data_15386_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15386
_Entry.PDB_ID 2JT1
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 2 2 SER HA H 2 4.126 4.736 -0.610 1
1 4 . 1 1 1 A 2 2 SER CA C 2 57.564 58.546 -0.982 1
1 5 . 1 1 1 A 2 2 SER CB C 2 63.953 65.818 -1.865 1
1 6 . 1 1 1 A 3 3 GLU HA H 3 4.408 4.065 0.343 1
1 11 . 1 1 1 A 3 3 GLU C C 3 176.658 176.836 -0.178 1
1 12 . 1 1 1 A 3 3 GLU CA C 3 56.802 59.021 -2.219 1
1 13 . 1 1 1 A 3 3 GLU CB C 3 30.674 29.312 1.362 1
1 15 . 1 1 1 A 4 4 SER H H 4 8.650 8.016 0.634 1
1 16 . 1 1 1 A 4 4 SER HA H 4 4.463 4.282 0.181 1
1 19 . 1 1 1 A 4 4 SER C C 4 175.949 175.633 0.316 1
1 20 . 1 1 1 A 4 4 SER CA C 4 58.557 60.938 -2.381 1
1 21 . 1 1 1 A 4 4 SER CB C 4 63.834 62.828 1.006 1
1 22 . 1 1 1 A 4 4 SER N N 4 118.042 114.384 3.658 1
1 23 . 1 1 1 A 5 5 ILE H H 5 8.404 8.281 0.123 1
1 24 . 1 1 1 A 5 5 ILE HA H 5 3.902 3.848 0.054 1
1 34 . 1 1 1 A 5 5 ILE C C 5 176.608 177.716 -1.108 1
1 35 . 1 1 1 A 5 5 ILE CA C 5 62.662 64.021 -1.359 1
1 36 . 1 1 1 A 5 5 ILE CB C 5 37.622 37.456 0.166 1
1 40 . 1 1 1 A 5 5 ILE N N 5 124.711 120.861 3.850 1
1 41 . 1 1 1 A 6 6 VAL H H 6 7.602 7.935 -0.333 1
1 42 . 1 1 1 A 6 6 VAL HA H 6 3.293 3.261 0.032 1
1 50 . 1 1 1 A 6 6 VAL C C 6 177.088 178.152 -1.064 1
1 51 . 1 1 1 A 6 6 VAL CA C 6 67.180 66.498 0.682 1
1 52 . 1 1 1 A 6 6 VAL CB C 6 31.517 31.396 0.121 1
1 55 . 1 1 1 A 6 6 VAL N N 6 119.974 121.219 -1.245 1
1 56 . 1 1 1 A 7 7 THR H H 7 7.515 8.177 -0.662 1
1 57 . 1 1 1 A 7 7 THR HA H 7 3.823 3.765 0.058 1
1 62 . 1 1 1 A 7 7 THR C C 7 176.978 175.967 1.011 1
1 63 . 1 1 1 A 7 7 THR CA C 7 66.257 67.755 -1.498 1
1 64 . 1 1 1 A 7 7 THR CB C 7 68.410 68.237 0.173 1
1 66 . 1 1 1 A 7 7 THR N N 7 114.177 116.974 -2.797 1
1 67 . 1 1 1 A 8 8 LYS H H 8 7.807 8.043 -0.236 1
1 68 . 1 1 1 A 8 8 LYS HA H 8 4.066 3.945 0.121 1
1 77 . 1 1 1 A 8 8 LYS C C 8 178.733 178.306 0.427 1
1 78 . 1 1 1 A 8 8 LYS CA C 8 59.338 59.735 -0.397 1
1 79 . 1 1 1 A 8 8 LYS CB C 8 32.002 31.873 0.129 1
1 83 . 1 1 1 A 8 8 LYS N N 8 123.387 120.489 2.898 1
1 84 . 1 1 1 A 9 9 ILE H H 9 8.288 8.005 0.283 1
1 85 . 1 1 1 A 9 9 ILE HA H 9 3.421 3.571 -0.150 1
1 95 . 1 1 1 A 9 9 ILE C C 9 177.187 178.297 -1.110 1
1 96 . 1 1 1 A 9 9 ILE CA C 9 65.772 65.733 0.039 1
1 97 . 1 1 1 A 9 9 ILE CB C 9 37.183 37.900 -0.717 1
1 101 . 1 1 1 A 9 9 ILE N N 9 119.543 118.968 0.575 1
1 102 . 1 1 1 A 10 10 ILE H H 10 8.073 8.184 -0.111 1
1 103 . 1 1 1 A 10 10 ILE HA H 10 3.305 3.502 -0.197 1
1 113 . 1 1 1 A 10 10 ILE C C 10 177.308 178.077 -0.769 1
1 114 . 1 1 1 A 10 10 ILE CA C 10 66.704 65.365 1.339 1
1 115 . 1 1 1 A 10 10 ILE CB C 10 37.840 37.937 -0.097 1
1 119 . 1 1 1 A 10 10 ILE N N 10 119.219 119.973 -0.754 1
1 120 . 1 1 1 A 11 11 SER H H 11 7.861 8.145 -0.284 1
1 121 . 1 1 1 A 11 11 SER HA H 11 4.250 4.070 0.180 1
1 124 . 1 1 1 A 11 11 SER C C 11 176.918 177.494 -0.576 1
1 125 . 1 1 1 A 11 11 SER CA C 11 61.911 61.615 0.296 1
1 126 . 1 1 1 A 11 11 SER CB C 11 62.998 62.970 0.028 1
1 127 . 1 1 1 A 11 11 SER N N 11 113.959 115.335 -1.376 1
1 128 . 1 1 1 A 12 12 ILE H H 12 8.250 7.927 0.323 1
1 129 . 1 1 1 A 12 12 ILE HA H 12 3.801 3.661 0.140 1
1 139 . 1 1 1 A 12 12 ILE C C 12 178.130 178.121 0.009 1
1 140 . 1 1 1 A 12 12 ILE CA C 12 65.023 64.914 0.109 1
1 141 . 1 1 1 A 12 12 ILE CB C 12 38.195 37.739 0.456 1
1 145 . 1 1 1 A 12 12 ILE N N 12 123.767 121.290 2.477 1
1 146 . 1 1 1 A 13 13 VAL H H 13 8.308 8.347 -0.039 1
1 147 . 1 1 1 A 13 13 VAL HA H 13 3.435 3.480 -0.045 1
1 155 . 1 1 1 A 13 13 VAL C C 13 177.283 178.014 -0.731 1
1 156 . 1 1 1 A 13 13 VAL CA C 13 67.693 66.899 0.794 1
1 157 . 1 1 1 A 13 13 VAL CB C 13 31.139 31.392 -0.253 1
1 160 . 1 1 1 A 13 13 VAL N N 13 120.066 119.878 0.188 1
1 161 . 1 1 1 A 14 14 GLN H H 14 8.612 8.099 0.513 1
1 162 . 1 1 1 A 14 14 GLN HA H 14 3.831 3.988 -0.157 1
1 169 . 1 1 1 A 14 14 GLN C C 14 178.256 178.713 -0.457 1
1 170 . 1 1 1 A 14 14 GLN CA C 14 59.660 59.342 0.318 1
1 171 . 1 1 1 A 14 14 GLN CB C 14 29.456 28.144 1.312 1
1 174 . 1 1 1 A 14 14 GLN N N 14 118.099 119.300 -1.201 1
1 176 . 1 1 1 A 15 15 GLU H H 15 8.378 8.309 0.069 1
1 177 . 1 1 1 A 15 15 GLU HA H 15 4.110 4.098 0.012 1
1 182 . 1 1 1 A 15 15 GLU C C 15 179.659 178.974 0.685 1
1 183 . 1 1 1 A 15 15 GLU CA C 15 59.476 59.326 0.150 1
1 184 . 1 1 1 A 15 15 GLU CB C 15 29.725 29.248 0.477 1
1 186 . 1 1 1 A 15 15 GLU N N 15 118.580 119.189 -0.609 1
1 187 . 1 1 1 A 16 16 ARG H H 16 8.439 8.169 0.270 1
1 188 . 1 1 1 A 16 16 ARG HA H 16 4.157 4.093 0.064 1
1 196 . 1 1 1 A 16 16 ARG C C 16 179.276 179.062 0.214 1
1 197 . 1 1 1 A 16 16 ARG CA C 16 58.141 59.450 -1.309 1
1 198 . 1 1 1 A 16 16 ARG CB C 16 29.434 30.083 -0.649 1
1 201 . 1 1 1 A 16 16 ARG N N 16 118.688 119.470 -0.782 1
1 203 . 1 1 1 A 17 17 GLN H H 17 8.861 8.027 0.834 1
1 204 . 1 1 1 A 17 17 GLN HA H 17 4.236 4.043 0.193 1
1 211 . 1 1 1 A 17 17 GLN C C 17 178.736 178.333 0.403 1
1 212 . 1 1 1 A 17 17 GLN CA C 17 59.683 58.494 1.189 1
1 213 . 1 1 1 A 17 17 GLN CB C 17 29.960 27.683 2.277 1
1 216 . 1 1 1 A 17 17 GLN N N 17 120.427 117.439 2.988 1
1 218 . 1 1 1 A 18 18 ASN H H 18 8.017 8.271 -0.254 1
1 219 . 1 1 1 A 18 18 ASN HA H 18 4.605 4.476 0.129 1
1 224 . 1 1 1 A 18 18 ASN C C 18 177.906 177.154 0.752 1
1 225 . 1 1 1 A 18 18 ASN CA C 18 55.375 56.803 -1.428 1
1 226 . 1 1 1 A 18 18 ASN CB C 18 38.383 39.076 -0.693 1
1 228 . 1 1 1 A 18 18 ASN N N 18 117.033 119.120 -2.087 1
1 230 . 1 1 1 A 19 19 MET H H 19 7.994 8.161 -0.167 1
1 231 . 1 1 1 A 19 19 MET HA H 19 4.372 4.421 -0.049 1
1 236 . 1 1 1 A 19 19 MET C C 19 176.518 177.253 -0.735 1
1 237 . 1 1 1 A 19 19 MET CA C 19 57.623 57.403 0.220 1
1 238 . 1 1 1 A 19 19 MET CB C 19 33.248 32.383 0.865 1
1 240 . 1 1 1 A 19 19 MET N N 19 119.320 117.683 1.637 1
1 241 . 1 1 1 A 20 20 ASP H H 20 7.800 8.297 -0.497 1
1 242 . 1 1 1 A 20 20 ASP HA H 20 4.990 4.629 0.361 1
1 245 . 1 1 1 A 20 20 ASP C C 20 176.082 176.354 -0.272 1
1 246 . 1 1 1 A 20 20 ASP CA C 20 53.796 54.027 -0.231 1
1 247 . 1 1 1 A 20 20 ASP CB C 20 40.409 40.957 -0.548 1
1 248 . 1 1 1 A 20 20 ASP N N 20 119.127 118.535 0.592 1
1 249 . 1 1 1 A 21 21 ASP H H 21 8.136 7.820 0.316 1
1 250 . 1 1 1 A 21 21 ASP HA H 21 4.497 4.218 0.279 1
1 253 . 1 1 1 A 21 21 ASP C C 21 176.264 176.944 -0.680 1
1 254 . 1 1 1 A 21 21 ASP CA C 21 55.508 56.537 -1.029 1
1 255 . 1 1 1 A 21 21 ASP CB C 21 40.063 39.332 0.731 1
1 256 . 1 1 1 A 21 21 ASP N N 21 118.276 117.068 1.208 1
1 257 . 1 1 1 A 22 22 GLY H H 22 8.728 8.737 -0.009 1
1 258 . 1 1 1 A 22 22 GLY HA2 H 22 4.189 3.959 0.230 1
1 259 . 1 1 1 A 22 22 GLY HA3 H 22 3.683 3.961 -0.278 1
1 260 . 1 1 1 A 22 22 GLY C C 22 174.304 173.995 0.309 1
1 261 . 1 1 1 A 22 22 GLY CA C 22 45.629 45.347 0.282 1
1 262 . 1 1 1 A 22 22 GLY N N 22 105.878 106.792 -0.914 1
1 263 . 1 1 1 A 23 23 ALA H H 23 7.473 7.595 -0.122 1
1 264 . 1 1 1 A 23 23 ALA HA H 23 4.519 4.500 0.019 1
1 268 . 1 1 1 A 23 23 ALA C C 23 174.065 176.147 -2.082 1
1 269 . 1 1 1 A 23 23 ALA CA C 23 51.142 49.512 1.630 1
1 270 . 1 1 1 A 23 23 ALA CB C 23 18.283 20.282 -1.999 1
1 271 . 1 1 1 A 23 23 ALA N N 23 125.323 123.453 1.870 1
1 272 . 1 1 1 A 24 24 PRO HA H 24 4.590 4.626 -0.036 1
1 279 . 1 1 1 A 24 24 PRO C C 24 175.253 175.854 -0.601 1
1 280 . 1 1 1 A 24 24 PRO CA C 24 62.186 62.283 -0.097 1
1 281 . 1 1 1 A 24 24 PRO CB C 24 32.931 32.834 0.097 1
1 284 . 1 1 1 A 25 25 VAL H H 25 9.334 8.489 0.845 1
1 285 . 1 1 1 A 25 25 VAL HA H 25 4.378 4.356 0.022 1
1 293 . 1 1 1 A 25 25 VAL C C 25 176.439 175.836 0.603 1
1 294 . 1 1 1 A 25 25 VAL CA C 25 61.482 62.483 -1.001 1
1 295 . 1 1 1 A 25 25 VAL CB C 25 34.781 32.563 2.218 1
1 298 . 1 1 1 A 25 25 VAL N N 25 120.408 120.487 -0.079 1
1 299 . 1 1 1 A 26 26 LYS H H 26 9.300 8.866 0.434 1
1 300 . 1 1 1 A 26 26 LYS HA H 26 4.982 4.677 0.305 1
1 309 . 1 1 1 A 26 26 LYS C C 26 179.008 177.615 1.393 1
1 310 . 1 1 1 A 26 26 LYS CA C 26 56.908 55.084 1.824 1
1 311 . 1 1 1 A 26 26 LYS CB C 26 34.071 33.823 0.248 1
1 315 . 1 1 1 A 26 26 LYS N N 26 126.177 124.915 1.262 1
1 316 . 1 1 1 A 27 27 THR H H 27 8.618 8.517 0.101 1
1 317 . 1 1 1 A 27 27 THR HA H 27 3.662 4.009 -0.347 1
1 322 . 1 1 1 A 27 27 THR C C 27 176.442 176.101 0.341 1
1 323 . 1 1 1 A 27 27 THR CA C 27 67.591 66.685 0.906 1
1 324 . 1 1 1 A 27 27 THR CB C 27 68.868 69.200 -0.332 1
1 326 . 1 1 1 A 27 27 THR N N 27 119.020 118.021 0.999 1
1 327 . 1 1 1 A 28 28 ARG H H 28 9.288 8.358 0.930 1
1 328 . 1 1 1 A 28 28 ARG HA H 28 3.879 4.012 -0.133 1
1 335 . 1 1 1 A 28 28 ARG C C 28 176.884 178.366 -1.482 1
1 336 . 1 1 1 A 28 28 ARG CA C 28 59.431 59.509 -0.078 1
1 337 . 1 1 1 A 28 28 ARG CB C 28 29.953 30.381 -0.428 1
1 340 . 1 1 1 A 28 28 ARG N N 28 119.100 120.243 -1.143 1
1 341 . 1 1 1 A 29 29 ASP H H 29 6.907 8.218 -1.311 1
1 342 . 1 1 1 A 29 29 ASP HA H 29 4.550 4.345 0.205 1
1 345 . 1 1 1 A 29 29 ASP C C 29 179.050 178.901 0.149 1
1 346 . 1 1 1 A 29 29 ASP CA C 29 57.262 57.706 -0.444 1
1 347 . 1 1 1 A 29 29 ASP CB C 29 40.191 42.103 -1.912 1
1 348 . 1 1 1 A 29 29 ASP N N 29 117.490 119.496 -2.006 1
1 349 . 1 1 1 A 30 30 ILE H H 30 7.554 7.831 -0.277 1
1 350 . 1 1 1 A 30 30 ILE HA H 30 3.595 3.784 -0.189 1
1 360 . 1 1 1 A 30 30 ILE C C 30 176.907 177.742 -0.835 1
1 361 . 1 1 1 A 30 30 ILE CA C 30 65.002 65.727 -0.725 1
1 362 . 1 1 1 A 30 30 ILE CB C 30 37.999 37.778 0.221 1
1 366 . 1 1 1 A 30 30 ILE N N 30 120.978 119.308 1.670 1
1 367 . 1 1 1 A 31 31 ALA H H 31 8.269 8.237 0.032 1
1 368 . 1 1 1 A 31 31 ALA HA H 31 3.720 4.006 -0.286 1
1 372 . 1 1 1 A 31 31 ALA C C 31 179.170 179.447 -0.277 1
1 373 . 1 1 1 A 31 31 ALA CA C 31 56.354 55.387 0.967 1
1 374 . 1 1 1 A 31 31 ALA CB C 31 17.843 17.553 0.290 1
1 375 . 1 1 1 A 31 31 ALA N N 31 121.171 122.349 -1.178 1
1 376 . 1 1 1 A 32 32 ASP H H 32 8.293 8.554 -0.261 1
1 377 . 1 1 1 A 32 32 ASP HA H 32 4.422 4.401 0.021 1
1 380 . 1 1 1 A 32 32 ASP C C 32 179.136 178.489 0.647 1
1 381 . 1 1 1 A 32 32 ASP CA C 32 57.109 57.084 0.025 1
1 382 . 1 1 1 A 32 32 ASP CB C 32 40.523 40.583 -0.060 1
1 383 . 1 1 1 A 32 32 ASP N N 32 116.467 119.459 -2.992 1
1 384 . 1 1 1 A 33 33 ALA H H 33 7.536 8.275 -0.739 1
1 385 . 1 1 1 A 33 33 ALA HA H 33 4.222 4.078 0.144 1
1 389 . 1 1 1 A 33 33 ALA C C 33 179.056 179.931 -0.875 1
1 390 . 1 1 1 A 33 33 ALA CA C 33 54.469 55.169 -0.700 1
1 391 . 1 1 1 A 33 33 ALA CB C 33 19.085 17.903 1.182 1
1 392 . 1 1 1 A 33 33 ALA N N 33 120.859 122.396 -1.537 1
1 393 . 1 1 1 A 34 34 ALA H H 34 8.296 7.578 0.718 1
1 394 . 1 1 1 A 34 34 ALA HA H 34 4.101 4.264 -0.163 1
1 398 . 1 1 1 A 34 34 ALA C C 34 176.912 178.092 -1.180 1
1 399 . 1 1 1 A 34 34 ALA CA C 34 52.380 52.456 -0.076 1
1 400 . 1 1 1 A 34 34 ALA CB C 34 18.817 19.590 -0.773 1
1 401 . 1 1 1 A 34 34 ALA N N 34 118.203 117.202 1.001 1
1 402 . 1 1 1 A 35 35 GLY H H 35 7.911 8.589 -0.678 1
1 403 . 1 1 1 A 35 35 GLY HA2 H 35 3.968 3.969 -0.001 1
1 404 . 1 1 1 A 35 35 GLY HA3 H 35 3.968 3.972 -0.004 1
1 405 . 1 1 1 A 35 35 GLY C C 35 174.374 174.123 0.251 1
1 406 . 1 1 1 A 35 35 GLY CA C 35 46.388 46.561 -0.173 1
1 407 . 1 1 1 A 35 35 GLY N N 35 107.752 107.894 -0.142 1
1 408 . 1 1 1 A 36 36 LEU H H 36 7.758 7.737 0.021 1
1 409 . 1 1 1 A 36 36 LEU HA H 36 4.887 4.948 -0.061 1
1 419 . 1 1 1 A 36 36 LEU C C 36 175.941 175.152 0.789 1
1 420 . 1 1 1 A 36 36 LEU CA C 36 52.443 53.005 -0.562 1
1 421 . 1 1 1 A 36 36 LEU CB C 36 47.885 45.387 2.498 1
1 425 . 1 1 1 A 36 36 LEU N N 36 118.719 120.288 -1.569 1
1 426 . 1 1 1 A 37 37 SER H H 37 8.603 8.657 -0.054 1
1 427 . 1 1 1 A 37 37 SER HA H 37 4.565 4.667 -0.102 1
1 430 . 1 1 1 A 37 37 SER C C 37 175.512 175.722 -0.210 1
1 431 . 1 1 1 A 37 37 SER CA C 37 57.262 57.294 -0.032 1
1 432 . 1 1 1 A 37 37 SER CB C 37 65.155 64.465 0.690 1
1 433 . 1 1 1 A 37 37 SER N N 37 115.095 115.780 -0.685 1
1 434 . 1 1 1 A 38 38 ILE H H 38 8.822 8.791 0.031 1
1 435 . 1 1 1 A 38 38 ILE HA H 38 3.650 3.772 -0.122 1
1 445 . 1 1 1 A 38 38 ILE C C 38 176.849 177.477 -0.628 1
1 446 . 1 1 1 A 38 38 ILE CA C 38 64.557 65.197 -0.640 1
1 447 . 1 1 1 A 38 38 ILE CB C 38 37.451 37.704 -0.253 1
1 451 . 1 1 1 A 38 38 ILE N N 38 122.026 128.548 -6.522 1
1 452 . 1 1 1 A 39 39 TYR H H 39 7.839 8.470 -0.631 1
1 453 . 1 1 1 A 39 39 TYR HA H 39 4.112 3.997 0.115 1
1 460 . 1 1 1 A 39 39 TYR C C 39 177.703 177.377 0.326 1
1 461 . 1 1 1 A 39 39 TYR CA C 39 60.856 62.073 -1.217 1
1 462 . 1 1 1 A 39 39 TYR CB C 39 38.402 38.445 -0.043 1
1 467 . 1 1 1 A 39 39 TYR N N 39 118.759 120.624 -1.865 1
1 468 . 1 1 1 A 40 40 GLN H H 40 7.687 8.172 -0.485 1
1 469 . 1 1 1 A 40 40 GLN HA H 40 3.865 3.791 0.074 1
1 476 . 1 1 1 A 40 40 GLN C C 40 178.735 178.212 0.523 1
1 477 . 1 1 1 A 40 40 GLN CA C 40 58.089 58.810 -0.721 1
1 478 . 1 1 1 A 40 40 GLN CB C 40 29.950 28.519 1.431 1
1 481 . 1 1 1 A 40 40 GLN N N 40 116.772 118.494 -1.722 1
1 483 . 1 1 1 A 41 41 VAL H H 41 8.494 8.182 0.312 1
1 484 . 1 1 1 A 41 41 VAL HA H 41 3.835 3.595 0.240 1
1 492 . 1 1 1 A 41 41 VAL C C 41 176.977 177.784 -0.807 1
1 493 . 1 1 1 A 41 41 VAL CA C 41 66.102 67.038 -0.936 1
1 494 . 1 1 1 A 41 41 VAL CB C 41 31.105 31.599 -0.494 1
1 497 . 1 1 1 A 41 41 VAL N N 41 117.192 119.539 -2.347 1
1 498 . 1 1 1 A 42 42 ARG H H 42 8.179 8.328 -0.149 1
1 499 . 1 1 1 A 42 42 ARG HA H 42 3.708 3.874 -0.166 1
1 506 . 1 1 1 A 42 42 ARG C C 42 177.570 178.372 -0.802 1
1 507 . 1 1 1 A 42 42 ARG CA C 42 60.349 58.475 1.874 1
1 508 . 1 1 1 A 42 42 ARG CB C 42 30.047 29.591 0.456 1
1 511 . 1 1 1 A 42 42 ARG N N 42 120.574 120.074 0.500 1
1 512 . 1 1 1 A 43 43 LEU H H 43 6.982 7.599 -0.617 1
1 513 . 1 1 1 A 43 43 LEU HA H 43 3.939 3.735 0.204 1
1 523 . 1 1 1 A 43 43 LEU C C 43 180.397 178.663 1.734 1
1 524 . 1 1 1 A 43 43 LEU CA C 43 58.119 57.748 0.371 1
1 525 . 1 1 1 A 43 43 LEU CB C 43 41.294 41.854 -0.560 1
1 529 . 1 1 1 A 43 43 LEU N N 43 117.189 121.510 -4.321 1
1 530 . 1 1 1 A 44 44 TYR H H 44 7.026 7.501 -0.475 1
1 531 . 1 1 1 A 44 44 TYR HA H 44 4.253 4.244 0.009 1
1 538 . 1 1 1 A 44 44 TYR C C 44 178.411 178.158 0.253 1
1 539 . 1 1 1 A 44 44 TYR CA C 44 60.941 60.598 0.343 1
1 540 . 1 1 1 A 44 44 TYR CB C 44 38.889 38.252 0.637 1
1 545 . 1 1 1 A 44 44 TYR N N 44 117.020 117.907 -0.887 1
1 546 . 1 1 1 A 45 45 LEU H H 45 8.429 8.563 -0.134 1
1 547 . 1 1 1 A 45 45 LEU HA H 45 3.486 3.597 -0.111 1
1 557 . 1 1 1 A 45 45 LEU C C 45 178.648 179.178 -0.530 1
1 558 . 1 1 1 A 45 45 LEU CA C 45 57.915 57.592 0.323 1
1 559 . 1 1 1 A 45 45 LEU CB C 45 39.073 40.428 -1.355 1
1 563 . 1 1 1 A 45 45 LEU N N 45 119.649 120.059 -0.410 1
1 564 . 1 1 1 A 46 46 GLU H H 46 8.309 8.116 0.193 1
1 565 . 1 1 1 A 46 46 GLU HA H 46 4.286 4.133 0.153 1
1 570 . 1 1 1 A 46 46 GLU C C 46 179.577 179.103 0.474 1
1 571 . 1 1 1 A 46 46 GLU CA C 46 59.570 59.463 0.107 1
1 572 . 1 1 1 A 46 46 GLU CB C 46 29.034 29.214 -0.180 1
1 574 . 1 1 1 A 46 46 GLU N N 46 117.366 119.550 -2.184 1
1 575 . 1 1 1 A 47 47 GLN H H 47 7.493 7.842 -0.349 1
1 576 . 1 1 1 A 47 47 GLN HA H 47 4.243 4.044 0.199 1
1 583 . 1 1 1 A 47 47 GLN C C 47 178.870 178.833 0.037 1
1 584 . 1 1 1 A 47 47 GLN CA C 47 59.581 58.850 0.731 1
1 585 . 1 1 1 A 47 47 GLN CB C 47 28.300 28.347 -0.047 1
1 588 . 1 1 1 A 47 47 GLN N N 47 119.345 118.933 0.412 1
1 590 . 1 1 1 A 48 48 LEU H H 48 8.160 8.386 -0.226 1
1 591 . 1 1 1 A 48 48 LEU HA H 48 4.211 4.019 0.192 1
1 601 . 1 1 1 A 48 48 LEU C C 48 180.111 179.219 0.892 1
1 602 . 1 1 1 A 48 48 LEU CA C 48 57.179 57.769 -0.590 1
1 603 . 1 1 1 A 48 48 LEU CB C 48 42.067 41.057 1.010 1
1 607 . 1 1 1 A 48 48 LEU N N 48 118.594 119.339 -0.745 1
1 608 . 1 1 1 A 49 49 HIS H H 49 8.864 8.390 0.474 1
1 609 . 1 1 1 A 49 49 HIS HA H 49 5.162 4.802 0.360 1
1 613 . 1 1 1 A 49 49 HIS C C 49 178.801 177.061 1.740 1
1 614 . 1 1 1 A 49 49 HIS CA C 49 58.397 60.364 -1.967 1
1 615 . 1 1 1 A 49 49 HIS CB C 49 29.631 30.168 -0.537 1
1 617 . 1 1 1 A 49 49 HIS N N 49 122.537 118.385 4.152 1
1 618 . 1 1 1 A 50 50 ASP H H 50 8.683 8.336 0.347 1
1 619 . 1 1 1 A 50 50 ASP HA H 50 4.356 4.153 0.203 1
1 622 . 1 1 1 A 50 50 ASP C C 50 178.474 177.731 0.743 1
1 623 . 1 1 1 A 50 50 ASP CA C 50 57.744 57.118 0.626 1
1 624 . 1 1 1 A 50 50 ASP CB C 50 40.575 41.365 -0.790 1
1 625 . 1 1 1 A 50 50 ASP N N 50 123.169 119.208 3.961 1
1 626 . 1 1 1 A 51 51 VAL H H 51 7.606 7.360 0.246 1
1 627 . 1 1 1 A 51 51 VAL HA H 51 4.514 4.150 0.364 1
1 635 . 1 1 1 A 51 51 VAL C C 51 176.862 176.773 0.089 1
1 636 . 1 1 1 A 51 51 VAL CA C 51 61.590 61.841 -0.251 1
1 637 . 1 1 1 A 51 51 VAL CB C 51 31.423 31.762 -0.339 1
1 640 . 1 1 1 A 51 51 VAL N N 51 109.266 111.241 -1.975 1
1 641 . 1 1 1 A 52 52 GLY H H 52 7.696 7.808 -0.112 1
1 642 . 1 1 1 A 52 52 GLY HA2 H 52 4.172 3.942 0.230 1
1 643 . 1 1 1 A 52 52 GLY HA3 H 52 3.938 3.968 -0.030 1
1 644 . 1 1 1 A 52 52 GLY C C 52 174.276 175.885 -1.609 1
1 645 . 1 1 1 A 52 52 GLY CA C 52 46.228 45.214 1.014 1
1 646 . 1 1 1 A 52 52 GLY N N 52 108.681 110.690 -2.009 1
1 647 . 1 1 1 A 53 53 VAL H H 53 8.046 7.867 0.179 1
1 648 . 1 1 1 A 53 53 VAL HA H 53 4.079 3.698 0.381 1
1 656 . 1 1 1 A 53 53 VAL C C 53 175.949 176.106 -0.157 1
1 657 . 1 1 1 A 53 53 VAL CA C 53 64.063 65.583 -1.520 1
1 658 . 1 1 1 A 53 53 VAL CB C 53 33.160 32.028 1.132 1
1 661 . 1 1 1 A 53 53 VAL N N 53 117.892 119.915 -2.023 1
1 662 . 1 1 1 A 54 54 LEU H H 54 6.835 7.498 -0.663 1
1 663 . 1 1 1 A 54 54 LEU HA H 54 5.348 5.051 0.297 1
1 673 . 1 1 1 A 54 54 LEU C C 54 175.713 175.772 -0.059 1
1 674 . 1 1 1 A 54 54 LEU CA C 54 52.194 53.149 -0.955 1
1 675 . 1 1 1 A 54 54 LEU CB C 54 46.733 45.441 1.292 1
1 679 . 1 1 1 A 54 54 LEU N N 54 114.848 117.708 -2.860 1
1 680 . 1 1 1 A 55 55 GLU H H 55 9.549 9.439 0.110 1
1 681 . 1 1 1 A 55 55 GLU HA H 55 4.826 5.477 -0.651 1
1 686 . 1 1 1 A 55 55 GLU C C 55 174.661 175.498 -0.837 1
1 687 . 1 1 1 A 55 55 GLU CA C 55 54.637 54.889 -0.252 1
1 688 . 1 1 1 A 55 55 GLU CB C 55 32.891 33.419 -0.528 1
1 690 . 1 1 1 A 55 55 GLU N N 55 121.431 122.969 -1.538 1
1 691 . 1 1 1 A 56 56 LYS H H 56 8.513 8.379 0.134 1
1 692 . 1 1 1 A 56 56 LYS HA H 56 4.151 3.927 0.224 1
1 701 . 1 1 1 A 56 56 LYS C C 56 176.270 175.341 0.929 1
1 702 . 1 1 1 A 56 56 LYS CA C 56 54.890 55.453 -0.563 1
1 703 . 1 1 1 A 56 56 LYS CB C 56 33.162 31.407 1.755 1
1 707 . 1 1 1 A 56 56 LYS N N 56 126.539 121.690 4.849 1
1 708 . 1 1 1 A 57 57 VAL H H 57 8.279 8.477 -0.198 1
1 709 . 1 1 1 A 57 57 VAL HA H 57 3.820 4.267 -0.447 1
1 717 . 1 1 1 A 57 57 VAL C C 57 175.108 174.412 0.696 1
1 718 . 1 1 1 A 57 57 VAL CA C 57 62.834 62.311 0.523 1
1 719 . 1 1 1 A 57 57 VAL CB C 57 32.549 30.247 2.302 1
1 722 . 1 1 1 A 57 57 VAL N N 57 126.540 126.124 0.416 1
1 723 . 1 1 1 A 58 58 ASN H H 58 8.383 7.753 0.630 1
1 724 . 1 1 1 A 58 58 ASN HA H 58 4.612 4.989 -0.377 1
1 729 . 1 1 1 A 58 58 ASN C C 58 174.772 175.097 -0.325 1
1 730 . 1 1 1 A 58 58 ASN CA C 58 52.575 51.757 0.818 1
1 731 . 1 1 1 A 58 58 ASN CB C 58 38.502 41.447 -2.945 1
1 733 . 1 1 1 A 58 58 ASN N N 58 121.767 122.546 -0.779 1
1 735 . 1 1 1 A 59 59 ALA H H 59 8.165 8.561 -0.396 1
1 736 . 1 1 1 A 59 59 ALA HA H 59 4.251 4.036 0.215 1
1 740 . 1 1 1 A 59 59 ALA C C 59 177.478 177.138 0.340 1
1 741 . 1 1 1 A 59 59 ALA CA C 59 52.490 53.586 -1.096 1
1 742 . 1 1 1 A 59 59 ALA CB C 59 19.724 19.581 0.143 1
1 743 . 1 1 1 A 59 59 ALA N N 59 125.082 123.320 1.762 1
1 744 . 1 1 1 A 60 60 GLY H H 60 8.291 7.418 0.873 1
1 745 . 1 1 1 A 60 60 GLY HA2 H 60 4.165 4.108 0.057 1
1 746 . 1 1 1 A 60 60 GLY HA3 H 60 3.853 4.124 -0.271 1
1 747 . 1 1 1 A 60 60 GLY C C 60 174.171 172.497 1.674 1
1 748 . 1 1 1 A 60 60 GLY CA C 60 44.994 45.675 -0.681 1
1 749 . 1 1 1 A 60 60 GLY N N 60 108.518 104.357 4.161 1
1 750 . 1 1 1 A 61 61 LYS H H 61 8.189 8.388 -0.199 1
1 751 . 1 1 1 A 61 61 LYS HA H 61 4.320 4.451 -0.131 1
1 760 . 1 1 1 A 61 61 LYS C C 61 177.712 177.223 0.489 1
1 761 . 1 1 1 A 61 61 LYS CA C 61 56.832 56.356 0.476 1
1 762 . 1 1 1 A 61 61 LYS CB C 61 32.641 33.837 -1.196 1
1 766 . 1 1 1 A 61 61 LYS N N 61 120.532 124.010 -3.478 1
1 767 . 1 1 1 A 62 62 GLY H H 62 8.767 8.867 -0.100 1
1 768 . 1 1 1 A 62 62 GLY HA2 H 62 4.021 3.934 0.087 1
1 769 . 1 1 1 A 62 62 GLY HA3 H 62 3.849 3.938 -0.089 1
1 770 . 1 1 1 A 62 62 GLY C C 62 173.782 173.553 0.229 1
1 771 . 1 1 1 A 62 62 GLY CA C 62 45.844 45.432 0.412 1
1 772 . 1 1 1 A 62 62 GLY N N 62 111.547 111.504 0.043 1
1 773 . 1 1 1 A 63 63 VAL H H 63 7.379 7.601 -0.222 1
1 774 . 1 1 1 A 63 63 VAL HA H 63 4.591 4.656 -0.065 1
1 782 . 1 1 1 A 63 63 VAL C C 63 174.262 175.334 -1.072 1
1 783 . 1 1 1 A 63 63 VAL CA C 63 59.292 58.209 1.083 1
1 784 . 1 1 1 A 63 63 VAL CB C 63 32.726 33.760 -1.034 1
1 787 . 1 1 1 A 63 63 VAL N N 63 117.546 115.653 1.893 1
1 788 . 1 1 1 A 64 64 PRO HA H 64 4.458 4.414 0.044 1
1 795 . 1 1 1 A 64 64 PRO C C 64 177.166 177.687 -0.521 1
1 796 . 1 1 1 A 64 64 PRO CA C 64 63.661 63.976 -0.315 1
1 797 . 1 1 1 A 64 64 PRO CB C 64 32.321 32.082 0.239 1
1 800 . 1 1 1 A 65 65 GLY H H 65 8.463 8.019 0.444 1
1 801 . 1 1 1 A 65 65 GLY HA2 H 65 3.882 3.852 0.030 1
1 802 . 1 1 1 A 65 65 GLY HA3 H 65 3.602 3.874 -0.272 1
1 803 . 1 1 1 A 65 65 GLY C C 65 172.406 172.879 -0.473 1
1 804 . 1 1 1 A 65 65 GLY CA C 65 45.933 44.512 1.421 1
1 805 . 1 1 1 A 65 65 GLY N N 65 109.819 107.749 2.070 1
1 806 . 1 1 1 A 66 66 LEU H H 66 7.534 8.245 -0.711 1
1 807 . 1 1 1 A 66 66 LEU HA H 66 4.940 5.176 -0.236 1
1 817 . 1 1 1 A 66 66 LEU C C 66 176.237 175.176 1.061 1
1 818 . 1 1 1 A 66 66 LEU CA C 66 53.687 53.005 0.682 1
1 819 . 1 1 1 A 66 66 LEU CB C 66 46.108 44.056 2.052 1
1 823 . 1 1 1 A 66 66 LEU N N 66 122.249 123.638 -1.389 1
1 824 . 1 1 1 A 67 67 TRP H H 67 8.916 9.280 -0.364 1
1 825 . 1 1 1 A 67 67 TRP HA H 67 5.526 5.402 0.124 1
1 834 . 1 1 1 A 67 67 TRP C C 67 175.670 175.010 0.660 1
1 835 . 1 1 1 A 67 67 TRP CA C 67 56.241 55.671 0.570 1
1 836 . 1 1 1 A 67 67 TRP CB C 67 33.314 31.887 1.427 1
1 842 . 1 1 1 A 67 67 TRP N N 67 121.160 125.186 -4.026 1
1 844 . 1 1 1 A 68 68 ARG H H 68 8.772 8.731 0.041 1
1 845 . 1 1 1 A 68 68 ARG HA H 68 4.832 5.041 -0.209 1
1 853 . 1 1 1 A 68 68 ARG C C 68 174.720 175.665 -0.945 1
1 854 . 1 1 1 A 68 68 ARG CA C 68 54.690 54.411 0.279 1
1 855 . 1 1 1 A 68 68 ARG CB C 68 35.176 34.107 1.069 1
1 858 . 1 1 1 A 68 68 ARG N N 68 117.471 123.788 -6.317 1
1 860 . 1 1 1 A 69 69 LEU H H 69 9.355 8.767 0.588 1
1 861 . 1 1 1 A 69 69 LEU HA H 69 4.557 4.929 -0.372 1
1 871 . 1 1 1 A 69 69 LEU C C 69 177.180 176.803 0.377 1
1 872 . 1 1 1 A 69 69 LEU CA C 69 55.780 53.771 2.009 1
1 873 . 1 1 1 A 69 69 LEU CB C 69 42.736 43.353 -0.617 1
1 877 . 1 1 1 A 69 69 LEU N N 69 125.211 122.551 2.660 1
1 878 . 1 1 1 A 70 70 LEU H H 70 8.058 8.449 -0.391 1
1 879 . 1 1 1 A 70 70 LEU HA H 70 4.364 4.622 -0.258 1
1 889 . 1 1 1 A 70 70 LEU C C 70 176.808 176.862 -0.054 1
1 890 . 1 1 1 A 70 70 LEU CA C 70 55.257 55.361 -0.104 1
1 891 . 1 1 1 A 70 70 LEU CB C 70 42.413 43.830 -1.417 1
1 895 . 1 1 1 A 70 70 LEU N N 70 125.525 118.539 6.986 1
1 1 . 2 1 1 A 2 2 SER HA H 2 4.126 4.764 -0.638 1
1 4 . 2 1 1 A 2 2 SER CA C 2 57.564 57.801 -0.237 1
1 5 . 2 1 1 A 2 2 SER CB C 2 63.953 63.341 0.612 1
1 6 . 2 1 1 A 3 3 GLU HA H 3 4.408 4.630 -0.222 1
1 11 . 2 1 1 A 3 3 GLU C C 3 176.658 177.095 -0.437 1
1 12 . 2 1 1 A 3 3 GLU CA C 3 56.802 55.920 0.882 1
1 13 . 2 1 1 A 3 3 GLU CB C 3 30.674 29.992 0.682 1
1 15 . 2 1 1 A 4 4 SER H H 4 8.650 8.191 0.459 1
1 16 . 2 1 1 A 4 4 SER HA H 4 4.463 4.337 0.126 1
1 19 . 2 1 1 A 4 4 SER C C 4 175.949 176.549 -0.600 1
1 20 . 2 1 1 A 4 4 SER CA C 4 58.557 60.962 -2.405 1
1 21 . 2 1 1 A 4 4 SER CB C 4 63.834 63.044 0.790 1
1 22 . 2 1 1 A 4 4 SER N N 4 118.042 114.589 3.453 1
1 23 . 2 1 1 A 5 5 ILE H H 5 8.404 7.752 0.652 1
1 24 . 2 1 1 A 5 5 ILE HA H 5 3.902 3.584 0.318 1
1 34 . 2 1 1 A 5 5 ILE C C 5 176.608 178.032 -1.424 1
1 35 . 2 1 1 A 5 5 ILE CA C 5 62.662 64.769 -2.107 1
1 36 . 2 1 1 A 5 5 ILE CB C 5 37.622 37.178 0.444 1
1 40 . 2 1 1 A 5 5 ILE N N 5 124.711 122.777 1.934 1
1 41 . 2 1 1 A 6 6 VAL H H 6 7.602 7.732 -0.130 1
1 42 . 2 1 1 A 6 6 VAL HA H 6 3.293 3.418 -0.125 1
1 50 . 2 1 1 A 6 6 VAL C C 6 177.088 178.211 -1.123 1
1 51 . 2 1 1 A 6 6 VAL CA C 6 67.180 66.761 0.419 1
1 52 . 2 1 1 A 6 6 VAL CB C 6 31.517 31.682 -0.165 1
1 55 . 2 1 1 A 6 6 VAL N N 6 119.974 120.451 -0.477 1
1 56 . 2 1 1 A 7 7 THR H H 7 7.515 8.144 -0.629 1
1 57 . 2 1 1 A 7 7 THR HA H 7 3.823 3.857 -0.034 1
1 62 . 2 1 1 A 7 7 THR C C 7 176.978 176.251 0.727 1
1 63 . 2 1 1 A 7 7 THR CA C 7 66.257 67.079 -0.822 1
1 64 . 2 1 1 A 7 7 THR CB C 7 68.410 68.229 0.181 1
1 66 . 2 1 1 A 7 7 THR N N 7 114.177 116.062 -1.885 1
1 67 . 2 1 1 A 8 8 LYS H H 8 7.807 8.052 -0.245 1
1 68 . 2 1 1 A 8 8 LYS HA H 8 4.066 3.980 0.086 1
1 77 . 2 1 1 A 8 8 LYS C C 8 178.733 178.569 0.164 1
1 78 . 2 1 1 A 8 8 LYS CA C 8 59.338 59.722 -0.384 1
1 79 . 2 1 1 A 8 8 LYS CB C 8 32.002 31.982 0.020 1
1 83 . 2 1 1 A 8 8 LYS N N 8 123.387 120.400 2.987 1
1 84 . 2 1 1 A 9 9 ILE H H 9 8.288 8.031 0.257 1
1 85 . 2 1 1 A 9 9 ILE HA H 9 3.421 3.556 -0.135 1
1 95 . 2 1 1 A 9 9 ILE C C 9 177.187 178.300 -1.113 1
1 96 . 2 1 1 A 9 9 ILE CA C 9 65.772 65.539 0.233 1
1 97 . 2 1 1 A 9 9 ILE CB C 9 37.183 37.657 -0.474 1
1 101 . 2 1 1 A 9 9 ILE N N 9 119.543 118.773 0.770 1
1 102 . 2 1 1 A 10 10 ILE H H 10 8.073 8.049 0.024 1
1 103 . 2 1 1 A 10 10 ILE HA H 10 3.305 3.512 -0.207 1
1 113 . 2 1 1 A 10 10 ILE C C 10 177.308 177.933 -0.625 1
1 114 . 2 1 1 A 10 10 ILE CA C 10 66.704 65.381 1.323 1
1 115 . 2 1 1 A 10 10 ILE CB C 10 37.840 38.008 -0.168 1
1 119 . 2 1 1 A 10 10 ILE N N 10 119.219 121.642 -2.423 1
1 120 . 2 1 1 A 11 11 SER H H 11 7.861 7.972 -0.111 1
1 121 . 2 1 1 A 11 11 SER HA H 11 4.250 4.183 0.067 1
1 124 . 2 1 1 A 11 11 SER C C 11 176.918 176.540 0.378 1
1 125 . 2 1 1 A 11 11 SER CA C 11 61.911 62.413 -0.502 1
1 126 . 2 1 1 A 11 11 SER CB C 11 62.998 62.765 0.233 1
1 127 . 2 1 1 A 11 11 SER N N 11 113.959 115.973 -2.014 1
1 128 . 2 1 1 A 12 12 ILE H H 12 8.250 7.999 0.251 1
1 129 . 2 1 1 A 12 12 ILE HA H 12 3.801 3.680 0.121 1
1 139 . 2 1 1 A 12 12 ILE C C 12 178.130 178.078 0.052 1
1 140 . 2 1 1 A 12 12 ILE CA C 12 65.023 64.587 0.436 1
1 141 . 2 1 1 A 12 12 ILE CB C 12 38.195 37.626 0.569 1
1 145 . 2 1 1 A 12 12 ILE N N 12 123.767 121.690 2.077 1
1 146 . 2 1 1 A 13 13 VAL H H 13 8.308 8.013 0.295 1
1 147 . 2 1 1 A 13 13 VAL HA H 13 3.435 3.504 -0.069 1
1 155 . 2 1 1 A 13 13 VAL C C 13 177.283 177.962 -0.679 1
1 156 . 2 1 1 A 13 13 VAL CA C 13 67.693 66.667 1.026 1
1 157 . 2 1 1 A 13 13 VAL CB C 13 31.139 31.162 -0.023 1
1 160 . 2 1 1 A 13 13 VAL N N 13 120.066 119.940 0.126 1
1 161 . 2 1 1 A 14 14 GLN H H 14 8.612 8.101 0.511 1
1 162 . 2 1 1 A 14 14 GLN HA H 14 3.831 4.038 -0.207 1
1 169 . 2 1 1 A 14 14 GLN C C 14 178.256 178.176 0.080 1
1 170 . 2 1 1 A 14 14 GLN CA C 14 59.660 59.510 0.150 1
1 171 . 2 1 1 A 14 14 GLN CB C 14 29.456 28.408 1.048 1
1 174 . 2 1 1 A 14 14 GLN N N 14 118.099 119.903 -1.804 1
1 176 . 2 1 1 A 15 15 GLU H H 15 8.378 8.464 -0.086 1
1 177 . 2 1 1 A 15 15 GLU HA H 15 4.110 3.969 0.141 1
1 182 . 2 1 1 A 15 15 GLU C C 15 179.659 178.900 0.759 1
1 183 . 2 1 1 A 15 15 GLU CA C 15 59.476 59.373 0.103 1
1 184 . 2 1 1 A 15 15 GLU CB C 15 29.725 29.411 0.314 1
1 186 . 2 1 1 A 15 15 GLU N N 15 118.580 119.217 -0.637 1
1 187 . 2 1 1 A 16 16 ARG H H 16 8.439 8.467 -0.028 1
1 188 . 2 1 1 A 16 16 ARG HA H 16 4.157 3.914 0.243 1
1 196 . 2 1 1 A 16 16 ARG C C 16 179.276 178.884 0.392 1
1 197 . 2 1 1 A 16 16 ARG CA C 16 58.141 60.066 -1.925 1
1 198 . 2 1 1 A 16 16 ARG CB C 16 29.434 30.040 -0.606 1
1 201 . 2 1 1 A 16 16 ARG N N 16 118.688 118.318 0.370 1
1 203 . 2 1 1 A 17 17 GLN H H 17 8.861 8.089 0.772 1
1 204 . 2 1 1 A 17 17 GLN HA H 17 4.236 4.080 0.156 1
1 211 . 2 1 1 A 17 17 GLN C C 17 178.736 177.675 1.061 1
1 212 . 2 1 1 A 17 17 GLN CA C 17 59.683 59.052 0.631 1
1 213 . 2 1 1 A 17 17 GLN CB C 17 29.960 28.486 1.474 1
1 216 . 2 1 1 A 17 17 GLN N N 17 120.427 119.164 1.263 1
1 218 . 2 1 1 A 18 18 ASN H H 18 8.017 7.724 0.293 1
1 219 . 2 1 1 A 18 18 ASN HA H 18 4.605 4.619 -0.014 1
1 224 . 2 1 1 A 18 18 ASN C C 18 177.906 178.235 -0.329 1
1 225 . 2 1 1 A 18 18 ASN CA C 18 55.375 55.705 -0.330 1
1 226 . 2 1 1 A 18 18 ASN CB C 18 38.383 37.944 0.439 1
1 228 . 2 1 1 A 18 18 ASN N N 18 117.033 116.436 0.597 1
1 230 . 2 1 1 A 19 19 MET H H 19 7.994 8.378 -0.384 1
1 231 . 2 1 1 A 19 19 MET HA H 19 4.372 4.174 0.198 1
1 236 . 2 1 1 A 19 19 MET C C 19 176.518 178.239 -1.721 1
1 237 . 2 1 1 A 19 19 MET CA C 19 57.623 58.162 -0.539 1
1 238 . 2 1 1 A 19 19 MET CB C 19 33.248 33.249 -0.001 1
1 240 . 2 1 1 A 19 19 MET N N 19 119.320 118.994 0.326 1
1 241 . 2 1 1 A 20 20 ASP H H 20 7.800 8.173 -0.373 1
1 242 . 2 1 1 A 20 20 ASP HA H 20 4.990 4.567 0.423 1
1 245 . 2 1 1 A 20 20 ASP C C 20 176.082 176.407 -0.325 1
1 246 . 2 1 1 A 20 20 ASP CA C 20 53.796 55.862 -2.066 1
1 247 . 2 1 1 A 20 20 ASP CB C 20 40.409 41.196 -0.787 1
1 248 . 2 1 1 A 20 20 ASP N N 20 119.127 119.890 -0.763 1
1 249 . 2 1 1 A 21 21 ASP H H 21 8.136 8.007 0.129 1
1 250 . 2 1 1 A 21 21 ASP HA H 21 4.497 4.766 -0.269 1
1 253 . 2 1 1 A 21 21 ASP C C 21 176.264 176.270 -0.006 1
1 254 . 2 1 1 A 21 21 ASP CA C 21 55.508 56.381 -0.873 1
1 255 . 2 1 1 A 21 21 ASP CB C 21 40.063 40.373 -0.310 1
1 256 . 2 1 1 A 21 21 ASP N N 21 118.276 118.623 -0.347 1
1 257 . 2 1 1 A 22 22 GLY H H 22 8.728 8.595 0.133 1
1 258 . 2 1 1 A 22 22 GLY HA2 H 22 4.189 3.888 0.301 1
1 259 . 2 1 1 A 22 22 GLY HA3 H 22 3.683 3.889 -0.206 1
1 260 . 2 1 1 A 22 22 GLY C C 22 174.304 173.634 0.670 1
1 261 . 2 1 1 A 22 22 GLY CA C 22 45.629 46.173 -0.544 1
1 262 . 2 1 1 A 22 22 GLY N N 22 105.878 106.279 -0.401 1
1 263 . 2 1 1 A 23 23 ALA H H 23 7.473 7.387 0.086 1
1 264 . 2 1 1 A 23 23 ALA HA H 23 4.519 4.738 -0.219 1
1 268 . 2 1 1 A 23 23 ALA C C 23 174.065 174.395 -0.330 1
1 269 . 2 1 1 A 23 23 ALA CA C 23 51.142 50.157 0.985 1
1 270 . 2 1 1 A 23 23 ALA CB C 23 18.283 22.369 -4.086 1
1 271 . 2 1 1 A 23 23 ALA N N 23 125.323 121.758 3.565 1
1 272 . 2 1 1 A 24 24 PRO HA H 24 4.590 4.607 -0.017 1
1 279 . 2 1 1 A 24 24 PRO C C 24 175.253 176.952 -1.699 1
1 280 . 2 1 1 A 24 24 PRO CA C 24 62.186 62.560 -0.374 1
1 281 . 2 1 1 A 24 24 PRO CB C 24 32.931 32.185 0.746 1
1 284 . 2 1 1 A 25 25 VAL H H 25 9.334 8.741 0.593 1
1 285 . 2 1 1 A 25 25 VAL HA H 25 4.378 4.338 0.040 1
1 293 . 2 1 1 A 25 25 VAL C C 25 176.439 176.168 0.271 1
1 294 . 2 1 1 A 25 25 VAL CA C 25 61.482 62.912 -1.430 1
1 295 . 2 1 1 A 25 25 VAL CB C 25 34.781 32.435 2.346 1
1 298 . 2 1 1 A 25 25 VAL N N 25 120.408 122.981 -2.573 1
1 299 . 2 1 1 A 26 26 LYS H H 26 9.300 8.669 0.631 1
1 300 . 2 1 1 A 26 26 LYS HA H 26 4.982 4.782 0.200 1
1 309 . 2 1 1 A 26 26 LYS C C 26 179.008 177.594 1.414 1
1 310 . 2 1 1 A 26 26 LYS CA C 26 56.908 54.524 2.384 1
1 311 . 2 1 1 A 26 26 LYS CB C 26 34.071 34.632 -0.561 1
1 315 . 2 1 1 A 26 26 LYS N N 26 126.177 124.711 1.466 1
1 316 . 2 1 1 A 27 27 THR H H 27 8.618 9.393 -0.775 1
1 317 . 2 1 1 A 27 27 THR HA H 27 3.662 3.945 -0.283 1
1 322 . 2 1 1 A 27 27 THR C C 27 176.442 176.467 -0.025 1
1 323 . 2 1 1 A 27 27 THR CA C 27 67.591 66.151 1.440 1
1 324 . 2 1 1 A 27 27 THR CB C 27 68.868 68.849 0.019 1
1 326 . 2 1 1 A 27 27 THR N N 27 119.020 117.084 1.936 1
1 327 . 2 1 1 A 28 28 ARG H H 28 9.288 8.137 1.151 1
1 328 . 2 1 1 A 28 28 ARG HA H 28 3.879 4.095 -0.216 1
1 335 . 2 1 1 A 28 28 ARG C C 28 176.884 179.056 -2.172 1
1 336 . 2 1 1 A 28 28 ARG CA C 28 59.431 59.478 -0.047 1
1 337 . 2 1 1 A 28 28 ARG CB C 28 29.953 30.021 -0.068 1
1 340 . 2 1 1 A 28 28 ARG N N 28 119.100 121.046 -1.946 1
1 341 . 2 1 1 A 29 29 ASP H H 29 6.907 8.522 -1.615 1
1 342 . 2 1 1 A 29 29 ASP HA H 29 4.550 4.383 0.167 1
1 345 . 2 1 1 A 29 29 ASP C C 29 179.050 178.024 1.026 1
1 346 . 2 1 1 A 29 29 ASP CA C 29 57.262 56.628 0.634 1
1 347 . 2 1 1 A 29 29 ASP CB C 29 40.191 39.365 0.826 1
1 348 . 2 1 1 A 29 29 ASP N N 29 117.490 118.408 -0.918 1
1 349 . 2 1 1 A 30 30 ILE H H 30 7.554 7.642 -0.088 1
1 350 . 2 1 1 A 30 30 ILE HA H 30 3.595 3.641 -0.046 1
1 360 . 2 1 1 A 30 30 ILE C C 30 176.907 177.659 -0.752 1
1 361 . 2 1 1 A 30 30 ILE CA C 30 65.002 65.789 -0.787 1
1 362 . 2 1 1 A 30 30 ILE CB C 30 37.999 38.831 -0.832 1
1 366 . 2 1 1 A 30 30 ILE N N 30 120.978 121.743 -0.765 1
1 367 . 2 1 1 A 31 31 ALA H H 31 8.269 8.314 -0.045 1
1 368 . 2 1 1 A 31 31 ALA HA H 31 3.720 3.965 -0.245 1
1 372 . 2 1 1 A 31 31 ALA C C 31 179.170 178.339 0.831 1
1 373 . 2 1 1 A 31 31 ALA CA C 31 56.354 55.595 0.759 1
1 374 . 2 1 1 A 31 31 ALA CB C 31 17.843 18.272 -0.429 1
1 375 . 2 1 1 A 31 31 ALA N N 31 121.171 121.985 -0.814 1
1 376 . 2 1 1 A 32 32 ASP H H 32 8.293 8.618 -0.325 1
1 377 . 2 1 1 A 32 32 ASP HA H 32 4.422 4.321 0.101 1
1 380 . 2 1 1 A 32 32 ASP C C 32 179.136 178.095 1.041 1
1 381 . 2 1 1 A 32 32 ASP CA C 32 57.109 57.687 -0.578 1
1 382 . 2 1 1 A 32 32 ASP CB C 32 40.523 41.446 -0.923 1
1 383 . 2 1 1 A 32 32 ASP N N 32 116.467 118.324 -1.857 1
1 384 . 2 1 1 A 33 33 ALA H H 33 7.536 7.723 -0.187 1
1 385 . 2 1 1 A 33 33 ALA HA H 33 4.222 4.133 0.089 1
1 389 . 2 1 1 A 33 33 ALA C C 33 179.056 179.702 -0.646 1
1 390 . 2 1 1 A 33 33 ALA CA C 33 54.469 54.428 0.041 1
1 391 . 2 1 1 A 33 33 ALA CB C 33 19.085 18.093 0.992 1
1 392 . 2 1 1 A 33 33 ALA N N 33 120.859 121.290 -0.431 1
1 393 . 2 1 1 A 34 34 ALA H H 34 8.296 7.545 0.751 1
1 394 . 2 1 1 A 34 34 ALA HA H 34 4.101 4.276 -0.175 1
1 398 . 2 1 1 A 34 34 ALA C C 34 176.912 178.103 -1.191 1
1 399 . 2 1 1 A 34 34 ALA CA C 34 52.380 52.365 0.015 1
1 400 . 2 1 1 A 34 34 ALA CB C 34 18.817 19.682 -0.865 1
1 401 . 2 1 1 A 34 34 ALA N N 34 118.203 117.685 0.518 1
1 402 . 2 1 1 A 35 35 GLY H H 35 7.911 8.547 -0.636 1
1 403 . 2 1 1 A 35 35 GLY HA2 H 35 3.968 3.944 0.024 1
1 404 . 2 1 1 A 35 35 GLY HA3 H 35 3.968 3.949 0.019 1
1 405 . 2 1 1 A 35 35 GLY C C 35 174.374 173.924 0.450 1
1 406 . 2 1 1 A 35 35 GLY CA C 35 46.388 46.176 0.212 1
1 407 . 2 1 1 A 35 35 GLY N N 35 107.752 107.803 -0.051 1
1 408 . 2 1 1 A 36 36 LEU H H 36 7.758 7.451 0.307 1
1 409 . 2 1 1 A 36 36 LEU HA H 36 4.887 4.884 0.003 1
1 419 . 2 1 1 A 36 36 LEU C C 36 175.941 175.443 0.498 1
1 420 . 2 1 1 A 36 36 LEU CA C 36 52.443 52.903 -0.460 1
1 421 . 2 1 1 A 36 36 LEU CB C 36 47.885 44.342 3.543 1
1 425 . 2 1 1 A 36 36 LEU N N 36 118.719 121.078 -2.359 1
1 426 . 2 1 1 A 37 37 SER H H 37 8.603 8.797 -0.194 1
1 427 . 2 1 1 A 37 37 SER HA H 37 4.565 4.570 -0.005 1
1 430 . 2 1 1 A 37 37 SER C C 37 175.512 175.832 -0.320 1
1 431 . 2 1 1 A 37 37 SER CA C 37 57.262 58.738 -1.476 1
1 432 . 2 1 1 A 37 37 SER CB C 37 65.155 63.832 1.323 1
1 433 . 2 1 1 A 37 37 SER N N 37 115.095 116.083 -0.988 1
1 434 . 2 1 1 A 38 38 ILE H H 38 8.822 8.842 -0.020 1
1 435 . 2 1 1 A 38 38 ILE HA H 38 3.650 3.801 -0.151 1
1 445 . 2 1 1 A 38 38 ILE C C 38 176.849 177.504 -0.655 1
1 446 . 2 1 1 A 38 38 ILE CA C 38 64.557 65.338 -0.781 1
1 447 . 2 1 1 A 38 38 ILE CB C 38 37.451 37.681 -0.230 1
1 451 . 2 1 1 A 38 38 ILE N N 38 122.026 124.606 -2.580 1
1 452 . 2 1 1 A 39 39 TYR H H 39 7.839 8.515 -0.676 1
1 453 . 2 1 1 A 39 39 TYR HA H 39 4.112 4.032 0.080 1
1 460 . 2 1 1 A 39 39 TYR C C 39 177.703 177.126 0.577 1
1 461 . 2 1 1 A 39 39 TYR CA C 39 60.856 62.044 -1.188 1
1 462 . 2 1 1 A 39 39 TYR CB C 39 38.402 38.605 -0.203 1
1 467 . 2 1 1 A 39 39 TYR N N 39 118.759 120.993 -2.234 1
1 468 . 2 1 1 A 40 40 GLN H H 40 7.687 8.495 -0.808 1
1 469 . 2 1 1 A 40 40 GLN HA H 40 3.865 3.864 0.001 1
1 476 . 2 1 1 A 40 40 GLN C C 40 178.735 179.009 -0.274 1
1 477 . 2 1 1 A 40 40 GLN CA C 40 58.089 59.300 -1.211 1
1 478 . 2 1 1 A 40 40 GLN CB C 40 29.950 28.589 1.361 1
1 481 . 2 1 1 A 40 40 GLN N N 40 116.772 118.051 -1.279 1
1 483 . 2 1 1 A 41 41 VAL H H 41 8.494 8.095 0.399 1
1 484 . 2 1 1 A 41 41 VAL HA H 41 3.835 3.613 0.222 1
1 492 . 2 1 1 A 41 41 VAL C C 41 176.977 177.969 -0.992 1
1 493 . 2 1 1 A 41 41 VAL CA C 41 66.102 67.077 -0.975 1
1 494 . 2 1 1 A 41 41 VAL CB C 41 31.105 31.431 -0.326 1
1 497 . 2 1 1 A 41 41 VAL N N 41 117.192 120.342 -3.150 1
1 498 . 2 1 1 A 42 42 ARG H H 42 8.179 8.088 0.091 1
1 499 . 2 1 1 A 42 42 ARG HA H 42 3.708 3.942 -0.234 1
1 506 . 2 1 1 A 42 42 ARG C C 42 177.570 178.387 -0.817 1
1 507 . 2 1 1 A 42 42 ARG CA C 42 60.349 59.267 1.082 1
1 508 . 2 1 1 A 42 42 ARG CB C 42 30.047 30.049 -0.002 1
1 511 . 2 1 1 A 42 42 ARG N N 42 120.574 120.116 0.458 1
1 512 . 2 1 1 A 43 43 LEU H H 43 6.982 8.081 -1.099 1
1 513 . 2 1 1 A 43 43 LEU HA H 43 3.939 3.826 0.113 1
1 523 . 2 1 1 A 43 43 LEU C C 43 180.397 178.539 1.858 1
1 524 . 2 1 1 A 43 43 LEU CA C 43 58.119 57.689 0.430 1
1 525 . 2 1 1 A 43 43 LEU CB C 43 41.294 41.258 0.036 1
1 529 . 2 1 1 A 43 43 LEU N N 43 117.189 119.640 -2.451 1
1 530 . 2 1 1 A 44 44 TYR H H 44 7.026 7.744 -0.718 1
1 531 . 2 1 1 A 44 44 TYR HA H 44 4.253 4.189 0.064 1
1 538 . 2 1 1 A 44 44 TYR C C 44 178.411 178.115 0.296 1
1 539 . 2 1 1 A 44 44 TYR CA C 44 60.941 60.965 -0.024 1
1 540 . 2 1 1 A 44 44 TYR CB C 44 38.889 38.020 0.869 1
1 545 . 2 1 1 A 44 44 TYR N N 44 117.020 117.924 -0.904 1
1 546 . 2 1 1 A 45 45 LEU H H 45 8.429 8.564 -0.135 1
1 547 . 2 1 1 A 45 45 LEU HA H 45 3.486 3.538 -0.052 1
1 557 . 2 1 1 A 45 45 LEU C C 45 178.648 178.660 -0.012 1
1 558 . 2 1 1 A 45 45 LEU CA C 45 57.915 57.582 0.333 1
1 559 . 2 1 1 A 45 45 LEU CB C 45 39.073 40.545 -1.472 1
1 563 . 2 1 1 A 45 45 LEU N N 45 119.649 120.077 -0.428 1
1 564 . 2 1 1 A 46 46 GLU H H 46 8.309 8.443 -0.134 1
1 565 . 2 1 1 A 46 46 GLU HA H 46 4.286 4.132 0.154 1
1 570 . 2 1 1 A 46 46 GLU C C 46 179.577 179.454 0.123 1
1 571 . 2 1 1 A 46 46 GLU CA C 46 59.570 59.706 -0.136 1
1 572 . 2 1 1 A 46 46 GLU CB C 46 29.034 29.214 -0.180 1
1 574 . 2 1 1 A 46 46 GLU N N 46 117.366 117.678 -0.312 1
1 575 . 2 1 1 A 47 47 GLN H H 47 7.493 7.583 -0.090 1
1 576 . 2 1 1 A 47 47 GLN HA H 47 4.243 4.044 0.199 1
1 583 . 2 1 1 A 47 47 GLN C C 47 178.870 179.231 -0.361 1
1 584 . 2 1 1 A 47 47 GLN CA C 47 59.581 58.757 0.824 1
1 585 . 2 1 1 A 47 47 GLN CB C 47 28.300 28.175 0.125 1
1 588 . 2 1 1 A 47 47 GLN N N 47 119.345 118.714 0.631 1
1 590 . 2 1 1 A 48 48 LEU H H 48 8.160 8.347 -0.187 1
1 591 . 2 1 1 A 48 48 LEU HA H 48 4.211 4.053 0.158 1
1 601 . 2 1 1 A 48 48 LEU C C 48 180.111 179.097 1.014 1
1 602 . 2 1 1 A 48 48 LEU CA C 48 57.179 57.611 -0.432 1
1 603 . 2 1 1 A 48 48 LEU CB C 48 42.067 41.063 1.004 1
1 607 . 2 1 1 A 48 48 LEU N N 48 118.594 120.574 -1.980 1
1 608 . 2 1 1 A 49 49 HIS H H 49 8.864 7.973 0.891 1
1 609 . 2 1 1 A 49 49 HIS HA H 49 5.162 4.562 0.600 1
1 613 . 2 1 1 A 49 49 HIS C C 49 178.801 176.781 2.020 1
1 614 . 2 1 1 A 49 49 HIS CA C 49 58.397 59.457 -1.060 1
1 615 . 2 1 1 A 49 49 HIS CB C 49 29.631 29.948 -0.317 1
1 617 . 2 1 1 A 49 49 HIS N N 49 122.537 118.480 4.057 1
1 618 . 2 1 1 A 50 50 ASP H H 50 8.683 8.208 0.475 1
1 619 . 2 1 1 A 50 50 ASP HA H 50 4.356 4.402 -0.046 1
1 622 . 2 1 1 A 50 50 ASP C C 50 178.474 178.141 0.333 1
1 623 . 2 1 1 A 50 50 ASP CA C 50 57.744 57.480 0.264 1
1 624 . 2 1 1 A 50 50 ASP CB C 50 40.575 41.135 -0.560 1
1 625 . 2 1 1 A 50 50 ASP N N 50 123.169 118.613 4.556 1
1 626 . 2 1 1 A 51 51 VAL H H 51 7.606 7.865 -0.259 1
1 627 . 2 1 1 A 51 51 VAL HA H 51 4.514 4.111 0.403 1
1 635 . 2 1 1 A 51 51 VAL C C 51 176.862 176.506 0.356 1
1 636 . 2 1 1 A 51 51 VAL CA C 51 61.590 62.904 -1.314 1
1 637 . 2 1 1 A 51 51 VAL CB C 51 31.423 32.635 -1.212 1
1 640 . 2 1 1 A 51 51 VAL N N 51 109.266 111.458 -2.192 1
1 641 . 2 1 1 A 52 52 GLY H H 52 7.696 7.901 -0.205 1
1 642 . 2 1 1 A 52 52 GLY HA2 H 52 4.172 3.961 0.211 1
1 643 . 2 1 1 A 52 52 GLY HA3 H 52 3.938 3.985 -0.047 1
1 644 . 2 1 1 A 52 52 GLY C C 52 174.276 174.341 -0.065 1
1 645 . 2 1 1 A 52 52 GLY CA C 52 46.228 46.407 -0.179 1
1 646 . 2 1 1 A 52 52 GLY N N 52 108.681 110.905 -2.224 1
1 647 . 2 1 1 A 53 53 VAL H H 53 8.046 8.164 -0.118 1
1 648 . 2 1 1 A 53 53 VAL HA H 53 4.079 4.219 -0.140 1
1 656 . 2 1 1 A 53 53 VAL C C 53 175.949 175.240 0.709 1
1 657 . 2 1 1 A 53 53 VAL CA C 53 64.063 63.723 0.340 1
1 658 . 2 1 1 A 53 53 VAL CB C 53 33.160 34.418 -1.258 1
1 661 . 2 1 1 A 53 53 VAL N N 53 117.892 116.517 1.375 1
1 662 . 2 1 1 A 54 54 LEU H H 54 6.835 7.651 -0.816 1
1 663 . 2 1 1 A 54 54 LEU HA H 54 5.348 4.708 0.640 1
1 673 . 2 1 1 A 54 54 LEU C C 54 175.713 175.757 -0.044 1
1 674 . 2 1 1 A 54 54 LEU CA C 54 52.194 53.283 -1.089 1
1 675 . 2 1 1 A 54 54 LEU CB C 54 46.733 43.410 3.323 1
1 679 . 2 1 1 A 54 54 LEU N N 54 114.848 118.171 -3.323 1
1 680 . 2 1 1 A 55 55 GLU H H 55 9.549 9.038 0.511 1
1 681 . 2 1 1 A 55 55 GLU HA H 55 4.826 4.892 -0.066 1
1 686 . 2 1 1 A 55 55 GLU C C 55 174.661 175.901 -1.240 1
1 687 . 2 1 1 A 55 55 GLU CA C 55 54.637 54.718 -0.081 1
1 688 . 2 1 1 A 55 55 GLU CB C 55 32.891 33.093 -0.202 1
1 690 . 2 1 1 A 55 55 GLU N N 55 121.431 123.943 -2.512 1
1 691 . 2 1 1 A 56 56 LYS H H 56 8.513 8.784 -0.271 1
1 692 . 2 1 1 A 56 56 LYS HA H 56 4.151 4.941 -0.790 1
1 701 . 2 1 1 A 56 56 LYS C C 56 176.270 175.287 0.983 1
1 702 . 2 1 1 A 56 56 LYS CA C 56 54.890 55.294 -0.404 1
1 703 . 2 1 1 A 56 56 LYS CB C 56 33.162 34.007 -0.845 1
1 707 . 2 1 1 A 56 56 LYS N N 56 126.539 120.915 5.624 1
1 708 . 2 1 1 A 57 57 VAL H H 57 8.279 8.854 -0.575 1
1 709 . 2 1 1 A 57 57 VAL HA H 57 3.820 5.025 -1.205 1
1 717 . 2 1 1 A 57 57 VAL C C 57 175.108 174.812 0.296 1
1 718 . 2 1 1 A 57 57 VAL CA C 57 62.834 60.622 2.212 1
1 719 . 2 1 1 A 57 57 VAL CB C 57 32.549 33.870 -1.321 1
1 722 . 2 1 1 A 57 57 VAL N N 57 126.540 123.367 3.173 1
1 723 . 2 1 1 A 58 58 ASN H H 58 8.383 8.528 -0.145 1
1 724 . 2 1 1 A 58 58 ASN HA H 58 4.612 5.030 -0.418 1
1 729 . 2 1 1 A 58 58 ASN C C 58 174.772 174.997 -0.225 1
1 730 . 2 1 1 A 58 58 ASN CA C 58 52.575 52.250 0.325 1
1 731 . 2 1 1 A 58 58 ASN CB C 58 38.502 40.066 -1.564 1
1 733 . 2 1 1 A 58 58 ASN N N 58 121.767 123.085 -1.318 1
1 735 . 2 1 1 A 59 59 ALA H H 59 8.165 8.555 -0.390 1
1 736 . 2 1 1 A 59 59 ALA HA H 59 4.251 4.317 -0.066 1
1 740 . 2 1 1 A 59 59 ALA C C 59 177.478 177.287 0.191 1
1 741 . 2 1 1 A 59 59 ALA CA C 59 52.490 52.634 -0.144 1
1 742 . 2 1 1 A 59 59 ALA CB C 59 19.724 20.091 -0.367 1
1 743 . 2 1 1 A 59 59 ALA N N 59 125.082 120.374 4.708 1
1 744 . 2 1 1 A 60 60 GLY H H 60 8.291 7.672 0.619 1
1 745 . 2 1 1 A 60 60 GLY HA2 H 60 4.165 4.028 0.137 1
1 746 . 2 1 1 A 60 60 GLY HA3 H 60 3.853 4.036 -0.183 1
1 747 . 2 1 1 A 60 60 GLY C C 60 174.171 174.045 0.126 1
1 748 . 2 1 1 A 60 60 GLY CA C 60 44.994 45.721 -0.727 1
1 749 . 2 1 1 A 60 60 GLY N N 60 108.518 105.764 2.754 1
1 750 . 2 1 1 A 61 61 LYS H H 61 8.189 7.946 0.243 1
1 751 . 2 1 1 A 61 61 LYS HA H 61 4.320 4.411 -0.091 1
1 760 . 2 1 1 A 61 61 LYS C C 61 177.712 176.976 0.736 1
1 761 . 2 1 1 A 61 61 LYS CA C 61 56.832 56.129 0.703 1
1 762 . 2 1 1 A 61 61 LYS CB C 61 32.641 33.437 -0.796 1
1 766 . 2 1 1 A 61 61 LYS N N 61 120.532 123.869 -3.337 1
1 767 . 2 1 1 A 62 62 GLY H H 62 8.767 9.029 -0.262 1
1 768 . 2 1 1 A 62 62 GLY HA2 H 62 4.021 3.880 0.141 1
1 769 . 2 1 1 A 62 62 GLY HA3 H 62 3.849 3.882 -0.033 1
1 770 . 2 1 1 A 62 62 GLY C C 62 173.782 173.633 0.149 1
1 771 . 2 1 1 A 62 62 GLY CA C 62 45.844 46.675 -0.831 1
1 772 . 2 1 1 A 62 62 GLY N N 62 111.547 114.297 -2.750 1
1 773 . 2 1 1 A 63 63 VAL H H 63 7.379 7.496 -0.117 1
1 774 . 2 1 1 A 63 63 VAL HA H 63 4.591 4.816 -0.225 1
1 782 . 2 1 1 A 63 63 VAL C C 63 174.262 173.161 1.101 1
1 783 . 2 1 1 A 63 63 VAL CA C 63 59.292 58.065 1.227 1
1 784 . 2 1 1 A 63 63 VAL CB C 63 32.726 34.083 -1.357 1
1 787 . 2 1 1 A 63 63 VAL N N 63 117.546 113.860 3.686 1
1 788 . 2 1 1 A 64 64 PRO HA H 64 4.458 4.863 -0.405 1
1 795 . 2 1 1 A 64 64 PRO C C 64 177.166 176.638 0.528 1
1 796 . 2 1 1 A 64 64 PRO CA C 64 63.661 62.333 1.328 1
1 797 . 2 1 1 A 64 64 PRO CB C 64 32.321 31.690 0.631 1
1 800 . 2 1 1 A 65 65 GLY H H 65 8.463 8.618 -0.155 1
1 801 . 2 1 1 A 65 65 GLY HA2 H 65 3.882 3.694 0.188 1
1 802 . 2 1 1 A 65 65 GLY HA3 H 65 3.602 3.760 -0.158 1
1 803 . 2 1 1 A 65 65 GLY C C 65 172.406 173.018 -0.612 1
1 804 . 2 1 1 A 65 65 GLY CA C 65 45.933 45.677 0.256 1
1 805 . 2 1 1 A 65 65 GLY N N 65 109.819 109.599 0.220 1
1 806 . 2 1 1 A 66 66 LEU H H 66 7.534 8.479 -0.945 1
1 807 . 2 1 1 A 66 66 LEU HA H 66 4.940 4.463 0.477 1
1 817 . 2 1 1 A 66 66 LEU C C 66 176.237 176.469 -0.232 1
1 818 . 2 1 1 A 66 66 LEU CA C 66 53.687 54.198 -0.511 1
1 819 . 2 1 1 A 66 66 LEU CB C 66 46.108 42.900 3.208 1
1 823 . 2 1 1 A 66 66 LEU N N 66 122.249 127.135 -4.886 1
1 824 . 2 1 1 A 67 67 TRP H H 67 8.916 9.430 -0.514 1
1 825 . 2 1 1 A 67 67 TRP HA H 67 5.526 5.442 0.084 1
1 834 . 2 1 1 A 67 67 TRP C C 67 175.670 175.346 0.324 1
1 835 . 2 1 1 A 67 67 TRP CA C 67 56.241 56.034 0.207 1
1 836 . 2 1 1 A 67 67 TRP CB C 67 33.314 31.894 1.420 1
1 842 . 2 1 1 A 67 67 TRP N N 67 121.160 123.569 -2.409 1
1 844 . 2 1 1 A 68 68 ARG H H 68 8.772 8.906 -0.134 1
1 845 . 2 1 1 A 68 68 ARG HA H 68 4.832 4.806 0.026 1
1 853 . 2 1 1 A 68 68 ARG C C 68 174.720 175.057 -0.337 1
1 854 . 2 1 1 A 68 68 ARG CA C 68 54.690 55.304 -0.614 1
1 855 . 2 1 1 A 68 68 ARG CB C 68 35.176 33.418 1.758 1
1 858 . 2 1 1 A 68 68 ARG N N 68 117.471 123.547 -6.076 1
1 860 . 2 1 1 A 69 69 LEU H H 69 9.355 8.436 0.919 1
1 861 . 2 1 1 A 69 69 LEU HA H 69 4.557 4.593 -0.036 1
1 871 . 2 1 1 A 69 69 LEU C C 69 177.180 176.247 0.933 1
1 872 . 2 1 1 A 69 69 LEU CA C 69 55.780 54.092 1.688 1
1 873 . 2 1 1 A 69 69 LEU CB C 69 42.736 43.900 -1.164 1
1 877 . 2 1 1 A 69 69 LEU N N 69 125.211 122.215 2.996 1
1 878 . 2 1 1 A 70 70 LEU H H 70 8.058 8.339 -0.281 1
1 879 . 2 1 1 A 70 70 LEU HA H 70 4.364 4.180 0.184 1
1 889 . 2 1 1 A 70 70 LEU C C 70 176.808 175.900 0.908 1
1 890 . 2 1 1 A 70 70 LEU CA C 70 55.257 55.026 0.231 1
1 891 . 2 1 1 A 70 70 LEU CB C 70 42.413 40.502 1.911 1
1 895 . 2 1 1 A 70 70 LEU N N 70 125.525 120.973 4.552 1
1 1 . 3 1 1 A 2 2 SER HA H 2 4.126 4.382 -0.256 1
1 4 . 3 1 1 A 2 2 SER CA C 2 57.564 58.609 -1.045 1
1 5 . 3 1 1 A 2 2 SER CB C 2 63.953 61.601 2.352 1
1 6 . 3 1 1 A 3 3 GLU HA H 3 4.408 4.688 -0.280 1
1 11 . 3 1 1 A 3 3 GLU C C 3 176.658 176.735 -0.077 1
1 12 . 3 1 1 A 3 3 GLU CA C 3 56.802 55.174 1.628 1
1 13 . 3 1 1 A 3 3 GLU CB C 3 30.674 31.927 -1.253 1
1 15 . 3 1 1 A 4 4 SER H H 4 8.650 8.987 -0.337 1
1 16 . 3 1 1 A 4 4 SER HA H 4 4.463 4.082 0.381 1
1 19 . 3 1 1 A 4 4 SER C C 4 175.949 176.214 -0.265 1
1 20 . 3 1 1 A 4 4 SER CA C 4 58.557 61.321 -2.764 1
1 21 . 3 1 1 A 4 4 SER CB C 4 63.834 62.746 1.088 1
1 22 . 3 1 1 A 4 4 SER N N 4 118.042 120.858 -2.816 1
1 23 . 3 1 1 A 5 5 ILE H H 5 8.404 7.898 0.506 1
1 24 . 3 1 1 A 5 5 ILE HA H 5 3.902 3.833 0.069 1
1 34 . 3 1 1 A 5 5 ILE C C 5 176.608 177.900 -1.292 1
1 35 . 3 1 1 A 5 5 ILE CA C 5 62.662 63.445 -0.783 1
1 36 . 3 1 1 A 5 5 ILE CB C 5 37.622 37.626 -0.004 1
1 40 . 3 1 1 A 5 5 ILE N N 5 124.711 121.987 2.724 1
1 41 . 3 1 1 A 6 6 VAL H H 6 7.602 8.012 -0.410 1
1 42 . 3 1 1 A 6 6 VAL HA H 6 3.293 3.446 -0.153 1
1 50 . 3 1 1 A 6 6 VAL C C 6 177.088 178.019 -0.931 1
1 51 . 3 1 1 A 6 6 VAL CA C 6 67.180 66.289 0.891 1
1 52 . 3 1 1 A 6 6 VAL CB C 6 31.517 31.328 0.189 1
1 55 . 3 1 1 A 6 6 VAL N N 6 119.974 120.761 -0.787 1
1 56 . 3 1 1 A 7 7 THR H H 7 7.515 7.958 -0.443 1
1 57 . 3 1 1 A 7 7 THR HA H 7 3.823 3.783 0.040 1
1 62 . 3 1 1 A 7 7 THR C C 7 176.978 176.197 0.781 1
1 63 . 3 1 1 A 7 7 THR CA C 7 66.257 66.963 -0.706 1
1 64 . 3 1 1 A 7 7 THR CB C 7 68.410 68.632 -0.222 1
1 66 . 3 1 1 A 7 7 THR N N 7 114.177 116.997 -2.820 1
1 67 . 3 1 1 A 8 8 LYS H H 8 7.807 7.909 -0.102 1
1 68 . 3 1 1 A 8 8 LYS HA H 8 4.066 4.005 0.061 1
1 77 . 3 1 1 A 8 8 LYS C C 8 178.733 178.580 0.153 1
1 78 . 3 1 1 A 8 8 LYS CA C 8 59.338 59.255 0.083 1
1 79 . 3 1 1 A 8 8 LYS CB C 8 32.002 32.214 -0.212 1
1 83 . 3 1 1 A 8 8 LYS N N 8 123.387 121.270 2.117 1
1 84 . 3 1 1 A 9 9 ILE H H 9 8.288 8.103 0.185 1
1 85 . 3 1 1 A 9 9 ILE HA H 9 3.421 3.585 -0.164 1
1 95 . 3 1 1 A 9 9 ILE C C 9 177.187 178.505 -1.318 1
1 96 . 3 1 1 A 9 9 ILE CA C 9 65.772 65.907 -0.135 1
1 97 . 3 1 1 A 9 9 ILE CB C 9 37.183 37.928 -0.745 1
1 101 . 3 1 1 A 9 9 ILE N N 9 119.543 119.487 0.056 1
1 102 . 3 1 1 A 10 10 ILE H H 10 8.073 8.139 -0.066 1
1 103 . 3 1 1 A 10 10 ILE HA H 10 3.305 3.513 -0.208 1
1 113 . 3 1 1 A 10 10 ILE C C 10 177.308 178.288 -0.980 1
1 114 . 3 1 1 A 10 10 ILE CA C 10 66.704 65.324 1.380 1
1 115 . 3 1 1 A 10 10 ILE CB C 10 37.840 37.968 -0.128 1
1 119 . 3 1 1 A 10 10 ILE N N 10 119.219 120.381 -1.162 1
1 120 . 3 1 1 A 11 11 SER H H 11 7.861 7.746 0.115 1
1 121 . 3 1 1 A 11 11 SER HA H 11 4.250 4.140 0.110 1
1 124 . 3 1 1 A 11 11 SER C C 11 176.918 177.541 -0.623 1
1 125 . 3 1 1 A 11 11 SER CA C 11 61.911 61.541 0.370 1
1 126 . 3 1 1 A 11 11 SER CB C 11 62.998 62.862 0.136 1
1 127 . 3 1 1 A 11 11 SER N N 11 113.959 115.504 -1.545 1
1 128 . 3 1 1 A 12 12 ILE H H 12 8.250 8.147 0.103 1
1 129 . 3 1 1 A 12 12 ILE HA H 12 3.801 3.658 0.143 1
1 139 . 3 1 1 A 12 12 ILE C C 12 178.130 178.117 0.013 1
1 140 . 3 1 1 A 12 12 ILE CA C 12 65.023 64.746 0.277 1
1 141 . 3 1 1 A 12 12 ILE CB C 12 38.195 37.896 0.299 1
1 145 . 3 1 1 A 12 12 ILE N N 12 123.767 122.346 1.421 1
1 146 . 3 1 1 A 13 13 VAL H H 13 8.308 8.107 0.201 1
1 147 . 3 1 1 A 13 13 VAL HA H 13 3.435 3.491 -0.056 1
1 155 . 3 1 1 A 13 13 VAL C C 13 177.283 177.919 -0.636 1
1 156 . 3 1 1 A 13 13 VAL CA C 13 67.693 66.856 0.837 1
1 157 . 3 1 1 A 13 13 VAL CB C 13 31.139 31.249 -0.110 1
1 160 . 3 1 1 A 13 13 VAL N N 13 120.066 119.887 0.179 1
1 161 . 3 1 1 A 14 14 GLN H H 14 8.612 8.092 0.520 1
1 162 . 3 1 1 A 14 14 GLN HA H 14 3.831 4.010 -0.179 1
1 169 . 3 1 1 A 14 14 GLN C C 14 178.256 178.225 0.031 1
1 170 . 3 1 1 A 14 14 GLN CA C 14 59.660 59.359 0.301 1
1 171 . 3 1 1 A 14 14 GLN CB C 14 29.456 28.125 1.331 1
1 174 . 3 1 1 A 14 14 GLN N N 14 118.099 119.876 -1.777 1
1 176 . 3 1 1 A 15 15 GLU H H 15 8.378 8.497 -0.119 1
1 177 . 3 1 1 A 15 15 GLU HA H 15 4.110 4.044 0.066 1
1 182 . 3 1 1 A 15 15 GLU C C 15 179.659 179.218 0.441 1
1 183 . 3 1 1 A 15 15 GLU CA C 15 59.476 59.545 -0.069 1
1 184 . 3 1 1 A 15 15 GLU CB C 15 29.725 29.058 0.667 1
1 186 . 3 1 1 A 15 15 GLU N N 15 118.580 119.224 -0.644 1
1 187 . 3 1 1 A 16 16 ARG H H 16 8.439 8.314 0.125 1
1 188 . 3 1 1 A 16 16 ARG HA H 16 4.157 4.119 0.038 1
1 196 . 3 1 1 A 16 16 ARG C C 16 179.276 178.892 0.384 1
1 197 . 3 1 1 A 16 16 ARG CA C 16 58.141 59.634 -1.493 1
1 198 . 3 1 1 A 16 16 ARG CB C 16 29.434 29.856 -0.422 1
1 201 . 3 1 1 A 16 16 ARG N N 16 118.688 118.944 -0.256 1
1 203 . 3 1 1 A 17 17 GLN H H 17 8.861 8.240 0.621 1
1 204 . 3 1 1 A 17 17 GLN HA H 17 4.236 4.138 0.098 1
1 211 . 3 1 1 A 17 17 GLN C C 17 178.736 177.445 1.291 1
1 212 . 3 1 1 A 17 17 GLN CA C 17 59.683 58.314 1.369 1
1 213 . 3 1 1 A 17 17 GLN CB C 17 29.960 28.386 1.574 1
1 216 . 3 1 1 A 17 17 GLN N N 17 120.427 118.814 1.613 1
1 218 . 3 1 1 A 18 18 ASN H H 18 8.017 8.005 0.012 1
1 219 . 3 1 1 A 18 18 ASN HA H 18 4.605 4.531 0.074 1
1 224 . 3 1 1 A 18 18 ASN C C 18 177.906 176.777 1.129 1
1 225 . 3 1 1 A 18 18 ASN CA C 18 55.375 55.284 0.091 1
1 226 . 3 1 1 A 18 18 ASN CB C 18 38.383 38.539 -0.156 1
1 228 . 3 1 1 A 18 18 ASN N N 18 117.033 117.007 0.026 1
1 230 . 3 1 1 A 19 19 MET H H 19 7.994 7.687 0.307 1
1 231 . 3 1 1 A 19 19 MET HA H 19 4.372 4.343 0.029 1
1 236 . 3 1 1 A 19 19 MET C C 19 176.518 177.881 -1.363 1
1 237 . 3 1 1 A 19 19 MET CA C 19 57.623 58.207 -0.584 1
1 238 . 3 1 1 A 19 19 MET CB C 19 33.248 32.954 0.294 1
1 240 . 3 1 1 A 19 19 MET N N 19 119.320 116.980 2.340 1
1 241 . 3 1 1 A 20 20 ASP H H 20 7.800 8.163 -0.363 1
1 242 . 3 1 1 A 20 20 ASP HA H 20 4.990 4.566 0.424 1
1 245 . 3 1 1 A 20 20 ASP C C 20 176.082 176.451 -0.369 1
1 246 . 3 1 1 A 20 20 ASP CA C 20 53.796 55.589 -1.793 1
1 247 . 3 1 1 A 20 20 ASP CB C 20 40.409 41.710 -1.301 1
1 248 . 3 1 1 A 20 20 ASP N N 20 119.127 121.132 -2.005 1
1 249 . 3 1 1 A 21 21 ASP H H 21 8.136 7.901 0.235 1
1 250 . 3 1 1 A 21 21 ASP HA H 21 4.497 4.598 -0.101 1
1 253 . 3 1 1 A 21 21 ASP C C 21 176.264 177.647 -1.383 1
1 254 . 3 1 1 A 21 21 ASP CA C 21 55.508 56.528 -1.020 1
1 255 . 3 1 1 A 21 21 ASP CB C 21 40.063 39.296 0.767 1
1 256 . 3 1 1 A 21 21 ASP N N 21 118.276 116.808 1.468 1
1 257 . 3 1 1 A 22 22 GLY H H 22 8.728 8.753 -0.025 1
1 258 . 3 1 1 A 22 22 GLY HA2 H 22 4.189 3.946 0.243 1
1 259 . 3 1 1 A 22 22 GLY HA3 H 22 3.683 3.947 -0.264 1
1 260 . 3 1 1 A 22 22 GLY C C 22 174.304 174.303 0.001 1
1 261 . 3 1 1 A 22 22 GLY CA C 22 45.629 46.389 -0.760 1
1 262 . 3 1 1 A 22 22 GLY N N 22 105.878 107.262 -1.384 1
1 263 . 3 1 1 A 23 23 ALA H H 23 7.473 7.647 -0.174 1
1 264 . 3 1 1 A 23 23 ALA HA H 23 4.519 4.589 -0.070 1
1 268 . 3 1 1 A 23 23 ALA C C 23 174.065 175.495 -1.430 1
1 269 . 3 1 1 A 23 23 ALA CA C 23 51.142 49.470 1.672 1
1 270 . 3 1 1 A 23 23 ALA CB C 23 18.283 20.740 -2.457 1
1 271 . 3 1 1 A 23 23 ALA N N 23 125.323 123.059 2.264 1
1 272 . 3 1 1 A 24 24 PRO HA H 24 4.590 4.624 -0.034 1
1 279 . 3 1 1 A 24 24 PRO C C 24 175.253 176.393 -1.140 1
1 280 . 3 1 1 A 24 24 PRO CA C 24 62.186 62.394 -0.208 1
1 281 . 3 1 1 A 24 24 PRO CB C 24 32.931 32.570 0.361 1
1 284 . 3 1 1 A 25 25 VAL H H 25 9.334 8.708 0.626 1
1 285 . 3 1 1 A 25 25 VAL HA H 25 4.378 4.300 0.078 1
1 293 . 3 1 1 A 25 25 VAL C C 25 176.439 176.218 0.221 1
1 294 . 3 1 1 A 25 25 VAL CA C 25 61.482 62.731 -1.249 1
1 295 . 3 1 1 A 25 25 VAL CB C 25 34.781 32.525 2.256 1
1 298 . 3 1 1 A 25 25 VAL N N 25 120.408 121.107 -0.699 1
1 299 . 3 1 1 A 26 26 LYS H H 26 9.300 8.495 0.805 1
1 300 . 3 1 1 A 26 26 LYS HA H 26 4.982 4.637 0.345 1
1 309 . 3 1 1 A 26 26 LYS C C 26 179.008 178.110 0.898 1
1 310 . 3 1 1 A 26 26 LYS CA C 26 56.908 54.722 2.186 1
1 311 . 3 1 1 A 26 26 LYS CB C 26 34.071 34.375 -0.304 1
1 315 . 3 1 1 A 26 26 LYS N N 26 126.177 124.895 1.282 1
1 316 . 3 1 1 A 27 27 THR H H 27 8.618 8.980 -0.362 1
1 317 . 3 1 1 A 27 27 THR HA H 27 3.662 4.050 -0.388 1
1 322 . 3 1 1 A 27 27 THR C C 27 176.442 176.584 -0.142 1
1 323 . 3 1 1 A 27 27 THR CA C 27 67.591 66.247 1.344 1
1 324 . 3 1 1 A 27 27 THR CB C 27 68.868 68.901 -0.033 1
1 326 . 3 1 1 A 27 27 THR N N 27 119.020 117.305 1.715 1
1 327 . 3 1 1 A 28 28 ARG H H 28 9.288 8.189 1.099 1
1 328 . 3 1 1 A 28 28 ARG HA H 28 3.879 4.019 -0.140 1
1 335 . 3 1 1 A 28 28 ARG C C 28 176.884 179.100 -2.216 1
1 336 . 3 1 1 A 28 28 ARG CA C 28 59.431 59.800 -0.369 1
1 337 . 3 1 1 A 28 28 ARG CB C 28 29.953 29.780 0.173 1
1 340 . 3 1 1 A 28 28 ARG N N 28 119.100 121.601 -2.501 1
1 341 . 3 1 1 A 29 29 ASP H H 29 6.907 7.892 -0.985 1
1 342 . 3 1 1 A 29 29 ASP HA H 29 4.550 4.394 0.156 1
1 345 . 3 1 1 A 29 29 ASP C C 29 179.050 178.812 0.238 1
1 346 . 3 1 1 A 29 29 ASP CA C 29 57.262 57.248 0.014 1
1 347 . 3 1 1 A 29 29 ASP CB C 29 40.191 40.576 -0.385 1
1 348 . 3 1 1 A 29 29 ASP N N 29 117.490 119.395 -1.905 1
1 349 . 3 1 1 A 30 30 ILE H H 30 7.554 7.896 -0.342 1
1 350 . 3 1 1 A 30 30 ILE HA H 30 3.595 3.631 -0.036 1
1 360 . 3 1 1 A 30 30 ILE C C 30 176.907 177.935 -1.028 1
1 361 . 3 1 1 A 30 30 ILE CA C 30 65.002 65.993 -0.991 1
1 362 . 3 1 1 A 30 30 ILE CB C 30 37.999 38.931 -0.932 1
1 366 . 3 1 1 A 30 30 ILE N N 30 120.978 119.822 1.156 1
1 367 . 3 1 1 A 31 31 ALA H H 31 8.269 8.044 0.225 1
1 368 . 3 1 1 A 31 31 ALA HA H 31 3.720 4.084 -0.364 1
1 372 . 3 1 1 A 31 31 ALA C C 31 179.170 179.975 -0.805 1
1 373 . 3 1 1 A 31 31 ALA CA C 31 56.354 55.787 0.567 1
1 374 . 3 1 1 A 31 31 ALA CB C 31 17.843 18.346 -0.503 1
1 375 . 3 1 1 A 31 31 ALA N N 31 121.171 122.561 -1.390 1
1 376 . 3 1 1 A 32 32 ASP H H 32 8.293 8.598 -0.305 1
1 377 . 3 1 1 A 32 32 ASP HA H 32 4.422 4.389 0.033 1
1 380 . 3 1 1 A 32 32 ASP C C 32 179.136 178.526 0.610 1
1 381 . 3 1 1 A 32 32 ASP CA C 32 57.109 56.792 0.317 1
1 382 . 3 1 1 A 32 32 ASP CB C 32 40.523 40.258 0.265 1
1 383 . 3 1 1 A 32 32 ASP N N 32 116.467 118.944 -2.477 1
1 384 . 3 1 1 A 33 33 ALA H H 33 7.536 7.817 -0.281 1
1 385 . 3 1 1 A 33 33 ALA HA H 33 4.222 4.301 -0.079 1
1 389 . 3 1 1 A 33 33 ALA C C 33 179.056 179.967 -0.911 1
1 390 . 3 1 1 A 33 33 ALA CA C 33 54.469 54.550 -0.081 1
1 391 . 3 1 1 A 33 33 ALA CB C 33 19.085 18.202 0.883 1
1 392 . 3 1 1 A 33 33 ALA N N 33 120.859 122.356 -1.497 1
1 393 . 3 1 1 A 34 34 ALA H H 34 8.296 7.725 0.571 1
1 394 . 3 1 1 A 34 34 ALA HA H 34 4.101 4.337 -0.236 1
1 398 . 3 1 1 A 34 34 ALA C C 34 176.912 177.845 -0.933 1
1 399 . 3 1 1 A 34 34 ALA CA C 34 52.380 52.296 0.084 1
1 400 . 3 1 1 A 34 34 ALA CB C 34 18.817 19.816 -0.999 1
1 401 . 3 1 1 A 34 34 ALA N N 34 118.203 117.320 0.883 1
1 402 . 3 1 1 A 35 35 GLY H H 35 7.911 8.434 -0.523 1
1 403 . 3 1 1 A 35 35 GLY HA2 H 35 3.968 3.921 0.047 1
1 404 . 3 1 1 A 35 35 GLY HA3 H 35 3.968 3.923 0.045 1
1 405 . 3 1 1 A 35 35 GLY C C 35 174.374 174.267 0.107 1
1 406 . 3 1 1 A 35 35 GLY CA C 35 46.388 45.983 0.405 1
1 407 . 3 1 1 A 35 35 GLY N N 35 107.752 107.700 0.052 1
1 408 . 3 1 1 A 36 36 LEU H H 36 7.758 7.823 -0.065 1
1 409 . 3 1 1 A 36 36 LEU HA H 36 4.887 4.787 0.100 1
1 419 . 3 1 1 A 36 36 LEU C C 36 175.941 175.718 0.223 1
1 420 . 3 1 1 A 36 36 LEU CA C 36 52.443 53.536 -1.093 1
1 421 . 3 1 1 A 36 36 LEU CB C 36 47.885 43.073 4.812 1
1 425 . 3 1 1 A 36 36 LEU N N 36 118.719 121.671 -2.952 1
1 426 . 3 1 1 A 37 37 SER H H 37 8.603 8.582 0.021 1
1 427 . 3 1 1 A 37 37 SER HA H 37 4.565 4.817 -0.252 1
1 430 . 3 1 1 A 37 37 SER C C 37 175.512 175.521 -0.009 1
1 431 . 3 1 1 A 37 37 SER CA C 37 57.262 56.330 0.932 1
1 432 . 3 1 1 A 37 37 SER CB C 37 65.155 65.025 0.130 1
1 433 . 3 1 1 A 37 37 SER N N 37 115.095 115.690 -0.595 1
1 434 . 3 1 1 A 38 38 ILE H H 38 8.822 8.855 -0.033 1
1 435 . 3 1 1 A 38 38 ILE HA H 38 3.650 3.808 -0.158 1
1 445 . 3 1 1 A 38 38 ILE C C 38 176.849 177.480 -0.631 1
1 446 . 3 1 1 A 38 38 ILE CA C 38 64.557 64.927 -0.370 1
1 447 . 3 1 1 A 38 38 ILE CB C 38 37.451 37.904 -0.453 1
1 451 . 3 1 1 A 38 38 ILE N N 38 122.026 128.090 -6.064 1
1 452 . 3 1 1 A 39 39 TYR H H 39 7.839 8.490 -0.651 1
1 453 . 3 1 1 A 39 39 TYR HA H 39 4.112 4.016 0.096 1
1 460 . 3 1 1 A 39 39 TYR C C 39 177.703 177.460 0.243 1
1 461 . 3 1 1 A 39 39 TYR CA C 39 60.856 62.171 -1.315 1
1 462 . 3 1 1 A 39 39 TYR CB C 39 38.402 38.563 -0.161 1
1 467 . 3 1 1 A 39 39 TYR N N 39 118.759 120.456 -1.697 1
1 468 . 3 1 1 A 40 40 GLN H H 40 7.687 8.218 -0.531 1
1 469 . 3 1 1 A 40 40 GLN HA H 40 3.865 3.576 0.289 1
1 476 . 3 1 1 A 40 40 GLN C C 40 178.735 178.229 0.506 1
1 477 . 3 1 1 A 40 40 GLN CA C 40 58.089 58.095 -0.006 1
1 478 . 3 1 1 A 40 40 GLN CB C 40 29.950 28.404 1.546 1
1 481 . 3 1 1 A 40 40 GLN N N 40 116.772 118.467 -1.695 1
1 483 . 3 1 1 A 41 41 VAL H H 41 8.494 8.227 0.267 1
1 484 . 3 1 1 A 41 41 VAL HA H 41 3.835 3.568 0.267 1
1 492 . 3 1 1 A 41 41 VAL C C 41 176.977 177.776 -0.799 1
1 493 . 3 1 1 A 41 41 VAL CA C 41 66.102 67.001 -0.899 1
1 494 . 3 1 1 A 41 41 VAL CB C 41 31.105 31.595 -0.490 1
1 497 . 3 1 1 A 41 41 VAL N N 41 117.192 120.245 -3.053 1
1 498 . 3 1 1 A 42 42 ARG H H 42 8.179 8.282 -0.103 1
1 499 . 3 1 1 A 42 42 ARG HA H 42 3.708 3.986 -0.278 1
1 506 . 3 1 1 A 42 42 ARG C C 42 177.570 178.458 -0.888 1
1 507 . 3 1 1 A 42 42 ARG CA C 42 60.349 58.522 1.827 1
1 508 . 3 1 1 A 42 42 ARG CB C 42 30.047 30.381 -0.334 1
1 511 . 3 1 1 A 42 42 ARG N N 42 120.574 120.442 0.132 1
1 512 . 3 1 1 A 43 43 LEU H H 43 6.982 7.445 -0.463 1
1 513 . 3 1 1 A 43 43 LEU HA H 43 3.939 3.812 0.127 1
1 523 . 3 1 1 A 43 43 LEU C C 43 180.397 178.506 1.891 1
1 524 . 3 1 1 A 43 43 LEU CA C 43 58.119 57.818 0.301 1
1 525 . 3 1 1 A 43 43 LEU CB C 43 41.294 41.468 -0.174 1
1 529 . 3 1 1 A 43 43 LEU N N 43 117.189 120.723 -3.534 1
1 530 . 3 1 1 A 44 44 TYR H H 44 7.026 7.468 -0.442 1
1 531 . 3 1 1 A 44 44 TYR HA H 44 4.253 4.240 0.013 1
1 538 . 3 1 1 A 44 44 TYR C C 44 178.411 178.205 0.206 1
1 539 . 3 1 1 A 44 44 TYR CA C 44 60.941 60.576 0.365 1
1 540 . 3 1 1 A 44 44 TYR CB C 44 38.889 38.238 0.651 1
1 545 . 3 1 1 A 44 44 TYR N N 44 117.020 117.939 -0.919 1
1 546 . 3 1 1 A 45 45 LEU H H 45 8.429 8.427 0.002 1
1 547 . 3 1 1 A 45 45 LEU HA H 45 3.486 3.547 -0.061 1
1 557 . 3 1 1 A 45 45 LEU C C 45 178.648 178.858 -0.210 1
1 558 . 3 1 1 A 45 45 LEU CA C 45 57.915 57.510 0.405 1
1 559 . 3 1 1 A 45 45 LEU CB C 45 39.073 40.458 -1.385 1
1 563 . 3 1 1 A 45 45 LEU N N 45 119.649 120.017 -0.368 1
1 564 . 3 1 1 A 46 46 GLU H H 46 8.309 8.291 0.018 1
1 565 . 3 1 1 A 46 46 GLU HA H 46 4.286 4.085 0.201 1
1 570 . 3 1 1 A 46 46 GLU C C 46 179.577 179.585 -0.008 1
1 571 . 3 1 1 A 46 46 GLU CA C 46 59.570 59.828 -0.258 1
1 572 . 3 1 1 A 46 46 GLU CB C 46 29.034 29.241 -0.207 1
1 574 . 3 1 1 A 46 46 GLU N N 46 117.366 117.535 -0.169 1
1 575 . 3 1 1 A 47 47 GLN H H 47 7.493 7.982 -0.489 1
1 576 . 3 1 1 A 47 47 GLN HA H 47 4.243 3.990 0.253 1
1 583 . 3 1 1 A 47 47 GLN C C 47 178.870 179.010 -0.140 1
1 584 . 3 1 1 A 47 47 GLN CA C 47 59.581 58.766 0.815 1
1 585 . 3 1 1 A 47 47 GLN CB C 47 28.300 28.023 0.277 1
1 588 . 3 1 1 A 47 47 GLN N N 47 119.345 118.960 0.385 1
1 590 . 3 1 1 A 48 48 LEU H H 48 8.160 8.554 -0.394 1
1 591 . 3 1 1 A 48 48 LEU HA H 48 4.211 3.974 0.237 1
