95 ILE H H 95 7.983 8.801 -0.818 1
1 947 . 3 1 1 A 95 95 ILE HA H 95 3.614 3.886 -0.272 1
1 957 . 3 1 1 A 95 95 ILE C C 95 174.678 178.267 -3.589 1
1 958 . 3 1 1 A 95 95 ILE CA C 95 63.461 65.574 -2.113 1
1 959 . 3 1 1 A 95 95 ILE CB C 95 36.625 37.701 -1.076 1
1 963 . 3 1 1 A 95 95 ILE N N 95 116.397 120.053 -3.656 1
1 964 . 3 1 1 A 96 96 GLN H H 96 8.175 8.733 -0.558 1
1 965 . 3 1 1 A 96 96 GLN HA H 96 3.763 3.995 -0.232 1
1 970 . 3 1 1 A 96 96 GLN C C 96 179.042 178.607 0.435 1
1 971 . 3 1 1 A 96 96 GLN CA C 96 59.270 60.002 -0.732 1
1 972 . 3 1 1 A 96 96 GLN CB C 96 27.696 27.909 -0.213 1
1 974 . 3 1 1 A 96 96 GLN N N 96 116.631 120.308 -3.677 1
1 976 . 3 1 1 A 97 97 GLY H H 97 8.222 8.110 0.112 1
1 977 . 3 1 1 A 97 97 GLY HA2 H 97 3.661 3.788 -0.127 1
1 978 . 3 1 1 A 97 97 GLY HA3 H 97 3.806 3.796 0.010 1
1 979 . 3 1 1 A 97 97 GLY C C 97 175.449 176.160 -0.711 1
1 980 . 3 1 1 A 97 97 GLY CA C 97 46.917 47.386 -0.469 1
1 981 . 3 1 1 A 97 97 GLY N N 97 107.315 107.118 0.197 1
1 982 . 3 1 1 A 98 98 ILE H H 98 7.630 8.981 -1.351 1
1 983 . 3 1 1 A 98 98 ILE HA H 98 3.399 3.911 -0.512 1
1 993 . 3 1 1 A 98 98 ILE C C 98 178.683 178.688 -0.005 1
1 994 . 3 1 1 A 98 98 ILE CA C 98 66.402 64.595 1.807 1
1 995 . 3 1 1 A 98 98 ILE CB C 98 38.037 38.033 0.004 1
1 999 . 3 1 1 A 98 98 ILE N N 98 120.644 122.563 -1.919 1
1 1000 . 3 1 1 A 99 99 LEU H H 99 7.076 8.345 -1.269 1
1 1001 . 3 1 1 A 99 99 LEU HA H 99 4.133 4.140 -0.007 1
1 1010 . 3 1 1 A 99 99 LEU C C 99 178.128 178.123 0.005 1
1 1011 . 3 1 1 A 99 99 LEU CA C 99 57.129 57.951 -0.822 1
1 1012 . 3 1 1 A 99 99 LEU CB C 99 41.108 41.876 -0.768 1
1 1014 . 3 1 1 A 99 99 LEU N N 99 116.844 121.121 -4.277 1
1 1015 . 3 1 1 A 100 100 TYR H H 100 7.890 8.343 -0.453 1
1 1016 . 3 1 1 A 100 100 TYR HA H 100 4.550 4.161 0.389 1
1 1021 . 3 1 1 A 100 100 TYR C C 100 178.210 177.431 0.779 1
1 1022 . 3 1 1 A 100 100 TYR CA C 100 59.452 59.952 -0.500 1
1 1023 . 3 1 1 A 100 100 TYR CB C 100 38.786 39.826 -1.040 1
1 1024 . 3 1 1 A 100 100 TYR N N 100 116.427 120.288 -3.861 1
1 1025 . 3 1 1 A 101 101 LEU H H 101 8.041 8.133 -0.092 1
1 1026 . 3 1 1 A 101 101 LEU HA H 101 4.158 3.949 0.209 1
1 1036 . 3 1 1 A 101 101 LEU C C 101 176.808 178.099 -1.291 1
1 1037 . 3 1 1 A 101 101 LEU CA C 101 56.156 58.262 -2.106 1
1 1038 . 3 1 1 A 101 101 LEU CB C 101 44.307 41.809 2.498 1
1 1041 . 3 1 1 A 101 101 LEU N N 101 116.493 120.490 -3.997 1
1 1042 . 3 1 1 A 102 102 ASN H H 102 7.146 8.203 -1.057 1
1 1043 . 3 1 1 A 102 102 ASN HA H 102 5.056 5.119 -0.063 1
1 1046 . 3 1 1 A 102 102 ASN CA C 102 52.704 54.822 -2.118 1
1 1047 . 3 1 1 A 102 102 ASN CB C 102 42.424 41.288 1.136 1
1 1048 . 3 1 1 A 102 102 ASN N N 102 114.922 115.129 -0.207 1
1 1049 . 3 1 1 A 103 103 GLN H H 103 8.477 7.835 0.642 1
1 1050 . 3 1 1 A 103 103 GLN HA H 103 3.866 4.367 -0.501 1
1 1054 . 3 1 1 A 103 103 GLN C C 103 176.110 175.484 0.626 1
1 1055 . 3 1 1 A 103 103 GLN CA C 103 58.451 55.606 2.845 1
1 1056 . 3 1 1 A 103 103 GLN CB C 103 28.896 29.197 -0.301 1
1 1058 . 3 1 1 A 103 103 GLN N N 103 120.252 115.473 4.779 1
1 1059 . 3 1 1 A 104 104 GLU H H 104 7.930 7.836 0.094 1
1 1060 . 3 1 1 A 104 104 GLU HA H 104 4.591 4.600 -0.009 1
1 1064 . 3 1 1 A 104 104 GLU C C 104 175.397 176.599 -1.202 1
1 1065 . 3 1 1 A 104 104 GLU CA C 104 54.058 57.447 -3.389 1
1 1066 . 3 1 1 A 104 104 GLU CB C 104 31.272 28.128 3.144 1
1 1068 . 3 1 1 A 104 104 GLU N N 104 117.295 116.791 0.504 1
1 1069 . 3 1 1 A 105 105 VAL H H 105 8.546 8.508 0.038 1
1 1070 . 3 1 1 A 105 105 VAL HA H 105 3.823 3.823 0.000 1
1 1078 . 3 1 1 A 105 105 VAL CA C 105 60.706 63.232 -2.526 1
1 1079 . 3 1 1 A 105 105 VAL CB C 105 32.126 30.314 1.812 1
1 1082 . 3 1 1 A 105 105 VAL N N 105 124.511 120.587 3.924 1
1 1083 . 3 1 1 A 106 106 PRO HA H 106 3.997 4.429 -0.432 1
1 1089 . 3 1 1 A 106 106 PRO C C 106 178.240 177.465 0.775 1
1 1090 . 3 1 1 A 106 106 PRO CA C 106 62.961 62.520 0.441 1
1 1091 . 3 1 1 A 106 106 PRO CB C 106 32.321 32.251 0.070 1
1 1094 . 3 1 1 A 107 107 LYS H H 107 9.122 8.998 0.124 1
1 1095 . 3 1 1 A 107 107 LYS HA H 107 3.813 4.063 -0.250 1
1 1101 . 3 1 1 A 107 107 LYS C C 107 178.563 177.844 0.719 1
1 1102 . 3 1 1 A 107 107 LYS CA C 107 60.085 59.421 0.664 1
1 1103 . 3 1 1 A 107 107 LYS CB C 107 31.632 32.482 -0.850 1
1 1106 . 3 1 1 A 107 107 LYS N N 107 129.017 123.507 5.510 1
1 1107 . 3 1 1 A 108 108 GLU H H 108 10.370 8.001 2.369 1
1 1108 . 3 1 1 A 108 108 GLU HA H 108 3.991 4.134 -0.143 1
1 1111 . 3 1 1 A 108 108 GLU C C 108 180.366 179.392 0.974 1
1 1112 . 3 1 1 A 108 108 GLU CA C 108 60.337 59.092 1.245 1
1 1113 . 3 1 1 A 108 108 GLU CB C 108 29.178 29.552 -0.374 1
1 1115 . 3 1 1 A 108 108 GLU N N 108 118.335 118.969 -0.634 1
1 1116 . 3 1 1 A 109 109 LEU H H 109 7.393 8.226 -0.833 1
1 1117 . 3 1 1 A 109 109 LEU HA H 109 4.220 4.136 0.084 1
1 1126 . 3 1 1 A 109 109 LEU C C 109 177.378 179.258 -1.880 1
1 1127 . 3 1 1 A 109 109 LEU CA C 109 56.618 58.217 -1.599 1
1 1128 . 3 1 1 A 109 109 LEU CB C 109 41.898 41.146 0.752 1
1 1131 . 3 1 1 A 109 109 LEU N N 109 118.285 120.037 -1.752 1
1 1132 . 3 1 1 A 110 110 LEU H H 110 7.641 7.689 -0.048 1
1 1133 . 3 1 1 A 110 110 LEU HA H 110 3.796 3.982 -0.186 1
1 1142 . 3 1 1 A 110 110 LEU C C 110 179.103 178.208 0.895 1
1 1143 . 3 1 1 A 110 110 LEU CA C 110 59.046 58.465 0.581 1
1 1144 . 3 1 1 A 110 110 LEU CB C 110 40.228 41.525 -1.297 1
1 1147 . 3 1 1 A 110 110 LEU N N 110 120.162 120.311 -0.149 1
1 1148 . 3 1 1 A 111 111 GLU H H 111 7.916 8.253 -0.337 1
1 1149 . 3 1 1 A 111 111 GLU HA H 111 4.080 4.068 0.012 1
1 1153 . 3 1 1 A 111 111 GLU C C 111 179.967 178.947 1.020 1
1 1154 . 3 1 1 A 111 111 GLU CA C 111 59.243 59.013 0.230 1
1 1155 . 3 1 1 A 111 111 GLU CB C 111 29.576 29.082 0.494 1
1 1157 . 3 1 1 A 111 111 GLU N N 111 117.360 118.494 -1.134 1
1 1158 . 3 1 1 A 112 112 PHE H H 112 7.712 8.398 -0.686 1
1 1159 . 3 1 1 A 112 112 PHE HA H 112 4.224 4.172 0.052 1
1 1164 . 3 1 1 A 112 112 PHE C C 112 177.180 176.758 0.422 1
1 1165 . 3 1 1 A 112 112 PHE CA C 112 61.407 61.032 0.375 1
1 1166 . 3 1 1 A 112 112 PHE CB C 112 40.172 39.453 0.719 1
1 1167 . 3 1 1 A 112 112 PHE N N 112 123.042 120.500 2.542 1
1 1168 . 3 1 1 A 113 113 LEU H H 113 8.056 7.869 0.187 1
1 1169 . 3 1 1 A 113 113 LEU HA H 113 4.147 4.337 -0.190 1
1 1175 . 3 1 1 A 113 113 LEU C C 113 173.717 176.096 -2.379 1
1 1176 . 3 1 1 A 113 113 LEU CA C 113 54.093 54.449 -0.356 1
1 1177 . 3 1 1 A 113 113 LEU CB C 113 41.517 42.581 -1.064 1
1 1179 . 3 1 1 A 113 113 LEU N N 113 115.595 116.734 -1.139 1
1 1180 . 3 1 1 A 114 114 ARG H H 114 7.902 7.917 -0.015 1
1 1181 . 3 1 1 A 114 114 ARG HA H 114 3.817 4.401 -0.584 1
1 1182 . 3 1 1 A 114 114 ARG C C 114 174.566 176.198 -1.632 1
1 1183 . 3 1 1 A 114 114 ARG CA C 114 57.233 57.006 0.227 1
1 1184 . 3 1 1 A 114 114 ARG CB C 114 27.788 27.220 0.568 1
1 1185 . 3 1 1 A 114 114 ARG N N 114 116.021 115.624 0.397 1
1 1186 . 3 1 1 A 115 115 LEU H H 115 8.160 8.295 -0.135 1
1 1187 . 3 1 1 A 115 115 LEU HA H 115 4.462 4.378 0.084 1
1 1195 . 3 1 1 A 115 115 LEU C C 115 176.374 176.313 0.061 1
1 1196 . 3 1 1 A 115 115 LEU CA C 115 53.965 54.219 -0.254 1
1 1197 . 3 1 1 A 115 115 LEU CB C 115 44.077 40.914 3.163 1
1 1199 . 3 1 1 A 115 115 LEU N N 115 118.089 118.327 -0.238 1
1 1200 . 3 1 1 A 116 116 ARG H H 116 8.066 7.652 0.414 1
1 1201 . 3 1 1 A 116 116 ARG HA H 116 4.172 4.035 0.137 1
1 1203 . 3 1 1 A 116 116 ARG CA C 116 55.961 58.125 -2.164 1
1 1204 . 3 1 1 A 116 116 ARG CB C 116 31.379 29.971 1.408 1
1 1205 . 3 1 1 A 116 116 ARG N N 116 120.852 122.187 -1.335 1
1 1206 . 3 1 1 A 117 117 HIS H H 117 7.928 9.050 -1.122 1
1 1207 . 3 1 1 A 117 117 HIS HA H 117 4.557 4.207 0.350 1
1 1211 . 3 1 1 A 117 117 HIS CA C 117 55.937 56.852 -0.915 1
1 1212 . 3 1 1 A 117 117 HIS CB C 117 30.875 28.193 2.682 1
1 1213 . 3 1 1 A 118 118 PHE H H 118 8.183 7.939 0.244 1
1 1214 . 3 1 1 A 118 118 PHE HA H 118 4.730 4.859 -0.129 1
1 1219 . 3 1 1 A 118 118 PHE CA C 118 55.716 54.508 1.208 1
1 1220 . 3 1 1 A 118 118 PHE CB C 118 39.263 39.176 0.087 1
1 1221 . 3 1 1 A 118 118 PHE N N 118 123.480 117.044 6.436 1
1 1222 . 3 1 1 A 119 119 PRO HA H 119 4.398 4.330 0.068 1
1 1227 . 3 1 1 A 119 119 PRO C C 119 176.666 176.908 -0.242 1
1 1228 . 3 1 1 A 119 119 PRO CA C 119 63.377 63.690 -0.313 1
1 1229 . 3 1 1 A 119 119 PRO CB C 119 32.059 31.935 0.124 1
1 1232 . 3 1 1 A 120 120 THR H H 120 8.054 8.080 -0.026 1
1 1233 . 3 1 1 A 120 120 THR HA H 120 4.273 4.265 0.008 1
1 1238 . 3 1 1 A 120 120 THR C C 120 174.154 173.557 0.597 1
1 1239 . 3 1 1 A 120 120 THR CA C 120 61.893 62.525 -0.632 1
1 1240 . 3 1 1 A 120 120 THR CB C 120 69.736 68.011 1.725 1
1 1242 . 3 1 1 A 120 120 THR N N 120 113.088 110.692 2.396 1
1 1243 . 3 1 1 A 121 121 ASP H H 121 8.209 8.851 -0.642 1
1 1244 . 3 1 1 A 121 121 ASP HA H 121 4.876 5.125 -0.249 1
1 1247 . 3 1 1 A 121 121 ASP CA C 121 52.126 51.178 0.948 1
1 1248 . 3 1 1 A 121 121 ASP CB C 121 41.553 41.074 0.479 1
1 1249 . 3 1 1 A 121 121 ASP N N 121 123.630 126.508 -2.878 1
1 1250 . 3 1 1 A 122 122 PRO HA H 122 4.363 4.647 -0.284 1
1 1255 . 3 1 1 A 122 122 PRO C C 122 177.344 177.363 -0.019 1
1 1256 . 3 1 1 A 122 122 PRO CA C 122 63.913 62.602 1.311 1
1 1257 . 3 1 1 A 122 122 PRO CB C 122 32.116 31.629 0.487 1
1 1260 . 3 1 1 A 123 123 LYS H H 123 8.344 8.848 -0.504 1
1 1261 . 3 1 1 A 123 123 LYS HA H 123 4.244 4.101 0.143 1
1 1266 . 3 1 1 A 123 123 LYS C C 123 176.637 177.031 -0.394 1
1 1267 . 3 1 1 A 123 123 LYS CA C 123 56.359 59.546 -3.187 1
1 1268 . 3 1 1 A 123 123 LYS CB C 123 32.367 32.979 -0.612 1
1 1272 . 3 1 1 A 123 123 LYS N N 123 119.110 124.685 -5.575 1
1 1273 . 3 1 1 A 124 124 ALA H H 124 7.929 7.541 0.388 1
1 1274 . 3 1 1 A 124 124 ALA HA H 124 4.248 4.464 -0.216 1
1 1278 . 3 1 1 A 124 124 ALA C C 124 177.648 176.130 1.518 1
1 1279 . 3 1 1 A 124 124 ALA CA C 124 52.618 51.298 1.320 1
1 1280 . 3 1 1 A 124 124 ALA CB C 124 19.379 18.094 1.285 1
1 1281 . 3 1 1 A 124 124 ALA N N 124 123.825 120.454 3.371 1
1 1282 . 3 1 1 A 125 125 SER H H 125 8.134 8.299 -0.165 1
1 1283 . 3 1 1 A 125 125 SER HA H 125 4.341 5.402 -1.061 1
1 1286 . 3 1 1 A 125 125 SER C C 125 174.172 173.126 1.046 1
1 1287 . 3 1 1 A 125 125 SER CA C 125 58.391 56.658 1.733 1
1 1288 . 3 1 1 A 125 125 SER CB C 125 63.748 64.371 -0.623 1
1 1289 . 3 1 1 A 125 125 SER N N 125 114.454 116.843 -2.389 1
1 1290 . 3 1 1 A 126 126 ASN H H 126 8.242 8.497 -0.255 1
1 1291 . 3 1 1 A 126 126 ASN HA H 126 4.657 5.279 -0.622 1
1 1294 . 3 1 1 A 126 126 ASN C C 126 174.624 173.342 1.282 1
1 1295 . 3 1 1 A 126 126 ASN CA C 126 53.292 52.682 0.610 1
1 1296 . 3 1 1 A 126 126 ASN CB C 126 38.797 41.294 -2.497 1
1 1297 . 3 1 1 A 126 126 ASN N N 126 120.102 123.944 -3.842 1
1 1298 . 3 1 1 A 127 127 TRP H H 127 8.051 9.048 -0.997 1
1 1299 . 3 1 1 A 127 127 TRP HA H 127 4.694 5.594 -0.900 1
1 1302 . 3 1 1 A 127 127 TRP C C 127 175.479 175.234 0.245 1
1 1303 . 3 1 1 A 127 127 TRP CA C 127 57.096 54.838 2.258 1
1 1304 . 3 1 1 A 127 127 TRP CB C 127 29.820 31.780 -1.960 1
1 1305 . 3 1 1 A 127 127 TRP N N 127 121.198 128.725 -7.527 1
1 1 . 4 1 1 A 7 7 HIS HA H 7 4.623 5.446 -0.823 1
1 4 . 4 1 1 A 7 7 HIS C C 7 174.747 174.991 -0.244 1
1 5 . 4 1 1 A 7 7 HIS CA C 7 56.189 53.600 2.589 1
1 6 . 4 1 1 A 7 7 HIS CB C 7 30.028 32.804 -2.776 1
1 7 . 4 1 1 A 8 8 LEU H H 8 8.283 8.539 -0.256 1
1 8 . 4 1 1 A 8 8 LEU HA H 8 4.249 4.323 -0.074 1
1 10 . 4 1 1 A 8 8 LEU C C 8 176.700 177.487 -0.787 1
1 11 . 4 1 1 A 8 8 LEU CA C 8 55.498 54.623 0.875 1
1 12 . 4 1 1 A 8 8 LEU CB C 8 42.568 42.032 0.536 1
1 13 . 4 1 1 A 8 8 LEU N N 8 122.916 122.516 0.400 1
1 14 . 4 1 1 A 9 9 GLU H H 9 8.623 7.722 0.901 1
1 15 . 4 1 1 A 9 9 GLU HA H 9 4.311 4.477 -0.166 1
1 16 . 4 1 1 A 9 9 GLU C C 9 174.811 175.495 -0.684 1
1 17 . 4 1 1 A 9 9 GLU CA C 9 56.377 55.767 0.610 1
1 18 . 4 1 1 A 9 9 GLU CB C 9 29.557 28.959 0.598 1
1 20 . 4 1 1 A 9 9 GLU N N 9 121.512 120.229 1.283 1
1 21 . 4 1 1 A 10 10 LEU H H 10 7.853 7.842 0.011 1
1 22 . 4 1 1 A 10 10 LEU HA H 10 5.225 4.854 0.371 1
1 31 . 4 1 1 A 10 10 LEU C C 10 174.637 174.390 0.247 1
1 32 . 4 1 1 A 10 10 LEU CA C 10 54.513 54.544 -0.031 1
1 33 . 4 1 1 A 10 10 LEU CB C 10 45.187 45.329 -0.142 1
1 36 . 4 1 1 A 10 10 LEU N N 10 123.592 125.799 -2.207 1
1 37 . 4 1 1 A 11 11 GLU H H 11 8.894 8.733 0.161 1
1 38 . 4 1 1 A 11 11 GLU HA H 11 4.765 5.175 -0.410 1
1 43 . 4 1 1 A 11 11 GLU C C 11 174.563 175.041 -0.478 1
1 44 . 4 1 1 A 11 11 GLU CA C 11 55.047 54.676 0.371 1
1 45 . 4 1 1 A 11 11 GLU CB C 11 33.760 34.427 -0.667 1
1 47 . 4 1 1 A 11 11 GLU N N 11 124.055 124.791 -0.736 1
1 48 . 4 1 1 A 12 12 VAL H H 12 8.607 8.572 0.035 1
1 49 . 4 1 1 A 12 12 VAL HA H 12 5.174 5.637 -0.463 1
1 57 . 4 1 1 A 12 12 VAL C C 12 173.573 174.800 -1.227 1
1 58 . 4 1 1 A 12 12 VAL CA C 12 60.296 61.260 -0.964 1
1 59 . 4 1 1 A 12 12 VAL CB C 12 35.689 34.731 0.958 1
1 62 . 4 1 1 A 12 12 VAL N N 12 120.878 121.916 -1.038 1
1 63 . 4 1 1 A 13 13 HIS H H 13 8.982 8.468 0.514 1
1 64 . 4 1 1 A 13 13 HIS HA H 13 4.824 5.157 -0.333 1
1 69 . 4 1 1 A 13 13 HIS C C 13 173.236 171.747 1.489 1
1 70 . 4 1 1 A 13 13 HIS CA C 13 54.906 54.180 0.726 1
1 71 . 4 1 1 A 13 13 HIS CB C 13 33.496 32.200 1.296 1
1 72 . 4 1 1 A 13 13 HIS N N 13 121.504 121.702 -0.198 1
1 73 . 4 1 1 A 14 14 ILE H H 14 10.442 8.904 1.538 1
1 74 . 4 1 1 A 14 14 ILE HA H 14 5.458 4.955 0.503 1
1 84 . 4 1 1 A 14 14 ILE CA C 14 58.386 57.976 0.410 1
1 85 . 4 1 1 A 14 14 ILE CB C 14 38.596 38.089 0.507 1
1 88 . 4 1 1 A 14 14 ILE N N 14 119.923 120.839 -0.916 1
1 89 . 4 1 1 A 15 15 PRO HA H 15 4.560 4.584 -0.024 1
1 95 . 4 1 1 A 15 15 PRO C C 15 176.907 176.482 0.425 1
1 96 . 4 1 1 A 15 15 PRO CA C 15 64.342 64.530 -0.188 1
1 97 . 4 1 1 A 15 15 PRO CB C 15 32.924 32.402 0.522 1
1 100 . 4 1 1 A 16 16 SER H H 16 7.331 7.858 -0.527 1
1 101 . 4 1 1 A 16 16 SER HA H 16 4.822 5.140 -0.318 1
1 104 . 4 1 1 A 16 16 SER C C 16 171.253 172.513 -1.260 1
1 105 . 4 1 1 A 16 16 SER CA C 16 57.135 57.942 -0.807 1
1 106 . 4 1 1 A 16 16 SER CB C 16 65.947 67.227 -1.280 1
1 107 . 4 1 1 A 16 16 SER N N 16 107.745 114.125 -6.380 1
1 108 . 4 1 1 A 17 17 VAL H H 17 8.350 8.602 -0.252 1
1 109 . 4 1 1 A 17 17 VAL HA H 17 4.926 5.043 -0.117 1
1 117 . 4 1 1 A 17 17 VAL C C 17 173.692 174.946 -1.254 1
1 118 . 4 1 1 A 17 17 VAL CA C 17 58.721 60.764 -2.043 1
1 119 . 4 1 1 A 17 17 VAL CB C 17 34.420 34.755 -0.335 1
1 122 . 4 1 1 A 17 17 VAL N N 17 118.680 123.299 -4.619 1
1 123 . 4 1 1 A 18 18 GLY H H 18 8.332 8.935 -0.603 1
1 124 . 4 1 1 A 18 18 GLY HA2 H 18 4.189 4.409 -0.220 1
1 125 . 4 1 1 A 18 18 GLY HA3 H 18 4.011 4.411 -0.400 1
1 126 . 4 1 1 A 18 18 GLY CA C 18 45.356 44.675 0.681 1
1 127 . 4 1 1 A 18 18 GLY N N 18 112.549 114.305 -1.756 1
1 128 . 4 1 1 A 19 19 PRO HA H 19 4.757 4.731 0.026 1
1 134 . 4 1 1 A 19 19 PRO C C 19 177.482 176.768 0.714 1
1 135 . 4 1 1 A 19 19 PRO CA C 19 62.848 63.130 -0.282 1
1 136 . 4 1 1 A 19 19 PRO CB C 19 32.283 30.247 2.036 1
1 139 . 4 1 1 A 20 20 GLU H H 20 8.588 8.703 -0.115 1
1 140 . 4 1 1 A 20 20 GLU HA H 20 4.147 4.331 -0.184 1
1 144 . 4 1 1 A 20 20 GLU C C 20 175.857 175.881 -0.024 1
1 145 . 4 1 1 A 20 20 GLU CA C 20 57.150 56.940 0.210 1
1 146 . 4 1 1 A 20 20 GLU CB C 20 30.923 30.011 0.912 1
1 148 . 4 1 1 A 20 20 GLU N N 20 122.087 118.065 4.022 1
1 149 . 4 1 1 A 21 21 ALA H H 21 8.352 7.753 0.599 1
1 150 . 4 1 1 A 21 21 ALA HA H 21 4.391 4.637 -0.246 1
1 154 . 4 1 1 A 21 21 ALA C C 21 174.910 175.828 -0.918 1
1 155 . 4 1 1 A 21 21 ALA CA C 21 52.166 50.554 1.612 1
1 156 . 4 1 1 A 21 21 ALA CB C 21 19.915 19.698 0.217 1
1 157 . 4 1 1 A 21 21 ALA N N 21 124.593 122.547 2.046 1
1 158 . 4 1 1 A 22 22 GLU H H 22 8.398 8.763 -0.365 1
1 159 . 4 1 1 A 22 22 GLU HA H 22 4.331 4.313 0.018 1
1 163 . 4 1 1 A 22 22 GLU C C 22 176.389 177.247 -0.858 1
1 164 . 4 1 1 A 22 22 GLU CA C 22 56.316 57.686 -1.370 1
1 165 . 4 1 1 A 22 22 GLU CB C 22 30.713 30.105 0.608 1
1 167 . 4 1 1 A 22 22 GLU N N 22 120.159 124.888 -4.729 1
1 168 . 4 1 1 A 23 23 GLY H H 23 8.246 8.845 -0.599 1
1 169 . 4 1 1 A 23 23 GLY HA2 H 23 4.162 4.076 0.086 1
1 170 . 4 1 1 A 23 23 GLY HA3 H 23 4.061 4.085 -0.024 1
1 171 . 4 1 1 A 23 23 GLY CA C 23 44.801 46.228 -1.427 1
1 172 . 4 1 1 A 23 23 GLY N N 23 110.080 114.508 -4.428 1
1 173 . 4 1 1 A 24 24 PRO HA H 24 4.417 4.662 -0.245 1
1 178 . 4 1 1 A 24 24 PRO C C 24 177.135 176.621 0.514 1
1 179 . 4 1 1 A 24 24 PRO CA C 24 63.520 62.300 1.220 1
1 180 . 4 1 1 A 24 24 PRO CB C 24 32.124 33.007 -0.883 1
1 183 . 4 1 1 A 25 25 ARG H H 25 8.409 8.396 0.013 1
1 184 . 4 1 1 A 25 25 ARG HA H 25 4.298 4.349 -0.051 1
1 187 . 4 1 1 A 25 25 ARG C C 25 176.217 175.939 0.278 1
1 188 . 4 1 1 A 25 25 ARG CA C 25 56.237 55.729 0.508 1
1 189 . 4 1 1 A 25 25 ARG CB C 25 30.467 30.928 -0.461 1
1 192 . 4 1 1 A 25 25 ARG N N 25 120.147 118.700 1.447 1
1 193 . 4 1 1 A 26 26 GLN H H 26 8.278 8.357 -0.079 1
1 194 . 4 1 1 A 26 26 GLN HA H 26 4.336 4.504 -0.168 1
1 200 . 4 1 1 A 26 26 GLN C C 26 175.566 174.837 0.729 1
1 201 . 4 1 1 A 26 26 GLN CA C 26 55.788 56.214 -0.426 1
1 202 . 4 1 1 A 26 26 GLN CB C 26 29.714 28.948 0.766 1
1 204 . 4 1 1 A 26 26 GLN N N 26 120.460 121.323 -0.863 1
1 206 . 4 1 1 A 27 27 SER H H 27 8.298 8.524 -0.226 1
1 208 . 4 1 1 A 27 27 SER CA C 27 56.156 55.352 0.804 1
1 209 . 4 1 1 A 27 27 SER CB C 27 63.813 65.053 -1.240 1
1 210 . 4 1 1 A 27 27 SER N N 27 117.382 124.568 -7.186 1
1 211 . 4 1 1 A 28 28 PRO HA H 28 4.366 4.578 -0.212 1
1 216 . 4 1 1 A 28 28 PRO C C 28 177.555 177.177 0.378 1
1 217 . 4 1 1 A 28 28 PRO CA C 28 64.486 64.126 0.360 1
1 218 . 4 1 1 A 28 28 PRO CB C 28 31.892 31.753 0.139 1
1 221 . 4 1 1 A 29 29 GLU H H 29 8.582 7.704 0.878 1
1 222 . 4 1 1 A 29 29 GLU HA H 29 4.218 4.582 -0.364 1
1 226 . 4 1 1 A 29 29 GLU CA C 29 57.261 56.159 1.102 1
1 227 . 4 1 1 A 29 29 GLU CB C 29 29.633 31.871 -2.238 1
1 229 . 4 1 1 A 29 29 GLU N N 29 118.309 115.104 3.205 1
1 230 . 4 1 1 A 30 30 LYS H H 30 7.955 7.909 0.046 1
1 231 . 4 1 1 A 30 30 LYS HA H 30 4.328 4.232 0.096 1
1 236 . 4 1 1 A 30 30 LYS C C 30 176.222 175.113 1.109 1
1 237 . 4 1 1 A 30 30 LYS CA C 30 56.247 56.876 -0.629 1
1 238 . 4 1 1 A 30 30 LYS CB C 30 32.720 31.413 1.307 1
1 242 . 4 1 1 A 30 30 LYS N N 30 120.129 116.475 3.654 1
1 243 . 4 1 1 A 31 31 SER H H 31 7.883 8.953 -1.070 1
1 244 . 4 1 1 A 31 31 SER HA H 31 4.458 4.892 -0.434 1
1 246 . 4 1 1 A 31 31 SER C C 31 174.129 174.090 0.039 1
1 247 . 4 1 1 A 31 31 SER CA C 31 58.477 57.466 1.011 1
1 248 . 4 1 1 A 31 31 SER CB C 31 64.042 65.379 -1.337 1
1 249 . 4 1 1 A 31 31 SER N N 31 115.366 120.240 -4.874 1
1 250 . 4 1 1 A 32 32 HIS H H 32 8.485 8.165 0.320 1
1 251 . 4 1 1 A 32 32 HIS HA H 32 4.450 4.852 -0.402 1
1 255 . 4 1 1 A 32 32 HIS CA C 32 56.009 56.352 -0.343 1
1 256 . 4 1 1 A 32 32 HIS CB C 32 31.122 30.053 1.069 1
1 257 . 4 1 1 A 32 32 HIS N N 32 121.500 122.127 -0.627 1
1 258 . 4 1 1 A 33 33 MET H H 33 8.392 7.408 0.984 1
1 259 . 4 1 1 A 33 33 MET HA H 33 4.601 5.030 -0.429 1
1 265 . 4 1 1 A 33 33 MET C C 33 175.842 175.159 0.683 1
1 266 . 4 1 1 A 33 33 MET CA C 33 54.533 54.413 0.120 1
1 267 . 4 1 1 A 33 33 MET CB C 33 32.868 34.587 -1.719 1
1 270 . 4 1 1 A 33 33 MET N N 33 120.204 120.652 -0.448 1
1 271 . 4 1 1 A 34 34 VAL H H 34 8.938 9.225 -0.287 1
1 272 . 4 1 1 A 34 34 VAL HA H 34 4.430 4.684 -0.254 1
1 280 . 4 1 1 A 34 34 VAL C C 34 174.149 174.059 0.090 1
1 281 . 4 1 1 A 34 34 VAL CA C 34 60.703 59.616 1.087 1
1 282 . 4 1 1 A 34 34 VAL CB C 34 34.319 35.606 -1.287 1
1 285 . 4 1 1 A 34 34 VAL N N 34 118.512 125.644 -7.132 1
1 286 . 4 1 1 A 35 35 PHE H H 35 9.242 8.038 1.204 1
1 287 . 4 1 1 A 35 35 PHE HA H 35 4.439 5.638 -1.199 1
1 294 . 4 1 1 A 35 35 PHE C C 35 174.831 174.335 0.496 1
1 295 . 4 1 1 A 35 35 PHE CA C 35 57.754 54.851 2.903 1
1 296 . 4 1 1 A 35 35 PHE CB C 35 38.959 42.541 -3.582 1
1 297 . 4 1 1 A 35 35 PHE N N 35 124.912 124.478 0.434 1
1 298 . 4 1 1 A 36 36 ARG H H 36 8.475 8.730 -0.255 1
1 299 . 4 1 1 A 36 36 ARG HA H 36 4.135 5.077 -0.942 1
1 304 . 4 1 1 A 36 36 ARG C C 36 172.865 175.480 -2.615 1
1 305 . 4 1 1 A 36 36 ARG CA C 36 56.895 55.208 1.687 1
1 306 . 4 1 1 A 36 36 ARG CB C 36 28.962 31.913 -2.951 1
1 308 . 4 1 1 A 36 36 ARG N N 36 125.680 120.296 5.384 1
1 309 . 4 1 1 A 37 37 VAL H H 37 8.066 9.283 -1.217 1
1 310 . 4 1 1 A 37 37 VAL HA H 37 4.292 4.819 -0.527 1
1 318 . 4 1 1 A 37 37 VAL C C 37 174.595 175.270 -0.675 1
1 319 . 4 1 1 A 37 37 VAL CA C 37 62.727 61.460 1.267 1
1 320 . 4 1 1 A 37 37 VAL CB C 37 31.102 33.190 -2.088 1
1 323 . 4 1 1 A 37 37 VAL N N 37 125.403 120.810 4.593 1
1 324 . 4 1 1 A 38 38 GLU H H 38 9.532 9.360 0.172 1
1 325 . 4 1 1 A 38 38 GLU HA H 38 4.895 5.487 -0.592 1
1 329 . 4 1 1 A 38 38 GLU C C 38 174.509 175.170 -0.661 1
1 330 . 4 1 1 A 38 38 GLU CA C 38 55.650 55.905 -0.255 1
1 331 . 4 1 1 A 38 38 GLU CB C 38 32.214 30.138 2.076 1
1 333 . 4 1 1 A 38 38 GLU N N 38 129.885 125.714 4.171 1
1 334 . 4 1 1 A 39 39 VAL H H 39 9.035 8.482 0.553 1
1 335 . 4 1 1 A 39 39 VAL HA H 39 4.446 4.398 0.048 1
1 343 . 4 1 1 A 39 39 VAL C C 39 173.661 174.261 -0.600 1
1 344 . 4 1 1 A 39 39 VAL CA C 39 61.258 62.138 -0.880 1
1 345 . 4 1 1 A 39 39 VAL CB C 39 33.533 31.640 1.893 1
1 348 . 4 1 1 A 39 39 VAL N N 39 127.941 126.537 1.404 1
1 349 . 4 1 1 A 40 40 LEU H H 40 8.843 9.427 -0.584 1
1 350 . 4 1 1 A 40 40 LEU HA H 40 5.130 5.217 -0.087 1
1 360 . 4 1 1 A 40 40 LEU C C 40 175.581 174.995 0.586 1
1 361 . 4 1 1 A 40 40 LEU CA C 40 53.702 53.716 -0.014 1
1 362 . 4 1 1 A 40 40 LEU CB C 40 43.989 44.056 -0.067 1
1 366 . 4 1 1 A 40 40 LEU N N 40 128.413 129.643 -1.230 1
1 367 . 4 1 1 A 41 41 CYS H H 41 8.959 8.765 0.194 1
1 368 . 4 1 1 A 41 41 CYS HA H 41 5.174 4.750 0.424 1
1 371 . 4 1 1 A 41 41 CYS C C 41 175.043 173.967 1.076 1
1 372 . 4 1 1 A 41 41 CYS CA C 41 57.483 57.732 -0.249 1
1 373 . 4 1 1 A 41 41 CYS CB C 41 28.472 29.472 -1.000 1
1 374 . 4 1 1 A 41 41 CYS N N 41 124.738 125.757 -1.019 1
1 375 . 4 1 1 A 42 42 SER H H 42 9.527 8.805 0.722 1
1 376 . 4 1 1 A 42 42 SER HA H 42 4.149 4.067 0.082 1
1 379 . 4 1 1 A 42 42 SER C C 42 175.014 173.965 1.049 1
1 380 . 4 1 1 A 42 42 SER CA C 42 59.058 59.426 -0.368 1
1 381 . 4 1 1 A 42 42 SER CB C 42 62.287 62.703 -0.416 1
1 382 . 4 1 1 A 42 42 SER N N 42 125.889 123.236 2.653 1
1 383 . 4 1 1 A 43 43 GLY H H 43 8.685 8.354 0.331 1
1 384 . 4 1 1 A 43 43 GLY HA2 H 43 3.594 4.001 -0.407 1
1 385 . 4 1 1 A 43 43 GLY HA3 H 43 4.210 4.006 0.204 1
1 386 . 4 1 1 A 43 43 GLY C C 43 173.664 174.544 -0.880 1
1 387 . 4 1 1 A 43 43 GLY CA C 43 45.404 45.365 0.039 1
1 388 . 4 1 1 A 43 43 GLY N N 43 104.633 107.490 -2.857 1
1 389 . 4 1 1 A 44 44 ARG H H 44 7.926 7.826 0.100 1
1 390 . 4 1 1 A 44 44 ARG HA H 44 4.678 4.384 0.294 1
1 395 . 4 1 1 A 44 44 ARG C C 44 175.261 175.612 -0.351 1
1 396 . 4 1 1 A 44 44 ARG CA C 44 55.011 55.943 -0.932 1
1 397 . 4 1 1 A 44 44 ARG CB C 44 32.138 31.512 0.626 1
1 400 . 4 1 1 A 44 44 ARG N N 44 121.239 119.757 1.482 1
1 401 . 4 1 1 A 45 45 ARG H H 45 8.775 9.440 -0.665 1
1 402 . 4 1 1 A 45 45 ARG HA H 45 5.770 5.762 0.008 1
1 409 . 4 1 1 A 45 45 ARG C C 45 176.064 174.408 1.656 1
1 410 . 4 1 1 A 45 45 ARG CA C 45 54.683 53.482 1.201 1
1 411 . 4 1 1 A 45 45 ARG CB C 45 33.748 34.475 -0.727 1
1 414 . 4 1 1 A 45 45 ARG N N 45 125.948 119.165 6.783 1
1 415 . 4 1 1 A 46 46 HIS H H 46 8.912 8.154 0.758 1
1 416 . 4 1 1 A 46 46 HIS HA H 46 4.927 5.086 -0.159 1
1 420 . 4 1 1 A 46 46 HIS C C 46 172.634 173.344 -0.710 1
1 421 . 4 1 1 A 46 46 HIS CA C 46 56.480 54.869 1.611 1
1 422 . 4 1 1 A 46 46 HIS CB C 46 33.608 33.385 0.223 1
1 423 . 4 1 1 A 46 46 HIS N N 46 121.825 116.327 5.498 1
1 424 . 4 1 1 A 47 47 THR H H 47 8.532 8.976 -0.444 1
1 425 . 4 1 1 A 47 47 THR HA H 47 5.472 4.989 0.483 1
1 430 . 4 1 1 A 47 47 THR C C 47 174.442 173.158 1.284 1
1 431 . 4 1 1 A 47 47 THR CA C 47 61.093 60.920 0.173 1
1 432 . 4 1 1 A 47 47 THR CB C 47 71.041 70.309 0.732 1
1 434 . 4 1 1 A 47 47 THR N N 47 115.450 113.916 1.534 1
1 435 . 4 1 1 A 48 48 VAL H H 48 9.695 9.342 0.353 1
1 436 . 4 1 1 A 48 48 VAL HA H 48 4.677 4.539 0.138 1
1 444 . 4 1 1 A 48 48 VAL CA C 48 58.172 59.423 -1.251 1
1 445 . 4 1 1 A 48 48 VAL CB C 48 34.990 32.519 2.471 1
1 448 . 4 1 1 A 48 48 VAL N N 48 126.721 127.684 -0.963 1
1 449 . 4 1 1 A 49 49 PRO HA H 49 5.087 4.929 0.158 1
1 453 . 4 1 1 A 49 49 PRO CA C 49 61.671 62.629 -0.958 1
1 454 . 4 1 1 A 49 49 PRO CB C 49 31.923 31.754 0.169 1
1 457 . 4 1 1 A 50 50 ARG H H 50 9.125 9.030 0.095 1
1 458 . 4 1 1 A 50 50 ARG HA H 50 4.974 4.493 0.481 1
1 464 . 4 1 1 A 50 50 ARG C C 50 176.187 174.586 1.601 1
1 465 . 4 1 1 A 50 50 ARG CA C 50 53.015 54.971 -1.956 1
1 466 . 4 1 1 A 50 50 ARG CB C 50 36.553 33.465 3.088 1
1 468 . 4 1 1 A 50 50 ARG N N 50 124.189 123.952 0.237 1
1 469 . 4 1 1 A 51 51 ARG H H 51 10.105 8.743 1.362 1
1 470 . 4 1 1 A 51 51 ARG HA H 51 5.196 4.303 0.893 1
1 475 . 4 1 1 A 51 51 ARG C C 51 178.865 175.665 3.200 1
1 476 . 4 1 1 A 51 51 ARG CA C 51 55.961 54.386 1.575 1
1 477 . 4 1 1 A 51 51 ARG CB C 51 32.539 30.903 1.636 1
1 480 . 4 1 1 A 51 51 ARG N N 51 124.521 123.714 0.807 1
1 481 . 4 1 1 A 52 52 TYR H H 52 10.397 9.065 1.332 1
1 482 . 4 1 1 A 52 52 TYR HA H 52 4.360 4.318 0.042 1
1 487 . 4 1 1 A 52 52 TYR C C 52 178.143 177.978 0.165 1
1 488 . 4 1 1 A 52 52 TYR CA C 52 63.538 62.512 1.026 1
1 489 . 4 1 1 A 52 52 TYR CB C 52 38.784 39.097 -0.313 1
1 490 . 4 1 1 A 52 52 TYR N N 52 124.772 121.882 2.890 1
1 491 . 4 1 1 A 53 53 SER H H 53 9.231 8.241 0.990 1
1 492 . 4 1 1 A 53 53 SER HA H 53 4.175 4.355 -0.180 1
1 493 . 4 1 1 A 53 53 SER C C 53 177.220 177.421 -0.201 1
1 494 . 4 1 1 A 53 53 SER CA C 53 61.606 61.378 0.228 1
1 495 . 4 1 1 A 53 53 SER N N 53 113.262 114.841 -1.579 1
1 496 . 4 1 1 A 54 54 GLU H H 54 7.807 7.737 0.070 1
1 497 . 4 1 1 A 54 54 GLU HA H 54 4.392 4.073 0.319 1
1 501 . 4 1 1 A 54 54 GLU C C 54 180.361 179.263 1.098 1
1 502 . 4 1 1 A 54 54 GLU CA C 54 59.497 59.105 0.392 1
1 503 . 4 1 1 A 54 54 GLU CB C 54 30.708 29.141 1.567 1
1 504 . 4 1 1 A 54 54 GLU N N 54 121.949 121.969 -0.020 1
1 505 . 4 1 1 A 55 55 PHE H H 55 8.133 8.036 0.097 1
1 506 . 4 1 1 A 55 55 PHE HA H 55 4.007 4.232 -0.225 1
1 513 . 4 1 1 A 55 55 PHE C C 55 176.531 177.583 -1.052 1
1 514 . 4 1 1 A 55 55 PHE CA C 55 61.848 61.443 0.405 1
1 515 . 4 1 1 A 55 55 PHE CB C 55 38.847 39.005 -0.158 1
1 516 . 4 1 1 A 55 55 PHE N N 55 119.998 121.465 -1.467 1
1 517 . 4 1 1 A 56 56 HIS H H 56 7.907 8.435 -0.528 1
1 518 . 4 1 1 A 56 56 HIS HA H 56 3.324 4.286 -0.962 1
1 522 . 4 1 1 A 56 56 HIS C C 56 176.748 177.584 -0.836 1
1 523 . 4 1 1 A 56 56 HIS CA C 56 58.770 60.281 -1.511 1
1 524 . 4 1 1 A 56 56 HIS CB C 56 30.404 29.325 1.079 1
1 525 . 4 1 1 A 56 56 HIS N N 56 119.173 118.183 0.990 1
1 526 . 4 1 1 A 57 57 ALA H H 57 7.962 8.539 -0.577 1
1 527 . 4 1 1 A 57 57 ALA HA H 57 3.865 3.989 -0.124 1
1 531 . 4 1 1 A 57 57 ALA C C 57 180.075 179.963 0.112 1
1 532 . 4 1 1 A 57 57 ALA CA C 57 54.996 55.179 -0.183 1
1 533 . 4 1 1 A 57 57 ALA CB C 57 18.226 18.054 0.172 1
1 534 . 4 1 1 A 57 57 ALA N N 57 120.094 121.375 -1.281 1
1 535 . 4 1 1 A 58 58 LEU H H 58 7.295 8.633 -1.338 1
1 536 . 4 1 1 A 58 58 LEU HA H 58 3.994 4.092 -0.098 1
1 546 . 4 1 1 A 58 58 LEU C C 58 177.428 178.729 -1.301 1
1 547 . 4 1 1 A 58 58 LEU CA C 58 58.342 58.008 0.334 1
1 548 . 4 1 1 A 58 58 LEU CB C 58 40.851 41.613 -0.762 1
1 552 . 4 1 1 A 58 58 LEU N N 58 119.404 120.216 -0.812 1
1 553 . 4 1 1 A 59 59 HIS H H 59 7.805 8.722 -0.917 1
1 554 . 4 1 1 A 59 59 HIS HA H 59 4.286 3.973 0.313 1
1 558 . 4 1 1 A 59 59 HIS C C 59 177.001 177.420 -0.419 1
1 559 . 4 1 1 A 59 59 HIS CA C 59 60.141 60.271 -0.130 1
1 560 . 4 1 1 A 59 59 HIS CB C 59 31.072 29.905 1.167 1
1 561 . 4 1 1 A 59 59 HIS N N 59 119.040 118.117 0.923 1
1 562 . 4 1 1 A 60 60 LYS H H 60 7.715 8.037 -0.322 1
1 563 . 4 1 1 A 60 60 LYS HA H 60 3.456 4.094 -0.638 1
1 570 . 4 1 1 A 60 60 LYS C C 60 178.464 179.024 -0.560 1
1 571 . 4 1 1 A 60 60 LYS CA C 60 59.629 59.443 0.186 1
1 572 . 4 1 1 A 60 60 LYS CB C 60 32.354 32.007 0.347 1
1 576 . 4 1 1 A 60 60 LYS N N 60 114.225 118.147 -3.922 1
1 577 . 4 1 1 A 61 61 ARG H H 61 7.486 8.309 -0.823 1
1 578 . 4 1 1 A 61 61 ARG HA H 61 4.202 4.055 0.147 1
1 584 . 4 1 1 A 61 61 ARG C C 61 178.995 179.185 -0.190 1
1 585 . 4 1 1 A 61 61 ARG CA C 61 58.387 59.281 -0.894 1
1 586 . 4 1 1 A 61 61 ARG CB C 61 31.216 30.021 1.195 1
1 589 . 4 1 1 A 61 61 ARG N N 61 115.929 118.920 -2.991 1
1 590 . 4 1 1 A 62 62 ILE H H 62 8.066 7.605 0.461 1
1 591 . 4 1 1 A 62 62 ILE HA H 62 4.491 3.969 0.522 1
1 601 . 4 1 1 A 62 62 ILE C C 62 177.838 177.508 0.330 1
1 602 . 4 1 1 A 62 62 ILE CA C 62 63.399 64.089 -0.690 1
1 603 . 4 1 1 A 62 62 ILE CB C 62 39.699 37.417 2.282 1
1 606 . 4 1 1 A 62 62 ILE N N 62 111.456 116.045 -4.589 1
1 607 . 4 1 1 A 63 63 LYS H H 63 8.158 8.342 -0.184 1
1 608 . 4 1 1 A 63 63 LYS HA H 63 4.136 3.930 0.206 1
1 615 . 4 1 1 A 63 63 LYS C C 63 176.358 178.973 -2.615 1
1 616 . 4 1 1 A 63 63 LYS CA C 63 58.753 58.657 0.096 1
1 617 . 4 1 1 A 63 63 LYS CB C 63 30.825 31.366 -0.541 1
1 621 . 4 1 1 A 63 63 LYS N N 63 120.800 123.317 -2.517 1
1 622 . 4 1 1 A 64 64 LYS H H 64 7.687 7.319 0.368 1
1 623 . 4 1 1 A 64 64 LYS HA H 64 4.301 4.167 0.134 1
1 628 . 4 1 1 A 64 64 LYS C C 64 177.084 178.209 -1.125 1
1 629 . 4 1 1 A 64 64 LYS CA C 64 57.237 58.731 -1.494 1
1 630 . 4 1 1 A 64 64 LYS CB C 64 32.502 31.804 0.698 1
1 634 . 4 1 1 A 64 64 LYS N N 64 116.548 119.687 -3.139 1
1 635 . 4 1 1 A 65 65 LEU H H 65 7.476 7.715 -0.239 1
1 636 . 4 1 1 A 65 65 LEU HA H 65 4.219 4.306 -0.087 1
1 645 . 4 1 1 A 65 65 LEU C C 65 175.886 176.889 -1.003 1
1 646 . 4 1 1 A 65 65 LEU CA C 65 55.542 56.513 -0.971 1
1 647 . 4 1 1 A 65 65 LEU CB C 65 45.493 43.482 2.011 1
1 650 . 4 1 1 A 65 65 LEU N N 65 118.000 118.101 -0.101 1
1 651 . 4 1 1 A 66 66 TYR H H 66 7.672 8.604 -0.932 1
1 652 . 4 1 1 A 66 66 TYR HA H 66 4.762 5.185 -0.423 1
1 660 . 4 1 1 A 66 66 TYR C C 66 174.199 174.706 -0.507 1
1 661 . 4 1 1 A 66 66 TYR CA C 66 56.013 55.359 0.654 1
1 662 . 4 1 1 A 66 66 TYR CB C 66 40.380 40.959 -0.579 1
1 663 . 4 1 1 A 66 66 TYR N N 66 116.805 115.297 1.508 1
1 664 . 4 1 1 A 67 67 LYS H H 67 8.547 8.451 0.096 1
1 665 . 4 1 1 A 67 67 LYS HA H 67 4.436 4.117 0.319 1
1 670 . 4 1 1 A 67 67 LYS C C 67 175.727 176.045 -0.318 1
1 671 . 4 1 1 A 67 67 LYS CA C 67 56.598 56.761 -0.163 1
1 672 . 4 1 1 A 67 67 LYS CB C 67 32.743 32.356 0.387 1
1 676 . 4 1 1 A 67 67 LYS N N 67 120.929 120.180 0.749 1
1 677 . 4 1 1 A 68 68 VAL H H 68 8.168 8.041 0.127 1
1 678 . 4 1 1 A 68 68 VAL HA H 68 4.869 4.348 0.521 1
1 686 . 4 1 1 A 68 68 VAL CA C 68 57.389 58.812 -1.423 1
1 687 . 4 1 1 A 68 68 VAL CB C 68 34.017 35.107 -1.090 1
1 690 . 4 1 1 A 68 68 VAL N N 68 116.467 123.583 -7.116 1
1 691 . 4 1 1 A 69 69 PRO HA H 69 4.674 4.661 0.013 1
1 696 . 4 1 1 A 69 69 PRO C C 69 178.013 175.909 2.104 1
1 697 . 4 1 1 A 69 69 PRO CA C 69 61.443 62.360 -0.917 1
1 698 . 4 1 1 A 69 69 PRO CB C 69 32.231 33.172 -0.941 1
1 701 . 4 1 1 A 70 70 ASP H H 70 8.167 8.716 -0.549 1
1 702 . 4 1 1 A 70 70 ASP HA H 70 4.531 4.834 -0.303 1
1 705 . 4 1 1 A 70 70 ASP C C 70 175.660 176.029 -0.369 1
1 706 . 4 1 1 A 70 70 ASP CA C 70 55.148 53.410 1.738 1
1 707 . 4 1 1 A 70 70 ASP CB C 70 40.876 42.047 -1.171 1
1 708 . 4 1 1 A 70 70 ASP N N 70 116.671 121.412 -4.741 1
1 709 . 4 1 1 A 71 71 PHE H H 71 8.387 8.183 0.204 1
1 710 . 4 1 1 A 71 71 PHE HA H 71 4.076 4.571 -0.495 1
1 717 . 4 1 1 A 71 71 PHE CA C 71 55.672 54.320 1.352 1
1 718 . 4 1 1 A 71 71 PHE CB C 71 39.155 40.426 -1.271 1
1 719 . 4 1 1 A 71 71 PHE N N 71 126.533 119.257 7.276 1
1 720 . 4 1 1 A 72 72 PRO HA H 72 4.156 4.655 -0.499 1
1 727 . 4 1 1 A 72 72 PRO CA C 72 63.079 62.473 0.606 1
1 728 . 4 1 1 A 72 72 PRO CB C 72 32.107 32.426 -0.319 1
1 731 . 4 1 1 A 73 73 SER H H 73 8.468 8.043 0.425 1
1 733 . 4 1 1 A 73 73 SER CA C 73 56.133 57.549 -1.416 1
1 734 . 4 1 1 A 73 73 SER CB C 73 63.991 64.951 -0.960 1
1 735 . 4 1 1 A 73 73 SER N N 73 121.533 120.465 1.068 1
1 736 . 4 1 1 A 74 74 LYS HA H 74 4.574 3.681 0.893 1
1 739 . 4 1 1 A 74 74 LYS CA C 74 55.659 58.156 -2.497 1
1 740 . 4 1 1 A 74 74 LYS CB C 74 30.550 32.700 -2.150 1
1 741 . 4 1 1 A 75 75 ARG H H 75 7.962 7.578 0.384 1
1 742 . 4 1 1 A 75 75 ARG HA H 75 4.162 4.793 -0.631 1
1 746 . 4 1 1 A 75 75 ARG CA C 75 56.123 54.458 1.665 1
1 747 . 4 1 1 A 75 75 ARG CB C 75 31.179 33.030 -1.851 1
1 749 . 4 1 1 A 75 75 ARG N N 75 121.665 119.207 2.458 1
1 750 . 4 1 1 A 76 76 LEU H H 76 8.071 8.336 -0.265 1
1 751 . 4 1 1 A 76 76 LEU HA H 76 4.618 4.531 0.087 1
1 759 . 4 1 1 A 76 76 LEU CA C 76 52.764 51.218 1.546 1
1 760 . 4 1 1 A 76 76 LEU CB C 76 41.918 44.425 -2.507 1
1 762 . 4 1 1 A 76 76 LEU N N 76 124.196 125.838 -1.642 1
1 763 . 4 1 1 A 77 77 PRO HA H 77 4.393 4.246 0.147 1
1 767 . 4 1 1 A 77 77 PRO CA C 77 63.746 62.344 1.402 1
1 770 . 4 1 1 A 78 78 ASN H H 78 8.379 8.771 -0.392 1
1 771 . 4 1 1 A 78 78 ASN HA H 78 4.586 4.503 0.083 1
1 776 . 4 1 1 A 78 78 ASN C C 78 175.648 175.025 0.623 1
1 777 . 4 1 1 A 78 78 ASN CA C 78 53.591 53.160 0.431 1
1 778 . 4 1 1 A 78 78 ASN CB C 78 37.826 38.834 -1.008 1
1 779 . 4 1 1 A 78 78 ASN N N 78 115.292 121.274 -5.982 1
1 781 . 4 1 1 A 79 79 TRP H H 79 7.900 7.753 0.147 1
1 782 . 4 1 1 A 79 79 TRP HA H 79 4.326 4.289 0.037 1
1 788 . 4 1 1 A 79 79 TRP CA C 79 58.825 58.477 0.348 1
1 789 . 4 1 1 A 79 79 TRP CB C 79 29.090 26.264 2.826 1
1 790 . 4 1 1 A 79 79 TRP N N 79 119.525 117.883 1.642 1
1 792 . 4 1 1 A 80 80 ARG H H 80 8.060 7.929 0.131 1
1 793 . 4 1 1 A 80 80 ARG HA H 80 3.913 4.120 -0.207 1
1 798 . 4 1 1 A 80 80 ARG C C 80 177.024 178.072 -1.048 1
1 799 . 4 1 1 A 80 80 ARG CA C 80 58.292 59.179 -0.887 1
1 800 . 4 1 1 A 80 80 ARG CB C 80 30.146 29.771 0.375 1
1 803 . 4 1 1 A 80 80 ARG N N 80 118.864 119.777 -0.913 1
1 804 . 4 1 1 A 81 81 THR H H 81 7.725 7.827 -0.102 1
1 805 . 4 1 1 A 81 81 THR HA H 81 4.297 4.382 -0.085 1
1 809 . 4 1 1 A 81 81 THR CA C 81 62.481 62.996 -0.515 1
1 811 . 4 1 1 A 81 81 THR N N 81 109.863 113.014 -3.151 1
1 812 . 4 1 1 A 82 82 ARG HA H 82 4.341 4.558 -0.217 1
1 816 . 4 1 1 A 82 82 ARG C C 82 177.261 176.405 0.856 1
1 817 . 4 1 1 A 82 82 ARG CA C 82 56.846 56.586 0.260 1
1 818 . 4 1 1 A 82 82 ARG CB C 82 30.288 32.886 -2.598 1
1 820 . 4 1 1 A 83 83 GLY H H 83 8.321 7.882 0.439 1
1 821 . 4 1 1 A 83 83 GLY HA2 H 83 3.957 4.141 -0.184 1
1 822 . 4 1 1 A 83 83 GLY C C 83 175.185 175.042 0.143 1
1 823 . 4 1 1 A 83 83 GLY CA C 83 46.297 44.038 2.259 1
1 824 . 4 1 1 A 83 83 GLY N N 83 109.146 105.450 3.696 1
1 825 . 4 1 1 A 84 84 LEU H H 84 8.303 8.838 -0.535 1
1 826 . 4 1 1 A 84 84 LEU HA H 84 4.018 3.868 0.150 1
1 835 . 4 1 1 A 84 84 LEU C C 84 178.552 178.387 0.165 1
1 836 . 4 1 1 A 84 84 LEU CA C 84 58.236 56.735 1.501 1
1 837 . 4 1 1 A 84 84 LEU CB C 84 41.837 41.547 0.290 1
1 840 . 4 1 1 A 84 84 LEU N N 84 122.662 121.254 1.408 1
1 841 . 4 1 1 A 85 85 GLU H H 85 8.233 8.206 0.027 1
1 842 . 4 1 1 A 85 85 GLU HA H 85 4.371 3.889 0.482 1
1 846 . 4 1 1 A 85 85 GLU C C 85 178.555 178.710 -0.155 1
1 847 . 4 1 1 A 85 85 GLU CA C 85 58.377 59.888 -1.511 1
1 848 . 4 1 1 A 85 85 GLU CB C 85 28.675 29.235 -0.560 1
1 850 . 4 1 1 A 85 85 GLU N N 85 119.781 119.299 0.482 1
1 851 . 4 1 1 A 86 86 GLN H H 86 7.877 7.850 0.027 1
1 852 . 4 1 1 A 86 86 GLN HA H 86 4.100 3.969 0.131 1
1 858 . 4 1 1 A 86 86 GLN C C 86 179.557 177.831 1.726 1
1 859 . 4 1 1 A 86 86 GLN CA C 86 58.955 59.075 -0.120 1
1 860 . 4 1 1 A 86 86 GLN CB C 86 28.191 28.685 -0.494 1
1 862 . 4 1 1 A 86 86 GLN N N 86 118.042 119.555 -1.513 1
1 863 . 4 1 1 A 87 87 ARG H H 87 8.169 7.528 0.641 1
1 864 . 4 1 1 A 87 87 ARG HA H 87 3.975 3.706 0.269 1
1 868 . 4 1 1 A 87 87 ARG C C 87 177.051 177.982 -0.931 1
1 869 . 4 1 1 A 87 87 ARG CA C 87 59.006 59.179 -0.173 1
1 870 . 4 1 1 A 87 87 ARG CB C 87 30.383 29.050 1.333 1
1 872 . 4 1 1 A 87 87 ARG N N 87 121.381 119.400 1.981 1
1 873 . 4 1 1 A 88 88 ARG H H 88 8.593 8.108 0.485 1
1 874 . 4 1 1 A 88 88 ARG HA H 88 3.726 3.774 -0.048 1
1 876 . 4 1 1 A 88 88 ARG C C 88 177.520 178.234 -0.714 1
1 877 . 4 1 1 A 88 88 ARG CA C 88 60.751 58.903 1.848 1
1 878 . 4 1 1 A 88 88 ARG CB C 88 30.153 30.027 0.126 1
1 879 . 4 1 1 A 88 88 ARG N N 88 120.863 117.530 3.333 1
1 880 . 4 1 1 A 89 89 GLN H H 89 8.355 7.701 0.654 1
1 881 . 4 1 1 A 89 89 GLN HA H 89 3.887 3.932 -0.045 1
1 887 . 4 1 1 A 89 89 GLN C C 89 179.499 178.540 0.959 1
1 888 . 4 1 1 A 89 89 GLN CA C 89 59.603 59.512 0.091 1
1 889 . 4 1 1 A 89 89 GLN CB C 89 28.464 28.161 0.303 1
1 891 . 4 1 1 A 89 89 GLN N N 89 116.860 118.914 -2.054 1
1 893 . 4 1 1 A 90 90 GLY H H 90 8.406 8.019 0.387 1
1 894 . 4 1 1 A 90 90 GLY HA2 H 90 3.672 3.508 0.164 1
1 895 . 4 1 1 A 90 90 GLY HA3 H 90 3.871 3.571 0.300 1
1 896 . 4 1 1 A 90 90 GLY C C 90 177.033 175.458 1.575 1
1 897 . 4 1 1 A 90 90 GLY CA C 90 46.813 47.161 -0.348 1
1 898 . 4 1 1 A 90 90 GLY N N 90 107.679 107.101 0.578 1
1 899 . 4 1 1 A 91 91 LEU H H 91 8.504 7.734 0.770 1
1 900 . 4 1 1 A 91 91 LEU HA H 91 3.784 3.504 0.280 1
1 910 . 4 1 1 A 91 91 LEU C C 91 178.003 179.143 -1.140 1
1 911 . 4 1 1 A 91 91 LEU CA C 91 57.354 57.364 -0.010 1
1 912 . 4 1 1 A 91 91 LEU CB C 91 40.359 40.428 -0.069 1
1 916 . 4 1 1 A 91 91 LEU N N 91 123.959 121.349 2.610 1
1 917 . 4 1 1 A 92 92 GLU H H 92 8.324 8.651 -0.327 1
1 918 . 4 1 1 A 92 92 GLU HA H 92 3.732 4.078 -0.346 1
1 922 . 4 1 1 A 92 92 GLU C C 92 177.272 178.914 -1.642 1
1 923 . 4 1 1 A 92 92 GLU CA C 92 60.651 59.285 1.366 1
1 924 . 4 1 1 A 92 92 GLU CB C 92 30.843 29.162 1.681 1
1 926 . 4 1 1 A 92 92 GLU N N 92 121.991 117.915 4.076 1
1 927 . 4 1 1 A 93 93 ALA H H 93 8.126 7.542 0.584 1
1 928 . 4 1 1 A 93 93 ALA HA H 93 4.160 4.061 0.099 1
1 932 . 4 1 1 A 93 93 ALA C C 93 180.818 179.238 1.580 1
1 933 . 4 1 1 A 93 93 ALA CA C 93 54.828 54.941 -0.113 1
1 934 . 4 1 1 A 93 93 ALA CB C 93 18.032 17.977 0.055 1
1 935 . 4 1 1 A 93 93 ALA N N 93 120.066 122.027 -1.961 1
1 936 . 4 1 1 A 94 94 TYR H H 94 7.916 7.753 0.163 1
1 937 . 4 1 1 A 94 94 TYR HA H 94 4.139 4.385 -0.246 1
1 942 . 4 1 1 A 94 94 TYR C C 94 175.895 178.731 -2.836 1
1 943 . 4 1 1 A 94 94 TYR CA C 94 61.915 61.755 0.160 1
1 944 . 4 1 1 A 94 94 TYR CB C 94 38.740 38.352 0.388 1
1 945 . 4 1 1 A 94 94 TYR N N 94 121.179 115.911 5.268 1
1 946 . 4 1 1 A 95 95 ILE H H 95 7.983 8.690 -0.707 1
1 947 . 4 1 1 A 95 95 ILE HA H 95 3.614 3.971 -0.357 1
1 957 . 4 1 1 A 95 95 ILE C C 95 174.678 177.919 -3.241 1
1 958 . 4 1 1 A 95 95 ILE CA C 95 63.461 62.751 0.710 1
1 959 . 4 1 1 A 95 95 ILE CB C 95 36.625 37.850 -1.225 1
1 963 . 4 1 1 A 95 95 ILE N N 95 116.397 120.804 -4.407 1
1 964 . 4 1 1 A 96 96 GLN H H 96 8.175 8.421 -0.246 1
1 965 . 4 1 1 A 96 96 GLN HA H 96 3.763 4.056 -0.293 1
1 970 . 4 1 1 A 96 96 GLN C C 96 179.042 178.606 0.436 1
1 971 . 4 1 1 A 96 96 GLN CA C 96 59.270 59.765 -0.495 1
1 972 . 4 1 1 A 96 96 GLN CB C 96 27.696 28.039 -0.343 1
1 974 . 4 1 1 A 96 96 GLN N N 96 116.631 121.706 -5.075 1
1 976 . 4 1 1 A 97 97 GLY H H 97 8.222 8.304 -0.082 1
1 977 . 4 1 1 A 97 97 GLY HA2 H 97 3.661 3.728 -0.067 1
1 978 . 4 1 1 A 97 97 GLY HA3 H 97 3.806 3.739 0.067 1
1 979 . 4 1 1 A 97 97 GLY C C 97 175.449 176.063 -0.614 1
1 980 . 4 1 1 A 97 97 GLY CA C 97 46.917 47.354 -0.437 1
1 981 . 4 1 1 A 97 97 GLY N N 97 107.315 107.170 0.145 1
1 982 . 4 1 1 A 98 98 ILE H H 98 7.630 8.104 -0.474 1
1 983 . 4 1 1 A 98 98 ILE HA H 98 3.399 3.908 -0.509 1
1 993 . 4 1 1 A 98 98 ILE C C 98 178.683 177.998 0.685 1
1 994 . 4 1 1 A 98 98 ILE CA C 98 66.402 64.800 1.602 1
1 995 . 4 1 1 A 98 98 ILE CB C 98 38.037 37.664 0.373 1
1 999 . 4 1 1 A 98 98 ILE N N 98 120.644 121.071 -0.427 1
1 1000 . 4 1 1 A 99 99 LEU H H 99 7.076 7.970 -0.894 1
1 1001 . 4 1 1 A 99 99 LEU HA H 99 4.133 4.058 0.075 1
1 1010 . 4 1 1 A 99 99 LEU C C 99 178.128 178.238 -0.110 1
1 1011 . 4 1 1 A 99 99 LEU CA C 99 57.129 57.961 -0.832 1
1 1012 . 4 1 1 A 99 99 LEU CB C 99 41.108 41.650 -0.542 1
1 1014 . 4 1 1 A 99 99 LEU N N 99 116.844 124.338 -7.494 1
1 1015 . 4 1 1 A 100 100 TYR H H 100 7.890 8.928 -1.038 1
1 1016 . 4 1 1 A 100 100 TYR HA H 100 4.550 4.175 0.375 1
1 1021 . 4 1 1 A 100 100 TYR C C 100 178.210 177.679 0.531 1
1 1022 . 4 1 1 A 100 100 TYR CA C 100 59.452 61.268 -1.816 1
1 1023 . 4 1 1 A 100 100 TYR CB C 100 38.786 38.817 -0.031 1
1 1024 . 4 1 1 A 100 100 TYR N N 100 116.427 119.736 -3.309 1
1 1025 . 4 1 1 A 101 101 LEU H H 101 8.041 8.514 -0.473 1
1 1026 . 4 1 1 A 101 101 LEU HA H 101 4.158 3.962 0.196 1
1 1036 . 4 1 1 A 101 101 LEU C C 101 176.808 177.689 -0.881 1
1 1037 . 4 1 1 A 101 101 LEU CA C 101 56.156 58.256 -2.100 1
1 1038 . 4 1 1 A 101 101 LEU CB C 101 44.307 41.787 2.520 1
1 1041 . 4 1 1 A 101 101 LEU N N 101 116.493 120.676 -4.183 1
1 1042 . 4 1 1 A 102 102 ASN H H 102 7.146 8.035 -0.889 1
1 1043 . 4 1 1 A 102 102 ASN HA H 102 5.056 5.047 0.009 1
1 1046 . 4 1 1 A 102 102 ASN CA C 102 52.704 54.693 -1.989 1
1 1047 . 4 1 1 A 102 102 ASN CB C 102 42.424 40.629 1.795 1
1 1048 . 4 1 1 A 102 102 ASN N N 102 114.922 114.117 0.805 1
1 1049 . 4 1 1 A 103 103 GLN H H 103 8.477 8.247 0.230 1
1 1050 . 4 1 1 A 103 103 GLN HA H 103 3.866 3.826 0.040 1
1 1054 . 4 1 1 A 103 103 GLN C C 103 176.110 176.208 -0.098 1
1 1055 . 4 1 1 A 103 103 GLN CA C 103 58.451 58.459 -0.008 1
1 1056 . 4 1 1 A 103 103 GLN CB C 103 28.896 28.402 0.494 1
1 1058 . 4 1 1 A 103 103 GLN N N 103 120.252 119.227 1.025 1
1 1059 . 4 1 1 A 104 104 GLU H H 104 7.930 8.439 -0.509 1
1 1060 . 4 1 1 A 104 104 GLU HA H 104 4.591 4.454 0.137 1
1 1064 . 4 1 1 A 104 104 GLU C C 104 175.397 175.115 0.282 1
1 1065 . 4 1 1 A 104 104 GLU CA C 104 54.058 57.810 -3.752 1
1 1066 . 4 1 1 A 104 104 GLU CB C 104 31.272 27.674 3.598 1
1 1068 . 4 1 1 A 104 104 GLU N N 104 117.295 118.877 -1.582 1
1 1069 . 4 1 1 A 105 105 VAL H H 105 8.546 7.883 0.663 1
1 1070 . 4 1 1 A 105 105 VAL HA H 105 3.823 4.348 -0.525 1
1 1078 . 4 1 1 A 105 105 VAL CA C 105 60.706 59.812 0.894 1
1 1079 . 4 1 1 A 105 105 VAL CB C 105 32.126 33.149 -1.023 1
1 1082 . 4 1 1 A 105 105 VAL N N 105 124.511 119.469 5.042 1
1 1083 . 4 1 1 A 106 106 PRO HA H 106 3.997 4.543 -0.546 1
1 1089 . 4 1 1 A 106 106 PRO C C 106 178.240 177.904 0.336 1
1 1090 . 4 1 1 A 106 106 PRO CA C 106 62.961 63.283 -0.322 1
1 1091 . 4 1 1 A 106 106 PRO CB C 106 32.321 32.029 0.292 1
1 1094 . 4 1 1 A 107 107 LYS H H 107 9.122 8.959 0.163 1
1 1095 . 4 1 1 A 107 107 LYS HA H 107 3.813 3.953 -0.140 1
1 1101 . 4 1 1 A 107 107 LYS C C 107 178.563 178.005 0.558 1
1 1102 . 4 1 1 A 107 107 LYS CA C 107 60.085 59.369 0.716 1
1 1103 . 4 1 1 A 107 107 LYS CB C 107 31.632 32.242 -0.610 1
1 1106 . 4 1 1 A 107 107 LYS N N 107 129.017 124.866 4.151 1
1 1107 . 4 1 1 A 108 108 GLU H H 108 10.370 8.292 2.078 1
1 1108 . 4 1 1 A 108 108 GLU HA H 108 3.991 4.097 -0.106 1
1 1111 . 4 1 1 A 108 108 GLU C C 108 180.366 179.189 1.177 1
1 1112 . 4 1 1 A 108 108 GLU CA C 108 60.337 59.369 0.968 1
1 1113 . 4 1 1 A 108 108 GLU CB C 108 29.178 29.715 -0.537 1
1 1115 . 4 1 1 A 108 108 GLU N N 108 118.335 118.879 -0.544 1
1 1116 . 4 1 1 A 109 109 LEU H H 109 7.393 7.984 -0.591 1
1 1117 . 4 1 1 A 109 109 LEU HA H 109 4.220 4.067 0.153 1
1 1126 . 4 1 1 A 109 109 LEU C C 109 177.378 178.754 -1.376 1
1 1127 . 4 1 1 A 109 109 LEU CA C 109 56.618 58.069 -1.451 1
1 1128 . 4 1 1 A 109 109 LEU CB C 109 41.898 41.610 0.288 1
1 1131 . 4 1 1 A 109 109 LEU N N 109 118.285 120.269 -1.984 1
1 1132 . 4 1 1 A 110 110 LEU H H 110 7.641 7.498 0.143 1
1 1133 . 4 1 1 A 110 110 LEU HA H 110 3.796 3.905 -0.109 1
1 1142 . 4 1 1 A 110 110 LEU C C 110 179.103 178.211 0.892 1
1 1143 . 4 1 1 A 110 110 LEU CA C 110 59.046 58.456 0.590 1
1 1144 . 4 1 1 A 110 110 LEU CB C 110 40.228 41.317 -1.089 1
1 1147 . 4 1 1 A 110 110 LEU N N 110 120.162 120.141 0.021 1
1 1148 . 4 1 1 A 111 111 GLU H H 111 7.916 8.626 -0.710 1
1 1149 . 4 1 1 A 111 111 GLU HA H 111 4.080 4.064 0.016 1
1 1153 . 4 1 1 A 111 111 GLU C C 111 179.967 178.893 1.074 1
1 1154 . 4 1 1 A 111 111 GLU CA C 111 59.243 59.007 0.236 1
1 1155 . 4 1 1 A 111 111 GLU CB C 111 29.576 29.070 0.506 1
1 1157 . 4 1 1 A 111 111 GLU N N 111 117.360 118.460 -1.100 1
1 1158 . 4 1 1 A 112 112 PHE H H 112 7.712 8.044 -0.332 1
1 1159 . 4 1 1 A 112 112 PHE HA H 112 4.224 4.151 0.073 1
1 1164 . 4 1 1 A 112 112 PHE C C 112 177.180 176.969 0.211 1
1 1165 . 4 1 1 A 112 112 PHE CA C 112 61.407 61.319 0.088 1
1 1166 . 4 1 1 A 112 112 PHE CB C 112 40.172 39.637 0.535 1
1 1167 . 4 1 1 A 112 112 PHE N N 112 123.042 120.949 2.093 1
1 1168 . 4 1 1 A 113 113 LEU H H 113 8.056 7.877 0.179 1
1 1169 . 4 1 1 A 113 113 LEU HA H 113 4.147 4.488 -0.341 1
1 1175 . 4 1 1 A 113 113 LEU C C 113 173.717 176.047 -2.330 1
1 1176 . 4 1 1 A 113 113 LEU CA C 113 54.093 54.427 -0.334 1
1 1177 . 4 1 1 A 113 113 LEU CB C 113 41.517 42.608 -1.091 1
1 1179 . 4 1 1 A 113 113 LEU N N 113 115.595 116.973 -1.378 1
1 1180 . 4 1 1 A 114 114 ARG H H 114 7.902 7.974 -0.072 1
1 1181 . 4 1 1 A 114 114 ARG HA H 114 3.817 4.214 -0.397 1
1 1182 . 4 1 1 A 114 114 ARG C C 114 174.566 176.211 -1.645 1
1 1183 . 4 1 1 A 114 114 ARG CA C 114 57.233 57.093 0.140 1
1 1184 . 4 1 1 A 114 114 ARG CB C 114 27.788 27.120 0.668 1
1 1185 . 4 1 1 A 114 114 ARG N N 114 116.021 115.542 0.479 1
1 1186 . 4 1 1 A 115 115 LEU H H 115 8.160 7.940 0.220 1
1 1187 . 4 1 1 A 115 115 LEU HA H 115 4.462 3.141 1.321 1
1 1195 . 4 1 1 A 115 115 LEU C C 115 176.374 176.383 -0.009 1
1 1196 . 4 1 1 A 115 115 LEU CA C 115 53.965 54.525 -0.560 1
1 1197 . 4 1 1 A 115 115 LEU CB C 115 44.077 40.923 3.154 1
1 1199 . 4 1 1 A 115 115 LEU N N 115 118.089 117.969 0.120 1
1 1200 . 4 1 1 A 116 116 ARG H H 116 8.066 7.514 0.552 1
1 1201 . 4 1 1 A 116 116 ARG HA H 116 4.172 4.453 -0.281 1
1 1203 . 4 1 1 A 116 116 ARG CA C 116 55.961 56.532 -0.571 1
1 1204 . 4 1 1 A 116 116 ARG CB C 116 31.379 30.426 0.953 1
1 1205 . 4 1 1 A 116 116 ARG N N 116 120.852 118.988 1.864 1
1 1206 . 4 1 1 A 117 117 HIS H H 117 7.928 9.000 -1.072 1
1 1207 . 4 1 1 A 117 117 HIS HA H 117 4.557 4.353 0.204 1
1 1211 . 4 1 1 A 117 117 HIS CA C 117 55.937 57.226 -1.289 1
1 1212 . 4 1 1 A 117 117 HIS CB C 117 30.875 29.166 1.709 1
1 1213 . 4 1 1 A 118 118 PHE H H 118 8.183 7.857 0.326 1
1 1214 . 4 1 1 A 118 118 PHE HA H 118 4.730 4.353 0.377 1
1 1219 . 4 1 1 A 118 118 PHE CA C 118 55.716 56.674 -0.958 1
1 1220 . 4 1 1 A 118 118 PHE CB C 118 39.263 38.209 1.054 1
1 1221 . 4 1 1 A 118 118 PHE N N 118 123.480 119.629 3.851 1
1 1222 . 4 1 1 A 119 119 PRO HA H 119 4.398 4.647 -0.249 1
1 1227 . 4 1 1 A 119 119 PRO C C 119 176.666 176.208 0.458 1
1 1228 . 4 1 1 A 119 119 PRO CA C 119 63.377 62.563 0.814 1
1 1229 . 4 1 1 A 119 119 PRO CB C 119 32.059 33.377 -1.318 1
1 1232 . 4 1 1 A 120 120 THR H H 120 8.054 8.495 -0.441 1
1 1233 . 4 1 1 A 120 120 THR HA H 120 4.273 5.252 -0.979 1
1 1238 . 4 1 1 A 120 120 THR C C 120 174.154 173.974 0.180 1
1 1239 . 4 1 1 A 120 120 THR CA C 120 61.893 61.282 0.611 1
1 1240 . 4 1 1 A 120 120 THR CB C 120 69.736 69.358 0.378 1
1 1242 . 4 1 1 A 120 120 THR N N 120 113.088 114.317 -1.229 1
1 1243 . 4 1 1 A 121 121 ASP H H 121 8.209 7.669 0.540 1
1 1244 . 4 1 1 A 121 121 ASP HA H 121 4.876 4.903 -0.027 1
1 1247 . 4 1 1 A 121 121 ASP CA C 121 52.126 50.555 1.571 1
1 1248 . 4 1 1 A 121 121 ASP CB C 121 41.553 41.245 0.308 1
1 1249 . 4 1 1 A 121 121 ASP N N 121 123.630 123.015 0.615 1
1 1250 . 4 1 1 A 122 122 PRO HA H 122 4.363 4.741 -0.378 1
1 1255 . 4 1 1 A 122 122 PRO C C 122 177.344 175.951 1.393 1
1 1256 . 4 1 1 A 122 122 PRO CA C 122 63.913 62.232 1.681 1
1 1257 . 4 1 1 A 122 122 PRO CB C 122 32.116 33.147 -1.031 1
1 1260 . 4 1 1 A 123 123 LYS H H 123 8.344 8.574 -0.230 1
1 1261 . 4 1 1 A 123 123 LYS HA H 123 4.244 4.733 -0.489 1
1 1266 . 4 1 1 A 123 123 LYS C C 123 176.637 175.246 1.391 1
1 1267 . 4 1 1 A 123 123 LYS CA C 123 56.359 55.108 1.251 1
1 1268 . 4 1 1 A 123 123 LYS CB C 123 32.367 35.924 -3.557 1
1 1272 . 4 1 1 A 123 123 LYS N N 123 119.110 120.800 -1.690 1
1 1273 . 4 1 1 A 124 124 ALA H H 124 7.929 8.873 -0.944 1
1 1274 . 4 1 1 A 124 124 ALA HA H 124 4.248 4.602 -0.354 1
1 1278 . 4 1 1 A 124 124 ALA C C 124 177.648 176.102 1.546 1
1 1279 . 4 1 1 A 124 124 ALA CA C 124 52.618 51.356 1.262 1
1 1280 . 4 1 1 A 124 124 ALA CB C 124 19.379 18.959 0.420 1
1 1281 . 4 1 1 A 124 124 ALA N N 124 123.825 129.321 -5.496 1
1 1282 . 4 1 1 A 125 125 SER H H 125 8.134 8.623 -0.489 1
1 1283 . 4 1 1 A 125 125 SER HA H 125 4.341 5.096 -0.755 1
1 1286 . 4 1 1 A 125 125 SER C C 125 174.172 173.168 1.004 1
1 1287 . 4 1 1 A 125 125 SER CA C 125 58.391 58.145 0.246 1
1 1288 . 4 1 1 A 125 125 SER CB C 125 63.748 63.239 0.509 1
1 1289 . 4 1 1 A 125 125 SER N N 125 114.454 121.368 -6.914 1
1 1290 . 4 1 1 A 126 126 ASN H H 126 8.242 8.960 -0.718 1
1 1291 . 4 1 1 A 126 126 ASN HA H 126 4.657 5.604 -0.947 1
1 1294 . 4 1 1 A 126 126 ASN C C 126 174.624 174.106 0.518 1
1 1295 . 4 1 1 A 126 126 ASN CA C 126 53.292 52.635 0.657 1
1 1296 . 4 1 1 A 126 126 ASN CB C 126 38.797 40.876 -2.079 1
1 1297 . 4 1 1 A 126 126 ASN N N 126 120.102 121.473 -1.371 1
1 1298 . 4 1 1 A 127 127 TRP H H 127 8.051 8.591 -0.540 1
1 1299 . 4 1 1 A 127 127 TRP HA H 127 4.694 5.199 -0.505 1
1 1302 . 4 1 1 A 127 127 TRP C C 127 175.479 174.276 1.203 1
1 1303 . 4 1 1 A 127 127 TRP CA C 127 57.096 57.105 -0.009 1
1 1304 . 4 1 1 A 127 127 TRP CB C 127 29.820 32.273 -2.453 1
1 1305 . 4 1 1 A 127 127 TRP N N 127 121.198 124.237 -3.039 1
1 1 . 5 1 1 A 7 7 HIS HA H 7 4.623 4.369 0.254 1
1 4 . 5 1 1 A 7 7 HIS C C 7 174.747 175.384 -0.637 1
1 5 . 5 1 1 A 7 7 HIS CA C 7 56.189 58.116 -1.927 1
1 6 . 5 1 1 A 7 7 HIS CB C 7 30.028 28.497 1.531 1
1 7 . 5 1 1 A 8 8 LEU H H 8 8.283 8.795 -0.512 1
1 8 . 5 1 1 A 8 8 LEU HA H 8 4.249 4.587 -0.338 1
1 10 . 5 1 1 A 8 8 LEU C C 8 176.700 176.692 0.008 1
1 11 . 5 1 1 A 8 8 LEU CA C 8 55.498 55.858 -0.360 1
1 12 . 5 1 1 A 8 8 LEU CB C 8 42.568 44.598 -2.030 1
1 13 . 5 1 1 A 8 8 LEU N N 8 122.916 121.806 1.110 1
1 14 . 5 1 1 A 9 9 GLU H H 9 8.623 8.124 0.499 1
1 15 . 5 1 1 A 9 9 GLU HA H 9 4.311 4.983 -0.672 1
1 16 . 5 1 1 A 9 9 GLU C C 9 174.811 175.363 -0.552 1
1 17 . 5 1 1 A 9 9 GLU CA C 9 56.377 55.154 1.223 1
1 18 . 5 1 1 A 9 9 GLU CB C 9 29.557 31.810 -2.253 1
1 20 . 5 1 1 A 9 9 GLU N N 9 121.512 115.116 6.396 1
1 21 . 5 1 1 A 10 10 LEU H H 10 7.853 9.111 -1.258 1
1 22 . 5 1 1 A 10 10 LEU HA H 10 5.225 5.455 -0.230 1
1 31 . 5 1 1 A 10 10 LEU C C 10 174.637 175.582 -0.945 1
1 32 . 5 1 1 A 10 10 LEU CA C 10 54.513 53.498 1.015 1
1 33 . 5 1 1 A 10 10 LEU CB C 10 45.187 45.889 -0.702 1
1 36 . 5 1 1 A 10 10 LEU N N 10 123.592 125.684 -2.092 1
1 37 . 5 1 1 A 11 11 GLU H H 11 8.894 8.925 -0.031 1
1 38 . 5 1 1 A 11 11 GLU HA H 11 4.765 5.114 -0.349 1
1 43 . 5 1 1 A 11 11 GLU C C 11 174.563 175.111 -0.548 1
1 44 . 5 1 1 A 11 11 GLU CA C 11 55.047 54.619 0.428 1
1 45 . 5 1 1 A 11 11 GLU CB C 11 33.760 34.439 -0.679 1
1 47 . 5 1 1 A 11 11 GLU N N 11 124.055 122.213 1.842 1
1 48 . 5 1 1 A 12 12 VAL H H 12 8.607 8.626 -0.019 1
1 49 . 5 1 1 A 12 12 VAL HA H 12 5.174 5.321 -0.147 1
1 57 . 5 1 1 A 12 12 VAL C C 12 173.573 174.427 -0.854 1
1 58 . 5 1 1 A 12 12 VAL CA C 12 60.296 59.954 0.342 1
1 59 . 5 1 1 A 12 12 VAL CB C 12 35.689 35.751 -0.062 1
1 62 . 5 1 1 A 12 12 VAL N N 12 120.878 117.539 3.339 1
1 63 . 5 1 1 A 13 13 HIS H H 13 8.982 8.603 0.379 1
1 64 . 5 1 1 A 13 13 HIS HA H 13 4.824 5.042 -0.218 1
1 69 . 5 1 1 A 13 13 HIS C C 13 173.236 171.744 1.492 1
1 70 . 5 1 1 A 13 13 HIS CA C 13 54.906 54.643 0.263 1
1 71 . 5 1 1 A 13 13 HIS CB C 13 33.496 31.866 1.630 1
1 72 . 5 1 1 A 13 13 HIS N N 13 121.504 118.492 3.012 1
1 73 . 5 1 1 A 14 14 ILE H H 14 10.442 9.323 1.119 1
1 74 . 5 1 1 A 14 14 ILE HA H 14 5.458 4.550 0.908 1
1 84 . 5 1 1 A 14 14 ILE CA C 14 58.386 57.832 0.554 1
1 85 . 5 1 1 A 14 14 ILE CB C 14 38.596 37.521 1.075 1
1 88 . 5 1 1 A 14 14 ILE N N 14 119.923 121.675 -1.752 1
1 89 . 5 1 1 A 15 15 PRO HA H 15 4.560 4.437 0.123 1
1 95 . 5 1 1 A 15 15 PRO C C 15 176.907 175.734 1.173 1
1 96 . 5 1 1 A 15 15 PRO CA C 15 64.342 64.302 0.040 1
1 97 . 5 1 1 A 15 15 PRO CB C 15 32.924 32.190 0.734 1
1 100 . 5 1 1 A 16 16 SER H H 16 7.331 7.450 -0.119 1
1 101 . 5 1 1 A 16 16 SER HA H 16 4.822 4.777 0.045 1
1 104 . 5 1 1 A 16 16 SER C C 16 171.253 172.086 -0.833 1
1 105 . 5 1 1 A 16 16 SER CA C 16 57.135 57.553 -0.418 1
1 106 . 5 1 1 A 16 16 SER CB C 16 65.947 65.264 0.683 1
1 107 . 5 1 1 A 16 16 SER N N 16 107.745 107.853 -0.108 1
1 108 . 5 1 1 A 17 17 VAL H H 17 8.350 8.314 0.036 1
1 109 . 5 1 1 A 17 17 VAL HA H 17 4.926 5.112 -0.186 1
1 117 . 5 1 1 A 17 17 VAL C C 17 173.692 175.306 -1.614 1
1 118 . 5 1 1 A 17 17 VAL CA C 17 58.721 60.702 -1.981 1
1 119 . 5 1 1 A 17 17 VAL CB C 17 34.420 34.793 -0.373 1
1 122 . 5 1 1 A 17 17 VAL N N 17 118.680 121.895 -3.215 1
1 123 . 5 1 1 A 18 18 GLY H H 18 8.332 8.647 -0.315 1
1 124 . 5 1 1 A 18 18 GLY HA2 H 18 4.189 4.306 -0.117 1
1 125 . 5 1 1 A 18 18 GLY HA3 H 18 4.011 4.311 -0.300 1
1 126 . 5 1 1 A 18 18 GLY CA C 18 45.356 44.779 0.577 1
1 127 . 5 1 1 A 18 18 GLY N N 18 112.549 113.813 -1.264 1
1 128 . 5 1 1 A 19 19 PRO HA H 19 4.757 4.286 0.471 1
1 134 . 5 1 1 A 19 19 PRO C C 19 177.482 176.465 1.017 1
1 135 . 5 1 1 A 19 19 PRO CA C 19 62.848 62.786 0.062 1
1 136 . 5 1 1 A 19 19 PRO CB C 19 32.283 29.871 2.412 1
1 139 . 5 1 1 A 20 20 GLU H H 20 8.588 8.455 0.133 1
1 140 . 5 1 1 A 20 20 GLU HA H 20 4.147 4.152 -0.005 1
1 144 . 5 1 1 A 20 20 GLU C C 20 175.857 177.622 -1.765 1
1 145 . 5 1 1 A 20 20 GLU CA C 20 57.150 59.168 -2.018 1
1 146 . 5 1 1 A 20 20 GLU CB C 20 30.923 29.792 1.131 1
1 148 . 5 1 1 A 20 20 GLU N N 20 122.087 122.096 -0.009 1
1 149 . 5 1 1 A 21 21 ALA H H 21 8.352 7.494 0.858 1
1 150 . 5 1 1 A 21 21 ALA HA H 21 4.391 4.362 0.029 1
1 154 . 5 1 1 A 21 21 ALA C C 21 174.910 176.702 -1.792 1
1 155 . 5 1 1 A 21 21 ALA CA C 21 52.166 52.641 -0.475 1
1 156 . 5 1 1 A 21 21 ALA CB C 21 19.915 19.980 -0.065 1
1 157 . 5 1 1 A 21 21 ALA N N 21 124.593 121.920 2.673 1
1 158 . 5 1 1 A 22 22 GLU H H 22 8.398 8.518 -0.120 1
1 159 . 5 1 1 A 22 22 GLU HA H 22 4.331 4.932 -0.601 1
1 163 . 5 1 1 A 22 22 GLU C C 22 176.389 175.905 0.484 1
1 164 . 5 1 1 A 22 22 GLU CA C 22 56.316 54.607 1.709 1
1 165 . 5 1 1 A 22 22 GLU CB C 22 30.713 32.574 -1.861 1
1 167 . 5 1 1 A 22 22 GLU N N 22 120.159 117.135 3.024 1
1 168 . 5 1 1 A 23 23 GLY H H 23 8.246 8.663 -0.417 1
1 169 . 5 1 1 A 23 23 GLY HA2 H 23 4.162 3.847 0.315 1
1 170 . 5 1 1 A 23 23 GLY HA3 H 23 4.061 3.850 0.211 1
1 171 . 5 1 1 A 23 23 GLY CA C 23 44.801 46.873 -2.072 1
1 172 . 5 1 1 A 23 23 GLY N N 23 110.080 111.262 -1.182 1
1 173 . 5 1 1 A 24 24 PRO HA H 24 4.417 4.571 -0.154 1
1 178 . 5 1 1 A 24 24 PRO C C 24 177.135 176.163 0.972 1
1 179 . 5 1 1 A 24 24 PRO CA C 24 63.520 62.384 1.136 1
1 180 . 5 1 1 A 24 24 PRO CB C 24 32.124 32.783 -0.659 1
1 183 . 5 1 1 A 25 25 ARG H H 25 8.409 8.510 -0.101 1
1 184 . 5 1 1 A 25 25 ARG HA H 25 4.298 4.346 -0.048 1
1 187 . 5 1 1 A 25 25 ARG C C 25 176.217 175.788 0.429 1
1 188 . 5 1 1 A 25 25 ARG CA C 25 56.237 55.031 1.206 1
1 189 . 5 1 1 A 25 25 ARG CB C 25 30.467 31.456 -0.989 1
1 192 . 5 1 1 A 25 25 ARG N N 25 120.147 121.515 -1.368 1
1 193 . 5 1 1 A 26 26 GLN H H 26 8.278 8.215 0.063 1
1 194 . 5 1 1 A 26 26 GLN HA H 26 4.336 4.285 0.051 1
1 200 . 5 1 1 A 26 26 GLN C C 26 175.566 174.815 0.751 1
1 201 . 5 1 1 A 26 26 GLN CA C 26 55.788 56.368 -0.580 1
1 202 . 5 1 1 A 26 26 GLN CB C 26 29.714 29.035 0.679 1
1 204 . 5 1 1 A 26 26 GLN N N 26 120.460 124.176 -3.716 1
1 206 . 5 1 1 A 27 27 SER H H 27 8.298 8.720 -0.422 1
1 208 . 5 1 1 A 27 27 SER CA C 27 56.156 55.276 0.880 1
1 209 . 5 1 1 A 27 27 SER CB C 27 63.813 65.043 -1.230 1
1 210 . 5 1 1 A 27 27 SER N N 27 117.382 123.409 -6.027 1
1 211 . 5 1 1 A 28 28 PRO HA H 28 4.366 4.543 -0.177 1
1 216 . 5 1 1 A 28 28 PRO C C 28 177.555 177.735 -0.180 1
1 217 . 5 1 1 A 28 28 PRO CA C 28 64.486 63.971 0.515 1
1 218 . 5 1 1 A 28 28 PRO CB C 28 31.892 32.281 -0.389 1
1 221 . 5 1 1 A 29 29 GLU H H 29 8.582 7.954 0.628 1
1 222 . 5 1 1 A 29 29 GLU HA H 29 4.218 4.442 -0.224 1
1 226 . 5 1 1 A 29 29 GLU CA C 29 57.261 58.401 -1.140 1
1 227 . 5 1 1 A 29 29 GLU CB C 29 29.633 31.890 -2.257 1
1 229 . 5 1 1 A 29 29 GLU N N 29 118.309 117.212 1.097 1
1 230 . 5 1 1 A 30 30 LYS H H 30 7.955 7.912 0.043 1
1 231 . 5 1 1 A 30 30 LYS HA H 30 4.328 3.945 0.383 1
1 236 . 5 1 1 A 30 30 LYS C C 30 176.222 174.868 1.354 1
1 237 . 5 1 1 A 30 30 LYS CA C 30 56.247 57.034 -0.787 1
1 238 . 5 1 1 A 30 30 LYS CB C 30 32.720 30.164 2.556 1
1 242 . 5 1 1 A 30 30 LYS N N 30 120.129 118.653 1.476 1
1 243 . 5 1 1 A 31 31 SER H H 31 7.883 7.951 -0.068 1
1 244 . 5 1 1 A 31 31 SER HA H 31 4.458 5.215 -0.757 1
1 246 . 5 1 1 A 31 31 SER C C 31 174.129 175.166 -1.037 1
1 247 . 5 1 1 A 31 31 SER CA C 31 58.477 56.667 1.810 1
1 248 . 5 1 1 A 31 31 SER CB C 31 64.042 64.697 -0.655 1
1 249 . 5 1 1 A 31 31 SER N N 31 115.366 113.000 2.366 1
1 250 . 5 1 1 A 32 32 HIS H H 32 8.485 8.683 -0.198 1
1 251 . 5 1 1 A 32 32 HIS HA H 32 4.450 4.631 -0.181 1
1 255 . 5 1 1 A 32 32 HIS CA C 32 56.009 56.264 -0.255 1
1 256 . 5 1 1 A 32 32 HIS CB C 32 31.122 29.991 1.131 1
1 257 . 5 1 1 A 32 32 HIS N N 32 121.500 119.905 1.595 1
1 258 . 5 1 1 A 33 33 MET H H 33 8.392 7.498 0.894 1
1 259 . 5 1 1 A 33 33 MET HA H 33 4.601 4.558 0.043 1
1 265 . 5 1 1 A 33 33 MET C C 33 175.842 175.360 0.482 1
1 266 . 5 1 1 A 33 33 MET CA C 33 54.533 54.289 0.244 1
1 267 . 5 1 1 A 33 33 MET CB C 33 32.868 32.530 0.338 1
1 270 . 5 1 1 A 33 33 MET N N 33 120.204 120.550 -0.346 1
1 271 . 5 1 1 A 34 34 VAL H H 34 8.938 9.327 -0.389 1
1 272 . 5 1 1 A 34 34 VAL HA H 34 4.430 4.741 -0.311 1
1 280 . 5 1 1 A 34 34 VAL C C 34 174.149 174.747 -0.598 1
1 281 . 5 1 1 A 34 34 VAL CA C 34 60.703 59.530 1.173 1
1 282 . 5 1 1 A 34 34 VAL CB C 34 34.319 34.616 -0.297 1
1 285 . 5 1 1 A 34 34 VAL N N 34 118.512 123.297 -4.785 1
1 286 . 5 1 1 A 35 35 PHE H H 35 9.242 8.255 0.987 1
1 287 . 5 1 1 A 35 35 PHE HA H 35 4.439 5.289 -0.850 1
1 294 . 5 1 1 A 35 35 PHE C C 35 174.831 174.724 0.107 1
1 295 . 5 1 1 A 35 35 PHE CA C 35 57.754 55.315 2.439 1
1 296 . 5 1 1 A 35 35 PHE CB C 35 38.959 41.016 -2.057 1
1 297 . 5 1 1 A 35 35 PHE N N 35 124.912 126.088 -1.176 1
1 298 . 5 1 1 A 36 36 ARG H H 36 8.475 8.863 -0.388 1
1 299 . 5 1 1 A 36 36 ARG HA H 36 4.135 4.737 -0.602 1
1 304 . 5 1 1 A 36 36 ARG C C 36 172.865 175.481 -2.616 1
1 305 . 5 1 1 A 36 36 ARG CA C 36 56.895 55.554 1.341 1
1 306 . 5 1 1 A 36 36 ARG CB C 36 28.962 30.740 -1.778 1
1 308 . 5 1 1 A 36 36 ARG N N 36 125.680 121.601 4.079 1
1 309 . 5 1 1 A 37 37 VAL H H 37 8.066 8.889 -0.823 1
1 310 . 5 1 1 A 37 37 VAL HA H 37 4.292 4.491 -0.199 1
1 318 . 5 1 1 A 37 37 VAL C C 37 174.595 174.207 0.388 1
1 319 . 5 1 1 A 37 37 VAL CA C 37 62.727 61.240 1.487 1
1 320 . 5 1 1 A 37 37 VAL CB C 37 31.102 32.644 -1.542 1
1 323 . 5 1 1 A 37 37 VAL N N 37 125.403 121.646 3.757 1
1 324 . 5 1 1 A 38 38 GLU H H 38 9.532 8.755 0.777 1
1 325 . 5 1 1 A 38 38 GLU HA H 38 4.895 4.896 -0.001 1
1 329 . 5 1 1 A 38 38 GLU C C 38 174.509 175.231 -0.722 1
1 330 . 5 1 1 A 38 38 GLU CA C 38 55.650 55.335 0.315 1
1 331 . 5 1 1 A 38 38 GLU CB C 38 32.214 30.343 1.871 1
1 333 . 5 1 1 A 38 38 GLU N N 38 129.885 127.322 2.563 1
1 334 . 5 1 1 A 39 39 VAL H H 39 9.035 8.822 0.213 1
1 335 . 5 1 1 A 39 39 VAL HA H 39 4.446 4.681 -0.235 1
1 343 . 5 1 1 A 39 39 VAL C C 39 173.661 173.598 0.063 1
1 344 . 5 1 1 A 39 39 VAL CA C 39 61.258 61.284 -0.026 1
1 345 . 5 1 1 A 39 39 VAL CB C 39 33.533 33.071 0.462 1
1 348 . 5 1 1 A 39 39 VAL N N 39 127.941 127.130 0.811 1
1 349 . 5 1 1 A 40 40 LEU H H 40 8.843 9.485 -0.642 1
1 350 . 5 1 1 A 40 40 LEU HA H 40 5.130 5.347 -0.217 1
1 360 . 5 1 1 A 40 40 LEU C C 40 175.581 174.936 0.645 1
1 361 . 5 1 1 A 40 40 LEU CA C 40 53.702 53.580 0.122 1
1 362 . 5 1 1 A 40 40 LEU CB C 40 43.989 44.556 -0.567 1
1 366 . 5 1 1 A 40 40 LEU N N 40 128.413 129.608 -1.195 1
1 367 . 5 1 1 A 41 41 CYS H H 41 8.959 8.736 0.223 1
1 368 . 5 1 1 A 41 41 CYS HA H 41 5.174 5.023 0.151 1
1 371 . 5 1 1 A 41 41 CYS C C 41 175.043 173.856 1.187 1
1 372 . 5 1 1 A 41 41 CYS CA C 41 57.483 57.384 0.099 1
1 373 . 5 1 1 A 41 41 CYS CB C 41 28.472 29.148 -0.676 1
1 374 . 5 1 1 A 41 41 CYS N N 41 124.738 124.588 0.150 1
1 375 . 5 1 1 A 42 42 SER H H 42 9.527 9.357 0.170 1
1 376 . 5 1 1 A 42 42 SER HA H 42 4.149 4.870 -0.721 1
1 379 . 5 1 1 A 42 42 SER C C 42 175.014 174.585 0.429 1
1 380 . 5 1 1 A 42 42 SER CA C 42 59.058 59.334 -0.276 1
1 381 . 5 1 1 A 42 42 SER CB C 42 62.287 61.919 0.368 1
1 382 . 5 1 1 A 42 42 SER N N 42 125.889 117.728 8.161 1
1 383 . 5 1 1 A 43 43 GLY H H 43 8.685 8.482 0.203 1
1 384 . 5 1 1 A 43 43 GLY HA2 H 43 3.594 3.966 -0.372 1
1 385 . 5 1 1 A 43 43 GLY HA3 H 43 4.210 3.978 0.232 1
1 386 . 5 1 1 A 43 43 GLY C C 43 173.664 174.113 -0.449 1
1 387 . 5 1 1 A 43 43 GLY CA C 43 45.404 45.589 -0.185 1
1 388 . 5 1 1 A 43 43 GLY N N 43 104.633 105.070 -0.437 1
1 389 . 5 1 1 A 44 44 ARG H H 44 7.926 8.359 -0.433 1
1 390 . 5 1 1 A 44 44 ARG HA H 44 4.678 4.622 0.056 1
1 395 . 5 1 1 A 44 44 ARG C C 44 175.261 175.467 -0.206 1
1 396 . 5 1 1 A 44 44 ARG CA C 44 55.011 56.412 -1.401 1
1 397 . 5 1 1 A 44 44 ARG CB C 44 32.138 31.375 0.763 1
1 400 . 5 1 1 A 44 44 ARG N N 44 121.239 121.325 -0.086 1
1 401 . 5 1 1 A 45 45 ARG H H 45 8.775 9.565 -0.790 1
1 402 . 5 1 1 A 45 45 ARG HA H 45 5.770 5.143 0.627 1
1 409 . 5 1 1 A 45 45 ARG C C 45 176.064 175.300 0.764 1
1 410 . 5 1 1 A 45 45 ARG CA C 45 54.683 54.334 0.349 1
1 411 . 5 1 1 A 45 45 ARG CB C 45 33.748 33.460 0.288 1
1 414 . 5 1 1 A 45 45 ARG N N 45 125.948 120.995 4.953 1
1 415 . 5 1 1 A 46 46 HIS H H 46 8.912 8.544 0.368 1
1 416 . 5 1 1 A 46 46 HIS HA H 46 4.927 5.400 -0.473 1
1 420 . 5 1 1 A 46 46 HIS C C 46 172.634 173.307 -0.673 1
1 421 . 5 1 1 A 46 46 HIS CA C 46 56.480 53.661 2.819 1
1 422 . 5 1 1 A 46 46 HIS CB C 46 33.608 32.488 1.120 1
1 423 . 5 1 1 A 46 46 HIS N N 46 121.825 117.240 4.585 1
1 424 . 5 1 1 A 47 47 THR H H 47 8.532 8.817 -0.285 1
1 425 . 5 1 1 A 47 47 THR HA H 47 5.472 4.617 0.855 1
1 430 . 5 1 1 A 47 47 THR C C 47 174.442 173.711 0.731 1
1 431 . 5 1 1 A 47 47 THR CA C 47 61.093 61.106 -0.013 1
1 432 . 5 1 1 A 47 47 THR CB C 47 71.041 69.414 1.627 1
1 434 . 5 1 1 A 47 47 THR N N 47 115.450 114.776 0.674 1
1 435 . 5 1 1 A 48 48 VAL H H 48 9.695 9.343 0.352 1
1 436 . 5 1 1 A 48 48 VAL HA H 48 4.677 4.614 0.063 1
1 444 . 5 1 1 A 48 48 VAL CA C 48 58.172 59.492 -1.320 1
1 445 . 5 1 1 A 48 48 VAL CB C 48 34.990 32.287 2.703 1
1 448 . 5 1 1 A 48 48 VAL N N 48 126.721 127.501 -0.780 1
1 449 . 5 1 1 A 49 49 PRO HA H 49 5.087 5.233 -0.146 1
1 453 . 5 1 1 A 49 49 PRO CA C 49 61.671 62.175 -0.504 1
1 454 . 5 1 1 A 49 49 PRO CB C 49 31.923 31.723 0.200 1
1 457 . 5 1 1 A 50 50 ARG H H 50 9.125 8.649 0.476 1
1 458 . 5 1 1 A 50 50 ARG HA H 50 4.974 4.748 0.226 1
1 464 . 5 1 1 A 50 50 ARG C C 50 176.187 175.389 0.798 1
1 465 . 5 1 1 A 50 50 ARG CA C 50 53.015 54.223 -1.208 1
1 466 . 5 1 1 A 50 50 ARG CB C 50 36.553 34.413 2.140 1
1 468 . 5 1 1 A 50 50 ARG N N 50 124.189 124.166 0.023 1
1 469 . 5 1 1 A 51 51 ARG H H 51 10.105 8.578 1.527 1
1 470 . 5 1 1 A 51 51 ARG HA H 51 5.196 4.170 1.026 1
1 475 . 5 1 1 A 51 51 ARG C C 51 178.865 175.699 3.166 1
1 476 . 5 1 1 A 51 51 ARG CA C 51 55.961 54.458 1.503 1
1 477 . 5 1 1 A 51 51 ARG CB C 51 32.539 30.657 1.882 1
1 480 . 5 1 1 A 51 51 ARG N N 51 124.521 121.423 3.098 1
1 481 . 5 1 1 A 52 52 TYR H H 52 10.397 8.888 1.509 1
1 482 . 5 1 1 A 52 52 TYR HA H 52 4.360 4.333 0.027 1
1 487 . 5 1 1 A 52 52 TYR C C 52 178.143 177.975 0.168 1
1 488 . 5 1 1 A 52 52 TYR CA C 52 63.538 62.308 1.230 1
1 489 . 5 1 1 A 52 52 TYR CB C 52 38.784 38.671 0.113 1
1 490 . 5 1 1 A 52 52 TYR N N 52 124.772 121.059 3.713 1
1 491 . 5 1 1 A 53 53 SER H H 53 9.231 8.132 1.099 1
1 492 . 5 1 1 A 53 53 SER HA H 53 4.175 4.303 -0.128 1
1 493 . 5 1 1 A 53 53 SER C C 53 177.220 177.493 -0.273 1
1 494 . 5 1 1 A 53 53 SER CA C 53 61.606 61.609 -0.003 1
1 495 . 5 1 1 A 53 53 SER N N 53 113.262 114.792 -1.530 1
1 496 . 5 1 1 A 54 54 GLU H H 54 7.807 7.913 -0.106 1
1 497 . 5 1 1 A 54 54 GLU HA H 54 4.392 4.036 0.356 1
1 501 . 5 1 1 A 54 54 GLU C C 54 180.361 179.162 1.199 1
1 502 . 5 1 1 A 54 54 GLU CA C 54 59.497 59.490 0.007 1
1 503 . 5 1 1 A 54 54 GLU CB C 54 30.708 29.472 1.236 1
1 504 . 5 1 1 A 54 54 GLU N N 54 121.949 121.799 0.150 1
1 505 . 5 1 1 A 55 55 PHE H H 55 8.133 7.752 0.381 1
1 506 . 5 1 1 A 55 55 PHE HA H 55 4.007 4.120 -0.113 1
1 513 . 5 1 1 A 55 55 PHE C C 55 176.531 177.566 -1.035 1
1 514 . 5 1 1 A 55 55 PHE CA C 55 61.848 61.355 0.493 1
1 515 . 5 1 1 A 55 55 PHE CB C 55 38.847 38.917 -0.070 1
1 516 . 5 1 1 A 55 55 PHE N N 55 119.998 121.648 -1.650 1
1 517 . 5 1 1 A 56 56 HIS H H 56 7.907 7.921 -0.014 1
1 518 . 5 1 1 A 56 56 HIS HA H 56 3.324 3.952 -0.628 1
1 522 . 5 1 1 A 56 56 HIS C C 56 176.748 177.433 -0.685 1
1 523 . 5 1 1 A 56 56 HIS CA C 56 58.770 59.940 -1.170 1
1 524 . 5 1 1 A 56 56 HIS CB C 56 30.404 29.136 1.268 1
1 525 . 5 1 1 A 56 56 HIS N N 56 119.173 118.151 1.022 1
1 526 . 5 1 1 A 57 57 ALA H H 57 7.962 8.302 -0.340 1
1 527 . 5 1 1 A 57 57 ALA HA H 57 3.865 3.831 0.034 1
1 531 . 5 1 1 A 57 57 ALA C C 57 180.075 179.491 0.584 1
1 532 . 5 1 1 A 57 57 ALA CA C 57 54.996 55.093 -0.097 1
1 533 . 5 1 1 A 57 57 ALA CB C 57 18.226 18.619 -0.393 1
1 534 . 5 1 1 A 57 57 ALA N N 57 120.094 121.238 -1.144 1
1 535 . 5 1 1 A 58 58 LEU H H 58 7.295 7.776 -0.481 1
1 536 . 5 1 1 A 58 58 LEU HA H 58 3.994 3.867 0.127 1
1 546 . 5 1 1 A 58 58 LEU C C 58 177.428 178.538 -1.110 1
1 547 . 5 1 1 A 58 58 LEU CA C 58 58.342 57.770 0.572 1
1 548 . 5 1 1 A 58 58 LEU CB C 58 40.851 40.942 -0.091 1
1 552 . 5 1 1 A 58 58 LEU N N 58 119.404 117.325 2.079 1
1 553 . 5 1 1 A 59 59 HIS H H 59 7.805 7.895 -0.090 1
1 554 . 5 1 1 A 59 59 HIS HA H 59 4.286 3.793 0.493 1
1 558 . 5 1 1 A 59 59 HIS C C 59 177.001 177.224 -0.223 1
1 559 . 5 1 1 A 59 59 HIS CA C 59 60.141 60.005 0.136 1
1 560 . 5 1 1 A 59 59 HIS CB C 59 31.072 29.251 1.821 1
1 561 . 5 1 1 A 59 59 HIS N N 59 119.040 120.084 -1.044 1
1 562 . 5 1 1 A 60 60 LYS H H 60 7.715 8.034 -0.319 1
1 563 . 5 1 1 A 60 60 LYS HA H 60 3.456 3.798 -0.342 1
1 570 . 5 1 1 A 60 60 LYS C C 60 178.464 178.595 -0.131 1
1 571 . 5 1 1 A 60 60 LYS CA C 60 59.629 58.603 1.026 1
1 572 . 5 1 1 A 60 60 LYS CB C 60 32.354 31.373 0.981 1
1 576 . 5 1 1 A 60 60 LYS N N 60 114.225 117.836 -3.611 1
1 577 . 5 1 1 A 61 61 ARG H H 61 7.486 7.422 0.064 1
1 578 . 5 1 1 A 61 61 ARG HA H 61 4.202 3.996 0.206 1
1 584 . 5 1 1 A 61 61 ARG C C 61 178.995 178.709 0.286 1
1 585 . 5 1 1 A 61 61 ARG CA C 61 58.387 58.537 -0.150 1
1 586 . 5 1 1 A 61 61 ARG CB C 61 31.216 29.869 1.347 1
1 589 . 5 1 1 A 61 61 ARG N N 61 115.929 119.287 -3.358 1
1 590 . 5 1 1 A 62 62 ILE H H 62 8.066 7.907 0.159 1
1 591 . 5 1 1 A 62 62 ILE HA H 62 4.491 3.796 0.695 1
1 601 . 5 1 1 A 62 62 ILE C C 62 177.838 177.308 0.530 1
1 602 . 5 1 1 A 62 62 ILE CA C 62 63.399 63.190 0.209 1
1 603 . 5 1 1 A 62 62 ILE CB C 62 39.699 37.267 2.432 1
1 606 . 5 1 1 A 62 62 ILE N N 62 111.456 117.498 -6.042 1
1 607 . 5 1 1 A 63 63 LYS H H 63 8.158 8.481 -0.323 1
1 608 . 5 1 1 A 63 63 LYS HA H 63 4.136 3.878 0.258 1
1 615 . 5 1 1 A 63 63 LYS C C 63 176.358 178.556 -2.198 1
1 616 . 5 1 1 A 63 63 LYS CA C 63 58.753 58.627 0.126 1
1 617 . 5 1 1 A 63 63 LYS CB C 63 30.825 31.497 -0.672 1
1 621 . 5 1 1 A 63 63 LYS N N 63 120.800 123.751 -2.951 1
1 622 . 5 1 1 A 64 64 LYS H H 64 7.687 7.805 -0.118 1
1 623 . 5 1 1 A 64 64 LYS HA H 64 4.301 4.072 0.229 1
1 628 . 5 1 1 A 64 64 LYS C C 64 177.084 178.227 -1.143 1
1 629 . 5 1 1 A 64 64 LYS CA C 64 57.237 58.432 -1.195 1
1 630 . 5 1 1 A 64 64 LYS CB C 64 32.502 32.173 0.329 1
1 634 . 5 1 1 A 64 64 LYS N N 64 116.548 119.722 -3.174 1
1 635 . 5 1 1 A 65 65 LEU H H 65 7.476 7.878 -0.402 1
1 636 . 5 1 1 A 65 65 LEU HA H 65 4.219 4.334 -0.115 1
1 645 . 5 1 1 A 65 65 LEU C C 65 175.886 175.975 -0.089 1
1 646 . 5 1 1 A 65 65 LEU CA C 65 55.542 56.611 -1.069 1
1 647 . 5 1 1 A 65 65 LEU CB C 65 45.493 43.483 2.010 1
1 650 . 5 1 1 A 65 65 LEU N N 65 118.000 120.439 -2.439 1
1 651 . 5 1 1 A 66 66 TYR H H 66 7.672 8.255 -0.583 1
1 652 . 5 1 1 A 66 66 TYR HA H 66 4.762 5.242 -0.480 1
1 660 . 5 1 1 A 66 66 TYR C C 66 174.199 174.244 -0.045 1
1 661 . 5 1 1 A 66 66 TYR CA C 66 56.013 55.315 0.698 1
1 662 . 5 1 1 A 66 66 TYR CB C 66 40.380 41.156 -0.776 1
1 663 . 5 1 1 A 66 66 TYR N N 66 116.805 114.208 2.597 1
1 664 . 5 1 1 A 67 67 LYS H H 67 8.547 8.542 0.005 1
1 665 . 5 1 1 A 67 67 LYS HA H 67 4.436 4.657 -0.221 1
1 670 . 5 1 1 A 67 67 LYS C C 67 175.727 175.872 -0.145 1
1 671 . 5 1 1 A 67 67 LYS CA C 67 56.598 56.393 0.205 1
1 672 . 5 1 1 A 67 67 LYS CB C 67 32.743 33.086 -0.343 1
1 676 . 5 1 1 A 67 67 LYS N N 67 120.929 120.225 0.704 1
1 677 . 5 1 1 A 68 68 VAL H H 68 8.168 8.570 -0.402 1
1 678 . 5 1 1 A 68 68 VAL HA H 68 4.869 4.849 0.020 1
1 686 . 5 1 1 A 68 68 VAL CA C 68 57.389 57.912 -0.523 1
1 687 . 5 1 1 A 68 68 VAL CB C 68 34.017 35.382 -1.365 1
1 690 . 5 1 1 A 68 68 VAL N N 68 116.467 122.772 -6.305 1
1 691 . 5 1 1 A 69 69 PRO HA H 69 4.674 4.702 -0.028 1
1 696 . 5 1 1 A 69 69 PRO C C 69 178.013 176.357 1.656 1
1 697 . 5 1 1 A 69 69 PRO CA C 69 61.443 62.377 -0.934 1
1 698 . 5 1 1 A 69 69 PRO CB C 69 32.231 33.105 -0.874 1
1 701 . 5 1 1 A 70 70 ASP H H 70 8.167 8.584 -0.417 1
1 702 . 5 1 1 A 70 70 ASP HA H 70 4.531 4.746 -0.215 1
1 705 . 5 1 1 A 70 70 ASP C C 70 175.660 176.492 -0.832 1
1 706 . 5 1 1 A 70 70 ASP CA C 70 55.148 54.989 0.159 1
1 707 . 5 1 1 A 70 70 ASP CB C 70 40.876 41.564 -0.688 1
1 708 . 5 1 1 A 70 70 ASP N N 70 116.671 121.507 -4.836 1
1 709 . 5 1 1 A 71 71 PHE H H 71 8.387 8.279 0.108 1
1 710 . 5 1 1 A 71 71 PHE HA H 71 4.076 4.372 -0.296 1
1 717 . 5 1 1 A 71 71 PHE CA C 71 55.672 54.178 1.494 1
1 718 . 5 1 1 A 71 71 PHE CB C 71 39.155 40.369 -1.214 1
1 719 . 5 1 1 A 71 71 PHE N N 71 126.533 117.864 8.669 1
1 720 . 5 1 1 A 72 72 PRO HA H 72 4.156 4.212 -0.056 1
1 727 . 5 1 1 A 72 72 PRO CA C 72 63.079 63.103 -0.024 1
1 728 . 5 1 1 A 72 72 PRO CB C 72 32.107 31.661 0.446 1
1 731 . 5 1 1 A 73 73 SER H H 73 8.468 8.680 -0.212 1
1 733 . 5 1 1 A 73 73 SER CA C 73 56.133 57.381 -1.248 1
1 734 . 5 1 1 A 73 73 SER CB C 73 63.991 64.147 -0.156 1
1 735 . 5 1 1 A 73 73 SER N N 73 121.533 117.563 3.970 1
1 736 . 5 1 1 A 74 74 LYS HA H 74 4.574 3.995 0.579 1
1 739 . 5 1 1 A 74 74 LYS CA C 74 55.659 58.209 -2.550 1
1 740 . 5 1 1 A 74 74 LYS CB C 74 30.550 32.649 -2.099 1
1 741 . 5 1 1 A 75 75 ARG H H 75 7.962 7.786 0.176 1
1 742 . 5 1 1 A 75 75 ARG HA H 75 4.162 4.529 -0.367 1
1 746 . 5 1 1 A 75 75 ARG CA C 75 56.123 55.831 0.292 1
1 747 . 5 1 1 A 75 75 ARG CB C 75 31.179 30.986 0.193 1
1 749 . 5 1 1 A 75 75 ARG N N 75 121.665 118.645 3.020 1
1 750 . 5 1 1 A 76 76 LEU H H 76 8.071 8.320 -0.249 1
1 751 . 5 1 1 A 76 76 LEU HA H 76 4.618 4.802 -0.184 1
1 759 . 5 1 1 A 76 76 LEU CA C 76 52.764 51.660 1.104 1
1 760 . 5 1 1 A 76 76 LEU CB C 76 41.918 45.311 -3.393 1
1 762 . 5 1 1 A 76 76 LEU N N 76 124.196 125.449 -1.253 1
1 763 . 5 1 1 A 77 77 PRO HA H 77 4.393 4.536 -0.143 1
1 767 . 5 1 1 A 77 77 PRO CA C 77 63.746 62.677 1.069 1
1 770 . 5 1 1 A 78 78 ASN H H 78 8.379 8.909 -0.530 1
1 771 . 5 1 1 A 78 78 ASN HA H 78 4.586 4.608 -0.022 1
1 776 . 5 1 1 A 78 78 ASN C C 78 175.648 175.218 0.430 1
1 777 . 5 1 1 A 78 78 ASN CA C 78 53.591 53.356 0.235 1
1 778 . 5 1 1 A 78 78 ASN CB C 78 37.826 38.855 -1.029 1
1 779 . 5 1 1 A 78 78 ASN N N 78 115.292 120.677 -5.385 1
1 781 . 5 1 1 A 79 79 TRP H H 79 7.900 8.328 -0.428 1
1 782 . 5 1 1 A 79 79 TRP HA H 79 4.326 4.602 -0.276 1
1 788 . 5 1 1 A 79 79 TRP CA C 79 58.825 58.947 -0.122 1
1 789 . 5 1 1 A 79 79 TRP CB C 79 29.090 29.193 -0.103 1
1 790 . 5 1 1 A 79 79 TRP N N 79 119.525 119.952 -0.427 1
1 792 . 5 1 1 A 80 80 ARG H H 80 8.060 8.480 -0.420 1
1 793 . 5 1 1 A 80 80 ARG HA H 80 3.913 3.811 0.102 1
1 798 . 5 1 1 A 80 80 ARG C C 80 177.024 178.658 -1.634 1
1 799 . 5 1 1 A 80 80 ARG CA C 80 58.292 59.190 -0.898 1
1 800 . 5 1 1 A 80 80 ARG CB C 80 30.146 29.812 0.334 1
1 803 . 5 1 1 A 80 80 ARG N N 80 118.864 117.891 0.973 1
1 804 . 5 1 1 A 81 81 THR H H 81 7.725 7.497 0.228 1
1 805 . 5 1 1 A 81 81 THR HA H 81 4.297 3.988 0.309 1
1 809 . 5 1 1 A 81 81 THR CA C 81 62.481 65.954 -3.473 1
1 811 . 5 1 1 A 81 81 THR N N 81 109.863 115.583 -5.720 1
1 812 . 5 1 1 A 82 82 ARG HA H 82 4.341 4.563 -0.222 1
1 816 . 5 1 1 A 82 82 ARG C C 82 177.261 174.851 2.410 1
1 817 . 5 1 1 A 82 82 ARG CA C 82 56.846 53.540 3.306 1
1 818 . 5 1 1 A 82 82 ARG CB C 82 30.288 33.078 -2.790 1
1 820 . 5 1 1 A 83 83 GLY H H 83 8.321 8.639 -0.318 1
1 821 . 5 1 1 A 83 83 GLY HA2 H 83 3.957 4.160 -0.203 1
1 822 . 5 1 1 A 83 83 GLY C C 83 175.185 175.127 0.058 1
1 823 . 5 1 1 A 83 83 GLY CA C 83 46.297 43.373 2.924 1
1 824 . 5 1 1 A 83 83 GLY N N 83 109.146 107.323 1.823 1
1 825 . 5 1 1 A 84 84 LEU H H 84 8.303 9.034 -0.731 1
1 826 . 5 1 1 A 84 84 LEU HA H 84 4.018 4.403 -0.385 1
1 835 . 5 1 1 A 84 84 LEU C C 84 178.552 178.879 -0.327 1
1 836 . 5 1 1 A 84 84 LEU CA C 84 58.236 57.498 0.738 1
1 837 . 5 1 1 A 84 84 LEU CB C 84 41.837 41.639 0.198 1
1 840 . 5 1 1 A 84 84 LEU N N 84 122.662 120.346 2.316 1
1 841 . 5 1 1 A 85 85 GLU H H 85 8.233 8.423 -0.190 1
1 842 . 5 1 1 A 85 85 GLU HA H 85 4.371 3.985 0.386 1
1 846 . 5 1 1 A 85 85 GLU C C 85 178.555 179.023 -0.468 1
1 847 . 5 1 1 A 85 85 GLU CA C 85 58.377 59.663 -1.286 1
1 848 . 5 1 1 A 85 85 GLU CB C 85 28.675 29.293 -0.618 1
1 850 . 5 1 1 A 85 85 GLU N N 85 119.781 119.492 0.289 1
1 851 . 5 1 1 A 86 86 GLN H H 86 7.877 7.650 0.227 1
1 852 . 5 1 1 A 86 86 GLN HA H 86 4.100 4.023 0.077 1
1 858 . 5 1 1 A 86 86 GLN C C 86 179.557 178.309 1.248 1
1 859 . 5 1 1 A 86 86 GLN CA C 86 58.955 59.255 -0.300 1
1 860 . 5 1 1 A 86 86 GLN CB C 86 28.191 28.509 -0.318 1
1 862 . 5 1 1 A 86 86 GLN N N 86 118.042 119.473 -1.431 1
1 863 . 5 1 1 A 87 87 ARG H H 87 8.169 8.469 -0.300 1
1 864 . 5 1 1 A 87 87 ARG HA H 87 3.975 4.139 -0.164 1
1 868 . 5 1 1 A 87 87 ARG C C 87 177.051 178.497 -1.446 1
1 869 . 5 1 1 A 87 87 ARG CA C 87 59.006 59.697 -0.691 1
1 870 . 5 1 1 A 87 87 ARG CB C 87 30.383 29.667 0.716 1
1 872 . 5 1 1 A 87 87 ARG N N 87 121.381 119.933 1.448 1
1 873 . 5 1 1 A 88 88 ARG H H 88 8.593 8.129 0.464 1
1 874 . 5 1 1 A 88 88 ARG HA H 88 3.726 3.756 -0.030 1
1 876 . 5 1 1 A 88 88 ARG C C 88 177.520 178.593 -1.073 1
1 877 . 5 1 1 A 88 88 ARG CA C 88 60.751 59.342 1.409 1
1 878 . 5 1 1 A 88 88 ARG CB C 88 30.153 29.959 0.194 1
1 879 . 5 1 1 A 88 88 ARG N N 88 120.863 119.187 1.676 1
1 880 . 5 1 1 A 89 89 GLN H H 89 8.355 7.686 0.669 1
1 881 . 5 1 1 A 89 89 GLN HA H 89 3.887 3.973 -0.086 1
1 887 . 5 1 1 A 89 89 GLN C C 89 179.499 178.298 1.201 1
1 888 . 5 1 1 A 89 89 GLN CA C 89 59.603 59.268 0.335 1
1 889 . 5 1 1 A 89 89 GLN CB C 89 28.464 28.059 0.405 1
1 891 . 5 1 1 A 89 89 GLN N N 89 116.860 119.036 -2.176 1
1 893 . 5 1 1 A 90 90 GLY H H 90 8.406 8.358 0.048 1
1 894 . 5 1 1 A 90 90 GLY HA2 H 90 3.672 3.524 0.148 1
1 895 . 5 1 1 A 90 90 GLY HA3 H 90 3.871 3.580 0.291 1
1 896 . 5 1 1 A 90 90 GLY C C 90 177.033 175.457 1.576 1
1 897 . 5 1 1 A 90 90 GLY CA C 90 46.813 47.139 -0.326 1
1 898 . 5 1 1 A 90 90 GLY N N 90 107.679 107.388 0.291 1
1 899 . 5 1 1 A 91 91 LEU H H 91 8.504 8.137 0.367 1
1 900 . 5 1 1 A 91 91 LEU HA H 91 3.784 4.003 -0.219 1
1 910 . 5 1 1 A 91 91 LEU C C 91 178.003 179.078 -1.075 1
1 911 . 5 1 1 A 91 91 LEU CA C 91 57.354 57.463 -0.109 1
1 912 . 5 1 1 A 91 91 LEU CB C 91 40.359 40.962 -0.603 1
1 916 . 5 1 1 A 91 91 LEU N N 91 123.959 121.400 2.559 1
1 917 . 5 1 1 A 92 92 GLU H H 92 8.324 8.334 -0.010 1
1 918 . 5 1 1 A 92 92 GLU HA H 92 3.732 3.828 -0.096 1
1 922 . 5 1 1 A 92 92 GLU C C 92 177.272 178.500 -1.228 1
1 923 . 5 1 1 A 92 92 GLU CA C 92 60.651 59.633 1.018 1
1 924 . 5 1 1 A 92 92 GLU CB C 92 30.843 29.085 1.758 1
1 926 . 5 1 1 A 92 92 GLU N N 92 121.991 121.253 0.738 1
1 927 . 5 1 1 A 93 93 ALA H H 93 8.126 7.574 0.552 1
1 928 . 5 1 1 A 93 93 ALA HA H 93 4.160 4.011 0.149 1
1 932 . 5 1 1 A 93 93 ALA C C 93 180.818 179.099 1.719 1
1 933 . 5 1 1 A 93 93 ALA CA C 93 54.828 54.783 0.045 1
1 934 . 5 1 1 A 93 93 ALA CB C 93 18.032 18.178 -0.146 1
1 935 . 5 1 1 A 93 93 ALA N N 93 120.066 121.486 -1.420 1
1 936 . 5 1 1 A 94 94 TYR H H 94 7.916 7.513 0.403 1
1 937 . 5 1 1 A 94 94 TYR HA H 94 4.139 4.355 -0.216 1
1 942 . 5 1 1 A 94 94 TYR C C 94 175.895 178.383 -2.488 1
1 943 . 5 1 1 A 94 94 TYR CA C 94 61.915 61.749 0.166 1
1 944 . 5 1 1 A 94 94 TYR CB C 94 38.740 38.250 0.490 1
1 945 . 5 1 1 A 94 94 TYR N N 94 121.179 116.179 5.000 1
1 946 . 5 1 1 A 95 95 ILE H H 95 7.983 8.243 -0.260 1
1 947 . 5 1 1 A 95 95 ILE HA H 95 3.614 3.662 -0.048 1
1 957 . 5 1 1 A 95 95 ILE C C 95 174.678 177.882 -3.204 1
1 958 . 5 1 1 A 95 95 ILE CA C 95 63.461 65.176 -1.715 1
1 959 . 5 1 1 A 95 95 ILE CB C 95 36.625 37.712 -1.087 1
1 963 . 5 1 1 A 95 95 ILE N N 95 116.397 120.150 -3.753 1
1 964 . 5 1 1 A 96 96 GLN H H 96 8.175 8.780 -0.605 1
1 965 . 5 1 1 A 96 96 GLN HA H 96 3.763 3.948 -0.185 1
1 970 . 5 1 1 A 96 96 GLN C C 96 179.042 178.698 0.344 1
1 971 . 5 1 1 A 96 96 GLN CA C 96 59.270 59.965 -0.695 1
1 972 . 5 1 1 A 96 96 GLN CB C 96 27.696 27.932 -0.236 1
1 974 . 5 1 1 A 96 96 GLN N N 96 116.631 120.467 -3.836 1
1 976 . 5 1 1 A 97 97 GLY H H 97 8.222 8.414 -0.192 1
1 977 . 5 1 1 A 97 97 GLY HA2 H 97 3.661 3.813 -0.152 1
1 978 . 5 1 1 A 97 97 GLY HA3 H 97 3.806 3.820 -0.014 1
1 979 . 5 1 1 A 97 97 GLY C C 97 175.449 176.145 -0.696 1
1 980 . 5 1 1 A 97 97 GLY CA C 97 46.917 47.407 -0.490 1
1 981 . 5 1 1 A 97 97 GLY N N 97 107.315 107.036 0.279 1
1 982 . 5 1 1 A 98 98 ILE H H 98 7.630 8.006 -0.376 1
1 983 . 5 1 1 A 98 98 ILE HA H 98 3.399 3.992 -0.593 1
1 993 . 5 1 1 A 98 98 ILE C C 98 178.683 177.783 0.900 1
1 994 . 5 1 1 A 98 98 ILE CA C 98 66.402 64.790 1.612 1
1 995 . 5 1 1 A 98 98 ILE CB C 98 38.037 37.371 0.666 1
1 999 . 5 1 1 A 98 98 ILE N N 98 120.644 120.096 0.548 1
1 1000 . 5 1 1 A 99 99 LEU H H 99 7.076 7.638 -0.562 1
1 1001 . 5 1 1 A 99 99 LEU HA H 99 4.133 4.043 0.090 1
1 1010 . 5 1 1 A 99 99 LEU C C 99 178.128 178.261 -0.133 1
1 1011 . 5 1 1 A 99 99 LEU CA C 99 57.129 57.733 -0.604 1
1 1012 . 5 1 1 A 99 99 LEU CB C 99 41.108 41.923 -0.815 1
1 1014 . 5 1 1 A 99 99 LEU N N 99 116.844 124.018 -7.174 1
1 1015 . 5 1 1 A 100 100 TYR H H 100 7.890 8.673 -0.783 1
1 1016 . 5 1 1 A 100 100 TYR HA H 100 4.550 4.183 0.367 1
1 1021 . 5 1 1 A 100 100 TYR C C 100 178.210 177.437 0.773 1
1 1022 . 5 1 1 A 100 100 TYR CA C 100 59.452 61.332 -1.880 1
1 1023 . 5 1 1 A 100 100 TYR CB C 100 38.786 38.732 0.054 1
1 1024 . 5 1 1 A 100 100 TYR N N 100 116.427 120.162 -3.735 1
1 1025 . 5 1 1 A 101 101 LEU H H 101 8.041 8.424 -0.383 1
1 1026 . 5 1 1 A 101 101 LEU HA H 101 4.158 3.848 0.310 1
1 1036 . 5 1 1 A 101 101 LEU C C 101 176.808 177.038 -0.230 1
1 1037 . 5 1 1 A 101 101 LEU CA C 101 56.156 58.173 -2.017 1
1 1038 . 5 1 1 A 101 101 LEU CB C 101 44.307 41.741 2.566 1
1 1041 . 5 1 1 A 101 101 LEU N N 101 116.493 120.698 -4.205 1
1 1042 . 5 1 1 A 102 102 ASN H H 102 7.146 7.516 -0.370 1
1 1043 . 5 1 1 A 102 102 ASN HA H 102 5.056 5.020 0.036 1
1 1046 . 5 1 1 A 102 102 ASN CA C 102 52.704 54.685 -1.981 1
1 1047 . 5 1 1 A 102 102 ASN CB C 102 42.424 40.395 2.029 1
1 1048 . 5 1 1 A 102 102 ASN N N 102 114.922 112.580 2.342 1
1 1049 . 5 1 1 A 103 103 GLN H H 103 8.477 8.385 0.092 1
1 1050 . 5 1 1 A 103 103 GLN HA H 103 3.866 3.892 -0.026 1
1 1054 . 5 1 1 A 103 103 GLN C C 103 176.110 176.025 0.085 1
1 1055 . 5 1 1 A 103 103 GLN CA C 103 58.451 57.471 0.980 1
1 1056 . 5 1 1 A 103 103 GLN CB C 103 28.896 28.498 0.398 1
1 1058 . 5 1 1 A 103 103 GLN N N 103 120.252 118.952 1.300 1
1 1059 . 5 1 1 A 104 104 GLU H H 104 7.930 7.884 0.046 1
1 1060 . 5 1 1 A 104 104 GLU HA H 104 4.591 3.910 0.681 1
1 1064 . 5 1 1 A 104 104 GLU C C 104 175.397 175.508 -0.111 1
1 1065 . 5 1 1 A 104 104 GLU CA C 104 54.058 58.895 -4.837 1
1 1066 . 5 1 1 A 104 104 GLU CB C 104 31.272 28.186 3.086 1
1 1068 . 5 1 1 A 104 104 GLU N N 104 117.295 116.933 0.362 1
1 1069 . 5 1 1 A 105 105 VAL H H 105 8.546 7.854 0.692 1
1 1070 . 5 1 1 A 105 105 VAL HA H 105 3.823 4.552 -0.729 1
1 1078 . 5 1 1 A 105 105 VAL CA C 105 60.706 58.524 2.182 1
1 1079 . 5 1 1 A 105 105 VAL CB C 105 32.126 33.672 -1.546 1
1 1082 . 5 1 1 A 105 105 VAL N N 105 124.511 120.555 3.956 1
1 1083 . 5 1 1 A 106 106 PRO HA H 106 3.997 4.585 -0.588 1
1 1089 . 5 1 1 A 106 106 PRO C C 106 178.240 177.970 0.270 1
1 1090 . 5 1 1 A 106 106 PRO CA C 106 62.961 63.435 -0.474 1
1 1091 . 5 1 1 A 106 106 PRO CB C 106 32.321 32.239 0.082 1
1 1094 . 5 1 1 A 107 107 LYS H H 107 9.122 9.050 0.072 1
1 1095 . 5 1 1 A 107 107 LYS HA H 107 3.813 4.012 -0.199 1
1 1101 . 5 1 1 A 107 107 LYS C C 107 178.563 177.679 0.884 1
1 1102 . 5 1 1 A 107 107 LYS CA C 107 60.085 59.439 0.646 1
1 1103 . 5 1 1 A 107 107 LYS CB C 107 31.632 32.475 -0.843 1
1 1106 . 5 1 1 A 107 107 LYS N N 107 129.017 125.083 3.934 1
1 1107 . 5 1 1 A 108 108 GLU H H 108 10.370 8.062 2.308 1
1 1108 . 5 1 1 A 108 108 GLU HA H 108 3.991 4.182 -0.191 1
1 1111 . 5 1 1 A 108 108 GLU C C 108 180.366 179.181 1.185 1
1 1112 . 5 1 1 A 108 108 GLU CA C 108 60.337 58.965 1.372 1
1 1113 . 5 1 1 A 108 108 GLU CB C 108 29.178 29.627 -0.449 1
1 1115 . 5 1 1 A 108 108 GLU N N 108 118.335 119.035 -0.700 1
1 1116 . 5 1 1 A 109 109 LEU H H 109 7.393 7.884 -0.491 1
1 1117 . 5 1 1 A 109 109 LEU HA H 109 4.220 4.165 0.055 1
1 1126 . 5 1 1 A 109 109 LEU C C 109 177.378 179.948 -2.570 1
1 1127 . 5 1 1 A 109 109 LEU CA C 109 56.618 58.129 -1.511 1
1 1128 . 5 1 1 A 109 109 LEU CB C 109 41.898 41.523 0.375 1
1 1131 . 5 1 1 A 109 109 LEU N N 109 118.285 120.605 -2.320 1
1 1132 . 5 1 1 A 110 110 LEU H H 110 7.641 8.075 -0.434 1
1 1133 . 5 1 1 A 110 110 LEU HA H 110 3.796 3.924 -0.128 1
1 1142 . 5 1 1 A 110 110 LEU C C 110 179.103 178.508 0.595 1
1 1143 . 5 1 1 A 110 110 LEU CA C 110 59.046 57.906 1.140 1
1 1144 . 5 1 1 A 110 110 LEU CB C 110 40.228 40.810 -0.582 1
1 1147 . 5 1 1 A 110 110 LEU N N 110 120.162 119.929 0.233 1
1 1148 . 5 1 1 A 111 111 GLU H H 111 7.916 7.978 -0.062 1
1 1149 . 5 1 1 A 111 111 GLU HA H 111 4.080 4.085 -0.005 1
1 1153 . 5 1 1 A 111 111 GLU C C 111 179.967 178.819 1.148 1
1 1154 . 5 1 1 A 111 111 GLU CA C 111 59.243 58.942 0.301 1
1 1155 . 5 1 1 A 111 111 GLU CB C 111 29.576 29.382 0.194 1
1 1157 . 5 1 1 A 111 111 GLU N N 111 117.360 120.324 -2.964 1
1 1158 . 5 1 1 A 112 112 PHE H H 112 7.712 7.952 -0.240 1
1 1159 . 5 1 1 A 112 112 PHE HA H 112 4.224 4.175 0.049 1
1 1164 . 5 1 1 A 112 112 PHE C C 112 177.180 177.231 -0.051 1
1 1165 . 5 1 1 A 112 112 PHE CA C 112 61.407 61.122 0.285 1
1 1166 . 5 1 1 A 112 112 PHE CB C 112 40.172 39.576 0.596 1
1 1167 . 5 1 1 A 112 112 PHE N N 112 123.042 120.869 2.173 1
1 1168 . 5 1 1 A 113 113 LEU H H 113 8.056 8.189 -0.133 1
1 1169 . 5 1 1 A 113 113 LEU HA H 113 4.147 4.350 -0.203 1
1 1175 . 5 1 1 A 113 113 LEU C C 113 173.717 176.150 -2.433 1
1 1176 . 5 1 1 A 113 113 LEU CA C 113 54.093 54.667 -0.574 1
1 1177 . 5 1 1 A 113 113 LEU CB C 113 41.517 42.028 -0.511 1
1 1179 . 5 1 1 A 113 113 LEU N N 113 115.595 117.396 -1.801 1
1 1180 . 5 1 1 A 114 114 ARG H H 114 7.902 7.918 -0.016 1
1 1181 . 5 1 1 A 114 114 ARG HA H 114 3.817 4.360 -0.543 1
1 1182 . 5 1 1 A 114 114 ARG C C 114 174.566 174.964 -0.398 1
1 1183 . 5 1 1 A 114 114 ARG CA C 114 57.233 57.022 0.211 1
1 1184 . 5 1 1 A 114 114 ARG CB C 114 27.788 27.400 0.388 1
1 1185 . 5 1 1 A 114 114 ARG N N 114 116.021 116.961 -0.940 1
1 1186 . 5 1 1 A 115 115 LEU H H 115 8.160 7.844 0.316 1
1 1187 . 5 1 1 A 115 115 LEU HA H 115 4.462 4.333 0.129 1
1 1195 . 5 1 1 A 115 115 LEU C C 115 176.374 176.149 0.225 1
1 1196 . 5 1 1 A 115 115 LEU CA C 115 53.965 53.528 0.437 1
1 1197 . 5 1 1 A 115 115 LEU CB C 115 44.077 42.709 1.368 1
1 1199 . 5 1 1 A 115 115 LEU N N 115 118.089 120.026 -1.937 1
1 1200 . 5 1 1 A 116 116 ARG H H 116 8.066 8.270 -0.204 1
1 1201 . 5 1 1 A 116 116 ARG HA H 116 4.172 4.401 -0.229 1
1 1203 . 5 1 1 A 116 116 ARG CA C 116 55.961 54.366 1.595 1
1 1204 . 5 1 1 A 116 116 ARG CB C 116 31.379 31.066 0.313 1
1 1205 . 5 1 1 A 116 116 ARG N N 116 120.852 122.639 -1.787 1
1 1206 . 5 1 1 A 117 117 HIS H H 117 7.928 8.349 -0.421 1
1 1207 . 5 1 1 A 117 117 HIS HA H 117 4.557 4.496 0.061 1
1 1211 . 5 1 1 A 117 117 HIS CA C 117 55.937 56.178 -0.241 1
1 1212 . 5 1 1 A 117 117 HIS CB C 117 30.875 29.318 1.557 1
1 1213 . 5 1 1 A 118 118 PHE H H 118 8.183 8.720 -0.537 1
1 1214 . 5 1 1 A 118 118 PHE HA H 118 4.730 4.379 0.351 1
1 1219 . 5 1 1 A 118 118 PHE CA C 118 55.716 57.846 -2.130 1
1 1220 . 5 1 1 A 118 118 PHE CB C 118 39.263 38.828 0.435 1
1 1221 . 5 1 1 A 118 118 PHE N N 118 123.480 125.091 -1.611 1
1 1222 . 5 1 1 A 119 119 PRO HA H 119 4.398 4.619 -0.221 1
1 1227 . 5 1 1 A 119 119 PRO C C 119 176.666 175.399 1.267 1
1 1228 . 5 1 1 A 119 119 PRO CA C 119 63.377 64.041 -0.664 1
1 1229 . 5 1 1 A 119 119 PRO CB C 119 32.059 31.938 0.121 1
1 1232 . 5 1 1 A 120 120 THR H H 120 8.054 7.307 0.747 1
1 1233 . 5 1 1 A 120 120 THR HA H 120 4.273 4.916 -0.643 1
1 1238 . 5 1 1 A 120 120 THR C C 120 174.154 172.534 1.620 1
1 1239 . 5 1 1 A 120 120 THR CA C 120 61.893 59.337 2.556 1
1 1240 . 5 1 1 A 120 120 THR CB C 120 69.736 71.998 -2.262 1
1 1242 . 5 1 1 A 120 120 THR N N 120 113.088 107.812 5.276 1
1 1243 . 5 1 1 A 121 121 ASP H H 121 8.209 8.646 -0.437 1
1 1244 . 5 1 1 A 121 121 ASP HA H 121 4.876 4.858 0.018 1
1 1247 . 5 1 1 A 121 121 ASP CA C 121 52.126 51.193 0.933 1
1 1248 . 5 1 1 A 121 121 ASP CB C 121 41.553 42.067 -0.514 1
1 1249 . 5 1 1 A 121 121 ASP N N 121 123.630 123.216 0.414 1
1 1250 . 5 1 1 A 122 122 PRO HA H 122 4.363 4.605 -0.242 1
1 1255 . 5 1 1 A 122 122 PRO C C 122 177.344 176.029 1.315 1
1 1256 . 5 1 1 A 122 122 PRO CA C 122 63.913 63.773 0.140 1
1 1257 . 5 1 1 A 122 122 PRO CB C 122 32.116 32.018 0.098 1
1 1260 . 5 1 1 A 123 123 LYS H H 123 8.344 7.558 0.786 1
1 1261 . 5 1 1 A 123 123 LYS HA H 123 4.244 4.844 -0.600 1
1 1266 . 5 1 1 A 123 123 LYS C C 123 176.637 174.136 2.501 1
1 1267 . 5 1 1 A 123 123 LYS CA C 123 56.359 55.245 1.114 1
1 1268 . 5 1 1 A 123 123 LYS CB C 123 32.367 35.315 -2.948 1
1 1272 . 5 1 1 A 123 123 LYS N N 123 119.110 119.698 -0.588 1
1 1273 . 5 1 1 A 124 124 ALA H H 124 7.929 8.973 -1.044 1
1 1274 . 5 1 1 A 124 124 ALA HA H 124 4.248 5.121 -0.873 1
1 1278 . 5 1 1 A 124 124 ALA C C 124 177.648 176.046 1.602 1
1 1279 . 5 1 1 A 124 124 ALA CA C 124 52.618 50.523 2.095 1
1 1280 . 5 1 1 A 124 124 ALA CB C 124 19.379 19.897 -0.518 1
1 1281 . 5 1 1 A 124 124 ALA N N 124 123.825 131.119 -7.294 1
1 1282 . 5 1 1 A 125 125 SER H H 125 8.134 8.935 -0.801 1
1 1283 . 5 1 1 A 125 125 SER HA H 125 4.341 5.217 -0.876 1
1 1286 . 5 1 1 A 125 125 SER C C 125 174.172 172.418 1.754 1
1 1287 . 5 1 1 A 125 125 SER CA C 125 58.391 57.542 0.849 1
1 1288 . 5 1 1 A 125 125 SER CB C 125 63.748 66.808 -3.060 1
1 1289 . 5 1 1 A 125 125 SER N N 125 114.454 116.925 -2.471 1
1 1290 . 5 1 1 A 126 126 ASN H H 126 8.242 8.921 -0.679 1
1 1291 . 5 1 1 A 126 126 ASN HA H 126 4.657 5.487 -0.830 1
1 1294 . 5 1 1 A 126 126 ASN C C 126 174.624 173.359 1.265 1
1 1295 . 5 1 1 A 126 126 ASN CA C 126 53.292 51.896 1.396 1
1 1296 . 5 1 1 A 126 126 ASN CB C 126 38.797 42.411 -3.614 1
1 1297 . 5 1 1 A 126 126 ASN N N 126 120.102 120.087 0.015 1
1 1298 . 5 1 1 A 127 127 TRP H H 127 8.051 9.090 -1.039 1
1 1299 . 5 1 1 A 127 127 TRP HA H 127 4.694 5.087 -0.393 1
1 1302 . 5 1 1 A 127 127 TRP C C 127 175.479 175.662 -0.183 1
1 1303 . 5 1 1 A 127 127 TRP CA C 127 57.096 56.194 0.902 1
1 1304 . 5 1 1 A 127 127 TRP CB C 127 29.820 30.145 -0.325 1
1 1305 . 5 1 1 A 127 127 TRP N N 127 121.198 129.230 -8.032 1
1 1 . 6 1 1 A 7 7 HIS HA H 7 4.623 4.846 -0.223 1
1 4 . 6 1 1 A 7 7 HIS C C 7 174.747 174.566 0.181 1
1 5 . 6 1 1 A 7 7 HIS CA C 7 56.189 53.803 2.386 1
1 6 . 6 1 1 A 7 7 HIS CB C 7 30.028 31.733 -1.705 1
1 7 . 6 1 1 A 8 8 LEU H H 8 8.283 8.540 -0.257 1
1 8 . 6 1 1 A 8 8 LEU HA H 8 4.249 4.091 0.158 1
1 10 . 6 1 1 A 8 8 LEU C C 8 176.700 175.956 0.744 1
1 11 . 6 1 1 A 8 8 LEU CA C 8 55.498 57.853 -2.355 1
1 12 . 6 1 1 A 8 8 LEU CB C 8 42.568 41.438 1.130 1
1 13 . 6 1 1 A 8 8 LEU N N 8 122.916 121.457 1.459 1
1 14 . 6 1 1 A 9 9 GLU H H 9 8.623 7.890 0.733 1
1 15 . 6 1 1 A 9 9 GLU HA H 9 4.311 4.801 -0.490 1
1 16 . 6 1 1 A 9 9 GLU C C 9 174.811 175.553 -0.742 1
1 17 . 6 1 1 A 9 9 GLU CA C 9 56.377 55.350 1.027 1
1 18 . 6 1 1 A 9 9 GLU CB C 9 29.557 30.953 -1.396 1
1 20 . 6 1 1 A 9 9 GLU N N 9 121.512 120.254 1.258 1
1 21 . 6 1 1 A 10 10 LEU H H 10 7.853 8.867 -1.014 1
1 22 . 6 1 1 A 10 10 LEU HA H 10 5.225 5.338 -0.113 1
1 31 . 6 1 1 A 10 10 LEU C C 10 174.637 175.578 -0.941 1
1 32 . 6 1 1 A 10 10 LEU CA C 10 54.513 54.101 0.412 1
1 33 . 6 1 1 A 10 10 LEU CB C 10 45.187 44.623 0.564 1
1 36 . 6 1 1 A 10 10 LEU N N 10 123.592 127.598 -4.006 1
1 37 . 6 1 1 A 11 11 GLU H H 11 8.894 8.915 -0.021 1
1 38 . 6 1 1 A 11 11 GLU HA H 11 4.765 5.083 -0.318 1
