data_15950_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15950
_Entry.PDB_ID 2K8I
_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 10
_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 14 . 1 1 1 A 2 2 LYS H H 2 7.540 8.799 -1.259 1
1 15 . 1 1 1 A 2 2 LYS HA H 2 4.729 4.899 -0.170 1
1 24 . 1 1 1 A 2 2 LYS C C 2 175.948 175.646 0.302 1
1 25 . 1 1 1 A 2 2 LYS CA C 2 53.978 54.975 -0.997 1
1 26 . 1 1 1 A 2 2 LYS CB C 2 35.985 34.855 1.130 1
1 30 . 1 1 1 A 2 2 LYS N N 2 120.764 120.350 0.414 1
1 31 . 1 1 1 A 3 3 VAL H H 3 8.738 8.416 0.322 1
1 32 . 1 1 1 A 3 3 VAL HA H 3 2.800 4.053 -1.253 1
1 40 . 1 1 1 A 3 3 VAL C C 3 175.018 174.970 0.048 1
1 41 . 1 1 1 A 3 3 VAL CA C 3 66.598 63.135 3.463 1
1 42 . 1 1 1 A 3 3 VAL CB C 3 31.218 31.685 -0.467 1
1 45 . 1 1 1 A 3 3 VAL N N 3 120.055 122.446 -2.391 1
1 46 . 1 1 1 A 4 4 ALA H H 4 6.584 8.899 -2.315 1
1 47 . 1 1 1 A 4 4 ALA HA H 4 4.223 4.675 -0.452 1
1 51 . 1 1 1 A 4 4 ALA C C 4 174.117 175.509 -1.392 1
1 52 . 1 1 1 A 4 4 ALA CA C 4 50.358 51.011 -0.653 1
1 53 . 1 1 1 A 4 4 ALA CB C 4 22.137 22.536 -0.399 1
1 54 . 1 1 1 A 4 4 ALA N N 4 129.800 130.597 -0.797 1
1 55 . 1 1 1 A 5 5 LYS H H 5 8.596 8.539 0.057 1
1 56 . 1 1 1 A 5 5 LYS HA H 5 3.793 4.138 -0.345 1
1 65 . 1 1 1 A 5 5 LYS C C 5 175.260 177.050 -1.790 1
1 66 . 1 1 1 A 5 5 LYS CA C 5 57.700 57.222 0.478 1
1 67 . 1 1 1 A 5 5 LYS CB C 5 32.400 32.641 -0.241 1
1 71 . 1 1 1 A 5 5 LYS N N 5 118.708 119.687 -0.979 1
1 72 . 1 1 1 A 6 6 ASP H H 6 8.679 8.772 -0.093 1
1 73 . 1 1 1 A 6 6 ASP HA H 6 4.040 4.345 -0.305 1
1 76 . 1 1 1 A 6 6 ASP C C 6 173.331 175.701 -2.370 1
1 77 . 1 1 1 A 6 6 ASP CA C 6 57.508 55.669 1.839 1
1 78 . 1 1 1 A 6 6 ASP CB C 6 37.604 39.770 -2.166 1
1 79 . 1 1 1 A 6 6 ASP N N 6 115.415 120.705 -5.290 1
1 80 . 1 1 1 A 7 7 LEU H H 7 7.376 7.488 -0.112 1
1 81 . 1 1 1 A 7 7 LEU HA H 7 4.689 4.458 0.231 1
1 91 . 1 1 1 A 7 7 LEU C C 7 175.906 175.857 0.049 1
1 92 . 1 1 1 A 7 7 LEU CA C 7 53.509 54.224 -0.715 1
1 93 . 1 1 1 A 7 7 LEU CB C 7 42.419 43.002 -0.583 1
1 97 . 1 1 1 A 7 7 LEU N N 7 117.619 120.262 -2.643 1
1 98 . 1 1 1 A 8 8 VAL H H 8 8.646 9.453 -0.807 1
1 99 . 1 1 1 A 8 8 VAL HA H 8 4.397 4.941 -0.544 1
1 107 . 1 1 1 A 8 8 VAL C C 8 175.244 174.747 0.497 1
1 108 . 1 1 1 A 8 8 VAL CA C 8 62.028 59.623 2.405 1
1 109 . 1 1 1 A 8 8 VAL CB C 8 31.515 34.834 -3.319 1
1 112 . 1 1 1 A 8 8 VAL N N 8 121.164 122.465 -1.301 1
1 113 . 1 1 1 A 9 9 VAL H H 9 8.607 8.703 -0.096 1
1 114 . 1 1 1 A 9 9 VAL HA H 9 4.281 5.034 -0.753 1
1 122 . 1 1 1 A 9 9 VAL C C 9 174.156 174.107 0.049 1
1 123 . 1 1 1 A 9 9 VAL CA C 9 60.614 58.731 1.883 1
1 124 . 1 1 1 A 9 9 VAL CB C 9 33.985 35.717 -1.732 1
1 127 . 1 1 1 A 9 9 VAL N N 9 134.014 121.497 12.517 1
1 128 . 1 1 1 A 10 10 SER H H 10 8.684 8.502 0.182 1
1 129 . 1 1 1 A 10 10 SER HA H 10 5.736 5.543 0.193 1
1 132 . 1 1 1 A 10 10 SER C C 10 173.544 173.644 -0.100 1
1 133 . 1 1 1 A 10 10 SER CA C 10 56.533 57.737 -1.204 1
1 134 . 1 1 1 A 10 10 SER CB C 10 63.385 64.326 -0.941 1
1 135 . 1 1 1 A 10 10 SER N N 10 121.492 118.942 2.550 1
1 136 . 1 1 1 A 11 11 LEU H H 11 9.939 9.013 0.926 1
1 137 . 1 1 1 A 11 11 LEU HA H 11 5.133 5.425 -0.292 1
1 147 . 1 1 1 A 11 11 LEU C C 11 174.843 175.113 -0.270 1
1 148 . 1 1 1 A 11 11 LEU CA C 11 53.770 52.965 0.805 1
1 149 . 1 1 1 A 11 11 LEU CB C 11 47.469 46.364 1.105 1
1 153 . 1 1 1 A 11 11 LEU N N 11 128.460 122.391 6.069 1
1 154 . 1 1 1 A 12 12 ALA H H 12 8.770 9.181 -0.411 1
1 155 . 1 1 1 A 12 12 ALA HA H 12 4.830 5.210 -0.380 1
1 159 . 1 1 1 A 12 12 ALA C C 12 176.974 175.562 1.412 1
1 160 . 1 1 1 A 12 12 ALA CA C 12 50.231 50.735 -0.504 1
1 161 . 1 1 1 A 12 12 ALA CB C 12 21.270 21.016 0.254 1
1 162 . 1 1 1 A 12 12 ALA N N 12 127.500 121.904 5.596 1
1 163 . 1 1 1 A 13 13 TYR H H 13 8.749 8.747 0.002 1
1 164 . 1 1 1 A 13 13 TYR HA H 13 5.797 6.124 -0.327 1
1 171 . 1 1 1 A 13 13 TYR C C 13 173.952 172.784 1.168 1
1 172 . 1 1 1 A 13 13 TYR CA C 13 56.390 55.133 1.257 1
1 173 . 1 1 1 A 13 13 TYR CB C 13 41.159 41.537 -0.378 1
1 176 . 1 1 1 A 13 13 TYR N N 13 117.737 119.814 -2.077 1
1 177 . 1 1 1 A 14 14 GLN H H 14 8.492 8.711 -0.219 1
1 178 . 1 1 1 A 14 14 GLN HA H 14 4.611 5.052 -0.441 1
1 185 . 1 1 1 A 14 14 GLN C C 14 174.492 173.688 0.804 1
1 186 . 1 1 1 A 14 14 GLN CA C 14 55.626 54.457 1.169 1
1 187 . 1 1 1 A 14 14 GLN CB C 14 32.734 31.952 0.782 1
1 189 . 1 1 1 A 14 14 GLN N N 14 116.962 120.265 -3.303 1
1 191 . 1 1 1 A 15 15 VAL H H 15 8.403 8.998 -0.595 1
1 192 . 1 1 1 A 15 15 VAL HA H 15 4.614 5.187 -0.573 1
1 200 . 1 1 1 A 15 15 VAL C C 15 173.389 174.959 -1.570 1
1 201 . 1 1 1 A 15 15 VAL CA C 15 59.711 60.196 -0.485 1
1 202 . 1 1 1 A 15 15 VAL CB C 15 33.639 34.148 -0.509 1
1 205 . 1 1 1 A 15 15 VAL N N 15 121.203 127.031 -5.828 1
1 206 . 1 1 1 A 16 16 ARG H H 16 8.584 9.146 -0.562 1
1 207 . 1 1 1 A 16 16 ARG HA H 16 5.584 4.904 0.680 1
1 214 . 1 1 1 A 16 16 ARG C C 16 176.585 174.949 1.636 1
1 215 . 1 1 1 A 16 16 ARG CA C 16 53.453 53.991 -0.538 1
1 216 . 1 1 1 A 16 16 ARG CB C 16 34.968 33.809 1.159 1
1 219 . 1 1 1 A 16 16 ARG N N 16 126.883 126.793 0.090 1
1 220 . 1 1 1 A 17 17 THR H H 17 8.270 8.654 -0.384 1
1 221 . 1 1 1 A 17 17 THR HA H 17 4.573 4.681 -0.108 1
1 226 . 1 1 1 A 17 17 THR C C 17 177.860 176.186 1.674 1
1 227 . 1 1 1 A 17 17 THR CA C 17 61.073 60.490 0.583 1
1 228 . 1 1 1 A 17 17 THR CB C 17 69.823 71.749 -1.926 1
1 230 . 1 1 1 A 17 17 THR N N 17 109.730 112.762 -3.032 1
1 231 . 1 1 1 A 18 18 GLU H H 18 9.147 8.446 0.701 1
1 232 . 1 1 1 A 18 18 GLU HA H 18 3.770 4.068 -0.298 1
1 237 . 1 1 1 A 18 18 GLU C C 18 176.683 178.111 -1.428 1
1 238 . 1 1 1 A 18 18 GLU CA C 18 59.866 59.215 0.651 1
1 239 . 1 1 1 A 18 18 GLU CB C 18 29.752 29.218 0.534 1
1 241 . 1 1 1 A 18 18 GLU N N 18 122.491 120.921 1.570 1
1 242 . 1 1 1 A 19 19 ASP H H 19 7.900 7.973 -0.073 1
1 243 . 1 1 1 A 19 19 ASP HA H 19 4.456 4.857 -0.401 1
1 246 . 1 1 1 A 19 19 ASP C C 19 176.670 176.052 0.618 1
1 247 . 1 1 1 A 19 19 ASP CA C 19 53.833 54.211 -0.378 1
1 248 . 1 1 1 A 19 19 ASP CB C 19 40.180 41.088 -0.908 1
1 249 . 1 1 1 A 19 19 ASP N N 19 116.200 117.348 -1.148 1
1 250 . 1 1 1 A 20 20 GLY H H 20 8.149 7.878 0.271 1
1 251 . 1 1 1 A 20 20 GLY HA2 H 20 4.145 3.943 0.202 1
1 252 . 1 1 1 A 20 20 GLY HA3 H 20 3.531 3.950 -0.419 1
1 253 . 1 1 1 A 20 20 GLY C C 20 173.987 174.294 -0.307 1
1 254 . 1 1 1 A 20 20 GLY CA C 20 45.463 45.021 0.442 1
1 255 . 1 1 1 A 20 20 GLY N N 20 108.869 105.980 2.889 1
1 256 . 1 1 1 A 21 21 VAL H H 21 7.261 7.873 -0.612 1
1 257 . 1 1 1 A 21 21 VAL HA H 21 3.645 4.193 -0.548 1
1 265 . 1 1 1 A 21 21 VAL C C 21 175.265 174.886 0.379 1
1 266 . 1 1 1 A 21 21 VAL CA C 21 63.368 61.928 1.440 1
1 267 . 1 1 1 A 21 21 VAL CB C 21 31.614 32.518 -0.904 1
1 270 . 1 1 1 A 21 21 VAL N N 21 124.283 121.922 2.361 1
1 271 . 1 1 1 A 22 22 LEU H H 22 8.407 8.423 -0.016 1
1 272 . 1 1 1 A 22 22 LEU HA H 22 4.333 4.420 -0.087 1
1 282 . 1 1 1 A 22 22 LEU C C 22 176.660 176.724 -0.064 1
1 283 . 1 1 1 A 22 22 LEU CA C 22 55.724 55.436 0.288 1
1 284 . 1 1 1 A 22 22 LEU CB C 22 42.272 42.794 -0.522 1
1 288 . 1 1 1 A 22 22 LEU N N 22 128.533 128.420 0.113 1
1 289 . 1 1 1 A 23 23 VAL H H 23 8.887 8.977 -0.090 1
1 290 . 1 1 1 A 23 23 VAL HA H 23 4.237 4.374 -0.137 1
1 298 . 1 1 1 A 23 23 VAL C C 23 175.265 175.466 -0.201 1
1 299 . 1 1 1 A 23 23 VAL CA C 23 62.348 62.160 0.188 1
1 300 . 1 1 1 A 23 23 VAL CB C 23 33.383 33.318 0.065 1
1 303 . 1 1 1 A 23 23 VAL N N 23 125.041 121.615 3.426 1
1 304 . 1 1 1 A 24 24 ASP H H 24 7.480 7.431 0.049 1
1 305 . 1 1 1 A 24 24 ASP HA H 24 4.763 4.997 -0.234 1
1 308 . 1 1 1 A 24 24 ASP C C 24 173.160 173.805 -0.645 1
1 309 . 1 1 1 A 24 24 ASP CA C 24 53.893 53.327 0.566 1
1 310 . 1 1 1 A 24 24 ASP CB C 24 43.680 44.066 -0.386 1
1 311 . 1 1 1 A 24 24 ASP N N 24 117.159 120.125 -2.966 1
1 312 . 1 1 1 A 25 25 GLU H H 25 8.187 8.649 -0.462 1
1 313 . 1 1 1 A 25 25 GLU HA H 25 4.491 4.508 -0.017 1
1 318 . 1 1 1 A 25 25 GLU C C 25 174.586 174.017 0.569 1
1 319 . 1 1 1 A 25 25 GLU CA C 25 55.475 56.211 -0.736 1
1 320 . 1 1 1 A 25 25 GLU CB C 25 33.033 34.290 -1.257 1
1 322 . 1 1 1 A 25 25 GLU N N 25 118.821 123.023 -4.202 1
1 323 . 1 1 1 A 26 26 SER H H 26 8.003 8.521 -0.518 1
1 324 . 1 1 1 A 26 26 SER HA H 26 4.782 4.817 -0.035 1
1 327 . 1 1 1 A 26 26 SER CA C 26 56.490 55.163 1.327 1
1 328 . 1 1 1 A 26 26 SER CB C 26 64.977 64.019 0.958 1
1 329 . 1 1 1 A 26 26 SER N N 26 119.346 123.296 -3.950 1
1 330 . 1 1 1 A 27 27 PRO HA H 27 4.633 4.583 0.050 1
1 337 . 1 1 1 A 27 27 PRO C C 27 177.016 177.220 -0.204 1
1 338 . 1 1 1 A 27 27 PRO CA C 27 61.943 62.629 -0.686 1
1 339 . 1 1 1 A 27 27 PRO CB C 27 32.492 33.129 -0.637 1
1 342 . 1 1 1 A 28 28 VAL H H 28 8.383 8.628 -0.245 1
1 343 . 1 1 1 A 28 28 VAL HA H 28 3.385 3.756 -0.371 1
1 351 . 1 1 1 A 28 28 VAL C C 28 176.069 177.232 -1.163 1
1 352 . 1 1 1 A 28 28 VAL CA C 28 65.888 65.073 0.815 1
1 353 . 1 1 1 A 28 28 VAL CB C 28 31.220 31.701 -0.481 1
1 356 . 1 1 1 A 28 28 VAL N N 28 119.349 122.333 -2.984 1
1 357 . 1 1 1 A 29 29 SER H H 29 7.365 7.765 -0.400 1
1 358 . 1 1 1 A 29 29 SER HA H 29 4.101 4.329 -0.228 1
1 361 . 1 1 1 A 29 29 SER C C 29 174.535 174.621 -0.086 1
1 362 . 1 1 1 A 29 29 SER CA C 29 58.609 60.128 -1.519 1
1 363 . 1 1 1 A 29 29 SER CB C 29 63.198 63.541 -0.343 1
1 364 . 1 1 1 A 29 29 SER N N 29 109.365 114.288 -4.923 1
1 365 . 1 1 1 A 30 30 ALA H H 30 7.457 7.746 -0.289 1
1 366 . 1 1 1 A 30 30 ALA HA H 30 4.548 4.684 -0.136 1
1 370 . 1 1 1 A 30 30 ALA CA C 30 50.789 49.252 1.537 1
1 371 . 1 1 1 A 30 30 ALA CB C 30 18.608 21.122 -2.514 1
1 372 . 1 1 1 A 30 30 ALA N N 30 126.056 122.431 3.625 1
1 373 . 1 1 1 A 31 31 PRO HA H 31 4.332 4.644 -0.312 1
1 380 . 1 1 1 A 31 31 PRO C C 31 175.841 176.036 -0.195 1
1 381 . 1 1 1 A 31 31 PRO CA C 31 62.996 62.429 0.567 1
1 382 . 1 1 1 A 31 31 PRO CB C 31 32.696 32.560 0.136 1
1 385 . 1 1 1 A 32 32 LEU H H 32 8.717 9.198 -0.481 1
1 386 . 1 1 1 A 32 32 LEU HA H 32 4.452 4.849 -0.397 1
1 396 . 1 1 1 A 32 32 LEU C C 32 175.298 174.440 0.858 1
1 397 . 1 1 1 A 32 32 LEU CA C 32 54.510 54.722 -0.212 1
1 398 . 1 1 1 A 32 32 LEU CB C 32 43.899 43.804 0.095 1
1 402 . 1 1 1 A 32 32 LEU N N 32 123.702 122.425 1.277 1
1 403 . 1 1 1 A 33 33 ASP H H 33 8.258 8.944 -0.686 1
1 404 . 1 1 1 A 33 33 ASP HA H 33 5.919 5.437 0.482 1
1 407 . 1 1 1 A 33 33 ASP C C 33 175.927 174.931 0.996 1
1 408 . 1 1 1 A 33 33 ASP CA C 33 52.619 53.011 -0.392 1
1 409 . 1 1 1 A 33 33 ASP CB C 33 42.205 42.461 -0.256 1
1 410 . 1 1 1 A 33 33 ASP N N 33 128.453 126.641 1.812 1
1 411 . 1 1 1 A 34 34 TYR H H 34 9.144 8.583 0.561 1
1 412 . 1 1 1 A 34 34 TYR HA H 34 4.689 5.266 -0.577 1
1 419 . 1 1 1 A 34 34 TYR C C 34 170.622 172.357 -1.735 1
1 420 . 1 1 1 A 34 34 TYR CA C 34 55.930 56.011 -0.081 1
1 421 . 1 1 1 A 34 34 TYR CB C 34 41.905 41.257 0.648 1
1 424 . 1 1 1 A 34 34 TYR N N 34 121.657 119.778 1.879 1
1 425 . 1 1 1 A 35 35 LEU H H 35 8.324 8.408 -0.084 1
1 426 . 1 1 1 A 35 35 LEU HA H 35 4.396 4.841 -0.445 1
1 436 . 1 1 1 A 35 35 LEU C C 35 175.301 176.408 -1.107 1
1 437 . 1 1 1 A 35 35 LEU CA C 35 52.909 53.221 -0.312 1
1 438 . 1 1 1 A 35 35 LEU CB C 35 42.816 44.020 -1.204 1
1 442 . 1 1 1 A 35 35 LEU N N 35 124.514 123.234 1.280 1
1 443 . 1 1 1 A 36 36 HIS H H 36 8.763 8.416 0.347 1
1 444 . 1 1 1 A 36 36 HIS HA H 36 4.382 4.785 -0.403 1
1 449 . 1 1 1 A 36 36 HIS C C 36 176.514 176.513 0.001 1
1 450 . 1 1 1 A 36 36 HIS CA C 36 59.570 57.948 1.622 1
1 451 . 1 1 1 A 36 36 HIS CB C 36 31.257 29.697 1.560 1
1 454 . 1 1 1 A 36 36 HIS N N 36 132.209 126.474 5.735 1
1 455 . 1 1 1 A 37 37 GLY H H 37 8.745 8.863 -0.118 1
1 456 . 1 1 1 A 37 37 GLY HA2 H 37 4.021 3.728 0.293 1
1 457 . 1 1 1 A 37 37 GLY HA3 H 37 3.592 3.889 -0.297 1
1 458 . 1 1 1 A 37 37 GLY C C 37 175.081 174.401 0.680 1
1 459 . 1 1 1 A 37 37 GLY CA C 37 45.621 46.033 -0.412 1
1 460 . 1 1 1 A 37 37 GLY N N 37 117.737 114.528 3.209 1
1 461 . 1 1 1 A 38 38 HIS H H 38 8.470 8.329 0.141 1
1 462 . 1 1 1 A 38 38 HIS HA H 38 4.584 4.710 -0.126 1
1 467 . 1 1 1 A 38 38 HIS C C 38 175.334 175.386 -0.052 1
1 468 . 1 1 1 A 38 38 HIS CA C 38 55.899 56.206 -0.307 1
1 469 . 1 1 1 A 38 38 HIS CB C 38 30.865 31.514 -0.649 1
1 472 . 1 1 1 A 38 38 HIS N N 38 119.813 117.339 2.474 1
1 473 . 1 1 1 A 39 39 GLY H H 39 8.936 7.878 1.058 1
1 474 . 1 1 1 A 39 39 GLY HA2 H 39 3.895 3.838 0.057 1
1 475 . 1 1 1 A 39 39 GLY HA3 H 39 3.895 3.878 0.017 1
1 476 . 1 1 1 A 39 39 GLY C C 39 175.557 175.175 0.382 1
1 477 . 1 1 1 A 39 39 GLY CA C 39 46.938 46.477 0.461 1
1 478 . 1 1 1 A 39 39 GLY N N 39 112.442 108.471 3.971 1
1 479 . 1 1 1 A 40 40 SER H H 40 9.249 8.125 1.124 1
1 480 . 1 1 1 A 40 40 SER HA H 40 4.299 4.263 0.036 1
1 483 . 1 1 1 A 40 40 SER C C 40 174.138 175.577 -1.439 1
1 484 . 1 1 1 A 40 40 SER CA C 40 60.809 62.369 -1.560 1
1 485 . 1 1 1 A 40 40 SER CB C 40 64.041 63.605 0.436 1
1 486 . 1 1 1 A 40 40 SER N N 40 117.098 113.374 3.724 1
1 487 . 1 1 1 A 41 41 LEU H H 41 7.386 6.934 0.452 1
1 488 . 1 1 1 A 41 41 LEU HA H 41 4.429 4.486 -0.057 1
1 498 . 1 1 1 A 41 41 LEU C C 41 176.526 175.769 0.757 1
1 499 . 1 1 1 A 41 41 LEU CA C 41 52.295 54.415 -2.120 1
1 500 . 1 1 1 A 41 41 LEU CB C 41 44.147 42.309 1.838 1
1 504 . 1 1 1 A 41 41 LEU N N 41 120.541 114.147 6.394 1
1 505 . 1 1 1 A 42 42 ILE H H 42 7.407 7.624 -0.217 1
1 506 . 1 1 1 A 42 42 ILE HA H 42 3.756 4.396 -0.640 1
1 516 . 1 1 1 A 42 42 ILE C C 42 178.081 175.911 2.170 1
1 517 . 1 1 1 A 42 42 ILE CA C 42 62.257 58.901 3.356 1
1 518 . 1 1 1 A 42 42 ILE CB C 42 38.256 38.866 -0.610 1
1 522 . 1 1 1 A 42 42 ILE N N 42 115.050 119.814 -4.764 1
1 523 . 1 1 1 A 43 43 SER H H 43 8.581 8.504 0.077 1
1 524 . 1 1 1 A 43 43 SER HA H 43 3.957 4.265 -0.308 1
1 527 . 1 1 1 A 43 43 SER C C 43 177.830 176.763 1.067 1
1 528 . 1 1 1 A 43 43 SER CA C 43 61.958 60.766 1.192 1
1 529 . 1 1 1 A 43 43 SER CB C 43 62.680 63.567 -0.887 1
1 530 . 1 1 1 A 43 43 SER N N 43 121.456 116.389 5.067 1
1 531 . 1 1 1 A 44 44 GLY H H 44 8.892 8.641 0.251 1
1 532 . 1 1 1 A 44 44 GLY HA2 H 44 3.514 3.757 -0.243 1
1 533 . 1 1 1 A 44 44 GLY HA3 H 44 3.854 3.760 0.094 1
1 534 . 1 1 1 A 44 44 GLY C C 44 175.296 175.570 -0.274 1
1 535 . 1 1 1 A 44 44 GLY CA C 44 46.854 46.695 0.159 1
1 536 . 1 1 1 A 44 44 GLY N N 44 106.351 108.461 -2.110 1
1 537 . 1 1 1 A 45 45 LEU H H 45 6.824 7.976 -1.152 1
1 538 . 1 1 1 A 45 45 LEU HA H 45 3.909 3.923 -0.014 1
1 548 . 1 1 1 A 45 45 LEU C C 45 176.738 178.808 -2.070 1
1 549 . 1 1 1 A 45 45 LEU CA C 45 56.356 57.623 -1.267 1
1 550 . 1 1 1 A 45 45 LEU CB C 45 42.296 41.140 1.156 1
1 554 . 1 1 1 A 45 45 LEU N N 45 119.207 123.376 -4.169 1
1 555 . 1 1 1 A 46 46 GLU H H 46 7.556 8.164 -0.608 1
1 556 . 1 1 1 A 46 46 GLU HA H 46 3.664 4.111 -0.447 1
1 561 . 1 1 1 A 46 46 GLU C C 46 179.231 179.668 -0.437 1
1 562 . 1 1 1 A 46 46 GLU CA C 46 62.316 59.812 2.504 1
1 563 . 1 1 1 A 46 46 GLU CB C 46 29.147 29.233 -0.086 1
1 565 . 1 1 1 A 46 46 GLU N N 46 119.049 117.524 1.525 1
1 566 . 1 1 1 A 47 47 THR H H 47 8.219 8.111 0.108 1
1 567 . 1 1 1 A 47 47 THR HA H 47 3.965 3.953 0.012 1
1 572 . 1 1 1 A 47 47 THR C C 47 176.251 176.385 -0.134 1
1 573 . 1 1 1 A 47 47 THR CA C 47 65.947 66.597 -0.650 1
1 574 . 1 1 1 A 47 47 THR CB C 47 69.014 68.274 0.740 1
1 576 . 1 1 1 A 47 47 THR N N 47 111.770 118.029 -6.259 1
1 577 . 1 1 1 A 48 48 ALA H H 48 6.794 7.902 -1.108 1
1 578 . 1 1 1 A 48 48 ALA HA H 48 4.171 4.219 -0.048 1
1 582 . 1 1 1 A 48 48 ALA C C 48 178.639 180.231 -1.592 1
1 583 . 1 1 1 A 48 48 ALA CA C 48 54.072 55.199 -1.127 1
1 584 . 1 1 1 A 48 48 ALA CB C 48 19.752 18.134 1.618 1
1 585 . 1 1 1 A 48 48 ALA N N 48 122.697 123.670 -0.973 1
1 586 . 1 1 1 A 49 49 LEU H H 49 7.691 8.679 -0.988 1
1 587 . 1 1 1 A 49 49 LEU HA H 49 3.902 4.339 -0.437 1
1 597 . 1 1 1 A 49 49 LEU C C 49 176.823 177.881 -1.058 1
1 598 . 1 1 1 A 49 49 LEU CA C 49 57.190 58.020 -0.830 1
1 599 . 1 1 1 A 49 49 LEU CB C 49 43.628 41.358 2.270 1
1 603 . 1 1 1 A 49 49 LEU N N 49 117.159 117.818 -0.659 1
1 604 . 1 1 1 A 50 50 GLU H H 50 6.963 7.733 -0.770 1
1 605 . 1 1 1 A 50 50 GLU HA H 50 3.220 4.033 -0.813 1
1 610 . 1 1 1 A 50 50 GLU C C 50 176.691 177.509 -0.818 1
1 611 . 1 1 1 A 50 50 GLU CA C 50 58.769 58.489 0.280 1
1 612 . 1 1 1 A 50 50 GLU CB C 50 29.792 29.652 0.140 1
1 614 . 1 1 1 A 50 50 GLU N N 50 118.761 119.649 -0.888 1
1 615 . 1 1 1 A 51 51 GLY H H 51 8.541 8.347 0.194 1
1 616 . 1 1 1 A 51 51 GLY HA2 H 51 4.140 3.831 0.309 1
1 617 . 1 1 1 A 51 51 GLY HA3 H 51 3.488 3.905 -0.417 1
1 618 . 1 1 1 A 51 51 GLY C C 51 173.801 174.065 -0.264 1
1 619 . 1 1 1 A 51 51 GLY CA C 51 45.498 45.202 0.296 1
1 620 . 1 1 1 A 51 51 GLY N N 51 113.511 112.076 1.435 1
1 621 . 1 1 1 A 52 52 HIS H H 52 7.656 7.625 0.031 1
1 622 . 1 1 1 A 52 52 HIS HA H 52 4.318 4.578 -0.260 1
1 627 . 1 1 1 A 52 52 HIS C C 52 172.815 174.261 -1.446 1
1 628 . 1 1 1 A 52 52 HIS CA C 52 57.562 56.116 1.446 1
1 629 . 1 1 1 A 52 52 HIS CB C 52 28.670 30.828 -2.158 1
1 632 . 1 1 1 A 52 52 HIS N N 52 116.844 118.601 -1.757 1
1 633 . 1 1 1 A 53 53 GLU H H 53 8.331 9.097 -0.766 1
1 634 . 1 1 1 A 53 53 GLU HA H 53 4.636 4.879 -0.243 1
1 639 . 1 1 1 A 53 53 GLU C C 53 176.145 176.107 0.038 1
1 640 . 1 1 1 A 53 53 GLU CA C 53 54.891 54.353 0.538 1
1 641 . 1 1 1 A 53 53 GLU CB C 53 33.837 33.287 0.550 1
1 643 . 1 1 1 A 53 53 GLU N N 53 118.873 119.825 -0.952 1
1 644 . 1 1 1 A 54 54 VAL H H 54 8.585 8.428 0.157 1
1 645 . 1 1 1 A 54 54 VAL HA H 54 3.227 4.013 -0.786 1
1 653 . 1 1 1 A 54 54 VAL C C 54 177.218 176.490 0.728 1
1 654 . 1 1 1 A 54 54 VAL CA C 54 65.848 63.546 2.302 1
1 655 . 1 1 1 A 54 54 VAL CB C 54 31.189 31.541 -0.352 1
1 658 . 1 1 1 A 54 54 VAL N N 54 120.580 121.618 -1.038 1
1 659 . 1 1 1 A 55 55 GLY H H 55 8.912 9.517 -0.605 1
1 660 . 1 1 1 A 55 55 GLY HA2 H 55 4.441 4.058 0.383 1
1 661 . 1 1 1 A 55 55 GLY HA3 H 55 3.865 4.060 -0.195 1
1 662 . 1 1 1 A 55 55 GLY C C 55 174.827 173.986 0.841 1
1 663 . 1 1 1 A 55 55 GLY CA C 55 44.370 44.841 -0.471 1
1 664 . 1 1 1 A 55 55 GLY N N 55 118.078 115.227 2.851 1
1 665 . 1 1 1 A 56 56 ASP H H 56 8.098 7.796 0.302 1
1 666 . 1 1 1 A 56 56 ASP HA H 56 4.547 4.694 -0.147 1
1 669 . 1 1 1 A 56 56 ASP C C 56 174.859 175.237 -0.378 1
1 670 . 1 1 1 A 56 56 ASP CA C 56 55.629 54.732 0.897 1
1 671 . 1 1 1 A 56 56 ASP CB C 56 40.906 41.826 -0.920 1
1 672 . 1 1 1 A 56 56 ASP N N 56 123.094 122.328 0.766 1
1 673 . 1 1 1 A 57 57 LYS H H 57 8.168 8.669 -0.501 1
1 674 . 1 1 1 A 57 57 LYS HA H 57 5.471 6.020 -0.549 1
1 683 . 1 1 1 A 57 57 LYS C C 57 175.732 175.114 0.618 1
1 684 . 1 1 1 A 57 57 LYS CA C 57 55.056 54.892 0.164 1
1 685 . 1 1 1 A 57 57 LYS CB C 57 35.302 36.175 -0.873 1
1 689 . 1 1 1 A 57 57 LYS N N 57 122.301 126.472 -4.171 1
1 690 . 1 1 1 A 58 58 PHE H H 58 8.355 8.517 -0.162 1
1 691 . 1 1 1 A 58 58 PHE HA H 58 4.858 5.042 -0.184 1
1 699 . 1 1 1 A 58 58 PHE C C 58 171.549 172.290 -0.741 1
1 700 . 1 1 1 A 58 58 PHE CA C 58 56.195 56.443 -0.248 1
1 701 . 1 1 1 A 58 58 PHE CB C 58 39.335 40.635 -1.300 1
1 705 . 1 1 1 A 58 58 PHE N N 58 121.026 120.873 0.153 1
1 706 . 1 1 1 A 59 59 ASP H H 59 8.407 8.814 -0.407 1
1 707 . 1 1 1 A 59 59 ASP HA H 59 5.743 5.779 -0.036 1
1 710 . 1 1 1 A 59 59 ASP C C 59 176.302 175.313 0.989 1
1 711 . 1 1 1 A 59 59 ASP CA C 59 52.579 52.857 -0.278 1
1 712 . 1 1 1 A 59 59 ASP CB C 59 43.628 42.617 1.011 1
1 713 . 1 1 1 A 59 59 ASP N N 59 119.234 119.539 -0.305 1
1 714 . 1 1 1 A 60 60 VAL H H 60 8.915 9.184 -0.269 1
1 715 . 1 1 1 A 60 60 VAL HA H 60 4.374 5.090 -0.716 1
1 723 . 1 1 1 A 60 60 VAL C C 60 173.140 174.797 -1.657 1
1 724 . 1 1 1 A 60 60 VAL CA C 60 61.252 60.886 0.366 1
1 725 . 1 1 1 A 60 60 VAL CB C 60 35.620 34.912 0.708 1
1 728 . 1 1 1 A 60 60 VAL N N 60 119.758 121.565 -1.807 1
1 729 . 1 1 1 A 61 61 ALA H H 61 8.761 8.985 -0.224 1
1 730 . 1 1 1 A 61 61 ALA HA H 61 5.091 5.486 -0.395 1
1 734 . 1 1 1 A 61 61 ALA C C 61 176.460 176.321 0.139 1
1 735 . 1 1 1 A 61 61 ALA CA C 61 51.019 50.674 0.345 1
1 736 . 1 1 1 A 61 61 ALA CB C 61 19.447 20.978 -1.531 1
1 737 . 1 1 1 A 61 61 ALA N N 61 133.341 128.709 4.632 1
1 738 . 1 1 1 A 62 62 VAL H H 62 8.929 9.060 -0.131 1
1 739 . 1 1 1 A 62 62 VAL HA H 62 4.236 4.712 -0.476 1
1 747 . 1 1 1 A 62 62 VAL C C 62 174.733 175.679 -0.946 1
1 748 . 1 1 1 A 62 62 VAL CA C 62 61.007 60.909 0.098 1
1 749 . 1 1 1 A 62 62 VAL CB C 62 34.387 35.660 -1.273 1
1 752 . 1 1 1 A 62 62 VAL N N 62 124.165 122.903 1.262 1
1 753 . 1 1 1 A 63 63 GLY H H 63 8.995 8.665 0.330 1
1 754 . 1 1 1 A 63 63 GLY HA2 H 63 4.229 4.137 0.092 1
1 755 . 1 1 1 A 63 63 GLY HA3 H 63 3.637 4.138 -0.501 1
1 756 . 1 1 1 A 63 63 GLY C C 63 175.306 174.937 0.369 1
1 757 . 1 1 1 A 63 63 GLY CA C 63 44.620 45.281 -0.661 1
1 758 . 1 1 1 A 63 63 GLY N N 63 115.598 112.377 3.221 1
1 759 . 1 1 1 A 64 64 ALA H H 64 8.106 8.889 -0.783 1
1 760 . 1 1 1 A 64 64 ALA HA H 64 4.010 4.552 -0.542 1
1 764 . 1 1 1 A 64 64 ALA C C 64 180.218 179.346 0.872 1
1 765 . 1 1 1 A 64 64 ALA CA C 64 55.897 54.691 1.206 1
1 766 . 1 1 1 A 64 64 ALA CB C 64 18.347 18.450 -0.103 1
1 767 . 1 1 1 A 64 64 ALA N N 64 122.859 123.910 -1.051 1
1 768 . 1 1 1 A 65 65 ASN H H 65 8.748 8.348 0.400 1
1 769 . 1 1 1 A 65 65 ASN HA H 65 4.230 4.516 -0.286 1
1 774 . 1 1 1 A 65 65 ASN C C 65 176.085 176.112 -0.027 1
1 775 . 1 1 1 A 65 65 ASN CA C 65 56.064 56.119 -0.055 1
1 776 . 1 1 1 A 65 65 ASN CB C 65 37.871 38.582 -0.711 1
1 777 . 1 1 1 A 65 65 ASN N N 65 114.590 117.836 -3.246 1
1 779 . 1 1 1 A 66 66 ASP H H 66 7.598 8.307 -0.709 1
1 780 . 1 1 1 A 66 66 ASP HA H 66 4.682 4.804 -0.122 1
1 783 . 1 1 1 A 66 66 ASP C C 66 173.061 175.222 -2.161 1
1 784 . 1 1 1 A 66 66 ASP CA C 66 53.549 53.997 -0.448 1
1 785 . 1 1 1 A 66 66 ASP CB C 66 42.204 42.591 -0.387 1
1 786 . 1 1 1 A 66 66 ASP N N 66 118.065 116.188 1.877 1
1 787 . 1 1 1 A 67 67 ALA H H 67 7.434 7.732 -0.298 1
1 788 . 1 1 1 A 67 67 ALA HA H 67 4.316 4.354 -0.038 1
1 792 . 1 1 1 A 67 67 ALA C C 67 175.615 176.378 -0.763 1
1 793 . 1 1 1 A 67 67 ALA CA C 67 50.814 50.769 0.045 1
1 794 . 1 1 1 A 67 67 ALA CB C 67 18.618 21.387 -2.769 1
1 795 . 1 1 1 A 67 67 ALA N N 67 124.890 119.679 5.211 1
1 796 . 1 1 1 A 68 68 TYR H H 68 8.390 8.422 -0.032 1
1 797 . 1 1 1 A 68 68 TYR HA H 68 4.195 4.639 -0.444 1
1 804 . 1 1 1 A 68 68 TYR C C 68 174.964 176.962 -1.998 1
1 805 . 1 1 1 A 68 68 TYR CA C 68 59.566 57.934 1.632 1
1 806 . 1 1 1 A 68 68 TYR CB C 68 36.992 39.562 -2.570 1
1 809 . 1 1 1 A 68 68 TYR N N 68 121.083 117.208 3.875 1
1 810 . 1 1 1 A 69 69 GLY H H 69 8.149 8.968 -0.819 1
1 811 . 1 1 1 A 69 69 GLY HA2 H 69 4.254 4.050 0.204 1
1 812 . 1 1 1 A 69 69 GLY HA3 H 69 3.624 4.063 -0.439 1
1 813 . 1 1 1 A 69 69 GLY C C 69 173.161 174.889 -1.728 1
1 814 . 1 1 1 A 69 69 GLY CA C 69 44.465 45.525 -1.060 1
1 815 . 1 1 1 A 69 69 GLY N N 69 108.762 110.708 -1.946 1
1 816 . 1 1 1 A 70 70 GLN H H 70 8.450 7.755 0.695 1
1 817 . 1 1 1 A 70 70 GLN HA H 70 4.140 4.411 -0.271 1
1 824 . 1 1 1 A 70 70 GLN C C 70 176.138 175.714 0.424 1
1 825 . 1 1 1 A 70 70 GLN CA C 70 54.680 56.262 -1.582 1
1 826 . 1 1 1 A 70 70 GLN CB C 70 29.210 29.982 -0.772 1
1 828 . 1 1 1 A 70 70 GLN N N 70 117.002 119.914 -2.912 1
1 830 . 1 1 1 A 71 71 TYR H H 71 8.991 8.582 0.409 1
1 831 . 1 1 1 A 71 71 TYR HA H 71 3.752 4.836 -1.084 1
1 838 . 1 1 1 A 71 71 TYR C C 71 174.548 174.377 0.171 1
1 839 . 1 1 1 A 71 71 TYR CA C 71 59.868 59.774 0.094 1
1 840 . 1 1 1 A 71 71 TYR CB C 71 38.961 39.083 -0.122 1
1 843 . 1 1 1 A 71 71 TYR N N 71 125.112 122.825 2.287 1
1 844 . 1 1 1 A 72 72 ASP H H 72 8.819 8.663 0.156 1
1 845 . 1 1 1 A 72 72 ASP HA H 72 4.773 4.657 0.116 1
1 848 . 1 1 1 A 72 72 ASP C C 72 177.709 175.645 2.064 1
1 849 . 1 1 1 A 72 72 ASP CA C 72 52.382 52.394 -0.012 1
1 850 . 1 1 1 A 72 72 ASP CB C 72 42.197 42.784 -0.587 1
1 851 . 1 1 1 A 72 72 ASP N N 72 129.918 127.998 1.920 1
1 852 . 1 1 1 A 73 73 GLU H H 73 9.409 8.620 0.789 1
1 853 . 1 1 1 A 73 73 GLU HA H 73 3.937 3.975 -0.038 1
1 858 . 1 1 1 A 73 73 GLU C C 73 177.581 177.028 0.553 1
1 859 . 1 1 1 A 73 73 GLU CA C 73 58.962 58.141 0.821 1
1 860 . 1 1 1 A 73 73 GLU CB C 73 29.155 28.588 0.567 1
1 862 . 1 1 1 A 73 73 GLU N N 73 129.624 124.749 4.875 1
1 863 . 1 1 1 A 74 74 ASN H H 74 8.700 7.918 0.782 1
1 864 . 1 1 1 A 74 74 ASN HA H 74 4.550 4.570 -0.020 1
1 869 . 1 1 1 A 74 74 ASN C C 74 176.190 176.647 -0.457 1
1 870 . 1 1 1 A 74 74 ASN CA C 74 54.932 55.152 -0.220 1
1 871 . 1 1 1 A 74 74 ASN CB C 74 38.113 38.112 0.001 1
1 872 . 1 1 1 A 74 74 ASN N N 74 116.792 117.771 -0.979 1
1 874 . 1 1 1 A 75 75 LEU H H 75 7.303 7.794 -0.491 1
1 875 . 1 1 1 A 75 75 LEU HA H 75 4.289 4.271 0.018 1
1 885 . 1 1 1 A 75 75 LEU C C 75 175.821 176.355 -0.534 1
1 886 . 1 1 1 A 75 75 LEU CA C 75 54.106 56.260 -2.154 1
1 887 . 1 1 1 A 75 75 LEU CB C 75 41.239 42.593 -1.354 1
1 891 . 1 1 1 A 75 75 LEU N N 75 117.094 119.325 -2.231 1
1 892 . 1 1 1 A 76 76 VAL H H 76 7.181 7.515 -0.334 1
1 893 . 1 1 1 A 76 76 VAL HA H 76 4.970 4.710 0.260 1
1 901 . 1 1 1 A 76 76 VAL C C 76 175.702 174.452 1.250 1
1 902 . 1 1 1 A 76 76 VAL CA C 76 61.733 59.981 1.752 1
1 903 . 1 1 1 A 76 76 VAL CB C 76 31.822 34.553 -2.731 1
1 905 . 1 1 1 A 76 76 VAL N N 76 124.716 119.339 5.377 1
1 906 . 1 1 1 A 77 77 GLN H H 77 8.791 8.694 0.097 1
1 907 . 1 1 1 A 77 77 GLN HA H 77 4.695 4.967 -0.272 1
1 914 . 1 1 1 A 77 77 GLN C C 77 173.553 173.330 0.223 1
1 915 . 1 1 1 A 77 77 GLN CA C 77 54.038 54.454 -0.416 1
1 916 . 1 1 1 A 77 77 GLN CB C 77 33.018 32.414 0.604 1
1 918 . 1 1 1 A 77 77 GLN N N 77 124.898 125.772 -0.874 1
1 920 . 1 1 1 A 78 78 ARG H H 78 8.530 8.502 0.028 1
1 921 . 1 1 1 A 78 78 ARG HA H 78 5.107 5.345 -0.238 1
1 928 . 1 1 1 A 78 78 ARG C C 78 176.182 175.298 0.884 1
1 929 . 1 1 1 A 78 78 ARG CA C 78 55.355 54.810 0.545 1
1 930 . 1 1 1 A 78 78 ARG CB C 78 31.150 32.179 -1.029 1
1 933 . 1 1 1 A 78 78 ARG N N 78 123.413 119.303 4.110 1
1 934 . 1 1 1 A 79 79 VAL H H 79 9.300 8.687 0.613 1
1 935 . 1 1 1 A 79 79 VAL HA H 79 4.824 4.571 0.253 1
1 943 . 1 1 1 A 79 79 VAL CA C 79 58.731 58.771 -0.040 1
1 944 . 1 1 1 A 79 79 VAL CB C 79 34.836 33.808 1.028 1
1 947 . 1 1 1 A 79 79 VAL N N 79 125.252 124.615 0.637 1
1 948 . 1 1 1 A 80 80 PRO HA H 80 4.339 4.726 -0.387 1
1 955 . 1 1 1 A 80 80 PRO C C 80 176.902 178.018 -1.116 1
1 956 . 1 1 1 A 80 80 PRO CA C 80 62.969 63.391 -0.422 1
1 957 . 1 1 1 A 80 80 PRO CB C 80 32.431 32.194 0.237 1
1 960 . 1 1 1 A 81 81 LYS H H 81 7.816 9.103 -1.287 1
1 961 . 1 1 1 A 81 81 LYS HA H 81 3.790 4.194 -0.404 1
1 970 . 1 1 1 A 81 81 LYS C C 81 177.808 178.881 -1.073 1
1 971 . 1 1 1 A 81 81 LYS CA C 81 59.874 59.756 0.118 1
1 972 . 1 1 1 A 81 81 LYS CB C 81 32.670 32.114 0.556 1
1 976 . 1 1 1 A 81 81 LYS N N 81 120.948 124.310 -3.362 1
1 977 . 1 1 1 A 82 82 ASP H H 82 8.069 8.230 -0.161 1
1 978 . 1 1 1 A 82 82 ASP HA H 82 4.243 4.341 -0.098 1
1 981 . 1 1 1 A 82 82 ASP C C 82 177.157 178.186 -1.029 1
1 982 . 1 1 1 A 82 82 ASP CA C 82 55.527 57.553 -2.026 1
1 983 . 1 1 1 A 82 82 ASP CB C 82 40.005 41.770 -1.765 1
1 984 . 1 1 1 A 82 82 ASP N N 82 116.004 119.896 -3.892 1
1 985 . 1 1 1 A 83 83 VAL H H 83 7.150 7.460 -0.310 1
1 986 . 1 1 1 A 83 83 VAL HA H 83 3.719 3.700 0.019 1
1 994 . 1 1 1 A 83 83 VAL C C 83 176.346 176.912 -0.566 1
1 995 . 1 1 1 A 83 83 VAL CA C 83 63.868 65.031 -1.163 1
1 996 . 1 1 1 A 83 83 VAL CB C 83 31.689 31.124 0.565 1
1 999 . 1 1 1 A 83 83 VAL N N 83 117.199 116.411 0.788 1
1 1000 . 1 1 1 A 84 84 PHE H H 84 7.365 7.398 -0.033 1
1 1001 . 1 1 1 A 84 84 PHE HA H 84 4.389 4.591 -0.202 1
1 1009 . 1 1 1 A 84 84 PHE C C 84 175.265 176.486 -1.221 1
1 1010 . 1 1 1 A 84 84 PHE CA C 84 57.210 56.916 0.294 1
1 1011 . 1 1 1 A 84 84 PHE CB C 84 38.968 37.717 1.251 1
1 1015 . 1 1 1 A 84 84 PHE N N 84 119.897 120.259 -0.362 1
1 1016 . 1 1 1 A 85 85 MET H H 85 7.765 8.222 -0.457 1
1 1017 . 1 1 1 A 85 85 MET HA H 85 4.277 4.273 0.004 1
1 1025 . 1 1 1 A 85 85 MET C C 85 176.856 178.344 -1.488 1
1 1026 . 1 1 1 A 85 85 MET CA C 85 56.389 57.735 -1.346 1
1 1027 . 1 1 1 A 85 85 MET CB C 85 32.715 32.193 0.522 1
1 1030 . 1 1 1 A 85 85 MET N N 85 121.131 119.171 1.960 1
1 1031 . 1 1 1 A 86 86 GLY H H 86 8.499 8.155 0.344 1
1 1032 . 1 1 1 A 86 86 GLY HA2 H 86 3.928 3.971 -0.043 1
1 1033 . 1 1 1 A 86 86 GLY HA3 H 86 3.793 3.973 -0.180 1
1 1034 . 1 1 1 A 86 86 GLY C C 86 174.168 174.390 -0.222 1
1 1035 . 1 1 1 A 86 86 GLY CA C 86 45.637 45.394 0.243 1
1 1036 . 1 1 1 A 86 86 GLY N N 86 111.268 107.997 3.271 1
1 1037 . 1 1 1 A 87 87 VAL H H 87 7.564 7.629 -0.065 1
1 1038 . 1 1 1 A 87 87 VAL HA H 87 4.083 3.888 0.195 1
1 1046 . 1 1 1 A 87 87 VAL C C 87 175.649 176.123 -0.474 1
1 1047 . 1 1 1 A 87 87 VAL CA C 87 61.809 62.332 -0.523 1
1 1048 . 1 1 1 A 87 87 VAL CB C 87 32.667 31.836 0.831 1
1 1051 . 1 1 1 A 87 87 VAL N N 87 118.839 120.713 -1.874 1
1 1052 . 1 1 1 A 88 88 ASP H H 88 8.270 8.746 -0.476 1
1 1053 . 1 1 1 A 88 88 ASP HA H 88 4.421 4.370 0.051 1
1 1056 . 1 1 1 A 88 88 ASP C C 88 175.977 175.285 0.692 1
1 1057 . 1 1 1 A 88 88 ASP CA C 88 55.655 57.011 -1.356 1
1 1058 . 1 1 1 A 88 88 ASP CB C 88 41.364 41.305 0.059 1
1 1059 . 1 1 1 A 88 88 ASP N N 88 124.401 125.464 -1.063 1
1 1060 . 1 1 1 A 89 89 GLU H H 89 7.833 7.846 -0.013 1
1 1061 . 1 1 1 A 89 89 GLU HA H 89 4.206 4.707 -0.501 1
1 1066 . 1 1 1 A 89 89 GLU C C 89 174.912 175.488 -0.576 1
1 1067 . 1 1 1 A 89 89 GLU CA C 89 55.739 55.036 0.703 1
1 1068 . 1 1 1 A 89 89 GLU CB C 89 30.603 32.557 -1.954 1
1 1070 . 1 1 1 A 89 89 GLU N N 89 119.378 115.730 3.648 1
1 1071 . 1 1 1 A 90 90 LEU H H 90 8.051 8.711 -0.660 1
1 1072 . 1 1 1 A 90 90 LEU HA H 90 4.127 4.477 -0.350 1
1 1082 . 1 1 1 A 90 90 LEU C C 90 175.753 175.760 -0.007 1
1 1083 . 1 1 1 A 90 90 LEU CA C 90 54.929 54.795 0.134 1
1 1084 . 1 1 1 A 90 90 LEU CB C 90 42.710 40.826 1.884 1
1 1088 . 1 1 1 A 90 90 LEU N N 90 124.432 126.523 -2.091 1
1 1089 . 1 1 1 A 91 91 GLN H H 91 7.341 8.401 -1.060 1
1 1090 . 1 1 1 A 91 91 GLN HA H 91 4.546 4.866 -0.320 1
1 1097 . 1 1 1 A 91 91 GLN C C 91 174.655 174.609 0.046 1
1 1098 . 1 1 1 A 91 91 GLN CA C 91 53.671 53.944 -0.273 1
1 1099 . 1 1 1 A 91 91 GLN CB C 91 32.850 32.280 0.570 1
1 1101 . 1 1 1 A 91 91 GLN N N 91 120.186 125.734 -5.548 1
1 1103 . 1 1 1 A 92 92 VAL H H 92 8.442 8.499 -0.057 1
1 1104 . 1 1 1 A 92 92 VAL HA H 92 3.278 3.892 -0.614 1
1 1112 . 1 1 1 A 92 92 VAL C C 92 177.098 177.238 -0.140 1
1 1113 . 1 1 1 A 92 92 VAL CA C 92 64.953 64.401 0.552 1
1 1114 . 1 1 1 A 92 92 VAL CB C 92 31.601 31.792 -0.191 1
1 1117 . 1 1 1 A 92 92 VAL N N 92 121.899 123.859 -1.960 1
1 1118 . 1 1 1 A 93 93 GLY H H 93 9.002 9.699 -0.697 1
1 1119 . 1 1 1 A 93 93 GLY HA2 H 93 4.327 3.978 0.349 1
1 1120 . 1 1 1 A 93 93 GLY HA3 H 93 3.770 3.979 -0.209 1
1 1121 . 1 1 1 A 93 93 GLY C C 93 174.547 174.183 0.364 1
1 1122 . 1 1 1 A 93 93 GLY CA C 93 44.446 45.147 -0.701 1
1 1123 . 1 1 1 A 93 93 GLY N N 93 116.485 115.104 1.381 1
1 1124 . 1 1 1 A 94 94 MET H H 94 7.445 7.895 -0.450 1
1 1125 . 1 1 1 A 94 94 MET HA H 94 4.182 4.545 -0.363 1
1 1133 . 1 1 1 A 94 94 MET C C 94 174.531 175.152 -0.621 1
1 1134 . 1 1 1 A 94 94 MET CA C 94 57.193 55.536 1.657 1
1 1135 . 1 1 1 A 94 94 MET CB C 94 34.474 33.397 1.077 1
1 1138 . 1 1 1 A 94 94 MET N N 94 120.304 120.272 0.032 1
1 1139 . 1 1 1 A 95 95 ARG H H 95 8.169 8.600 -0.431 1
1 1140 . 1 1 1 A 95 95 ARG HA H 95 5.343 4.869 0.474 1
1 1147 . 1 1 1 A 95 95 ARG C C 95 175.593 175.205 0.388 1
1 1148 . 1 1 1 A 95 95 ARG CA C 95 54.898 54.732 0.166 1
1 1149 . 1 1 1 A 95 95 ARG CB C 95 32.928 33.060 -0.132 1
1 1152 . 1 1 1 A 95 95 ARG N N 95 122.066 122.982 -0.916 1
1 1153 . 1 1 1 A 96 96 PHE H H 96 8.440 8.154 0.286 1
1 1154 . 1 1 1 A 96 96 PHE HA H 96 4.738 4.998 -0.260 1
1 1162 . 1 1 1 A 96 96 PHE C C 96 173.273 172.124 1.149 1
1 1163 . 1 1 1 A 96 96 PHE CA C 96 56.174 56.073 0.101 1
1 1164 . 1 1 1 A 96 96 PHE CB C 96 42.474 40.727 1.747 1
1 1168 . 1 1 1 A 96 96 PHE N N 96 119.938 118.576 1.362 1
1 1169 . 1 1 1 A 97 97 LEU H H 97 8.459 8.686 -0.227 1
1 1170 . 1 1 1 A 97 97 LEU HA H 97 4.625 4.680 -0.055 1
1 1180 . 1 1 1 A 97 97 LEU C C 97 175.664 175.155 0.509 1
1 1181 . 1 1 1 A 97 97 LEU CA C 97 53.547 55.121 -1.574 1
1 1182 . 1 1 1 A 97 97 LEU CB C 97 42.379 43.008 -0.629 1
1 1186 . 1 1 1 A 97 97 LEU N N 97 122.014 123.016 -1.002 1
1 1187 . 1 1 1 A 98 98 ALA H H 98 8.812 8.805 0.007 1
1 1188 . 1 1 1 A 98 98 ALA HA H 98 4.520 5.428 -0.908 1
1 1192 . 1 1 1 A 98 98 ALA C C 98 176.373 176.079 0.294 1
1 1193 . 1 1 1 A 98 98 ALA CA C 98 50.639 50.253 0.386 1
1 1194 . 1 1 1 A 98 98 ALA CB C 98 20.939 22.301 -1.362 1
1 1195 . 1 1 1 A 98 98 ALA N N 98 129.296 129.614 -0.318 1
1 1196 . 1 1 1 A 99 99 GLU H H 99 8.504 8.689 -0.185 1
1 1197 . 1 1 1 A 99 99 GLU HA H 99 4.150 4.887 -0.737 1
1 1202 . 1 1 1 A 99 99 GLU C C 99 176.351 176.465 -0.114 1
1 1203 . 1 1 1 A 99 99 GLU CA C 99 56.830 55.902 0.928 1
1 1204 . 1 1 1 A 99 99 GLU CB C 99 29.639 30.605 -0.966 1
1 1206 . 1 1 1 A 99 99 GLU N N 99 121.993 122.267 -0.274 1
1 1207 . 1 1 1 A 100 100 THR H H 100 7.393 8.494 -1.101 1
1 1208 . 1 1 1 A 100 100 THR HA H 100 4.819 4.814 0.005 1
1 1213 . 1 1 1 A 100 100 THR C C 100 175.882 174.527 1.355 1
1 1214 . 1 1 1 A 100 100 THR CA C 100 60.329 60.262 0.067 1
1 1215 . 1 1 1 A 100 100 THR CB C 100 73.452 71.859 1.593 1
1 1217 . 1 1 1 A 100 100 THR N N 100 115.598 114.953 0.645 1
1 1218 . 1 1 1 A 101 101 ASP H H 101 8.988 8.931 0.057 1
1 1219 . 1 1 1 A 101 101 ASP HA H 101 4.357 4.303 0.054 1
1 1222 . 1 1 1 A 101 101 ASP C C 101 176.848 177.196 -0.348 1
1 1223 . 1 1 1 A 101 101 ASP CA C 101 56.493 57.398 -0.905 1
1 1224 . 1 1 1 A 101 101 ASP CB C 101 39.973 40.620 -0.647 1
1 1225 . 1 1 1 A 101 101 ASP N N 101 121.468 121.189 0.279 1
1 1226 . 1 1 1 A 102 102 GLN H H 102 7.937 7.652 0.285 1
1 1227 . 1 1 1 A 102 102 GLN HA H 102 4.415 4.460 -0.045 1
1 1234 . 1 1 1 A 102 102 GLN C C 102 175.252 175.918 -0.666 1
1 1235 . 1 1 1 A 102 102 GLN CA C 102 55.097 55.064 0.033 1
1 1236 . 1 1 1 A 102 102 GLN CB C 102 29.121 28.816 0.305 1
1 1238 . 1 1 1 A 102 102 GLN N N 102 117.199 115.430 1.769 1
1 1240 . 1 1 1 A 103 103 GLY H H 103 7.431 7.943 -0.512 1
1 1241 . 1 1 1 A 103 103 GLY HA2 H 103 4.504 4.306 0.198 1
1 1242 . 1 1 1 A 103 103 GLY HA3 H 103 3.868 4.308 -0.440 1
1 1243 . 1 1 1 A 103 103 GLY CA C 103 44.051 44.340 -0.289 1
1 1244 . 1 1 1 A 103 103 GLY N N 103 110.056 107.596 2.460 1
1 1245 . 1 1 1 A 104 104 PRO HA H 104 5.057 5.100 -0.043 1
1 1252 . 1 1 1 A 104 104 PRO C C 104 177.873 175.781 2.092 1
1 1253 . 1 1 1 A 104 104 PRO CA C 104 62.464 63.103 -0.639 1
1 1254 . 1 1 1 A 104 104 PRO CB C 104 31.939 31.971 -0.032 1
1 1257 . 1 1 1 A 105 105 VAL H H 105 8.960 9.458 -0.498 1
1 1258 . 1 1 1 A 105 105 VAL HA H 105 4.678 4.611 0.067 1
1 1266 . 1 1 1 A 105 105 VAL CA C 105 58.474 59.266 -0.792 1
1 1267 . 1 1 1 A 105 105 VAL CB C 105 35.512 34.386 1.126 1
1 1270 . 1 1 1 A 105 105 VAL N N 105 123.240 123.183 0.057 1
1 1271 . 1 1 1 A 106 106 PRO HA H 106 4.777 4.776 0.001 1
1 1278 . 1 1 1 A 106 106 PRO C C 106 176.823 176.203 0.620 1
1 1279 . 1 1 1 A 106 106 PRO CA C 106 62.508 62.370 0.138 1
1 1280 . 1 1 1 A 106 106 PRO CB C 106 31.650 31.444 0.206 1
1 1283 . 1 1 1 A 107 107 VAL H H 107 8.835 7.818 1.017 1
1 1284 . 1 1 1 A 107 107 VAL HA H 107 4.719 5.014 -0.295 1
1 1292 . 1 1 1 A 107 107 VAL C C 107 173.661 173.433 0.228 1
1 1293 . 1 1 1 A 107 107 VAL CA C 107 59.026 59.207 -0.181 1
1 1294 . 1 1 1 A 107 107 VAL CB C 107 36.406 35.244 1.162 1
1 1297 . 1 1 1 A 107 107 VAL N N 107 117.474 117.148 0.326 1
1 1298 . 1 1 1 A 108 108 GLU H H 108 7.698 8.628 -0.930 1
1 1299 . 1 1 1 A 108 108 GLU HA H 108 5.133 4.926 0.207 1
1 1304 . 1 1 1 A 108 108 GLU C C 108 176.394 174.920 1.474 1
1 1305 . 1 1 1 A 108 108 GLU CA C 108 53.808 54.519 -0.711 1
1 1306 . 1 1 1 A 108 108 GLU CB C 108 33.984 33.440 0.544 1
1 1308 . 1 1 1 A 108 108 GLU N N 108 120.646 120.048 0.598 1
1 1309 . 1 1 1 A 109 109 ILE H H 109 8.690 8.895 -0.205 1
1 1310 . 1 1 1 A 109 109 ILE HA H 109 4.484 4.311 0.173 1
1 1320 . 1 1 1 A 109 109 ILE C C 109 177.313 177.024 0.289 1
1 1321 . 1 1 1 A 109 109 ILE CA C 109 61.789 61.715 0.074 1
1 1322 . 1 1 1 A 109 109 ILE CB C 109 36.628 37.789 -1.161 1
1 1326 . 1 1 1 A 109 109 ILE N N 109 124.739 127.331 -2.592 1
1 1327 . 1 1 1 A 110 110 THR H H 110 9.300 9.552 -0.252 1
1 1328 . 1 1 1 A 110 110 THR HA H 110 4.547 4.629 -0.082 1
1 1333 . 1 1 1 A 110 110 THR C C 110 174.904 174.490 0.414 1
1 1334 . 1 1 1 A 110 110 THR CA C 110 62.260 61.213 1.047 1
1 1335 . 1 1 1 A 110 110 THR CB C 110 69.100 69.687 -0.587 1
1 1337 . 1 1 1 A 110 110 THR N N 110 122.544 118.047 4.497 1
1 1338 . 1 1 1 A 111 111 ALA H H 111 7.673 7.534 0.139 1
1 1339 . 1 1 1 A 111 111 ALA HA H 111 4.367 4.571 -0.204 1
1 1343 . 1 1 1 A 111 111 ALA C C 111 175.019 175.014 0.005 1
1 1344 . 1 1 1 A 111 111 ALA CA C 111 53.125 51.844 1.281 1
1 1345 . 1 1 1 A 111 111 ALA CB C 111 21.539 22.299 -0.760 1
1 1346 . 1 1 1 A 111 111 ALA N N 111 123.153 120.941 2.212 1
1 1347 . 1 1 1 A 112 112 VAL H H 112 8.707 8.402 0.305 1
1 1348 . 1 1 1 A 112 112 VAL HA H 112 4.129 4.595 -0.466 1
1 1356 . 1 1 1 A 112 112 VAL C C 112 174.755 175.069 -0.314 1
1 1357 . 1 1 1 A 112 112 VAL CA C 112 62.898 61.562 1.336 1
1 1358 . 1 1 1 A 112 112 VAL CB C 112 33.379 34.492 -1.113 1
1 1361 . 1 1 1 A 112 112 VAL N N 112 122.369 119.944 2.425 1
1 1362 . 1 1 1 A 113 113 GLU H H 113 8.144 8.940 -0.796 1
1 1363 . 1 1 1 A 113 113 GLU HA H 113 4.645 4.577 0.068 1
1 1368 . 1 1 1 A 113 113 GLU C C 113 175.102 177.322 -2.220 1
1 1369 . 1 1 1 A 113 113 GLU CA C 113 54.080 55.166 -1.086 1
1 1370 . 1 1 1 A 113 113 GLU CB C 113 31.234 30.970 0.264 1
1 1372 . 1 1 1 A 113 113 GLU N N 113 127.435 127.022 0.413 1
1 1373 . 1 1 1 A 114 114 ASP H H 114 8.472 8.519 -0.047 1
1 1374 . 1 1 1 A 114 114 ASP HA H 114 4.209 4.267 -0.058 1
1 1377 . 1 1 1 A 114 114 ASP C C 114 177.679 177.184 0.495 1
1 1378 . 1 1 1 A 114 114 ASP CA C 114 58.334 56.837 1.497 1
1 1379 . 1 1 1 A 114 114 ASP CB C 114 40.347 41.032 -0.685 1
1 1380 . 1 1 1 A 114 114 ASP N N 114 119.844 120.784 -0.940 1
1 1381 . 1 1 1 A 115 115 ASP H H 115 8.475 7.822 0.653 1
1 1382 . 1 1 1 A 115 115 ASP HA H 115 4.848 4.861 -0.013 1
1 1385 . 1 1 1 A 115 115 ASP C C 115 175.968 175.182 0.786 1
1 1386 . 1 1 1 A 115 115 ASP CA C 115 53.290 53.451 -0.161 1
1 1387 . 1 1 1 A 115 115 ASP CB C 115 42.080 43.312 -1.232 1
1 1388 . 1 1 1 A 115 115 ASP N N 115 114.364 114.123 0.241 1
1 1389 . 1 1 1 A 116 116 HIS H H 116 7.185 7.659 -0.474 1
1 1390 . 1 1 1 A 116 116 HIS HA H 116 5.106 5.542 -0.436 1
1 1395 . 1 1 1 A 116 116 HIS C C 116 172.393 172.706 -0.313 1
1 1396 . 1 1 1 A 116 116 HIS CA C 116 56.099 53.957 2.142 1
1 1397 . 1 1 1 A 116 116 HIS CB C 116 33.289 33.487 -0.198 1
1 1400 . 1 1 1 A 116 116 HIS N N 116 117.212 114.403 2.809 1
1 1401 . 1 1 1 A 117 117 VAL H H 117 9.130 9.224 -0.094 1
1 1402 . 1 1 1 A 117 117 VAL HA H 117 4.649 4.921 -0.272 1
1 1410 . 1 1 1 A 117 117 VAL C C 117 173.832 174.585 -0.753 1
1 1411 . 1 1 1 A 117 117 VAL CA C 117 59.555 59.638 -0.083 1
1 1412 . 1 1 1 A 117 117 VAL CB C 117 34.676 34.806 -0.130 1
1 1415 . 1 1 1 A 117 117 VAL N N 117 114.046 115.963 -1.917 1
1 1416 . 1 1 1 A 118 118 VAL H H 118 8.680 9.152 -0.472 1
1 1417 . 1 1 1 A 118 118 VAL HA H 118 4.747 4.700 0.047 1
1 1425 . 1 1 1 A 118 118 VAL C C 118 175.836 175.407 0.429 1
1 1426 . 1 1 1 A 118 118 VAL CA C 118 62.159 61.311 0.848 1
1 1427 . 1 1 1 A 118 118 VAL CB C 118 31.887 33.110 -1.223 1
1 1430 . 1 1 1 A 118 118 VAL N N 118 125.095 122.065 3.030 1
1 1431 . 1 1 1 A 119 119 VAL H H 119 9.057 8.836 0.221 1
1 1432 . 1 1 1 A 119 119 VAL HA H 119 5.231 5.164 0.067 1
1 1440 . 1 1 1 A 119 119 VAL C C 119 173.747 173.719 0.028 1
1 1441 . 1 1 1 A 119 119 VAL CA C 119 58.326 59.137 -0.811 1
1 1442 . 1 1 1 A 119 119 VAL CB C 119 34.387 34.813 -0.426 1
1 1445 . 1 1 1 A 119 119 VAL N N 119 121.494 121.761 -0.267 1
1 1446 . 1 1 1 A 120 120 ASP H H 120 8.926 8.537 0.389 1
1 1447 . 1 1 1 A 120 120 ASP HA H 120 5.174 5.260 -0.086 1
1 1450 . 1 1 1 A 120 120 ASP C C 120 177.982 176.338 1.644 1
1 1451 . 1 1 1 A 120 120 ASP CA C 120 52.749 52.630 0.119 1
1 1452 . 1 1 1 A 120 120 ASP CB C 120 44.542 43.594 0.948 1
1 1453 . 1 1 1 A 120 120 ASP N N 120 121.454 125.433 -3.979 1
1 1454 . 1 1 1 A 121 121 GLY H H 121 8.674 8.776 -0.102 1
1 1455 . 1 1 1 A 121 121 GLY HA2 H 121 4.702 3.853 0.849 1
1 1456 . 1 1 1 A 121 121 GLY HA3 H 121 3.573 3.864 -0.291 1
1 1457 . 1 1 1 A 121 121 GLY C C 121 175.041 174.470 0.571 1
1 1458 . 1 1 1 A 121 121 GLY CA C 121 45.319 46.737 -1.418 1
1 1459 . 1 1 1 A 121 121 GLY N N 121 114.850 112.984 1.866 1
1 1460 . 1 1 1 A 122 122 ASN H H 122 8.762 8.044 0.718 1
1 1461 . 1 1 1 A 122 122 ASN HA H 122 4.183 5.649 -1.466 1
1 1466 . 1 1 1 A 122 122 ASN C C 122 175.406 174.935 0.471 1
1 1467 . 1 1 1 A 122 122 ASN CA C 122 54.686 53.075 1.611 1
1 1468 . 1 1 1 A 122 122 ASN CB C 122 40.139 38.858 1.281 1
1 1469 . 1 1 1 A 122 122 ASN N N 122 121.618 119.234 2.384 1
1 1471 . 1 1 1 A 123 123 HIS H H 123 8.929 9.217 -0.288 1
1 1472 . 1 1 1 A 123 123 HIS HA H 123 4.005 4.460 -0.455 1
1 1477 . 1 1 1 A 123 123 HIS C C 123 177.325 176.782 0.543 1
1 1478 . 1 1 1 A 123 123 HIS CA C 123 58.768 59.125 -0.357 1
1 1479 . 1 1 1 A 123 123 HIS CB C 123 31.172 30.576 0.596 1
1 1482 . 1 1 1 A 123 123 HIS N N 123 124.165 125.201 -1.036 1
1 1483 . 1 1 1 A 124 124 MET H H 124 8.266 8.590 -0.324 1
1 1484 . 1 1 1 A 124 124 MET HA H 124 4.048 3.954 0.094 1
1 1492 . 1 1 1 A 124 124 MET CA C 124 58.994 58.557 0.437 1
1 1493 . 1 1 1 A 124 124 MET CB C 124 32.777 32.185 0.592 1
1 1496 . 1 1 1 A 124 124 MET N N 124 129.443 117.462 11.981 1
1 1497 . 1 1 1 A 125 125 LEU H H 125 8.094 8.055 0.039 1
1 1498 . 1 1 1 A 125 125 LEU HA H 125 4.455 4.441 0.014 1
1 1504 . 1 1 1 A 125 125 LEU C C 125 177.860 176.962 0.898 1
1 1505 . 1 1 1 A 125 125 LEU CA C 125 53.517 55.497 -1.980 1
1 1506 . 1 1 1 A 125 125 LEU CB C 125 42.462 43.890 -1.428 1
1 1509 . 1 1 1 A 126 126 ALA H H 126 8.089 7.724 0.365 1
1 1510 . 1 1 1 A 126 126 ALA HA H 126 3.966 4.443 -0.477 1
1 1514 . 1 1 1 A 126 126 ALA C C 126 179.135 178.881 0.254 1
1 1515 . 1 1 1 A 126 126 ALA CA C 126 54.170 53.192 0.978 1
1 1516 . 1 1 1 A 126 126 ALA CB C 126 18.687 20.394 -1.707 1
1 1517 . 1 1 1 A 126 126 ALA N N 126 126.095 118.241 7.854 1
1 1518 . 1 1 1 A 127 127 GLY H H 127 9.499 8.224 1.275 1
1 1519 . 1 1 1 A 127 127 GLY HA2 H 127 4.207 3.989 0.218 1
1 1520 . 1 1 1 A 127 127 GLY HA3 H 127 3.598 4.008 -0.410 1
1 1521 . 1 1 1 A 127 127 GLY C C 127 173.568 174.440 -0.872 1
1 1522 . 1 1 1 A 127 127 GLY CA C 127 45.846 45.155 0.691 1
1 1523 . 1 1 1 A 127 127 GLY N N 127 110.073 108.497 1.576 1
1 1524 . 1 1 1 A 128 128 GLN H H 128 7.514 7.957 -0.443 1
1 1525 . 1 1 1 A 128 128 GLN HA H 128 4.496 4.342 0.154 1
1 1532 . 1 1 1 A 128 128 GLN C C 128 174.790 175.296 -0.506 1
1 1533 . 1 1 1 A 128 128 GLN CA C 128 54.948 56.189 -1.241 1
1 1534 . 1 1 1 A 128 128 GLN CB C 128 29.181 29.081 0.100 1
1 1536 . 1 1 1 A 128 128 GLN N N 128 117.842 120.286 -2.444 1
1 1538 . 1 1 1 A 129 129 ASN H H 129 8.689 9.175 -0.486 1
1 1539 . 1 1 1 A 129 129 ASN HA H 129 4.857 5.284 -0.427 1
1 1544 . 1 1 1 A 129 129 ASN C C 129 174.325 174.626 -0.301 1
1 1545 . 1 1 1 A 129 129 ASN CA C 129 52.568 53.023 -0.455 1
1 1546 . 1 1 1 A 129 129 ASN CB C 129 38.035 40.248 -2.213 1
1 1547 . 1 1 1 A 129 129 ASN N N 129 122.739 122.918 -0.179 1
1 1549 . 1 1 1 A 130 130 LEU H H 130 8.742 8.982 -0.240 1
1 1550 . 1 1 1 A 130 130 LEU HA H 130 4.918 5.035 -0.117 1
1 1560 . 1 1 1 A 130 130 LEU C C 130 176.095 175.552 0.543 1
1 1561 . 1 1 1 A 130 130 LEU CA C 130 53.691 53.020 0.671 1
1 1562 . 1 1 1 A 130 130 LEU CB C 130 46.814 44.859 1.955 1
1 1566 . 1 1 1 A 130 130 LEU N N 130 121.242 121.670 -0.428 1
1 1567 . 1 1 1 A 131 131 LYS H H 131 8.809 9.382 -0.573 1
1 1568 . 1 1 1 A 131 131 LYS HA H 131 4.918 5.277 -0.359 1
1 1577 . 1 1 1 A 131 131 LYS C C 131 175.508 175.292 0.216 1
1 1578 . 1 1 1 A 131 131 LYS CA C 131 55.333 54.788 0.545 1
1 1579 . 1 1 1 A 131 131 LYS CB C 131 33.962 34.317 -0.355 1
1 1583 . 1 1 1 A 131 131 LYS N N 131 122.071 121.509 0.562 1
1 1584 . 1 1 1 A 132 132 PHE H H 132 9.436 9.483 -0.047 1
1 1585 . 1 1 1 A 132 132 PHE HA H 132 5.427 5.579 -0.152 1
1 1593 . 1 1 1 A 132 132 PHE C C 132 175.715 174.949 0.766 1
1 1594 . 1 1 1 A 132 132 PHE CA C 132 56.665 56.803 -0.138 1
1 1595 . 1 1 1 A 132 132 PHE CB C 132 42.263 41.242 1.021 1
1 1599 . 1 1 1 A 132 132 PHE N N 132 125.247 123.134 2.113 1
1 1600 . 1 1 1 A 133 133 ASN H H 133 8.680 9.401 -0.721 1
1 1601 . 1 1 1 A 133 133 ASN HA H 133 5.249 5.012 0.237 1
1 1606 . 1 1 1 A 133 133 ASN C C 133 174.433 174.051 0.382 1
1 1607 . 1 1 1 A 133 133 ASN CA C 133 53.952 53.031 0.921 1
1 1608 . 1 1 1 A 133 133 ASN CB C 133 41.492 39.274 2.218 1
1 1609 . 1 1 1 A 133 133 ASN N N 133 122.056 121.864 0.192 1
1 1611 . 1 1 1 A 134 134 VAL H H 134 8.762 8.971 -0.209 1
1 1612 . 1 1 1 A 134 134 VAL HA H 134 4.805 4.637 0.168 1