1 601 . 3 1 1 A 48 48 LEU C C 48 180.111 179.182 0.929 1
1 602 . 3 1 1 A 48 48 LEU CA C 48 57.179 57.854 -0.675 1
1 603 . 3 1 1 A 48 48 LEU CB C 48 42.067 41.751 0.316 1
1 607 . 3 1 1 A 48 48 LEU N N 48 118.594 119.777 -1.183 1
1 608 . 3 1 1 A 49 49 HIS H H 49 8.864 8.281 0.583 1
1 609 . 3 1 1 A 49 49 HIS HA H 49 5.162 4.448 0.714 1
1 613 . 3 1 1 A 49 49 HIS C C 49 178.801 176.731 2.070 1
1 614 . 3 1 1 A 49 49 HIS CA C 49 58.397 59.861 -1.464 1
1 615 . 3 1 1 A 49 49 HIS CB C 49 29.631 29.917 -0.286 1
1 617 . 3 1 1 A 49 49 HIS N N 49 122.537 118.049 4.488 1
1 618 . 3 1 1 A 50 50 ASP H H 50 8.683 8.396 0.287 1
1 619 . 3 1 1 A 50 50 ASP HA H 50 4.356 4.191 0.165 1
1 622 . 3 1 1 A 50 50 ASP C C 50 178.474 178.023 0.451 1
1 623 . 3 1 1 A 50 50 ASP CA C 50 57.744 57.375 0.369 1
1 624 . 3 1 1 A 50 50 ASP CB C 50 40.575 41.302 -0.727 1
1 625 . 3 1 1 A 50 50 ASP N N 50 123.169 118.430 4.739 1
1 626 . 3 1 1 A 51 51 VAL H H 51 7.606 7.830 -0.224 1
1 627 . 3 1 1 A 51 51 VAL HA H 51 4.514 4.060 0.454 1
1 635 . 3 1 1 A 51 51 VAL C C 51 176.862 176.372 0.490 1
1 636 . 3 1 1 A 51 51 VAL CA C 51 61.590 62.899 -1.309 1
1 637 . 3 1 1 A 51 51 VAL CB C 51 31.423 32.634 -1.211 1
1 640 . 3 1 1 A 51 51 VAL N N 51 109.266 111.457 -2.191 1
1 641 . 3 1 1 A 52 52 GLY H H 52 7.696 7.811 -0.115 1
1 642 . 3 1 1 A 52 52 GLY HA2 H 52 4.172 3.976 0.196 1
1 643 . 3 1 1 A 52 52 GLY HA3 H 52 3.938 3.993 -0.055 1
1 644 . 3 1 1 A 52 52 GLY C C 52 174.276 174.404 -0.128 1
1 645 . 3 1 1 A 52 52 GLY CA C 52 46.228 46.376 -0.148 1
1 646 . 3 1 1 A 52 52 GLY N N 52 108.681 110.415 -1.734 1
1 647 . 3 1 1 A 53 53 VAL H H 53 8.046 8.317 -0.271 1
1 648 . 3 1 1 A 53 53 VAL HA H 53 4.079 4.228 -0.149 1
1 656 . 3 1 1 A 53 53 VAL C C 53 175.949 175.312 0.637 1
1 657 . 3 1 1 A 53 53 VAL CA C 53 64.063 63.659 0.404 1
1 658 . 3 1 1 A 53 53 VAL CB C 53 33.160 34.511 -1.351 1
1 661 . 3 1 1 A 53 53 VAL N N 53 117.892 116.526 1.366 1
1 662 . 3 1 1 A 54 54 LEU H H 54 6.835 7.474 -0.639 1
1 663 . 3 1 1 A 54 54 LEU HA H 54 5.348 5.012 0.336 1
1 673 . 3 1 1 A 54 54 LEU C C 54 175.713 176.068 -0.355 1
1 674 . 3 1 1 A 54 54 LEU CA C 54 52.194 52.833 -0.639 1
1 675 . 3 1 1 A 54 54 LEU CB C 54 46.733 43.868 2.865 1
1 679 . 3 1 1 A 54 54 LEU N N 54 114.848 118.052 -3.204 1
1 680 . 3 1 1 A 55 55 GLU H H 55 9.549 9.280 0.269 1
1 681 . 3 1 1 A 55 55 GLU HA H 55 4.826 4.843 -0.017 1
1 686 . 3 1 1 A 55 55 GLU C C 55 174.661 175.665 -1.004 1
1 687 . 3 1 1 A 55 55 GLU CA C 55 54.637 55.879 -1.242 1
1 688 . 3 1 1 A 55 55 GLU CB C 55 32.891 31.172 1.719 1
1 690 . 3 1 1 A 55 55 GLU N N 55 121.431 123.948 -2.517 1
1 691 . 3 1 1 A 56 56 LYS H H 56 8.513 8.732 -0.219 1
1 692 . 3 1 1 A 56 56 LYS HA H 56 4.151 4.241 -0.090 1
1 701 . 3 1 1 A 56 56 LYS C C 56 176.270 174.531 1.739 1
1 702 . 3 1 1 A 56 56 LYS CA C 56 54.890 55.446 -0.556 1
1 703 . 3 1 1 A 56 56 LYS CB C 56 33.162 32.227 0.935 1
1 707 . 3 1 1 A 56 56 LYS N N 56 126.539 128.677 -2.138 1
1 708 . 3 1 1 A 57 57 VAL H H 57 8.279 8.538 -0.259 1
1 709 . 3 1 1 A 57 57 VAL HA H 57 3.820 4.519 -0.699 1
1 717 . 3 1 1 A 57 57 VAL C C 57 175.108 174.391 0.717 1
1 718 . 3 1 1 A 57 57 VAL CA C 57 62.834 61.064 1.770 1
1 719 . 3 1 1 A 57 57 VAL CB C 57 32.549 32.869 -0.320 1
1 722 . 3 1 1 A 57 57 VAL N N 57 126.540 127.182 -0.642 1
1 723 . 3 1 1 A 58 58 ASN H H 58 8.383 8.781 -0.398 1
1 724 . 3 1 1 A 58 58 ASN HA H 58 4.612 5.025 -0.413 1
1 729 . 3 1 1 A 58 58 ASN C C 58 174.772 173.770 1.002 1
1 730 . 3 1 1 A 58 58 ASN CA C 58 52.575 51.901 0.674 1
1 731 . 3 1 1 A 58 58 ASN CB C 58 38.502 40.451 -1.949 1
1 733 . 3 1 1 A 58 58 ASN N N 58 121.767 125.322 -3.555 1
1 735 . 3 1 1 A 59 59 ALA H H 59 8.165 8.438 -0.273 1
1 736 . 3 1 1 A 59 59 ALA HA H 59 4.251 4.070 0.181 1
1 740 . 3 1 1 A 59 59 ALA C C 59 177.478 178.009 -0.531 1
1 741 . 3 1 1 A 59 59 ALA CA C 59 52.490 53.230 -0.740 1
1 742 . 3 1 1 A 59 59 ALA CB C 59 19.724 18.562 1.162 1
1 743 . 3 1 1 A 59 59 ALA N N 59 125.082 128.366 -3.284 1
1 744 . 3 1 1 A 60 60 GLY H H 60 8.291 8.429 -0.138 1
1 745 . 3 1 1 A 60 60 GLY HA2 H 60 4.165 3.840 0.325 1
1 746 . 3 1 1 A 60 60 GLY HA3 H 60 3.853 3.840 0.013 1
1 747 . 3 1 1 A 60 60 GLY C C 60 174.171 174.158 0.013 1
1 748 . 3 1 1 A 60 60 GLY CA C 60 44.994 47.316 -2.322 1
1 749 . 3 1 1 A 60 60 GLY N N 60 108.518 114.506 -5.988 1
1 750 . 3 1 1 A 61 61 LYS H H 61 8.189 7.994 0.195 1
1 751 . 3 1 1 A 61 61 LYS HA H 61 4.320 4.701 -0.381 1
1 760 . 3 1 1 A 61 61 LYS C C 61 177.712 177.646 0.066 1
1 761 . 3 1 1 A 61 61 LYS CA C 61 56.832 56.985 -0.153 1
1 762 . 3 1 1 A 61 61 LYS CB C 61 32.641 35.295 -2.654 1
1 766 . 3 1 1 A 61 61 LYS N N 61 120.532 124.349 -3.817 1
1 767 . 3 1 1 A 62 62 GLY H H 62 8.767 8.341 0.426 1
1 768 . 3 1 1 A 62 62 GLY HA2 H 62 4.021 3.862 0.159 1
1 769 . 3 1 1 A 62 62 GLY HA3 H 62 3.849 3.862 -0.013 1
1 770 . 3 1 1 A 62 62 GLY C C 62 173.782 174.484 -0.702 1
1 771 . 3 1 1 A 62 62 GLY CA C 62 45.844 46.989 -1.145 1
1 772 . 3 1 1 A 62 62 GLY N N 62 111.547 107.690 3.857 1
1 773 . 3 1 1 A 63 63 VAL H H 63 7.379 7.514 -0.135 1
1 774 . 3 1 1 A 63 63 VAL HA H 63 4.591 4.248 0.343 1
1 782 . 3 1 1 A 63 63 VAL C C 63 174.262 175.708 -1.446 1
1 783 . 3 1 1 A 63 63 VAL CA C 63 59.292 60.750 -1.458 1
1 784 . 3 1 1 A 63 63 VAL CB C 63 32.726 31.343 1.383 1
1 787 . 3 1 1 A 63 63 VAL N N 63 117.546 118.203 -0.657 1
1 788 . 3 1 1 A 64 64 PRO HA H 64 4.458 4.422 0.036 1
1 795 . 3 1 1 A 64 64 PRO C C 64 177.166 176.399 0.767 1
1 796 . 3 1 1 A 64 64 PRO CA C 64 63.661 64.259 -0.598 1
1 797 . 3 1 1 A 64 64 PRO CB C 64 32.321 32.154 0.167 1
1 800 . 3 1 1 A 65 65 GLY H H 65 8.463 7.263 1.200 1
1 801 . 3 1 1 A 65 65 GLY HA2 H 65 3.882 3.736 0.146 1
1 802 . 3 1 1 A 65 65 GLY HA3 H 65 3.602 3.801 -0.199 1
1 803 . 3 1 1 A 65 65 GLY C C 65 172.406 171.265 1.141 1
1 804 . 3 1 1 A 65 65 GLY CA C 65 45.933 45.187 0.746 1
1 805 . 3 1 1 A 65 65 GLY N N 65 109.819 104.286 5.533 1
1 806 . 3 1 1 A 66 66 LEU H H 66 7.534 8.152 -0.618 1
1 807 . 3 1 1 A 66 66 LEU HA H 66 4.940 4.773 0.167 1
1 817 . 3 1 1 A 66 66 LEU C C 66 176.237 174.922 1.315 1
1 818 . 3 1 1 A 66 66 LEU CA C 66 53.687 53.118 0.569 1
1 819 . 3 1 1 A 66 66 LEU CB C 66 46.108 45.541 0.567 1
1 823 . 3 1 1 A 66 66 LEU N N 66 122.249 120.825 1.424 1
1 824 . 3 1 1 A 67 67 TRP H H 67 8.916 8.941 -0.025 1
1 825 . 3 1 1 A 67 67 TRP HA H 67 5.526 5.386 0.140 1
1 834 . 3 1 1 A 67 67 TRP C C 67 175.670 174.938 0.732 1
1 835 . 3 1 1 A 67 67 TRP CA C 67 56.241 55.192 1.049 1
1 836 . 3 1 1 A 67 67 TRP CB C 67 33.314 32.376 0.938 1
1 842 . 3 1 1 A 67 67 TRP N N 67 121.160 124.481 -3.321 1
1 844 . 3 1 1 A 68 68 ARG H H 68 8.772 8.752 0.020 1
1 845 . 3 1 1 A 68 68 ARG HA H 68 4.832 5.055 -0.223 1
1 853 . 3 1 1 A 68 68 ARG C C 68 174.720 175.426 -0.706 1
1 854 . 3 1 1 A 68 68 ARG CA C 68 54.690 54.576 0.114 1
1 855 . 3 1 1 A 68 68 ARG CB C 68 35.176 33.631 1.545 1
1 858 . 3 1 1 A 68 68 ARG N N 68 117.471 124.954 -7.483 1
1 860 . 3 1 1 A 69 69 LEU H H 69 9.355 8.593 0.762 1
1 861 . 3 1 1 A 69 69 LEU HA H 69 4.557 4.476 0.081 1
1 871 . 3 1 1 A 69 69 LEU C C 69 177.180 176.432 0.748 1
1 872 . 3 1 1 A 69 69 LEU CA C 69 55.780 54.877 0.903 1
1 873 . 3 1 1 A 69 69 LEU CB C 69 42.736 43.000 -0.264 1
1 877 . 3 1 1 A 69 69 LEU N N 69 125.211 123.543 1.668 1
1 878 . 3 1 1 A 70 70 LEU H H 70 8.058 8.775 -0.717 1
1 879 . 3 1 1 A 70 70 LEU HA H 70 4.364 4.572 -0.208 1
1 889 . 3 1 1 A 70 70 LEU C C 70 176.808 177.473 -0.665 1
1 890 . 3 1 1 A 70 70 LEU CA C 70 55.257 54.187 1.070 1
1 891 . 3 1 1 A 70 70 LEU CB C 70 42.413 42.095 0.318 1
1 895 . 3 1 1 A 70 70 LEU N N 70 125.525 121.790 3.735 1
1 1 . 4 1 1 A 2 2 SER HA H 2 4.126 4.450 -0.324 1
1 4 . 4 1 1 A 2 2 SER CA C 2 57.564 61.711 -4.147 1
1 5 . 4 1 1 A 2 2 SER CB C 2 63.953 63.499 0.454 1
1 6 . 4 1 1 A 3 3 GLU HA H 3 4.408 4.533 -0.125 1
1 11 . 4 1 1 A 3 3 GLU C C 3 176.658 175.325 1.333 1
1 12 . 4 1 1 A 3 3 GLU CA C 3 56.802 55.989 0.813 1
1 13 . 4 1 1 A 3 3 GLU CB C 3 30.674 30.421 0.253 1
1 15 . 4 1 1 A 4 4 SER H H 4 8.650 8.242 0.408 1
1 16 . 4 1 1 A 4 4 SER HA H 4 4.463 4.852 -0.389 1
1 19 . 4 1 1 A 4 4 SER C C 4 175.949 174.576 1.373 1
1 20 . 4 1 1 A 4 4 SER CA C 4 58.557 56.346 2.211 1
1 21 . 4 1 1 A 4 4 SER CB C 4 63.834 64.433 -0.599 1
1 22 . 4 1 1 A 4 4 SER N N 4 118.042 115.897 2.145 1
1 23 . 4 1 1 A 5 5 ILE H H 5 8.404 8.559 -0.155 1
1 24 . 4 1 1 A 5 5 ILE HA H 5 3.902 3.724 0.178 1
1 34 . 4 1 1 A 5 5 ILE C C 5 176.608 177.570 -0.962 1
1 35 . 4 1 1 A 5 5 ILE CA C 5 62.662 64.344 -1.682 1
1 36 . 4 1 1 A 5 5 ILE CB C 5 37.622 37.260 0.362 1
1 40 . 4 1 1 A 5 5 ILE N N 5 124.711 127.360 -2.649 1
1 41 . 4 1 1 A 6 6 VAL H H 6 7.602 7.975 -0.373 1
1 42 . 4 1 1 A 6 6 VAL HA H 6 3.293 3.434 -0.141 1
1 50 . 4 1 1 A 6 6 VAL C C 6 177.088 178.203 -1.115 1
1 51 . 4 1 1 A 6 6 VAL CA C 6 67.180 66.585 0.595 1
1 52 . 4 1 1 A 6 6 VAL CB C 6 31.517 31.702 -0.185 1
1 55 . 4 1 1 A 6 6 VAL N N 6 119.974 120.747 -0.773 1
1 56 . 4 1 1 A 7 7 THR H H 7 7.515 8.228 -0.713 1
1 57 . 4 1 1 A 7 7 THR HA H 7 3.823 3.886 -0.063 1
1 62 . 4 1 1 A 7 7 THR C C 7 176.978 176.257 0.721 1
1 63 . 4 1 1 A 7 7 THR CA C 7 66.257 67.057 -0.800 1
1 64 . 4 1 1 A 7 7 THR CB C 7 68.410 68.098 0.312 1
1 66 . 4 1 1 A 7 7 THR N N 7 114.177 115.824 -1.647 1
1 67 . 4 1 1 A 8 8 LYS H H 8 7.807 7.938 -0.131 1
1 68 . 4 1 1 A 8 8 LYS HA H 8 4.066 3.953 0.113 1
1 77 . 4 1 1 A 8 8 LYS C C 8 178.733 178.358 0.375 1
1 78 . 4 1 1 A 8 8 LYS CA C 8 59.338 59.762 -0.424 1
1 79 . 4 1 1 A 8 8 LYS CB C 8 32.002 32.005 -0.003 1
1 83 . 4 1 1 A 8 8 LYS N N 8 123.387 120.318 3.069 1
1 84 . 4 1 1 A 9 9 ILE H H 9 8.288 8.116 0.172 1
1 85 . 4 1 1 A 9 9 ILE HA H 9 3.421 3.576 -0.155 1
1 95 . 4 1 1 A 9 9 ILE C C 9 177.187 177.988 -0.801 1
1 96 . 4 1 1 A 9 9 ILE CA C 9 65.772 65.630 0.142 1
1 97 . 4 1 1 A 9 9 ILE CB C 9 37.183 37.862 -0.679 1
1 101 . 4 1 1 A 9 9 ILE N N 9 119.543 118.756 0.787 1
1 102 . 4 1 1 A 10 10 ILE H H 10 8.073 8.052 0.021 1
1 103 . 4 1 1 A 10 10 ILE HA H 10 3.305 3.549 -0.244 1
1 113 . 4 1 1 A 10 10 ILE C C 10 177.308 177.950 -0.642 1
1 114 . 4 1 1 A 10 10 ILE CA C 10 66.704 65.418 1.286 1
1 115 . 4 1 1 A 10 10 ILE CB C 10 37.840 37.854 -0.014 1
1 119 . 4 1 1 A 10 10 ILE N N 10 119.219 120.118 -0.899 1
1 120 . 4 1 1 A 11 11 SER H H 11 7.861 7.941 -0.080 1
1 121 . 4 1 1 A 11 11 SER HA H 11 4.250 4.047 0.203 1
1 124 . 4 1 1 A 11 11 SER C C 11 176.918 175.880 1.038 1
1 125 . 4 1 1 A 11 11 SER CA C 11 61.911 62.495 -0.584 1
1 126 . 4 1 1 A 11 11 SER CB C 11 62.998 63.012 -0.014 1
1 127 . 4 1 1 A 11 11 SER N N 11 113.959 115.653 -1.694 1
1 128 . 4 1 1 A 12 12 ILE H H 12 8.250 7.793 0.457 1
1 129 . 4 1 1 A 12 12 ILE HA H 12 3.801 3.668 0.133 1
1 139 . 4 1 1 A 12 12 ILE C C 12 178.130 178.028 0.102 1
1 140 . 4 1 1 A 12 12 ILE CA C 12 65.023 64.786 0.237 1
1 141 . 4 1 1 A 12 12 ILE CB C 12 38.195 37.883 0.312 1
1 145 . 4 1 1 A 12 12 ILE N N 12 123.767 121.255 2.512 1
1 146 . 4 1 1 A 13 13 VAL H H 13 8.308 8.221 0.087 1
1 147 . 4 1 1 A 13 13 VAL HA H 13 3.435 3.473 -0.038 1
1 155 . 4 1 1 A 13 13 VAL C C 13 177.283 178.203 -0.920 1
1 156 . 4 1 1 A 13 13 VAL CA C 13 67.693 67.051 0.642 1
1 157 . 4 1 1 A 13 13 VAL CB C 13 31.139 31.492 -0.353 1
1 160 . 4 1 1 A 13 13 VAL N N 13 120.066 119.926 0.140 1
1 161 . 4 1 1 A 14 14 GLN H H 14 8.612 7.970 0.642 1
1 162 . 4 1 1 A 14 14 GLN HA H 14 3.831 3.946 -0.115 1
1 169 . 4 1 1 A 14 14 GLN C C 14 178.256 177.905 0.351 1
1 170 . 4 1 1 A 14 14 GLN CA C 14 59.660 59.246 0.414 1
1 171 . 4 1 1 A 14 14 GLN CB C 14 29.456 28.392 1.064 1
1 174 . 4 1 1 A 14 14 GLN N N 14 118.099 119.764 -1.665 1
1 176 . 4 1 1 A 15 15 GLU H H 15 8.378 8.588 -0.210 1
1 177 . 4 1 1 A 15 15 GLU HA H 15 4.110 4.024 0.086 1
1 182 . 4 1 1 A 15 15 GLU C C 15 179.659 179.131 0.528 1
1 183 . 4 1 1 A 15 15 GLU CA C 15 59.476 59.663 -0.187 1
1 184 . 4 1 1 A 15 15 GLU CB C 15 29.725 29.357 0.368 1
1 186 . 4 1 1 A 15 15 GLU N N 15 118.580 119.386 -0.806 1
1 187 . 4 1 1 A 16 16 ARG H H 16 8.439 8.096 0.343 1
1 188 . 4 1 1 A 16 16 ARG HA H 16 4.157 4.027 0.130 1
1 196 . 4 1 1 A 16 16 ARG C C 16 179.276 179.248 0.028 1
1 197 . 4 1 1 A 16 16 ARG CA C 16 58.141 59.996 -1.855 1
1 198 . 4 1 1 A 16 16 ARG CB C 16 29.434 30.191 -0.757 1
1 201 . 4 1 1 A 16 16 ARG N N 16 118.688 118.618 0.070 1
1 203 . 4 1 1 A 17 17 GLN H H 17 8.861 7.785 1.076 1
1 204 . 4 1 1 A 17 17 GLN HA H 17 4.236 4.062 0.174 1
1 211 . 4 1 1 A 17 17 GLN C C 17 178.736 178.790 -0.054 1
1 212 . 4 1 1 A 17 17 GLN CA C 17 59.683 58.628 1.055 1
1 213 . 4 1 1 A 17 17 GLN CB C 17 29.960 27.960 2.000 1
1 216 . 4 1 1 A 17 17 GLN N N 17 120.427 118.764 1.663 1
1 218 . 4 1 1 A 18 18 ASN H H 18 8.017 8.164 -0.147 1
1 219 . 4 1 1 A 18 18 ASN HA H 18 4.605 4.630 -0.025 1
1 224 . 4 1 1 A 18 18 ASN C C 18 177.906 178.204 -0.298 1
1 225 . 4 1 1 A 18 18 ASN CA C 18 55.375 56.061 -0.686 1
1 226 . 4 1 1 A 18 18 ASN CB C 18 38.383 38.457 -0.074 1
1 228 . 4 1 1 A 18 18 ASN N N 18 117.033 118.769 -1.736 1
1 230 . 4 1 1 A 19 19 MET H H 19 7.994 8.556 -0.562 1
1 231 . 4 1 1 A 19 19 MET HA H 19 4.372 4.229 0.143 1
1 236 . 4 1 1 A 19 19 MET C C 19 176.518 177.814 -1.296 1
1 237 . 4 1 1 A 19 19 MET CA C 19 57.623 58.839 -1.216 1
1 238 . 4 1 1 A 19 19 MET CB C 19 33.248 33.404 -0.156 1
1 240 . 4 1 1 A 19 19 MET N N 19 119.320 118.789 0.531 1
1 241 . 4 1 1 A 20 20 ASP H H 20 7.800 7.829 -0.029 1
1 242 . 4 1 1 A 20 20 ASP HA H 20 4.990 4.638 0.352 1
1 245 . 4 1 1 A 20 20 ASP C C 20 176.082 175.744 0.338 1
1 246 . 4 1 1 A 20 20 ASP CA C 20 53.796 55.643 -1.847 1
1 247 . 4 1 1 A 20 20 ASP CB C 20 40.409 41.475 -1.066 1
1 248 . 4 1 1 A 20 20 ASP N N 20 119.127 118.230 0.897 1
1 249 . 4 1 1 A 21 21 ASP H H 21 8.136 8.014 0.122 1
1 250 . 4 1 1 A 21 21 ASP HA H 21 4.497 4.674 -0.177 1
1 253 . 4 1 1 A 21 21 ASP C C 21 176.264 175.492 0.772 1
1 254 . 4 1 1 A 21 21 ASP CA C 21 55.508 54.922 0.586 1
1 255 . 4 1 1 A 21 21 ASP CB C 21 40.063 40.091 -0.028 1
1 256 . 4 1 1 A 21 21 ASP N N 21 118.276 118.425 -0.149 1
1 257 . 4 1 1 A 22 22 GLY H H 22 8.728 8.396 0.332 1
1 258 . 4 1 1 A 22 22 GLY HA2 H 22 4.189 3.959 0.230 1
1 259 . 4 1 1 A 22 22 GLY HA3 H 22 3.683 3.961 -0.278 1
1 260 . 4 1 1 A 22 22 GLY C C 22 174.304 174.110 0.194 1
1 261 . 4 1 1 A 22 22 GLY CA C 22 45.629 45.079 0.550 1
1 262 . 4 1 1 A 22 22 GLY N N 22 105.878 114.112 -8.234 1
1 263 . 4 1 1 A 23 23 ALA H H 23 7.473 7.894 -0.421 1
1 264 . 4 1 1 A 23 23 ALA HA H 23 4.519 4.370 0.149 1
1 268 . 4 1 1 A 23 23 ALA C C 23 174.065 176.901 -2.836 1
1 269 . 4 1 1 A 23 23 ALA CA C 23 51.142 50.997 0.145 1
1 270 . 4 1 1 A 23 23 ALA CB C 23 18.283 19.531 -1.248 1
1 271 . 4 1 1 A 23 23 ALA N N 23 125.323 124.738 0.585 1
1 272 . 4 1 1 A 24 24 PRO HA H 24 4.590 4.697 -0.107 1
1 279 . 4 1 1 A 24 24 PRO C C 24 175.253 176.298 -1.045 1
1 280 . 4 1 1 A 24 24 PRO CA C 24 62.186 62.391 -0.205 1
1 281 . 4 1 1 A 24 24 PRO CB C 24 32.931 32.636 0.295 1
1 284 . 4 1 1 A 25 25 VAL H H 25 9.334 8.678 0.656 1
1 285 . 4 1 1 A 25 25 VAL HA H 25 4.378 4.265 0.113 1
1 293 . 4 1 1 A 25 25 VAL C C 25 176.439 175.813 0.626 1
1 294 . 4 1 1 A 25 25 VAL CA C 25 61.482 62.485 -1.003 1
1 295 . 4 1 1 A 25 25 VAL CB C 25 34.781 32.397 2.384 1
1 298 . 4 1 1 A 25 25 VAL N N 25 120.408 121.444 -1.036 1
1 299 . 4 1 1 A 26 26 LYS H H 26 9.300 8.990 0.310 1
1 300 . 4 1 1 A 26 26 LYS HA H 26 4.982 4.666 0.316 1
1 309 . 4 1 1 A 26 26 LYS C C 26 179.008 178.032 0.976 1
1 310 . 4 1 1 A 26 26 LYS CA C 26 56.908 54.731 2.177 1
1 311 . 4 1 1 A 26 26 LYS CB C 26 34.071 34.431 -0.360 1
1 315 . 4 1 1 A 26 26 LYS N N 26 126.177 125.673 0.504 1
1 316 . 4 1 1 A 27 27 THR H H 27 8.618 8.961 -0.343 1
1 317 . 4 1 1 A 27 27 THR HA H 27 3.662 3.920 -0.258 1
1 322 . 4 1 1 A 27 27 THR C C 27 176.442 176.336 0.106 1
1 323 . 4 1 1 A 27 27 THR CA C 27 67.591 66.120 1.471 1
1 324 . 4 1 1 A 27 27 THR CB C 27 68.868 68.827 0.041 1
1 326 . 4 1 1 A 27 27 THR N N 27 119.020 117.348 1.672 1
1 327 . 4 1 1 A 28 28 ARG H H 28 9.288 8.262 1.026 1
1 328 . 4 1 1 A 28 28 ARG HA H 28 3.879 4.014 -0.135 1
1 335 . 4 1 1 A 28 28 ARG C C 28 176.884 178.818 -1.934 1
1 336 . 4 1 1 A 28 28 ARG CA C 28 59.431 59.653 -0.222 1
1 337 . 4 1 1 A 28 28 ARG CB C 28 29.953 30.300 -0.347 1
1 340 . 4 1 1 A 28 28 ARG N N 28 119.100 121.429 -2.329 1
1 341 . 4 1 1 A 29 29 ASP H H 29 6.907 8.162 -1.255 1
1 342 . 4 1 1 A 29 29 ASP HA H 29 4.550 4.401 0.149 1
1 345 . 4 1 1 A 29 29 ASP C C 29 179.050 178.804 0.246 1
1 346 . 4 1 1 A 29 29 ASP CA C 29 57.262 57.233 0.029 1
1 347 . 4 1 1 A 29 29 ASP CB C 29 40.191 40.589 -0.398 1
1 348 . 4 1 1 A 29 29 ASP N N 29 117.490 119.639 -2.149 1
1 349 . 4 1 1 A 30 30 ILE H H 30 7.554 7.574 -0.020 1
1 350 . 4 1 1 A 30 30 ILE HA H 30 3.595 3.773 -0.178 1
1 360 . 4 1 1 A 30 30 ILE C C 30 176.907 177.789 -0.882 1
1 361 . 4 1 1 A 30 30 ILE CA C 30 65.002 66.070 -1.068 1
1 362 . 4 1 1 A 30 30 ILE CB C 30 37.999 37.943 0.056 1
1 366 . 4 1 1 A 30 30 ILE N N 30 120.978 120.141 0.837 1
1 367 . 4 1 1 A 31 31 ALA H H 31 8.269 8.587 -0.318 1
1 368 . 4 1 1 A 31 31 ALA HA H 31 3.720 4.002 -0.282 1
1 372 . 4 1 1 A 31 31 ALA C C 31 179.170 179.695 -0.525 1
1 373 . 4 1 1 A 31 31 ALA CA C 31 56.354 55.833 0.521 1
1 374 . 4 1 1 A 31 31 ALA CB C 31 17.843 18.093 -0.250 1
1 375 . 4 1 1 A 31 31 ALA N N 31 121.171 124.105 -2.934 1
1 376 . 4 1 1 A 32 32 ASP H H 32 8.293 8.520 -0.227 1
1 377 . 4 1 1 A 32 32 ASP HA H 32 4.422 4.458 -0.036 1
1 380 . 4 1 1 A 32 32 ASP C C 32 179.136 178.307 0.829 1
1 381 . 4 1 1 A 32 32 ASP CA C 32 57.109 56.464 0.645 1
1 382 . 4 1 1 A 32 32 ASP CB C 32 40.523 40.339 0.184 1
1 383 . 4 1 1 A 32 32 ASP N N 32 116.467 119.252 -2.785 1
1 384 . 4 1 1 A 33 33 ALA H H 33 7.536 8.087 -0.551 1
1 385 . 4 1 1 A 33 33 ALA HA H 33 4.222 4.162 0.060 1
1 389 . 4 1 1 A 33 33 ALA C C 33 179.056 179.974 -0.918 1
1 390 . 4 1 1 A 33 33 ALA CA C 33 54.469 54.673 -0.204 1
1 391 . 4 1 1 A 33 33 ALA CB C 33 19.085 18.378 0.707 1
1 392 . 4 1 1 A 33 33 ALA N N 33 120.859 122.921 -2.062 1
1 393 . 4 1 1 A 34 34 ALA H H 34 8.296 7.791 0.505 1
1 394 . 4 1 1 A 34 34 ALA HA H 34 4.101 4.316 -0.215 1
1 398 . 4 1 1 A 34 34 ALA C C 34 176.912 178.053 -1.141 1
1 399 . 4 1 1 A 34 34 ALA CA C 34 52.380 52.353 0.027 1
1 400 . 4 1 1 A 34 34 ALA CB C 34 18.817 19.755 -0.938 1
1 401 . 4 1 1 A 34 34 ALA N N 34 118.203 117.208 0.995 1
1 402 . 4 1 1 A 35 35 GLY H H 35 7.911 8.651 -0.740 1
1 403 . 4 1 1 A 35 35 GLY HA2 H 35 3.968 3.946 0.022 1
1 404 . 4 1 1 A 35 35 GLY HA3 H 35 3.968 3.952 0.016 1
1 405 . 4 1 1 A 35 35 GLY C C 35 174.374 174.008 0.366 1
1 406 . 4 1 1 A 35 35 GLY CA C 35 46.388 46.409 -0.021 1
1 407 . 4 1 1 A 35 35 GLY N N 35 107.752 107.745 0.007 1
1 408 . 4 1 1 A 36 36 LEU H H 36 7.758 7.561 0.197 1
1 409 . 4 1 1 A 36 36 LEU HA H 36 4.887 4.893 -0.006 1
1 419 . 4 1 1 A 36 36 LEU C C 36 175.941 175.669 0.272 1
1 420 . 4 1 1 A 36 36 LEU CA C 36 52.443 52.809 -0.366 1
1 421 . 4 1 1 A 36 36 LEU CB C 36 47.885 45.020 2.865 1
1 425 . 4 1 1 A 36 36 LEU N N 36 118.719 120.128 -1.409 1
1 426 . 4 1 1 A 37 37 SER H H 37 8.603 8.445 0.158 1
1 427 . 4 1 1 A 37 37 SER HA H 37 4.565 4.545 0.020 1
1 430 . 4 1 1 A 37 37 SER C C 37 175.512 175.660 -0.148 1
1 431 . 4 1 1 A 37 37 SER CA C 37 57.262 58.768 -1.506 1
1 432 . 4 1 1 A 37 37 SER CB C 37 65.155 63.758 1.397 1
1 433 . 4 1 1 A 37 37 SER N N 37 115.095 116.512 -1.417 1
1 434 . 4 1 1 A 38 38 ILE H H 38 8.822 8.762 0.060 1
1 435 . 4 1 1 A 38 38 ILE HA H 38 3.650 3.781 -0.131 1
1 445 . 4 1 1 A 38 38 ILE C C 38 176.849 177.478 -0.629 1
1 446 . 4 1 1 A 38 38 ILE CA C 38 64.557 65.221 -0.664 1
1 447 . 4 1 1 A 38 38 ILE CB C 38 37.451 37.980 -0.529 1
1 451 . 4 1 1 A 38 38 ILE N N 38 122.026 124.620 -2.594 1
1 452 . 4 1 1 A 39 39 TYR H H 39 7.839 8.482 -0.643 1
1 453 . 4 1 1 A 39 39 TYR HA H 39 4.112 4.050 0.062 1
1 460 . 4 1 1 A 39 39 TYR C C 39 177.703 177.316 0.387 1
1 461 . 4 1 1 A 39 39 TYR CA C 39 60.856 62.252 -1.396 1
1 462 . 4 1 1 A 39 39 TYR CB C 39 38.402 38.682 -0.280 1
1 467 . 4 1 1 A 39 39 TYR N N 39 118.759 120.763 -2.004 1
1 468 . 4 1 1 A 40 40 GLN H H 40 7.687 8.370 -0.683 1
1 469 . 4 1 1 A 40 40 GLN HA H 40 3.865 3.874 -0.009 1
1 476 . 4 1 1 A 40 40 GLN C C 40 178.735 178.213 0.522 1
1 477 . 4 1 1 A 40 40 GLN CA C 40 58.089 58.956 -0.867 1
1 478 . 4 1 1 A 40 40 GLN CB C 40 29.950 28.416 1.534 1
1 481 . 4 1 1 A 40 40 GLN N N 40 116.772 118.789 -2.017 1
1 483 . 4 1 1 A 41 41 VAL H H 41 8.494 8.488 0.006 1
1 484 . 4 1 1 A 41 41 VAL HA H 41 3.835 3.584 0.251 1
1 492 . 4 1 1 A 41 41 VAL C C 41 176.977 177.954 -0.977 1
1 493 . 4 1 1 A 41 41 VAL CA C 41 66.102 67.152 -1.050 1
1 494 . 4 1 1 A 41 41 VAL CB C 41 31.105 31.519 -0.414 1
1 497 . 4 1 1 A 41 41 VAL N N 41 117.192 119.874 -2.682 1
1 498 . 4 1 1 A 42 42 ARG H H 42 8.179 8.092 0.087 1
1 499 . 4 1 1 A 42 42 ARG HA H 42 3.708 3.908 -0.200 1
1 506 . 4 1 1 A 42 42 ARG C C 42 177.570 178.385 -0.815 1
1 507 . 4 1 1 A 42 42 ARG CA C 42 60.349 58.456 1.893 1
1 508 . 4 1 1 A 42 42 ARG CB C 42 30.047 29.555 0.492 1
1 511 . 4 1 1 A 42 42 ARG N N 42 120.574 120.194 0.380 1
1 512 . 4 1 1 A 43 43 LEU H H 43 6.982 7.702 -0.720 1
1 513 . 4 1 1 A 43 43 LEU HA H 43 3.939 3.781 0.158 1
1 523 . 4 1 1 A 43 43 LEU C C 43 180.397 178.310 2.087 1
1 524 . 4 1 1 A 43 43 LEU CA C 43 58.119 57.853 0.266 1
1 525 . 4 1 1 A 43 43 LEU CB C 43 41.294 41.312 -0.018 1
1 529 . 4 1 1 A 43 43 LEU N N 43 117.189 121.469 -4.280 1
1 530 . 4 1 1 A 44 44 TYR H H 44 7.026 7.664 -0.638 1
1 531 . 4 1 1 A 44 44 TYR HA H 44 4.253 4.100 0.153 1
1 538 . 4 1 1 A 44 44 TYR C C 44 178.411 178.074 0.337 1
1 539 . 4 1 1 A 44 44 TYR CA C 44 60.941 60.645 0.296 1
1 540 . 4 1 1 A 44 44 TYR CB C 44 38.889 37.636 1.253 1
1 545 . 4 1 1 A 44 44 TYR N N 44 117.020 117.448 -0.428 1
1 546 . 4 1 1 A 45 45 LEU H H 45 8.429 8.105 0.324 1
1 547 . 4 1 1 A 45 45 LEU HA H 45 3.486 3.555 -0.069 1
1 557 . 4 1 1 A 45 45 LEU C C 45 178.648 178.855 -0.207 1
1 558 . 4 1 1 A 45 45 LEU CA C 45 57.915 57.673 0.242 1
1 559 . 4 1 1 A 45 45 LEU CB C 45 39.073 40.480 -1.407 1
1 563 . 4 1 1 A 45 45 LEU N N 45 119.649 120.214 -0.565 1
1 564 . 4 1 1 A 46 46 GLU H H 46 8.309 8.403 -0.094 1
1 565 . 4 1 1 A 46 46 GLU HA H 46 4.286 4.179 0.107 1
1 570 . 4 1 1 A 46 46 GLU C C 46 179.577 179.399 0.178 1
1 571 . 4 1 1 A 46 46 GLU CA C 46 59.570 59.486 0.084 1
1 572 . 4 1 1 A 46 46 GLU CB C 46 29.034 29.353 -0.319 1
1 574 . 4 1 1 A 46 46 GLU N N 46 117.366 117.649 -0.283 1
1 575 . 4 1 1 A 47 47 GLN H H 47 7.493 7.904 -0.411 1
1 576 . 4 1 1 A 47 47 GLN HA H 47 4.243 3.808 0.435 1
1 583 . 4 1 1 A 47 47 GLN C C 47 178.870 178.824 0.046 1
1 584 . 4 1 1 A 47 47 GLN CA C 47 59.581 59.110 0.471 1
1 585 . 4 1 1 A 47 47 GLN CB C 47 28.300 28.066 0.234 1
1 588 . 4 1 1 A 47 47 GLN N N 47 119.345 118.998 0.347 1
1 590 . 4 1 1 A 48 48 LEU H H 48 8.160 8.421 -0.261 1
1 591 . 4 1 1 A 48 48 LEU HA H 48 4.211 4.016 0.195 1
1 601 . 4 1 1 A 48 48 LEU C C 48 180.111 179.143 0.968 1
1 602 . 4 1 1 A 48 48 LEU CA C 48 57.179 57.742 -0.563 1
1 603 . 4 1 1 A 48 48 LEU CB C 48 42.067 40.984 1.083 1
1 607 . 4 1 1 A 48 48 LEU N N 48 118.594 119.517 -0.923 1
1 608 . 4 1 1 A 49 49 HIS H H 49 8.864 8.280 0.584 1
1 609 . 4 1 1 A 49 49 HIS HA H 49 5.162 4.301 0.861 1
1 613 . 4 1 1 A 49 49 HIS C C 49 178.801 177.219 1.582 1
1 614 . 4 1 1 A 49 49 HIS CA C 49 58.397 60.000 -1.603 1
1 615 . 4 1 1 A 49 49 HIS CB C 49 29.631 30.123 -0.492 1
1 617 . 4 1 1 A 49 49 HIS N N 49 122.537 118.274 4.263 1
1 618 . 4 1 1 A 50 50 ASP H H 50 8.683 8.160 0.523 1
1 619 . 4 1 1 A 50 50 ASP HA H 50 4.356 4.191 0.165 1
1 622 . 4 1 1 A 50 50 ASP C C 50 178.474 177.972 0.502 1
1 623 . 4 1 1 A 50 50 ASP CA C 50 57.744 56.623 1.121 1
1 624 . 4 1 1 A 50 50 ASP CB C 50 40.575 40.449 0.126 1
1 625 . 4 1 1 A 50 50 ASP N N 50 123.169 119.355 3.814 1
1 626 . 4 1 1 A 51 51 VAL H H 51 7.606 7.701 -0.095 1
1 627 . 4 1 1 A 51 51 VAL HA H 51 4.514 4.241 0.273 1
1 635 . 4 1 1 A 51 51 VAL C C 51 176.862 175.859 1.003 1
1 636 . 4 1 1 A 51 51 VAL CA C 51 61.590 61.262 0.328 1
1 637 . 4 1 1 A 51 51 VAL CB C 51 31.423 31.581 -0.158 1
1 640 . 4 1 1 A 51 51 VAL N N 51 109.266 112.511 -3.245 1
1 641 . 4 1 1 A 52 52 GLY H H 52 7.696 7.852 -0.156 1
1 642 . 4 1 1 A 52 52 GLY HA2 H 52 4.172 3.983 0.189 1
1 643 . 4 1 1 A 52 52 GLY HA3 H 52 3.938 3.989 -0.051 1
1 644 . 4 1 1 A 52 52 GLY C C 52 174.276 174.627 -0.351 1
1 645 . 4 1 1 A 52 52 GLY CA C 52 46.228 46.709 -0.481 1
1 646 . 4 1 1 A 52 52 GLY N N 52 108.681 111.176 -2.495 1
1 647 . 4 1 1 A 53 53 VAL H H 53 8.046 8.102 -0.056 1
1 648 . 4 1 1 A 53 53 VAL HA H 53 4.079 4.272 -0.193 1
1 656 . 4 1 1 A 53 53 VAL C C 53 175.949 175.241 0.708 1
1 657 . 4 1 1 A 53 53 VAL CA C 53 64.063 63.761 0.302 1
1 658 . 4 1 1 A 53 53 VAL CB C 53 33.160 34.805 -1.645 1
1 661 . 4 1 1 A 53 53 VAL N N 53 117.892 116.731 1.161 1
1 662 . 4 1 1 A 54 54 LEU H H 54 6.835 7.805 -0.970 1
1 663 . 4 1 1 A 54 54 LEU HA H 54 5.348 4.919 0.429 1
1 673 . 4 1 1 A 54 54 LEU C C 54 175.713 176.297 -0.584 1
1 674 . 4 1 1 A 54 54 LEU CA C 54 52.194 53.589 -1.395 1
1 675 . 4 1 1 A 54 54 LEU CB C 54 46.733 43.390 3.343 1
1 679 . 4 1 1 A 54 54 LEU N N 54 114.848 118.372 -3.524 1
1 680 . 4 1 1 A 55 55 GLU H H 55 9.549 9.111 0.438 1
1 681 . 4 1 1 A 55 55 GLU HA H 55 4.826 5.030 -0.204 1
1 686 . 4 1 1 A 55 55 GLU C C 55 174.661 175.583 -0.922 1
1 687 . 4 1 1 A 55 55 GLU CA C 55 54.637 55.168 -0.531 1
1 688 . 4 1 1 A 55 55 GLU CB C 55 32.891 31.892 0.999 1
1 690 . 4 1 1 A 55 55 GLU N N 55 121.431 123.323 -1.892 1
1 691 . 4 1 1 A 56 56 LYS H H 56 8.513 8.705 -0.192 1
1 692 . 4 1 1 A 56 56 LYS HA H 56 4.151 4.634 -0.483 1
1 701 . 4 1 1 A 56 56 LYS C C 56 176.270 175.444 0.826 1
1 702 . 4 1 1 A 56 56 LYS CA C 56 54.890 55.413 -0.523 1
1 703 . 4 1 1 A 56 56 LYS CB C 56 33.162 33.352 -0.190 1
1 707 . 4 1 1 A 56 56 LYS N N 56 126.539 124.829 1.710 1
1 708 . 4 1 1 A 57 57 VAL H H 57 8.279 9.185 -0.906 1
1 709 . 4 1 1 A 57 57 VAL HA H 57 3.820 4.494 -0.674 1
1 717 . 4 1 1 A 57 57 VAL C C 57 175.108 173.965 1.143 1
1 718 . 4 1 1 A 57 57 VAL CA C 57 62.834 61.465 1.369 1
1 719 . 4 1 1 A 57 57 VAL CB C 57 32.549 32.630 -0.081 1
1 722 . 4 1 1 A 57 57 VAL N N 57 126.540 125.414 1.126 1
1 723 . 4 1 1 A 58 58 ASN H H 58 8.383 8.767 -0.384 1
1 724 . 4 1 1 A 58 58 ASN HA H 58 4.612 4.796 -0.184 1
1 729 . 4 1 1 A 58 58 ASN C C 58 174.772 175.943 -1.171 1
1 730 . 4 1 1 A 58 58 ASN CA C 58 52.575 51.635 0.940 1
1 731 . 4 1 1 A 58 58 ASN CB C 58 38.502 38.287 0.215 1
1 733 . 4 1 1 A 58 58 ASN N N 58 121.767 126.950 -5.183 1
1 735 . 4 1 1 A 59 59 ALA H H 59 8.165 8.721 -0.556 1
1 736 . 4 1 1 A 59 59 ALA HA H 59 4.251 4.128 0.123 1
1 740 . 4 1 1 A 59 59 ALA C C 59 177.478 177.012 0.466 1
1 741 . 4 1 1 A 59 59 ALA CA C 59 52.490 52.522 -0.032 1
1 742 . 4 1 1 A 59 59 ALA CB C 59 19.724 19.175 0.549 1
1 743 . 4 1 1 A 59 59 ALA N N 59 125.082 128.385 -3.303 1
1 744 . 4 1 1 A 60 60 GLY H H 60 8.291 7.247 1.044 1
1 745 . 4 1 1 A 60 60 GLY HA2 H 60 4.165 4.060 0.105 1
1 746 . 4 1 1 A 60 60 GLY HA3 H 60 3.853 4.061 -0.208 1
1 747 . 4 1 1 A 60 60 GLY C C 60 174.171 171.783 2.388 1
1 748 . 4 1 1 A 60 60 GLY CA C 60 44.994 45.572 -0.578 1
1 749 . 4 1 1 A 60 60 GLY N N 60 108.518 104.104 4.414 1
1 750 . 4 1 1 A 61 61 LYS H H 61 8.189 8.548 -0.359 1
1 751 . 4 1 1 A 61 61 LYS HA H 61 4.320 4.278 0.042 1
1 760 . 4 1 1 A 61 61 LYS C C 61 177.712 177.079 0.633 1
1 761 . 4 1 1 A 61 61 LYS CA C 61 56.832 57.088 -0.256 1
1 762 . 4 1 1 A 61 61 LYS CB C 61 32.641 31.443 1.198 1
1 766 . 4 1 1 A 61 61 LYS N N 61 120.532 120.774 -0.242 1
1 767 . 4 1 1 A 62 62 GLY H H 62 8.767 8.169 0.598 1
1 768 . 4 1 1 A 62 62 GLY HA2 H 62 4.021 4.017 0.004 1
1 769 . 4 1 1 A 62 62 GLY HA3 H 62 3.849 4.018 -0.169 1
1 770 . 4 1 1 A 62 62 GLY C C 62 173.782 174.592 -0.810 1
1 771 . 4 1 1 A 62 62 GLY CA C 62 45.844 45.326 0.518 1
1 772 . 4 1 1 A 62 62 GLY N N 62 111.547 112.729 -1.182 1
1 773 . 4 1 1 A 63 63 VAL H H 63 7.379 7.239 0.140 1
1 774 . 4 1 1 A 63 63 VAL HA H 63 4.591 4.277 0.314 1
1 782 . 4 1 1 A 63 63 VAL C C 63 174.262 175.818 -1.556 1
1 783 . 4 1 1 A 63 63 VAL CA C 63 59.292 60.647 -1.355 1
1 784 . 4 1 1 A 63 63 VAL CB C 63 32.726 31.317 1.409 1
1 787 . 4 1 1 A 63 63 VAL N N 63 117.546 118.996 -1.450 1
1 788 . 4 1 1 A 64 64 PRO HA H 64 4.458 4.404 0.054 1
1 795 . 4 1 1 A 64 64 PRO C C 64 177.166 176.487 0.679 1
1 796 . 4 1 1 A 64 64 PRO CA C 64 63.661 64.704 -1.043 1
1 797 . 4 1 1 A 64 64 PRO CB C 64 32.321 31.966 0.355 1
1 800 . 4 1 1 A 65 65 GLY H H 65 8.463 7.179 1.284 1
1 801 . 4 1 1 A 65 65 GLY HA2 H 65 3.882 3.722 0.160 1
1 802 . 4 1 1 A 65 65 GLY HA3 H 65 3.602 3.828 -0.226 1
1 803 . 4 1 1 A 65 65 GLY C C 65 172.406 171.956 0.450 1
1 804 . 4 1 1 A 65 65 GLY CA C 65 45.933 45.429 0.504 1
1 805 . 4 1 1 A 65 65 GLY N N 65 109.819 104.215 5.604 1
1 806 . 4 1 1 A 66 66 LEU H H 66 7.534 8.732 -1.198 1
1 807 . 4 1 1 A 66 66 LEU HA H 66 4.940 4.447 0.493 1
1 817 . 4 1 1 A 66 66 LEU C C 66 176.237 176.281 -0.044 1
1 818 . 4 1 1 A 66 66 LEU CA C 66 53.687 53.915 -0.228 1
1 819 . 4 1 1 A 66 66 LEU CB C 66 46.108 42.717 3.391 1
1 823 . 4 1 1 A 66 66 LEU N N 66 122.249 125.753 -3.504 1
1 824 . 4 1 1 A 67 67 TRP H H 67 8.916 8.775 0.141 1
1 825 . 4 1 1 A 67 67 TRP HA H 67 5.526 5.290 0.236 1
1 834 . 4 1 1 A 67 67 TRP C C 67 175.670 175.637 0.033 1
1 835 . 4 1 1 A 67 67 TRP CA C 67 56.241 55.834 0.407 1
1 836 . 4 1 1 A 67 67 TRP CB C 67 33.314 31.289 2.025 1
1 842 . 4 1 1 A 67 67 TRP N N 67 121.160 123.136 -1.976 1
1 844 . 4 1 1 A 68 68 ARG H H 68 8.772 8.850 -0.078 1
1 845 . 4 1 1 A 68 68 ARG HA H 68 4.832 4.999 -0.167 1
1 853 . 4 1 1 A 68 68 ARG C C 68 174.720 174.992 -0.272 1
1 854 . 4 1 1 A 68 68 ARG CA C 68 54.690 53.874 0.816 1
1 855 . 4 1 1 A 68 68 ARG CB C 68 35.176 34.344 0.832 1
1 858 . 4 1 1 A 68 68 ARG N N 68 117.471 121.960 -4.489 1
1 860 . 4 1 1 A 69 69 LEU H H 69 9.355 8.492 0.863 1
1 861 . 4 1 1 A 69 69 LEU HA H 69 4.557 5.178 -0.621 1
1 871 . 4 1 1 A 69 69 LEU C C 69 177.180 176.281 0.899 1
1 872 . 4 1 1 A 69 69 LEU CA C 69 55.780 52.493 3.287 1
1 873 . 4 1 1 A 69 69 LEU CB C 69 42.736 45.291 -2.555 1
1 877 . 4 1 1 A 69 69 LEU N N 69 125.211 117.881 7.330 1
1 878 . 4 1 1 A 70 70 LEU H H 70 8.058 8.481 -0.423 1
1 879 . 4 1 1 A 70 70 LEU HA H 70 4.364 4.233 0.131 1
1 889 . 4 1 1 A 70 70 LEU C C 70 176.808 176.141 0.667 1
1 890 . 4 1 1 A 70 70 LEU CA C 70 55.257 54.667 0.590 1
1 891 . 4 1 1 A 70 70 LEU CB C 70 42.413 40.742 1.671 1
1 895 . 4 1 1 A 70 70 LEU N N 70 125.525 120.621 4.904 1
1 1 . 5 1 1 A 2 2 SER HA H 2 4.126 4.197 -0.071 1
1 4 . 5 1 1 A 2 2 SER CA C 2 57.564 59.242 -1.678 1
1 5 . 5 1 1 A 2 2 SER CB C 2 63.953 62.782 1.171 1
1 6 . 5 1 1 A 3 3 GLU HA H 3 4.408 4.273 0.135 1
1 11 . 5 1 1 A 3 3 GLU C C 3 176.658 177.523 -0.865 1
1 12 . 5 1 1 A 3 3 GLU CA C 3 56.802 56.392 0.410 1
1 13 . 5 1 1 A 3 3 GLU CB C 3 30.674 29.161 1.513 1
1 15 . 5 1 1 A 4 4 SER H H 4 8.650 7.908 0.742 1
1 16 . 5 1 1 A 4 4 SER HA H 4 4.463 4.074 0.389 1
1 19 . 5 1 1 A 4 4 SER C C 4 175.949 175.846 0.103 1
1 20 . 5 1 1 A 4 4 SER CA C 4 58.557 62.555 -3.998 1
1 21 . 5 1 1 A 4 4 SER CB C 4 63.834 62.801 1.033 1
1 22 . 5 1 1 A 4 4 SER N N 4 118.042 118.028 0.014 1
1 23 . 5 1 1 A 5 5 ILE H H 5 8.404 7.969 0.435 1
1 24 . 5 1 1 A 5 5 ILE HA H 5 3.902 3.742 0.160 1
1 34 . 5 1 1 A 5 5 ILE C C 5 176.608 177.593 -0.985 1
1 35 . 5 1 1 A 5 5 ILE CA C 5 62.662 63.564 -0.902 1
1 36 . 5 1 1 A 5 5 ILE CB C 5 37.622 37.526 0.096 1
1 40 . 5 1 1 A 5 5 ILE N N 5 124.711 121.356 3.355 1
1 41 . 5 1 1 A 6 6 VAL H H 6 7.602 8.152 -0.550 1
1 42 . 5 1 1 A 6 6 VAL HA H 6 3.293 3.419 -0.126 1
1 50 . 5 1 1 A 6 6 VAL C C 6 177.088 178.236 -1.148 1
1 51 . 5 1 1 A 6 6 VAL CA C 6 67.180 66.148 1.032 1
1 52 . 5 1 1 A 6 6 VAL CB C 6 31.517 31.528 -0.011 1
1 55 . 5 1 1 A 6 6 VAL N N 6 119.974 121.133 -1.159 1
1 56 . 5 1 1 A 7 7 THR H H 7 7.515 7.886 -0.371 1
1 57 . 5 1 1 A 7 7 THR HA H 7 3.823 3.837 -0.014 1
1 62 . 5 1 1 A 7 7 THR C C 7 176.978 176.316 0.662 1
1 63 . 5 1 1 A 7 7 THR CA C 7 66.257 67.035 -0.778 1
1 64 . 5 1 1 A 7 7 THR CB C 7 68.410 68.516 -0.106 1
1 66 . 5 1 1 A 7 7 THR N N 7 114.177 117.042 -2.865 1
1 67 . 5 1 1 A 8 8 LYS H H 8 7.807 7.646 0.161 1
1 68 . 5 1 1 A 8 8 LYS HA H 8 4.066 4.227 -0.161 1
1 77 . 5 1 1 A 8 8 LYS C C 8 178.733 178.354 0.379 1
1 78 . 5 1 1 A 8 8 LYS CA C 8 59.338 59.727 -0.389 1
1 79 . 5 1 1 A 8 8 LYS CB C 8 32.002 32.015 -0.013 1
1 83 . 5 1 1 A 8 8 LYS N N 8 123.387 120.679 2.708 1
1 84 . 5 1 1 A 9 9 ILE H H 9 8.288 7.799 0.489 1
1 85 . 5 1 1 A 9 9 ILE HA H 9 3.421 3.570 -0.149 1
1 95 . 5 1 1 A 9 9 ILE C C 9 177.187 178.522 -1.335 1
1 96 . 5 1 1 A 9 9 ILE CA C 9 65.772 65.869 -0.097 1
1 97 . 5 1 1 A 9 9 ILE CB C 9 37.183 37.928 -0.745 1
1 101 . 5 1 1 A 9 9 ILE N N 9 119.543 118.671 0.872 1
1 102 . 5 1 1 A 10 10 ILE H H 10 8.073 8.269 -0.196 1
1 103 . 5 1 1 A 10 10 ILE HA H 10 3.305 3.492 -0.187 1
1 113 . 5 1 1 A 10 10 ILE C C 10 177.308 178.080 -0.772 1
1 114 . 5 1 1 A 10 10 ILE CA C 10 66.704 65.196 1.508 1
1 115 . 5 1 1 A 10 10 ILE CB C 10 37.840 37.762 0.078 1
1 119 . 5 1 1 A 10 10 ILE N N 10 119.219 120.605 -1.386 1
1 120 . 5 1 1 A 11 11 SER H H 11 7.861 8.168 -0.307 1
1 121 . 5 1 1 A 11 11 SER HA H 11 4.250 4.261 -0.011 1
1 124 . 5 1 1 A 11 11 SER C C 11 176.918 177.509 -0.591 1
1 125 . 5 1 1 A 11 11 SER CA C 11 61.911 61.169 0.742 1
1 126 . 5 1 1 A 11 11 SER CB C 11 62.998 62.934 0.064 1
1 127 . 5 1 1 A 11 11 SER N N 11 113.959 114.645 -0.686 1
1 128 . 5 1 1 A 12 12 ILE H H 12 8.250 7.787 0.463 1
1 129 . 5 1 1 A 12 12 ILE HA H 12 3.801 3.806 -0.005 1
1 139 . 5 1 1 A 12 12 ILE C C 12 178.130 178.133 -0.003 1
1 140 . 5 1 1 A 12 12 ILE CA C 12 65.023 63.620 1.403 1
1 141 . 5 1 1 A 12 12 ILE CB C 12 38.195 37.738 0.457 1
1 145 . 5 1 1 A 12 12 ILE N N 12 123.767 122.900 0.867 1
1 146 . 5 1 1 A 13 13 VAL H H 13 8.308 7.749 0.559 1
1 147 . 5 1 1 A 13 13 VAL HA H 13 3.435 3.843 -0.408 1
1 155 . 5 1 1 A 13 13 VAL C C 13 177.283 177.876 -0.593 1
1 156 . 5 1 1 A 13 13 VAL CA C 13 67.693 64.305 3.388 1
1 157 . 5 1 1 A 13 13 VAL CB C 13 31.139 31.474 -0.335 1
1 160 . 5 1 1 A 13 13 VAL N N 13 120.066 119.092 0.974 1
1 161 . 5 1 1 A 14 14 GLN H H 14 8.612 8.146 0.466 1
1 162 . 5 1 1 A 14 14 GLN HA H 14 3.831 3.977 -0.146 1
1 169 . 5 1 1 A 14 14 GLN C C 14 178.256 177.939 0.317 1
1 170 . 5 1 1 A 14 14 GLN CA C 14 59.660 59.264 0.396 1
1 171 . 5 1 1 A 14 14 GLN CB C 14 29.456 28.312 1.144 1
1 174 . 5 1 1 A 14 14 GLN N N 14 118.099 119.704 -1.605 1
1 176 . 5 1 1 A 15 15 GLU H H 15 8.378 8.396 -0.018 1
1 177 . 5 1 1 A 15 15 GLU HA H 15 4.110 4.008 0.102 1
1 182 . 5 1 1 A 15 15 GLU C C 15 179.659 179.168 0.491 1
1 183 . 5 1 1 A 15 15 GLU CA C 15 59.476 59.694 -0.218 1
1 184 . 5 1 1 A 15 15 GLU CB C 15 29.725 29.259 0.466 1
1 186 . 5 1 1 A 15 15 GLU N N 15 118.580 119.257 -0.677 1
1 187 . 5 1 1 A 16 16 ARG H H 16 8.439 8.313 0.126 1
1 188 . 5 1 1 A 16 16 ARG HA H 16 4.157 4.123 0.034 1
1 196 . 5 1 1 A 16 16 ARG C C 16 179.276 178.589 0.687 1
1 197 . 5 1 1 A 16 16 ARG CA C 16 58.141 59.783 -1.642 1
1 198 . 5 1 1 A 16 16 ARG CB C 16 29.434 29.830 -0.396 1
1 201 . 5 1 1 A 16 16 ARG N N 16 118.688 119.047 -0.359 1
1 203 . 5 1 1 A 17 17 GLN H H 17 8.861 7.645 1.216 1
1 204 . 5 1 1 A 17 17 GLN HA H 17 4.236 4.363 -0.127 1
1 211 . 5 1 1 A 17 17 GLN C C 17 178.736 177.788 0.948 1
1 212 . 5 1 1 A 17 17 GLN CA C 17 59.683 57.871 1.812 1
1 213 . 5 1 1 A 17 17 GLN CB C 17 29.960 28.667 1.293 1
1 216 . 5 1 1 A 17 17 GLN N N 17 120.427 118.279 2.148 1
1 218 . 5 1 1 A 18 18 ASN H H 18 8.017 8.062 -0.045 1
1 219 . 5 1 1 A 18 18 ASN HA H 18 4.605 4.572 0.033 1
1 224 . 5 1 1 A 18 18 ASN C C 18 177.906 177.861 0.045 1
1 225 . 5 1 1 A 18 18 ASN CA C 18 55.375 55.726 -0.351 1
1 226 . 5 1 1 A 18 18 ASN CB C 18 38.383 38.571 -0.188 1
1 228 . 5 1 1 A 18 18 ASN N N 18 117.033 117.941 -0.908 1
1 230 . 5 1 1 A 19 19 MET H H 19 7.994 8.379 -0.385 1
1 231 . 5 1 1 A 19 19 MET HA H 19 4.372 4.226 0.146 1
1 236 . 5 1 1 A 19 19 MET C C 19 176.518 176.595 -0.077 1
1 237 . 5 1 1 A 19 19 MET CA C 19 57.623 58.061 -0.438 1
1 238 . 5 1 1 A 19 19 MET CB C 19 33.248 33.189 0.059 1
1 240 . 5 1 1 A 19 19 MET N N 19 119.320 119.082 0.238 1
1 241 . 5 1 1 A 20 20 ASP H H 20 7.800 8.271 -0.471 1
1 242 . 5 1 1 A 20 20 ASP HA H 20 4.990 4.779 0.211 1
1 245 . 5 1 1 A 20 20 ASP C C 20 176.082 175.029 1.053 1
1 246 . 5 1 1 A 20 20 ASP CA C 20 53.796 53.808 -0.012 1
1 247 . 5 1 1 A 20 20 ASP CB C 20 40.409 40.164 0.245 1
1 248 . 5 1 1 A 20 20 ASP N N 20 119.127 119.258 -0.131 1
1 249 . 5 1 1 A 21 21 ASP H H 21 8.136 8.843 -0.707 1
1 250 . 5 1 1 A 21 21 ASP HA H 21 4.497 4.225 0.272 1
1 253 . 5 1 1 A 21 21 ASP C C 21 176.264 177.265 -1.001 1
1 254 . 5 1 1 A 21 21 ASP CA C 21 55.508 56.075 -0.567 1
1 255 . 5 1 1 A 21 21 ASP CB C 21 40.063 40.309 -0.246 1
1 256 . 5 1 1 A 21 21 ASP N N 21 118.276 125.844 -7.568 1
1 257 . 5 1 1 A 22 22 GLY H H 22 8.728 8.379 0.349 1
1 258 . 5 1 1 A 22 22 GLY HA2 H 22 4.189 3.874 0.315 1
1 259 . 5 1 1 A 22 22 GLY HA3 H 22 3.683 3.878 -0.195 1
1 260 . 5 1 1 A 22 22 GLY C C 22 174.304 174.271 0.033 1
1 261 . 5 1 1 A 22 22 GLY CA C 22 45.629 46.721 -1.092 1
1 262 . 5 1 1 A 22 22 GLY N N 22 105.878 112.627 -6.749 1
1 263 . 5 1 1 A 23 23 ALA H H 23 7.473 7.860 -0.387 1
1 264 . 5 1 1 A 23 23 ALA HA H 23 4.519 4.677 -0.158 1
1 268 . 5 1 1 A 23 23 ALA C C 23 174.065 175.819 -1.754 1
1 269 . 5 1 1 A 23 23 ALA CA C 23 51.142 49.986 1.156 1
1 270 . 5 1 1 A 23 23 ALA CB C 23 18.283 20.048 -1.765 1
1 271 . 5 1 1 A 23 23 ALA N N 23 125.323 123.405 1.918 1
1 272 . 5 1 1 A 24 24 PRO HA H 24 4.590 4.574 0.016 1
1 279 . 5 1 1 A 24 24 PRO C C 24 175.253 177.144 -1.891 1
1 280 . 5 1 1 A 24 24 PRO CA C 24 62.186 63.112 -0.926 1
1 281 . 5 1 1 A 24 24 PRO CB C 24 32.931 32.264 0.667 1
1 284 . 5 1 1 A 25 25 VAL H H 25 9.334 8.691 0.643 1
1 285 . 5 1 1 A 25 25 VAL HA H 25 4.378 4.292 0.086 1
1 293 . 5 1 1 A 25 25 VAL C C 25 176.439 175.929 0.510 1
1 294 . 5 1 1 A 25 25 VAL CA C 25 61.482 62.737 -1.255 1
1 295 . 5 1 1 A 25 25 VAL CB C 25 34.781 32.385 2.396 1
1 298 . 5 1 1 A 25 25 VAL N N 25 120.408 123.054 -2.646 1
1 299 . 5 1 1 A 26 26 LYS H H 26 9.300 8.921 0.379 1
1 300 . 5 1 1 A 26 26 LYS HA H 26 4.982 4.677 0.305 1
1 309 . 5 1 1 A 26 26 LYS C C 26 179.008 178.046 0.962 1
1 310 . 5 1 1 A 26 26 LYS CA C 26 56.908 54.725 2.183 1
1 311 . 5 1 1 A 26 26 LYS CB C 26 34.071 34.485 -0.414 1
1 315 . 5 1 1 A 26 26 LYS N N 26 126.177 124.995 1.182 1
1 316 . 5 1 1 A 27 27 THR H H 27 8.618 9.089 -0.471 1
1 317 . 5 1 1 A 27 27 THR HA H 27 3.662 4.000 -0.338 1
1 322 . 5 1 1 A 27 27 THR C C 27 176.442 176.453 -0.011 1
1 323 . 5 1 1 A 27 27 THR CA C 27 67.591 66.135 1.456 1
1 324 . 5 1 1 A 27 27 THR CB C 27 68.868 68.933 -0.065 1
1 326 . 5 1 1 A 27 27 THR N N 27 119.020 117.453 1.567 1
1 327 . 5 1 1 A 28 28 ARG H H 28 9.288 8.194 1.094 1
1 328 . 5 1 1 A 28 28 ARG HA H 28 3.879 4.077 -0.198 1
1 335 . 5 1 1 A 28 28 ARG C C 28 176.884 178.938 -2.054 1
1 336 . 5 1 1 A 28 28 ARG CA C 28 59.431 59.684 -0.253 1
1 337 . 5 1 1 A 28 28 ARG CB C 28 29.953 30.335 -0.382 1
1 340 . 5 1 1 A 28 28 ARG N N 28 119.100 121.429 -2.329 1
1 341 . 5 1 1 A 29 29 ASP H H 29 6.907 8.228 -1.321 1
1 342 . 5 1 1 A 29 29 ASP HA H 29 4.550 4.337 0.213 1
1 345 . 5 1 1 A 29 29 ASP C C 29 179.050 178.915 0.135 1
1 346 . 5 1 1 A 29 29 ASP CA C 29 57.262 57.224 0.038 1
1 347 . 5 1 1 A 29 29 ASP CB C 29 40.191 40.572 -0.381 1
1 348 . 5 1 1 A 29 29 ASP N N 29 117.490 119.595 -2.105 1
1 349 . 5 1 1 A 30 30 ILE H H 30 7.554 7.732 -0.178 1
1 350 . 5 1 1 A 30 30 ILE HA H 30 3.595 3.773 -0.178 1
1 360 . 5 1 1 A 30 30 ILE C C 30 176.907 177.997 -1.090 1
1 361 . 5 1 1 A 30 30 ILE CA C 30 65.002 65.749 -0.747 1
1 362 . 5 1 1 A 30 30 ILE CB C 30 37.999 37.899 0.100 1
1 366 . 5 1 1 A 30 30 ILE N N 30 120.978 120.137 0.841 1
1 367 . 5 1 1 A 31 31 ALA H H 31 8.269 8.282 -0.013 1
1 368 . 5 1 1 A 31 31 ALA HA H 31 3.720 4.036 -0.316 1
1 372 . 5 1 1 A 31 31 ALA C C 31 179.170 179.931 -0.761 1
1 373 . 5 1 1 A 31 31 ALA CA C 31 56.354 55.794 0.560 1
1 374 . 5 1 1 A 31 31 ALA CB C 31 17.843 18.324 -0.481 1
1 375 . 5 1 1 A 31 31 ALA N N 31 121.171 122.784 -1.613 1
1 376 . 5 1 1 A 32 32 ASP H H 32 8.293 8.483 -0.190 1
1 377 . 5 1 1 A 32 32 ASP HA H 32 4.422 4.417 0.005 1
1 380 . 5 1 1 A 32 32 ASP C C 32 179.136 178.328 0.808 1
1 381 . 5 1 1 A 32 32 ASP CA C 32 57.109 56.813 0.296 1
1 382 . 5 1 1 A 32 32 ASP CB C 32 40.523 40.379 0.144 1
1 383 . 5 1 1 A 32 32 ASP N N 32 116.467 119.153 -2.686 1
1 384 . 5 1 1 A 33 33 ALA H H 33 7.536 8.341 -0.805 1
1 385 . 5 1 1 A 33 33 ALA HA H 33 4.222 4.030 0.192 1
1 389 . 5 1 1 A 33 33 ALA C C 33 179.056 179.700 -0.644 1
1 390 . 5 1 1 A 33 33 ALA CA C 33 54.469 54.863 -0.394 1
1 391 . 5 1 1 A 33 33 ALA CB C 33 19.085 18.150 0.935 1
1 392 . 5 1 1 A 33 33 ALA N N 33 120.859 123.041 -2.182 1
1 393 . 5 1 1 A 34 34 ALA H H 34 8.296 7.570 0.726 1
1 394 . 5 1 1 A 34 34 ALA HA H 34 4.101 4.321 -0.220 1
1 398 . 5 1 1 A 34 34 ALA C C 34 176.912 177.904 -0.992 1
1 399 . 5 1 1 A 34 34 ALA CA C 34 52.380 52.268 0.112 1
1 400 . 5 1 1 A 34 34 ALA CB C 34 18.817 19.915 -1.098 1
1 401 . 5 1 1 A 34 34 ALA N N 34 118.203 117.368 0.835 1
1 402 . 5 1 1 A 35 35 GLY H H 35 7.911 8.445 -0.534 1
1 403 . 5 1 1 A 35 35 GLY HA2 H 35 3.968 3.924 0.044 1
1 404 . 5 1 1 A 35 35 GLY HA3 H 35 3.968 3.928 0.040 1
1 405 . 5 1 1 A 35 35 GLY C C 35 174.374 174.112 0.262 1
1 406 . 5 1 1 A 35 35 GLY CA C 35 46.388 46.025 0.363 1
1 407 . 5 1 1 A 35 35 GLY N N 35 107.752 107.776 -0.024 1
1 408 . 5 1 1 A 36 36 LEU H H 36 7.758 7.812 -0.054 1
1 409 . 5 1 1 A 36 36 LEU HA H 36 4.887 4.844 0.043 1
1 419 . 5 1 1 A 36 36 LEU C C 36 175.941 175.698 0.243 1
1 420 . 5 1 1 A 36 36 LEU CA C 36 52.443 53.106 -0.663 1
1 421 . 5 1 1 A 36 36 LEU CB C 36 47.885 43.742 4.143 1
1 425 . 5 1 1 A 36 36 LEU N N 36 118.719 121.477 -2.758 1
1 426 . 5 1 1 A 37 37 SER H H 37 8.603 8.855 -0.252 1
1 427 . 5 1 1 A 37 37 SER HA H 37 4.565 4.566 -0.001 1
1 430 . 5 1 1 A 37 37 SER C C 37 175.512 175.674 -0.162 1
1 431 . 5 1 1 A 37 37 SER CA C 37 57.262 58.725 -1.463 1
1 432 . 5 1 1 A 37 37 SER CB C 37 65.155 63.676 1.479 1
1 433 . 5 1 1 A 37 37 SER N N 37 115.095 116.055 -0.960 1
1 434 . 5 1 1 A 38 38 ILE H H 38 8.822 8.822 0.000 1
1 435 . 5 1 1 A 38 38 ILE HA H 38 3.650 3.796 -0.146 1
1 445 . 5 1 1 A 38 38 ILE C C 38 176.849 177.480 -0.631 1
1 446 . 5 1 1 A 38 38 ILE CA C 38 64.557 65.077 -0.520 1
1 447 . 5 1 1 A 38 38 ILE CB C 38 37.451 38.005 -0.554 1
1 451 . 5 1 1 A 38 38 ILE N N 38 122.026 124.773 -2.747 1
1 452 . 5 1 1 A 39 39 TYR H H 39 7.839 8.516 -0.677 1
1 453 . 5 1 1 A 39 39 TYR HA H 39 4.112 4.000 0.112 1
1 460 . 5 1 1 A 39 39 TYR C C 39 177.703 177.353 0.350 1
1 461 . 5 1 1 A 39 39 TYR CA C 39 60.856 61.883 -1.027 1
1 462 . 5 1 1 A 39 39 TYR CB C 39 38.402 38.676 -0.274 1
1 467 . 5 1 1 A 39 39 TYR N N 39 118.759 120.541 -1.782 1
1 468 . 5 1 1 A 40 40 GLN H H 40 7.687 8.273 -0.586 1
1 469 . 5 1 1 A 40 40 GLN HA H 40 3.865 3.773 0.092 1
1 476 . 5 1 1 A 40 40 GLN C C 40 178.735 178.123 0.612 1
1 477 . 5 1 1 A 40 40 GLN CA C 40 58.089 58.647 -0.558 1
1 478 . 5 1 1 A 40 40 GLN CB C 40 29.950 28.683 1.267 1
1 481 . 5 1 1 A 40 40 GLN N N 40 116.772 118.778 -2.006 1
1 483 . 5 1 1 A 41 41 VAL H H 41 8.494 8.399 0.095 1
1 484 . 5 1 1 A 41 41 VAL HA H 41 3.835 3.752 0.083 1
1 492 . 5 1 1 A 41 41 VAL C C 41 176.977 177.926 -0.949 1
1 493 . 5 1 1 A 41 41 VAL CA C 41 66.102 67.169 -1.067 1
1 494 . 5 1 1 A 41 41 VAL CB C 41 31.105 31.601 -0.496 1
1 497 . 5 1 1 A 41 41 VAL N N 41 117.192 119.724 -2.532 1
1 498 . 5 1 1 A 42 42 ARG H H 42 8.179 8.405 -0.226 1
1 499 . 5 1 1 A 42 42 ARG HA H 42 3.708 4.019 -0.311 1
1 506 . 5 1 1 A 42 42 ARG C C 42 177.570 178.328 -0.758 1
1 507 . 5 1 1 A 42 42 ARG CA C 42 60.349 59.519 0.830 1
1 508 . 5 1 1 A 42 42 ARG CB C 42 30.047 29.877 0.170 1
1 511 . 5 1 1 A 42 42 ARG N N 42 120.574 120.131 0.443 1
1 512 . 5 1 1 A 43 43 LEU H H 43 6.982 7.857 -0.875 1
1 513 . 5 1 1 A 43 43 LEU HA H 43 3.939 3.833 0.106 1
1 523 . 5 1 1 A 43 43 LEU C C 43 180.397 178.694 1.703 1
1 524 . 5 1 1 A 43 43 LEU CA C 43 58.119 57.754 0.365 1
1 525 . 5 1 1 A 43 43 LEU CB C 43 41.294 41.164 0.130 1
1 529 . 5 1 1 A 43 43 LEU N N 43 117.189 119.699 -2.510 1
1 530 . 5 1 1 A 44 44 TYR H H 44 7.026 7.579 -0.553 1
1 531 . 5 1 1 A 44 44 TYR HA H 44 4.253 4.256 -0.003 1
1 538 . 5 1 1 A 44 44 TYR C C 44 178.411 178.271 0.140 1
1 539 . 5 1 1 A 44 44 TYR CA C 44 60.941 60.748 0.193 1
1 540 . 5 1 1 A 44 44 TYR CB C 44 38.889 38.205 0.684 1
1 545 . 5 1 1 A 44 44 TYR N N 44 117.020 117.988 -0.968 1
1 546 . 5 1 1 A 45 45 LEU H H 45 8.429 8.606 -0.177 1
1 547 . 5 1 1 A 45 45 LEU HA H 45 3.486 3.597 -0.111 1
1 557 . 5 1 1 A 45 45 LEU C C 45 178.648 179.006 -0.358 1
1 558 . 5 1 1 A 45 45 LEU CA C 45 57.915 57.652 0.263 1
1 559 . 5 1 1 A 45 45 LEU CB C 45 39.073 40.636 -1.563 1
1 563 . 5 1 1 A 45 45 LEU N N 45 119.649 120.076 -0.427 1
1 564 . 5 1 1 A 46 46 GLU H H 46 8.309 8.494 -0.185 1
1 565 . 5 1 1 A 46 46 GLU HA H 46 4.286 4.066 0.220 1
1 570 . 5 1 1 A 46 46 GLU C C 46 179.577 179.719 -0.142 1
1 571 . 5 1 1 A 46 46 GLU CA C 46 59.570 59.907 -0.337 1
1 572 . 5 1 1 A 46 46 GLU CB C 46 29.034 29.509 -0.475 1
1 574 . 5 1 1 A 46 46 GLU N N 46 117.366 118.165 -0.799 1
1 575 . 5 1 1 A 47 47 GLN H H 47 7.493 7.586 -0.093 1
1 576 . 5 1 1 A 47 47 GLN HA H 47 4.243 4.121 0.122 1
1 583 . 5 1 1 A 47 47 GLN C C 47 178.870 179.349 -0.479 1
1 584 . 5 1 1 A 47 47 GLN CA C 47 59.581 58.653 0.928 1
1 585 . 5 1 1 A 47 47 GLN CB C 47 28.300 28.311 -0.011 1
1 588 . 5 1 1 A 47 47 GLN N N 47 119.345 118.836 0.509 1
1 590 . 5 1 1 A 48 48 LEU H H 48 8.160 8.336 -0.176 1
1 591 . 5 1 1 A 48 48 LEU HA H 48 4.211 4.088 0.123 1
1 601 . 5 1 1 A 48 48 LEU C C 48 180.111 178.919 1.192 1
1 602 . 5 1 1 A 48 48 LEU CA C 48 57.179 57.599 -0.420 1
1 603 . 5 1 1 A 48 48 LEU CB C 48 42.067 41.050 1.017 1
1 607 . 5 1 1 A 48 48 LEU N N 48 118.594 120.664 -2.070 1
1 608 . 5 1 1 A 49 49 HIS H H 49 8.864 8.221 0.643 1
1 609 . 5 1 1 A 49 49 HIS HA H 49 5.162 4.748 0.414 1
1 613 . 5 1 1 A 49 49 HIS C C 49 178.801 176.944 1.857 1
1 614 . 5 1 1 A 49 49 HIS CA C 49 58.397 59.276 -0.879 1
1 615 . 5 1 1 A 49 49 HIS CB C 49 29.631 29.930 -0.299 1
1 617 . 5 1 1 A 49 49 HIS N N 49 122.537 118.344 4.193 1
1 618 . 5 1 1 A 50 50 ASP H H 50 8.683 8.071 0.612 1
1 619 . 5 1 1 A 50 50 ASP HA H 50 4.356 4.311 0.045 1
1 622 . 5 1 1 A 50 50 ASP C C 50 178.474 178.414 0.060 1
1 623 . 5 1 1 A 50 50 ASP CA C 50 57.744 57.318 0.426 1
1 624 . 5 1 1 A 50 50 ASP CB C 50 40.575 41.095 -0.520 1
1 625 . 5 1 1 A 50 50 ASP N N 50 123.169 118.887 4.282 1
1 626 . 5 1 1 A 51 51 VAL H H 51 7.606 7.774 -0.168 1
1 627 . 5 1 1 A 51 51 VAL HA H 51 4.514 4.032 0.482 1
1 635 . 5 1 1 A 51 51 VAL C C 51 176.862 176.425 0.437 1
1 636 . 5 1 1 A 51 51 VAL CA C 51 61.590 63.248 -1.658 1
1 637 . 5 1 1 A 51 51 VAL CB C 51 31.423 32.639 -1.216 1
1 640 . 5 1 1 A 51 51 VAL N N 51 109.266 112.039 -2.773 1
1 641 . 5 1 1 A 52 52 GLY H H 52 7.696 7.817 -0.121 1
1 642 . 5 1 1 A 52 52 GLY HA2 H 52 4.172 3.943 0.229 1
1 643 . 5 1 1 A 52 52 GLY HA3 H 52 3.938 3.973 -0.035 1
1 644 . 5 1 1 A 52 52 GLY C C 52 174.276 174.483 -0.207 1
1 645 . 5 1 1 A 52 52 GLY CA C 52 46.228 46.416 -0.188 1
1 646 . 5 1 1 A 52 52 GLY N N 52 108.681 110.544 -1.863 1
1 647 . 5 1 1 A 53 53 VAL H H 53 8.046 8.278 -0.232 1
1 648 . 5 1 1 A 53 53 VAL HA H 53 4.079 4.210 -0.131 1
1 656 . 5 1 1 A 53 53 VAL C C 53 175.949 175.261 0.688 1
1 657 . 5 1 1 A 53 53 VAL CA C 53 64.063 63.787 0.276 1
1 658 . 5 1 1 A 53 53 VAL CB C 53 33.160 34.135 -0.975 1
1 661 . 5 1 1 A 53 53 VAL N N 53 117.892 116.375 1.517 1
1 662 . 5 1 1 A 54 54 LEU H H 54 6.835 7.549 -0.714 1
1 663 . 5 1 1 A 54 54 LEU HA H 54 5.348 5.037 0.311 1
1 673 . 5 1 1 A 54 54 LEU C C 54 175.713 175.394 0.319 1
1 674 . 5 1 1 A 54 54 LEU CA C 54 52.194 53.202 -1.008 1
1 675 . 5 1 1 A 54 54 LEU CB C 54 46.733 45.106 1.627 1
1 679 . 5 1 1 A 54 54 LEU N N 54 114.848 117.566 -2.718 1
1 680 . 5 1 1 A 55 55 GLU H H 55 9.549 9.389 0.160 1
1 681 . 5 1 1 A 55 55 GLU HA H 55 4.826 5.425 -0.599 1
1 686 . 5 1 1 A 55 55 GLU C C 55 174.661 175.266 -0.605 1
1 687 . 5 1 1 A 55 55 GLU CA C 55 54.637 55.152 -0.515 1
1 688 . 5 1 1 A 55 55 GLU CB C 55 32.891 32.991 -0.100 1
1 690 . 5 1 1 A 55 55 GLU N N 55 121.431 123.746 -2.315 1
1 691 . 5 1 1 A 56 56 LYS H H 56 8.513 8.702 -0.189 1
1 692 . 5 1 1 A 56 56 LYS HA H 56 4.151 4.049 0.102 1
1 701 . 5 1 1 A 56 56 LYS C C 56 176.270 174.837 1.433 1
1 702 . 5 1 1 A 56 56 LYS CA C 56 54.890 55.625 -0.735 1
1 703 . 5 1 1 A 56 56 LYS CB C 56 33.162 32.574 0.588 1
1 707 . 5 1 1 A 56 56 LYS N N 56 126.539 127.356 -0.817 1
1 708 . 5 1 1 A 57 57 VAL H H 57 8.279 8.541 -0.262 1
1 709 . 5 1 1 A 57 57 VAL HA H 57 3.820 4.179 -0.359 1
1 717 . 5 1 1 A 57 57 VAL C C 57 175.108 174.960 0.148 1
1 718 . 5 1 1 A 57 57 VAL CA C 57 62.834 62.860 -0.026 1
1 719 . 5 1 1 A 57 57 VAL CB C 57 32.549 30.938 1.611 1
1 722 . 5 1 1 A 57 57 VAL N N 57 126.540 127.256 -0.716 1
1 723 . 5 1 1 A 58 58 ASN H H 58 8.383 8.683 -0.300 1
1 724 . 5 1 1 A 58 58 ASN HA H 58 4.612 5.121 -0.509 1
1 729 . 5 1 1 A 58 58 ASN C C 58 174.772 174.950 -0.178 1
1 730 . 5 1 1 A 58 58 ASN CA C 58 52.575 51.879 0.696 1
1 731 . 5 1 1 A 58 58 ASN CB C 58 38.502 40.745 -2.243 1
1 733 . 5 1 1 A 58 58 ASN N N 58 121.767 126.788 -5.021 1
1 735 . 5 1 1 A 59 59 ALA H H 59 8.165 8.690 -0.525 1
1 736 . 5 1 1 A 59 59 ALA HA H 59 4.251 4.670 -0.419 1
1 740 . 5 1 1 A 59 59 ALA C C 59 177.478 176.207 1.271 1
1 741 . 5 1 1 A 59 59 ALA CA C 59 52.490 51.027 1.463 1
1 742 . 5 1 1 A 59 59 ALA CB C 59 19.724 19.999 -0.275 1
1 743 . 5 1 1 A 59 59 ALA N N 59 125.082 126.862 -1.780 1
1 744 . 5 1 1 A 60 60 GLY H H 60 8.291 7.305 0.986 1
1 745 . 5 1 1 A 60 60 GLY HA2 H 60 4.165 4.056 0.109 1
1 746 . 5 1 1 A 60 60 GLY HA3 H 60 3.853 4.056 -0.203 1
1 747 . 5 1 1 A 60 60 GLY C C 60 174.171 171.913 2.258 1
1 748 . 5 1 1 A 60 60 GLY CA C 60 44.994 45.081 -0.087 1
1 749 . 5 1 1 A 60 60 GLY N N 60 108.518 107.050 1.468 1
1 750 . 5 1 1 A 61 61 LYS H H 61 8.189 8.215 -0.026 1
1 751 . 5 1 1 A 61 61 LYS HA H 61 4.320 4.104 0.216 1
1 760 . 5 1 1 A 61 61 LYS C C 61 177.712 177.577 0.135 1
1 761 . 5 1 1 A 61 61 LYS CA C 61 56.832 57.632 -0.800 1
1 762 . 5 1 1 A 61 61 LYS CB C 61 32.641 32.246 0.395 1
1 766 . 5 1 1 A 61 61 LYS N N 61 120.532 120.474 0.058 1
1 767 . 5 1 1 A 62 62 GLY H H 62 8.767 8.841 -0.074 1
1 768 . 5 1 1 A 62 62 GLY HA2 H 62 4.021 3.873 0.148 1
1 769 . 5 1 1 A 62 62 GLY HA3 H 62 3.849 3.877 -0.028 1
1 770 . 5 1 1 A 62 62 GLY C C 62 173.782 173.929 -0.147 1
1 771 . 5 1 1 A 62 62 GLY CA C 62 45.844 46.837 -0.993 1
1 772 . 5 1 1 A 62 62 GLY N N 62 111.547 114.473 -2.926 1
1 773 . 5 1 1 A 63 63 VAL H H 63 7.379 7.658 -0.279 1
1 774 . 5 1 1 A 63 63 VAL HA H 63 4.591 4.774 -0.183 1
1 782 . 5 1 1 A 63 63 VAL C C 63 174.262 173.808 0.454 1
1 783 . 5 1 1 A 63 63 VAL CA C 63 59.292 58.186 1.106 1
1 784 . 5 1 1 A 63 63 VAL CB C 63 32.726 33.329 -0.603 1
1 787 . 5 1 1 A 63 63 VAL N N 63 117.546 113.851 3.695 1
1 788 . 5 1 1 A 64 64 PRO HA H 64 4.458 4.400 0.058 1
1 795 . 5 1 1 A 64 64 PRO C C 64 177.166 176.592 0.574 1
1 796 . 5 1 1 A 64 64 PRO CA C 64 63.661 63.498 0.163 1
1 797 . 5 1 1 A 64 64 PRO CB C 64 32.321 31.820 0.501 1
1 800 . 5 1 1 A 65 65 GLY H H 65 8.463 8.660 -0.197 1
1 801 . 5 1 1 A 65 65 GLY HA2 H 65 3.882 3.771 0.111 1
1 802 . 5 1 1 A 65 65 GLY HA3 H 65 3.602 3.790 -0.188 1
1 803 . 5 1 1 A 65 65 GLY C C 65 172.406 172.775 -0.369 1
1 804 . 5 1 1 A 65 65 GLY CA C 65 45.933 45.224 0.709 1
1 805 . 5 1 1 A 65 65 GLY N N 65 109.819 109.349 0.470 1
1 806 . 5 1 1 A 66 66 LEU H H 66 7.534 8.472 -0.938 1
1 807 . 5 1 1 A 66 66 LEU HA H 66 4.940 4.964 -0.024 1
1 817 . 5 1 1 A 66 66 LEU C C 66 176.237 175.999 0.238 1
1 818 . 5 1 1 A 66 66 LEU CA C 66 53.687 52.928 0.759 1
1 819 . 5 1 1 A 66 66 LEU CB C 66 46.108 44.817 1.291 1
1 823 . 5 1 1 A 66 66 LEU N N 66 122.249 126.362 -4.113 1
1 824 . 5 1 1 A 67 67 TRP H H 67 8.916 9.067 -0.151 1
1 825 . 5 1 1 A 67 67 TRP HA H 67 5.526 5.623 -0.097 1
1 834 . 5 1 1 A 67 67 TRP C C 67 175.670 176.264 -0.594 1
1 835 . 5 1 1 A 67 67 TRP CA C 67 56.241 55.584 0.657 1
1 836 . 5 1 1 A 67 67 TRP CB C 67 33.314 33.045 0.269 1
1 842 . 5 1 1 A 67 67 TRP N N 67 121.160 121.133 0.027 1
1 844 . 5 1 1 A 68 68 ARG H H 68 8.772 8.859 -0.087 1
1 845 . 5 1 1 A 68 68 ARG HA H 68 4.832 4.946 -0.114 1
1 853 . 5 1 1 A 68 68 ARG C C 68 174.720 176.327 -1.607 1
1 854 . 5 1 1 A 68 68 ARG CA C 68 54.690 54.813 -0.123 1
1 855 . 5 1 1 A 68 68 ARG CB C 68 35.176 32.791 2.385 1
1 858 . 5 1 1 A 68 68 ARG N N 68 117.471 122.532 -5.061 1
1 860 . 5 1 1 A 69 69 LEU H H 69 9.355 8.613 0.742 1
1 861 . 5 1 1 A 69 69 LEU HA H 69 4.557 4.582 -0.025 1
1 871 . 5 1 1 A 69 69 LEU C C 69 177.180 176.426 0.754 1
1 872 . 5 1 1 A 69 69 LEU CA C 69 55.780 54.391 1.389 1
1 873 . 5 1 1 A 69 69 LEU CB C 69 42.736 42.966 -0.230 1
1 877 . 5 1 1 A 69 69 LEU N N 69 125.211 123.418 1.793 1
1 878 . 5 1 1 A 70 70 LEU H H 70 8.058 8.902 -0.844 1
1 879 . 5 1 1 A 70 70 LEU HA H 70 4.364 4.586 -0.222 1
1 889 . 5 1 1 A 70 70 LEU C C 70 176.808 176.750 0.058 1
1 890 . 5 1 1 A 70 70 LEU CA C 70 55.257 54.192 1.065 1
1 891 . 5 1 1 A 70 70 LEU CB C 70 42.413 40.140 2.273 1
1 895 . 5 1 1 A 70 70 LEU N N 70 125.525 122.668 2.857 1
1 1 . 6 1 1 A 2 2 SER HA H 2 4.126 4.049 0.077 1
1 4 . 6 1 1 A 2 2 SER CA C 2 57.564 59.477 -1.913 1
1 5 . 6 1 1 A 2 2 SER CB C 2 63.953 62.816 1.137 1
1 6 . 6 1 1 A 3 3 GLU HA H 3 4.408 4.364 0.044 1
1 11 . 6 1 1 A 3 3 GLU C C 3 176.658 175.551 1.107 1
1 12 . 6 1 1 A 3 3 GLU CA C 3 56.802 55.341 1.461 1
1 13 . 6 1 1 A 3 3 GLU CB C 3 30.674 28.929 1.745 1
1 15 . 6 1 1 A 4 4 SER H H 4 8.650 7.931 0.719 1
1 16 . 6 1 1 A 4 4 SER HA H 4 4.463 5.029 -0.566 1
1 19 . 6 1 1 A 4 4 SER C C 4 175.949 174.535 1.414 1
1 20 . 6 1 1 A 4 4 SER CA C 4 58.557 56.456 2.101 1
1 21 . 6 1 1 A 4 4 SER CB C 4 63.834 64.460 -0.626 1
1 22 . 6 1 1 A 4 4 SER N N 4 118.042 118.156 -0.114 1
1 23 . 6 1 1 A 5 5 ILE H H 5 8.404 8.691 -0.287 1
1 24 . 6 1 1 A 5 5 ILE HA H 5 3.902 3.824 0.078 1
1 34 . 6 1 1 A 5 5 ILE C C 5 176.608 177.486 -0.878 1
1 35 . 6 1 1 A 5 5 ILE CA C 5 62.662 64.133 -1.471 1
1 36 . 6 1 1 A 5 5 ILE CB C 5 37.622 37.401 0.221 1
1 40 . 6 1 1 A 5 5 ILE N N 5 124.711 125.500 -0.789 1
1 41 . 6 1 1 A 6 6 VAL H H 6 7.602 8.068 -0.466 1
1 42 . 6 1 1 A 6 6 VAL HA H 6 3.293 3.332 -0.039 1
1 50 . 6 1 1 A 6 6 VAL C C 6 177.088 178.025 -0.937 1
1 51 . 6 1 1 A 6 6 VAL CA C 6 67.180 66.839 0.341 1
1 52 . 6 1 1 A 6 6 VAL CB C 6 31.517 31.610 -0.093 1
1 55 . 6 1 1 A 6 6 VAL N N 6 119.974 121.185 -1.211 1
1 56 . 6 1 1 A 7 7 THR H H 7 7.515 8.104 -0.589 1
1 57 . 6 1 1 A 7 7 THR HA H 7 3.823 3.877 -0.054 1
1 62 . 6 1 1 A 7 7 THR C C 7 176.978 176.336 0.642 1
1 63 . 6 1 1 A 7 7 THR CA C 7 66.257 67.029 -0.772 1
1 64 . 6 1 1 A 7 7 THR CB C 7 68.410 68.489 -0.079 1
1 66 . 6 1 1 A 7 7 THR N N 7 114.177 116.096 -1.919 1
1 67 . 6 1 1 A 8 8 LYS H H 8 7.807 7.684 0.123 1
1 68 . 6 1 1 A 8 8 LYS HA H 8 4.066 3.969 0.097 1
1 77 . 6 1 1 A 8 8 LYS C C 8 178.733 178.624 0.109 1
1 78 . 6 1 1 A 8 8 LYS CA C 8 59.338 59.344 -0.006 1
1 79 . 6 1 1 A 8 8 LYS CB C 8 32.002 32.310 -0.308 1
1 83 . 6 1 1 A 8 8 LYS N N 8 123.387 120.325 3.062 1
1 84 . 6 1 1 A 9 9 ILE H H 9 8.288 7.942 0.346 1
1 85 . 6 1 1 A 9 9 ILE HA H 9 3.421 3.560 -0.139 1
1 95 . 6 1 1 A 9 9 ILE C C 9 177.187 177.980 -0.793 1
1 96 . 6 1 1 A 9 9 ILE CA C 9 65.772 65.633 0.139 1
1 97 . 6 1 1 A 9 9 ILE CB C 9 37.183 37.782 -0.599 1
1 101 . 6 1 1 A 9 9 ILE N N 9 119.543 119.379 0.164 1
1 102 . 6 1 1 A 10 10 ILE H H 10 8.073 8.235 -0.162 1
1 103 . 6 1 1 A 10 10 ILE HA H 10 3.305 3.504 -0.199 1
1 113 . 6 1 1 A 10 10 ILE C C 10 177.308 177.914 -0.606 1
1 114 . 6 1 1 A 10 10 ILE CA C 10 66.704 65.347 1.357 1
1 115 . 6 1 1 A 10 10 ILE CB C 10 37.840 37.919 -0.079 1
1 119 . 6 1 1 A 10 10 ILE N N 10 119.219 121.017 -1.798 1
1 120 . 6 1 1 A 11 11 SER H H 11 7.861 7.881 -0.020 1
1 121 . 6 1 1 A 11 11 SER HA H 11 4.250 4.201 0.049 1
1 124 . 6 1 1 A 11 11 SER C C 11 176.918 176.423 0.495 1
1 125 . 6 1 1 A 11 11 SER CA C 11 61.911 62.339 -0.428 1
1 126 . 6 1 1 A 11 11 SER CB C 11 62.998 62.816 0.182 1
1 127 . 6 1 1 A 11 11 SER N N 11 113.959 115.837 -1.878 1
1 128 . 6 1 1 A 12 12 ILE H H 12 8.250 7.937 0.313 1
1 129 . 6 1 1 A 12 12 ILE HA H 12 3.801 3.639 0.162 1
1 139 . 6 1 1 A 12 12 ILE C C 12 178.130 178.066 0.064 1
1 140 . 6 1 1 A 12 12 ILE CA C 12 65.023 64.681 0.342 1
1 141 . 6 1 1 A 12 12 ILE CB C 12 38.195 37.825 0.370 1
1 145 . 6 1 1 A 12 12 ILE N N 12 123.767 121.728 2.039 1
1 146 . 6 1 1 A 13 13 VAL H H 13 8.308 7.934 0.374 1
1 147 . 6 1 1 A 13 13 VAL HA H 13 3.435 3.491 -0.056 1
1 155 . 6 1 1 A 13 13 VAL C C 13 177.283 178.084 -0.801 1
1 156 . 6 1 1 A 13 13 VAL CA C 13 67.693 66.781 0.912 1
1 157 . 6 1 1 A 13 13 VAL CB C 13 31.139 31.298 -0.159 1
1 160 . 6 1 1 A 13 13 VAL N N 13 120.066 119.588 0.478 1
1 161 . 6 1 1 A 14 14 GLN H H 14 8.612 7.865 0.747 1
1 162 . 6 1 1 A 14 14 GLN HA H 14 3.831 4.009 -0.178 1
1 169 . 6 1 1 A 14 14 GLN C C 14 178.256 178.078 0.178 1
1 170 . 6 1 1 A 14 14 GLN CA C 14 59.660 59.334 0.326 1
1 171 . 6 1 1 A 14 14 GLN CB C 14 29.456 28.125 1.331 1
1 174 . 6 1 1 A 14 14 GLN N N 14 118.099 119.683 -1.584 1
1 176 . 6 1 1 A 15 15 GLU H H 15 8.378 8.484 -0.106 1
1 177 . 6 1 1 A 15 15 GLU HA H 15 4.110 4.023 0.087 1
1 182 . 6 1 1 A 15 15 GLU C C 15 179.659 179.182 0.477 1
1 183 . 6 1 1 A 15 15 GLU CA C 15 59.476 59.511 -0.035 1
1 184 . 6 1 1 A 15 15 GLU CB C 15 29.725 29.127 0.598 1
1 186 . 6 1 1 A 15 15 GLU N N 15 118.580 119.174 -0.594 1
1 187 . 6 1 1 A 16 16 ARG H H 16 8.439 8.148 0.291 1
1 188 . 6 1 1 A 16 16 ARG HA H 16 4.157 4.118 0.039 1
1 196 . 6 1 1 A 16 16 ARG C C 16 179.276 178.709 0.567 1
1 197 . 6 1 1 A 16 16 ARG CA C 16 58.141 59.774 -1.633 1
1 198 . 6 1 1 A 16 16 ARG CB C 16 29.434 29.882 -0.448 1
1 201 . 6 1 1 A 16 16 ARG N N 16 118.688 119.254 -0.566 1
1 203 . 6 1 1 A 17 17 GLN H H 17 8.861 7.660 1.201 1
1 204 . 6 1 1 A 17 17 GLN HA H 17 4.236 4.419 -0.183 1
1 211 . 6 1 1 A 17 17 GLN C C 17 178.736 178.706 0.030 1
1 212 . 6 1 1 A 17 17 GLN CA C 17 59.683 58.197 1.486 1
1 213 . 6 1 1 A 17 17 GLN CB C 17 29.960 27.930 2.030 1
1 216 . 6 1 1 A 17 17 GLN N N 17 120.427 118.280 2.147 1
1 218 . 6 1 1 A 18 18 ASN H H 18 8.017 8.080 -0.063 1
1 219 . 6 1 1 A 18 18 ASN HA H 18 4.605 4.567 0.038 1
1 224 . 6 1 1 A 18 18 ASN C C 18 177.906 178.491 -0.585 1
1 225 . 6 1 1 A 18 18 ASN CA C 18 55.375 56.293 -0.918 1
1 226 . 6 1 1 A 18 18 ASN CB C 18 38.383 38.097 0.286 1
1 228 . 6 1 1 A 18 18 ASN N N 18 117.033 118.773 -1.740 1
1 230 . 6 1 1 A 19 19 MET H H 19 7.994 8.057 -0.063 1
1 231 . 6 1 1 A 19 19 MET HA H 19 4.372 4.231 0.141 1
1 236 . 6 1 1 A 19 19 MET C C 19 176.518 175.890 0.628 1
1 237 . 6 1 1 A 19 19 MET CA C 19 57.623 58.420 -0.797 1
1 238 . 6 1 1 A 19 19 MET CB C 19 33.248 33.177 0.071 1
1 240 . 6 1 1 A 19 19 MET N N 19 119.320 118.053 1.267 1
1 241 . 6 1 1 A 20 20 ASP H H 20 7.800 8.217 -0.417 1
1 242 . 6 1 1 A 20 20 ASP HA H 20 4.990 4.843 0.147 1
1 245 . 6 1 1 A 20 20 ASP C C 20 176.082 176.200 -0.118 1
1 246 . 6 1 1 A 20 20 ASP CA C 20 53.796 53.098 0.698 1
1 247 . 6 1 1 A 20 20 ASP CB C 20 40.409 42.573 -2.164 1
1 248 . 6 1 1 A 20 20 ASP N N 20 119.127 119.129 -0.002 1
1 249 . 6 1 1 A 21 21 ASP H H 21 8.136 8.942 -0.806 1
1 250 . 6 1 1 A 21 21 ASP HA H 21 4.497 4.302 0.195 1
1 253 . 6 1 1 A 21 21 ASP C C 21 176.264 177.408 -1.144 1
1 254 . 6 1 1 A 21 21 ASP CA C 21 55.508 57.513 -2.005 1
1 255 . 6 1 1 A 21 21 ASP CB C 21 40.063 40.815 -0.752 1
1 256 . 6 1 1 A 21 21 ASP N N 21 118.276 124.992 -6.716 1
1 257 . 6 1 1 A 22 22 GLY H H 22 8.728 7.952 0.776 1
1 258 . 6 1 1 A 22 22 GLY HA2 H 22 4.189 4.046 0.143 1
1 259 . 6 1 1 A 22 22 GLY HA3 H 22 3.683 4.049 -0.366 1
1 260 . 6 1 1 A 22 22 GLY C C 22 174.304 172.970 1.334 1
1 261 . 6 1 1 A 22 22 GLY CA C 22 45.629 46.023 -0.394 1
1 262 . 6 1 1 A 22 22 GLY N N 22 105.878 106.795 -0.917 1
1 263 . 6 1 1 A 23 23 ALA H H 23 7.473 7.618 -0.145 1
1 264 . 6 1 1 A 23 23 ALA HA H 23 4.519 4.669 -0.150 1
1 268 . 6 1 1 A 23 23 ALA C C 23 174.065 176.227 -2.162 1
1 269 . 6 1 1 A 23 23 ALA CA C 23 51.142 48.841 2.301 1
1 270 . 6 1 1 A 23 23 ALA CB C 23 18.283 20.429 -2.146 1
1 271 . 6 1 1 A 23 23 ALA N N 23 125.323 123.630 1.693 1
1 272 . 6 1 1 A 24 24 PRO HA H 24 4.590 4.714 -0.124 1
1 279 . 6 1 1 A 24 24 PRO C C 24 175.253 176.953 -1.700 1
1 280 . 6 1 1 A 24 24 PRO CA C 24 62.186 62.746 -0.560 1
1 281 . 6 1 1 A 24 24 PRO CB C 24 32.931 32.062 0.869 1
1 284 . 6 1 1 A 25 25 VAL H H 25 9.334 8.302 1.032 1
1 285 . 6 1 1 A 25 25 VAL HA H 25 4.378 4.259 0.119 1
1 293 . 6 1 1 A 25 25 VAL C C 25 176.439 175.936 0.503 1
1 294 . 6 1 1 A 25 25 VAL CA C 25 61.482 62.724 -1.242 1
1 295 . 6 1 1 A 25 25 VAL CB C 25 34.781 32.338 2.443 1
1 298 . 6 1 1 A 25 25 VAL N N 25 120.408 123.616 -3.208 1
1 299 . 6 1 1 A 26 26 LYS H H 26 9.300 9.007 0.293 1
1 300 . 6 1 1 A 26 26 LYS HA H 26 4.982 4.658 0.324 1
1 309 . 6 1 1 A 26 26 LYS C C 26 179.008 178.284 0.724 1