1 43 . 6 1 1 A 11 11 GLU C C 11 174.563 175.531 -0.968 1
1 44 . 6 1 1 A 11 11 GLU CA C 11 55.047 55.003 0.044 1
1 45 . 6 1 1 A 11 11 GLU CB C 11 33.760 31.927 1.833 1
1 47 . 6 1 1 A 11 11 GLU N N 11 124.055 123.657 0.398 1
1 48 . 6 1 1 A 12 12 VAL H H 12 8.607 8.985 -0.378 1
1 49 . 6 1 1 A 12 12 VAL HA H 12 5.174 5.493 -0.319 1
1 57 . 6 1 1 A 12 12 VAL C C 12 173.573 175.413 -1.840 1
1 58 . 6 1 1 A 12 12 VAL CA C 12 60.296 61.204 -0.908 1
1 59 . 6 1 1 A 12 12 VAL CB C 12 35.689 33.506 2.183 1
1 62 . 6 1 1 A 12 12 VAL N N 12 120.878 125.245 -4.367 1
1 63 . 6 1 1 A 13 13 HIS H H 13 8.982 9.106 -0.124 1
1 64 . 6 1 1 A 13 13 HIS HA H 13 4.824 5.144 -0.320 1
1 69 . 6 1 1 A 13 13 HIS C C 13 173.236 171.984 1.252 1
1 70 . 6 1 1 A 13 13 HIS CA C 13 54.906 54.139 0.767 1
1 71 . 6 1 1 A 13 13 HIS CB C 13 33.496 32.396 1.100 1
1 72 . 6 1 1 A 13 13 HIS N N 13 121.504 121.863 -0.359 1
1 73 . 6 1 1 A 14 14 ILE H H 14 10.442 9.196 1.246 1
1 74 . 6 1 1 A 14 14 ILE HA H 14 5.458 4.692 0.766 1
1 84 . 6 1 1 A 14 14 ILE CA C 14 58.386 57.969 0.417 1
1 85 . 6 1 1 A 14 14 ILE CB C 14 38.596 38.025 0.571 1
1 88 . 6 1 1 A 14 14 ILE N N 14 119.923 121.384 -1.461 1
1 89 . 6 1 1 A 15 15 PRO HA H 15 4.560 4.542 0.018 1
1 95 . 6 1 1 A 15 15 PRO C C 15 176.907 176.529 0.378 1
1 96 . 6 1 1 A 15 15 PRO CA C 15 64.342 64.445 -0.103 1
1 97 . 6 1 1 A 15 15 PRO CB C 15 32.924 32.292 0.632 1
1 100 . 6 1 1 A 16 16 SER H H 16 7.331 7.682 -0.351 1
1 101 . 6 1 1 A 16 16 SER HA H 16 4.822 4.945 -0.123 1
1 104 . 6 1 1 A 16 16 SER C C 16 171.253 172.349 -1.096 1
1 105 . 6 1 1 A 16 16 SER CA C 16 57.135 57.599 -0.464 1
1 106 . 6 1 1 A 16 16 SER CB C 16 65.947 67.220 -1.273 1
1 107 . 6 1 1 A 16 16 SER N N 16 107.745 113.268 -5.523 1
1 108 . 6 1 1 A 17 17 VAL H H 17 8.350 8.274 0.076 1
1 109 . 6 1 1 A 17 17 VAL HA H 17 4.926 5.068 -0.142 1
1 117 . 6 1 1 A 17 17 VAL C C 17 173.692 174.889 -1.197 1
1 118 . 6 1 1 A 17 17 VAL CA C 17 58.721 60.677 -1.956 1
1 119 . 6 1 1 A 17 17 VAL CB C 17 34.420 34.652 -0.232 1
1 122 . 6 1 1 A 17 17 VAL N N 17 118.680 122.035 -3.355 1
1 123 . 6 1 1 A 18 18 GLY H H 18 8.332 8.759 -0.427 1
1 124 . 6 1 1 A 18 18 GLY HA2 H 18 4.189 4.353 -0.164 1
1 125 . 6 1 1 A 18 18 GLY HA3 H 18 4.011 4.371 -0.360 1
1 126 . 6 1 1 A 18 18 GLY CA C 18 45.356 44.750 0.606 1
1 127 . 6 1 1 A 18 18 GLY N N 18 112.549 114.235 -1.686 1
1 128 . 6 1 1 A 19 19 PRO HA H 19 4.757 4.878 -0.121 1
1 134 . 6 1 1 A 19 19 PRO C C 19 177.482 176.750 0.732 1
1 135 . 6 1 1 A 19 19 PRO CA C 19 62.848 62.283 0.565 1
1 136 . 6 1 1 A 19 19 PRO CB C 19 32.283 29.725 2.558 1
1 139 . 6 1 1 A 20 20 GLU H H 20 8.588 8.190 0.398 1
1 140 . 6 1 1 A 20 20 GLU HA H 20 4.147 4.591 -0.444 1
1 144 . 6 1 1 A 20 20 GLU C C 20 175.857 175.898 -0.041 1
1 145 . 6 1 1 A 20 20 GLU CA C 20 57.150 55.813 1.337 1
1 146 . 6 1 1 A 20 20 GLU CB C 20 30.923 31.030 -0.107 1
1 148 . 6 1 1 A 20 20 GLU N N 20 122.087 119.640 2.447 1
1 149 . 6 1 1 A 21 21 ALA H H 21 8.352 7.021 1.331 1
1 150 . 6 1 1 A 21 21 ALA HA H 21 4.391 4.500 -0.109 1
1 154 . 6 1 1 A 21 21 ALA C C 21 174.910 176.933 -2.023 1
1 155 . 6 1 1 A 21 21 ALA CA C 21 52.166 50.372 1.794 1
1 156 . 6 1 1 A 21 21 ALA CB C 21 19.915 20.471 -0.556 1
1 157 . 6 1 1 A 21 21 ALA N N 21 124.593 123.554 1.039 1
1 158 . 6 1 1 A 22 22 GLU H H 22 8.398 8.307 0.091 1
1 159 . 6 1 1 A 22 22 GLU HA H 22 4.331 4.178 0.153 1
1 163 . 6 1 1 A 22 22 GLU C C 22 176.389 176.121 0.268 1
1 164 . 6 1 1 A 22 22 GLU CA C 22 56.316 54.517 1.799 1
1 165 . 6 1 1 A 22 22 GLU CB C 22 30.713 30.433 0.280 1
1 167 . 6 1 1 A 22 22 GLU N N 22 120.159 121.237 -1.078 1
1 168 . 6 1 1 A 23 23 GLY H H 23 8.246 8.669 -0.423 1
1 169 . 6 1 1 A 23 23 GLY HA2 H 23 4.162 4.086 0.076 1
1 170 . 6 1 1 A 23 23 GLY HA3 H 23 4.061 4.140 -0.079 1
1 171 . 6 1 1 A 23 23 GLY CA C 23 44.801 45.593 -0.792 1
1 172 . 6 1 1 A 23 23 GLY N N 23 110.080 107.424 2.656 1
1 173 . 6 1 1 A 24 24 PRO HA H 24 4.417 4.431 -0.014 1
1 178 . 6 1 1 A 24 24 PRO C C 24 177.135 176.657 0.478 1
1 179 . 6 1 1 A 24 24 PRO CA C 24 63.520 64.922 -1.402 1
1 180 . 6 1 1 A 24 24 PRO CB C 24 32.124 31.983 0.141 1
1 183 . 6 1 1 A 25 25 ARG H H 25 8.409 7.675 0.734 1
1 184 . 6 1 1 A 25 25 ARG HA H 25 4.298 4.866 -0.568 1
1 187 . 6 1 1 A 25 25 ARG C C 25 176.217 175.494 0.723 1
1 188 . 6 1 1 A 25 25 ARG CA C 25 56.237 54.230 2.007 1
1 189 . 6 1 1 A 25 25 ARG CB C 25 30.467 34.970 -4.503 1
1 192 . 6 1 1 A 25 25 ARG N N 25 120.147 117.928 2.219 1
1 193 . 6 1 1 A 26 26 GLN H H 26 8.278 8.400 -0.122 1
1 194 . 6 1 1 A 26 26 GLN HA H 26 4.336 4.602 -0.266 1
1 200 . 6 1 1 A 26 26 GLN C C 26 175.566 174.663 0.903 1
1 201 . 6 1 1 A 26 26 GLN CA C 26 55.788 55.569 0.219 1
1 202 . 6 1 1 A 26 26 GLN CB C 26 29.714 28.869 0.845 1
1 204 . 6 1 1 A 26 26 GLN N N 26 120.460 121.315 -0.855 1
1 206 . 6 1 1 A 27 27 SER H H 27 8.298 8.677 -0.379 1
1 208 . 6 1 1 A 27 27 SER CA C 27 56.156 56.971 -0.815 1
1 209 . 6 1 1 A 27 27 SER CB C 27 63.813 63.162 0.651 1
1 210 . 6 1 1 A 27 27 SER N N 27 117.382 122.807 -5.425 1
1 211 . 6 1 1 A 28 28 PRO HA H 28 4.366 4.318 0.048 1
1 216 . 6 1 1 A 28 28 PRO C C 28 177.555 178.003 -0.448 1
1 217 . 6 1 1 A 28 28 PRO CA C 28 64.486 65.397 -0.911 1
1 218 . 6 1 1 A 28 28 PRO CB C 28 31.892 32.010 -0.118 1
1 221 . 6 1 1 A 29 29 GLU H H 29 8.582 7.760 0.822 1
1 222 . 6 1 1 A 29 29 GLU HA H 29 4.218 4.335 -0.117 1
1 226 . 6 1 1 A 29 29 GLU CA C 29 57.261 56.967 0.294 1
1 227 . 6 1 1 A 29 29 GLU CB C 29 29.633 30.596 -0.963 1
1 229 . 6 1 1 A 29 29 GLU N N 29 118.309 115.502 2.807 1
1 230 . 6 1 1 A 30 30 LYS H H 30 7.955 7.888 0.067 1
1 231 . 6 1 1 A 30 30 LYS HA H 30 4.328 3.998 0.330 1
1 236 . 6 1 1 A 30 30 LYS C C 30 176.222 175.327 0.895 1
1 237 . 6 1 1 A 30 30 LYS CA C 30 56.247 56.962 -0.715 1
1 238 . 6 1 1 A 30 30 LYS CB C 30 32.720 31.176 1.544 1
1 242 . 6 1 1 A 30 30 LYS N N 30 120.129 117.474 2.655 1
1 243 . 6 1 1 A 31 31 SER H H 31 7.883 8.717 -0.834 1
1 244 . 6 1 1 A 31 31 SER HA H 31 4.458 4.939 -0.481 1
1 246 . 6 1 1 A 31 31 SER C C 31 174.129 174.255 -0.126 1
1 247 . 6 1 1 A 31 31 SER CA C 31 58.477 58.346 0.131 1
1 248 . 6 1 1 A 31 31 SER CB C 31 64.042 62.885 1.157 1
1 249 . 6 1 1 A 31 31 SER N N 31 115.366 117.158 -1.792 1
1 250 . 6 1 1 A 32 32 HIS H H 32 8.485 9.079 -0.594 1
1 251 . 6 1 1 A 32 32 HIS HA H 32 4.450 4.681 -0.231 1
1 255 . 6 1 1 A 32 32 HIS CA C 32 56.009 57.069 -1.060 1
1 256 . 6 1 1 A 32 32 HIS CB C 32 31.122 30.545 0.577 1
1 257 . 6 1 1 A 32 32 HIS N N 32 121.500 127.128 -5.628 1
1 258 . 6 1 1 A 33 33 MET H H 33 8.392 7.832 0.560 1
1 259 . 6 1 1 A 33 33 MET HA H 33 4.601 4.921 -0.320 1
1 265 . 6 1 1 A 33 33 MET C C 33 175.842 174.186 1.656 1
1 266 . 6 1 1 A 33 33 MET CA C 33 54.533 54.283 0.250 1
1 267 . 6 1 1 A 33 33 MET CB C 33 32.868 36.044 -3.176 1
1 270 . 6 1 1 A 33 33 MET N N 33 120.204 117.708 2.496 1
1 271 . 6 1 1 A 34 34 VAL H H 34 8.938 9.151 -0.213 1
1 272 . 6 1 1 A 34 34 VAL HA H 34 4.430 4.964 -0.534 1
1 280 . 6 1 1 A 34 34 VAL C C 34 174.149 174.438 -0.289 1
1 281 . 6 1 1 A 34 34 VAL CA C 34 60.703 59.481 1.222 1
1 282 . 6 1 1 A 34 34 VAL CB C 34 34.319 35.414 -1.095 1
1 285 . 6 1 1 A 34 34 VAL N N 34 118.512 123.532 -5.020 1
1 286 . 6 1 1 A 35 35 PHE H H 35 9.242 7.963 1.279 1
1 287 . 6 1 1 A 35 35 PHE HA H 35 4.439 5.341 -0.902 1
1 294 . 6 1 1 A 35 35 PHE C C 35 174.831 174.711 0.120 1
1 295 . 6 1 1 A 35 35 PHE CA C 35 57.754 55.331 2.423 1
1 296 . 6 1 1 A 35 35 PHE CB C 35 38.959 40.817 -1.858 1
1 297 . 6 1 1 A 35 35 PHE N N 35 124.912 124.770 0.142 1
1 298 . 6 1 1 A 36 36 ARG H H 36 8.475 8.631 -0.156 1
1 299 . 6 1 1 A 36 36 ARG HA H 36 4.135 4.758 -0.623 1
1 304 . 6 1 1 A 36 36 ARG C C 36 172.865 175.483 -2.618 1
1 305 . 6 1 1 A 36 36 ARG CA C 36 56.895 55.291 1.604 1
1 306 . 6 1 1 A 36 36 ARG CB C 36 28.962 30.840 -1.878 1
1 308 . 6 1 1 A 36 36 ARG N N 36 125.680 122.260 3.420 1
1 309 . 6 1 1 A 37 37 VAL H H 37 8.066 8.868 -0.802 1
1 310 . 6 1 1 A 37 37 VAL HA H 37 4.292 4.520 -0.228 1
1 318 . 6 1 1 A 37 37 VAL C C 37 174.595 174.346 0.249 1
1 319 . 6 1 1 A 37 37 VAL CA C 37 62.727 61.618 1.109 1
1 320 . 6 1 1 A 37 37 VAL CB C 37 31.102 32.656 -1.554 1
1 323 . 6 1 1 A 37 37 VAL N N 37 125.403 121.089 4.314 1
1 324 . 6 1 1 A 38 38 GLU H H 38 9.532 9.035 0.497 1
1 325 . 6 1 1 A 38 38 GLU HA H 38 4.895 5.480 -0.585 1
1 329 . 6 1 1 A 38 38 GLU C C 38 174.509 175.343 -0.834 1
1 330 . 6 1 1 A 38 38 GLU CA C 38 55.650 54.963 0.687 1
1 331 . 6 1 1 A 38 38 GLU CB C 38 32.214 30.602 1.612 1
1 333 . 6 1 1 A 38 38 GLU N N 38 129.885 126.625 3.260 1
1 334 . 6 1 1 A 39 39 VAL H H 39 9.035 9.314 -0.279 1
1 335 . 6 1 1 A 39 39 VAL HA H 39 4.446 4.610 -0.164 1
1 343 . 6 1 1 A 39 39 VAL C C 39 173.661 174.446 -0.785 1
1 344 . 6 1 1 A 39 39 VAL CA C 39 61.258 61.815 -0.557 1
1 345 . 6 1 1 A 39 39 VAL CB C 39 33.533 32.530 1.003 1
1 348 . 6 1 1 A 39 39 VAL N N 39 127.941 127.219 0.722 1
1 349 . 6 1 1 A 40 40 LEU H H 40 8.843 9.398 -0.555 1
1 350 . 6 1 1 A 40 40 LEU HA H 40 5.130 4.998 0.132 1
1 360 . 6 1 1 A 40 40 LEU C C 40 175.581 174.899 0.682 1
1 361 . 6 1 1 A 40 40 LEU CA C 40 53.702 53.819 -0.117 1
1 362 . 6 1 1 A 40 40 LEU CB C 40 43.989 44.158 -0.169 1
1 366 . 6 1 1 A 40 40 LEU N N 40 128.413 130.147 -1.734 1
1 367 . 6 1 1 A 41 41 CYS H H 41 8.959 8.929 0.030 1
1 368 . 6 1 1 A 41 41 CYS HA H 41 5.174 4.855 0.319 1
1 371 . 6 1 1 A 41 41 CYS C C 41 175.043 174.867 0.176 1
1 372 . 6 1 1 A 41 41 CYS CA C 41 57.483 58.187 -0.704 1
1 373 . 6 1 1 A 41 41 CYS CB C 41 28.472 30.481 -2.009 1
1 374 . 6 1 1 A 41 41 CYS N N 41 124.738 125.708 -0.970 1
1 375 . 6 1 1 A 42 42 SER H H 42 9.527 9.239 0.288 1
1 376 . 6 1 1 A 42 42 SER HA H 42 4.149 4.423 -0.274 1
1 379 . 6 1 1 A 42 42 SER C C 42 175.014 173.861 1.153 1
1 380 . 6 1 1 A 42 42 SER CA C 42 59.058 59.936 -0.878 1
1 381 . 6 1 1 A 42 42 SER CB C 42 62.287 63.175 -0.888 1
1 382 . 6 1 1 A 42 42 SER N N 42 125.889 120.466 5.423 1
1 383 . 6 1 1 A 43 43 GLY H H 43 8.685 8.359 0.326 1
1 384 . 6 1 1 A 43 43 GLY HA2 H 43 3.594 4.081 -0.487 1
1 385 . 6 1 1 A 43 43 GLY HA3 H 43 4.210 4.082 0.128 1
1 386 . 6 1 1 A 43 43 GLY C C 43 173.664 174.423 -0.759 1
1 387 . 6 1 1 A 43 43 GLY CA C 43 45.404 45.567 -0.163 1
1 388 . 6 1 1 A 43 43 GLY N N 43 104.633 107.081 -2.448 1
1 389 . 6 1 1 A 44 44 ARG H H 44 7.926 7.952 -0.026 1
1 390 . 6 1 1 A 44 44 ARG HA H 44 4.678 4.444 0.234 1
1 395 . 6 1 1 A 44 44 ARG C C 44 175.261 175.443 -0.182 1
1 396 . 6 1 1 A 44 44 ARG CA C 44 55.011 55.758 -0.747 1
1 397 . 6 1 1 A 44 44 ARG CB C 44 32.138 31.326 0.812 1
1 400 . 6 1 1 A 44 44 ARG N N 44 121.239 120.653 0.586 1
1 401 . 6 1 1 A 45 45 ARG H H 45 8.775 9.119 -0.344 1
1 402 . 6 1 1 A 45 45 ARG HA H 45 5.770 5.356 0.414 1
1 409 . 6 1 1 A 45 45 ARG C C 45 176.064 174.847 1.217 1
1 410 . 6 1 1 A 45 45 ARG CA C 45 54.683 54.073 0.610 1
1 411 . 6 1 1 A 45 45 ARG CB C 45 33.748 34.406 -0.658 1
1 414 . 6 1 1 A 45 45 ARG N N 45 125.948 119.258 6.690 1
1 415 . 6 1 1 A 46 46 HIS H H 46 8.912 9.120 -0.208 1
1 416 . 6 1 1 A 46 46 HIS HA H 46 4.927 5.184 -0.257 1
1 420 . 6 1 1 A 46 46 HIS C C 46 172.634 174.278 -1.644 1
1 421 . 6 1 1 A 46 46 HIS CA C 46 56.480 54.432 2.048 1
1 422 . 6 1 1 A 46 46 HIS CB C 46 33.608 31.937 1.671 1
1 423 . 6 1 1 A 46 46 HIS N N 46 121.825 118.807 3.018 1
1 424 . 6 1 1 A 47 47 THR H H 47 8.532 8.921 -0.389 1
1 425 . 6 1 1 A 47 47 THR HA H 47 5.472 4.624 0.848 1
1 430 . 6 1 1 A 47 47 THR C C 47 174.442 174.043 0.399 1
1 431 . 6 1 1 A 47 47 THR CA C 47 61.093 62.294 -1.201 1
1 432 . 6 1 1 A 47 47 THR CB C 47 71.041 68.410 2.631 1
1 434 . 6 1 1 A 47 47 THR N N 47 115.450 119.102 -3.652 1
1 435 . 6 1 1 A 48 48 VAL H H 48 9.695 9.432 0.263 1
1 436 . 6 1 1 A 48 48 VAL HA H 48 4.677 4.538 0.139 1
1 444 . 6 1 1 A 48 48 VAL CA C 48 58.172 59.335 -1.163 1
1 445 . 6 1 1 A 48 48 VAL CB C 48 34.990 32.213 2.777 1
1 448 . 6 1 1 A 48 48 VAL N N 48 126.721 127.709 -0.988 1
1 449 . 6 1 1 A 49 49 PRO HA H 49 5.087 4.669 0.418 1
1 453 . 6 1 1 A 49 49 PRO CA C 49 61.671 62.436 -0.765 1
1 454 . 6 1 1 A 49 49 PRO CB C 49 31.923 31.643 0.280 1
1 457 . 6 1 1 A 50 50 ARG H H 50 9.125 8.544 0.581 1
1 458 . 6 1 1 A 50 50 ARG HA H 50 4.974 4.608 0.366 1
1 464 . 6 1 1 A 50 50 ARG C C 50 176.187 174.778 1.409 1
1 465 . 6 1 1 A 50 50 ARG CA C 50 53.015 53.963 -0.948 1
1 466 . 6 1 1 A 50 50 ARG CB C 50 36.553 33.596 2.957 1
1 468 . 6 1 1 A 50 50 ARG N N 50 124.189 124.027 0.162 1
1 469 . 6 1 1 A 51 51 ARG H H 51 10.105 8.357 1.748 1
1 470 . 6 1 1 A 51 51 ARG HA H 51 5.196 4.477 0.719 1
1 475 . 6 1 1 A 51 51 ARG C C 51 178.865 177.063 1.802 1
1 476 . 6 1 1 A 51 51 ARG CA C 51 55.961 54.569 1.392 1
1 477 . 6 1 1 A 51 51 ARG CB C 51 32.539 31.171 1.368 1
1 480 . 6 1 1 A 51 51 ARG N N 51 124.521 121.800 2.721 1
1 481 . 6 1 1 A 52 52 TYR H H 52 10.397 9.153 1.244 1
1 482 . 6 1 1 A 52 52 TYR HA H 52 4.360 4.403 -0.043 1
1 487 . 6 1 1 A 52 52 TYR C C 52 178.143 177.804 0.339 1
1 488 . 6 1 1 A 52 52 TYR CA C 52 63.538 60.435 3.103 1
1 489 . 6 1 1 A 52 52 TYR CB C 52 38.784 37.705 1.079 1
1 490 . 6 1 1 A 52 52 TYR N N 52 124.772 122.333 2.439 1
1 491 . 6 1 1 A 53 53 SER H H 53 9.231 8.231 1.000 1
1 492 . 6 1 1 A 53 53 SER HA H 53 4.175 4.272 -0.097 1
1 493 . 6 1 1 A 53 53 SER C C 53 177.220 177.198 0.022 1
1 494 . 6 1 1 A 53 53 SER CA C 53 61.606 61.406 0.200 1
1 495 . 6 1 1 A 53 53 SER N N 53 113.262 115.886 -2.624 1
1 496 . 6 1 1 A 54 54 GLU H H 54 7.807 7.427 0.380 1
1 497 . 6 1 1 A 54 54 GLU HA H 54 4.392 3.965 0.427 1
1 501 . 6 1 1 A 54 54 GLU C C 54 180.361 178.772 1.589 1
1 502 . 6 1 1 A 54 54 GLU CA C 54 59.497 58.919 0.578 1
1 503 . 6 1 1 A 54 54 GLU CB C 54 30.708 29.259 1.449 1
1 504 . 6 1 1 A 54 54 GLU N N 54 121.949 121.798 0.151 1
1 505 . 6 1 1 A 55 55 PHE H H 55 8.133 8.305 -0.172 1
1 506 . 6 1 1 A 55 55 PHE HA H 55 4.007 4.195 -0.188 1
1 513 . 6 1 1 A 55 55 PHE C C 55 176.531 177.577 -1.046 1
1 514 . 6 1 1 A 55 55 PHE CA C 55 61.848 61.417 0.431 1
1 515 . 6 1 1 A 55 55 PHE CB C 55 38.847 38.914 -0.067 1
1 516 . 6 1 1 A 55 55 PHE N N 55 119.998 121.446 -1.448 1
1 517 . 6 1 1 A 56 56 HIS H H 56 7.907 8.230 -0.323 1
1 518 . 6 1 1 A 56 56 HIS HA H 56 3.324 4.201 -0.877 1
1 522 . 6 1 1 A 56 56 HIS C C 56 176.748 177.521 -0.773 1
1 523 . 6 1 1 A 56 56 HIS CA C 56 58.770 59.524 -0.754 1
1 524 . 6 1 1 A 56 56 HIS CB C 56 30.404 29.765 0.639 1
1 525 . 6 1 1 A 56 56 HIS N N 56 119.173 117.532 1.641 1
1 526 . 6 1 1 A 57 57 ALA H H 57 7.962 7.940 0.022 1
1 527 . 6 1 1 A 57 57 ALA HA H 57 3.865 3.980 -0.115 1
1 531 . 6 1 1 A 57 57 ALA C C 57 180.075 179.759 0.316 1
1 532 . 6 1 1 A 57 57 ALA CA C 57 54.996 55.210 -0.214 1
1 533 . 6 1 1 A 57 57 ALA CB C 57 18.226 17.990 0.236 1
1 534 . 6 1 1 A 57 57 ALA N N 57 120.094 121.939 -1.845 1
1 535 . 6 1 1 A 58 58 LEU H H 58 7.295 8.207 -0.912 1
1 536 . 6 1 1 A 58 58 LEU HA H 58 3.994 3.642 0.352 1
1 546 . 6 1 1 A 58 58 LEU C C 58 177.428 178.523 -1.095 1
1 547 . 6 1 1 A 58 58 LEU CA C 58 58.342 57.746 0.596 1
1 548 . 6 1 1 A 58 58 LEU CB C 58 40.851 41.415 -0.564 1
1 552 . 6 1 1 A 58 58 LEU N N 58 119.404 119.877 -0.473 1
1 553 . 6 1 1 A 59 59 HIS H H 59 7.805 8.451 -0.646 1
1 554 . 6 1 1 A 59 59 HIS HA H 59 4.286 3.811 0.475 1
1 558 . 6 1 1 A 59 59 HIS C C 59 177.001 177.088 -0.087 1
1 559 . 6 1 1 A 59 59 HIS CA C 59 60.141 60.051 0.090 1
1 560 . 6 1 1 A 59 59 HIS CB C 59 31.072 29.561 1.511 1
1 561 . 6 1 1 A 59 59 HIS N N 59 119.040 117.887 1.153 1
1 562 . 6 1 1 A 60 60 LYS H H 60 7.715 8.268 -0.553 1
1 563 . 6 1 1 A 60 60 LYS HA H 60 3.456 3.794 -0.338 1
1 570 . 6 1 1 A 60 60 LYS C C 60 178.464 178.743 -0.279 1
1 571 . 6 1 1 A 60 60 LYS CA C 60 59.629 58.973 0.656 1
1 572 . 6 1 1 A 60 60 LYS CB C 60 32.354 31.942 0.412 1
1 576 . 6 1 1 A 60 60 LYS N N 60 114.225 117.826 -3.601 1
1 577 . 6 1 1 A 61 61 ARG H H 61 7.486 7.786 -0.300 1
1 578 . 6 1 1 A 61 61 ARG HA H 61 4.202 4.176 0.026 1
1 584 . 6 1 1 A 61 61 ARG C C 61 178.995 178.707 0.288 1
1 585 . 6 1 1 A 61 61 ARG CA C 61 58.387 58.579 -0.192 1
1 586 . 6 1 1 A 61 61 ARG CB C 61 31.216 30.099 1.117 1
1 589 . 6 1 1 A 61 61 ARG N N 61 115.929 119.250 -3.321 1
1 590 . 6 1 1 A 62 62 ILE H H 62 8.066 7.361 0.705 1
1 591 . 6 1 1 A 62 62 ILE HA H 62 4.491 3.909 0.582 1
1 601 . 6 1 1 A 62 62 ILE C C 62 177.838 177.546 0.292 1
1 602 . 6 1 1 A 62 62 ILE CA C 62 63.399 64.229 -0.830 1
1 603 . 6 1 1 A 62 62 ILE CB C 62 39.699 37.580 2.119 1
1 606 . 6 1 1 A 62 62 ILE N N 62 111.456 118.275 -6.819 1
1 607 . 6 1 1 A 63 63 LYS H H 63 8.158 8.401 -0.243 1
1 608 . 6 1 1 A 63 63 LYS HA H 63 4.136 3.845 0.291 1
1 615 . 6 1 1 A 63 63 LYS C C 63 176.358 178.895 -2.537 1
1 616 . 6 1 1 A 63 63 LYS CA C 63 58.753 58.606 0.147 1
1 617 . 6 1 1 A 63 63 LYS CB C 63 30.825 31.431 -0.606 1
1 621 . 6 1 1 A 63 63 LYS N N 63 120.800 122.876 -2.076 1
1 622 . 6 1 1 A 64 64 LYS H H 64 7.687 7.425 0.262 1
1 623 . 6 1 1 A 64 64 LYS HA H 64 4.301 4.154 0.147 1
1 628 . 6 1 1 A 64 64 LYS C C 64 177.084 178.287 -1.203 1
1 629 . 6 1 1 A 64 64 LYS CA C 64 57.237 58.661 -1.424 1
1 630 . 6 1 1 A 64 64 LYS CB C 64 32.502 32.014 0.488 1
1 634 . 6 1 1 A 64 64 LYS N N 64 116.548 119.662 -3.114 1
1 635 . 6 1 1 A 65 65 LEU H H 65 7.476 7.410 0.066 1
1 636 . 6 1 1 A 65 65 LEU HA H 65 4.219 4.292 -0.073 1
1 645 . 6 1 1 A 65 65 LEU C C 65 175.886 176.775 -0.889 1
1 646 . 6 1 1 A 65 65 LEU CA C 65 55.542 56.523 -0.981 1
1 647 . 6 1 1 A 65 65 LEU CB C 65 45.493 43.738 1.755 1
1 650 . 6 1 1 A 65 65 LEU N N 65 118.000 118.109 -0.109 1
1 651 . 6 1 1 A 66 66 TYR H H 66 7.672 8.764 -1.092 1
1 652 . 6 1 1 A 66 66 TYR HA H 66 4.762 5.114 -0.352 1
1 660 . 6 1 1 A 66 66 TYR C C 66 174.199 173.199 1.000 1
1 661 . 6 1 1 A 66 66 TYR CA C 66 56.013 55.241 0.772 1
1 662 . 6 1 1 A 66 66 TYR CB C 66 40.380 41.039 -0.659 1
1 663 . 6 1 1 A 66 66 TYR N N 66 116.805 116.141 0.664 1
1 664 . 6 1 1 A 67 67 LYS H H 67 8.547 8.533 0.014 1
1 665 . 6 1 1 A 67 67 LYS HA H 67 4.436 4.267 0.169 1
1 670 . 6 1 1 A 67 67 LYS C C 67 175.727 174.805 0.922 1
1 671 . 6 1 1 A 67 67 LYS CA C 67 56.598 56.900 -0.302 1
1 672 . 6 1 1 A 67 67 LYS CB C 67 32.743 32.705 0.038 1
1 676 . 6 1 1 A 67 67 LYS N N 67 120.929 120.329 0.600 1
1 677 . 6 1 1 A 68 68 VAL H H 68 8.168 7.995 0.173 1
1 678 . 6 1 1 A 68 68 VAL HA H 68 4.869 4.345 0.524 1
1 686 . 6 1 1 A 68 68 VAL CA C 68 57.389 58.665 -1.276 1
1 687 . 6 1 1 A 68 68 VAL CB C 68 34.017 35.111 -1.094 1
1 690 . 6 1 1 A 68 68 VAL N N 68 116.467 126.642 -10.175 1
1 691 . 6 1 1 A 69 69 PRO HA H 69 4.674 4.709 -0.035 1
1 696 . 6 1 1 A 69 69 PRO C C 69 178.013 175.940 2.073 1
1 697 . 6 1 1 A 69 69 PRO CA C 69 61.443 62.324 -0.881 1
1 698 . 6 1 1 A 69 69 PRO CB C 69 32.231 33.206 -0.975 1
1 701 . 6 1 1 A 70 70 ASP H H 70 8.167 8.662 -0.495 1
1 702 . 6 1 1 A 70 70 ASP HA H 70 4.531 4.759 -0.228 1
1 705 . 6 1 1 A 70 70 ASP C C 70 175.660 175.240 0.420 1
1 706 . 6 1 1 A 70 70 ASP CA C 70 55.148 53.499 1.649 1
1 707 . 6 1 1 A 70 70 ASP CB C 70 40.876 41.890 -1.014 1
1 708 . 6 1 1 A 70 70 ASP N N 70 116.671 121.440 -4.769 1
1 709 . 6 1 1 A 71 71 PHE H H 71 8.387 8.644 -0.257 1
1 710 . 6 1 1 A 71 71 PHE HA H 71 4.076 4.919 -0.843 1
1 717 . 6 1 1 A 71 71 PHE CA C 71 55.672 54.720 0.952 1
1 718 . 6 1 1 A 71 71 PHE CB C 71 39.155 41.671 -2.516 1
1 719 . 6 1 1 A 71 71 PHE N N 71 126.533 118.158 8.375 1
1 720 . 6 1 1 A 72 72 PRO HA H 72 4.156 4.652 -0.496 1
1 727 . 6 1 1 A 72 72 PRO CA C 72 63.079 63.110 -0.031 1
1 728 . 6 1 1 A 72 72 PRO CB C 72 32.107 32.593 -0.486 1
1 731 . 6 1 1 A 73 73 SER H H 73 8.468 8.535 -0.067 1
1 733 . 6 1 1 A 73 73 SER CA C 73 56.133 56.404 -0.271 1
1 734 . 6 1 1 A 73 73 SER CB C 73 63.991 65.448 -1.457 1
1 735 . 6 1 1 A 73 73 SER N N 73 121.533 117.459 4.074 1
1 736 . 6 1 1 A 74 74 LYS HA H 74 4.574 4.512 0.062 1
1 739 . 6 1 1 A 74 74 LYS CA C 74 55.659 59.200 -3.541 1
1 740 . 6 1 1 A 74 74 LYS CB C 74 30.550 32.118 -1.568 1
1 741 . 6 1 1 A 75 75 ARG H H 75 7.962 7.583 0.379 1
1 742 . 6 1 1 A 75 75 ARG HA H 75 4.162 4.403 -0.241 1
1 746 . 6 1 1 A 75 75 ARG CA C 75 56.123 56.031 0.092 1
1 747 . 6 1 1 A 75 75 ARG CB C 75 31.179 31.102 0.077 1
1 749 . 6 1 1 A 75 75 ARG N N 75 121.665 121.707 -0.042 1
1 750 . 6 1 1 A 76 76 LEU H H 76 8.071 8.591 -0.520 1
1 751 . 6 1 1 A 76 76 LEU HA H 76 4.618 4.823 -0.205 1
1 759 . 6 1 1 A 76 76 LEU CA C 76 52.764 51.871 0.893 1
1 760 . 6 1 1 A 76 76 LEU CB C 76 41.918 42.811 -0.893 1
1 762 . 6 1 1 A 76 76 LEU N N 76 124.196 128.967 -4.771 1
1 763 . 6 1 1 A 77 77 PRO HA H 77 4.393 4.501 -0.108 1
1 767 . 6 1 1 A 77 77 PRO CA C 77 63.746 62.795 0.951 1
1 770 . 6 1 1 A 78 78 ASN H H 78 8.379 8.672 -0.293 1
1 771 . 6 1 1 A 78 78 ASN HA H 78 4.586 4.489 0.097 1
1 776 . 6 1 1 A 78 78 ASN C C 78 175.648 176.240 -0.592 1
1 777 . 6 1 1 A 78 78 ASN CA C 78 53.591 54.148 -0.557 1
1 778 . 6 1 1 A 78 78 ASN CB C 78 37.826 38.232 -0.406 1
1 779 . 6 1 1 A 78 78 ASN N N 78 115.292 119.879 -4.587 1
1 781 . 6 1 1 A 79 79 TRP H H 79 7.900 7.977 -0.077 1
1 782 . 6 1 1 A 79 79 TRP HA H 79 4.326 4.403 -0.077 1
1 788 . 6 1 1 A 79 79 TRP CA C 79 58.825 59.824 -0.999 1
1 789 . 6 1 1 A 79 79 TRP CB C 79 29.090 28.144 0.946 1
1 790 . 6 1 1 A 79 79 TRP N N 79 119.525 121.287 -1.762 1
1 792 . 6 1 1 A 80 80 ARG H H 80 8.060 7.969 0.091 1
1 793 . 6 1 1 A 80 80 ARG HA H 80 3.913 3.665 0.248 1
1 798 . 6 1 1 A 80 80 ARG C C 80 177.024 178.238 -1.214 1
1 799 . 6 1 1 A 80 80 ARG CA C 80 58.292 58.949 -0.657 1
1 800 . 6 1 1 A 80 80 ARG CB C 80 30.146 29.710 0.436 1
1 803 . 6 1 1 A 80 80 ARG N N 80 118.864 121.606 -2.742 1
1 804 . 6 1 1 A 81 81 THR H H 81 7.725 7.613 0.112 1
1 805 . 6 1 1 A 81 81 THR HA H 81 4.297 4.232 0.065 1
1 809 . 6 1 1 A 81 81 THR CA C 81 62.481 63.475 -0.994 1
1 811 . 6 1 1 A 81 81 THR N N 81 109.863 113.099 -3.236 1
1 812 . 6 1 1 A 82 82 ARG HA H 82 4.341 4.329 0.012 1
1 816 . 6 1 1 A 82 82 ARG C C 82 177.261 176.364 0.897 1
1 817 . 6 1 1 A 82 82 ARG CA C 82 56.846 57.626 -0.780 1
1 818 . 6 1 1 A 82 82 ARG CB C 82 30.288 31.878 -1.590 1
1 820 . 6 1 1 A 83 83 GLY H H 83 8.321 7.806 0.515 1
1 821 . 6 1 1 A 83 83 GLY HA2 H 83 3.957 4.174 -0.217 1
1 822 . 6 1 1 A 83 83 GLY C C 83 175.185 174.393 0.792 1
1 823 . 6 1 1 A 83 83 GLY CA C 83 46.297 45.497 0.800 1
1 824 . 6 1 1 A 83 83 GLY N N 83 109.146 104.637 4.509 1
1 825 . 6 1 1 A 84 84 LEU H H 84 8.303 9.055 -0.752 1
1 826 . 6 1 1 A 84 84 LEU HA H 84 4.018 3.893 0.125 1
1 835 . 6 1 1 A 84 84 LEU C C 84 178.552 178.292 0.260 1
1 836 . 6 1 1 A 84 84 LEU CA C 84 58.236 56.696 1.540 1
1 837 . 6 1 1 A 84 84 LEU CB C 84 41.837 41.371 0.466 1
1 840 . 6 1 1 A 84 84 LEU N N 84 122.662 120.864 1.798 1
1 841 . 6 1 1 A 85 85 GLU H H 85 8.233 8.248 -0.015 1
1 842 . 6 1 1 A 85 85 GLU HA H 85 4.371 3.872 0.499 1
1 846 . 6 1 1 A 85 85 GLU C C 85 178.555 179.273 -0.718 1
1 847 . 6 1 1 A 85 85 GLU CA C 85 58.377 59.780 -1.403 1
1 848 . 6 1 1 A 85 85 GLU CB C 85 28.675 29.293 -0.618 1
1 850 . 6 1 1 A 85 85 GLU N N 85 119.781 119.433 0.348 1
1 851 . 6 1 1 A 86 86 GLN H H 86 7.877 7.606 0.271 1
1 852 . 6 1 1 A 86 86 GLN HA H 86 4.100 4.032 0.068 1
1 858 . 6 1 1 A 86 86 GLN C C 86 179.557 177.843 1.714 1
1 859 . 6 1 1 A 86 86 GLN CA C 86 58.955 58.236 0.719 1
1 860 . 6 1 1 A 86 86 GLN CB C 86 28.191 28.166 0.025 1
1 862 . 6 1 1 A 86 86 GLN N N 86 118.042 118.210 -0.168 1
1 863 . 6 1 1 A 87 87 ARG H H 87 8.169 7.416 0.753 1
1 864 . 6 1 1 A 87 87 ARG HA H 87 3.975 3.429 0.546 1
1 868 . 6 1 1 A 87 87 ARG C C 87 177.051 178.203 -1.152 1
1 869 . 6 1 1 A 87 87 ARG CA C 87 59.006 58.954 0.052 1
1 870 . 6 1 1 A 87 87 ARG CB C 87 30.383 29.169 1.214 1
1 872 . 6 1 1 A 87 87 ARG N N 87 121.381 120.582 0.799 1
1 873 . 6 1 1 A 88 88 ARG H H 88 8.593 8.080 0.513 1
1 874 . 6 1 1 A 88 88 ARG HA H 88 3.726 3.753 -0.027 1
1 876 . 6 1 1 A 88 88 ARG C C 88 177.520 178.257 -0.737 1
1 877 . 6 1 1 A 88 88 ARG CA C 88 60.751 58.804 1.947 1
1 878 . 6 1 1 A 88 88 ARG CB C 88 30.153 30.041 0.112 1
1 879 . 6 1 1 A 88 88 ARG N N 88 120.863 117.563 3.300 1
1 880 . 6 1 1 A 89 89 GLN H H 89 8.355 7.709 0.646 1
1 881 . 6 1 1 A 89 89 GLN HA H 89 3.887 3.877 0.010 1
1 887 . 6 1 1 A 89 89 GLN C C 89 179.499 178.263 1.236 1
1 888 . 6 1 1 A 89 89 GLN CA C 89 59.603 59.259 0.344 1
1 889 . 6 1 1 A 89 89 GLN CB C 89 28.464 27.905 0.559 1
1 891 . 6 1 1 A 89 89 GLN N N 89 116.860 119.106 -2.246 1
1 893 . 6 1 1 A 90 90 GLY H H 90 8.406 8.175 0.231 1
1 894 . 6 1 1 A 90 90 GLY HA2 H 90 3.672 3.506 0.166 1
1 895 . 6 1 1 A 90 90 GLY HA3 H 90 3.871 3.557 0.314 1
1 896 . 6 1 1 A 90 90 GLY C C 90 177.033 175.352 1.681 1
1 897 . 6 1 1 A 90 90 GLY CA C 90 46.813 46.989 -0.176 1
1 898 . 6 1 1 A 90 90 GLY N N 90 107.679 107.303 0.376 1
1 899 . 6 1 1 A 91 91 LEU H H 91 8.504 7.769 0.735 1
1 900 . 6 1 1 A 91 91 LEU HA H 91 3.784 3.771 0.013 1
1 910 . 6 1 1 A 91 91 LEU C C 91 178.003 179.394 -1.391 1
1 911 . 6 1 1 A 91 91 LEU CA C 91 57.354 57.364 -0.010 1
1 912 . 6 1 1 A 91 91 LEU CB C 91 40.359 40.832 -0.473 1
1 916 . 6 1 1 A 91 91 LEU N N 91 123.959 120.976 2.983 1
1 917 . 6 1 1 A 92 92 GLU H H 92 8.324 8.263 0.061 1
1 918 . 6 1 1 A 92 92 GLU HA H 92 3.732 3.934 -0.202 1
1 922 . 6 1 1 A 92 92 GLU C C 92 177.272 178.322 -1.050 1
1 923 . 6 1 1 A 92 92 GLU CA C 92 60.651 59.697 0.954 1
1 924 . 6 1 1 A 92 92 GLU CB C 92 30.843 29.230 1.613 1
1 926 . 6 1 1 A 92 92 GLU N N 92 121.991 121.109 0.882 1
1 927 . 6 1 1 A 93 93 ALA H H 93 8.126 7.785 0.341 1
1 928 . 6 1 1 A 93 93 ALA HA H 93 4.160 4.059 0.101 1
1 932 . 6 1 1 A 93 93 ALA C C 93 180.818 178.935 1.883 1
1 933 . 6 1 1 A 93 93 ALA CA C 93 54.828 54.715 0.113 1
1 934 . 6 1 1 A 93 93 ALA CB C 93 18.032 17.725 0.307 1
1 935 . 6 1 1 A 93 93 ALA N N 93 120.066 122.294 -2.228 1
1 936 . 6 1 1 A 94 94 TYR H H 94 7.916 7.316 0.600 1
1 937 . 6 1 1 A 94 94 TYR HA H 94 4.139 4.432 -0.293 1
1 942 . 6 1 1 A 94 94 TYR C C 94 175.895 178.557 -2.662 1
1 943 . 6 1 1 A 94 94 TYR CA C 94 61.915 61.600 0.315 1
1 944 . 6 1 1 A 94 94 TYR CB C 94 38.740 38.694 0.046 1
1 945 . 6 1 1 A 94 94 TYR N N 94 121.179 115.916 5.263 1
1 946 . 6 1 1 A 95 95 ILE H H 95 7.983 8.350 -0.367 1
1 947 . 6 1 1 A 95 95 ILE HA H 95 3.614 3.820 -0.206 1
1 957 . 6 1 1 A 95 95 ILE C C 95 174.678 178.691 -4.013 1
1 958 . 6 1 1 A 95 95 ILE CA C 95 63.461 65.035 -1.574 1
1 959 . 6 1 1 A 95 95 ILE CB C 95 36.625 37.832 -1.207 1
1 963 . 6 1 1 A 95 95 ILE N N 95 116.397 120.583 -4.186 1
1 964 . 6 1 1 A 96 96 GLN H H 96 8.175 8.956 -0.781 1
1 965 . 6 1 1 A 96 96 GLN HA H 96 3.763 4.107 -0.344 1
1 970 . 6 1 1 A 96 96 GLN C C 96 179.042 178.393 0.649 1
1 971 . 6 1 1 A 96 96 GLN CA C 96 59.270 58.161 1.109 1
1 972 . 6 1 1 A 96 96 GLN CB C 96 27.696 27.801 -0.105 1
1 974 . 6 1 1 A 96 96 GLN N N 96 116.631 120.057 -3.426 1
1 976 . 6 1 1 A 97 97 GLY H H 97 8.222 8.203 0.019 1
1 977 . 6 1 1 A 97 97 GLY HA2 H 97 3.661 3.789 -0.128 1
1 978 . 6 1 1 A 97 97 GLY HA3 H 97 3.806 3.806 0.000 1
1 979 . 6 1 1 A 97 97 GLY C C 97 175.449 176.128 -0.679 1
1 980 . 6 1 1 A 97 97 GLY CA C 97 46.917 47.426 -0.509 1
1 981 . 6 1 1 A 97 97 GLY N N 97 107.315 108.764 -1.449 1
1 982 . 6 1 1 A 98 98 ILE H H 98 7.630 8.209 -0.579 1
1 983 . 6 1 1 A 98 98 ILE HA H 98 3.399 3.918 -0.519 1
1 993 . 6 1 1 A 98 98 ILE C C 98 178.683 178.005 0.678 1
1 994 . 6 1 1 A 98 98 ILE CA C 98 66.402 64.731 1.671 1
1 995 . 6 1 1 A 98 98 ILE CB C 98 38.037 37.519 0.518 1
1 999 . 6 1 1 A 98 98 ILE N N 98 120.644 120.675 -0.031 1
1 1000 . 6 1 1 A 99 99 LEU H H 99 7.076 7.919 -0.843 1
1 1001 . 6 1 1 A 99 99 LEU HA H 99 4.133 4.362 -0.229 1
1 1010 . 6 1 1 A 99 99 LEU C C 99 178.128 178.308 -0.180 1
1 1011 . 6 1 1 A 99 99 LEU CA C 99 57.129 58.207 -1.078 1
1 1012 . 6 1 1 A 99 99 LEU CB C 99 41.108 41.686 -0.578 1
1 1014 . 6 1 1 A 99 99 LEU N N 99 116.844 123.939 -7.095 1
1 1015 . 6 1 1 A 100 100 TYR H H 100 7.890 8.493 -0.603 1
1 1016 . 6 1 1 A 100 100 TYR HA H 100 4.550 4.147 0.403 1
1 1021 . 6 1 1 A 100 100 TYR C C 100 178.210 177.539 0.671 1
1 1022 . 6 1 1 A 100 100 TYR CA C 100 59.452 61.096 -1.644 1
1 1023 . 6 1 1 A 100 100 TYR CB C 100 38.786 38.628 0.158 1
1 1024 . 6 1 1 A 100 100 TYR N N 100 116.427 119.728 -3.301 1
1 1025 . 6 1 1 A 101 101 LEU H H 101 8.041 8.412 -0.371 1
1 1026 . 6 1 1 A 101 101 LEU HA H 101 4.158 3.842 0.316 1
1 1036 . 6 1 1 A 101 101 LEU C C 101 176.808 177.722 -0.914 1
1 1037 . 6 1 1 A 101 101 LEU CA C 101 56.156 58.175 -2.019 1
1 1038 . 6 1 1 A 101 101 LEU CB C 101 44.307 41.740 2.567 1
1 1041 . 6 1 1 A 101 101 LEU N N 101 116.493 120.347 -3.854 1
1 1042 . 6 1 1 A 102 102 ASN H H 102 7.146 8.243 -1.097 1
1 1043 . 6 1 1 A 102 102 ASN HA H 102 5.056 5.139 -0.083 1
1 1046 . 6 1 1 A 102 102 ASN CA C 102 52.704 54.947 -2.243 1
1 1047 . 6 1 1 A 102 102 ASN CB C 102 42.424 40.572 1.852 1
1 1048 . 6 1 1 A 102 102 ASN N N 102 114.922 114.867 0.055 1
1 1049 . 6 1 1 A 103 103 GLN H H 103 8.477 8.129 0.348 1
1 1050 . 6 1 1 A 103 103 GLN HA H 103 3.866 4.262 -0.396 1
1 1054 . 6 1 1 A 103 103 GLN C C 103 176.110 176.472 -0.362 1
1 1055 . 6 1 1 A 103 103 GLN CA C 103 58.451 54.520 3.931 1
1 1056 . 6 1 1 A 103 103 GLN CB C 103 28.896 27.957 0.939 1
1 1058 . 6 1 1 A 103 103 GLN N N 103 120.252 116.164 4.088 1
1 1059 . 6 1 1 A 104 104 GLU H H 104 7.930 8.264 -0.334 1
1 1060 . 6 1 1 A 104 104 GLU HA H 104 4.591 4.664 -0.073 1
1 1064 . 6 1 1 A 104 104 GLU C C 104 175.397 175.704 -0.307 1
1 1065 . 6 1 1 A 104 104 GLU CA C 104 54.058 58.587 -4.529 1
1 1066 . 6 1 1 A 104 104 GLU CB C 104 31.272 29.181 2.091 1
1 1068 . 6 1 1 A 104 104 GLU N N 104 117.295 119.370 -2.075 1
1 1069 . 6 1 1 A 105 105 VAL H H 105 8.546 8.183 0.363 1
1 1070 . 6 1 1 A 105 105 VAL HA H 105 3.823 4.481 -0.658 1
1 1078 . 6 1 1 A 105 105 VAL CA C 105 60.706 59.180 1.526 1
1 1079 . 6 1 1 A 105 105 VAL CB C 105 32.126 32.869 -0.743 1
1 1082 . 6 1 1 A 105 105 VAL N N 105 124.511 124.543 -0.032 1
1 1083 . 6 1 1 A 106 106 PRO HA H 106 3.997 4.537 -0.540 1
1 1089 . 6 1 1 A 106 106 PRO C C 106 178.240 177.933 0.307 1
1 1090 . 6 1 1 A 106 106 PRO CA C 106 62.961 63.274 -0.313 1
1 1091 . 6 1 1 A 106 106 PRO CB C 106 32.321 31.878 0.443 1
1 1094 . 6 1 1 A 107 107 LYS H H 107 9.122 8.951 0.171 1
1 1095 . 6 1 1 A 107 107 LYS HA H 107 3.813 3.906 -0.093 1
1 1101 . 6 1 1 A 107 107 LYS C C 107 178.563 177.556 1.007 1
1 1102 . 6 1 1 A 107 107 LYS CA C 107 60.085 59.545 0.540 1
1 1103 . 6 1 1 A 107 107 LYS CB C 107 31.632 32.280 -0.648 1
1 1106 . 6 1 1 A 107 107 LYS N N 107 129.017 125.045 3.972 1
1 1107 . 6 1 1 A 108 108 GLU H H 108 10.370 8.002 2.368 1
1 1108 . 6 1 1 A 108 108 GLU HA H 108 3.991 4.041 -0.050 1
1 1111 . 6 1 1 A 108 108 GLU C C 108 180.366 178.735 1.631 1
1 1112 . 6 1 1 A 108 108 GLU CA C 108 60.337 58.800 1.537 1
1 1113 . 6 1 1 A 108 108 GLU CB C 108 29.178 29.457 -0.279 1
1 1115 . 6 1 1 A 108 108 GLU N N 108 118.335 118.715 -0.380 1
1 1116 . 6 1 1 A 109 109 LEU H H 109 7.393 7.924 -0.531 1
1 1117 . 6 1 1 A 109 109 LEU HA H 109 4.220 4.418 -0.198 1
1 1126 . 6 1 1 A 109 109 LEU C C 109 177.378 179.145 -1.767 1
1 1127 . 6 1 1 A 109 109 LEU CA C 109 56.618 57.666 -1.048 1
1 1128 . 6 1 1 A 109 109 LEU CB C 109 41.898 41.834 0.064 1
1 1131 . 6 1 1 A 109 109 LEU N N 109 118.285 121.238 -2.953 1
1 1132 . 6 1 1 A 110 110 LEU H H 110 7.641 8.049 -0.408 1
1 1133 . 6 1 1 A 110 110 LEU HA H 110 3.796 4.018 -0.222 1
1 1142 . 6 1 1 A 110 110 LEU C C 110 179.103 179.012 0.091 1
1 1143 . 6 1 1 A 110 110 LEU CA C 110 59.046 57.266 1.780 1
1 1144 . 6 1 1 A 110 110 LEU CB C 110 40.228 41.214 -0.986 1
1 1147 . 6 1 1 A 110 110 LEU N N 110 120.162 118.610 1.552 1
1 1148 . 6 1 1 A 111 111 GLU H H 111 7.916 7.911 0.005 1
1 1149 . 6 1 1 A 111 111 GLU HA H 111 4.080 4.145 -0.065 1
1 1153 . 6 1 1 A 111 111 GLU C C 111 179.967 178.501 1.466 1
1 1154 . 6 1 1 A 111 111 GLU CA C 111 59.243 58.407 0.836 1
1 1155 . 6 1 1 A 111 111 GLU CB C 111 29.576 29.565 0.011 1
1 1157 . 6 1 1 A 111 111 GLU N N 111 117.360 119.726 -2.366 1
1 1158 . 6 1 1 A 112 112 PHE H H 112 7.712 7.323 0.389 1
1 1159 . 6 1 1 A 112 112 PHE HA H 112 4.224 4.384 -0.160 1
1 1164 . 6 1 1 A 112 112 PHE C C 112 177.180 176.718 0.462 1
1 1165 . 6 1 1 A 112 112 PHE CA C 112 61.407 60.639 0.768 1
1 1166 . 6 1 1 A 112 112 PHE CB C 112 40.172 39.638 0.534 1
1 1167 . 6 1 1 A 112 112 PHE N N 112 123.042 118.355 4.687 1
1 1168 . 6 1 1 A 113 113 LEU H H 113 8.056 8.048 0.008 1
1 1169 . 6 1 1 A 113 113 LEU HA H 113 4.147 4.351 -0.204 1
1 1175 . 6 1 1 A 113 113 LEU C C 113 173.717 175.940 -2.223 1
1 1176 . 6 1 1 A 113 113 LEU CA C 113 54.093 54.502 -0.409 1
1 1177 . 6 1 1 A 113 113 LEU CB C 113 41.517 41.871 -0.354 1
1 1179 . 6 1 1 A 113 113 LEU N N 113 115.595 116.955 -1.360 1
1 1180 . 6 1 1 A 114 114 ARG H H 114 7.902 8.031 -0.129 1
1 1181 . 6 1 1 A 114 114 ARG HA H 114 3.817 4.731 -0.914 1
1 1182 . 6 1 1 A 114 114 ARG C C 114 174.566 176.085 -1.519 1
1 1183 . 6 1 1 A 114 114 ARG CA C 114 57.233 57.209 0.024 1
1 1184 . 6 1 1 A 114 114 ARG CB C 114 27.788 26.713 1.075 1
1 1185 . 6 1 1 A 114 114 ARG N N 114 116.021 115.269 0.752 1
1 1186 . 6 1 1 A 115 115 LEU H H 115 8.160 7.876 0.284 1
1 1187 . 6 1 1 A 115 115 LEU HA H 115 4.462 4.166 0.296 1
1 1195 . 6 1 1 A 115 115 LEU C C 115 176.374 177.379 -1.005 1
1 1196 . 6 1 1 A 115 115 LEU CA C 115 53.965 56.827 -2.862 1
1 1197 . 6 1 1 A 115 115 LEU CB C 115 44.077 41.793 2.284 1
1 1199 . 6 1 1 A 115 115 LEU N N 115 118.089 119.439 -1.350 1
1 1200 . 6 1 1 A 116 116 ARG H H 116 8.066 7.760 0.306 1
1 1201 . 6 1 1 A 116 116 ARG HA H 116 4.172 4.531 -0.359 1
1 1203 . 6 1 1 A 116 116 ARG CA C 116 55.961 56.740 -0.779 1
1 1204 . 6 1 1 A 116 116 ARG CB C 116 31.379 30.336 1.043 1
1 1205 . 6 1 1 A 116 116 ARG N N 116 120.852 118.979 1.873 1
1 1206 . 6 1 1 A 117 117 HIS H H 117 7.928 9.023 -1.095 1
1 1207 . 6 1 1 A 117 117 HIS HA H 117 4.557 4.405 0.152 1
1 1211 . 6 1 1 A 117 117 HIS CA C 117 55.937 57.096 -1.159 1
1 1212 . 6 1 1 A 117 117 HIS CB C 117 30.875 29.093 1.782 1
1 1213 . 6 1 1 A 118 118 PHE H H 118 8.183 8.181 0.002 1
1 1214 . 6 1 1 A 118 118 PHE HA H 118 4.730 4.672 0.058 1
1 1219 . 6 1 1 A 118 118 PHE CA C 118 55.716 55.562 0.154 1
1 1220 . 6 1 1 A 118 118 PHE CB C 118 39.263 39.659 -0.396 1
1 1221 . 6 1 1 A 118 118 PHE N N 118 123.480 119.940 3.540 1
1 1222 . 6 1 1 A 119 119 PRO HA H 119 4.398 4.457 -0.059 1
1 1227 . 6 1 1 A 119 119 PRO C C 119 176.666 176.336 0.330 1
1 1228 . 6 1 1 A 119 119 PRO CA C 119 63.377 62.098 1.279 1
1 1229 . 6 1 1 A 119 119 PRO CB C 119 32.059 32.938 -0.879 1
1 1232 . 6 1 1 A 120 120 THR H H 120 8.054 8.212 -0.158 1
1 1233 . 6 1 1 A 120 120 THR HA H 120 4.273 4.446 -0.173 1
1 1238 . 6 1 1 A 120 120 THR C C 120 174.154 173.387 0.767 1
1 1239 . 6 1 1 A 120 120 THR CA C 120 61.893 60.576 1.317 1
1 1240 . 6 1 1 A 120 120 THR CB C 120 69.736 70.152 -0.416 1
1 1242 . 6 1 1 A 120 120 THR N N 120 113.088 112.033 1.055 1
1 1243 . 6 1 1 A 121 121 ASP H H 121 8.209 8.642 -0.433 1
1 1244 . 6 1 1 A 121 121 ASP HA H 121 4.876 4.748 0.128 1
1 1247 . 6 1 1 A 121 121 ASP CA C 121 52.126 51.334 0.792 1
1 1248 . 6 1 1 A 121 121 ASP CB C 121 41.553 41.800 -0.247 1
1 1249 . 6 1 1 A 121 121 ASP N N 121 123.630 124.686 -1.056 1
1 1250 . 6 1 1 A 122 122 PRO HA H 122 4.363 4.433 -0.070 1
1 1255 . 6 1 1 A 122 122 PRO C C 122 177.344 175.365 1.979 1
1 1256 . 6 1 1 A 122 122 PRO CA C 122 63.913 63.335 0.578 1
1 1257 . 6 1 1 A 122 122 PRO CB C 122 32.116 31.861 0.255 1
1 1260 . 6 1 1 A 123 123 LYS H H 123 8.344 8.669 -0.325 1
1 1261 . 6 1 1 A 123 123 LYS HA H 123 4.244 4.772 -0.528 1
1 1266 . 6 1 1 A 123 123 LYS C C 123 176.637 174.656 1.981 1
1 1267 . 6 1 1 A 123 123 LYS CA C 123 56.359 55.429 0.930 1
1 1268 . 6 1 1 A 123 123 LYS CB C 123 32.367 36.199 -3.832 1
1 1272 . 6 1 1 A 123 123 LYS N N 123 119.110 123.520 -4.410 1
1 1273 . 6 1 1 A 124 124 ALA H H 124 7.929 8.966 -1.037 1
1 1274 . 6 1 1 A 124 124 ALA HA H 124 4.248 4.741 -0.493 1
1 1278 . 6 1 1 A 124 124 ALA C C 124 177.648 176.484 1.164 1
1 1279 . 6 1 1 A 124 124 ALA CA C 124 52.618 51.297 1.321 1
1 1280 . 6 1 1 A 124 124 ALA CB C 124 19.379 19.419 -0.040 1
1 1281 . 6 1 1 A 124 124 ALA N N 124 123.825 129.940 -6.115 1
1 1282 . 6 1 1 A 125 125 SER H H 125 8.134 8.806 -0.672 1
1 1283 . 6 1 1 A 125 125 SER HA H 125 4.341 5.222 -0.881 1
1 1286 . 6 1 1 A 125 125 SER C C 125 174.172 172.770 1.402 1
1 1287 . 6 1 1 A 125 125 SER CA C 125 58.391 56.778 1.613 1
1 1288 . 6 1 1 A 125 125 SER CB C 125 63.748 65.110 -1.362 1
1 1289 . 6 1 1 A 125 125 SER N N 125 114.454 118.231 -3.777 1
1 1290 . 6 1 1 A 126 126 ASN H H 126 8.242 8.915 -0.673 1
1 1291 . 6 1 1 A 126 126 ASN HA H 126 4.657 5.596 -0.939 1
1 1294 . 6 1 1 A 126 126 ASN C C 126 174.624 173.457 1.167 1
1 1295 . 6 1 1 A 126 126 ASN CA C 126 53.292 52.386 0.906 1
1 1296 . 6 1 1 A 126 126 ASN CB C 126 38.797 42.372 -3.575 1
1 1297 . 6 1 1 A 126 126 ASN N N 126 120.102 122.745 -2.643 1
1 1298 . 6 1 1 A 127 127 TRP H H 127 8.051 8.622 -0.571 1
1 1299 . 6 1 1 A 127 127 TRP HA H 127 4.694 5.219 -0.525 1
1 1302 . 6 1 1 A 127 127 TRP C C 127 175.479 174.908 0.571 1
1 1303 . 6 1 1 A 127 127 TRP CA C 127 57.096 56.196 0.900 1
1 1304 . 6 1 1 A 127 127 TRP CB C 127 29.820 32.641 -2.821 1
1 1305 . 6 1 1 A 127 127 TRP N N 127 121.198 121.526 -0.328 1
1 1 . 7 1 1 A 7 7 HIS HA H 7 4.623 5.363 -0.740 1
1 4 . 7 1 1 A 7 7 HIS C C 7 174.747 174.361 0.386 1
1 5 . 7 1 1 A 7 7 HIS CA C 7 56.189 54.355 1.834 1
1 6 . 7 1 1 A 7 7 HIS CB C 7 30.028 32.860 -2.832 1
1 7 . 7 1 1 A 8 8 LEU H H 8 8.283 8.541 -0.258 1
1 8 . 7 1 1 A 8 8 LEU HA H 8 4.249 4.634 -0.385 1
1 10 . 7 1 1 A 8 8 LEU C C 8 176.700 176.753 -0.053 1
1 11 . 7 1 1 A 8 8 LEU CA C 8 55.498 53.792 1.706 1
1 12 . 7 1 1 A 8 8 LEU CB C 8 42.568 42.822 -0.254 1
1 13 . 7 1 1 A 8 8 LEU N N 8 122.916 124.506 -1.590 1
1 14 . 7 1 1 A 9 9 GLU H H 9 8.623 8.521 0.102 1
1 15 . 7 1 1 A 9 9 GLU HA H 9 4.311 4.187 0.124 1
1 16 . 7 1 1 A 9 9 GLU C C 9 174.811 175.942 -1.131 1
1 17 . 7 1 1 A 9 9 GLU CA C 9 56.377 57.792 -1.415 1
1 18 . 7 1 1 A 9 9 GLU CB C 9 29.557 30.286 -0.729 1
1 20 . 7 1 1 A 9 9 GLU N N 9 121.512 120.005 1.507 1
1 21 . 7 1 1 A 10 10 LEU H H 10 7.853 8.449 -0.596 1
1 22 . 7 1 1 A 10 10 LEU HA H 10 5.225 5.277 -0.052 1
1 31 . 7 1 1 A 10 10 LEU C C 10 174.637 174.630 0.007 1
1 32 . 7 1 1 A 10 10 LEU CA C 10 54.513 54.132 0.381 1
1 33 . 7 1 1 A 10 10 LEU CB C 10 45.187 46.260 -1.073 1
1 36 . 7 1 1 A 10 10 LEU N N 10 123.592 123.746 -0.154 1
1 37 . 7 1 1 A 11 11 GLU H H 11 8.894 8.724 0.170 1
1 38 . 7 1 1 A 11 11 GLU HA H 11 4.765 5.072 -0.307 1
1 43 . 7 1 1 A 11 11 GLU C C 11 174.563 174.633 -0.070 1
1 44 . 7 1 1 A 11 11 GLU CA C 11 55.047 55.155 -0.108 1
1 45 . 7 1 1 A 11 11 GLU CB C 11 33.760 32.622 1.138 1
1 47 . 7 1 1 A 11 11 GLU N N 11 124.055 124.502 -0.447 1
1 48 . 7 1 1 A 12 12 VAL H H 12 8.607 8.759 -0.152 1
1 49 . 7 1 1 A 12 12 VAL HA H 12 5.174 5.469 -0.295 1
1 57 . 7 1 1 A 12 12 VAL C C 12 173.573 174.399 -0.826 1
1 58 . 7 1 1 A 12 12 VAL CA C 12 60.296 60.768 -0.472 1
1 59 . 7 1 1 A 12 12 VAL CB C 12 35.689 35.122 0.567 1
1 62 . 7 1 1 A 12 12 VAL N N 12 120.878 125.158 -4.280 1
1 63 . 7 1 1 A 13 13 HIS H H 13 8.982 8.773 0.209 1
1 64 . 7 1 1 A 13 13 HIS HA H 13 4.824 5.118 -0.294 1
1 69 . 7 1 1 A 13 13 HIS C C 13 173.236 171.755 1.481 1
1 70 . 7 1 1 A 13 13 HIS CA C 13 54.906 54.290 0.616 1
1 71 . 7 1 1 A 13 13 HIS CB C 13 33.496 31.702 1.794 1
1 72 . 7 1 1 A 13 13 HIS N N 13 121.504 120.261 1.243 1
1 73 . 7 1 1 A 14 14 ILE H H 14 10.442 8.645 1.797 1
1 74 . 7 1 1 A 14 14 ILE HA H 14 5.458 4.761 0.697 1
1 84 . 7 1 1 A 14 14 ILE CA C 14 58.386 57.682 0.704 1
1 85 . 7 1 1 A 14 14 ILE CB C 14 38.596 38.098 0.498 1
1 88 . 7 1 1 A 14 14 ILE N N 14 119.923 120.612 -0.689 1
1 89 . 7 1 1 A 15 15 PRO HA H 15 4.560 4.198 0.362 1
1 95 . 7 1 1 A 15 15 PRO C C 15 176.907 176.376 0.531 1
1 96 . 7 1 1 A 15 15 PRO CA C 15 64.342 64.270 0.072 1
1 97 . 7 1 1 A 15 15 PRO CB C 15 32.924 32.115 0.809 1
1 100 . 7 1 1 A 16 16 SER H H 16 7.331 7.655 -0.324 1
1 101 . 7 1 1 A 16 16 SER HA H 16 4.822 4.901 -0.079 1
1 104 . 7 1 1 A 16 16 SER C C 16 171.253 172.343 -1.090 1
1 105 . 7 1 1 A 16 16 SER CA C 16 57.135 57.764 -0.629 1
1 106 . 7 1 1 A 16 16 SER CB C 16 65.947 67.014 -1.067 1
1 107 . 7 1 1 A 16 16 SER N N 16 107.745 113.908 -6.163 1
1 108 . 7 1 1 A 17 17 VAL H H 17 8.350 8.394 -0.044 1
1 109 . 7 1 1 A 17 17 VAL HA H 17 4.926 5.021 -0.095 1
1 117 . 7 1 1 A 17 17 VAL C C 17 173.692 175.295 -1.603 1
1 118 . 7 1 1 A 17 17 VAL CA C 17 58.721 60.417 -1.696 1
1 119 . 7 1 1 A 17 17 VAL CB C 17 34.420 35.845 -1.425 1
1 122 . 7 1 1 A 17 17 VAL N N 17 118.680 122.894 -4.214 1
1 123 . 7 1 1 A 18 18 GLY H H 18 8.332 8.563 -0.231 1
1 124 . 7 1 1 A 18 18 GLY HA2 H 18 4.189 4.267 -0.078 1
1 125 . 7 1 1 A 18 18 GLY HA3 H 18 4.011 4.271 -0.260 1
1 126 . 7 1 1 A 18 18 GLY CA C 18 45.356 45.123 0.233 1
1 127 . 7 1 1 A 18 18 GLY N N 18 112.549 112.243 0.306 1
1 128 . 7 1 1 A 19 19 PRO HA H 19 4.757 4.543 0.214 1
1 134 . 7 1 1 A 19 19 PRO C C 19 177.482 176.417 1.065 1
1 135 . 7 1 1 A 19 19 PRO CA C 19 62.848 62.808 0.040 1
1 136 . 7 1 1 A 19 19 PRO CB C 19 32.283 32.327 -0.044 1
1 139 . 7 1 1 A 20 20 GLU H H 20 8.588 8.454 0.134 1
1 140 . 7 1 1 A 20 20 GLU HA H 20 4.147 4.388 -0.241 1
1 144 . 7 1 1 A 20 20 GLU C C 20 175.857 175.952 -0.095 1
1 145 . 7 1 1 A 20 20 GLU CA C 20 57.150 54.978 2.172 1
1 146 . 7 1 1 A 20 20 GLU CB C 20 30.923 31.556 -0.633 1
1 148 . 7 1 1 A 20 20 GLU N N 20 122.087 121.915 0.172 1
1 149 . 7 1 1 A 21 21 ALA H H 21 8.352 8.507 -0.155 1
1 150 . 7 1 1 A 21 21 ALA HA H 21 4.391 4.369 0.022 1
1 154 . 7 1 1 A 21 21 ALA C C 21 174.910 176.974 -2.064 1
1 155 . 7 1 1 A 21 21 ALA CA C 21 52.166 52.544 -0.378 1
1 156 . 7 1 1 A 21 21 ALA CB C 21 19.915 18.598 1.317 1
1 157 . 7 1 1 A 21 21 ALA N N 21 124.593 124.754 -0.161 1
1 158 . 7 1 1 A 22 22 GLU H H 22 8.398 8.640 -0.242 1
1 159 . 7 1 1 A 22 22 GLU HA H 22 4.331 4.275 0.056 1
1 163 . 7 1 1 A 22 22 GLU C C 22 176.389 176.964 -0.575 1
1 164 . 7 1 1 A 22 22 GLU CA C 22 56.316 57.436 -1.120 1
1 165 . 7 1 1 A 22 22 GLU CB C 22 30.713 29.282 1.431 1
1 167 . 7 1 1 A 22 22 GLU N N 22 120.159 123.727 -3.568 1
1 168 . 7 1 1 A 23 23 GLY H H 23 8.246 9.263 -1.017 1
1 169 . 7 1 1 A 23 23 GLY HA2 H 23 4.162 3.954 0.208 1
1 170 . 7 1 1 A 23 23 GLY HA3 H 23 4.061 3.971 0.090 1
1 171 . 7 1 1 A 23 23 GLY CA C 23 44.801 46.928 -2.127 1
1 172 . 7 1 1 A 23 23 GLY N N 23 110.080 112.196 -2.116 1
1 173 . 7 1 1 A 24 24 PRO HA H 24 4.417 4.591 -0.174 1
1 178 . 7 1 1 A 24 24 PRO C C 24 177.135 176.342 0.793 1
1 179 . 7 1 1 A 24 24 PRO CA C 24 63.520 64.127 -0.607 1
1 180 . 7 1 1 A 24 24 PRO CB C 24 32.124 32.102 0.022 1
1 183 . 7 1 1 A 25 25 ARG H H 25 8.409 7.490 0.919 1
1 184 . 7 1 1 A 25 25 ARG HA H 25 4.298 4.765 -0.467 1
1 187 . 7 1 1 A 25 25 ARG C C 25 176.217 173.984 2.233 1
1 188 . 7 1 1 A 25 25 ARG CA C 25 56.237 55.103 1.134 1
1 189 . 7 1 1 A 25 25 ARG CB C 25 30.467 34.041 -3.574 1
1 192 . 7 1 1 A 25 25 ARG N N 25 120.147 116.773 3.374 1
1 193 . 7 1 1 A 26 26 GLN H H 26 8.278 8.506 -0.228 1
1 194 . 7 1 1 A 26 26 GLN HA H 26 4.336 4.539 -0.203 1
1 200 . 7 1 1 A 26 26 GLN C C 26 175.566 175.010 0.556 1
1 201 . 7 1 1 A 26 26 GLN CA C 26 55.788 55.792 -0.004 1
1 202 . 7 1 1 A 26 26 GLN CB C 26 29.714 29.334 0.380 1
1 204 . 7 1 1 A 26 26 GLN N N 26 120.460 124.576 -4.116 1
1 206 . 7 1 1 A 27 27 SER H H 27 8.298 8.487 -0.189 1
1 208 . 7 1 1 A 27 27 SER CA C 27 56.156 55.498 0.658 1
1 209 . 7 1 1 A 27 27 SER CB C 27 63.813 64.855 -1.042 1
1 210 . 7 1 1 A 27 27 SER N N 27 117.382 123.867 -6.485 1
1 211 . 7 1 1 A 28 28 PRO HA H 28 4.366 4.377 -0.011 1
1 216 . 7 1 1 A 28 28 PRO C C 28 177.555 176.626 0.929 1
1 217 . 7 1 1 A 28 28 PRO CA C 28 64.486 65.403 -0.917 1
1 218 . 7 1 1 A 28 28 PRO CB C 28 31.892 31.850 0.042 1
1 221 . 7 1 1 A 29 29 GLU H H 29 8.582 7.719 0.863 1
1 222 . 7 1 1 A 29 29 GLU HA H 29 4.218 4.668 -0.450 1
1 226 . 7 1 1 A 29 29 GLU CA C 29 57.261 55.255 2.006 1
1 227 . 7 1 1 A 29 29 GLU CB C 29 29.633 31.030 -1.397 1
1 229 . 7 1 1 A 29 29 GLU N N 29 118.309 114.058 4.251 1
1 230 . 7 1 1 A 30 30 LYS H H 30 7.955 8.680 -0.725 1
1 231 . 7 1 1 A 30 30 LYS HA H 30 4.328 4.978 -0.650 1
1 236 . 7 1 1 A 30 30 LYS C C 30 176.222 175.411 0.811 1
1 237 . 7 1 1 A 30 30 LYS CA C 30 56.247 55.177 1.070 1
1 238 . 7 1 1 A 30 30 LYS CB C 30 32.720 34.491 -1.771 1
1 242 . 7 1 1 A 30 30 LYS N N 30 120.129 121.054 -0.925 1
1 243 . 7 1 1 A 31 31 SER H H 31 7.883 9.038 -1.155 1
1 244 . 7 1 1 A 31 31 SER HA H 31 4.458 4.834 -0.376 1
1 246 . 7 1 1 A 31 31 SER C C 31 174.129 174.841 -0.712 1
1 247 . 7 1 1 A 31 31 SER CA C 31 58.477 58.395 0.082 1
1 248 . 7 1 1 A 31 31 SER CB C 31 64.042 63.309 0.733 1
1 249 . 7 1 1 A 31 31 SER N N 31 115.366 121.507 -6.141 1
1 250 . 7 1 1 A 32 32 HIS H H 32 8.485 8.410 0.075 1
1 251 . 7 1 1 A 32 32 HIS HA H 32 4.450 4.883 -0.433 1
1 255 . 7 1 1 A 32 32 HIS CA C 32 56.009 55.092 0.917 1
1 256 . 7 1 1 A 32 32 HIS CB C 32 31.122 31.228 -0.106 1
1 257 . 7 1 1 A 32 32 HIS N N 32 121.500 118.809 2.691 1
1 258 . 7 1 1 A 33 33 MET H H 33 8.392 7.628 0.764 1
1 259 . 7 1 1 A 33 33 MET HA H 33 4.601 4.671 -0.070 1
1 265 . 7 1 1 A 33 33 MET C C 33 175.842 173.938 1.904 1
1 266 . 7 1 1 A 33 33 MET CA C 33 54.533 54.049 0.484 1
1 267 . 7 1 1 A 33 33 MET CB C 33 32.868 35.428 -2.560 1
1 270 . 7 1 1 A 33 33 MET N N 33 120.204 119.301 0.903 1
1 271 . 7 1 1 A 34 34 VAL H H 34 8.938 8.958 -0.020 1
1 272 . 7 1 1 A 34 34 VAL HA H 34 4.430 4.740 -0.310 1
1 280 . 7 1 1 A 34 34 VAL C C 34 174.149 174.293 -0.144 1
1 281 . 7 1 1 A 34 34 VAL CA C 34 60.703 59.903 0.800 1
1 282 . 7 1 1 A 34 34 VAL CB C 34 34.319 34.601 -0.282 1
1 285 . 7 1 1 A 34 34 VAL N N 34 118.512 126.155 -7.643 1
1 286 . 7 1 1 A 35 35 PHE H H 35 9.242 8.608 0.634 1
1 287 . 7 1 1 A 35 35 PHE HA H 35 4.439 5.703 -1.264 1
1 294 . 7 1 1 A 35 35 PHE C C 35 174.831 173.731 1.100 1
1 295 . 7 1 1 A 35 35 PHE CA C 35 57.754 54.958 2.796 1
1 296 . 7 1 1 A 35 35 PHE CB C 35 38.959 42.420 -3.461 1
1 297 . 7 1 1 A 35 35 PHE N N 35 124.912 125.737 -0.825 1
1 298 . 7 1 1 A 36 36 ARG H H 36 8.475 9.195 -0.720 1
1 299 . 7 1 1 A 36 36 ARG HA H 36 4.135 4.815 -0.680 1
1 304 . 7 1 1 A 36 36 ARG C C 36 172.865 175.447 -2.582 1
1 305 . 7 1 1 A 36 36 ARG CA C 36 56.895 55.636 1.259 1
1 306 . 7 1 1 A 36 36 ARG CB C 36 28.962 30.465 -1.503 1
1 308 . 7 1 1 A 36 36 ARG N N 36 125.680 120.414 5.266 1
1 309 . 7 1 1 A 37 37 VAL H H 37 8.066 8.875 -0.809 1
1 310 . 7 1 1 A 37 37 VAL HA H 37 4.292 4.458 -0.166 1
1 318 . 7 1 1 A 37 37 VAL C C 37 174.595 174.441 0.154 1
1 319 . 7 1 1 A 37 37 VAL CA C 37 62.727 61.415 1.312 1
1 320 . 7 1 1 A 37 37 VAL CB C 37 31.102 32.910 -1.808 1
1 323 . 7 1 1 A 37 37 VAL N N 37 125.403 120.813 4.590 1
1 324 . 7 1 1 A 38 38 GLU H H 38 9.532 9.088 0.444 1
1 325 . 7 1 1 A 38 38 GLU HA H 38 4.895 4.974 -0.079 1
1 329 . 7 1 1 A 38 38 GLU C C 38 174.509 175.071 -0.562 1
1 330 . 7 1 1 A 38 38 GLU CA C 38 55.650 54.958 0.692 1
1 331 . 7 1 1 A 38 38 GLU CB C 38 32.214 30.571 1.643 1
1 333 . 7 1 1 A 38 38 GLU N N 38 129.885 126.304 3.581 1
1 334 . 7 1 1 A 39 39 VAL H H 39 9.035 8.748 0.287 1
1 335 . 7 1 1 A 39 39 VAL HA H 39 4.446 4.536 -0.090 1
1 343 . 7 1 1 A 39 39 VAL C C 39 173.661 174.017 -0.356 1
1 344 . 7 1 1 A 39 39 VAL CA C 39 61.258 61.653 -0.395 1
1 345 . 7 1 1 A 39 39 VAL CB C 39 33.533 33.027 0.506 1
1 348 . 7 1 1 A 39 39 VAL N N 39 127.941 126.926 1.015 1
1 349 . 7 1 1 A 40 40 LEU H H 40 8.843 8.732 0.111 1
1 350 . 7 1 1 A 40 40 LEU HA H 40 5.130 5.164 -0.034 1
1 360 . 7 1 1 A 40 40 LEU C C 40 175.581 175.123 0.458 1
1 361 . 7 1 1 A 40 40 LEU CA C 40 53.702 53.740 -0.038 1
1 362 . 7 1 1 A 40 40 LEU CB C 40 43.989 44.187 -0.198 1
1 366 . 7 1 1 A 40 40 LEU N N 40 128.413 129.708 -1.295 1
1 367 . 7 1 1 A 41 41 CYS H H 41 8.959 9.078 -0.119 1
1 368 . 7 1 1 A 41 41 CYS HA H 41 5.174 5.122 0.052 1
1 371 . 7 1 1 A 41 41 CYS C C 41 175.043 173.675 1.368 1
1 372 . 7 1 1 A 41 41 CYS CA C 41 57.483 57.465 0.018 1
1 373 . 7 1 1 A 41 41 CYS CB C 41 28.472 29.610 -1.138 1
1 374 . 7 1 1 A 41 41 CYS N N 41 124.738 124.479 0.259 1
1 375 . 7 1 1 A 42 42 SER H H 42 9.527 9.431 0.096 1
1 376 . 7 1 1 A 42 42 SER HA H 42 4.149 4.232 -0.083 1
1 379 . 7 1 1 A 42 42 SER C C 42 175.014 174.488 0.526 1
1 380 . 7 1 1 A 42 42 SER CA C 42 59.058 59.492 -0.434 1
1 381 . 7 1 1 A 42 42 SER CB C 42 62.287 61.858 0.429 1
1 382 . 7 1 1 A 42 42 SER N N 42 125.889 117.606 8.283 1
1 383 . 7 1 1 A 43 43 GLY H H 43 8.685 8.413 0.272 1
1 384 . 7 1 1 A 43 43 GLY HA2 H 43 3.594 3.830 -0.236 1
1 385 . 7 1 1 A 43 43 GLY HA3 H 43 4.210 3.837 0.373 1
1 386 . 7 1 1 A 43 43 GLY C C 43 173.664 173.617 0.047 1
1 387 . 7 1 1 A 43 43 GLY CA C 43 45.404 45.251 0.153 1
1 388 . 7 1 1 A 43 43 GLY N N 43 104.633 105.830 -1.197 1
1 389 . 7 1 1 A 44 44 ARG H H 44 7.926 7.860 0.066 1
1 390 . 7 1 1 A 44 44 ARG HA H 44 4.678 4.643 0.035 1
1 395 . 7 1 1 A 44 44 ARG C C 44 175.261 175.354 -0.093 1
1 396 . 7 1 1 A 44 44 ARG CA C 44 55.011 54.934 0.077 1
1 397 . 7 1 1 A 44 44 ARG CB C 44 32.138 32.503 -0.365 1
1 400 . 7 1 1 A 44 44 ARG N N 44 121.239 120.716 0.523 1
1 401 . 7 1 1 A 45 45 ARG H H 45 8.775 8.798 -0.023 1
1 402 . 7 1 1 A 45 45 ARG HA H 45 5.770 5.446 0.324 1
1 409 . 7 1 1 A 45 45 ARG C C 45 176.064 175.056 1.008 1
1 410 . 7 1 1 A 45 45 ARG CA C 45 54.683 54.476 0.207 1
1 411 . 7 1 1 A 45 45 ARG CB C 45 33.748 33.397 0.351 1
1 414 . 7 1 1 A 45 45 ARG N N 45 125.948 123.626 2.322 1
1 415 . 7 1 1 A 46 46 HIS H H 46 8.912 8.570 0.342 1
1 416 . 7 1 1 A 46 46 HIS HA H 46 4.927 4.895 0.032 1
1 420 . 7 1 1 A 46 46 HIS C C 46 172.634 173.499 -0.865 1
1 421 . 7 1 1 A 46 46 HIS CA C 46 56.480 56.468 0.012 1
1 422 . 7 1 1 A 46 46 HIS CB C 46 33.608 32.911 0.697 1
1 423 . 7 1 1 A 46 46 HIS N N 46 121.825 120.610 1.215 1
1 424 . 7 1 1 A 47 47 THR H H 47 8.532 8.497 0.035 1
1 425 . 7 1 1 A 47 47 THR HA H 47 5.472 4.415 1.057 1
1 430 . 7 1 1 A 47 47 THR C C 47 174.442 173.880 0.562 1
1 431 . 7 1 1 A 47 47 THR CA C 47 61.093 62.522 -1.429 1
1 432 . 7 1 1 A 47 47 THR CB C 47 71.041 68.549 2.492 1
1 434 . 7 1 1 A 47 47 THR N N 47 115.450 122.598 -7.148 1
1 435 . 7 1 1 A 48 48 VAL H H 48 9.695 9.424 0.271 1
1 436 . 7 1 1 A 48 48 VAL HA H 48 4.677 4.558 0.119 1
1 444 . 7 1 1 A 48 48 VAL CA C 48 58.172 59.429 -1.257 1
1 445 . 7 1 1 A 48 48 VAL CB C 48 34.990 32.720 2.270 1
1 448 . 7 1 1 A 48 48 VAL N N 48 126.721 127.582 -0.861 1
1 449 . 7 1 1 A 49 49 PRO HA H 49 5.087 4.962 0.125 1
1 453 . 7 1 1 A 49 49 PRO CA C 49 61.671 62.569 -0.898 1
1 454 . 7 1 1 A 49 49 PRO CB C 49 31.923 31.754 0.169 1
1 457 . 7 1 1 A 50 50 ARG H H 50 9.125 9.384 -0.259 1
1 458 . 7 1 1 A 50 50 ARG HA H 50 4.974 4.808 0.166 1
1 464 . 7 1 1 A 50 50 ARG C C 50 176.187 174.680 1.507 1
1 465 . 7 1 1 A 50 50 ARG CA C 50 53.015 54.909 -1.894 1
1 466 . 7 1 1 A 50 50 ARG CB C 50 36.553 34.040 2.513 1
1 468 . 7 1 1 A 50 50 ARG N N 50 124.189 123.653 0.536 1
1 469 . 7 1 1 A 51 51 ARG H H 51 10.105 8.651 1.454 1
1 470 . 7 1 1 A 51 51 ARG HA H 51 5.196 4.444 0.752 1
1 475 . 7 1 1 A 51 51 ARG C C 51 178.865 176.708 2.157 1
1 476 . 7 1 1 A 51 51 ARG CA C 51 55.961 55.906 0.055 1
1 477 . 7 1 1 A 51 51 ARG CB C 51 32.539 31.690 0.849 1
1 480 . 7 1 1 A 51 51 ARG N N 51 124.521 126.196 -1.675 1
1 481 . 7 1 1 A 52 52 TYR H H 52 10.397 8.843 1.554 1
1 482 . 7 1 1 A 52 52 TYR HA H 52 4.360 4.091 0.269 1
1 487 . 7 1 1 A 52 52 TYR C C 52 178.143 177.256 0.887 1
1 488 . 7 1 1 A 52 52 TYR CA C 52 63.538 62.497 1.041 1
1 489 . 7 1 1 A 52 52 TYR CB C 52 38.784 39.196 -0.412 1
1 490 . 7 1 1 A 52 52 TYR N N 52 124.772 128.123 -3.351 1
1 491 . 7 1 1 A 53 53 SER H H 53 9.231 8.314 0.917 1
1 492 . 7 1 1 A 53 53 SER HA H 53 4.175 4.670 -0.495 1
1 493 . 7 1 1 A 53 53 SER C C 53 177.220 176.560 0.660 1
1 494 . 7 1 1 A 53 53 SER CA C 53 61.606 62.130 -0.524 1
1 495 . 7 1 1 A 53 53 SER N N 53 113.262 116.028 -2.766 1
1 496 . 7 1 1 A 54 54 GLU H H 54 7.807 7.749 0.058 1
1 497 . 7 1 1 A 54 54 GLU HA H 54 4.392 4.215 0.177 1
1 501 . 7 1 1 A 54 54 GLU C C 54 180.361 178.991 1.370 1
1 502 . 7 1 1 A 54 54 GLU CA C 54 59.497 59.107 0.390 1
1 503 . 7 1 1 A 54 54 GLU CB C 54 30.708 29.628 1.080 1
1 504 . 7 1 1 A 54 54 GLU N N 54 121.949 122.834 -0.885 1
1 505 . 7 1 1 A 55 55 PHE H H 55 8.133 8.127 0.006 1
1 506 . 7 1 1 A 55 55 PHE HA H 55 4.007 4.191 -0.184 1
1 513 . 7 1 1 A 55 55 PHE C C 55 176.531 177.482 -0.951 1
1 514 . 7 1 1 A 55 55 PHE CA C 55 61.848 61.324 0.524 1
1 515 . 7 1 1 A 55 55 PHE CB C 55 38.847 39.121 -0.274 1
1 516 . 7 1 1 A 55 55 PHE N N 55 119.998 121.622 -1.624 1
1 517 . 7 1 1 A 56 56 HIS H H 56 7.907 8.141 -0.234 1
1 518 . 7 1 1 A 56 56 HIS HA H 56 3.324 3.923 -0.599 1
1 522 . 7 1 1 A 56 56 HIS C C 56 176.748 177.356 -0.608 1
1 523 . 7 1 1 A 56 56 HIS CA C 56 58.770 59.413 -0.643 1
1 524 . 7 1 1 A 56 56 HIS CB C 56 30.404 29.278 1.126 1
1 525 . 7 1 1 A 56 56 HIS N N 56 119.173 118.361 0.812 1
1 526 . 7 1 1 A 57 57 ALA H H 57 7.962 7.837 0.125 1
1 527 . 7 1 1 A 57 57 ALA HA H 57 3.865 3.627 0.238 1
1 531 . 7 1 1 A 57 57 ALA C C 57 180.075 179.191 0.884 1
1 532 . 7 1 1 A 57 57 ALA CA C 57 54.996 54.921 0.075 1
1 533 . 7 1 1 A 57 57 ALA CB C 57 18.226 18.455 -0.229 1
1 534 . 7 1 1 A 57 57 ALA N N 57 120.094 120.848 -0.754 1
1 535 . 7 1 1 A 58 58 LEU H H 58 7.295 7.251 0.044 1
1 536 . 7 1 1 A 58 58 LEU HA H 58 3.994 3.539 0.455 1
1 546 . 7 1 1 A 58 58 LEU C C 58 177.428 178.341 -0.913 1
1 547 . 7 1 1 A 58 58 LEU CA C 58 58.342 57.541 0.801 1
1 548 . 7 1 1 A 58 58 LEU CB C 58 40.851 40.638 0.213 1
1 552 . 7 1 1 A 58 58 LEU N N 58 119.404 117.067 2.337 1
1 553 . 7 1 1 A 59 59 HIS H H 59 7.805 7.865 -0.060 1
1 554 . 7 1 1 A 59 59 HIS HA H 59 4.286 3.687 0.599 1
1 558 . 7 1 1 A 59 59 HIS C C 59 177.001 177.085 -0.084 1
1 559 . 7 1 1 A 59 59 HIS CA C 59 60.141 59.795 0.346 1
1 560 . 7 1 1 A 59 59 HIS CB C 59 31.072 29.223 1.849 1
1 561 . 7 1 1 A 59 59 HIS N N 59 119.040 119.839 -0.799 1
1 562 . 7 1 1 A 60 60 LYS H H 60 7.715 7.540 0.175 1
1 563 . 7 1 1 A 60 60 LYS HA H 60 3.456 3.551 -0.095 1
1 570 . 7 1 1 A 60 60 LYS C C 60 178.464 178.447 0.017 1
1 571 . 7 1 1 A 60 60 LYS CA C 60 59.629 58.206 1.423 1
1 572 . 7 1 1 A 60 60 LYS CB C 60 32.354 30.814 1.540 1
1 576 . 7 1 1 A 60 60 LYS N N 60 114.225 117.577 -3.352 1
1 577 . 7 1 1 A 61 61 ARG H H 61 7.486 7.389 0.097 1
1 578 . 7 1 1 A 61 61 ARG HA H 61 4.202 3.907 0.295 1
1 584 . 7 1 1 A 61 61 ARG C C 61 178.995 179.015 -0.020 1
1 585 . 7 1 1 A 61 61 ARG CA C 61 58.387 58.533 -0.146 1
1 586 . 7 1 1 A 61 61 ARG CB C 61 31.216 29.853 1.363 1
1 589 . 7 1 1 A 61 61 ARG N N 61 115.929 119.210 -3.281 1
1 590 . 7 1 1 A 62 62 ILE H H 62 8.066 8.148 -0.082 1
1 591 . 7 1 1 A 62 62 ILE HA H 62 4.491 3.718 0.773 1
1 601 . 7 1 1 A 62 62 ILE C C 62 177.838 176.917 0.921 1
1 602 . 7 1 1 A 62 62 ILE CA C 62 63.399 63.706 -0.307 1
1 603 . 7 1 1 A 62 62 ILE CB C 62 39.699 37.169 2.530 1
1 606 . 7 1 1 A 62 62 ILE N N 62 111.456 117.863 -6.407 1
1 607 . 7 1 1 A 63 63 LYS H H 63 8.158 8.463 -0.305 1
1 608 . 7 1 1 A 63 63 LYS HA H 63 4.136 3.933 0.203 1
1 615 . 7 1 1 A 63 63 LYS C C 63 176.358 177.386 -1.028 1
1 616 . 7 1 1 A 63 63 LYS CA C 63 58.753 58.254 0.499 1
1 617 . 7 1 1 A 63 63 LYS CB C 63 30.825 31.288 -0.463 1
1 621 . 7 1 1 A 63 63 LYS N N 63 120.800 123.179 -2.379 1
1 622 . 7 1 1 A 64 64 LYS H H 64 7.687 7.790 -0.103 1
1 623 . 7 1 1 A 64 64 LYS HA H 64 4.301 4.416 -0.115 1
1 628 . 7 1 1 A 64 64 LYS C C 64 177.084 177.641 -0.557 1
1 629 . 7 1 1 A 64 64 LYS CA C 64 57.237 56.437 0.800 1
1 630 . 7 1 1 A 64 64 LYS CB C 64 32.502 32.889 -0.387 1
1 634 . 7 1 1 A 64 64 LYS N N 64 116.548 118.693 -2.145 1
1 635 . 7 1 1 A 65 65 LEU H H 65 7.476 8.119 -0.643 1
1 636 . 7 1 1 A 65 65 LEU HA H 65 4.219 4.347 -0.128 1
1 645 . 7 1 1 A 65 65 LEU C C 65 175.886 175.960 -0.074 1
1 646 . 7 1 1 A 65 65 LEU CA C 65 55.542 56.788 -1.246 1
1 647 . 7 1 1 A 65 65 LEU CB C 65 45.493 43.667 1.826 1
1 650 . 7 1 1 A 65 65 LEU N N 65 118.000 120.157 -2.157 1
1 651 . 7 1 1 A 66 66 TYR H H 66 7.672 8.336 -0.664 1
1 652 . 7 1 1 A 66 66 TYR HA H 66 4.762 5.110 -0.348 1
1 660 . 7 1 1 A 66 66 TYR C C 66 174.199 172.673 1.526 1
1 661 . 7 1 1 A 66 66 TYR CA C 66 56.013 55.392 0.621 1
1 662 . 7 1 1 A 66 66 TYR CB C 66 40.380 41.099 -0.719 1
1 663 . 7 1 1 A 66 66 TYR N N 66 116.805 113.718 3.087 1
1 664 . 7 1 1 A 67 67 LYS H H 67 8.547 8.574 -0.027 1
1 665 . 7 1 1 A 67 67 LYS HA H 67 4.436 4.347 0.089 1
1 670 . 7 1 1 A 67 67 LYS C C 67 175.727 175.146 0.581 1
1 671 . 7 1 1 A 67 67 LYS CA C 67 56.598 57.131 -0.533 1
1 672 . 7 1 1 A 67 67 LYS CB C 67 32.743 32.724 0.019 1
1 676 . 7 1 1 A 67 67 LYS N N 67 120.929 120.375 0.554 1
1 677 . 7 1 1 A 68 68 VAL H H 68 8.168 8.131 0.037 1
1 678 . 7 1 1 A 68 68 VAL HA H 68 4.869 4.530 0.339 1
1 686 . 7 1 1 A 68 68 VAL CA C 68 57.389 58.837 -1.448 1
1 687 . 7 1 1 A 68 68 VAL CB C 68 34.017 35.353 -1.336 1
1 690 . 7 1 1 A 68 68 VAL N N 68 116.467 126.959 -10.492 1
1 691 . 7 1 1 A 69 69 PRO HA H 69 4.674 4.749 -0.075 1
1 696 . 7 1 1 A 69 69 PRO C C 69 178.013 176.198 1.815 1
1 697 . 7 1 1 A 69 69 PRO CA C 69 61.443 62.370 -0.927 1
1 698 . 7 1 1 A 69 69 PRO CB C 69 32.231 33.020 -0.789 1
1 701 . 7 1 1 A 70 70 ASP H H 70 8.167 8.694 -0.527 1
1 702 . 7 1 1 A 70 70 ASP HA H 70 4.531 4.715 -0.184 1
1 705 . 7 1 1 A 70 70 ASP C C 70 175.660 175.637 0.023 1
1 706 . 7 1 1 A 70 70 ASP CA C 70 55.148 53.805 1.343 1
1 707 . 7 1 1 A 70 70 ASP CB C 70 40.876 41.889 -1.013 1
1 708 . 7 1 1 A 70 70 ASP N N 70 116.671 121.680 -5.009 1
1 709 . 7 1 1 A 71 71 PHE H H 71 8.387 8.539 -0.152 1
1 710 . 7 1 1 A 71 71 PHE HA H 71 4.076 4.752 -0.676 1
1 717 . 7 1 1 A 71 71 PHE CA C 71 55.672 54.596 1.076 1
1 718 . 7 1 1 A 71 71 PHE CB C 71 39.155 41.474 -2.319 1
1 719 . 7 1 1 A 71 71 PHE N N 71 126.533 118.326 8.207 1
1 720 . 7 1 1 A 72 72 PRO HA H 72 4.156 4.497 -0.341 1
1 727 . 7 1 1 A 72 72 PRO CA C 72 63.079 62.826 0.253 1
1 728 . 7 1 1 A 72 72 PRO CB C 72 32.107 32.157 -0.050 1
1 731 . 7 1 1 A 73 73 SER H H 73 8.468 8.477 -0.009 1
1 733 . 7 1 1 A 73 73 SER CA C 73 56.133 56.980 -0.847 1
1 734 . 7 1 1 A 73 73 SER CB C 73 63.991 65.389 -1.398 1
1 735 . 7 1 1 A 73 73 SER N N 73 121.533 117.281 4.252 1
1 736 . 7 1 1 A 74 74 LYS HA H 74 4.574 4.151 0.423 1
1 739 . 7 1 1 A 74 74 LYS CA C 74 55.659 58.446 -2.787 1
1 740 . 7 1 1 A 74 74 LYS CB C 74 30.550 32.175 -1.625 1
1 741 . 7 1 1 A 75 75 ARG H H 75 7.962 7.778 0.184 1
1 742 . 7 1 1 A 75 75 ARG HA H 75 4.162 4.345 -0.183 1
1 746 . 7 1 1 A 75 75 ARG CA C 75 56.123 55.950 0.173 1
1 747 . 7 1 1 A 75 75 ARG CB C 75 31.179 31.200 -0.021 1
1 749 . 7 1 1 A 75 75 ARG N N 75 121.665 121.220 0.445 1
1 750 . 7 1 1 A 76 76 LEU H H 76 8.071 8.189 -0.118 1
1 751 . 7 1 1 A 76 76 LEU HA H 76 4.618 4.675 -0.057 1
1 759 . 7 1 1 A 76 76 LEU CA C 76 52.764 51.187 1.577 1
1 760 . 7 1 1 A 76 76 LEU CB C 76 41.918 45.325 -3.407 1
1 762 . 7 1 1 A 76 76 LEU N N 76 124.196 125.531 -1.335 1
1 763 . 7 1 1 A 77 77 PRO HA H 77 4.393 4.237 0.156 1
1 767 . 7 1 1 A 77 77 PRO CA C 77 63.746 62.228 1.518 1
1 770 . 7 1 1 A 78 78 ASN H H 78 8.379 8.889 -0.510 1
1 771 . 7 1 1 A 78 78 ASN HA H 78 4.586 4.366 0.220 1
1 776 . 7 1 1 A 78 78 ASN C C 78 175.648 174.948 0.700 1
1 777 . 7 1 1 A 78 78 ASN CA C 78 53.591 55.308 -1.717 1
1 778 . 7 1 1 A 78 78 ASN CB C 78 37.826 39.108 -1.282 1
1 779 . 7 1 1 A 78 78 ASN N N 78 115.292 121.377 -6.085 1
1 781 . 7 1 1 A 79 79 TRP H H 79 7.900 7.773 0.127 1
1 782 . 7 1 1 A 79 79 TRP HA H 79 4.326 4.690 -0.364 1
1 788 . 7 1 1 A 79 79 TRP CA C 79 58.825 60.140 -1.315 1
1 789 . 7 1 1 A 79 79 TRP CB C 79 29.090 27.147 1.943 1
1 790 . 7 1 1 A 79 79 TRP N N 79 119.525 118.455 1.070 1
1 792 . 7 1 1 A 80 80 ARG H H 80 8.060 8.266 -0.206 1
1 793 . 7 1 1 A 80 80 ARG HA H 80 3.913 4.260 -0.347 1
1 798 . 7 1 1 A 80 80 ARG C C 80 177.024 178.928 -1.904 1
1 799 . 7 1 1 A 80 80 ARG CA C 80 58.292 59.075 -0.783 1
1 800 . 7 1 1 A 80 80 ARG CB C 80 30.146 29.985 0.161 1
1 803 . 7 1 1 A 80 80 ARG N N 80 118.864 120.475 -1.611 1
1 804 . 7 1 1 A 81 81 THR H H 81 7.725 7.669 0.056 1
1 805 . 7 1 1 A 81 81 THR HA H 81 4.297 4.201 0.096 1
1 809 . 7 1 1 A 81 81 THR CA C 81 62.481 65.084 -2.603 1
1 811 . 7 1 1 A 81 81 THR N N 81 109.863 111.229 -1.366 1
1 812 . 7 1 1 A 82 82 ARG HA H 82 4.341 4.817 -0.476 1
1 816 . 7 1 1 A 82 82 ARG C C 82 177.261 176.254 1.007 1
1 817 . 7 1 1 A 82 82 ARG CA C 82 56.846 54.251 2.595 1
1 818 . 7 1 1 A 82 82 ARG CB C 82 30.288 32.850 -2.562 1
1 820 . 7 1 1 A 83 83 GLY H H 83 8.321 8.678 -0.357 1
1 821 . 7 1 1 A 83 83 GLY HA2 H 83 3.957 4.184 -0.227 1
1 822 . 7 1 1 A 83 83 GLY C C 83 175.185 175.803 -0.618 1
1 823 . 7 1 1 A 83 83 GLY CA C 83 46.297 45.585 0.712 1
1 824 . 7 1 1 A 83 83 GLY N N 83 109.146 111.413 -2.267 1
1 825 . 7 1 1 A 84 84 LEU H H 84 8.303 8.889 -0.586 1
1 826 . 7 1 1 A 84 84 LEU HA H 84 4.018 4.119 -0.101 1
1 835 . 7 1 1 A 84 84 LEU C C 84 178.552 178.054 0.498 1
1 836 . 7 1 1 A 84 84 LEU CA C 84 58.236 56.693 1.543 1
1 837 . 7 1 1 A 84 84 LEU CB C 84 41.837 41.639 0.198 1
1 840 . 7 1 1 A 84 84 LEU N N 84 122.662 121.310 1.352 1
1 841 . 7 1 1 A 85 85 GLU H H 85 8.233 8.496 -0.263 1
1 842 . 7 1 1 A 85 85 GLU HA H 85 4.371 3.895 0.476 1
1 846 . 7 1 1 A 85 85 GLU C C 85 178.555 178.664 -0.109 1
1 847 . 7 1 1 A 85 85 GLU CA C 85 58.377 59.705 -1.328 1
1 848 . 7 1 1 A 85 85 GLU CB C 85 28.675 29.421 -0.746 1
1 850 . 7 1 1 A 85 85 GLU N N 85 119.781 119.147 0.634 1
1 851 . 7 1 1 A 86 86 GLN H H 86 7.877 8.038 -0.161 1
1 852 . 7 1 1 A 86 86 GLN HA H 86 4.100 4.074 0.026 1
1 858 . 7 1 1 A 86 86 GLN C C 86 179.557 178.310 1.247 1
1 859 . 7 1 1 A 86 86 GLN CA C 86 58.955 59.276 -0.321 1
1 860 . 7 1 1 A 86 86 GLN CB C 86 28.191 28.393 -0.202 1
1 862 . 7 1 1 A 86 86 GLN N N 86 118.042 118.856 -0.814 1
1 863 . 7 1 1 A 87 87 ARG H H 87 8.169 8.206 -0.037 1
1 864 . 7 1 1 A 87 87 ARG HA H 87 3.975 4.244 -0.269 1
1 868 . 7 1 1 A 87 87 ARG C C 87 177.051 178.641 -1.590 1
1 869 . 7 1 1 A 87 87 ARG CA C 87 59.006 59.716 -0.710 1
1 870 . 7 1 1 A 87 87 ARG CB C 87 30.383 29.783 0.600 1
1 872 . 7 1 1 A 87 87 ARG N N 87 121.381 120.078 1.303 1
1 873 . 7 1 1 A 88 88 ARG H H 88 8.593 7.583 1.010 1
1 874 . 7 1 1 A 88 88 ARG HA H 88 3.726 3.789 -0.063 1
1 876 . 7 1 1 A 88 88 ARG C C 88 177.520 178.433 -0.913 1
1 877 . 7 1 1 A 88 88 ARG CA C 88 60.751 59.421 1.330 1
1 878 . 7 1 1 A 88 88 ARG CB C 88 30.153 29.803 0.350 1
1 879 . 7 1 1 A 88 88 ARG N N 88 120.863 119.354 1.509 1
1 880 . 7 1 1 A 89 89 GLN H H 89 8.355 8.211 0.144 1
1 881 . 7 1 1 A 89 89 GLN HA H 89 3.887 3.933 -0.046 1
1 887 . 7 1 1 A 89 89 GLN C C 89 179.499 178.588 0.911 1
1 888 . 7 1 1 A 89 89 GLN CA C 89 59.603 59.596 0.007 1
1 889 . 7 1 1 A 89 89 GLN CB C 89 28.464 28.210 0.254 1
1 891 . 7 1 1 A 89 89 GLN N N 89 116.860 118.996 -2.136 1
1 893 . 7 1 1 A 90 90 GLY H H 90 8.406 8.349 0.057 1
1 894 . 7 1 1 A 90 90 GLY HA2 H 90 3.672 3.785 -0.113 1
1 895 . 7 1 1 A 90 90 GLY HA3 H 90 3.871 3.861 0.010 1
1 896 . 7 1 1 A 90 90 GLY C C 90 177.033 175.949 1.084 1
1 897 . 7 1 1 A 90 90 GLY CA C 90 46.813 47.286 -0.473 1
1 898 . 7 1 1 A 90 90 GLY N N 90 107.679 107.536 0.143 1
1 899 . 7 1 1 A 91 91 LEU H H 91 8.504 8.484 0.020 1
1 900 . 7 1 1 A 91 91 LEU HA H 91 3.784 4.038 -0.254 1
1 910 . 7 1 1 A 91 91 LEU C C 91 178.003 178.860 -0.857 1
1 911 . 7 1 1 A 91 91 LEU CA C 91 57.354 57.868 -0.514 1
1 912 . 7 1 1 A 91 91 LEU CB C 91 40.359 41.174 -0.815 1
1 916 . 7 1 1 A 91 91 LEU N N 91 123.959 121.902 2.057 1
1 917 . 7 1 1 A 92 92 GLU H H 92 8.324 9.015 -0.691 1
1 918 . 7 1 1 A 92 92 GLU HA H 92 3.732 3.874 -0.142 1
1 922 . 7 1 1 A 92 92 GLU C C 92 177.272 178.603 -1.331 1
1 923 . 7 1 1 A 92 92 GLU CA C 92 60.651 59.253 1.398 1
1 924 . 7 1 1 A 92 92 GLU CB C 92 30.843 28.868 1.975 1
1 926 . 7 1 1 A 92 92 GLU N N 92 121.991 117.618 4.373 1
1 927 . 7 1 1 A 93 93 ALA H H 93 8.126 7.710 0.416 1
1 928 . 7 1 1 A 93 93 ALA HA H 93 4.160 4.054 0.106 1
1 932 . 7 1 1 A 93 93 ALA C C 93 180.818 179.484 1.334 1
1 933 . 7 1 1 A 93 93 ALA CA C 93 54.828 55.055 -0.227 1
1 934 . 7 1 1 A 93 93 ALA CB C 93 18.032 17.895 0.137 1
1 935 . 7 1 1 A 93 93 ALA N N 93 120.066 122.137 -2.071 1
1 936 . 7 1 1 A 94 94 TYR H H 94 7.916 8.083 -0.167 1
1 937 . 7 1 1 A 94 94 TYR HA H 94 4.139 4.365 -0.226 1
1 942 . 7 1 1 A 94 94 TYR C C 94 175.895 178.507 -2.612 1
1 943 . 7 1 1 A 94 94 TYR CA C 94 61.915 61.572 0.343 1
1 944 . 7 1 1 A 94 94 TYR CB C 94 38.740 38.241 0.499 1
1 945 . 7 1 1 A 94 94 TYR N N 94 121.179 115.801 5.378 1
1 946 . 7 1 1 A 95 95 ILE H H 95 7.983 8.497 -0.514 1
1 947 . 7 1 1 A 95 95 ILE HA H 95 3.614 3.798 -0.184 1
1 957 . 7 1 1 A 95 95 ILE C C 95 174.678 178.065 -3.387 1
1 958 . 7 1 1 A 95 95 ILE CA C 95 63.461 64.944 -1.483 1
1 959 . 7 1 1 A 95 95 ILE CB C 95 36.625 37.374 -0.749 1
1 963 . 7 1 1 A 95 95 ILE N N 95 116.397 120.288 -3.891 1
1 964 . 7 1 1 A 96 96 GLN H H 96 8.175 8.660 -0.485 1
1 965 . 7 1 1 A 96 96 GLN HA H 96 3.763 3.982 -0.219 1
1 970 . 7 1 1 A 96 96 GLN C C 96 179.042 178.569 0.473 1
1 971 . 7 1 1 A 96 96 GLN CA C 96 59.270 59.788 -0.518 1
1 972 . 7 1 1 A 96 96 GLN CB C 96 27.696 28.319 -0.623 1
1 974 . 7 1 1 A 96 96 GLN N N 96 116.631 120.276 -3.645 1
1 976 . 7 1 1 A 97 97 GLY H H 97 8.222 8.261 -0.039 1
1 977 . 7 1 1 A 97 97 GLY HA2 H 97 3.661 3.692 -0.031 1
1 978 . 7 1 1 A 97 97 GLY HA3 H 97 3.806 3.704 0.102 1
1 979 . 7 1 1 A 97 97 GLY C C 97 175.449 176.051 -0.602 1
1 980 . 7 1 1 A 97 97 GLY CA C 97 46.917 47.368 -0.451 1
1 981 . 7 1 1 A 97 97 GLY N N 97 107.315 106.770 0.545 1
1 982 . 7 1 1 A 98 98 ILE H H 98 7.630 7.922 -0.292 1
1 983 . 7 1 1 A 98 98 ILE HA H 98 3.399 3.994 -0.595 1
1 993 . 7 1 1 A 98 98 ILE C C 98 178.683 177.920 0.763 1
1 994 . 7 1 1 A 98 98 ILE CA C 98 66.402 64.680 1.722 1
1 995 . 7 1 1 A 98 98 ILE CB C 98 38.037 37.498 0.539 1
1 999 . 7 1 1 A 98 98 ILE N N 98 120.644 120.777 -0.133 1
1 1000 . 7 1 1 A 99 99 LEU H H 99 7.076 7.732 -0.656 1
1 1001 . 7 1 1 A 99 99 LEU HA H 99 4.133 4.089 0.044 1
1 1010 . 7 1 1 A 99 99 LEU C C 99 178.128 178.037 0.091 1
1 1011 . 7 1 1 A 99 99 LEU CA C 99 57.129 57.547 -0.418 1
1 1012 . 7 1 1 A 99 99 LEU CB C 99 41.108 41.931 -0.823 1
1 1014 . 7 1 1 A 99 99 LEU N N 99 116.844 121.549 -4.705 1
1 1015 . 7 1 1 A 100 100 TYR H H 100 7.890 8.181 -0.291 1
1 1016 . 7 1 1 A 100 100 TYR HA H 100 4.550 4.184 0.366 1
1 1021 . 7 1 1 A 100 100 TYR C C 100 178.210 177.459 0.751 1
1 1022 . 7 1 1 A 100 100 TYR CA C 100 59.452 60.292 -0.840 1
1 1023 . 7 1 1 A 100 100 TYR CB C 100 38.786 39.603 -0.817 1
1 1024 . 7 1 1 A 100 100 TYR N N 100 116.427 119.941 -3.514 1
1 1025 . 7 1 1 A 101 101 LEU H H 101 8.041 8.436 -0.395 1
1 1026 . 7 1 1 A 101 101 LEU HA H 101 4.158 3.895 0.263 1
1 1036 . 7 1 1 A 101 101 LEU C C 101 176.808 177.413 -0.605 1
1 1037 . 7 1 1 A 101 101 LEU CA C 101 56.156 58.160 -2.004 1
1 1038 . 7 1 1 A 101 101 LEU CB C 101 44.307 41.694 2.613 1
1 1041 . 7 1 1 A 101 101 LEU N N 101 116.493 120.032 -3.539 1
1 1042 . 7 1 1 A 102 102 ASN H H 102 7.146 7.611 -0.465 1
1 1043 . 7 1 1 A 102 102 ASN HA H 102 5.056 5.032 0.024 1
1 1046 . 7 1 1 A 102 102 ASN CA C 102 52.704 54.720 -2.016 1
1 1047 . 7 1 1 A 102 102 ASN CB C 102 42.424 40.490 1.934 1
1 1048 . 7 1 1 A 102 102 ASN N N 102 114.922 113.852 1.070 1
1 1049 . 7 1 1 A 103 103 GLN H H 103 8.477 7.968 0.509 1
1 1050 . 7 1 1 A 103 103 GLN HA H 103 3.866 3.911 -0.045 1
1 1054 . 7 1 1 A 103 103 GLN C C 103 176.110 175.757 0.353 1
1 1055 . 7 1 1 A 103 103 GLN CA C 103 58.451 58.939 -0.488 1
1 1056 . 7 1 1 A 103 103 GLN CB C 103 28.896 28.449 0.447 1
1 1058 . 7 1 1 A 103 103 GLN N N 103 120.252 119.048 1.204 1
1 1059 . 7 1 1 A 104 104 GLU H H 104 7.930 7.259 0.671 1
1 1060 . 7 1 1 A 104 104 GLU HA H 104 4.591 4.562 0.029 1
1 1064 . 7 1 1 A 104 104 GLU C C 104 175.397 174.713 0.684 1
1 1065 . 7 1 1 A 104 104 GLU CA C 104 54.058 58.895 -4.837 1
1 1066 . 7 1 1 A 104 104 GLU CB C 104 31.272 27.241 4.031 1
1 1068 . 7 1 1 A 104 104 GLU N N 104 117.295 117.675 -0.380 1
1 1069 . 7 1 1 A 105 105 VAL H H 105 8.546 7.882 0.664 1
1 1070 . 7 1 1 A 105 105 VAL HA H 105 3.823 4.437 -0.614 1
1 1078 . 7 1 1 A 105 105 VAL CA C 105 60.706 58.351 2.355 1
1 1079 . 7 1 1 A 105 105 VAL CB C 105 32.126 34.394 -2.268 1
1 1082 . 7 1 1 A 105 105 VAL N N 105 124.511 117.710 6.801 1
1 1083 . 7 1 1 A 106 106 PRO HA H 106 3.997 4.576 -0.579 1
1 1089 . 7 1 1 A 106 106 PRO C C 106 178.240 177.891 0.349 1
1 1090 . 7 1 1 A 106 106 PRO CA C 106 62.961 63.216 -0.255 1
1 1091 . 7 1 1 A 106 106 PRO CB C 106 32.321 31.943 0.378 1
1 1094 . 7 1 1 A 107 107 LYS H H 107 9.122 8.999 0.123 1
1 1095 . 7 1 1 A 107 107 LYS HA H 107 3.813 4.021 -0.208 1
1 1101 . 7 1 1 A 107 107 LYS C C 107 178.563 178.384 0.179 1
1 1102 . 7 1 1 A 107 107 LYS CA C 107 60.085 59.606 0.479 1
1 1103 . 7 1 1 A 107 107 LYS CB C 107 31.632 32.312 -0.680 1
1 1106 . 7 1 1 A 107 107 LYS N N 107 129.017 125.254 3.763 1
1 1107 . 7 1 1 A 108 108 GLU H H 108 10.370 8.236 2.134 1
1 1108 . 7 1 1 A 108 108 GLU HA H 108 3.991 4.112 -0.121 1
1 1111 . 7 1 1 A 108 108 GLU C C 108 180.366 179.424 0.942 1
1 1112 . 7 1 1 A 108 108 GLU CA C 108 60.337 59.139 1.198 1
1 1113 . 7 1 1 A 108 108 GLU CB C 108 29.178 29.521 -0.343 1
1 1115 . 7 1 1 A 108 108 GLU N N 108 118.335 118.250 0.085 1
1 1116 . 7 1 1 A 109 109 LEU H H 109 7.393 8.086 -0.693 1
1 1117 . 7 1 1 A 109 109 LEU HA H 109 4.220 4.287 -0.067 1
1 1126 . 7 1 1 A 109 109 LEU C C 109 177.378 179.088 -1.710 1
1 1127 . 7 1 1 A 109 109 LEU CA C 109 56.618 57.606 -0.988 1
1 1128 . 7 1 1 A 109 109 LEU CB C 109 41.898 42.067 -0.169 1
1 1131 . 7 1 1 A 109 109 LEU N N 109 118.285 122.243 -3.958 1
1 1132 . 7 1 1 A 110 110 LEU H H 110 7.641 7.782 -0.141 1
1 1133 . 7 1 1 A 110 110 LEU HA H 110 3.796 3.928 -0.132 1
1 1142 . 7 1 1 A 110 110 LEU C C 110 179.103 178.819 0.284 1
1 1143 . 7 1 1 A 110 110 LEU CA C 110 59.046 58.139 0.907 1
1 1144 . 7 1 1 A 110 110 LEU CB C 110 40.228 40.716 -0.488 1
1 1147 . 7 1 1 A 110 110 LEU N N 110 120.162 118.761 1.401 1
1 1148 . 7 1 1 A 111 111 GLU H H 111 7.916 8.345 -0.429 1
1 1149 . 7 1 1 A 111 111 GLU HA H 111 4.080 4.079 0.001 1
1 1153 . 7 1 1 A 111 111 GLU C C 111 179.967 178.935 1.032 1
1 1154 . 7 1 1 A 111 111 GLU CA C 111 59.243 59.004 0.239 1
1 1155 . 7 1 1 A 111 111 GLU CB C 111 29.576 29.043 0.533 1
1 1157 . 7 1 1 A 111 111 GLU N N 111 117.360 120.411 -3.051 1
1 1158 . 7 1 1 A 112 112 PHE H H 112 7.712 8.265 -0.553 1
1 1159 . 7 1 1 A 112 112 PHE HA H 112 4.224 4.157 0.067 1
1 1164 . 7 1 1 A 112 112 PHE C C 112 177.180 177.056 0.124 1
1 1165 . 7 1 1 A 112 112 PHE CA C 112 61.407 61.293 0.114 1
1 1166 . 7 1 1 A 112 112 PHE CB C 112 40.172 39.589 0.583 1
1 1167 . 7 1 1 A 112 112 PHE N N 112 123.042 120.994 2.048 1
1 1168 . 7 1 1 A 113 113 LEU H H 113 8.056 7.859 0.197 1
1 1169 . 7 1 1 A 113 113 LEU HA H 113 4.147 4.291 -0.144 1
1 1175 . 7 1 1 A 113 113 LEU C C 113 173.717 176.034 -2.317 1
1 1176 . 7 1 1 A 113 113 LEU CA C 113 54.093 54.388 -0.295 1
1 1177 . 7 1 1 A 113 113 LEU CB C 113 41.517 42.058 -0.541 1
1 1179 . 7 1 1 A 113 113 LEU N N 113 115.595 117.025 -1.430 1
1 1180 . 7 1 1 A 114 114 ARG H H 114 7.902 8.091 -0.189 1
1 1181 . 7 1 1 A 114 114 ARG HA H 114 3.817 4.353 -0.536 1
1 1182 . 7 1 1 A 114 114 ARG C C 114 174.566 176.253 -1.687 1
1 1183 . 7 1 1 A 114 114 ARG CA C 114 57.233 56.952 0.281 1
1 1184 . 7 1 1 A 114 114 ARG CB C 114 27.788 28.620 -0.832 1
1 1185 . 7 1 1 A 114 114 ARG N N 114 116.021 118.792 -2.771 1
1 1186 . 7 1 1 A 115 115 LEU H H 115 8.160 8.347 -0.187 1
1 1187 . 7 1 1 A 115 115 LEU HA H 115 4.462 4.241 0.221 1
1 1195 . 7 1 1 A 115 115 LEU C C 115 176.374 175.874 0.500 1
1 1196 . 7 1 1 A 115 115 LEU CA C 115 53.965 54.041 -0.076 1
1 1197 . 7 1 1 A 115 115 LEU CB C 115 44.077 41.523 2.554 1
1 1199 . 7 1 1 A 115 115 LEU N N 115 118.089 118.687 -0.598 1
1 1200 . 7 1 1 A 116 116 ARG H H 116 8.066 7.479 0.587 1
1 1201 . 7 1 1 A 116 116 ARG HA H 116 4.172 3.752 0.420 1
1 1203 . 7 1 1 A 116 116 ARG CA C 116 55.961 58.121 -2.160 1
1 1204 . 7 1 1 A 116 116 ARG CB C 116 31.379 29.878 1.501 1
1 1205 . 7 1 1 A 116 116 ARG N N 116 120.852 121.301 -0.449 1
1 1206 . 7 1 1 A 117 117 HIS H H 117 7.928 8.842 -0.914 1
1 1207 . 7 1 1 A 117 117 HIS HA H 117 4.557 4.117 0.440 1
1 1211 . 7 1 1 A 117 117 HIS CA C 117 55.937 56.723 -0.786 1
1 1212 . 7 1 1 A 117 117 HIS CB C 117 30.875 28.122 2.753 1
1 1213 . 7 1 1 A 118 118 PHE H H 118 8.183 8.059 0.124 1
1 1214 . 7 1 1 A 118 118 PHE HA H 118 4.730 4.411 0.319 1
1 1219 . 7 1 1 A 118 118 PHE CA C 118 55.716 56.274 -0.558 1
1 1220 . 7 1 1 A 118 118 PHE CB C 118 39.263 38.932 0.331 1
1 1221 . 7 1 1 A 118 118 PHE N N 118 123.480 124.377 -0.897 1
1 1222 . 7 1 1 A 119 119 PRO HA H 119 4.398 4.448 -0.050 1
1 1227 . 7 1 1 A 119 119 PRO C C 119 176.666 175.988 0.678 1
1 1228 . 7 1 1 A 119 119 PRO CA C 119 63.377 62.186 1.191 1
1 1229 . 7 1 1 A 119 119 PRO CB C 119 32.059 33.027 -0.968 1
1 1232 . 7 1 1 A 120 120 THR H H 120 8.054 8.430 -0.376 1
1 1233 . 7 1 1 A 120 120 THR HA H 120 4.273 4.521 -0.248 1
1 1238 . 7 1 1 A 120 120 THR C C 120 174.154 172.982 1.172 1
1 1239 . 7 1 1 A 120 120 THR CA C 120 61.893 61.154 0.739 1
1 1240 . 7 1 1 A 120 120 THR CB C 120 69.736 68.171 1.565 1
1 1242 . 7 1 1 A 120 120 THR N N 120 113.088 115.557 -2.469 1
1 1243 . 7 1 1 A 121 121 ASP H H 121 8.209 8.609 -0.400 1
1 1244 . 7 1 1 A 121 121 ASP HA H 121 4.876 4.792 0.084 1
1 1247 . 7 1 1 A 121 121 ASP CA C 121 52.126 52.222 -0.096 1
1 1248 . 7 1 1 A 121 121 ASP CB C 121 41.553 42.067 -0.514 1
1 1249 . 7 1 1 A 121 121 ASP N N 121 123.630 129.529 -5.899 1
1 1250 . 7 1 1 A 122 122 PRO HA H 122 4.363 4.437 -0.074 1
1 1255 . 7 1 1 A 122 122 PRO C C 122 177.344 176.460 0.884 1
1 1256 . 7 1 1 A 122 122 PRO CA C 122 63.913 63.379 0.534 1
1 1257 . 7 1 1 A 122 122 PRO CB C 122 32.116 31.833 0.283 1
1 1260 . 7 1 1 A 123 123 LYS H H 123 8.344 8.398 -0.054 1
1 1261 . 7 1 1 A 123 123 LYS HA H 123 4.244 4.465 -0.221 1
1 1266 . 7 1 1 A 123 123 LYS C C 123 176.637 175.260 1.377 1
1 1267 . 7 1 1 A 123 123 LYS CA C 123 56.359 56.323 0.036 1
1 1268 . 7 1 1 A 123 123 LYS CB C 123 32.367 32.182 0.185 1
1 1272 . 7 1 1 A 123 123 LYS N N 123 119.110 122.515 -3.405 1
1 1273 . 7 1 1 A 124 124 ALA H H 124 7.929 8.290 -0.361 1
1 1274 . 7 1 1 A 124 124 ALA HA H 124 4.248 4.730 -0.482 1
1 1278 . 7 1 1 A 124 124 ALA C C 124 177.648 175.934 1.714 1
1 1279 . 7 1 1 A 124 124 ALA CA C 124 52.618 51.208 1.410 1
1 1280 . 7 1 1 A 124 124 ALA CB C 124 19.379 19.771 -0.392 1
1 1281 . 7 1 1 A 124 124 ALA N N 124 123.825 130.252 -6.427 1
1 1282 . 7 1 1 A 125 125 SER H H 125 8.134 8.338 -0.204 1
1 1283 . 7 1 1 A 125 125 SER HA H 125 4.341 4.930 -0.589 1
1 1286 . 7 1 1 A 125 125 SER C C 125 174.172 172.849 1.323 1
1 1287 . 7 1 1 A 125 125 SER CA C 125 58.391 58.038 0.353 1
1 1288 . 7 1 1 A 125 125 SER CB C 125 63.748 63.903 -0.155 1
1 1289 . 7 1 1 A 125 125 SER N N 125 114.454 117.512 -3.058 1
1 1290 . 7 1 1 A 126 126 ASN H H 126 8.242 9.114 -0.872 1
1 1291 . 7 1 1 A 126 126 ASN HA H 126 4.657 5.379 -0.722 1
1 1294 . 7 1 1 A 126 126 ASN C C 126 174.624 173.593 1.031 1
1 1295 . 7 1 1 A 126 126 ASN CA C 126 53.292 52.298 0.994 1
1 1296 . 7 1 1 A 126 126 ASN CB C 126 38.797 39.880 -1.083 1
1 1297 . 7 1 1 A 126 126 ASN N N 126 120.102 126.076 -5.974 1
1 1298 . 7 1 1 A 127 127 TRP H H 127 8.051 9.152 -1.101 1
1 1299 . 7 1 1 A 127 127 TRP HA H 127 4.694 5.123 -0.429 1
1 1302 . 7 1 1 A 127 127 TRP C C 127 175.479 175.670 -0.191 1
1 1303 . 7 1 1 A 127 127 TRP CA C 127 57.096 56.495 0.601 1
1 1304 . 7 1 1 A 127 127 TRP CB C 127 29.820 30.784 -0.964 1
1 1305 . 7 1 1 A 127 127 TRP N N 127 121.198 128.070 -6.872 1
1 1 . 8 1 1 A 7 7 HIS HA H 7 4.623 4.849 -0.226 1
1 4 . 8 1 1 A 7 7 HIS C C 7 174.747 174.672 0.075 1
1 5 . 8 1 1 A 7 7 HIS CA C 7 56.189 54.326 1.863 1
1 6 . 8 1 1 A 7 7 HIS CB C 7 30.028 30.316 -0.288 1
1 7 . 8 1 1 A 8 8 LEU H H 8 8.283 8.266 0.017 1
1 8 . 8 1 1 A 8 8 LEU HA H 8 4.249 4.261 -0.012 1
1 10 . 8 1 1 A 8 8 LEU C C 8 176.700 177.469 -0.769 1
1 11 . 8 1 1 A 8 8 LEU CA C 8 55.498 54.335 1.163 1
1 12 . 8 1 1 A 8 8 LEU CB C 8 42.568 41.524 1.044 1
1 13 . 8 1 1 A 8 8 LEU N N 8 122.916 125.148 -2.232 1
1 14 . 8 1 1 A 9 9 GLU H H 9 8.623 7.674 0.949 1
1 15 . 8 1 1 A 9 9 GLU HA H 9 4.311 4.469 -0.158 1
1 16 . 8 1 1 A 9 9 GLU C C 9 174.811 175.325 -0.514 1
1 17 . 8 1 1 A 9 9 GLU CA C 9 56.377 55.584 0.793 1
1 18 . 8 1 1 A 9 9 GLU CB C 9 29.557 28.612 0.945 1
1 20 . 8 1 1 A 9 9 GLU N N 9 121.512 120.037 1.475 1
1 21 . 8 1 1 A 10 10 LEU H H 10 7.853 7.834 0.019 1
1 22 . 8 1 1 A 10 10 LEU HA H 10 5.225 5.164 0.061 1
1 31 . 8 1 1 A 10 10 LEU C C 10 174.637 174.224 0.413 1
1 32 . 8 1 1 A 10 10 LEU CA C 10 54.513 54.502 0.011 1
1 33 . 8 1 1 A 10 10 LEU CB C 10 45.187 45.924 -0.737 1
1 36 . 8 1 1 A 10 10 LEU N N 10 123.592 125.936 -2.344 1
1 37 . 8 1 1 A 11 11 GLU H H 11 8.894 8.724 0.170 1
1 38 . 8 1 1 A 11 11 GLU HA H 11 4.765 5.199 -0.434 1
1 43 . 8 1 1 A 11 11 GLU C C 11 174.563 174.961 -0.398 1
1 44 . 8 1 1 A 11 11 GLU CA C 11 55.047 54.816 0.231 1
1 45 . 8 1 1 A 11 11 GLU CB C 11 33.760 33.579 0.181 1
1 47 . 8 1 1 A 11 11 GLU N N 11 124.055 124.968 -0.913 1
1 48 . 8 1 1 A 12 12 VAL H H 12 8.607 8.707 -0.100 1
1 49 . 8 1 1 A 12 12 VAL HA H 12 5.174 5.485 -0.311 1
1 57 . 8 1 1 A 12 12 VAL C C 12 173.573 174.689 -1.116 1
1 58 . 8 1 1 A 12 12 VAL CA C 12 60.296 61.097 -0.801 1
1 59 . 8 1 1 A 12 12 VAL CB C 12 35.689 34.621 1.068 1
1 62 . 8 1 1 A 12 12 VAL N N 12 120.878 122.748 -1.870 1
1 63 . 8 1 1 A 13 13 HIS H H 13 8.982 8.459 0.523 1
1 64 . 8 1 1 A 13 13 HIS HA H 13 4.824 5.055 -0.231 1
1 69 . 8 1 1 A 13 13 HIS C C 13 173.236 171.592 1.644 1
1 70 . 8 1 1 A 13 13 HIS CA C 13 54.906 54.321 0.585 1
1 71 . 8 1 1 A 13 13 HIS CB C 13 33.496 31.720 1.776 1
1 72 . 8 1 1 A 13 13 HIS N N 13 121.504 121.519 -0.015 1
1 73 . 8 1 1 A 14 14 ILE H H 14 10.442 8.884 1.558 1
1 74 . 8 1 1 A 14 14 ILE HA H 14 5.458 4.588 0.870 1
1 84 . 8 1 1 A 14 14 ILE CA C 14 58.386 57.887 0.499 1
1 85 . 8 1 1 A 14 14 ILE CB C 14 38.596 38.414 0.182 1
1 88 . 8 1 1 A 14 14 ILE N N 14 119.923 121.330 -1.407 1
1 89 . 8 1 1 A 15 15 PRO HA H 15 4.560 4.651 -0.091 1
1 95 . 8 1 1 A 15 15 PRO C C 15 176.907 176.090 0.817 1
1 96 . 8 1 1 A 15 15 PRO CA C 15 64.342 64.413 -0.071 1
1 97 . 8 1 1 A 15 15 PRO CB C 15 32.924 32.210 0.714 1
1 100 . 8 1 1 A 16 16 SER H H 16 7.331 7.881 -0.550 1
1 101 . 8 1 1 A 16 16 SER HA H 16 4.822 5.038 -0.216 1
1 104 . 8 1 1 A 16 16 SER C C 16 171.253 172.362 -1.109 1
1 105 . 8 1 1 A 16 16 SER CA C 16 57.135 57.926 -0.791 1
1 106 . 8 1 1 A 16 16 SER CB C 16 65.947 67.278 -1.331 1
1 107 . 8 1 1 A 16 16 SER N N 16 107.745 113.802 -6.057 1
1 108 . 8 1 1 A 17 17 VAL H H 17 8.350 8.214 0.136 1
1 109 . 8 1 1 A 17 17 VAL HA H 17 4.926 4.961 -0.035 1
1 117 . 8 1 1 A 17 17 VAL C C 17 173.692 174.674 -0.982 1
1 118 . 8 1 1 A 17 17 VAL CA C 17 58.721 60.617 -1.896 1
1 119 . 8 1 1 A 17 17 VAL CB C 17 34.420 34.839 -0.419 1
1 122 . 8 1 1 A 17 17 VAL N N 17 118.680 122.990 -4.310 1
1 123 . 8 1 1 A 18 18 GLY H H 18 8.332 9.167 -0.835 1
1 124 . 8 1 1 A 18 18 GLY HA2 H 18 4.189 4.354 -0.165 1
1 125 . 8 1 1 A 18 18 GLY HA3 H 18 4.011 4.409 -0.398 1
1 126 . 8 1 1 A 18 18 GLY CA C 18 45.356 44.459 0.897 1
1 127 . 8 1 1 A 18 18 GLY N N 18 112.549 114.513 -1.964 1
1 128 . 8 1 1 A 19 19 PRO HA H 19 4.757 5.058 -0.301 1
1 134 . 8 1 1 A 19 19 PRO C C 19 177.482 175.899 1.583 1
1 135 . 8 1 1 A 19 19 PRO CA C 19 62.848 62.921 -0.073 1
1 136 . 8 1 1 A 19 19 PRO CB C 19 32.283 29.770 2.513 1
1 139 . 8 1 1 A 20 20 GLU H H 20 8.588 8.298 0.290 1
1 140 . 8 1 1 A 20 20 GLU HA H 20 4.147 4.372 -0.225 1
1 144 . 8 1 1 A 20 20 GLU C C 20 175.857 176.699 -0.842 1
1 145 . 8 1 1 A 20 20 GLU CA C 20 57.150 56.547 0.603 1
1 146 . 8 1 1 A 20 20 GLU CB C 20 30.923 29.933 0.990 1
1 148 . 8 1 1 A 20 20 GLU N N 20 122.087 122.113 -0.026 1
1 149 . 8 1 1 A 21 21 ALA H H 21 8.352 7.311 1.041 1
1 150 . 8 1 1 A 21 21 ALA HA H 21 4.391 4.444 -0.053 1
1 154 . 8 1 1 A 21 21 ALA C C 21 174.910 177.508 -2.598 1
1 155 . 8 1 1 A 21 21 ALA CA C 21 52.166 51.700 0.466 1
1 156 . 8 1 1 A 21 21 ALA CB C 21 19.915 21.200 -1.285 1
1 157 . 8 1 1 A 21 21 ALA N N 21 124.593 122.767 1.826 1
1 158 . 8 1 1 A 22 22 GLU H H 22 8.398 8.436 -0.038 1
1 159 . 8 1 1 A 22 22 GLU HA H 22 4.331 4.514 -0.183 1
1 163 . 8 1 1 A 22 22 GLU C C 22 176.389 176.539 -0.150 1
1 164 . 8 1 1 A 22 22 GLU CA C 22 56.316 54.737 1.579 1
1 165 . 8 1 1 A 22 22 GLU CB C 22 30.713 30.423 0.290 1
1 167 . 8 1 1 A 22 22 GLU N N 22 120.159 118.423 1.736 1
1 168 . 8 1 1 A 23 23 GLY H H 23 8.246 8.811 -0.565 1
1 169 . 8 1 1 A 23 23 GLY HA2 H 23 4.162 4.401 -0.239 1
1 170 . 8 1 1 A 23 23 GLY HA3 H 23 4.061 4.426 -0.365 1
1 171 . 8 1 1 A 23 23 GLY CA C 23 44.801 45.529 -0.728 1
1 172 . 8 1 1 A 23 23 GLY N N 23 110.080 107.791 2.289 1
1 173 . 8 1 1 A 24 24 PRO HA H 24 4.417 4.454 -0.037 1
1 178 . 8 1 1 A 24 24 PRO C C 24 177.135 176.067 1.068 1
1 179 . 8 1 1 A 24 24 PRO CA C 24 63.520 64.793 -1.273 1
1 180 . 8 1 1 A 24 24 PRO CB C 24 32.124 32.077 0.047 1
1 183 . 8 1 1 A 25 25 ARG H H 25 8.409 7.328 1.081 1
1 184 . 8 1 1 A 25 25 ARG HA H 25 4.298 4.685 -0.387 1
1 187 . 8 1 1 A 25 25 ARG C C 25 176.217 174.491 1.726 1
1 188 . 8 1 1 A 25 25 ARG CA C 25 56.237 54.789 1.448 1
1 189 . 8 1 1 A 25 25 ARG CB C 25 30.467 32.342 -1.875 1
1 192 . 8 1 1 A 25 25 ARG N N 25 120.147 112.498 7.649 1
1 193 . 8 1 1 A 26 26 GLN H H 26 8.278 8.367 -0.089 1
1 194 . 8 1 1 A 26 26 GLN HA H 26 4.336 4.577 -0.241 1
1 200 . 8 1 1 A 26 26 GLN C C 26 175.566 174.713 0.853 1
1 201 . 8 1 1 A 26 26 GLN CA C 26 55.788 55.549 0.239 1
1 202 . 8 1 1 A 26 26 GLN CB C 26 29.714 28.908 0.806 1
1 204 . 8 1 1 A 26 26 GLN N N 26 120.460 119.556 0.904 1
1 206 . 8 1 1 A 27 27 SER H H 27 8.298 8.345 -0.047 1
1 208 . 8 1 1 A 27 27 SER CA C 27 56.156 56.666 -0.510 1
1 209 . 8 1 1 A 27 27 SER CB C 27 63.813 63.886 -0.073 1
1 210 . 8 1 1 A 27 27 SER N N 27 117.382 122.732 -5.350 1
1 211 . 8 1 1 A 28 28 PRO HA H 28 4.366 4.421 -0.055 1
1 216 . 8 1 1 A 28 28 PRO C C 28 177.555 178.468 -0.913 1
1 217 . 8 1 1 A 28 28 PRO CA C 28 64.486 64.573 -0.087 1
1 218 . 8 1 1 A 28 28 PRO CB C 28 31.892 31.844 0.048 1
1 221 . 8 1 1 A 29 29 GLU H H 29 8.582 8.076 0.506 1
1 222 . 8 1 1 A 29 29 GLU HA H 29 4.218 4.231 -0.013 1
1 226 . 8 1 1 A 29 29 GLU CA C 29 57.261 59.665 -2.404 1
1 227 . 8 1 1 A 29 29 GLU CB C 29 29.633 29.354 0.279 1
1 229 . 8 1 1 A 29 29 GLU N N 29 118.309 117.369 0.940 1
1 230 . 8 1 1 A 30 30 LYS H H 30 7.955 7.756 0.199 1
1 231 . 8 1 1 A 30 30 LYS HA H 30 4.328 3.762 0.566 1
1 236 . 8 1 1 A 30 30 LYS C C 30 176.222 174.444 1.778 1
1 237 . 8 1 1 A 30 30 LYS CA C 30 56.247 57.252 -1.005 1
1 238 . 8 1 1 A 30 30 LYS CB C 30 32.720 29.050 3.670 1
1 242 . 8 1 1 A 30 30 LYS N N 30 120.129 116.995 3.134 1
1 243 . 8 1 1 A 31 31 SER H H 31 7.883 7.551 0.332 1
1 244 . 8 1 1 A 31 31 SER HA H 31 4.458 4.576 -0.118 1
1 246 . 8 1 1 A 31 31 SER C C 31 174.129 175.359 -1.230 1
1 247 . 8 1 1 A 31 31 SER CA C 31 58.477 56.865 1.612 1
1 248 . 8 1 1 A 31 31 SER CB C 31 64.042 63.316 0.726 1
1 249 . 8 1 1 A 31 31 SER N N 31 115.366 114.142 1.224 1
1 250 . 8 1 1 A 32 32 HIS H H 32 8.485 8.427 0.058 1
1 251 . 8 1 1 A 32 32 HIS HA H 32 4.450 4.712 -0.262 1
1 255 . 8 1 1 A 32 32 HIS CA C 32 56.009 56.427 -0.418 1
1 256 . 8 1 1 A 32 32 HIS CB C 32 31.122 30.170 0.952 1
1 257 . 8 1 1 A 32 32 HIS N N 32 121.500 125.926 -4.426 1
1 258 . 8 1 1 A 33 33 MET H H 33 8.392 7.574 0.818 1
1 259 . 8 1 1 A 33 33 MET HA H 33 4.601 5.192 -0.591 1
1 265 . 8 1 1 A 33 33 MET C C 33 175.842 175.575 0.267 1
1 266 . 8 1 1 A 33 33 MET CA C 33 54.533 53.419 1.114 1
1 267 . 8 1 1 A 33 33 MET CB C 33 32.868 33.483 -0.615 1
1 270 . 8 1 1 A 33 33 MET N N 33 120.204 118.686 1.518 1
1 271 . 8 1 1 A 34 34 VAL H H 34 8.938 9.442 -0.504 1
1 272 . 8 1 1 A 34 34 VAL HA H 34 4.430 4.672 -0.242 1
1 280 . 8 1 1 A 34 34 VAL C C 34 174.149 174.626 -0.477 1
1 281 . 8 1 1 A 34 34 VAL CA C 34 60.703 59.654 1.049 1
1 282 . 8 1 1 A 34 34 VAL CB C 34 34.319 35.070 -0.751 1
1 285 . 8 1 1 A 34 34 VAL N N 34 118.512 120.569 -2.057 1
1 286 . 8 1 1 A 35 35 PHE H H 35 9.242 7.974 1.268 1
1 287 . 8 1 1 A 35 35 PHE HA H 35 4.439 5.208 -0.769 1
1 294 . 8 1 1 A 35 35 PHE C C 35 174.831 174.744 0.087 1
1 295 . 8 1 1 A 35 35 PHE CA C 35 57.754 55.314 2.440 1
1 296 . 8 1 1 A 35 35 PHE CB C 35 38.959 41.183 -2.224 1
1 297 . 8 1 1 A 35 35 PHE N N 35 124.912 125.854 -0.942 1
1 298 . 8 1 1 A 36 36 ARG H H 36 8.475 8.934 -0.459 1
1 299 . 8 1 1 A 36 36 ARG HA H 36 4.135 5.179 -1.044 1
1 304 . 8 1 1 A 36 36 ARG C C 36 172.865 175.437 -2.572 1
1 305 . 8 1 1 A 36 36 ARG CA C 36 56.895 55.095 1.800 1
1 306 . 8 1 1 A 36 36 ARG CB C 36 28.962 31.328 -2.366 1
1 308 . 8 1 1 A 36 36 ARG N N 36 125.680 121.101 4.579 1
1 309 . 8 1 1 A 37 37 VAL H H 37 8.066 8.871 -0.805 1
1 310 . 8 1 1 A 37 37 VAL HA H 37 4.292 4.479 -0.187 1
1 318 . 8 1 1 A 37 37 VAL C C 37 174.595 175.505 -0.910 1
1 319 . 8 1 1 A 37 37 VAL CA C 37 62.727 61.726 1.001 1
1 320 . 8 1 1 A 37 37 VAL CB C 37 31.102 32.730 -1.628 1
1 323 . 8 1 1 A 37 37 VAL N N 37 125.403 121.148 4.255 1
1 324 . 8 1 1 A 38 38 GLU H H 38 9.532 8.866 0.666 1
1 325 . 8 1 1 A 38 38 GLU HA H 38 4.895 4.636 0.259 1
1 329 . 8 1 1 A 38 38 GLU C C 38 174.509 175.328 -0.819 1
1 330 . 8 1 1 A 38 38 GLU CA C 38 55.650 56.052 -0.402 1
1 331 . 8 1 1 A 38 38 GLU CB C 38 32.214 30.121 2.093 1
1 333 . 8 1 1 A 38 38 GLU N N 38 129.885 126.346 3.539 1
1 334 . 8 1 1 A 39 39 VAL H H 39 9.035 8.502 0.533 1
1 335 . 8 1 1 A 39 39 VAL HA H 39 4.446 4.527 -0.081 1
1 343 . 8 1 1 A 39 39 VAL C C 39 173.661 173.916 -0.255 1
1 344 . 8 1 1 A 39 39 VAL CA C 39 61.258 61.586 -0.328 1
1 345 . 8 1 1 A 39 39 VAL CB C 39 33.533 32.518 1.015 1
1 348 . 8 1 1 A 39 39 VAL N N 39 127.941 126.286 1.655 1
1 349 . 8 1 1 A 40 40 LEU H H 40 8.843 9.303 -0.460 1
1 350 . 8 1 1 A 40 40 LEU HA H 40 5.130 5.616 -0.486 1
1 360 . 8 1 1 A 40 40 LEU C C 40 175.581 174.591 0.990 1
1 361 . 8 1 1 A 40 40 LEU CA C 40 53.702 53.721 -0.019 1
1 362 . 8 1 1 A 40 40 LEU CB C 40 43.989 44.040 -0.051 1
1 366 . 8 1 1 A 40 40 LEU N N 40 128.413 129.802 -1.389 1
1 367 . 8 1 1 A 41 41 CYS H H 41 8.959 8.917 0.042 1
1 368 . 8 1 1 A 41 41 CYS HA H 41 5.174 4.826 0.348 1
1 371 . 8 1 1 A 41 41 CYS C C 41 175.043 174.926 0.117 1
1 372 . 8 1 1 A 41 41 CYS CA C 41 57.483 58.250 -0.767 1
1 373 . 8 1 1 A 41 41 CYS CB C 41 28.472 29.765 -1.293 1
1 374 . 8 1 1 A 41 41 CYS N N 41 124.738 125.230 -0.492 1
1 375 . 8 1 1 A 42 42 SER H H 42 9.527 9.573 -0.046 1
1 376 . 8 1 1 A 42 42 SER HA H 42 4.149 4.080 0.069 1
1 379 . 8 1 1 A 42 42 SER C C 42 175.014 173.615 1.399 1
1 380 . 8 1 1 A 42 42 SER CA C 42 59.058 59.235 -0.177 1
1 381 . 8 1 1 A 42 42 SER CB C 42 62.287 62.028 0.259 1
1 382 . 8 1 1 A 42 42 SER N N 42 125.889 120.733 5.156 1
1 383 . 8 1 1 A 43 43 GLY H H 43 8.685 8.446 0.239 1
1 384 . 8 1 1 A 43 43 GLY HA2 H 43 3.594 3.951 -0.357 1
1 385 . 8 1 1 A 43 43 GLY HA3 H 43 4.210 3.961 0.249 1
1 386 . 8 1 1 A 43 43 GLY C C 43 173.664 174.235 -0.571 1
1 387 . 8 1 1 A 43 43 GLY CA C 43 45.404 45.931 -0.527 1
1 388 . 8 1 1 A 43 43 GLY N N 43 104.633 108.156 -3.523 1
1 389 . 8 1 1 A 44 44 ARG H H 44 7.926 8.117 -0.191 1
1 390 . 8 1 1 A 44 44 ARG HA H 44 4.678 4.373 0.305 1
1 395 . 8 1 1 A 44 44 ARG C C 44 175.261 175.977 -0.716 1
1 396 . 8 1 1 A 44 44 ARG CA C 44 55.011 56.328 -1.317 1
1 397 . 8 1 1 A 44 44 ARG CB C 44 32.138 30.586 1.552 1
1 400 . 8 1 1 A 44 44 ARG N N 44 121.239 120.285 0.954 1
1 401 . 8 1 1 A 45 45 ARG H H 45 8.775 8.886 -0.111 1
1 402 . 8 1 1 A 45 45 ARG HA H 45 5.770 5.717 0.053 1
1 409 . 8 1 1 A 45 45 ARG C C 45 176.064 175.300 0.764 1
1 410 . 8 1 1 A 45 45 ARG CA C 45 54.683 54.650 0.033 1
1 411 . 8 1 1 A 45 45 ARG CB C 45 33.748 33.289 0.459 1
1 414 . 8 1 1 A 45 45 ARG N N 45 125.948 121.712 4.236 1
1 415 . 8 1 1 A 46 46 HIS H H 46 8.912 8.442 0.470 1
1 416 . 8 1 1 A 46 46 HIS HA H 46 4.927 5.768 -0.841 1
1 420 . 8 1 1 A 46 46 HIS C C 46 172.634 172.827 -0.193 1
1 421 . 8 1 1 A 46 46 HIS CA C 46 56.480 53.797 2.683 1
1 422 . 8 1 1 A 46 46 HIS CB C 46 33.608 33.103 0.505 1
1 423 . 8 1 1 A 46 46 HIS N N 46 121.825 116.810 5.015 1
1 424 . 8 1 1 A 47 47 THR H H 47 8.532 8.715 -0.183 1
1 425 . 8 1 1 A 47 47 THR HA H 47 5.472 4.952 0.520 1
1 430 . 8 1 1 A 47 47 THR C C 47 174.442 173.742 0.700 1
1 431 . 8 1 1 A 47 47 THR CA C 47 61.093 61.026 0.067 1
1 432 . 8 1 1 A 47 47 THR CB C 47 71.041 69.293 1.748 1
1 434 . 8 1 1 A 47 47 THR N N 47 115.450 113.574 1.876 1
1 435 . 8 1 1 A 48 48 VAL H H 48 9.695 9.195 0.500 1
1 436 . 8 1 1 A 48 48 VAL HA H 48 4.677 4.547 0.130 1
1 444 . 8 1 1 A 48 48 VAL CA C 48 58.172 59.609 -1.437 1
1 445 . 8 1 1 A 48 48 VAL CB C 48 34.990 32.214 2.776 1
1 448 . 8 1 1 A 48 48 VAL N N 48 126.721 127.337 -0.616 1
1 449 . 8 1 1 A 49 49 PRO HA H 49 5.087 5.005 0.082 1
1 453 . 8 1 1 A 49 49 PRO CA C 49 61.671 62.556 -0.885 1
1 454 . 8 1 1 A 49 49 PRO CB C 49 31.923 31.647 0.276 1
1 457 . 8 1 1 A 50 50 ARG H H 50 9.125 9.156 -0.031 1
1 458 . 8 1 1 A 50 50 ARG HA H 50 4.974 4.800 0.174 1
1 464 . 8 1 1 A 50 50 ARG C C 50 176.187 174.176 2.011 1
1 465 . 8 1 1 A 50 50 ARG CA C 50 53.015 55.087 -2.072 1
1 466 . 8 1 1 A 50 50 ARG CB C 50 36.553 33.863 2.690 1