1 1620 . 1 1 1 A 134 134 VAL C C 134 173.555 174.895 -1.340 1
1 1621 . 1 1 1 A 134 134 VAL CA C 134 60.374 61.254 -0.880 1
1 1622 . 1 1 1 A 134 134 VAL CB C 134 34.848 33.062 1.786 1
1 1625 . 1 1 1 A 134 134 VAL N N 134 122.014 125.809 -3.795 1
1 1626 . 1 1 1 A 135 135 GLU H H 135 8.869 9.026 -0.157 1
1 1627 . 1 1 1 A 135 135 GLU HA H 135 5.240 4.953 0.287 1
1 1632 . 1 1 1 A 135 135 GLU C C 135 175.578 175.084 0.494 1
1 1633 . 1 1 1 A 135 135 GLU CA C 135 54.376 55.336 -0.960 1
1 1634 . 1 1 1 A 135 135 GLU CB C 135 33.264 30.853 2.411 1
1 1636 . 1 1 1 A 135 135 GLU N N 135 125.197 126.962 -1.765 1
1 1637 . 1 1 1 A 136 136 VAL H H 136 8.270 8.439 -0.169 1
1 1638 . 1 1 1 A 136 136 VAL HA H 136 4.066 4.268 -0.202 1
1 1646 . 1 1 1 A 136 136 VAL C C 136 176.119 175.691 0.428 1
1 1647 . 1 1 1 A 136 136 VAL CA C 136 62.910 62.988 -0.078 1
1 1648 . 1 1 1 A 136 136 VAL CB C 136 30.573 32.385 -1.812 1
1 1651 . 1 1 1 A 136 136 VAL N N 136 126.347 127.564 -1.217 1
1 1652 . 1 1 1 A 137 137 VAL H H 137 8.865 8.573 0.292 1
1 1653 . 1 1 1 A 137 137 VAL HA H 137 4.022 3.958 0.064 1
1 1661 . 1 1 1 A 137 137 VAL C C 137 175.208 176.138 -0.930 1
1 1662 . 1 1 1 A 137 137 VAL CA C 137 64.424 64.489 -0.065 1
1 1663 . 1 1 1 A 137 137 VAL CB C 137 32.943 32.305 0.638 1
1 1666 . 1 1 1 A 137 137 VAL N N 137 130.810 130.719 0.091 1
1 1667 . 1 1 1 A 138 138 ALA H H 138 7.677 7.292 0.385 1
1 1668 . 1 1 1 A 138 138 ALA HA H 138 4.496 4.688 -0.192 1
1 1672 . 1 1 1 A 138 138 ALA C C 138 174.405 175.147 -0.742 1
1 1673 . 1 1 1 A 138 138 ALA CA C 138 52.556 51.704 0.852 1
1 1674 . 1 1 1 A 138 138 ALA CB C 138 21.874 22.625 -0.751 1
1 1675 . 1 1 1 A 138 138 ALA N N 138 119.194 117.651 1.543 1
1 1676 . 1 1 1 A 139 139 ILE H H 139 8.052 8.485 -0.433 1
1 1677 . 1 1 1 A 139 139 ILE HA H 139 4.640 4.855 -0.215 1
1 1687 . 1 1 1 A 139 139 ILE C C 139 173.734 174.342 -0.608 1
1 1688 . 1 1 1 A 139 139 ILE CA C 139 61.623 59.975 1.648 1
1 1689 . 1 1 1 A 139 139 ILE CB C 139 43.363 41.779 1.584 1
1 1693 . 1 1 1 A 139 139 ILE N N 139 119.307 120.248 -0.941 1
1 1694 . 1 1 1 A 140 140 ARG H H 140 8.912 8.842 0.070 1
1 1695 . 1 1 1 A 140 140 ARG HA H 140 4.760 4.906 -0.146 1
1 1702 . 1 1 1 A 140 140 ARG C C 140 174.181 174.913 -0.732 1
1 1703 . 1 1 1 A 140 140 ARG CA C 140 54.243 54.274 -0.031 1
1 1704 . 1 1 1 A 140 140 ARG CB C 140 33.438 34.186 -0.748 1
1 1707 . 1 1 1 A 140 140 ARG N N 140 122.820 127.243 -4.423 1
1 1708 . 1 1 1 A 141 141 GLU H H 141 8.545 8.427 0.118 1
1 1709 . 1 1 1 A 141 141 GLU HA H 141 4.254 4.325 -0.071 1
1 1714 . 1 1 1 A 141 141 GLU C C 141 177.299 176.040 1.259 1
1 1715 . 1 1 1 A 141 141 GLU CA C 141 57.165 56.504 0.661 1
1 1716 . 1 1 1 A 141 141 GLU CB C 141 30.048 29.833 0.215 1
1 1718 . 1 1 1 A 141 141 GLU N N 141 119.458 123.605 -4.147 1
1 1719 . 1 1 1 A 142 142 ALA H H 142 8.380 8.309 0.071 1
1 1720 . 1 1 1 A 142 142 ALA HA H 142 4.388 4.508 -0.120 1
1 1724 . 1 1 1 A 142 142 ALA C C 142 178.495 179.241 -0.746 1
1 1725 . 1 1 1 A 142 142 ALA CA C 142 51.113 52.144 -1.031 1
1 1726 . 1 1 1 A 142 142 ALA CB C 142 21.044 19.524 1.520 1
1 1727 . 1 1 1 A 142 142 ALA N N 142 127.330 127.391 -0.061 1
1 1728 . 1 1 1 A 143 143 THR H H 143 9.502 8.789 0.713 1
1 1729 . 1 1 1 A 143 143 THR HA H 143 4.362 4.678 -0.316 1
1 1734 . 1 1 1 A 143 143 THR C C 143 175.241 175.055 0.186 1
1 1735 . 1 1 1 A 143 143 THR CA C 143 60.541 61.183 -0.642 1
1 1736 . 1 1 1 A 143 143 THR CB C 143 70.879 68.496 2.383 1
1 1738 . 1 1 1 A 143 143 THR N N 143 114.561 111.373 3.188 1
1 1739 . 1 1 1 A 144 144 GLU H H 144 8.787 8.089 0.698 1
1 1740 . 1 1 1 A 144 144 GLU HA H 144 3.817 3.779 0.038 1
1 1745 . 1 1 1 A 144 144 GLU C C 144 179.490 176.757 2.733 1
1 1746 . 1 1 1 A 144 144 GLU CA C 144 60.102 58.913 1.189 1
1 1747 . 1 1 1 A 144 144 GLU CB C 144 29.338 27.368 1.970 1
1 1749 . 1 1 1 A 144 144 GLU N N 144 120.475 115.256 5.219 1
1 1750 . 1 1 1 A 145 145 GLU H H 145 8.321 8.621 -0.300 1
1 1751 . 1 1 1 A 145 145 GLU HA H 145 3.899 3.763 0.136 1
1 1756 . 1 1 1 A 145 145 GLU C C 145 178.521 179.437 -0.916 1
1 1757 . 1 1 1 A 145 145 GLU CA C 145 59.588 58.858 0.730 1
1 1758 . 1 1 1 A 145 145 GLU CB C 145 29.658 28.932 0.726 1
1 1760 . 1 1 1 A 145 145 GLU N N 145 119.761 118.912 0.849 1
1 1761 . 1 1 1 A 146 146 GLU H H 146 7.514 7.994 -0.480 1
1 1762 . 1 1 1 A 146 146 GLU HA H 146 3.856 4.093 -0.237 1
1 1767 . 1 1 1 A 146 146 GLU C C 146 179.189 179.362 -0.173 1
1 1768 . 1 1 1 A 146 146 GLU CA C 146 59.148 59.059 0.089 1
1 1769 . 1 1 1 A 146 146 GLU CB C 146 29.834 28.972 0.862 1
1 1771 . 1 1 1 A 146 146 GLU N N 146 121.118 120.499 0.619 1
1 1772 . 1 1 1 A 147 147 LEU H H 147 7.823 8.047 -0.224 1
1 1773 . 1 1 1 A 147 147 LEU HA H 147 3.662 3.977 -0.315 1
1 1783 . 1 1 1 A 147 147 LEU C C 147 179.341 178.757 0.584 1
1 1784 . 1 1 1 A 147 147 LEU CA C 147 57.277 57.697 -0.420 1
1 1785 . 1 1 1 A 147 147 LEU CB C 147 41.239 41.670 -0.431 1
1 1789 . 1 1 1 A 147 147 LEU N N 147 117.199 120.724 -3.525 1
1 1790 . 1 1 1 A 148 148 ALA H H 148 7.788 8.548 -0.760 1
1 1791 . 1 1 1 A 148 148 ALA HA H 148 3.958 4.111 -0.153 1
1 1795 . 1 1 1 A 148 148 ALA C C 148 179.777 179.369 0.408 1
1 1796 . 1 1 1 A 148 148 ALA CA C 148 54.509 54.744 -0.235 1
1 1797 . 1 1 1 A 148 148 ALA CB C 148 18.064 18.222 -0.158 1
1 1798 . 1 1 1 A 148 148 ALA N N 148 121.696 120.909 0.787 1
1 1799 . 1 1 1 A 149 149 HIS H H 149 7.726 7.410 0.316 1
1 1800 . 1 1 1 A 149 149 HIS HA H 149 4.477 4.676 -0.199 1
1 1805 . 1 1 1 A 149 149 HIS C C 149 176.099 175.831 0.268 1
1 1806 . 1 1 1 A 149 149 HIS CA C 149 55.802 56.348 -0.546 1
1 1807 . 1 1 1 A 149 149 HIS CB C 149 30.406 30.754 -0.348 1
1 1810 . 1 1 1 A 149 149 HIS N N 149 114.463 113.346 1.117 1
1 1811 . 1 1 1 A 150 150 GLY H H 150 8.076 8.965 -0.889 1
1 1812 . 1 1 1 A 150 150 GLY HA2 H 150 3.927 3.721 0.206 1
1 1813 . 1 1 1 A 150 150 GLY HA3 H 150 3.237 3.913 -0.676 1
1 1814 . 1 1 1 A 150 150 GLY C C 150 173.382 173.545 -0.163 1
1 1815 . 1 1 1 A 150 150 GLY CA C 150 46.117 45.607 0.510 1
1 1816 . 1 1 1 A 150 150 GLY N N 150 109.417 106.924 2.493 1
1 1817 . 1 1 1 A 151 151 HIS H H 151 7.518 7.409 0.109 1
1 1818 . 1 1 1 A 151 151 HIS HA H 151 4.563 4.967 -0.404 1
1 1823 . 1 1 1 A 151 151 HIS C C 151 173.157 173.460 -0.303 1
1 1824 . 1 1 1 A 151 151 HIS CA C 151 54.731 54.672 0.059 1
1 1825 . 1 1 1 A 151 151 HIS CB C 151 31.611 31.482 0.129 1
1 1828 . 1 1 1 A 151 151 HIS N N 151 114.828 114.209 0.619 1
1 1829 . 1 1 1 A 152 152 VAL H H 152 7.931 8.785 -0.854 1
1 1830 . 1 1 1 A 152 152 VAL HA H 152 3.951 4.000 -0.049 1
1 1838 . 1 1 1 A 152 152 VAL C C 152 175.848 177.098 -1.250 1
1 1839 . 1 1 1 A 152 152 VAL CA C 152 62.190 63.190 -1.000 1
1 1840 . 1 1 1 A 152 152 VAL CB C 152 32.703 32.180 0.523 1
1 1843 . 1 1 1 A 152 152 VAL N N 152 118.551 120.371 -1.820 1
1 1844 . 1 1 1 A 153 153 HIS H H 153 9.784 8.581 1.203 1
1 1845 . 1 1 1 A 153 153 HIS HA H 153 4.604 4.827 -0.223 1
1 1850 . 1 1 1 A 153 153 HIS C C 153 175.795 175.296 0.499 1
1 1851 . 1 1 1 A 153 153 HIS CA C 153 56.753 55.058 1.695 1
1 1852 . 1 1 1 A 153 153 HIS CB C 153 30.325 30.945 -0.620 1
1 1855 . 1 1 1 A 153 153 HIS N N 153 127.403 120.212 7.191 1
1 1856 . 1 1 1 A 154 154 GLY H H 154 8.447 7.278 1.169 1
1 1857 . 1 1 1 A 154 154 GLY HA2 H 154 3.797 3.667 0.130 1
1 1858 . 1 1 1 A 154 154 GLY HA3 H 154 3.797 3.884 -0.087 1
1 1859 . 1 1 1 A 154 154 GLY C C 154 173.848 174.232 -0.384 1
1 1860 . 1 1 1 A 154 154 GLY CA C 154 45.153 45.682 -0.529 1
1 1861 . 1 1 1 A 154 154 GLY N N 154 112.233 106.689 5.544 1
1 1862 . 1 1 1 A 155 155 ALA H H 155 8.074 7.995 0.079 1
1 1863 . 1 1 1 A 155 155 ALA HA H 155 4.101 4.344 -0.243 1
1 1867 . 1 1 1 A 155 155 ALA C C 155 177.651 177.093 0.558 1
1 1868 . 1 1 1 A 155 155 ALA CA C 155 52.795 52.933 -0.138 1
1 1869 . 1 1 1 A 155 155 ALA CB C 155 19.258 20.108 -0.850 1
1 1870 . 1 1 1 A 155 155 ALA N N 155 124.092 121.385 2.707 1
1 1871 . 1 1 1 A 156 156 HIS H H 156 8.201 7.776 0.425 1
1 1872 . 1 1 1 A 156 156 HIS HA H 156 4.474 4.561 -0.087 1
1 1875 . 1 1 1 A 156 156 HIS C C 156 174.758 173.834 0.924 1
1 1876 . 1 1 1 A 156 156 HIS CA C 156 55.756 56.139 -0.383 1
1 1877 . 1 1 1 A 156 156 HIS CB C 156 30.060 30.227 -0.167 1
1 1878 . 1 1 1 A 156 156 HIS N N 156 118.170 119.006 -0.836 1
1 1879 . 1 1 1 A 157 157 ASP H H 157 8.001 8.396 -0.395 1
1 1880 . 1 1 1 A 157 157 ASP HA H 157 4.436 4.519 -0.083 1
1 1883 . 1 1 1 A 157 157 ASP CA C 157 54.185 53.772 0.413 1
1 1884 . 1 1 1 A 157 157 ASP CB C 157 41.016 42.337 -1.321 1
1 1885 . 1 1 1 A 157 157 ASP N N 157 121.683 128.075 -6.392 1
1 1886 . 1 1 1 A 160 160 HIS HA H 160 4.502 4.410 0.092 1
1 1889 . 1 1 1 A 160 160 HIS C C 160 174.722 173.572 1.150 1
1 1890 . 1 1 1 A 160 160 HIS CA C 160 55.979 56.658 -0.679 1
1 1891 . 1 1 1 A 160 160 HIS CB C 160 30.058 31.868 -1.810 1
1 1892 . 1 1 1 A 161 161 ASP H H 161 8.270 8.012 0.258 1
1 1893 . 1 1 1 A 161 161 ASP HA H 161 4.446 4.377 0.069 1
1 1896 . 1 1 1 A 161 161 ASP C C 161 176.107 174.988 1.119 1
1 1897 . 1 1 1 A 161 161 ASP CA C 161 54.474 53.072 1.402 1
1 1898 . 1 1 1 A 161 161 ASP CB C 161 40.820 43.603 -2.783 1
1 1899 . 1 1 1 A 161 161 ASP N N 161 121.957 115.003 6.954 1
1 1900 . 1 1 1 A 162 162 HIS H H 162 8.212 8.455 -0.243 1
1 1901 . 1 1 1 A 162 162 HIS HA H 162 4.289 4.834 -0.545 1
1 1904 . 1 1 1 A 162 162 HIS C C 162 175.036 175.614 -0.578 1
1 1905 . 1 1 1 A 162 162 HIS CA C 162 56.185 57.394 -1.209 1
1 1906 . 1 1 1 A 162 162 HIS CB C 162 30.108 31.667 -1.559 1
1 1907 . 1 1 1 A 162 162 HIS N N 162 119.766 117.447 2.319 1
1 1908 . 1 1 1 A 163 163 ASP H H 163 8.163 7.778 0.385 1
1 1909 . 1 1 1 A 163 163 ASP HA H 163 4.428 4.708 -0.280 1
1 1912 . 1 1 1 A 163 163 ASP C C 163 176.161 175.109 1.052 1
1 1913 . 1 1 1 A 163 163 ASP CA C 163 54.585 53.597 0.988 1
1 1914 . 1 1 1 A 163 163 ASP CB C 163 40.823 39.719 1.104 1
1 1915 . 1 1 1 A 163 163 ASP N N 163 121.265 116.785 4.480 1
1 1916 . 1 1 1 A 164 164 HIS H H 164 8.106 7.747 0.359 1
1 1917 . 1 1 1 A 164 164 HIS HA H 164 4.422 4.646 -0.224 1
1 1920 . 1 1 1 A 164 164 HIS C C 164 174.904 173.927 0.977 1
1 1921 . 1 1 1 A 164 164 HIS CA C 164 56.361 55.612 0.749 1
1 1922 . 1 1 1 A 164 164 HIS CB C 164 30.305 30.429 -0.124 1
1 1923 . 1 1 1 A 164 164 HIS N N 164 119.729 116.987 2.742 1
1 1924 . 1 1 1 A 165 165 ASP H H 165 8.118 8.859 -0.741 1
1 1925 . 1 1 1 A 165 165 ASP HA H 165 4.394 5.217 -0.823 1
1 1928 . 1 1 1 A 165 165 ASP C C 165 176.054 174.791 1.263 1
1 1929 . 1 1 1 A 165 165 ASP CA C 165 54.364 53.272 1.092 1
1 1930 . 1 1 1 A 165 165 ASP CB C 165 40.818 44.774 -3.956 1
1 1931 . 1 1 1 A 165 165 ASP N N 165 121.062 123.270 -2.208 1
1 1932 . 1 1 1 A 166 166 HIS H H 166 8.092 8.748 -0.656 1
1 1933 . 1 1 1 A 166 166 HIS CA C 166 56.114 55.146 0.968 1
1 1934 . 1 1 1 A 166 166 HIS CB C 166 29.702 30.686 -0.984 1
1 1935 . 1 1 1 A 166 166 HIS N N 166 120.001 119.445 0.556 1
1 1936 . 1 1 1 A 170 170 HIS HA H 170 4.514 4.588 -0.074 1
1 1939 . 1 1 1 A 170 170 HIS C C 170 173.952 174.339 -0.387 1
1 1940 . 1 1 1 A 170 170 HIS CA C 170 55.995 55.402 0.593 1
1 1941 . 1 1 1 A 170 170 HIS CB C 170 30.161 31.010 -0.849 1
1 14 . 2 1 1 A 2 2 LYS H H 2 7.540 8.798 -1.258 1
1 15 . 2 1 1 A 2 2 LYS HA H 2 4.729 4.986 -0.257 1
1 24 . 2 1 1 A 2 2 LYS C C 2 175.948 175.511 0.437 1
1 25 . 2 1 1 A 2 2 LYS CA C 2 53.978 54.595 -0.617 1
1 26 . 2 1 1 A 2 2 LYS CB C 2 35.985 34.795 1.190 1
1 30 . 2 1 1 A 2 2 LYS N N 2 120.764 120.760 0.004 1
1 31 . 2 1 1 A 3 3 VAL H H 3 8.738 8.484 0.254 1
1 32 . 2 1 1 A 3 3 VAL HA H 3 2.800 4.455 -1.655 1
1 40 . 2 1 1 A 3 3 VAL C C 3 175.018 175.181 -0.163 1
1 41 . 2 1 1 A 3 3 VAL CA C 3 66.598 61.844 4.754 1
1 42 . 2 1 1 A 3 3 VAL CB C 3 31.218 32.347 -1.129 1
1 45 . 2 1 1 A 3 3 VAL N N 3 120.055 121.863 -1.808 1
1 46 . 2 1 1 A 4 4 ALA H H 4 6.584 8.799 -2.215 1
1 47 . 2 1 1 A 4 4 ALA HA H 4 4.223 4.690 -0.467 1
1 51 . 2 1 1 A 4 4 ALA C C 4 174.117 175.555 -1.438 1
1 52 . 2 1 1 A 4 4 ALA CA C 4 50.358 50.908 -0.550 1
1 53 . 2 1 1 A 4 4 ALA CB C 4 22.137 23.149 -1.012 1
1 54 . 2 1 1 A 4 4 ALA N N 4 129.800 130.303 -0.503 1
1 55 . 2 1 1 A 5 5 LYS H H 5 8.596 8.546 0.050 1
1 56 . 2 1 1 A 5 5 LYS HA H 5 3.793 4.144 -0.351 1
1 65 . 2 1 1 A 5 5 LYS C C 5 175.260 177.048 -1.788 1
1 66 . 2 1 1 A 5 5 LYS CA C 5 57.700 57.554 0.146 1
1 67 . 2 1 1 A 5 5 LYS CB C 5 32.400 32.595 -0.195 1
1 71 . 2 1 1 A 5 5 LYS N N 5 118.708 120.101 -1.393 1
1 72 . 2 1 1 A 6 6 ASP H H 6 8.679 9.026 -0.347 1
1 73 . 2 1 1 A 6 6 ASP HA H 6 4.040 4.403 -0.363 1
1 76 . 2 1 1 A 6 6 ASP C C 6 173.331 175.458 -2.127 1
1 77 . 2 1 1 A 6 6 ASP CA C 6 57.508 55.838 1.670 1
1 78 . 2 1 1 A 6 6 ASP CB C 6 37.604 39.500 -1.896 1
1 79 . 2 1 1 A 6 6 ASP N N 6 115.415 121.006 -5.591 1
1 80 . 2 1 1 A 7 7 LEU H H 7 7.376 7.721 -0.345 1
1 81 . 2 1 1 A 7 7 LEU HA H 7 4.689 4.399 0.290 1
1 91 . 2 1 1 A 7 7 LEU C C 7 175.906 175.829 0.077 1
1 92 . 2 1 1 A 7 7 LEU CA C 7 53.509 53.916 -0.407 1
1 93 . 2 1 1 A 7 7 LEU CB C 7 42.419 41.412 1.007 1
1 97 . 2 1 1 A 7 7 LEU N N 7 117.619 121.134 -3.515 1
1 98 . 2 1 1 A 8 8 VAL H H 8 8.646 8.618 0.028 1
1 99 . 2 1 1 A 8 8 VAL HA H 8 4.397 4.204 0.193 1
1 107 . 2 1 1 A 8 8 VAL C C 8 175.244 175.179 0.065 1
1 108 . 2 1 1 A 8 8 VAL CA C 8 62.028 62.995 -0.967 1
1 109 . 2 1 1 A 8 8 VAL CB C 8 31.515 32.328 -0.813 1
1 112 . 2 1 1 A 8 8 VAL N N 8 121.164 127.077 -5.913 1
1 113 . 2 1 1 A 9 9 VAL H H 9 8.607 8.612 -0.005 1
1 114 . 2 1 1 A 9 9 VAL HA H 9 4.281 5.007 -0.726 1
1 122 . 2 1 1 A 9 9 VAL C C 9 174.156 174.080 0.076 1
1 123 . 2 1 1 A 9 9 VAL CA C 9 60.614 58.895 1.719 1
1 124 . 2 1 1 A 9 9 VAL CB C 9 33.985 35.987 -2.002 1
1 127 . 2 1 1 A 9 9 VAL N N 9 134.014 122.649 11.365 1
1 128 . 2 1 1 A 10 10 SER H H 10 8.684 8.716 -0.032 1
1 129 . 2 1 1 A 10 10 SER HA H 10 5.736 5.545 0.191 1
1 132 . 2 1 1 A 10 10 SER C C 10 173.544 173.683 -0.139 1
1 133 . 2 1 1 A 10 10 SER CA C 10 56.533 57.838 -1.305 1
1 134 . 2 1 1 A 10 10 SER CB C 10 63.385 64.155 -0.770 1
1 135 . 2 1 1 A 10 10 SER N N 10 121.492 119.358 2.134 1
1 136 . 2 1 1 A 11 11 LEU H H 11 9.939 9.136 0.803 1
1 137 . 2 1 1 A 11 11 LEU HA H 11 5.133 5.118 0.015 1
1 147 . 2 1 1 A 11 11 LEU C C 11 174.843 175.205 -0.362 1
1 148 . 2 1 1 A 11 11 LEU CA C 11 53.770 53.453 0.317 1
1 149 . 2 1 1 A 11 11 LEU CB C 11 47.469 46.190 1.279 1
1 153 . 2 1 1 A 11 11 LEU N N 11 128.460 122.494 5.966 1
1 154 . 2 1 1 A 12 12 ALA H H 12 8.770 9.299 -0.529 1
1 155 . 2 1 1 A 12 12 ALA HA H 12 4.830 5.306 -0.476 1
1 159 . 2 1 1 A 12 12 ALA C C 12 176.974 176.268 0.706 1
1 160 . 2 1 1 A 12 12 ALA CA C 12 50.231 50.622 -0.391 1
1 161 . 2 1 1 A 12 12 ALA CB C 12 21.270 21.928 -0.658 1
1 162 . 2 1 1 A 12 12 ALA N N 12 127.500 122.959 4.541 1
1 163 . 2 1 1 A 13 13 TYR H H 13 8.749 8.167 0.582 1
1 164 . 2 1 1 A 13 13 TYR HA H 13 5.797 5.720 0.077 1
1 171 . 2 1 1 A 13 13 TYR C C 13 173.952 172.528 1.424 1
1 172 . 2 1 1 A 13 13 TYR CA C 13 56.390 55.871 0.519 1
1 173 . 2 1 1 A 13 13 TYR CB C 13 41.159 41.570 -0.411 1
1 176 . 2 1 1 A 13 13 TYR N N 13 117.737 116.486 1.251 1
1 177 . 2 1 1 A 14 14 GLN H H 14 8.492 8.789 -0.297 1
1 178 . 2 1 1 A 14 14 GLN HA H 14 4.611 5.147 -0.536 1
1 185 . 2 1 1 A 14 14 GLN C C 14 174.492 174.410 0.082 1
1 186 . 2 1 1 A 14 14 GLN CA C 14 55.626 54.546 1.080 1
1 187 . 2 1 1 A 14 14 GLN CB C 14 32.734 31.942 0.792 1
1 189 . 2 1 1 A 14 14 GLN N N 14 116.962 120.427 -3.465 1
1 191 . 2 1 1 A 15 15 VAL H H 15 8.403 9.605 -1.202 1
1 192 . 2 1 1 A 15 15 VAL HA H 15 4.614 5.061 -0.447 1
1 200 . 2 1 1 A 15 15 VAL C C 15 173.389 175.359 -1.970 1
1 201 . 2 1 1 A 15 15 VAL CA C 15 59.711 61.971 -2.260 1
1 202 . 2 1 1 A 15 15 VAL CB C 15 33.639 32.783 0.856 1
1 205 . 2 1 1 A 15 15 VAL N N 15 121.203 127.555 -6.352 1
1 206 . 2 1 1 A 16 16 ARG H H 16 8.584 9.538 -0.954 1
1 207 . 2 1 1 A 16 16 ARG HA H 16 5.584 5.243 0.341 1
1 214 . 2 1 1 A 16 16 ARG C C 16 176.585 175.345 1.240 1
1 215 . 2 1 1 A 16 16 ARG CA C 16 53.453 54.354 -0.901 1
1 216 . 2 1 1 A 16 16 ARG CB C 16 34.968 33.772 1.196 1
1 219 . 2 1 1 A 16 16 ARG N N 16 126.883 124.577 2.306 1
1 220 . 2 1 1 A 17 17 THR H H 17 8.270 8.496 -0.226 1
1 221 . 2 1 1 A 17 17 THR HA H 17 4.573 4.604 -0.031 1
1 226 . 2 1 1 A 17 17 THR C C 17 177.860 176.124 1.736 1
1 227 . 2 1 1 A 17 17 THR CA C 17 61.073 60.864 0.209 1
1 228 . 2 1 1 A 17 17 THR CB C 17 69.823 71.509 -1.686 1
1 230 . 2 1 1 A 17 17 THR N N 17 109.730 113.147 -3.417 1
1 231 . 2 1 1 A 18 18 GLU H H 18 9.147 8.926 0.221 1
1 232 . 2 1 1 A 18 18 GLU HA H 18 3.770 4.014 -0.244 1
1 237 . 2 1 1 A 18 18 GLU C C 18 176.683 178.084 -1.401 1
1 238 . 2 1 1 A 18 18 GLU CA C 18 59.866 59.823 0.043 1
1 239 . 2 1 1 A 18 18 GLU CB C 18 29.752 29.164 0.588 1
1 241 . 2 1 1 A 18 18 GLU N N 18 122.491 121.072 1.419 1
1 242 . 2 1 1 A 19 19 ASP H H 19 7.900 8.038 -0.138 1
1 243 . 2 1 1 A 19 19 ASP HA H 19 4.456 4.549 -0.093 1
1 246 . 2 1 1 A 19 19 ASP C C 19 176.670 176.541 0.129 1
1 247 . 2 1 1 A 19 19 ASP CA C 19 53.833 54.273 -0.440 1
1 248 . 2 1 1 A 19 19 ASP CB C 19 40.180 40.902 -0.722 1
1 249 . 2 1 1 A 19 19 ASP N N 19 116.200 117.305 -1.105 1
1 250 . 2 1 1 A 20 20 GLY H H 20 8.149 8.367 -0.218 1
1 251 . 2 1 1 A 20 20 GLY HA2 H 20 4.145 3.975 0.170 1
1 252 . 2 1 1 A 20 20 GLY HA3 H 20 3.531 3.981 -0.450 1
1 253 . 2 1 1 A 20 20 GLY C C 20 173.987 174.087 -0.100 1
1 254 . 2 1 1 A 20 20 GLY CA C 20 45.463 45.219 0.244 1
1 255 . 2 1 1 A 20 20 GLY N N 20 108.869 106.761 2.108 1
1 256 . 2 1 1 A 21 21 VAL H H 21 7.261 7.892 -0.631 1
1 257 . 2 1 1 A 21 21 VAL HA H 21 3.645 4.204 -0.559 1
1 265 . 2 1 1 A 21 21 VAL C C 21 175.265 174.850 0.415 1
1 266 . 2 1 1 A 21 21 VAL CA C 21 63.368 61.978 1.390 1
1 267 . 2 1 1 A 21 21 VAL CB C 21 31.614 32.517 -0.903 1
1 270 . 2 1 1 A 21 21 VAL N N 21 124.283 122.255 2.028 1
1 271 . 2 1 1 A 22 22 LEU H H 22 8.407 8.283 0.124 1
1 272 . 2 1 1 A 22 22 LEU HA H 22 4.333 4.425 -0.092 1
1 282 . 2 1 1 A 22 22 LEU C C 22 176.660 176.658 0.002 1
1 283 . 2 1 1 A 22 22 LEU CA C 22 55.724 56.333 -0.609 1
1 284 . 2 1 1 A 22 22 LEU CB C 22 42.272 42.269 0.003 1
1 288 . 2 1 1 A 22 22 LEU N N 22 128.533 128.625 -0.092 1
1 289 . 2 1 1 A 23 23 VAL H H 23 8.887 9.352 -0.465 1
1 290 . 2 1 1 A 23 23 VAL HA H 23 4.237 4.407 -0.170 1
1 298 . 2 1 1 A 23 23 VAL C C 23 175.265 175.596 -0.331 1
1 299 . 2 1 1 A 23 23 VAL CA C 23 62.348 62.256 0.092 1
1 300 . 2 1 1 A 23 23 VAL CB C 23 33.383 33.270 0.113 1
1 303 . 2 1 1 A 23 23 VAL N N 23 125.041 121.397 3.644 1
1 304 . 2 1 1 A 24 24 ASP H H 24 7.480 7.770 -0.290 1
1 305 . 2 1 1 A 24 24 ASP HA H 24 4.763 5.095 -0.332 1
1 308 . 2 1 1 A 24 24 ASP C C 24 173.160 173.970 -0.810 1
1 309 . 2 1 1 A 24 24 ASP CA C 24 53.893 53.217 0.676 1
1 310 . 2 1 1 A 24 24 ASP CB C 24 43.680 44.647 -0.967 1
1 311 . 2 1 1 A 24 24 ASP N N 24 117.159 120.375 -3.216 1
1 312 . 2 1 1 A 25 25 GLU H H 25 8.187 8.686 -0.499 1
1 313 . 2 1 1 A 25 25 GLU HA H 25 4.491 4.800 -0.309 1
1 318 . 2 1 1 A 25 25 GLU C C 25 174.586 173.950 0.636 1
1 319 . 2 1 1 A 25 25 GLU CA C 25 55.475 55.813 -0.338 1
1 320 . 2 1 1 A 25 25 GLU CB C 25 33.033 34.073 -1.040 1
1 322 . 2 1 1 A 25 25 GLU N N 25 118.821 123.881 -5.060 1
1 323 . 2 1 1 A 26 26 SER H H 26 8.003 8.505 -0.502 1
1 324 . 2 1 1 A 26 26 SER HA H 26 4.782 4.754 0.028 1
1 327 . 2 1 1 A 26 26 SER CA C 26 56.490 55.134 1.356 1
1 328 . 2 1 1 A 26 26 SER CB C 26 64.977 63.708 1.269 1
1 329 . 2 1 1 A 26 26 SER N N 26 119.346 123.213 -3.867 1
1 330 . 2 1 1 A 27 27 PRO HA H 27 4.633 4.595 0.038 1
1 337 . 2 1 1 A 27 27 PRO C C 27 177.016 177.223 -0.207 1
1 338 . 2 1 1 A 27 27 PRO CA C 27 61.943 62.580 -0.637 1
1 339 . 2 1 1 A 27 27 PRO CB C 27 32.492 32.809 -0.317 1
1 342 . 2 1 1 A 28 28 VAL H H 28 8.383 8.634 -0.251 1
1 343 . 2 1 1 A 28 28 VAL HA H 28 3.385 3.795 -0.410 1
1 351 . 2 1 1 A 28 28 VAL C C 28 176.069 176.976 -0.907 1
1 352 . 2 1 1 A 28 28 VAL CA C 28 65.888 65.029 0.859 1
1 353 . 2 1 1 A 28 28 VAL CB C 28 31.220 31.693 -0.473 1
1 356 . 2 1 1 A 28 28 VAL N N 28 119.349 122.531 -3.182 1
1 357 . 2 1 1 A 29 29 SER H H 29 7.365 7.798 -0.433 1
1 358 . 2 1 1 A 29 29 SER HA H 29 4.101 4.416 -0.315 1
1 361 . 2 1 1 A 29 29 SER C C 29 174.535 174.635 -0.100 1
1 362 . 2 1 1 A 29 29 SER CA C 29 58.609 59.984 -1.375 1
1 363 . 2 1 1 A 29 29 SER CB C 29 63.198 63.644 -0.446 1
1 364 . 2 1 1 A 29 29 SER N N 29 109.365 114.188 -4.823 1
1 365 . 2 1 1 A 30 30 ALA H H 30 7.457 7.729 -0.272 1
1 366 . 2 1 1 A 30 30 ALA HA H 30 4.548 4.572 -0.024 1
1 370 . 2 1 1 A 30 30 ALA CA C 30 50.789 49.320 1.469 1
1 371 . 2 1 1 A 30 30 ALA CB C 30 18.608 21.151 -2.543 1
1 372 . 2 1 1 A 30 30 ALA N N 30 126.056 122.409 3.647 1
1 373 . 2 1 1 A 31 31 PRO HA H 31 4.332 4.620 -0.288 1
1 380 . 2 1 1 A 31 31 PRO C C 31 175.841 175.992 -0.151 1
1 381 . 2 1 1 A 31 31 PRO CA C 31 62.996 62.423 0.573 1
1 382 . 2 1 1 A 31 31 PRO CB C 31 32.696 32.700 -0.004 1
1 385 . 2 1 1 A 32 32 LEU H H 32 8.717 8.818 -0.101 1
1 386 . 2 1 1 A 32 32 LEU HA H 32 4.452 4.910 -0.458 1
1 396 . 2 1 1 A 32 32 LEU C C 32 175.298 174.394 0.904 1
1 397 . 2 1 1 A 32 32 LEU CA C 32 54.510 54.354 0.156 1
1 398 . 2 1 1 A 32 32 LEU CB C 32 43.899 44.142 -0.243 1
1 402 . 2 1 1 A 32 32 LEU N N 32 123.702 122.225 1.477 1
1 403 . 2 1 1 A 33 33 ASP H H 33 8.258 8.861 -0.603 1
1 404 . 2 1 1 A 33 33 ASP HA H 33 5.919 5.624 0.295 1
1 407 . 2 1 1 A 33 33 ASP C C 33 175.927 174.868 1.059 1
1 408 . 2 1 1 A 33 33 ASP CA C 33 52.619 52.827 -0.208 1
1 409 . 2 1 1 A 33 33 ASP CB C 33 42.205 43.378 -1.173 1
1 410 . 2 1 1 A 33 33 ASP N N 33 128.453 126.001 2.452 1
1 411 . 2 1 1 A 34 34 TYR H H 34 9.144 8.816 0.328 1
1 412 . 2 1 1 A 34 34 TYR HA H 34 4.689 5.054 -0.365 1
1 419 . 2 1 1 A 34 34 TYR C C 34 170.622 174.031 -3.409 1
1 420 . 2 1 1 A 34 34 TYR CA C 34 55.930 56.768 -0.838 1
1 421 . 2 1 1 A 34 34 TYR CB C 34 41.905 42.762 -0.857 1
1 424 . 2 1 1 A 34 34 TYR N N 34 121.657 120.136 1.521 1
1 425 . 2 1 1 A 35 35 LEU H H 35 8.324 8.336 -0.012 1
1 426 . 2 1 1 A 35 35 LEU HA H 35 4.396 4.818 -0.422 1
1 436 . 2 1 1 A 35 35 LEU C C 35 175.301 176.211 -0.910 1
1 437 . 2 1 1 A 35 35 LEU CA C 35 52.909 53.940 -1.031 1
1 438 . 2 1 1 A 35 35 LEU CB C 35 42.816 43.375 -0.559 1
1 442 . 2 1 1 A 35 35 LEU N N 35 124.514 123.880 0.634 1
1 443 . 2 1 1 A 36 36 HIS H H 36 8.763 8.698 0.065 1
1 444 . 2 1 1 A 36 36 HIS HA H 36 4.382 4.362 0.020 1
1 449 . 2 1 1 A 36 36 HIS C C 36 176.514 176.428 0.086 1
1 450 . 2 1 1 A 36 36 HIS CA C 36 59.570 57.865 1.705 1
1 451 . 2 1 1 A 36 36 HIS CB C 36 31.257 29.633 1.624 1
1 454 . 2 1 1 A 36 36 HIS N N 36 132.209 126.416 5.793 1
1 455 . 2 1 1 A 37 37 GLY H H 37 8.745 8.685 0.060 1
1 456 . 2 1 1 A 37 37 GLY HA2 H 37 4.021 3.778 0.243 1
1 457 . 2 1 1 A 37 37 GLY HA3 H 37 3.592 3.953 -0.361 1
1 458 . 2 1 1 A 37 37 GLY C C 37 175.081 174.670 0.411 1
1 459 . 2 1 1 A 37 37 GLY CA C 37 45.621 45.827 -0.206 1
1 460 . 2 1 1 A 37 37 GLY N N 37 117.737 114.505 3.232 1
1 461 . 2 1 1 A 38 38 HIS H H 38 8.470 8.247 0.223 1
1 462 . 2 1 1 A 38 38 HIS HA H 38 4.584 4.728 -0.144 1
1 467 . 2 1 1 A 38 38 HIS C C 38 175.334 175.030 0.304 1
1 468 . 2 1 1 A 38 38 HIS CA C 38 55.899 55.970 -0.071 1
1 469 . 2 1 1 A 38 38 HIS CB C 38 30.865 30.828 0.037 1
1 472 . 2 1 1 A 38 38 HIS N N 38 119.813 117.746 2.067 1
1 473 . 2 1 1 A 39 39 GLY H H 39 8.936 7.847 1.089 1
1 474 . 2 1 1 A 39 39 GLY HA2 H 39 3.895 3.760 0.135 1
1 475 . 2 1 1 A 39 39 GLY HA3 H 39 3.895 3.805 0.090 1
1 476 . 2 1 1 A 39 39 GLY C C 39 175.557 174.971 0.586 1
1 477 . 2 1 1 A 39 39 GLY CA C 39 46.938 46.750 0.188 1
1 478 . 2 1 1 A 39 39 GLY N N 39 112.442 108.918 3.524 1
1 479 . 2 1 1 A 40 40 SER H H 40 9.249 8.189 1.060 1
1 480 . 2 1 1 A 40 40 SER HA H 40 4.299 4.074 0.225 1
1 483 . 2 1 1 A 40 40 SER C C 40 174.138 175.410 -1.272 1
1 484 . 2 1 1 A 40 40 SER CA C 40 60.809 62.283 -1.474 1
1 485 . 2 1 1 A 40 40 SER CB C 40 64.041 63.181 0.860 1
1 486 . 2 1 1 A 40 40 SER N N 40 117.098 114.624 2.474 1
1 487 . 2 1 1 A 41 41 LEU H H 41 7.386 7.179 0.207 1
1 488 . 2 1 1 A 41 41 LEU HA H 41 4.429 4.302 0.127 1
1 498 . 2 1 1 A 41 41 LEU C C 41 176.526 176.286 0.240 1
1 499 . 2 1 1 A 41 41 LEU CA C 41 52.295 54.930 -2.635 1
1 500 . 2 1 1 A 41 41 LEU CB C 41 44.147 42.488 1.659 1
1 504 . 2 1 1 A 41 41 LEU N N 41 120.541 113.028 7.513 1
1 505 . 2 1 1 A 42 42 ILE H H 42 7.407 7.602 -0.195 1
1 506 . 2 1 1 A 42 42 ILE HA H 42 3.756 4.340 -0.584 1
1 516 . 2 1 1 A 42 42 ILE C C 42 178.081 176.184 1.897 1
1 517 . 2 1 1 A 42 42 ILE CA C 42 62.257 58.693 3.564 1
1 518 . 2 1 1 A 42 42 ILE CB C 42 38.256 40.296 -2.040 1
1 522 . 2 1 1 A 42 42 ILE N N 42 115.050 118.210 -3.160 1
1 523 . 2 1 1 A 43 43 SER H H 43 8.581 8.715 -0.134 1
1 524 . 2 1 1 A 43 43 SER HA H 43 3.957 4.297 -0.340 1
1 527 . 2 1 1 A 43 43 SER C C 43 177.830 176.587 1.243 1
1 528 . 2 1 1 A 43 43 SER CA C 43 61.958 60.723 1.235 1
1 529 . 2 1 1 A 43 43 SER CB C 43 62.680 63.879 -1.199 1
1 530 . 2 1 1 A 43 43 SER N N 43 121.456 116.327 5.129 1
1 531 . 2 1 1 A 44 44 GLY H H 44 8.892 8.788 0.104 1
1 532 . 2 1 1 A 44 44 GLY HA2 H 44 3.514 3.782 -0.268 1
1 533 . 2 1 1 A 44 44 GLY HA3 H 44 3.854 3.796 0.058 1
1 534 . 2 1 1 A 44 44 GLY C C 44 175.296 175.509 -0.213 1
1 535 . 2 1 1 A 44 44 GLY CA C 44 46.854 47.041 -0.187 1
1 536 . 2 1 1 A 44 44 GLY N N 44 106.351 108.609 -2.258 1
1 537 . 2 1 1 A 45 45 LEU H H 45 6.824 8.014 -1.190 1
1 538 . 2 1 1 A 45 45 LEU HA H 45 3.909 4.202 -0.293 1
1 548 . 2 1 1 A 45 45 LEU C C 45 176.738 178.533 -1.795 1
1 549 . 2 1 1 A 45 45 LEU CA C 45 56.356 57.086 -0.730 1
1 550 . 2 1 1 A 45 45 LEU CB C 45 42.296 41.394 0.902 1
1 554 . 2 1 1 A 45 45 LEU N N 45 119.207 123.022 -3.815 1
1 555 . 2 1 1 A 46 46 GLU H H 46 7.556 8.234 -0.678 1
1 556 . 2 1 1 A 46 46 GLU HA H 46 3.664 4.106 -0.442 1
1 561 . 2 1 1 A 46 46 GLU C C 46 179.231 179.506 -0.275 1
1 562 . 2 1 1 A 46 46 GLU CA C 46 62.316 59.682 2.634 1
1 563 . 2 1 1 A 46 46 GLU CB C 46 29.147 29.020 0.127 1
1 565 . 2 1 1 A 46 46 GLU N N 46 119.049 118.850 0.199 1
1 566 . 2 1 1 A 47 47 THR H H 47 8.219 7.692 0.527 1
1 567 . 2 1 1 A 47 47 THR HA H 47 3.965 3.925 0.040 1
1 572 . 2 1 1 A 47 47 THR C C 47 176.251 176.132 0.119 1
1 573 . 2 1 1 A 47 47 THR CA C 47 65.947 66.227 -0.280 1
1 574 . 2 1 1 A 47 47 THR CB C 47 69.014 68.388 0.626 1
1 576 . 2 1 1 A 47 47 THR N N 47 111.770 117.592 -5.822 1
1 577 . 2 1 1 A 48 48 ALA H H 48 6.794 8.111 -1.317 1
1 578 . 2 1 1 A 48 48 ALA HA H 48 4.171 4.200 -0.029 1
1 582 . 2 1 1 A 48 48 ALA C C 48 178.639 180.009 -1.370 1
1 583 . 2 1 1 A 48 48 ALA CA C 48 54.072 55.046 -0.974 1
1 584 . 2 1 1 A 48 48 ALA CB C 48 19.752 18.391 1.361 1
1 585 . 2 1 1 A 48 48 ALA N N 48 122.697 123.779 -1.082 1
1 586 . 2 1 1 A 49 49 LEU H H 49 7.691 9.040 -1.349 1
1 587 . 2 1 1 A 49 49 LEU HA H 49 3.902 4.452 -0.550 1
1 597 . 2 1 1 A 49 49 LEU C C 49 176.823 177.736 -0.913 1
1 598 . 2 1 1 A 49 49 LEU CA C 49 57.190 58.170 -0.980 1
1 599 . 2 1 1 A 49 49 LEU CB C 49 43.628 41.497 2.131 1
1 603 . 2 1 1 A 49 49 LEU N N 49 117.159 118.103 -0.944 1
1 604 . 2 1 1 A 50 50 GLU H H 50 6.963 7.596 -0.633 1
1 605 . 2 1 1 A 50 50 GLU HA H 50 3.220 4.046 -0.826 1
1 610 . 2 1 1 A 50 50 GLU C C 50 176.691 177.255 -0.564 1
1 611 . 2 1 1 A 50 50 GLU CA C 50 58.769 58.434 0.335 1
1 612 . 2 1 1 A 50 50 GLU CB C 50 29.792 29.799 -0.007 1
1 614 . 2 1 1 A 50 50 GLU N N 50 118.761 119.508 -0.747 1
1 615 . 2 1 1 A 51 51 GLY H H 51 8.541 8.146 0.395 1
1 616 . 2 1 1 A 51 51 GLY HA2 H 51 4.140 3.812 0.328 1
1 617 . 2 1 1 A 51 51 GLY HA3 H 51 3.488 3.896 -0.408 1
1 618 . 2 1 1 A 51 51 GLY C C 51 173.801 173.552 0.249 1
1 619 . 2 1 1 A 51 51 GLY CA C 51 45.498 45.285 0.213 1
1 620 . 2 1 1 A 51 51 GLY N N 51 113.511 111.654 1.857 1
1 621 . 2 1 1 A 52 52 HIS H H 52 7.656 7.231 0.425 1
1 622 . 2 1 1 A 52 52 HIS HA H 52 4.318 5.224 -0.906 1
1 627 . 2 1 1 A 52 52 HIS C C 52 172.815 173.615 -0.800 1
1 628 . 2 1 1 A 52 52 HIS CA C 52 57.562 53.785 3.777 1
1 629 . 2 1 1 A 52 52 HIS CB C 52 28.670 32.952 -4.282 1
1 632 . 2 1 1 A 52 52 HIS N N 52 116.844 115.824 1.020 1
1 633 . 2 1 1 A 53 53 GLU H H 53 8.331 8.694 -0.363 1
1 634 . 2 1 1 A 53 53 GLU HA H 53 4.636 4.734 -0.098 1
1 639 . 2 1 1 A 53 53 GLU C C 53 176.145 175.775 0.370 1
1 640 . 2 1 1 A 53 53 GLU CA C 53 54.891 54.827 0.064 1
1 641 . 2 1 1 A 53 53 GLU CB C 53 33.837 32.016 1.821 1
1 643 . 2 1 1 A 53 53 GLU N N 53 118.873 120.108 -1.235 1
1 644 . 2 1 1 A 54 54 VAL H H 54 8.585 8.431 0.154 1
1 645 . 2 1 1 A 54 54 VAL HA H 54 3.227 3.911 -0.684 1
1 653 . 2 1 1 A 54 54 VAL C C 54 177.218 176.665 0.553 1
1 654 . 2 1 1 A 54 54 VAL CA C 54 65.848 63.642 2.206 1
1 655 . 2 1 1 A 54 54 VAL CB C 54 31.189 31.377 -0.188 1
1 658 . 2 1 1 A 54 54 VAL N N 54 120.580 120.836 -0.256 1
1 659 . 2 1 1 A 55 55 GLY H H 55 8.912 9.403 -0.491 1
1 660 . 2 1 1 A 55 55 GLY HA2 H 55 4.441 4.009 0.432 1
1 661 . 2 1 1 A 55 55 GLY HA3 H 55 3.865 4.012 -0.147 1
1 662 . 2 1 1 A 55 55 GLY C C 55 174.827 173.906 0.921 1
1 663 . 2 1 1 A 55 55 GLY CA C 55 44.370 44.920 -0.550 1
1 664 . 2 1 1 A 55 55 GLY N N 55 118.078 115.172 2.906 1
1 665 . 2 1 1 A 56 56 ASP H H 56 8.098 7.772 0.326 1
1 666 . 2 1 1 A 56 56 ASP HA H 56 4.547 4.738 -0.191 1
1 669 . 2 1 1 A 56 56 ASP C C 56 174.859 175.345 -0.486 1
1 670 . 2 1 1 A 56 56 ASP CA C 56 55.629 53.996 1.633 1
1 671 . 2 1 1 A 56 56 ASP CB C 56 40.906 41.060 -0.154 1
1 672 . 2 1 1 A 56 56 ASP N N 56 123.094 121.538 1.556 1
1 673 . 2 1 1 A 57 57 LYS H H 57 8.168 8.767 -0.599 1
1 674 . 2 1 1 A 57 57 LYS HA H 57 5.471 6.094 -0.623 1
1 683 . 2 1 1 A 57 57 LYS C C 57 175.732 175.112 0.620 1
1 684 . 2 1 1 A 57 57 LYS CA C 57 55.056 55.104 -0.048 1
1 685 . 2 1 1 A 57 57 LYS CB C 57 35.302 36.038 -0.736 1
1 689 . 2 1 1 A 57 57 LYS N N 57 122.301 126.715 -4.414 1
1 690 . 2 1 1 A 58 58 PHE H H 58 8.355 8.455 -0.100 1
1 691 . 2 1 1 A 58 58 PHE HA H 58 4.858 5.044 -0.186 1
1 699 . 2 1 1 A 58 58 PHE C C 58 171.549 171.692 -0.143 1
1 700 . 2 1 1 A 58 58 PHE CA C 58 56.195 56.374 -0.179 1
1 701 . 2 1 1 A 58 58 PHE CB C 58 39.335 40.440 -1.105 1
1 705 . 2 1 1 A 58 58 PHE N N 58 121.026 121.066 -0.040 1
1 706 . 2 1 1 A 59 59 ASP H H 59 8.407 8.902 -0.495 1
1 707 . 2 1 1 A 59 59 ASP HA H 59 5.743 5.219 0.524 1
1 710 . 2 1 1 A 59 59 ASP C C 59 176.302 175.317 0.985 1
1 711 . 2 1 1 A 59 59 ASP CA C 59 52.579 53.557 -0.978 1
1 712 . 2 1 1 A 59 59 ASP CB C 59 43.628 42.271 1.357 1
1 713 . 2 1 1 A 59 59 ASP N N 59 119.234 120.928 -1.694 1
1 714 . 2 1 1 A 60 60 VAL H H 60 8.915 8.847 0.068 1
1 715 . 2 1 1 A 60 60 VAL HA H 60 4.374 5.014 -0.640 1
1 723 . 2 1 1 A 60 60 VAL C C 60 173.140 174.668 -1.528 1
1 724 . 2 1 1 A 60 60 VAL CA C 60 61.252 60.210 1.042 1
1 725 . 2 1 1 A 60 60 VAL CB C 60 35.620 35.545 0.075 1
1 728 . 2 1 1 A 60 60 VAL N N 60 119.758 125.026 -5.268 1
1 729 . 2 1 1 A 61 61 ALA H H 61 8.761 8.879 -0.118 1
1 730 . 2 1 1 A 61 61 ALA HA H 61 5.091 5.120 -0.029 1
1 734 . 2 1 1 A 61 61 ALA C C 61 176.460 176.174 0.286 1
1 735 . 2 1 1 A 61 61 ALA CA C 61 51.019 51.075 -0.056 1
1 736 . 2 1 1 A 61 61 ALA CB C 61 19.447 21.381 -1.934 1
1 737 . 2 1 1 A 61 61 ALA N N 61 133.341 128.054 5.287 1
1 738 . 2 1 1 A 62 62 VAL H H 62 8.929 8.784 0.145 1
1 739 . 2 1 1 A 62 62 VAL HA H 62 4.236 4.683 -0.447 1
1 747 . 2 1 1 A 62 62 VAL C C 62 174.733 175.491 -0.758 1
1 748 . 2 1 1 A 62 62 VAL CA C 62 61.007 60.681 0.326 1
1 749 . 2 1 1 A 62 62 VAL CB C 62 34.387 36.011 -1.624 1
1 752 . 2 1 1 A 62 62 VAL N N 62 124.165 122.605 1.560 1
1 753 . 2 1 1 A 63 63 GLY H H 63 8.995 8.604 0.391 1
1 754 . 2 1 1 A 63 63 GLY HA2 H 63 4.229 4.112 0.117 1
1 755 . 2 1 1 A 63 63 GLY HA3 H 63 3.637 4.117 -0.480 1
1 756 . 2 1 1 A 63 63 GLY C C 63 175.306 174.879 0.427 1
1 757 . 2 1 1 A 63 63 GLY CA C 63 44.620 45.215 -0.595 1
1 758 . 2 1 1 A 63 63 GLY N N 63 115.598 111.871 3.727 1
1 759 . 2 1 1 A 64 64 ALA H H 64 8.106 8.931 -0.825 1
1 760 . 2 1 1 A 64 64 ALA HA H 64 4.010 4.431 -0.421 1
1 764 . 2 1 1 A 64 64 ALA C C 64 180.218 179.511 0.707 1
1 765 . 2 1 1 A 64 64 ALA CA C 64 55.897 54.597 1.300 1
1 766 . 2 1 1 A 64 64 ALA CB C 64 18.347 18.359 -0.012 1
1 767 . 2 1 1 A 64 64 ALA N N 64 122.859 123.789 -0.930 1
1 768 . 2 1 1 A 65 65 ASN H H 65 8.748 8.334 0.414 1
1 769 . 2 1 1 A 65 65 ASN HA H 65 4.230 4.486 -0.256 1
1 774 . 2 1 1 A 65 65 ASN C C 65 176.085 176.197 -0.112 1
1 775 . 2 1 1 A 65 65 ASN CA C 65 56.064 56.353 -0.289 1
1 776 . 2 1 1 A 65 65 ASN CB C 65 37.871 39.146 -1.275 1
1 777 . 2 1 1 A 65 65 ASN N N 65 114.590 117.208 -2.618 1
1 779 . 2 1 1 A 66 66 ASP H H 66 7.598 8.060 -0.462 1
1 780 . 2 1 1 A 66 66 ASP HA H 66 4.682 4.719 -0.037 1
1 783 . 2 1 1 A 66 66 ASP C C 66 173.061 175.550 -2.489 1
1 784 . 2 1 1 A 66 66 ASP CA C 66 53.549 54.329 -0.780 1
1 785 . 2 1 1 A 66 66 ASP CB C 66 42.204 42.406 -0.202 1
1 786 . 2 1 1 A 66 66 ASP N N 66 118.065 116.217 1.848 1
1 787 . 2 1 1 A 67 67 ALA H H 67 7.434 7.355 0.079 1
1 788 . 2 1 1 A 67 67 ALA HA H 67 4.316 4.402 -0.086 1
1 792 . 2 1 1 A 67 67 ALA C C 67 175.615 176.454 -0.839 1
1 793 . 2 1 1 A 67 67 ALA CA C 67 50.814 50.259 0.555 1
1 794 . 2 1 1 A 67 67 ALA CB C 67 18.618 21.656 -3.038 1
1 795 . 2 1 1 A 67 67 ALA N N 67 124.890 120.581 4.309 1
1 796 . 2 1 1 A 68 68 TYR H H 68 8.390 8.391 -0.001 1
1 797 . 2 1 1 A 68 68 TYR HA H 68 4.195 4.676 -0.481 1
1 804 . 2 1 1 A 68 68 TYR C C 68 174.964 176.797 -1.833 1
1 805 . 2 1 1 A 68 68 TYR CA C 68 59.566 57.925 1.641 1
1 806 . 2 1 1 A 68 68 TYR CB C 68 36.992 39.304 -2.312 1
1 809 . 2 1 1 A 68 68 TYR N N 68 121.083 117.420 3.663 1
1 810 . 2 1 1 A 69 69 GLY H H 69 8.149 8.869 -0.720 1
1 811 . 2 1 1 A 69 69 GLY HA2 H 69 4.254 3.981 0.273 1
1 812 . 2 1 1 A 69 69 GLY HA3 H 69 3.624 3.990 -0.366 1
1 813 . 2 1 1 A 69 69 GLY C C 69 173.161 175.079 -1.918 1
1 814 . 2 1 1 A 69 69 GLY CA C 69 44.465 45.707 -1.242 1
1 815 . 2 1 1 A 69 69 GLY N N 69 108.762 110.093 -1.331 1
1 816 . 2 1 1 A 70 70 GLN H H 70 8.450 7.776 0.674 1
1 817 . 2 1 1 A 70 70 GLN HA H 70 4.140 4.531 -0.391 1
1 824 . 2 1 1 A 70 70 GLN C C 70 176.138 174.991 1.147 1
1 825 . 2 1 1 A 70 70 GLN CA C 70 54.680 55.613 -0.933 1
1 826 . 2 1 1 A 70 70 GLN CB C 70 29.210 30.356 -1.146 1
1 828 . 2 1 1 A 70 70 GLN N N 70 117.002 119.479 -2.477 1
1 830 . 2 1 1 A 71 71 TYR H H 71 8.991 8.591 0.400 1
1 831 . 2 1 1 A 71 71 TYR HA H 71 3.752 4.563 -0.811 1
1 838 . 2 1 1 A 71 71 TYR C C 71 174.548 175.012 -0.464 1
1 839 . 2 1 1 A 71 71 TYR CA C 71 59.868 57.823 2.045 1
1 840 . 2 1 1 A 71 71 TYR CB C 71 38.961 39.531 -0.570 1
1 843 . 2 1 1 A 71 71 TYR N N 71 125.112 120.538 4.574 1
1 844 . 2 1 1 A 72 72 ASP H H 72 8.819 9.065 -0.246 1
1 845 . 2 1 1 A 72 72 ASP HA H 72 4.773 4.556 0.217 1
1 848 . 2 1 1 A 72 72 ASP C C 72 177.709 176.831 0.878 1
1 849 . 2 1 1 A 72 72 ASP CA C 72 52.382 53.347 -0.965 1
1 850 . 2 1 1 A 72 72 ASP CB C 72 42.197 40.594 1.603 1
1 851 . 2 1 1 A 72 72 ASP N N 72 129.918 122.988 6.930 1
1 852 . 2 1 1 A 73 73 GLU H H 73 9.409 8.334 1.075 1
1 853 . 2 1 1 A 73 73 GLU HA H 73 3.937 4.355 -0.418 1
1 858 . 2 1 1 A 73 73 GLU C C 73 177.581 176.954 0.627 1
1 859 . 2 1 1 A 73 73 GLU CA C 73 58.962 58.264 0.698 1
1 860 . 2 1 1 A 73 73 GLU CB C 73 29.155 28.479 0.676 1
1 862 . 2 1 1 A 73 73 GLU N N 73 129.624 125.159 4.465 1
1 863 . 2 1 1 A 74 74 ASN H H 74 8.700 8.234 0.466 1
1 864 . 2 1 1 A 74 74 ASN HA H 74 4.550 4.610 -0.060 1
1 869 . 2 1 1 A 74 74 ASN C C 74 176.190 176.563 -0.373 1
1 870 . 2 1 1 A 74 74 ASN CA C 74 54.932 54.038 0.894 1
1 871 . 2 1 1 A 74 74 ASN CB C 74 38.113 37.639 0.474 1
1 872 . 2 1 1 A 74 74 ASN N N 74 116.792 118.123 -1.331 1
1 874 . 2 1 1 A 75 75 LEU H H 75 7.303 7.783 -0.480 1
1 875 . 2 1 1 A 75 75 LEU HA H 75 4.289 4.384 -0.095 1
1 885 . 2 1 1 A 75 75 LEU C C 75 175.821 176.650 -0.829 1
1 886 . 2 1 1 A 75 75 LEU CA C 75 54.106 55.880 -1.774 1
1 887 . 2 1 1 A 75 75 LEU CB C 75 41.239 42.916 -1.677 1
1 891 . 2 1 1 A 75 75 LEU N N 75 117.094 120.054 -2.960 1
1 892 . 2 1 1 A 76 76 VAL H H 76 7.181 7.827 -0.646 1
1 893 . 2 1 1 A 76 76 VAL HA H 76 4.970 4.662 0.308 1
1 901 . 2 1 1 A 76 76 VAL C C 76 175.702 174.765 0.937 1
1 902 . 2 1 1 A 76 76 VAL CA C 76 61.733 60.884 0.849 1
1 903 . 2 1 1 A 76 76 VAL CB C 76 31.822 34.810 -2.988 1
1 905 . 2 1 1 A 76 76 VAL N N 76 124.716 119.898 4.818 1
1 906 . 2 1 1 A 77 77 GLN H H 77 8.791 8.968 -0.177 1
1 907 . 2 1 1 A 77 77 GLN HA H 77 4.695 5.078 -0.383 1
1 914 . 2 1 1 A 77 77 GLN C C 77 173.553 173.349 0.204 1
1 915 . 2 1 1 A 77 77 GLN CA C 77 54.038 54.616 -0.578 1
1 916 . 2 1 1 A 77 77 GLN CB C 77 33.018 32.312 0.706 1
1 918 . 2 1 1 A 77 77 GLN N N 77 124.898 122.471 2.427 1
1 920 . 2 1 1 A 78 78 ARG H H 78 8.530 8.515 0.015 1
1 921 . 2 1 1 A 78 78 ARG HA H 78 5.107 5.423 -0.316 1
1 928 . 2 1 1 A 78 78 ARG C C 78 176.182 175.374 0.808 1
1 929 . 2 1 1 A 78 78 ARG CA C 78 55.355 54.887 0.468 1
1 930 . 2 1 1 A 78 78 ARG CB C 78 31.150 32.016 -0.866 1
1 933 . 2 1 1 A 78 78 ARG N N 78 123.413 119.811 3.602 1
1 934 . 2 1 1 A 79 79 VAL H H 79 9.300 9.027 0.273 1
1 935 . 2 1 1 A 79 79 VAL HA H 79 4.824 4.569 0.255 1
1 943 . 2 1 1 A 79 79 VAL CA C 79 58.731 58.858 -0.127 1
1 944 . 2 1 1 A 79 79 VAL CB C 79 34.836 33.076 1.760 1
1 947 . 2 1 1 A 79 79 VAL N N 79 125.252 125.049 0.203 1
1 948 . 2 1 1 A 80 80 PRO HA H 80 4.339 4.884 -0.545 1
1 955 . 2 1 1 A 80 80 PRO C C 80 176.902 178.039 -1.137 1
1 956 . 2 1 1 A 80 80 PRO CA C 80 62.969 63.171 -0.202 1
1 957 . 2 1 1 A 80 80 PRO CB C 80 32.431 32.131 0.300 1
1 960 . 2 1 1 A 81 81 LYS H H 81 7.816 8.994 -1.178 1
1 961 . 2 1 1 A 81 81 LYS HA H 81 3.790 4.031 -0.241 1
1 970 . 2 1 1 A 81 81 LYS C C 81 177.808 178.749 -0.941 1
1 971 . 2 1 1 A 81 81 LYS CA C 81 59.874 59.492 0.382 1
1 972 . 2 1 1 A 81 81 LYS CB C 81 32.670 32.158 0.512 1
1 976 . 2 1 1 A 81 81 LYS N N 81 120.948 124.258 -3.310 1
1 977 . 2 1 1 A 82 82 ASP H H 82 8.069 8.194 -0.125 1
1 978 . 2 1 1 A 82 82 ASP HA H 82 4.243 4.441 -0.198 1
1 981 . 2 1 1 A 82 82 ASP C C 82 177.157 178.646 -1.489 1
1 982 . 2 1 1 A 82 82 ASP CA C 82 55.527 56.655 -1.128 1
1 983 . 2 1 1 A 82 82 ASP CB C 82 40.005 41.039 -1.034 1
1 984 . 2 1 1 A 82 82 ASP N N 82 116.004 119.836 -3.832 1
1 985 . 2 1 1 A 83 83 VAL H H 83 7.150 8.008 -0.858 1
1 986 . 2 1 1 A 83 83 VAL HA H 83 3.719 3.598 0.121 1
1 994 . 2 1 1 A 83 83 VAL C C 83 176.346 176.701 -0.355 1
1 995 . 2 1 1 A 83 83 VAL CA C 83 63.868 65.792 -1.924 1
1 996 . 2 1 1 A 83 83 VAL CB C 83 31.689 31.612 0.077 1
1 999 . 2 1 1 A 83 83 VAL N N 83 117.199 119.036 -1.837 1
1 1000 . 2 1 1 A 84 84 PHE H H 84 7.365 7.676 -0.311 1
1 1001 . 2 1 1 A 84 84 PHE HA H 84 4.389 4.627 -0.238 1
1 1009 . 2 1 1 A 84 84 PHE C C 84 175.265 176.151 -0.886 1
1 1010 . 2 1 1 A 84 84 PHE CA C 84 57.210 56.902 0.308 1
1 1011 . 2 1 1 A 84 84 PHE CB C 84 38.968 37.966 1.002 1
1 1015 . 2 1 1 A 84 84 PHE N N 84 119.897 117.118 2.779 1
1 1016 . 2 1 1 A 85 85 MET H H 85 7.765 8.225 -0.460 1
1 1017 . 2 1 1 A 85 85 MET HA H 85 4.277 4.334 -0.057 1
1 1025 . 2 1 1 A 85 85 MET C C 85 176.856 177.167 -0.311 1
1 1026 . 2 1 1 A 85 85 MET CA C 85 56.389 57.748 -1.359 1
1 1027 . 2 1 1 A 85 85 MET CB C 85 32.715 32.339 0.376 1
1 1030 . 2 1 1 A 85 85 MET N N 85 121.131 119.286 1.845 1
1 1031 . 2 1 1 A 86 86 GLY H H 86 8.499 8.158 0.341 1
1 1032 . 2 1 1 A 86 86 GLY HA2 H 86 3.928 3.942 -0.014 1
1 1033 . 2 1 1 A 86 86 GLY HA3 H 86 3.793 3.943 -0.150 1
1 1034 . 2 1 1 A 86 86 GLY C C 86 174.168 173.702 0.466 1
1 1035 . 2 1 1 A 86 86 GLY CA C 86 45.637 45.217 0.420 1
1 1036 . 2 1 1 A 86 86 GLY N N 86 111.268 107.800 3.468 1
1 1037 . 2 1 1 A 87 87 VAL H H 87 7.564 7.677 -0.113 1
1 1038 . 2 1 1 A 87 87 VAL HA H 87 4.083 4.266 -0.183 1
1 1046 . 2 1 1 A 87 87 VAL C C 87 175.649 176.098 -0.449 1
1 1047 . 2 1 1 A 87 87 VAL CA C 87 61.809 61.019 0.790 1
1 1048 . 2 1 1 A 87 87 VAL CB C 87 32.667 33.617 -0.950 1
1 1051 . 2 1 1 A 87 87 VAL N N 87 118.839 120.441 -1.602 1
1 1052 . 2 1 1 A 88 88 ASP H H 88 8.270 8.814 -0.544 1
1 1053 . 2 1 1 A 88 88 ASP HA H 88 4.421 4.344 0.077 1
1 1056 . 2 1 1 A 88 88 ASP C C 88 175.977 175.231 0.746 1
1 1057 . 2 1 1 A 88 88 ASP CA C 88 55.655 57.023 -1.368 1
1 1058 . 2 1 1 A 88 88 ASP CB C 88 41.364 41.050 0.314 1
1 1059 . 2 1 1 A 88 88 ASP N N 88 124.401 127.301 -2.900 1
1 1060 . 2 1 1 A 89 89 GLU H H 89 7.833 7.857 -0.024 1
1 1061 . 2 1 1 A 89 89 GLU HA H 89 4.206 4.732 -0.526 1
1 1066 . 2 1 1 A 89 89 GLU C C 89 174.912 175.498 -0.586 1
1 1067 . 2 1 1 A 89 89 GLU CA C 89 55.739 55.338 0.401 1
1 1068 . 2 1 1 A 89 89 GLU CB C 89 30.603 32.754 -2.151 1
1 1070 . 2 1 1 A 89 89 GLU N N 89 119.378 115.660 3.718 1
1 1071 . 2 1 1 A 90 90 LEU H H 90 8.051 8.700 -0.649 1
1 1072 . 2 1 1 A 90 90 LEU HA H 90 4.127 4.355 -0.228 1
1 1082 . 2 1 1 A 90 90 LEU C C 90 175.753 176.181 -0.428 1
1 1083 . 2 1 1 A 90 90 LEU CA C 90 54.929 55.543 -0.614 1
1 1084 . 2 1 1 A 90 90 LEU CB C 90 42.710 41.403 1.307 1
1 1088 . 2 1 1 A 90 90 LEU N N 90 124.432 126.128 -1.696 1
1 1089 . 2 1 1 A 91 91 GLN H H 91 7.341 8.701 -1.360 1
1 1090 . 2 1 1 A 91 91 GLN HA H 91 4.546 4.808 -0.262 1
1 1097 . 2 1 1 A 91 91 GLN C C 91 174.655 174.285 0.370 1
1 1098 . 2 1 1 A 91 91 GLN CA C 91 53.671 54.267 -0.596 1
1 1099 . 2 1 1 A 91 91 GLN CB C 91 32.850 32.504 0.346 1
1 1101 . 2 1 1 A 91 91 GLN N N 91 120.186 125.343 -5.157 1
1 1103 . 2 1 1 A 92 92 VAL H H 92 8.442 8.502 -0.060 1
1 1104 . 2 1 1 A 92 92 VAL HA H 92 3.278 3.710 -0.432 1
1 1112 . 2 1 1 A 92 92 VAL C C 92 177.098 177.267 -0.169 1
1 1113 . 2 1 1 A 92 92 VAL CA C 92 64.953 64.668 0.285 1
1 1114 . 2 1 1 A 92 92 VAL CB C 92 31.601 31.785 -0.184 1
1 1117 . 2 1 1 A 92 92 VAL N N 92 121.899 124.008 -2.109 1
1 1118 . 2 1 1 A 93 93 GLY H H 93 9.002 9.281 -0.279 1
1 1119 . 2 1 1 A 93 93 GLY HA2 H 93 4.327 3.926 0.401 1
1 1120 . 2 1 1 A 93 93 GLY HA3 H 93 3.770 3.945 -0.175 1
1 1121 . 2 1 1 A 93 93 GLY C C 93 174.547 174.028 0.519 1
1 1122 . 2 1 1 A 93 93 GLY CA C 93 44.446 45.202 -0.756 1
1 1123 . 2 1 1 A 93 93 GLY N N 93 116.485 114.936 1.549 1
1 1124 . 2 1 1 A 94 94 MET H H 94 7.445 7.853 -0.408 1
1 1125 . 2 1 1 A 94 94 MET HA H 94 4.182 4.502 -0.320 1
1 1133 . 2 1 1 A 94 94 MET C C 94 174.531 175.181 -0.650 1
1 1134 . 2 1 1 A 94 94 MET CA C 94 57.193 55.153 2.040 1
1 1135 . 2 1 1 A 94 94 MET CB C 94 34.474 33.200 1.274 1
1 1138 . 2 1 1 A 94 94 MET N N 94 120.304 120.298 0.006 1
1 1139 . 2 1 1 A 95 95 ARG H H 95 8.169 8.606 -0.437 1
1 1140 . 2 1 1 A 95 95 ARG HA H 95 5.343 4.923 0.420 1
1 1147 . 2 1 1 A 95 95 ARG C C 95 175.593 175.071 0.522 1
1 1148 . 2 1 1 A 95 95 ARG CA C 95 54.898 54.621 0.277 1
1 1149 . 2 1 1 A 95 95 ARG CB C 95 32.928 33.050 -0.122 1
1 1152 . 2 1 1 A 95 95 ARG N N 95 122.066 122.886 -0.820 1
1 1153 . 2 1 1 A 96 96 PHE H H 96 8.440 8.464 -0.024 1
1 1154 . 2 1 1 A 96 96 PHE HA H 96 4.738 5.085 -0.347 1
1 1162 . 2 1 1 A 96 96 PHE C C 96 173.273 171.925 1.348 1
1 1163 . 2 1 1 A 96 96 PHE CA C 96 56.174 56.084 0.090 1
1 1164 . 2 1 1 A 96 96 PHE CB C 96 42.474 40.590 1.884 1
1 1168 . 2 1 1 A 96 96 PHE N N 96 119.938 118.842 1.096 1
1 1169 . 2 1 1 A 97 97 LEU H H 97 8.459 8.741 -0.282 1
1 1170 . 2 1 1 A 97 97 LEU HA H 97 4.625 4.935 -0.310 1
1 1180 . 2 1 1 A 97 97 LEU C C 97 175.664 174.835 0.829 1
1 1181 . 2 1 1 A 97 97 LEU CA C 97 53.547 54.504 -0.957 1
1 1182 . 2 1 1 A 97 97 LEU CB C 97 42.379 43.592 -1.213 1
1 1186 . 2 1 1 A 97 97 LEU N N 97 122.014 121.836 0.178 1
1 1187 . 2 1 1 A 98 98 ALA H H 98 8.812 8.604 0.208 1
1 1188 . 2 1 1 A 98 98 ALA HA H 98 4.520 5.062 -0.542 1
1 1192 . 2 1 1 A 98 98 ALA C C 98 176.373 177.016 -0.643 1
1 1193 . 2 1 1 A 98 98 ALA CA C 98 50.639 51.157 -0.518 1
1 1194 . 2 1 1 A 98 98 ALA CB C 98 20.939 20.135 0.804 1
1 1195 . 2 1 1 A 98 98 ALA N N 98 129.296 128.176 1.120 1
1 1196 . 2 1 1 A 99 99 GLU H H 99 8.504 8.832 -0.328 1
1 1197 . 2 1 1 A 99 99 GLU HA H 99 4.150 4.265 -0.115 1
1 1202 . 2 1 1 A 99 99 GLU C C 99 176.351 176.635 -0.284 1
1 1203 . 2 1 1 A 99 99 GLU CA C 99 56.830 57.679 -0.849 1
1 1204 . 2 1 1 A 99 99 GLU CB C 99 29.639 29.916 -0.277 1
1 1206 . 2 1 1 A 99 99 GLU N N 99 121.993 122.453 -0.460 1
1 1207 . 2 1 1 A 100 100 THR H H 100 7.393 8.401 -1.008 1
1 1208 . 2 1 1 A 100 100 THR HA H 100 4.819 4.838 -0.019 1
1 1213 . 2 1 1 A 100 100 THR C C 100 175.882 174.948 0.934 1
1 1214 . 2 1 1 A 100 100 THR CA C 100 60.329 60.460 -0.131 1
1 1215 . 2 1 1 A 100 100 THR CB C 100 73.452 71.905 1.547 1
1 1217 . 2 1 1 A 100 100 THR N N 100 115.598 115.669 -0.071 1
1 1218 . 2 1 1 A 101 101 ASP H H 101 8.988 8.916 0.072 1
1 1219 . 2 1 1 A 101 101 ASP HA H 101 4.357 4.385 -0.028 1
1 1222 . 2 1 1 A 101 101 ASP C C 101 176.848 177.337 -0.489 1
1 1223 . 2 1 1 A 101 101 ASP CA C 101 56.493 58.060 -1.567 1
1 1224 . 2 1 1 A 101 101 ASP CB C 101 39.973 40.474 -0.501 1
1 1225 . 2 1 1 A 101 101 ASP N N 101 121.468 120.407 1.061 1
1 1226 . 2 1 1 A 102 102 GLN H H 102 7.937 7.990 -0.053 1
1 1227 . 2 1 1 A 102 102 GLN HA H 102 4.415 4.327 0.088 1
1 1234 . 2 1 1 A 102 102 GLN C C 102 175.252 176.051 -0.799 1
1 1235 . 2 1 1 A 102 102 GLN CA C 102 55.097 54.982 0.115 1
1 1236 . 2 1 1 A 102 102 GLN CB C 102 29.121 27.449 1.672 1
1 1238 . 2 1 1 A 102 102 GLN N N 102 117.199 113.926 3.273 1