1 310 . 6 1 1 A 26 26 LYS CA C 26 56.908 54.982 1.926 1
1 311 . 6 1 1 A 26 26 LYS CB C 26 34.071 33.971 0.100 1
1 315 . 6 1 1 A 26 26 LYS N N 26 126.177 125.377 0.800 1
1 316 . 6 1 1 A 27 27 THR H H 27 8.618 9.044 -0.426 1
1 317 . 6 1 1 A 27 27 THR HA H 27 3.662 4.007 -0.345 1
1 322 . 6 1 1 A 27 27 THR C C 27 176.442 176.504 -0.062 1
1 323 . 6 1 1 A 27 27 THR CA C 27 67.591 66.476 1.115 1
1 324 . 6 1 1 A 27 27 THR CB C 27 68.868 68.837 0.031 1
1 326 . 6 1 1 A 27 27 THR N N 27 119.020 117.126 1.894 1
1 327 . 6 1 1 A 28 28 ARG H H 28 9.288 8.173 1.115 1
1 328 . 6 1 1 A 28 28 ARG HA H 28 3.879 4.051 -0.172 1
1 335 . 6 1 1 A 28 28 ARG C C 28 176.884 178.993 -2.109 1
1 336 . 6 1 1 A 28 28 ARG CA C 28 59.431 59.663 -0.232 1
1 337 . 6 1 1 A 28 28 ARG CB C 28 29.953 29.916 0.037 1
1 340 . 6 1 1 A 28 28 ARG N N 28 119.100 121.244 -2.144 1
1 341 . 6 1 1 A 29 29 ASP H H 29 6.907 8.204 -1.297 1
1 342 . 6 1 1 A 29 29 ASP HA H 29 4.550 4.481 0.069 1
1 345 . 6 1 1 A 29 29 ASP C C 29 179.050 178.945 0.105 1
1 346 . 6 1 1 A 29 29 ASP CA C 29 57.262 57.169 0.093 1
1 347 . 6 1 1 A 29 29 ASP CB C 29 40.191 40.707 -0.516 1
1 348 . 6 1 1 A 29 29 ASP N N 29 117.490 119.748 -2.258 1
1 349 . 6 1 1 A 30 30 ILE H H 30 7.554 7.744 -0.190 1
1 350 . 6 1 1 A 30 30 ILE HA H 30 3.595 3.713 -0.118 1
1 360 . 6 1 1 A 30 30 ILE C C 30 176.907 177.639 -0.732 1
1 361 . 6 1 1 A 30 30 ILE CA C 30 65.002 66.076 -1.074 1
1 362 . 6 1 1 A 30 30 ILE CB C 30 37.999 37.860 0.139 1
1 366 . 6 1 1 A 30 30 ILE N N 30 120.978 120.799 0.179 1
1 367 . 6 1 1 A 31 31 ALA H H 31 8.269 8.371 -0.102 1
1 368 . 6 1 1 A 31 31 ALA HA H 31 3.720 4.027 -0.307 1
1 372 . 6 1 1 A 31 31 ALA C C 31 179.170 178.823 0.347 1
1 373 . 6 1 1 A 31 31 ALA CA C 31 56.354 55.510 0.844 1
1 374 . 6 1 1 A 31 31 ALA CB C 31 17.843 17.953 -0.110 1
1 375 . 6 1 1 A 31 31 ALA N N 31 121.171 122.605 -1.434 1
1 376 . 6 1 1 A 32 32 ASP H H 32 8.293 8.458 -0.165 1
1 377 . 6 1 1 A 32 32 ASP HA H 32 4.422 4.335 0.087 1
1 380 . 6 1 1 A 32 32 ASP C C 32 179.136 178.148 0.988 1
1 381 . 6 1 1 A 32 32 ASP CA C 32 57.109 57.263 -0.154 1
1 382 . 6 1 1 A 32 32 ASP CB C 32 40.523 41.525 -1.002 1
1 383 . 6 1 1 A 32 32 ASP N N 32 116.467 118.340 -1.873 1
1 384 . 6 1 1 A 33 33 ALA H H 33 7.536 8.228 -0.692 1
1 385 . 6 1 1 A 33 33 ALA HA H 33 4.222 4.107 0.115 1
1 389 . 6 1 1 A 33 33 ALA C C 33 179.056 179.814 -0.758 1
1 390 . 6 1 1 A 33 33 ALA CA C 33 54.469 54.906 -0.437 1
1 391 . 6 1 1 A 33 33 ALA CB C 33 19.085 18.378 0.707 1
1 392 . 6 1 1 A 33 33 ALA N N 33 120.859 121.299 -0.440 1
1 393 . 6 1 1 A 34 34 ALA H H 34 8.296 7.883 0.413 1
1 394 . 6 1 1 A 34 34 ALA HA H 34 4.101 4.267 -0.166 1
1 398 . 6 1 1 A 34 34 ALA C C 34 176.912 178.033 -1.121 1
1 399 . 6 1 1 A 34 34 ALA CA C 34 52.380 52.336 0.044 1
1 400 . 6 1 1 A 34 34 ALA CB C 34 18.817 19.458 -0.641 1
1 401 . 6 1 1 A 34 34 ALA N N 34 118.203 117.183 1.020 1
1 402 . 6 1 1 A 35 35 GLY H H 35 7.911 8.465 -0.554 1
1 403 . 6 1 1 A 35 35 GLY HA2 H 35 3.968 3.964 0.004 1
1 404 . 6 1 1 A 35 35 GLY HA3 H 35 3.968 3.969 -0.001 1
1 405 . 6 1 1 A 35 35 GLY C C 35 174.374 174.157 0.217 1
1 406 . 6 1 1 A 35 35 GLY CA C 35 46.388 46.521 -0.133 1
1 407 . 6 1 1 A 35 35 GLY N N 35 107.752 107.779 -0.027 1
1 408 . 6 1 1 A 36 36 LEU H H 36 7.758 7.558 0.200 1
1 409 . 6 1 1 A 36 36 LEU HA H 36 4.887 4.897 -0.010 1
1 419 . 6 1 1 A 36 36 LEU C C 36 175.941 175.263 0.678 1
1 420 . 6 1 1 A 36 36 LEU CA C 36 52.443 52.849 -0.406 1
1 421 . 6 1 1 A 36 36 LEU CB C 36 47.885 45.067 2.818 1
1 425 . 6 1 1 A 36 36 LEU N N 36 118.719 120.229 -1.510 1
1 426 . 6 1 1 A 37 37 SER H H 37 8.603 8.162 0.441 1
1 427 . 6 1 1 A 37 37 SER HA H 37 4.565 4.675 -0.110 1
1 430 . 6 1 1 A 37 37 SER C C 37 175.512 175.643 -0.131 1
1 431 . 6 1 1 A 37 37 SER CA C 37 57.262 57.379 -0.117 1
1 432 . 6 1 1 A 37 37 SER CB C 37 65.155 64.487 0.668 1
1 433 . 6 1 1 A 37 37 SER N N 37 115.095 115.713 -0.618 1
1 434 . 6 1 1 A 38 38 ILE H H 38 8.822 8.851 -0.029 1
1 435 . 6 1 1 A 38 38 ILE HA H 38 3.650 3.787 -0.137 1
1 445 . 6 1 1 A 38 38 ILE C C 38 176.849 177.529 -0.680 1
1 446 . 6 1 1 A 38 38 ILE CA C 38 64.557 64.923 -0.366 1
1 447 . 6 1 1 A 38 38 ILE CB C 38 37.451 37.972 -0.521 1
1 451 . 6 1 1 A 38 38 ILE N N 38 122.026 127.712 -5.686 1
1 452 . 6 1 1 A 39 39 TYR H H 39 7.839 8.576 -0.737 1
1 453 . 6 1 1 A 39 39 TYR HA H 39 4.112 4.057 0.055 1
1 460 . 6 1 1 A 39 39 TYR C C 39 177.703 177.461 0.242 1
1 461 . 6 1 1 A 39 39 TYR CA C 39 60.856 61.583 -0.727 1
1 462 . 6 1 1 A 39 39 TYR CB C 39 38.402 38.785 -0.383 1
1 467 . 6 1 1 A 39 39 TYR N N 39 118.759 120.631 -1.872 1
1 468 . 6 1 1 A 40 40 GLN H H 40 7.687 8.138 -0.451 1
1 469 . 6 1 1 A 40 40 GLN HA H 40 3.865 3.862 0.003 1
1 476 . 6 1 1 A 40 40 GLN C C 40 178.735 178.559 0.176 1
1 477 . 6 1 1 A 40 40 GLN CA C 40 58.089 58.827 -0.738 1
1 478 . 6 1 1 A 40 40 GLN CB C 40 29.950 28.688 1.262 1
1 481 . 6 1 1 A 40 40 GLN N N 40 116.772 118.306 -1.534 1
1 483 . 6 1 1 A 41 41 VAL H H 41 8.494 8.095 0.399 1
1 484 . 6 1 1 A 41 41 VAL HA H 41 3.835 3.775 0.060 1
1 492 . 6 1 1 A 41 41 VAL C C 41 176.977 177.732 -0.755 1
1 493 . 6 1 1 A 41 41 VAL CA C 41 66.102 66.979 -0.877 1
1 494 . 6 1 1 A 41 41 VAL CB C 41 31.105 31.580 -0.475 1
1 497 . 6 1 1 A 41 41 VAL N N 41 117.192 119.588 -2.396 1
1 498 . 6 1 1 A 42 42 ARG H H 42 8.179 8.316 -0.137 1
1 499 . 6 1 1 A 42 42 ARG HA H 42 3.708 3.968 -0.260 1
1 506 . 6 1 1 A 42 42 ARG C C 42 177.570 178.309 -0.739 1
1 507 . 6 1 1 A 42 42 ARG CA C 42 60.349 59.269 1.080 1
1 508 . 6 1 1 A 42 42 ARG CB C 42 30.047 29.870 0.177 1
1 511 . 6 1 1 A 42 42 ARG N N 42 120.574 119.981 0.593 1
1 512 . 6 1 1 A 43 43 LEU H H 43 6.982 7.895 -0.913 1
1 513 . 6 1 1 A 43 43 LEU HA H 43 3.939 3.723 0.216 1
1 523 . 6 1 1 A 43 43 LEU C C 43 180.397 178.636 1.761 1
1 524 . 6 1 1 A 43 43 LEU CA C 43 58.119 57.724 0.395 1
1 525 . 6 1 1 A 43 43 LEU CB C 43 41.294 41.771 -0.477 1
1 529 . 6 1 1 A 43 43 LEU N N 43 117.189 119.785 -2.596 1
1 530 . 6 1 1 A 44 44 TYR H H 44 7.026 7.512 -0.486 1
1 531 . 6 1 1 A 44 44 TYR HA H 44 4.253 4.476 -0.223 1
1 538 . 6 1 1 A 44 44 TYR C C 44 178.411 178.266 0.145 1
1 539 . 6 1 1 A 44 44 TYR CA C 44 60.941 60.328 0.613 1
1 540 . 6 1 1 A 44 44 TYR CB C 44 38.889 37.688 1.201 1
1 545 . 6 1 1 A 44 44 TYR N N 44 117.020 117.742 -0.722 1
1 546 . 6 1 1 A 45 45 LEU H H 45 8.429 8.180 0.249 1
1 547 . 6 1 1 A 45 45 LEU HA H 45 3.486 3.496 -0.010 1
1 557 . 6 1 1 A 45 45 LEU C C 45 178.648 178.802 -0.154 1
1 558 . 6 1 1 A 45 45 LEU CA C 45 57.915 57.387 0.528 1
1 559 . 6 1 1 A 45 45 LEU CB C 45 39.073 40.423 -1.350 1
1 563 . 6 1 1 A 45 45 LEU N N 45 119.649 120.158 -0.509 1
1 564 . 6 1 1 A 46 46 GLU H H 46 8.309 8.150 0.159 1
1 565 . 6 1 1 A 46 46 GLU HA H 46 4.286 3.965 0.321 1
1 570 . 6 1 1 A 46 46 GLU C C 46 179.577 179.413 0.164 1
1 571 . 6 1 1 A 46 46 GLU CA C 46 59.570 59.751 -0.181 1
1 572 . 6 1 1 A 46 46 GLU CB C 46 29.034 29.284 -0.250 1
1 574 . 6 1 1 A 46 46 GLU N N 46 117.366 118.290 -0.924 1
1 575 . 6 1 1 A 47 47 GLN H H 47 7.493 7.844 -0.351 1
1 576 . 6 1 1 A 47 47 GLN HA H 47 4.243 3.984 0.259 1
1 583 . 6 1 1 A 47 47 GLN C C 47 178.870 178.813 0.057 1
1 584 . 6 1 1 A 47 47 GLN CA C 47 59.581 59.003 0.578 1
1 585 . 6 1 1 A 47 47 GLN CB C 47 28.300 28.334 -0.034 1
1 588 . 6 1 1 A 47 47 GLN N N 47 119.345 119.305 0.040 1
1 590 . 6 1 1 A 48 48 LEU H H 48 8.160 8.323 -0.163 1
1 591 . 6 1 1 A 48 48 LEU HA H 48 4.211 3.994 0.217 1
1 601 . 6 1 1 A 48 48 LEU C C 48 180.111 179.155 0.956 1
1 602 . 6 1 1 A 48 48 LEU CA C 48 57.179 57.744 -0.565 1
1 603 . 6 1 1 A 48 48 LEU CB C 48 42.067 41.017 1.050 1
1 607 . 6 1 1 A 48 48 LEU N N 48 118.594 119.296 -0.702 1
1 608 . 6 1 1 A 49 49 HIS H H 49 8.864 8.479 0.385 1
1 609 . 6 1 1 A 49 49 HIS HA H 49 5.162 4.283 0.879 1
1 613 . 6 1 1 A 49 49 HIS C C 49 178.801 177.274 1.527 1
1 614 . 6 1 1 A 49 49 HIS CA C 49 58.397 60.257 -1.860 1
1 615 . 6 1 1 A 49 49 HIS CB C 49 29.631 30.117 -0.486 1
1 617 . 6 1 1 A 49 49 HIS N N 49 122.537 118.271 4.266 1
1 618 . 6 1 1 A 50 50 ASP H H 50 8.683 8.163 0.520 1
1 619 . 6 1 1 A 50 50 ASP HA H 50 4.356 4.335 0.021 1
1 622 . 6 1 1 A 50 50 ASP C C 50 178.474 178.676 -0.202 1
1 623 . 6 1 1 A 50 50 ASP CA C 50 57.744 57.240 0.504 1
1 624 . 6 1 1 A 50 50 ASP CB C 50 40.575 40.879 -0.304 1
1 625 . 6 1 1 A 50 50 ASP N N 50 123.169 120.163 3.006 1
1 626 . 6 1 1 A 51 51 VAL H H 51 7.606 7.914 -0.308 1
1 627 . 6 1 1 A 51 51 VAL HA H 51 4.514 4.027 0.487 1
1 635 . 6 1 1 A 51 51 VAL C C 51 176.862 176.618 0.244 1
1 636 . 6 1 1 A 51 51 VAL CA C 51 61.590 63.572 -1.982 1
1 637 . 6 1 1 A 51 51 VAL CB C 51 31.423 32.848 -1.425 1
1 640 . 6 1 1 A 51 51 VAL N N 51 109.266 114.513 -5.247 1
1 641 . 6 1 1 A 52 52 GLY H H 52 7.696 7.828 -0.132 1
1 642 . 6 1 1 A 52 52 GLY HA2 H 52 4.172 3.975 0.197 1
1 643 . 6 1 1 A 52 52 GLY HA3 H 52 3.938 3.993 -0.055 1
1 644 . 6 1 1 A 52 52 GLY C C 52 174.276 174.558 -0.282 1
1 645 . 6 1 1 A 52 52 GLY CA C 52 46.228 46.405 -0.177 1
1 646 . 6 1 1 A 52 52 GLY N N 52 108.681 110.344 -1.663 1
1 647 . 6 1 1 A 53 53 VAL H H 53 8.046 8.195 -0.149 1
1 648 . 6 1 1 A 53 53 VAL HA H 53 4.079 4.211 -0.132 1
1 656 . 6 1 1 A 53 53 VAL C C 53 175.949 175.408 0.541 1
1 657 . 6 1 1 A 53 53 VAL CA C 53 64.063 63.608 0.455 1
1 658 . 6 1 1 A 53 53 VAL CB C 53 33.160 34.228 -1.068 1
1 661 . 6 1 1 A 53 53 VAL N N 53 117.892 116.483 1.409 1
1 662 . 6 1 1 A 54 54 LEU H H 54 6.835 7.551 -0.716 1
1 663 . 6 1 1 A 54 54 LEU HA H 54 5.348 4.977 0.371 1
1 673 . 6 1 1 A 54 54 LEU C C 54 175.713 176.016 -0.303 1
1 674 . 6 1 1 A 54 54 LEU CA C 54 52.194 53.016 -0.822 1
1 675 . 6 1 1 A 54 54 LEU CB C 54 46.733 43.943 2.790 1
1 679 . 6 1 1 A 54 54 LEU N N 54 114.848 117.863 -3.015 1
1 680 . 6 1 1 A 55 55 GLU H H 55 9.549 9.342 0.207 1
1 681 . 6 1 1 A 55 55 GLU HA H 55 4.826 4.766 0.060 1
1 686 . 6 1 1 A 55 55 GLU C C 55 174.661 176.335 -1.674 1
1 687 . 6 1 1 A 55 55 GLU CA C 55 54.637 55.906 -1.269 1
1 688 . 6 1 1 A 55 55 GLU CB C 55 32.891 31.213 1.678 1
1 690 . 6 1 1 A 55 55 GLU N N 55 121.431 124.506 -3.075 1
1 691 . 6 1 1 A 56 56 LYS H H 56 8.513 8.608 -0.095 1
1 692 . 6 1 1 A 56 56 LYS HA H 56 4.151 4.620 -0.469 1
1 701 . 6 1 1 A 56 56 LYS C C 56 176.270 175.283 0.987 1
1 702 . 6 1 1 A 56 56 LYS CA C 56 54.890 55.525 -0.635 1
1 703 . 6 1 1 A 56 56 LYS CB C 56 33.162 32.844 0.318 1
1 707 . 6 1 1 A 56 56 LYS N N 56 126.539 123.566 2.973 1
1 708 . 6 1 1 A 57 57 VAL H H 57 8.279 8.840 -0.561 1
1 709 . 6 1 1 A 57 57 VAL HA H 57 3.820 4.303 -0.483 1
1 717 . 6 1 1 A 57 57 VAL C C 57 175.108 175.140 -0.032 1
1 718 . 6 1 1 A 57 57 VAL CA C 57 62.834 62.526 0.308 1
1 719 . 6 1 1 A 57 57 VAL CB C 57 32.549 29.686 2.863 1
1 722 . 6 1 1 A 57 57 VAL N N 57 126.540 125.687 0.853 1
1 723 . 6 1 1 A 58 58 ASN H H 58 8.383 8.319 0.064 1
1 724 . 6 1 1 A 58 58 ASN HA H 58 4.612 4.879 -0.267 1
1 729 . 6 1 1 A 58 58 ASN C C 58 174.772 173.803 0.969 1
1 730 . 6 1 1 A 58 58 ASN CA C 58 52.575 54.506 -1.931 1
1 731 . 6 1 1 A 58 58 ASN CB C 58 38.502 39.956 -1.454 1
1 733 . 6 1 1 A 58 58 ASN N N 58 121.767 124.453 -2.686 1
1 735 . 6 1 1 A 59 59 ALA H H 59 8.165 7.872 0.293 1
1 736 . 6 1 1 A 59 59 ALA HA H 59 4.251 4.569 -0.318 1
1 740 . 6 1 1 A 59 59 ALA C C 59 177.478 177.390 0.088 1
1 741 . 6 1 1 A 59 59 ALA CA C 59 52.490 52.015 0.475 1
1 742 . 6 1 1 A 59 59 ALA CB C 59 19.724 21.539 -1.815 1
1 743 . 6 1 1 A 59 59 ALA N N 59 125.082 118.780 6.302 1
1 744 . 6 1 1 A 60 60 GLY H H 60 8.291 8.956 -0.665 1
1 745 . 6 1 1 A 60 60 GLY HA2 H 60 4.165 3.852 0.313 1
1 746 . 6 1 1 A 60 60 GLY HA3 H 60 3.853 3.887 -0.034 1
1 747 . 6 1 1 A 60 60 GLY C C 60 174.171 173.594 0.577 1
1 748 . 6 1 1 A 60 60 GLY CA C 60 44.994 47.563 -2.569 1
1 749 . 6 1 1 A 60 60 GLY N N 60 108.518 112.595 -4.077 1
1 750 . 6 1 1 A 61 61 LYS H H 61 8.189 7.977 0.212 1
1 751 . 6 1 1 A 61 61 LYS HA H 61 4.320 4.563 -0.243 1
1 760 . 6 1 1 A 61 61 LYS C C 61 177.712 176.329 1.383 1
1 761 . 6 1 1 A 61 61 LYS CA C 61 56.832 54.591 2.241 1
1 762 . 6 1 1 A 61 61 LYS CB C 61 32.641 35.557 -2.916 1
1 766 . 6 1 1 A 61 61 LYS N N 61 120.532 119.707 0.825 1
1 767 . 6 1 1 A 62 62 GLY H H 62 8.767 8.354 0.413 1
1 768 . 6 1 1 A 62 62 GLY HA2 H 62 4.021 3.940 0.081 1
1 769 . 6 1 1 A 62 62 GLY HA3 H 62 3.849 3.946 -0.097 1
1 770 . 6 1 1 A 62 62 GLY C C 62 173.782 174.288 -0.506 1
1 771 . 6 1 1 A 62 62 GLY CA C 62 45.844 45.505 0.339 1
1 772 . 6 1 1 A 62 62 GLY N N 62 111.547 109.245 2.302 1
1 773 . 6 1 1 A 63 63 VAL H H 63 7.379 7.993 -0.614 1
1 774 . 6 1 1 A 63 63 VAL HA H 63 4.591 4.162 0.429 1
1 782 . 6 1 1 A 63 63 VAL C C 63 174.262 175.638 -1.376 1
1 783 . 6 1 1 A 63 63 VAL CA C 63 59.292 60.645 -1.353 1
1 784 . 6 1 1 A 63 63 VAL CB C 63 32.726 31.083 1.643 1
1 787 . 6 1 1 A 63 63 VAL N N 63 117.546 120.170 -2.624 1
1 788 . 6 1 1 A 64 64 PRO HA H 64 4.458 4.437 0.021 1
1 795 . 6 1 1 A 64 64 PRO C C 64 177.166 176.261 0.905 1
1 796 . 6 1 1 A 64 64 PRO CA C 64 63.661 62.763 0.898 1
1 797 . 6 1 1 A 64 64 PRO CB C 64 32.321 31.455 0.866 1
1 800 . 6 1 1 A 65 65 GLY H H 65 8.463 8.349 0.114 1
1 801 . 6 1 1 A 65 65 GLY HA2 H 65 3.882 3.971 -0.089 1
1 802 . 6 1 1 A 65 65 GLY HA3 H 65 3.602 4.106 -0.504 1
1 803 . 6 1 1 A 65 65 GLY C C 65 172.406 171.372 1.034 1
1 804 . 6 1 1 A 65 65 GLY CA C 65 45.933 43.744 2.189 1
1 805 . 6 1 1 A 65 65 GLY N N 65 109.819 109.089 0.730 1
1 806 . 6 1 1 A 66 66 LEU H H 66 7.534 8.302 -0.768 1
1 807 . 6 1 1 A 66 66 LEU HA H 66 4.940 4.394 0.546 1
1 817 . 6 1 1 A 66 66 LEU C C 66 176.237 176.467 -0.230 1
1 818 . 6 1 1 A 66 66 LEU CA C 66 53.687 54.541 -0.854 1
1 819 . 6 1 1 A 66 66 LEU CB C 66 46.108 42.163 3.945 1
1 823 . 6 1 1 A 66 66 LEU N N 66 122.249 122.061 0.188 1
1 824 . 6 1 1 A 67 67 TRP H H 67 8.916 9.137 -0.221 1
1 825 . 6 1 1 A 67 67 TRP HA H 67 5.526 5.229 0.297 1
1 834 . 6 1 1 A 67 67 TRP C C 67 175.670 175.301 0.369 1
1 835 . 6 1 1 A 67 67 TRP CA C 67 56.241 56.543 -0.302 1
1 836 . 6 1 1 A 67 67 TRP CB C 67 33.314 30.723 2.591 1
1 842 . 6 1 1 A 67 67 TRP N N 67 121.160 125.271 -4.111 1
1 844 . 6 1 1 A 68 68 ARG H H 68 8.772 9.002 -0.230 1
1 845 . 6 1 1 A 68 68 ARG HA H 68 4.832 4.905 -0.073 1
1 853 . 6 1 1 A 68 68 ARG C C 68 174.720 175.635 -0.915 1
1 854 . 6 1 1 A 68 68 ARG CA C 68 54.690 54.457 0.233 1
1 855 . 6 1 1 A 68 68 ARG CB C 68 35.176 32.394 2.782 1
1 858 . 6 1 1 A 68 68 ARG N N 68 117.471 125.849 -8.378 1
1 860 . 6 1 1 A 69 69 LEU H H 69 9.355 8.558 0.797 1
1 861 . 6 1 1 A 69 69 LEU HA H 69 4.557 4.351 0.206 1
1 871 . 6 1 1 A 69 69 LEU C C 69 177.180 176.306 0.874 1
1 872 . 6 1 1 A 69 69 LEU CA C 69 55.780 54.879 0.901 1
1 873 . 6 1 1 A 69 69 LEU CB C 69 42.736 43.021 -0.285 1
1 877 . 6 1 1 A 69 69 LEU N N 69 125.211 124.164 1.047 1
1 878 . 6 1 1 A 70 70 LEU H H 70 8.058 7.945 0.113 1
1 879 . 6 1 1 A 70 70 LEU HA H 70 4.364 4.303 0.061 1
1 889 . 6 1 1 A 70 70 LEU C C 70 176.808 177.653 -0.845 1
1 890 . 6 1 1 A 70 70 LEU CA C 70 55.257 54.626 0.631 1
1 891 . 6 1 1 A 70 70 LEU CB C 70 42.413 40.503 1.910 1
1 895 . 6 1 1 A 70 70 LEU N N 70 125.525 121.449 4.076 1
1 1 . 7 1 1 A 2 2 SER HA H 2 4.126 4.634 -0.508 1
1 4 . 7 1 1 A 2 2 SER CA C 2 57.564 57.424 0.140 1
1 5 . 7 1 1 A 2 2 SER CB C 2 63.953 61.291 2.662 1
1 6 . 7 1 1 A 3 3 GLU HA H 3 4.408 4.475 -0.067 1
1 11 . 7 1 1 A 3 3 GLU C C 3 176.658 175.817 0.841 1
1 12 . 7 1 1 A 3 3 GLU CA C 3 56.802 56.017 0.785 1
1 13 . 7 1 1 A 3 3 GLU CB C 3 30.674 29.174 1.500 1
1 15 . 7 1 1 A 4 4 SER H H 4 8.650 8.128 0.522 1
1 16 . 7 1 1 A 4 4 SER HA H 4 4.463 4.087 0.376 1
1 19 . 7 1 1 A 4 4 SER C C 4 175.949 173.949 2.000 1
1 20 . 7 1 1 A 4 4 SER CA C 4 58.557 59.123 -0.566 1
1 21 . 7 1 1 A 4 4 SER CB C 4 63.834 60.913 2.921 1
1 22 . 7 1 1 A 4 4 SER N N 4 118.042 113.253 4.789 1
1 23 . 7 1 1 A 5 5 ILE H H 5 8.404 7.761 0.643 1
1 24 . 7 1 1 A 5 5 ILE HA H 5 3.902 3.491 0.411 1
1 34 . 7 1 1 A 5 5 ILE C C 5 176.608 178.473 -1.865 1
1 35 . 7 1 1 A 5 5 ILE CA C 5 62.662 64.693 -2.031 1
1 36 . 7 1 1 A 5 5 ILE CB C 5 37.622 37.776 -0.154 1
1 40 . 7 1 1 A 5 5 ILE N N 5 124.711 121.219 3.492 1
1 41 . 7 1 1 A 6 6 VAL H H 6 7.602 8.042 -0.440 1
1 42 . 7 1 1 A 6 6 VAL HA H 6 3.293 3.297 -0.004 1
1 50 . 7 1 1 A 6 6 VAL C C 6 177.088 177.832 -0.744 1
1 51 . 7 1 1 A 6 6 VAL CA C 6 67.180 66.977 0.203 1
1 52 . 7 1 1 A 6 6 VAL CB C 6 31.517 31.444 0.073 1
1 55 . 7 1 1 A 6 6 VAL N N 6 119.974 119.857 0.117 1
1 56 . 7 1 1 A 7 7 THR H H 7 7.515 8.065 -0.550 1
1 57 . 7 1 1 A 7 7 THR HA H 7 3.823 3.822 0.001 1
1 62 . 7 1 1 A 7 7 THR C C 7 176.978 176.366 0.612 1
1 63 . 7 1 1 A 7 7 THR CA C 7 66.257 66.891 -0.634 1
1 64 . 7 1 1 A 7 7 THR CB C 7 68.410 68.533 -0.123 1
1 66 . 7 1 1 A 7 7 THR N N 7 114.177 116.520 -2.343 1
1 67 . 7 1 1 A 8 8 LYS H H 8 7.807 8.272 -0.465 1
1 68 . 7 1 1 A 8 8 LYS HA H 8 4.066 3.947 0.119 1
1 77 . 7 1 1 A 8 8 LYS C C 8 178.733 178.421 0.312 1
1 78 . 7 1 1 A 8 8 LYS CA C 8 59.338 59.967 -0.629 1
1 79 . 7 1 1 A 8 8 LYS CB C 8 32.002 32.336 -0.334 1
1 83 . 7 1 1 A 8 8 LYS N N 8 123.387 120.869 2.518 1
1 84 . 7 1 1 A 9 9 ILE H H 9 8.288 7.787 0.501 1
1 85 . 7 1 1 A 9 9 ILE HA H 9 3.421 3.556 -0.135 1
1 95 . 7 1 1 A 9 9 ILE C C 9 177.187 178.008 -0.821 1
1 96 . 7 1 1 A 9 9 ILE CA C 9 65.772 65.592 0.180 1
1 97 . 7 1 1 A 9 9 ILE CB C 9 37.183 37.633 -0.450 1
1 101 . 7 1 1 A 9 9 ILE N N 9 119.543 118.695 0.848 1
1 102 . 7 1 1 A 10 10 ILE H H 10 8.073 8.360 -0.287 1
1 103 . 7 1 1 A 10 10 ILE HA H 10 3.305 3.491 -0.186 1
1 113 . 7 1 1 A 10 10 ILE C C 10 177.308 177.849 -0.541 1
1 114 . 7 1 1 A 10 10 ILE CA C 10 66.704 65.161 1.543 1
1 115 . 7 1 1 A 10 10 ILE CB C 10 37.840 37.585 0.255 1
1 119 . 7 1 1 A 10 10 ILE N N 10 119.219 120.844 -1.625 1
1 120 . 7 1 1 A 11 11 SER H H 11 7.861 8.340 -0.479 1
1 121 . 7 1 1 A 11 11 SER HA H 11 4.250 4.168 0.082 1
1 124 . 7 1 1 A 11 11 SER C C 11 176.918 177.528 -0.610 1
1 125 . 7 1 1 A 11 11 SER CA C 11 61.911 61.636 0.275 1
1 126 . 7 1 1 A 11 11 SER CB C 11 62.998 62.408 0.590 1
1 127 . 7 1 1 A 11 11 SER N N 11 113.959 114.282 -0.323 1
1 128 . 7 1 1 A 12 12 ILE H H 12 8.250 7.654 0.596 1
1 129 . 7 1 1 A 12 12 ILE HA H 12 3.801 3.550 0.251 1
1 139 . 7 1 1 A 12 12 ILE C C 12 178.130 177.960 0.170 1
1 140 . 7 1 1 A 12 12 ILE CA C 12 65.023 64.974 0.049 1
1 141 . 7 1 1 A 12 12 ILE CB C 12 38.195 37.934 0.261 1
1 145 . 7 1 1 A 12 12 ILE N N 12 123.767 123.127 0.640 1
1 146 . 7 1 1 A 13 13 VAL H H 13 8.308 8.158 0.150 1
1 147 . 7 1 1 A 13 13 VAL HA H 13 3.435 3.491 -0.056 1
1 155 . 7 1 1 A 13 13 VAL C C 13 177.283 178.340 -1.057 1
1 156 . 7 1 1 A 13 13 VAL CA C 13 67.693 66.346 1.347 1
1 157 . 7 1 1 A 13 13 VAL CB C 13 31.139 31.245 -0.106 1
1 160 . 7 1 1 A 13 13 VAL N N 13 120.066 119.772 0.294 1
1 161 . 7 1 1 A 14 14 GLN H H 14 8.612 8.221 0.391 1
1 162 . 7 1 1 A 14 14 GLN HA H 14 3.831 4.008 -0.177 1
1 169 . 7 1 1 A 14 14 GLN C C 14 178.256 177.965 0.291 1
1 170 . 7 1 1 A 14 14 GLN CA C 14 59.660 59.291 0.369 1
1 171 . 7 1 1 A 14 14 GLN CB C 14 29.456 28.305 1.151 1
1 174 . 7 1 1 A 14 14 GLN N N 14 118.099 119.586 -1.487 1
1 176 . 7 1 1 A 15 15 GLU H H 15 8.378 8.395 -0.017 1
1 177 . 7 1 1 A 15 15 GLU HA H 15 4.110 3.998 0.112 1
1 182 . 7 1 1 A 15 15 GLU C C 15 179.659 179.073 0.586 1
1 183 . 7 1 1 A 15 15 GLU CA C 15 59.476 59.660 -0.184 1
1 184 . 7 1 1 A 15 15 GLU CB C 15 29.725 29.130 0.595 1
1 186 . 7 1 1 A 15 15 GLU N N 15 118.580 119.256 -0.676 1
1 187 . 7 1 1 A 16 16 ARG H H 16 8.439 8.159 0.280 1
1 188 . 7 1 1 A 16 16 ARG HA H 16 4.157 4.029 0.128 1
1 196 . 7 1 1 A 16 16 ARG C C 16 179.276 178.983 0.293 1
1 197 . 7 1 1 A 16 16 ARG CA C 16 58.141 59.902 -1.761 1
1 198 . 7 1 1 A 16 16 ARG CB C 16 29.434 30.086 -0.652 1
1 201 . 7 1 1 A 16 16 ARG N N 16 118.688 118.633 0.055 1
1 203 . 7 1 1 A 17 17 GLN H H 17 8.861 7.910 0.951 1
1 204 . 7 1 1 A 17 17 GLN HA H 17 4.236 4.171 0.065 1
1 211 . 7 1 1 A 17 17 GLN C C 17 178.736 177.383 1.353 1
1 212 . 7 1 1 A 17 17 GLN CA C 17 59.683 58.004 1.679 1
1 213 . 7 1 1 A 17 17 GLN CB C 17 29.960 28.715 1.245 1
1 216 . 7 1 1 A 17 17 GLN N N 17 120.427 118.855 1.572 1
1 218 . 7 1 1 A 18 18 ASN H H 18 8.017 7.797 0.220 1
1 219 . 7 1 1 A 18 18 ASN HA H 18 4.605 4.643 -0.038 1
1 224 . 7 1 1 A 18 18 ASN C C 18 177.906 176.974 0.932 1
1 225 . 7 1 1 A 18 18 ASN CA C 18 55.375 55.806 -0.431 1
1 226 . 7 1 1 A 18 18 ASN CB C 18 38.383 38.531 -0.148 1
1 228 . 7 1 1 A 18 18 ASN N N 18 117.033 117.567 -0.534 1
1 230 . 7 1 1 A 19 19 MET H H 19 7.994 7.817 0.177 1
1 231 . 7 1 1 A 19 19 MET HA H 19 4.372 4.481 -0.109 1
1 236 . 7 1 1 A 19 19 MET C C 19 176.518 176.212 0.306 1
1 237 . 7 1 1 A 19 19 MET CA C 19 57.623 57.544 0.079 1
1 238 . 7 1 1 A 19 19 MET CB C 19 33.248 33.212 0.036 1
1 240 . 7 1 1 A 19 19 MET N N 19 119.320 116.767 2.553 1
1 241 . 7 1 1 A 20 20 ASP H H 20 7.800 8.314 -0.514 1
1 242 . 7 1 1 A 20 20 ASP HA H 20 4.990 4.703 0.287 1
1 245 . 7 1 1 A 20 20 ASP C C 20 176.082 175.609 0.473 1
1 246 . 7 1 1 A 20 20 ASP CA C 20 53.796 53.707 0.089 1
1 247 . 7 1 1 A 20 20 ASP CB C 20 40.409 39.708 0.701 1
1 248 . 7 1 1 A 20 20 ASP N N 20 119.127 116.635 2.492 1
1 249 . 7 1 1 A 21 21 ASP H H 21 8.136 8.281 -0.145 1
1 250 . 7 1 1 A 21 21 ASP HA H 21 4.497 4.485 0.012 1
1 253 . 7 1 1 A 21 21 ASP C C 21 176.264 177.645 -1.381 1
1 254 . 7 1 1 A 21 21 ASP CA C 21 55.508 56.514 -1.006 1
1 255 . 7 1 1 A 21 21 ASP CB C 21 40.063 40.755 -0.692 1
1 256 . 7 1 1 A 21 21 ASP N N 21 118.276 123.214 -4.938 1
1 257 . 7 1 1 A 22 22 GLY H H 22 8.728 8.152 0.576 1
1 258 . 7 1 1 A 22 22 GLY HA2 H 22 4.189 3.966 0.223 1
1 259 . 7 1 1 A 22 22 GLY HA3 H 22 3.683 3.966 -0.283 1
1 260 . 7 1 1 A 22 22 GLY C C 22 174.304 173.697 0.607 1
1 261 . 7 1 1 A 22 22 GLY CA C 22 45.629 45.573 0.056 1
1 262 . 7 1 1 A 22 22 GLY N N 22 105.878 106.041 -0.163 1
1 263 . 7 1 1 A 23 23 ALA H H 23 7.473 7.783 -0.310 1
1 264 . 7 1 1 A 23 23 ALA HA H 23 4.519 4.683 -0.164 1
1 268 . 7 1 1 A 23 23 ALA C C 23 174.065 174.455 -0.390 1
1 269 . 7 1 1 A 23 23 ALA CA C 23 51.142 49.487 1.655 1
1 270 . 7 1 1 A 23 23 ALA CB C 23 18.283 21.686 -3.403 1
1 271 . 7 1 1 A 23 23 ALA N N 23 125.323 121.584 3.739 1
1 272 . 7 1 1 A 24 24 PRO HA H 24 4.590 4.539 0.051 1
1 279 . 7 1 1 A 24 24 PRO C C 24 175.253 177.296 -2.043 1
1 280 . 7 1 1 A 24 24 PRO CA C 24 62.186 62.884 -0.698 1
1 281 . 7 1 1 A 24 24 PRO CB C 24 32.931 32.214 0.717 1
1 284 . 7 1 1 A 25 25 VAL H H 25 9.334 8.232 1.102 1
1 285 . 7 1 1 A 25 25 VAL HA H 25 4.378 4.280 0.098 1
1 293 . 7 1 1 A 25 25 VAL C C 25 176.439 176.254 0.185 1
1 294 . 7 1 1 A 25 25 VAL CA C 25 61.482 62.731 -1.249 1
1 295 . 7 1 1 A 25 25 VAL CB C 25 34.781 32.548 2.233 1
1 298 . 7 1 1 A 25 25 VAL N N 25 120.408 122.827 -2.419 1
1 299 . 7 1 1 A 26 26 LYS H H 26 9.300 9.058 0.242 1
1 300 . 7 1 1 A 26 26 LYS HA H 26 4.982 4.668 0.314 1
1 309 . 7 1 1 A 26 26 LYS C C 26 179.008 178.319 0.689 1
1 310 . 7 1 1 A 26 26 LYS CA C 26 56.908 55.057 1.851 1
1 311 . 7 1 1 A 26 26 LYS CB C 26 34.071 33.896 0.175 1
1 315 . 7 1 1 A 26 26 LYS N N 26 126.177 124.869 1.308 1
1 316 . 7 1 1 A 27 27 THR H H 27 8.618 8.646 -0.028 1
1 317 . 7 1 1 A 27 27 THR HA H 27 3.662 4.057 -0.395 1
1 322 . 7 1 1 A 27 27 THR C C 27 176.442 176.254 0.188 1
1 323 . 7 1 1 A 27 27 THR CA C 27 67.591 66.595 0.996 1
1 324 . 7 1 1 A 27 27 THR CB C 27 68.868 68.955 -0.087 1
1 326 . 7 1 1 A 27 27 THR N N 27 119.020 117.466 1.554 1
1 327 . 7 1 1 A 28 28 ARG H H 28 9.288 8.245 1.043 1
1 328 . 7 1 1 A 28 28 ARG HA H 28 3.879 4.033 -0.154 1
1 335 . 7 1 1 A 28 28 ARG C C 28 176.884 178.821 -1.937 1
1 336 . 7 1 1 A 28 28 ARG CA C 28 59.431 59.673 -0.242 1
1 337 . 7 1 1 A 28 28 ARG CB C 28 29.953 30.298 -0.345 1
1 340 . 7 1 1 A 28 28 ARG N N 28 119.100 121.268 -2.168 1
1 341 . 7 1 1 A 29 29 ASP H H 29 6.907 8.192 -1.285 1
1 342 . 7 1 1 A 29 29 ASP HA H 29 4.550 4.392 0.158 1
1 345 . 7 1 1 A 29 29 ASP C C 29 179.050 178.826 0.224 1
1 346 . 7 1 1 A 29 29 ASP CA C 29 57.262 57.211 0.051 1
1 347 . 7 1 1 A 29 29 ASP CB C 29 40.191 40.563 -0.372 1
1 348 . 7 1 1 A 29 29 ASP N N 29 117.490 119.662 -2.172 1
1 349 . 7 1 1 A 30 30 ILE H H 30 7.554 7.482 0.072 1
1 350 . 7 1 1 A 30 30 ILE HA H 30 3.595 3.676 -0.081 1
1 360 . 7 1 1 A 30 30 ILE C C 30 176.907 177.730 -0.823 1
1 361 . 7 1 1 A 30 30 ILE CA C 30 65.002 65.994 -0.992 1
1 362 . 7 1 1 A 30 30 ILE CB C 30 37.999 38.331 -0.332 1
1 366 . 7 1 1 A 30 30 ILE N N 30 120.978 120.097 0.881 1
1 367 . 7 1 1 A 31 31 ALA H H 31 8.269 8.420 -0.151 1
1 368 . 7 1 1 A 31 31 ALA HA H 31 3.720 4.025 -0.305 1
1 372 . 7 1 1 A 31 31 ALA C C 31 179.170 178.672 0.498 1
1 373 . 7 1 1 A 31 31 ALA CA C 31 56.354 55.574 0.780 1
1 374 . 7 1 1 A 31 31 ALA CB C 31 17.843 18.051 -0.208 1
1 375 . 7 1 1 A 31 31 ALA N N 31 121.171 122.659 -1.488 1
1 376 . 7 1 1 A 32 32 ASP H H 32 8.293 8.656 -0.363 1
1 377 . 7 1 1 A 32 32 ASP HA H 32 4.422 4.339 0.083 1
1 380 . 7 1 1 A 32 32 ASP C C 32 179.136 178.116 1.020 1
1 381 . 7 1 1 A 32 32 ASP CA C 32 57.109 57.237 -0.128 1
1 382 . 7 1 1 A 32 32 ASP CB C 32 40.523 41.539 -1.016 1
1 383 . 7 1 1 A 32 32 ASP N N 32 116.467 118.239 -1.772 1
1 384 . 7 1 1 A 33 33 ALA H H 33 7.536 8.049 -0.513 1
1 385 . 7 1 1 A 33 33 ALA HA H 33 4.222 4.088 0.134 1
1 389 . 7 1 1 A 33 33 ALA C C 33 179.056 179.331 -0.275 1
1 390 . 7 1 1 A 33 33 ALA CA C 33 54.469 54.716 -0.247 1
1 391 . 7 1 1 A 33 33 ALA CB C 33 19.085 18.090 0.995 1
1 392 . 7 1 1 A 33 33 ALA N N 33 120.859 121.266 -0.407 1
1 393 . 7 1 1 A 34 34 ALA H H 34 8.296 7.464 0.832 1
1 394 . 7 1 1 A 34 34 ALA HA H 34 4.101 4.345 -0.244 1
1 398 . 7 1 1 A 34 34 ALA C C 34 176.912 177.959 -1.047 1
1 399 . 7 1 1 A 34 34 ALA CA C 34 52.380 52.172 0.208 1
1 400 . 7 1 1 A 34 34 ALA CB C 34 18.817 19.803 -0.986 1
1 401 . 7 1 1 A 34 34 ALA N N 34 118.203 117.702 0.501 1
1 402 . 7 1 1 A 35 35 GLY H H 35 7.911 8.291 -0.380 1
1 403 . 7 1 1 A 35 35 GLY HA2 H 35 3.968 3.957 0.011 1
1 404 . 7 1 1 A 35 35 GLY HA3 H 35 3.968 3.962 0.006 1
1 405 . 7 1 1 A 35 35 GLY C C 35 174.374 174.073 0.301 1
1 406 . 7 1 1 A 35 35 GLY CA C 35 46.388 46.218 0.170 1
1 407 . 7 1 1 A 35 35 GLY N N 35 107.752 107.913 -0.161 1
1 408 . 7 1 1 A 36 36 LEU H H 36 7.758 7.800 -0.042 1
1 409 . 7 1 1 A 36 36 LEU HA H 36 4.887 4.871 0.016 1
1 419 . 7 1 1 A 36 36 LEU C C 36 175.941 175.627 0.314 1
1 420 . 7 1 1 A 36 36 LEU CA C 36 52.443 52.844 -0.401 1
1 421 . 7 1 1 A 36 36 LEU CB C 36 47.885 44.217 3.668 1
1 425 . 7 1 1 A 36 36 LEU N N 36 118.719 120.729 -2.010 1
1 426 . 7 1 1 A 37 37 SER H H 37 8.603 8.693 -0.090 1
1 427 . 7 1 1 A 37 37 SER HA H 37 4.565 4.640 -0.075 1
1 430 . 7 1 1 A 37 37 SER C C 37 175.512 175.743 -0.231 1
1 431 . 7 1 1 A 37 37 SER CA C 37 57.262 57.916 -0.654 1
1 432 . 7 1 1 A 37 37 SER CB C 37 65.155 64.231 0.924 1
1 433 . 7 1 1 A 37 37 SER N N 37 115.095 115.850 -0.755 1
1 434 . 7 1 1 A 38 38 ILE H H 38 8.822 8.857 -0.035 1
1 435 . 7 1 1 A 38 38 ILE HA H 38 3.650 3.818 -0.168 1
1 445 . 7 1 1 A 38 38 ILE C C 38 176.849 177.479 -0.630 1
1 446 . 7 1 1 A 38 38 ILE CA C 38 64.557 65.302 -0.745 1
1 447 . 7 1 1 A 38 38 ILE CB C 38 37.451 37.577 -0.126 1
1 451 . 7 1 1 A 38 38 ILE N N 38 122.026 128.268 -6.242 1
1 452 . 7 1 1 A 39 39 TYR H H 39 7.839 8.286 -0.447 1
1 453 . 7 1 1 A 39 39 TYR HA H 39 4.112 4.043 0.069 1
1 460 . 7 1 1 A 39 39 TYR C C 39 177.703 177.240 0.463 1
1 461 . 7 1 1 A 39 39 TYR CA C 39 60.856 61.837 -0.981 1
1 462 . 7 1 1 A 39 39 TYR CB C 39 38.402 38.624 -0.222 1
1 467 . 7 1 1 A 39 39 TYR N N 39 118.759 121.011 -2.252 1
1 468 . 7 1 1 A 40 40 GLN H H 40 7.687 8.276 -0.589 1
1 469 . 7 1 1 A 40 40 GLN HA H 40 3.865 3.782 0.083 1
1 476 . 7 1 1 A 40 40 GLN C C 40 178.735 178.189 0.546 1
1 477 . 7 1 1 A 40 40 GLN CA C 40 58.089 58.688 -0.599 1
1 478 . 7 1 1 A 40 40 GLN CB C 40 29.950 28.645 1.305 1
1 481 . 7 1 1 A 40 40 GLN N N 40 116.772 118.827 -2.055 1
1 483 . 7 1 1 A 41 41 VAL H H 41 8.494 8.174 0.320 1
1 484 . 7 1 1 A 41 41 VAL HA H 41 3.835 3.625 0.210 1
1 492 . 7 1 1 A 41 41 VAL C C 41 176.977 177.867 -0.890 1
1 493 . 7 1 1 A 41 41 VAL CA C 41 66.102 67.146 -1.044 1
1 494 . 7 1 1 A 41 41 VAL CB C 41 31.105 31.506 -0.401 1
1 497 . 7 1 1 A 41 41 VAL N N 41 117.192 119.693 -2.501 1
1 498 . 7 1 1 A 42 42 ARG H H 42 8.179 7.796 0.383 1
1 499 . 7 1 1 A 42 42 ARG HA H 42 3.708 3.730 -0.022 1
1 506 . 7 1 1 A 42 42 ARG C C 42 177.570 178.436 -0.866 1
1 507 . 7 1 1 A 42 42 ARG CA C 42 60.349 59.144 1.205 1
1 508 . 7 1 1 A 42 42 ARG CB C 42 30.047 30.053 -0.006 1
1 511 . 7 1 1 A 42 42 ARG N N 42 120.574 120.210 0.364 1
1 512 . 7 1 1 A 43 43 LEU H H 43 6.982 7.725 -0.743 1
1 513 . 7 1 1 A 43 43 LEU HA H 43 3.939 3.818 0.121 1
1 523 . 7 1 1 A 43 43 LEU C C 43 180.397 178.488 1.909 1
1 524 . 7 1 1 A 43 43 LEU CA C 43 58.119 57.765 0.354 1
1 525 . 7 1 1 A 43 43 LEU CB C 43 41.294 41.246 0.048 1
1 529 . 7 1 1 A 43 43 LEU N N 43 117.189 119.877 -2.688 1
1 530 . 7 1 1 A 44 44 TYR H H 44 7.026 7.623 -0.597 1
1 531 . 7 1 1 A 44 44 TYR HA H 44 4.253 4.235 0.018 1
1 538 . 7 1 1 A 44 44 TYR C C 44 178.411 178.148 0.263 1
1 539 . 7 1 1 A 44 44 TYR CA C 44 60.941 60.919 0.022 1
1 540 . 7 1 1 A 44 44 TYR CB C 44 38.889 38.025 0.864 1
1 545 . 7 1 1 A 44 44 TYR N N 44 117.020 117.750 -0.730 1
1 546 . 7 1 1 A 45 45 LEU H H 45 8.429 8.461 -0.032 1
1 547 . 7 1 1 A 45 45 LEU HA H 45 3.486 3.766 -0.280 1
1 557 . 7 1 1 A 45 45 LEU C C 45 178.648 179.352 -0.704 1
1 558 . 7 1 1 A 45 45 LEU CA C 45 57.915 57.958 -0.043 1
1 559 . 7 1 1 A 45 45 LEU CB C 45 39.073 40.813 -1.740 1
1 563 . 7 1 1 A 45 45 LEU N N 45 119.649 120.012 -0.363 1
1 564 . 7 1 1 A 46 46 GLU H H 46 8.309 8.146 0.163 1
1 565 . 7 1 1 A 46 46 GLU HA H 46 4.286 4.190 0.096 1
1 570 . 7 1 1 A 46 46 GLU C C 46 179.577 179.548 0.029 1
1 571 . 7 1 1 A 46 46 GLU CA C 46 59.570 60.120 -0.550 1
1 572 . 7 1 1 A 46 46 GLU CB C 46 29.034 29.410 -0.376 1
1 574 . 7 1 1 A 46 46 GLU N N 46 117.366 117.546 -0.180 1
1 575 . 7 1 1 A 47 47 GLN H H 47 7.493 7.771 -0.278 1
1 576 . 7 1 1 A 47 47 GLN HA H 47 4.243 4.026 0.217 1
1 583 . 7 1 1 A 47 47 GLN C C 47 178.870 179.013 -0.143 1
1 584 . 7 1 1 A 47 47 GLN CA C 47 59.581 58.749 0.832 1
1 585 . 7 1 1 A 47 47 GLN CB C 47 28.300 28.104 0.196 1
1 588 . 7 1 1 A 47 47 GLN N N 47 119.345 119.072 0.273 1
1 590 . 7 1 1 A 48 48 LEU H H 48 8.160 8.517 -0.357 1
1 591 . 7 1 1 A 48 48 LEU HA H 48 4.211 4.017 0.194 1
1 601 . 7 1 1 A 48 48 LEU C C 48 180.111 179.271 0.840 1
1 602 . 7 1 1 A 48 48 LEU CA C 48 57.179 57.833 -0.654 1
1 603 . 7 1 1 A 48 48 LEU CB C 48 42.067 41.217 0.850 1
1 607 . 7 1 1 A 48 48 LEU N N 48 118.594 119.628 -1.034 1
1 608 . 7 1 1 A 49 49 HIS H H 49 8.864 8.027 0.837 1
1 609 . 7 1 1 A 49 49 HIS HA H 49 5.162 4.673 0.489 1
1 613 . 7 1 1 A 49 49 HIS C C 49 178.801 176.794 2.007 1
1 614 . 7 1 1 A 49 49 HIS CA C 49 58.397 60.177 -1.780 1
1 615 . 7 1 1 A 49 49 HIS CB C 49 29.631 30.042 -0.411 1
1 617 . 7 1 1 A 49 49 HIS N N 49 122.537 118.384 4.153 1
1 618 . 7 1 1 A 50 50 ASP H H 50 8.683 8.201 0.482 1
1 619 . 7 1 1 A 50 50 ASP HA H 50 4.356 4.106 0.250 1
1 622 . 7 1 1 A 50 50 ASP C C 50 178.474 177.737 0.737 1
1 623 . 7 1 1 A 50 50 ASP CA C 50 57.744 57.148 0.596 1
1 624 . 7 1 1 A 50 50 ASP CB C 50 40.575 41.632 -1.057 1
1 625 . 7 1 1 A 50 50 ASP N N 50 123.169 118.799 4.370 1
1 626 . 7 1 1 A 51 51 VAL H H 51 7.606 7.489 0.117 1
1 627 . 7 1 1 A 51 51 VAL HA H 51 4.514 4.222 0.292 1
1 635 . 7 1 1 A 51 51 VAL C C 51 176.862 175.807 1.055 1
1 636 . 7 1 1 A 51 51 VAL CA C 51 61.590 61.291 0.299 1
1 637 . 7 1 1 A 51 51 VAL CB C 51 31.423 31.608 -0.185 1
1 640 . 7 1 1 A 51 51 VAL N N 51 109.266 110.091 -0.825 1
1 641 . 7 1 1 A 52 52 GLY H H 52 7.696 7.791 -0.095 1
1 642 . 7 1 1 A 52 52 GLY HA2 H 52 4.172 3.989 0.183 1
1 643 . 7 1 1 A 52 52 GLY HA3 H 52 3.938 3.996 -0.058 1
1 644 . 7 1 1 A 52 52 GLY C C 52 174.276 174.299 -0.023 1
1 645 . 7 1 1 A 52 52 GLY CA C 52 46.228 46.633 -0.405 1
1 646 . 7 1 1 A 52 52 GLY N N 52 108.681 110.665 -1.984 1
1 647 . 7 1 1 A 53 53 VAL H H 53 8.046 8.166 -0.120 1
1 648 . 7 1 1 A 53 53 VAL HA H 53 4.079 4.272 -0.193 1
1 656 . 7 1 1 A 53 53 VAL C C 53 175.949 175.385 0.564 1
1 657 . 7 1 1 A 53 53 VAL CA C 53 64.063 63.780 0.283 1
1 658 . 7 1 1 A 53 53 VAL CB C 53 33.160 34.577 -1.417 1
1 661 . 7 1 1 A 53 53 VAL N N 53 117.892 116.563 1.329 1
1 662 . 7 1 1 A 54 54 LEU H H 54 6.835 7.557 -0.722 1
1 663 . 7 1 1 A 54 54 LEU HA H 54 5.348 4.863 0.485 1
1 673 . 7 1 1 A 54 54 LEU C C 54 175.713 175.951 -0.238 1
1 674 . 7 1 1 A 54 54 LEU CA C 54 52.194 52.979 -0.785 1
1 675 . 7 1 1 A 54 54 LEU CB C 54 46.733 44.419 2.314 1
1 679 . 7 1 1 A 54 54 LEU N N 54 114.848 117.992 -3.144 1
1 680 . 7 1 1 A 55 55 GLU H H 55 9.549 9.061 0.488 1
1 681 . 7 1 1 A 55 55 GLU HA H 55 4.826 5.063 -0.237 1
1 686 . 7 1 1 A 55 55 GLU C C 55 174.661 174.429 0.232 1
1 687 . 7 1 1 A 55 55 GLU CA C 55 54.637 54.643 -0.006 1
1 688 . 7 1 1 A 55 55 GLU CB C 55 32.891 33.736 -0.845 1
1 690 . 7 1 1 A 55 55 GLU N N 55 121.431 121.143 0.288 1
1 691 . 7 1 1 A 56 56 LYS H H 56 8.513 8.124 0.389 1
1 692 . 7 1 1 A 56 56 LYS HA H 56 4.151 4.648 -0.497 1
1 701 . 7 1 1 A 56 56 LYS C C 56 176.270 175.606 0.664 1
1 702 . 7 1 1 A 56 56 LYS CA C 56 54.890 55.753 -0.863 1
1 703 . 7 1 1 A 56 56 LYS CB C 56 33.162 33.562 -0.400 1
1 707 . 7 1 1 A 56 56 LYS N N 56 126.539 125.805 0.734 1
1 708 . 7 1 1 A 57 57 VAL H H 57 8.279 8.464 -0.185 1
1 709 . 7 1 1 A 57 57 VAL HA H 57 3.820 4.392 -0.572 1
1 717 . 7 1 1 A 57 57 VAL C C 57 175.108 175.627 -0.519 1
1 718 . 7 1 1 A 57 57 VAL CA C 57 62.834 60.985 1.849 1
1 719 . 7 1 1 A 57 57 VAL CB C 57 32.549 33.460 -0.911 1
1 722 . 7 1 1 A 57 57 VAL N N 57 126.540 124.068 2.472 1
1 723 . 7 1 1 A 58 58 ASN H H 58 8.383 8.549 -0.166 1
1 724 . 7 1 1 A 58 58 ASN HA H 58 4.612 4.631 -0.019 1
1 729 . 7 1 1 A 58 58 ASN C C 58 174.772 175.161 -0.389 1
1 730 . 7 1 1 A 58 58 ASN CA C 58 52.575 55.053 -2.478 1
1 731 . 7 1 1 A 58 58 ASN CB C 58 38.502 37.346 1.156 1
1 733 . 7 1 1 A 58 58 ASN N N 58 121.767 122.049 -0.282 1
1 735 . 7 1 1 A 59 59 ALA H H 59 8.165 8.638 -0.473 1
1 736 . 7 1 1 A 59 59 ALA HA H 59 4.251 4.127 0.124 1
1 740 . 7 1 1 A 59 59 ALA C C 59 177.478 178.184 -0.706 1
1 741 . 7 1 1 A 59 59 ALA CA C 59 52.490 54.662 -2.172 1
1 742 . 7 1 1 A 59 59 ALA CB C 59 19.724 19.122 0.602 1
1 743 . 7 1 1 A 59 59 ALA N N 59 125.082 125.622 -0.540 1
1 744 . 7 1 1 A 60 60 GLY H H 60 8.291 7.545 0.746 1
1 745 . 7 1 1 A 60 60 GLY HA2 H 60 4.165 4.006 0.159 1
1 746 . 7 1 1 A 60 60 GLY HA3 H 60 3.853 4.024 -0.171 1
1 747 . 7 1 1 A 60 60 GLY C C 60 174.171 174.497 -0.326 1
1 748 . 7 1 1 A 60 60 GLY CA C 60 44.994 45.569 -0.575 1
1 749 . 7 1 1 A 60 60 GLY N N 60 108.518 104.111 4.407 1
1 750 . 7 1 1 A 61 61 LYS H H 61 8.189 7.824 0.365 1
1 751 . 7 1 1 A 61 61 LYS HA H 61 4.320 4.131 0.189 1
1 760 . 7 1 1 A 61 61 LYS C C 61 177.712 177.159 0.553 1
1 761 . 7 1 1 A 61 61 LYS CA C 61 56.832 57.609 -0.777 1
1 762 . 7 1 1 A 61 61 LYS CB C 61 32.641 32.480 0.161 1
1 766 . 7 1 1 A 61 61 LYS N N 61 120.532 122.314 -1.782 1
1 767 . 7 1 1 A 62 62 GLY H H 62 8.767 8.890 -0.123 1
1 768 . 7 1 1 A 62 62 GLY HA2 H 62 4.021 3.971 0.050 1
1 769 . 7 1 1 A 62 62 GLY HA3 H 62 3.849 3.978 -0.129 1
1 770 . 7 1 1 A 62 62 GLY C C 62 173.782 174.335 -0.553 1
1 771 . 7 1 1 A 62 62 GLY CA C 62 45.844 45.407 0.437 1
1 772 . 7 1 1 A 62 62 GLY N N 62 111.547 114.486 -2.939 1
1 773 . 7 1 1 A 63 63 VAL H H 63 7.379 7.891 -0.512 1
1 774 . 7 1 1 A 63 63 VAL HA H 63 4.591 4.216 0.375 1
1 782 . 7 1 1 A 63 63 VAL C C 63 174.262 176.358 -2.096 1
1 783 . 7 1 1 A 63 63 VAL CA C 63 59.292 60.973 -1.681 1
1 784 . 7 1 1 A 63 63 VAL CB C 63 32.726 31.394 1.332 1
1 787 . 7 1 1 A 63 63 VAL N N 63 117.546 119.962 -2.416 1
1 788 . 7 1 1 A 64 64 PRO HA H 64 4.458 4.469 -0.011 1
1 795 . 7 1 1 A 64 64 PRO C C 64 177.166 177.354 -0.188 1
1 796 . 7 1 1 A 64 64 PRO CA C 64 63.661 64.110 -0.449 1
1 797 . 7 1 1 A 64 64 PRO CB C 64 32.321 32.078 0.243 1
1 800 . 7 1 1 A 65 65 GLY H H 65 8.463 7.877 0.586 1
1 801 . 7 1 1 A 65 65 GLY HA2 H 65 3.882 3.716 0.166 1
1 802 . 7 1 1 A 65 65 GLY HA3 H 65 3.602 3.858 -0.256 1
1 803 . 7 1 1 A 65 65 GLY C C 65 172.406 172.905 -0.499 1
1 804 . 7 1 1 A 65 65 GLY CA C 65 45.933 44.446 1.487 1
1 805 . 7 1 1 A 65 65 GLY N N 65 109.819 108.703 1.116 1
1 806 . 7 1 1 A 66 66 LEU H H 66 7.534 8.421 -0.887 1
1 807 . 7 1 1 A 66 66 LEU HA H 66 4.940 5.184 -0.244 1
1 817 . 7 1 1 A 66 66 LEU C C 66 176.237 175.325 0.912 1
1 818 . 7 1 1 A 66 66 LEU CA C 66 53.687 52.897 0.790 1
1 819 . 7 1 1 A 66 66 LEU CB C 66 46.108 44.026 2.082 1
1 823 . 7 1 1 A 66 66 LEU N N 66 122.249 125.150 -2.901 1
1 824 . 7 1 1 A 67 67 TRP H H 67 8.916 9.329 -0.413 1
1 825 . 7 1 1 A 67 67 TRP HA H 67 5.526 5.392 0.134 1
1 834 . 7 1 1 A 67 67 TRP C C 67 175.670 175.581 0.089 1
1 835 . 7 1 1 A 67 67 TRP CA C 67 56.241 55.660 0.581 1
1 836 . 7 1 1 A 67 67 TRP CB C 67 33.314 33.123 0.191 1
1 842 . 7 1 1 A 67 67 TRP N N 67 121.160 124.329 -3.169 1
1 844 . 7 1 1 A 68 68 ARG H H 68 8.772 8.835 -0.063 1
1 845 . 7 1 1 A 68 68 ARG HA H 68 4.832 5.126 -0.294 1
1 853 . 7 1 1 A 68 68 ARG C C 68 174.720 174.683 0.037 1
1 854 . 7 1 1 A 68 68 ARG CA C 68 54.690 54.039 0.651 1
1 855 . 7 1 1 A 68 68 ARG CB C 68 35.176 34.406 0.770 1
1 858 . 7 1 1 A 68 68 ARG N N 68 117.471 119.983 -2.512 1
1 860 . 7 1 1 A 69 69 LEU H H 69 9.355 8.639 0.716 1
1 861 . 7 1 1 A 69 69 LEU HA H 69 4.557 5.307 -0.750 1
1 871 . 7 1 1 A 69 69 LEU C C 69 177.180 175.549 1.631 1
1 872 . 7 1 1 A 69 69 LEU CA C 69 55.780 52.663 3.117 1
1 873 . 7 1 1 A 69 69 LEU CB C 69 42.736 46.304 -3.568 1
1 877 . 7 1 1 A 69 69 LEU N N 69 125.211 116.210 9.001 1
1 878 . 7 1 1 A 70 70 LEU H H 70 8.058 8.607 -0.549 1
1 879 . 7 1 1 A 70 70 LEU HA H 70 4.364 4.980 -0.616 1
1 889 . 7 1 1 A 70 70 LEU C C 70 176.808 174.488 2.320 1
1 890 . 7 1 1 A 70 70 LEU CA C 70 55.257 53.047 2.210 1
1 891 . 7 1 1 A 70 70 LEU CB C 70 42.413 42.195 0.218 1
1 895 . 7 1 1 A 70 70 LEU N N 70 125.525 115.799 9.726 1
1 1 . 8 1 1 A 2 2 SER HA H 2 4.126 4.553 -0.427 1
1 4 . 8 1 1 A 2 2 SER CA C 2 57.564 60.549 -2.985 1
1 5 . 8 1 1 A 2 2 SER CB C 2 63.953 63.671 0.282 1
1 6 . 8 1 1 A 3 3 GLU HA H 3 4.408 4.448 -0.040 1
1 11 . 8 1 1 A 3 3 GLU C C 3 176.658 175.360 1.298 1
1 12 . 8 1 1 A 3 3 GLU CA C 3 56.802 56.543 0.259 1
1 13 . 8 1 1 A 3 3 GLU CB C 3 30.674 31.293 -0.619 1
1 15 . 8 1 1 A 4 4 SER H H 4 8.650 8.658 -0.008 1
1 16 . 8 1 1 A 4 4 SER HA H 4 4.463 4.631 -0.168 1
1 19 . 8 1 1 A 4 4 SER C C 4 175.949 175.545 0.404 1
1 20 . 8 1 1 A 4 4 SER CA C 4 58.557 59.544 -0.987 1
1 21 . 8 1 1 A 4 4 SER CB C 4 63.834 65.060 -1.226 1
1 22 . 8 1 1 A 4 4 SER N N 4 118.042 121.084 -3.042 1
1 23 . 8 1 1 A 5 5 ILE H H 5 8.404 7.848 0.556 1
1 24 . 8 1 1 A 5 5 ILE HA H 5 3.902 3.682 0.220 1
1 34 . 8 1 1 A 5 5 ILE C C 5 176.608 178.097 -1.489 1
1 35 . 8 1 1 A 5 5 ILE CA C 5 62.662 64.786 -2.124 1
1 36 . 8 1 1 A 5 5 ILE CB C 5 37.622 37.676 -0.054 1
1 40 . 8 1 1 A 5 5 ILE N N 5 124.711 121.853 2.858 1
1 41 . 8 1 1 A 6 6 VAL H H 6 7.602 7.983 -0.381 1
1 42 . 8 1 1 A 6 6 VAL HA H 6 3.293 3.537 -0.244 1
1 50 . 8 1 1 A 6 6 VAL C C 6 177.088 178.277 -1.189 1
1 51 . 8 1 1 A 6 6 VAL CA C 6 67.180 66.409 0.771 1
1 52 . 8 1 1 A 6 6 VAL CB C 6 31.517 31.289 0.228 1
1 55 . 8 1 1 A 6 6 VAL N N 6 119.974 119.887 0.087 1
1 56 . 8 1 1 A 7 7 THR H H 7 7.515 8.236 -0.721 1
1 57 . 8 1 1 A 7 7 THR HA H 7 3.823 3.867 -0.044 1
1 62 . 8 1 1 A 7 7 THR C C 7 176.978 176.090 0.888 1
1 63 . 8 1 1 A 7 7 THR CA C 7 66.257 67.351 -1.094 1
1 64 . 8 1 1 A 7 7 THR CB C 7 68.410 68.242 0.168 1
1 66 . 8 1 1 A 7 7 THR N N 7 114.177 116.947 -2.770 1
1 67 . 8 1 1 A 8 8 LYS H H 8 7.807 8.134 -0.327 1
1 68 . 8 1 1 A 8 8 LYS HA H 8 4.066 3.968 0.098 1
1 77 . 8 1 1 A 8 8 LYS C C 8 178.733 178.305 0.428 1
1 78 . 8 1 1 A 8 8 LYS CA C 8 59.338 59.586 -0.248 1
1 79 . 8 1 1 A 8 8 LYS CB C 8 32.002 32.162 -0.160 1
1 83 . 8 1 1 A 8 8 LYS N N 8 123.387 120.460 2.927 1
1 84 . 8 1 1 A 9 9 ILE H H 9 8.288 8.124 0.164 1
1 85 . 8 1 1 A 9 9 ILE HA H 9 3.421 3.623 -0.202 1
1 95 . 8 1 1 A 9 9 ILE C C 9 177.187 178.477 -1.290 1
1 96 . 8 1 1 A 9 9 ILE CA C 9 65.772 65.927 -0.155 1
1 97 . 8 1 1 A 9 9 ILE CB C 9 37.183 37.980 -0.797 1
1 101 . 8 1 1 A 9 9 ILE N N 9 119.543 119.515 0.028 1
1 102 . 8 1 1 A 10 10 ILE H H 10 8.073 8.027 0.046 1
1 103 . 8 1 1 A 10 10 ILE HA H 10 3.305 3.520 -0.215 1
1 113 . 8 1 1 A 10 10 ILE C C 10 177.308 177.811 -0.503 1
1 114 . 8 1 1 A 10 10 ILE CA C 10 66.704 65.374 1.330 1
1 115 . 8 1 1 A 10 10 ILE CB C 10 37.840 37.936 -0.096 1
1 119 . 8 1 1 A 10 10 ILE N N 10 119.219 120.981 -1.762 1
1 120 . 8 1 1 A 11 11 SER H H 11 7.861 7.736 0.125 1
1 121 . 8 1 1 A 11 11 SER HA H 11 4.250 4.055 0.195 1
1 124 . 8 1 1 A 11 11 SER C C 11 176.918 175.923 0.995 1
1 125 . 8 1 1 A 11 11 SER CA C 11 61.911 62.470 -0.559 1
1 126 . 8 1 1 A 11 11 SER CB C 11 62.998 62.947 0.051 1
1 127 . 8 1 1 A 11 11 SER N N 11 113.959 115.566 -1.607 1
1 128 . 8 1 1 A 12 12 ILE H H 12 8.250 7.979 0.271 1
1 129 . 8 1 1 A 12 12 ILE HA H 12 3.801 3.640 0.161 1
1 139 . 8 1 1 A 12 12 ILE C C 12 178.130 178.368 -0.238 1
1 140 . 8 1 1 A 12 12 ILE CA C 12 65.023 64.914 0.109 1
1 141 . 8 1 1 A 12 12 ILE CB C 12 38.195 37.730 0.465 1
1 145 . 8 1 1 A 12 12 ILE N N 12 123.767 121.316 2.451 1
1 146 . 8 1 1 A 13 13 VAL H H 13 8.308 8.221 0.087 1
1 147 . 8 1 1 A 13 13 VAL HA H 13 3.435 3.495 -0.060 1
1 155 . 8 1 1 A 13 13 VAL C C 13 177.283 178.093 -0.810 1
1 156 . 8 1 1 A 13 13 VAL CA C 13 67.693 66.887 0.806 1
1 157 . 8 1 1 A 13 13 VAL CB C 13 31.139 31.395 -0.256 1
1 160 . 8 1 1 A 13 13 VAL N N 13 120.066 120.106 -0.040 1
1 161 . 8 1 1 A 14 14 GLN H H 14 8.612 8.274 0.338 1
1 162 . 8 1 1 A 14 14 GLN HA H 14 3.831 4.034 -0.203 1
1 169 . 8 1 1 A 14 14 GLN C C 14 178.256 178.497 -0.241 1
1 170 . 8 1 1 A 14 14 GLN CA C 14 59.660 59.271 0.389 1
1 171 . 8 1 1 A 14 14 GLN CB C 14 29.456 28.128 1.328 1
1 174 . 8 1 1 A 14 14 GLN N N 14 118.099 119.732 -1.633 1
1 176 . 8 1 1 A 15 15 GLU H H 15 8.378 8.472 -0.094 1
1 177 . 8 1 1 A 15 15 GLU HA H 15 4.110 4.058 0.052 1
1 182 . 8 1 1 A 15 15 GLU C C 15 179.659 179.246 0.413 1
1 183 . 8 1 1 A 15 15 GLU CA C 15 59.476 59.573 -0.097 1
1 184 . 8 1 1 A 15 15 GLU CB C 15 29.725 29.051 0.674 1
1 186 . 8 1 1 A 15 15 GLU N N 15 118.580 119.403 -0.823 1
1 187 . 8 1 1 A 16 16 ARG H H 16 8.439 8.063 0.376 1
1 188 . 8 1 1 A 16 16 ARG HA H 16 4.157 4.074 0.083 1
1 196 . 8 1 1 A 16 16 ARG C C 16 179.276 178.807 0.469 1
1 197 . 8 1 1 A 16 16 ARG CA C 16 58.141 59.663 -1.522 1
1 198 . 8 1 1 A 16 16 ARG CB C 16 29.434 29.999 -0.565 1
1 201 . 8 1 1 A 16 16 ARG N N 16 118.688 119.033 -0.345 1
1 203 . 8 1 1 A 17 17 GLN H H 17 8.861 7.614 1.247 1
1 204 . 8 1 1 A 17 17 GLN HA H 17 4.236 4.148 0.088 1
1 211 . 8 1 1 A 17 17 GLN C C 17 178.736 178.382 0.354 1
1 212 . 8 1 1 A 17 17 GLN CA C 17 59.683 58.608 1.075 1
1 213 . 8 1 1 A 17 17 GLN CB C 17 29.960 28.148 1.812 1
1 216 . 8 1 1 A 17 17 GLN N N 17 120.427 119.064 1.363 1
1 218 . 8 1 1 A 18 18 ASN H H 18 8.017 7.896 0.121 1
1 219 . 8 1 1 A 18 18 ASN HA H 18 4.605 4.633 -0.028 1
1 224 . 8 1 1 A 18 18 ASN C C 18 177.906 178.160 -0.254 1
1 225 . 8 1 1 A 18 18 ASN CA C 18 55.375 55.692 -0.317 1
1 226 . 8 1 1 A 18 18 ASN CB C 18 38.383 38.159 0.224 1
1 228 . 8 1 1 A 18 18 ASN N N 18 117.033 118.214 -1.181 1
1 230 . 8 1 1 A 19 19 MET H H 19 7.994 7.645 0.349 1
1 231 . 8 1 1 A 19 19 MET HA H 19 4.372 4.336 0.036 1
1 236 . 8 1 1 A 19 19 MET C C 19 176.518 175.665 0.853 1
1 237 . 8 1 1 A 19 19 MET CA C 19 57.623 58.369 -0.746 1
1 238 . 8 1 1 A 19 19 MET CB C 19 33.248 33.667 -0.419 1
1 240 . 8 1 1 A 19 19 MET N N 19 119.320 117.470 1.850 1
1 241 . 8 1 1 A 20 20 ASP H H 20 7.800 8.159 -0.359 1
1 242 . 8 1 1 A 20 20 ASP HA H 20 4.990 4.844 0.146 1
1 245 . 8 1 1 A 20 20 ASP C C 20 176.082 176.088 -0.006 1
1 246 . 8 1 1 A 20 20 ASP CA C 20 53.796 52.681 1.115 1
1 247 . 8 1 1 A 20 20 ASP CB C 20 40.409 41.336 -0.927 1
1 248 . 8 1 1 A 20 20 ASP N N 20 119.127 119.047 0.080 1
1 249 . 8 1 1 A 21 21 ASP H H 21 8.136 9.044 -0.908 1
1 250 . 8 1 1 A 21 21 ASP HA H 21 4.497 4.613 -0.116 1
1 253 . 8 1 1 A 21 21 ASP C C 21 176.264 176.658 -0.394 1
1 254 . 8 1 1 A 21 21 ASP CA C 21 55.508 56.128 -0.620 1
1 255 . 8 1 1 A 21 21 ASP CB C 21 40.063 39.878 0.185 1
1 256 . 8 1 1 A 21 21 ASP N N 21 118.276 125.540 -7.264 1
1 257 . 8 1 1 A 22 22 GLY H H 22 8.728 7.952 0.776 1
1 258 . 8 1 1 A 22 22 GLY HA2 H 22 4.189 4.013 0.176 1
1 259 . 8 1 1 A 22 22 GLY HA3 H 22 3.683 4.014 -0.331 1
1 260 . 8 1 1 A 22 22 GLY C C 22 174.304 172.956 1.348 1
1 261 . 8 1 1 A 22 22 GLY CA C 22 45.629 45.566 0.063 1
1 262 . 8 1 1 A 22 22 GLY N N 22 105.878 106.558 -0.680 1
1 263 . 8 1 1 A 23 23 ALA H H 23 7.473 7.388 0.085 1
1 264 . 8 1 1 A 23 23 ALA HA H 23 4.519 4.837 -0.318 1
1 268 . 8 1 1 A 23 23 ALA C C 23 174.065 174.668 -0.603 1
1 269 . 8 1 1 A 23 23 ALA CA C 23 51.142 49.684 1.458 1
1 270 . 8 1 1 A 23 23 ALA CB C 23 18.283 22.056 -3.773 1
1 271 . 8 1 1 A 23 23 ALA N N 23 125.323 121.990 3.333 1
1 272 . 8 1 1 A 24 24 PRO HA H 24 4.590 4.738 -0.148 1
1 279 . 8 1 1 A 24 24 PRO C C 24 175.253 176.171 -0.918 1
1 280 . 8 1 1 A 24 24 PRO CA C 24 62.186 62.340 -0.154 1
1 281 . 8 1 1 A 24 24 PRO CB C 24 32.931 32.422 0.509 1
1 284 . 8 1 1 A 25 25 VAL H H 25 9.334 8.815 0.519 1
1 285 . 8 1 1 A 25 25 VAL HA H 25 4.378 4.386 -0.008 1
1 293 . 8 1 1 A 25 25 VAL C C 25 176.439 175.753 0.686 1
1 294 . 8 1 1 A 25 25 VAL CA C 25 61.482 62.669 -1.187 1
1 295 . 8 1 1 A 25 25 VAL CB C 25 34.781 32.182 2.599 1
1 298 . 8 1 1 A 25 25 VAL N N 25 120.408 121.715 -1.307 1
1 299 . 8 1 1 A 26 26 LYS H H 26 9.300 8.782 0.518 1
1 300 . 8 1 1 A 26 26 LYS HA H 26 4.982 4.647 0.335 1
1 309 . 8 1 1 A 26 26 LYS C C 26 179.008 177.783 1.225 1
1 310 . 8 1 1 A 26 26 LYS CA C 26 56.908 54.775 2.133 1
1 311 . 8 1 1 A 26 26 LYS CB C 26 34.071 34.182 -0.111 1
1 315 . 8 1 1 A 26 26 LYS N N 26 126.177 124.653 1.524 1
1 316 . 8 1 1 A 27 27 THR H H 27 8.618 8.946 -0.328 1
1 317 . 8 1 1 A 27 27 THR HA H 27 3.662 4.038 -0.376 1
1 322 . 8 1 1 A 27 27 THR C C 27 176.442 176.224 0.218 1
1 323 . 8 1 1 A 27 27 THR CA C 27 67.591 66.609 0.982 1
1 324 . 8 1 1 A 27 27 THR CB C 27 68.868 68.912 -0.044 1
1 326 . 8 1 1 A 27 27 THR N N 27 119.020 117.639 1.381 1
1 327 . 8 1 1 A 28 28 ARG H H 28 9.288 8.234 1.054 1
1 328 . 8 1 1 A 28 28 ARG HA H 28 3.879 4.057 -0.178 1
1 335 . 8 1 1 A 28 28 ARG C C 28 176.884 178.886 -2.002 1
1 336 . 8 1 1 A 28 28 ARG CA C 28 59.431 59.714 -0.283 1
1 337 . 8 1 1 A 28 28 ARG CB C 28 29.953 30.275 -0.322 1
1 340 . 8 1 1 A 28 28 ARG N N 28 119.100 120.931 -1.831 1
1 341 . 8 1 1 A 29 29 ASP H H 29 6.907 8.286 -1.379 1
1 342 . 8 1 1 A 29 29 ASP HA H 29 4.550 4.448 0.102 1
1 345 . 8 1 1 A 29 29 ASP C C 29 179.050 178.932 0.118 1
1 346 . 8 1 1 A 29 29 ASP CA C 29 57.262 57.277 -0.015 1
1 347 . 8 1 1 A 29 29 ASP CB C 29 40.191 40.941 -0.750 1
1 348 . 8 1 1 A 29 29 ASP N N 29 117.490 119.602 -2.112 1
1 349 . 8 1 1 A 30 30 ILE H H 30 7.554 7.943 -0.389 1
1 350 . 8 1 1 A 30 30 ILE HA H 30 3.595 3.574 0.021 1
1 360 . 8 1 1 A 30 30 ILE C C 30 176.907 177.801 -0.894 1
1 361 . 8 1 1 A 30 30 ILE CA C 30 65.002 65.936 -0.934 1
1 362 . 8 1 1 A 30 30 ILE CB C 30 37.999 38.634 -0.635 1
1 366 . 8 1 1 A 30 30 ILE N N 30 120.978 120.867 0.111 1
1 367 . 8 1 1 A 31 31 ALA H H 31 8.269 8.543 -0.274 1
1 368 . 8 1 1 A 31 31 ALA HA H 31 3.720 3.940 -0.220 1
1 372 . 8 1 1 A 31 31 ALA C C 31 179.170 179.166 0.004 1
1 373 . 8 1 1 A 31 31 ALA CA C 31 56.354 55.845 0.509 1
1 374 . 8 1 1 A 31 31 ALA CB C 31 17.843 18.376 -0.533 1
1 375 . 8 1 1 A 31 31 ALA N N 31 121.171 121.934 -0.763 1
1 376 . 8 1 1 A 32 32 ASP H H 32 8.293 8.313 -0.020 1
1 377 . 8 1 1 A 32 32 ASP HA H 32 4.422 4.326 0.096 1
1 380 . 8 1 1 A 32 32 ASP C C 32 179.136 178.182 0.954 1
1 381 . 8 1 1 A 32 32 ASP CA C 32 57.109 57.363 -0.254 1
1 382 . 8 1 1 A 32 32 ASP CB C 32 40.523 41.407 -0.884 1
1 383 . 8 1 1 A 32 32 ASP N N 32 116.467 118.265 -1.798 1
1 384 . 8 1 1 A 33 33 ALA H H 33 7.536 7.816 -0.280 1
1 385 . 8 1 1 A 33 33 ALA HA H 33 4.222 4.002 0.220 1
1 389 . 8 1 1 A 33 33 ALA C C 33 179.056 180.112 -1.056 1
1 390 . 8 1 1 A 33 33 ALA CA C 33 54.469 54.845 -0.376 1
1 391 . 8 1 1 A 33 33 ALA CB C 33 19.085 18.157 0.928 1
1 392 . 8 1 1 A 33 33 ALA N N 33 120.859 121.610 -0.751 1
1 393 . 8 1 1 A 34 34 ALA H H 34 8.296 7.739 0.557 1
1 394 . 8 1 1 A 34 34 ALA HA H 34 4.101 4.303 -0.202 1
1 398 . 8 1 1 A 34 34 ALA C C 34 176.912 178.099 -1.187 1
1 399 . 8 1 1 A 34 34 ALA CA C 34 52.380 52.520 -0.140 1
1 400 . 8 1 1 A 34 34 ALA CB C 34 18.817 19.735 -0.918 1
1 401 . 8 1 1 A 34 34 ALA N N 34 118.203 117.660 0.543 1
1 402 . 8 1 1 A 35 35 GLY H H 35 7.911 8.623 -0.712 1
1 403 . 8 1 1 A 35 35 GLY HA2 H 35 3.968 3.970 -0.002 1
1 404 . 8 1 1 A 35 35 GLY HA3 H 35 3.968 3.970 -0.002 1
1 405 . 8 1 1 A 35 35 GLY C C 35 174.374 174.057 0.317 1
1 406 . 8 1 1 A 35 35 GLY CA C 35 46.388 46.575 -0.187 1
1 407 . 8 1 1 A 35 35 GLY N N 35 107.752 107.887 -0.135 1
1 408 . 8 1 1 A 36 36 LEU H H 36 7.758 7.412 0.346 1
1 409 . 8 1 1 A 36 36 LEU HA H 36 4.887 4.918 -0.031 1
1 419 . 8 1 1 A 36 36 LEU C C 36 175.941 175.404 0.537 1
1 420 . 8 1 1 A 36 36 LEU CA C 36 52.443 52.927 -0.484 1
1 421 . 8 1 1 A 36 36 LEU CB C 36 47.885 45.868 2.017 1
1 425 . 8 1 1 A 36 36 LEU N N 36 118.719 120.256 -1.537 1
1 426 . 8 1 1 A 37 37 SER H H 37 8.603 8.320 0.283 1
1 427 . 8 1 1 A 37 37 SER HA H 37 4.565 4.477 0.088 1
1 430 . 8 1 1 A 37 37 SER C C 37 175.512 175.583 -0.071 1
1 431 . 8 1 1 A 37 37 SER CA C 37 57.262 58.887 -1.625 1
1 432 . 8 1 1 A 37 37 SER CB C 37 65.155 63.579 1.576 1
1 433 . 8 1 1 A 37 37 SER N N 37 115.095 116.199 -1.104 1
1 434 . 8 1 1 A 38 38 ILE H H 38 8.822 8.749 0.073 1
1 435 . 8 1 1 A 38 38 ILE HA H 38 3.650 3.719 -0.069 1
1 445 . 8 1 1 A 38 38 ILE C C 38 176.849 177.319 -0.470 1
1 446 . 8 1 1 A 38 38 ILE CA C 38 64.557 65.196 -0.639 1
1 447 . 8 1 1 A 38 38 ILE CB C 38 37.451 38.046 -0.595 1
1 451 . 8 1 1 A 38 38 ILE N N 38 122.026 124.621 -2.595 1
1 452 . 8 1 1 A 39 39 TYR H H 39 7.839 8.442 -0.603 1
1 453 . 8 1 1 A 39 39 TYR HA H 39 4.112 3.971 0.141 1
1 460 . 8 1 1 A 39 39 TYR C C 39 177.703 177.373 0.330 1
1 461 . 8 1 1 A 39 39 TYR CA C 39 60.856 62.012 -1.156 1
1 462 . 8 1 1 A 39 39 TYR CB C 39 38.402 38.577 -0.175 1
1 467 . 8 1 1 A 39 39 TYR N N 39 118.759 120.704 -1.945 1
1 468 . 8 1 1 A 40 40 GLN H H 40 7.687 8.128 -0.441 1
1 469 . 8 1 1 A 40 40 GLN HA H 40 3.865 3.741 0.124 1
1 476 . 8 1 1 A 40 40 GLN C C 40 178.735 178.259 0.476 1
1 477 . 8 1 1 A 40 40 GLN CA C 40 58.089 58.479 -0.390 1
1 478 . 8 1 1 A 40 40 GLN CB C 40 29.950 28.328 1.622 1
1 481 . 8 1 1 A 40 40 GLN N N 40 116.772 118.290 -1.518 1
1 483 . 8 1 1 A 41 41 VAL H H 41 8.494 8.045 0.449 1
1 484 . 8 1 1 A 41 41 VAL HA H 41 3.835 3.315 0.520 1
1 492 . 8 1 1 A 41 41 VAL C C 41 176.977 177.623 -0.646 1
1 493 . 8 1 1 A 41 41 VAL CA C 41 66.102 66.585 -0.483 1
1 494 . 8 1 1 A 41 41 VAL CB C 41 31.105 31.392 -0.287 1
1 497 . 8 1 1 A 41 41 VAL N N 41 117.192 119.806 -2.614 1
1 498 . 8 1 1 A 42 42 ARG H H 42 8.179 8.391 -0.212 1
1 499 . 8 1 1 A 42 42 ARG HA H 42 3.708 3.891 -0.183 1
1 506 . 8 1 1 A 42 42 ARG C C 42 177.570 178.514 -0.944 1
1 507 . 8 1 1 A 42 42 ARG CA C 42 60.349 59.762 0.587 1
1 508 . 8 1 1 A 42 42 ARG CB C 42 30.047 29.748 0.299 1
1 511 . 8 1 1 A 42 42 ARG N N 42 120.574 119.849 0.725 1
1 512 . 8 1 1 A 43 43 LEU H H 43 6.982 7.567 -0.585 1
1 513 . 8 1 1 A 43 43 LEU HA H 43 3.939 3.839 0.100 1
1 523 . 8 1 1 A 43 43 LEU C C 43 180.397 178.715 1.682 1
1 524 . 8 1 1 A 43 43 LEU CA C 43 58.119 57.934 0.185 1
1 525 . 8 1 1 A 43 43 LEU CB C 43 41.294 41.571 -0.277 1
1 529 . 8 1 1 A 43 43 LEU N N 43 117.189 118.574 -1.385 1
1 530 . 8 1 1 A 44 44 TYR H H 44 7.026 7.544 -0.518 1
1 531 . 8 1 1 A 44 44 TYR HA H 44 4.253 4.253 0.000 1
1 538 . 8 1 1 A 44 44 TYR C C 44 178.411 178.171 0.240 1
1 539 . 8 1 1 A 44 44 TYR CA C 44 60.941 60.684 0.257 1
1 540 . 8 1 1 A 44 44 TYR CB C 44 38.889 38.202 0.687 1
1 545 . 8 1 1 A 44 44 TYR N N 44 117.020 117.804 -0.784 1
1 546 . 8 1 1 A 45 45 LEU H H 45 8.429 8.644 -0.215 1
1 547 . 8 1 1 A 45 45 LEU HA H 45 3.486 3.484 0.002 1
1 557 . 8 1 1 A 45 45 LEU C C 45 178.648 178.909 -0.261 1
1 558 . 8 1 1 A 45 45 LEU CA C 45 57.915 57.507 0.408 1
1 559 . 8 1 1 A 45 45 LEU CB C 45 39.073 40.414 -1.341 1
1 563 . 8 1 1 A 45 45 LEU N N 45 119.649 119.901 -0.252 1
1 564 . 8 1 1 A 46 46 GLU H H 46 8.309 8.004 0.305 1
1 565 . 8 1 1 A 46 46 GLU HA H 46 4.286 4.098 0.188 1
1 570 . 8 1 1 A 46 46 GLU C C 46 179.577 179.683 -0.106 1
1 571 . 8 1 1 A 46 46 GLU CA C 46 59.570 59.857 -0.287 1
1 572 . 8 1 1 A 46 46 GLU CB C 46 29.034 29.470 -0.436 1
1 574 . 8 1 1 A 46 46 GLU N N 46 117.366 117.394 -0.028 1
1 575 . 8 1 1 A 47 47 GLN H H 47 7.493 8.139 -0.646 1
1 576 . 8 1 1 A 47 47 GLN HA H 47 4.243 3.962 0.281 1
1 583 . 8 1 1 A 47 47 GLN C C 47 178.870 178.936 -0.066 1
1 584 . 8 1 1 A 47 47 GLN CA C 47 59.581 58.854 0.727 1
1 585 . 8 1 1 A 47 47 GLN CB C 47 28.300 28.037 0.263 1
1 588 . 8 1 1 A 47 47 GLN N N 47 119.345 119.140 0.205 1
1 590 . 8 1 1 A 48 48 LEU H H 48 8.160 8.478 -0.318 1
1 591 . 8 1 1 A 48 48 LEU HA H 48 4.211 3.992 0.219 1
1 601 . 8 1 1 A 48 48 LEU C C 48 180.111 179.125 0.986 1
1 602 . 8 1 1 A 48 48 LEU CA C 48 57.179 57.681 -0.502 1
1 603 . 8 1 1 A 48 48 LEU CB C 48 42.067 40.954 1.113 1
1 607 . 8 1 1 A 48 48 LEU N N 48 118.594 119.545 -0.951 1
1 608 . 8 1 1 A 49 49 HIS H H 49 8.864 8.031 0.833 1
1 609 . 8 1 1 A 49 49 HIS HA H 49 5.162 4.675 0.487 1
1 613 . 8 1 1 A 49 49 HIS C C 49 178.801 176.811 1.990 1
1 614 . 8 1 1 A 49 49 HIS CA C 49 58.397 59.548 -1.151 1
1 615 . 8 1 1 A 49 49 HIS CB C 49 29.631 29.883 -0.252 1
1 617 . 8 1 1 A 49 49 HIS N N 49 122.537 118.136 4.401 1
1 618 . 8 1 1 A 50 50 ASP H H 50 8.683 8.262 0.421 1
1 619 . 8 1 1 A 50 50 ASP HA H 50 4.356 4.149 0.207 1
1 622 . 8 1 1 A 50 50 ASP C C 50 178.474 178.268 0.206 1
1 623 . 8 1 1 A 50 50 ASP CA C 50 57.744 57.352 0.392 1
1 624 . 8 1 1 A 50 50 ASP CB C 50 40.575 41.313 -0.738 1
1 625 . 8 1 1 A 50 50 ASP N N 50 123.169 118.418 4.751 1
1 626 . 8 1 1 A 51 51 VAL H H 51 7.606 7.987 -0.381 1
1 627 . 8 1 1 A 51 51 VAL HA H 51 4.514 4.108 0.406 1
1 635 . 8 1 1 A 51 51 VAL C C 51 176.862 176.266 0.596 1
1 636 . 8 1 1 A 51 51 VAL CA C 51 61.590 62.214 -0.624 1
1 637 . 8 1 1 A 51 51 VAL CB C 51 31.423 31.592 -0.169 1
1 640 . 8 1 1 A 51 51 VAL N N 51 109.266 111.999 -2.733 1
1 641 . 8 1 1 A 52 52 GLY H H 52 7.696 7.767 -0.071 1
1 642 . 8 1 1 A 52 52 GLY HA2 H 52 4.172 3.994 0.178 1
1 643 . 8 1 1 A 52 52 GLY HA3 H 52 3.938 3.998 -0.060 1
1 644 . 8 1 1 A 52 52 GLY C C 52 174.276 174.662 -0.386 1
1 645 . 8 1 1 A 52 52 GLY CA C 52 46.228 46.347 -0.119 1
1 646 . 8 1 1 A 52 52 GLY N N 52 108.681 110.734 -2.053 1
1 647 . 8 1 1 A 53 53 VAL H H 53 8.046 8.333 -0.287 1
1 648 . 8 1 1 A 53 53 VAL HA H 53 4.079 4.101 -0.022 1
1 656 . 8 1 1 A 53 53 VAL C C 53 175.949 175.666 0.283 1
1 657 . 8 1 1 A 53 53 VAL CA C 53 64.063 64.073 -0.010 1
1 658 . 8 1 1 A 53 53 VAL CB C 53 33.160 32.738 0.422 1
1 661 . 8 1 1 A 53 53 VAL N N 53 117.892 117.264 0.628 1
1 662 . 8 1 1 A 54 54 LEU H H 54 6.835 7.651 -0.816 1
1 663 . 8 1 1 A 54 54 LEU HA H 54 5.348 4.989 0.359 1
1 673 . 8 1 1 A 54 54 LEU C C 54 175.713 176.301 -0.588 1
1 674 . 8 1 1 A 54 54 LEU CA C 54 52.194 53.325 -1.131 1
1 675 . 8 1 1 A 54 54 LEU CB C 54 46.733 43.429 3.304 1
1 679 . 8 1 1 A 54 54 LEU N N 54 114.848 118.528 -3.680 1
1 680 . 8 1 1 A 55 55 GLU H H 55 9.549 9.194 0.355 1
1 681 . 8 1 1 A 55 55 GLU HA H 55 4.826 4.818 0.008 1
1 686 . 8 1 1 A 55 55 GLU C C 55 174.661 175.914 -1.253 1
1 687 . 8 1 1 A 55 55 GLU CA C 55 54.637 55.760 -1.123 1
1 688 . 8 1 1 A 55 55 GLU CB C 55 32.891 31.237 1.654 1
1 690 . 8 1 1 A 55 55 GLU N N 55 121.431 123.237 -1.806 1
1 691 . 8 1 1 A 56 56 LYS H H 56 8.513 8.339 0.174 1
1 692 . 8 1 1 A 56 56 LYS HA H 56 4.151 4.191 -0.040 1
1 701 . 8 1 1 A 56 56 LYS C C 56 176.270 174.761 1.509 1
1 702 . 8 1 1 A 56 56 LYS CA C 56 54.890 55.663 -0.773 1
1 703 . 8 1 1 A 56 56 LYS CB C 56 33.162 32.877 0.285 1
1 707 . 8 1 1 A 56 56 LYS N N 56 126.539 126.985 -0.446 1
1 708 . 8 1 1 A 57 57 VAL H H 57 8.279 8.768 -0.489 1
1 709 . 8 1 1 A 57 57 VAL HA H 57 3.820 4.495 -0.675 1
1 717 . 8 1 1 A 57 57 VAL C C 57 175.108 173.748 1.360 1
1 718 . 8 1 1 A 57 57 VAL CA C 57 62.834 61.512 1.322 1
1 719 . 8 1 1 A 57 57 VAL CB C 57 32.549 32.499 0.050 1
1 722 . 8 1 1 A 57 57 VAL N N 57 126.540 127.861 -1.321 1
1 723 . 8 1 1 A 58 58 ASN H H 58 8.383 8.794 -0.411 1
1 724 . 8 1 1 A 58 58 ASN HA H 58 4.612 5.057 -0.445 1
1 729 . 8 1 1 A 58 58 ASN C C 58 174.772 175.084 -0.312 1
1 730 . 8 1 1 A 58 58 ASN CA C 58 52.575 51.462 1.113 1
1 731 . 8 1 1 A 58 58 ASN CB C 58 38.502 40.231 -1.729 1
1 733 . 8 1 1 A 58 58 ASN N N 58 121.767 127.218 -5.451 1
1 735 . 8 1 1 A 59 59 ALA H H 59 8.165 8.506 -0.341 1
1 736 . 8 1 1 A 59 59 ALA HA H 59 4.251 4.329 -0.078 1
1 740 . 8 1 1 A 59 59 ALA C C 59 177.478 176.719 0.759 1
1 741 . 8 1 1 A 59 59 ALA CA C 59 52.490 51.865 0.625 1
1 742 . 8 1 1 A 59 59 ALA CB C 59 19.724 19.328 0.396 1
1 743 . 8 1 1 A 59 59 ALA N N 59 125.082 127.784 -2.702 1
1 744 . 8 1 1 A 60 60 GLY H H 60 8.291 7.221 1.070 1
1 745 . 8 1 1 A 60 60 GLY HA2 H 60 4.165 4.085 0.080 1
1 746 . 8 1 1 A 60 60 GLY HA3 H 60 3.853 4.088 -0.235 1
1 747 . 8 1 1 A 60 60 GLY C C 60 174.171 172.239 1.932 1
1 748 . 8 1 1 A 60 60 GLY CA C 60 44.994 44.228 0.766 1
1 749 . 8 1 1 A 60 60 GLY N N 60 108.518 105.879 2.639 1
1 750 . 8 1 1 A 61 61 LYS H H 61 8.189 8.412 -0.223 1
1 751 . 8 1 1 A 61 61 LYS HA H 61 4.320 4.225 0.095 1
1 760 . 8 1 1 A 61 61 LYS C C 61 177.712 177.259 0.453 1
1 761 . 8 1 1 A 61 61 LYS CA C 61 56.832 57.024 -0.192 1
1 762 . 8 1 1 A 61 61 LYS CB C 61 32.641 33.290 -0.649 1
1 766 . 8 1 1 A 61 61 LYS N N 61 120.532 120.888 -0.356 1
1 767 . 8 1 1 A 62 62 GLY H H 62 8.767 8.825 -0.058 1
1 768 . 8 1 1 A 62 62 GLY HA2 H 62 4.021 3.957 0.064 1
1 769 . 8 1 1 A 62 62 GLY HA3 H 62 3.849 3.959 -0.110 1
1 770 . 8 1 1 A 62 62 GLY C C 62 173.782 174.267 -0.485 1
1 771 . 8 1 1 A 62 62 GLY CA C 62 45.844 45.450 0.394 1
1 772 . 8 1 1 A 62 62 GLY N N 62 111.547 111.353 0.194 1
1 773 . 8 1 1 A 63 63 VAL H H 63 7.379 7.712 -0.333 1
1 774 . 8 1 1 A 63 63 VAL HA H 63 4.591 4.188 0.403 1
1 782 . 8 1 1 A 63 63 VAL C C 63 174.262 175.212 -0.950 1
1 783 . 8 1 1 A 63 63 VAL CA C 63 59.292 60.592 -1.300 1
1 784 . 8 1 1 A 63 63 VAL CB C 63 32.726 31.808 0.918 1
1 787 . 8 1 1 A 63 63 VAL N N 63 117.546 119.481 -1.935 1
1 788 . 8 1 1 A 64 64 PRO HA H 64 4.458 4.547 -0.089 1
1 795 . 8 1 1 A 64 64 PRO C C 64 177.166 176.071 1.095 1
1 796 . 8 1 1 A 64 64 PRO CA C 64 63.661 62.104 1.557 1
1 797 . 8 1 1 A 64 64 PRO CB C 64 32.321 32.975 -0.654 1
1 800 . 8 1 1 A 65 65 GLY H H 65 8.463 8.301 0.162 1
1 801 . 8 1 1 A 65 65 GLY HA2 H 65 3.882 3.522 0.360 1
1 802 . 8 1 1 A 65 65 GLY HA3 H 65 3.602 3.649 -0.047 1
1 803 . 8 1 1 A 65 65 GLY C C 65 172.406 172.556 -0.150 1
1 804 . 8 1 1 A 65 65 GLY CA C 65 45.933 45.279 0.654 1
1 805 . 8 1 1 A 65 65 GLY N N 65 109.819 108.422 1.397 1
1 806 . 8 1 1 A 66 66 LEU H H 66 7.534 8.477 -0.943 1
1 807 . 8 1 1 A 66 66 LEU HA H 66 4.940 4.081 0.859 1
1 817 . 8 1 1 A 66 66 LEU C C 66 176.237 176.417 -0.180 1
1 818 . 8 1 1 A 66 66 LEU CA C 66 53.687 54.885 -1.198 1
1 819 . 8 1 1 A 66 66 LEU CB C 66 46.108 42.312 3.796 1
1 823 . 8 1 1 A 66 66 LEU N N 66 122.249 126.398 -4.149 1
1 824 . 8 1 1 A 67 67 TRP H H 67 8.916 9.150 -0.234 1
1 825 . 8 1 1 A 67 67 TRP HA H 67 5.526 5.297 0.229 1
1 834 . 8 1 1 A 67 67 TRP C C 67 175.670 175.065 0.605 1
1 835 . 8 1 1 A 67 67 TRP CA C 67 56.241 55.397 0.844 1
1 836 . 8 1 1 A 67 67 TRP CB C 67 33.314 31.361 1.953 1
1 842 . 8 1 1 A 67 67 TRP N N 67 121.160 125.035 -3.875 1
1 844 . 8 1 1 A 68 68 ARG H H 68 8.772 8.843 -0.071 1
1 845 . 8 1 1 A 68 68 ARG HA H 68 4.832 5.159 -0.327 1
1 853 . 8 1 1 A 68 68 ARG C C 68 174.720 175.325 -0.605 1
1 854 . 8 1 1 A 68 68 ARG CA C 68 54.690 54.041 0.649 1
1 855 . 8 1 1 A 68 68 ARG CB C 68 35.176 33.462 1.714 1
1 858 . 8 1 1 A 68 68 ARG N N 68 117.471 125.631 -8.160 1
1 860 . 8 1 1 A 69 69 LEU H H 69 9.355 7.911 1.444 1
1 861 . 8 1 1 A 69 69 LEU HA H 69 4.557 4.911 -0.354 1
1 871 . 8 1 1 A 69 69 LEU C C 69 177.180 176.409 0.771 1
1 872 . 8 1 1 A 69 69 LEU CA C 69 55.780 53.015 2.765 1
1 873 . 8 1 1 A 69 69 LEU CB C 69 42.736 44.384 -1.648 1
1 877 . 8 1 1 A 69 69 LEU N N 69 125.211 119.889 5.322 1
1 878 . 8 1 1 A 70 70 LEU H H 70 8.058 8.525 -0.467 1
1 879 . 8 1 1 A 70 70 LEU HA H 70 4.364 4.273 0.091 1
1 889 . 8 1 1 A 70 70 LEU C C 70 176.808 175.887 0.921 1
1 890 . 8 1 1 A 70 70 LEU CA C 70 55.257 54.584 0.673 1
1 891 . 8 1 1 A 70 70 LEU CB C 70 42.413 40.674 1.739 1
1 895 . 8 1 1 A 70 70 LEU N N 70 125.525 121.250 4.275 1
1 1 . 9 1 1 A 2 2 SER HA H 2 4.126 4.533 -0.407 1
1 4 . 9 1 1 A 2 2 SER CA C 2 57.564 57.866 -0.302 1
1 5 . 9 1 1 A 2 2 SER CB C 2 63.953 63.084 0.869 1
1 6 . 9 1 1 A 3 3 GLU HA H 3 4.408 4.765 -0.357 1
1 11 . 9 1 1 A 3 3 GLU C C 3 176.658 176.560 0.098 1
1 12 . 9 1 1 A 3 3 GLU CA C 3 56.802 54.909 1.893 1