1 468 . 8 1 1 A 50 50 ARG N N 50 124.189 124.171 0.018 1
1 469 . 8 1 1 A 51 51 ARG H H 51 10.105 9.304 0.801 1
1 470 . 8 1 1 A 51 51 ARG HA H 51 5.196 3.876 1.320 1
1 475 . 8 1 1 A 51 51 ARG C C 51 178.865 176.590 2.275 1
1 476 . 8 1 1 A 51 51 ARG CA C 51 55.961 55.953 0.008 1
1 477 . 8 1 1 A 51 51 ARG CB C 51 32.539 31.647 0.892 1
1 480 . 8 1 1 A 51 51 ARG N N 51 124.521 126.615 -2.094 1
1 481 . 8 1 1 A 52 52 TYR H H 52 10.397 8.433 1.964 1
1 482 . 8 1 1 A 52 52 TYR HA H 52 4.360 4.364 -0.004 1
1 487 . 8 1 1 A 52 52 TYR C C 52 178.143 177.625 0.518 1
1 488 . 8 1 1 A 52 52 TYR CA C 52 63.538 60.714 2.824 1
1 489 . 8 1 1 A 52 52 TYR CB C 52 38.784 37.871 0.913 1
1 490 . 8 1 1 A 52 52 TYR N N 52 124.772 125.774 -1.002 1
1 491 . 8 1 1 A 53 53 SER H H 53 9.231 8.126 1.105 1
1 492 . 8 1 1 A 53 53 SER HA H 53 4.175 4.326 -0.151 1
1 493 . 8 1 1 A 53 53 SER C C 53 177.220 177.430 -0.210 1
1 494 . 8 1 1 A 53 53 SER CA C 53 61.606 61.812 -0.206 1
1 495 . 8 1 1 A 53 53 SER N N 53 113.262 116.570 -3.308 1
1 496 . 8 1 1 A 54 54 GLU H H 54 7.807 7.678 0.129 1
1 497 . 8 1 1 A 54 54 GLU HA H 54 4.392 4.044 0.348 1
1 501 . 8 1 1 A 54 54 GLU C C 54 180.361 179.034 1.327 1
1 502 . 8 1 1 A 54 54 GLU CA C 54 59.497 58.984 0.513 1
1 503 . 8 1 1 A 54 54 GLU CB C 54 30.708 29.354 1.354 1
1 504 . 8 1 1 A 54 54 GLU N N 54 121.949 121.583 0.366 1
1 505 . 8 1 1 A 55 55 PHE H H 55 8.133 8.175 -0.042 1
1 506 . 8 1 1 A 55 55 PHE HA H 55 4.007 4.229 -0.222 1
1 513 . 8 1 1 A 55 55 PHE C C 55 176.531 177.270 -0.739 1
1 514 . 8 1 1 A 55 55 PHE CA C 55 61.848 61.195 0.653 1
1 515 . 8 1 1 A 55 55 PHE CB C 55 38.847 39.090 -0.243 1
1 516 . 8 1 1 A 55 55 PHE N N 55 119.998 121.497 -1.499 1
1 517 . 8 1 1 A 56 56 HIS H H 56 7.907 7.789 0.118 1
1 518 . 8 1 1 A 56 56 HIS HA H 56 3.324 4.280 -0.956 1
1 522 . 8 1 1 A 56 56 HIS C C 56 176.748 177.344 -0.596 1
1 523 . 8 1 1 A 56 56 HIS CA C 56 58.770 59.693 -0.923 1
1 524 . 8 1 1 A 56 56 HIS CB C 56 30.404 29.431 0.973 1
1 525 . 8 1 1 A 56 56 HIS N N 56 119.173 116.596 2.577 1
1 526 . 8 1 1 A 57 57 ALA H H 57 7.962 7.920 0.042 1
1 527 . 8 1 1 A 57 57 ALA HA H 57 3.865 3.863 0.002 1
1 531 . 8 1 1 A 57 57 ALA C C 57 180.075 179.784 0.291 1
1 532 . 8 1 1 A 57 57 ALA CA C 57 54.996 55.015 -0.019 1
1 533 . 8 1 1 A 57 57 ALA CB C 57 18.226 17.894 0.332 1
1 534 . 8 1 1 A 57 57 ALA N N 57 120.094 122.392 -2.298 1
1 535 . 8 1 1 A 58 58 LEU H H 58 7.295 8.327 -1.032 1
1 536 . 8 1 1 A 58 58 LEU HA H 58 3.994 3.904 0.090 1
1 546 . 8 1 1 A 58 58 LEU C C 58 177.428 178.600 -1.172 1
1 547 . 8 1 1 A 58 58 LEU CA C 58 58.342 57.858 0.484 1
1 548 . 8 1 1 A 58 58 LEU CB C 58 40.851 41.578 -0.727 1
1 552 . 8 1 1 A 58 58 LEU N N 58 119.404 120.000 -0.596 1
1 553 . 8 1 1 A 59 59 HIS H H 59 7.805 8.533 -0.728 1
1 554 . 8 1 1 A 59 59 HIS HA H 59 4.286 3.707 0.579 1
1 558 . 8 1 1 A 59 59 HIS C C 59 177.001 177.136 -0.135 1
1 559 . 8 1 1 A 59 59 HIS CA C 59 60.141 60.061 0.080 1
1 560 . 8 1 1 A 59 59 HIS CB C 59 31.072 29.054 2.018 1
1 561 . 8 1 1 A 59 59 HIS N N 59 119.040 118.411 0.629 1
1 562 . 8 1 1 A 60 60 LYS H H 60 7.715 7.853 -0.138 1
1 563 . 8 1 1 A 60 60 LYS HA H 60 3.456 3.535 -0.079 1
1 570 . 8 1 1 A 60 60 LYS C C 60 178.464 178.664 -0.200 1
1 571 . 8 1 1 A 60 60 LYS CA C 60 59.629 58.866 0.763 1
1 572 . 8 1 1 A 60 60 LYS CB C 60 32.354 31.882 0.472 1
1 576 . 8 1 1 A 60 60 LYS N N 60 114.225 117.682 -3.457 1
1 577 . 8 1 1 A 61 61 ARG H H 61 7.486 7.653 -0.167 1
1 578 . 8 1 1 A 61 61 ARG HA H 61 4.202 3.922 0.280 1
1 584 . 8 1 1 A 61 61 ARG C C 61 178.995 178.947 0.048 1
1 585 . 8 1 1 A 61 61 ARG CA C 61 58.387 59.208 -0.821 1
1 586 . 8 1 1 A 61 61 ARG CB C 61 31.216 29.950 1.266 1
1 589 . 8 1 1 A 61 61 ARG N N 61 115.929 118.799 -2.870 1
1 590 . 8 1 1 A 62 62 ILE H H 62 8.066 7.723 0.343 1
1 591 . 8 1 1 A 62 62 ILE HA H 62 4.491 3.512 0.979 1
1 601 . 8 1 1 A 62 62 ILE C C 62 177.838 177.285 0.553 1
1 602 . 8 1 1 A 62 62 ILE CA C 62 63.399 63.628 -0.229 1
1 603 . 8 1 1 A 62 62 ILE CB C 62 39.699 36.540 3.159 1
1 606 . 8 1 1 A 62 62 ILE N N 62 111.456 116.269 -4.813 1
1 607 . 8 1 1 A 63 63 LYS H H 63 8.158 8.420 -0.262 1
1 608 . 8 1 1 A 63 63 LYS HA H 63 4.136 3.945 0.191 1
1 615 . 8 1 1 A 63 63 LYS C C 63 176.358 177.601 -1.243 1
1 616 . 8 1 1 A 63 63 LYS CA C 63 58.753 58.524 0.229 1
1 617 . 8 1 1 A 63 63 LYS CB C 63 30.825 31.196 -0.371 1
1 621 . 8 1 1 A 63 63 LYS N N 63 120.800 122.975 -2.175 1
1 622 . 8 1 1 A 64 64 LYS H H 64 7.687 7.508 0.179 1
1 623 . 8 1 1 A 64 64 LYS HA H 64 4.301 4.133 0.168 1
1 628 . 8 1 1 A 64 64 LYS C C 64 177.084 177.600 -0.516 1
1 629 . 8 1 1 A 64 64 LYS CA C 64 57.237 57.435 -0.198 1
1 630 . 8 1 1 A 64 64 LYS CB C 64 32.502 32.196 0.306 1
1 634 . 8 1 1 A 64 64 LYS N N 64 116.548 118.245 -1.697 1
1 635 . 8 1 1 A 65 65 LEU H H 65 7.476 7.792 -0.316 1
1 636 . 8 1 1 A 65 65 LEU HA H 65 4.219 4.325 -0.106 1
1 645 . 8 1 1 A 65 65 LEU C C 65 175.886 175.928 -0.042 1
1 646 . 8 1 1 A 65 65 LEU CA C 65 55.542 56.632 -1.090 1
1 647 . 8 1 1 A 65 65 LEU CB C 65 45.493 43.403 2.090 1
1 650 . 8 1 1 A 65 65 LEU N N 65 118.000 120.368 -2.368 1
1 651 . 8 1 1 A 66 66 TYR H H 66 7.672 8.239 -0.567 1
1 652 . 8 1 1 A 66 66 TYR HA H 66 4.762 5.300 -0.538 1
1 660 . 8 1 1 A 66 66 TYR C C 66 174.199 174.730 -0.531 1
1 661 . 8 1 1 A 66 66 TYR CA C 66 56.013 55.156 0.857 1
1 662 . 8 1 1 A 66 66 TYR CB C 66 40.380 41.096 -0.716 1
1 663 . 8 1 1 A 66 66 TYR N N 66 116.805 114.257 2.548 1
1 664 . 8 1 1 A 67 67 LYS H H 67 8.547 8.542 0.005 1
1 665 . 8 1 1 A 67 67 LYS HA H 67 4.436 4.598 -0.162 1
1 670 . 8 1 1 A 67 67 LYS C C 67 175.727 176.629 -0.902 1
1 671 . 8 1 1 A 67 67 LYS CA C 67 56.598 56.870 -0.272 1
1 672 . 8 1 1 A 67 67 LYS CB C 67 32.743 32.814 -0.071 1
1 676 . 8 1 1 A 67 67 LYS N N 67 120.929 120.377 0.552 1
1 677 . 8 1 1 A 68 68 VAL H H 68 8.168 8.622 -0.454 1
1 678 . 8 1 1 A 68 68 VAL HA H 68 4.869 4.810 0.059 1
1 686 . 8 1 1 A 68 68 VAL CA C 68 57.389 59.110 -1.721 1
1 687 . 8 1 1 A 68 68 VAL CB C 68 34.017 35.633 -1.616 1
1 690 . 8 1 1 A 68 68 VAL N N 68 116.467 123.758 -7.291 1
1 691 . 8 1 1 A 69 69 PRO HA H 69 4.674 4.500 0.174 1
1 696 . 8 1 1 A 69 69 PRO C C 69 178.013 176.353 1.660 1
1 697 . 8 1 1 A 69 69 PRO CA C 69 61.443 65.645 -4.202 1
1 698 . 8 1 1 A 69 69 PRO CB C 69 32.231 31.901 0.330 1
1 701 . 8 1 1 A 70 70 ASP H H 70 8.167 8.030 0.137 1
1 702 . 8 1 1 A 70 70 ASP HA H 70 4.531 5.329 -0.798 1
1 705 . 8 1 1 A 70 70 ASP C C 70 175.660 173.836 1.824 1
1 706 . 8 1 1 A 70 70 ASP CA C 70 55.148 53.004 2.144 1
1 707 . 8 1 1 A 70 70 ASP CB C 70 40.876 45.721 -4.845 1
1 708 . 8 1 1 A 70 70 ASP N N 70 116.671 117.404 -0.733 1
1 709 . 8 1 1 A 71 71 PHE H H 71 8.387 8.474 -0.087 1
1 710 . 8 1 1 A 71 71 PHE HA H 71 4.076 4.977 -0.901 1
1 717 . 8 1 1 A 71 71 PHE CA C 71 55.672 54.734 0.938 1
1 718 . 8 1 1 A 71 71 PHE CB C 71 39.155 41.720 -2.565 1
1 719 . 8 1 1 A 71 71 PHE N N 71 126.533 117.160 9.373 1
1 720 . 8 1 1 A 72 72 PRO HA H 72 4.156 4.355 -0.199 1
1 727 . 8 1 1 A 72 72 PRO CA C 72 63.079 62.482 0.597 1
1 728 . 8 1 1 A 72 72 PRO CB C 72 32.107 32.095 0.012 1
1 731 . 8 1 1 A 73 73 SER H H 73 8.468 8.521 -0.053 1
1 733 . 8 1 1 A 73 73 SER CA C 73 56.133 58.821 -2.688 1
1 734 . 8 1 1 A 73 73 SER CB C 73 63.991 63.720 0.271 1
1 735 . 8 1 1 A 73 73 SER N N 73 121.533 117.931 3.602 1
1 736 . 8 1 1 A 74 74 LYS HA H 74 4.574 3.570 1.004 1
1 739 . 8 1 1 A 74 74 LYS CA C 74 55.659 58.197 -2.538 1
1 740 . 8 1 1 A 74 74 LYS CB C 74 30.550 32.069 -1.519 1
1 741 . 8 1 1 A 75 75 ARG H H 75 7.962 7.080 0.882 1
1 742 . 8 1 1 A 75 75 ARG HA H 75 4.162 4.837 -0.675 1
1 746 . 8 1 1 A 75 75 ARG CA C 75 56.123 54.642 1.481 1
1 747 . 8 1 1 A 75 75 ARG CB C 75 31.179 32.782 -1.603 1
1 749 . 8 1 1 A 75 75 ARG N N 75 121.665 120.117 1.548 1
1 750 . 8 1 1 A 76 76 LEU H H 76 8.071 8.582 -0.511 1
1 751 . 8 1 1 A 76 76 LEU HA H 76 4.618 4.473 0.145 1
1 759 . 8 1 1 A 76 76 LEU CA C 76 52.764 53.104 -0.340 1
1 760 . 8 1 1 A 76 76 LEU CB C 76 41.918 41.362 0.556 1
1 762 . 8 1 1 A 76 76 LEU N N 76 124.196 127.551 -3.355 1
1 763 . 8 1 1 A 77 77 PRO HA H 77 4.393 4.294 0.099 1
1 767 . 8 1 1 A 77 77 PRO CA C 77 63.746 62.460 1.286 1
1 770 . 8 1 1 A 78 78 ASN H H 78 8.379 8.557 -0.178 1
1 771 . 8 1 1 A 78 78 ASN HA H 78 4.586 3.994 0.592 1
1 776 . 8 1 1 A 78 78 ASN C C 78 175.648 174.354 1.294 1
1 777 . 8 1 1 A 78 78 ASN CA C 78 53.591 53.198 0.393 1
1 778 . 8 1 1 A 78 78 ASN CB C 78 37.826 38.199 -0.373 1
1 779 . 8 1 1 A 78 78 ASN N N 78 115.292 118.837 -3.545 1
1 781 . 8 1 1 A 79 79 TRP H H 79 7.900 7.832 0.068 1
1 782 . 8 1 1 A 79 79 TRP HA H 79 4.326 4.180 0.146 1
1 788 . 8 1 1 A 79 79 TRP CA C 79 58.825 58.190 0.635 1
1 789 . 8 1 1 A 79 79 TRP CB C 79 29.090 26.621 2.469 1
1 790 . 8 1 1 A 79 79 TRP N N 79 119.525 116.582 2.943 1
1 792 . 8 1 1 A 80 80 ARG H H 80 8.060 8.113 -0.053 1
1 793 . 8 1 1 A 80 80 ARG HA H 80 3.913 4.195 -0.282 1
1 798 . 8 1 1 A 80 80 ARG C C 80 177.024 177.042 -0.018 1
1 799 . 8 1 1 A 80 80 ARG CA C 80 58.292 58.583 -0.291 1
1 800 . 8 1 1 A 80 80 ARG CB C 80 30.146 29.965 0.181 1
1 803 . 8 1 1 A 80 80 ARG N N 80 118.864 119.293 -0.429 1
1 804 . 8 1 1 A 81 81 THR H H 81 7.725 8.011 -0.286 1
1 805 . 8 1 1 A 81 81 THR HA H 81 4.297 4.441 -0.144 1
1 809 . 8 1 1 A 81 81 THR CA C 81 62.481 62.334 0.147 1
1 811 . 8 1 1 A 81 81 THR N N 81 109.863 114.285 -4.422 1
1 812 . 8 1 1 A 82 82 ARG HA H 82 4.341 4.515 -0.174 1
1 816 . 8 1 1 A 82 82 ARG C C 82 177.261 177.257 0.004 1
1 817 . 8 1 1 A 82 82 ARG CA C 82 56.846 56.023 0.823 1
1 818 . 8 1 1 A 82 82 ARG CB C 82 30.288 32.776 -2.488 1
1 820 . 8 1 1 A 83 83 GLY H H 83 8.321 8.812 -0.491 1
1 821 . 8 1 1 A 83 83 GLY HA2 H 83 3.957 4.005 -0.048 1
1 822 . 8 1 1 A 83 83 GLY C C 83 175.185 175.358 -0.173 1
1 823 . 8 1 1 A 83 83 GLY CA C 83 46.297 46.648 -0.351 1
1 824 . 8 1 1 A 83 83 GLY N N 83 109.146 107.688 1.458 1
1 825 . 8 1 1 A 84 84 LEU H H 84 8.303 8.517 -0.214 1
1 826 . 8 1 1 A 84 84 LEU HA H 84 4.018 3.638 0.380 1
1 835 . 8 1 1 A 84 84 LEU C C 84 178.552 179.044 -0.492 1
1 836 . 8 1 1 A 84 84 LEU CA C 84 58.236 57.017 1.219 1
1 837 . 8 1 1 A 84 84 LEU CB C 84 41.837 41.116 0.721 1
1 840 . 8 1 1 A 84 84 LEU N N 84 122.662 126.454 -3.792 1
1 841 . 8 1 1 A 85 85 GLU H H 85 8.233 8.303 -0.070 1
1 842 . 8 1 1 A 85 85 GLU HA H 85 4.371 3.730 0.641 1
1 846 . 8 1 1 A 85 85 GLU C C 85 178.555 179.036 -0.481 1
1 847 . 8 1 1 A 85 85 GLU CA C 85 58.377 59.995 -1.618 1
1 848 . 8 1 1 A 85 85 GLU CB C 85 28.675 29.229 -0.554 1
1 850 . 8 1 1 A 85 85 GLU N N 85 119.781 120.703 -0.922 1
1 851 . 8 1 1 A 86 86 GLN H H 86 7.877 7.765 0.112 1
1 852 . 8 1 1 A 86 86 GLN HA H 86 4.100 4.011 0.089 1
1 858 . 8 1 1 A 86 86 GLN C C 86 179.557 177.663 1.894 1
1 859 . 8 1 1 A 86 86 GLN CA C 86 58.955 58.757 0.198 1
1 860 . 8 1 1 A 86 86 GLN CB C 86 28.191 28.396 -0.205 1
1 862 . 8 1 1 A 86 86 GLN N N 86 118.042 118.998 -0.956 1
1 863 . 8 1 1 A 87 87 ARG H H 87 8.169 6.682 1.487 1
1 864 . 8 1 1 A 87 87 ARG HA H 87 3.975 3.629 0.346 1
1 868 . 8 1 1 A 87 87 ARG C C 87 177.051 178.161 -1.110 1
1 869 . 8 1 1 A 87 87 ARG CA C 87 59.006 59.063 -0.057 1
1 870 . 8 1 1 A 87 87 ARG CB C 87 30.383 29.082 1.301 1
1 872 . 8 1 1 A 87 87 ARG N N 87 121.381 119.241 2.140 1
1 873 . 8 1 1 A 88 88 ARG H H 88 8.593 7.823 0.770 1
1 874 . 8 1 1 A 88 88 ARG HA H 88 3.726 3.691 0.035 1
1 876 . 8 1 1 A 88 88 ARG C C 88 177.520 178.290 -0.770 1
1 877 . 8 1 1 A 88 88 ARG CA C 88 60.751 59.368 1.383 1
1 878 . 8 1 1 A 88 88 ARG CB C 88 30.153 29.928 0.225 1
1 879 . 8 1 1 A 88 88 ARG N N 88 120.863 119.070 1.793 1
1 880 . 8 1 1 A 89 89 GLN H H 89 8.355 7.891 0.464 1
1 881 . 8 1 1 A 89 89 GLN HA H 89 3.887 3.873 0.014 1
1 887 . 8 1 1 A 89 89 GLN C C 89 179.499 178.455 1.044 1
1 888 . 8 1 1 A 89 89 GLN CA C 89 59.603 59.417 0.186 1
1 889 . 8 1 1 A 89 89 GLN CB C 89 28.464 28.068 0.396 1
1 891 . 8 1 1 A 89 89 GLN N N 89 116.860 118.260 -1.400 1
1 893 . 8 1 1 A 90 90 GLY H H 90 8.406 8.077 0.329 1
1 894 . 8 1 1 A 90 90 GLY HA2 H 90 3.672 3.730 -0.058 1
1 895 . 8 1 1 A 90 90 GLY HA3 H 90 3.871 3.746 0.125 1
1 896 . 8 1 1 A 90 90 GLY C C 90 177.033 175.771 1.262 1
1 897 . 8 1 1 A 90 90 GLY CA C 90 46.813 47.200 -0.387 1
1 898 . 8 1 1 A 90 90 GLY N N 90 107.679 107.269 0.410 1
1 899 . 8 1 1 A 91 91 LEU H H 91 8.504 7.819 0.685 1
1 900 . 8 1 1 A 91 91 LEU HA H 91 3.784 3.801 -0.017 1
1 910 . 8 1 1 A 91 91 LEU C C 91 178.003 178.660 -0.657 1
1 911 . 8 1 1 A 91 91 LEU CA C 91 57.354 57.636 -0.282 1
1 912 . 8 1 1 A 91 91 LEU CB C 91 40.359 40.845 -0.486 1
1 916 . 8 1 1 A 91 91 LEU N N 91 123.959 121.732 2.227 1
1 917 . 8 1 1 A 92 92 GLU H H 92 8.324 8.502 -0.178 1
1 918 . 8 1 1 A 92 92 GLU HA H 92 3.732 3.892 -0.160 1
1 922 . 8 1 1 A 92 92 GLU C C 92 177.272 178.652 -1.380 1
1 923 . 8 1 1 A 92 92 GLU CA C 92 60.651 59.280 1.371 1
1 924 . 8 1 1 A 92 92 GLU CB C 92 30.843 28.858 1.985 1
1 926 . 8 1 1 A 92 92 GLU N N 92 121.991 117.301 4.690 1
1 927 . 8 1 1 A 93 93 ALA H H 93 8.126 7.724 0.402 1
1 928 . 8 1 1 A 93 93 ALA HA H 93 4.160 4.009 0.151 1
1 932 . 8 1 1 A 93 93 ALA C C 93 180.818 179.140 1.678 1
1 933 . 8 1 1 A 93 93 ALA CA C 93 54.828 54.884 -0.056 1
1 934 . 8 1 1 A 93 93 ALA CB C 93 18.032 18.275 -0.243 1
1 935 . 8 1 1 A 93 93 ALA N N 93 120.066 122.272 -2.206 1
1 936 . 8 1 1 A 94 94 TYR H H 94 7.916 7.590 0.326 1
1 937 . 8 1 1 A 94 94 TYR HA H 94 4.139 4.369 -0.230 1
1 942 . 8 1 1 A 94 94 TYR C C 94 175.895 178.560 -2.665 1
1 943 . 8 1 1 A 94 94 TYR CA C 94 61.915 61.656 0.259 1
1 944 . 8 1 1 A 94 94 TYR CB C 94 38.740 38.265 0.475 1
1 945 . 8 1 1 A 94 94 TYR N N 94 121.179 115.749 5.430 1
1 946 . 8 1 1 A 95 95 ILE H H 95 7.983 8.487 -0.504 1
1 947 . 8 1 1 A 95 95 ILE HA H 95 3.614 3.849 -0.235 1
1 957 . 8 1 1 A 95 95 ILE C C 95 174.678 178.158 -3.480 1
1 958 . 8 1 1 A 95 95 ILE CA C 95 63.461 65.170 -1.709 1
1 959 . 8 1 1 A 95 95 ILE CB C 95 36.625 37.504 -0.879 1
1 963 . 8 1 1 A 95 95 ILE N N 95 116.397 120.192 -3.795 1
1 964 . 8 1 1 A 96 96 GLN H H 96 8.175 8.603 -0.428 1
1 965 . 8 1 1 A 96 96 GLN HA H 96 3.763 4.001 -0.238 1
1 970 . 8 1 1 A 96 96 GLN C C 96 179.042 178.585 0.457 1
1 971 . 8 1 1 A 96 96 GLN CA C 96 59.270 60.013 -0.743 1
1 972 . 8 1 1 A 96 96 GLN CB C 96 27.696 27.803 -0.107 1
1 974 . 8 1 1 A 96 96 GLN N N 96 116.631 120.425 -3.794 1
1 976 . 8 1 1 A 97 97 GLY H H 97 8.222 8.121 0.101 1
1 977 . 8 1 1 A 97 97 GLY HA2 H 97 3.661 3.751 -0.090 1
1 978 . 8 1 1 A 97 97 GLY HA3 H 97 3.806 3.756 0.050 1
1 979 . 8 1 1 A 97 97 GLY C C 97 175.449 176.090 -0.641 1
1 980 . 8 1 1 A 97 97 GLY CA C 97 46.917 47.392 -0.475 1
1 981 . 8 1 1 A 97 97 GLY N N 97 107.315 107.118 0.197 1
1 982 . 8 1 1 A 98 98 ILE H H 98 7.630 8.243 -0.613 1
1 983 . 8 1 1 A 98 98 ILE HA H 98 3.399 3.944 -0.545 1
1 993 . 8 1 1 A 98 98 ILE C C 98 178.683 177.802 0.881 1
1 994 . 8 1 1 A 98 98 ILE CA C 98 66.402 64.821 1.581 1
1 995 . 8 1 1 A 98 98 ILE CB C 98 38.037 37.905 0.132 1
1 999 . 8 1 1 A 98 98 ILE N N 98 120.644 121.237 -0.593 1
1 1000 . 8 1 1 A 99 99 LEU H H 99 7.076 7.883 -0.807 1
1 1001 . 8 1 1 A 99 99 LEU HA H 99 4.133 3.982 0.151 1
1 1010 . 8 1 1 A 99 99 LEU C C 99 178.128 178.034 0.094 1
1 1011 . 8 1 1 A 99 99 LEU CA C 99 57.129 57.823 -0.694 1
1 1012 . 8 1 1 A 99 99 LEU CB C 99 41.108 41.756 -0.648 1
1 1014 . 8 1 1 A 99 99 LEU N N 99 116.844 124.254 -7.410 1
1 1015 . 8 1 1 A 100 100 TYR H H 100 7.890 8.272 -0.382 1
1 1016 . 8 1 1 A 100 100 TYR HA H 100 4.550 4.176 0.374 1
1 1021 . 8 1 1 A 100 100 TYR C C 100 178.210 177.496 0.714 1
1 1022 . 8 1 1 A 100 100 TYR CA C 100 59.452 60.353 -0.901 1
1 1023 . 8 1 1 A 100 100 TYR CB C 100 38.786 39.345 -0.559 1
1 1024 . 8 1 1 A 100 100 TYR N N 100 116.427 120.205 -3.778 1
1 1025 . 8 1 1 A 101 101 LEU H H 101 8.041 8.082 -0.041 1
1 1026 . 8 1 1 A 101 101 LEU HA H 101 4.158 3.933 0.225 1
1 1036 . 8 1 1 A 101 101 LEU C C 101 176.808 177.726 -0.918 1
1 1037 . 8 1 1 A 101 101 LEU CA C 101 56.156 58.174 -2.018 1
1 1038 . 8 1 1 A 101 101 LEU CB C 101 44.307 41.969 2.338 1
1 1041 . 8 1 1 A 101 101 LEU N N 101 116.493 120.171 -3.678 1
1 1042 . 8 1 1 A 102 102 ASN H H 102 7.146 7.877 -0.731 1
1 1043 . 8 1 1 A 102 102 ASN HA H 102 5.056 4.998 0.058 1
1 1046 . 8 1 1 A 102 102 ASN CA C 102 52.704 54.568 -1.864 1
1 1047 . 8 1 1 A 102 102 ASN CB C 102 42.424 39.939 2.485 1
1 1048 . 8 1 1 A 102 102 ASN N N 102 114.922 115.365 -0.443 1
1 1049 . 8 1 1 A 103 103 GLN H H 103 8.477 7.576 0.901 1
1 1050 . 8 1 1 A 103 103 GLN HA H 103 3.866 4.320 -0.454 1
1 1054 . 8 1 1 A 103 103 GLN C C 103 176.110 175.432 0.678 1
1 1055 . 8 1 1 A 103 103 GLN CA C 103 58.451 56.066 2.385 1
1 1056 . 8 1 1 A 103 103 GLN CB C 103 28.896 29.208 -0.312 1
1 1058 . 8 1 1 A 103 103 GLN N N 103 120.252 119.047 1.205 1
1 1059 . 8 1 1 A 104 104 GLU H H 104 7.930 8.085 -0.155 1
1 1060 . 8 1 1 A 104 104 GLU HA H 104 4.591 4.867 -0.276 1
1 1064 . 8 1 1 A 104 104 GLU C C 104 175.397 175.996 -0.599 1
1 1065 . 8 1 1 A 104 104 GLU CA C 104 54.058 58.435 -4.377 1
1 1066 . 8 1 1 A 104 104 GLU CB C 104 31.272 28.137 3.135 1
1 1068 . 8 1 1 A 104 104 GLU N N 104 117.295 118.757 -1.462 1
1 1069 . 8 1 1 A 105 105 VAL H H 105 8.546 8.202 0.344 1
1 1070 . 8 1 1 A 105 105 VAL HA H 105 3.823 4.175 -0.352 1
1 1078 . 8 1 1 A 105 105 VAL CA C 105 60.706 60.901 -0.195 1
1 1079 . 8 1 1 A 105 105 VAL CB C 105 32.126 32.587 -0.461 1
1 1082 . 8 1 1 A 105 105 VAL N N 105 124.511 124.267 0.244 1
1 1083 . 8 1 1 A 106 106 PRO HA H 106 3.997 4.801 -0.804 1
1 1089 . 8 1 1 A 106 106 PRO C C 106 178.240 178.063 0.177 1
1 1090 . 8 1 1 A 106 106 PRO CA C 106 62.961 63.668 -0.707 1
1 1091 . 8 1 1 A 106 106 PRO CB C 106 32.321 32.321 0.000 1
1 1094 . 8 1 1 A 107 107 LYS H H 107 9.122 8.783 0.339 1
1 1095 . 8 1 1 A 107 107 LYS HA H 107 3.813 4.008 -0.195 1
1 1101 . 8 1 1 A 107 107 LYS C C 107 178.563 178.170 0.393 1
1 1102 . 8 1 1 A 107 107 LYS CA C 107 60.085 59.693 0.392 1
1 1103 . 8 1 1 A 107 107 LYS CB C 107 31.632 32.273 -0.641 1
1 1106 . 8 1 1 A 107 107 LYS N N 107 129.017 125.216 3.801 1
1 1107 . 8 1 1 A 108 108 GLU H H 108 10.370 8.168 2.202 1
1 1108 . 8 1 1 A 108 108 GLU HA H 108 3.991 4.082 -0.091 1
1 1111 . 8 1 1 A 108 108 GLU C C 108 180.366 178.760 1.606 1
1 1112 . 8 1 1 A 108 108 GLU CA C 108 60.337 59.167 1.170 1
1 1113 . 8 1 1 A 108 108 GLU CB C 108 29.178 29.542 -0.364 1
1 1115 . 8 1 1 A 108 108 GLU N N 108 118.335 119.163 -0.828 1
1 1116 . 8 1 1 A 109 109 LEU H H 109 7.393 8.096 -0.703 1
1 1117 . 8 1 1 A 109 109 LEU HA H 109 4.220 4.225 -0.005 1
1 1126 . 8 1 1 A 109 109 LEU C C 109 177.378 178.331 -0.953 1
1 1127 . 8 1 1 A 109 109 LEU CA C 109 56.618 58.220 -1.602 1
1 1128 . 8 1 1 A 109 109 LEU CB C 109 41.898 41.580 0.318 1
1 1131 . 8 1 1 A 109 109 LEU N N 109 118.285 121.272 -2.987 1
1 1132 . 8 1 1 A 110 110 LEU H H 110 7.641 8.015 -0.374 1
1 1133 . 8 1 1 A 110 110 LEU HA H 110 3.796 4.113 -0.317 1
1 1142 . 8 1 1 A 110 110 LEU C C 110 179.103 178.339 0.764 1
1 1143 . 8 1 1 A 110 110 LEU CA C 110 59.046 58.502 0.544 1
1 1144 . 8 1 1 A 110 110 LEU CB C 110 40.228 41.419 -1.191 1
1 1147 . 8 1 1 A 110 110 LEU N N 110 120.162 119.958 0.204 1
1 1148 . 8 1 1 A 111 111 GLU H H 111 7.916 8.626 -0.710 1
1 1149 . 8 1 1 A 111 111 GLU HA H 111 4.080 4.084 -0.004 1
1 1153 . 8 1 1 A 111 111 GLU C C 111 179.967 178.953 1.014 1
1 1154 . 8 1 1 A 111 111 GLU CA C 111 59.243 59.087 0.156 1
1 1155 . 8 1 1 A 111 111 GLU CB C 111 29.576 29.071 0.505 1
1 1157 . 8 1 1 A 111 111 GLU N N 111 117.360 118.689 -1.329 1
1 1158 . 8 1 1 A 112 112 PHE H H 112 7.712 8.227 -0.515 1
1 1159 . 8 1 1 A 112 112 PHE HA H 112 4.224 4.208 0.016 1
1 1164 . 8 1 1 A 112 112 PHE C C 112 177.180 177.182 -0.002 1
1 1165 . 8 1 1 A 112 112 PHE CA C 112 61.407 61.311 0.096 1
1 1166 . 8 1 1 A 112 112 PHE CB C 112 40.172 39.548 0.624 1
1 1167 . 8 1 1 A 112 112 PHE N N 112 123.042 121.044 1.998 1
1 1168 . 8 1 1 A 113 113 LEU H H 113 8.056 7.886 0.170 1
1 1169 . 8 1 1 A 113 113 LEU HA H 113 4.147 4.144 0.003 1
1 1175 . 8 1 1 A 113 113 LEU C C 113 173.717 175.858 -2.141 1
1 1176 . 8 1 1 A 113 113 LEU CA C 113 54.093 54.422 -0.329 1
1 1177 . 8 1 1 A 113 113 LEU CB C 113 41.517 41.951 -0.434 1
1 1179 . 8 1 1 A 113 113 LEU N N 113 115.595 117.088 -1.493 1
1 1180 . 8 1 1 A 114 114 ARG H H 114 7.902 7.584 0.318 1
1 1181 . 8 1 1 A 114 114 ARG HA H 114 3.817 3.956 -0.139 1
1 1182 . 8 1 1 A 114 114 ARG C C 114 174.566 175.340 -0.774 1
1 1183 . 8 1 1 A 114 114 ARG CA C 114 57.233 57.091 0.142 1
1 1184 . 8 1 1 A 114 114 ARG CB C 114 27.788 27.163 0.625 1
1 1185 . 8 1 1 A 114 114 ARG N N 114 116.021 115.952 0.069 1
1 1186 . 8 1 1 A 115 115 LEU H H 115 8.160 8.095 0.065 1
1 1187 . 8 1 1 A 115 115 LEU HA H 115 4.462 4.639 -0.177 1
1 1195 . 8 1 1 A 115 115 LEU C C 115 176.374 176.067 0.307 1
1 1196 . 8 1 1 A 115 115 LEU CA C 115 53.965 54.503 -0.538 1
1 1197 . 8 1 1 A 115 115 LEU CB C 115 44.077 40.393 3.684 1
1 1199 . 8 1 1 A 115 115 LEU N N 115 118.089 120.021 -1.932 1
1 1200 . 8 1 1 A 116 116 ARG H H 116 8.066 8.094 -0.028 1
1 1201 . 8 1 1 A 116 116 ARG HA H 116 4.172 4.388 -0.216 1
1 1203 . 8 1 1 A 116 116 ARG CA C 116 55.961 55.022 0.939 1
1 1204 . 8 1 1 A 116 116 ARG CB C 116 31.379 30.638 0.741 1
1 1205 . 8 1 1 A 116 116 ARG N N 116 120.852 123.738 -2.886 1
1 1206 . 8 1 1 A 117 117 HIS H H 117 7.928 8.242 -0.314 1
1 1207 . 8 1 1 A 117 117 HIS HA H 117 4.557 4.554 0.003 1
1 1211 . 8 1 1 A 117 117 HIS CA C 117 55.937 54.654 1.283 1
1 1212 . 8 1 1 A 117 117 HIS CB C 117 30.875 28.746 2.129 1
1 1213 . 8 1 1 A 118 118 PHE H H 118 8.183 8.585 -0.402 1
1 1214 . 8 1 1 A 118 118 PHE HA H 118 4.730 4.427 0.303 1
1 1219 . 8 1 1 A 118 118 PHE CA C 118 55.716 56.135 -0.419 1
1 1220 . 8 1 1 A 118 118 PHE CB C 118 39.263 38.257 1.006 1
1 1221 . 8 1 1 A 118 118 PHE N N 118 123.480 125.590 -2.110 1
1 1222 . 8 1 1 A 119 119 PRO HA H 119 4.398 4.545 -0.147 1
1 1227 . 8 1 1 A 119 119 PRO C C 119 176.666 176.518 0.148 1
1 1228 . 8 1 1 A 119 119 PRO CA C 119 63.377 62.357 1.020 1
1 1229 . 8 1 1 A 119 119 PRO CB C 119 32.059 33.099 -1.040 1
1 1232 . 8 1 1 A 120 120 THR H H 120 8.054 8.363 -0.309 1
1 1233 . 8 1 1 A 120 120 THR HA H 120 4.273 4.945 -0.672 1
1 1238 . 8 1 1 A 120 120 THR C C 120 174.154 173.571 0.583 1
1 1239 . 8 1 1 A 120 120 THR CA C 120 61.893 60.943 0.950 1
1 1240 . 8 1 1 A 120 120 THR CB C 120 69.736 69.864 -0.128 1
1 1242 . 8 1 1 A 120 120 THR N N 120 113.088 111.957 1.131 1
1 1243 . 8 1 1 A 121 121 ASP H H 121 8.209 9.277 -1.068 1
1 1244 . 8 1 1 A 121 121 ASP HA H 121 4.876 5.160 -0.284 1
1 1247 . 8 1 1 A 121 121 ASP CA C 121 52.126 50.444 1.682 1
1 1248 . 8 1 1 A 121 121 ASP CB C 121 41.553 41.530 0.023 1
1 1249 . 8 1 1 A 121 121 ASP N N 121 123.630 126.216 -2.586 1
1 1250 . 8 1 1 A 122 122 PRO HA H 122 4.363 4.677 -0.314 1
1 1255 . 8 1 1 A 122 122 PRO C C 122 177.344 176.348 0.996 1
1 1256 . 8 1 1 A 122 122 PRO CA C 122 63.913 62.462 1.451 1
1 1257 . 8 1 1 A 122 122 PRO CB C 122 32.116 32.303 -0.187 1
1 1260 . 8 1 1 A 123 123 LYS H H 123 8.344 8.440 -0.096 1
1 1261 . 8 1 1 A 123 123 LYS HA H 123 4.244 4.465 -0.221 1
1 1266 . 8 1 1 A 123 123 LYS C C 123 176.637 175.313 1.324 1
1 1267 . 8 1 1 A 123 123 LYS CA C 123 56.359 56.185 0.174 1
1 1268 . 8 1 1 A 123 123 LYS CB C 123 32.367 31.695 0.672 1
1 1272 . 8 1 1 A 123 123 LYS N N 123 119.110 121.539 -2.429 1
1 1273 . 8 1 1 A 124 124 ALA H H 124 7.929 7.925 0.004 1
1 1274 . 8 1 1 A 124 124 ALA HA H 124 4.248 4.763 -0.515 1
1 1278 . 8 1 1 A 124 124 ALA C C 124 177.648 175.825 1.823 1
1 1279 . 8 1 1 A 124 124 ALA CA C 124 52.618 51.757 0.861 1
1 1280 . 8 1 1 A 124 124 ALA CB C 124 19.379 19.718 -0.339 1
1 1281 . 8 1 1 A 124 124 ALA N N 124 123.825 128.621 -4.796 1
1 1282 . 8 1 1 A 125 125 SER H H 125 8.134 8.837 -0.703 1
1 1283 . 8 1 1 A 125 125 SER HA H 125 4.341 4.976 -0.635 1
1 1286 . 8 1 1 A 125 125 SER C C 125 174.172 173.086 1.086 1
1 1287 . 8 1 1 A 125 125 SER CA C 125 58.391 57.620 0.771 1
1 1288 . 8 1 1 A 125 125 SER CB C 125 63.748 64.962 -1.214 1
1 1289 . 8 1 1 A 125 125 SER N N 125 114.454 119.030 -4.576 1
1 1290 . 8 1 1 A 126 126 ASN H H 126 8.242 8.631 -0.389 1
1 1291 . 8 1 1 A 126 126 ASN HA H 126 4.657 4.977 -0.320 1
1 1294 . 8 1 1 A 126 126 ASN C C 126 174.624 174.057 0.567 1
1 1295 . 8 1 1 A 126 126 ASN CA C 126 53.292 52.257 1.035 1
1 1296 . 8 1 1 A 126 126 ASN CB C 126 38.797 38.670 0.127 1
1 1297 . 8 1 1 A 126 126 ASN N N 126 120.102 123.985 -3.883 1
1 1298 . 8 1 1 A 127 127 TRP H H 127 8.051 8.950 -0.899 1
1 1299 . 8 1 1 A 127 127 TRP HA H 127 4.694 5.281 -0.587 1
1 1302 . 8 1 1 A 127 127 TRP C C 127 175.479 176.439 -0.960 1
1 1303 . 8 1 1 A 127 127 TRP CA C 127 57.096 55.755 1.341 1
1 1304 . 8 1 1 A 127 127 TRP CB C 127 29.820 30.290 -0.470 1
1 1305 . 8 1 1 A 127 127 TRP N N 127 121.198 125.302 -4.104 1
1 1 . 9 1 1 A 7 7 HIS HA H 7 4.623 4.198 0.425 1
1 4 . 9 1 1 A 7 7 HIS C C 7 174.747 175.549 -0.802 1
1 5 . 9 1 1 A 7 7 HIS CA C 7 56.189 56.807 -0.618 1
1 6 . 9 1 1 A 7 7 HIS CB C 7 30.028 29.165 0.863 1
1 7 . 9 1 1 A 8 8 LEU H H 8 8.283 7.808 0.475 1
1 8 . 9 1 1 A 8 8 LEU HA H 8 4.249 4.245 0.004 1
1 10 . 9 1 1 A 8 8 LEU C C 8 176.700 176.065 0.635 1
1 11 . 9 1 1 A 8 8 LEU CA C 8 55.498 54.786 0.712 1
1 12 . 9 1 1 A 8 8 LEU CB C 8 42.568 42.434 0.134 1
1 13 . 9 1 1 A 8 8 LEU N N 8 122.916 120.779 2.137 1
1 14 . 9 1 1 A 9 9 GLU H H 9 8.623 7.845 0.778 1
1 15 . 9 1 1 A 9 9 GLU HA H 9 4.311 4.068 0.243 1
1 16 . 9 1 1 A 9 9 GLU C C 9 174.811 175.087 -0.276 1
1 17 . 9 1 1 A 9 9 GLU CA C 9 56.377 56.846 -0.469 1
1 18 . 9 1 1 A 9 9 GLU CB C 9 29.557 28.352 1.205 1
1 20 . 9 1 1 A 9 9 GLU N N 9 121.512 116.324 5.188 1
1 21 . 9 1 1 A 10 10 LEU H H 10 7.853 8.214 -0.361 1
1 22 . 9 1 1 A 10 10 LEU HA H 10 5.225 5.235 -0.010 1
1 31 . 9 1 1 A 10 10 LEU C C 10 174.637 175.482 -0.845 1
1 32 . 9 1 1 A 10 10 LEU CA C 10 54.513 54.174 0.339 1
1 33 . 9 1 1 A 10 10 LEU CB C 10 45.187 44.444 0.743 1
1 36 . 9 1 1 A 10 10 LEU N N 10 123.592 122.619 0.973 1
1 37 . 9 1 1 A 11 11 GLU H H 11 8.894 8.890 0.004 1
1 38 . 9 1 1 A 11 11 GLU HA H 11 4.765 5.209 -0.444 1
1 43 . 9 1 1 A 11 11 GLU C C 11 174.563 175.175 -0.612 1
1 44 . 9 1 1 A 11 11 GLU CA C 11 55.047 54.581 0.466 1
1 45 . 9 1 1 A 11 11 GLU CB C 11 33.760 33.571 0.189 1
1 47 . 9 1 1 A 11 11 GLU N N 11 124.055 123.403 0.652 1
1 48 . 9 1 1 A 12 12 VAL H H 12 8.607 8.754 -0.147 1
1 49 . 9 1 1 A 12 12 VAL HA H 12 5.174 5.336 -0.162 1
1 57 . 9 1 1 A 12 12 VAL C C 12 173.573 175.230 -1.657 1
1 58 . 9 1 1 A 12 12 VAL CA C 12 60.296 61.232 -0.936 1
1 59 . 9 1 1 A 12 12 VAL CB C 12 35.689 34.419 1.270 1
1 62 . 9 1 1 A 12 12 VAL N N 12 120.878 123.179 -2.301 1
1 63 . 9 1 1 A 13 13 HIS H H 13 8.982 8.977 0.005 1
1 64 . 9 1 1 A 13 13 HIS HA H 13 4.824 5.335 -0.511 1
1 69 . 9 1 1 A 13 13 HIS C C 13 173.236 171.939 1.297 1
1 70 . 9 1 1 A 13 13 HIS CA C 13 54.906 53.885 1.021 1
1 71 . 9 1 1 A 13 13 HIS CB C 13 33.496 32.618 0.878 1
1 72 . 9 1 1 A 13 13 HIS N N 13 121.504 122.095 -0.591 1
1 73 . 9 1 1 A 14 14 ILE H H 14 10.442 9.400 1.042 1
1 74 . 9 1 1 A 14 14 ILE HA H 14 5.458 4.704 0.754 1
1 84 . 9 1 1 A 14 14 ILE CA C 14 58.386 57.902 0.484 1
1 85 . 9 1 1 A 14 14 ILE CB C 14 38.596 38.106 0.490 1
1 88 . 9 1 1 A 14 14 ILE N N 14 119.923 121.315 -1.392 1
1 89 . 9 1 1 A 15 15 PRO HA H 15 4.560 4.398 0.162 1
1 95 . 9 1 1 A 15 15 PRO C C 15 176.907 176.009 0.898 1
1 96 . 9 1 1 A 15 15 PRO CA C 15 64.342 64.377 -0.035 1
1 97 . 9 1 1 A 15 15 PRO CB C 15 32.924 31.988 0.936 1
1 100 . 9 1 1 A 16 16 SER H H 16 7.331 7.526 -0.195 1
1 101 . 9 1 1 A 16 16 SER HA H 16 4.822 4.776 0.046 1
1 104 . 9 1 1 A 16 16 SER C C 16 171.253 171.936 -0.683 1
1 105 . 9 1 1 A 16 16 SER CA C 16 57.135 57.677 -0.542 1
1 106 . 9 1 1 A 16 16 SER CB C 16 65.947 65.500 0.447 1
1 107 . 9 1 1 A 16 16 SER N N 16 107.745 107.420 0.325 1
1 108 . 9 1 1 A 17 17 VAL H H 17 8.350 8.227 0.123 1
1 109 . 9 1 1 A 17 17 VAL HA H 17 4.926 4.947 -0.021 1
1 117 . 9 1 1 A 17 17 VAL C C 17 173.692 175.094 -1.402 1
1 118 . 9 1 1 A 17 17 VAL CA C 17 58.721 60.557 -1.836 1
1 119 . 9 1 1 A 17 17 VAL CB C 17 34.420 36.017 -1.597 1
1 122 . 9 1 1 A 17 17 VAL N N 17 118.680 120.545 -1.865 1
1 123 . 9 1 1 A 18 18 GLY H H 18 8.332 8.966 -0.634 1
1 124 . 9 1 1 A 18 18 GLY HA2 H 18 4.189 4.306 -0.117 1
1 125 . 9 1 1 A 18 18 GLY HA3 H 18 4.011 4.307 -0.296 1
1 126 . 9 1 1 A 18 18 GLY CA C 18 45.356 45.142 0.214 1
1 127 . 9 1 1 A 18 18 GLY N N 18 112.549 112.944 -0.395 1
1 128 . 9 1 1 A 19 19 PRO HA H 19 4.757 4.805 -0.048 1
1 134 . 9 1 1 A 19 19 PRO C C 19 177.482 176.282 1.200 1
1 135 . 9 1 1 A 19 19 PRO CA C 19 62.848 62.344 0.504 1
1 136 . 9 1 1 A 19 19 PRO CB C 19 32.283 30.443 1.840 1
1 139 . 9 1 1 A 20 20 GLU H H 20 8.588 8.630 -0.042 1
1 140 . 9 1 1 A 20 20 GLU HA H 20 4.147 4.655 -0.508 1
1 144 . 9 1 1 A 20 20 GLU C C 20 175.857 175.934 -0.077 1
1 145 . 9 1 1 A 20 20 GLU CA C 20 57.150 55.853 1.297 1
1 146 . 9 1 1 A 20 20 GLU CB C 20 30.923 30.091 0.832 1
1 148 . 9 1 1 A 20 20 GLU N N 20 122.087 118.385 3.702 1
1 149 . 9 1 1 A 21 21 ALA H H 21 8.352 8.008 0.344 1
1 150 . 9 1 1 A 21 21 ALA HA H 21 4.391 4.357 0.034 1
1 154 . 9 1 1 A 21 21 ALA C C 21 174.910 177.354 -2.444 1
1 155 . 9 1 1 A 21 21 ALA CA C 21 52.166 52.240 -0.074 1
1 156 . 9 1 1 A 21 21 ALA CB C 21 19.915 20.076 -0.161 1
1 157 . 9 1 1 A 21 21 ALA N N 21 124.593 122.869 1.724 1
1 158 . 9 1 1 A 22 22 GLU H H 22 8.398 8.443 -0.045 1
1 159 . 9 1 1 A 22 22 GLU HA H 22 4.331 4.460 -0.129 1
1 163 . 9 1 1 A 22 22 GLU C C 22 176.389 176.357 0.032 1
1 164 . 9 1 1 A 22 22 GLU CA C 22 56.316 54.909 1.407 1
1 165 . 9 1 1 A 22 22 GLU CB C 22 30.713 30.522 0.191 1
1 167 . 9 1 1 A 22 22 GLU N N 22 120.159 118.743 1.416 1
1 168 . 9 1 1 A 23 23 GLY H H 23 8.246 8.770 -0.524 1
1 169 . 9 1 1 A 23 23 GLY HA2 H 23 4.162 4.172 -0.010 1
1 170 . 9 1 1 A 23 23 GLY HA3 H 23 4.061 4.369 -0.308 1
1 171 . 9 1 1 A 23 23 GLY CA C 23 44.801 45.989 -1.188 1
1 172 . 9 1 1 A 23 23 GLY N N 23 110.080 107.678 2.402 1
1 173 . 9 1 1 A 24 24 PRO HA H 24 4.417 4.436 -0.019 1
1 178 . 9 1 1 A 24 24 PRO C C 24 177.135 176.544 0.591 1
1 179 . 9 1 1 A 24 24 PRO CA C 24 63.520 65.254 -1.734 1
1 180 . 9 1 1 A 24 24 PRO CB C 24 32.124 31.823 0.301 1
1 183 . 9 1 1 A 25 25 ARG H H 25 8.409 7.574 0.835 1
1 184 . 9 1 1 A 25 25 ARG HA H 25 4.298 4.763 -0.465 1
1 187 . 9 1 1 A 25 25 ARG C C 25 176.217 174.206 2.011 1
1 188 . 9 1 1 A 25 25 ARG CA C 25 56.237 55.156 1.081 1
1 189 . 9 1 1 A 25 25 ARG CB C 25 30.467 33.584 -3.117 1
1 192 . 9 1 1 A 25 25 ARG N N 25 120.147 116.664 3.483 1
1 193 . 9 1 1 A 26 26 GLN H H 26 8.278 8.415 -0.137 1
1 194 . 9 1 1 A 26 26 GLN HA H 26 4.336 4.398 -0.062 1
1 200 . 9 1 1 A 26 26 GLN C C 26 175.566 175.371 0.195 1
1 201 . 9 1 1 A 26 26 GLN CA C 26 55.788 56.214 -0.426 1
1 202 . 9 1 1 A 26 26 GLN CB C 26 29.714 28.952 0.762 1
1 204 . 9 1 1 A 26 26 GLN N N 26 120.460 124.028 -3.568 1
1 206 . 9 1 1 A 27 27 SER H H 27 8.298 8.726 -0.428 1
1 208 . 9 1 1 A 27 27 SER CA C 27 56.156 56.888 -0.732 1
1 209 . 9 1 1 A 27 27 SER CB C 27 63.813 63.948 -0.135 1
1 210 . 9 1 1 A 27 27 SER N N 27 117.382 124.185 -6.803 1
1 211 . 9 1 1 A 28 28 PRO HA H 28 4.366 4.404 -0.038 1
1 216 . 9 1 1 A 28 28 PRO C C 28 177.555 176.435 1.120 1
1 217 . 9 1 1 A 28 28 PRO CA C 28 64.486 63.875 0.611 1
1 218 . 9 1 1 A 28 28 PRO CB C 28 31.892 31.979 -0.087 1
1 221 . 9 1 1 A 29 29 GLU H H 29 8.582 8.063 0.519 1
1 222 . 9 1 1 A 29 29 GLU HA H 29 4.218 3.935 0.283 1
1 226 . 9 1 1 A 29 29 GLU CA C 29 57.261 56.919 0.342 1
1 227 . 9 1 1 A 29 29 GLU CB C 29 29.633 27.959 1.674 1
1 229 . 9 1 1 A 29 29 GLU N N 29 118.309 115.761 2.548 1
1 230 . 9 1 1 A 30 30 LYS H H 30 7.955 7.778 0.177 1
1 231 . 9 1 1 A 30 30 LYS HA H 30 4.328 4.850 -0.522 1
1 236 . 9 1 1 A 30 30 LYS C C 30 176.222 175.276 0.946 1
1 237 . 9 1 1 A 30 30 LYS CA C 30 56.247 54.260 1.987 1
1 238 . 9 1 1 A 30 30 LYS CB C 30 32.720 36.224 -3.504 1
1 242 . 9 1 1 A 30 30 LYS N N 30 120.129 118.739 1.390 1
1 243 . 9 1 1 A 31 31 SER H H 31 7.883 8.625 -0.742 1
1 244 . 9 1 1 A 31 31 SER HA H 31 4.458 4.506 -0.048 1
1 246 . 9 1 1 A 31 31 SER C C 31 174.129 174.142 -0.013 1
1 247 . 9 1 1 A 31 31 SER CA C 31 58.477 58.986 -0.509 1
1 248 . 9 1 1 A 31 31 SER CB C 31 64.042 63.769 0.273 1
1 249 . 9 1 1 A 31 31 SER N N 31 115.366 116.653 -1.287 1
1 250 . 9 1 1 A 32 32 HIS H H 32 8.485 8.768 -0.283 1
1 251 . 9 1 1 A 32 32 HIS HA H 32 4.450 4.668 -0.218 1
1 255 . 9 1 1 A 32 32 HIS CA C 32 56.009 54.461 1.548 1
1 256 . 9 1 1 A 32 32 HIS CB C 32 31.122 27.443 3.679 1
1 257 . 9 1 1 A 32 32 HIS N N 32 121.500 124.369 -2.869 1
1 258 . 9 1 1 A 33 33 MET H H 33 8.392 8.051 0.341 1
1 259 . 9 1 1 A 33 33 MET HA H 33 4.601 5.142 -0.541 1
1 265 . 9 1 1 A 33 33 MET C C 33 175.842 174.352 1.490 1
1 266 . 9 1 1 A 33 33 MET CA C 33 54.533 53.904 0.629 1
1 267 . 9 1 1 A 33 33 MET CB C 33 32.868 36.015 -3.147 1
1 270 . 9 1 1 A 33 33 MET N N 33 120.204 120.481 -0.277 1
1 271 . 9 1 1 A 34 34 VAL H H 34 8.938 9.297 -0.359 1
1 272 . 9 1 1 A 34 34 VAL HA H 34 4.430 4.677 -0.247 1
1 280 . 9 1 1 A 34 34 VAL C C 34 174.149 174.046 0.103 1
1 281 . 9 1 1 A 34 34 VAL CA C 34 60.703 59.495 1.208 1
1 282 . 9 1 1 A 34 34 VAL CB C 34 34.319 35.645 -1.326 1
1 285 . 9 1 1 A 34 34 VAL N N 34 118.512 121.930 -3.418 1
1 286 . 9 1 1 A 35 35 PHE H H 35 9.242 8.408 0.834 1
1 287 . 9 1 1 A 35 35 PHE HA H 35 4.439 5.680 -1.241 1
1 294 . 9 1 1 A 35 35 PHE C C 35 174.831 173.609 1.222 1
1 295 . 9 1 1 A 35 35 PHE CA C 35 57.754 54.760 2.994 1
1 296 . 9 1 1 A 35 35 PHE CB C 35 38.959 42.392 -3.433 1
1 297 . 9 1 1 A 35 35 PHE N N 35 124.912 123.642 1.270 1
1 298 . 9 1 1 A 36 36 ARG H H 36 8.475 8.892 -0.417 1
1 299 . 9 1 1 A 36 36 ARG HA H 36 4.135 4.696 -0.561 1
1 304 . 9 1 1 A 36 36 ARG C C 36 172.865 175.910 -3.045 1
1 305 . 9 1 1 A 36 36 ARG CA C 36 56.895 55.313 1.582 1
1 306 . 9 1 1 A 36 36 ARG CB C 36 28.962 30.568 -1.606 1
1 308 . 9 1 1 A 36 36 ARG N N 36 125.680 120.529 5.151 1
1 309 . 9 1 1 A 37 37 VAL H H 37 8.066 8.922 -0.856 1
1 310 . 9 1 1 A 37 37 VAL HA H 37 4.292 4.550 -0.258 1
1 318 . 9 1 1 A 37 37 VAL C C 37 174.595 174.811 -0.216 1
1 319 . 9 1 1 A 37 37 VAL CA C 37 62.727 61.407 1.320 1
1 320 . 9 1 1 A 37 37 VAL CB C 37 31.102 33.061 -1.959 1
1 323 . 9 1 1 A 37 37 VAL N N 37 125.403 120.055 5.348 1
1 324 . 9 1 1 A 38 38 GLU H H 38 9.532 9.280 0.252 1
1 325 . 9 1 1 A 38 38 GLU HA H 38 4.895 5.266 -0.371 1
1 329 . 9 1 1 A 38 38 GLU C C 38 174.509 174.870 -0.361 1
1 330 . 9 1 1 A 38 38 GLU CA C 38 55.650 54.806 0.844 1
1 331 . 9 1 1 A 38 38 GLU CB C 38 32.214 32.022 0.192 1
1 333 . 9 1 1 A 38 38 GLU N N 38 129.885 123.653 6.232 1
1 334 . 9 1 1 A 39 39 VAL H H 39 9.035 8.729 0.306 1
1 335 . 9 1 1 A 39 39 VAL HA H 39 4.446 4.536 -0.090 1
1 343 . 9 1 1 A 39 39 VAL C C 39 173.661 174.671 -1.010 1
1 344 . 9 1 1 A 39 39 VAL CA C 39 61.258 62.262 -1.004 1
1 345 . 9 1 1 A 39 39 VAL CB C 39 33.533 32.300 1.233 1
1 348 . 9 1 1 A 39 39 VAL N N 39 127.941 127.370 0.571 1
1 349 . 9 1 1 A 40 40 LEU H H 40 8.843 9.430 -0.587 1
1 350 . 9 1 1 A 40 40 LEU HA H 40 5.130 5.017 0.113 1
1 360 . 9 1 1 A 40 40 LEU C C 40 175.581 175.221 0.360 1
1 361 . 9 1 1 A 40 40 LEU CA C 40 53.702 53.903 -0.201 1
1 362 . 9 1 1 A 40 40 LEU CB C 40 43.989 43.886 0.103 1
1 366 . 9 1 1 A 40 40 LEU N N 40 128.413 129.717 -1.304 1
1 367 . 9 1 1 A 41 41 CYS H H 41 8.959 9.197 -0.238 1
1 368 . 9 1 1 A 41 41 CYS HA H 41 5.174 5.070 0.104 1
1 371 . 9 1 1 A 41 41 CYS C C 41 175.043 174.484 0.559 1
1 372 . 9 1 1 A 41 41 CYS CA C 41 57.483 57.974 -0.491 1
1 373 . 9 1 1 A 41 41 CYS CB C 41 28.472 29.477 -1.005 1
1 374 . 9 1 1 A 41 41 CYS N N 41 124.738 124.439 0.299 1
1 375 . 9 1 1 A 42 42 SER H H 42 9.527 9.313 0.214 1
1 376 . 9 1 1 A 42 42 SER HA H 42 4.149 4.701 -0.552 1
1 379 . 9 1 1 A 42 42 SER C C 42 175.014 173.689 1.325 1
1 380 . 9 1 1 A 42 42 SER CA C 42 59.058 59.204 -0.146 1
1 381 . 9 1 1 A 42 42 SER CB C 42 62.287 62.304 -0.017 1
1 382 . 9 1 1 A 42 42 SER N N 42 125.889 116.806 9.083 1
1 383 . 9 1 1 A 43 43 GLY H H 43 8.685 8.363 0.322 1
1 384 . 9 1 1 A 43 43 GLY HA2 H 43 3.594 4.015 -0.421 1
1 385 . 9 1 1 A 43 43 GLY HA3 H 43 4.210 4.018 0.192 1
1 386 . 9 1 1 A 43 43 GLY C C 43 173.664 174.520 -0.856 1
1 387 . 9 1 1 A 43 43 GLY CA C 43 45.404 45.048 0.356 1
1 388 . 9 1 1 A 43 43 GLY N N 43 104.633 106.779 -2.146 1
1 389 . 9 1 1 A 44 44 ARG H H 44 7.926 7.626 0.300 1
1 390 . 9 1 1 A 44 44 ARG HA H 44 4.678 4.867 -0.189 1
1 395 . 9 1 1 A 44 44 ARG C C 44 175.261 175.578 -0.317 1
1 396 . 9 1 1 A 44 44 ARG CA C 44 55.011 56.321 -1.310 1
1 397 . 9 1 1 A 44 44 ARG CB C 44 32.138 31.413 0.725 1
1 400 . 9 1 1 A 44 44 ARG N N 44 121.239 120.744 0.495 1
1 401 . 9 1 1 A 45 45 ARG H H 45 8.775 9.302 -0.527 1
1 402 . 9 1 1 A 45 45 ARG HA H 45 5.770 5.665 0.105 1
1 409 . 9 1 1 A 45 45 ARG C C 45 176.064 174.595 1.469 1
1 410 . 9 1 1 A 45 45 ARG CA C 45 54.683 54.629 0.054 1
1 411 . 9 1 1 A 45 45 ARG CB C 45 33.748 33.781 -0.033 1
1 414 . 9 1 1 A 45 45 ARG N N 45 125.948 121.768 4.180 1
1 415 . 9 1 1 A 46 46 HIS H H 46 8.912 8.728 0.184 1
1 416 . 9 1 1 A 46 46 HIS HA H 46 4.927 5.395 -0.468 1
1 420 . 9 1 1 A 46 46 HIS C C 46 172.634 173.467 -0.833 1
1 421 . 9 1 1 A 46 46 HIS CA C 46 56.480 54.371 2.109 1
1 422 . 9 1 1 A 46 46 HIS CB C 46 33.608 32.989 0.619 1
1 423 . 9 1 1 A 46 46 HIS N N 46 121.825 122.059 -0.234 1
1 424 . 9 1 1 A 47 47 THR H H 47 8.532 8.757 -0.225 1
1 425 . 9 1 1 A 47 47 THR HA H 47 5.472 4.711 0.761 1
1 430 . 9 1 1 A 47 47 THR C C 47 174.442 174.207 0.235 1
1 431 . 9 1 1 A 47 47 THR CA C 47 61.093 62.696 -1.603 1
1 432 . 9 1 1 A 47 47 THR CB C 47 71.041 68.737 2.304 1
1 434 . 9 1 1 A 47 47 THR N N 47 115.450 123.186 -7.736 1
1 435 . 9 1 1 A 48 48 VAL H H 48 9.695 9.775 -0.080 1
1 436 . 9 1 1 A 48 48 VAL HA H 48 4.677 4.700 -0.023 1
1 444 . 9 1 1 A 48 48 VAL CA C 48 58.172 59.523 -1.351 1
1 445 . 9 1 1 A 48 48 VAL CB C 48 34.990 32.655 2.335 1
1 448 . 9 1 1 A 48 48 VAL N N 48 126.721 127.900 -1.179 1
1 449 . 9 1 1 A 49 49 PRO HA H 49 5.087 5.137 -0.050 1
1 453 . 9 1 1 A 49 49 PRO CA C 49 61.671 62.353 -0.682 1
1 454 . 9 1 1 A 49 49 PRO CB C 49 31.923 31.774 0.149 1
1 457 . 9 1 1 A 50 50 ARG H H 50 9.125 8.704 0.421 1
1 458 . 9 1 1 A 50 50 ARG HA H 50 4.974 4.782 0.192 1
1 464 . 9 1 1 A 50 50 ARG C C 50 176.187 174.052 2.135 1
1 465 . 9 1 1 A 50 50 ARG CA C 50 53.015 54.204 -1.189 1
1 466 . 9 1 1 A 50 50 ARG CB C 50 36.553 34.715 1.838 1
1 468 . 9 1 1 A 50 50 ARG N N 50 124.189 124.130 0.059 1
1 469 . 9 1 1 A 51 51 ARG H H 51 10.105 8.665 1.440 1
1 470 . 9 1 1 A 51 51 ARG HA H 51 5.196 4.274 0.922 1
1 475 . 9 1 1 A 51 51 ARG C C 51 178.865 176.399 2.466 1
1 476 . 9 1 1 A 51 51 ARG CA C 51 55.961 54.884 1.077 1
1 477 . 9 1 1 A 51 51 ARG CB C 51 32.539 31.937 0.602 1
1 480 . 9 1 1 A 51 51 ARG N N 51 124.521 122.381 2.140 1
1 481 . 9 1 1 A 52 52 TYR H H 52 10.397 8.888 1.509 1
1 482 . 9 1 1 A 52 52 TYR HA H 52 4.360 4.166 0.194 1
1 487 . 9 1 1 A 52 52 TYR C C 52 178.143 177.673 0.470 1
1 488 . 9 1 1 A 52 52 TYR CA C 52 63.538 61.511 2.027 1
1 489 . 9 1 1 A 52 52 TYR CB C 52 38.784 38.837 -0.053 1
1 490 . 9 1 1 A 52 52 TYR N N 52 124.772 127.417 -2.645 1
1 491 . 9 1 1 A 53 53 SER H H 53 9.231 8.327 0.904 1
1 492 . 9 1 1 A 53 53 SER HA H 53 4.175 4.152 0.023 1
1 493 . 9 1 1 A 53 53 SER C C 53 177.220 176.565 0.655 1
1 494 . 9 1 1 A 53 53 SER CA C 53 61.606 61.863 -0.257 1
1 495 . 9 1 1 A 53 53 SER N N 53 113.262 114.368 -1.106 1
1 496 . 9 1 1 A 54 54 GLU H H 54 7.807 8.277 -0.470 1
1 497 . 9 1 1 A 54 54 GLU HA H 54 4.392 3.923 0.469 1
1 501 . 9 1 1 A 54 54 GLU C C 54 180.361 178.961 1.400 1
1 502 . 9 1 1 A 54 54 GLU CA C 54 59.497 59.178 0.319 1
1 503 . 9 1 1 A 54 54 GLU CB C 54 30.708 28.957 1.751 1
1 504 . 9 1 1 A 54 54 GLU N N 54 121.949 119.007 2.942 1
1 505 . 9 1 1 A 55 55 PHE H H 55 8.133 7.910 0.223 1
1 506 . 9 1 1 A 55 55 PHE HA H 55 4.007 4.233 -0.226 1
1 513 . 9 1 1 A 55 55 PHE C C 55 176.531 178.675 -2.144 1
1 514 . 9 1 1 A 55 55 PHE CA C 55 61.848 60.051 1.797 1
1 515 . 9 1 1 A 55 55 PHE CB C 55 38.847 38.059 0.788 1
1 516 . 9 1 1 A 55 55 PHE N N 55 119.998 118.253 1.745 1
1 517 . 9 1 1 A 56 56 HIS H H 56 7.907 8.098 -0.191 1
1 518 . 9 1 1 A 56 56 HIS HA H 56 3.324 4.071 -0.747 1
1 522 . 9 1 1 A 56 56 HIS C C 56 176.748 177.472 -0.724 1
1 523 . 9 1 1 A 56 56 HIS CA C 56 58.770 60.037 -1.267 1
1 524 . 9 1 1 A 56 56 HIS CB C 56 30.404 29.703 0.701 1
1 525 . 9 1 1 A 56 56 HIS N N 56 119.173 118.967 0.206 1
1 526 . 9 1 1 A 57 57 ALA H H 57 7.962 8.001 -0.039 1
1 527 . 9 1 1 A 57 57 ALA HA H 57 3.865 3.821 0.044 1
1 531 . 9 1 1 A 57 57 ALA C C 57 180.075 179.840 0.235 1
1 532 . 9 1 1 A 57 57 ALA CA C 57 54.996 54.988 0.008 1
1 533 . 9 1 1 A 57 57 ALA CB C 57 18.226 17.730 0.496 1
1 534 . 9 1 1 A 57 57 ALA N N 57 120.094 121.178 -1.084 1
1 535 . 9 1 1 A 58 58 LEU H H 58 7.295 8.739 -1.444 1
1 536 . 9 1 1 A 58 58 LEU HA H 58 3.994 3.927 0.067 1
1 546 . 9 1 1 A 58 58 LEU C C 58 177.428 178.620 -1.192 1
1 547 . 9 1 1 A 58 58 LEU CA C 58 58.342 57.881 0.461 1
1 548 . 9 1 1 A 58 58 LEU CB C 58 40.851 41.505 -0.654 1
1 552 . 9 1 1 A 58 58 LEU N N 58 119.404 120.300 -0.896 1
1 553 . 9 1 1 A 59 59 HIS H H 59 7.805 8.027 -0.222 1
1 554 . 9 1 1 A 59 59 HIS HA H 59 4.286 3.998 0.288 1
1 558 . 9 1 1 A 59 59 HIS C C 59 177.001 177.363 -0.362 1
1 559 . 9 1 1 A 59 59 HIS CA C 59 60.141 60.263 -0.122 1
1 560 . 9 1 1 A 59 59 HIS CB C 59 31.072 29.800 1.272 1
1 561 . 9 1 1 A 59 59 HIS N N 59 119.040 118.079 0.961 1
1 562 . 9 1 1 A 60 60 LYS H H 60 7.715 7.748 -0.033 1
1 563 . 9 1 1 A 60 60 LYS HA H 60 3.456 3.811 -0.355 1
1 570 . 9 1 1 A 60 60 LYS C C 60 178.464 178.805 -0.341 1
1 571 . 9 1 1 A 60 60 LYS CA C 60 59.629 58.883 0.746 1
1 572 . 9 1 1 A 60 60 LYS CB C 60 32.354 31.561 0.793 1
1 576 . 9 1 1 A 60 60 LYS N N 60 114.225 118.003 -3.778 1
1 577 . 9 1 1 A 61 61 ARG H H 61 7.486 8.183 -0.697 1
1 578 . 9 1 1 A 61 61 ARG HA H 61 4.202 3.963 0.239 1
1 584 . 9 1 1 A 61 61 ARG C C 61 178.995 178.694 0.301 1
1 585 . 9 1 1 A 61 61 ARG CA C 61 58.387 58.864 -0.477 1
1 586 . 9 1 1 A 61 61 ARG CB C 61 31.216 29.918 1.298 1
1 589 . 9 1 1 A 61 61 ARG N N 61 115.929 119.458 -3.529 1
1 590 . 9 1 1 A 62 62 ILE H H 62 8.066 7.374 0.692 1
1 591 . 9 1 1 A 62 62 ILE HA H 62 4.491 3.946 0.545 1
1 601 . 9 1 1 A 62 62 ILE C C 62 177.838 177.452 0.386 1
1 602 . 9 1 1 A 62 62 ILE CA C 62 63.399 63.790 -0.391 1
1 603 . 9 1 1 A 62 62 ILE CB C 62 39.699 37.525 2.174 1
1 606 . 9 1 1 A 62 62 ILE N N 62 111.456 118.036 -6.580 1
1 607 . 9 1 1 A 63 63 LYS H H 63 8.158 8.021 0.137 1
1 608 . 9 1 1 A 63 63 LYS HA H 63 4.136 3.801 0.335 1
1 615 . 9 1 1 A 63 63 LYS C C 63 176.358 177.870 -1.512 1
1 616 . 9 1 1 A 63 63 LYS CA C 63 58.753 58.892 -0.139 1
1 617 . 9 1 1 A 63 63 LYS CB C 63 30.825 31.811 -0.986 1
1 621 . 9 1 1 A 63 63 LYS N N 63 120.800 123.311 -2.511 1
1 622 . 9 1 1 A 64 64 LYS H H 64 7.687 7.391 0.296 1
1 623 . 9 1 1 A 64 64 LYS HA H 64 4.301 4.157 0.144 1
1 628 . 9 1 1 A 64 64 LYS C C 64 177.084 178.128 -1.044 1
1 629 . 9 1 1 A 64 64 LYS CA C 64 57.237 58.328 -1.091 1
1 630 . 9 1 1 A 64 64 LYS CB C 64 32.502 32.594 -0.092 1
1 634 . 9 1 1 A 64 64 LYS N N 64 116.548 118.822 -2.274 1
1 635 . 9 1 1 A 65 65 LEU H H 65 7.476 7.817 -0.341 1
1 636 . 9 1 1 A 65 65 LEU HA H 65 4.219 4.324 -0.105 1
1 645 . 9 1 1 A 65 65 LEU C C 65 175.886 176.007 -0.121 1
1 646 . 9 1 1 A 65 65 LEU CA C 65 55.542 56.845 -1.303 1
1 647 . 9 1 1 A 65 65 LEU CB C 65 45.493 43.373 2.120 1
1 650 . 9 1 1 A 65 65 LEU N N 65 118.000 120.765 -2.765 1
1 651 . 9 1 1 A 66 66 TYR H H 66 7.672 8.514 -0.842 1
1 652 . 9 1 1 A 66 66 TYR HA H 66 4.762 4.972 -0.210 1
1 660 . 9 1 1 A 66 66 TYR C C 66 174.199 174.247 -0.048 1
1 661 . 9 1 1 A 66 66 TYR CA C 66 56.013 55.550 0.463 1
1 662 . 9 1 1 A 66 66 TYR CB C 66 40.380 40.921 -0.541 1
1 663 . 9 1 1 A 66 66 TYR N N 66 116.805 113.544 3.261 1
1 664 . 9 1 1 A 67 67 LYS H H 67 8.547 8.469 0.078 1
1 665 . 9 1 1 A 67 67 LYS HA H 67 4.436 4.252 0.184 1
1 670 . 9 1 1 A 67 67 LYS C C 67 175.727 175.675 0.052 1
1 671 . 9 1 1 A 67 67 LYS CA C 67 56.598 56.803 -0.205 1
1 672 . 9 1 1 A 67 67 LYS CB C 67 32.743 32.333 0.410 1
1 676 . 9 1 1 A 67 67 LYS N N 67 120.929 120.215 0.714 1
1 677 . 9 1 1 A 68 68 VAL H H 68 8.168 8.108 0.060 1
1 678 . 9 1 1 A 68 68 VAL HA H 68 4.869 4.392 0.477 1
1 686 . 9 1 1 A 68 68 VAL CA C 68 57.389 58.816 -1.427 1
1 687 . 9 1 1 A 68 68 VAL CB C 68 34.017 35.321 -1.304 1
1 690 . 9 1 1 A 68 68 VAL N N 68 116.467 123.851 -7.384 1
1 691 . 9 1 1 A 69 69 PRO HA H 69 4.674 4.639 0.035 1
1 696 . 9 1 1 A 69 69 PRO C C 69 178.013 176.080 1.933 1
1 697 . 9 1 1 A 69 69 PRO CA C 69 61.443 62.245 -0.802 1
1 698 . 9 1 1 A 69 69 PRO CB C 69 32.231 32.994 -0.763 1
1 701 . 9 1 1 A 70 70 ASP H H 70 8.167 8.518 -0.351 1
1 702 . 9 1 1 A 70 70 ASP HA H 70 4.531 4.630 -0.099 1
1 705 . 9 1 1 A 70 70 ASP C C 70 175.660 175.302 0.358 1
1 706 . 9 1 1 A 70 70 ASP CA C 70 55.148 54.266 0.882 1
1 707 . 9 1 1 A 70 70 ASP CB C 70 40.876 41.395 -0.519 1
1 708 . 9 1 1 A 70 70 ASP N N 70 116.671 121.278 -4.607 1
1 709 . 9 1 1 A 71 71 PHE H H 71 8.387 8.171 0.216 1
1 710 . 9 1 1 A 71 71 PHE HA H 71 4.076 4.472 -0.396 1
1 717 . 9 1 1 A 71 71 PHE CA C 71 55.672 54.524 1.148 1
1 718 . 9 1 1 A 71 71 PHE CB C 71 39.155 41.264 -2.109 1
1 719 . 9 1 1 A 71 71 PHE N N 71 126.533 116.856 9.677 1
1 720 . 9 1 1 A 72 72 PRO HA H 72 4.156 4.765 -0.609 1
1 727 . 9 1 1 A 72 72 PRO CA C 72 63.079 62.860 0.219 1
1 728 . 9 1 1 A 72 72 PRO CB C 72 32.107 32.450 -0.343 1
1 731 . 9 1 1 A 73 73 SER H H 73 8.468 8.678 -0.210 1
1 733 . 9 1 1 A 73 73 SER CA C 73 56.133 58.745 -2.612 1
1 734 . 9 1 1 A 73 73 SER CB C 73 63.991 63.787 0.204 1
1 735 . 9 1 1 A 73 73 SER N N 73 121.533 118.041 3.492 1
1 736 . 9 1 1 A 74 74 LYS HA H 74 4.574 4.094 0.480 1
1 739 . 9 1 1 A 74 74 LYS CA C 74 55.659 59.154 -3.495 1
1 740 . 9 1 1 A 74 74 LYS CB C 74 30.550 33.044 -2.494 1
1 741 . 9 1 1 A 75 75 ARG H H 75 7.962 7.677 0.285 1
1 742 . 9 1 1 A 75 75 ARG HA H 75 4.162 4.492 -0.330 1
1 746 . 9 1 1 A 75 75 ARG CA C 75 56.123 55.895 0.228 1
1 747 . 9 1 1 A 75 75 ARG CB C 75 31.179 31.189 -0.010 1
1 749 . 9 1 1 A 75 75 ARG N N 75 121.665 119.416 2.249 1
1 750 . 9 1 1 A 76 76 LEU H H 76 8.071 8.275 -0.204 1
1 751 . 9 1 1 A 76 76 LEU HA H 76 4.618 4.595 0.023 1
1 759 . 9 1 1 A 76 76 LEU CA C 76 52.764 50.993 1.771 1
1 760 . 9 1 1 A 76 76 LEU CB C 76 41.918 44.949 -3.031 1
1 762 . 9 1 1 A 76 76 LEU N N 76 124.196 128.377 -4.181 1
1 763 . 9 1 1 A 77 77 PRO HA H 77 4.393 4.247 0.146 1
1 767 . 9 1 1 A 77 77 PRO CA C 77 63.746 62.363 1.383 1
1 770 . 9 1 1 A 78 78 ASN H H 78 8.379 8.490 -0.111 1
1 771 . 9 1 1 A 78 78 ASN HA H 78 4.586 4.448 0.138 1
1 776 . 9 1 1 A 78 78 ASN C C 78 175.648 174.228 1.420 1
1 777 . 9 1 1 A 78 78 ASN CA C 78 53.591 52.756 0.835 1
1 778 . 9 1 1 A 78 78 ASN CB C 78 37.826 38.529 -0.703 1
1 779 . 9 1 1 A 78 78 ASN N N 78 115.292 119.185 -3.893 1
1 781 . 9 1 1 A 79 79 TRP H H 79 7.900 7.700 0.200 1
1 782 . 9 1 1 A 79 79 TRP HA H 79 4.326 4.299 0.027 1
1 788 . 9 1 1 A 79 79 TRP CA C 79 58.825 58.671 0.154 1
1 789 . 9 1 1 A 79 79 TRP CB C 79 29.090 26.665 2.425 1
1 790 . 9 1 1 A 79 79 TRP N N 79 119.525 116.532 2.993 1
1 792 . 9 1 1 A 80 80 ARG H H 80 8.060 7.897 0.163 1
1 793 . 9 1 1 A 80 80 ARG HA H 80 3.913 4.121 -0.208 1
1 798 . 9 1 1 A 80 80 ARG C C 80 177.024 178.961 -1.937 1
1 799 . 9 1 1 A 80 80 ARG CA C 80 58.292 59.252 -0.960 1
1 800 . 9 1 1 A 80 80 ARG CB C 80 30.146 29.600 0.546 1
1 803 . 9 1 1 A 80 80 ARG N N 80 118.864 120.163 -1.299 1
1 804 . 9 1 1 A 81 81 THR H H 81 7.725 7.667 0.058 1
1 805 . 9 1 1 A 81 81 THR HA H 81 4.297 4.092 0.205 1
1 809 . 9 1 1 A 81 81 THR CA C 81 62.481 66.384 -3.903 1
1 811 . 9 1 1 A 81 81 THR N N 81 109.863 115.107 -5.244 1
1 812 . 9 1 1 A 82 82 ARG HA H 82 4.341 4.741 -0.400 1
1 816 . 9 1 1 A 82 82 ARG C C 82 177.261 175.905 1.356 1
1 817 . 9 1 1 A 82 82 ARG CA C 82 56.846 54.097 2.749 1
1 818 . 9 1 1 A 82 82 ARG CB C 82 30.288 32.391 -2.103 1
1 820 . 9 1 1 A 83 83 GLY H H 83 8.321 8.824 -0.503 1
1 821 . 9 1 1 A 83 83 GLY HA2 H 83 3.957 4.337 -0.380 1
1 822 . 9 1 1 A 83 83 GLY C C 83 175.185 175.021 0.164 1
1 823 . 9 1 1 A 83 83 GLY CA C 83 46.297 44.068 2.229 1
1 824 . 9 1 1 A 83 83 GLY N N 83 109.146 107.714 1.432 1
1 825 . 9 1 1 A 84 84 LEU H H 84 8.303 8.733 -0.430 1
1 826 . 9 1 1 A 84 84 LEU HA H 84 4.018 3.837 0.181 1
1 835 . 9 1 1 A 84 84 LEU C C 84 178.552 178.629 -0.077 1
1 836 . 9 1 1 A 84 84 LEU CA C 84 58.236 57.081 1.155 1
1 837 . 9 1 1 A 84 84 LEU CB C 84 41.837 41.425 0.412 1
1 840 . 9 1 1 A 84 84 LEU N N 84 122.662 119.699 2.963 1
1 841 . 9 1 1 A 85 85 GLU H H 85 8.233 8.224 0.009 1
1 842 . 9 1 1 A 85 85 GLU HA H 85 4.371 3.959 0.412 1
1 846 . 9 1 1 A 85 85 GLU C C 85 178.555 179.558 -1.003 1
1 847 . 9 1 1 A 85 85 GLU CA C 85 58.377 59.605 -1.228 1
1 848 . 9 1 1 A 85 85 GLU CB C 85 28.675 29.047 -0.372 1
1 850 . 9 1 1 A 85 85 GLU N N 85 119.781 119.554 0.227 1
1 851 . 9 1 1 A 86 86 GLN H H 86 7.877 8.068 -0.191 1
1 852 . 9 1 1 A 86 86 GLN HA H 86 4.100 3.969 0.131 1
1 858 . 9 1 1 A 86 86 GLN C C 86 179.557 178.141 1.416 1
1 859 . 9 1 1 A 86 86 GLN CA C 86 58.955 59.151 -0.196 1
1 860 . 9 1 1 A 86 86 GLN CB C 86 28.191 28.363 -0.172 1
1 862 . 9 1 1 A 86 86 GLN N N 86 118.042 120.307 -2.265 1
1 863 . 9 1 1 A 87 87 ARG H H 87 8.169 7.903 0.266 1
1 864 . 9 1 1 A 87 87 ARG HA H 87 3.975 3.991 -0.016 1
1 868 . 9 1 1 A 87 87 ARG C C 87 177.051 178.449 -1.398 1
1 869 . 9 1 1 A 87 87 ARG CA C 87 59.006 59.477 -0.471 1
1 870 . 9 1 1 A 87 87 ARG CB C 87 30.383 29.350 1.033 1
1 872 . 9 1 1 A 87 87 ARG N N 87 121.381 119.657 1.724 1
1 873 . 9 1 1 A 88 88 ARG H H 88 8.593 8.278 0.315 1
1 874 . 9 1 1 A 88 88 ARG HA H 88 3.726 3.718 0.008 1
1 876 . 9 1 1 A 88 88 ARG C C 88 177.520 178.583 -1.063 1
1 877 . 9 1 1 A 88 88 ARG CA C 88 60.751 59.214 1.537 1
1 878 . 9 1 1 A 88 88 ARG CB C 88 30.153 29.886 0.267 1
1 879 . 9 1 1 A 88 88 ARG N N 88 120.863 119.203 1.660 1
1 880 . 9 1 1 A 89 89 GLN H H 89 8.355 8.052 0.303 1
1 881 . 9 1 1 A 89 89 GLN HA H 89 3.887 3.913 -0.026 1
1 887 . 9 1 1 A 89 89 GLN C C 89 179.499 178.413 1.086 1
1 888 . 9 1 1 A 89 89 GLN CA C 89 59.603 59.539 0.064 1
1 889 . 9 1 1 A 89 89 GLN CB C 89 28.464 27.893 0.571 1
1 891 . 9 1 1 A 89 89 GLN N N 89 116.860 119.080 -2.220 1
1 893 . 9 1 1 A 90 90 GLY H H 90 8.406 8.019 0.387 1
1 894 . 9 1 1 A 90 90 GLY HA2 H 90 3.672 3.498 0.174 1
1 895 . 9 1 1 A 90 90 GLY HA3 H 90 3.871 3.727 0.144 1
1 896 . 9 1 1 A 90 90 GLY C C 90 177.033 175.677 1.356 1
1 897 . 9 1 1 A 90 90 GLY CA C 90 46.813 47.069 -0.256 1
1 898 . 9 1 1 A 90 90 GLY N N 90 107.679 107.036 0.643 1
1 899 . 9 1 1 A 91 91 LEU H H 91 8.504 7.949 0.555 1
1 900 . 9 1 1 A 91 91 LEU HA H 91 3.784 4.054 -0.270 1
1 910 . 9 1 1 A 91 91 LEU C C 91 178.003 179.069 -1.066 1
1 911 . 9 1 1 A 91 91 LEU CA C 91 57.354 57.604 -0.250 1
1 912 . 9 1 1 A 91 91 LEU CB C 91 40.359 41.285 -0.926 1
1 916 . 9 1 1 A 91 91 LEU N N 91 123.959 121.369 2.590 1
1 917 . 9 1 1 A 92 92 GLU H H 92 8.324 8.793 -0.469 1
1 918 . 9 1 1 A 92 92 GLU HA H 92 3.732 3.947 -0.215 1
1 922 . 9 1 1 A 92 92 GLU C C 92 177.272 178.789 -1.517 1
1 923 . 9 1 1 A 92 92 GLU CA C 92 60.651 59.130 1.521 1
1 924 . 9 1 1 A 92 92 GLU CB C 92 30.843 29.026 1.817 1
1 926 . 9 1 1 A 92 92 GLU N N 92 121.991 119.507 2.484 1
1 927 . 9 1 1 A 93 93 ALA H H 93 8.126 7.648 0.478 1
1 928 . 9 1 1 A 93 93 ALA HA H 93 4.160 4.022 0.138 1
1 932 . 9 1 1 A 93 93 ALA C C 93 180.818 179.357 1.461 1
1 933 . 9 1 1 A 93 93 ALA CA C 93 54.828 54.956 -0.128 1
1 934 . 9 1 1 A 93 93 ALA CB C 93 18.032 17.965 0.067 1
1 935 . 9 1 1 A 93 93 ALA N N 93 120.066 121.681 -1.615 1
1 936 . 9 1 1 A 94 94 TYR H H 94 7.916 7.846 0.070 1
1 937 . 9 1 1 A 94 94 TYR HA H 94 4.139 4.399 -0.260 1
1 942 . 9 1 1 A 94 94 TYR C C 94 175.895 178.645 -2.750 1
1 943 . 9 1 1 A 94 94 TYR CA C 94 61.915 61.797 0.118 1
1 944 . 9 1 1 A 94 94 TYR CB C 94 38.740 38.283 0.457 1
1 945 . 9 1 1 A 94 94 TYR N N 94 121.179 115.803 5.376 1
1 946 . 9 1 1 A 95 95 ILE H H 95 7.983 8.655 -0.672 1
1 947 . 9 1 1 A 95 95 ILE HA H 95 3.614 3.813 -0.199 1
1 957 . 9 1 1 A 95 95 ILE C C 95 174.678 178.178 -3.500 1
1 958 . 9 1 1 A 95 95 ILE CA C 95 63.461 64.871 -1.410 1
1 959 . 9 1 1 A 95 95 ILE CB C 95 36.625 37.557 -0.932 1
1 963 . 9 1 1 A 95 95 ILE N N 95 116.397 120.323 -3.926 1
1 964 . 9 1 1 A 96 96 GLN H H 96 8.175 8.068 0.107 1
1 965 . 9 1 1 A 96 96 GLN HA H 96 3.763 4.106 -0.343 1
1 970 . 9 1 1 A 96 96 GLN C C 96 179.042 178.610 0.432 1
1 971 . 9 1 1 A 96 96 GLN CA C 96 59.270 59.553 -0.283 1
1 972 . 9 1 1 A 96 96 GLN CB C 96 27.696 28.206 -0.510 1
1 974 . 9 1 1 A 96 96 GLN N N 96 116.631 120.464 -3.833 1
1 976 . 9 1 1 A 97 97 GLY H H 97 8.222 8.211 0.011 1
1 977 . 9 1 1 A 97 97 GLY HA2 H 97 3.661 3.792 -0.131 1
1 978 . 9 1 1 A 97 97 GLY HA3 H 97 3.806 3.821 -0.015 1
1 979 . 9 1 1 A 97 97 GLY C C 97 175.449 176.172 -0.723 1
1 980 . 9 1 1 A 97 97 GLY CA C 97 46.917 47.425 -0.508 1
1 981 . 9 1 1 A 97 97 GLY N N 97 107.315 106.964 0.351 1
1 982 . 9 1 1 A 98 98 ILE H H 98 7.630 8.070 -0.440 1
1 983 . 9 1 1 A 98 98 ILE HA H 98 3.399 3.970 -0.571 1
1 993 . 9 1 1 A 98 98 ILE C C 98 178.683 177.962 0.721 1
1 994 . 9 1 1 A 98 98 ILE CA C 98 66.402 64.787 1.615 1
1 995 . 9 1 1 A 98 98 ILE CB C 98 38.037 37.385 0.652 1
1 999 . 9 1 1 A 98 98 ILE N N 98 120.644 120.517 0.127 1
1 1000 . 9 1 1 A 99 99 LEU H H 99 7.076 7.992 -0.916 1
1 1001 . 9 1 1 A 99 99 LEU HA H 99 4.133 4.599 -0.466 1
1 1010 . 9 1 1 A 99 99 LEU C C 99 178.128 178.268 -0.140 1
1 1011 . 9 1 1 A 99 99 LEU CA C 99 57.129 58.092 -0.963 1
1 1012 . 9 1 1 A 99 99 LEU CB C 99 41.108 41.371 -0.263 1
1 1014 . 9 1 1 A 99 99 LEU N N 99 116.844 123.890 -7.046 1
1 1015 . 9 1 1 A 100 100 TYR H H 100 7.890 8.218 -0.328 1
1 1016 . 9 1 1 A 100 100 TYR HA H 100 4.550 4.205 0.345 1
1 1021 . 9 1 1 A 100 100 TYR C C 100 178.210 177.605 0.605 1
1 1022 . 9 1 1 A 100 100 TYR CA C 100 59.452 60.024 -0.572 1
1 1023 . 9 1 1 A 100 100 TYR CB C 100 38.786 39.504 -0.718 1
1 1024 . 9 1 1 A 100 100 TYR N N 100 116.427 120.388 -3.961 1
1 1025 . 9 1 1 A 101 101 LEU H H 101 8.041 7.868 0.173 1
1 1026 . 9 1 1 A 101 101 LEU HA H 101 4.158 4.252 -0.094 1
1 1036 . 9 1 1 A 101 101 LEU C C 101 176.808 177.439 -0.631 1
1 1037 . 9 1 1 A 101 101 LEU CA C 101 56.156 58.155 -1.999 1
1 1038 . 9 1 1 A 101 101 LEU CB C 101 44.307 42.691 1.616 1
1 1041 . 9 1 1 A 101 101 LEU N N 101 116.493 120.162 -3.669 1
1 1042 . 9 1 1 A 102 102 ASN H H 102 7.146 8.085 -0.939 1
1 1043 . 9 1 1 A 102 102 ASN HA H 102 5.056 5.053 0.003 1
1 1046 . 9 1 1 A 102 102 ASN CA C 102 52.704 54.750 -2.046 1
1 1047 . 9 1 1 A 102 102 ASN CB C 102 42.424 39.845 2.579 1
1 1048 . 9 1 1 A 102 102 ASN N N 102 114.922 113.247 1.675 1
1 1049 . 9 1 1 A 103 103 GLN H H 103 8.477 8.189 0.288 1
1 1050 . 9 1 1 A 103 103 GLN HA H 103 3.866 4.189 -0.323 1
1 1054 . 9 1 1 A 103 103 GLN C C 103 176.110 176.165 -0.055 1
1 1055 . 9 1 1 A 103 103 GLN CA C 103 58.451 55.638 2.813 1
1 1056 . 9 1 1 A 103 103 GLN CB C 103 28.896 28.537 0.359 1
1 1058 . 9 1 1 A 103 103 GLN N N 103 120.252 118.855 1.397 1
1 1059 . 9 1 1 A 104 104 GLU H H 104 7.930 8.175 -0.245 1
1 1060 . 9 1 1 A 104 104 GLU HA H 104 4.591 4.511 0.080 1
1 1064 . 9 1 1 A 104 104 GLU C C 104 175.397 176.211 -0.814 1
1 1065 . 9 1 1 A 104 104 GLU CA C 104 54.058 58.835 -4.777 1
1 1066 . 9 1 1 A 104 104 GLU CB C 104 31.272 28.332 2.940 1
1 1068 . 9 1 1 A 104 104 GLU N N 104 117.295 117.168 0.127 1
1 1069 . 9 1 1 A 105 105 VAL H H 105 8.546 8.366 0.180 1
1 1070 . 9 1 1 A 105 105 VAL HA H 105 3.823 4.435 -0.612 1
1 1078 . 9 1 1 A 105 105 VAL CA C 105 60.706 59.919 0.787 1
1 1079 . 9 1 1 A 105 105 VAL CB C 105 32.126 32.508 -0.382 1
1 1082 . 9 1 1 A 105 105 VAL N N 105 124.511 125.615 -1.104 1
1 1083 . 9 1 1 A 106 106 PRO HA H 106 3.997 4.499 -0.502 1
1 1089 . 9 1 1 A 106 106 PRO C C 106 178.240 177.793 0.447 1
1 1090 . 9 1 1 A 106 106 PRO CA C 106 62.961 63.428 -0.467 1
1 1091 . 9 1 1 A 106 106 PRO CB C 106 32.321 32.277 0.044 1
1 1094 . 9 1 1 A 107 107 LYS H H 107 9.122 9.082 0.040 1
1 1095 . 9 1 1 A 107 107 LYS HA H 107 3.813 3.921 -0.108 1
1 1101 . 9 1 1 A 107 107 LYS C C 107 178.563 178.273 0.290 1
1 1102 . 9 1 1 A 107 107 LYS CA C 107 60.085 59.644 0.441 1
1 1103 . 9 1 1 A 107 107 LYS CB C 107 31.632 32.121 -0.489 1
1 1106 . 9 1 1 A 107 107 LYS N N 107 129.017 124.968 4.049 1
1 1107 . 9 1 1 A 108 108 GLU H H 108 10.370 8.182 2.188 1
1 1108 . 9 1 1 A 108 108 GLU HA H 108 3.991 4.230 -0.239 1
1 1111 . 9 1 1 A 108 108 GLU C C 108 180.366 179.295 1.071 1
1 1112 . 9 1 1 A 108 108 GLU CA C 108 60.337 58.847 1.490 1
1 1113 . 9 1 1 A 108 108 GLU CB C 108 29.178 29.292 -0.114 1
1 1115 . 9 1 1 A 108 108 GLU N N 108 118.335 118.289 0.046 1
1 1116 . 9 1 1 A 109 109 LEU H H 109 7.393 8.253 -0.860 1
1 1117 . 9 1 1 A 109 109 LEU HA H 109 4.220 4.179 0.041 1
1 1126 . 9 1 1 A 109 109 LEU C C 109 177.378 178.994 -1.616 1
1 1127 . 9 1 1 A 109 109 LEU CA C 109 56.618 57.508 -0.890 1
1 1128 . 9 1 1 A 109 109 LEU CB C 109 41.898 41.925 -0.027 1
1 1131 . 9 1 1 A 109 109 LEU N N 109 118.285 122.044 -3.759 1
1 1132 . 9 1 1 A 110 110 LEU H H 110 7.641 7.789 -0.148 1
1 1133 . 9 1 1 A 110 110 LEU HA H 110 3.796 3.940 -0.144 1
1 1142 . 9 1 1 A 110 110 LEU C C 110 179.103 179.294 -0.191 1
1 1143 . 9 1 1 A 110 110 LEU CA C 110 59.046 58.021 1.025 1
1 1144 . 9 1 1 A 110 110 LEU CB C 110 40.228 40.985 -0.757 1
1 1147 . 9 1 1 A 110 110 LEU N N 110 120.162 118.587 1.575 1
1 1148 . 9 1 1 A 111 111 GLU H H 111 7.916 7.966 -0.050 1
1 1149 . 9 1 1 A 111 111 GLU HA H 111 4.080 4.162 -0.082 1
1 1153 . 9 1 1 A 111 111 GLU C C 111 179.967 178.468 1.499 1
1 1154 . 9 1 1 A 111 111 GLU CA C 111 59.243 58.632 0.611 1
1 1155 . 9 1 1 A 111 111 GLU CB C 111 29.576 29.684 -0.108 1
1 1157 . 9 1 1 A 111 111 GLU N N 111 117.360 118.414 -1.054 1
1 1158 . 9 1 1 A 112 112 PHE H H 112 7.712 7.911 -0.199 1
1 1159 . 9 1 1 A 112 112 PHE HA H 112 4.224 4.175 0.049 1
1 1164 . 9 1 1 A 112 112 PHE C C 112 177.180 177.817 -0.637 1
1 1165 . 9 1 1 A 112 112 PHE CA C 112 61.407 61.136 0.271 1
1 1166 . 9 1 1 A 112 112 PHE CB C 112 40.172 39.577 0.595 1
1 1167 . 9 1 1 A 112 112 PHE N N 112 123.042 123.012 0.030 1
1 1168 . 9 1 1 A 113 113 LEU H H 113 8.056 8.425 -0.369 1
1 1169 . 9 1 1 A 113 113 LEU HA H 113 4.147 4.323 -0.176 1
1 1175 . 9 1 1 A 113 113 LEU C C 113 173.717 176.465 -2.748 1
1 1176 . 9 1 1 A 113 113 LEU CA C 113 54.093 56.253 -2.160 1
1 1177 . 9 1 1 A 113 113 LEU CB C 113 41.517 43.072 -1.555 1
1 1179 . 9 1 1 A 113 113 LEU N N 113 115.595 120.340 -4.745 1
1 1180 . 9 1 1 A 114 114 ARG H H 114 7.902 8.023 -0.121 1
1 1181 . 9 1 1 A 114 114 ARG HA H 114 3.817 4.439 -0.622 1
1 1182 . 9 1 1 A 114 114 ARG C C 114 174.566 174.783 -0.217 1
1 1183 . 9 1 1 A 114 114 ARG CA C 114 57.233 56.980 0.253 1
1 1184 . 9 1 1 A 114 114 ARG CB C 114 27.788 28.678 -0.890 1
1 1185 . 9 1 1 A 114 114 ARG N N 114 116.021 119.553 -3.532 1
1 1186 . 9 1 1 A 115 115 LEU H H 115 8.160 7.885 0.275 1
1 1187 . 9 1 1 A 115 115 LEU HA H 115 4.462 4.504 -0.042 1
1 1195 . 9 1 1 A 115 115 LEU C C 115 176.374 176.312 0.062 1
1 1196 . 9 1 1 A 115 115 LEU CA C 115 53.965 53.604 0.361 1
1 1197 . 9 1 1 A 115 115 LEU CB C 115 44.077 43.329 0.748 1
1 1199 . 9 1 1 A 115 115 LEU N N 115 118.089 119.336 -1.247 1
1 1200 . 9 1 1 A 116 116 ARG H H 116 8.066 8.532 -0.466 1
1 1201 . 9 1 1 A 116 116 ARG HA H 116 4.172 4.655 -0.483 1
1 1203 . 9 1 1 A 116 116 ARG CA C 116 55.961 54.301 1.660 1
1 1204 . 9 1 1 A 116 116 ARG CB C 116 31.379 32.985 -1.606 1
1 1205 . 9 1 1 A 116 116 ARG N N 116 120.852 121.461 -0.609 1
1 1206 . 9 1 1 A 117 117 HIS H H 117 7.928 8.378 -0.450 1
1 1207 . 9 1 1 A 117 117 HIS HA H 117 4.557 3.920 0.637 1
1 1211 . 9 1 1 A 117 117 HIS CA C 117 55.937 58.852 -2.915 1
1 1212 . 9 1 1 A 117 117 HIS CB C 117 30.875 28.115 2.760 1
1 1213 . 9 1 1 A 118 118 PHE H H 118 8.183 8.175 0.008 1
1 1214 . 9 1 1 A 118 118 PHE HA H 118 4.730 5.001 -0.271 1
1 1219 . 9 1 1 A 118 118 PHE CA C 118 55.716 56.085 -0.369 1
1 1220 . 9 1 1 A 118 118 PHE CB C 118 39.263 42.918 -3.655 1
1 1221 . 9 1 1 A 118 118 PHE N N 118 123.480 115.292 8.188 1
1 1222 . 9 1 1 A 119 119 PRO HA H 119 4.398 4.824 -0.426 1
1 1227 . 9 1 1 A 119 119 PRO C C 119 176.666 176.299 0.367 1
1 1228 . 9 1 1 A 119 119 PRO CA C 119 63.377 62.504 0.873 1
1 1229 . 9 1 1 A 119 119 PRO CB C 119 32.059 30.146 1.913 1
1 1232 . 9 1 1 A 120 120 THR H H 120 8.054 8.158 -0.104 1
1 1233 . 9 1 1 A 120 120 THR HA H 120 4.273 5.163 -0.890 1
1 1238 . 9 1 1 A 120 120 THR C C 120 174.154 173.645 0.509 1
1 1239 . 9 1 1 A 120 120 THR CA C 120 61.893 59.470 2.423 1
1 1240 . 9 1 1 A 120 120 THR CB C 120 69.736 71.322 -1.586 1
1 1242 . 9 1 1 A 120 120 THR N N 120 113.088 112.688 0.400 1
1 1243 . 9 1 1 A 121 121 ASP H H 121 8.209 8.686 -0.477 1
1 1244 . 9 1 1 A 121 121 ASP HA H 121 4.876 5.196 -0.320 1
1 1247 . 9 1 1 A 121 121 ASP CA C 121 52.126 51.988 0.138 1
1 1248 . 9 1 1 A 121 121 ASP CB C 121 41.553 41.920 -0.367 1
1 1249 . 9 1 1 A 121 121 ASP N N 121 123.630 120.566 3.064 1
1 1250 . 9 1 1 A 122 122 PRO HA H 122 4.363 4.512 -0.149 1
1 1255 . 9 1 1 A 122 122 PRO C C 122 177.344 176.542 0.802 1
1 1256 . 9 1 1 A 122 122 PRO CA C 122 63.913 64.775 -0.862 1
1 1257 . 9 1 1 A 122 122 PRO CB C 122 32.116 32.007 0.109 1
1 1260 . 9 1 1 A 123 123 LYS H H 123 8.344 7.642 0.702 1
1 1261 . 9 1 1 A 123 123 LYS HA H 123 4.244 4.588 -0.344 1
1 1266 . 9 1 1 A 123 123 LYS C C 123 176.637 174.696 1.941 1
1 1267 . 9 1 1 A 123 123 LYS CA C 123 56.359 56.186 0.173 1
1 1268 . 9 1 1 A 123 123 LYS CB C 123 32.367 33.687 -1.320 1
1 1272 . 9 1 1 A 123 123 LYS N N 123 119.110 116.650 2.460 1
1 1273 . 9 1 1 A 124 124 ALA H H 124 7.929 9.234 -1.305 1
1 1274 . 9 1 1 A 124 124 ALA HA H 124 4.248 4.713 -0.465 1
1 1278 . 9 1 1 A 124 124 ALA C C 124 177.648 176.797 0.851 1
1 1279 . 9 1 1 A 124 124 ALA CA C 124 52.618 51.903 0.715 1
1 1280 . 9 1 1 A 124 124 ALA CB C 124 19.379 20.015 -0.636 1
1 1281 . 9 1 1 A 124 124 ALA N N 124 123.825 129.487 -5.662 1
1 1282 . 9 1 1 A 125 125 SER H H 125 8.134 8.594 -0.460 1
1 1283 . 9 1 1 A 125 125 SER HA H 125 4.341 4.685 -0.344 1
1 1286 . 9 1 1 A 125 125 SER C C 125 174.172 173.606 0.566 1
1 1287 . 9 1 1 A 125 125 SER CA C 125 58.391 57.710 0.681 1
1 1288 . 9 1 1 A 125 125 SER CB C 125 63.748 62.903 0.845 1
1 1289 . 9 1 1 A 125 125 SER N N 125 114.454 116.362 -1.908 1
1 1290 . 9 1 1 A 126 126 ASN H H 126 8.242 8.303 -0.061 1
1 1291 . 9 1 1 A 126 126 ASN HA H 126 4.657 5.506 -0.849 1
1 1294 . 9 1 1 A 126 126 ASN C C 126 174.624 173.892 0.732 1
1 1295 . 9 1 1 A 126 126 ASN CA C 126 53.292 52.609 0.683 1
1 1296 . 9 1 1 A 126 126 ASN CB C 126 38.797 41.672 -2.875 1
1 1297 . 9 1 1 A 126 126 ASN N N 126 120.102 123.335 -3.233 1
1 1298 . 9 1 1 A 127 127 TRP H H 127 8.051 8.553 -0.502 1
1 1299 . 9 1 1 A 127 127 TRP HA H 127 4.694 5.106 -0.412 1
1 1302 . 9 1 1 A 127 127 TRP C C 127 175.479 174.899 0.580 1
1 1303 . 9 1 1 A 127 127 TRP CA C 127 57.096 57.094 0.002 1
1 1304 . 9 1 1 A 127 127 TRP CB C 127 29.820 32.670 -2.850 1
1 1305 . 9 1 1 A 127 127 TRP N N 127 121.198 122.175 -0.977 1
1 1 . 10 1 1 A 7 7 HIS HA H 7 4.623 4.855 -0.232 1
1 4 . 10 1 1 A 7 7 HIS C C 7 174.747 174.717 0.030 1
1 5 . 10 1 1 A 7 7 HIS CA C 7 56.189 53.539 2.650 1
1 6 . 10 1 1 A 7 7 HIS CB C 7 30.028 29.516 0.512 1
1 7 . 10 1 1 A 8 8 LEU H H 8 8.283 8.482 -0.199 1
1 8 . 10 1 1 A 8 8 LEU HA H 8 4.249 4.642 -0.393 1
1 10 . 10 1 1 A 8 8 LEU C C 8 176.700 177.317 -0.617 1
1 11 . 10 1 1 A 8 8 LEU CA C 8 55.498 54.138 1.360 1
1 12 . 10 1 1 A 8 8 LEU CB C 8 42.568 43.312 -0.744 1
1 13 . 10 1 1 A 8 8 LEU N N 8 122.916 119.493 3.423 1
1 14 . 10 1 1 A 9 9 GLU H H 9 8.623 7.956 0.667 1
1 15 . 10 1 1 A 9 9 GLU HA H 9 4.311 4.557 -0.246 1
1 16 . 10 1 1 A 9 9 GLU C C 9 174.811 175.778 -0.967 1
1 17 . 10 1 1 A 9 9 GLU CA C 9 56.377 55.554 0.823 1
1 18 . 10 1 1 A 9 9 GLU CB C 9 29.557 29.635 -0.078 1
1 20 . 10 1 1 A 9 9 GLU N N 9 121.512 118.343 3.169 1
1 21 . 10 1 1 A 10 10 LEU H H 10 7.853 7.516 0.337 1
1 22 . 10 1 1 A 10 10 LEU HA H 10 5.225 4.942 0.283 1
1 31 . 10 1 1 A 10 10 LEU C C 10 174.637 175.851 -1.214 1
1 32 . 10 1 1 A 10 10 LEU CA C 10 54.513 54.159 0.354 1
1 33 . 10 1 1 A 10 10 LEU CB C 10 45.187 41.384 3.803 1
1 36 . 10 1 1 A 10 10 LEU N N 10 123.592 122.798 0.794 1
1 37 . 10 1 1 A 11 11 GLU H H 11 8.894 8.948 -0.054 1
1 38 . 10 1 1 A 11 11 GLU HA H 11 4.765 5.024 -0.259 1
1 43 . 10 1 1 A 11 11 GLU C C 11 174.563 175.589 -1.026 1
1 44 . 10 1 1 A 11 11 GLU CA C 11 55.047 54.831 0.216 1
1 45 . 10 1 1 A 11 11 GLU CB C 11 33.760 31.742 2.018 1
1 47 . 10 1 1 A 11 11 GLU N N 11 124.055 124.139 -0.084 1
1 48 . 10 1 1 A 12 12 VAL H H 12 8.607 8.879 -0.272 1
1 49 . 10 1 1 A 12 12 VAL HA H 12 5.174 5.256 -0.082 1
1 57 . 10 1 1 A 12 12 VAL C C 12 173.573 175.472 -1.899 1
1 58 . 10 1 1 A 12 12 VAL CA C 12 60.296 61.298 -1.002 1
1 59 . 10 1 1 A 12 12 VAL CB C 12 35.689 33.149 2.540 1
1 62 . 10 1 1 A 12 12 VAL N N 12 120.878 125.414 -4.536 1
1 63 . 10 1 1 A 13 13 HIS H H 13 8.982 9.162 -0.180 1
1 64 . 10 1 1 A 13 13 HIS HA H 13 4.824 5.295 -0.471 1
1 69 . 10 1 1 A 13 13 HIS C C 13 173.236 171.982 1.254 1
1 70 . 10 1 1 A 13 13 HIS CA C 13 54.906 53.900 1.006 1
1 71 . 10 1 1 A 13 13 HIS CB C 13 33.496 32.735 0.761 1
1 72 . 10 1 1 A 13 13 HIS N N 13 121.504 122.157 -0.653 1
1 73 . 10 1 1 A 14 14 ILE H H 14 10.442 9.286 1.156 1
1 74 . 10 1 1 A 14 14 ILE HA H 14 5.458 4.770 0.688 1
1 84 . 10 1 1 A 14 14 ILE CA C 14 58.386 57.880 0.506 1
1 85 . 10 1 1 A 14 14 ILE CB C 14 38.596 38.102 0.494 1
1 88 . 10 1 1 A 14 14 ILE N N 14 119.923 121.663 -1.740 1
1 89 . 10 1 1 A 15 15 PRO HA H 15 4.560 4.491 0.069 1
1 95 . 10 1 1 A 15 15 PRO C C 15 176.907 176.462 0.445 1
1 96 . 10 1 1 A 15 15 PRO CA C 15 64.342 64.369 -0.027 1
1 97 . 10 1 1 A 15 15 PRO CB C 15 32.924 32.233 0.691 1
1 100 . 10 1 1 A 16 16 SER H H 16 7.331 7.744 -0.413 1
1 101 . 10 1 1 A 16 16 SER HA H 16 4.822 4.975 -0.153 1
1 104 . 10 1 1 A 16 16 SER C C 16 171.253 172.570 -1.317 1
1 105 . 10 1 1 A 16 16 SER CA C 16 57.135 57.783 -0.648 1
1 106 . 10 1 1 A 16 16 SER CB C 16 65.947 67.018 -1.071 1
1 107 . 10 1 1 A 16 16 SER N N 16 107.745 113.951 -6.206 1
1 108 . 10 1 1 A 17 17 VAL H H 17 8.350 8.512 -0.162 1
1 109 . 10 1 1 A 17 17 VAL HA H 17 4.926 5.014 -0.088 1
1 117 . 10 1 1 A 17 17 VAL C C 17 173.692 175.318 -1.626 1
1 118 . 10 1 1 A 17 17 VAL CA C 17 58.721 60.541 -1.820 1
1 119 . 10 1 1 A 17 17 VAL CB C 17 34.420 35.841 -1.421 1
1 122 . 10 1 1 A 17 17 VAL N N 17 118.680 122.586 -3.906 1
1 123 . 10 1 1 A 18 18 GLY H H 18 8.332 8.402 -0.070 1
1 124 . 10 1 1 A 18 18 GLY HA2 H 18 4.189 4.221 -0.032 1
1 125 . 10 1 1 A 18 18 GLY HA3 H 18 4.011 4.241 -0.230 1
1 126 . 10 1 1 A 18 18 GLY CA C 18 45.356 45.116 0.240 1
1 127 . 10 1 1 A 18 18 GLY N N 18 112.549 112.639 -0.090 1
1 128 . 10 1 1 A 19 19 PRO HA H 19 4.757 4.707 0.050 1
1 134 . 10 1 1 A 19 19 PRO C C 19 177.482 177.096 0.386 1
1 135 . 10 1 1 A 19 19 PRO CA C 19 62.848 62.534 0.314 1
1 136 . 10 1 1 A 19 19 PRO CB C 19 32.283 32.020 0.263 1
1 139 . 10 1 1 A 20 20 GLU H H 20 8.588 8.960 -0.372 1
1 140 . 10 1 1 A 20 20 GLU HA H 20 4.147 4.487 -0.340 1
1 144 . 10 1 1 A 20 20 GLU C C 20 175.857 175.144 0.713 1
1 145 . 10 1 1 A 20 20 GLU CA C 20 57.150 57.976 -0.826 1
1 146 . 10 1 1 A 20 20 GLU CB C 20 30.923 30.942 -0.019 1
1 148 . 10 1 1 A 20 20 GLU N N 20 122.087 122.383 -0.296 1
1 149 . 10 1 1 A 21 21 ALA H H 21 8.352 7.974 0.378 1
1 150 . 10 1 1 A 21 21 ALA HA H 21 4.391 4.779 -0.388 1
1 154 . 10 1 1 A 21 21 ALA C C 21 174.910 175.979 -1.069 1
1 155 . 10 1 1 A 21 21 ALA CA C 21 52.166 50.476 1.690 1
1 156 . 10 1 1 A 21 21 ALA CB C 21 19.915 21.981 -2.066 1
1 157 . 10 1 1 A 21 21 ALA N N 21 124.593 120.360 4.233 1
1 158 . 10 1 1 A 22 22 GLU H H 22 8.398 8.642 -0.244 1
1 159 . 10 1 1 A 22 22 GLU HA H 22 4.331 4.467 -0.136 1
1 163 . 10 1 1 A 22 22 GLU C C 22 176.389 176.850 -0.461 1
1 164 . 10 1 1 A 22 22 GLU CA C 22 56.316 56.940 -0.624 1
1 165 . 10 1 1 A 22 22 GLU CB C 22 30.713 29.209 1.504 1
1 167 . 10 1 1 A 22 22 GLU N N 22 120.159 124.184 -4.025 1
1 168 . 10 1 1 A 23 23 GLY H H 23 8.246 9.071 -0.825 1
1 169 . 10 1 1 A 23 23 GLY HA2 H 23 4.162 3.940 0.222 1
1 170 . 10 1 1 A 23 23 GLY HA3 H 23 4.061 3.957 0.104 1
1 171 . 10 1 1 A 23 23 GLY CA C 23 44.801 46.922 -2.121 1
1 172 . 10 1 1 A 23 23 GLY N N 23 110.080 112.248 -2.168 1
1 173 . 10 1 1 A 24 24 PRO HA H 24 4.417 4.493 -0.076 1
1 178 . 10 1 1 A 24 24 PRO C C 24 177.135 176.411 0.724 1
1 179 . 10 1 1 A 24 24 PRO CA C 24 63.520 64.573 -1.053 1
1 180 . 10 1 1 A 24 24 PRO CB C 24 32.124 32.282 -0.158 1
1 183 . 10 1 1 A 25 25 ARG H H 25 8.409 7.562 0.847 1
1 184 . 10 1 1 A 25 25 ARG HA H 25 4.298 4.757 -0.459 1
1 187 . 10 1 1 A 25 25 ARG C C 25 176.217 173.918 2.299 1
1 188 . 10 1 1 A 25 25 ARG CA C 25 56.237 55.171 1.066 1
1 189 . 10 1 1 A 25 25 ARG CB C 25 30.467 34.067 -3.600 1
1 192 . 10 1 1 A 25 25 ARG N N 25 120.147 116.760 3.387 1
1 193 . 10 1 1 A 26 26 GLN H H 26 8.278 8.379 -0.101 1
1 194 . 10 1 1 A 26 26 GLN HA H 26 4.336 4.549 -0.213 1
1 200 . 10 1 1 A 26 26 GLN C C 26 175.566 174.721 0.845 1
1 201 . 10 1 1 A 26 26 GLN CA C 26 55.788 55.659 0.129 1
1 202 . 10 1 1 A 26 26 GLN CB C 26 29.714 28.943 0.771 1
1 204 . 10 1 1 A 26 26 GLN N N 26 120.460 123.281 -2.821 1
1 206 . 10 1 1 A 27 27 SER H H 27 8.298 8.309 -0.011 1
1 208 . 10 1 1 A 27 27 SER CA C 27 56.156 56.574 -0.418 1
1 209 . 10 1 1 A 27 27 SER CB C 27 63.813 63.887 -0.074 1
1 210 . 10 1 1 A 27 27 SER N N 27 117.382 122.501 -5.119 1
1 211 . 10 1 1 A 28 28 PRO HA H 28 4.366 4.405 -0.039 1
1 216 . 10 1 1 A 28 28 PRO C C 28 177.555 177.813 -0.258 1
1 217 . 10 1 1 A 28 28 PRO CA C 28 64.486 65.258 -0.772 1
1 218 . 10 1 1 A 28 28 PRO CB C 28 31.892 31.834 0.058 1
1 221 . 10 1 1 A 29 29 GLU H H 29 8.582 8.131 0.451 1
1 222 . 10 1 1 A 29 29 GLU HA H 29 4.218 4.589 -0.371 1
1 226 . 10 1 1 A 29 29 GLU CA C 29 57.261 57.748 -0.487 1
1 227 . 10 1 1 A 29 29 GLU CB C 29 29.633 32.392 -2.759 1
1 229 . 10 1 1 A 29 29 GLU N N 29 118.309 116.895 1.414 1
1 230 . 10 1 1 A 30 30 LYS H H 30 7.955 8.034 -0.079 1
1 231 . 10 1 1 A 30 30 LYS HA H 30 4.328 4.461 -0.133 1
1 236 . 10 1 1 A 30 30 LYS C C 30 176.222 174.667 1.555 1
1 237 . 10 1 1 A 30 30 LYS CA C 30 56.247 58.088 -1.841 1
1 238 . 10 1 1 A 30 30 LYS CB C 30 32.720 31.548 1.172 1
1 242 . 10 1 1 A 30 30 LYS N N 30 120.129 118.850 1.279 1
1 243 . 10 1 1 A 31 31 SER H H 31 7.883 9.031 -1.148 1
1 244 . 10 1 1 A 31 31 SER HA H 31 4.458 5.165 -0.707 1
1 246 . 10 1 1 A 31 31 SER C C 31 174.129 174.091 0.038 1
1 247 . 10 1 1 A 31 31 SER CA C 31 58.477 57.621 0.856 1
1 248 . 10 1 1 A 31 31 SER CB C 31 64.042 65.445 -1.403 1
1 249 . 10 1 1 A 31 31 SER N N 31 115.366 118.119 -2.753 1
1 250 . 10 1 1 A 32 32 HIS H H 32 8.485 8.572 -0.087 1
1 251 . 10 1 1 A 32 32 HIS HA H 32 4.450 4.903 -0.453 1
1 255 . 10 1 1 A 32 32 HIS CA C 32 56.009 55.893 0.116 1
1 256 . 10 1 1 A 32 32 HIS CB C 32 31.122 30.434 0.688 1
1 257 . 10 1 1 A 32 32 HIS N N 32 121.500 121.626 -0.126 1
1 258 . 10 1 1 A 33 33 MET H H 33 8.392 7.555 0.837 1
1 259 . 10 1 1 A 33 33 MET HA H 33 4.601 4.752 -0.151 1
1 265 . 10 1 1 A 33 33 MET C C 33 175.842 174.016 1.826 1
1 266 . 10 1 1 A 33 33 MET CA C 33 54.533 53.993 0.540 1
1 267 . 10 1 1 A 33 33 MET CB C 33 32.868 35.656 -2.788 1
1 270 . 10 1 1 A 33 33 MET N N 33 120.204 119.980 0.224 1
1 271 . 10 1 1 A 34 34 VAL H H 34 8.938 9.100 -0.162 1
1 272 . 10 1 1 A 34 34 VAL HA H 34 4.430 4.698 -0.268 1
1 280 . 10 1 1 A 34 34 VAL C C 34 174.149 174.126 0.023 1
1 281 . 10 1 1 A 34 34 VAL CA C 34 60.703 59.550 1.153 1
1 282 . 10 1 1 A 34 34 VAL CB C 34 34.319 35.632 -1.313 1
1 285 . 10 1 1 A 34 34 VAL N N 34 118.512 122.739 -4.227 1
1 286 . 10 1 1 A 35 35 PHE H H 35 9.242 7.829 1.413 1
1 287 . 10 1 1 A 35 35 PHE HA H 35 4.439 5.692 -1.253 1
1 294 . 10 1 1 A 35 35 PHE C C 35 174.831 173.717 1.114 1
1 295 . 10 1 1 A 35 35 PHE CA C 35 57.754 54.946 2.808 1
1 296 . 10 1 1 A 35 35 PHE CB C 35 38.959 42.419 -3.460 1
1 297 . 10 1 1 A 35 35 PHE N N 35 124.912 123.306 1.606 1
1 298 . 10 1 1 A 36 36 ARG H H 36 8.475 8.734 -0.259 1
1 299 . 10 1 1 A 36 36 ARG HA H 36 4.135 4.910 -0.775 1
1 304 . 10 1 1 A 36 36 ARG C C 36 172.865 175.453 -2.588 1
1 305 . 10 1 1 A 36 36 ARG CA C 36 56.895 55.677 1.218 1
1 306 . 10 1 1 A 36 36 ARG CB C 36 28.962 30.507 -1.545 1
1 308 . 10 1 1 A 36 36 ARG N N 36 125.680 120.215 5.465 1
1 309 . 10 1 1 A 37 37 VAL H H 37 8.066 8.841 -0.775 1
1 310 . 10 1 1 A 37 37 VAL HA H 37 4.292 4.483 -0.191 1
1 318 . 10 1 1 A 37 37 VAL C C 37 174.595 174.776 -0.181 1
1 319 . 10 1 1 A 37 37 VAL CA C 37 62.727 61.641 1.086 1
1 320 . 10 1 1 A 37 37 VAL CB C 37 31.102 32.708 -1.606 1
1 323 . 10 1 1 A 37 37 VAL N N 37 125.403 121.399 4.004 1
1 324 . 10 1 1 A 38 38 GLU H H 38 9.532 9.033 0.499 1
1 325 . 10 1 1 A 38 38 GLU HA H 38 4.895 5.238 -0.343 1
1 329 . 10 1 1 A 38 38 GLU C C 38 174.509 175.236 -0.727 1
1 330 . 10 1 1 A 38 38 GLU CA C 38 55.650 54.850 0.800 1
1 331 . 10 1 1 A 38 38 GLU CB C 38 32.214 30.823 1.391 1
1 333 . 10 1 1 A 38 38 GLU N N 38 129.885 126.221 3.664 1
1 334 . 10 1 1 A 39 39 VAL H H 39 9.035 8.817 0.218 1
1 335 . 10 1 1 A 39 39 VAL HA H 39 4.446 4.555 -0.109 1
1 343 . 10 1 1 A 39 39 VAL C C 39 173.661 174.600 -0.939 1
1 344 . 10 1 1 A 39 39 VAL CA C 39 61.258 61.941 -0.683 1
1 345 . 10 1 1 A 39 39 VAL CB C 39 33.533 32.555 0.978 1
1 348 . 10 1 1 A 39 39 VAL N N 39 127.941 127.096 0.845 1
1 349 . 10 1 1 A 40 40 LEU H H 40 8.843 9.414 -0.571 1
1 350 . 10 1 1 A 40 40 LEU HA H 40 5.130 4.926 0.204 1
1 360 . 10 1 1 A 40 40 LEU C C 40 175.581 175.477 0.104 1
1 361 . 10 1 1 A 40 40 LEU CA C 40 53.702 53.933 -0.231 1
1 362 . 10 1 1 A 40 40 LEU CB C 40 43.989 43.575 0.414 1
1 366 . 10 1 1 A 40 40 LEU N N 40 128.413 130.234 -1.821 1
1 367 . 10 1 1 A 41 41 CYS H H 41 8.959 9.030 -0.071 1
1 368 . 10 1 1 A 41 41 CYS HA H 41 5.174 4.845 0.329 1
1 371 . 10 1 1 A 41 41 CYS C C 41 175.043 173.690 1.353 1
1 372 . 10 1 1 A 41 41 CYS CA C 41 57.483 57.753 -0.270 1
1 373 . 10 1 1 A 41 41 CYS CB C 41 28.472 29.343 -0.871 1
1 374 . 10 1 1 A 41 41 CYS N N 41 124.738 126.946 -2.208 1
1 375 . 10 1 1 A 42 42 SER H H 42 9.527 9.347 0.180 1
1 376 . 10 1 1 A 42 42 SER HA H 42 4.149 4.216 -0.067 1
1 379 . 10 1 1 A 42 42 SER C C 42 175.014 174.570 0.444 1
1 380 . 10 1 1 A 42 42 SER CA C 42 59.058 59.339 -0.281 1
1 381 . 10 1 1 A 42 42 SER CB C 42 62.287 61.555 0.732 1
1 382 . 10 1 1 A 42 42 SER N N 42 125.889 123.666 2.223 1
1 383 . 10 1 1 A 43 43 GLY H H 43 8.685 8.528 0.157 1
1 384 . 10 1 1 A 43 43 GLY HA2 H 43 3.594 3.937 -0.343 1
1 385 . 10 1 1 A 43 43 GLY HA3 H 43 4.210 3.949 0.261 1
1 386 . 10 1 1 A 43 43 GLY C C 43 173.664 173.614 0.050 1
1 387 . 10 1 1 A 43 43 GLY CA C 43 45.404 45.575 -0.171 1
1 388 . 10 1 1 A 43 43 GLY N N 43 104.633 105.041 -0.408 1
1 389 . 10 1 1 A 44 44 ARG H H 44 7.926 8.048 -0.122 1
1 390 . 10 1 1 A 44 44 ARG HA H 44 4.678 4.754 -0.076 1
1 395 . 10 1 1 A 44 44 ARG C C 44 175.261 175.259 0.002 1
1 396 . 10 1 1 A 44 44 ARG CA C 44 55.011 54.568 0.443 1
1 397 . 10 1 1 A 44 44 ARG CB C 44 32.138 32.547 -0.409 1
1 400 . 10 1 1 A 44 44 ARG N N 44 121.239 120.668 0.571 1
1 401 . 10 1 1 A 45 45 ARG H H 45 8.775 9.135 -0.360 1
1 402 . 10 1 1 A 45 45 ARG HA H 45 5.770 5.446 0.324 1
1 409 . 10 1 1 A 45 45 ARG C C 45 176.064 174.108 1.956 1
1 410 . 10 1 1 A 45 45 ARG CA C 45 54.683 54.177 0.506 1
1 411 . 10 1 1 A 45 45 ARG CB C 45 33.748 34.311 -0.563 1
1 414 . 10 1 1 A 45 45 ARG N N 45 125.948 119.372 6.576 1
1 415 . 10 1 1 A 46 46 HIS H H 46 8.912 8.756 0.156 1
1 416 . 10 1 1 A 46 46 HIS HA H 46 4.927 5.364 -0.437 1
1 420 . 10 1 1 A 46 46 HIS C C 46 172.634 173.614 -0.980 1
1 421 . 10 1 1 A 46 46 HIS CA C 46 56.480 54.341 2.139 1
1 422 . 10 1 1 A 46 46 HIS CB C 46 33.608 32.967 0.641 1
1 423 . 10 1 1 A 46 46 HIS N N 46 121.825 121.029 0.796 1
1 424 . 10 1 1 A 47 47 THR H H 47 8.532 8.569 -0.037 1
1 425 . 10 1 1 A 47 47 THR HA H 47 5.472 4.550 0.922 1
1 430 . 10 1 1 A 47 47 THR C C 47 174.442 174.366 0.076 1
1 431 . 10 1 1 A 47 47 THR CA C 47 61.093 62.612 -1.519 1
1 432 . 10 1 1 A 47 47 THR CB C 47 71.041 68.523 2.518 1
1 434 . 10 1 1 A 47 47 THR N N 47 115.450 123.107 -7.657 1
1 435 . 10 1 1 A 48 48 VAL H H 48 9.695 9.246 0.449 1
1 436 . 10 1 1 A 48 48 VAL HA H 48 4.677 4.650 0.027 1
1 444 . 10 1 1 A 48 48 VAL CA C 48 58.172 59.416 -1.244 1
1 445 . 10 1 1 A 48 48 VAL CB C 48 34.990 32.686 2.304 1
1 448 . 10 1 1 A 48 48 VAL N N 48 126.721 127.891 -1.170 1
1 449 . 10 1 1 A 49 49 PRO HA H 49 5.087 4.961 0.126 1
1 453 . 10 1 1 A 49 49 PRO CA C 49 61.671 62.517 -0.846 1
1 454 . 10 1 1 A 49 49 PRO CB C 49 31.923 31.753 0.170 1
1 457 . 10 1 1 A 50 50 ARG H H 50 9.125 9.114 0.011 1
1 458 . 10 1 1 A 50 50 ARG HA H 50 4.974 4.616 0.358 1
1 464 . 10 1 1 A 50 50 ARG C C 50 176.187 175.180 1.007 1
1 465 . 10 1 1 A 50 50 ARG CA C 50 53.015 54.910 -1.895 1
1 466 . 10 1 1 A 50 50 ARG CB C 50 36.553 33.794 2.759 1
1 468 . 10 1 1 A 50 50 ARG N N 50 124.189 123.699 0.490 1
1 469 . 10 1 1 A 51 51 ARG H H 51 10.105 8.750 1.355 1
1 470 . 10 1 1 A 51 51 ARG HA H 51 5.196 4.100 1.096 1
1 475 . 10 1 1 A 51 51 ARG C C 51 178.865 177.069 1.796 1
1 476 . 10 1 1 A 51 51 ARG CA C 51 55.961 55.739 0.222 1
1 477 . 10 1 1 A 51 51 ARG CB C 51 32.539 30.747 1.792 1
1 480 . 10 1 1 A 51 51 ARG N N 51 124.521 125.653 -1.132 1
1 481 . 10 1 1 A 52 52 TYR H H 52 10.397 8.855 1.542 1
1 482 . 10 1 1 A 52 52 TYR HA H 52 4.360 4.107 0.253 1
1 487 . 10 1 1 A 52 52 TYR C C 52 178.143 177.207 0.936 1
1 488 . 10 1 1 A 52 52 TYR CA C 52 63.538 62.304 1.234 1
1 489 . 10 1 1 A 52 52 TYR CB C 52 38.784 38.926 -0.142 1
1 490 . 10 1 1 A 52 52 TYR N N 52 124.772 123.839 0.933 1
1 491 . 10 1 1 A 53 53 SER H H 53 9.231 8.533 0.698 1
1 492 . 10 1 1 A 53 53 SER HA H 53 4.175 4.597 -0.422 1
1 493 . 10 1 1 A 53 53 SER C C 53 177.220 176.561 0.659 1
1 494 . 10 1 1 A 53 53 SER CA C 53 61.606 61.744 -0.138 1
1 495 . 10 1 1 A 53 53 SER N N 53 113.262 116.052 -2.790 1
1 496 . 10 1 1 A 54 54 GLU H H 54 7.807 7.729 0.078 1
1 497 . 10 1 1 A 54 54 GLU HA H 54 4.392 3.936 0.456 1
1 501 . 10 1 1 A 54 54 GLU C C 54 180.361 179.176 1.185 1
1 502 . 10 1 1 A 54 54 GLU CA C 54 59.497 59.147 0.350 1
1 503 . 10 1 1 A 54 54 GLU CB C 54 30.708 29.194 1.514 1
1 504 . 10 1 1 A 54 54 GLU N N 54 121.949 122.438 -0.489 1
1 505 . 10 1 1 A 55 55 PHE H H 55 8.133 8.058 0.075 1
1 506 . 10 1 1 A 55 55 PHE HA H 55 4.007 4.178 -0.171 1
1 513 . 10 1 1 A 55 55 PHE C C 55 176.531 177.510 -0.979 1
1 514 . 10 1 1 A 55 55 PHE CA C 55 61.848 61.312 0.536 1
1 515 . 10 1 1 A 55 55 PHE CB C 55 38.847 38.975 -0.128 1
1 516 . 10 1 1 A 55 55 PHE N N 55 119.998 121.576 -1.578 1
1 517 . 10 1 1 A 56 56 HIS H H 56 7.907 7.453 0.454 1
1 518 . 10 1 1 A 56 56 HIS HA H 56 3.324 3.537 -0.213 1
1 522 . 10 1 1 A 56 56 HIS C C 56 176.748 177.494 -0.746 1
1 523 . 10 1 1 A 56 56 HIS CA C 56 58.770 59.080 -0.310 1
1 524 . 10 1 1 A 56 56 HIS CB C 56 30.404 29.147 1.257 1
1 525 . 10 1 1 A 56 56 HIS N N 56 119.173 117.546 1.627 1
1 526 . 10 1 1 A 57 57 ALA H H 57 7.962 8.027 -0.065 1
1 527 . 10 1 1 A 57 57 ALA HA H 57 3.865 3.917 -0.052 1
1 531 . 10 1 1 A 57 57 ALA C C 57 180.075 179.883 0.192 1
1 532 . 10 1 1 A 57 57 ALA CA C 57 54.996 55.100 -0.104 1
1 533 . 10 1 1 A 57 57 ALA CB C 57 18.226 17.875 0.351 1
1 534 . 10 1 1 A 57 57 ALA N N 57 120.094 122.007 -1.913 1
1 535 . 10 1 1 A 58 58 LEU H H 58 7.295 8.330 -1.035 1
1 536 . 10 1 1 A 58 58 LEU HA H 58 3.994 4.016 -0.022 1
1 546 . 10 1 1 A 58 58 LEU C C 58 177.428 178.497 -1.069 1
1 547 . 10 1 1 A 58 58 LEU CA C 58 58.342 57.965 0.377 1
1 548 . 10 1 1 A 58 58 LEU CB C 58 40.851 41.625 -0.774 1
1 552 . 10 1 1 A 58 58 LEU N N 58 119.404 120.481 -1.077 1
1 553 . 10 1 1 A 59 59 HIS H H 59 7.805 8.429 -0.624 1
1 554 . 10 1 1 A 59 59 HIS HA H 59 4.286 3.745 0.541 1
1 558 . 10 1 1 A 59 59 HIS C C 59 177.001 177.273 -0.272 1
1 559 . 10 1 1 A 59 59 HIS CA C 59 60.141 60.188 -0.047 1
1 560 . 10 1 1 A 59 59 HIS CB C 59 31.072 29.670 1.402 1
1 561 . 10 1 1 A 59 59 HIS N N 59 119.040 117.556 1.484 1
1 562 . 10 1 1 A 60 60 LYS H H 60 7.715 7.840 -0.125 1
1 563 . 10 1 1 A 60 60 LYS HA H 60 3.456 4.062 -0.606 1
1 570 . 10 1 1 A 60 60 LYS C C 60 178.464 179.349 -0.885 1
1 571 . 10 1 1 A 60 60 LYS CA C 60 59.629 59.268 0.361 1
1 572 . 10 1 1 A 60 60 LYS CB C 60 32.354 32.249 0.105 1
1 576 . 10 1 1 A 60 60 LYS N N 60 114.225 118.781 -4.556 1
1 577 . 10 1 1 A 61 61 ARG H H 61 7.486 8.216 -0.730 1
1 578 . 10 1 1 A 61 61 ARG HA H 61 4.202 3.984 0.218 1
1 584 . 10 1 1 A 61 61 ARG C C 61 178.995 178.973 0.022 1
1 585 . 10 1 1 A 61 61 ARG CA C 61 58.387 59.386 -0.999 1
1 586 . 10 1 1 A 61 61 ARG CB C 61 31.216 29.987 1.229 1
1 589 . 10 1 1 A 61 61 ARG N N 61 115.929 119.499 -3.570 1
1 590 . 10 1 1 A 62 62 ILE H H 62 8.066 7.709 0.357 1
1 591 . 10 1 1 A 62 62 ILE HA H 62 4.491 3.882 0.609 1
1 601 . 10 1 1 A 62 62 ILE C C 62 177.838 177.260 0.578 1
1 602 . 10 1 1 A 62 62 ILE CA C 62 63.399 64.004 -0.605 1
1 603 . 10 1 1 A 62 62 ILE CB C 62 39.699 37.282 2.417 1
1 606 . 10 1 1 A 62 62 ILE N N 62 111.456 116.057 -4.601 1
1 607 . 10 1 1 A 63 63 LYS H H 63 8.158 8.137 0.021 1
1 608 . 10 1 1 A 63 63 LYS HA H 63 4.136 3.808 0.328 1
1 615 . 10 1 1 A 63 63 LYS C C 63 176.358 177.759 -1.401 1
1 616 . 10 1 1 A 63 63 LYS CA C 63 58.753 58.611 0.142 1
1 617 . 10 1 1 A 63 63 LYS CB C 63 30.825 31.252 -0.427 1
1 621 . 10 1 1 A 63 63 LYS N N 63 120.800 123.017 -2.217 1
1 622 . 10 1 1 A 64 64 LYS H H 64 7.687 7.226 0.461 1
1 623 . 10 1 1 A 64 64 LYS HA H 64 4.301 4.081 0.220 1
1 628 . 10 1 1 A 64 64 LYS C C 64 177.084 177.932 -0.848 1
1 629 . 10 1 1 A 64 64 LYS CA C 64 57.237 58.471 -1.234 1
1 630 . 10 1 1 A 64 64 LYS CB C 64 32.502 32.260 0.242 1
1 634 . 10 1 1 A 64 64 LYS N N 64 116.548 118.708 -2.160 1
1 635 . 10 1 1 A 65 65 LEU H H 65 7.476 7.702 -0.226 1
1 636 . 10 1 1 A 65 65 LEU HA H 65 4.219 4.305 -0.086 1
1 645 . 10 1 1 A 65 65 LEU C C 65 175.886 176.736 -0.850 1
1 646 . 10 1 1 A 65 65 LEU CA C 65 55.542 56.633 -1.091 1
1 647 . 10 1 1 A 65 65 LEU CB C 65 45.493 43.141 2.352 1
1 650 . 10 1 1 A 65 65 LEU N N 65 118.000 117.622 0.378 1
1 651 . 10 1 1 A 66 66 TYR H H 66 7.672 8.252 -0.580 1
1 652 . 10 1 1 A 66 66 TYR HA H 66 4.762 5.241 -0.479 1
1 660 . 10 1 1 A 66 66 TYR C C 66 174.199 174.786 -0.587 1
1 661 . 10 1 1 A 66 66 TYR CA C 66 56.013 55.120 0.893 1
1 662 . 10 1 1 A 66 66 TYR CB C 66 40.380 41.112 -0.732 1
1 663 . 10 1 1 A 66 66 TYR N N 66 116.805 114.901 1.904 1
1 664 . 10 1 1 A 67 67 LYS H H 67 8.547 8.557 -0.010 1
1 665 . 10 1 1 A 67 67 LYS HA H 67 4.436 4.439 -0.003 1
1 670 . 10 1 1 A 67 67 LYS C C 67 175.727 176.296 -0.569 1
1 671 . 10 1 1 A 67 67 LYS CA C 67 56.598 56.508 0.090 1
1 672 . 10 1 1 A 67 67 LYS CB C 67 32.743 32.626 0.117 1
1 676 . 10 1 1 A 67 67 LYS N N 67 120.929 120.159 0.770 1
1 677 . 10 1 1 A 68 68 VAL H H 68 8.168 8.228 -0.060 1
1 678 . 10 1 1 A 68 68 VAL HA H 68 4.869 4.453 0.416 1
1 686 . 10 1 1 A 68 68 VAL CA C 68 57.389 58.835 -1.446 1
1 687 . 10 1 1 A 68 68 VAL CB C 68 34.017 35.090 -1.073 1
1 690 . 10 1 1 A 68 68 VAL N N 68 116.467 123.638 -7.171 1
1 691 . 10 1 1 A 69 69 PRO HA H 69 4.674 4.691 -0.017 1
1 696 . 10 1 1 A 69 69 PRO C C 69 178.013 175.370 2.643 1
1 697 . 10 1 1 A 69 69 PRO CA C 69 61.443 62.352 -0.909 1
1 698 . 10 1 1 A 69 69 PRO CB C 69 32.231 33.410 -1.179 1
1 701 . 10 1 1 A 70 70 ASP H H 70 8.167 8.548 -0.381 1
1 702 . 10 1 1 A 70 70 ASP HA H 70 4.531 5.364 -0.833 1
1 705 . 10 1 1 A 70 70 ASP C C 70 175.660 175.547 0.113 1
1 706 . 10 1 1 A 70 70 ASP CA C 70 55.148 52.561 2.587 1
1 707 . 10 1 1 A 70 70 ASP CB C 70 40.876 44.125 -3.249 1
1 708 . 10 1 1 A 70 70 ASP N N 70 116.671 120.349 -3.678 1
1 709 . 10 1 1 A 71 71 PHE H H 71 8.387 7.818 0.569 1
1 710 . 10 1 1 A 71 71 PHE HA H 71 4.076 4.528 -0.452 1
1 717 . 10 1 1 A 71 71 PHE CA C 71 55.672 54.217 1.455 1
1 718 . 10 1 1 A 71 71 PHE CB C 71 39.155 40.789 -1.634 1
1 719 . 10 1 1 A 71 71 PHE N N 71 126.533 117.445 9.088 1
1 720 . 10 1 1 A 72 72 PRO HA H 72 4.156 4.552 -0.396 1
1 727 . 10 1 1 A 72 72 PRO CA C 72 63.079 62.701 0.378 1
1 728 . 10 1 1 A 72 72 PRO CB C 72 32.107 32.164 -0.057 1
1 731 . 10 1 1 A 73 73 SER H H 73 8.468 8.596 -0.128 1
1 733 . 10 1 1 A 73 73 SER CA C 73 56.133 58.564 -2.431 1
1 734 . 10 1 1 A 73 73 SER CB C 73 63.991 63.985 0.006 1
1 735 . 10 1 1 A 73 73 SER N N 73 121.533 118.042 3.491 1
1 736 . 10 1 1 A 74 74 LYS HA H 74 4.574 4.595 -0.021 1
1 739 . 10 1 1 A 74 74 LYS CA C 74 55.659 58.293 -2.634 1
1 740 . 10 1 1 A 74 74 LYS CB C 74 30.550 32.859 -2.309 1
1 741 . 10 1 1 A 75 75 ARG H H 75 7.962 7.767 0.195 1
1 742 . 10 1 1 A 75 75 ARG HA H 75 4.162 4.875 -0.713 1
1 746 . 10 1 1 A 75 75 ARG CA C 75 56.123 54.885 1.238 1
1 747 . 10 1 1 A 75 75 ARG CB C 75 31.179 31.894 -0.715 1
1 749 . 10 1 1 A 75 75 ARG N N 75 121.665 119.880 1.785 1
1 750 . 10 1 1 A 76 76 LEU H H 76 8.071 8.540 -0.469 1
1 751 . 10 1 1 A 76 76 LEU HA H 76 4.618 4.773 -0.155 1
1 759 . 10 1 1 A 76 76 LEU CA C 76 52.764 52.247 0.517 1
1 760 . 10 1 1 A 76 76 LEU CB C 76 41.918 43.757 -1.839 1
1 762 . 10 1 1 A 76 76 LEU N N 76 124.196 125.385 -1.189 1
1 763 . 10 1 1 A 77 77 PRO HA H 77 4.393 4.321 0.072 1
1 767 . 10 1 1 A 77 77 PRO CA C 77 63.746 62.550 1.196 1
1 770 . 10 1 1 A 78 78 ASN H H 78 8.379 7.986 0.393 1
1 771 . 10 1 1 A 78 78 ASN HA H 78 4.586 4.136 0.450 1
1 776 . 10 1 1 A 78 78 ASN C C 78 175.648 174.926 0.722 1
1 777 . 10 1 1 A 78 78 ASN CA C 78 53.591 52.591 1.000 1
1 778 . 10 1 1 A 78 78 ASN CB C 78 37.826 38.480 -0.654 1
1 779 . 10 1 1 A 78 78 ASN N N 78 115.292 119.538 -4.246 1
1 781 . 10 1 1 A 79 79 TRP H H 79 7.900 7.866 0.034 1
1 782 . 10 1 1 A 79 79 TRP HA H 79 4.326 4.430 -0.104 1
1 788 . 10 1 1 A 79 79 TRP CA C 79 58.825 60.637 -1.812 1
1 789 . 10 1 1 A 79 79 TRP CB C 79 29.090 27.171 1.919 1
1 790 . 10 1 1 A 79 79 TRP N N 79 119.525 116.487 3.038 1
1 792 . 10 1 1 A 80 80 ARG H H 80 8.060 8.193 -0.133 1
1 793 . 10 1 1 A 80 80 ARG HA H 80 3.913 4.157 -0.244 1
1 798 . 10 1 1 A 80 80 ARG C C 80 177.024 178.539 -1.515 1
1 799 . 10 1 1 A 80 80 ARG CA C 80 58.292 59.283 -0.991 1
1 800 . 10 1 1 A 80 80 ARG CB C 80 30.146 29.903 0.243 1
1 803 . 10 1 1 A 80 80 ARG N N 80 118.864 119.464 -0.600 1
1 804 . 10 1 1 A 81 81 THR H H 81 7.725 7.624 0.101 1
1 805 . 10 1 1 A 81 81 THR HA H 81 4.297 4.231 0.066 1
1 809 . 10 1 1 A 81 81 THR CA C 81 62.481 64.909 -2.428 1
1 811 . 10 1 1 A 81 81 THR N N 81 109.863 111.328 -1.465 1
1 812 . 10 1 1 A 82 82 ARG HA H 82 4.341 4.749 -0.408 1
1 816 . 10 1 1 A 82 82 ARG C C 82 177.261 176.264 0.997 1
1 817 . 10 1 1 A 82 82 ARG CA C 82 56.846 54.164 2.682 1
1 818 . 10 1 1 A 82 82 ARG CB C 82 30.288 33.885 -3.597 1
1 820 . 10 1 1 A 83 83 GLY H H 83 8.321 8.668 -0.347 1
1 821 . 10 1 1 A 83 83 GLY HA2 H 83 3.957 4.153 -0.196 1
1 822 . 10 1 1 A 83 83 GLY C C 83 175.185 175.830 -0.645 1
1 823 . 10 1 1 A 83 83 GLY CA C 83 46.297 45.673 0.624 1
1 824 . 10 1 1 A 83 83 GLY N N 83 109.146 110.896 -1.750 1
1 825 . 10 1 1 A 84 84 LEU H H 84 8.303 8.766 -0.463 1
1 826 . 10 1 1 A 84 84 LEU HA H 84 4.018 4.070 -0.052 1
1 835 . 10 1 1 A 84 84 LEU C C 84 178.552 177.948 0.604 1
1 836 . 10 1 1 A 84 84 LEU CA C 84 58.236 56.687 1.549 1
1 837 . 10 1 1 A 84 84 LEU CB C 84 41.837 41.718 0.119 1
1 840 . 10 1 1 A 84 84 LEU N N 84 122.662 121.813 0.849 1
1 841 . 10 1 1 A 85 85 GLU H H 85 8.233 8.429 -0.196 1
1 842 . 10 1 1 A 85 85 GLU HA H 85 4.371 3.940 0.431 1
1 846 . 10 1 1 A 85 85 GLU C C 85 178.555 178.604 -0.049 1
1 847 . 10 1 1 A 85 85 GLU CA C 85 58.377 59.547 -1.170 1
1 848 . 10 1 1 A 85 85 GLU CB C 85 28.675 29.458 -0.783 1
1 850 . 10 1 1 A 85 85 GLU N N 85 119.781 119.036 0.745 1
1 851 . 10 1 1 A 86 86 GLN H H 86 7.877 7.973 -0.096 1
1 852 . 10 1 1 A 86 86 GLN HA H 86 4.100 4.151 -0.051 1
1 858 . 10 1 1 A 86 86 GLN C C 86 179.557 178.407 1.150 1
1 859 . 10 1 1 A 86 86 GLN CA C 86 58.955 58.892 0.063 1
1 860 . 10 1 1 A 86 86 GLN CB C 86 28.191 28.449 -0.258 1
1 862 . 10 1 1 A 86 86 GLN N N 86 118.042 118.819 -0.777 1
1 863 . 10 1 1 A 87 87 ARG H H 87 8.169 8.213 -0.044 1
1 864 . 10 1 1 A 87 87 ARG HA H 87 3.975 4.176 -0.201 1
1 868 . 10 1 1 A 87 87 ARG C C 87 177.051 178.586 -1.535 1
1 869 . 10 1 1 A 87 87 ARG CA C 87 59.006 59.634 -0.628 1
1 870 . 10 1 1 A 87 87 ARG CB C 87 30.383 29.600 0.783 1
1 872 . 10 1 1 A 87 87 ARG N N 87 121.381 120.443 0.938 1
1 873 . 10 1 1 A 88 88 ARG H H 88 8.593 7.945 0.648 1
1 874 . 10 1 1 A 88 88 ARG HA H 88 3.726 3.760 -0.034 1
1 876 . 10 1 1 A 88 88 ARG C C 88 177.520 178.073 -0.553 1
1 877 . 10 1 1 A 88 88 ARG CA C 88 60.751 58.878 1.873 1
1 878 . 10 1 1 A 88 88 ARG CB C 88 30.153 29.988 0.165 1
1 879 . 10 1 1 A 88 88 ARG N N 88 120.863 117.875 2.988 1
1 880 . 10 1 1 A 89 89 GLN H H 89 8.355 8.021 0.334 1
1 881 . 10 1 1 A 89 89 GLN HA H 89 3.887 3.971 -0.084 1
1 887 . 10 1 1 A 89 89 GLN C C 89 179.499 179.485 0.014 1
1 888 . 10 1 1 A 89 89 GLN CA C 89 59.603 58.412 1.191 1
1 889 . 10 1 1 A 89 89 GLN CB C 89 28.464 28.629 -0.165 1
1 891 . 10 1 1 A 89 89 GLN N N 89 116.860 119.161 -2.301 1
1 893 . 10 1 1 A 90 90 GLY H H 90 8.406 7.948 0.458 1