1 1240 . 2 1 1 A 103 103 GLY H H 103 7.431 7.878 -0.447 1
1 1241 . 2 1 1 A 103 103 GLY HA2 H 103 4.504 4.193 0.311 1
1 1242 . 2 1 1 A 103 103 GLY HA3 H 103 3.868 4.194 -0.326 1
1 1243 . 2 1 1 A 103 103 GLY CA C 103 44.051 44.433 -0.382 1
1 1244 . 2 1 1 A 103 103 GLY N N 103 110.056 110.580 -0.524 1
1 1245 . 2 1 1 A 104 104 PRO HA H 104 5.057 4.812 0.245 1
1 1252 . 2 1 1 A 104 104 PRO C C 104 177.873 175.901 1.972 1
1 1253 . 2 1 1 A 104 104 PRO CA C 104 62.464 62.852 -0.388 1
1 1254 . 2 1 1 A 104 104 PRO CB C 104 31.939 31.859 0.080 1
1 1257 . 2 1 1 A 105 105 VAL H H 105 8.960 8.889 0.071 1
1 1258 . 2 1 1 A 105 105 VAL HA H 105 4.678 4.481 0.197 1
1 1266 . 2 1 1 A 105 105 VAL CA C 105 58.474 59.377 -0.903 1
1 1267 . 2 1 1 A 105 105 VAL CB C 105 35.512 33.885 1.627 1
1 1270 . 2 1 1 A 105 105 VAL N N 105 123.240 123.249 -0.009 1
1 1271 . 2 1 1 A 106 106 PRO HA H 106 4.777 4.798 -0.021 1
1 1278 . 2 1 1 A 106 106 PRO C C 106 176.823 176.148 0.675 1
1 1279 . 2 1 1 A 106 106 PRO CA C 106 62.508 62.413 0.095 1
1 1280 . 2 1 1 A 106 106 PRO CB C 106 31.650 30.952 0.698 1
1 1283 . 2 1 1 A 107 107 VAL H H 107 8.835 8.158 0.677 1
1 1284 . 2 1 1 A 107 107 VAL HA H 107 4.719 5.008 -0.289 1
1 1292 . 2 1 1 A 107 107 VAL C C 107 173.661 173.390 0.271 1
1 1293 . 2 1 1 A 107 107 VAL CA C 107 59.026 59.214 -0.188 1
1 1294 . 2 1 1 A 107 107 VAL CB C 107 36.406 35.312 1.094 1
1 1297 . 2 1 1 A 107 107 VAL N N 107 117.474 117.275 0.199 1
1 1298 . 2 1 1 A 108 108 GLU H H 108 7.698 8.673 -0.975 1
1 1299 . 2 1 1 A 108 108 GLU HA H 108 5.133 5.005 0.128 1
1 1304 . 2 1 1 A 108 108 GLU C C 108 176.394 175.004 1.390 1
1 1305 . 2 1 1 A 108 108 GLU CA C 108 53.808 54.370 -0.562 1
1 1306 . 2 1 1 A 108 108 GLU CB C 108 33.984 33.516 0.468 1
1 1308 . 2 1 1 A 108 108 GLU N N 108 120.646 120.048 0.598 1
1 1309 . 2 1 1 A 109 109 ILE H H 109 8.690 8.880 -0.190 1
1 1310 . 2 1 1 A 109 109 ILE HA H 109 4.484 4.261 0.223 1
1 1320 . 2 1 1 A 109 109 ILE C C 109 177.313 177.038 0.275 1
1 1321 . 2 1 1 A 109 109 ILE CA C 109 61.789 61.635 0.154 1
1 1322 . 2 1 1 A 109 109 ILE CB C 109 36.628 37.459 -0.831 1
1 1326 . 2 1 1 A 109 109 ILE N N 109 124.739 127.501 -2.762 1
1 1327 . 2 1 1 A 110 110 THR H H 110 9.300 9.504 -0.204 1
1 1328 . 2 1 1 A 110 110 THR HA H 110 4.547 4.468 0.079 1
1 1333 . 2 1 1 A 110 110 THR C C 110 174.904 174.775 0.129 1
1 1334 . 2 1 1 A 110 110 THR CA C 110 62.260 61.854 0.406 1
1 1335 . 2 1 1 A 110 110 THR CB C 110 69.100 69.511 -0.411 1
1 1337 . 2 1 1 A 110 110 THR N N 110 122.544 119.418 3.126 1
1 1338 . 2 1 1 A 111 111 ALA H H 111 7.673 7.085 0.588 1
1 1339 . 2 1 1 A 111 111 ALA HA H 111 4.367 4.572 -0.205 1
1 1343 . 2 1 1 A 111 111 ALA C C 111 175.019 174.938 0.081 1
1 1344 . 2 1 1 A 111 111 ALA CA C 111 53.125 51.805 1.320 1
1 1345 . 2 1 1 A 111 111 ALA CB C 111 21.539 22.404 -0.865 1
1 1346 . 2 1 1 A 111 111 ALA N N 111 123.153 120.984 2.169 1
1 1347 . 2 1 1 A 112 112 VAL H H 112 8.707 8.523 0.184 1
1 1348 . 2 1 1 A 112 112 VAL HA H 112 4.129 4.539 -0.410 1
1 1356 . 2 1 1 A 112 112 VAL C C 112 174.755 175.230 -0.475 1
1 1357 . 2 1 1 A 112 112 VAL CA C 112 62.898 61.538 1.360 1
1 1358 . 2 1 1 A 112 112 VAL CB C 112 33.379 34.422 -1.043 1
1 1361 . 2 1 1 A 112 112 VAL N N 112 122.369 119.752 2.617 1
1 1362 . 2 1 1 A 113 113 GLU H H 113 8.144 8.785 -0.641 1
1 1363 . 2 1 1 A 113 113 GLU HA H 113 4.645 4.458 0.187 1
1 1368 . 2 1 1 A 113 113 GLU C C 113 175.102 177.629 -2.527 1
1 1369 . 2 1 1 A 113 113 GLU CA C 113 54.080 55.507 -1.427 1
1 1370 . 2 1 1 A 113 113 GLU CB C 113 31.234 30.618 0.616 1
1 1372 . 2 1 1 A 113 113 GLU N N 113 127.435 126.942 0.493 1
1 1373 . 2 1 1 A 114 114 ASP H H 114 8.472 8.596 -0.124 1
1 1374 . 2 1 1 A 114 114 ASP HA H 114 4.209 4.284 -0.075 1
1 1377 . 2 1 1 A 114 114 ASP C C 114 177.679 176.704 0.975 1
1 1378 . 2 1 1 A 114 114 ASP CA C 114 58.334 57.884 0.450 1
1 1379 . 2 1 1 A 114 114 ASP CB C 114 40.347 40.632 -0.285 1
1 1380 . 2 1 1 A 114 114 ASP N N 114 119.844 121.318 -1.474 1
1 1381 . 2 1 1 A 115 115 ASP H H 115 8.475 8.117 0.358 1
1 1382 . 2 1 1 A 115 115 ASP HA H 115 4.848 4.846 0.002 1
1 1385 . 2 1 1 A 115 115 ASP C C 115 175.968 175.541 0.427 1
1 1386 . 2 1 1 A 115 115 ASP CA C 115 53.290 53.559 -0.269 1
1 1387 . 2 1 1 A 115 115 ASP CB C 115 42.080 41.762 0.318 1
1 1388 . 2 1 1 A 115 115 ASP N N 115 114.364 116.057 -1.693 1
1 1389 . 2 1 1 A 116 116 HIS H H 116 7.185 7.389 -0.204 1
1 1390 . 2 1 1 A 116 116 HIS HA H 116 5.106 5.445 -0.339 1
1 1395 . 2 1 1 A 116 116 HIS C C 116 172.393 173.480 -1.087 1
1 1396 . 2 1 1 A 116 116 HIS CA C 116 56.099 54.226 1.873 1
1 1397 . 2 1 1 A 116 116 HIS CB C 116 33.289 32.422 0.867 1
1 1400 . 2 1 1 A 116 116 HIS N N 116 117.212 116.442 0.770 1
1 1401 . 2 1 1 A 117 117 VAL H H 117 9.130 9.265 -0.135 1
1 1402 . 2 1 1 A 117 117 VAL HA H 117 4.649 4.874 -0.225 1
1 1410 . 2 1 1 A 117 117 VAL C C 117 173.832 175.001 -1.169 1
1 1411 . 2 1 1 A 117 117 VAL CA C 117 59.555 60.165 -0.610 1
1 1412 . 2 1 1 A 117 117 VAL CB C 117 34.676 33.936 0.740 1
1 1415 . 2 1 1 A 117 117 VAL N N 117 114.046 117.760 -3.714 1
1 1416 . 2 1 1 A 118 118 VAL H H 118 8.680 8.506 0.174 1
1 1417 . 2 1 1 A 118 118 VAL HA H 118 4.747 4.965 -0.218 1
1 1425 . 2 1 1 A 118 118 VAL C C 118 175.836 175.290 0.546 1
1 1426 . 2 1 1 A 118 118 VAL CA C 118 62.159 60.910 1.249 1
1 1427 . 2 1 1 A 118 118 VAL CB C 118 31.887 34.407 -2.520 1
1 1430 . 2 1 1 A 118 118 VAL N N 118 125.095 121.568 3.527 1
1 1431 . 2 1 1 A 119 119 VAL H H 119 9.057 8.526 0.531 1
1 1432 . 2 1 1 A 119 119 VAL HA H 119 5.231 5.130 0.101 1
1 1440 . 2 1 1 A 119 119 VAL C C 119 173.747 173.755 -0.008 1
1 1441 . 2 1 1 A 119 119 VAL CA C 119 58.326 59.433 -1.107 1
1 1442 . 2 1 1 A 119 119 VAL CB C 119 34.387 34.246 0.141 1
1 1445 . 2 1 1 A 119 119 VAL N N 119 121.494 122.509 -1.015 1
1 1446 . 2 1 1 A 120 120 ASP H H 120 8.926 8.437 0.489 1
1 1447 . 2 1 1 A 120 120 ASP HA H 120 5.174 5.218 -0.044 1
1 1450 . 2 1 1 A 120 120 ASP C C 120 177.982 174.538 3.444 1
1 1451 . 2 1 1 A 120 120 ASP CA C 120 52.749 52.433 0.316 1
1 1452 . 2 1 1 A 120 120 ASP CB C 120 44.542 44.657 -0.115 1
1 1453 . 2 1 1 A 120 120 ASP N N 120 121.454 125.075 -3.621 1
1 1454 . 2 1 1 A 121 121 GLY H H 121 8.674 8.531 0.143 1
1 1455 . 2 1 1 A 121 121 GLY HA2 H 121 4.702 4.178 0.524 1
1 1456 . 2 1 1 A 121 121 GLY HA3 H 121 3.573 4.196 -0.623 1
1 1457 . 2 1 1 A 121 121 GLY C C 121 175.041 174.201 0.840 1
1 1458 . 2 1 1 A 121 121 GLY CA C 121 45.319 45.509 -0.190 1
1 1459 . 2 1 1 A 121 121 GLY N N 121 114.850 112.157 2.693 1
1 1460 . 2 1 1 A 122 122 ASN H H 122 8.762 7.880 0.882 1
1 1461 . 2 1 1 A 122 122 ASN HA H 122 4.183 5.250 -1.067 1
1 1466 . 2 1 1 A 122 122 ASN C C 122 175.406 174.379 1.027 1
1 1467 . 2 1 1 A 122 122 ASN CA C 122 54.686 51.875 2.811 1
1 1468 . 2 1 1 A 122 122 ASN CB C 122 40.139 42.057 -1.918 1
1 1469 . 2 1 1 A 122 122 ASN N N 122 121.618 117.025 4.593 1
1 1471 . 2 1 1 A 123 123 HIS H H 123 8.929 8.747 0.182 1
1 1472 . 2 1 1 A 123 123 HIS HA H 123 4.005 4.844 -0.839 1
1 1477 . 2 1 1 A 123 123 HIS C C 123 177.325 176.330 0.995 1
1 1478 . 2 1 1 A 123 123 HIS CA C 123 58.768 56.911 1.857 1
1 1479 . 2 1 1 A 123 123 HIS CB C 123 31.172 32.360 -1.188 1
1 1482 . 2 1 1 A 123 123 HIS N N 123 124.165 121.880 2.285 1
1 1483 . 2 1 1 A 124 124 MET H H 124 8.266 8.511 -0.245 1
1 1484 . 2 1 1 A 124 124 MET HA H 124 4.048 4.094 -0.046 1
1 1492 . 2 1 1 A 124 124 MET CA C 124 58.994 57.294 1.700 1
1 1493 . 2 1 1 A 124 124 MET CB C 124 32.777 31.917 0.860 1
1 1496 . 2 1 1 A 124 124 MET N N 124 129.443 118.986 10.457 1
1 1497 . 2 1 1 A 125 125 LEU H H 125 8.094 7.695 0.399 1
1 1498 . 2 1 1 A 125 125 LEU HA H 125 4.455 4.281 0.174 1
1 1504 . 2 1 1 A 125 125 LEU C C 125 177.860 177.058 0.802 1
1 1505 . 2 1 1 A 125 125 LEU CA C 125 53.517 55.978 -2.461 1
1 1506 . 2 1 1 A 125 125 LEU CB C 125 42.462 42.056 0.406 1
1 1509 . 2 1 1 A 126 126 ALA H H 126 8.089 7.410 0.679 1
1 1510 . 2 1 1 A 126 126 ALA HA H 126 3.966 4.488 -0.522 1
1 1514 . 2 1 1 A 126 126 ALA C C 126 179.135 178.373 0.762 1
1 1515 . 2 1 1 A 126 126 ALA CA C 126 54.170 51.969 2.201 1
1 1516 . 2 1 1 A 126 126 ALA CB C 126 18.687 20.406 -1.719 1
1 1517 . 2 1 1 A 126 126 ALA N N 126 126.095 121.457 4.638 1
1 1518 . 2 1 1 A 127 127 GLY H H 127 9.499 8.837 0.662 1
1 1519 . 2 1 1 A 127 127 GLY HA2 H 127 4.207 3.975 0.232 1
1 1520 . 2 1 1 A 127 127 GLY HA3 H 127 3.598 3.981 -0.383 1
1 1521 . 2 1 1 A 127 127 GLY C C 127 173.568 174.093 -0.525 1
1 1522 . 2 1 1 A 127 127 GLY CA C 127 45.846 44.972 0.874 1
1 1523 . 2 1 1 A 127 127 GLY N N 127 110.073 109.500 0.573 1
1 1524 . 2 1 1 A 128 128 GLN H H 128 7.514 7.877 -0.363 1
1 1525 . 2 1 1 A 128 128 GLN HA H 128 4.496 4.371 0.125 1
1 1532 . 2 1 1 A 128 128 GLN C C 128 174.790 174.976 -0.186 1
1 1533 . 2 1 1 A 128 128 GLN CA C 128 54.948 55.036 -0.088 1
1 1534 . 2 1 1 A 128 128 GLN CB C 128 29.181 29.888 -0.707 1
1 1536 . 2 1 1 A 128 128 GLN N N 128 117.842 120.237 -2.395 1
1 1538 . 2 1 1 A 129 129 ASN H H 129 8.689 8.671 0.018 1
1 1539 . 2 1 1 A 129 129 ASN HA H 129 4.857 4.948 -0.091 1
1 1544 . 2 1 1 A 129 129 ASN C C 129 174.325 174.927 -0.602 1
1 1545 . 2 1 1 A 129 129 ASN CA C 129 52.568 52.437 0.131 1
1 1546 . 2 1 1 A 129 129 ASN CB C 129 38.035 39.720 -1.685 1
1 1547 . 2 1 1 A 129 129 ASN N N 129 122.739 124.259 -1.520 1
1 1549 . 2 1 1 A 130 130 LEU H H 130 8.742 8.331 0.411 1
1 1550 . 2 1 1 A 130 130 LEU HA H 130 4.918 4.954 -0.036 1
1 1560 . 2 1 1 A 130 130 LEU C C 130 176.095 175.479 0.616 1
1 1561 . 2 1 1 A 130 130 LEU CA C 130 53.691 53.347 0.344 1
1 1562 . 2 1 1 A 130 130 LEU CB C 130 46.814 45.723 1.091 1
1 1566 . 2 1 1 A 130 130 LEU N N 130 121.242 121.572 -0.330 1
1 1567 . 2 1 1 A 131 131 LYS H H 131 8.809 8.661 0.148 1
1 1568 . 2 1 1 A 131 131 LYS HA H 131 4.918 4.909 0.009 1
1 1577 . 2 1 1 A 131 131 LYS C C 131 175.508 175.162 0.346 1
1 1578 . 2 1 1 A 131 131 LYS CA C 131 55.333 54.374 0.959 1
1 1579 . 2 1 1 A 131 131 LYS CB C 131 33.962 34.929 -0.967 1
1 1583 . 2 1 1 A 131 131 LYS N N 131 122.071 119.993 2.078 1
1 1584 . 2 1 1 A 132 132 PHE H H 132 9.436 9.374 0.062 1
1 1585 . 2 1 1 A 132 132 PHE HA H 132 5.427 5.452 -0.025 1
1 1593 . 2 1 1 A 132 132 PHE C C 132 175.715 174.577 1.138 1
1 1594 . 2 1 1 A 132 132 PHE CA C 132 56.665 56.497 0.168 1
1 1595 . 2 1 1 A 132 132 PHE CB C 132 42.263 42.526 -0.263 1
1 1599 . 2 1 1 A 132 132 PHE N N 132 125.247 122.062 3.185 1
1 1600 . 2 1 1 A 133 133 ASN H H 133 8.680 9.223 -0.543 1
1 1601 . 2 1 1 A 133 133 ASN HA H 133 5.249 5.331 -0.082 1
1 1606 . 2 1 1 A 133 133 ASN C C 133 174.433 174.161 0.272 1
1 1607 . 2 1 1 A 133 133 ASN CA C 133 53.952 52.823 1.129 1
1 1608 . 2 1 1 A 133 133 ASN CB C 133 41.492 39.420 2.072 1
1 1609 . 2 1 1 A 133 133 ASN N N 133 122.056 121.772 0.284 1
1 1611 . 2 1 1 A 134 134 VAL H H 134 8.762 8.738 0.024 1
1 1612 . 2 1 1 A 134 134 VAL HA H 134 4.805 4.739 0.066 1
1 1620 . 2 1 1 A 134 134 VAL C C 134 173.555 175.013 -1.458 1
1 1621 . 2 1 1 A 134 134 VAL CA C 134 60.374 61.136 -0.762 1
1 1622 . 2 1 1 A 134 134 VAL CB C 134 34.848 33.268 1.580 1
1 1625 . 2 1 1 A 134 134 VAL N N 134 122.014 125.588 -3.574 1
1 1626 . 2 1 1 A 135 135 GLU H H 135 8.869 9.820 -0.951 1
1 1627 . 2 1 1 A 135 135 GLU HA H 135 5.240 4.978 0.262 1
1 1632 . 2 1 1 A 135 135 GLU C C 135 175.578 175.071 0.507 1
1 1633 . 2 1 1 A 135 135 GLU CA C 135 54.376 55.292 -0.916 1
1 1634 . 2 1 1 A 135 135 GLU CB C 135 33.264 30.880 2.384 1
1 1636 . 2 1 1 A 135 135 GLU N N 135 125.197 126.608 -1.411 1
1 1637 . 2 1 1 A 136 136 VAL H H 136 8.270 8.487 -0.217 1
1 1638 . 2 1 1 A 136 136 VAL HA H 136 4.066 4.291 -0.225 1
1 1646 . 2 1 1 A 136 136 VAL C C 136 176.119 175.648 0.471 1
1 1647 . 2 1 1 A 136 136 VAL CA C 136 62.910 62.816 0.094 1
1 1648 . 2 1 1 A 136 136 VAL CB C 136 30.573 32.110 -1.537 1
1 1651 . 2 1 1 A 136 136 VAL N N 136 126.347 127.819 -1.472 1
1 1652 . 2 1 1 A 137 137 VAL H H 137 8.865 8.505 0.360 1
1 1653 . 2 1 1 A 137 137 VAL HA H 137 4.022 3.961 0.061 1
1 1661 . 2 1 1 A 137 137 VAL C C 137 175.208 176.122 -0.914 1
1 1662 . 2 1 1 A 137 137 VAL CA C 137 64.424 64.544 -0.120 1
1 1663 . 2 1 1 A 137 137 VAL CB C 137 32.943 32.289 0.654 1
1 1666 . 2 1 1 A 137 137 VAL N N 137 130.810 130.707 0.103 1
1 1667 . 2 1 1 A 138 138 ALA H H 138 7.677 7.671 0.006 1
1 1668 . 2 1 1 A 138 138 ALA HA H 138 4.496 4.684 -0.188 1
1 1672 . 2 1 1 A 138 138 ALA C C 138 174.405 175.168 -0.763 1
1 1673 . 2 1 1 A 138 138 ALA CA C 138 52.556 51.737 0.819 1
1 1674 . 2 1 1 A 138 138 ALA CB C 138 21.874 22.654 -0.780 1
1 1675 . 2 1 1 A 138 138 ALA N N 138 119.194 117.668 1.526 1
1 1676 . 2 1 1 A 139 139 ILE H H 139 8.052 8.542 -0.490 1
1 1677 . 2 1 1 A 139 139 ILE HA H 139 4.640 4.877 -0.237 1
1 1687 . 2 1 1 A 139 139 ILE C C 139 173.734 174.454 -0.720 1
1 1688 . 2 1 1 A 139 139 ILE CA C 139 61.623 59.970 1.653 1
1 1689 . 2 1 1 A 139 139 ILE CB C 139 43.363 41.582 1.781 1
1 1693 . 2 1 1 A 139 139 ILE N N 139 119.307 120.160 -0.853 1
1 1694 . 2 1 1 A 140 140 ARG H H 140 8.912 9.340 -0.428 1
1 1695 . 2 1 1 A 140 140 ARG HA H 140 4.760 5.162 -0.402 1
1 1702 . 2 1 1 A 140 140 ARG C C 140 174.181 175.248 -1.067 1
1 1703 . 2 1 1 A 140 140 ARG CA C 140 54.243 54.108 0.135 1
1 1704 . 2 1 1 A 140 140 ARG CB C 140 33.438 33.917 -0.479 1
1 1707 . 2 1 1 A 140 140 ARG N N 140 122.820 127.759 -4.939 1
1 1708 . 2 1 1 A 141 141 GLU H H 141 8.545 8.606 -0.061 1
1 1709 . 2 1 1 A 141 141 GLU HA H 141 4.254 4.386 -0.132 1
1 1714 . 2 1 1 A 141 141 GLU C C 141 177.299 176.049 1.250 1
1 1715 . 2 1 1 A 141 141 GLU CA C 141 57.165 56.560 0.605 1
1 1716 . 2 1 1 A 141 141 GLU CB C 141 30.048 29.827 0.221 1
1 1718 . 2 1 1 A 141 141 GLU N N 141 119.458 123.726 -4.268 1
1 1719 . 2 1 1 A 142 142 ALA H H 142 8.380 8.504 -0.124 1
1 1720 . 2 1 1 A 142 142 ALA HA H 142 4.388 4.477 -0.089 1
1 1724 . 2 1 1 A 142 142 ALA C C 142 178.495 178.636 -0.141 1
1 1725 . 2 1 1 A 142 142 ALA CA C 142 51.113 52.188 -1.075 1
1 1726 . 2 1 1 A 142 142 ALA CB C 142 21.044 19.966 1.078 1
1 1727 . 2 1 1 A 142 142 ALA N N 142 127.330 127.731 -0.401 1
1 1728 . 2 1 1 A 143 143 THR H H 143 9.502 9.022 0.480 1
1 1729 . 2 1 1 A 143 143 THR HA H 143 4.362 4.753 -0.391 1
1 1734 . 2 1 1 A 143 143 THR C C 143 175.241 174.887 0.354 1
1 1735 . 2 1 1 A 143 143 THR CA C 143 60.541 60.723 -0.182 1
1 1736 . 2 1 1 A 143 143 THR CB C 143 70.879 68.559 2.320 1
1 1738 . 2 1 1 A 143 143 THR N N 143 114.561 110.812 3.749 1
1 1739 . 2 1 1 A 144 144 GLU H H 144 8.787 8.201 0.586 1
1 1740 . 2 1 1 A 144 144 GLU HA H 144 3.817 3.864 -0.047 1
1 1745 . 2 1 1 A 144 144 GLU C C 144 179.490 176.787 2.703 1
1 1746 . 2 1 1 A 144 144 GLU CA C 144 60.102 58.630 1.472 1
1 1747 . 2 1 1 A 144 144 GLU CB C 144 29.338 27.388 1.950 1
1 1749 . 2 1 1 A 144 144 GLU N N 144 120.475 115.301 5.174 1
1 1750 . 2 1 1 A 145 145 GLU H H 145 8.321 8.436 -0.115 1
1 1751 . 2 1 1 A 145 145 GLU HA H 145 3.899 3.747 0.152 1
1 1756 . 2 1 1 A 145 145 GLU C C 145 178.521 178.911 -0.390 1
1 1757 . 2 1 1 A 145 145 GLU CA C 145 59.588 59.151 0.437 1
1 1758 . 2 1 1 A 145 145 GLU CB C 145 29.658 29.202 0.456 1
1 1760 . 2 1 1 A 145 145 GLU N N 145 119.761 118.767 0.994 1
1 1761 . 2 1 1 A 146 146 GLU H H 146 7.514 8.005 -0.491 1
1 1762 . 2 1 1 A 146 146 GLU HA H 146 3.856 3.979 -0.123 1
1 1767 . 2 1 1 A 146 146 GLU C C 146 179.189 179.289 -0.100 1
1 1768 . 2 1 1 A 146 146 GLU CA C 146 59.148 59.139 0.009 1
1 1769 . 2 1 1 A 146 146 GLU CB C 146 29.834 29.268 0.566 1
1 1771 . 2 1 1 A 146 146 GLU N N 146 121.118 119.186 1.932 1
1 1772 . 2 1 1 A 147 147 LEU H H 147 7.823 8.135 -0.312 1
1 1773 . 2 1 1 A 147 147 LEU HA H 147 3.662 3.848 -0.186 1
1 1783 . 2 1 1 A 147 147 LEU C C 147 179.341 178.668 0.673 1
1 1784 . 2 1 1 A 147 147 LEU CA C 147 57.277 57.678 -0.401 1
1 1785 . 2 1 1 A 147 147 LEU CB C 147 41.239 41.591 -0.352 1
1 1789 . 2 1 1 A 147 147 LEU N N 147 117.199 120.258 -3.059 1
1 1790 . 2 1 1 A 148 148 ALA H H 148 7.788 8.629 -0.841 1
1 1791 . 2 1 1 A 148 148 ALA HA H 148 3.958 4.041 -0.083 1
1 1795 . 2 1 1 A 148 148 ALA C C 148 179.777 178.957 0.820 1
1 1796 . 2 1 1 A 148 148 ALA CA C 148 54.509 54.900 -0.391 1
1 1797 . 2 1 1 A 148 148 ALA CB C 148 18.064 18.372 -0.308 1
1 1798 . 2 1 1 A 148 148 ALA N N 148 121.696 119.807 1.889 1
1 1799 . 2 1 1 A 149 149 HIS H H 149 7.726 7.465 0.261 1
1 1800 . 2 1 1 A 149 149 HIS HA H 149 4.477 4.634 -0.157 1
1 1805 . 2 1 1 A 149 149 HIS C C 149 176.099 175.266 0.833 1
1 1806 . 2 1 1 A 149 149 HIS CA C 149 55.802 55.895 -0.093 1
1 1807 . 2 1 1 A 149 149 HIS CB C 149 30.406 29.886 0.520 1
1 1810 . 2 1 1 A 149 149 HIS N N 149 114.463 112.450 2.013 1
1 1811 . 2 1 1 A 150 150 GLY H H 150 8.076 9.314 -1.238 1
1 1812 . 2 1 1 A 150 150 GLY HA2 H 150 3.927 3.746 0.181 1
1 1813 . 2 1 1 A 150 150 GLY HA3 H 150 3.237 3.840 -0.603 1
1 1814 . 2 1 1 A 150 150 GLY C C 150 173.382 173.500 -0.118 1
1 1815 . 2 1 1 A 150 150 GLY CA C 150 46.117 45.718 0.399 1
1 1816 . 2 1 1 A 150 150 GLY N N 150 109.417 108.926 0.491 1
1 1817 . 2 1 1 A 151 151 HIS H H 151 7.518 7.361 0.157 1
1 1818 . 2 1 1 A 151 151 HIS HA H 151 4.563 4.813 -0.250 1
1 1823 . 2 1 1 A 151 151 HIS C C 151 173.157 174.562 -1.405 1
1 1824 . 2 1 1 A 151 151 HIS CA C 151 54.731 54.843 -0.112 1
1 1825 . 2 1 1 A 151 151 HIS CB C 151 31.611 31.563 0.048 1
1 1828 . 2 1 1 A 151 151 HIS N N 151 114.828 113.957 0.871 1
1 1829 . 2 1 1 A 152 152 VAL H H 152 7.931 9.049 -1.118 1
1 1830 . 2 1 1 A 152 152 VAL HA H 152 3.951 3.531 0.420 1
1 1838 . 2 1 1 A 152 152 VAL C C 152 175.848 176.012 -0.164 1
1 1839 . 2 1 1 A 152 152 VAL CA C 152 62.190 66.419 -4.229 1
1 1840 . 2 1 1 A 152 152 VAL CB C 152 32.703 31.740 0.963 1
1 1843 . 2 1 1 A 152 152 VAL N N 152 118.551 120.104 -1.553 1
1 1844 . 2 1 1 A 153 153 HIS H H 153 9.784 8.021 1.763 1
1 1845 . 2 1 1 A 153 153 HIS HA H 153 4.604 4.000 0.604 1
1 1850 . 2 1 1 A 153 153 HIS C C 153 175.795 173.944 1.851 1
1 1851 . 2 1 1 A 153 153 HIS CA C 153 56.753 56.888 -0.135 1
1 1852 . 2 1 1 A 153 153 HIS CB C 153 30.325 29.131 1.194 1
1 1855 . 2 1 1 A 153 153 HIS N N 153 127.403 118.954 8.449 1
1 1856 . 2 1 1 A 154 154 GLY H H 154 8.447 7.447 1.000 1
1 1857 . 2 1 1 A 154 154 GLY HA2 H 154 3.797 3.793 0.004 1
1 1858 . 2 1 1 A 154 154 GLY HA3 H 154 3.797 3.801 -0.004 1
1 1859 . 2 1 1 A 154 154 GLY C C 154 173.848 171.302 2.546 1
1 1860 . 2 1 1 A 154 154 GLY CA C 154 45.153 45.721 -0.568 1
1 1861 . 2 1 1 A 154 154 GLY N N 154 112.233 106.705 5.528 1
1 1862 . 2 1 1 A 155 155 ALA H H 155 8.074 8.425 -0.351 1
1 1863 . 2 1 1 A 155 155 ALA HA H 155 4.101 4.552 -0.451 1
1 1867 . 2 1 1 A 155 155 ALA C C 155 177.651 175.727 1.924 1
1 1868 . 2 1 1 A 155 155 ALA CA C 155 52.795 50.735 2.060 1
1 1869 . 2 1 1 A 155 155 ALA CB C 155 19.258 22.453 -3.195 1
1 1870 . 2 1 1 A 155 155 ALA N N 155 124.092 124.190 -0.098 1
1 1871 . 2 1 1 A 156 156 HIS H H 156 8.201 8.399 -0.198 1
1 1872 . 2 1 1 A 156 156 HIS HA H 156 4.474 4.107 0.367 1
1 1875 . 2 1 1 A 156 156 HIS C C 156 174.758 174.477 0.281 1
1 1876 . 2 1 1 A 156 156 HIS CA C 156 55.756 57.005 -1.249 1
1 1877 . 2 1 1 A 156 156 HIS CB C 156 30.060 26.890 3.170 1
1 1878 . 2 1 1 A 156 156 HIS N N 156 118.170 112.975 5.195 1
1 1879 . 2 1 1 A 157 157 ASP H H 157 8.001 7.927 0.074 1
1 1880 . 2 1 1 A 157 157 ASP HA H 157 4.436 4.196 0.240 1
1 1883 . 2 1 1 A 157 157 ASP CA C 157 54.185 57.259 -3.074 1
1 1884 . 2 1 1 A 157 157 ASP CB C 157 41.016 40.669 0.347 1
1 1885 . 2 1 1 A 157 157 ASP N N 157 121.683 118.459 3.224 1
1 1886 . 2 1 1 A 160 160 HIS HA H 160 4.502 4.619 -0.117 1
1 1889 . 2 1 1 A 160 160 HIS C C 160 174.722 175.301 -0.579 1
1 1890 . 2 1 1 A 160 160 HIS CA C 160 55.979 56.347 -0.368 1
1 1891 . 2 1 1 A 160 160 HIS CB C 160 30.058 30.306 -0.248 1
1 1892 . 2 1 1 A 161 161 ASP H H 161 8.270 8.453 -0.183 1
1 1893 . 2 1 1 A 161 161 ASP HA H 161 4.446 4.691 -0.245 1
1 1896 . 2 1 1 A 161 161 ASP C C 161 176.107 175.569 0.538 1
1 1897 . 2 1 1 A 161 161 ASP CA C 161 54.474 53.430 1.044 1
1 1898 . 2 1 1 A 161 161 ASP CB C 161 40.820 41.893 -1.073 1
1 1899 . 2 1 1 A 161 161 ASP N N 161 121.957 120.469 1.488 1
1 1900 . 2 1 1 A 162 162 HIS H H 162 8.212 8.875 -0.663 1
1 1901 . 2 1 1 A 162 162 HIS HA H 162 4.289 4.862 -0.573 1
1 1904 . 2 1 1 A 162 162 HIS C C 162 175.036 174.477 0.559 1
1 1905 . 2 1 1 A 162 162 HIS CA C 162 56.185 54.734 1.451 1
1 1906 . 2 1 1 A 162 162 HIS CB C 162 30.108 30.100 0.008 1
1 1907 . 2 1 1 A 162 162 HIS N N 162 119.766 123.054 -3.288 1
1 1908 . 2 1 1 A 163 163 ASP H H 163 8.163 8.648 -0.485 1
1 1909 . 2 1 1 A 163 163 ASP HA H 163 4.428 3.975 0.453 1
1 1912 . 2 1 1 A 163 163 ASP C C 163 176.161 175.708 0.453 1
1 1913 . 2 1 1 A 163 163 ASP CA C 163 54.585 54.587 -0.002 1
1 1914 . 2 1 1 A 163 163 ASP CB C 163 40.823 39.073 1.750 1
1 1915 . 2 1 1 A 163 163 ASP N N 163 121.265 125.210 -3.945 1
1 1916 . 2 1 1 A 164 164 HIS H H 164 8.106 7.807 0.299 1
1 1917 . 2 1 1 A 164 164 HIS HA H 164 4.422 4.462 -0.040 1
1 1920 . 2 1 1 A 164 164 HIS C C 164 174.904 174.588 0.316 1
1 1921 . 2 1 1 A 164 164 HIS CA C 164 56.361 55.968 0.393 1
1 1922 . 2 1 1 A 164 164 HIS CB C 164 30.305 30.191 0.114 1
1 1923 . 2 1 1 A 164 164 HIS N N 164 119.729 115.827 3.902 1
1 1924 . 2 1 1 A 165 165 ASP H H 165 8.118 8.698 -0.580 1
1 1925 . 2 1 1 A 165 165 ASP HA H 165 4.394 4.495 -0.101 1
1 1928 . 2 1 1 A 165 165 ASP C C 165 176.054 176.115 -0.061 1
1 1929 . 2 1 1 A 165 165 ASP CA C 165 54.364 54.370 -0.006 1
1 1930 . 2 1 1 A 165 165 ASP CB C 165 40.818 41.383 -0.565 1
1 1931 . 2 1 1 A 165 165 ASP N N 165 121.062 122.974 -1.912 1
1 1932 . 2 1 1 A 166 166 HIS H H 166 8.092 8.518 -0.426 1
1 1933 . 2 1 1 A 166 166 HIS CA C 166 56.114 56.657 -0.543 1
1 1934 . 2 1 1 A 166 166 HIS CB C 166 29.702 28.159 1.543 1
1 1935 . 2 1 1 A 166 166 HIS N N 166 120.001 115.094 4.907 1
1 1936 . 2 1 1 A 170 170 HIS HA H 170 4.514 4.504 0.010 1
1 1939 . 2 1 1 A 170 170 HIS C C 170 173.952 175.017 -1.065 1
1 1940 . 2 1 1 A 170 170 HIS CA C 170 55.995 55.050 0.945 1
1 1941 . 2 1 1 A 170 170 HIS CB C 170 30.161 29.846 0.315 1
1 14 . 3 1 1 A 2 2 LYS H H 2 7.540 8.996 -1.456 1
1 15 . 3 1 1 A 2 2 LYS HA H 2 4.729 4.981 -0.252 1
1 24 . 3 1 1 A 2 2 LYS C C 2 175.948 174.995 0.953 1
1 25 . 3 1 1 A 2 2 LYS CA C 2 53.978 54.011 -0.033 1
1 26 . 3 1 1 A 2 2 LYS CB C 2 35.985 35.970 0.015 1
1 30 . 3 1 1 A 2 2 LYS N N 2 120.764 119.643 1.121 1
1 31 . 3 1 1 A 3 3 VAL H H 3 8.738 8.152 0.586 1
1 32 . 3 1 1 A 3 3 VAL HA H 3 2.800 4.218 -1.418 1
1 40 . 3 1 1 A 3 3 VAL C C 3 175.018 175.248 -0.230 1
1 41 . 3 1 1 A 3 3 VAL CA C 3 66.598 62.724 3.874 1
1 42 . 3 1 1 A 3 3 VAL CB C 3 31.218 31.913 -0.695 1
1 45 . 3 1 1 A 3 3 VAL N N 3 120.055 121.955 -1.900 1
1 46 . 3 1 1 A 4 4 ALA H H 4 6.584 8.796 -2.212 1
1 47 . 3 1 1 A 4 4 ALA HA H 4 4.223 4.724 -0.501 1
1 51 . 3 1 1 A 4 4 ALA C C 4 174.117 175.493 -1.376 1
1 52 . 3 1 1 A 4 4 ALA CA C 4 50.358 50.960 -0.602 1
1 53 . 3 1 1 A 4 4 ALA CB C 4 22.137 23.285 -1.148 1
1 54 . 3 1 1 A 4 4 ALA N N 4 129.800 130.355 -0.555 1
1 55 . 3 1 1 A 5 5 LYS H H 5 8.596 8.548 0.048 1
1 56 . 3 1 1 A 5 5 LYS HA H 5 3.793 4.184 -0.391 1
1 65 . 3 1 1 A 5 5 LYS C C 5 175.260 177.016 -1.756 1
1 66 . 3 1 1 A 5 5 LYS CA C 5 57.700 56.781 0.919 1
1 67 . 3 1 1 A 5 5 LYS CB C 5 32.400 33.122 -0.722 1
1 71 . 3 1 1 A 5 5 LYS N N 5 118.708 120.061 -1.353 1
1 72 . 3 1 1 A 6 6 ASP H H 6 8.679 8.814 -0.135 1
1 73 . 3 1 1 A 6 6 ASP HA H 6 4.040 4.435 -0.395 1
1 76 . 3 1 1 A 6 6 ASP C C 6 173.331 175.222 -1.891 1
1 77 . 3 1 1 A 6 6 ASP CA C 6 57.508 55.235 2.273 1
1 78 . 3 1 1 A 6 6 ASP CB C 6 37.604 38.778 -1.174 1
1 79 . 3 1 1 A 6 6 ASP N N 6 115.415 125.696 -10.281 1
1 80 . 3 1 1 A 7 7 LEU H H 7 7.376 7.394 -0.018 1
1 81 . 3 1 1 A 7 7 LEU HA H 7 4.689 4.321 0.368 1
1 91 . 3 1 1 A 7 7 LEU C C 7 175.906 175.925 -0.019 1
1 92 . 3 1 1 A 7 7 LEU CA C 7 53.509 53.695 -0.186 1
1 93 . 3 1 1 A 7 7 LEU CB C 7 42.419 41.979 0.440 1
1 97 . 3 1 1 A 7 7 LEU N N 7 117.619 121.724 -4.105 1
1 98 . 3 1 1 A 8 8 VAL H H 8 8.646 8.462 0.184 1
1 99 . 3 1 1 A 8 8 VAL HA H 8 4.397 3.862 0.535 1
1 107 . 3 1 1 A 8 8 VAL C C 8 175.244 174.854 0.390 1
1 108 . 3 1 1 A 8 8 VAL CA C 8 62.028 62.925 -0.897 1
1 109 . 3 1 1 A 8 8 VAL CB C 8 31.515 32.078 -0.563 1
1 112 . 3 1 1 A 8 8 VAL N N 8 121.164 127.114 -5.950 1
1 113 . 3 1 1 A 9 9 VAL H H 9 8.607 8.127 0.480 1
1 114 . 3 1 1 A 9 9 VAL HA H 9 4.281 4.729 -0.448 1
1 122 . 3 1 1 A 9 9 VAL C C 9 174.156 174.537 -0.381 1
1 123 . 3 1 1 A 9 9 VAL CA C 9 60.614 60.424 0.190 1
1 124 . 3 1 1 A 9 9 VAL CB C 9 33.985 35.901 -1.916 1
1 127 . 3 1 1 A 9 9 VAL N N 9 134.014 128.885 5.129 1
1 128 . 3 1 1 A 10 10 SER H H 10 8.684 8.948 -0.264 1
1 129 . 3 1 1 A 10 10 SER HA H 10 5.736 5.921 -0.185 1
1 132 . 3 1 1 A 10 10 SER C C 10 173.544 173.389 0.155 1
1 133 . 3 1 1 A 10 10 SER CA C 10 56.533 57.146 -0.613 1
1 134 . 3 1 1 A 10 10 SER CB C 10 63.385 66.247 -2.862 1
1 135 . 3 1 1 A 10 10 SER N N 10 121.492 123.872 -2.380 1
1 136 . 3 1 1 A 11 11 LEU H H 11 9.939 8.873 1.066 1
1 137 . 3 1 1 A 11 11 LEU HA H 11 5.133 4.998 0.135 1
1 147 . 3 1 1 A 11 11 LEU C C 11 174.843 174.432 0.411 1
1 148 . 3 1 1 A 11 11 LEU CA C 11 53.770 54.139 -0.369 1
1 149 . 3 1 1 A 11 11 LEU CB C 11 47.469 45.608 1.861 1
1 153 . 3 1 1 A 11 11 LEU N N 11 128.460 119.386 9.074 1
1 154 . 3 1 1 A 12 12 ALA H H 12 8.770 9.359 -0.589 1
1 155 . 3 1 1 A 12 12 ALA HA H 12 4.830 5.218 -0.388 1
1 159 . 3 1 1 A 12 12 ALA C C 12 176.974 175.694 1.280 1
1 160 . 3 1 1 A 12 12 ALA CA C 12 50.231 50.555 -0.324 1
1 161 . 3 1 1 A 12 12 ALA CB C 12 21.270 20.909 0.361 1
1 162 . 3 1 1 A 12 12 ALA N N 12 127.500 122.002 5.498 1
1 163 . 3 1 1 A 13 13 TYR H H 13 8.749 8.741 0.008 1
1 164 . 3 1 1 A 13 13 TYR HA H 13 5.797 6.168 -0.371 1
1 171 . 3 1 1 A 13 13 TYR C C 13 173.952 172.854 1.098 1
1 172 . 3 1 1 A 13 13 TYR CA C 13 56.390 55.015 1.375 1
1 173 . 3 1 1 A 13 13 TYR CB C 13 41.159 41.911 -0.752 1
1 176 . 3 1 1 A 13 13 TYR N N 13 117.737 119.747 -2.010 1
1 177 . 3 1 1 A 14 14 GLN H H 14 8.492 8.852 -0.360 1
1 178 . 3 1 1 A 14 14 GLN HA H 14 4.611 5.099 -0.488 1
1 185 . 3 1 1 A 14 14 GLN C C 14 174.492 173.748 0.744 1
1 186 . 3 1 1 A 14 14 GLN CA C 14 55.626 54.397 1.229 1
1 187 . 3 1 1 A 14 14 GLN CB C 14 32.734 31.688 1.046 1
1 189 . 3 1 1 A 14 14 GLN N N 14 116.962 120.128 -3.166 1
1 191 . 3 1 1 A 15 15 VAL H H 15 8.403 8.897 -0.494 1
1 192 . 3 1 1 A 15 15 VAL HA H 15 4.614 4.966 -0.352 1
1 200 . 3 1 1 A 15 15 VAL C C 15 173.389 174.727 -1.338 1
1 201 . 3 1 1 A 15 15 VAL CA C 15 59.711 60.411 -0.700 1
1 202 . 3 1 1 A 15 15 VAL CB C 15 33.639 34.046 -0.407 1
1 205 . 3 1 1 A 15 15 VAL N N 15 121.203 126.951 -5.748 1
1 206 . 3 1 1 A 16 16 ARG H H 16 8.584 9.245 -0.661 1
1 207 . 3 1 1 A 16 16 ARG HA H 16 5.584 5.101 0.483 1
1 214 . 3 1 1 A 16 16 ARG C C 16 176.585 175.079 1.506 1
1 215 . 3 1 1 A 16 16 ARG CA C 16 53.453 53.886 -0.433 1
1 216 . 3 1 1 A 16 16 ARG CB C 16 34.968 34.020 0.948 1
1 219 . 3 1 1 A 16 16 ARG N N 16 126.883 130.160 -3.277 1
1 220 . 3 1 1 A 17 17 THR H H 17 8.270 8.735 -0.465 1
1 221 . 3 1 1 A 17 17 THR HA H 17 4.573 4.521 0.052 1
1 226 . 3 1 1 A 17 17 THR C C 17 177.860 176.302 1.558 1
1 227 . 3 1 1 A 17 17 THR CA C 17 61.073 60.871 0.202 1
1 228 . 3 1 1 A 17 17 THR CB C 17 69.823 71.182 -1.359 1
1 230 . 3 1 1 A 17 17 THR N N 17 109.730 114.721 -4.991 1
1 231 . 3 1 1 A 18 18 GLU H H 18 9.147 8.922 0.225 1
1 232 . 3 1 1 A 18 18 GLU HA H 18 3.770 4.023 -0.253 1
1 237 . 3 1 1 A 18 18 GLU C C 18 176.683 177.305 -0.622 1
1 238 . 3 1 1 A 18 18 GLU CA C 18 59.866 58.938 0.928 1
1 239 . 3 1 1 A 18 18 GLU CB C 18 29.752 29.217 0.535 1
1 241 . 3 1 1 A 18 18 GLU N N 18 122.491 121.084 1.407 1
1 242 . 3 1 1 A 19 19 ASP H H 19 7.900 7.993 -0.093 1
1 243 . 3 1 1 A 19 19 ASP HA H 19 4.456 4.622 -0.166 1
1 246 . 3 1 1 A 19 19 ASP C C 19 176.670 176.422 0.248 1
1 247 . 3 1 1 A 19 19 ASP CA C 19 53.833 54.046 -0.213 1
1 248 . 3 1 1 A 19 19 ASP CB C 19 40.180 41.533 -1.353 1
1 249 . 3 1 1 A 19 19 ASP N N 19 116.200 117.236 -1.036 1
1 250 . 3 1 1 A 20 20 GLY H H 20 8.149 7.787 0.362 1
1 251 . 3 1 1 A 20 20 GLY HA2 H 20 4.145 3.996 0.149 1
1 252 . 3 1 1 A 20 20 GLY HA3 H 20 3.531 4.003 -0.472 1
1 253 . 3 1 1 A 20 20 GLY C C 20 173.987 174.234 -0.247 1
1 254 . 3 1 1 A 20 20 GLY CA C 20 45.463 45.307 0.156 1
1 255 . 3 1 1 A 20 20 GLY N N 20 108.869 105.996 2.873 1
1 256 . 3 1 1 A 21 21 VAL H H 21 7.261 7.469 -0.208 1
1 257 . 3 1 1 A 21 21 VAL HA H 21 3.645 4.442 -0.797 1
1 265 . 3 1 1 A 21 21 VAL C C 21 175.265 174.472 0.793 1
1 266 . 3 1 1 A 21 21 VAL CA C 21 63.368 60.292 3.076 1
1 267 . 3 1 1 A 21 21 VAL CB C 21 31.614 33.853 -2.239 1
1 270 . 3 1 1 A 21 21 VAL N N 21 124.283 120.684 3.599 1
1 271 . 3 1 1 A 22 22 LEU H H 22 8.407 8.807 -0.400 1
1 272 . 3 1 1 A 22 22 LEU HA H 22 4.333 4.593 -0.260 1
1 282 . 3 1 1 A 22 22 LEU C C 22 176.660 176.427 0.233 1
1 283 . 3 1 1 A 22 22 LEU CA C 22 55.724 54.224 1.500 1
1 284 . 3 1 1 A 22 22 LEU CB C 22 42.272 43.088 -0.816 1
1 288 . 3 1 1 A 22 22 LEU N N 22 128.533 129.372 -0.839 1
1 289 . 3 1 1 A 23 23 VAL H H 23 8.887 8.655 0.232 1
1 290 . 3 1 1 A 23 23 VAL HA H 23 4.237 4.309 -0.072 1
1 298 . 3 1 1 A 23 23 VAL C C 23 175.265 175.493 -0.228 1
1 299 . 3 1 1 A 23 23 VAL CA C 23 62.348 62.180 0.168 1
1 300 . 3 1 1 A 23 23 VAL CB C 23 33.383 32.997 0.386 1
1 303 . 3 1 1 A 23 23 VAL N N 23 125.041 121.859 3.182 1
1 304 . 3 1 1 A 24 24 ASP H H 24 7.480 7.249 0.231 1
1 305 . 3 1 1 A 24 24 ASP HA H 24 4.763 4.967 -0.204 1
1 308 . 3 1 1 A 24 24 ASP C C 24 173.160 173.770 -0.610 1
1 309 . 3 1 1 A 24 24 ASP CA C 24 53.893 53.500 0.393 1
1 310 . 3 1 1 A 24 24 ASP CB C 24 43.680 44.139 -0.459 1
1 311 . 3 1 1 A 24 24 ASP N N 24 117.159 120.108 -2.949 1
1 312 . 3 1 1 A 25 25 GLU H H 25 8.187 8.654 -0.467 1
1 313 . 3 1 1 A 25 25 GLU HA H 25 4.491 4.572 -0.081 1
1 318 . 3 1 1 A 25 25 GLU C C 25 174.586 173.949 0.637 1
1 319 . 3 1 1 A 25 25 GLU CA C 25 55.475 56.007 -0.532 1
1 320 . 3 1 1 A 25 25 GLU CB C 25 33.033 34.280 -1.247 1
1 322 . 3 1 1 A 25 25 GLU N N 25 118.821 123.023 -4.202 1
1 323 . 3 1 1 A 26 26 SER H H 26 8.003 8.574 -0.571 1
1 324 . 3 1 1 A 26 26 SER HA H 26 4.782 4.878 -0.096 1
1 327 . 3 1 1 A 26 26 SER CA C 26 56.490 55.360 1.130 1
1 328 . 3 1 1 A 26 26 SER CB C 26 64.977 63.903 1.074 1
1 329 . 3 1 1 A 26 26 SER N N 26 119.346 123.886 -4.540 1
1 330 . 3 1 1 A 27 27 PRO HA H 27 4.633 4.576 0.057 1
1 337 . 3 1 1 A 27 27 PRO C C 27 177.016 177.400 -0.384 1
1 338 . 3 1 1 A 27 27 PRO CA C 27 61.943 62.698 -0.755 1
1 339 . 3 1 1 A 27 27 PRO CB C 27 32.492 32.846 -0.354 1
1 342 . 3 1 1 A 28 28 VAL H H 28 8.383 8.636 -0.253 1
1 343 . 3 1 1 A 28 28 VAL HA H 28 3.385 3.792 -0.407 1
1 351 . 3 1 1 A 28 28 VAL C C 28 176.069 177.077 -1.008 1
1 352 . 3 1 1 A 28 28 VAL CA C 28 65.888 65.084 0.804 1
1 353 . 3 1 1 A 28 28 VAL CB C 28 31.220 31.702 -0.482 1
1 356 . 3 1 1 A 28 28 VAL N N 28 119.349 122.254 -2.905 1
1 357 . 3 1 1 A 29 29 SER H H 29 7.365 7.750 -0.385 1
1 358 . 3 1 1 A 29 29 SER HA H 29 4.101 4.342 -0.241 1
1 361 . 3 1 1 A 29 29 SER C C 29 174.535 174.695 -0.160 1
1 362 . 3 1 1 A 29 29 SER CA C 29 58.609 60.127 -1.518 1
1 363 . 3 1 1 A 29 29 SER CB C 29 63.198 63.571 -0.373 1
1 364 . 3 1 1 A 29 29 SER N N 29 109.365 114.171 -4.806 1
1 365 . 3 1 1 A 30 30 ALA H H 30 7.457 7.738 -0.281 1
1 366 . 3 1 1 A 30 30 ALA HA H 30 4.548 4.710 -0.162 1
1 370 . 3 1 1 A 30 30 ALA CA C 30 50.789 49.399 1.390 1
1 371 . 3 1 1 A 30 30 ALA CB C 30 18.608 21.265 -2.657 1
1 372 . 3 1 1 A 30 30 ALA N N 30 126.056 122.413 3.643 1
1 373 . 3 1 1 A 31 31 PRO HA H 31 4.332 4.664 -0.332 1
1 380 . 3 1 1 A 31 31 PRO C C 31 175.841 176.419 -0.578 1
1 381 . 3 1 1 A 31 31 PRO CA C 31 62.996 62.449 0.547 1
1 382 . 3 1 1 A 31 31 PRO CB C 31 32.696 32.649 0.047 1
1 385 . 3 1 1 A 32 32 LEU H H 32 8.717 9.239 -0.522 1
1 386 . 3 1 1 A 32 32 LEU HA H 32 4.452 4.583 -0.131 1
1 396 . 3 1 1 A 32 32 LEU C C 32 175.298 174.871 0.427 1
1 397 . 3 1 1 A 32 32 LEU CA C 32 54.510 55.773 -1.263 1
1 398 . 3 1 1 A 32 32 LEU CB C 32 43.899 42.953 0.946 1
1 402 . 3 1 1 A 32 32 LEU N N 32 123.702 122.854 0.848 1
1 403 . 3 1 1 A 33 33 ASP H H 33 8.258 8.910 -0.652 1
1 404 . 3 1 1 A 33 33 ASP HA H 33 5.919 5.706 0.213 1
1 407 . 3 1 1 A 33 33 ASP C C 33 175.927 174.776 1.151 1
1 408 . 3 1 1 A 33 33 ASP CA C 33 52.619 53.125 -0.506 1
1 409 . 3 1 1 A 33 33 ASP CB C 33 42.205 43.693 -1.488 1
1 410 . 3 1 1 A 33 33 ASP N N 33 128.453 125.796 2.657 1
1 411 . 3 1 1 A 34 34 TYR H H 34 9.144 8.377 0.767 1
1 412 . 3 1 1 A 34 34 TYR HA H 34 4.689 5.195 -0.506 1
1 419 . 3 1 1 A 34 34 TYR C C 34 170.622 172.293 -1.671 1
1 420 . 3 1 1 A 34 34 TYR CA C 34 55.930 56.164 -0.234 1
1 421 . 3 1 1 A 34 34 TYR CB C 34 41.905 40.407 1.498 1
1 424 . 3 1 1 A 34 34 TYR N N 34 121.657 119.689 1.968 1
1 425 . 3 1 1 A 35 35 LEU H H 35 8.324 8.607 -0.283 1
1 426 . 3 1 1 A 35 35 LEU HA H 35 4.396 4.808 -0.412 1
1 436 . 3 1 1 A 35 35 LEU C C 35 175.301 176.157 -0.856 1
1 437 . 3 1 1 A 35 35 LEU CA C 35 52.909 53.144 -0.235 1
1 438 . 3 1 1 A 35 35 LEU CB C 35 42.816 44.059 -1.243 1
1 442 . 3 1 1 A 35 35 LEU N N 35 124.514 123.029 1.485 1
1 443 . 3 1 1 A 36 36 HIS H H 36 8.763 8.403 0.360 1
1 444 . 3 1 1 A 36 36 HIS HA H 36 4.382 4.751 -0.369 1
1 449 . 3 1 1 A 36 36 HIS C C 36 176.514 176.491 0.023 1
1 450 . 3 1 1 A 36 36 HIS CA C 36 59.570 57.858 1.712 1
1 451 . 3 1 1 A 36 36 HIS CB C 36 31.257 29.607 1.650 1
1 454 . 3 1 1 A 36 36 HIS N N 36 132.209 126.381 5.828 1
1 455 . 3 1 1 A 37 37 GLY H H 37 8.745 9.184 -0.439 1
1 456 . 3 1 1 A 37 37 GLY HA2 H 37 4.021 3.751 0.270 1
1 457 . 3 1 1 A 37 37 GLY HA3 H 37 3.592 3.891 -0.299 1
1 458 . 3 1 1 A 37 37 GLY C C 37 175.081 174.875 0.206 1
1 459 . 3 1 1 A 37 37 GLY CA C 37 45.621 46.121 -0.500 1
1 460 . 3 1 1 A 37 37 GLY N N 37 117.737 114.793 2.944 1
1 461 . 3 1 1 A 38 38 HIS H H 38 8.470 8.307 0.163 1
1 462 . 3 1 1 A 38 38 HIS HA H 38 4.584 4.714 -0.130 1
1 467 . 3 1 1 A 38 38 HIS C C 38 175.334 175.049 0.285 1
1 468 . 3 1 1 A 38 38 HIS CA C 38 55.899 55.962 -0.063 1
1 469 . 3 1 1 A 38 38 HIS CB C 38 30.865 30.764 0.101 1
1 472 . 3 1 1 A 38 38 HIS N N 38 119.813 117.820 1.993 1
1 473 . 3 1 1 A 39 39 GLY H H 39 8.936 7.876 1.060 1
1 474 . 3 1 1 A 39 39 GLY HA2 H 39 3.895 3.776 0.119 1
1 475 . 3 1 1 A 39 39 GLY HA3 H 39 3.895 3.806 0.089 1
1 476 . 3 1 1 A 39 39 GLY C C 39 175.557 175.029 0.528 1
1 477 . 3 1 1 A 39 39 GLY CA C 39 46.938 46.773 0.165 1
1 478 . 3 1 1 A 39 39 GLY N N 39 112.442 108.941 3.501 1
1 479 . 3 1 1 A 40 40 SER H H 40 9.249 7.742 1.507 1
1 480 . 3 1 1 A 40 40 SER HA H 40 4.299 4.235 0.064 1
1 483 . 3 1 1 A 40 40 SER C C 40 174.138 174.695 -0.557 1
1 484 . 3 1 1 A 40 40 SER CA C 40 60.809 62.287 -1.478 1
1 485 . 3 1 1 A 40 40 SER CB C 40 64.041 63.744 0.297 1
1 486 . 3 1 1 A 40 40 SER N N 40 117.098 113.787 3.311 1
1 487 . 3 1 1 A 41 41 LEU H H 41 7.386 6.778 0.608 1
1 488 . 3 1 1 A 41 41 LEU HA H 41 4.429 4.791 -0.362 1
1 498 . 3 1 1 A 41 41 LEU C C 41 176.526 175.431 1.095 1
1 499 . 3 1 1 A 41 41 LEU CA C 41 52.295 53.111 -0.816 1
1 500 . 3 1 1 A 41 41 LEU CB C 41 44.147 45.150 -1.003 1
1 504 . 3 1 1 A 41 41 LEU N N 41 120.541 114.758 5.783 1
1 505 . 3 1 1 A 42 42 ILE H H 42 7.407 8.012 -0.605 1
1 506 . 3 1 1 A 42 42 ILE HA H 42 3.756 3.880 -0.124 1
1 516 . 3 1 1 A 42 42 ILE C C 42 178.081 176.975 1.106 1
1 517 . 3 1 1 A 42 42 ILE CA C 42 62.257 61.478 0.779 1
1 518 . 3 1 1 A 42 42 ILE CB C 42 38.256 38.038 0.218 1
1 522 . 3 1 1 A 42 42 ILE N N 42 115.050 116.592 -1.542 1
1 523 . 3 1 1 A 43 43 SER H H 43 8.581 8.775 -0.194 1
1 524 . 3 1 1 A 43 43 SER HA H 43 3.957 3.981 -0.024 1
1 527 . 3 1 1 A 43 43 SER C C 43 177.830 176.596 1.234 1
1 528 . 3 1 1 A 43 43 SER CA C 43 61.958 62.334 -0.376 1
1 529 . 3 1 1 A 43 43 SER CB C 43 62.680 62.388 0.292 1
1 530 . 3 1 1 A 43 43 SER N N 43 121.456 119.748 1.708 1
1 531 . 3 1 1 A 44 44 GLY H H 44 8.892 8.116 0.776 1
1 532 . 3 1 1 A 44 44 GLY HA2 H 44 3.514 3.799 -0.285 1
1 533 . 3 1 1 A 44 44 GLY HA3 H 44 3.854 3.810 0.044 1
1 534 . 3 1 1 A 44 44 GLY C C 44 175.296 175.400 -0.104 1
1 535 . 3 1 1 A 44 44 GLY CA C 44 46.854 47.239 -0.385 1
1 536 . 3 1 1 A 44 44 GLY N N 44 106.351 109.053 -2.702 1
1 537 . 3 1 1 A 45 45 LEU H H 45 6.824 7.522 -0.698 1
1 538 . 3 1 1 A 45 45 LEU HA H 45 3.909 3.940 -0.031 1
1 548 . 3 1 1 A 45 45 LEU C C 45 176.738 178.450 -1.712 1
1 549 . 3 1 1 A 45 45 LEU CA C 45 56.356 56.960 -0.604 1
1 550 . 3 1 1 A 45 45 LEU CB C 45 42.296 41.059 1.237 1
1 554 . 3 1 1 A 45 45 LEU N N 45 119.207 122.947 -3.740 1
1 555 . 3 1 1 A 46 46 GLU H H 46 7.556 7.866 -0.310 1
1 556 . 3 1 1 A 46 46 GLU HA H 46 3.664 4.060 -0.396 1
1 561 . 3 1 1 A 46 46 GLU C C 46 179.231 179.492 -0.261 1
1 562 . 3 1 1 A 46 46 GLU CA C 46 62.316 59.650 2.666 1
1 563 . 3 1 1 A 46 46 GLU CB C 46 29.147 29.053 0.094 1
1 565 . 3 1 1 A 46 46 GLU N N 46 119.049 118.244 0.805 1
1 566 . 3 1 1 A 47 47 THR H H 47 8.219 8.195 0.024 1
1 567 . 3 1 1 A 47 47 THR HA H 47 3.965 3.955 0.010 1
1 572 . 3 1 1 A 47 47 THR C C 47 176.251 176.545 -0.294 1
1 573 . 3 1 1 A 47 47 THR CA C 47 65.947 66.005 -0.058 1
1 574 . 3 1 1 A 47 47 THR CB C 47 69.014 68.349 0.665 1
1 576 . 3 1 1 A 47 47 THR N N 47 111.770 117.177 -5.407 1
1 577 . 3 1 1 A 48 48 ALA H H 48 6.794 7.803 -1.009 1
1 578 . 3 1 1 A 48 48 ALA HA H 48 4.171 4.179 -0.008 1
1 582 . 3 1 1 A 48 48 ALA C C 48 178.639 180.515 -1.876 1
1 583 . 3 1 1 A 48 48 ALA CA C 48 54.072 55.169 -1.097 1
1 584 . 3 1 1 A 48 48 ALA CB C 48 19.752 18.626 1.126 1
1 585 . 3 1 1 A 48 48 ALA N N 48 122.697 123.362 -0.665 1
1 586 . 3 1 1 A 49 49 LEU H H 49 7.691 8.419 -0.728 1
1 587 . 3 1 1 A 49 49 LEU HA H 49 3.902 4.539 -0.637 1
1 597 . 3 1 1 A 49 49 LEU C C 49 176.823 177.479 -0.656 1
1 598 . 3 1 1 A 49 49 LEU CA C 49 57.190 57.755 -0.565 1
1 599 . 3 1 1 A 49 49 LEU CB C 49 43.628 41.397 2.231 1
1 603 . 3 1 1 A 49 49 LEU N N 49 117.159 118.130 -0.971 1
1 604 . 3 1 1 A 50 50 GLU H H 50 6.963 7.807 -0.844 1
1 605 . 3 1 1 A 50 50 GLU HA H 50 3.220 3.928 -0.708 1
1 610 . 3 1 1 A 50 50 GLU C C 50 176.691 177.343 -0.652 1
1 611 . 3 1 1 A 50 50 GLU CA C 50 58.769 58.416 0.353 1
1 612 . 3 1 1 A 50 50 GLU CB C 50 29.792 29.805 -0.013 1
1 614 . 3 1 1 A 50 50 GLU N N 50 118.761 119.513 -0.752 1
1 615 . 3 1 1 A 51 51 GLY H H 51 8.541 8.733 -0.192 1
1 616 . 3 1 1 A 51 51 GLY HA2 H 51 4.140 3.943 0.197 1
1 617 . 3 1 1 A 51 51 GLY HA3 H 51 3.488 3.956 -0.468 1
1 618 . 3 1 1 A 51 51 GLY C C 51 173.801 173.814 -0.013 1
1 619 . 3 1 1 A 51 51 GLY CA C 51 45.498 45.164 0.334 1
1 620 . 3 1 1 A 51 51 GLY N N 51 113.511 111.629 1.882 1
1 621 . 3 1 1 A 52 52 HIS H H 52 7.656 7.614 0.042 1
1 622 . 3 1 1 A 52 52 HIS HA H 52 4.318 4.905 -0.587 1
1 627 . 3 1 1 A 52 52 HIS C C 52 172.815 173.813 -0.998 1
1 628 . 3 1 1 A 52 52 HIS CA C 52 57.562 54.172 3.390 1
1 629 . 3 1 1 A 52 52 HIS CB C 52 28.670 32.713 -4.043 1
1 632 . 3 1 1 A 52 52 HIS N N 52 116.844 117.037 -0.193 1
1 633 . 3 1 1 A 53 53 GLU H H 53 8.331 8.902 -0.571 1
1 634 . 3 1 1 A 53 53 GLU HA H 53 4.636 4.783 -0.147 1
1 639 . 3 1 1 A 53 53 GLU C C 53 176.145 176.213 -0.068 1
1 640 . 3 1 1 A 53 53 GLU CA C 53 54.891 54.856 0.035 1
1 641 . 3 1 1 A 53 53 GLU CB C 53 33.837 33.101 0.736 1
1 643 . 3 1 1 A 53 53 GLU N N 53 118.873 118.599 0.274 1
1 644 . 3 1 1 A 54 54 VAL H H 54 8.585 8.449 0.136 1
1 645 . 3 1 1 A 54 54 VAL HA H 54 3.227 4.093 -0.866 1
1 653 . 3 1 1 A 54 54 VAL C C 54 177.218 176.525 0.693 1
1 654 . 3 1 1 A 54 54 VAL CA C 54 65.848 63.461 2.387 1
1 655 . 3 1 1 A 54 54 VAL CB C 54 31.189 31.502 -0.313 1
1 658 . 3 1 1 A 54 54 VAL N N 54 120.580 120.609 -0.029 1
1 659 . 3 1 1 A 55 55 GLY H H 55 8.912 9.315 -0.403 1
1 660 . 3 1 1 A 55 55 GLY HA2 H 55 4.441 4.063 0.378 1
1 661 . 3 1 1 A 55 55 GLY HA3 H 55 3.865 4.065 -0.200 1
1 662 . 3 1 1 A 55 55 GLY C C 55 174.827 173.886 0.941 1
1 663 . 3 1 1 A 55 55 GLY CA C 55 44.370 44.941 -0.571 1
1 664 . 3 1 1 A 55 55 GLY N N 55 118.078 115.414 2.664 1
1 665 . 3 1 1 A 56 56 ASP H H 56 8.098 7.909 0.189 1
1 666 . 3 1 1 A 56 56 ASP HA H 56 4.547 4.647 -0.100 1
1 669 . 3 1 1 A 56 56 ASP C C 56 174.859 174.888 -0.029 1
1 670 . 3 1 1 A 56 56 ASP CA C 56 55.629 55.114 0.515 1
1 671 . 3 1 1 A 56 56 ASP CB C 56 40.906 41.428 -0.522 1
1 672 . 3 1 1 A 56 56 ASP N N 56 123.094 122.118 0.976 1
1 673 . 3 1 1 A 57 57 LYS H H 57 8.168 8.538 -0.370 1
1 674 . 3 1 1 A 57 57 LYS HA H 57 5.471 5.857 -0.386 1
1 683 . 3 1 1 A 57 57 LYS C C 57 175.732 175.131 0.601 1
1 684 . 3 1 1 A 57 57 LYS CA C 57 55.056 55.179 -0.123 1
1 685 . 3 1 1 A 57 57 LYS CB C 57 35.302 35.714 -0.412 1
1 689 . 3 1 1 A 57 57 LYS N N 57 122.301 122.240 0.061 1
1 690 . 3 1 1 A 58 58 PHE H H 58 8.355 8.409 -0.054 1
1 691 . 3 1 1 A 58 58 PHE HA H 58 4.858 5.129 -0.271 1
1 699 . 3 1 1 A 58 58 PHE C C 58 171.549 171.863 -0.314 1
1 700 . 3 1 1 A 58 58 PHE CA C 58 56.195 56.018 0.177 1
1 701 . 3 1 1 A 58 58 PHE CB C 58 39.335 40.768 -1.433 1
1 705 . 3 1 1 A 58 58 PHE N N 58 121.026 121.116 -0.090 1
1 706 . 3 1 1 A 59 59 ASP H H 59 8.407 8.920 -0.513 1
1 707 . 3 1 1 A 59 59 ASP HA H 59 5.743 5.725 0.018 1
1 710 . 3 1 1 A 59 59 ASP C C 59 176.302 175.232 1.070 1
1 711 . 3 1 1 A 59 59 ASP CA C 59 52.579 52.708 -0.129 1
1 712 . 3 1 1 A 59 59 ASP CB C 59 43.628 43.608 0.020 1
1 713 . 3 1 1 A 59 59 ASP N N 59 119.234 119.464 -0.230 1
1 714 . 3 1 1 A 60 60 VAL H H 60 8.915 8.953 -0.038 1
1 715 . 3 1 1 A 60 60 VAL HA H 60 4.374 5.080 -0.706 1
1 723 . 3 1 1 A 60 60 VAL C C 60 173.140 174.821 -1.681 1
1 724 . 3 1 1 A 60 60 VAL CA C 60 61.252 60.442 0.810 1
1 725 . 3 1 1 A 60 60 VAL CB C 60 35.620 35.426 0.194 1
1 728 . 3 1 1 A 60 60 VAL N N 60 119.758 121.864 -2.106 1
1 729 . 3 1 1 A 61 61 ALA H H 61 8.761 9.015 -0.254 1
1 730 . 3 1 1 A 61 61 ALA HA H 61 5.091 5.613 -0.522 1
1 734 . 3 1 1 A 61 61 ALA C C 61 176.460 176.340 0.120 1
1 735 . 3 1 1 A 61 61 ALA CA C 61 51.019 51.057 -0.038 1
1 736 . 3 1 1 A 61 61 ALA CB C 61 19.447 21.354 -1.907 1
1 737 . 3 1 1 A 61 61 ALA N N 61 133.341 128.286 5.055 1
1 738 . 3 1 1 A 62 62 VAL H H 62 8.929 9.139 -0.210 1
1 739 . 3 1 1 A 62 62 VAL HA H 62 4.236 4.713 -0.477 1
1 747 . 3 1 1 A 62 62 VAL C C 62 174.733 175.617 -0.884 1
1 748 . 3 1 1 A 62 62 VAL CA C 62 61.007 60.935 0.072 1
1 749 . 3 1 1 A 62 62 VAL CB C 62 34.387 35.779 -1.392 1
1 752 . 3 1 1 A 62 62 VAL N N 62 124.165 122.882 1.283 1
1 753 . 3 1 1 A 63 63 GLY H H 63 8.995 8.642 0.353 1
1 754 . 3 1 1 A 63 63 GLY HA2 H 63 4.229 4.128 0.101 1
1 755 . 3 1 1 A 63 63 GLY HA3 H 63 3.637 4.129 -0.492 1
1 756 . 3 1 1 A 63 63 GLY C C 63 175.306 174.926 0.380 1
1 757 . 3 1 1 A 63 63 GLY CA C 63 44.620 45.280 -0.660 1
1 758 . 3 1 1 A 63 63 GLY N N 63 115.598 112.000 3.598 1
1 759 . 3 1 1 A 64 64 ALA H H 64 8.106 8.986 -0.880 1
1 760 . 3 1 1 A 64 64 ALA HA H 64 4.010 4.536 -0.526 1
1 764 . 3 1 1 A 64 64 ALA C C 64 180.218 178.979 1.239 1
1 765 . 3 1 1 A 64 64 ALA CA C 64 55.897 54.669 1.228 1
1 766 . 3 1 1 A 64 64 ALA CB C 64 18.347 18.446 -0.099 1
1 767 . 3 1 1 A 64 64 ALA N N 64 122.859 124.668 -1.809 1
1 768 . 3 1 1 A 65 65 ASN H H 65 8.748 8.705 0.043 1
1 769 . 3 1 1 A 65 65 ASN HA H 65 4.230 4.519 -0.289 1
1 774 . 3 1 1 A 65 65 ASN C C 65 176.085 175.593 0.492 1
1 775 . 3 1 1 A 65 65 ASN CA C 65 56.064 54.837 1.227 1
1 776 . 3 1 1 A 65 65 ASN CB C 65 37.871 36.864 1.007 1
1 777 . 3 1 1 A 65 65 ASN N N 65 114.590 114.101 0.489 1
1 779 . 3 1 1 A 66 66 ASP H H 66 7.598 8.150 -0.552 1
1 780 . 3 1 1 A 66 66 ASP HA H 66 4.682 4.776 -0.094 1
1 783 . 3 1 1 A 66 66 ASP C C 66 173.061 175.592 -2.531 1
1 784 . 3 1 1 A 66 66 ASP CA C 66 53.549 54.366 -0.817 1
1 785 . 3 1 1 A 66 66 ASP CB C 66 42.204 42.515 -0.311 1
1 786 . 3 1 1 A 66 66 ASP N N 66 118.065 117.905 0.160 1
1 787 . 3 1 1 A 67 67 ALA H H 67 7.434 7.533 -0.099 1
1 788 . 3 1 1 A 67 67 ALA HA H 67 4.316 4.385 -0.069 1
1 792 . 3 1 1 A 67 67 ALA C C 67 175.615 176.384 -0.769 1
1 793 . 3 1 1 A 67 67 ALA CA C 67 50.814 50.252 0.562 1
1 794 . 3 1 1 A 67 67 ALA CB C 67 18.618 21.582 -2.964 1
1 795 . 3 1 1 A 67 67 ALA N N 67 124.890 120.652 4.238 1
1 796 . 3 1 1 A 68 68 TYR H H 68 8.390 8.336 0.054 1
1 797 . 3 1 1 A 68 68 TYR HA H 68 4.195 4.717 -0.522 1
1 804 . 3 1 1 A 68 68 TYR C C 68 174.964 176.941 -1.977 1
1 805 . 3 1 1 A 68 68 TYR CA C 68 59.566 57.916 1.650 1
1 806 . 3 1 1 A 68 68 TYR CB C 68 36.992 39.544 -2.552 1
1 809 . 3 1 1 A 68 68 TYR N N 68 121.083 116.987 4.096 1
1 810 . 3 1 1 A 69 69 GLY H H 69 8.149 8.959 -0.810 1
1 811 . 3 1 1 A 69 69 GLY HA2 H 69 4.254 4.031 0.223 1
1 812 . 3 1 1 A 69 69 GLY HA3 H 69 3.624 4.043 -0.419 1
1 813 . 3 1 1 A 69 69 GLY C C 69 173.161 175.050 -1.889 1
1 814 . 3 1 1 A 69 69 GLY CA C 69 44.465 45.493 -1.028 1
1 815 . 3 1 1 A 69 69 GLY N N 69 108.762 110.682 -1.920 1
1 816 . 3 1 1 A 70 70 GLN H H 70 8.450 7.825 0.625 1
1 817 . 3 1 1 A 70 70 GLN HA H 70 4.140 4.449 -0.309 1
1 824 . 3 1 1 A 70 70 GLN C C 70 176.138 175.676 0.462 1
1 825 . 3 1 1 A 70 70 GLN CA C 70 54.680 56.099 -1.419 1
1 826 . 3 1 1 A 70 70 GLN CB C 70 29.210 30.261 -1.051 1