1 13 . 9 1 1 A 3 3 GLU CB C 3 30.674 32.473 -1.799 1
1 15 . 9 1 1 A 4 4 SER H H 4 8.650 9.171 -0.521 1
1 16 . 9 1 1 A 4 4 SER HA H 4 4.463 4.062 0.401 1
1 19 . 9 1 1 A 4 4 SER C C 4 175.949 176.624 -0.675 1
1 20 . 9 1 1 A 4 4 SER CA C 4 58.557 62.171 -3.614 1
1 21 . 9 1 1 A 4 4 SER CB C 4 63.834 62.943 0.891 1
1 22 . 9 1 1 A 4 4 SER N N 4 118.042 121.432 -3.390 1
1 23 . 9 1 1 A 5 5 ILE H H 5 8.404 7.464 0.940 1
1 24 . 9 1 1 A 5 5 ILE HA H 5 3.902 3.481 0.421 1
1 34 . 9 1 1 A 5 5 ILE C C 5 176.608 178.165 -1.557 1
1 35 . 9 1 1 A 5 5 ILE CA C 5 62.662 64.876 -2.214 1
1 36 . 9 1 1 A 5 5 ILE CB C 5 37.622 37.447 0.175 1
1 40 . 9 1 1 A 5 5 ILE N N 5 124.711 121.285 3.426 1
1 41 . 9 1 1 A 6 6 VAL H H 6 7.602 7.995 -0.393 1
1 42 . 9 1 1 A 6 6 VAL HA H 6 3.293 3.202 0.091 1
1 50 . 9 1 1 A 6 6 VAL C C 6 177.088 178.030 -0.942 1
1 51 . 9 1 1 A 6 6 VAL CA C 6 67.180 66.749 0.431 1
1 52 . 9 1 1 A 6 6 VAL CB C 6 31.517 31.427 0.090 1
1 55 . 9 1 1 A 6 6 VAL N N 6 119.974 119.640 0.334 1
1 56 . 9 1 1 A 7 7 THR H H 7 7.515 8.083 -0.568 1
1 57 . 9 1 1 A 7 7 THR HA H 7 3.823 3.859 -0.036 1
1 62 . 9 1 1 A 7 7 THR C C 7 176.978 176.412 0.566 1
1 63 . 9 1 1 A 7 7 THR CA C 7 66.257 67.147 -0.890 1
1 64 . 9 1 1 A 7 7 THR CB C 7 68.410 68.383 0.027 1
1 66 . 9 1 1 A 7 7 THR N N 7 114.177 116.232 -2.055 1
1 67 . 9 1 1 A 8 8 LYS H H 8 7.807 8.344 -0.537 1
1 68 . 9 1 1 A 8 8 LYS HA H 8 4.066 3.954 0.112 1
1 77 . 9 1 1 A 8 8 LYS C C 8 178.733 178.395 0.338 1
1 78 . 9 1 1 A 8 8 LYS CA C 8 59.338 59.840 -0.502 1
1 79 . 9 1 1 A 8 8 LYS CB C 8 32.002 32.261 -0.259 1
1 83 . 9 1 1 A 8 8 LYS N N 8 123.387 120.518 2.869 1
1 84 . 9 1 1 A 9 9 ILE H H 9 8.288 7.813 0.475 1
1 85 . 9 1 1 A 9 9 ILE HA H 9 3.421 3.557 -0.136 1
1 95 . 9 1 1 A 9 9 ILE C C 9 177.187 178.235 -1.048 1
1 96 . 9 1 1 A 9 9 ILE CA C 9 65.772 65.647 0.125 1
1 97 . 9 1 1 A 9 9 ILE CB C 9 37.183 37.855 -0.672 1
1 101 . 9 1 1 A 9 9 ILE N N 9 119.543 118.692 0.851 1
1 102 . 9 1 1 A 10 10 ILE H H 10 8.073 8.261 -0.188 1
1 103 . 9 1 1 A 10 10 ILE HA H 10 3.305 3.501 -0.196 1
1 113 . 9 1 1 A 10 10 ILE C C 10 177.308 178.194 -0.886 1
1 114 . 9 1 1 A 10 10 ILE CA C 10 66.704 65.240 1.464 1
1 115 . 9 1 1 A 10 10 ILE CB C 10 37.840 37.873 -0.033 1
1 119 . 9 1 1 A 10 10 ILE N N 10 119.219 120.149 -0.930 1
1 120 . 9 1 1 A 11 11 SER H H 11 7.861 8.191 -0.330 1
1 121 . 9 1 1 A 11 11 SER HA H 11 4.250 4.207 0.043 1
1 124 . 9 1 1 A 11 11 SER C C 11 176.918 177.162 -0.244 1
1 125 . 9 1 1 A 11 11 SER CA C 11 61.911 61.181 0.730 1
1 126 . 9 1 1 A 11 11 SER CB C 11 62.998 62.985 0.013 1
1 127 . 9 1 1 A 11 11 SER N N 11 113.959 115.343 -1.384 1
1 128 . 9 1 1 A 12 12 ILE H H 12 8.250 7.688 0.562 1
1 129 . 9 1 1 A 12 12 ILE HA H 12 3.801 3.777 0.024 1
1 139 . 9 1 1 A 12 12 ILE C C 12 178.130 177.947 0.183 1
1 140 . 9 1 1 A 12 12 ILE CA C 12 65.023 64.226 0.797 1
1 141 . 9 1 1 A 12 12 ILE CB C 12 38.195 37.695 0.500 1
1 145 . 9 1 1 A 12 12 ILE N N 12 123.767 122.030 1.737 1
1 146 . 9 1 1 A 13 13 VAL H H 13 8.308 8.096 0.212 1
1 147 . 9 1 1 A 13 13 VAL HA H 13 3.435 3.531 -0.096 1
1 155 . 9 1 1 A 13 13 VAL C C 13 177.283 177.938 -0.655 1
1 156 . 9 1 1 A 13 13 VAL CA C 13 67.693 66.423 1.270 1
1 157 . 9 1 1 A 13 13 VAL CB C 13 31.139 31.259 -0.120 1
1 160 . 9 1 1 A 13 13 VAL N N 13 120.066 119.688 0.378 1
1 161 . 9 1 1 A 14 14 GLN H H 14 8.612 8.198 0.414 1
1 162 . 9 1 1 A 14 14 GLN HA H 14 3.831 3.941 -0.110 1
1 169 . 9 1 1 A 14 14 GLN C C 14 178.256 178.158 0.098 1
1 170 . 9 1 1 A 14 14 GLN CA C 14 59.660 59.276 0.384 1
1 171 . 9 1 1 A 14 14 GLN CB C 14 29.456 28.414 1.042 1
1 174 . 9 1 1 A 14 14 GLN N N 14 118.099 119.677 -1.578 1
1 176 . 9 1 1 A 15 15 GLU H H 15 8.378 8.432 -0.054 1
1 177 . 9 1 1 A 15 15 GLU HA H 15 4.110 4.037 0.073 1
1 182 . 9 1 1 A 15 15 GLU C C 15 179.659 179.312 0.347 1
1 183 . 9 1 1 A 15 15 GLU CA C 15 59.476 59.556 -0.080 1
1 184 . 9 1 1 A 15 15 GLU CB C 15 29.725 29.193 0.532 1
1 186 . 9 1 1 A 15 15 GLU N N 15 118.580 119.662 -1.082 1
1 187 . 9 1 1 A 16 16 ARG H H 16 8.439 8.154 0.285 1
1 188 . 9 1 1 A 16 16 ARG HA H 16 4.157 4.136 0.021 1
1 196 . 9 1 1 A 16 16 ARG C C 16 179.276 178.814 0.462 1
1 197 . 9 1 1 A 16 16 ARG CA C 16 58.141 59.477 -1.336 1
1 198 . 9 1 1 A 16 16 ARG CB C 16 29.434 29.799 -0.365 1
1 201 . 9 1 1 A 16 16 ARG N N 16 118.688 119.044 -0.356 1
1 203 . 9 1 1 A 17 17 GLN H H 17 8.861 7.821 1.040 1
1 204 . 9 1 1 A 17 17 GLN HA H 17 4.236 4.077 0.159 1
1 211 . 9 1 1 A 17 17 GLN C C 17 178.736 178.718 0.018 1
1 212 . 9 1 1 A 17 17 GLN CA C 17 59.683 58.644 1.039 1
1 213 . 9 1 1 A 17 17 GLN CB C 17 29.960 28.236 1.724 1
1 216 . 9 1 1 A 17 17 GLN N N 17 120.427 118.571 1.856 1
1 218 . 9 1 1 A 18 18 ASN H H 18 8.017 8.302 -0.285 1
1 219 . 9 1 1 A 18 18 ASN HA H 18 4.605 4.605 0.000 1
1 224 . 9 1 1 A 18 18 ASN C C 18 177.906 177.275 0.631 1
1 225 . 9 1 1 A 18 18 ASN CA C 18 55.375 55.650 -0.275 1
1 226 . 9 1 1 A 18 18 ASN CB C 18 38.383 38.245 0.138 1
1 228 . 9 1 1 A 18 18 ASN N N 18 117.033 117.372 -0.339 1
1 230 . 9 1 1 A 19 19 MET H H 19 7.994 8.005 -0.011 1
1 231 . 9 1 1 A 19 19 MET HA H 19 4.372 4.378 -0.006 1
1 236 . 9 1 1 A 19 19 MET C C 19 176.518 175.816 0.702 1
1 237 . 9 1 1 A 19 19 MET CA C 19 57.623 57.083 0.540 1
1 238 . 9 1 1 A 19 19 MET CB C 19 33.248 32.981 0.267 1
1 240 . 9 1 1 A 19 19 MET N N 19 119.320 116.249 3.071 1
1 241 . 9 1 1 A 20 20 ASP H H 20 7.800 7.613 0.187 1
1 242 . 9 1 1 A 20 20 ASP HA H 20 4.990 4.869 0.121 1
1 245 . 9 1 1 A 20 20 ASP C C 20 176.082 175.505 0.577 1
1 246 . 9 1 1 A 20 20 ASP CA C 20 53.796 53.619 0.177 1
1 247 . 9 1 1 A 20 20 ASP CB C 20 40.409 42.611 -2.202 1
1 248 . 9 1 1 A 20 20 ASP N N 20 119.127 118.628 0.499 1
1 249 . 9 1 1 A 21 21 ASP H H 21 8.136 8.959 -0.823 1
1 250 . 9 1 1 A 21 21 ASP HA H 21 4.497 4.495 0.002 1
1 253 . 9 1 1 A 21 21 ASP C C 21 176.264 176.714 -0.450 1
1 254 . 9 1 1 A 21 21 ASP CA C 21 55.508 56.375 -0.867 1
1 255 . 9 1 1 A 21 21 ASP CB C 21 40.063 40.313 -0.250 1
1 256 . 9 1 1 A 21 21 ASP N N 21 118.276 124.768 -6.492 1
1 257 . 9 1 1 A 22 22 GLY H H 22 8.728 7.917 0.811 1
1 258 . 9 1 1 A 22 22 GLY HA2 H 22 4.189 4.015 0.174 1
1 259 . 9 1 1 A 22 22 GLY HA3 H 22 3.683 4.018 -0.335 1
1 260 . 9 1 1 A 22 22 GLY C C 22 174.304 173.543 0.761 1
1 261 . 9 1 1 A 22 22 GLY CA C 22 45.629 45.233 0.396 1
1 262 . 9 1 1 A 22 22 GLY N N 22 105.878 107.019 -1.141 1
1 263 . 9 1 1 A 23 23 ALA H H 23 7.473 7.395 0.078 1
1 264 . 9 1 1 A 23 23 ALA HA H 23 4.519 4.518 0.001 1
1 268 . 9 1 1 A 23 23 ALA C C 23 174.065 176.207 -2.142 1
1 269 . 9 1 1 A 23 23 ALA CA C 23 51.142 48.994 2.148 1
1 270 . 9 1 1 A 23 23 ALA CB C 23 18.283 20.511 -2.228 1
1 271 . 9 1 1 A 23 23 ALA N N 23 125.323 122.833 2.490 1
1 272 . 9 1 1 A 24 24 PRO HA H 24 4.590 4.700 -0.110 1
1 279 . 9 1 1 A 24 24 PRO C C 24 175.253 177.084 -1.831 1
1 280 . 9 1 1 A 24 24 PRO CA C 24 62.186 62.596 -0.410 1
1 281 . 9 1 1 A 24 24 PRO CB C 24 32.931 32.342 0.589 1
1 284 . 9 1 1 A 25 25 VAL H H 25 9.334 8.764 0.570 1
1 285 . 9 1 1 A 25 25 VAL HA H 25 4.378 4.330 0.048 1
1 293 . 9 1 1 A 25 25 VAL C C 25 176.439 175.984 0.455 1
1 294 . 9 1 1 A 25 25 VAL CA C 25 61.482 63.060 -1.578 1
1 295 . 9 1 1 A 25 25 VAL CB C 25 34.781 32.557 2.224 1
1 298 . 9 1 1 A 25 25 VAL N N 25 120.408 123.099 -2.691 1
1 299 . 9 1 1 A 26 26 LYS H H 26 9.300 8.774 0.526 1
1 300 . 9 1 1 A 26 26 LYS HA H 26 4.982 4.714 0.268 1
1 309 . 9 1 1 A 26 26 LYS C C 26 179.008 177.411 1.597 1
1 310 . 9 1 1 A 26 26 LYS CA C 26 56.908 54.626 2.282 1
1 311 . 9 1 1 A 26 26 LYS CB C 26 34.071 34.529 -0.458 1
1 315 . 9 1 1 A 26 26 LYS N N 26 126.177 124.310 1.867 1
1 316 . 9 1 1 A 27 27 THR H H 27 8.618 9.163 -0.545 1
1 317 . 9 1 1 A 27 27 THR HA H 27 3.662 3.996 -0.334 1
1 322 . 9 1 1 A 27 27 THR C C 27 176.442 176.199 0.243 1
1 323 . 9 1 1 A 27 27 THR CA C 27 67.591 66.859 0.732 1
1 324 . 9 1 1 A 27 27 THR CB C 27 68.868 69.177 -0.309 1
1 326 . 9 1 1 A 27 27 THR N N 27 119.020 117.644 1.376 1
1 327 . 9 1 1 A 28 28 ARG H H 28 9.288 8.239 1.049 1
1 328 . 9 1 1 A 28 28 ARG HA H 28 3.879 3.922 -0.043 1
1 335 . 9 1 1 A 28 28 ARG C C 28 176.884 178.572 -1.688 1
1 336 . 9 1 1 A 28 28 ARG CA C 28 59.431 59.359 0.072 1
1 337 . 9 1 1 A 28 28 ARG CB C 28 29.953 29.711 0.242 1
1 340 . 9 1 1 A 28 28 ARG N N 28 119.100 119.897 -0.797 1
1 341 . 9 1 1 A 29 29 ASP H H 29 6.907 8.242 -1.335 1
1 342 . 9 1 1 A 29 29 ASP HA H 29 4.550 4.394 0.156 1
1 345 . 9 1 1 A 29 29 ASP C C 29 179.050 178.612 0.438 1
1 346 . 9 1 1 A 29 29 ASP CA C 29 57.262 57.944 -0.682 1
1 347 . 9 1 1 A 29 29 ASP CB C 29 40.191 41.717 -1.526 1
1 348 . 9 1 1 A 29 29 ASP N N 29 117.490 118.781 -1.291 1
1 349 . 9 1 1 A 30 30 ILE H H 30 7.554 8.160 -0.606 1
1 350 . 9 1 1 A 30 30 ILE HA H 30 3.595 3.827 -0.232 1
1 360 . 9 1 1 A 30 30 ILE C C 30 176.907 177.704 -0.797 1
1 361 . 9 1 1 A 30 30 ILE CA C 30 65.002 65.522 -0.520 1
1 362 . 9 1 1 A 30 30 ILE CB C 30 37.999 37.664 0.335 1
1 366 . 9 1 1 A 30 30 ILE N N 30 120.978 119.667 1.311 1
1 367 . 9 1 1 A 31 31 ALA H H 31 8.269 8.157 0.112 1
1 368 . 9 1 1 A 31 31 ALA HA H 31 3.720 3.987 -0.267 1
1 372 . 9 1 1 A 31 31 ALA C C 31 179.170 179.216 -0.046 1
1 373 . 9 1 1 A 31 31 ALA CA C 31 56.354 55.350 1.004 1
1 374 . 9 1 1 A 31 31 ALA CB C 31 17.843 17.885 -0.042 1
1 375 . 9 1 1 A 31 31 ALA N N 31 121.171 122.220 -1.049 1
1 376 . 9 1 1 A 32 32 ASP H H 32 8.293 8.069 0.224 1
1 377 . 9 1 1 A 32 32 ASP HA H 32 4.422 4.321 0.101 1
1 380 . 9 1 1 A 32 32 ASP C C 32 179.136 177.913 1.223 1
1 381 . 9 1 1 A 32 32 ASP CA C 32 57.109 56.870 0.239 1
1 382 . 9 1 1 A 32 32 ASP CB C 32 40.523 41.024 -0.501 1
1 383 . 9 1 1 A 32 32 ASP N N 32 116.467 118.952 -2.485 1
1 384 . 9 1 1 A 33 33 ALA H H 33 7.536 8.304 -0.768 1
1 385 . 9 1 1 A 33 33 ALA HA H 33 4.222 4.055 0.167 1
1 389 . 9 1 1 A 33 33 ALA C C 33 179.056 179.120 -0.064 1
1 390 . 9 1 1 A 33 33 ALA CA C 33 54.469 54.726 -0.257 1
1 391 . 9 1 1 A 33 33 ALA CB C 33 19.085 18.095 0.990 1
1 392 . 9 1 1 A 33 33 ALA N N 33 120.859 121.278 -0.419 1
1 393 . 9 1 1 A 34 34 ALA H H 34 8.296 7.723 0.573 1
1 394 . 9 1 1 A 34 34 ALA HA H 34 4.101 4.339 -0.238 1
1 398 . 9 1 1 A 34 34 ALA C C 34 176.912 178.149 -1.237 1
1 399 . 9 1 1 A 34 34 ALA CA C 34 52.380 52.367 0.013 1
1 400 . 9 1 1 A 34 34 ALA CB C 34 18.817 19.971 -1.154 1
1 401 . 9 1 1 A 34 34 ALA N N 34 118.203 117.638 0.565 1
1 402 . 9 1 1 A 35 35 GLY H H 35 7.911 8.407 -0.496 1
1 403 . 9 1 1 A 35 35 GLY HA2 H 35 3.968 3.929 0.039 1
1 404 . 9 1 1 A 35 35 GLY HA3 H 35 3.968 3.933 0.035 1
1 405 . 9 1 1 A 35 35 GLY C C 35 174.374 174.167 0.207 1
1 406 . 9 1 1 A 35 35 GLY CA C 35 46.388 46.205 0.183 1
1 407 . 9 1 1 A 35 35 GLY N N 35 107.752 107.826 -0.074 1
1 408 . 9 1 1 A 36 36 LEU H H 36 7.758 7.701 0.057 1
1 409 . 9 1 1 A 36 36 LEU HA H 36 4.887 4.792 0.095 1
1 419 . 9 1 1 A 36 36 LEU C C 36 175.941 175.374 0.567 1
1 420 . 9 1 1 A 36 36 LEU CA C 36 52.443 52.869 -0.426 1
1 421 . 9 1 1 A 36 36 LEU CB C 36 47.885 44.079 3.806 1
1 425 . 9 1 1 A 36 36 LEU N N 36 118.719 120.630 -1.911 1
1 426 . 9 1 1 A 37 37 SER H H 37 8.603 8.445 0.158 1
1 427 . 9 1 1 A 37 37 SER HA H 37 4.565 4.639 -0.074 1
1 430 . 9 1 1 A 37 37 SER C C 37 175.512 175.458 0.054 1
1 431 . 9 1 1 A 37 37 SER CA C 37 57.262 57.084 0.178 1
1 432 . 9 1 1 A 37 37 SER CB C 37 65.155 64.512 0.643 1
1 433 . 9 1 1 A 37 37 SER N N 37 115.095 115.755 -0.660 1
1 434 . 9 1 1 A 38 38 ILE H H 38 8.822 8.884 -0.062 1
1 435 . 9 1 1 A 38 38 ILE HA H 38 3.650 3.731 -0.081 1
1 445 . 9 1 1 A 38 38 ILE C C 38 176.849 177.492 -0.643 1
1 446 . 9 1 1 A 38 38 ILE CA C 38 64.557 65.109 -0.552 1
1 447 . 9 1 1 A 38 38 ILE CB C 38 37.451 37.922 -0.471 1
1 451 . 9 1 1 A 38 38 ILE N N 38 122.026 128.011 -5.985 1
1 452 . 9 1 1 A 39 39 TYR H H 39 7.839 8.322 -0.483 1
1 453 . 9 1 1 A 39 39 TYR HA H 39 4.112 4.238 -0.126 1
1 460 . 9 1 1 A 39 39 TYR C C 39 177.703 177.583 0.120 1
1 461 . 9 1 1 A 39 39 TYR CA C 39 60.856 60.765 0.091 1
1 462 . 9 1 1 A 39 39 TYR CB C 39 38.402 37.070 1.332 1
1 467 . 9 1 1 A 39 39 TYR N N 39 118.759 119.973 -1.214 1
1 468 . 9 1 1 A 40 40 GLN H H 40 7.687 7.552 0.135 1
1 469 . 9 1 1 A 40 40 GLN HA H 40 3.865 3.791 0.074 1
1 476 . 9 1 1 A 40 40 GLN C C 40 178.735 178.174 0.561 1
1 477 . 9 1 1 A 40 40 GLN CA C 40 58.089 58.221 -0.132 1
1 478 . 9 1 1 A 40 40 GLN CB C 40 29.950 28.440 1.510 1
1 481 . 9 1 1 A 40 40 GLN N N 40 116.772 121.294 -4.522 1
1 483 . 9 1 1 A 41 41 VAL H H 41 8.494 8.068 0.426 1
1 484 . 9 1 1 A 41 41 VAL HA H 41 3.835 3.637 0.198 1
1 492 . 9 1 1 A 41 41 VAL C C 41 176.977 177.901 -0.924 1
1 493 . 9 1 1 A 41 41 VAL CA C 41 66.102 67.190 -1.088 1
1 494 . 9 1 1 A 41 41 VAL CB C 41 31.105 31.565 -0.460 1
1 497 . 9 1 1 A 41 41 VAL N N 41 117.192 119.986 -2.794 1
1 498 . 9 1 1 A 42 42 ARG H H 42 8.179 8.340 -0.161 1
1 499 . 9 1 1 A 42 42 ARG HA H 42 3.708 3.966 -0.258 1
1 506 . 9 1 1 A 42 42 ARG C C 42 177.570 178.492 -0.922 1
1 507 . 9 1 1 A 42 42 ARG CA C 42 60.349 58.512 1.837 1
1 508 . 9 1 1 A 42 42 ARG CB C 42 30.047 29.579 0.468 1
1 511 . 9 1 1 A 42 42 ARG N N 42 120.574 119.830 0.744 1
1 512 . 9 1 1 A 43 43 LEU H H 43 6.982 7.578 -0.596 1
1 513 . 9 1 1 A 43 43 LEU HA H 43 3.939 3.881 0.058 1
1 523 . 9 1 1 A 43 43 LEU C C 43 180.397 178.601 1.796 1
1 524 . 9 1 1 A 43 43 LEU CA C 43 58.119 57.866 0.253 1
1 525 . 9 1 1 A 43 43 LEU CB C 43 41.294 41.411 -0.117 1
1 529 . 9 1 1 A 43 43 LEU N N 43 117.189 121.872 -4.683 1
1 530 . 9 1 1 A 44 44 TYR H H 44 7.026 7.611 -0.585 1
1 531 . 9 1 1 A 44 44 TYR HA H 44 4.253 4.232 0.021 1
1 538 . 9 1 1 A 44 44 TYR C C 44 178.411 178.111 0.300 1
1 539 . 9 1 1 A 44 44 TYR CA C 44 60.941 60.662 0.279 1
1 540 . 9 1 1 A 44 44 TYR CB C 44 38.889 38.406 0.483 1
1 545 . 9 1 1 A 44 44 TYR N N 44 117.020 117.903 -0.883 1
1 546 . 9 1 1 A 45 45 LEU H H 45 8.429 8.448 -0.019 1
1 547 . 9 1 1 A 45 45 LEU HA H 45 3.486 3.574 -0.088 1
1 557 . 9 1 1 A 45 45 LEU C C 45 178.648 178.918 -0.270 1
1 558 . 9 1 1 A 45 45 LEU CA C 45 57.915 57.777 0.138 1
1 559 . 9 1 1 A 45 45 LEU CB C 45 39.073 40.817 -1.744 1
1 563 . 9 1 1 A 45 45 LEU N N 45 119.649 120.100 -0.451 1
1 564 . 9 1 1 A 46 46 GLU H H 46 8.309 8.315 -0.006 1
1 565 . 9 1 1 A 46 46 GLU HA H 46 4.286 4.004 0.282 1
1 570 . 9 1 1 A 46 46 GLU C C 46 179.577 179.258 0.319 1
1 571 . 9 1 1 A 46 46 GLU CA C 46 59.570 59.642 -0.072 1
1 572 . 9 1 1 A 46 46 GLU CB C 46 29.034 29.078 -0.044 1
1 574 . 9 1 1 A 46 46 GLU N N 46 117.366 118.820 -1.454 1
1 575 . 9 1 1 A 47 47 GLN H H 47 7.493 7.680 -0.187 1
1 576 . 9 1 1 A 47 47 GLN HA H 47 4.243 4.104 0.139 1
1 583 . 9 1 1 A 47 47 GLN C C 47 178.870 178.978 -0.108 1
1 584 . 9 1 1 A 47 47 GLN CA C 47 59.581 58.361 1.220 1
1 585 . 9 1 1 A 47 47 GLN CB C 47 28.300 28.417 -0.117 1
1 588 . 9 1 1 A 47 47 GLN N N 47 119.345 118.478 0.867 1
1 590 . 9 1 1 A 48 48 LEU H H 48 8.160 8.366 -0.206 1
1 591 . 9 1 1 A 48 48 LEU HA H 48 4.211 3.992 0.219 1
1 601 . 9 1 1 A 48 48 LEU C C 48 180.111 179.177 0.934 1
1 602 . 9 1 1 A 48 48 LEU CA C 48 57.179 57.724 -0.545 1
1 603 . 9 1 1 A 48 48 LEU CB C 48 42.067 40.977 1.090 1
1 607 . 9 1 1 A 48 48 LEU N N 48 118.594 119.418 -0.824 1
1 608 . 9 1 1 A 49 49 HIS H H 49 8.864 8.268 0.596 1
1 609 . 9 1 1 A 49 49 HIS HA H 49 5.162 4.885 0.277 1
1 613 . 9 1 1 A 49 49 HIS C C 49 178.801 176.711 2.090 1
1 614 . 9 1 1 A 49 49 HIS CA C 49 58.397 60.145 -1.748 1
1 615 . 9 1 1 A 49 49 HIS CB C 49 29.631 30.095 -0.464 1
1 617 . 9 1 1 A 49 49 HIS N N 49 122.537 118.278 4.259 1
1 618 . 9 1 1 A 50 50 ASP H H 50 8.683 8.132 0.551 1
1 619 . 9 1 1 A 50 50 ASP HA H 50 4.356 4.356 0.000 1
1 622 . 9 1 1 A 50 50 ASP C C 50 178.474 177.843 0.631 1
1 623 . 9 1 1 A 50 50 ASP CA C 50 57.744 57.362 0.382 1
1 624 . 9 1 1 A 50 50 ASP CB C 50 40.575 41.939 -1.364 1
1 625 . 9 1 1 A 50 50 ASP N N 50 123.169 118.918 4.251 1
1 626 . 9 1 1 A 51 51 VAL H H 51 7.606 7.357 0.249 1
1 627 . 9 1 1 A 51 51 VAL HA H 51 4.514 4.212 0.302 1
1 635 . 9 1 1 A 51 51 VAL C C 51 176.862 175.909 0.953 1
1 636 . 9 1 1 A 51 51 VAL CA C 51 61.590 61.366 0.224 1
1 637 . 9 1 1 A 51 51 VAL CB C 51 31.423 31.606 -0.183 1
1 640 . 9 1 1 A 51 51 VAL N N 51 109.266 109.030 0.236 1
1 641 . 9 1 1 A 52 52 GLY H H 52 7.696 7.731 -0.035 1
1 642 . 9 1 1 A 52 52 GLY HA2 H 52 4.172 3.899 0.273 1
1 643 . 9 1 1 A 52 52 GLY HA3 H 52 3.938 3.943 -0.005 1
1 644 . 9 1 1 A 52 52 GLY C C 52 174.276 174.855 -0.579 1
1 645 . 9 1 1 A 52 52 GLY CA C 52 46.228 45.892 0.336 1
1 646 . 9 1 1 A 52 52 GLY N N 52 108.681 110.342 -1.661 1
1 647 . 9 1 1 A 53 53 VAL H H 53 8.046 8.262 -0.216 1
1 648 . 9 1 1 A 53 53 VAL HA H 53 4.079 3.940 0.139 1
1 656 . 9 1 1 A 53 53 VAL C C 53 175.949 176.125 -0.176 1
1 657 . 9 1 1 A 53 53 VAL CA C 53 64.063 64.489 -0.426 1
1 658 . 9 1 1 A 53 53 VAL CB C 53 33.160 32.542 0.618 1
1 661 . 9 1 1 A 53 53 VAL N N 53 117.892 118.037 -0.145 1
1 662 . 9 1 1 A 54 54 LEU H H 54 6.835 7.443 -0.608 1
1 663 . 9 1 1 A 54 54 LEU HA H 54 5.348 4.973 0.375 1
1 673 . 9 1 1 A 54 54 LEU C C 54 175.713 175.431 0.282 1
1 674 . 9 1 1 A 54 54 LEU CA C 54 52.194 53.086 -0.892 1
1 675 . 9 1 1 A 54 54 LEU CB C 54 46.733 44.962 1.771 1
1 679 . 9 1 1 A 54 54 LEU N N 54 114.848 117.456 -2.608 1
1 680 . 9 1 1 A 55 55 GLU H H 55 9.549 9.254 0.295 1
1 681 . 9 1 1 A 55 55 GLU HA H 55 4.826 5.501 -0.675 1
1 686 . 9 1 1 A 55 55 GLU C C 55 174.661 176.389 -1.728 1
1 687 . 9 1 1 A 55 55 GLU CA C 55 54.637 55.067 -0.430 1
1 688 . 9 1 1 A 55 55 GLU CB C 55 32.891 33.287 -0.396 1
1 690 . 9 1 1 A 55 55 GLU N N 55 121.431 122.478 -1.047 1
1 691 . 9 1 1 A 56 56 LYS H H 56 8.513 8.901 -0.388 1
1 692 . 9 1 1 A 56 56 LYS HA H 56 4.151 4.725 -0.574 1
1 701 . 9 1 1 A 56 56 LYS C C 56 176.270 175.223 1.047 1
1 702 . 9 1 1 A 56 56 LYS CA C 56 54.890 55.329 -0.439 1
1 703 . 9 1 1 A 56 56 LYS CB C 56 33.162 33.681 -0.519 1
1 707 . 9 1 1 A 56 56 LYS N N 56 126.539 121.847 4.692 1
1 708 . 9 1 1 A 57 57 VAL H H 57 8.279 8.745 -0.466 1
1 709 . 9 1 1 A 57 57 VAL HA H 57 3.820 4.880 -1.060 1
1 717 . 9 1 1 A 57 57 VAL C C 57 175.108 174.898 0.210 1
1 718 . 9 1 1 A 57 57 VAL CA C 57 62.834 60.576 2.258 1
1 719 . 9 1 1 A 57 57 VAL CB C 57 32.549 34.551 -2.002 1
1 722 . 9 1 1 A 57 57 VAL N N 57 126.540 123.221 3.319 1
1 723 . 9 1 1 A 58 58 ASN H H 58 8.383 8.461 -0.078 1
1 724 . 9 1 1 A 58 58 ASN HA H 58 4.612 4.982 -0.370 1
1 729 . 9 1 1 A 58 58 ASN C C 58 174.772 174.989 -0.217 1
1 730 . 9 1 1 A 58 58 ASN CA C 58 52.575 52.718 -0.143 1
1 731 . 9 1 1 A 58 58 ASN CB C 58 38.502 39.640 -1.138 1
1 733 . 9 1 1 A 58 58 ASN N N 58 121.767 123.208 -1.441 1
1 735 . 9 1 1 A 59 59 ALA H H 59 8.165 8.658 -0.493 1
1 736 . 9 1 1 A 59 59 ALA HA H 59 4.251 4.031 0.220 1
1 740 . 9 1 1 A 59 59 ALA C C 59 177.478 177.484 -0.006 1
1 741 . 9 1 1 A 59 59 ALA CA C 59 52.490 54.337 -1.847 1
1 742 . 9 1 1 A 59 59 ALA CB C 59 19.724 19.667 0.057 1
1 743 . 9 1 1 A 59 59 ALA N N 59 125.082 128.257 -3.175 1
1 744 . 9 1 1 A 60 60 GLY H H 60 8.291 7.202 1.089 1
1 745 . 9 1 1 A 60 60 GLY HA2 H 60 4.165 4.009 0.156 1
1 746 . 9 1 1 A 60 60 GLY HA3 H 60 3.853 4.012 -0.159 1
1 747 . 9 1 1 A 60 60 GLY C C 60 174.171 171.666 2.505 1
1 748 . 9 1 1 A 60 60 GLY CA C 60 44.994 45.596 -0.602 1
1 749 . 9 1 1 A 60 60 GLY N N 60 108.518 102.773 5.745 1
1 750 . 9 1 1 A 61 61 LYS H H 61 8.189 8.614 -0.425 1
1 751 . 9 1 1 A 61 61 LYS HA H 61 4.320 3.985 0.335 1
1 760 . 9 1 1 A 61 61 LYS C C 61 177.712 177.159 0.553 1
1 761 . 9 1 1 A 61 61 LYS CA C 61 56.832 58.117 -1.285 1
1 762 . 9 1 1 A 61 61 LYS CB C 61 32.641 31.537 1.104 1
1 766 . 9 1 1 A 61 61 LYS N N 61 120.532 121.169 -0.637 1
1 767 . 9 1 1 A 62 62 GLY H H 62 8.767 8.655 0.112 1
1 768 . 9 1 1 A 62 62 GLY HA2 H 62 4.021 4.016 0.005 1
1 769 . 9 1 1 A 62 62 GLY HA3 H 62 3.849 4.016 -0.167 1
1 770 . 9 1 1 A 62 62 GLY C C 62 173.782 174.538 -0.756 1
1 771 . 9 1 1 A 62 62 GLY CA C 62 45.844 45.387 0.457 1
1 772 . 9 1 1 A 62 62 GLY N N 62 111.547 112.720 -1.173 1
1 773 . 9 1 1 A 63 63 VAL H H 63 7.379 7.594 -0.215 1
1 774 . 9 1 1 A 63 63 VAL HA H 63 4.591 4.203 0.388 1
1 782 . 9 1 1 A 63 63 VAL C C 63 174.262 175.000 -0.738 1
1 783 . 9 1 1 A 63 63 VAL CA C 63 59.292 60.593 -1.301 1
1 784 . 9 1 1 A 63 63 VAL CB C 63 32.726 31.975 0.751 1
1 787 . 9 1 1 A 63 63 VAL N N 63 117.546 119.348 -1.802 1
1 788 . 9 1 1 A 64 64 PRO HA H 64 4.458 4.535 -0.077 1
1 795 . 9 1 1 A 64 64 PRO C C 64 177.166 175.956 1.210 1
1 796 . 9 1 1 A 64 64 PRO CA C 64 63.661 62.408 1.253 1
1 797 . 9 1 1 A 64 64 PRO CB C 64 32.321 32.170 0.151 1
1 800 . 9 1 1 A 65 65 GLY H H 65 8.463 8.459 0.004 1
1 801 . 9 1 1 A 65 65 GLY HA2 H 65 3.882 3.685 0.197 1
1 802 . 9 1 1 A 65 65 GLY HA3 H 65 3.602 3.700 -0.098 1
1 803 . 9 1 1 A 65 65 GLY C C 65 172.406 172.855 -0.449 1
1 804 . 9 1 1 A 65 65 GLY CA C 65 45.933 45.433 0.500 1
1 805 . 9 1 1 A 65 65 GLY N N 65 109.819 108.126 1.693 1
1 806 . 9 1 1 A 66 66 LEU H H 66 7.534 8.566 -1.032 1
1 807 . 9 1 1 A 66 66 LEU HA H 66 4.940 4.732 0.208 1
1 817 . 9 1 1 A 66 66 LEU C C 66 176.237 175.280 0.957 1
1 818 . 9 1 1 A 66 66 LEU CA C 66 53.687 53.826 -0.139 1
1 819 . 9 1 1 A 66 66 LEU CB C 66 46.108 42.993 3.115 1
1 823 . 9 1 1 A 66 66 LEU N N 66 122.249 126.507 -4.258 1
1 824 . 9 1 1 A 67 67 TRP H H 67 8.916 9.341 -0.425 1
1 825 . 9 1 1 A 67 67 TRP HA H 67 5.526 5.499 0.027 1
1 834 . 9 1 1 A 67 67 TRP C C 67 175.670 175.389 0.281 1
1 835 . 9 1 1 A 67 67 TRP CA C 67 56.241 55.345 0.896 1
1 836 . 9 1 1 A 67 67 TRP CB C 67 33.314 34.025 -0.711 1
1 842 . 9 1 1 A 67 67 TRP N N 67 121.160 120.547 0.613 1
1 844 . 9 1 1 A 68 68 ARG H H 68 8.772 9.015 -0.243 1
1 845 . 9 1 1 A 68 68 ARG HA H 68 4.832 4.695 0.137 1
1 853 . 9 1 1 A 68 68 ARG C C 68 174.720 174.760 -0.040 1
1 854 . 9 1 1 A 68 68 ARG CA C 68 54.690 55.497 -0.807 1
1 855 . 9 1 1 A 68 68 ARG CB C 68 35.176 33.574 1.602 1
1 858 . 9 1 1 A 68 68 ARG N N 68 117.471 122.356 -4.885 1
1 860 . 9 1 1 A 69 69 LEU H H 69 9.355 8.653 0.702 1
1 861 . 9 1 1 A 69 69 LEU HA H 69 4.557 4.463 0.094 1
1 871 . 9 1 1 A 69 69 LEU C C 69 177.180 177.265 -0.085 1
1 872 . 9 1 1 A 69 69 LEU CA C 69 55.780 54.774 1.006 1
1 873 . 9 1 1 A 69 69 LEU CB C 69 42.736 43.116 -0.380 1
1 877 . 9 1 1 A 69 69 LEU N N 69 125.211 123.178 2.033 1
1 878 . 9 1 1 A 70 70 LEU H H 70 8.058 8.287 -0.229 1
1 879 . 9 1 1 A 70 70 LEU HA H 70 4.364 4.720 -0.356 1
1 889 . 9 1 1 A 70 70 LEU C C 70 176.808 176.140 0.668 1
1 890 . 9 1 1 A 70 70 LEU CA C 70 55.257 54.135 1.122 1
1 891 . 9 1 1 A 70 70 LEU CB C 70 42.413 42.949 -0.536 1
1 895 . 9 1 1 A 70 70 LEU N N 70 125.525 117.960 7.565 1
1 1 . 10 1 1 A 2 2 SER HA H 2 4.126 4.830 -0.704 1
1 4 . 10 1 1 A 2 2 SER CA C 2 57.564 57.292 0.272 1
1 5 . 10 1 1 A 2 2 SER CB C 2 63.953 66.073 -2.120 1
1 6 . 10 1 1 A 3 3 GLU HA H 3 4.408 4.286 0.122 1
1 11 . 10 1 1 A 3 3 GLU C C 3 176.658 177.664 -1.006 1
1 12 . 10 1 1 A 3 3 GLU CA C 3 56.802 56.302 0.500 1
1 13 . 10 1 1 A 3 3 GLU CB C 3 30.674 29.641 1.033 1
1 15 . 10 1 1 A 4 4 SER H H 4 8.650 9.035 -0.385 1
1 16 . 10 1 1 A 4 4 SER HA H 4 4.463 4.576 -0.113 1
1 19 . 10 1 1 A 4 4 SER C C 4 175.949 175.028 0.921 1
1 20 . 10 1 1 A 4 4 SER CA C 4 58.557 58.554 0.003 1
1 21 . 10 1 1 A 4 4 SER CB C 4 63.834 62.812 1.022 1
1 22 . 10 1 1 A 4 4 SER N N 4 118.042 122.486 -4.444 1
1 23 . 10 1 1 A 5 5 ILE H H 5 8.404 7.564 0.840 1
1 24 . 10 1 1 A 5 5 ILE HA H 5 3.902 3.695 0.207 1
1 34 . 10 1 1 A 5 5 ILE C C 5 176.608 177.616 -1.008 1
1 35 . 10 1 1 A 5 5 ILE CA C 5 62.662 64.046 -1.384 1
1 36 . 10 1 1 A 5 5 ILE CB C 5 37.622 37.527 0.095 1
1 40 . 10 1 1 A 5 5 ILE N N 5 124.711 121.643 3.068 1
1 41 . 10 1 1 A 6 6 VAL H H 6 7.602 8.112 -0.510 1
1 42 . 10 1 1 A 6 6 VAL HA H 6 3.293 3.445 -0.152 1
1 50 . 10 1 1 A 6 6 VAL C C 6 177.088 178.268 -1.180 1
1 51 . 10 1 1 A 6 6 VAL CA C 6 67.180 66.748 0.432 1
1 52 . 10 1 1 A 6 6 VAL CB C 6 31.517 31.767 -0.250 1
1 55 . 10 1 1 A 6 6 VAL N N 6 119.974 121.101 -1.127 1
1 56 . 10 1 1 A 7 7 THR H H 7 7.515 8.197 -0.682 1
1 57 . 10 1 1 A 7 7 THR HA H 7 3.823 3.830 -0.007 1
1 62 . 10 1 1 A 7 7 THR C C 7 176.978 176.076 0.902 1
1 63 . 10 1 1 A 7 7 THR CA C 7 66.257 67.609 -1.352 1
1 64 . 10 1 1 A 7 7 THR CB C 7 68.410 68.271 0.139 1
1 66 . 10 1 1 A 7 7 THR N N 7 114.177 116.265 -2.088 1
1 67 . 10 1 1 A 8 8 LYS H H 8 7.807 7.834 -0.027 1
1 68 . 10 1 1 A 8 8 LYS HA H 8 4.066 3.952 0.114 1
1 77 . 10 1 1 A 8 8 LYS C C 8 178.733 178.370 0.363 1
1 78 . 10 1 1 A 8 8 LYS CA C 8 59.338 59.779 -0.441 1
1 79 . 10 1 1 A 8 8 LYS CB C 8 32.002 31.992 0.010 1
1 83 . 10 1 1 A 8 8 LYS N N 8 123.387 120.539 2.848 1
1 84 . 10 1 1 A 9 9 ILE H H 9 8.288 8.162 0.126 1
1 85 . 10 1 1 A 9 9 ILE HA H 9 3.421 3.541 -0.120 1
1 95 . 10 1 1 A 9 9 ILE C C 9 177.187 178.359 -1.172 1
1 96 . 10 1 1 A 9 9 ILE CA C 9 65.772 65.758 0.014 1
1 97 . 10 1 1 A 9 9 ILE CB C 9 37.183 37.849 -0.666 1
1 101 . 10 1 1 A 9 9 ILE N N 9 119.543 118.786 0.757 1
1 102 . 10 1 1 A 10 10 ILE H H 10 8.073 8.032 0.041 1
1 103 . 10 1 1 A 10 10 ILE HA H 10 3.305 3.518 -0.213 1
1 113 . 10 1 1 A 10 10 ILE C C 10 177.308 178.259 -0.951 1
1 114 . 10 1 1 A 10 10 ILE CA C 10 66.704 65.299 1.405 1
1 115 . 10 1 1 A 10 10 ILE CB C 10 37.840 37.819 0.021 1
1 119 . 10 1 1 A 10 10 ILE N N 10 119.219 120.260 -1.041 1
1 120 . 10 1 1 A 11 11 SER H H 11 7.861 8.154 -0.293 1
1 121 . 10 1 1 A 11 11 SER HA H 11 4.250 4.124 0.126 1
1 124 . 10 1 1 A 11 11 SER C C 11 176.918 177.469 -0.551 1
1 125 . 10 1 1 A 11 11 SER CA C 11 61.911 61.541 0.370 1
1 126 . 10 1 1 A 11 11 SER CB C 11 62.998 62.851 0.147 1
1 127 . 10 1 1 A 11 11 SER N N 11 113.959 115.556 -1.597 1
1 128 . 10 1 1 A 12 12 ILE H H 12 8.250 7.925 0.325 1
1 129 . 10 1 1 A 12 12 ILE HA H 12 3.801 3.595 0.206 1
1 139 . 10 1 1 A 12 12 ILE C C 12 178.130 178.201 -0.071 1
1 140 . 10 1 1 A 12 12 ILE CA C 12 65.023 64.920 0.103 1
1 141 . 10 1 1 A 12 12 ILE CB C 12 38.195 37.674 0.521 1
1 145 . 10 1 1 A 12 12 ILE N N 12 123.767 122.202 1.565 1
1 146 . 10 1 1 A 13 13 VAL H H 13 8.308 8.005 0.303 1
1 147 . 10 1 1 A 13 13 VAL HA H 13 3.435 3.479 -0.044 1
1 155 . 10 1 1 A 13 13 VAL C C 13 177.283 177.944 -0.661 1
1 156 . 10 1 1 A 13 13 VAL CA C 13 67.693 66.930 0.763 1
1 157 . 10 1 1 A 13 13 VAL CB C 13 31.139 31.497 -0.358 1
1 160 . 10 1 1 A 13 13 VAL N N 13 120.066 120.183 -0.117 1
1 161 . 10 1 1 A 14 14 GLN H H 14 8.612 8.382 0.230 1
1 162 . 10 1 1 A 14 14 GLN HA H 14 3.831 4.054 -0.223 1
1 169 . 10 1 1 A 14 14 GLN C C 14 178.256 178.351 -0.095 1
1 170 . 10 1 1 A 14 14 GLN CA C 14 59.660 59.519 0.141 1
1 171 . 10 1 1 A 14 14 GLN CB C 14 29.456 28.273 1.183 1
1 174 . 10 1 1 A 14 14 GLN N N 14 118.099 119.428 -1.329 1
1 176 . 10 1 1 A 15 15 GLU H H 15 8.378 8.261 0.117 1
1 177 . 10 1 1 A 15 15 GLU HA H 15 4.110 4.034 0.076 1
1 182 . 10 1 1 A 15 15 GLU C C 15 179.659 179.324 0.335 1
1 183 . 10 1 1 A 15 15 GLU CA C 15 59.476 59.518 -0.042 1
1 184 . 10 1 1 A 15 15 GLU CB C 15 29.725 28.977 0.748 1
1 186 . 10 1 1 A 15 15 GLU N N 15 118.580 119.043 -0.463 1
1 187 . 10 1 1 A 16 16 ARG H H 16 8.439 8.414 0.025 1
1 188 . 10 1 1 A 16 16 ARG HA H 16 4.157 4.096 0.061 1
1 196 . 10 1 1 A 16 16 ARG C C 16 179.276 178.349 0.927 1
1 197 . 10 1 1 A 16 16 ARG CA C 16 58.141 59.247 -1.106 1
1 198 . 10 1 1 A 16 16 ARG CB C 16 29.434 29.939 -0.505 1
1 201 . 10 1 1 A 16 16 ARG N N 16 118.688 119.071 -0.383 1
1 203 . 10 1 1 A 17 17 GLN H H 17 8.861 7.892 0.969 1
1 204 . 10 1 1 A 17 17 GLN HA H 17 4.236 4.163 0.073 1
1 211 . 10 1 1 A 17 17 GLN C C 17 178.736 178.752 -0.016 1
1 212 . 10 1 1 A 17 17 GLN CA C 17 59.683 58.410 1.273 1
1 213 . 10 1 1 A 17 17 GLN CB C 17 29.960 27.692 2.268 1
1 216 . 10 1 1 A 17 17 GLN N N 17 120.427 117.670 2.757 1
1 218 . 10 1 1 A 18 18 ASN H H 18 8.017 8.231 -0.214 1
1 219 . 10 1 1 A 18 18 ASN HA H 18 4.605 4.523 0.082 1
1 224 . 10 1 1 A 18 18 ASN C C 18 177.906 178.127 -0.221 1
1 225 . 10 1 1 A 18 18 ASN CA C 18 55.375 56.129 -0.754 1
1 226 . 10 1 1 A 18 18 ASN CB C 18 38.383 38.222 0.161 1
1 228 . 10 1 1 A 18 18 ASN N N 18 117.033 118.876 -1.843 1
1 230 . 10 1 1 A 19 19 MET H H 19 7.994 7.719 0.275 1
1 231 . 10 1 1 A 19 19 MET HA H 19 4.372 4.276 0.096 1
1 236 . 10 1 1 A 19 19 MET C C 19 176.518 177.318 -0.800 1
1 237 . 10 1 1 A 19 19 MET CA C 19 57.623 58.075 -0.452 1
1 238 . 10 1 1 A 19 19 MET CB C 19 33.248 33.609 -0.361 1
1 240 . 10 1 1 A 19 19 MET N N 19 119.320 119.160 0.160 1
1 241 . 10 1 1 A 20 20 ASP H H 20 7.800 8.189 -0.389 1
1 242 . 10 1 1 A 20 20 ASP HA H 20 4.990 4.522 0.468 1
1 245 . 10 1 1 A 20 20 ASP C C 20 176.082 176.667 -0.585 1
1 246 . 10 1 1 A 20 20 ASP CA C 20 53.796 55.935 -2.139 1
1 247 . 10 1 1 A 20 20 ASP CB C 20 40.409 41.300 -0.891 1
1 248 . 10 1 1 A 20 20 ASP N N 20 119.127 119.069 0.058 1
1 249 . 10 1 1 A 21 21 ASP H H 21 8.136 8.247 -0.111 1
1 250 . 10 1 1 A 21 21 ASP HA H 21 4.497 4.581 -0.084 1
1 253 . 10 1 1 A 21 21 ASP C C 21 176.264 177.530 -1.266 1
1 254 . 10 1 1 A 21 21 ASP CA C 21 55.508 56.221 -0.713 1
1 255 . 10 1 1 A 21 21 ASP CB C 21 40.063 40.369 -0.306 1
1 256 . 10 1 1 A 21 21 ASP N N 21 118.276 119.078 -0.802 1
1 257 . 10 1 1 A 22 22 GLY H H 22 8.728 8.730 -0.002 1
1 258 . 10 1 1 A 22 22 GLY HA2 H 22 4.189 3.935 0.254 1
1 259 . 10 1 1 A 22 22 GLY HA3 H 22 3.683 3.936 -0.253 1
1 260 . 10 1 1 A 22 22 GLY C C 22 174.304 174.523 -0.219 1
1 261 . 10 1 1 A 22 22 GLY CA C 22 45.629 46.967 -1.338 1
1 262 . 10 1 1 A 22 22 GLY N N 22 105.878 107.846 -1.968 1
1 263 . 10 1 1 A 23 23 ALA H H 23 7.473 7.726 -0.253 1
1 264 . 10 1 1 A 23 23 ALA HA H 23 4.519 4.525 -0.006 1
1 268 . 10 1 1 A 23 23 ALA C C 23 174.065 175.965 -1.900 1
1 269 . 10 1 1 A 23 23 ALA CA C 23 51.142 49.810 1.332 1
1 270 . 10 1 1 A 23 23 ALA CB C 23 18.283 20.153 -1.870 1
1 271 . 10 1 1 A 23 23 ALA N N 23 125.323 122.887 2.436 1
1 272 . 10 1 1 A 24 24 PRO HA H 24 4.590 4.627 -0.037 1
1 279 . 10 1 1 A 24 24 PRO C C 24 175.253 176.348 -1.095 1
1 280 . 10 1 1 A 24 24 PRO CA C 24 62.186 62.570 -0.384 1
1 281 . 10 1 1 A 24 24 PRO CB C 24 32.931 32.381 0.550 1
1 284 . 10 1 1 A 25 25 VAL H H 25 9.334 8.534 0.800 1
1 285 . 10 1 1 A 25 25 VAL HA H 25 4.378 4.244 0.134 1
1 293 . 10 1 1 A 25 25 VAL C C 25 176.439 176.009 0.430 1
1 294 . 10 1 1 A 25 25 VAL CA C 25 61.482 62.497 -1.015 1
1 295 . 10 1 1 A 25 25 VAL CB C 25 34.781 32.441 2.340 1
1 298 . 10 1 1 A 25 25 VAL N N 25 120.408 121.353 -0.945 1
1 299 . 10 1 1 A 26 26 LYS H H 26 9.300 9.005 0.295 1
1 300 . 10 1 1 A 26 26 LYS HA H 26 4.982 4.489 0.493 1
1 309 . 10 1 1 A 26 26 LYS C C 26 179.008 178.242 0.766 1
1 310 . 10 1 1 A 26 26 LYS CA C 26 56.908 55.622 1.286 1
1 311 . 10 1 1 A 26 26 LYS CB C 26 34.071 33.569 0.502 1
1 315 . 10 1 1 A 26 26 LYS N N 26 126.177 125.331 0.846 1
1 316 . 10 1 1 A 27 27 THR H H 27 8.618 8.866 -0.248 1
1 317 . 10 1 1 A 27 27 THR HA H 27 3.662 4.051 -0.389 1
1 322 . 10 1 1 A 27 27 THR C C 27 176.442 176.257 0.185 1
1 323 . 10 1 1 A 27 27 THR CA C 27 67.591 66.425 1.166 1
1 324 . 10 1 1 A 27 27 THR CB C 27 68.868 68.868 0.000 1
1 326 . 10 1 1 A 27 27 THR N N 27 119.020 117.453 1.567 1
1 327 . 10 1 1 A 28 28 ARG H H 28 9.288 8.181 1.107 1
1 328 . 10 1 1 A 28 28 ARG HA H 28 3.879 4.074 -0.195 1
1 335 . 10 1 1 A 28 28 ARG C C 28 176.884 179.056 -2.172 1
1 336 . 10 1 1 A 28 28 ARG CA C 28 59.431 59.639 -0.208 1
1 337 . 10 1 1 A 28 28 ARG CB C 28 29.953 30.084 -0.131 1
1 340 . 10 1 1 A 28 28 ARG N N 28 119.100 121.219 -2.119 1
1 341 . 10 1 1 A 29 29 ASP H H 29 6.907 8.195 -1.288 1
1 342 . 10 1 1 A 29 29 ASP HA H 29 4.550 4.286 0.264 1
1 345 . 10 1 1 A 29 29 ASP C C 29 179.050 178.965 0.085 1
1 346 . 10 1 1 A 29 29 ASP CA C 29 57.262 57.164 0.098 1
1 347 . 10 1 1 A 29 29 ASP CB C 29 40.191 40.480 -0.289 1
1 348 . 10 1 1 A 29 29 ASP N N 29 117.490 119.131 -1.641 1
1 349 . 10 1 1 A 30 30 ILE H H 30 7.554 7.957 -0.403 1
1 350 . 10 1 1 A 30 30 ILE HA H 30 3.595 3.599 -0.004 1
1 360 . 10 1 1 A 30 30 ILE C C 30 176.907 177.842 -0.935 1
1 361 . 10 1 1 A 30 30 ILE CA C 30 65.002 65.727 -0.725 1
1 362 . 10 1 1 A 30 30 ILE CB C 30 37.999 37.814 0.185 1
1 366 . 10 1 1 A 30 30 ILE N N 30 120.978 120.260 0.718 1
1 367 . 10 1 1 A 31 31 ALA H H 31 8.269 8.435 -0.166 1
1 368 . 10 1 1 A 31 31 ALA HA H 31 3.720 3.975 -0.255 1
1 372 . 10 1 1 A 31 31 ALA C C 31 179.170 178.746 0.424 1
1 373 . 10 1 1 A 31 31 ALA CA C 31 56.354 55.712 0.642 1
1 374 . 10 1 1 A 31 31 ALA CB C 31 17.843 18.253 -0.410 1
1 375 . 10 1 1 A 31 31 ALA N N 31 121.171 121.844 -0.673 1
1 376 . 10 1 1 A 32 32 ASP H H 32 8.293 8.606 -0.313 1
1 377 . 10 1 1 A 32 32 ASP HA H 32 4.422 4.401 0.021 1
1 380 . 10 1 1 A 32 32 ASP C C 32 179.136 177.990 1.146 1
1 381 . 10 1 1 A 32 32 ASP CA C 32 57.109 56.772 0.337 1
1 382 . 10 1 1 A 32 32 ASP CB C 32 40.523 41.561 -1.038 1
1 383 . 10 1 1 A 32 32 ASP N N 32 116.467 118.177 -1.710 1
1 384 . 10 1 1 A 33 33 ALA H H 33 7.536 8.096 -0.560 1
1 385 . 10 1 1 A 33 33 ALA HA H 33 4.222 4.178 0.044 1
1 389 . 10 1 1 A 33 33 ALA C C 33 179.056 179.891 -0.835 1
1 390 . 10 1 1 A 33 33 ALA CA C 33 54.469 54.745 -0.276 1
1 391 . 10 1 1 A 33 33 ALA CB C 33 19.085 18.279 0.806 1
1 392 . 10 1 1 A 33 33 ALA N N 33 120.859 120.807 0.052 1
1 393 . 10 1 1 A 34 34 ALA H H 34 8.296 7.784 0.512 1
1 394 . 10 1 1 A 34 34 ALA HA H 34 4.101 4.164 -0.063 1
1 398 . 10 1 1 A 34 34 ALA C C 34 176.912 178.083 -1.171 1
1 399 . 10 1 1 A 34 34 ALA CA C 34 52.380 52.823 -0.443 1
1 400 . 10 1 1 A 34 34 ALA CB C 34 18.817 19.439 -0.622 1
1 401 . 10 1 1 A 34 34 ALA N N 34 118.203 117.474 0.729 1
1 402 . 10 1 1 A 35 35 GLY H H 35 7.911 8.562 -0.651 1
1 403 . 10 1 1 A 35 35 GLY HA2 H 35 3.968 3.870 0.098 1
1 404 . 10 1 1 A 35 35 GLY HA3 H 35 3.968 3.874 0.094 1
1 405 . 10 1 1 A 35 35 GLY C C 35 174.374 174.004 0.370 1
1 406 . 10 1 1 A 35 35 GLY CA C 35 46.388 45.892 0.496 1
1 407 . 10 1 1 A 35 35 GLY N N 35 107.752 107.818 -0.066 1
1 408 . 10 1 1 A 36 36 LEU H H 36 7.758 7.400 0.358 1
1 409 . 10 1 1 A 36 36 LEU HA H 36 4.887 4.753 0.134 1
1 419 . 10 1 1 A 36 36 LEU C C 36 175.941 175.746 0.195 1
1 420 . 10 1 1 A 36 36 LEU CA C 36 52.443 52.954 -0.511 1
1 421 . 10 1 1 A 36 36 LEU CB C 36 47.885 43.602 4.283 1
1 425 . 10 1 1 A 36 36 LEU N N 36 118.719 121.125 -2.406 1
1 426 . 10 1 1 A 37 37 SER H H 37 8.603 8.472 0.131 1
1 427 . 10 1 1 A 37 37 SER HA H 37 4.565 4.425 0.140 1
1 430 . 10 1 1 A 37 37 SER C C 37 175.512 175.353 0.159 1
1 431 . 10 1 1 A 37 37 SER CA C 37 57.262 58.813 -1.551 1
1 432 . 10 1 1 A 37 37 SER CB C 37 65.155 62.970 2.185 1
1 433 . 10 1 1 A 37 37 SER N N 37 115.095 115.701 -0.606 1
1 434 . 10 1 1 A 38 38 ILE H H 38 8.822 8.649 0.173 1
1 435 . 10 1 1 A 38 38 ILE HA H 38 3.650 3.696 -0.046 1
1 445 . 10 1 1 A 38 38 ILE C C 38 176.849 177.473 -0.624 1
1 446 . 10 1 1 A 38 38 ILE CA C 38 64.557 65.171 -0.614 1
1 447 . 10 1 1 A 38 38 ILE CB C 38 37.451 38.122 -0.671 1
1 451 . 10 1 1 A 38 38 ILE N N 38 122.026 124.538 -2.512 1
1 452 . 10 1 1 A 39 39 TYR H H 39 7.839 8.326 -0.487 1
1 453 . 10 1 1 A 39 39 TYR HA H 39 4.112 4.253 -0.141 1
1 460 . 10 1 1 A 39 39 TYR C C 39 177.703 177.619 0.084 1
1 461 . 10 1 1 A 39 39 TYR CA C 39 60.856 60.829 0.027 1
1 462 . 10 1 1 A 39 39 TYR CB C 39 38.402 37.134 1.268 1
1 467 . 10 1 1 A 39 39 TYR N N 39 118.759 120.131 -1.372 1
1 468 . 10 1 1 A 40 40 GLN H H 40 7.687 7.559 0.128 1
1 469 . 10 1 1 A 40 40 GLN HA H 40 3.865 3.912 -0.047 1
1 476 . 10 1 1 A 40 40 GLN C C 40 178.735 178.467 0.268 1
1 477 . 10 1 1 A 40 40 GLN CA C 40 58.089 58.459 -0.370 1
1 478 . 10 1 1 A 40 40 GLN CB C 40 29.950 28.477 1.473 1
1 481 . 10 1 1 A 40 40 GLN N N 40 116.772 121.619 -4.847 1
1 483 . 10 1 1 A 41 41 VAL H H 41 8.494 8.304 0.190 1
1 484 . 10 1 1 A 41 41 VAL HA H 41 3.835 3.647 0.188 1
1 492 . 10 1 1 A 41 41 VAL C C 41 176.977 177.950 -0.973 1
1 493 . 10 1 1 A 41 41 VAL CA C 41 66.102 66.962 -0.860 1
1 494 . 10 1 1 A 41 41 VAL CB C 41 31.105 31.361 -0.256 1
1 497 . 10 1 1 A 41 41 VAL N N 41 117.192 119.878 -2.686 1
1 498 . 10 1 1 A 42 42 ARG H H 42 8.179 8.371 -0.192 1
1 499 . 10 1 1 A 42 42 ARG HA H 42 3.708 3.850 -0.142 1
1 506 . 10 1 1 A 42 42 ARG C C 42 177.570 178.316 -0.746 1
1 507 . 10 1 1 A 42 42 ARG CA C 42 60.349 59.637 0.712 1
1 508 . 10 1 1 A 42 42 ARG CB C 42 30.047 30.045 0.002 1
1 511 . 10 1 1 A 42 42 ARG N N 42 120.574 119.926 0.648 1
1 512 . 10 1 1 A 43 43 LEU H H 43 6.982 7.888 -0.906 1
1 513 . 10 1 1 A 43 43 LEU HA H 43 3.939 3.900 0.039 1
1 523 . 10 1 1 A 43 43 LEU C C 43 180.397 178.611 1.786 1
1 524 . 10 1 1 A 43 43 LEU CA C 43 58.119 58.093 0.026 1
1 525 . 10 1 1 A 43 43 LEU CB C 43 41.294 41.961 -0.667 1
1 529 . 10 1 1 A 43 43 LEU N N 43 117.189 118.997 -1.808 1
1 530 . 10 1 1 A 44 44 TYR H H 44 7.026 7.777 -0.751 1
1 531 . 10 1 1 A 44 44 TYR HA H 44 4.253 4.275 -0.022 1
1 538 . 10 1 1 A 44 44 TYR C C 44 178.411 178.135 0.276 1
1 539 . 10 1 1 A 44 44 TYR CA C 44 60.941 60.726 0.215 1
1 540 . 10 1 1 A 44 44 TYR CB C 44 38.889 38.267 0.622 1
1 545 . 10 1 1 A 44 44 TYR N N 44 117.020 117.859 -0.839 1
1 546 . 10 1 1 A 45 45 LEU H H 45 8.429 8.597 -0.168 1
1 547 . 10 1 1 A 45 45 LEU HA H 45 3.486 3.592 -0.106 1
1 557 . 10 1 1 A 45 45 LEU C C 45 178.648 179.169 -0.521 1
1 558 . 10 1 1 A 45 45 LEU CA C 45 57.915 57.617 0.298 1
1 559 . 10 1 1 A 45 45 LEU CB C 45 39.073 40.587 -1.514 1
1 563 . 10 1 1 A 45 45 LEU N N 45 119.649 120.012 -0.363 1
1 564 . 10 1 1 A 46 46 GLU H H 46 8.309 8.115 0.194 1
1 565 . 10 1 1 A 46 46 GLU HA H 46 4.286 4.174 0.112 1
1 570 . 10 1 1 A 46 46 GLU C C 46 179.577 178.920 0.657 1
1 571 . 10 1 1 A 46 46 GLU CA C 46 59.570 59.253 0.317 1
1 572 . 10 1 1 A 46 46 GLU CB C 46 29.034 29.364 -0.330 1
1 574 . 10 1 1 A 46 46 GLU N N 46 117.366 119.281 -1.915 1
1 575 . 10 1 1 A 47 47 GLN H H 47 7.493 8.062 -0.569 1
1 576 . 10 1 1 A 47 47 GLN HA H 47 4.243 3.993 0.250 1
1 583 . 10 1 1 A 47 47 GLN C C 47 178.870 179.005 -0.135 1
1 584 . 10 1 1 A 47 47 GLN CA C 47 59.581 58.870 0.711 1
1 585 . 10 1 1 A 47 47 GLN CB C 47 28.300 28.027 0.273 1
1 588 . 10 1 1 A 47 47 GLN N N 47 119.345 118.840 0.505 1
1 590 . 10 1 1 A 48 48 LEU H H 48 8.160 8.415 -0.255 1
1 591 . 10 1 1 A 48 48 LEU HA H 48 4.211 4.006 0.205 1
1 601 . 10 1 1 A 48 48 LEU C C 48 180.111 179.109 1.002 1
1 602 . 10 1 1 A 48 48 LEU CA C 48 57.179 57.807 -0.628 1
1 603 . 10 1 1 A 48 48 LEU CB C 48 42.067 41.369 0.698 1
1 607 . 10 1 1 A 48 48 LEU N N 48 118.594 119.760 -1.166 1
1 608 . 10 1 1 A 49 49 HIS H H 49 8.864 8.231 0.633 1
1 609 . 10 1 1 A 49 49 HIS HA H 49 5.162 4.639 0.523 1
1 613 . 10 1 1 A 49 49 HIS C C 49 178.801 177.076 1.725 1
1 614 . 10 1 1 A 49 49 HIS CA C 49 58.397 59.424 -1.027 1
1 615 . 10 1 1 A 49 49 HIS CB C 49 29.631 29.904 -0.273 1
1 617 . 10 1 1 A 49 49 HIS N N 49 122.537 117.788 4.749 1
1 618 . 10 1 1 A 50 50 ASP H H 50 8.683 8.200 0.483 1
1 619 . 10 1 1 A 50 50 ASP HA H 50 4.356 4.247 0.109 1
1 622 . 10 1 1 A 50 50 ASP C C 50 178.474 178.032 0.442 1
1 623 . 10 1 1 A 50 50 ASP CA C 50 57.744 57.380 0.364 1
1 624 . 10 1 1 A 50 50 ASP CB C 50 40.575 41.021 -0.446 1
1 625 . 10 1 1 A 50 50 ASP N N 50 123.169 119.167 4.002 1
1 626 . 10 1 1 A 51 51 VAL H H 51 7.606 7.860 -0.254 1
1 627 . 10 1 1 A 51 51 VAL HA H 51 4.514 4.075 0.439 1
1 635 . 10 1 1 A 51 51 VAL C C 51 176.862 176.601 0.261 1
1 636 . 10 1 1 A 51 51 VAL CA C 51 61.590 63.613 -2.023 1
1 637 . 10 1 1 A 51 51 VAL CB C 51 31.423 32.827 -1.404 1
1 640 . 10 1 1 A 51 51 VAL N N 51 109.266 111.911 -2.645 1
1 641 . 10 1 1 A 52 52 GLY H H 52 7.696 7.710 -0.014 1
1 642 . 10 1 1 A 52 52 GLY HA2 H 52 4.172 3.985 0.187 1
1 643 . 10 1 1 A 52 52 GLY HA3 H 52 3.938 4.002 -0.064 1
1 644 . 10 1 1 A 52 52 GLY C C 52 174.276 174.285 -0.009 1
1 645 . 10 1 1 A 52 52 GLY CA C 52 46.228 46.417 -0.189 1
1 646 . 10 1 1 A 52 52 GLY N N 52 108.681 110.905 -2.224 1
1 647 . 10 1 1 A 53 53 VAL H H 53 8.046 7.928 0.118 1
1 648 . 10 1 1 A 53 53 VAL HA H 53 4.079 4.308 -0.229 1
1 656 . 10 1 1 A 53 53 VAL C C 53 175.949 175.142 0.807 1
1 657 . 10 1 1 A 53 53 VAL CA C 53 64.063 63.576 0.487 1
1 658 . 10 1 1 A 53 53 VAL CB C 53 33.160 34.572 -1.412 1
1 661 . 10 1 1 A 53 53 VAL N N 53 117.892 116.592 1.300 1
1 662 . 10 1 1 A 54 54 LEU H H 54 6.835 7.916 -1.081 1
1 663 . 10 1 1 A 54 54 LEU HA H 54 5.348 4.918 0.430 1
1 673 . 10 1 1 A 54 54 LEU C C 54 175.713 175.805 -0.092 1
1 674 . 10 1 1 A 54 54 LEU CA C 54 52.194 53.028 -0.834 1
1 675 . 10 1 1 A 54 54 LEU CB C 54 46.733 44.104 2.629 1
1 679 . 10 1 1 A 54 54 LEU N N 54 114.848 118.337 -3.489 1
1 680 . 10 1 1 A 55 55 GLU H H 55 9.549 9.244 0.305 1
1 681 . 10 1 1 A 55 55 GLU HA H 55 4.826 5.438 -0.612 1
1 686 . 10 1 1 A 55 55 GLU C C 55 174.661 175.889 -1.228 1
1 687 . 10 1 1 A 55 55 GLU CA C 55 54.637 55.220 -0.583 1
1 688 . 10 1 1 A 55 55 GLU CB C 55 32.891 32.838 0.053 1
1 690 . 10 1 1 A 55 55 GLU N N 55 121.431 123.752 -2.321 1
1 691 . 10 1 1 A 56 56 LYS H H 56 8.513 8.357 0.156 1
1 692 . 10 1 1 A 56 56 LYS HA H 56 4.151 4.020 0.131 1
1 701 . 10 1 1 A 56 56 LYS C C 56 176.270 175.248 1.022 1
1 702 . 10 1 1 A 56 56 LYS CA C 56 54.890 55.263 -0.373 1
1 703 . 10 1 1 A 56 56 LYS CB C 56 33.162 31.585 1.577 1
1 707 . 10 1 1 A 56 56 LYS N N 56 126.539 122.862 3.677 1
1 708 . 10 1 1 A 57 57 VAL H H 57 8.279 8.607 -0.328 1
1 709 . 10 1 1 A 57 57 VAL HA H 57 3.820 4.354 -0.534 1
1 717 . 10 1 1 A 57 57 VAL C C 57 175.108 175.400 -0.292 1
1 718 . 10 1 1 A 57 57 VAL CA C 57 62.834 62.420 0.414 1
1 719 . 10 1 1 A 57 57 VAL CB C 57 32.549 30.139 2.410 1
1 722 . 10 1 1 A 57 57 VAL N N 57 126.540 125.768 0.772 1
1 723 . 10 1 1 A 58 58 ASN H H 58 8.383 8.121 0.262 1
1 724 . 10 1 1 A 58 58 ASN HA H 58 4.612 5.004 -0.392 1
1 729 . 10 1 1 A 58 58 ASN C C 58 174.772 174.221 0.551 1
1 730 . 10 1 1 A 58 58 ASN CA C 58 52.575 52.350 0.225 1
1 731 . 10 1 1 A 58 58 ASN CB C 58 38.502 41.359 -2.857 1
1 733 . 10 1 1 A 58 58 ASN N N 58 121.767 124.268 -2.501 1
1 735 . 10 1 1 A 59 59 ALA H H 59 8.165 8.381 -0.216 1
1 736 . 10 1 1 A 59 59 ALA HA H 59 4.251 4.318 -0.067 1
1 740 . 10 1 1 A 59 59 ALA C C 59 177.478 177.019 0.459 1
1 741 . 10 1 1 A 59 59 ALA CA C 59 52.490 52.151 0.339 1
1 742 . 10 1 1 A 59 59 ALA CB C 59 19.724 19.848 -0.124 1
1 743 . 10 1 1 A 59 59 ALA N N 59 125.082 122.388 2.694 1
1 744 . 10 1 1 A 60 60 GLY H H 60 8.291 8.390 -0.099 1
1 745 . 10 1 1 A 60 60 GLY HA2 H 60 4.165 4.211 -0.046 1
1 746 . 10 1 1 A 60 60 GLY HA3 H 60 3.853 4.226 -0.373 1
1 747 . 10 1 1 A 60 60 GLY C C 60 174.171 173.523 0.648 1
1 748 . 10 1 1 A 60 60 GLY CA C 60 44.994 45.203 -0.209 1
1 749 . 10 1 1 A 60 60 GLY N N 60 108.518 105.561 2.957 1
1 750 . 10 1 1 A 61 61 LYS H H 61 8.189 9.117 -0.928 1
1 751 . 10 1 1 A 61 61 LYS HA H 61 4.320 4.022 0.298 1
1 760 . 10 1 1 A 61 61 LYS C C 61 177.712 175.981 1.731 1
1 761 . 10 1 1 A 61 61 LYS CA C 61 56.832 57.548 -0.716 1
1 762 . 10 1 1 A 61 61 LYS CB C 61 32.641 32.210 0.431 1
1 766 . 10 1 1 A 61 61 LYS N N 61 120.532 119.501 1.031 1
1 767 . 10 1 1 A 62 62 GLY H H 62 8.767 8.430 0.337 1
1 768 . 10 1 1 A 62 62 GLY HA2 H 62 4.021 4.059 -0.038 1
1 769 . 10 1 1 A 62 62 GLY HA3 H 62 3.849 4.074 -0.225 1
1 770 . 10 1 1 A 62 62 GLY C C 62 173.782 174.671 -0.889 1
1 771 . 10 1 1 A 62 62 GLY CA C 62 45.844 45.386 0.458 1
1 772 . 10 1 1 A 62 62 GLY N N 62 111.547 105.453 6.094 1
1 773 . 10 1 1 A 63 63 VAL H H 63 7.379 7.788 -0.409 1
1 774 . 10 1 1 A 63 63 VAL HA H 63 4.591 4.231 0.360 1
1 782 . 10 1 1 A 63 63 VAL C C 63 174.262 176.275 -2.013 1
1 783 . 10 1 1 A 63 63 VAL CA C 63 59.292 61.059 -1.767 1
1 784 . 10 1 1 A 63 63 VAL CB C 63 32.726 31.295 1.431 1
1 787 . 10 1 1 A 63 63 VAL N N 63 117.546 120.043 -2.497 1
1 788 . 10 1 1 A 64 64 PRO HA H 64 4.458 4.383 0.075 1
1 795 . 10 1 1 A 64 64 PRO C C 64 177.166 177.344 -0.178 1
1 796 . 10 1 1 A 64 64 PRO CA C 64 63.661 65.724 -2.063 1
1 797 . 10 1 1 A 64 64 PRO CB C 64 32.321 31.593 0.728 1
1 800 . 10 1 1 A 65 65 GLY H H 65 8.463 7.878 0.585 1
1 801 . 10 1 1 A 65 65 GLY HA2 H 65 3.882 3.687 0.195 1
1 802 . 10 1 1 A 65 65 GLY HA3 H 65 3.602 3.830 -0.228 1
1 803 . 10 1 1 A 65 65 GLY C C 65 172.406 172.677 -0.271 1
1 804 . 10 1 1 A 65 65 GLY CA C 65 45.933 44.435 1.498 1
1 805 . 10 1 1 A 65 65 GLY N N 65 109.819 108.240 1.579 1
1 806 . 10 1 1 A 66 66 LEU H H 66 7.534 7.877 -0.343 1
1 807 . 10 1 1 A 66 66 LEU HA H 66 4.940 4.934 0.006 1
1 817 . 10 1 1 A 66 66 LEU C C 66 176.237 175.468 0.769 1
1 818 . 10 1 1 A 66 66 LEU CA C 66 53.687 53.006 0.681 1
1 819 . 10 1 1 A 66 66 LEU CB C 66 46.108 43.863 2.245 1
1 823 . 10 1 1 A 66 66 LEU N N 66 122.249 119.917 2.332 1
1 824 . 10 1 1 A 67 67 TRP H H 67 8.916 9.211 -0.295 1
1 825 . 10 1 1 A 67 67 TRP HA H 67 5.526 5.376 0.150 1
1 834 . 10 1 1 A 67 67 TRP C C 67 175.670 175.328 0.342 1
1 835 . 10 1 1 A 67 67 TRP CA C 67 56.241 56.129 0.112 1
1 836 . 10 1 1 A 67 67 TRP CB C 67 33.314 31.160 2.154 1
1 842 . 10 1 1 A 67 67 TRP N N 67 121.160 125.684 -4.524 1
1 844 . 10 1 1 A 68 68 ARG H H 68 8.772 9.065 -0.293 1
1 845 . 10 1 1 A 68 68 ARG HA H 68 4.832 5.234 -0.402 1
1 853 . 10 1 1 A 68 68 ARG C C 68 174.720 175.333 -0.613 1
1 854 . 10 1 1 A 68 68 ARG CA C 68 54.690 54.901 -0.211 1
1 855 . 10 1 1 A 68 68 ARG CB C 68 35.176 33.915 1.261 1
1 858 . 10 1 1 A 68 68 ARG N N 68 117.471 123.233 -5.762 1
1 860 . 10 1 1 A 69 69 LEU H H 69 9.355 8.954 0.401 1
1 861 . 10 1 1 A 69 69 LEU HA H 69 4.557 4.629 -0.072 1
1 871 . 10 1 1 A 69 69 LEU C C 69 177.180 176.813 0.367 1
1 872 . 10 1 1 A 69 69 LEU CA C 69 55.780 54.739 1.041 1
1 873 . 10 1 1 A 69 69 LEU CB C 69 42.736 43.225 -0.489 1
1 877 . 10 1 1 A 69 69 LEU N N 69 125.211 123.498 1.713 1
1 878 . 10 1 1 A 70 70 LEU H H 70 8.058 8.692 -0.634 1
1 879 . 10 1 1 A 70 70 LEU HA H 70 4.364 5.119 -0.755 1
1 889 . 10 1 1 A 70 70 LEU C C 70 176.808 174.982 1.826 1
1 890 . 10 1 1 A 70 70 LEU CA C 70 55.257 53.116 2.141 1
1 891 . 10 1 1 A 70 70 LEU CB C 70 42.413 45.961 -3.548 1
1 895 . 10 1 1 A 70 70 LEU N N 70 125.525 118.421 7.104 1
1 1 . 11 1 1 A 2 2 SER HA H 2 4.126 4.205 -0.079 1
1 4 . 11 1 1 A 2 2 SER CA C 2 57.564 62.215 -4.651 1
1 5 . 11 1 1 A 2 2 SER CB C 2 63.953 63.446 0.507 1
1 6 . 11 1 1 A 3 3 GLU HA H 3 4.408 3.986 0.422 1
1 11 . 11 1 1 A 3 3 GLU C C 3 176.658 175.354 1.304 1
1 12 . 11 1 1 A 3 3 GLU CA C 3 56.802 57.572 -0.770 1
1 13 . 11 1 1 A 3 3 GLU CB C 3 30.674 28.753 1.921 1
1 15 . 11 1 1 A 4 4 SER H H 4 8.650 8.406 0.244 1
1 16 . 11 1 1 A 4 4 SER HA H 4 4.463 4.176 0.287 1
1 19 . 11 1 1 A 4 4 SER C C 4 175.949 174.393 1.556 1
1 20 . 11 1 1 A 4 4 SER CA C 4 58.557 59.737 -1.180 1
1 21 . 11 1 1 A 4 4 SER CB C 4 63.834 61.290 2.544 1
1 22 . 11 1 1 A 4 4 SER N N 4 118.042 108.061 9.981 1
1 23 . 11 1 1 A 5 5 ILE H H 5 8.404 7.717 0.687 1
1 24 . 11 1 1 A 5 5 ILE HA H 5 3.902 3.751 0.151 1
1 34 . 11 1 1 A 5 5 ILE C C 5 176.608 177.593 -0.985 1
1 35 . 11 1 1 A 5 5 ILE CA C 5 62.662 63.946 -1.284 1
1 36 . 11 1 1 A 5 5 ILE CB C 5 37.622 37.760 -0.138 1
1 40 . 11 1 1 A 5 5 ILE N N 5 124.711 120.972 3.739 1
1 41 . 11 1 1 A 6 6 VAL H H 6 7.602 8.034 -0.432 1
1 42 . 11 1 1 A 6 6 VAL HA H 6 3.293 3.474 -0.181 1
1 50 . 11 1 1 A 6 6 VAL C C 6 177.088 178.294 -1.206 1
1 51 . 11 1 1 A 6 6 VAL CA C 6 67.180 66.552 0.628 1
1 52 . 11 1 1 A 6 6 VAL CB C 6 31.517 31.689 -0.172 1
1 55 . 11 1 1 A 6 6 VAL N N 6 119.974 120.485 -0.511 1
1 56 . 11 1 1 A 7 7 THR H H 7 7.515 7.810 -0.295 1
1 57 . 11 1 1 A 7 7 THR HA H 7 3.823 3.806 0.017 1
1 62 . 11 1 1 A 7 7 THR C C 7 176.978 176.309 0.669 1
1 63 . 11 1 1 A 7 7 THR CA C 7 66.257 66.919 -0.662 1
1 64 . 11 1 1 A 7 7 THR CB C 7 68.410 68.456 -0.046 1
1 66 . 11 1 1 A 7 7 THR N N 7 114.177 116.141 -1.964 1
1 67 . 11 1 1 A 8 8 LYS H H 8 7.807 8.129 -0.322 1
1 68 . 11 1 1 A 8 8 LYS HA H 8 4.066 3.965 0.101 1
1 77 . 11 1 1 A 8 8 LYS C C 8 178.733 178.432 0.301 1
1 78 . 11 1 1 A 8 8 LYS CA C 8 59.338 59.827 -0.489 1
1 79 . 11 1 1 A 8 8 LYS CB C 8 32.002 32.081 -0.079 1
1 83 . 11 1 1 A 8 8 LYS N N 8 123.387 120.919 2.468 1
1 84 . 11 1 1 A 9 9 ILE H H 9 8.288 7.893 0.395 1
1 85 . 11 1 1 A 9 9 ILE HA H 9 3.421 3.534 -0.113 1
1 95 . 11 1 1 A 9 9 ILE C C 9 177.187 178.367 -1.180 1
1 96 . 11 1 1 A 9 9 ILE CA C 9 65.772 65.562 0.210 1
1 97 . 11 1 1 A 9 9 ILE CB C 9 37.183 37.871 -0.688 1
1 101 . 11 1 1 A 9 9 ILE N N 9 119.543 118.707 0.836 1
1 102 . 11 1 1 A 10 10 ILE H H 10 8.073 8.039 0.034 1
1 103 . 11 1 1 A 10 10 ILE HA H 10 3.305 3.484 -0.179 1
1 113 . 11 1 1 A 10 10 ILE C C 10 177.308 177.833 -0.525 1
1 114 . 11 1 1 A 10 10 ILE CA C 10 66.704 65.240 1.464 1
1 115 . 11 1 1 A 10 10 ILE CB C 10 37.840 37.771 0.069 1
1 119 . 11 1 1 A 10 10 ILE N N 10 119.219 121.273 -2.054 1
1 120 . 11 1 1 A 11 11 SER H H 11 7.861 7.896 -0.035 1
1 121 . 11 1 1 A 11 11 SER HA H 11 4.250 4.129 0.121 1
1 124 . 11 1 1 A 11 11 SER C C 11 176.918 176.578 0.340 1
1 125 . 11 1 1 A 11 11 SER CA C 11 61.911 62.524 -0.613 1
1 126 . 11 1 1 A 11 11 SER CB C 11 62.998 62.694 0.304 1
1 127 . 11 1 1 A 11 11 SER N N 11 113.959 115.598 -1.639 1
1 128 . 11 1 1 A 12 12 ILE H H 12 8.250 7.829 0.421 1
1 129 . 11 1 1 A 12 12 ILE HA H 12 3.801 3.739 0.062 1
1 139 . 11 1 1 A 12 12 ILE C C 12 178.130 177.977 0.153 1
1 140 . 11 1 1 A 12 12 ILE CA C 12 65.023 64.223 0.800 1
1 141 . 11 1 1 A 12 12 ILE CB C 12 38.195 37.748 0.447 1
1 145 . 11 1 1 A 12 12 ILE N N 12 123.767 121.641 2.126 1
1 146 . 11 1 1 A 13 13 VAL H H 13 8.308 7.792 0.516 1
1 147 . 11 1 1 A 13 13 VAL HA H 13 3.435 3.788 -0.353 1
1 155 . 11 1 1 A 13 13 VAL C C 13 177.283 178.063 -0.780 1
1 156 . 11 1 1 A 13 13 VAL CA C 13 67.693 64.359 3.334 1
1 157 . 11 1 1 A 13 13 VAL CB C 13 31.139 31.491 -0.352 1
1 160 . 11 1 1 A 13 13 VAL N N 13 120.066 119.618 0.448 1
1 161 . 11 1 1 A 14 14 GLN H H 14 8.612 7.785 0.827 1
1 162 . 11 1 1 A 14 14 GLN HA H 14 3.831 3.991 -0.160 1
1 169 . 11 1 1 A 14 14 GLN C C 14 178.256 178.019 0.237 1
1 170 . 11 1 1 A 14 14 GLN CA C 14 59.660 59.333 0.327 1
1 171 . 11 1 1 A 14 14 GLN CB C 14 29.456 28.162 1.294 1
1 174 . 11 1 1 A 14 14 GLN N N 14 118.099 119.737 -1.638 1
1 176 . 11 1 1 A 15 15 GLU H H 15 8.378 8.373 0.005 1
1 177 . 11 1 1 A 15 15 GLU HA H 15 4.110 4.013 0.097 1
1 182 . 11 1 1 A 15 15 GLU C C 15 179.659 179.050 0.609 1
1 183 . 11 1 1 A 15 15 GLU CA C 15 59.476 59.727 -0.251 1
1 184 . 11 1 1 A 15 15 GLU CB C 15 29.725 29.332 0.393 1
1 186 . 11 1 1 A 15 15 GLU N N 15 118.580 119.202 -0.622 1
1 187 . 11 1 1 A 16 16 ARG H H 16 8.439 8.376 0.063 1
1 188 . 11 1 1 A 16 16 ARG HA H 16 4.157 4.147 0.010 1
1 196 . 11 1 1 A 16 16 ARG C C 16 179.276 178.976 0.300 1
1 197 . 11 1 1 A 16 16 ARG CA C 16 58.141 59.526 -1.385 1
1 198 . 11 1 1 A 16 16 ARG CB C 16 29.434 29.918 -0.484 1
1 201 . 11 1 1 A 16 16 ARG N N 16 118.688 118.692 -0.004 1
1 203 . 11 1 1 A 17 17 GLN H H 17 8.861 7.899 0.962 1
1 204 . 11 1 1 A 17 17 GLN HA H 17 4.236 4.145 0.091 1
1 211 . 11 1 1 A 17 17 GLN C C 17 178.736 178.371 0.365 1
1 212 . 11 1 1 A 17 17 GLN CA C 17 59.683 58.221 1.462 1
1 213 . 11 1 1 A 17 17 GLN CB C 17 29.960 27.634 2.326 1
1 216 . 11 1 1 A 17 17 GLN N N 17 120.427 118.379 2.048 1
1 218 . 11 1 1 A 18 18 ASN H H 18 8.017 8.237 -0.220 1
1 219 . 11 1 1 A 18 18 ASN HA H 18 4.605 4.511 0.094 1
1 224 . 11 1 1 A 18 18 ASN C C 18 177.906 177.634 0.272 1
1 225 . 11 1 1 A 18 18 ASN CA C 18 55.375 55.710 -0.335 1
1 226 . 11 1 1 A 18 18 ASN CB C 18 38.383 38.574 -0.191 1
1 228 . 11 1 1 A 18 18 ASN N N 18 117.033 119.197 -2.164 1
1 230 . 11 1 1 A 19 19 MET H H 19 7.994 7.725 0.269 1
1 231 . 11 1 1 A 19 19 MET HA H 19 4.372 4.421 -0.049 1
1 236 . 11 1 1 A 19 19 MET C C 19 176.518 176.312 0.206 1
1 237 . 11 1 1 A 19 19 MET CA C 19 57.623 58.347 -0.724 1
1 238 . 11 1 1 A 19 19 MET CB C 19 33.248 33.697 -0.449 1
1 240 . 11 1 1 A 19 19 MET N N 19 119.320 116.173 3.147 1
1 241 . 11 1 1 A 20 20 ASP H H 20 7.800 8.033 -0.233 1
1 242 . 11 1 1 A 20 20 ASP HA H 20 4.990 4.922 0.068 1
1 245 . 11 1 1 A 20 20 ASP C C 20 176.082 175.578 0.504 1
1 246 . 11 1 1 A 20 20 ASP CA C 20 53.796 52.684 1.112 1
1 247 . 11 1 1 A 20 20 ASP CB C 20 40.409 39.308 1.101 1
1 248 . 11 1 1 A 20 20 ASP N N 20 119.127 118.695 0.432 1
1 249 . 11 1 1 A 21 21 ASP H H 21 8.136 8.430 -0.294 1
1 250 . 11 1 1 A 21 21 ASP HA H 21 4.497 4.296 0.201 1
1 253 . 11 1 1 A 21 21 ASP C C 21 176.264 177.672 -1.408 1
1 254 . 11 1 1 A 21 21 ASP CA C 21 55.508 57.166 -1.658 1
1 255 . 11 1 1 A 21 21 ASP CB C 21 40.063 40.583 -0.520 1
1 256 . 11 1 1 A 21 21 ASP N N 21 118.276 125.444 -7.168 1
1 257 . 11 1 1 A 22 22 GLY H H 22 8.728 8.075 0.653 1
1 258 . 11 1 1 A 22 22 GLY HA2 H 22 4.189 3.976 0.213 1
1 259 . 11 1 1 A 22 22 GLY HA3 H 22 3.683 3.977 -0.294 1
1 260 . 11 1 1 A 22 22 GLY C C 22 174.304 173.297 1.007 1
1 261 . 11 1 1 A 22 22 GLY CA C 22 45.629 45.343 0.286 1
1 262 . 11 1 1 A 22 22 GLY N N 22 105.878 105.250 0.628 1
1 263 . 11 1 1 A 23 23 ALA H H 23 7.473 7.404 0.069 1
1 264 . 11 1 1 A 23 23 ALA HA H 23 4.519 4.648 -0.129 1
1 268 . 11 1 1 A 23 23 ALA C C 23 174.065 174.579 -0.514 1
1 269 . 11 1 1 A 23 23 ALA CA C 23 51.142 49.712 1.430 1
1 270 . 11 1 1 A 23 23 ALA CB C 23 18.283 20.536 -2.253 1
1 271 . 11 1 1 A 23 23 ALA N N 23 125.323 121.288 4.035 1
1 272 . 11 1 1 A 24 24 PRO HA H 24 4.590 4.613 -0.023 1
1 279 . 11 1 1 A 24 24 PRO C C 24 175.253 176.792 -1.539 1
1 280 . 11 1 1 A 24 24 PRO CA C 24 62.186 62.595 -0.409 1
1 281 . 11 1 1 A 24 24 PRO CB C 24 32.931 33.012 -0.081 1
1 284 . 11 1 1 A 25 25 VAL H H 25 9.334 8.674 0.660 1
1 285 . 11 1 1 A 25 25 VAL HA H 25 4.378 4.332 0.046 1
1 293 . 11 1 1 A 25 25 VAL C C 25 176.439 176.144 0.295 1
1 294 . 11 1 1 A 25 25 VAL CA C 25 61.482 62.928 -1.446 1
1 295 . 11 1 1 A 25 25 VAL CB C 25 34.781 32.643 2.138 1
1 298 . 11 1 1 A 25 25 VAL N N 25 120.408 121.368 -0.960 1
1 299 . 11 1 1 A 26 26 LYS H H 26 9.300 8.839 0.461 1
1 300 . 11 1 1 A 26 26 LYS HA H 26 4.982 4.708 0.274 1
1 309 . 11 1 1 A 26 26 LYS C C 26 179.008 177.851 1.157 1
1 310 . 11 1 1 A 26 26 LYS CA C 26 56.908 54.587 2.321 1
1 311 . 11 1 1 A 26 26 LYS CB C 26 34.071 34.526 -0.455 1
1 315 . 11 1 1 A 26 26 LYS N N 26 126.177 124.687 1.490 1
1 316 . 11 1 1 A 27 27 THR H H 27 8.618 9.206 -0.588 1
1 317 . 11 1 1 A 27 27 THR HA H 27 3.662 4.016 -0.354 1
1 322 . 11 1 1 A 27 27 THR C C 27 176.442 176.175 0.267 1
1 323 . 11 1 1 A 27 27 THR CA C 27 67.591 66.762 0.829 1
1 324 . 11 1 1 A 27 27 THR CB C 27 68.868 69.062 -0.194 1
1 326 . 11 1 1 A 27 27 THR N N 27 119.020 117.326 1.694 1
1 327 . 11 1 1 A 28 28 ARG H H 28 9.288 8.253 1.035 1
1 328 . 11 1 1 A 28 28 ARG HA H 28 3.879 4.028 -0.149 1
1 335 . 11 1 1 A 28 28 ARG C C 28 176.884 179.243 -2.359 1
1 336 . 11 1 1 A 28 28 ARG CA C 28 59.431 59.673 -0.242 1
1 337 . 11 1 1 A 28 28 ARG CB C 28 29.953 30.060 -0.107 1
1 340 . 11 1 1 A 28 28 ARG N N 28 119.100 120.724 -1.624 1
1 341 . 11 1 1 A 29 29 ASP H H 29 6.907 8.149 -1.242 1
1 342 . 11 1 1 A 29 29 ASP HA H 29 4.550 4.433 0.117 1
1 345 . 11 1 1 A 29 29 ASP C C 29 179.050 178.570 0.480 1
1 346 . 11 1 1 A 29 29 ASP CA C 29 57.262 57.212 0.050 1
1 347 . 11 1 1 A 29 29 ASP CB C 29 40.191 40.713 -0.522 1
1 348 . 11 1 1 A 29 29 ASP N N 29 117.490 119.617 -2.127 1
1 349 . 11 1 1 A 30 30 ILE H H 30 7.554 7.489 0.065 1
1 350 . 11 1 1 A 30 30 ILE HA H 30 3.595 3.698 -0.103 1
1 360 . 11 1 1 A 30 30 ILE C C 30 176.907 177.688 -0.781 1
1 361 . 11 1 1 A 30 30 ILE CA C 30 65.002 65.443 -0.441 1
1 362 . 11 1 1 A 30 30 ILE CB C 30 37.999 37.843 0.156 1
1 366 . 11 1 1 A 30 30 ILE N N 30 120.978 120.697 0.281 1
1 367 . 11 1 1 A 31 31 ALA H H 31 8.269 8.182 0.087 1
1 368 . 11 1 1 A 31 31 ALA HA H 31 3.720 3.992 -0.272 1
1 372 . 11 1 1 A 31 31 ALA C C 31 179.170 178.859 0.311 1
1 373 . 11 1 1 A 31 31 ALA CA C 31 56.354 55.354 1.000 1
1 374 . 11 1 1 A 31 31 ALA CB C 31 17.843 18.028 -0.185 1
1 375 . 11 1 1 A 31 31 ALA N N 31 121.171 122.320 -1.149 1
1 376 . 11 1 1 A 32 32 ASP H H 32 8.293 8.441 -0.148 1
1 377 . 11 1 1 A 32 32 ASP HA H 32 4.422 4.322 0.100 1
1 380 . 11 1 1 A 32 32 ASP C C 32 179.136 178.228 0.908 1
1 381 . 11 1 1 A 32 32 ASP CA C 32 57.109 57.233 -0.124 1
1 382 . 11 1 1 A 32 32 ASP CB C 32 40.523 41.247 -0.724 1
1 383 . 11 1 1 A 32 32 ASP N N 32 116.467 118.872 -2.405 1
1 384 . 11 1 1 A 33 33 ALA H H 33 7.536 8.198 -0.662 1
1 385 . 11 1 1 A 33 33 ALA HA H 33 4.222 4.026 0.196 1
1 389 . 11 1 1 A 33 33 ALA C C 33 179.056 179.654 -0.598 1
1 390 . 11 1 1 A 33 33 ALA CA C 33 54.469 54.821 -0.352 1
1 391 . 11 1 1 A 33 33 ALA CB C 33 19.085 18.138 0.947 1
1 392 . 11 1 1 A 33 33 ALA N N 33 120.859 121.541 -0.682 1
1 393 . 11 1 1 A 34 34 ALA H H 34 8.296 7.430 0.866 1
1 394 . 11 1 1 A 34 34 ALA HA H 34 4.101 4.259 -0.158 1
1 398 . 11 1 1 A 34 34 ALA C C 34 176.912 178.078 -1.166 1
1 399 . 11 1 1 A 34 34 ALA CA C 34 52.380 52.466 -0.086 1
1 400 . 11 1 1 A 34 34 ALA CB C 34 18.817 19.779 -0.962 1
1 401 . 11 1 1 A 34 34 ALA N N 34 118.203 117.255 0.948 1
1 402 . 11 1 1 A 35 35 GLY H H 35 7.911 8.342 -0.431 1
1 403 . 11 1 1 A 35 35 GLY HA2 H 35 3.968 3.959 0.009 1
1 404 . 11 1 1 A 35 35 GLY HA3 H 35 3.968 3.964 0.004 1
1 405 . 11 1 1 A 35 35 GLY C C 35 174.374 174.213 0.161 1
1 406 . 11 1 1 A 35 35 GLY CA C 35 46.388 46.415 -0.027 1
1 407 . 11 1 1 A 35 35 GLY N N 35 107.752 107.835 -0.083 1
1 408 . 11 1 1 A 36 36 LEU H H 36 7.758 7.520 0.238 1
1 409 . 11 1 1 A 36 36 LEU HA H 36 4.887 4.832 0.055 1
1 419 . 11 1 1 A 36 36 LEU C C 36 175.941 175.673 0.268 1
1 420 . 11 1 1 A 36 36 LEU CA C 36 52.443 52.814 -0.371 1
1 421 . 11 1 1 A 36 36 LEU CB C 36 47.885 44.416 3.469 1
1 425 . 11 1 1 A 36 36 LEU N N 36 118.719 120.521 -1.802 1
1 426 . 11 1 1 A 37 37 SER H H 37 8.603 8.718 -0.115 1
1 427 . 11 1 1 A 37 37 SER HA H 37 4.565 4.560 0.005 1
1 430 . 11 1 1 A 37 37 SER C C 37 175.512 175.711 -0.199 1
1 431 . 11 1 1 A 37 37 SER CA C 37 57.262 58.870 -1.608 1
1 432 . 11 1 1 A 37 37 SER CB C 37 65.155 63.754 1.401 1
1 433 . 11 1 1 A 37 37 SER N N 37 115.095 116.001 -0.906 1
1 434 . 11 1 1 A 38 38 ILE H H 38 8.822 8.849 -0.027 1
1 435 . 11 1 1 A 38 38 ILE HA H 38 3.650 3.744 -0.094 1
1 445 . 11 1 1 A 38 38 ILE C C 38 176.849 177.370 -0.521 1
1 446 . 11 1 1 A 38 38 ILE CA C 38 64.557 65.222 -0.665 1
1 447 . 11 1 1 A 38 38 ILE CB C 38 37.451 38.144 -0.693 1
1 451 . 11 1 1 A 38 38 ILE N N 38 122.026 124.853 -2.827 1
1 452 . 11 1 1 A 39 39 TYR H H 39 7.839 8.484 -0.645 1
1 453 . 11 1 1 A 39 39 TYR HA H 39 4.112 4.090 0.022 1
1 460 . 11 1 1 A 39 39 TYR C C 39 177.703 177.559 0.144 1
1 461 . 11 1 1 A 39 39 TYR CA C 39 60.856 61.492 -0.636 1
1 462 . 11 1 1 A 39 39 TYR CB C 39 38.402 38.931 -0.529 1
1 467 . 11 1 1 A 39 39 TYR N N 39 118.759 120.774 -2.015 1
1 468 . 11 1 1 A 40 40 GLN H H 40 7.687 8.202 -0.515 1
1 469 . 11 1 1 A 40 40 GLN HA H 40 3.865 3.829 0.036 1
1 476 . 11 1 1 A 40 40 GLN C C 40 178.735 178.775 -0.040 1
1 477 . 11 1 1 A 40 40 GLN CA C 40 58.089 58.820 -0.731 1
1 478 . 11 1 1 A 40 40 GLN CB C 40 29.950 28.498 1.452 1
1 481 . 11 1 1 A 40 40 GLN N N 40 116.772 118.350 -1.578 1
1 483 . 11 1 1 A 41 41 VAL H H 41 8.494 8.317 0.177 1
1 484 . 11 1 1 A 41 41 VAL HA H 41 3.835 3.650 0.185 1
1 492 . 11 1 1 A 41 41 VAL C C 41 176.977 177.716 -0.739 1
1 493 . 11 1 1 A 41 41 VAL CA C 41 66.102 66.834 -0.732 1
1 494 . 11 1 1 A 41 41 VAL CB C 41 31.105 31.480 -0.375 1
1 497 . 11 1 1 A 41 41 VAL N N 41 117.192 119.643 -2.451 1
1 498 . 11 1 1 A 42 42 ARG H H 42 8.179 8.573 -0.394 1
1 499 . 11 1 1 A 42 42 ARG HA H 42 3.708 3.959 -0.251 1
1 506 . 11 1 1 A 42 42 ARG C C 42 177.570 178.789 -1.219 1
1 507 . 11 1 1 A 42 42 ARG CA C 42 60.349 59.883 0.466 1
1 508 . 11 1 1 A 42 42 ARG CB C 42 30.047 29.923 0.124 1
1 511 . 11 1 1 A 42 42 ARG N N 42 120.574 119.877 0.697 1
1 512 . 11 1 1 A 43 43 LEU H H 43 6.982 7.735 -0.753 1
1 513 . 11 1 1 A 43 43 LEU HA H 43 3.939 3.796 0.143 1
1 523 . 11 1 1 A 43 43 LEU C C 43 180.397 178.641 1.756 1
1 524 . 11 1 1 A 43 43 LEU CA C 43 58.119 57.941 0.178 1
1 525 . 11 1 1 A 43 43 LEU CB C 43 41.294 41.518 -0.224 1
1 529 . 11 1 1 A 43 43 LEU N N 43 117.189 119.126 -1.937 1
1 530 . 11 1 1 A 44 44 TYR H H 44 7.026 7.653 -0.627 1
1 531 . 11 1 1 A 44 44 TYR HA H 44 4.253 4.248 0.005 1
1 538 . 11 1 1 A 44 44 TYR C C 44 178.411 178.073 0.338 1
1 539 . 11 1 1 A 44 44 TYR CA C 44 60.941 60.747 0.194 1
1 540 . 11 1 1 A 44 44 TYR CB C 44 38.889 38.190 0.699 1
1 545 . 11 1 1 A 44 44 TYR N N 44 117.020 117.710 -0.690 1
1 546 . 11 1 1 A 45 45 LEU H H 45 8.429 8.632 -0.203 1
1 547 . 11 1 1 A 45 45 LEU HA H 45 3.486 3.538 -0.052 1
1 557 . 11 1 1 A 45 45 LEU C C 45 178.648 179.144 -0.496 1
1 558 . 11 1 1 A 45 45 LEU CA C 45 57.915 57.911 0.004 1
1 559 . 11 1 1 A 45 45 LEU CB C 45 39.073 40.804 -1.731 1
1 563 . 11 1 1 A 45 45 LEU N N 45 119.649 120.015 -0.366 1
1 564 . 11 1 1 A 46 46 GLU H H 46 8.309 8.096 0.213 1
1 565 . 11 1 1 A 46 46 GLU HA H 46 4.286 4.327 -0.041 1
1 570 . 11 1 1 A 46 46 GLU C C 46 179.577 179.885 -0.308 1
1 571 . 11 1 1 A 46 46 GLU CA C 46 59.570 59.624 -0.054 1
1 572 . 11 1 1 A 46 46 GLU CB C 46 29.034 29.266 -0.232 1
1 574 . 11 1 1 A 46 46 GLU N N 46 117.366 117.614 -0.248 1
1 575 . 11 1 1 A 47 47 GLN H H 47 7.493 7.715 -0.222 1
1 576 . 11 1 1 A 47 47 GLN HA H 47 4.243 4.114 0.129 1
1 583 . 11 1 1 A 47 47 GLN C C 47 178.870 179.146 -0.276 1
1 584 . 11 1 1 A 47 47 GLN CA C 47 59.581 58.428 1.153 1