1 894 . 10 1 1 A 90 90 GLY HA2 H 90 3.672 3.369 0.303 1
1 895 . 10 1 1 A 90 90 GLY HA3 H 90 3.871 3.413 0.458 1
1 896 . 10 1 1 A 90 90 GLY C C 90 177.033 175.406 1.627 1
1 897 . 10 1 1 A 90 90 GLY CA C 90 46.813 47.126 -0.313 1
1 898 . 10 1 1 A 90 90 GLY N N 90 107.679 109.791 -2.112 1
1 899 . 10 1 1 A 91 91 LEU H H 91 8.504 8.146 0.358 1
1 900 . 10 1 1 A 91 91 LEU HA H 91 3.784 3.838 -0.054 1
1 910 . 10 1 1 A 91 91 LEU C C 91 178.003 179.096 -1.093 1
1 911 . 10 1 1 A 91 91 LEU CA C 91 57.354 57.660 -0.306 1
1 912 . 10 1 1 A 91 91 LEU CB C 91 40.359 41.078 -0.719 1
1 916 . 10 1 1 A 91 91 LEU N N 91 123.959 121.542 2.417 1
1 917 . 10 1 1 A 92 92 GLU H H 92 8.324 8.928 -0.604 1
1 918 . 10 1 1 A 92 92 GLU HA H 92 3.732 3.802 -0.070 1
1 922 . 10 1 1 A 92 92 GLU C C 92 177.272 178.393 -1.121 1
1 923 . 10 1 1 A 92 92 GLU CA C 92 60.651 59.719 0.932 1
1 924 . 10 1 1 A 92 92 GLU CB C 92 30.843 29.301 1.542 1
1 926 . 10 1 1 A 92 92 GLU N N 92 121.991 120.224 1.767 1
1 927 . 10 1 1 A 93 93 ALA H H 93 8.126 7.567 0.559 1
1 928 . 10 1 1 A 93 93 ALA HA H 93 4.160 4.054 0.106 1
1 932 . 10 1 1 A 93 93 ALA C C 93 180.818 179.546 1.272 1
1 933 . 10 1 1 A 93 93 ALA CA C 93 54.828 55.068 -0.240 1
1 934 . 10 1 1 A 93 93 ALA CB C 93 18.032 17.938 0.094 1
1 935 . 10 1 1 A 93 93 ALA N N 93 120.066 121.570 -1.504 1
1 936 . 10 1 1 A 94 94 TYR H H 94 7.916 7.672 0.244 1
1 937 . 10 1 1 A 94 94 TYR HA H 94 4.139 4.355 -0.216 1
1 942 . 10 1 1 A 94 94 TYR C C 94 175.895 178.639 -2.744 1
1 943 . 10 1 1 A 94 94 TYR CA C 94 61.915 61.329 0.586 1
1 944 . 10 1 1 A 94 94 TYR CB C 94 38.740 38.078 0.662 1
1 945 . 10 1 1 A 94 94 TYR N N 94 121.179 115.888 5.291 1
1 946 . 10 1 1 A 95 95 ILE H H 95 7.983 8.465 -0.482 1
1 947 . 10 1 1 A 95 95 ILE HA H 95 3.614 3.878 -0.264 1
1 957 . 10 1 1 A 95 95 ILE C C 95 174.678 178.131 -3.453 1
1 958 . 10 1 1 A 95 95 ILE CA C 95 63.461 64.623 -1.162 1
1 959 . 10 1 1 A 95 95 ILE CB C 95 36.625 36.513 0.112 1
1 963 . 10 1 1 A 95 95 ILE N N 95 116.397 120.365 -3.968 1
1 964 . 10 1 1 A 96 96 GLN H H 96 8.175 8.467 -0.292 1
1 965 . 10 1 1 A 96 96 GLN HA H 96 3.763 4.033 -0.270 1
1 970 . 10 1 1 A 96 96 GLN C C 96 179.042 178.624 0.418 1
1 971 . 10 1 1 A 96 96 GLN CA C 96 59.270 60.015 -0.745 1
1 972 . 10 1 1 A 96 96 GLN CB C 96 27.696 27.901 -0.205 1
1 974 . 10 1 1 A 96 96 GLN N N 96 116.631 120.688 -4.057 1
1 976 . 10 1 1 A 97 97 GLY H H 97 8.222 8.452 -0.230 1
1 977 . 10 1 1 A 97 97 GLY HA2 H 97 3.661 3.785 -0.124 1
1 978 . 10 1 1 A 97 97 GLY HA3 H 97 3.806 3.798 0.008 1
1 979 . 10 1 1 A 97 97 GLY C C 97 175.449 176.158 -0.709 1
1 980 . 10 1 1 A 97 97 GLY CA C 97 46.917 47.420 -0.503 1
1 981 . 10 1 1 A 97 97 GLY N N 97 107.315 107.110 0.205 1
1 982 . 10 1 1 A 98 98 ILE H H 98 7.630 8.395 -0.765 1
1 983 . 10 1 1 A 98 98 ILE HA H 98 3.399 4.022 -0.623 1
1 993 . 10 1 1 A 98 98 ILE C C 98 178.683 177.871 0.812 1
1 994 . 10 1 1 A 98 98 ILE CA C 98 66.402 64.891 1.511 1
1 995 . 10 1 1 A 98 98 ILE CB C 98 38.037 37.640 0.397 1
1 999 . 10 1 1 A 98 98 ILE N N 98 120.644 120.703 -0.059 1
1 1000 . 10 1 1 A 99 99 LEU H H 99 7.076 7.919 -0.843 1
1 1001 . 10 1 1 A 99 99 LEU HA H 99 4.133 4.023 0.110 1
1 1010 . 10 1 1 A 99 99 LEU C C 99 178.128 177.882 0.246 1
1 1011 . 10 1 1 A 99 99 LEU CA C 99 57.129 57.961 -0.832 1
1 1012 . 10 1 1 A 99 99 LEU CB C 99 41.108 41.687 -0.579 1
1 1014 . 10 1 1 A 99 99 LEU N N 99 116.844 123.934 -7.090 1
1 1015 . 10 1 1 A 100 100 TYR H H 100 7.890 8.765 -0.875 1
1 1016 . 10 1 1 A 100 100 TYR HA H 100 4.550 4.165 0.385 1
1 1021 . 10 1 1 A 100 100 TYR C C 100 178.210 177.500 0.710 1
1 1022 . 10 1 1 A 100 100 TYR CA C 100 59.452 60.677 -1.225 1
1 1023 . 10 1 1 A 100 100 TYR CB C 100 38.786 38.974 -0.188 1
1 1024 . 10 1 1 A 100 100 TYR N N 100 116.427 119.988 -3.561 1
1 1025 . 10 1 1 A 101 101 LEU H H 101 8.041 8.201 -0.160 1
1 1026 . 10 1 1 A 101 101 LEU HA H 101 4.158 3.915 0.243 1
1 1036 . 10 1 1 A 101 101 LEU C C 101 176.808 177.508 -0.700 1
1 1037 . 10 1 1 A 101 101 LEU CA C 101 56.156 58.197 -2.041 1
1 1038 . 10 1 1 A 101 101 LEU CB C 101 44.307 42.074 2.233 1
1 1041 . 10 1 1 A 101 101 LEU N N 101 116.493 120.103 -3.610 1
1 1042 . 10 1 1 A 102 102 ASN H H 102 7.146 7.887 -0.741 1
1 1043 . 10 1 1 A 102 102 ASN HA H 102 5.056 5.047 0.009 1
1 1046 . 10 1 1 A 102 102 ASN CA C 102 52.704 54.868 -2.164 1
1 1047 . 10 1 1 A 102 102 ASN CB C 102 42.424 40.087 2.337 1
1 1048 . 10 1 1 A 102 102 ASN N N 102 114.922 114.233 0.689 1
1 1049 . 10 1 1 A 103 103 GLN H H 103 8.477 7.618 0.859 1
1 1050 . 10 1 1 A 103 103 GLN HA H 103 3.866 4.252 -0.386 1
1 1054 . 10 1 1 A 103 103 GLN C C 103 176.110 175.365 0.745 1
1 1055 . 10 1 1 A 103 103 GLN CA C 103 58.451 55.498 2.953 1
1 1056 . 10 1 1 A 103 103 GLN CB C 103 28.896 28.339 0.557 1
1 1058 . 10 1 1 A 103 103 GLN N N 103 120.252 119.311 0.941 1
1 1059 . 10 1 1 A 104 104 GLU H H 104 7.930 8.137 -0.207 1
1 1060 . 10 1 1 A 104 104 GLU HA H 104 4.591 4.558 0.033 1
1 1064 . 10 1 1 A 104 104 GLU C C 104 175.397 175.648 -0.251 1
1 1065 . 10 1 1 A 104 104 GLU CA C 104 54.058 58.484 -4.426 1
1 1066 . 10 1 1 A 104 104 GLU CB C 104 31.272 29.139 2.133 1
1 1068 . 10 1 1 A 104 104 GLU N N 104 117.295 119.619 -2.324 1
1 1069 . 10 1 1 A 105 105 VAL H H 105 8.546 8.132 0.414 1
1 1070 . 10 1 1 A 105 105 VAL HA H 105 3.823 4.364 -0.541 1
1 1078 . 10 1 1 A 105 105 VAL CA C 105 60.706 59.813 0.893 1
1 1079 . 10 1 1 A 105 105 VAL CB C 105 32.126 32.475 -0.349 1
1 1082 . 10 1 1 A 105 105 VAL N N 105 124.511 125.547 -1.036 1
1 1083 . 10 1 1 A 106 106 PRO HA H 106 3.997 4.493 -0.496 1
1 1089 . 10 1 1 A 106 106 PRO C C 106 178.240 177.842 0.398 1
1 1090 . 10 1 1 A 106 106 PRO CA C 106 62.961 63.245 -0.284 1
1 1091 . 10 1 1 A 106 106 PRO CB C 106 32.321 31.961 0.360 1
1 1094 . 10 1 1 A 107 107 LYS H H 107 9.122 8.947 0.175 1
1 1095 . 10 1 1 A 107 107 LYS HA H 107 3.813 3.967 -0.154 1
1 1101 . 10 1 1 A 107 107 LYS C C 107 178.563 177.730 0.833 1
1 1102 . 10 1 1 A 107 107 LYS CA C 107 60.085 59.501 0.584 1
1 1103 . 10 1 1 A 107 107 LYS CB C 107 31.632 32.430 -0.798 1
1 1106 . 10 1 1 A 107 107 LYS N N 107 129.017 125.124 3.893 1
1 1107 . 10 1 1 A 108 108 GLU H H 108 10.370 8.013 2.357 1
1 1108 . 10 1 1 A 108 108 GLU HA H 108 3.991 4.228 -0.237 1
1 1111 . 10 1 1 A 108 108 GLU C C 108 180.366 179.000 1.366 1
1 1112 . 10 1 1 A 108 108 GLU CA C 108 60.337 58.992 1.345 1
1 1113 . 10 1 1 A 108 108 GLU CB C 108 29.178 29.640 -0.462 1
1 1115 . 10 1 1 A 108 108 GLU N N 108 118.335 118.848 -0.513 1
1 1116 . 10 1 1 A 109 109 LEU H H 109 7.393 8.015 -0.622 1
1 1117 . 10 1 1 A 109 109 LEU HA H 109 4.220 4.199 0.021 1
1 1126 . 10 1 1 A 109 109 LEU C C 109 177.378 178.946 -1.568 1
1 1127 . 10 1 1 A 109 109 LEU CA C 109 56.618 57.438 -0.820 1
1 1128 . 10 1 1 A 109 109 LEU CB C 109 41.898 41.116 0.782 1
1 1131 . 10 1 1 A 109 109 LEU N N 109 118.285 120.508 -2.223 1
1 1132 . 10 1 1 A 110 110 LEU H H 110 7.641 7.695 -0.054 1
1 1133 . 10 1 1 A 110 110 LEU HA H 110 3.796 3.996 -0.200 1
1 1142 . 10 1 1 A 110 110 LEU C C 110 179.103 178.534 0.569 1
1 1143 . 10 1 1 A 110 110 LEU CA C 110 59.046 58.409 0.637 1
1 1144 . 10 1 1 A 110 110 LEU CB C 110 40.228 41.248 -1.020 1
1 1147 . 10 1 1 A 110 110 LEU N N 110 120.162 120.100 0.062 1
1 1148 . 10 1 1 A 111 111 GLU H H 111 7.916 8.155 -0.239 1
1 1149 . 10 1 1 A 111 111 GLU HA H 111 4.080 4.097 -0.017 1
1 1153 . 10 1 1 A 111 111 GLU C C 111 179.967 178.628 1.339 1
1 1154 . 10 1 1 A 111 111 GLU CA C 111 59.243 59.205 0.038 1
1 1155 . 10 1 1 A 111 111 GLU CB C 111 29.576 29.255 0.321 1
1 1157 . 10 1 1 A 111 111 GLU N N 111 117.360 118.372 -1.012 1
1 1158 . 10 1 1 A 112 112 PHE H H 112 7.712 7.949 -0.237 1
1 1159 . 10 1 1 A 112 112 PHE HA H 112 4.224 4.164 0.060 1
1 1164 . 10 1 1 A 112 112 PHE C C 112 177.180 177.020 0.160 1
1 1165 . 10 1 1 A 112 112 PHE CA C 112 61.407 61.309 0.098 1
1 1166 . 10 1 1 A 112 112 PHE CB C 112 40.172 39.659 0.513 1
1 1167 . 10 1 1 A 112 112 PHE N N 112 123.042 122.109 0.933 1
1 1168 . 10 1 1 A 113 113 LEU H H 113 8.056 7.900 0.156 1
1 1169 . 10 1 1 A 113 113 LEU HA H 113 4.147 4.434 -0.287 1
1 1175 . 10 1 1 A 113 113 LEU C C 113 173.717 176.096 -2.379 1
1 1176 . 10 1 1 A 113 113 LEU CA C 113 54.093 54.539 -0.446 1
1 1177 . 10 1 1 A 113 113 LEU CB C 113 41.517 42.062 -0.545 1
1 1179 . 10 1 1 A 113 113 LEU N N 113 115.595 117.237 -1.642 1
1 1180 . 10 1 1 A 114 114 ARG H H 114 7.902 8.036 -0.134 1
1 1181 . 10 1 1 A 114 114 ARG HA H 114 3.817 4.098 -0.281 1
1 1182 . 10 1 1 A 114 114 ARG C C 114 174.566 176.192 -1.626 1
1 1183 . 10 1 1 A 114 114 ARG CA C 114 57.233 57.208 0.025 1
1 1184 . 10 1 1 A 114 114 ARG CB C 114 27.788 26.691 1.097 1
1 1185 . 10 1 1 A 114 114 ARG N N 114 116.021 115.472 0.549 1
1 1186 . 10 1 1 A 115 115 LEU H H 115 8.160 7.795 0.365 1
1 1187 . 10 1 1 A 115 115 LEU HA H 115 4.462 4.400 0.062 1
1 1195 . 10 1 1 A 115 115 LEU C C 115 176.374 177.067 -0.693 1
1 1196 . 10 1 1 A 115 115 LEU CA C 115 53.965 56.768 -2.803 1
1 1197 . 10 1 1 A 115 115 LEU CB C 115 44.077 41.891 2.186 1
1 1199 . 10 1 1 A 115 115 LEU N N 115 118.089 119.145 -1.056 1
1 1200 . 10 1 1 A 116 116 ARG H H 116 8.066 7.554 0.512 1
1 1201 . 10 1 1 A 116 116 ARG HA H 116 4.172 4.360 -0.188 1
1 1203 . 10 1 1 A 116 116 ARG CA C 116 55.961 56.674 -0.713 1
1 1204 . 10 1 1 A 116 116 ARG CB C 116 31.379 30.261 1.118 1
1 1205 . 10 1 1 A 116 116 ARG N N 116 120.852 119.007 1.845 1
1 1206 . 10 1 1 A 117 117 HIS H H 117 7.928 8.764 -0.836 1
1 1207 . 10 1 1 A 117 117 HIS HA H 117 4.557 4.330 0.227 1
1 1211 . 10 1 1 A 117 117 HIS CA C 117 55.937 57.017 -1.080 1
1 1212 . 10 1 1 A 117 117 HIS CB C 117 30.875 28.976 1.899 1
1 1213 . 10 1 1 A 118 118 PHE H H 118 8.183 7.940 0.243 1
1 1214 . 10 1 1 A 118 118 PHE HA H 118 4.730 4.824 -0.094 1
1 1219 . 10 1 1 A 118 118 PHE CA C 118 55.716 55.941 -0.225 1
1 1220 . 10 1 1 A 118 118 PHE CB C 118 39.263 40.577 -1.314 1
1 1221 . 10 1 1 A 118 118 PHE N N 118 123.480 120.813 2.667 1
1 1222 . 10 1 1 A 119 119 PRO HA H 119 4.398 4.539 -0.141 1
1 1227 . 10 1 1 A 119 119 PRO C C 119 176.666 176.845 -0.179 1
1 1228 . 10 1 1 A 119 119 PRO CA C 119 63.377 65.142 -1.765 1
1 1229 . 10 1 1 A 119 119 PRO CB C 119 32.059 32.018 0.041 1
1 1232 . 10 1 1 A 120 120 THR H H 120 8.054 7.424 0.630 1
1 1233 . 10 1 1 A 120 120 THR HA H 120 4.273 3.977 0.296 1
1 1238 . 10 1 1 A 120 120 THR C C 120 174.154 172.061 2.093 1
1 1239 . 10 1 1 A 120 120 THR CA C 120 61.893 60.266 1.627 1
1 1240 . 10 1 1 A 120 120 THR CB C 120 69.736 69.591 0.145 1
1 1242 . 10 1 1 A 120 120 THR N N 120 113.088 108.550 4.538 1
1 1243 . 10 1 1 A 121 121 ASP H H 121 8.209 8.196 0.013 1
1 1244 . 10 1 1 A 121 121 ASP HA H 121 4.876 4.856 0.020 1
1 1247 . 10 1 1 A 121 121 ASP CA C 121 52.126 52.293 -0.167 1
1 1248 . 10 1 1 A 121 121 ASP CB C 121 41.553 40.497 1.056 1
1 1249 . 10 1 1 A 121 121 ASP N N 121 123.630 122.813 0.817 1
1 1250 . 10 1 1 A 122 122 PRO HA H 122 4.363 4.557 -0.194 1
1 1255 . 10 1 1 A 122 122 PRO C C 122 177.344 175.317 2.027 1
1 1256 . 10 1 1 A 122 122 PRO CA C 122 63.913 62.856 1.057 1
1 1257 . 10 1 1 A 122 122 PRO CB C 122 32.116 30.785 1.331 1
1 1260 . 10 1 1 A 123 123 LYS H H 123 8.344 8.259 0.085 1
1 1261 . 10 1 1 A 123 123 LYS HA H 123 4.244 4.702 -0.458 1
1 1266 . 10 1 1 A 123 123 LYS C C 123 176.637 174.671 1.966 1
1 1267 . 10 1 1 A 123 123 LYS CA C 123 56.359 55.243 1.116 1
1 1268 . 10 1 1 A 123 123 LYS CB C 123 32.367 34.336 -1.969 1
1 1272 . 10 1 1 A 123 123 LYS N N 123 119.110 124.460 -5.350 1
1 1273 . 10 1 1 A 124 124 ALA H H 124 7.929 8.721 -0.792 1
1 1274 . 10 1 1 A 124 124 ALA HA H 124 4.248 4.957 -0.709 1
1 1278 . 10 1 1 A 124 124 ALA C C 124 177.648 175.826 1.822 1
1 1279 . 10 1 1 A 124 124 ALA CA C 124 52.618 51.771 0.847 1
1 1280 . 10 1 1 A 124 124 ALA CB C 124 19.379 20.401 -1.022 1
1 1281 . 10 1 1 A 124 124 ALA N N 124 123.825 128.072 -4.247 1
1 1282 . 10 1 1 A 125 125 SER H H 125 8.134 9.156 -1.022 1
1 1283 . 10 1 1 A 125 125 SER HA H 125 4.341 5.438 -1.097 1
1 1286 . 10 1 1 A 125 125 SER C C 125 174.172 173.269 0.903 1
1 1287 . 10 1 1 A 125 125 SER CA C 125 58.391 56.783 1.608 1
1 1288 . 10 1 1 A 125 125 SER CB C 125 63.748 64.873 -1.125 1
1 1289 . 10 1 1 A 125 125 SER N N 125 114.454 118.896 -4.442 1
1 1290 . 10 1 1 A 126 126 ASN H H 126 8.242 8.956 -0.714 1
1 1291 . 10 1 1 A 126 126 ASN HA H 126 4.657 5.362 -0.705 1
1 1294 . 10 1 1 A 126 126 ASN C C 126 174.624 174.327 0.297 1
1 1295 . 10 1 1 A 126 126 ASN CA C 126 53.292 51.732 1.560 1
1 1296 . 10 1 1 A 126 126 ASN CB C 126 38.797 39.789 -0.992 1
1 1297 . 10 1 1 A 126 126 ASN N N 126 120.102 122.912 -2.810 1
1 1298 . 10 1 1 A 127 127 TRP H H 127 8.051 9.034 -0.983 1
1 1299 . 10 1 1 A 127 127 TRP HA H 127 4.694 5.110 -0.416 1
1 1302 . 10 1 1 A 127 127 TRP C C 127 175.479 175.827 -0.348 1
1 1303 . 10 1 1 A 127 127 TRP CA C 127 57.096 56.212 0.884 1
1 1304 . 10 1 1 A 127 127 TRP CB C 127 29.820 32.171 -2.351 1
1 1305 . 10 1 1 A 127 127 TRP N N 127 121.198 126.197 -4.999 1
1 1 . 11 1 1 A 7 7 HIS HA H 7 4.623 4.563 0.060 1
1 4 . 11 1 1 A 7 7 HIS C C 7 174.747 174.115 0.632 1
1 5 . 11 1 1 A 7 7 HIS CA C 7 56.189 55.028 1.161 1
1 6 . 11 1 1 A 7 7 HIS CB C 7 30.028 28.404 1.624 1
1 7 . 11 1 1 A 8 8 LEU H H 8 8.283 8.246 0.037 1
1 8 . 11 1 1 A 8 8 LEU HA H 8 4.249 4.448 -0.199 1
1 10 . 11 1 1 A 8 8 LEU C C 8 176.700 176.537 0.163 1
1 11 . 11 1 1 A 8 8 LEU CA C 8 55.498 54.608 0.890 1
1 12 . 11 1 1 A 8 8 LEU CB C 8 42.568 43.534 -0.966 1
1 13 . 11 1 1 A 8 8 LEU N N 8 122.916 124.851 -1.935 1
1 14 . 11 1 1 A 9 9 GLU H H 9 8.623 8.841 -0.218 1
1 15 . 11 1 1 A 9 9 GLU HA H 9 4.311 3.871 0.440 1
1 16 . 11 1 1 A 9 9 GLU C C 9 174.811 175.242 -0.431 1
1 17 . 11 1 1 A 9 9 GLU CA C 9 56.377 57.132 -0.755 1
1 18 . 11 1 1 A 9 9 GLU CB C 9 29.557 28.245 1.312 1
1 20 . 11 1 1 A 9 9 GLU N N 9 121.512 117.876 3.636 1
1 21 . 11 1 1 A 10 10 LEU H H 10 7.853 7.800 0.053 1
1 22 . 11 1 1 A 10 10 LEU HA H 10 5.225 5.130 0.095 1
1 31 . 11 1 1 A 10 10 LEU C C 10 174.637 175.509 -0.872 1
1 32 . 11 1 1 A 10 10 LEU CA C 10 54.513 53.956 0.557 1
1 33 . 11 1 1 A 10 10 LEU CB C 10 45.187 43.207 1.980 1
1 36 . 11 1 1 A 10 10 LEU N N 10 123.592 121.071 2.521 1
1 37 . 11 1 1 A 11 11 GLU H H 11 8.894 8.939 -0.045 1
1 38 . 11 1 1 A 11 11 GLU HA H 11 4.765 5.115 -0.350 1
1 43 . 11 1 1 A 11 11 GLU C C 11 174.563 175.488 -0.925 1
1 44 . 11 1 1 A 11 11 GLU CA C 11 55.047 54.759 0.288 1
1 45 . 11 1 1 A 11 11 GLU CB C 11 33.760 32.316 1.444 1
1 47 . 11 1 1 A 11 11 GLU N N 11 124.055 123.730 0.325 1
1 48 . 11 1 1 A 12 12 VAL H H 12 8.607 9.227 -0.620 1
1 49 . 11 1 1 A 12 12 VAL HA H 12 5.174 5.093 0.081 1
1 57 . 11 1 1 A 12 12 VAL C C 12 173.573 175.359 -1.786 1
1 58 . 11 1 1 A 12 12 VAL CA C 12 60.296 61.252 -0.956 1
1 59 . 11 1 1 A 12 12 VAL CB C 12 35.689 33.047 2.642 1
1 62 . 11 1 1 A 12 12 VAL N N 12 120.878 125.066 -4.188 1
1 63 . 11 1 1 A 13 13 HIS H H 13 8.982 8.893 0.089 1
1 64 . 11 1 1 A 13 13 HIS HA H 13 4.824 5.301 -0.477 1
1 69 . 11 1 1 A 13 13 HIS C C 13 173.236 172.037 1.199 1
1 70 . 11 1 1 A 13 13 HIS CA C 13 54.906 53.958 0.948 1
1 71 . 11 1 1 A 13 13 HIS CB C 13 33.496 32.992 0.504 1
1 72 . 11 1 1 A 13 13 HIS N N 13 121.504 122.159 -0.655 1
1 73 . 11 1 1 A 14 14 ILE H H 14 10.442 8.993 1.449 1
1 74 . 11 1 1 A 14 14 ILE HA H 14 5.458 4.947 0.511 1
1 84 . 11 1 1 A 14 14 ILE CA C 14 58.386 57.715 0.671 1
1 85 . 11 1 1 A 14 14 ILE CB C 14 38.596 38.340 0.256 1
1 88 . 11 1 1 A 14 14 ILE N N 14 119.923 120.512 -0.589 1
1 89 . 11 1 1 A 15 15 PRO HA H 15 4.560 4.572 -0.012 1
1 95 . 11 1 1 A 15 15 PRO C C 15 176.907 176.623 0.284 1
1 96 . 11 1 1 A 15 15 PRO CA C 15 64.342 64.518 -0.176 1
1 97 . 11 1 1 A 15 15 PRO CB C 15 32.924 32.278 0.646 1
1 100 . 11 1 1 A 16 16 SER H H 16 7.331 7.722 -0.391 1
1 101 . 11 1 1 A 16 16 SER HA H 16 4.822 5.038 -0.216 1
1 104 . 11 1 1 A 16 16 SER C C 16 171.253 172.635 -1.382 1
1 105 . 11 1 1 A 16 16 SER CA C 16 57.135 57.835 -0.700 1
1 106 . 11 1 1 A 16 16 SER CB C 16 65.947 66.989 -1.042 1
1 107 . 11 1 1 A 16 16 SER N N 16 107.745 113.998 -6.253 1
1 108 . 11 1 1 A 17 17 VAL H H 17 8.350 8.550 -0.200 1
1 109 . 11 1 1 A 17 17 VAL HA H 17 4.926 5.206 -0.280 1
1 117 . 11 1 1 A 17 17 VAL C C 17 173.692 175.244 -1.552 1
1 118 . 11 1 1 A 17 17 VAL CA C 17 58.721 60.643 -1.922 1
1 119 . 11 1 1 A 17 17 VAL CB C 17 34.420 35.947 -1.527 1
1 122 . 11 1 1 A 17 17 VAL N N 17 118.680 122.805 -4.125 1
1 123 . 11 1 1 A 18 18 GLY H H 18 8.332 8.303 0.029 1
1 124 . 11 1 1 A 18 18 GLY HA2 H 18 4.189 4.270 -0.081 1
1 125 . 11 1 1 A 18 18 GLY HA3 H 18 4.011 4.278 -0.267 1
1 126 . 11 1 1 A 18 18 GLY CA C 18 45.356 45.134 0.222 1
1 127 . 11 1 1 A 18 18 GLY N N 18 112.549 113.168 -0.619 1
1 128 . 11 1 1 A 19 19 PRO HA H 19 4.757 4.698 0.059 1
1 134 . 11 1 1 A 19 19 PRO C C 19 177.482 177.534 -0.052 1
1 135 . 11 1 1 A 19 19 PRO CA C 19 62.848 62.549 0.299 1
1 136 . 11 1 1 A 19 19 PRO CB C 19 32.283 31.717 0.566 1
1 139 . 11 1 1 A 20 20 GLU H H 20 8.588 8.853 -0.265 1
1 140 . 11 1 1 A 20 20 GLU HA H 20 4.147 4.100 0.047 1
1 144 . 11 1 1 A 20 20 GLU C C 20 175.857 175.985 -0.128 1
1 145 . 11 1 1 A 20 20 GLU CA C 20 57.150 59.462 -2.312 1
1 146 . 11 1 1 A 20 20 GLU CB C 20 30.923 30.449 0.474 1
1 148 . 11 1 1 A 20 20 GLU N N 20 122.087 124.030 -1.943 1
1 149 . 11 1 1 A 21 21 ALA H H 21 8.352 7.860 0.492 1
1 150 . 11 1 1 A 21 21 ALA HA H 21 4.391 4.777 -0.386 1
1 154 . 11 1 1 A 21 21 ALA C C 21 174.910 176.179 -1.269 1
1 155 . 11 1 1 A 21 21 ALA CA C 21 52.166 50.476 1.690 1
1 156 . 11 1 1 A 21 21 ALA CB C 21 19.915 22.195 -2.280 1
1 157 . 11 1 1 A 21 21 ALA N N 21 124.593 119.642 4.951 1
1 158 . 11 1 1 A 22 22 GLU H H 22 8.398 8.853 -0.455 1
1 159 . 11 1 1 A 22 22 GLU HA H 22 4.331 4.277 0.054 1
1 163 . 11 1 1 A 22 22 GLU C C 22 176.389 177.324 -0.935 1
1 164 . 11 1 1 A 22 22 GLU CA C 22 56.316 58.041 -1.725 1
1 165 . 11 1 1 A 22 22 GLU CB C 22 30.713 28.916 1.797 1
1 167 . 11 1 1 A 22 22 GLU N N 22 120.159 121.569 -1.410 1
1 168 . 11 1 1 A 23 23 GLY H H 23 8.246 8.911 -0.665 1
1 169 . 11 1 1 A 23 23 GLY HA2 H 23 4.162 3.872 0.290 1
1 170 . 11 1 1 A 23 23 GLY HA3 H 23 4.061 3.886 0.175 1
1 171 . 11 1 1 A 23 23 GLY CA C 23 44.801 46.920 -2.119 1
1 172 . 11 1 1 A 23 23 GLY N N 23 110.080 113.891 -3.811 1
1 173 . 11 1 1 A 24 24 PRO HA H 24 4.417 4.562 -0.145 1
1 178 . 11 1 1 A 24 24 PRO C C 24 177.135 176.247 0.888 1
1 179 . 11 1 1 A 24 24 PRO CA C 24 63.520 62.366 1.154 1
1 180 . 11 1 1 A 24 24 PRO CB C 24 32.124 32.938 -0.814 1
1 183 . 11 1 1 A 25 25 ARG H H 25 8.409 8.425 -0.016 1
1 184 . 11 1 1 A 25 25 ARG HA H 25 4.298 4.318 -0.020 1
1 187 . 11 1 1 A 25 25 ARG C C 25 176.217 176.058 0.159 1
1 188 . 11 1 1 A 25 25 ARG CA C 25 56.237 55.616 0.621 1
1 189 . 11 1 1 A 25 25 ARG CB C 25 30.467 31.044 -0.577 1
1 192 . 11 1 1 A 25 25 ARG N N 25 120.147 121.429 -1.282 1
1 193 . 11 1 1 A 26 26 GLN H H 26 8.278 8.128 0.150 1
1 194 . 11 1 1 A 26 26 GLN HA H 26 4.336 4.252 0.084 1
1 200 . 11 1 1 A 26 26 GLN C C 26 175.566 175.028 0.538 1
1 201 . 11 1 1 A 26 26 GLN CA C 26 55.788 56.901 -1.113 1
1 202 . 11 1 1 A 26 26 GLN CB C 26 29.714 29.132 0.582 1
1 204 . 11 1 1 A 26 26 GLN N N 26 120.460 125.423 -4.963 1
1 206 . 11 1 1 A 27 27 SER H H 27 8.298 8.405 -0.107 1
1 208 . 11 1 1 A 27 27 SER CA C 27 56.156 55.627 0.529 1
1 209 . 11 1 1 A 27 27 SER CB C 27 63.813 64.704 -0.891 1
1 210 . 11 1 1 A 27 27 SER N N 27 117.382 123.706 -6.324 1
1 211 . 11 1 1 A 28 28 PRO HA H 28 4.366 4.272 0.094 1
1 216 . 11 1 1 A 28 28 PRO C C 28 177.555 177.746 -0.191 1
1 217 . 11 1 1 A 28 28 PRO CA C 28 64.486 65.524 -1.038 1
1 218 . 11 1 1 A 28 28 PRO CB C 28 31.892 31.871 0.021 1
1 221 . 11 1 1 A 29 29 GLU H H 29 8.582 8.277 0.305 1
1 222 . 11 1 1 A 29 29 GLU HA H 29 4.218 4.600 -0.382 1
1 226 . 11 1 1 A 29 29 GLU CA C 29 57.261 57.117 0.144 1
1 227 . 11 1 1 A 29 29 GLU CB C 29 29.633 31.010 -1.377 1
1 229 . 11 1 1 A 29 29 GLU N N 29 118.309 113.990 4.319 1
1 230 . 11 1 1 A 30 30 LYS H H 30 7.955 7.609 0.346 1
1 231 . 11 1 1 A 30 30 LYS HA H 30 4.328 4.617 -0.289 1
1 236 . 11 1 1 A 30 30 LYS C C 30 176.222 174.551 1.671 1
1 237 . 11 1 1 A 30 30 LYS CA C 30 56.247 56.062 0.185 1
1 238 . 11 1 1 A 30 30 LYS CB C 30 32.720 35.699 -2.979 1
1 242 . 11 1 1 A 30 30 LYS N N 30 120.129 119.625 0.504 1
1 243 . 11 1 1 A 31 31 SER H H 31 7.883 9.032 -1.149 1
1 244 . 11 1 1 A 31 31 SER HA H 31 4.458 4.563 -0.105 1
1 246 . 11 1 1 A 31 31 SER C C 31 174.129 175.290 -1.161 1
1 247 . 11 1 1 A 31 31 SER CA C 31 58.477 58.417 0.060 1
1 248 . 11 1 1 A 31 31 SER CB C 31 64.042 62.062 1.980 1
1 249 . 11 1 1 A 31 31 SER N N 31 115.366 124.056 -8.690 1
1 250 . 11 1 1 A 32 32 HIS H H 32 8.485 8.446 0.039 1
1 251 . 11 1 1 A 32 32 HIS HA H 32 4.450 4.920 -0.470 1
1 255 . 11 1 1 A 32 32 HIS CA C 32 56.009 55.054 0.955 1
1 256 . 11 1 1 A 32 32 HIS CB C 32 31.122 30.896 0.226 1
1 257 . 11 1 1 A 32 32 HIS N N 32 121.500 119.579 1.921 1
1 258 . 11 1 1 A 33 33 MET H H 33 8.392 7.724 0.668 1
1 259 . 11 1 1 A 33 33 MET HA H 33 4.601 4.644 -0.043 1
1 265 . 11 1 1 A 33 33 MET C C 33 175.842 174.034 1.808 1
1 266 . 11 1 1 A 33 33 MET CA C 33 54.533 54.282 0.251 1
1 267 . 11 1 1 A 33 33 MET CB C 33 32.868 33.873 -1.005 1
1 270 . 11 1 1 A 33 33 MET N N 33 120.204 119.580 0.624 1
1 271 . 11 1 1 A 34 34 VAL H H 34 8.938 9.283 -0.345 1
1 272 . 11 1 1 A 34 34 VAL HA H 34 4.430 4.729 -0.299 1
1 280 . 11 1 1 A 34 34 VAL C C 34 174.149 174.640 -0.491 1
1 281 . 11 1 1 A 34 34 VAL CA C 34 60.703 59.542 1.161 1
1 282 . 11 1 1 A 34 34 VAL CB C 34 34.319 34.220 0.099 1
1 285 . 11 1 1 A 34 34 VAL N N 34 118.512 127.483 -8.971 1
1 286 . 11 1 1 A 35 35 PHE H H 35 9.242 8.781 0.461 1
1 287 . 11 1 1 A 35 35 PHE HA H 35 4.439 5.710 -1.271 1
1 294 . 11 1 1 A 35 35 PHE C C 35 174.831 173.728 1.103 1
1 295 . 11 1 1 A 35 35 PHE CA C 35 57.754 54.965 2.789 1
1 296 . 11 1 1 A 35 35 PHE CB C 35 38.959 42.296 -3.337 1
1 297 . 11 1 1 A 35 35 PHE N N 35 124.912 125.772 -0.860 1
1 298 . 11 1 1 A 36 36 ARG H H 36 8.475 8.682 -0.207 1
1 299 . 11 1 1 A 36 36 ARG HA H 36 4.135 4.745 -0.610 1
1 304 . 11 1 1 A 36 36 ARG C C 36 172.865 175.460 -2.595 1
1 305 . 11 1 1 A 36 36 ARG CA C 36 56.895 55.603 1.292 1
1 306 . 11 1 1 A 36 36 ARG CB C 36 28.962 30.680 -1.718 1
1 308 . 11 1 1 A 36 36 ARG N N 36 125.680 120.591 5.089 1
1 309 . 11 1 1 A 37 37 VAL H H 37 8.066 9.005 -0.939 1
1 310 . 11 1 1 A 37 37 VAL HA H 37 4.292 4.468 -0.176 1
1 318 . 11 1 1 A 37 37 VAL C C 37 174.595 174.291 0.304 1
1 319 . 11 1 1 A 37 37 VAL CA C 37 62.727 61.277 1.450 1
1 320 . 11 1 1 A 37 37 VAL CB C 37 31.102 32.481 -1.379 1
1 323 . 11 1 1 A 37 37 VAL N N 37 125.403 121.136 4.267 1
1 324 . 11 1 1 A 38 38 GLU H H 38 9.532 9.197 0.335 1
1 325 . 11 1 1 A 38 38 GLU HA H 38 4.895 5.171 -0.276 1
1 329 . 11 1 1 A 38 38 GLU C C 38 174.509 175.109 -0.600 1
1 330 . 11 1 1 A 38 38 GLU CA C 38 55.650 55.031 0.619 1
1 331 . 11 1 1 A 38 38 GLU CB C 38 32.214 30.562 1.652 1
1 333 . 11 1 1 A 38 38 GLU N N 38 129.885 128.029 1.856 1
1 334 . 11 1 1 A 39 39 VAL H H 39 9.035 8.737 0.298 1
1 335 . 11 1 1 A 39 39 VAL HA H 39 4.446 4.466 -0.020 1
1 343 . 11 1 1 A 39 39 VAL C C 39 173.661 174.435 -0.774 1
1 344 . 11 1 1 A 39 39 VAL CA C 39 61.258 62.069 -0.811 1
1 345 . 11 1 1 A 39 39 VAL CB C 39 33.533 32.072 1.461 1
1 348 . 11 1 1 A 39 39 VAL N N 39 127.941 127.605 0.336 1
1 349 . 11 1 1 A 40 40 LEU H H 40 8.843 9.207 -0.364 1
1 350 . 11 1 1 A 40 40 LEU HA H 40 5.130 5.071 0.059 1
1 360 . 11 1 1 A 40 40 LEU C C 40 175.581 174.852 0.729 1
1 361 . 11 1 1 A 40 40 LEU CA C 40 53.702 53.758 -0.056 1
1 362 . 11 1 1 A 40 40 LEU CB C 40 43.989 43.856 0.133 1
1 366 . 11 1 1 A 40 40 LEU N N 40 128.413 130.047 -1.634 1
1 367 . 11 1 1 A 41 41 CYS H H 41 8.959 9.171 -0.212 1
1 368 . 11 1 1 A 41 41 CYS HA H 41 5.174 4.817 0.357 1
1 371 . 11 1 1 A 41 41 CYS C C 41 175.043 174.879 0.164 1
1 372 . 11 1 1 A 41 41 CYS CA C 41 57.483 58.023 -0.540 1
1 373 . 11 1 1 A 41 41 CYS CB C 41 28.472 30.178 -1.706 1
1 374 . 11 1 1 A 41 41 CYS N N 41 124.738 125.213 -0.475 1
1 375 . 11 1 1 A 42 42 SER H H 42 9.527 9.142 0.385 1
1 376 . 11 1 1 A 42 42 SER HA H 42 4.149 4.538 -0.389 1
1 379 . 11 1 1 A 42 42 SER C C 42 175.014 173.597 1.417 1
1 380 . 11 1 1 A 42 42 SER CA C 42 59.058 59.209 -0.151 1
1 381 . 11 1 1 A 42 42 SER CB C 42 62.287 62.081 0.206 1
1 382 . 11 1 1 A 42 42 SER N N 42 125.889 120.792 5.097 1
1 383 . 11 1 1 A 43 43 GLY H H 43 8.685 7.898 0.787 1
1 384 . 11 1 1 A 43 43 GLY HA2 H 43 3.594 3.835 -0.241 1
1 385 . 11 1 1 A 43 43 GLY HA3 H 43 4.210 3.837 0.373 1
1 386 . 11 1 1 A 43 43 GLY C C 43 173.664 173.577 0.087 1
1 387 . 11 1 1 A 43 43 GLY CA C 43 45.404 45.218 0.186 1
1 388 . 11 1 1 A 43 43 GLY N N 43 104.633 106.273 -1.640 1
1 389 . 11 1 1 A 44 44 ARG H H 44 7.926 7.788 0.138 1
1 390 . 11 1 1 A 44 44 ARG HA H 44 4.678 4.440 0.238 1
1 395 . 11 1 1 A 44 44 ARG C C 44 175.261 174.954 0.307 1
1 396 . 11 1 1 A 44 44 ARG CA C 44 55.011 55.385 -0.374 1
1 397 . 11 1 1 A 44 44 ARG CB C 44 32.138 31.431 0.707 1
1 400 . 11 1 1 A 44 44 ARG N N 44 121.239 120.614 0.625 1
1 401 . 11 1 1 A 45 45 ARG H H 45 8.775 8.800 -0.025 1
1 402 . 11 1 1 A 45 45 ARG HA H 45 5.770 5.233 0.537 1
1 409 . 11 1 1 A 45 45 ARG C C 45 176.064 175.508 0.556 1
1 410 . 11 1 1 A 45 45 ARG CA C 45 54.683 54.615 0.068 1
1 411 . 11 1 1 A 45 45 ARG CB C 45 33.748 32.734 1.014 1
1 414 . 11 1 1 A 45 45 ARG N N 45 125.948 121.752 4.196 1
1 415 . 11 1 1 A 46 46 HIS H H 46 8.912 8.495 0.417 1
1 416 . 11 1 1 A 46 46 HIS HA H 46 4.927 5.545 -0.618 1
1 420 . 11 1 1 A 46 46 HIS C C 46 172.634 174.040 -1.406 1
1 421 . 11 1 1 A 46 46 HIS CA C 46 56.480 53.988 2.492 1
1 422 . 11 1 1 A 46 46 HIS CB C 46 33.608 31.758 1.850 1
1 423 . 11 1 1 A 46 46 HIS N N 46 121.825 119.951 1.874 1
1 424 . 11 1 1 A 47 47 THR H H 47 8.532 9.061 -0.529 1
1 425 . 11 1 1 A 47 47 THR HA H 47 5.472 4.589 0.883 1
1 430 . 11 1 1 A 47 47 THR C C 47 174.442 173.996 0.446 1
1 431 . 11 1 1 A 47 47 THR CA C 47 61.093 62.741 -1.648 1
1 432 . 11 1 1 A 47 47 THR CB C 47 71.041 68.808 2.233 1
1 434 . 11 1 1 A 47 47 THR N N 47 115.450 120.458 -5.008 1
1 435 . 11 1 1 A 48 48 VAL H H 48 9.695 9.077 0.618 1
1 436 . 11 1 1 A 48 48 VAL HA H 48 4.677 4.513 0.164 1
1 444 . 11 1 1 A 48 48 VAL CA C 48 58.172 59.333 -1.161 1
1 445 . 11 1 1 A 48 48 VAL CB C 48 34.990 32.596 2.394 1
1 448 . 11 1 1 A 48 48 VAL N N 48 126.721 127.700 -0.979 1
1 449 . 11 1 1 A 49 49 PRO HA H 49 5.087 5.311 -0.224 1
1 453 . 11 1 1 A 49 49 PRO CA C 49 61.671 62.518 -0.847 1
1 454 . 11 1 1 A 49 49 PRO CB C 49 31.923 31.732 0.191 1
1 457 . 11 1 1 A 50 50 ARG H H 50 9.125 9.039 0.086 1
1 458 . 11 1 1 A 50 50 ARG HA H 50 4.974 4.751 0.223 1
1 464 . 11 1 1 A 50 50 ARG C C 50 176.187 174.750 1.437 1
1 465 . 11 1 1 A 50 50 ARG CA C 50 53.015 54.139 -1.124 1
1 466 . 11 1 1 A 50 50 ARG CB C 50 36.553 34.975 1.578 1
1 468 . 11 1 1 A 50 50 ARG N N 50 124.189 123.112 1.077 1
1 469 . 11 1 1 A 51 51 ARG H H 51 10.105 7.896 2.209 1
1 470 . 11 1 1 A 51 51 ARG HA H 51 5.196 4.164 1.032 1
1 475 . 11 1 1 A 51 51 ARG C C 51 178.865 175.740 3.125 1
1 476 . 11 1 1 A 51 51 ARG CA C 51 55.961 54.362 1.599 1
1 477 . 11 1 1 A 51 51 ARG CB C 51 32.539 31.385 1.154 1
1 480 . 11 1 1 A 51 51 ARG N N 51 124.521 120.281 4.240 1
1 481 . 11 1 1 A 52 52 TYR H H 52 10.397 8.925 1.472 1
1 482 . 11 1 1 A 52 52 TYR HA H 52 4.360 4.359 0.001 1
1 487 . 11 1 1 A 52 52 TYR C C 52 178.143 177.772 0.371 1
1 488 . 11 1 1 A 52 52 TYR CA C 52 63.538 62.571 0.967 1
1 489 . 11 1 1 A 52 52 TYR CB C 52 38.784 38.563 0.221 1
1 490 . 11 1 1 A 52 52 TYR N N 52 124.772 121.526 3.246 1
1 491 . 11 1 1 A 53 53 SER H H 53 9.231 8.600 0.631 1
1 492 . 11 1 1 A 53 53 SER HA H 53 4.175 4.463 -0.288 1
1 493 . 11 1 1 A 53 53 SER C C 53 177.220 177.484 -0.264 1
1 494 . 11 1 1 A 53 53 SER CA C 53 61.606 61.860 -0.254 1
1 495 . 11 1 1 A 53 53 SER N N 53 113.262 114.449 -1.187 1
1 496 . 11 1 1 A 54 54 GLU H H 54 7.807 7.693 0.114 1
1 497 . 11 1 1 A 54 54 GLU HA H 54 4.392 4.377 0.015 1
1 501 . 11 1 1 A 54 54 GLU C C 54 180.361 179.003 1.358 1
1 502 . 11 1 1 A 54 54 GLU CA C 54 59.497 59.056 0.441 1
1 503 . 11 1 1 A 54 54 GLU CB C 54 30.708 29.739 0.969 1
1 504 . 11 1 1 A 54 54 GLU N N 54 121.949 122.370 -0.421 1
1 505 . 11 1 1 A 55 55 PHE H H 55 8.133 8.468 -0.335 1
1 506 . 11 1 1 A 55 55 PHE HA H 55 4.007 4.258 -0.251 1
1 513 . 11 1 1 A 55 55 PHE C C 55 176.531 177.641 -1.110 1
1 514 . 11 1 1 A 55 55 PHE CA C 55 61.848 61.305 0.543 1
1 515 . 11 1 1 A 55 55 PHE CB C 55 38.847 38.949 -0.102 1
1 516 . 11 1 1 A 55 55 PHE N N 55 119.998 122.985 -2.987 1
1 517 . 11 1 1 A 56 56 HIS H H 56 7.907 8.085 -0.178 1
1 518 . 11 1 1 A 56 56 HIS HA H 56 3.324 4.165 -0.841 1
1 522 . 11 1 1 A 56 56 HIS C C 56 176.748 177.936 -1.188 1
1 523 . 11 1 1 A 56 56 HIS CA C 56 58.770 60.152 -1.382 1
1 524 . 11 1 1 A 56 56 HIS CB C 56 30.404 29.747 0.657 1
1 525 . 11 1 1 A 56 56 HIS N N 56 119.173 118.429 0.744 1
1 526 . 11 1 1 A 57 57 ALA H H 57 7.962 8.601 -0.639 1
1 527 . 11 1 1 A 57 57 ALA HA H 57 3.865 3.909 -0.044 1
1 531 . 11 1 1 A 57 57 ALA C C 57 180.075 179.893 0.182 1
1 532 . 11 1 1 A 57 57 ALA CA C 57 54.996 55.083 -0.087 1
1 533 . 11 1 1 A 57 57 ALA CB C 57 18.226 18.065 0.161 1
1 534 . 11 1 1 A 57 57 ALA N N 57 120.094 121.349 -1.255 1
1 535 . 11 1 1 A 58 58 LEU H H 58 7.295 7.894 -0.599 1
1 536 . 11 1 1 A 58 58 LEU HA H 58 3.994 3.459 0.535 1
1 546 . 11 1 1 A 58 58 LEU C C 58 177.428 178.497 -1.069 1
1 547 . 11 1 1 A 58 58 LEU CA C 58 58.342 57.617 0.725 1
1 548 . 11 1 1 A 58 58 LEU CB C 58 40.851 41.236 -0.385 1
1 552 . 11 1 1 A 58 58 LEU N N 58 119.404 120.156 -0.752 1
1 553 . 11 1 1 A 59 59 HIS H H 59 7.805 8.211 -0.406 1
1 554 . 11 1 1 A 59 59 HIS HA H 59 4.286 3.786 0.500 1
1 558 . 11 1 1 A 59 59 HIS C C 59 177.001 177.272 -0.271 1
1 559 . 11 1 1 A 59 59 HIS CA C 59 60.141 60.024 0.117 1
1 560 . 11 1 1 A 59 59 HIS CB C 59 31.072 29.242 1.830 1
1 561 . 11 1 1 A 59 59 HIS N N 59 119.040 118.102 0.938 1
1 562 . 11 1 1 A 60 60 LYS H H 60 7.715 7.854 -0.139 1
1 563 . 11 1 1 A 60 60 LYS HA H 60 3.456 3.860 -0.404 1
1 570 . 11 1 1 A 60 60 LYS C C 60 178.464 178.719 -0.255 1
1 571 . 11 1 1 A 60 60 LYS CA C 60 59.629 58.641 0.988 1
1 572 . 11 1 1 A 60 60 LYS CB C 60 32.354 31.676 0.678 1
1 576 . 11 1 1 A 60 60 LYS N N 60 114.225 117.867 -3.642 1
1 577 . 11 1 1 A 61 61 ARG H H 61 7.486 7.433 0.053 1
1 578 . 11 1 1 A 61 61 ARG HA H 61 4.202 4.094 0.108 1
1 584 . 11 1 1 A 61 61 ARG C C 61 178.995 177.959 1.036 1
1 585 . 11 1 1 A 61 61 ARG CA C 61 58.387 58.482 -0.095 1
1 586 . 11 1 1 A 61 61 ARG CB C 61 31.216 30.247 0.969 1
1 589 . 11 1 1 A 61 61 ARG N N 61 115.929 119.356 -3.427 1
1 590 . 11 1 1 A 62 62 ILE H H 62 8.066 7.538 0.528 1
1 591 . 11 1 1 A 62 62 ILE HA H 62 4.491 4.354 0.137 1
1 601 . 11 1 1 A 62 62 ILE C C 62 177.838 177.326 0.512 1
1 602 . 11 1 1 A 62 62 ILE CA C 62 63.399 61.227 2.172 1
1 603 . 11 1 1 A 62 62 ILE CB C 62 39.699 38.148 1.551 1
1 606 . 11 1 1 A 62 62 ILE N N 62 111.456 114.631 -3.175 1
1 607 . 11 1 1 A 63 63 LYS H H 63 8.158 8.344 -0.186 1
1 608 . 11 1 1 A 63 63 LYS HA H 63 4.136 3.746 0.390 1
1 615 . 11 1 1 A 63 63 LYS C C 63 176.358 177.630 -1.272 1
1 616 . 11 1 1 A 63 63 LYS CA C 63 58.753 58.719 0.034 1
1 617 . 11 1 1 A 63 63 LYS CB C 63 30.825 31.850 -1.025 1
1 621 . 11 1 1 A 63 63 LYS N N 63 120.800 124.118 -3.318 1
1 622 . 11 1 1 A 64 64 LYS H H 64 7.687 8.068 -0.381 1
1 623 . 11 1 1 A 64 64 LYS HA H 64 4.301 4.162 0.139 1
1 628 . 11 1 1 A 64 64 LYS C C 64 177.084 177.966 -0.882 1
1 629 . 11 1 1 A 64 64 LYS CA C 64 57.237 57.045 0.192 1
1 630 . 11 1 1 A 64 64 LYS CB C 64 32.502 32.243 0.259 1
1 634 . 11 1 1 A 64 64 LYS N N 64 116.548 118.466 -1.918 1
1 635 . 11 1 1 A 65 65 LEU H H 65 7.476 8.022 -0.546 1
1 636 . 11 1 1 A 65 65 LEU HA H 65 4.219 4.203 0.016 1
1 645 . 11 1 1 A 65 65 LEU C C 65 175.886 176.171 -0.285 1
1 646 . 11 1 1 A 65 65 LEU CA C 65 55.542 56.818 -1.276 1
1 647 . 11 1 1 A 65 65 LEU CB C 65 45.493 43.404 2.089 1
1 650 . 11 1 1 A 65 65 LEU N N 65 118.000 120.088 -2.088 1
1 651 . 11 1 1 A 66 66 TYR H H 66 7.672 7.395 0.277 1
1 652 . 11 1 1 A 66 66 TYR HA H 66 4.762 4.931 -0.169 1
1 660 . 11 1 1 A 66 66 TYR C C 66 174.199 173.315 0.884 1
1 661 . 11 1 1 A 66 66 TYR CA C 66 56.013 55.898 0.115 1
1 662 . 11 1 1 A 66 66 TYR CB C 66 40.380 40.254 0.126 1
1 663 . 11 1 1 A 66 66 TYR N N 66 116.805 113.700 3.105 1
1 664 . 11 1 1 A 67 67 LYS H H 67 8.547 8.236 0.311 1
1 665 . 11 1 1 A 67 67 LYS HA H 67 4.436 4.485 -0.049 1
1 670 . 11 1 1 A 67 67 LYS C C 67 175.727 175.273 0.454 1
1 671 . 11 1 1 A 67 67 LYS CA C 67 56.598 55.972 0.626 1
1 672 . 11 1 1 A 67 67 LYS CB C 67 32.743 32.968 -0.225 1
1 676 . 11 1 1 A 67 67 LYS N N 67 120.929 120.094 0.835 1
1 677 . 11 1 1 A 68 68 VAL H H 68 8.168 8.252 -0.084 1
1 678 . 11 1 1 A 68 68 VAL HA H 68 4.869 4.298 0.571 1
1 686 . 11 1 1 A 68 68 VAL CA C 68 57.389 58.358 -0.969 1
1 687 . 11 1 1 A 68 68 VAL CB C 68 34.017 34.746 -0.729 1
1 690 . 11 1 1 A 68 68 VAL N N 68 116.467 123.312 -6.845 1
1 691 . 11 1 1 A 69 69 PRO HA H 69 4.674 4.477 0.197 1
1 696 . 11 1 1 A 69 69 PRO C C 69 178.013 176.260 1.753 1
1 697 . 11 1 1 A 69 69 PRO CA C 69 61.443 65.619 -4.176 1
1 698 . 11 1 1 A 69 69 PRO CB C 69 32.231 31.861 0.370 1
1 701 . 11 1 1 A 70 70 ASP H H 70 8.167 7.923 0.244 1
1 702 . 11 1 1 A 70 70 ASP HA H 70 4.531 5.149 -0.618 1
1 705 . 11 1 1 A 70 70 ASP C C 70 175.660 173.853 1.807 1
1 706 . 11 1 1 A 70 70 ASP CA C 70 55.148 53.011 2.137 1
1 707 . 11 1 1 A 70 70 ASP CB C 70 40.876 44.230 -3.354 1
1 708 . 11 1 1 A 70 70 ASP N N 70 116.671 116.909 -0.238 1
1 709 . 11 1 1 A 71 71 PHE H H 71 8.387 8.501 -0.114 1
1 710 . 11 1 1 A 71 71 PHE HA H 71 4.076 4.628 -0.552 1
1 717 . 11 1 1 A 71 71 PHE CA C 71 55.672 54.602 1.070 1
1 718 . 11 1 1 A 71 71 PHE CB C 71 39.155 41.560 -2.405 1
1 719 . 11 1 1 A 71 71 PHE N N 71 126.533 116.688 9.845 1
1 720 . 11 1 1 A 72 72 PRO HA H 72 4.156 4.817 -0.661 1
1 727 . 11 1 1 A 72 72 PRO CA C 72 63.079 62.377 0.702 1
1 728 . 11 1 1 A 72 72 PRO CB C 72 32.107 32.739 -0.632 1
1 731 . 11 1 1 A 73 73 SER H H 73 8.468 8.648 -0.180 1
1 733 . 11 1 1 A 73 73 SER CA C 73 56.133 57.152 -1.019 1
1 734 . 11 1 1 A 73 73 SER CB C 73 63.991 64.695 -0.704 1
1 735 . 11 1 1 A 73 73 SER N N 73 121.533 117.556 3.977 1
1 736 . 11 1 1 A 74 74 LYS HA H 74 4.574 4.144 0.430 1
1 739 . 11 1 1 A 74 74 LYS CA C 74 55.659 58.181 -2.522 1
1 740 . 11 1 1 A 74 74 LYS CB C 74 30.550 33.574 -3.024 1
1 741 . 11 1 1 A 75 75 ARG H H 75 7.962 7.591 0.371 1
1 742 . 11 1 1 A 75 75 ARG HA H 75 4.162 4.519 -0.357 1
1 746 . 11 1 1 A 75 75 ARG CA C 75 56.123 55.977 0.146 1
1 747 . 11 1 1 A 75 75 ARG CB C 75 31.179 31.163 0.016 1
1 749 . 11 1 1 A 75 75 ARG N N 75 121.665 119.979 1.686 1
1 750 . 11 1 1 A 76 76 LEU H H 76 8.071 8.297 -0.226 1
1 751 . 11 1 1 A 76 76 LEU HA H 76 4.618 4.608 0.010 1
1 759 . 11 1 1 A 76 76 LEU CA C 76 52.764 51.359 1.405 1
1 760 . 11 1 1 A 76 76 LEU CB C 76 41.918 44.264 -2.346 1
1 762 . 11 1 1 A 76 76 LEU N N 76 124.196 127.427 -3.231 1
1 763 . 11 1 1 A 77 77 PRO HA H 77 4.393 4.254 0.139 1
1 767 . 11 1 1 A 77 77 PRO CA C 77 63.746 62.280 1.466 1
1 770 . 11 1 1 A 78 78 ASN H H 78 8.379 8.205 0.174 1
1 771 . 11 1 1 A 78 78 ASN HA H 78 4.586 4.289 0.297 1
1 776 . 11 1 1 A 78 78 ASN C C 78 175.648 175.339 0.309 1
1 777 . 11 1 1 A 78 78 ASN CA C 78 53.591 53.600 -0.009 1
1 778 . 11 1 1 A 78 78 ASN CB C 78 37.826 38.323 -0.497 1
1 779 . 11 1 1 A 78 78 ASN N N 78 115.292 119.831 -4.539 1
1 781 . 11 1 1 A 79 79 TRP H H 79 7.900 7.857 0.043 1
1 782 . 11 1 1 A 79 79 TRP HA H 79 4.326 4.232 0.094 1
1 788 . 11 1 1 A 79 79 TRP CA C 79 58.825 60.019 -1.194 1
1 789 . 11 1 1 A 79 79 TRP CB C 79 29.090 27.170 1.920 1
1 790 . 11 1 1 A 79 79 TRP N N 79 119.525 116.561 2.964 1
1 792 . 11 1 1 A 80 80 ARG H H 80 8.060 8.024 0.036 1
1 793 . 11 1 1 A 80 80 ARG HA H 80 3.913 4.176 -0.263 1
1 798 . 11 1 1 A 80 80 ARG C C 80 177.024 178.992 -1.968 1
1 799 . 11 1 1 A 80 80 ARG CA C 80 58.292 59.170 -0.878 1
1 800 . 11 1 1 A 80 80 ARG CB C 80 30.146 29.638 0.508 1
1 803 . 11 1 1 A 80 80 ARG N N 80 118.864 120.001 -1.137 1
1 804 . 11 1 1 A 81 81 THR H H 81 7.725 7.634 0.091 1
1 805 . 11 1 1 A 81 81 THR HA H 81 4.297 4.116 0.181 1
1 809 . 11 1 1 A 81 81 THR CA C 81 62.481 65.973 -3.492 1
1 811 . 11 1 1 A 81 81 THR N N 81 109.863 114.811 -4.948 1
1 812 . 11 1 1 A 82 82 ARG HA H 82 4.341 4.789 -0.448 1
1 816 . 11 1 1 A 82 82 ARG C C 82 177.261 174.787 2.474 1
1 817 . 11 1 1 A 82 82 ARG CA C 82 56.846 55.313 1.533 1
1 818 . 11 1 1 A 82 82 ARG CB C 82 30.288 34.097 -3.809 1
1 820 . 11 1 1 A 83 83 GLY H H 83 8.321 8.713 -0.392 1
1 821 . 11 1 1 A 83 83 GLY HA2 H 83 3.957 4.132 -0.175 1
1 822 . 11 1 1 A 83 83 GLY C C 83 175.185 175.514 -0.329 1
1 823 . 11 1 1 A 83 83 GLY CA C 83 46.297 45.589 0.708 1
1 824 . 11 1 1 A 83 83 GLY N N 83 109.146 112.151 -3.005 1
1 825 . 11 1 1 A 84 84 LEU H H 84 8.303 8.861 -0.558 1
1 826 . 11 1 1 A 84 84 LEU HA H 84 4.018 4.204 -0.186 1
1 835 . 11 1 1 A 84 84 LEU C C 84 178.552 178.577 -0.025 1
1 836 . 11 1 1 A 84 84 LEU CA C 84 58.236 56.665 1.571 1
1 837 . 11 1 1 A 84 84 LEU CB C 84 41.837 41.971 -0.134 1
1 840 . 11 1 1 A 84 84 LEU N N 84 122.662 122.165 0.497 1
1 841 . 11 1 1 A 85 85 GLU H H 85 8.233 8.246 -0.013 1
1 842 . 11 1 1 A 85 85 GLU HA H 85 4.371 3.942 0.429 1
1 846 . 11 1 1 A 85 85 GLU C C 85 178.555 179.299 -0.744 1
1 847 . 11 1 1 A 85 85 GLU CA C 85 58.377 59.827 -1.450 1
1 848 . 11 1 1 A 85 85 GLU CB C 85 28.675 29.101 -0.426 1
1 850 . 11 1 1 A 85 85 GLU N N 85 119.781 118.732 1.049 1
1 851 . 11 1 1 A 86 86 GLN H H 86 7.877 7.792 0.085 1
1 852 . 11 1 1 A 86 86 GLN HA H 86 4.100 4.022 0.078 1
1 858 . 11 1 1 A 86 86 GLN C C 86 179.557 178.518 1.039 1
1 859 . 11 1 1 A 86 86 GLN CA C 86 58.955 59.157 -0.202 1
1 860 . 11 1 1 A 86 86 GLN CB C 86 28.191 28.439 -0.248 1
1 862 . 11 1 1 A 86 86 GLN N N 86 118.042 119.928 -1.886 1
1 863 . 11 1 1 A 87 87 ARG H H 87 8.169 7.721 0.448 1
1 864 . 11 1 1 A 87 87 ARG HA H 87 3.975 4.150 -0.175 1
1 868 . 11 1 1 A 87 87 ARG C C 87 177.051 178.336 -1.285 1
1 869 . 11 1 1 A 87 87 ARG CA C 87 59.006 59.581 -0.575 1
1 870 . 11 1 1 A 87 87 ARG CB C 87 30.383 29.619 0.764 1
1 872 . 11 1 1 A 87 87 ARG N N 87 121.381 119.757 1.624 1
1 873 . 11 1 1 A 88 88 ARG H H 88 8.593 8.036 0.557 1
1 874 . 11 1 1 A 88 88 ARG HA H 88 3.726 3.836 -0.110 1
1 876 . 11 1 1 A 88 88 ARG C C 88 177.520 178.701 -1.181 1
1 877 . 11 1 1 A 88 88 ARG CA C 88 60.751 59.867 0.884 1
1 878 . 11 1 1 A 88 88 ARG CB C 88 30.153 29.994 0.159 1
1 879 . 11 1 1 A 88 88 ARG N N 88 120.863 118.287 2.576 1
1 880 . 11 1 1 A 89 89 GLN H H 89 8.355 7.960 0.395 1
1 881 . 11 1 1 A 89 89 GLN HA H 89 3.887 3.888 -0.001 1
1 887 . 11 1 1 A 89 89 GLN C C 89 179.499 178.382 1.117 1
1 888 . 11 1 1 A 89 89 GLN CA C 89 59.603 59.318 0.285 1
1 889 . 11 1 1 A 89 89 GLN CB C 89 28.464 28.038 0.426 1
1 891 . 11 1 1 A 89 89 GLN N N 89 116.860 119.083 -2.223 1
1 893 . 11 1 1 A 90 90 GLY H H 90 8.406 8.180 0.226 1
1 894 . 11 1 1 A 90 90 GLY HA2 H 90 3.672 3.439 0.233 1
1 895 . 11 1 1 A 90 90 GLY HA3 H 90 3.871 3.567 0.304 1
1 896 . 11 1 1 A 90 90 GLY C C 90 177.033 175.260 1.773 1
1 897 . 11 1 1 A 90 90 GLY CA C 90 46.813 46.899 -0.086 1
1 898 . 11 1 1 A 90 90 GLY N N 90 107.679 107.471 0.208 1
1 899 . 11 1 1 A 91 91 LEU H H 91 8.504 7.793 0.711 1
1 900 . 11 1 1 A 91 91 LEU HA H 91 3.784 3.769 0.015 1
1 910 . 11 1 1 A 91 91 LEU C C 91 178.003 178.924 -0.921 1
1 911 . 11 1 1 A 91 91 LEU CA C 91 57.354 57.502 -0.148 1
1 912 . 11 1 1 A 91 91 LEU CB C 91 40.359 41.260 -0.901 1
1 916 . 11 1 1 A 91 91 LEU N N 91 123.959 121.438 2.521 1
1 917 . 11 1 1 A 92 92 GLU H H 92 8.324 8.401 -0.077 1
1 918 . 11 1 1 A 92 92 GLU HA H 92 3.732 3.738 -0.006 1
1 922 . 11 1 1 A 92 92 GLU C C 92 177.272 179.271 -1.999 1
1 923 . 11 1 1 A 92 92 GLU CA C 92 60.651 59.437 1.214 1
1 924 . 11 1 1 A 92 92 GLU CB C 92 30.843 28.693 2.150 1
1 926 . 11 1 1 A 92 92 GLU N N 92 121.991 120.722 1.269 1
1 927 . 11 1 1 A 93 93 ALA H H 93 8.126 7.757 0.369 1
1 928 . 11 1 1 A 93 93 ALA HA H 93 4.160 4.017 0.143 1
1 932 . 11 1 1 A 93 93 ALA C C 93 180.818 179.369 1.449 1
1 933 . 11 1 1 A 93 93 ALA CA C 93 54.828 54.676 0.152 1
1 934 . 11 1 1 A 93 93 ALA CB C 93 18.032 17.885 0.147 1
1 935 . 11 1 1 A 93 93 ALA N N 93 120.066 121.429 -1.363 1
1 936 . 11 1 1 A 94 94 TYR H H 94 7.916 7.034 0.882 1
1 937 . 11 1 1 A 94 94 TYR HA H 94 4.139 4.305 -0.166 1
1 942 . 11 1 1 A 94 94 TYR C C 94 175.895 178.458 -2.563 1
1 943 . 11 1 1 A 94 94 TYR CA C 94 61.915 61.573 0.342 1
1 944 . 11 1 1 A 94 94 TYR CB C 94 38.740 38.364 0.376 1
1 945 . 11 1 1 A 94 94 TYR N N 94 121.179 116.025 5.154 1
1 946 . 11 1 1 A 95 95 ILE H H 95 7.983 8.059 -0.076 1
1 947 . 11 1 1 A 95 95 ILE HA H 95 3.614 3.795 -0.181 1
1 957 . 11 1 1 A 95 95 ILE C C 95 174.678 178.257 -3.579 1
1 958 . 11 1 1 A 95 95 ILE CA C 95 63.461 65.569 -2.108 1
1 959 . 11 1 1 A 95 95 ILE CB C 95 36.625 37.778 -1.153 1
1 963 . 11 1 1 A 95 95 ILE N N 95 116.397 119.992 -3.595 1
1 964 . 11 1 1 A 96 96 GLN H H 96 8.175 8.496 -0.321 1
1 965 . 11 1 1 A 96 96 GLN HA H 96 3.763 3.982 -0.219 1
1 970 . 11 1 1 A 96 96 GLN C C 96 179.042 178.470 0.572 1
1 971 . 11 1 1 A 96 96 GLN CA C 96 59.270 59.774 -0.504 1
1 972 . 11 1 1 A 96 96 GLN CB C 96 27.696 27.945 -0.249 1
1 974 . 11 1 1 A 96 96 GLN N N 96 116.631 120.392 -3.761 1
1 976 . 11 1 1 A 97 97 GLY H H 97 8.222 8.196 0.026 1
1 977 . 11 1 1 A 97 97 GLY HA2 H 97 3.661 3.775 -0.114 1
1 978 . 11 1 1 A 97 97 GLY HA3 H 97 3.806 3.779 0.027 1
1 979 . 11 1 1 A 97 97 GLY C C 97 175.449 176.100 -0.651 1
1 980 . 11 1 1 A 97 97 GLY CA C 97 46.917 47.478 -0.561 1
1 981 . 11 1 1 A 97 97 GLY N N 97 107.315 107.069 0.246 1
1 982 . 11 1 1 A 98 98 ILE H H 98 7.630 8.933 -1.303 1
1 983 . 11 1 1 A 98 98 ILE HA H 98 3.399 4.038 -0.639 1
1 993 . 11 1 1 A 98 98 ILE C C 98 178.683 178.592 0.091 1
1 994 . 11 1 1 A 98 98 ILE CA C 98 66.402 64.847 1.555 1
1 995 . 11 1 1 A 98 98 ILE CB C 98 38.037 38.125 -0.088 1
1 999 . 11 1 1 A 98 98 ILE N N 98 120.644 123.032 -2.388 1
1 1000 . 11 1 1 A 99 99 LEU H H 99 7.076 8.003 -0.927 1
1 1001 . 11 1 1 A 99 99 LEU HA H 99 4.133 4.065 0.068 1
1 1010 . 11 1 1 A 99 99 LEU C C 99 178.128 178.099 0.029 1
1 1011 . 11 1 1 A 99 99 LEU CA C 99 57.129 57.899 -0.770 1
1 1012 . 11 1 1 A 99 99 LEU CB C 99 41.108 41.838 -0.730 1
1 1014 . 11 1 1 A 99 99 LEU N N 99 116.844 121.457 -4.613 1
1 1015 . 11 1 1 A 100 100 TYR H H 100 7.890 8.335 -0.445 1
1 1016 . 11 1 1 A 100 100 TYR HA H 100 4.550 4.219 0.331 1
1 1021 . 11 1 1 A 100 100 TYR C C 100 178.210 177.668 0.542 1
1 1022 . 11 1 1 A 100 100 TYR CA C 100 59.452 60.755 -1.303 1
1 1023 . 11 1 1 A 100 100 TYR CB C 100 38.786 38.832 -0.046 1
1 1024 . 11 1 1 A 100 100 TYR N N 100 116.427 120.093 -3.666 1
1 1025 . 11 1 1 A 101 101 LEU H H 101 8.041 8.438 -0.397 1
1 1026 . 11 1 1 A 101 101 LEU HA H 101 4.158 3.885 0.273 1
1 1036 . 11 1 1 A 101 101 LEU C C 101 176.808 177.661 -0.853 1
1 1037 . 11 1 1 A 101 101 LEU CA C 101 56.156 58.236 -2.080 1
1 1038 . 11 1 1 A 101 101 LEU CB C 101 44.307 41.848 2.459 1
1 1041 . 11 1 1 A 101 101 LEU N N 101 116.493 120.490 -3.997 1
1 1042 . 11 1 1 A 102 102 ASN H H 102 7.146 8.307 -1.161 1
1 1043 . 11 1 1 A 102 102 ASN HA H 102 5.056 5.118 -0.062 1
1 1046 . 11 1 1 A 102 102 ASN CA C 102 52.704 54.831 -2.127 1
1 1047 . 11 1 1 A 102 102 ASN CB C 102 42.424 40.475 1.949 1
1 1048 . 11 1 1 A 102 102 ASN N N 102 114.922 114.717 0.205 1
1 1049 . 11 1 1 A 103 103 GLN H H 103 8.477 8.167 0.310 1
1 1050 . 11 1 1 A 103 103 GLN HA H 103 3.866 4.299 -0.433 1
1 1054 . 11 1 1 A 103 103 GLN C C 103 176.110 176.053 0.057 1
1 1055 . 11 1 1 A 103 103 GLN CA C 103 58.451 55.859 2.592 1
1 1056 . 11 1 1 A 103 103 GLN CB C 103 28.896 29.255 -0.359 1
1 1058 . 11 1 1 A 103 103 GLN N N 103 120.252 115.515 4.737 1
1 1059 . 11 1 1 A 104 104 GLU H H 104 7.930 8.183 -0.253 1
1 1060 . 11 1 1 A 104 104 GLU HA H 104 4.591 4.278 0.313 1
1 1064 . 11 1 1 A 104 104 GLU C C 104 175.397 175.774 -0.377 1
1 1065 . 11 1 1 A 104 104 GLU CA C 104 54.058 57.320 -3.262 1
1 1066 . 11 1 1 A 104 104 GLU CB C 104 31.272 28.713 2.559 1
1 1068 . 11 1 1 A 104 104 GLU N N 104 117.295 119.467 -2.172 1
1 1069 . 11 1 1 A 105 105 VAL H H 105 8.546 8.503 0.043 1
1 1070 . 11 1 1 A 105 105 VAL HA H 105 3.823 3.797 0.026 1
1 1078 . 11 1 1 A 105 105 VAL CA C 105 60.706 63.017 -2.311 1
1 1079 . 11 1 1 A 105 105 VAL CB C 105 32.126 30.285 1.841 1
1 1082 . 11 1 1 A 105 105 VAL N N 105 124.511 124.617 -0.106 1
1 1083 . 11 1 1 A 106 106 PRO HA H 106 3.997 4.514 -0.517 1
1 1089 . 11 1 1 A 106 106 PRO C C 106 178.240 177.597 0.643 1
1 1090 . 11 1 1 A 106 106 PRO CA C 106 62.961 62.315 0.646 1
1 1091 . 11 1 1 A 106 106 PRO CB C 106 32.321 32.205 0.116 1
1 1094 . 11 1 1 A 107 107 LYS H H 107 9.122 9.036 0.086 1
1 1095 . 11 1 1 A 107 107 LYS HA H 107 3.813 3.963 -0.150 1
1 1101 . 11 1 1 A 107 107 LYS C C 107 178.563 177.740 0.823 1
1 1102 . 11 1 1 A 107 107 LYS CA C 107 60.085 59.603 0.482 1
1 1103 . 11 1 1 A 107 107 LYS CB C 107 31.632 32.090 -0.458 1
1 1106 . 11 1 1 A 107 107 LYS N N 107 129.017 123.543 5.474 1
1 1107 . 11 1 1 A 108 108 GLU H H 108 10.370 8.104 2.266 1
1 1108 . 11 1 1 A 108 108 GLU HA H 108 3.991 4.127 -0.136 1
1 1111 . 11 1 1 A 108 108 GLU C C 108 180.366 178.661 1.705 1
1 1112 . 11 1 1 A 108 108 GLU CA C 108 60.337 58.863 1.474 1
1 1113 . 11 1 1 A 108 108 GLU CB C 108 29.178 29.508 -0.330 1
1 1115 . 11 1 1 A 108 108 GLU N N 108 118.335 118.930 -0.595 1
1 1116 . 11 1 1 A 109 109 LEU H H 109 7.393 7.842 -0.449 1
1 1117 . 11 1 1 A 109 109 LEU HA H 109 4.220 4.175 0.045 1
1 1126 . 11 1 1 A 109 109 LEU C C 109 177.378 179.913 -2.535 1
1 1127 . 11 1 1 A 109 109 LEU CA C 109 56.618 57.356 -0.738 1
1 1128 . 11 1 1 A 109 109 LEU CB C 109 41.898 41.198 0.700 1
1 1131 . 11 1 1 A 109 109 LEU N N 109 118.285 120.043 -1.758 1
1 1132 . 11 1 1 A 110 110 LEU H H 110 7.641 8.039 -0.398 1
1 1133 . 11 1 1 A 110 110 LEU HA H 110 3.796 3.992 -0.196 1
1 1142 . 11 1 1 A 110 110 LEU C C 110 179.103 178.796 0.307 1
1 1143 . 11 1 1 A 110 110 LEU CA C 110 59.046 58.057 0.989 1
1 1144 . 11 1 1 A 110 110 LEU CB C 110 40.228 40.784 -0.556 1
1 1147 . 11 1 1 A 110 110 LEU N N 110 120.162 120.336 -0.174 1
1 1148 . 11 1 1 A 111 111 GLU H H 111 7.916 8.113 -0.197 1
1 1149 . 11 1 1 A 111 111 GLU HA H 111 4.080 4.111 -0.031 1
1 1153 . 11 1 1 A 111 111 GLU C C 111 179.967 178.953 1.014 1
1 1154 . 11 1 1 A 111 111 GLU CA C 111 59.243 58.972 0.271 1
1 1155 . 11 1 1 A 111 111 GLU CB C 111 29.576 29.087 0.489 1
1 1157 . 11 1 1 A 111 111 GLU N N 111 117.360 120.402 -3.042 1
1 1158 . 11 1 1 A 112 112 PHE H H 112 7.712 8.267 -0.555 1
1 1159 . 11 1 1 A 112 112 PHE HA H 112 4.224 4.219 0.005 1
1 1164 . 11 1 1 A 112 112 PHE C C 112 177.180 176.896 0.284 1
1 1165 . 11 1 1 A 112 112 PHE CA C 112 61.407 61.230 0.177 1
1 1166 . 11 1 1 A 112 112 PHE CB C 112 40.172 39.455 0.717 1
1 1167 . 11 1 1 A 112 112 PHE N N 112 123.042 120.921 2.121 1
1 1168 . 11 1 1 A 113 113 LEU H H 113 8.056 8.006 0.050 1
1 1169 . 11 1 1 A 113 113 LEU HA H 113 4.147 4.396 -0.249 1
1 1175 . 11 1 1 A 113 113 LEU C C 113 173.717 176.156 -2.439 1
1 1176 . 11 1 1 A 113 113 LEU CA C 113 54.093 54.373 -0.280 1
1 1177 . 11 1 1 A 113 113 LEU CB C 113 41.517 42.431 -0.914 1
1 1179 . 11 1 1 A 113 113 LEU N N 113 115.595 117.023 -1.428 1
1 1180 . 11 1 1 A 114 114 ARG H H 114 7.902 8.013 -0.111 1
1 1181 . 11 1 1 A 114 114 ARG HA H 114 3.817 4.544 -0.727 1
1 1182 . 11 1 1 A 114 114 ARG C C 114 174.566 176.264 -1.698 1
1 1183 . 11 1 1 A 114 114 ARG CA C 114 57.233 57.216 0.017 1
1 1184 . 11 1 1 A 114 114 ARG CB C 114 27.788 26.906 0.882 1
1 1185 . 11 1 1 A 114 114 ARG N N 114 116.021 115.601 0.420 1
1 1186 . 11 1 1 A 115 115 LEU H H 115 8.160 7.906 0.254 1
1 1187 . 11 1 1 A 115 115 LEU HA H 115 4.462 4.217 0.245 1
1 1195 . 11 1 1 A 115 115 LEU C C 115 176.374 177.075 -0.701 1
1 1196 . 11 1 1 A 115 115 LEU CA C 115 53.965 55.062 -1.097 1
1 1197 . 11 1 1 A 115 115 LEU CB C 115 44.077 41.060 3.017 1
1 1199 . 11 1 1 A 115 115 LEU N N 115 118.089 118.894 -0.805 1
1 1200 . 11 1 1 A 116 116 ARG H H 116 8.066 7.681 0.385 1
1 1201 . 11 1 1 A 116 116 ARG HA H 116 4.172 4.392 -0.220 1
1 1203 . 11 1 1 A 116 116 ARG CA C 116 55.961 56.863 -0.902 1
1 1204 . 11 1 1 A 116 116 ARG CB C 116 31.379 30.454 0.925 1
1 1205 . 11 1 1 A 116 116 ARG N N 116 120.852 120.237 0.615 1
1 1206 . 11 1 1 A 117 117 HIS H H 117 7.928 8.965 -1.037 1
1 1207 . 11 1 1 A 117 117 HIS HA H 117 4.557 4.312 0.245 1
1 1211 . 11 1 1 A 117 117 HIS CA C 117 55.937 56.989 -1.052 1
1 1212 . 11 1 1 A 117 117 HIS CB C 117 30.875 29.033 1.842 1
1 1213 . 11 1 1 A 118 118 PHE H H 118 8.183 7.877 0.306 1
1 1214 . 11 1 1 A 118 118 PHE HA H 118 4.730 4.845 -0.115 1
1 1219 . 11 1 1 A 118 118 PHE CA C 118 55.716 55.095 0.621 1
1 1220 . 11 1 1 A 118 118 PHE CB C 118 39.263 39.001 0.262 1
1 1221 . 11 1 1 A 118 118 PHE N N 118 123.480 120.083 3.397 1
1 1222 . 11 1 1 A 119 119 PRO HA H 119 4.398 4.634 -0.236 1
1 1227 . 11 1 1 A 119 119 PRO C C 119 176.666 176.656 0.010 1
1 1228 . 11 1 1 A 119 119 PRO CA C 119 63.377 64.549 -1.172 1
1 1229 . 11 1 1 A 119 119 PRO CB C 119 32.059 32.191 -0.132 1
1 1232 . 11 1 1 A 120 120 THR H H 120 8.054 7.476 0.578 1
1 1233 . 11 1 1 A 120 120 THR HA H 120 4.273 4.610 -0.337 1
1 1238 . 11 1 1 A 120 120 THR C C 120 174.154 171.363 2.791 1
1 1239 . 11 1 1 A 120 120 THR CA C 120 61.893 60.993 0.900 1
1 1240 . 11 1 1 A 120 120 THR CB C 120 69.736 71.012 -1.276 1
1 1242 . 11 1 1 A 120 120 THR N N 120 113.088 110.712 2.376 1
1 1243 . 11 1 1 A 121 121 ASP H H 121 8.209 9.096 -0.887 1
1 1244 . 11 1 1 A 121 121 ASP HA H 121 4.876 5.206 -0.330 1
1 1247 . 11 1 1 A 121 121 ASP CA C 121 52.126 50.391 1.735 1
1 1248 . 11 1 1 A 121 121 ASP CB C 121 41.553 42.336 -0.783 1
1 1249 . 11 1 1 A 121 121 ASP N N 121 123.630 127.210 -3.580 1
1 1250 . 11 1 1 A 122 122 PRO HA H 122 4.363 4.654 -0.291 1
1 1255 . 11 1 1 A 122 122 PRO C C 122 177.344 175.961 1.383 1
1 1256 . 11 1 1 A 122 122 PRO CA C 122 63.913 63.067 0.846 1
1 1257 . 11 1 1 A 122 122 PRO CB C 122 32.116 31.757 0.359 1
1 1260 . 11 1 1 A 123 123 LYS H H 123 8.344 8.685 -0.341 1
1 1261 . 11 1 1 A 123 123 LYS HA H 123 4.244 4.650 -0.406 1
1 1266 . 11 1 1 A 123 123 LYS C C 123 176.637 176.613 0.024 1
1 1267 . 11 1 1 A 123 123 LYS CA C 123 56.359 55.192 1.167 1
1 1268 . 11 1 1 A 123 123 LYS CB C 123 32.367 34.161 -1.794 1
1 1272 . 11 1 1 A 123 123 LYS N N 123 119.110 123.539 -4.429 1
1 1273 . 11 1 1 A 124 124 ALA H H 124 7.929 8.650 -0.721 1
1 1274 . 11 1 1 A 124 124 ALA HA H 124 4.248 4.465 -0.217 1
1 1278 . 11 1 1 A 124 124 ALA C C 124 177.648 176.113 1.535 1
1 1279 . 11 1 1 A 124 124 ALA CA C 124 52.618 52.272 0.346 1
1 1280 . 11 1 1 A 124 124 ALA CB C 124 19.379 19.544 -0.165 1
1 1281 . 11 1 1 A 124 124 ALA N N 124 123.825 127.389 -3.564 1
1 1282 . 11 1 1 A 125 125 SER H H 125 8.134 7.818 0.316 1
1 1283 . 11 1 1 A 125 125 SER HA H 125 4.341 5.138 -0.797 1
1 1286 . 11 1 1 A 125 125 SER C C 125 174.172 173.014 1.158 1
1 1287 . 11 1 1 A 125 125 SER CA C 125 58.391 57.405 0.986 1
1 1288 . 11 1 1 A 125 125 SER CB C 125 63.748 66.209 -2.461 1
1 1289 . 11 1 1 A 125 125 SER N N 125 114.454 115.478 -1.024 1
1 1290 . 11 1 1 A 126 126 ASN H H 126 8.242 8.979 -0.737 1
1 1291 . 11 1 1 A 126 126 ASN HA H 126 4.657 5.504 -0.847 1
1 1294 . 11 1 1 A 126 126 ASN C C 126 174.624 173.347 1.277 1
1 1295 . 11 1 1 A 126 126 ASN CA C 126 53.292 52.184 1.108 1
1 1296 . 11 1 1 A 126 126 ASN CB C 126 38.797 42.564 -3.767 1
1 1297 . 11 1 1 A 126 126 ASN N N 126 120.102 119.343 0.759 1
1 1298 . 11 1 1 A 127 127 TRP H H 127 8.051 8.757 -0.706 1
1 1299 . 11 1 1 A 127 127 TRP HA H 127 4.694 5.426 -0.732 1
1 1302 . 11 1 1 A 127 127 TRP C C 127 175.479 175.045 0.434 1
1 1303 . 11 1 1 A 127 127 TRP CA C 127 57.096 55.591 1.505 1
1 1304 . 11 1 1 A 127 127 TRP CB C 127 29.820 32.798 -2.978 1
1 1305 . 11 1 1 A 127 127 TRP N N 127 121.198 122.442 -1.244 1
1 1 . 12 1 1 A 7 7 HIS HA H 7 4.623 4.770 -0.147 1
1 4 . 12 1 1 A 7 7 HIS C C 7 174.747 174.354 0.393 1
1 5 . 12 1 1 A 7 7 HIS CA C 7 56.189 56.039 0.150 1
1 6 . 12 1 1 A 7 7 HIS CB C 7 30.028 32.411 -2.383 1
1 7 . 12 1 1 A 8 8 LEU H H 8 8.283 8.617 -0.334 1
1 8 . 12 1 1 A 8 8 LEU HA H 8 4.249 4.235 0.014 1
1 10 . 12 1 1 A 8 8 LEU C C 8 176.700 176.345 0.355 1
1 11 . 12 1 1 A 8 8 LEU CA C 8 55.498 56.320 -0.822 1
1 12 . 12 1 1 A 8 8 LEU CB C 8 42.568 42.667 -0.099 1
1 13 . 12 1 1 A 8 8 LEU N N 8 122.916 128.843 -5.927 1
1 14 . 12 1 1 A 9 9 GLU H H 9 8.623 7.974 0.649 1
1 15 . 12 1 1 A 9 9 GLU HA H 9 4.311 3.928 0.383 1
1 16 . 12 1 1 A 9 9 GLU C C 9 174.811 175.106 -0.295 1
1 17 . 12 1 1 A 9 9 GLU CA C 9 56.377 57.112 -0.735 1
1 18 . 12 1 1 A 9 9 GLU CB C 9 29.557 27.829 1.728 1
1 20 . 12 1 1 A 9 9 GLU N N 9 121.512 116.327 5.185 1
1 21 . 12 1 1 A 10 10 LEU H H 10 7.853 7.794 0.059 1
1 22 . 12 1 1 A 10 10 LEU HA H 10 5.225 5.189 0.036 1
1 31 . 12 1 1 A 10 10 LEU C C 10 174.637 175.234 -0.597 1
1 32 . 12 1 1 A 10 10 LEU CA C 10 54.513 53.754 0.759 1
1 33 . 12 1 1 A 10 10 LEU CB C 10 45.187 44.343 0.844 1
1 36 . 12 1 1 A 10 10 LEU N N 10 123.592 120.625 2.967 1
1 37 . 12 1 1 A 11 11 GLU H H 11 8.894 8.813 0.081 1
1 38 . 12 1 1 A 11 11 GLU HA H 11 4.765 5.098 -0.333 1
1 43 . 12 1 1 A 11 11 GLU C C 11 174.563 175.461 -0.898 1
1 44 . 12 1 1 A 11 11 GLU CA C 11 55.047 54.841 0.206 1
1 45 . 12 1 1 A 11 11 GLU CB C 11 33.760 32.080 1.680 1
1 47 . 12 1 1 A 11 11 GLU N N 11 124.055 123.714 0.341 1
1 48 . 12 1 1 A 12 12 VAL H H 12 8.607 8.966 -0.359 1
1 49 . 12 1 1 A 12 12 VAL HA H 12 5.174 4.988 0.186 1
1 57 . 12 1 1 A 12 12 VAL C C 12 173.573 175.309 -1.736 1
1 58 . 12 1 1 A 12 12 VAL CA C 12 60.296 61.049 -0.753 1
1 59 . 12 1 1 A 12 12 VAL CB C 12 35.689 33.333 2.356 1
1 62 . 12 1 1 A 12 12 VAL N N 12 120.878 125.176 -4.298 1
1 63 . 12 1 1 A 13 13 HIS H H 13 8.982 8.763 0.219 1
1 64 . 12 1 1 A 13 13 HIS HA H 13 4.824 5.124 -0.300 1
1 69 . 12 1 1 A 13 13 HIS C C 13 173.236 171.762 1.474 1
1 70 . 12 1 1 A 13 13 HIS CA C 13 54.906 54.051 0.855 1
1 71 . 12 1 1 A 13 13 HIS CB C 13 33.496 32.262 1.234 1
1 72 . 12 1 1 A 13 13 HIS N N 13 121.504 121.620 -0.116 1
1 73 . 12 1 1 A 14 14 ILE H H 14 10.442 9.586 0.856 1
1 74 . 12 1 1 A 14 14 ILE HA H 14 5.458 5.069 0.389 1
1 84 . 12 1 1 A 14 14 ILE CA C 14 58.386 58.000 0.386 1
1 85 . 12 1 1 A 14 14 ILE CB C 14 38.596 38.063 0.533 1
1 88 . 12 1 1 A 14 14 ILE N N 14 119.923 121.693 -1.770 1
1 89 . 12 1 1 A 15 15 PRO HA H 15 4.560 4.503 0.057 1
1 95 . 12 1 1 A 15 15 PRO C C 15 176.907 176.521 0.386 1
1 96 . 12 1 1 A 15 15 PRO CA C 15 64.342 64.489 -0.147 1
1 97 . 12 1 1 A 15 15 PRO CB C 15 32.924 32.388 0.536 1
1 100 . 12 1 1 A 16 16 SER H H 16 7.331 7.748 -0.417 1
1 101 . 12 1 1 A 16 16 SER HA H 16 4.822 4.851 -0.029 1
1 104 . 12 1 1 A 16 16 SER C C 16 171.253 172.235 -0.982 1
1 105 . 12 1 1 A 16 16 SER CA C 16 57.135 57.555 -0.420 1
1 106 . 12 1 1 A 16 16 SER CB C 16 65.947 67.117 -1.170 1
1 107 . 12 1 1 A 16 16 SER N N 16 107.745 113.537 -5.792 1
1 108 . 12 1 1 A 17 17 VAL H H 17 8.350 8.334 0.016 1
1 109 . 12 1 1 A 17 17 VAL HA H 17 4.926 5.069 -0.143 1
1 117 . 12 1 1 A 17 17 VAL C C 17 173.692 174.641 -0.949 1
1 118 . 12 1 1 A 17 17 VAL CA C 17 58.721 60.813 -2.092 1
1 119 . 12 1 1 A 17 17 VAL CB C 17 34.420 34.947 -0.527 1
1 122 . 12 1 1 A 17 17 VAL N N 17 118.680 121.879 -3.199 1
1 123 . 12 1 1 A 18 18 GLY H H 18 8.332 9.303 -0.971 1
1 124 . 12 1 1 A 18 18 GLY HA2 H 18 4.189 4.361 -0.172 1
1 125 . 12 1 1 A 18 18 GLY HA3 H 18 4.011 4.361 -0.350 1
1 126 . 12 1 1 A 18 18 GLY CA C 18 45.356 43.987 1.369 1
1 127 . 12 1 1 A 18 18 GLY N N 18 112.549 114.897 -2.348 1
1 128 . 12 1 1 A 19 19 PRO HA H 19 4.757 5.076 -0.319 1
1 134 . 12 1 1 A 19 19 PRO C C 19 177.482 176.558 0.924 1
1 135 . 12 1 1 A 19 19 PRO CA C 19 62.848 62.176 0.672 1
1 136 . 12 1 1 A 19 19 PRO CB C 19 32.283 29.719 2.564 1
1 139 . 12 1 1 A 20 20 GLU H H 20 8.588 8.188 0.400 1
1 140 . 12 1 1 A 20 20 GLU HA H 20 4.147 4.665 -0.518 1
1 144 . 12 1 1 A 20 20 GLU C C 20 175.857 176.359 -0.502 1
1 145 . 12 1 1 A 20 20 GLU CA C 20 57.150 55.800 1.350 1
1 146 . 12 1 1 A 20 20 GLU CB C 20 30.923 30.904 0.019 1
1 148 . 12 1 1 A 20 20 GLU N N 20 122.087 118.474 3.613 1
1 149 . 12 1 1 A 21 21 ALA H H 21 8.352 7.380 0.972 1
1 150 . 12 1 1 A 21 21 ALA HA H 21 4.391 4.535 -0.144 1
1 154 . 12 1 1 A 21 21 ALA C C 21 174.910 177.141 -2.231 1
1 155 . 12 1 1 A 21 21 ALA CA C 21 52.166 50.706 1.460 1
1 156 . 12 1 1 A 21 21 ALA CB C 21 19.915 21.515 -1.600 1
1 157 . 12 1 1 A 21 21 ALA N N 21 124.593 122.780 1.813 1
1 158 . 12 1 1 A 22 22 GLU H H 22 8.398 8.616 -0.218 1
1 159 . 12 1 1 A 22 22 GLU HA H 22 4.331 4.559 -0.228 1
1 163 . 12 1 1 A 22 22 GLU C C 22 176.389 176.744 -0.355 1
1 164 . 12 1 1 A 22 22 GLU CA C 22 56.316 57.145 -0.829 1
1 165 . 12 1 1 A 22 22 GLU CB C 22 30.713 30.016 0.697 1
1 167 . 12 1 1 A 22 22 GLU N N 22 120.159 120.489 -0.330 1
1 168 . 12 1 1 A 23 23 GLY H H 23 8.246 8.220 0.026 1
1 169 . 12 1 1 A 23 23 GLY HA2 H 23 4.162 4.210 -0.048 1
1 170 . 12 1 1 A 23 23 GLY HA3 H 23 4.061 4.232 -0.171 1
1 171 . 12 1 1 A 23 23 GLY CA C 23 44.801 45.770 -0.969 1
1 172 . 12 1 1 A 23 23 GLY N N 23 110.080 111.001 -0.921 1
1 173 . 12 1 1 A 24 24 PRO HA H 24 4.417 4.490 -0.073 1
1 178 . 12 1 1 A 24 24 PRO C C 24 177.135 176.354 0.781 1
1 179 . 12 1 1 A 24 24 PRO CA C 24 63.520 64.956 -1.436 1
1 180 . 12 1 1 A 24 24 PRO CB C 24 32.124 32.255 -0.131 1
1 183 . 12 1 1 A 25 25 ARG H H 25 8.409 7.473 0.936 1
1 184 . 12 1 1 A 25 25 ARG HA H 25 4.298 4.861 -0.563 1
1 187 . 12 1 1 A 25 25 ARG C C 25 176.217 175.023 1.194 1
1 188 . 12 1 1 A 25 25 ARG CA C 25 56.237 54.665 1.572 1
1 189 . 12 1 1 A 25 25 ARG CB C 25 30.467 32.268 -1.801 1
1 192 . 12 1 1 A 25 25 ARG N N 25 120.147 113.136 7.011 1
1 193 . 12 1 1 A 26 26 GLN H H 26 8.278 8.462 -0.184 1
1 194 . 12 1 1 A 26 26 GLN HA H 26 4.336 4.572 -0.236 1
1 200 . 12 1 1 A 26 26 GLN C C 26 175.566 175.537 0.029 1
1 201 . 12 1 1 A 26 26 GLN CA C 26 55.788 55.632 0.156 1
1 202 . 12 1 1 A 26 26 GLN CB C 26 29.714 28.544 1.170 1
1 204 . 12 1 1 A 26 26 GLN N N 26 120.460 119.705 0.755 1
1 206 . 12 1 1 A 27 27 SER H H 27 8.298 8.204 0.094 1
1 208 . 12 1 1 A 27 27 SER CA C 27 56.156 55.515 0.641 1
1 209 . 12 1 1 A 27 27 SER CB C 27 63.813 64.900 -1.087 1
1 210 . 12 1 1 A 27 27 SER N N 27 117.382 121.114 -3.732 1
1 211 . 12 1 1 A 28 28 PRO HA H 28 4.366 4.754 -0.388 1
1 216 . 12 1 1 A 28 28 PRO C C 28 177.555 177.728 -0.173 1
1 217 . 12 1 1 A 28 28 PRO CA C 28 64.486 64.586 -0.100 1
1 218 . 12 1 1 A 28 28 PRO CB C 28 31.892 31.962 -0.070 1
1 221 . 12 1 1 A 29 29 GLU H H 29 8.582 8.656 -0.074 1
1 222 . 12 1 1 A 29 29 GLU HA H 29 4.218 4.251 -0.033 1
1 226 . 12 1 1 A 29 29 GLU CA C 29 57.261 58.559 -1.298 1
1 227 . 12 1 1 A 29 29 GLU CB C 29 29.633 29.841 -0.208 1
1 229 . 12 1 1 A 29 29 GLU N N 29 118.309 115.407 2.902 1
1 230 . 12 1 1 A 30 30 LYS H H 30 7.955 7.831 0.124 1
1 231 . 12 1 1 A 30 30 LYS HA H 30 4.328 4.582 -0.254 1
1 236 . 12 1 1 A 30 30 LYS C C 30 176.222 174.565 1.657 1
1 237 . 12 1 1 A 30 30 LYS CA C 30 56.247 54.941 1.306 1
1 238 . 12 1 1 A 30 30 LYS CB C 30 32.720 34.339 -1.619 1
1 242 . 12 1 1 A 30 30 LYS N N 30 120.129 118.694 1.435 1
1 243 . 12 1 1 A 31 31 SER H H 31 7.883 8.727 -0.844 1
1 244 . 12 1 1 A 31 31 SER HA H 31 4.458 5.000 -0.542 1
1 246 . 12 1 1 A 31 31 SER C C 31 174.129 175.723 -1.594 1
1 247 . 12 1 1 A 31 31 SER CA C 31 58.477 56.033 2.444 1
1 248 . 12 1 1 A 31 31 SER CB C 31 64.042 64.257 -0.215 1
1 249 . 12 1 1 A 31 31 SER N N 31 115.366 119.250 -3.884 1
1 250 . 12 1 1 A 32 32 HIS H H 32 8.485 8.315 0.170 1
1 251 . 12 1 1 A 32 32 HIS HA H 32 4.450 4.739 -0.289 1
1 255 . 12 1 1 A 32 32 HIS CA C 32 56.009 56.413 -0.404 1
1 256 . 12 1 1 A 32 32 HIS CB C 32 31.122 30.058 1.064 1
1 257 . 12 1 1 A 32 32 HIS N N 32 121.500 122.811 -1.311 1
1 258 . 12 1 1 A 33 33 MET H H 33 8.392 7.552 0.840 1
1 259 . 12 1 1 A 33 33 MET HA H 33 4.601 5.212 -0.611 1
1 265 . 12 1 1 A 33 33 MET C C 33 175.842 174.465 1.377 1
1 266 . 12 1 1 A 33 33 MET CA C 33 54.533 53.941 0.592 1
1 267 . 12 1 1 A 33 33 MET CB C 33 32.868 35.943 -3.075 1
1 270 . 12 1 1 A 33 33 MET N N 33 120.204 119.046 1.158 1
1 271 . 12 1 1 A 34 34 VAL H H 34 8.938 9.472 -0.534 1
1 272 . 12 1 1 A 34 34 VAL HA H 34 4.430 4.795 -0.365 1
1 280 . 12 1 1 A 34 34 VAL C C 34 174.149 174.964 -0.815 1
1 281 . 12 1 1 A 34 34 VAL CA C 34 60.703 59.430 1.273 1
1 282 . 12 1 1 A 34 34 VAL CB C 34 34.319 34.622 -0.303 1
1 285 . 12 1 1 A 34 34 VAL N N 34 118.512 122.096 -3.584 1
1 286 . 12 1 1 A 35 35 PHE H H 35 9.242 8.237 1.005 1
1 287 . 12 1 1 A 35 35 PHE HA H 35 4.439 5.449 -1.010 1
1 294 . 12 1 1 A 35 35 PHE C C 35 174.831 174.270 0.561 1
1 295 . 12 1 1 A 35 35 PHE CA C 35 57.754 55.091 2.663 1
1 296 . 12 1 1 A 35 35 PHE CB C 35 38.959 42.155 -3.196 1
1 297 . 12 1 1 A 35 35 PHE N N 35 124.912 125.962 -1.050 1
1 298 . 12 1 1 A 36 36 ARG H H 36 8.475 8.841 -0.366 1
1 299 . 12 1 1 A 36 36 ARG HA H 36 4.135 4.733 -0.598 1
1 304 . 12 1 1 A 36 36 ARG C C 36 172.865 175.490 -2.625 1
1 305 . 12 1 1 A 36 36 ARG CA C 36 56.895 55.374 1.521 1
1 306 . 12 1 1 A 36 36 ARG CB C 36 28.962 30.692 -1.730 1
1 308 . 12 1 1 A 36 36 ARG N N 36 125.680 120.596 5.084 1
1 309 . 12 1 1 A 37 37 VAL H H 37 8.066 9.065 -0.999 1
1 310 . 12 1 1 A 37 37 VAL HA H 37 4.292 4.522 -0.230 1
1 318 . 12 1 1 A 37 37 VAL C C 37 174.595 174.501 0.094 1
1 319 . 12 1 1 A 37 37 VAL CA C 37 62.727 61.466 1.261 1
1 320 . 12 1 1 A 37 37 VAL CB C 37 31.102 32.811 -1.709 1
1 323 . 12 1 1 A 37 37 VAL N N 37 125.403 120.872 4.531 1
1 324 . 12 1 1 A 38 38 GLU H H 38 9.532 9.211 0.321 1
1 325 . 12 1 1 A 38 38 GLU HA H 38 4.895 5.284 -0.389 1
1 329 . 12 1 1 A 38 38 GLU C C 38 174.509 174.786 -0.277 1
1 330 . 12 1 1 A 38 38 GLU CA C 38 55.650 54.787 0.863 1
1 331 . 12 1 1 A 38 38 GLU CB C 38 32.214 30.903 1.311 1
1 333 . 12 1 1 A 38 38 GLU N N 38 129.885 127.051 2.834 1
1 334 . 12 1 1 A 39 39 VAL H H 39 9.035 8.939 0.096 1
1 335 . 12 1 1 A 39 39 VAL HA H 39 4.446 4.715 -0.269 1
1 343 . 12 1 1 A 39 39 VAL C C 39 173.661 173.919 -0.258 1
1 344 . 12 1 1 A 39 39 VAL CA C 39 61.258 61.459 -0.201 1
1 345 . 12 1 1 A 39 39 VAL CB C 39 33.533 33.318 0.215 1
1 348 . 12 1 1 A 39 39 VAL N N 39 127.941 126.908 1.033 1
1 349 . 12 1 1 A 40 40 LEU H H 40 8.843 9.222 -0.379 1
1 350 . 12 1 1 A 40 40 LEU HA H 40 5.130 5.148 -0.018 1
1 360 . 12 1 1 A 40 40 LEU C C 40 175.581 174.901 0.680 1
1 361 . 12 1 1 A 40 40 LEU CA C 40 53.702 53.553 0.149 1
1 362 . 12 1 1 A 40 40 LEU CB C 40 43.989 44.242 -0.253 1
1 366 . 12 1 1 A 40 40 LEU N N 40 128.413 129.609 -1.196 1
1 367 . 12 1 1 A 41 41 CYS H H 41 8.959 9.022 -0.063 1
1 368 . 12 1 1 A 41 41 CYS HA H 41 5.174 5.088 0.086 1
1 371 . 12 1 1 A 41 41 CYS C C 41 175.043 173.438 1.605 1
1 372 . 12 1 1 A 41 41 CYS CA C 41 57.483 58.439 -0.956 1
1 373 . 12 1 1 A 41 41 CYS CB C 41 28.472 30.332 -1.860 1
1 374 . 12 1 1 A 41 41 CYS N N 41 124.738 124.688 0.050 1
1 375 . 12 1 1 A 42 42 SER H H 42 9.527 9.113 0.414 1
1 376 . 12 1 1 A 42 42 SER HA H 42 4.149 4.021 0.128 1
1 379 . 12 1 1 A 42 42 SER C C 42 175.014 174.399 0.615 1
1 380 . 12 1 1 A 42 42 SER CA C 42 59.058 59.615 -0.557 1
1 381 . 12 1 1 A 42 42 SER CB C 42 62.287 61.730 0.557 1
1 382 . 12 1 1 A 42 42 SER N N 42 125.889 122.910 2.979 1
1 383 . 12 1 1 A 43 43 GLY H H 43 8.685 8.313 0.372 1
1 384 . 12 1 1 A 43 43 GLY HA2 H 43 3.594 4.022 -0.428 1
1 385 . 12 1 1 A 43 43 GLY HA3 H 43 4.210 4.035 0.175 1
1 386 . 12 1 1 A 43 43 GLY C C 43 173.664 174.299 -0.635 1
1 387 . 12 1 1 A 43 43 GLY CA C 43 45.404 45.127 0.277 1
1 388 . 12 1 1 A 43 43 GLY N N 43 104.633 106.196 -1.563 1
1 389 . 12 1 1 A 44 44 ARG H H 44 7.926 7.434 0.492 1
1 390 . 12 1 1 A 44 44 ARG HA H 44 4.678 4.691 -0.013 1
1 395 . 12 1 1 A 44 44 ARG C C 44 175.261 174.883 0.378 1
1 396 . 12 1 1 A 44 44 ARG CA C 44 55.011 54.433 0.578 1
1 397 . 12 1 1 A 44 44 ARG CB C 44 32.138 32.308 -0.170 1
1 400 . 12 1 1 A 44 44 ARG N N 44 121.239 120.418 0.821 1
1 401 . 12 1 1 A 45 45 ARG H H 45 8.775 9.042 -0.267 1
1 402 . 12 1 1 A 45 45 ARG HA H 45 5.770 5.184 0.586 1
1 409 . 12 1 1 A 45 45 ARG C C 45 176.064 174.918 1.146 1
1 410 . 12 1 1 A 45 45 ARG CA C 45 54.683 54.088 0.595 1
1 411 . 12 1 1 A 45 45 ARG CB C 45 33.748 34.174 -0.426 1
1 414 . 12 1 1 A 45 45 ARG N N 45 125.948 118.895 7.053 1
1 415 . 12 1 1 A 46 46 HIS H H 46 8.912 8.602 0.310 1
1 416 . 12 1 1 A 46 46 HIS HA H 46 4.927 6.063 -1.136 1
1 420 . 12 1 1 A 46 46 HIS C C 46 172.634 173.043 -0.409 1
1 421 . 12 1 1 A 46 46 HIS CA C 46 56.480 53.699 2.781 1
1 422 . 12 1 1 A 46 46 HIS CB C 46 33.608 32.888 0.720 1
1 423 . 12 1 1 A 46 46 HIS N N 46 121.825 116.872 4.953 1
1 424 . 12 1 1 A 47 47 THR H H 47 8.532 9.069 -0.537 1
1 425 . 12 1 1 A 47 47 THR HA H 47 5.472 4.559 0.913 1
1 430 . 12 1 1 A 47 47 THR C C 47 174.442 174.103 0.339 1
1 431 . 12 1 1 A 47 47 THR CA C 47 61.093 62.720 -1.627 1
1 432 . 12 1 1 A 47 47 THR CB C 47 71.041 69.244 1.797 1
1 434 . 12 1 1 A 47 47 THR N N 47 115.450 119.763 -4.313 1
1 435 . 12 1 1 A 48 48 VAL H H 48 9.695 9.267 0.428 1
1 436 . 12 1 1 A 48 48 VAL HA H 48 4.677 4.518 0.159 1
1 444 . 12 1 1 A 48 48 VAL CA C 48 58.172 59.365 -1.193 1
1 445 . 12 1 1 A 48 48 VAL CB C 48 34.990 33.238 1.752 1
1 448 . 12 1 1 A 48 48 VAL N N 48 126.721 127.209 -0.488 1
1 449 . 12 1 1 A 49 49 PRO HA H 49 5.087 5.198 -0.111 1
1 453 . 12 1 1 A 49 49 PRO CA C 49 61.671 62.494 -0.823 1
1 454 . 12 1 1 A 49 49 PRO CB C 49 31.923 31.752 0.171 1
1 457 . 12 1 1 A 50 50 ARG H H 50 9.125 9.222 -0.097 1
1 458 . 12 1 1 A 50 50 ARG HA H 50 4.974 4.660 0.314 1
1 464 . 12 1 1 A 50 50 ARG C C 50 176.187 173.946 2.241 1
1 465 . 12 1 1 A 50 50 ARG CA C 50 53.015 54.741 -1.726 1
1 466 . 12 1 1 A 50 50 ARG CB C 50 36.553 33.719 2.834 1
1 468 . 12 1 1 A 50 50 ARG N N 50 124.189 124.080 0.109 1
1 469 . 12 1 1 A 51 51 ARG H H 51 10.105 8.628 1.477 1
1 470 . 12 1 1 A 51 51 ARG HA H 51 5.196 3.844 1.352 1
1 475 . 12 1 1 A 51 51 ARG C C 51 178.865 177.673 1.192 1
1 476 . 12 1 1 A 51 51 ARG CA C 51 55.961 54.228 1.733 1
1 477 . 12 1 1 A 51 51 ARG CB C 51 32.539 31.120 1.419 1
1 480 . 12 1 1 A 51 51 ARG N N 51 124.521 122.589 1.932 1
1 481 . 12 1 1 A 52 52 TYR H H 52 10.397 8.559 1.838 1
1 482 . 12 1 1 A 52 52 TYR HA H 52 4.360 4.610 -0.250 1
1 487 . 12 1 1 A 52 52 TYR C C 52 178.143 177.769 0.374 1
1 488 . 12 1 1 A 52 52 TYR CA C 52 63.538 60.609 2.929 1
1 489 . 12 1 1 A 52 52 TYR CB C 52 38.784 37.912 0.872 1
1 490 . 12 1 1 A 52 52 TYR N N 52 124.772 119.742 5.030 1
1 491 . 12 1 1 A 53 53 SER H H 53 9.231 7.976 1.255 1
1 492 . 12 1 1 A 53 53 SER HA H 53 4.175 4.184 -0.009 1
1 493 . 12 1 1 A 53 53 SER C C 53 177.220 177.351 -0.131 1
1 494 . 12 1 1 A 53 53 SER CA C 53 61.606 61.711 -0.105 1
1 495 . 12 1 1 A 53 53 SER N N 53 113.262 116.672 -3.410 1
1 496 . 12 1 1 A 54 54 GLU H H 54 7.807 7.499 0.308 1
1 497 . 12 1 1 A 54 54 GLU HA H 54 4.392 4.104 0.288 1
1 501 . 12 1 1 A 54 54 GLU C C 54 180.361 178.782 1.579 1
1 502 . 12 1 1 A 54 54 GLU CA C 54 59.497 58.923 0.574 1
1 503 . 12 1 1 A 54 54 GLU CB C 54 30.708 29.375 1.333 1
1 504 . 12 1 1 A 54 54 GLU N N 54 121.949 121.617 0.332 1
1 505 . 12 1 1 A 55 55 PHE H H 55 8.133 8.024 0.109 1
1 506 . 12 1 1 A 55 55 PHE HA H 55 4.007 4.229 -0.222 1
1 513 . 12 1 1 A 55 55 PHE C C 55 176.531 177.479 -0.948 1
1 514 . 12 1 1 A 55 55 PHE CA C 55 61.848 61.473 0.375 1
1 515 . 12 1 1 A 55 55 PHE CB C 55 38.847 38.969 -0.122 1
1 516 . 12 1 1 A 55 55 PHE N N 55 119.998 121.289 -1.291 1
1 517 . 12 1 1 A 56 56 HIS H H 56 7.907 8.453 -0.546 1
1 518 . 12 1 1 A 56 56 HIS HA H 56 3.324 4.116 -0.792 1
1 522 . 12 1 1 A 56 56 HIS C C 56 176.748 177.609 -0.861 1
1 523 . 12 1 1 A 56 56 HIS CA C 56 58.770 59.824 -1.054 1
1 524 . 12 1 1 A 56 56 HIS CB C 56 30.404 29.405 0.999 1
1 525 . 12 1 1 A 56 56 HIS N N 56 119.173 118.381 0.792 1
1 526 . 12 1 1 A 57 57 ALA H H 57 7.962 7.895 0.067 1
1 527 . 12 1 1 A 57 57 ALA HA H 57 3.865 3.887 -0.022 1
1 531 . 12 1 1 A 57 57 ALA C C 57 180.075 179.510 0.565 1
1 532 . 12 1 1 A 57 57 ALA CA C 57 54.996 55.110 -0.114 1
1 533 . 12 1 1 A 57 57 ALA CB C 57 18.226 18.656 -0.430 1
1 534 . 12 1 1 A 57 57 ALA N N 57 120.094 121.027 -0.933 1
1 535 . 12 1 1 A 58 58 LEU H H 58 7.295 7.610 -0.315 1
1 536 . 12 1 1 A 58 58 LEU HA H 58 3.994 3.846 0.148 1
1 546 . 12 1 1 A 58 58 LEU C C 58 177.428 178.537 -1.109 1
1 547 . 12 1 1 A 58 58 LEU CA C 58 58.342 57.770 0.572 1
1 548 . 12 1 1 A 58 58 LEU CB C 58 40.851 41.056 -0.205 1
1 552 . 12 1 1 A 58 58 LEU N N 58 119.404 117.410 1.994 1
1 553 . 12 1 1 A 59 59 HIS H H 59 7.805 8.109 -0.304 1
1 554 . 12 1 1 A 59 59 HIS HA H 59 4.286 3.730 0.556 1
1 558 . 12 1 1 A 59 59 HIS C C 59 177.001 177.212 -0.211 1
1 559 . 12 1 1 A 59 59 HIS CA C 59 60.141 59.844 0.297 1
1 560 . 12 1 1 A 59 59 HIS CB C 59 31.072 29.157 1.915 1
1 561 . 12 1 1 A 59 59 HIS N N 59 119.040 120.013 -0.973 1
1 562 . 12 1 1 A 60 60 LYS H H 60 7.715 7.818 -0.103 1
1 563 . 12 1 1 A 60 60 LYS HA H 60 3.456 3.556 -0.100 1
1 570 . 12 1 1 A 60 60 LYS C C 60 178.464 178.499 -0.035 1
1 571 . 12 1 1 A 60 60 LYS CA C 60 59.629 58.536 1.093 1
1 572 . 12 1 1 A 60 60 LYS CB C 60 32.354 31.567 0.787 1
1 576 . 12 1 1 A 60 60 LYS N N 60 114.225 117.563 -3.338 1
1 577 . 12 1 1 A 61 61 ARG H H 61 7.486 7.478 0.008 1
1 578 . 12 1 1 A 61 61 ARG HA H 61 4.202 3.934 0.268 1
1 584 . 12 1 1 A 61 61 ARG C C 61 178.995 178.989 0.006 1
1 585 . 12 1 1 A 61 61 ARG CA C 61 58.387 58.717 -0.330 1
1 586 . 12 1 1 A 61 61 ARG CB C 61 31.216 29.946 1.270 1
1 589 . 12 1 1 A 61 61 ARG N N 61 115.929 119.141 -3.212 1
1 590 . 12 1 1 A 62 62 ILE H H 62 8.066 8.114 -0.048 1
1 591 . 12 1 1 A 62 62 ILE HA H 62 4.491 3.814 0.677 1
1 601 . 12 1 1 A 62 62 ILE C C 62 177.838 176.968 0.870 1
1 602 . 12 1 1 A 62 62 ILE CA C 62 63.399 63.779 -0.380 1
1 603 . 12 1 1 A 62 62 ILE CB C 62 39.699 37.266 2.433 1
1 606 . 12 1 1 A 62 62 ILE N N 62 111.456 117.906 -6.450 1
1 607 . 12 1 1 A 63 63 LYS H H 63 8.158 8.194 -0.036 1
1 608 . 12 1 1 A 63 63 LYS HA H 63 4.136 3.753 0.383 1
1 615 . 12 1 1 A 63 63 LYS C C 63 176.358 178.067 -1.709 1
1 616 . 12 1 1 A 63 63 LYS CA C 63 58.753 58.669 0.084 1
1 617 . 12 1 1 A 63 63 LYS CB C 63 30.825 31.746 -0.921 1
1 621 . 12 1 1 A 63 63 LYS N N 63 120.800 123.185 -2.385 1
1 622 . 12 1 1 A 64 64 LYS H H 64 7.687 7.399 0.288 1
1 623 . 12 1 1 A 64 64 LYS HA H 64 4.301 4.082 0.219 1
1 628 . 12 1 1 A 64 64 LYS C C 64 177.084 178.237 -1.153 1
1 629 . 12 1 1 A 64 64 LYS CA C 64 57.237 58.243 -1.006 1
1 630 . 12 1 1 A 64 64 LYS CB C 64 32.502 32.311 0.191 1
1 634 . 12 1 1 A 64 64 LYS N N 64 116.548 119.518 -2.970 1
1 635 . 12 1 1 A 65 65 LEU H H 65 7.476 7.994 -0.518 1
1 636 . 12 1 1 A 65 65 LEU HA H 65 4.219 4.328 -0.109 1
1 645 . 12 1 1 A 65 65 LEU C C 65 175.886 175.983 -0.097 1
1 646 . 12 1 1 A 65 65 LEU CA C 65 55.542 56.808 -1.266 1
1 647 . 12 1 1 A 65 65 LEU CB C 65 45.493 43.350 2.143 1
1 650 . 12 1 1 A 65 65 LEU N N 65 118.000 120.477 -2.477 1
1 651 . 12 1 1 A 66 66 TYR H H 66 7.672 7.963 -0.291 1
1 652 . 12 1 1 A 66 66 TYR HA H 66 4.762 5.215 -0.453 1
1 660 . 12 1 1 A 66 66 TYR C C 66 174.199 174.776 -0.577 1
1 661 . 12 1 1 A 66 66 TYR CA C 66 56.013 55.436 0.577 1
1 662 . 12 1 1 A 66 66 TYR CB C 66 40.380 41.172 -0.792 1
1 663 . 12 1 1 A 66 66 TYR N N 66 116.805 114.294 2.511 1
1 664 . 12 1 1 A 67 67 LYS H H 67 8.547 8.555 -0.008 1
1 665 . 12 1 1 A 67 67 LYS HA H 67 4.436 4.519 -0.083 1
1 670 . 12 1 1 A 67 67 LYS C C 67 175.727 175.717 0.010 1
1 671 . 12 1 1 A 67 67 LYS CA C 67 56.598 56.631 -0.033 1
1 672 . 12 1 1 A 67 67 LYS CB C 67 32.743 32.816 -0.073 1
1 676 . 12 1 1 A 67 67 LYS N N 67 120.929 120.027 0.902 1
1 677 . 12 1 1 A 68 68 VAL H H 68 8.168 8.378 -0.210 1
1 678 . 12 1 1 A 68 68 VAL HA H 68 4.869 4.624 0.245 1
1 686 . 12 1 1 A 68 68 VAL CA C 68 57.389 59.096 -1.707 1
1 687 . 12 1 1 A 68 68 VAL CB C 68 34.017 34.897 -0.880 1
1 690 . 12 1 1 A 68 68 VAL N N 68 116.467 123.965 -7.498 1
1 691 . 12 1 1 A 69 69 PRO HA H 69 4.674 4.797 -0.123 1
1 696 . 12 1 1 A 69 69 PRO C C 69 178.013 176.148 1.865 1
1 697 . 12 1 1 A 69 69 PRO CA C 69 61.443 62.384 -0.941 1
1 698 . 12 1 1 A 69 69 PRO CB C 69 32.231 33.097 -0.866 1
1 701 . 12 1 1 A 70 70 ASP H H 70 8.167 8.660 -0.493 1
1 702 . 12 1 1 A 70 70 ASP HA H 70 4.531 4.910 -0.379 1
1 705 . 12 1 1 A 70 70 ASP C C 70 175.660 176.574 -0.914 1
1 706 . 12 1 1 A 70 70 ASP CA C 70 55.148 54.864 0.284 1
1 707 . 12 1 1 A 70 70 ASP CB C 70 40.876 41.122 -0.246 1
1 708 . 12 1 1 A 70 70 ASP N N 70 116.671 121.454 -4.783 1
1 709 . 12 1 1 A 71 71 PHE H H 71 8.387 8.692 -0.305 1
1 710 . 12 1 1 A 71 71 PHE HA H 71 4.076 4.660 -0.584 1
1 717 . 12 1 1 A 71 71 PHE CA C 71 55.672 54.455 1.217 1
1 718 . 12 1 1 A 71 71 PHE CB C 71 39.155 41.474 -2.319 1
1 719 . 12 1 1 A 71 71 PHE N N 71 126.533 119.071 7.462 1
1 720 . 12 1 1 A 72 72 PRO HA H 72 4.156 4.375 -0.219 1
1 727 . 12 1 1 A 72 72 PRO CA C 72 63.079 62.997 0.082 1
1 728 . 12 1 1 A 72 72 PRO CB C 72 32.107 31.994 0.113 1
1 731 . 12 1 1 A 73 73 SER H H 73 8.468 8.443 0.025 1
1 733 . 12 1 1 A 73 73 SER CA C 73 56.133 57.800 -1.667 1
1 734 . 12 1 1 A 73 73 SER CB C 73 63.991 64.161 -0.170 1
1 735 . 12 1 1 A 73 73 SER N N 73 121.533 117.479 4.054 1
1 736 . 12 1 1 A 74 74 LYS HA H 74 4.574 4.024 0.550 1
1 739 . 12 1 1 A 74 74 LYS CA C 74 55.659 58.817 -3.158 1
1 740 . 12 1 1 A 74 74 LYS CB C 74 30.550 31.997 -1.447 1
1 741 . 12 1 1 A 75 75 ARG H H 75 7.962 7.579 0.383 1
1 742 . 12 1 1 A 75 75 ARG HA H 75 4.162 4.418 -0.256 1
1 746 . 12 1 1 A 75 75 ARG CA C 75 56.123 55.953 0.170 1
1 747 . 12 1 1 A 75 75 ARG CB C 75 31.179 31.046 0.133 1
1 749 . 12 1 1 A 75 75 ARG N N 75 121.665 121.612 0.053 1
1 750 . 12 1 1 A 76 76 LEU H H 76 8.071 8.440 -0.369 1
1 751 . 12 1 1 A 76 76 LEU HA H 76 4.618 4.564 0.054 1
1 759 . 12 1 1 A 76 76 LEU CA C 76 52.764 51.302 1.462 1
1 760 . 12 1 1 A 76 76 LEU CB C 76 41.918 43.458 -1.540 1
1 762 . 12 1 1 A 76 76 LEU N N 76 124.196 128.847 -4.651 1
1 763 . 12 1 1 A 77 77 PRO HA H 77 4.393 4.212 0.181 1
1 767 . 12 1 1 A 77 77 PRO CA C 77 63.746 62.234 1.512 1
1 770 . 12 1 1 A 78 78 ASN H H 78 8.379 8.693 -0.314 1
1 771 . 12 1 1 A 78 78 ASN HA H 78 4.586 4.408 0.178 1
1 776 . 12 1 1 A 78 78 ASN C C 78 175.648 174.945 0.703 1
1 777 . 12 1 1 A 78 78 ASN CA C 78 53.591 53.612 -0.021 1
1 778 . 12 1 1 A 78 78 ASN CB C 78 37.826 38.931 -1.105 1
1 779 . 12 1 1 A 78 78 ASN N N 78 115.292 120.849 -5.557 1
1 781 . 12 1 1 A 79 79 TRP H H 79 7.900 7.960 -0.060 1
1 782 . 12 1 1 A 79 79 TRP HA H 79 4.326 4.072 0.254 1
1 788 . 12 1 1 A 79 79 TRP CA C 79 58.825 61.644 -2.819 1
1 789 . 12 1 1 A 79 79 TRP CB C 79 29.090 27.473 1.617 1
1 790 . 12 1 1 A 79 79 TRP N N 79 119.525 118.266 1.259 1
1 792 . 12 1 1 A 80 80 ARG H H 80 8.060 8.534 -0.474 1
1 793 . 12 1 1 A 80 80 ARG HA H 80 3.913 4.128 -0.215 1
1 798 . 12 1 1 A 80 80 ARG C C 80 177.024 177.413 -0.389 1
1 799 . 12 1 1 A 80 80 ARG CA C 80 58.292 59.532 -1.240 1
1 800 . 12 1 1 A 80 80 ARG CB C 80 30.146 30.030 0.116 1
1 803 . 12 1 1 A 80 80 ARG N N 80 118.864 118.957 -0.093 1
1 804 . 12 1 1 A 81 81 THR H H 81 7.725 7.961 -0.236 1
1 805 . 12 1 1 A 81 81 THR HA H 81 4.297 4.365 -0.068 1
1 809 . 12 1 1 A 81 81 THR CA C 81 62.481 63.111 -0.630 1
1 811 . 12 1 1 A 81 81 THR N N 81 109.863 115.377 -5.514 1
1 812 . 12 1 1 A 82 82 ARG HA H 82 4.341 4.482 -0.141 1
1 816 . 12 1 1 A 82 82 ARG C C 82 177.261 176.791 0.470 1
1 817 . 12 1 1 A 82 82 ARG CA C 82 56.846 56.619 0.227 1
1 818 . 12 1 1 A 82 82 ARG CB C 82 30.288 32.403 -2.115 1
1 820 . 12 1 1 A 83 83 GLY H H 83 8.321 8.371 -0.050 1
1 821 . 12 1 1 A 83 83 GLY HA2 H 83 3.957 4.168 -0.211 1
1 822 . 12 1 1 A 83 83 GLY C C 83 175.185 175.068 0.117 1
1 823 . 12 1 1 A 83 83 GLY CA C 83 46.297 43.928 2.369 1
1 824 . 12 1 1 A 83 83 GLY N N 83 109.146 105.989 3.157 1
1 825 . 12 1 1 A 84 84 LEU H H 84 8.303 8.713 -0.410 1
1 826 . 12 1 1 A 84 84 LEU HA H 84 4.018 4.089 -0.071 1
1 835 . 12 1 1 A 84 84 LEU C C 84 178.552 178.340 0.212 1
1 836 . 12 1 1 A 84 84 LEU CA C 84 58.236 56.153 2.083 1
1 837 . 12 1 1 A 84 84 LEU CB C 84 41.837 41.514 0.323 1
1 840 . 12 1 1 A 84 84 LEU N N 84 122.662 121.070 1.592 1
1 841 . 12 1 1 A 85 85 GLU H H 85 8.233 8.068 0.165 1
1 842 . 12 1 1 A 85 85 GLU HA H 85 4.371 3.927 0.444 1
1 846 . 12 1 1 A 85 85 GLU C C 85 178.555 179.182 -0.627 1
1 847 . 12 1 1 A 85 85 GLU CA C 85 58.377 59.680 -1.303 1
1 848 . 12 1 1 A 85 85 GLU CB C 85 28.675 29.091 -0.416 1
1 850 . 12 1 1 A 85 85 GLU N N 85 119.781 119.710 0.071 1
1 851 . 12 1 1 A 86 86 GLN H H 86 7.877 8.168 -0.291 1
1 852 . 12 1 1 A 86 86 GLN HA H 86 4.100 4.061 0.039 1
1 858 . 12 1 1 A 86 86 GLN C C 86 179.557 178.338 1.219 1
1 859 . 12 1 1 A 86 86 GLN CA C 86 58.955 59.203 -0.248 1
1 860 . 12 1 1 A 86 86 GLN CB C 86 28.191 28.516 -0.325 1
1 862 . 12 1 1 A 86 86 GLN N N 86 118.042 120.223 -2.181 1
1 863 . 12 1 1 A 87 87 ARG H H 87 8.169 7.986 0.183 1
1 864 . 12 1 1 A 87 87 ARG HA H 87 3.975 4.085 -0.110 1
1 868 . 12 1 1 A 87 87 ARG C C 87 177.051 178.383 -1.332 1
1 869 . 12 1 1 A 87 87 ARG CA C 87 59.006 59.564 -0.558 1
1 870 . 12 1 1 A 87 87 ARG CB C 87 30.383 29.590 0.793 1
1 872 . 12 1 1 A 87 87 ARG N N 87 121.381 119.553 1.828 1
1 873 . 12 1 1 A 88 88 ARG H H 88 8.593 8.151 0.442 1
1 874 . 12 1 1 A 88 88 ARG HA H 88 3.726 3.788 -0.062 1
1 876 . 12 1 1 A 88 88 ARG C C 88 177.520 178.613 -1.093 1
1 877 . 12 1 1 A 88 88 ARG CA C 88 60.751 59.515 1.236 1
1 878 . 12 1 1 A 88 88 ARG CB C 88 30.153 29.943 0.210 1
1 879 . 12 1 1 A 88 88 ARG N N 88 120.863 119.115 1.748 1
1 880 . 12 1 1 A 89 89 GLN H H 89 8.355 8.439 -0.084 1
1 881 . 12 1 1 A 89 89 GLN HA H 89 3.887 3.960 -0.073 1
1 887 . 12 1 1 A 89 89 GLN C C 89 179.499 178.421 1.078 1
1 888 . 12 1 1 A 89 89 GLN CA C 89 59.603 59.409 0.194 1
1 889 . 12 1 1 A 89 89 GLN CB C 89 28.464 28.001 0.463 1
1 891 . 12 1 1 A 89 89 GLN N N 89 116.860 119.000 -2.140 1
1 893 . 12 1 1 A 90 90 GLY H H 90 8.406 8.543 -0.137 1
1 894 . 12 1 1 A 90 90 GLY HA2 H 90 3.672 3.723 -0.051 1
1 895 . 12 1 1 A 90 90 GLY HA3 H 90 3.871 3.725 0.146 1
1 896 . 12 1 1 A 90 90 GLY C C 90 177.033 175.761 1.272 1
1 897 . 12 1 1 A 90 90 GLY CA C 90 46.813 47.180 -0.367 1
1 898 . 12 1 1 A 90 90 GLY N N 90 107.679 107.489 0.190 1
1 899 . 12 1 1 A 91 91 LEU H H 91 8.504 8.287 0.217 1
1 900 . 12 1 1 A 91 91 LEU HA H 91 3.784 3.952 -0.168 1
1 910 . 12 1 1 A 91 91 LEU C C 91 178.003 179.238 -1.235 1
1 911 . 12 1 1 A 91 91 LEU CA C 91 57.354 57.708 -0.354 1
1 912 . 12 1 1 A 91 91 LEU CB C 91 40.359 41.023 -0.664 1
1 916 . 12 1 1 A 91 91 LEU N N 91 123.959 121.634 2.325 1
1 917 . 12 1 1 A 92 92 GLU H H 92 8.324 8.728 -0.404 1
1 918 . 12 1 1 A 92 92 GLU HA H 92 3.732 3.787 -0.055 1
1 922 . 12 1 1 A 92 92 GLU C C 92 177.272 178.423 -1.151 1
1 923 . 12 1 1 A 92 92 GLU CA C 92 60.651 59.660 0.991 1
1 924 . 12 1 1 A 92 92 GLU CB C 92 30.843 29.260 1.583 1
1 926 . 12 1 1 A 92 92 GLU N N 92 121.991 120.296 1.695 1
1 927 . 12 1 1 A 93 93 ALA H H 93 8.126 7.856 0.270 1
1 928 . 12 1 1 A 93 93 ALA HA H 93 4.160 4.135 0.025 1
1 932 . 12 1 1 A 93 93 ALA C C 93 180.818 179.639 1.179 1
1 933 . 12 1 1 A 93 93 ALA CA C 93 54.828 54.889 -0.061 1
1 934 . 12 1 1 A 93 93 ALA CB C 93 18.032 18.334 -0.302 1
1 935 . 12 1 1 A 93 93 ALA N N 93 120.066 122.268 -2.202 1
1 936 . 12 1 1 A 94 94 TYR H H 94 7.916 7.547 0.369 1
1 937 . 12 1 1 A 94 94 TYR HA H 94 4.139 4.263 -0.124 1
1 942 . 12 1 1 A 94 94 TYR C C 94 175.895 177.250 -1.355 1
1 943 . 12 1 1 A 94 94 TYR CA C 94 61.915 61.264 0.651 1
1 944 . 12 1 1 A 94 94 TYR CB C 94 38.740 38.422 0.318 1
1 945 . 12 1 1 A 94 94 TYR N N 94 121.179 119.900 1.279 1
1 946 . 12 1 1 A 95 95 ILE H H 95 7.983 8.733 -0.750 1
1 947 . 12 1 1 A 95 95 ILE HA H 95 3.614 3.592 0.022 1
1 957 . 12 1 1 A 95 95 ILE C C 95 174.678 178.293 -3.615 1
1 958 . 12 1 1 A 95 95 ILE CA C 95 63.461 65.396 -1.935 1
1 959 . 12 1 1 A 95 95 ILE CB C 95 36.625 37.641 -1.016 1
1 963 . 12 1 1 A 95 95 ILE N N 95 116.397 120.576 -4.179 1
1 964 . 12 1 1 A 96 96 GLN H H 96 8.175 8.648 -0.473 1
1 965 . 12 1 1 A 96 96 GLN HA H 96 3.763 4.052 -0.289 1
1 970 . 12 1 1 A 96 96 GLN C C 96 179.042 178.350 0.692 1
1 971 . 12 1 1 A 96 96 GLN CA C 96 59.270 58.104 1.166 1
1 972 . 12 1 1 A 96 96 GLN CB C 96 27.696 27.773 -0.077 1
1 974 . 12 1 1 A 96 96 GLN N N 96 116.631 119.641 -3.010 1
1 976 . 12 1 1 A 97 97 GLY H H 97 8.222 8.067 0.155 1
1 977 . 12 1 1 A 97 97 GLY HA2 H 97 3.661 3.663 -0.002 1
1 978 . 12 1 1 A 97 97 GLY HA3 H 97 3.806 3.692 0.114 1
1 979 . 12 1 1 A 97 97 GLY C C 97 175.449 176.045 -0.596 1
1 980 . 12 1 1 A 97 97 GLY CA C 97 46.917 47.325 -0.408 1
1 981 . 12 1 1 A 97 97 GLY N N 97 107.315 108.684 -1.369 1
1 982 . 12 1 1 A 98 98 ILE H H 98 7.630 7.988 -0.358 1
1 983 . 12 1 1 A 98 98 ILE HA H 98 3.399 3.915 -0.516 1
1 993 . 12 1 1 A 98 98 ILE C C 98 178.683 177.746 0.937 1
1 994 . 12 1 1 A 98 98 ILE CA C 98 66.402 64.655 1.747 1
1 995 . 12 1 1 A 98 98 ILE CB C 98 38.037 37.378 0.659 1
1 999 . 12 1 1 A 98 98 ILE N N 98 120.644 120.457 0.187 1
1 1000 . 12 1 1 A 99 99 LEU H H 99 7.076 7.664 -0.588 1
1 1001 . 12 1 1 A 99 99 LEU HA H 99 4.133 4.011 0.122 1
1 1010 . 12 1 1 A 99 99 LEU C C 99 178.128 178.062 0.066 1
1 1011 . 12 1 1 A 99 99 LEU CA C 99 57.129 58.001 -0.872 1
1 1012 . 12 1 1 A 99 99 LEU CB C 99 41.108 41.741 -0.633 1
1 1014 . 12 1 1 A 99 99 LEU N N 99 116.844 124.200 -7.356 1
1 1015 . 12 1 1 A 100 100 TYR H H 100 7.890 9.158 -1.268 1
1 1016 . 12 1 1 A 100 100 TYR HA H 100 4.550 4.048 0.502 1
1 1021 . 12 1 1 A 100 100 TYR C C 100 178.210 177.685 0.525 1
1 1022 . 12 1 1 A 100 100 TYR CA C 100 59.452 61.454 -2.002 1
1 1023 . 12 1 1 A 100 100 TYR CB C 100 38.786 38.714 0.072 1
1 1024 . 12 1 1 A 100 100 TYR N N 100 116.427 119.778 -3.351 1
1 1025 . 12 1 1 A 101 101 LEU H H 101 8.041 7.849 0.192 1
1 1026 . 12 1 1 A 101 101 LEU HA H 101 4.158 3.970 0.188 1
1 1036 . 12 1 1 A 101 101 LEU C C 101 176.808 177.216 -0.408 1
1 1037 . 12 1 1 A 101 101 LEU CA C 101 56.156 58.074 -1.918 1
1 1038 . 12 1 1 A 101 101 LEU CB C 101 44.307 41.815 2.492 1
1 1041 . 12 1 1 A 101 101 LEU N N 101 116.493 120.608 -4.115 1
1 1042 . 12 1 1 A 102 102 ASN H H 102 7.146 8.035 -0.889 1
1 1043 . 12 1 1 A 102 102 ASN HA H 102 5.056 5.044 0.012 1
1 1046 . 12 1 1 A 102 102 ASN CA C 102 52.704 54.404 -1.700 1
1 1047 . 12 1 1 A 102 102 ASN CB C 102 42.424 41.338 1.086 1
1 1048 . 12 1 1 A 102 102 ASN N N 102 114.922 114.957 -0.035 1
1 1049 . 12 1 1 A 103 103 GLN H H 103 8.477 7.948 0.529 1
1 1050 . 12 1 1 A 103 103 GLN HA H 103 3.866 3.705 0.161 1
1 1054 . 12 1 1 A 103 103 GLN C C 103 176.110 175.655 0.455 1
1 1055 . 12 1 1 A 103 103 GLN CA C 103 58.451 58.903 -0.452 1
1 1056 . 12 1 1 A 103 103 GLN CB C 103 28.896 27.934 0.962 1
1 1058 . 12 1 1 A 103 103 GLN N N 103 120.252 119.188 1.064 1
1 1059 . 12 1 1 A 104 104 GLU H H 104 7.930 8.290 -0.360 1
1 1060 . 12 1 1 A 104 104 GLU HA H 104 4.591 4.260 0.331 1
1 1064 . 12 1 1 A 104 104 GLU C C 104 175.397 174.956 0.441 1
1 1065 . 12 1 1 A 104 104 GLU CA C 104 54.058 58.020 -3.962 1
1 1066 . 12 1 1 A 104 104 GLU CB C 104 31.272 29.501 1.771 1
1 1068 . 12 1 1 A 104 104 GLU N N 104 117.295 119.107 -1.812 1
1 1069 . 12 1 1 A 105 105 VAL H H 105 8.546 7.884 0.662 1
1 1070 . 12 1 1 A 105 105 VAL HA H 105 3.823 4.377 -0.554 1
1 1078 . 12 1 1 A 105 105 VAL CA C 105 60.706 59.237 1.469 1
1 1079 . 12 1 1 A 105 105 VAL CB C 105 32.126 34.151 -2.025 1
1 1082 . 12 1 1 A 105 105 VAL N N 105 124.511 118.820 5.691 1
1 1083 . 12 1 1 A 106 106 PRO HA H 106 3.997 4.637 -0.640 1
1 1089 . 12 1 1 A 106 106 PRO C C 106 178.240 177.720 0.520 1
1 1090 . 12 1 1 A 106 106 PRO CA C 106 62.961 62.928 0.033 1
1 1091 . 12 1 1 A 106 106 PRO CB C 106 32.321 31.738 0.583 1
1 1094 . 12 1 1 A 107 107 LYS H H 107 9.122 9.006 0.116 1
1 1095 . 12 1 1 A 107 107 LYS HA H 107 3.813 3.995 -0.182 1
1 1101 . 12 1 1 A 107 107 LYS C C 107 178.563 178.024 0.539 1
1 1102 . 12 1 1 A 107 107 LYS CA C 107 60.085 59.381 0.704 1
1 1103 . 12 1 1 A 107 107 LYS CB C 107 31.632 32.492 -0.860 1
1 1106 . 12 1 1 A 107 107 LYS N N 107 129.017 125.225 3.792 1
1 1107 . 12 1 1 A 108 108 GLU H H 108 10.370 8.098 2.272 1
1 1108 . 12 1 1 A 108 108 GLU HA H 108 3.991 4.180 -0.189 1
1 1111 . 12 1 1 A 108 108 GLU C C 108 180.366 179.233 1.133 1
1 1112 . 12 1 1 A 108 108 GLU CA C 108 60.337 58.947 1.390 1
1 1113 . 12 1 1 A 108 108 GLU CB C 108 29.178 29.680 -0.502 1
1 1115 . 12 1 1 A 108 108 GLU N N 108 118.335 118.982 -0.647 1
1 1116 . 12 1 1 A 109 109 LEU H H 109 7.393 7.859 -0.466 1
1 1117 . 12 1 1 A 109 109 LEU HA H 109 4.220 4.122 0.098 1
1 1126 . 12 1 1 A 109 109 LEU C C 109 177.378 179.720 -2.342 1
1 1127 . 12 1 1 A 109 109 LEU CA C 109 56.618 58.061 -1.443 1
1 1128 . 12 1 1 A 109 109 LEU CB C 109 41.898 41.620 0.278 1
1 1131 . 12 1 1 A 109 109 LEU N N 109 118.285 120.720 -2.435 1
1 1132 . 12 1 1 A 110 110 LEU H H 110 7.641 8.179 -0.538 1
1 1133 . 12 1 1 A 110 110 LEU HA H 110 3.796 3.966 -0.170 1
1 1142 . 12 1 1 A 110 110 LEU C C 110 179.103 178.590 0.513 1
1 1143 . 12 1 1 A 110 110 LEU CA C 110 59.046 57.673 1.373 1
1 1144 . 12 1 1 A 110 110 LEU CB C 110 40.228 40.838 -0.610 1
1 1147 . 12 1 1 A 110 110 LEU N N 110 120.162 119.315 0.847 1
1 1148 . 12 1 1 A 111 111 GLU H H 111 7.916 7.993 -0.077 1
1 1149 . 12 1 1 A 111 111 GLU HA H 111 4.080 4.129 -0.049 1
1 1153 . 12 1 1 A 111 111 GLU C C 111 179.967 178.771 1.196 1
1 1154 . 12 1 1 A 111 111 GLU CA C 111 59.243 59.006 0.237 1
1 1155 . 12 1 1 A 111 111 GLU CB C 111 29.576 29.428 0.148 1
1 1157 . 12 1 1 A 111 111 GLU N N 111 117.360 120.234 -2.874 1
1 1158 . 12 1 1 A 112 112 PHE H H 112 7.712 8.121 -0.409 1
1 1159 . 12 1 1 A 112 112 PHE HA H 112 4.224 4.184 0.040 1
1 1164 . 12 1 1 A 112 112 PHE C C 112 177.180 177.231 -0.051 1
1 1165 . 12 1 1 A 112 112 PHE CA C 112 61.407 61.018 0.389 1
1 1166 . 12 1 1 A 112 112 PHE CB C 112 40.172 39.397 0.775 1
1 1167 . 12 1 1 A 112 112 PHE N N 112 123.042 120.843 2.199 1
1 1168 . 12 1 1 A 113 113 LEU H H 113 8.056 8.017 0.039 1
1 1169 . 12 1 1 A 113 113 LEU HA H 113 4.147 4.361 -0.214 1
1 1175 . 12 1 1 A 113 113 LEU C C 113 173.717 176.011 -2.294 1
1 1176 . 12 1 1 A 113 113 LEU CA C 113 54.093 54.354 -0.261 1
1 1177 . 12 1 1 A 113 113 LEU CB C 113 41.517 42.439 -0.922 1
1 1179 . 12 1 1 A 113 113 LEU N N 113 115.595 117.240 -1.645 1
1 1180 . 12 1 1 A 114 114 ARG H H 114 7.902 8.062 -0.160 1
1 1181 . 12 1 1 A 114 114 ARG HA H 114 3.817 4.361 -0.544 1
1 1182 . 12 1 1 A 114 114 ARG C C 114 174.566 176.387 -1.821 1
1 1183 . 12 1 1 A 114 114 ARG CA C 114 57.233 57.030 0.203 1
1 1184 . 12 1 1 A 114 114 ARG CB C 114 27.788 28.666 -0.878 1
1 1185 . 12 1 1 A 114 114 ARG N N 114 116.021 118.907 -2.886 1
1 1186 . 12 1 1 A 115 115 LEU H H 115 8.160 8.395 -0.235 1
1 1187 . 12 1 1 A 115 115 LEU HA H 115 4.462 4.424 0.038 1
1 1195 . 12 1 1 A 115 115 LEU C C 115 176.374 177.171 -0.797 1
1 1196 . 12 1 1 A 115 115 LEU CA C 115 53.965 54.487 -0.522 1
1 1197 . 12 1 1 A 115 115 LEU CB C 115 44.077 41.407 2.670 1
1 1199 . 12 1 1 A 115 115 LEU N N 115 118.089 118.835 -0.746 1
1 1200 . 12 1 1 A 116 116 ARG H H 116 8.066 7.629 0.437 1
1 1201 . 12 1 1 A 116 116 ARG HA H 116 4.172 4.353 -0.181 1
1 1203 . 12 1 1 A 116 116 ARG CA C 116 55.961 57.307 -1.346 1
1 1204 . 12 1 1 A 116 116 ARG CB C 116 31.379 30.433 0.946 1
1 1205 . 12 1 1 A 116 116 ARG N N 116 120.852 120.064 0.788 1
1 1206 . 12 1 1 A 117 117 HIS H H 117 7.928 8.943 -1.015 1
1 1207 . 12 1 1 A 117 117 HIS HA H 117 4.557 4.340 0.217 1
1 1211 . 12 1 1 A 117 117 HIS CA C 117 55.937 56.999 -1.062 1
1 1212 . 12 1 1 A 117 117 HIS CB C 117 30.875 28.949 1.926 1
1 1213 . 12 1 1 A 118 118 PHE H H 118 8.183 7.925 0.258 1
1 1214 . 12 1 1 A 118 118 PHE HA H 118 4.730 4.766 -0.036 1
1 1219 . 12 1 1 A 118 118 PHE CA C 118 55.716 55.019 0.697 1
1 1220 . 12 1 1 A 118 118 PHE CB C 118 39.263 39.315 -0.052 1
1 1221 . 12 1 1 A 118 118 PHE N N 118 123.480 120.003 3.477 1
1 1222 . 12 1 1 A 119 119 PRO HA H 119 4.398 4.631 -0.233 1
1 1227 . 12 1 1 A 119 119 PRO C C 119 176.666 176.780 -0.114 1
1 1228 . 12 1 1 A 119 119 PRO CA C 119 63.377 63.516 -0.139 1
1 1229 . 12 1 1 A 119 119 PRO CB C 119 32.059 32.440 -0.381 1
1 1232 . 12 1 1 A 120 120 THR H H 120 8.054 8.043 0.011 1
1 1233 . 12 1 1 A 120 120 THR HA H 120 4.273 4.486 -0.213 1
1 1238 . 12 1 1 A 120 120 THR C C 120 174.154 172.943 1.211 1
1 1239 . 12 1 1 A 120 120 THR CA C 120 61.893 63.067 -1.174 1
1 1240 . 12 1 1 A 120 120 THR CB C 120 69.736 67.972 1.764 1
1 1242 . 12 1 1 A 120 120 THR N N 120 113.088 111.398 1.690 1
1 1243 . 12 1 1 A 121 121 ASP H H 121 8.209 8.973 -0.764 1
1 1244 . 12 1 1 A 121 121 ASP HA H 121 4.876 5.007 -0.131 1
1 1247 . 12 1 1 A 121 121 ASP CA C 121 52.126 51.046 1.080 1
1 1248 . 12 1 1 A 121 121 ASP CB C 121 41.553 41.163 0.390 1
1 1249 . 12 1 1 A 121 121 ASP N N 121 123.630 126.271 -2.641 1
1 1250 . 12 1 1 A 122 122 PRO HA H 122 4.363 4.814 -0.451 1
1 1255 . 12 1 1 A 122 122 PRO C C 122 177.344 175.630 1.714 1