1 828 . 3 1 1 A 70 70 GLN N N 70 117.002 119.898 -2.896 1
1 830 . 3 1 1 A 71 71 TYR H H 71 8.991 8.562 0.429 1
1 831 . 3 1 1 A 71 71 TYR HA H 71 3.752 4.503 -0.751 1
1 838 . 3 1 1 A 71 71 TYR C C 71 174.548 174.349 0.199 1
1 839 . 3 1 1 A 71 71 TYR CA C 71 59.868 59.743 0.125 1
1 840 . 3 1 1 A 71 71 TYR CB C 71 38.961 39.107 -0.146 1
1 843 . 3 1 1 A 71 71 TYR N N 71 125.112 122.799 2.313 1
1 844 . 3 1 1 A 72 72 ASP H H 72 8.819 8.400 0.419 1
1 845 . 3 1 1 A 72 72 ASP HA H 72 4.773 4.825 -0.052 1
1 848 . 3 1 1 A 72 72 ASP C C 72 177.709 175.625 2.084 1
1 849 . 3 1 1 A 72 72 ASP CA C 72 52.382 52.779 -0.397 1
1 850 . 3 1 1 A 72 72 ASP CB C 72 42.197 43.086 -0.889 1
1 851 . 3 1 1 A 72 72 ASP N N 72 129.918 127.805 2.113 1
1 852 . 3 1 1 A 73 73 GLU H H 73 9.409 8.799 0.610 1
1 853 . 3 1 1 A 73 73 GLU HA H 73 3.937 3.763 0.174 1
1 858 . 3 1 1 A 73 73 GLU C C 73 177.581 176.820 0.761 1
1 859 . 3 1 1 A 73 73 GLU CA C 73 58.962 58.112 0.850 1
1 860 . 3 1 1 A 73 73 GLU CB C 73 29.155 28.858 0.297 1
1 862 . 3 1 1 A 73 73 GLU N N 73 129.624 124.692 4.932 1
1 863 . 3 1 1 A 74 74 ASN H H 74 8.700 8.077 0.623 1
1 864 . 3 1 1 A 74 74 ASN HA H 74 4.550 4.480 0.070 1
1 869 . 3 1 1 A 74 74 ASN C C 74 176.190 176.737 -0.547 1
1 870 . 3 1 1 A 74 74 ASN CA C 74 54.932 54.197 0.735 1
1 871 . 3 1 1 A 74 74 ASN CB C 74 38.113 37.230 0.883 1
1 872 . 3 1 1 A 74 74 ASN N N 74 116.792 117.908 -1.116 1
1 874 . 3 1 1 A 75 75 LEU H H 75 7.303 7.326 -0.023 1
1 875 . 3 1 1 A 75 75 LEU HA H 75 4.289 4.171 0.118 1
1 885 . 3 1 1 A 75 75 LEU C C 75 175.821 176.293 -0.472 1
1 886 . 3 1 1 A 75 75 LEU CA C 75 54.106 56.707 -2.601 1
1 887 . 3 1 1 A 75 75 LEU CB C 75 41.239 42.337 -1.098 1
1 891 . 3 1 1 A 75 75 LEU N N 75 117.094 120.558 -3.464 1
1 892 . 3 1 1 A 76 76 VAL H H 76 7.181 7.492 -0.311 1
1 893 . 3 1 1 A 76 76 VAL HA H 76 4.970 4.580 0.390 1
1 901 . 3 1 1 A 76 76 VAL C C 76 175.702 174.328 1.374 1
1 902 . 3 1 1 A 76 76 VAL CA C 76 61.733 59.872 1.861 1
1 903 . 3 1 1 A 76 76 VAL CB C 76 31.822 34.468 -2.646 1
1 905 . 3 1 1 A 76 76 VAL N N 76 124.716 119.285 5.431 1
1 906 . 3 1 1 A 77 77 GLN H H 77 8.791 8.523 0.268 1
1 907 . 3 1 1 A 77 77 GLN HA H 77 4.695 4.967 -0.272 1
1 914 . 3 1 1 A 77 77 GLN C C 77 173.553 173.275 0.278 1
1 915 . 3 1 1 A 77 77 GLN CA C 77 54.038 54.389 -0.351 1
1 916 . 3 1 1 A 77 77 GLN CB C 77 33.018 32.402 0.616 1
1 918 . 3 1 1 A 77 77 GLN N N 77 124.898 125.770 -0.872 1
1 920 . 3 1 1 A 78 78 ARG H H 78 8.530 8.496 0.034 1
1 921 . 3 1 1 A 78 78 ARG HA H 78 5.107 5.227 -0.120 1
1 928 . 3 1 1 A 78 78 ARG C C 78 176.182 175.097 1.085 1
1 929 . 3 1 1 A 78 78 ARG CA C 78 55.355 54.910 0.445 1
1 930 . 3 1 1 A 78 78 ARG CB C 78 31.150 31.821 -0.671 1
1 933 . 3 1 1 A 78 78 ARG N N 78 123.413 119.746 3.667 1
1 934 . 3 1 1 A 79 79 VAL H H 79 9.300 8.576 0.724 1
1 935 . 3 1 1 A 79 79 VAL HA H 79 4.824 4.573 0.251 1
1 943 . 3 1 1 A 79 79 VAL CA C 79 58.731 58.769 -0.038 1
1 944 . 3 1 1 A 79 79 VAL CB C 79 34.836 33.204 1.632 1
1 947 . 3 1 1 A 79 79 VAL N N 79 125.252 124.932 0.320 1
1 948 . 3 1 1 A 80 80 PRO HA H 80 4.339 4.670 -0.331 1
1 955 . 3 1 1 A 80 80 PRO C C 80 176.902 177.925 -1.023 1
1 956 . 3 1 1 A 80 80 PRO CA C 80 62.969 63.020 -0.051 1
1 957 . 3 1 1 A 80 80 PRO CB C 80 32.431 32.395 0.036 1
1 960 . 3 1 1 A 81 81 LYS H H 81 7.816 9.152 -1.336 1
1 961 . 3 1 1 A 81 81 LYS HA H 81 3.790 4.050 -0.260 1
1 970 . 3 1 1 A 81 81 LYS C C 81 177.808 178.952 -1.144 1
1 971 . 3 1 1 A 81 81 LYS CA C 81 59.874 60.167 -0.293 1
1 972 . 3 1 1 A 81 81 LYS CB C 81 32.670 32.142 0.528 1
1 976 . 3 1 1 A 81 81 LYS N N 81 120.948 124.532 -3.584 1
1 977 . 3 1 1 A 82 82 ASP H H 82 8.069 8.113 -0.044 1
1 978 . 3 1 1 A 82 82 ASP HA H 82 4.243 4.372 -0.129 1
1 981 . 3 1 1 A 82 82 ASP C C 82 177.157 178.544 -1.387 1
1 982 . 3 1 1 A 82 82 ASP CA C 82 55.527 57.487 -1.960 1
1 983 . 3 1 1 A 82 82 ASP CB C 82 40.005 41.703 -1.698 1
1 984 . 3 1 1 A 82 82 ASP N N 82 116.004 120.250 -4.246 1
1 985 . 3 1 1 A 83 83 VAL H H 83 7.150 7.813 -0.663 1
1 986 . 3 1 1 A 83 83 VAL HA H 83 3.719 3.542 0.177 1
1 994 . 3 1 1 A 83 83 VAL C C 83 176.346 176.724 -0.378 1
1 995 . 3 1 1 A 83 83 VAL CA C 83 63.868 65.747 -1.879 1
1 996 . 3 1 1 A 83 83 VAL CB C 83 31.689 31.410 0.279 1
1 999 . 3 1 1 A 83 83 VAL N N 83 117.199 119.073 -1.874 1
1 1000 . 3 1 1 A 84 84 PHE H H 84 7.365 7.502 -0.137 1
1 1001 . 3 1 1 A 84 84 PHE HA H 84 4.389 4.693 -0.304 1
1 1009 . 3 1 1 A 84 84 PHE C C 84 175.265 176.227 -0.962 1
1 1010 . 3 1 1 A 84 84 PHE CA C 84 57.210 57.051 0.159 1
1 1011 . 3 1 1 A 84 84 PHE CB C 84 38.968 38.106 0.862 1
1 1015 . 3 1 1 A 84 84 PHE N N 84 119.897 116.772 3.125 1
1 1016 . 3 1 1 A 85 85 MET H H 85 7.765 7.966 -0.201 1
1 1017 . 3 1 1 A 85 85 MET HA H 85 4.277 4.341 -0.064 1
1 1025 . 3 1 1 A 85 85 MET C C 85 176.856 177.216 -0.360 1
1 1026 . 3 1 1 A 85 85 MET CA C 85 56.389 57.813 -1.424 1
1 1027 . 3 1 1 A 85 85 MET CB C 85 32.715 32.589 0.126 1
1 1030 . 3 1 1 A 85 85 MET N N 85 121.131 119.322 1.809 1
1 1031 . 3 1 1 A 86 86 GLY H H 86 8.499 8.206 0.293 1
1 1032 . 3 1 1 A 86 86 GLY HA2 H 86 3.928 3.934 -0.006 1
1 1033 . 3 1 1 A 86 86 GLY HA3 H 86 3.793 3.938 -0.145 1
1 1034 . 3 1 1 A 86 86 GLY C C 86 174.168 173.762 0.406 1
1 1035 . 3 1 1 A 86 86 GLY CA C 86 45.637 45.219 0.418 1
1 1036 . 3 1 1 A 86 86 GLY N N 86 111.268 107.800 3.468 1
1 1037 . 3 1 1 A 87 87 VAL H H 87 7.564 7.793 -0.229 1
1 1038 . 3 1 1 A 87 87 VAL HA H 87 4.083 4.100 -0.017 1
1 1046 . 3 1 1 A 87 87 VAL C C 87 175.649 175.862 -0.213 1
1 1047 . 3 1 1 A 87 87 VAL CA C 87 61.809 61.264 0.545 1
1 1048 . 3 1 1 A 87 87 VAL CB C 87 32.667 33.136 -0.469 1
1 1051 . 3 1 1 A 87 87 VAL N N 87 118.839 120.410 -1.571 1
1 1052 . 3 1 1 A 88 88 ASP H H 88 8.270 8.836 -0.566 1
1 1053 . 3 1 1 A 88 88 ASP HA H 88 4.421 4.396 0.025 1
1 1056 . 3 1 1 A 88 88 ASP C C 88 175.977 175.240 0.737 1
1 1057 . 3 1 1 A 88 88 ASP CA C 88 55.655 56.915 -1.260 1
1 1058 . 3 1 1 A 88 88 ASP CB C 88 41.364 41.027 0.337 1
1 1059 . 3 1 1 A 88 88 ASP N N 88 124.401 126.810 -2.409 1
1 1060 . 3 1 1 A 89 89 GLU H H 89 7.833 7.810 0.023 1
1 1061 . 3 1 1 A 89 89 GLU HA H 89 4.206 4.672 -0.466 1
1 1066 . 3 1 1 A 89 89 GLU C C 89 174.912 175.534 -0.622 1
1 1067 . 3 1 1 A 89 89 GLU CA C 89 55.739 55.217 0.522 1
1 1068 . 3 1 1 A 89 89 GLU CB C 89 30.603 32.859 -2.256 1
1 1070 . 3 1 1 A 89 89 GLU N N 89 119.378 115.631 3.747 1
1 1071 . 3 1 1 A 90 90 LEU H H 90 8.051 8.674 -0.623 1
1 1072 . 3 1 1 A 90 90 LEU HA H 90 4.127 4.266 -0.139 1
1 1082 . 3 1 1 A 90 90 LEU C C 90 175.753 175.856 -0.103 1
1 1083 . 3 1 1 A 90 90 LEU CA C 90 54.929 55.355 -0.426 1
1 1084 . 3 1 1 A 90 90 LEU CB C 90 42.710 41.004 1.706 1
1 1088 . 3 1 1 A 90 90 LEU N N 90 124.432 125.983 -1.551 1
1 1089 . 3 1 1 A 91 91 GLN H H 91 7.341 8.694 -1.353 1
1 1090 . 3 1 1 A 91 91 GLN HA H 91 4.546 4.879 -0.333 1
1 1097 . 3 1 1 A 91 91 GLN C C 91 174.655 174.571 0.084 1
1 1098 . 3 1 1 A 91 91 GLN CA C 91 53.671 53.880 -0.209 1
1 1099 . 3 1 1 A 91 91 GLN CB C 91 32.850 32.469 0.381 1
1 1101 . 3 1 1 A 91 91 GLN N N 91 120.186 125.608 -5.422 1
1 1103 . 3 1 1 A 92 92 VAL H H 92 8.442 8.503 -0.061 1
1 1104 . 3 1 1 A 92 92 VAL HA H 92 3.278 3.914 -0.636 1
1 1112 . 3 1 1 A 92 92 VAL C C 92 177.098 177.295 -0.197 1
1 1113 . 3 1 1 A 92 92 VAL CA C 92 64.953 64.341 0.612 1
1 1114 . 3 1 1 A 92 92 VAL CB C 92 31.601 31.885 -0.284 1
1 1117 . 3 1 1 A 92 92 VAL N N 92 121.899 123.859 -1.960 1
1 1118 . 3 1 1 A 93 93 GLY H H 93 9.002 9.573 -0.571 1
1 1119 . 3 1 1 A 93 93 GLY HA2 H 93 4.327 3.994 0.333 1
1 1120 . 3 1 1 A 93 93 GLY HA3 H 93 3.770 3.998 -0.228 1
1 1121 . 3 1 1 A 93 93 GLY C C 93 174.547 174.295 0.252 1
1 1122 . 3 1 1 A 93 93 GLY CA C 93 44.446 45.198 -0.752 1
1 1123 . 3 1 1 A 93 93 GLY N N 93 116.485 114.978 1.507 1
1 1124 . 3 1 1 A 94 94 MET H H 94 7.445 7.957 -0.512 1
1 1125 . 3 1 1 A 94 94 MET HA H 94 4.182 4.552 -0.370 1
1 1133 . 3 1 1 A 94 94 MET C C 94 174.531 175.218 -0.687 1
1 1134 . 3 1 1 A 94 94 MET CA C 94 57.193 55.619 1.574 1
1 1135 . 3 1 1 A 94 94 MET CB C 94 34.474 33.330 1.144 1
1 1138 . 3 1 1 A 94 94 MET N N 94 120.304 120.361 -0.057 1
1 1139 . 3 1 1 A 95 95 ARG H H 95 8.169 8.629 -0.460 1
1 1140 . 3 1 1 A 95 95 ARG HA H 95 5.343 5.040 0.303 1
1 1147 . 3 1 1 A 95 95 ARG C C 95 175.593 175.247 0.346 1
1 1148 . 3 1 1 A 95 95 ARG CA C 95 54.898 54.725 0.173 1
1 1149 . 3 1 1 A 95 95 ARG CB C 95 32.928 33.222 -0.294 1
1 1152 . 3 1 1 A 95 95 ARG N N 95 122.066 122.918 -0.852 1
1 1153 . 3 1 1 A 96 96 PHE H H 96 8.440 8.221 0.219 1
1 1154 . 3 1 1 A 96 96 PHE HA H 96 4.738 5.091 -0.353 1
1 1162 . 3 1 1 A 96 96 PHE C C 96 173.273 171.952 1.321 1
1 1163 . 3 1 1 A 96 96 PHE CA C 96 56.174 56.133 0.041 1
1 1164 . 3 1 1 A 96 96 PHE CB C 96 42.474 40.648 1.826 1
1 1168 . 3 1 1 A 96 96 PHE N N 96 119.938 118.506 1.432 1
1 1169 . 3 1 1 A 97 97 LEU H H 97 8.459 8.797 -0.338 1
1 1170 . 3 1 1 A 97 97 LEU HA H 97 4.625 4.928 -0.303 1
1 1180 . 3 1 1 A 97 97 LEU C C 97 175.664 175.074 0.590 1
1 1181 . 3 1 1 A 97 97 LEU CA C 97 53.547 54.142 -0.595 1
1 1182 . 3 1 1 A 97 97 LEU CB C 97 42.379 44.297 -1.918 1
1 1186 . 3 1 1 A 97 97 LEU N N 97 122.014 122.201 -0.187 1
1 1187 . 3 1 1 A 98 98 ALA H H 98 8.812 9.119 -0.307 1
1 1188 . 3 1 1 A 98 98 ALA HA H 98 4.520 5.599 -1.079 1
1 1192 . 3 1 1 A 98 98 ALA C C 98 176.373 176.446 -0.073 1
1 1193 . 3 1 1 A 98 98 ALA CA C 98 50.639 50.347 0.292 1
1 1194 . 3 1 1 A 98 98 ALA CB C 98 20.939 21.494 -0.555 1
1 1195 . 3 1 1 A 98 98 ALA N N 98 129.296 129.442 -0.146 1
1 1196 . 3 1 1 A 99 99 GLU H H 99 8.504 8.823 -0.319 1
1 1197 . 3 1 1 A 99 99 GLU HA H 99 4.150 4.650 -0.500 1
1 1202 . 3 1 1 A 99 99 GLU C C 99 176.351 176.636 -0.285 1
1 1203 . 3 1 1 A 99 99 GLU CA C 99 56.830 57.115 -0.285 1
1 1204 . 3 1 1 A 99 99 GLU CB C 99 29.639 30.282 -0.643 1
1 1206 . 3 1 1 A 99 99 GLU N N 99 121.993 122.934 -0.941 1
1 1207 . 3 1 1 A 100 100 THR H H 100 7.393 8.561 -1.168 1
1 1208 . 3 1 1 A 100 100 THR HA H 100 4.819 4.825 -0.006 1
1 1213 . 3 1 1 A 100 100 THR C C 100 175.882 174.760 1.122 1
1 1214 . 3 1 1 A 100 100 THR CA C 100 60.329 60.337 -0.008 1
1 1215 . 3 1 1 A 100 100 THR CB C 100 73.452 71.951 1.501 1
1 1217 . 3 1 1 A 100 100 THR N N 100 115.598 114.732 0.866 1
1 1218 . 3 1 1 A 101 101 ASP H H 101 8.988 8.767 0.221 1
1 1219 . 3 1 1 A 101 101 ASP HA H 101 4.357 4.382 -0.025 1
1 1222 . 3 1 1 A 101 101 ASP C C 101 176.848 176.910 -0.062 1
1 1223 . 3 1 1 A 101 101 ASP CA C 101 56.493 57.645 -1.152 1
1 1224 . 3 1 1 A 101 101 ASP CB C 101 39.973 40.631 -0.658 1
1 1225 . 3 1 1 A 101 101 ASP N N 101 121.468 120.200 1.268 1
1 1226 . 3 1 1 A 102 102 GLN H H 102 7.937 7.578 0.359 1
1 1227 . 3 1 1 A 102 102 GLN HA H 102 4.415 4.307 0.108 1
1 1234 . 3 1 1 A 102 102 GLN C C 102 175.252 176.031 -0.779 1
1 1235 . 3 1 1 A 102 102 GLN CA C 102 55.097 54.901 0.196 1
1 1236 . 3 1 1 A 102 102 GLN CB C 102 29.121 27.460 1.661 1
1 1238 . 3 1 1 A 102 102 GLN N N 102 117.199 113.826 3.373 1
1 1240 . 3 1 1 A 103 103 GLY H H 103 7.431 7.739 -0.308 1
1 1241 . 3 1 1 A 103 103 GLY HA2 H 103 4.504 4.170 0.334 1
1 1242 . 3 1 1 A 103 103 GLY HA3 H 103 3.868 4.174 -0.306 1
1 1243 . 3 1 1 A 103 103 GLY CA C 103 44.051 44.455 -0.404 1
1 1244 . 3 1 1 A 103 103 GLY N N 103 110.056 110.492 -0.436 1
1 1245 . 3 1 1 A 104 104 PRO HA H 104 5.057 4.907 0.150 1
1 1252 . 3 1 1 A 104 104 PRO C C 104 177.873 175.622 2.251 1
1 1253 . 3 1 1 A 104 104 PRO CA C 104 62.464 62.952 -0.488 1
1 1254 . 3 1 1 A 104 104 PRO CB C 104 31.939 32.325 -0.386 1
1 1257 . 3 1 1 A 105 105 VAL H H 105 8.960 9.304 -0.344 1
1 1258 . 3 1 1 A 105 105 VAL HA H 105 4.678 4.557 0.121 1
1 1266 . 3 1 1 A 105 105 VAL CA C 105 58.474 59.137 -0.663 1
1 1267 . 3 1 1 A 105 105 VAL CB C 105 35.512 35.225 0.287 1
1 1270 . 3 1 1 A 105 105 VAL N N 105 123.240 122.894 0.346 1
1 1271 . 3 1 1 A 106 106 PRO HA H 106 4.777 4.996 -0.219 1
1 1278 . 3 1 1 A 106 106 PRO C C 106 176.823 176.300 0.523 1
1 1279 . 3 1 1 A 106 106 PRO CA C 106 62.508 62.145 0.363 1
1 1280 . 3 1 1 A 106 106 PRO CB C 106 31.650 31.773 -0.123 1
1 1283 . 3 1 1 A 107 107 VAL H H 107 8.835 7.827 1.008 1
1 1284 . 3 1 1 A 107 107 VAL HA H 107 4.719 4.874 -0.155 1
1 1292 . 3 1 1 A 107 107 VAL C C 107 173.661 173.354 0.307 1
1 1293 . 3 1 1 A 107 107 VAL CA C 107 59.026 59.104 -0.078 1
1 1294 . 3 1 1 A 107 107 VAL CB C 107 36.406 34.879 1.527 1
1 1297 . 3 1 1 A 107 107 VAL N N 107 117.474 117.044 0.430 1
1 1298 . 3 1 1 A 108 108 GLU H H 108 7.698 8.372 -0.674 1
1 1299 . 3 1 1 A 108 108 GLU HA H 108 5.133 5.096 0.037 1
1 1304 . 3 1 1 A 108 108 GLU C C 108 176.394 175.546 0.848 1
1 1305 . 3 1 1 A 108 108 GLU CA C 108 53.808 54.524 -0.716 1
1 1306 . 3 1 1 A 108 108 GLU CB C 108 33.984 32.907 1.077 1
1 1308 . 3 1 1 A 108 108 GLU N N 108 120.646 121.730 -1.084 1
1 1309 . 3 1 1 A 109 109 ILE H H 109 8.690 9.122 -0.432 1
1 1310 . 3 1 1 A 109 109 ILE HA H 109 4.484 4.316 0.168 1
1 1320 . 3 1 1 A 109 109 ILE C C 109 177.313 176.998 0.315 1
1 1321 . 3 1 1 A 109 109 ILE CA C 109 61.789 61.629 0.160 1
1 1322 . 3 1 1 A 109 109 ILE CB C 109 36.628 37.677 -1.049 1
1 1326 . 3 1 1 A 109 109 ILE N N 109 124.739 127.513 -2.774 1
1 1327 . 3 1 1 A 110 110 THR H H 110 9.300 9.658 -0.358 1
1 1328 . 3 1 1 A 110 110 THR HA H 110 4.547 4.634 -0.087 1
1 1333 . 3 1 1 A 110 110 THR C C 110 174.904 174.508 0.396 1
1 1334 . 3 1 1 A 110 110 THR CA C 110 62.260 61.231 1.029 1
1 1335 . 3 1 1 A 110 110 THR CB C 110 69.100 69.749 -0.649 1
1 1337 . 3 1 1 A 110 110 THR N N 110 122.544 118.440 4.104 1
1 1338 . 3 1 1 A 111 111 ALA H H 111 7.673 7.530 0.143 1
1 1339 . 3 1 1 A 111 111 ALA HA H 111 4.367 4.572 -0.205 1
1 1343 . 3 1 1 A 111 111 ALA C C 111 175.019 175.014 0.005 1
1 1344 . 3 1 1 A 111 111 ALA CA C 111 53.125 51.826 1.299 1
1 1345 . 3 1 1 A 111 111 ALA CB C 111 21.539 22.298 -0.759 1
1 1346 . 3 1 1 A 111 111 ALA N N 111 123.153 120.620 2.533 1
1 1347 . 3 1 1 A 112 112 VAL H H 112 8.707 8.373 0.334 1
1 1348 . 3 1 1 A 112 112 VAL HA H 112 4.129 4.582 -0.453 1
1 1356 . 3 1 1 A 112 112 VAL C C 112 174.755 175.118 -0.363 1
1 1357 . 3 1 1 A 112 112 VAL CA C 112 62.898 61.630 1.268 1
1 1358 . 3 1 1 A 112 112 VAL CB C 112 33.379 34.441 -1.062 1
1 1361 . 3 1 1 A 112 112 VAL N N 112 122.369 119.935 2.434 1
1 1362 . 3 1 1 A 113 113 GLU H H 113 8.144 9.195 -1.051 1
1 1363 . 3 1 1 A 113 113 GLU HA H 113 4.645 4.595 0.050 1
1 1368 . 3 1 1 A 113 113 GLU C C 113 175.102 177.706 -2.604 1
1 1369 . 3 1 1 A 113 113 GLU CA C 113 54.080 55.087 -1.007 1
1 1370 . 3 1 1 A 113 113 GLU CB C 113 31.234 31.180 0.054 1
1 1372 . 3 1 1 A 113 113 GLU N N 113 127.435 127.109 0.326 1
1 1373 . 3 1 1 A 114 114 ASP H H 114 8.472 8.679 -0.207 1
1 1374 . 3 1 1 A 114 114 ASP HA H 114 4.209 4.251 -0.042 1
1 1377 . 3 1 1 A 114 114 ASP C C 114 177.679 176.668 1.011 1
1 1378 . 3 1 1 A 114 114 ASP CA C 114 58.334 57.928 0.406 1
1 1379 . 3 1 1 A 114 114 ASP CB C 114 40.347 41.240 -0.893 1
1 1380 . 3 1 1 A 114 114 ASP N N 114 119.844 122.830 -2.986 1
1 1381 . 3 1 1 A 115 115 ASP H H 115 8.475 7.833 0.642 1
1 1382 . 3 1 1 A 115 115 ASP HA H 115 4.848 4.923 -0.075 1
1 1385 . 3 1 1 A 115 115 ASP C C 115 175.968 175.253 0.715 1
1 1386 . 3 1 1 A 115 115 ASP CA C 115 53.290 53.353 -0.063 1
1 1387 . 3 1 1 A 115 115 ASP CB C 115 42.080 42.657 -0.577 1
1 1388 . 3 1 1 A 115 115 ASP N N 115 114.364 114.636 -0.272 1
1 1389 . 3 1 1 A 116 116 HIS H H 116 7.185 7.559 -0.374 1
1 1390 . 3 1 1 A 116 116 HIS HA H 116 5.106 5.526 -0.420 1
1 1395 . 3 1 1 A 116 116 HIS C C 116 172.393 172.861 -0.468 1
1 1396 . 3 1 1 A 116 116 HIS CA C 116 56.099 54.118 1.981 1
1 1397 . 3 1 1 A 116 116 HIS CB C 116 33.289 33.439 -0.150 1
1 1400 . 3 1 1 A 116 116 HIS N N 116 117.212 114.668 2.544 1
1 1401 . 3 1 1 A 117 117 VAL H H 117 9.130 9.345 -0.215 1
1 1402 . 3 1 1 A 117 117 VAL HA H 117 4.649 4.905 -0.256 1
1 1410 . 3 1 1 A 117 117 VAL C C 117 173.832 174.656 -0.824 1
1 1411 . 3 1 1 A 117 117 VAL CA C 117 59.555 59.873 -0.318 1
1 1412 . 3 1 1 A 117 117 VAL CB C 117 34.676 34.570 0.106 1
1 1415 . 3 1 1 A 117 117 VAL N N 117 114.046 116.166 -2.120 1
1 1416 . 3 1 1 A 118 118 VAL H H 118 8.680 9.097 -0.417 1
1 1417 . 3 1 1 A 118 118 VAL HA H 118 4.747 4.711 0.036 1
1 1425 . 3 1 1 A 118 118 VAL C C 118 175.836 175.462 0.374 1
1 1426 . 3 1 1 A 118 118 VAL CA C 118 62.159 61.345 0.814 1
1 1427 . 3 1 1 A 118 118 VAL CB C 118 31.887 32.823 -0.936 1
1 1430 . 3 1 1 A 118 118 VAL N N 118 125.095 122.058 3.037 1
1 1431 . 3 1 1 A 119 119 VAL H H 119 9.057 8.708 0.349 1
1 1432 . 3 1 1 A 119 119 VAL HA H 119 5.231 5.519 -0.288 1
1 1440 . 3 1 1 A 119 119 VAL C C 119 173.747 173.977 -0.230 1
1 1441 . 3 1 1 A 119 119 VAL CA C 119 58.326 59.814 -1.488 1
1 1442 . 3 1 1 A 119 119 VAL CB C 119 34.387 34.227 0.160 1
1 1445 . 3 1 1 A 119 119 VAL N N 119 121.494 122.369 -0.875 1
1 1446 . 3 1 1 A 120 120 ASP H H 120 8.926 8.803 0.123 1
1 1447 . 3 1 1 A 120 120 ASP HA H 120 5.174 5.315 -0.141 1
1 1450 . 3 1 1 A 120 120 ASP C C 120 177.982 174.628 3.354 1
1 1451 . 3 1 1 A 120 120 ASP CA C 120 52.749 52.384 0.365 1
1 1452 . 3 1 1 A 120 120 ASP CB C 120 44.542 44.368 0.174 1
1 1453 . 3 1 1 A 120 120 ASP N N 120 121.454 125.418 -3.964 1
1 1454 . 3 1 1 A 121 121 GLY H H 121 8.674 8.500 0.174 1
1 1455 . 3 1 1 A 121 121 GLY HA2 H 121 4.702 4.186 0.516 1
1 1456 . 3 1 1 A 121 121 GLY HA3 H 121 3.573 4.234 -0.661 1
1 1457 . 3 1 1 A 121 121 GLY C C 121 175.041 174.133 0.908 1
1 1458 . 3 1 1 A 121 121 GLY CA C 121 45.319 45.572 -0.253 1
1 1459 . 3 1 1 A 121 121 GLY N N 121 114.850 112.292 2.558 1
1 1460 . 3 1 1 A 122 122 ASN H H 122 8.762 7.979 0.783 1
1 1461 . 3 1 1 A 122 122 ASN HA H 122 4.183 5.431 -1.248 1
1 1466 . 3 1 1 A 122 122 ASN C C 122 175.406 173.582 1.824 1
1 1467 . 3 1 1 A 122 122 ASN CA C 122 54.686 51.963 2.723 1
1 1468 . 3 1 1 A 122 122 ASN CB C 122 40.139 39.975 0.164 1
1 1469 . 3 1 1 A 122 122 ASN N N 122 121.618 116.665 4.953 1
1 1471 . 3 1 1 A 123 123 HIS H H 123 8.929 8.943 -0.014 1
1 1472 . 3 1 1 A 123 123 HIS HA H 123 4.005 5.202 -1.197 1
1 1477 . 3 1 1 A 123 123 HIS C C 123 177.325 175.608 1.717 1
1 1478 . 3 1 1 A 123 123 HIS CA C 123 58.768 55.370 3.398 1
1 1479 . 3 1 1 A 123 123 HIS CB C 123 31.172 33.985 -2.813 1
1 1482 . 3 1 1 A 123 123 HIS N N 123 124.165 120.325 3.840 1
1 1483 . 3 1 1 A 124 124 MET H H 124 8.266 9.071 -0.805 1
1 1484 . 3 1 1 A 124 124 MET HA H 124 4.048 4.163 -0.115 1
1 1492 . 3 1 1 A 124 124 MET CA C 124 58.994 58.744 0.250 1
1 1493 . 3 1 1 A 124 124 MET CB C 124 32.777 32.042 0.735 1
1 1496 . 3 1 1 A 124 124 MET N N 124 129.443 121.098 8.345 1
1 1497 . 3 1 1 A 125 125 LEU H H 125 8.094 7.824 0.270 1
1 1498 . 3 1 1 A 125 125 LEU HA H 125 4.455 4.362 0.093 1
1 1504 . 3 1 1 A 125 125 LEU C C 125 177.860 177.142 0.718 1
1 1505 . 3 1 1 A 125 125 LEU CA C 125 53.517 54.736 -1.219 1
1 1506 . 3 1 1 A 125 125 LEU CB C 125 42.462 42.170 0.292 1
1 1509 . 3 1 1 A 126 126 ALA H H 126 8.089 8.300 -0.211 1
1 1510 . 3 1 1 A 126 126 ALA HA H 126 3.966 4.070 -0.104 1
1 1514 . 3 1 1 A 126 126 ALA C C 126 179.135 177.377 1.758 1
1 1515 . 3 1 1 A 126 126 ALA CA C 126 54.170 54.924 -0.754 1
1 1516 . 3 1 1 A 126 126 ALA CB C 126 18.687 18.306 0.381 1
1 1517 . 3 1 1 A 126 126 ALA N N 126 126.095 121.644 4.451 1
1 1518 . 3 1 1 A 127 127 GLY H H 127 9.499 8.617 0.882 1
1 1519 . 3 1 1 A 127 127 GLY HA2 H 127 4.207 3.985 0.222 1
1 1520 . 3 1 1 A 127 127 GLY HA3 H 127 3.598 3.994 -0.396 1
1 1521 . 3 1 1 A 127 127 GLY C C 127 173.568 174.360 -0.792 1
1 1522 . 3 1 1 A 127 127 GLY CA C 127 45.846 45.094 0.752 1
1 1523 . 3 1 1 A 127 127 GLY N N 127 110.073 106.078 3.995 1
1 1524 . 3 1 1 A 128 128 GLN H H 128 7.514 7.887 -0.373 1
1 1525 . 3 1 1 A 128 128 GLN HA H 128 4.496 4.337 0.159 1
1 1532 . 3 1 1 A 128 128 GLN C C 128 174.790 175.032 -0.242 1
1 1533 . 3 1 1 A 128 128 GLN CA C 128 54.948 56.136 -1.188 1
1 1534 . 3 1 1 A 128 128 GLN CB C 128 29.181 29.743 -0.562 1
1 1536 . 3 1 1 A 128 128 GLN N N 128 117.842 120.394 -2.552 1
1 1538 . 3 1 1 A 129 129 ASN H H 129 8.689 8.211 0.478 1
1 1539 . 3 1 1 A 129 129 ASN HA H 129 4.857 5.428 -0.571 1
1 1544 . 3 1 1 A 129 129 ASN C C 129 174.325 174.180 0.145 1
1 1545 . 3 1 1 A 129 129 ASN CA C 129 52.568 51.833 0.735 1
1 1546 . 3 1 1 A 129 129 ASN CB C 129 38.035 41.327 -3.292 1
1 1547 . 3 1 1 A 129 129 ASN N N 129 122.739 122.972 -0.233 1
1 1549 . 3 1 1 A 130 130 LEU H H 130 8.742 8.776 -0.034 1
1 1550 . 3 1 1 A 130 130 LEU HA H 130 4.918 5.071 -0.153 1
1 1560 . 3 1 1 A 130 130 LEU C C 130 176.095 175.559 0.536 1
1 1561 . 3 1 1 A 130 130 LEU CA C 130 53.691 53.101 0.590 1
1 1562 . 3 1 1 A 130 130 LEU CB C 130 46.814 44.953 1.861 1
1 1566 . 3 1 1 A 130 130 LEU N N 130 121.242 121.017 0.225 1
1 1567 . 3 1 1 A 131 131 LYS H H 131 8.809 9.459 -0.650 1
1 1568 . 3 1 1 A 131 131 LYS HA H 131 4.918 5.335 -0.417 1
1 1577 . 3 1 1 A 131 131 LYS C C 131 175.508 175.078 0.430 1
1 1578 . 3 1 1 A 131 131 LYS CA C 131 55.333 54.608 0.725 1
1 1579 . 3 1 1 A 131 131 LYS CB C 131 33.962 34.944 -0.982 1
1 1583 . 3 1 1 A 131 131 LYS N N 131 122.071 121.045 1.026 1
1 1584 . 3 1 1 A 132 132 PHE H H 132 9.436 9.591 -0.155 1
1 1585 . 3 1 1 A 132 132 PHE HA H 132 5.427 5.511 -0.084 1
1 1593 . 3 1 1 A 132 132 PHE C C 132 175.715 174.570 1.145 1
1 1594 . 3 1 1 A 132 132 PHE CA C 132 56.665 56.627 0.038 1
1 1595 . 3 1 1 A 132 132 PHE CB C 132 42.263 42.257 0.006 1
1 1599 . 3 1 1 A 132 132 PHE N N 132 125.247 122.836 2.411 1
1 1600 . 3 1 1 A 133 133 ASN H H 133 8.680 9.052 -0.372 1
1 1601 . 3 1 1 A 133 133 ASN HA H 133 5.249 5.131 0.118 1
1 1606 . 3 1 1 A 133 133 ASN C C 133 174.433 174.007 0.426 1
1 1607 . 3 1 1 A 133 133 ASN CA C 133 53.952 52.818 1.134 1
1 1608 . 3 1 1 A 133 133 ASN CB C 133 41.492 39.339 2.153 1
1 1609 . 3 1 1 A 133 133 ASN N N 133 122.056 121.406 0.650 1
1 1611 . 3 1 1 A 134 134 VAL H H 134 8.762 8.640 0.122 1
1 1612 . 3 1 1 A 134 134 VAL HA H 134 4.805 4.706 0.099 1
1 1620 . 3 1 1 A 134 134 VAL C C 134 173.555 175.116 -1.561 1
1 1621 . 3 1 1 A 134 134 VAL CA C 134 60.374 61.038 -0.664 1
1 1622 . 3 1 1 A 134 134 VAL CB C 134 34.848 33.085 1.763 1
1 1625 . 3 1 1 A 134 134 VAL N N 134 122.014 125.936 -3.922 1
1 1626 . 3 1 1 A 135 135 GLU H H 135 8.869 8.965 -0.096 1
1 1627 . 3 1 1 A 135 135 GLU HA H 135 5.240 4.919 0.321 1
1 1632 . 3 1 1 A 135 135 GLU C C 135 175.578 175.155 0.423 1
1 1633 . 3 1 1 A 135 135 GLU CA C 135 54.376 55.371 -0.995 1
1 1634 . 3 1 1 A 135 135 GLU CB C 135 33.264 31.030 2.234 1
1 1636 . 3 1 1 A 135 135 GLU N N 135 125.197 126.950 -1.753 1
1 1637 . 3 1 1 A 136 136 VAL H H 136 8.270 8.633 -0.363 1
1 1638 . 3 1 1 A 136 136 VAL HA H 136 4.066 4.399 -0.333 1
1 1646 . 3 1 1 A 136 136 VAL C C 136 176.119 175.416 0.703 1
1 1647 . 3 1 1 A 136 136 VAL CA C 136 62.910 62.557 0.353 1
1 1648 . 3 1 1 A 136 136 VAL CB C 136 30.573 32.034 -1.461 1
1 1651 . 3 1 1 A 136 136 VAL N N 136 126.347 127.600 -1.253 1
1 1652 . 3 1 1 A 137 137 VAL H H 137 8.865 8.571 0.294 1
1 1653 . 3 1 1 A 137 137 VAL HA H 137 4.022 4.001 0.021 1
1 1661 . 3 1 1 A 137 137 VAL C C 137 175.208 176.247 -1.039 1
1 1662 . 3 1 1 A 137 137 VAL CA C 137 64.424 64.491 -0.067 1
1 1663 . 3 1 1 A 137 137 VAL CB C 137 32.943 32.302 0.641 1
1 1666 . 3 1 1 A 137 137 VAL N N 137 130.810 130.620 0.190 1
1 1667 . 3 1 1 A 138 138 ALA H H 138 7.677 7.418 0.259 1
1 1668 . 3 1 1 A 138 138 ALA HA H 138 4.496 4.769 -0.273 1
1 1672 . 3 1 1 A 138 138 ALA C C 138 174.405 175.189 -0.784 1
1 1673 . 3 1 1 A 138 138 ALA CA C 138 52.556 51.668 0.888 1
1 1674 . 3 1 1 A 138 138 ALA CB C 138 21.874 22.600 -0.726 1
1 1675 . 3 1 1 A 138 138 ALA N N 138 119.194 118.038 1.156 1
1 1676 . 3 1 1 A 139 139 ILE H H 139 8.052 8.493 -0.441 1
1 1677 . 3 1 1 A 139 139 ILE HA H 139 4.640 4.831 -0.191 1
1 1687 . 3 1 1 A 139 139 ILE C C 139 173.734 174.477 -0.743 1
1 1688 . 3 1 1 A 139 139 ILE CA C 139 61.623 60.006 1.617 1
1 1689 . 3 1 1 A 139 139 ILE CB C 139 43.363 41.329 2.034 1
1 1693 . 3 1 1 A 139 139 ILE N N 139 119.307 120.463 -1.156 1
1 1694 . 3 1 1 A 140 140 ARG H H 140 8.912 8.826 0.086 1
1 1695 . 3 1 1 A 140 140 ARG HA H 140 4.760 4.666 0.094 1
1 1702 . 3 1 1 A 140 140 ARG C C 140 174.181 174.529 -0.348 1
1 1703 . 3 1 1 A 140 140 ARG CA C 140 54.243 54.629 -0.386 1
1 1704 . 3 1 1 A 140 140 ARG CB C 140 33.438 34.285 -0.847 1
1 1707 . 3 1 1 A 140 140 ARG N N 140 122.820 127.171 -4.351 1
1 1708 . 3 1 1 A 141 141 GLU H H 141 8.545 8.456 0.089 1
1 1709 . 3 1 1 A 141 141 GLU HA H 141 4.254 4.202 0.052 1
1 1714 . 3 1 1 A 141 141 GLU C C 141 177.299 176.132 1.167 1
1 1715 . 3 1 1 A 141 141 GLU CA C 141 57.165 56.662 0.503 1
1 1716 . 3 1 1 A 141 141 GLU CB C 141 30.048 29.732 0.316 1
1 1718 . 3 1 1 A 141 141 GLU N N 141 119.458 124.028 -4.570 1
1 1719 . 3 1 1 A 142 142 ALA H H 142 8.380 8.155 0.225 1
1 1720 . 3 1 1 A 142 142 ALA HA H 142 4.388 4.493 -0.105 1
1 1724 . 3 1 1 A 142 142 ALA C C 142 178.495 179.073 -0.578 1
1 1725 . 3 1 1 A 142 142 ALA CA C 142 51.113 51.962 -0.849 1
1 1726 . 3 1 1 A 142 142 ALA CB C 142 21.044 19.752 1.292 1
1 1727 . 3 1 1 A 142 142 ALA N N 142 127.330 127.446 -0.116 1
1 1728 . 3 1 1 A 143 143 THR H H 143 9.502 8.976 0.526 1
1 1729 . 3 1 1 A 143 143 THR HA H 143 4.362 4.747 -0.385 1
1 1734 . 3 1 1 A 143 143 THR C C 143 175.241 174.930 0.311 1
1 1735 . 3 1 1 A 143 143 THR CA C 143 60.541 61.033 -0.492 1
1 1736 . 3 1 1 A 143 143 THR CB C 143 70.879 68.678 2.201 1
1 1738 . 3 1 1 A 143 143 THR N N 143 114.561 110.781 3.780 1
1 1739 . 3 1 1 A 144 144 GLU H H 144 8.787 8.108 0.679 1
1 1740 . 3 1 1 A 144 144 GLU HA H 144 3.817 3.851 -0.034 1
1 1745 . 3 1 1 A 144 144 GLU C C 144 179.490 176.466 3.024 1
1 1746 . 3 1 1 A 144 144 GLU CA C 144 60.102 58.391 1.711 1
1 1747 . 3 1 1 A 144 144 GLU CB C 144 29.338 27.354 1.984 1
1 1749 . 3 1 1 A 144 144 GLU N N 144 120.475 115.249 5.226 1
1 1750 . 3 1 1 A 145 145 GLU H H 145 8.321 8.282 0.039 1
1 1751 . 3 1 1 A 145 145 GLU HA H 145 3.899 3.808 0.091 1
1 1756 . 3 1 1 A 145 145 GLU C C 145 178.521 179.298 -0.777 1
1 1757 . 3 1 1 A 145 145 GLU CA C 145 59.588 58.959 0.629 1
1 1758 . 3 1 1 A 145 145 GLU CB C 145 29.658 29.234 0.424 1
1 1760 . 3 1 1 A 145 145 GLU N N 145 119.761 119.413 0.348 1
1 1761 . 3 1 1 A 146 146 GLU H H 146 7.514 8.039 -0.525 1
1 1762 . 3 1 1 A 146 146 GLU HA H 146 3.856 4.027 -0.171 1
1 1767 . 3 1 1 A 146 146 GLU C C 146 179.189 179.171 0.018 1
1 1768 . 3 1 1 A 146 146 GLU CA C 146 59.148 59.110 0.038 1
1 1769 . 3 1 1 A 146 146 GLU CB C 146 29.834 29.004 0.830 1
1 1771 . 3 1 1 A 146 146 GLU N N 146 121.118 120.698 0.420 1
1 1772 . 3 1 1 A 147 147 LEU H H 147 7.823 8.076 -0.253 1
1 1773 . 3 1 1 A 147 147 LEU HA H 147 3.662 3.908 -0.246 1
1 1783 . 3 1 1 A 147 147 LEU C C 147 179.341 178.643 0.698 1
1 1784 . 3 1 1 A 147 147 LEU CA C 147 57.277 57.663 -0.386 1
1 1785 . 3 1 1 A 147 147 LEU CB C 147 41.239 41.679 -0.440 1
1 1789 . 3 1 1 A 147 147 LEU N N 147 117.199 120.563 -3.364 1
1 1790 . 3 1 1 A 148 148 ALA H H 148 7.788 8.745 -0.957 1
1 1791 . 3 1 1 A 148 148 ALA HA H 148 3.958 4.069 -0.111 1
1 1795 . 3 1 1 A 148 148 ALA C C 148 179.777 178.979 0.798 1
1 1796 . 3 1 1 A 148 148 ALA CA C 148 54.509 54.810 -0.301 1
1 1797 . 3 1 1 A 148 148 ALA CB C 148 18.064 18.427 -0.363 1
1 1798 . 3 1 1 A 148 148 ALA N N 148 121.696 120.675 1.021 1
1 1799 . 3 1 1 A 149 149 HIS H H 149 7.726 7.266 0.460 1
1 1800 . 3 1 1 A 149 149 HIS HA H 149 4.477 4.736 -0.259 1
1 1805 . 3 1 1 A 149 149 HIS C C 149 176.099 175.753 0.346 1
1 1806 . 3 1 1 A 149 149 HIS CA C 149 55.802 56.095 -0.293 1
1 1807 . 3 1 1 A 149 149 HIS CB C 149 30.406 30.663 -0.257 1
1 1810 . 3 1 1 A 149 149 HIS N N 149 114.463 112.722 1.741 1
1 1811 . 3 1 1 A 150 150 GLY H H 150 8.076 8.676 -0.600 1
1 1812 . 3 1 1 A 150 150 GLY HA2 H 150 3.927 3.652 0.275 1
1 1813 . 3 1 1 A 150 150 GLY HA3 H 150 3.237 3.817 -0.580 1
1 1814 . 3 1 1 A 150 150 GLY C C 150 173.382 173.326 0.056 1
1 1815 . 3 1 1 A 150 150 GLY CA C 150 46.117 46.039 0.078 1
1 1816 . 3 1 1 A 150 150 GLY N N 150 109.417 108.309 1.108 1
1 1817 . 3 1 1 A 151 151 HIS H H 151 7.518 7.975 -0.457 1
1 1818 . 3 1 1 A 151 151 HIS HA H 151 4.563 5.151 -0.588 1
1 1823 . 3 1 1 A 151 151 HIS C C 151 173.157 175.156 -1.999 1
1 1824 . 3 1 1 A 151 151 HIS CA C 151 54.731 54.258 0.473 1
1 1825 . 3 1 1 A 151 151 HIS CB C 151 31.611 34.190 -2.579 1
1 1828 . 3 1 1 A 151 151 HIS N N 151 114.828 117.427 -2.599 1
1 1829 . 3 1 1 A 152 152 VAL H H 152 7.931 8.886 -0.955 1
1 1830 . 3 1 1 A 152 152 VAL HA H 152 3.951 3.696 0.255 1
1 1838 . 3 1 1 A 152 152 VAL C C 152 175.848 175.977 -0.129 1
1 1839 . 3 1 1 A 152 152 VAL CA C 152 62.190 64.623 -2.433 1
1 1840 . 3 1 1 A 152 152 VAL CB C 152 32.703 33.027 -0.324 1
1 1843 . 3 1 1 A 152 152 VAL N N 152 118.551 122.818 -4.267 1
1 1844 . 3 1 1 A 153 153 HIS H H 153 9.784 8.292 1.492 1
1 1845 . 3 1 1 A 153 153 HIS HA H 153 4.604 4.517 0.087 1
1 1850 . 3 1 1 A 153 153 HIS C C 153 175.795 176.051 -0.256 1
1 1851 . 3 1 1 A 153 153 HIS CA C 153 56.753 58.218 -1.465 1
1 1852 . 3 1 1 A 153 153 HIS CB C 153 30.325 29.469 0.856 1
1 1855 . 3 1 1 A 153 153 HIS N N 153 127.403 120.296 7.107 1
1 1856 . 3 1 1 A 154 154 GLY H H 154 8.447 8.647 -0.200 1
1 1857 . 3 1 1 A 154 154 GLY HA2 H 154 3.797 3.709 0.088 1
1 1858 . 3 1 1 A 154 154 GLY HA3 H 154 3.797 3.785 0.012 1
1 1859 . 3 1 1 A 154 154 GLY C C 154 173.848 174.610 -0.762 1
1 1860 . 3 1 1 A 154 154 GLY CA C 154 45.153 47.163 -2.010 1
1 1861 . 3 1 1 A 154 154 GLY N N 154 112.233 106.018 6.215 1
1 1862 . 3 1 1 A 155 155 ALA H H 155 8.074 7.926 0.148 1
1 1863 . 3 1 1 A 155 155 ALA HA H 155 4.101 3.712 0.389 1
1 1867 . 3 1 1 A 155 155 ALA C C 155 177.651 177.153 0.498 1
1 1868 . 3 1 1 A 155 155 ALA CA C 155 52.795 54.118 -1.323 1
1 1869 . 3 1 1 A 155 155 ALA CB C 155 19.258 17.870 1.388 1
1 1870 . 3 1 1 A 155 155 ALA N N 155 124.092 119.961 4.131 1
1 1871 . 3 1 1 A 156 156 HIS H H 156 8.201 8.201 0.000 1
1 1872 . 3 1 1 A 156 156 HIS HA H 156 4.474 4.740 -0.266 1
1 1875 . 3 1 1 A 156 156 HIS C C 156 174.758 173.904 0.854 1
1 1876 . 3 1 1 A 156 156 HIS CA C 156 55.756 57.178 -1.422 1
1 1877 . 3 1 1 A 156 156 HIS CB C 156 30.060 31.986 -1.926 1
1 1878 . 3 1 1 A 156 156 HIS N N 156 118.170 118.436 -0.266 1
1 1879 . 3 1 1 A 157 157 ASP H H 157 8.001 8.371 -0.370 1
1 1880 . 3 1 1 A 157 157 ASP HA H 157 4.436 4.716 -0.280 1
1 1883 . 3 1 1 A 157 157 ASP CA C 157 54.185 52.849 1.336 1
1 1884 . 3 1 1 A 157 157 ASP CB C 157 41.016 41.582 -0.566 1
1 1885 . 3 1 1 A 157 157 ASP N N 157 121.683 116.730 4.953 1
1 1886 . 3 1 1 A 160 160 HIS HA H 160 4.502 4.860 -0.358 1
1 1889 . 3 1 1 A 160 160 HIS C C 160 174.722 174.305 0.417 1
1 1890 . 3 1 1 A 160 160 HIS CA C 160 55.979 54.891 1.088 1
1 1891 . 3 1 1 A 160 160 HIS CB C 160 30.058 29.989 0.069 1
1 1892 . 3 1 1 A 161 161 ASP H H 161 8.270 8.162 0.108 1
1 1893 . 3 1 1 A 161 161 ASP HA H 161 4.446 4.772 -0.326 1
1 1896 . 3 1 1 A 161 161 ASP C C 161 176.107 175.340 0.767 1
1 1897 . 3 1 1 A 161 161 ASP CA C 161 54.474 52.979 1.495 1
1 1898 . 3 1 1 A 161 161 ASP CB C 161 40.820 42.038 -1.218 1
1 1899 . 3 1 1 A 161 161 ASP N N 161 121.957 125.586 -3.629 1
1 1900 . 3 1 1 A 162 162 HIS H H 162 8.212 8.723 -0.511 1
1 1901 . 3 1 1 A 162 162 HIS HA H 162 4.289 4.748 -0.459 1
1 1904 . 3 1 1 A 162 162 HIS C C 162 175.036 174.798 0.238 1
1 1905 . 3 1 1 A 162 162 HIS CA C 162 56.185 56.535 -0.350 1
1 1906 . 3 1 1 A 162 162 HIS CB C 162 30.108 33.070 -2.962 1
1 1907 . 3 1 1 A 162 162 HIS N N 162 119.766 121.748 -1.982 1
1 1908 . 3 1 1 A 163 163 ASP H H 163 8.163 7.887 0.276 1
1 1909 . 3 1 1 A 163 163 ASP HA H 163 4.428 4.313 0.115 1
1 1912 . 3 1 1 A 163 163 ASP C C 163 176.161 175.579 0.582 1
1 1913 . 3 1 1 A 163 163 ASP CA C 163 54.585 54.511 0.074 1
1 1914 . 3 1 1 A 163 163 ASP CB C 163 40.823 41.985 -1.162 1
1 1915 . 3 1 1 A 163 163 ASP N N 163 121.265 119.406 1.859 1
1 1916 . 3 1 1 A 164 164 HIS H H 164 8.106 8.524 -0.418 1
1 1917 . 3 1 1 A 164 164 HIS HA H 164 4.422 4.945 -0.523 1
1 1920 . 3 1 1 A 164 164 HIS C C 164 174.904 174.753 0.151 1
1 1921 . 3 1 1 A 164 164 HIS CA C 164 56.361 54.225 2.136 1
1 1922 . 3 1 1 A 164 164 HIS CB C 164 30.305 30.060 0.245 1
1 1923 . 3 1 1 A 164 164 HIS N N 164 119.729 116.878 2.851 1
1 1924 . 3 1 1 A 165 165 ASP H H 165 8.118 7.714 0.404 1
1 1925 . 3 1 1 A 165 165 ASP HA H 165 4.394 4.612 -0.218 1
1 1928 . 3 1 1 A 165 165 ASP C C 165 176.054 175.617 0.437 1
1 1929 . 3 1 1 A 165 165 ASP CA C 165 54.364 55.183 -0.819 1
1 1930 . 3 1 1 A 165 165 ASP CB C 165 40.818 41.275 -0.457 1
1 1931 . 3 1 1 A 165 165 ASP N N 165 121.062 121.976 -0.914 1
1 1932 . 3 1 1 A 166 166 HIS H H 166 8.092 8.906 -0.814 1
1 1933 . 3 1 1 A 166 166 HIS CA C 166 56.114 55.140 0.974 1
1 1934 . 3 1 1 A 166 166 HIS CB C 166 29.702 30.593 -0.891 1
1 1935 . 3 1 1 A 166 166 HIS N N 166 120.001 124.502 -4.501 1
1 1936 . 3 1 1 A 170 170 HIS HA H 170 4.514 4.190 0.324 1
1 1939 . 3 1 1 A 170 170 HIS C C 170 173.952 173.518 0.434 1
1 1940 . 3 1 1 A 170 170 HIS CA C 170 55.995 57.116 -1.121 1
1 1941 . 3 1 1 A 170 170 HIS CB C 170 30.161 29.412 0.749 1
1 14 . 4 1 1 A 2 2 LYS H H 2 7.540 8.438 -0.898 1
1 15 . 4 1 1 A 2 2 LYS HA H 2 4.729 4.721 0.008 1
1 24 . 4 1 1 A 2 2 LYS C C 2 175.948 175.533 0.415 1
1 25 . 4 1 1 A 2 2 LYS CA C 2 53.978 55.320 -1.342 1
1 26 . 4 1 1 A 2 2 LYS CB C 2 35.985 33.603 2.382 1
1 30 . 4 1 1 A 2 2 LYS N N 2 120.764 119.105 1.659 1
1 31 . 4 1 1 A 3 3 VAL H H 3 8.738 8.474 0.264 1
1 32 . 4 1 1 A 3 3 VAL HA H 3 2.800 4.463 -1.663 1
1 40 . 4 1 1 A 3 3 VAL C C 3 175.018 175.108 -0.090 1
1 41 . 4 1 1 A 3 3 VAL CA C 3 66.598 61.277 5.321 1
1 42 . 4 1 1 A 3 3 VAL CB C 3 31.218 32.390 -1.172 1
1 45 . 4 1 1 A 3 3 VAL N N 3 120.055 121.856 -1.801 1
1 46 . 4 1 1 A 4 4 ALA H H 4 6.584 8.678 -2.094 1
1 47 . 4 1 1 A 4 4 ALA HA H 4 4.223 4.649 -0.426 1
1 51 . 4 1 1 A 4 4 ALA C C 4 174.117 175.539 -1.422 1
1 52 . 4 1 1 A 4 4 ALA CA C 4 50.358 50.862 -0.504 1
1 53 . 4 1 1 A 4 4 ALA CB C 4 22.137 22.816 -0.679 1
1 54 . 4 1 1 A 4 4 ALA N N 4 129.800 129.977 -0.177 1
1 55 . 4 1 1 A 5 5 LYS H H 5 8.596 8.489 0.107 1
1 56 . 4 1 1 A 5 5 LYS HA H 5 3.793 4.155 -0.362 1
1 65 . 4 1 1 A 5 5 LYS C C 5 175.260 177.015 -1.755 1
1 66 . 4 1 1 A 5 5 LYS CA C 5 57.700 56.816 0.884 1
1 67 . 4 1 1 A 5 5 LYS CB C 5 32.400 32.993 -0.593 1
1 71 . 4 1 1 A 5 5 LYS N N 5 118.708 120.016 -1.308 1
1 72 . 4 1 1 A 6 6 ASP H H 6 8.679 8.684 -0.005 1
1 73 . 4 1 1 A 6 6 ASP HA H 6 4.040 4.502 -0.462 1
1 76 . 4 1 1 A 6 6 ASP C C 6 173.331 174.950 -1.619 1
1 77 . 4 1 1 A 6 6 ASP CA C 6 57.508 55.292 2.216 1
1 78 . 4 1 1 A 6 6 ASP CB C 6 37.604 38.746 -1.142 1
1 79 . 4 1 1 A 6 6 ASP N N 6 115.415 125.642 -10.227 1
1 80 . 4 1 1 A 7 7 LEU H H 7 7.376 7.777 -0.401 1
1 81 . 4 1 1 A 7 7 LEU HA H 7 4.689 4.945 -0.256 1
1 91 . 4 1 1 A 7 7 LEU C C 7 175.906 175.466 0.440 1
1 92 . 4 1 1 A 7 7 LEU CA C 7 53.509 53.221 0.288 1
1 93 . 4 1 1 A 7 7 LEU CB C 7 42.419 44.140 -1.721 1
1 97 . 4 1 1 A 7 7 LEU N N 7 117.619 121.409 -3.790 1
1 98 . 4 1 1 A 8 8 VAL H H 8 8.646 9.225 -0.579 1
1 99 . 4 1 1 A 8 8 VAL HA H 8 4.397 5.103 -0.706 1
1 107 . 4 1 1 A 8 8 VAL C C 8 175.244 174.942 0.302 1
1 108 . 4 1 1 A 8 8 VAL CA C 8 62.028 59.697 2.331 1
1 109 . 4 1 1 A 8 8 VAL CB C 8 31.515 34.981 -3.466 1
1 112 . 4 1 1 A 8 8 VAL N N 8 121.164 121.300 -0.136 1
1 113 . 4 1 1 A 9 9 VAL H H 9 8.607 8.737 -0.130 1
1 114 . 4 1 1 A 9 9 VAL HA H 9 4.281 5.241 -0.960 1
1 122 . 4 1 1 A 9 9 VAL C C 9 174.156 174.610 -0.454 1
1 123 . 4 1 1 A 9 9 VAL CA C 9 60.614 58.736 1.878 1
1 124 . 4 1 1 A 9 9 VAL CB C 9 33.985 35.870 -1.885 1
1 127 . 4 1 1 A 9 9 VAL N N 9 134.014 122.154 11.860 1
1 128 . 4 1 1 A 10 10 SER H H 10 8.684 8.926 -0.242 1
1 129 . 4 1 1 A 10 10 SER HA H 10 5.736 5.494 0.242 1
1 132 . 4 1 1 A 10 10 SER C C 10 173.544 173.473 0.071 1
1 133 . 4 1 1 A 10 10 SER CA C 10 56.533 57.755 -1.222 1
1 134 . 4 1 1 A 10 10 SER CB C 10 63.385 64.798 -1.413 1
1 135 . 4 1 1 A 10 10 SER N N 10 121.492 118.798 2.694 1
1 136 . 4 1 1 A 11 11 LEU H H 11 9.939 8.738 1.201 1
1 137 . 4 1 1 A 11 11 LEU HA H 11 5.133 5.374 -0.241 1
1 147 . 4 1 1 A 11 11 LEU C C 11 174.843 175.178 -0.335 1
1 148 . 4 1 1 A 11 11 LEU CA C 11 53.770 52.940 0.830 1
1 149 . 4 1 1 A 11 11 LEU CB C 11 47.469 46.073 1.396 1
1 153 . 4 1 1 A 11 11 LEU N N 11 128.460 121.433 7.027 1
1 154 . 4 1 1 A 12 12 ALA H H 12 8.770 9.213 -0.443 1
1 155 . 4 1 1 A 12 12 ALA HA H 12 4.830 5.109 -0.279 1
1 159 . 4 1 1 A 12 12 ALA C C 12 176.974 175.506 1.468 1
1 160 . 4 1 1 A 12 12 ALA CA C 12 50.231 50.764 -0.533 1
1 161 . 4 1 1 A 12 12 ALA CB C 12 21.270 20.655 0.615 1
1 162 . 4 1 1 A 12 12 ALA N N 12 127.500 121.702 5.798 1
1 163 . 4 1 1 A 13 13 TYR H H 13 8.749 8.844 -0.095 1
1 164 . 4 1 1 A 13 13 TYR HA H 13 5.797 6.056 -0.259 1
1 171 . 4 1 1 A 13 13 TYR C C 13 173.952 172.810 1.142 1
1 172 . 4 1 1 A 13 13 TYR CA C 13 56.390 55.289 1.101 1
1 173 . 4 1 1 A 13 13 TYR CB C 13 41.159 41.515 -0.356 1
1 176 . 4 1 1 A 13 13 TYR N N 13 117.737 120.054 -2.317 1
1 177 . 4 1 1 A 14 14 GLN H H 14 8.492 8.653 -0.161 1
1 178 . 4 1 1 A 14 14 GLN HA H 14 4.611 5.038 -0.427 1
1 185 . 4 1 1 A 14 14 GLN C C 14 174.492 173.687 0.805 1
1 186 . 4 1 1 A 14 14 GLN CA C 14 55.626 54.453 1.173 1
1 187 . 4 1 1 A 14 14 GLN CB C 14 32.734 31.708 1.026 1
1 189 . 4 1 1 A 14 14 GLN N N 14 116.962 120.310 -3.348 1
1 191 . 4 1 1 A 15 15 VAL H H 15 8.403 8.834 -0.431 1
1 192 . 4 1 1 A 15 15 VAL HA H 15 4.614 5.352 -0.738 1
1 200 . 4 1 1 A 15 15 VAL C C 15 173.389 174.971 -1.582 1
1 201 . 4 1 1 A 15 15 VAL CA C 15 59.711 60.420 -0.709 1
1 202 . 4 1 1 A 15 15 VAL CB C 15 33.639 34.209 -0.570 1
1 205 . 4 1 1 A 15 15 VAL N N 15 121.203 126.969 -5.766 1
1 206 . 4 1 1 A 16 16 ARG H H 16 8.584 9.052 -0.468 1
1 207 . 4 1 1 A 16 16 ARG HA H 16 5.584 5.071 0.513 1
1 214 . 4 1 1 A 16 16 ARG C C 16 176.585 174.804 1.781 1
1 215 . 4 1 1 A 16 16 ARG CA C 16 53.453 53.885 -0.432 1
1 216 . 4 1 1 A 16 16 ARG CB C 16 34.968 33.905 1.063 1
1 219 . 4 1 1 A 16 16 ARG N N 16 126.883 126.551 0.332 1
1 220 . 4 1 1 A 17 17 THR H H 17 8.270 8.630 -0.360 1
1 221 . 4 1 1 A 17 17 THR HA H 17 4.573 4.523 0.050 1
1 226 . 4 1 1 A 17 17 THR C C 17 177.860 176.226 1.634 1
1 227 . 4 1 1 A 17 17 THR CA C 17 61.073 60.723 0.350 1
1 228 . 4 1 1 A 17 17 THR CB C 17 69.823 71.378 -1.555 1
1 230 . 4 1 1 A 17 17 THR N N 17 109.730 113.139 -3.409 1
1 231 . 4 1 1 A 18 18 GLU H H 18 9.147 8.900 0.247 1
1 232 . 4 1 1 A 18 18 GLU HA H 18 3.770 3.982 -0.212 1
1 237 . 4 1 1 A 18 18 GLU C C 18 176.683 177.823 -1.140 1
1 238 . 4 1 1 A 18 18 GLU CA C 18 59.866 59.645 0.221 1
1 239 . 4 1 1 A 18 18 GLU CB C 18 29.752 29.116 0.636 1
1 241 . 4 1 1 A 18 18 GLU N N 18 122.491 121.135 1.356 1
1 242 . 4 1 1 A 19 19 ASP H H 19 7.900 7.641 0.259 1
1 243 . 4 1 1 A 19 19 ASP HA H 19 4.456 4.700 -0.244 1
1 246 . 4 1 1 A 19 19 ASP C C 19 176.670 176.235 0.435 1
1 247 . 4 1 1 A 19 19 ASP CA C 19 53.833 54.106 -0.273 1
1 248 . 4 1 1 A 19 19 ASP CB C 19 40.180 41.263 -1.083 1
1 249 . 4 1 1 A 19 19 ASP N N 19 116.200 117.499 -1.299 1
1 250 . 4 1 1 A 20 20 GLY H H 20 8.149 7.911 0.238 1
1 251 . 4 1 1 A 20 20 GLY HA2 H 20 4.145 3.955 0.190 1
1 252 . 4 1 1 A 20 20 GLY HA3 H 20 3.531 3.967 -0.436 1
1 253 . 4 1 1 A 20 20 GLY C C 20 173.987 174.437 -0.450 1
1 254 . 4 1 1 A 20 20 GLY CA C 20 45.463 45.030 0.433 1
1 255 . 4 1 1 A 20 20 GLY N N 20 108.869 107.265 1.604 1
1 256 . 4 1 1 A 21 21 VAL H H 21 7.261 7.880 -0.619 1
1 257 . 4 1 1 A 21 21 VAL HA H 21 3.645 4.067 -0.422 1
1 265 . 4 1 1 A 21 21 VAL C C 21 175.265 174.874 0.391 1
1 266 . 4 1 1 A 21 21 VAL CA C 21 63.368 62.303 1.065 1
1 267 . 4 1 1 A 21 21 VAL CB C 21 31.614 32.532 -0.918 1
1 270 . 4 1 1 A 21 21 VAL N N 21 124.283 121.775 2.508 1
1 271 . 4 1 1 A 22 22 LEU H H 22 8.407 8.366 0.041 1
1 272 . 4 1 1 A 22 22 LEU HA H 22 4.333 4.510 -0.177 1
1 282 . 4 1 1 A 22 22 LEU C C 22 176.660 176.804 -0.144 1
1 283 . 4 1 1 A 22 22 LEU CA C 22 55.724 54.996 0.728 1
1 284 . 4 1 1 A 22 22 LEU CB C 22 42.272 42.666 -0.394 1
1 288 . 4 1 1 A 22 22 LEU N N 22 128.533 128.927 -0.394 1
1 289 . 4 1 1 A 23 23 VAL H H 23 8.887 8.880 0.007 1
1 290 . 4 1 1 A 23 23 VAL HA H 23 4.237 4.386 -0.149 1
1 298 . 4 1 1 A 23 23 VAL C C 23 175.265 175.646 -0.381 1
1 299 . 4 1 1 A 23 23 VAL CA C 23 62.348 62.230 0.118 1
1 300 . 4 1 1 A 23 23 VAL CB C 23 33.383 33.175 0.208 1
1 303 . 4 1 1 A 23 23 VAL N N 23 125.041 121.577 3.464 1
1 304 . 4 1 1 A 24 24 ASP H H 24 7.480 7.409 0.071 1
1 305 . 4 1 1 A 24 24 ASP HA H 24 4.763 5.103 -0.340 1
1 308 . 4 1 1 A 24 24 ASP C C 24 173.160 173.877 -0.717 1
1 309 . 4 1 1 A 24 24 ASP CA C 24 53.893 53.688 0.205 1
1 310 . 4 1 1 A 24 24 ASP CB C 24 43.680 44.228 -0.548 1
1 311 . 4 1 1 A 24 24 ASP N N 24 117.159 120.129 -2.970 1
1 312 . 4 1 1 A 25 25 GLU H H 25 8.187 8.694 -0.507 1
1 313 . 4 1 1 A 25 25 GLU HA H 25 4.491 4.452 0.039 1
1 318 . 4 1 1 A 25 25 GLU C C 25 174.586 173.717 0.869 1
1 319 . 4 1 1 A 25 25 GLU CA C 25 55.475 56.068 -0.593 1
1 320 . 4 1 1 A 25 25 GLU CB C 25 33.033 34.298 -1.265 1
1 322 . 4 1 1 A 25 25 GLU N N 25 118.821 123.380 -4.559 1
1 323 . 4 1 1 A 26 26 SER H H 26 8.003 8.718 -0.715 1
1 324 . 4 1 1 A 26 26 SER HA H 26 4.782 5.000 -0.218 1
1 327 . 4 1 1 A 26 26 SER CA C 26 56.490 54.742 1.748 1
1 328 . 4 1 1 A 26 26 SER CB C 26 64.977 64.449 0.528 1
1 329 . 4 1 1 A 26 26 SER N N 26 119.346 122.274 -2.928 1
1 330 . 4 1 1 A 27 27 PRO HA H 27 4.633 4.601 0.032 1
1 337 . 4 1 1 A 27 27 PRO C C 27 177.016 177.495 -0.479 1
1 338 . 4 1 1 A 27 27 PRO CA C 27 61.943 62.656 -0.713 1
1 339 . 4 1 1 A 27 27 PRO CB C 27 32.492 33.158 -0.666 1
1 342 . 4 1 1 A 28 28 VAL H H 28 8.383 8.660 -0.277 1
1 343 . 4 1 1 A 28 28 VAL HA H 28 3.385 3.756 -0.371 1
1 351 . 4 1 1 A 28 28 VAL C C 28 176.069 177.257 -1.188 1
1 352 . 4 1 1 A 28 28 VAL CA C 28 65.888 65.187 0.701 1
1 353 . 4 1 1 A 28 28 VAL CB C 28 31.220 31.602 -0.382 1
1 356 . 4 1 1 A 28 28 VAL N N 28 119.349 122.212 -2.863 1
1 357 . 4 1 1 A 29 29 SER H H 29 7.365 7.793 -0.428 1
1 358 . 4 1 1 A 29 29 SER HA H 29 4.101 4.384 -0.283 1
1 361 . 4 1 1 A 29 29 SER C C 29 174.535 174.720 -0.185 1
1 362 . 4 1 1 A 29 29 SER CA C 29 58.609 60.108 -1.499 1
1 363 . 4 1 1 A 29 29 SER CB C 29 63.198 63.603 -0.405 1
1 364 . 4 1 1 A 29 29 SER N N 29 109.365 114.078 -4.713 1
1 365 . 4 1 1 A 30 30 ALA H H 30 7.457 7.786 -0.329 1
1 366 . 4 1 1 A 30 30 ALA HA H 30 4.548 4.715 -0.167 1
1 370 . 4 1 1 A 30 30 ALA CA C 30 50.789 49.432 1.357 1
1 371 . 4 1 1 A 30 30 ALA CB C 30 18.608 21.330 -2.722 1
1 372 . 4 1 1 A 30 30 ALA N N 30 126.056 122.374 3.682 1
1 373 . 4 1 1 A 31 31 PRO HA H 31 4.332 5.067 -0.735 1
1 380 . 4 1 1 A 31 31 PRO C C 31 175.841 176.124 -0.283 1
1 381 . 4 1 1 A 31 31 PRO CA C 31 62.996 62.489 0.507 1
1 382 . 4 1 1 A 31 31 PRO CB C 31 32.696 32.578 0.118 1
1 385 . 4 1 1 A 32 32 LEU H H 32 8.717 9.131 -0.414 1
1 386 . 4 1 1 A 32 32 LEU HA H 32 4.452 4.907 -0.455 1
1 396 . 4 1 1 A 32 32 LEU C C 32 175.298 174.486 0.812 1
1 397 . 4 1 1 A 32 32 LEU CA C 32 54.510 54.650 -0.140 1
1 398 . 4 1 1 A 32 32 LEU CB C 32 43.899 43.995 -0.096 1
1 402 . 4 1 1 A 32 32 LEU N N 32 123.702 122.354 1.348 1
1 403 . 4 1 1 A 33 33 ASP H H 33 8.258 8.816 -0.558 1
1 404 . 4 1 1 A 33 33 ASP HA H 33 5.919 5.508 0.411 1
1 407 . 4 1 1 A 33 33 ASP C C 33 175.927 174.599 1.328 1
1 408 . 4 1 1 A 33 33 ASP CA C 33 52.619 52.856 -0.237 1
1 409 . 4 1 1 A 33 33 ASP CB C 33 42.205 43.103 -0.898 1
1 410 . 4 1 1 A 33 33 ASP N N 33 128.453 126.175 2.278 1
1 411 . 4 1 1 A 34 34 TYR H H 34 9.144 8.575 0.569 1
1 412 . 4 1 1 A 34 34 TYR HA H 34 4.689 4.844 -0.155 1
1 419 . 4 1 1 A 34 34 TYR C C 34 170.622 173.955 -3.333 1
1 420 . 4 1 1 A 34 34 TYR CA C 34 55.930 56.593 -0.663 1
1 421 . 4 1 1 A 34 34 TYR CB C 34 41.905 42.556 -0.651 1
1 424 . 4 1 1 A 34 34 TYR N N 34 121.657 120.079 1.578 1
1 425 . 4 1 1 A 35 35 LEU H H 35 8.324 8.564 -0.240 1
1 426 . 4 1 1 A 35 35 LEU HA H 35 4.396 4.774 -0.378 1
1 436 . 4 1 1 A 35 35 LEU C C 35 175.301 176.252 -0.951 1
1 437 . 4 1 1 A 35 35 LEU CA C 35 52.909 54.194 -1.285 1
1 438 . 4 1 1 A 35 35 LEU CB C 35 42.816 43.069 -0.253 1
1 442 . 4 1 1 A 35 35 LEU N N 35 124.514 124.088 0.426 1
1 443 . 4 1 1 A 36 36 HIS H H 36 8.763 8.585 0.178 1
1 444 . 4 1 1 A 36 36 HIS HA H 36 4.382 4.307 0.075 1
1 449 . 4 1 1 A 36 36 HIS C C 36 176.514 176.330 0.184 1
1 450 . 4 1 1 A 36 36 HIS CA C 36 59.570 57.759 1.811 1
1 451 . 4 1 1 A 36 36 HIS CB C 36 31.257 29.641 1.616 1
1 454 . 4 1 1 A 36 36 HIS N N 36 132.209 126.254 5.955 1
1 455 . 4 1 1 A 37 37 GLY H H 37 8.745 8.399 0.346 1
1 456 . 4 1 1 A 37 37 GLY HA2 H 37 4.021 3.841 0.180 1
1 457 . 4 1 1 A 37 37 GLY HA3 H 37 3.592 3.987 -0.395 1
1 458 . 4 1 1 A 37 37 GLY C C 37 175.081 174.227 0.854 1
1 459 . 4 1 1 A 37 37 GLY CA C 37 45.621 46.050 -0.429 1
1 460 . 4 1 1 A 37 37 GLY N N 37 117.737 114.662 3.075 1
1 461 . 4 1 1 A 38 38 HIS H H 38 8.470 8.205 0.265 1
1 462 . 4 1 1 A 38 38 HIS HA H 38 4.584 4.673 -0.089 1
1 467 . 4 1 1 A 38 38 HIS C C 38 175.334 175.474 -0.140 1
1 468 . 4 1 1 A 38 38 HIS CA C 38 55.899 56.155 -0.256 1
1 469 . 4 1 1 A 38 38 HIS CB C 38 30.865 31.924 -1.059 1