1 585 . 11 1 1 A 47 47 GLN CB C 47 28.300 28.291 0.009 1
1 588 . 11 1 1 A 47 47 GLN N N 47 119.345 120.046 -0.701 1
1 590 . 11 1 1 A 48 48 LEU H H 48 8.160 8.355 -0.195 1
1 591 . 11 1 1 A 48 48 LEU HA H 48 4.211 4.073 0.138 1
1 601 . 11 1 1 A 48 48 LEU C C 48 180.111 179.204 0.907 1
1 602 . 11 1 1 A 48 48 LEU CA C 48 57.179 57.681 -0.502 1
1 603 . 11 1 1 A 48 48 LEU CB C 48 42.067 41.112 0.955 1
1 607 . 11 1 1 A 48 48 LEU N N 48 118.594 120.053 -1.459 1
1 608 . 11 1 1 A 49 49 HIS H H 49 8.864 8.301 0.563 1
1 609 . 11 1 1 A 49 49 HIS HA H 49 5.162 4.704 0.458 1
1 613 . 11 1 1 A 49 49 HIS C C 49 178.801 176.697 2.104 1
1 614 . 11 1 1 A 49 49 HIS CA C 49 58.397 59.699 -1.302 1
1 615 . 11 1 1 A 49 49 HIS CB C 49 29.631 30.164 -0.533 1
1 617 . 11 1 1 A 49 49 HIS N N 49 122.537 118.312 4.225 1
1 618 . 11 1 1 A 50 50 ASP H H 50 8.683 8.094 0.589 1
1 619 . 11 1 1 A 50 50 ASP HA H 50 4.356 4.147 0.209 1
1 622 . 11 1 1 A 50 50 ASP C C 50 178.474 178.058 0.416 1
1 623 . 11 1 1 A 50 50 ASP CA C 50 57.744 57.439 0.305 1
1 624 . 11 1 1 A 50 50 ASP CB C 50 40.575 41.377 -0.802 1
1 625 . 11 1 1 A 50 50 ASP N N 50 123.169 118.411 4.758 1
1 626 . 11 1 1 A 51 51 VAL H H 51 7.606 7.586 0.020 1
1 627 . 11 1 1 A 51 51 VAL HA H 51 4.514 4.126 0.388 1
1 635 . 11 1 1 A 51 51 VAL C C 51 176.862 176.575 0.287 1
1 636 . 11 1 1 A 51 51 VAL CA C 51 61.590 62.797 -1.207 1
1 637 . 11 1 1 A 51 51 VAL CB C 51 31.423 32.597 -1.174 1
1 640 . 11 1 1 A 51 51 VAL N N 51 109.266 110.772 -1.506 1
1 641 . 11 1 1 A 52 52 GLY H H 52 7.696 7.819 -0.123 1
1 642 . 11 1 1 A 52 52 GLY HA2 H 52 4.172 3.992 0.180 1
1 643 . 11 1 1 A 52 52 GLY HA3 H 52 3.938 3.995 -0.057 1
1 644 . 11 1 1 A 52 52 GLY C C 52 174.276 174.969 -0.693 1
1 645 . 11 1 1 A 52 52 GLY CA C 52 46.228 45.808 0.420 1
1 646 . 11 1 1 A 52 52 GLY N N 52 108.681 110.452 -1.771 1
1 647 . 11 1 1 A 53 53 VAL H H 53 8.046 8.369 -0.323 1
1 648 . 11 1 1 A 53 53 VAL HA H 53 4.079 4.041 0.038 1
1 656 . 11 1 1 A 53 53 VAL C C 53 175.949 175.501 0.448 1
1 657 . 11 1 1 A 53 53 VAL CA C 53 64.063 64.486 -0.423 1
1 658 . 11 1 1 A 53 53 VAL CB C 53 33.160 32.580 0.580 1
1 661 . 11 1 1 A 53 53 VAL N N 53 117.892 117.478 0.414 1
1 662 . 11 1 1 A 54 54 LEU H H 54 6.835 7.643 -0.808 1
1 663 . 11 1 1 A 54 54 LEU HA H 54 5.348 4.931 0.417 1
1 673 . 11 1 1 A 54 54 LEU C C 54 175.713 175.954 -0.241 1
1 674 . 11 1 1 A 54 54 LEU CA C 54 52.194 53.348 -1.154 1
1 675 . 11 1 1 A 54 54 LEU CB C 54 46.733 43.347 3.386 1
1 679 . 11 1 1 A 54 54 LEU N N 54 114.848 118.728 -3.880 1
1 680 . 11 1 1 A 55 55 GLU H H 55 9.549 9.300 0.249 1
1 681 . 11 1 1 A 55 55 GLU HA H 55 4.826 4.935 -0.109 1
1 686 . 11 1 1 A 55 55 GLU C C 55 174.661 175.562 -0.901 1
1 687 . 11 1 1 A 55 55 GLU CA C 55 54.637 55.543 -0.906 1
1 688 . 11 1 1 A 55 55 GLU CB C 55 32.891 31.440 1.451 1
1 690 . 11 1 1 A 55 55 GLU N N 55 121.431 125.352 -3.921 1
1 691 . 11 1 1 A 56 56 LYS H H 56 8.513 8.164 0.349 1
1 692 . 11 1 1 A 56 56 LYS HA H 56 4.151 4.088 0.063 1
1 701 . 11 1 1 A 56 56 LYS C C 56 176.270 175.287 0.983 1
1 702 . 11 1 1 A 56 56 LYS CA C 56 54.890 55.309 -0.419 1
1 703 . 11 1 1 A 56 56 LYS CB C 56 33.162 31.671 1.491 1
1 707 . 11 1 1 A 56 56 LYS N N 56 126.539 125.068 1.471 1
1 708 . 11 1 1 A 57 57 VAL H H 57 8.279 8.651 -0.372 1
1 709 . 11 1 1 A 57 57 VAL HA H 57 3.820 3.653 0.167 1
1 717 . 11 1 1 A 57 57 VAL C C 57 175.108 177.003 -1.895 1
1 718 . 11 1 1 A 57 57 VAL CA C 57 62.834 63.956 -1.122 1
1 719 . 11 1 1 A 57 57 VAL CB C 57 32.549 31.654 0.895 1
1 722 . 11 1 1 A 57 57 VAL N N 57 126.540 125.426 1.114 1
1 723 . 11 1 1 A 58 58 ASN H H 58 8.383 8.978 -0.595 1
1 724 . 11 1 1 A 58 58 ASN HA H 58 4.612 4.458 0.154 1
1 729 . 11 1 1 A 58 58 ASN C C 58 174.772 175.729 -0.957 1
1 730 . 11 1 1 A 58 58 ASN CA C 58 52.575 54.254 -1.679 1
1 731 . 11 1 1 A 58 58 ASN CB C 58 38.502 38.526 -0.024 1
1 733 . 11 1 1 A 58 58 ASN N N 58 121.767 124.429 -2.662 1
1 735 . 11 1 1 A 59 59 ALA H H 59 8.165 7.603 0.562 1
1 736 . 11 1 1 A 59 59 ALA HA H 59 4.251 4.298 -0.047 1
1 740 . 11 1 1 A 59 59 ALA C C 59 177.478 178.003 -0.525 1
1 741 . 11 1 1 A 59 59 ALA CA C 59 52.490 52.053 0.437 1
1 742 . 11 1 1 A 59 59 ALA CB C 59 19.724 19.468 0.256 1
1 743 . 11 1 1 A 59 59 ALA N N 59 125.082 120.964 4.118 1
1 744 . 11 1 1 A 60 60 GLY H H 60 8.291 8.151 0.140 1
1 745 . 11 1 1 A 60 60 GLY HA2 H 60 4.165 3.799 0.366 1
1 746 . 11 1 1 A 60 60 GLY HA3 H 60 3.853 3.802 0.051 1
1 747 . 11 1 1 A 60 60 GLY C C 60 174.171 174.573 -0.402 1
1 748 . 11 1 1 A 60 60 GLY CA C 60 44.994 47.336 -2.342 1
1 749 . 11 1 1 A 60 60 GLY N N 60 108.518 107.260 1.258 1
1 750 . 11 1 1 A 61 61 LYS H H 61 8.189 8.514 -0.325 1
1 751 . 11 1 1 A 61 61 LYS HA H 61 4.320 4.432 -0.112 1
1 760 . 11 1 1 A 61 61 LYS C C 61 177.712 176.512 1.200 1
1 761 . 11 1 1 A 61 61 LYS CA C 61 56.832 55.149 1.683 1
1 762 . 11 1 1 A 61 61 LYS CB C 61 32.641 33.067 -0.426 1
1 766 . 11 1 1 A 61 61 LYS N N 61 120.532 125.307 -4.775 1
1 767 . 11 1 1 A 62 62 GLY H H 62 8.767 7.975 0.792 1
1 768 . 11 1 1 A 62 62 GLY HA2 H 62 4.021 4.054 -0.033 1
1 769 . 11 1 1 A 62 62 GLY HA3 H 62 3.849 4.060 -0.211 1
1 770 . 11 1 1 A 62 62 GLY C C 62 173.782 174.205 -0.423 1
1 771 . 11 1 1 A 62 62 GLY CA C 62 45.844 45.747 0.097 1
1 772 . 11 1 1 A 62 62 GLY N N 62 111.547 107.897 3.650 1
1 773 . 11 1 1 A 63 63 VAL H H 63 7.379 7.756 -0.377 1
1 774 . 11 1 1 A 63 63 VAL HA H 63 4.591 4.815 -0.224 1
1 782 . 11 1 1 A 63 63 VAL C C 63 174.262 174.132 0.130 1
1 783 . 11 1 1 A 63 63 VAL CA C 63 59.292 58.082 1.210 1
1 784 . 11 1 1 A 63 63 VAL CB C 63 32.726 33.614 -0.888 1
1 787 . 11 1 1 A 63 63 VAL N N 63 117.546 115.790 1.756 1
1 788 . 11 1 1 A 64 64 PRO HA H 64 4.458 4.595 -0.137 1
1 795 . 11 1 1 A 64 64 PRO C C 64 177.166 176.455 0.711 1
1 796 . 11 1 1 A 64 64 PRO CA C 64 63.661 62.386 1.275 1
1 797 . 11 1 1 A 64 64 PRO CB C 64 32.321 30.576 1.745 1
1 800 . 11 1 1 A 65 65 GLY H H 65 8.463 7.874 0.589 1
1 801 . 11 1 1 A 65 65 GLY HA2 H 65 3.882 3.854 0.028 1
1 802 . 11 1 1 A 65 65 GLY HA3 H 65 3.602 3.908 -0.306 1
1 803 . 11 1 1 A 65 65 GLY C C 65 172.406 173.105 -0.699 1
1 804 . 11 1 1 A 65 65 GLY CA C 65 45.933 44.130 1.803 1
1 805 . 11 1 1 A 65 65 GLY N N 65 109.819 110.049 -0.230 1
1 806 . 11 1 1 A 66 66 LEU H H 66 7.534 8.620 -1.086 1
1 807 . 11 1 1 A 66 66 LEU HA H 66 4.940 4.856 0.084 1
1 817 . 11 1 1 A 66 66 LEU C C 66 176.237 176.064 0.173 1
1 818 . 11 1 1 A 66 66 LEU CA C 66 53.687 53.262 0.425 1
1 819 . 11 1 1 A 66 66 LEU CB C 66 46.108 43.485 2.623 1
1 823 . 11 1 1 A 66 66 LEU N N 66 122.249 122.021 0.228 1
1 824 . 11 1 1 A 67 67 TRP H H 67 8.916 9.230 -0.314 1
1 825 . 11 1 1 A 67 67 TRP HA H 67 5.526 5.076 0.450 1
1 834 . 11 1 1 A 67 67 TRP C C 67 175.670 175.507 0.163 1
1 835 . 11 1 1 A 67 67 TRP CA C 67 56.241 57.112 -0.871 1
1 836 . 11 1 1 A 67 67 TRP CB C 67 33.314 30.584 2.730 1
1 842 . 11 1 1 A 67 67 TRP N N 67 121.160 125.755 -4.595 1
1 844 . 11 1 1 A 68 68 ARG H H 68 8.772 8.870 -0.098 1
1 845 . 11 1 1 A 68 68 ARG HA H 68 4.832 4.920 -0.088 1
1 853 . 11 1 1 A 68 68 ARG C C 68 174.720 175.304 -0.584 1
1 854 . 11 1 1 A 68 68 ARG CA C 68 54.690 54.756 -0.066 1
1 855 . 11 1 1 A 68 68 ARG CB C 68 35.176 34.190 0.986 1
1 858 . 11 1 1 A 68 68 ARG N N 68 117.471 124.135 -6.664 1
1 860 . 11 1 1 A 69 69 LEU H H 69 9.355 8.537 0.818 1
1 861 . 11 1 1 A 69 69 LEU HA H 69 4.557 4.651 -0.094 1
1 871 . 11 1 1 A 69 69 LEU C C 69 177.180 176.351 0.829 1
1 872 . 11 1 1 A 69 69 LEU CA C 69 55.780 54.630 1.150 1
1 873 . 11 1 1 A 69 69 LEU CB C 69 42.736 43.073 -0.337 1
1 877 . 11 1 1 A 69 69 LEU N N 69 125.211 123.420 1.791 1
1 878 . 11 1 1 A 70 70 LEU H H 70 8.058 8.390 -0.332 1
1 879 . 11 1 1 A 70 70 LEU HA H 70 4.364 4.466 -0.102 1
1 889 . 11 1 1 A 70 70 LEU C C 70 176.808 177.478 -0.670 1
1 890 . 11 1 1 A 70 70 LEU CA C 70 55.257 54.721 0.536 1
1 891 . 11 1 1 A 70 70 LEU CB C 70 42.413 41.649 0.764 1
1 895 . 11 1 1 A 70 70 LEU N N 70 125.525 121.853 3.672 1
1 1 . 12 1 1 A 2 2 SER HA H 2 4.126 4.502 -0.376 1
1 4 . 12 1 1 A 2 2 SER CA C 2 57.564 58.611 -1.047 1
1 5 . 12 1 1 A 2 2 SER CB C 2 63.953 62.705 1.248 1
1 6 . 12 1 1 A 3 3 GLU HA H 3 4.408 4.068 0.340 1
1 11 . 12 1 1 A 3 3 GLU C C 3 176.658 176.516 0.142 1
1 12 . 12 1 1 A 3 3 GLU CA C 3 56.802 59.065 -2.263 1
1 13 . 12 1 1 A 3 3 GLU CB C 3 30.674 29.089 1.585 1
1 15 . 12 1 1 A 4 4 SER H H 4 8.650 7.829 0.821 1
1 16 . 12 1 1 A 4 4 SER HA H 4 4.463 4.397 0.066 1
1 19 . 12 1 1 A 4 4 SER C C 4 175.949 174.535 1.414 1
1 20 . 12 1 1 A 4 4 SER CA C 4 58.557 57.447 1.110 1
1 21 . 12 1 1 A 4 4 SER CB C 4 63.834 62.354 1.480 1
1 22 . 12 1 1 A 4 4 SER N N 4 118.042 115.375 2.667 1
1 23 . 12 1 1 A 5 5 ILE H H 5 8.404 8.087 0.317 1
1 24 . 12 1 1 A 5 5 ILE HA H 5 3.902 3.859 0.043 1
1 34 . 12 1 1 A 5 5 ILE C C 5 176.608 177.301 -0.693 1
1 35 . 12 1 1 A 5 5 ILE CA C 5 62.662 63.707 -1.045 1
1 36 . 12 1 1 A 5 5 ILE CB C 5 37.622 37.886 -0.264 1
1 40 . 12 1 1 A 5 5 ILE N N 5 124.711 128.118 -3.407 1
1 41 . 12 1 1 A 6 6 VAL H H 6 7.602 7.995 -0.393 1
1 42 . 12 1 1 A 6 6 VAL HA H 6 3.293 3.373 -0.080 1
1 50 . 12 1 1 A 6 6 VAL C C 6 177.088 178.210 -1.122 1
1 51 . 12 1 1 A 6 6 VAL CA C 6 67.180 66.688 0.492 1
1 52 . 12 1 1 A 6 6 VAL CB C 6 31.517 31.672 -0.155 1
1 55 . 12 1 1 A 6 6 VAL N N 6 119.974 120.377 -0.403 1
1 56 . 12 1 1 A 7 7 THR H H 7 7.515 8.138 -0.623 1
1 57 . 12 1 1 A 7 7 THR HA H 7 3.823 3.907 -0.084 1
1 62 . 12 1 1 A 7 7 THR C C 7 176.978 176.317 0.661 1
1 63 . 12 1 1 A 7 7 THR CA C 7 66.257 66.911 -0.654 1
1 64 . 12 1 1 A 7 7 THR CB C 7 68.410 68.373 0.037 1
1 66 . 12 1 1 A 7 7 THR N N 7 114.177 116.203 -2.026 1
1 67 . 12 1 1 A 8 8 LYS H H 8 7.807 7.538 0.269 1
1 68 . 12 1 1 A 8 8 LYS HA H 8 4.066 3.940 0.126 1
1 77 . 12 1 1 A 8 8 LYS C C 8 178.733 178.621 0.112 1
1 78 . 12 1 1 A 8 8 LYS CA C 8 59.338 59.742 -0.404 1
1 79 . 12 1 1 A 8 8 LYS CB C 8 32.002 32.013 -0.011 1
1 83 . 12 1 1 A 8 8 LYS N N 8 123.387 120.094 3.293 1
1 84 . 12 1 1 A 9 9 ILE H H 9 8.288 7.901 0.387 1
1 85 . 12 1 1 A 9 9 ILE HA H 9 3.421 3.559 -0.138 1
1 95 . 12 1 1 A 9 9 ILE C C 9 177.187 178.265 -1.078 1
1 96 . 12 1 1 A 9 9 ILE CA C 9 65.772 65.596 0.176 1
1 97 . 12 1 1 A 9 9 ILE CB C 9 37.183 37.856 -0.673 1
1 101 . 12 1 1 A 9 9 ILE N N 9 119.543 118.768 0.775 1
1 102 . 12 1 1 A 10 10 ILE H H 10 8.073 8.360 -0.287 1
1 103 . 12 1 1 A 10 10 ILE HA H 10 3.305 3.533 -0.228 1
1 113 . 12 1 1 A 10 10 ILE C C 10 177.308 177.846 -0.538 1
1 114 . 12 1 1 A 10 10 ILE CA C 10 66.704 65.326 1.378 1
1 115 . 12 1 1 A 10 10 ILE CB C 10 37.840 37.857 -0.017 1
1 119 . 12 1 1 A 10 10 ILE N N 10 119.219 121.304 -2.085 1
1 120 . 12 1 1 A 11 11 SER H H 11 7.861 7.860 0.001 1
1 121 . 12 1 1 A 11 11 SER HA H 11 4.250 4.111 0.139 1
1 124 . 12 1 1 A 11 11 SER C C 11 176.918 176.586 0.332 1
1 125 . 12 1 1 A 11 11 SER CA C 11 61.911 62.478 -0.567 1
1 126 . 12 1 1 A 11 11 SER CB C 11 62.998 62.768 0.230 1
1 127 . 12 1 1 A 11 11 SER N N 11 113.959 115.859 -1.900 1
1 128 . 12 1 1 A 12 12 ILE H H 12 8.250 7.751 0.499 1
1 129 . 12 1 1 A 12 12 ILE HA H 12 3.801 3.694 0.107 1
1 139 . 12 1 1 A 12 12 ILE C C 12 178.130 178.103 0.027 1
1 140 . 12 1 1 A 12 12 ILE CA C 12 65.023 64.499 0.524 1
1 141 . 12 1 1 A 12 12 ILE CB C 12 38.195 37.708 0.487 1
1 145 . 12 1 1 A 12 12 ILE N N 12 123.767 121.539 2.228 1
1 146 . 12 1 1 A 13 13 VAL H H 13 8.308 8.135 0.173 1
1 147 . 12 1 1 A 13 13 VAL HA H 13 3.435 3.513 -0.078 1
1 155 . 12 1 1 A 13 13 VAL C C 13 177.283 177.965 -0.682 1
1 156 . 12 1 1 A 13 13 VAL CA C 13 67.693 66.707 0.986 1
1 157 . 12 1 1 A 13 13 VAL CB C 13 31.139 31.184 -0.045 1
1 160 . 12 1 1 A 13 13 VAL N N 13 120.066 119.753 0.313 1
1 161 . 12 1 1 A 14 14 GLN H H 14 8.612 8.398 0.214 1
1 162 . 12 1 1 A 14 14 GLN HA H 14 3.831 4.046 -0.215 1
1 169 . 12 1 1 A 14 14 GLN C C 14 178.256 178.057 0.199 1
1 170 . 12 1 1 A 14 14 GLN CA C 14 59.660 59.440 0.220 1
1 171 . 12 1 1 A 14 14 GLN CB C 14 29.456 28.491 0.965 1
1 174 . 12 1 1 A 14 14 GLN N N 14 118.099 119.751 -1.652 1
1 176 . 12 1 1 A 15 15 GLU H H 15 8.378 8.409 -0.031 1
1 177 . 12 1 1 A 15 15 GLU HA H 15 4.110 4.009 0.101 1
1 182 . 12 1 1 A 15 15 GLU C C 15 179.659 179.187 0.472 1
1 183 . 12 1 1 A 15 15 GLU CA C 15 59.476 59.515 -0.039 1
1 184 . 12 1 1 A 15 15 GLU CB C 15 29.725 29.097 0.628 1
1 186 . 12 1 1 A 15 15 GLU N N 15 118.580 119.227 -0.647 1
1 187 . 12 1 1 A 16 16 ARG H H 16 8.439 8.318 0.121 1
1 188 . 12 1 1 A 16 16 ARG HA H 16 4.157 4.016 0.141 1
1 196 . 12 1 1 A 16 16 ARG C C 16 179.276 179.338 -0.062 1
1 197 . 12 1 1 A 16 16 ARG CA C 16 58.141 59.935 -1.794 1
1 198 . 12 1 1 A 16 16 ARG CB C 16 29.434 29.985 -0.551 1
1 201 . 12 1 1 A 16 16 ARG N N 16 118.688 118.446 0.242 1
1 203 . 12 1 1 A 17 17 GLN H H 17 8.861 8.235 0.626 1
1 204 . 12 1 1 A 17 17 GLN HA H 17 4.236 4.017 0.219 1
1 211 . 12 1 1 A 17 17 GLN C C 17 178.736 178.869 -0.133 1
1 212 . 12 1 1 A 17 17 GLN CA C 17 59.683 59.015 0.668 1
1 213 . 12 1 1 A 17 17 GLN CB C 17 29.960 28.407 1.553 1
1 216 . 12 1 1 A 17 17 GLN N N 17 120.427 118.809 1.618 1
1 218 . 12 1 1 A 18 18 ASN H H 18 8.017 8.536 -0.519 1
1 219 . 12 1 1 A 18 18 ASN HA H 18 4.605 4.510 0.095 1
1 224 . 12 1 1 A 18 18 ASN C C 18 177.906 178.427 -0.521 1
1 225 . 12 1 1 A 18 18 ASN CA C 18 55.375 56.167 -0.792 1
1 226 . 12 1 1 A 18 18 ASN CB C 18 38.383 37.794 0.589 1
1 228 . 12 1 1 A 18 18 ASN N N 18 117.033 118.293 -1.260 1
1 230 . 12 1 1 A 19 19 MET H H 19 7.994 7.583 0.411 1
1 231 . 12 1 1 A 19 19 MET HA H 19 4.372 4.146 0.226 1
1 236 . 12 1 1 A 19 19 MET C C 19 176.518 176.684 -0.166 1
1 237 . 12 1 1 A 19 19 MET CA C 19 57.623 58.784 -1.161 1
1 238 . 12 1 1 A 19 19 MET CB C 19 33.248 32.501 0.747 1
1 240 . 12 1 1 A 19 19 MET N N 19 119.320 118.469 0.851 1
1 241 . 12 1 1 A 20 20 ASP H H 20 7.800 7.948 -0.148 1
1 242 . 12 1 1 A 20 20 ASP HA H 20 4.990 4.818 0.172 1
1 245 . 12 1 1 A 20 20 ASP C C 20 176.082 175.506 0.576 1
1 246 . 12 1 1 A 20 20 ASP CA C 20 53.796 52.880 0.916 1
1 247 . 12 1 1 A 20 20 ASP CB C 20 40.409 41.242 -0.833 1
1 248 . 12 1 1 A 20 20 ASP N N 20 119.127 116.720 2.407 1
1 249 . 12 1 1 A 21 21 ASP H H 21 8.136 8.599 -0.463 1
1 250 . 12 1 1 A 21 21 ASP HA H 21 4.497 4.281 0.216 1
1 253 . 12 1 1 A 21 21 ASP C C 21 176.264 175.417 0.847 1
1 254 . 12 1 1 A 21 21 ASP CA C 21 55.508 54.927 0.581 1
1 255 . 12 1 1 A 21 21 ASP CB C 21 40.063 39.950 0.113 1
1 256 . 12 1 1 A 21 21 ASP N N 21 118.276 119.647 -1.371 1
1 257 . 12 1 1 A 22 22 GLY H H 22 8.728 8.382 0.346 1
1 258 . 12 1 1 A 22 22 GLY HA2 H 22 4.189 3.972 0.217 1
1 259 . 12 1 1 A 22 22 GLY HA3 H 22 3.683 3.976 -0.293 1
1 260 . 12 1 1 A 22 22 GLY C C 22 174.304 174.386 -0.082 1
1 261 . 12 1 1 A 22 22 GLY CA C 22 45.629 45.003 0.626 1
1 262 . 12 1 1 A 22 22 GLY N N 22 105.878 113.502 -7.624 1
1 263 . 12 1 1 A 23 23 ALA H H 23 7.473 7.942 -0.469 1
1 264 . 12 1 1 A 23 23 ALA HA H 23 4.519 4.414 0.105 1
1 268 . 12 1 1 A 23 23 ALA C C 23 174.065 176.516 -2.451 1
1 269 . 12 1 1 A 23 23 ALA CA C 23 51.142 50.756 0.386 1
1 270 . 12 1 1 A 23 23 ALA CB C 23 18.283 19.389 -1.106 1
1 271 . 12 1 1 A 23 23 ALA N N 23 125.323 124.346 0.977 1
1 272 . 12 1 1 A 24 24 PRO HA H 24 4.590 4.787 -0.197 1
1 279 . 12 1 1 A 24 24 PRO C C 24 175.253 175.587 -0.334 1
1 280 . 12 1 1 A 24 24 PRO CA C 24 62.186 62.687 -0.501 1
1 281 . 12 1 1 A 24 24 PRO CB C 24 32.931 32.574 0.357 1
1 284 . 12 1 1 A 25 25 VAL H H 25 9.334 8.672 0.662 1
1 285 . 12 1 1 A 25 25 VAL HA H 25 4.378 4.742 -0.364 1
1 293 . 12 1 1 A 25 25 VAL C C 25 176.439 175.174 1.265 1
1 294 . 12 1 1 A 25 25 VAL CA C 25 61.482 60.422 1.060 1
1 295 . 12 1 1 A 25 25 VAL CB C 25 34.781 35.442 -0.661 1
1 298 . 12 1 1 A 25 25 VAL N N 25 120.408 120.525 -0.117 1
1 299 . 12 1 1 A 26 26 LYS H H 26 9.300 8.947 0.353 1
1 300 . 12 1 1 A 26 26 LYS HA H 26 4.982 4.557 0.425 1
1 309 . 12 1 1 A 26 26 LYS C C 26 179.008 178.653 0.355 1
1 310 . 12 1 1 A 26 26 LYS CA C 26 56.908 55.422 1.486 1
1 311 . 12 1 1 A 26 26 LYS CB C 26 34.071 33.306 0.765 1
1 315 . 12 1 1 A 26 26 LYS N N 26 126.177 124.538 1.639 1
1 316 . 12 1 1 A 27 27 THR H H 27 8.618 9.007 -0.389 1
1 317 . 12 1 1 A 27 27 THR HA H 27 3.662 3.972 -0.310 1
1 322 . 12 1 1 A 27 27 THR C C 27 176.442 176.144 0.298 1
1 323 . 12 1 1 A 27 27 THR CA C 27 67.591 67.317 0.274 1
1 324 . 12 1 1 A 27 27 THR CB C 27 68.868 69.051 -0.183 1
1 326 . 12 1 1 A 27 27 THR N N 27 119.020 116.938 2.082 1
1 327 . 12 1 1 A 28 28 ARG H H 28 9.288 8.452 0.836 1
1 328 . 12 1 1 A 28 28 ARG HA H 28 3.879 4.069 -0.190 1
1 335 . 12 1 1 A 28 28 ARG C C 28 176.884 178.254 -1.370 1
1 336 . 12 1 1 A 28 28 ARG CA C 28 59.431 59.123 0.308 1
1 337 . 12 1 1 A 28 28 ARG CB C 28 29.953 30.137 -0.184 1
1 340 . 12 1 1 A 28 28 ARG N N 28 119.100 120.447 -1.347 1
1 341 . 12 1 1 A 29 29 ASP H H 29 6.907 8.145 -1.238 1
1 342 . 12 1 1 A 29 29 ASP HA H 29 4.550 4.480 0.070 1
1 345 . 12 1 1 A 29 29 ASP C C 29 179.050 179.004 0.046 1
1 346 . 12 1 1 A 29 29 ASP CA C 29 57.262 57.167 0.095 1
1 347 . 12 1 1 A 29 29 ASP CB C 29 40.191 40.816 -0.625 1
1 348 . 12 1 1 A 29 29 ASP N N 29 117.490 119.328 -1.838 1
1 349 . 12 1 1 A 30 30 ILE H H 30 7.554 7.960 -0.406 1
1 350 . 12 1 1 A 30 30 ILE HA H 30 3.595 3.668 -0.073 1
1 360 . 12 1 1 A 30 30 ILE C C 30 176.907 177.624 -0.717 1
1 361 . 12 1 1 A 30 30 ILE CA C 30 65.002 65.977 -0.975 1
1 362 . 12 1 1 A 30 30 ILE CB C 30 37.999 38.340 -0.341 1
1 366 . 12 1 1 A 30 30 ILE N N 30 120.978 120.523 0.455 1
1 367 . 12 1 1 A 31 31 ALA H H 31 8.269 8.570 -0.301 1
1 368 . 12 1 1 A 31 31 ALA HA H 31 3.720 4.001 -0.281 1
1 372 . 12 1 1 A 31 31 ALA C C 31 179.170 179.071 0.099 1
1 373 . 12 1 1 A 31 31 ALA CA C 31 56.354 55.841 0.513 1
1 374 . 12 1 1 A 31 31 ALA CB C 31 17.843 18.379 -0.536 1
1 375 . 12 1 1 A 31 31 ALA N N 31 121.171 122.216 -1.045 1
1 376 . 12 1 1 A 32 32 ASP H H 32 8.293 8.391 -0.098 1
1 377 . 12 1 1 A 32 32 ASP HA H 32 4.422 4.347 0.075 1
1 380 . 12 1 1 A 32 32 ASP C C 32 179.136 178.125 1.011 1
1 381 . 12 1 1 A 32 32 ASP CA C 32 57.109 57.227 -0.118 1
1 382 . 12 1 1 A 32 32 ASP CB C 32 40.523 41.466 -0.943 1
1 383 . 12 1 1 A 32 32 ASP N N 32 116.467 118.305 -1.838 1
1 384 . 12 1 1 A 33 33 ALA H H 33 7.536 8.129 -0.593 1
1 385 . 12 1 1 A 33 33 ALA HA H 33 4.222 4.085 0.137 1
1 389 . 12 1 1 A 33 33 ALA C C 33 179.056 178.895 0.161 1
1 390 . 12 1 1 A 33 33 ALA CA C 33 54.469 54.642 -0.173 1
1 391 . 12 1 1 A 33 33 ALA CB C 33 19.085 17.978 1.107 1
1 392 . 12 1 1 A 33 33 ALA N N 33 120.859 121.224 -0.365 1
1 393 . 12 1 1 A 34 34 ALA H H 34 8.296 7.627 0.669 1
1 394 . 12 1 1 A 34 34 ALA HA H 34 4.101 4.343 -0.242 1
1 398 . 12 1 1 A 34 34 ALA C C 34 176.912 178.159 -1.247 1
1 399 . 12 1 1 A 34 34 ALA CA C 34 52.380 52.310 0.070 1
1 400 . 12 1 1 A 34 34 ALA CB C 34 18.817 19.867 -1.050 1
1 401 . 12 1 1 A 34 34 ALA N N 34 118.203 117.778 0.425 1
1 402 . 12 1 1 A 35 35 GLY H H 35 7.911 8.418 -0.507 1
1 403 . 12 1 1 A 35 35 GLY HA2 H 35 3.968 3.970 -0.002 1
1 404 . 12 1 1 A 35 35 GLY HA3 H 35 3.968 3.975 -0.007 1
1 405 . 12 1 1 A 35 35 GLY C C 35 174.374 174.158 0.216 1
1 406 . 12 1 1 A 35 35 GLY CA C 35 46.388 46.347 0.041 1
1 407 . 12 1 1 A 35 35 GLY N N 35 107.752 107.863 -0.111 1
1 408 . 12 1 1 A 36 36 LEU H H 36 7.758 7.912 -0.154 1
1 409 . 12 1 1 A 36 36 LEU HA H 36 4.887 4.889 -0.002 1
1 419 . 12 1 1 A 36 36 LEU C C 36 175.941 175.558 0.383 1
1 420 . 12 1 1 A 36 36 LEU CA C 36 52.443 53.061 -0.618 1
1 421 . 12 1 1 A 36 36 LEU CB C 36 47.885 44.085 3.800 1
1 425 . 12 1 1 A 36 36 LEU N N 36 118.719 120.481 -1.762 1
1 426 . 12 1 1 A 37 37 SER H H 37 8.603 8.879 -0.276 1
1 427 . 12 1 1 A 37 37 SER HA H 37 4.565 4.543 0.022 1
1 430 . 12 1 1 A 37 37 SER C C 37 175.512 175.512 0.000 1
1 431 . 12 1 1 A 37 37 SER CA C 37 57.262 58.860 -1.598 1
1 432 . 12 1 1 A 37 37 SER CB C 37 65.155 63.631 1.524 1
1 433 . 12 1 1 A 37 37 SER N N 37 115.095 116.139 -1.044 1
1 434 . 12 1 1 A 38 38 ILE H H 38 8.822 8.791 0.031 1
1 435 . 12 1 1 A 38 38 ILE HA H 38 3.650 3.748 -0.098 1
1 445 . 12 1 1 A 38 38 ILE C C 38 176.849 177.445 -0.596 1
1 446 . 12 1 1 A 38 38 ILE CA C 38 64.557 65.212 -0.655 1
1 447 . 12 1 1 A 38 38 ILE CB C 38 37.451 38.201 -0.750 1
1 451 . 12 1 1 A 38 38 ILE N N 38 122.026 124.695 -2.669 1
1 452 . 12 1 1 A 39 39 TYR H H 39 7.839 8.585 -0.746 1
1 453 . 12 1 1 A 39 39 TYR HA H 39 4.112 4.097 0.015 1
1 460 . 12 1 1 A 39 39 TYR C C 39 177.703 177.559 0.144 1
1 461 . 12 1 1 A 39 39 TYR CA C 39 60.856 61.313 -0.457 1
1 462 . 12 1 1 A 39 39 TYR CB C 39 38.402 38.778 -0.376 1
1 467 . 12 1 1 A 39 39 TYR N N 39 118.759 120.720 -1.961 1
1 468 . 12 1 1 A 40 40 GLN H H 40 7.687 8.289 -0.602 1
1 469 . 12 1 1 A 40 40 GLN HA H 40 3.865 3.856 0.009 1
1 476 . 12 1 1 A 40 40 GLN C C 40 178.735 178.266 0.469 1
1 477 . 12 1 1 A 40 40 GLN CA C 40 58.089 58.797 -0.708 1
1 478 . 12 1 1 A 40 40 GLN CB C 40 29.950 28.634 1.316 1
1 481 . 12 1 1 A 40 40 GLN N N 40 116.772 118.344 -1.572 1
1 483 . 12 1 1 A 41 41 VAL H H 41 8.494 8.260 0.234 1
1 484 . 12 1 1 A 41 41 VAL HA H 41 3.835 3.766 0.069 1
1 492 . 12 1 1 A 41 41 VAL C C 41 176.977 177.800 -0.823 1
1 493 . 12 1 1 A 41 41 VAL CA C 41 66.102 67.028 -0.926 1
1 494 . 12 1 1 A 41 41 VAL CB C 41 31.105 31.448 -0.343 1
1 497 . 12 1 1 A 41 41 VAL N N 41 117.192 119.477 -2.285 1
1 498 . 12 1 1 A 42 42 ARG H H 42 8.179 8.204 -0.025 1
1 499 . 12 1 1 A 42 42 ARG HA H 42 3.708 3.897 -0.189 1
1 506 . 12 1 1 A 42 42 ARG C C 42 177.570 178.360 -0.790 1
1 507 . 12 1 1 A 42 42 ARG CA C 42 60.349 59.224 1.125 1
1 508 . 12 1 1 A 42 42 ARG CB C 42 30.047 29.912 0.135 1
1 511 . 12 1 1 A 42 42 ARG N N 42 120.574 119.984 0.590 1
1 512 . 12 1 1 A 43 43 LEU H H 43 6.982 7.748 -0.766 1
1 513 . 12 1 1 A 43 43 LEU HA H 43 3.939 3.772 0.167 1
1 523 . 12 1 1 A 43 43 LEU C C 43 180.397 178.454 1.943 1
1 524 . 12 1 1 A 43 43 LEU CA C 43 58.119 57.600 0.519 1
1 525 . 12 1 1 A 43 43 LEU CB C 43 41.294 41.727 -0.433 1
1 529 . 12 1 1 A 43 43 LEU N N 43 117.189 119.686 -2.497 1
1 530 . 12 1 1 A 44 44 TYR H H 44 7.026 7.524 -0.498 1
1 531 . 12 1 1 A 44 44 TYR HA H 44 4.253 4.444 -0.191 1
1 538 . 12 1 1 A 44 44 TYR C C 44 178.411 178.124 0.287 1
1 539 . 12 1 1 A 44 44 TYR CA C 44 60.941 60.675 0.266 1
1 540 . 12 1 1 A 44 44 TYR CB C 44 38.889 37.822 1.067 1
1 545 . 12 1 1 A 44 44 TYR N N 44 117.020 118.074 -1.054 1
1 546 . 12 1 1 A 45 45 LEU H H 45 8.429 8.423 0.006 1
1 547 . 12 1 1 A 45 45 LEU HA H 45 3.486 3.534 -0.048 1
1 557 . 12 1 1 A 45 45 LEU C C 45 178.648 178.885 -0.237 1
1 558 . 12 1 1 A 45 45 LEU CA C 45 57.915 57.535 0.380 1
1 559 . 12 1 1 A 45 45 LEU CB C 45 39.073 40.525 -1.452 1
1 563 . 12 1 1 A 45 45 LEU N N 45 119.649 119.912 -0.263 1
1 564 . 12 1 1 A 46 46 GLU H H 46 8.309 7.964 0.345 1
1 565 . 12 1 1 A 46 46 GLU HA H 46 4.286 4.107 0.179 1
1 570 . 12 1 1 A 46 46 GLU C C 46 179.577 179.507 0.070 1
1 571 . 12 1 1 A 46 46 GLU CA C 46 59.570 59.865 -0.295 1
1 572 . 12 1 1 A 46 46 GLU CB C 46 29.034 29.343 -0.309 1
1 574 . 12 1 1 A 46 46 GLU N N 46 117.366 117.592 -0.226 1
1 575 . 12 1 1 A 47 47 GLN H H 47 7.493 8.152 -0.659 1
1 576 . 12 1 1 A 47 47 GLN HA H 47 4.243 4.061 0.182 1
1 583 . 12 1 1 A 47 47 GLN C C 47 178.870 178.276 0.594 1
1 584 . 12 1 1 A 47 47 GLN CA C 47 59.581 58.575 1.006 1
1 585 . 12 1 1 A 47 47 GLN CB C 47 28.300 27.800 0.500 1
1 588 . 12 1 1 A 47 47 GLN N N 47 119.345 118.205 1.140 1
1 590 . 12 1 1 A 48 48 LEU H H 48 8.160 7.988 0.172 1
1 591 . 12 1 1 A 48 48 LEU HA H 48 4.211 4.094 0.117 1
1 601 . 12 1 1 A 48 48 LEU C C 48 180.111 179.114 0.997 1
1 602 . 12 1 1 A 48 48 LEU CA C 48 57.179 57.808 -0.629 1
1 603 . 12 1 1 A 48 48 LEU CB C 48 42.067 41.974 0.093 1
1 607 . 12 1 1 A 48 48 LEU N N 48 118.594 121.806 -3.212 1
1 608 . 12 1 1 A 49 49 HIS H H 49 8.864 8.514 0.350 1
1 609 . 12 1 1 A 49 49 HIS HA H 49 5.162 4.526 0.636 1
1 613 . 12 1 1 A 49 49 HIS C C 49 178.801 176.871 1.930 1
1 614 . 12 1 1 A 49 49 HIS CA C 49 58.397 58.964 -0.567 1
1 615 . 12 1 1 A 49 49 HIS CB C 49 29.631 30.255 -0.624 1
1 617 . 12 1 1 A 49 49 HIS N N 49 122.537 117.600 4.937 1
1 618 . 12 1 1 A 50 50 ASP H H 50 8.683 8.228 0.455 1
1 619 . 12 1 1 A 50 50 ASP HA H 50 4.356 4.205 0.151 1
1 622 . 12 1 1 A 50 50 ASP C C 50 178.474 178.274 0.200 1
1 623 . 12 1 1 A 50 50 ASP CA C 50 57.744 56.938 0.806 1
1 624 . 12 1 1 A 50 50 ASP CB C 50 40.575 41.201 -0.626 1
1 625 . 12 1 1 A 50 50 ASP N N 50 123.169 119.145 4.024 1
1 626 . 12 1 1 A 51 51 VAL H H 51 7.606 7.840 -0.234 1
1 627 . 12 1 1 A 51 51 VAL HA H 51 4.514 4.068 0.446 1
1 635 . 12 1 1 A 51 51 VAL C C 51 176.862 176.463 0.399 1
1 636 . 12 1 1 A 51 51 VAL CA C 51 61.590 64.033 -2.443 1
1 637 . 12 1 1 A 51 51 VAL CB C 51 31.423 32.970 -1.547 1
1 640 . 12 1 1 A 51 51 VAL N N 51 109.266 112.368 -3.102 1
1 641 . 12 1 1 A 52 52 GLY H H 52 7.696 7.763 -0.067 1
1 642 . 12 1 1 A 52 52 GLY HA2 H 52 4.172 4.082 0.090 1
1 643 . 12 1 1 A 52 52 GLY HA3 H 52 3.938 4.093 -0.155 1
1 644 . 12 1 1 A 52 52 GLY C C 52 174.276 174.609 -0.333 1
1 645 . 12 1 1 A 52 52 GLY CA C 52 46.228 45.469 0.759 1
1 646 . 12 1 1 A 52 52 GLY N N 52 108.681 110.499 -1.818 1
1 647 . 12 1 1 A 53 53 VAL H H 53 8.046 8.343 -0.297 1
1 648 . 12 1 1 A 53 53 VAL HA H 53 4.079 4.234 -0.155 1
1 656 . 12 1 1 A 53 53 VAL C C 53 175.949 175.460 0.489 1
1 657 . 12 1 1 A 53 53 VAL CA C 53 64.063 63.625 0.438 1
1 658 . 12 1 1 A 53 53 VAL CB C 53 33.160 34.007 -0.847 1
1 661 . 12 1 1 A 53 53 VAL N N 53 117.892 116.547 1.345 1
1 662 . 12 1 1 A 54 54 LEU H H 54 6.835 7.400 -0.565 1
1 663 . 12 1 1 A 54 54 LEU HA H 54 5.348 4.999 0.349 1
1 673 . 12 1 1 A 54 54 LEU C C 54 175.713 175.834 -0.121 1
1 674 . 12 1 1 A 54 54 LEU CA C 54 52.194 52.979 -0.785 1
1 675 . 12 1 1 A 54 54 LEU CB C 54 46.733 43.826 2.907 1
1 679 . 12 1 1 A 54 54 LEU N N 54 114.848 118.099 -3.251 1
1 680 . 12 1 1 A 55 55 GLU H H 55 9.549 9.115 0.434 1
1 681 . 12 1 1 A 55 55 GLU HA H 55 4.826 5.257 -0.431 1
1 686 . 12 1 1 A 55 55 GLU C C 55 174.661 176.371 -1.710 1
1 687 . 12 1 1 A 55 55 GLU CA C 55 54.637 55.081 -0.444 1
1 688 . 12 1 1 A 55 55 GLU CB C 55 32.891 32.215 0.676 1
1 690 . 12 1 1 A 55 55 GLU N N 55 121.431 124.731 -3.300 1
1 691 . 12 1 1 A 56 56 LYS H H 56 8.513 8.707 -0.194 1
1 692 . 12 1 1 A 56 56 LYS HA H 56 4.151 4.820 -0.669 1
1 701 . 12 1 1 A 56 56 LYS C C 56 176.270 175.562 0.708 1
1 702 . 12 1 1 A 56 56 LYS CA C 56 54.890 55.520 -0.630 1
1 703 . 12 1 1 A 56 56 LYS CB C 56 33.162 33.147 0.015 1
1 707 . 12 1 1 A 56 56 LYS N N 56 126.539 122.650 3.889 1
1 708 . 12 1 1 A 57 57 VAL H H 57 8.279 8.836 -0.557 1
1 709 . 12 1 1 A 57 57 VAL HA H 57 3.820 4.551 -0.731 1
1 717 . 12 1 1 A 57 57 VAL C C 57 175.108 175.938 -0.830 1
1 718 . 12 1 1 A 57 57 VAL CA C 57 62.834 60.711 2.123 1
1 719 . 12 1 1 A 57 57 VAL CB C 57 32.549 33.536 -0.987 1
1 722 . 12 1 1 A 57 57 VAL N N 57 126.540 122.212 4.328 1
1 723 . 12 1 1 A 58 58 ASN H H 58 8.383 8.736 -0.353 1
1 724 . 12 1 1 A 58 58 ASN HA H 58 4.612 4.623 -0.011 1
1 729 . 12 1 1 A 58 58 ASN C C 58 174.772 175.541 -0.769 1
1 730 . 12 1 1 A 58 58 ASN CA C 58 52.575 55.471 -2.896 1
1 731 . 12 1 1 A 58 58 ASN CB C 58 38.502 37.303 1.199 1
1 733 . 12 1 1 A 58 58 ASN N N 58 121.767 120.151 1.616 1
1 735 . 12 1 1 A 59 59 ALA H H 59 8.165 8.622 -0.457 1
1 736 . 12 1 1 A 59 59 ALA HA H 59 4.251 4.035 0.216 1
1 740 . 12 1 1 A 59 59 ALA C C 59 177.478 178.612 -1.134 1
1 741 . 12 1 1 A 59 59 ALA CA C 59 52.490 52.200 0.290 1
1 742 . 12 1 1 A 59 59 ALA CB C 59 19.724 19.816 -0.092 1
1 743 . 12 1 1 A 59 59 ALA N N 59 125.082 123.902 1.180 1
1 744 . 12 1 1 A 60 60 GLY H H 60 8.291 7.961 0.330 1
1 745 . 12 1 1 A 60 60 GLY HA2 H 60 4.165 3.862 0.303 1
1 746 . 12 1 1 A 60 60 GLY HA3 H 60 3.853 3.894 -0.041 1
1 747 . 12 1 1 A 60 60 GLY C C 60 174.171 174.098 0.073 1
1 748 . 12 1 1 A 60 60 GLY CA C 60 44.994 45.180 -0.186 1
1 749 . 12 1 1 A 60 60 GLY N N 60 108.518 107.457 1.061 1
1 750 . 12 1 1 A 61 61 LYS H H 61 8.189 7.605 0.584 1
1 751 . 12 1 1 A 61 61 LYS HA H 61 4.320 4.194 0.126 1
1 760 . 12 1 1 A 61 61 LYS C C 61 177.712 177.322 0.390 1
1 761 . 12 1 1 A 61 61 LYS CA C 61 56.832 57.840 -1.008 1
1 762 . 12 1 1 A 61 61 LYS CB C 61 32.641 32.068 0.573 1
1 766 . 12 1 1 A 61 61 LYS N N 61 120.532 120.723 -0.191 1
1 767 . 12 1 1 A 62 62 GLY H H 62 8.767 8.841 -0.074 1
1 768 . 12 1 1 A 62 62 GLY HA2 H 62 4.021 3.950 0.071 1
1 769 . 12 1 1 A 62 62 GLY HA3 H 62 3.849 3.954 -0.105 1
1 770 . 12 1 1 A 62 62 GLY C C 62 173.782 174.211 -0.429 1
1 771 . 12 1 1 A 62 62 GLY CA C 62 45.844 45.747 0.097 1
1 772 . 12 1 1 A 62 62 GLY N N 62 111.547 112.359 -0.812 1
1 773 . 12 1 1 A 63 63 VAL H H 63 7.379 7.933 -0.554 1
1 774 . 12 1 1 A 63 63 VAL HA H 63 4.591 4.202 0.389 1
1 782 . 12 1 1 A 63 63 VAL C C 63 174.262 175.000 -0.738 1
1 783 . 12 1 1 A 63 63 VAL CA C 63 59.292 60.763 -1.471 1
1 784 . 12 1 1 A 63 63 VAL CB C 63 32.726 31.733 0.993 1
1 787 . 12 1 1 A 63 63 VAL N N 63 117.546 119.419 -1.873 1
1 788 . 12 1 1 A 64 64 PRO HA H 64 4.458 4.600 -0.142 1
1 795 . 12 1 1 A 64 64 PRO C C 64 177.166 176.506 0.660 1
1 796 . 12 1 1 A 64 64 PRO CA C 64 63.661 62.883 0.778 1
1 797 . 12 1 1 A 64 64 PRO CB C 64 32.321 31.634 0.687 1
1 800 . 12 1 1 A 65 65 GLY H H 65 8.463 8.670 -0.207 1
1 801 . 12 1 1 A 65 65 GLY HA2 H 65 3.882 3.618 0.264 1
1 802 . 12 1 1 A 65 65 GLY HA3 H 65 3.602 3.710 -0.108 1
1 803 . 12 1 1 A 65 65 GLY C C 65 172.406 172.436 -0.030 1
1 804 . 12 1 1 A 65 65 GLY CA C 65 45.933 45.280 0.653 1
1 805 . 12 1 1 A 65 65 GLY N N 65 109.819 109.821 -0.002 1
1 806 . 12 1 1 A 66 66 LEU H H 66 7.534 8.529 -0.995 1
1 807 . 12 1 1 A 66 66 LEU HA H 66 4.940 4.569 0.371 1
1 817 . 12 1 1 A 66 66 LEU C C 66 176.237 176.075 0.162 1
1 818 . 12 1 1 A 66 66 LEU CA C 66 53.687 53.842 -0.155 1
1 819 . 12 1 1 A 66 66 LEU CB C 66 46.108 43.359 2.749 1
1 823 . 12 1 1 A 66 66 LEU N N 66 122.249 126.431 -4.182 1
1 824 . 12 1 1 A 67 67 TRP H H 67 8.916 9.344 -0.428 1
1 825 . 12 1 1 A 67 67 TRP HA H 67 5.526 5.173 0.353 1
1 834 . 12 1 1 A 67 67 TRP C C 67 175.670 175.757 -0.087 1
1 835 . 12 1 1 A 67 67 TRP CA C 67 56.241 55.574 0.667 1
1 836 . 12 1 1 A 67 67 TRP CB C 67 33.314 31.439 1.875 1
1 842 . 12 1 1 A 67 67 TRP N N 67 121.160 124.873 -3.713 1
1 844 . 12 1 1 A 68 68 ARG H H 68 8.772 9.302 -0.530 1
1 845 . 12 1 1 A 68 68 ARG HA H 68 4.832 5.184 -0.352 1
1 853 . 12 1 1 A 68 68 ARG C C 68 174.720 175.482 -0.762 1
1 854 . 12 1 1 A 68 68 ARG CA C 68 54.690 54.671 0.019 1
1 855 . 12 1 1 A 68 68 ARG CB C 68 35.176 33.520 1.656 1
1 858 . 12 1 1 A 68 68 ARG N N 68 117.471 121.584 -4.113 1
1 860 . 12 1 1 A 69 69 LEU H H 69 9.355 8.589 0.766 1
1 861 . 12 1 1 A 69 69 LEU HA H 69 4.557 4.520 0.037 1
1 871 . 12 1 1 A 69 69 LEU C C 69 177.180 176.906 0.274 1
1 872 . 12 1 1 A 69 69 LEU CA C 69 55.780 54.311 1.469 1
1 873 . 12 1 1 A 69 69 LEU CB C 69 42.736 43.252 -0.516 1
1 877 . 12 1 1 A 69 69 LEU N N 69 125.211 121.163 4.048 1
1 878 . 12 1 1 A 70 70 LEU H H 70 8.058 8.050 0.008 1
1 879 . 12 1 1 A 70 70 LEU HA H 70 4.364 4.776 -0.412 1
1 889 . 12 1 1 A 70 70 LEU C C 70 176.808 177.438 -0.630 1
1 890 . 12 1 1 A 70 70 LEU CA C 70 55.257 53.592 1.665 1
1 891 . 12 1 1 A 70 70 LEU CB C 70 42.413 41.902 0.511 1
1 895 . 12 1 1 A 70 70 LEU N N 70 125.525 118.460 7.065 1
1 1 . 13 1 1 A 2 2 SER HA H 2 4.126 4.443 -0.317 1
1 4 . 13 1 1 A 2 2 SER CA C 2 57.564 58.836 -1.272 1
1 5 . 13 1 1 A 2 2 SER CB C 2 63.953 64.209 -0.256 1
1 6 . 13 1 1 A 3 3 GLU HA H 3 4.408 4.401 0.007 1
1 11 . 13 1 1 A 3 3 GLU C C 3 176.658 176.701 -0.043 1
1 12 . 13 1 1 A 3 3 GLU CA C 3 56.802 56.555 0.247 1
1 13 . 13 1 1 A 3 3 GLU CB C 3 30.674 29.949 0.725 1
1 15 . 13 1 1 A 4 4 SER H H 4 8.650 9.000 -0.350 1
1 16 . 13 1 1 A 4 4 SER HA H 4 4.463 4.526 -0.063 1
1 19 . 13 1 1 A 4 4 SER C C 4 175.949 174.434 1.515 1
1 20 . 13 1 1 A 4 4 SER CA C 4 58.557 57.582 0.975 1
1 21 . 13 1 1 A 4 4 SER CB C 4 63.834 60.647 3.187 1
1 22 . 13 1 1 A 4 4 SER N N 4 118.042 120.735 -2.693 1
1 23 . 13 1 1 A 5 5 ILE H H 5 8.404 7.842 0.562 1
1 24 . 13 1 1 A 5 5 ILE HA H 5 3.902 3.799 0.103 1
1 34 . 13 1 1 A 5 5 ILE C C 5 176.608 177.434 -0.826 1
1 35 . 13 1 1 A 5 5 ILE CA C 5 62.662 64.058 -1.396 1
1 36 . 13 1 1 A 5 5 ILE CB C 5 37.622 37.516 0.106 1
1 40 . 13 1 1 A 5 5 ILE N N 5 124.711 123.558 1.153 1
1 41 . 13 1 1 A 6 6 VAL H H 6 7.602 8.117 -0.515 1
1 42 . 13 1 1 A 6 6 VAL HA H 6 3.293 3.413 -0.120 1
1 50 . 13 1 1 A 6 6 VAL C C 6 177.088 178.218 -1.130 1
1 51 . 13 1 1 A 6 6 VAL CA C 6 67.180 66.730 0.450 1
1 52 . 13 1 1 A 6 6 VAL CB C 6 31.517 31.662 -0.145 1
1 55 . 13 1 1 A 6 6 VAL N N 6 119.974 121.229 -1.255 1
1 56 . 13 1 1 A 7 7 THR H H 7 7.515 8.296 -0.781 1
1 57 . 13 1 1 A 7 7 THR HA H 7 3.823 3.782 0.041 1
1 62 . 13 1 1 A 7 7 THR C C 7 176.978 176.092 0.886 1
1 63 . 13 1 1 A 7 7 THR CA C 7 66.257 67.796 -1.539 1
1 64 . 13 1 1 A 7 7 THR CB C 7 68.410 68.272 0.138 1
1 66 . 13 1 1 A 7 7 THR N N 7 114.177 116.456 -2.279 1
1 67 . 13 1 1 A 8 8 LYS H H 8 7.807 7.898 -0.091 1
1 68 . 13 1 1 A 8 8 LYS HA H 8 4.066 3.947 0.119 1
1 77 . 13 1 1 A 8 8 LYS C C 8 178.733 178.315 0.418 1
1 78 . 13 1 1 A 8 8 LYS CA C 8 59.338 59.690 -0.352 1
1 79 . 13 1 1 A 8 8 LYS CB C 8 32.002 31.906 0.096 1
1 83 . 13 1 1 A 8 8 LYS N N 8 123.387 120.424 2.963 1
1 84 . 13 1 1 A 9 9 ILE H H 9 8.288 8.170 0.118 1
1 85 . 13 1 1 A 9 9 ILE HA H 9 3.421 3.582 -0.161 1
1 95 . 13 1 1 A 9 9 ILE C C 9 177.187 178.350 -1.163 1
1 96 . 13 1 1 A 9 9 ILE CA C 9 65.772 65.742 0.030 1
1 97 . 13 1 1 A 9 9 ILE CB C 9 37.183 37.914 -0.731 1
1 101 . 13 1 1 A 9 9 ILE N N 9 119.543 119.149 0.394 1
1 102 . 13 1 1 A 10 10 ILE H H 10 8.073 7.963 0.110 1
1 103 . 13 1 1 A 10 10 ILE HA H 10 3.305 3.527 -0.222 1
1 113 . 13 1 1 A 10 10 ILE C C 10 177.308 178.302 -0.994 1
1 114 . 13 1 1 A 10 10 ILE CA C 10 66.704 65.162 1.542 1
1 115 . 13 1 1 A 10 10 ILE CB C 10 37.840 37.709 0.131 1
1 119 . 13 1 1 A 10 10 ILE N N 10 119.219 120.095 -0.876 1
1 120 . 13 1 1 A 11 11 SER H H 11 7.861 8.180 -0.319 1
1 121 . 13 1 1 A 11 11 SER HA H 11 4.250 4.195 0.055 1
1 124 . 13 1 1 A 11 11 SER C C 11 176.918 177.418 -0.500 1
1 125 . 13 1 1 A 11 11 SER CA C 11 61.911 61.296 0.615 1
1 126 . 13 1 1 A 11 11 SER CB C 11 62.998 62.884 0.114 1
1 127 . 13 1 1 A 11 11 SER N N 11 113.959 115.963 -2.004 1
1 128 . 13 1 1 A 12 12 ILE H H 12 8.250 7.990 0.260 1
1 129 . 13 1 1 A 12 12 ILE HA H 12 3.801 3.661 0.140 1
1 139 . 13 1 1 A 12 12 ILE C C 12 178.130 178.112 0.018 1
1 140 . 13 1 1 A 12 12 ILE CA C 12 65.023 64.561 0.462 1
1 141 . 13 1 1 A 12 12 ILE CB C 12 38.195 37.742 0.453 1
1 145 . 13 1 1 A 12 12 ILE N N 12 123.767 122.217 1.550 1
1 146 . 13 1 1 A 13 13 VAL H H 13 8.308 8.015 0.293 1
1 147 . 13 1 1 A 13 13 VAL HA H 13 3.435 3.479 -0.044 1
1 155 . 13 1 1 A 13 13 VAL C C 13 177.283 178.018 -0.735 1
1 156 . 13 1 1 A 13 13 VAL CA C 13 67.693 66.804 0.889 1
1 157 . 13 1 1 A 13 13 VAL CB C 13 31.139 31.336 -0.197 1
1 160 . 13 1 1 A 13 13 VAL N N 13 120.066 119.441 0.625 1
1 161 . 13 1 1 A 14 14 GLN H H 14 8.612 8.152 0.460 1
1 162 . 13 1 1 A 14 14 GLN HA H 14 3.831 3.980 -0.149 1
1 169 . 13 1 1 A 14 14 GLN C C 14 178.256 178.091 0.165 1
1 170 . 13 1 1 A 14 14 GLN CA C 14 59.660 59.341 0.319 1
1 171 . 13 1 1 A 14 14 GLN CB C 14 29.456 28.202 1.254 1
1 174 . 13 1 1 A 14 14 GLN N N 14 118.099 119.795 -1.696 1
1 176 . 13 1 1 A 15 15 GLU H H 15 8.378 8.343 0.035 1
1 177 . 13 1 1 A 15 15 GLU HA H 15 4.110 4.018 0.092 1
1 182 . 13 1 1 A 15 15 GLU C C 15 179.659 179.194 0.465 1
1 183 . 13 1 1 A 15 15 GLU CA C 15 59.476 59.654 -0.178 1
1 184 . 13 1 1 A 15 15 GLU CB C 15 29.725 28.991 0.734 1
1 186 . 13 1 1 A 15 15 GLU N N 15 118.580 119.195 -0.615 1
1 187 . 13 1 1 A 16 16 ARG H H 16 8.439 8.392 0.047 1
1 188 . 13 1 1 A 16 16 ARG HA H 16 4.157 3.995 0.162 1
1 196 . 13 1 1 A 16 16 ARG C C 16 179.276 178.988 0.288 1
1 197 . 13 1 1 A 16 16 ARG CA C 16 58.141 59.929 -1.788 1
1 198 . 13 1 1 A 16 16 ARG CB C 16 29.434 30.082 -0.648 1
1 201 . 13 1 1 A 16 16 ARG N N 16 118.688 118.560 0.128 1
1 203 . 13 1 1 A 17 17 GLN H H 17 8.861 7.622 1.239 1
1 204 . 13 1 1 A 17 17 GLN HA H 17 4.236 4.131 0.105 1
1 211 . 13 1 1 A 17 17 GLN C C 17 178.736 178.961 -0.225 1
1 212 . 13 1 1 A 17 17 GLN CA C 17 59.683 58.739 0.944 1
1 213 . 13 1 1 A 17 17 GLN CB C 17 29.960 28.099 1.861 1
1 216 . 13 1 1 A 17 17 GLN N N 17 120.427 118.598 1.829 1
1 218 . 13 1 1 A 18 18 ASN H H 18 8.017 8.157 -0.140 1
1 219 . 13 1 1 A 18 18 ASN HA H 18 4.605 4.520 0.085 1
1 224 . 13 1 1 A 18 18 ASN C C 18 177.906 178.325 -0.419 1
1 225 . 13 1 1 A 18 18 ASN CA C 18 55.375 56.437 -1.062 1
1 226 . 13 1 1 A 18 18 ASN CB C 18 38.383 37.700 0.683 1
1 228 . 13 1 1 A 18 18 ASN N N 18 117.033 118.717 -1.684 1
1 230 . 13 1 1 A 19 19 MET H H 19 7.994 7.635 0.359 1
1 231 . 13 1 1 A 19 19 MET HA H 19 4.372 4.301 0.071 1
1 236 . 13 1 1 A 19 19 MET C C 19 176.518 176.477 0.041 1
1 237 . 13 1 1 A 19 19 MET CA C 19 57.623 57.994 -0.371 1
1 238 . 13 1 1 A 19 19 MET CB C 19 33.248 33.028 0.220 1
1 240 . 13 1 1 A 19 19 MET N N 19 119.320 118.385 0.935 1
1 241 . 13 1 1 A 20 20 ASP H H 20 7.800 7.818 -0.018 1
1 242 . 13 1 1 A 20 20 ASP HA H 20 4.990 4.776 0.214 1
1 245 . 13 1 1 A 20 20 ASP C C 20 176.082 175.462 0.620 1
1 246 . 13 1 1 A 20 20 ASP CA C 20 53.796 53.698 0.098 1
1 247 . 13 1 1 A 20 20 ASP CB C 20 40.409 42.028 -1.619 1
1 248 . 13 1 1 A 20 20 ASP N N 20 119.127 117.012 2.115 1
1 249 . 13 1 1 A 21 21 ASP H H 21 8.136 9.176 -1.040 1
1 250 . 13 1 1 A 21 21 ASP HA H 21 4.497 4.428 0.069 1
1 253 . 13 1 1 A 21 21 ASP C C 21 176.264 176.479 -0.215 1
1 254 . 13 1 1 A 21 21 ASP CA C 21 55.508 56.174 -0.666 1
1 255 . 13 1 1 A 21 21 ASP CB C 21 40.063 40.048 0.015 1
1 256 . 13 1 1 A 21 21 ASP N N 21 118.276 126.388 -8.112 1
1 257 . 13 1 1 A 22 22 GLY H H 22 8.728 8.084 0.644 1
1 258 . 13 1 1 A 22 22 GLY HA2 H 22 4.189 3.954 0.235 1
1 259 . 13 1 1 A 22 22 GLY HA3 H 22 3.683 3.955 -0.272 1
1 260 . 13 1 1 A 22 22 GLY C C 22 174.304 173.675 0.629 1
1 261 . 13 1 1 A 22 22 GLY CA C 22 45.629 45.176 0.453 1
1 262 . 13 1 1 A 22 22 GLY N N 22 105.878 107.010 -1.132 1
1 263 . 13 1 1 A 23 23 ALA H H 23 7.473 7.612 -0.139 1
1 264 . 13 1 1 A 23 23 ALA HA H 23 4.519 4.686 -0.167 1
1 268 . 13 1 1 A 23 23 ALA C C 23 174.065 175.022 -0.957 1
1 269 . 13 1 1 A 23 23 ALA CA C 23 51.142 49.432 1.710 1
1 270 . 13 1 1 A 23 23 ALA CB C 23 18.283 21.637 -3.354 1
1 271 . 13 1 1 A 23 23 ALA N N 23 125.323 122.651 2.672 1
1 272 . 13 1 1 A 24 24 PRO HA H 24 4.590 4.663 -0.073 1
1 279 . 13 1 1 A 24 24 PRO C C 24 175.253 175.400 -0.147 1
1 280 . 13 1 1 A 24 24 PRO CA C 24 62.186 62.239 -0.053 1
1 281 . 13 1 1 A 24 24 PRO CB C 24 32.931 32.884 0.047 1
1 284 . 13 1 1 A 25 25 VAL H H 25 9.334 8.591 0.743 1
1 285 . 13 1 1 A 25 25 VAL HA H 25 4.378 4.419 -0.041 1
1 293 . 13 1 1 A 25 25 VAL C C 25 176.439 175.407 1.032 1
1 294 . 13 1 1 A 25 25 VAL CA C 25 61.482 61.050 0.432 1
1 295 . 13 1 1 A 25 25 VAL CB C 25 34.781 33.554 1.227 1
1 298 . 13 1 1 A 25 25 VAL N N 25 120.408 119.565 0.843 1
1 299 . 13 1 1 A 26 26 LYS H H 26 9.300 8.996 0.304 1
1 300 . 13 1 1 A 26 26 LYS HA H 26 4.982 4.561 0.421 1
1 309 . 13 1 1 A 26 26 LYS C C 26 179.008 178.202 0.806 1
1 310 . 13 1 1 A 26 26 LYS CA C 26 56.908 55.342 1.566 1
1 311 . 13 1 1 A 26 26 LYS CB C 26 34.071 33.603 0.468 1
1 315 . 13 1 1 A 26 26 LYS N N 26 126.177 125.985 0.192 1
1 316 . 13 1 1 A 27 27 THR H H 27 8.618 8.857 -0.239 1
1 317 . 13 1 1 A 27 27 THR HA H 27 3.662 4.001 -0.339 1
1 322 . 13 1 1 A 27 27 THR C C 27 176.442 176.325 0.117 1
1 323 . 13 1 1 A 27 27 THR CA C 27 67.591 66.615 0.976 1
1 324 . 13 1 1 A 27 27 THR CB C 27 68.868 68.812 0.056 1
1 326 . 13 1 1 A 27 27 THR N N 27 119.020 117.752 1.268 1
1 327 . 13 1 1 A 28 28 ARG H H 28 9.288 8.172 1.116 1
1 328 . 13 1 1 A 28 28 ARG HA H 28 3.879 4.024 -0.145 1
1 335 . 13 1 1 A 28 28 ARG C C 28 176.884 179.031 -2.147 1
1 336 . 13 1 1 A 28 28 ARG CA C 28 59.431 59.572 -0.141 1
1 337 . 13 1 1 A 28 28 ARG CB C 28 29.953 30.353 -0.400 1
1 340 . 13 1 1 A 28 28 ARG N N 28 119.100 121.287 -2.187 1
1 341 . 13 1 1 A 29 29 ASP H H 29 6.907 8.133 -1.226 1
1 342 . 13 1 1 A 29 29 ASP HA H 29 4.550 4.335 0.215 1
1 345 . 13 1 1 A 29 29 ASP C C 29 179.050 178.855 0.195 1
1 346 . 13 1 1 A 29 29 ASP CA C 29 57.262 57.206 0.056 1
1 347 . 13 1 1 A 29 29 ASP CB C 29 40.191 40.468 -0.277 1
1 348 . 13 1 1 A 29 29 ASP N N 29 117.490 119.733 -2.243 1
1 349 . 13 1 1 A 30 30 ILE H H 30 7.554 7.937 -0.383 1
1 350 . 13 1 1 A 30 30 ILE HA H 30 3.595 3.724 -0.129 1
1 360 . 13 1 1 A 30 30 ILE C C 30 176.907 177.647 -0.740 1
1 361 . 13 1 1 A 30 30 ILE CA C 30 65.002 65.940 -0.938 1
1 362 . 13 1 1 A 30 30 ILE CB C 30 37.999 38.051 -0.052 1
1 366 . 13 1 1 A 30 30 ILE N N 30 120.978 120.261 0.717 1
1 367 . 13 1 1 A 31 31 ALA H H 31 8.269 8.348 -0.079 1
1 368 . 13 1 1 A 31 31 ALA HA H 31 3.720 3.990 -0.270 1
1 372 . 13 1 1 A 31 31 ALA C C 31 179.170 179.260 -0.090 1
1 373 . 13 1 1 A 31 31 ALA CA C 31 56.354 55.013 1.341 1
1 374 . 13 1 1 A 31 31 ALA CB C 31 17.843 18.167 -0.324 1
1 375 . 13 1 1 A 31 31 ALA N N 31 121.171 121.832 -0.661 1
1 376 . 13 1 1 A 32 32 ASP H H 32 8.293 8.327 -0.034 1
1 377 . 13 1 1 A 32 32 ASP HA H 32 4.422 4.337 0.085 1
1 380 . 13 1 1 A 32 32 ASP C C 32 179.136 177.962 1.174 1
1 381 . 13 1 1 A 32 32 ASP CA C 32 57.109 57.081 0.028 1
1 382 . 13 1 1 A 32 32 ASP CB C 32 40.523 41.034 -0.511 1
1 383 . 13 1 1 A 32 32 ASP N N 32 116.467 118.971 -2.504 1
1 384 . 13 1 1 A 33 33 ALA H H 33 7.536 7.902 -0.366 1
1 385 . 13 1 1 A 33 33 ALA HA H 33 4.222 4.170 0.052 1
1 389 . 13 1 1 A 33 33 ALA C C 33 179.056 179.413 -0.357 1
1 390 . 13 1 1 A 33 33 ALA CA C 33 54.469 54.538 -0.069 1
1 391 . 13 1 1 A 33 33 ALA CB C 33 19.085 18.099 0.986 1
1 392 . 13 1 1 A 33 33 ALA N N 33 120.859 121.317 -0.458 1
1 393 . 13 1 1 A 34 34 ALA H H 34 8.296 7.733 0.563 1
1 394 . 13 1 1 A 34 34 ALA HA H 34 4.101 4.284 -0.183 1
1 398 . 13 1 1 A 34 34 ALA C C 34 176.912 178.197 -1.285 1
1 399 . 13 1 1 A 34 34 ALA CA C 34 52.380 52.400 -0.020 1
1 400 . 13 1 1 A 34 34 ALA CB C 34 18.817 19.814 -0.997 1
1 401 . 13 1 1 A 34 34 ALA N N 34 118.203 117.840 0.363 1
1 402 . 13 1 1 A 35 35 GLY H H 35 7.911 8.452 -0.541 1
1 403 . 13 1 1 A 35 35 GLY HA2 H 35 3.968 3.962 0.006 1
1 404 . 13 1 1 A 35 35 GLY HA3 H 35 3.968 3.968 0.000 1
1 405 . 13 1 1 A 35 35 GLY C C 35 174.374 174.320 0.054 1
1 406 . 13 1 1 A 35 35 GLY CA C 35 46.388 46.310 0.078 1
1 407 . 13 1 1 A 35 35 GLY N N 35 107.752 107.820 -0.068 1
1 408 . 13 1 1 A 36 36 LEU H H 36 7.758 7.345 0.413 1
1 409 . 13 1 1 A 36 36 LEU HA H 36 4.887 4.812 0.075 1
1 419 . 13 1 1 A 36 36 LEU C C 36 175.941 176.138 -0.197 1
1 420 . 13 1 1 A 36 36 LEU CA C 36 52.443 52.772 -0.329 1
1 421 . 13 1 1 A 36 36 LEU CB C 36 47.885 43.939 3.946 1
1 425 . 13 1 1 A 36 36 LEU N N 36 118.719 120.645 -1.926 1
1 426 . 13 1 1 A 37 37 SER H H 37 8.603 8.869 -0.266 1
1 427 . 13 1 1 A 37 37 SER HA H 37 4.565 4.585 -0.020 1
1 430 . 13 1 1 A 37 37 SER C C 37 175.512 175.910 -0.398 1
1 431 . 13 1 1 A 37 37 SER CA C 37 57.262 57.809 -0.547 1
1 432 . 13 1 1 A 37 37 SER CB C 37 65.155 64.572 0.583 1
1 433 . 13 1 1 A 37 37 SER N N 37 115.095 114.939 0.156 1
1 434 . 13 1 1 A 38 38 ILE H H 38 8.822 8.845 -0.023 1
1 435 . 13 1 1 A 38 38 ILE HA H 38 3.650 3.793 -0.143 1
1 445 . 13 1 1 A 38 38 ILE C C 38 176.849 177.470 -0.621 1
1 446 . 13 1 1 A 38 38 ILE CA C 38 64.557 65.246 -0.689 1
1 447 . 13 1 1 A 38 38 ILE CB C 38 37.451 37.975 -0.524 1
1 451 . 13 1 1 A 38 38 ILE N N 38 122.026 123.892 -1.866 1
1 452 . 13 1 1 A 39 39 TYR H H 39 7.839 8.624 -0.785 1
1 453 . 13 1 1 A 39 39 TYR HA H 39 4.112 4.101 0.011 1
1 460 . 13 1 1 A 39 39 TYR C C 39 177.703 177.601 0.102 1
1 461 . 13 1 1 A 39 39 TYR CA C 39 60.856 61.479 -0.623 1
1 462 . 13 1 1 A 39 39 TYR CB C 39 38.402 39.035 -0.633 1
1 467 . 13 1 1 A 39 39 TYR N N 39 118.759 120.566 -1.807 1
1 468 . 13 1 1 A 40 40 GLN H H 40 7.687 7.938 -0.251 1
1 469 . 13 1 1 A 40 40 GLN HA H 40 3.865 4.013 -0.148 1
1 476 . 13 1 1 A 40 40 GLN C C 40 178.735 178.494 0.241 1
1 477 . 13 1 1 A 40 40 GLN CA C 40 58.089 58.549 -0.460 1
1 478 . 13 1 1 A 40 40 GLN CB C 40 29.950 28.641 1.309 1
1 481 . 13 1 1 A 40 40 GLN N N 40 116.772 118.626 -1.854 1
1 483 . 13 1 1 A 41 41 VAL H H 41 8.494 8.407 0.087 1
1 484 . 13 1 1 A 41 41 VAL HA H 41 3.835 3.654 0.181 1
1 492 . 13 1 1 A 41 41 VAL C C 41 176.977 177.614 -0.637 1
1 493 . 13 1 1 A 41 41 VAL CA C 41 66.102 67.004 -0.902 1
1 494 . 13 1 1 A 41 41 VAL CB C 41 31.105 31.461 -0.356 1
1 497 . 13 1 1 A 41 41 VAL N N 41 117.192 120.463 -3.271 1
1 498 . 13 1 1 A 42 42 ARG H H 42 8.179 8.351 -0.172 1
1 499 . 13 1 1 A 42 42 ARG HA H 42 3.708 3.904 -0.196 1
1 506 . 13 1 1 A 42 42 ARG C C 42 177.570 178.484 -0.914 1
1 507 . 13 1 1 A 42 42 ARG CA C 42 60.349 59.942 0.407 1
1 508 . 13 1 1 A 42 42 ARG CB C 42 30.047 29.655 0.392 1
1 511 . 13 1 1 A 42 42 ARG N N 42 120.574 120.198 0.376 1
1 512 . 13 1 1 A 43 43 LEU H H 43 6.982 7.852 -0.870 1
1 513 . 13 1 1 A 43 43 LEU HA H 43 3.939 3.801 0.138 1
1 523 . 13 1 1 A 43 43 LEU C C 43 180.397 178.576 1.821 1
1 524 . 13 1 1 A 43 43 LEU CA C 43 58.119 57.751 0.368 1
1 525 . 13 1 1 A 43 43 LEU CB C 43 41.294 41.525 -0.231 1
1 529 . 13 1 1 A 43 43 LEU N N 43 117.189 118.455 -1.266 1
1 530 . 13 1 1 A 44 44 TYR H H 44 7.026 7.648 -0.622 1
1 531 . 13 1 1 A 44 44 TYR HA H 44 4.253 4.259 -0.006 1
1 538 . 13 1 1 A 44 44 TYR C C 44 178.411 178.246 0.165 1
1 539 . 13 1 1 A 44 44 TYR CA C 44 60.941 60.695 0.246 1
1 540 . 13 1 1 A 44 44 TYR CB C 44 38.889 38.116 0.773 1
1 545 . 13 1 1 A 44 44 TYR N N 44 117.020 118.108 -1.088 1
1 546 . 13 1 1 A 45 45 LEU H H 45 8.429 8.600 -0.171 1
1 547 . 13 1 1 A 45 45 LEU HA H 45 3.486 3.563 -0.077 1
1 557 . 13 1 1 A 45 45 LEU C C 45 178.648 178.609 0.039 1
1 558 . 13 1 1 A 45 45 LEU CA C 45 57.915 57.596 0.319 1
1 559 . 13 1 1 A 45 45 LEU CB C 45 39.073 40.701 -1.628 1
1 563 . 13 1 1 A 45 45 LEU N N 45 119.649 120.168 -0.519 1
1 564 . 13 1 1 A 46 46 GLU H H 46 8.309 8.338 -0.029 1
1 565 . 13 1 1 A 46 46 GLU HA H 46 4.286 3.885 0.401 1
1 570 . 13 1 1 A 46 46 GLU C C 46 179.577 178.597 0.980 1
1 571 . 13 1 1 A 46 46 GLU CA C 46 59.570 59.778 -0.208 1
1 572 . 13 1 1 A 46 46 GLU CB C 46 29.034 29.097 -0.063 1
1 574 . 13 1 1 A 46 46 GLU N N 46 117.366 120.419 -3.053 1
1 575 . 13 1 1 A 47 47 GLN H H 47 7.493 7.813 -0.320 1
1 576 . 13 1 1 A 47 47 GLN HA H 47 4.243 4.049 0.194 1
1 583 . 13 1 1 A 47 47 GLN C C 47 178.870 178.398 0.472 1
1 584 . 13 1 1 A 47 47 GLN CA C 47 59.581 58.520 1.061 1
1 585 . 13 1 1 A 47 47 GLN CB C 47 28.300 27.907 0.393 1
1 588 . 13 1 1 A 47 47 GLN N N 47 119.345 117.685 1.660 1
1 590 . 13 1 1 A 48 48 LEU H H 48 8.160 8.348 -0.188 1
1 591 . 13 1 1 A 48 48 LEU HA H 48 4.211 3.971 0.240 1
1 601 . 13 1 1 A 48 48 LEU C C 48 180.111 179.210 0.901 1
1 602 . 13 1 1 A 48 48 LEU CA C 48 57.179 57.768 -0.589 1
1 603 . 13 1 1 A 48 48 LEU CB C 48 42.067 41.439 0.628 1
1 607 . 13 1 1 A 48 48 LEU N N 48 118.594 121.540 -2.946 1
1 608 . 13 1 1 A 49 49 HIS H H 49 8.864 8.111 0.753 1
1 609 . 13 1 1 A 49 49 HIS HA H 49 5.162 4.660 0.502 1
1 613 . 13 1 1 A 49 49 HIS C C 49 178.801 176.509 2.292 1
1 614 . 13 1 1 A 49 49 HIS CA C 49 58.397 60.093 -1.696 1
1 615 . 13 1 1 A 49 49 HIS CB C 49 29.631 30.159 -0.528 1
1 617 . 13 1 1 A 49 49 HIS N N 49 122.537 118.293 4.244 1
1 618 . 13 1 1 A 50 50 ASP H H 50 8.683 8.287 0.396 1
1 619 . 13 1 1 A 50 50 ASP HA H 50 4.356 3.961 0.395 1
1 622 . 13 1 1 A 50 50 ASP C C 50 178.474 177.958 0.516 1
1 623 . 13 1 1 A 50 50 ASP CA C 50 57.744 57.283 0.461 1
1 624 . 13 1 1 A 50 50 ASP CB C 50 40.575 41.000 -0.425 1
1 625 . 13 1 1 A 50 50 ASP N N 50 123.169 118.486 4.683 1
1 626 . 13 1 1 A 51 51 VAL H H 51 7.606 7.604 0.002 1
1 627 . 13 1 1 A 51 51 VAL HA H 51 4.514 4.004 0.510 1
1 635 . 13 1 1 A 51 51 VAL C C 51 176.862 176.643 0.219 1
1 636 . 13 1 1 A 51 51 VAL CA C 51 61.590 63.494 -1.904 1
1 637 . 13 1 1 A 51 51 VAL CB C 51 31.423 32.816 -1.393 1
1 640 . 13 1 1 A 51 51 VAL N N 51 109.266 111.786 -2.520 1
1 641 . 13 1 1 A 52 52 GLY H H 52 7.696 7.813 -0.117 1
1 642 . 13 1 1 A 52 52 GLY HA2 H 52 4.172 4.018 0.154 1
1 643 . 13 1 1 A 52 52 GLY HA3 H 52 3.938 4.019 -0.081 1
1 644 . 13 1 1 A 52 52 GLY C C 52 174.276 174.995 -0.719 1
1 645 . 13 1 1 A 52 52 GLY CA C 52 46.228 45.398 0.830 1
1 646 . 13 1 1 A 52 52 GLY N N 52 108.681 110.398 -1.717 1
1 647 . 13 1 1 A 53 53 VAL H H 53 8.046 8.180 -0.134 1
1 648 . 13 1 1 A 53 53 VAL HA H 53 4.079 4.033 0.046 1
1 656 . 13 1 1 A 53 53 VAL C C 53 175.949 175.648 0.301 1
1 657 . 13 1 1 A 53 53 VAL CA C 53 64.063 64.170 -0.107 1
1 658 . 13 1 1 A 53 53 VAL CB C 53 33.160 32.645 0.515 1
1 661 . 13 1 1 A 53 53 VAL N N 53 117.892 117.233 0.659 1
1 662 . 13 1 1 A 54 54 LEU H H 54 6.835 7.466 -0.631 1
1 663 . 13 1 1 A 54 54 LEU HA H 54 5.348 5.156 0.192 1
1 673 . 13 1 1 A 54 54 LEU C C 54 175.713 176.049 -0.336 1
1 674 . 13 1 1 A 54 54 LEU CA C 54 52.194 53.021 -0.827 1
1 675 . 13 1 1 A 54 54 LEU CB C 54 46.733 43.850 2.883 1
1 679 . 13 1 1 A 54 54 LEU N N 54 114.848 117.826 -2.978 1
1 680 . 13 1 1 A 55 55 GLU H H 55 9.549 9.049 0.500 1
1 681 . 13 1 1 A 55 55 GLU HA H 55 4.826 4.888 -0.062 1
1 686 . 13 1 1 A 55 55 GLU C C 55 174.661 176.681 -2.020 1
1 687 . 13 1 1 A 55 55 GLU CA C 55 54.637 55.895 -1.258 1
1 688 . 13 1 1 A 55 55 GLU CB C 55 32.891 31.047 1.844 1
1 690 . 13 1 1 A 55 55 GLU N N 55 121.431 123.873 -2.442 1
1 691 . 13 1 1 A 56 56 LYS H H 56 8.513 8.390 0.123 1
1 692 . 13 1 1 A 56 56 LYS HA H 56 4.151 4.247 -0.096 1
1 701 . 13 1 1 A 56 56 LYS C C 56 176.270 175.474 0.796 1
1 702 . 13 1 1 A 56 56 LYS CA C 56 54.890 55.716 -0.826 1
1 703 . 13 1 1 A 56 56 LYS CB C 56 33.162 32.685 0.477 1
1 707 . 13 1 1 A 56 56 LYS N N 56 126.539 122.121 4.418 1
1 708 . 13 1 1 A 57 57 VAL H H 57 8.279 8.382 -0.103 1
1 709 . 13 1 1 A 57 57 VAL HA H 57 3.820 4.332 -0.512 1
1 717 . 13 1 1 A 57 57 VAL C C 57 175.108 175.967 -0.859 1
1 718 . 13 1 1 A 57 57 VAL CA C 57 62.834 61.034 1.800 1
1 719 . 13 1 1 A 57 57 VAL CB C 57 32.549 33.799 -1.250 1
1 722 . 13 1 1 A 57 57 VAL N N 57 126.540 121.884 4.656 1
1 723 . 13 1 1 A 58 58 ASN H H 58 8.383 8.924 -0.541 1
1 724 . 13 1 1 A 58 58 ASN HA H 58 4.612 4.238 0.374 1
1 729 . 13 1 1 A 58 58 ASN C C 58 174.772 173.756 1.016 1
1 730 . 13 1 1 A 58 58 ASN CA C 58 52.575 53.806 -1.231 1
1 731 . 13 1 1 A 58 58 ASN CB C 58 38.502 36.844 1.658 1
1 733 . 13 1 1 A 58 58 ASN N N 58 121.767 124.339 -2.572 1
1 735 . 13 1 1 A 59 59 ALA H H 59 8.165 7.778 0.387 1
1 736 . 13 1 1 A 59 59 ALA HA H 59 4.251 4.912 -0.661 1
1 740 . 13 1 1 A 59 59 ALA C C 59 177.478 175.802 1.676 1
1 741 . 13 1 1 A 59 59 ALA CA C 59 52.490 50.998 1.492 1
1 742 . 13 1 1 A 59 59 ALA CB C 59 19.724 22.469 -2.745 1
1 743 . 13 1 1 A 59 59 ALA N N 59 125.082 122.976 2.106 1
1 744 . 13 1 1 A 60 60 GLY H H 60 8.291 8.110 0.181 1
1 745 . 13 1 1 A 60 60 GLY HA2 H 60 4.165 4.178 -0.013 1
1 746 . 13 1 1 A 60 60 GLY HA3 H 60 3.853 4.191 -0.338 1
1 747 . 13 1 1 A 60 60 GLY C C 60 174.171 172.557 1.614 1
1 748 . 13 1 1 A 60 60 GLY CA C 60 44.994 44.902 0.092 1
1 749 . 13 1 1 A 60 60 GLY N N 60 108.518 105.549 2.969 1
1 750 . 13 1 1 A 61 61 LYS H H 61 8.189 8.383 -0.194 1
1 751 . 13 1 1 A 61 61 LYS HA H 61 4.320 4.221 0.099 1
1 760 . 13 1 1 A 61 61 LYS C C 61 177.712 177.132 0.580 1
1 761 . 13 1 1 A 61 61 LYS CA C 61 56.832 57.246 -0.414 1
1 762 . 13 1 1 A 61 61 LYS CB C 61 32.641 31.647 0.994 1
1 766 . 13 1 1 A 61 61 LYS N N 61 120.532 124.873 -4.341 1
1 767 . 13 1 1 A 62 62 GLY H H 62 8.767 8.978 -0.211 1
1 768 . 13 1 1 A 62 62 GLY HA2 H 62 4.021 3.907 0.114 1
1 769 . 13 1 1 A 62 62 GLY HA3 H 62 3.849 3.918 -0.069 1
1 770 . 13 1 1 A 62 62 GLY C C 62 173.782 174.238 -0.456 1
1 771 . 13 1 1 A 62 62 GLY CA C 62 45.844 47.117 -1.273 1
1 772 . 13 1 1 A 62 62 GLY N N 62 111.547 113.528 -1.981 1
1 773 . 13 1 1 A 63 63 VAL H H 63 7.379 7.776 -0.397 1
1 774 . 13 1 1 A 63 63 VAL HA H 63 4.591 4.665 -0.074 1
1 782 . 13 1 1 A 63 63 VAL C C 63 174.262 175.621 -1.359 1
1 783 . 13 1 1 A 63 63 VAL CA C 63 59.292 58.917 0.375 1
1 784 . 13 1 1 A 63 63 VAL CB C 63 32.726 33.197 -0.471 1
1 787 . 13 1 1 A 63 63 VAL N N 63 117.546 114.766 2.780 1
1 788 . 13 1 1 A 64 64 PRO HA H 64 4.458 4.441 0.017 1
1 795 . 13 1 1 A 64 64 PRO C C 64 177.166 177.351 -0.185 1
1 796 . 13 1 1 A 64 64 PRO CA C 64 63.661 64.046 -0.385 1
1 797 . 13 1 1 A 64 64 PRO CB C 64 32.321 31.990 0.331 1
1 800 . 13 1 1 A 65 65 GLY H H 65 8.463 7.919 0.544 1
1 801 . 13 1 1 A 65 65 GLY HA2 H 65 3.882 3.643 0.239 1
1 802 . 13 1 1 A 65 65 GLY HA3 H 65 3.602 3.920 -0.318 1
1 803 . 13 1 1 A 65 65 GLY C C 65 172.406 174.087 -1.681 1
1 804 . 13 1 1 A 65 65 GLY CA C 65 45.933 46.306 -0.373 1
1 805 . 13 1 1 A 65 65 GLY N N 65 109.819 109.097 0.722 1
1 806 . 13 1 1 A 66 66 LEU H H 66 7.534 7.912 -0.378 1
1 807 . 13 1 1 A 66 66 LEU HA H 66 4.940 4.875 0.065 1
1 817 . 13 1 1 A 66 66 LEU C C 66 176.237 175.961 0.276 1
1 818 . 13 1 1 A 66 66 LEU CA C 66 53.687 53.379 0.308 1
1 819 . 13 1 1 A 66 66 LEU CB C 66 46.108 42.766 3.342 1
1 823 . 13 1 1 A 66 66 LEU N N 66 122.249 122.113 0.136 1
1 824 . 13 1 1 A 67 67 TRP H H 67 8.916 9.483 -0.567 1
1 825 . 13 1 1 A 67 67 TRP HA H 67 5.526 5.352 0.174 1
1 834 . 13 1 1 A 67 67 TRP C C 67 175.670 175.396 0.274 1
1 835 . 13 1 1 A 67 67 TRP CA C 67 56.241 55.411 0.830 1
1 836 . 13 1 1 A 67 67 TRP CB C 67 33.314 33.768 -0.454 1
1 842 . 13 1 1 A 67 67 TRP N N 67 121.160 124.369 -3.209 1
1 844 . 13 1 1 A 68 68 ARG H H 68 8.772 8.886 -0.114 1
1 845 . 13 1 1 A 68 68 ARG HA H 68 4.832 5.107 -0.275 1
1 853 . 13 1 1 A 68 68 ARG C C 68 174.720 175.221 -0.501 1
1 854 . 13 1 1 A 68 68 ARG CA C 68 54.690 53.979 0.711 1
1 855 . 13 1 1 A 68 68 ARG CB C 68 35.176 34.181 0.995 1
1 858 . 13 1 1 A 68 68 ARG N N 68 117.471 120.096 -2.625 1
1 860 . 13 1 1 A 69 69 LEU H H 69 9.355 8.341 1.014 1
1 861 . 13 1 1 A 69 69 LEU HA H 69 4.557 4.985 -0.428 1
1 871 . 13 1 1 A 69 69 LEU C C 69 177.180 176.080 1.100 1
1 872 . 13 1 1 A 69 69 LEU CA C 69 55.780 52.588 3.192 1
1 873 . 13 1 1 A 69 69 LEU CB C 69 42.736 44.875 -2.139 1
1 877 . 13 1 1 A 69 69 LEU N N 69 125.211 117.009 8.202 1
1 878 . 13 1 1 A 70 70 LEU H H 70 8.058 8.622 -0.564 1
1 879 . 13 1 1 A 70 70 LEU HA H 70 4.364 4.510 -0.146 1
1 889 . 13 1 1 A 70 70 LEU C C 70 176.808 175.657 1.151 1
1 890 . 13 1 1 A 70 70 LEU CA C 70 55.257 54.594 0.663 1
1 891 . 13 1 1 A 70 70 LEU CB C 70 42.413 40.058 2.355 1
1 895 . 13 1 1 A 70 70 LEU N N 70 125.525 120.941 4.584 1
1 1 . 14 1 1 A 2 2 SER HA H 2 4.126 4.672 -0.546 1
1 4 . 14 1 1 A 2 2 SER CA C 2 57.564 58.119 -0.555 1
1 5 . 14 1 1 A 2 2 SER CB C 2 63.953 63.318 0.635 1
1 6 . 14 1 1 A 3 3 GLU HA H 3 4.408 4.912 -0.504 1
1 11 . 14 1 1 A 3 3 GLU C C 3 176.658 175.768 0.890 1
1 12 . 14 1 1 A 3 3 GLU CA C 3 56.802 55.387 1.415 1
1 13 . 14 1 1 A 3 3 GLU CB C 3 30.674 30.505 0.169 1
1 15 . 14 1 1 A 4 4 SER H H 4 8.650 8.443 0.207 1
1 16 . 14 1 1 A 4 4 SER HA H 4 4.463 4.851 -0.388 1
1 19 . 14 1 1 A 4 4 SER C C 4 175.949 174.229 1.720 1
1 20 . 14 1 1 A 4 4 SER CA C 4 58.557 57.640 0.917 1
1 21 . 14 1 1 A 4 4 SER CB C 4 63.834 65.433 -1.599 1
1 22 . 14 1 1 A 4 4 SER N N 4 118.042 118.796 -0.754 1
1 23 . 14 1 1 A 5 5 ILE H H 5 8.404 8.865 -0.461 1
1 24 . 14 1 1 A 5 5 ILE HA H 5 3.902 3.849 0.053 1
1 34 . 14 1 1 A 5 5 ILE C C 5 176.608 177.715 -1.107 1
1 35 . 14 1 1 A 5 5 ILE CA C 5 62.662 63.985 -1.323 1
1 36 . 14 1 1 A 5 5 ILE CB C 5 37.622 37.361 0.261 1
1 40 . 14 1 1 A 5 5 ILE N N 5 124.711 127.442 -2.731 1
1 41 . 14 1 1 A 6 6 VAL H H 6 7.602 8.117 -0.515 1
1 42 . 14 1 1 A 6 6 VAL HA H 6 3.293 3.722 -0.429 1
1 50 . 14 1 1 A 6 6 VAL C C 6 177.088 178.211 -1.123 1
1 51 . 14 1 1 A 6 6 VAL CA C 6 67.180 66.872 0.308 1
1 52 . 14 1 1 A 6 6 VAL CB C 6 31.517 31.756 -0.239 1
1 55 . 14 1 1 A 6 6 VAL N N 6 119.974 120.618 -0.644 1
1 56 . 14 1 1 A 7 7 THR H H 7 7.515 8.282 -0.767 1
1 57 . 14 1 1 A 7 7 THR HA H 7 3.823 3.901 -0.078 1
1 62 . 14 1 1 A 7 7 THR C C 7 176.978 176.230 0.748 1
1 63 . 14 1 1 A 7 7 THR CA C 7 66.257 67.060 -0.803 1
1 64 . 14 1 1 A 7 7 THR CB C 7 68.410 68.263 0.147 1
1 66 . 14 1 1 A 7 7 THR N N 7 114.177 116.511 -2.334 1
1 67 . 14 1 1 A 8 8 LYS H H 8 7.807 7.775 0.032 1
1 68 . 14 1 1 A 8 8 LYS HA H 8 4.066 4.003 0.063 1
1 77 . 14 1 1 A 8 8 LYS C C 8 178.733 178.383 0.350 1
1 78 . 14 1 1 A 8 8 LYS CA C 8 59.338 59.715 -0.377 1
1 79 . 14 1 1 A 8 8 LYS CB C 8 32.002 31.981 0.021 1
1 83 . 14 1 1 A 8 8 LYS N N 8 123.387 120.437 2.950 1
1 84 . 14 1 1 A 9 9 ILE H H 9 8.288 8.094 0.194 1
1 85 . 14 1 1 A 9 9 ILE HA H 9 3.421 3.584 -0.163 1
1 95 . 14 1 1 A 9 9 ILE C C 9 177.187 178.242 -1.055 1
1 96 . 14 1 1 A 9 9 ILE CA C 9 65.772 65.750 0.022 1
1 97 . 14 1 1 A 9 9 ILE CB C 9 37.183 37.962 -0.779 1
1 101 . 14 1 1 A 9 9 ILE N N 9 119.543 119.024 0.519 1
1 102 . 14 1 1 A 10 10 ILE H H 10 8.073 8.107 -0.034 1
1 103 . 14 1 1 A 10 10 ILE HA H 10 3.305 3.584 -0.279 1
1 113 . 14 1 1 A 10 10 ILE C C 10 177.308 178.169 -0.861 1
1 114 . 14 1 1 A 10 10 ILE CA C 10 66.704 65.191 1.513 1
1 115 . 14 1 1 A 10 10 ILE CB C 10 37.840 37.737 0.103 1
1 119 . 14 1 1 A 10 10 ILE N N 10 119.219 120.281 -1.062 1
1 120 . 14 1 1 A 11 11 SER H H 11 7.861 8.110 -0.249 1
1 121 . 14 1 1 A 11 11 SER HA H 11 4.250 4.070 0.180 1
1 124 . 14 1 1 A 11 11 SER C C 11 176.918 175.958 0.960 1
1 125 . 14 1 1 A 11 11 SER CA C 11 61.911 62.405 -0.494 1
1 126 . 14 1 1 A 11 11 SER CB C 11 62.998 63.165 -0.167 1
1 127 . 14 1 1 A 11 11 SER N N 11 113.959 115.649 -1.690 1
1 128 . 14 1 1 A 12 12 ILE H H 12 8.250 7.951 0.299 1
1 129 . 14 1 1 A 12 12 ILE HA H 12 3.801 3.637 0.164 1
1 139 . 14 1 1 A 12 12 ILE C C 12 178.130 178.091 0.039 1
1 140 . 14 1 1 A 12 12 ILE CA C 12 65.023 65.171 -0.148 1
1 141 . 14 1 1 A 12 12 ILE CB C 12 38.195 37.948 0.247 1
1 145 . 14 1 1 A 12 12 ILE N N 12 123.767 121.309 2.458 1
1 146 . 14 1 1 A 13 13 VAL H H 13 8.308 8.122 0.186 1
1 147 . 14 1 1 A 13 13 VAL HA H 13 3.435 3.481 -0.046 1
1 155 . 14 1 1 A 13 13 VAL C C 13 177.283 177.922 -0.639 1
1 156 . 14 1 1 A 13 13 VAL CA C 13 67.693 66.891 0.802 1
1 157 . 14 1 1 A 13 13 VAL CB C 13 31.139 31.549 -0.410 1
1 160 . 14 1 1 A 13 13 VAL N N 13 120.066 120.200 -0.134 1
1 161 . 14 1 1 A 14 14 GLN H H 14 8.612 8.172 0.440 1
1 162 . 14 1 1 A 14 14 GLN HA H 14 3.831 4.044 -0.213 1
1 169 . 14 1 1 A 14 14 GLN C C 14 178.256 178.550 -0.294 1
1 170 . 14 1 1 A 14 14 GLN CA C 14 59.660 59.336 0.324 1
1 171 . 14 1 1 A 14 14 GLN CB C 14 29.456 28.080 1.376 1
1 174 . 14 1 1 A 14 14 GLN N N 14 118.099 119.652 -1.553 1
1 176 . 14 1 1 A 15 15 GLU H H 15 8.378 8.368 0.010 1
1 177 . 14 1 1 A 15 15 GLU HA H 15 4.110 4.086 0.024 1
1 182 . 14 1 1 A 15 15 GLU C C 15 179.659 179.022 0.637 1
1 183 . 14 1 1 A 15 15 GLU CA C 15 59.476 59.333 0.143 1
1 184 . 14 1 1 A 15 15 GLU CB C 15 29.725 29.229 0.496 1
1 186 . 14 1 1 A 15 15 GLU N N 15 118.580 119.034 -0.454 1
1 187 . 14 1 1 A 16 16 ARG H H 16 8.439 7.976 0.463 1
1 188 . 14 1 1 A 16 16 ARG HA H 16 4.157 4.133 0.024 1
1 196 . 14 1 1 A 16 16 ARG C C 16 179.276 179.038 0.238 1
1 197 . 14 1 1 A 16 16 ARG CA C 16 58.141 59.803 -1.662 1
1 198 . 14 1 1 A 16 16 ARG CB C 16 29.434 29.928 -0.494 1
1 201 . 14 1 1 A 16 16 ARG N N 16 118.688 118.974 -0.286 1
1 203 . 14 1 1 A 17 17 GLN H H 17 8.861 7.823 1.038 1
1 204 . 14 1 1 A 17 17 GLN HA H 17 4.236 4.236 0.000 1
1 211 . 14 1 1 A 17 17 GLN C C 17 178.736 178.016 0.720 1
1 212 . 14 1 1 A 17 17 GLN CA C 17 59.683 58.431 1.252 1
1 213 . 14 1 1 A 17 17 GLN CB C 17 29.960 28.135 1.825 1
1 216 . 14 1 1 A 17 17 GLN N N 17 120.427 118.354 2.073 1
1 218 . 14 1 1 A 18 18 ASN H H 18 8.017 8.000 0.017 1
1 219 . 14 1 1 A 18 18 ASN HA H 18 4.605 4.612 -0.007 1
1 224 . 14 1 1 A 18 18 ASN C C 18 177.906 177.380 0.526 1
1 225 . 14 1 1 A 18 18 ASN CA C 18 55.375 55.476 -0.101 1
1 226 . 14 1 1 A 18 18 ASN CB C 18 38.383 38.210 0.173 1
1 228 . 14 1 1 A 18 18 ASN N N 18 117.033 117.555 -0.522 1
1 230 . 14 1 1 A 19 19 MET H H 19 7.994 7.830 0.164 1
1 231 . 14 1 1 A 19 19 MET HA H 19 4.372 4.511 -0.139 1
1 236 . 14 1 1 A 19 19 MET C C 19 176.518 176.115 0.403 1
1 237 . 14 1 1 A 19 19 MET CA C 19 57.623 57.311 0.312 1
1 238 . 14 1 1 A 19 19 MET CB C 19 33.248 33.792 -0.544 1
1 240 . 14 1 1 A 19 19 MET N N 19 119.320 115.890 3.430 1
1 241 . 14 1 1 A 20 20 ASP H H 20 7.800 7.763 0.037 1
1 242 . 14 1 1 A 20 20 ASP HA H 20 4.990 4.956 0.034 1
1 245 . 14 1 1 A 20 20 ASP C C 20 176.082 175.520 0.562 1
1 246 . 14 1 1 A 20 20 ASP CA C 20 53.796 53.471 0.325 1
1 247 . 14 1 1 A 20 20 ASP CB C 20 40.409 43.424 -3.015 1
1 248 . 14 1 1 A 20 20 ASP N N 20 119.127 117.326 1.801 1
1 249 . 14 1 1 A 21 21 ASP H H 21 8.136 8.596 -0.460 1
1 250 . 14 1 1 A 21 21 ASP HA H 21 4.497 4.432 0.065 1
1 253 . 14 1 1 A 21 21 ASP C C 21 176.264 176.596 -0.332 1
1 254 . 14 1 1 A 21 21 ASP CA C 21 55.508 56.475 -0.967 1
1 255 . 14 1 1 A 21 21 ASP CB C 21 40.063 40.455 -0.392 1
1 256 . 14 1 1 A 21 21 ASP N N 21 118.276 123.805 -5.529 1
1 257 . 14 1 1 A 22 22 GLY H H 22 8.728 7.647 1.081 1
1 258 . 14 1 1 A 22 22 GLY HA2 H 22 4.189 4.138 0.051 1