1 1256 . 12 1 1 A 122 122 PRO CA C 122 63.913 62.750 1.163 1
1 1257 . 12 1 1 A 122 122 PRO CB C 122 32.116 31.838 0.278 1
1 1260 . 12 1 1 A 123 123 LYS H H 123 8.344 8.669 -0.325 1
1 1261 . 12 1 1 A 123 123 LYS HA H 123 4.244 4.750 -0.506 1
1 1266 . 12 1 1 A 123 123 LYS C C 123 176.637 175.791 0.846 1
1 1267 . 12 1 1 A 123 123 LYS CA C 123 56.359 55.004 1.355 1
1 1268 . 12 1 1 A 123 123 LYS CB C 123 32.367 36.048 -3.681 1
1 1272 . 12 1 1 A 123 123 LYS N N 123 119.110 122.513 -3.403 1
1 1273 . 12 1 1 A 124 124 ALA H H 124 7.929 8.765 -0.836 1
1 1274 . 12 1 1 A 124 124 ALA HA H 124 4.248 4.376 -0.128 1
1 1278 . 12 1 1 A 124 124 ALA C C 124 177.648 176.831 0.817 1
1 1279 . 12 1 1 A 124 124 ALA CA C 124 52.618 52.477 0.141 1
1 1280 . 12 1 1 A 124 124 ALA CB C 124 19.379 18.752 0.627 1
1 1281 . 12 1 1 A 124 124 ALA N N 124 123.825 128.507 -4.682 1
1 1282 . 12 1 1 A 125 125 SER H H 125 8.134 8.921 -0.787 1
1 1283 . 12 1 1 A 125 125 SER HA H 125 4.341 5.046 -0.705 1
1 1286 . 12 1 1 A 125 125 SER C C 125 174.172 172.919 1.253 1
1 1287 . 12 1 1 A 125 125 SER CA C 125 58.391 57.016 1.375 1
1 1288 . 12 1 1 A 125 125 SER CB C 125 63.748 63.907 -0.159 1
1 1289 . 12 1 1 A 125 125 SER N N 125 114.454 121.681 -7.227 1
1 1290 . 12 1 1 A 126 126 ASN H H 126 8.242 7.391 0.851 1
1 1291 . 12 1 1 A 126 126 ASN HA H 126 4.657 4.954 -0.297 1
1 1294 . 12 1 1 A 126 126 ASN C C 126 174.624 173.256 1.368 1
1 1295 . 12 1 1 A 126 126 ASN CA C 126 53.292 52.881 0.411 1
1 1296 . 12 1 1 A 126 126 ASN CB C 126 38.797 38.952 -0.155 1
1 1297 . 12 1 1 A 126 126 ASN N N 126 120.102 123.058 -2.956 1
1 1298 . 12 1 1 A 127 127 TRP H H 127 8.051 8.874 -0.823 1
1 1299 . 12 1 1 A 127 127 TRP HA H 127 4.694 5.255 -0.561 1
1 1302 . 12 1 1 A 127 127 TRP C C 127 175.479 175.967 -0.488 1
1 1303 . 12 1 1 A 127 127 TRP CA C 127 57.096 55.183 1.913 1
1 1304 . 12 1 1 A 127 127 TRP CB C 127 29.820 31.300 -1.480 1
1 1305 . 12 1 1 A 127 127 TRP N N 127 121.198 126.134 -4.936 1
1 1 . 13 1 1 A 7 7 HIS HA H 7 4.623 4.941 -0.318 1
1 4 . 13 1 1 A 7 7 HIS C C 7 174.747 172.786 1.961 1
1 5 . 13 1 1 A 7 7 HIS CA C 7 56.189 53.456 2.733 1
1 6 . 13 1 1 A 7 7 HIS CB C 7 30.028 29.768 0.260 1
1 7 . 13 1 1 A 8 8 LEU H H 8 8.283 8.590 -0.307 1
1 8 . 13 1 1 A 8 8 LEU HA H 8 4.249 4.522 -0.273 1
1 10 . 13 1 1 A 8 8 LEU C C 8 176.700 175.566 1.134 1
1 11 . 13 1 1 A 8 8 LEU CA C 8 55.498 53.193 2.305 1
1 12 . 13 1 1 A 8 8 LEU CB C 8 42.568 43.011 -0.443 1
1 13 . 13 1 1 A 8 8 LEU N N 8 122.916 126.117 -3.201 1
1 14 . 13 1 1 A 9 9 GLU H H 9 8.623 8.446 0.177 1
1 15 . 13 1 1 A 9 9 GLU HA H 9 4.311 4.207 0.104 1
1 16 . 13 1 1 A 9 9 GLU C C 9 174.811 174.933 -0.122 1
1 17 . 13 1 1 A 9 9 GLU CA C 9 56.377 57.707 -1.330 1
1 18 . 13 1 1 A 9 9 GLU CB C 9 29.557 28.766 0.791 1
1 20 . 13 1 1 A 9 9 GLU N N 9 121.512 125.151 -3.639 1
1 21 . 13 1 1 A 10 10 LEU H H 10 7.853 8.958 -1.105 1
1 22 . 13 1 1 A 10 10 LEU HA H 10 5.225 5.189 0.036 1
1 31 . 13 1 1 A 10 10 LEU C C 10 174.637 175.377 -0.740 1
1 32 . 13 1 1 A 10 10 LEU CA C 10 54.513 54.356 0.157 1
1 33 . 13 1 1 A 10 10 LEU CB C 10 45.187 43.965 1.222 1
1 36 . 13 1 1 A 10 10 LEU N N 10 123.592 125.705 -2.113 1
1 37 . 13 1 1 A 11 11 GLU H H 11 8.894 8.977 -0.083 1
1 38 . 13 1 1 A 11 11 GLU HA H 11 4.765 5.205 -0.440 1
1 43 . 13 1 1 A 11 11 GLU C C 11 174.563 175.190 -0.627 1
1 44 . 13 1 1 A 11 11 GLU CA C 11 55.047 54.717 0.330 1
1 45 . 13 1 1 A 11 11 GLU CB C 11 33.760 31.876 1.884 1
1 47 . 13 1 1 A 11 11 GLU N N 11 124.055 122.445 1.610 1
1 48 . 13 1 1 A 12 12 VAL H H 12 8.607 8.907 -0.300 1
1 49 . 13 1 1 A 12 12 VAL HA H 12 5.174 5.235 -0.061 1
1 57 . 13 1 1 A 12 12 VAL C C 12 173.573 174.575 -1.002 1
1 58 . 13 1 1 A 12 12 VAL CA C 12 60.296 61.071 -0.775 1
1 59 . 13 1 1 A 12 12 VAL CB C 12 35.689 34.855 0.834 1
1 62 . 13 1 1 A 12 12 VAL N N 12 120.878 125.738 -4.860 1
1 63 . 13 1 1 A 13 13 HIS H H 13 8.982 8.978 0.004 1
1 64 . 13 1 1 A 13 13 HIS HA H 13 4.824 5.148 -0.324 1
1 69 . 13 1 1 A 13 13 HIS C C 13 173.236 171.909 1.327 1
1 70 . 13 1 1 A 13 13 HIS CA C 13 54.906 54.465 0.441 1
1 71 . 13 1 1 A 13 13 HIS CB C 13 33.496 32.196 1.300 1
1 72 . 13 1 1 A 13 13 HIS N N 13 121.504 120.786 0.718 1
1 73 . 13 1 1 A 14 14 ILE H H 14 10.442 9.124 1.318 1
1 74 . 13 1 1 A 14 14 ILE HA H 14 5.458 4.593 0.865 1
1 84 . 13 1 1 A 14 14 ILE CA C 14 58.386 57.908 0.478 1
1 85 . 13 1 1 A 14 14 ILE CB C 14 38.596 37.881 0.715 1
1 88 . 13 1 1 A 14 14 ILE N N 14 119.923 121.586 -1.663 1
1 89 . 13 1 1 A 15 15 PRO HA H 15 4.560 4.570 -0.010 1
1 95 . 13 1 1 A 15 15 PRO C C 15 176.907 176.514 0.393 1
1 96 . 13 1 1 A 15 15 PRO CA C 15 64.342 64.468 -0.126 1
1 97 . 13 1 1 A 15 15 PRO CB C 15 32.924 32.343 0.581 1
1 100 . 13 1 1 A 16 16 SER H H 16 7.331 7.809 -0.478 1
1 101 . 13 1 1 A 16 16 SER HA H 16 4.822 5.184 -0.362 1
1 104 . 13 1 1 A 16 16 SER C C 16 171.253 172.837 -1.584 1
1 105 . 13 1 1 A 16 16 SER CA C 16 57.135 58.004 -0.869 1
1 106 . 13 1 1 A 16 16 SER CB C 16 65.947 67.325 -1.378 1
1 107 . 13 1 1 A 16 16 SER N N 16 107.745 114.179 -6.434 1
1 108 . 13 1 1 A 17 17 VAL H H 17 8.350 8.614 -0.264 1
1 109 . 13 1 1 A 17 17 VAL HA H 17 4.926 4.921 0.005 1
1 117 . 13 1 1 A 17 17 VAL C C 17 173.692 174.825 -1.133 1
1 118 . 13 1 1 A 17 17 VAL CA C 17 58.721 60.346 -1.625 1
1 119 . 13 1 1 A 17 17 VAL CB C 17 34.420 36.315 -1.895 1
1 122 . 13 1 1 A 17 17 VAL N N 17 118.680 122.575 -3.895 1
1 123 . 13 1 1 A 18 18 GLY H H 18 8.332 8.794 -0.462 1
1 124 . 13 1 1 A 18 18 GLY HA2 H 18 4.189 4.308 -0.119 1
1 125 . 13 1 1 A 18 18 GLY HA3 H 18 4.011 4.322 -0.311 1
1 126 . 13 1 1 A 18 18 GLY CA C 18 45.356 45.333 0.023 1
1 127 . 13 1 1 A 18 18 GLY N N 18 112.549 112.752 -0.203 1
1 128 . 13 1 1 A 19 19 PRO HA H 19 4.757 4.612 0.145 1
1 134 . 13 1 1 A 19 19 PRO C C 19 177.482 176.777 0.705 1
1 135 . 13 1 1 A 19 19 PRO CA C 19 62.848 62.618 0.230 1
1 136 . 13 1 1 A 19 19 PRO CB C 19 32.283 30.747 1.536 1
1 139 . 13 1 1 A 20 20 GLU H H 20 8.588 8.500 0.088 1
1 140 . 13 1 1 A 20 20 GLU HA H 20 4.147 4.687 -0.540 1
1 144 . 13 1 1 A 20 20 GLU C C 20 175.857 176.189 -0.332 1
1 145 . 13 1 1 A 20 20 GLU CA C 20 57.150 56.063 1.087 1
1 146 . 13 1 1 A 20 20 GLU CB C 20 30.923 30.762 0.161 1
1 148 . 13 1 1 A 20 20 GLU N N 20 122.087 118.210 3.877 1
1 149 . 13 1 1 A 21 21 ALA H H 21 8.352 7.811 0.541 1
1 150 . 13 1 1 A 21 21 ALA HA H 21 4.391 4.454 -0.063 1
1 154 . 13 1 1 A 21 21 ALA C C 21 174.910 176.501 -1.591 1
1 155 . 13 1 1 A 21 21 ALA CA C 21 52.166 51.422 0.744 1
1 156 . 13 1 1 A 21 21 ALA CB C 21 19.915 19.301 0.614 1
1 157 . 13 1 1 A 21 21 ALA N N 21 124.593 123.167 1.426 1
1 158 . 13 1 1 A 22 22 GLU H H 22 8.398 8.083 0.315 1
1 159 . 13 1 1 A 22 22 GLU HA H 22 4.331 5.104 -0.773 1
1 163 . 13 1 1 A 22 22 GLU C C 22 176.389 175.885 0.504 1
1 164 . 13 1 1 A 22 22 GLU CA C 22 56.316 55.324 0.992 1
1 165 . 13 1 1 A 22 22 GLU CB C 22 30.713 31.724 -1.011 1
1 167 . 13 1 1 A 22 22 GLU N N 22 120.159 123.282 -3.123 1
1 168 . 13 1 1 A 23 23 GLY H H 23 8.246 8.286 -0.040 1
1 169 . 13 1 1 A 23 23 GLY HA2 H 23 4.162 4.013 0.149 1
1 170 . 13 1 1 A 23 23 GLY HA3 H 23 4.061 4.021 0.040 1
1 171 . 13 1 1 A 23 23 GLY CA C 23 44.801 45.485 -0.684 1
1 172 . 13 1 1 A 23 23 GLY N N 23 110.080 109.185 0.895 1
1 173 . 13 1 1 A 24 24 PRO HA H 24 4.417 4.645 -0.228 1
1 178 . 13 1 1 A 24 24 PRO C C 24 177.135 176.608 0.527 1
1 179 . 13 1 1 A 24 24 PRO CA C 24 63.520 62.565 0.955 1
1 180 . 13 1 1 A 24 24 PRO CB C 24 32.124 32.734 -0.610 1
1 183 . 13 1 1 A 25 25 ARG H H 25 8.409 8.551 -0.142 1
1 184 . 13 1 1 A 25 25 ARG HA H 25 4.298 4.675 -0.377 1
1 187 . 13 1 1 A 25 25 ARG C C 25 176.217 175.643 0.574 1
1 188 . 13 1 1 A 25 25 ARG CA C 25 56.237 55.013 1.224 1
1 189 . 13 1 1 A 25 25 ARG CB C 25 30.467 31.991 -1.524 1
1 192 . 13 1 1 A 25 25 ARG N N 25 120.147 120.724 -0.577 1
1 193 . 13 1 1 A 26 26 GLN H H 26 8.278 8.212 0.066 1
1 194 . 13 1 1 A 26 26 GLN HA H 26 4.336 4.333 0.003 1
1 200 . 13 1 1 A 26 26 GLN C C 26 175.566 174.840 0.726 1
1 201 . 13 1 1 A 26 26 GLN CA C 26 55.788 56.754 -0.966 1
1 202 . 13 1 1 A 26 26 GLN CB C 26 29.714 28.915 0.799 1
1 204 . 13 1 1 A 26 26 GLN N N 26 120.460 121.944 -1.484 1
1 206 . 13 1 1 A 27 27 SER H H 27 8.298 8.288 0.010 1
1 208 . 13 1 1 A 27 27 SER CA C 27 56.156 54.499 1.657 1
1 209 . 13 1 1 A 27 27 SER CB C 27 63.813 64.543 -0.730 1
1 210 . 13 1 1 A 27 27 SER N N 27 117.382 122.144 -4.762 1
1 211 . 13 1 1 A 28 28 PRO HA H 28 4.366 4.517 -0.151 1
1 216 . 13 1 1 A 28 28 PRO C C 28 177.555 177.335 0.220 1
1 217 . 13 1 1 A 28 28 PRO CA C 28 64.486 64.449 0.037 1
1 218 . 13 1 1 A 28 28 PRO CB C 28 31.892 31.978 -0.086 1
1 221 . 13 1 1 A 29 29 GLU H H 29 8.582 7.973 0.609 1
1 222 . 13 1 1 A 29 29 GLU HA H 29 4.218 4.345 -0.127 1
1 226 . 13 1 1 A 29 29 GLU CA C 29 57.261 58.366 -1.105 1
1 227 . 13 1 1 A 29 29 GLU CB C 29 29.633 30.265 -0.632 1
1 229 . 13 1 1 A 29 29 GLU N N 29 118.309 116.747 1.562 1
1 230 . 13 1 1 A 30 30 LYS H H 30 7.955 7.622 0.333 1
1 231 . 13 1 1 A 30 30 LYS HA H 30 4.328 3.999 0.329 1
1 236 . 13 1 1 A 30 30 LYS C C 30 176.222 175.539 0.683 1
1 237 . 13 1 1 A 30 30 LYS CA C 30 56.247 58.333 -2.086 1
1 238 . 13 1 1 A 30 30 LYS CB C 30 32.720 30.033 2.687 1
1 242 . 13 1 1 A 30 30 LYS N N 30 120.129 117.108 3.021 1
1 243 . 13 1 1 A 31 31 SER H H 31 7.883 7.871 0.012 1
1 244 . 13 1 1 A 31 31 SER HA H 31 4.458 4.539 -0.081 1
1 246 . 13 1 1 A 31 31 SER C C 31 174.129 174.452 -0.323 1
1 247 . 13 1 1 A 31 31 SER CA C 31 58.477 57.798 0.679 1
1 248 . 13 1 1 A 31 31 SER CB C 31 64.042 61.457 2.585 1
1 249 . 13 1 1 A 31 31 SER N N 31 115.366 115.555 -0.189 1
1 250 . 13 1 1 A 32 32 HIS H H 32 8.485 7.518 0.967 1
1 251 . 13 1 1 A 32 32 HIS HA H 32 4.450 4.755 -0.305 1
1 255 . 13 1 1 A 32 32 HIS CA C 32 56.009 56.004 0.005 1
1 256 . 13 1 1 A 32 32 HIS CB C 32 31.122 30.210 0.912 1
1 257 . 13 1 1 A 32 32 HIS N N 32 121.500 120.860 0.640 1
1 258 . 13 1 1 A 33 33 MET H H 33 8.392 7.534 0.858 1
1 259 . 13 1 1 A 33 33 MET HA H 33 4.601 4.722 -0.121 1
1 265 . 13 1 1 A 33 33 MET C C 33 175.842 174.665 1.177 1
1 266 . 13 1 1 A 33 33 MET CA C 33 54.533 53.958 0.575 1
1 267 . 13 1 1 A 33 33 MET CB C 33 32.868 34.842 -1.974 1
1 270 . 13 1 1 A 33 33 MET N N 33 120.204 120.367 -0.163 1
1 271 . 13 1 1 A 34 34 VAL H H 34 8.938 8.763 0.175 1
1 272 . 13 1 1 A 34 34 VAL HA H 34 4.430 4.515 -0.085 1
1 280 . 13 1 1 A 34 34 VAL C C 34 174.149 173.935 0.214 1
1 281 . 13 1 1 A 34 34 VAL CA C 34 60.703 59.561 1.142 1
1 282 . 13 1 1 A 34 34 VAL CB C 34 34.319 35.323 -1.004 1
1 285 . 13 1 1 A 34 34 VAL N N 34 118.512 122.770 -4.258 1
1 286 . 13 1 1 A 35 35 PHE H H 35 9.242 7.750 1.492 1
1 287 . 13 1 1 A 35 35 PHE HA H 35 4.439 5.741 -1.302 1
1 294 . 13 1 1 A 35 35 PHE C C 35 174.831 173.572 1.259 1
1 295 . 13 1 1 A 35 35 PHE CA C 35 57.754 54.833 2.921 1
1 296 . 13 1 1 A 35 35 PHE CB C 35 38.959 42.471 -3.512 1
1 297 . 13 1 1 A 35 35 PHE N N 35 124.912 123.777 1.135 1
1 298 . 13 1 1 A 36 36 ARG H H 36 8.475 9.304 -0.829 1
1 299 . 13 1 1 A 36 36 ARG HA H 36 4.135 4.724 -0.589 1
1 304 . 13 1 1 A 36 36 ARG C C 36 172.865 175.998 -3.133 1
1 305 . 13 1 1 A 36 36 ARG CA C 36 56.895 55.506 1.389 1
1 306 . 13 1 1 A 36 36 ARG CB C 36 28.962 30.582 -1.620 1
1 308 . 13 1 1 A 36 36 ARG N N 36 125.680 120.274 5.406 1
1 309 . 13 1 1 A 37 37 VAL H H 37 8.066 8.892 -0.826 1
1 310 . 13 1 1 A 37 37 VAL HA H 37 4.292 4.595 -0.303 1
1 318 . 13 1 1 A 37 37 VAL C C 37 174.595 174.680 -0.085 1
1 319 . 13 1 1 A 37 37 VAL CA C 37 62.727 61.358 1.369 1
1 320 . 13 1 1 A 37 37 VAL CB C 37 31.102 33.117 -2.015 1
1 323 . 13 1 1 A 37 37 VAL N N 37 125.403 120.204 5.199 1
1 324 . 13 1 1 A 38 38 GLU H H 38 9.532 8.933 0.599 1
1 325 . 13 1 1 A 38 38 GLU HA H 38 4.895 5.390 -0.495 1
1 329 . 13 1 1 A 38 38 GLU C C 38 174.509 174.767 -0.258 1
1 330 . 13 1 1 A 38 38 GLU CA C 38 55.650 54.702 0.948 1
1 331 . 13 1 1 A 38 38 GLU CB C 38 32.214 32.124 0.090 1
1 333 . 13 1 1 A 38 38 GLU N N 38 129.885 123.923 5.962 1
1 334 . 13 1 1 A 39 39 VAL H H 39 9.035 8.631 0.404 1
1 335 . 13 1 1 A 39 39 VAL HA H 39 4.446 4.638 -0.192 1
1 343 . 13 1 1 A 39 39 VAL C C 39 173.661 173.875 -0.214 1
1 344 . 13 1 1 A 39 39 VAL CA C 39 61.258 61.237 0.021 1
1 345 . 13 1 1 A 39 39 VAL CB C 39 33.533 32.643 0.890 1
1 348 . 13 1 1 A 39 39 VAL N N 39 127.941 126.893 1.048 1
1 349 . 13 1 1 A 40 40 LEU H H 40 8.843 8.927 -0.084 1
1 350 . 13 1 1 A 40 40 LEU HA H 40 5.130 5.391 -0.261 1
1 360 . 13 1 1 A 40 40 LEU C C 40 175.581 175.217 0.364 1
1 361 . 13 1 1 A 40 40 LEU CA C 40 53.702 53.697 0.005 1
1 362 . 13 1 1 A 40 40 LEU CB C 40 43.989 43.945 0.044 1
1 366 . 13 1 1 A 40 40 LEU N N 40 128.413 129.597 -1.184 1
1 367 . 13 1 1 A 41 41 CYS H H 41 8.959 9.181 -0.222 1
1 368 . 13 1 1 A 41 41 CYS HA H 41 5.174 5.097 0.077 1
1 371 . 13 1 1 A 41 41 CYS C C 41 175.043 173.497 1.546 1
1 372 . 13 1 1 A 41 41 CYS CA C 41 57.483 58.559 -1.076 1
1 373 . 13 1 1 A 41 41 CYS CB C 41 28.472 30.353 -1.881 1
1 374 . 13 1 1 A 41 41 CYS N N 41 124.738 124.611 0.127 1
1 375 . 13 1 1 A 42 42 SER H H 42 9.527 8.981 0.546 1
1 376 . 13 1 1 A 42 42 SER HA H 42 4.149 4.484 -0.335 1
1 379 . 13 1 1 A 42 42 SER C C 42 175.014 174.450 0.564 1
1 380 . 13 1 1 A 42 42 SER CA C 42 59.058 59.440 -0.382 1
1 381 . 13 1 1 A 42 42 SER CB C 42 62.287 61.689 0.598 1
1 382 . 13 1 1 A 42 42 SER N N 42 125.889 123.253 2.636 1
1 383 . 13 1 1 A 43 43 GLY H H 43 8.685 8.362 0.323 1
1 384 . 13 1 1 A 43 43 GLY HA2 H 43 3.594 4.013 -0.419 1
1 385 . 13 1 1 A 43 43 GLY HA3 H 43 4.210 4.014 0.196 1
1 386 . 13 1 1 A 43 43 GLY C C 43 173.664 174.025 -0.361 1
1 387 . 13 1 1 A 43 43 GLY CA C 43 45.404 45.096 0.308 1
1 388 . 13 1 1 A 43 43 GLY N N 43 104.633 106.089 -1.456 1
1 389 . 13 1 1 A 44 44 ARG H H 44 7.926 7.639 0.287 1
1 390 . 13 1 1 A 44 44 ARG HA H 44 4.678 4.549 0.129 1
1 395 . 13 1 1 A 44 44 ARG C C 44 175.261 175.140 0.121 1
1 396 . 13 1 1 A 44 44 ARG CA C 44 55.011 55.656 -0.645 1
1 397 . 13 1 1 A 44 44 ARG CB C 44 32.138 31.641 0.497 1
1 400 . 13 1 1 A 44 44 ARG N N 44 121.239 120.607 0.632 1
1 401 . 13 1 1 A 45 45 ARG H H 45 8.775 9.073 -0.298 1
1 402 . 13 1 1 A 45 45 ARG HA H 45 5.770 5.445 0.325 1
1 409 . 13 1 1 A 45 45 ARG C C 45 176.064 175.778 0.286 1
1 410 . 13 1 1 A 45 45 ARG CA C 45 54.683 54.862 -0.179 1
1 411 . 13 1 1 A 45 45 ARG CB C 45 33.748 32.254 1.494 1
1 414 . 13 1 1 A 45 45 ARG N N 45 125.948 121.982 3.966 1
1 415 . 13 1 1 A 46 46 HIS H H 46 8.912 8.814 0.098 1
1 416 . 13 1 1 A 46 46 HIS HA H 46 4.927 5.610 -0.683 1
1 420 . 13 1 1 A 46 46 HIS C C 46 172.634 174.160 -1.526 1
1 421 . 13 1 1 A 46 46 HIS CA C 46 56.480 54.061 2.419 1
1 422 . 13 1 1 A 46 46 HIS CB C 46 33.608 31.526 2.082 1
1 423 . 13 1 1 A 46 46 HIS N N 46 121.825 120.066 1.759 1
1 424 . 13 1 1 A 47 47 THR H H 47 8.532 9.029 -0.497 1
1 425 . 13 1 1 A 47 47 THR HA H 47 5.472 4.951 0.521 1
1 430 . 13 1 1 A 47 47 THR C C 47 174.442 174.010 0.432 1
1 431 . 13 1 1 A 47 47 THR CA C 47 61.093 62.364 -1.271 1
1 432 . 13 1 1 A 47 47 THR CB C 47 71.041 69.263 1.778 1
1 434 . 13 1 1 A 47 47 THR N N 47 115.450 120.299 -4.849 1
1 435 . 13 1 1 A 48 48 VAL H H 48 9.695 9.579 0.116 1
1 436 . 13 1 1 A 48 48 VAL HA H 48 4.677 4.651 0.026 1
1 444 . 13 1 1 A 48 48 VAL CA C 48 58.172 59.099 -0.927 1
1 445 . 13 1 1 A 48 48 VAL CB C 48 34.990 34.289 0.701 1
1 448 . 13 1 1 A 48 48 VAL N N 48 126.721 126.646 0.075 1
1 449 . 13 1 1 A 49 49 PRO HA H 49 5.087 5.170 -0.083 1
1 453 . 13 1 1 A 49 49 PRO CA C 49 61.671 62.596 -0.925 1
1 454 . 13 1 1 A 49 49 PRO CB C 49 31.923 31.729 0.194 1
1 457 . 13 1 1 A 50 50 ARG H H 50 9.125 9.160 -0.035 1
1 458 . 13 1 1 A 50 50 ARG HA H 50 4.974 4.767 0.207 1
1 464 . 13 1 1 A 50 50 ARG C C 50 176.187 174.628 1.559 1
1 465 . 13 1 1 A 50 50 ARG CA C 50 53.015 55.230 -2.215 1
1 466 . 13 1 1 A 50 50 ARG CB C 50 36.553 34.007 2.546 1
1 468 . 13 1 1 A 50 50 ARG N N 50 124.189 123.949 0.240 1
1 469 . 13 1 1 A 51 51 ARG H H 51 10.105 8.633 1.472 1
1 470 . 13 1 1 A 51 51 ARG HA H 51 5.196 4.242 0.954 1
1 475 . 13 1 1 A 51 51 ARG C C 51 178.865 176.735 2.130 1
1 476 . 13 1 1 A 51 51 ARG CA C 51 55.961 56.736 -0.775 1
1 477 . 13 1 1 A 51 51 ARG CB C 51 32.539 31.276 1.263 1
1 480 . 13 1 1 A 51 51 ARG N N 51 124.521 126.602 -2.081 1
1 481 . 13 1 1 A 52 52 TYR H H 52 10.397 9.012 1.385 1
1 482 . 13 1 1 A 52 52 TYR HA H 52 4.360 4.018 0.342 1
1 487 . 13 1 1 A 52 52 TYR C C 52 178.143 177.596 0.547 1
1 488 . 13 1 1 A 52 52 TYR CA C 52 63.538 62.367 1.171 1
1 489 . 13 1 1 A 52 52 TYR CB C 52 38.784 38.638 0.146 1
1 490 . 13 1 1 A 52 52 TYR N N 52 124.772 128.454 -3.682 1
1 491 . 13 1 1 A 53 53 SER H H 53 9.231 8.087 1.144 1
1 492 . 13 1 1 A 53 53 SER HA H 53 4.175 4.139 0.036 1
1 493 . 13 1 1 A 53 53 SER C C 53 177.220 176.940 0.280 1
1 494 . 13 1 1 A 53 53 SER CA C 53 61.606 61.668 -0.062 1
1 495 . 13 1 1 A 53 53 SER N N 53 113.262 114.175 -0.913 1
1 496 . 13 1 1 A 54 54 GLU H H 54 7.807 7.782 0.025 1
1 497 . 13 1 1 A 54 54 GLU HA H 54 4.392 4.180 0.212 1
1 501 . 13 1 1 A 54 54 GLU C C 54 180.361 179.320 1.041 1
1 502 . 13 1 1 A 54 54 GLU CA C 54 59.497 58.950 0.547 1
1 503 . 13 1 1 A 54 54 GLU CB C 54 30.708 29.738 0.970 1
1 504 . 13 1 1 A 54 54 GLU N N 54 121.949 122.010 -0.061 1
1 505 . 13 1 1 A 55 55 PHE H H 55 8.133 8.021 0.112 1
1 506 . 13 1 1 A 55 55 PHE HA H 55 4.007 4.165 -0.158 1
1 513 . 13 1 1 A 55 55 PHE C C 55 176.531 178.654 -2.123 1
1 514 . 13 1 1 A 55 55 PHE CA C 55 61.848 59.984 1.864 1
1 515 . 13 1 1 A 55 55 PHE CB C 55 38.847 38.157 0.690 1
1 516 . 13 1 1 A 55 55 PHE N N 55 119.998 119.531 0.467 1
1 517 . 13 1 1 A 56 56 HIS H H 56 7.907 8.307 -0.400 1
1 518 . 13 1 1 A 56 56 HIS HA H 56 3.324 4.071 -0.747 1
1 522 . 13 1 1 A 56 56 HIS C C 56 176.748 177.084 -0.336 1
1 523 . 13 1 1 A 56 56 HIS CA C 56 58.770 60.236 -1.466 1
1 524 . 13 1 1 A 56 56 HIS CB C 56 30.404 29.334 1.070 1
1 525 . 13 1 1 A 56 56 HIS N N 56 119.173 118.899 0.274 1
1 526 . 13 1 1 A 57 57 ALA H H 57 7.962 7.996 -0.034 1
1 527 . 13 1 1 A 57 57 ALA HA H 57 3.865 3.897 -0.032 1
1 531 . 13 1 1 A 57 57 ALA C C 57 180.075 179.794 0.281 1
1 532 . 13 1 1 A 57 57 ALA CA C 57 54.996 55.265 -0.269 1
1 533 . 13 1 1 A 57 57 ALA CB C 57 18.226 17.997 0.229 1
1 534 . 13 1 1 A 57 57 ALA N N 57 120.094 121.144 -1.050 1
1 535 . 13 1 1 A 58 58 LEU H H 58 7.295 8.263 -0.968 1
1 536 . 13 1 1 A 58 58 LEU HA H 58 3.994 3.902 0.092 1
1 546 . 13 1 1 A 58 58 LEU C C 58 177.428 178.500 -1.072 1
1 547 . 13 1 1 A 58 58 LEU CA C 58 58.342 57.892 0.450 1
1 548 . 13 1 1 A 58 58 LEU CB C 58 40.851 41.463 -0.612 1
1 552 . 13 1 1 A 58 58 LEU N N 58 119.404 120.221 -0.817 1
1 553 . 13 1 1 A 59 59 HIS H H 59 7.805 8.362 -0.557 1
1 554 . 13 1 1 A 59 59 HIS HA H 59 4.286 4.006 0.280 1
1 558 . 13 1 1 A 59 59 HIS C C 59 177.001 177.318 -0.317 1
1 559 . 13 1 1 A 59 59 HIS CA C 59 60.141 60.015 0.126 1
1 560 . 13 1 1 A 59 59 HIS CB C 59 31.072 29.848 1.224 1
1 561 . 13 1 1 A 59 59 HIS N N 59 119.040 118.028 1.012 1
1 562 . 13 1 1 A 60 60 LYS H H 60 7.715 7.961 -0.246 1
1 563 . 13 1 1 A 60 60 LYS HA H 60 3.456 3.764 -0.308 1
1 570 . 13 1 1 A 60 60 LYS C C 60 178.464 179.299 -0.835 1
1 571 . 13 1 1 A 60 60 LYS CA C 60 59.629 59.400 0.229 1
1 572 . 13 1 1 A 60 60 LYS CB C 60 32.354 31.668 0.686 1
1 576 . 13 1 1 A 60 60 LYS N N 60 114.225 118.625 -4.400 1
1 577 . 13 1 1 A 61 61 ARG H H 61 7.486 7.534 -0.048 1
1 578 . 13 1 1 A 61 61 ARG HA H 61 4.202 4.018 0.184 1
1 584 . 13 1 1 A 61 61 ARG C C 61 178.995 179.208 -0.213 1
1 585 . 13 1 1 A 61 61 ARG CA C 61 58.387 59.156 -0.769 1
1 586 . 13 1 1 A 61 61 ARG CB C 61 31.216 30.490 0.726 1
1 589 . 13 1 1 A 61 61 ARG N N 61 115.929 118.849 -2.920 1
1 590 . 13 1 1 A 62 62 ILE H H 62 8.066 7.661 0.405 1
1 591 . 13 1 1 A 62 62 ILE HA H 62 4.491 3.884 0.607 1
1 601 . 13 1 1 A 62 62 ILE C C 62 177.838 177.231 0.607 1
1 602 . 13 1 1 A 62 62 ILE CA C 62 63.399 63.931 -0.532 1
1 603 . 13 1 1 A 62 62 ILE CB C 62 39.699 37.417 2.282 1
1 606 . 13 1 1 A 62 62 ILE N N 62 111.456 116.451 -4.995 1
1 607 . 13 1 1 A 63 63 LYS H H 63 8.158 8.492 -0.334 1
1 608 . 13 1 1 A 63 63 LYS HA H 63 4.136 3.883 0.253 1
1 615 . 13 1 1 A 63 63 LYS C C 63 176.358 178.015 -1.657 1
1 616 . 13 1 1 A 63 63 LYS CA C 63 58.753 58.313 0.440 1
1 617 . 13 1 1 A 63 63 LYS CB C 63 30.825 31.259 -0.434 1
1 621 . 13 1 1 A 63 63 LYS N N 63 120.800 123.337 -2.537 1
1 622 . 13 1 1 A 64 64 LYS H H 64 7.687 7.612 0.075 1
1 623 . 13 1 1 A 64 64 LYS HA H 64 4.301 4.167 0.134 1
1 628 . 13 1 1 A 64 64 LYS C C 64 177.084 178.174 -1.090 1
1 629 . 13 1 1 A 64 64 LYS CA C 64 57.237 57.949 -0.712 1
1 630 . 13 1 1 A 64 64 LYS CB C 64 32.502 32.579 -0.077 1
1 634 . 13 1 1 A 64 64 LYS N N 64 116.548 119.597 -3.049 1
1 635 . 13 1 1 A 65 65 LEU H H 65 7.476 8.143 -0.667 1
1 636 . 13 1 1 A 65 65 LEU HA H 65 4.219 4.363 -0.144 1
1 645 . 13 1 1 A 65 65 LEU C C 65 175.886 175.990 -0.104 1
1 646 . 13 1 1 A 65 65 LEU CA C 65 55.542 56.843 -1.301 1
1 647 . 13 1 1 A 65 65 LEU CB C 65 45.493 43.703 1.790 1
1 650 . 13 1 1 A 65 65 LEU N N 65 118.000 120.542 -2.542 1
1 651 . 13 1 1 A 66 66 TYR H H 66 7.672 8.501 -0.829 1
1 652 . 13 1 1 A 66 66 TYR HA H 66 4.762 5.113 -0.351 1
1 660 . 13 1 1 A 66 66 TYR C C 66 174.199 174.489 -0.290 1
1 661 . 13 1 1 A 66 66 TYR CA C 66 56.013 55.369 0.644 1
1 662 . 13 1 1 A 66 66 TYR CB C 66 40.380 41.067 -0.687 1
1 663 . 13 1 1 A 66 66 TYR N N 66 116.805 113.732 3.073 1
1 664 . 13 1 1 A 67 67 LYS H H 67 8.547 8.410 0.137 1
1 665 . 13 1 1 A 67 67 LYS HA H 67 4.436 4.198 0.238 1
1 670 . 13 1 1 A 67 67 LYS C C 67 175.727 175.937 -0.210 1
1 671 . 13 1 1 A 67 67 LYS CA C 67 56.598 56.732 -0.134 1
1 672 . 13 1 1 A 67 67 LYS CB C 67 32.743 32.146 0.597 1
1 676 . 13 1 1 A 67 67 LYS N N 67 120.929 120.097 0.832 1
1 677 . 13 1 1 A 68 68 VAL H H 68 8.168 8.090 0.078 1
1 678 . 13 1 1 A 68 68 VAL HA H 68 4.869 4.358 0.511 1
1 686 . 13 1 1 A 68 68 VAL CA C 68 57.389 58.875 -1.486 1
1 687 . 13 1 1 A 68 68 VAL CB C 68 34.017 35.106 -1.089 1
1 690 . 13 1 1 A 68 68 VAL N N 68 116.467 123.610 -7.143 1
1 691 . 13 1 1 A 69 69 PRO HA H 69 4.674 4.696 -0.022 1
1 696 . 13 1 1 A 69 69 PRO C C 69 178.013 177.126 0.887 1
1 697 . 13 1 1 A 69 69 PRO CA C 69 61.443 62.734 -1.291 1
1 698 . 13 1 1 A 69 69 PRO CB C 69 32.231 31.281 0.950 1
1 701 . 13 1 1 A 70 70 ASP H H 70 8.167 8.906 -0.739 1
1 702 . 13 1 1 A 70 70 ASP HA H 70 4.531 4.544 -0.013 1
1 705 . 13 1 1 A 70 70 ASP C C 70 175.660 175.317 0.343 1
1 706 . 13 1 1 A 70 70 ASP CA C 70 55.148 55.386 -0.238 1
1 707 . 13 1 1 A 70 70 ASP CB C 70 40.876 40.438 0.438 1
1 708 . 13 1 1 A 70 70 ASP N N 70 116.671 124.736 -8.065 1
1 709 . 13 1 1 A 71 71 PHE H H 71 8.387 8.266 0.121 1
1 710 . 13 1 1 A 71 71 PHE HA H 71 4.076 5.338 -1.262 1
1 717 . 13 1 1 A 71 71 PHE CA C 71 55.672 55.263 0.409 1
1 718 . 13 1 1 A 71 71 PHE CB C 71 39.155 41.286 -2.131 1
1 719 . 13 1 1 A 71 71 PHE N N 71 126.533 116.686 9.847 1
1 720 . 13 1 1 A 72 72 PRO HA H 72 4.156 4.108 0.048 1
1 727 . 13 1 1 A 72 72 PRO CA C 72 63.079 61.904 1.175 1
1 728 . 13 1 1 A 72 72 PRO CB C 72 32.107 32.134 -0.027 1
1 731 . 13 1 1 A 73 73 SER H H 73 8.468 8.485 -0.017 1
1 733 . 13 1 1 A 73 73 SER CA C 73 56.133 58.172 -2.039 1
1 734 . 13 1 1 A 73 73 SER CB C 73 63.991 63.758 0.233 1
1 735 . 13 1 1 A 73 73 SER N N 73 121.533 117.641 3.892 1
1 736 . 13 1 1 A 74 74 LYS HA H 74 4.574 3.963 0.611 1
1 739 . 13 1 1 A 74 74 LYS CA C 74 55.659 58.519 -2.860 1
1 740 . 13 1 1 A 74 74 LYS CB C 74 30.550 32.362 -1.812 1
1 741 . 13 1 1 A 75 75 ARG H H 75 7.962 7.491 0.471 1
1 742 . 13 1 1 A 75 75 ARG HA H 75 4.162 4.665 -0.503 1
1 746 . 13 1 1 A 75 75 ARG CA C 75 56.123 55.149 0.974 1
1 747 . 13 1 1 A 75 75 ARG CB C 75 31.179 31.541 -0.362 1
1 749 . 13 1 1 A 75 75 ARG N N 75 121.665 121.520 0.145 1
1 750 . 13 1 1 A 76 76 LEU H H 76 8.071 8.292 -0.221 1
1 751 . 13 1 1 A 76 76 LEU HA H 76 4.618 4.848 -0.230 1
1 759 . 13 1 1 A 76 76 LEU CA C 76 52.764 51.456 1.308 1
1 760 . 13 1 1 A 76 76 LEU CB C 76 41.918 45.405 -3.487 1
1 762 . 13 1 1 A 76 76 LEU N N 76 124.196 127.561 -3.365 1
1 763 . 13 1 1 A 77 77 PRO HA H 77 4.393 4.483 -0.090 1
1 767 . 13 1 1 A 77 77 PRO CA C 77 63.746 62.767 0.979 1
1 770 . 13 1 1 A 78 78 ASN H H 78 8.379 9.058 -0.679 1
1 771 . 13 1 1 A 78 78 ASN HA H 78 4.586 4.488 0.098 1
1 776 . 13 1 1 A 78 78 ASN C C 78 175.648 175.174 0.474 1
1 777 . 13 1 1 A 78 78 ASN CA C 78 53.591 55.625 -2.034 1
1 778 . 13 1 1 A 78 78 ASN CB C 78 37.826 39.361 -1.535 1
1 779 . 13 1 1 A 78 78 ASN N N 78 115.292 121.826 -6.534 1
1 781 . 13 1 1 A 79 79 TRP H H 79 7.900 7.966 -0.066 1
1 782 . 13 1 1 A 79 79 TRP HA H 79 4.326 4.327 -0.001 1
1 788 . 13 1 1 A 79 79 TRP CA C 79 58.825 58.428 0.397 1
1 789 . 13 1 1 A 79 79 TRP CB C 79 29.090 28.976 0.114 1
1 790 . 13 1 1 A 79 79 TRP N N 79 119.525 119.658 -0.133 1
1 792 . 13 1 1 A 80 80 ARG H H 80 8.060 7.929 0.131 1
1 793 . 13 1 1 A 80 80 ARG HA H 80 3.913 4.100 -0.187 1
1 798 . 13 1 1 A 80 80 ARG C C 80 177.024 178.631 -1.607 1
1 799 . 13 1 1 A 80 80 ARG CA C 80 58.292 59.299 -1.007 1
1 800 . 13 1 1 A 80 80 ARG CB C 80 30.146 29.911 0.235 1
1 803 . 13 1 1 A 80 80 ARG N N 80 118.864 120.549 -1.685 1
1 804 . 13 1 1 A 81 81 THR H H 81 7.725 7.423 0.302 1
1 805 . 13 1 1 A 81 81 THR HA H 81 4.297 4.187 0.110 1
1 809 . 13 1 1 A 81 81 THR CA C 81 62.481 64.913 -2.432 1
1 811 . 13 1 1 A 81 81 THR N N 81 109.863 114.416 -4.553 1
1 812 . 13 1 1 A 82 82 ARG HA H 82 4.341 4.549 -0.208 1
1 816 . 13 1 1 A 82 82 ARG C C 82 177.261 175.295 1.966 1
1 817 . 13 1 1 A 82 82 ARG CA C 82 56.846 53.562 3.284 1
1 818 . 13 1 1 A 82 82 ARG CB C 82 30.288 32.555 -2.267 1
1 820 . 13 1 1 A 83 83 GLY H H 83 8.321 8.779 -0.458 1
1 821 . 13 1 1 A 83 83 GLY HA2 H 83 3.957 4.337 -0.380 1
1 822 . 13 1 1 A 83 83 GLY C C 83 175.185 175.366 -0.181 1
1 823 . 13 1 1 A 83 83 GLY CA C 83 46.297 44.342 1.955 1
1 824 . 13 1 1 A 83 83 GLY N N 83 109.146 107.579 1.567 1
1 825 . 13 1 1 A 84 84 LEU H H 84 8.303 8.778 -0.475 1
1 826 . 13 1 1 A 84 84 LEU HA H 84 4.018 4.197 -0.179 1
1 835 . 13 1 1 A 84 84 LEU C C 84 178.552 178.493 0.059 1
1 836 . 13 1 1 A 84 84 LEU CA C 84 58.236 57.135 1.101 1
1 837 . 13 1 1 A 84 84 LEU CB C 84 41.837 41.680 0.157 1
1 840 . 13 1 1 A 84 84 LEU N N 84 122.662 122.127 0.535 1
1 841 . 13 1 1 A 85 85 GLU H H 85 8.233 8.498 -0.265 1
1 842 . 13 1 1 A 85 85 GLU HA H 85 4.371 3.994 0.377 1
1 846 . 13 1 1 A 85 85 GLU C C 85 178.555 179.467 -0.912 1
1 847 . 13 1 1 A 85 85 GLU CA C 85 58.377 59.870 -1.493 1
1 848 . 13 1 1 A 85 85 GLU CB C 85 28.675 29.269 -0.594 1
1 850 . 13 1 1 A 85 85 GLU N N 85 119.781 119.517 0.264 1
1 851 . 13 1 1 A 86 86 GLN H H 86 7.877 8.117 -0.240 1
1 852 . 13 1 1 A 86 86 GLN HA H 86 4.100 4.151 -0.051 1
1 858 . 13 1 1 A 86 86 GLN C C 86 179.557 178.140 1.417 1
1 859 . 13 1 1 A 86 86 GLN CA C 86 58.955 59.163 -0.208 1
1 860 . 13 1 1 A 86 86 GLN CB C 86 28.191 28.824 -0.633 1
1 862 . 13 1 1 A 86 86 GLN N N 86 118.042 118.712 -0.670 1
1 863 . 13 1 1 A 87 87 ARG H H 87 8.169 7.882 0.287 1
1 864 . 13 1 1 A 87 87 ARG HA H 87 3.975 3.744 0.231 1
1 868 . 13 1 1 A 87 87 ARG C C 87 177.051 178.329 -1.278 1
1 869 . 13 1 1 A 87 87 ARG CA C 87 59.006 58.843 0.163 1
1 870 . 13 1 1 A 87 87 ARG CB C 87 30.383 28.892 1.491 1
1 872 . 13 1 1 A 87 87 ARG N N 87 121.381 119.485 1.896 1
1 873 . 13 1 1 A 88 88 ARG H H 88 8.593 8.016 0.577 1
1 874 . 13 1 1 A 88 88 ARG HA H 88 3.726 3.775 -0.049 1
1 876 . 13 1 1 A 88 88 ARG C C 88 177.520 178.617 -1.097 1
1 877 . 13 1 1 A 88 88 ARG CA C 88 60.751 59.235 1.516 1
1 878 . 13 1 1 A 88 88 ARG CB C 88 30.153 29.853 0.300 1
1 879 . 13 1 1 A 88 88 ARG N N 88 120.863 119.930 0.933 1
1 880 . 13 1 1 A 89 89 GLN H H 89 8.355 7.569 0.786 1
1 881 . 13 1 1 A 89 89 GLN HA H 89 3.887 3.980 -0.093 1
1 887 . 13 1 1 A 89 89 GLN C C 89 179.499 178.471 1.028 1
1 888 . 13 1 1 A 89 89 GLN CA C 89 59.603 59.576 0.027 1
1 889 . 13 1 1 A 89 89 GLN CB C 89 28.464 27.984 0.480 1
1 891 . 13 1 1 A 89 89 GLN N N 89 116.860 119.072 -2.212 1
1 893 . 13 1 1 A 90 90 GLY H H 90 8.406 8.023 0.383 1
1 894 . 13 1 1 A 90 90 GLY HA2 H 90 3.672 3.704 -0.032 1
1 895 . 13 1 1 A 90 90 GLY HA3 H 90 3.871 3.808 0.063 1
1 896 . 13 1 1 A 90 90 GLY C C 90 177.033 175.783 1.250 1
1 897 . 13 1 1 A 90 90 GLY CA C 90 46.813 47.225 -0.412 1
1 898 . 13 1 1 A 90 90 GLY N N 90 107.679 107.199 0.480 1
1 899 . 13 1 1 A 91 91 LEU H H 91 8.504 7.968 0.536 1
1 900 . 13 1 1 A 91 91 LEU HA H 91 3.784 4.031 -0.247 1
1 910 . 13 1 1 A 91 91 LEU C C 91 178.003 179.514 -1.511 1
1 911 . 13 1 1 A 91 91 LEU CA C 91 57.354 57.747 -0.393 1
1 912 . 13 1 1 A 91 91 LEU CB C 91 40.359 41.345 -0.986 1
1 916 . 13 1 1 A 91 91 LEU N N 91 123.959 121.465 2.494 1
1 917 . 13 1 1 A 92 92 GLU H H 92 8.324 8.853 -0.529 1
1 918 . 13 1 1 A 92 92 GLU HA H 92 3.732 3.890 -0.158 1
1 922 . 13 1 1 A 92 92 GLU C C 92 177.272 178.485 -1.213 1
1 923 . 13 1 1 A 92 92 GLU CA C 92 60.651 59.763 0.888 1
1 924 . 13 1 1 A 92 92 GLU CB C 92 30.843 29.391 1.452 1
1 926 . 13 1 1 A 92 92 GLU N N 92 121.991 120.917 1.074 1
1 927 . 13 1 1 A 93 93 ALA H H 93 8.126 8.084 0.042 1
1 928 . 13 1 1 A 93 93 ALA HA H 93 4.160 4.050 0.110 1
1 932 . 13 1 1 A 93 93 ALA C C 93 180.818 179.430 1.388 1
1 933 . 13 1 1 A 93 93 ALA CA C 93 54.828 55.068 -0.240 1
1 934 . 13 1 1 A 93 93 ALA CB C 93 18.032 18.498 -0.466 1
1 935 . 13 1 1 A 93 93 ALA N N 93 120.066 121.520 -1.454 1
1 936 . 13 1 1 A 94 94 TYR H H 94 7.916 8.123 -0.207 1
1 937 . 13 1 1 A 94 94 TYR HA H 94 4.139 4.316 -0.177 1
1 942 . 13 1 1 A 94 94 TYR C C 94 175.895 178.533 -2.638 1
1 943 . 13 1 1 A 94 94 TYR CA C 94 61.915 61.656 0.259 1
1 944 . 13 1 1 A 94 94 TYR CB C 94 38.740 38.056 0.684 1
1 945 . 13 1 1 A 94 94 TYR N N 94 121.179 115.914 5.265 1
1 946 . 13 1 1 A 95 95 ILE H H 95 7.983 8.707 -0.724 1
1 947 . 13 1 1 A 95 95 ILE HA H 95 3.614 3.776 -0.162 1
1 957 . 13 1 1 A 95 95 ILE C C 95 174.678 178.357 -3.679 1
1 958 . 13 1 1 A 95 95 ILE CA C 95 63.461 64.852 -1.391 1
1 959 . 13 1 1 A 95 95 ILE CB C 95 36.625 36.944 -0.319 1
1 963 . 13 1 1 A 95 95 ILE N N 95 116.397 120.129 -3.732 1
1 964 . 13 1 1 A 96 96 GLN H H 96 8.175 8.085 0.090 1
1 965 . 13 1 1 A 96 96 GLN HA H 96 3.763 4.067 -0.304 1
1 970 . 13 1 1 A 96 96 GLN C C 96 179.042 178.533 0.509 1
1 971 . 13 1 1 A 96 96 GLN CA C 96 59.270 59.873 -0.603 1
1 972 . 13 1 1 A 96 96 GLN CB C 96 27.696 28.076 -0.380 1
1 974 . 13 1 1 A 96 96 GLN N N 96 116.631 120.564 -3.933 1
1 976 . 13 1 1 A 97 97 GLY H H 97 8.222 8.442 -0.220 1
1 977 . 13 1 1 A 97 97 GLY HA2 H 97 3.661 3.712 -0.051 1
1 978 . 13 1 1 A 97 97 GLY HA3 H 97 3.806 3.744 0.062 1
1 979 . 13 1 1 A 97 97 GLY C C 97 175.449 176.023 -0.574 1
1 980 . 13 1 1 A 97 97 GLY CA C 97 46.917 47.351 -0.434 1
1 981 . 13 1 1 A 97 97 GLY N N 97 107.315 106.918 0.397 1
1 982 . 13 1 1 A 98 98 ILE H H 98 7.630 7.855 -0.225 1
1 983 . 13 1 1 A 98 98 ILE HA H 98 3.399 3.879 -0.480 1
1 993 . 13 1 1 A 98 98 ILE C C 98 178.683 177.909 0.774 1
1 994 . 13 1 1 A 98 98 ILE CA C 98 66.402 64.724 1.678 1
1 995 . 13 1 1 A 98 98 ILE CB C 98 38.037 37.278 0.759 1
1 999 . 13 1 1 A 98 98 ILE N N 98 120.644 120.474 0.170 1
1 1000 . 13 1 1 A 99 99 LEU H H 99 7.076 7.869 -0.793 1
1 1001 . 13 1 1 A 99 99 LEU HA H 99 4.133 4.097 0.036 1
1 1010 . 13 1 1 A 99 99 LEU C C 99 178.128 177.723 0.405 1
1 1011 . 13 1 1 A 99 99 LEU CA C 99 57.129 57.474 -0.345 1
1 1012 . 13 1 1 A 99 99 LEU CB C 99 41.108 41.419 -0.311 1
1 1014 . 13 1 1 A 99 99 LEU N N 99 116.844 121.272 -4.428 1
1 1015 . 13 1 1 A 100 100 TYR H H 100 7.890 8.015 -0.125 1
1 1016 . 13 1 1 A 100 100 TYR HA H 100 4.550 4.270 0.280 1
1 1021 . 13 1 1 A 100 100 TYR C C 100 178.210 177.537 0.673 1
1 1022 . 13 1 1 A 100 100 TYR CA C 100 59.452 60.351 -0.899 1
1 1023 . 13 1 1 A 100 100 TYR CB C 100 38.786 39.245 -0.459 1
1 1024 . 13 1 1 A 100 100 TYR N N 100 116.427 120.594 -4.167 1
1 1025 . 13 1 1 A 101 101 LEU H H 101 8.041 8.227 -0.186 1
1 1026 . 13 1 1 A 101 101 LEU HA H 101 4.158 3.764 0.394 1
1 1036 . 13 1 1 A 101 101 LEU C C 101 176.808 177.587 -0.779 1
1 1037 . 13 1 1 A 101 101 LEU CA C 101 56.156 58.210 -2.054 1
1 1038 . 13 1 1 A 101 101 LEU CB C 101 44.307 41.656 2.651 1
1 1041 . 13 1 1 A 101 101 LEU N N 101 116.493 120.291 -3.798 1
1 1042 . 13 1 1 A 102 102 ASN H H 102 7.146 7.917 -0.771 1
1 1043 . 13 1 1 A 102 102 ASN HA H 102 5.056 5.096 -0.040 1
1 1046 . 13 1 1 A 102 102 ASN CA C 102 52.704 54.957 -2.253 1
1 1047 . 13 1 1 A 102 102 ASN CB C 102 42.424 40.352 2.072 1
1 1048 . 13 1 1 A 102 102 ASN N N 102 114.922 114.611 0.311 1
1 1049 . 13 1 1 A 103 103 GLN H H 103 8.477 8.158 0.319 1
1 1050 . 13 1 1 A 103 103 GLN HA H 103 3.866 4.428 -0.562 1
1 1054 . 13 1 1 A 103 103 GLN C C 103 176.110 175.179 0.931 1
1 1055 . 13 1 1 A 103 103 GLN CA C 103 58.451 57.141 1.310 1
1 1056 . 13 1 1 A 103 103 GLN CB C 103 28.896 28.594 0.302 1
1 1058 . 13 1 1 A 103 103 GLN N N 103 120.252 116.872 3.380 1
1 1059 . 13 1 1 A 104 104 GLU H H 104 7.930 7.598 0.332 1
1 1060 . 13 1 1 A 104 104 GLU HA H 104 4.591 4.494 0.097 1
1 1064 . 13 1 1 A 104 104 GLU C C 104 175.397 173.853 1.544 1
1 1065 . 13 1 1 A 104 104 GLU CA C 104 54.058 55.993 -1.935 1
1 1066 . 13 1 1 A 104 104 GLU CB C 104 31.272 31.683 -0.411 1
1 1068 . 13 1 1 A 104 104 GLU N N 104 117.295 118.409 -1.114 1
1 1069 . 13 1 1 A 105 105 VAL H H 105 8.546 8.303 0.243 1
1 1070 . 13 1 1 A 105 105 VAL HA H 105 3.823 4.234 -0.411 1
1 1078 . 13 1 1 A 105 105 VAL CA C 105 60.706 60.268 0.438 1
1 1079 . 13 1 1 A 105 105 VAL CB C 105 32.126 32.830 -0.704 1
1 1082 . 13 1 1 A 105 105 VAL N N 105 124.511 120.766 3.745 1
1 1083 . 13 1 1 A 106 106 PRO HA H 106 3.997 4.409 -0.412 1
1 1089 . 13 1 1 A 106 106 PRO C C 106 178.240 177.733 0.507 1
1 1090 . 13 1 1 A 106 106 PRO CA C 106 62.961 63.353 -0.392 1
1 1091 . 13 1 1 A 106 106 PRO CB C 106 32.321 32.225 0.096 1
1 1094 . 13 1 1 A 107 107 LYS H H 107 9.122 8.851 0.271 1
1 1095 . 13 1 1 A 107 107 LYS HA H 107 3.813 3.894 -0.081 1
1 1101 . 13 1 1 A 107 107 LYS C C 107 178.563 177.847 0.716 1
1 1102 . 13 1 1 A 107 107 LYS CA C 107 60.085 59.301 0.784 1
1 1103 . 13 1 1 A 107 107 LYS CB C 107 31.632 32.327 -0.695 1
1 1106 . 13 1 1 A 107 107 LYS N N 107 129.017 125.098 3.919 1
1 1107 . 13 1 1 A 108 108 GLU H H 108 10.370 8.085 2.285 1
1 1108 . 13 1 1 A 108 108 GLU HA H 108 3.991 4.095 -0.104 1
1 1111 . 13 1 1 A 108 108 GLU C C 108 180.366 178.761 1.605 1
1 1112 . 13 1 1 A 108 108 GLU CA C 108 60.337 59.014 1.323 1
1 1113 . 13 1 1 A 108 108 GLU CB C 108 29.178 29.384 -0.206 1
1 1115 . 13 1 1 A 108 108 GLU N N 108 118.335 118.853 -0.518 1
1 1116 . 13 1 1 A 109 109 LEU H H 109 7.393 7.872 -0.479 1
1 1117 . 13 1 1 A 109 109 LEU HA H 109 4.220 4.142 0.078 1
1 1126 . 13 1 1 A 109 109 LEU C C 109 177.378 178.951 -1.573 1
1 1127 . 13 1 1 A 109 109 LEU CA C 109 56.618 57.817 -1.199 1
1 1128 . 13 1 1 A 109 109 LEU CB C 109 41.898 41.154 0.744 1
1 1131 . 13 1 1 A 109 109 LEU N N 109 118.285 120.443 -2.158 1
1 1132 . 13 1 1 A 110 110 LEU H H 110 7.641 7.590 0.051 1
1 1133 . 13 1 1 A 110 110 LEU HA H 110 3.796 3.989 -0.193 1
1 1142 . 13 1 1 A 110 110 LEU C C 110 179.103 178.549 0.554 1
1 1143 . 13 1 1 A 110 110 LEU CA C 110 59.046 58.437 0.609 1
1 1144 . 13 1 1 A 110 110 LEU CB C 110 40.228 41.488 -1.260 1
1 1147 . 13 1 1 A 110 110 LEU N N 110 120.162 121.558 -1.396 1
1 1148 . 13 1 1 A 111 111 GLU H H 111 7.916 7.917 -0.001 1
1 1149 . 13 1 1 A 111 111 GLU HA H 111 4.080 4.220 -0.140 1
1 1153 . 13 1 1 A 111 111 GLU C C 111 179.967 178.881 1.086 1
1 1154 . 13 1 1 A 111 111 GLU CA C 111 59.243 58.594 0.649 1
1 1155 . 13 1 1 A 111 111 GLU CB C 111 29.576 29.548 0.028 1
1 1157 . 13 1 1 A 111 111 GLU N N 111 117.360 118.075 -0.715 1
1 1158 . 13 1 1 A 112 112 PHE H H 112 7.712 7.804 -0.092 1
1 1159 . 13 1 1 A 112 112 PHE HA H 112 4.224 4.203 0.021 1
1 1164 . 13 1 1 A 112 112 PHE C C 112 177.180 176.928 0.252 1
1 1165 . 13 1 1 A 112 112 PHE CA C 112 61.407 61.158 0.249 1
1 1166 . 13 1 1 A 112 112 PHE CB C 112 40.172 39.540 0.632 1
1 1167 . 13 1 1 A 112 112 PHE N N 112 123.042 122.334 0.708 1
1 1168 . 13 1 1 A 113 113 LEU H H 113 8.056 7.809 0.247 1
1 1169 . 13 1 1 A 113 113 LEU HA H 113 4.147 4.334 -0.187 1
1 1175 . 13 1 1 A 113 113 LEU C C 113 173.717 176.077 -2.360 1
1 1176 . 13 1 1 A 113 113 LEU CA C 113 54.093 54.505 -0.412 1
1 1177 . 13 1 1 A 113 113 LEU CB C 113 41.517 42.095 -0.578 1
1 1179 . 13 1 1 A 113 113 LEU N N 113 115.595 117.295 -1.700 1
1 1180 . 13 1 1 A 114 114 ARG H H 114 7.902 8.062 -0.160 1
1 1181 . 13 1 1 A 114 114 ARG HA H 114 3.817 4.062 -0.245 1
1 1182 . 13 1 1 A 114 114 ARG C C 114 174.566 176.357 -1.791 1
1 1183 . 13 1 1 A 114 114 ARG CA C 114 57.233 57.282 -0.049 1
1 1184 . 13 1 1 A 114 114 ARG CB C 114 27.788 29.466 -1.678 1
1 1185 . 13 1 1 A 114 114 ARG N N 114 116.021 118.628 -2.607 1
1 1186 . 13 1 1 A 115 115 LEU H H 115 8.160 7.840 0.320 1
1 1187 . 13 1 1 A 115 115 LEU HA H 115 4.462 4.383 0.079 1
1 1195 . 13 1 1 A 115 115 LEU C C 115 176.374 177.281 -0.907 1
1 1196 . 13 1 1 A 115 115 LEU CA C 115 53.965 57.157 -3.192 1
1 1197 . 13 1 1 A 115 115 LEU CB C 115 44.077 41.816 2.261 1
1 1199 . 13 1 1 A 115 115 LEU N N 115 118.089 119.056 -0.967 1
1 1200 . 13 1 1 A 116 116 ARG H H 116 8.066 7.730 0.336 1
1 1201 . 13 1 1 A 116 116 ARG HA H 116 4.172 3.947 0.225 1
1 1203 . 13 1 1 A 116 116 ARG CA C 116 55.961 58.457 -2.496 1
1 1204 . 13 1 1 A 116 116 ARG CB C 116 31.379 29.982 1.397 1
1 1205 . 13 1 1 A 116 116 ARG N N 116 120.852 120.656 0.196 1
1 1206 . 13 1 1 A 117 117 HIS H H 117 7.928 8.994 -1.066 1
1 1207 . 13 1 1 A 117 117 HIS HA H 117 4.557 4.204 0.353 1
1 1211 . 13 1 1 A 117 117 HIS CA C 117 55.937 56.827 -0.890 1
1 1212 . 13 1 1 A 117 117 HIS CB C 117 30.875 28.199 2.676 1
1 1213 . 13 1 1 A 118 118 PHE H H 118 8.183 8.024 0.159 1
1 1214 . 13 1 1 A 118 118 PHE HA H 118 4.730 4.788 -0.058 1
1 1219 . 13 1 1 A 118 118 PHE CA C 118 55.716 56.399 -0.683 1
1 1220 . 13 1 1 A 118 118 PHE CB C 118 39.263 40.453 -1.190 1
1 1221 . 13 1 1 A 118 118 PHE N N 118 123.480 124.255 -0.775 1
1 1222 . 13 1 1 A 119 119 PRO HA H 119 4.398 4.241 0.157 1
1 1227 . 13 1 1 A 119 119 PRO C C 119 176.666 176.776 -0.110 1
1 1228 . 13 1 1 A 119 119 PRO CA C 119 63.377 63.737 -0.360 1
1 1229 . 13 1 1 A 119 119 PRO CB C 119 32.059 31.784 0.275 1
1 1232 . 13 1 1 A 120 120 THR H H 120 8.054 7.321 0.733 1
1 1233 . 13 1 1 A 120 120 THR HA H 120 4.273 3.596 0.677 1
1 1238 . 13 1 1 A 120 120 THR C C 120 174.154 173.274 0.880 1
1 1239 . 13 1 1 A 120 120 THR CA C 120 61.893 62.179 -0.286 1
1 1240 . 13 1 1 A 120 120 THR CB C 120 69.736 67.817 1.919 1
1 1242 . 13 1 1 A 120 120 THR N N 120 113.088 110.986 2.102 1
1 1243 . 13 1 1 A 121 121 ASP H H 121 8.209 8.109 0.100 1
1 1244 . 13 1 1 A 121 121 ASP HA H 121 4.876 5.453 -0.577 1
1 1247 . 13 1 1 A 121 121 ASP CA C 121 52.126 51.401 0.725 1
1 1248 . 13 1 1 A 121 121 ASP CB C 121 41.553 42.351 -0.798 1
1 1249 . 13 1 1 A 121 121 ASP N N 121 123.630 124.309 -0.679 1
1 1250 . 13 1 1 A 122 122 PRO HA H 122 4.363 4.875 -0.512 1
1 1255 . 13 1 1 A 122 122 PRO C C 122 177.344 176.256 1.088 1
1 1256 . 13 1 1 A 122 122 PRO CA C 122 63.913 62.250 1.663 1
1 1257 . 13 1 1 A 122 122 PRO CB C 122 32.116 33.242 -1.126 1
1 1260 . 13 1 1 A 123 123 LYS H H 123 8.344 8.521 -0.177 1
1 1261 . 13 1 1 A 123 123 LYS HA H 123 4.244 4.733 -0.489 1
1 1266 . 13 1 1 A 123 123 LYS C C 123 176.637 174.734 1.903 1
1 1267 . 13 1 1 A 123 123 LYS CA C 123 56.359 54.861 1.498 1
1 1268 . 13 1 1 A 123 123 LYS CB C 123 32.367 33.168 -0.801 1
1 1272 . 13 1 1 A 123 123 LYS N N 123 119.110 121.124 -2.014 1
1 1273 . 13 1 1 A 124 124 ALA H H 124 7.929 8.662 -0.733 1
1 1274 . 13 1 1 A 124 124 ALA HA H 124 4.248 4.573 -0.325 1
1 1278 . 13 1 1 A 124 124 ALA C C 124 177.648 176.380 1.268 1
1 1279 . 13 1 1 A 124 124 ALA CA C 124 52.618 51.563 1.055 1
1 1280 . 13 1 1 A 124 124 ALA CB C 124 19.379 18.199 1.180 1
1 1281 . 13 1 1 A 124 124 ALA N N 124 123.825 129.051 -5.226 1
1 1282 . 13 1 1 A 125 125 SER H H 125 8.134 7.852 0.282 1
1 1283 . 13 1 1 A 125 125 SER HA H 125 4.341 4.920 -0.579 1
1 1286 . 13 1 1 A 125 125 SER C C 125 174.172 172.546 1.626 1
1 1287 . 13 1 1 A 125 125 SER CA C 125 58.391 57.930 0.461 1
1 1288 . 13 1 1 A 125 125 SER CB C 125 63.748 64.942 -1.194 1
1 1289 . 13 1 1 A 125 125 SER N N 125 114.454 117.685 -3.231 1
1 1290 . 13 1 1 A 126 126 ASN H H 126 8.242 9.180 -0.938 1
1 1291 . 13 1 1 A 126 126 ASN HA H 126 4.657 5.101 -0.444 1
1 1294 . 13 1 1 A 126 126 ASN C C 126 174.624 174.124 0.500 1
1 1295 . 13 1 1 A 126 126 ASN CA C 126 53.292 51.775 1.517 1
1 1296 . 13 1 1 A 126 126 ASN CB C 126 38.797 39.142 -0.345 1
1 1297 . 13 1 1 A 126 126 ASN N N 126 120.102 127.442 -7.340 1
1 1298 . 13 1 1 A 127 127 TRP H H 127 8.051 9.141 -1.090 1
1 1299 . 13 1 1 A 127 127 TRP HA H 127 4.694 5.018 -0.324 1
1 1302 . 13 1 1 A 127 127 TRP C C 127 175.479 175.651 -0.172 1
1 1303 . 13 1 1 A 127 127 TRP CA C 127 57.096 56.399 0.697 1
1 1304 . 13 1 1 A 127 127 TRP CB C 127 29.820 29.409 0.411 1
1 1305 . 13 1 1 A 127 127 TRP N N 127 121.198 129.853 -8.655 1
1 1 . 14 1 1 A 7 7 HIS HA H 7 4.623 4.372 0.251 1
1 4 . 14 1 1 A 7 7 HIS C C 7 174.747 174.389 0.358 1
1 5 . 14 1 1 A 7 7 HIS CA C 7 56.189 54.905 1.284 1
1 6 . 14 1 1 A 7 7 HIS CB C 7 30.028 27.989 2.039 1
1 7 . 14 1 1 A 8 8 LEU H H 8 8.283 8.453 -0.170 1
1 8 . 14 1 1 A 8 8 LEU HA H 8 4.249 4.646 -0.397 1
1 10 . 14 1 1 A 8 8 LEU C C 8 176.700 176.307 0.393 1
1 11 . 14 1 1 A 8 8 LEU CA C 8 55.498 53.092 2.406 1
1 12 . 14 1 1 A 8 8 LEU CB C 8 42.568 45.012 -2.444 1
1 13 . 14 1 1 A 8 8 LEU N N 8 122.916 125.013 -2.097 1
1 14 . 14 1 1 A 9 9 GLU H H 9 8.623 8.719 -0.096 1
1 15 . 14 1 1 A 9 9 GLU HA H 9 4.311 3.821 0.490 1
1 16 . 14 1 1 A 9 9 GLU C C 9 174.811 175.119 -0.308 1
1 17 . 14 1 1 A 9 9 GLU CA C 9 56.377 57.215 -0.838 1
1 18 . 14 1 1 A 9 9 GLU CB C 9 29.557 27.652 1.905 1
1 20 . 14 1 1 A 9 9 GLU N N 9 121.512 118.526 2.986 1
1 21 . 14 1 1 A 10 10 LEU H H 10 7.853 7.633 0.220 1
1 22 . 14 1 1 A 10 10 LEU HA H 10 5.225 5.476 -0.251 1
1 31 . 14 1 1 A 10 10 LEU C C 10 174.637 175.667 -1.030 1
1 32 . 14 1 1 A 10 10 LEU CA C 10 54.513 54.229 0.284 1
1 33 . 14 1 1 A 10 10 LEU CB C 10 45.187 44.170 1.017 1
1 36 . 14 1 1 A 10 10 LEU N N 10 123.592 120.236 3.356 1
1 37 . 14 1 1 A 11 11 GLU H H 11 8.894 8.697 0.197 1
1 38 . 14 1 1 A 11 11 GLU HA H 11 4.765 5.100 -0.335 1
1 43 . 14 1 1 A 11 11 GLU C C 11 174.563 175.324 -0.761 1
1 44 . 14 1 1 A 11 11 GLU CA C 11 55.047 54.915 0.132 1
1 45 . 14 1 1 A 11 11 GLU CB C 11 33.760 32.720 1.040 1
1 47 . 14 1 1 A 11 11 GLU N N 11 124.055 123.329 0.726 1
1 48 . 14 1 1 A 12 12 VAL H H 12 8.607 8.880 -0.273 1
1 49 . 14 1 1 A 12 12 VAL HA H 12 5.174 5.394 -0.220 1
1 57 . 14 1 1 A 12 12 VAL C C 12 173.573 175.285 -1.712 1
1 58 . 14 1 1 A 12 12 VAL CA C 12 60.296 61.267 -0.971 1
1 59 . 14 1 1 A 12 12 VAL CB C 12 35.689 33.063 2.626 1
1 62 . 14 1 1 A 12 12 VAL N N 12 120.878 125.047 -4.169 1
1 63 . 14 1 1 A 13 13 HIS H H 13 8.982 8.784 0.198 1
1 64 . 14 1 1 A 13 13 HIS HA H 13 4.824 5.206 -0.382 1
1 69 . 14 1 1 A 13 13 HIS C C 13 173.236 171.673 1.563 1
1 70 . 14 1 1 A 13 13 HIS CA C 13 54.906 54.224 0.682 1
1 71 . 14 1 1 A 13 13 HIS CB C 13 33.496 32.126 1.370 1
1 72 . 14 1 1 A 13 13 HIS N N 13 121.504 121.932 -0.428 1
1 73 . 14 1 1 A 14 14 ILE H H 14 10.442 8.717 1.725 1
1 74 . 14 1 1 A 14 14 ILE HA H 14 5.458 4.492 0.966 1
1 84 . 14 1 1 A 14 14 ILE CA C 14 58.386 57.848 0.538 1
1 85 . 14 1 1 A 14 14 ILE CB C 14 38.596 38.941 -0.345 1
1 88 . 14 1 1 A 14 14 ILE N N 14 119.923 119.128 0.795 1
1 89 . 14 1 1 A 15 15 PRO HA H 15 4.560 4.583 -0.023 1
1 95 . 14 1 1 A 15 15 PRO C C 15 176.907 175.939 0.968 1
1 96 . 14 1 1 A 15 15 PRO CA C 15 64.342 63.891 0.451 1
1 97 . 14 1 1 A 15 15 PRO CB C 15 32.924 31.950 0.974 1
1 100 . 14 1 1 A 16 16 SER H H 16 7.331 7.833 -0.502 1
1 101 . 14 1 1 A 16 16 SER HA H 16 4.822 5.226 -0.404 1
1 104 . 14 1 1 A 16 16 SER C C 16 171.253 172.905 -1.652 1
1 105 . 14 1 1 A 16 16 SER CA C 16 57.135 58.083 -0.948 1
1 106 . 14 1 1 A 16 16 SER CB C 16 65.947 67.042 -1.095 1
1 107 . 14 1 1 A 16 16 SER N N 16 107.745 113.992 -6.247 1
1 108 . 14 1 1 A 17 17 VAL H H 17 8.350 8.580 -0.230 1
1 109 . 14 1 1 A 17 17 VAL HA H 17 4.926 4.905 0.021 1
1 117 . 14 1 1 A 17 17 VAL C C 17 173.692 174.957 -1.265 1
1 118 . 14 1 1 A 17 17 VAL CA C 17 58.721 60.836 -2.115 1
1 119 . 14 1 1 A 17 17 VAL CB C 17 34.420 35.433 -1.013 1
1 122 . 14 1 1 A 17 17 VAL N N 17 118.680 122.705 -4.025 1
1 123 . 14 1 1 A 18 18 GLY H H 18 8.332 8.503 -0.171 1
1 124 . 14 1 1 A 18 18 GLY HA2 H 18 4.189 4.382 -0.193 1
1 125 . 14 1 1 A 18 18 GLY HA3 H 18 4.011 4.394 -0.383 1
1 126 . 14 1 1 A 18 18 GLY CA C 18 45.356 44.494 0.862 1
1 127 . 14 1 1 A 18 18 GLY N N 18 112.549 114.516 -1.967 1
1 128 . 14 1 1 A 19 19 PRO HA H 19 4.757 4.750 0.007 1
1 134 . 14 1 1 A 19 19 PRO C C 19 177.482 176.921 0.561 1
1 135 . 14 1 1 A 19 19 PRO CA C 19 62.848 62.260 0.588 1
1 136 . 14 1 1 A 19 19 PRO CB C 19 32.283 29.534 2.749 1
1 139 . 14 1 1 A 20 20 GLU H H 20 8.588 8.697 -0.109 1
1 140 . 14 1 1 A 20 20 GLU HA H 20 4.147 4.339 -0.192 1
1 144 . 14 1 1 A 20 20 GLU C C 20 175.857 176.516 -0.659 1
1 145 . 14 1 1 A 20 20 GLU CA C 20 57.150 58.810 -1.660 1
1 146 . 14 1 1 A 20 20 GLU CB C 20 30.923 30.270 0.653 1
1 148 . 14 1 1 A 20 20 GLU N N 20 122.087 124.972 -2.885 1
1 149 . 14 1 1 A 21 21 ALA H H 21 8.352 7.551 0.801 1
1 150 . 14 1 1 A 21 21 ALA HA H 21 4.391 4.344 0.047 1
1 154 . 14 1 1 A 21 21 ALA C C 21 174.910 177.051 -2.141 1
1 155 . 14 1 1 A 21 21 ALA CA C 21 52.166 51.556 0.610 1
1 156 . 14 1 1 A 21 21 ALA CB C 21 19.915 20.005 -0.090 1
1 157 . 14 1 1 A 21 21 ALA N N 21 124.593 121.752 2.841 1
1 158 . 14 1 1 A 22 22 GLU H H 22 8.398 8.573 -0.175 1
1 159 . 14 1 1 A 22 22 GLU HA H 22 4.331 4.436 -0.105 1
1 163 . 14 1 1 A 22 22 GLU C C 22 176.389 176.350 0.039 1
1 164 . 14 1 1 A 22 22 GLU CA C 22 56.316 55.523 0.793 1
1 165 . 14 1 1 A 22 22 GLU CB C 22 30.713 30.381 0.332 1
1 167 . 14 1 1 A 22 22 GLU N N 22 120.159 123.297 -3.138 1
1 168 . 14 1 1 A 23 23 GLY H H 23 8.246 8.676 -0.430 1
1 169 . 14 1 1 A 23 23 GLY HA2 H 23 4.162 3.944 0.218 1
1 170 . 14 1 1 A 23 23 GLY HA3 H 23 4.061 3.978 0.083 1
1 171 . 14 1 1 A 23 23 GLY CA C 23 44.801 45.642 -0.841 1
1 172 . 14 1 1 A 23 23 GLY N N 23 110.080 109.682 0.398 1
1 173 . 14 1 1 A 24 24 PRO HA H 24 4.417 4.607 -0.190 1
1 178 . 14 1 1 A 24 24 PRO C C 24 177.135 176.289 0.846 1
1 179 . 14 1 1 A 24 24 PRO CA C 24 63.520 62.412 1.108 1
1 180 . 14 1 1 A 24 24 PRO CB C 24 32.124 32.872 -0.748 1
1 183 . 14 1 1 A 25 25 ARG H H 25 8.409 8.471 -0.062 1
1 184 . 14 1 1 A 25 25 ARG HA H 25 4.298 4.289 0.009 1
1 187 . 14 1 1 A 25 25 ARG C C 25 176.217 175.847 0.370 1
1 188 . 14 1 1 A 25 25 ARG CA C 25 56.237 54.883 1.354 1
1 189 . 14 1 1 A 25 25 ARG CB C 25 30.467 31.990 -1.523 1
1 192 . 14 1 1 A 25 25 ARG N N 25 120.147 121.441 -1.294 1
1 193 . 14 1 1 A 26 26 GLN H H 26 8.278 8.462 -0.184 1
1 194 . 14 1 1 A 26 26 GLN HA H 26 4.336 4.146 0.190 1
1 200 . 14 1 1 A 26 26 GLN C C 26 175.566 175.702 -0.136 1
1 201 . 14 1 1 A 26 26 GLN CA C 26 55.788 56.192 -0.404 1
1 202 . 14 1 1 A 26 26 GLN CB C 26 29.714 28.652 1.062 1
1 204 . 14 1 1 A 26 26 GLN N N 26 120.460 121.599 -1.139 1
1 206 . 14 1 1 A 27 27 SER H H 27 8.298 8.545 -0.247 1
1 208 . 14 1 1 A 27 27 SER CA C 27 56.156 55.535 0.621 1
1 209 . 14 1 1 A 27 27 SER CB C 27 63.813 64.855 -1.042 1
1 210 . 14 1 1 A 27 27 SER N N 27 117.382 122.338 -4.956 1
1 211 . 14 1 1 A 28 28 PRO HA H 28 4.366 4.386 -0.020 1
1 216 . 14 1 1 A 28 28 PRO C C 28 177.555 175.906 1.649 1
1 217 . 14 1 1 A 28 28 PRO CA C 28 64.486 64.665 -0.179 1
1 218 . 14 1 1 A 28 28 PRO CB C 28 31.892 32.236 -0.344 1
1 221 . 14 1 1 A 29 29 GLU H H 29 8.582 7.517 1.065 1
1 222 . 14 1 1 A 29 29 GLU HA H 29 4.218 4.806 -0.588 1
1 226 . 14 1 1 A 29 29 GLU CA C 29 57.261 54.546 2.715 1
1 227 . 14 1 1 A 29 29 GLU CB C 29 29.633 31.697 -2.064 1
1 229 . 14 1 1 A 29 29 GLU N N 29 118.309 112.382 5.927 1
1 230 . 14 1 1 A 30 30 LYS H H 30 7.955 8.793 -0.838 1
1 231 . 14 1 1 A 30 30 LYS HA H 30 4.328 4.743 -0.415 1
1 236 . 14 1 1 A 30 30 LYS C C 30 176.222 176.228 -0.006 1
1 237 . 14 1 1 A 30 30 LYS CA C 30 56.247 55.453 0.794 1
1 238 . 14 1 1 A 30 30 LYS CB C 30 32.720 33.584 -0.864 1
1 242 . 14 1 1 A 30 30 LYS N N 30 120.129 118.161 1.968 1
1 243 . 14 1 1 A 31 31 SER H H 31 7.883 7.763 0.120 1
1 244 . 14 1 1 A 31 31 SER HA H 31 4.458 4.581 -0.123 1
1 246 . 14 1 1 A 31 31 SER C C 31 174.129 175.248 -1.119 1
1 247 . 14 1 1 A 31 31 SER CA C 31 58.477 59.641 -1.164 1
1 248 . 14 1 1 A 31 31 SER CB C 31 64.042 62.671 1.371 1
1 249 . 14 1 1 A 31 31 SER N N 31 115.366 117.603 -2.237 1
1 250 . 14 1 1 A 32 32 HIS H H 32 8.485 8.334 0.151 1
1 251 . 14 1 1 A 32 32 HIS HA H 32 4.450 4.876 -0.426 1
1 255 . 14 1 1 A 32 32 HIS CA C 32 56.009 55.496 0.513 1
1 256 . 14 1 1 A 32 32 HIS CB C 32 31.122 31.375 -0.253 1
1 257 . 14 1 1 A 32 32 HIS N N 32 121.500 120.726 0.774 1
1 258 . 14 1 1 A 33 33 MET H H 33 8.392 7.579 0.813 1
1 259 . 14 1 1 A 33 33 MET HA H 33 4.601 4.839 -0.238 1
1 265 . 14 1 1 A 33 33 MET C C 33 175.842 174.235 1.607 1
1 266 . 14 1 1 A 33 33 MET CA C 33 54.533 54.118 0.415 1
1 267 . 14 1 1 A 33 33 MET CB C 33 32.868 35.781 -2.913 1
1 270 . 14 1 1 A 33 33 MET N N 33 120.204 120.074 0.130 1
1 271 . 14 1 1 A 34 34 VAL H H 34 8.938 8.607 0.331 1
1 272 . 14 1 1 A 34 34 VAL HA H 34 4.430 4.545 -0.115 1
1 280 . 14 1 1 A 34 34 VAL C C 34 174.149 174.427 -0.278 1
1 281 . 14 1 1 A 34 34 VAL CA C 34 60.703 59.968 0.735 1
1 282 . 14 1 1 A 34 34 VAL CB C 34 34.319 34.819 -0.500 1
1 285 . 14 1 1 A 34 34 VAL N N 34 118.512 123.249 -4.737 1
1 286 . 14 1 1 A 35 35 PHE H H 35 9.242 7.872 1.370 1
1 287 . 14 1 1 A 35 35 PHE HA H 35 4.439 5.236 -0.797 1
1 294 . 14 1 1 A 35 35 PHE C C 35 174.831 174.802 0.029 1
1 295 . 14 1 1 A 35 35 PHE CA C 35 57.754 55.400 2.354 1
1 296 . 14 1 1 A 35 35 PHE CB C 35 38.959 41.160 -2.201 1
1 297 . 14 1 1 A 35 35 PHE N N 35 124.912 126.655 -1.743 1
1 298 . 14 1 1 A 36 36 ARG H H 36 8.475 8.892 -0.417 1
1 299 . 14 1 1 A 36 36 ARG HA H 36 4.135 5.003 -0.868 1
1 304 . 14 1 1 A 36 36 ARG C C 36 172.865 175.603 -2.738 1
1 305 . 14 1 1 A 36 36 ARG CA C 36 56.895 55.169 1.726 1
1 306 . 14 1 1 A 36 36 ARG CB C 36 28.962 31.640 -2.678 1
1 308 . 14 1 1 A 36 36 ARG N N 36 125.680 120.793 4.887 1
1 309 . 14 1 1 A 37 37 VAL H H 37 8.066 9.171 -1.105 1
1 310 . 14 1 1 A 37 37 VAL HA H 37 4.292 4.535 -0.243 1
1 318 . 14 1 1 A 37 37 VAL C C 37 174.595 174.450 0.145 1
1 319 . 14 1 1 A 37 37 VAL CA C 37 62.727 61.534 1.193 1
1 320 . 14 1 1 A 37 37 VAL CB C 37 31.102 32.679 -1.577 1
1 323 . 14 1 1 A 37 37 VAL N N 37 125.403 121.504 3.899 1
1 324 . 14 1 1 A 38 38 GLU H H 38 9.532 9.231 0.301 1
1 325 . 14 1 1 A 38 38 GLU HA H 38 4.895 4.939 -0.044 1
1 329 . 14 1 1 A 38 38 GLU C C 38 174.509 175.238 -0.729 1
1 330 . 14 1 1 A 38 38 GLU CA C 38 55.650 55.481 0.169 1
1 331 . 14 1 1 A 38 38 GLU CB C 38 32.214 30.329 1.885 1
1 333 . 14 1 1 A 38 38 GLU N N 38 129.885 126.701 3.184 1
1 334 . 14 1 1 A 39 39 VAL H H 39 9.035 8.859 0.176 1
1 335 . 14 1 1 A 39 39 VAL HA H 39 4.446 4.485 -0.039 1
1 343 . 14 1 1 A 39 39 VAL C C 39 173.661 174.254 -0.593 1
1 344 . 14 1 1 A 39 39 VAL CA C 39 61.258 61.945 -0.687 1
1 345 . 14 1 1 A 39 39 VAL CB C 39 33.533 31.898 1.635 1
1 348 . 14 1 1 A 39 39 VAL N N 39 127.941 127.607 0.334 1
1 349 . 14 1 1 A 40 40 LEU H H 40 8.843 9.045 -0.202 1
1 350 . 14 1 1 A 40 40 LEU HA H 40 5.130 4.953 0.177 1
1 360 . 14 1 1 A 40 40 LEU C C 40 175.581 175.387 0.194 1
1 361 . 14 1 1 A 40 40 LEU CA C 40 53.702 53.791 -0.089 1
1 362 . 14 1 1 A 40 40 LEU CB C 40 43.989 43.274 0.715 1
1 366 . 14 1 1 A 40 40 LEU N N 40 128.413 129.920 -1.507 1
1 367 . 14 1 1 A 41 41 CYS H H 41 8.959 9.031 -0.072 1
1 368 . 14 1 1 A 41 41 CYS HA H 41 5.174 5.094 0.080 1
1 371 . 14 1 1 A 41 41 CYS C C 41 175.043 174.407 0.636 1
1 372 . 14 1 1 A 41 41 CYS CA C 41 57.483 57.617 -0.134 1
1 373 . 14 1 1 A 41 41 CYS CB C 41 28.472 30.805 -2.333 1
1 374 . 14 1 1 A 41 41 CYS N N 41 124.738 123.700 1.038 1
1 375 . 14 1 1 A 42 42 SER H H 42 9.527 8.806 0.721 1
1 376 . 14 1 1 A 42 42 SER HA H 42 4.149 3.876 0.273 1
1 379 . 14 1 1 A 42 42 SER C C 42 175.014 173.539 1.475 1
1 380 . 14 1 1 A 42 42 SER CA C 42 59.058 59.129 -0.071 1
1 381 . 14 1 1 A 42 42 SER CB C 42 62.287 62.090 0.197 1
1 382 . 14 1 1 A 42 42 SER N N 42 125.889 117.231 8.658 1
1 383 . 14 1 1 A 43 43 GLY H H 43 8.685 7.855 0.830 1
1 384 . 14 1 1 A 43 43 GLY HA2 H 43 3.594 3.930 -0.336 1
1 385 . 14 1 1 A 43 43 GLY HA3 H 43 4.210 3.954 0.256 1
1 386 . 14 1 1 A 43 43 GLY C C 43 173.664 173.952 -0.288 1
1 387 . 14 1 1 A 43 43 GLY CA C 43 45.404 45.110 0.294 1
1 388 . 14 1 1 A 43 43 GLY N N 43 104.633 106.217 -1.584 1
1 389 . 14 1 1 A 44 44 ARG H H 44 7.926 7.420 0.506 1
1 390 . 14 1 1 A 44 44 ARG HA H 44 4.678 4.418 0.260 1
1 395 . 14 1 1 A 44 44 ARG C C 44 175.261 174.945 0.316 1
1 396 . 14 1 1 A 44 44 ARG CA C 44 55.011 55.930 -0.919 1
1 397 . 14 1 1 A 44 44 ARG CB C 44 32.138 31.381 0.757 1
1 400 . 14 1 1 A 44 44 ARG N N 44 121.239 120.517 0.722 1
1 401 . 14 1 1 A 45 45 ARG H H 45 8.775 8.916 -0.141 1
1 402 . 14 1 1 A 45 45 ARG HA H 45 5.770 5.206 0.564 1
1 409 . 14 1 1 A 45 45 ARG C C 45 176.064 175.385 0.679 1
1 410 . 14 1 1 A 45 45 ARG CA C 45 54.683 54.327 0.356 1
1 411 . 14 1 1 A 45 45 ARG CB C 45 33.748 33.786 -0.038 1
1 414 . 14 1 1 A 45 45 ARG N N 45 125.948 120.718 5.230 1
1 415 . 14 1 1 A 46 46 HIS H H 46 8.912 8.457 0.455 1
1 416 . 14 1 1 A 46 46 HIS HA H 46 4.927 5.395 -0.468 1
1 420 . 14 1 1 A 46 46 HIS C C 46 172.634 172.209 0.425 1
1 421 . 14 1 1 A 46 46 HIS CA C 46 56.480 53.939 2.541 1
1 422 . 14 1 1 A 46 46 HIS CB C 46 33.608 32.593 1.015 1
1 423 . 14 1 1 A 46 46 HIS N N 46 121.825 116.164 5.661 1
1 424 . 14 1 1 A 47 47 THR H H 47 8.532 8.953 -0.421 1
1 425 . 14 1 1 A 47 47 THR HA H 47 5.472 4.556 0.916 1
1 430 . 14 1 1 A 47 47 THR C C 47 174.442 174.123 0.319 1
1 431 . 14 1 1 A 47 47 THR CA C 47 61.093 62.408 -1.315 1
1 432 . 14 1 1 A 47 47 THR CB C 47 71.041 68.156 2.885 1
1 434 . 14 1 1 A 47 47 THR N N 47 115.450 120.358 -4.908 1
1 435 . 14 1 1 A 48 48 VAL H H 48 9.695 9.239 0.456 1
1 436 . 14 1 1 A 48 48 VAL HA H 48 4.677 4.555 0.122 1
1 444 . 14 1 1 A 48 48 VAL CA C 48 58.172 59.241 -1.069 1
1 445 . 14 1 1 A 48 48 VAL CB C 48 34.990 32.335 2.655 1
1 448 . 14 1 1 A 48 48 VAL N N 48 126.721 127.767 -1.046 1
1 449 . 14 1 1 A 49 49 PRO HA H 49 5.087 4.700 0.387 1
1 453 . 14 1 1 A 49 49 PRO CA C 49 61.671 62.909 -1.238 1
1 454 . 14 1 1 A 49 49 PRO CB C 49 31.923 31.694 0.229 1
1 457 . 14 1 1 A 50 50 ARG H H 50 9.125 9.032 0.093 1
1 458 . 14 1 1 A 50 50 ARG HA H 50 4.974 4.710 0.264 1
1 464 . 14 1 1 A 50 50 ARG C C 50 176.187 175.162 1.025 1
1 465 . 14 1 1 A 50 50 ARG CA C 50 53.015 54.139 -1.124 1
1 466 . 14 1 1 A 50 50 ARG CB C 50 36.553 33.908 2.645 1
1 468 . 14 1 1 A 50 50 ARG N N 50 124.189 123.684 0.505 1
1 469 . 14 1 1 A 51 51 ARG H H 51 10.105 8.439 1.666 1
1 470 . 14 1 1 A 51 51 ARG HA H 51 5.196 4.081 1.115 1
1 475 . 14 1 1 A 51 51 ARG C C 51 178.865 176.935 1.930 1
1 476 . 14 1 1 A 51 51 ARG CA C 51 55.961 55.185 0.776 1
1 477 . 14 1 1 A 51 51 ARG CB C 51 32.539 31.330 1.209 1
1 480 . 14 1 1 A 51 51 ARG N N 51 124.521 122.516 2.005 1
1 481 . 14 1 1 A 52 52 TYR H H 52 10.397 8.163 2.234 1
1 482 . 14 1 1 A 52 52 TYR HA H 52 4.360 4.453 -0.093 1
1 487 . 14 1 1 A 52 52 TYR C C 52 178.143 177.628 0.515 1
1 488 . 14 1 1 A 52 52 TYR CA C 52 63.538 61.418 2.120 1
1 489 . 14 1 1 A 52 52 TYR CB C 52 38.784 38.008 0.776 1
1 490 . 14 1 1 A 52 52 TYR N N 52 124.772 120.888 3.884 1
1 491 . 14 1 1 A 53 53 SER H H 53 9.231 8.128 1.103 1
1 492 . 14 1 1 A 53 53 SER HA H 53 4.175 4.472 -0.297 1
1 493 . 14 1 1 A 53 53 SER C C 53 177.220 175.921 1.299 1
1 494 . 14 1 1 A 53 53 SER CA C 53 61.606 61.864 -0.258 1
1 495 . 14 1 1 A 53 53 SER N N 53 113.262 117.029 -3.767 1
1 496 . 14 1 1 A 54 54 GLU H H 54 7.807 7.719 0.088 1
1 497 . 14 1 1 A 54 54 GLU HA H 54 4.392 4.143 0.249 1
1 501 . 14 1 1 A 54 54 GLU C C 54 180.361 178.960 1.401 1
1 502 . 14 1 1 A 54 54 GLU CA C 54 59.497 59.218 0.279 1
1 503 . 14 1 1 A 54 54 GLU CB C 54 30.708 29.305 1.403 1
1 504 . 14 1 1 A 54 54 GLU N N 54 121.949 121.958 -0.009 1
1 505 . 14 1 1 A 55 55 PHE H H 55 8.133 8.306 -0.173 1
1 506 . 14 1 1 A 55 55 PHE HA H 55 4.007 4.252 -0.245 1
1 513 . 14 1 1 A 55 55 PHE C C 55 176.531 177.691 -1.160 1
1 514 . 14 1 1 A 55 55 PHE CA C 55 61.848 61.399 0.449 1
1 515 . 14 1 1 A 55 55 PHE CB C 55 38.847 39.059 -0.212 1
1 516 . 14 1 1 A 55 55 PHE N N 55 119.998 120.598 -0.600 1
1 517 . 14 1 1 A 56 56 HIS H H 56 7.907 8.163 -0.256 1
1 518 . 14 1 1 A 56 56 HIS HA H 56 3.324 4.312 -0.988 1
1 522 . 14 1 1 A 56 56 HIS C C 56 176.748 177.559 -0.811 1
1 523 . 14 1 1 A 56 56 HIS CA C 56 58.770 60.249 -1.479 1
1 524 . 14 1 1 A 56 56 HIS CB C 56 30.404 29.411 0.993 1
1 525 . 14 1 1 A 56 56 HIS N N 56 119.173 118.563 0.610 1
1 526 . 14 1 1 A 57 57 ALA H H 57 7.962 8.056 -0.094 1
1 527 . 14 1 1 A 57 57 ALA HA H 57 3.865 3.857 0.008 1
1 531 . 14 1 1 A 57 57 ALA C C 57 180.075 179.576 0.499 1
1 532 . 14 1 1 A 57 57 ALA CA C 57 54.996 54.989 0.007 1
1 533 . 14 1 1 A 57 57 ALA CB C 57 18.226 18.002 0.224 1
1 534 . 14 1 1 A 57 57 ALA N N 57 120.094 121.348 -1.254 1
1 535 . 14 1 1 A 58 58 LEU H H 58 7.295 7.689 -0.394 1
1 536 . 14 1 1 A 58 58 LEU HA H 58 3.994 3.730 0.264 1
1 546 . 14 1 1 A 58 58 LEU C C 58 177.428 178.432 -1.004 1
1 547 . 14 1 1 A 58 58 LEU CA C 58 58.342 57.345 0.997 1
1 548 . 14 1 1 A 58 58 LEU CB C 58 40.851 40.711 0.140 1
1 552 . 14 1 1 A 58 58 LEU N N 58 119.404 117.391 2.013 1
1 553 . 14 1 1 A 59 59 HIS H H 59 7.805 8.286 -0.481 1
1 554 . 14 1 1 A 59 59 HIS HA H 59 4.286 3.654 0.632 1
1 558 . 14 1 1 A 59 59 HIS C C 59 177.001 177.333 -0.332 1
1 559 . 14 1 1 A 59 59 HIS CA C 59 60.141 59.776 0.365 1
1 560 . 14 1 1 A 59 59 HIS CB C 59 31.072 29.576 1.496 1
1 561 . 14 1 1 A 59 59 HIS N N 59 119.040 120.105 -1.065 1
1 562 . 14 1 1 A 60 60 LYS H H 60 7.715 7.695 0.020 1
1 563 . 14 1 1 A 60 60 LYS HA H 60 3.456 3.726 -0.270 1
1 570 . 14 1 1 A 60 60 LYS C C 60 178.464 178.652 -0.188 1
1 571 . 14 1 1 A 60 60 LYS CA C 60 59.629 59.176 0.453 1
1 572 . 14 1 1 A 60 60 LYS CB C 60 32.354 31.788 0.566 1
1 576 . 14 1 1 A 60 60 LYS N N 60 114.225 117.788 -3.563 1
1 577 . 14 1 1 A 61 61 ARG H H 61 7.486 7.545 -0.059 1
1 578 . 14 1 1 A 61 61 ARG HA H 61 4.202 3.867 0.335 1
1 584 . 14 1 1 A 61 61 ARG C C 61 178.995 178.931 0.064 1
1 585 . 14 1 1 A 61 61 ARG CA C 61 58.387 59.256 -0.869 1
1 586 . 14 1 1 A 61 61 ARG CB C 61 31.216 29.851 1.365 1
1 589 . 14 1 1 A 61 61 ARG N N 61 115.929 118.717 -2.788 1
1 590 . 14 1 1 A 62 62 ILE H H 62 8.066 7.815 0.251 1
1 591 . 14 1 1 A 62 62 ILE HA H 62 4.491 3.589 0.902 1
1 601 . 14 1 1 A 62 62 ILE C C 62 177.838 177.156 0.682 1
1 602 . 14 1 1 A 62 62 ILE CA C 62 63.399 63.461 -0.062 1
1 603 . 14 1 1 A 62 62 ILE CB C 62 39.699 36.782 2.917 1
1 606 . 14 1 1 A 62 62 ILE N N 62 111.456 115.960 -4.504 1
1 607 . 14 1 1 A 63 63 LYS H H 63 8.158 8.334 -0.176 1
1 608 . 14 1 1 A 63 63 LYS HA H 63 4.136 3.784 0.352 1
1 615 . 14 1 1 A 63 63 LYS C C 63 176.358 177.580 -1.222 1
1 616 . 14 1 1 A 63 63 LYS CA C 63 58.753 58.649 0.104 1
1 617 . 14 1 1 A 63 63 LYS CB C 63 30.825 31.663 -0.838 1
1 621 . 14 1 1 A 63 63 LYS N N 63 120.800 123.239 -2.439 1
1 622 . 14 1 1 A 64 64 LYS H H 64 7.687 7.876 -0.189 1
1 623 . 14 1 1 A 64 64 LYS HA H 64 4.301 4.126 0.175 1
1 628 . 14 1 1 A 64 64 LYS C C 64 177.084 177.542 -0.458 1
1 629 . 14 1 1 A 64 64 LYS CA C 64 57.237 57.087 0.150 1
1 630 . 14 1 1 A 64 64 LYS CB C 64 32.502 32.160 0.342 1
1 634 . 14 1 1 A 64 64 LYS N N 64 116.548 118.355 -1.807 1
1 635 . 14 1 1 A 65 65 LEU H H 65 7.476 7.877 -0.401 1
1 636 . 14 1 1 A 65 65 LEU HA H 65 4.219 4.303 -0.084 1
1 645 . 14 1 1 A 65 65 LEU C C 65 175.886 175.921 -0.035 1
1 646 . 14 1 1 A 65 65 LEU CA C 65 55.542 56.546 -1.004 1
1 647 . 14 1 1 A 65 65 LEU CB C 65 45.493 43.447 2.046 1
1 650 . 14 1 1 A 65 65 LEU N N 65 118.000 120.320 -2.320 1
1 651 . 14 1 1 A 66 66 TYR H H 66 7.672 8.208 -0.536 1
1 652 . 14 1 1 A 66 66 TYR HA H 66 4.762 5.206 -0.444 1
1 660 . 14 1 1 A 66 66 TYR C C 66 174.199 174.257 -0.058 1
1 661 . 14 1 1 A 66 66 TYR CA C 66 56.013 55.300 0.713 1
1 662 . 14 1 1 A 66 66 TYR CB C 66 40.380 41.064 -0.684 1
1 663 . 14 1 1 A 66 66 TYR N N 66 116.805 113.777 3.028 1
1 664 . 14 1 1 A 67 67 LYS H H 67 8.547 8.498 0.049 1
1 665 . 14 1 1 A 67 67 LYS HA H 67 4.436 4.591 -0.155 1
1 670 . 14 1 1 A 67 67 LYS C C 67 175.727 176.382 -0.655 1
1 671 . 14 1 1 A 67 67 LYS CA C 67 56.598 56.611 -0.013 1
1 672 . 14 1 1 A 67 67 LYS CB C 67 32.743 32.831 -0.088 1
1 676 . 14 1 1 A 67 67 LYS N N 67 120.929 120.438 0.491 1
1 677 . 14 1 1 A 68 68 VAL H H 68 8.168 8.315 -0.147 1
1 678 . 14 1 1 A 68 68 VAL HA H 68 4.869 4.710 0.159 1
1 686 . 14 1 1 A 68 68 VAL CA C 68 57.389 58.929 -1.540 1
1 687 . 14 1 1 A 68 68 VAL CB C 68 34.017 35.607 -1.590 1
1 690 . 14 1 1 A 68 68 VAL N N 68 116.467 123.773 -7.306 1
1 691 . 14 1 1 A 69 69 PRO HA H 69 4.674 4.699 -0.025 1
1 696 . 14 1 1 A 69 69 PRO C C 69 178.013 175.937 2.076 1
1 697 . 14 1 1 A 69 69 PRO CA C 69 61.443 62.279 -0.836 1
1 698 . 14 1 1 A 69 69 PRO CB C 69 32.231 33.174 -0.943 1
1 701 . 14 1 1 A 70 70 ASP H H 70 8.167 8.584 -0.417 1
1 702 . 14 1 1 A 70 70 ASP HA H 70 4.531 4.716 -0.185 1
1 705 . 14 1 1 A 70 70 ASP C C 70 175.660 175.129 0.531 1
1 706 . 14 1 1 A 70 70 ASP CA C 70 55.148 54.260 0.888 1
1 707 . 14 1 1 A 70 70 ASP CB C 70 40.876 41.328 -0.452 1
1 708 . 14 1 1 A 70 70 ASP N N 70 116.671 121.002 -4.331 1
1 709 . 14 1 1 A 71 71 PHE H H 71 8.387 8.239 0.148 1
1 710 . 14 1 1 A 71 71 PHE HA H 71 4.076 4.852 -0.776 1
1 717 . 14 1 1 A 71 71 PHE CA C 71 55.672 54.663 1.009 1
1 718 . 14 1 1 A 71 71 PHE CB C 71 39.155 41.987 -2.832 1
1 719 . 14 1 1 A 71 71 PHE N N 71 126.533 116.658 9.875 1
1 720 . 14 1 1 A 72 72 PRO HA H 72 4.156 4.756 -0.600 1
1 727 . 14 1 1 A 72 72 PRO CA C 72 63.079 62.418 0.661 1
1 728 . 14 1 1 A 72 72 PRO CB C 72 32.107 32.665 -0.558 1
1 731 . 14 1 1 A 73 73 SER H H 73 8.468 8.569 -0.101 1
1 733 . 14 1 1 A 73 73 SER CA C 73 56.133 57.760 -1.627 1
1 734 . 14 1 1 A 73 73 SER CB C 73 63.991 64.228 -0.237 1
1 735 . 14 1 1 A 73 73 SER N N 73 121.533 116.791 4.742 1
1 736 . 14 1 1 A 74 74 LYS HA H 74 4.574 4.459 0.115 1
1 739 . 14 1 1 A 74 74 LYS CA C 74 55.659 57.094 -1.435 1
1 740 . 14 1 1 A 74 74 LYS CB C 74 30.550 33.575 -3.025 1
1 741 . 14 1 1 A 75 75 ARG H H 75 7.962 7.416 0.546 1
1 742 . 14 1 1 A 75 75 ARG HA H 75 4.162 4.633 -0.471 1
1 746 . 14 1 1 A 75 75 ARG CA C 75 56.123 55.479 0.644 1
1 747 . 14 1 1 A 75 75 ARG CB C 75 31.179 30.529 0.650 1
1 749 . 14 1 1 A 75 75 ARG N N 75 121.665 120.304 1.361 1
1 750 . 14 1 1 A 76 76 LEU H H 76 8.071 8.496 -0.425 1
1 751 . 14 1 1 A 76 76 LEU HA H 76 4.618 4.599 0.019 1
1 759 . 14 1 1 A 76 76 LEU CA C 76 52.764 51.521 1.243 1
1 760 . 14 1 1 A 76 76 LEU CB C 76 41.918 43.840 -1.922 1
1 762 . 14 1 1 A 76 76 LEU N N 76 124.196 125.085 -0.889 1
1 763 . 14 1 1 A 77 77 PRO HA H 77 4.393 4.362 0.031 1
1 767 . 14 1 1 A 77 77 PRO CA C 77 63.746 61.757 1.989 1
1 770 . 14 1 1 A 78 78 ASN H H 78 8.379 8.810 -0.431 1
1 771 . 14 1 1 A 78 78 ASN HA H 78 4.586 4.396 0.190 1
1 776 . 14 1 1 A 78 78 ASN C C 78 175.648 175.054 0.594 1
1 777 . 14 1 1 A 78 78 ASN CA C 78 53.591 55.045 -1.454 1
1 778 . 14 1 1 A 78 78 ASN CB C 78 37.826 39.300 -1.474 1
1 779 . 14 1 1 A 78 78 ASN N N 78 115.292 120.276 -4.984 1
1 781 . 14 1 1 A 79 79 TRP H H 79 7.900 7.847 0.053 1
1 782 . 14 1 1 A 79 79 TRP HA H 79 4.326 4.152 0.174 1
1 788 . 14 1 1 A 79 79 TRP CA C 79 58.825 61.519 -2.694 1
1 789 . 14 1 1 A 79 79 TRP CB C 79 29.090 27.605 1.485 1
1 790 . 14 1 1 A 79 79 TRP N N 79 119.525 118.657 0.868 1
1 792 . 14 1 1 A 80 80 ARG H H 80 8.060 8.633 -0.573 1
1 793 . 14 1 1 A 80 80 ARG HA H 80 3.913 4.069 -0.156 1
1 798 . 14 1 1 A 80 80 ARG C C 80 177.024 178.768 -1.744 1
1 799 . 14 1 1 A 80 80 ARG CA C 80 58.292 59.444 -1.152 1
1 800 . 14 1 1 A 80 80 ARG CB C 80 30.146 30.060 0.086 1
1 803 . 14 1 1 A 80 80 ARG N N 80 118.864 119.210 -0.346 1
1 804 . 14 1 1 A 81 81 THR H H 81 7.725 8.005 -0.280 1
1 805 . 14 1 1 A 81 81 THR HA H 81 4.297 4.007 0.290 1
1 809 . 14 1 1 A 81 81 THR CA C 81 62.481 65.687 -3.206 1
1 811 . 14 1 1 A 81 81 THR N N 81 109.863 113.294 -3.431 1
1 812 . 14 1 1 A 82 82 ARG HA H 82 4.341 4.482 -0.141 1
1 816 . 14 1 1 A 82 82 ARG C C 82 177.261 176.572 0.689 1
1 817 . 14 1 1 A 82 82 ARG CA C 82 56.846 57.033 -0.187 1
1 818 . 14 1 1 A 82 82 ARG CB C 82 30.288 32.022 -1.734 1
1 820 . 14 1 1 A 83 83 GLY H H 83 8.321 7.629 0.692 1
1 821 . 14 1 1 A 83 83 GLY HA2 H 83 3.957 4.132 -0.175 1
1 822 . 14 1 1 A 83 83 GLY C C 83 175.185 174.735 0.450 1
1 823 . 14 1 1 A 83 83 GLY CA C 83 46.297 45.344 0.953 1
1 824 . 14 1 1 A 83 83 GLY N N 83 109.146 103.741 5.405 1
1 825 . 14 1 1 A 84 84 LEU H H 84 8.303 8.615 -0.312 1
1 826 . 14 1 1 A 84 84 LEU HA H 84 4.018 4.272 -0.254 1
1 835 . 14 1 1 A 84 84 LEU C C 84 178.552 178.392 0.160 1
1 836 . 14 1 1 A 84 84 LEU CA C 84 58.236 56.688 1.548 1
1 837 . 14 1 1 A 84 84 LEU CB C 84 41.837 42.095 -0.258 1
1 840 . 14 1 1 A 84 84 LEU N N 84 122.662 122.168 0.494 1
1 841 . 14 1 1 A 85 85 GLU H H 85 8.233 8.529 -0.296 1
1 842 . 14 1 1 A 85 85 GLU HA H 85 4.371 4.010 0.361 1
1 846 . 14 1 1 A 85 85 GLU C C 85 178.555 178.267 0.288 1
1 847 . 14 1 1 A 85 85 GLU CA C 85 58.377 59.159 -0.782 1
1 848 . 14 1 1 A 85 85 GLU CB C 85 28.675 28.796 -0.121 1
1 850 . 14 1 1 A 85 85 GLU N N 85 119.781 117.132 2.649 1
1 851 . 14 1 1 A 86 86 GLN H H 86 7.877 8.114 -0.237 1
1 852 . 14 1 1 A 86 86 GLN HA H 86 4.100 4.080 0.020 1
1 858 . 14 1 1 A 86 86 GLN C C 86 179.557 178.308 1.249 1
1 859 . 14 1 1 A 86 86 GLN CA C 86 58.955 58.876 0.079 1
1 860 . 14 1 1 A 86 86 GLN CB C 86 28.191 28.359 -0.168 1
1 862 . 14 1 1 A 86 86 GLN N N 86 118.042 119.122 -1.080 1
1 863 . 14 1 1 A 87 87 ARG H H 87 8.169 8.032 0.137 1
1 864 . 14 1 1 A 87 87 ARG HA H 87 3.975 4.052 -0.077 1
1 868 . 14 1 1 A 87 87 ARG C C 87 177.051 178.411 -1.360 1
1 869 . 14 1 1 A 87 87 ARG CA C 87 59.006 59.554 -0.548 1
1 870 . 14 1 1 A 87 87 ARG CB C 87 30.383 29.506 0.877 1
1 872 . 14 1 1 A 87 87 ARG N N 87 121.381 120.600 0.781 1
1 873 . 14 1 1 A 88 88 ARG H H 88 8.593 7.669 0.924 1
1 874 . 14 1 1 A 88 88 ARG HA H 88 3.726 3.795 -0.069 1
1 876 . 14 1 1 A 88 88 ARG C C 88 177.520 178.479 -0.959 1
1 877 . 14 1 1 A 88 88 ARG CA C 88 60.751 59.880 0.871 1
1 878 . 14 1 1 A 88 88 ARG CB C 88 30.153 29.700 0.453 1
1 879 . 14 1 1 A 88 88 ARG N N 88 120.863 118.073 2.790 1
1 880 . 14 1 1 A 89 89 GLN H H 89 8.355 7.967 0.388 1
1 881 . 14 1 1 A 89 89 GLN HA H 89 3.887 3.855 0.032 1
1 887 . 14 1 1 A 89 89 GLN C C 89 179.499 178.249 1.250 1
1 888 . 14 1 1 A 89 89 GLN CA C 89 59.603 59.223 0.380 1
1 889 . 14 1 1 A 89 89 GLN CB C 89 28.464 27.949 0.515 1
1 891 . 14 1 1 A 89 89 GLN N N 89 116.860 119.281 -2.421 1
1 893 . 14 1 1 A 90 90 GLY H H 90 8.406 7.900 0.506 1
1 894 . 14 1 1 A 90 90 GLY HA2 H 90 3.672 3.262 0.410 1
1 895 . 14 1 1 A 90 90 GLY HA3 H 90 3.871 3.446 0.425 1
1 896 . 14 1 1 A 90 90 GLY C C 90 177.033 175.176 1.857 1
1 897 . 14 1 1 A 90 90 GLY CA C 90 46.813 46.844 -0.031 1
1 898 . 14 1 1 A 90 90 GLY N N 90 107.679 107.239 0.440 1
1 899 . 14 1 1 A 91 91 LEU H H 91 8.504 8.074 0.430 1
1 900 . 14 1 1 A 91 91 LEU HA H 91 3.784 3.747 0.037 1
1 910 . 14 1 1 A 91 91 LEU C C 91 178.003 178.925 -0.922 1
1 911 . 14 1 1 A 91 91 LEU CA C 91 57.354 57.599 -0.245 1
1 912 . 14 1 1 A 91 91 LEU CB C 91 40.359 41.084 -0.725 1
1 916 . 14 1 1 A 91 91 LEU N N 91 123.959 121.532 2.427 1
1 917 . 14 1 1 A 92 92 GLU H H 92 8.324 8.140 0.184 1
1 918 . 14 1 1 A 92 92 GLU HA H 92 3.732 3.824 -0.092 1
1 922 . 14 1 1 A 92 92 GLU C C 92 177.272 178.891 -1.619 1
1 923 . 14 1 1 A 92 92 GLU CA C 92 60.651 59.305 1.346 1
1 924 . 14 1 1 A 92 92 GLU CB C 92 30.843 29.336 1.507 1
1 926 . 14 1 1 A 92 92 GLU N N 92 121.991 117.614 4.377 1
1 927 . 14 1 1 A 93 93 ALA H H 93 8.126 7.303 0.823 1
1 928 . 14 1 1 A 93 93 ALA HA H 93 4.160 4.076 0.084 1
1 932 . 14 1 1 A 93 93 ALA C C 93 180.818 179.174 1.644 1
1 933 . 14 1 1 A 93 93 ALA CA C 93 54.828 54.739 0.089 1
1 934 . 14 1 1 A 93 93 ALA CB C 93 18.032 17.730 0.302 1
1 935 . 14 1 1 A 93 93 ALA N N 93 120.066 122.618 -2.552 1
1 936 . 14 1 1 A 94 94 TYR H H 94 7.916 7.228 0.688 1
1 937 . 14 1 1 A 94 94 TYR HA H 94 4.139 4.426 -0.287 1
1 942 . 14 1 1 A 94 94 TYR C C 94 175.895 178.533 -2.638 1
1 943 . 14 1 1 A 94 94 TYR CA C 94 61.915 61.600 0.315 1
1 944 . 14 1 1 A 94 94 TYR CB C 94 38.740 38.585 0.155 1
1 945 . 14 1 1 A 94 94 TYR N N 94 121.179 115.818 5.361 1
1 946 . 14 1 1 A 95 95 ILE H H 95 7.983 8.674 -0.691 1
1 947 . 14 1 1 A 95 95 ILE HA H 95 3.614 3.660 -0.046 1
1 957 . 14 1 1 A 95 95 ILE C C 95 174.678 178.095 -3.417 1
1 958 . 14 1 1 A 95 95 ILE CA C 95 63.461 65.122 -1.661 1
1 959 . 14 1 1 A 95 95 ILE CB C 95 36.625 37.775 -1.150 1
1 963 . 14 1 1 A 95 95 ILE N N 95 116.397 120.333 -3.936 1
1 964 . 14 1 1 A 96 96 GLN H H 96 8.175 8.569 -0.394 1
1 965 . 14 1 1 A 96 96 GLN HA H 96 3.763 4.058 -0.295 1
1 970 . 14 1 1 A 96 96 GLN C C 96 179.042 178.460 0.582 1
1 971 . 14 1 1 A 96 96 GLN CA C 96 59.270 59.723 -0.453 1
1 972 . 14 1 1 A 96 96 GLN CB C 96 27.696 28.157 -0.461 1
1 974 . 14 1 1 A 96 96 GLN N N 96 116.631 120.534 -3.903 1
1 976 . 14 1 1 A 97 97 GLY H H 97 8.222 8.159 0.063 1
1 977 . 14 1 1 A 97 97 GLY HA2 H 97 3.661 3.802 -0.141 1
1 978 . 14 1 1 A 97 97 GLY HA3 H 97 3.806 3.831 -0.025 1
1 979 . 14 1 1 A 97 97 GLY C C 97 175.449 176.155 -0.706 1
1 980 . 14 1 1 A 97 97 GLY CA C 97 46.917 47.450 -0.533 1
1 981 . 14 1 1 A 97 97 GLY N N 97 107.315 106.951 0.364 1
1 982 . 14 1 1 A 98 98 ILE H H 98 7.630 8.260 -0.630 1
1 983 . 14 1 1 A 98 98 ILE HA H 98 3.399 3.948 -0.549 1
1 993 . 14 1 1 A 98 98 ILE C C 98 178.683 177.854 0.829 1
1 994 . 14 1 1 A 98 98 ILE CA C 98 66.402 64.804 1.598 1
1 995 . 14 1 1 A 98 98 ILE CB C 98 38.037 37.537 0.500 1
1 999 . 14 1 1 A 98 98 ILE N N 98 120.644 120.524 0.120 1
1 1000 . 14 1 1 A 99 99 LEU H H 99 7.076 7.932 -0.856 1
1 1001 . 14 1 1 A 99 99 LEU HA H 99 4.133 4.524 -0.391 1
1 1010 . 14 1 1 A 99 99 LEU C C 99 178.128 177.988 0.140 1
1 1011 . 14 1 1 A 99 99 LEU CA C 99 57.129 57.935 -0.806 1
1 1012 . 14 1 1 A 99 99 LEU CB C 99 41.108 41.395 -0.287 1
1 1014 . 14 1 1 A 99 99 LEU N N 99 116.844 123.873 -7.029 1
1 1015 . 14 1 1 A 100 100 TYR H H 100 7.890 8.170 -0.280 1
1 1016 . 14 1 1 A 100 100 TYR HA H 100 4.550 4.247 0.303 1
1 1021 . 14 1 1 A 100 100 TYR C C 100 178.210 177.557 0.653 1
1 1022 . 14 1 1 A 100 100 TYR CA C 100 59.452 60.958 -1.506 1
1 1023 . 14 1 1 A 100 100 TYR CB C 100 38.786 38.840 -0.054 1
1 1024 . 14 1 1 A 100 100 TYR N N 100 116.427 120.481 -4.054 1
1 1025 . 14 1 1 A 101 101 LEU H H 101 8.041 8.323 -0.282 1
1 1026 . 14 1 1 A 101 101 LEU HA H 101 4.158 3.981 0.177 1
1 1036 . 14 1 1 A 101 101 LEU C C 101 176.808 177.137 -0.329 1
1 1037 . 14 1 1 A 101 101 LEU CA C 101 56.156 58.142 -1.986 1
1 1038 . 14 1 1 A 101 101 LEU CB C 101 44.307 41.682 2.625 1
1 1041 . 14 1 1 A 101 101 LEU N N 101 116.493 120.356 -3.863 1
1 1042 . 14 1 1 A 102 102 ASN H H 102 7.146 7.975 -0.829 1
1 1043 . 14 1 1 A 102 102 ASN HA H 102 5.056 5.002 0.054 1
1 1046 . 14 1 1 A 102 102 ASN CA C 102 52.704 54.684 -1.980 1
1 1047 . 14 1 1 A 102 102 ASN CB C 102 42.424 40.486 1.938 1
1 1048 . 14 1 1 A 102 102 ASN N N 102 114.922 112.929 1.993 1
1 1049 . 14 1 1 A 103 103 GLN H H 103 8.477 8.204 0.273 1
1 1050 . 14 1 1 A 103 103 GLN HA H 103 3.866 4.136 -0.270 1
1 1054 . 14 1 1 A 103 103 GLN C C 103 176.110 176.286 -0.176 1
1 1055 . 14 1 1 A 103 103 GLN CA C 103 58.451 55.416 3.035 1
1 1056 . 14 1 1 A 103 103 GLN CB C 103 28.896 27.703 1.193 1
1 1058 . 14 1 1 A 103 103 GLN N N 103 120.252 117.240 3.012 1
1 1059 . 14 1 1 A 104 104 GLU H H 104 7.930 8.162 -0.232 1
1 1060 . 14 1 1 A 104 104 GLU HA H 104 4.591 4.504 0.087 1
1 1064 . 14 1 1 A 104 104 GLU C C 104 175.397 175.766 -0.369 1
1 1065 . 14 1 1 A 104 104 GLU CA C 104 54.058 58.551 -4.493 1
1 1066 . 14 1 1 A 104 104 GLU CB C 104 31.272 29.213 2.059 1
1 1068 . 14 1 1 A 104 104 GLU N N 104 117.295 119.731 -2.436 1
1 1069 . 14 1 1 A 105 105 VAL H H 105 8.546 8.173 0.373 1
1 1070 . 14 1 1 A 105 105 VAL HA H 105 3.823 4.467 -0.644 1
1 1078 . 14 1 1 A 105 105 VAL CA C 105 60.706 59.165 1.541 1
1 1079 . 14 1 1 A 105 105 VAL CB C 105 32.126 32.814 -0.688 1
1 1082 . 14 1 1 A 105 105 VAL N N 105 124.511 122.864 1.647 1
1 1083 . 14 1 1 A 106 106 PRO HA H 106 3.997 4.534 -0.537 1
1 1089 . 14 1 1 A 106 106 PRO C C 106 178.240 178.021 0.219 1
1 1090 . 14 1 1 A 106 106 PRO CA C 106 62.961 63.030 -0.069 1
1 1091 . 14 1 1 A 106 106 PRO CB C 106 32.321 32.011 0.310 1
1 1094 . 14 1 1 A 107 107 LYS H H 107 9.122 8.982 0.140 1
1 1095 . 14 1 1 A 107 107 LYS HA H 107 3.813 4.027 -0.214 1
1 1101 . 14 1 1 A 107 107 LYS C C 107 178.563 177.882 0.681 1
1 1102 . 14 1 1 A 107 107 LYS CA C 107 60.085 59.441 0.644 1
1 1103 . 14 1 1 A 107 107 LYS CB C 107 31.632 32.526 -0.894 1
1 1106 . 14 1 1 A 107 107 LYS N N 107 129.017 124.673 4.344 1
1 1107 . 14 1 1 A 108 108 GLU H H 108 10.370 8.144 2.226 1
1 1108 . 14 1 1 A 108 108 GLU HA H 108 3.991 4.141 -0.150 1
1 1111 . 14 1 1 A 108 108 GLU C C 108 180.366 179.466 0.900 1
1 1112 . 14 1 1 A 108 108 GLU CA C 108 60.337 59.182 1.155 1
1 1113 . 14 1 1 A 108 108 GLU CB C 108 29.178 29.535 -0.357 1
1 1115 . 14 1 1 A 108 108 GLU N N 108 118.335 119.107 -0.772 1
1 1116 . 14 1 1 A 109 109 LEU H H 109 7.393 8.339 -0.946 1
1 1117 . 14 1 1 A 109 109 LEU HA H 109 4.220 4.235 -0.015 1
1 1126 . 14 1 1 A 109 109 LEU C C 109 177.378 179.156 -1.778 1
1 1127 . 14 1 1 A 109 109 LEU CA C 109 56.618 58.075 -1.457 1
1 1128 . 14 1 1 A 109 109 LEU CB C 109 41.898 41.103 0.795 1
1 1131 . 14 1 1 A 109 109 LEU N N 109 118.285 120.165 -1.880 1
1 1132 . 14 1 1 A 110 110 LEU H H 110 7.641 7.915 -0.274 1
1 1133 . 14 1 1 A 110 110 LEU HA H 110 3.796 4.014 -0.218 1
1 1142 . 14 1 1 A 110 110 LEU C C 110 179.103 178.602 0.501 1
1 1143 . 14 1 1 A 110 110 LEU CA C 110 59.046 58.417 0.629 1
1 1144 . 14 1 1 A 110 110 LEU CB C 110 40.228 41.536 -1.308 1
1 1147 . 14 1 1 A 110 110 LEU N N 110 120.162 120.142 0.020 1
1 1148 . 14 1 1 A 111 111 GLU H H 111 7.916 8.321 -0.405 1
1 1149 . 14 1 1 A 111 111 GLU HA H 111 4.080 4.080 0.000 1
1 1153 . 14 1 1 A 111 111 GLU C C 111 179.967 179.013 0.954 1
1 1154 . 14 1 1 A 111 111 GLU CA C 111 59.243 59.419 -0.176 1
1 1155 . 14 1 1 A 111 111 GLU CB C 111 29.576 29.349 0.227 1
1 1157 . 14 1 1 A 111 111 GLU N N 111 117.360 119.020 -1.660 1
1 1158 . 14 1 1 A 112 112 PHE H H 112 7.712 8.314 -0.602 1
1 1159 . 14 1 1 A 112 112 PHE HA H 112 4.224 4.223 0.001 1
1 1164 . 14 1 1 A 112 112 PHE C C 112 177.180 176.939 0.241 1
1 1165 . 14 1 1 A 112 112 PHE CA C 112 61.407 61.135 0.272 1
1 1166 . 14 1 1 A 112 112 PHE CB C 112 40.172 39.293 0.879 1
1 1167 . 14 1 1 A 112 112 PHE N N 112 123.042 122.338 0.704 1
1 1168 . 14 1 1 A 113 113 LEU H H 113 8.056 8.229 -0.173 1
1 1169 . 14 1 1 A 113 113 LEU HA H 113 4.147 4.270 -0.123 1
1 1175 . 14 1 1 A 113 113 LEU C C 113 173.717 176.093 -2.376 1
1 1176 . 14 1 1 A 113 113 LEU CA C 113 54.093 54.443 -0.350 1
1 1177 . 14 1 1 A 113 113 LEU CB C 113 41.517 42.395 -0.878 1
1 1179 . 14 1 1 A 113 113 LEU N N 113 115.595 117.003 -1.408 1
1 1180 . 14 1 1 A 114 114 ARG H H 114 7.902 7.967 -0.065 1
1 1181 . 14 1 1 A 114 114 ARG HA H 114 3.817 4.293 -0.476 1
1 1182 . 14 1 1 A 114 114 ARG C C 114 174.566 176.439 -1.873 1
1 1183 . 14 1 1 A 114 114 ARG CA C 114 57.233 57.162 0.071 1
1 1184 . 14 1 1 A 114 114 ARG CB C 114 27.788 27.041 0.747 1
1 1185 . 14 1 1 A 114 114 ARG N N 114 116.021 115.424 0.597 1
1 1186 . 14 1 1 A 115 115 LEU H H 115 8.160 7.835 0.325 1
1 1187 . 14 1 1 A 115 115 LEU HA H 115 4.462 4.090 0.372 1
1 1195 . 14 1 1 A 115 115 LEU C C 115 176.374 176.822 -0.448 1
1 1196 . 14 1 1 A 115 115 LEU CA C 115 53.965 55.414 -1.449 1
1 1197 . 14 1 1 A 115 115 LEU CB C 115 44.077 41.308 2.769 1
1 1199 . 14 1 1 A 115 115 LEU N N 115 118.089 118.187 -0.098 1
1 1200 . 14 1 1 A 116 116 ARG H H 116 8.066 7.808 0.258 1
1 1201 . 14 1 1 A 116 116 ARG HA H 116 4.172 4.129 0.043 1
1 1203 . 14 1 1 A 116 116 ARG CA C 116 55.961 57.326 -1.365 1
1 1204 . 14 1 1 A 116 116 ARG CB C 116 31.379 30.146 1.233 1
1 1205 . 14 1 1 A 116 116 ARG N N 116 120.852 122.133 -1.281 1
1 1206 . 14 1 1 A 117 117 HIS H H 117 7.928 9.080 -1.152 1
1 1207 . 14 1 1 A 117 117 HIS HA H 117 4.557 4.195 0.362 1
1 1211 . 14 1 1 A 117 117 HIS CA C 117 55.937 56.813 -0.876 1
1 1212 . 14 1 1 A 117 117 HIS CB C 117 30.875 28.656 2.219 1
1 1213 . 14 1 1 A 118 118 PHE H H 118 8.183 7.704 0.479 1
1 1214 . 14 1 1 A 118 118 PHE HA H 118 4.730 4.401 0.329 1
1 1219 . 14 1 1 A 118 118 PHE CA C 118 55.716 57.467 -1.751 1
1 1220 . 14 1 1 A 118 118 PHE CB C 118 39.263 39.874 -0.611 1
1 1221 . 14 1 1 A 118 118 PHE N N 118 123.480 120.442 3.038 1
1 1222 . 14 1 1 A 119 119 PRO HA H 119 4.398 4.513 -0.115 1
1 1227 . 14 1 1 A 119 119 PRO C C 119 176.666 176.289 0.377 1
1 1228 . 14 1 1 A 119 119 PRO CA C 119 63.377 62.232 1.145 1
1 1229 . 14 1 1 A 119 119 PRO CB C 119 32.059 32.659 -0.600 1
1 1232 . 14 1 1 A 120 120 THR H H 120 8.054 8.414 -0.360 1
1 1233 . 14 1 1 A 120 120 THR HA H 120 4.273 4.942 -0.669 1
1 1238 . 14 1 1 A 120 120 THR C C 120 174.154 172.680 1.474 1
1 1239 . 14 1 1 A 120 120 THR CA C 120 61.893 60.034 1.859 1
1 1240 . 14 1 1 A 120 120 THR CB C 120 69.736 70.533 -0.797 1
1 1242 . 14 1 1 A 120 120 THR N N 120 113.088 111.015 2.073 1
1 1243 . 14 1 1 A 121 121 ASP H H 121 8.209 8.525 -0.316 1
1 1244 . 14 1 1 A 121 121 ASP HA H 121 4.876 5.200 -0.324 1
1 1247 . 14 1 1 A 121 121 ASP CA C 121 52.126 50.886 1.240 1
1 1248 . 14 1 1 A 121 121 ASP CB C 121 41.553 42.872 -1.319 1
1 1249 . 14 1 1 A 121 121 ASP N N 121 123.630 124.469 -0.839 1
1 1250 . 14 1 1 A 122 122 PRO HA H 122 4.363 4.431 -0.068 1
1 1255 . 14 1 1 A 122 122 PRO C C 122 177.344 176.496 0.848 1
1 1256 . 14 1 1 A 122 122 PRO CA C 122 63.913 63.357 0.556 1
1 1257 . 14 1 1 A 122 122 PRO CB C 122 32.116 31.666 0.450 1
1 1260 . 14 1 1 A 123 123 LYS H H 123 8.344 8.386 -0.042 1
1 1261 . 14 1 1 A 123 123 LYS HA H 123 4.244 4.516 -0.272 1
1 1266 . 14 1 1 A 123 123 LYS C C 123 176.637 175.302 1.335 1
1 1267 . 14 1 1 A 123 123 LYS CA C 123 56.359 56.248 0.111 1
1 1268 . 14 1 1 A 123 123 LYS CB C 123 32.367 32.630 -0.263 1
1 1272 . 14 1 1 A 123 123 LYS N N 123 119.110 122.760 -3.650 1
1 1273 . 14 1 1 A 124 124 ALA H H 124 7.929 8.239 -0.310 1
1 1274 . 14 1 1 A 124 124 ALA HA H 124 4.248 4.808 -0.560 1
1 1278 . 14 1 1 A 124 124 ALA C C 124 177.648 177.184 0.464 1
1 1279 . 14 1 1 A 124 124 ALA CA C 124 52.618 51.173 1.445 1
1 1280 . 14 1 1 A 124 124 ALA CB C 124 19.379 19.820 -0.441 1
1 1281 . 14 1 1 A 124 124 ALA N N 124 123.825 130.441 -6.616 1
1 1282 . 14 1 1 A 125 125 SER H H 125 8.134 8.983 -0.849 1
1 1283 . 14 1 1 A 125 125 SER HA H 125 4.341 5.061 -0.720 1
1 1286 . 14 1 1 A 125 125 SER C C 125 174.172 173.276 0.896 1
1 1287 . 14 1 1 A 125 125 SER CA C 125 58.391 58.092 0.299 1
1 1288 . 14 1 1 A 125 125 SER CB C 125 63.748 64.697 -0.949 1
1 1289 . 14 1 1 A 125 125 SER N N 125 114.454 119.935 -5.481 1
1 1290 . 14 1 1 A 126 126 ASN H H 126 8.242 8.047 0.195 1
1 1291 . 14 1 1 A 126 126 ASN HA H 126 4.657 5.020 -0.363 1
1 1294 . 14 1 1 A 126 126 ASN C C 126 174.624 174.845 -0.221 1
1 1295 . 14 1 1 A 126 126 ASN CA C 126 53.292 52.093 1.199 1
1 1296 . 14 1 1 A 126 126 ASN CB C 126 38.797 39.302 -0.505 1
1 1297 . 14 1 1 A 126 126 ASN N N 126 120.102 119.969 0.133 1
1 1298 . 14 1 1 A 127 127 TRP H H 127 8.051 8.119 -0.068 1
1 1299 . 14 1 1 A 127 127 TRP HA H 127 4.694 5.066 -0.372 1
1 1302 . 14 1 1 A 127 127 TRP C C 127 175.479 175.820 -0.341 1
1 1303 . 14 1 1 A 127 127 TRP CA C 127 57.096 56.028 1.068 1
1 1304 . 14 1 1 A 127 127 TRP CB C 127 29.820 31.461 -1.641 1
1 1305 . 14 1 1 A 127 127 TRP N N 127 121.198 120.390 0.808 1
1 1 . 15 1 1 A 7 7 HIS HA H 7 4.623 4.240 0.383 1
1 4 . 15 1 1 A 7 7 HIS C C 7 174.747 175.026 -0.279 1
1 5 . 15 1 1 A 7 7 HIS CA C 7 56.189 56.208 -0.019 1
1 6 . 15 1 1 A 7 7 HIS CB C 7 30.028 28.026 2.002 1
1 7 . 15 1 1 A 8 8 LEU H H 8 8.283 8.234 0.049 1
1 8 . 15 1 1 A 8 8 LEU HA H 8 4.249 4.511 -0.262 1
1 10 . 15 1 1 A 8 8 LEU C C 8 176.700 176.814 -0.114 1
1 11 . 15 1 1 A 8 8 LEU CA C 8 55.498 54.256 1.242 1
1 12 . 15 1 1 A 8 8 LEU CB C 8 42.568 42.476 0.092 1
1 13 . 15 1 1 A 8 8 LEU N N 8 122.916 125.824 -2.908 1
1 14 . 15 1 1 A 9 9 GLU H H 9 8.623 7.838 0.785 1
1 15 . 15 1 1 A 9 9 GLU HA H 9 4.311 4.532 -0.221 1
1 16 . 15 1 1 A 9 9 GLU C C 9 174.811 175.061 -0.250 1
1 17 . 15 1 1 A 9 9 GLU CA C 9 56.377 56.227 0.150 1
1 18 . 15 1 1 A 9 9 GLU CB C 9 29.557 29.233 0.324 1
1 20 . 15 1 1 A 9 9 GLU N N 9 121.512 120.104 1.408 1
1 21 . 15 1 1 A 10 10 LEU H H 10 7.853 8.235 -0.382 1
1 22 . 15 1 1 A 10 10 LEU HA H 10 5.225 5.370 -0.145 1
1 31 . 15 1 1 A 10 10 LEU C C 10 174.637 175.753 -1.116 1
1 32 . 15 1 1 A 10 10 LEU CA C 10 54.513 53.953 0.560 1
1 33 . 15 1 1 A 10 10 LEU CB C 10 45.187 44.421 0.766 1
1 36 . 15 1 1 A 10 10 LEU N N 10 123.592 126.333 -2.741 1
1 37 . 15 1 1 A 11 11 GLU H H 11 8.894 8.745 0.149 1
1 38 . 15 1 1 A 11 11 GLU HA H 11 4.765 5.208 -0.443 1
1 43 . 15 1 1 A 11 11 GLU C C 11 174.563 175.147 -0.584 1
1 44 . 15 1 1 A 11 11 GLU CA C 11 55.047 54.544 0.503 1
1 45 . 15 1 1 A 11 11 GLU CB C 11 33.760 34.167 -0.407 1
1 47 . 15 1 1 A 11 11 GLU N N 11 124.055 122.821 1.234 1
1 48 . 15 1 1 A 12 12 VAL H H 12 8.607 8.637 -0.030 1
1 49 . 15 1 1 A 12 12 VAL HA H 12 5.174 5.487 -0.313 1
1 57 . 15 1 1 A 12 12 VAL C C 12 173.573 175.054 -1.481 1
1 58 . 15 1 1 A 12 12 VAL CA C 12 60.296 61.225 -0.929 1
1 59 . 15 1 1 A 12 12 VAL CB C 12 35.689 34.765 0.924 1
1 62 . 15 1 1 A 12 12 VAL N N 12 120.878 122.179 -1.301 1
1 63 . 15 1 1 A 13 13 HIS H H 13 8.982 8.915 0.067 1
1 64 . 15 1 1 A 13 13 HIS HA H 13 4.824 5.461 -0.637 1
1 69 . 15 1 1 A 13 13 HIS C C 13 173.236 171.972 1.264 1
1 70 . 15 1 1 A 13 13 HIS CA C 13 54.906 53.732 1.174 1
1 71 . 15 1 1 A 13 13 HIS CB C 13 33.496 32.983 0.513 1
1 72 . 15 1 1 A 13 13 HIS N N 13 121.504 122.052 -0.548 1
1 73 . 15 1 1 A 14 14 ILE H H 14 10.442 8.413 2.029 1
1 74 . 15 1 1 A 14 14 ILE HA H 14 5.458 4.878 0.580 1
1 84 . 15 1 1 A 14 14 ILE CA C 14 58.386 57.915 0.471 1
1 85 . 15 1 1 A 14 14 ILE CB C 14 38.596 38.245 0.351 1
1 88 . 15 1 1 A 14 14 ILE N N 14 119.923 121.382 -1.459 1
1 89 . 15 1 1 A 15 15 PRO HA H 15 4.560 4.530 0.030 1
1 95 . 15 1 1 A 15 15 PRO C C 15 176.907 175.885 1.022 1
1 96 . 15 1 1 A 15 15 PRO CA C 15 64.342 64.406 -0.064 1
1 97 . 15 1 1 A 15 15 PRO CB C 15 32.924 32.165 0.759 1
1 100 . 15 1 1 A 16 16 SER H H 16 7.331 7.460 -0.129 1
1 101 . 15 1 1 A 16 16 SER HA H 16 4.822 4.824 -0.002 1
1 104 . 15 1 1 A 16 16 SER C C 16 171.253 172.095 -0.842 1
1 105 . 15 1 1 A 16 16 SER CA C 16 57.135 57.608 -0.473 1
1 106 . 15 1 1 A 16 16 SER CB C 16 65.947 65.262 0.685 1
1 107 . 15 1 1 A 16 16 SER N N 16 107.745 107.955 -0.210 1
1 108 . 15 1 1 A 17 17 VAL H H 17 8.350 8.463 -0.113 1
1 109 . 15 1 1 A 17 17 VAL HA H 17 4.926 5.050 -0.124 1
1 117 . 15 1 1 A 17 17 VAL C C 17 173.692 175.527 -1.835 1
1 118 . 15 1 1 A 17 17 VAL CA C 17 58.721 60.538 -1.817 1
1 119 . 15 1 1 A 17 17 VAL CB C 17 34.420 34.262 0.158 1
1 122 . 15 1 1 A 17 17 VAL N N 17 118.680 121.745 -3.065 1
1 123 . 15 1 1 A 18 18 GLY H H 18 8.332 8.753 -0.421 1
1 124 . 15 1 1 A 18 18 GLY HA2 H 18 4.189 4.272 -0.083 1
1 125 . 15 1 1 A 18 18 GLY HA3 H 18 4.011 4.288 -0.277 1
1 126 . 15 1 1 A 18 18 GLY CA C 18 45.356 45.063 0.293 1
1 127 . 15 1 1 A 18 18 GLY N N 18 112.549 113.147 -0.598 1
1 128 . 15 1 1 A 19 19 PRO HA H 19 4.757 5.015 -0.258 1
1 134 . 15 1 1 A 19 19 PRO C C 19 177.482 176.441 1.041 1
1 135 . 15 1 1 A 19 19 PRO CA C 19 62.848 62.818 0.030 1
1 136 . 15 1 1 A 19 19 PRO CB C 19 32.283 31.577 0.706 1
1 139 . 15 1 1 A 20 20 GLU H H 20 8.588 8.677 -0.089 1
1 140 . 15 1 1 A 20 20 GLU HA H 20 4.147 4.547 -0.400 1
1 144 . 15 1 1 A 20 20 GLU C C 20 175.857 176.545 -0.688 1
1 145 . 15 1 1 A 20 20 GLU CA C 20 57.150 56.139 1.011 1
1 146 . 15 1 1 A 20 20 GLU CB C 20 30.923 31.108 -0.185 1
1 148 . 15 1 1 A 20 20 GLU N N 20 122.087 122.623 -0.536 1
1 149 . 15 1 1 A 21 21 ALA H H 21 8.352 8.384 -0.032 1
1 150 . 15 1 1 A 21 21 ALA HA H 21 4.391 4.576 -0.185 1
1 154 . 15 1 1 A 21 21 ALA C C 21 174.910 176.878 -1.968 1
1 155 . 15 1 1 A 21 21 ALA CA C 21 52.166 51.856 0.310 1
1 156 . 15 1 1 A 21 21 ALA CB C 21 19.915 18.852 1.063 1
1 157 . 15 1 1 A 21 21 ALA N N 21 124.593 127.270 -2.677 1
1 158 . 15 1 1 A 22 22 GLU H H 22 8.398 8.390 0.008 1
1 159 . 15 1 1 A 22 22 GLU HA H 22 4.331 5.182 -0.851 1
1 163 . 15 1 1 A 22 22 GLU C C 22 176.389 175.275 1.114 1
1 164 . 15 1 1 A 22 22 GLU CA C 22 56.316 54.508 1.808 1
1 165 . 15 1 1 A 22 22 GLU CB C 22 30.713 33.947 -3.234 1
1 167 . 15 1 1 A 22 22 GLU N N 22 120.159 121.401 -1.242 1
1 168 . 15 1 1 A 23 23 GLY H H 23 8.246 8.437 -0.191 1
1 169 . 15 1 1 A 23 23 GLY HA2 H 23 4.162 4.231 -0.069 1
1 170 . 15 1 1 A 23 23 GLY HA3 H 23 4.061 4.237 -0.176 1
1 171 . 15 1 1 A 23 23 GLY CA C 23 44.801 45.559 -0.758 1
1 172 . 15 1 1 A 23 23 GLY N N 23 110.080 106.661 3.419 1
1 173 . 15 1 1 A 24 24 PRO HA H 24 4.417 4.616 -0.199 1
1 178 . 15 1 1 A 24 24 PRO C C 24 177.135 175.998 1.137 1
1 179 . 15 1 1 A 24 24 PRO CA C 24 63.520 62.358 1.162 1
1 180 . 15 1 1 A 24 24 PRO CB C 24 32.124 32.984 -0.860 1
1 183 . 15 1 1 A 25 25 ARG H H 25 8.409 8.442 -0.033 1
1 184 . 15 1 1 A 25 25 ARG HA H 25 4.298 4.502 -0.204 1
1 187 . 15 1 1 A 25 25 ARG C C 25 176.217 176.603 -0.386 1
1 188 . 15 1 1 A 25 25 ARG CA C 25 56.237 55.415 0.822 1
1 189 . 15 1 1 A 25 25 ARG CB C 25 30.467 31.274 -0.807 1
1 192 . 15 1 1 A 25 25 ARG N N 25 120.147 120.248 -0.101 1
1 193 . 15 1 1 A 26 26 GLN H H 26 8.278 8.487 -0.209 1
1 194 . 15 1 1 A 26 26 GLN HA H 26 4.336 4.353 -0.017 1
1 200 . 15 1 1 A 26 26 GLN C C 26 175.566 175.448 0.118 1
1 201 . 15 1 1 A 26 26 GLN CA C 26 55.788 56.092 -0.304 1
1 202 . 15 1 1 A 26 26 GLN CB C 26 29.714 28.995 0.719 1
1 204 . 15 1 1 A 26 26 GLN N N 26 120.460 121.718 -1.258 1
1 206 . 15 1 1 A 27 27 SER H H 27 8.298 8.664 -0.366 1
1 208 . 15 1 1 A 27 27 SER CA C 27 56.156 56.425 -0.269 1
1 209 . 15 1 1 A 27 27 SER CB C 27 63.813 64.348 -0.535 1
1 210 . 15 1 1 A 27 27 SER N N 27 117.382 121.853 -4.471 1
1 211 . 15 1 1 A 28 28 PRO HA H 28 4.366 4.452 -0.086 1
1 216 . 15 1 1 A 28 28 PRO C C 28 177.555 178.397 -0.842 1
1 217 . 15 1 1 A 28 28 PRO CA C 28 64.486 64.685 -0.199 1
1 218 . 15 1 1 A 28 28 PRO CB C 28 31.892 32.004 -0.112 1
1 221 . 15 1 1 A 29 29 GLU H H 29 8.582 8.074 0.508 1
1 222 . 15 1 1 A 29 29 GLU HA H 29 4.218 4.267 -0.049 1
1 226 . 15 1 1 A 29 29 GLU CA C 29 57.261 59.444 -2.183 1
1 227 . 15 1 1 A 29 29 GLU CB C 29 29.633 30.062 -0.429 1
1 229 . 15 1 1 A 29 29 GLU N N 29 118.309 117.565 0.744 1
1 230 . 15 1 1 A 30 30 LYS H H 30 7.955 7.889 0.066 1
1 231 . 15 1 1 A 30 30 LYS HA H 30 4.328 3.977 0.351 1
1 236 . 15 1 1 A 30 30 LYS C C 30 176.222 175.899 0.323 1
1 237 . 15 1 1 A 30 30 LYS CA C 30 56.247 58.230 -1.983 1
1 238 . 15 1 1 A 30 30 LYS CB C 30 32.720 30.195 2.525 1
1 242 . 15 1 1 A 30 30 LYS N N 30 120.129 116.870 3.259 1
1 243 . 15 1 1 A 31 31 SER H H 31 7.883 8.241 -0.358 1
1 244 . 15 1 1 A 31 31 SER HA H 31 4.458 4.431 0.027 1
1 246 . 15 1 1 A 31 31 SER C C 31 174.129 174.287 -0.158 1
1 247 . 15 1 1 A 31 31 SER CA C 31 58.477 60.067 -1.590 1
1 248 . 15 1 1 A 31 31 SER CB C 31 64.042 63.573 0.469 1
1 249 . 15 1 1 A 31 31 SER N N 31 115.366 117.657 -2.291 1
1 250 . 15 1 1 A 32 32 HIS H H 32 8.485 8.494 -0.009 1
1 251 . 15 1 1 A 32 32 HIS HA H 32 4.450 4.731 -0.281 1
1 255 . 15 1 1 A 32 32 HIS CA C 32 56.009 55.184 0.825 1
1 256 . 15 1 1 A 32 32 HIS CB C 32 31.122 29.011 2.111 1
1 257 . 15 1 1 A 32 32 HIS N N 32 121.500 122.754 -1.254 1
1 258 . 15 1 1 A 33 33 MET H H 33 8.392 8.161 0.231 1
1 259 . 15 1 1 A 33 33 MET HA H 33 4.601 5.108 -0.507 1
1 265 . 15 1 1 A 33 33 MET C C 33 175.842 174.491 1.351 1
1 266 . 15 1 1 A 33 33 MET CA C 33 54.533 54.659 -0.126 1
1 267 . 15 1 1 A 33 33 MET CB C 33 32.868 36.843 -3.975 1
1 270 . 15 1 1 A 33 33 MET N N 33 120.204 123.519 -3.315 1
1 271 . 15 1 1 A 34 34 VAL H H 34 8.938 9.186 -0.248 1
1 272 . 15 1 1 A 34 34 VAL HA H 34 4.430 4.876 -0.446 1
1 280 . 15 1 1 A 34 34 VAL C C 34 174.149 174.748 -0.599 1
1 281 . 15 1 1 A 34 34 VAL CA C 34 60.703 59.517 1.186 1
1 282 . 15 1 1 A 34 34 VAL CB C 34 34.319 34.460 -0.141 1
1 285 . 15 1 1 A 34 34 VAL N N 34 118.512 118.562 -0.050 1
1 286 . 15 1 1 A 35 35 PHE H H 35 9.242 8.658 0.584 1
1 287 . 15 1 1 A 35 35 PHE HA H 35 4.439 5.417 -0.978 1
1 294 . 15 1 1 A 35 35 PHE C C 35 174.831 174.531 0.300 1
1 295 . 15 1 1 A 35 35 PHE CA C 35 57.754 55.319 2.435 1
1 296 . 15 1 1 A 35 35 PHE CB C 35 38.959 41.097 -2.138 1
1 297 . 15 1 1 A 35 35 PHE N N 35 124.912 121.276 3.636 1
1 298 . 15 1 1 A 36 36 ARG H H 36 8.475 8.928 -0.453 1