1 472 . 4 1 1 A 38 38 HIS N N 38 119.813 117.013 2.800 1
1 473 . 4 1 1 A 39 39 GLY H H 39 8.936 7.957 0.979 1
1 474 . 4 1 1 A 39 39 GLY HA2 H 39 3.895 3.851 0.044 1
1 475 . 4 1 1 A 39 39 GLY HA3 H 39 3.895 3.891 0.004 1
1 476 . 4 1 1 A 39 39 GLY C C 39 175.557 175.305 0.252 1
1 477 . 4 1 1 A 39 39 GLY CA C 39 46.938 45.476 1.462 1
1 478 . 4 1 1 A 39 39 GLY N N 39 112.442 107.560 4.882 1
1 479 . 4 1 1 A 40 40 SER H H 40 9.249 7.991 1.258 1
1 480 . 4 1 1 A 40 40 SER HA H 40 4.299 3.775 0.524 1
1 483 . 4 1 1 A 40 40 SER C C 40 174.138 174.441 -0.303 1
1 484 . 4 1 1 A 40 40 SER CA C 40 60.809 62.061 -1.252 1
1 485 . 4 1 1 A 40 40 SER CB C 40 64.041 63.195 0.846 1
1 486 . 4 1 1 A 40 40 SER N N 40 117.098 113.540 3.558 1
1 487 . 4 1 1 A 41 41 LEU H H 41 7.386 7.186 0.200 1
1 488 . 4 1 1 A 41 41 LEU HA H 41 4.429 4.472 -0.043 1
1 498 . 4 1 1 A 41 41 LEU C C 41 176.526 175.421 1.105 1
1 499 . 4 1 1 A 41 41 LEU CA C 41 52.295 52.965 -0.670 1
1 500 . 4 1 1 A 41 41 LEU CB C 41 44.147 44.130 0.017 1
1 504 . 4 1 1 A 41 41 LEU N N 41 120.541 115.091 5.450 1
1 505 . 4 1 1 A 42 42 ILE H H 42 7.407 8.080 -0.673 1
1 506 . 4 1 1 A 42 42 ILE HA H 42 3.756 4.052 -0.296 1
1 516 . 4 1 1 A 42 42 ILE C C 42 178.081 176.772 1.309 1
1 517 . 4 1 1 A 42 42 ILE CA C 42 62.257 61.321 0.936 1
1 518 . 4 1 1 A 42 42 ILE CB C 42 38.256 38.479 -0.223 1
1 522 . 4 1 1 A 42 42 ILE N N 42 115.050 116.344 -1.294 1
1 523 . 4 1 1 A 43 43 SER H H 43 8.581 8.856 -0.275 1
1 524 . 4 1 1 A 43 43 SER HA H 43 3.957 4.123 -0.166 1
1 527 . 4 1 1 A 43 43 SER C C 43 177.830 176.799 1.031 1
1 528 . 4 1 1 A 43 43 SER CA C 43 61.958 61.053 0.905 1
1 529 . 4 1 1 A 43 43 SER CB C 43 62.680 62.518 0.162 1
1 530 . 4 1 1 A 43 43 SER N N 43 121.456 119.132 2.324 1
1 531 . 4 1 1 A 44 44 GLY H H 44 8.892 8.213 0.679 1
1 532 . 4 1 1 A 44 44 GLY HA2 H 44 3.514 3.866 -0.352 1
1 533 . 4 1 1 A 44 44 GLY HA3 H 44 3.854 3.878 -0.024 1
1 534 . 4 1 1 A 44 44 GLY C C 44 175.296 175.555 -0.259 1
1 535 . 4 1 1 A 44 44 GLY CA C 44 46.854 47.258 -0.404 1
1 536 . 4 1 1 A 44 44 GLY N N 44 106.351 108.386 -2.035 1
1 537 . 4 1 1 A 45 45 LEU H H 45 6.824 7.894 -1.070 1
1 538 . 4 1 1 A 45 45 LEU HA H 45 3.909 4.053 -0.144 1
1 548 . 4 1 1 A 45 45 LEU C C 45 176.738 178.516 -1.778 1
1 549 . 4 1 1 A 45 45 LEU CA C 45 56.356 57.074 -0.718 1
1 550 . 4 1 1 A 45 45 LEU CB C 45 42.296 41.152 1.144 1
1 554 . 4 1 1 A 45 45 LEU N N 45 119.207 123.194 -3.987 1
1 555 . 4 1 1 A 46 46 GLU H H 46 7.556 7.923 -0.367 1
1 556 . 4 1 1 A 46 46 GLU HA H 46 3.664 4.025 -0.361 1
1 561 . 4 1 1 A 46 46 GLU C C 46 179.231 179.649 -0.418 1
1 562 . 4 1 1 A 46 46 GLU CA C 46 62.316 59.680 2.636 1
1 563 . 4 1 1 A 46 46 GLU CB C 46 29.147 29.076 0.071 1
1 565 . 4 1 1 A 46 46 GLU N N 46 119.049 118.188 0.861 1
1 566 . 4 1 1 A 47 47 THR H H 47 8.219 8.407 -0.188 1
1 567 . 4 1 1 A 47 47 THR HA H 47 3.965 3.940 0.025 1
1 572 . 4 1 1 A 47 47 THR C C 47 176.251 176.452 -0.201 1
1 573 . 4 1 1 A 47 47 THR CA C 47 65.947 66.103 -0.156 1
1 574 . 4 1 1 A 47 47 THR CB C 47 69.014 68.333 0.681 1
1 576 . 4 1 1 A 47 47 THR N N 47 111.770 117.606 -5.836 1
1 577 . 4 1 1 A 48 48 ALA H H 48 6.794 8.015 -1.221 1
1 578 . 4 1 1 A 48 48 ALA HA H 48 4.171 4.200 -0.029 1
1 582 . 4 1 1 A 48 48 ALA C C 48 178.639 180.535 -1.896 1
1 583 . 4 1 1 A 48 48 ALA CA C 48 54.072 55.179 -1.107 1
1 584 . 4 1 1 A 48 48 ALA CB C 48 19.752 18.653 1.099 1
1 585 . 4 1 1 A 48 48 ALA N N 48 122.697 123.539 -0.842 1
1 586 . 4 1 1 A 49 49 LEU H H 49 7.691 7.997 -0.306 1
1 587 . 4 1 1 A 49 49 LEU HA H 49 3.902 4.509 -0.607 1
1 597 . 4 1 1 A 49 49 LEU C C 49 176.823 178.055 -1.232 1
1 598 . 4 1 1 A 49 49 LEU CA C 49 57.190 57.829 -0.639 1
1 599 . 4 1 1 A 49 49 LEU CB C 49 43.628 42.106 1.522 1
1 603 . 4 1 1 A 49 49 LEU N N 49 117.159 117.594 -0.435 1
1 604 . 4 1 1 A 50 50 GLU H H 50 6.963 7.892 -0.929 1
1 605 . 4 1 1 A 50 50 GLU HA H 50 3.220 4.335 -1.115 1
1 610 . 4 1 1 A 50 50 GLU C C 50 176.691 177.462 -0.771 1
1 611 . 4 1 1 A 50 50 GLU CA C 50 58.769 58.655 0.114 1
1 612 . 4 1 1 A 50 50 GLU CB C 50 29.792 29.398 0.394 1
1 614 . 4 1 1 A 50 50 GLU N N 50 118.761 119.579 -0.818 1
1 615 . 4 1 1 A 51 51 GLY H H 51 8.541 8.537 0.004 1
1 616 . 4 1 1 A 51 51 GLY HA2 H 51 4.140 3.796 0.344 1
1 617 . 4 1 1 A 51 51 GLY HA3 H 51 3.488 3.869 -0.381 1
1 618 . 4 1 1 A 51 51 GLY C C 51 173.801 174.391 -0.590 1
1 619 . 4 1 1 A 51 51 GLY CA C 51 45.498 44.882 0.616 1
1 620 . 4 1 1 A 51 51 GLY N N 51 113.511 112.624 0.887 1
1 621 . 4 1 1 A 52 52 HIS H H 52 7.656 7.584 0.072 1
1 622 . 4 1 1 A 52 52 HIS HA H 52 4.318 4.710 -0.392 1
1 627 . 4 1 1 A 52 52 HIS C C 52 172.815 174.189 -1.374 1
1 628 . 4 1 1 A 52 52 HIS CA C 52 57.562 56.035 1.527 1
1 629 . 4 1 1 A 52 52 HIS CB C 52 28.670 32.737 -4.067 1
1 632 . 4 1 1 A 52 52 HIS N N 52 116.844 118.955 -2.111 1
1 633 . 4 1 1 A 53 53 GLU H H 53 8.331 9.032 -0.701 1
1 634 . 4 1 1 A 53 53 GLU HA H 53 4.636 4.794 -0.158 1
1 639 . 4 1 1 A 53 53 GLU C C 53 176.145 176.277 -0.132 1
1 640 . 4 1 1 A 53 53 GLU CA C 53 54.891 54.598 0.293 1
1 641 . 4 1 1 A 53 53 GLU CB C 53 33.837 33.407 0.430 1
1 643 . 4 1 1 A 53 53 GLU N N 53 118.873 119.074 -0.201 1
1 644 . 4 1 1 A 54 54 VAL H H 54 8.585 8.398 0.187 1
1 645 . 4 1 1 A 54 54 VAL HA H 54 3.227 4.022 -0.795 1
1 653 . 4 1 1 A 54 54 VAL C C 54 177.218 176.495 0.723 1
1 654 . 4 1 1 A 54 54 VAL CA C 54 65.848 63.424 2.424 1
1 655 . 4 1 1 A 54 54 VAL CB C 54 31.189 31.589 -0.400 1
1 658 . 4 1 1 A 54 54 VAL N N 54 120.580 120.392 0.188 1
1 659 . 4 1 1 A 55 55 GLY H H 55 8.912 9.388 -0.476 1
1 660 . 4 1 1 A 55 55 GLY HA2 H 55 4.441 4.005 0.436 1
1 661 . 4 1 1 A 55 55 GLY HA3 H 55 3.865 4.006 -0.141 1
1 662 . 4 1 1 A 55 55 GLY C C 55 174.827 174.105 0.722 1
1 663 . 4 1 1 A 55 55 GLY CA C 55 44.370 45.165 -0.795 1
1 664 . 4 1 1 A 55 55 GLY N N 55 118.078 114.823 3.255 1
1 665 . 4 1 1 A 56 56 ASP H H 56 8.098 7.779 0.319 1
1 666 . 4 1 1 A 56 56 ASP HA H 56 4.547 4.686 -0.139 1
1 669 . 4 1 1 A 56 56 ASP C C 56 174.859 175.191 -0.332 1
1 670 . 4 1 1 A 56 56 ASP CA C 56 55.629 54.263 1.366 1
1 671 . 4 1 1 A 56 56 ASP CB C 56 40.906 42.420 -1.514 1
1 672 . 4 1 1 A 56 56 ASP N N 56 123.094 122.248 0.846 1
1 673 . 4 1 1 A 57 57 LYS H H 57 8.168 8.519 -0.351 1
1 674 . 4 1 1 A 57 57 LYS HA H 57 5.471 5.374 0.097 1
1 683 . 4 1 1 A 57 57 LYS C C 57 175.732 174.785 0.947 1
1 684 . 4 1 1 A 57 57 LYS CA C 57 55.056 55.541 -0.485 1
1 685 . 4 1 1 A 57 57 LYS CB C 57 35.302 35.937 -0.635 1
1 689 . 4 1 1 A 57 57 LYS N N 57 122.301 123.766 -1.465 1
1 690 . 4 1 1 A 58 58 PHE H H 58 8.355 8.371 -0.016 1
1 691 . 4 1 1 A 58 58 PHE HA H 58 4.858 5.138 -0.280 1
1 699 . 4 1 1 A 58 58 PHE C C 58 171.549 172.010 -0.461 1
1 700 . 4 1 1 A 58 58 PHE CA C 58 56.195 56.297 -0.102 1
1 701 . 4 1 1 A 58 58 PHE CB C 58 39.335 40.835 -1.500 1
1 705 . 4 1 1 A 58 58 PHE N N 58 121.026 120.684 0.342 1
1 706 . 4 1 1 A 59 59 ASP H H 59 8.407 8.986 -0.579 1
1 707 . 4 1 1 A 59 59 ASP HA H 59 5.743 5.630 0.113 1
1 710 . 4 1 1 A 59 59 ASP C C 59 176.302 175.050 1.252 1
1 711 . 4 1 1 A 59 59 ASP CA C 59 52.579 52.792 -0.213 1
1 712 . 4 1 1 A 59 59 ASP CB C 59 43.628 44.398 -0.770 1
1 713 . 4 1 1 A 59 59 ASP N N 59 119.234 119.338 -0.104 1
1 714 . 4 1 1 A 60 60 VAL H H 60 8.915 8.909 0.006 1
1 715 . 4 1 1 A 60 60 VAL HA H 60 4.374 5.029 -0.655 1
1 723 . 4 1 1 A 60 60 VAL C C 60 173.140 174.722 -1.582 1
1 724 . 4 1 1 A 60 60 VAL CA C 60 61.252 60.298 0.954 1
1 725 . 4 1 1 A 60 60 VAL CB C 60 35.620 35.574 0.046 1
1 728 . 4 1 1 A 60 60 VAL N N 60 119.758 120.891 -1.133 1
1 729 . 4 1 1 A 61 61 ALA H H 61 8.761 8.942 -0.181 1
1 730 . 4 1 1 A 61 61 ALA HA H 61 5.091 5.442 -0.351 1
1 734 . 4 1 1 A 61 61 ALA C C 61 176.460 176.235 0.225 1
1 735 . 4 1 1 A 61 61 ALA CA C 61 51.019 51.033 -0.014 1
1 736 . 4 1 1 A 61 61 ALA CB C 61 19.447 21.305 -1.858 1
1 737 . 4 1 1 A 61 61 ALA N N 61 133.341 128.195 5.146 1
1 738 . 4 1 1 A 62 62 VAL H H 62 8.929 8.993 -0.064 1
1 739 . 4 1 1 A 62 62 VAL HA H 62 4.236 4.766 -0.530 1
1 747 . 4 1 1 A 62 62 VAL C C 62 174.733 175.526 -0.793 1
1 748 . 4 1 1 A 62 62 VAL CA C 62 61.007 60.931 0.076 1
1 749 . 4 1 1 A 62 62 VAL CB C 62 34.387 35.630 -1.243 1
1 752 . 4 1 1 A 62 62 VAL N N 62 124.165 122.835 1.330 1
1 753 . 4 1 1 A 63 63 GLY H H 63 8.995 8.720 0.275 1
1 754 . 4 1 1 A 63 63 GLY HA2 H 63 4.229 4.106 0.123 1
1 755 . 4 1 1 A 63 63 GLY HA3 H 63 3.637 4.122 -0.485 1
1 756 . 4 1 1 A 63 63 GLY C C 63 175.306 174.868 0.438 1
1 757 . 4 1 1 A 63 63 GLY CA C 63 44.620 45.133 -0.513 1
1 758 . 4 1 1 A 63 63 GLY N N 63 115.598 112.254 3.344 1
1 759 . 4 1 1 A 64 64 ALA H H 64 8.106 8.864 -0.758 1
1 760 . 4 1 1 A 64 64 ALA HA H 64 4.010 4.230 -0.220 1
1 764 . 4 1 1 A 64 64 ALA C C 64 180.218 179.254 0.964 1
1 765 . 4 1 1 A 64 64 ALA CA C 64 55.897 54.446 1.451 1
1 766 . 4 1 1 A 64 64 ALA CB C 64 18.347 18.497 -0.150 1
1 767 . 4 1 1 A 64 64 ALA N N 64 122.859 124.346 -1.487 1
1 768 . 4 1 1 A 65 65 ASN H H 65 8.748 8.349 0.399 1
1 769 . 4 1 1 A 65 65 ASN HA H 65 4.230 4.545 -0.315 1
1 774 . 4 1 1 A 65 65 ASN C C 65 176.085 176.691 -0.606 1
1 775 . 4 1 1 A 65 65 ASN CA C 65 56.064 55.739 0.325 1
1 776 . 4 1 1 A 65 65 ASN CB C 65 37.871 38.589 -0.718 1
1 777 . 4 1 1 A 65 65 ASN N N 65 114.590 117.033 -2.443 1
1 779 . 4 1 1 A 66 66 ASP H H 66 7.598 7.989 -0.391 1
1 780 . 4 1 1 A 66 66 ASP HA H 66 4.682 4.895 -0.213 1
1 783 . 4 1 1 A 66 66 ASP C C 66 173.061 177.899 -4.838 1
1 784 . 4 1 1 A 66 66 ASP CA C 66 53.549 55.826 -2.277 1
1 785 . 4 1 1 A 66 66 ASP CB C 66 42.204 42.654 -0.450 1
1 786 . 4 1 1 A 66 66 ASP N N 66 118.065 119.378 -1.313 1
1 787 . 4 1 1 A 67 67 ALA H H 67 7.434 8.197 -0.763 1
1 788 . 4 1 1 A 67 67 ALA HA H 67 4.316 4.376 -0.060 1
1 792 . 4 1 1 A 67 67 ALA C C 67 175.615 177.439 -1.824 1
1 793 . 4 1 1 A 67 67 ALA CA C 67 50.814 53.908 -3.094 1
1 794 . 4 1 1 A 67 67 ALA CB C 67 18.618 19.253 -0.635 1
1 795 . 4 1 1 A 67 67 ALA N N 67 124.890 120.967 3.923 1
1 796 . 4 1 1 A 68 68 TYR H H 68 8.390 8.068 0.322 1
1 797 . 4 1 1 A 68 68 TYR HA H 68 4.195 4.841 -0.646 1
1 804 . 4 1 1 A 68 68 TYR C C 68 174.964 174.340 0.624 1
1 805 . 4 1 1 A 68 68 TYR CA C 68 59.566 56.547 3.019 1
1 806 . 4 1 1 A 68 68 TYR CB C 68 36.992 40.547 -3.555 1
1 809 . 4 1 1 A 68 68 TYR N N 68 121.083 111.472 9.611 1
1 810 . 4 1 1 A 69 69 GLY H H 69 8.149 8.704 -0.555 1
1 811 . 4 1 1 A 69 69 GLY HA2 H 69 4.254 3.810 0.444 1
1 812 . 4 1 1 A 69 69 GLY HA3 H 69 3.624 3.882 -0.258 1
1 813 . 4 1 1 A 69 69 GLY C C 69 173.161 175.137 -1.976 1
1 814 . 4 1 1 A 69 69 GLY CA C 69 44.465 45.380 -0.915 1
1 815 . 4 1 1 A 69 69 GLY N N 69 108.762 108.688 0.074 1
1 816 . 4 1 1 A 70 70 GLN H H 70 8.450 7.739 0.711 1
1 817 . 4 1 1 A 70 70 GLN HA H 70 4.140 4.426 -0.286 1
1 824 . 4 1 1 A 70 70 GLN C C 70 176.138 175.434 0.704 1
1 825 . 4 1 1 A 70 70 GLN CA C 70 54.680 56.161 -1.481 1
1 826 . 4 1 1 A 70 70 GLN CB C 70 29.210 30.342 -1.132 1
1 828 . 4 1 1 A 70 70 GLN N N 70 117.002 119.819 -2.817 1
1 830 . 4 1 1 A 71 71 TYR H H 71 8.991 8.758 0.233 1
1 831 . 4 1 1 A 71 71 TYR HA H 71 3.752 5.186 -1.434 1
1 838 . 4 1 1 A 71 71 TYR C C 71 174.548 174.144 0.404 1
1 839 . 4 1 1 A 71 71 TYR CA C 71 59.868 59.209 0.659 1
1 840 . 4 1 1 A 71 71 TYR CB C 71 38.961 38.830 0.131 1
1 843 . 4 1 1 A 71 71 TYR N N 71 125.112 122.678 2.434 1
1 844 . 4 1 1 A 72 72 ASP H H 72 8.819 8.433 0.386 1
1 845 . 4 1 1 A 72 72 ASP HA H 72 4.773 4.827 -0.054 1
1 848 . 4 1 1 A 72 72 ASP C C 72 177.709 175.783 1.926 1
1 849 . 4 1 1 A 72 72 ASP CA C 72 52.382 52.202 0.180 1
1 850 . 4 1 1 A 72 72 ASP CB C 72 42.197 42.283 -0.086 1
1 851 . 4 1 1 A 72 72 ASP N N 72 129.918 128.442 1.476 1
1 852 . 4 1 1 A 73 73 GLU H H 73 9.409 8.743 0.666 1
1 853 . 4 1 1 A 73 73 GLU HA H 73 3.937 3.708 0.229 1
1 858 . 4 1 1 A 73 73 GLU C C 73 177.581 177.301 0.280 1
1 859 . 4 1 1 A 73 73 GLU CA C 73 58.962 58.011 0.951 1
1 860 . 4 1 1 A 73 73 GLU CB C 73 29.155 28.550 0.605 1
1 862 . 4 1 1 A 73 73 GLU N N 73 129.624 124.926 4.698 1
1 863 . 4 1 1 A 74 74 ASN H H 74 8.700 7.876 0.824 1
1 864 . 4 1 1 A 74 74 ASN HA H 74 4.550 4.576 -0.026 1
1 869 . 4 1 1 A 74 74 ASN C C 74 176.190 176.409 -0.219 1
1 870 . 4 1 1 A 74 74 ASN CA C 74 54.932 55.240 -0.308 1
1 871 . 4 1 1 A 74 74 ASN CB C 74 38.113 38.248 -0.135 1
1 872 . 4 1 1 A 74 74 ASN N N 74 116.792 117.705 -0.913 1
1 874 . 4 1 1 A 75 75 LEU H H 75 7.303 7.311 -0.008 1
1 875 . 4 1 1 A 75 75 LEU HA H 75 4.289 4.276 0.013 1
1 885 . 4 1 1 A 75 75 LEU C C 75 175.821 177.138 -1.317 1
1 886 . 4 1 1 A 75 75 LEU CA C 75 54.106 54.884 -0.778 1
1 887 . 4 1 1 A 75 75 LEU CB C 75 41.239 42.031 -0.792 1
1 891 . 4 1 1 A 75 75 LEU N N 75 117.094 117.688 -0.594 1
1 892 . 4 1 1 A 76 76 VAL H H 76 7.181 7.110 0.071 1
1 893 . 4 1 1 A 76 76 VAL HA H 76 4.970 4.181 0.789 1
1 901 . 4 1 1 A 76 76 VAL C C 76 175.702 175.691 0.011 1
1 902 . 4 1 1 A 76 76 VAL CA C 76 61.733 62.796 -1.063 1
1 903 . 4 1 1 A 76 76 VAL CB C 76 31.822 31.745 0.077 1
1 905 . 4 1 1 A 76 76 VAL N N 76 124.716 120.736 3.980 1
1 906 . 4 1 1 A 77 77 GLN H H 77 8.791 9.397 -0.606 1
1 907 . 4 1 1 A 77 77 GLN HA H 77 4.695 4.995 -0.300 1
1 914 . 4 1 1 A 77 77 GLN C C 77 173.553 173.772 -0.219 1
1 915 . 4 1 1 A 77 77 GLN CA C 77 54.038 53.778 0.260 1
1 916 . 4 1 1 A 77 77 GLN CB C 77 33.018 32.495 0.523 1
1 918 . 4 1 1 A 77 77 GLN N N 77 124.898 123.974 0.924 1
1 920 . 4 1 1 A 78 78 ARG H H 78 8.530 8.494 0.036 1
1 921 . 4 1 1 A 78 78 ARG HA H 78 5.107 5.247 -0.140 1
1 928 . 4 1 1 A 78 78 ARG C C 78 176.182 175.050 1.132 1
1 929 . 4 1 1 A 78 78 ARG CA C 78 55.355 55.104 0.251 1
1 930 . 4 1 1 A 78 78 ARG CB C 78 31.150 31.027 0.123 1
1 933 . 4 1 1 A 78 78 ARG N N 78 123.413 119.811 3.602 1
1 934 . 4 1 1 A 79 79 VAL H H 79 9.300 8.589 0.711 1
1 935 . 4 1 1 A 79 79 VAL HA H 79 4.824 4.523 0.301 1
1 943 . 4 1 1 A 79 79 VAL CA C 79 58.731 58.718 0.013 1
1 944 . 4 1 1 A 79 79 VAL CB C 79 34.836 33.581 1.255 1
1 947 . 4 1 1 A 79 79 VAL N N 79 125.252 125.036 0.216 1
1 948 . 4 1 1 A 80 80 PRO HA H 80 4.339 4.789 -0.450 1
1 955 . 4 1 1 A 80 80 PRO C C 80 176.902 178.090 -1.188 1
1 956 . 4 1 1 A 80 80 PRO CA C 80 62.969 63.134 -0.165 1
1 957 . 4 1 1 A 80 80 PRO CB C 80 32.431 32.033 0.398 1
1 960 . 4 1 1 A 81 81 LYS H H 81 7.816 8.583 -0.767 1
1 961 . 4 1 1 A 81 81 LYS HA H 81 3.790 4.156 -0.366 1
1 970 . 4 1 1 A 81 81 LYS C C 81 177.808 178.868 -1.060 1
1 971 . 4 1 1 A 81 81 LYS CA C 81 59.874 59.778 0.096 1
1 972 . 4 1 1 A 81 81 LYS CB C 81 32.670 32.122 0.548 1
1 976 . 4 1 1 A 81 81 LYS N N 81 120.948 124.514 -3.566 1
1 977 . 4 1 1 A 82 82 ASP H H 82 8.069 8.216 -0.147 1
1 978 . 4 1 1 A 82 82 ASP HA H 82 4.243 4.335 -0.092 1
1 981 . 4 1 1 A 82 82 ASP C C 82 177.157 178.177 -1.020 1
1 982 . 4 1 1 A 82 82 ASP CA C 82 55.527 57.605 -2.078 1
1 983 . 4 1 1 A 82 82 ASP CB C 82 40.005 41.766 -1.761 1
1 984 . 4 1 1 A 82 82 ASP N N 82 116.004 119.885 -3.881 1
1 985 . 4 1 1 A 83 83 VAL H H 83 7.150 7.395 -0.245 1
1 986 . 4 1 1 A 83 83 VAL HA H 83 3.719 3.709 0.010 1
1 994 . 4 1 1 A 83 83 VAL C C 83 176.346 176.659 -0.313 1
1 995 . 4 1 1 A 83 83 VAL CA C 83 63.868 64.921 -1.053 1
1 996 . 4 1 1 A 83 83 VAL CB C 83 31.689 31.140 0.549 1
1 999 . 4 1 1 A 83 83 VAL N N 83 117.199 116.278 0.921 1
1 1000 . 4 1 1 A 84 84 PHE H H 84 7.365 7.537 -0.172 1
1 1001 . 4 1 1 A 84 84 PHE HA H 84 4.389 4.749 -0.360 1
1 1009 . 4 1 1 A 84 84 PHE C C 84 175.265 176.120 -0.855 1
1 1010 . 4 1 1 A 84 84 PHE CA C 84 57.210 57.074 0.136 1
1 1011 . 4 1 1 A 84 84 PHE CB C 84 38.968 38.343 0.625 1
1 1015 . 4 1 1 A 84 84 PHE N N 84 119.897 119.653 0.244 1
1 1016 . 4 1 1 A 85 85 MET H H 85 7.765 8.160 -0.395 1
1 1017 . 4 1 1 A 85 85 MET HA H 85 4.277 4.278 -0.001 1
1 1025 . 4 1 1 A 85 85 MET C C 85 176.856 178.163 -1.307 1
1 1026 . 4 1 1 A 85 85 MET CA C 85 56.389 57.857 -1.468 1
1 1027 . 4 1 1 A 85 85 MET CB C 85 32.715 32.308 0.407 1
1 1030 . 4 1 1 A 85 85 MET N N 85 121.131 119.236 1.895 1
1 1031 . 4 1 1 A 86 86 GLY H H 86 8.499 8.182 0.317 1
1 1032 . 4 1 1 A 86 86 GLY HA2 H 86 3.928 3.958 -0.030 1
1 1033 . 4 1 1 A 86 86 GLY HA3 H 86 3.793 3.963 -0.170 1
1 1034 . 4 1 1 A 86 86 GLY C C 86 174.168 174.322 -0.154 1
1 1035 . 4 1 1 A 86 86 GLY CA C 86 45.637 45.397 0.240 1
1 1036 . 4 1 1 A 86 86 GLY N N 86 111.268 108.018 3.250 1
1 1037 . 4 1 1 A 87 87 VAL H H 87 7.564 7.488 0.076 1
1 1038 . 4 1 1 A 87 87 VAL HA H 87 4.083 3.861 0.222 1
1 1046 . 4 1 1 A 87 87 VAL C C 87 175.649 176.357 -0.708 1
1 1047 . 4 1 1 A 87 87 VAL CA C 87 61.809 62.155 -0.346 1
1 1048 . 4 1 1 A 87 87 VAL CB C 87 32.667 31.830 0.837 1
1 1051 . 4 1 1 A 87 87 VAL N N 87 118.839 120.547 -1.708 1
1 1052 . 4 1 1 A 88 88 ASP H H 88 8.270 8.697 -0.427 1
1 1053 . 4 1 1 A 88 88 ASP HA H 88 4.421 4.271 0.150 1
1 1056 . 4 1 1 A 88 88 ASP C C 88 175.977 175.244 0.733 1
1 1057 . 4 1 1 A 88 88 ASP CA C 88 55.655 57.309 -1.654 1
1 1058 . 4 1 1 A 88 88 ASP CB C 88 41.364 41.258 0.106 1
1 1059 . 4 1 1 A 88 88 ASP N N 88 124.401 125.316 -0.915 1
1 1060 . 4 1 1 A 89 89 GLU H H 89 7.833 7.791 0.042 1
1 1061 . 4 1 1 A 89 89 GLU HA H 89 4.206 4.704 -0.498 1
1 1066 . 4 1 1 A 89 89 GLU C C 89 174.912 175.484 -0.572 1
1 1067 . 4 1 1 A 89 89 GLU CA C 89 55.739 55.309 0.430 1
1 1068 . 4 1 1 A 89 89 GLU CB C 89 30.603 32.705 -2.102 1
1 1070 . 4 1 1 A 89 89 GLU N N 89 119.378 115.398 3.980 1
1 1071 . 4 1 1 A 90 90 LEU H H 90 8.051 8.633 -0.582 1
1 1072 . 4 1 1 A 90 90 LEU HA H 90 4.127 4.429 -0.302 1
1 1082 . 4 1 1 A 90 90 LEU C C 90 175.753 176.004 -0.251 1
1 1083 . 4 1 1 A 90 90 LEU CA C 90 54.929 55.105 -0.176 1
1 1084 . 4 1 1 A 90 90 LEU CB C 90 42.710 40.996 1.714 1
1 1088 . 4 1 1 A 90 90 LEU N N 90 124.432 125.986 -1.554 1
1 1089 . 4 1 1 A 91 91 GLN H H 91 7.341 8.860 -1.519 1
1 1090 . 4 1 1 A 91 91 GLN HA H 91 4.546 5.006 -0.460 1
1 1097 . 4 1 1 A 91 91 GLN C C 91 174.655 174.445 0.210 1
1 1098 . 4 1 1 A 91 91 GLN CA C 91 53.671 53.990 -0.319 1
1 1099 . 4 1 1 A 91 91 GLN CB C 91 32.850 32.505 0.345 1
1 1101 . 4 1 1 A 91 91 GLN N N 91 120.186 126.154 -5.968 1
1 1103 . 4 1 1 A 92 92 VAL H H 92 8.442 8.466 -0.024 1
1 1104 . 4 1 1 A 92 92 VAL HA H 92 3.278 3.901 -0.623 1
1 1112 . 4 1 1 A 92 92 VAL C C 92 177.098 177.320 -0.222 1
1 1113 . 4 1 1 A 92 92 VAL CA C 92 64.953 64.232 0.721 1
1 1114 . 4 1 1 A 92 92 VAL CB C 92 31.601 31.966 -0.365 1
1 1117 . 4 1 1 A 92 92 VAL N N 92 121.899 123.113 -1.214 1
1 1118 . 4 1 1 A 93 93 GLY H H 93 9.002 9.293 -0.291 1
1 1119 . 4 1 1 A 93 93 GLY HA2 H 93 4.327 3.942 0.385 1
1 1120 . 4 1 1 A 93 93 GLY HA3 H 93 3.770 3.967 -0.197 1
1 1121 . 4 1 1 A 93 93 GLY C C 93 174.547 174.270 0.277 1
1 1122 . 4 1 1 A 93 93 GLY CA C 93 44.446 45.244 -0.798 1
1 1123 . 4 1 1 A 93 93 GLY N N 93 116.485 115.016 1.469 1
1 1124 . 4 1 1 A 94 94 MET H H 94 7.445 7.412 0.033 1
1 1125 . 4 1 1 A 94 94 MET HA H 94 4.182 4.532 -0.350 1
1 1133 . 4 1 1 A 94 94 MET C C 94 174.531 175.101 -0.570 1
1 1134 . 4 1 1 A 94 94 MET CA C 94 57.193 55.834 1.359 1
1 1135 . 4 1 1 A 94 94 MET CB C 94 34.474 33.315 1.159 1
1 1138 . 4 1 1 A 94 94 MET N N 94 120.304 120.267 0.037 1
1 1139 . 4 1 1 A 95 95 ARG H H 95 8.169 8.804 -0.635 1
1 1140 . 4 1 1 A 95 95 ARG HA H 95 5.343 5.352 -0.009 1
1 1147 . 4 1 1 A 95 95 ARG C C 95 175.593 174.465 1.128 1
1 1148 . 4 1 1 A 95 95 ARG CA C 95 54.898 54.607 0.291 1
1 1149 . 4 1 1 A 95 95 ARG CB C 95 32.928 34.055 -1.127 1
1 1152 . 4 1 1 A 95 95 ARG N N 95 122.066 123.730 -1.664 1
1 1153 . 4 1 1 A 96 96 PHE H H 96 8.440 8.694 -0.254 1
1 1154 . 4 1 1 A 96 96 PHE HA H 96 4.738 5.073 -0.335 1
1 1162 . 4 1 1 A 96 96 PHE C C 96 173.273 172.024 1.249 1
1 1163 . 4 1 1 A 96 96 PHE CA C 96 56.174 56.098 0.076 1
1 1164 . 4 1 1 A 96 96 PHE CB C 96 42.474 40.741 1.733 1
1 1168 . 4 1 1 A 96 96 PHE N N 96 119.938 120.992 -1.054 1
1 1169 . 4 1 1 A 97 97 LEU H H 97 8.459 8.689 -0.230 1
1 1170 . 4 1 1 A 97 97 LEU HA H 97 4.625 4.760 -0.135 1
1 1180 . 4 1 1 A 97 97 LEU C C 97 175.664 175.228 0.436 1
1 1181 . 4 1 1 A 97 97 LEU CA C 97 53.547 54.761 -1.214 1
1 1182 . 4 1 1 A 97 97 LEU CB C 97 42.379 43.449 -1.070 1
1 1186 . 4 1 1 A 97 97 LEU N N 97 122.014 122.091 -0.077 1
1 1187 . 4 1 1 A 98 98 ALA H H 98 8.812 8.961 -0.149 1
1 1188 . 4 1 1 A 98 98 ALA HA H 98 4.520 5.433 -0.913 1
1 1192 . 4 1 1 A 98 98 ALA C C 98 176.373 175.728 0.645 1
1 1193 . 4 1 1 A 98 98 ALA CA C 98 50.639 50.468 0.171 1
1 1194 . 4 1 1 A 98 98 ALA CB C 98 20.939 21.506 -0.567 1
1 1195 . 4 1 1 A 98 98 ALA N N 98 129.296 129.674 -0.378 1
1 1196 . 4 1 1 A 99 99 GLU H H 99 8.504 9.079 -0.575 1
1 1197 . 4 1 1 A 99 99 GLU HA H 99 4.150 4.702 -0.552 1
1 1202 . 4 1 1 A 99 99 GLU C C 99 176.351 176.417 -0.066 1
1 1203 . 4 1 1 A 99 99 GLU CA C 99 56.830 55.830 1.000 1
1 1204 . 4 1 1 A 99 99 GLU CB C 99 29.639 30.036 -0.397 1
1 1206 . 4 1 1 A 99 99 GLU N N 99 121.993 123.402 -1.409 1
1 1207 . 4 1 1 A 100 100 THR H H 100 7.393 8.700 -1.307 1
1 1208 . 4 1 1 A 100 100 THR HA H 100 4.819 4.781 0.038 1
1 1213 . 4 1 1 A 100 100 THR C C 100 175.882 175.458 0.424 1
1 1214 . 4 1 1 A 100 100 THR CA C 100 60.329 60.334 -0.005 1
1 1215 . 4 1 1 A 100 100 THR CB C 100 73.452 71.395 2.057 1
1 1217 . 4 1 1 A 100 100 THR N N 100 115.598 117.822 -2.224 1
1 1218 . 4 1 1 A 101 101 ASP H H 101 8.988 8.946 0.042 1
1 1219 . 4 1 1 A 101 101 ASP HA H 101 4.357 4.334 0.023 1
1 1222 . 4 1 1 A 101 101 ASP C C 101 176.848 176.741 0.107 1
1 1223 . 4 1 1 A 101 101 ASP CA C 101 56.493 57.157 -0.664 1
1 1224 . 4 1 1 A 101 101 ASP CB C 101 39.973 40.498 -0.525 1
1 1225 . 4 1 1 A 101 101 ASP N N 101 121.468 121.675 -0.207 1
1 1226 . 4 1 1 A 102 102 GLN H H 102 7.937 7.591 0.346 1
1 1227 . 4 1 1 A 102 102 GLN HA H 102 4.415 4.330 0.085 1
1 1234 . 4 1 1 A 102 102 GLN C C 102 175.252 175.941 -0.689 1
1 1235 . 4 1 1 A 102 102 GLN CA C 102 55.097 54.845 0.252 1
1 1236 . 4 1 1 A 102 102 GLN CB C 102 29.121 27.994 1.127 1
1 1238 . 4 1 1 A 102 102 GLN N N 102 117.199 113.956 3.243 1
1 1240 . 4 1 1 A 103 103 GLY H H 103 7.431 7.853 -0.422 1
1 1241 . 4 1 1 A 103 103 GLY HA2 H 103 4.504 4.130 0.374 1
1 1242 . 4 1 1 A 103 103 GLY HA3 H 103 3.868 4.130 -0.262 1
1 1243 . 4 1 1 A 103 103 GLY CA C 103 44.051 44.484 -0.433 1
1 1244 . 4 1 1 A 103 103 GLY N N 103 110.056 110.306 -0.250 1
1 1245 . 4 1 1 A 104 104 PRO HA H 104 5.057 4.886 0.171 1
1 1252 . 4 1 1 A 104 104 PRO C C 104 177.873 175.577 2.296 1
1 1253 . 4 1 1 A 104 104 PRO CA C 104 62.464 62.960 -0.496 1
1 1254 . 4 1 1 A 104 104 PRO CB C 104 31.939 32.180 -0.241 1
1 1257 . 4 1 1 A 105 105 VAL H H 105 8.960 9.065 -0.105 1
1 1258 . 4 1 1 A 105 105 VAL HA H 105 4.678 4.576 0.102 1
1 1266 . 4 1 1 A 105 105 VAL CA C 105 58.474 59.464 -0.990 1
1 1267 . 4 1 1 A 105 105 VAL CB C 105 35.512 34.660 0.852 1
1 1270 . 4 1 1 A 105 105 VAL N N 105 123.240 122.861 0.379 1
1 1271 . 4 1 1 A 106 106 PRO HA H 106 4.777 4.837 -0.060 1
1 1278 . 4 1 1 A 106 106 PRO C C 106 176.823 176.327 0.496 1
1 1279 . 4 1 1 A 106 106 PRO CA C 106 62.508 62.394 0.114 1
1 1280 . 4 1 1 A 106 106 PRO CB C 106 31.650 31.682 -0.032 1
1 1283 . 4 1 1 A 107 107 VAL H H 107 8.835 8.165 0.670 1
1 1284 . 4 1 1 A 107 107 VAL HA H 107 4.719 4.924 -0.205 1
1 1292 . 4 1 1 A 107 107 VAL C C 107 173.661 173.332 0.329 1
1 1293 . 4 1 1 A 107 107 VAL CA C 107 59.026 59.131 -0.105 1
1 1294 . 4 1 1 A 107 107 VAL CB C 107 36.406 34.839 1.567 1
1 1297 . 4 1 1 A 107 107 VAL N N 107 117.474 117.116 0.358 1
1 1298 . 4 1 1 A 108 108 GLU H H 108 7.698 8.738 -1.040 1
1 1299 . 4 1 1 A 108 108 GLU HA H 108 5.133 4.974 0.159 1
1 1304 . 4 1 1 A 108 108 GLU C C 108 176.394 175.181 1.213 1
1 1305 . 4 1 1 A 108 108 GLU CA C 108 53.808 54.458 -0.650 1
1 1306 . 4 1 1 A 108 108 GLU CB C 108 33.984 33.240 0.744 1
1 1308 . 4 1 1 A 108 108 GLU N N 108 120.646 121.505 -0.859 1
1 1309 . 4 1 1 A 109 109 ILE H H 109 8.690 9.460 -0.770 1
1 1310 . 4 1 1 A 109 109 ILE HA H 109 4.484 4.181 0.303 1
1 1320 . 4 1 1 A 109 109 ILE C C 109 177.313 176.946 0.367 1
1 1321 . 4 1 1 A 109 109 ILE CA C 109 61.789 61.506 0.283 1
1 1322 . 4 1 1 A 109 109 ILE CB C 109 36.628 37.728 -1.100 1
1 1326 . 4 1 1 A 109 109 ILE N N 109 124.739 127.360 -2.621 1
1 1327 . 4 1 1 A 110 110 THR H H 110 9.300 9.540 -0.240 1
1 1328 . 4 1 1 A 110 110 THR HA H 110 4.547 4.583 -0.036 1
1 1333 . 4 1 1 A 110 110 THR C C 110 174.904 174.468 0.436 1
1 1334 . 4 1 1 A 110 110 THR CA C 110 62.260 61.316 0.944 1
1 1335 . 4 1 1 A 110 110 THR CB C 110 69.100 69.713 -0.613 1
1 1337 . 4 1 1 A 110 110 THR N N 110 122.544 117.806 4.738 1
1 1338 . 4 1 1 A 111 111 ALA H H 111 7.673 7.484 0.189 1
1 1339 . 4 1 1 A 111 111 ALA HA H 111 4.367 4.561 -0.194 1
1 1343 . 4 1 1 A 111 111 ALA C C 111 175.019 175.049 -0.030 1
1 1344 . 4 1 1 A 111 111 ALA CA C 111 53.125 51.850 1.275 1
1 1345 . 4 1 1 A 111 111 ALA CB C 111 21.539 22.261 -0.722 1
1 1346 . 4 1 1 A 111 111 ALA N N 111 123.153 120.589 2.564 1
1 1347 . 4 1 1 A 112 112 VAL H H 112 8.707 8.397 0.310 1
1 1348 . 4 1 1 A 112 112 VAL HA H 112 4.129 4.662 -0.533 1
1 1356 . 4 1 1 A 112 112 VAL C C 112 174.755 175.042 -0.287 1
1 1357 . 4 1 1 A 112 112 VAL CA C 112 62.898 61.442 1.456 1
1 1358 . 4 1 1 A 112 112 VAL CB C 112 33.379 34.683 -1.304 1
1 1361 . 4 1 1 A 112 112 VAL N N 112 122.369 119.890 2.479 1
1 1362 . 4 1 1 A 113 113 GLU H H 113 8.144 9.291 -1.147 1
1 1363 . 4 1 1 A 113 113 GLU HA H 113 4.645 4.600 0.045 1
1 1368 . 4 1 1 A 113 113 GLU C C 113 175.102 177.629 -2.527 1
1 1369 . 4 1 1 A 113 113 GLU CA C 113 54.080 55.044 -0.964 1
1 1370 . 4 1 1 A 113 113 GLU CB C 113 31.234 31.146 0.088 1
1 1372 . 4 1 1 A 113 113 GLU N N 113 127.435 126.998 0.437 1
1 1373 . 4 1 1 A 114 114 ASP H H 114 8.472 8.751 -0.279 1
1 1374 . 4 1 1 A 114 114 ASP HA H 114 4.209 4.334 -0.125 1
1 1377 . 4 1 1 A 114 114 ASP C C 114 177.679 176.454 1.225 1
1 1378 . 4 1 1 A 114 114 ASP CA C 114 58.334 56.900 1.434 1
1 1379 . 4 1 1 A 114 114 ASP CB C 114 40.347 40.538 -0.191 1
1 1380 . 4 1 1 A 114 114 ASP N N 114 119.844 122.637 -2.793 1
1 1381 . 4 1 1 A 115 115 ASP H H 115 8.475 7.843 0.632 1
1 1382 . 4 1 1 A 115 115 ASP HA H 115 4.848 4.775 0.073 1
1 1385 . 4 1 1 A 115 115 ASP C C 115 175.968 175.730 0.238 1
1 1386 . 4 1 1 A 115 115 ASP CA C 115 53.290 54.939 -1.649 1
1 1387 . 4 1 1 A 115 115 ASP CB C 115 42.080 43.828 -1.748 1
1 1388 . 4 1 1 A 115 115 ASP N N 115 114.364 116.371 -2.007 1
1 1389 . 4 1 1 A 116 116 HIS H H 116 7.185 7.801 -0.616 1
1 1390 . 4 1 1 A 116 116 HIS HA H 116 5.106 5.623 -0.517 1
1 1395 . 4 1 1 A 116 116 HIS C C 116 172.393 172.887 -0.494 1
1 1396 . 4 1 1 A 116 116 HIS CA C 116 56.099 53.549 2.550 1
1 1397 . 4 1 1 A 116 116 HIS CB C 116 33.289 33.404 -0.115 1
1 1400 . 4 1 1 A 116 116 HIS N N 116 117.212 115.009 2.203 1
1 1401 . 4 1 1 A 117 117 VAL H H 117 9.130 9.081 0.049 1
1 1402 . 4 1 1 A 117 117 VAL HA H 117 4.649 4.943 -0.294 1
1 1410 . 4 1 1 A 117 117 VAL C C 117 173.832 174.729 -0.897 1
1 1411 . 4 1 1 A 117 117 VAL CA C 117 59.555 59.732 -0.177 1
1 1412 . 4 1 1 A 117 117 VAL CB C 117 34.676 34.892 -0.216 1
1 1415 . 4 1 1 A 117 117 VAL N N 117 114.046 114.737 -0.691 1
1 1416 . 4 1 1 A 118 118 VAL H H 118 8.680 9.141 -0.461 1
1 1417 . 4 1 1 A 118 118 VAL HA H 118 4.747 4.829 -0.082 1
1 1425 . 4 1 1 A 118 118 VAL C C 118 175.836 174.872 0.964 1
1 1426 . 4 1 1 A 118 118 VAL CA C 118 62.159 61.313 0.846 1
1 1427 . 4 1 1 A 118 118 VAL CB C 118 31.887 32.809 -0.922 1
1 1430 . 4 1 1 A 118 118 VAL N N 118 125.095 121.938 3.157 1
1 1431 . 4 1 1 A 119 119 VAL H H 119 9.057 9.240 -0.183 1
1 1432 . 4 1 1 A 119 119 VAL HA H 119 5.231 4.680 0.551 1
1 1440 . 4 1 1 A 119 119 VAL C C 119 173.747 174.111 -0.364 1
1 1441 . 4 1 1 A 119 119 VAL CA C 119 58.326 61.056 -2.730 1
1 1442 . 4 1 1 A 119 119 VAL CB C 119 34.387 34.204 0.183 1
1 1445 . 4 1 1 A 119 119 VAL N N 119 121.494 128.895 -7.401 1
1 1446 . 4 1 1 A 120 120 ASP H H 120 8.926 8.753 0.173 1
1 1447 . 4 1 1 A 120 120 ASP HA H 120 5.174 5.198 -0.024 1
1 1450 . 4 1 1 A 120 120 ASP C C 120 177.982 176.673 1.309 1
1 1451 . 4 1 1 A 120 120 ASP CA C 120 52.749 52.687 0.062 1
1 1452 . 4 1 1 A 120 120 ASP CB C 120 44.542 43.832 0.710 1
1 1453 . 4 1 1 A 120 120 ASP N N 120 121.454 127.366 -5.912 1
1 1454 . 4 1 1 A 121 121 GLY H H 121 8.674 8.611 0.063 1
1 1455 . 4 1 1 A 121 121 GLY HA2 H 121 4.702 3.853 0.849 1
1 1456 . 4 1 1 A 121 121 GLY HA3 H 121 3.573 3.862 -0.289 1
1 1457 . 4 1 1 A 121 121 GLY C C 121 175.041 173.921 1.120 1
1 1458 . 4 1 1 A 121 121 GLY CA C 121 45.319 45.610 -0.291 1
1 1459 . 4 1 1 A 121 121 GLY N N 121 114.850 111.846 3.004 1
1 1460 . 4 1 1 A 122 122 ASN H H 122 8.762 8.351 0.411 1
1 1461 . 4 1 1 A 122 122 ASN HA H 122 4.183 5.342 -1.159 1
1 1466 . 4 1 1 A 122 122 ASN C C 122 175.406 174.228 1.178 1
1 1467 . 4 1 1 A 122 122 ASN CA C 122 54.686 51.058 3.628 1
1 1468 . 4 1 1 A 122 122 ASN CB C 122 40.139 41.473 -1.334 1
1 1469 . 4 1 1 A 122 122 ASN N N 122 121.618 116.876 4.742 1
1 1471 . 4 1 1 A 123 123 HIS H H 123 8.929 8.727 0.202 1
1 1472 . 4 1 1 A 123 123 HIS HA H 123 4.005 4.650 -0.645 1
1 1477 . 4 1 1 A 123 123 HIS C C 123 177.325 176.166 1.159 1
1 1478 . 4 1 1 A 123 123 HIS CA C 123 58.768 55.805 2.963 1
1 1479 . 4 1 1 A 123 123 HIS CB C 123 31.172 30.579 0.593 1
1 1482 . 4 1 1 A 123 123 HIS N N 123 124.165 119.505 4.660 1
1 1483 . 4 1 1 A 124 124 MET H H 124 8.266 8.737 -0.471 1
1 1484 . 4 1 1 A 124 124 MET HA H 124 4.048 4.248 -0.200 1
1 1492 . 4 1 1 A 124 124 MET CA C 124 58.994 57.888 1.106 1
1 1493 . 4 1 1 A 124 124 MET CB C 124 32.777 32.085 0.692 1
1 1496 . 4 1 1 A 124 124 MET N N 124 129.443 126.911 2.532 1
1 1497 . 4 1 1 A 125 125 LEU H H 125 8.094 7.308 0.786 1
1 1498 . 4 1 1 A 125 125 LEU HA H 125 4.455 4.218 0.237 1
1 1504 . 4 1 1 A 125 125 LEU C C 125 177.860 176.881 0.979 1
1 1505 . 4 1 1 A 125 125 LEU CA C 125 53.517 54.365 -0.848 1
1 1506 . 4 1 1 A 125 125 LEU CB C 125 42.462 41.858 0.604 1
1 1509 . 4 1 1 A 126 126 ALA H H 126 8.089 8.384 -0.295 1
1 1510 . 4 1 1 A 126 126 ALA HA H 126 3.966 4.104 -0.138 1
1 1514 . 4 1 1 A 126 126 ALA C C 126 179.135 177.874 1.261 1
1 1515 . 4 1 1 A 126 126 ALA CA C 126 54.170 54.066 0.104 1
1 1516 . 4 1 1 A 126 126 ALA CB C 126 18.687 18.064 0.623 1
1 1517 . 4 1 1 A 126 126 ALA N N 126 126.095 121.608 4.487 1
1 1518 . 4 1 1 A 127 127 GLY H H 127 9.499 8.683 0.816 1
1 1519 . 4 1 1 A 127 127 GLY HA2 H 127 4.207 3.963 0.244 1
1 1520 . 4 1 1 A 127 127 GLY HA3 H 127 3.598 3.972 -0.374 1
1 1521 . 4 1 1 A 127 127 GLY C C 127 173.568 174.406 -0.838 1
1 1522 . 4 1 1 A 127 127 GLY CA C 127 45.846 45.588 0.258 1
1 1523 . 4 1 1 A 127 127 GLY N N 127 110.073 108.260 1.813 1
1 1524 . 4 1 1 A 128 128 GLN H H 128 7.514 7.932 -0.418 1
1 1525 . 4 1 1 A 128 128 GLN HA H 128 4.496 4.272 0.224 1
1 1532 . 4 1 1 A 128 128 GLN C C 128 174.790 174.795 -0.005 1
1 1533 . 4 1 1 A 128 128 GLN CA C 128 54.948 55.740 -0.792 1
1 1534 . 4 1 1 A 128 128 GLN CB C 128 29.181 29.598 -0.417 1
1 1536 . 4 1 1 A 128 128 GLN N N 128 117.842 120.623 -2.781 1
1 1538 . 4 1 1 A 129 129 ASN H H 129 8.689 9.320 -0.631 1
1 1539 . 4 1 1 A 129 129 ASN HA H 129 4.857 5.414 -0.557 1
1 1544 . 4 1 1 A 129 129 ASN C C 129 174.325 173.767 0.558 1
1 1545 . 4 1 1 A 129 129 ASN CA C 129 52.568 51.780 0.788 1
1 1546 . 4 1 1 A 129 129 ASN CB C 129 38.035 41.453 -3.418 1
1 1547 . 4 1 1 A 129 129 ASN N N 129 122.739 120.870 1.869 1
1 1549 . 4 1 1 A 130 130 LEU H H 130 8.742 8.925 -0.183 1
1 1550 . 4 1 1 A 130 130 LEU HA H 130 4.918 4.906 0.012 1
1 1560 . 4 1 1 A 130 130 LEU C C 130 176.095 175.610 0.485 1
1 1561 . 4 1 1 A 130 130 LEU CA C 130 53.691 52.938 0.753 1
1 1562 . 4 1 1 A 130 130 LEU CB C 130 46.814 44.744 2.070 1
1 1566 . 4 1 1 A 130 130 LEU N N 130 121.242 122.376 -1.134 1
1 1567 . 4 1 1 A 131 131 LYS H H 131 8.809 9.113 -0.304 1
1 1568 . 4 1 1 A 131 131 LYS HA H 131 4.918 4.944 -0.026 1
1 1577 . 4 1 1 A 131 131 LYS C C 131 175.508 174.962 0.546 1
1 1578 . 4 1 1 A 131 131 LYS CA C 131 55.333 54.500 0.833 1
1 1579 . 4 1 1 A 131 131 LYS CB C 131 33.962 35.001 -1.039 1
1 1583 . 4 1 1 A 131 131 LYS N N 131 122.071 120.972 1.099 1
1 1584 . 4 1 1 A 132 132 PHE H H 132 9.436 9.589 -0.153 1
1 1585 . 4 1 1 A 132 132 PHE HA H 132 5.427 5.831 -0.404 1
1 1593 . 4 1 1 A 132 132 PHE C C 132 175.715 174.527 1.188 1
1 1594 . 4 1 1 A 132 132 PHE CA C 132 56.665 56.649 0.016 1
1 1595 . 4 1 1 A 132 132 PHE CB C 132 42.263 41.865 0.398 1
1 1599 . 4 1 1 A 132 132 PHE N N 132 125.247 122.632 2.615 1
1 1600 . 4 1 1 A 133 133 ASN H H 133 8.680 9.047 -0.367 1
1 1601 . 4 1 1 A 133 133 ASN HA H 133 5.249 5.090 0.159 1
1 1606 . 4 1 1 A 133 133 ASN C C 133 174.433 173.986 0.447 1
1 1607 . 4 1 1 A 133 133 ASN CA C 133 53.952 52.963 0.989 1
1 1608 . 4 1 1 A 133 133 ASN CB C 133 41.492 39.232 2.260 1
1 1609 . 4 1 1 A 133 133 ASN N N 133 122.056 121.401 0.655 1
1 1611 . 4 1 1 A 134 134 VAL H H 134 8.762 8.856 -0.094 1
1 1612 . 4 1 1 A 134 134 VAL HA H 134 4.805 4.723 0.082 1
1 1620 . 4 1 1 A 134 134 VAL C C 134 173.555 175.300 -1.745 1
1 1621 . 4 1 1 A 134 134 VAL CA C 134 60.374 60.816 -0.442 1
1 1622 . 4 1 1 A 134 134 VAL CB C 134 34.848 33.173 1.675 1
1 1625 . 4 1 1 A 134 134 VAL N N 134 122.014 125.813 -3.799 1
1 1626 . 4 1 1 A 135 135 GLU H H 135 8.869 8.736 0.133 1
1 1627 . 4 1 1 A 135 135 GLU HA H 135 5.240 5.171 0.069 1
1 1632 . 4 1 1 A 135 135 GLU C C 135 175.578 175.233 0.345 1
1 1633 . 4 1 1 A 135 135 GLU CA C 135 54.376 55.259 -0.883 1
1 1634 . 4 1 1 A 135 135 GLU CB C 135 33.264 31.224 2.040 1
1 1636 . 4 1 1 A 135 135 GLU N N 135 125.197 125.663 -0.466 1
1 1637 . 4 1 1 A 136 136 VAL H H 136 8.270 8.654 -0.384 1
1 1638 . 4 1 1 A 136 136 VAL HA H 136 4.066 4.295 -0.229 1
1 1646 . 4 1 1 A 136 136 VAL C C 136 176.119 175.354 0.765 1
1 1647 . 4 1 1 A 136 136 VAL CA C 136 62.910 62.565 0.345 1
1 1648 . 4 1 1 A 136 136 VAL CB C 136 30.573 31.883 -1.310 1
1 1651 . 4 1 1 A 136 136 VAL N N 136 126.347 127.498 -1.151 1
1 1652 . 4 1 1 A 137 137 VAL H H 137 8.865 8.669 0.196 1
1 1653 . 4 1 1 A 137 137 VAL HA H 137 4.022 4.004 0.018 1
1 1661 . 4 1 1 A 137 137 VAL C C 137 175.208 176.228 -1.020 1
1 1662 . 4 1 1 A 137 137 VAL CA C 137 64.424 64.463 -0.039 1
1 1663 . 4 1 1 A 137 137 VAL CB C 137 32.943 32.379 0.564 1
1 1666 . 4 1 1 A 137 137 VAL N N 137 130.810 130.558 0.252 1
1 1667 . 4 1 1 A 138 138 ALA H H 138 7.677 7.356 0.321 1
1 1668 . 4 1 1 A 138 138 ALA HA H 138 4.496 4.709 -0.213 1
1 1672 . 4 1 1 A 138 138 ALA C C 138 174.405 175.227 -0.822 1
1 1673 . 4 1 1 A 138 138 ALA CA C 138 52.556 51.658 0.898 1
1 1674 . 4 1 1 A 138 138 ALA CB C 138 21.874 22.583 -0.709 1
1 1675 . 4 1 1 A 138 138 ALA N N 138 119.194 117.727 1.467 1
1 1676 . 4 1 1 A 139 139 ILE H H 139 8.052 8.505 -0.453 1
1 1677 . 4 1 1 A 139 139 ILE HA H 139 4.640 4.869 -0.229 1
1 1687 . 4 1 1 A 139 139 ILE C C 139 173.734 174.411 -0.677 1
1 1688 . 4 1 1 A 139 139 ILE CA C 139 61.623 59.996 1.627 1
1 1689 . 4 1 1 A 139 139 ILE CB C 139 43.363 41.960 1.403 1
1 1693 . 4 1 1 A 139 139 ILE N N 139 119.307 120.190 -0.883 1
1 1694 . 4 1 1 A 140 140 ARG H H 140 8.912 9.034 -0.122 1
1 1695 . 4 1 1 A 140 140 ARG HA H 140 4.760 4.877 -0.117 1
1 1702 . 4 1 1 A 140 140 ARG C C 140 174.181 174.894 -0.713 1
1 1703 . 4 1 1 A 140 140 ARG CA C 140 54.243 54.334 -0.091 1
1 1704 . 4 1 1 A 140 140 ARG CB C 140 33.438 34.221 -0.783 1
1 1707 . 4 1 1 A 140 140 ARG N N 140 122.820 126.589 -3.769 1
1 1708 . 4 1 1 A 141 141 GLU H H 141 8.545 8.456 0.089 1
1 1709 . 4 1 1 A 141 141 GLU HA H 141 4.254 4.373 -0.119 1
1 1714 . 4 1 1 A 141 141 GLU C C 141 177.299 176.172 1.127 1
1 1715 . 4 1 1 A 141 141 GLU CA C 141 57.165 56.477 0.688 1
1 1716 . 4 1 1 A 141 141 GLU CB C 141 30.048 29.890 0.158 1
1 1718 . 4 1 1 A 141 141 GLU N N 141 119.458 123.910 -4.452 1
1 1719 . 4 1 1 A 142 142 ALA H H 142 8.380 8.174 0.206 1
1 1720 . 4 1 1 A 142 142 ALA HA H 142 4.388 4.530 -0.142 1
1 1724 . 4 1 1 A 142 142 ALA C C 142 178.495 178.750 -0.255 1
1 1725 . 4 1 1 A 142 142 ALA CA C 142 51.113 52.038 -0.925 1
1 1726 . 4 1 1 A 142 142 ALA CB C 142 21.044 20.050 0.994 1
1 1727 . 4 1 1 A 142 142 ALA N N 142 127.330 127.593 -0.263 1
1 1728 . 4 1 1 A 143 143 THR H H 143 9.502 9.064 0.438 1
1 1729 . 4 1 1 A 143 143 THR HA H 143 4.362 4.823 -0.461 1
1 1734 . 4 1 1 A 143 143 THR C C 143 175.241 175.079 0.162 1
1 1735 . 4 1 1 A 143 143 THR CA C 143 60.541 60.955 -0.414 1
1 1736 . 4 1 1 A 143 143 THR CB C 143 70.879 68.655 2.224 1
1 1738 . 4 1 1 A 143 143 THR N N 143 114.561 110.284 4.277 1
1 1739 . 4 1 1 A 144 144 GLU H H 144 8.787 8.181 0.606 1
1 1740 . 4 1 1 A 144 144 GLU HA H 144 3.817 3.893 -0.076 1
1 1745 . 4 1 1 A 144 144 GLU C C 144 179.490 176.549 2.941 1
1 1746 . 4 1 1 A 144 144 GLU CA C 144 60.102 58.838 1.264 1
1 1747 . 4 1 1 A 144 144 GLU CB C 144 29.338 27.388 1.950 1
1 1749 . 4 1 1 A 144 144 GLU N N 144 120.475 115.341 5.134 1
1 1750 . 4 1 1 A 145 145 GLU H H 145 8.321 8.355 -0.034 1
1 1751 . 4 1 1 A 145 145 GLU HA H 145 3.899 3.944 -0.045 1
1 1756 . 4 1 1 A 145 145 GLU C C 145 178.521 179.617 -1.096 1
1 1757 . 4 1 1 A 145 145 GLU CA C 145 59.588 59.092 0.496 1
1 1758 . 4 1 1 A 145 145 GLU CB C 145 29.658 29.184 0.474 1
1 1760 . 4 1 1 A 145 145 GLU N N 145 119.761 119.424 0.337 1
1 1761 . 4 1 1 A 146 146 GLU H H 146 7.514 8.131 -0.617 1
1 1762 . 4 1 1 A 146 146 GLU HA H 146 3.856 4.231 -0.375 1
1 1767 . 4 1 1 A 146 146 GLU C C 146 179.189 179.387 -0.198 1
1 1768 . 4 1 1 A 146 146 GLU CA C 146 59.148 59.053 0.095 1
1 1769 . 4 1 1 A 146 146 GLU CB C 146 29.834 29.179 0.655 1
1 1771 . 4 1 1 A 146 146 GLU N N 146 121.118 120.806 0.312 1
1 1772 . 4 1 1 A 147 147 LEU H H 147 7.823 8.167 -0.344 1
1 1773 . 4 1 1 A 147 147 LEU HA H 147 3.662 3.989 -0.327 1
1 1783 . 4 1 1 A 147 147 LEU C C 147 179.341 178.726 0.615 1
1 1784 . 4 1 1 A 147 147 LEU CA C 147 57.277 57.740 -0.463 1
1 1785 . 4 1 1 A 147 147 LEU CB C 147 41.239 41.650 -0.411 1
1 1789 . 4 1 1 A 147 147 LEU N N 147 117.199 120.528 -3.329 1
1 1790 . 4 1 1 A 148 148 ALA H H 148 7.788 8.607 -0.819 1
1 1791 . 4 1 1 A 148 148 ALA HA H 148 3.958 4.060 -0.102 1
1 1795 . 4 1 1 A 148 148 ALA C C 148 179.777 178.996 0.781 1
1 1796 . 4 1 1 A 148 148 ALA CA C 148 54.509 54.764 -0.255 1
1 1797 . 4 1 1 A 148 148 ALA CB C 148 18.064 18.236 -0.172 1
1 1798 . 4 1 1 A 148 148 ALA N N 148 121.696 120.838 0.858 1
1 1799 . 4 1 1 A 149 149 HIS H H 149 7.726 7.173 0.553 1
1 1800 . 4 1 1 A 149 149 HIS HA H 149 4.477 4.747 -0.270 1
1 1805 . 4 1 1 A 149 149 HIS C C 149 176.099 175.818 0.281 1
1 1806 . 4 1 1 A 149 149 HIS CA C 149 55.802 56.058 -0.256 1
1 1807 . 4 1 1 A 149 149 HIS CB C 149 30.406 30.876 -0.470 1
1 1810 . 4 1 1 A 149 149 HIS N N 149 114.463 112.711 1.752 1
1 1811 . 4 1 1 A 150 150 GLY H H 150 8.076 9.079 -1.003 1
1 1812 . 4 1 1 A 150 150 GLY HA2 H 150 3.927 3.325 0.602 1
1 1813 . 4 1 1 A 150 150 GLY HA3 H 150 3.237 3.622 -0.385 1
1 1814 . 4 1 1 A 150 150 GLY C C 150 173.382 173.066 0.316 1
1 1815 . 4 1 1 A 150 150 GLY CA C 150 46.117 45.451 0.666 1
1 1816 . 4 1 1 A 150 150 GLY N N 150 109.417 107.814 1.603 1
1 1817 . 4 1 1 A 151 151 HIS H H 151 7.518 7.612 -0.094 1
1 1818 . 4 1 1 A 151 151 HIS HA H 151 4.563 4.941 -0.378 1
1 1823 . 4 1 1 A 151 151 HIS C C 151 173.157 174.452 -1.295 1
1 1824 . 4 1 1 A 151 151 HIS CA C 151 54.731 53.996 0.735 1
1 1825 . 4 1 1 A 151 151 HIS CB C 151 31.611 33.196 -1.585 1
1 1828 . 4 1 1 A 151 151 HIS N N 151 114.828 117.230 -2.402 1
1 1829 . 4 1 1 A 152 152 VAL H H 152 7.931 8.781 -0.850 1
1 1830 . 4 1 1 A 152 152 VAL HA H 152 3.951 3.821 0.130 1
1 1838 . 4 1 1 A 152 152 VAL C C 152 175.848 175.654 0.194 1
1 1839 . 4 1 1 A 152 152 VAL CA C 152 62.190 64.011 -1.821 1
1 1840 . 4 1 1 A 152 152 VAL CB C 152 32.703 32.987 -0.284 1
1 1843 . 4 1 1 A 152 152 VAL N N 152 118.551 121.659 -3.108 1
1 1844 . 4 1 1 A 153 153 HIS H H 153 9.784 7.974 1.810 1
1 1845 . 4 1 1 A 153 153 HIS HA H 153 4.604 4.277 0.327 1
1 1850 . 4 1 1 A 153 153 HIS C C 153 175.795 175.373 0.422 1
1 1851 . 4 1 1 A 153 153 HIS CA C 153 56.753 56.512 0.241 1
1 1852 . 4 1 1 A 153 153 HIS CB C 153 30.325 28.406 1.919 1
1 1855 . 4 1 1 A 153 153 HIS N N 153 127.403 118.601 8.802 1
1 1856 . 4 1 1 A 154 154 GLY H H 154 8.447 8.571 -0.124 1
1 1857 . 4 1 1 A 154 154 GLY HA2 H 154 3.797 3.843 -0.046 1
1 1858 . 4 1 1 A 154 154 GLY HA3 H 154 3.797 3.850 -0.053 1
1 1859 . 4 1 1 A 154 154 GLY C C 154 173.848 174.085 -0.237 1
1 1860 . 4 1 1 A 154 154 GLY CA C 154 45.153 45.702 -0.549 1
1 1861 . 4 1 1 A 154 154 GLY N N 154 112.233 112.104 0.129 1
1 1862 . 4 1 1 A 155 155 ALA H H 155 8.074 7.706 0.368 1
1 1863 . 4 1 1 A 155 155 ALA HA H 155 4.101 4.731 -0.630 1
1 1867 . 4 1 1 A 155 155 ALA C C 155 177.651 177.167 0.484 1
1 1868 . 4 1 1 A 155 155 ALA CA C 155 52.795 50.449 2.346 1
1 1869 . 4 1 1 A 155 155 ALA CB C 155 19.258 21.678 -2.420 1
1 1870 . 4 1 1 A 155 155 ALA N N 155 124.092 122.742 1.350 1
1 1871 . 4 1 1 A 156 156 HIS H H 156 8.201 8.877 -0.676 1
1 1872 . 4 1 1 A 156 156 HIS HA H 156 4.474 4.055 0.419 1
1 1875 . 4 1 1 A 156 156 HIS C C 156 174.758 174.159 0.599 1
1 1876 . 4 1 1 A 156 156 HIS CA C 156 55.756 56.633 -0.877 1
1 1877 . 4 1 1 A 156 156 HIS CB C 156 30.060 28.359 1.701 1
1 1878 . 4 1 1 A 156 156 HIS N N 156 118.170 118.095 0.075 1
1 1879 . 4 1 1 A 157 157 ASP H H 157 8.001 7.707 0.294 1
1 1880 . 4 1 1 A 157 157 ASP HA H 157 4.436 4.786 -0.350 1
1 1883 . 4 1 1 A 157 157 ASP CA C 157 54.185 53.205 0.980 1
1 1884 . 4 1 1 A 157 157 ASP CB C 157 41.016 42.538 -1.522 1
1 1885 . 4 1 1 A 157 157 ASP N N 157 121.683 119.447 2.236 1
1 1886 . 4 1 1 A 160 160 HIS HA H 160 4.502 5.503 -1.001 1
1 1889 . 4 1 1 A 160 160 HIS C C 160 174.722 172.683 2.039 1
1 1890 . 4 1 1 A 160 160 HIS CA C 160 55.979 53.453 2.526 1
1 1891 . 4 1 1 A 160 160 HIS CB C 160 30.058 32.845 -2.787 1
1 1892 . 4 1 1 A 161 161 ASP H H 161 8.270 9.019 -0.749 1
1 1893 . 4 1 1 A 161 161 ASP HA H 161 4.446 4.916 -0.470 1
1 1896 . 4 1 1 A 161 161 ASP C C 161 176.107 176.167 -0.060 1
1 1897 . 4 1 1 A 161 161 ASP CA C 161 54.474 53.413 1.061 1
1 1898 . 4 1 1 A 161 161 ASP CB C 161 40.820 39.280 1.540 1
1 1899 . 4 1 1 A 161 161 ASP N N 161 121.957 121.111 0.846 1
1 1900 . 4 1 1 A 162 162 HIS H H 162 8.212 8.118 0.094 1
1 1901 . 4 1 1 A 162 162 HIS HA H 162 4.289 4.253 0.036 1
1 1904 . 4 1 1 A 162 162 HIS C C 162 175.036 173.805 1.231 1
1 1905 . 4 1 1 A 162 162 HIS CA C 162 56.185 56.414 -0.229 1
1 1906 . 4 1 1 A 162 162 HIS CB C 162 30.108 27.959 2.149 1
1 1907 . 4 1 1 A 162 162 HIS N N 162 119.766 118.675 1.091 1
1 1908 . 4 1 1 A 163 163 ASP H H 163 8.163 7.895 0.268 1
1 1909 . 4 1 1 A 163 163 ASP HA H 163 4.428 4.381 0.047 1
1 1912 . 4 1 1 A 163 163 ASP C C 163 176.161 176.145 0.016 1
1 1913 . 4 1 1 A 163 163 ASP CA C 163 54.585 54.240 0.345 1
1 1914 . 4 1 1 A 163 163 ASP CB C 163 40.823 40.466 0.357 1
1 1915 . 4 1 1 A 163 163 ASP N N 163 121.265 120.257 1.008 1
1 1916 . 4 1 1 A 164 164 HIS H H 164 8.106 7.978 0.128 1
1 1917 . 4 1 1 A 164 164 HIS HA H 164 4.422 4.875 -0.453 1
1 1920 . 4 1 1 A 164 164 HIS C C 164 174.904 175.569 -0.665 1
1 1921 . 4 1 1 A 164 164 HIS CA C 164 56.361 54.646 1.715 1
1 1922 . 4 1 1 A 164 164 HIS CB C 164 30.305 29.529 0.776 1
1 1923 . 4 1 1 A 164 164 HIS N N 164 119.729 118.158 1.571 1
1 1924 . 4 1 1 A 165 165 ASP H H 165 8.118 7.866 0.252 1
1 1925 . 4 1 1 A 165 165 ASP HA H 165 4.394 4.271 0.123 1
1 1928 . 4 1 1 A 165 165 ASP C C 165 176.054 176.353 -0.299 1
1 1929 . 4 1 1 A 165 165 ASP CA C 165 54.364 56.404 -2.040 1
1 1930 . 4 1 1 A 165 165 ASP CB C 165 40.818 40.681 0.137 1
1 1931 . 4 1 1 A 165 165 ASP N N 165 121.062 119.522 1.540 1
1 1932 . 4 1 1 A 166 166 HIS H H 166 8.092 7.643 0.449 1
1 1933 . 4 1 1 A 166 166 HIS CA C 166 56.114 56.414 -0.300 1
1 1934 . 4 1 1 A 166 166 HIS CB C 166 29.702 29.654 0.048 1
1 1935 . 4 1 1 A 166 166 HIS N N 166 120.001 117.376 2.625 1
1 1936 . 4 1 1 A 170 170 HIS HA H 170 4.514 4.173 0.341 1
1 1939 . 4 1 1 A 170 170 HIS C C 170 173.952 174.619 -0.667 1
1 1940 . 4 1 1 A 170 170 HIS CA C 170 55.995 56.810 -0.815 1
1 1941 . 4 1 1 A 170 170 HIS CB C 170 30.161 28.239 1.922 1
1 14 . 5 1 1 A 2 2 LYS H H 2 7.540 8.831 -1.291 1
1 15 . 5 1 1 A 2 2 LYS HA H 2 4.729 4.967 -0.238 1
1 24 . 5 1 1 A 2 2 LYS C C 2 175.948 175.387 0.561 1
1 25 . 5 1 1 A 2 2 LYS CA C 2 53.978 54.364 -0.386 1
1 26 . 5 1 1 A 2 2 LYS CB C 2 35.985 34.919 1.066 1
1 30 . 5 1 1 A 2 2 LYS N N 2 120.764 120.656 0.108 1
1 31 . 5 1 1 A 3 3 VAL H H 3 8.738 8.205 0.533 1
1 32 . 5 1 1 A 3 3 VAL HA H 3 2.800 4.425 -1.625 1
1 40 . 5 1 1 A 3 3 VAL C C 3 175.018 174.937 0.081 1
1 41 . 5 1 1 A 3 3 VAL CA C 3 66.598 61.447 5.151 1
1 42 . 5 1 1 A 3 3 VAL CB C 3 31.218 32.639 -1.421 1
1 45 . 5 1 1 A 3 3 VAL N N 3 120.055 121.170 -1.115 1
1 46 . 5 1 1 A 4 4 ALA H H 4 6.584 8.714 -2.130 1
1 47 . 5 1 1 A 4 4 ALA HA H 4 4.223 4.142 0.081 1
1 51 . 5 1 1 A 4 4 ALA C C 4 174.117 175.225 -1.108 1
1 52 . 5 1 1 A 4 4 ALA CA C 4 50.358 50.709 -0.351 1
1 53 . 5 1 1 A 4 4 ALA CB C 4 22.137 22.735 -0.598 1
1 54 . 5 1 1 A 4 4 ALA N N 4 129.800 129.677 0.123 1
1 55 . 5 1 1 A 5 5 LYS H H 5 8.596 8.351 0.245 1
1 56 . 5 1 1 A 5 5 LYS HA H 5 3.793 4.145 -0.352 1
1 65 . 5 1 1 A 5 5 LYS C C 5 175.260 177.024 -1.764 1