1 259 . 14 1 1 A 22 22 GLY HA3 H 22 3.683 4.142 -0.459 1
1 260 . 14 1 1 A 22 22 GLY C C 22 174.304 173.093 1.211 1
1 261 . 14 1 1 A 22 22 GLY CA C 22 45.629 45.674 -0.045 1
1 262 . 14 1 1 A 22 22 GLY N N 22 105.878 105.696 0.182 1
1 263 . 14 1 1 A 23 23 ALA H H 23 7.473 7.912 -0.439 1
1 264 . 14 1 1 A 23 23 ALA HA H 23 4.519 4.516 0.003 1
1 268 . 14 1 1 A 23 23 ALA C C 23 174.065 176.264 -2.199 1
1 269 . 14 1 1 A 23 23 ALA CA C 23 51.142 49.743 1.399 1
1 270 . 14 1 1 A 23 23 ALA CB C 23 18.283 19.686 -1.403 1
1 271 . 14 1 1 A 23 23 ALA N N 23 125.323 123.722 1.601 1
1 272 . 14 1 1 A 24 24 PRO HA H 24 4.590 4.855 -0.265 1
1 279 . 14 1 1 A 24 24 PRO C C 24 175.253 176.481 -1.228 1
1 280 . 14 1 1 A 24 24 PRO CA C 24 62.186 62.266 -0.080 1
1 281 . 14 1 1 A 24 24 PRO CB C 24 32.931 31.767 1.164 1
1 284 . 14 1 1 A 25 25 VAL H H 25 9.334 8.545 0.789 1
1 285 . 14 1 1 A 25 25 VAL HA H 25 4.378 4.227 0.151 1
1 293 . 14 1 1 A 25 25 VAL C C 25 176.439 175.750 0.689 1
1 294 . 14 1 1 A 25 25 VAL CA C 25 61.482 62.720 -1.238 1
1 295 . 14 1 1 A 25 25 VAL CB C 25 34.781 32.483 2.298 1
1 298 . 14 1 1 A 25 25 VAL N N 25 120.408 123.585 -3.177 1
1 299 . 14 1 1 A 26 26 LYS H H 26 9.300 9.039 0.261 1
1 300 . 14 1 1 A 26 26 LYS HA H 26 4.982 4.649 0.333 1
1 309 . 14 1 1 A 26 26 LYS C C 26 179.008 177.917 1.091 1
1 310 . 14 1 1 A 26 26 LYS CA C 26 56.908 55.262 1.646 1
1 311 . 14 1 1 A 26 26 LYS CB C 26 34.071 34.045 0.026 1
1 315 . 14 1 1 A 26 26 LYS N N 26 126.177 125.452 0.725 1
1 316 . 14 1 1 A 27 27 THR H H 27 8.618 8.944 -0.326 1
1 317 . 14 1 1 A 27 27 THR HA H 27 3.662 3.869 -0.207 1
1 322 . 14 1 1 A 27 27 THR C C 27 176.442 176.078 0.364 1
1 323 . 14 1 1 A 27 27 THR CA C 27 67.591 66.433 1.158 1
1 324 . 14 1 1 A 27 27 THR CB C 27 68.868 68.775 0.093 1
1 326 . 14 1 1 A 27 27 THR N N 27 119.020 117.584 1.436 1
1 327 . 14 1 1 A 28 28 ARG H H 28 9.288 8.202 1.086 1
1 328 . 14 1 1 A 28 28 ARG HA H 28 3.879 4.042 -0.163 1
1 335 . 14 1 1 A 28 28 ARG C C 28 176.884 178.244 -1.360 1
1 336 . 14 1 1 A 28 28 ARG CA C 28 59.431 59.465 -0.034 1
1 337 . 14 1 1 A 28 28 ARG CB C 28 29.953 30.228 -0.275 1
1 340 . 14 1 1 A 28 28 ARG N N 28 119.100 121.006 -1.906 1
1 341 . 14 1 1 A 29 29 ASP H H 29 6.907 8.158 -1.251 1
1 342 . 14 1 1 A 29 29 ASP HA H 29 4.550 4.311 0.239 1
1 345 . 14 1 1 A 29 29 ASP C C 29 179.050 178.767 0.283 1
1 346 . 14 1 1 A 29 29 ASP CA C 29 57.262 57.559 -0.297 1
1 347 . 14 1 1 A 29 29 ASP CB C 29 40.191 41.850 -1.659 1
1 348 . 14 1 1 A 29 29 ASP N N 29 117.490 119.313 -1.823 1
1 349 . 14 1 1 A 30 30 ILE H H 30 7.554 8.098 -0.544 1
1 350 . 14 1 1 A 30 30 ILE HA H 30 3.595 3.741 -0.146 1
1 360 . 14 1 1 A 30 30 ILE C C 30 176.907 177.800 -0.893 1
1 361 . 14 1 1 A 30 30 ILE CA C 30 65.002 65.803 -0.801 1
1 362 . 14 1 1 A 30 30 ILE CB C 30 37.999 38.002 -0.003 1
1 366 . 14 1 1 A 30 30 ILE N N 30 120.978 118.858 2.120 1
1 367 . 14 1 1 A 31 31 ALA H H 31 8.269 8.332 -0.063 1
1 368 . 14 1 1 A 31 31 ALA HA H 31 3.720 3.927 -0.207 1
1 372 . 14 1 1 A 31 31 ALA C C 31 179.170 179.486 -0.316 1
1 373 . 14 1 1 A 31 31 ALA CA C 31 56.354 55.815 0.539 1
1 374 . 14 1 1 A 31 31 ALA CB C 31 17.843 18.042 -0.199 1
1 375 . 14 1 1 A 31 31 ALA N N 31 121.171 123.318 -2.147 1
1 376 . 14 1 1 A 32 32 ASP H H 32 8.293 8.512 -0.219 1
1 377 . 14 1 1 A 32 32 ASP HA H 32 4.422 4.378 0.044 1
1 380 . 14 1 1 A 32 32 ASP C C 32 179.136 178.481 0.655 1
1 381 . 14 1 1 A 32 32 ASP CA C 32 57.109 57.147 -0.038 1
1 382 . 14 1 1 A 32 32 ASP CB C 32 40.523 40.648 -0.125 1
1 383 . 14 1 1 A 32 32 ASP N N 32 116.467 119.278 -2.811 1
1 384 . 14 1 1 A 33 33 ALA H H 33 7.536 8.152 -0.616 1
1 385 . 14 1 1 A 33 33 ALA HA H 33 4.222 4.060 0.162 1
1 389 . 14 1 1 A 33 33 ALA C C 33 179.056 180.139 -1.083 1
1 390 . 14 1 1 A 33 33 ALA CA C 33 54.469 54.708 -0.239 1
1 391 . 14 1 1 A 33 33 ALA CB C 33 19.085 18.183 0.902 1
1 392 . 14 1 1 A 33 33 ALA N N 33 120.859 122.553 -1.694 1
1 393 . 14 1 1 A 34 34 ALA H H 34 8.296 7.910 0.386 1
1 394 . 14 1 1 A 34 34 ALA HA H 34 4.101 4.211 -0.110 1
1 398 . 14 1 1 A 34 34 ALA C C 34 176.912 177.916 -1.004 1
1 399 . 14 1 1 A 34 34 ALA CA C 34 52.380 52.807 -0.427 1
1 400 . 14 1 1 A 34 34 ALA CB C 34 18.817 19.674 -0.857 1
1 401 . 14 1 1 A 34 34 ALA N N 34 118.203 117.569 0.634 1
1 402 . 14 1 1 A 35 35 GLY H H 35 7.911 8.535 -0.624 1
1 403 . 14 1 1 A 35 35 GLY HA2 H 35 3.968 3.894 0.074 1
1 404 . 14 1 1 A 35 35 GLY HA3 H 35 3.968 3.895 0.073 1
1 405 . 14 1 1 A 35 35 GLY C C 35 174.374 173.877 0.497 1
1 406 . 14 1 1 A 35 35 GLY CA C 35 46.388 46.005 0.383 1
1 407 . 14 1 1 A 35 35 GLY N N 35 107.752 107.774 -0.022 1
1 408 . 14 1 1 A 36 36 LEU H H 36 7.758 7.504 0.254 1
1 409 . 14 1 1 A 36 36 LEU HA H 36 4.887 4.793 0.094 1
1 419 . 14 1 1 A 36 36 LEU C C 36 175.941 175.469 0.472 1
1 420 . 14 1 1 A 36 36 LEU CA C 36 52.443 52.663 -0.220 1
1 421 . 14 1 1 A 36 36 LEU CB C 36 47.885 44.752 3.133 1
1 425 . 14 1 1 A 36 36 LEU N N 36 118.719 120.382 -1.663 1
1 426 . 14 1 1 A 37 37 SER H H 37 8.603 8.311 0.292 1
1 427 . 14 1 1 A 37 37 SER HA H 37 4.565 4.507 0.058 1
1 430 . 14 1 1 A 37 37 SER C C 37 175.512 175.606 -0.094 1
1 431 . 14 1 1 A 37 37 SER CA C 37 57.262 58.695 -1.433 1
1 432 . 14 1 1 A 37 37 SER CB C 37 65.155 63.747 1.408 1
1 433 . 14 1 1 A 37 37 SER N N 37 115.095 116.295 -1.200 1
1 434 . 14 1 1 A 38 38 ILE H H 38 8.822 8.813 0.009 1
1 435 . 14 1 1 A 38 38 ILE HA H 38 3.650 3.713 -0.063 1
1 445 . 14 1 1 A 38 38 ILE C C 38 176.849 177.360 -0.511 1
1 446 . 14 1 1 A 38 38 ILE CA C 38 64.557 65.226 -0.669 1
1 447 . 14 1 1 A 38 38 ILE CB C 38 37.451 38.098 -0.647 1
1 451 . 14 1 1 A 38 38 ILE N N 38 122.026 124.778 -2.752 1
1 452 . 14 1 1 A 39 39 TYR H H 39 7.839 8.622 -0.783 1
1 453 . 14 1 1 A 39 39 TYR HA H 39 4.112 4.087 0.025 1
1 460 . 14 1 1 A 39 39 TYR C C 39 177.703 177.624 0.079 1
1 461 . 14 1 1 A 39 39 TYR CA C 39 60.856 60.917 -0.061 1
1 462 . 14 1 1 A 39 39 TYR CB C 39 38.402 38.578 -0.176 1
1 467 . 14 1 1 A 39 39 TYR N N 39 118.759 120.716 -1.957 1
1 468 . 14 1 1 A 40 40 GLN H H 40 7.687 8.217 -0.530 1
1 469 . 14 1 1 A 40 40 GLN HA H 40 3.865 4.010 -0.145 1
1 476 . 14 1 1 A 40 40 GLN C C 40 178.735 178.475 0.260 1
1 477 . 14 1 1 A 40 40 GLN CA C 40 58.089 58.493 -0.404 1
1 478 . 14 1 1 A 40 40 GLN CB C 40 29.950 28.370 1.580 1
1 481 . 14 1 1 A 40 40 GLN N N 40 116.772 118.544 -1.772 1
1 483 . 14 1 1 A 41 41 VAL H H 41 8.494 8.147 0.347 1
1 484 . 14 1 1 A 41 41 VAL HA H 41 3.835 3.354 0.481 1
1 492 . 14 1 1 A 41 41 VAL C C 41 176.977 177.686 -0.709 1
1 493 . 14 1 1 A 41 41 VAL CA C 41 66.102 66.756 -0.654 1
1 494 . 14 1 1 A 41 41 VAL CB C 41 31.105 31.427 -0.322 1
1 497 . 14 1 1 A 41 41 VAL N N 41 117.192 119.861 -2.669 1
1 498 . 14 1 1 A 42 42 ARG H H 42 8.179 8.065 0.114 1
1 499 . 14 1 1 A 42 42 ARG HA H 42 3.708 3.811 -0.103 1
1 506 . 14 1 1 A 42 42 ARG C C 42 177.570 178.914 -1.344 1
1 507 . 14 1 1 A 42 42 ARG CA C 42 60.349 59.707 0.642 1
1 508 . 14 1 1 A 42 42 ARG CB C 42 30.047 29.906 0.141 1
1 511 . 14 1 1 A 42 42 ARG N N 42 120.574 119.755 0.819 1
1 512 . 14 1 1 A 43 43 LEU H H 43 6.982 7.498 -0.516 1
1 513 . 14 1 1 A 43 43 LEU HA H 43 3.939 3.868 0.071 1
1 523 . 14 1 1 A 43 43 LEU C C 43 180.397 178.655 1.742 1
1 524 . 14 1 1 A 43 43 LEU CA C 43 58.119 57.970 0.149 1
1 525 . 14 1 1 A 43 43 LEU CB C 43 41.294 41.797 -0.503 1
1 529 . 14 1 1 A 43 43 LEU N N 43 117.189 119.512 -2.323 1
1 530 . 14 1 1 A 44 44 TYR H H 44 7.026 8.045 -1.019 1
1 531 . 14 1 1 A 44 44 TYR HA H 44 4.253 4.244 0.009 1
1 538 . 14 1 1 A 44 44 TYR C C 44 178.411 178.187 0.224 1
1 539 . 14 1 1 A 44 44 TYR CA C 44 60.941 60.529 0.412 1
1 540 . 14 1 1 A 44 44 TYR CB C 44 38.889 38.495 0.394 1
1 545 . 14 1 1 A 44 44 TYR N N 44 117.020 117.903 -0.883 1
1 546 . 14 1 1 A 45 45 LEU H H 45 8.429 8.652 -0.223 1
1 547 . 14 1 1 A 45 45 LEU HA H 45 3.486 3.668 -0.182 1
1 557 . 14 1 1 A 45 45 LEU C C 45 178.648 179.056 -0.408 1
1 558 . 14 1 1 A 45 45 LEU CA C 45 57.915 57.769 0.146 1
1 559 . 14 1 1 A 45 45 LEU CB C 45 39.073 40.646 -1.573 1
1 563 . 14 1 1 A 45 45 LEU N N 45 119.649 120.069 -0.420 1
1 564 . 14 1 1 A 46 46 GLU H H 46 8.309 7.979 0.330 1
1 565 . 14 1 1 A 46 46 GLU HA H 46 4.286 3.995 0.291 1
1 570 . 14 1 1 A 46 46 GLU C C 46 179.577 179.647 -0.070 1
1 571 . 14 1 1 A 46 46 GLU CA C 46 59.570 59.908 -0.338 1
1 572 . 14 1 1 A 46 46 GLU CB C 46 29.034 29.515 -0.481 1
1 574 . 14 1 1 A 46 46 GLU N N 46 117.366 117.394 -0.028 1
1 575 . 14 1 1 A 47 47 GLN H H 47 7.493 7.684 -0.191 1
1 576 . 14 1 1 A 47 47 GLN HA H 47 4.243 4.036 0.207 1
1 583 . 14 1 1 A 47 47 GLN C C 47 178.870 179.092 -0.222 1
1 584 . 14 1 1 A 47 47 GLN CA C 47 59.581 58.608 0.973 1
1 585 . 14 1 1 A 47 47 GLN CB C 47 28.300 28.197 0.103 1
1 588 . 14 1 1 A 47 47 GLN N N 47 119.345 118.792 0.553 1
1 590 . 14 1 1 A 48 48 LEU H H 48 8.160 8.238 -0.078 1
1 591 . 14 1 1 A 48 48 LEU HA H 48 4.211 4.018 0.193 1
1 601 . 14 1 1 A 48 48 LEU C C 48 180.111 179.152 0.959 1
1 602 . 14 1 1 A 48 48 LEU CA C 48 57.179 57.687 -0.508 1
1 603 . 14 1 1 A 48 48 LEU CB C 48 42.067 40.883 1.184 1
1 607 . 14 1 1 A 48 48 LEU N N 48 118.594 119.749 -1.155 1
1 608 . 14 1 1 A 49 49 HIS H H 49 8.864 8.285 0.579 1
1 609 . 14 1 1 A 49 49 HIS HA H 49 5.162 4.631 0.531 1
1 613 . 14 1 1 A 49 49 HIS C C 49 178.801 177.158 1.643 1
1 614 . 14 1 1 A 49 49 HIS CA C 49 58.397 60.155 -1.758 1
1 615 . 14 1 1 A 49 49 HIS CB C 49 29.631 30.061 -0.430 1
1 617 . 14 1 1 A 49 49 HIS N N 49 122.537 118.193 4.344 1
1 618 . 14 1 1 A 50 50 ASP H H 50 8.683 8.064 0.619 1
1 619 . 14 1 1 A 50 50 ASP HA H 50 4.356 4.113 0.243 1
1 622 . 14 1 1 A 50 50 ASP C C 50 178.474 178.138 0.336 1
1 623 . 14 1 1 A 50 50 ASP CA C 50 57.744 57.328 0.416 1
1 624 . 14 1 1 A 50 50 ASP CB C 50 40.575 40.736 -0.161 1
1 625 . 14 1 1 A 50 50 ASP N N 50 123.169 119.981 3.188 1
1 626 . 14 1 1 A 51 51 VAL H H 51 7.606 7.625 -0.019 1
1 627 . 14 1 1 A 51 51 VAL HA H 51 4.514 4.077 0.437 1
1 635 . 14 1 1 A 51 51 VAL C C 51 176.862 176.248 0.614 1
1 636 . 14 1 1 A 51 51 VAL CA C 51 61.590 62.468 -0.878 1
1 637 . 14 1 1 A 51 51 VAL CB C 51 31.423 31.700 -0.277 1
1 640 . 14 1 1 A 51 51 VAL N N 51 109.266 113.837 -4.571 1
1 641 . 14 1 1 A 52 52 GLY H H 52 7.696 7.445 0.251 1
1 642 . 14 1 1 A 52 52 GLY HA2 H 52 4.172 3.947 0.225 1
1 643 . 14 1 1 A 52 52 GLY HA3 H 52 3.938 3.971 -0.033 1
1 644 . 14 1 1 A 52 52 GLY C C 52 174.276 174.425 -0.149 1
1 645 . 14 1 1 A 52 52 GLY CA C 52 46.228 46.377 -0.149 1
1 646 . 14 1 1 A 52 52 GLY N N 52 108.681 110.478 -1.797 1
1 647 . 14 1 1 A 53 53 VAL H H 53 8.046 8.269 -0.223 1
1 648 . 14 1 1 A 53 53 VAL HA H 53 4.079 4.148 -0.069 1
1 656 . 14 1 1 A 53 53 VAL C C 53 175.949 175.669 0.280 1
1 657 . 14 1 1 A 53 53 VAL CA C 53 64.063 63.811 0.252 1
1 658 . 14 1 1 A 53 53 VAL CB C 53 33.160 33.248 -0.088 1
1 661 . 14 1 1 A 53 53 VAL N N 53 117.892 116.939 0.953 1
1 662 . 14 1 1 A 54 54 LEU H H 54 6.835 7.531 -0.696 1
1 663 . 14 1 1 A 54 54 LEU HA H 54 5.348 5.001 0.347 1
1 673 . 14 1 1 A 54 54 LEU C C 54 175.713 175.948 -0.235 1
1 674 . 14 1 1 A 54 54 LEU CA C 54 52.194 53.004 -0.810 1
1 675 . 14 1 1 A 54 54 LEU CB C 54 46.733 45.221 1.512 1
1 679 . 14 1 1 A 54 54 LEU N N 54 114.848 118.083 -3.235 1
1 680 . 14 1 1 A 55 55 GLU H H 55 9.549 9.349 0.200 1
1 681 . 14 1 1 A 55 55 GLU HA H 55 4.826 5.293 -0.467 1
1 686 . 14 1 1 A 55 55 GLU C C 55 174.661 175.364 -0.703 1
1 687 . 14 1 1 A 55 55 GLU CA C 55 54.637 54.742 -0.105 1
1 688 . 14 1 1 A 55 55 GLU CB C 55 32.891 33.803 -0.912 1
1 690 . 14 1 1 A 55 55 GLU N N 55 121.431 122.081 -0.650 1
1 691 . 14 1 1 A 56 56 LYS H H 56 8.513 8.179 0.334 1
1 692 . 14 1 1 A 56 56 LYS HA H 56 4.151 3.993 0.158 1
1 701 . 14 1 1 A 56 56 LYS C C 56 176.270 175.608 0.662 1
1 702 . 14 1 1 A 56 56 LYS CA C 56 54.890 55.784 -0.894 1
1 703 . 14 1 1 A 56 56 LYS CB C 56 33.162 32.772 0.390 1
1 707 . 14 1 1 A 56 56 LYS N N 56 126.539 122.067 4.472 1
1 708 . 14 1 1 A 57 57 VAL H H 57 8.279 8.312 -0.033 1
1 709 . 14 1 1 A 57 57 VAL HA H 57 3.820 4.512 -0.692 1
1 717 . 14 1 1 A 57 57 VAL C C 57 175.108 174.307 0.801 1
1 718 . 14 1 1 A 57 57 VAL CA C 57 62.834 61.651 1.183 1
1 719 . 14 1 1 A 57 57 VAL CB C 57 32.549 32.391 0.158 1
1 722 . 14 1 1 A 57 57 VAL N N 57 126.540 122.686 3.854 1
1 723 . 14 1 1 A 58 58 ASN H H 58 8.383 8.414 -0.031 1
1 724 . 14 1 1 A 58 58 ASN HA H 58 4.612 4.918 -0.306 1
1 729 . 14 1 1 A 58 58 ASN C C 58 174.772 175.115 -0.343 1
1 730 . 14 1 1 A 58 58 ASN CA C 58 52.575 52.026 0.549 1
1 731 . 14 1 1 A 58 58 ASN CB C 58 38.502 39.282 -0.780 1
1 733 . 14 1 1 A 58 58 ASN N N 58 121.767 124.194 -2.427 1
1 735 . 14 1 1 A 59 59 ALA H H 59 8.165 8.741 -0.576 1
1 736 . 14 1 1 A 59 59 ALA HA H 59 4.251 4.292 -0.041 1
1 740 . 14 1 1 A 59 59 ALA C C 59 177.478 178.382 -0.904 1
1 741 . 14 1 1 A 59 59 ALA CA C 59 52.490 55.077 -2.587 1
1 742 . 14 1 1 A 59 59 ALA CB C 59 19.724 19.167 0.557 1
1 743 . 14 1 1 A 59 59 ALA N N 59 125.082 121.032 4.050 1
1 744 . 14 1 1 A 60 60 GLY H H 60 8.291 7.855 0.436 1
1 745 . 14 1 1 A 60 60 GLY HA2 H 60 4.165 4.038 0.127 1
1 746 . 14 1 1 A 60 60 GLY HA3 H 60 3.853 4.040 -0.187 1
1 747 . 14 1 1 A 60 60 GLY C C 60 174.171 173.237 0.934 1
1 748 . 14 1 1 A 60 60 GLY CA C 60 44.994 44.370 0.624 1
1 749 . 14 1 1 A 60 60 GLY N N 60 108.518 107.352 1.166 1
1 750 . 14 1 1 A 61 61 LYS H H 61 8.189 8.199 -0.010 1
1 751 . 14 1 1 A 61 61 LYS HA H 61 4.320 4.624 -0.304 1
1 760 . 14 1 1 A 61 61 LYS C C 61 177.712 176.868 0.844 1
1 761 . 14 1 1 A 61 61 LYS CA C 61 56.832 54.773 2.059 1
1 762 . 14 1 1 A 61 61 LYS CB C 61 32.641 35.555 -2.914 1
1 766 . 14 1 1 A 61 61 LYS N N 61 120.532 121.587 -1.055 1
1 767 . 14 1 1 A 62 62 GLY H H 62 8.767 8.762 0.005 1
1 768 . 14 1 1 A 62 62 GLY HA2 H 62 4.021 3.997 0.024 1
1 769 . 14 1 1 A 62 62 GLY HA3 H 62 3.849 4.025 -0.176 1
1 770 . 14 1 1 A 62 62 GLY C C 62 173.782 174.480 -0.698 1
1 771 . 14 1 1 A 62 62 GLY CA C 62 45.844 45.283 0.561 1
1 772 . 14 1 1 A 62 62 GLY N N 62 111.547 111.622 -0.075 1
1 773 . 14 1 1 A 63 63 VAL H H 63 7.379 7.821 -0.442 1
1 774 . 14 1 1 A 63 63 VAL HA H 63 4.591 4.215 0.376 1
1 782 . 14 1 1 A 63 63 VAL C C 63 174.262 175.485 -1.223 1
1 783 . 14 1 1 A 63 63 VAL CA C 63 59.292 60.890 -1.598 1
1 784 . 14 1 1 A 63 63 VAL CB C 63 32.726 31.464 1.262 1
1 787 . 14 1 1 A 63 63 VAL N N 63 117.546 119.960 -2.414 1
1 788 . 14 1 1 A 64 64 PRO HA H 64 4.458 4.831 -0.373 1
1 795 . 14 1 1 A 64 64 PRO C C 64 177.166 175.859 1.307 1
1 796 . 14 1 1 A 64 64 PRO CA C 64 63.661 63.008 0.653 1
1 797 . 14 1 1 A 64 64 PRO CB C 64 32.321 32.934 -0.613 1
1 800 . 14 1 1 A 65 65 GLY H H 65 8.463 7.943 0.520 1
1 801 . 14 1 1 A 65 65 GLY HA2 H 65 3.882 4.097 -0.215 1
1 802 . 14 1 1 A 65 65 GLY HA3 H 65 3.602 4.198 -0.596 1
1 803 . 14 1 1 A 65 65 GLY C C 65 172.406 171.702 0.704 1
1 804 . 14 1 1 A 65 65 GLY CA C 65 45.933 45.855 0.078 1
1 805 . 14 1 1 A 65 65 GLY N N 65 109.819 107.835 1.984 1
1 806 . 14 1 1 A 66 66 LEU H H 66 7.534 7.892 -0.358 1
1 807 . 14 1 1 A 66 66 LEU HA H 66 4.940 5.060 -0.120 1
1 817 . 14 1 1 A 66 66 LEU C C 66 176.237 175.761 0.476 1
1 818 . 14 1 1 A 66 66 LEU CA C 66 53.687 53.039 0.648 1
1 819 . 14 1 1 A 66 66 LEU CB C 66 46.108 44.915 1.193 1
1 823 . 14 1 1 A 66 66 LEU N N 66 122.249 123.003 -0.754 1
1 824 . 14 1 1 A 67 67 TRP H H 67 8.916 9.311 -0.395 1
1 825 . 14 1 1 A 67 67 TRP HA H 67 5.526 5.298 0.228 1
1 834 . 14 1 1 A 67 67 TRP C C 67 175.670 175.603 0.067 1
1 835 . 14 1 1 A 67 67 TRP CA C 67 56.241 55.897 0.344 1
1 836 . 14 1 1 A 67 67 TRP CB C 67 33.314 32.156 1.158 1
1 842 . 14 1 1 A 67 67 TRP N N 67 121.160 122.327 -1.167 1
1 844 . 14 1 1 A 68 68 ARG H H 68 8.772 9.019 -0.247 1
1 845 . 14 1 1 A 68 68 ARG HA H 68 4.832 4.957 -0.125 1
1 853 . 14 1 1 A 68 68 ARG C C 68 174.720 175.572 -0.852 1
1 854 . 14 1 1 A 68 68 ARG CA C 68 54.690 54.318 0.372 1
1 855 . 14 1 1 A 68 68 ARG CB C 68 35.176 33.099 2.077 1
1 858 . 14 1 1 A 68 68 ARG N N 68 117.471 123.856 -6.385 1
1 860 . 14 1 1 A 69 69 LEU H H 69 9.355 8.742 0.613 1
1 861 . 14 1 1 A 69 69 LEU HA H 69 4.557 5.114 -0.557 1
1 871 . 14 1 1 A 69 69 LEU C C 69 177.180 175.907 1.273 1
1 872 . 14 1 1 A 69 69 LEU CA C 69 55.780 52.542 3.238 1
1 873 . 14 1 1 A 69 69 LEU CB C 69 42.736 46.001 -3.265 1
1 877 . 14 1 1 A 69 69 LEU N N 69 125.211 117.607 7.604 1
1 878 . 14 1 1 A 70 70 LEU H H 70 8.058 8.843 -0.785 1
1 879 . 14 1 1 A 70 70 LEU HA H 70 4.364 4.246 0.118 1
1 889 . 14 1 1 A 70 70 LEU C C 70 176.808 176.339 0.469 1
1 890 . 14 1 1 A 70 70 LEU CA C 70 55.257 54.667 0.590 1
1 891 . 14 1 1 A 70 70 LEU CB C 70 42.413 40.730 1.683 1
1 895 . 14 1 1 A 70 70 LEU N N 70 125.525 121.721 3.804 1
1 1 . 15 1 1 A 2 2 SER HA H 2 4.126 5.167 -1.041 1
1 4 . 15 1 1 A 2 2 SER CA C 2 57.564 56.772 0.792 1
1 5 . 15 1 1 A 2 2 SER CB C 2 63.953 64.983 -1.030 1
1 6 . 15 1 1 A 3 3 GLU HA H 3 4.408 4.724 -0.316 1
1 11 . 15 1 1 A 3 3 GLU C C 3 176.658 176.366 0.292 1
1 12 . 15 1 1 A 3 3 GLU CA C 3 56.802 55.481 1.321 1
1 13 . 15 1 1 A 3 3 GLU CB C 3 30.674 30.179 0.495 1
1 15 . 15 1 1 A 4 4 SER H H 4 8.650 7.677 0.973 1
1 16 . 15 1 1 A 4 4 SER HA H 4 4.463 4.372 0.091 1
1 19 . 15 1 1 A 4 4 SER C C 4 175.949 174.917 1.032 1
1 20 . 15 1 1 A 4 4 SER CA C 4 58.557 57.042 1.515 1
1 21 . 15 1 1 A 4 4 SER CB C 4 63.834 61.521 2.313 1
1 22 . 15 1 1 A 4 4 SER N N 4 118.042 116.582 1.460 1
1 23 . 15 1 1 A 5 5 ILE H H 5 8.404 8.091 0.313 1
1 24 . 15 1 1 A 5 5 ILE HA H 5 3.902 3.911 -0.009 1
1 34 . 15 1 1 A 5 5 ILE C C 5 176.608 177.948 -1.340 1
1 35 . 15 1 1 A 5 5 ILE CA C 5 62.662 63.486 -0.824 1
1 36 . 15 1 1 A 5 5 ILE CB C 5 37.622 37.785 -0.163 1
1 40 . 15 1 1 A 5 5 ILE N N 5 124.711 126.264 -1.553 1
1 41 . 15 1 1 A 6 6 VAL H H 6 7.602 7.821 -0.219 1
1 42 . 15 1 1 A 6 6 VAL HA H 6 3.293 3.405 -0.112 1
1 50 . 15 1 1 A 6 6 VAL C C 6 177.088 178.309 -1.221 1
1 51 . 15 1 1 A 6 6 VAL CA C 6 67.180 66.279 0.901 1
1 52 . 15 1 1 A 6 6 VAL CB C 6 31.517 31.288 0.229 1
1 55 . 15 1 1 A 6 6 VAL N N 6 119.974 120.539 -0.565 1
1 56 . 15 1 1 A 7 7 THR H H 7 7.515 7.991 -0.476 1
1 57 . 15 1 1 A 7 7 THR HA H 7 3.823 3.824 -0.001 1
1 62 . 15 1 1 A 7 7 THR C C 7 176.978 176.269 0.709 1
1 63 . 15 1 1 A 7 7 THR CA C 7 66.257 67.048 -0.791 1
1 64 . 15 1 1 A 7 7 THR CB C 7 68.410 68.617 -0.207 1
1 66 . 15 1 1 A 7 7 THR N N 7 114.177 117.042 -2.865 1
1 67 . 15 1 1 A 8 8 LYS H H 8 7.807 7.678 0.129 1
1 68 . 15 1 1 A 8 8 LYS HA H 8 4.066 3.960 0.106 1
1 77 . 15 1 1 A 8 8 LYS C C 8 178.733 178.387 0.346 1
1 78 . 15 1 1 A 8 8 LYS CA C 8 59.338 59.659 -0.321 1
1 79 . 15 1 1 A 8 8 LYS CB C 8 32.002 31.912 0.090 1
1 83 . 15 1 1 A 8 8 LYS N N 8 123.387 120.558 2.829 1
1 84 . 15 1 1 A 9 9 ILE H H 9 8.288 7.593 0.695 1
1 85 . 15 1 1 A 9 9 ILE HA H 9 3.421 3.557 -0.136 1
1 95 . 15 1 1 A 9 9 ILE C C 9 177.187 178.302 -1.115 1
1 96 . 15 1 1 A 9 9 ILE CA C 9 65.772 65.819 -0.047 1
1 97 . 15 1 1 A 9 9 ILE CB C 9 37.183 37.834 -0.651 1
1 101 . 15 1 1 A 9 9 ILE N N 9 119.543 119.030 0.513 1
1 102 . 15 1 1 A 10 10 ILE H H 10 8.073 8.289 -0.216 1
1 103 . 15 1 1 A 10 10 ILE HA H 10 3.305 3.491 -0.186 1
1 113 . 15 1 1 A 10 10 ILE C C 10 177.308 178.297 -0.989 1
1 114 . 15 1 1 A 10 10 ILE CA C 10 66.704 65.254 1.450 1
1 115 . 15 1 1 A 10 10 ILE CB C 10 37.840 37.735 0.105 1
1 119 . 15 1 1 A 10 10 ILE N N 10 119.219 120.494 -1.275 1
1 120 . 15 1 1 A 11 11 SER H H 11 7.861 8.235 -0.374 1
1 121 . 15 1 1 A 11 11 SER HA H 11 4.250 4.175 0.075 1
1 124 . 15 1 1 A 11 11 SER C C 11 176.918 177.469 -0.551 1
1 125 . 15 1 1 A 11 11 SER CA C 11 61.911 61.400 0.511 1
1 126 . 15 1 1 A 11 11 SER CB C 11 62.998 62.886 0.112 1
1 127 . 15 1 1 A 11 11 SER N N 11 113.959 115.619 -1.660 1
1 128 . 15 1 1 A 12 12 ILE H H 12 8.250 7.996 0.254 1
1 129 . 15 1 1 A 12 12 ILE HA H 12 3.801 3.599 0.202 1
1 139 . 15 1 1 A 12 12 ILE C C 12 178.130 178.385 -0.255 1
1 140 . 15 1 1 A 12 12 ILE CA C 12 65.023 64.950 0.073 1
1 141 . 15 1 1 A 12 12 ILE CB C 12 38.195 37.700 0.495 1
1 145 . 15 1 1 A 12 12 ILE N N 12 123.767 122.262 1.505 1
1 146 . 15 1 1 A 13 13 VAL H H 13 8.308 8.309 -0.001 1
1 147 . 15 1 1 A 13 13 VAL HA H 13 3.435 3.490 -0.055 1
1 155 . 15 1 1 A 13 13 VAL C C 13 177.283 177.888 -0.605 1
1 156 . 15 1 1 A 13 13 VAL CA C 13 67.693 66.626 1.067 1
1 157 . 15 1 1 A 13 13 VAL CB C 13 31.139 31.183 -0.044 1
1 160 . 15 1 1 A 13 13 VAL N N 13 120.066 120.370 -0.304 1
1 161 . 15 1 1 A 14 14 GLN H H 14 8.612 8.353 0.259 1
1 162 . 15 1 1 A 14 14 GLN HA H 14 3.831 4.005 -0.174 1
1 169 . 15 1 1 A 14 14 GLN C C 14 178.256 178.635 -0.379 1
1 170 . 15 1 1 A 14 14 GLN CA C 14 59.660 59.309 0.351 1
1 171 . 15 1 1 A 14 14 GLN CB C 14 29.456 28.126 1.330 1
1 174 . 15 1 1 A 14 14 GLN N N 14 118.099 119.492 -1.393 1
1 176 . 15 1 1 A 15 15 GLU H H 15 8.378 8.312 0.066 1
1 177 . 15 1 1 A 15 15 GLU HA H 15 4.110 4.088 0.022 1
1 182 . 15 1 1 A 15 15 GLU C C 15 179.659 179.149 0.510 1
1 183 . 15 1 1 A 15 15 GLU CA C 15 59.476 59.251 0.225 1
1 184 . 15 1 1 A 15 15 GLU CB C 15 29.725 29.279 0.446 1
1 186 . 15 1 1 A 15 15 GLU N N 15 118.580 119.166 -0.586 1
1 187 . 15 1 1 A 16 16 ARG H H 16 8.439 7.991 0.448 1
1 188 . 15 1 1 A 16 16 ARG HA H 16 4.157 4.165 -0.008 1
1 196 . 15 1 1 A 16 16 ARG C C 16 179.276 179.236 0.040 1
1 197 . 15 1 1 A 16 16 ARG CA C 16 58.141 59.624 -1.483 1
1 198 . 15 1 1 A 16 16 ARG CB C 16 29.434 29.950 -0.516 1
1 201 . 15 1 1 A 16 16 ARG N N 16 118.688 119.017 -0.329 1
1 203 . 15 1 1 A 17 17 GLN H H 17 8.861 8.050 0.811 1
1 204 . 15 1 1 A 17 17 GLN HA H 17 4.236 4.113 0.123 1
1 211 . 15 1 1 A 17 17 GLN C C 17 178.736 178.352 0.384 1
1 212 . 15 1 1 A 17 17 GLN CA C 17 59.683 58.677 1.006 1
1 213 . 15 1 1 A 17 17 GLN CB C 17 29.960 28.169 1.791 1
1 216 . 15 1 1 A 17 17 GLN N N 17 120.427 118.612 1.815 1
1 218 . 15 1 1 A 18 18 ASN H H 18 8.017 8.305 -0.288 1
1 219 . 15 1 1 A 18 18 ASN HA H 18 4.605 4.529 0.076 1
1 224 . 15 1 1 A 18 18 ASN C C 18 177.906 176.607 1.299 1
1 225 . 15 1 1 A 18 18 ASN CA C 18 55.375 55.456 -0.081 1
1 226 . 15 1 1 A 18 18 ASN CB C 18 38.383 38.224 0.159 1
1 228 . 15 1 1 A 18 18 ASN N N 18 117.033 117.852 -0.819 1
1 230 . 15 1 1 A 19 19 MET H H 19 7.994 7.645 0.349 1
1 231 . 15 1 1 A 19 19 MET HA H 19 4.372 4.564 -0.192 1
1 236 . 15 1 1 A 19 19 MET C C 19 176.518 177.768 -1.250 1
1 237 . 15 1 1 A 19 19 MET CA C 19 57.623 56.710 0.913 1
1 238 . 15 1 1 A 19 19 MET CB C 19 33.248 33.349 -0.101 1
1 240 . 15 1 1 A 19 19 MET N N 19 119.320 117.298 2.022 1
1 241 . 15 1 1 A 20 20 ASP H H 20 7.800 8.423 -0.623 1
1 242 . 15 1 1 A 20 20 ASP HA H 20 4.990 4.373 0.617 1
1 245 . 15 1 1 A 20 20 ASP C C 20 176.082 176.272 -0.190 1
1 246 . 15 1 1 A 20 20 ASP CA C 20 53.796 57.182 -3.386 1
1 247 . 15 1 1 A 20 20 ASP CB C 20 40.409 40.671 -0.262 1
1 248 . 15 1 1 A 20 20 ASP N N 20 119.127 120.614 -1.487 1
1 249 . 15 1 1 A 21 21 ASP H H 21 8.136 7.812 0.324 1
1 250 . 15 1 1 A 21 21 ASP HA H 21 4.497 4.734 -0.237 1
1 253 . 15 1 1 A 21 21 ASP C C 21 176.264 177.516 -1.252 1
1 254 . 15 1 1 A 21 21 ASP CA C 21 55.508 56.187 -0.679 1
1 255 . 15 1 1 A 21 21 ASP CB C 21 40.063 40.419 -0.356 1
1 256 . 15 1 1 A 21 21 ASP N N 21 118.276 118.860 -0.584 1
1 257 . 15 1 1 A 22 22 GLY H H 22 8.728 8.813 -0.085 1
1 258 . 15 1 1 A 22 22 GLY HA2 H 22 4.189 3.949 0.240 1
1 259 . 15 1 1 A 22 22 GLY HA3 H 22 3.683 3.949 -0.266 1
1 260 . 15 1 1 A 22 22 GLY C C 22 174.304 174.366 -0.062 1
1 261 . 15 1 1 A 22 22 GLY CA C 22 45.629 46.403 -0.774 1
1 262 . 15 1 1 A 22 22 GLY N N 22 105.878 107.288 -1.410 1
1 263 . 15 1 1 A 23 23 ALA H H 23 7.473 7.653 -0.180 1
1 264 . 15 1 1 A 23 23 ALA HA H 23 4.519 4.519 0.000 1
1 268 . 15 1 1 A 23 23 ALA C C 23 174.065 175.690 -1.625 1
1 269 . 15 1 1 A 23 23 ALA CA C 23 51.142 49.402 1.740 1
1 270 . 15 1 1 A 23 23 ALA CB C 23 18.283 20.382 -2.099 1
1 271 . 15 1 1 A 23 23 ALA N N 23 125.323 122.933 2.390 1
1 272 . 15 1 1 A 24 24 PRO HA H 24 4.590 4.622 -0.032 1
1 279 . 15 1 1 A 24 24 PRO C C 24 175.253 176.157 -0.904 1
1 280 . 15 1 1 A 24 24 PRO CA C 24 62.186 62.429 -0.243 1
1 281 . 15 1 1 A 24 24 PRO CB C 24 32.931 32.415 0.516 1
1 284 . 15 1 1 A 25 25 VAL H H 25 9.334 8.811 0.523 1
1 285 . 15 1 1 A 25 25 VAL HA H 25 4.378 4.254 0.124 1
1 293 . 15 1 1 A 25 25 VAL C C 25 176.439 175.859 0.580 1
1 294 . 15 1 1 A 25 25 VAL CA C 25 61.482 62.531 -1.049 1
1 295 . 15 1 1 A 25 25 VAL CB C 25 34.781 32.292 2.489 1
1 298 . 15 1 1 A 25 25 VAL N N 25 120.408 121.190 -0.782 1
1 299 . 15 1 1 A 26 26 LYS H H 26 9.300 8.911 0.389 1
1 300 . 15 1 1 A 26 26 LYS HA H 26 4.982 4.675 0.307 1
1 309 . 15 1 1 A 26 26 LYS C C 26 179.008 177.950 1.058 1
1 310 . 15 1 1 A 26 26 LYS CA C 26 56.908 54.701 2.207 1
1 311 . 15 1 1 A 26 26 LYS CB C 26 34.071 34.586 -0.515 1
1 315 . 15 1 1 A 26 26 LYS N N 26 126.177 125.392 0.785 1
1 316 . 15 1 1 A 27 27 THR H H 27 8.618 9.068 -0.450 1
1 317 . 15 1 1 A 27 27 THR HA H 27 3.662 4.040 -0.378 1
1 322 . 15 1 1 A 27 27 THR C C 27 176.442 176.530 -0.088 1
1 323 . 15 1 1 A 27 27 THR CA C 27 67.591 66.085 1.506 1
1 324 . 15 1 1 A 27 27 THR CB C 27 68.868 68.942 -0.074 1
1 326 . 15 1 1 A 27 27 THR N N 27 119.020 117.360 1.660 1
1 327 . 15 1 1 A 28 28 ARG H H 28 9.288 8.228 1.060 1
1 328 . 15 1 1 A 28 28 ARG HA H 28 3.879 4.045 -0.166 1
1 335 . 15 1 1 A 28 28 ARG C C 28 176.884 178.898 -2.014 1
1 336 . 15 1 1 A 28 28 ARG CA C 28 59.431 59.313 0.118 1
1 337 . 15 1 1 A 28 28 ARG CB C 28 29.953 30.118 -0.165 1
1 340 . 15 1 1 A 28 28 ARG N N 28 119.100 121.265 -2.165 1
1 341 . 15 1 1 A 29 29 ASP H H 29 6.907 8.235 -1.328 1
1 342 . 15 1 1 A 29 29 ASP HA H 29 4.550 4.390 0.160 1
1 345 . 15 1 1 A 29 29 ASP C C 29 179.050 178.757 0.293 1
1 346 . 15 1 1 A 29 29 ASP CA C 29 57.262 57.276 -0.014 1
1 347 . 15 1 1 A 29 29 ASP CB C 29 40.191 40.399 -0.208 1
1 348 . 15 1 1 A 29 29 ASP N N 29 117.490 119.716 -2.226 1
1 349 . 15 1 1 A 30 30 ILE H H 30 7.554 7.420 0.134 1
1 350 . 15 1 1 A 30 30 ILE HA H 30 3.595 3.779 -0.184 1
1 360 . 15 1 1 A 30 30 ILE C C 30 176.907 177.772 -0.865 1
1 361 . 15 1 1 A 30 30 ILE CA C 30 65.002 65.910 -0.908 1
1 362 . 15 1 1 A 30 30 ILE CB C 30 37.999 37.913 0.086 1
1 366 . 15 1 1 A 30 30 ILE N N 30 120.978 120.123 0.855 1
1 367 . 15 1 1 A 31 31 ALA H H 31 8.269 8.374 -0.105 1
1 368 . 15 1 1 A 31 31 ALA HA H 31 3.720 4.067 -0.347 1
1 372 . 15 1 1 A 31 31 ALA C C 31 179.170 179.631 -0.461 1
1 373 . 15 1 1 A 31 31 ALA CA C 31 56.354 55.750 0.604 1
1 374 . 15 1 1 A 31 31 ALA CB C 31 17.843 18.133 -0.290 1
1 375 . 15 1 1 A 31 31 ALA N N 31 121.171 122.909 -1.738 1
1 376 . 15 1 1 A 32 32 ASP H H 32 8.293 8.483 -0.190 1
1 377 . 15 1 1 A 32 32 ASP HA H 32 4.422 4.469 -0.047 1
1 380 . 15 1 1 A 32 32 ASP C C 32 179.136 178.350 0.786 1
1 381 . 15 1 1 A 32 32 ASP CA C 32 57.109 56.458 0.651 1
1 382 . 15 1 1 A 32 32 ASP CB C 32 40.523 40.284 0.239 1
1 383 . 15 1 1 A 32 32 ASP N N 32 116.467 118.955 -2.488 1
1 384 . 15 1 1 A 33 33 ALA H H 33 7.536 8.341 -0.805 1
1 385 . 15 1 1 A 33 33 ALA HA H 33 4.222 4.119 0.103 1
1 389 . 15 1 1 A 33 33 ALA C C 33 179.056 179.734 -0.678 1
1 390 . 15 1 1 A 33 33 ALA CA C 33 54.469 54.890 -0.421 1
1 391 . 15 1 1 A 33 33 ALA CB C 33 19.085 18.447 0.638 1
1 392 . 15 1 1 A 33 33 ALA N N 33 120.859 123.033 -2.174 1
1 393 . 15 1 1 A 34 34 ALA H H 34 8.296 7.811 0.485 1
1 394 . 15 1 1 A 34 34 ALA HA H 34 4.101 4.256 -0.155 1
1 398 . 15 1 1 A 34 34 ALA C C 34 176.912 178.033 -1.121 1
1 399 . 15 1 1 A 34 34 ALA CA C 34 52.380 52.540 -0.160 1
1 400 . 15 1 1 A 34 34 ALA CB C 34 18.817 19.691 -0.874 1
1 401 . 15 1 1 A 34 34 ALA N N 34 118.203 117.023 1.180 1
1 402 . 15 1 1 A 35 35 GLY H H 35 7.911 8.491 -0.580 1
1 403 . 15 1 1 A 35 35 GLY HA2 H 35 3.968 3.950 0.018 1
1 404 . 15 1 1 A 35 35 GLY HA3 H 35 3.968 3.954 0.014 1
1 405 . 15 1 1 A 35 35 GLY C C 35 174.374 174.109 0.265 1
1 406 . 15 1 1 A 35 35 GLY CA C 35 46.388 46.648 -0.260 1
1 407 . 15 1 1 A 35 35 GLY N N 35 107.752 107.729 0.023 1
1 408 . 15 1 1 A 36 36 LEU H H 36 7.758 7.477 0.281 1
1 409 . 15 1 1 A 36 36 LEU HA H 36 4.887 4.893 -0.006 1
1 419 . 15 1 1 A 36 36 LEU C C 36 175.941 175.624 0.317 1
1 420 . 15 1 1 A 36 36 LEU CA C 36 52.443 52.530 -0.087 1
1 421 . 15 1 1 A 36 36 LEU CB C 36 47.885 45.718 2.167 1
1 425 . 15 1 1 A 36 36 LEU N N 36 118.719 120.671 -1.952 1
1 426 . 15 1 1 A 37 37 SER H H 37 8.603 8.790 -0.187 1
1 427 . 15 1 1 A 37 37 SER HA H 37 4.565 4.576 -0.011 1
1 430 . 15 1 1 A 37 37 SER C C 37 175.512 175.783 -0.271 1
1 431 . 15 1 1 A 37 37 SER CA C 37 57.262 59.055 -1.793 1
1 432 . 15 1 1 A 37 37 SER CB C 37 65.155 63.551 1.604 1
1 433 . 15 1 1 A 37 37 SER N N 37 115.095 117.370 -2.275 1
1 434 . 15 1 1 A 38 38 ILE H H 38 8.822 8.807 0.015 1
1 435 . 15 1 1 A 38 38 ILE HA H 38 3.650 3.820 -0.170 1
1 445 . 15 1 1 A 38 38 ILE C C 38 176.849 177.436 -0.587 1
1 446 . 15 1 1 A 38 38 ILE CA C 38 64.557 65.256 -0.699 1
1 447 . 15 1 1 A 38 38 ILE CB C 38 37.451 37.658 -0.207 1
1 451 . 15 1 1 A 38 38 ILE N N 38 122.026 124.578 -2.552 1
1 452 . 15 1 1 A 39 39 TYR H H 39 7.839 8.465 -0.626 1
1 453 . 15 1 1 A 39 39 TYR HA H 39 4.112 3.990 0.122 1
1 460 . 15 1 1 A 39 39 TYR C C 39 177.703 177.417 0.286 1
1 461 . 15 1 1 A 39 39 TYR CA C 39 60.856 62.065 -1.209 1
1 462 . 15 1 1 A 39 39 TYR CB C 39 38.402 38.437 -0.035 1
1 467 . 15 1 1 A 39 39 TYR N N 39 118.759 120.968 -2.209 1
1 468 . 15 1 1 A 40 40 GLN H H 40 7.687 8.104 -0.417 1
1 469 . 15 1 1 A 40 40 GLN HA H 40 3.865 3.687 0.178 1
1 476 . 15 1 1 A 40 40 GLN C C 40 178.735 178.354 0.381 1
1 477 . 15 1 1 A 40 40 GLN CA C 40 58.089 58.671 -0.582 1
1 478 . 15 1 1 A 40 40 GLN CB C 40 29.950 28.235 1.715 1
1 481 . 15 1 1 A 40 40 GLN N N 40 116.772 118.419 -1.647 1
1 483 . 15 1 1 A 41 41 VAL H H 41 8.494 8.388 0.106 1
1 484 . 15 1 1 A 41 41 VAL HA H 41 3.835 3.545 0.290 1
1 492 . 15 1 1 A 41 41 VAL C C 41 176.977 177.810 -0.833 1
1 493 . 15 1 1 A 41 41 VAL CA C 41 66.102 66.940 -0.838 1
1 494 . 15 1 1 A 41 41 VAL CB C 41 31.105 31.515 -0.410 1
1 497 . 15 1 1 A 41 41 VAL N N 41 117.192 119.956 -2.764 1
1 498 . 15 1 1 A 42 42 ARG H H 42 8.179 8.485 -0.306 1
1 499 . 15 1 1 A 42 42 ARG HA H 42 3.708 3.916 -0.208 1
1 506 . 15 1 1 A 42 42 ARG C C 42 177.570 178.329 -0.759 1
1 507 . 15 1 1 A 42 42 ARG CA C 42 60.349 59.687 0.662 1
1 508 . 15 1 1 A 42 42 ARG CB C 42 30.047 29.919 0.128 1
1 511 . 15 1 1 A 42 42 ARG N N 42 120.574 119.343 1.231 1
1 512 . 15 1 1 A 43 43 LEU H H 43 6.982 7.887 -0.905 1
1 513 . 15 1 1 A 43 43 LEU HA H 43 3.939 3.754 0.185 1
1 523 . 15 1 1 A 43 43 LEU C C 43 180.397 178.401 1.996 1
1 524 . 15 1 1 A 43 43 LEU CA C 43 58.119 57.828 0.291 1
1 525 . 15 1 1 A 43 43 LEU CB C 43 41.294 41.263 0.031 1
1 529 . 15 1 1 A 43 43 LEU N N 43 117.189 118.914 -1.725 1
1 530 . 15 1 1 A 44 44 TYR H H 44 7.026 7.353 -0.327 1
1 531 . 15 1 1 A 44 44 TYR HA H 44 4.253 4.225 0.028 1
1 538 . 15 1 1 A 44 44 TYR C C 44 178.411 178.058 0.353 1
1 539 . 15 1 1 A 44 44 TYR CA C 44 60.941 60.832 0.109 1
1 540 . 15 1 1 A 44 44 TYR CB C 44 38.889 38.160 0.729 1
1 545 . 15 1 1 A 44 44 TYR N N 44 117.020 117.512 -0.492 1
1 546 . 15 1 1 A 45 45 LEU H H 45 8.429 8.394 0.035 1
1 547 . 15 1 1 A 45 45 LEU HA H 45 3.486 3.567 -0.081 1
1 557 . 15 1 1 A 45 45 LEU C C 45 178.648 178.961 -0.313 1
1 558 . 15 1 1 A 45 45 LEU CA C 45 57.915 57.781 0.134 1
1 559 . 15 1 1 A 45 45 LEU CB C 45 39.073 40.592 -1.519 1
1 563 . 15 1 1 A 45 45 LEU N N 45 119.649 120.041 -0.392 1
1 564 . 15 1 1 A 46 46 GLU H H 46 8.309 8.256 0.053 1
1 565 . 15 1 1 A 46 46 GLU HA H 46 4.286 4.047 0.239 1
1 570 . 15 1 1 A 46 46 GLU C C 46 179.577 179.491 0.086 1
1 571 . 15 1 1 A 46 46 GLU CA C 46 59.570 59.653 -0.083 1
1 572 . 15 1 1 A 46 46 GLU CB C 46 29.034 29.254 -0.220 1
1 574 . 15 1 1 A 46 46 GLU N N 46 117.366 117.202 0.164 1
1 575 . 15 1 1 A 47 47 GLN H H 47 7.493 7.663 -0.170 1
1 576 . 15 1 1 A 47 47 GLN HA H 47 4.243 4.041 0.202 1
1 583 . 15 1 1 A 47 47 GLN C C 47 178.870 178.636 0.234 1
1 584 . 15 1 1 A 47 47 GLN CA C 47 59.581 58.733 0.848 1
1 585 . 15 1 1 A 47 47 GLN CB C 47 28.300 28.518 -0.218 1
1 588 . 15 1 1 A 47 47 GLN N N 47 119.345 119.895 -0.550 1
1 590 . 15 1 1 A 48 48 LEU H H 48 8.160 8.391 -0.231 1
1 591 . 15 1 1 A 48 48 LEU HA H 48 4.211 3.986 0.225 1
1 601 . 15 1 1 A 48 48 LEU C C 48 180.111 179.220 0.891 1
1 602 . 15 1 1 A 48 48 LEU CA C 48 57.179 57.796 -0.617 1
1 603 . 15 1 1 A 48 48 LEU CB C 48 42.067 41.094 0.973 1
1 607 . 15 1 1 A 48 48 LEU N N 48 118.594 119.242 -0.648 1
1 608 . 15 1 1 A 49 49 HIS H H 49 8.864 8.385 0.479 1
1 609 . 15 1 1 A 49 49 HIS HA H 49 5.162 4.720 0.442 1
1 613 . 15 1 1 A 49 49 HIS C C 49 178.801 176.633 2.168 1
1 614 . 15 1 1 A 49 49 HIS CA C 49 58.397 60.048 -1.651 1
1 615 . 15 1 1 A 49 49 HIS CB C 49 29.631 30.088 -0.457 1
1 617 . 15 1 1 A 49 49 HIS N N 49 122.537 118.134 4.403 1
1 618 . 15 1 1 A 50 50 ASP H H 50 8.683 8.280 0.403 1
1 619 . 15 1 1 A 50 50 ASP HA H 50 4.356 4.066 0.290 1
1 622 . 15 1 1 A 50 50 ASP C C 50 178.474 178.009 0.465 1
1 623 . 15 1 1 A 50 50 ASP CA C 50 57.744 57.327 0.417 1
1 624 . 15 1 1 A 50 50 ASP CB C 50 40.575 41.125 -0.550 1
1 625 . 15 1 1 A 50 50 ASP N N 50 123.169 118.679 4.490 1
1 626 . 15 1 1 A 51 51 VAL H H 51 7.606 7.848 -0.242 1
1 627 . 15 1 1 A 51 51 VAL HA H 51 4.514 4.036 0.478 1
1 635 . 15 1 1 A 51 51 VAL C C 51 176.862 176.682 0.180 1
1 636 . 15 1 1 A 51 51 VAL CA C 51 61.590 63.051 -1.461 1
1 637 . 15 1 1 A 51 51 VAL CB C 51 31.423 32.600 -1.177 1
1 640 . 15 1 1 A 51 51 VAL N N 51 109.266 111.517 -2.251 1
1 641 . 15 1 1 A 52 52 GLY H H 52 7.696 7.870 -0.174 1
1 642 . 15 1 1 A 52 52 GLY HA2 H 52 4.172 3.989 0.183 1
1 643 . 15 1 1 A 52 52 GLY HA3 H 52 3.938 4.007 -0.069 1
1 644 . 15 1 1 A 52 52 GLY C C 52 174.276 175.359 -1.083 1
1 645 . 15 1 1 A 52 52 GLY CA C 52 46.228 45.197 1.031 1
1 646 . 15 1 1 A 52 52 GLY N N 52 108.681 110.395 -1.714 1
1 647 . 15 1 1 A 53 53 VAL H H 53 8.046 8.283 -0.237 1
1 648 . 15 1 1 A 53 53 VAL HA H 53 4.079 3.886 0.193 1
1 656 . 15 1 1 A 53 53 VAL C C 53 175.949 176.074 -0.125 1
1 657 . 15 1 1 A 53 53 VAL CA C 53 64.063 65.023 -0.960 1
1 658 . 15 1 1 A 53 53 VAL CB C 53 33.160 32.299 0.861 1
1 661 . 15 1 1 A 53 53 VAL N N 53 117.892 118.582 -0.690 1
1 662 . 15 1 1 A 54 54 LEU H H 54 6.835 7.538 -0.703 1
1 663 . 15 1 1 A 54 54 LEU HA H 54 5.348 5.047 0.301 1
1 673 . 15 1 1 A 54 54 LEU C C 54 175.713 176.033 -0.320 1
1 674 . 15 1 1 A 54 54 LEU CA C 54 52.194 52.877 -0.683 1
1 675 . 15 1 1 A 54 54 LEU CB C 54 46.733 45.931 0.802 1
1 679 . 15 1 1 A 54 54 LEU N N 54 114.848 117.590 -2.742 1
1 680 . 15 1 1 A 55 55 GLU H H 55 9.549 9.244 0.305 1
1 681 . 15 1 1 A 55 55 GLU HA H 55 4.826 5.040 -0.214 1
1 686 . 15 1 1 A 55 55 GLU C C 55 174.661 174.498 0.163 1
1 687 . 15 1 1 A 55 55 GLU CA C 55 54.637 54.588 0.049 1
1 688 . 15 1 1 A 55 55 GLU CB C 55 32.891 33.472 -0.581 1
1 690 . 15 1 1 A 55 55 GLU N N 55 121.431 122.219 -0.788 1
1 691 . 15 1 1 A 56 56 LYS H H 56 8.513 7.981 0.532 1
1 692 . 15 1 1 A 56 56 LYS HA H 56 4.151 4.216 -0.065 1
1 701 . 15 1 1 A 56 56 LYS C C 56 176.270 174.751 1.519 1
1 702 . 15 1 1 A 56 56 LYS CA C 56 54.890 55.417 -0.527 1
1 703 . 15 1 1 A 56 56 LYS CB C 56 33.162 32.633 0.529 1
1 707 . 15 1 1 A 56 56 LYS N N 56 126.539 126.203 0.336 1
1 708 . 15 1 1 A 57 57 VAL H H 57 8.279 8.473 -0.194 1
1 709 . 15 1 1 A 57 57 VAL HA H 57 3.820 4.269 -0.449 1
1 717 . 15 1 1 A 57 57 VAL C C 57 175.108 174.579 0.529 1
1 718 . 15 1 1 A 57 57 VAL CA C 57 62.834 62.222 0.612 1
1 719 . 15 1 1 A 57 57 VAL CB C 57 32.549 30.525 2.024 1
1 722 . 15 1 1 A 57 57 VAL N N 57 126.540 127.875 -1.335 1
1 723 . 15 1 1 A 58 58 ASN H H 58 8.383 8.055 0.328 1
1 724 . 15 1 1 A 58 58 ASN HA H 58 4.612 4.928 -0.316 1
1 729 . 15 1 1 A 58 58 ASN C C 58 174.772 175.134 -0.362 1
1 730 . 15 1 1 A 58 58 ASN CA C 58 52.575 52.233 0.342 1
1 731 . 15 1 1 A 58 58 ASN CB C 58 38.502 40.550 -2.048 1
1 733 . 15 1 1 A 58 58 ASN N N 58 121.767 126.101 -4.334 1
1 735 . 15 1 1 A 59 59 ALA H H 59 8.165 8.610 -0.445 1
1 736 . 15 1 1 A 59 59 ALA HA H 59 4.251 4.063 0.188 1
1 740 . 15 1 1 A 59 59 ALA C C 59 177.478 177.018 0.460 1
1 741 . 15 1 1 A 59 59 ALA CA C 59 52.490 53.105 -0.615 1
1 742 . 15 1 1 A 59 59 ALA CB C 59 19.724 19.471 0.253 1
1 743 . 15 1 1 A 59 59 ALA N N 59 125.082 126.732 -1.650 1
1 744 . 15 1 1 A 60 60 GLY H H 60 8.291 6.981 1.310 1
1 745 . 15 1 1 A 60 60 GLY HA2 H 60 4.165 4.068 0.097 1
1 746 . 15 1 1 A 60 60 GLY HA3 H 60 3.853 4.074 -0.221 1
1 747 . 15 1 1 A 60 60 GLY C C 60 174.171 172.424 1.747 1
1 748 . 15 1 1 A 60 60 GLY CA C 60 44.994 44.524 0.470 1
1 749 . 15 1 1 A 60 60 GLY N N 60 108.518 104.374 4.144 1
1 750 . 15 1 1 A 61 61 LYS H H 61 8.189 8.595 -0.406 1
1 751 . 15 1 1 A 61 61 LYS HA H 61 4.320 3.966 0.354 1
1 760 . 15 1 1 A 61 61 LYS C C 61 177.712 177.232 0.480 1
1 761 . 15 1 1 A 61 61 LYS CA C 61 56.832 58.469 -1.637 1
1 762 . 15 1 1 A 61 61 LYS CB C 61 32.641 31.960 0.681 1
1 766 . 15 1 1 A 61 61 LYS N N 61 120.532 121.612 -1.080 1
1 767 . 15 1 1 A 62 62 GLY H H 62 8.767 8.802 -0.035 1
1 768 . 15 1 1 A 62 62 GLY HA2 H 62 4.021 3.982 0.039 1
1 769 . 15 1 1 A 62 62 GLY HA3 H 62 3.849 3.984 -0.135 1
1 770 . 15 1 1 A 62 62 GLY C C 62 173.782 174.404 -0.622 1
1 771 . 15 1 1 A 62 62 GLY CA C 62 45.844 45.354 0.490 1
1 772 . 15 1 1 A 62 62 GLY N N 62 111.547 112.424 -0.877 1
1 773 . 15 1 1 A 63 63 VAL H H 63 7.379 7.794 -0.415 1
1 774 . 15 1 1 A 63 63 VAL HA H 63 4.591 4.181 0.410 1
1 782 . 15 1 1 A 63 63 VAL C C 63 174.262 175.116 -0.854 1
1 783 . 15 1 1 A 63 63 VAL CA C 63 59.292 60.768 -1.476 1
1 784 . 15 1 1 A 63 63 VAL CB C 63 32.726 31.350 1.376 1
1 787 . 15 1 1 A 63 63 VAL N N 63 117.546 120.077 -2.531 1
1 788 . 15 1 1 A 64 64 PRO HA H 64 4.458 4.543 -0.085 1
1 795 . 15 1 1 A 64 64 PRO C C 64 177.166 175.909 1.257 1
1 796 . 15 1 1 A 64 64 PRO CA C 64 63.661 62.482 1.179 1
1 797 . 15 1 1 A 64 64 PRO CB C 64 32.321 31.935 0.386 1
1 800 . 15 1 1 A 65 65 GLY H H 65 8.463 8.492 -0.029 1
1 801 . 15 1 1 A 65 65 GLY HA2 H 65 3.882 3.720 0.162 1
1 802 . 15 1 1 A 65 65 GLY HA3 H 65 3.602 3.742 -0.140 1
1 803 . 15 1 1 A 65 65 GLY C C 65 172.406 172.505 -0.099 1
1 804 . 15 1 1 A 65 65 GLY CA C 65 45.933 45.062 0.871 1
1 805 . 15 1 1 A 65 65 GLY N N 65 109.819 108.157 1.662 1
1 806 . 15 1 1 A 66 66 LEU H H 66 7.534 8.553 -1.019 1
1 807 . 15 1 1 A 66 66 LEU HA H 66 4.940 4.761 0.179 1
1 817 . 15 1 1 A 66 66 LEU C C 66 176.237 175.732 0.505 1
1 818 . 15 1 1 A 66 66 LEU CA C 66 53.687 53.525 0.162 1
1 819 . 15 1 1 A 66 66 LEU CB C 66 46.108 43.788 2.320 1
1 823 . 15 1 1 A 66 66 LEU N N 66 122.249 126.155 -3.906 1
1 824 . 15 1 1 A 67 67 TRP H H 67 8.916 9.254 -0.338 1
1 825 . 15 1 1 A 67 67 TRP HA H 67 5.526 5.625 -0.099 1
1 834 . 15 1 1 A 67 67 TRP C C 67 175.670 175.279 0.391 1
1 835 . 15 1 1 A 67 67 TRP CA C 67 56.241 55.372 0.869 1
1 836 . 15 1 1 A 67 67 TRP CB C 67 33.314 33.914 -0.600 1
1 842 . 15 1 1 A 67 67 TRP N N 67 121.160 122.528 -1.368 1
1 844 . 15 1 1 A 68 68 ARG H H 68 8.772 9.005 -0.233 1
1 845 . 15 1 1 A 68 68 ARG HA H 68 4.832 5.143 -0.311 1
1 853 . 15 1 1 A 68 68 ARG C C 68 174.720 175.044 -0.324 1
1 854 . 15 1 1 A 68 68 ARG CA C 68 54.690 54.775 -0.085 1
1 855 . 15 1 1 A 68 68 ARG CB C 68 35.176 33.936 1.240 1
1 858 . 15 1 1 A 68 68 ARG N N 68 117.471 119.972 -2.501 1
1 860 . 15 1 1 A 69 69 LEU H H 69 9.355 8.632 0.723 1
1 861 . 15 1 1 A 69 69 LEU HA H 69 4.557 4.945 -0.388 1
1 871 . 15 1 1 A 69 69 LEU C C 69 177.180 176.794 0.386 1
1 872 . 15 1 1 A 69 69 LEU CA C 69 55.780 54.185 1.595 1
1 873 . 15 1 1 A 69 69 LEU CB C 69 42.736 42.923 -0.187 1
1 877 . 15 1 1 A 69 69 LEU N N 69 125.211 119.463 5.748 1
1 878 . 15 1 1 A 70 70 LEU H H 70 8.058 8.611 -0.553 1
1 879 . 15 1 1 A 70 70 LEU HA H 70 4.364 4.714 -0.350 1
1 889 . 15 1 1 A 70 70 LEU C C 70 176.808 176.377 0.431 1
1 890 . 15 1 1 A 70 70 LEU CA C 70 55.257 54.964 0.293 1
1 891 . 15 1 1 A 70 70 LEU CB C 70 42.413 44.311 -1.898 1
1 895 . 15 1 1 A 70 70 LEU N N 70 125.525 118.965 6.560 1
1 1 . 16 1 1 A 2 2 SER HA H 2 4.126 4.077 0.049 1
1 4 . 16 1 1 A 2 2 SER CA C 2 57.564 59.008 -1.444 1
1 5 . 16 1 1 A 2 2 SER CB C 2 63.953 61.653 2.300 1
1 6 . 16 1 1 A 3 3 GLU HA H 3 4.408 4.738 -0.330 1
1 11 . 16 1 1 A 3 3 GLU C C 3 176.658 175.276 1.382 1
1 12 . 16 1 1 A 3 3 GLU CA C 3 56.802 55.137 1.665 1
1 13 . 16 1 1 A 3 3 GLU CB C 3 30.674 30.532 0.142 1
1 15 . 16 1 1 A 4 4 SER H H 4 8.650 9.053 -0.403 1
1 16 . 16 1 1 A 4 4 SER HA H 4 4.463 4.508 -0.045 1
1 19 . 16 1 1 A 4 4 SER C C 4 175.949 173.979 1.970 1
1 20 . 16 1 1 A 4 4 SER CA C 4 58.557 58.521 0.036 1
1 21 . 16 1 1 A 4 4 SER CB C 4 63.834 62.922 0.912 1
1 22 . 16 1 1 A 4 4 SER N N 4 118.042 123.454 -5.412 1
1 23 . 16 1 1 A 5 5 ILE H H 5 8.404 8.402 0.002 1
1 24 . 16 1 1 A 5 5 ILE HA H 5 3.902 3.562 0.340 1
1 34 . 16 1 1 A 5 5 ILE C C 5 176.608 177.274 -0.666 1
1 35 . 16 1 1 A 5 5 ILE CA C 5 62.662 64.709 -2.047 1
1 36 . 16 1 1 A 5 5 ILE CB C 5 37.622 37.659 -0.037 1
1 40 . 16 1 1 A 5 5 ILE N N 5 124.711 127.586 -2.875 1
1 41 . 16 1 1 A 6 6 VAL H H 6 7.602 8.024 -0.422 1
1 42 . 16 1 1 A 6 6 VAL HA H 6 3.293 3.277 0.016 1
1 50 . 16 1 1 A 6 6 VAL C C 6 177.088 177.968 -0.880 1
1 51 . 16 1 1 A 6 6 VAL CA C 6 67.180 66.799 0.381 1
1 52 . 16 1 1 A 6 6 VAL CB C 6 31.517 31.652 -0.135 1
1 55 . 16 1 1 A 6 6 VAL N N 6 119.974 119.649 0.325 1
1 56 . 16 1 1 A 7 7 THR H H 7 7.515 8.191 -0.676 1
1 57 . 16 1 1 A 7 7 THR HA H 7 3.823 3.880 -0.057 1
1 62 . 16 1 1 A 7 7 THR C C 7 176.978 176.268 0.710 1
1 63 . 16 1 1 A 7 7 THR CA C 7 66.257 67.027 -0.770 1
1 64 . 16 1 1 A 7 7 THR CB C 7 68.410 68.454 -0.044 1
1 66 . 16 1 1 A 7 7 THR N N 7 114.177 116.040 -1.863 1
1 67 . 16 1 1 A 8 8 LYS H H 8 7.807 8.235 -0.428 1
1 68 . 16 1 1 A 8 8 LYS HA H 8 4.066 3.956 0.110 1
1 77 . 16 1 1 A 8 8 LYS C C 8 178.733 178.314 0.419 1
1 78 . 16 1 1 A 8 8 LYS CA C 8 59.338 59.803 -0.465 1
1 79 . 16 1 1 A 8 8 LYS CB C 8 32.002 32.059 -0.057 1
1 83 . 16 1 1 A 8 8 LYS N N 8 123.387 120.260 3.127 1
1 84 . 16 1 1 A 9 9 ILE H H 9 8.288 7.773 0.515 1
1 85 . 16 1 1 A 9 9 ILE HA H 9 3.421 3.593 -0.172 1
1 95 . 16 1 1 A 9 9 ILE C C 9 177.187 177.982 -0.795 1
1 96 . 16 1 1 A 9 9 ILE CA C 9 65.772 65.438 0.334 1
1 97 . 16 1 1 A 9 9 ILE CB C 9 37.183 37.940 -0.757 1
1 101 . 16 1 1 A 9 9 ILE N N 9 119.543 118.751 0.792 1
1 102 . 16 1 1 A 10 10 ILE H H 10 8.073 8.181 -0.108 1
1 103 . 16 1 1 A 10 10 ILE HA H 10 3.305 3.499 -0.194 1
1 113 . 16 1 1 A 10 10 ILE C C 10 177.308 178.078 -0.770 1
1 114 . 16 1 1 A 10 10 ILE CA C 10 66.704 65.329 1.375 1
1 115 . 16 1 1 A 10 10 ILE CB C 10 37.840 37.713 0.127 1
1 119 . 16 1 1 A 10 10 ILE N N 10 119.219 119.942 -0.723 1
1 120 . 16 1 1 A 11 11 SER H H 11 7.861 8.499 -0.638 1
1 121 . 16 1 1 A 11 11 SER HA H 11 4.250 4.171 0.079 1
1 124 . 16 1 1 A 11 11 SER C C 11 176.918 177.748 -0.830 1
1 125 . 16 1 1 A 11 11 SER CA C 11 61.911 61.715 0.196 1
1 126 . 16 1 1 A 11 11 SER CB C 11 62.998 62.285 0.713 1
1 127 . 16 1 1 A 11 11 SER N N 11 113.959 114.572 -0.613 1
1 128 . 16 1 1 A 12 12 ILE H H 12 8.250 7.619 0.631 1
1 129 . 16 1 1 A 12 12 ILE HA H 12 3.801 3.622 0.179 1
1 139 . 16 1 1 A 12 12 ILE C C 12 178.130 177.825 0.305 1
1 140 . 16 1 1 A 12 12 ILE CA C 12 65.023 64.859 0.164 1
1 141 . 16 1 1 A 12 12 ILE CB C 12 38.195 37.735 0.460 1
1 145 . 16 1 1 A 12 12 ILE N N 12 123.767 123.025 0.742 1
1 146 . 16 1 1 A 13 13 VAL H H 13 8.308 8.171 0.137 1
1 147 . 16 1 1 A 13 13 VAL HA H 13 3.435 3.453 -0.018 1
1 155 . 16 1 1 A 13 13 VAL C C 13 177.283 177.955 -0.672 1
1 156 . 16 1 1 A 13 13 VAL CA C 13 67.693 67.119 0.574 1
1 157 . 16 1 1 A 13 13 VAL CB C 13 31.139 31.566 -0.427 1
1 160 . 16 1 1 A 13 13 VAL N N 13 120.066 119.888 0.178 1
1 161 . 16 1 1 A 14 14 GLN H H 14 8.612 8.288 0.324 1
1 162 . 16 1 1 A 14 14 GLN HA H 14 3.831 4.022 -0.191 1
1 169 . 16 1 1 A 14 14 GLN C C 14 178.256 178.448 -0.192 1
1 170 . 16 1 1 A 14 14 GLN CA C 14 59.660 59.225 0.435 1
1 171 . 16 1 1 A 14 14 GLN CB C 14 29.456 28.061 1.395 1
1 174 . 16 1 1 A 14 14 GLN N N 14 118.099 119.457 -1.358 1
1 176 . 16 1 1 A 15 15 GLU H H 15 8.378 8.000 0.378 1
1 177 . 16 1 1 A 15 15 GLU HA H 15 4.110 4.090 0.020 1
1 182 . 16 1 1 A 15 15 GLU C C 15 179.659 178.765 0.894 1
1 183 . 16 1 1 A 15 15 GLU CA C 15 59.476 59.160 0.316 1
1 184 . 16 1 1 A 15 15 GLU CB C 15 29.725 29.211 0.514 1
1 186 . 16 1 1 A 15 15 GLU N N 15 118.580 119.337 -0.757 1
1 187 . 16 1 1 A 16 16 ARG H H 16 8.439 8.171 0.268 1
1 188 . 16 1 1 A 16 16 ARG HA H 16 4.157 4.097 0.060 1
1 196 . 16 1 1 A 16 16 ARG C C 16 179.276 179.256 0.020 1
1 197 . 16 1 1 A 16 16 ARG CA C 16 58.141 59.839 -1.698 1
1 198 . 16 1 1 A 16 16 ARG CB C 16 29.434 30.001 -0.567 1
1 201 . 16 1 1 A 16 16 ARG N N 16 118.688 118.845 -0.157 1
1 203 . 16 1 1 A 17 17 GLN H H 17 8.861 8.005 0.856 1
1 204 . 16 1 1 A 17 17 GLN HA H 17 4.236 4.049 0.187 1
1 211 . 16 1 1 A 17 17 GLN C C 17 178.736 178.931 -0.195 1
1 212 . 16 1 1 A 17 17 GLN CA C 17 59.683 58.826 0.857 1
1 213 . 16 1 1 A 17 17 GLN CB C 17 29.960 28.402 1.558 1
1 216 . 16 1 1 A 17 17 GLN N N 17 120.427 118.717 1.710 1
1 218 . 16 1 1 A 18 18 ASN H H 18 8.017 8.372 -0.355 1
1 219 . 16 1 1 A 18 18 ASN HA H 18 4.605 4.538 0.067 1
1 224 . 16 1 1 A 18 18 ASN C C 18 177.906 178.575 -0.669 1
1 225 . 16 1 1 A 18 18 ASN CA C 18 55.375 56.131 -0.756 1
1 226 . 16 1 1 A 18 18 ASN CB C 18 38.383 37.849 0.534 1
1 228 . 16 1 1 A 18 18 ASN N N 18 117.033 117.874 -0.841 1
1 230 . 16 1 1 A 19 19 MET H H 19 7.994 7.735 0.259 1
1 231 . 16 1 1 A 19 19 MET HA H 19 4.372 4.249 0.123 1
1 236 . 16 1 1 A 19 19 MET C C 19 176.518 175.723 0.795 1
1 237 . 16 1 1 A 19 19 MET CA C 19 57.623 58.393 -0.770 1
1 238 . 16 1 1 A 19 19 MET CB C 19 33.248 33.012 0.236 1
1 240 . 16 1 1 A 19 19 MET N N 19 119.320 117.851 1.469 1
1 241 . 16 1 1 A 20 20 ASP H H 20 7.800 8.010 -0.210 1
1 242 . 16 1 1 A 20 20 ASP HA H 20 4.990 5.127 -0.137 1
1 245 . 16 1 1 A 20 20 ASP C C 20 176.082 174.757 1.325 1
1 246 . 16 1 1 A 20 20 ASP CA C 20 53.796 52.596 1.200 1
1 247 . 16 1 1 A 20 20 ASP CB C 20 40.409 43.170 -2.761 1
1 248 . 16 1 1 A 20 20 ASP N N 20 119.127 118.381 0.746 1
1 249 . 16 1 1 A 21 21 ASP H H 21 8.136 8.906 -0.770 1
1 250 . 16 1 1 A 21 21 ASP HA H 21 4.497 4.243 0.254 1
1 253 . 16 1 1 A 21 21 ASP C C 21 176.264 177.049 -0.785 1
1 254 . 16 1 1 A 21 21 ASP CA C 21 55.508 55.920 -0.412 1
1 255 . 16 1 1 A 21 21 ASP CB C 21 40.063 40.100 -0.037 1
1 256 . 16 1 1 A 21 21 ASP N N 21 118.276 124.263 -5.987 1
1 257 . 16 1 1 A 22 22 GLY H H 22 8.728 8.523 0.205 1
1 258 . 16 1 1 A 22 22 GLY HA2 H 22 4.189 3.911 0.278 1
1 259 . 16 1 1 A 22 22 GLY HA3 H 22 3.683 3.914 -0.231 1
1 260 . 16 1 1 A 22 22 GLY C C 22 174.304 175.043 -0.739 1
1 261 . 16 1 1 A 22 22 GLY CA C 22 45.629 46.486 -0.857 1
1 262 . 16 1 1 A 22 22 GLY N N 22 105.878 112.885 -7.007 1
1 263 . 16 1 1 A 23 23 ALA H H 23 7.473 7.829 -0.356 1
1 264 . 16 1 1 A 23 23 ALA HA H 23 4.519 4.372 0.147 1
1 268 . 16 1 1 A 23 23 ALA C C 23 174.065 176.864 -2.799 1
1 269 . 16 1 1 A 23 23 ALA CA C 23 51.142 50.929 0.213 1
1 270 . 16 1 1 A 23 23 ALA CB C 23 18.283 19.536 -1.253 1
1 271 . 16 1 1 A 23 23 ALA N N 23 125.323 123.298 2.025 1
1 272 . 16 1 1 A 24 24 PRO HA H 24 4.590 4.945 -0.355 1
1 279 . 16 1 1 A 24 24 PRO C C 24 175.253 176.663 -1.410 1
1 280 . 16 1 1 A 24 24 PRO CA C 24 62.186 62.056 0.130 1
1 281 . 16 1 1 A 24 24 PRO CB C 24 32.931 32.225 0.706 1
1 284 . 16 1 1 A 25 25 VAL H H 25 9.334 8.798 0.536 1
1 285 . 16 1 1 A 25 25 VAL HA H 25 4.378 4.218 0.160 1
1 293 . 16 1 1 A 25 25 VAL C C 25 176.439 175.831 0.608 1
1 294 . 16 1 1 A 25 25 VAL CA C 25 61.482 62.659 -1.177 1
1 295 . 16 1 1 A 25 25 VAL CB C 25 34.781 32.385 2.396 1
1 298 . 16 1 1 A 25 25 VAL N N 25 120.408 122.831 -2.423 1
1 299 . 16 1 1 A 26 26 LYS H H 26 9.300 9.010 0.290 1
1 300 . 16 1 1 A 26 26 LYS HA H 26 4.982 4.600 0.382 1
1 309 . 16 1 1 A 26 26 LYS C C 26 179.008 177.864 1.144 1
1 310 . 16 1 1 A 26 26 LYS CA C 26 56.908 55.825 1.083 1
1 311 . 16 1 1 A 26 26 LYS CB C 26 34.071 33.420 0.651 1
1 315 . 16 1 1 A 26 26 LYS N N 26 126.177 125.817 0.360 1
1 316 . 16 1 1 A 27 27 THR H H 27 8.618 8.900 -0.282 1
1 317 . 16 1 1 A 27 27 THR HA H 27 3.662 4.032 -0.370 1
1 322 . 16 1 1 A 27 27 THR C C 27 176.442 176.447 -0.005 1
1 323 . 16 1 1 A 27 27 THR CA C 27 67.591 65.834 1.757 1
1 324 . 16 1 1 A 27 27 THR CB C 27 68.868 68.858 0.010 1
1 326 . 16 1 1 A 27 27 THR N N 27 119.020 117.779 1.241 1
1 327 . 16 1 1 A 28 28 ARG H H 28 9.288 8.154 1.134 1
1 328 . 16 1 1 A 28 28 ARG HA H 28 3.879 4.104 -0.225 1
1 335 . 16 1 1 A 28 28 ARG C C 28 176.884 178.874 -1.990 1
1 336 . 16 1 1 A 28 28 ARG CA C 28 59.431 59.577 -0.146 1
1 337 . 16 1 1 A 28 28 ARG CB C 28 29.953 30.177 -0.224 1
1 340 . 16 1 1 A 28 28 ARG N N 28 119.100 120.976 -1.876 1
1 341 . 16 1 1 A 29 29 ASP H H 29 6.907 8.264 -1.357 1
1 342 . 16 1 1 A 29 29 ASP HA H 29 4.550 4.287 0.263 1
1 345 . 16 1 1 A 29 29 ASP C C 29 179.050 178.938 0.112 1
1 346 . 16 1 1 A 29 29 ASP CA C 29 57.262 57.210 0.052 1
1 347 . 16 1 1 A 29 29 ASP CB C 29 40.191 40.227 -0.036 1
1 348 . 16 1 1 A 29 29 ASP N N 29 117.490 119.509 -2.019 1
1 349 . 16 1 1 A 30 30 ILE H H 30 7.554 7.708 -0.154 1
1 350 . 16 1 1 A 30 30 ILE HA H 30 3.595 3.503 0.092 1
1 360 . 16 1 1 A 30 30 ILE C C 30 176.907 177.846 -0.939 1
1 361 . 16 1 1 A 30 30 ILE CA C 30 65.002 65.840 -0.838 1
1 362 . 16 1 1 A 30 30 ILE CB C 30 37.999 37.892 0.107 1
1 366 . 16 1 1 A 30 30 ILE N N 30 120.978 120.567 0.411 1
1 367 . 16 1 1 A 31 31 ALA H H 31 8.269 8.029 0.240 1
1 368 . 16 1 1 A 31 31 ALA HA H 31 3.720 3.925 -0.205 1
1 372 . 16 1 1 A 31 31 ALA C C 31 179.170 178.924 0.246 1
1 373 . 16 1 1 A 31 31 ALA CA C 31 56.354 55.809 0.545 1
1 374 . 16 1 1 A 31 31 ALA CB C 31 17.843 18.324 -0.481 1
1 375 . 16 1 1 A 31 31 ALA N N 31 121.171 121.820 -0.649 1
1 376 . 16 1 1 A 32 32 ASP H H 32 8.293 8.443 -0.150 1
1 377 . 16 1 1 A 32 32 ASP HA H 32 4.422 4.357 0.065 1
1 380 . 16 1 1 A 32 32 ASP C C 32 179.136 178.073 1.063 1
1 381 . 16 1 1 A 32 32 ASP CA C 32 57.109 57.171 -0.062 1
1 382 . 16 1 1 A 32 32 ASP CB C 32 40.523 41.833 -1.310 1
1 383 . 16 1 1 A 32 32 ASP N N 32 116.467 117.961 -1.494 1
1 384 . 16 1 1 A 33 33 ALA H H 33 7.536 8.080 -0.544 1
1 385 . 16 1 1 A 33 33 ALA HA H 33 4.222 4.179 0.043 1
1 389 . 16 1 1 A 33 33 ALA C C 33 179.056 179.851 -0.795 1
1 390 . 16 1 1 A 33 33 ALA CA C 33 54.469 54.769 -0.300 1
1 391 . 16 1 1 A 33 33 ALA CB C 33 19.085 18.335 0.750 1
1 392 . 16 1 1 A 33 33 ALA N N 33 120.859 120.799 0.060 1
1 393 . 16 1 1 A 34 34 ALA H H 34 8.296 7.801 0.495 1
1 394 . 16 1 1 A 34 34 ALA HA H 34 4.101 4.260 -0.159 1
1 398 . 16 1 1 A 34 34 ALA C C 34 176.912 177.749 -0.837 1
1 399 . 16 1 1 A 34 34 ALA CA C 34 52.380 52.286 0.094 1
1 400 . 16 1 1 A 34 34 ALA CB C 34 18.817 19.386 -0.569 1
1 401 . 16 1 1 A 34 34 ALA N N 34 118.203 117.502 0.701 1
1 402 . 16 1 1 A 35 35 GLY H H 35 7.911 8.011 -0.100 1
1 403 . 16 1 1 A 35 35 GLY HA2 H 35 3.968 3.898 0.070 1
1 404 . 16 1 1 A 35 35 GLY HA3 H 35 3.968 3.904 0.064 1
1 405 . 16 1 1 A 35 35 GLY C C 35 174.374 174.062 0.312 1
1 406 . 16 1 1 A 35 35 GLY CA C 35 46.388 45.708 0.680 1
1 407 . 16 1 1 A 35 35 GLY N N 35 107.752 107.223 0.529 1
1 408 . 16 1 1 A 36 36 LEU H H 36 7.758 7.703 0.055 1
1 409 . 16 1 1 A 36 36 LEU HA H 36 4.887 4.748 0.139 1
1 419 . 16 1 1 A 36 36 LEU C C 36 175.941 175.707 0.234 1
1 420 . 16 1 1 A 36 36 LEU CA C 36 52.443 53.269 -0.826 1
1 421 . 16 1 1 A 36 36 LEU CB C 36 47.885 43.289 4.596 1
1 425 . 16 1 1 A 36 36 LEU N N 36 118.719 121.787 -3.068 1
1 426 . 16 1 1 A 37 37 SER H H 37 8.603 8.452 0.151 1
1 427 . 16 1 1 A 37 37 SER HA H 37 4.565 4.805 -0.240 1
1 430 . 16 1 1 A 37 37 SER C C 37 175.512 175.273 0.239 1
1 431 . 16 1 1 A 37 37 SER CA C 37 57.262 56.546 0.716 1
1 432 . 16 1 1 A 37 37 SER CB C 37 65.155 65.167 -0.012 1
1 433 . 16 1 1 A 37 37 SER N N 37 115.095 116.090 -0.995 1
1 434 . 16 1 1 A 38 38 ILE H H 38 8.822 8.905 -0.083 1
1 435 . 16 1 1 A 38 38 ILE HA H 38 3.650 3.739 -0.089 1
1 445 . 16 1 1 A 38 38 ILE C C 38 176.849 177.487 -0.638 1
1 446 . 16 1 1 A 38 38 ILE CA C 38 64.557 64.950 -0.393 1
1 447 . 16 1 1 A 38 38 ILE CB C 38 37.451 37.914 -0.463 1
1 451 . 16 1 1 A 38 38 ILE N N 38 122.026 127.110 -5.084 1
1 452 . 16 1 1 A 39 39 TYR H H 39 7.839 8.433 -0.594 1
1 453 . 16 1 1 A 39 39 TYR HA H 39 4.112 4.255 -0.143 1
1 460 . 16 1 1 A 39 39 TYR C C 39 177.703 177.587 0.116 1
1 461 . 16 1 1 A 39 39 TYR CA C 39 60.856 60.901 -0.045 1
1 462 . 16 1 1 A 39 39 TYR CB C 39 38.402 37.286 1.116 1
1 467 . 16 1 1 A 39 39 TYR N N 39 118.759 119.989 -1.230 1
1 468 . 16 1 1 A 40 40 GLN H H 40 7.687 7.238 0.449 1
1 469 . 16 1 1 A 40 40 GLN HA H 40 3.865 3.669 0.196 1
1 476 . 16 1 1 A 40 40 GLN C C 40 178.735 178.358 0.377 1
1 477 . 16 1 1 A 40 40 GLN CA C 40 58.089 58.481 -0.392 1
1 478 . 16 1 1 A 40 40 GLN CB C 40 29.950 28.226 1.724 1
1 481 . 16 1 1 A 40 40 GLN N N 40 116.772 120.711 -3.939 1
1 483 . 16 1 1 A 41 41 VAL H H 41 8.494 8.004 0.490 1
1 484 . 16 1 1 A 41 41 VAL HA H 41 3.835 3.549 0.286 1
1 492 . 16 1 1 A 41 41 VAL C C 41 176.977 178.080 -1.103 1
1 493 . 16 1 1 A 41 41 VAL CA C 41 66.102 66.950 -0.848 1
1 494 . 16 1 1 A 41 41 VAL CB C 41 31.105 31.328 -0.223 1
1 497 . 16 1 1 A 41 41 VAL N N 41 117.192 119.382 -2.190 1
1 498 . 16 1 1 A 42 42 ARG H H 42 8.179 8.302 -0.123 1
1 499 . 16 1 1 A 42 42 ARG HA H 42 3.708 3.917 -0.209 1
1 506 . 16 1 1 A 42 42 ARG C C 42 177.570 178.657 -1.087 1
1 507 . 16 1 1 A 42 42 ARG CA C 42 60.349 59.530 0.819 1
1 508 . 16 1 1 A 42 42 ARG CB C 42 30.047 29.859 0.188 1
1 511 . 16 1 1 A 42 42 ARG N N 42 120.574 119.650 0.924 1
1 512 . 16 1 1 A 43 43 LEU H H 43 6.982 7.830 -0.848 1
1 513 . 16 1 1 A 43 43 LEU HA H 43 3.939 3.874 0.065 1
1 523 . 16 1 1 A 43 43 LEU C C 43 180.397 178.595 1.802 1
1 524 . 16 1 1 A 43 43 LEU CA C 43 58.119 57.852 0.267 1
1 525 . 16 1 1 A 43 43 LEU CB C 43 41.294 41.867 -0.573 1
1 529 . 16 1 1 A 43 43 LEU N N 43 117.189 119.479 -2.290 1
1 530 . 16 1 1 A 44 44 TYR H H 44 7.026 7.820 -0.794 1
1 531 . 16 1 1 A 44 44 TYR HA H 44 4.253 4.228 0.025 1
1 538 . 16 1 1 A 44 44 TYR C C 44 178.411 178.189 0.222 1
1 539 . 16 1 1 A 44 44 TYR CA C 44 60.941 60.790 0.151 1
1 540 . 16 1 1 A 44 44 TYR CB C 44 38.889 37.880 1.009 1
1 545 . 16 1 1 A 44 44 TYR N N 44 117.020 117.557 -0.537 1
1 546 . 16 1 1 A 45 45 LEU H H 45 8.429 8.725 -0.296 1
1 547 . 16 1 1 A 45 45 LEU HA H 45 3.486 3.620 -0.134 1
1 557 . 16 1 1 A 45 45 LEU C C 45 178.648 179.050 -0.402 1
1 558 . 16 1 1 A 45 45 LEU CA C 45 57.915 57.569 0.346 1
1 559 . 16 1 1 A 45 45 LEU CB C 45 39.073 40.517 -1.444 1
1 563 . 16 1 1 A 45 45 LEU N N 45 119.649 119.794 -0.145 1
1 564 . 16 1 1 A 46 46 GLU H H 46 8.309 8.218 0.091 1
1 565 . 16 1 1 A 46 46 GLU HA H 46 4.286 3.955 0.331 1
1 570 . 16 1 1 A 46 46 GLU C C 46 179.577 178.963 0.614 1
1 571 . 16 1 1 A 46 46 GLU CA C 46 59.570 60.116 -0.546 1
1 572 . 16 1 1 A 46 46 GLU CB C 46 29.034 29.028 0.006 1
1 574 . 16 1 1 A 46 46 GLU N N 46 117.366 120.275 -2.909 1
1 575 . 16 1 1 A 47 47 GLN H H 47 7.493 7.725 -0.232 1
1 576 . 16 1 1 A 47 47 GLN HA H 47 4.243 4.016 0.227 1
1 583 . 16 1 1 A 47 47 GLN C C 47 178.870 178.920 -0.050 1
1 584 . 16 1 1 A 47 47 GLN CA C 47 59.581 58.974 0.607 1
1 585 . 16 1 1 A 47 47 GLN CB C 47 28.300 28.357 -0.057 1
1 588 . 16 1 1 A 47 47 GLN N N 47 119.345 118.901 0.444 1
1 590 . 16 1 1 A 48 48 LEU H H 48 8.160 8.388 -0.228 1
1 591 . 16 1 1 A 48 48 LEU HA H 48 4.211 4.023 0.188 1
1 601 . 16 1 1 A 48 48 LEU C C 48 180.111 179.107 1.004 1
1 602 . 16 1 1 A 48 48 LEU CA C 48 57.179 57.784 -0.605 1
1 603 . 16 1 1 A 48 48 LEU CB C 48 42.067 41.084 0.983 1
1 607 . 16 1 1 A 48 48 LEU N N 48 118.594 119.448 -0.854 1
1 608 . 16 1 1 A 49 49 HIS H H 49 8.864 8.438 0.426 1
1 609 . 16 1 1 A 49 49 HIS HA H 49 5.162 4.388 0.774 1
1 613 . 16 1 1 A 49 49 HIS C C 49 178.801 177.124 1.677 1
1 614 . 16 1 1 A 49 49 HIS CA C 49 58.397 59.550 -1.153 1
1 615 . 16 1 1 A 49 49 HIS CB C 49 29.631 29.817 -0.186 1
1 617 . 16 1 1 A 49 49 HIS N N 49 122.537 118.094 4.443 1
1 618 . 16 1 1 A 50 50 ASP H H 50 8.683 8.354 0.329 1
1 619 . 16 1 1 A 50 50 ASP HA H 50 4.356 4.297 0.059 1
1 622 . 16 1 1 A 50 50 ASP C C 50 178.474 178.231 0.243 1
1 623 . 16 1 1 A 50 50 ASP CA C 50 57.744 57.346 0.398 1
1 624 . 16 1 1 A 50 50 ASP CB C 50 40.575 41.248 -0.673 1
1 625 . 16 1 1 A 50 50 ASP N N 50 123.169 118.607 4.562 1
1 626 . 16 1 1 A 51 51 VAL H H 51 7.606 7.757 -0.151 1
1 627 . 16 1 1 A 51 51 VAL HA H 51 4.514 4.223 0.291 1
1 635 . 16 1 1 A 51 51 VAL C C 51 176.862 175.787 1.075 1
1 636 . 16 1 1 A 51 51 VAL CA C 51 61.590 61.531 0.059 1
1 637 . 16 1 1 A 51 51 VAL CB C 51 31.423 31.680 -0.257 1
1 640 . 16 1 1 A 51 51 VAL N N 51 109.266 110.757 -1.491 1
1 641 . 16 1 1 A 52 52 GLY H H 52 7.696 7.767 -0.071 1
1 642 . 16 1 1 A 52 52 GLY HA2 H 52 4.172 3.938 0.234 1
1 643 . 16 1 1 A 52 52 GLY HA3 H 52 3.938 3.966 -0.028 1
1 644 . 16 1 1 A 52 52 GLY C C 52 174.276 174.772 -0.496 1
1 645 . 16 1 1 A 52 52 GLY CA C 52 46.228 46.612 -0.384 1
1 646 . 16 1 1 A 52 52 GLY N N 52 108.681 111.025 -2.344 1
1 647 . 16 1 1 A 53 53 VAL H H 53 8.046 8.317 -0.271 1
1 648 . 16 1 1 A 53 53 VAL HA H 53 4.079 4.221 -0.142 1
1 656 . 16 1 1 A 53 53 VAL C C 53 175.949 175.444 0.505 1
1 657 . 16 1 1 A 53 53 VAL CA C 53 64.063 63.610 0.453 1
1 658 . 16 1 1 A 53 53 VAL CB C 53 33.160 33.896 -0.736 1
1 661 . 16 1 1 A 53 53 VAL N N 53 117.892 116.644 1.248 1
1 662 . 16 1 1 A 54 54 LEU H H 54 6.835 7.374 -0.539 1
1 663 . 16 1 1 A 54 54 LEU HA H 54 5.348 5.052 0.296 1
1 673 . 16 1 1 A 54 54 LEU C C 54 175.713 175.301 0.412 1
1 674 . 16 1 1 A 54 54 LEU CA C 54 52.194 53.276 -1.082 1
1 675 . 16 1 1 A 54 54 LEU CB C 54 46.733 45.539 1.194 1
1 679 . 16 1 1 A 54 54 LEU N N 54 114.848 117.818 -2.970 1
1 680 . 16 1 1 A 55 55 GLU H H 55 9.549 9.460 0.089 1
1 681 . 16 1 1 A 55 55 GLU HA H 55 4.826 5.336 -0.510 1
1 686 . 16 1 1 A 55 55 GLU C C 55 174.661 174.895 -0.234 1
1 687 . 16 1 1 A 55 55 GLU CA C 55 54.637 54.900 -0.263 1
1 688 . 16 1 1 A 55 55 GLU CB C 55 32.891 33.121 -0.230 1
1 690 . 16 1 1 A 55 55 GLU N N 55 121.431 123.215 -1.784 1
1 691 . 16 1 1 A 56 56 LYS H H 56 8.513 8.643 -0.130 1
1 692 . 16 1 1 A 56 56 LYS HA H 56 4.151 4.278 -0.127 1
1 701 . 16 1 1 A 56 56 LYS C C 56 176.270 174.613 1.657 1
1 702 . 16 1 1 A 56 56 LYS CA C 56 54.890 55.284 -0.394 1
1 703 . 16 1 1 A 56 56 LYS CB C 56 33.162 32.136 1.026 1
1 707 . 16 1 1 A 56 56 LYS N N 56 126.539 127.542 -1.003 1
1 708 . 16 1 1 A 57 57 VAL H H 57 8.279 8.328 -0.049 1
1 709 . 16 1 1 A 57 57 VAL HA H 57 3.820 4.290 -0.470 1
1 717 . 16 1 1 A 57 57 VAL C C 57 175.108 175.633 -0.525 1
1 718 . 16 1 1 A 57 57 VAL CA C 57 62.834 62.757 0.077 1
1 719 . 16 1 1 A 57 57 VAL CB C 57 32.549 31.142 1.407 1
1 722 . 16 1 1 A 57 57 VAL N N 57 126.540 126.910 -0.370 1
1 723 . 16 1 1 A 58 58 ASN H H 58 8.383 8.898 -0.515 1
1 724 . 16 1 1 A 58 58 ASN HA H 58 4.612 5.481 -0.869 1
1 729 . 16 1 1 A 58 58 ASN C C 58 174.772 173.501 1.271 1
1 730 . 16 1 1 A 58 58 ASN CA C 58 52.575 51.183 1.392 1
1 731 . 16 1 1 A 58 58 ASN CB C 58 38.502 41.901 -3.399 1
1 733 . 16 1 1 A 58 58 ASN N N 58 121.767 123.725 -1.958 1
1 735 . 16 1 1 A 59 59 ALA H H 59 8.165 8.467 -0.302 1
1 736 . 16 1 1 A 59 59 ALA HA H 59 4.251 4.457 -0.206 1
1 740 . 16 1 1 A 59 59 ALA C C 59 177.478 177.428 0.050 1
1 741 . 16 1 1 A 59 59 ALA CA C 59 52.490 51.395 1.095 1
1 742 . 16 1 1 A 59 59 ALA CB C 59 19.724 17.629 2.095 1
1 743 . 16 1 1 A 59 59 ALA N N 59 125.082 126.358 -1.276 1
1 744 . 16 1 1 A 60 60 GLY H H 60 8.291 8.559 -0.268 1
1 745 . 16 1 1 A 60 60 GLY HA2 H 60 4.165 3.997 0.168 1
1 746 . 16 1 1 A 60 60 GLY HA3 H 60 3.853 3.999 -0.146 1
1 747 . 16 1 1 A 60 60 GLY C C 60 174.171 173.276 0.895 1
1 748 . 16 1 1 A 60 60 GLY CA C 60 44.994 45.014 -0.020 1
1 749 . 16 1 1 A 60 60 GLY N N 60 108.518 111.966 -3.448 1
1 750 . 16 1 1 A 61 61 LYS H H 61 8.189 8.327 -0.138 1
1 751 . 16 1 1 A 61 61 LYS HA H 61 4.320 4.459 -0.139 1
1 760 . 16 1 1 A 61 61 LYS C C 61 177.712 177.341 0.371 1
1 761 . 16 1 1 A 61 61 LYS CA C 61 56.832 56.904 -0.072 1
1 762 . 16 1 1 A 61 61 LYS CB C 61 32.641 33.106 -0.465 1
1 766 . 16 1 1 A 61 61 LYS N N 61 120.532 123.796 -3.264 1
1 767 . 16 1 1 A 62 62 GLY H H 62 8.767 9.025 -0.258 1
1 768 . 16 1 1 A 62 62 GLY HA2 H 62 4.021 3.860 0.161 1
1 769 . 16 1 1 A 62 62 GLY HA3 H 62 3.849 3.863 -0.014 1
1 770 . 16 1 1 A 62 62 GLY C C 62 173.782 173.703 0.079 1
1 771 . 16 1 1 A 62 62 GLY CA C 62 45.844 46.747 -0.903 1
1 772 . 16 1 1 A 62 62 GLY N N 62 111.547 114.473 -2.926 1
1 773 . 16 1 1 A 63 63 VAL H H 63 7.379 7.583 -0.204 1
1 774 . 16 1 1 A 63 63 VAL HA H 63 4.591 4.823 -0.232 1
1 782 . 16 1 1 A 63 63 VAL C C 63 174.262 173.447 0.815 1
1 783 . 16 1 1 A 63 63 VAL CA C 63 59.292 58.071 1.221 1
1 784 . 16 1 1 A 63 63 VAL CB C 63 32.726 33.817 -1.091 1
1 787 . 16 1 1 A 63 63 VAL N N 63 117.546 113.960 3.586 1
1 788 . 16 1 1 A 64 64 PRO HA H 64 4.458 4.468 -0.010 1
1 795 . 16 1 1 A 64 64 PRO C C 64 177.166 176.552 0.614 1
1 796 . 16 1 1 A 64 64 PRO CA C 64 63.661 63.588 0.073 1
1 797 . 16 1 1 A 64 64 PRO CB C 64 32.321 32.171 0.150 1