1 299 . 15 1 1 A 36 36 ARG HA H 36 4.135 4.610 -0.475 1
1 304 . 15 1 1 A 36 36 ARG C C 36 172.865 175.742 -2.877 1
1 305 . 15 1 1 A 36 36 ARG CA C 36 56.895 56.104 0.791 1
1 306 . 15 1 1 A 36 36 ARG CB C 36 28.962 30.637 -1.675 1
1 308 . 15 1 1 A 36 36 ARG N N 36 125.680 123.039 2.641 1
1 309 . 15 1 1 A 37 37 VAL H H 37 8.066 8.683 -0.617 1
1 310 . 15 1 1 A 37 37 VAL HA H 37 4.292 4.523 -0.231 1
1 318 . 15 1 1 A 37 37 VAL C C 37 174.595 174.332 0.263 1
1 319 . 15 1 1 A 37 37 VAL CA C 37 62.727 61.439 1.288 1
1 320 . 15 1 1 A 37 37 VAL CB C 37 31.102 32.810 -1.708 1
1 323 . 15 1 1 A 37 37 VAL N N 37 125.403 120.855 4.548 1
1 324 . 15 1 1 A 38 38 GLU H H 38 9.532 9.095 0.437 1
1 325 . 15 1 1 A 38 38 GLU HA H 38 4.895 4.995 -0.100 1
1 329 . 15 1 1 A 38 38 GLU C C 38 174.509 174.968 -0.459 1
1 330 . 15 1 1 A 38 38 GLU CA C 38 55.650 55.106 0.544 1
1 331 . 15 1 1 A 38 38 GLU CB C 38 32.214 30.610 1.604 1
1 333 . 15 1 1 A 38 38 GLU N N 38 129.885 126.716 3.169 1
1 334 . 15 1 1 A 39 39 VAL H H 39 9.035 8.851 0.184 1
1 335 . 15 1 1 A 39 39 VAL HA H 39 4.446 4.422 0.024 1
1 343 . 15 1 1 A 39 39 VAL C C 39 173.661 174.169 -0.508 1
1 344 . 15 1 1 A 39 39 VAL CA C 39 61.258 61.645 -0.387 1
1 345 . 15 1 1 A 39 39 VAL CB C 39 33.533 32.678 0.855 1
1 348 . 15 1 1 A 39 39 VAL N N 39 127.941 127.372 0.569 1
1 349 . 15 1 1 A 40 40 LEU H H 40 8.843 9.353 -0.510 1
1 350 . 15 1 1 A 40 40 LEU HA H 40 5.130 5.090 0.040 1
1 360 . 15 1 1 A 40 40 LEU C C 40 175.581 175.313 0.268 1
1 361 . 15 1 1 A 40 40 LEU CA C 40 53.702 53.760 -0.058 1
1 362 . 15 1 1 A 40 40 LEU CB C 40 43.989 43.812 0.177 1
1 366 . 15 1 1 A 40 40 LEU N N 40 128.413 129.595 -1.182 1
1 367 . 15 1 1 A 41 41 CYS H H 41 8.959 9.065 -0.106 1
1 368 . 15 1 1 A 41 41 CYS HA H 41 5.174 5.165 0.009 1
1 371 . 15 1 1 A 41 41 CYS C C 41 175.043 173.729 1.314 1
1 372 . 15 1 1 A 41 41 CYS CA C 41 57.483 57.442 0.041 1
1 373 . 15 1 1 A 41 41 CYS CB C 41 28.472 30.345 -1.873 1
1 374 . 15 1 1 A 41 41 CYS N N 41 124.738 124.701 0.037 1
1 375 . 15 1 1 A 42 42 SER H H 42 9.527 9.287 0.240 1
1 376 . 15 1 1 A 42 42 SER HA H 42 4.149 4.333 -0.184 1
1 379 . 15 1 1 A 42 42 SER C C 42 175.014 174.483 0.531 1
1 380 . 15 1 1 A 42 42 SER CA C 42 59.058 59.521 -0.463 1
1 381 . 15 1 1 A 42 42 SER CB C 42 62.287 61.861 0.426 1
1 382 . 15 1 1 A 42 42 SER N N 42 125.889 117.478 8.411 1
1 383 . 15 1 1 A 43 43 GLY H H 43 8.685 7.983 0.702 1
1 384 . 15 1 1 A 43 43 GLY HA2 H 43 3.594 3.693 -0.099 1
1 385 . 15 1 1 A 43 43 GLY HA3 H 43 4.210 3.813 0.397 1
1 386 . 15 1 1 A 43 43 GLY C C 43 173.664 173.592 0.072 1
1 387 . 15 1 1 A 43 43 GLY CA C 43 45.404 45.189 0.215 1
1 388 . 15 1 1 A 43 43 GLY N N 43 104.633 105.844 -1.211 1
1 389 . 15 1 1 A 44 44 ARG H H 44 7.926 7.919 0.007 1
1 390 . 15 1 1 A 44 44 ARG HA H 44 4.678 4.666 0.012 1
1 395 . 15 1 1 A 44 44 ARG C C 44 175.261 175.802 -0.541 1
1 396 . 15 1 1 A 44 44 ARG CA C 44 55.011 54.958 0.053 1
1 397 . 15 1 1 A 44 44 ARG CB C 44 32.138 32.565 -0.427 1
1 400 . 15 1 1 A 44 44 ARG N N 44 121.239 120.493 0.746 1
1 401 . 15 1 1 A 45 45 ARG H H 45 8.775 8.568 0.207 1
1 402 . 15 1 1 A 45 45 ARG HA H 45 5.770 4.621 1.149 1
1 409 . 15 1 1 A 45 45 ARG C C 45 176.064 175.547 0.517 1
1 410 . 15 1 1 A 45 45 ARG CA C 45 54.683 56.061 -1.378 1
1 411 . 15 1 1 A 45 45 ARG CB C 45 33.748 32.324 1.424 1
1 414 . 15 1 1 A 45 45 ARG N N 45 125.948 123.608 2.340 1
1 415 . 15 1 1 A 46 46 HIS H H 46 8.912 8.310 0.602 1
1 416 . 15 1 1 A 46 46 HIS HA H 46 4.927 5.837 -0.910 1
1 420 . 15 1 1 A 46 46 HIS C C 46 172.634 171.992 0.642 1
1 421 . 15 1 1 A 46 46 HIS CA C 46 56.480 54.914 1.566 1
1 422 . 15 1 1 A 46 46 HIS CB C 46 33.608 31.919 1.689 1
1 423 . 15 1 1 A 46 46 HIS N N 46 121.825 116.544 5.281 1
1 424 . 15 1 1 A 47 47 THR H H 47 8.532 9.559 -1.027 1
1 425 . 15 1 1 A 47 47 THR HA H 47 5.472 4.529 0.943 1
1 430 . 15 1 1 A 47 47 THR C C 47 174.442 173.983 0.459 1
1 431 . 15 1 1 A 47 47 THR CA C 47 61.093 62.734 -1.641 1
1 432 . 15 1 1 A 47 47 THR CB C 47 71.041 68.982 2.059 1
1 434 . 15 1 1 A 47 47 THR N N 47 115.450 120.307 -4.857 1
1 435 . 15 1 1 A 48 48 VAL H H 48 9.695 9.324 0.371 1
1 436 . 15 1 1 A 48 48 VAL HA H 48 4.677 4.402 0.275 1
1 444 . 15 1 1 A 48 48 VAL CA C 48 58.172 59.160 -0.988 1
1 445 . 15 1 1 A 48 48 VAL CB C 48 34.990 33.101 1.889 1
1 448 . 15 1 1 A 48 48 VAL N N 48 126.721 127.107 -0.386 1
1 449 . 15 1 1 A 49 49 PRO HA H 49 5.087 4.550 0.537 1
1 453 . 15 1 1 A 49 49 PRO CA C 49 61.671 62.838 -1.167 1
1 454 . 15 1 1 A 49 49 PRO CB C 49 31.923 31.690 0.233 1
1 457 . 15 1 1 A 50 50 ARG H H 50 9.125 8.489 0.636 1
1 458 . 15 1 1 A 50 50 ARG HA H 50 4.974 4.603 0.371 1
1 464 . 15 1 1 A 50 50 ARG C C 50 176.187 174.492 1.695 1
1 465 . 15 1 1 A 50 50 ARG CA C 50 53.015 54.159 -1.144 1
1 466 . 15 1 1 A 50 50 ARG CB C 50 36.553 32.405 4.148 1
1 468 . 15 1 1 A 50 50 ARG N N 50 124.189 123.116 1.073 1
1 469 . 15 1 1 A 51 51 ARG H H 51 10.105 8.656 1.449 1
1 470 . 15 1 1 A 51 51 ARG HA H 51 5.196 4.395 0.801 1
1 475 . 15 1 1 A 51 51 ARG C C 51 178.865 176.880 1.985 1
1 476 . 15 1 1 A 51 51 ARG CA C 51 55.961 55.880 0.081 1
1 477 . 15 1 1 A 51 51 ARG CB C 51 32.539 31.344 1.195 1
1 480 . 15 1 1 A 51 51 ARG N N 51 124.521 126.782 -2.261 1
1 481 . 15 1 1 A 52 52 TYR H H 52 10.397 9.136 1.261 1
1 482 . 15 1 1 A 52 52 TYR HA H 52 4.360 4.180 0.180 1
1 487 . 15 1 1 A 52 52 TYR C C 52 178.143 177.727 0.416 1
1 488 . 15 1 1 A 52 52 TYR CA C 52 63.538 61.783 1.755 1
1 489 . 15 1 1 A 52 52 TYR CB C 52 38.784 38.731 0.053 1
1 490 . 15 1 1 A 52 52 TYR N N 52 124.772 127.544 -2.772 1
1 491 . 15 1 1 A 53 53 SER H H 53 9.231 8.250 0.981 1
1 492 . 15 1 1 A 53 53 SER HA H 53 4.175 4.349 -0.174 1
1 493 . 15 1 1 A 53 53 SER C C 53 177.220 177.560 -0.340 1
1 494 . 15 1 1 A 53 53 SER CA C 53 61.606 61.850 -0.244 1
1 495 . 15 1 1 A 53 53 SER N N 53 113.262 114.886 -1.624 1
1 496 . 15 1 1 A 54 54 GLU H H 54 7.807 7.919 -0.112 1
1 497 . 15 1 1 A 54 54 GLU HA H 54 4.392 4.189 0.203 1
1 501 . 15 1 1 A 54 54 GLU C C 54 180.361 178.887 1.474 1
1 502 . 15 1 1 A 54 54 GLU CA C 54 59.497 59.355 0.142 1
1 503 . 15 1 1 A 54 54 GLU CB C 54 30.708 29.355 1.353 1
1 504 . 15 1 1 A 54 54 GLU N N 54 121.949 121.572 0.377 1
1 505 . 15 1 1 A 55 55 PHE H H 55 8.133 7.821 0.312 1
1 506 . 15 1 1 A 55 55 PHE HA H 55 4.007 4.100 -0.093 1
1 513 . 15 1 1 A 55 55 PHE C C 55 176.531 177.296 -0.765 1
1 514 . 15 1 1 A 55 55 PHE CA C 55 61.848 61.239 0.609 1
1 515 . 15 1 1 A 55 55 PHE CB C 55 38.847 38.399 0.448 1
1 516 . 15 1 1 A 55 55 PHE N N 55 119.998 120.848 -0.850 1
1 517 . 15 1 1 A 56 56 HIS H H 56 7.907 7.785 0.122 1
1 518 . 15 1 1 A 56 56 HIS HA H 56 3.324 4.168 -0.844 1
1 522 . 15 1 1 A 56 56 HIS C C 56 176.748 177.595 -0.847 1
1 523 . 15 1 1 A 56 56 HIS CA C 56 58.770 59.711 -0.941 1
1 524 . 15 1 1 A 56 56 HIS CB C 56 30.404 29.633 0.771 1
1 525 . 15 1 1 A 56 56 HIS N N 56 119.173 117.412 1.761 1
1 526 . 15 1 1 A 57 57 ALA H H 57 7.962 8.205 -0.243 1
1 527 . 15 1 1 A 57 57 ALA HA H 57 3.865 4.017 -0.152 1
1 531 . 15 1 1 A 57 57 ALA C C 57 180.075 179.938 0.137 1
1 532 . 15 1 1 A 57 57 ALA CA C 57 54.996 55.152 -0.156 1
1 533 . 15 1 1 A 57 57 ALA CB C 57 18.226 17.909 0.317 1
1 534 . 15 1 1 A 57 57 ALA N N 57 120.094 122.848 -2.754 1
1 535 . 15 1 1 A 58 58 LEU H H 58 7.295 8.070 -0.775 1
1 536 . 15 1 1 A 58 58 LEU HA H 58 3.994 3.818 0.176 1
1 546 . 15 1 1 A 58 58 LEU C C 58 177.428 178.446 -1.018 1
1 547 . 15 1 1 A 58 58 LEU CA C 58 58.342 57.791 0.551 1
1 548 . 15 1 1 A 58 58 LEU CB C 58 40.851 41.418 -0.567 1
1 552 . 15 1 1 A 58 58 LEU N N 58 119.404 120.320 -0.916 1
1 553 . 15 1 1 A 59 59 HIS H H 59 7.805 8.070 -0.265 1
1 554 . 15 1 1 A 59 59 HIS HA H 59 4.286 4.030 0.256 1
1 558 . 15 1 1 A 59 59 HIS C C 59 177.001 177.332 -0.331 1
1 559 . 15 1 1 A 59 59 HIS CA C 59 60.141 60.139 0.002 1
1 560 . 15 1 1 A 59 59 HIS CB C 59 31.072 29.802 1.270 1
1 561 . 15 1 1 A 59 59 HIS N N 59 119.040 117.993 1.047 1
1 562 . 15 1 1 A 60 60 LYS H H 60 7.715 8.078 -0.363 1
1 563 . 15 1 1 A 60 60 LYS HA H 60 3.456 3.826 -0.370 1
1 570 . 15 1 1 A 60 60 LYS C C 60 178.464 178.769 -0.305 1
1 571 . 15 1 1 A 60 60 LYS CA C 60 59.629 59.029 0.600 1
1 572 . 15 1 1 A 60 60 LYS CB C 60 32.354 31.853 0.501 1
1 576 . 15 1 1 A 60 60 LYS N N 60 114.225 117.716 -3.491 1
1 577 . 15 1 1 A 61 61 ARG H H 61 7.486 7.639 -0.153 1
1 578 . 15 1 1 A 61 61 ARG HA H 61 4.202 3.962 0.240 1
1 584 . 15 1 1 A 61 61 ARG C C 61 178.995 178.740 0.255 1
1 585 . 15 1 1 A 61 61 ARG CA C 61 58.387 59.551 -1.164 1
1 586 . 15 1 1 A 61 61 ARG CB C 61 31.216 30.007 1.209 1
1 589 . 15 1 1 A 61 61 ARG N N 61 115.929 118.870 -2.941 1
1 590 . 15 1 1 A 62 62 ILE H H 62 8.066 7.258 0.808 1
1 591 . 15 1 1 A 62 62 ILE HA H 62 4.491 3.623 0.868 1
1 601 . 15 1 1 A 62 62 ILE C C 62 177.838 177.254 0.584 1
1 602 . 15 1 1 A 62 62 ILE CA C 62 63.399 63.151 0.248 1
1 603 . 15 1 1 A 62 62 ILE CB C 62 39.699 37.122 2.577 1
1 606 . 15 1 1 A 62 62 ILE N N 62 111.456 115.624 -4.168 1
1 607 . 15 1 1 A 63 63 LYS H H 63 8.158 8.540 -0.382 1
1 608 . 15 1 1 A 63 63 LYS HA H 63 4.136 3.858 0.278 1
1 615 . 15 1 1 A 63 63 LYS C C 63 176.358 177.723 -1.365 1
1 616 . 15 1 1 A 63 63 LYS CA C 63 58.753 58.791 -0.038 1
1 617 . 15 1 1 A 63 63 LYS CB C 63 30.825 31.729 -0.904 1
1 621 . 15 1 1 A 63 63 LYS N N 63 120.800 123.500 -2.700 1
1 622 . 15 1 1 A 64 64 LYS H H 64 7.687 7.394 0.293 1
1 623 . 15 1 1 A 64 64 LYS HA H 64 4.301 4.103 0.198 1
1 628 . 15 1 1 A 64 64 LYS C C 64 177.084 177.557 -0.473 1
1 629 . 15 1 1 A 64 64 LYS CA C 64 57.237 58.238 -1.001 1
1 630 . 15 1 1 A 64 64 LYS CB C 64 32.502 32.671 -0.169 1
1 634 . 15 1 1 A 64 64 LYS N N 64 116.548 118.830 -2.282 1
1 635 . 15 1 1 A 65 65 LEU H H 65 7.476 7.519 -0.043 1
1 636 . 15 1 1 A 65 65 LEU HA H 65 4.219 4.237 -0.018 1
1 645 . 15 1 1 A 65 65 LEU C C 65 175.886 176.790 -0.904 1
1 646 . 15 1 1 A 65 65 LEU CA C 65 55.542 56.323 -0.781 1
1 647 . 15 1 1 A 65 65 LEU CB C 65 45.493 43.294 2.199 1
1 650 . 15 1 1 A 65 65 LEU N N 65 118.000 117.540 0.460 1
1 651 . 15 1 1 A 66 66 TYR H H 66 7.672 7.993 -0.321 1
1 652 . 15 1 1 A 66 66 TYR HA H 66 4.762 5.318 -0.556 1
1 660 . 15 1 1 A 66 66 TYR C C 66 174.199 173.818 0.381 1
1 661 . 15 1 1 A 66 66 TYR CA C 66 56.013 55.278 0.735 1
1 662 . 15 1 1 A 66 66 TYR CB C 66 40.380 41.254 -0.874 1
1 663 . 15 1 1 A 66 66 TYR N N 66 116.805 114.837 1.968 1
1 664 . 15 1 1 A 67 67 LYS H H 67 8.547 8.529 0.018 1
1 665 . 15 1 1 A 67 67 LYS HA H 67 4.436 4.676 -0.240 1
1 670 . 15 1 1 A 67 67 LYS C C 67 175.727 176.134 -0.407 1
1 671 . 15 1 1 A 67 67 LYS CA C 67 56.598 56.454 0.144 1
1 672 . 15 1 1 A 67 67 LYS CB C 67 32.743 32.986 -0.243 1
1 676 . 15 1 1 A 67 67 LYS N N 67 120.929 120.451 0.478 1
1 677 . 15 1 1 A 68 68 VAL H H 68 8.168 8.715 -0.547 1
1 678 . 15 1 1 A 68 68 VAL HA H 68 4.869 4.765 0.104 1
1 686 . 15 1 1 A 68 68 VAL CA C 68 57.389 58.347 -0.958 1
1 687 . 15 1 1 A 68 68 VAL CB C 68 34.017 34.954 -0.937 1
1 690 . 15 1 1 A 68 68 VAL N N 68 116.467 117.479 -1.012 1
1 691 . 15 1 1 A 69 69 PRO HA H 69 4.674 4.654 0.020 1
1 696 . 15 1 1 A 69 69 PRO C C 69 178.013 176.156 1.857 1
1 697 . 15 1 1 A 69 69 PRO CA C 69 61.443 62.593 -1.150 1
1 698 . 15 1 1 A 69 69 PRO CB C 69 32.231 32.498 -0.267 1
1 701 . 15 1 1 A 70 70 ASP H H 70 8.167 8.692 -0.525 1
1 702 . 15 1 1 A 70 70 ASP HA H 70 4.531 4.809 -0.278 1
1 705 . 15 1 1 A 70 70 ASP C C 70 175.660 175.749 -0.089 1
1 706 . 15 1 1 A 70 70 ASP CA C 70 55.148 52.961 2.187 1
1 707 . 15 1 1 A 70 70 ASP CB C 70 40.876 41.785 -0.909 1
1 708 . 15 1 1 A 70 70 ASP N N 70 116.671 121.636 -4.965 1
1 709 . 15 1 1 A 71 71 PHE H H 71 8.387 8.151 0.236 1
1 710 . 15 1 1 A 71 71 PHE HA H 71 4.076 4.531 -0.455 1
1 717 . 15 1 1 A 71 71 PHE CA C 71 55.672 55.821 -0.149 1
1 718 . 15 1 1 A 71 71 PHE CB C 71 39.155 38.799 0.356 1
1 719 . 15 1 1 A 71 71 PHE N N 71 126.533 121.314 5.219 1
1 720 . 15 1 1 A 72 72 PRO HA H 72 4.156 4.528 -0.372 1
1 727 . 15 1 1 A 72 72 PRO CA C 72 63.079 63.105 -0.026 1
1 728 . 15 1 1 A 72 72 PRO CB C 72 32.107 32.088 0.019 1
1 731 . 15 1 1 A 73 73 SER H H 73 8.468 8.572 -0.104 1
1 733 . 15 1 1 A 73 73 SER CA C 73 56.133 58.834 -2.701 1
1 734 . 15 1 1 A 73 73 SER CB C 73 63.991 63.693 0.298 1
1 735 . 15 1 1 A 73 73 SER N N 73 121.533 118.141 3.392 1
1 736 . 15 1 1 A 74 74 LYS HA H 74 4.574 4.200 0.374 1
1 739 . 15 1 1 A 74 74 LYS CA C 74 55.659 58.468 -2.809 1
1 740 . 15 1 1 A 74 74 LYS CB C 74 30.550 32.136 -1.586 1
1 741 . 15 1 1 A 75 75 ARG H H 75 7.962 7.284 0.678 1
1 742 . 15 1 1 A 75 75 ARG HA H 75 4.162 4.621 -0.459 1
1 746 . 15 1 1 A 75 75 ARG CA C 75 56.123 55.438 0.685 1
1 747 . 15 1 1 A 75 75 ARG CB C 75 31.179 31.462 -0.283 1
1 749 . 15 1 1 A 75 75 ARG N N 75 121.665 121.680 -0.015 1
1 750 . 15 1 1 A 76 76 LEU H H 76 8.071 8.273 -0.202 1
1 751 . 15 1 1 A 76 76 LEU HA H 76 4.618 4.569 0.049 1
1 759 . 15 1 1 A 76 76 LEU CA C 76 52.764 51.043 1.721 1
1 760 . 15 1 1 A 76 76 LEU CB C 76 41.918 44.568 -2.650 1
1 762 . 15 1 1 A 76 76 LEU N N 76 124.196 127.920 -3.724 1
1 763 . 15 1 1 A 77 77 PRO HA H 77 4.393 4.284 0.109 1
1 767 . 15 1 1 A 77 77 PRO CA C 77 63.746 62.313 1.433 1
1 770 . 15 1 1 A 78 78 ASN H H 78 8.379 8.625 -0.246 1
1 771 . 15 1 1 A 78 78 ASN HA H 78 4.586 4.335 0.251 1
1 776 . 15 1 1 A 78 78 ASN C C 78 175.648 175.000 0.648 1
1 777 . 15 1 1 A 78 78 ASN CA C 78 53.591 53.467 0.124 1
1 778 . 15 1 1 A 78 78 ASN CB C 78 37.826 38.867 -1.041 1
1 779 . 15 1 1 A 78 78 ASN N N 78 115.292 119.419 -4.127 1
1 781 . 15 1 1 A 79 79 TRP H H 79 7.900 8.001 -0.101 1
1 782 . 15 1 1 A 79 79 TRP HA H 79 4.326 4.287 0.039 1
1 788 . 15 1 1 A 79 79 TRP CA C 79 58.825 60.887 -2.062 1
1 789 . 15 1 1 A 79 79 TRP CB C 79 29.090 27.826 1.264 1
1 790 . 15 1 1 A 79 79 TRP N N 79 119.525 118.725 0.800 1
1 792 . 15 1 1 A 80 80 ARG H H 80 8.060 8.367 -0.307 1
1 793 . 15 1 1 A 80 80 ARG HA H 80 3.913 3.985 -0.072 1
1 798 . 15 1 1 A 80 80 ARG C C 80 177.024 178.901 -1.877 1
1 799 . 15 1 1 A 80 80 ARG CA C 80 58.292 59.562 -1.270 1
1 800 . 15 1 1 A 80 80 ARG CB C 80 30.146 30.081 0.065 1
1 803 . 15 1 1 A 80 80 ARG N N 80 118.864 120.603 -1.739 1
1 804 . 15 1 1 A 81 81 THR H H 81 7.725 7.979 -0.254 1
1 805 . 15 1 1 A 81 81 THR HA H 81 4.297 3.956 0.341 1
1 809 . 15 1 1 A 81 81 THR CA C 81 62.481 66.929 -4.448 1
1 811 . 15 1 1 A 81 81 THR N N 81 109.863 117.725 -7.862 1
1 812 . 15 1 1 A 82 82 ARG HA H 82 4.341 4.330 0.011 1
1 816 . 15 1 1 A 82 82 ARG C C 82 177.261 176.300 0.961 1
1 817 . 15 1 1 A 82 82 ARG CA C 82 56.846 56.802 0.044 1
1 818 . 15 1 1 A 82 82 ARG CB C 82 30.288 32.115 -1.827 1
1 820 . 15 1 1 A 83 83 GLY H H 83 8.321 8.035 0.286 1
1 821 . 15 1 1 A 83 83 GLY HA2 H 83 3.957 4.100 -0.143 1
1 822 . 15 1 1 A 83 83 GLY C C 83 175.185 174.741 0.444 1
1 823 . 15 1 1 A 83 83 GLY CA C 83 46.297 44.223 2.074 1
1 824 . 15 1 1 A 83 83 GLY N N 83 109.146 106.172 2.974 1
1 825 . 15 1 1 A 84 84 LEU H H 84 8.303 8.885 -0.582 1
1 826 . 15 1 1 A 84 84 LEU HA H 84 4.018 4.110 -0.092 1
1 835 . 15 1 1 A 84 84 LEU C C 84 178.552 178.253 0.299 1
1 836 . 15 1 1 A 84 84 LEU CA C 84 58.236 55.957 2.279 1
1 837 . 15 1 1 A 84 84 LEU CB C 84 41.837 41.612 0.225 1
1 840 . 15 1 1 A 84 84 LEU N N 84 122.662 121.011 1.651 1
1 841 . 15 1 1 A 85 85 GLU H H 85 8.233 8.175 0.058 1
1 842 . 15 1 1 A 85 85 GLU HA H 85 4.371 3.820 0.551 1
1 846 . 15 1 1 A 85 85 GLU C C 85 178.555 178.704 -0.149 1
1 847 . 15 1 1 A 85 85 GLU CA C 85 58.377 60.033 -1.656 1
1 848 . 15 1 1 A 85 85 GLU CB C 85 28.675 29.107 -0.432 1
1 850 . 15 1 1 A 85 85 GLU N N 85 119.781 121.088 -1.307 1
1 851 . 15 1 1 A 86 86 GLN H H 86 7.877 7.839 0.038 1
1 852 . 15 1 1 A 86 86 GLN HA H 86 4.100 4.118 -0.018 1
1 858 . 15 1 1 A 86 86 GLN C C 86 179.557 178.068 1.489 1
1 859 . 15 1 1 A 86 86 GLN CA C 86 58.955 59.084 -0.129 1
1 860 . 15 1 1 A 86 86 GLN CB C 86 28.191 28.674 -0.483 1
1 862 . 15 1 1 A 86 86 GLN N N 86 118.042 118.529 -0.487 1
1 863 . 15 1 1 A 87 87 ARG H H 87 8.169 8.121 0.048 1
1 864 . 15 1 1 A 87 87 ARG HA H 87 3.975 3.952 0.023 1
1 868 . 15 1 1 A 87 87 ARG C C 87 177.051 178.378 -1.327 1
1 869 . 15 1 1 A 87 87 ARG CA C 87 59.006 59.498 -0.492 1
1 870 . 15 1 1 A 87 87 ARG CB C 87 30.383 29.384 0.999 1
1 872 . 15 1 1 A 87 87 ARG N N 87 121.381 119.869 1.512 1
1 873 . 15 1 1 A 88 88 ARG H H 88 8.593 8.339 0.254 1
1 874 . 15 1 1 A 88 88 ARG HA H 88 3.726 3.756 -0.030 1
1 876 . 15 1 1 A 88 88 ARG C C 88 177.520 178.383 -0.863 1
1 877 . 15 1 1 A 88 88 ARG CA C 88 60.751 58.769 1.982 1
1 878 . 15 1 1 A 88 88 ARG CB C 88 30.153 30.135 0.018 1
1 879 . 15 1 1 A 88 88 ARG N N 88 120.863 117.725 3.138 1
1 880 . 15 1 1 A 89 89 GLN H H 89 8.355 8.036 0.319 1
1 881 . 15 1 1 A 89 89 GLN HA H 89 3.887 3.951 -0.064 1
1 887 . 15 1 1 A 89 89 GLN C C 89 179.499 178.328 1.171 1
1 888 . 15 1 1 A 89 89 GLN CA C 89 59.603 59.198 0.405 1
1 889 . 15 1 1 A 89 89 GLN CB C 89 28.464 28.042 0.422 1
1 891 . 15 1 1 A 89 89 GLN N N 89 116.860 119.358 -2.498 1
1 893 . 15 1 1 A 90 90 GLY H H 90 8.406 8.508 -0.102 1
1 894 . 15 1 1 A 90 90 GLY HA2 H 90 3.672 3.600 0.072 1
1 895 . 15 1 1 A 90 90 GLY HA3 H 90 3.871 3.618 0.253 1
1 896 . 15 1 1 A 90 90 GLY C C 90 177.033 175.789 1.244 1
1 897 . 15 1 1 A 90 90 GLY CA C 90 46.813 47.261 -0.448 1
1 898 . 15 1 1 A 90 90 GLY N N 90 107.679 107.501 0.178 1
1 899 . 15 1 1 A 91 91 LEU H H 91 8.504 8.084 0.420 1
1 900 . 15 1 1 A 91 91 LEU HA H 91 3.784 3.882 -0.098 1
1 910 . 15 1 1 A 91 91 LEU C C 91 178.003 179.363 -1.360 1
1 911 . 15 1 1 A 91 91 LEU CA C 91 57.354 57.352 0.002 1
1 912 . 15 1 1 A 91 91 LEU CB C 91 40.359 40.884 -0.525 1
1 916 . 15 1 1 A 91 91 LEU N N 91 123.959 121.350 2.609 1
1 917 . 15 1 1 A 92 92 GLU H H 92 8.324 8.129 0.195 1
1 918 . 15 1 1 A 92 92 GLU HA H 92 3.732 3.989 -0.257 1
1 922 . 15 1 1 A 92 92 GLU C C 92 177.272 178.420 -1.148 1
1 923 . 15 1 1 A 92 92 GLU CA C 92 60.651 59.745 0.906 1
1 924 . 15 1 1 A 92 92 GLU CB C 92 30.843 29.346 1.497 1
1 926 . 15 1 1 A 92 92 GLU N N 92 121.991 120.989 1.002 1
1 927 . 15 1 1 A 93 93 ALA H H 93 8.126 7.799 0.327 1
1 928 . 15 1 1 A 93 93 ALA HA H 93 4.160 4.160 0.000 1
1 932 . 15 1 1 A 93 93 ALA C C 93 180.818 179.624 1.194 1
1 933 . 15 1 1 A 93 93 ALA CA C 93 54.828 54.893 -0.065 1
1 934 . 15 1 1 A 93 93 ALA CB C 93 18.032 18.034 -0.002 1
1 935 . 15 1 1 A 93 93 ALA N N 93 120.066 122.316 -2.250 1
1 936 . 15 1 1 A 94 94 TYR H H 94 7.916 7.741 0.175 1
1 937 . 15 1 1 A 94 94 TYR HA H 94 4.139 4.345 -0.206 1
1 942 . 15 1 1 A 94 94 TYR C C 94 175.895 177.197 -1.302 1
1 943 . 15 1 1 A 94 94 TYR CA C 94 61.915 61.309 0.606 1
1 944 . 15 1 1 A 94 94 TYR CB C 94 38.740 38.672 0.068 1
1 945 . 15 1 1 A 94 94 TYR N N 94 121.179 120.035 1.144 1
1 946 . 15 1 1 A 95 95 ILE H H 95 7.983 8.766 -0.783 1
1 947 . 15 1 1 A 95 95 ILE HA H 95 3.614 3.742 -0.128 1
1 957 . 15 1 1 A 95 95 ILE C C 95 174.678 178.226 -3.548 1
1 958 . 15 1 1 A 95 95 ILE CA C 95 63.461 65.502 -2.041 1
1 959 . 15 1 1 A 95 95 ILE CB C 95 36.625 37.954 -1.329 1
1 963 . 15 1 1 A 95 95 ILE N N 95 116.397 121.036 -4.639 1
1 964 . 15 1 1 A 96 96 GLN H H 96 8.175 8.747 -0.572 1
1 965 . 15 1 1 A 96 96 GLN HA H 96 3.763 3.983 -0.220 1
1 970 . 15 1 1 A 96 96 GLN C C 96 179.042 178.408 0.634 1
1 971 . 15 1 1 A 96 96 GLN CA C 96 59.270 59.626 -0.356 1
1 972 . 15 1 1 A 96 96 GLN CB C 96 27.696 28.021 -0.325 1
1 974 . 15 1 1 A 96 96 GLN N N 96 116.631 120.533 -3.902 1
1 976 . 15 1 1 A 97 97 GLY H H 97 8.222 8.150 0.072 1
1 977 . 15 1 1 A 97 97 GLY HA2 H 97 3.661 3.667 -0.006 1
1 978 . 15 1 1 A 97 97 GLY HA3 H 97 3.806 3.702 0.104 1
1 979 . 15 1 1 A 97 97 GLY C C 97 175.449 176.084 -0.635 1
1 980 . 15 1 1 A 97 97 GLY CA C 97 46.917 47.400 -0.483 1
1 981 . 15 1 1 A 97 97 GLY N N 97 107.315 106.985 0.330 1
1 982 . 15 1 1 A 98 98 ILE H H 98 7.630 8.251 -0.621 1
1 983 . 15 1 1 A 98 98 ILE HA H 98 3.399 3.720 -0.321 1
1 993 . 15 1 1 A 98 98 ILE C C 98 178.683 177.855 0.828 1
1 994 . 15 1 1 A 98 98 ILE CA C 98 66.402 64.575 1.827 1
1 995 . 15 1 1 A 98 98 ILE CB C 98 38.037 37.115 0.922 1
1 999 . 15 1 1 A 98 98 ILE N N 98 120.644 119.815 0.829 1
1 1000 . 15 1 1 A 99 99 LEU H H 99 7.076 7.831 -0.755 1
1 1001 . 15 1 1 A 99 99 LEU HA H 99 4.133 3.938 0.195 1
1 1010 . 15 1 1 A 99 99 LEU C C 99 178.128 178.057 0.071 1
1 1011 . 15 1 1 A 99 99 LEU CA C 99 57.129 57.953 -0.824 1
1 1012 . 15 1 1 A 99 99 LEU CB C 99 41.108 41.674 -0.566 1
1 1014 . 15 1 1 A 99 99 LEU N N 99 116.844 123.724 -6.880 1
1 1015 . 15 1 1 A 100 100 TYR H H 100 7.890 7.915 -0.025 1
1 1016 . 15 1 1 A 100 100 TYR HA H 100 4.550 4.148 0.402 1
1 1021 . 15 1 1 A 100 100 TYR C C 100 178.210 177.418 0.792 1
1 1022 . 15 1 1 A 100 100 TYR CA C 100 59.452 59.985 -0.533 1
1 1023 . 15 1 1 A 100 100 TYR CB C 100 38.786 39.303 -0.517 1
1 1024 . 15 1 1 A 100 100 TYR N N 100 116.427 120.009 -3.582 1
1 1025 . 15 1 1 A 101 101 LEU H H 101 8.041 7.683 0.358 1
1 1026 . 15 1 1 A 101 101 LEU HA H 101 4.158 4.132 0.026 1
1 1036 . 15 1 1 A 101 101 LEU C C 101 176.808 177.222 -0.414 1
1 1037 . 15 1 1 A 101 101 LEU CA C 101 56.156 58.064 -1.908 1
1 1038 . 15 1 1 A 101 101 LEU CB C 101 44.307 42.528 1.779 1
1 1041 . 15 1 1 A 101 101 LEU N N 101 116.493 120.119 -3.626 1
1 1042 . 15 1 1 A 102 102 ASN H H 102 7.146 7.882 -0.736 1
1 1043 . 15 1 1 A 102 102 ASN HA H 102 5.056 4.968 0.088 1
1 1046 . 15 1 1 A 102 102 ASN CA C 102 52.704 54.316 -1.612 1
1 1047 . 15 1 1 A 102 102 ASN CB C 102 42.424 41.180 1.244 1
1 1048 . 15 1 1 A 102 102 ASN N N 102 114.922 114.201 0.721 1
1 1049 . 15 1 1 A 103 103 GLN H H 103 8.477 7.377 1.100 1
1 1050 . 15 1 1 A 103 103 GLN HA H 103 3.866 3.901 -0.035 1
1 1054 . 15 1 1 A 103 103 GLN C C 103 176.110 176.375 -0.265 1
1 1055 . 15 1 1 A 103 103 GLN CA C 103 58.451 56.990 1.461 1
1 1056 . 15 1 1 A 103 103 GLN CB C 103 28.896 29.012 -0.116 1
1 1058 . 15 1 1 A 103 103 GLN N N 103 120.252 116.845 3.407 1
1 1059 . 15 1 1 A 104 104 GLU H H 104 7.930 8.100 -0.170 1
1 1060 . 15 1 1 A 104 104 GLU HA H 104 4.591 4.163 0.428 1
1 1064 . 15 1 1 A 104 104 GLU C C 104 175.397 175.654 -0.257 1
1 1065 . 15 1 1 A 104 104 GLU CA C 104 54.058 58.467 -4.409 1
1 1066 . 15 1 1 A 104 104 GLU CB C 104 31.272 29.198 2.074 1
1 1068 . 15 1 1 A 104 104 GLU N N 104 117.295 119.882 -2.587 1
1 1069 . 15 1 1 A 105 105 VAL H H 105 8.546 8.110 0.436 1
1 1070 . 15 1 1 A 105 105 VAL HA H 105 3.823 4.578 -0.755 1
1 1078 . 15 1 1 A 105 105 VAL CA C 105 60.706 58.646 2.060 1
1 1079 . 15 1 1 A 105 105 VAL CB C 105 32.126 33.349 -1.223 1
1 1082 . 15 1 1 A 105 105 VAL N N 105 124.511 122.949 1.562 1
1 1083 . 15 1 1 A 106 106 PRO HA H 106 3.997 4.834 -0.837 1
1 1089 . 15 1 1 A 106 106 PRO C C 106 178.240 177.163 1.077 1
1 1090 . 15 1 1 A 106 106 PRO CA C 106 62.961 61.841 1.120 1
1 1091 . 15 1 1 A 106 106 PRO CB C 106 32.321 32.797 -0.476 1
1 1094 . 15 1 1 A 107 107 LYS H H 107 9.122 9.041 0.081 1
1 1095 . 15 1 1 A 107 107 LYS HA H 107 3.813 3.977 -0.164 1
1 1101 . 15 1 1 A 107 107 LYS C C 107 178.563 178.442 0.121 1
1 1102 . 15 1 1 A 107 107 LYS CA C 107 60.085 59.624 0.461 1
1 1103 . 15 1 1 A 107 107 LYS CB C 107 31.632 32.194 -0.562 1
1 1106 . 15 1 1 A 107 107 LYS N N 107 129.017 122.812 6.205 1
1 1107 . 15 1 1 A 108 108 GLU H H 108 10.370 8.386 1.984 1
1 1108 . 15 1 1 A 108 108 GLU HA H 108 3.991 4.075 -0.084 1
1 1111 . 15 1 1 A 108 108 GLU C C 108 180.366 179.439 0.927 1
1 1112 . 15 1 1 A 108 108 GLU CA C 108 60.337 59.196 1.141 1
1 1113 . 15 1 1 A 108 108 GLU CB C 108 29.178 29.229 -0.051 1
1 1115 . 15 1 1 A 108 108 GLU N N 108 118.335 119.091 -0.756 1
1 1116 . 15 1 1 A 109 109 LEU H H 109 7.393 8.191 -0.798 1
1 1117 . 15 1 1 A 109 109 LEU HA H 109 4.220 4.078 0.142 1
1 1126 . 15 1 1 A 109 109 LEU C C 109 177.378 179.862 -2.484 1
1 1127 . 15 1 1 A 109 109 LEU CA C 109 56.618 58.055 -1.437 1
1 1128 . 15 1 1 A 109 109 LEU CB C 109 41.898 41.536 0.362 1
1 1131 . 15 1 1 A 109 109 LEU N N 109 118.285 120.648 -2.363 1
1 1132 . 15 1 1 A 110 110 LEU H H 110 7.641 8.164 -0.523 1
1 1133 . 15 1 1 A 110 110 LEU HA H 110 3.796 3.972 -0.176 1
1 1142 . 15 1 1 A 110 110 LEU C C 110 179.103 178.479 0.624 1
1 1143 . 15 1 1 A 110 110 LEU CA C 110 59.046 57.983 1.063 1
1 1144 . 15 1 1 A 110 110 LEU CB C 110 40.228 40.916 -0.688 1
1 1147 . 15 1 1 A 110 110 LEU N N 110 120.162 119.547 0.615 1
1 1148 . 15 1 1 A 111 111 GLU H H 111 7.916 8.251 -0.335 1
1 1149 . 15 1 1 A 111 111 GLU HA H 111 4.080 4.111 -0.031 1
1 1153 . 15 1 1 A 111 111 GLU C C 111 179.967 178.827 1.140 1
1 1154 . 15 1 1 A 111 111 GLU CA C 111 59.243 58.962 0.281 1
1 1155 . 15 1 1 A 111 111 GLU CB C 111 29.576 29.434 0.142 1
1 1157 . 15 1 1 A 111 111 GLU N N 111 117.360 119.993 -2.633 1
1 1158 . 15 1 1 A 112 112 PHE H H 112 7.712 7.950 -0.238 1
1 1159 . 15 1 1 A 112 112 PHE HA H 112 4.224 4.182 0.042 1
1 1164 . 15 1 1 A 112 112 PHE C C 112 177.180 177.091 0.089 1
1 1165 . 15 1 1 A 112 112 PHE CA C 112 61.407 61.118 0.289 1
1 1166 . 15 1 1 A 112 112 PHE CB C 112 40.172 39.319 0.853 1
1 1167 . 15 1 1 A 112 112 PHE N N 112 123.042 121.033 2.009 1
1 1168 . 15 1 1 A 113 113 LEU H H 113 8.056 8.175 -0.119 1
1 1169 . 15 1 1 A 113 113 LEU HA H 113 4.147 4.401 -0.254 1
1 1175 . 15 1 1 A 113 113 LEU C C 113 173.717 176.214 -2.497 1
1 1176 . 15 1 1 A 113 113 LEU CA C 113 54.093 54.644 -0.551 1
1 1177 . 15 1 1 A 113 113 LEU CB C 113 41.517 42.261 -0.744 1
1 1179 . 15 1 1 A 113 113 LEU N N 113 115.595 117.402 -1.807 1
1 1180 . 15 1 1 A 114 114 ARG H H 114 7.902 7.932 -0.030 1
1 1181 . 15 1 1 A 114 114 ARG HA H 114 3.817 4.292 -0.475 1
1 1182 . 15 1 1 A 114 114 ARG C C 114 174.566 175.096 -0.530 1
1 1183 . 15 1 1 A 114 114 ARG CA C 114 57.233 57.098 0.135 1
1 1184 . 15 1 1 A 114 114 ARG CB C 114 27.788 27.466 0.322 1
1 1185 . 15 1 1 A 114 114 ARG N N 114 116.021 117.086 -1.065 1
1 1186 . 15 1 1 A 115 115 LEU H H 115 8.160 8.241 -0.081 1
1 1187 . 15 1 1 A 115 115 LEU HA H 115 4.462 4.690 -0.228 1
1 1195 . 15 1 1 A 115 115 LEU C C 115 176.374 176.066 0.308 1
1 1196 . 15 1 1 A 115 115 LEU CA C 115 53.965 54.259 -0.294 1
1 1197 . 15 1 1 A 115 115 LEU CB C 115 44.077 42.142 1.935 1
1 1199 . 15 1 1 A 115 115 LEU N N 115 118.089 120.222 -2.133 1
1 1200 . 15 1 1 A 116 116 ARG H H 116 8.066 8.789 -0.723 1
1 1201 . 15 1 1 A 116 116 ARG HA H 116 4.172 5.098 -0.926 1
1 1203 . 15 1 1 A 116 116 ARG CA C 116 55.961 54.535 1.426 1
1 1204 . 15 1 1 A 116 116 ARG CB C 116 31.379 32.799 -1.420 1
1 1205 . 15 1 1 A 116 116 ARG N N 116 120.852 122.344 -1.492 1
1 1206 . 15 1 1 A 117 117 HIS H H 117 7.928 9.024 -1.096 1
1 1207 . 15 1 1 A 117 117 HIS HA H 117 4.557 4.154 0.403 1
1 1211 . 15 1 1 A 117 117 HIS CA C 117 55.937 56.784 -0.847 1
1 1212 . 15 1 1 A 117 117 HIS CB C 117 30.875 28.104 2.771 1
1 1213 . 15 1 1 A 118 118 PHE H H 118 8.183 8.360 -0.177 1
1 1214 . 15 1 1 A 118 118 PHE HA H 118 4.730 4.753 -0.023 1
1 1219 . 15 1 1 A 118 118 PHE CA C 118 55.716 54.700 1.016 1
1 1220 . 15 1 1 A 118 118 PHE CB C 118 39.263 39.701 -0.438 1
1 1221 . 15 1 1 A 118 118 PHE N N 118 123.480 124.136 -0.656 1
1 1222 . 15 1 1 A 119 119 PRO HA H 119 4.398 4.595 -0.197 1
1 1227 . 15 1 1 A 119 119 PRO C C 119 176.666 176.069 0.597 1
1 1228 . 15 1 1 A 119 119 PRO CA C 119 63.377 62.197 1.180 1
1 1229 . 15 1 1 A 119 119 PRO CB C 119 32.059 32.893 -0.834 1
1 1232 . 15 1 1 A 120 120 THR H H 120 8.054 8.445 -0.391 1
1 1233 . 15 1 1 A 120 120 THR HA H 120 4.273 5.141 -0.868 1
1 1238 . 15 1 1 A 120 120 THR C C 120 174.154 174.202 -0.048 1
1 1239 . 15 1 1 A 120 120 THR CA C 120 61.893 61.814 0.079 1
1 1240 . 15 1 1 A 120 120 THR CB C 120 69.736 69.099 0.637 1
1 1242 . 15 1 1 A 120 120 THR N N 120 113.088 115.987 -2.899 1
1 1243 . 15 1 1 A 121 121 ASP H H 121 8.209 8.681 -0.472 1
1 1244 . 15 1 1 A 121 121 ASP HA H 121 4.876 4.828 0.048 1
1 1247 . 15 1 1 A 121 121 ASP CA C 121 52.126 52.977 -0.851 1
1 1248 . 15 1 1 A 121 121 ASP CB C 121 41.553 39.867 1.686 1
1 1249 . 15 1 1 A 121 121 ASP N N 121 123.630 129.044 -5.414 1
1 1250 . 15 1 1 A 122 122 PRO HA H 122 4.363 4.576 -0.213 1
1 1255 . 15 1 1 A 122 122 PRO C C 122 177.344 175.831 1.513 1
1 1256 . 15 1 1 A 122 122 PRO CA C 122 63.913 62.595 1.318 1
1 1257 . 15 1 1 A 122 122 PRO CB C 122 32.116 31.944 0.172 1
1 1260 . 15 1 1 A 123 123 LYS H H 123 8.344 8.399 -0.055 1
1 1261 . 15 1 1 A 123 123 LYS HA H 123 4.244 4.632 -0.388 1
1 1266 . 15 1 1 A 123 123 LYS C C 123 176.637 175.241 1.396 1
1 1267 . 15 1 1 A 123 123 LYS CA C 123 56.359 55.757 0.602 1
1 1268 . 15 1 1 A 123 123 LYS CB C 123 32.367 32.933 -0.566 1
1 1272 . 15 1 1 A 123 123 LYS N N 123 119.110 121.823 -2.713 1
1 1273 . 15 1 1 A 124 124 ALA H H 124 7.929 8.632 -0.703 1
1 1274 . 15 1 1 A 124 124 ALA HA H 124 4.248 4.794 -0.546 1
1 1278 . 15 1 1 A 124 124 ALA C C 124 177.648 176.894 0.754 1
1 1279 . 15 1 1 A 124 124 ALA CA C 124 52.618 51.292 1.326 1
1 1280 . 15 1 1 A 124 124 ALA CB C 124 19.379 20.230 -0.851 1
1 1281 . 15 1 1 A 124 124 ALA N N 124 123.825 130.448 -6.623 1
1 1282 . 15 1 1 A 125 125 SER H H 125 8.134 8.996 -0.862 1
1 1283 . 15 1 1 A 125 125 SER HA H 125 4.341 4.849 -0.508 1
1 1286 . 15 1 1 A 125 125 SER C C 125 174.172 173.907 0.265 1
1 1287 . 15 1 1 A 125 125 SER CA C 125 58.391 57.896 0.495 1
1 1288 . 15 1 1 A 125 125 SER CB C 125 63.748 65.037 -1.289 1
1 1289 . 15 1 1 A 125 125 SER N N 125 114.454 120.349 -5.895 1
1 1290 . 15 1 1 A 126 126 ASN H H 126 8.242 7.987 0.255 1
1 1291 . 15 1 1 A 126 126 ASN HA H 126 4.657 4.827 -0.170 1
1 1294 . 15 1 1 A 126 126 ASN C C 126 174.624 175.432 -0.808 1
1 1295 . 15 1 1 A 126 126 ASN CA C 126 53.292 52.075 1.217 1
1 1296 . 15 1 1 A 126 126 ASN CB C 126 38.797 38.430 0.367 1
1 1297 . 15 1 1 A 126 126 ASN N N 126 120.102 121.708 -1.606 1
1 1298 . 15 1 1 A 127 127 TRP H H 127 8.051 9.052 -1.001 1
1 1299 . 15 1 1 A 127 127 TRP HA H 127 4.694 4.625 0.069 1
1 1302 . 15 1 1 A 127 127 TRP C C 127 175.479 176.359 -0.880 1
1 1303 . 15 1 1 A 127 127 TRP CA C 127 57.096 59.150 -2.054 1
1 1304 . 15 1 1 A 127 127 TRP CB C 127 29.820 31.309 -1.489 1
1 1305 . 15 1 1 A 127 127 TRP N N 127 121.198 128.179 -6.981 1
1 1 . 16 1 1 A 7 7 HIS HA H 7 4.623 4.879 -0.256 1
1 4 . 16 1 1 A 7 7 HIS C C 7 174.747 173.487 1.260 1
1 5 . 16 1 1 A 7 7 HIS CA C 7 56.189 53.917 2.272 1
1 6 . 16 1 1 A 7 7 HIS CB C 7 30.028 30.873 -0.845 1
1 7 . 16 1 1 A 8 8 LEU H H 8 8.283 8.655 -0.372 1
1 8 . 16 1 1 A 8 8 LEU HA H 8 4.249 4.535 -0.286 1
1 10 . 16 1 1 A 8 8 LEU C C 8 176.700 177.083 -0.383 1
1 11 . 16 1 1 A 8 8 LEU CA C 8 55.498 53.595 1.903 1
1 12 . 16 1 1 A 8 8 LEU CB C 8 42.568 43.212 -0.644 1
1 13 . 16 1 1 A 8 8 LEU N N 8 122.916 124.523 -1.607 1
1 14 . 16 1 1 A 9 9 GLU H H 9 8.623 9.042 -0.419 1
1 15 . 16 1 1 A 9 9 GLU HA H 9 4.311 3.894 0.417 1
1 16 . 16 1 1 A 9 9 GLU C C 9 174.811 175.213 -0.402 1
1 17 . 16 1 1 A 9 9 GLU CA C 9 56.377 57.282 -0.905 1
1 18 . 16 1 1 A 9 9 GLU CB C 9 29.557 28.147 1.410 1
1 20 . 16 1 1 A 9 9 GLU N N 9 121.512 123.446 -1.934 1
1 21 . 16 1 1 A 10 10 LEU H H 10 7.853 8.061 -0.208 1
1 22 . 16 1 1 A 10 10 LEU HA H 10 5.225 5.124 0.101 1
1 31 . 16 1 1 A 10 10 LEU C C 10 174.637 175.808 -1.171 1
1 32 . 16 1 1 A 10 10 LEU CA C 10 54.513 53.556 0.957 1
1 33 . 16 1 1 A 10 10 LEU CB C 10 45.187 45.367 -0.180 1
1 36 . 16 1 1 A 10 10 LEU N N 10 123.592 123.674 -0.082 1
1 37 . 16 1 1 A 11 11 GLU H H 11 8.894 8.640 0.254 1
1 38 . 16 1 1 A 11 11 GLU HA H 11 4.765 5.157 -0.392 1
1 43 . 16 1 1 A 11 11 GLU C C 11 174.563 175.192 -0.629 1
1 44 . 16 1 1 A 11 11 GLU CA C 11 55.047 54.943 0.104 1
1 45 . 16 1 1 A 11 11 GLU CB C 11 33.760 32.548 1.212 1
1 47 . 16 1 1 A 11 11 GLU N N 11 124.055 123.053 1.002 1
1 48 . 16 1 1 A 12 12 VAL H H 12 8.607 8.948 -0.341 1
1 49 . 16 1 1 A 12 12 VAL HA H 12 5.174 5.507 -0.333 1
1 57 . 16 1 1 A 12 12 VAL C C 12 173.573 175.218 -1.645 1
1 58 . 16 1 1 A 12 12 VAL CA C 12 60.296 61.120 -0.824 1
1 59 . 16 1 1 A 12 12 VAL CB C 12 35.689 34.368 1.321 1
1 62 . 16 1 1 A 12 12 VAL N N 12 120.878 124.397 -3.519 1
1 63 . 16 1 1 A 13 13 HIS H H 13 8.982 9.112 -0.130 1
1 64 . 16 1 1 A 13 13 HIS HA H 13 4.824 5.415 -0.591 1
1 69 . 16 1 1 A 13 13 HIS C C 13 173.236 171.774 1.462 1
1 70 . 16 1 1 A 13 13 HIS CA C 13 54.906 53.938 0.968 1
1 71 . 16 1 1 A 13 13 HIS CB C 13 33.496 32.718 0.778 1
1 72 . 16 1 1 A 13 13 HIS N N 13 121.504 122.045 -0.541 1
1 73 . 16 1 1 A 14 14 ILE H H 14 10.442 9.082 1.360 1
1 74 . 16 1 1 A 14 14 ILE HA H 14 5.458 4.540 0.918 1
1 84 . 16 1 1 A 14 14 ILE CA C 14 58.386 57.844 0.542 1
1 85 . 16 1 1 A 14 14 ILE CB C 14 38.596 38.234 0.362 1
1 88 . 16 1 1 A 14 14 ILE N N 14 119.923 121.073 -1.150 1
1 89 . 16 1 1 A 15 15 PRO HA H 15 4.560 4.365 0.195 1
1 95 . 16 1 1 A 15 15 PRO C C 15 176.907 176.346 0.561 1
1 96 . 16 1 1 A 15 15 PRO CA C 15 64.342 64.266 0.076 1
1 97 . 16 1 1 A 15 15 PRO CB C 15 32.924 32.111 0.813 1
1 100 . 16 1 1 A 16 16 SER H H 16 7.331 7.728 -0.397 1
1 101 . 16 1 1 A 16 16 SER HA H 16 4.822 5.039 -0.217 1
1 104 . 16 1 1 A 16 16 SER C C 16 171.253 172.692 -1.439 1
1 105 . 16 1 1 A 16 16 SER CA C 16 57.135 57.769 -0.634 1
1 106 . 16 1 1 A 16 16 SER CB C 16 65.947 67.224 -1.277 1
1 107 . 16 1 1 A 16 16 SER N N 16 107.745 113.995 -6.250 1
1 108 . 16 1 1 A 17 17 VAL H H 17 8.350 8.548 -0.198 1
1 109 . 16 1 1 A 17 17 VAL HA H 17 4.926 4.973 -0.047 1
1 117 . 16 1 1 A 17 17 VAL C C 17 173.692 175.010 -1.318 1
1 118 . 16 1 1 A 17 17 VAL CA C 17 58.721 60.401 -1.680 1
1 119 . 16 1 1 A 17 17 VAL CB C 17 34.420 36.289 -1.869 1
1 122 . 16 1 1 A 17 17 VAL N N 17 118.680 122.866 -4.186 1
1 123 . 16 1 1 A 18 18 GLY H H 18 8.332 8.689 -0.357 1
1 124 . 16 1 1 A 18 18 GLY HA2 H 18 4.189 4.230 -0.041 1
1 125 . 16 1 1 A 18 18 GLY HA3 H 18 4.011 4.242 -0.231 1
1 126 . 16 1 1 A 18 18 GLY CA C 18 45.356 45.070 0.286 1
1 127 . 16 1 1 A 18 18 GLY N N 18 112.549 112.571 -0.022 1
1 128 . 16 1 1 A 19 19 PRO HA H 19 4.757 4.884 -0.127 1
1 134 . 16 1 1 A 19 19 PRO C C 19 177.482 177.016 0.466 1
1 135 . 16 1 1 A 19 19 PRO CA C 19 62.848 62.948 -0.100 1
1 136 . 16 1 1 A 19 19 PRO CB C 19 32.283 29.802 2.481 1
1 139 . 16 1 1 A 20 20 GLU H H 20 8.588 8.287 0.301 1
1 140 . 16 1 1 A 20 20 GLU HA H 20 4.147 4.568 -0.421 1
1 144 . 16 1 1 A 20 20 GLU C C 20 175.857 176.756 -0.899 1
1 145 . 16 1 1 A 20 20 GLU CA C 20 57.150 56.928 0.222 1
1 146 . 16 1 1 A 20 20 GLU CB C 20 30.923 29.766 1.157 1
1 148 . 16 1 1 A 20 20 GLU N N 20 122.087 120.908 1.179 1
1 149 . 16 1 1 A 21 21 ALA H H 21 8.352 7.320 1.032 1
1 150 . 16 1 1 A 21 21 ALA HA H 21 4.391 4.421 -0.030 1
1 154 . 16 1 1 A 21 21 ALA C C 21 174.910 177.075 -2.165 1
1 155 . 16 1 1 A 21 21 ALA CA C 21 52.166 50.852 1.314 1
1 156 . 16 1 1 A 21 21 ALA CB C 21 19.915 20.336 -0.421 1
1 157 . 16 1 1 A 21 21 ALA N N 21 124.593 122.309 2.284 1
1 158 . 16 1 1 A 22 22 GLU H H 22 8.398 8.406 -0.008 1
1 159 . 16 1 1 A 22 22 GLU HA H 22 4.331 4.524 -0.193 1
1 163 . 16 1 1 A 22 22 GLU C C 22 176.389 176.237 0.152 1
1 164 . 16 1 1 A 22 22 GLU CA C 22 56.316 54.853 1.463 1
1 165 . 16 1 1 A 22 22 GLU CB C 22 30.713 30.192 0.521 1
1 167 . 16 1 1 A 22 22 GLU N N 22 120.159 121.568 -1.409 1
1 168 . 16 1 1 A 23 23 GLY H H 23 8.246 8.656 -0.410 1
1 169 . 16 1 1 A 23 23 GLY HA2 H 23 4.162 3.553 0.609 1
1 170 . 16 1 1 A 23 23 GLY HA3 H 23 4.061 3.893 0.168 1
1 171 . 16 1 1 A 23 23 GLY CA C 23 44.801 45.525 -0.724 1
1 172 . 16 1 1 A 23 23 GLY N N 23 110.080 109.177 0.903 1
1 173 . 16 1 1 A 24 24 PRO HA H 24 4.417 4.510 -0.093 1
1 178 . 16 1 1 A 24 24 PRO C C 24 177.135 176.190 0.945 1
1 179 . 16 1 1 A 24 24 PRO CA C 24 63.520 62.288 1.232 1
1 180 . 16 1 1 A 24 24 PRO CB C 24 32.124 32.888 -0.764 1
1 183 . 16 1 1 A 25 25 ARG H H 25 8.409 8.387 0.022 1
1 184 . 16 1 1 A 25 25 ARG HA H 25 4.298 4.264 0.034 1
1 187 . 16 1 1 A 25 25 ARG C C 25 176.217 175.947 0.270 1
1 188 . 16 1 1 A 25 25 ARG CA C 25 56.237 55.701 0.536 1
1 189 . 16 1 1 A 25 25 ARG CB C 25 30.467 31.009 -0.542 1
1 192 . 16 1 1 A 25 25 ARG N N 25 120.147 121.404 -1.257 1
1 193 . 16 1 1 A 26 26 GLN H H 26 8.278 8.126 0.152 1
1 194 . 16 1 1 A 26 26 GLN HA H 26 4.336 4.253 0.083 1
1 200 . 16 1 1 A 26 26 GLN C C 26 175.566 174.819 0.747 1
1 201 . 16 1 1 A 26 26 GLN CA C 26 55.788 56.624 -0.836 1
1 202 . 16 1 1 A 26 26 GLN CB C 26 29.714 29.027 0.687 1
1 204 . 16 1 1 A 26 26 GLN N N 26 120.460 125.736 -5.276 1
1 206 . 16 1 1 A 27 27 SER H H 27 8.298 8.518 -0.220 1
1 208 . 16 1 1 A 27 27 SER CA C 27 56.156 55.216 0.940 1
1 209 . 16 1 1 A 27 27 SER CB C 27 63.813 64.968 -1.155 1
1 210 . 16 1 1 A 27 27 SER N N 27 117.382 124.052 -6.670 1
1 211 . 16 1 1 A 28 28 PRO HA H 28 4.366 4.330 0.036 1
1 216 . 16 1 1 A 28 28 PRO C C 28 177.555 178.766 -1.211 1
1 217 . 16 1 1 A 28 28 PRO CA C 28 64.486 65.234 -0.748 1
1 218 . 16 1 1 A 28 28 PRO CB C 28 31.892 32.016 -0.124 1
1 221 . 16 1 1 A 29 29 GLU H H 29 8.582 8.125 0.457 1
1 222 . 16 1 1 A 29 29 GLU HA H 29 4.218 4.254 -0.036 1
1 226 . 16 1 1 A 29 29 GLU CA C 29 57.261 59.547 -2.286 1
1 227 . 16 1 1 A 29 29 GLU CB C 29 29.633 30.309 -0.676 1
1 229 . 16 1 1 A 29 29 GLU N N 29 118.309 115.491 2.818 1
1 230 . 16 1 1 A 30 30 LYS H H 30 7.955 7.947 0.008 1
1 231 . 16 1 1 A 30 30 LYS HA H 30 4.328 4.315 0.013 1
1 236 . 16 1 1 A 30 30 LYS C C 30 176.222 174.604 1.618 1
1 237 . 16 1 1 A 30 30 LYS CA C 30 56.247 57.358 -1.111 1
1 238 . 16 1 1 A 30 30 LYS CB C 30 32.720 31.516 1.204 1
1 242 . 16 1 1 A 30 30 LYS N N 30 120.129 117.655 2.474 1
1 243 . 16 1 1 A 31 31 SER H H 31 7.883 8.050 -0.167 1
1 244 . 16 1 1 A 31 31 SER HA H 31 4.458 4.729 -0.271 1
1 246 . 16 1 1 A 31 31 SER C C 31 174.129 172.943 1.186 1
1 247 . 16 1 1 A 31 31 SER CA C 31 58.477 56.639 1.838 1
1 248 . 16 1 1 A 31 31 SER CB C 31 64.042 64.783 -0.741 1
1 249 . 16 1 1 A 31 31 SER N N 31 115.366 118.658 -3.292 1
1 250 . 16 1 1 A 32 32 HIS H H 32 8.485 8.830 -0.345 1
1 251 . 16 1 1 A 32 32 HIS HA H 32 4.450 4.704 -0.254 1
1 255 . 16 1 1 A 32 32 HIS CA C 32 56.009 56.550 -0.541 1
1 256 . 16 1 1 A 32 32 HIS CB C 32 31.122 30.128 0.994 1
1 257 . 16 1 1 A 32 32 HIS N N 32 121.500 124.676 -3.176 1
1 258 . 16 1 1 A 33 33 MET H H 33 8.392 7.532 0.860 1
1 259 . 16 1 1 A 33 33 MET HA H 33 4.601 4.875 -0.274 1
1 265 . 16 1 1 A 33 33 MET C C 33 175.842 175.345 0.497 1
1 266 . 16 1 1 A 33 33 MET CA C 33 54.533 54.308 0.225 1
1 267 . 16 1 1 A 33 33 MET CB C 33 32.868 34.721 -1.853 1
1 270 . 16 1 1 A 33 33 MET N N 33 120.204 119.758 0.446 1
1 271 . 16 1 1 A 34 34 VAL H H 34 8.938 8.975 -0.037 1
1 272 . 16 1 1 A 34 34 VAL HA H 34 4.430 4.743 -0.313 1
1 280 . 16 1 1 A 34 34 VAL C C 34 174.149 174.040 0.109 1
1 281 . 16 1 1 A 34 34 VAL CA C 34 60.703 59.942 0.761 1
1 282 . 16 1 1 A 34 34 VAL CB C 34 34.319 34.713 -0.394 1
1 285 . 16 1 1 A 34 34 VAL N N 34 118.512 125.344 -6.832 1
1 286 . 16 1 1 A 35 35 PHE H H 35 9.242 8.160 1.082 1
1 287 . 16 1 1 A 35 35 PHE HA H 35 4.439 5.712 -1.273 1
1 294 . 16 1 1 A 35 35 PHE C C 35 174.831 173.668 1.163 1
1 295 . 16 1 1 A 35 35 PHE CA C 35 57.754 54.951 2.803 1
1 296 . 16 1 1 A 35 35 PHE CB C 35 38.959 42.334 -3.375 1
1 297 . 16 1 1 A 35 35 PHE N N 35 124.912 125.187 -0.275 1
1 298 . 16 1 1 A 36 36 ARG H H 36 8.475 9.260 -0.785 1
1 299 . 16 1 1 A 36 36 ARG HA H 36 4.135 4.689 -0.554 1
1 304 . 16 1 1 A 36 36 ARG C C 36 172.865 175.850 -2.985 1
1 305 . 16 1 1 A 36 36 ARG CA C 36 56.895 55.849 1.046 1
1 306 . 16 1 1 A 36 36 ARG CB C 36 28.962 30.844 -1.882 1
1 308 . 16 1 1 A 36 36 ARG N N 36 125.680 120.847 4.833 1
1 309 . 16 1 1 A 37 37 VAL H H 37 8.066 9.318 -1.252 1
1 310 . 16 1 1 A 37 37 VAL HA H 37 4.292 4.934 -0.642 1
1 318 . 16 1 1 A 37 37 VAL C C 37 174.595 174.628 -0.033 1
1 319 . 16 1 1 A 37 37 VAL CA C 37 62.727 60.247 2.480 1
1 320 . 16 1 1 A 37 37 VAL CB C 37 31.102 33.749 -2.647 1
1 323 . 16 1 1 A 37 37 VAL N N 37 125.403 119.786 5.617 1
1 324 . 16 1 1 A 38 38 GLU H H 38 9.532 9.140 0.392 1
1 325 . 16 1 1 A 38 38 GLU HA H 38 4.895 5.172 -0.277 1
1 329 . 16 1 1 A 38 38 GLU C C 38 174.509 175.683 -1.174 1
1 330 . 16 1 1 A 38 38 GLU CA C 38 55.650 55.144 0.506 1
1 331 . 16 1 1 A 38 38 GLU CB C 38 32.214 31.301 0.913 1
1 333 . 16 1 1 A 38 38 GLU N N 38 129.885 123.261 6.624 1
1 334 . 16 1 1 A 39 39 VAL H H 39 9.035 8.780 0.255 1
1 335 . 16 1 1 A 39 39 VAL HA H 39 4.446 4.526 -0.080 1
1 343 . 16 1 1 A 39 39 VAL C C 39 173.661 173.928 -0.267 1
1 344 . 16 1 1 A 39 39 VAL CA C 39 61.258 61.335 -0.077 1
1 345 . 16 1 1 A 39 39 VAL CB C 39 33.533 32.450 1.083 1
1 348 . 16 1 1 A 39 39 VAL N N 39 127.941 126.064 1.877 1
1 349 . 16 1 1 A 40 40 LEU H H 40 8.843 9.257 -0.414 1
1 350 . 16 1 1 A 40 40 LEU HA H 40 5.130 5.069 0.061 1
1 360 . 16 1 1 A 40 40 LEU C C 40 175.581 175.317 0.264 1
1 361 . 16 1 1 A 40 40 LEU CA C 40 53.702 53.807 -0.105 1
1 362 . 16 1 1 A 40 40 LEU CB C 40 43.989 43.614 0.375 1
1 366 . 16 1 1 A 40 40 LEU N N 40 128.413 130.023 -1.610 1
1 367 . 16 1 1 A 41 41 CYS H H 41 8.959 9.294 -0.335 1
1 368 . 16 1 1 A 41 41 CYS HA H 41 5.174 4.847 0.327 1
1 371 . 16 1 1 A 41 41 CYS C C 41 175.043 173.837 1.206 1
1 372 . 16 1 1 A 41 41 CYS CA C 41 57.483 57.547 -0.064 1
1 373 . 16 1 1 A 41 41 CYS CB C 41 28.472 29.460 -0.988 1
1 374 . 16 1 1 A 41 41 CYS N N 41 124.738 126.810 -2.072 1
1 375 . 16 1 1 A 42 42 SER H H 42 9.527 9.532 -0.005 1
1 376 . 16 1 1 A 42 42 SER HA H 42 4.149 4.490 -0.341 1
1 379 . 16 1 1 A 42 42 SER C C 42 175.014 174.516 0.498 1
1 380 . 16 1 1 A 42 42 SER CA C 42 59.058 59.509 -0.451 1
1 381 . 16 1 1 A 42 42 SER CB C 42 62.287 61.860 0.427 1
1 382 . 16 1 1 A 42 42 SER N N 42 125.889 124.115 1.774 1
1 383 . 16 1 1 A 43 43 GLY H H 43 8.685 8.347 0.338 1
1 384 . 16 1 1 A 43 43 GLY HA2 H 43 3.594 4.017 -0.423 1
1 385 . 16 1 1 A 43 43 GLY HA3 H 43 4.210 4.022 0.188 1
1 386 . 16 1 1 A 43 43 GLY C C 43 173.664 173.869 -0.205 1
1 387 . 16 1 1 A 43 43 GLY CA C 43 45.404 45.110 0.294 1
1 388 . 16 1 1 A 43 43 GLY N N 43 104.633 105.929 -1.296 1
1 389 . 16 1 1 A 44 44 ARG H H 44 7.926 7.914 0.012 1
1 390 . 16 1 1 A 44 44 ARG HA H 44 4.678 4.568 0.110 1
1 395 . 16 1 1 A 44 44 ARG C C 44 175.261 176.162 -0.901 1
1 396 . 16 1 1 A 44 44 ARG CA C 44 55.011 55.345 -0.334 1
1 397 . 16 1 1 A 44 44 ARG CB C 44 32.138 31.813 0.325 1
1 400 . 16 1 1 A 44 44 ARG N N 44 121.239 120.559 0.680 1
1 401 . 16 1 1 A 45 45 ARG H H 45 8.775 8.776 -0.001 1
1 402 . 16 1 1 A 45 45 ARG HA H 45 5.770 4.724 1.046 1
1 409 . 16 1 1 A 45 45 ARG C C 45 176.064 176.226 -0.162 1
1 410 . 16 1 1 A 45 45 ARG CA C 45 54.683 56.192 -1.509 1
1 411 . 16 1 1 A 45 45 ARG CB C 45 33.748 32.109 1.639 1
1 414 . 16 1 1 A 45 45 ARG N N 45 125.948 123.385 2.563 1
1 415 . 16 1 1 A 46 46 HIS H H 46 8.912 8.502 0.410 1
1 416 . 16 1 1 A 46 46 HIS HA H 46 4.927 5.776 -0.849 1
1 420 . 16 1 1 A 46 46 HIS C C 46 172.634 172.902 -0.268 1
1 421 . 16 1 1 A 46 46 HIS CA C 46 56.480 54.026 2.454 1
1 422 . 16 1 1 A 46 46 HIS CB C 46 33.608 32.647 0.961 1
1 423 . 16 1 1 A 46 46 HIS N N 46 121.825 117.015 4.810 1
1 424 . 16 1 1 A 47 47 THR H H 47 8.532 8.835 -0.303 1
1 425 . 16 1 1 A 47 47 THR HA H 47 5.472 5.624 -0.152 1
1 430 . 16 1 1 A 47 47 THR C C 47 174.442 173.998 0.444 1
1 431 . 16 1 1 A 47 47 THR CA C 47 61.093 62.323 -1.230 1
1 432 . 16 1 1 A 47 47 THR CB C 47 71.041 69.720 1.321 1
1 434 . 16 1 1 A 47 47 THR N N 47 115.450 120.098 -4.648 1
1 435 . 16 1 1 A 48 48 VAL H H 48 9.695 9.218 0.477 1
1 436 . 16 1 1 A 48 48 VAL HA H 48 4.677 4.589 0.088 1
1 444 . 16 1 1 A 48 48 VAL CA C 48 58.172 58.923 -0.751 1
1 445 . 16 1 1 A 48 48 VAL CB C 48 34.990 35.358 -0.368 1
1 448 . 16 1 1 A 48 48 VAL N N 48 126.721 126.291 0.430 1
1 449 . 16 1 1 A 49 49 PRO HA H 49 5.087 5.028 0.059 1
1 453 . 16 1 1 A 49 49 PRO CA C 49 61.671 62.545 -0.874 1
1 454 . 16 1 1 A 49 49 PRO CB C 49 31.923 31.699 0.224 1
1 457 . 16 1 1 A 50 50 ARG H H 50 9.125 9.052 0.073 1
1 458 . 16 1 1 A 50 50 ARG HA H 50 4.974 4.749 0.225 1
1 464 . 16 1 1 A 50 50 ARG C C 50 176.187 174.262 1.925 1
1 465 . 16 1 1 A 50 50 ARG CA C 50 53.015 54.475 -1.460 1
1 466 . 16 1 1 A 50 50 ARG CB C 50 36.553 34.012 2.541 1
1 468 . 16 1 1 A 50 50 ARG N N 50 124.189 123.860 0.329 1
1 469 . 16 1 1 A 51 51 ARG H H 51 10.105 8.375 1.730 1
1 470 . 16 1 1 A 51 51 ARG HA H 51 5.196 4.057 1.139 1
1 475 . 16 1 1 A 51 51 ARG C C 51 178.865 176.839 2.026 1
1 476 . 16 1 1 A 51 51 ARG CA C 51 55.961 54.775 1.186 1
1 477 . 16 1 1 A 51 51 ARG CB C 51 32.539 30.890 1.649 1
1 480 . 16 1 1 A 51 51 ARG N N 51 124.521 124.300 0.221 1
1 481 . 16 1 1 A 52 52 TYR H H 52 10.397 8.219 2.178 1
1 482 . 16 1 1 A 52 52 TYR HA H 52 4.360 4.610 -0.250 1
1 487 . 16 1 1 A 52 52 TYR C C 52 178.143 177.730 0.413 1
1 488 . 16 1 1 A 52 52 TYR CA C 52 63.538 60.531 3.007 1
1 489 . 16 1 1 A 52 52 TYR CB C 52 38.784 37.899 0.885 1
1 490 . 16 1 1 A 52 52 TYR N N 52 124.772 122.284 2.488 1
1 491 . 16 1 1 A 53 53 SER H H 53 9.231 7.943 1.288 1
1 492 . 16 1 1 A 53 53 SER HA H 53 4.175 4.239 -0.064 1
1 493 . 16 1 1 A 53 53 SER C C 53 177.220 176.433 0.787 1
1 494 . 16 1 1 A 53 53 SER CA C 53 61.606 62.081 -0.475 1
1 495 . 16 1 1 A 53 53 SER N N 53 113.262 117.231 -3.969 1
1 496 . 16 1 1 A 54 54 GLU H H 54 7.807 7.501 0.306 1
1 497 . 16 1 1 A 54 54 GLU HA H 54 4.392 4.033 0.359 1
1 501 . 16 1 1 A 54 54 GLU C C 54 180.361 179.343 1.018 1
1 502 . 16 1 1 A 54 54 GLU CA C 54 59.497 58.879 0.618 1
1 503 . 16 1 1 A 54 54 GLU CB C 54 30.708 29.367 1.341 1
1 504 . 16 1 1 A 54 54 GLU N N 54 121.949 121.835 0.114 1
1 505 . 16 1 1 A 55 55 PHE H H 55 8.133 8.110 0.023 1
1 506 . 16 1 1 A 55 55 PHE HA H 55 4.007 4.247 -0.240 1
1 513 . 16 1 1 A 55 55 PHE C C 55 176.531 178.818 -2.287 1
1 514 . 16 1 1 A 55 55 PHE CA C 55 61.848 60.279 1.569 1
1 515 . 16 1 1 A 55 55 PHE CB C 55 38.847 38.312 0.535 1
1 516 . 16 1 1 A 55 55 PHE N N 55 119.998 119.652 0.346 1
1 517 . 16 1 1 A 56 56 HIS H H 56 7.907 8.646 -0.739 1
1 518 . 16 1 1 A 56 56 HIS HA H 56 3.324 4.270 -0.946 1
1 522 . 16 1 1 A 56 56 HIS C C 56 176.748 177.585 -0.837 1
1 523 . 16 1 1 A 56 56 HIS CA C 56 58.770 60.428 -1.658 1
1 524 . 16 1 1 A 56 56 HIS CB C 56 30.404 29.679 0.725 1
1 525 . 16 1 1 A 56 56 HIS N N 56 119.173 119.325 -0.152 1
1 526 . 16 1 1 A 57 57 ALA H H 57 7.962 7.961 0.001 1
1 527 . 16 1 1 A 57 57 ALA HA H 57 3.865 3.747 0.118 1
1 531 . 16 1 1 A 57 57 ALA C C 57 180.075 179.820 0.255 1
1 532 . 16 1 1 A 57 57 ALA CA C 57 54.996 54.964 0.032 1
1 533 . 16 1 1 A 57 57 ALA CB C 57 18.226 17.896 0.330 1
1 534 . 16 1 1 A 57 57 ALA N N 57 120.094 121.176 -1.082 1
1 535 . 16 1 1 A 58 58 LEU H H 58 7.295 8.686 -1.391 1
1 536 . 16 1 1 A 58 58 LEU HA H 58 3.994 3.993 0.001 1
1 546 . 16 1 1 A 58 58 LEU C C 58 177.428 178.561 -1.133 1
1 547 . 16 1 1 A 58 58 LEU CA C 58 58.342 57.934 0.408 1
1 548 . 16 1 1 A 58 58 LEU CB C 58 40.851 41.655 -0.804 1
1 552 . 16 1 1 A 58 58 LEU N N 58 119.404 120.314 -0.910 1
1 553 . 16 1 1 A 59 59 HIS H H 59 7.805 8.453 -0.648 1
1 554 . 16 1 1 A 59 59 HIS HA H 59 4.286 4.124 0.162 1
1 558 . 16 1 1 A 59 59 HIS C C 59 177.001 177.365 -0.364 1
1 559 . 16 1 1 A 59 59 HIS CA C 59 60.141 59.849 0.292 1
1 560 . 16 1 1 A 59 59 HIS CB C 59 31.072 29.906 1.166 1
1 561 . 16 1 1 A 59 59 HIS N N 59 119.040 118.197 0.843 1
1 562 . 16 1 1 A 60 60 LYS H H 60 7.715 8.075 -0.360 1
1 563 . 16 1 1 A 60 60 LYS HA H 60 3.456 3.996 -0.540 1
1 570 . 16 1 1 A 60 60 LYS C C 60 178.464 178.657 -0.193 1
1 571 . 16 1 1 A 60 60 LYS CA C 60 59.629 58.895 0.734 1
1 572 . 16 1 1 A 60 60 LYS CB C 60 32.354 31.475 0.879 1
1 576 . 16 1 1 A 60 60 LYS N N 60 114.225 118.162 -3.937 1
1 577 . 16 1 1 A 61 61 ARG H H 61 7.486 7.691 -0.205 1
1 578 . 16 1 1 A 61 61 ARG HA H 61 4.202 4.036 0.166 1
1 584 . 16 1 1 A 61 61 ARG C C 61 178.995 178.866 0.129 1
1 585 . 16 1 1 A 61 61 ARG CA C 61 58.387 58.803 -0.416 1
1 586 . 16 1 1 A 61 61 ARG CB C 61 31.216 30.084 1.132 1
1 589 . 16 1 1 A 61 61 ARG N N 61 115.929 119.252 -3.323 1
1 590 . 16 1 1 A 62 62 ILE H H 62 8.066 7.609 0.457 1
1 591 . 16 1 1 A 62 62 ILE HA H 62 4.491 3.971 0.520 1
1 601 . 16 1 1 A 62 62 ILE C C 62 177.838 177.109 0.729 1
1 602 . 16 1 1 A 62 62 ILE CA C 62 63.399 63.400 -0.001 1
1 603 . 16 1 1 A 62 62 ILE CB C 62 39.699 37.528 2.171 1
1 606 . 16 1 1 A 62 62 ILE N N 62 111.456 118.152 -6.696 1
1 607 . 16 1 1 A 63 63 LYS H H 63 8.158 8.492 -0.334 1
1 608 . 16 1 1 A 63 63 LYS HA H 63 4.136 3.884 0.252 1
1 615 . 16 1 1 A 63 63 LYS C C 63 176.358 178.137 -1.779 1
1 616 . 16 1 1 A 63 63 LYS CA C 63 58.753 58.355 0.398 1
1 617 . 16 1 1 A 63 63 LYS CB C 63 30.825 31.247 -0.422 1
1 621 . 16 1 1 A 63 63 LYS N N 63 120.800 123.847 -3.047 1
1 622 . 16 1 1 A 64 64 LYS H H 64 7.687 7.672 0.015 1
1 623 . 16 1 1 A 64 64 LYS HA H 64 4.301 4.190 0.111 1
1 628 . 16 1 1 A 64 64 LYS C C 64 177.084 178.478 -1.394 1
1 629 . 16 1 1 A 64 64 LYS CA C 64 57.237 58.396 -1.159 1
1 630 . 16 1 1 A 64 64 LYS CB C 64 32.502 32.589 -0.087 1
1 634 . 16 1 1 A 64 64 LYS N N 64 116.548 119.580 -3.032 1
1 635 . 16 1 1 A 65 65 LEU H H 65 7.476 7.914 -0.438 1
1 636 . 16 1 1 A 65 65 LEU HA H 65 4.219 4.205 0.014 1
1 645 . 16 1 1 A 65 65 LEU C C 65 175.886 176.149 -0.263 1
1 646 . 16 1 1 A 65 65 LEU CA C 65 55.542 57.296 -1.754 1
1 647 . 16 1 1 A 65 65 LEU CB C 65 45.493 42.852 2.641 1
1 650 . 16 1 1 A 65 65 LEU N N 65 118.000 120.495 -2.495 1
1 651 . 16 1 1 A 66 66 TYR H H 66 7.672 7.988 -0.316 1
1 652 . 16 1 1 A 66 66 TYR HA H 66 4.762 5.161 -0.399 1
1 660 . 16 1 1 A 66 66 TYR C C 66 174.199 172.975 1.224 1
1 661 . 16 1 1 A 66 66 TYR CA C 66 56.013 55.231 0.782 1
1 662 . 16 1 1 A 66 66 TYR CB C 66 40.380 40.950 -0.570 1
1 663 . 16 1 1 A 66 66 TYR N N 66 116.805 114.054 2.751 1
1 664 . 16 1 1 A 67 67 LYS H H 67 8.547 8.074 0.473 1
1 665 . 16 1 1 A 67 67 LYS HA H 67 4.436 4.298 0.138 1
1 670 . 16 1 1 A 67 67 LYS C C 67 175.727 175.001 0.726 1
1 671 . 16 1 1 A 67 67 LYS CA C 67 56.598 56.888 -0.290 1
1 672 . 16 1 1 A 67 67 LYS CB C 67 32.743 32.687 0.056 1
1 676 . 16 1 1 A 67 67 LYS N N 67 120.929 120.289 0.640 1
1 677 . 16 1 1 A 68 68 VAL H H 68 8.168 8.070 0.098 1
1 678 . 16 1 1 A 68 68 VAL HA H 68 4.869 4.459 0.410 1
1 686 . 16 1 1 A 68 68 VAL CA C 68 57.389 58.776 -1.387 1
1 687 . 16 1 1 A 68 68 VAL CB C 68 34.017 35.174 -1.157 1
1 690 . 16 1 1 A 68 68 VAL N N 68 116.467 126.491 -10.024 1
1 691 . 16 1 1 A 69 69 PRO HA H 69 4.674 4.672 0.002 1
1 696 . 16 1 1 A 69 69 PRO C C 69 178.013 176.124 1.889 1
1 697 . 16 1 1 A 69 69 PRO CA C 69 61.443 62.276 -0.833 1
1 698 . 16 1 1 A 69 69 PRO CB C 69 32.231 33.027 -0.796 1
1 701 . 16 1 1 A 70 70 ASP H H 70 8.167 8.578 -0.411 1
1 702 . 16 1 1 A 70 70 ASP HA H 70 4.531 4.955 -0.424 1
1 705 . 16 1 1 A 70 70 ASP C C 70 175.660 176.250 -0.590 1
1 706 . 16 1 1 A 70 70 ASP CA C 70 55.148 53.799 1.349 1
1 707 . 16 1 1 A 70 70 ASP CB C 70 40.876 42.216 -1.340 1
1 708 . 16 1 1 A 70 70 ASP N N 70 116.671 121.071 -4.400 1
1 709 . 16 1 1 A 71 71 PHE H H 71 8.387 8.120 0.267 1
1 710 . 16 1 1 A 71 71 PHE HA H 71 4.076 4.977 -0.901 1
1 717 . 16 1 1 A 71 71 PHE CA C 71 55.672 54.887 0.785 1
1 718 . 16 1 1 A 71 71 PHE CB C 71 39.155 40.542 -1.387 1
1 719 . 16 1 1 A 71 71 PHE N N 71 126.533 117.533 9.000 1
1 720 . 16 1 1 A 72 72 PRO HA H 72 4.156 4.410 -0.254 1
1 727 . 16 1 1 A 72 72 PRO CA C 72 63.079 62.389 0.690 1
1 728 . 16 1 1 A 72 72 PRO CB C 72 32.107 31.620 0.487 1
1 731 . 16 1 1 A 73 73 SER H H 73 8.468 8.425 0.043 1
1 733 . 16 1 1 A 73 73 SER CA C 73 56.133 56.879 -0.746 1
1 734 . 16 1 1 A 73 73 SER CB C 73 63.991 65.105 -1.114 1
1 735 . 16 1 1 A 73 73 SER N N 73 121.533 117.339 4.194 1
1 736 . 16 1 1 A 74 74 LYS HA H 74 4.574 4.111 0.463 1
1 739 . 16 1 1 A 74 74 LYS CA C 74 55.659 57.944 -2.285 1
1 740 . 16 1 1 A 74 74 LYS CB C 74 30.550 32.988 -2.438 1
1 741 . 16 1 1 A 75 75 ARG H H 75 7.962 7.314 0.648 1
1 742 . 16 1 1 A 75 75 ARG HA H 75 4.162 4.658 -0.496 1
1 746 . 16 1 1 A 75 75 ARG CA C 75 56.123 55.512 0.611 1
1 747 . 16 1 1 A 75 75 ARG CB C 75 31.179 31.459 -0.280 1
1 749 . 16 1 1 A 75 75 ARG N N 75 121.665 121.576 0.089 1
1 750 . 16 1 1 A 76 76 LEU H H 76 8.071 8.633 -0.562 1
1 751 . 16 1 1 A 76 76 LEU HA H 76 4.618 4.920 -0.302 1
1 759 . 16 1 1 A 76 76 LEU CA C 76 52.764 51.173 1.591 1
1 760 . 16 1 1 A 76 76 LEU CB C 76 41.918 46.198 -4.280 1
1 762 . 16 1 1 A 76 76 LEU N N 76 124.196 127.840 -3.644 1
1 763 . 16 1 1 A 77 77 PRO HA H 77 4.393 4.468 -0.075 1
1 767 . 16 1 1 A 77 77 PRO CA C 77 63.746 63.325 0.421 1
1 770 . 16 1 1 A 78 78 ASN H H 78 8.379 8.777 -0.398 1
1 771 . 16 1 1 A 78 78 ASN HA H 78 4.586 3.997 0.589 1
1 776 . 16 1 1 A 78 78 ASN C C 78 175.648 175.930 -0.282 1
1 777 . 16 1 1 A 78 78 ASN CA C 78 53.591 55.262 -1.671 1
1 778 . 16 1 1 A 78 78 ASN CB C 78 37.826 38.657 -0.831 1
1 779 . 16 1 1 A 78 78 ASN N N 78 115.292 122.795 -7.503 1
1 781 . 16 1 1 A 79 79 TRP H H 79 7.900 8.031 -0.131 1
1 782 . 16 1 1 A 79 79 TRP HA H 79 4.326 4.569 -0.243 1
1 788 . 16 1 1 A 79 79 TRP CA C 79 58.825 58.716 0.109 1
1 789 . 16 1 1 A 79 79 TRP CB C 79 29.090 27.509 1.581 1
1 790 . 16 1 1 A 79 79 TRP N N 79 119.525 120.420 -0.895 1
1 792 . 16 1 1 A 80 80 ARG H H 80 8.060 8.260 -0.200 1
1 793 . 16 1 1 A 80 80 ARG HA H 80 3.913 4.118 -0.205 1
1 798 . 16 1 1 A 80 80 ARG C C 80 177.024 178.736 -1.712 1
1 799 . 16 1 1 A 80 80 ARG CA C 80 58.292 59.086 -0.794 1
1 800 . 16 1 1 A 80 80 ARG CB C 80 30.146 29.565 0.581 1
1 803 . 16 1 1 A 80 80 ARG N N 80 118.864 121.247 -2.383 1
1 804 . 16 1 1 A 81 81 THR H H 81 7.725 7.166 0.559 1
1 805 . 16 1 1 A 81 81 THR HA H 81 4.297 4.186 0.111 1
1 809 . 16 1 1 A 81 81 THR CA C 81 62.481 63.922 -1.441 1
1 811 . 16 1 1 A 81 81 THR N N 81 109.863 112.845 -2.982 1
1 812 . 16 1 1 A 82 82 ARG HA H 82 4.341 4.842 -0.501 1
1 816 . 16 1 1 A 82 82 ARG C C 82 177.261 175.348 1.913 1
1 817 . 16 1 1 A 82 82 ARG CA C 82 56.846 54.668 2.178 1
1 818 . 16 1 1 A 82 82 ARG CB C 82 30.288 32.267 -1.979 1
1 820 . 16 1 1 A 83 83 GLY H H 83 8.321 8.770 -0.449 1
1 821 . 16 1 1 A 83 83 GLY HA2 H 83 3.957 4.184 -0.227 1
1 822 . 16 1 1 A 83 83 GLY C C 83 175.185 175.468 -0.283 1
1 823 . 16 1 1 A 83 83 GLY CA C 83 46.297 44.416 1.881 1
1 824 . 16 1 1 A 83 83 GLY N N 83 109.146 109.533 -0.387 1
1 825 . 16 1 1 A 84 84 LEU H H 84 8.303 8.814 -0.511 1
1 826 . 16 1 1 A 84 84 LEU HA H 84 4.018 4.052 -0.034 1
1 835 . 16 1 1 A 84 84 LEU C C 84 178.552 178.050 0.502 1
1 836 . 16 1 1 A 84 84 LEU CA C 84 58.236 56.665 1.571 1
1 837 . 16 1 1 A 84 84 LEU CB C 84 41.837 41.970 -0.133 1
1 840 . 16 1 1 A 84 84 LEU N N 84 122.662 121.152 1.510 1
1 841 . 16 1 1 A 85 85 GLU H H 85 8.233 8.246 -0.013 1
1 842 . 16 1 1 A 85 85 GLU HA H 85 4.371 3.797 0.574 1
1 846 . 16 1 1 A 85 85 GLU C C 85 178.555 178.461 0.094 1
1 847 . 16 1 1 A 85 85 GLU CA C 85 58.377 59.998 -1.621 1
1 848 . 16 1 1 A 85 85 GLU CB C 85 28.675 29.103 -0.428 1
1 850 . 16 1 1 A 85 85 GLU N N 85 119.781 119.050 0.731 1
1 851 . 16 1 1 A 86 86 GLN H H 86 7.877 8.318 -0.441 1
1 852 . 16 1 1 A 86 86 GLN HA H 86 4.100 3.943 0.157 1
1 858 . 16 1 1 A 86 86 GLN C C 86 179.557 178.329 1.228 1
1 859 . 16 1 1 A 86 86 GLN CA C 86 58.955 59.208 -0.253 1
1 860 . 16 1 1 A 86 86 GLN CB C 86 28.191 28.478 -0.287 1
1 862 . 16 1 1 A 86 86 GLN N N 86 118.042 118.229 -0.187 1
1 863 . 16 1 1 A 87 87 ARG H H 87 8.169 7.711 0.458 1
1 864 . 16 1 1 A 87 87 ARG HA H 87 3.975 3.776 0.199 1
1 868 . 16 1 1 A 87 87 ARG C C 87 177.051 178.553 -1.502 1
1 869 . 16 1 1 A 87 87 ARG CA C 87 59.006 59.298 -0.292 1
1 870 . 16 1 1 A 87 87 ARG CB C 87 30.383 29.273 1.110 1
1 872 . 16 1 1 A 87 87 ARG N N 87 121.381 119.903 1.478 1
1 873 . 16 1 1 A 88 88 ARG H H 88 8.593 7.427 1.166 1
1 874 . 16 1 1 A 88 88 ARG HA H 88 3.726 3.656 0.070 1
1 876 . 16 1 1 A 88 88 ARG C C 88 177.520 178.305 -0.785 1
1 877 . 16 1 1 A 88 88 ARG CA C 88 60.751 59.030 1.721 1
1 878 . 16 1 1 A 88 88 ARG CB C 88 30.153 29.773 0.380 1
1 879 . 16 1 1 A 88 88 ARG N N 88 120.863 118.991 1.872 1
1 880 . 16 1 1 A 89 89 GLN H H 89 8.355 8.213 0.142 1
1 881 . 16 1 1 A 89 89 GLN HA H 89 3.887 3.918 -0.031 1
1 887 . 16 1 1 A 89 89 GLN C C 89 179.499 178.486 1.013 1
1 888 . 16 1 1 A 89 89 GLN CA C 89 59.603 59.528 0.075 1
1 889 . 16 1 1 A 89 89 GLN CB C 89 28.464 28.036 0.428 1
1 891 . 16 1 1 A 89 89 GLN N N 89 116.860 118.983 -2.123 1
1 893 . 16 1 1 A 90 90 GLY H H 90 8.406 8.129 0.277 1
1 894 . 16 1 1 A 90 90 GLY HA2 H 90 3.672 3.677 -0.005 1
1 895 . 16 1 1 A 90 90 GLY HA3 H 90 3.871 3.697 0.174 1
1 896 . 16 1 1 A 90 90 GLY C C 90 177.033 175.827 1.206 1
1 897 . 16 1 1 A 90 90 GLY CA C 90 46.813 47.210 -0.397 1
1 898 . 16 1 1 A 90 90 GLY N N 90 107.679 107.403 0.276 1
1 899 . 16 1 1 A 91 91 LEU H H 91 8.504 7.868 0.636 1
1 900 . 16 1 1 A 91 91 LEU HA H 91 3.784 4.078 -0.294 1
1 910 . 16 1 1 A 91 91 LEU C C 91 178.003 179.096 -1.093 1
1 911 . 16 1 1 A 91 91 LEU CA C 91 57.354 57.851 -0.497 1
1 912 . 16 1 1 A 91 91 LEU CB C 91 40.359 41.250 -0.891 1
1 916 . 16 1 1 A 91 91 LEU N N 91 123.959 121.656 2.303 1
1 917 . 16 1 1 A 92 92 GLU H H 92 8.324 8.829 -0.505 1
1 918 . 16 1 1 A 92 92 GLU HA H 92 3.732 4.041 -0.309 1
1 922 . 16 1 1 A 92 92 GLU C C 92 177.272 178.675 -1.403 1
1 923 . 16 1 1 A 92 92 GLU CA C 92 60.651 59.495 1.156 1
1 924 . 16 1 1 A 92 92 GLU CB C 92 30.843 29.369 1.474 1
1 926 . 16 1 1 A 92 92 GLU N N 92 121.991 120.328 1.663 1
1 927 . 16 1 1 A 93 93 ALA H H 93 8.126 8.017 0.109 1
1 928 . 16 1 1 A 93 93 ALA HA H 93 4.160 4.067 0.093 1
1 932 . 16 1 1 A 93 93 ALA C C 93 180.818 179.102 1.716 1
1 933 . 16 1 1 A 93 93 ALA CA C 93 54.828 54.809 0.019 1
1 934 . 16 1 1 A 93 93 ALA CB C 93 18.032 17.968 0.064 1
1 935 . 16 1 1 A 93 93 ALA N N 93 120.066 121.739 -1.673 1
1 936 . 16 1 1 A 94 94 TYR H H 94 7.916 7.525 0.391 1
1 937 . 16 1 1 A 94 94 TYR HA H 94 4.139 4.316 -0.177 1
1 942 . 16 1 1 A 94 94 TYR C C 94 175.895 178.502 -2.607 1
1 943 . 16 1 1 A 94 94 TYR CA C 94 61.915 61.678 0.237 1
1 944 . 16 1 1 A 94 94 TYR CB C 94 38.740 38.004 0.736 1
1 945 . 16 1 1 A 94 94 TYR N N 94 121.179 115.923 5.256 1
1 946 . 16 1 1 A 95 95 ILE H H 95 7.983 8.455 -0.472 1
1 947 . 16 1 1 A 95 95 ILE HA H 95 3.614 3.716 -0.102 1
1 957 . 16 1 1 A 95 95 ILE C C 95 174.678 178.063 -3.385 1
1 958 . 16 1 1 A 95 95 ILE CA C 95 63.461 64.637 -1.176 1
1 959 . 16 1 1 A 95 95 ILE CB C 95 36.625 37.449 -0.824 1
1 963 . 16 1 1 A 95 95 ILE N N 95 116.397 120.266 -3.869 1
1 964 . 16 1 1 A 96 96 GLN H H 96 8.175 8.985 -0.810 1
1 965 . 16 1 1 A 96 96 GLN HA H 96 3.763 4.044 -0.281 1
1 970 . 16 1 1 A 96 96 GLN C C 96 179.042 178.523 0.519 1
1 971 . 16 1 1 A 96 96 GLN CA C 96 59.270 59.835 -0.565 1
1 972 . 16 1 1 A 96 96 GLN CB C 96 27.696 28.241 -0.545 1
1 974 . 16 1 1 A 96 96 GLN N N 96 116.631 120.371 -3.740 1
1 976 . 16 1 1 A 97 97 GLY H H 97 8.222 8.102 0.120 1
1 977 . 16 1 1 A 97 97 GLY HA2 H 97 3.661 3.734 -0.073 1
1 978 . 16 1 1 A 97 97 GLY HA3 H 97 3.806 3.752 0.054 1
1 979 . 16 1 1 A 97 97 GLY C C 97 175.449 176.114 -0.665 1
1 980 . 16 1 1 A 97 97 GLY CA C 97 46.917 47.376 -0.459 1
1 981 . 16 1 1 A 97 97 GLY N N 97 107.315 106.909 0.406 1
1 982 . 16 1 1 A 98 98 ILE H H 98 7.630 8.036 -0.406 1
1 983 . 16 1 1 A 98 98 ILE HA H 98 3.399 3.937 -0.538 1
1 993 . 16 1 1 A 98 98 ILE C C 98 178.683 178.058 0.625 1
1 994 . 16 1 1 A 98 98 ILE CA C 98 66.402 64.777 1.625 1
1 995 . 16 1 1 A 98 98 ILE CB C 98 38.037 37.370 0.667 1
1 999 . 16 1 1 A 98 98 ILE N N 98 120.644 120.511 0.133 1
1 1000 . 16 1 1 A 99 99 LEU H H 99 7.076 8.586 -1.510 1
1 1001 . 16 1 1 A 99 99 LEU HA H 99 4.133 4.054 0.079 1
1 1010 . 16 1 1 A 99 99 LEU C C 99 178.128 177.733 0.395 1
1 1011 . 16 1 1 A 99 99 LEU CA C 99 57.129 58.051 -0.922 1
1 1012 . 16 1 1 A 99 99 LEU CB C 99 41.108 41.383 -0.275 1
1 1014 . 16 1 1 A 99 99 LEU N N 99 116.844 123.858 -7.014 1
1 1015 . 16 1 1 A 100 100 TYR H H 100 7.890 8.131 -0.241 1
1 1016 . 16 1 1 A 100 100 TYR HA H 100 4.550 4.283 0.267 1
1 1021 . 16 1 1 A 100 100 TYR C C 100 178.210 177.800 0.410 1
1 1022 . 16 1 1 A 100 100 TYR CA C 100 59.452 60.090 -0.638 1
1 1023 . 16 1 1 A 100 100 TYR CB C 100 38.786 39.468 -0.682 1
1 1024 . 16 1 1 A 100 100 TYR N N 100 116.427 120.244 -3.817 1
1 1025 . 16 1 1 A 101 101 LEU H H 101 8.041 7.733 0.308 1
1 1026 . 16 1 1 A 101 101 LEU HA H 101 4.158 4.143 0.015 1
1 1036 . 16 1 1 A 101 101 LEU C C 101 176.808 177.225 -0.417 1
1 1037 . 16 1 1 A 101 101 LEU CA C 101 56.156 57.972 -1.816 1
1 1038 . 16 1 1 A 101 101 LEU CB C 101 44.307 42.571 1.736 1
1 1041 . 16 1 1 A 101 101 LEU N N 101 116.493 119.998 -3.505 1
1 1042 . 16 1 1 A 102 102 ASN H H 102 7.146 8.022 -0.876 1
1 1043 . 16 1 1 A 102 102 ASN HA H 102 5.056 5.123 -0.067 1
1 1046 . 16 1 1 A 102 102 ASN CA C 102 52.704 54.576 -1.872 1
1 1047 . 16 1 1 A 102 102 ASN CB C 102 42.424 39.802 2.622 1
1 1048 . 16 1 1 A 102 102 ASN N N 102 114.922 113.743 1.179 1
1 1049 . 16 1 1 A 103 103 GLN H H 103 8.477 7.867 0.610 1
1 1050 . 16 1 1 A 103 103 GLN HA H 103 3.866 4.461 -0.595 1
1 1054 . 16 1 1 A 103 103 GLN C C 103 176.110 174.491 1.619 1
1 1055 . 16 1 1 A 103 103 GLN CA C 103 58.451 54.032 4.419 1
1 1056 . 16 1 1 A 103 103 GLN CB C 103 28.896 27.914 0.982 1
1 1058 . 16 1 1 A 103 103 GLN N N 103 120.252 114.353 5.899 1
1 1059 . 16 1 1 A 104 104 GLU H H 104 7.930 8.696 -0.766 1
1 1060 . 16 1 1 A 104 104 GLU HA H 104 4.591 4.604 -0.013 1
1 1064 . 16 1 1 A 104 104 GLU C C 104 175.397 177.265 -1.868 1
1 1065 . 16 1 1 A 104 104 GLU CA C 104 54.058 57.179 -3.121 1
1 1066 . 16 1 1 A 104 104 GLU CB C 104 31.272 29.927 1.345 1
1 1068 . 16 1 1 A 104 104 GLU N N 104 117.295 125.539 -8.244 1
1 1069 . 16 1 1 A 105 105 VAL H H 105 8.546 8.863 -0.317 1
1 1070 . 16 1 1 A 105 105 VAL HA H 105 3.823 3.778 0.045 1
1 1078 . 16 1 1 A 105 105 VAL CA C 105 60.706 63.145 -2.439 1
1 1079 . 16 1 1 A 105 105 VAL CB C 105 32.126 30.226 1.900 1
1 1082 . 16 1 1 A 105 105 VAL N N 105 124.511 124.305 0.206 1
1 1083 . 16 1 1 A 106 106 PRO HA H 106 3.997 4.701 -0.704 1
1 1089 . 16 1 1 A 106 106 PRO C C 106 178.240 177.022 1.218 1
1 1090 . 16 1 1 A 106 106 PRO CA C 106 62.961 62.049 0.912 1
1 1091 . 16 1 1 A 106 106 PRO CB C 106 32.321 32.674 -0.353 1
1 1094 . 16 1 1 A 107 107 LYS H H 107 9.122 9.063 0.059 1
1 1095 . 16 1 1 A 107 107 LYS HA H 107 3.813 3.954 -0.141 1
1 1101 . 16 1 1 A 107 107 LYS C C 107 178.563 178.322 0.241 1
1 1102 . 16 1 1 A 107 107 LYS CA C 107 60.085 59.438 0.647 1
1 1103 . 16 1 1 A 107 107 LYS CB C 107 31.632 32.083 -0.451 1
1 1106 . 16 1 1 A 107 107 LYS N N 107 129.017 122.878 6.139 1
1 1107 . 16 1 1 A 108 108 GLU H H 108 10.370 8.454 1.916 1
1 1108 . 16 1 1 A 108 108 GLU HA H 108 3.991 4.102 -0.111 1
1 1111 . 16 1 1 A 108 108 GLU C C 108 180.366 179.588 0.778 1
1 1112 . 16 1 1 A 108 108 GLU CA C 108 60.337 59.215 1.122 1
1 1113 . 16 1 1 A 108 108 GLU CB C 108 29.178 29.089 0.089 1
1 1115 . 16 1 1 A 108 108 GLU N N 108 118.335 118.473 -0.138 1
1 1116 . 16 1 1 A 109 109 LEU H H 109 7.393 7.944 -0.551 1
1 1117 . 16 1 1 A 109 109 LEU HA H 109 4.220 4.176 0.044 1
1 1126 . 16 1 1 A 109 109 LEU C C 109 177.378 179.940 -2.562 1
1 1127 . 16 1 1 A 109 109 LEU CA C 109 56.618 57.602 -0.984 1
1 1128 . 16 1 1 A 109 109 LEU CB C 109 41.898 41.209 0.689 1
1 1131 . 16 1 1 A 109 109 LEU N N 109 118.285 120.244 -1.959 1
1 1132 . 16 1 1 A 110 110 LEU H H 110 7.641 8.158 -0.517 1
1 1133 . 16 1 1 A 110 110 LEU HA H 110 3.796 3.915 -0.119 1
1 1142 . 16 1 1 A 110 110 LEU C C 110 179.103 179.207 -0.104 1
1 1143 . 16 1 1 A 110 110 LEU CA C 110 59.046 58.078 0.968 1
1 1144 . 16 1 1 A 110 110 LEU CB C 110 40.228 40.744 -0.516 1
1 1147 . 16 1 1 A 110 110 LEU N N 110 120.162 120.117 0.045 1
1 1148 . 16 1 1 A 111 111 GLU H H 111 7.916 8.573 -0.657 1
1 1149 . 16 1 1 A 111 111 GLU HA H 111 4.080 4.030 0.050 1
1 1153 . 16 1 1 A 111 111 GLU C C 111 179.967 178.955 1.012 1
1 1154 . 16 1 1 A 111 111 GLU CA C 111 59.243 59.191 0.052 1
1 1155 . 16 1 1 A 111 111 GLU CB C 111 29.576 29.267 0.309 1
1 1157 . 16 1 1 A 111 111 GLU N N 111 117.360 120.365 -3.005 1
1 1158 . 16 1 1 A 112 112 PHE H H 112 7.712 8.594 -0.882 1
1 1159 . 16 1 1 A 112 112 PHE HA H 112 4.224 4.206 0.018 1
1 1164 . 16 1 1 A 112 112 PHE C C 112 177.180 177.175 0.005 1
1 1165 . 16 1 1 A 112 112 PHE CA C 112 61.407 61.270 0.137 1
1 1166 . 16 1 1 A 112 112 PHE CB C 112 40.172 39.664 0.508 1
1 1167 . 16 1 1 A 112 112 PHE N N 112 123.042 121.037 2.005 1
1 1168 . 16 1 1 A 113 113 LEU H H 113 8.056 8.309 -0.253 1
1 1169 . 16 1 1 A 113 113 LEU HA H 113 4.147 4.312 -0.165 1
1 1175 . 16 1 1 A 113 113 LEU C C 113 173.717 176.083 -2.366 1
1 1176 . 16 1 1 A 113 113 LEU CA C 113 54.093 54.681 -0.588 1
1 1177 . 16 1 1 A 113 113 LEU CB C 113 41.517 41.844 -0.327 1
1 1179 . 16 1 1 A 113 113 LEU N N 113 115.595 117.269 -1.674 1
1 1180 . 16 1 1 A 114 114 ARG H H 114 7.902 8.062 -0.160 1
1 1181 . 16 1 1 A 114 114 ARG HA H 114 3.817 4.190 -0.373 1
1 1182 . 16 1 1 A 114 114 ARG C C 114 174.566 176.413 -1.847 1
1 1183 . 16 1 1 A 114 114 ARG CA C 114 57.233 57.289 -0.056 1
1 1184 . 16 1 1 A 114 114 ARG CB C 114 27.788 29.369 -1.581 1
1 1185 . 16 1 1 A 114 114 ARG N N 114 116.021 118.742 -2.721 1
1 1186 . 16 1 1 A 115 115 LEU H H 115 8.160 7.433 0.727 1
1 1187 . 16 1 1 A 115 115 LEU HA H 115 4.462 4.407 0.055 1
1 1195 . 16 1 1 A 115 115 LEU C C 115 176.374 177.325 -0.951 1
1 1196 . 16 1 1 A 115 115 LEU CA C 115 53.965 55.285 -1.320 1
1 1197 . 16 1 1 A 115 115 LEU CB C 115 44.077 41.237 2.840 1
1 1199 . 16 1 1 A 115 115 LEU N N 115 118.089 119.250 -1.161 1
1 1200 . 16 1 1 A 116 116 ARG H H 116 8.066 7.240 0.826 1
1 1201 . 16 1 1 A 116 116 ARG HA H 116 4.172 4.292 -0.120 1
1 1203 . 16 1 1 A 116 116 ARG CA C 116 55.961 57.234 -1.273 1
1 1204 . 16 1 1 A 116 116 ARG CB C 116 31.379 30.649 0.730 1
1 1205 . 16 1 1 A 116 116 ARG N N 116 120.852 120.040 0.812 1
1 1206 . 16 1 1 A 117 117 HIS H H 117 7.928 8.969 -1.041 1
1 1207 . 16 1 1 A 117 117 HIS HA H 117 4.557 4.236 0.321 1
1 1211 . 16 1 1 A 117 117 HIS CA C 117 55.937 56.800 -0.863 1
1 1212 . 16 1 1 A 117 117 HIS CB C 117 30.875 28.197 2.678 1
1 1213 . 16 1 1 A 118 118 PHE H H 118 8.183 8.015 0.168 1
1 1214 . 16 1 1 A 118 118 PHE HA H 118 4.730 4.733 -0.003 1
1 1219 . 16 1 1 A 118 118 PHE CA C 118 55.716 56.371 -0.655 1
1 1220 . 16 1 1 A 118 118 PHE CB C 118 39.263 40.269 -1.006 1
1 1221 . 16 1 1 A 118 118 PHE N N 118 123.480 122.145 1.335 1
1 1222 . 16 1 1 A 119 119 PRO HA H 119 4.398 4.308 0.090 1
1 1227 . 16 1 1 A 119 119 PRO C C 119 176.666 176.374 0.292 1
1 1228 . 16 1 1 A 119 119 PRO CA C 119 63.377 64.248 -0.871 1
1 1229 . 16 1 1 A 119 119 PRO CB C 119 32.059 32.023 0.036 1
1 1232 . 16 1 1 A 120 120 THR H H 120 8.054 6.836 1.218 1
1 1233 . 16 1 1 A 120 120 THR HA H 120 4.273 3.972 0.301 1
1 1238 . 16 1 1 A 120 120 THR C C 120 174.154 170.834 3.320 1
1 1239 . 16 1 1 A 120 120 THR CA C 120 61.893 59.993 1.900 1
1 1240 . 16 1 1 A 120 120 THR CB C 120 69.736 69.430 0.306 1
1 1242 . 16 1 1 A 120 120 THR N N 120 113.088 107.802 5.286 1
1 1243 . 16 1 1 A 121 121 ASP H H 121 8.209 8.693 -0.484 1
1 1244 . 16 1 1 A 121 121 ASP HA H 121 4.876 5.128 -0.252 1
1 1247 . 16 1 1 A 121 121 ASP CA C 121 52.126 50.701 1.425 1
1 1248 . 16 1 1 A 121 121 ASP CB C 121 41.553 43.780 -2.227 1
1 1249 . 16 1 1 A 121 121 ASP N N 121 123.630 123.005 0.625 1
1 1250 . 16 1 1 A 122 122 PRO HA H 122 4.363 4.764 -0.401 1
1 1255 . 16 1 1 A 122 122 PRO C C 122 177.344 176.085 1.259 1
1 1256 . 16 1 1 A 122 122 PRO CA C 122 63.913 62.412 1.501 1
1 1257 . 16 1 1 A 122 122 PRO CB C 122 32.116 29.983 2.133 1
1 1260 . 16 1 1 A 123 123 LYS H H 123 8.344 7.751 0.593 1
1 1261 . 16 1 1 A 123 123 LYS HA H 123 4.244 4.882 -0.638 1
1 1266 . 16 1 1 A 123 123 LYS C C 123 176.637 175.307 1.330 1
1 1267 . 16 1 1 A 123 123 LYS CA C 123 56.359 55.121 1.238 1
1 1268 . 16 1 1 A 123 123 LYS CB C 123 32.367 34.165 -1.798 1
1 1272 . 16 1 1 A 123 123 LYS N N 123 119.110 118.038 1.072 1
1 1273 . 16 1 1 A 124 124 ALA H H 124 7.929 8.821 -0.892 1
1 1274 . 16 1 1 A 124 124 ALA HA H 124 4.248 4.579 -0.331 1
1 1278 . 16 1 1 A 124 124 ALA C C 124 177.648 176.835 0.813 1
1 1279 . 16 1 1 A 124 124 ALA CA C 124 52.618 51.346 1.272 1
1 1280 . 16 1 1 A 124 124 ALA CB C 124 19.379 17.795 1.584 1
1 1281 . 16 1 1 A 124 124 ALA N N 124 123.825 127.650 -3.825 1
1 1282 . 16 1 1 A 125 125 SER H H 125 8.134 8.222 -0.088 1
1 1283 . 16 1 1 A 125 125 SER HA H 125 4.341 4.867 -0.526 1
1 1286 . 16 1 1 A 125 125 SER C C 125 174.172 173.651 0.521 1
1 1287 . 16 1 1 A 125 125 SER CA C 125 58.391 57.640 0.751 1
1 1288 . 16 1 1 A 125 125 SER CB C 125 63.748 63.727 0.021 1
1 1289 . 16 1 1 A 125 125 SER N N 125 114.454 115.406 -0.952 1
1 1290 . 16 1 1 A 126 126 ASN H H 126 8.242 8.688 -0.446 1
1 1291 . 16 1 1 A 126 126 ASN HA H 126 4.657 5.065 -0.408 1
1 1294 . 16 1 1 A 126 126 ASN C C 126 174.624 174.806 -0.182 1
1 1295 . 16 1 1 A 126 126 ASN CA C 126 53.292 52.091 1.201 1
1 1296 . 16 1 1 A 126 126 ASN CB C 126 38.797 39.387 -0.590 1
1 1297 . 16 1 1 A 126 126 ASN N N 126 120.102 124.438 -4.336 1
1 1298 . 16 1 1 A 127 127 TRP H H 127 8.051 8.902 -0.851 1
1 1299 . 16 1 1 A 127 127 TRP HA H 127 4.694 4.911 -0.217 1
1 1302 . 16 1 1 A 127 127 TRP C C 127 175.479 176.248 -0.769 1
1 1303 . 16 1 1 A 127 127 TRP CA C 127 57.096 58.599 -1.503 1
1 1304 . 16 1 1 A 127 127 TRP CB C 127 29.820 31.931 -2.111 1
1 1305 . 16 1 1 A 127 127 TRP N N 127 121.198 126.243 -5.045 1
1 1 . 17 1 1 A 7 7 HIS HA H 7 4.623 4.611 0.012 1
1 4 . 17 1 1 A 7 7 HIS C C 7 174.747 173.378 1.369 1
1 5 . 17 1 1 A 7 7 HIS CA C 7 56.189 54.255 1.934 1
1 6 . 17 1 1 A 7 7 HIS CB C 7 30.028 28.548 1.480 1
1 7 . 17 1 1 A 8 8 LEU H H 8 8.283 8.579 -0.296 1
1 8 . 17 1 1 A 8 8 LEU HA H 8 4.249 4.535 -0.286 1
1 10 . 17 1 1 A 8 8 LEU C C 8 176.700 175.692 1.008 1
1 11 . 17 1 1 A 8 8 LEU CA C 8 55.498 53.855 1.643 1
1 12 . 17 1 1 A 8 8 LEU CB C 8 42.568 41.626 0.942 1
1 13 . 17 1 1 A 8 8 LEU N N 8 122.916 127.417 -4.501 1
1 14 . 17 1 1 A 9 9 GLU H H 9 8.623 8.585 0.038 1
1 15 . 17 1 1 A 9 9 GLU HA H 9 4.311 4.351 -0.040 1
1 16 . 17 1 1 A 9 9 GLU C C 9 174.811 175.621 -0.810 1
1 17 . 17 1 1 A 9 9 GLU CA C 9 56.377 57.010 -0.633 1
1 18 . 17 1 1 A 9 9 GLU CB C 9 29.557 30.317 -0.760 1
1 20 . 17 1 1 A 9 9 GLU N N 9 121.512 125.343 -3.831 1
1 21 . 17 1 1 A 10 10 LEU H H 10 7.853 8.920 -1.067 1
1 22 . 17 1 1 A 10 10 LEU HA H 10 5.225 5.435 -0.210 1
1 31 . 17 1 1 A 10 10 LEU C C 10 174.637 175.374 -0.737 1
1 32 . 17 1 1 A 10 10 LEU CA C 10 54.513 53.346 1.167 1
1 33 . 17 1 1 A 10 10 LEU CB C 10 45.187 42.867 2.320 1
1 36 . 17 1 1 A 10 10 LEU N N 10 123.592 126.902 -3.310 1
1 37 . 17 1 1 A 11 11 GLU H H 11 8.894 8.680 0.214 1
1 38 . 17 1 1 A 11 11 GLU HA H 11 4.765 4.739 0.026 1
1 43 . 17 1 1 A 11 11 GLU C C 11 174.563 175.414 -0.851 1
1 44 . 17 1 1 A 11 11 GLU CA C 11 55.047 55.905 -0.858 1
1 45 . 17 1 1 A 11 11 GLU CB C 11 33.760 30.541 3.219 1
1 47 . 17 1 1 A 11 11 GLU N N 11 124.055 124.822 -0.767 1
1 48 . 17 1 1 A 12 12 VAL H H 12 8.607 8.885 -0.278 1
1 49 . 17 1 1 A 12 12 VAL HA H 12 5.174 5.314 -0.140 1
1 57 . 17 1 1 A 12 12 VAL C C 12 173.573 175.321 -1.748 1
1 58 . 17 1 1 A 12 12 VAL CA C 12 60.296 61.174 -0.878 1
1 59 . 17 1 1 A 12 12 VAL CB C 12 35.689 33.999 1.690 1
1 62 . 17 1 1 A 12 12 VAL N N 12 120.878 125.297 -4.419 1
1 63 . 17 1 1 A 13 13 HIS H H 13 8.982 9.149 -0.167 1
1 64 . 17 1 1 A 13 13 HIS HA H 13 4.824 5.314 -0.490 1
1 69 . 17 1 1 A 13 13 HIS C C 13 173.236 171.999 1.237 1
1 70 . 17 1 1 A 13 13 HIS CA C 13 54.906 53.788 1.118 1
1 71 . 17 1 1 A 13 13 HIS CB C 13 33.496 32.852 0.644 1
1 72 . 17 1 1 A 13 13 HIS N N 13 121.504 121.875 -0.371 1
1 73 . 17 1 1 A 14 14 ILE H H 14 10.442 9.129 1.313 1
1 74 . 17 1 1 A 14 14 ILE HA H 14 5.458 4.549 0.909 1
1 84 . 17 1 1 A 14 14 ILE CA C 14 58.386 57.802 0.584 1
1 85 . 17 1 1 A 14 14 ILE CB C 14 38.596 38.147 0.449 1
1 88 . 17 1 1 A 14 14 ILE N N 14 119.923 121.309 -1.386 1
1 89 . 17 1 1 A 15 15 PRO HA H 15 4.560 4.488 0.072 1
1 95 . 17 1 1 A 15 15 PRO C C 15 176.907 175.959 0.948 1
1 96 . 17 1 1 A 15 15 PRO CA C 15 64.342 64.351 -0.009 1
1 97 . 17 1 1 A 15 15 PRO CB C 15 32.924 32.235 0.689 1
1 100 . 17 1 1 A 16 16 SER H H 16 7.331 7.495 -0.164 1
1 101 . 17 1 1 A 16 16 SER HA H 16 4.822 4.828 -0.006 1
1 104 . 17 1 1 A 16 16 SER C C 16 171.253 171.973 -0.720 1
1 105 . 17 1 1 A 16 16 SER CA C 16 57.135 57.536 -0.401 1
1 106 . 17 1 1 A 16 16 SER CB C 16 65.947 65.543 0.404 1
1 107 . 17 1 1 A 16 16 SER N N 16 107.745 108.007 -0.262 1
1 108 . 17 1 1 A 17 17 VAL H H 17 8.350 8.205 0.145 1
1 109 . 17 1 1 A 17 17 VAL HA H 17 4.926 4.939 -0.013 1
1 117 . 17 1 1 A 17 17 VAL C C 17 173.692 174.651 -0.959 1
1 118 . 17 1 1 A 17 17 VAL CA C 17 58.721 60.742 -2.021 1
1 119 . 17 1 1 A 17 17 VAL CB C 17 34.420 34.858 -0.438 1
1 122 . 17 1 1 A 17 17 VAL N N 17 118.680 121.250 -2.570 1
1 123 . 17 1 1 A 18 18 GLY H H 18 8.332 8.967 -0.635 1
1 124 . 17 1 1 A 18 18 GLY HA2 H 18 4.189 4.327 -0.138 1
1 125 . 17 1 1 A 18 18 GLY HA3 H 18 4.011 4.340 -0.329 1
1 126 . 17 1 1 A 18 18 GLY CA C 18 45.356 43.993 1.363 1
1 127 . 17 1 1 A 18 18 GLY N N 18 112.549 114.970 -2.421 1
1 128 . 17 1 1 A 19 19 PRO HA H 19 4.757 4.812 -0.055 1
1 134 . 17 1 1 A 19 19 PRO C C 19 177.482 175.973 1.509 1
1 135 . 17 1 1 A 19 19 PRO CA C 19 62.848 62.203 0.645 1
1 136 . 17 1 1 A 19 19 PRO CB C 19 32.283 29.850 2.433 1
1 139 . 17 1 1 A 20 20 GLU H H 20 8.588 8.807 -0.219 1
1 140 . 17 1 1 A 20 20 GLU HA H 20 4.147 4.603 -0.456 1
1 144 . 17 1 1 A 20 20 GLU C C 20 175.857 176.633 -0.776 1
1 145 . 17 1 1 A 20 20 GLU CA C 20 57.150 56.806 0.344 1
1 146 . 17 1 1 A 20 20 GLU CB C 20 30.923 32.244 -1.321 1
1 148 . 17 1 1 A 20 20 GLU N N 20 122.087 120.578 1.509 1
1 149 . 17 1 1 A 21 21 ALA H H 21 8.352 7.251 1.101 1
1 150 . 17 1 1 A 21 21 ALA HA H 21 4.391 4.344 0.047 1
1 154 . 17 1 1 A 21 21 ALA C C 21 174.910 177.285 -2.375 1
1 155 . 17 1 1 A 21 21 ALA CA C 21 52.166 52.553 -0.387 1
1 156 . 17 1 1 A 21 21 ALA CB C 21 19.915 19.268 0.647 1
1 157 . 17 1 1 A 21 21 ALA N N 21 124.593 123.005 1.588 1
1 158 . 17 1 1 A 22 22 GLU H H 22 8.398 8.512 -0.114 1
1 159 . 17 1 1 A 22 22 GLU HA H 22 4.331 4.457 -0.126 1
1 163 . 17 1 1 A 22 22 GLU C C 22 176.389 176.849 -0.460 1
1 164 . 17 1 1 A 22 22 GLU CA C 22 56.316 56.122 0.194 1
1 165 . 17 1 1 A 22 22 GLU CB C 22 30.713 30.071 0.642 1
1 167 . 17 1 1 A 22 22 GLU N N 22 120.159 118.784 1.375 1
1 168 . 17 1 1 A 23 23 GLY H H 23 8.246 8.732 -0.486 1
1 169 . 17 1 1 A 23 23 GLY HA2 H 23 4.162 4.228 -0.066 1
1 170 . 17 1 1 A 23 23 GLY HA3 H 23 4.061 4.349 -0.288 1
1 171 . 17 1 1 A 23 23 GLY CA C 23 44.801 45.728 -0.927 1
1 172 . 17 1 1 A 23 23 GLY N N 23 110.080 109.387 0.693 1
1 173 . 17 1 1 A 24 24 PRO HA H 24 4.417 4.390 0.027 1
1 178 . 17 1 1 A 24 24 PRO C C 24 177.135 176.072 1.063 1
1 179 . 17 1 1 A 24 24 PRO CA C 24 63.520 65.088 -1.568 1
1 180 . 17 1 1 A 24 24 PRO CB C 24 32.124 31.867 0.257 1
1 183 . 17 1 1 A 25 25 ARG H H 25 8.409 7.330 1.079 1
1 184 . 17 1 1 A 25 25 ARG HA H 25 4.298 4.677 -0.379 1
1 187 . 17 1 1 A 25 25 ARG C C 25 176.217 174.629 1.588 1
1 188 . 17 1 1 A 25 25 ARG CA C 25 56.237 54.657 1.580 1
1 189 . 17 1 1 A 25 25 ARG CB C 25 30.467 32.741 -2.274 1
1 192 . 17 1 1 A 25 25 ARG N N 25 120.147 112.520 7.627 1
1 193 . 17 1 1 A 26 26 GLN H H 26 8.278 8.330 -0.052 1
1 194 . 17 1 1 A 26 26 GLN HA H 26 4.336 4.552 -0.216 1
1 200 . 17 1 1 A 26 26 GLN C C 26 175.566 175.031 0.535 1
1 201 . 17 1 1 A 26 26 GLN CA C 26 55.788 55.879 -0.091 1
1 202 . 17 1 1 A 26 26 GLN CB C 26 29.714 28.630 1.084 1
1 204 . 17 1 1 A 26 26 GLN N N 26 120.460 119.885 0.575 1
1 206 . 17 1 1 A 27 27 SER H H 27 8.298 8.501 -0.203 1
1 208 . 17 1 1 A 27 27 SER CA C 27 56.156 56.015 0.141 1
1 209 . 17 1 1 A 27 27 SER CB C 27 63.813 64.579 -0.766 1
1 210 . 17 1 1 A 27 27 SER N N 27 117.382 121.925 -4.543 1
1 211 . 17 1 1 A 28 28 PRO HA H 28 4.366 4.407 -0.041 1
1 216 . 17 1 1 A 28 28 PRO C C 28 177.555 176.457 1.098 1
1 217 . 17 1 1 A 28 28 PRO CA C 28 64.486 65.371 -0.885 1
1 218 . 17 1 1 A 28 28 PRO CB C 28 31.892 31.842 0.050 1
1 221 . 17 1 1 A 29 29 GLU H H 29 8.582 8.332 0.250 1
1 222 . 17 1 1 A 29 29 GLU HA H 29 4.218 4.726 -0.508 1
1 226 . 17 1 1 A 29 29 GLU CA C 29 57.261 55.760 1.501 1
1 227 . 17 1 1 A 29 29 GLU CB C 29 29.633 31.574 -1.941 1
1 229 . 17 1 1 A 29 29 GLU N N 29 118.309 118.107 0.202 1
1 230 . 17 1 1 A 30 30 LYS H H 30 7.955 8.792 -0.837 1
1 231 . 17 1 1 A 30 30 LYS HA H 30 4.328 4.606 -0.278 1
1 236 . 17 1 1 A 30 30 LYS C C 30 176.222 176.663 -0.441 1
1 237 . 17 1 1 A 30 30 LYS CA C 30 56.247 56.826 -0.579 1
1 238 . 17 1 1 A 30 30 LYS CB C 30 32.720 35.239 -2.519 1
1 242 . 17 1 1 A 30 30 LYS N N 30 120.129 122.487 -2.358 1
1 243 . 17 1 1 A 31 31 SER H H 31 7.883 7.709 0.174 1
1 244 . 17 1 1 A 31 31 SER HA H 31 4.458 4.447 0.011 1
1 246 . 17 1 1 A 31 31 SER C C 31 174.129 175.249 -1.120 1
1 247 . 17 1 1 A 31 31 SER CA C 31 58.477 59.628 -1.151 1
1 248 . 17 1 1 A 31 31 SER CB C 31 64.042 63.262 0.780 1
1 249 . 17 1 1 A 31 31 SER N N 31 115.366 115.891 -0.525 1
1 250 . 17 1 1 A 32 32 HIS H H 32 8.485 8.127 0.358 1
1 251 . 17 1 1 A 32 32 HIS HA H 32 4.450 4.556 -0.106 1
1 255 . 17 1 1 A 32 32 HIS CA C 32 56.009 56.360 -0.351 1
1 256 . 17 1 1 A 32 32 HIS CB C 32 31.122 29.794 1.328 1
1 257 . 17 1 1 A 32 32 HIS N N 32 121.500 122.125 -0.625 1
1 258 . 17 1 1 A 33 33 MET H H 33 8.392 7.400 0.992 1
1 259 . 17 1 1 A 33 33 MET HA H 33 4.601 4.227 0.374 1
1 265 . 17 1 1 A 33 33 MET C C 33 175.842 175.120 0.722 1
1 266 . 17 1 1 A 33 33 MET CA C 33 54.533 55.530 -0.997 1
1 267 . 17 1 1 A 33 33 MET CB C 33 32.868 33.524 -0.656 1
1 270 . 17 1 1 A 33 33 MET N N 33 120.204 120.641 -0.437 1
1 271 . 17 1 1 A 34 34 VAL H H 34 8.938 9.009 -0.071 1
1 272 . 17 1 1 A 34 34 VAL HA H 34 4.430 4.724 -0.294 1
1 280 . 17 1 1 A 34 34 VAL C C 34 174.149 174.742 -0.593 1
1 281 . 17 1 1 A 34 34 VAL CA C 34 60.703 59.417 1.286 1
1 282 . 17 1 1 A 34 34 VAL CB C 34 34.319 35.101 -0.782 1
1 285 . 17 1 1 A 34 34 VAL N N 34 118.512 124.906 -6.394 1
1 286 . 17 1 1 A 35 35 PHE H H 35 9.242 8.340 0.902 1
1 287 . 17 1 1 A 35 35 PHE HA H 35 4.439 5.291 -0.852 1
1 294 . 17 1 1 A 35 35 PHE C C 35 174.831 174.536 0.295 1
1 295 . 17 1 1 A 35 35 PHE CA C 35 57.754 55.188 2.566 1
1 296 . 17 1 1 A 35 35 PHE CB C 35 38.959 41.598 -2.639 1
1 297 . 17 1 1 A 35 35 PHE N N 35 124.912 125.975 -1.063 1
1 298 . 17 1 1 A 36 36 ARG H H 36 8.475 8.749 -0.274 1
1 299 . 17 1 1 A 36 36 ARG HA H 36 4.135 4.873 -0.738 1
1 304 . 17 1 1 A 36 36 ARG C C 36 172.865 175.231 -2.366 1
1 305 . 17 1 1 A 36 36 ARG CA C 36 56.895 55.011 1.884 1
1 306 . 17 1 1 A 36 36 ARG CB C 36 28.962 31.499 -2.537 1
1 308 . 17 1 1 A 36 36 ARG N N 36 125.680 120.261 5.419 1
1 309 . 17 1 1 A 37 37 VAL H H 37 8.066 9.041 -0.975 1
1 310 . 17 1 1 A 37 37 VAL HA H 37 4.292 4.473 -0.181 1
1 318 . 17 1 1 A 37 37 VAL C C 37 174.595 174.459 0.136 1
1 319 . 17 1 1 A 37 37 VAL CA C 37 62.727 61.445 1.282 1
1 320 . 17 1 1 A 37 37 VAL CB C 37 31.102 32.917 -1.815 1
1 323 . 17 1 1 A 37 37 VAL N N 37 125.403 121.085 4.318 1
1 324 . 17 1 1 A 38 38 GLU H H 38 9.532 9.208 0.324 1
1 325 . 17 1 1 A 38 38 GLU HA H 38 4.895 5.016 -0.121 1
1 329 . 17 1 1 A 38 38 GLU C C 38 174.509 175.081 -0.572 1
1 330 . 17 1 1 A 38 38 GLU CA C 38 55.650 54.745 0.905 1
1 331 . 17 1 1 A 38 38 GLU CB C 38 32.214 30.717 1.497 1
1 333 . 17 1 1 A 38 38 GLU N N 38 129.885 126.008 3.877 1
1 334 . 17 1 1 A 39 39 VAL H H 39 9.035 8.807 0.228 1
1 335 . 17 1 1 A 39 39 VAL HA H 39 4.446 4.435 0.011 1
1 343 . 17 1 1 A 39 39 VAL C C 39 173.661 174.024 -0.363 1
1 344 . 17 1 1 A 39 39 VAL CA C 39 61.258 61.488 -0.230 1
1 345 . 17 1 1 A 39 39 VAL CB C 39 33.533 32.776 0.757 1
1 348 . 17 1 1 A 39 39 VAL N N 39 127.941 127.027 0.914 1
1 349 . 17 1 1 A 40 40 LEU H H 40 8.843 9.171 -0.328 1
1 350 . 17 1 1 A 40 40 LEU HA H 40 5.130 4.846 0.284 1
1 360 . 17 1 1 A 40 40 LEU C C 40 175.581 175.446 0.135 1
1 361 . 17 1 1 A 40 40 LEU CA C 40 53.702 53.976 -0.274 1
1 362 . 17 1 1 A 40 40 LEU CB C 40 43.989 43.446 0.543 1
1 366 . 17 1 1 A 40 40 LEU N N 40 128.413 129.832 -1.419 1
1 367 . 17 1 1 A 41 41 CYS H H 41 8.959 8.967 -0.008 1
1 368 . 17 1 1 A 41 41 CYS HA H 41 5.174 4.856 0.318 1
1 371 . 17 1 1 A 41 41 CYS C C 41 175.043 174.821 0.222 1
1 372 . 17 1 1 A 41 41 CYS CA C 41 57.483 57.264 0.219 1
1 373 . 17 1 1 A 41 41 CYS CB C 41 28.472 28.967 -0.495 1
1 374 . 17 1 1 A 41 41 CYS N N 41 124.738 127.231 -2.493 1
1 375 . 17 1 1 A 42 42 SER H H 42 9.527 8.973 0.554 1
1 376 . 17 1 1 A 42 42 SER HA H 42 4.149 4.308 -0.159 1
1 379 . 17 1 1 A 42 42 SER C C 42 175.014 174.249 0.765 1
1 380 . 17 1 1 A 42 42 SER CA C 42 59.058 60.437 -1.379 1
1 381 . 17 1 1 A 42 42 SER CB C 42 62.287 62.944 -0.657 1
1 382 . 17 1 1 A 42 42 SER N N 42 125.889 124.748 1.141 1
1 383 . 17 1 1 A 43 43 GLY H H 43 8.685 8.556 0.129 1
1 384 . 17 1 1 A 43 43 GLY HA2 H 43 3.594 4.050 -0.456 1
1 385 . 17 1 1 A 43 43 GLY HA3 H 43 4.210 4.055 0.155 1
1 386 . 17 1 1 A 43 43 GLY C C 43 173.664 173.324 0.340 1
1 387 . 17 1 1 A 43 43 GLY CA C 43 45.404 45.292 0.112 1
1 388 . 17 1 1 A 43 43 GLY N N 43 104.633 108.497 -3.864 1
1 389 . 17 1 1 A 44 44 ARG H H 44 7.926 7.751 0.175 1
1 390 . 17 1 1 A 44 44 ARG HA H 44 4.678 4.846 -0.168 1
1 395 . 17 1 1 A 44 44 ARG C C 44 175.261 175.496 -0.235 1
1 396 . 17 1 1 A 44 44 ARG CA C 44 55.011 54.520 0.491 1
1 397 . 17 1 1 A 44 44 ARG CB C 44 32.138 32.722 -0.584 1
1 400 . 17 1 1 A 44 44 ARG N N 44 121.239 119.930 1.309 1
1 401 . 17 1 1 A 45 45 ARG H H 45 8.775 8.659 0.116 1
1 402 . 17 1 1 A 45 45 ARG HA H 45 5.770 4.863 0.907 1
1 409 . 17 1 1 A 45 45 ARG C C 45 176.064 175.704 0.360 1
1 410 . 17 1 1 A 45 45 ARG CA C 45 54.683 55.460 -0.777 1
1 411 . 17 1 1 A 45 45 ARG CB C 45 33.748 31.422 2.326 1
1 414 . 17 1 1 A 45 45 ARG N N 45 125.948 123.315 2.633 1
1 415 . 17 1 1 A 46 46 HIS H H 46 8.912 8.757 0.155 1
1 416 . 17 1 1 A 46 46 HIS HA H 46 4.927 5.711 -0.784 1
1 420 . 17 1 1 A 46 46 HIS C C 46 172.634 173.192 -0.558 1
1 421 . 17 1 1 A 46 46 HIS CA C 46 56.480 53.721 2.759 1
1 422 . 17 1 1 A 46 46 HIS CB C 46 33.608 32.472 1.136 1
1 423 . 17 1 1 A 46 46 HIS N N 46 121.825 117.645 4.180 1
1 424 . 17 1 1 A 47 47 THR H H 47 8.532 8.965 -0.433 1
1 425 . 17 1 1 A 47 47 THR HA H 47 5.472 4.506 0.966 1
1 430 . 17 1 1 A 47 47 THR C C 47 174.442 174.000 0.442 1
1 431 . 17 1 1 A 47 47 THR CA C 47 61.093 62.776 -1.683 1
1 432 . 17 1 1 A 47 47 THR CB C 47 71.041 69.008 2.033 1
1 434 . 17 1 1 A 47 47 THR N N 47 115.450 120.286 -4.836 1
1 435 . 17 1 1 A 48 48 VAL H H 48 9.695 9.563 0.132 1
1 436 . 17 1 1 A 48 48 VAL HA H 48 4.677 4.511 0.166 1
1 444 . 17 1 1 A 48 48 VAL CA C 48 58.172 59.382 -1.210 1
1 445 . 17 1 1 A 48 48 VAL CB C 48 34.990 32.775 2.215 1
1 448 . 17 1 1 A 48 48 VAL N N 48 126.721 127.346 -0.625 1
1 449 . 17 1 1 A 49 49 PRO HA H 49 5.087 5.198 -0.111 1
1 453 . 17 1 1 A 49 49 PRO CA C 49 61.671 62.393 -0.722 1
1 454 . 17 1 1 A 49 49 PRO CB C 49 31.923 31.784 0.139 1
1 457 . 17 1 1 A 50 50 ARG H H 50 9.125 9.054 0.071 1
1 458 . 17 1 1 A 50 50 ARG HA H 50 4.974 4.605 0.369 1
1 464 . 17 1 1 A 50 50 ARG C C 50 176.187 174.852 1.335 1
1 465 . 17 1 1 A 50 50 ARG CA C 50 53.015 54.238 -1.223 1
1 466 . 17 1 1 A 50 50 ARG CB C 50 36.553 34.473 2.080 1
1 468 . 17 1 1 A 50 50 ARG N N 50 124.189 123.401 0.788 1
1 469 . 17 1 1 A 51 51 ARG H H 51 10.105 9.065 1.040 1
1 470 . 17 1 1 A 51 51 ARG HA H 51 5.196 4.097 1.099 1
1 475 . 17 1 1 A 51 51 ARG C C 51 178.865 177.059 1.806 1
1 476 . 17 1 1 A 51 51 ARG CA C 51 55.961 55.063 0.898 1
1 477 . 17 1 1 A 51 51 ARG CB C 51 32.539 30.730 1.809 1
1 480 . 17 1 1 A 51 51 ARG N N 51 124.521 121.364 3.157 1
1 481 . 17 1 1 A 52 52 TYR H H 52 10.397 8.759 1.638 1
1 482 . 17 1 1 A 52 52 TYR HA H 52 4.360 4.602 -0.242 1
1 487 . 17 1 1 A 52 52 TYR C C 52 178.143 177.768 0.375 1
1 488 . 17 1 1 A 52 52 TYR CA C 52 63.538 60.556 2.982 1
1 489 . 17 1 1 A 52 52 TYR CB C 52 38.784 38.033 0.751 1
1 490 . 17 1 1 A 52 52 TYR N N 52 124.772 122.263 2.509 1
1 491 . 17 1 1 A 53 53 SER H H 53 9.231 7.904 1.327 1
1 492 . 17 1 1 A 53 53 SER HA H 53 4.175 4.267 -0.092 1
1 493 . 17 1 1 A 53 53 SER C C 53 177.220 176.584 0.636 1
1 494 . 17 1 1 A 53 53 SER CA C 53 61.606 61.951 -0.345 1
1 495 . 17 1 1 A 53 53 SER N N 53 113.262 117.142 -3.880 1
1 496 . 17 1 1 A 54 54 GLU H H 54 7.807 7.286 0.521 1
1 497 . 17 1 1 A 54 54 GLU HA H 54 4.392 3.863 0.529 1
1 501 . 17 1 1 A 54 54 GLU C C 54 180.361 178.568 1.793 1
1 502 . 17 1 1 A 54 54 GLU CA C 54 59.497 58.884 0.613 1
1 503 . 17 1 1 A 54 54 GLU CB C 54 30.708 29.162 1.546 1
1 504 . 17 1 1 A 54 54 GLU N N 54 121.949 121.601 0.348 1
1 505 . 17 1 1 A 55 55 PHE H H 55 8.133 7.789 0.344 1
1 506 . 17 1 1 A 55 55 PHE HA H 55 4.007 4.299 -0.292 1
1 513 . 17 1 1 A 55 55 PHE C C 55 176.531 177.822 -1.291 1
1 514 . 17 1 1 A 55 55 PHE CA C 55 61.848 61.470 0.378 1
1 515 . 17 1 1 A 55 55 PHE CB C 55 38.847 39.230 -0.383 1
1 516 . 17 1 1 A 55 55 PHE N N 55 119.998 121.025 -1.027 1
1 517 . 17 1 1 A 56 56 HIS H H 56 7.907 8.593 -0.686 1
1 518 . 17 1 1 A 56 56 HIS HA H 56 3.324 4.329 -1.005 1
1 522 . 17 1 1 A 56 56 HIS C C 56 176.748 177.657 -0.909 1
1 523 . 17 1 1 A 56 56 HIS CA C 56 58.770 58.692 0.078 1
1 524 . 17 1 1 A 56 56 HIS CB C 56 30.404 28.770 1.634 1
1 525 . 17 1 1 A 56 56 HIS N N 56 119.173 117.205 1.968 1
1 526 . 17 1 1 A 57 57 ALA H H 57 7.962 7.643 0.319 1
1 527 . 17 1 1 A 57 57 ALA HA H 57 3.865 3.853 0.012 1
1 531 . 17 1 1 A 57 57 ALA C C 57 180.075 179.500 0.575 1
1 532 . 17 1 1 A 57 57 ALA CA C 57 54.996 55.092 -0.096 1
1 533 . 17 1 1 A 57 57 ALA CB C 57 18.226 18.518 -0.292 1
1 534 . 17 1 1 A 57 57 ALA N N 57 120.094 123.486 -3.392 1
1 535 . 17 1 1 A 58 58 LEU H H 58 7.295 7.877 -0.582 1
1 536 . 17 1 1 A 58 58 LEU HA H 58 3.994 3.935 0.059 1
1 546 . 17 1 1 A 58 58 LEU C C 58 177.428 178.556 -1.128 1
1 547 . 17 1 1 A 58 58 LEU CA C 58 58.342 57.882 0.460 1
1 548 . 17 1 1 A 58 58 LEU CB C 58 40.851 41.095 -0.244 1
1 552 . 17 1 1 A 58 58 LEU N N 58 119.404 117.393 2.011 1
1 553 . 17 1 1 A 59 59 HIS H H 59 7.805 8.249 -0.444 1
1 554 . 17 1 1 A 59 59 HIS HA H 59 4.286 3.824 0.462 1
1 558 . 17 1 1 A 59 59 HIS C C 59 177.001 177.313 -0.312 1
1 559 . 17 1 1 A 59 59 HIS CA C 59 60.141 59.989 0.152 1
1 560 . 17 1 1 A 59 59 HIS CB C 59 31.072 29.300 1.772 1
1 561 . 17 1 1 A 59 59 HIS N N 59 119.040 120.068 -1.028 1
1 562 . 17 1 1 A 60 60 LYS H H 60 7.715 8.160 -0.445 1
1 563 . 17 1 1 A 60 60 LYS HA H 60 3.456 3.547 -0.091 1
1 570 . 17 1 1 A 60 60 LYS C C 60 178.464 178.549 -0.085 1
1 571 . 17 1 1 A 60 60 LYS CA C 60 59.629 58.668 0.961 1
1 572 . 17 1 1 A 60 60 LYS CB C 60 32.354 31.677 0.677 1
1 576 . 17 1 1 A 60 60 LYS N N 60 114.225 117.745 -3.520 1
1 577 . 17 1 1 A 61 61 ARG H H 61 7.486 7.430 0.056 1
1 578 . 17 1 1 A 61 61 ARG HA H 61 4.202 4.038 0.164 1
1 584 . 17 1 1 A 61 61 ARG C C 61 178.995 178.689 0.306 1
1 585 . 17 1 1 A 61 61 ARG CA C 61 58.387 58.369 0.018 1
1 586 . 17 1 1 A 61 61 ARG CB C 61 31.216 29.863 1.353 1
1 589 . 17 1 1 A 61 61 ARG N N 61 115.929 119.161 -3.232 1
1 590 . 17 1 1 A 62 62 ILE H H 62 8.066 7.918 0.148 1
1 591 . 17 1 1 A 62 62 ILE HA H 62 4.491 3.886 0.605 1
1 601 . 17 1 1 A 62 62 ILE C C 62 177.838 177.173 0.665 1
1 602 . 17 1 1 A 62 62 ILE CA C 62 63.399 63.911 -0.512 1
1 603 . 17 1 1 A 62 62 ILE CB C 62 39.699 37.342 2.357 1
1 606 . 17 1 1 A 62 62 ILE N N 62 111.456 118.153 -6.697 1
1 607 . 17 1 1 A 63 63 LYS H H 63 8.158 8.268 -0.110 1
1 608 . 17 1 1 A 63 63 LYS HA H 63 4.136 3.801 0.335 1
1 615 . 17 1 1 A 63 63 LYS C C 63 176.358 177.558 -1.200 1
1 616 . 17 1 1 A 63 63 LYS CA C 63 58.753 58.491 0.262 1
1 617 . 17 1 1 A 63 63 LYS CB C 63 30.825 31.089 -0.264 1
1 621 . 17 1 1 A 63 63 LYS N N 63 120.800 123.155 -2.355 1
1 622 . 17 1 1 A 64 64 LYS H H 64 7.687 7.724 -0.037 1
1 623 . 17 1 1 A 64 64 LYS HA H 64 4.301 4.085 0.216 1
1 628 . 17 1 1 A 64 64 LYS C C 64 177.084 177.957 -0.873 1
1 629 . 17 1 1 A 64 64 LYS CA C 64 57.237 58.102 -0.865 1
1 630 . 17 1 1 A 64 64 LYS CB C 64 32.502 32.565 -0.063 1
1 634 . 17 1 1 A 64 64 LYS N N 64 116.548 118.163 -1.615 1
1 635 . 17 1 1 A 65 65 LEU H H 65 7.476 7.914 -0.438 1
1 636 . 17 1 1 A 65 65 LEU HA H 65 4.219 4.347 -0.128 1
1 645 . 17 1 1 A 65 65 LEU C C 65 175.886 175.948 -0.062 1
1 646 . 17 1 1 A 65 65 LEU CA C 65 55.542 56.742 -1.200 1
1 647 . 17 1 1 A 65 65 LEU CB C 65 45.493 43.614 1.879 1
1 650 . 17 1 1 A 65 65 LEU N N 65 118.000 120.511 -2.511 1
1 651 . 17 1 1 A 66 66 TYR H H 66 7.672 8.451 -0.779 1
1 652 . 17 1 1 A 66 66 TYR HA H 66 4.762 5.187 -0.425 1
1 660 . 17 1 1 A 66 66 TYR C C 66 174.199 174.564 -0.365 1
1 661 . 17 1 1 A 66 66 TYR CA C 66 56.013 55.294 0.719 1
1 662 . 17 1 1 A 66 66 TYR CB C 66 40.380 40.992 -0.612 1
1 663 . 17 1 1 A 66 66 TYR N N 66 116.805 114.101 2.704 1
1 664 . 17 1 1 A 67 67 LYS H H 67 8.547 8.494 0.053 1
1 665 . 17 1 1 A 67 67 LYS HA H 67 4.436 4.438 -0.002 1
1 670 . 17 1 1 A 67 67 LYS C C 67 175.727 175.825 -0.098 1
1 671 . 17 1 1 A 67 67 LYS CA C 67 56.598 56.510 0.088 1
1 672 . 17 1 1 A 67 67 LYS CB C 67 32.743 32.654 0.089 1
1 676 . 17 1 1 A 67 67 LYS N N 67 120.929 120.080 0.849 1
1 677 . 17 1 1 A 68 68 VAL H H 68 8.168 8.294 -0.126 1
1 678 . 17 1 1 A 68 68 VAL HA H 68 4.869 4.514 0.355 1
1 686 . 17 1 1 A 68 68 VAL CA C 68 57.389 59.099 -1.710 1
1 687 . 17 1 1 A 68 68 VAL CB C 68 34.017 34.682 -0.665 1
1 690 . 17 1 1 A 68 68 VAL N N 68 116.467 124.082 -7.615 1