1 66 . 5 1 1 A 5 5 LYS CA C 5 57.700 57.903 -0.203 1
1 67 . 5 1 1 A 5 5 LYS CB C 5 32.400 32.377 0.023 1
1 71 . 5 1 1 A 5 5 LYS N N 5 118.708 120.341 -1.633 1
1 72 . 5 1 1 A 6 6 ASP H H 6 8.679 9.105 -0.426 1
1 73 . 5 1 1 A 6 6 ASP HA H 6 4.040 4.389 -0.349 1
1 76 . 5 1 1 A 6 6 ASP C C 6 173.331 175.411 -2.080 1
1 77 . 5 1 1 A 6 6 ASP CA C 6 57.508 55.812 1.696 1
1 78 . 5 1 1 A 6 6 ASP CB C 6 37.604 39.555 -1.951 1
1 79 . 5 1 1 A 6 6 ASP N N 6 115.415 120.778 -5.363 1
1 80 . 5 1 1 A 7 7 LEU H H 7 7.376 7.834 -0.458 1
1 81 . 5 1 1 A 7 7 LEU HA H 7 4.689 4.380 0.309 1
1 91 . 5 1 1 A 7 7 LEU C C 7 175.906 175.721 0.185 1
1 92 . 5 1 1 A 7 7 LEU CA C 7 53.509 53.743 -0.234 1
1 93 . 5 1 1 A 7 7 LEU CB C 7 42.419 41.487 0.932 1
1 97 . 5 1 1 A 7 7 LEU N N 7 117.619 121.268 -3.649 1
1 98 . 5 1 1 A 8 8 VAL H H 8 8.646 8.560 0.086 1
1 99 . 5 1 1 A 8 8 VAL HA H 8 4.397 4.076 0.321 1
1 107 . 5 1 1 A 8 8 VAL C C 8 175.244 175.133 0.111 1
1 108 . 5 1 1 A 8 8 VAL CA C 8 62.028 62.820 -0.792 1
1 109 . 5 1 1 A 8 8 VAL CB C 8 31.515 32.195 -0.680 1
1 112 . 5 1 1 A 8 8 VAL N N 8 121.164 127.104 -5.940 1
1 113 . 5 1 1 A 9 9 VAL H H 9 8.607 8.134 0.473 1
1 114 . 5 1 1 A 9 9 VAL HA H 9 4.281 4.958 -0.677 1
1 122 . 5 1 1 A 9 9 VAL C C 9 174.156 173.988 0.168 1
1 123 . 5 1 1 A 9 9 VAL CA C 9 60.614 58.804 1.810 1
1 124 . 5 1 1 A 9 9 VAL CB C 9 33.985 35.983 -1.998 1
1 127 . 5 1 1 A 9 9 VAL N N 9 134.014 122.393 11.621 1
1 128 . 5 1 1 A 10 10 SER H H 10 8.684 8.726 -0.042 1
1 129 . 5 1 1 A 10 10 SER HA H 10 5.736 5.497 0.239 1
1 132 . 5 1 1 A 10 10 SER C C 10 173.544 173.541 0.003 1
1 133 . 5 1 1 A 10 10 SER CA C 10 56.533 57.765 -1.232 1
1 134 . 5 1 1 A 10 10 SER CB C 10 63.385 64.509 -1.124 1
1 135 . 5 1 1 A 10 10 SER N N 10 121.492 118.474 3.018 1
1 136 . 5 1 1 A 11 11 LEU H H 11 9.939 8.829 1.110 1
1 137 . 5 1 1 A 11 11 LEU HA H 11 5.133 5.181 -0.048 1
1 147 . 5 1 1 A 11 11 LEU C C 11 174.843 175.314 -0.471 1
1 148 . 5 1 1 A 11 11 LEU CA C 11 53.770 53.465 0.305 1
1 149 . 5 1 1 A 11 11 LEU CB C 11 47.469 46.290 1.179 1
1 153 . 5 1 1 A 11 11 LEU N N 11 128.460 122.348 6.112 1
1 154 . 5 1 1 A 12 12 ALA H H 12 8.770 8.991 -0.221 1
1 155 . 5 1 1 A 12 12 ALA HA H 12 4.830 5.274 -0.444 1
1 159 . 5 1 1 A 12 12 ALA C C 12 176.974 176.495 0.479 1
1 160 . 5 1 1 A 12 12 ALA CA C 12 50.231 50.926 -0.695 1
1 161 . 5 1 1 A 12 12 ALA CB C 12 21.270 21.480 -0.210 1
1 162 . 5 1 1 A 12 12 ALA N N 12 127.500 122.445 5.055 1
1 163 . 5 1 1 A 13 13 TYR H H 13 8.749 8.325 0.424 1
1 164 . 5 1 1 A 13 13 TYR HA H 13 5.797 5.764 0.033 1
1 171 . 5 1 1 A 13 13 TYR C C 13 173.952 172.630 1.322 1
1 172 . 5 1 1 A 13 13 TYR CA C 13 56.390 55.798 0.592 1
1 173 . 5 1 1 A 13 13 TYR CB C 13 41.159 42.009 -0.850 1
1 176 . 5 1 1 A 13 13 TYR N N 13 117.737 116.466 1.271 1
1 177 . 5 1 1 A 14 14 GLN H H 14 8.492 8.459 0.033 1
1 178 . 5 1 1 A 14 14 GLN HA H 14 4.611 5.089 -0.478 1
1 185 . 5 1 1 A 14 14 GLN C C 14 174.492 173.707 0.785 1
1 186 . 5 1 1 A 14 14 GLN CA C 14 55.626 54.452 1.174 1
1 187 . 5 1 1 A 14 14 GLN CB C 14 32.734 32.142 0.592 1
1 189 . 5 1 1 A 14 14 GLN N N 14 116.962 120.286 -3.324 1
1 191 . 5 1 1 A 15 15 VAL H H 15 8.403 9.273 -0.870 1
1 192 . 5 1 1 A 15 15 VAL HA H 15 4.614 5.390 -0.776 1
1 200 . 5 1 1 A 15 15 VAL C C 15 173.389 174.984 -1.595 1
1 201 . 5 1 1 A 15 15 VAL CA C 15 59.711 60.251 -0.540 1
1 202 . 5 1 1 A 15 15 VAL CB C 15 33.639 34.398 -0.759 1
1 205 . 5 1 1 A 15 15 VAL N N 15 121.203 127.083 -5.880 1
1 206 . 5 1 1 A 16 16 ARG H H 16 8.584 9.400 -0.816 1
1 207 . 5 1 1 A 16 16 ARG HA H 16 5.584 4.960 0.624 1
1 214 . 5 1 1 A 16 16 ARG C C 16 176.585 174.955 1.630 1
1 215 . 5 1 1 A 16 16 ARG CA C 16 53.453 53.917 -0.464 1
1 216 . 5 1 1 A 16 16 ARG CB C 16 34.968 33.844 1.124 1
1 219 . 5 1 1 A 16 16 ARG N N 16 126.883 126.856 0.027 1
1 220 . 5 1 1 A 17 17 THR H H 17 8.270 8.479 -0.209 1
1 221 . 5 1 1 A 17 17 THR HA H 17 4.573 4.567 0.006 1
1 226 . 5 1 1 A 17 17 THR C C 17 177.860 176.211 1.649 1
1 227 . 5 1 1 A 17 17 THR CA C 17 61.073 60.872 0.201 1
1 228 . 5 1 1 A 17 17 THR CB C 17 69.823 71.417 -1.594 1
1 230 . 5 1 1 A 17 17 THR N N 17 109.730 113.039 -3.309 1
1 231 . 5 1 1 A 18 18 GLU H H 18 9.147 8.869 0.278 1
1 232 . 5 1 1 A 18 18 GLU HA H 18 3.770 4.074 -0.304 1
1 237 . 5 1 1 A 18 18 GLU C C 18 176.683 177.793 -1.110 1
1 238 . 5 1 1 A 18 18 GLU CA C 18 59.866 58.555 1.311 1
1 239 . 5 1 1 A 18 18 GLU CB C 18 29.752 29.231 0.521 1
1 241 . 5 1 1 A 18 18 GLU N N 18 122.491 120.688 1.803 1
1 242 . 5 1 1 A 19 19 ASP H H 19 7.900 7.705 0.195 1
1 243 . 5 1 1 A 19 19 ASP HA H 19 4.456 4.696 -0.240 1
1 246 . 5 1 1 A 19 19 ASP C C 19 176.670 176.181 0.489 1
1 247 . 5 1 1 A 19 19 ASP CA C 19 53.833 54.191 -0.358 1
1 248 . 5 1 1 A 19 19 ASP CB C 19 40.180 41.370 -1.190 1
1 249 . 5 1 1 A 19 19 ASP N N 19 116.200 117.889 -1.689 1
1 250 . 5 1 1 A 20 20 GLY H H 20 8.149 8.018 0.131 1
1 251 . 5 1 1 A 20 20 GLY HA2 H 20 4.145 3.934 0.211 1
1 252 . 5 1 1 A 20 20 GLY HA3 H 20 3.531 3.944 -0.413 1
1 253 . 5 1 1 A 20 20 GLY C C 20 173.987 174.305 -0.318 1
1 254 . 5 1 1 A 20 20 GLY CA C 20 45.463 45.009 0.454 1
1 255 . 5 1 1 A 20 20 GLY N N 20 108.869 107.780 1.089 1
1 256 . 5 1 1 A 21 21 VAL H H 21 7.261 7.927 -0.666 1
1 257 . 5 1 1 A 21 21 VAL HA H 21 3.645 4.069 -0.424 1
1 265 . 5 1 1 A 21 21 VAL C C 21 175.265 174.970 0.295 1
1 266 . 5 1 1 A 21 21 VAL CA C 21 63.368 62.254 1.114 1
1 267 . 5 1 1 A 21 21 VAL CB C 21 31.614 32.306 -0.692 1
1 270 . 5 1 1 A 21 21 VAL N N 21 124.283 121.844 2.439 1
1 271 . 5 1 1 A 22 22 LEU H H 22 8.407 8.258 0.149 1
1 272 . 5 1 1 A 22 22 LEU HA H 22 4.333 4.307 0.026 1
1 282 . 5 1 1 A 22 22 LEU C C 22 176.660 176.310 0.350 1
1 283 . 5 1 1 A 22 22 LEU CA C 22 55.724 56.479 -0.755 1
1 284 . 5 1 1 A 22 22 LEU CB C 22 42.272 42.383 -0.111 1
1 288 . 5 1 1 A 22 22 LEU N N 22 128.533 128.665 -0.132 1
1 289 . 5 1 1 A 23 23 VAL H H 23 8.887 9.358 -0.471 1
1 290 . 5 1 1 A 23 23 VAL HA H 23 4.237 4.308 -0.071 1
1 298 . 5 1 1 A 23 23 VAL C C 23 175.265 174.870 0.395 1
1 299 . 5 1 1 A 23 23 VAL CA C 23 62.348 63.211 -0.863 1
1 300 . 5 1 1 A 23 23 VAL CB C 23 33.383 34.273 -0.890 1
1 303 . 5 1 1 A 23 23 VAL N N 23 125.041 125.869 -0.828 1
1 304 . 5 1 1 A 24 24 ASP H H 24 7.480 7.697 -0.217 1
1 305 . 5 1 1 A 24 24 ASP HA H 24 4.763 5.041 -0.278 1
1 308 . 5 1 1 A 24 24 ASP C C 24 173.160 174.146 -0.986 1
1 309 . 5 1 1 A 24 24 ASP CA C 24 53.893 53.695 0.198 1
1 310 . 5 1 1 A 24 24 ASP CB C 24 43.680 44.336 -0.656 1
1 311 . 5 1 1 A 24 24 ASP N N 24 117.159 119.957 -2.798 1
1 312 . 5 1 1 A 25 25 GLU H H 25 8.187 8.764 -0.577 1
1 313 . 5 1 1 A 25 25 GLU HA H 25 4.491 4.789 -0.298 1
1 318 . 5 1 1 A 25 25 GLU C C 25 174.586 173.627 0.959 1
1 319 . 5 1 1 A 25 25 GLU CA C 25 55.475 55.272 0.203 1
1 320 . 5 1 1 A 25 25 GLU CB C 25 33.033 33.316 -0.283 1
1 322 . 5 1 1 A 25 25 GLU N N 25 118.821 118.507 0.314 1
1 323 . 5 1 1 A 26 26 SER H H 26 8.003 8.027 -0.024 1
1 324 . 5 1 1 A 26 26 SER HA H 26 4.782 4.800 -0.018 1
1 327 . 5 1 1 A 26 26 SER CA C 26 56.490 55.167 1.323 1
1 328 . 5 1 1 A 26 26 SER CB C 26 64.977 64.061 0.916 1
1 329 . 5 1 1 A 26 26 SER N N 26 119.346 117.920 1.426 1
1 330 . 5 1 1 A 27 27 PRO HA H 27 4.633 4.823 -0.190 1
1 337 . 5 1 1 A 27 27 PRO C C 27 177.016 177.361 -0.345 1
1 338 . 5 1 1 A 27 27 PRO CA C 27 61.943 62.848 -0.905 1
1 339 . 5 1 1 A 27 27 PRO CB C 27 32.492 32.643 -0.151 1
1 342 . 5 1 1 A 28 28 VAL H H 28 8.383 8.556 -0.173 1
1 343 . 5 1 1 A 28 28 VAL HA H 28 3.385 3.813 -0.428 1
1 351 . 5 1 1 A 28 28 VAL C C 28 176.069 176.576 -0.507 1
1 352 . 5 1 1 A 28 28 VAL CA C 28 65.888 64.720 1.168 1
1 353 . 5 1 1 A 28 28 VAL CB C 28 31.220 31.546 -0.326 1
1 356 . 5 1 1 A 28 28 VAL N N 28 119.349 123.321 -3.972 1
1 357 . 5 1 1 A 29 29 SER H H 29 7.365 7.822 -0.457 1
1 358 . 5 1 1 A 29 29 SER HA H 29 4.101 4.459 -0.358 1
1 361 . 5 1 1 A 29 29 SER C C 29 174.535 174.578 -0.043 1
1 362 . 5 1 1 A 29 29 SER CA C 29 58.609 59.067 -0.458 1
1 363 . 5 1 1 A 29 29 SER CB C 29 63.198 64.026 -0.828 1
1 364 . 5 1 1 A 29 29 SER N N 29 109.365 114.705 -5.340 1
1 365 . 5 1 1 A 30 30 ALA H H 30 7.457 7.632 -0.175 1
1 366 . 5 1 1 A 30 30 ALA HA H 30 4.548 4.731 -0.183 1
1 370 . 5 1 1 A 30 30 ALA CA C 30 50.789 49.464 1.325 1
1 371 . 5 1 1 A 30 30 ALA CB C 30 18.608 21.297 -2.689 1
1 372 . 5 1 1 A 30 30 ALA N N 30 126.056 122.471 3.585 1
1 373 . 5 1 1 A 31 31 PRO HA H 31 4.332 4.665 -0.333 1
1 380 . 5 1 1 A 31 31 PRO C C 31 175.841 175.996 -0.155 1
1 381 . 5 1 1 A 31 31 PRO CA C 31 62.996 62.472 0.524 1
1 382 . 5 1 1 A 31 31 PRO CB C 31 32.696 32.635 0.061 1
1 385 . 5 1 1 A 32 32 LEU H H 32 8.717 8.775 -0.058 1
1 386 . 5 1 1 A 32 32 LEU HA H 32 4.452 4.901 -0.449 1
1 396 . 5 1 1 A 32 32 LEU C C 32 175.298 175.751 -0.453 1
1 397 . 5 1 1 A 32 32 LEU CA C 32 54.510 54.385 0.125 1
1 398 . 5 1 1 A 32 32 LEU CB C 32 43.899 44.208 -0.309 1
1 402 . 5 1 1 A 32 32 LEU N N 32 123.702 122.271 1.431 1
1 403 . 5 1 1 A 33 33 ASP H H 33 8.258 9.322 -1.064 1
1 404 . 5 1 1 A 33 33 ASP HA H 33 5.919 5.710 0.209 1
1 407 . 5 1 1 A 33 33 ASP C C 33 175.927 174.659 1.268 1
1 408 . 5 1 1 A 33 33 ASP CA C 33 52.619 52.559 0.060 1
1 409 . 5 1 1 A 33 33 ASP CB C 33 42.205 43.502 -1.297 1
1 410 . 5 1 1 A 33 33 ASP N N 33 128.453 126.449 2.004 1
1 411 . 5 1 1 A 34 34 TYR H H 34 9.144 8.171 0.973 1
1 412 . 5 1 1 A 34 34 TYR HA H 34 4.689 5.212 -0.523 1
1 419 . 5 1 1 A 34 34 TYR C C 34 170.622 172.307 -1.685 1
1 420 . 5 1 1 A 34 34 TYR CA C 34 55.930 56.286 -0.356 1
1 421 . 5 1 1 A 34 34 TYR CB C 34 41.905 40.349 1.556 1
1 424 . 5 1 1 A 34 34 TYR N N 34 121.657 118.569 3.088 1
1 425 . 5 1 1 A 35 35 LEU H H 35 8.324 8.892 -0.568 1
1 426 . 5 1 1 A 35 35 LEU HA H 35 4.396 4.991 -0.595 1
1 436 . 5 1 1 A 35 35 LEU C C 35 175.301 176.456 -1.155 1
1 437 . 5 1 1 A 35 35 LEU CA C 35 52.909 53.447 -0.538 1
1 438 . 5 1 1 A 35 35 LEU CB C 35 42.816 43.963 -1.147 1
1 442 . 5 1 1 A 35 35 LEU N N 35 124.514 123.165 1.349 1
1 443 . 5 1 1 A 36 36 HIS H H 36 8.763 8.686 0.077 1
1 444 . 5 1 1 A 36 36 HIS HA H 36 4.382 4.562 -0.180 1
1 449 . 5 1 1 A 36 36 HIS C C 36 176.514 176.476 0.038 1
1 450 . 5 1 1 A 36 36 HIS CA C 36 59.570 57.765 1.805 1
1 451 . 5 1 1 A 36 36 HIS CB C 36 31.257 29.637 1.620 1
1 454 . 5 1 1 A 36 36 HIS N N 36 132.209 126.460 5.749 1
1 455 . 5 1 1 A 37 37 GLY H H 37 8.745 8.456 0.289 1
1 456 . 5 1 1 A 37 37 GLY HA2 H 37 4.021 3.838 0.183 1
1 457 . 5 1 1 A 37 37 GLY HA3 H 37 3.592 3.926 -0.334 1
1 458 . 5 1 1 A 37 37 GLY C C 37 175.081 174.131 0.950 1
1 459 . 5 1 1 A 37 37 GLY CA C 37 45.621 45.544 0.077 1
1 460 . 5 1 1 A 37 37 GLY N N 37 117.737 115.402 2.335 1
1 461 . 5 1 1 A 38 38 HIS H H 38 8.470 8.220 0.250 1
1 462 . 5 1 1 A 38 38 HIS HA H 38 4.584 4.755 -0.171 1
1 467 . 5 1 1 A 38 38 HIS C C 38 175.334 174.925 0.409 1
1 468 . 5 1 1 A 38 38 HIS CA C 38 55.899 56.666 -0.767 1
1 469 . 5 1 1 A 38 38 HIS CB C 38 30.865 31.449 -0.584 1
1 472 . 5 1 1 A 38 38 HIS N N 38 119.813 117.471 2.342 1
1 473 . 5 1 1 A 39 39 GLY H H 39 8.936 7.482 1.454 1
1 474 . 5 1 1 A 39 39 GLY HA2 H 39 3.895 3.993 -0.098 1
1 475 . 5 1 1 A 39 39 GLY HA3 H 39 3.895 4.076 -0.181 1
1 476 . 5 1 1 A 39 39 GLY C C 39 175.557 173.684 1.873 1
1 477 . 5 1 1 A 39 39 GLY CA C 39 46.938 45.607 1.331 1
1 478 . 5 1 1 A 39 39 GLY N N 39 112.442 106.569 5.873 1
1 479 . 5 1 1 A 40 40 SER H H 40 9.249 8.775 0.474 1
1 480 . 5 1 1 A 40 40 SER HA H 40 4.299 4.730 -0.431 1
1 483 . 5 1 1 A 40 40 SER C C 40 174.138 174.391 -0.253 1
1 484 . 5 1 1 A 40 40 SER CA C 40 60.809 57.541 3.268 1
1 485 . 5 1 1 A 40 40 SER CB C 40 64.041 63.879 0.162 1
1 486 . 5 1 1 A 40 40 SER N N 40 117.098 119.952 -2.854 1
1 487 . 5 1 1 A 41 41 LEU H H 41 7.386 8.005 -0.619 1
1 488 . 5 1 1 A 41 41 LEU HA H 41 4.429 4.073 0.356 1
1 498 . 5 1 1 A 41 41 LEU C C 41 176.526 175.697 0.829 1
1 499 . 5 1 1 A 41 41 LEU CA C 41 52.295 57.020 -4.725 1
1 500 . 5 1 1 A 41 41 LEU CB C 41 44.147 41.285 2.862 1
1 504 . 5 1 1 A 41 41 LEU N N 41 120.541 119.959 0.582 1
1 505 . 5 1 1 A 42 42 ILE H H 42 7.407 7.734 -0.327 1
1 506 . 5 1 1 A 42 42 ILE HA H 42 3.756 4.558 -0.802 1
1 516 . 5 1 1 A 42 42 ILE C C 42 178.081 176.089 1.992 1
1 517 . 5 1 1 A 42 42 ILE CA C 42 62.257 58.803 3.454 1
1 518 . 5 1 1 A 42 42 ILE CB C 42 38.256 40.856 -2.600 1
1 522 . 5 1 1 A 42 42 ILE N N 42 115.050 119.244 -4.194 1
1 523 . 5 1 1 A 43 43 SER H H 43 8.581 9.097 -0.516 1
1 524 . 5 1 1 A 43 43 SER HA H 43 3.957 4.030 -0.073 1
1 527 . 5 1 1 A 43 43 SER C C 43 177.830 177.050 0.780 1
1 528 . 5 1 1 A 43 43 SER CA C 43 61.958 61.840 0.118 1
1 529 . 5 1 1 A 43 43 SER CB C 43 62.680 62.594 0.086 1
1 530 . 5 1 1 A 43 43 SER N N 43 121.456 120.754 0.702 1
1 531 . 5 1 1 A 44 44 GLY H H 44 8.892 8.480 0.412 1
1 532 . 5 1 1 A 44 44 GLY HA2 H 44 3.514 3.800 -0.286 1
1 533 . 5 1 1 A 44 44 GLY HA3 H 44 3.854 3.811 0.043 1
1 534 . 5 1 1 A 44 44 GLY C C 44 175.296 175.515 -0.219 1
1 535 . 5 1 1 A 44 44 GLY CA C 44 46.854 47.412 -0.558 1
1 536 . 5 1 1 A 44 44 GLY N N 44 106.351 108.839 -2.488 1
1 537 . 5 1 1 A 45 45 LEU H H 45 6.824 7.759 -0.935 1
1 538 . 5 1 1 A 45 45 LEU HA H 45 3.909 4.103 -0.194 1
1 548 . 5 1 1 A 45 45 LEU C C 45 176.738 178.482 -1.744 1
1 549 . 5 1 1 A 45 45 LEU CA C 45 56.356 57.096 -0.740 1
1 550 . 5 1 1 A 45 45 LEU CB C 45 42.296 41.265 1.031 1
1 554 . 5 1 1 A 45 45 LEU N N 45 119.207 122.893 -3.686 1
1 555 . 5 1 1 A 46 46 GLU H H 46 7.556 7.874 -0.318 1
1 556 . 5 1 1 A 46 46 GLU HA H 46 3.664 3.988 -0.324 1
1 561 . 5 1 1 A 46 46 GLU C C 46 179.231 179.407 -0.176 1
1 562 . 5 1 1 A 46 46 GLU CA C 46 62.316 59.598 2.718 1
1 563 . 5 1 1 A 46 46 GLU CB C 46 29.147 29.042 0.105 1
1 565 . 5 1 1 A 46 46 GLU N N 46 119.049 118.169 0.880 1
1 566 . 5 1 1 A 47 47 THR H H 47 8.219 7.642 0.577 1
1 567 . 5 1 1 A 47 47 THR HA H 47 3.965 4.367 -0.402 1
1 572 . 5 1 1 A 47 47 THR C C 47 176.251 176.593 -0.342 1
1 573 . 5 1 1 A 47 47 THR CA C 47 65.947 65.987 -0.040 1
1 574 . 5 1 1 A 47 47 THR CB C 47 69.014 68.347 0.667 1
1 576 . 5 1 1 A 47 47 THR N N 47 111.770 117.131 -5.361 1
1 577 . 5 1 1 A 48 48 ALA H H 48 6.794 7.947 -1.153 1
1 578 . 5 1 1 A 48 48 ALA HA H 48 4.171 4.200 -0.029 1
1 582 . 5 1 1 A 48 48 ALA C C 48 178.639 180.313 -1.674 1
1 583 . 5 1 1 A 48 48 ALA CA C 48 54.072 55.140 -1.068 1
1 584 . 5 1 1 A 48 48 ALA CB C 48 19.752 18.726 1.026 1
1 585 . 5 1 1 A 48 48 ALA N N 48 122.697 123.376 -0.679 1
1 586 . 5 1 1 A 49 49 LEU H H 49 7.691 8.670 -0.979 1
1 587 . 5 1 1 A 49 49 LEU HA H 49 3.902 4.446 -0.544 1
1 597 . 5 1 1 A 49 49 LEU C C 49 176.823 177.697 -0.874 1
1 598 . 5 1 1 A 49 49 LEU CA C 49 57.190 58.041 -0.851 1
1 599 . 5 1 1 A 49 49 LEU CB C 49 43.628 41.548 2.080 1
1 603 . 5 1 1 A 49 49 LEU N N 49 117.159 117.930 -0.771 1
1 604 . 5 1 1 A 50 50 GLU H H 50 6.963 7.827 -0.864 1
1 605 . 5 1 1 A 50 50 GLU HA H 50 3.220 4.172 -0.952 1
1 610 . 5 1 1 A 50 50 GLU C C 50 176.691 177.424 -0.733 1
1 611 . 5 1 1 A 50 50 GLU CA C 50 58.769 58.606 0.163 1
1 612 . 5 1 1 A 50 50 GLU CB C 50 29.792 29.876 -0.084 1
1 614 . 5 1 1 A 50 50 GLU N N 50 118.761 119.591 -0.830 1
1 615 . 5 1 1 A 51 51 GLY H H 51 8.541 8.432 0.109 1
1 616 . 5 1 1 A 51 51 GLY HA2 H 51 4.140 3.923 0.217 1
1 617 . 5 1 1 A 51 51 GLY HA3 H 51 3.488 3.948 -0.460 1
1 618 . 5 1 1 A 51 51 GLY C C 51 173.801 173.620 0.181 1
1 619 . 5 1 1 A 51 51 GLY CA C 51 45.498 45.643 -0.145 1
1 620 . 5 1 1 A 51 51 GLY N N 51 113.511 111.894 1.617 1
1 621 . 5 1 1 A 52 52 HIS H H 52 7.656 7.078 0.578 1
1 622 . 5 1 1 A 52 52 HIS HA H 52 4.318 5.183 -0.865 1
1 627 . 5 1 1 A 52 52 HIS C C 52 172.815 173.569 -0.754 1
1 628 . 5 1 1 A 52 52 HIS CA C 52 57.562 53.535 4.027 1
1 629 . 5 1 1 A 52 52 HIS CB C 52 28.670 33.107 -4.437 1
1 632 . 5 1 1 A 52 52 HIS N N 52 116.844 115.811 1.033 1
1 633 . 5 1 1 A 53 53 GLU H H 53 8.331 9.295 -0.964 1
1 634 . 5 1 1 A 53 53 GLU HA H 53 4.636 4.807 -0.171 1
1 639 . 5 1 1 A 53 53 GLU C C 53 176.145 176.165 -0.020 1
1 640 . 5 1 1 A 53 53 GLU CA C 53 54.891 54.556 0.335 1
1 641 . 5 1 1 A 53 53 GLU CB C 53 33.837 33.646 0.191 1
1 643 . 5 1 1 A 53 53 GLU N N 53 118.873 118.425 0.448 1
1 644 . 5 1 1 A 54 54 VAL H H 54 8.585 8.378 0.207 1
1 645 . 5 1 1 A 54 54 VAL HA H 54 3.227 4.064 -0.837 1
1 653 . 5 1 1 A 54 54 VAL C C 54 177.218 176.518 0.700 1
1 654 . 5 1 1 A 54 54 VAL CA C 54 65.848 63.435 2.413 1
1 655 . 5 1 1 A 54 54 VAL CB C 54 31.189 31.526 -0.337 1
1 658 . 5 1 1 A 54 54 VAL N N 54 120.580 120.122 0.458 1
1 659 . 5 1 1 A 55 55 GLY H H 55 8.912 9.526 -0.614 1
1 660 . 5 1 1 A 55 55 GLY HA2 H 55 4.441 4.059 0.382 1
1 661 . 5 1 1 A 55 55 GLY HA3 H 55 3.865 4.063 -0.198 1
1 662 . 5 1 1 A 55 55 GLY C C 55 174.827 173.796 1.031 1
1 663 . 5 1 1 A 55 55 GLY CA C 55 44.370 44.677 -0.307 1
1 664 . 5 1 1 A 55 55 GLY N N 55 118.078 114.800 3.278 1
1 665 . 5 1 1 A 56 56 ASP H H 56 8.098 7.911 0.187 1
1 666 . 5 1 1 A 56 56 ASP HA H 56 4.547 4.744 -0.197 1
1 669 . 5 1 1 A 56 56 ASP C C 56 174.859 175.084 -0.225 1
1 670 . 5 1 1 A 56 56 ASP CA C 56 55.629 54.890 0.739 1
1 671 . 5 1 1 A 56 56 ASP CB C 56 40.906 41.586 -0.680 1
1 672 . 5 1 1 A 56 56 ASP N N 56 123.094 122.028 1.066 1
1 673 . 5 1 1 A 57 57 LYS H H 57 8.168 8.537 -0.369 1
1 674 . 5 1 1 A 57 57 LYS HA H 57 5.471 5.971 -0.500 1
1 683 . 5 1 1 A 57 57 LYS C C 57 175.732 174.864 0.868 1
1 684 . 5 1 1 A 57 57 LYS CA C 57 55.056 55.536 -0.480 1
1 685 . 5 1 1 A 57 57 LYS CB C 57 35.302 35.686 -0.384 1
1 689 . 5 1 1 A 57 57 LYS N N 57 122.301 122.222 0.079 1
1 690 . 5 1 1 A 58 58 PHE H H 58 8.355 8.442 -0.087 1
1 691 . 5 1 1 A 58 58 PHE HA H 58 4.858 4.986 -0.128 1
1 699 . 5 1 1 A 58 58 PHE C C 58 171.549 172.045 -0.496 1
1 700 . 5 1 1 A 58 58 PHE CA C 58 56.195 56.235 -0.040 1
1 701 . 5 1 1 A 58 58 PHE CB C 58 39.335 40.745 -1.410 1
1 705 . 5 1 1 A 58 58 PHE N N 58 121.026 120.828 0.198 1
1 706 . 5 1 1 A 59 59 ASP H H 59 8.407 8.667 -0.260 1
1 707 . 5 1 1 A 59 59 ASP HA H 59 5.743 5.201 0.542 1
1 710 . 5 1 1 A 59 59 ASP C C 59 176.302 175.986 0.316 1
1 711 . 5 1 1 A 59 59 ASP CA C 59 52.579 54.792 -2.213 1
1 712 . 5 1 1 A 59 59 ASP CB C 59 43.628 42.021 1.607 1
1 713 . 5 1 1 A 59 59 ASP N N 59 119.234 120.016 -0.782 1
1 714 . 5 1 1 A 60 60 VAL H H 60 8.915 9.011 -0.096 1
1 715 . 5 1 1 A 60 60 VAL HA H 60 4.374 5.016 -0.642 1
1 723 . 5 1 1 A 60 60 VAL C C 60 173.140 174.929 -1.789 1
1 724 . 5 1 1 A 60 60 VAL CA C 60 61.252 60.428 0.824 1
1 725 . 5 1 1 A 60 60 VAL CB C 60 35.620 35.335 0.285 1
1 728 . 5 1 1 A 60 60 VAL N N 60 119.758 123.389 -3.631 1
1 729 . 5 1 1 A 61 61 ALA H H 61 8.761 8.879 -0.118 1
1 730 . 5 1 1 A 61 61 ALA HA H 61 5.091 5.302 -0.211 1
1 734 . 5 1 1 A 61 61 ALA C C 61 176.460 175.672 0.788 1
1 735 . 5 1 1 A 61 61 ALA CA C 61 51.019 51.368 -0.349 1
1 736 . 5 1 1 A 61 61 ALA CB C 61 19.447 21.292 -1.845 1
1 737 . 5 1 1 A 61 61 ALA N N 61 133.341 127.836 5.505 1
1 738 . 5 1 1 A 62 62 VAL H H 62 8.929 8.748 0.181 1
1 739 . 5 1 1 A 62 62 VAL HA H 62 4.236 4.993 -0.757 1
1 747 . 5 1 1 A 62 62 VAL C C 62 174.733 175.292 -0.559 1
1 748 . 5 1 1 A 62 62 VAL CA C 62 61.007 59.853 1.154 1
1 749 . 5 1 1 A 62 62 VAL CB C 62 34.387 35.582 -1.195 1
1 752 . 5 1 1 A 62 62 VAL N N 62 124.165 117.605 6.560 1
1 753 . 5 1 1 A 63 63 GLY H H 63 8.995 8.712 0.283 1
1 754 . 5 1 1 A 63 63 GLY HA2 H 63 4.229 4.122 0.107 1
1 755 . 5 1 1 A 63 63 GLY HA3 H 63 3.637 4.144 -0.507 1
1 756 . 5 1 1 A 63 63 GLY C C 63 175.306 174.833 0.473 1
1 757 . 5 1 1 A 63 63 GLY CA C 63 44.620 44.630 -0.010 1
1 758 . 5 1 1 A 63 63 GLY N N 63 115.598 109.015 6.583 1
1 759 . 5 1 1 A 64 64 ALA H H 64 8.106 8.750 -0.644 1
1 760 . 5 1 1 A 64 64 ALA HA H 64 4.010 4.156 -0.146 1
1 764 . 5 1 1 A 64 64 ALA C C 64 180.218 179.397 0.821 1
1 765 . 5 1 1 A 64 64 ALA CA C 64 55.897 54.666 1.231 1
1 766 . 5 1 1 A 64 64 ALA CB C 64 18.347 18.433 -0.086 1
1 767 . 5 1 1 A 64 64 ALA N N 64 122.859 123.773 -0.914 1
1 768 . 5 1 1 A 65 65 ASN H H 65 8.748 8.374 0.374 1
1 769 . 5 1 1 A 65 65 ASN HA H 65 4.230 4.547 -0.317 1
1 774 . 5 1 1 A 65 65 ASN C C 65 176.085 176.076 0.009 1
1 775 . 5 1 1 A 65 65 ASN CA C 65 56.064 56.197 -0.133 1
1 776 . 5 1 1 A 65 65 ASN CB C 65 37.871 38.982 -1.111 1
1 777 . 5 1 1 A 65 65 ASN N N 65 114.590 117.530 -2.940 1
1 779 . 5 1 1 A 66 66 ASP H H 66 7.598 8.191 -0.593 1
1 780 . 5 1 1 A 66 66 ASP HA H 66 4.682 4.804 -0.122 1
1 783 . 5 1 1 A 66 66 ASP C C 66 173.061 175.886 -2.825 1
1 784 . 5 1 1 A 66 66 ASP CA C 66 53.549 54.325 -0.776 1
1 785 . 5 1 1 A 66 66 ASP CB C 66 42.204 42.438 -0.234 1
1 786 . 5 1 1 A 66 66 ASP N N 66 118.065 116.287 1.778 1
1 787 . 5 1 1 A 67 67 ALA H H 67 7.434 7.324 0.110 1
1 788 . 5 1 1 A 67 67 ALA HA H 67 4.316 4.500 -0.184 1
1 792 . 5 1 1 A 67 67 ALA C C 67 175.615 176.633 -1.018 1
1 793 . 5 1 1 A 67 67 ALA CA C 67 50.814 50.866 -0.052 1
1 794 . 5 1 1 A 67 67 ALA CB C 67 18.618 19.203 -0.585 1
1 795 . 5 1 1 A 67 67 ALA N N 67 124.890 122.853 2.037 1
1 796 . 5 1 1 A 68 68 TYR H H 68 8.390 8.498 -0.108 1
1 797 . 5 1 1 A 68 68 TYR HA H 68 4.195 4.441 -0.246 1
1 804 . 5 1 1 A 68 68 TYR C C 68 174.964 175.867 -0.903 1
1 805 . 5 1 1 A 68 68 TYR CA C 68 59.566 58.924 0.642 1
1 806 . 5 1 1 A 68 68 TYR CB C 68 36.992 38.681 -1.689 1
1 809 . 5 1 1 A 68 68 TYR N N 68 121.083 123.172 -2.089 1
1 810 . 5 1 1 A 69 69 GLY H H 69 8.149 9.058 -0.909 1
1 811 . 5 1 1 A 69 69 GLY HA2 H 69 4.254 3.983 0.271 1
1 812 . 5 1 1 A 69 69 GLY HA3 H 69 3.624 4.099 -0.475 1
1 813 . 5 1 1 A 69 69 GLY C C 69 173.161 174.907 -1.746 1
1 814 . 5 1 1 A 69 69 GLY CA C 69 44.465 45.736 -1.271 1
1 815 . 5 1 1 A 69 69 GLY N N 69 108.762 109.513 -0.751 1
1 816 . 5 1 1 A 70 70 GLN H H 70 8.450 7.834 0.616 1
1 817 . 5 1 1 A 70 70 GLN HA H 70 4.140 4.449 -0.309 1
1 824 . 5 1 1 A 70 70 GLN C C 70 176.138 175.457 0.681 1
1 825 . 5 1 1 A 70 70 GLN CA C 70 54.680 56.156 -1.476 1
1 826 . 5 1 1 A 70 70 GLN CB C 70 29.210 30.200 -0.990 1
1 828 . 5 1 1 A 70 70 GLN N N 70 117.002 120.010 -3.008 1
1 830 . 5 1 1 A 71 71 TYR H H 71 8.991 8.561 0.430 1
1 831 . 5 1 1 A 71 71 TYR HA H 71 3.752 4.492 -0.740 1
1 838 . 5 1 1 A 71 71 TYR C C 71 174.548 174.372 0.176 1
1 839 . 5 1 1 A 71 71 TYR CA C 71 59.868 59.789 0.079 1
1 840 . 5 1 1 A 71 71 TYR CB C 71 38.961 39.109 -0.148 1
1 843 . 5 1 1 A 71 71 TYR N N 71 125.112 122.579 2.533 1
1 844 . 5 1 1 A 72 72 ASP H H 72 8.819 8.389 0.430 1
1 845 . 5 1 1 A 72 72 ASP HA H 72 4.773 5.082 -0.309 1
1 848 . 5 1 1 A 72 72 ASP C C 72 177.709 175.906 1.803 1
1 849 . 5 1 1 A 72 72 ASP CA C 72 52.382 52.856 -0.474 1
1 850 . 5 1 1 A 72 72 ASP CB C 72 42.197 43.144 -0.947 1
1 851 . 5 1 1 A 72 72 ASP N N 72 129.918 128.045 1.873 1
1 852 . 5 1 1 A 73 73 GLU H H 73 9.409 9.135 0.274 1
1 853 . 5 1 1 A 73 73 GLU HA H 73 3.937 3.974 -0.037 1
1 858 . 5 1 1 A 73 73 GLU C C 73 177.581 177.303 0.278 1
1 859 . 5 1 1 A 73 73 GLU CA C 73 58.962 58.359 0.603 1
1 860 . 5 1 1 A 73 73 GLU CB C 73 29.155 28.956 0.199 1
1 862 . 5 1 1 A 73 73 GLU N N 73 129.624 125.705 3.919 1
1 863 . 5 1 1 A 74 74 ASN H H 74 8.700 8.258 0.442 1
1 864 . 5 1 1 A 74 74 ASN HA H 74 4.550 4.565 -0.015 1
1 869 . 5 1 1 A 74 74 ASN C C 74 176.190 176.891 -0.701 1
1 870 . 5 1 1 A 74 74 ASN CA C 74 54.932 55.131 -0.199 1
1 871 . 5 1 1 A 74 74 ASN CB C 74 38.113 38.587 -0.474 1
1 872 . 5 1 1 A 74 74 ASN N N 74 116.792 117.414 -0.622 1
1 874 . 5 1 1 A 75 75 LEU H H 75 7.303 7.506 -0.203 1
1 875 . 5 1 1 A 75 75 LEU HA H 75 4.289 4.194 0.095 1
1 885 . 5 1 1 A 75 75 LEU C C 75 175.821 176.308 -0.487 1
1 886 . 5 1 1 A 75 75 LEU CA C 75 54.106 56.423 -2.317 1
1 887 . 5 1 1 A 75 75 LEU CB C 75 41.239 42.363 -1.124 1
1 891 . 5 1 1 A 75 75 LEU N N 75 117.094 119.717 -2.623 1
1 892 . 5 1 1 A 76 76 VAL H H 76 7.181 7.509 -0.328 1
1 893 . 5 1 1 A 76 76 VAL HA H 76 4.970 4.799 0.171 1
1 901 . 5 1 1 A 76 76 VAL C C 76 175.702 174.554 1.148 1
1 902 . 5 1 1 A 76 76 VAL CA C 76 61.733 60.061 1.672 1
1 903 . 5 1 1 A 76 76 VAL CB C 76 31.822 34.249 -2.427 1
1 905 . 5 1 1 A 76 76 VAL N N 76 124.716 119.296 5.420 1
1 906 . 5 1 1 A 77 77 GLN H H 77 8.791 9.063 -0.272 1
1 907 . 5 1 1 A 77 77 GLN HA H 77 4.695 5.019 -0.324 1
1 914 . 5 1 1 A 77 77 GLN C C 77 173.553 173.682 -0.129 1
1 915 . 5 1 1 A 77 77 GLN CA C 77 54.038 54.457 -0.419 1
1 916 . 5 1 1 A 77 77 GLN CB C 77 33.018 31.597 1.421 1
1 918 . 5 1 1 A 77 77 GLN N N 77 124.898 125.208 -0.310 1
1 920 . 5 1 1 A 78 78 ARG H H 78 8.530 8.567 -0.037 1
1 921 . 5 1 1 A 78 78 ARG HA H 78 5.107 5.351 -0.244 1
1 928 . 5 1 1 A 78 78 ARG C C 78 176.182 175.732 0.450 1
1 929 . 5 1 1 A 78 78 ARG CA C 78 55.355 55.245 0.110 1
1 930 . 5 1 1 A 78 78 ARG CB C 78 31.150 32.639 -1.489 1
1 933 . 5 1 1 A 78 78 ARG N N 78 123.413 120.688 2.725 1
1 934 . 5 1 1 A 79 79 VAL H H 79 9.300 8.893 0.407 1
1 935 . 5 1 1 A 79 79 VAL HA H 79 4.824 4.613 0.211 1
1 943 . 5 1 1 A 79 79 VAL CA C 79 58.731 59.086 -0.355 1
1 944 . 5 1 1 A 79 79 VAL CB C 79 34.836 35.533 -0.697 1
1 947 . 5 1 1 A 79 79 VAL N N 79 125.252 121.773 3.479 1
1 948 . 5 1 1 A 80 80 PRO HA H 80 4.339 4.787 -0.448 1
1 955 . 5 1 1 A 80 80 PRO C C 80 176.902 178.061 -1.159 1
1 956 . 5 1 1 A 80 80 PRO CA C 80 62.969 63.005 -0.036 1
1 957 . 5 1 1 A 80 80 PRO CB C 80 32.431 32.300 0.131 1
1 960 . 5 1 1 A 81 81 LYS H H 81 7.816 9.358 -1.542 1
1 961 . 5 1 1 A 81 81 LYS HA H 81 3.790 4.002 -0.212 1
1 970 . 5 1 1 A 81 81 LYS C C 81 177.808 178.881 -1.073 1
1 971 . 5 1 1 A 81 81 LYS CA C 81 59.874 60.025 -0.151 1
1 972 . 5 1 1 A 81 81 LYS CB C 81 32.670 32.137 0.533 1
1 976 . 5 1 1 A 81 81 LYS N N 81 120.948 124.914 -3.966 1
1 977 . 5 1 1 A 82 82 ASP H H 82 8.069 8.127 -0.058 1
1 978 . 5 1 1 A 82 82 ASP HA H 82 4.243 4.370 -0.127 1
1 981 . 5 1 1 A 82 82 ASP C C 82 177.157 178.621 -1.464 1
1 982 . 5 1 1 A 82 82 ASP CA C 82 55.527 57.448 -1.921 1
1 983 . 5 1 1 A 82 82 ASP CB C 82 40.005 41.319 -1.314 1
1 984 . 5 1 1 A 82 82 ASP N N 82 116.004 119.817 -3.813 1
1 985 . 5 1 1 A 83 83 VAL H H 83 7.150 7.584 -0.434 1
1 986 . 5 1 1 A 83 83 VAL HA H 83 3.719 3.499 0.220 1
1 994 . 5 1 1 A 83 83 VAL C C 83 176.346 176.724 -0.378 1
1 995 . 5 1 1 A 83 83 VAL CA C 83 63.868 65.780 -1.912 1
1 996 . 5 1 1 A 83 83 VAL CB C 83 31.689 31.434 0.255 1
1 999 . 5 1 1 A 83 83 VAL N N 83 117.199 119.365 -2.166 1
1 1000 . 5 1 1 A 84 84 PHE H H 84 7.365 7.677 -0.312 1
1 1001 . 5 1 1 A 84 84 PHE HA H 84 4.389 4.649 -0.260 1
1 1009 . 5 1 1 A 84 84 PHE C C 84 175.265 176.235 -0.970 1
1 1010 . 5 1 1 A 84 84 PHE CA C 84 57.210 57.011 0.199 1
1 1011 . 5 1 1 A 84 84 PHE CB C 84 38.968 38.041 0.927 1
1 1015 . 5 1 1 A 84 84 PHE N N 84 119.897 116.881 3.016 1
1 1016 . 5 1 1 A 85 85 MET H H 85 7.765 7.947 -0.182 1
1 1017 . 5 1 1 A 85 85 MET HA H 85 4.277 4.319 -0.042 1
1 1025 . 5 1 1 A 85 85 MET C C 85 176.856 177.471 -0.615 1
1 1026 . 5 1 1 A 85 85 MET CA C 85 56.389 57.833 -1.444 1
1 1027 . 5 1 1 A 85 85 MET CB C 85 32.715 32.555 0.160 1
1 1030 . 5 1 1 A 85 85 MET N N 85 121.131 119.108 2.023 1
1 1031 . 5 1 1 A 86 86 GLY H H 86 8.499 8.204 0.295 1
1 1032 . 5 1 1 A 86 86 GLY HA2 H 86 3.928 3.936 -0.008 1
1 1033 . 5 1 1 A 86 86 GLY HA3 H 86 3.793 3.939 -0.146 1
1 1034 . 5 1 1 A 86 86 GLY C C 86 174.168 173.738 0.430 1
1 1035 . 5 1 1 A 86 86 GLY CA C 86 45.637 45.208 0.429 1
1 1036 . 5 1 1 A 86 86 GLY N N 86 111.268 108.031 3.237 1
1 1037 . 5 1 1 A 87 87 VAL H H 87 7.564 7.591 -0.027 1
1 1038 . 5 1 1 A 87 87 VAL HA H 87 4.083 4.176 -0.093 1
1 1046 . 5 1 1 A 87 87 VAL C C 87 175.649 176.075 -0.426 1
1 1047 . 5 1 1 A 87 87 VAL CA C 87 61.809 61.071 0.738 1
1 1048 . 5 1 1 A 87 87 VAL CB C 87 32.667 33.469 -0.802 1
1 1051 . 5 1 1 A 87 87 VAL N N 87 118.839 120.333 -1.494 1
1 1052 . 5 1 1 A 88 88 ASP H H 88 8.270 8.748 -0.478 1
1 1053 . 5 1 1 A 88 88 ASP HA H 88 4.421 4.332 0.089 1
1 1056 . 5 1 1 A 88 88 ASP C C 88 175.977 175.695 0.282 1
1 1057 . 5 1 1 A 88 88 ASP CA C 88 55.655 56.881 -1.226 1
1 1058 . 5 1 1 A 88 88 ASP CB C 88 41.364 41.187 0.177 1
1 1059 . 5 1 1 A 88 88 ASP N N 88 124.401 126.192 -1.791 1
1 1060 . 5 1 1 A 89 89 GLU H H 89 7.833 7.740 0.093 1
1 1061 . 5 1 1 A 89 89 GLU HA H 89 4.206 4.633 -0.427 1
1 1066 . 5 1 1 A 89 89 GLU C C 89 174.912 174.366 0.546 1
1 1067 . 5 1 1 A 89 89 GLU CA C 89 55.739 55.865 -0.126 1
1 1068 . 5 1 1 A 89 89 GLU CB C 89 30.603 32.943 -2.340 1
1 1070 . 5 1 1 A 89 89 GLU N N 89 119.378 117.952 1.426 1
1 1071 . 5 1 1 A 90 90 LEU H H 90 8.051 8.511 -0.460 1
1 1072 . 5 1 1 A 90 90 LEU HA H 90 4.127 4.317 -0.190 1
1 1082 . 5 1 1 A 90 90 LEU C C 90 175.753 176.507 -0.754 1
1 1083 . 5 1 1 A 90 90 LEU CA C 90 54.929 55.358 -0.429 1
1 1084 . 5 1 1 A 90 90 LEU CB C 90 42.710 41.391 1.319 1
1 1088 . 5 1 1 A 90 90 LEU N N 90 124.432 127.509 -3.077 1
1 1089 . 5 1 1 A 91 91 GLN H H 91 7.341 8.888 -1.547 1
1 1090 . 5 1 1 A 91 91 GLN HA H 91 4.546 4.852 -0.306 1
1 1097 . 5 1 1 A 91 91 GLN C C 91 174.655 174.768 -0.113 1
1 1098 . 5 1 1 A 91 91 GLN CA C 91 53.671 54.134 -0.463 1
1 1099 . 5 1 1 A 91 91 GLN CB C 91 32.850 32.079 0.771 1
1 1101 . 5 1 1 A 91 91 GLN N N 91 120.186 125.387 -5.201 1
1 1103 . 5 1 1 A 92 92 VAL H H 92 8.442 8.549 -0.107 1
1 1104 . 5 1 1 A 92 92 VAL HA H 92 3.278 3.885 -0.607 1
1 1112 . 5 1 1 A 92 92 VAL C C 92 177.098 177.238 -0.140 1
1 1113 . 5 1 1 A 92 92 VAL CA C 92 64.953 64.362 0.591 1
1 1114 . 5 1 1 A 92 92 VAL CB C 92 31.601 31.744 -0.143 1
1 1117 . 5 1 1 A 92 92 VAL N N 92 121.899 123.806 -1.907 1
1 1118 . 5 1 1 A 93 93 GLY H H 93 9.002 9.588 -0.586 1
1 1119 . 5 1 1 A 93 93 GLY HA2 H 93 4.327 3.981 0.346 1
1 1120 . 5 1 1 A 93 93 GLY HA3 H 93 3.770 3.981 -0.211 1
1 1121 . 5 1 1 A 93 93 GLY C C 93 174.547 174.284 0.263 1
1 1122 . 5 1 1 A 93 93 GLY CA C 93 44.446 45.169 -0.723 1
1 1123 . 5 1 1 A 93 93 GLY N N 93 116.485 115.248 1.237 1
1 1124 . 5 1 1 A 94 94 MET H H 94 7.445 7.874 -0.429 1
1 1125 . 5 1 1 A 94 94 MET HA H 94 4.182 4.535 -0.353 1
1 1133 . 5 1 1 A 94 94 MET C C 94 174.531 175.143 -0.612 1
1 1134 . 5 1 1 A 94 94 MET CA C 94 57.193 55.540 1.653 1
1 1135 . 5 1 1 A 94 94 MET CB C 94 34.474 33.404 1.070 1
1 1138 . 5 1 1 A 94 94 MET N N 94 120.304 120.289 0.015 1
1 1139 . 5 1 1 A 95 95 ARG H H 95 8.169 8.575 -0.406 1
1 1140 . 5 1 1 A 95 95 ARG HA H 95 5.343 4.854 0.489 1
1 1147 . 5 1 1 A 95 95 ARG C C 95 175.593 175.097 0.496 1
1 1148 . 5 1 1 A 95 95 ARG CA C 95 54.898 54.650 0.248 1
1 1149 . 5 1 1 A 95 95 ARG CB C 95 32.928 33.039 -0.111 1
1 1152 . 5 1 1 A 95 95 ARG N N 95 122.066 122.814 -0.748 1
1 1153 . 5 1 1 A 96 96 PHE H H 96 8.440 7.999 0.441 1
1 1154 . 5 1 1 A 96 96 PHE HA H 96 4.738 5.093 -0.355 1
1 1162 . 5 1 1 A 96 96 PHE C C 96 173.273 171.927 1.346 1
1 1163 . 5 1 1 A 96 96 PHE CA C 96 56.174 56.083 0.091 1
1 1164 . 5 1 1 A 96 96 PHE CB C 96 42.474 40.707 1.767 1
1 1168 . 5 1 1 A 96 96 PHE N N 96 119.938 118.802 1.136 1
1 1169 . 5 1 1 A 97 97 LEU H H 97 8.459 8.797 -0.338 1
1 1170 . 5 1 1 A 97 97 LEU HA H 97 4.625 4.916 -0.291 1
1 1180 . 5 1 1 A 97 97 LEU C C 97 175.664 176.439 -0.775 1
1 1181 . 5 1 1 A 97 97 LEU CA C 97 53.547 54.265 -0.718 1
1 1182 . 5 1 1 A 97 97 LEU CB C 97 42.379 43.898 -1.519 1
1 1186 . 5 1 1 A 97 97 LEU N N 97 122.014 121.825 0.189 1
1 1187 . 5 1 1 A 98 98 ALA H H 98 8.812 9.215 -0.403 1
1 1188 . 5 1 1 A 98 98 ALA HA H 98 4.520 5.013 -0.493 1
1 1192 . 5 1 1 A 98 98 ALA C C 98 176.373 176.750 -0.377 1
1 1193 . 5 1 1 A 98 98 ALA CA C 98 50.639 51.774 -1.135 1
1 1194 . 5 1 1 A 98 98 ALA CB C 98 20.939 21.044 -0.105 1
1 1195 . 5 1 1 A 98 98 ALA N N 98 129.296 130.369 -1.073 1
1 1196 . 5 1 1 A 99 99 GLU H H 99 8.504 8.678 -0.174 1
1 1197 . 5 1 1 A 99 99 GLU HA H 99 4.150 5.228 -1.078 1
1 1202 . 5 1 1 A 99 99 GLU C C 99 176.351 175.529 0.822 1
1 1203 . 5 1 1 A 99 99 GLU CA C 99 56.830 55.062 1.768 1
1 1204 . 5 1 1 A 99 99 GLU CB C 99 29.639 32.422 -2.783 1
1 1206 . 5 1 1 A 99 99 GLU N N 99 121.993 117.037 4.956 1
1 1207 . 5 1 1 A 100 100 THR H H 100 7.393 8.517 -1.124 1
1 1208 . 5 1 1 A 100 100 THR HA H 100 4.819 4.788 0.031 1
1 1213 . 5 1 1 A 100 100 THR C C 100 175.882 174.566 1.316 1
1 1214 . 5 1 1 A 100 100 THR CA C 100 60.329 59.980 0.349 1
1 1215 . 5 1 1 A 100 100 THR CB C 100 73.452 72.311 1.141 1
1 1217 . 5 1 1 A 100 100 THR N N 100 115.598 115.707 -0.109 1
1 1218 . 5 1 1 A 101 101 ASP H H 101 8.988 9.027 -0.039 1
1 1219 . 5 1 1 A 101 101 ASP HA H 101 4.357 4.290 0.067 1
1 1222 . 5 1 1 A 101 101 ASP C C 101 176.848 176.767 0.081 1
1 1223 . 5 1 1 A 101 101 ASP CA C 101 56.493 57.541 -1.048 1
1 1224 . 5 1 1 A 101 101 ASP CB C 101 39.973 40.574 -0.601 1
1 1225 . 5 1 1 A 101 101 ASP N N 101 121.468 121.857 -0.389 1
1 1226 . 5 1 1 A 102 102 GLN H H 102 7.937 7.945 -0.008 1
1 1227 . 5 1 1 A 102 102 GLN HA H 102 4.415 4.306 0.109 1
1 1234 . 5 1 1 A 102 102 GLN C C 102 175.252 176.052 -0.800 1
1 1235 . 5 1 1 A 102 102 GLN CA C 102 55.097 54.949 0.148 1
1 1236 . 5 1 1 A 102 102 GLN CB C 102 29.121 27.435 1.686 1
1 1238 . 5 1 1 A 102 102 GLN N N 102 117.199 114.023 3.176 1
1 1240 . 5 1 1 A 103 103 GLY H H 103 7.431 7.890 -0.459 1
1 1241 . 5 1 1 A 103 103 GLY HA2 H 103 4.504 4.243 0.261 1
1 1242 . 5 1 1 A 103 103 GLY HA3 H 103 3.868 4.243 -0.375 1
1 1243 . 5 1 1 A 103 103 GLY CA C 103 44.051 44.393 -0.342 1
1 1244 . 5 1 1 A 103 103 GLY N N 103 110.056 110.585 -0.529 1
1 1245 . 5 1 1 A 104 104 PRO HA H 104 5.057 5.340 -0.283 1
1 1252 . 5 1 1 A 104 104 PRO C C 104 177.873 175.478 2.395 1
1 1253 . 5 1 1 A 104 104 PRO CA C 104 62.464 62.990 -0.526 1
1 1254 . 5 1 1 A 104 104 PRO CB C 104 31.939 32.390 -0.451 1
1 1257 . 5 1 1 A 105 105 VAL H H 105 8.960 8.351 0.609 1
1 1258 . 5 1 1 A 105 105 VAL HA H 105 4.678 4.582 0.096 1
1 1266 . 5 1 1 A 105 105 VAL CA C 105 58.474 59.210 -0.736 1
1 1267 . 5 1 1 A 105 105 VAL CB C 105 35.512 35.223 0.289 1
1 1270 . 5 1 1 A 105 105 VAL N N 105 123.240 122.872 0.368 1
1 1271 . 5 1 1 A 106 106 PRO HA H 106 4.777 4.742 0.035 1
1 1278 . 5 1 1 A 106 106 PRO C C 106 176.823 176.313 0.510 1
1 1279 . 5 1 1 A 106 106 PRO CA C 106 62.508 62.448 0.060 1
1 1280 . 5 1 1 A 106 106 PRO CB C 106 31.650 31.546 0.104 1
1 1283 . 5 1 1 A 107 107 VAL H H 107 8.835 7.758 1.077 1
1 1284 . 5 1 1 A 107 107 VAL HA H 107 4.719 5.023 -0.304 1
1 1292 . 5 1 1 A 107 107 VAL C C 107 173.661 173.415 0.246 1
1 1293 . 5 1 1 A 107 107 VAL CA C 107 59.026 59.173 -0.147 1
1 1294 . 5 1 1 A 107 107 VAL CB C 107 36.406 35.297 1.109 1
1 1297 . 5 1 1 A 107 107 VAL N N 107 117.474 117.129 0.345 1
1 1298 . 5 1 1 A 108 108 GLU H H 108 7.698 8.364 -0.666 1
1 1299 . 5 1 1 A 108 108 GLU HA H 108 5.133 4.850 0.283 1
1 1304 . 5 1 1 A 108 108 GLU C C 108 176.394 174.787 1.607 1
1 1305 . 5 1 1 A 108 108 GLU CA C 108 53.808 54.556 -0.748 1
1 1306 . 5 1 1 A 108 108 GLU CB C 108 33.984 33.435 0.549 1
1 1308 . 5 1 1 A 108 108 GLU N N 108 120.646 120.312 0.334 1
1 1309 . 5 1 1 A 109 109 ILE H H 109 8.690 8.843 -0.153 1
1 1310 . 5 1 1 A 109 109 ILE HA H 109 4.484 4.259 0.225 1
1 1320 . 5 1 1 A 109 109 ILE C C 109 177.313 176.978 0.335 1
1 1321 . 5 1 1 A 109 109 ILE CA C 109 61.789 61.424 0.365 1
1 1322 . 5 1 1 A 109 109 ILE CB C 109 36.628 37.389 -0.761 1
1 1326 . 5 1 1 A 109 109 ILE N N 109 124.739 127.305 -2.566 1
1 1327 . 5 1 1 A 110 110 THR H H 110 9.300 9.652 -0.352 1
1 1328 . 5 1 1 A 110 110 THR HA H 110 4.547 4.598 -0.051 1
1 1333 . 5 1 1 A 110 110 THR C C 110 174.904 174.519 0.385 1
1 1334 . 5 1 1 A 110 110 THR CA C 110 62.260 61.358 0.902 1
1 1335 . 5 1 1 A 110 110 THR CB C 110 69.100 69.593 -0.493 1
1 1337 . 5 1 1 A 110 110 THR N N 110 122.544 119.097 3.447 1
1 1338 . 5 1 1 A 111 111 ALA H H 111 7.673 7.531 0.142 1
1 1339 . 5 1 1 A 111 111 ALA HA H 111 4.367 4.579 -0.212 1
1 1343 . 5 1 1 A 111 111 ALA C C 111 175.019 175.080 -0.061 1
1 1344 . 5 1 1 A 111 111 ALA CA C 111 53.125 51.860 1.265 1
1 1345 . 5 1 1 A 111 111 ALA CB C 111 21.539 22.306 -0.767 1
1 1346 . 5 1 1 A 111 111 ALA N N 111 123.153 120.983 2.170 1
1 1347 . 5 1 1 A 112 112 VAL H H 112 8.707 8.435 0.272 1
1 1348 . 5 1 1 A 112 112 VAL HA H 112 4.129 4.601 -0.472 1
1 1356 . 5 1 1 A 112 112 VAL C C 112 174.755 175.025 -0.270 1
1 1357 . 5 1 1 A 112 112 VAL CA C 112 62.898 61.583 1.315 1
1 1358 . 5 1 1 A 112 112 VAL CB C 112 33.379 34.565 -1.186 1
1 1361 . 5 1 1 A 112 112 VAL N N 112 122.369 120.114 2.255 1
1 1362 . 5 1 1 A 113 113 GLU H H 113 8.144 8.990 -0.846 1
1 1363 . 5 1 1 A 113 113 GLU HA H 113 4.645 4.577 0.068 1
1 1368 . 5 1 1 A 113 113 GLU C C 113 175.102 177.730 -2.628 1
1 1369 . 5 1 1 A 113 113 GLU CA C 113 54.080 54.972 -0.892 1
1 1370 . 5 1 1 A 113 113 GLU CB C 113 31.234 31.053 0.181 1
1 1372 . 5 1 1 A 113 113 GLU N N 113 127.435 127.123 0.312 1
1 1373 . 5 1 1 A 114 114 ASP H H 114 8.472 8.750 -0.278 1
1 1374 . 5 1 1 A 114 114 ASP HA H 114 4.209 4.215 -0.006 1
1 1377 . 5 1 1 A 114 114 ASP C C 114 177.679 177.021 0.658 1
1 1378 . 5 1 1 A 114 114 ASP CA C 114 58.334 57.447 0.887 1
1 1379 . 5 1 1 A 114 114 ASP CB C 114 40.347 41.248 -0.901 1
1 1380 . 5 1 1 A 114 114 ASP N N 114 119.844 122.574 -2.730 1
1 1381 . 5 1 1 A 115 115 ASP H H 115 8.475 8.074 0.401 1
1 1382 . 5 1 1 A 115 115 ASP HA H 115 4.848 4.751 0.097 1
1 1385 . 5 1 1 A 115 115 ASP C C 115 175.968 175.244 0.724 1
1 1386 . 5 1 1 A 115 115 ASP CA C 115 53.290 53.511 -0.221 1
1 1387 . 5 1 1 A 115 115 ASP CB C 115 42.080 40.991 1.089 1
1 1388 . 5 1 1 A 115 115 ASP N N 115 114.364 114.767 -0.403 1
1 1389 . 5 1 1 A 116 116 HIS H H 116 7.185 7.421 -0.236 1
1 1390 . 5 1 1 A 116 116 HIS HA H 116 5.106 5.486 -0.380 1
1 1395 . 5 1 1 A 116 116 HIS C C 116 172.393 172.851 -0.458 1
1 1396 . 5 1 1 A 116 116 HIS CA C 116 56.099 54.326 1.773 1
1 1397 . 5 1 1 A 116 116 HIS CB C 116 33.289 33.299 -0.010 1
1 1400 . 5 1 1 A 116 116 HIS N N 116 117.212 114.710 2.502 1
1 1401 . 5 1 1 A 117 117 VAL H H 117 9.130 9.560 -0.430 1
1 1402 . 5 1 1 A 117 117 VAL HA H 117 4.649 5.002 -0.353 1
1 1410 . 5 1 1 A 117 117 VAL C C 117 173.832 174.717 -0.885 1
1 1411 . 5 1 1 A 117 117 VAL CA C 117 59.555 59.845 -0.290 1
1 1412 . 5 1 1 A 117 117 VAL CB C 117 34.676 34.908 -0.232 1
1 1415 . 5 1 1 A 117 117 VAL N N 117 114.046 117.417 -3.371 1
1 1416 . 5 1 1 A 118 118 VAL H H 118 8.680 9.069 -0.389 1
1 1417 . 5 1 1 A 118 118 VAL HA H 118 4.747 4.917 -0.170 1
1 1425 . 5 1 1 A 118 118 VAL C C 118 175.836 175.385 0.451 1
1 1426 . 5 1 1 A 118 118 VAL CA C 118 62.159 60.988 1.171 1
1 1427 . 5 1 1 A 118 118 VAL CB C 118 31.887 33.811 -1.924 1
1 1430 . 5 1 1 A 118 118 VAL N N 118 125.095 121.570 3.525 1
1 1431 . 5 1 1 A 119 119 VAL H H 119 9.057 9.144 -0.087 1
1 1432 . 5 1 1 A 119 119 VAL HA H 119 5.231 5.293 -0.062 1
1 1440 . 5 1 1 A 119 119 VAL C C 119 173.747 173.751 -0.004 1
1 1441 . 5 1 1 A 119 119 VAL CA C 119 58.326 59.477 -1.151 1
1 1442 . 5 1 1 A 119 119 VAL CB C 119 34.387 34.363 0.024 1
1 1445 . 5 1 1 A 119 119 VAL N N 119 121.494 122.350 -0.856 1
1 1446 . 5 1 1 A 120 120 ASP H H 120 8.926 8.860 0.066 1
1 1447 . 5 1 1 A 120 120 ASP HA H 120 5.174 5.287 -0.113 1
1 1450 . 5 1 1 A 120 120 ASP C C 120 177.982 176.247 1.735 1
1 1451 . 5 1 1 A 120 120 ASP CA C 120 52.749 52.366 0.383 1
1 1452 . 5 1 1 A 120 120 ASP CB C 120 44.542 44.062 0.480 1
1 1453 . 5 1 1 A 120 120 ASP N N 120 121.454 125.158 -3.704 1
1 1454 . 5 1 1 A 121 121 GLY H H 121 8.674 8.316 0.358 1
1 1455 . 5 1 1 A 121 121 GLY HA2 H 121 4.702 3.849 0.853 1
1 1456 . 5 1 1 A 121 121 GLY HA3 H 121 3.573 3.851 -0.278 1
1 1457 . 5 1 1 A 121 121 GLY C C 121 175.041 174.227 0.814 1
1 1458 . 5 1 1 A 121 121 GLY CA C 121 45.319 45.821 -0.502 1
1 1459 . 5 1 1 A 121 121 GLY N N 121 114.850 112.392 2.458 1
1 1460 . 5 1 1 A 122 122 ASN H H 122 8.762 7.774 0.988 1
1 1461 . 5 1 1 A 122 122 ASN HA H 122 4.183 5.345 -1.162 1
1 1466 . 5 1 1 A 122 122 ASN C C 122 175.406 174.799 0.607 1
1 1467 . 5 1 1 A 122 122 ASN CA C 122 54.686 52.002 2.684 1
1 1468 . 5 1 1 A 122 122 ASN CB C 122 40.139 39.891 0.248 1
1 1469 . 5 1 1 A 122 122 ASN N N 122 121.618 117.291 4.327 1
1 1471 . 5 1 1 A 123 123 HIS H H 123 8.929 9.336 -0.407 1
1 1472 . 5 1 1 A 123 123 HIS HA H 123 4.005 4.337 -0.332 1
1 1477 . 5 1 1 A 123 123 HIS C C 123 177.325 176.920 0.405 1
1 1478 . 5 1 1 A 123 123 HIS CA C 123 58.768 59.319 -0.551 1
1 1479 . 5 1 1 A 123 123 HIS CB C 123 31.172 30.421 0.751 1
1 1482 . 5 1 1 A 123 123 HIS N N 123 124.165 122.156 2.009 1
1 1483 . 5 1 1 A 124 124 MET H H 124 8.266 8.312 -0.046 1
1 1484 . 5 1 1 A 124 124 MET HA H 124 4.048 4.123 -0.075 1
1 1492 . 5 1 1 A 124 124 MET CA C 124 58.994 58.383 0.611 1
1 1493 . 5 1 1 A 124 124 MET CB C 124 32.777 32.816 -0.039 1
1 1496 . 5 1 1 A 124 124 MET N N 124 129.443 117.740 11.703 1
1 1497 . 5 1 1 A 125 125 LEU H H 125 8.094 8.017 0.077 1
1 1498 . 5 1 1 A 125 125 LEU HA H 125 4.455 4.558 -0.103 1
1 1504 . 5 1 1 A 125 125 LEU C C 125 177.860 176.930 0.930 1
1 1505 . 5 1 1 A 125 125 LEU CA C 125 53.517 55.449 -1.932 1
1 1506 . 5 1 1 A 125 125 LEU CB C 125 42.462 43.708 -1.246 1
1 1509 . 5 1 1 A 126 126 ALA H H 126 8.089 7.830 0.259 1
1 1510 . 5 1 1 A 126 126 ALA HA H 126 3.966 4.415 -0.449 1
1 1514 . 5 1 1 A 126 126 ALA C C 126 179.135 178.791 0.344 1
1 1515 . 5 1 1 A 126 126 ALA CA C 126 54.170 53.212 0.958 1
1 1516 . 5 1 1 A 126 126 ALA CB C 126 18.687 19.926 -1.239 1
1 1517 . 5 1 1 A 126 126 ALA N N 126 126.095 119.053 7.042 1
1 1518 . 5 1 1 A 127 127 GLY H H 127 9.499 8.313 1.186 1
1 1519 . 5 1 1 A 127 127 GLY HA2 H 127 4.207 3.993 0.214 1
1 1520 . 5 1 1 A 127 127 GLY HA3 H 127 3.598 4.020 -0.422 1
1 1521 . 5 1 1 A 127 127 GLY C C 127 173.568 174.496 -0.928 1
1 1522 . 5 1 1 A 127 127 GLY CA C 127 45.846 45.429 0.417 1
1 1523 . 5 1 1 A 127 127 GLY N N 127 110.073 108.151 1.922 1
1 1524 . 5 1 1 A 128 128 GLN H H 128 7.514 7.982 -0.468 1
1 1525 . 5 1 1 A 128 128 GLN HA H 128 4.496 4.295 0.201 1
1 1532 . 5 1 1 A 128 128 GLN C C 128 174.790 175.293 -0.503 1
1 1533 . 5 1 1 A 128 128 GLN CA C 128 54.948 56.143 -1.195 1
1 1534 . 5 1 1 A 128 128 GLN CB C 128 29.181 29.012 0.169 1
1 1536 . 5 1 1 A 128 128 GLN N N 128 117.842 120.357 -2.515 1
1 1538 . 5 1 1 A 129 129 ASN H H 129 8.689 8.177 0.512 1
1 1539 . 5 1 1 A 129 129 ASN HA H 129 4.857 5.271 -0.414 1
1 1544 . 5 1 1 A 129 129 ASN C C 129 174.325 174.514 -0.189 1
1 1545 . 5 1 1 A 129 129 ASN CA C 129 52.568 53.067 -0.499 1
1 1546 . 5 1 1 A 129 129 ASN CB C 129 38.035 40.191 -2.156 1
1 1547 . 5 1 1 A 129 129 ASN N N 129 122.739 122.813 -0.074 1
1 1549 . 5 1 1 A 130 130 LEU H H 130 8.742 9.145 -0.403 1
1 1550 . 5 1 1 A 130 130 LEU HA H 130 4.918 4.909 0.009 1
1 1560 . 5 1 1 A 130 130 LEU C C 130 176.095 175.415 0.680 1
1 1561 . 5 1 1 A 130 130 LEU CA C 130 53.691 52.883 0.808 1
1 1562 . 5 1 1 A 130 130 LEU CB C 130 46.814 45.097 1.717 1
1 1566 . 5 1 1 A 130 130 LEU N N 130 121.242 121.075 0.167 1
1 1567 . 5 1 1 A 131 131 LYS H H 131 8.809 9.352 -0.543 1
1 1568 . 5 1 1 A 131 131 LYS HA H 131 4.918 4.943 -0.025 1
1 1577 . 5 1 1 A 131 131 LYS C C 131 175.508 175.152 0.356 1
1 1578 . 5 1 1 A 131 131 LYS CA C 131 55.333 54.481 0.852 1
1 1579 . 5 1 1 A 131 131 LYS CB C 131 33.962 34.820 -0.858 1
1 1583 . 5 1 1 A 131 131 LYS N N 131 122.071 121.799 0.272 1
1 1584 . 5 1 1 A 132 132 PHE H H 132 9.436 9.311 0.125 1
1 1585 . 5 1 1 A 132 132 PHE HA H 132 5.427 5.767 -0.340 1
1 1593 . 5 1 1 A 132 132 PHE C C 132 175.715 174.514 1.201 1
1 1594 . 5 1 1 A 132 132 PHE CA C 132 56.665 56.528 0.137 1
1 1595 . 5 1 1 A 132 132 PHE CB C 132 42.263 42.399 -0.136 1
1 1599 . 5 1 1 A 132 132 PHE N N 132 125.247 123.076 2.171 1
1 1600 . 5 1 1 A 133 133 ASN H H 133 8.680 8.821 -0.141 1
1 1601 . 5 1 1 A 133 133 ASN HA H 133 5.249 5.222 0.027 1
1 1606 . 5 1 1 A 133 133 ASN C C 133 174.433 174.034 0.399 1
1 1607 . 5 1 1 A 133 133 ASN CA C 133 53.952 52.763 1.189 1
1 1608 . 5 1 1 A 133 133 ASN CB C 133 41.492 39.559 1.933 1
1 1609 . 5 1 1 A 133 133 ASN N N 133 122.056 121.454 0.602 1
1 1611 . 5 1 1 A 134 134 VAL H H 134 8.762 8.653 0.109 1
1 1612 . 5 1 1 A 134 134 VAL HA H 134 4.805 4.677 0.128 1
1 1620 . 5 1 1 A 134 134 VAL C C 134 173.555 175.158 -1.603 1
1 1621 . 5 1 1 A 134 134 VAL CA C 134 60.374 61.427 -1.053 1
1 1622 . 5 1 1 A 134 134 VAL CB C 134 34.848 33.039 1.809 1
1 1625 . 5 1 1 A 134 134 VAL N N 134 122.014 126.081 -4.067 1
1 1626 . 5 1 1 A 135 135 GLU H H 135 8.869 9.489 -0.620 1
1 1627 . 5 1 1 A 135 135 GLU HA H 135 5.240 5.046 0.194 1
1 1632 . 5 1 1 A 135 135 GLU C C 135 175.578 175.480 0.098 1
1 1633 . 5 1 1 A 135 135 GLU CA C 135 54.376 55.283 -0.907 1
1 1634 . 5 1 1 A 135 135 GLU CB C 135 33.264 31.233 2.031 1
1 1636 . 5 1 1 A 135 135 GLU N N 135 125.197 127.174 -1.977 1
1 1637 . 5 1 1 A 136 136 VAL H H 136 8.270 8.871 -0.601 1
1 1638 . 5 1 1 A 136 136 VAL HA H 136 4.066 4.107 -0.041 1
1 1646 . 5 1 1 A 136 136 VAL C C 136 176.119 174.639 1.480 1
1 1647 . 5 1 1 A 136 136 VAL CA C 136 62.910 63.775 -0.865 1
1 1648 . 5 1 1 A 136 136 VAL CB C 136 30.573 30.973 -0.400 1
1 1651 . 5 1 1 A 136 136 VAL N N 136 126.347 125.882 0.465 1
1 1652 . 5 1 1 A 137 137 VAL H H 137 8.865 8.526 0.339 1
1 1653 . 5 1 1 A 137 137 VAL HA H 137 4.022 3.997 0.025 1
1 1661 . 5 1 1 A 137 137 VAL C C 137 175.208 176.193 -0.985 1
1 1662 . 5 1 1 A 137 137 VAL CA C 137 64.424 64.519 -0.095 1
1 1663 . 5 1 1 A 137 137 VAL CB C 137 32.943 32.373 0.570 1