1 800 . 16 1 1 A 65 65 GLY H H 65 8.463 8.642 -0.179 1
1 801 . 16 1 1 A 65 65 GLY HA2 H 65 3.882 3.789 0.093 1
1 802 . 16 1 1 A 65 65 GLY HA3 H 65 3.602 3.799 -0.197 1
1 803 . 16 1 1 A 65 65 GLY C C 65 172.406 172.648 -0.242 1
1 804 . 16 1 1 A 65 65 GLY CA C 65 45.933 45.211 0.722 1
1 805 . 16 1 1 A 65 65 GLY N N 65 109.819 109.326 0.493 1
1 806 . 16 1 1 A 66 66 LEU H H 66 7.534 9.082 -1.548 1
1 807 . 16 1 1 A 66 66 LEU HA H 66 4.940 5.107 -0.167 1
1 817 . 16 1 1 A 66 66 LEU C C 66 176.237 176.071 0.166 1
1 818 . 16 1 1 A 66 66 LEU CA C 66 53.687 53.290 0.397 1
1 819 . 16 1 1 A 66 66 LEU CB C 66 46.108 44.398 1.710 1
1 823 . 16 1 1 A 66 66 LEU N N 66 122.249 126.232 -3.983 1
1 824 . 16 1 1 A 67 67 TRP H H 67 8.916 9.348 -0.432 1
1 825 . 16 1 1 A 67 67 TRP HA H 67 5.526 5.312 0.214 1
1 834 . 16 1 1 A 67 67 TRP C C 67 175.670 174.663 1.007 1
1 835 . 16 1 1 A 67 67 TRP CA C 67 56.241 55.517 0.724 1
1 836 . 16 1 1 A 67 67 TRP CB C 67 33.314 32.110 1.204 1
1 842 . 16 1 1 A 67 67 TRP N N 67 121.160 121.483 -0.323 1
1 844 . 16 1 1 A 68 68 ARG H H 68 8.772 9.511 -0.739 1
1 845 . 16 1 1 A 68 68 ARG HA H 68 4.832 5.053 -0.221 1
1 853 . 16 1 1 A 68 68 ARG C C 68 174.720 176.008 -1.288 1
1 854 . 16 1 1 A 68 68 ARG CA C 68 54.690 53.810 0.880 1
1 855 . 16 1 1 A 68 68 ARG CB C 68 35.176 33.652 1.524 1
1 858 . 16 1 1 A 68 68 ARG N N 68 117.471 125.152 -7.681 1
1 860 . 16 1 1 A 69 69 LEU H H 69 9.355 8.656 0.699 1
1 861 . 16 1 1 A 69 69 LEU HA H 69 4.557 4.944 -0.387 1
1 871 . 16 1 1 A 69 69 LEU C C 69 177.180 176.540 0.640 1
1 872 . 16 1 1 A 69 69 LEU CA C 69 55.780 54.005 1.775 1
1 873 . 16 1 1 A 69 69 LEU CB C 69 42.736 43.465 -0.729 1
1 877 . 16 1 1 A 69 69 LEU N N 69 125.211 122.283 2.928 1
1 878 . 16 1 1 A 70 70 LEU H H 70 8.058 8.685 -0.627 1
1 879 . 16 1 1 A 70 70 LEU HA H 70 4.364 5.123 -0.759 1
1 889 . 16 1 1 A 70 70 LEU C C 70 176.808 175.780 1.028 1
1 890 . 16 1 1 A 70 70 LEU CA C 70 55.257 53.038 2.219 1
1 891 . 16 1 1 A 70 70 LEU CB C 70 42.413 45.556 -3.143 1
1 895 . 16 1 1 A 70 70 LEU N N 70 125.525 119.526 5.999 1
1 1 . 17 1 1 A 2 2 SER HA H 2 4.126 4.671 -0.545 1
1 4 . 17 1 1 A 2 2 SER CA C 2 57.564 59.791 -2.227 1
1 5 . 17 1 1 A 2 2 SER CB C 2 63.953 64.660 -0.707 1
1 6 . 17 1 1 A 3 3 GLU HA H 3 4.408 4.774 -0.366 1
1 11 . 17 1 1 A 3 3 GLU C C 3 176.658 176.538 0.120 1
1 12 . 17 1 1 A 3 3 GLU CA C 3 56.802 54.611 2.191 1
1 13 . 17 1 1 A 3 3 GLU CB C 3 30.674 30.664 0.010 1
1 15 . 17 1 1 A 4 4 SER H H 4 8.650 8.943 -0.293 1
1 16 . 17 1 1 A 4 4 SER HA H 4 4.463 4.405 0.058 1
1 19 . 17 1 1 A 4 4 SER C C 4 175.949 174.381 1.568 1
1 20 . 17 1 1 A 4 4 SER CA C 4 58.557 58.688 -0.131 1
1 21 . 17 1 1 A 4 4 SER CB C 4 63.834 61.613 2.221 1
1 22 . 17 1 1 A 4 4 SER N N 4 118.042 119.298 -1.256 1
1 23 . 17 1 1 A 5 5 ILE H H 5 8.404 8.300 0.104 1
1 24 . 17 1 1 A 5 5 ILE HA H 5 3.902 4.373 -0.471 1
1 34 . 17 1 1 A 5 5 ILE C C 5 176.608 177.789 -1.181 1
1 35 . 17 1 1 A 5 5 ILE CA C 5 62.662 62.234 0.428 1
1 36 . 17 1 1 A 5 5 ILE CB C 5 37.622 39.416 -1.794 1
1 40 . 17 1 1 A 5 5 ILE N N 5 124.711 126.114 -1.403 1
1 41 . 17 1 1 A 6 6 VAL H H 6 7.602 7.687 -0.085 1
1 42 . 17 1 1 A 6 6 VAL HA H 6 3.293 3.481 -0.188 1
1 50 . 17 1 1 A 6 6 VAL C C 6 177.088 178.253 -1.165 1
1 51 . 17 1 1 A 6 6 VAL CA C 6 67.180 66.129 1.051 1
1 52 . 17 1 1 A 6 6 VAL CB C 6 31.517 31.485 0.032 1
1 55 . 17 1 1 A 6 6 VAL N N 6 119.974 120.487 -0.513 1
1 56 . 17 1 1 A 7 7 THR H H 7 7.515 7.907 -0.392 1
1 57 . 17 1 1 A 7 7 THR HA H 7 3.823 3.827 -0.004 1
1 62 . 17 1 1 A 7 7 THR C C 7 176.978 176.287 0.691 1
1 63 . 17 1 1 A 7 7 THR CA C 7 66.257 67.030 -0.773 1
1 64 . 17 1 1 A 7 7 THR CB C 7 68.410 68.621 -0.211 1
1 66 . 17 1 1 A 7 7 THR N N 7 114.177 116.554 -2.377 1
1 67 . 17 1 1 A 8 8 LYS H H 8 7.807 7.851 -0.044 1
1 68 . 17 1 1 A 8 8 LYS HA H 8 4.066 3.979 0.087 1
1 77 . 17 1 1 A 8 8 LYS C C 8 178.733 178.445 0.288 1
1 78 . 17 1 1 A 8 8 LYS CA C 8 59.338 59.908 -0.570 1
1 79 . 17 1 1 A 8 8 LYS CB C 8 32.002 32.277 -0.275 1
1 83 . 17 1 1 A 8 8 LYS N N 8 123.387 120.629 2.758 1
1 84 . 17 1 1 A 9 9 ILE H H 9 8.288 8.002 0.286 1
1 85 . 17 1 1 A 9 9 ILE HA H 9 3.421 3.574 -0.153 1
1 95 . 17 1 1 A 9 9 ILE C C 9 177.187 178.280 -1.093 1
1 96 . 17 1 1 A 9 9 ILE CA C 9 65.772 65.660 0.112 1
1 97 . 17 1 1 A 9 9 ILE CB C 9 37.183 37.831 -0.648 1
1 101 . 17 1 1 A 9 9 ILE N N 9 119.543 118.767 0.776 1
1 102 . 17 1 1 A 10 10 ILE H H 10 8.073 8.358 -0.285 1
1 103 . 17 1 1 A 10 10 ILE HA H 10 3.305 3.504 -0.199 1
1 113 . 17 1 1 A 10 10 ILE C C 10 177.308 178.331 -1.023 1
1 114 . 17 1 1 A 10 10 ILE CA C 10 66.704 65.358 1.346 1
1 115 . 17 1 1 A 10 10 ILE CB C 10 37.840 37.970 -0.130 1
1 119 . 17 1 1 A 10 10 ILE N N 10 119.219 120.801 -1.582 1
1 120 . 17 1 1 A 11 11 SER H H 11 7.861 8.069 -0.208 1
1 121 . 17 1 1 A 11 11 SER HA H 11 4.250 4.183 0.067 1
1 124 . 17 1 1 A 11 11 SER C C 11 176.918 177.532 -0.614 1
1 125 . 17 1 1 A 11 11 SER CA C 11 61.911 61.422 0.489 1
1 126 . 17 1 1 A 11 11 SER CB C 11 62.998 62.855 0.143 1
1 127 . 17 1 1 A 11 11 SER N N 11 113.959 115.602 -1.643 1
1 128 . 17 1 1 A 12 12 ILE H H 12 8.250 7.818 0.432 1
1 129 . 17 1 1 A 12 12 ILE HA H 12 3.801 3.663 0.138 1
1 139 . 17 1 1 A 12 12 ILE C C 12 178.130 177.937 0.193 1
1 140 . 17 1 1 A 12 12 ILE CA C 12 65.023 64.745 0.278 1
1 141 . 17 1 1 A 12 12 ILE CB C 12 38.195 37.795 0.400 1
1 145 . 17 1 1 A 12 12 ILE N N 12 123.767 122.357 1.410 1
1 146 . 17 1 1 A 13 13 VAL H H 13 8.308 8.066 0.242 1
1 147 . 17 1 1 A 13 13 VAL HA H 13 3.435 3.489 -0.054 1
1 155 . 17 1 1 A 13 13 VAL C C 13 177.283 177.943 -0.660 1
1 156 . 17 1 1 A 13 13 VAL CA C 13 67.693 67.101 0.592 1
1 157 . 17 1 1 A 13 13 VAL CB C 13 31.139 31.596 -0.457 1
1 160 . 17 1 1 A 13 13 VAL N N 13 120.066 119.792 0.274 1
1 161 . 17 1 1 A 14 14 GLN H H 14 8.612 8.133 0.479 1
1 162 . 17 1 1 A 14 14 GLN HA H 14 3.831 4.048 -0.217 1
1 169 . 17 1 1 A 14 14 GLN C C 14 178.256 178.422 -0.166 1
1 170 . 17 1 1 A 14 14 GLN CA C 14 59.660 59.326 0.334 1
1 171 . 17 1 1 A 14 14 GLN CB C 14 29.456 28.045 1.411 1
1 174 . 17 1 1 A 14 14 GLN N N 14 118.099 119.561 -1.462 1
1 176 . 17 1 1 A 15 15 GLU H H 15 8.378 8.425 -0.047 1
1 177 . 17 1 1 A 15 15 GLU HA H 15 4.110 4.044 0.066 1
1 182 . 17 1 1 A 15 15 GLU C C 15 179.659 178.720 0.939 1
1 183 . 17 1 1 A 15 15 GLU CA C 15 59.476 59.557 -0.081 1
1 184 . 17 1 1 A 15 15 GLU CB C 15 29.725 28.874 0.851 1
1 186 . 17 1 1 A 15 15 GLU N N 15 118.580 119.121 -0.541 1
1 187 . 17 1 1 A 16 16 ARG H H 16 8.439 8.355 0.084 1
1 188 . 17 1 1 A 16 16 ARG HA H 16 4.157 4.023 0.134 1
1 196 . 17 1 1 A 16 16 ARG C C 16 179.276 179.176 0.100 1
1 197 . 17 1 1 A 16 16 ARG CA C 16 58.141 59.633 -1.492 1
1 198 . 17 1 1 A 16 16 ARG CB C 16 29.434 29.941 -0.507 1
1 201 . 17 1 1 A 16 16 ARG N N 16 118.688 118.230 0.458 1
1 203 . 17 1 1 A 17 17 GLN H H 17 8.861 7.632 1.229 1
1 204 . 17 1 1 A 17 17 GLN HA H 17 4.236 4.117 0.119 1
1 211 . 17 1 1 A 17 17 GLN C C 17 178.736 177.971 0.765 1
1 212 . 17 1 1 A 17 17 GLN CA C 17 59.683 58.514 1.169 1
1 213 . 17 1 1 A 17 17 GLN CB C 17 29.960 28.316 1.644 1
1 216 . 17 1 1 A 17 17 GLN N N 17 120.427 118.784 1.643 1
1 218 . 17 1 1 A 18 18 ASN H H 18 8.017 8.408 -0.391 1
1 219 . 17 1 1 A 18 18 ASN HA H 18 4.605 4.475 0.130 1
1 224 . 17 1 1 A 18 18 ASN C C 18 177.906 178.397 -0.491 1
1 225 . 17 1 1 A 18 18 ASN CA C 18 55.375 56.271 -0.896 1
1 226 . 17 1 1 A 18 18 ASN CB C 18 38.383 38.169 0.214 1
1 228 . 17 1 1 A 18 18 ASN N N 18 117.033 117.923 -0.890 1
1 230 . 17 1 1 A 19 19 MET H H 19 7.994 7.824 0.170 1
1 231 . 17 1 1 A 19 19 MET HA H 19 4.372 4.316 0.056 1
1 236 . 17 1 1 A 19 19 MET C C 19 176.518 176.803 -0.285 1
1 237 . 17 1 1 A 19 19 MET CA C 19 57.623 58.475 -0.852 1
1 238 . 17 1 1 A 19 19 MET CB C 19 33.248 33.383 -0.135 1
1 240 . 17 1 1 A 19 19 MET N N 19 119.320 118.191 1.129 1
1 241 . 17 1 1 A 20 20 ASP H H 20 7.800 7.810 -0.010 1
1 242 . 17 1 1 A 20 20 ASP HA H 20 4.990 4.861 0.129 1
1 245 . 17 1 1 A 20 20 ASP C C 20 176.082 175.893 0.189 1
1 246 . 17 1 1 A 20 20 ASP CA C 20 53.796 53.493 0.303 1
1 247 . 17 1 1 A 20 20 ASP CB C 20 40.409 41.317 -0.908 1
1 248 . 17 1 1 A 20 20 ASP N N 20 119.127 116.909 2.218 1
1 249 . 17 1 1 A 21 21 ASP H H 21 8.136 8.331 -0.195 1
1 250 . 17 1 1 A 21 21 ASP HA H 21 4.497 4.471 0.026 1
1 253 . 17 1 1 A 21 21 ASP C C 21 176.264 176.188 0.076 1
1 254 . 17 1 1 A 21 21 ASP CA C 21 55.508 56.530 -1.022 1
1 255 . 17 1 1 A 21 21 ASP CB C 21 40.063 40.267 -0.204 1
1 256 . 17 1 1 A 21 21 ASP N N 21 118.276 118.272 0.004 1
1 257 . 17 1 1 A 22 22 GLY H H 22 8.728 8.222 0.506 1
1 258 . 17 1 1 A 22 22 GLY HA2 H 22 4.189 3.873 0.316 1
1 259 . 17 1 1 A 22 22 GLY HA3 H 22 3.683 3.877 -0.194 1
1 260 . 17 1 1 A 22 22 GLY C C 22 174.304 173.755 0.549 1
1 261 . 17 1 1 A 22 22 GLY CA C 22 45.629 46.801 -1.172 1
1 262 . 17 1 1 A 22 22 GLY N N 22 105.878 108.247 -2.369 1
1 263 . 17 1 1 A 23 23 ALA H H 23 7.473 7.846 -0.373 1
1 264 . 17 1 1 A 23 23 ALA HA H 23 4.519 4.692 -0.173 1
1 268 . 17 1 1 A 23 23 ALA C C 23 174.065 176.131 -2.066 1
1 269 . 17 1 1 A 23 23 ALA CA C 23 51.142 49.078 2.064 1
1 270 . 17 1 1 A 23 23 ALA CB C 23 18.283 20.256 -1.973 1
1 271 . 17 1 1 A 23 23 ALA N N 23 125.323 124.020 1.303 1
1 272 . 17 1 1 A 24 24 PRO HA H 24 4.590 4.824 -0.234 1
1 279 . 17 1 1 A 24 24 PRO C C 24 175.253 176.769 -1.516 1
1 280 . 17 1 1 A 24 24 PRO CA C 24 62.186 62.344 -0.158 1
1 281 . 17 1 1 A 24 24 PRO CB C 24 32.931 31.881 1.050 1
1 284 . 17 1 1 A 25 25 VAL H H 25 9.334 8.596 0.738 1
1 285 . 17 1 1 A 25 25 VAL HA H 25 4.378 4.195 0.183 1
1 293 . 17 1 1 A 25 25 VAL C C 25 176.439 175.883 0.556 1
1 294 . 17 1 1 A 25 25 VAL CA C 25 61.482 62.535 -1.053 1
1 295 . 17 1 1 A 25 25 VAL CB C 25 34.781 32.212 2.569 1
1 298 . 17 1 1 A 25 25 VAL N N 25 120.408 123.067 -2.659 1
1 299 . 17 1 1 A 26 26 LYS H H 26 9.300 8.648 0.652 1
1 300 . 17 1 1 A 26 26 LYS HA H 26 4.982 4.542 0.440 1
1 309 . 17 1 1 A 26 26 LYS C C 26 179.008 177.738 1.270 1
1 310 . 17 1 1 A 26 26 LYS CA C 26 56.908 55.761 1.147 1
1 311 . 17 1 1 A 26 26 LYS CB C 26 34.071 33.269 0.802 1
1 315 . 17 1 1 A 26 26 LYS N N 26 126.177 126.330 -0.153 1
1 316 . 17 1 1 A 27 27 THR H H 27 8.618 8.892 -0.274 1
1 317 . 17 1 1 A 27 27 THR HA H 27 3.662 4.073 -0.411 1
1 322 . 17 1 1 A 27 27 THR C C 27 176.442 176.481 -0.039 1
1 323 . 17 1 1 A 27 27 THR CA C 27 67.591 66.355 1.236 1
1 324 . 17 1 1 A 27 27 THR CB C 27 68.868 68.969 -0.101 1
1 326 . 17 1 1 A 27 27 THR N N 27 119.020 117.848 1.172 1
1 327 . 17 1 1 A 28 28 ARG H H 28 9.288 8.045 1.243 1
1 328 . 17 1 1 A 28 28 ARG HA H 28 3.879 4.120 -0.241 1
1 335 . 17 1 1 A 28 28 ARG C C 28 176.884 179.076 -2.192 1
1 336 . 17 1 1 A 28 28 ARG CA C 28 59.431 59.176 0.255 1
1 337 . 17 1 1 A 28 28 ARG CB C 28 29.953 29.520 0.433 1
1 340 . 17 1 1 A 28 28 ARG N N 28 119.100 120.938 -1.838 1
1 341 . 17 1 1 A 29 29 ASP H H 29 6.907 7.945 -1.038 1
1 342 . 17 1 1 A 29 29 ASP HA H 29 4.550 4.333 0.217 1
1 345 . 17 1 1 A 29 29 ASP C C 29 179.050 178.986 0.064 1
1 346 . 17 1 1 A 29 29 ASP CA C 29 57.262 57.266 -0.004 1
1 347 . 17 1 1 A 29 29 ASP CB C 29 40.191 40.632 -0.441 1
1 348 . 17 1 1 A 29 29 ASP N N 29 117.490 119.271 -1.781 1
1 349 . 17 1 1 A 30 30 ILE H H 30 7.554 7.935 -0.381 1
1 350 . 17 1 1 A 30 30 ILE HA H 30 3.595 3.836 -0.241 1
1 360 . 17 1 1 A 30 30 ILE C C 30 176.907 177.880 -0.973 1
1 361 . 17 1 1 A 30 30 ILE CA C 30 65.002 65.459 -0.457 1
1 362 . 17 1 1 A 30 30 ILE CB C 30 37.999 37.818 0.181 1
1 366 . 17 1 1 A 30 30 ILE N N 30 120.978 120.062 0.916 1
1 367 . 17 1 1 A 31 31 ALA H H 31 8.269 7.889 0.380 1
1 368 . 17 1 1 A 31 31 ALA HA H 31 3.720 4.079 -0.359 1
1 372 . 17 1 1 A 31 31 ALA C C 31 179.170 179.609 -0.439 1
1 373 . 17 1 1 A 31 31 ALA CA C 31 56.354 55.737 0.617 1
1 374 . 17 1 1 A 31 31 ALA CB C 31 17.843 18.117 -0.274 1
1 375 . 17 1 1 A 31 31 ALA N N 31 121.171 122.293 -1.122 1
1 376 . 17 1 1 A 32 32 ASP H H 32 8.293 8.440 -0.147 1
1 377 . 17 1 1 A 32 32 ASP HA H 32 4.422 4.431 -0.009 1
1 380 . 17 1 1 A 32 32 ASP C C 32 179.136 178.461 0.675 1
1 381 . 17 1 1 A 32 32 ASP CA C 32 57.109 56.972 0.137 1
1 382 . 17 1 1 A 32 32 ASP CB C 32 40.523 40.630 -0.107 1
1 383 . 17 1 1 A 32 32 ASP N N 32 116.467 118.953 -2.486 1
1 384 . 17 1 1 A 33 33 ALA H H 33 7.536 8.435 -0.899 1
1 385 . 17 1 1 A 33 33 ALA HA H 33 4.222 4.104 0.118 1
1 389 . 17 1 1 A 33 33 ALA C C 33 179.056 179.684 -0.628 1
1 390 . 17 1 1 A 33 33 ALA CA C 33 54.469 55.075 -0.606 1
1 391 . 17 1 1 A 33 33 ALA CB C 33 19.085 18.249 0.836 1
1 392 . 17 1 1 A 33 33 ALA N N 33 120.859 122.938 -2.079 1
1 393 . 17 1 1 A 34 34 ALA H H 34 8.296 7.774 0.522 1
1 394 . 17 1 1 A 34 34 ALA HA H 34 4.101 4.316 -0.215 1
1 398 . 17 1 1 A 34 34 ALA C C 34 176.912 177.954 -1.042 1
1 399 . 17 1 1 A 34 34 ALA CA C 34 52.380 52.291 0.089 1
1 400 . 17 1 1 A 34 34 ALA CB C 34 18.817 19.776 -0.959 1
1 401 . 17 1 1 A 34 34 ALA N N 34 118.203 116.918 1.285 1
1 402 . 17 1 1 A 35 35 GLY H H 35 7.911 8.306 -0.395 1
1 403 . 17 1 1 A 35 35 GLY HA2 H 35 3.968 3.961 0.007 1
1 404 . 17 1 1 A 35 35 GLY HA3 H 35 3.968 3.965 0.003 1
1 405 . 17 1 1 A 35 35 GLY C C 35 174.374 174.254 0.120 1
1 406 . 17 1 1 A 35 35 GLY CA C 35 46.388 46.601 -0.213 1
1 407 . 17 1 1 A 35 35 GLY N N 35 107.752 107.767 -0.015 1
1 408 . 17 1 1 A 36 36 LEU H H 36 7.758 7.550 0.208 1
1 409 . 17 1 1 A 36 36 LEU HA H 36 4.887 4.902 -0.015 1
1 419 . 17 1 1 A 36 36 LEU C C 36 175.941 175.053 0.888 1
1 420 . 17 1 1 A 36 36 LEU CA C 36 52.443 53.033 -0.590 1
1 421 . 17 1 1 A 36 36 LEU CB C 36 47.885 44.402 3.483 1
1 425 . 17 1 1 A 36 36 LEU N N 36 118.719 120.139 -1.420 1
1 426 . 17 1 1 A 37 37 SER H H 37 8.603 8.257 0.346 1
1 427 . 17 1 1 A 37 37 SER HA H 37 4.565 4.639 -0.074 1
1 430 . 17 1 1 A 37 37 SER C C 37 175.512 175.752 -0.240 1
1 431 . 17 1 1 A 37 37 SER CA C 37 57.262 57.521 -0.259 1
1 432 . 17 1 1 A 37 37 SER CB C 37 65.155 64.534 0.621 1
1 433 . 17 1 1 A 37 37 SER N N 37 115.095 115.697 -0.602 1
1 434 . 17 1 1 A 38 38 ILE H H 38 8.822 8.778 0.044 1
1 435 . 17 1 1 A 38 38 ILE HA H 38 3.650 3.793 -0.143 1
1 445 . 17 1 1 A 38 38 ILE C C 38 176.849 177.456 -0.607 1
1 446 . 17 1 1 A 38 38 ILE CA C 38 64.557 64.927 -0.370 1
1 447 . 17 1 1 A 38 38 ILE CB C 38 37.451 38.012 -0.561 1
1 451 . 17 1 1 A 38 38 ILE N N 38 122.026 128.619 -6.593 1
1 452 . 17 1 1 A 39 39 TYR H H 39 7.839 8.518 -0.679 1
1 453 . 17 1 1 A 39 39 TYR HA H 39 4.112 4.095 0.017 1
1 460 . 17 1 1 A 39 39 TYR C C 39 177.703 177.501 0.202 1
1 461 . 17 1 1 A 39 39 TYR CA C 39 60.856 61.240 -0.384 1
1 462 . 17 1 1 A 39 39 TYR CB C 39 38.402 38.911 -0.509 1
1 467 . 17 1 1 A 39 39 TYR N N 39 118.759 120.470 -1.711 1
1 468 . 17 1 1 A 40 40 GLN H H 40 7.687 8.342 -0.655 1
1 469 . 17 1 1 A 40 40 GLN HA H 40 3.865 3.940 -0.075 1
1 476 . 17 1 1 A 40 40 GLN C C 40 178.735 178.338 0.397 1
1 477 . 17 1 1 A 40 40 GLN CA C 40 58.089 58.921 -0.832 1
1 478 . 17 1 1 A 40 40 GLN CB C 40 29.950 29.022 0.928 1
1 481 . 17 1 1 A 40 40 GLN N N 40 116.772 118.865 -2.093 1
1 483 . 17 1 1 A 41 41 VAL H H 41 8.494 8.344 0.150 1
1 484 . 17 1 1 A 41 41 VAL HA H 41 3.835 3.663 0.172 1
1 492 . 17 1 1 A 41 41 VAL C C 41 176.977 177.699 -0.722 1
1 493 . 17 1 1 A 41 41 VAL CA C 41 66.102 67.008 -0.906 1
1 494 . 17 1 1 A 41 41 VAL CB C 41 31.105 31.489 -0.384 1
1 497 . 17 1 1 A 41 41 VAL N N 41 117.192 119.657 -2.465 1
1 498 . 17 1 1 A 42 42 ARG H H 42 8.179 8.051 0.128 1
1 499 . 17 1 1 A 42 42 ARG HA H 42 3.708 3.997 -0.289 1
1 506 . 17 1 1 A 42 42 ARG C C 42 177.570 178.337 -0.767 1
1 507 . 17 1 1 A 42 42 ARG CA C 42 60.349 59.556 0.793 1
1 508 . 17 1 1 A 42 42 ARG CB C 42 30.047 29.753 0.294 1
1 511 . 17 1 1 A 42 42 ARG N N 42 120.574 119.857 0.717 1
1 512 . 17 1 1 A 43 43 LEU H H 43 6.982 7.750 -0.768 1
1 513 . 17 1 1 A 43 43 LEU HA H 43 3.939 3.747 0.192 1
1 523 . 17 1 1 A 43 43 LEU C C 43 180.397 178.217 2.180 1
1 524 . 17 1 1 A 43 43 LEU CA C 43 58.119 57.677 0.442 1
1 525 . 17 1 1 A 43 43 LEU CB C 43 41.294 41.541 -0.247 1
1 529 . 17 1 1 A 43 43 LEU N N 43 117.189 119.712 -2.523 1
1 530 . 17 1 1 A 44 44 TYR H H 44 7.026 7.430 -0.404 1
1 531 . 17 1 1 A 44 44 TYR HA H 44 4.253 4.102 0.151 1
1 538 . 17 1 1 A 44 44 TYR C C 44 178.411 178.056 0.355 1
1 539 . 17 1 1 A 44 44 TYR CA C 44 60.941 60.926 0.015 1
1 540 . 17 1 1 A 44 44 TYR CB C 44 38.889 38.182 0.707 1
1 545 . 17 1 1 A 44 44 TYR N N 44 117.020 117.831 -0.811 1
1 546 . 17 1 1 A 45 45 LEU H H 45 8.429 8.340 0.089 1
1 547 . 17 1 1 A 45 45 LEU HA H 45 3.486 3.513 -0.027 1
1 557 . 17 1 1 A 45 45 LEU C C 45 178.648 178.412 0.236 1
1 558 . 17 1 1 A 45 45 LEU CA C 45 57.915 57.365 0.550 1
1 559 . 17 1 1 A 45 45 LEU CB C 45 39.073 40.440 -1.367 1
1 563 . 17 1 1 A 45 45 LEU N N 45 119.649 120.080 -0.431 1
1 564 . 17 1 1 A 46 46 GLU H H 46 8.309 8.412 -0.103 1
1 565 . 17 1 1 A 46 46 GLU HA H 46 4.286 3.953 0.333 1
1 570 . 17 1 1 A 46 46 GLU C C 46 179.577 178.651 0.926 1
1 571 . 17 1 1 A 46 46 GLU CA C 46 59.570 59.994 -0.424 1
1 572 . 17 1 1 A 46 46 GLU CB C 46 29.034 29.039 -0.005 1
1 574 . 17 1 1 A 46 46 GLU N N 46 117.366 120.093 -2.727 1
1 575 . 17 1 1 A 47 47 GLN H H 47 7.493 7.987 -0.494 1
1 576 . 17 1 1 A 47 47 GLN HA H 47 4.243 4.078 0.165 1
1 583 . 17 1 1 A 47 47 GLN C C 47 178.870 178.285 0.585 1
1 584 . 17 1 1 A 47 47 GLN CA C 47 59.581 58.420 1.161 1
1 585 . 17 1 1 A 47 47 GLN CB C 47 28.300 28.500 -0.200 1
1 588 . 17 1 1 A 47 47 GLN N N 47 119.345 117.676 1.669 1
1 590 . 17 1 1 A 48 48 LEU H H 48 8.160 7.999 0.161 1
1 591 . 17 1 1 A 48 48 LEU HA H 48 4.211 3.999 0.212 1
1 601 . 17 1 1 A 48 48 LEU C C 48 180.111 179.177 0.934 1
1 602 . 17 1 1 A 48 48 LEU CA C 48 57.179 57.936 -0.757 1
1 603 . 17 1 1 A 48 48 LEU CB C 48 42.067 41.786 0.281 1
1 607 . 17 1 1 A 48 48 LEU N N 48 118.594 121.376 -2.782 1
1 608 . 17 1 1 A 49 49 HIS H H 49 8.864 8.257 0.607 1
1 609 . 17 1 1 A 49 49 HIS HA H 49 5.162 4.601 0.561 1
1 613 . 17 1 1 A 49 49 HIS C C 49 178.801 177.137 1.664 1
1 614 . 17 1 1 A 49 49 HIS CA C 49 58.397 59.484 -1.087 1
1 615 . 17 1 1 A 49 49 HIS CB C 49 29.631 29.827 -0.196 1
1 617 . 17 1 1 A 49 49 HIS N N 49 122.537 117.827 4.710 1
1 618 . 17 1 1 A 50 50 ASP H H 50 8.683 8.358 0.325 1
1 619 . 17 1 1 A 50 50 ASP HA H 50 4.356 4.152 0.204 1
1 622 . 17 1 1 A 50 50 ASP C C 50 178.474 177.769 0.705 1
1 623 . 17 1 1 A 50 50 ASP CA C 50 57.744 56.906 0.838 1
1 624 . 17 1 1 A 50 50 ASP CB C 50 40.575 40.537 0.038 1
1 625 . 17 1 1 A 50 50 ASP N N 50 123.169 118.831 4.338 1
1 626 . 17 1 1 A 51 51 VAL H H 51 7.606 7.987 -0.381 1
1 627 . 17 1 1 A 51 51 VAL HA H 51 4.514 4.094 0.420 1
1 635 . 17 1 1 A 51 51 VAL C C 51 176.862 176.399 0.463 1
1 636 . 17 1 1 A 51 51 VAL CA C 51 61.590 63.504 -1.914 1
1 637 . 17 1 1 A 51 51 VAL CB C 51 31.423 32.984 -1.561 1
1 640 . 17 1 1 A 51 51 VAL N N 51 109.266 111.318 -2.052 1
1 641 . 17 1 1 A 52 52 GLY H H 52 7.696 7.609 0.087 1
1 642 . 17 1 1 A 52 52 GLY HA2 H 52 4.172 4.032 0.140 1
1 643 . 17 1 1 A 52 52 GLY HA3 H 52 3.938 4.036 -0.098 1
1 644 . 17 1 1 A 52 52 GLY C C 52 174.276 175.592 -1.316 1
1 645 . 17 1 1 A 52 52 GLY CA C 52 46.228 44.912 1.316 1
1 646 . 17 1 1 A 52 52 GLY N N 52 108.681 110.437 -1.756 1
1 647 . 17 1 1 A 53 53 VAL H H 53 8.046 8.205 -0.159 1
1 648 . 17 1 1 A 53 53 VAL HA H 53 4.079 3.876 0.203 1
1 656 . 17 1 1 A 53 53 VAL C C 53 175.949 175.977 -0.028 1
1 657 . 17 1 1 A 53 53 VAL CA C 53 64.063 64.805 -0.742 1
1 658 . 17 1 1 A 53 53 VAL CB C 53 33.160 31.862 1.298 1
1 661 . 17 1 1 A 53 53 VAL N N 53 117.892 118.577 -0.685 1
1 662 . 17 1 1 A 54 54 LEU H H 54 6.835 7.546 -0.711 1
1 663 . 17 1 1 A 54 54 LEU HA H 54 5.348 5.227 0.121 1
1 673 . 17 1 1 A 54 54 LEU C C 54 175.713 175.991 -0.278 1
1 674 . 17 1 1 A 54 54 LEU CA C 54 52.194 53.140 -0.946 1
1 675 . 17 1 1 A 54 54 LEU CB C 54 46.733 43.690 3.043 1
1 679 . 17 1 1 A 54 54 LEU N N 54 114.848 118.220 -3.372 1
1 680 . 17 1 1 A 55 55 GLU H H 55 9.549 9.141 0.408 1
1 681 . 17 1 1 A 55 55 GLU HA H 55 4.826 4.777 0.049 1
1 686 . 17 1 1 A 55 55 GLU C C 55 174.661 176.627 -1.966 1
1 687 . 17 1 1 A 55 55 GLU CA C 55 54.637 55.782 -1.145 1
1 688 . 17 1 1 A 55 55 GLU CB C 55 32.891 30.995 1.896 1
1 690 . 17 1 1 A 55 55 GLU N N 55 121.431 124.456 -3.025 1
1 691 . 17 1 1 A 56 56 LYS H H 56 8.513 8.391 0.122 1
1 692 . 17 1 1 A 56 56 LYS HA H 56 4.151 4.094 0.057 1
1 701 . 17 1 1 A 56 56 LYS C C 56 176.270 175.940 0.330 1
1 702 . 17 1 1 A 56 56 LYS CA C 56 54.890 55.993 -1.103 1
1 703 . 17 1 1 A 56 56 LYS CB C 56 33.162 32.747 0.415 1
1 707 . 17 1 1 A 56 56 LYS N N 56 126.539 121.146 5.393 1
1 708 . 17 1 1 A 57 57 VAL H H 57 8.279 8.378 -0.099 1
1 709 . 17 1 1 A 57 57 VAL HA H 57 3.820 4.533 -0.713 1
1 717 . 17 1 1 A 57 57 VAL C C 57 175.108 174.528 0.580 1
1 718 . 17 1 1 A 57 57 VAL CA C 57 62.834 61.926 0.908 1
1 719 . 17 1 1 A 57 57 VAL CB C 57 32.549 33.108 -0.559 1
1 722 . 17 1 1 A 57 57 VAL N N 57 126.540 122.735 3.805 1
1 723 . 17 1 1 A 58 58 ASN H H 58 8.383 8.678 -0.295 1
1 724 . 17 1 1 A 58 58 ASN HA H 58 4.612 5.029 -0.417 1
1 729 . 17 1 1 A 58 58 ASN C C 58 174.772 174.306 0.466 1
1 730 . 17 1 1 A 58 58 ASN CA C 58 52.575 51.813 0.762 1
1 731 . 17 1 1 A 58 58 ASN CB C 58 38.502 42.270 -3.768 1
1 733 . 17 1 1 A 58 58 ASN N N 58 121.767 123.691 -1.924 1
1 735 . 17 1 1 A 59 59 ALA H H 59 8.165 8.157 0.008 1
1 736 . 17 1 1 A 59 59 ALA HA H 59 4.251 4.534 -0.283 1
1 740 . 17 1 1 A 59 59 ALA C C 59 177.478 178.775 -1.297 1
1 741 . 17 1 1 A 59 59 ALA CA C 59 52.490 51.732 0.758 1
1 742 . 17 1 1 A 59 59 ALA CB C 59 19.724 18.777 0.947 1
1 743 . 17 1 1 A 59 59 ALA N N 59 125.082 123.406 1.676 1
1 744 . 17 1 1 A 60 60 GLY H H 60 8.291 8.175 0.116 1
1 745 . 17 1 1 A 60 60 GLY HA2 H 60 4.165 3.929 0.236 1
1 746 . 17 1 1 A 60 60 GLY HA3 H 60 3.853 3.939 -0.086 1
1 747 . 17 1 1 A 60 60 GLY C C 60 174.171 174.351 -0.180 1
1 748 . 17 1 1 A 60 60 GLY CA C 60 44.994 45.766 -0.772 1
1 749 . 17 1 1 A 60 60 GLY N N 60 108.518 107.894 0.624 1
1 750 . 17 1 1 A 61 61 LYS H H 61 8.189 7.778 0.411 1
1 751 . 17 1 1 A 61 61 LYS HA H 61 4.320 4.161 0.159 1
1 760 . 17 1 1 A 61 61 LYS C C 61 177.712 177.272 0.440 1
1 761 . 17 1 1 A 61 61 LYS CA C 61 56.832 58.030 -1.198 1
1 762 . 17 1 1 A 61 61 LYS CB C 61 32.641 32.160 0.481 1
1 766 . 17 1 1 A 61 61 LYS N N 61 120.532 120.871 -0.339 1
1 767 . 17 1 1 A 62 62 GLY H H 62 8.767 8.886 -0.119 1
1 768 . 17 1 1 A 62 62 GLY HA2 H 62 4.021 3.931 0.090 1
1 769 . 17 1 1 A 62 62 GLY HA3 H 62 3.849 3.934 -0.085 1
1 770 . 17 1 1 A 62 62 GLY C C 62 173.782 174.302 -0.520 1
1 771 . 17 1 1 A 62 62 GLY CA C 62 45.844 45.947 -0.103 1
1 772 . 17 1 1 A 62 62 GLY N N 62 111.547 112.277 -0.730 1
1 773 . 17 1 1 A 63 63 VAL H H 63 7.379 8.048 -0.669 1
1 774 . 17 1 1 A 63 63 VAL HA H 63 4.591 4.174 0.417 1
1 782 . 17 1 1 A 63 63 VAL C C 63 174.262 176.359 -2.097 1
1 783 . 17 1 1 A 63 63 VAL CA C 63 59.292 61.007 -1.715 1
1 784 . 17 1 1 A 63 63 VAL CB C 63 32.726 31.407 1.319 1
1 787 . 17 1 1 A 63 63 VAL N N 63 117.546 120.051 -2.505 1
1 788 . 17 1 1 A 64 64 PRO HA H 64 4.458 4.413 0.045 1
1 795 . 17 1 1 A 64 64 PRO C C 64 177.166 176.541 0.625 1
1 796 . 17 1 1 A 64 64 PRO CA C 64 63.661 64.255 -0.594 1
1 797 . 17 1 1 A 64 64 PRO CB C 64 32.321 32.073 0.248 1
1 800 . 17 1 1 A 65 65 GLY H H 65 8.463 7.218 1.245 1
1 801 . 17 1 1 A 65 65 GLY HA2 H 65 3.882 3.595 0.287 1
1 802 . 17 1 1 A 65 65 GLY HA3 H 65 3.602 3.761 -0.159 1
1 803 . 17 1 1 A 65 65 GLY C C 65 172.406 172.017 0.389 1
1 804 . 17 1 1 A 65 65 GLY CA C 65 45.933 44.829 1.104 1
1 805 . 17 1 1 A 65 65 GLY N N 65 109.819 106.236 3.583 1
1 806 . 17 1 1 A 66 66 LEU H H 66 7.534 8.314 -0.780 1
1 807 . 17 1 1 A 66 66 LEU HA H 66 4.940 4.595 0.345 1
1 817 . 17 1 1 A 66 66 LEU C C 66 176.237 175.538 0.699 1
1 818 . 17 1 1 A 66 66 LEU CA C 66 53.687 53.021 0.666 1
1 819 . 17 1 1 A 66 66 LEU CB C 66 46.108 44.420 1.688 1
1 823 . 17 1 1 A 66 66 LEU N N 66 122.249 123.557 -1.308 1
1 824 . 17 1 1 A 67 67 TRP H H 67 8.916 8.931 -0.015 1
1 825 . 17 1 1 A 67 67 TRP HA H 67 5.526 5.232 0.294 1
1 834 . 17 1 1 A 67 67 TRP C C 67 175.670 175.011 0.659 1
1 835 . 17 1 1 A 67 67 TRP CA C 67 56.241 55.486 0.755 1
1 836 . 17 1 1 A 67 67 TRP CB C 67 33.314 31.478 1.836 1
1 842 . 17 1 1 A 67 67 TRP N N 67 121.160 124.055 -2.895 1
1 844 . 17 1 1 A 68 68 ARG H H 68 8.772 9.143 -0.371 1
1 845 . 17 1 1 A 68 68 ARG HA H 68 4.832 5.195 -0.363 1
1 853 . 17 1 1 A 68 68 ARG C C 68 174.720 174.921 -0.201 1
1 854 . 17 1 1 A 68 68 ARG CA C 68 54.690 53.975 0.715 1
1 855 . 17 1 1 A 68 68 ARG CB C 68 35.176 33.990 1.186 1
1 858 . 17 1 1 A 68 68 ARG N N 68 117.471 124.835 -7.364 1
1 860 . 17 1 1 A 69 69 LEU H H 69 9.355 8.931 0.424 1
1 861 . 17 1 1 A 69 69 LEU HA H 69 4.557 5.185 -0.628 1
1 871 . 17 1 1 A 69 69 LEU C C 69 177.180 176.080 1.100 1
1 872 . 17 1 1 A 69 69 LEU CA C 69 55.780 52.646 3.134 1
1 873 . 17 1 1 A 69 69 LEU CB C 69 42.736 45.670 -2.934 1
1 877 . 17 1 1 A 69 69 LEU N N 69 125.211 121.603 3.608 1
1 878 . 17 1 1 A 70 70 LEU H H 70 8.058 8.560 -0.502 1
1 879 . 17 1 1 A 70 70 LEU HA H 70 4.364 4.756 -0.392 1
1 889 . 17 1 1 A 70 70 LEU C C 70 176.808 175.903 0.905 1
1 890 . 17 1 1 A 70 70 LEU CA C 70 55.257 53.939 1.318 1
1 891 . 17 1 1 A 70 70 LEU CB C 70 42.413 42.322 0.091 1
1 895 . 17 1 1 A 70 70 LEU N N 70 125.525 118.570 6.955 1
1 1 . 18 1 1 A 2 2 SER HA H 2 4.126 4.955 -0.829 1
1 4 . 18 1 1 A 2 2 SER CA C 2 57.564 57.758 -0.194 1
1 5 . 18 1 1 A 2 2 SER CB C 2 63.953 64.076 -0.123 1
1 6 . 18 1 1 A 3 3 GLU HA H 3 4.408 4.695 -0.287 1
1 11 . 18 1 1 A 3 3 GLU C C 3 176.658 175.812 0.846 1
1 12 . 18 1 1 A 3 3 GLU CA C 3 56.802 55.221 1.581 1
1 13 . 18 1 1 A 3 3 GLU CB C 3 30.674 31.438 -0.764 1
1 15 . 18 1 1 A 4 4 SER H H 4 8.650 8.680 -0.030 1
1 16 . 18 1 1 A 4 4 SER HA H 4 4.463 4.205 0.258 1
1 19 . 18 1 1 A 4 4 SER C C 4 175.949 174.352 1.597 1
1 20 . 18 1 1 A 4 4 SER CA C 4 58.557 59.085 -0.528 1
1 21 . 18 1 1 A 4 4 SER CB C 4 63.834 61.023 2.811 1
1 22 . 18 1 1 A 4 4 SER N N 4 118.042 115.834 2.208 1
1 23 . 18 1 1 A 5 5 ILE H H 5 8.404 7.808 0.596 1
1 24 . 18 1 1 A 5 5 ILE HA H 5 3.902 3.500 0.402 1
1 34 . 18 1 1 A 5 5 ILE C C 5 176.608 178.447 -1.839 1
1 35 . 18 1 1 A 5 5 ILE CA C 5 62.662 64.781 -2.119 1
1 36 . 18 1 1 A 5 5 ILE CB C 5 37.622 37.786 -0.164 1
1 40 . 18 1 1 A 5 5 ILE N N 5 124.711 120.949 3.762 1
1 41 . 18 1 1 A 6 6 VAL H H 6 7.602 8.097 -0.495 1
1 42 . 18 1 1 A 6 6 VAL HA H 6 3.293 3.309 -0.016 1
1 50 . 18 1 1 A 6 6 VAL C C 6 177.088 178.028 -0.940 1
1 51 . 18 1 1 A 6 6 VAL CA C 6 67.180 66.675 0.505 1
1 52 . 18 1 1 A 6 6 VAL CB C 6 31.517 31.714 -0.197 1
1 55 . 18 1 1 A 6 6 VAL N N 6 119.974 119.631 0.343 1
1 56 . 18 1 1 A 7 7 THR H H 7 7.515 8.171 -0.656 1
1 57 . 18 1 1 A 7 7 THR HA H 7 3.823 3.883 -0.060 1
1 62 . 18 1 1 A 7 7 THR C C 7 176.978 176.444 0.534 1
1 63 . 18 1 1 A 7 7 THR CA C 7 66.257 66.907 -0.650 1
1 64 . 18 1 1 A 7 7 THR CB C 7 68.410 68.116 0.294 1
1 66 . 18 1 1 A 7 7 THR N N 7 114.177 115.801 -1.624 1
1 67 . 18 1 1 A 8 8 LYS H H 8 7.807 8.376 -0.569 1
1 68 . 18 1 1 A 8 8 LYS HA H 8 4.066 3.952 0.114 1
1 77 . 18 1 1 A 8 8 LYS C C 8 178.733 178.469 0.264 1
1 78 . 18 1 1 A 8 8 LYS CA C 8 59.338 59.845 -0.507 1
1 79 . 18 1 1 A 8 8 LYS CB C 8 32.002 32.429 -0.427 1
1 83 . 18 1 1 A 8 8 LYS N N 8 123.387 120.192 3.195 1
1 84 . 18 1 1 A 9 9 ILE H H 9 8.288 7.707 0.581 1
1 85 . 18 1 1 A 9 9 ILE HA H 9 3.421 3.575 -0.154 1
1 95 . 18 1 1 A 9 9 ILE C C 9 177.187 178.398 -1.211 1
1 96 . 18 1 1 A 9 9 ILE CA C 9 65.772 65.583 0.189 1
1 97 . 18 1 1 A 9 9 ILE CB C 9 37.183 37.848 -0.665 1
1 101 . 18 1 1 A 9 9 ILE N N 9 119.543 118.602 0.941 1
1 102 . 18 1 1 A 10 10 ILE H H 10 8.073 7.992 0.081 1
1 103 . 18 1 1 A 10 10 ILE HA H 10 3.305 3.495 -0.190 1
1 113 . 18 1 1 A 10 10 ILE C C 10 177.308 178.354 -1.046 1
1 114 . 18 1 1 A 10 10 ILE CA C 10 66.704 65.114 1.590 1
1 115 . 18 1 1 A 10 10 ILE CB C 10 37.840 37.476 0.364 1
1 119 . 18 1 1 A 10 10 ILE N N 10 119.219 121.068 -1.849 1
1 120 . 18 1 1 A 11 11 SER H H 11 7.861 8.222 -0.361 1
1 121 . 18 1 1 A 11 11 SER HA H 11 4.250 4.217 0.033 1
1 124 . 18 1 1 A 11 11 SER C C 11 176.918 177.392 -0.474 1
1 125 . 18 1 1 A 11 11 SER CA C 11 61.911 61.203 0.708 1
1 126 . 18 1 1 A 11 11 SER CB C 11 62.998 62.904 0.094 1
1 127 . 18 1 1 A 11 11 SER N N 11 113.959 115.773 -1.814 1
1 128 . 18 1 1 A 12 12 ILE H H 12 8.250 7.876 0.374 1
1 129 . 18 1 1 A 12 12 ILE HA H 12 3.801 3.632 0.169 1
1 139 . 18 1 1 A 12 12 ILE C C 12 178.130 178.108 0.022 1
1 140 . 18 1 1 A 12 12 ILE CA C 12 65.023 64.880 0.143 1
1 141 . 18 1 1 A 12 12 ILE CB C 12 38.195 37.560 0.635 1
1 145 . 18 1 1 A 12 12 ILE N N 12 123.767 122.189 1.578 1
1 146 . 18 1 1 A 13 13 VAL H H 13 8.308 7.985 0.323 1
1 147 . 18 1 1 A 13 13 VAL HA H 13 3.435 3.493 -0.058 1
1 155 . 18 1 1 A 13 13 VAL C C 13 177.283 177.920 -0.637 1
1 156 . 18 1 1 A 13 13 VAL CA C 13 67.693 66.775 0.918 1
1 157 . 18 1 1 A 13 13 VAL CB C 13 31.139 31.275 -0.136 1
1 160 . 18 1 1 A 13 13 VAL N N 13 120.066 119.947 0.119 1
1 161 . 18 1 1 A 14 14 GLN H H 14 8.612 8.032 0.580 1
1 162 . 18 1 1 A 14 14 GLN HA H 14 3.831 4.037 -0.206 1
1 169 . 18 1 1 A 14 14 GLN C C 14 178.256 178.065 0.191 1
1 170 . 18 1 1 A 14 14 GLN CA C 14 59.660 59.373 0.287 1
1 171 . 18 1 1 A 14 14 GLN CB C 14 29.456 28.141 1.315 1
1 174 . 18 1 1 A 14 14 GLN N N 14 118.099 119.629 -1.530 1
1 176 . 18 1 1 A 15 15 GLU H H 15 8.378 8.337 0.041 1
1 177 . 18 1 1 A 15 15 GLU HA H 15 4.110 4.027 0.083 1
1 182 . 18 1 1 A 15 15 GLU C C 15 179.659 179.328 0.331 1
1 183 . 18 1 1 A 15 15 GLU CA C 15 59.476 59.554 -0.078 1
1 184 . 18 1 1 A 15 15 GLU CB C 15 29.725 29.042 0.683 1
1 186 . 18 1 1 A 15 15 GLU N N 15 118.580 118.943 -0.363 1
1 187 . 18 1 1 A 16 16 ARG H H 16 8.439 8.014 0.425 1
1 188 . 18 1 1 A 16 16 ARG HA H 16 4.157 4.153 0.004 1
1 196 . 18 1 1 A 16 16 ARG C C 16 179.276 179.035 0.241 1
1 197 . 18 1 1 A 16 16 ARG CA C 16 58.141 59.376 -1.235 1
1 198 . 18 1 1 A 16 16 ARG CB C 16 29.434 29.922 -0.488 1
1 201 . 18 1 1 A 16 16 ARG N N 16 118.688 119.429 -0.741 1
1 203 . 18 1 1 A 17 17 GLN H H 17 8.861 8.108 0.753 1
1 204 . 18 1 1 A 17 17 GLN HA H 17 4.236 4.119 0.117 1
1 211 . 18 1 1 A 17 17 GLN C C 17 178.736 177.750 0.986 1
1 212 . 18 1 1 A 17 17 GLN CA C 17 59.683 58.562 1.121 1
1 213 . 18 1 1 A 17 17 GLN CB C 17 29.960 28.104 1.856 1
1 216 . 18 1 1 A 17 17 GLN N N 17 120.427 119.054 1.373 1
1 218 . 18 1 1 A 18 18 ASN H H 18 8.017 7.916 0.101 1
1 219 . 18 1 1 A 18 18 ASN HA H 18 4.605 4.640 -0.035 1
1 224 . 18 1 1 A 18 18 ASN C C 18 177.906 177.883 0.023 1
1 225 . 18 1 1 A 18 18 ASN CA C 18 55.375 55.269 0.106 1
1 226 . 18 1 1 A 18 18 ASN CB C 18 38.383 38.782 -0.399 1
1 228 . 18 1 1 A 18 18 ASN N N 18 117.033 117.160 -0.127 1
1 230 . 18 1 1 A 19 19 MET H H 19 7.994 8.180 -0.186 1
1 231 . 18 1 1 A 19 19 MET HA H 19 4.372 4.259 0.113 1
1 236 . 18 1 1 A 19 19 MET C C 19 176.518 175.427 1.091 1
1 237 . 18 1 1 A 19 19 MET CA C 19 57.623 57.564 0.059 1
1 238 . 18 1 1 A 19 19 MET CB C 19 33.248 32.232 1.016 1
1 240 . 18 1 1 A 19 19 MET N N 19 119.320 116.771 2.549 1
1 241 . 18 1 1 A 20 20 ASP H H 20 7.800 7.393 0.407 1
1 242 . 18 1 1 A 20 20 ASP HA H 20 4.990 4.996 -0.006 1
1 245 . 18 1 1 A 20 20 ASP C C 20 176.082 174.602 1.480 1
1 246 . 18 1 1 A 20 20 ASP CA C 20 53.796 52.378 1.418 1
1 247 . 18 1 1 A 20 20 ASP CB C 20 40.409 44.145 -3.736 1
1 248 . 18 1 1 A 20 20 ASP N N 20 119.127 118.784 0.343 1
1 249 . 18 1 1 A 21 21 ASP H H 21 8.136 8.786 -0.650 1
1 250 . 18 1 1 A 21 21 ASP HA H 21 4.497 4.923 -0.426 1
1 253 . 18 1 1 A 21 21 ASP C C 21 176.264 176.305 -0.041 1
1 254 . 18 1 1 A 21 21 ASP CA C 21 55.508 54.425 1.083 1
1 255 . 18 1 1 A 21 21 ASP CB C 21 40.063 42.595 -2.532 1
1 256 . 18 1 1 A 21 21 ASP N N 21 118.276 120.968 -2.692 1
1 257 . 18 1 1 A 22 22 GLY H H 22 8.728 7.565 1.163 1
1 258 . 18 1 1 A 22 22 GLY HA2 H 22 4.189 4.102 0.087 1
1 259 . 18 1 1 A 22 22 GLY HA3 H 22 3.683 4.105 -0.422 1
1 260 . 18 1 1 A 22 22 GLY C C 22 174.304 173.221 1.083 1
1 261 . 18 1 1 A 22 22 GLY CA C 22 45.629 45.693 -0.064 1
1 262 . 18 1 1 A 22 22 GLY N N 22 105.878 105.111 0.767 1
1 263 . 18 1 1 A 23 23 ALA H H 23 7.473 7.909 -0.436 1
1 264 . 18 1 1 A 23 23 ALA HA H 23 4.519 4.602 -0.083 1
1 268 . 18 1 1 A 23 23 ALA C C 23 174.065 176.345 -2.280 1
1 269 . 18 1 1 A 23 23 ALA CA C 23 51.142 48.955 2.187 1
1 270 . 18 1 1 A 23 23 ALA CB C 23 18.283 20.037 -1.754 1
1 271 . 18 1 1 A 23 23 ALA N N 23 125.323 123.060 2.263 1
1 272 . 18 1 1 A 24 24 PRO HA H 24 4.590 4.587 0.003 1
1 279 . 18 1 1 A 24 24 PRO C C 24 175.253 176.631 -1.378 1
1 280 . 18 1 1 A 24 24 PRO CA C 24 62.186 62.889 -0.703 1
1 281 . 18 1 1 A 24 24 PRO CB C 24 32.931 32.486 0.445 1
1 284 . 18 1 1 A 25 25 VAL H H 25 9.334 8.551 0.783 1
1 285 . 18 1 1 A 25 25 VAL HA H 25 4.378 4.198 0.180 1
1 293 . 18 1 1 A 25 25 VAL C C 25 176.439 176.017 0.422 1
1 294 . 18 1 1 A 25 25 VAL CA C 25 61.482 61.820 -0.338 1
1 295 . 18 1 1 A 25 25 VAL CB C 25 34.781 31.848 2.933 1
1 298 . 18 1 1 A 25 25 VAL N N 25 120.408 123.034 -2.626 1
1 299 . 18 1 1 A 26 26 LYS H H 26 9.300 8.883 0.417 1
1 300 . 18 1 1 A 26 26 LYS HA H 26 4.982 4.400 0.582 1
1 309 . 18 1 1 A 26 26 LYS C C 26 179.008 177.896 1.112 1
1 310 . 18 1 1 A 26 26 LYS CA C 26 56.908 56.148 0.760 1
1 311 . 18 1 1 A 26 26 LYS CB C 26 34.071 32.765 1.306 1
1 315 . 18 1 1 A 26 26 LYS N N 26 126.177 127.467 -1.290 1
1 316 . 18 1 1 A 27 27 THR H H 27 8.618 8.416 0.202 1
1 317 . 18 1 1 A 27 27 THR HA H 27 3.662 4.046 -0.384 1
1 322 . 18 1 1 A 27 27 THR C C 27 176.442 176.158 0.284 1
1 323 . 18 1 1 A 27 27 THR CA C 27 67.591 66.694 0.897 1
1 324 . 18 1 1 A 27 27 THR CB C 27 68.868 69.104 -0.236 1
1 326 . 18 1 1 A 27 27 THR N N 27 119.020 118.106 0.914 1
1 327 . 18 1 1 A 28 28 ARG H H 28 9.288 8.230 1.058 1
1 328 . 18 1 1 A 28 28 ARG HA H 28 3.879 4.061 -0.182 1
1 335 . 18 1 1 A 28 28 ARG C C 28 176.884 178.860 -1.976 1
1 336 . 18 1 1 A 28 28 ARG CA C 28 59.431 59.542 -0.111 1
1 337 . 18 1 1 A 28 28 ARG CB C 28 29.953 30.076 -0.123 1
1 340 . 18 1 1 A 28 28 ARG N N 28 119.100 120.765 -1.665 1
1 341 . 18 1 1 A 29 29 ASP H H 29 6.907 8.336 -1.429 1
1 342 . 18 1 1 A 29 29 ASP HA H 29 4.550 4.389 0.161 1
1 345 . 18 1 1 A 29 29 ASP C C 29 179.050 178.768 0.282 1
1 346 . 18 1 1 A 29 29 ASP CA C 29 57.262 57.940 -0.678 1
1 347 . 18 1 1 A 29 29 ASP CB C 29 40.191 42.151 -1.960 1
1 348 . 18 1 1 A 29 29 ASP N N 29 117.490 119.807 -2.317 1
1 349 . 18 1 1 A 30 30 ILE H H 30 7.554 8.112 -0.558 1
1 350 . 18 1 1 A 30 30 ILE HA H 30 3.595 3.900 -0.305 1
1 360 . 18 1 1 A 30 30 ILE C C 30 176.907 177.769 -0.862 1
1 361 . 18 1 1 A 30 30 ILE CA C 30 65.002 65.807 -0.805 1
1 362 . 18 1 1 A 30 30 ILE CB C 30 37.999 37.898 0.101 1
1 366 . 18 1 1 A 30 30 ILE N N 30 120.978 119.171 1.807 1
1 367 . 18 1 1 A 31 31 ALA H H 31 8.269 8.360 -0.091 1
1 368 . 18 1 1 A 31 31 ALA HA H 31 3.720 3.992 -0.272 1
1 372 . 18 1 1 A 31 31 ALA C C 31 179.170 179.636 -0.466 1
1 373 . 18 1 1 A 31 31 ALA CA C 31 56.354 55.929 0.425 1
1 374 . 18 1 1 A 31 31 ALA CB C 31 17.843 18.212 -0.369 1
1 375 . 18 1 1 A 31 31 ALA N N 31 121.171 122.454 -1.283 1
1 376 . 18 1 1 A 32 32 ASP H H 32 8.293 8.303 -0.010 1
1 377 . 18 1 1 A 32 32 ASP HA H 32 4.422 4.436 -0.014 1
1 380 . 18 1 1 A 32 32 ASP C C 32 179.136 178.268 0.868 1
1 381 . 18 1 1 A 32 32 ASP CA C 32 57.109 56.715 0.394 1
1 382 . 18 1 1 A 32 32 ASP CB C 32 40.523 40.395 0.128 1
1 383 . 18 1 1 A 32 32 ASP N N 32 116.467 119.230 -2.763 1
1 384 . 18 1 1 A 33 33 ALA H H 33 7.536 8.087 -0.551 1
1 385 . 18 1 1 A 33 33 ALA HA H 33 4.222 4.089 0.133 1
1 389 . 18 1 1 A 33 33 ALA C C 33 179.056 179.759 -0.703 1
1 390 . 18 1 1 A 33 33 ALA CA C 33 54.469 54.823 -0.354 1
1 391 . 18 1 1 A 33 33 ALA CB C 33 19.085 18.205 0.880 1
1 392 . 18 1 1 A 33 33 ALA N N 33 120.859 123.132 -2.273 1
1 393 . 18 1 1 A 34 34 ALA H H 34 8.296 7.856 0.440 1
1 394 . 18 1 1 A 34 34 ALA HA H 34 4.101 4.294 -0.193 1
1 398 . 18 1 1 A 34 34 ALA C C 34 176.912 178.093 -1.181 1
1 399 . 18 1 1 A 34 34 ALA CA C 34 52.380 52.347 0.033 1
1 400 . 18 1 1 A 34 34 ALA CB C 34 18.817 19.800 -0.983 1
1 401 . 18 1 1 A 34 34 ALA N N 34 118.203 117.121 1.082 1
1 402 . 18 1 1 A 35 35 GLY H H 35 7.911 8.584 -0.673 1
1 403 . 18 1 1 A 35 35 GLY HA2 H 35 3.968 3.958 0.010 1
1 404 . 18 1 1 A 35 35 GLY HA3 H 35 3.968 3.964 0.004 1
1 405 . 18 1 1 A 35 35 GLY C C 35 174.374 174.071 0.303 1
1 406 . 18 1 1 A 35 35 GLY CA C 35 46.388 46.476 -0.088 1
1 407 . 18 1 1 A 35 35 GLY N N 35 107.752 107.631 0.121 1
1 408 . 18 1 1 A 36 36 LEU H H 36 7.758 7.434 0.324 1
1 409 . 18 1 1 A 36 36 LEU HA H 36 4.887 4.895 -0.008 1
1 419 . 18 1 1 A 36 36 LEU C C 36 175.941 175.727 0.214 1
1 420 . 18 1 1 A 36 36 LEU CA C 36 52.443 52.570 -0.127 1
1 421 . 18 1 1 A 36 36 LEU CB C 36 47.885 45.421 2.464 1
1 425 . 18 1 1 A 36 36 LEU N N 36 118.719 120.263 -1.544 1
1 426 . 18 1 1 A 37 37 SER H H 37 8.603 8.728 -0.125 1
1 427 . 18 1 1 A 37 37 SER HA H 37 4.565 4.530 0.035 1
1 430 . 18 1 1 A 37 37 SER C C 37 175.512 175.886 -0.374 1
1 431 . 18 1 1 A 37 37 SER CA C 37 57.262 58.956 -1.694 1
1 432 . 18 1 1 A 37 37 SER CB C 37 65.155 63.872 1.283 1
1 433 . 18 1 1 A 37 37 SER N N 37 115.095 117.245 -2.150 1
1 434 . 18 1 1 A 38 38 ILE H H 38 8.822 8.848 -0.026 1
1 435 . 18 1 1 A 38 38 ILE HA H 38 3.650 3.800 -0.150 1
1 445 . 18 1 1 A 38 38 ILE C C 38 176.849 177.480 -0.631 1
1 446 . 18 1 1 A 38 38 ILE CA C 38 64.557 64.956 -0.399 1
1 447 . 18 1 1 A 38 38 ILE CB C 38 37.451 37.934 -0.483 1
1 451 . 18 1 1 A 38 38 ILE N N 38 122.026 124.737 -2.711 1
1 452 . 18 1 1 A 39 39 TYR H H 39 7.839 8.521 -0.682 1
1 453 . 18 1 1 A 39 39 TYR HA H 39 4.112 4.017 0.095 1
1 460 . 18 1 1 A 39 39 TYR C C 39 177.703 177.507 0.196 1
1 461 . 18 1 1 A 39 39 TYR CA C 39 60.856 61.948 -1.092 1
1 462 . 18 1 1 A 39 39 TYR CB C 39 38.402 38.567 -0.165 1
1 467 . 18 1 1 A 39 39 TYR N N 39 118.759 120.449 -1.690 1
1 468 . 18 1 1 A 40 40 GLN H H 40 7.687 8.278 -0.591 1
1 469 . 18 1 1 A 40 40 GLN HA H 40 3.865 3.871 -0.006 1
1 476 . 18 1 1 A 40 40 GLN C C 40 178.735 178.285 0.450 1
1 477 . 18 1 1 A 40 40 GLN CA C 40 58.089 58.940 -0.851 1
1 478 . 18 1 1 A 40 40 GLN CB C 40 29.950 28.551 1.399 1
1 481 . 18 1 1 A 40 40 GLN N N 40 116.772 118.708 -1.936 1
1 483 . 18 1 1 A 41 41 VAL H H 41 8.494 8.440 0.054 1
1 484 . 18 1 1 A 41 41 VAL HA H 41 3.835 3.636 0.199 1
1 492 . 18 1 1 A 41 41 VAL C C 41 176.977 177.785 -0.808 1
1 493 . 18 1 1 A 41 41 VAL CA C 41 66.102 67.253 -1.151 1
1 494 . 18 1 1 A 41 41 VAL CB C 41 31.105 31.558 -0.453 1
1 497 . 18 1 1 A 41 41 VAL N N 41 117.192 119.601 -2.409 1
1 498 . 18 1 1 A 42 42 ARG H H 42 8.179 8.362 -0.183 1
1 499 . 18 1 1 A 42 42 ARG HA H 42 3.708 3.955 -0.247 1
1 506 . 18 1 1 A 42 42 ARG C C 42 177.570 178.412 -0.842 1
1 507 . 18 1 1 A 42 42 ARG CA C 42 60.349 59.495 0.854 1
1 508 . 18 1 1 A 42 42 ARG CB C 42 30.047 30.009 0.038 1
1 511 . 18 1 1 A 42 42 ARG N N 42 120.574 119.514 1.060 1
1 512 . 18 1 1 A 43 43 LEU H H 43 6.982 7.923 -0.941 1
1 513 . 18 1 1 A 43 43 LEU HA H 43 3.939 3.763 0.176 1
1 523 . 18 1 1 A 43 43 LEU C C 43 180.397 178.502 1.895 1
1 524 . 18 1 1 A 43 43 LEU CA C 43 58.119 57.761 0.358 1
1 525 . 18 1 1 A 43 43 LEU CB C 43 41.294 41.207 0.087 1
1 529 . 18 1 1 A 43 43 LEU N N 43 117.189 119.096 -1.907 1
1 530 . 18 1 1 A 44 44 TYR H H 44 7.026 7.630 -0.604 1
1 531 . 18 1 1 A 44 44 TYR HA H 44 4.253 4.225 0.028 1
1 538 . 18 1 1 A 44 44 TYR C C 44 178.411 178.053 0.358 1
1 539 . 18 1 1 A 44 44 TYR CA C 44 60.941 60.881 0.060 1
1 540 . 18 1 1 A 44 44 TYR CB C 44 38.889 38.018 0.871 1
1 545 . 18 1 1 A 44 44 TYR N N 44 117.020 117.668 -0.648 1
1 546 . 18 1 1 A 45 45 LEU H H 45 8.429 8.477 -0.048 1
1 547 . 18 1 1 A 45 45 LEU HA H 45 3.486 3.509 -0.023 1
1 557 . 18 1 1 A 45 45 LEU C C 45 178.648 178.696 -0.048 1
1 558 . 18 1 1 A 45 45 LEU CA C 45 57.915 57.779 0.136 1
1 559 . 18 1 1 A 45 45 LEU CB C 45 39.073 40.785 -1.712 1
1 563 . 18 1 1 A 45 45 LEU N N 45 119.649 120.073 -0.424 1
1 564 . 18 1 1 A 46 46 GLU H H 46 8.309 8.490 -0.181 1
1 565 . 18 1 1 A 46 46 GLU HA H 46 4.286 3.926 0.360 1
1 570 . 18 1 1 A 46 46 GLU C C 46 179.577 179.351 0.226 1
1 571 . 18 1 1 A 46 46 GLU CA C 46 59.570 59.600 -0.030 1
1 572 . 18 1 1 A 46 46 GLU CB C 46 29.034 29.411 -0.377 1
1 574 . 18 1 1 A 46 46 GLU N N 46 117.366 117.176 0.190 1
1 575 . 18 1 1 A 47 47 GLN H H 47 7.493 7.583 -0.090 1
1 576 . 18 1 1 A 47 47 GLN HA H 47 4.243 3.975 0.268 1
1 583 . 18 1 1 A 47 47 GLN C C 47 178.870 178.684 0.186 1
1 584 . 18 1 1 A 47 47 GLN CA C 47 59.581 58.815 0.766 1
1 585 . 18 1 1 A 47 47 GLN CB C 47 28.300 28.278 0.022 1
1 588 . 18 1 1 A 47 47 GLN N N 47 119.345 118.824 0.521 1
1 590 . 18 1 1 A 48 48 LEU H H 48 8.160 8.414 -0.254 1
1 591 . 18 1 1 A 48 48 LEU HA H 48 4.211 3.988 0.223 1
1 601 . 18 1 1 A 48 48 LEU C C 48 180.111 179.151 0.960 1
1 602 . 18 1 1 A 48 48 LEU CA C 48 57.179 57.698 -0.519 1
1 603 . 18 1 1 A 48 48 LEU CB C 48 42.067 40.894 1.173 1
1 607 . 18 1 1 A 48 48 LEU N N 48 118.594 119.410 -0.816 1
1 608 . 18 1 1 A 49 49 HIS H H 49 8.864 8.348 0.516 1
1 609 . 18 1 1 A 49 49 HIS HA H 49 5.162 4.701 0.461 1
1 613 . 18 1 1 A 49 49 HIS C C 49 178.801 177.525 1.276 1
1 614 . 18 1 1 A 49 49 HIS CA C 49 58.397 60.058 -1.661 1
1 615 . 18 1 1 A 49 49 HIS CB C 49 29.631 29.937 -0.306 1
1 617 . 18 1 1 A 49 49 HIS N N 49 122.537 118.145 4.392 1
1 618 . 18 1 1 A 50 50 ASP H H 50 8.683 8.589 0.094 1
1 619 . 18 1 1 A 50 50 ASP HA H 50 4.356 4.208 0.148 1
1 622 . 18 1 1 A 50 50 ASP C C 50 178.474 178.051 0.423 1
1 623 . 18 1 1 A 50 50 ASP CA C 50 57.744 56.740 1.004 1
1 624 . 18 1 1 A 50 50 ASP CB C 50 40.575 40.820 -0.245 1
1 625 . 18 1 1 A 50 50 ASP N N 50 123.169 119.819 3.350 1
1 626 . 18 1 1 A 51 51 VAL H H 51 7.606 7.668 -0.062 1
1 627 . 18 1 1 A 51 51 VAL HA H 51 4.514 4.156 0.358 1
1 635 . 18 1 1 A 51 51 VAL C C 51 176.862 176.425 0.437 1
1 636 . 18 1 1 A 51 51 VAL CA C 51 61.590 62.061 -0.471 1
1 637 . 18 1 1 A 51 51 VAL CB C 51 31.423 32.020 -0.597 1
1 640 . 18 1 1 A 51 51 VAL N N 51 109.266 112.703 -3.437 1
1 641 . 18 1 1 A 52 52 GLY H H 52 7.696 7.616 0.080 1
1 642 . 18 1 1 A 52 52 GLY HA2 H 52 4.172 3.934 0.238 1
1 643 . 18 1 1 A 52 52 GLY HA3 H 52 3.938 3.959 -0.021 1
1 644 . 18 1 1 A 52 52 GLY C C 52 174.276 174.964 -0.688 1
1 645 . 18 1 1 A 52 52 GLY CA C 52 46.228 45.610 0.618 1
1 646 . 18 1 1 A 52 52 GLY N N 52 108.681 110.611 -1.930 1
1 647 . 18 1 1 A 53 53 VAL H H 53 8.046 8.126 -0.080 1
1 648 . 18 1 1 A 53 53 VAL HA H 53 4.079 3.960 0.119 1
1 656 . 18 1 1 A 53 53 VAL C C 53 175.949 175.586 0.363 1
1 657 . 18 1 1 A 53 53 VAL CA C 53 64.063 64.472 -0.409 1
1 658 . 18 1 1 A 53 53 VAL CB C 53 33.160 32.529 0.631 1
1 661 . 18 1 1 A 53 53 VAL N N 53 117.892 118.029 -0.137 1
1 662 . 18 1 1 A 54 54 LEU H H 54 6.835 7.760 -0.925 1
1 663 . 18 1 1 A 54 54 LEU HA H 54 5.348 4.942 0.406 1
1 673 . 18 1 1 A 54 54 LEU C C 54 175.713 175.792 -0.079 1
1 674 . 18 1 1 A 54 54 LEU CA C 54 52.194 53.125 -0.931 1
1 675 . 18 1 1 A 54 54 LEU CB C 54 46.733 43.508 3.225 1
1 679 . 18 1 1 A 54 54 LEU N N 54 114.848 118.268 -3.420 1
1 680 . 18 1 1 A 55 55 GLU H H 55 9.549 9.384 0.165 1
1 681 . 18 1 1 A 55 55 GLU HA H 55 4.826 5.059 -0.233 1
1 686 . 18 1 1 A 55 55 GLU C C 55 174.661 176.597 -1.936 1
1 687 . 18 1 1 A 55 55 GLU CA C 55 54.637 55.293 -0.656 1
1 688 . 18 1 1 A 55 55 GLU CB C 55 32.891 31.884 1.007 1
1 690 . 18 1 1 A 55 55 GLU N N 55 121.431 124.854 -3.423 1
1 691 . 18 1 1 A 56 56 LYS H H 56 8.513 8.522 -0.009 1
1 692 . 18 1 1 A 56 56 LYS HA H 56 4.151 4.009 0.142 1
1 701 . 18 1 1 A 56 56 LYS C C 56 176.270 176.314 -0.044 1
1 702 . 18 1 1 A 56 56 LYS CA C 56 54.890 56.517 -1.627 1
1 703 . 18 1 1 A 56 56 LYS CB C 56 33.162 32.708 0.454 1
1 707 . 18 1 1 A 56 56 LYS N N 56 126.539 121.963 4.576 1
1 708 . 18 1 1 A 57 57 VAL H H 57 8.279 8.406 -0.127 1
1 709 . 18 1 1 A 57 57 VAL HA H 57 3.820 4.361 -0.541 1
1 717 . 18 1 1 A 57 57 VAL C C 57 175.108 176.111 -1.003 1
1 718 . 18 1 1 A 57 57 VAL CA C 57 62.834 61.252 1.582 1
1 719 . 18 1 1 A 57 57 VAL CB C 57 32.549 33.786 -1.237 1
1 722 . 18 1 1 A 57 57 VAL N N 57 126.540 122.115 4.425 1
1 723 . 18 1 1 A 58 58 ASN H H 58 8.383 9.054 -0.671 1
1 724 . 18 1 1 A 58 58 ASN HA H 58 4.612 4.264 0.348 1
1 729 . 18 1 1 A 58 58 ASN C C 58 174.772 173.812 0.960 1
1 730 . 18 1 1 A 58 58 ASN CA C 58 52.575 53.849 -1.274 1
1 731 . 18 1 1 A 58 58 ASN CB C 58 38.502 36.962 1.540 1
1 733 . 18 1 1 A 58 58 ASN N N 58 121.767 124.626 -2.859 1
1 735 . 18 1 1 A 59 59 ALA H H 59 8.165 7.562 0.603 1
1 736 . 18 1 1 A 59 59 ALA HA H 59 4.251 4.713 -0.462 1
1 740 . 18 1 1 A 59 59 ALA C C 59 177.478 175.533 1.945 1
1 741 . 18 1 1 A 59 59 ALA CA C 59 52.490 51.242 1.248 1
1 742 . 18 1 1 A 59 59 ALA CB C 59 19.724 22.071 -2.347 1
1 743 . 18 1 1 A 59 59 ALA N N 59 125.082 122.414 2.668 1
1 744 . 18 1 1 A 60 60 GLY H H 60 8.291 8.207 0.084 1
1 745 . 18 1 1 A 60 60 GLY HA2 H 60 4.165 4.176 -0.011 1
1 746 . 18 1 1 A 60 60 GLY HA3 H 60 3.853 4.181 -0.328 1
1 747 . 18 1 1 A 60 60 GLY C C 60 174.171 172.318 1.853 1
1 748 . 18 1 1 A 60 60 GLY CA C 60 44.994 45.428 -0.434 1
1 749 . 18 1 1 A 60 60 GLY N N 60 108.518 104.932 3.586 1
1 750 . 18 1 1 A 61 61 LYS H H 61 8.189 8.317 -0.128 1
1 751 . 18 1 1 A 61 61 LYS HA H 61 4.320 4.632 -0.312 1
1 760 . 18 1 1 A 61 61 LYS C C 61 177.712 176.697 1.015 1
1 761 . 18 1 1 A 61 61 LYS CA C 61 56.832 54.810 2.022 1
1 762 . 18 1 1 A 61 61 LYS CB C 61 32.641 35.228 -2.587 1
1 766 . 18 1 1 A 61 61 LYS N N 61 120.532 123.800 -3.268 1
1 767 . 18 1 1 A 62 62 GLY H H 62 8.767 8.760 0.007 1
1 768 . 18 1 1 A 62 62 GLY HA2 H 62 4.021 3.902 0.119 1
1 769 . 18 1 1 A 62 62 GLY HA3 H 62 3.849 3.905 -0.056 1
1 770 . 18 1 1 A 62 62 GLY C C 62 173.782 173.572 0.210 1
1 771 . 18 1 1 A 62 62 GLY CA C 62 45.844 45.641 0.203 1
1 772 . 18 1 1 A 62 62 GLY N N 62 111.547 112.063 -0.516 1
1 773 . 18 1 1 A 63 63 VAL H H 63 7.379 7.603 -0.224 1
1 774 . 18 1 1 A 63 63 VAL HA H 63 4.591 4.730 -0.139 1
1 782 . 18 1 1 A 63 63 VAL C C 63 174.262 173.329 0.933 1
1 783 . 18 1 1 A 63 63 VAL CA C 63 59.292 58.371 0.921 1
1 784 . 18 1 1 A 63 63 VAL CB C 63 32.726 34.814 -2.088 1
1 787 . 18 1 1 A 63 63 VAL N N 63 117.546 115.091 2.455 1
1 788 . 18 1 1 A 64 64 PRO HA H 64 4.458 4.620 -0.162 1
1 795 . 18 1 1 A 64 64 PRO C C 64 177.166 176.912 0.254 1
1 796 . 18 1 1 A 64 64 PRO CA C 64 63.661 63.052 0.609 1
1 797 . 18 1 1 A 64 64 PRO CB C 64 32.321 31.666 0.655 1
1 800 . 18 1 1 A 65 65 GLY H H 65 8.463 8.599 -0.136 1
1 801 . 18 1 1 A 65 65 GLY HA2 H 65 3.882 3.669 0.213 1
1 802 . 18 1 1 A 65 65 GLY HA3 H 65 3.602 3.697 -0.095 1
1 803 . 18 1 1 A 65 65 GLY C C 65 172.406 172.742 -0.336 1
1 804 . 18 1 1 A 65 65 GLY CA C 65 45.933 45.350 0.583 1
1 805 . 18 1 1 A 65 65 GLY N N 65 109.819 109.297 0.522 1
1 806 . 18 1 1 A 66 66 LEU H H 66 7.534 8.282 -0.748 1
1 807 . 18 1 1 A 66 66 LEU HA H 66 4.940 5.012 -0.072 1
1 817 . 18 1 1 A 66 66 LEU C C 66 176.237 175.665 0.572 1
1 818 . 18 1 1 A 66 66 LEU CA C 66 53.687 53.261 0.426 1
1 819 . 18 1 1 A 66 66 LEU CB C 66 46.108 44.046 2.062 1
1 823 . 18 1 1 A 66 66 LEU N N 66 122.249 125.237 -2.988 1
1 824 . 18 1 1 A 67 67 TRP H H 67 8.916 9.350 -0.434 1
1 825 . 18 1 1 A 67 67 TRP HA H 67 5.526 5.404 0.122 1
1 834 . 18 1 1 A 67 67 TRP C C 67 175.670 175.314 0.356 1
1 835 . 18 1 1 A 67 67 TRP CA C 67 56.241 55.530 0.711 1
1 836 . 18 1 1 A 67 67 TRP CB C 67 33.314 32.897 0.417 1
1 842 . 18 1 1 A 67 67 TRP N N 67 121.160 124.550 -3.390 1
1 844 . 18 1 1 A 68 68 ARG H H 68 8.772 8.836 -0.064 1
1 845 . 18 1 1 A 68 68 ARG HA H 68 4.832 5.163 -0.331 1
1 853 . 18 1 1 A 68 68 ARG C C 68 174.720 175.280 -0.560 1
1 854 . 18 1 1 A 68 68 ARG CA C 68 54.690 54.755 -0.065 1
1 855 . 18 1 1 A 68 68 ARG CB C 68 35.176 33.872 1.304 1
1 858 . 18 1 1 A 68 68 ARG N N 68 117.471 120.130 -2.659 1
1 860 . 18 1 1 A 69 69 LEU H H 69 9.355 8.579 0.776 1
1 861 . 18 1 1 A 69 69 LEU HA H 69 4.557 4.704 -0.147 1
1 871 . 18 1 1 A 69 69 LEU C C 69 177.180 176.421 0.759 1
1 872 . 18 1 1 A 69 69 LEU CA C 69 55.780 53.936 1.844 1
1 873 . 18 1 1 A 69 69 LEU CB C 69 42.736 43.671 -0.935 1
1 877 . 18 1 1 A 69 69 LEU N N 69 125.211 120.802 4.409 1
1 878 . 18 1 1 A 70 70 LEU H H 70 8.058 8.518 -0.460 1
1 879 . 18 1 1 A 70 70 LEU HA H 70 4.364 4.249 0.115 1
1 889 . 18 1 1 A 70 70 LEU C C 70 176.808 177.000 -0.192 1
1 890 . 18 1 1 A 70 70 LEU CA C 70 55.257 54.557 0.700 1
1 891 . 18 1 1 A 70 70 LEU CB C 70 42.413 40.169 2.244 1
1 895 . 18 1 1 A 70 70 LEU N N 70 125.525 121.117 4.408 1
1 1 . 19 1 1 A 2 2 SER HA H 2 4.126 4.664 -0.538 1
1 4 . 19 1 1 A 2 2 SER CA C 2 57.564 58.157 -0.593 1
1 5 . 19 1 1 A 2 2 SER CB C 2 63.953 64.440 -0.487 1
1 6 . 19 1 1 A 3 3 GLU HA H 3 4.408 4.104 0.304 1
1 11 . 19 1 1 A 3 3 GLU C C 3 176.658 178.665 -2.007 1
1 12 . 19 1 1 A 3 3 GLU CA C 3 56.802 59.367 -2.565 1
1 13 . 19 1 1 A 3 3 GLU CB C 3 30.674 29.161 1.513 1
1 15 . 19 1 1 A 4 4 SER H H 4 8.650 8.052 0.598 1
1 16 . 19 1 1 A 4 4 SER HA H 4 4.463 4.089 0.374 1
1 19 . 19 1 1 A 4 4 SER C C 4 175.949 175.786 0.163 1
1 20 . 19 1 1 A 4 4 SER CA C 4 58.557 62.150 -3.593 1
1 21 . 19 1 1 A 4 4 SER CB C 4 63.834 62.850 0.984 1
1 22 . 19 1 1 A 4 4 SER N N 4 118.042 118.486 -0.444 1
1 23 . 19 1 1 A 5 5 ILE H H 5 8.404 7.425 0.979 1
1 24 . 19 1 1 A 5 5 ILE HA H 5 3.902 3.495 0.407 1
1 34 . 19 1 1 A 5 5 ILE C C 5 176.608 178.550 -1.942 1
1 35 . 19 1 1 A 5 5 ILE CA C 5 62.662 64.976 -2.314 1
1 36 . 19 1 1 A 5 5 ILE CB C 5 37.622 37.703 -0.081 1
1 40 . 19 1 1 A 5 5 ILE N N 5 124.711 121.373 3.338 1
1 41 . 19 1 1 A 6 6 VAL H H 6 7.602 7.955 -0.353 1
1 42 . 19 1 1 A 6 6 VAL HA H 6 3.293 3.236 0.057 1
1 50 . 19 1 1 A 6 6 VAL C C 6 177.088 177.773 -0.685 1
1 51 . 19 1 1 A 6 6 VAL CA C 6 67.180 66.527 0.653 1
1 52 . 19 1 1 A 6 6 VAL CB C 6 31.517 31.759 -0.242 1
1 55 . 19 1 1 A 6 6 VAL N N 6 119.974 120.053 -0.079 1
1 56 . 19 1 1 A 7 7 THR H H 7 7.515 7.648 -0.133 1
1 57 . 19 1 1 A 7 7 THR HA H 7 3.823 3.883 -0.060 1
1 62 . 19 1 1 A 7 7 THR C C 7 176.978 176.362 0.616 1
1 63 . 19 1 1 A 7 7 THR CA C 7 66.257 67.033 -0.776 1
1 64 . 19 1 1 A 7 7 THR CB C 7 68.410 68.560 -0.150 1
1 66 . 19 1 1 A 7 7 THR N N 7 114.177 116.702 -2.525 1
1 67 . 19 1 1 A 8 8 LYS H H 8 7.807 8.325 -0.518 1
1 68 . 19 1 1 A 8 8 LYS HA H 8 4.066 3.941 0.125 1
1 77 . 19 1 1 A 8 8 LYS C C 8 178.733 178.432 0.301 1
1 78 . 19 1 1 A 8 8 LYS CA C 8 59.338 59.723 -0.385 1
1 79 . 19 1 1 A 8 8 LYS CB C 8 32.002 32.014 -0.012 1
1 83 . 19 1 1 A 8 8 LYS N N 8 123.387 120.449 2.938 1
1 84 . 19 1 1 A 9 9 ILE H H 9 8.288 7.594 0.694 1
1 85 . 19 1 1 A 9 9 ILE HA H 9 3.421 3.550 -0.129 1
1 95 . 19 1 1 A 9 9 ILE C C 9 177.187 178.321 -1.134 1
1 96 . 19 1 1 A 9 9 ILE CA C 9 65.772 65.966 -0.194 1
1 97 . 19 1 1 A 9 9 ILE CB C 9 37.183 37.855 -0.672 1
1 101 . 19 1 1 A 9 9 ILE N N 9 119.543 118.722 0.821 1
1 102 . 19 1 1 A 10 10 ILE H H 10 8.073 8.158 -0.085 1
1 103 . 19 1 1 A 10 10 ILE HA H 10 3.305 3.503 -0.198 1
1 113 . 19 1 1 A 10 10 ILE C C 10 177.308 178.229 -0.921 1
1 114 . 19 1 1 A 10 10 ILE CA C 10 66.704 65.302 1.402 1
1 115 . 19 1 1 A 10 10 ILE CB C 10 37.840 37.951 -0.111 1
1 119 . 19 1 1 A 10 10 ILE N N 10 119.219 120.500 -1.281 1
1 120 . 19 1 1 A 11 11 SER H H 11 7.861 8.064 -0.203 1
1 121 . 19 1 1 A 11 11 SER HA H 11 4.250 4.184 0.066 1
1 124 . 19 1 1 A 11 11 SER C C 11 176.918 177.407 -0.489 1
1 125 . 19 1 1 A 11 11 SER CA C 11 61.911 61.288 0.623 1
1 126 . 19 1 1 A 11 11 SER CB C 11 62.998 62.944 0.054 1
1 127 . 19 1 1 A 11 11 SER N N 11 113.959 115.241 -1.282 1
1 128 . 19 1 1 A 12 12 ILE H H 12 8.250 7.929 0.321 1
1 129 . 19 1 1 A 12 12 ILE HA H 12 3.801 3.626 0.175 1
1 139 . 19 1 1 A 12 12 ILE C C 12 178.130 177.823 0.307 1
1 140 . 19 1 1 A 12 12 ILE CA C 12 65.023 64.803 0.220 1
1 141 . 19 1 1 A 12 12 ILE CB C 12 38.195 37.590 0.605 1
1 145 . 19 1 1 A 12 12 ILE N N 12 123.767 122.401 1.366 1
1 146 . 19 1 1 A 13 13 VAL H H 13 8.308 7.876 0.432 1
1 147 . 19 1 1 A 13 13 VAL HA H 13 3.435 3.483 -0.048 1
1 155 . 19 1 1 A 13 13 VAL C C 13 177.283 177.997 -0.714 1
1 156 . 19 1 1 A 13 13 VAL CA C 13 67.693 66.966 0.727 1
1 157 . 19 1 1 A 13 13 VAL CB C 13 31.139 31.504 -0.365 1
1 160 . 19 1 1 A 13 13 VAL N N 13 120.066 119.941 0.125 1
1 161 . 19 1 1 A 14 14 GLN H H 14 8.612 7.883 0.729 1
1 162 . 19 1 1 A 14 14 GLN HA H 14 3.831 3.990 -0.159 1
1 169 . 19 1 1 A 14 14 GLN C C 14 178.256 178.500 -0.244 1
1 170 . 19 1 1 A 14 14 GLN CA C 14 59.660 59.336 0.324 1
1 171 . 19 1 1 A 14 14 GLN CB C 14 29.456 28.206 1.250 1
1 174 . 19 1 1 A 14 14 GLN N N 14 118.099 119.468 -1.369 1
1 176 . 19 1 1 A 15 15 GLU H H 15 8.378 8.396 -0.018 1
1 177 . 19 1 1 A 15 15 GLU HA H 15 4.110 4.088 0.022 1
1 182 . 19 1 1 A 15 15 GLU C C 15 179.659 179.060 0.599 1
1 183 . 19 1 1 A 15 15 GLU CA C 15 59.476 59.272 0.204 1
1 184 . 19 1 1 A 15 15 GLU CB C 15 29.725 29.289 0.436 1
1 186 . 19 1 1 A 15 15 GLU N N 15 118.580 119.410 -0.830 1
1 187 . 19 1 1 A 16 16 ARG H H 16 8.439 8.112 0.327 1
1 188 . 19 1 1 A 16 16 ARG HA H 16 4.157 4.154 0.003 1
1 196 . 19 1 1 A 16 16 ARG C C 16 179.276 178.596 0.680 1
1 197 . 19 1 1 A 16 16 ARG CA C 16 58.141 59.616 -1.475 1
1 198 . 19 1 1 A 16 16 ARG CB C 16 29.434 29.880 -0.446 1
1 201 . 19 1 1 A 16 16 ARG N N 16 118.688 119.376 -0.688 1
1 203 . 19 1 1 A 17 17 GLN H H 17 8.861 7.781 1.080 1
1 204 . 19 1 1 A 17 17 GLN HA H 17 4.236 4.238 -0.002 1
1 211 . 19 1 1 A 17 17 GLN C C 17 178.736 177.213 1.523 1
1 212 . 19 1 1 A 17 17 GLN CA C 17 59.683 57.713 1.970 1
1 213 . 19 1 1 A 17 17 GLN CB C 17 29.960 28.483 1.477 1
1 216 . 19 1 1 A 17 17 GLN N N 17 120.427 118.421 2.006 1
1 218 . 19 1 1 A 18 18 ASN H H 18 8.017 7.834 0.183 1
1 219 . 19 1 1 A 18 18 ASN HA H 18 4.605 4.605 0.000 1
1 224 . 19 1 1 A 18 18 ASN C C 18 177.906 178.190 -0.284 1
1 225 . 19 1 1 A 18 18 ASN CA C 18 55.375 55.570 -0.195 1
1 226 . 19 1 1 A 18 18 ASN CB C 18 38.383 38.915 -0.532 1
1 228 . 19 1 1 A 18 18 ASN N N 18 117.033 117.285 -0.252 1
1 230 . 19 1 1 A 19 19 MET H H 19 7.994 8.259 -0.265 1
1 231 . 19 1 1 A 19 19 MET HA H 19 4.372 4.224 0.148 1
1 236 . 19 1 1 A 19 19 MET C C 19 176.518 178.022 -1.504 1
1 237 . 19 1 1 A 19 19 MET CA C 19 57.623 58.116 -0.493 1
1 238 . 19 1 1 A 19 19 MET CB C 19 33.248 33.479 -0.231 1
1 240 . 19 1 1 A 19 19 MET N N 19 119.320 118.958 0.362 1
1 241 . 19 1 1 A 20 20 ASP H H 20 7.800 8.435 -0.635 1
1 242 . 19 1 1 A 20 20 ASP HA H 20 4.990 4.584 0.406 1
1 245 . 19 1 1 A 20 20 ASP C C 20 176.082 176.297 -0.215 1
1 246 . 19 1 1 A 20 20 ASP CA C 20 53.796 54.210 -0.414 1
1 247 . 19 1 1 A 20 20 ASP CB C 20 40.409 40.927 -0.518 1
1 248 . 19 1 1 A 20 20 ASP N N 20 119.127 119.557 -0.430 1
1 249 . 19 1 1 A 21 21 ASP H H 21 8.136 7.822 0.314 1
1 250 . 19 1 1 A 21 21 ASP HA H 21 4.497 5.102 -0.605 1
1 253 . 19 1 1 A 21 21 ASP C C 21 176.264 176.066 0.198 1
1 254 . 19 1 1 A 21 21 ASP CA C 21 55.508 56.056 -0.548 1
1 255 . 19 1 1 A 21 21 ASP CB C 21 40.063 40.530 -0.467 1
1 256 . 19 1 1 A 21 21 ASP N N 21 118.276 118.508 -0.232 1
1 257 . 19 1 1 A 22 22 GLY H H 22 8.728 8.403 0.325 1
1 258 . 19 1 1 A 22 22 GLY HA2 H 22 4.189 4.071 0.118 1
1 259 . 19 1 1 A 22 22 GLY HA3 H 22 3.683 4.074 -0.391 1
1 260 . 19 1 1 A 22 22 GLY C C 22 174.304 173.383 0.921 1
1 261 . 19 1 1 A 22 22 GLY CA C 22 45.629 45.675 -0.046 1
1 262 . 19 1 1 A 22 22 GLY N N 22 105.878 106.857 -0.979 1
1 263 . 19 1 1 A 23 23 ALA H H 23 7.473 7.743 -0.270 1
1 264 . 19 1 1 A 23 23 ALA HA H 23 4.519 4.694 -0.175 1
1 268 . 19 1 1 A 23 23 ALA C C 23 174.065 175.488 -1.423 1
1 269 . 19 1 1 A 23 23 ALA CA C 23 51.142 49.886 1.256 1
1 270 . 19 1 1 A 23 23 ALA CB C 23 18.283 20.247 -1.964 1
1 271 . 19 1 1 A 23 23 ALA N N 23 125.323 122.016 3.307 1
1 272 . 19 1 1 A 24 24 PRO HA H 24 4.590 4.545 0.045 1
1 279 . 19 1 1 A 24 24 PRO C C 24 175.253 176.856 -1.603 1
1 280 . 19 1 1 A 24 24 PRO CA C 24 62.186 62.946 -0.760 1
1 281 . 19 1 1 A 24 24 PRO CB C 24 32.931 32.238 0.693 1
1 284 . 19 1 1 A 25 25 VAL H H 25 9.334 8.629 0.705 1
1 285 . 19 1 1 A 25 25 VAL HA H 25 4.378 4.208 0.170 1
1 293 . 19 1 1 A 25 25 VAL C C 25 176.439 176.016 0.423 1
1 294 . 19 1 1 A 25 25 VAL CA C 25 61.482 62.593 -1.111 1
1 295 . 19 1 1 A 25 25 VAL CB C 25 34.781 32.285 2.496 1
1 298 . 19 1 1 A 25 25 VAL N N 25 120.408 123.290 -2.882 1
1 299 . 19 1 1 A 26 26 LYS H H 26 9.300 9.008 0.292 1
1 300 . 19 1 1 A 26 26 LYS HA H 26 4.982 4.546 0.436 1
1 309 . 19 1 1 A 26 26 LYS C C 26 179.008 177.957 1.051 1
1 310 . 19 1 1 A 26 26 LYS CA C 26 56.908 56.031 0.877 1
1 311 . 19 1 1 A 26 26 LYS CB C 26 34.071 33.443 0.628 1
1 315 . 19 1 1 A 26 26 LYS N N 26 126.177 126.085 0.092 1
1 316 . 19 1 1 A 27 27 THR H H 27 8.618 8.374 0.244 1
1 317 . 19 1 1 A 27 27 THR HA H 27 3.662 3.990 -0.328 1
1 322 . 19 1 1 A 27 27 THR C C 27 176.442 176.464 -0.022 1
1 323 . 19 1 1 A 27 27 THR CA C 27 67.591 65.936 1.655 1
1 324 . 19 1 1 A 27 27 THR CB C 27 68.868 68.886 -0.018 1
1 326 . 19 1 1 A 27 27 THR N N 27 119.020 117.726 1.294 1
1 327 . 19 1 1 A 28 28 ARG H H 28 9.288 8.206 1.082 1
1 328 . 19 1 1 A 28 28 ARG HA H 28 3.879 4.043 -0.164 1
1 335 . 19 1 1 A 28 28 ARG C C 28 176.884 178.876 -1.992 1
1 336 . 19 1 1 A 28 28 ARG CA C 28 59.431 59.605 -0.174 1
1 337 . 19 1 1 A 28 28 ARG CB C 28 29.953 30.323 -0.370 1
1 340 . 19 1 1 A 28 28 ARG N N 28 119.100 121.405 -2.305 1
1 341 . 19 1 1 A 29 29 ASP H H 29 6.907 8.234 -1.327 1
1 342 . 19 1 1 A 29 29 ASP HA H 29 4.550 4.430 0.120 1
1 345 . 19 1 1 A 29 29 ASP C C 29 179.050 178.766 0.284 1
1 346 . 19 1 1 A 29 29 ASP CA C 29 57.262 57.174 0.088 1
1 347 . 19 1 1 A 29 29 ASP CB C 29 40.191 40.918 -0.727 1
1 348 . 19 1 1 A 29 29 ASP N N 29 117.490 119.850 -2.360 1
1 349 . 19 1 1 A 30 30 ILE H H 30 7.554 7.639 -0.085 1
1 350 . 19 1 1 A 30 30 ILE HA H 30 3.595 3.638 -0.043 1
1 360 . 19 1 1 A 30 30 ILE C C 30 176.907 177.590 -0.683 1
1 361 . 19 1 1 A 30 30 ILE CA C 30 65.002 65.870 -0.868 1
1 362 . 19 1 1 A 30 30 ILE CB C 30 37.999 38.841 -0.842 1
1 366 . 19 1 1 A 30 30 ILE N N 30 120.978 121.012 -0.034 1
1 367 . 19 1 1 A 31 31 ALA H H 31 8.269 8.389 -0.120 1
1 368 . 19 1 1 A 31 31 ALA HA H 31 3.720 3.980 -0.260 1
1 372 . 19 1 1 A 31 31 ALA C C 31 179.170 179.058 0.112 1
1 373 . 19 1 1 A 31 31 ALA CA C 31 56.354 55.297 1.057 1
1 374 . 19 1 1 A 31 31 ALA CB C 31 17.843 17.907 -0.064 1
1 375 . 19 1 1 A 31 31 ALA N N 31 121.171 121.783 -0.612 1
1 376 . 19 1 1 A 32 32 ASP H H 32 8.293 8.347 -0.054 1
1 377 . 19 1 1 A 32 32 ASP HA H 32 4.422 4.331 0.091 1
1 380 . 19 1 1 A 32 32 ASP C C 32 179.136 178.200 0.936 1
1 381 . 19 1 1 A 32 32 ASP CA C 32 57.109 57.115 -0.006 1
1 382 . 19 1 1 A 32 32 ASP CB C 32 40.523 41.110 -0.587 1
1 383 . 19 1 1 A 32 32 ASP N N 32 116.467 118.828 -2.361 1
1 384 . 19 1 1 A 33 33 ALA H H 33 7.536 7.972 -0.436 1
1 385 . 19 1 1 A 33 33 ALA HA H 33 4.222 4.173 0.049 1
1 389 . 19 1 1 A 33 33 ALA C C 33 179.056 180.203 -1.147 1
1 390 . 19 1 1 A 33 33 ALA CA C 33 54.469 54.663 -0.194 1
1 391 . 19 1 1 A 33 33 ALA CB C 33 19.085 18.339 0.746 1
1 392 . 19 1 1 A 33 33 ALA N N 33 120.859 121.467 -0.608 1
1 393 . 19 1 1 A 34 34 ALA H H 34 8.296 7.787 0.509 1
1 394 . 19 1 1 A 34 34 ALA HA H 34 4.101 4.225 -0.124 1
1 398 . 19 1 1 A 34 34 ALA C C 34 176.912 178.046 -1.134 1
1 399 . 19 1 1 A 34 34 ALA CA C 34 52.380 52.652 -0.272 1
1 400 . 19 1 1 A 34 34 ALA CB C 34 18.817 19.671 -0.854 1
1 401 . 19 1 1 A 34 34 ALA N N 34 118.203 117.360 0.843 1
1 402 . 19 1 1 A 35 35 GLY H H 35 7.911 8.102 -0.191 1
1 403 . 19 1 1 A 35 35 GLY HA2 H 35 3.968 3.918 0.050 1
1 404 . 19 1 1 A 35 35 GLY HA3 H 35 3.968 3.923 0.045 1
1 405 . 19 1 1 A 35 35 GLY C C 35 174.374 173.971 0.403 1
1 406 . 19 1 1 A 35 35 GLY CA C 35 46.388 45.370 1.018 1
1 407 . 19 1 1 A 35 35 GLY N N 35 107.752 107.677 0.075 1
1 408 . 19 1 1 A 36 36 LEU H H 36 7.758 7.879 -0.121 1
1 409 . 19 1 1 A 36 36 LEU HA H 36 4.887 4.607 0.280 1
1 419 . 19 1 1 A 36 36 LEU C C 36 175.941 176.256 -0.315 1
1 420 . 19 1 1 A 36 36 LEU CA C 36 52.443 54.356 -1.913 1
1 421 . 19 1 1 A 36 36 LEU CB C 36 47.885 42.689 5.196 1
1 425 . 19 1 1 A 36 36 LEU N N 36 118.719 123.001 -4.282 1
1 426 . 19 1 1 A 37 37 SER H H 37 8.603 8.097 0.506 1
1 427 . 19 1 1 A 37 37 SER HA H 37 4.565 4.639 -0.074 1
1 430 . 19 1 1 A 37 37 SER C C 37 175.512 175.452 0.060 1
1 431 . 19 1 1 A 37 37 SER CA C 37 57.262 57.697 -0.435 1
1 432 . 19 1 1 A 37 37 SER CB C 37 65.155 63.879 1.276 1
1 433 . 19 1 1 A 37 37 SER N N 37 115.095 116.162 -1.067 1
1 434 . 19 1 1 A 38 38 ILE H H 38 8.822 8.841 -0.019 1
1 435 . 19 1 1 A 38 38 ILE HA H 38 3.650 3.746 -0.096 1
1 445 . 19 1 1 A 38 38 ILE C C 38 176.849 177.555 -0.706 1
1 446 . 19 1 1 A 38 38 ILE CA C 38 64.557 65.073 -0.516 1
1 447 . 19 1 1 A 38 38 ILE CB C 38 37.451 37.988 -0.537 1
1 451 . 19 1 1 A 38 38 ILE N N 38 122.026 127.549 -5.523 1
1 452 . 19 1 1 A 39 39 TYR H H 39 7.839 8.465 -0.626 1
1 453 . 19 1 1 A 39 39 TYR HA H 39 4.112 4.235 -0.123 1
1 460 . 19 1 1 A 39 39 TYR C C 39 177.703 177.599 0.104 1
1 461 . 19 1 1 A 39 39 TYR CA C 39 60.856 60.950 -0.094 1