1 691 . 17 1 1 A 69 69 PRO HA H 69 4.674 4.726 -0.052 1
1 696 . 17 1 1 A 69 69 PRO C C 69 178.013 176.286 1.727 1
1 697 . 17 1 1 A 69 69 PRO CA C 69 61.443 62.492 -1.049 1
1 698 . 17 1 1 A 69 69 PRO CB C 69 32.231 33.283 -1.052 1
1 701 . 17 1 1 A 70 70 ASP H H 70 8.167 8.579 -0.412 1
1 702 . 17 1 1 A 70 70 ASP HA H 70 4.531 4.703 -0.172 1
1 705 . 17 1 1 A 70 70 ASP C C 70 175.660 176.543 -0.883 1
1 706 . 17 1 1 A 70 70 ASP CA C 70 55.148 55.086 0.062 1
1 707 . 17 1 1 A 70 70 ASP CB C 70 40.876 41.028 -0.152 1
1 708 . 17 1 1 A 70 70 ASP N N 70 116.671 121.636 -4.965 1
1 709 . 17 1 1 A 71 71 PHE H H 71 8.387 8.510 -0.123 1
1 710 . 17 1 1 A 71 71 PHE HA H 71 4.076 4.842 -0.766 1
1 717 . 17 1 1 A 71 71 PHE CA C 71 55.672 54.794 0.878 1
1 718 . 17 1 1 A 71 71 PHE CB C 71 39.155 42.064 -2.909 1
1 719 . 17 1 1 A 71 71 PHE N N 71 126.533 118.319 8.214 1
1 720 . 17 1 1 A 72 72 PRO HA H 72 4.156 4.534 -0.378 1
1 727 . 17 1 1 A 72 72 PRO CA C 72 63.079 62.644 0.435 1
1 728 . 17 1 1 A 72 72 PRO CB C 72 32.107 32.401 -0.294 1
1 731 . 17 1 1 A 73 73 SER H H 73 8.468 8.436 0.032 1
1 733 . 17 1 1 A 73 73 SER CA C 73 56.133 56.623 -0.490 1
1 734 . 17 1 1 A 73 73 SER CB C 73 63.991 65.264 -1.273 1
1 735 . 17 1 1 A 73 73 SER N N 73 121.533 117.318 4.215 1
1 736 . 17 1 1 A 74 74 LYS HA H 74 4.574 4.016 0.558 1
1 739 . 17 1 1 A 74 74 LYS CA C 74 55.659 58.295 -2.636 1
1 740 . 17 1 1 A 74 74 LYS CB C 74 30.550 31.805 -1.255 1
1 741 . 17 1 1 A 75 75 ARG H H 75 7.962 7.517 0.445 1
1 742 . 17 1 1 A 75 75 ARG HA H 75 4.162 4.629 -0.467 1
1 746 . 17 1 1 A 75 75 ARG CA C 75 56.123 55.699 0.424 1
1 747 . 17 1 1 A 75 75 ARG CB C 75 31.179 31.454 -0.275 1
1 749 . 17 1 1 A 75 75 ARG N N 75 121.665 121.637 0.028 1
1 750 . 17 1 1 A 76 76 LEU H H 76 8.071 8.173 -0.102 1
1 751 . 17 1 1 A 76 76 LEU HA H 76 4.618 4.579 0.039 1
1 759 . 17 1 1 A 76 76 LEU CA C 76 52.764 51.272 1.492 1
1 760 . 17 1 1 A 76 76 LEU CB C 76 41.918 44.362 -2.444 1
1 762 . 17 1 1 A 76 76 LEU N N 76 124.196 127.623 -3.427 1
1 763 . 17 1 1 A 77 77 PRO HA H 77 4.393 4.253 0.140 1
1 767 . 17 1 1 A 77 77 PRO CA C 77 63.746 62.474 1.272 1
1 770 . 17 1 1 A 78 78 ASN H H 78 8.379 8.714 -0.335 1
1 771 . 17 1 1 A 78 78 ASN HA H 78 4.586 4.349 0.237 1
1 776 . 17 1 1 A 78 78 ASN C C 78 175.648 174.814 0.834 1
1 777 . 17 1 1 A 78 78 ASN CA C 78 53.591 52.950 0.641 1
1 778 . 17 1 1 A 78 78 ASN CB C 78 37.826 38.757 -0.931 1
1 779 . 17 1 1 A 78 78 ASN N N 78 115.292 121.605 -6.313 1
1 781 . 17 1 1 A 79 79 TRP H H 79 7.900 7.785 0.115 1
1 782 . 17 1 1 A 79 79 TRP HA H 79 4.326 4.318 0.008 1
1 788 . 17 1 1 A 79 79 TRP CA C 79 58.825 58.674 0.151 1
1 789 . 17 1 1 A 79 79 TRP CB C 79 29.090 26.534 2.556 1
1 790 . 17 1 1 A 79 79 TRP N N 79 119.525 118.249 1.276 1
1 792 . 17 1 1 A 80 80 ARG H H 80 8.060 8.082 -0.022 1
1 793 . 17 1 1 A 80 80 ARG HA H 80 3.913 4.227 -0.314 1
1 798 . 17 1 1 A 80 80 ARG C C 80 177.024 178.159 -1.135 1
1 799 . 17 1 1 A 80 80 ARG CA C 80 58.292 58.956 -0.664 1
1 800 . 17 1 1 A 80 80 ARG CB C 80 30.146 30.804 -0.658 1
1 803 . 17 1 1 A 80 80 ARG N N 80 118.864 120.502 -1.638 1
1 804 . 17 1 1 A 81 81 THR H H 81 7.725 7.463 0.262 1
1 805 . 17 1 1 A 81 81 THR HA H 81 4.297 4.615 -0.318 1
1 809 . 17 1 1 A 81 81 THR CA C 81 62.481 62.042 0.439 1
1 811 . 17 1 1 A 81 81 THR N N 81 109.863 106.447 3.416 1
1 812 . 17 1 1 A 82 82 ARG HA H 82 4.341 5.041 -0.700 1
1 816 . 17 1 1 A 82 82 ARG C C 82 177.261 174.802 2.459 1
1 817 . 17 1 1 A 82 82 ARG CA C 82 56.846 54.137 2.709 1
1 818 . 17 1 1 A 82 82 ARG CB C 82 30.288 33.980 -3.692 1
1 820 . 17 1 1 A 83 83 GLY H H 83 8.321 8.673 -0.352 1
1 821 . 17 1 1 A 83 83 GLY HA2 H 83 3.957 4.112 -0.155 1
1 822 . 17 1 1 A 83 83 GLY C C 83 175.185 174.759 0.426 1
1 823 . 17 1 1 A 83 83 GLY CA C 83 46.297 44.504 1.793 1
1 824 . 17 1 1 A 83 83 GLY N N 83 109.146 112.956 -3.810 1
1 825 . 17 1 1 A 84 84 LEU H H 84 8.303 8.642 -0.339 1
1 826 . 17 1 1 A 84 84 LEU HA H 84 4.018 3.927 0.091 1
1 835 . 17 1 1 A 84 84 LEU C C 84 178.552 178.015 0.537 1
1 836 . 17 1 1 A 84 84 LEU CA C 84 58.236 56.049 2.187 1
1 837 . 17 1 1 A 84 84 LEU CB C 84 41.837 41.844 -0.007 1
1 840 . 17 1 1 A 84 84 LEU N N 84 122.662 119.519 3.143 1
1 841 . 17 1 1 A 85 85 GLU H H 85 8.233 8.028 0.205 1
1 842 . 17 1 1 A 85 85 GLU HA H 85 4.371 3.914 0.457 1
1 846 . 17 1 1 A 85 85 GLU C C 85 178.555 179.126 -0.571 1
1 847 . 17 1 1 A 85 85 GLU CA C 85 58.377 59.863 -1.486 1
1 848 . 17 1 1 A 85 85 GLU CB C 85 28.675 29.242 -0.567 1
1 850 . 17 1 1 A 85 85 GLU N N 85 119.781 119.834 -0.053 1
1 851 . 17 1 1 A 86 86 GLN H H 86 7.877 7.880 -0.003 1
1 852 . 17 1 1 A 86 86 GLN HA H 86 4.100 3.967 0.133 1
1 858 . 17 1 1 A 86 86 GLN C C 86 179.557 178.129 1.428 1
1 859 . 17 1 1 A 86 86 GLN CA C 86 58.955 59.150 -0.195 1
1 860 . 17 1 1 A 86 86 GLN CB C 86 28.191 28.449 -0.258 1
1 862 . 17 1 1 A 86 86 GLN N N 86 118.042 119.569 -1.527 1
1 863 . 17 1 1 A 87 87 ARG H H 87 8.169 7.911 0.258 1
1 864 . 17 1 1 A 87 87 ARG HA H 87 3.975 4.004 -0.029 1
1 868 . 17 1 1 A 87 87 ARG C C 87 177.051 178.340 -1.289 1
1 869 . 17 1 1 A 87 87 ARG CA C 87 59.006 59.521 -0.515 1
1 870 . 17 1 1 A 87 87 ARG CB C 87 30.383 29.782 0.601 1
1 872 . 17 1 1 A 87 87 ARG N N 87 121.381 119.815 1.566 1
1 873 . 17 1 1 A 88 88 ARG H H 88 8.593 8.242 0.351 1
1 874 . 17 1 1 A 88 88 ARG HA H 88 3.726 3.834 -0.108 1
1 876 . 17 1 1 A 88 88 ARG C C 88 177.520 178.316 -0.796 1
1 877 . 17 1 1 A 88 88 ARG CA C 88 60.751 58.894 1.857 1
1 878 . 17 1 1 A 88 88 ARG CB C 88 30.153 30.011 0.142 1
1 879 . 17 1 1 A 88 88 ARG N N 88 120.863 117.773 3.090 1
1 880 . 17 1 1 A 89 89 GLN H H 89 8.355 7.617 0.738 1
1 881 . 17 1 1 A 89 89 GLN HA H 89 3.887 3.924 -0.037 1
1 887 . 17 1 1 A 89 89 GLN C C 89 179.499 178.397 1.102 1
1 888 . 17 1 1 A 89 89 GLN CA C 89 59.603 59.345 0.258 1
1 889 . 17 1 1 A 89 89 GLN CB C 89 28.464 28.016 0.448 1
1 891 . 17 1 1 A 89 89 GLN N N 89 116.860 119.182 -2.322 1
1 893 . 17 1 1 A 90 90 GLY H H 90 8.406 8.763 -0.357 1
1 894 . 17 1 1 A 90 90 GLY HA2 H 90 3.672 3.699 -0.027 1
1 895 . 17 1 1 A 90 90 GLY HA3 H 90 3.871 3.709 0.162 1
1 896 . 17 1 1 A 90 90 GLY C C 90 177.033 175.628 1.405 1
1 897 . 17 1 1 A 90 90 GLY CA C 90 46.813 47.153 -0.340 1
1 898 . 17 1 1 A 90 90 GLY N N 90 107.679 107.582 0.097 1
1 899 . 17 1 1 A 91 91 LEU H H 91 8.504 7.911 0.593 1
1 900 . 17 1 1 A 91 91 LEU HA H 91 3.784 3.879 -0.095 1
1 910 . 17 1 1 A 91 91 LEU C C 91 178.003 179.028 -1.025 1
1 911 . 17 1 1 A 91 91 LEU CA C 91 57.354 57.596 -0.242 1
1 912 . 17 1 1 A 91 91 LEU CB C 91 40.359 41.212 -0.853 1
1 916 . 17 1 1 A 91 91 LEU N N 91 123.959 121.369 2.590 1
1 917 . 17 1 1 A 92 92 GLU H H 92 8.324 8.287 0.037 1
1 918 . 17 1 1 A 92 92 GLU HA H 92 3.732 3.778 -0.046 1
1 922 . 17 1 1 A 92 92 GLU C C 92 177.272 178.451 -1.179 1
1 923 . 17 1 1 A 92 92 GLU CA C 92 60.651 59.569 1.082 1
1 924 . 17 1 1 A 92 92 GLU CB C 92 30.843 29.246 1.597 1
1 926 . 17 1 1 A 92 92 GLU N N 92 121.991 120.701 1.290 1
1 927 . 17 1 1 A 93 93 ALA H H 93 8.126 7.858 0.268 1
1 928 . 17 1 1 A 93 93 ALA HA H 93 4.160 4.129 0.031 1
1 932 . 17 1 1 A 93 93 ALA C C 93 180.818 179.622 1.196 1
1 933 . 17 1 1 A 93 93 ALA CA C 93 54.828 54.894 -0.066 1
1 934 . 17 1 1 A 93 93 ALA CB C 93 18.032 18.285 -0.253 1
1 935 . 17 1 1 A 93 93 ALA N N 93 120.066 122.181 -2.115 1
1 936 . 17 1 1 A 94 94 TYR H H 94 7.916 7.576 0.340 1
1 937 . 17 1 1 A 94 94 TYR HA H 94 4.139 4.293 -0.154 1
1 942 . 17 1 1 A 94 94 TYR C C 94 175.895 177.152 -1.257 1
1 943 . 17 1 1 A 94 94 TYR CA C 94 61.915 61.394 0.521 1
1 944 . 17 1 1 A 94 94 TYR CB C 94 38.740 38.530 0.210 1
1 945 . 17 1 1 A 94 94 TYR N N 94 121.179 119.957 1.222 1
1 946 . 17 1 1 A 95 95 ILE H H 95 7.983 8.444 -0.461 1
1 947 . 17 1 1 A 95 95 ILE HA H 95 3.614 3.627 -0.013 1
1 957 . 17 1 1 A 95 95 ILE C C 95 174.678 178.150 -3.472 1
1 958 . 17 1 1 A 95 95 ILE CA C 95 63.461 64.733 -1.272 1
1 959 . 17 1 1 A 95 95 ILE CB C 95 36.625 36.639 -0.014 1
1 963 . 17 1 1 A 95 95 ILE N N 95 116.397 119.807 -3.410 1
1 964 . 17 1 1 A 96 96 GLN H H 96 8.175 8.749 -0.574 1
1 965 . 17 1 1 A 96 96 GLN HA H 96 3.763 4.016 -0.253 1
1 970 . 17 1 1 A 96 96 GLN C C 96 179.042 178.542 0.500 1
1 971 . 17 1 1 A 96 96 GLN CA C 96 59.270 59.894 -0.624 1
1 972 . 17 1 1 A 96 96 GLN CB C 96 27.696 27.931 -0.235 1
1 974 . 17 1 1 A 96 96 GLN N N 96 116.631 120.489 -3.858 1
1 976 . 17 1 1 A 97 97 GLY H H 97 8.222 8.207 0.015 1
1 977 . 17 1 1 A 97 97 GLY HA2 H 97 3.661 3.663 -0.002 1
1 978 . 17 1 1 A 97 97 GLY HA3 H 97 3.806 3.700 0.106 1
1 979 . 17 1 1 A 97 97 GLY C C 97 175.449 176.035 -0.586 1
1 980 . 17 1 1 A 97 97 GLY CA C 97 46.917 47.333 -0.416 1
1 981 . 17 1 1 A 97 97 GLY N N 97 107.315 106.954 0.361 1
1 982 . 17 1 1 A 98 98 ILE H H 98 7.630 8.059 -0.429 1
1 983 . 17 1 1 A 98 98 ILE HA H 98 3.399 3.923 -0.524 1
1 993 . 17 1 1 A 98 98 ILE C C 98 178.683 177.821 0.862 1
1 994 . 17 1 1 A 98 98 ILE CA C 98 66.402 64.626 1.776 1
1 995 . 17 1 1 A 98 98 ILE CB C 98 38.037 37.555 0.482 1
1 999 . 17 1 1 A 98 98 ILE N N 98 120.644 120.531 0.113 1
1 1000 . 17 1 1 A 99 99 LEU H H 99 7.076 7.814 -0.738 1
1 1001 . 17 1 1 A 99 99 LEU HA H 99 4.133 4.436 -0.303 1
1 1010 . 17 1 1 A 99 99 LEU C C 99 178.128 177.640 0.488 1
1 1011 . 17 1 1 A 99 99 LEU CA C 99 57.129 57.764 -0.635 1
1 1012 . 17 1 1 A 99 99 LEU CB C 99 41.108 41.488 -0.380 1
1 1014 . 17 1 1 A 99 99 LEU N N 99 116.844 123.937 -7.093 1
1 1015 . 17 1 1 A 100 100 TYR H H 100 7.890 7.976 -0.086 1
1 1016 . 17 1 1 A 100 100 TYR HA H 100 4.550 4.334 0.216 1
1 1021 . 17 1 1 A 100 100 TYR C C 100 178.210 177.893 0.317 1
1 1022 . 17 1 1 A 100 100 TYR CA C 100 59.452 59.842 -0.390 1
1 1023 . 17 1 1 A 100 100 TYR CB C 100 38.786 39.119 -0.333 1
1 1024 . 17 1 1 A 100 100 TYR N N 100 116.427 120.331 -3.904 1
1 1025 . 17 1 1 A 101 101 LEU H H 101 8.041 7.825 0.216 1
1 1026 . 17 1 1 A 101 101 LEU HA H 101 4.158 4.142 0.016 1
1 1036 . 17 1 1 A 101 101 LEU C C 101 176.808 177.372 -0.564 1
1 1037 . 17 1 1 A 101 101 LEU CA C 101 56.156 58.135 -1.979 1
1 1038 . 17 1 1 A 101 101 LEU CB C 101 44.307 42.404 1.903 1
1 1041 . 17 1 1 A 101 101 LEU N N 101 116.493 120.532 -4.039 1
1 1042 . 17 1 1 A 102 102 ASN H H 102 7.146 7.826 -0.680 1
1 1043 . 17 1 1 A 102 102 ASN HA H 102 5.056 5.050 0.006 1
1 1046 . 17 1 1 A 102 102 ASN CA C 102 52.704 54.736 -2.032 1
1 1047 . 17 1 1 A 102 102 ASN CB C 102 42.424 40.514 1.910 1
1 1048 . 17 1 1 A 102 102 ASN N N 102 114.922 113.602 1.320 1
1 1049 . 17 1 1 A 103 103 GLN H H 103 8.477 7.600 0.877 1
1 1050 . 17 1 1 A 103 103 GLN HA H 103 3.866 4.163 -0.297 1
1 1054 . 17 1 1 A 103 103 GLN C C 103 176.110 175.391 0.719 1
1 1055 . 17 1 1 A 103 103 GLN CA C 103 58.451 55.852 2.599 1
1 1056 . 17 1 1 A 103 103 GLN CB C 103 28.896 28.296 0.600 1
1 1058 . 17 1 1 A 103 103 GLN N N 103 120.252 119.062 1.190 1
1 1059 . 17 1 1 A 104 104 GLU H H 104 7.930 8.102 -0.172 1
1 1060 . 17 1 1 A 104 104 GLU HA H 104 4.591 5.172 -0.581 1
1 1064 . 17 1 1 A 104 104 GLU C C 104 175.397 175.639 -0.242 1
1 1065 . 17 1 1 A 104 104 GLU CA C 104 54.058 58.277 -4.219 1
1 1066 . 17 1 1 A 104 104 GLU CB C 104 31.272 28.876 2.396 1
1 1068 . 17 1 1 A 104 104 GLU N N 104 117.295 119.410 -2.115 1
1 1069 . 17 1 1 A 105 105 VAL H H 105 8.546 8.237 0.309 1
1 1070 . 17 1 1 A 105 105 VAL HA H 105 3.823 4.347 -0.524 1
1 1078 . 17 1 1 A 105 105 VAL CA C 105 60.706 60.214 0.492 1
1 1079 . 17 1 1 A 105 105 VAL CB C 105 32.126 32.529 -0.403 1
1 1082 . 17 1 1 A 105 105 VAL N N 105 124.511 125.094 -0.583 1
1 1083 . 17 1 1 A 106 106 PRO HA H 106 3.997 4.622 -0.625 1
1 1089 . 17 1 1 A 106 106 PRO C C 106 178.240 177.786 0.454 1
1 1090 . 17 1 1 A 106 106 PRO CA C 106 62.961 63.419 -0.458 1
1 1091 . 17 1 1 A 106 106 PRO CB C 106 32.321 32.341 -0.020 1
1 1094 . 17 1 1 A 107 107 LYS H H 107 9.122 8.951 0.171 1
1 1095 . 17 1 1 A 107 107 LYS HA H 107 3.813 3.962 -0.149 1
1 1101 . 17 1 1 A 107 107 LYS C C 107 178.563 177.704 0.859 1
1 1102 . 17 1 1 A 107 107 LYS CA C 107 60.085 59.506 0.579 1
1 1103 . 17 1 1 A 107 107 LYS CB C 107 31.632 32.271 -0.639 1
1 1106 . 17 1 1 A 107 107 LYS N N 107 129.017 124.948 4.069 1
1 1107 . 17 1 1 A 108 108 GLU H H 108 10.370 7.899 2.471 1
1 1108 . 17 1 1 A 108 108 GLU HA H 108 3.991 4.224 -0.233 1
1 1111 . 17 1 1 A 108 108 GLU C C 108 180.366 178.880 1.486 1
1 1112 . 17 1 1 A 108 108 GLU CA C 108 60.337 59.146 1.191 1
1 1113 . 17 1 1 A 108 108 GLU CB C 108 29.178 29.118 0.060 1
1 1115 . 17 1 1 A 108 108 GLU N N 108 118.335 118.732 -0.397 1
1 1116 . 17 1 1 A 109 109 LEU H H 109 7.393 7.947 -0.554 1
1 1117 . 17 1 1 A 109 109 LEU HA H 109 4.220 4.201 0.019 1
1 1126 . 17 1 1 A 109 109 LEU C C 109 177.378 178.263 -0.885 1
1 1127 . 17 1 1 A 109 109 LEU CA C 109 56.618 57.692 -1.074 1
1 1128 . 17 1 1 A 109 109 LEU CB C 109 41.898 42.007 -0.109 1
1 1131 . 17 1 1 A 109 109 LEU N N 109 118.285 120.780 -2.495 1
1 1132 . 17 1 1 A 110 110 LEU H H 110 7.641 7.910 -0.269 1
1 1133 . 17 1 1 A 110 110 LEU HA H 110 3.796 3.980 -0.184 1
1 1142 . 17 1 1 A 110 110 LEU C C 110 179.103 178.280 0.823 1
1 1143 . 17 1 1 A 110 110 LEU CA C 110 59.046 58.400 0.646 1
1 1144 . 17 1 1 A 110 110 LEU CB C 110 40.228 41.387 -1.159 1
1 1147 . 17 1 1 A 110 110 LEU N N 110 120.162 119.969 0.193 1
1 1148 . 17 1 1 A 111 111 GLU H H 111 7.916 8.264 -0.348 1
1 1149 . 17 1 1 A 111 111 GLU HA H 111 4.080 4.116 -0.036 1
1 1153 . 17 1 1 A 111 111 GLU C C 111 179.967 178.786 1.181 1
1 1154 . 17 1 1 A 111 111 GLU CA C 111 59.243 58.964 0.279 1
1 1155 . 17 1 1 A 111 111 GLU CB C 111 29.576 29.377 0.199 1
1 1157 . 17 1 1 A 111 111 GLU N N 111 117.360 118.399 -1.039 1
1 1158 . 17 1 1 A 112 112 PHE H H 112 7.712 8.034 -0.322 1
1 1159 . 17 1 1 A 112 112 PHE HA H 112 4.224 4.181 0.043 1
1 1164 . 17 1 1 A 112 112 PHE C C 112 177.180 177.040 0.140 1
1 1165 . 17 1 1 A 112 112 PHE CA C 112 61.407 61.141 0.266 1
1 1166 . 17 1 1 A 112 112 PHE CB C 112 40.172 39.524 0.648 1
1 1167 . 17 1 1 A 112 112 PHE N N 112 123.042 120.824 2.218 1
1 1168 . 17 1 1 A 113 113 LEU H H 113 8.056 7.728 0.328 1
1 1169 . 17 1 1 A 113 113 LEU HA H 113 4.147 4.283 -0.136 1
1 1175 . 17 1 1 A 113 113 LEU C C 113 173.717 176.061 -2.344 1
1 1176 . 17 1 1 A 113 113 LEU CA C 113 54.093 54.403 -0.310 1
1 1177 . 17 1 1 A 113 113 LEU CB C 113 41.517 42.014 -0.497 1
1 1179 . 17 1 1 A 113 113 LEU N N 113 115.595 117.241 -1.646 1
1 1180 . 17 1 1 A 114 114 ARG H H 114 7.902 8.013 -0.111 1
1 1181 . 17 1 1 A 114 114 ARG HA H 114 3.817 4.064 -0.247 1
1 1182 . 17 1 1 A 114 114 ARG C C 114 174.566 176.454 -1.888 1
1 1183 . 17 1 1 A 114 114 ARG CA C 114 57.233 57.121 0.112 1
1 1184 . 17 1 1 A 114 114 ARG CB C 114 27.788 28.815 -1.027 1
1 1185 . 17 1 1 A 114 114 ARG N N 114 116.021 118.795 -2.774 1
1 1186 . 17 1 1 A 115 115 LEU H H 115 8.160 7.980 0.180 1
1 1187 . 17 1 1 A 115 115 LEU HA H 115 4.462 4.383 0.079 1
1 1195 . 17 1 1 A 115 115 LEU C C 115 176.374 176.558 -0.184 1
1 1196 . 17 1 1 A 115 115 LEU CA C 115 53.965 55.045 -1.080 1
1 1197 . 17 1 1 A 115 115 LEU CB C 115 44.077 41.001 3.076 1
1 1199 . 17 1 1 A 115 115 LEU N N 115 118.089 119.127 -1.038 1
1 1200 . 17 1 1 A 116 116 ARG H H 116 8.066 7.632 0.434 1
1 1201 . 17 1 1 A 116 116 ARG HA H 116 4.172 4.502 -0.330 1
1 1203 . 17 1 1 A 116 116 ARG CA C 116 55.961 56.158 -0.197 1
1 1204 . 17 1 1 A 116 116 ARG CB C 116 31.379 30.828 0.551 1
1 1205 . 17 1 1 A 116 116 ARG N N 116 120.852 118.173 2.679 1
1 1206 . 17 1 1 A 117 117 HIS H H 117 7.928 9.052 -1.124 1
1 1207 . 17 1 1 A 117 117 HIS HA H 117 4.557 4.171 0.386 1
1 1211 . 17 1 1 A 117 117 HIS CA C 117 55.937 56.826 -0.889 1
1 1212 . 17 1 1 A 117 117 HIS CB C 117 30.875 28.821 2.054 1
1 1213 . 17 1 1 A 118 118 PHE H H 118 8.183 8.047 0.136 1
1 1214 . 17 1 1 A 118 118 PHE HA H 118 4.730 4.360 0.370 1
1 1219 . 17 1 1 A 118 118 PHE CA C 118 55.716 57.184 -1.468 1
1 1220 . 17 1 1 A 118 118 PHE CB C 118 39.263 39.623 -0.360 1
1 1221 . 17 1 1 A 118 118 PHE N N 118 123.480 120.316 3.164 1
1 1222 . 17 1 1 A 119 119 PRO HA H 119 4.398 4.510 -0.112 1
1 1227 . 17 1 1 A 119 119 PRO C C 119 176.666 176.670 -0.004 1
1 1228 . 17 1 1 A 119 119 PRO CA C 119 63.377 62.252 1.125 1
1 1229 . 17 1 1 A 119 119 PRO CB C 119 32.059 32.578 -0.519 1
1 1232 . 17 1 1 A 120 120 THR H H 120 8.054 8.340 -0.286 1
1 1233 . 17 1 1 A 120 120 THR HA H 120 4.273 4.771 -0.498 1
1 1238 . 17 1 1 A 120 120 THR C C 120 174.154 173.113 1.041 1
1 1239 . 17 1 1 A 120 120 THR CA C 120 61.893 60.908 0.985 1
1 1240 . 17 1 1 A 120 120 THR CB C 120 69.736 69.927 -0.191 1
1 1242 . 17 1 1 A 120 120 THR N N 120 113.088 112.014 1.074 1
1 1243 . 17 1 1 A 121 121 ASP H H 121 8.209 8.728 -0.519 1
1 1244 . 17 1 1 A 121 121 ASP HA H 121 4.876 4.996 -0.120 1
1 1247 . 17 1 1 A 121 121 ASP CA C 121 52.126 51.037 1.089 1
1 1248 . 17 1 1 A 121 121 ASP CB C 121 41.553 42.077 -0.524 1
1 1249 . 17 1 1 A 121 121 ASP N N 121 123.630 126.512 -2.882 1
1 1250 . 17 1 1 A 122 122 PRO HA H 122 4.363 4.837 -0.474 1
1 1255 . 17 1 1 A 122 122 PRO C C 122 177.344 175.498 1.846 1
1 1256 . 17 1 1 A 122 122 PRO CA C 122 63.913 62.585 1.328 1
1 1257 . 17 1 1 A 122 122 PRO CB C 122 32.116 31.165 0.951 1
1 1260 . 17 1 1 A 123 123 LYS H H 123 8.344 8.200 0.144 1
1 1261 . 17 1 1 A 123 123 LYS HA H 123 4.244 4.682 -0.438 1
1 1266 . 17 1 1 A 123 123 LYS C C 123 176.637 174.253 2.384 1
1 1267 . 17 1 1 A 123 123 LYS CA C 123 56.359 55.957 0.402 1
1 1268 . 17 1 1 A 123 123 LYS CB C 123 32.367 35.364 -2.997 1
1 1272 . 17 1 1 A 123 123 LYS N N 123 119.110 124.408 -5.298 1
1 1273 . 17 1 1 A 124 124 ALA H H 124 7.929 8.786 -0.857 1
1 1274 . 17 1 1 A 124 124 ALA HA H 124 4.248 5.078 -0.830 1
1 1278 . 17 1 1 A 124 124 ALA C C 124 177.648 175.461 2.187 1
1 1279 . 17 1 1 A 124 124 ALA CA C 124 52.618 51.532 1.086 1
1 1280 . 17 1 1 A 124 124 ALA CB C 124 19.379 21.062 -1.683 1
1 1281 . 17 1 1 A 124 124 ALA N N 124 123.825 128.317 -4.492 1
1 1282 . 17 1 1 A 125 125 SER H H 125 8.134 8.998 -0.864 1
1 1283 . 17 1 1 A 125 125 SER HA H 125 4.341 5.097 -0.756 1
1 1286 . 17 1 1 A 125 125 SER C C 125 174.172 172.981 1.191 1
1 1287 . 17 1 1 A 125 125 SER CA C 125 58.391 56.768 1.623 1
1 1288 . 17 1 1 A 125 125 SER CB C 125 63.748 64.221 -0.473 1
1 1289 . 17 1 1 A 125 125 SER N N 125 114.454 119.955 -5.501 1
1 1290 . 17 1 1 A 126 126 ASN H H 126 8.242 8.713 -0.471 1
1 1291 . 17 1 1 A 126 126 ASN HA H 126 4.657 5.317 -0.660 1
1 1294 . 17 1 1 A 126 126 ASN C C 126 174.624 173.332 1.292 1
1 1295 . 17 1 1 A 126 126 ASN CA C 126 53.292 53.162 0.130 1
1 1296 . 17 1 1 A 126 126 ASN CB C 126 38.797 41.002 -2.205 1
1 1297 . 17 1 1 A 126 126 ASN N N 126 120.102 125.428 -5.326 1
1 1298 . 17 1 1 A 127 127 TRP H H 127 8.051 8.978 -0.927 1
1 1299 . 17 1 1 A 127 127 TRP HA H 127 4.694 5.241 -0.547 1
1 1302 . 17 1 1 A 127 127 TRP C C 127 175.479 175.234 0.245 1
1 1303 . 17 1 1 A 127 127 TRP CA C 127 57.096 56.007 1.089 1
1 1304 . 17 1 1 A 127 127 TRP CB C 127 29.820 31.580 -1.760 1
1 1305 . 17 1 1 A 127 127 TRP N N 127 121.198 128.256 -7.058 1
1 1 . 18 1 1 A 7 7 HIS HA H 7 4.623 4.489 0.134 1
1 4 . 18 1 1 A 7 7 HIS C C 7 174.747 174.302 0.445 1
1 5 . 18 1 1 A 7 7 HIS CA C 7 56.189 54.356 1.833 1
1 6 . 18 1 1 A 7 7 HIS CB C 7 30.028 28.585 1.443 1
1 7 . 18 1 1 A 8 8 LEU H H 8 8.283 8.337 -0.054 1
1 8 . 18 1 1 A 8 8 LEU HA H 8 4.249 4.359 -0.110 1
1 10 . 18 1 1 A 8 8 LEU C C 8 176.700 177.166 -0.466 1
1 11 . 18 1 1 A 8 8 LEU CA C 8 55.498 55.506 -0.008 1
1 12 . 18 1 1 A 8 8 LEU CB C 8 42.568 43.120 -0.552 1
1 13 . 18 1 1 A 8 8 LEU N N 8 122.916 127.722 -4.806 1
1 14 . 18 1 1 A 9 9 GLU H H 9 8.623 7.876 0.747 1
1 15 . 18 1 1 A 9 9 GLU HA H 9 4.311 4.285 0.026 1
1 16 . 18 1 1 A 9 9 GLU C C 9 174.811 176.019 -1.208 1
1 17 . 18 1 1 A 9 9 GLU CA C 9 56.377 56.942 -0.565 1
1 18 . 18 1 1 A 9 9 GLU CB C 9 29.557 30.191 -0.634 1
1 20 . 18 1 1 A 9 9 GLU N N 9 121.512 118.384 3.128 1
1 21 . 18 1 1 A 10 10 LEU H H 10 7.853 8.288 -0.435 1
1 22 . 18 1 1 A 10 10 LEU HA H 10 5.225 5.099 0.126 1
1 31 . 18 1 1 A 10 10 LEU C C 10 174.637 174.473 0.164 1
1 32 . 18 1 1 A 10 10 LEU CA C 10 54.513 54.414 0.099 1
1 33 . 18 1 1 A 10 10 LEU CB C 10 45.187 44.040 1.147 1
1 36 . 18 1 1 A 10 10 LEU N N 10 123.592 125.419 -1.827 1
1 37 . 18 1 1 A 11 11 GLU H H 11 8.894 8.663 0.231 1
1 38 . 18 1 1 A 11 11 GLU HA H 11 4.765 5.132 -0.367 1
1 43 . 18 1 1 A 11 11 GLU C C 11 174.563 175.295 -0.732 1
1 44 . 18 1 1 A 11 11 GLU CA C 11 55.047 54.978 0.069 1
1 45 . 18 1 1 A 11 11 GLU CB C 11 33.760 32.670 1.090 1
1 47 . 18 1 1 A 11 11 GLU N N 11 124.055 125.262 -1.207 1
1 48 . 18 1 1 A 12 12 VAL H H 12 8.607 8.953 -0.346 1
1 49 . 18 1 1 A 12 12 VAL HA H 12 5.174 5.095 0.079 1
1 57 . 18 1 1 A 12 12 VAL C C 12 173.573 175.270 -1.697 1
1 58 . 18 1 1 A 12 12 VAL CA C 12 60.296 61.177 -0.881 1
1 59 . 18 1 1 A 12 12 VAL CB C 12 35.689 33.143 2.546 1
1 62 . 18 1 1 A 12 12 VAL N N 12 120.878 124.991 -4.113 1
1 63 . 18 1 1 A 13 13 HIS H H 13 8.982 8.514 0.468 1
1 64 . 18 1 1 A 13 13 HIS HA H 13 4.824 5.407 -0.583 1
1 69 . 18 1 1 A 13 13 HIS C C 13 173.236 172.063 1.173 1
1 70 . 18 1 1 A 13 13 HIS CA C 13 54.906 53.983 0.923 1
1 71 . 18 1 1 A 13 13 HIS CB C 13 33.496 33.213 0.283 1
1 72 . 18 1 1 A 13 13 HIS N N 13 121.504 122.238 -0.734 1
1 73 . 18 1 1 A 14 14 ILE H H 14 10.442 8.768 1.674 1
1 74 . 18 1 1 A 14 14 ILE HA H 14 5.458 5.061 0.397 1
1 84 . 18 1 1 A 14 14 ILE CA C 14 58.386 57.937 0.449 1
1 85 . 18 1 1 A 14 14 ILE CB C 14 38.596 38.781 -0.185 1
1 88 . 18 1 1 A 14 14 ILE N N 14 119.923 119.935 -0.012 1
1 89 . 18 1 1 A 15 15 PRO HA H 15 4.560 4.561 -0.001 1
1 95 . 18 1 1 A 15 15 PRO C C 15 176.907 176.546 0.361 1
1 96 . 18 1 1 A 15 15 PRO CA C 15 64.342 64.499 -0.157 1
1 97 . 18 1 1 A 15 15 PRO CB C 15 32.924 32.409 0.515 1
1 100 . 18 1 1 A 16 16 SER H H 16 7.331 7.764 -0.433 1
1 101 . 18 1 1 A 16 16 SER HA H 16 4.822 5.047 -0.225 1
1 104 . 18 1 1 A 16 16 SER C C 16 171.253 172.506 -1.253 1
1 105 . 18 1 1 A 16 16 SER CA C 16 57.135 57.861 -0.726 1
1 106 . 18 1 1 A 16 16 SER CB C 16 65.947 67.052 -1.105 1
1 107 . 18 1 1 A 16 16 SER N N 16 107.745 113.922 -6.177 1
1 108 . 18 1 1 A 17 17 VAL H H 17 8.350 8.513 -0.163 1
1 109 . 18 1 1 A 17 17 VAL HA H 17 4.926 5.055 -0.129 1
1 117 . 18 1 1 A 17 17 VAL C C 17 173.692 175.411 -1.719 1
1 118 . 18 1 1 A 17 17 VAL CA C 17 58.721 60.835 -2.114 1
1 119 . 18 1 1 A 17 17 VAL CB C 17 34.420 34.880 -0.460 1
1 122 . 18 1 1 A 17 17 VAL N N 17 118.680 122.794 -4.114 1
1 123 . 18 1 1 A 18 18 GLY H H 18 8.332 8.493 -0.161 1
1 124 . 18 1 1 A 18 18 GLY HA2 H 18 4.189 4.208 -0.019 1
1 125 . 18 1 1 A 18 18 GLY HA3 H 18 4.011 4.218 -0.207 1
1 126 . 18 1 1 A 18 18 GLY CA C 18 45.356 45.139 0.217 1
1 127 . 18 1 1 A 18 18 GLY N N 18 112.549 113.164 -0.615 1
1 128 . 18 1 1 A 19 19 PRO HA H 19 4.757 4.708 0.049 1
1 134 . 18 1 1 A 19 19 PRO C C 19 177.482 176.751 0.731 1
1 135 . 18 1 1 A 19 19 PRO CA C 19 62.848 62.697 0.151 1
1 136 . 18 1 1 A 19 19 PRO CB C 19 32.283 31.433 0.850 1
1 139 . 18 1 1 A 20 20 GLU H H 20 8.588 8.877 -0.289 1
1 140 . 18 1 1 A 20 20 GLU HA H 20 4.147 4.504 -0.357 1
1 144 . 18 1 1 A 20 20 GLU C C 20 175.857 175.920 -0.063 1
1 145 . 18 1 1 A 20 20 GLU CA C 20 57.150 57.937 -0.787 1
1 146 . 18 1 1 A 20 20 GLU CB C 20 30.923 31.814 -0.891 1
1 148 . 18 1 1 A 20 20 GLU N N 20 122.087 123.940 -1.853 1
1 149 . 18 1 1 A 21 21 ALA H H 21 8.352 7.946 0.406 1
1 150 . 18 1 1 A 21 21 ALA HA H 21 4.391 4.673 -0.282 1
1 154 . 18 1 1 A 21 21 ALA C C 21 174.910 176.406 -1.496 1
1 155 . 18 1 1 A 21 21 ALA CA C 21 52.166 50.473 1.693 1
1 156 . 18 1 1 A 21 21 ALA CB C 21 19.915 19.498 0.417 1
1 157 . 18 1 1 A 21 21 ALA N N 21 124.593 121.908 2.685 1
1 158 . 18 1 1 A 22 22 GLU H H 22 8.398 8.453 -0.055 1
1 159 . 18 1 1 A 22 22 GLU HA H 22 4.331 4.706 -0.375 1
1 163 . 18 1 1 A 22 22 GLU C C 22 176.389 176.809 -0.420 1
1 164 . 18 1 1 A 22 22 GLU CA C 22 56.316 55.955 0.361 1
1 165 . 18 1 1 A 22 22 GLU CB C 22 30.713 30.652 0.061 1
1 167 . 18 1 1 A 22 22 GLU N N 22 120.159 123.021 -2.862 1
1 168 . 18 1 1 A 23 23 GLY H H 23 8.246 8.998 -0.752 1
1 169 . 18 1 1 A 23 23 GLY HA2 H 23 4.162 4.032 0.130 1
1 170 . 18 1 1 A 23 23 GLY HA3 H 23 4.061 4.040 0.021 1
1 171 . 18 1 1 A 23 23 GLY CA C 23 44.801 46.790 -1.989 1
1 172 . 18 1 1 A 23 23 GLY N N 23 110.080 111.602 -1.522 1
1 173 . 18 1 1 A 24 24 PRO HA H 24 4.417 4.599 -0.182 1
1 178 . 18 1 1 A 24 24 PRO C C 24 177.135 176.187 0.948 1
1 179 . 18 1 1 A 24 24 PRO CA C 24 63.520 62.349 1.171 1
1 180 . 18 1 1 A 24 24 PRO CB C 24 32.124 33.075 -0.951 1
1 183 . 18 1 1 A 25 25 ARG H H 25 8.409 8.464 -0.055 1
1 184 . 18 1 1 A 25 25 ARG HA H 25 4.298 4.556 -0.258 1
1 187 . 18 1 1 A 25 25 ARG C C 25 176.217 176.173 0.044 1
1 188 . 18 1 1 A 25 25 ARG CA C 25 56.237 55.573 0.664 1
1 189 . 18 1 1 A 25 25 ARG CB C 25 30.467 31.229 -0.762 1
1 192 . 18 1 1 A 25 25 ARG N N 25 120.147 120.266 -0.119 1
1 193 . 18 1 1 A 26 26 GLN H H 26 8.278 8.362 -0.084 1
1 194 . 18 1 1 A 26 26 GLN HA H 26 4.336 4.454 -0.118 1
1 200 . 18 1 1 A 26 26 GLN C C 26 175.566 174.745 0.821 1
1 201 . 18 1 1 A 26 26 GLN CA C 26 55.788 55.668 0.120 1
1 202 . 18 1 1 A 26 26 GLN CB C 26 29.714 28.517 1.197 1
1 204 . 18 1 1 A 26 26 GLN N N 26 120.460 121.930 -1.470 1
1 206 . 18 1 1 A 27 27 SER H H 27 8.298 8.268 0.030 1
1 208 . 18 1 1 A 27 27 SER CA C 27 56.156 55.374 0.782 1
1 209 . 18 1 1 A 27 27 SER CB C 27 63.813 64.956 -1.143 1
1 210 . 18 1 1 A 27 27 SER N N 27 117.382 123.333 -5.951 1
1 211 . 18 1 1 A 28 28 PRO HA H 28 4.366 4.459 -0.093 1
1 216 . 18 1 1 A 28 28 PRO C C 28 177.555 177.752 -0.197 1
1 217 . 18 1 1 A 28 28 PRO CA C 28 64.486 64.520 -0.034 1
1 218 . 18 1 1 A 28 28 PRO CB C 28 31.892 31.921 -0.029 1
1 221 . 18 1 1 A 29 29 GLU H H 29 8.582 7.953 0.629 1
1 222 . 18 1 1 A 29 29 GLU HA H 29 4.218 4.092 0.126 1
1 226 . 18 1 1 A 29 29 GLU CA C 29 57.261 59.472 -2.211 1
1 227 . 18 1 1 A 29 29 GLU CB C 29 29.633 29.449 0.184 1
1 229 . 18 1 1 A 29 29 GLU N N 29 118.309 117.983 0.326 1
1 230 . 18 1 1 A 30 30 LYS H H 30 7.955 7.416 0.539 1
1 231 . 18 1 1 A 30 30 LYS HA H 30 4.328 3.932 0.396 1
1 236 . 18 1 1 A 30 30 LYS C C 30 176.222 175.928 0.294 1
1 237 . 18 1 1 A 30 30 LYS CA C 30 56.247 56.995 -0.748 1
1 238 . 18 1 1 A 30 30 LYS CB C 30 32.720 29.891 2.829 1
1 242 . 18 1 1 A 30 30 LYS N N 30 120.129 118.806 1.323 1
1 243 . 18 1 1 A 31 31 SER H H 31 7.883 8.010 -0.127 1
1 244 . 18 1 1 A 31 31 SER HA H 31 4.458 4.409 0.049 1
1 246 . 18 1 1 A 31 31 SER C C 31 174.129 175.578 -1.449 1
1 247 . 18 1 1 A 31 31 SER CA C 31 58.477 60.252 -1.775 1
1 248 . 18 1 1 A 31 31 SER CB C 31 64.042 63.760 0.282 1
1 249 . 18 1 1 A 31 31 SER N N 31 115.366 114.406 0.960 1
1 250 . 18 1 1 A 32 32 HIS H H 32 8.485 8.604 -0.119 1
1 251 . 18 1 1 A 32 32 HIS HA H 32 4.450 4.959 -0.509 1
1 255 . 18 1 1 A 32 32 HIS CA C 32 56.009 55.210 0.799 1
1 256 . 18 1 1 A 32 32 HIS CB C 32 31.122 30.530 0.592 1
1 257 . 18 1 1 A 32 32 HIS N N 32 121.500 119.730 1.770 1
1 258 . 18 1 1 A 33 33 MET H H 33 8.392 7.612 0.780 1
1 259 . 18 1 1 A 33 33 MET HA H 33 4.601 4.816 -0.215 1
1 265 . 18 1 1 A 33 33 MET C C 33 175.842 174.452 1.390 1
1 266 . 18 1 1 A 33 33 MET CA C 33 54.533 54.204 0.329 1
1 267 . 18 1 1 A 33 33 MET CB C 33 32.868 35.861 -2.993 1
1 270 . 18 1 1 A 33 33 MET N N 33 120.204 118.567 1.637 1
1 271 . 18 1 1 A 34 34 VAL H H 34 8.938 8.639 0.299 1
1 272 . 18 1 1 A 34 34 VAL HA H 34 4.430 4.959 -0.529 1
1 280 . 18 1 1 A 34 34 VAL C C 34 174.149 174.760 -0.611 1
1 281 . 18 1 1 A 34 34 VAL CA C 34 60.703 59.823 0.880 1
1 282 . 18 1 1 A 34 34 VAL CB C 34 34.319 35.434 -1.115 1
1 285 . 18 1 1 A 34 34 VAL N N 34 118.512 119.454 -0.942 1
1 286 . 18 1 1 A 35 35 PHE H H 35 9.242 8.689 0.553 1
1 287 . 18 1 1 A 35 35 PHE HA H 35 4.439 5.617 -1.178 1
1 294 . 18 1 1 A 35 35 PHE C C 35 174.831 174.412 0.419 1
1 295 . 18 1 1 A 35 35 PHE CA C 35 57.754 55.297 2.457 1
1 296 . 18 1 1 A 35 35 PHE CB C 35 38.959 41.679 -2.720 1
1 297 . 18 1 1 A 35 35 PHE N N 35 124.912 121.135 3.777 1
1 298 . 18 1 1 A 36 36 ARG H H 36 8.475 9.106 -0.631 1
1 299 . 18 1 1 A 36 36 ARG HA H 36 4.135 4.903 -0.768 1
1 304 . 18 1 1 A 36 36 ARG C C 36 172.865 176.014 -3.149 1
1 305 . 18 1 1 A 36 36 ARG CA C 36 56.895 56.186 0.709 1
1 306 . 18 1 1 A 36 36 ARG CB C 36 28.962 30.655 -1.693 1
1 308 . 18 1 1 A 36 36 ARG N N 36 125.680 123.224 2.456 1
1 309 . 18 1 1 A 37 37 VAL H H 37 8.066 8.757 -0.691 1
1 310 . 18 1 1 A 37 37 VAL HA H 37 4.292 4.645 -0.353 1
1 318 . 18 1 1 A 37 37 VAL C C 37 174.595 174.443 0.152 1
1 319 . 18 1 1 A 37 37 VAL CA C 37 62.727 61.508 1.219 1
1 320 . 18 1 1 A 37 37 VAL CB C 37 31.102 33.251 -2.149 1
1 323 . 18 1 1 A 37 37 VAL N N 37 125.403 120.748 4.655 1
1 324 . 18 1 1 A 38 38 GLU H H 38 9.532 9.462 0.070 1
1 325 . 18 1 1 A 38 38 GLU HA H 38 4.895 5.080 -0.185 1
1 329 . 18 1 1 A 38 38 GLU C C 38 174.509 174.886 -0.377 1
1 330 . 18 1 1 A 38 38 GLU CA C 38 55.650 54.653 0.997 1
1 331 . 18 1 1 A 38 38 GLU CB C 38 32.214 31.087 1.127 1
1 333 . 18 1 1 A 38 38 GLU N N 38 129.885 126.194 3.691 1
1 334 . 18 1 1 A 39 39 VAL H H 39 9.035 8.630 0.405 1
1 335 . 18 1 1 A 39 39 VAL HA H 39 4.446 4.422 0.024 1
1 343 . 18 1 1 A 39 39 VAL C C 39 173.661 174.331 -0.670 1
1 344 . 18 1 1 A 39 39 VAL CA C 39 61.258 62.045 -0.787 1
1 345 . 18 1 1 A 39 39 VAL CB C 39 33.533 32.298 1.235 1
1 348 . 18 1 1 A 39 39 VAL N N 39 127.941 127.388 0.553 1
1 349 . 18 1 1 A 40 40 LEU H H 40 8.843 8.898 -0.055 1
1 350 . 18 1 1 A 40 40 LEU HA H 40 5.130 4.807 0.323 1
1 360 . 18 1 1 A 40 40 LEU C C 40 175.581 175.288 0.293 1
1 361 . 18 1 1 A 40 40 LEU CA C 40 53.702 53.801 -0.099 1
1 362 . 18 1 1 A 40 40 LEU CB C 40 43.989 43.397 0.592 1
1 366 . 18 1 1 A 40 40 LEU N N 40 128.413 129.911 -1.498 1
1 367 . 18 1 1 A 41 41 CYS H H 41 8.959 9.032 -0.073 1
1 368 . 18 1 1 A 41 41 CYS HA H 41 5.174 5.150 0.024 1
1 371 . 18 1 1 A 41 41 CYS C C 41 175.043 173.741 1.302 1
1 372 . 18 1 1 A 41 41 CYS CA C 41 57.483 57.523 -0.040 1
1 373 . 18 1 1 A 41 41 CYS CB C 41 28.472 30.011 -1.539 1
1 374 . 18 1 1 A 41 41 CYS N N 41 124.738 124.189 0.549 1
1 375 . 18 1 1 A 42 42 SER H H 42 9.527 9.380 0.147 1
1 376 . 18 1 1 A 42 42 SER HA H 42 4.149 4.178 -0.029 1
1 379 . 18 1 1 A 42 42 SER C C 42 175.014 174.460 0.554 1
1 380 . 18 1 1 A 42 42 SER CA C 42 59.058 59.477 -0.419 1
1 381 . 18 1 1 A 42 42 SER CB C 42 62.287 61.861 0.426 1
1 382 . 18 1 1 A 42 42 SER N N 42 125.889 117.441 8.448 1
1 383 . 18 1 1 A 43 43 GLY H H 43 8.685 8.373 0.312 1
1 384 . 18 1 1 A 43 43 GLY HA2 H 43 3.594 3.831 -0.237 1
1 385 . 18 1 1 A 43 43 GLY HA3 H 43 4.210 3.849 0.361 1
1 386 . 18 1 1 A 43 43 GLY C C 43 173.664 173.615 0.049 1
1 387 . 18 1 1 A 43 43 GLY CA C 43 45.404 45.240 0.164 1
1 388 . 18 1 1 A 43 43 GLY N N 43 104.633 105.937 -1.304 1
1 389 . 18 1 1 A 44 44 ARG H H 44 7.926 7.748 0.178 1
1 390 . 18 1 1 A 44 44 ARG HA H 44 4.678 4.507 0.171 1
1 395 . 18 1 1 A 44 44 ARG C C 44 175.261 174.866 0.395 1
1 396 . 18 1 1 A 44 44 ARG CA C 44 55.011 55.012 -0.001 1
1 397 . 18 1 1 A 44 44 ARG CB C 44 32.138 32.328 -0.190 1
1 400 . 18 1 1 A 44 44 ARG N N 44 121.239 120.605 0.634 1
1 401 . 18 1 1 A 45 45 ARG H H 45 8.775 8.952 -0.177 1
1 402 . 18 1 1 A 45 45 ARG HA H 45 5.770 5.399 0.371 1
1 409 . 18 1 1 A 45 45 ARG C C 45 176.064 174.566 1.498 1
1 410 . 18 1 1 A 45 45 ARG CA C 45 54.683 54.382 0.301 1
1 411 . 18 1 1 A 45 45 ARG CB C 45 33.748 34.017 -0.269 1
1 414 . 18 1 1 A 45 45 ARG N N 45 125.948 121.338 4.610 1
1 415 . 18 1 1 A 46 46 HIS H H 46 8.912 8.662 0.250 1
1 416 . 18 1 1 A 46 46 HIS HA H 46 4.927 5.282 -0.355 1
1 420 . 18 1 1 A 46 46 HIS C C 46 172.634 173.476 -0.842 1
1 421 . 18 1 1 A 46 46 HIS CA C 46 56.480 54.326 2.154 1
1 422 . 18 1 1 A 46 46 HIS CB C 46 33.608 33.166 0.442 1
1 423 . 18 1 1 A 46 46 HIS N N 46 121.825 121.433 0.392 1
1 424 . 18 1 1 A 47 47 THR H H 47 8.532 8.609 -0.077 1
1 425 . 18 1 1 A 47 47 THR HA H 47 5.472 4.440 1.032 1
1 430 . 18 1 1 A 47 47 THR C C 47 174.442 173.896 0.546 1
1 431 . 18 1 1 A 47 47 THR CA C 47 61.093 62.658 -1.565 1
1 432 . 18 1 1 A 47 47 THR CB C 47 71.041 68.940 2.101 1
1 434 . 18 1 1 A 47 47 THR N N 47 115.450 123.299 -7.849 1
1 435 . 18 1 1 A 48 48 VAL H H 48 9.695 9.214 0.481 1
1 436 . 18 1 1 A 48 48 VAL HA H 48 4.677 4.482 0.195 1
1 444 . 18 1 1 A 48 48 VAL CA C 48 58.172 59.182 -1.010 1
1 445 . 18 1 1 A 48 48 VAL CB C 48 34.990 33.430 1.560 1
1 448 . 18 1 1 A 48 48 VAL N N 48 126.721 127.133 -0.412 1
1 449 . 18 1 1 A 49 49 PRO HA H 49 5.087 4.719 0.368 1
1 453 . 18 1 1 A 49 49 PRO CA C 49 61.671 62.564 -0.893 1
1 454 . 18 1 1 A 49 49 PRO CB C 49 31.923 31.771 0.152 1
1 457 . 18 1 1 A 50 50 ARG H H 50 9.125 8.948 0.177 1
1 458 . 18 1 1 A 50 50 ARG HA H 50 4.974 4.810 0.164 1
1 464 . 18 1 1 A 50 50 ARG C C 50 176.187 175.357 0.830 1
1 465 . 18 1 1 A 50 50 ARG CA C 50 53.015 54.394 -1.379 1
1 466 . 18 1 1 A 50 50 ARG CB C 50 36.553 33.519 3.034 1
1 468 . 18 1 1 A 50 50 ARG N N 50 124.189 124.028 0.161 1
1 469 . 18 1 1 A 51 51 ARG H H 51 10.105 8.514 1.591 1
1 470 . 18 1 1 A 51 51 ARG HA H 51 5.196 4.471 0.725 1
1 475 . 18 1 1 A 51 51 ARG C C 51 178.865 175.740 3.125 1
1 476 . 18 1 1 A 51 51 ARG CA C 51 55.961 54.859 1.102 1
1 477 . 18 1 1 A 51 51 ARG CB C 51 32.539 31.407 1.132 1
1 480 . 18 1 1 A 51 51 ARG N N 51 124.521 122.016 2.505 1
1 481 . 18 1 1 A 52 52 TYR H H 52 10.397 9.184 1.213 1
1 482 . 18 1 1 A 52 52 TYR HA H 52 4.360 4.406 -0.046 1
1 487 . 18 1 1 A 52 52 TYR C C 52 178.143 177.416 0.727 1
1 488 . 18 1 1 A 52 52 TYR CA C 52 63.538 62.593 0.945 1
1 489 . 18 1 1 A 52 52 TYR CB C 52 38.784 38.878 -0.094 1
1 490 . 18 1 1 A 52 52 TYR N N 52 124.772 121.949 2.823 1
1 491 . 18 1 1 A 53 53 SER H H 53 9.231 8.363 0.868 1
1 492 . 18 1 1 A 53 53 SER HA H 53 4.175 4.326 -0.151 1
1 493 . 18 1 1 A 53 53 SER C C 53 177.220 176.640 0.580 1
1 494 . 18 1 1 A 53 53 SER CA C 53 61.606 62.300 -0.694 1
1 495 . 18 1 1 A 53 53 SER N N 53 113.262 116.906 -3.644 1
1 496 . 18 1 1 A 54 54 GLU H H 54 7.807 7.711 0.096 1
1 497 . 18 1 1 A 54 54 GLU HA H 54 4.392 4.249 0.143 1
1 501 . 18 1 1 A 54 54 GLU C C 54 180.361 179.206 1.155 1
1 502 . 18 1 1 A 54 54 GLU CA C 54 59.497 58.913 0.584 1
1 503 . 18 1 1 A 54 54 GLU CB C 54 30.708 29.551 1.157 1
1 504 . 18 1 1 A 54 54 GLU N N 54 121.949 122.273 -0.324 1
1 505 . 18 1 1 A 55 55 PHE H H 55 8.133 8.196 -0.063 1
1 506 . 18 1 1 A 55 55 PHE HA H 55 4.007 4.148 -0.141 1
1 513 . 18 1 1 A 55 55 PHE C C 55 176.531 177.382 -0.851 1
1 514 . 18 1 1 A 55 55 PHE CA C 55 61.848 61.048 0.800 1
1 515 . 18 1 1 A 55 55 PHE CB C 55 38.847 39.127 -0.280 1
1 516 . 18 1 1 A 55 55 PHE N N 55 119.998 121.892 -1.894 1
1 517 . 18 1 1 A 56 56 HIS H H 56 7.907 8.267 -0.360 1
1 518 . 18 1 1 A 56 56 HIS HA H 56 3.324 3.910 -0.586 1
1 522 . 18 1 1 A 56 56 HIS C C 56 176.748 176.900 -0.152 1
1 523 . 18 1 1 A 56 56 HIS CA C 56 58.770 59.935 -1.165 1
1 524 . 18 1 1 A 56 56 HIS CB C 56 30.404 29.598 0.806 1
1 525 . 18 1 1 A 56 56 HIS N N 56 119.173 118.512 0.661 1
1 526 . 18 1 1 A 57 57 ALA H H 57 7.962 7.960 0.002 1
1 527 . 18 1 1 A 57 57 ALA HA H 57 3.865 3.775 0.090 1
1 531 . 18 1 1 A 57 57 ALA C C 57 180.075 179.744 0.331 1
1 532 . 18 1 1 A 57 57 ALA CA C 57 54.996 54.898 0.098 1
1 533 . 18 1 1 A 57 57 ALA CB C 57 18.226 18.175 0.051 1
1 534 . 18 1 1 A 57 57 ALA N N 57 120.094 120.752 -0.658 1
1 535 . 18 1 1 A 58 58 LEU H H 58 7.295 7.938 -0.643 1
1 536 . 18 1 1 A 58 58 LEU HA H 58 3.994 3.325 0.669 1
1 546 . 18 1 1 A 58 58 LEU C C 58 177.428 177.769 -0.341 1
1 547 . 18 1 1 A 58 58 LEU CA C 58 58.342 57.383 0.959 1
1 548 . 18 1 1 A 58 58 LEU CB C 58 40.851 41.008 -0.157 1
1 552 . 18 1 1 A 58 58 LEU N N 58 119.404 120.046 -0.642 1
1 553 . 18 1 1 A 59 59 HIS H H 59 7.805 7.724 0.081 1
1 554 . 18 1 1 A 59 59 HIS HA H 59 4.286 3.872 0.414 1
1 558 . 18 1 1 A 59 59 HIS C C 59 177.001 177.926 -0.925 1
1 559 . 18 1 1 A 59 59 HIS CA C 59 60.141 58.362 1.779 1
1 560 . 18 1 1 A 59 59 HIS CB C 59 31.072 28.356 2.716 1
1 561 . 18 1 1 A 59 59 HIS N N 59 119.040 117.021 2.019 1
1 562 . 18 1 1 A 60 60 LYS H H 60 7.715 7.249 0.466 1
1 563 . 18 1 1 A 60 60 LYS HA H 60 3.456 3.602 -0.146 1
1 570 . 18 1 1 A 60 60 LYS C C 60 178.464 179.380 -0.916 1
1 571 . 18 1 1 A 60 60 LYS CA C 60 59.629 59.438 0.191 1
1 572 . 18 1 1 A 60 60 LYS CB C 60 32.354 31.645 0.709 1
1 576 . 18 1 1 A 60 60 LYS N N 60 114.225 122.064 -7.839 1
1 577 . 18 1 1 A 61 61 ARG H H 61 7.486 7.326 0.160 1
1 578 . 18 1 1 A 61 61 ARG HA H 61 4.202 3.991 0.211 1
1 584 . 18 1 1 A 61 61 ARG C C 61 178.995 179.012 -0.017 1
1 585 . 18 1 1 A 61 61 ARG CA C 61 58.387 59.234 -0.847 1
1 586 . 18 1 1 A 61 61 ARG CB C 61 31.216 30.586 0.630 1
1 589 . 18 1 1 A 61 61 ARG N N 61 115.929 118.683 -2.754 1
1 590 . 18 1 1 A 62 62 ILE H H 62 8.066 7.317 0.749 1
1 591 . 18 1 1 A 62 62 ILE HA H 62 4.491 3.643 0.848 1
1 601 . 18 1 1 A 62 62 ILE C C 62 177.838 177.350 0.488 1
1 602 . 18 1 1 A 62 62 ILE CA C 62 63.399 63.874 -0.475 1
1 603 . 18 1 1 A 62 62 ILE CB C 62 39.699 36.846 2.853 1
1 606 . 18 1 1 A 62 62 ILE N N 62 111.456 116.639 -5.183 1
1 607 . 18 1 1 A 63 63 LYS H H 63 8.158 8.451 -0.293 1
1 608 . 18 1 1 A 63 63 LYS HA H 63 4.136 3.945 0.191 1
1 615 . 18 1 1 A 63 63 LYS C C 63 176.358 178.489 -2.131 1
1 616 . 18 1 1 A 63 63 LYS CA C 63 58.753 58.868 -0.115 1
1 617 . 18 1 1 A 63 63 LYS CB C 63 30.825 31.901 -1.076 1
1 621 . 18 1 1 A 63 63 LYS N N 63 120.800 123.325 -2.525 1
1 622 . 18 1 1 A 64 64 LYS H H 64 7.687 7.697 -0.010 1
1 623 . 18 1 1 A 64 64 LYS HA H 64 4.301 4.106 0.195 1
1 628 . 18 1 1 A 64 64 LYS C C 64 177.084 178.640 -1.556 1
1 629 . 18 1 1 A 64 64 LYS CA C 64 57.237 58.638 -1.401 1
1 630 . 18 1 1 A 64 64 LYS CB C 64 32.502 32.185 0.317 1
1 634 . 18 1 1 A 64 64 LYS N N 64 116.548 119.498 -2.950 1
1 635 . 18 1 1 A 65 65 LEU H H 65 7.476 7.361 0.115 1
1 636 . 18 1 1 A 65 65 LEU HA H 65 4.219 4.026 0.193 1
1 645 . 18 1 1 A 65 65 LEU C C 65 175.886 175.848 0.038 1
1 646 . 18 1 1 A 65 65 LEU CA C 65 55.542 57.893 -2.351 1
1 647 . 18 1 1 A 65 65 LEU CB C 65 45.493 42.105 3.388 1
1 650 . 18 1 1 A 65 65 LEU N N 65 118.000 120.853 -2.853 1
1 651 . 18 1 1 A 66 66 TYR H H 66 7.672 7.906 -0.234 1
1 652 . 18 1 1 A 66 66 TYR HA H 66 4.762 5.215 -0.453 1
1 660 . 18 1 1 A 66 66 TYR C C 66 174.199 174.634 -0.435 1
1 661 . 18 1 1 A 66 66 TYR CA C 66 56.013 55.338 0.675 1
1 662 . 18 1 1 A 66 66 TYR CB C 66 40.380 40.937 -0.557 1
1 663 . 18 1 1 A 66 66 TYR N N 66 116.805 113.609 3.196 1
1 664 . 18 1 1 A 67 67 LYS H H 67 8.547 8.486 0.061 1
1 665 . 18 1 1 A 67 67 LYS HA H 67 4.436 4.469 -0.033 1
1 670 . 18 1 1 A 67 67 LYS C C 67 175.727 176.084 -0.357 1
1 671 . 18 1 1 A 67 67 LYS CA C 67 56.598 56.867 -0.269 1
1 672 . 18 1 1 A 67 67 LYS CB C 67 32.743 32.756 -0.013 1
1 676 . 18 1 1 A 67 67 LYS N N 67 120.929 120.088 0.841 1
1 677 . 18 1 1 A 68 68 VAL H H 68 8.168 8.545 -0.377 1
1 678 . 18 1 1 A 68 68 VAL HA H 68 4.869 4.771 0.098 1
1 686 . 18 1 1 A 68 68 VAL CA C 68 57.389 59.237 -1.848 1
1 687 . 18 1 1 A 68 68 VAL CB C 68 34.017 34.448 -0.431 1
1 690 . 18 1 1 A 68 68 VAL N N 68 116.467 123.892 -7.425 1
1 691 . 18 1 1 A 69 69 PRO HA H 69 4.674 4.446 0.228 1
1 696 . 18 1 1 A 69 69 PRO C C 69 178.013 176.344 1.669 1
1 697 . 18 1 1 A 69 69 PRO CA C 69 61.443 65.662 -4.219 1
1 698 . 18 1 1 A 69 69 PRO CB C 69 32.231 31.761 0.470 1
1 701 . 18 1 1 A 70 70 ASP H H 70 8.167 8.008 0.159 1
1 702 . 18 1 1 A 70 70 ASP HA H 70 4.531 5.066 -0.535 1
1 705 . 18 1 1 A 70 70 ASP C C 70 175.660 174.844 0.816 1
1 706 . 18 1 1 A 70 70 ASP CA C 70 55.148 52.612 2.536 1
1 707 . 18 1 1 A 70 70 ASP CB C 70 40.876 45.216 -4.340 1
1 708 . 18 1 1 A 70 70 ASP N N 70 116.671 117.062 -0.391 1
1 709 . 18 1 1 A 71 71 PHE H H 71 8.387 8.308 0.079 1
1 710 . 18 1 1 A 71 71 PHE HA H 71 4.076 5.102 -1.026 1
1 717 . 18 1 1 A 71 71 PHE CA C 71 55.672 54.671 1.001 1
1 718 . 18 1 1 A 71 71 PHE CB C 71 39.155 41.702 -2.547 1
1 719 . 18 1 1 A 71 71 PHE N N 71 126.533 117.099 9.434 1
1 720 . 18 1 1 A 72 72 PRO HA H 72 4.156 4.381 -0.225 1
1 727 . 18 1 1 A 72 72 PRO CA C 72 63.079 63.018 0.061 1
1 728 . 18 1 1 A 72 72 PRO CB C 72 32.107 32.019 0.088 1
1 731 . 18 1 1 A 73 73 SER H H 73 8.468 8.526 -0.058 1
1 733 . 18 1 1 A 73 73 SER CA C 73 56.133 57.074 -0.941 1
1 734 . 18 1 1 A 73 73 SER CB C 73 63.991 64.962 -0.971 1
1 735 . 18 1 1 A 73 73 SER N N 73 121.533 117.623 3.910 1
1 736 . 18 1 1 A 74 74 LYS HA H 74 4.574 4.695 -0.121 1
1 739 . 18 1 1 A 74 74 LYS CA C 74 55.659 57.039 -1.380 1
1 740 . 18 1 1 A 74 74 LYS CB C 74 30.550 33.982 -3.432 1
1 741 . 18 1 1 A 75 75 ARG H H 75 7.962 7.286 0.676 1
1 742 . 18 1 1 A 75 75 ARG HA H 75 4.162 4.605 -0.443 1
1 746 . 18 1 1 A 75 75 ARG CA C 75 56.123 55.980 0.143 1
1 747 . 18 1 1 A 75 75 ARG CB C 75 31.179 31.325 -0.146 1
1 749 . 18 1 1 A 75 75 ARG N N 75 121.665 121.852 -0.187 1
1 750 . 18 1 1 A 76 76 LEU H H 76 8.071 8.466 -0.395 1
1 751 . 18 1 1 A 76 76 LEU HA H 76 4.618 4.720 -0.102 1
1 759 . 18 1 1 A 76 76 LEU CA C 76 52.764 51.315 1.449 1
1 760 . 18 1 1 A 76 76 LEU CB C 76 41.918 44.779 -2.861 1
1 762 . 18 1 1 A 76 76 LEU N N 76 124.196 128.510 -4.314 1
1 763 . 18 1 1 A 77 77 PRO HA H 77 4.393 4.315 0.078 1
1 767 . 18 1 1 A 77 77 PRO CA C 77 63.746 62.428 1.318 1
1 770 . 18 1 1 A 78 78 ASN H H 78 8.379 9.012 -0.633 1
1 771 . 18 1 1 A 78 78 ASN HA H 78 4.586 4.515 0.071 1
1 776 . 18 1 1 A 78 78 ASN C C 78 175.648 175.236 0.412 1
1 777 . 18 1 1 A 78 78 ASN CA C 78 53.591 55.964 -2.373 1
1 778 . 18 1 1 A 78 78 ASN CB C 78 37.826 39.324 -1.498 1
1 779 . 18 1 1 A 78 78 ASN N N 78 115.292 121.756 -6.464 1
1 781 . 18 1 1 A 79 79 TRP H H 79 7.900 7.840 0.060 1
1 782 . 18 1 1 A 79 79 TRP HA H 79 4.326 4.231 0.095 1
1 788 . 18 1 1 A 79 79 TRP CA C 79 58.825 59.948 -1.123 1
1 789 . 18 1 1 A 79 79 TRP CB C 79 29.090 27.060 2.030 1
1 790 . 18 1 1 A 79 79 TRP N N 79 119.525 118.561 0.964 1
1 792 . 18 1 1 A 80 80 ARG H H 80 8.060 7.925 0.135 1
1 793 . 18 1 1 A 80 80 ARG HA H 80 3.913 4.278 -0.365 1
1 798 . 18 1 1 A 80 80 ARG C C 80 177.024 177.944 -0.920 1
1 799 . 18 1 1 A 80 80 ARG CA C 80 58.292 58.874 -0.582 1
1 800 . 18 1 1 A 80 80 ARG CB C 80 30.146 30.241 -0.095 1
1 803 . 18 1 1 A 80 80 ARG N N 80 118.864 120.326 -1.462 1
1 804 . 18 1 1 A 81 81 THR H H 81 7.725 7.646 0.079 1
1 805 . 18 1 1 A 81 81 THR HA H 81 4.297 4.444 -0.147 1
1 809 . 18 1 1 A 81 81 THR CA C 81 62.481 62.072 0.409 1
1 811 . 18 1 1 A 81 81 THR N N 81 109.863 106.416 3.447 1
1 812 . 18 1 1 A 82 82 ARG HA H 82 4.341 4.852 -0.511 1
1 816 . 18 1 1 A 82 82 ARG C C 82 177.261 174.937 2.324 1
1 817 . 18 1 1 A 82 82 ARG CA C 82 56.846 54.346 2.500 1
1 818 . 18 1 1 A 82 82 ARG CB C 82 30.288 33.870 -3.582 1
1 820 . 18 1 1 A 83 83 GLY H H 83 8.321 8.745 -0.424 1
1 821 . 18 1 1 A 83 83 GLY HA2 H 83 3.957 4.192 -0.235 1
1 822 . 18 1 1 A 83 83 GLY C C 83 175.185 175.477 -0.292 1
1 823 . 18 1 1 A 83 83 GLY CA C 83 46.297 44.938 1.359 1
1 824 . 18 1 1 A 83 83 GLY N N 83 109.146 112.454 -3.308 1
1 825 . 18 1 1 A 84 84 LEU H H 84 8.303 8.937 -0.634 1
1 826 . 18 1 1 A 84 84 LEU HA H 84 4.018 4.355 -0.337 1
1 835 . 18 1 1 A 84 84 LEU C C 84 178.552 178.661 -0.109 1
1 836 . 18 1 1 A 84 84 LEU CA C 84 58.236 56.758 1.478 1
1 837 . 18 1 1 A 84 84 LEU CB C 84 41.837 42.067 -0.230 1
1 840 . 18 1 1 A 84 84 LEU N N 84 122.662 121.234 1.428 1
1 841 . 18 1 1 A 85 85 GLU H H 85 8.233 8.119 0.114 1
1 842 . 18 1 1 A 85 85 GLU HA H 85 4.371 3.938 0.433 1
1 846 . 18 1 1 A 85 85 GLU C C 85 178.555 179.338 -0.783 1
1 847 . 18 1 1 A 85 85 GLU CA C 85 58.377 59.971 -1.594 1
1 848 . 18 1 1 A 85 85 GLU CB C 85 28.675 29.274 -0.599 1
1 850 . 18 1 1 A 85 85 GLU N N 85 119.781 118.705 1.076 1
1 851 . 18 1 1 A 86 86 GLN H H 86 7.877 8.262 -0.385 1
1 852 . 18 1 1 A 86 86 GLN HA H 86 4.100 4.105 -0.005 1
1 858 . 18 1 1 A 86 86 GLN C C 86 179.557 178.506 1.051 1
1 859 . 18 1 1 A 86 86 GLN CA C 86 58.955 59.206 -0.251 1
1 860 . 18 1 1 A 86 86 GLN CB C 86 28.191 28.457 -0.266 1
1 862 . 18 1 1 A 86 86 GLN N N 86 118.042 119.772 -1.730 1
1 863 . 18 1 1 A 87 87 ARG H H 87 8.169 8.243 -0.074 1
1 864 . 18 1 1 A 87 87 ARG HA H 87 3.975 4.197 -0.222 1
1 868 . 18 1 1 A 87 87 ARG C C 87 177.051 178.759 -1.708 1
1 869 . 18 1 1 A 87 87 ARG CA C 87 59.006 59.608 -0.602 1
1 870 . 18 1 1 A 87 87 ARG CB C 87 30.383 29.362 1.021 1
1 872 . 18 1 1 A 87 87 ARG N N 87 121.381 119.944 1.437 1
1 873 . 18 1 1 A 88 88 ARG H H 88 8.593 7.950 0.643 1
1 874 . 18 1 1 A 88 88 ARG HA H 88 3.726 3.796 -0.070 1
1 876 . 18 1 1 A 88 88 ARG C C 88 177.520 178.451 -0.931 1
1 877 . 18 1 1 A 88 88 ARG CA C 88 60.751 59.024 1.727 1
1 878 . 18 1 1 A 88 88 ARG CB C 88 30.153 29.971 0.182 1
1 879 . 18 1 1 A 88 88 ARG N N 88 120.863 117.971 2.892 1
1 880 . 18 1 1 A 89 89 GLN H H 89 8.355 8.006 0.349 1
1 881 . 18 1 1 A 89 89 GLN HA H 89 3.887 4.024 -0.137 1
1 887 . 18 1 1 A 89 89 GLN C C 89 179.499 178.336 1.163 1
1 888 . 18 1 1 A 89 89 GLN CA C 89 59.603 59.258 0.345 1
1 889 . 18 1 1 A 89 89 GLN CB C 89 28.464 28.127 0.337 1
1 891 . 18 1 1 A 89 89 GLN N N 89 116.860 119.387 -2.527 1
1 893 . 18 1 1 A 90 90 GLY H H 90 8.406 8.119 0.287 1
1 894 . 18 1 1 A 90 90 GLY HA2 H 90 3.672 3.659 0.013 1
1 895 . 18 1 1 A 90 90 GLY HA3 H 90 3.871 3.684 0.187 1
1 896 . 18 1 1 A 90 90 GLY C C 90 177.033 175.592 1.441 1
1 897 . 18 1 1 A 90 90 GLY CA C 90 46.813 47.247 -0.434 1
1 898 . 18 1 1 A 90 90 GLY N N 90 107.679 107.223 0.456 1
1 899 . 18 1 1 A 91 91 LEU H H 91 8.504 8.017 0.487 1
1 900 . 18 1 1 A 91 91 LEU HA H 91 3.784 3.782 0.002 1
1 910 . 18 1 1 A 91 91 LEU C C 91 178.003 178.910 -0.907 1
1 911 . 18 1 1 A 91 91 LEU CA C 91 57.354 57.690 -0.336 1
1 912 . 18 1 1 A 91 91 LEU CB C 91 40.359 40.904 -0.545 1
1 916 . 18 1 1 A 91 91 LEU N N 91 123.959 121.662 2.297 1
1 917 . 18 1 1 A 92 92 GLU H H 92 8.324 8.157 0.167 1
1 918 . 18 1 1 A 92 92 GLU HA H 92 3.732 3.764 -0.032 1
1 922 . 18 1 1 A 92 92 GLU C C 92 177.272 178.246 -0.974 1
1 923 . 18 1 1 A 92 92 GLU CA C 92 60.651 59.641 1.010 1
1 924 . 18 1 1 A 92 92 GLU CB C 92 30.843 29.372 1.471 1
1 926 . 18 1 1 A 92 92 GLU N N 92 121.991 120.170 1.821 1
1 927 . 18 1 1 A 93 93 ALA H H 93 8.126 7.888 0.238 1
1 928 . 18 1 1 A 93 93 ALA HA H 93 4.160 4.017 0.143 1
1 932 . 18 1 1 A 93 93 ALA C C 93 180.818 179.058 1.760 1
1 933 . 18 1 1 A 93 93 ALA CA C 93 54.828 54.886 -0.058 1
1 934 . 18 1 1 A 93 93 ALA CB C 93 18.032 18.451 -0.419 1
1 935 . 18 1 1 A 93 93 ALA N N 93 120.066 122.460 -2.394 1
1 936 . 18 1 1 A 94 94 TYR H H 94 7.916 7.548 0.368 1
1 937 . 18 1 1 A 94 94 TYR HA H 94 4.139 4.323 -0.184 1
1 942 . 18 1 1 A 94 94 TYR C C 94 175.895 178.509 -2.614 1
1 943 . 18 1 1 A 94 94 TYR CA C 94 61.915 61.320 0.595 1
1 944 . 18 1 1 A 94 94 TYR CB C 94 38.740 38.367 0.373 1
1 945 . 18 1 1 A 94 94 TYR N N 94 121.179 115.769 5.410 1
1 946 . 18 1 1 A 95 95 ILE H H 95 7.983 8.382 -0.399 1
1 947 . 18 1 1 A 95 95 ILE HA H 95 3.614 3.798 -0.184 1
1 957 . 18 1 1 A 95 95 ILE C C 95 174.678 178.127 -3.449 1
1 958 . 18 1 1 A 95 95 ILE CA C 95 63.461 65.165 -1.704 1
1 959 . 18 1 1 A 95 95 ILE CB C 95 36.625 37.470 -0.845 1
1 963 . 18 1 1 A 95 95 ILE N N 95 116.397 120.366 -3.969 1
1 964 . 18 1 1 A 96 96 GLN H H 96 8.175 8.641 -0.466 1
1 965 . 18 1 1 A 96 96 GLN HA H 96 3.763 4.008 -0.245 1
1 970 . 18 1 1 A 96 96 GLN C C 96 179.042 178.506 0.536 1
1 971 . 18 1 1 A 96 96 GLN CA C 96 59.270 60.144 -0.874 1
1 972 . 18 1 1 A 96 96 GLN CB C 96 27.696 27.697 -0.001 1
1 974 . 18 1 1 A 96 96 GLN N N 96 116.631 120.409 -3.778 1
1 976 . 18 1 1 A 97 97 GLY H H 97 8.222 8.216 0.006 1
1 977 . 18 1 1 A 97 97 GLY HA2 H 97 3.661 3.718 -0.057 1
1 978 . 18 1 1 A 97 97 GLY HA3 H 97 3.806 3.723 0.083 1
1 979 . 18 1 1 A 97 97 GLY C C 97 175.449 176.089 -0.640 1
1 980 . 18 1 1 A 97 97 GLY CA C 97 46.917 47.346 -0.429 1
1 981 . 18 1 1 A 97 97 GLY N N 97 107.315 106.926 0.389 1
1 982 . 18 1 1 A 98 98 ILE H H 98 7.630 8.156 -0.526 1
1 983 . 18 1 1 A 98 98 ILE HA H 98 3.399 3.966 -0.567 1
1 993 . 18 1 1 A 98 98 ILE C C 98 178.683 177.927 0.756 1
1 994 . 18 1 1 A 98 98 ILE CA C 98 66.402 64.869 1.533 1
1 995 . 18 1 1 A 98 98 ILE CB C 98 38.037 37.652 0.385 1
1 999 . 18 1 1 A 98 98 ILE N N 98 120.644 120.680 -0.036 1
1 1000 . 18 1 1 A 99 99 LEU H H 99 7.076 8.520 -1.444 1
1 1001 . 18 1 1 A 99 99 LEU HA H 99 4.133 4.013 0.120 1
1 1010 . 18 1 1 A 99 99 LEU C C 99 178.128 178.234 -0.106 1
1 1011 . 18 1 1 A 99 99 LEU CA C 99 57.129 57.952 -0.823 1
1 1012 . 18 1 1 A 99 99 LEU CB C 99 41.108 41.757 -0.649 1
1 1014 . 18 1 1 A 99 99 LEU N N 99 116.844 124.259 -7.415 1
1 1015 . 18 1 1 A 100 100 TYR H H 100 7.890 8.620 -0.730 1
1 1016 . 18 1 1 A 100 100 TYR HA H 100 4.550 4.137 0.413 1
1 1021 . 18 1 1 A 100 100 TYR C C 100 178.210 177.607 0.603 1
1 1022 . 18 1 1 A 100 100 TYR CA C 100 59.452 60.927 -1.475 1
1 1023 . 18 1 1 A 100 100 TYR CB C 100 38.786 38.789 -0.003 1
1 1024 . 18 1 1 A 100 100 TYR N N 100 116.427 119.775 -3.348 1
1 1025 . 18 1 1 A 101 101 LEU H H 101 8.041 7.595 0.446 1
1 1026 . 18 1 1 A 101 101 LEU HA H 101 4.158 3.967 0.191 1
1 1036 . 18 1 1 A 101 101 LEU C C 101 176.808 177.467 -0.659 1
1 1037 . 18 1 1 A 101 101 LEU CA C 101 56.156 58.134 -1.978 1
1 1038 . 18 1 1 A 101 101 LEU CB C 101 44.307 41.838 2.469 1
1 1041 . 18 1 1 A 101 101 LEU N N 101 116.493 120.569 -4.076 1
1 1042 . 18 1 1 A 102 102 ASN H H 102 7.146 7.549 -0.403 1
1 1043 . 18 1 1 A 102 102 ASN HA H 102 5.056 4.970 0.086 1
1 1046 . 18 1 1 A 102 102 ASN CA C 102 52.704 52.334 0.370 1
1 1047 . 18 1 1 A 102 102 ASN CB C 102 42.424 41.103 1.321 1
1 1048 . 18 1 1 A 102 102 ASN N N 102 114.922 115.235 -0.313 1
1 1049 . 18 1 1 A 103 103 GLN H H 103 8.477 7.559 0.918 1
1 1050 . 18 1 1 A 103 103 GLN HA H 103 3.866 3.611 0.255 1
1 1054 . 18 1 1 A 103 103 GLN C C 103 176.110 176.448 -0.338 1
1 1055 . 18 1 1 A 103 103 GLN CA C 103 58.451 58.936 -0.485 1
1 1056 . 18 1 1 A 103 103 GLN CB C 103 28.896 28.471 0.425 1
1 1058 . 18 1 1 A 103 103 GLN N N 103 120.252 119.664 0.588 1
1 1059 . 18 1 1 A 104 104 GLU H H 104 7.930 7.393 0.537 1
1 1060 . 18 1 1 A 104 104 GLU HA H 104 4.591 3.962 0.629 1
1 1064 . 18 1 1 A 104 104 GLU C C 104 175.397 174.893 0.504 1
1 1065 . 18 1 1 A 104 104 GLU CA C 104 54.058 59.310 -5.252 1
1 1066 . 18 1 1 A 104 104 GLU CB C 104 31.272 27.696 3.576 1
1 1068 . 18 1 1 A 104 104 GLU N N 104 117.295 115.978 1.317 1
1 1069 . 18 1 1 A 105 105 VAL H H 105 8.546 8.126 0.420 1
1 1070 . 18 1 1 A 105 105 VAL HA H 105 3.823 4.417 -0.594 1
1 1078 . 18 1 1 A 105 105 VAL CA C 105 60.706 59.903 0.803 1
1 1079 . 18 1 1 A 105 105 VAL CB C 105 32.126 32.927 -0.801 1
1 1082 . 18 1 1 A 105 105 VAL N N 105 124.511 117.241 7.270 1
1 1083 . 18 1 1 A 106 106 PRO HA H 106 3.997 4.729 -0.732 1
1 1089 . 18 1 1 A 106 106 PRO C C 106 178.240 177.824 0.416 1
1 1090 . 18 1 1 A 106 106 PRO CA C 106 62.961 62.322 0.639 1
1 1091 . 18 1 1 A 106 106 PRO CB C 106 32.321 32.625 -0.304 1
1 1094 . 18 1 1 A 107 107 LYS H H 107 9.122 9.055 0.067 1
1 1095 . 18 1 1 A 107 107 LYS HA H 107 3.813 4.042 -0.229 1
1 1101 . 18 1 1 A 107 107 LYS C C 107 178.563 177.662 0.901 1
1 1102 . 18 1 1 A 107 107 LYS CA C 107 60.085 59.529 0.556 1
1 1103 . 18 1 1 A 107 107 LYS CB C 107 31.632 32.320 -0.688 1
1 1106 . 18 1 1 A 107 107 LYS N N 107 129.017 123.983 5.034 1
1 1107 . 18 1 1 A 108 108 GLU H H 108 10.370 8.022 2.348 1
1 1108 . 18 1 1 A 108 108 GLU HA H 108 3.991 4.323 -0.332 1
1 1111 . 18 1 1 A 108 108 GLU C C 108 180.366 179.409 0.957 1
1 1112 . 18 1 1 A 108 108 GLU CA C 108 60.337 59.151 1.186 1
1 1113 . 18 1 1 A 108 108 GLU CB C 108 29.178 29.502 -0.324 1
1 1115 . 18 1 1 A 108 108 GLU N N 108 118.335 118.931 -0.596 1
1 1116 . 18 1 1 A 109 109 LEU H H 109 7.393 8.076 -0.683 1
1 1117 . 18 1 1 A 109 109 LEU HA H 109 4.220 4.235 -0.015 1
1 1126 . 18 1 1 A 109 109 LEU C C 109 177.378 179.670 -2.292 1
1 1127 . 18 1 1 A 109 109 LEU CA C 109 56.618 58.190 -1.572 1
1 1128 . 18 1 1 A 109 109 LEU CB C 109 41.898 41.352 0.546 1
1 1131 . 18 1 1 A 109 109 LEU N N 109 118.285 120.041 -1.756 1
1 1132 . 18 1 1 A 110 110 LEU H H 110 7.641 8.082 -0.441 1
1 1133 . 18 1 1 A 110 110 LEU HA H 110 3.796 4.042 -0.246 1
1 1142 . 18 1 1 A 110 110 LEU C C 110 179.103 179.231 -0.128 1
1 1143 . 18 1 1 A 110 110 LEU CA C 110 59.046 58.128 0.918 1
1 1144 . 18 1 1 A 110 110 LEU CB C 110 40.228 41.084 -0.856 1
1 1147 . 18 1 1 A 110 110 LEU N N 110 120.162 119.903 0.259 1
1 1148 . 18 1 1 A 111 111 GLU H H 111 7.916 8.041 -0.125 1
1 1149 . 18 1 1 A 111 111 GLU HA H 111 4.080 4.165 -0.085 1
1 1153 . 18 1 1 A 111 111 GLU C C 111 179.967 178.074 1.893 1
1 1154 . 18 1 1 A 111 111 GLU CA C 111 59.243 58.799 0.444 1
1 1155 . 18 1 1 A 111 111 GLU CB C 111 29.576 29.642 -0.066 1
1 1157 . 18 1 1 A 111 111 GLU N N 111 117.360 118.504 -1.144 1
1 1158 . 18 1 1 A 112 112 PHE H H 112 7.712 7.700 0.012 1
1 1159 . 18 1 1 A 112 112 PHE HA H 112 4.224 4.420 -0.196 1
1 1164 . 18 1 1 A 112 112 PHE C C 112 177.180 177.682 -0.502 1
1 1165 . 18 1 1 A 112 112 PHE CA C 112 61.407 60.337 1.070 1
1 1166 . 18 1 1 A 112 112 PHE CB C 112 40.172 40.138 0.034 1
1 1167 . 18 1 1 A 112 112 PHE N N 112 123.042 118.542 4.500 1
1 1168 . 18 1 1 A 113 113 LEU H H 113 8.056 8.517 -0.461 1
1 1169 . 18 1 1 A 113 113 LEU HA H 113 4.147 4.431 -0.284 1
1 1175 . 18 1 1 A 113 113 LEU C C 113 173.717 176.223 -2.506 1
1 1176 . 18 1 1 A 113 113 LEU CA C 113 54.093 54.927 -0.834 1
1 1177 . 18 1 1 A 113 113 LEU CB C 113 41.517 42.277 -0.760 1
1 1179 . 18 1 1 A 113 113 LEU N N 113 115.595 117.811 -2.216 1
1 1180 . 18 1 1 A 114 114 ARG H H 114 7.902 8.070 -0.168 1
1 1181 . 18 1 1 A 114 114 ARG HA H 114 3.817 4.090 -0.273 1
1 1182 . 18 1 1 A 114 114 ARG C C 114 174.566 174.811 -0.245 1
1 1183 . 18 1 1 A 114 114 ARG CA C 114 57.233 57.035 0.198 1
1 1184 . 18 1 1 A 114 114 ARG CB C 114 27.788 28.749 -0.961 1
1 1185 . 18 1 1 A 114 114 ARG N N 114 116.021 119.160 -3.139 1
1 1186 . 18 1 1 A 115 115 LEU H H 115 8.160 8.176 -0.016 1
1 1187 . 18 1 1 A 115 115 LEU HA H 115 4.462 4.583 -0.121 1
1 1195 . 18 1 1 A 115 115 LEU C C 115 176.374 177.258 -0.884 1
1 1196 . 18 1 1 A 115 115 LEU CA C 115 53.965 53.554 0.411 1
1 1197 . 18 1 1 A 115 115 LEU CB C 115 44.077 43.550 0.527 1
1 1199 . 18 1 1 A 115 115 LEU N N 115 118.089 119.501 -1.412 1
1 1200 . 18 1 1 A 116 116 ARG H H 116 8.066 7.954 0.112 1
1 1201 . 18 1 1 A 116 116 ARG HA H 116 4.172 4.313 -0.141 1
1 1203 . 18 1 1 A 116 116 ARG CA C 116 55.961 55.143 0.818 1
1 1204 . 18 1 1 A 116 116 ARG CB C 116 31.379 30.686 0.693 1
1 1205 . 18 1 1 A 116 116 ARG N N 116 120.852 121.738 -0.886 1
1 1206 . 18 1 1 A 117 117 HIS H H 117 7.928 8.585 -0.657 1
1 1207 . 18 1 1 A 117 117 HIS HA H 117 4.557 4.684 -0.127 1
1 1211 . 18 1 1 A 117 117 HIS CA C 117 55.937 54.884 1.053 1
1 1212 . 18 1 1 A 117 117 HIS CB C 117 30.875 29.822 1.053 1
1 1213 . 18 1 1 A 118 118 PHE H H 118 8.183 8.210 -0.027 1
1 1214 . 18 1 1 A 118 118 PHE HA H 118 4.730 4.449 0.281 1
1 1219 . 18 1 1 A 118 118 PHE CA C 118 55.716 56.295 -0.579 1
1 1220 . 18 1 1 A 118 118 PHE CB C 118 39.263 38.781 0.482 1
1 1221 . 18 1 1 A 118 118 PHE N N 118 123.480 125.971 -2.491 1
1 1222 . 18 1 1 A 119 119 PRO HA H 119 4.398 4.576 -0.178 1
1 1227 . 18 1 1 A 119 119 PRO C C 119 176.666 176.114 0.552 1
1 1228 . 18 1 1 A 119 119 PRO CA C 119 63.377 62.892 0.485 1
1 1229 . 18 1 1 A 119 119 PRO CB C 119 32.059 31.732 0.327 1
1 1232 . 18 1 1 A 120 120 THR H H 120 8.054 8.161 -0.107 1
1 1233 . 18 1 1 A 120 120 THR HA H 120 4.273 4.787 -0.514 1
1 1238 . 18 1 1 A 120 120 THR C C 120 174.154 173.012 1.142 1
1 1239 . 18 1 1 A 120 120 THR CA C 120 61.893 60.557 1.336 1
1 1240 . 18 1 1 A 120 120 THR CB C 120 69.736 70.239 -0.503 1
1 1242 . 18 1 1 A 120 120 THR N N 120 113.088 112.558 0.530 1
1 1243 . 18 1 1 A 121 121 ASP H H 121 8.209 8.573 -0.364 1
1 1244 . 18 1 1 A 121 121 ASP HA H 121 4.876 4.755 0.121 1
1 1247 . 18 1 1 A 121 121 ASP CA C 121 52.126 51.806 0.320 1
1 1248 . 18 1 1 A 121 121 ASP CB C 121 41.553 40.670 0.883 1
1 1249 . 18 1 1 A 121 121 ASP N N 121 123.630 127.327 -3.697 1
1 1250 . 18 1 1 A 122 122 PRO HA H 122 4.363 4.560 -0.197 1
1 1255 . 18 1 1 A 122 122 PRO C C 122 177.344 177.804 -0.460 1
1 1256 . 18 1 1 A 122 122 PRO CA C 122 63.913 63.048 0.865 1
1 1257 . 18 1 1 A 122 122 PRO CB C 122 32.116 31.896 0.220 1
1 1260 . 18 1 1 A 123 123 LYS H H 123 8.344 8.882 -0.538 1
1 1261 . 18 1 1 A 123 123 LYS HA H 123 4.244 4.202 0.042 1
1 1266 . 18 1 1 A 123 123 LYS C C 123 176.637 176.962 -0.325 1
1 1267 . 18 1 1 A 123 123 LYS CA C 123 56.359 58.469 -2.110 1
1 1268 . 18 1 1 A 123 123 LYS CB C 123 32.367 32.772 -0.405 1
1 1272 . 18 1 1 A 123 123 LYS N N 123 119.110 121.279 -2.169 1
1 1273 . 18 1 1 A 124 124 ALA H H 124 7.929 7.735 0.194 1
1 1274 . 18 1 1 A 124 124 ALA HA H 124 4.248 4.518 -0.270 1
1 1278 . 18 1 1 A 124 124 ALA C C 124 177.648 176.053 1.595 1
1 1279 . 18 1 1 A 124 124 ALA CA C 124 52.618 50.873 1.745 1
1 1280 . 18 1 1 A 124 124 ALA CB C 124 19.379 19.503 -0.124 1
1 1281 . 18 1 1 A 124 124 ALA N N 124 123.825 122.470 1.355 1
1 1282 . 18 1 1 A 125 125 SER H H 125 8.134 8.762 -0.628 1
1 1283 . 18 1 1 A 125 125 SER HA H 125 4.341 4.743 -0.402 1
1 1286 . 18 1 1 A 125 125 SER C C 125 174.172 173.279 0.893 1
1 1287 . 18 1 1 A 125 125 SER CA C 125 58.391 59.827 -1.436 1
1 1288 . 18 1 1 A 125 125 SER CB C 125 63.748 63.443 0.305 1
1 1289 . 18 1 1 A 125 125 SER N N 125 114.454 120.529 -6.075 1
1 1290 . 18 1 1 A 126 126 ASN H H 126 8.242 8.902 -0.660 1
1 1291 . 18 1 1 A 126 126 ASN HA H 126 4.657 5.238 -0.581 1
1 1294 . 18 1 1 A 126 126 ASN C C 126 174.624 173.775 0.849 1
1 1295 . 18 1 1 A 126 126 ASN CA C 126 53.292 51.765 1.527 1
1 1296 . 18 1 1 A 126 126 ASN CB C 126 38.797 39.045 -0.248 1
1 1297 . 18 1 1 A 126 126 ASN N N 126 120.102 125.547 -5.445 1
1 1298 . 18 1 1 A 127 127 TRP H H 127 8.051 8.705 -0.654 1
1 1299 . 18 1 1 A 127 127 TRP HA H 127 4.694 5.011 -0.317 1
1 1302 . 18 1 1 A 127 127 TRP C C 127 175.479 175.794 -0.315 1
1 1303 . 18 1 1 A 127 127 TRP CA C 127 57.096 55.386 1.710 1
1 1304 . 18 1 1 A 127 127 TRP CB C 127 29.820 30.564 -0.744 1
1 1305 . 18 1 1 A 127 127 TRP N N 127 121.198 125.966 -4.768 1
1 1 . 19 1 1 A 7 7 HIS HA H 7 4.623 4.435 0.188 1
1 4 . 19 1 1 A 7 7 HIS C C 7 174.747 174.701 0.046 1
1 5 . 19 1 1 A 7 7 HIS CA C 7 56.189 56.116 0.073 1
1 6 . 19 1 1 A 7 7 HIS CB C 7 30.028 32.200 -2.172 1
1 7 . 19 1 1 A 8 8 LEU H H 8 8.283 7.991 0.292 1
1 8 . 19 1 1 A 8 8 LEU HA H 8 4.249 3.838 0.411 1
1 10 . 19 1 1 A 8 8 LEU C C 8 176.700 175.911 0.789 1
1 11 . 19 1 1 A 8 8 LEU CA C 8 55.498 55.955 -0.457 1
1 12 . 19 1 1 A 8 8 LEU CB C 8 42.568 40.876 1.692 1
1 13 . 19 1 1 A 8 8 LEU N N 8 122.916 118.049 4.867 1
1 14 . 19 1 1 A 9 9 GLU H H 9 8.623 8.168 0.455 1
1 15 . 19 1 1 A 9 9 GLU HA H 9 4.311 4.078 0.233 1
1 16 . 19 1 1 A 9 9 GLU C C 9 174.811 175.161 -0.350 1
1 17 . 19 1 1 A 9 9 GLU CA C 9 56.377 57.026 -0.649 1
1 18 . 19 1 1 A 9 9 GLU CB C 9 29.557 28.924 0.633 1
1 20 . 19 1 1 A 9 9 GLU N N 9 121.512 115.438 6.074 1
1 21 . 19 1 1 A 10 10 LEU H H 10 7.853 8.449 -0.596 1
1 22 . 19 1 1 A 10 10 LEU HA H 10 5.225 5.035 0.190 1
1 31 . 19 1 1 A 10 10 LEU C C 10 174.637 175.355 -0.718 1
1 32 . 19 1 1 A 10 10 LEU CA C 10 54.513 54.134 0.379 1
1 33 . 19 1 1 A 10 10 LEU CB C 10 45.187 43.452 1.735 1
1 36 . 19 1 1 A 10 10 LEU N N 10 123.592 124.746 -1.154 1
1 37 . 19 1 1 A 11 11 GLU H H 11 8.894 9.075 -0.181 1
1 38 . 19 1 1 A 11 11 GLU HA H 11 4.765 5.047 -0.282 1
1 43 . 19 1 1 A 11 11 GLU C C 11 174.563 175.463 -0.900 1
1 44 . 19 1 1 A 11 11 GLU CA C 11 55.047 54.988 0.059 1
1 45 . 19 1 1 A 11 11 GLU CB C 11 33.760 31.833 1.927 1
1 47 . 19 1 1 A 11 11 GLU N N 11 124.055 124.032 0.023 1
1 48 . 19 1 1 A 12 12 VAL H H 12 8.607 8.984 -0.377 1
1 49 . 19 1 1 A 12 12 VAL HA H 12 5.174 5.250 -0.076 1
1 57 . 19 1 1 A 12 12 VAL C C 12 173.573 175.324 -1.751 1
1 58 . 19 1 1 A 12 12 VAL CA C 12 60.296 61.291 -0.995 1
1 59 . 19 1 1 A 12 12 VAL CB C 12 35.689 33.920 1.769 1
1 62 . 19 1 1 A 12 12 VAL N N 12 120.878 125.197 -4.319 1
1 63 . 19 1 1 A 13 13 HIS H H 13 8.982 9.131 -0.149 1
1 64 . 19 1 1 A 13 13 HIS HA H 13 4.824 5.392 -0.568 1
1 69 . 19 1 1 A 13 13 HIS C C 13 173.236 171.930 1.306 1
1 70 . 19 1 1 A 13 13 HIS CA C 13 54.906 53.786 1.120 1
1 71 . 19 1 1 A 13 13 HIS CB C 13 33.496 32.917 0.579 1
1 72 . 19 1 1 A 13 13 HIS N N 13 121.504 122.070 -0.566 1
1 73 . 19 1 1 A 14 14 ILE H H 14 10.442 8.633 1.809 1
1 74 . 19 1 1 A 14 14 ILE HA H 14 5.458 4.805 0.653 1
1 84 . 19 1 1 A 14 14 ILE CA C 14 58.386 57.916 0.470 1
1 85 . 19 1 1 A 14 14 ILE CB C 14 38.596 38.851 -0.255 1
1 88 . 19 1 1 A 14 14 ILE N N 14 119.923 121.416 -1.493 1
1 89 . 19 1 1 A 15 15 PRO HA H 15 4.560 4.545 0.015 1
1 95 . 19 1 1 A 15 15 PRO C C 15 176.907 176.540 0.367 1
1 96 . 19 1 1 A 15 15 PRO CA C 15 64.342 64.489 -0.147 1
1 97 . 19 1 1 A 15 15 PRO CB C 15 32.924 32.343 0.581 1
1 100 . 19 1 1 A 16 16 SER H H 16 7.331 7.693 -0.362 1
1 101 . 19 1 1 A 16 16 SER HA H 16 4.822 4.906 -0.084 1
1 104 . 19 1 1 A 16 16 SER C C 16 171.253 172.051 -0.798 1
1 105 . 19 1 1 A 16 16 SER CA C 16 57.135 57.715 -0.580 1
1 106 . 19 1 1 A 16 16 SER CB C 16 65.947 66.454 -0.507 1
1 107 . 19 1 1 A 16 16 SER N N 16 107.745 112.468 -4.723 1
1 108 . 19 1 1 A 17 17 VAL H H 17 8.350 8.656 -0.306 1
1 109 . 19 1 1 A 17 17 VAL HA H 17 4.926 4.808 0.118 1
1 117 . 19 1 1 A 17 17 VAL C C 17 173.692 174.903 -1.211 1
1 118 . 19 1 1 A 17 17 VAL CA C 17 58.721 60.927 -2.206 1
1 119 . 19 1 1 A 17 17 VAL CB C 17 34.420 34.352 0.068 1
1 122 . 19 1 1 A 17 17 VAL N N 17 118.680 122.048 -3.368 1
1 123 . 19 1 1 A 18 18 GLY H H 18 8.332 9.352 -1.020 1
1 124 . 19 1 1 A 18 18 GLY HA2 H 18 4.189 4.208 -0.019 1
1 125 . 19 1 1 A 18 18 GLY HA3 H 18 4.011 4.225 -0.214 1
1 126 . 19 1 1 A 18 18 GLY CA C 18 45.356 44.541 0.815 1
1 127 . 19 1 1 A 18 18 GLY N N 18 112.549 115.313 -2.764 1
1 128 . 19 1 1 A 19 19 PRO HA H 19 4.757 4.731 0.026 1
1 134 . 19 1 1 A 19 19 PRO C C 19 177.482 176.537 0.945 1
1 135 . 19 1 1 A 19 19 PRO CA C 19 62.848 62.703 0.145 1
1 136 . 19 1 1 A 19 19 PRO CB C 19 32.283 31.810 0.473 1
1 139 . 19 1 1 A 20 20 GLU H H 20 8.588 9.129 -0.541 1
1 140 . 19 1 1 A 20 20 GLU HA H 20 4.147 4.422 -0.275 1
1 144 . 19 1 1 A 20 20 GLU C C 20 175.857 176.730 -0.873 1
1 145 . 19 1 1 A 20 20 GLU CA C 20 57.150 59.269 -2.119 1
1 146 . 19 1 1 A 20 20 GLU CB C 20 30.923 30.922 0.001 1
1 148 . 19 1 1 A 20 20 GLU N N 20 122.087 120.250 1.837 1
1 149 . 19 1 1 A 21 21 ALA H H 21 8.352 7.994 0.358 1
1 150 . 19 1 1 A 21 21 ALA HA H 21 4.391 4.801 -0.410 1
1 154 . 19 1 1 A 21 21 ALA C C 21 174.910 175.931 -1.021 1
1 155 . 19 1 1 A 21 21 ALA CA C 21 52.166 50.366 1.800 1
1 156 . 19 1 1 A 21 21 ALA CB C 21 19.915 22.224 -2.309 1
1 157 . 19 1 1 A 21 21 ALA N N 21 124.593 120.669 3.924 1
1 158 . 19 1 1 A 22 22 GLU H H 22 8.398 8.808 -0.410 1
1 159 . 19 1 1 A 22 22 GLU HA H 22 4.331 4.033 0.298 1
1 163 . 19 1 1 A 22 22 GLU C C 22 176.389 177.045 -0.656 1
1 164 . 19 1 1 A 22 22 GLU CA C 22 56.316 56.477 -0.161 1
1 165 . 19 1 1 A 22 22 GLU CB C 22 30.713 29.465 1.248 1
1 167 . 19 1 1 A 22 22 GLU N N 22 120.159 121.631 -1.472 1
1 168 . 19 1 1 A 23 23 GLY H H 23 8.246 8.794 -0.548 1
1 169 . 19 1 1 A 23 23 GLY HA2 H 23 4.162 3.848 0.314 1
1 170 . 19 1 1 A 23 23 GLY HA3 H 23 4.061 3.906 0.155 1
1 171 . 19 1 1 A 23 23 GLY CA C 23 44.801 46.914 -2.113 1
1 172 . 19 1 1 A 23 23 GLY N N 23 110.080 113.850 -3.770 1
1 173 . 19 1 1 A 24 24 PRO HA H 24 4.417 4.484 -0.067 1
1 178 . 19 1 1 A 24 24 PRO C C 24 177.135 176.548 0.587 1
1 179 . 19 1 1 A 24 24 PRO CA C 24 63.520 64.708 -1.188 1
1 180 . 19 1 1 A 24 24 PRO CB C 24 32.124 32.258 -0.134 1
1 183 . 19 1 1 A 25 25 ARG H H 25 8.409 7.556 0.853 1
1 184 . 19 1 1 A 25 25 ARG HA H 25 4.298 4.782 -0.484 1
1 187 . 19 1 1 A 25 25 ARG C C 25 176.217 174.048 2.169 1
1 188 . 19 1 1 A 25 25 ARG CA C 25 56.237 55.211 1.026 1
1 189 . 19 1 1 A 25 25 ARG CB C 25 30.467 33.862 -3.395 1
1 192 . 19 1 1 A 25 25 ARG N N 25 120.147 116.516 3.631 1
1 193 . 19 1 1 A 26 26 GLN H H 26 8.278 8.336 -0.058 1
1 194 . 19 1 1 A 26 26 GLN HA H 26 4.336 4.596 -0.260 1
1 200 . 19 1 1 A 26 26 GLN C C 26 175.566 175.020 0.546 1
1 201 . 19 1 1 A 26 26 GLN CA C 26 55.788 55.633 0.155 1
1 202 . 19 1 1 A 26 26 GLN CB C 26 29.714 29.192 0.522 1
1 204 . 19 1 1 A 26 26 GLN N N 26 120.460 122.953 -2.493 1
1 206 . 19 1 1 A 27 27 SER H H 27 8.298 8.966 -0.668 1
1 208 . 19 1 1 A 27 27 SER CA C 27 56.156 57.139 -0.983 1
1 209 . 19 1 1 A 27 27 SER CB C 27 63.813 62.965 0.848 1
1 210 . 19 1 1 A 27 27 SER N N 27 117.382 121.950 -4.568 1
1 211 . 19 1 1 A 28 28 PRO HA H 28 4.366 4.412 -0.046 1
1 216 . 19 1 1 A 28 28 PRO C C 28 177.555 177.704 -0.149 1
1 217 . 19 1 1 A 28 28 PRO CA C 28 64.486 65.739 -1.253 1
1 218 . 19 1 1 A 28 28 PRO CB C 28 31.892 31.797 0.095 1
1 221 . 19 1 1 A 29 29 GLU H H 29 8.582 8.066 0.516 1
1 222 . 19 1 1 A 29 29 GLU HA H 29 4.218 4.195 0.023 1
1 226 . 19 1 1 A 29 29 GLU CA C 29 57.261 56.272 0.989 1
1 227 . 19 1 1 A 29 29 GLU CB C 29 29.633 29.105 0.528 1
1 229 . 19 1 1 A 29 29 GLU N N 29 118.309 115.190 3.119 1
1 230 . 19 1 1 A 30 30 LYS H H 30 7.955 7.900 0.055 1
1 231 . 19 1 1 A 30 30 LYS HA H 30 4.328 4.056 0.272 1
1 236 . 19 1 1 A 30 30 LYS C C 30 176.222 175.551 0.671 1
1 237 . 19 1 1 A 30 30 LYS CA C 30 56.247 57.564 -1.317 1
1 238 . 19 1 1 A 30 30 LYS CB C 30 32.720 29.331 3.389 1
1 242 . 19 1 1 A 30 30 LYS N N 30 120.129 115.638 4.491 1
1 243 . 19 1 1 A 31 31 SER H H 31 7.883 7.917 -0.034 1
1 244 . 19 1 1 A 31 31 SER HA H 31 4.458 4.442 0.016 1
1 246 . 19 1 1 A 31 31 SER C C 31 174.129 174.952 -0.823 1
1 247 . 19 1 1 A 31 31 SER CA C 31 58.477 58.943 -0.466 1
1 248 . 19 1 1 A 31 31 SER CB C 31 64.042 63.261 0.781 1
1 249 . 19 1 1 A 31 31 SER N N 31 115.366 115.737 -0.371 1
1 250 . 19 1 1 A 32 32 HIS H H 32 8.485 8.078 0.407 1
1 251 . 19 1 1 A 32 32 HIS HA H 32 4.450 4.688 -0.238 1
1 255 . 19 1 1 A 32 32 HIS CA C 32 56.009 55.922 0.087 1
1 256 . 19 1 1 A 32 32 HIS CB C 32 31.122 30.239 0.883 1
1 257 . 19 1 1 A 32 32 HIS N N 32 121.500 122.110 -0.610 1
1 258 . 19 1 1 A 33 33 MET H H 33 8.392 7.321 1.071 1
1 259 . 19 1 1 A 33 33 MET HA H 33 4.601 4.676 -0.075 1
1 265 . 19 1 1 A 33 33 MET C C 33 175.842 174.630 1.212 1
1 266 . 19 1 1 A 33 33 MET CA C 33 54.533 53.388 1.145 1
1 267 . 19 1 1 A 33 33 MET CB C 33 32.868 34.052 -1.184 1
1 270 . 19 1 1 A 33 33 MET N N 33 120.204 117.669 2.535 1
1 271 . 19 1 1 A 34 34 VAL H H 34 8.938 9.056 -0.118 1
1 272 . 19 1 1 A 34 34 VAL HA H 34 4.430 4.766 -0.336 1
1 280 . 19 1 1 A 34 34 VAL C C 34 174.149 175.229 -1.080 1
1 281 . 19 1 1 A 34 34 VAL CA C 34 60.703 59.601 1.102 1
1 282 . 19 1 1 A 34 34 VAL CB C 34 34.319 34.424 -0.105 1
1 285 . 19 1 1 A 34 34 VAL N N 34 118.512 122.801 -4.289 1
1 286 . 19 1 1 A 35 35 PHE H H 35 9.242 8.184 1.058 1
1 287 . 19 1 1 A 35 35 PHE HA H 35 4.439 5.287 -0.848 1
1 294 . 19 1 1 A 35 35 PHE C C 35 174.831 174.782 0.049 1
1 295 . 19 1 1 A 35 35 PHE CA C 35 57.754 55.264 2.490 1
1 296 . 19 1 1 A 35 35 PHE CB C 35 38.959 41.319 -2.360 1
1 297 . 19 1 1 A 35 35 PHE N N 35 124.912 125.769 -0.857 1
1 298 . 19 1 1 A 36 36 ARG H H 36 8.475 8.586 -0.111 1
1 299 . 19 1 1 A 36 36 ARG HA H 36 4.135 4.654 -0.519 1
1 304 . 19 1 1 A 36 36 ARG C C 36 172.865 175.341 -2.476 1
1 305 . 19 1 1 A 36 36 ARG CA C 36 56.895 55.748 1.147 1
1 306 . 19 1 1 A 36 36 ARG CB C 36 28.962 30.542 -1.580 1
1 308 . 19 1 1 A 36 36 ARG N N 36 125.680 120.950 4.730 1
1 309 . 19 1 1 A 37 37 VAL H H 37 8.066 8.948 -0.882 1
1 310 . 19 1 1 A 37 37 VAL HA H 37 4.292 4.401 -0.109 1
1 318 . 19 1 1 A 37 37 VAL C C 37 174.595 174.308 0.287 1
1 319 . 19 1 1 A 37 37 VAL CA C 37 62.727 61.628 1.099 1
1 320 . 19 1 1 A 37 37 VAL CB C 37 31.102 32.323 -1.221 1
1 323 . 19 1 1 A 37 37 VAL N N 37 125.403 121.630 3.773 1
1 324 . 19 1 1 A 38 38 GLU H H 38 9.532 9.061 0.471 1
1 325 . 19 1 1 A 38 38 GLU HA H 38 4.895 4.660 0.235 1
1 329 . 19 1 1 A 38 38 GLU C C 38 174.509 175.419 -0.910 1
1 330 . 19 1 1 A 38 38 GLU CA C 38 55.650 55.489 0.161 1
1 331 . 19 1 1 A 38 38 GLU CB C 38 32.214 30.168 2.046 1
1 333 . 19 1 1 A 38 38 GLU N N 38 129.885 127.896 1.989 1
1 334 . 19 1 1 A 39 39 VAL H H 39 9.035 9.054 -0.019 1
1 335 . 19 1 1 A 39 39 VAL HA H 39 4.446 4.548 -0.102 1
1 343 . 19 1 1 A 39 39 VAL C C 39 173.661 173.844 -0.183 1
1 344 . 19 1 1 A 39 39 VAL CA C 39 61.258 61.498 -0.240 1
1 345 . 19 1 1 A 39 39 VAL CB C 39 33.533 32.712 0.821 1
1 348 . 19 1 1 A 39 39 VAL N N 39 127.941 127.371 0.570 1
1 349 . 19 1 1 A 40 40 LEU H H 40 8.843 9.300 -0.457 1
1 350 . 19 1 1 A 40 40 LEU HA H 40 5.130 5.046 0.084 1
1 360 . 19 1 1 A 40 40 LEU C C 40 175.581 175.308 0.273 1
1 361 . 19 1 1 A 40 40 LEU CA C 40 53.702 53.674 0.028 1
1 362 . 19 1 1 A 40 40 LEU CB C 40 43.989 43.940 0.049 1
1 366 . 19 1 1 A 40 40 LEU N N 40 128.413 129.497 -1.084 1
1 367 . 19 1 1 A 41 41 CYS H H 41 8.959 8.932 0.027 1
1 368 . 19 1 1 A 41 41 CYS HA H 41 5.174 5.098 0.076 1
1 371 . 19 1 1 A 41 41 CYS C C 41 175.043 174.419 0.624 1
1 372 . 19 1 1 A 41 41 CYS CA C 41 57.483 57.516 -0.033 1
1 373 . 19 1 1 A 41 41 CYS CB C 41 28.472 30.836 -2.364 1
1 374 . 19 1 1 A 41 41 CYS N N 41 124.738 124.375 0.363 1
1 375 . 19 1 1 A 42 42 SER H H 42 9.527 9.215 0.312 1
1 376 . 19 1 1 A 42 42 SER HA H 42 4.149 4.379 -0.230 1
1 379 . 19 1 1 A 42 42 SER C C 42 175.014 173.627 1.387 1
1 380 . 19 1 1 A 42 42 SER CA C 42 59.058 59.227 -0.169 1
1 381 . 19 1 1 A 42 42 SER CB C 42 62.287 62.105 0.182 1
1 382 . 19 1 1 A 42 42 SER N N 42 125.889 117.354 8.535 1
1 383 . 19 1 1 A 43 43 GLY H H 43 8.685 7.946 0.739 1
1 384 . 19 1 1 A 43 43 GLY HA2 H 43 3.594 3.870 -0.276 1
1 385 . 19 1 1 A 43 43 GLY HA3 H 43 4.210 3.876 0.334 1
1 386 . 19 1 1 A 43 43 GLY C C 43 173.664 173.708 -0.044 1
1 387 . 19 1 1 A 43 43 GLY CA C 43 45.404 45.111 0.293 1
1 388 . 19 1 1 A 43 43 GLY N N 43 104.633 106.400 -1.767 1
1 389 . 19 1 1 A 44 44 ARG H H 44 7.926 7.640 0.286 1
1 390 . 19 1 1 A 44 44 ARG HA H 44 4.678 4.557 0.121 1
1 395 . 19 1 1 A 44 44 ARG C C 44 175.261 175.308 -0.047 1
1 396 . 19 1 1 A 44 44 ARG CA C 44 55.011 55.401 -0.390 1
1 397 . 19 1 1 A 44 44 ARG CB C 44 32.138 32.086 0.052 1
1 400 . 19 1 1 A 44 44 ARG N N 44 121.239 120.341 0.898 1
1 401 . 19 1 1 A 45 45 ARG H H 45 8.775 8.983 -0.208 1
1 402 . 19 1 1 A 45 45 ARG HA H 45 5.770 5.273 0.497 1
1 409 . 19 1 1 A 45 45 ARG C C 45 176.064 175.055 1.009 1
1 410 . 19 1 1 A 45 45 ARG CA C 45 54.683 53.718 0.965 1
1 411 . 19 1 1 A 45 45 ARG CB C 45 33.748 34.567 -0.819 1
1 414 . 19 1 1 A 45 45 ARG N N 45 125.948 120.736 5.212 1
1 415 . 19 1 1 A 46 46 HIS H H 46 8.912 8.509 0.403 1
1 416 . 19 1 1 A 46 46 HIS HA H 46 4.927 5.522 -0.595 1
1 420 . 19 1 1 A 46 46 HIS C C 46 172.634 172.097 0.537 1
1 421 . 19 1 1 A 46 46 HIS CA C 46 56.480 54.103 2.377 1
1 422 . 19 1 1 A 46 46 HIS CB C 46 33.608 32.704 0.904 1
1 423 . 19 1 1 A 46 46 HIS N N 46 121.825 115.751 6.074 1
1 424 . 19 1 1 A 47 47 THR H H 47 8.532 8.556 -0.024 1
1 425 . 19 1 1 A 47 47 THR HA H 47 5.472 4.603 0.869 1
1 430 . 19 1 1 A 47 47 THR C C 47 174.442 173.949 0.493 1
1 431 . 19 1 1 A 47 47 THR CA C 47 61.093 62.735 -1.642 1
1 432 . 19 1 1 A 47 47 THR CB C 47 71.041 69.242 1.799 1
1 434 . 19 1 1 A 47 47 THR N N 47 115.450 119.685 -4.235 1
1 435 . 19 1 1 A 48 48 VAL H H 48 9.695 9.167 0.528 1
1 436 . 19 1 1 A 48 48 VAL HA H 48 4.677 4.540 0.137 1
1 444 . 19 1 1 A 48 48 VAL CA C 48 58.172 59.415 -1.243 1
1 445 . 19 1 1 A 48 48 VAL CB C 48 34.990 32.755 2.235 1
1 448 . 19 1 1 A 48 48 VAL N N 48 126.721 127.466 -0.745 1
1 449 . 19 1 1 A 49 49 PRO HA H 49 5.087 5.132 -0.045 1
1 453 . 19 1 1 A 49 49 PRO CA C 49 61.671 62.654 -0.983 1
1 454 . 19 1 1 A 49 49 PRO CB C 49 31.923 31.789 0.134 1
1 457 . 19 1 1 A 50 50 ARG H H 50 9.125 9.376 -0.251 1
1 458 . 19 1 1 A 50 50 ARG HA H 50 4.974 4.832 0.142 1
1 464 . 19 1 1 A 50 50 ARG C C 50 176.187 174.895 1.292 1
1 465 . 19 1 1 A 50 50 ARG CA C 50 53.015 55.054 -2.039 1
1 466 . 19 1 1 A 50 50 ARG CB C 50 36.553 33.788 2.765 1
1 468 . 19 1 1 A 50 50 ARG N N 50 124.189 124.053 0.136 1
1 469 . 19 1 1 A 51 51 ARG H H 51 10.105 8.303 1.802 1
1 470 . 19 1 1 A 51 51 ARG HA H 51 5.196 4.091 1.105 1
1 475 . 19 1 1 A 51 51 ARG C C 51 178.865 176.874 1.991 1
1 476 . 19 1 1 A 51 51 ARG CA C 51 55.961 56.201 -0.240 1
1 477 . 19 1 1 A 51 51 ARG CB C 51 32.539 31.726 0.813 1
1 480 . 19 1 1 A 51 51 ARG N N 51 124.521 127.085 -2.564 1
1 481 . 19 1 1 A 52 52 TYR H H 52 10.397 8.861 1.536 1
1 482 . 19 1 1 A 52 52 TYR HA H 52 4.360 3.864 0.496 1
1 487 . 19 1 1 A 52 52 TYR C C 52 178.143 177.535 0.608 1
1 488 . 19 1 1 A 52 52 TYR CA C 52 63.538 61.444 2.094 1
1 489 . 19 1 1 A 52 52 TYR CB C 52 38.784 38.690 0.094 1
1 490 . 19 1 1 A 52 52 TYR N N 52 124.772 128.153 -3.381 1
1 491 . 19 1 1 A 53 53 SER H H 53 9.231 8.274 0.957 1
1 492 . 19 1 1 A 53 53 SER HA H 53 4.175 4.442 -0.267 1
1 493 . 19 1 1 A 53 53 SER C C 53 177.220 177.472 -0.252 1
1 494 . 19 1 1 A 53 53 SER CA C 53 61.606 61.891 -0.285 1
1 495 . 19 1 1 A 53 53 SER N N 53 113.262 114.525 -1.263 1
1 496 . 19 1 1 A 54 54 GLU H H 54 7.807 7.872 -0.065 1
1 497 . 19 1 1 A 54 54 GLU HA H 54 4.392 4.072 0.320 1
1 501 . 19 1 1 A 54 54 GLU C C 54 180.361 178.595 1.766 1
1 502 . 19 1 1 A 54 54 GLU CA C 54 59.497 58.781 0.716 1
1 503 . 19 1 1 A 54 54 GLU CB C 54 30.708 29.446 1.262 1
1 504 . 19 1 1 A 54 54 GLU N N 54 121.949 121.405 0.544 1
1 505 . 19 1 1 A 55 55 PHE H H 55 8.133 7.910 0.223 1
1 506 . 19 1 1 A 55 55 PHE HA H 55 4.007 4.301 -0.294 1
1 513 . 19 1 1 A 55 55 PHE C C 55 176.531 177.439 -0.908 1
1 514 . 19 1 1 A 55 55 PHE CA C 55 61.848 61.286 0.562 1
1 515 . 19 1 1 A 55 55 PHE CB C 55 38.847 38.584 0.263 1
1 516 . 19 1 1 A 55 55 PHE N N 55 119.998 121.647 -1.649 1
1 517 . 19 1 1 A 56 56 HIS H H 56 7.907 8.009 -0.102 1
1 518 . 19 1 1 A 56 56 HIS HA H 56 3.324 3.656 -0.332 1
1 522 . 19 1 1 A 56 56 HIS C C 56 176.748 177.517 -0.769 1
1 523 . 19 1 1 A 56 56 HIS CA C 56 58.770 59.599 -0.829 1
1 524 . 19 1 1 A 56 56 HIS CB C 56 30.404 29.349 1.055 1
1 525 . 19 1 1 A 56 56 HIS N N 56 119.173 116.867 2.306 1
1 526 . 19 1 1 A 57 57 ALA H H 57 7.962 8.286 -0.324 1
1 527 . 19 1 1 A 57 57 ALA HA H 57 3.865 3.936 -0.071 1
1 531 . 19 1 1 A 57 57 ALA C C 57 180.075 179.617 0.458 1
1 532 . 19 1 1 A 57 57 ALA CA C 57 54.996 55.202 -0.206 1
1 533 . 19 1 1 A 57 57 ALA CB C 57 18.226 17.808 0.418 1
1 534 . 19 1 1 A 57 57 ALA N N 57 120.094 121.867 -1.773 1
1 535 . 19 1 1 A 58 58 LEU H H 58 7.295 8.490 -1.195 1
1 536 . 19 1 1 A 58 58 LEU HA H 58 3.994 3.914 0.080 1
1 546 . 19 1 1 A 58 58 LEU C C 58 177.428 178.227 -0.799 1
1 547 . 19 1 1 A 58 58 LEU CA C 58 58.342 57.868 0.474 1
1 548 . 19 1 1 A 58 58 LEU CB C 58 40.851 41.511 -0.660 1
1 552 . 19 1 1 A 58 58 LEU N N 58 119.404 119.811 -0.407 1
1 553 . 19 1 1 A 59 59 HIS H H 59 7.805 7.562 0.243 1
1 554 . 19 1 1 A 59 59 HIS HA H 59 4.286 4.039 0.247 1
1 558 . 19 1 1 A 59 59 HIS C C 59 177.001 177.918 -0.917 1
1 559 . 19 1 1 A 59 59 HIS CA C 59 60.141 59.737 0.404 1
1 560 . 19 1 1 A 59 59 HIS CB C 59 31.072 29.531 1.541 1
1 561 . 19 1 1 A 59 59 HIS N N 59 119.040 116.116 2.924 1
1 562 . 19 1 1 A 60 60 LYS H H 60 7.715 8.202 -0.487 1
1 563 . 19 1 1 A 60 60 LYS HA H 60 3.456 3.956 -0.500 1
1 570 . 19 1 1 A 60 60 LYS C C 60 178.464 178.970 -0.506 1
1 571 . 19 1 1 A 60 60 LYS CA C 60 59.629 59.773 -0.144 1
1 572 . 19 1 1 A 60 60 LYS CB C 60 32.354 32.125 0.229 1
1 576 . 19 1 1 A 60 60 LYS N N 60 114.225 119.212 -4.987 1
1 577 . 19 1 1 A 61 61 ARG H H 61 7.486 7.498 -0.012 1
1 578 . 19 1 1 A 61 61 ARG HA H 61 4.202 4.161 0.041 1
1 584 . 19 1 1 A 61 61 ARG C C 61 178.995 179.179 -0.184 1
1 585 . 19 1 1 A 61 61 ARG CA C 61 58.387 58.678 -0.291 1
1 586 . 19 1 1 A 61 61 ARG CB C 61 31.216 30.032 1.184 1
1 589 . 19 1 1 A 61 61 ARG N N 61 115.929 119.357 -3.428 1
1 590 . 19 1 1 A 62 62 ILE H H 62 8.066 7.607 0.459 1
1 591 . 19 1 1 A 62 62 ILE HA H 62 4.491 3.930 0.561 1
1 601 . 19 1 1 A 62 62 ILE C C 62 177.838 177.781 0.057 1
1 602 . 19 1 1 A 62 62 ILE CA C 62 63.399 63.907 -0.508 1
1 603 . 19 1 1 A 62 62 ILE CB C 62 39.699 37.327 2.372 1
1 606 . 19 1 1 A 62 62 ILE N N 62 111.456 118.886 -7.430 1
1 607 . 19 1 1 A 63 63 LYS H H 63 8.158 7.819 0.339 1
1 608 . 19 1 1 A 63 63 LYS HA H 63 4.136 3.799 0.337 1
1 615 . 19 1 1 A 63 63 LYS C C 63 176.358 178.908 -2.550 1
1 616 . 19 1 1 A 63 63 LYS CA C 63 58.753 60.374 -1.621 1
1 617 . 19 1 1 A 63 63 LYS CB C 63 30.825 32.087 -1.262 1
1 621 . 19 1 1 A 63 63 LYS N N 63 120.800 120.304 0.496 1
1 622 . 19 1 1 A 64 64 LYS H H 64 7.687 7.687 0.000 1
1 623 . 19 1 1 A 64 64 LYS HA H 64 4.301 4.156 0.145 1
1 628 . 19 1 1 A 64 64 LYS C C 64 177.084 177.708 -0.624 1
1 629 . 19 1 1 A 64 64 LYS CA C 64 57.237 57.830 -0.593 1
1 630 . 19 1 1 A 64 64 LYS CB C 64 32.502 32.200 0.302 1
1 634 . 19 1 1 A 64 64 LYS N N 64 116.548 117.790 -1.242 1
1 635 . 19 1 1 A 65 65 LEU H H 65 7.476 7.943 -0.467 1
1 636 . 19 1 1 A 65 65 LEU HA H 65 4.219 4.367 -0.148 1
1 645 . 19 1 1 A 65 65 LEU C C 65 175.886 175.994 -0.108 1
1 646 . 19 1 1 A 65 65 LEU CA C 65 55.542 56.637 -1.095 1
1 647 . 19 1 1 A 65 65 LEU CB C 65 45.493 43.543 1.950 1
1 650 . 19 1 1 A 65 65 LEU N N 65 118.000 120.206 -2.206 1
1 651 . 19 1 1 A 66 66 TYR H H 66 7.672 8.295 -0.623 1
1 652 . 19 1 1 A 66 66 TYR HA H 66 4.762 5.173 -0.411 1
1 660 . 19 1 1 A 66 66 TYR C C 66 174.199 174.071 0.128 1
1 661 . 19 1 1 A 66 66 TYR CA C 66 56.013 55.350 0.663 1
1 662 . 19 1 1 A 66 66 TYR CB C 66 40.380 41.112 -0.732 1
1 663 . 19 1 1 A 66 66 TYR N N 66 116.805 113.705 3.100 1
1 664 . 19 1 1 A 67 67 LYS H H 67 8.547 8.450 0.097 1
1 665 . 19 1 1 A 67 67 LYS HA H 67 4.436 4.457 -0.021 1
1 670 . 19 1 1 A 67 67 LYS C C 67 175.727 175.993 -0.266 1
1 671 . 19 1 1 A 67 67 LYS CA C 67 56.598 56.549 0.049 1
1 672 . 19 1 1 A 67 67 LYS CB C 67 32.743 32.743 0.000 1
1 676 . 19 1 1 A 67 67 LYS N N 67 120.929 120.548 0.381 1
1 677 . 19 1 1 A 68 68 VAL H H 68 8.168 8.102 0.066 1
1 678 . 19 1 1 A 68 68 VAL HA H 68 4.869 4.499 0.370 1
1 686 . 19 1 1 A 68 68 VAL CA C 68 57.389 58.744 -1.355 1
1 687 . 19 1 1 A 68 68 VAL CB C 68 34.017 35.532 -1.515 1
1 690 . 19 1 1 A 68 68 VAL N N 68 116.467 123.481 -7.014 1
1 691 . 19 1 1 A 69 69 PRO HA H 69 4.674 4.721 -0.047 1
1 696 . 19 1 1 A 69 69 PRO C C 69 178.013 175.509 2.504 1
1 697 . 19 1 1 A 69 69 PRO CA C 69 61.443 62.304 -0.861 1
1 698 . 19 1 1 A 69 69 PRO CB C 69 32.231 33.007 -0.776 1
1 701 . 19 1 1 A 70 70 ASP H H 70 8.167 8.634 -0.467 1
1 702 . 19 1 1 A 70 70 ASP HA H 70 4.531 5.016 -0.485 1
1 705 . 19 1 1 A 70 70 ASP C C 70 175.660 176.464 -0.804 1
1 706 . 19 1 1 A 70 70 ASP CA C 70 55.148 53.533 1.615 1
1 707 . 19 1 1 A 70 70 ASP CB C 70 40.876 42.696 -1.820 1
1 708 . 19 1 1 A 70 70 ASP N N 70 116.671 120.888 -4.217 1
1 709 . 19 1 1 A 71 71 PHE H H 71 8.387 8.422 -0.035 1
1 710 . 19 1 1 A 71 71 PHE HA H 71 4.076 4.358 -0.282 1
1 717 . 19 1 1 A 71 71 PHE CA C 71 55.672 55.325 0.347 1
1 718 . 19 1 1 A 71 71 PHE CB C 71 39.155 39.110 0.045 1
1 719 . 19 1 1 A 71 71 PHE N N 71 126.533 120.022 6.511 1
1 720 . 19 1 1 A 72 72 PRO HA H 72 4.156 4.536 -0.380 1
1 727 . 19 1 1 A 72 72 PRO CA C 72 63.079 63.221 -0.142 1
1 728 . 19 1 1 A 72 72 PRO CB C 72 32.107 32.124 -0.017 1
1 731 . 19 1 1 A 73 73 SER H H 73 8.468 8.574 -0.106 1
1 733 . 19 1 1 A 73 73 SER CA C 73 56.133 57.977 -1.844 1
1 734 . 19 1 1 A 73 73 SER CB C 73 63.991 64.344 -0.353 1
1 735 . 19 1 1 A 73 73 SER N N 73 121.533 118.049 3.484 1
1 736 . 19 1 1 A 74 74 LYS HA H 74 4.574 3.972 0.602 1
1 739 . 19 1 1 A 74 74 LYS CA C 74 55.659 58.462 -2.803 1
1 740 . 19 1 1 A 74 74 LYS CB C 74 30.550 32.030 -1.480 1
1 741 . 19 1 1 A 75 75 ARG H H 75 7.962 7.634 0.328 1
1 742 . 19 1 1 A 75 75 ARG HA H 75 4.162 4.425 -0.263 1
1 746 . 19 1 1 A 75 75 ARG CA C 75 56.123 55.732 0.391 1
1 747 . 19 1 1 A 75 75 ARG CB C 75 31.179 30.986 0.193 1
1 749 . 19 1 1 A 75 75 ARG N N 75 121.665 121.039 0.626 1
1 750 . 19 1 1 A 76 76 LEU H H 76 8.071 8.255 -0.184 1
1 751 . 19 1 1 A 76 76 LEU HA H 76 4.618 4.544 0.074 1
1 759 . 19 1 1 A 76 76 LEU CA C 76 52.764 51.154 1.610 1
1 760 . 19 1 1 A 76 76 LEU CB C 76 41.918 44.481 -2.563 1
1 762 . 19 1 1 A 76 76 LEU N N 76 124.196 125.310 -1.114 1
1 763 . 19 1 1 A 77 77 PRO HA H 77 4.393 4.255 0.138 1
1 767 . 19 1 1 A 77 77 PRO CA C 77 63.746 62.337 1.409 1
1 770 . 19 1 1 A 78 78 ASN H H 78 8.379 8.877 -0.498 1
1 771 . 19 1 1 A 78 78 ASN HA H 78 4.586 4.316 0.270 1
1 776 . 19 1 1 A 78 78 ASN C C 78 175.648 175.090 0.558 1
1 777 . 19 1 1 A 78 78 ASN CA C 78 53.591 54.912 -1.321 1
1 778 . 19 1 1 A 78 78 ASN CB C 78 37.826 39.110 -1.284 1
1 779 . 19 1 1 A 78 78 ASN N N 78 115.292 120.533 -5.241 1
1 781 . 19 1 1 A 79 79 TRP H H 79 7.900 8.107 -0.207 1
1 782 . 19 1 1 A 79 79 TRP HA H 79 4.326 4.231 0.095 1
1 788 . 19 1 1 A 79 79 TRP CA C 79 58.825 61.706 -2.881 1
1 789 . 19 1 1 A 79 79 TRP CB C 79 29.090 27.462 1.628 1
1 790 . 19 1 1 A 79 79 TRP N N 79 119.525 118.473 1.052 1
1 792 . 19 1 1 A 80 80 ARG H H 80 8.060 8.883 -0.823 1
1 793 . 19 1 1 A 80 80 ARG HA H 80 3.913 4.085 -0.172 1
1 798 . 19 1 1 A 80 80 ARG C C 80 177.024 178.634 -1.610 1
1 799 . 19 1 1 A 80 80 ARG CA C 80 58.292 59.281 -0.989 1
1 800 . 19 1 1 A 80 80 ARG CB C 80 30.146 30.078 0.068 1
1 803 . 19 1 1 A 80 80 ARG N N 80 118.864 118.963 -0.099 1
1 804 . 19 1 1 A 81 81 THR H H 81 7.725 7.661 0.064 1
1 805 . 19 1 1 A 81 81 THR HA H 81 4.297 4.324 -0.027 1
1 809 . 19 1 1 A 81 81 THR CA C 81 62.481 63.182 -0.701 1
1 811 . 19 1 1 A 81 81 THR N N 81 109.863 108.906 0.957 1
1 812 . 19 1 1 A 82 82 ARG HA H 82 4.341 4.878 -0.537 1
1 816 . 19 1 1 A 82 82 ARG C C 82 177.261 176.127 1.134 1
1 817 . 19 1 1 A 82 82 ARG CA C 82 56.846 55.156 1.690 1
1 818 . 19 1 1 A 82 82 ARG CB C 82 30.288 34.666 -4.378 1
1 820 . 19 1 1 A 83 83 GLY H H 83 8.321 8.487 -0.166 1
1 821 . 19 1 1 A 83 83 GLY HA2 H 83 3.957 4.067 -0.110 1
1 822 . 19 1 1 A 83 83 GLY C C 83 175.185 176.229 -1.044 1
1 823 . 19 1 1 A 83 83 GLY CA C 83 46.297 45.717 0.580 1
1 824 . 19 1 1 A 83 83 GLY N N 83 109.146 110.042 -0.896 1
1 825 . 19 1 1 A 84 84 LEU H H 84 8.303 8.358 -0.055 1
1 826 . 19 1 1 A 84 84 LEU HA H 84 4.018 3.982 0.036 1
1 835 . 19 1 1 A 84 84 LEU C C 84 178.552 178.719 -0.167 1
1 836 . 19 1 1 A 84 84 LEU CA C 84 58.236 57.559 0.677 1
1 837 . 19 1 1 A 84 84 LEU CB C 84 41.837 41.447 0.390 1
1 840 . 19 1 1 A 84 84 LEU N N 84 122.662 122.576 0.086 1
1 841 . 19 1 1 A 85 85 GLU H H 85 8.233 7.835 0.398 1
1 842 . 19 1 1 A 85 85 GLU HA H 85 4.371 2.800 1.571 1
1 846 . 19 1 1 A 85 85 GLU C C 85 178.555 178.997 -0.442 1
1 847 . 19 1 1 A 85 85 GLU CA C 85 58.377 58.359 0.018 1
1 848 . 19 1 1 A 85 85 GLU CB C 85 28.675 28.455 0.220 1
1 850 . 19 1 1 A 85 85 GLU N N 85 119.781 120.081 -0.300 1
1 851 . 19 1 1 A 86 86 GLN H H 86 7.877 7.751 0.126 1
1 852 . 19 1 1 A 86 86 GLN HA H 86 4.100 4.051 0.049 1
1 858 . 19 1 1 A 86 86 GLN C C 86 179.557 178.040 1.517 1
1 859 . 19 1 1 A 86 86 GLN CA C 86 58.955 59.040 -0.085 1
1 860 . 19 1 1 A 86 86 GLN CB C 86 28.191 28.427 -0.236 1
1 862 . 19 1 1 A 86 86 GLN N N 86 118.042 118.531 -0.489 1
1 863 . 19 1 1 A 87 87 ARG H H 87 8.169 8.568 -0.399 1
1 864 . 19 1 1 A 87 87 ARG HA H 87 3.975 4.137 -0.162 1
1 868 . 19 1 1 A 87 87 ARG C C 87 177.051 178.642 -1.591 1
1 869 . 19 1 1 A 87 87 ARG CA C 87 59.006 59.696 -0.690 1
1 870 . 19 1 1 A 87 87 ARG CB C 87 30.383 30.030 0.353 1
1 872 . 19 1 1 A 87 87 ARG N N 87 121.381 120.393 0.988 1
1 873 . 19 1 1 A 88 88 ARG H H 88 8.593 7.733 0.860 1
1 874 . 19 1 1 A 88 88 ARG HA H 88 3.726 3.911 -0.185 1
1 876 . 19 1 1 A 88 88 ARG C C 88 177.520 178.529 -1.009 1
1 877 . 19 1 1 A 88 88 ARG CA C 88 60.751 59.574 1.177 1
1 878 . 19 1 1 A 88 88 ARG CB C 88 30.153 30.008 0.145 1
1 879 . 19 1 1 A 88 88 ARG N N 88 120.863 119.128 1.735 1
1 880 . 19 1 1 A 89 89 GLN H H 89 8.355 7.875 0.480 1
1 881 . 19 1 1 A 89 89 GLN HA H 89 3.887 3.950 -0.063 1
1 887 . 19 1 1 A 89 89 GLN C C 89 179.499 178.496 1.003 1
1 888 . 19 1 1 A 89 89 GLN CA C 89 59.603 59.428 0.175 1
1 889 . 19 1 1 A 89 89 GLN CB C 89 28.464 28.087 0.377 1
1 891 . 19 1 1 A 89 89 GLN N N 89 116.860 118.630 -1.770 1
1 893 . 19 1 1 A 90 90 GLY H H 90 8.406 8.733 -0.327 1
1 894 . 19 1 1 A 90 90 GLY HA2 H 90 3.672 3.698 -0.026 1
1 895 . 19 1 1 A 90 90 GLY HA3 H 90 3.871 3.702 0.169 1
1 896 . 19 1 1 A 90 90 GLY C C 90 177.033 175.677 1.356 1
1 897 . 19 1 1 A 90 90 GLY CA C 90 46.813 47.329 -0.516 1
1 898 . 19 1 1 A 90 90 GLY N N 90 107.679 107.488 0.191 1
1 899 . 19 1 1 A 91 91 LEU H H 91 8.504 8.202 0.302 1
1 900 . 19 1 1 A 91 91 LEU HA H 91 3.784 3.937 -0.153 1
1 910 . 19 1 1 A 91 91 LEU C C 91 178.003 179.289 -1.286 1
1 911 . 19 1 1 A 91 91 LEU CA C 91 57.354 57.532 -0.178 1
1 912 . 19 1 1 A 91 91 LEU CB C 91 40.359 41.081 -0.722 1
1 916 . 19 1 1 A 91 91 LEU N N 91 123.959 121.237 2.722 1
1 917 . 19 1 1 A 92 92 GLU H H 92 8.324 8.648 -0.324 1
1 918 . 19 1 1 A 92 92 GLU HA H 92 3.732 3.840 -0.108 1
1 922 . 19 1 1 A 92 92 GLU C C 92 177.272 178.850 -1.578 1
1 923 . 19 1 1 A 92 92 GLU CA C 92 60.651 59.707 0.944 1
1 924 . 19 1 1 A 92 92 GLU CB C 92 30.843 29.498 1.345 1
1 926 . 19 1 1 A 92 92 GLU N N 92 121.991 121.083 0.908 1
1 927 . 19 1 1 A 93 93 ALA H H 93 8.126 7.898 0.228 1
1 928 . 19 1 1 A 93 93 ALA HA H 93 4.160 4.148 0.012 1
1 932 . 19 1 1 A 93 93 ALA C C 93 180.818 179.579 1.239 1
1 933 . 19 1 1 A 93 93 ALA CA C 93 54.828 54.978 -0.150 1
1 934 . 19 1 1 A 93 93 ALA CB C 93 18.032 18.321 -0.289 1
1 935 . 19 1 1 A 93 93 ALA N N 93 120.066 121.390 -1.324 1
1 936 . 19 1 1 A 94 94 TYR H H 94 7.916 7.809 0.107 1
1 937 . 19 1 1 A 94 94 TYR HA H 94 4.139 4.294 -0.155 1
1 942 . 19 1 1 A 94 94 TYR C C 94 175.895 176.950 -1.055 1
1 943 . 19 1 1 A 94 94 TYR CA C 94 61.915 61.479 0.436 1
1 944 . 19 1 1 A 94 94 TYR CB C 94 38.740 38.558 0.182 1
1 945 . 19 1 1 A 94 94 TYR N N 94 121.179 119.868 1.311 1
1 946 . 19 1 1 A 95 95 ILE H H 95 7.983 8.474 -0.491 1
1 947 . 19 1 1 A 95 95 ILE HA H 95 3.614 3.674 -0.060 1
1 957 . 19 1 1 A 95 95 ILE C C 95 174.678 178.207 -3.529 1
1 958 . 19 1 1 A 95 95 ILE CA C 95 63.461 64.385 -0.924 1
1 959 . 19 1 1 A 95 95 ILE CB C 95 36.625 36.535 0.090 1
1 963 . 19 1 1 A 95 95 ILE N N 95 116.397 120.348 -3.951 1
1 964 . 19 1 1 A 96 96 GLN H H 96 8.175 8.060 0.115 1
1 965 . 19 1 1 A 96 96 GLN HA H 96 3.763 4.026 -0.263 1
1 970 . 19 1 1 A 96 96 GLN C C 96 179.042 178.426 0.616 1
1 971 . 19 1 1 A 96 96 GLN CA C 96 59.270 59.886 -0.616 1
1 972 . 19 1 1 A 96 96 GLN CB C 96 27.696 28.051 -0.355 1
1 974 . 19 1 1 A 96 96 GLN N N 96 116.631 121.100 -4.469 1
1 976 . 19 1 1 A 97 97 GLY H H 97 8.222 8.248 -0.026 1
1 977 . 19 1 1 A 97 97 GLY HA2 H 97 3.661 3.682 -0.021 1
1 978 . 19 1 1 A 97 97 GLY HA3 H 97 3.806 3.750 0.056 1
1 979 . 19 1 1 A 97 97 GLY C C 97 175.449 176.029 -0.580 1
1 980 . 19 1 1 A 97 97 GLY CA C 97 46.917 47.357 -0.440 1
1 981 . 19 1 1 A 97 97 GLY N N 97 107.315 106.886 0.429 1
1 982 . 19 1 1 A 98 98 ILE H H 98 7.630 7.943 -0.313 1
1 983 . 19 1 1 A 98 98 ILE HA H 98 3.399 3.892 -0.493 1
1 993 . 19 1 1 A 98 98 ILE C C 98 178.683 178.017 0.666 1
1 994 . 19 1 1 A 98 98 ILE CA C 98 66.402 64.714 1.688 1
1 995 . 19 1 1 A 98 98 ILE CB C 98 38.037 37.381 0.656 1
1 999 . 19 1 1 A 98 98 ILE N N 98 120.644 120.456 0.188 1
1 1000 . 19 1 1 A 99 99 LEU H H 99 7.076 8.066 -0.990 1
1 1001 . 19 1 1 A 99 99 LEU HA H 99 4.133 4.272 -0.139 1
1 1010 . 19 1 1 A 99 99 LEU C C 99 178.128 178.040 0.088 1
1 1011 . 19 1 1 A 99 99 LEU CA C 99 57.129 58.001 -0.872 1
1 1012 . 19 1 1 A 99 99 LEU CB C 99 41.108 41.708 -0.600 1
1 1014 . 19 1 1 A 99 99 LEU N N 99 116.844 123.840 -6.996 1
1 1015 . 19 1 1 A 100 100 TYR H H 100 7.890 8.239 -0.349 1
1 1016 . 19 1 1 A 100 100 TYR HA H 100 4.550 4.250 0.300 1
1 1021 . 19 1 1 A 100 100 TYR C C 100 178.210 177.566 0.644 1
1 1022 . 19 1 1 A 100 100 TYR CA C 100 59.452 60.293 -0.841 1
1 1023 . 19 1 1 A 100 100 TYR CB C 100 38.786 39.689 -0.903 1
1 1024 . 19 1 1 A 100 100 TYR N N 100 116.427 120.255 -3.828 1
1 1025 . 19 1 1 A 101 101 LEU H H 101 8.041 7.941 0.100 1
1 1026 . 19 1 1 A 101 101 LEU HA H 101 4.158 3.942 0.216 1
1 1036 . 19 1 1 A 101 101 LEU C C 101 176.808 177.354 -0.546 1
1 1037 . 19 1 1 A 101 101 LEU CA C 101 56.156 58.177 -2.021 1
1 1038 . 19 1 1 A 101 101 LEU CB C 101 44.307 41.731 2.576 1
1 1041 . 19 1 1 A 101 101 LEU N N 101 116.493 120.084 -3.591 1
1 1042 . 19 1 1 A 102 102 ASN H H 102 7.146 7.848 -0.702 1
1 1043 . 19 1 1 A 102 102 ASN HA H 102 5.056 5.085 -0.029 1
1 1046 . 19 1 1 A 102 102 ASN CA C 102 52.704 54.809 -2.105 1
1 1047 . 19 1 1 A 102 102 ASN CB C 102 42.424 40.142 2.282 1
1 1048 . 19 1 1 A 102 102 ASN N N 102 114.922 113.234 1.688 1
1 1049 . 19 1 1 A 103 103 GLN H H 103 8.477 7.861 0.616 1
1 1050 . 19 1 1 A 103 103 GLN HA H 103 3.866 4.234 -0.368 1
1 1054 . 19 1 1 A 103 103 GLN C C 103 176.110 175.545 0.565 1
1 1055 . 19 1 1 A 103 103 GLN CA C 103 58.451 56.102 2.349 1
1 1056 . 19 1 1 A 103 103 GLN CB C 103 28.896 28.547 0.349 1
1 1058 . 19 1 1 A 103 103 GLN N N 103 120.252 119.364 0.888 1
1 1059 . 19 1 1 A 104 104 GLU H H 104 7.930 8.141 -0.211 1
1 1060 . 19 1 1 A 104 104 GLU HA H 104 4.591 4.605 -0.014 1
1 1064 . 19 1 1 A 104 104 GLU C C 104 175.397 175.597 -0.200 1