1 1666 . 5 1 1 A 137 137 VAL N N 137 130.810 129.904 0.906 1
1 1667 . 5 1 1 A 138 138 ALA H H 138 7.677 7.462 0.215 1
1 1668 . 5 1 1 A 138 138 ALA HA H 138 4.496 4.712 -0.216 1
1 1672 . 5 1 1 A 138 138 ALA C C 138 174.405 175.209 -0.804 1
1 1673 . 5 1 1 A 138 138 ALA CA C 138 52.556 51.673 0.883 1
1 1674 . 5 1 1 A 138 138 ALA CB C 138 21.874 22.599 -0.725 1
1 1675 . 5 1 1 A 138 138 ALA N N 138 119.194 117.878 1.316 1
1 1676 . 5 1 1 A 139 139 ILE H H 139 8.052 8.477 -0.425 1
1 1677 . 5 1 1 A 139 139 ILE HA H 139 4.640 4.833 -0.193 1
1 1687 . 5 1 1 A 139 139 ILE C C 139 173.734 174.400 -0.666 1
1 1688 . 5 1 1 A 139 139 ILE CA C 139 61.623 59.831 1.792 1
1 1689 . 5 1 1 A 139 139 ILE CB C 139 43.363 41.922 1.441 1
1 1693 . 5 1 1 A 139 139 ILE N N 139 119.307 120.244 -0.937 1
1 1694 . 5 1 1 A 140 140 ARG H H 140 8.912 9.061 -0.149 1
1 1695 . 5 1 1 A 140 140 ARG HA H 140 4.760 4.774 -0.014 1
1 1702 . 5 1 1 A 140 140 ARG C C 140 174.181 174.726 -0.545 1
1 1703 . 5 1 1 A 140 140 ARG CA C 140 54.243 54.463 -0.220 1
1 1704 . 5 1 1 A 140 140 ARG CB C 140 33.438 34.254 -0.816 1
1 1707 . 5 1 1 A 140 140 ARG N N 140 122.820 125.965 -3.145 1
1 1708 . 5 1 1 A 141 141 GLU H H 141 8.545 8.411 0.134 1
1 1709 . 5 1 1 A 141 141 GLU HA H 141 4.254 4.326 -0.072 1
1 1714 . 5 1 1 A 141 141 GLU C C 141 177.299 176.037 1.262 1
1 1715 . 5 1 1 A 141 141 GLU CA C 141 57.165 56.575 0.590 1
1 1716 . 5 1 1 A 141 141 GLU CB C 141 30.048 29.747 0.301 1
1 1718 . 5 1 1 A 141 141 GLU N N 141 119.458 123.499 -4.041 1
1 1719 . 5 1 1 A 142 142 ALA H H 142 8.380 8.169 0.211 1
1 1720 . 5 1 1 A 142 142 ALA HA H 142 4.388 4.521 -0.133 1
1 1724 . 5 1 1 A 142 142 ALA C C 142 178.495 179.208 -0.713 1
1 1725 . 5 1 1 A 142 142 ALA CA C 142 51.113 52.303 -1.190 1
1 1726 . 5 1 1 A 142 142 ALA CB C 142 21.044 18.962 2.082 1
1 1727 . 5 1 1 A 142 142 ALA N N 142 127.330 127.698 -0.368 1
1 1728 . 5 1 1 A 143 143 THR H H 143 9.502 9.092 0.410 1
1 1729 . 5 1 1 A 143 143 THR HA H 143 4.362 4.635 -0.273 1
1 1734 . 5 1 1 A 143 143 THR C C 143 175.241 175.288 -0.047 1
1 1735 . 5 1 1 A 143 143 THR CA C 143 60.541 61.426 -0.885 1
1 1736 . 5 1 1 A 143 143 THR CB C 143 70.879 68.577 2.302 1
1 1738 . 5 1 1 A 143 143 THR N N 143 114.561 114.302 0.259 1
1 1739 . 5 1 1 A 144 144 GLU H H 144 8.787 7.966 0.821 1
1 1740 . 5 1 1 A 144 144 GLU HA H 144 3.817 3.815 0.002 1
1 1745 . 5 1 1 A 144 144 GLU C C 144 179.490 176.789 2.701 1
1 1746 . 5 1 1 A 144 144 GLU CA C 144 60.102 58.684 1.418 1
1 1747 . 5 1 1 A 144 144 GLU CB C 144 29.338 27.358 1.980 1
1 1749 . 5 1 1 A 144 144 GLU N N 144 120.475 115.246 5.229 1
1 1750 . 5 1 1 A 145 145 GLU H H 145 8.321 8.647 -0.326 1
1 1751 . 5 1 1 A 145 145 GLU HA H 145 3.899 3.715 0.184 1
1 1756 . 5 1 1 A 145 145 GLU C C 145 178.521 178.511 0.010 1
1 1757 . 5 1 1 A 145 145 GLU CA C 145 59.588 59.358 0.230 1
1 1758 . 5 1 1 A 145 145 GLU CB C 145 29.658 29.274 0.384 1
1 1760 . 5 1 1 A 145 145 GLU N N 145 119.761 118.924 0.837 1
1 1761 . 5 1 1 A 146 146 GLU H H 146 7.514 8.041 -0.527 1
1 1762 . 5 1 1 A 146 146 GLU HA H 146 3.856 4.278 -0.422 1
1 1767 . 5 1 1 A 146 146 GLU C C 146 179.189 179.306 -0.117 1
1 1768 . 5 1 1 A 146 146 GLU CA C 146 59.148 58.992 0.156 1
1 1769 . 5 1 1 A 146 146 GLU CB C 146 29.834 29.187 0.647 1
1 1771 . 5 1 1 A 146 146 GLU N N 146 121.118 118.780 2.338 1
1 1772 . 5 1 1 A 147 147 LEU H H 147 7.823 8.174 -0.351 1
1 1773 . 5 1 1 A 147 147 LEU HA H 147 3.662 3.726 -0.064 1
1 1783 . 5 1 1 A 147 147 LEU C C 147 179.341 178.606 0.735 1
1 1784 . 5 1 1 A 147 147 LEU CA C 147 57.277 57.562 -0.285 1
1 1785 . 5 1 1 A 147 147 LEU CB C 147 41.239 41.533 -0.294 1
1 1789 . 5 1 1 A 147 147 LEU N N 147 117.199 120.470 -3.271 1
1 1790 . 5 1 1 A 148 148 ALA H H 148 7.788 8.625 -0.837 1
1 1791 . 5 1 1 A 148 148 ALA HA H 148 3.958 4.030 -0.072 1
1 1795 . 5 1 1 A 148 148 ALA C C 148 179.777 178.937 0.840 1
1 1796 . 5 1 1 A 148 148 ALA CA C 148 54.509 54.661 -0.152 1
1 1797 . 5 1 1 A 148 148 ALA CB C 148 18.064 18.391 -0.327 1
1 1798 . 5 1 1 A 148 148 ALA N N 148 121.696 120.238 1.458 1
1 1799 . 5 1 1 A 149 149 HIS H H 149 7.726 7.430 0.296 1
1 1800 . 5 1 1 A 149 149 HIS HA H 149 4.477 4.613 -0.136 1
1 1805 . 5 1 1 A 149 149 HIS C C 149 176.099 175.224 0.875 1
1 1806 . 5 1 1 A 149 149 HIS CA C 149 55.802 55.908 -0.106 1
1 1807 . 5 1 1 A 149 149 HIS CB C 149 30.406 29.971 0.435 1
1 1810 . 5 1 1 A 149 149 HIS N N 149 114.463 112.777 1.686 1
1 1811 . 5 1 1 A 150 150 GLY H H 150 8.076 9.228 -1.152 1
1 1812 . 5 1 1 A 150 150 GLY HA2 H 150 3.927 3.653 0.274 1
1 1813 . 5 1 1 A 150 150 GLY HA3 H 150 3.237 3.762 -0.525 1
1 1814 . 5 1 1 A 150 150 GLY C C 150 173.382 173.453 -0.071 1
1 1815 . 5 1 1 A 150 150 GLY CA C 150 46.117 45.663 0.454 1
1 1816 . 5 1 1 A 150 150 GLY N N 150 109.417 108.988 0.429 1
1 1817 . 5 1 1 A 151 151 HIS H H 151 7.518 7.465 0.053 1
1 1818 . 5 1 1 A 151 151 HIS HA H 151 4.563 4.813 -0.250 1
1 1823 . 5 1 1 A 151 151 HIS C C 151 173.157 174.627 -1.470 1
1 1824 . 5 1 1 A 151 151 HIS CA C 151 54.731 54.771 -0.040 1
1 1825 . 5 1 1 A 151 151 HIS CB C 151 31.611 31.545 0.066 1
1 1828 . 5 1 1 A 151 151 HIS N N 151 114.828 114.141 0.687 1
1 1829 . 5 1 1 A 152 152 VAL H H 152 7.931 9.029 -1.098 1
1 1830 . 5 1 1 A 152 152 VAL HA H 152 3.951 3.560 0.391 1
1 1838 . 5 1 1 A 152 152 VAL C C 152 175.848 176.355 -0.507 1
1 1839 . 5 1 1 A 152 152 VAL CA C 152 62.190 66.531 -4.341 1
1 1840 . 5 1 1 A 152 152 VAL CB C 152 32.703 31.604 1.099 1
1 1843 . 5 1 1 A 152 152 VAL N N 152 118.551 120.330 -1.779 1
1 1844 . 5 1 1 A 153 153 HIS H H 153 9.784 7.764 2.020 1
1 1845 . 5 1 1 A 153 153 HIS HA H 153 4.604 3.935 0.669 1
1 1850 . 5 1 1 A 153 153 HIS C C 153 175.795 174.400 1.395 1
1 1851 . 5 1 1 A 153 153 HIS CA C 153 56.753 56.660 0.093 1
1 1852 . 5 1 1 A 153 153 HIS CB C 153 30.325 28.622 1.703 1
1 1855 . 5 1 1 A 153 153 HIS N N 153 127.403 118.902 8.501 1
1 1856 . 5 1 1 A 154 154 GLY H H 154 8.447 8.071 0.376 1
1 1857 . 5 1 1 A 154 154 GLY HA2 H 154 3.797 3.288 0.509 1
1 1858 . 5 1 1 A 154 154 GLY HA3 H 154 3.797 3.417 0.380 1
1 1859 . 5 1 1 A 154 154 GLY C C 154 173.848 174.157 -0.309 1
1 1860 . 5 1 1 A 154 154 GLY CA C 154 45.153 45.251 -0.098 1
1 1861 . 5 1 1 A 154 154 GLY N N 154 112.233 111.085 1.148 1
1 1862 . 5 1 1 A 155 155 ALA H H 155 8.074 8.401 -0.327 1
1 1863 . 5 1 1 A 155 155 ALA HA H 155 4.101 3.911 0.190 1
1 1867 . 5 1 1 A 155 155 ALA C C 155 177.651 176.816 0.835 1
1 1868 . 5 1 1 A 155 155 ALA CA C 155 52.795 53.619 -0.824 1
1 1869 . 5 1 1 A 155 155 ALA CB C 155 19.258 18.263 0.995 1
1 1870 . 5 1 1 A 155 155 ALA N N 155 124.092 124.828 -0.736 1
1 1871 . 5 1 1 A 156 156 HIS H H 156 8.201 7.405 0.796 1
1 1872 . 5 1 1 A 156 156 HIS HA H 156 4.474 4.907 -0.433 1
1 1875 . 5 1 1 A 156 156 HIS C C 156 174.758 174.258 0.500 1
1 1876 . 5 1 1 A 156 156 HIS CA C 156 55.756 54.230 1.526 1
1 1877 . 5 1 1 A 156 156 HIS CB C 156 30.060 29.823 0.237 1
1 1878 . 5 1 1 A 156 156 HIS N N 156 118.170 110.673 7.497 1
1 1879 . 5 1 1 A 157 157 ASP H H 157 8.001 8.080 -0.079 1
1 1880 . 5 1 1 A 157 157 ASP HA H 157 4.436 4.887 -0.451 1
1 1883 . 5 1 1 A 157 157 ASP CA C 157 54.185 53.592 0.593 1
1 1884 . 5 1 1 A 157 157 ASP CB C 157 41.016 40.548 0.468 1
1 1885 . 5 1 1 A 157 157 ASP N N 157 121.683 120.832 0.851 1
1 1886 . 5 1 1 A 160 160 HIS HA H 160 4.502 4.992 -0.490 1
1 1889 . 5 1 1 A 160 160 HIS C C 160 174.722 174.852 -0.130 1
1 1890 . 5 1 1 A 160 160 HIS CA C 160 55.979 54.231 1.748 1
1 1891 . 5 1 1 A 160 160 HIS CB C 160 30.058 29.263 0.795 1
1 1892 . 5 1 1 A 161 161 ASP H H 161 8.270 8.940 -0.670 1
1 1893 . 5 1 1 A 161 161 ASP HA H 161 4.446 4.825 -0.379 1
1 1896 . 5 1 1 A 161 161 ASP C C 161 176.107 176.035 0.072 1
1 1897 . 5 1 1 A 161 161 ASP CA C 161 54.474 55.657 -1.183 1
1 1898 . 5 1 1 A 161 161 ASP CB C 161 40.820 42.984 -2.164 1
1 1899 . 5 1 1 A 161 161 ASP N N 161 121.957 124.493 -2.536 1
1 1900 . 5 1 1 A 162 162 HIS H H 162 8.212 7.983 0.229 1
1 1901 . 5 1 1 A 162 162 HIS HA H 162 4.289 4.748 -0.459 1
1 1904 . 5 1 1 A 162 162 HIS C C 162 175.036 173.383 1.653 1
1 1905 . 5 1 1 A 162 162 HIS CA C 162 56.185 53.804 2.381 1
1 1906 . 5 1 1 A 162 162 HIS CB C 162 30.108 28.668 1.440 1
1 1907 . 5 1 1 A 162 162 HIS N N 162 119.766 117.599 2.167 1
1 1908 . 5 1 1 A 163 163 ASP H H 163 8.163 8.268 -0.105 1
1 1909 . 5 1 1 A 163 163 ASP HA H 163 4.428 4.948 -0.520 1
1 1912 . 5 1 1 A 163 163 ASP C C 163 176.161 174.488 1.673 1
1 1913 . 5 1 1 A 163 163 ASP CA C 163 54.585 53.671 0.914 1
1 1914 . 5 1 1 A 163 163 ASP CB C 163 40.823 41.715 -0.892 1
1 1915 . 5 1 1 A 163 163 ASP N N 163 121.265 125.210 -3.945 1
1 1916 . 5 1 1 A 164 164 HIS H H 164 8.106 8.407 -0.301 1
1 1917 . 5 1 1 A 164 164 HIS HA H 164 4.422 5.103 -0.681 1
1 1920 . 5 1 1 A 164 164 HIS C C 164 174.904 171.735 3.169 1
1 1921 . 5 1 1 A 164 164 HIS CA C 164 56.361 54.749 1.612 1
1 1922 . 5 1 1 A 164 164 HIS CB C 164 30.305 31.384 -1.079 1
1 1923 . 5 1 1 A 164 164 HIS N N 164 119.729 120.254 -0.525 1
1 1924 . 5 1 1 A 165 165 ASP H H 165 8.118 8.750 -0.632 1
1 1925 . 5 1 1 A 165 165 ASP HA H 165 4.394 4.915 -0.521 1
1 1928 . 5 1 1 A 165 165 ASP C C 165 176.054 175.663 0.391 1
1 1929 . 5 1 1 A 165 165 ASP CA C 165 54.364 52.474 1.890 1
1 1930 . 5 1 1 A 165 165 ASP CB C 165 40.818 43.815 -2.997 1
1 1931 . 5 1 1 A 165 165 ASP N N 165 121.062 119.321 1.741 1
1 1932 . 5 1 1 A 166 166 HIS H H 166 8.092 8.452 -0.360 1
1 1933 . 5 1 1 A 166 166 HIS CA C 166 56.114 58.018 -1.904 1
1 1934 . 5 1 1 A 166 166 HIS CB C 166 29.702 28.444 1.258 1
1 1935 . 5 1 1 A 166 166 HIS N N 166 120.001 116.014 3.987 1
1 1936 . 5 1 1 A 170 170 HIS HA H 170 4.514 4.421 0.093 1
1 1939 . 5 1 1 A 170 170 HIS C C 170 173.952 174.122 -0.170 1
1 1940 . 5 1 1 A 170 170 HIS CA C 170 55.995 56.984 -0.989 1
1 1941 . 5 1 1 A 170 170 HIS CB C 170 30.161 31.758 -1.597 1
1 14 . 6 1 1 A 2 2 LYS H H 2 7.540 8.758 -1.218 1
1 15 . 6 1 1 A 2 2 LYS HA H 2 4.729 5.104 -0.375 1
1 24 . 6 1 1 A 2 2 LYS C C 2 175.948 175.467 0.481 1
1 25 . 6 1 1 A 2 2 LYS CA C 2 53.978 54.587 -0.609 1
1 26 . 6 1 1 A 2 2 LYS CB C 2 35.985 34.685 1.300 1
1 30 . 6 1 1 A 2 2 LYS N N 2 120.764 119.930 0.834 1
1 31 . 6 1 1 A 3 3 VAL H H 3 8.738 8.337 0.401 1
1 32 . 6 1 1 A 3 3 VAL HA H 3 2.800 4.437 -1.637 1
1 40 . 6 1 1 A 3 3 VAL C C 3 175.018 175.153 -0.135 1
1 41 . 6 1 1 A 3 3 VAL CA C 3 66.598 61.366 5.232 1
1 42 . 6 1 1 A 3 3 VAL CB C 3 31.218 32.486 -1.268 1
1 45 . 6 1 1 A 3 3 VAL N N 3 120.055 121.575 -1.520 1
1 46 . 6 1 1 A 4 4 ALA H H 4 6.584 8.763 -2.179 1
1 47 . 6 1 1 A 4 4 ALA HA H 4 4.223 4.704 -0.481 1
1 51 . 6 1 1 A 4 4 ALA C C 4 174.117 175.552 -1.435 1
1 52 . 6 1 1 A 4 4 ALA CA C 4 50.358 50.900 -0.542 1
1 53 . 6 1 1 A 4 4 ALA CB C 4 22.137 23.129 -0.992 1
1 54 . 6 1 1 A 4 4 ALA N N 4 129.800 130.167 -0.367 1
1 55 . 6 1 1 A 5 5 LYS H H 5 8.596 8.495 0.101 1
1 56 . 6 1 1 A 5 5 LYS HA H 5 3.793 4.041 -0.248 1
1 65 . 6 1 1 A 5 5 LYS C C 5 175.260 177.037 -1.777 1
1 66 . 6 1 1 A 5 5 LYS CA C 5 57.700 57.918 -0.218 1
1 67 . 6 1 1 A 5 5 LYS CB C 5 32.400 32.333 0.067 1
1 71 . 6 1 1 A 5 5 LYS N N 5 118.708 119.962 -1.254 1
1 72 . 6 1 1 A 6 6 ASP H H 6 8.679 9.004 -0.325 1
1 73 . 6 1 1 A 6 6 ASP HA H 6 4.040 4.446 -0.406 1
1 76 . 6 1 1 A 6 6 ASP C C 6 173.331 175.484 -2.153 1
1 77 . 6 1 1 A 6 6 ASP CA C 6 57.508 55.638 1.870 1
1 78 . 6 1 1 A 6 6 ASP CB C 6 37.604 39.385 -1.781 1
1 79 . 6 1 1 A 6 6 ASP N N 6 115.415 120.841 -5.426 1
1 80 . 6 1 1 A 7 7 LEU H H 7 7.376 7.780 -0.404 1
1 81 . 6 1 1 A 7 7 LEU HA H 7 4.689 4.336 0.353 1
1 91 . 6 1 1 A 7 7 LEU C C 7 175.906 175.965 -0.059 1
1 92 . 6 1 1 A 7 7 LEU CA C 7 53.509 54.073 -0.564 1
1 93 . 6 1 1 A 7 7 LEU CB C 7 42.419 41.312 1.107 1
1 97 . 6 1 1 A 7 7 LEU N N 7 117.619 121.258 -3.639 1
1 98 . 6 1 1 A 8 8 VAL H H 8 8.646 8.311 0.335 1
1 99 . 6 1 1 A 8 8 VAL HA H 8 4.397 4.255 0.142 1
1 107 . 6 1 1 A 8 8 VAL C C 8 175.244 175.215 0.029 1
1 108 . 6 1 1 A 8 8 VAL CA C 8 62.028 63.127 -1.099 1
1 109 . 6 1 1 A 8 8 VAL CB C 8 31.515 32.359 -0.844 1
1 112 . 6 1 1 A 8 8 VAL N N 8 121.164 127.419 -6.255 1
1 113 . 6 1 1 A 9 9 VAL H H 9 8.607 8.780 -0.173 1
1 114 . 6 1 1 A 9 9 VAL HA H 9 4.281 4.758 -0.477 1
1 122 . 6 1 1 A 9 9 VAL C C 9 174.156 173.954 0.202 1
1 123 . 6 1 1 A 9 9 VAL CA C 9 60.614 59.653 0.961 1
1 124 . 6 1 1 A 9 9 VAL CB C 9 33.985 35.827 -1.842 1
1 127 . 6 1 1 A 9 9 VAL N N 9 134.014 121.830 12.184 1
1 128 . 6 1 1 A 10 10 SER H H 10 8.684 8.861 -0.177 1
1 129 . 6 1 1 A 10 10 SER HA H 10 5.736 5.464 0.272 1
1 132 . 6 1 1 A 10 10 SER C C 10 173.544 173.906 -0.362 1
1 133 . 6 1 1 A 10 10 SER CA C 10 56.533 58.099 -1.566 1
1 134 . 6 1 1 A 10 10 SER CB C 10 63.385 64.190 -0.805 1
1 135 . 6 1 1 A 10 10 SER N N 10 121.492 121.937 -0.445 1
1 136 . 6 1 1 A 11 11 LEU H H 11 9.939 9.079 0.860 1
1 137 . 6 1 1 A 11 11 LEU HA H 11 5.133 5.175 -0.042 1
1 147 . 6 1 1 A 11 11 LEU C C 11 174.843 175.311 -0.468 1
1 148 . 6 1 1 A 11 11 LEU CA C 11 53.770 53.249 0.521 1
1 149 . 6 1 1 A 11 11 LEU CB C 11 47.469 46.336 1.133 1
1 153 . 6 1 1 A 11 11 LEU N N 11 128.460 122.645 5.815 1
1 154 . 6 1 1 A 12 12 ALA H H 12 8.770 9.373 -0.603 1
1 155 . 6 1 1 A 12 12 ALA HA H 12 4.830 5.361 -0.531 1
1 159 . 6 1 1 A 12 12 ALA C C 12 176.974 176.172 0.802 1
1 160 . 6 1 1 A 12 12 ALA CA C 12 50.231 50.427 -0.196 1
1 161 . 6 1 1 A 12 12 ALA CB C 12 21.270 22.292 -1.022 1
1 162 . 6 1 1 A 12 12 ALA N N 12 127.500 122.942 4.558 1
1 163 . 6 1 1 A 13 13 TYR H H 13 8.749 8.216 0.533 1
1 164 . 6 1 1 A 13 13 TYR HA H 13 5.797 5.641 0.156 1
1 171 . 6 1 1 A 13 13 TYR C C 13 173.952 172.520 1.432 1
1 172 . 6 1 1 A 13 13 TYR CA C 13 56.390 55.847 0.543 1
1 173 . 6 1 1 A 13 13 TYR CB C 13 41.159 41.672 -0.513 1
1 176 . 6 1 1 A 13 13 TYR N N 13 117.737 116.345 1.392 1
1 177 . 6 1 1 A 14 14 GLN H H 14 8.492 8.528 -0.036 1
1 178 . 6 1 1 A 14 14 GLN HA H 14 4.611 5.140 -0.529 1
1 185 . 6 1 1 A 14 14 GLN C C 14 174.492 174.239 0.253 1
1 186 . 6 1 1 A 14 14 GLN CA C 14 55.626 54.478 1.148 1
1 187 . 6 1 1 A 14 14 GLN CB C 14 32.734 32.218 0.516 1
1 189 . 6 1 1 A 14 14 GLN N N 14 116.962 120.384 -3.422 1
1 191 . 6 1 1 A 15 15 VAL H H 15 8.403 9.666 -1.263 1
1 192 . 6 1 1 A 15 15 VAL HA H 15 4.614 5.047 -0.433 1
1 200 . 6 1 1 A 15 15 VAL C C 15 173.389 175.234 -1.845 1
1 201 . 6 1 1 A 15 15 VAL CA C 15 59.711 61.977 -2.266 1
1 202 . 6 1 1 A 15 15 VAL CB C 15 33.639 32.773 0.866 1
1 205 . 6 1 1 A 15 15 VAL N N 15 121.203 127.483 -6.280 1
1 206 . 6 1 1 A 16 16 ARG H H 16 8.584 9.491 -0.907 1
1 207 . 6 1 1 A 16 16 ARG HA H 16 5.584 5.465 0.119 1
1 214 . 6 1 1 A 16 16 ARG C C 16 176.585 175.155 1.430 1
1 215 . 6 1 1 A 16 16 ARG CA C 16 53.453 54.392 -0.939 1
1 216 . 6 1 1 A 16 16 ARG CB C 16 34.968 33.673 1.295 1
1 219 . 6 1 1 A 16 16 ARG N N 16 126.883 124.768 2.115 1
1 220 . 6 1 1 A 17 17 THR H H 17 8.270 8.721 -0.451 1
1 221 . 6 1 1 A 17 17 THR HA H 17 4.573 4.578 -0.005 1
1 226 . 6 1 1 A 17 17 THR C C 17 177.860 176.156 1.704 1
1 227 . 6 1 1 A 17 17 THR CA C 17 61.073 60.823 0.250 1
1 228 . 6 1 1 A 17 17 THR CB C 17 69.823 71.357 -1.534 1
1 230 . 6 1 1 A 17 17 THR N N 17 109.730 113.158 -3.428 1
1 231 . 6 1 1 A 18 18 GLU H H 18 9.147 8.947 0.200 1
1 232 . 6 1 1 A 18 18 GLU HA H 18 3.770 3.988 -0.218 1
1 237 . 6 1 1 A 18 18 GLU C C 18 176.683 178.160 -1.477 1
1 238 . 6 1 1 A 18 18 GLU CA C 18 59.866 59.688 0.178 1
1 239 . 6 1 1 A 18 18 GLU CB C 18 29.752 29.233 0.519 1
1 241 . 6 1 1 A 18 18 GLU N N 18 122.491 121.248 1.243 1
1 242 . 6 1 1 A 19 19 ASP H H 19 7.900 7.746 0.154 1
1 243 . 6 1 1 A 19 19 ASP HA H 19 4.456 4.667 -0.211 1
1 246 . 6 1 1 A 19 19 ASP C C 19 176.670 176.253 0.417 1
1 247 . 6 1 1 A 19 19 ASP CA C 19 53.833 54.255 -0.422 1
1 248 . 6 1 1 A 19 19 ASP CB C 19 40.180 41.343 -1.163 1
1 249 . 6 1 1 A 19 19 ASP N N 19 116.200 117.438 -1.238 1
1 250 . 6 1 1 A 20 20 GLY H H 20 8.149 8.004 0.145 1
1 251 . 6 1 1 A 20 20 GLY HA2 H 20 4.145 3.897 0.248 1
1 252 . 6 1 1 A 20 20 GLY HA3 H 20 3.531 3.903 -0.372 1
1 253 . 6 1 1 A 20 20 GLY C C 20 173.987 174.402 -0.415 1
1 254 . 6 1 1 A 20 20 GLY CA C 20 45.463 45.896 -0.433 1
1 255 . 6 1 1 A 20 20 GLY N N 20 108.869 107.741 1.128 1
1 256 . 6 1 1 A 21 21 VAL H H 21 7.261 7.474 -0.213 1
1 257 . 6 1 1 A 21 21 VAL HA H 21 3.645 4.151 -0.506 1
1 265 . 6 1 1 A 21 21 VAL C C 21 175.265 175.465 -0.200 1
1 266 . 6 1 1 A 21 21 VAL CA C 21 63.368 61.910 1.458 1
1 267 . 6 1 1 A 21 21 VAL CB C 21 31.614 32.883 -1.269 1
1 270 . 6 1 1 A 21 21 VAL N N 21 124.283 120.909 3.374 1
1 271 . 6 1 1 A 22 22 LEU H H 22 8.407 8.675 -0.268 1
1 272 . 6 1 1 A 22 22 LEU HA H 22 4.333 4.614 -0.281 1
1 282 . 6 1 1 A 22 22 LEU C C 22 176.660 176.771 -0.111 1
1 283 . 6 1 1 A 22 22 LEU CA C 22 55.724 56.222 -0.498 1
1 284 . 6 1 1 A 22 22 LEU CB C 22 42.272 42.120 0.152 1
1 288 . 6 1 1 A 22 22 LEU N N 22 128.533 128.270 0.263 1
1 289 . 6 1 1 A 23 23 VAL H H 23 8.887 9.469 -0.582 1
1 290 . 6 1 1 A 23 23 VAL HA H 23 4.237 4.444 -0.207 1
1 298 . 6 1 1 A 23 23 VAL C C 23 175.265 175.683 -0.418 1
1 299 . 6 1 1 A 23 23 VAL CA C 23 62.348 62.187 0.161 1
1 300 . 6 1 1 A 23 23 VAL CB C 23 33.383 33.442 -0.059 1
1 303 . 6 1 1 A 23 23 VAL N N 23 125.041 120.926 4.115 1
1 304 . 6 1 1 A 24 24 ASP H H 24 7.480 7.704 -0.224 1
1 305 . 6 1 1 A 24 24 ASP HA H 24 4.763 5.117 -0.354 1
1 308 . 6 1 1 A 24 24 ASP C C 24 173.160 173.924 -0.764 1
1 309 . 6 1 1 A 24 24 ASP CA C 24 53.893 53.531 0.362 1
1 310 . 6 1 1 A 24 24 ASP CB C 24 43.680 44.638 -0.958 1
1 311 . 6 1 1 A 24 24 ASP N N 24 117.159 120.404 -3.245 1
1 312 . 6 1 1 A 25 25 GLU H H 25 8.187 8.734 -0.547 1
1 313 . 6 1 1 A 25 25 GLU HA H 25 4.491 4.685 -0.194 1
1 318 . 6 1 1 A 25 25 GLU C C 25 174.586 173.956 0.630 1
1 319 . 6 1 1 A 25 25 GLU CA C 25 55.475 56.024 -0.549 1
1 320 . 6 1 1 A 25 25 GLU CB C 25 33.033 34.098 -1.065 1
1 322 . 6 1 1 A 25 25 GLU N N 25 118.821 123.856 -5.035 1
1 323 . 6 1 1 A 26 26 SER H H 26 8.003 8.410 -0.407 1
1 324 . 6 1 1 A 26 26 SER HA H 26 4.782 4.766 0.016 1
1 327 . 6 1 1 A 26 26 SER CA C 26 56.490 54.995 1.495 1
1 328 . 6 1 1 A 26 26 SER CB C 26 64.977 64.127 0.850 1
1 329 . 6 1 1 A 26 26 SER N N 26 119.346 123.055 -3.709 1
1 330 . 6 1 1 A 27 27 PRO HA H 27 4.633 4.549 0.084 1
1 337 . 6 1 1 A 27 27 PRO C C 27 177.016 177.437 -0.421 1
1 338 . 6 1 1 A 27 27 PRO CA C 27 61.943 62.534 -0.591 1
1 339 . 6 1 1 A 27 27 PRO CB C 27 32.492 33.313 -0.821 1
1 342 . 6 1 1 A 28 28 VAL H H 28 8.383 8.641 -0.258 1
1 343 . 6 1 1 A 28 28 VAL HA H 28 3.385 3.729 -0.344 1
1 351 . 6 1 1 A 28 28 VAL C C 28 176.069 177.462 -1.393 1
1 352 . 6 1 1 A 28 28 VAL CA C 28 65.888 65.201 0.687 1
1 353 . 6 1 1 A 28 28 VAL CB C 28 31.220 31.537 -0.317 1
1 356 . 6 1 1 A 28 28 VAL N N 28 119.349 122.538 -3.189 1
1 357 . 6 1 1 A 29 29 SER H H 29 7.365 7.747 -0.382 1
1 358 . 6 1 1 A 29 29 SER HA H 29 4.101 4.345 -0.244 1
1 361 . 6 1 1 A 29 29 SER C C 29 174.535 174.608 -0.073 1
1 362 . 6 1 1 A 29 29 SER CA C 29 58.609 60.248 -1.639 1
1 363 . 6 1 1 A 29 29 SER CB C 29 63.198 63.499 -0.301 1
1 364 . 6 1 1 A 29 29 SER N N 29 109.365 114.235 -4.870 1
1 365 . 6 1 1 A 30 30 ALA H H 30 7.457 7.502 -0.045 1
1 366 . 6 1 1 A 30 30 ALA HA H 30 4.548 4.789 -0.241 1
1 370 . 6 1 1 A 30 30 ALA CA C 30 50.789 49.203 1.586 1
1 371 . 6 1 1 A 30 30 ALA CB C 30 18.608 21.405 -2.797 1
1 372 . 6 1 1 A 30 30 ALA N N 30 126.056 122.520 3.536 1
1 373 . 6 1 1 A 31 31 PRO HA H 31 4.332 4.653 -0.321 1
1 380 . 6 1 1 A 31 31 PRO C C 31 175.841 176.704 -0.863 1
1 381 . 6 1 1 A 31 31 PRO CA C 31 62.996 62.397 0.599 1
1 382 . 6 1 1 A 31 31 PRO CB C 31 32.696 32.552 0.144 1
1 385 . 6 1 1 A 32 32 LEU H H 32 8.717 9.125 -0.408 1
1 386 . 6 1 1 A 32 32 LEU HA H 32 4.452 4.473 -0.021 1
1 396 . 6 1 1 A 32 32 LEU C C 32 175.298 176.830 -1.532 1
1 397 . 6 1 1 A 32 32 LEU CA C 32 54.510 55.100 -0.590 1
1 398 . 6 1 1 A 32 32 LEU CB C 32 43.899 43.491 0.408 1
1 402 . 6 1 1 A 32 32 LEU N N 32 123.702 122.546 1.156 1
1 403 . 6 1 1 A 33 33 ASP H H 33 8.258 8.539 -0.281 1
1 404 . 6 1 1 A 33 33 ASP HA H 33 5.919 4.375 1.544 1
1 407 . 6 1 1 A 33 33 ASP C C 33 175.927 175.336 0.591 1
1 408 . 6 1 1 A 33 33 ASP CA C 33 52.619 52.851 -0.232 1
1 409 . 6 1 1 A 33 33 ASP CB C 33 42.205 42.782 -0.577 1
1 410 . 6 1 1 A 33 33 ASP N N 33 128.453 122.980 5.473 1
1 411 . 6 1 1 A 34 34 TYR H H 34 9.144 7.751 1.393 1
1 412 . 6 1 1 A 34 34 TYR HA H 34 4.689 5.805 -1.116 1
1 419 . 6 1 1 A 34 34 TYR C C 34 170.622 173.694 -3.072 1
1 420 . 6 1 1 A 34 34 TYR CA C 34 55.930 55.438 0.492 1
1 421 . 6 1 1 A 34 34 TYR CB C 34 41.905 41.340 0.565 1
1 424 . 6 1 1 A 34 34 TYR N N 34 121.657 118.597 3.060 1
1 425 . 6 1 1 A 35 35 LEU H H 35 8.324 8.772 -0.448 1
1 426 . 6 1 1 A 35 35 LEU HA H 35 4.396 4.855 -0.459 1
1 436 . 6 1 1 A 35 35 LEU C C 35 175.301 175.312 -0.011 1
1 437 . 6 1 1 A 35 35 LEU CA C 35 52.909 54.511 -1.602 1
1 438 . 6 1 1 A 35 35 LEU CB C 35 42.816 44.280 -1.464 1
1 442 . 6 1 1 A 35 35 LEU N N 35 124.514 124.411 0.103 1
1 443 . 6 1 1 A 36 36 HIS H H 36 8.763 8.852 -0.089 1
1 444 . 6 1 1 A 36 36 HIS HA H 36 4.382 4.953 -0.571 1
1 449 . 6 1 1 A 36 36 HIS C C 36 176.514 176.376 0.138 1
1 450 . 6 1 1 A 36 36 HIS CA C 36 59.570 57.927 1.643 1
1 451 . 6 1 1 A 36 36 HIS CB C 36 31.257 29.668 1.589 1
1 454 . 6 1 1 A 36 36 HIS N N 36 132.209 127.420 4.789 1
1 455 . 6 1 1 A 37 37 GLY H H 37 8.745 8.681 0.064 1
1 456 . 6 1 1 A 37 37 GLY HA2 H 37 4.021 3.809 0.212 1
1 457 . 6 1 1 A 37 37 GLY HA3 H 37 3.592 3.923 -0.331 1
1 458 . 6 1 1 A 37 37 GLY C C 37 175.081 174.092 0.989 1
1 459 . 6 1 1 A 37 37 GLY CA C 37 45.621 45.191 0.430 1
1 460 . 6 1 1 A 37 37 GLY N N 37 117.737 115.082 2.655 1
1 461 . 6 1 1 A 38 38 HIS H H 38 8.470 7.324 1.146 1
1 462 . 6 1 1 A 38 38 HIS HA H 38 4.584 4.734 -0.150 1
1 467 . 6 1 1 A 38 38 HIS C C 38 175.334 174.476 0.858 1
1 468 . 6 1 1 A 38 38 HIS CA C 38 55.899 54.836 1.063 1
1 469 . 6 1 1 A 38 38 HIS CB C 38 30.865 31.334 -0.469 1
1 472 . 6 1 1 A 38 38 HIS N N 38 119.813 114.469 5.344 1
1 473 . 6 1 1 A 39 39 GLY H H 39 8.936 6.939 1.997 1
1 474 . 6 1 1 A 39 39 GLY HA2 H 39 3.895 3.981 -0.086 1
1 475 . 6 1 1 A 39 39 GLY HA3 H 39 3.895 3.994 -0.099 1
1 476 . 6 1 1 A 39 39 GLY C C 39 175.557 174.600 0.957 1
1 477 . 6 1 1 A 39 39 GLY CA C 39 46.938 45.271 1.667 1
1 478 . 6 1 1 A 39 39 GLY N N 39 112.442 108.331 4.111 1
1 479 . 6 1 1 A 40 40 SER H H 40 9.249 8.463 0.786 1
1 480 . 6 1 1 A 40 40 SER HA H 40 4.299 4.716 -0.417 1
1 483 . 6 1 1 A 40 40 SER C C 40 174.138 174.402 -0.264 1
1 484 . 6 1 1 A 40 40 SER CA C 40 60.809 59.645 1.164 1
1 485 . 6 1 1 A 40 40 SER CB C 40 64.041 65.264 -1.223 1
1 486 . 6 1 1 A 40 40 SER N N 40 117.098 116.412 0.686 1
1 487 . 6 1 1 A 41 41 LEU H H 41 7.386 7.660 -0.274 1
1 488 . 6 1 1 A 41 41 LEU HA H 41 4.429 4.429 0.000 1
1 498 . 6 1 1 A 41 41 LEU C C 41 176.526 175.439 1.087 1
1 499 . 6 1 1 A 41 41 LEU CA C 41 52.295 53.650 -1.355 1
1 500 . 6 1 1 A 41 41 LEU CB C 41 44.147 42.768 1.379 1
1 504 . 6 1 1 A 41 41 LEU N N 41 120.541 115.879 4.662 1
1 505 . 6 1 1 A 42 42 ILE H H 42 7.407 8.183 -0.776 1
1 506 . 6 1 1 A 42 42 ILE HA H 42 3.756 4.054 -0.298 1
1 516 . 6 1 1 A 42 42 ILE C C 42 178.081 176.942 1.139 1
1 517 . 6 1 1 A 42 42 ILE CA C 42 62.257 61.566 0.691 1
1 518 . 6 1 1 A 42 42 ILE CB C 42 38.256 38.474 -0.218 1
1 522 . 6 1 1 A 42 42 ILE N N 42 115.050 116.934 -1.884 1
1 523 . 6 1 1 A 43 43 SER H H 43 8.581 8.948 -0.367 1
1 524 . 6 1 1 A 43 43 SER HA H 43 3.957 4.118 -0.161 1
1 527 . 6 1 1 A 43 43 SER C C 43 177.830 176.940 0.890 1
1 528 . 6 1 1 A 43 43 SER CA C 43 61.958 61.327 0.631 1
1 529 . 6 1 1 A 43 43 SER CB C 43 62.680 62.687 -0.007 1
1 530 . 6 1 1 A 43 43 SER N N 43 121.456 119.623 1.833 1
1 531 . 6 1 1 A 44 44 GLY H H 44 8.892 8.212 0.680 1
1 532 . 6 1 1 A 44 44 GLY HA2 H 44 3.514 3.888 -0.374 1
1 533 . 6 1 1 A 44 44 GLY HA3 H 44 3.854 3.909 -0.055 1
1 534 . 6 1 1 A 44 44 GLY C C 44 175.296 175.605 -0.309 1
1 535 . 6 1 1 A 44 44 GLY CA C 44 46.854 47.473 -0.619 1
1 536 . 6 1 1 A 44 44 GLY N N 44 106.351 108.482 -2.131 1
1 537 . 6 1 1 A 45 45 LEU H H 45 6.824 8.132 -1.308 1
1 538 . 6 1 1 A 45 45 LEU HA H 45 3.909 4.236 -0.327 1
1 548 . 6 1 1 A 45 45 LEU C C 45 176.738 178.645 -1.907 1
1 549 . 6 1 1 A 45 45 LEU CA C 45 56.356 57.205 -0.849 1
1 550 . 6 1 1 A 45 45 LEU CB C 45 42.296 41.402 0.894 1
1 554 . 6 1 1 A 45 45 LEU N N 45 119.207 122.879 -3.672 1
1 555 . 6 1 1 A 46 46 GLU H H 46 7.556 8.221 -0.665 1
1 556 . 6 1 1 A 46 46 GLU HA H 46 3.664 4.149 -0.485 1
1 561 . 6 1 1 A 46 46 GLU C C 46 179.231 179.603 -0.372 1
1 562 . 6 1 1 A 46 46 GLU CA C 46 62.316 59.809 2.507 1
1 563 . 6 1 1 A 46 46 GLU CB C 46 29.147 29.180 -0.033 1
1 565 . 6 1 1 A 46 46 GLU N N 46 119.049 118.573 0.476 1
1 566 . 6 1 1 A 47 47 THR H H 47 8.219 8.325 -0.106 1
1 567 . 6 1 1 A 47 47 THR HA H 47 3.965 3.972 -0.007 1
1 572 . 6 1 1 A 47 47 THR C C 47 176.251 176.253 -0.002 1
1 573 . 6 1 1 A 47 47 THR CA C 47 65.947 66.233 -0.286 1
1 574 . 6 1 1 A 47 47 THR CB C 47 69.014 68.443 0.571 1
1 576 . 6 1 1 A 47 47 THR N N 47 111.770 117.819 -6.049 1
1 577 . 6 1 1 A 48 48 ALA H H 48 6.794 7.711 -0.917 1
1 578 . 6 1 1 A 48 48 ALA HA H 48 4.171 4.238 -0.067 1
1 582 . 6 1 1 A 48 48 ALA C C 48 178.639 180.330 -1.691 1
1 583 . 6 1 1 A 48 48 ALA CA C 48 54.072 55.264 -1.192 1
1 584 . 6 1 1 A 48 48 ALA CB C 48 19.752 18.174 1.578 1
1 585 . 6 1 1 A 48 48 ALA N N 48 122.697 123.588 -0.891 1
1 586 . 6 1 1 A 49 49 LEU H H 49 7.691 8.843 -1.152 1
1 587 . 6 1 1 A 49 49 LEU HA H 49 3.902 4.369 -0.467 1
1 597 . 6 1 1 A 49 49 LEU C C 49 176.823 177.853 -1.030 1
1 598 . 6 1 1 A 49 49 LEU CA C 49 57.190 58.129 -0.939 1
1 599 . 6 1 1 A 49 49 LEU CB C 49 43.628 41.767 1.861 1
1 603 . 6 1 1 A 49 49 LEU N N 49 117.159 117.872 -0.713 1
1 604 . 6 1 1 A 50 50 GLU H H 50 6.963 7.734 -0.771 1
1 605 . 6 1 1 A 50 50 GLU HA H 50 3.220 4.065 -0.845 1
1 610 . 6 1 1 A 50 50 GLU C C 50 176.691 177.400 -0.709 1
1 611 . 6 1 1 A 50 50 GLU CA C 50 58.769 58.509 0.260 1
1 612 . 6 1 1 A 50 50 GLU CB C 50 29.792 29.626 0.166 1
1 614 . 6 1 1 A 50 50 GLU N N 50 118.761 119.558 -0.797 1
1 615 . 6 1 1 A 51 51 GLY H H 51 8.541 8.436 0.105 1
1 616 . 6 1 1 A 51 51 GLY HA2 H 51 4.140 3.810 0.330 1
1 617 . 6 1 1 A 51 51 GLY HA3 H 51 3.488 3.891 -0.403 1
1 618 . 6 1 1 A 51 51 GLY C C 51 173.801 174.271 -0.470 1
1 619 . 6 1 1 A 51 51 GLY CA C 51 45.498 45.113 0.385 1
1 620 . 6 1 1 A 51 51 GLY N N 51 113.511 111.996 1.515 1
1 621 . 6 1 1 A 52 52 HIS H H 52 7.656 7.536 0.120 1
1 622 . 6 1 1 A 52 52 HIS HA H 52 4.318 4.634 -0.316 1
1 627 . 6 1 1 A 52 52 HIS C C 52 172.815 174.043 -1.228 1
1 628 . 6 1 1 A 52 52 HIS CA C 52 57.562 56.105 1.457 1
1 629 . 6 1 1 A 52 52 HIS CB C 52 28.670 31.513 -2.843 1
1 632 . 6 1 1 A 52 52 HIS N N 52 116.844 118.682 -1.838 1
1 633 . 6 1 1 A 53 53 GLU H H 53 8.331 8.771 -0.440 1
1 634 . 6 1 1 A 53 53 GLU HA H 53 4.636 4.998 -0.362 1
1 639 . 6 1 1 A 53 53 GLU C C 53 176.145 176.014 0.131 1
1 640 . 6 1 1 A 53 53 GLU CA C 53 54.891 54.095 0.796 1
1 641 . 6 1 1 A 53 53 GLU CB C 53 33.837 33.677 0.160 1
1 643 . 6 1 1 A 53 53 GLU N N 53 118.873 118.733 0.140 1
1 644 . 6 1 1 A 54 54 VAL H H 54 8.585 8.383 0.202 1
1 645 . 6 1 1 A 54 54 VAL HA H 54 3.227 3.981 -0.754 1
1 653 . 6 1 1 A 54 54 VAL C C 54 177.218 176.485 0.733 1
1 654 . 6 1 1 A 54 54 VAL CA C 54 65.848 63.534 2.314 1
1 655 . 6 1 1 A 54 54 VAL CB C 54 31.189 31.451 -0.262 1
1 658 . 6 1 1 A 54 54 VAL N N 54 120.580 121.588 -1.008 1
1 659 . 6 1 1 A 55 55 GLY H H 55 8.912 9.357 -0.445 1
1 660 . 6 1 1 A 55 55 GLY HA2 H 55 4.441 4.054 0.387 1
1 661 . 6 1 1 A 55 55 GLY HA3 H 55 3.865 4.054 -0.189 1
1 662 . 6 1 1 A 55 55 GLY C C 55 174.827 173.896 0.931 1
1 663 . 6 1 1 A 55 55 GLY CA C 55 44.370 44.891 -0.521 1
1 664 . 6 1 1 A 55 55 GLY N N 55 118.078 115.443 2.635 1
1 665 . 6 1 1 A 56 56 ASP H H 56 8.098 7.996 0.102 1
1 666 . 6 1 1 A 56 56 ASP HA H 56 4.547 4.658 -0.111 1
1 669 . 6 1 1 A 56 56 ASP C C 56 174.859 174.863 -0.004 1
1 670 . 6 1 1 A 56 56 ASP CA C 56 55.629 55.155 0.474 1
1 671 . 6 1 1 A 56 56 ASP CB C 56 40.906 41.763 -0.857 1
1 672 . 6 1 1 A 56 56 ASP N N 56 123.094 122.408 0.686 1
1 673 . 6 1 1 A 57 57 LYS H H 57 8.168 8.610 -0.442 1
1 674 . 6 1 1 A 57 57 LYS HA H 57 5.471 6.017 -0.546 1
1 683 . 6 1 1 A 57 57 LYS C C 57 175.732 175.016 0.716 1
1 684 . 6 1 1 A 57 57 LYS CA C 57 55.056 55.193 -0.137 1
1 685 . 6 1 1 A 57 57 LYS CB C 57 35.302 36.060 -0.758 1
1 689 . 6 1 1 A 57 57 LYS N N 57 122.301 123.295 -0.994 1
1 690 . 6 1 1 A 58 58 PHE H H 58 8.355 8.442 -0.087 1
1 691 . 6 1 1 A 58 58 PHE HA H 58 4.858 5.063 -0.205 1
1 699 . 6 1 1 A 58 58 PHE C C 58 171.549 171.603 -0.054 1
1 700 . 6 1 1 A 58 58 PHE CA C 58 56.195 56.349 -0.154 1
1 701 . 6 1 1 A 58 58 PHE CB C 58 39.335 40.285 -0.950 1
1 705 . 6 1 1 A 58 58 PHE N N 58 121.026 120.944 0.082 1
1 706 . 6 1 1 A 59 59 ASP H H 59 8.407 8.892 -0.485 1
1 707 . 6 1 1 A 59 59 ASP HA H 59 5.743 5.182 0.561 1
1 710 . 6 1 1 A 59 59 ASP C C 59 176.302 175.248 1.054 1
1 711 . 6 1 1 A 59 59 ASP CA C 59 52.579 53.504 -0.925 1
1 712 . 6 1 1 A 59 59 ASP CB C 59 43.628 42.282 1.346 1
1 713 . 6 1 1 A 59 59 ASP N N 59 119.234 120.797 -1.563 1
1 714 . 6 1 1 A 60 60 VAL H H 60 8.915 8.819 0.096 1
1 715 . 6 1 1 A 60 60 VAL HA H 60 4.374 5.048 -0.674 1
1 723 . 6 1 1 A 60 60 VAL C C 60 173.140 174.591 -1.451 1
1 724 . 6 1 1 A 60 60 VAL CA C 60 61.252 60.304 0.948 1
1 725 . 6 1 1 A 60 60 VAL CB C 60 35.620 35.352 0.268 1
1 728 . 6 1 1 A 60 60 VAL N N 60 119.758 125.045 -5.287 1
1 729 . 6 1 1 A 61 61 ALA H H 61 8.761 8.917 -0.156 1
1 730 . 6 1 1 A 61 61 ALA HA H 61 5.091 5.149 -0.058 1
1 734 . 6 1 1 A 61 61 ALA C C 61 176.460 176.291 0.169 1
1 735 . 6 1 1 A 61 61 ALA CA C 61 51.019 50.700 0.319 1
1 736 . 6 1 1 A 61 61 ALA CB C 61 19.447 21.220 -1.773 1
1 737 . 6 1 1 A 61 61 ALA N N 61 133.341 128.268 5.073 1
1 738 . 6 1 1 A 62 62 VAL H H 62 8.929 8.824 0.105 1
1 739 . 6 1 1 A 62 62 VAL HA H 62 4.236 4.715 -0.479 1
1 747 . 6 1 1 A 62 62 VAL C C 62 174.733 175.598 -0.865 1
1 748 . 6 1 1 A 62 62 VAL CA C 62 61.007 60.867 0.140 1
1 749 . 6 1 1 A 62 62 VAL CB C 62 34.387 35.616 -1.229 1
1 752 . 6 1 1 A 62 62 VAL N N 62 124.165 122.794 1.371 1
1 753 . 6 1 1 A 63 63 GLY H H 63 8.995 8.665 0.330 1
1 754 . 6 1 1 A 63 63 GLY HA2 H 63 4.229 4.102 0.127 1
1 755 . 6 1 1 A 63 63 GLY HA3 H 63 3.637 4.126 -0.489 1
1 756 . 6 1 1 A 63 63 GLY C C 63 175.306 174.894 0.412 1
1 757 . 6 1 1 A 63 63 GLY CA C 63 44.620 45.343 -0.723 1
1 758 . 6 1 1 A 63 63 GLY N N 63 115.598 112.833 2.765 1
1 759 . 6 1 1 A 64 64 ALA H H 64 8.106 8.944 -0.838 1
1 760 . 6 1 1 A 64 64 ALA HA H 64 4.010 4.109 -0.099 1
1 764 . 6 1 1 A 64 64 ALA C C 64 180.218 179.147 1.071 1
1 765 . 6 1 1 A 64 64 ALA CA C 64 55.897 54.405 1.492 1
1 766 . 6 1 1 A 64 64 ALA CB C 64 18.347 18.450 -0.103 1
1 767 . 6 1 1 A 64 64 ALA N N 64 122.859 124.861 -2.002 1
1 768 . 6 1 1 A 65 65 ASN H H 65 8.748 8.672 0.076 1
1 769 . 6 1 1 A 65 65 ASN HA H 65 4.230 4.500 -0.270 1
1 774 . 6 1 1 A 65 65 ASN C C 65 176.085 176.583 -0.498 1
1 775 . 6 1 1 A 65 65 ASN CA C 65 56.064 54.963 1.101 1
1 776 . 6 1 1 A 65 65 ASN CB C 65 37.871 36.563 1.308 1
1 777 . 6 1 1 A 65 65 ASN N N 65 114.590 114.277 0.313 1
1 779 . 6 1 1 A 66 66 ASP H H 66 7.598 7.985 -0.387 1
1 780 . 6 1 1 A 66 66 ASP HA H 66 4.682 4.926 -0.244 1
1 783 . 6 1 1 A 66 66 ASP C C 66 173.061 177.963 -4.902 1
1 784 . 6 1 1 A 66 66 ASP CA C 66 53.549 55.560 -2.011 1
1 785 . 6 1 1 A 66 66 ASP CB C 66 42.204 42.540 -0.336 1
1 786 . 6 1 1 A 66 66 ASP N N 66 118.065 118.660 -0.595 1
1 787 . 6 1 1 A 67 67 ALA H H 67 7.434 7.909 -0.475 1
1 788 . 6 1 1 A 67 67 ALA HA H 67 4.316 4.455 -0.139 1
1 792 . 6 1 1 A 67 67 ALA C C 67 175.615 177.405 -1.790 1
1 793 . 6 1 1 A 67 67 ALA CA C 67 50.814 53.921 -3.107 1
1 794 . 6 1 1 A 67 67 ALA CB C 67 18.618 19.188 -0.570 1
1 795 . 6 1 1 A 67 67 ALA N N 67 124.890 121.135 3.755 1
1 796 . 6 1 1 A 68 68 TYR H H 68 8.390 7.998 0.392 1
1 797 . 6 1 1 A 68 68 TYR HA H 68 4.195 4.925 -0.730 1
1 804 . 6 1 1 A 68 68 TYR C C 68 174.964 174.458 0.506 1
1 805 . 6 1 1 A 68 68 TYR CA C 68 59.566 56.477 3.089 1
1 806 . 6 1 1 A 68 68 TYR CB C 68 36.992 40.993 -4.001 1
1 809 . 6 1 1 A 68 68 TYR N N 68 121.083 112.173 8.910 1
1 810 . 6 1 1 A 69 69 GLY H H 69 8.149 8.768 -0.619 1
1 811 . 6 1 1 A 69 69 GLY HA2 H 69 4.254 3.886 0.368 1
1 812 . 6 1 1 A 69 69 GLY HA3 H 69 3.624 4.022 -0.398 1
1 813 . 6 1 1 A 69 69 GLY C C 69 173.161 175.092 -1.931 1
1 814 . 6 1 1 A 69 69 GLY CA C 69 44.465 45.536 -1.071 1
1 815 . 6 1 1 A 69 69 GLY N N 69 108.762 109.532 -0.770 1
1 816 . 6 1 1 A 70 70 GLN H H 70 8.450 7.755 0.695 1
1 817 . 6 1 1 A 70 70 GLN HA H 70 4.140 4.412 -0.272 1
1 824 . 6 1 1 A 70 70 GLN C C 70 176.138 174.456 1.682 1
1 825 . 6 1 1 A 70 70 GLN CA C 70 54.680 55.984 -1.304 1
1 826 . 6 1 1 A 70 70 GLN CB C 70 29.210 29.839 -0.629 1
1 828 . 6 1 1 A 70 70 GLN N N 70 117.002 119.850 -2.848 1
1 830 . 6 1 1 A 71 71 TYR H H 71 8.991 8.804 0.187 1
1 831 . 6 1 1 A 71 71 TYR HA H 71 3.752 4.841 -1.089 1
1 838 . 6 1 1 A 71 71 TYR C C 71 174.548 173.743 0.805 1
1 839 . 6 1 1 A 71 71 TYR CA C 71 59.868 56.894 2.974 1
1 840 . 6 1 1 A 71 71 TYR CB C 71 38.961 39.684 -0.723 1
1 843 . 6 1 1 A 71 71 TYR N N 71 125.112 124.217 0.895 1
1 844 . 6 1 1 A 72 72 ASP H H 72 8.819 8.894 -0.075 1
1 845 . 6 1 1 A 72 72 ASP HA H 72 4.773 4.617 0.156 1
1 848 . 6 1 1 A 72 72 ASP C C 72 177.709 176.591 1.118 1
1 849 . 6 1 1 A 72 72 ASP CA C 72 52.382 52.678 -0.296 1
1 850 . 6 1 1 A 72 72 ASP CB C 72 42.197 38.945 3.252 1
1 851 . 6 1 1 A 72 72 ASP N N 72 129.918 127.311 2.607 1
1 852 . 6 1 1 A 73 73 GLU H H 73 9.409 8.066 1.343 1
1 853 . 6 1 1 A 73 73 GLU HA H 73 3.937 3.676 0.261 1
1 858 . 6 1 1 A 73 73 GLU C C 73 177.581 177.190 0.391 1
1 859 . 6 1 1 A 73 73 GLU CA C 73 58.962 58.113 0.849 1
1 860 . 6 1 1 A 73 73 GLU CB C 73 29.155 28.202 0.953 1
1 862 . 6 1 1 A 73 73 GLU N N 73 129.624 122.289 7.335 1
1 863 . 6 1 1 A 74 74 ASN H H 74 8.700 7.956 0.744 1
1 864 . 6 1 1 A 74 74 ASN HA H 74 4.550 4.547 0.003 1
1 869 . 6 1 1 A 74 74 ASN C C 74 176.190 176.115 0.075 1
1 870 . 6 1 1 A 74 74 ASN CA C 74 54.932 54.568 0.364 1
1 871 . 6 1 1 A 74 74 ASN CB C 74 38.113 38.639 -0.526 1
1 872 . 6 1 1 A 74 74 ASN N N 74 116.792 117.512 -0.720 1
1 874 . 6 1 1 A 75 75 LEU H H 75 7.303 7.848 -0.545 1
1 875 . 6 1 1 A 75 75 LEU HA H 75 4.289 4.433 -0.144 1
1 885 . 6 1 1 A 75 75 LEU C C 75 175.821 176.326 -0.505 1
1 886 . 6 1 1 A 75 75 LEU CA C 75 54.106 55.310 -1.204 1
1 887 . 6 1 1 A 75 75 LEU CB C 75 41.239 43.186 -1.947 1
1 891 . 6 1 1 A 75 75 LEU N N 75 117.094 118.848 -1.754 1
1 892 . 6 1 1 A 76 76 VAL H H 76 7.181 7.461 -0.280 1
1 893 . 6 1 1 A 76 76 VAL HA H 76 4.970 5.130 -0.160 1
1 901 . 6 1 1 A 76 76 VAL C C 76 175.702 174.629 1.073 1
1 902 . 6 1 1 A 76 76 VAL CA C 76 61.733 60.166 1.567 1
1 903 . 6 1 1 A 76 76 VAL CB C 76 31.822 33.696 -1.874 1
1 905 . 6 1 1 A 76 76 VAL N N 76 124.716 118.945 5.771 1
1 906 . 6 1 1 A 77 77 GLN H H 77 8.791 8.494 0.297 1
1 907 . 6 1 1 A 77 77 GLN HA H 77 4.695 4.985 -0.290 1
1 914 . 6 1 1 A 77 77 GLN C C 77 173.553 173.299 0.254 1
1 915 . 6 1 1 A 77 77 GLN CA C 77 54.038 54.453 -0.415 1
1 916 . 6 1 1 A 77 77 GLN CB C 77 33.018 31.643 1.375 1
1 918 . 6 1 1 A 77 77 GLN N N 77 124.898 125.721 -0.823 1
1 920 . 6 1 1 A 78 78 ARG H H 78 8.530 8.546 -0.016 1
1 921 . 6 1 1 A 78 78 ARG HA H 78 5.107 5.267 -0.160 1
1 928 . 6 1 1 A 78 78 ARG C C 78 176.182 175.249 0.933 1
1 929 . 6 1 1 A 78 78 ARG CA C 78 55.355 54.873 0.482 1
1 930 . 6 1 1 A 78 78 ARG CB C 78 31.150 31.896 -0.746 1
1 933 . 6 1 1 A 78 78 ARG N N 78 123.413 119.438 3.975 1
1 934 . 6 1 1 A 79 79 VAL H H 79 9.300 8.515 0.785 1
1 935 . 6 1 1 A 79 79 VAL HA H 79 4.824 4.536 0.288 1
1 943 . 6 1 1 A 79 79 VAL CA C 79 58.731 58.733 -0.002 1
1 944 . 6 1 1 A 79 79 VAL CB C 79 34.836 33.608 1.228 1
1 947 . 6 1 1 A 79 79 VAL N N 79 125.252 124.775 0.477 1
1 948 . 6 1 1 A 80 80 PRO HA H 80 4.339 4.743 -0.404 1
1 955 . 6 1 1 A 80 80 PRO C C 80 176.902 177.815 -0.913 1
1 956 . 6 1 1 A 80 80 PRO CA C 80 62.969 63.103 -0.134 1
1 957 . 6 1 1 A 80 80 PRO CB C 80 32.431 32.008 0.423 1
1 960 . 6 1 1 A 81 81 LYS H H 81 7.816 8.756 -0.940 1
1 961 . 6 1 1 A 81 81 LYS HA H 81 3.790 4.111 -0.321 1
1 970 . 6 1 1 A 81 81 LYS C C 81 177.808 178.714 -0.906 1
1 971 . 6 1 1 A 81 81 LYS CA C 81 59.874 59.325 0.549 1
1 972 . 6 1 1 A 81 81 LYS CB C 81 32.670 32.120 0.550 1
1 976 . 6 1 1 A 81 81 LYS N N 81 120.948 124.129 -3.181 1
1 977 . 6 1 1 A 82 82 ASP H H 82 8.069 8.174 -0.105 1
1 978 . 6 1 1 A 82 82 ASP HA H 82 4.243 4.433 -0.190 1
1 981 . 6 1 1 A 82 82 ASP C C 82 177.157 178.865 -1.708 1
1 982 . 6 1 1 A 82 82 ASP CA C 82 55.527 56.512 -0.985 1
1 983 . 6 1 1 A 82 82 ASP CB C 82 40.005 40.801 -0.796 1
1 984 . 6 1 1 A 82 82 ASP N N 82 116.004 119.950 -3.946 1
1 985 . 6 1 1 A 83 83 VAL H H 83 7.150 7.737 -0.587 1
1 986 . 6 1 1 A 83 83 VAL HA H 83 3.719 3.533 0.186 1
1 994 . 6 1 1 A 83 83 VAL C C 83 176.346 176.529 -0.183 1
1 995 . 6 1 1 A 83 83 VAL CA C 83 63.868 65.759 -1.891 1
1 996 . 6 1 1 A 83 83 VAL CB C 83 31.689 31.497 0.192 1
1 999 . 6 1 1 A 83 83 VAL N N 83 117.199 118.686 -1.487 1
1 1000 . 6 1 1 A 84 84 PHE H H 84 7.365 7.603 -0.238 1
1 1001 . 6 1 1 A 84 84 PHE HA H 84 4.389 4.650 -0.261 1
1 1009 . 6 1 1 A 84 84 PHE C C 84 175.265 176.100 -0.835 1
1 1010 . 6 1 1 A 84 84 PHE CA C 84 57.210 56.825 0.385 1
1 1011 . 6 1 1 A 84 84 PHE CB C 84 38.968 38.086 0.882 1
1 1015 . 6 1 1 A 84 84 PHE N N 84 119.897 116.981 2.916 1
1 1016 . 6 1 1 A 85 85 MET H H 85 7.765 7.830 -0.065 1
1 1017 . 6 1 1 A 85 85 MET HA H 85 4.277 4.275 0.002 1
1 1025 . 6 1 1 A 85 85 MET C C 85 176.856 177.246 -0.390 1
1 1026 . 6 1 1 A 85 85 MET CA C 85 56.389 57.655 -1.266 1
1 1027 . 6 1 1 A 85 85 MET CB C 85 32.715 32.471 0.244 1
1 1030 . 6 1 1 A 85 85 MET N N 85 121.131 119.236 1.895 1
1 1031 . 6 1 1 A 86 86 GLY H H 86 8.499 8.161 0.338 1
1 1032 . 6 1 1 A 86 86 GLY HA2 H 86 3.928 3.954 -0.026 1
1 1033 . 6 1 1 A 86 86 GLY HA3 H 86 3.793 3.955 -0.162 1
1 1034 . 6 1 1 A 86 86 GLY C C 86 174.168 174.095 0.073 1
1 1035 . 6 1 1 A 86 86 GLY CA C 86 45.637 45.248 0.389 1
1 1036 . 6 1 1 A 86 86 GLY N N 86 111.268 108.016 3.252 1
1 1037 . 6 1 1 A 87 87 VAL H H 87 7.564 7.778 -0.214 1
1 1038 . 6 1 1 A 87 87 VAL HA H 87 4.083 4.157 -0.074 1
1 1046 . 6 1 1 A 87 87 VAL C C 87 175.649 176.184 -0.535 1
1 1047 . 6 1 1 A 87 87 VAL CA C 87 61.809 61.969 -0.160 1
1 1048 . 6 1 1 A 87 87 VAL CB C 87 32.667 32.251 0.416 1
1 1051 . 6 1 1 A 87 87 VAL N N 87 118.839 120.332 -1.493 1
1 1052 . 6 1 1 A 88 88 ASP H H 88 8.270 8.775 -0.505 1
1 1053 . 6 1 1 A 88 88 ASP HA H 88 4.421 4.370 0.051 1
1 1056 . 6 1 1 A 88 88 ASP C C 88 175.977 175.381 0.596 1
1 1057 . 6 1 1 A 88 88 ASP CA C 88 55.655 57.072 -1.417 1
1 1058 . 6 1 1 A 88 88 ASP CB C 88 41.364 41.249 0.115 1
1 1059 . 6 1 1 A 88 88 ASP N N 88 124.401 124.714 -0.313 1
1 1060 . 6 1 1 A 89 89 GLU H H 89 7.833 7.929 -0.096 1
1 1061 . 6 1 1 A 89 89 GLU HA H 89 4.206 4.724 -0.518 1
1 1066 . 6 1 1 A 89 89 GLU C C 89 174.912 175.501 -0.589 1
1 1067 . 6 1 1 A 89 89 GLU CA C 89 55.739 55.181 0.558 1
1 1068 . 6 1 1 A 89 89 GLU CB C 89 30.603 31.522 -0.919 1
1 1070 . 6 1 1 A 89 89 GLU N N 89 119.378 115.832 3.546 1
1 1071 . 6 1 1 A 90 90 LEU H H 90 8.051 8.729 -0.678 1
1 1072 . 6 1 1 A 90 90 LEU HA H 90 4.127 4.336 -0.209 1
1 1082 . 6 1 1 A 90 90 LEU C C 90 175.753 176.037 -0.284 1
1 1083 . 6 1 1 A 90 90 LEU CA C 90 54.929 55.566 -0.637 1
1 1084 . 6 1 1 A 90 90 LEU CB C 90 42.710 41.258 1.452 1
1 1088 . 6 1 1 A 90 90 LEU N N 90 124.432 126.421 -1.989 1
1 1089 . 6 1 1 A 91 91 GLN H H 91 7.341 8.832 -1.491 1
1 1090 . 6 1 1 A 91 91 GLN HA H 91 4.546 4.973 -0.427 1
1 1097 . 6 1 1 A 91 91 GLN C C 91 174.655 174.543 0.112 1
1 1098 . 6 1 1 A 91 91 GLN CA C 91 53.671 54.004 -0.333 1
1 1099 . 6 1 1 A 91 91 GLN CB C 91 32.850 32.491 0.359 1
1 1101 . 6 1 1 A 91 91 GLN N N 91 120.186 125.991 -5.805 1
1 1103 . 6 1 1 A 92 92 VAL H H 92 8.442 8.477 -0.035 1
1 1104 . 6 1 1 A 92 92 VAL HA H 92 3.278 3.744 -0.466 1
1 1112 . 6 1 1 A 92 92 VAL C C 92 177.098 177.232 -0.134 1
1 1113 . 6 1 1 A 92 92 VAL CA C 92 64.953 64.680 0.273 1
1 1114 . 6 1 1 A 92 92 VAL CB C 92 31.601 31.692 -0.091 1
1 1117 . 6 1 1 A 92 92 VAL N N 92 121.899 123.475 -1.576 1
1 1118 . 6 1 1 A 93 93 GLY H H 93 9.002 9.405 -0.403 1
1 1119 . 6 1 1 A 93 93 GLY HA2 H 93 4.327 3.948 0.379 1
1 1120 . 6 1 1 A 93 93 GLY HA3 H 93 3.770 3.963 -0.193 1
1 1121 . 6 1 1 A 93 93 GLY C C 93 174.547 174.146 0.401 1
1 1122 . 6 1 1 A 93 93 GLY CA C 93 44.446 45.130 -0.684 1
1 1123 . 6 1 1 A 93 93 GLY N N 93 116.485 115.120 1.365 1
1 1124 . 6 1 1 A 94 94 MET H H 94 7.445 7.857 -0.412 1
1 1125 . 6 1 1 A 94 94 MET HA H 94 4.182 4.529 -0.347 1
1 1133 . 6 1 1 A 94 94 MET C C 94 174.531 175.139 -0.608 1
1 1134 . 6 1 1 A 94 94 MET CA C 94 57.193 55.373 1.820 1
1 1135 . 6 1 1 A 94 94 MET CB C 94 34.474 33.317 1.157 1
1 1138 . 6 1 1 A 94 94 MET N N 94 120.304 120.367 -0.063 1
1 1139 . 6 1 1 A 95 95 ARG H H 95 8.169 8.626 -0.457 1
1 1140 . 6 1 1 A 95 95 ARG HA H 95 5.343 4.792 0.551 1
1 1147 . 6 1 1 A 95 95 ARG C C 95 175.593 175.047 0.546 1
1 1148 . 6 1 1 A 95 95 ARG CA C 95 54.898 54.548 0.350 1
1 1149 . 6 1 1 A 95 95 ARG CB C 95 32.928 33.082 -0.154 1
1 1152 . 6 1 1 A 95 95 ARG N N 95 122.066 122.789 -0.723 1
1 1153 . 6 1 1 A 96 96 PHE H H 96 8.440 7.970 0.470 1
1 1154 . 6 1 1 A 96 96 PHE HA H 96 4.738 5.055 -0.317 1
1 1162 . 6 1 1 A 96 96 PHE C C 96 173.273 171.981 1.292 1
1 1163 . 6 1 1 A 96 96 PHE CA C 96 56.174 56.175 -0.001 1
1 1164 . 6 1 1 A 96 96 PHE CB C 96 42.474 40.556 1.918 1
1 1168 . 6 1 1 A 96 96 PHE N N 96 119.938 118.818 1.120 1
1 1169 . 6 1 1 A 97 97 LEU H H 97 8.459 8.704 -0.245 1
1 1170 . 6 1 1 A 97 97 LEU HA H 97 4.625 4.931 -0.306 1
1 1180 . 6 1 1 A 97 97 LEU C C 97 175.664 175.113 0.551 1
1 1181 . 6 1 1 A 97 97 LEU CA C 97 53.547 54.679 -1.132 1
1 1182 . 6 1 1 A 97 97 LEU CB C 97 42.379 44.089 -1.710 1
1 1186 . 6 1 1 A 97 97 LEU N N 97 122.014 122.010 0.004 1
1 1187 . 6 1 1 A 98 98 ALA H H 98 8.812 9.038 -0.226 1
1 1188 . 6 1 1 A 98 98 ALA HA H 98 4.520 5.555 -1.035 1
1 1192 . 6 1 1 A 98 98 ALA C C 98 176.373 176.091 0.282 1
1 1193 . 6 1 1 A 98 98 ALA CA C 98 50.639 50.166 0.473 1
1 1194 . 6 1 1 A 98 98 ALA CB C 98 20.939 22.483 -1.544 1
1 1195 . 6 1 1 A 98 98 ALA N N 98 129.296 129.772 -0.476 1
1 1196 . 6 1 1 A 99 99 GLU H H 99 8.504 8.770 -0.266 1
1 1197 . 6 1 1 A 99 99 GLU HA H 99 4.150 4.862 -0.712 1
1 1202 . 6 1 1 A 99 99 GLU C C 99 176.351 176.447 -0.096 1
1 1203 . 6 1 1 A 99 99 GLU CA C 99 56.830 55.951 0.879 1
1 1204 . 6 1 1 A 99 99 GLU CB C 99 29.639 30.815 -1.176 1
1 1206 . 6 1 1 A 99 99 GLU N N 99 121.993 121.526 0.467 1
1 1207 . 6 1 1 A 100 100 THR H H 100 7.393 8.444 -1.051 1
1 1208 . 6 1 1 A 100 100 THR HA H 100 4.819 4.820 -0.001 1
1 1213 . 6 1 1 A 100 100 THR C C 100 175.882 174.472 1.410 1
1 1214 . 6 1 1 A 100 100 THR CA C 100 60.329 60.345 -0.016 1
1 1215 . 6 1 1 A 100 100 THR CB C 100 73.452 71.697 1.755 1
1 1217 . 6 1 1 A 100 100 THR N N 100 115.598 115.183 0.415 1
1 1218 . 6 1 1 A 101 101 ASP H H 101 8.988 8.883 0.105 1
1 1219 . 6 1 1 A 101 101 ASP HA H 101 4.357 4.351 0.006 1
1 1222 . 6 1 1 A 101 101 ASP C C 101 176.848 177.283 -0.435 1
1 1223 . 6 1 1 A 101 101 ASP CA C 101 56.493 57.318 -0.825 1
1 1224 . 6 1 1 A 101 101 ASP CB C 101 39.973 40.397 -0.424 1
1 1225 . 6 1 1 A 101 101 ASP N N 101 121.468 121.641 -0.173 1
1 1226 . 6 1 1 A 102 102 GLN H H 102 7.937 7.476 0.461 1
1 1227 . 6 1 1 A 102 102 GLN HA H 102 4.415 4.391 0.024 1
1 1234 . 6 1 1 A 102 102 GLN C C 102 175.252 175.959 -0.707 1
1 1235 . 6 1 1 A 102 102 GLN CA C 102 55.097 55.516 -0.419 1
1 1236 . 6 1 1 A 102 102 GLN CB C 102 29.121 28.571 0.550 1
1 1238 . 6 1 1 A 102 102 GLN N N 102 117.199 115.399 1.800 1
1 1240 . 6 1 1 A 103 103 GLY H H 103 7.431 8.164 -0.733 1
1 1241 . 6 1 1 A 103 103 GLY HA2 H 103 4.504 4.314 0.190 1
1 1242 . 6 1 1 A 103 103 GLY HA3 H 103 3.868 4.316 -0.448 1
1 1243 . 6 1 1 A 103 103 GLY CA C 103 44.051 44.346 -0.295 1
1 1244 . 6 1 1 A 103 103 GLY N N 103 110.056 107.457 2.599 1
1 1245 . 6 1 1 A 104 104 PRO HA H 104 5.057 5.138 -0.081 1
1 1252 . 6 1 1 A 104 104 PRO C C 104 177.873 175.605 2.268 1
1 1253 . 6 1 1 A 104 104 PRO CA C 104 62.464 63.058 -0.594 1
1 1254 . 6 1 1 A 104 104 PRO CB C 104 31.939 32.109 -0.170 1
1 1257 . 6 1 1 A 105 105 VAL H H 105 8.960 9.220 -0.260 1
1 1258 . 6 1 1 A 105 105 VAL HA H 105 4.678 4.472 0.206 1
1 1266 . 6 1 1 A 105 105 VAL CA C 105 58.474 59.184 -0.710 1
1 1267 . 6 1 1 A 105 105 VAL CB C 105 35.512 34.970 0.542 1
1 1270 . 6 1 1 A 105 105 VAL N N 105 123.240 123.231 0.009 1
1 1271 . 6 1 1 A 106 106 PRO HA H 106 4.777 4.791 -0.014 1
1 1278 . 6 1 1 A 106 106 PRO C C 106 176.823 176.317 0.506 1
1 1279 . 6 1 1 A 106 106 PRO CA C 106 62.508 62.357 0.151 1
1 1280 . 6 1 1 A 106 106 PRO CB C 106 31.650 31.585 0.065 1
1 1283 . 6 1 1 A 107 107 VAL H H 107 8.835 7.729 1.106 1
1 1284 . 6 1 1 A 107 107 VAL HA H 107 4.719 4.986 -0.267 1
1 1292 . 6 1 1 A 107 107 VAL C C 107 173.661 173.400 0.261 1