1 462 . 19 1 1 A 39 39 TYR CB C 39 38.402 37.222 1.180 1
1 467 . 19 1 1 A 39 39 TYR N N 39 118.759 119.961 -1.202 1
1 468 . 19 1 1 A 40 40 GLN H H 40 7.687 7.340 0.347 1
1 469 . 19 1 1 A 40 40 GLN HA H 40 3.865 3.731 0.134 1
1 476 . 19 1 1 A 40 40 GLN C C 40 178.735 178.203 0.532 1
1 477 . 19 1 1 A 40 40 GLN CA C 40 58.089 58.155 -0.066 1
1 478 . 19 1 1 A 40 40 GLN CB C 40 29.950 28.166 1.784 1
1 481 . 19 1 1 A 40 40 GLN N N 40 116.772 120.861 -4.089 1
1 483 . 19 1 1 A 41 41 VAL H H 41 8.494 8.351 0.143 1
1 484 . 19 1 1 A 41 41 VAL HA H 41 3.835 3.503 0.332 1
1 492 . 19 1 1 A 41 41 VAL C C 41 176.977 177.941 -0.964 1
1 493 . 19 1 1 A 41 41 VAL CA C 41 66.102 67.043 -0.941 1
1 494 . 19 1 1 A 41 41 VAL CB C 41 31.105 31.539 -0.434 1
1 497 . 19 1 1 A 41 41 VAL N N 41 117.192 119.973 -2.781 1
1 498 . 19 1 1 A 42 42 ARG H H 42 8.179 8.270 -0.091 1
1 499 . 19 1 1 A 42 42 ARG HA H 42 3.708 4.004 -0.296 1
1 506 . 19 1 1 A 42 42 ARG C C 42 177.570 178.474 -0.904 1
1 507 . 19 1 1 A 42 42 ARG CA C 42 60.349 58.530 1.819 1
1 508 . 19 1 1 A 42 42 ARG CB C 42 30.047 29.660 0.387 1
1 511 . 19 1 1 A 42 42 ARG N N 42 120.574 120.088 0.486 1
1 512 . 19 1 1 A 43 43 LEU H H 43 6.982 7.658 -0.676 1
1 513 . 19 1 1 A 43 43 LEU HA H 43 3.939 3.911 0.028 1
1 523 . 19 1 1 A 43 43 LEU C C 43 180.397 178.565 1.832 1
1 524 . 19 1 1 A 43 43 LEU CA C 43 58.119 57.851 0.268 1
1 525 . 19 1 1 A 43 43 LEU CB C 43 41.294 41.843 -0.549 1
1 529 . 19 1 1 A 43 43 LEU N N 43 117.189 121.644 -4.455 1
1 530 . 19 1 1 A 44 44 TYR H H 44 7.026 7.784 -0.758 1
1 531 . 19 1 1 A 44 44 TYR HA H 44 4.253 4.177 0.076 1
1 538 . 19 1 1 A 44 44 TYR C C 44 178.411 178.114 0.297 1
1 539 . 19 1 1 A 44 44 TYR CA C 44 60.941 60.936 0.005 1
1 540 . 19 1 1 A 44 44 TYR CB C 44 38.889 38.007 0.882 1
1 545 . 19 1 1 A 44 44 TYR N N 44 117.020 117.500 -0.480 1
1 546 . 19 1 1 A 45 45 LEU H H 45 8.429 8.501 -0.072 1
1 547 . 19 1 1 A 45 45 LEU HA H 45 3.486 3.535 -0.049 1
1 557 . 19 1 1 A 45 45 LEU C C 45 178.648 178.764 -0.116 1
1 558 . 19 1 1 A 45 45 LEU CA C 45 57.915 57.545 0.370 1
1 559 . 19 1 1 A 45 45 LEU CB C 45 39.073 40.311 -1.238 1
1 563 . 19 1 1 A 45 45 LEU N N 45 119.649 119.940 -0.291 1
1 564 . 19 1 1 A 46 46 GLU H H 46 8.309 8.129 0.180 1
1 565 . 19 1 1 A 46 46 GLU HA H 46 4.286 3.892 0.394 1
1 570 . 19 1 1 A 46 46 GLU C C 46 179.577 178.927 0.650 1
1 571 . 19 1 1 A 46 46 GLU CA C 46 59.570 60.188 -0.618 1
1 572 . 19 1 1 A 46 46 GLU CB C 46 29.034 29.110 -0.076 1
1 574 . 19 1 1 A 46 46 GLU N N 46 117.366 119.909 -2.543 1
1 575 . 19 1 1 A 47 47 GLN H H 47 7.493 7.957 -0.464 1
1 576 . 19 1 1 A 47 47 GLN HA H 47 4.243 4.010 0.233 1
1 583 . 19 1 1 A 47 47 GLN C C 47 178.870 179.171 -0.301 1
1 584 . 19 1 1 A 47 47 GLN CA C 47 59.581 58.708 0.873 1
1 585 . 19 1 1 A 47 47 GLN CB C 47 28.300 27.948 0.352 1
1 588 . 19 1 1 A 47 47 GLN N N 47 119.345 118.854 0.491 1
1 590 . 19 1 1 A 48 48 LEU H H 48 8.160 8.227 -0.067 1
1 591 . 19 1 1 A 48 48 LEU HA H 48 4.211 4.025 0.186 1
1 601 . 19 1 1 A 48 48 LEU C C 48 180.111 179.200 0.911 1
1 602 . 19 1 1 A 48 48 LEU CA C 48 57.179 57.717 -0.538 1
1 603 . 19 1 1 A 48 48 LEU CB C 48 42.067 41.170 0.897 1
1 607 . 19 1 1 A 48 48 LEU N N 48 118.594 119.960 -1.366 1
1 608 . 19 1 1 A 49 49 HIS H H 49 8.864 8.111 0.753 1
1 609 . 19 1 1 A 49 49 HIS HA H 49 5.162 4.542 0.620 1
1 613 . 19 1 1 A 49 49 HIS C C 49 178.801 176.700 2.101 1
1 614 . 19 1 1 A 49 49 HIS CA C 49 58.397 59.678 -1.281 1
1 615 . 19 1 1 A 49 49 HIS CB C 49 29.631 30.318 -0.687 1
1 617 . 19 1 1 A 49 49 HIS N N 49 122.537 117.961 4.576 1
1 618 . 19 1 1 A 50 50 ASP H H 50 8.683 8.386 0.297 1
1 619 . 19 1 1 A 50 50 ASP HA H 50 4.356 4.200 0.156 1
1 622 . 19 1 1 A 50 50 ASP C C 50 178.474 178.026 0.448 1
1 623 . 19 1 1 A 50 50 ASP CA C 50 57.744 57.374 0.370 1
1 624 . 19 1 1 A 50 50 ASP CB C 50 40.575 41.566 -0.991 1
1 625 . 19 1 1 A 50 50 ASP N N 50 123.169 118.265 4.904 1
1 626 . 19 1 1 A 51 51 VAL H H 51 7.606 7.631 -0.025 1
1 627 . 19 1 1 A 51 51 VAL HA H 51 4.514 4.097 0.417 1
1 635 . 19 1 1 A 51 51 VAL C C 51 176.862 176.635 0.227 1
1 636 . 19 1 1 A 51 51 VAL CA C 51 61.590 62.997 -1.407 1
1 637 . 19 1 1 A 51 51 VAL CB C 51 31.423 32.743 -1.320 1
1 640 . 19 1 1 A 51 51 VAL N N 51 109.266 110.952 -1.686 1
1 641 . 19 1 1 A 52 52 GLY H H 52 7.696 7.792 -0.096 1
1 642 . 19 1 1 A 52 52 GLY HA2 H 52 4.172 3.964 0.208 1
1 643 . 19 1 1 A 52 52 GLY HA3 H 52 3.938 4.003 -0.065 1
1 644 . 19 1 1 A 52 52 GLY C C 52 174.276 175.443 -1.167 1
1 645 . 19 1 1 A 52 52 GLY CA C 52 46.228 45.081 1.147 1
1 646 . 19 1 1 A 52 52 GLY N N 52 108.681 110.289 -1.608 1
1 647 . 19 1 1 A 53 53 VAL H H 53 8.046 8.279 -0.233 1
1 648 . 19 1 1 A 53 53 VAL HA H 53 4.079 3.869 0.210 1
1 656 . 19 1 1 A 53 53 VAL C C 53 175.949 176.038 -0.089 1
1 657 . 19 1 1 A 53 53 VAL CA C 53 64.063 65.072 -1.009 1
1 658 . 19 1 1 A 53 53 VAL CB C 53 33.160 32.131 1.029 1
1 661 . 19 1 1 A 53 53 VAL N N 53 117.892 118.686 -0.794 1
1 662 . 19 1 1 A 54 54 LEU H H 54 6.835 7.582 -0.747 1
1 663 . 19 1 1 A 54 54 LEU HA H 54 5.348 5.108 0.240 1
1 673 . 19 1 1 A 54 54 LEU C C 54 175.713 176.207 -0.494 1
1 674 . 19 1 1 A 54 54 LEU CA C 54 52.194 53.081 -0.887 1
1 675 . 19 1 1 A 54 54 LEU CB C 54 46.733 44.750 1.983 1
1 679 . 19 1 1 A 54 54 LEU N N 54 114.848 117.727 -2.879 1
1 680 . 19 1 1 A 55 55 GLU H H 55 9.549 9.460 0.089 1
1 681 . 19 1 1 A 55 55 GLU HA H 55 4.826 5.167 -0.341 1
1 686 . 19 1 1 A 55 55 GLU C C 55 174.661 175.772 -1.111 1
1 687 . 19 1 1 A 55 55 GLU CA C 55 54.637 55.272 -0.635 1
1 688 . 19 1 1 A 55 55 GLU CB C 55 32.891 32.477 0.414 1
1 690 . 19 1 1 A 55 55 GLU N N 55 121.431 120.645 0.786 1
1 691 . 19 1 1 A 56 56 LYS H H 56 8.513 8.259 0.254 1
1 692 . 19 1 1 A 56 56 LYS HA H 56 4.151 4.063 0.088 1
1 701 . 19 1 1 A 56 56 LYS C C 56 176.270 175.348 0.922 1
1 702 . 19 1 1 A 56 56 LYS CA C 56 54.890 55.623 -0.733 1
1 703 . 19 1 1 A 56 56 LYS CB C 56 33.162 32.479 0.683 1
1 707 . 19 1 1 A 56 56 LYS N N 56 126.539 123.683 2.856 1
1 708 . 19 1 1 A 57 57 VAL H H 57 8.279 8.535 -0.256 1
1 709 . 19 1 1 A 57 57 VAL HA H 57 3.820 4.244 -0.424 1
1 717 . 19 1 1 A 57 57 VAL C C 57 175.108 175.173 -0.065 1
1 718 . 19 1 1 A 57 57 VAL CA C 57 62.834 62.132 0.702 1
1 719 . 19 1 1 A 57 57 VAL CB C 57 32.549 30.513 2.036 1
1 722 . 19 1 1 A 57 57 VAL N N 57 126.540 125.777 0.763 1
1 723 . 19 1 1 A 58 58 ASN H H 58 8.383 7.957 0.426 1
1 724 . 19 1 1 A 58 58 ASN HA H 58 4.612 5.199 -0.587 1
1 729 . 19 1 1 A 58 58 ASN C C 58 174.772 175.114 -0.342 1
1 730 . 19 1 1 A 58 58 ASN CA C 58 52.575 51.910 0.665 1
1 731 . 19 1 1 A 58 58 ASN CB C 58 38.502 39.678 -1.176 1
1 733 . 19 1 1 A 58 58 ASN N N 58 121.767 126.424 -4.657 1
1 735 . 19 1 1 A 59 59 ALA H H 59 8.165 8.747 -0.582 1
1 736 . 19 1 1 A 59 59 ALA HA H 59 4.251 4.243 0.008 1
1 740 . 19 1 1 A 59 59 ALA C C 59 177.478 177.602 -0.124 1
1 741 . 19 1 1 A 59 59 ALA CA C 59 52.490 55.074 -2.584 1
1 742 . 19 1 1 A 59 59 ALA CB C 59 19.724 19.070 0.654 1
1 743 . 19 1 1 A 59 59 ALA N N 59 125.082 127.747 -2.665 1
1 744 . 19 1 1 A 60 60 GLY H H 60 8.291 7.731 0.560 1
1 745 . 19 1 1 A 60 60 GLY HA2 H 60 4.165 4.036 0.129 1
1 746 . 19 1 1 A 60 60 GLY HA3 H 60 3.853 4.036 -0.183 1
1 747 . 19 1 1 A 60 60 GLY C C 60 174.171 172.499 1.672 1
1 748 . 19 1 1 A 60 60 GLY CA C 60 44.994 44.002 0.992 1
1 749 . 19 1 1 A 60 60 GLY N N 60 108.518 106.853 1.665 1
1 750 . 19 1 1 A 61 61 LYS H H 61 8.189 8.456 -0.267 1
1 751 . 19 1 1 A 61 61 LYS HA H 61 4.320 4.678 -0.358 1
1 760 . 19 1 1 A 61 61 LYS C C 61 177.712 177.301 0.411 1
1 761 . 19 1 1 A 61 61 LYS CA C 61 56.832 55.780 1.052 1
1 762 . 19 1 1 A 61 61 LYS CB C 61 32.641 33.972 -1.331 1
1 766 . 19 1 1 A 61 61 LYS N N 61 120.532 120.849 -0.317 1
1 767 . 19 1 1 A 62 62 GLY H H 62 8.767 8.836 -0.069 1
1 768 . 19 1 1 A 62 62 GLY HA2 H 62 4.021 3.853 0.168 1
1 769 . 19 1 1 A 62 62 GLY HA3 H 62 3.849 3.853 -0.004 1
1 770 . 19 1 1 A 62 62 GLY C C 62 173.782 174.034 -0.252 1
1 771 . 19 1 1 A 62 62 GLY CA C 62 45.844 46.068 -0.224 1
1 772 . 19 1 1 A 62 62 GLY N N 62 111.547 114.515 -2.968 1
1 773 . 19 1 1 A 63 63 VAL H H 63 7.379 7.690 -0.311 1
1 774 . 19 1 1 A 63 63 VAL HA H 63 4.591 4.692 -0.101 1
1 782 . 19 1 1 A 63 63 VAL C C 63 174.262 174.098 0.164 1
1 783 . 19 1 1 A 63 63 VAL CA C 63 59.292 58.240 1.052 1
1 784 . 19 1 1 A 63 63 VAL CB C 63 32.726 33.334 -0.608 1
1 787 . 19 1 1 A 63 63 VAL N N 63 117.546 116.900 0.646 1
1 788 . 19 1 1 A 64 64 PRO HA H 64 4.458 4.598 -0.140 1
1 795 . 19 1 1 A 64 64 PRO C C 64 177.166 176.182 0.984 1
1 796 . 19 1 1 A 64 64 PRO CA C 64 63.661 62.355 1.306 1
1 797 . 19 1 1 A 64 64 PRO CB C 64 32.321 32.234 0.087 1
1 800 . 19 1 1 A 65 65 GLY H H 65 8.463 8.496 -0.033 1
1 801 . 19 1 1 A 65 65 GLY HA2 H 65 3.882 3.729 0.153 1
1 802 . 19 1 1 A 65 65 GLY HA3 H 65 3.602 3.859 -0.257 1
1 803 . 19 1 1 A 65 65 GLY C C 65 172.406 172.692 -0.286 1
1 804 . 19 1 1 A 65 65 GLY CA C 65 45.933 45.366 0.567 1
1 805 . 19 1 1 A 65 65 GLY N N 65 109.819 108.740 1.079 1
1 806 . 19 1 1 A 66 66 LEU H H 66 7.534 8.553 -1.019 1
1 807 . 19 1 1 A 66 66 LEU HA H 66 4.940 5.117 -0.177 1
1 817 . 19 1 1 A 66 66 LEU C C 66 176.237 175.886 0.351 1
1 818 . 19 1 1 A 66 66 LEU CA C 66 53.687 53.291 0.396 1
1 819 . 19 1 1 A 66 66 LEU CB C 66 46.108 43.654 2.454 1
1 823 . 19 1 1 A 66 66 LEU N N 66 122.249 126.659 -4.410 1
1 824 . 19 1 1 A 67 67 TRP H H 67 8.916 9.504 -0.588 1
1 825 . 19 1 1 A 67 67 TRP HA H 67 5.526 5.449 0.077 1
1 834 . 19 1 1 A 67 67 TRP C C 67 175.670 174.910 0.760 1
1 835 . 19 1 1 A 67 67 TRP CA C 67 56.241 55.760 0.481 1
1 836 . 19 1 1 A 67 67 TRP CB C 67 33.314 33.018 0.296 1
1 842 . 19 1 1 A 67 67 TRP N N 67 121.160 124.275 -3.115 1
1 844 . 19 1 1 A 68 68 ARG H H 68 8.772 8.676 0.096 1
1 845 . 19 1 1 A 68 68 ARG HA H 68 4.832 5.026 -0.194 1
1 853 . 19 1 1 A 68 68 ARG C C 68 174.720 175.500 -0.780 1
1 854 . 19 1 1 A 68 68 ARG CA C 68 54.690 54.623 0.067 1
1 855 . 19 1 1 A 68 68 ARG CB C 68 35.176 34.218 0.958 1
1 858 . 19 1 1 A 68 68 ARG N N 68 117.471 123.307 -5.836 1
1 860 . 19 1 1 A 69 69 LEU H H 69 9.355 8.652 0.703 1
1 861 . 19 1 1 A 69 69 LEU HA H 69 4.557 5.185 -0.628 1
1 871 . 19 1 1 A 69 69 LEU C C 69 177.180 176.892 0.288 1
1 872 . 19 1 1 A 69 69 LEU CA C 69 55.780 54.043 1.737 1
1 873 . 19 1 1 A 69 69 LEU CB C 69 42.736 42.855 -0.119 1
1 877 . 19 1 1 A 69 69 LEU N N 69 125.211 122.584 2.627 1
1 878 . 19 1 1 A 70 70 LEU H H 70 8.058 9.073 -1.015 1
1 879 . 19 1 1 A 70 70 LEU HA H 70 4.364 4.749 -0.385 1
1 889 . 19 1 1 A 70 70 LEU C C 70 176.808 176.006 0.802 1
1 890 . 19 1 1 A 70 70 LEU CA C 70 55.257 54.207 1.050 1
1 891 . 19 1 1 A 70 70 LEU CB C 70 42.413 42.909 -0.496 1
1 895 . 19 1 1 A 70 70 LEU N N 70 125.525 118.721 6.804 1
1 1 . 20 1 1 A 2 2 SER HA H 2 4.126 4.176 -0.050 1
1 4 . 20 1 1 A 2 2 SER CA C 2 57.564 59.374 -1.810 1
1 5 . 20 1 1 A 2 2 SER CB C 2 63.953 61.437 2.516 1
1 6 . 20 1 1 A 3 3 GLU HA H 3 4.408 4.023 0.385 1
1 11 . 20 1 1 A 3 3 GLU C C 3 176.658 177.130 -0.472 1
1 12 . 20 1 1 A 3 3 GLU CA C 3 56.802 57.589 -0.787 1
1 13 . 20 1 1 A 3 3 GLU CB C 3 30.674 29.276 1.398 1
1 15 . 20 1 1 A 4 4 SER H H 4 8.650 7.973 0.677 1
1 16 . 20 1 1 A 4 4 SER HA H 4 4.463 4.162 0.301 1
1 19 . 20 1 1 A 4 4 SER C C 4 175.949 176.475 -0.526 1
1 20 . 20 1 1 A 4 4 SER CA C 4 58.557 61.415 -2.858 1
1 21 . 20 1 1 A 4 4 SER CB C 4 63.834 62.454 1.380 1
1 22 . 20 1 1 A 4 4 SER N N 4 118.042 114.693 3.349 1
1 23 . 20 1 1 A 5 5 ILE H H 5 8.404 7.828 0.576 1
1 24 . 20 1 1 A 5 5 ILE HA H 5 3.902 3.636 0.266 1
1 34 . 20 1 1 A 5 5 ILE C C 5 176.608 178.134 -1.526 1
1 35 . 20 1 1 A 5 5 ILE CA C 5 62.662 64.828 -2.166 1
1 36 . 20 1 1 A 5 5 ILE CB C 5 37.622 37.712 -0.090 1
1 40 . 20 1 1 A 5 5 ILE N N 5 124.711 121.946 2.765 1
1 41 . 20 1 1 A 6 6 VAL H H 6 7.602 8.073 -0.471 1
1 42 . 20 1 1 A 6 6 VAL HA H 6 3.293 3.351 -0.058 1
1 50 . 20 1 1 A 6 6 VAL C C 6 177.088 178.114 -1.026 1
1 51 . 20 1 1 A 6 6 VAL CA C 6 67.180 66.598 0.582 1
1 52 . 20 1 1 A 6 6 VAL CB C 6 31.517 31.564 -0.047 1
1 55 . 20 1 1 A 6 6 VAL N N 6 119.974 120.048 -0.074 1
1 56 . 20 1 1 A 7 7 THR H H 7 7.515 7.782 -0.267 1
1 57 . 20 1 1 A 7 7 THR HA H 7 3.823 3.823 0.000 1
1 62 . 20 1 1 A 7 7 THR C C 7 176.978 176.167 0.811 1
1 63 . 20 1 1 A 7 7 THR CA C 7 66.257 66.946 -0.689 1
1 64 . 20 1 1 A 7 7 THR CB C 7 68.410 68.120 0.290 1
1 66 . 20 1 1 A 7 7 THR N N 7 114.177 115.321 -1.144 1
1 67 . 20 1 1 A 8 8 LYS H H 8 7.807 8.374 -0.567 1
1 68 . 20 1 1 A 8 8 LYS HA H 8 4.066 3.963 0.103 1
1 77 . 20 1 1 A 8 8 LYS C C 8 178.733 178.413 0.320 1
1 78 . 20 1 1 A 8 8 LYS CA C 8 59.338 59.981 -0.643 1
1 79 . 20 1 1 A 8 8 LYS CB C 8 32.002 32.322 -0.320 1
1 83 . 20 1 1 A 8 8 LYS N N 8 123.387 120.235 3.152 1
1 84 . 20 1 1 A 9 9 ILE H H 9 8.288 7.909 0.379 1
1 85 . 20 1 1 A 9 9 ILE HA H 9 3.421 3.559 -0.138 1
1 95 . 20 1 1 A 9 9 ILE C C 9 177.187 178.432 -1.245 1
1 96 . 20 1 1 A 9 9 ILE CA C 9 65.772 65.639 0.133 1
1 97 . 20 1 1 A 9 9 ILE CB C 9 37.183 37.726 -0.543 1
1 101 . 20 1 1 A 9 9 ILE N N 9 119.543 118.728 0.815 1
1 102 . 20 1 1 A 10 10 ILE H H 10 8.073 7.888 0.185 1
1 103 . 20 1 1 A 10 10 ILE HA H 10 3.305 3.478 -0.173 1
1 113 . 20 1 1 A 10 10 ILE C C 10 177.308 177.846 -0.538 1
1 114 . 20 1 1 A 10 10 ILE CA C 10 66.704 65.043 1.661 1
1 115 . 20 1 1 A 10 10 ILE CB C 10 37.840 37.472 0.368 1
1 119 . 20 1 1 A 10 10 ILE N N 10 119.219 120.630 -1.411 1
1 120 . 20 1 1 A 11 11 SER H H 11 7.861 8.237 -0.376 1
1 121 . 20 1 1 A 11 11 SER HA H 11 4.250 4.195 0.055 1
1 124 . 20 1 1 A 11 11 SER C C 11 176.918 177.870 -0.952 1
1 125 . 20 1 1 A 11 11 SER CA C 11 61.911 61.718 0.193 1
1 126 . 20 1 1 A 11 11 SER CB C 11 62.998 62.340 0.658 1
1 127 . 20 1 1 A 11 11 SER N N 11 113.959 114.959 -1.000 1
1 128 . 20 1 1 A 12 12 ILE H H 12 8.250 7.511 0.739 1
1 129 . 20 1 1 A 12 12 ILE HA H 12 3.801 3.671 0.130 1
1 139 . 20 1 1 A 12 12 ILE C C 12 178.130 178.036 0.094 1
1 140 . 20 1 1 A 12 12 ILE CA C 12 65.023 64.629 0.394 1
1 141 . 20 1 1 A 12 12 ILE CB C 12 38.195 37.897 0.298 1
1 145 . 20 1 1 A 12 12 ILE N N 12 123.767 122.830 0.937 1
1 146 . 20 1 1 A 13 13 VAL H H 13 8.308 8.019 0.289 1
1 147 . 20 1 1 A 13 13 VAL HA H 13 3.435 3.467 -0.032 1
1 155 . 20 1 1 A 13 13 VAL C C 13 177.283 178.071 -0.788 1
1 156 . 20 1 1 A 13 13 VAL CA C 13 67.693 66.984 0.709 1
1 157 . 20 1 1 A 13 13 VAL CB C 13 31.139 31.531 -0.392 1
1 160 . 20 1 1 A 13 13 VAL N N 13 120.066 120.232 -0.166 1
1 161 . 20 1 1 A 14 14 GLN H H 14 8.612 8.103 0.509 1
1 162 . 20 1 1 A 14 14 GLN HA H 14 3.831 4.029 -0.198 1
1 169 . 20 1 1 A 14 14 GLN C C 14 178.256 177.960 0.296 1
1 170 . 20 1 1 A 14 14 GLN CA C 14 59.660 59.308 0.352 1
1 171 . 20 1 1 A 14 14 GLN CB C 14 29.456 28.165 1.291 1
1 174 . 20 1 1 A 14 14 GLN N N 14 118.099 119.670 -1.571 1
1 176 . 20 1 1 A 15 15 GLU H H 15 8.378 8.453 -0.075 1
1 177 . 20 1 1 A 15 15 GLU HA H 15 4.110 4.017 0.093 1
1 182 . 20 1 1 A 15 15 GLU C C 15 179.659 178.990 0.669 1
1 183 . 20 1 1 A 15 15 GLU CA C 15 59.476 59.811 -0.335 1
1 184 . 20 1 1 A 15 15 GLU CB C 15 29.725 29.531 0.194 1
1 186 . 20 1 1 A 15 15 GLU N N 15 118.580 119.172 -0.592 1
1 187 . 20 1 1 A 16 16 ARG H H 16 8.439 8.144 0.295 1
1 188 . 20 1 1 A 16 16 ARG HA H 16 4.157 4.114 0.043 1
1 196 . 20 1 1 A 16 16 ARG C C 16 179.276 178.325 0.951 1
1 197 . 20 1 1 A 16 16 ARG CA C 16 58.141 59.659 -1.518 1
1 198 . 20 1 1 A 16 16 ARG CB C 16 29.434 29.843 -0.409 1
1 201 . 20 1 1 A 16 16 ARG N N 16 118.688 118.569 0.119 1
1 203 . 20 1 1 A 17 17 GLN H H 17 8.861 7.766 1.095 1
1 204 . 20 1 1 A 17 17 GLN HA H 17 4.236 4.430 -0.194 1
1 211 . 20 1 1 A 17 17 GLN C C 17 178.736 178.263 0.473 1
1 212 . 20 1 1 A 17 17 GLN CA C 17 59.683 57.812 1.871 1
1 213 . 20 1 1 A 17 17 GLN CB C 17 29.960 28.387 1.573 1
1 216 . 20 1 1 A 17 17 GLN N N 17 120.427 117.614 2.813 1
1 218 . 20 1 1 A 18 18 ASN H H 18 8.017 8.418 -0.401 1
1 219 . 20 1 1 A 18 18 ASN HA H 18 4.605 4.589 0.016 1
1 224 . 20 1 1 A 18 18 ASN C C 18 177.906 178.441 -0.535 1
1 225 . 20 1 1 A 18 18 ASN CA C 18 55.375 56.207 -0.832 1
1 226 . 20 1 1 A 18 18 ASN CB C 18 38.383 38.425 -0.042 1
1 228 . 20 1 1 A 18 18 ASN N N 18 117.033 118.303 -1.270 1
1 230 . 20 1 1 A 19 19 MET H H 19 7.994 7.741 0.253 1
1 231 . 20 1 1 A 19 19 MET HA H 19 4.372 4.287 0.085 1
1 236 . 20 1 1 A 19 19 MET C C 19 176.518 175.673 0.845 1
1 237 . 20 1 1 A 19 19 MET CA C 19 57.623 58.333 -0.710 1
1 238 . 20 1 1 A 19 19 MET CB C 19 33.248 33.435 -0.187 1
1 240 . 20 1 1 A 19 19 MET N N 19 119.320 118.462 0.858 1
1 241 . 20 1 1 A 20 20 ASP H H 20 7.800 8.157 -0.357 1
1 242 . 20 1 1 A 20 20 ASP HA H 20 4.990 4.840 0.150 1
1 245 . 20 1 1 A 20 20 ASP C C 20 176.082 176.086 -0.004 1
1 246 . 20 1 1 A 20 20 ASP CA C 20 53.796 52.844 0.952 1
1 247 . 20 1 1 A 20 20 ASP CB C 20 40.409 41.804 -1.395 1
1 248 . 20 1 1 A 20 20 ASP N N 20 119.127 119.292 -0.165 1
1 249 . 20 1 1 A 21 21 ASP H H 21 8.136 9.098 -0.962 1
1 250 . 20 1 1 A 21 21 ASP HA H 21 4.497 4.739 -0.242 1
1 253 . 20 1 1 A 21 21 ASP C C 21 176.264 176.616 -0.352 1
1 254 . 20 1 1 A 21 21 ASP CA C 21 55.508 56.034 -0.526 1
1 255 . 20 1 1 A 21 21 ASP CB C 21 40.063 39.931 0.132 1
1 256 . 20 1 1 A 21 21 ASP N N 21 118.276 125.302 -7.026 1
1 257 . 20 1 1 A 22 22 GLY H H 22 8.728 7.960 0.768 1
1 258 . 20 1 1 A 22 22 GLY HA2 H 22 4.189 4.011 0.178 1
1 259 . 20 1 1 A 22 22 GLY HA3 H 22 3.683 4.014 -0.331 1
1 260 . 20 1 1 A 22 22 GLY C C 22 174.304 173.595 0.709 1
1 261 . 20 1 1 A 22 22 GLY CA C 22 45.629 45.262 0.367 1
1 262 . 20 1 1 A 22 22 GLY N N 22 105.878 106.838 -0.960 1
1 263 . 20 1 1 A 23 23 ALA H H 23 7.473 7.609 -0.136 1
1 264 . 20 1 1 A 23 23 ALA HA H 23 4.519 4.478 0.041 1
1 268 . 20 1 1 A 23 23 ALA C C 23 174.065 175.741 -1.676 1
1 269 . 20 1 1 A 23 23 ALA CA C 23 51.142 49.140 2.002 1
1 270 . 20 1 1 A 23 23 ALA CB C 23 18.283 20.323 -2.040 1
1 271 . 20 1 1 A 23 23 ALA N N 23 125.323 122.720 2.603 1
1 272 . 20 1 1 A 24 24 PRO HA H 24 4.590 4.674 -0.084 1
1 279 . 20 1 1 A 24 24 PRO C C 24 175.253 176.829 -1.576 1
1 280 . 20 1 1 A 24 24 PRO CA C 24 62.186 62.696 -0.510 1
1 281 . 20 1 1 A 24 24 PRO CB C 24 32.931 32.532 0.399 1
1 284 . 20 1 1 A 25 25 VAL H H 25 9.334 8.643 0.691 1
1 285 . 20 1 1 A 25 25 VAL HA H 25 4.378 4.228 0.150 1
1 293 . 20 1 1 A 25 25 VAL C C 25 176.439 175.898 0.541 1
1 294 . 20 1 1 A 25 25 VAL CA C 25 61.482 62.657 -1.175 1
1 295 . 20 1 1 A 25 25 VAL CB C 25 34.781 32.434 2.347 1
1 298 . 20 1 1 A 25 25 VAL N N 25 120.408 123.097 -2.689 1
1 299 . 20 1 1 A 26 26 LYS H H 26 9.300 9.046 0.254 1
1 300 . 20 1 1 A 26 26 LYS HA H 26 4.982 4.614 0.368 1
1 309 . 20 1 1 A 26 26 LYS C C 26 179.008 177.706 1.302 1
1 310 . 20 1 1 A 26 26 LYS CA C 26 56.908 55.721 1.187 1
1 311 . 20 1 1 A 26 26 LYS CB C 26 34.071 33.094 0.977 1
1 315 . 20 1 1 A 26 26 LYS N N 26 126.177 125.745 0.432 1
1 316 . 20 1 1 A 27 27 THR H H 27 8.618 8.637 -0.019 1
1 317 . 20 1 1 A 27 27 THR HA H 27 3.662 4.005 -0.343 1
1 322 . 20 1 1 A 27 27 THR C C 27 176.442 176.191 0.251 1
1 323 . 20 1 1 A 27 27 THR CA C 27 67.591 66.028 1.563 1
1 324 . 20 1 1 A 27 27 THR CB C 27 68.868 68.814 0.054 1
1 326 . 20 1 1 A 27 27 THR N N 27 119.020 118.325 0.695 1
1 327 . 20 1 1 A 28 28 ARG H H 28 9.288 8.305 0.983 1
1 328 . 20 1 1 A 28 28 ARG HA H 28 3.879 4.090 -0.211 1
1 335 . 20 1 1 A 28 28 ARG C C 28 176.884 178.640 -1.756 1
1 336 . 20 1 1 A 28 28 ARG CA C 28 59.431 59.632 -0.201 1
1 337 . 20 1 1 A 28 28 ARG CB C 28 29.953 30.236 -0.283 1
1 340 . 20 1 1 A 28 28 ARG N N 28 119.100 121.401 -2.301 1
1 341 . 20 1 1 A 29 29 ASP H H 29 6.907 7.998 -1.091 1
1 342 . 20 1 1 A 29 29 ASP HA H 29 4.550 4.355 0.195 1
1 345 . 20 1 1 A 29 29 ASP C C 29 179.050 178.495 0.555 1
1 346 . 20 1 1 A 29 29 ASP CA C 29 57.262 58.189 -0.927 1
1 347 . 20 1 1 A 29 29 ASP CB C 29 40.191 41.703 -1.512 1
1 348 . 20 1 1 A 29 29 ASP N N 29 117.490 119.603 -2.113 1
1 349 . 20 1 1 A 30 30 ILE H H 30 7.554 7.827 -0.273 1
1 350 . 20 1 1 A 30 30 ILE HA H 30 3.595 3.669 -0.074 1
1 360 . 20 1 1 A 30 30 ILE C C 30 176.907 178.016 -1.109 1
1 361 . 20 1 1 A 30 30 ILE CA C 30 65.002 65.823 -0.821 1
1 362 . 20 1 1 A 30 30 ILE CB C 30 37.999 37.808 0.191 1
1 366 . 20 1 1 A 30 30 ILE N N 30 120.978 118.842 2.136 1
1 367 . 20 1 1 A 31 31 ALA H H 31 8.269 8.567 -0.298 1
1 368 . 20 1 1 A 31 31 ALA HA H 31 3.720 4.015 -0.295 1
1 372 . 20 1 1 A 31 31 ALA C C 31 179.170 179.080 0.090 1
1 373 . 20 1 1 A 31 31 ALA CA C 31 56.354 55.875 0.479 1
1 374 . 20 1 1 A 31 31 ALA CB C 31 17.843 18.167 -0.324 1
1 375 . 20 1 1 A 31 31 ALA N N 31 121.171 122.405 -1.234 1
1 376 . 20 1 1 A 32 32 ASP H H 32 8.293 8.520 -0.227 1
1 377 . 20 1 1 A 32 32 ASP HA H 32 4.422 4.395 0.027 1
1 380 . 20 1 1 A 32 32 ASP C C 32 179.136 178.110 1.026 1
1 381 . 20 1 1 A 32 32 ASP CA C 32 57.109 56.665 0.444 1
1 382 . 20 1 1 A 32 32 ASP CB C 32 40.523 41.227 -0.704 1
1 383 . 20 1 1 A 32 32 ASP N N 32 116.467 117.967 -1.500 1
1 384 . 20 1 1 A 33 33 ALA H H 33 7.536 8.224 -0.688 1
1 385 . 20 1 1 A 33 33 ALA HA H 33 4.222 4.126 0.096 1
1 389 . 20 1 1 A 33 33 ALA C C 33 179.056 180.042 -0.986 1
1 390 . 20 1 1 A 33 33 ALA CA C 33 54.469 54.756 -0.287 1
1 391 . 20 1 1 A 33 33 ALA CB C 33 19.085 18.029 1.056 1
1 392 . 20 1 1 A 33 33 ALA N N 33 120.859 120.777 0.082 1
1 393 . 20 1 1 A 34 34 ALA H H 34 8.296 7.692 0.604 1
1 394 . 20 1 1 A 34 34 ALA HA H 34 4.101 4.308 -0.207 1
1 398 . 20 1 1 A 34 34 ALA C C 34 176.912 177.829 -0.917 1
1 399 . 20 1 1 A 34 34 ALA CA C 34 52.380 52.322 0.058 1
1 400 . 20 1 1 A 34 34 ALA CB C 34 18.817 19.768 -0.951 1
1 401 . 20 1 1 A 34 34 ALA N N 34 118.203 117.312 0.891 1
1 402 . 20 1 1 A 35 35 GLY H H 35 7.911 8.417 -0.506 1
1 403 . 20 1 1 A 35 35 GLY HA2 H 35 3.968 3.928 0.040 1
1 404 . 20 1 1 A 35 35 GLY HA3 H 35 3.968 3.933 0.035 1
1 405 . 20 1 1 A 35 35 GLY C C 35 174.374 173.931 0.443 1
1 406 . 20 1 1 A 35 35 GLY CA C 35 46.388 46.204 0.184 1
1 407 . 20 1 1 A 35 35 GLY N N 35 107.752 107.705 0.047 1
1 408 . 20 1 1 A 36 36 LEU H H 36 7.758 7.913 -0.155 1
1 409 . 20 1 1 A 36 36 LEU HA H 36 4.887 4.886 0.001 1
1 419 . 20 1 1 A 36 36 LEU C C 36 175.941 175.680 0.261 1
1 420 . 20 1 1 A 36 36 LEU CA C 36 52.443 52.750 -0.307 1
1 421 . 20 1 1 A 36 36 LEU CB C 36 47.885 44.959 2.926 1
1 425 . 20 1 1 A 36 36 LEU N N 36 118.719 120.384 -1.665 1
1 426 . 20 1 1 A 37 37 SER H H 37 8.603 8.988 -0.385 1
1 427 . 20 1 1 A 37 37 SER HA H 37 4.565 4.569 -0.004 1
1 430 . 20 1 1 A 37 37 SER C C 37 175.512 175.820 -0.308 1
1 431 . 20 1 1 A 37 37 SER CA C 37 57.262 58.611 -1.349 1
1 432 . 20 1 1 A 37 37 SER CB C 37 65.155 63.971 1.184 1
1 433 . 20 1 1 A 37 37 SER N N 37 115.095 117.477 -2.382 1
1 434 . 20 1 1 A 38 38 ILE H H 38 8.822 8.868 -0.046 1
1 435 . 20 1 1 A 38 38 ILE HA H 38 3.650 3.828 -0.178 1
1 445 . 20 1 1 A 38 38 ILE C C 38 176.849 177.482 -0.633 1
1 446 . 20 1 1 A 38 38 ILE CA C 38 64.557 65.041 -0.484 1
1 447 . 20 1 1 A 38 38 ILE CB C 38 37.451 37.801 -0.350 1
1 451 . 20 1 1 A 38 38 ILE N N 38 122.026 124.659 -2.633 1
1 452 . 20 1 1 A 39 39 TYR H H 39 7.839 8.491 -0.652 1
1 453 . 20 1 1 A 39 39 TYR HA H 39 4.112 4.019 0.093 1
1 460 . 20 1 1 A 39 39 TYR C C 39 177.703 177.445 0.258 1
1 461 . 20 1 1 A 39 39 TYR CA C 39 60.856 62.127 -1.271 1
1 462 . 20 1 1 A 39 39 TYR CB C 39 38.402 38.552 -0.150 1
1 467 . 20 1 1 A 39 39 TYR N N 39 118.759 120.499 -1.740 1
1 468 . 20 1 1 A 40 40 GLN H H 40 7.687 8.287 -0.600 1
1 469 . 20 1 1 A 40 40 GLN HA H 40 3.865 3.885 -0.020 1
1 476 . 20 1 1 A 40 40 GLN C C 40 178.735 178.674 0.061 1
1 477 . 20 1 1 A 40 40 GLN CA C 40 58.089 58.580 -0.491 1
1 478 . 20 1 1 A 40 40 GLN CB C 40 29.950 28.577 1.373 1
1 481 . 20 1 1 A 40 40 GLN N N 40 116.772 118.493 -1.721 1
1 483 . 20 1 1 A 41 41 VAL H H 41 8.494 8.229 0.265 1
1 484 . 20 1 1 A 41 41 VAL HA H 41 3.835 3.649 0.186 1
1 492 . 20 1 1 A 41 41 VAL C C 41 176.977 177.555 -0.578 1
1 493 . 20 1 1 A 41 41 VAL CA C 41 66.102 66.992 -0.890 1
1 494 . 20 1 1 A 41 41 VAL CB C 41 31.105 31.518 -0.413 1
1 497 . 20 1 1 A 41 41 VAL N N 41 117.192 120.313 -3.121 1
1 498 . 20 1 1 A 42 42 ARG H H 42 8.179 8.567 -0.388 1
1 499 . 20 1 1 A 42 42 ARG HA H 42 3.708 3.936 -0.228 1
1 506 . 20 1 1 A 42 42 ARG C C 42 177.570 178.495 -0.925 1
1 507 . 20 1 1 A 42 42 ARG CA C 42 60.349 59.985 0.364 1
1 508 . 20 1 1 A 42 42 ARG CB C 42 30.047 29.775 0.272 1
1 511 . 20 1 1 A 42 42 ARG N N 42 120.574 119.892 0.682 1
1 512 . 20 1 1 A 43 43 LEU H H 43 6.982 7.640 -0.658 1
1 513 . 20 1 1 A 43 43 LEU HA H 43 3.939 3.811 0.128 1
1 523 . 20 1 1 A 43 43 LEU C C 43 180.397 178.739 1.658 1
1 524 . 20 1 1 A 43 43 LEU CA C 43 58.119 57.764 0.355 1
1 525 . 20 1 1 A 43 43 LEU CB C 43 41.294 41.707 -0.413 1
1 529 . 20 1 1 A 43 43 LEU N N 43 117.189 118.821 -1.632 1
1 530 . 20 1 1 A 44 44 TYR H H 44 7.026 7.754 -0.728 1
1 531 . 20 1 1 A 44 44 TYR HA H 44 4.253 4.244 0.009 1
1 538 . 20 1 1 A 44 44 TYR C C 44 178.411 178.155 0.256 1
1 539 . 20 1 1 A 44 44 TYR CA C 44 60.941 60.594 0.347 1
1 540 . 20 1 1 A 44 44 TYR CB C 44 38.889 38.429 0.460 1
1 545 . 20 1 1 A 44 44 TYR N N 44 117.020 117.842 -0.822 1
1 546 . 20 1 1 A 45 45 LEU H H 45 8.429 8.793 -0.364 1
1 547 . 20 1 1 A 45 45 LEU HA H 45 3.486 3.546 -0.060 1
1 557 . 20 1 1 A 45 45 LEU C C 45 178.648 178.599 0.049 1
1 558 . 20 1 1 A 45 45 LEU CA C 45 57.915 57.550 0.365 1
1 559 . 20 1 1 A 45 45 LEU CB C 45 39.073 40.402 -1.329 1
1 563 . 20 1 1 A 45 45 LEU N N 45 119.649 120.137 -0.488 1
1 564 . 20 1 1 A 46 46 GLU H H 46 8.309 8.111 0.198 1
1 565 . 20 1 1 A 46 46 GLU HA H 46 4.286 3.946 0.340 1
1 570 . 20 1 1 A 46 46 GLU C C 46 179.577 178.839 0.738 1
1 571 . 20 1 1 A 46 46 GLU CA C 46 59.570 60.107 -0.537 1
1 572 . 20 1 1 A 46 46 GLU CB C 46 29.034 29.294 -0.260 1
1 574 . 20 1 1 A 46 46 GLU N N 46 117.366 119.857 -2.491 1
1 575 . 20 1 1 A 47 47 GLN H H 47 7.493 8.092 -0.599 1
1 576 . 20 1 1 A 47 47 GLN HA H 47 4.243 3.839 0.404 1
1 583 . 20 1 1 A 47 47 GLN C C 47 178.870 178.953 -0.083 1
1 584 . 20 1 1 A 47 47 GLN CA C 47 59.581 59.118 0.463 1
1 585 . 20 1 1 A 47 47 GLN CB C 47 28.300 28.014 0.286 1
1 588 . 20 1 1 A 47 47 GLN N N 47 119.345 119.095 0.250 1
1 590 . 20 1 1 A 48 48 LEU H H 48 8.160 8.533 -0.373 1
1 591 . 20 1 1 A 48 48 LEU HA H 48 4.211 3.993 0.218 1
1 601 . 20 1 1 A 48 48 LEU C C 48 180.111 179.217 0.894 1
1 602 . 20 1 1 A 48 48 LEU CA C 48 57.179 57.703 -0.524 1
1 603 . 20 1 1 A 48 48 LEU CB C 48 42.067 40.917 1.150 1
1 607 . 20 1 1 A 48 48 LEU N N 48 118.594 119.257 -0.663 1
1 608 . 20 1 1 A 49 49 HIS H H 49 8.864 7.936 0.928 1
1 609 . 20 1 1 A 49 49 HIS HA H 49 5.162 4.381 0.781 1
1 613 . 20 1 1 A 49 49 HIS C C 49 178.801 177.289 1.512 1
1 614 . 20 1 1 A 49 49 HIS CA C 49 58.397 59.828 -1.431 1
1 615 . 20 1 1 A 49 49 HIS CB C 49 29.631 30.173 -0.542 1
1 617 . 20 1 1 A 49 49 HIS N N 49 122.537 118.250 4.287 1
1 618 . 20 1 1 A 50 50 ASP H H 50 8.683 8.348 0.335 1
1 619 . 20 1 1 A 50 50 ASP HA H 50 4.356 4.232 0.124 1
1 622 . 20 1 1 A 50 50 ASP C C 50 178.474 177.646 0.828 1
1 623 . 20 1 1 A 50 50 ASP CA C 50 57.744 56.440 1.304 1
1 624 . 20 1 1 A 50 50 ASP CB C 50 40.575 40.610 -0.035 1
1 625 . 20 1 1 A 50 50 ASP N N 50 123.169 119.366 3.803 1
1 626 . 20 1 1 A 51 51 VAL H H 51 7.606 7.421 0.185 1
1 627 . 20 1 1 A 51 51 VAL HA H 51 4.514 4.405 0.109 1
1 635 . 20 1 1 A 51 51 VAL C C 51 176.862 175.795 1.067 1
1 636 . 20 1 1 A 51 51 VAL CA C 51 61.590 61.001 0.589 1
1 637 . 20 1 1 A 51 51 VAL CB C 51 31.423 31.315 0.108 1
1 640 . 20 1 1 A 51 51 VAL N N 51 109.266 112.038 -2.772 1
1 641 . 20 1 1 A 52 52 GLY H H 52 7.696 7.670 0.026 1
1 642 . 20 1 1 A 52 52 GLY HA2 H 52 4.172 3.984 0.188 1
1 643 . 20 1 1 A 52 52 GLY HA3 H 52 3.938 3.997 -0.059 1
1 644 . 20 1 1 A 52 52 GLY C C 52 174.276 174.491 -0.215 1
1 645 . 20 1 1 A 52 52 GLY CA C 52 46.228 46.343 -0.115 1
1 646 . 20 1 1 A 52 52 GLY N N 52 108.681 110.771 -2.090 1
1 647 . 20 1 1 A 53 53 VAL H H 53 8.046 8.331 -0.285 1
1 648 . 20 1 1 A 53 53 VAL HA H 53 4.079 4.157 -0.078 1
1 656 . 20 1 1 A 53 53 VAL C C 53 175.949 175.814 0.135 1
1 657 . 20 1 1 A 53 53 VAL CA C 53 64.063 63.822 0.241 1
1 658 . 20 1 1 A 53 53 VAL CB C 53 33.160 33.475 -0.315 1
1 661 . 20 1 1 A 53 53 VAL N N 53 117.892 116.956 0.936 1
1 662 . 20 1 1 A 54 54 LEU H H 54 6.835 7.568 -0.733 1
1 663 . 20 1 1 A 54 54 LEU HA H 54 5.348 5.052 0.296 1
1 673 . 20 1 1 A 54 54 LEU C C 54 175.713 175.720 -0.007 1
1 674 . 20 1 1 A 54 54 LEU CA C 54 52.194 53.093 -0.899 1
1 675 . 20 1 1 A 54 54 LEU CB C 54 46.733 44.658 2.075 1
1 679 . 20 1 1 A 54 54 LEU N N 54 114.848 117.893 -3.045 1
1 680 . 20 1 1 A 55 55 GLU H H 55 9.549 9.422 0.127 1
1 681 . 20 1 1 A 55 55 GLU HA H 55 4.826 5.256 -0.430 1
1 686 . 20 1 1 A 55 55 GLU C C 55 174.661 175.882 -1.221 1
1 687 . 20 1 1 A 55 55 GLU CA C 55 54.637 54.693 -0.056 1
1 688 . 20 1 1 A 55 55 GLU CB C 55 32.891 33.516 -0.625 1
1 690 . 20 1 1 A 55 55 GLU N N 55 121.431 121.889 -0.458 1
1 691 . 20 1 1 A 56 56 LYS H H 56 8.513 8.277 0.236 1
1 692 . 20 1 1 A 56 56 LYS HA H 56 4.151 4.038 0.113 1
1 701 . 20 1 1 A 56 56 LYS C C 56 176.270 175.920 0.350 1
1 702 . 20 1 1 A 56 56 LYS CA C 56 54.890 55.890 -1.000 1
1 703 . 20 1 1 A 56 56 LYS CB C 56 33.162 32.544 0.618 1
1 707 . 20 1 1 A 56 56 LYS N N 56 126.539 121.348 5.191 1
1 708 . 20 1 1 A 57 57 VAL H H 57 8.279 8.171 0.108 1
1 709 . 20 1 1 A 57 57 VAL HA H 57 3.820 4.320 -0.500 1
1 717 . 20 1 1 A 57 57 VAL C C 57 175.108 175.967 -0.859 1
1 718 . 20 1 1 A 57 57 VAL CA C 57 62.834 61.186 1.648 1
1 719 . 20 1 1 A 57 57 VAL CB C 57 32.549 34.155 -1.606 1
1 722 . 20 1 1 A 57 57 VAL N N 57 126.540 122.482 4.058 1
1 723 . 20 1 1 A 58 58 ASN H H 58 8.383 9.060 -0.677 1
1 724 . 20 1 1 A 58 58 ASN HA H 58 4.612 4.237 0.375 1
1 729 . 20 1 1 A 58 58 ASN C C 58 174.772 173.785 0.987 1
1 730 . 20 1 1 A 58 58 ASN CA C 58 52.575 53.833 -1.258 1
1 731 . 20 1 1 A 58 58 ASN CB C 58 38.502 36.873 1.629 1
1 733 . 20 1 1 A 58 58 ASN N N 58 121.767 124.432 -2.665 1
1 735 . 20 1 1 A 59 59 ALA H H 59 8.165 7.725 0.440 1
1 736 . 20 1 1 A 59 59 ALA HA H 59 4.251 5.009 -0.758 1
1 740 . 20 1 1 A 59 59 ALA C C 59 177.478 175.984 1.494 1
1 741 . 20 1 1 A 59 59 ALA CA C 59 52.490 51.019 1.471 1
1 742 . 20 1 1 A 59 59 ALA CB C 59 19.724 23.132 -3.408 1
1 743 . 20 1 1 A 59 59 ALA N N 59 125.082 122.881 2.201 1
1 744 . 20 1 1 A 60 60 GLY H H 60 8.291 8.102 0.189 1
1 745 . 20 1 1 A 60 60 GLY HA2 H 60 4.165 4.148 0.017 1
1 746 . 20 1 1 A 60 60 GLY HA3 H 60 3.853 4.153 -0.300 1
1 747 . 20 1 1 A 60 60 GLY C C 60 174.171 172.786 1.385 1
1 748 . 20 1 1 A 60 60 GLY CA C 60 44.994 45.180 -0.186 1
1 749 . 20 1 1 A 60 60 GLY N N 60 108.518 106.102 2.416 1
1 750 . 20 1 1 A 61 61 LYS H H 61 8.189 8.453 -0.264 1
1 751 . 20 1 1 A 61 61 LYS HA H 61 4.320 4.779 -0.459 1
1 760 . 20 1 1 A 61 61 LYS C C 61 177.712 176.373 1.339 1
1 761 . 20 1 1 A 61 61 LYS CA C 61 56.832 54.838 1.994 1
1 762 . 20 1 1 A 61 61 LYS CB C 61 32.641 34.234 -1.593 1
1 766 . 20 1 1 A 61 61 LYS N N 61 120.532 123.012 -2.480 1
1 767 . 20 1 1 A 62 62 GLY H H 62 8.767 8.993 -0.226 1
1 768 . 20 1 1 A 62 62 GLY HA2 H 62 4.021 3.870 0.151 1
1 769 . 20 1 1 A 62 62 GLY HA3 H 62 3.849 3.874 -0.025 1
1 770 . 20 1 1 A 62 62 GLY C C 62 173.782 173.724 0.058 1
1 771 . 20 1 1 A 62 62 GLY CA C 62 45.844 46.986 -1.142 1
1 772 . 20 1 1 A 62 62 GLY N N 62 111.547 111.798 -0.251 1
1 773 . 20 1 1 A 63 63 VAL H H 63 7.379 7.655 -0.276 1
1 774 . 20 1 1 A 63 63 VAL HA H 63 4.591 4.730 -0.139 1
1 782 . 20 1 1 A 63 63 VAL C C 63 174.262 175.416 -1.154 1
1 783 . 20 1 1 A 63 63 VAL CA C 63 59.292 58.188 1.104 1
1 784 . 20 1 1 A 63 63 VAL CB C 63 32.726 33.865 -1.139 1
1 787 . 20 1 1 A 63 63 VAL N N 63 117.546 114.020 3.526 1
1 788 . 20 1 1 A 64 64 PRO HA H 64 4.458 4.554 -0.096 1
1 795 . 20 1 1 A 64 64 PRO C C 64 177.166 177.523 -0.357 1
1 796 . 20 1 1 A 64 64 PRO CA C 64 63.661 63.502 0.159 1
1 797 . 20 1 1 A 64 64 PRO CB C 64 32.321 32.295 0.026 1
1 800 . 20 1 1 A 65 65 GLY H H 65 8.463 8.005 0.458 1
1 801 . 20 1 1 A 65 65 GLY HA2 H 65 3.882 3.769 0.113 1
1 802 . 20 1 1 A 65 65 GLY HA3 H 65 3.602 4.018 -0.416 1
1 803 . 20 1 1 A 65 65 GLY C C 65 172.406 173.983 -1.577 1
1 804 . 20 1 1 A 65 65 GLY CA C 65 45.933 45.522 0.411 1
1 805 . 20 1 1 A 65 65 GLY N N 65 109.819 109.846 -0.027 1
1 806 . 20 1 1 A 66 66 LEU H H 66 7.534 8.095 -0.561 1
1 807 . 20 1 1 A 66 66 LEU HA H 66 4.940 4.997 -0.057 1
1 817 . 20 1 1 A 66 66 LEU C C 66 176.237 175.420 0.817 1
1 818 . 20 1 1 A 66 66 LEU CA C 66 53.687 53.190 0.497 1
1 819 . 20 1 1 A 66 66 LEU CB C 66 46.108 43.723 2.385 1
1 823 . 20 1 1 A 66 66 LEU N N 66 122.249 124.558 -2.309 1
1 824 . 20 1 1 A 67 67 TRP H H 67 8.916 9.400 -0.484 1
1 825 . 20 1 1 A 67 67 TRP HA H 67 5.526 5.305 0.221 1
1 834 . 20 1 1 A 67 67 TRP C C 67 175.670 175.892 -0.222 1
1 835 . 20 1 1 A 67 67 TRP CA C 67 56.241 55.844 0.397 1
1 836 . 20 1 1 A 67 67 TRP CB C 67 33.314 33.295 0.019 1
1 842 . 20 1 1 A 67 67 TRP N N 67 121.160 124.262 -3.102 1
1 844 . 20 1 1 A 68 68 ARG H H 68 8.772 8.836 -0.064 1
1 845 . 20 1 1 A 68 68 ARG HA H 68 4.832 5.036 -0.204 1
1 853 . 20 1 1 A 68 68 ARG C C 68 174.720 175.437 -0.717 1
1 854 . 20 1 1 A 68 68 ARG CA C 68 54.690 54.266 0.424 1
1 855 . 20 1 1 A 68 68 ARG CB C 68 35.176 33.580 1.596 1
1 858 . 20 1 1 A 68 68 ARG N N 68 117.471 121.655 -4.184 1
1 860 . 20 1 1 A 69 69 LEU H H 69 9.355 8.812 0.543 1
1 861 . 20 1 1 A 69 69 LEU HA H 69 4.557 5.248 -0.691 1
1 871 . 20 1 1 A 69 69 LEU C C 69 177.180 176.029 1.151 1
1 872 . 20 1 1 A 69 69 LEU CA C 69 55.780 52.811 2.969 1
1 873 . 20 1 1 A 69 69 LEU CB C 69 42.736 45.946 -3.210 1
1 877 . 20 1 1 A 69 69 LEU N N 69 125.211 117.210 8.001 1
1 878 . 20 1 1 A 70 70 LEU H H 70 8.058 8.387 -0.329 1
1 879 . 20 1 1 A 70 70 LEU HA H 70 4.364 4.759 -0.395 1
1 889 . 20 1 1 A 70 70 LEU C C 70 176.808 177.492 -0.684 1
1 890 . 20 1 1 A 70 70 LEU CA C 70 55.257 54.049 1.208 1
1 891 . 20 1 1 A 70 70 LEU CB C 70 42.413 43.517 -1.104 1
1 895 . 20 1 1 A 70 70 LEU N N 70 125.525 118.103 7.422 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 68 0.817 1
2 1 1 1 "RMS(OBS, PRED)" CA 69 0.969 1
3 1 1 1 "RMS(OBS, PRED)" CB 63 1.125 1
4 1 1 1 "RMS(OBS, PRED)" H 65 0.455 1
5 1 1 1 "RMS(OBS, PRED)" HA 75 0.225 1
6 1 1 1 "RMS(OBS, PRED)" N 65 2.564 1
7 1 2 1 "RMS(OBS, PRED)" C 68 0.836 1
8 1 2 1 "RMS(OBS, PRED)" CA 69 0.980 1
9 1 2 1 "RMS(OBS, PRED)" CB 63 1.253 1
10 1 2 1 "RMS(OBS, PRED)" H 65 0.523 1
11 1 2 1 "RMS(OBS, PRED)" HA 75 0.277 1
12 1 2 1 "RMS(OBS, PRED)" N 65 2.482 1
13 1 3 1 "RMS(OBS, PRED)" C 68 0.889 1
14 1 3 1 "RMS(OBS, PRED)" CA 69 1.026 1
15 1 3 1 "RMS(OBS, PRED)" CB 63 1.228 1
16 1 3 1 "RMS(OBS, PRED)" H 65 0.438 1
17 1 3 1 "RMS(OBS, PRED)" HA 75 0.233 1
18 1 3 1 "RMS(OBS, PRED)" N 65 2.628 1
19 1 4 1 "RMS(OBS, PRED)" C 68 0.939 1
20 1 4 1 "RMS(OBS, PRED)" CA 69 1.126 1
21 1 4 1 "RMS(OBS, PRED)" CB 63 1.141 1
22 1 4 1 "RMS(OBS, PRED)" H 65 0.544 1
23 1 4 1 "RMS(OBS, PRED)" HA 75 0.247 1
24 1 4 1 "RMS(OBS, PRED)" N 65 2.719 1
25 1 5 1 "RMS(OBS, PRED)" C 68 0.876 1
26 1 5 1 "RMS(OBS, PRED)" CA 69 1.092 1
27 1 5 1 "RMS(OBS, PRED)" CB 63 1.092 1
28 1 5 1 "RMS(OBS, PRED)" H 65 0.522 1
29 1 5 1 "RMS(OBS, PRED)" HA 75 0.213 1
30 1 5 1 "RMS(OBS, PRED)" N 65 2.492 1
31 1 6 1 "RMS(OBS, PRED)" C 68 0.869 1
32 1 6 1 "RMS(OBS, PRED)" CA 69 1.099 1
33 1 6 1 "RMS(OBS, PRED)" CB 63 1.389 1
34 1 6 1 "RMS(OBS, PRED)" H 65 0.512 1
35 1 6 1 "RMS(OBS, PRED)" HA 75 0.244 1
36 1 6 1 "RMS(OBS, PRED)" N 65 2.633 1
37 1 7 1 "RMS(OBS, PRED)" C 68 0.936 1
38 1 7 1 "RMS(OBS, PRED)" CA 69 1.064 1
39 1 7 1 "RMS(OBS, PRED)" CB 63 1.248 1
40 1 7 1 "RMS(OBS, PRED)" H 65 0.511 1
41 1 7 1 "RMS(OBS, PRED)" HA 75 0.247 1
42 1 7 1 "RMS(OBS, PRED)" N 65 2.796 1
43 1 8 1 "RMS(OBS, PRED)" C 68 0.872 1
44 1 8 1 "RMS(OBS, PRED)" CA 69 0.988 1
45 1 8 1 "RMS(OBS, PRED)" CB 63 1.237 1
46 1 8 1 "RMS(OBS, PRED)" H 65 0.542 1
47 1 8 1 "RMS(OBS, PRED)" HA 75 0.245 1
48 1 8 1 "RMS(OBS, PRED)" N 65 2.603 1
49 1 9 1 "RMS(OBS, PRED)" C 68 0.904 1
50 1 9 1 "RMS(OBS, PRED)" CA 69 1.063 1
51 1 9 1 "RMS(OBS, PRED)" CB 63 1.144 1
52 1 9 1 "RMS(OBS, PRED)" H 65 0.518 1
53 1 9 1 "RMS(OBS, PRED)" HA 75 0.253 1
54 1 9 1 "RMS(OBS, PRED)" N 65 2.701 1
55 1 10 1 "RMS(OBS, PRED)" C 68 0.896 1
56 1 10 1 "RMS(OBS, PRED)" CA 69 0.895 1
57 1 10 1 "RMS(OBS, PRED)" CB 63 1.354 1
58 1 10 1 "RMS(OBS, PRED)" H 65 0.486 1
59 1 10 1 "RMS(OBS, PRED)" HA 75 0.254 1
60 1 10 1 "RMS(OBS, PRED)" N 65 2.529 1
61 1 11 1 "RMS(OBS, PRED)" C 68 0.863 1
62 1 11 1 "RMS(OBS, PRED)" CA 69 1.184 1
63 1 11 1 "RMS(OBS, PRED)" CB 63 1.231 1
64 1 11 1 "RMS(OBS, PRED)" H 65 0.510 1
65 1 11 1 "RMS(OBS, PRED)" HA 75 0.187 1
66 1 11 1 "RMS(OBS, PRED)" N 65 2.815 1
67 1 12 1 "RMS(OBS, PRED)" C 68 0.781 1
68 1 12 1 "RMS(OBS, PRED)" CA 69 0.978 1
69 1 12 1 "RMS(OBS, PRED)" CB 63 1.090 1
70 1 12 1 "RMS(OBS, PRED)" H 65 0.478 1
71 1 12 1 "RMS(OBS, PRED)" HA 75 0.247 1
72 1 12 1 "RMS(OBS, PRED)" N 65 2.550 1
73 1 13 1 "RMS(OBS, PRED)" C 68 0.901 1
74 1 13 1 "RMS(OBS, PRED)" CA 69 0.956 1
75 1 13 1 "RMS(OBS, PRED)" CB 63 1.326 1
76 1 13 1 "RMS(OBS, PRED)" H 65 0.498 1
77 1 13 1 "RMS(OBS, PRED)" HA 75 0.217 1
78 1 13 1 "RMS(OBS, PRED)" N 65 2.655 1
79 1 14 1 "RMS(OBS, PRED)" C 68 0.854 1
80 1 14 1 "RMS(OBS, PRED)" CA 69 0.955 1
81 1 14 1 "RMS(OBS, PRED)" CB 63 1.186 1
82 1 14 1 "RMS(OBS, PRED)" H 65 0.495 1
83 1 14 1 "RMS(OBS, PRED)" HA 75 0.260 1
84 1 14 1 "RMS(OBS, PRED)" N 65 2.538 1
85 1 15 1 "RMS(OBS, PRED)" C 68 0.855 1
86 1 15 1 "RMS(OBS, PRED)" CA 69 0.998 1
87 1 15 1 "RMS(OBS, PRED)" CB 63 1.029 1
88 1 15 1 "RMS(OBS, PRED)" H 65 0.503 1
89 1 15 1 "RMS(OBS, PRED)" HA 75 0.253 1
90 1 15 1 "RMS(OBS, PRED)" N 65 2.243 1
91 1 16 1 "RMS(OBS, PRED)" C 68 0.927 1
92 1 16 1 "RMS(OBS, PRED)" CA 69 0.858 1
93 1 16 1 "RMS(OBS, PRED)" CB 63 1.282 1
94 1 16 1 "RMS(OBS, PRED)" H 65 0.501 1
95 1 16 1 "RMS(OBS, PRED)" HA 75 0.259 1
96 1 16 1 "RMS(OBS, PRED)" N 65 2.726 1
97 1 17 1 "RMS(OBS, PRED)" C 68 0.921 1
98 1 17 1 "RMS(OBS, PRED)" CA 69 1.014 1
99 1 17 1 "RMS(OBS, PRED)" CB 63 1.258 1
100 1 17 1 "RMS(OBS, PRED)" H 65 0.488 1
101 1 17 1 "RMS(OBS, PRED)" HA 75 0.255 1
102 1 17 1 "RMS(OBS, PRED)" N 65 2.574 1
103 1 18 1 "RMS(OBS, PRED)" C 68 0.938 1
104 1 18 1 "RMS(OBS, PRED)" CA 69 0.933 1
105 1 18 1 "RMS(OBS, PRED)" CB 63 1.377 1
106 1 18 1 "RMS(OBS, PRED)" H 65 0.509 1
107 1 18 1 "RMS(OBS, PRED)" HA 75 0.247 1
108 1 18 1 "RMS(OBS, PRED)" N 65 2.365 1
109 1 19 1 "RMS(OBS, PRED)" C 68 0.901 1
110 1 19 1 "RMS(OBS, PRED)" CA 69 1.094 1
111 1 19 1 "RMS(OBS, PRED)" CB 63 1.171 1
112 1 19 1 "RMS(OBS, PRED)" H 65 0.510 1
113 1 19 1 "RMS(OBS, PRED)" HA 75 0.256 1
114 1 19 1 "RMS(OBS, PRED)" N 65 2.536 1
115 1 20 1 "RMS(OBS, PRED)" C 68 0.887 1
116 1 20 1 "RMS(OBS, PRED)" CA 69 1.069 1
117 1 20 1 "RMS(OBS, PRED)" CB 63 1.241 1
118 1 20 1 "RMS(OBS, PRED)" H 65 0.506 1
119 1 20 1 "RMS(OBS, PRED)" HA 75 0.253 1
120 1 20 1 "RMS(OBS, PRED)" N 65 2.681 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 2 2 SER HA H 2 4.126 4.533 -0.407 2
1 4 . 1 1 A 2 2 SER CA C 2 57.564 58.858 -1.294 2
1 5 . 1 1 A 2 2 SER CB C 2 63.953 63.445 0.508 2
1 6 . 1 1 A 3 3 GLU HA H 3 4.408 4.448 -0.040 2
1 11 . 1 1 A 3 3 GLU C C 3 176.658 176.430 0.228 2
1 12 . 1 1 A 3 3 GLU CA C 3 56.802 56.380 0.422 2
1 13 . 1 1 A 3 3 GLU CB C 3 30.674 30.093 0.581 2
1 15 . 1 1 A 4 4 SER H H 4 8.650 8.416 0.234 2
1 16 . 1 1 A 4 4 SER HA H 4 4.463 4.385 0.078 2
1 19 . 1 1 A 4 4 SER C C 4 175.949 175.099 0.850 2
1 20 . 1 1 A 4 4 SER CA C 4 58.557 59.364 -0.807 2
1 21 . 1 1 A 4 4 SER CB C 4 63.834 62.707 1.127 2
1 22 . 1 1 A 4 4 SER N N 4 118.042 117.574 0.468 2
1 23 . 1 1 A 5 5 ILE H H 5 8.404 8.008 0.396 2
1 24 . 1 1 A 5 5 ILE HA H 5 3.902 3.732 0.170 2
1 34 . 1 1 A 5 5 ILE C C 5 176.608 177.842 -1.234 2
1 35 . 1 1 A 5 5 ILE CA C 5 62.662 64.169 -1.507 2
1 36 . 1 1 A 5 5 ILE CB C 5 37.622 37.673 -0.051 2
1 40 . 1 1 A 5 5 ILE N N 5 124.711 123.508 1.203 2
1 41 . 1 1 A 6 6 VAL H H 6 7.602 7.996 -0.394 2
1 42 . 1 1 A 6 6 VAL HA H 6 3.293 3.392 -0.099 2
1 50 . 1 1 A 6 6 VAL C C 6 177.088 178.132 -1.044 2
1 51 . 1 1 A 6 6 VAL CA C 6 67.180 66.593 0.587 2
1 52 . 1 1 A 6 6 VAL CB C 6 31.517 31.571 -0.054 2
1 55 . 1 1 A 6 6 VAL N N 6 119.974 120.455 -0.481 2
1 56 . 1 1 A 7 7 THR H H 7 7.515 8.065 -0.550 2
1 57 . 1 1 A 7 7 THR HA H 7 3.823 3.845 -0.022 2
1 62 . 1 1 A 7 7 THR C C 7 176.978 176.251 0.727 2
1 63 . 1 1 A 7 7 THR CA C 7 66.257 67.130 -0.873 2
1 64 . 1 1 A 7 7 THR CB C 7 68.410 68.374 0.036 2
1 66 . 1 1 A 7 7 THR N N 7 114.177 116.386 -2.209 2
1 67 . 1 1 A 8 8 LYS H H 8 7.807 8.002 -0.195 2
1 68 . 1 1 A 8 8 LYS HA H 8 4.066 3.975 0.091 2
1 77 . 1 1 A 8 8 LYS C C 8 178.733 178.425 0.308 2
1 78 . 1 1 A 8 8 LYS CA C 8 59.338 59.730 -0.392 2
1 79 . 1 1 A 8 8 LYS CB C 8 32.002 32.107 -0.105 2
1 83 . 1 1 A 8 8 LYS N N 8 123.387 120.503 2.884 2
1 84 . 1 1 A 9 9 ILE H H 9 8.288 7.926 0.362 2
1 85 . 1 1 A 9 9 ILE HA H 9 3.421 3.568 -0.147 2
1 95 . 1 1 A 9 9 ILE C C 9 177.187 178.280 -1.094 2
1 96 . 1 1 A 9 9 ILE CA C 9 65.772 65.700 0.073 2
1 97 . 1 1 A 9 9 ILE CB C 9 37.183 37.851 -0.668 2
1 101 . 1 1 A 9 9 ILE N N 9 119.543 118.898 0.644 2
1 102 . 1 1 A 10 10 ILE H H 10 8.073 8.147 -0.074 2
1 103 . 1 1 A 10 10 ILE HA H 10 3.305 3.510 -0.205 2
1 113 . 1 1 A 10 10 ILE C C 10 177.308 178.082 -0.774 2
1 114 . 1 1 A 10 10 ILE CA C 10 66.704 65.271 1.433 2
1 115 . 1 1 A 10 10 ILE CB C 10 37.840 37.803 0.037 2
1 119 . 1 1 A 10 10 ILE N N 10 119.219 120.618 -1.399 2
1 120 . 1 1 A 11 11 SER H H 11 7.861 8.082 -0.221 2
1 121 . 1 1 A 11 11 SER HA H 11 4.250 4.154 0.096 2
1 124 . 1 1 A 11 11 SER C C 11 176.918 177.071 -0.153 2
1 125 . 1 1 A 11 11 SER CA C 11 61.911 61.792 0.119 2
1 126 . 1 1 A 11 11 SER CB C 11 62.998 62.814 0.184 2
1 127 . 1 1 A 11 11 SER N N 11 113.959 115.426 -1.467 2
1 128 . 1 1 A 12 12 ILE H H 12 8.250 7.855 0.395 2
1 129 . 1 1 A 12 12 ILE HA H 12 3.801 3.661 0.140 2
1 139 . 1 1 A 12 12 ILE C C 12 178.130 178.071 0.059 2
1 140 . 1 1 A 12 12 ILE CA C 12 65.023 64.684 0.339 2
1 141 . 1 1 A 12 12 ILE CB C 12 38.195 37.758 0.437 2
1 145 . 1 1 A 12 12 ILE N N 12 123.767 122.083 1.684 2
1 146 . 1 1 A 13 13 VAL H H 13 8.308 8.067 0.241 2
1 147 . 1 1 A 13 13 VAL HA H 13 3.435 3.521 -0.086 2
1 155 . 1 1 A 13 13 VAL C C 13 177.283 178.006 -0.723 2
1 156 . 1 1 A 13 13 VAL CA C 13 67.693 66.574 1.119 2
1 157 . 1 1 A 13 13 VAL CB C 13 31.139 31.384 -0.245 2
1 160 . 1 1 A 13 13 VAL N N 13 120.066 119.862 0.204 2
1 161 . 1 1 A 14 14 GLN H H 14 8.612 8.132 0.480 2
1 162 . 1 1 A 14 14 GLN HA H 14 3.831 4.010 -0.179 2
1 169 . 1 1 A 14 14 GLN C C 14 178.256 178.238 0.018 2
1 170 . 1 1 A 14 14 GLN CA C 14 59.660 59.337 0.323 2
1 171 . 1 1 A 14 14 GLN CB C 14 29.456 28.215 1.241 2
1 174 . 1 1 A 14 14 GLN N N 14 118.099 119.643 -1.544 2
1 176 . 1 1 A 15 15 GLU H H 15 8.378 8.386 -0.008 2
1 177 . 1 1 A 15 15 GLU HA H 15 4.110 4.039 0.071 2
1 182 . 1 1 A 15 15 GLU C C 15 179.659 179.100 0.559 2
1 183 . 1 1 A 15 15 GLU CA C 15 59.476 59.513 -0.037 2
1 184 . 1 1 A 15 15 GLU CB C 15 29.725 29.184 0.541 2
1 186 . 1 1 A 15 15 GLU N N 15 118.580 119.231 -0.651 2
1 187 . 1 1 A 16 16 ARG H H 16 8.439 8.207 0.232 2
1 188 . 1 1 A 16 16 ARG HA H 16 4.157 4.086 0.071 2
1 196 . 1 1 A 16 16 ARG C C 16 179.276 178.915 0.361 2
1 197 . 1 1 A 16 16 ARG CA C 16 58.141 59.697 -1.556 2
1 198 . 1 1 A 16 16 ARG CB C 16 29.434 29.958 -0.524 2
1 201 . 1 1 A 16 16 ARG N N 16 118.688 118.879 -0.191 2
1 203 . 1 1 A 17 17 GLN H H 17 8.861 7.880 0.981 2
1 204 . 1 1 A 17 17 GLN HA H 17 4.236 4.163 0.073 2
1 211 . 1 1 A 17 17 GLN C C 17 178.736 178.233 0.503 2
1 212 . 1 1 A 17 17 GLN CA C 17 59.683 58.437 1.246 2
1 213 . 1 1 A 17 17 GLN CB C 17 29.960 28.202 1.758 2
1 216 . 1 1 A 17 17 GLN N N 17 120.427 118.512 1.915 2
1 218 . 1 1 A 18 18 ASN H H 18 8.017 8.136 -0.119 2
1 219 . 1 1 A 18 18 ASN HA H 18 4.605 4.566 0.039 2
1 224 . 1 1 A 18 18 ASN C C 18 177.906 177.856 0.050 2
1 225 . 1 1 A 18 18 ASN CA C 18 55.375 55.892 -0.517 2
1 226 . 1 1 A 18 18 ASN CB C 18 38.383 38.324 0.059 2
1 228 . 1 1 A 18 18 ASN N N 18 117.033 118.012 -0.979 2
1 230 . 1 1 A 19 19 MET H H 19 7.994 7.928 0.066 2
1 231 . 1 1 A 19 19 MET HA H 19 4.372 4.319 0.053 2
1 236 . 1 1 A 19 19 MET C C 19 176.518 176.684 -0.166 2
1 237 . 1 1 A 19 19 MET CA C 19 57.623 58.010 -0.387 2
1 238 . 1 1 A 19 19 MET CB C 19 33.248 33.187 0.061 2
1 240 . 1 1 A 19 19 MET N N 19 119.320 117.784 1.536 2
1 241 . 1 1 A 20 20 ASP H H 20 7.800 8.051 -0.251 2
1 242 . 1 1 A 20 20 ASP HA H 20 4.990 4.761 0.229 2
1 245 . 1 1 A 20 20 ASP C C 20 176.082 175.801 0.281 2
1 246 . 1 1 A 20 20 ASP CA C 20 53.796 53.970 -0.174 2
1 247 . 1 1 A 20 20 ASP CB C 20 40.409 41.553 -1.144 2
1 248 . 1 1 A 20 20 ASP N N 20 119.127 118.642 0.485 2
1 249 . 1 1 A 21 21 ASP H H 21 8.136 8.481 -0.345 2
1 250 . 1 1 A 21 21 ASP HA H 21 4.497 4.530 -0.033 2
1 253 . 1 1 A 21 21 ASP C C 21 176.264 176.774 -0.510 2
1 254 . 1 1 A 21 21 ASP CA C 21 55.508 56.154 -0.646 2
1 255 . 1 1 A 21 21 ASP CB C 21 40.063 40.320 -0.257 2
1 256 . 1 1 A 21 21 ASP N N 21 118.276 121.791 -3.515 2
1 257 . 1 1 A 22 22 GLY H H 22 8.728 8.262 0.466 2
1 258 . 1 1 A 22 22 GLY HA2 H 22 4.189 3.978 0.211 2
1 259 . 1 1 A 22 22 GLY HA3 H 22 3.683 3.980 -0.297 2
1 260 . 1 1 A 22 22 GLY C C 22 174.304 173.791 0.513 2
1 261 . 1 1 A 22 22 GLY CA C 22 45.629 45.829 -0.200 2
1 262 . 1 1 A 22 22 GLY N N 22 105.878 108.001 -2.123 2
1 263 . 1 1 A 23 23 ALA H H 23 7.473 7.688 -0.215 2
1 264 . 1 1 A 23 23 ALA HA H 23 4.519 4.586 -0.067 2
1 268 . 1 1 A 23 23 ALA C C 23 174.065 175.746 -1.681 2
1 269 . 1 1 A 23 23 ALA CA C 23 51.142 49.699 1.443 2
1 270 . 1 1 A 23 23 ALA CB C 23 18.283 20.492 -2.209 2
1 271 . 1 1 A 23 23 ALA N N 23 125.323 122.970 2.353 2
1 272 . 1 1 A 24 24 PRO HA H 24 4.590 4.678 -0.088 2
1 279 . 1 1 A 24 24 PRO C C 24 175.253 176.533 -1.280 2
1 280 . 1 1 A 24 24 PRO CA C 24 62.186 62.551 -0.365 2
1 281 . 1 1 A 24 24 PRO CB C 24 32.931 32.396 0.535 2
1 284 . 1 1 A 25 25 VAL H H 25 9.334 8.623 0.711 2
1 285 . 1 1 A 25 25 VAL HA H 25 4.378 4.304 0.074 2
1 293 . 1 1 A 25 25 VAL C C 25 176.439 175.894 0.545 2
1 294 . 1 1 A 25 25 VAL CA C 25 61.482 62.447 -0.965 2
1 295 . 1 1 A 25 25 VAL CB C 25 34.781 32.597 2.184 2
1 298 . 1 1 A 25 25 VAL N N 25 120.408 122.162 -1.754 2
1 299 . 1 1 A 26 26 LYS H H 26 9.300 8.895 0.405 2
1 300 . 1 1 A 26 26 LYS HA H 26 4.982 4.623 0.359 2
1 309 . 1 1 A 26 26 LYS C C 26 179.008 177.958 1.050 2
1 310 . 1 1 A 26 26 LYS CA C 26 56.908 55.182 1.726 2
1 311 . 1 1 A 26 26 LYS CB C 26 34.071 33.898 0.173 2
1 315 . 1 1 A 26 26 LYS N N 26 126.177 125.361 0.816 2
1 316 . 1 1 A 27 27 THR H H 27 8.618 8.895 -0.277 2
1 317 . 1 1 A 27 27 THR HA H 27 3.662 4.006 -0.344 2
1 322 . 1 1 A 27 27 THR C C 27 176.442 176.319 0.123 2
1 323 . 1 1 A 27 27 THR CA C 27 67.591 66.418 1.173 2
1 324 . 1 1 A 27 27 THR CB C 27 68.868 68.937 -0.069 2
1 326 . 1 1 A 27 27 THR N N 27 119.020 117.564 1.456 2
1 327 . 1 1 A 28 28 ARG H H 28 9.288 8.223 1.065 2
1 328 . 1 1 A 28 28 ARG HA H 28 3.879 4.049 -0.170 2
1 335 . 1 1 A 28 28 ARG C C 28 176.884 178.830 -1.946 2
1 336 . 1 1 A 28 28 ARG CA C 28 59.431 59.542 -0.112 2
1 337 . 1 1 A 28 28 ARG CB C 28 29.953 30.116 -0.163 2
1 340 . 1 1 A 28 28 ARG N N 28 119.100 121.026 -1.926 2
1 341 . 1 1 A 29 29 ASP H H 29 6.907 8.187 -1.280 2
1 342 . 1 1 A 29 29 ASP HA H 29 4.550 4.380 0.170 2
1 345 . 1 1 A 29 29 ASP C C 29 179.050 178.782 0.268 2
1 346 . 1 1 A 29 29 ASP CA C 29 57.262 57.350 -0.088 2
1 347 . 1 1 A 29 29 ASP CB C 29 40.191 40.874 -0.683 2
1 348 . 1 1 A 29 29 ASP N N 29 117.490 119.460 -1.970 2
1 349 . 1 1 A 30 30 ILE H H 30 7.554 7.804 -0.250 2
1 350 . 1 1 A 30 30 ILE HA H 30 3.595 3.707 -0.112 2
1 360 . 1 1 A 30 30 ILE C C 30 176.907 177.774 -0.866 2
1 361 . 1 1 A 30 30 ILE CA C 30 65.002 65.823 -0.821 2
1 362 . 1 1 A 30 30 ILE CB C 30 37.999 38.105 -0.106 2
1 366 . 1 1 A 30 30 ILE N N 30 120.978 120.148 0.830 2
1 367 . 1 1 A 31 31 ALA H H 31 8.269 8.322 -0.053 2
1 368 . 1 1 A 31 31 ALA HA H 31 3.720 4.001 -0.281 2
1 372 . 1 1 A 31 31 ALA C C 31 179.170 179.231 -0.061 2
1 373 . 1 1 A 31 31 ALA CA C 31 56.354 55.640 0.714 2
1 374 . 1 1 A 31 31 ALA CB C 31 17.843 18.129 -0.286 2
1 375 . 1 1 A 31 31 ALA N N 31 121.171 122.420 -1.249 2
1 376 . 1 1 A 32 32 ASP H H 32 8.293 8.454 -0.161 2
1 377 . 1 1 A 32 32 ASP HA H 32 4.422 4.376 0.046 2
1 380 . 1 1 A 32 32 ASP C C 32 179.136 178.218 0.918 2
1 381 . 1 1 A 32 32 ASP CA C 32 57.109 57.006 0.103 2
1 382 . 1 1 A 32 32 ASP CB C 32 40.523 40.997 -0.474 2
1 383 . 1 1 A 32 32 ASP N N 32 116.467 118.721 -2.254 2
1 384 . 1 1 A 33 33 ALA H H 33 7.536 8.113 -0.577 2
1 385 . 1 1 A 33 33 ALA HA H 33 4.222 4.113 0.109 2
1 389 . 1 1 A 33 33 ALA C C 33 179.056 179.746 -0.690 2
1 390 . 1 1 A 33 33 ALA CA C 33 54.469 54.765 -0.296 2
1 391 . 1 1 A 33 33 ALA CB C 33 19.085 18.186 0.899 2
1 392 . 1 1 A 33 33 ALA N N 33 120.859 121.852 -0.993 2
1 393 . 1 1 A 34 34 ALA H H 34 8.296 7.711 0.585 2
1 394 . 1 1 A 34 34 ALA HA H 34 4.101 4.284 -0.183 2
1 398 . 1 1 A 34 34 ALA C C 34 176.912 178.019 -1.107 2
1 399 . 1 1 A 34 34 ALA CA C 34 52.380 52.419 -0.039 2
1 400 . 1 1 A 34 34 ALA CB C 34 18.817 19.720 -0.902 2
1 401 . 1 1 A 34 34 ALA N N 34 118.203 117.406 0.797 2
1 402 . 1 1 A 35 35 GLY H H 35 7.911 8.434 -0.523 2
1 403 . 1 1 A 35 35 GLY HA2 H 35 3.968 3.940 0.028 2
1 404 . 1 1 A 35 35 GLY HA3 H 35 3.968 3.944 0.024 2
1 405 . 1 1 A 35 35 GLY C C 35 174.374 174.093 0.281 2
1 406 . 1 1 A 35 35 GLY CA C 35 46.388 46.232 0.156 2
1 407 . 1 1 A 35 35 GLY N N 35 107.752 107.758 -0.006 2
1 408 . 1 1 A 36 36 LEU H H 36 7.758 7.625 0.133 2
1 409 . 1 1 A 36 36 LEU HA H 36 4.887 4.842 0.045 2
1 419 . 1 1 A 36 36 LEU C C 36 175.941 175.599 0.342 2
1 420 . 1 1 A 36 36 LEU CA C 36 52.443 52.981 -0.538 2
1 421 . 1 1 A 36 36 LEU CB C 36 47.885 44.403 3.482 2
1 425 . 1 1 A 36 36 LEU N N 36 118.719 120.794 -2.075 2
1 426 . 1 1 A 37 37 SER H H 37 8.603 8.576 0.027 2
1 427 . 1 1 A 37 37 SER HA H 37 4.565 4.599 -0.034 2
1 430 . 1 1 A 37 37 SER C C 37 175.512 175.645 -0.133 2
1 431 . 1 1 A 37 37 SER CA C 37 57.262 58.128 -0.866 2
1 432 . 1 1 A 37 37 SER CB C 37 65.155 64.061 1.094 2
1 433 . 1 1 A 37 37 SER N N 37 115.095 116.138 -1.043 2
1 434 . 1 1 A 38 38 ILE H H 38 8.822 8.820 0.002 2
1 435 . 1 1 A 38 38 ILE HA H 38 3.650 3.772 -0.122 2
1 445 . 1 1 A 38 38 ILE C C 38 176.849 177.463 -0.614 2
1 446 . 1 1 A 38 38 ILE CA C 38 64.557 65.129 -0.572 2
1 447 . 1 1 A 38 38 ILE CB C 38 37.451 37.932 -0.481 2
1 451 . 1 1 A 38 38 ILE N N 38 122.026 125.963 -3.937 2
1 452 . 1 1 A 39 39 TYR H H 39 7.839 8.482 -0.643 2
1 453 . 1 1 A 39 39 TYR HA H 39 4.112 4.082 0.030 2
1 460 . 1 1 A 39 39 TYR C C 39 177.703 177.465 0.238 2
1 461 . 1 1 A 39 39 TYR CA C 39 60.856 61.594 -0.738 2
1 462 . 1 1 A 39 39 TYR CB C 39 38.402 38.373 0.029 2
1 467 . 1 1 A 39 39 TYR N N 39 118.759 120.547 -1.788 2
1 468 . 1 1 A 40 40 GLN H H 40 7.687 8.071 -0.384 2
1 469 . 1 1 A 40 40 GLN HA H 40 3.865 3.823 0.042 2
1 476 . 1 1 A 40 40 GLN C C 40 178.735 178.383 0.352 2
1 477 . 1 1 A 40 40 GLN CA C 40 58.089 58.644 -0.555 2
1 478 . 1 1 A 40 40 GLN CB C 40 29.950 28.505 1.445 2
1 481 . 1 1 A 40 40 GLN N N 40 116.772 119.042 -2.270 2
1 483 . 1 1 A 41 41 VAL H H 41 8.494 8.248 0.246 2
1 484 . 1 1 A 41 41 VAL HA H 41 3.835 3.604 0.231 2
1 492 . 1 1 A 41 41 VAL C C 41 176.977 177.808 -0.831 2
1 493 . 1 1 A 41 41 VAL CA C 41 66.102 67.005 -0.903 2
1 494 . 1 1 A 41 41 VAL CB C 41 31.105 31.496 -0.391 2
1 497 . 1 1 A 41 41 VAL N N 41 117.192 119.850 -2.658 2
1 498 . 1 1 A 42 42 ARG H H 42 8.179 8.282 -0.103 2
1 499 . 1 1 A 42 42 ARG HA H 42 3.708 3.921 -0.213 2
1 506 . 1 1 A 42 42 ARG C C 42 177.570 178.462 -0.892 2
1 507 . 1 1 A 42 42 ARG CA C 42 60.349 59.305 1.044 2
1 508 . 1 1 A 42 42 ARG CB C 42 30.047 29.856 0.191 2
1 511 . 1 1 A 42 42 ARG N N 42 120.574 119.946 0.628 2
1 512 . 1 1 A 43 43 LEU H H 43 6.982 7.743 -0.761 2
1 513 . 1 1 A 43 43 LEU HA H 43 3.939 3.812 0.127 2
1 523 . 1 1 A 43 43 LEU C C 43 180.397 178.555 1.842 2
1 524 . 1 1 A 43 43 LEU CA C 43 58.119 57.812 0.307 2
1 525 . 1 1 A 43 43 LEU CB C 43 41.294 41.551 -0.257 2
1 529 . 1 1 A 43 43 LEU N N 43 117.189 119.830 -2.641 2
1 530 . 1 1 A 44 44 TYR H H 44 7.026 7.633 -0.607 2
1 531 . 1 1 A 44 44 TYR HA H 44 4.253 4.245 0.008 2
1 538 . 1 1 A 44 44 TYR C C 44 178.411 178.145 0.266 2
1 539 . 1 1 A 44 44 TYR CA C 44 60.941 60.723 0.218 2
1 540 . 1 1 A 44 44 TYR CB C 44 38.889 38.112 0.777 2
1 545 . 1 1 A 44 44 TYR N N 44 117.020 117.798 -0.778 2
1 546 . 1 1 A 45 45 LEU H H 45 8.429 8.507 -0.078 2
1 547 . 1 1 A 45 45 LEU HA H 45 3.486 3.567 -0.081 2
1 557 . 1 1 A 45 45 LEU C C 45 178.648 178.894 -0.246 2
1 558 . 1 1 A 45 45 LEU CA C 45 57.915 57.633 0.282 2
1 559 . 1 1 A 45 45 LEU CB C 45 39.073 40.566 -1.493 2
1 563 . 1 1 A 45 45 LEU N N 45 119.649 120.043 -0.394 2
1 564 . 1 1 A 46 46 GLU H H 46 8.309 8.223 0.086 2
1 565 . 1 1 A 46 46 GLU HA H 46 4.286 4.053 0.233 2
1 570 . 1 1 A 46 46 GLU C C 46 179.577 179.297 0.280 2
1 571 . 1 1 A 46 46 GLU CA C 46 59.570 59.792 -0.222 2
1 572 . 1 1 A 46 46 GLU CB C 46 29.034 29.275 -0.241 2
1 574 . 1 1 A 46 46 GLU N N 46 117.366 118.472 -1.106 2
1 575 . 1 1 A 47 47 GLN H H 47 7.493 7.838 -0.345 2
1 576 . 1 1 A 47 47 GLN HA H 47 4.243 4.015 0.228 2
1 583 . 1 1 A 47 47 GLN C C 47 178.870 178.878 -0.008 2
1 584 . 1 1 A 47 47 GLN CA C 47 59.581 58.744 0.837 2
1 585 . 1 1 A 47 47 GLN CB C 47 28.300 28.183 0.117 2
1 588 . 1 1 A 47 47 GLN N N 47 119.345 118.862 0.483 2
1 590 . 1 1 A 48 48 LEU H H 48 8.160 8.351 -0.191 2
1 591 . 1 1 A 48 48 LEU HA H 48 4.211 4.016 0.195 2
1 601 . 1 1 A 48 48 LEU C C 48 180.111 179.157 0.954 2
1 602 . 1 1 A 48 48 LEU CA C 48 57.179 57.747 -0.568 2
1 603 . 1 1 A 48 48 LEU CB C 48 42.067 41.190 0.877 2
1 607 . 1 1 A 48 48 LEU N N 48 118.594 119.968 -1.374 2
1 608 . 1 1 A 49 49 HIS H H 49 8.864 8.243 0.621 2
1 609 . 1 1 A 49 49 HIS HA H 49 5.162 4.593 0.569 2
1 613 . 1 1 A 49 49 HIS C C 49 178.801 176.952 1.849 2
1 614 . 1 1 A 49 49 HIS CA C 49 58.397 59.803 -1.406 2
1 615 . 1 1 A 49 49 HIS CB C 49 29.631 30.046 -0.415 2
1 617 . 1 1 A 49 49 HIS N N 49 122.537 118.160 4.377 2
1 618 . 1 1 A 50 50 ASP H H 50 8.683 8.256 0.427 2
1 619 . 1 1 A 50 50 ASP HA H 50 4.356 4.201 0.155 2
1 622 . 1 1 A 50 50 ASP C C 50 178.474 178.050 0.424 2
1 623 . 1 1 A 50 50 ASP CA C 50 57.744 57.176 0.568 2
1 624 . 1 1 A 50 50 ASP CB C 50 40.575 41.117 -0.543 2
1 625 . 1 1 A 50 50 ASP N N 50 123.169 118.977 4.192 2
1 626 . 1 1 A 51 51 VAL H H 51 7.606 7.705 -0.099 2
1 627 . 1 1 A 51 51 VAL HA H 51 4.514 4.126 0.388 2
1 635 . 1 1 A 51 51 VAL C C 51 176.862 176.339 0.523 2
1 636 . 1 1 A 51 51 VAL CA C 51 61.590 62.557 -0.967 2
1 637 . 1 1 A 51 51 VAL CB C 51 31.423 32.258 -0.835 2
1 640 . 1 1 A 51 51 VAL N N 51 109.266 111.715 -2.449 2
1 641 . 1 1 A 52 52 GLY H H 52 7.696 7.759 -0.063 2
1 642 . 1 1 A 52 52 GLY HA2 H 52 4.172 3.976 0.196 2
1 643 . 1 1 A 52 52 GLY HA3 H 52 3.938 3.994 -0.056 2
1 644 . 1 1 A 52 52 GLY C C 52 174.276 174.801 -0.525 2
1 645 . 1 1 A 52 52 GLY CA C 52 46.228 45.981 0.247 2
1 646 . 1 1 A 52 52 GLY N N 52 108.681 110.604 -1.923 2
1 647 . 1 1 A 53 53 VAL H H 53 8.046 8.216 -0.170 2
1 648 . 1 1 A 53 53 VAL HA H 53 4.079 4.094 -0.015 2
1 656 . 1 1 A 53 53 VAL C C 53 175.949 175.605 0.344 2
1 657 . 1 1 A 53 53 VAL CA C 53 64.063 64.147 -0.084 2
1 658 . 1 1 A 53 53 VAL CB C 53 33.160 33.361 -0.201 2
1 661 . 1 1 A 53 53 VAL N N 53 117.892 117.334 0.558 2
1 662 . 1 1 A 54 54 LEU H H 54 6.835 7.575 -0.740 2
1 663 . 1 1 A 54 54 LEU HA H 54 5.348 4.998 0.350 2
1 673 . 1 1 A 54 54 LEU C C 54 175.713 175.881 -0.168 2
1 674 . 1 1 A 54 54 LEU CA C 54 52.194 53.122 -0.928 2
1 675 . 1 1 A 54 54 LEU CB C 54 46.733 44.320 2.413 2
1 679 . 1 1 A 54 54 LEU N N 54 114.848 118.015 -3.167 2
1 680 . 1 1 A 55 55 GLU H H 55 9.549 9.264 0.285 2
1 681 . 1 1 A 55 55 GLU HA H 55 4.826 5.113 -0.287 2
1 686 . 1 1 A 55 55 GLU C C 55 174.661 175.756 -1.095 2
1 687 . 1 1 A 55 55 GLU CA C 55 54.637 55.210 -0.573 2
1 688 . 1 1 A 55 55 GLU CB C 55 32.891 32.442 0.449 2
1 690 . 1 1 A 55 55 GLU N N 55 121.431 123.318 -1.887 2
1 691 . 1 1 A 56 56 LYS H H 56 8.513 8.457 0.056 2
1 692 . 1 1 A 56 56 LYS HA H 56 4.151 4.292 -0.141 2
1 701 . 1 1 A 56 56 LYS C C 56 176.270 175.319 0.951 2
1 702 . 1 1 A 56 56 LYS CA C 56 54.890 55.591 -0.701 2
1 703 . 1 1 A 56 56 LYS CB C 56 33.162 32.682 0.480 2
1 707 . 1 1 A 56 56 LYS N N 56 126.539 123.916 2.623 2
1 708 . 1 1 A 57 57 VAL H H 57 8.279 8.575 -0.296 2
1 709 . 1 1 A 57 57 VAL HA H 57 3.820 4.399 -0.579 2
1 717 . 1 1 A 57 57 VAL C C 57 175.108 175.128 -0.020 2
1 718 . 1 1 A 57 57 VAL CA C 57 62.834 61.758 1.076 2
1 719 . 1 1 A 57 57 VAL CB C 57 32.549 32.275 0.274 2
1 722 . 1 1 A 57 57 VAL N N 57 126.540 124.802 1.738 2
1 723 . 1 1 A 58 58 ASN H H 58 8.383 8.575 -0.192 2
1 724 . 1 1 A 58 58 ASN HA H 58 4.612 4.844 -0.232 2
1 729 . 1 1 A 58 58 ASN C C 58 174.772 174.690 0.082 2
1 730 . 1 1 A 58 58 ASN CA C 58 52.575 52.794 -0.219 2
1 731 . 1 1 A 58 58 ASN CB C 58 38.502 39.486 -0.984 2
1 733 . 1 1 A 58 58 ASN N N 58 121.767 124.400 -2.633 2
1 735 . 1 1 A 59 59 ALA H H 59 8.165 8.352 -0.187 2
1 736 . 1 1 A 59 59 ALA HA H 59 4.251 4.358 -0.107 2
1 740 . 1 1 A 59 59 ALA C C 59 177.478 177.279 0.199 2
1 741 . 1 1 A 59 59 ALA CA C 59 52.490 52.596 -0.106 2
1 742 . 1 1 A 59 59 ALA CB C 59 19.724 19.899 -0.175 2
1 743 . 1 1 A 59 59 ALA N N 59 125.082 124.427 0.655 2
1 744 . 1 1 A 60 60 GLY H H 60 8.291 7.861 0.430 2
1 745 . 1 1 A 60 60 GLY HA2 H 60 4.165 4.024 0.141 2
1 746 . 1 1 A 60 60 GLY HA3 H 60 3.853 4.033 -0.180 2
1 747 . 1 1 A 60 60 GLY C C 60 174.171 173.102 1.069 2
1 748 . 1 1 A 60 60 GLY CA C 60 44.994 45.461 -0.467 2
1 749 . 1 1 A 60 60 GLY N N 60 108.518 106.822 1.696 2
1 750 . 1 1 A 61 61 LYS H H 61 8.189 8.283 -0.094 2
1 751 . 1 1 A 61 61 LYS HA H 61 4.320 4.351 -0.031 2
1 760 . 1 1 A 61 61 LYS C C 61 177.712 177.022 0.690 2
1 761 . 1 1 A 61 61 LYS CA C 61 56.832 56.646 0.186 2
1 762 . 1 1 A 61 61 LYS CB C 61 32.641 33.216 -0.575 2
1 766 . 1 1 A 61 61 LYS N N 61 120.532 122.174 -1.642 2
1 767 . 1 1 A 62 62 GLY H H 62 8.767 8.713 0.054 2
1 768 . 1 1 A 62 62 GLY HA2 H 62 4.021 3.941 0.080 2
1 769 . 1 1 A 62 62 GLY HA3 H 62 3.849 3.946 -0.097 2
1 770 . 1 1 A 62 62 GLY C C 62 173.782 174.158 -0.376 2
1 771 . 1 1 A 62 62 GLY CA C 62 45.844 45.952 -0.108 2
1 772 . 1 1 A 62 62 GLY N N 62 111.547 111.845 -0.298 2
1 773 . 1 1 A 63 63 VAL H H 63 7.379 7.707 -0.328 2
1 774 . 1 1 A 63 63 VAL HA H 63 4.591 4.450 0.141 2
1 782 . 1 1 A 63 63 VAL C C 63 174.262 175.016 -0.754 2
1 783 . 1 1 A 63 63 VAL CA C 63 59.292 59.651 -0.359 2
1 784 . 1 1 A 63 63 VAL CB C 63 32.726 32.499 0.227 2
1 787 . 1 1 A 63 63 VAL N N 63 117.546 117.480 0.066 2
1 788 . 1 1 A 64 64 PRO HA H 64 4.458 4.527 -0.069 2
1 795 . 1 1 A 64 64 PRO C C 64 177.166 176.629 0.537 2
1 796 . 1 1 A 64 64 PRO CA C 64 63.661 63.372 0.289 2
1 797 . 1 1 A 64 64 PRO CB C 64 32.321 31.975 0.346 2
1 800 . 1 1 A 65 65 GLY H H 65 8.463 8.123 0.340 2
1 801 . 1 1 A 65 65 GLY HA2 H 65 3.882 3.742 0.140 2
1 802 . 1 1 A 65 65 GLY HA3 H 65 3.602 3.840 -0.238 2
1 803 . 1 1 A 65 65 GLY C C 65 172.406 172.609 -0.203 2
1 804 . 1 1 A 65 65 GLY CA C 65 45.933 45.114 0.819 2
1 805 . 1 1 A 65 65 GLY N N 65 109.819 108.309 1.510 2
1 806 . 1 1 A 66 66 LEU H H 66 7.534 8.378 -0.844 2
1 807 . 1 1 A 66 66 LEU HA H 66 4.940 4.805 0.135 2
1 817 . 1 1 A 66 66 LEU C C 66 176.237 175.799 0.438 2
1 818 . 1 1 A 66 66 LEU CA C 66 53.687 53.471 0.216 2
1 819 . 1 1 A 66 66 LEU CB C 66 46.108 43.697 2.411 2
1 823 . 1 1 A 66 66 LEU N N 66 122.249 124.486 -2.237 2
1 824 . 1 1 A 67 67 TRP H H 67 8.916 9.241 -0.325 2
1 825 . 1 1 A 67 67 TRP HA H 67 5.526 5.358 0.168 2
1 834 . 1 1 A 67 67 TRP C C 67 175.670 175.360 0.310 2
1 835 . 1 1 A 67 67 TRP CA C 67 56.241 55.745 0.496 2
1 836 . 1 1 A 67 67 TRP CB C 67 33.314 32.277 1.037 2
1 842 . 1 1 A 67 67 TRP N N 67 121.160 123.842 -2.682 2
1 844 . 1 1 A 68 68 ARG H H 68 8.772 8.947 -0.175 2
1 845 . 1 1 A 68 68 ARG HA H 68 4.832 5.037 -0.205 2
1 853 . 1 1 A 68 68 ARG C C 68 174.720 175.349 -0.629 2
1 854 . 1 1 A 68 68 ARG CA C 68 54.690 54.492 0.198 2
1 855 . 1 1 A 68 68 ARG CB C 68 35.176 33.714 1.462 2
1 858 . 1 1 A 68 68 ARG N N 68 117.471 122.928 -5.457 2
1 860 . 1 1 A 69 69 LEU H H 69 9.355 8.604 0.751 2
1 861 . 1 1 A 69 69 LEU HA H 69 4.557 4.845 -0.288 2
1 871 . 1 1 A 69 69 LEU C C 69 177.180 176.427 0.753 2
1 872 . 1 1 A 69 69 LEU CA C 69 55.780 53.770 2.010 2
1 873 . 1 1 A 69 69 LEU CB C 69 42.736 44.015 -1.279 2
1 877 . 1 1 A 69 69 LEU N N 69 125.211 120.985 4.226 2
1 878 . 1 1 A 70 70 LEU H H 70 8.058 8.537 -0.479 2
1 879 . 1 1 A 70 70 LEU HA H 70 4.364 4.597 -0.233 2
1 889 . 1 1 A 70 70 LEU C C 70 176.808 176.387 0.421 2
1 890 . 1 1 A 70 70 LEU CA C 70 55.257 54.263 0.994 2
1 891 . 1 1 A 70 70 LEU CB C 70 42.413 42.136 0.277 2
1 895 . 1 1 A 70 70 LEU N N 70 125.525 119.872 5.653 2
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