1 1065 . 19 1 1 A 104 104 GLU CA C 104 54.058 58.488 -4.430 1
1 1066 . 19 1 1 A 104 104 GLU CB C 104 31.272 29.171 2.101 1
1 1068 . 19 1 1 A 104 104 GLU N N 104 117.295 120.266 -2.971 1
1 1069 . 19 1 1 A 105 105 VAL H H 105 8.546 8.095 0.451 1
1 1070 . 19 1 1 A 105 105 VAL HA H 105 3.823 4.446 -0.623 1
1 1078 . 19 1 1 A 105 105 VAL CA C 105 60.706 59.221 1.485 1
1 1079 . 19 1 1 A 105 105 VAL CB C 105 32.126 32.459 -0.333 1
1 1082 . 19 1 1 A 105 105 VAL N N 105 124.511 123.735 0.776 1
1 1083 . 19 1 1 A 106 106 PRO HA H 106 3.997 4.804 -0.807 1
1 1089 . 19 1 1 A 106 106 PRO C C 106 178.240 177.644 0.596 1
1 1090 . 19 1 1 A 106 106 PRO CA C 106 62.961 63.107 -0.146 1
1 1091 . 19 1 1 A 106 106 PRO CB C 106 32.321 31.681 0.640 1
1 1094 . 19 1 1 A 107 107 LYS H H 107 9.122 8.859 0.263 1
1 1095 . 19 1 1 A 107 107 LYS HA H 107 3.813 3.894 -0.081 1
1 1101 . 19 1 1 A 107 107 LYS C C 107 178.563 177.646 0.917 1
1 1102 . 19 1 1 A 107 107 LYS CA C 107 60.085 59.486 0.599 1
1 1103 . 19 1 1 A 107 107 LYS CB C 107 31.632 32.279 -0.647 1
1 1106 . 19 1 1 A 107 107 LYS N N 107 129.017 125.162 3.855 1
1 1107 . 19 1 1 A 108 108 GLU H H 108 10.370 7.872 2.498 1
1 1108 . 19 1 1 A 108 108 GLU HA H 108 3.991 4.170 -0.179 1
1 1111 . 19 1 1 A 108 108 GLU C C 108 180.366 178.761 1.605 1
1 1112 . 19 1 1 A 108 108 GLU CA C 108 60.337 58.851 1.486 1
1 1113 . 19 1 1 A 108 108 GLU CB C 108 29.178 29.635 -0.457 1
1 1115 . 19 1 1 A 108 108 GLU N N 108 118.335 118.629 -0.294 1
1 1116 . 19 1 1 A 109 109 LEU H H 109 7.393 7.615 -0.222 1
1 1117 . 19 1 1 A 109 109 LEU HA H 109 4.220 4.103 0.117 1
1 1126 . 19 1 1 A 109 109 LEU C C 109 177.378 178.832 -1.454 1
1 1127 . 19 1 1 A 109 109 LEU CA C 109 56.618 57.779 -1.161 1
1 1128 . 19 1 1 A 109 109 LEU CB C 109 41.898 41.144 0.754 1
1 1131 . 19 1 1 A 109 109 LEU N N 109 118.285 120.672 -2.387 1
1 1132 . 19 1 1 A 110 110 LEU H H 110 7.641 7.910 -0.269 1
1 1133 . 19 1 1 A 110 110 LEU HA H 110 3.796 3.838 -0.042 1
1 1142 . 19 1 1 A 110 110 LEU C C 110 179.103 178.627 0.476 1
1 1143 . 19 1 1 A 110 110 LEU CA C 110 59.046 58.283 0.763 1
1 1144 . 19 1 1 A 110 110 LEU CB C 110 40.228 41.857 -1.629 1
1 1147 . 19 1 1 A 110 110 LEU N N 110 120.162 121.470 -1.308 1
1 1148 . 19 1 1 A 111 111 GLU H H 111 7.916 8.222 -0.306 1
1 1149 . 19 1 1 A 111 111 GLU HA H 111 4.080 4.068 0.012 1
1 1153 . 19 1 1 A 111 111 GLU C C 111 179.967 178.549 1.418 1
1 1154 . 19 1 1 A 111 111 GLU CA C 111 59.243 59.197 0.046 1
1 1155 . 19 1 1 A 111 111 GLU CB C 111 29.576 29.227 0.349 1
1 1157 . 19 1 1 A 111 111 GLU N N 111 117.360 119.129 -1.769 1
1 1158 . 19 1 1 A 112 112 PHE H H 112 7.712 7.776 -0.064 1
1 1159 . 19 1 1 A 112 112 PHE HA H 112 4.224 4.125 0.099 1
1 1164 . 19 1 1 A 112 112 PHE C C 112 177.180 176.921 0.259 1
1 1165 . 19 1 1 A 112 112 PHE CA C 112 61.407 61.217 0.190 1
1 1166 . 19 1 1 A 112 112 PHE CB C 112 40.172 39.592 0.580 1
1 1167 . 19 1 1 A 112 112 PHE N N 112 123.042 121.979 1.063 1
1 1168 . 19 1 1 A 113 113 LEU H H 113 8.056 7.283 0.773 1
1 1169 . 19 1 1 A 113 113 LEU HA H 113 4.147 4.088 0.059 1
1 1175 . 19 1 1 A 113 113 LEU C C 113 173.717 175.778 -2.061 1
1 1176 . 19 1 1 A 113 113 LEU CA C 113 54.093 54.171 -0.078 1
1 1177 . 19 1 1 A 113 113 LEU CB C 113 41.517 41.671 -0.154 1
1 1179 . 19 1 1 A 113 113 LEU N N 113 115.595 116.811 -1.216 1
1 1180 . 19 1 1 A 114 114 ARG H H 114 7.902 7.675 0.227 1
1 1181 . 19 1 1 A 114 114 ARG HA H 114 3.817 3.947 -0.130 1
1 1182 . 19 1 1 A 114 114 ARG C C 114 174.566 176.016 -1.450 1
1 1183 . 19 1 1 A 114 114 ARG CA C 114 57.233 57.027 0.206 1
1 1184 . 19 1 1 A 114 114 ARG CB C 114 27.788 27.141 0.647 1
1 1185 . 19 1 1 A 114 114 ARG N N 114 116.021 115.485 0.536 1
1 1186 . 19 1 1 A 115 115 LEU H H 115 8.160 7.650 0.510 1
1 1187 . 19 1 1 A 115 115 LEU HA H 115 4.462 3.556 0.906 1
1 1195 . 19 1 1 A 115 115 LEU C C 115 176.374 176.438 -0.064 1
1 1196 . 19 1 1 A 115 115 LEU CA C 115 53.965 55.431 -1.466 1
1 1197 . 19 1 1 A 115 115 LEU CB C 115 44.077 41.078 2.999 1
1 1199 . 19 1 1 A 115 115 LEU N N 115 118.089 118.542 -0.453 1
1 1200 . 19 1 1 A 116 116 ARG H H 116 8.066 7.700 0.366 1
1 1201 . 19 1 1 A 116 116 ARG HA H 116 4.172 4.438 -0.266 1
1 1203 . 19 1 1 A 116 116 ARG CA C 116 55.961 56.518 -0.557 1
1 1204 . 19 1 1 A 116 116 ARG CB C 116 31.379 30.406 0.973 1
1 1205 . 19 1 1 A 116 116 ARG N N 116 120.852 119.297 1.555 1
1 1206 . 19 1 1 A 117 117 HIS H H 117 7.928 8.916 -0.988 1
1 1207 . 19 1 1 A 117 117 HIS HA H 117 4.557 4.323 0.234 1
1 1211 . 19 1 1 A 117 117 HIS CA C 117 55.937 57.213 -1.276 1
1 1212 . 19 1 1 A 117 117 HIS CB C 117 30.875 27.518 3.357 1
1 1213 . 19 1 1 A 118 118 PHE H H 118 8.183 7.631 0.552 1
1 1214 . 19 1 1 A 118 118 PHE HA H 118 4.730 4.339 0.391 1
1 1219 . 19 1 1 A 118 118 PHE CA C 118 55.716 56.556 -0.840 1
1 1220 . 19 1 1 A 118 118 PHE CB C 118 39.263 38.136 1.127 1
1 1221 . 19 1 1 A 118 118 PHE N N 118 123.480 119.359 4.121 1
1 1222 . 19 1 1 A 119 119 PRO HA H 119 4.398 4.647 -0.249 1
1 1227 . 19 1 1 A 119 119 PRO C C 119 176.666 175.380 1.286 1
1 1228 . 19 1 1 A 119 119 PRO CA C 119 63.377 62.581 0.796 1
1 1229 . 19 1 1 A 119 119 PRO CB C 119 32.059 32.790 -0.731 1
1 1232 . 19 1 1 A 120 120 THR H H 120 8.054 8.614 -0.560 1
1 1233 . 19 1 1 A 120 120 THR HA H 120 4.273 4.972 -0.699 1
1 1238 . 19 1 1 A 120 120 THR C C 120 174.154 171.572 2.582 1
1 1239 . 19 1 1 A 120 120 THR CA C 120 61.893 59.896 1.997 1
1 1240 . 19 1 1 A 120 120 THR CB C 120 69.736 70.969 -1.233 1
1 1242 . 19 1 1 A 120 120 THR N N 120 113.088 115.697 -2.609 1
1 1243 . 19 1 1 A 121 121 ASP H H 121 8.209 9.376 -1.167 1
1 1244 . 19 1 1 A 121 121 ASP HA H 121 4.876 5.124 -0.248 1
1 1247 . 19 1 1 A 121 121 ASP CA C 121 52.126 50.816 1.310 1
1 1248 . 19 1 1 A 121 121 ASP CB C 121 41.553 42.312 -0.759 1
1 1249 . 19 1 1 A 121 121 ASP N N 121 123.630 122.430 1.200 1
1 1250 . 19 1 1 A 122 122 PRO HA H 122 4.363 4.514 -0.151 1
1 1255 . 19 1 1 A 122 122 PRO C C 122 177.344 176.587 0.757 1
1 1256 . 19 1 1 A 122 122 PRO CA C 122 63.913 62.551 1.362 1
1 1257 . 19 1 1 A 122 122 PRO CB C 122 32.116 32.793 -0.677 1
1 1260 . 19 1 1 A 123 123 LYS H H 123 8.344 8.760 -0.416 1
1 1261 . 19 1 1 A 123 123 LYS HA H 123 4.244 4.157 0.087 1
1 1266 . 19 1 1 A 123 123 LYS C C 123 176.637 176.763 -0.126 1
1 1267 . 19 1 1 A 123 123 LYS CA C 123 56.359 57.245 -0.886 1
1 1268 . 19 1 1 A 123 123 LYS CB C 123 32.367 31.241 1.126 1
1 1272 . 19 1 1 A 123 123 LYS N N 123 119.110 116.267 2.843 1
1 1273 . 19 1 1 A 124 124 ALA H H 124 7.929 8.593 -0.664 1
1 1274 . 19 1 1 A 124 124 ALA HA H 124 4.248 4.334 -0.086 1
1 1278 . 19 1 1 A 124 124 ALA C C 124 177.648 176.851 0.797 1
1 1279 . 19 1 1 A 124 124 ALA CA C 124 52.618 54.087 -1.469 1
1 1280 . 19 1 1 A 124 124 ALA CB C 124 19.379 18.909 0.470 1
1 1281 . 19 1 1 A 124 124 ALA N N 124 123.825 127.075 -3.250 1
1 1282 . 19 1 1 A 125 125 SER H H 125 8.134 7.780 0.354 1
1 1283 . 19 1 1 A 125 125 SER HA H 125 4.341 4.956 -0.615 1
1 1286 . 19 1 1 A 125 125 SER C C 125 174.172 172.705 1.467 1
1 1287 . 19 1 1 A 125 125 SER CA C 125 58.391 57.730 0.661 1
1 1288 . 19 1 1 A 125 125 SER CB C 125 63.748 65.061 -1.313 1
1 1289 . 19 1 1 A 125 125 SER N N 125 114.454 110.007 4.447 1
1 1290 . 19 1 1 A 126 126 ASN H H 126 8.242 8.601 -0.359 1
1 1291 . 19 1 1 A 126 126 ASN HA H 126 4.657 5.164 -0.507 1
1 1294 . 19 1 1 A 126 126 ASN C C 126 174.624 173.640 0.984 1
1 1295 . 19 1 1 A 126 126 ASN CA C 126 53.292 52.752 0.540 1
1 1296 . 19 1 1 A 126 126 ASN CB C 126 38.797 40.853 -2.056 1
1 1297 . 19 1 1 A 126 126 ASN N N 126 120.102 124.904 -4.802 1
1 1298 . 19 1 1 A 127 127 TRP H H 127 8.051 9.087 -1.036 1
1 1299 . 19 1 1 A 127 127 TRP HA H 127 4.694 4.851 -0.157 1
1 1302 . 19 1 1 A 127 127 TRP C C 127 175.479 176.333 -0.854 1
1 1303 . 19 1 1 A 127 127 TRP CA C 127 57.096 57.531 -0.435 1
1 1304 . 19 1 1 A 127 127 TRP CB C 127 29.820 29.500 0.320 1
1 1305 . 19 1 1 A 127 127 TRP N N 127 121.198 129.553 -8.355 1
1 1 . 20 1 1 A 7 7 HIS HA H 7 4.623 4.612 0.011 1
1 4 . 20 1 1 A 7 7 HIS C C 7 174.747 175.107 -0.360 1
1 5 . 20 1 1 A 7 7 HIS CA C 7 56.189 54.147 2.042 1
1 6 . 20 1 1 A 7 7 HIS CB C 7 30.028 30.008 0.020 1
1 7 . 20 1 1 A 8 8 LEU H H 8 8.283 7.185 1.098 1
1 8 . 20 1 1 A 8 8 LEU HA H 8 4.249 4.102 0.147 1
1 10 . 20 1 1 A 8 8 LEU C C 8 176.700 176.432 0.268 1
1 11 . 20 1 1 A 8 8 LEU CA C 8 55.498 54.774 0.724 1
1 12 . 20 1 1 A 8 8 LEU CB C 8 42.568 42.060 0.508 1
1 13 . 20 1 1 A 8 8 LEU N N 8 122.916 118.967 3.949 1
1 14 . 20 1 1 A 9 9 GLU H H 9 8.623 8.930 -0.307 1
1 15 . 20 1 1 A 9 9 GLU HA H 9 4.311 3.786 0.525 1
1 16 . 20 1 1 A 9 9 GLU C C 9 174.811 175.179 -0.368 1
1 17 . 20 1 1 A 9 9 GLU CA C 9 56.377 57.267 -0.890 1
1 18 . 20 1 1 A 9 9 GLU CB C 9 29.557 27.723 1.834 1
1 20 . 20 1 1 A 9 9 GLU N N 9 121.512 117.859 3.653 1
1 21 . 20 1 1 A 10 10 LEU H H 10 7.853 7.694 0.159 1
1 22 . 20 1 1 A 10 10 LEU HA H 10 5.225 5.501 -0.276 1
1 31 . 20 1 1 A 10 10 LEU C C 10 174.637 175.246 -0.609 1
1 32 . 20 1 1 A 10 10 LEU CA C 10 54.513 53.821 0.692 1
1 33 . 20 1 1 A 10 10 LEU CB C 10 45.187 42.637 2.550 1
1 36 . 20 1 1 A 10 10 LEU N N 10 123.592 120.320 3.272 1
1 37 . 20 1 1 A 11 11 GLU H H 11 8.894 8.908 -0.014 1
1 38 . 20 1 1 A 11 11 GLU HA H 11 4.765 4.954 -0.189 1
1 43 . 20 1 1 A 11 11 GLU C C 11 174.563 175.735 -1.172 1
1 44 . 20 1 1 A 11 11 GLU CA C 11 55.047 55.285 -0.238 1
1 45 . 20 1 1 A 11 11 GLU CB C 11 33.760 30.903 2.857 1
1 47 . 20 1 1 A 11 11 GLU N N 11 124.055 124.142 -0.087 1
1 48 . 20 1 1 A 12 12 VAL H H 12 8.607 8.822 -0.215 1
1 49 . 20 1 1 A 12 12 VAL HA H 12 5.174 5.229 -0.055 1
1 57 . 20 1 1 A 12 12 VAL C C 12 173.573 174.975 -1.402 1
1 58 . 20 1 1 A 12 12 VAL CA C 12 60.296 61.050 -0.754 1
1 59 . 20 1 1 A 12 12 VAL CB C 12 35.689 34.496 1.193 1
1 62 . 20 1 1 A 12 12 VAL N N 12 120.878 124.844 -3.966 1
1 63 . 20 1 1 A 13 13 HIS H H 13 8.982 9.047 -0.065 1
1 64 . 20 1 1 A 13 13 HIS HA H 13 4.824 5.141 -0.317 1
1 69 . 20 1 1 A 13 13 HIS C C 13 173.236 171.744 1.492 1
1 70 . 20 1 1 A 13 13 HIS CA C 13 54.906 54.429 0.477 1
1 71 . 20 1 1 A 13 13 HIS CB C 13 33.496 31.984 1.512 1
1 72 . 20 1 1 A 13 13 HIS N N 13 121.504 121.464 0.040 1
1 73 . 20 1 1 A 14 14 ILE H H 14 10.442 8.989 1.453 1
1 74 . 20 1 1 A 14 14 ILE HA H 14 5.458 4.653 0.805 1
1 84 . 20 1 1 A 14 14 ILE CA C 14 58.386 57.817 0.569 1
1 85 . 20 1 1 A 14 14 ILE CB C 14 38.596 38.327 0.269 1
1 88 . 20 1 1 A 14 14 ILE N N 14 119.923 121.078 -1.155 1
1 89 . 20 1 1 A 15 15 PRO HA H 15 4.560 4.556 0.004 1
1 95 . 20 1 1 A 15 15 PRO C C 15 176.907 176.485 0.422 1
1 96 . 20 1 1 A 15 15 PRO CA C 15 64.342 64.430 -0.088 1
1 97 . 20 1 1 A 15 15 PRO CB C 15 32.924 32.328 0.596 1
1 100 . 20 1 1 A 16 16 SER H H 16 7.331 7.737 -0.406 1
1 101 . 20 1 1 A 16 16 SER HA H 16 4.822 5.024 -0.202 1
1 104 . 20 1 1 A 16 16 SER C C 16 171.253 172.367 -1.114 1
1 105 . 20 1 1 A 16 16 SER CA C 16 57.135 57.828 -0.693 1
1 106 . 20 1 1 A 16 16 SER CB C 16 65.947 67.001 -1.054 1
1 107 . 20 1 1 A 16 16 SER N N 16 107.745 113.859 -6.114 1
1 108 . 20 1 1 A 17 17 VAL H H 17 8.350 8.423 -0.073 1
1 109 . 20 1 1 A 17 17 VAL HA H 17 4.926 5.130 -0.204 1
1 117 . 20 1 1 A 17 17 VAL C C 17 173.692 175.112 -1.420 1
1 118 . 20 1 1 A 17 17 VAL CA C 17 58.721 60.692 -1.971 1
1 119 . 20 1 1 A 17 17 VAL CB C 17 34.420 34.743 -0.323 1
1 122 . 20 1 1 A 17 17 VAL N N 17 118.680 123.484 -4.804 1
1 123 . 20 1 1 A 18 18 GLY H H 18 8.332 8.869 -0.537 1
1 124 . 20 1 1 A 18 18 GLY HA2 H 18 4.189 4.341 -0.152 1
1 125 . 20 1 1 A 18 18 GLY HA3 H 18 4.011 4.347 -0.336 1
1 126 . 20 1 1 A 18 18 GLY CA C 18 45.356 44.731 0.625 1
1 127 . 20 1 1 A 18 18 GLY N N 18 112.549 114.005 -1.456 1
1 128 . 20 1 1 A 19 19 PRO HA H 19 4.757 5.155 -0.398 1
1 134 . 20 1 1 A 19 19 PRO C C 19 177.482 175.926 1.556 1
1 135 . 20 1 1 A 19 19 PRO CA C 19 62.848 62.262 0.586 1
1 136 . 20 1 1 A 19 19 PRO CB C 19 32.283 29.876 2.407 1
1 139 . 20 1 1 A 20 20 GLU H H 20 8.588 8.036 0.552 1
1 140 . 20 1 1 A 20 20 GLU HA H 20 4.147 4.484 -0.337 1
1 144 . 20 1 1 A 20 20 GLU C C 20 175.857 176.173 -0.316 1
1 145 . 20 1 1 A 20 20 GLU CA C 20 57.150 55.660 1.490 1
1 146 . 20 1 1 A 20 20 GLU CB C 20 30.923 30.461 0.462 1
1 148 . 20 1 1 A 20 20 GLU N N 20 122.087 119.191 2.896 1
1 149 . 20 1 1 A 21 21 ALA H H 21 8.352 7.189 1.163 1
1 150 . 20 1 1 A 21 21 ALA HA H 21 4.391 4.600 -0.209 1
1 154 . 20 1 1 A 21 21 ALA C C 21 174.910 176.905 -1.995 1
1 155 . 20 1 1 A 21 21 ALA CA C 21 52.166 50.221 1.945 1
1 156 . 20 1 1 A 21 21 ALA CB C 21 19.915 22.102 -2.187 1
1 157 . 20 1 1 A 21 21 ALA N N 21 124.593 122.426 2.167 1
1 158 . 20 1 1 A 22 22 GLU H H 22 8.398 8.354 0.044 1
1 159 . 20 1 1 A 22 22 GLU HA H 22 4.331 4.639 -0.308 1
1 163 . 20 1 1 A 22 22 GLU C C 22 176.389 176.616 -0.227 1
1 164 . 20 1 1 A 22 22 GLU CA C 22 56.316 55.465 0.851 1
1 165 . 20 1 1 A 22 22 GLU CB C 22 30.713 30.814 -0.101 1
1 167 . 20 1 1 A 22 22 GLU N N 22 120.159 118.780 1.379 1
1 168 . 20 1 1 A 23 23 GLY H H 23 8.246 8.919 -0.673 1
1 169 . 20 1 1 A 23 23 GLY HA2 H 23 4.162 4.357 -0.195 1
1 170 . 20 1 1 A 23 23 GLY HA3 H 23 4.061 4.380 -0.319 1
1 171 . 20 1 1 A 23 23 GLY CA C 23 44.801 45.831 -1.030 1
1 172 . 20 1 1 A 23 23 GLY N N 23 110.080 107.725 2.355 1
1 173 . 20 1 1 A 24 24 PRO HA H 24 4.417 4.349 0.068 1
1 178 . 20 1 1 A 24 24 PRO C C 24 177.135 176.457 0.678 1
1 179 . 20 1 1 A 24 24 PRO CA C 24 63.520 65.296 -1.776 1
1 180 . 20 1 1 A 24 24 PRO CB C 24 32.124 31.715 0.409 1
1 183 . 20 1 1 A 25 25 ARG H H 25 8.409 7.742 0.667 1
1 184 . 20 1 1 A 25 25 ARG HA H 25 4.298 4.917 -0.619 1
1 187 . 20 1 1 A 25 25 ARG C C 25 176.217 175.160 1.057 1
1 188 . 20 1 1 A 25 25 ARG CA C 25 56.237 54.230 2.007 1
1 189 . 20 1 1 A 25 25 ARG CB C 25 30.467 33.706 -3.239 1
1 192 . 20 1 1 A 25 25 ARG N N 25 120.147 117.493 2.654 1
1 193 . 20 1 1 A 26 26 GLN H H 26 8.278 8.368 -0.090 1
1 194 . 20 1 1 A 26 26 GLN HA H 26 4.336 4.350 -0.014 1
1 200 . 20 1 1 A 26 26 GLN C C 26 175.566 175.352 0.214 1
1 201 . 20 1 1 A 26 26 GLN CA C 26 55.788 56.085 -0.297 1
1 202 . 20 1 1 A 26 26 GLN CB C 26 29.714 28.818 0.896 1
1 204 . 20 1 1 A 26 26 GLN N N 26 120.460 121.609 -1.149 1
1 206 . 20 1 1 A 27 27 SER H H 27 8.298 8.408 -0.110 1
1 208 . 20 1 1 A 27 27 SER CA C 27 56.156 56.772 -0.616 1
1 209 . 20 1 1 A 27 27 SER CB C 27 63.813 63.224 0.589 1
1 210 . 20 1 1 A 27 27 SER N N 27 117.382 124.021 -6.639 1
1 211 . 20 1 1 A 28 28 PRO HA H 28 4.366 4.335 0.031 1
1 216 . 20 1 1 A 28 28 PRO C C 28 177.555 176.738 0.817 1
1 217 . 20 1 1 A 28 28 PRO CA C 28 64.486 65.338 -0.852 1
1 218 . 20 1 1 A 28 28 PRO CB C 28 31.892 31.788 0.104 1
1 221 . 20 1 1 A 29 29 GLU H H 29 8.582 7.819 0.763 1
1 222 . 20 1 1 A 29 29 GLU HA H 29 4.218 4.842 -0.624 1
1 226 . 20 1 1 A 29 29 GLU CA C 29 57.261 55.318 1.943 1
1 227 . 20 1 1 A 29 29 GLU CB C 29 29.633 32.627 -2.994 1
1 229 . 20 1 1 A 29 29 GLU N N 29 118.309 116.692 1.617 1
1 230 . 20 1 1 A 30 30 LYS H H 30 7.955 8.368 -0.413 1
1 231 . 20 1 1 A 30 30 LYS HA H 30 4.328 4.314 0.014 1
1 236 . 20 1 1 A 30 30 LYS C C 30 176.222 176.453 -0.231 1
1 237 . 20 1 1 A 30 30 LYS CA C 30 56.247 57.167 -0.920 1
1 238 . 20 1 1 A 30 30 LYS CB C 30 32.720 32.479 0.241 1
1 242 . 20 1 1 A 30 30 LYS N N 30 120.129 124.358 -4.229 1
1 243 . 20 1 1 A 31 31 SER H H 31 7.883 8.661 -0.778 1
1 244 . 20 1 1 A 31 31 SER HA H 31 4.458 4.591 -0.133 1
1 246 . 20 1 1 A 31 31 SER C C 31 174.129 173.983 0.146 1
1 247 . 20 1 1 A 31 31 SER CA C 31 58.477 57.215 1.262 1
1 248 . 20 1 1 A 31 31 SER CB C 31 64.042 62.538 1.504 1
1 249 . 20 1 1 A 31 31 SER N N 31 115.366 121.064 -5.698 1
1 250 . 20 1 1 A 32 32 HIS H H 32 8.485 8.257 0.228 1
1 251 . 20 1 1 A 32 32 HIS HA H 32 4.450 4.791 -0.341 1
1 255 . 20 1 1 A 32 32 HIS CA C 32 56.009 55.667 0.342 1
1 256 . 20 1 1 A 32 32 HIS CB C 32 31.122 32.613 -1.491 1
1 257 . 20 1 1 A 32 32 HIS N N 32 121.500 128.558 -7.058 1
1 258 . 20 1 1 A 33 33 MET H H 33 8.392 7.831 0.561 1
1 259 . 20 1 1 A 33 33 MET HA H 33 4.601 5.316 -0.715 1
1 265 . 20 1 1 A 33 33 MET C C 33 175.842 174.669 1.173 1
1 266 . 20 1 1 A 33 33 MET CA C 33 54.533 54.145 0.388 1
1 267 . 20 1 1 A 33 33 MET CB C 33 32.868 36.151 -3.283 1
1 270 . 20 1 1 A 33 33 MET N N 33 120.204 118.689 1.515 1
1 271 . 20 1 1 A 34 34 VAL H H 34 8.938 9.128 -0.190 1
1 272 . 20 1 1 A 34 34 VAL HA H 34 4.430 4.660 -0.230 1
1 280 . 20 1 1 A 34 34 VAL C C 34 174.149 173.668 0.481 1
1 281 . 20 1 1 A 34 34 VAL CA C 34 60.703 59.822 0.881 1
1 282 . 20 1 1 A 34 34 VAL CB C 34 34.319 35.620 -1.301 1
1 285 . 20 1 1 A 34 34 VAL N N 34 118.512 119.878 -1.366 1
1 286 . 20 1 1 A 35 35 PHE H H 35 9.242 8.035 1.207 1
1 287 . 20 1 1 A 35 35 PHE HA H 35 4.439 5.572 -1.133 1
1 294 . 20 1 1 A 35 35 PHE C C 35 174.831 174.631 0.200 1
1 295 . 20 1 1 A 35 35 PHE CA C 35 57.754 55.085 2.669 1
1 296 . 20 1 1 A 35 35 PHE CB C 35 38.959 41.796 -2.837 1
1 297 . 20 1 1 A 35 35 PHE N N 35 124.912 125.346 -0.434 1
1 298 . 20 1 1 A 36 36 ARG H H 36 8.475 9.134 -0.659 1
1 299 . 20 1 1 A 36 36 ARG HA H 36 4.135 4.665 -0.530 1
1 304 . 20 1 1 A 36 36 ARG C C 36 172.865 175.837 -2.972 1
1 305 . 20 1 1 A 36 36 ARG CA C 36 56.895 55.987 0.908 1
1 306 . 20 1 1 A 36 36 ARG CB C 36 28.962 30.930 -1.968 1
1 308 . 20 1 1 A 36 36 ARG N N 36 125.680 120.726 4.954 1
1 309 . 20 1 1 A 37 37 VAL H H 37 8.066 9.144 -1.078 1
1 310 . 20 1 1 A 37 37 VAL HA H 37 4.292 4.745 -0.453 1
1 318 . 20 1 1 A 37 37 VAL C C 37 174.595 174.144 0.451 1
1 319 . 20 1 1 A 37 37 VAL CA C 37 62.727 61.136 1.591 1
1 320 . 20 1 1 A 37 37 VAL CB C 37 31.102 33.014 -1.912 1
1 323 . 20 1 1 A 37 37 VAL N N 37 125.403 120.916 4.487 1
1 324 . 20 1 1 A 38 38 GLU H H 38 9.532 8.955 0.577 1
1 325 . 20 1 1 A 38 38 GLU HA H 38 4.895 5.132 -0.237 1
1 329 . 20 1 1 A 38 38 GLU C C 38 174.509 175.532 -1.023 1
1 330 . 20 1 1 A 38 38 GLU CA C 38 55.650 55.186 0.464 1
1 331 . 20 1 1 A 38 38 GLU CB C 38 32.214 31.481 0.733 1
1 333 . 20 1 1 A 38 38 GLU N N 38 129.885 127.069 2.816 1
1 334 . 20 1 1 A 39 39 VAL H H 39 9.035 9.086 -0.051 1
1 335 . 20 1 1 A 39 39 VAL HA H 39 4.446 4.766 -0.320 1
1 343 . 20 1 1 A 39 39 VAL C C 39 173.661 173.818 -0.157 1
1 344 . 20 1 1 A 39 39 VAL CA C 39 61.258 61.009 0.249 1
1 345 . 20 1 1 A 39 39 VAL CB C 39 33.533 34.199 -0.666 1
1 348 . 20 1 1 A 39 39 VAL N N 39 127.941 126.647 1.294 1
1 349 . 20 1 1 A 40 40 LEU H H 40 8.843 9.319 -0.476 1
1 350 . 20 1 1 A 40 40 LEU HA H 40 5.130 4.906 0.224 1
1 360 . 20 1 1 A 40 40 LEU C C 40 175.581 175.171 0.410 1
1 361 . 20 1 1 A 40 40 LEU CA C 40 53.702 53.777 -0.075 1
1 362 . 20 1 1 A 40 40 LEU CB C 40 43.989 43.923 0.066 1
1 366 . 20 1 1 A 40 40 LEU N N 40 128.413 129.772 -1.359 1
1 367 . 20 1 1 A 41 41 CYS H H 41 8.959 9.173 -0.214 1
1 368 . 20 1 1 A 41 41 CYS HA H 41 5.174 4.806 0.368 1
1 371 . 20 1 1 A 41 41 CYS C C 41 175.043 173.770 1.273 1
1 372 . 20 1 1 A 41 41 CYS CA C 41 57.483 57.633 -0.150 1
1 373 . 20 1 1 A 41 41 CYS CB C 41 28.472 29.268 -0.796 1
1 374 . 20 1 1 A 41 41 CYS N N 41 124.738 126.409 -1.671 1
1 375 . 20 1 1 A 42 42 SER H H 42 9.527 9.793 -0.266 1
1 376 . 20 1 1 A 42 42 SER HA H 42 4.149 4.189 -0.040 1
1 379 . 20 1 1 A 42 42 SER C C 42 175.014 174.482 0.532 1
1 380 . 20 1 1 A 42 42 SER CA C 42 59.058 59.483 -0.425 1
1 381 . 20 1 1 A 42 42 SER CB C 42 62.287 61.805 0.482 1
1 382 . 20 1 1 A 42 42 SER N N 42 125.889 123.573 2.316 1
1 383 . 20 1 1 A 43 43 GLY H H 43 8.685 8.296 0.389 1
1 384 . 20 1 1 A 43 43 GLY HA2 H 43 3.594 4.014 -0.420 1
1 385 . 20 1 1 A 43 43 GLY HA3 H 43 4.210 4.020 0.190 1
1 386 . 20 1 1 A 43 43 GLY C C 43 173.664 174.607 -0.943 1
1 387 . 20 1 1 A 43 43 GLY CA C 43 45.404 45.257 0.147 1
1 388 . 20 1 1 A 43 43 GLY N N 43 104.633 106.360 -1.727 1
1 389 . 20 1 1 A 44 44 ARG H H 44 7.926 7.507 0.419 1
1 390 . 20 1 1 A 44 44 ARG HA H 44 4.678 4.318 0.360 1
1 395 . 20 1 1 A 44 44 ARG C C 44 175.261 175.403 -0.142 1
1 396 . 20 1 1 A 44 44 ARG CA C 44 55.011 56.181 -1.170 1
1 397 . 20 1 1 A 44 44 ARG CB C 44 32.138 31.306 0.832 1
1 400 . 20 1 1 A 44 44 ARG N N 44 121.239 120.957 0.282 1
1 401 . 20 1 1 A 45 45 ARG H H 45 8.775 8.869 -0.094 1
1 402 . 20 1 1 A 45 45 ARG HA H 45 5.770 4.995 0.775 1
1 409 . 20 1 1 A 45 45 ARG C C 45 176.064 175.442 0.622 1
1 410 . 20 1 1 A 45 45 ARG CA C 45 54.683 54.431 0.252 1
1 411 . 20 1 1 A 45 45 ARG CB C 45 33.748 32.940 0.808 1
1 414 . 20 1 1 A 45 45 ARG N N 45 125.948 121.447 4.501 1
1 415 . 20 1 1 A 46 46 HIS H H 46 8.912 8.635 0.277 1
1 416 . 20 1 1 A 46 46 HIS HA H 46 4.927 5.576 -0.649 1
1 420 . 20 1 1 A 46 46 HIS C C 46 172.634 172.778 -0.144 1
1 421 . 20 1 1 A 46 46 HIS CA C 46 56.480 53.925 2.555 1
1 422 . 20 1 1 A 46 46 HIS CB C 46 33.608 32.997 0.611 1
1 423 . 20 1 1 A 46 46 HIS N N 46 121.825 117.410 4.415 1
1 424 . 20 1 1 A 47 47 THR H H 47 8.532 9.002 -0.470 1
1 425 . 20 1 1 A 47 47 THR HA H 47 5.472 4.537 0.935 1
1 430 . 20 1 1 A 47 47 THR C C 47 174.442 174.125 0.317 1
1 431 . 20 1 1 A 47 47 THR CA C 47 61.093 62.752 -1.659 1
1 432 . 20 1 1 A 47 47 THR CB C 47 71.041 68.737 2.304 1
1 434 . 20 1 1 A 47 47 THR N N 47 115.450 119.885 -4.435 1
1 435 . 20 1 1 A 48 48 VAL H H 48 9.695 9.225 0.470 1
1 436 . 20 1 1 A 48 48 VAL HA H 48 4.677 4.556 0.121 1
1 444 . 20 1 1 A 48 48 VAL CA C 48 58.172 59.051 -0.879 1
1 445 . 20 1 1 A 48 48 VAL CB C 48 34.990 33.655 1.335 1
1 448 . 20 1 1 A 48 48 VAL N N 48 126.721 127.094 -0.373 1
1 449 . 20 1 1 A 49 49 PRO HA H 49 5.087 4.718 0.369 1
1 453 . 20 1 1 A 49 49 PRO CA C 49 61.671 62.852 -1.181 1
1 454 . 20 1 1 A 49 49 PRO CB C 49 31.923 32.304 -0.381 1
1 457 . 20 1 1 A 50 50 ARG H H 50 9.125 9.165 -0.040 1
1 458 . 20 1 1 A 50 50 ARG HA H 50 4.974 4.927 0.047 1
1 464 . 20 1 1 A 50 50 ARG C C 50 176.187 174.329 1.858 1
1 465 . 20 1 1 A 50 50 ARG CA C 50 53.015 54.845 -1.830 1
1 466 . 20 1 1 A 50 50 ARG CB C 50 36.553 33.737 2.816 1
1 468 . 20 1 1 A 50 50 ARG N N 50 124.189 123.460 0.729 1
1 469 . 20 1 1 A 51 51 ARG H H 51 10.105 8.494 1.611 1
1 470 . 20 1 1 A 51 51 ARG HA H 51 5.196 4.115 1.081 1
1 475 . 20 1 1 A 51 51 ARG C C 51 178.865 176.724 2.141 1
1 476 . 20 1 1 A 51 51 ARG CA C 51 55.961 56.181 -0.220 1
1 477 . 20 1 1 A 51 51 ARG CB C 51 32.539 31.743 0.796 1
1 480 . 20 1 1 A 51 51 ARG N N 51 124.521 127.014 -2.493 1
1 481 . 20 1 1 A 52 52 TYR H H 52 10.397 9.108 1.289 1
1 482 . 20 1 1 A 52 52 TYR HA H 52 4.360 4.252 0.108 1
1 487 . 20 1 1 A 52 52 TYR C C 52 178.143 177.626 0.517 1
1 488 . 20 1 1 A 52 52 TYR CA C 52 63.538 62.517 1.021 1
1 489 . 20 1 1 A 52 52 TYR CB C 52 38.784 39.079 -0.295 1
1 490 . 20 1 1 A 52 52 TYR N N 52 124.772 128.321 -3.549 1
1 491 . 20 1 1 A 53 53 SER H H 53 9.231 8.670 0.561 1
1 492 . 20 1 1 A 53 53 SER HA H 53 4.175 4.467 -0.292 1
1 493 . 20 1 1 A 53 53 SER C C 53 177.220 176.847 0.373 1
1 494 . 20 1 1 A 53 53 SER CA C 53 61.606 61.720 -0.114 1
1 495 . 20 1 1 A 53 53 SER N N 53 113.262 114.383 -1.121 1
1 496 . 20 1 1 A 54 54 GLU H H 54 7.807 8.062 -0.255 1
1 497 . 20 1 1 A 54 54 GLU HA H 54 4.392 3.968 0.424 1
1 501 . 20 1 1 A 54 54 GLU C C 54 180.361 178.659 1.702 1
1 502 . 20 1 1 A 54 54 GLU CA C 54 59.497 59.492 0.005 1
1 503 . 20 1 1 A 54 54 GLU CB C 54 30.708 29.413 1.295 1
1 504 . 20 1 1 A 54 54 GLU N N 54 121.949 122.808 -0.859 1
1 505 . 20 1 1 A 55 55 PHE H H 55 8.133 8.234 -0.101 1
1 506 . 20 1 1 A 55 55 PHE HA H 55 4.007 4.139 -0.132 1
1 513 . 20 1 1 A 55 55 PHE C C 55 176.531 177.501 -0.970 1
1 514 . 20 1 1 A 55 55 PHE CA C 55 61.848 61.278 0.570 1
1 515 . 20 1 1 A 55 55 PHE CB C 55 38.847 38.928 -0.081 1
1 516 . 20 1 1 A 55 55 PHE N N 55 119.998 120.197 -0.199 1
1 517 . 20 1 1 A 56 56 HIS H H 56 7.907 8.415 -0.508 1
1 518 . 20 1 1 A 56 56 HIS HA H 56 3.324 3.977 -0.653 1
1 522 . 20 1 1 A 56 56 HIS C C 56 176.748 177.279 -0.531 1
1 523 . 20 1 1 A 56 56 HIS CA C 56 58.770 60.187 -1.417 1
1 524 . 20 1 1 A 56 56 HIS CB C 56 30.404 29.581 0.823 1
1 525 . 20 1 1 A 56 56 HIS N N 56 119.173 118.097 1.076 1
1 526 . 20 1 1 A 57 57 ALA H H 57 7.962 8.392 -0.430 1
1 527 . 20 1 1 A 57 57 ALA HA H 57 3.865 3.940 -0.075 1
1 531 . 20 1 1 A 57 57 ALA C C 57 180.075 179.794 0.281 1
1 532 . 20 1 1 A 57 57 ALA CA C 57 54.996 54.992 0.004 1
1 533 . 20 1 1 A 57 57 ALA CB C 57 18.226 18.074 0.152 1
1 534 . 20 1 1 A 57 57 ALA N N 57 120.094 121.247 -1.153 1
1 535 . 20 1 1 A 58 58 LEU H H 58 7.295 7.934 -0.639 1
1 536 . 20 1 1 A 58 58 LEU HA H 58 3.994 3.977 0.017 1
1 546 . 20 1 1 A 58 58 LEU C C 58 177.428 178.330 -0.902 1
1 547 . 20 1 1 A 58 58 LEU CA C 58 58.342 57.875 0.467 1
1 548 . 20 1 1 A 58 58 LEU CB C 58 40.851 41.599 -0.748 1
1 552 . 20 1 1 A 58 58 LEU N N 58 119.404 120.124 -0.720 1
1 553 . 20 1 1 A 59 59 HIS H H 59 7.805 8.000 -0.195 1
1 554 . 20 1 1 A 59 59 HIS HA H 59 4.286 3.869 0.417 1
1 558 . 20 1 1 A 59 59 HIS C C 59 177.001 176.539 0.462 1
1 559 . 20 1 1 A 59 59 HIS CA C 59 60.141 59.621 0.520 1
1 560 . 20 1 1 A 59 59 HIS CB C 59 31.072 29.576 1.496 1
1 561 . 20 1 1 A 59 59 HIS N N 59 119.040 117.844 1.196 1
1 562 . 20 1 1 A 60 60 LYS H H 60 7.715 8.105 -0.390 1
1 563 . 20 1 1 A 60 60 LYS HA H 60 3.456 3.573 -0.117 1
1 570 . 20 1 1 A 60 60 LYS C C 60 178.464 178.463 0.001 1
1 571 . 20 1 1 A 60 60 LYS CA C 60 59.629 59.839 -0.210 1
1 572 . 20 1 1 A 60 60 LYS CB C 60 32.354 32.046 0.308 1
1 576 . 20 1 1 A 60 60 LYS N N 60 114.225 118.082 -3.857 1
1 577 . 20 1 1 A 61 61 ARG H H 61 7.486 7.515 -0.029 1
1 578 . 20 1 1 A 61 61 ARG HA H 61 4.202 3.945 0.257 1
1 584 . 20 1 1 A 61 61 ARG C C 61 178.995 178.858 0.137 1
1 585 . 20 1 1 A 61 61 ARG CA C 61 58.387 58.781 -0.394 1
1 586 . 20 1 1 A 61 61 ARG CB C 61 31.216 30.035 1.181 1
1 589 . 20 1 1 A 61 61 ARG N N 61 115.929 118.778 -2.849 1
1 590 . 20 1 1 A 62 62 ILE H H 62 8.066 7.802 0.264 1
1 591 . 20 1 1 A 62 62 ILE HA H 62 4.491 3.733 0.758 1
1 601 . 20 1 1 A 62 62 ILE C C 62 177.838 177.050 0.788 1
1 602 . 20 1 1 A 62 62 ILE CA C 62 63.399 63.200 0.199 1
1 603 . 20 1 1 A 62 62 ILE CB C 62 39.699 37.057 2.642 1
1 606 . 20 1 1 A 62 62 ILE N N 62 111.456 116.899 -5.443 1
1 607 . 20 1 1 A 63 63 LYS H H 63 8.158 8.343 -0.185 1
1 608 . 20 1 1 A 63 63 LYS HA H 63 4.136 3.843 0.293 1
1 615 . 20 1 1 A 63 63 LYS C C 63 176.358 178.681 -2.323 1
1 616 . 20 1 1 A 63 63 LYS CA C 63 58.753 58.520 0.233 1
1 617 . 20 1 1 A 63 63 LYS CB C 63 30.825 31.215 -0.390 1
1 621 . 20 1 1 A 63 63 LYS N N 63 120.800 123.477 -2.677 1
1 622 . 20 1 1 A 64 64 LYS H H 64 7.687 7.616 0.071 1
1 623 . 20 1 1 A 64 64 LYS HA H 64 4.301 4.040 0.261 1
1 628 . 20 1 1 A 64 64 LYS C C 64 177.084 178.148 -1.064 1
1 629 . 20 1 1 A 64 64 LYS CA C 64 57.237 58.771 -1.534 1
1 630 . 20 1 1 A 64 64 LYS CB C 64 32.502 32.098 0.404 1
1 634 . 20 1 1 A 64 64 LYS N N 64 116.548 119.731 -3.183 1
1 635 . 20 1 1 A 65 65 LEU H H 65 7.476 7.539 -0.063 1
1 636 . 20 1 1 A 65 65 LEU HA H 65 4.219 4.257 -0.038 1
1 645 . 20 1 1 A 65 65 LEU C C 65 175.886 176.938 -1.052 1
1 646 . 20 1 1 A 65 65 LEU CA C 65 55.542 56.338 -0.796 1
1 647 . 20 1 1 A 65 65 LEU CB C 65 45.493 43.226 2.267 1
1 650 . 20 1 1 A 65 65 LEU N N 65 118.000 118.002 -0.002 1
1 651 . 20 1 1 A 66 66 TYR H H 66 7.672 8.112 -0.440 1
1 652 . 20 1 1 A 66 66 TYR HA H 66 4.762 5.055 -0.293 1
1 660 . 20 1 1 A 66 66 TYR C C 66 174.199 173.862 0.337 1
1 661 . 20 1 1 A 66 66 TYR CA C 66 56.013 55.508 0.505 1
1 662 . 20 1 1 A 66 66 TYR CB C 66 40.380 40.889 -0.509 1
1 663 . 20 1 1 A 66 66 TYR N N 66 116.805 114.644 2.161 1
1 664 . 20 1 1 A 67 67 LYS H H 67 8.547 8.466 0.081 1
1 665 . 20 1 1 A 67 67 LYS HA H 67 4.436 4.523 -0.087 1
1 670 . 20 1 1 A 67 67 LYS C C 67 175.727 176.372 -0.645 1
1 671 . 20 1 1 A 67 67 LYS CA C 67 56.598 56.600 -0.002 1
1 672 . 20 1 1 A 67 67 LYS CB C 67 32.743 32.675 0.068 1
1 676 . 20 1 1 A 67 67 LYS N N 67 120.929 120.283 0.646 1
1 677 . 20 1 1 A 68 68 VAL H H 68 8.168 8.615 -0.447 1
1 678 . 20 1 1 A 68 68 VAL HA H 68 4.869 4.735 0.134 1
1 686 . 20 1 1 A 68 68 VAL CA C 68 57.389 58.440 -1.051 1
1 687 . 20 1 1 A 68 68 VAL CB C 68 34.017 34.644 -0.627 1
1 690 . 20 1 1 A 68 68 VAL N N 68 116.467 117.733 -1.266 1
1 691 . 20 1 1 A 69 69 PRO HA H 69 4.674 4.669 0.005 1
1 696 . 20 1 1 A 69 69 PRO C C 69 178.013 176.161 1.852 1
1 697 . 20 1 1 A 69 69 PRO CA C 69 61.443 62.483 -1.040 1
1 698 . 20 1 1 A 69 69 PRO CB C 69 32.231 33.451 -1.220 1
1 701 . 20 1 1 A 70 70 ASP H H 70 8.167 8.759 -0.592 1
1 702 . 20 1 1 A 70 70 ASP HA H 70 4.531 4.815 -0.284 1
1 705 . 20 1 1 A 70 70 ASP C C 70 175.660 175.502 0.158 1
1 706 . 20 1 1 A 70 70 ASP CA C 70 55.148 52.855 2.293 1
1 707 . 20 1 1 A 70 70 ASP CB C 70 40.876 42.502 -1.626 1
1 708 . 20 1 1 A 70 70 ASP N N 70 116.671 121.599 -4.928 1
1 709 . 20 1 1 A 71 71 PHE H H 71 8.387 8.466 -0.079 1
1 710 . 20 1 1 A 71 71 PHE HA H 71 4.076 4.718 -0.642 1
1 717 . 20 1 1 A 71 71 PHE CA C 71 55.672 54.876 0.796 1
1 718 . 20 1 1 A 71 71 PHE CB C 71 39.155 41.615 -2.460 1
1 719 . 20 1 1 A 71 71 PHE N N 71 126.533 116.872 9.661 1
1 720 . 20 1 1 A 72 72 PRO HA H 72 4.156 4.605 -0.449 1
1 727 . 20 1 1 A 72 72 PRO CA C 72 63.079 62.059 1.020 1
1 728 . 20 1 1 A 72 72 PRO CB C 72 32.107 32.645 -0.538 1
1 731 . 20 1 1 A 73 73 SER H H 73 8.468 8.095 0.373 1
1 733 . 20 1 1 A 73 73 SER CA C 73 56.133 57.633 -1.500 1
1 734 . 20 1 1 A 73 73 SER CB C 73 63.991 64.749 -0.758 1
1 735 . 20 1 1 A 73 73 SER N N 73 121.533 118.609 2.924 1
1 736 . 20 1 1 A 74 74 LYS HA H 74 4.574 3.759 0.815 1
1 739 . 20 1 1 A 74 74 LYS CA C 74 55.659 58.232 -2.573 1
1 740 . 20 1 1 A 74 74 LYS CB C 74 30.550 32.027 -1.477 1
1 741 . 20 1 1 A 75 75 ARG H H 75 7.962 7.517 0.445 1
1 742 . 20 1 1 A 75 75 ARG HA H 75 4.162 4.844 -0.682 1
1 746 . 20 1 1 A 75 75 ARG CA C 75 56.123 54.690 1.433 1
1 747 . 20 1 1 A 75 75 ARG CB C 75 31.179 32.970 -1.791 1
1 749 . 20 1 1 A 75 75 ARG N N 75 121.665 119.678 1.987 1
1 750 . 20 1 1 A 76 76 LEU H H 76 8.071 8.514 -0.443 1
1 751 . 20 1 1 A 76 76 LEU HA H 76 4.618 4.643 -0.025 1
1 759 . 20 1 1 A 76 76 LEU CA C 76 52.764 51.709 1.055 1
1 760 . 20 1 1 A 76 76 LEU CB C 76 41.918 44.286 -2.368 1
1 762 . 20 1 1 A 76 76 LEU N N 76 124.196 126.397 -2.201 1
1 763 . 20 1 1 A 77 77 PRO HA H 77 4.393 4.241 0.152 1
1 767 . 20 1 1 A 77 77 PRO CA C 77 63.746 62.355 1.391 1
1 770 . 20 1 1 A 78 78 ASN H H 78 8.379 8.604 -0.225 1
1 771 . 20 1 1 A 78 78 ASN HA H 78 4.586 4.393 0.193 1
1 776 . 20 1 1 A 78 78 ASN C C 78 175.648 175.556 0.092 1
1 777 . 20 1 1 A 78 78 ASN CA C 78 53.591 53.905 -0.314 1
1 778 . 20 1 1 A 78 78 ASN CB C 78 37.826 38.458 -0.632 1
1 779 . 20 1 1 A 78 78 ASN N N 78 115.292 120.031 -4.739 1
1 781 . 20 1 1 A 79 79 TRP H H 79 7.900 7.906 -0.006 1
1 782 . 20 1 1 A 79 79 TRP HA H 79 4.326 4.109 0.217 1
1 788 . 20 1 1 A 79 79 TRP CA C 79 58.825 61.455 -2.630 1
1 789 . 20 1 1 A 79 79 TRP CB C 79 29.090 27.396 1.694 1
1 790 . 20 1 1 A 79 79 TRP N N 79 119.525 117.012 2.513 1
1 792 . 20 1 1 A 80 80 ARG H H 80 8.060 8.630 -0.570 1
1 793 . 20 1 1 A 80 80 ARG HA H 80 3.913 4.001 -0.088 1
1 798 . 20 1 1 A 80 80 ARG C C 80 177.024 178.362 -1.338 1
1 799 . 20 1 1 A 80 80 ARG CA C 80 58.292 59.500 -1.208 1
1 800 . 20 1 1 A 80 80 ARG CB C 80 30.146 29.896 0.250 1
1 803 . 20 1 1 A 80 80 ARG N N 80 118.864 119.026 -0.162 1
1 804 . 20 1 1 A 81 81 THR H H 81 7.725 7.864 -0.139 1
1 805 . 20 1 1 A 81 81 THR HA H 81 4.297 4.392 -0.095 1
1 809 . 20 1 1 A 81 81 THR CA C 81 62.481 62.843 -0.362 1
1 811 . 20 1 1 A 81 81 THR N N 81 109.863 111.822 -1.959 1
1 812 . 20 1 1 A 82 82 ARG HA H 82 4.341 4.476 -0.135 1
1 816 . 20 1 1 A 82 82 ARG C C 82 177.261 176.200 1.061 1
1 817 . 20 1 1 A 82 82 ARG CA C 82 56.846 57.083 -0.237 1
1 818 . 20 1 1 A 82 82 ARG CB C 82 30.288 31.880 -1.592 1
1 820 . 20 1 1 A 83 83 GLY H H 83 8.321 7.244 1.077 1
1 821 . 20 1 1 A 83 83 GLY HA2 H 83 3.957 4.219 -0.262 1
1 822 . 20 1 1 A 83 83 GLY C C 83 175.185 174.370 0.815 1
1 823 . 20 1 1 A 83 83 GLY CA C 83 46.297 45.780 0.517 1
1 824 . 20 1 1 A 83 83 GLY N N 83 109.146 103.732 5.414 1
1 825 . 20 1 1 A 84 84 LEU H H 84 8.303 9.180 -0.877 1
1 826 . 20 1 1 A 84 84 LEU HA H 84 4.018 4.072 -0.054 1
1 835 . 20 1 1 A 84 84 LEU C C 84 178.552 178.384 0.168 1
1 836 . 20 1 1 A 84 84 LEU CA C 84 58.236 56.034 2.202 1
1 837 . 20 1 1 A 84 84 LEU CB C 84 41.837 41.795 0.042 1
1 840 . 20 1 1 A 84 84 LEU N N 84 122.662 121.836 0.826 1
1 841 . 20 1 1 A 85 85 GLU H H 85 8.233 8.618 -0.385 1
1 842 . 20 1 1 A 85 85 GLU HA H 85 4.371 4.002 0.369 1
1 846 . 20 1 1 A 85 85 GLU C C 85 178.555 178.585 -0.030 1
1 847 . 20 1 1 A 85 85 GLU CA C 85 58.377 59.213 -0.836 1
1 848 . 20 1 1 A 85 85 GLU CB C 85 28.675 29.084 -0.409 1
1 850 . 20 1 1 A 85 85 GLU N N 85 119.781 118.668 1.113 1
1 851 . 20 1 1 A 86 86 GLN H H 86 7.877 8.257 -0.380 1
1 852 . 20 1 1 A 86 86 GLN HA H 86 4.100 4.001 0.099 1
1 858 . 20 1 1 A 86 86 GLN C C 86 179.557 178.019 1.538 1
1 859 . 20 1 1 A 86 86 GLN CA C 86 58.955 59.366 -0.411 1
1 860 . 20 1 1 A 86 86 GLN CB C 86 28.191 28.531 -0.340 1
1 862 . 20 1 1 A 86 86 GLN N N 86 118.042 119.287 -1.245 1
1 863 . 20 1 1 A 87 87 ARG H H 87 8.169 8.048 0.121 1
1 864 . 20 1 1 A 87 87 ARG HA H 87 3.975 4.017 -0.042 1
1 868 . 20 1 1 A 87 87 ARG C C 87 177.051 178.404 -1.353 1
1 869 . 20 1 1 A 87 87 ARG CA C 87 59.006 59.442 -0.436 1
1 870 . 20 1 1 A 87 87 ARG CB C 87 30.383 29.253 1.130 1
1 872 . 20 1 1 A 87 87 ARG N N 87 121.381 119.709 1.672 1
1 873 . 20 1 1 A 88 88 ARG H H 88 8.593 8.372 0.221 1
1 874 . 20 1 1 A 88 88 ARG HA H 88 3.726 3.732 -0.006 1
1 876 . 20 1 1 A 88 88 ARG C C 88 177.520 178.313 -0.793 1
1 877 . 20 1 1 A 88 88 ARG CA C 88 60.751 58.892 1.859 1
1 878 . 20 1 1 A 88 88 ARG CB C 88 30.153 30.061 0.092 1
1 879 . 20 1 1 A 88 88 ARG N N 88 120.863 117.698 3.165 1
1 880 . 20 1 1 A 89 89 GLN H H 89 8.355 7.709 0.646 1
1 881 . 20 1 1 A 89 89 GLN HA H 89 3.887 3.949 -0.062 1
1 887 . 20 1 1 A 89 89 GLN C C 89 179.499 178.334 1.165 1
1 888 . 20 1 1 A 89 89 GLN CA C 89 59.603 59.384 0.219 1
1 889 . 20 1 1 A 89 89 GLN CB C 89 28.464 27.989 0.475 1
1 891 . 20 1 1 A 89 89 GLN N N 89 116.860 119.199 -2.339 1
1 893 . 20 1 1 A 90 90 GLY H H 90 8.406 8.055 0.351 1
1 894 . 20 1 1 A 90 90 GLY HA2 H 90 3.672 3.635 0.037 1
1 895 . 20 1 1 A 90 90 GLY HA3 H 90 3.871 3.701 0.170 1
1 896 . 20 1 1 A 90 90 GLY C C 90 177.033 175.645 1.388 1
1 897 . 20 1 1 A 90 90 GLY CA C 90 46.813 47.230 -0.417 1
1 898 . 20 1 1 A 90 90 GLY N N 90 107.679 107.480 0.199 1
1 899 . 20 1 1 A 91 91 LEU H H 91 8.504 8.296 0.208 1
1 900 . 20 1 1 A 91 91 LEU HA H 91 3.784 4.079 -0.295 1
1 910 . 20 1 1 A 91 91 LEU C C 91 178.003 179.293 -1.290 1
1 911 . 20 1 1 A 91 91 LEU CA C 91 57.354 57.455 -0.101 1
1 912 . 20 1 1 A 91 91 LEU CB C 91 40.359 40.894 -0.535 1
1 916 . 20 1 1 A 91 91 LEU N N 91 123.959 121.345 2.614 1
1 917 . 20 1 1 A 92 92 GLU H H 92 8.324 8.274 0.050 1
1 918 . 20 1 1 A 92 92 GLU HA H 92 3.732 3.872 -0.140 1
1 922 . 20 1 1 A 92 92 GLU C C 92 177.272 178.520 -1.248 1
1 923 . 20 1 1 A 92 92 GLU CA C 92 60.651 59.659 0.992 1
1 924 . 20 1 1 A 92 92 GLU CB C 92 30.843 29.253 1.590 1
1 926 . 20 1 1 A 92 92 GLU N N 92 121.991 121.023 0.968 1
1 927 . 20 1 1 A 93 93 ALA H H 93 8.126 7.761 0.365 1
1 928 . 20 1 1 A 93 93 ALA HA H 93 4.160 4.061 0.099 1
1 932 . 20 1 1 A 93 93 ALA C C 93 180.818 179.101 1.717 1
1 933 . 20 1 1 A 93 93 ALA CA C 93 54.828 54.809 0.019 1
1 934 . 20 1 1 A 93 93 ALA CB C 93 18.032 17.909 0.123 1
1 935 . 20 1 1 A 93 93 ALA N N 93 120.066 122.224 -2.158 1
1 936 . 20 1 1 A 94 94 TYR H H 94 7.916 7.424 0.492 1
1 937 . 20 1 1 A 94 94 TYR HA H 94 4.139 4.360 -0.221 1
1 942 . 20 1 1 A 94 94 TYR C C 94 175.895 178.604 -2.709 1
1 943 . 20 1 1 A 94 94 TYR CA C 94 61.915 61.589 0.326 1
1 944 . 20 1 1 A 94 94 TYR CB C 94 38.740 38.206 0.534 1
1 945 . 20 1 1 A 94 94 TYR N N 94 121.179 115.999 5.180 1
1 946 . 20 1 1 A 95 95 ILE H H 95 7.983 8.534 -0.551 1
1 947 . 20 1 1 A 95 95 ILE HA H 95 3.614 3.831 -0.217 1
1 957 . 20 1 1 A 95 95 ILE C C 95 174.678 178.041 -3.363 1
1 958 . 20 1 1 A 95 95 ILE CA C 95 63.461 65.193 -1.732 1
1 959 . 20 1 1 A 95 95 ILE CB C 95 36.625 37.698 -1.073 1
1 963 . 20 1 1 A 95 95 ILE N N 95 116.397 120.164 -3.767 1
1 964 . 20 1 1 A 96 96 GLN H H 96 8.175 8.775 -0.600 1
1 965 . 20 1 1 A 96 96 GLN HA H 96 3.763 4.045 -0.282 1
1 970 . 20 1 1 A 96 96 GLN C C 96 179.042 178.466 0.576 1
1 971 . 20 1 1 A 96 96 GLN CA C 96 59.270 59.703 -0.433 1
1 972 . 20 1 1 A 96 96 GLN CB C 96 27.696 28.022 -0.326 1
1 974 . 20 1 1 A 96 96 GLN N N 96 116.631 120.492 -3.861 1
1 976 . 20 1 1 A 97 97 GLY H H 97 8.222 8.171 0.051 1
1 977 . 20 1 1 A 97 97 GLY HA2 H 97 3.661 3.767 -0.106 1
1 978 . 20 1 1 A 97 97 GLY HA3 H 97 3.806 3.794 0.012 1
1 979 . 20 1 1 A 97 97 GLY C C 97 175.449 176.261 -0.812 1
1 980 . 20 1 1 A 97 97 GLY CA C 97 46.917 47.471 -0.554 1
1 981 . 20 1 1 A 97 97 GLY N N 97 107.315 107.071 0.244 1
1 982 . 20 1 1 A 98 98 ILE H H 98 7.630 8.291 -0.661 1
1 983 . 20 1 1 A 98 98 ILE HA H 98 3.399 3.955 -0.556 1
1 993 . 20 1 1 A 98 98 ILE C C 98 178.683 177.984 0.699 1
1 994 . 20 1 1 A 98 98 ILE CA C 98 66.402 64.858 1.544 1
1 995 . 20 1 1 A 98 98 ILE CB C 98 38.037 37.584 0.453 1
1 999 . 20 1 1 A 98 98 ILE N N 98 120.644 120.077 0.567 1
1 1000 . 20 1 1 A 99 99 LEU H H 99 7.076 7.970 -0.894 1
1 1001 . 20 1 1 A 99 99 LEU HA H 99 4.133 4.191 -0.058 1
1 1010 . 20 1 1 A 99 99 LEU C C 99 178.128 178.101 0.027 1
1 1011 . 20 1 1 A 99 99 LEU CA C 99 57.129 58.027 -0.898 1
1 1012 . 20 1 1 A 99 99 LEU CB C 99 41.108 41.789 -0.681 1
1 1014 . 20 1 1 A 99 99 LEU N N 99 116.844 124.239 -7.395 1
1 1015 . 20 1 1 A 100 100 TYR H H 100 7.890 8.429 -0.539 1
1 1016 . 20 1 1 A 100 100 TYR HA H 100 4.550 4.022 0.528 1
1 1021 . 20 1 1 A 100 100 TYR C C 100 178.210 177.371 0.839 1
1 1022 . 20 1 1 A 100 100 TYR CA C 100 59.452 60.139 -0.687 1
1 1023 . 20 1 1 A 100 100 TYR CB C 100 38.786 39.510 -0.724 1
1 1024 . 20 1 1 A 100 100 TYR N N 100 116.427 120.079 -3.652 1
1 1025 . 20 1 1 A 101 101 LEU H H 101 8.041 7.855 0.186 1
1 1026 . 20 1 1 A 101 101 LEU HA H 101 4.158 3.845 0.313 1
1 1036 . 20 1 1 A 101 101 LEU C C 101 176.808 178.173 -1.365 1
1 1037 . 20 1 1 A 101 101 LEU CA C 101 56.156 58.099 -1.943 1
1 1038 . 20 1 1 A 101 101 LEU CB C 101 44.307 41.802 2.505 1
1 1041 . 20 1 1 A 101 101 LEU N N 101 116.493 120.126 -3.633 1
1 1042 . 20 1 1 A 102 102 ASN H H 102 7.146 7.690 -0.544 1
1 1043 . 20 1 1 A 102 102 ASN HA H 102 5.056 4.745 0.311 1
1 1046 . 20 1 1 A 102 102 ASN CA C 102 52.704 53.800 -1.096 1
1 1047 . 20 1 1 A 102 102 ASN CB C 102 42.424 40.977 1.447 1
1 1048 . 20 1 1 A 102 102 ASN N N 102 114.922 113.292 1.630 1
1 1049 . 20 1 1 A 103 103 GLN H H 103 8.477 7.610 0.867 1
1 1050 . 20 1 1 A 103 103 GLN HA H 103 3.866 4.108 -0.242 1
1 1054 . 20 1 1 A 103 103 GLN C C 103 176.110 175.407 0.703 1
1 1055 . 20 1 1 A 103 103 GLN CA C 103 58.451 55.390 3.061 1
1 1056 . 20 1 1 A 103 103 GLN CB C 103 28.896 27.643 1.253 1
1 1058 . 20 1 1 A 103 103 GLN N N 103 120.252 116.533 3.719 1
1 1059 . 20 1 1 A 104 104 GLU H H 104 7.930 7.663 0.267 1
1 1060 . 20 1 1 A 104 104 GLU HA H 104 4.591 4.472 0.119 1
1 1064 . 20 1 1 A 104 104 GLU C C 104 175.397 175.504 -0.107 1
1 1065 . 20 1 1 A 104 104 GLU CA C 104 54.058 57.223 -3.165 1
1 1066 . 20 1 1 A 104 104 GLU CB C 104 31.272 29.643 1.629 1
1 1068 . 20 1 1 A 104 104 GLU N N 104 117.295 119.734 -2.439 1
1 1069 . 20 1 1 A 105 105 VAL H H 105 8.546 8.248 0.298 1
1 1070 . 20 1 1 A 105 105 VAL HA H 105 3.823 4.226 -0.403 1
1 1078 . 20 1 1 A 105 105 VAL CA C 105 60.706 60.646 0.060 1
1 1079 . 20 1 1 A 105 105 VAL CB C 105 32.126 32.845 -0.719 1
1 1082 . 20 1 1 A 105 105 VAL N N 105 124.511 123.713 0.798 1
1 1083 . 20 1 1 A 106 106 PRO HA H 106 3.997 4.513 -0.516 1
1 1089 . 20 1 1 A 106 106 PRO C C 106 178.240 177.784 0.456 1
1 1090 . 20 1 1 A 106 106 PRO CA C 106 62.961 63.405 -0.444 1
1 1091 . 20 1 1 A 106 106 PRO CB C 106 32.321 32.092 0.229 1
1 1094 . 20 1 1 A 107 107 LYS H H 107 9.122 8.997 0.125 1
1 1095 . 20 1 1 A 107 107 LYS HA H 107 3.813 3.991 -0.178 1
1 1101 . 20 1 1 A 107 107 LYS C C 107 178.563 177.954 0.609 1
1 1102 . 20 1 1 A 107 107 LYS CA C 107 60.085 59.624 0.461 1
1 1103 . 20 1 1 A 107 107 LYS CB C 107 31.632 32.255 -0.623 1
1 1106 . 20 1 1 A 107 107 LYS N N 107 129.017 125.235 3.782 1
1 1107 . 20 1 1 A 108 108 GLU H H 108 10.370 8.075 2.295 1
1 1108 . 20 1 1 A 108 108 GLU HA H 108 3.991 4.233 -0.242 1
1 1111 . 20 1 1 A 108 108 GLU C C 108 180.366 179.301 1.065 1
1 1112 . 20 1 1 A 108 108 GLU CA C 108 60.337 58.940 1.397 1
1 1113 . 20 1 1 A 108 108 GLU CB C 108 29.178 29.453 -0.275 1
1 1115 . 20 1 1 A 108 108 GLU N N 108 118.335 118.929 -0.594 1
1 1116 . 20 1 1 A 109 109 LEU H H 109 7.393 7.886 -0.493 1
1 1117 . 20 1 1 A 109 109 LEU HA H 109 4.220 4.193 0.027 1
1 1126 . 20 1 1 A 109 109 LEU C C 109 177.378 180.067 -2.689 1
1 1127 . 20 1 1 A 109 109 LEU CA C 109 56.618 57.914 -1.296 1
1 1128 . 20 1 1 A 109 109 LEU CB C 109 41.898 41.271 0.627 1
1 1131 . 20 1 1 A 109 109 LEU N N 109 118.285 120.521 -2.236 1
1 1132 . 20 1 1 A 110 110 LEU H H 110 7.641 8.293 -0.652 1
1 1133 . 20 1 1 A 110 110 LEU HA H 110 3.796 3.976 -0.180 1
1 1142 . 20 1 1 A 110 110 LEU C C 110 179.103 179.402 -0.299 1
1 1143 . 20 1 1 A 110 110 LEU CA C 110 59.046 57.810 1.236 1
1 1144 . 20 1 1 A 110 110 LEU CB C 110 40.228 40.958 -0.730 1
1 1147 . 20 1 1 A 110 110 LEU N N 110 120.162 119.989 0.173 1
1 1148 . 20 1 1 A 111 111 GLU H H 111 7.916 8.086 -0.170 1
1 1149 . 20 1 1 A 111 111 GLU HA H 111 4.080 4.209 -0.129 1
1 1153 . 20 1 1 A 111 111 GLU C C 111 179.967 178.719 1.248 1
1 1154 . 20 1 1 A 111 111 GLU CA C 111 59.243 58.537 0.706 1
1 1155 . 20 1 1 A 111 111 GLU CB C 111 29.576 29.681 -0.105 1
1 1157 . 20 1 1 A 111 111 GLU N N 111 117.360 118.761 -1.401 1
1 1158 . 20 1 1 A 112 112 PHE H H 112 7.712 8.020 -0.308 1
1 1159 . 20 1 1 A 112 112 PHE HA H 112 4.224 4.179 0.045 1
1 1164 . 20 1 1 A 112 112 PHE C C 112 177.180 177.213 -0.033 1
1 1165 . 20 1 1 A 112 112 PHE CA C 112 61.407 61.321 0.086 1
1 1166 . 20 1 1 A 112 112 PHE CB C 112 40.172 39.799 0.373 1
1 1167 . 20 1 1 A 112 112 PHE N N 112 123.042 122.875 0.167 1
1 1168 . 20 1 1 A 113 113 LEU H H 113 8.056 7.999 0.057 1
1 1169 . 20 1 1 A 113 113 LEU HA H 113 4.147 4.412 -0.265 1
1 1175 . 20 1 1 A 113 113 LEU C C 113 173.717 176.053 -2.336 1
1 1176 . 20 1 1 A 113 113 LEU CA C 113 54.093 54.406 -0.313 1
1 1177 . 20 1 1 A 113 113 LEU CB C 113 41.517 42.307 -0.790 1
1 1179 . 20 1 1 A 113 113 LEU N N 113 115.595 117.354 -1.759 1
1 1180 . 20 1 1 A 114 114 ARG H H 114 7.902 7.987 -0.085 1
1 1181 . 20 1 1 A 114 114 ARG HA H 114 3.817 4.578 -0.761 1
1 1182 . 20 1 1 A 114 114 ARG C C 114 174.566 176.208 -1.642 1
1 1183 . 20 1 1 A 114 114 ARG CA C 114 57.233 56.991 0.242 1
1 1184 . 20 1 1 A 114 114 ARG CB C 114 27.788 27.240 0.548 1
1 1185 . 20 1 1 A 114 114 ARG N N 114 116.021 115.633 0.388 1
1 1186 . 20 1 1 A 115 115 LEU H H 115 8.160 7.966 0.194 1
1 1187 . 20 1 1 A 115 115 LEU HA H 115 4.462 4.302 0.160 1
1 1195 . 20 1 1 A 115 115 LEU C C 115 176.374 176.495 -0.121 1
1 1196 . 20 1 1 A 115 115 LEU CA C 115 53.965 54.309 -0.344 1
1 1197 . 20 1 1 A 115 115 LEU CB C 115 44.077 41.174 2.903 1
1 1199 . 20 1 1 A 115 115 LEU N N 115 118.089 118.192 -0.103 1
1 1200 . 20 1 1 A 116 116 ARG H H 116 8.066 7.668 0.398 1
1 1201 . 20 1 1 A 116 116 ARG HA H 116 4.172 3.986 0.186 1
1 1203 . 20 1 1 A 116 116 ARG CA C 116 55.961 58.404 -2.443 1
1 1204 . 20 1 1 A 116 116 ARG CB C 116 31.379 30.126 1.253 1
1 1205 . 20 1 1 A 116 116 ARG N N 116 120.852 121.834 -0.982 1
1 1206 . 20 1 1 A 117 117 HIS H H 117 7.928 8.961 -1.033 1
1 1207 . 20 1 1 A 117 117 HIS HA H 117 4.557 4.361 0.196 1
1 1211 . 20 1 1 A 117 117 HIS CA C 117 55.937 57.224 -1.287 1
1 1212 . 20 1 1 A 117 117 HIS CB C 117 30.875 29.212 1.663 1
1 1213 . 20 1 1 A 118 118 PHE H H 118 8.183 7.660 0.523 1
1 1214 . 20 1 1 A 118 118 PHE HA H 118 4.730 4.533 0.197 1
1 1219 . 20 1 1 A 118 118 PHE CA C 118 55.716 56.823 -1.107 1
1 1220 . 20 1 1 A 118 118 PHE CB C 118 39.263 39.541 -0.278 1
1 1221 . 20 1 1 A 118 118 PHE N N 118 123.480 120.843 2.637 1
1 1222 . 20 1 1 A 119 119 PRO HA H 119 4.398 4.438 -0.040 1
1 1227 . 20 1 1 A 119 119 PRO C C 119 176.666 175.903 0.763 1
1 1228 . 20 1 1 A 119 119 PRO CA C 119 63.377 65.207 -1.830 1
1 1229 . 20 1 1 A 119 119 PRO CB C 119 32.059 31.647 0.412 1
1 1232 . 20 1 1 A 120 120 THR H H 120 8.054 7.157 0.897 1
1 1233 . 20 1 1 A 120 120 THR HA H 120 4.273 4.687 -0.414 1
1 1238 . 20 1 1 A 120 120 THR C C 120 174.154 172.980 1.174 1
1 1239 . 20 1 1 A 120 120 THR CA C 120 61.893 60.913 0.980 1
1 1240 . 20 1 1 A 120 120 THR CB C 120 69.736 72.054 -2.318 1
1 1242 . 20 1 1 A 120 120 THR N N 120 113.088 109.675 3.413 1
1 1243 . 20 1 1 A 121 121 ASP H H 121 8.209 8.750 -0.541 1
1 1244 . 20 1 1 A 121 121 ASP HA H 121 4.876 5.134 -0.258 1
1 1247 . 20 1 1 A 121 121 ASP CA C 121 52.126 51.952 0.174 1
1 1248 . 20 1 1 A 121 121 ASP CB C 121 41.553 41.793 -0.240 1
1 1249 . 20 1 1 A 121 121 ASP N N 121 123.630 125.845 -2.215 1
1 1250 . 20 1 1 A 122 122 PRO HA H 122 4.363 4.407 -0.044 1
1 1255 . 20 1 1 A 122 122 PRO C C 122 177.344 175.659 1.685 1
1 1256 . 20 1 1 A 122 122 PRO CA C 122 63.913 63.452 0.461 1
1 1257 . 20 1 1 A 122 122 PRO CB C 122 32.116 31.883 0.233 1
1 1260 . 20 1 1 A 123 123 LYS H H 123 8.344 8.446 -0.102 1
1 1261 . 20 1 1 A 123 123 LYS HA H 123 4.244 4.699 -0.455 1
1 1266 . 20 1 1 A 123 123 LYS C C 123 176.637 174.644 1.993 1
1 1267 . 20 1 1 A 123 123 LYS CA C 123 56.359 55.371 0.988 1
1 1268 . 20 1 1 A 123 123 LYS CB C 123 32.367 33.240 -0.873 1
1 1272 . 20 1 1 A 123 123 LYS N N 123 119.110 124.255 -5.145 1
1 1273 . 20 1 1 A 124 124 ALA H H 124 7.929 8.963 -1.034 1
1 1274 . 20 1 1 A 124 124 ALA HA H 124 4.248 4.914 -0.666 1
1 1278 . 20 1 1 A 124 124 ALA C C 124 177.648 176.597 1.051 1
1 1279 . 20 1 1 A 124 124 ALA CA C 124 52.618 50.714 1.904 1
1 1280 . 20 1 1 A 124 124 ALA CB C 124 19.379 20.255 -0.876 1
1 1281 . 20 1 1 A 124 124 ALA N N 124 123.825 130.576 -6.751 1
1 1282 . 20 1 1 A 125 125 SER H H 125 8.134 8.822 -0.688 1
1 1283 . 20 1 1 A 125 125 SER HA H 125 4.341 5.522 -1.181 1
1 1286 . 20 1 1 A 125 125 SER C C 125 174.172 173.019 1.153 1
1 1287 . 20 1 1 A 125 125 SER CA C 125 58.391 57.049 1.342 1
1 1288 . 20 1 1 A 125 125 SER CB C 125 63.748 66.119 -2.371 1
1 1289 . 20 1 1 A 125 125 SER N N 125 114.454 120.567 -6.113 1
1 1290 . 20 1 1 A 126 126 ASN H H 126 8.242 9.048 -0.806 1
1 1291 . 20 1 1 A 126 126 ASN HA H 126 4.657 4.979 -0.322 1
1 1294 . 20 1 1 A 126 126 ASN C C 126 174.624 173.953 0.671 1
1 1295 . 20 1 1 A 126 126 ASN CA C 126 53.292 52.333 0.959 1
1 1296 . 20 1 1 A 126 126 ASN CB C 126 38.797 42.209 -3.412 1
1 1297 . 20 1 1 A 126 126 ASN N N 126 120.102 120.774 -0.672 1
1 1298 . 20 1 1 A 127 127 TRP H H 127 8.051 8.652 -0.601 1
1 1299 . 20 1 1 A 127 127 TRP HA H 127 4.694 4.286 0.408 1
1 1302 . 20 1 1 A 127 127 TRP C C 127 175.479 175.868 -0.389 1
1 1303 . 20 1 1 A 127 127 TRP CA C 127 57.096 57.697 -0.601 1
1 1304 . 20 1 1 A 127 127 TRP CB C 127 29.820 27.716 2.104 1
1 1305 . 20 1 1 A 127 127 TRP N N 127 121.198 121.210 -0.012 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 97 1.170 1
2 1 1 1 "RMS(OBS, PRED)" CA 121 1.283 1
3 1 1 1 "RMS(OBS, PRED)" CB 112 1.365 1
4 1 1 1 "RMS(OBS, PRED)" H 107 0.579 1
5 1 1 1 "RMS(OBS, PRED)" HA 124 0.360 1
6 1 1 1 "RMS(OBS, PRED)" N 106 3.210 1
7 1 2 1 "RMS(OBS, PRED)" C 97 1.148 1
8 1 2 1 "RMS(OBS, PRED)" CA 121 1.206 1
9 1 2 1 "RMS(OBS, PRED)" CB 112 1.456 1
10 1 2 1 "RMS(OBS, PRED)" H 107 0.593 1
11 1 2 1 "RMS(OBS, PRED)" HA 124 0.383 1
12 1 2 1 "RMS(OBS, PRED)" N 106 3.477 1
13 1 3 1 "RMS(OBS, PRED)" C 97 1.123 1
14 1 3 1 "RMS(OBS, PRED)" CA 121 1.228 1
15 1 3 1 "RMS(OBS, PRED)" CB 112 1.391 1
16 1 3 1 "RMS(OBS, PRED)" H 107 0.610 1
17 1 3 1 "RMS(OBS, PRED)" HA 124 0.358 1
18 1 3 1 "RMS(OBS, PRED)" N 106 3.250 1
19 1 4 1 "RMS(OBS, PRED)" C 97 1.130 1
20 1 4 1 "RMS(OBS, PRED)" CA 121 1.129 1
21 1 4 1 "RMS(OBS, PRED)" CB 112 1.415 1
22 1 4 1 "RMS(OBS, PRED)" H 107 0.626 1
23 1 4 1 "RMS(OBS, PRED)" HA 124 0.401 1
24 1 4 1 "RMS(OBS, PRED)" N 106 3.266 1
25 1 5 1 "RMS(OBS, PRED)" C 97 1.195 1
26 1 5 1 "RMS(OBS, PRED)" CA 121 1.285 1
27 1 5 1 "RMS(OBS, PRED)" CB 112 1.355 1
28 1 5 1 "RMS(OBS, PRED)" H 107 0.568 1
29 1 5 1 "RMS(OBS, PRED)" HA 124 0.374 1
30 1 5 1 "RMS(OBS, PRED)" N 106 3.223 1
31 1 6 1 "RMS(OBS, PRED)" C 97 1.202 1
32 1 6 1 "RMS(OBS, PRED)" CA 121 1.290 1
33 1 6 1 "RMS(OBS, PRED)" CB 112 1.407 1
34 1 6 1 "RMS(OBS, PRED)" H 107 0.614 1
35 1 6 1 "RMS(OBS, PRED)" HA 124 0.368 1
36 1 6 1 "RMS(OBS, PRED)" N 106 3.276 1
37 1 7 1 "RMS(OBS, PRED)" C 97 1.125 1
38 1 7 1 "RMS(OBS, PRED)" CA 121 1.184 1
39 1 7 1 "RMS(OBS, PRED)" CB 112 1.389 1
40 1 7 1 "RMS(OBS, PRED)" H 107 0.556 1
41 1 7 1 "RMS(OBS, PRED)" HA 124 0.353 1
42 1 7 1 "RMS(OBS, PRED)" N 106 3.535 1
43 1 8 1 "RMS(OBS, PRED)" C 97 1.129 1
44 1 8 1 "RMS(OBS, PRED)" CA 121 1.241 1
45 1 8 1 "RMS(OBS, PRED)" CB 112 1.386 1
46 1 8 1 "RMS(OBS, PRED)" H 107 0.606 1
47 1 8 1 "RMS(OBS, PRED)" HA 124 0.394 1
48 1 8 1 "RMS(OBS, PRED)" N 106 3.098 1
49 1 9 1 "RMS(OBS, PRED)" C 97 1.197 1
50 1 9 1 "RMS(OBS, PRED)" CA 121 1.326 1
51 1 9 1 "RMS(OBS, PRED)" CB 112 1.452 1
52 1 9 1 "RMS(OBS, PRED)" H 107 0.544 1
53 1 9 1 "RMS(OBS, PRED)" HA 124 0.361 1
54 1 9 1 "RMS(OBS, PRED)" N 106 3.389 1
55 1 10 1 "RMS(OBS, PRED)" C 97 1.193 1
56 1 10 1 "RMS(OBS, PRED)" CA 121 1.276 1
57 1 10 1 "RMS(OBS, PRED)" CB 112 1.441 1
58 1 10 1 "RMS(OBS, PRED)" H 107 0.578 1
59 1 10 1 "RMS(OBS, PRED)" HA 124 0.376 1
60 1 10 1 "RMS(OBS, PRED)" N 106 3.111 1
61 1 11 1 "RMS(OBS, PRED)" C 97 1.247 1
62 1 11 1 "RMS(OBS, PRED)" CA 121 1.270 1
63 1 11 1 "RMS(OBS, PRED)" CB 112 1.468 1
64 1 11 1 "RMS(OBS, PRED)" H 107 0.584 1
65 1 11 1 "RMS(OBS, PRED)" HA 124 0.364 1
66 1 11 1 "RMS(OBS, PRED)" N 106 3.300 1
67 1 12 1 "RMS(OBS, PRED)" C 97 1.107 1
68 1 12 1 "RMS(OBS, PRED)" CA 121 1.248 1
69 1 12 1 "RMS(OBS, PRED)" CB 112 1.301 1
70 1 12 1 "RMS(OBS, PRED)" H 107 0.578 1
71 1 12 1 "RMS(OBS, PRED)" HA 124 0.363 1
72 1 12 1 "RMS(OBS, PRED)" N 106 3.354 1
73 1 13 1 "RMS(OBS, PRED)" C 97 1.168 1
74 1 13 1 "RMS(OBS, PRED)" CA 121 1.242 1
75 1 13 1 "RMS(OBS, PRED)" CB 112 1.278 1
76 1 13 1 "RMS(OBS, PRED)" H 107 0.581 1
77 1 13 1 "RMS(OBS, PRED)" HA 124 0.360 1
78 1 13 1 "RMS(OBS, PRED)" N 106 3.273 1
79 1 14 1 "RMS(OBS, PRED)" C 97 1.110 1
80 1 14 1 "RMS(OBS, PRED)" CA 121 1.245 1
81 1 14 1 "RMS(OBS, PRED)" CB 112 1.388 1
82 1 14 1 "RMS(OBS, PRED)" H 107 0.611 1
83 1 14 1 "RMS(OBS, PRED)" HA 124 0.370 1
84 1 14 1 "RMS(OBS, PRED)" N 106 3.321 1
85 1 15 1 "RMS(OBS, PRED)" C 97 1.071 1
86 1 15 1 "RMS(OBS, PRED)" CA 121 1.263 1
87 1 15 1 "RMS(OBS, PRED)" CB 112 1.266 1
88 1 15 1 "RMS(OBS, PRED)" H 107 0.552 1
89 1 15 1 "RMS(OBS, PRED)" HA 124 0.378 1
90 1 15 1 "RMS(OBS, PRED)" N 106 3.014 1
91 1 16 1 "RMS(OBS, PRED)" C 97 1.253 1
92 1 16 1 "RMS(OBS, PRED)" CA 121 1.284 1
93 1 16 1 "RMS(OBS, PRED)" CB 112 1.322 1
94 1 16 1 "RMS(OBS, PRED)" H 107 0.650 1
95 1 16 1 "RMS(OBS, PRED)" HA 124 0.373 1
96 1 16 1 "RMS(OBS, PRED)" N 106 3.465 1
97 1 17 1 "RMS(OBS, PRED)" C 97 1.140 1
98 1 17 1 "RMS(OBS, PRED)" CA 121 1.200 1
99 1 17 1 "RMS(OBS, PRED)" CB 112 1.396 1
100 1 17 1 "RMS(OBS, PRED)" H 107 0.576 1
101 1 17 1 "RMS(OBS, PRED)" HA 124 0.380 1
102 1 17 1 "RMS(OBS, PRED)" N 106 3.283 1
103 1 18 1 "RMS(OBS, PRED)" C 97 1.157 1
104 1 18 1 "RMS(OBS, PRED)" CA 121 1.289 1
105 1 18 1 "RMS(OBS, PRED)" CB 112 1.370 1
106 1 18 1 "RMS(OBS, PRED)" H 107 0.542 1
107 1 18 1 "RMS(OBS, PRED)" HA 124 0.348 1
108 1 18 1 "RMS(OBS, PRED)" N 106 3.416 1
109 1 19 1 "RMS(OBS, PRED)" C 97 1.129 1
110 1 19 1 "RMS(OBS, PRED)" CA 121 1.194 1
111 1 19 1 "RMS(OBS, PRED)" CB 112 1.369 1
112 1 19 1 "RMS(OBS, PRED)" H 107 0.615 1
113 1 19 1 "RMS(OBS, PRED)" HA 124 0.360 1
114 1 19 1 "RMS(OBS, PRED)" N 106 3.223 1
115 1 20 1 "RMS(OBS, PRED)" C 97 1.170 1
116 1 20 1 "RMS(OBS, PRED)" CA 121 1.197 1
117 1 20 1 "RMS(OBS, PRED)" CB 112 1.407 1
118 1 20 1 "RMS(OBS, PRED)" H 107 0.601 1
119 1 20 1 "RMS(OBS, PRED)" HA 124 0.385 1
120 1 20 1 "RMS(OBS, PRED)" N 106 3.207 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 7 7 HIS HA H 7 4.623 4.679 -0.056 2
1 4 . 1 1 A 7 7 HIS C C 7 174.747 174.403 0.344 2
1 5 . 1 1 A 7 7 HIS CA C 7 56.189 54.931 1.258 2
1 6 . 1 1 A 7 7 HIS CB C 7 30.028 30.046 -0.018 2
1 7 . 1 1 A 8 8 LEU H H 8 8.283 8.331 -0.048 2
1 8 . 1 1 A 8 8 LEU HA H 8 4.249 4.377 -0.128 2
1 10 . 1 1 A 8 8 LEU C C 8 176.700 176.561 0.139 2
1 11 . 1 1 A 8 8 LEU CA C 8 55.498 54.670 0.828 2
1 12 . 1 1 A 8 8 LEU CB C 8 42.568 42.683 -0.115 2
1 13 . 1 1 A 8 8 LEU N N 8 122.916 123.617 -0.701 2
1 14 . 1 1 A 9 9 GLU H H 9 8.623 8.347 0.276 2
1 15 . 1 1 A 9 9 GLU HA H 9 4.311 4.243 0.068 2
1 16 . 1 1 A 9 9 GLU C C 9 174.811 175.349 -0.538 2
1 17 . 1 1 A 9 9 GLU CA C 9 56.377 56.650 -0.273 2
1 18 . 1 1 A 9 9 GLU CB C 9 29.557 29.145 0.412 2
1 20 . 1 1 A 9 9 GLU N N 9 121.512 119.681 1.831 2
1 21 . 1 1 A 10 10 LEU H H 10 7.853 8.251 -0.398 2
1 22 . 1 1 A 10 10 LEU HA H 10 5.225 5.233 -0.008 2
1 31 . 1 1 A 10 10 LEU C C 10 174.637 175.258 -0.621 2
1 32 . 1 1 A 10 10 LEU CA C 10 54.513 53.992 0.521 2
1 33 . 1 1 A 10 10 LEU CB C 10 45.187 44.401 0.786 2
1 36 . 1 1 A 10 10 LEU N N 10 123.592 124.320 -0.728 2
1 37 . 1 1 A 11 11 GLU H H 11 8.894 8.852 0.042 2
1 38 . 1 1 A 11 11 GLU HA H 11 4.765 5.095 -0.330 2
1 43 . 1 1 A 11 11 GLU C C 11 174.563 175.299 -0.736 2
1 44 . 1 1 A 11 11 GLU CA C 11 55.047 54.926 0.121 2
1 45 . 1 1 A 11 11 GLU CB C 11 33.760 32.537 1.223 2
1 47 . 1 1 A 11 11 GLU N N 11 124.055 123.886 0.169 2
1 48 . 1 1 A 12 12 VAL H H 12 8.607 8.869 -0.262 2
1 49 . 1 1 A 12 12 VAL HA H 12 5.174 5.327 -0.153 2
1 57 . 1 1 A 12 12 VAL C C 12 173.573 175.109 -1.536 2
1 58 . 1 1 A 12 12 VAL CA C 12 60.296 61.107 -0.811 2
1 59 . 1 1 A 12 12 VAL CB C 12 35.689 34.029 1.659 2
1 62 . 1 1 A 12 12 VAL N N 12 120.878 124.234 -3.356 2
1 63 . 1 1 A 13 13 HIS H H 13 8.982 8.862 0.120 2
1 64 . 1 1 A 13 13 HIS HA H 13 4.824 5.252 -0.428 2
1 69 . 1 1 A 13 13 HIS C C 13 173.236 171.869 1.366 2
1 70 . 1 1 A 13 13 HIS CA C 13 54.906 54.082 0.824 2
1 71 . 1 1 A 13 13 HIS CB C 13 33.496 32.464 1.032 2
1 72 . 1 1 A 13 13 HIS N N 13 121.504 121.627 -0.123 2
1 73 . 1 1 A 14 14 ILE H H 14 10.442 9.041 1.401 2
1 74 . 1 1 A 14 14 ILE HA H 14 5.458 4.753 0.705 2
1 84 . 1 1 A 14 14 ILE CA C 14 58.386 57.882 0.505 2
1 85 . 1 1 A 14 14 ILE CB C 14 38.596 38.288 0.308 2
1 88 . 1 1 A 14 14 ILE N N 14 119.923 120.982 -1.059 2
1 89 . 1 1 A 15 15 PRO HA H 15 4.560 4.517 0.043 2
1 95 . 1 1 A 15 15 PRO C C 15 176.907 176.283 0.624 2
1 96 . 1 1 A 15 15 PRO CA C 15 64.342 64.362 -0.020 2
1 97 . 1 1 A 15 15 PRO CB C 15 32.924 32.215 0.709 2
1 100 . 1 1 A 16 16 SER H H 16 7.331 7.675 -0.344 2
1 101 . 1 1 A 16 16 SER HA H 16 4.822 4.978 -0.156 2
1 104 . 1 1 A 16 16 SER C C 16 171.253 172.404 -1.151 2
1 105 . 1 1 A 16 16 SER CA C 16 57.135 57.755 -0.620 2
1 106 . 1 1 A 16 16 SER CB C 16 65.947 66.662 -0.715 2
1 107 . 1 1 A 16 16 SER N N 16 107.745 112.355 -4.610 2
1 108 . 1 1 A 17 17 VAL H H 17 8.350 8.437 -0.087 2
1 109 . 1 1 A 17 17 VAL HA H 17 4.926 5.002 -0.076 2
1 117 . 1 1 A 17 17 VAL C C 17 173.692 175.003 -1.311 2
1 118 . 1 1 A 17 17 VAL CA C 17 58.721 60.660 -1.939 2
1 119 . 1 1 A 17 17 VAL CB C 17 34.420 35.254 -0.834 2
1 122 . 1 1 A 17 17 VAL N N 17 118.680 122.352 -3.672 2
1 123 . 1 1 A 18 18 GLY H H 18 8.332 8.790 -0.458 2
1 124 . 1 1 A 18 18 GLY HA2 H 18 4.189 4.308 -0.119 2
1 125 . 1 1 A 18 18 GLY HA3 H 18 4.011 4.319 -0.308 2
1 126 . 1 1 A 18 18 GLY CA C 18 45.356 44.753 0.603 2
1 127 . 1 1 A 18 18 GLY N N 18 112.549 113.803 -1.254 2
1 128 . 1 1 A 19 19 PRO HA H 19 4.757 4.779 -0.022 2
1 134 . 1 1 A 19 19 PRO C C 19 177.482 176.604 0.878 2
1 135 . 1 1 A 19 19 PRO CA C 19 62.848 62.596 0.252 2
1 136 . 1 1 A 19 19 PRO CB C 19 32.283 30.757 1.526 2
1 139 . 1 1 A 20 20 GLU H H 20 8.588 8.585 0.004 2
1 140 . 1 1 A 20 20 GLU HA H 20 4.147 4.471 -0.324 2
1 144 . 1 1 A 20 20 GLU C C 20 175.857 176.221 -0.364 2
1 145 . 1 1 A 20 20 GLU CA C 20 57.150 57.066 0.084 2
1 146 . 1 1 A 20 20 GLU CB C 20 30.923 30.799 0.124 2
1 148 . 1 1 A 20 20 GLU N N 20 122.087 121.044 1.043 2
1 149 . 1 1 A 21 21 ALA H H 21 8.352 7.651 0.701 2
1 150 . 1 1 A 21 21 ALA HA H 21 4.391 4.520 -0.129 2
1 154 . 1 1 A 21 21 ALA C C 21 174.910 176.721 -1.811 2
1 155 . 1 1 A 21 21 ALA CA C 21 52.166 51.298 0.868 2
1 156 . 1 1 A 21 21 ALA CB C 21 19.915 20.476 -0.561 2
1 157 . 1 1 A 21 21 ALA N N 21 124.593 122.467 2.126 2
1 158 . 1 1 A 22 22 GLU H H 22 8.398 8.509 -0.111 2
1 159 . 1 1 A 22 22 GLU HA H 22 4.331 4.530 -0.199 2
1 163 . 1 1 A 22 22 GLU C C 22 176.389 176.553 -0.164 2
1 164 . 1 1 A 22 22 GLU CA C 22 56.316 55.984 0.332 2
1 165 . 1 1 A 22 22 GLU CB C 22 30.713 30.443 0.270 2
1 167 . 1 1 A 22 22 GLU N N 22 120.159 121.173 -1.014 2
1 168 . 1 1 A 23 23 GLY H H 23 8.246 8.750 -0.504 2
1 169 . 1 1 A 23 23 GLY HA2 H 23 4.162 4.054 0.108 2
1 170 . 1 1 A 23 23 GLY HA3 H 23 4.061 4.107 -0.047 2
1 171 . 1 1 A 23 23 GLY CA C 23 44.801 46.058 -1.257 2
1 172 . 1 1 A 23 23 GLY N N 23 110.080 110.709 -0.629 2
1 173 . 1 1 A 24 24 PRO HA H 24 4.417 4.534 -0.117 2
1 178 . 1 1 A 24 24 PRO C C 24 177.135 176.328 0.807 2
1 179 . 1 1 A 24 24 PRO CA C 24 63.520 63.495 0.025 2
1 180 . 1 1 A 24 24 PRO CB C 24 32.124 32.516 -0.392 2
1 183 . 1 1 A 25 25 ARG H H 25 8.409 8.036 0.373 2
1 184 . 1 1 A 25 25 ARG HA H 25 4.298 4.562 -0.264 2
1 187 . 1 1 A 25 25 ARG C C 25 176.217 175.328 0.889 2
1 188 . 1 1 A 25 25 ARG CA C 25 56.237 55.158 1.079 2
1 189 . 1 1 A 25 25 ARG CB C 25 30.467 32.292 -1.825 2
1 192 . 1 1 A 25 25 ARG N N 25 120.147 118.521 1.626 2
1 193 . 1 1 A 26 26 GLN H H 26 8.278 8.348 -0.070 2
1 194 . 1 1 A 26 26 GLN HA H 26 4.336 4.405 -0.069 2
1 200 . 1 1 A 26 26 GLN C C 26 175.566 175.128 0.438 2
1 201 . 1 1 A 26 26 GLN CA C 26 55.788 56.093 -0.305 2
1 202 . 1 1 A 26 26 GLN CB C 26 29.714 28.879 0.835 2
1 204 . 1 1 A 26 26 GLN N N 26 120.460 122.582 -2.122 2
1 206 . 1 1 A 27 27 SER H H 27 8.298 8.512 -0.214 2
1 208 . 1 1 A 27 27 SER CA C 27 56.156 55.904 0.252 2
1 209 . 1 1 A 27 27 SER CB C 27 63.813 64.443 -0.630 2
1 210 . 1 1 A 27 27 SER N N 27 117.382 122.764 -5.382 2
1 211 . 1 1 A 28 28 PRO HA H 28 4.366 4.432 -0.066 2
1 216 . 1 1 A 28 28 PRO C C 28 177.555 177.398 0.157 2
1 217 . 1 1 A 28 28 PRO CA C 28 64.486 64.873 -0.387 2
1 218 . 1 1 A 28 28 PRO CB C 28 31.892 31.942 -0.050 2
1 221 . 1 1 A 29 29 GLU H H 29 8.582 7.998 0.584 2
1 222 . 1 1 A 29 29 GLU HA H 29 4.218 4.447 -0.229 2
1 226 . 1 1 A 29 29 GLU CA C 29 57.261 57.268 -0.007 2
1 227 . 1 1 A 29 29 GLU CB C 29 29.633 30.820 -1.187 2
1 229 . 1 1 A 29 29 GLU N N 29 118.309 116.141 2.168 2
1 230 . 1 1 A 30 30 LYS H H 30 7.955 8.070 -0.115 2
1 231 . 1 1 A 30 30 LYS HA H 30 4.328 4.290 0.038 2
1 236 . 1 1 A 30 30 LYS C C 30 176.222 175.373 0.849 2
1 237 . 1 1 A 30 30 LYS CA C 30 56.247 56.877 -0.630 2
1 238 . 1 1 A 30 30 LYS CB C 30 32.720 32.002 0.718 2
1 242 . 1 1 A 30 30 LYS N N 30 120.129 118.964 1.165 2
1 243 . 1 1 A 31 31 SER H H 31 7.883 8.341 -0.458 2
1 244 . 1 1 A 31 31 SER HA H 31 4.458 4.696 -0.238 2
1 246 . 1 1 A 31 31 SER C C 31 174.129 174.634 -0.505 2
1 247 . 1 1 A 31 31 SER CA C 31 58.477 58.119 0.358 2
1 248 . 1 1 A 31 31 SER CB C 31 64.042 63.542 0.500 2
1 249 . 1 1 A 31 31 SER N N 31 115.366 117.475 -2.109 2
1 250 . 1 1 A 32 32 HIS H H 32 8.485 8.459 0.026 2
1 251 . 1 1 A 32 32 HIS HA H 32 4.450 4.766 -0.315 2
1 255 . 1 1 A 32 32 HIS CA C 32 56.009 55.917 0.092 2
1 256 . 1 1 A 32 32 HIS CB C 32 31.122 30.323 0.799 2
1 257 . 1 1 A 32 32 HIS N N 32 121.500 122.950 -1.450 2
1 258 . 1 1 A 33 33 MET H H 33 8.392 7.596 0.796 2
1 259 . 1 1 A 33 33 MET HA H 33 4.601 4.849 -0.248 2
1 265 . 1 1 A 33 33 MET C C 33 175.842 174.599 1.243 2
1 266 . 1 1 A 33 33 MET CA C 33 54.533 54.143 0.390 2
1 267 . 1 1 A 33 33 MET CB C 33 32.868 35.028 -2.160 2
1 270 . 1 1 A 33 33 MET N N 33 120.204 119.680 0.524 2
1 271 . 1 1 A 34 34 VAL H H 34 8.938 9.068 -0.130 2
1 272 . 1 1 A 34 34 VAL HA H 34 4.430 4.726 -0.296 2
1 280 . 1 1 A 34 34 VAL C C 34 174.149 174.400 -0.251 2
1 281 . 1 1 A 34 34 VAL CA C 34 60.703 59.677 1.026 2
1 282 . 1 1 A 34 34 VAL CB C 34 34.319 34.985 -0.666 2
1 285 . 1 1 A 34 34 VAL N N 34 118.512 123.204 -4.692 2
1 286 . 1 1 A 35 35 PHE H H 35 9.242 8.211 1.031 2
1 287 . 1 1 A 35 35 PHE HA H 35 4.439 5.500 -1.060 2
1 294 . 1 1 A 35 35 PHE C C 35 174.831 174.259 0.572 2
1 295 . 1 1 A 35 35 PHE CA C 35 57.754 55.114 2.640 2
1 296 . 1 1 A 35 35 PHE CB C 35 38.959 41.804 -2.845 2
1 297 . 1 1 A 35 35 PHE N N 35 124.912 124.874 0.038 2
1 298 . 1 1 A 36 36 ARG H H 36 8.475 8.942 -0.467 2
1 299 . 1 1 A 36 36 ARG HA H 36 4.135 4.804 -0.669 2
1 304 . 1 1 A 36 36 ARG C C 36 172.865 175.603 -2.738 2
1 305 . 1 1 A 36 36 ARG CA C 36 56.895 55.524 1.371 2
1 306 . 1 1 A 36 36 ARG CB C 36 28.962 30.912 -1.950 2
1 308 . 1 1 A 36 36 ARG N N 36 125.680 121.061 4.619 2
1 309 . 1 1 A 37 37 VAL H H 37 8.066 8.982 -0.916 2
1 310 . 1 1 A 37 37 VAL HA H 37 4.292 4.595 -0.303 2
1 318 . 1 1 A 37 37 VAL C C 37 174.595 174.586 0.009 2
1 319 . 1 1 A 37 37 VAL CA C 37 62.727 61.338 1.389 2
1 320 . 1 1 A 37 37 VAL CB C 37 31.102 32.941 -1.839 2
1 323 . 1 1 A 37 37 VAL N N 37 125.403 121.016 4.387 2
1 324 . 1 1 A 38 38 GLU H H 38 9.532 9.115 0.417 2
1 325 . 1 1 A 38 38 GLU HA H 38 4.895 5.108 -0.213 2
1 329 . 1 1 A 38 38 GLU C C 38 174.509 175.135 -0.626 2
1 330 . 1 1 A 38 38 GLU CA C 38 55.650 55.169 0.481 2
1 331 . 1 1 A 38 38 GLU CB C 38 32.214 30.862 1.352 2
1 333 . 1 1 A 38 38 GLU N N 38 129.885 125.992 3.893 2
1 334 . 1 1 A 39 39 VAL H H 39 9.035 8.776 0.259 2
1 335 . 1 1 A 39 39 VAL HA H 39 4.446 4.546 -0.100 2
1 343 . 1 1 A 39 39 VAL C C 39 173.661 174.135 -0.474 2
1 344 . 1 1 A 39 39 VAL CA C 39 61.258 61.712 -0.454 2
1 345 . 1 1 A 39 39 VAL CB C 39 33.533 32.583 0.950 2
1 348 . 1 1 A 39 39 VAL N N 39 127.941 126.993 0.948 2
1 349 . 1 1 A 40 40 LEU H H 40 8.843 9.243 -0.400 2
1 350 . 1 1 A 40 40 LEU HA H 40 5.130 5.138 -0.008 2
1 360 . 1 1 A 40 40 LEU C C 40 175.581 175.169 0.412 2
1 361 . 1 1 A 40 40 LEU CA C 40 53.702 53.766 -0.064 2
1 362 . 1 1 A 40 40 LEU CB C 40 43.989 43.900 0.089 2
1 366 . 1 1 A 40 40 LEU N N 40 128.413 129.811 -1.398 2
1 367 . 1 1 A 41 41 CYS H H 41 8.959 9.030 -0.071 2
1 368 . 1 1 A 41 41 CYS HA H 41 5.174 5.008 0.166 2
1 371 . 1 1 A 41 41 CYS C C 41 175.043 174.130 0.913 2
1 372 . 1 1 A 41 41 CYS CA C 41 57.483 57.759 -0.276 2
1 373 . 1 1 A 41 41 CYS CB C 41 28.472 29.908 -1.436 2
1 374 . 1 1 A 41 41 CYS N N 41 124.738 125.215 -0.477 2
1 375 . 1 1 A 42 42 SER H H 42 9.527 9.201 0.326 2
1 376 . 1 1 A 42 42 SER HA H 42 4.149 4.346 -0.197 2
1 379 . 1 1 A 42 42 SER C C 42 175.014 174.142 0.872 2
1 380 . 1 1 A 42 42 SER CA C 42 59.058 59.482 -0.424 2
1 381 . 1 1 A 42 42 SER CB C 42 62.287 62.056 0.231 2
1 382 . 1 1 A 42 42 SER N N 42 125.889 120.588 5.301 2
1 383 . 1 1 A 43 43 GLY H H 43 8.685 8.312 0.374 2
1 384 . 1 1 A 43 43 GLY HA2 H 43 3.594 3.949 -0.355 2
1 385 . 1 1 A 43 43 GLY HA3 H 43 4.210 3.963 0.247 2
1 386 . 1 1 A 43 43 GLY C C 43 173.664 173.914 -0.250 2
1 387 . 1 1 A 43 43 GLY CA C 43 45.404 45.291 0.113 2
1 388 . 1 1 A 43 43 GLY N N 43 104.633 106.492 -1.859 2
1 389 . 1 1 A 44 44 ARG H H 44 7.926 7.774 0.152 2
1 390 . 1 1 A 44 44 ARG HA H 44 4.678 4.587 0.091 2
1 395 . 1 1 A 44 44 ARG C C 44 175.261 175.349 -0.088 2
1 396 . 1 1 A 44 44 ARG CA C 44 55.011 55.395 -0.384 2
1 397 . 1 1 A 44 44 ARG CB C 44 32.138 31.917 0.221 2
1 400 . 1 1 A 44 44 ARG N N 44 121.239 120.587 0.652 2
1 401 . 1 1 A 45 45 ARG H H 45 8.775 8.998 -0.223 2
1 402 . 1 1 A 45 45 ARG HA H 45 5.770 5.290 0.480 2
1 409 . 1 1 A 45 45 ARG C C 45 176.064 175.110 0.954 2
1 410 . 1 1 A 45 45 ARG CA C 45 54.683 54.588 0.095 2
1 411 . 1 1 A 45 45 ARG CB C 45 33.748 33.372 0.376 2
1 414 . 1 1 A 45 45 ARG N N 45 125.948 121.464 4.484 2
1 415 . 1 1 A 46 46 HIS H H 46 8.912 8.616 0.296 2
1 416 . 1 1 A 46 46 HIS HA H 46 4.927 5.489 -0.562 2
1 420 . 1 1 A 46 46 HIS C C 46 172.634 173.249 -0.615 2
1 421 . 1 1 A 46 46 HIS CA C 46 56.480 54.287 2.193 2
1 422 . 1 1 A 46 46 HIS CB C 46 33.608 32.635 0.973 2
1 423 . 1 1 A 46 46 HIS N N 46 121.825 118.708 3.117 2
1 424 . 1 1 A 47 47 THR H H 47 8.532 8.827 -0.295 2
1 425 . 1 1 A 47 47 THR HA H 47 5.472 4.690 0.782 2
1 430 . 1 1 A 47 47 THR C C 47 174.442 173.983 0.459 2
1 431 . 1 1 A 47 47 THR CA C 47 61.093 62.346 -1.253 2
1 432 . 1 1 A 47 47 THR CB C 47 71.041 69.002 2.039 2
1 434 . 1 1 A 47 47 THR N N 47 115.450 119.941 -4.491 2
1 435 . 1 1 A 48 48 VAL H H 48 9.695 9.327 0.368 2
1 436 . 1 1 A 48 48 VAL HA H 48 4.677 4.570 0.107 2
1 444 . 1 1 A 48 48 VAL CA C 48 58.172 59.319 -1.147 2
1 445 . 1 1 A 48 48 VAL CB C 48 34.990 33.058 1.932 2
1 448 . 1 1 A 48 48 VAL N N 48 126.721 127.355 -0.634 2
1 449 . 1 1 A 49 49 PRO HA H 49 5.087 4.967 0.120 2
1 453 . 1 1 A 49 49 PRO CA C 49 61.671 62.591 -0.920 2
1 454 . 1 1 A 49 49 PRO CB C 49 31.923 31.772 0.151 2
1 457 . 1 1 A 50 50 ARG H H 50 9.125 9.007 0.118 2
1 458 . 1 1 A 50 50 ARG HA H 50 4.974 4.730 0.244 2
1 464 . 1 1 A 50 50 ARG C C 50 176.187 174.673 1.514 2
1 465 . 1 1 A 50 50 ARG CA C 50 53.015 54.540 -1.525 2
1 466 . 1 1 A 50 50 ARG CB C 50 36.553 33.845 2.708 2
1 468 . 1 1 A 50 50 ARG N N 50 124.189 123.465 0.724 2
1 469 . 1 1 A 51 51 ARG H H 51 10.105 8.571 1.534 2
1 470 . 1 1 A 51 51 ARG HA H 51 5.196 4.185 1.011 2
1 475 . 1 1 A 51 51 ARG C C 51 178.865 176.656 2.209 2
1 476 . 1 1 A 51 51 ARG CA C 51 55.961 55.388 0.573 2
1 477 . 1 1 A 51 51 ARG CB C 51 32.539 31.270 1.269 2
1 480 . 1 1 A 51 51 ARG N N 51 124.521 124.149 0.372 2
1 481 . 1 1 A 52 52 TYR H H 52 10.397 8.813 1.584 2
1 482 . 1 1 A 52 52 TYR HA H 52 4.360 4.275 0.085 2
1 487 . 1 1 A 52 52 TYR C C 52 178.143 177.647 0.496 2
1 488 . 1 1 A 52 52 TYR CA C 52 63.538 61.796 1.742 2
1 489 . 1 1 A 52 52 TYR CB C 52 38.784 38.565 0.219 2
1 490 . 1 1 A 52 52 TYR N N 52 124.772 124.619 0.153 2
1 491 . 1 1 A 53 53 SER H H 53 9.231 8.258 0.973 2
1 492 . 1 1 A 53 53 SER HA H 53 4.175 4.368 -0.193 2
1 493 . 1 1 A 53 53 SER C C 53 177.220 177.022 0.198 2
1 494 . 1 1 A 53 53 SER CA C 53 61.606 61.773 -0.167 2
1 495 . 1 1 A 53 53 SER N N 53 113.262 115.452 -2.190 2
1 496 . 1 1 A 54 54 GLU H H 54 7.807 7.749 0.058 2
1 497 . 1 1 A 54 54 GLU HA H 54 4.392 4.085 0.307 2
1 501 . 1 1 A 54 54 GLU C C 54 180.361 179.000 1.361 2
1 502 . 1 1 A 54 54 GLU CA C 54 59.497 59.095 0.402 2
1 503 . 1 1 A 54 54 GLU CB C 54 30.708 29.411 1.297 2
1 504 . 1 1 A 54 54 GLU N N 54 121.949 121.843 0.106 2
1 505 . 1 1 A 55 55 PHE H H 55 8.133 8.047 0.086 2
1 506 . 1 1 A 55 55 PHE HA H 55 4.007 4.213 -0.206 2
1 513 . 1 1 A 55 55 PHE C C 55 176.531 177.755 -1.224 2
1 514 . 1 1 A 55 55 PHE CA C 55 61.848 61.095 0.753 2
1 515 . 1 1 A 55 55 PHE CB C 55 38.847 38.830 0.017 2
1 516 . 1 1 A 55 55 PHE N N 55 119.998 120.988 -0.990 2
1 517 . 1 1 A 56 56 HIS H H 56 7.907 8.179 -0.272 2
1 518 . 1 1 A 56 56 HIS HA H 56 3.324 4.079 -0.755 2
1 522 . 1 1 A 56 56 HIS C C 56 176.748 177.442 -0.694 2
1 523 . 1 1 A 56 56 HIS CA C 56 58.770 59.782 -1.012 2
1 524 . 1 1 A 56 56 HIS CB C 56 30.404 29.388 1.016 2
1 525 . 1 1 A 56 56 HIS N N 56 119.173 118.073 1.100 2
1 526 . 1 1 A 57 57 ALA H H 57 7.962 8.088 -0.126 2
1 527 . 1 1 A 57 57 ALA HA H 57 3.865 3.871 -0.006 2
1 531 . 1 1 A 57 57 ALA C C 57 180.075 179.721 0.354 2
1 532 . 1 1 A 57 57 ALA CA C 57 54.996 55.066 -0.069 2
1 533 . 1 1 A 57 57 ALA CB C 57 18.226 18.080 0.146 2
1 534 . 1 1 A 57 57 ALA N N 57 120.094 121.637 -1.543 2
1 535 . 1 1 A 58 58 LEU H H 58 7.295 8.094 -0.799 2
1 536 . 1 1 A 58 58 LEU HA H 58 3.994 3.817 0.177 2
1 546 . 1 1 A 58 58 LEU C C 58 177.428 178.458 -1.030 2
1 547 . 1 1 A 58 58 LEU CA C 58 58.342 57.775 0.567 2
1 548 . 1 1 A 58 58 LEU CB C 58 40.851 41.275 -0.424 2
1 552 . 1 1 A 58 58 LEU N N 58 119.404 119.328 0.076 2
1 553 . 1 1 A 59 59 HIS H H 59 7.805 8.192 -0.387 2
1 554 . 1 1 A 59 59 HIS HA H 59 4.286 3.857 0.429 2
1 558 . 1 1 A 59 59 HIS C C 59 177.001 177.284 -0.283 2
1 559 . 1 1 A 59 59 HIS CA C 59 60.141 59.902 0.239 2
1 560 . 1 1 A 59 59 HIS CB C 59 31.072 29.477 1.595 2
1 561 . 1 1 A 59 59 HIS N N 59 119.040 118.473 0.567 2
1 562 . 1 1 A 60 60 LYS H H 60 7.715 7.897 -0.182 2
1 563 . 1 1 A 60 60 LYS HA H 60 3.456 3.787 -0.331 2
1 570 . 1 1 A 60 60 LYS C C 60 178.464 178.842 -0.378 2
1 571 . 1 1 A 60 60 LYS CA C 60 59.629 59.023 0.606 2
1 572 . 1 1 A 60 60 LYS CB C 60 32.354 31.755 0.599 2
1 576 . 1 1 A 60 60 LYS N N 60 114.225 118.287 -4.062 2
1 577 . 1 1 A 61 61 ARG H H 61 7.486 7.644 -0.158 2
1 578 . 1 1 A 61 61 ARG HA H 61 4.202 4.011 0.191 2
1 584 . 1 1 A 61 61 ARG C C 61 178.995 178.845 0.150 2
1 585 . 1 1 A 61 61 ARG CA C 61 58.387 58.875 -0.488 2
1 586 . 1 1 A 61 61 ARG CB C 61 31.216 30.042 1.174 2
1 589 . 1 1 A 61 61 ARG N N 61 115.929 119.218 -3.289 2
1 590 . 1 1 A 62 62 ILE H H 62 8.066 7.673 0.393 2
1 591 . 1 1 A 62 62 ILE HA H 62 4.491 3.850 0.641 2
1 601 . 1 1 A 62 62 ILE C C 62 177.838 177.290 0.548 2
1 602 . 1 1 A 62 62 ILE CA C 62 63.399 63.542 -0.143 2
1 603 . 1 1 A 62 62 ILE CB C 62 39.699 37.305 2.394 2
1 606 . 1 1 A 62 62 ILE N N 62 111.456 117.129 -5.673 2
1 607 . 1 1 A 63 63 LYS H H 63 8.158 8.336 -0.178 2
1 608 . 1 1 A 63 63 LYS HA H 63 4.136 3.847 0.289 2
1 615 . 1 1 A 63 63 LYS C C 63 176.358 178.161 -1.803 2
1 616 . 1 1 A 63 63 LYS CA C 63 58.753 58.700 0.053 2
1 617 . 1 1 A 63 63 LYS CB C 63 30.825 31.540 -0.715 2
1 621 . 1 1 A 63 63 LYS N N 63 120.800 123.200 -2.400 2
1 622 . 1 1 A 64 64 LYS H H 64 7.687 7.619 0.068 2
1 623 . 1 1 A 64 64 LYS HA H 64 4.301 4.136 0.165 2
1 628 . 1 1 A 64 64 LYS C C 64 177.084 178.076 -0.992 2
1 629 . 1 1 A 64 64 LYS CA C 64 57.237 58.104 -0.867 2
1 630 . 1 1 A 64 64 LYS CB C 64 32.502 32.323 0.179 2
1 634 . 1 1 A 64 64 LYS N N 64 116.548 119.094 -2.546 2
1 635 . 1 1 A 65 65 LEU H H 65 7.476 7.810 -0.334 2
1 636 . 1 1 A 65 65 LEU HA H 65 4.219 4.281 -0.062 2
1 645 . 1 1 A 65 65 LEU C C 65 175.886 176.205 -0.319 2
1 646 . 1 1 A 65 65 LEU CA C 65 55.542 56.797 -1.255 2
1 647 . 1 1 A 65 65 LEU CB C 65 45.493 43.314 2.179 2
1 650 . 1 1 A 65 65 LEU N N 65 118.000 119.811 -1.811 2
1 651 . 1 1 A 66 66 TYR H H 66 7.672 8.246 -0.574 2
1 652 . 1 1 A 66 66 TYR HA H 66 4.762 5.153 -0.391 2
1 660 . 1 1 A 66 66 TYR C C 66 174.199 174.128 0.071 2
1 661 . 1 1 A 66 66 TYR CA C 66 56.013 55.362 0.651 2
1 662 . 1 1 A 66 66 TYR CB C 66 40.380 41.021 -0.641 2
1 663 . 1 1 A 66 66 TYR N N 66 116.805 114.177 2.628 2
1 664 . 1 1 A 67 67 LYS H H 67 8.547 8.469 0.078 2
1 665 . 1 1 A 67 67 LYS HA H 67 4.436 4.420 0.016 2
1 670 . 1 1 A 67 67 LYS C C 67 175.727 175.835 -0.108 2
1 671 . 1 1 A 67 67 LYS CA C 67 56.598 56.647 -0.049 2
1 672 . 1 1 A 67 67 LYS CB C 67 32.743 32.678 0.065 2
1 676 . 1 1 A 67 67 LYS N N 67 120.929 120.241 0.688 2
1 677 . 1 1 A 68 68 VAL H H 68 8.168 8.267 -0.099 2
1 678 . 1 1 A 68 68 VAL HA H 68 4.869 4.530 0.339 2
1 686 . 1 1 A 68 68 VAL CA C 68 57.389 58.761 -1.372 2
1 687 . 1 1 A 68 68 VAL CB C 68 34.017 35.120 -1.103 2
1 690 . 1 1 A 68 68 VAL N N 68 116.467 123.497 -7.030 2
1 691 . 1 1 A 69 69 PRO HA H 69 4.674 4.660 0.014 2
1 696 . 1 1 A 69 69 PRO C C 69 178.013 176.118 1.895 2
1 697 . 1 1 A 69 69 PRO CA C 69 61.443 62.865 -1.422 2
1 698 . 1 1 A 69 69 PRO CB C 69 32.231 32.817 -0.586 2
1 701 . 1 1 A 70 70 ASP H H 70 8.167 8.535 -0.368 2
1 702 . 1 1 A 70 70 ASP HA H 70 4.531 4.859 -0.328 2
1 705 . 1 1 A 70 70 ASP C C 70 175.660 175.578 0.082 2
1 706 . 1 1 A 70 70 ASP CA C 70 55.148 53.790 1.358 2
1 707 . 1 1 A 70 70 ASP CB C 70 40.876 42.302 -1.426 2
1 708 . 1 1 A 70 70 ASP N N 70 116.671 120.801 -4.130 2
1 709 . 1 1 A 71 71 PHE H H 71 8.387 8.349 0.038 2
1 710 . 1 1 A 71 71 PHE HA H 71 4.076 4.721 -0.645 2
1 717 . 1 1 A 71 71 PHE CA C 71 55.672 54.712 0.960 2
1 718 . 1 1 A 71 71 PHE CB C 71 39.155 41.064 -1.909 2
1 719 . 1 1 A 71 71 PHE N N 71 126.533 118.007 8.526 2
1 720 . 1 1 A 72 72 PRO HA H 72 4.156 4.548 -0.392 2
1 727 . 1 1 A 72 72 PRO CA C 72 63.079 62.688 0.391 2
1 728 . 1 1 A 72 72 PRO CB C 72 32.107 32.315 -0.208 2
1 731 . 1 1 A 73 73 SER H H 73 8.468 8.485 -0.017 2
1 733 . 1 1 A 73 73 SER CA C 73 56.133 57.596 -1.463 2
1 734 . 1 1 A 73 73 SER CB C 73 63.991 64.507 -0.516 2
1 735 . 1 1 A 73 73 SER N N 73 121.533 117.731 3.802 2
1 736 . 1 1 A 74 74 LYS HA H 74 4.574 4.116 0.458 2
1 739 . 1 1 A 74 74 LYS CA C 74 55.659 58.305 -2.646 2
1 740 . 1 1 A 74 74 LYS CB C 74 30.550 32.582 -2.032 2
1 741 . 1 1 A 75 75 ARG H H 75 7.962 7.500 0.462 2
1 742 . 1 1 A 75 75 ARG HA H 75 4.162 4.617 -0.455 2
1 746 . 1 1 A 75 75 ARG CA C 75 56.123 55.483 0.640 2
1 747 . 1 1 A 75 75 ARG CB C 75 31.179 31.512 -0.333 2
1 749 . 1 1 A 75 75 ARG N N 75 121.665 120.726 0.939 2
1 750 . 1 1 A 76 76 LEU H H 76 8.071 8.418 -0.347 2
1 751 . 1 1 A 76 76 LEU HA H 76 4.618 4.683 -0.065 2
1 759 . 1 1 A 76 76 LEU CA C 76 52.764 51.457 1.307 2
1 760 . 1 1 A 76 76 LEU CB C 76 41.918 44.497 -2.579 2
1 762 . 1 1 A 76 76 LEU N N 76 124.196 126.989 -2.793 2
1 763 . 1 1 A 77 77 PRO HA H 77 4.393 4.332 0.061 2
1 767 . 1 1 A 77 77 PRO CA C 77 63.746 62.463 1.283 2
1 770 . 1 1 A 78 78 ASN H H 78 8.379 8.697 -0.318 2
1 771 . 1 1 A 78 78 ASN HA H 78 4.586 4.360 0.226 2
1 776 . 1 1 A 78 78 ASN C C 78 175.648 175.132 0.516 2
1 777 . 1 1 A 78 78 ASN CA C 78 53.591 54.107 -0.516 2
1 778 . 1 1 A 78 78 ASN CB C 78 37.826 38.788 -0.962 2
1 779 . 1 1 A 78 78 ASN N N 78 115.292 120.624 -5.332 2
1 781 . 1 1 A 79 79 TRP H H 79 7.900 7.913 -0.013 2
1 782 . 1 1 A 79 79 TRP HA H 79 4.326 4.308 0.018 2
1 788 . 1 1 A 79 79 TRP CA C 79 58.825 59.819 -0.994 2
1 789 . 1 1 A 79 79 TRP CB C 79 29.090 27.466 1.624 2
1 790 . 1 1 A 79 79 TRP N N 79 119.525 118.361 1.164 2
1 792 . 1 1 A 80 80 ARG H H 80 8.060 8.238 -0.178 2
1 793 . 1 1 A 80 80 ARG HA H 80 3.913 4.101 -0.188 2
1 798 . 1 1 A 80 80 ARG C C 80 177.024 178.337 -1.313 2
1 799 . 1 1 A 80 80 ARG CA C 80 58.292 59.147 -0.855 2
1 800 . 1 1 A 80 80 ARG CB C 80 30.146 29.942 0.204 2
1 803 . 1 1 A 80 80 ARG N N 80 118.864 119.816 -0.952 2
1 804 . 1 1 A 81 81 THR H H 81 7.725 7.689 0.036 2
1 805 . 1 1 A 81 81 THR HA H 81 4.297 4.254 0.043 2
1 809 . 1 1 A 81 81 THR CA C 81 62.481 64.182 -1.701 2
1 811 . 1 1 A 81 81 THR N N 81 109.863 112.545 -2.682 2
1 812 . 1 1 A 82 82 ARG HA H 82 4.341 4.617 -0.276 2
1 816 . 1 1 A 82 82 ARG C C 82 177.261 175.918 1.343 2
1 817 . 1 1 A 82 82 ARG CA C 82 56.846 55.352 1.494 2
1 818 . 1 1 A 82 82 ARG CB C 82 30.288 32.789 -2.501 2
1 820 . 1 1 A 83 83 GLY H H 83 8.321 8.416 -0.095 2
1 821 . 1 1 A 83 83 GLY HA2 H 83 3.957 4.163 -0.206 2
1 822 . 1 1 A 83 83 GLY C C 83 175.185 175.160 0.025 2
1 823 . 1 1 A 83 83 GLY CA C 83 46.297 44.896 1.401 2
1 824 . 1 1 A 83 83 GLY N N 83 109.146 108.331 0.815 2
1 825 . 1 1 A 84 84 LEU H H 84 8.303 8.793 -0.490 2
1 826 . 1 1 A 84 84 LEU HA H 84 4.018 4.075 -0.057 2
1 835 . 1 1 A 84 84 LEU C C 84 178.552 178.411 0.141 2
1 836 . 1 1 A 84 84 LEU CA C 84 58.236 56.764 1.472 2
1 837 . 1 1 A 84 84 LEU CB C 84 41.837 41.681 0.156 2
1 840 . 1 1 A 84 84 LEU N N 84 122.662 121.609 1.053 2
1 841 . 1 1 A 85 85 GLU H H 85 8.233 8.284 -0.051 2
1 842 . 1 1 A 85 85 GLU HA H 85 4.371 3.856 0.515 2
1 846 . 1 1 A 85 85 GLU C C 85 178.555 178.938 -0.383 2
1 847 . 1 1 A 85 85 GLU CA C 85 58.377 59.666 -1.289 2
1 848 . 1 1 A 85 85 GLU CB C 85 28.675 29.155 -0.480 2
1 850 . 1 1 A 85 85 GLU N N 85 119.781 119.422 0.359 2
1 851 . 1 1 A 86 86 GLN H H 86 7.877 7.945 -0.068 2
1 852 . 1 1 A 86 86 GLN HA H 86 4.100 4.048 0.052 2
1 858 . 1 1 A 86 86 GLN C C 86 179.557 178.186 1.370 2
1 859 . 1 1 A 86 86 GLN CA C 86 58.955 59.072 -0.117 2
1 860 . 1 1 A 86 86 GLN CB C 86 28.191 28.482 -0.291 2
1 862 . 1 1 A 86 86 GLN N N 86 118.042 119.215 -1.173 2
1 863 . 1 1 A 87 87 ARG H H 87 8.169 7.957 0.212 2
1 864 . 1 1 A 87 87 ARG HA H 87 3.975 3.977 -0.002 2
1 868 . 1 1 A 87 87 ARG C C 87 177.051 178.414 -1.363 2
1 869 . 1 1 A 87 87 ARG CA C 87 59.006 59.418 -0.412 2
1 870 . 1 1 A 87 87 ARG CB C 87 30.383 29.420 0.963 2
1 872 . 1 1 A 87 87 ARG N N 87 121.381 119.907 1.474 2
1 873 . 1 1 A 88 88 ARG H H 88 8.593 8.008 0.585 2
1 874 . 1 1 A 88 88 ARG HA H 88 3.726 3.772 -0.045 2
1 876 . 1 1 A 88 88 ARG C C 88 177.520 178.445 -0.925 2
1 877 . 1 1 A 88 88 ARG CA C 88 60.751 59.279 1.472 2
1 878 . 1 1 A 88 88 ARG CB C 88 30.153 29.955 0.198 2
1 879 . 1 1 A 88 88 ARG N N 88 120.863 118.603 2.260 2
1 880 . 1 1 A 89 89 GLN H H 89 8.355 7.954 0.401 2
1 881 . 1 1 A 89 89 GLN HA H 89 3.887 3.934 -0.047 2
1 887 . 1 1 A 89 89 GLN C C 89 179.499 178.465 1.034 2
1 888 . 1 1 A 89 89 GLN CA C 89 59.603 59.342 0.261 2
1 889 . 1 1 A 89 89 GLN CB C 89 28.464 28.086 0.378 2
1 891 . 1 1 A 89 89 GLN N N 89 116.860 119.047 -2.188 2
1 893 . 1 1 A 90 90 GLY H H 90 8.406 8.209 0.197 2
1 894 . 1 1 A 90 90 GLY HA2 H 90 3.672 3.574 0.098 2
1 895 . 1 1 A 90 90 GLY HA3 H 90 3.871 3.646 0.225 2
1 896 . 1 1 A 90 90 GLY C C 90 177.033 175.574 1.459 2
1 897 . 1 1 A 90 90 GLY CA C 90 46.813 47.139 -0.326 2
1 898 . 1 1 A 90 90 GLY N N 90 107.679 107.460 0.219 2
1 899 . 1 1 A 91 91 LEU H H 91 8.504 8.036 0.468 2
1 900 . 1 1 A 91 91 LEU HA H 91 3.784 3.904 -0.120 2
1 910 . 1 1 A 91 91 LEU C C 91 178.003 179.134 -1.131 2
1 911 . 1 1 A 91 91 LEU CA C 91 57.354 57.587 -0.233 2
1 912 . 1 1 A 91 91 LEU CB C 91 40.359 41.051 -0.692 2
1 916 . 1 1 A 91 91 LEU N N 91 123.959 121.440 2.519 2
1 917 . 1 1 A 92 92 GLU H H 92 8.324 8.527 -0.203 2
1 918 . 1 1 A 92 92 GLU HA H 92 3.732 3.884 -0.152 2
1 922 . 1 1 A 92 92 GLU C C 92 177.272 178.580 -1.308 2
1 923 . 1 1 A 92 92 GLU CA C 92 60.651 59.554 1.097 2
1 924 . 1 1 A 92 92 GLU CB C 92 30.843 29.192 1.651 2
1 926 . 1 1 A 92 92 GLU N N 92 121.991 120.119 1.872 2
1 927 . 1 1 A 93 93 ALA H H 93 8.126 7.759 0.367 2
1 928 . 1 1 A 93 93 ALA HA H 93 4.160 4.067 0.093 2
1 932 . 1 1 A 93 93 ALA C C 93 180.818 179.310 1.508 2
1 933 . 1 1 A 93 93 ALA CA C 93 54.828 54.879 -0.051 2
1 934 . 1 1 A 93 93 ALA CB C 93 18.032 18.066 -0.034 2
1 935 . 1 1 A 93 93 ALA N N 93 120.066 121.969 -1.903 2
1 936 . 1 1 A 94 94 TYR H H 94 7.916 7.580 0.336 2
1 937 . 1 1 A 94 94 TYR HA H 94 4.139 4.355 -0.216 2
1 942 . 1 1 A 94 94 TYR C C 94 175.895 178.256 -2.361 2
1 943 . 1 1 A 94 94 TYR CA C 94 61.915 61.543 0.372 2
1 944 . 1 1 A 94 94 TYR CB C 94 38.740 38.353 0.387 2
1 945 . 1 1 A 94 94 TYR N N 94 121.179 116.710 4.469 2
1 946 . 1 1 A 95 95 ILE H H 95 7.983 8.503 -0.520 2
1 947 . 1 1 A 95 95 ILE HA H 95 3.614 3.761 -0.147 2
1 957 . 1 1 A 95 95 ILE C C 95 174.678 178.161 -3.483 2
1 958 . 1 1 A 95 95 ILE CA C 95 63.461 64.922 -1.461 2
1 959 . 1 1 A 95 95 ILE CB C 95 36.625 37.441 -0.816 2
1 963 . 1 1 A 95 95 ILE N N 95 116.397 120.321 -3.924 2
1 964 . 1 1 A 96 96 GLN H H 96 8.175 8.584 -0.409 2
1 965 . 1 1 A 96 96 GLN HA H 96 3.763 4.030 -0.267 2
1 970 . 1 1 A 96 96 GLN C C 96 179.042 178.523 0.519 2
1 971 . 1 1 A 96 96 GLN CA C 96 59.270 59.667 -0.397 2
1 972 . 1 1 A 96 96 GLN CB C 96 27.696 28.000 -0.304 2
1 974 . 1 1 A 96 96 GLN N N 96 116.631 120.495 -3.864 2
1 976 . 1 1 A 97 97 GLY H H 97 8.222 8.239 -0.017 2
1 977 . 1 1 A 97 97 GLY HA2 H 97 3.661 3.742 -0.081 2
1 978 . 1 1 A 97 97 GLY HA3 H 97 3.806 3.764 0.042 2
1 979 . 1 1 A 97 97 GLY C C 97 175.449 176.106 -0.657 2
1 980 . 1 1 A 97 97 GLY CA C 97 46.917 47.393 -0.476 2
1 981 . 1 1 A 97 97 GLY N N 97 107.315 107.162 0.153 2
1 982 . 1 1 A 98 98 ILE H H 98 7.630 8.191 -0.561 2
1 983 . 1 1 A 98 98 ILE HA H 98 3.399 3.934 -0.535 2
1 993 . 1 1 A 98 98 ILE C C 98 178.683 177.990 0.693 2
1 994 . 1 1 A 98 98 ILE CA C 98 66.402 64.751 1.651 2
1 995 . 1 1 A 98 98 ILE CB C 98 38.037 37.535 0.502 2
1 999 . 1 1 A 98 98 ILE N N 98 120.644 120.764 -0.120 2
1 1000 . 1 1 A 99 99 LEU H H 99 7.076 7.995 -0.919 2
1 1001 . 1 1 A 99 99 LEU HA H 99 4.133 4.172 -0.039 2
1 1010 . 1 1 A 99 99 LEU C C 99 178.128 178.044 0.084 2
1 1011 . 1 1 A 99 99 LEU CA C 99 57.129 57.917 -0.788 2
1 1012 . 1 1 A 99 99 LEU CB C 99 41.108 41.655 -0.547 2
1 1014 . 1 1 A 99 99 LEU N N 99 116.844 123.470 -6.626 2
1 1015 . 1 1 A 100 100 TYR H H 100 7.890 8.361 -0.471 2
1 1016 . 1 1 A 100 100 TYR HA H 100 4.550 4.193 0.357 2
1 1021 . 1 1 A 100 100 TYR C C 100 178.210 177.563 0.647 2
1 1022 . 1 1 A 100 100 TYR CA C 100 59.452 60.582 -1.130 2
1 1023 . 1 1 A 100 100 TYR CB C 100 38.786 39.130 -0.344 2
1 1024 . 1 1 A 100 100 TYR N N 100 116.427 120.130 -3.703 2
1 1025 . 1 1 A 101 101 LEU H H 101 8.041 8.127 -0.086 2
1 1026 . 1 1 A 101 101 LEU HA H 101 4.158 3.962 0.196 2
1 1036 . 1 1 A 101 101 LEU C C 101 176.808 177.507 -0.699 2
1 1037 . 1 1 A 101 101 LEU CA C 101 56.156 58.165 -2.009 2
1 1038 . 1 1 A 101 101 LEU CB C 101 44.307 41.950 2.357 2
1 1041 . 1 1 A 101 101 LEU N N 101 116.493 120.337 -3.844 2
1 1042 . 1 1 A 102 102 ASN H H 102 7.146 7.931 -0.785 2
1 1043 . 1 1 A 102 102 ASN HA H 102 5.056 5.038 0.018 2
1 1046 . 1 1 A 102 102 ASN CA C 102 52.704 54.549 -1.845 2
1 1047 . 1 1 A 102 102 ASN CB C 102 42.424 40.477 1.947 2
1 1048 . 1 1 A 102 102 ASN N N 102 114.922 114.047 0.875 2
1 1049 . 1 1 A 103 103 GLN H H 103 8.477 7.935 0.542 2
1 1050 . 1 1 A 103 103 GLN HA H 103 3.866 4.128 -0.261 2
1 1054 . 1 1 A 103 103 GLN C C 103 176.110 175.807 0.303 2
1 1055 . 1 1 A 103 103 GLN CA C 103 58.451 56.398 2.053 2
1 1056 . 1 1 A 103 103 GLN CB C 103 28.896 28.461 0.435 2
1 1058 . 1 1 A 103 103 GLN N N 103 120.252 117.869 2.383 2
1 1059 . 1 1 A 104 104 GLU H H 104 7.930 8.006 -0.076 2
1 1060 . 1 1 A 104 104 GLU HA H 104 4.591 4.483 0.108 2
1 1064 . 1 1 A 104 104 GLU C C 104 175.397 175.598 -0.201 2
1 1065 . 1 1 A 104 104 GLU CA C 104 54.058 58.185 -4.127 2
1 1066 . 1 1 A 104 104 GLU CB C 104 31.272 28.807 2.465 2
1 1068 . 1 1 A 104 104 GLU N N 104 117.295 118.891 -1.596 2
1 1069 . 1 1 A 105 105 VAL H H 105 8.546 8.183 0.363 2
1 1070 . 1 1 A 105 105 VAL HA H 105 3.823 4.304 -0.481 2
1 1078 . 1 1 A 105 105 VAL CA C 105 60.706 60.137 0.569 2
1 1079 . 1 1 A 105 105 VAL CB C 105 32.126 32.620 -0.494 2
1 1082 . 1 1 A 105 105 VAL N N 105 124.511 122.375 2.136 2
1 1083 . 1 1 A 106 106 PRO HA H 106 3.997 4.584 -0.587 2
1 1089 . 1 1 A 106 106 PRO C C 106 178.240 177.752 0.488 2
1 1090 . 1 1 A 106 106 PRO CA C 106 62.961 63.017 -0.056 2
1 1091 . 1 1 A 106 106 PRO CB C 106 32.321 32.196 0.125 2
1 1094 . 1 1 A 107 107 LYS H H 107 9.122 8.977 0.145 2
1 1095 . 1 1 A 107 107 LYS HA H 107 3.813 3.974 -0.161 2
1 1101 . 1 1 A 107 107 LYS C C 107 178.563 177.914 0.649 2
1 1102 . 1 1 A 107 107 LYS CA C 107 60.085 59.498 0.587 2
1 1103 . 1 1 A 107 107 LYS CB C 107 31.632 32.310 -0.678 2
1 1106 . 1 1 A 107 107 LYS N N 107 129.017 124.631 4.386 2
1 1107 . 1 1 A 108 108 GLU H H 108 10.370 8.105 2.265 2
1 1108 . 1 1 A 108 108 GLU HA H 108 3.991 4.153 -0.162 2
1 1111 . 1 1 A 108 108 GLU C C 108 180.366 179.126 1.240 2
1 1112 . 1 1 A 108 108 GLU CA C 108 60.337 59.040 1.297 2
1 1113 . 1 1 A 108 108 GLU CB C 108 29.178 29.469 -0.291 2
1 1115 . 1 1 A 108 108 GLU N N 108 118.335 118.834 -0.499 2
1 1116 . 1 1 A 109 109 LEU H H 109 7.393 8.007 -0.614 2
1 1117 . 1 1 A 109 109 LEU HA H 109 4.220 4.186 0.034 2
1 1126 . 1 1 A 109 109 LEU C C 109 177.378 179.238 -1.860 2
1 1127 . 1 1 A 109 109 LEU CA C 109 56.618 57.848 -1.230 2
1 1128 . 1 1 A 109 109 LEU CB C 109 41.898 41.470 0.428 2
1 1131 . 1 1 A 109 109 LEU N N 109 118.285 120.647 -2.362 2
1 1132 . 1 1 A 110 110 LEU H H 110 7.641 7.952 -0.311 2
1 1133 . 1 1 A 110 110 LEU HA H 110 3.796 3.967 -0.171 2
1 1142 . 1 1 A 110 110 LEU C C 110 179.103 178.713 0.391 2
1 1143 . 1 1 A 110 110 LEU CA C 110 59.046 58.144 0.902 2
1 1144 . 1 1 A 110 110 LEU CB C 110 40.228 41.163 -0.935 2
1 1147 . 1 1 A 110 110 LEU N N 110 120.162 119.935 0.227 2
1 1148 . 1 1 A 111 111 GLU H H 111 7.916 8.194 -0.278 2
1 1149 . 1 1 A 111 111 GLU HA H 111 4.080 4.116 -0.036 2
1 1153 . 1 1 A 111 111 GLU C C 111 179.967 178.765 1.202 2
1 1154 . 1 1 A 111 111 GLU CA C 111 59.243 58.921 0.322 2
1 1155 . 1 1 A 111 111 GLU CB C 111 29.576 29.350 0.226 2
1 1157 . 1 1 A 111 111 GLU N N 111 117.360 119.127 -1.767 2
1 1158 . 1 1 A 112 112 PHE H H 112 7.712 8.028 -0.316 2
1 1159 . 1 1 A 112 112 PHE HA H 112 4.224 4.205 0.019 2
1 1164 . 1 1 A 112 112 PHE C C 112 177.180 177.106 0.075 2
1 1165 . 1 1 A 112 112 PHE CA C 112 61.407 61.126 0.281 2
1 1166 . 1 1 A 112 112 PHE CB C 112 40.172 39.586 0.586 2
1 1167 . 1 1 A 112 112 PHE N N 112 123.042 121.214 1.828 2
1 1168 . 1 1 A 113 113 LEU H H 113 8.056 8.016 0.040 2
1 1169 . 1 1 A 113 113 LEU HA H 113 4.147 4.331 -0.184 2
1 1175 . 1 1 A 113 113 LEU C C 113 173.717 176.077 -2.360 2
1 1176 . 1 1 A 113 113 LEU CA C 113 54.093 54.563 -0.470 2
1 1177 . 1 1 A 113 113 LEU CB C 113 41.517 42.245 -0.728 2
1 1179 . 1 1 A 113 113 LEU N N 113 115.595 117.300 -1.705 2
1 1180 . 1 1 A 114 114 ARG H H 114 7.902 7.977 -0.075 2
1 1181 . 1 1 A 114 114 ARG HA H 114 3.817 4.300 -0.482 2
1 1182 . 1 1 A 114 114 ARG C C 114 174.566 175.954 -1.388 2
1 1183 . 1 1 A 114 114 ARG CA C 114 57.233 57.096 0.137 2
1 1184 . 1 1 A 114 114 ARG CB C 114 27.788 27.891 -0.103 2
1 1185 . 1 1 A 114 114 ARG N N 114 116.021 117.216 -1.195 2
1 1186 . 1 1 A 115 115 LEU H H 115 8.160 7.967 0.193 2
1 1187 . 1 1 A 115 115 LEU HA H 115 4.462 4.265 0.197 2
1 1195 . 1 1 A 115 115 LEU C C 115 176.374 176.622 -0.248 2
1 1196 . 1 1 A 115 115 LEU CA C 115 53.965 54.859 -0.894 2
1 1197 . 1 1 A 115 115 LEU CB C 115 44.077 41.593 2.483 2
1 1199 . 1 1 A 115 115 LEU N N 115 118.089 119.025 -0.936 2
1 1200 . 1 1 A 116 116 ARG H H 116 8.066 7.774 0.292 2
1 1201 . 1 1 A 116 116 ARG HA H 116 4.172 4.293 -0.121 2
1 1203 . 1 1 A 116 116 ARG CA C 116 55.961 56.655 -0.694 2
1 1204 . 1 1 A 116 116 ARG CB C 116 31.379 30.621 0.758 2
1 1205 . 1 1 A 116 116 ARG N N 116 120.852 120.912 -0.060 2
1 1206 . 1 1 A 117 117 HIS H H 117 7.928 8.846 -0.918 2
1 1207 . 1 1 A 117 117 HIS HA H 117 4.557 4.289 0.268 2
1 1211 . 1 1 A 117 117 HIS CA C 117 55.937 56.786 -0.849 2
1 1212 . 1 1 A 117 117 HIS CB C 117 30.875 28.672 2.203 2
1 1213 . 1 1 A 118 118 PHE H H 118 8.183 8.052 0.131 2
1 1214 . 1 1 A 118 118 PHE HA H 118 4.730 4.592 0.138 2
1 1219 . 1 1 A 118 118 PHE CA C 118 55.716 56.212 -0.496 2
1 1220 . 1 1 A 118 118 PHE CB C 118 39.263 39.553 -0.289 2
1 1221 . 1 1 A 118 118 PHE N N 118 123.480 121.538 1.942 2
1 1222 . 1 1 A 119 119 PRO HA H 119 4.398 4.532 -0.134 2
1 1227 . 1 1 A 119 119 PRO C C 119 176.666 176.304 0.362 2
1 1228 . 1 1 A 119 119 PRO CA C 119 63.377 63.148 0.229 2
1 1229 . 1 1 A 119 119 PRO CB C 119 32.059 32.270 -0.211 2
1 1232 . 1 1 A 120 120 THR H H 120 8.054 8.023 0.031 2
1 1233 . 1 1 A 120 120 THR HA H 120 4.273 4.659 -0.386 2
1 1238 . 1 1 A 120 120 THR C C 120 174.154 172.871 1.283 2
1 1239 . 1 1 A 120 120 THR CA C 120 61.893 60.922 0.971 2
1 1240 . 1 1 A 120 120 THR CB C 120 69.736 69.897 -0.161 2
1 1242 . 1 1 A 120 120 THR N N 120 113.088 112.293 0.795 2
1 1243 . 1 1 A 121 121 ASP H H 121 8.209 8.606 -0.397 2
1 1244 . 1 1 A 121 121 ASP HA H 121 4.876 5.024 -0.148 2
1 1247 . 1 1 A 121 121 ASP CA C 121 52.126 51.346 0.780 2
1 1248 . 1 1 A 121 121 ASP CB C 121 41.553 41.759 -0.206 2
1 1249 . 1 1 A 121 121 ASP N N 121 123.630 124.784 -1.154 2
1 1250 . 1 1 A 122 122 PRO HA H 122 4.363 4.613 -0.250 2
1 1255 . 1 1 A 122 122 PRO C C 122 177.344 176.191 1.153 2
1 1256 . 1 1 A 122 122 PRO CA C 122 63.913 63.037 0.876 2
1 1257 . 1 1 A 122 122 PRO CB C 122 32.116 31.878 0.238 2
1 1260 . 1 1 A 123 123 LYS H H 123 8.344 8.423 -0.079 2
1 1261 . 1 1 A 123 123 LYS HA H 123 4.244 4.584 -0.340 2
1 1266 . 1 1 A 123 123 LYS C C 123 176.637 175.360 1.277 2
1 1267 . 1 1 A 123 123 LYS CA C 123 56.359 55.982 0.377 2
1 1268 . 1 1 A 123 123 LYS CB C 123 32.367 33.639 -1.272 2
1 1272 . 1 1 A 123 123 LYS N N 123 119.110 121.536 -2.426 2
1 1273 . 1 1 A 124 124 ALA H H 124 7.929 8.551 -0.622 2
1 1274 . 1 1 A 124 124 ALA HA H 124 4.248 4.706 -0.458 2
1 1278 . 1 1 A 124 124 ALA C C 124 177.648 176.343 1.305 2
1 1279 . 1 1 A 124 124 ALA CA C 124 52.618 51.552 1.066 2
1 1280 . 1 1 A 124 124 ALA CB C 124 19.379 19.573 -0.194 2
1 1281 . 1 1 A 124 124 ALA N N 124 123.825 128.172 -4.347 2
1 1282 . 1 1 A 125 125 SER H H 125 8.134 8.557 -0.423 2
1 1283 . 1 1 A 125 125 SER HA H 125 4.341 5.041 -0.700 2
1 1286 . 1 1 A 125 125 SER C C 125 174.172 173.176 0.996 2
1 1287 . 1 1 A 125 125 SER CA C 125 58.391 57.592 0.799 2
1 1288 . 1 1 A 125 125 SER CB C 125 63.748 64.632 -0.884 2
1 1289 . 1 1 A 125 125 SER N N 125 114.454 117.866 -3.412 2
1 1290 . 1 1 A 126 126 ASN H H 126 8.242 8.655 -0.413 2
1 1291 . 1 1 A 126 126 ASN HA H 126 4.657 5.229 -0.572 2
1 1294 . 1 1 A 126 126 ASN C C 126 174.624 174.032 0.592 2
1 1295 . 1 1 A 126 126 ASN CA C 126 53.292 52.450 0.842 2
1 1296 . 1 1 A 126 126 ASN CB C 126 38.797 40.458 -1.661 2
1 1297 . 1 1 A 126 126 ASN N N 126 120.102 123.082 -2.980 2
1 1298 . 1 1 A 127 127 TRP H H 127 8.051 8.826 -0.775 2
1 1299 . 1 1 A 127 127 TRP HA H 127 4.694 5.095 -0.401 2
1 1302 . 1 1 A 127 127 TRP C C 127 175.479 175.608 -0.129 2
1 1303 . 1 1 A 127 127 TRP CA C 127 57.096 56.489 0.607 2
1 1304 . 1 1 A 127 127 TRP CB C 127 29.820 31.218 -1.398 2
1 1305 . 1 1 A 127 127 TRP N N 127 121.198 125.437 -4.239 2
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