1 1293 . 6 1 1 A 107 107 VAL CA C 107 59.026 59.201 -0.175 1
1 1294 . 6 1 1 A 107 107 VAL CB C 107 36.406 35.243 1.163 1
1 1297 . 6 1 1 A 107 107 VAL N N 107 117.474 117.143 0.331 1
1 1298 . 6 1 1 A 108 108 GLU H H 108 7.698 8.705 -1.007 1
1 1299 . 6 1 1 A 108 108 GLU HA H 108 5.133 4.871 0.262 1
1 1304 . 6 1 1 A 108 108 GLU C C 108 176.394 175.134 1.260 1
1 1305 . 6 1 1 A 108 108 GLU CA C 108 53.808 54.406 -0.598 1
1 1306 . 6 1 1 A 108 108 GLU CB C 108 33.984 33.430 0.554 1
1 1308 . 6 1 1 A 108 108 GLU N N 108 120.646 120.123 0.523 1
1 1309 . 6 1 1 A 109 109 ILE H H 109 8.690 8.705 -0.015 1
1 1310 . 6 1 1 A 109 109 ILE HA H 109 4.484 4.308 0.176 1
1 1320 . 6 1 1 A 109 109 ILE C C 109 177.313 177.205 0.108 1
1 1321 . 6 1 1 A 109 109 ILE CA C 109 61.789 61.835 -0.046 1
1 1322 . 6 1 1 A 109 109 ILE CB C 109 36.628 37.662 -1.034 1
1 1326 . 6 1 1 A 109 109 ILE N N 109 124.739 127.544 -2.805 1
1 1327 . 6 1 1 A 110 110 THR H H 110 9.300 9.675 -0.375 1
1 1328 . 6 1 1 A 110 110 THR HA H 110 4.547 4.607 -0.060 1
1 1333 . 6 1 1 A 110 110 THR C C 110 174.904 174.516 0.388 1
1 1334 . 6 1 1 A 110 110 THR CA C 110 62.260 61.316 0.944 1
1 1335 . 6 1 1 A 110 110 THR CB C 110 69.100 69.694 -0.594 1
1 1337 . 6 1 1 A 110 110 THR N N 110 122.544 118.416 4.128 1
1 1338 . 6 1 1 A 111 111 ALA H H 111 7.673 7.125 0.548 1
1 1339 . 6 1 1 A 111 111 ALA HA H 111 4.367 4.630 -0.263 1
1 1343 . 6 1 1 A 111 111 ALA C C 111 175.019 174.986 0.033 1
1 1344 . 6 1 1 A 111 111 ALA CA C 111 53.125 51.820 1.305 1
1 1345 . 6 1 1 A 111 111 ALA CB C 111 21.539 22.524 -0.985 1
1 1346 . 6 1 1 A 111 111 ALA N N 111 123.153 121.055 2.098 1
1 1347 . 6 1 1 A 112 112 VAL H H 112 8.707 8.473 0.234 1
1 1348 . 6 1 1 A 112 112 VAL HA H 112 4.129 4.540 -0.411 1
1 1356 . 6 1 1 A 112 112 VAL C C 112 174.755 175.133 -0.378 1
1 1357 . 6 1 1 A 112 112 VAL CA C 112 62.898 61.582 1.316 1
1 1358 . 6 1 1 A 112 112 VAL CB C 112 33.379 34.431 -1.052 1
1 1361 . 6 1 1 A 112 112 VAL N N 112 122.369 120.126 2.243 1
1 1362 . 6 1 1 A 113 113 GLU H H 113 8.144 8.890 -0.746 1
1 1363 . 6 1 1 A 113 113 GLU HA H 113 4.645 4.495 0.150 1
1 1368 . 6 1 1 A 113 113 GLU C C 113 175.102 177.756 -2.654 1
1 1369 . 6 1 1 A 113 113 GLU CA C 113 54.080 55.453 -1.373 1
1 1370 . 6 1 1 A 113 113 GLU CB C 113 31.234 30.783 0.451 1
1 1372 . 6 1 1 A 113 113 GLU N N 113 127.435 127.036 0.399 1
1 1373 . 6 1 1 A 114 114 ASP H H 114 8.472 8.815 -0.343 1
1 1374 . 6 1 1 A 114 114 ASP HA H 114 4.209 4.236 -0.027 1
1 1377 . 6 1 1 A 114 114 ASP C C 114 177.679 177.269 0.410 1
1 1378 . 6 1 1 A 114 114 ASP CA C 114 58.334 57.806 0.528 1
1 1379 . 6 1 1 A 114 114 ASP CB C 114 40.347 41.183 -0.836 1
1 1380 . 6 1 1 A 114 114 ASP N N 114 119.844 122.829 -2.985 1
1 1381 . 6 1 1 A 115 115 ASP H H 115 8.475 8.013 0.462 1
1 1382 . 6 1 1 A 115 115 ASP HA H 115 4.848 4.816 0.032 1
1 1385 . 6 1 1 A 115 115 ASP C C 115 175.968 175.530 0.438 1
1 1386 . 6 1 1 A 115 115 ASP CA C 115 53.290 54.647 -1.357 1
1 1387 . 6 1 1 A 115 115 ASP CB C 115 42.080 42.526 -0.446 1
1 1388 . 6 1 1 A 115 115 ASP N N 115 114.364 116.385 -2.021 1
1 1389 . 6 1 1 A 116 116 HIS H H 116 7.185 7.478 -0.293 1
1 1390 . 6 1 1 A 116 116 HIS HA H 116 5.106 5.378 -0.272 1
1 1395 . 6 1 1 A 116 116 HIS C C 116 172.393 173.038 -0.645 1
1 1396 . 6 1 1 A 116 116 HIS CA C 116 56.099 54.370 1.729 1
1 1397 . 6 1 1 A 116 116 HIS CB C 116 33.289 32.988 0.301 1
1 1400 . 6 1 1 A 116 116 HIS N N 116 117.212 115.421 1.791 1
1 1401 . 6 1 1 A 117 117 VAL H H 117 9.130 9.049 0.081 1
1 1402 . 6 1 1 A 117 117 VAL HA H 117 4.649 4.979 -0.330 1
1 1410 . 6 1 1 A 117 117 VAL C C 117 173.832 174.697 -0.865 1
1 1411 . 6 1 1 A 117 117 VAL CA C 117 59.555 60.127 -0.572 1
1 1412 . 6 1 1 A 117 117 VAL CB C 117 34.676 34.472 0.204 1
1 1415 . 6 1 1 A 117 117 VAL N N 117 114.046 117.010 -2.964 1
1 1416 . 6 1 1 A 118 118 VAL H H 118 8.680 8.958 -0.278 1
1 1417 . 6 1 1 A 118 118 VAL HA H 118 4.747 4.968 -0.221 1
1 1425 . 6 1 1 A 118 118 VAL C C 118 175.836 175.153 0.683 1
1 1426 . 6 1 1 A 118 118 VAL CA C 118 62.159 60.619 1.540 1
1 1427 . 6 1 1 A 118 118 VAL CB C 118 31.887 34.219 -2.332 1
1 1430 . 6 1 1 A 118 118 VAL N N 118 125.095 121.499 3.596 1
1 1431 . 6 1 1 A 119 119 VAL H H 119 9.057 8.959 0.098 1
1 1432 . 6 1 1 A 119 119 VAL HA H 119 5.231 5.138 0.093 1
1 1440 . 6 1 1 A 119 119 VAL C C 119 173.747 174.246 -0.499 1
1 1441 . 6 1 1 A 119 119 VAL CA C 119 58.326 59.829 -1.503 1
1 1442 . 6 1 1 A 119 119 VAL CB C 119 34.387 34.175 0.212 1
1 1445 . 6 1 1 A 119 119 VAL N N 119 121.494 122.496 -1.002 1
1 1446 . 6 1 1 A 120 120 ASP H H 120 8.926 8.642 0.284 1
1 1447 . 6 1 1 A 120 120 ASP HA H 120 5.174 4.988 0.186 1
1 1450 . 6 1 1 A 120 120 ASP C C 120 177.982 176.021 1.961 1
1 1451 . 6 1 1 A 120 120 ASP CA C 120 52.749 52.992 -0.243 1
1 1452 . 6 1 1 A 120 120 ASP CB C 120 44.542 42.892 1.650 1
1 1453 . 6 1 1 A 120 120 ASP N N 120 121.454 125.670 -4.216 1
1 1454 . 6 1 1 A 121 121 GLY H H 121 8.674 9.014 -0.340 1
1 1455 . 6 1 1 A 121 121 GLY HA2 H 121 4.702 3.877 0.825 1
1 1456 . 6 1 1 A 121 121 GLY HA3 H 121 3.573 3.884 -0.311 1
1 1457 . 6 1 1 A 121 121 GLY C C 121 175.041 173.952 1.089 1
1 1458 . 6 1 1 A 121 121 GLY CA C 121 45.319 45.145 0.174 1
1 1459 . 6 1 1 A 121 121 GLY N N 121 114.850 114.136 0.714 1
1 1460 . 6 1 1 A 122 122 ASN H H 122 8.762 7.688 1.074 1
1 1461 . 6 1 1 A 122 122 ASN HA H 122 4.183 5.290 -1.107 1
1 1466 . 6 1 1 A 122 122 ASN C C 122 175.406 173.868 1.538 1
1 1467 . 6 1 1 A 122 122 ASN CA C 122 54.686 50.894 3.792 1
1 1468 . 6 1 1 A 122 122 ASN CB C 122 40.139 41.737 -1.598 1
1 1469 . 6 1 1 A 122 122 ASN N N 122 121.618 117.143 4.475 1
1 1471 . 6 1 1 A 123 123 HIS H H 123 8.929 8.790 0.139 1
1 1472 . 6 1 1 A 123 123 HIS HA H 123 4.005 5.129 -1.124 1
1 1477 . 6 1 1 A 123 123 HIS C C 123 177.325 176.008 1.317 1
1 1478 . 6 1 1 A 123 123 HIS CA C 123 58.768 54.666 4.102 1
1 1479 . 6 1 1 A 123 123 HIS CB C 123 31.172 32.520 -1.348 1
1 1482 . 6 1 1 A 123 123 HIS N N 123 124.165 116.736 7.429 1
1 1483 . 6 1 1 A 124 124 MET H H 124 8.266 9.188 -0.922 1
1 1484 . 6 1 1 A 124 124 MET HA H 124 4.048 4.251 -0.203 1
1 1492 . 6 1 1 A 124 124 MET CA C 124 58.994 57.460 1.534 1
1 1493 . 6 1 1 A 124 124 MET CB C 124 32.777 32.244 0.533 1
1 1496 . 6 1 1 A 124 124 MET N N 124 129.443 122.040 7.403 1
1 1497 . 6 1 1 A 125 125 LEU H H 125 8.094 7.706 0.388 1
1 1498 . 6 1 1 A 125 125 LEU HA H 125 4.455 4.402 0.053 1
1 1504 . 6 1 1 A 125 125 LEU C C 125 177.860 176.648 1.212 1
1 1505 . 6 1 1 A 125 125 LEU CA C 125 53.517 54.291 -0.774 1
1 1506 . 6 1 1 A 125 125 LEU CB C 125 42.462 41.296 1.166 1
1 1509 . 6 1 1 A 126 126 ALA H H 126 8.089 7.376 0.713 1
1 1510 . 6 1 1 A 126 126 ALA HA H 126 3.966 4.390 -0.424 1
1 1514 . 6 1 1 A 126 126 ALA C C 126 179.135 178.416 0.719 1
1 1515 . 6 1 1 A 126 126 ALA CA C 126 54.170 53.225 0.945 1
1 1516 . 6 1 1 A 126 126 ALA CB C 126 18.687 19.465 -0.778 1
1 1517 . 6 1 1 A 126 126 ALA N N 126 126.095 123.102 2.993 1
1 1518 . 6 1 1 A 127 127 GLY H H 127 9.499 9.058 0.441 1
1 1519 . 6 1 1 A 127 127 GLY HA2 H 127 4.207 3.975 0.232 1
1 1520 . 6 1 1 A 127 127 GLY HA3 H 127 3.598 4.004 -0.406 1
1 1521 . 6 1 1 A 127 127 GLY C C 127 173.568 174.785 -1.217 1
1 1522 . 6 1 1 A 127 127 GLY CA C 127 45.846 45.116 0.730 1
1 1523 . 6 1 1 A 127 127 GLY N N 127 110.073 110.571 -0.498 1
1 1524 . 6 1 1 A 128 128 GLN H H 128 7.514 7.935 -0.421 1
1 1525 . 6 1 1 A 128 128 GLN HA H 128 4.496 4.360 0.136 1
1 1532 . 6 1 1 A 128 128 GLN C C 128 174.790 174.976 -0.186 1
1 1533 . 6 1 1 A 128 128 GLN CA C 128 54.948 55.927 -0.979 1
1 1534 . 6 1 1 A 128 128 GLN CB C 128 29.181 30.021 -0.840 1
1 1536 . 6 1 1 A 128 128 GLN N N 128 117.842 120.380 -2.538 1
1 1538 . 6 1 1 A 129 129 ASN H H 129 8.689 9.154 -0.465 1
1 1539 . 6 1 1 A 129 129 ASN HA H 129 4.857 5.323 -0.466 1
1 1544 . 6 1 1 A 129 129 ASN C C 129 174.325 174.281 0.044 1
1 1545 . 6 1 1 A 129 129 ASN CA C 129 52.568 52.365 0.203 1
1 1546 . 6 1 1 A 129 129 ASN CB C 129 38.035 40.732 -2.697 1
1 1547 . 6 1 1 A 129 129 ASN N N 129 122.739 118.330 4.409 1
1 1549 . 6 1 1 A 130 130 LEU H H 130 8.742 8.460 0.282 1
1 1550 . 6 1 1 A 130 130 LEU HA H 130 4.918 4.872 0.046 1
1 1560 . 6 1 1 A 130 130 LEU C C 130 176.095 175.440 0.655 1
1 1561 . 6 1 1 A 130 130 LEU CA C 130 53.691 52.962 0.729 1
1 1562 . 6 1 1 A 130 130 LEU CB C 130 46.814 45.212 1.602 1
1 1566 . 6 1 1 A 130 130 LEU N N 130 121.242 119.732 1.510 1
1 1567 . 6 1 1 A 131 131 LYS H H 131 8.809 9.185 -0.376 1
1 1568 . 6 1 1 A 131 131 LYS HA H 131 4.918 4.897 0.021 1
1 1577 . 6 1 1 A 131 131 LYS C C 131 175.508 175.092 0.416 1
1 1578 . 6 1 1 A 131 131 LYS CA C 131 55.333 54.624 0.709 1
1 1579 . 6 1 1 A 131 131 LYS CB C 131 33.962 34.712 -0.750 1
1 1583 . 6 1 1 A 131 131 LYS N N 131 122.071 121.505 0.566 1
1 1584 . 6 1 1 A 132 132 PHE H H 132 9.436 9.333 0.103 1
1 1585 . 6 1 1 A 132 132 PHE HA H 132 5.427 5.425 0.002 1
1 1593 . 6 1 1 A 132 132 PHE C C 132 175.715 174.520 1.195 1
1 1594 . 6 1 1 A 132 132 PHE CA C 132 56.665 56.430 0.235 1
1 1595 . 6 1 1 A 132 132 PHE CB C 132 42.263 42.306 -0.043 1
1 1599 . 6 1 1 A 132 132 PHE N N 132 125.247 123.124 2.123 1
1 1600 . 6 1 1 A 133 133 ASN H H 133 8.680 9.047 -0.367 1
1 1601 . 6 1 1 A 133 133 ASN HA H 133 5.249 5.349 -0.100 1
1 1606 . 6 1 1 A 133 133 ASN C C 133 174.433 174.160 0.273 1
1 1607 . 6 1 1 A 133 133 ASN CA C 133 53.952 52.876 1.076 1
1 1608 . 6 1 1 A 133 133 ASN CB C 133 41.492 39.434 2.058 1
1 1609 . 6 1 1 A 133 133 ASN N N 133 122.056 121.670 0.386 1
1 1611 . 6 1 1 A 134 134 VAL H H 134 8.762 8.637 0.125 1
1 1612 . 6 1 1 A 134 134 VAL HA H 134 4.805 4.701 0.104 1
1 1620 . 6 1 1 A 134 134 VAL C C 134 173.555 175.034 -1.479 1
1 1621 . 6 1 1 A 134 134 VAL CA C 134 60.374 61.318 -0.944 1
1 1622 . 6 1 1 A 134 134 VAL CB C 134 34.848 33.159 1.689 1
1 1625 . 6 1 1 A 134 134 VAL N N 134 122.014 125.911 -3.897 1
1 1626 . 6 1 1 A 135 135 GLU H H 135 8.869 9.756 -0.887 1
1 1627 . 6 1 1 A 135 135 GLU HA H 135 5.240 4.924 0.316 1
1 1632 . 6 1 1 A 135 135 GLU C C 135 175.578 175.223 0.355 1
1 1633 . 6 1 1 A 135 135 GLU CA C 135 54.376 55.250 -0.874 1
1 1634 . 6 1 1 A 135 135 GLU CB C 135 33.264 30.904 2.360 1
1 1636 . 6 1 1 A 135 135 GLU N N 135 125.197 126.605 -1.408 1
1 1637 . 6 1 1 A 136 136 VAL H H 136 8.270 8.535 -0.265 1
1 1638 . 6 1 1 A 136 136 VAL HA H 136 4.066 4.288 -0.222 1
1 1646 . 6 1 1 A 136 136 VAL C C 136 176.119 175.636 0.483 1
1 1647 . 6 1 1 A 136 136 VAL CA C 136 62.910 63.118 -0.208 1
1 1648 . 6 1 1 A 136 136 VAL CB C 136 30.573 32.311 -1.738 1
1 1651 . 6 1 1 A 136 136 VAL N N 136 126.347 127.816 -1.469 1
1 1652 . 6 1 1 A 137 137 VAL H H 137 8.865 8.653 0.212 1
1 1653 . 6 1 1 A 137 137 VAL HA H 137 4.022 3.972 0.050 1
1 1661 . 6 1 1 A 137 137 VAL C C 137 175.208 176.089 -0.881 1
1 1662 . 6 1 1 A 137 137 VAL CA C 137 64.424 64.487 -0.063 1
1 1663 . 6 1 1 A 137 137 VAL CB C 137 32.943 32.415 0.528 1
1 1666 . 6 1 1 A 137 137 VAL N N 137 130.810 130.406 0.404 1
1 1667 . 6 1 1 A 138 138 ALA H H 138 7.677 7.468 0.209 1
1 1668 . 6 1 1 A 138 138 ALA HA H 138 4.496 4.652 -0.156 1
1 1672 . 6 1 1 A 138 138 ALA C C 138 174.405 175.158 -0.753 1
1 1673 . 6 1 1 A 138 138 ALA CA C 138 52.556 51.687 0.869 1
1 1674 . 6 1 1 A 138 138 ALA CB C 138 21.874 22.595 -0.721 1
1 1675 . 6 1 1 A 138 138 ALA N N 138 119.194 117.555 1.639 1
1 1676 . 6 1 1 A 139 139 ILE H H 139 8.052 8.381 -0.329 1
1 1677 . 6 1 1 A 139 139 ILE HA H 139 4.640 4.837 -0.197 1
1 1687 . 6 1 1 A 139 139 ILE C C 139 173.734 174.447 -0.713 1
1 1688 . 6 1 1 A 139 139 ILE CA C 139 61.623 60.007 1.616 1
1 1689 . 6 1 1 A 139 139 ILE CB C 139 43.363 41.702 1.661 1
1 1693 . 6 1 1 A 139 139 ILE N N 139 119.307 120.220 -0.913 1
1 1694 . 6 1 1 A 140 140 ARG H H 140 8.912 8.987 -0.075 1
1 1695 . 6 1 1 A 140 140 ARG HA H 140 4.760 4.647 0.113 1
1 1702 . 6 1 1 A 140 140 ARG C C 140 174.181 174.576 -0.395 1
1 1703 . 6 1 1 A 140 140 ARG CA C 140 54.243 54.683 -0.440 1
1 1704 . 6 1 1 A 140 140 ARG CB C 140 33.438 33.984 -0.546 1
1 1707 . 6 1 1 A 140 140 ARG N N 140 122.820 126.846 -4.026 1
1 1708 . 6 1 1 A 141 141 GLU H H 141 8.545 8.467 0.078 1
1 1709 . 6 1 1 A 141 141 GLU HA H 141 4.254 4.214 0.040 1
1 1714 . 6 1 1 A 141 141 GLU C C 141 177.299 176.155 1.144 1
1 1715 . 6 1 1 A 141 141 GLU CA C 141 57.165 56.750 0.415 1
1 1716 . 6 1 1 A 141 141 GLU CB C 141 30.048 29.852 0.196 1
1 1718 . 6 1 1 A 141 141 GLU N N 141 119.458 123.910 -4.452 1
1 1719 . 6 1 1 A 142 142 ALA H H 142 8.380 8.235 0.145 1
1 1720 . 6 1 1 A 142 142 ALA HA H 142 4.388 4.442 -0.054 1
1 1724 . 6 1 1 A 142 142 ALA C C 142 178.495 178.836 -0.341 1
1 1725 . 6 1 1 A 142 142 ALA CA C 142 51.113 52.275 -1.162 1
1 1726 . 6 1 1 A 142 142 ALA CB C 142 21.044 19.549 1.495 1
1 1727 . 6 1 1 A 142 142 ALA N N 142 127.330 127.381 -0.051 1
1 1728 . 6 1 1 A 143 143 THR H H 143 9.502 9.285 0.217 1
1 1729 . 6 1 1 A 143 143 THR HA H 143 4.362 4.788 -0.426 1
1 1734 . 6 1 1 A 143 143 THR C C 143 175.241 175.042 0.199 1
1 1735 . 6 1 1 A 143 143 THR CA C 143 60.541 61.077 -0.536 1
1 1736 . 6 1 1 A 143 143 THR CB C 143 70.879 68.739 2.140 1
1 1738 . 6 1 1 A 143 143 THR N N 143 114.561 111.029 3.532 1
1 1739 . 6 1 1 A 144 144 GLU H H 144 8.787 8.193 0.594 1
1 1740 . 6 1 1 A 144 144 GLU HA H 144 3.817 3.877 -0.060 1
1 1745 . 6 1 1 A 144 144 GLU C C 144 179.490 176.616 2.874 1
1 1746 . 6 1 1 A 144 144 GLU CA C 144 60.102 58.964 1.138 1
1 1747 . 6 1 1 A 144 144 GLU CB C 144 29.338 27.411 1.927 1
1 1749 . 6 1 1 A 144 144 GLU N N 144 120.475 115.316 5.159 1
1 1750 . 6 1 1 A 145 145 GLU H H 145 8.321 8.437 -0.116 1
1 1751 . 6 1 1 A 145 145 GLU HA H 145 3.899 3.824 0.075 1
1 1756 . 6 1 1 A 145 145 GLU C C 145 178.521 179.237 -0.716 1
1 1757 . 6 1 1 A 145 145 GLU CA C 145 59.588 59.098 0.490 1
1 1758 . 6 1 1 A 145 145 GLU CB C 145 29.658 29.156 0.502 1
1 1760 . 6 1 1 A 145 145 GLU N N 145 119.761 119.468 0.293 1
1 1761 . 6 1 1 A 146 146 GLU H H 146 7.514 8.229 -0.715 1
1 1762 . 6 1 1 A 146 146 GLU HA H 146 3.856 4.263 -0.407 1
1 1767 . 6 1 1 A 146 146 GLU C C 146 179.189 179.226 -0.037 1
1 1768 . 6 1 1 A 146 146 GLU CA C 146 59.148 59.164 -0.016 1
1 1769 . 6 1 1 A 146 146 GLU CB C 146 29.834 29.186 0.648 1
1 1771 . 6 1 1 A 146 146 GLU N N 146 121.118 120.831 0.287 1
1 1772 . 6 1 1 A 147 147 LEU H H 147 7.823 8.276 -0.453 1
1 1773 . 6 1 1 A 147 147 LEU HA H 147 3.662 4.150 -0.488 1
1 1783 . 6 1 1 A 147 147 LEU C C 147 179.341 178.708 0.633 1
1 1784 . 6 1 1 A 147 147 LEU CA C 147 57.277 57.802 -0.525 1
1 1785 . 6 1 1 A 147 147 LEU CB C 147 41.239 41.801 -0.562 1
1 1789 . 6 1 1 A 147 147 LEU N N 147 117.199 120.674 -3.475 1
1 1790 . 6 1 1 A 148 148 ALA H H 148 7.788 8.646 -0.858 1
1 1791 . 6 1 1 A 148 148 ALA HA H 148 3.958 4.118 -0.160 1
1 1795 . 6 1 1 A 148 148 ALA C C 148 179.777 179.757 0.020 1
1 1796 . 6 1 1 A 148 148 ALA CA C 148 54.509 54.853 -0.344 1
1 1797 . 6 1 1 A 148 148 ALA CB C 148 18.064 18.229 -0.165 1
1 1798 . 6 1 1 A 148 148 ALA N N 148 121.696 120.631 1.065 1
1 1799 . 6 1 1 A 149 149 HIS H H 149 7.726 7.696 0.030 1
1 1800 . 6 1 1 A 149 149 HIS HA H 149 4.477 4.597 -0.120 1
1 1805 . 6 1 1 A 149 149 HIS C C 149 176.099 175.382 0.717 1
1 1806 . 6 1 1 A 149 149 HIS CA C 149 55.802 56.046 -0.244 1
1 1807 . 6 1 1 A 149 149 HIS CB C 149 30.406 30.210 0.196 1
1 1810 . 6 1 1 A 149 149 HIS N N 149 114.463 113.159 1.304 1
1 1811 . 6 1 1 A 150 150 GLY H H 150 8.076 9.174 -1.098 1
1 1812 . 6 1 1 A 150 150 GLY HA2 H 150 3.927 3.612 0.315 1
1 1813 . 6 1 1 A 150 150 GLY HA3 H 150 3.237 3.668 -0.431 1
1 1814 . 6 1 1 A 150 150 GLY C C 150 173.382 173.370 0.012 1
1 1815 . 6 1 1 A 150 150 GLY CA C 150 46.117 45.580 0.537 1
1 1816 . 6 1 1 A 150 150 GLY N N 150 109.417 108.795 0.622 1
1 1817 . 6 1 1 A 151 151 HIS H H 151 7.518 7.435 0.083 1
1 1818 . 6 1 1 A 151 151 HIS HA H 151 4.563 4.822 -0.259 1
1 1823 . 6 1 1 A 151 151 HIS C C 151 173.157 174.456 -1.299 1
1 1824 . 6 1 1 A 151 151 HIS CA C 151 54.731 54.767 -0.036 1
1 1825 . 6 1 1 A 151 151 HIS CB C 151 31.611 31.203 0.408 1
1 1828 . 6 1 1 A 151 151 HIS N N 151 114.828 114.281 0.547 1
1 1829 . 6 1 1 A 152 152 VAL H H 152 7.931 8.983 -1.052 1
1 1830 . 6 1 1 A 152 152 VAL HA H 152 3.951 3.682 0.269 1
1 1838 . 6 1 1 A 152 152 VAL C C 152 175.848 176.152 -0.304 1
1 1839 . 6 1 1 A 152 152 VAL CA C 152 62.190 66.389 -4.199 1
1 1840 . 6 1 1 A 152 152 VAL CB C 152 32.703 31.741 0.962 1
1 1843 . 6 1 1 A 152 152 VAL N N 152 118.551 120.563 -2.012 1
1 1844 . 6 1 1 A 153 153 HIS H H 153 9.784 7.878 1.906 1
1 1845 . 6 1 1 A 153 153 HIS HA H 153 4.604 4.442 0.162 1
1 1850 . 6 1 1 A 153 153 HIS C C 153 175.795 174.335 1.460 1
1 1851 . 6 1 1 A 153 153 HIS CA C 153 56.753 56.629 0.124 1
1 1852 . 6 1 1 A 153 153 HIS CB C 153 30.325 28.346 1.979 1
1 1855 . 6 1 1 A 153 153 HIS N N 153 127.403 119.137 8.266 1
1 1856 . 6 1 1 A 154 154 GLY H H 154 8.447 8.547 -0.100 1
1 1857 . 6 1 1 A 154 154 GLY HA2 H 154 3.797 3.827 -0.030 1
1 1858 . 6 1 1 A 154 154 GLY HA3 H 154 3.797 3.859 -0.062 1
1 1859 . 6 1 1 A 154 154 GLY C C 154 173.848 174.610 -0.762 1
1 1860 . 6 1 1 A 154 154 GLY CA C 154 45.153 45.053 0.100 1
1 1861 . 6 1 1 A 154 154 GLY N N 154 112.233 109.743 2.490 1
1 1862 . 6 1 1 A 155 155 ALA H H 155 8.074 7.240 0.834 1
1 1863 . 6 1 1 A 155 155 ALA HA H 155 4.101 4.592 -0.491 1
1 1867 . 6 1 1 A 155 155 ALA C C 155 177.651 178.532 -0.881 1
1 1868 . 6 1 1 A 155 155 ALA CA C 155 52.795 52.868 -0.073 1
1 1869 . 6 1 1 A 155 155 ALA CB C 155 19.258 19.686 -0.428 1
1 1870 . 6 1 1 A 155 155 ALA N N 155 124.092 123.474 0.618 1
1 1871 . 6 1 1 A 156 156 HIS H H 156 8.201 7.839 0.362 1
1 1872 . 6 1 1 A 156 156 HIS HA H 156 4.474 4.484 -0.010 1
1 1875 . 6 1 1 A 156 156 HIS C C 156 174.758 175.201 -0.443 1
1 1876 . 6 1 1 A 156 156 HIS CA C 156 55.756 56.745 -0.989 1
1 1877 . 6 1 1 A 156 156 HIS CB C 156 30.060 29.402 0.658 1
1 1878 . 6 1 1 A 156 156 HIS N N 156 118.170 115.806 2.364 1
1 1879 . 6 1 1 A 157 157 ASP H H 157 8.001 7.644 0.357 1
1 1880 . 6 1 1 A 157 157 ASP HA H 157 4.436 4.811 -0.375 1
1 1883 . 6 1 1 A 157 157 ASP CA C 157 54.185 53.130 1.055 1
1 1884 . 6 1 1 A 157 157 ASP CB C 157 41.016 40.552 0.464 1
1 1885 . 6 1 1 A 157 157 ASP N N 157 121.683 118.498 3.185 1
1 1886 . 6 1 1 A 160 160 HIS HA H 160 4.502 4.645 -0.143 1
1 1889 . 6 1 1 A 160 160 HIS C C 160 174.722 174.746 -0.024 1
1 1890 . 6 1 1 A 160 160 HIS CA C 160 55.979 56.262 -0.283 1
1 1891 . 6 1 1 A 160 160 HIS CB C 160 30.058 30.403 -0.345 1
1 1892 . 6 1 1 A 161 161 ASP H H 161 8.270 8.994 -0.724 1
1 1893 . 6 1 1 A 161 161 ASP HA H 161 4.446 4.851 -0.405 1
1 1896 . 6 1 1 A 161 161 ASP C C 161 176.107 177.120 -1.013 1
1 1897 . 6 1 1 A 161 161 ASP CA C 161 54.474 55.099 -0.625 1
1 1898 . 6 1 1 A 161 161 ASP CB C 161 40.820 44.155 -3.335 1
1 1899 . 6 1 1 A 161 161 ASP N N 161 121.957 124.842 -2.885 1
1 1900 . 6 1 1 A 162 162 HIS H H 162 8.212 8.403 -0.191 1
1 1901 . 6 1 1 A 162 162 HIS HA H 162 4.289 4.420 -0.131 1
1 1904 . 6 1 1 A 162 162 HIS C C 162 175.036 175.253 -0.217 1
1 1905 . 6 1 1 A 162 162 HIS CA C 162 56.185 58.360 -2.175 1
1 1906 . 6 1 1 A 162 162 HIS CB C 162 30.108 30.549 -0.441 1
1 1907 . 6 1 1 A 162 162 HIS N N 162 119.766 115.753 4.013 1
1 1908 . 6 1 1 A 163 163 ASP H H 163 8.163 7.835 0.328 1
1 1909 . 6 1 1 A 163 163 ASP HA H 163 4.428 4.561 -0.133 1
1 1912 . 6 1 1 A 163 163 ASP C C 163 176.161 175.889 0.272 1
1 1913 . 6 1 1 A 163 163 ASP CA C 163 54.585 53.798 0.787 1
1 1914 . 6 1 1 A 163 163 ASP CB C 163 40.823 42.012 -1.189 1
1 1915 . 6 1 1 A 163 163 ASP N N 163 121.265 118.764 2.501 1
1 1916 . 6 1 1 A 164 164 HIS H H 164 8.106 8.675 -0.569 1
1 1917 . 6 1 1 A 164 164 HIS HA H 164 4.422 4.786 -0.364 1
1 1920 . 6 1 1 A 164 164 HIS C C 164 174.904 174.402 0.502 1
1 1921 . 6 1 1 A 164 164 HIS CA C 164 56.361 54.125 2.236 1
1 1922 . 6 1 1 A 164 164 HIS CB C 164 30.305 29.729 0.576 1
1 1923 . 6 1 1 A 164 164 HIS N N 164 119.729 116.835 2.894 1
1 1924 . 6 1 1 A 165 165 ASP H H 165 8.118 7.715 0.403 1
1 1925 . 6 1 1 A 165 165 ASP HA H 165 4.394 4.362 0.032 1
1 1928 . 6 1 1 A 165 165 ASP C C 165 176.054 176.146 -0.092 1
1 1929 . 6 1 1 A 165 165 ASP CA C 165 54.364 54.309 0.055 1
1 1930 . 6 1 1 A 165 165 ASP CB C 165 40.818 41.131 -0.313 1
1 1931 . 6 1 1 A 165 165 ASP N N 165 121.062 120.875 0.187 1
1 1932 . 6 1 1 A 166 166 HIS H H 166 8.092 8.266 -0.174 1
1 1933 . 6 1 1 A 166 166 HIS CA C 166 56.114 55.191 0.923 1
1 1934 . 6 1 1 A 166 166 HIS CB C 166 29.702 29.281 0.421 1
1 1935 . 6 1 1 A 166 166 HIS N N 166 120.001 124.138 -4.137 1
1 1936 . 6 1 1 A 170 170 HIS HA H 170 4.514 4.829 -0.315 1
1 1939 . 6 1 1 A 170 170 HIS C C 170 173.952 173.108 0.844 1
1 1940 . 6 1 1 A 170 170 HIS CA C 170 55.995 56.103 -0.108 1
1 1941 . 6 1 1 A 170 170 HIS CB C 170 30.161 32.897 -2.736 1
1 14 . 7 1 1 A 2 2 LYS H H 2 7.540 8.886 -1.346 1
1 15 . 7 1 1 A 2 2 LYS HA H 2 4.729 4.931 -0.202 1
1 24 . 7 1 1 A 2 2 LYS C C 2 175.948 174.984 0.964 1
1 25 . 7 1 1 A 2 2 LYS CA C 2 53.978 54.067 -0.089 1
1 26 . 7 1 1 A 2 2 LYS CB C 2 35.985 36.114 -0.129 1
1 30 . 7 1 1 A 2 2 LYS N N 2 120.764 119.046 1.718 1
1 31 . 7 1 1 A 3 3 VAL H H 3 8.738 8.353 0.385 1
1 32 . 7 1 1 A 3 3 VAL HA H 3 2.800 4.157 -1.357 1
1 40 . 7 1 1 A 3 3 VAL C C 3 175.018 175.245 -0.227 1
1 41 . 7 1 1 A 3 3 VAL CA C 3 66.598 62.993 3.605 1
1 42 . 7 1 1 A 3 3 VAL CB C 3 31.218 31.606 -0.388 1
1 45 . 7 1 1 A 3 3 VAL N N 3 120.055 121.944 -1.889 1
1 46 . 7 1 1 A 4 4 ALA H H 4 6.584 8.684 -2.100 1
1 47 . 7 1 1 A 4 4 ALA HA H 4 4.223 4.706 -0.483 1
1 51 . 7 1 1 A 4 4 ALA C C 4 174.117 175.521 -1.404 1
1 52 . 7 1 1 A 4 4 ALA CA C 4 50.358 50.898 -0.540 1
1 53 . 7 1 1 A 4 4 ALA CB C 4 22.137 23.074 -0.937 1
1 54 . 7 1 1 A 4 4 ALA N N 4 129.800 130.844 -1.044 1
1 55 . 7 1 1 A 5 5 LYS H H 5 8.596 8.537 0.059 1
1 56 . 7 1 1 A 5 5 LYS HA H 5 3.793 4.141 -0.348 1
1 65 . 7 1 1 A 5 5 LYS C C 5 175.260 177.057 -1.797 1
1 66 . 7 1 1 A 5 5 LYS CA C 5 57.700 57.235 0.465 1
1 67 . 7 1 1 A 5 5 LYS CB C 5 32.400 32.578 -0.178 1
1 71 . 7 1 1 A 5 5 LYS N N 5 118.708 120.067 -1.359 1
1 72 . 7 1 1 A 6 6 ASP H H 6 8.679 8.922 -0.243 1
1 73 . 7 1 1 A 6 6 ASP HA H 6 4.040 4.566 -0.526 1
1 76 . 7 1 1 A 6 6 ASP C C 6 173.331 175.050 -1.719 1
1 77 . 7 1 1 A 6 6 ASP CA C 6 57.508 55.381 2.127 1
1 78 . 7 1 1 A 6 6 ASP CB C 6 37.604 38.808 -1.204 1
1 79 . 7 1 1 A 6 6 ASP N N 6 115.415 126.219 -10.804 1
1 80 . 7 1 1 A 7 7 LEU H H 7 7.376 7.927 -0.551 1
1 81 . 7 1 1 A 7 7 LEU HA H 7 4.689 4.437 0.252 1
1 91 . 7 1 1 A 7 7 LEU C C 7 175.906 175.939 -0.033 1
1 92 . 7 1 1 A 7 7 LEU CA C 7 53.509 53.865 -0.356 1
1 93 . 7 1 1 A 7 7 LEU CB C 7 42.419 42.069 0.350 1
1 97 . 7 1 1 A 7 7 LEU N N 7 117.619 122.100 -4.481 1
1 98 . 7 1 1 A 8 8 VAL H H 8 8.646 8.693 -0.047 1
1 99 . 7 1 1 A 8 8 VAL HA H 8 4.397 4.150 0.247 1
1 107 . 7 1 1 A 8 8 VAL C C 8 175.244 175.807 -0.563 1
1 108 . 7 1 1 A 8 8 VAL CA C 8 62.028 63.388 -1.360 1
1 109 . 7 1 1 A 8 8 VAL CB C 8 31.515 32.265 -0.750 1
1 112 . 7 1 1 A 8 8 VAL N N 8 121.164 125.020 -3.856 1
1 113 . 7 1 1 A 9 9 VAL H H 9 8.607 8.660 -0.053 1
1 114 . 7 1 1 A 9 9 VAL HA H 9 4.281 4.726 -0.445 1
1 122 . 7 1 1 A 9 9 VAL C C 9 174.156 175.027 -0.871 1
1 123 . 7 1 1 A 9 9 VAL CA C 9 60.614 60.691 -0.077 1
1 124 . 7 1 1 A 9 9 VAL CB C 9 33.985 36.092 -2.107 1
1 127 . 7 1 1 A 9 9 VAL N N 9 134.014 127.823 6.191 1
1 128 . 7 1 1 A 10 10 SER H H 10 8.684 8.900 -0.216 1
1 129 . 7 1 1 A 10 10 SER HA H 10 5.736 5.533 0.203 1
1 132 . 7 1 1 A 10 10 SER C C 10 173.544 173.733 -0.189 1
1 133 . 7 1 1 A 10 10 SER CA C 10 56.533 57.868 -1.335 1
1 134 . 7 1 1 A 10 10 SER CB C 10 63.385 63.950 -0.565 1
1 135 . 7 1 1 A 10 10 SER N N 10 121.492 125.554 -4.062 1
1 136 . 7 1 1 A 11 11 LEU H H 11 9.939 8.878 1.061 1
1 137 . 7 1 1 A 11 11 LEU HA H 11 5.133 5.427 -0.294 1
1 147 . 7 1 1 A 11 11 LEU C C 11 174.843 175.077 -0.234 1
1 148 . 7 1 1 A 11 11 LEU CA C 11 53.770 52.983 0.787 1
1 149 . 7 1 1 A 11 11 LEU CB C 11 47.469 46.347 1.122 1
1 153 . 7 1 1 A 11 11 LEU N N 11 128.460 122.055 6.405 1
1 154 . 7 1 1 A 12 12 ALA H H 12 8.770 9.190 -0.420 1
1 155 . 7 1 1 A 12 12 ALA HA H 12 4.830 5.722 -0.892 1
1 159 . 7 1 1 A 12 12 ALA C C 12 176.974 175.725 1.249 1
1 160 . 7 1 1 A 12 12 ALA CA C 12 50.231 50.147 0.084 1
1 161 . 7 1 1 A 12 12 ALA CB C 12 21.270 22.792 -1.522 1
1 162 . 7 1 1 A 12 12 ALA N N 12 127.500 121.533 5.967 1
1 163 . 7 1 1 A 13 13 TYR H H 13 8.749 8.963 -0.214 1
1 164 . 7 1 1 A 13 13 TYR HA H 13 5.797 5.783 0.014 1
1 171 . 7 1 1 A 13 13 TYR C C 13 173.952 172.316 1.636 1
1 172 . 7 1 1 A 13 13 TYR CA C 13 56.390 56.206 0.184 1
1 173 . 7 1 1 A 13 13 TYR CB C 13 41.159 40.785 0.374 1
1 176 . 7 1 1 A 13 13 TYR N N 13 117.737 116.896 0.841 1
1 177 . 7 1 1 A 14 14 GLN H H 14 8.492 8.333 0.159 1
1 178 . 7 1 1 A 14 14 GLN HA H 14 4.611 5.045 -0.434 1
1 185 . 7 1 1 A 14 14 GLN C C 14 174.492 173.698 0.794 1
1 186 . 7 1 1 A 14 14 GLN CA C 14 55.626 54.404 1.222 1
1 187 . 7 1 1 A 14 14 GLN CB C 14 32.734 32.058 0.676 1
1 189 . 7 1 1 A 14 14 GLN N N 14 116.962 120.259 -3.297 1
1 191 . 7 1 1 A 15 15 VAL H H 15 8.403 9.130 -0.727 1
1 192 . 7 1 1 A 15 15 VAL HA H 15 4.614 5.221 -0.607 1
1 200 . 7 1 1 A 15 15 VAL C C 15 173.389 174.861 -1.472 1
1 201 . 7 1 1 A 15 15 VAL CA C 15 59.711 60.127 -0.416 1
1 202 . 7 1 1 A 15 15 VAL CB C 15 33.639 34.471 -0.832 1
1 205 . 7 1 1 A 15 15 VAL N N 15 121.203 126.984 -5.781 1
1 206 . 7 1 1 A 16 16 ARG H H 16 8.584 8.959 -0.375 1
1 207 . 7 1 1 A 16 16 ARG HA H 16 5.584 5.172 0.412 1
1 214 . 7 1 1 A 16 16 ARG C C 16 176.585 175.202 1.383 1
1 215 . 7 1 1 A 16 16 ARG CA C 16 53.453 53.989 -0.536 1
1 216 . 7 1 1 A 16 16 ARG CB C 16 34.968 33.847 1.121 1
1 219 . 7 1 1 A 16 16 ARG N N 16 126.883 126.742 0.141 1
1 220 . 7 1 1 A 17 17 THR H H 17 8.270 8.145 0.125 1
1 221 . 7 1 1 A 17 17 THR HA H 17 4.573 4.751 -0.178 1
1 226 . 7 1 1 A 17 17 THR C C 17 177.860 175.893 1.967 1
1 227 . 7 1 1 A 17 17 THR CA C 17 61.073 60.194 0.879 1
1 228 . 7 1 1 A 17 17 THR CB C 17 69.823 72.126 -2.303 1
1 230 . 7 1 1 A 17 17 THR N N 17 109.730 111.721 -1.991 1
1 231 . 7 1 1 A 18 18 GLU H H 18 9.147 8.873 0.274 1
1 232 . 7 1 1 A 18 18 GLU HA H 18 3.770 4.026 -0.256 1
1 237 . 7 1 1 A 18 18 GLU C C 18 176.683 178.023 -1.340 1
1 238 . 7 1 1 A 18 18 GLU CA C 18 59.866 59.089 0.777 1
1 239 . 7 1 1 A 18 18 GLU CB C 18 29.752 29.186 0.566 1
1 241 . 7 1 1 A 18 18 GLU N N 18 122.491 120.717 1.774 1
1 242 . 7 1 1 A 19 19 ASP H H 19 7.900 7.668 0.232 1
1 243 . 7 1 1 A 19 19 ASP HA H 19 4.456 4.696 -0.240 1
1 246 . 7 1 1 A 19 19 ASP C C 19 176.670 176.222 0.448 1
1 247 . 7 1 1 A 19 19 ASP CA C 19 53.833 54.174 -0.341 1
1 248 . 7 1 1 A 19 19 ASP CB C 19 40.180 41.285 -1.105 1
1 249 . 7 1 1 A 19 19 ASP N N 19 116.200 117.608 -1.408 1
1 250 . 7 1 1 A 20 20 GLY H H 20 8.149 7.879 0.270 1
1 251 . 7 1 1 A 20 20 GLY HA2 H 20 4.145 3.944 0.201 1
1 252 . 7 1 1 A 20 20 GLY HA3 H 20 3.531 3.951 -0.420 1
1 253 . 7 1 1 A 20 20 GLY C C 20 173.987 174.532 -0.545 1
1 254 . 7 1 1 A 20 20 GLY CA C 20 45.463 44.986 0.477 1
1 255 . 7 1 1 A 20 20 GLY N N 20 108.869 107.713 1.156 1
1 256 . 7 1 1 A 21 21 VAL H H 21 7.261 7.244 0.017 1
1 257 . 7 1 1 A 21 21 VAL HA H 21 3.645 3.954 -0.309 1
1 265 . 7 1 1 A 21 21 VAL C C 21 175.265 175.171 0.094 1
1 266 . 7 1 1 A 21 21 VAL CA C 21 63.368 62.513 0.855 1
1 267 . 7 1 1 A 21 21 VAL CB C 21 31.614 31.353 0.261 1
1 270 . 7 1 1 A 21 21 VAL N N 21 124.283 122.349 1.934 1
1 271 . 7 1 1 A 22 22 LEU H H 22 8.407 8.516 -0.109 1
1 272 . 7 1 1 A 22 22 LEU HA H 22 4.333 4.403 -0.070 1
1 282 . 7 1 1 A 22 22 LEU C C 22 176.660 176.819 -0.159 1
1 283 . 7 1 1 A 22 22 LEU CA C 22 55.724 55.828 -0.104 1
1 284 . 7 1 1 A 22 22 LEU CB C 22 42.272 42.416 -0.144 1
1 288 . 7 1 1 A 22 22 LEU N N 22 128.533 129.729 -1.196 1
1 289 . 7 1 1 A 23 23 VAL H H 23 8.887 8.910 -0.023 1
1 290 . 7 1 1 A 23 23 VAL HA H 23 4.237 4.275 -0.038 1
1 298 . 7 1 1 A 23 23 VAL C C 23 175.265 175.492 -0.227 1
1 299 . 7 1 1 A 23 23 VAL CA C 23 62.348 62.540 -0.192 1
1 300 . 7 1 1 A 23 23 VAL CB C 23 33.383 32.737 0.646 1
1 303 . 7 1 1 A 23 23 VAL N N 23 125.041 121.851 3.190 1
1 304 . 7 1 1 A 24 24 ASP H H 24 7.480 7.401 0.079 1
1 305 . 7 1 1 A 24 24 ASP HA H 24 4.763 5.012 -0.249 1
1 308 . 7 1 1 A 24 24 ASP C C 24 173.160 173.745 -0.585 1
1 309 . 7 1 1 A 24 24 ASP CA C 24 53.893 53.560 0.333 1
1 310 . 7 1 1 A 24 24 ASP CB C 24 43.680 44.181 -0.501 1
1 311 . 7 1 1 A 24 24 ASP N N 24 117.159 120.045 -2.886 1
1 312 . 7 1 1 A 25 25 GLU H H 25 8.187 8.631 -0.444 1
1 313 . 7 1 1 A 25 25 GLU HA H 25 4.491 4.567 -0.076 1
1 318 . 7 1 1 A 25 25 GLU C C 25 174.586 174.033 0.553 1
1 319 . 7 1 1 A 25 25 GLU CA C 25 55.475 55.951 -0.476 1
1 320 . 7 1 1 A 25 25 GLU CB C 25 33.033 34.021 -0.988 1
1 322 . 7 1 1 A 25 25 GLU N N 25 118.821 123.465 -4.644 1
1 323 . 7 1 1 A 26 26 SER H H 26 8.003 8.705 -0.702 1
1 324 . 7 1 1 A 26 26 SER HA H 26 4.782 4.836 -0.054 1
1 327 . 7 1 1 A 26 26 SER CA C 26 56.490 55.099 1.391 1
1 328 . 7 1 1 A 26 26 SER CB C 26 64.977 64.323 0.654 1
1 329 . 7 1 1 A 26 26 SER N N 26 119.346 122.695 -3.349 1
1 330 . 7 1 1 A 27 27 PRO HA H 27 4.633 4.597 0.036 1
1 337 . 7 1 1 A 27 27 PRO C C 27 177.016 177.422 -0.406 1
1 338 . 7 1 1 A 27 27 PRO CA C 27 61.943 62.600 -0.657 1
1 339 . 7 1 1 A 27 27 PRO CB C 27 32.492 33.240 -0.748 1
1 342 . 7 1 1 A 28 28 VAL H H 28 8.383 8.648 -0.265 1
1 343 . 7 1 1 A 28 28 VAL HA H 28 3.385 3.764 -0.379 1
1 351 . 7 1 1 A 28 28 VAL C C 28 176.069 177.534 -1.465 1
1 352 . 7 1 1 A 28 28 VAL CA C 28 65.888 65.140 0.748 1
1 353 . 7 1 1 A 28 28 VAL CB C 28 31.220 31.566 -0.346 1
1 356 . 7 1 1 A 28 28 VAL N N 28 119.349 122.170 -2.821 1
1 357 . 7 1 1 A 29 29 SER H H 29 7.365 7.785 -0.420 1
1 358 . 7 1 1 A 29 29 SER HA H 29 4.101 4.304 -0.203 1
1 361 . 7 1 1 A 29 29 SER C C 29 174.535 174.625 -0.090 1
1 362 . 7 1 1 A 29 29 SER CA C 29 58.609 60.870 -2.261 1
1 363 . 7 1 1 A 29 29 SER CB C 29 63.198 63.403 -0.205 1
1 364 . 7 1 1 A 29 29 SER N N 29 109.365 114.223 -4.858 1
1 365 . 7 1 1 A 30 30 ALA H H 30 7.457 7.832 -0.375 1
1 366 . 7 1 1 A 30 30 ALA HA H 30 4.548 4.788 -0.240 1
1 370 . 7 1 1 A 30 30 ALA CA C 30 50.789 49.088 1.701 1
1 371 . 7 1 1 A 30 30 ALA CB C 30 18.608 21.294 -2.686 1
1 372 . 7 1 1 A 30 30 ALA N N 30 126.056 122.377 3.679 1
1 373 . 7 1 1 A 31 31 PRO HA H 31 4.332 4.669 -0.337 1
1 380 . 7 1 1 A 31 31 PRO C C 31 175.841 176.013 -0.172 1
1 381 . 7 1 1 A 31 31 PRO CA C 31 62.996 62.453 0.543 1
1 382 . 7 1 1 A 31 31 PRO CB C 31 32.696 32.593 0.103 1
1 385 . 7 1 1 A 32 32 LEU H H 32 8.717 9.344 -0.627 1
1 386 . 7 1 1 A 32 32 LEU HA H 32 4.452 4.899 -0.447 1
1 396 . 7 1 1 A 32 32 LEU C C 32 175.298 174.605 0.693 1
1 397 . 7 1 1 A 32 32 LEU CA C 32 54.510 54.562 -0.052 1
1 398 . 7 1 1 A 32 32 LEU CB C 32 43.899 44.223 -0.324 1
1 402 . 7 1 1 A 32 32 LEU N N 32 123.702 122.310 1.392 1
1 403 . 7 1 1 A 33 33 ASP H H 33 8.258 8.872 -0.614 1
1 404 . 7 1 1 A 33 33 ASP HA H 33 5.919 5.641 0.278 1
1 407 . 7 1 1 A 33 33 ASP C C 33 175.927 174.418 1.509 1
1 408 . 7 1 1 A 33 33 ASP CA C 33 52.619 52.941 -0.322 1
1 409 . 7 1 1 A 33 33 ASP CB C 33 42.205 43.537 -1.332 1
1 410 . 7 1 1 A 33 33 ASP N N 33 128.453 126.051 2.402 1
1 411 . 7 1 1 A 34 34 TYR H H 34 9.144 8.740 0.404 1
1 412 . 7 1 1 A 34 34 TYR HA H 34 4.689 5.161 -0.472 1
1 419 . 7 1 1 A 34 34 TYR C C 34 170.622 174.213 -3.591 1
1 420 . 7 1 1 A 34 34 TYR CA C 34 55.930 56.673 -0.743 1
1 421 . 7 1 1 A 34 34 TYR CB C 34 41.905 43.444 -1.539 1
1 424 . 7 1 1 A 34 34 TYR N N 34 121.657 120.434 1.223 1
1 425 . 7 1 1 A 35 35 LEU H H 35 8.324 8.981 -0.657 1
1 426 . 7 1 1 A 35 35 LEU HA H 35 4.396 5.085 -0.689 1
1 436 . 7 1 1 A 35 35 LEU C C 35 175.301 176.037 -0.736 1
1 437 . 7 1 1 A 35 35 LEU CA C 35 52.909 53.407 -0.498 1
1 438 . 7 1 1 A 35 35 LEU CB C 35 42.816 44.359 -1.543 1
1 442 . 7 1 1 A 35 35 LEU N N 35 124.514 123.034 1.480 1
1 443 . 7 1 1 A 36 36 HIS H H 36 8.763 8.385 0.378 1
1 444 . 7 1 1 A 36 36 HIS HA H 36 4.382 4.331 0.051 1
1 449 . 7 1 1 A 36 36 HIS C C 36 176.514 176.355 0.159 1
1 450 . 7 1 1 A 36 36 HIS CA C 36 59.570 57.806 1.764 1
1 451 . 7 1 1 A 36 36 HIS CB C 36 31.257 29.636 1.621 1
1 454 . 7 1 1 A 36 36 HIS N N 36 132.209 126.923 5.286 1
1 455 . 7 1 1 A 37 37 GLY H H 37 8.745 8.595 0.150 1
1 456 . 7 1 1 A 37 37 GLY HA2 H 37 4.021 3.826 0.195 1
1 457 . 7 1 1 A 37 37 GLY HA3 H 37 3.592 3.946 -0.354 1
1 458 . 7 1 1 A 37 37 GLY C C 37 175.081 174.106 0.975 1
1 459 . 7 1 1 A 37 37 GLY CA C 37 45.621 45.104 0.517 1
1 460 . 7 1 1 A 37 37 GLY N N 37 117.737 115.108 2.629 1
1 461 . 7 1 1 A 38 38 HIS H H 38 8.470 8.241 0.229 1
1 462 . 7 1 1 A 38 38 HIS HA H 38 4.584 4.725 -0.141 1
1 467 . 7 1 1 A 38 38 HIS C C 38 175.334 174.946 0.388 1
1 468 . 7 1 1 A 38 38 HIS CA C 38 55.899 56.044 -0.145 1
1 469 . 7 1 1 A 38 38 HIS CB C 38 30.865 31.268 -0.403 1
1 472 . 7 1 1 A 38 38 HIS N N 38 119.813 117.266 2.547 1
1 473 . 7 1 1 A 39 39 GLY H H 39 8.936 7.693 1.243 1
1 474 . 7 1 1 A 39 39 GLY HA2 H 39 3.895 3.933 -0.038 1
1 475 . 7 1 1 A 39 39 GLY HA3 H 39 3.895 3.990 -0.095 1
1 476 . 7 1 1 A 39 39 GLY C C 39 175.557 174.282 1.275 1
1 477 . 7 1 1 A 39 39 GLY CA C 39 46.938 44.935 2.003 1
1 478 . 7 1 1 A 39 39 GLY N N 39 112.442 108.460 3.982 1
1 479 . 7 1 1 A 40 40 SER H H 40 9.249 8.245 1.004 1
1 480 . 7 1 1 A 40 40 SER HA H 40 4.299 4.592 -0.293 1
1 483 . 7 1 1 A 40 40 SER C C 40 174.138 173.701 0.437 1
1 484 . 7 1 1 A 40 40 SER CA C 40 60.809 59.482 1.327 1
1 485 . 7 1 1 A 40 40 SER CB C 40 64.041 65.585 -1.544 1
1 486 . 7 1 1 A 40 40 SER N N 40 117.098 118.457 -1.359 1
1 487 . 7 1 1 A 41 41 LEU H H 41 7.386 7.559 -0.173 1
1 488 . 7 1 1 A 41 41 LEU HA H 41 4.429 4.338 0.091 1
1 498 . 7 1 1 A 41 41 LEU C C 41 176.526 175.348 1.178 1
1 499 . 7 1 1 A 41 41 LEU CA C 41 52.295 53.499 -1.204 1
1 500 . 7 1 1 A 41 41 LEU CB C 41 44.147 42.602 1.545 1
1 504 . 7 1 1 A 41 41 LEU N N 41 120.541 115.193 5.348 1
1 505 . 7 1 1 A 42 42 ILE H H 42 7.407 8.064 -0.657 1
1 506 . 7 1 1 A 42 42 ILE HA H 42 3.756 3.906 -0.150 1
1 516 . 7 1 1 A 42 42 ILE C C 42 178.081 176.807 1.274 1
1 517 . 7 1 1 A 42 42 ILE CA C 42 62.257 61.227 1.030 1
1 518 . 7 1 1 A 42 42 ILE CB C 42 38.256 38.122 0.134 1
1 522 . 7 1 1 A 42 42 ILE N N 42 115.050 116.775 -1.725 1
1 523 . 7 1 1 A 43 43 SER H H 43 8.581 8.833 -0.252 1
1 524 . 7 1 1 A 43 43 SER HA H 43 3.957 4.048 -0.091 1
1 527 . 7 1 1 A 43 43 SER C C 43 177.830 176.696 1.134 1
1 528 . 7 1 1 A 43 43 SER CA C 43 61.958 61.083 0.875 1
1 529 . 7 1 1 A 43 43 SER CB C 43 62.680 62.486 0.194 1
1 530 . 7 1 1 A 43 43 SER N N 43 121.456 119.442 2.014 1
1 531 . 7 1 1 A 44 44 GLY H H 44 8.892 8.431 0.461 1
1 532 . 7 1 1 A 44 44 GLY HA2 H 44 3.514 3.800 -0.286 1
1 533 . 7 1 1 A 44 44 GLY HA3 H 44 3.854 3.808 0.046 1
1 534 . 7 1 1 A 44 44 GLY C C 44 175.296 175.508 -0.212 1
1 535 . 7 1 1 A 44 44 GLY CA C 44 46.854 47.499 -0.645 1
1 536 . 7 1 1 A 44 44 GLY N N 44 106.351 108.334 -1.983 1
1 537 . 7 1 1 A 45 45 LEU H H 45 6.824 7.950 -1.126 1
1 538 . 7 1 1 A 45 45 LEU HA H 45 3.909 4.051 -0.142 1
1 548 . 7 1 1 A 45 45 LEU C C 45 176.738 178.654 -1.916 1
1 549 . 7 1 1 A 45 45 LEU CA C 45 56.356 57.044 -0.688 1
1 550 . 7 1 1 A 45 45 LEU CB C 45 42.296 41.245 1.051 1
1 554 . 7 1 1 A 45 45 LEU N N 45 119.207 122.809 -3.602 1
1 555 . 7 1 1 A 46 46 GLU H H 46 7.556 8.092 -0.536 1
1 556 . 7 1 1 A 46 46 GLU HA H 46 3.664 4.094 -0.430 1
1 561 . 7 1 1 A 46 46 GLU C C 46 179.231 179.636 -0.405 1
1 562 . 7 1 1 A 46 46 GLU CA C 46 62.316 59.727 2.589 1
1 563 . 7 1 1 A 46 46 GLU CB C 46 29.147 29.223 -0.076 1
1 565 . 7 1 1 A 46 46 GLU N N 46 119.049 118.301 0.748 1
1 566 . 7 1 1 A 47 47 THR H H 47 8.219 8.025 0.194 1
1 567 . 7 1 1 A 47 47 THR HA H 47 3.965 3.911 0.054 1
1 572 . 7 1 1 A 47 47 THR C C 47 176.251 176.245 0.006 1
1 573 . 7 1 1 A 47 47 THR CA C 47 65.947 66.566 -0.619 1
1 574 . 7 1 1 A 47 47 THR CB C 47 69.014 68.358 0.656 1
1 576 . 7 1 1 A 47 47 THR N N 47 111.770 117.777 -6.007 1
1 577 . 7 1 1 A 48 48 ALA H H 48 6.794 7.863 -1.069 1
1 578 . 7 1 1 A 48 48 ALA HA H 48 4.171 4.199 -0.028 1
1 582 . 7 1 1 A 48 48 ALA C C 48 178.639 180.115 -1.476 1
1 583 . 7 1 1 A 48 48 ALA CA C 48 54.072 55.183 -1.111 1
1 584 . 7 1 1 A 48 48 ALA CB C 48 19.752 18.221 1.531 1
1 585 . 7 1 1 A 48 48 ALA N N 48 122.697 123.555 -0.858 1
1 586 . 7 1 1 A 49 49 LEU H H 49 7.691 8.716 -1.025 1
1 587 . 7 1 1 A 49 49 LEU HA H 49 3.902 4.291 -0.389 1
1 597 . 7 1 1 A 49 49 LEU C C 49 176.823 178.011 -1.188 1
1 598 . 7 1 1 A 49 49 LEU CA C 49 57.190 58.264 -1.074 1
1 599 . 7 1 1 A 49 49 LEU CB C 49 43.628 41.608 2.020 1
1 603 . 7 1 1 A 49 49 LEU N N 49 117.159 117.883 -0.724 1
1 604 . 7 1 1 A 50 50 GLU H H 50 6.963 7.977 -1.014 1
1 605 . 7 1 1 A 50 50 GLU HA H 50 3.220 4.033 -0.813 1
1 610 . 7 1 1 A 50 50 GLU C C 50 176.691 177.510 -0.819 1
1 611 . 7 1 1 A 50 50 GLU CA C 50 58.769 58.551 0.218 1
1 612 . 7 1 1 A 50 50 GLU CB C 50 29.792 29.816 -0.024 1
1 614 . 7 1 1 A 50 50 GLU N N 50 118.761 119.435 -0.674 1
1 615 . 7 1 1 A 51 51 GLY H H 51 8.541 8.281 0.260 1
1 616 . 7 1 1 A 51 51 GLY HA2 H 51 4.140 3.800 0.340 1
1 617 . 7 1 1 A 51 51 GLY HA3 H 51 3.488 3.884 -0.396 1
1 618 . 7 1 1 A 51 51 GLY C C 51 173.801 174.157 -0.356 1
1 619 . 7 1 1 A 51 51 GLY CA C 51 45.498 45.185 0.313 1
1 620 . 7 1 1 A 51 51 GLY N N 51 113.511 112.265 1.246 1
1 621 . 7 1 1 A 52 52 HIS H H 52 7.656 7.710 -0.054 1
1 622 . 7 1 1 A 52 52 HIS HA H 52 4.318 4.627 -0.309 1
1 627 . 7 1 1 A 52 52 HIS C C 52 172.815 174.069 -1.254 1
1 628 . 7 1 1 A 52 52 HIS CA C 52 57.562 56.117 1.445 1
1 629 . 7 1 1 A 52 52 HIS CB C 52 28.670 31.495 -2.825 1
1 632 . 7 1 1 A 52 52 HIS N N 52 116.844 118.595 -1.751 1
1 633 . 7 1 1 A 53 53 GLU H H 53 8.331 9.392 -1.061 1
1 634 . 7 1 1 A 53 53 GLU HA H 53 4.636 4.886 -0.250 1
1 639 . 7 1 1 A 53 53 GLU C C 53 176.145 176.201 -0.056 1
1 640 . 7 1 1 A 53 53 GLU CA C 53 54.891 54.280 0.611 1
1 641 . 7 1 1 A 53 53 GLU CB C 53 33.837 33.603 0.234 1
1 643 . 7 1 1 A 53 53 GLU N N 53 118.873 118.915 -0.042 1
1 644 . 7 1 1 A 54 54 VAL H H 54 8.585 8.417 0.168 1
1 645 . 7 1 1 A 54 54 VAL HA H 54 3.227 3.994 -0.767 1
1 653 . 7 1 1 A 54 54 VAL C C 54 177.218 176.473 0.745 1
1 654 . 7 1 1 A 54 54 VAL CA C 54 65.848 63.554 2.294 1
1 655 . 7 1 1 A 54 54 VAL CB C 54 31.189 31.469 -0.280 1
1 658 . 7 1 1 A 54 54 VAL N N 54 120.580 121.233 -0.653 1
1 659 . 7 1 1 A 55 55 GLY H H 55 8.912 9.421 -0.509 1
1 660 . 7 1 1 A 55 55 GLY HA2 H 55 4.441 4.057 0.384 1
1 661 . 7 1 1 A 55 55 GLY HA3 H 55 3.865 4.058 -0.193 1
1 662 . 7 1 1 A 55 55 GLY C C 55 174.827 173.959 0.868 1
1 663 . 7 1 1 A 55 55 GLY CA C 55 44.370 44.782 -0.412 1
1 664 . 7 1 1 A 55 55 GLY N N 55 118.078 115.388 2.690 1
1 665 . 7 1 1 A 56 56 ASP H H 56 8.098 7.926 0.172 1
1 666 . 7 1 1 A 56 56 ASP HA H 56 4.547 4.690 -0.143 1
1 669 . 7 1 1 A 56 56 ASP C C 56 174.859 174.959 -0.100 1
1 670 . 7 1 1 A 56 56 ASP CA C 56 55.629 55.136 0.493 1
1 671 . 7 1 1 A 56 56 ASP CB C 56 40.906 41.618 -0.712 1
1 672 . 7 1 1 A 56 56 ASP N N 56 123.094 122.190 0.904 1
1 673 . 7 1 1 A 57 57 LYS H H 57 8.168 8.625 -0.457 1
1 674 . 7 1 1 A 57 57 LYS HA H 57 5.471 5.957 -0.486 1
1 683 . 7 1 1 A 57 57 LYS C C 57 175.732 175.016 0.716 1
1 684 . 7 1 1 A 57 57 LYS CA C 57 55.056 55.206 -0.150 1
1 685 . 7 1 1 A 57 57 LYS CB C 57 35.302 35.947 -0.645 1
1 689 . 7 1 1 A 57 57 LYS N N 57 122.301 123.054 -0.753 1
1 690 . 7 1 1 A 58 58 PHE H H 58 8.355 8.493 -0.138 1
1 691 . 7 1 1 A 58 58 PHE HA H 58 4.858 5.033 -0.175 1
1 699 . 7 1 1 A 58 58 PHE C C 58 171.549 172.045 -0.496 1
1 700 . 7 1 1 A 58 58 PHE CA C 58 56.195 56.373 -0.178 1
1 701 . 7 1 1 A 58 58 PHE CB C 58 39.335 40.324 -0.989 1
1 705 . 7 1 1 A 58 58 PHE N N 58 121.026 120.962 0.064 1
1 706 . 7 1 1 A 59 59 ASP H H 59 8.407 8.641 -0.234 1
1 707 . 7 1 1 A 59 59 ASP HA H 59 5.743 5.195 0.548 1
1 710 . 7 1 1 A 59 59 ASP C C 59 176.302 175.866 0.436 1
1 711 . 7 1 1 A 59 59 ASP CA C 59 52.579 54.703 -2.124 1
1 712 . 7 1 1 A 59 59 ASP CB C 59 43.628 42.191 1.437 1
1 713 . 7 1 1 A 59 59 ASP N N 59 119.234 120.038 -0.804 1
1 714 . 7 1 1 A 60 60 VAL H H 60 8.915 8.925 -0.010 1
1 715 . 7 1 1 A 60 60 VAL HA H 60 4.374 4.997 -0.623 1
1 723 . 7 1 1 A 60 60 VAL C C 60 173.140 174.516 -1.376 1
1 724 . 7 1 1 A 60 60 VAL CA C 60 61.252 60.261 0.991 1
1 725 . 7 1 1 A 60 60 VAL CB C 60 35.620 35.547 0.073 1
1 728 . 7 1 1 A 60 60 VAL N N 60 119.758 123.011 -3.253 1
1 729 . 7 1 1 A 61 61 ALA H H 61 8.761 8.943 -0.182 1
1 730 . 7 1 1 A 61 61 ALA HA H 61 5.091 5.427 -0.336 1
1 734 . 7 1 1 A 61 61 ALA C C 61 176.460 176.308 0.152 1
1 735 . 7 1 1 A 61 61 ALA CA C 61 51.019 51.030 -0.011 1
1 736 . 7 1 1 A 61 61 ALA CB C 61 19.447 21.322 -1.875 1
1 737 . 7 1 1 A 61 61 ALA N N 61 133.341 128.372 4.969 1
1 738 . 7 1 1 A 62 62 VAL H H 62 8.929 8.887 0.042 1
1 739 . 7 1 1 A 62 62 VAL HA H 62 4.236 4.766 -0.530 1
1 747 . 7 1 1 A 62 62 VAL C C 62 174.733 175.682 -0.949 1
1 748 . 7 1 1 A 62 62 VAL CA C 62 61.007 60.931 0.076 1
1 749 . 7 1 1 A 62 62 VAL CB C 62 34.387 35.376 -0.989 1
1 752 . 7 1 1 A 62 62 VAL N N 62 124.165 123.006 1.159 1
1 753 . 7 1 1 A 63 63 GLY H H 63 8.995 8.662 0.333 1
1 754 . 7 1 1 A 63 63 GLY HA2 H 63 4.229 4.148 0.081 1
1 755 . 7 1 1 A 63 63 GLY HA3 H 63 3.637 4.150 -0.513 1
1 756 . 7 1 1 A 63 63 GLY C C 63 175.306 174.919 0.387 1
1 757 . 7 1 1 A 63 63 GLY CA C 63 44.620 45.307 -0.687 1
1 758 . 7 1 1 A 63 63 GLY N N 63 115.598 112.268 3.330 1
1 759 . 7 1 1 A 64 64 ALA H H 64 8.106 9.002 -0.896 1
1 760 . 7 1 1 A 64 64 ALA HA H 64 4.010 4.317 -0.307 1
1 764 . 7 1 1 A 64 64 ALA C C 64 180.218 179.564 0.654 1
1 765 . 7 1 1 A 64 64 ALA CA C 64 55.897 54.696 1.201 1
1 766 . 7 1 1 A 64 64 ALA CB C 64 18.347 18.410 -0.063 1
1 767 . 7 1 1 A 64 64 ALA N N 64 122.859 124.505 -1.646 1
1 768 . 7 1 1 A 65 65 ASN H H 65 8.748 8.890 -0.142 1
1 769 . 7 1 1 A 65 65 ASN HA H 65 4.230 4.786 -0.556 1
1 774 . 7 1 1 A 65 65 ASN C C 65 176.085 175.634 0.451 1
1 775 . 7 1 1 A 65 65 ASN CA C 65 56.064 55.262 0.802 1
1 776 . 7 1 1 A 65 65 ASN CB C 65 37.871 36.965 0.906 1
1 777 . 7 1 1 A 65 65 ASN N N 65 114.590 114.352 0.238 1
1 779 . 7 1 1 A 66 66 ASP H H 66 7.598 8.114 -0.516 1
1 780 . 7 1 1 A 66 66 ASP HA H 66 4.682 4.789 -0.107 1
1 783 . 7 1 1 A 66 66 ASP C C 66 173.061 175.420 -2.359 1
1 784 . 7 1 1 A 66 66 ASP CA C 66 53.549 53.880 -0.331 1
1 785 . 7 1 1 A 66 66 ASP CB C 66 42.204 42.550 -0.346 1
1 786 . 7 1 1 A 66 66 ASP N N 66 118.065 118.007 0.058 1
1 787 . 7 1 1 A 67 67 ALA H H 67 7.434 7.508 -0.074 1
1 788 . 7 1 1 A 67 67 ALA HA H 67 4.316 4.383 -0.067 1
1 792 . 7 1 1 A 67 67 ALA C C 67 175.615 176.343 -0.728 1
1 793 . 7 1 1 A 67 67 ALA CA C 67 50.814 50.530 0.284 1
1 794 . 7 1 1 A 67 67 ALA CB C 67 18.618 21.352 -2.734 1
1 795 . 7 1 1 A 67 67 ALA N N 67 124.890 120.103 4.787 1
1 796 . 7 1 1 A 68 68 TYR H H 68 8.390 8.486 -0.096 1
1 797 . 7 1 1 A 68 68 TYR HA H 68 4.195 4.310 -0.115 1
1 804 . 7 1 1 A 68 68 TYR C C 68 174.964 177.175 -2.211 1
1 805 . 7 1 1 A 68 68 TYR CA C 68 59.566 58.421 1.145 1
1 806 . 7 1 1 A 68 68 TYR CB C 68 36.992 39.229 -2.237 1
1 809 . 7 1 1 A 68 68 TYR N N 68 121.083 117.582 3.501 1
1 810 . 7 1 1 A 69 69 GLY H H 69 8.149 9.073 -0.924 1
1 811 . 7 1 1 A 69 69 GLY HA2 H 69 4.254 4.025 0.229 1
1 812 . 7 1 1 A 69 69 GLY HA3 H 69 3.624 4.042 -0.418 1
1 813 . 7 1 1 A 69 69 GLY C C 69 173.161 174.877 -1.716 1
1 814 . 7 1 1 A 69 69 GLY CA C 69 44.465 45.556 -1.091 1
1 815 . 7 1 1 A 69 69 GLY N N 69 108.762 112.160 -3.398 1
1 816 . 7 1 1 A 70 70 GLN H H 70 8.450 7.852 0.598 1
1 817 . 7 1 1 A 70 70 GLN HA H 70 4.140 4.272 -0.132 1
1 824 . 7 1 1 A 70 70 GLN C C 70 176.138 175.648 0.490 1
1 825 . 7 1 1 A 70 70 GLN CA C 70 54.680 56.499 -1.819 1
1 826 . 7 1 1 A 70 70 GLN CB C 70 29.210 29.324 -0.114 1
1 828 . 7 1 1 A 70 70 GLN N N 70 117.002 120.007 -3.005 1
1 830 . 7 1 1 A 71 71 TYR H H 71 8.991 8.786 0.205 1
1 831 . 7 1 1 A 71 71 TYR HA H 71 3.752 4.599 -0.847 1
1 838 . 7 1 1 A 71 71 TYR C C 71 174.548 174.884 -0.336 1
1 839 . 7 1 1 A 71 71 TYR CA C 71 59.868 57.631 2.237 1
1 840 . 7 1 1 A 71 71 TYR CB C 71 38.961 39.756 -0.795 1
1 843 . 7 1 1 A 71 71 TYR N N 71 125.112 123.881 1.231 1
1 844 . 7 1 1 A 72 72 ASP H H 72 8.819 8.552 0.267 1
1 845 . 7 1 1 A 72 72 ASP HA H 72 4.773 4.566 0.207 1
1 848 . 7 1 1 A 72 72 ASP C C 72 177.709 177.751 -0.042 1
1 849 . 7 1 1 A 72 72 ASP CA C 72 52.382 53.971 -1.589 1
1 850 . 7 1 1 A 72 72 ASP CB C 72 42.197 41.406 0.791 1
1 851 . 7 1 1 A 72 72 ASP N N 72 129.918 122.824 7.094 1
1 852 . 7 1 1 A 73 73 GLU H H 73 9.409 8.995 0.414 1
1 853 . 7 1 1 A 73 73 GLU HA H 73 3.937 4.373 -0.436 1
1 858 . 7 1 1 A 73 73 GLU C C 73 177.581 177.912 -0.331 1
1 859 . 7 1 1 A 73 73 GLU CA C 73 58.962 58.174 0.788 1
1 860 . 7 1 1 A 73 73 GLU CB C 73 29.155 30.085 -0.930 1
1 862 . 7 1 1 A 73 73 GLU N N 73 129.624 128.024 1.600 1
1 863 . 7 1 1 A 74 74 ASN H H 74 8.700 7.909 0.791 1
1 864 . 7 1 1 A 74 74 ASN HA H 74 4.550 4.627 -0.077 1
1 869 . 7 1 1 A 74 74 ASN C C 74 176.190 176.302 -0.112 1
1 870 . 7 1 1 A 74 74 ASN CA C 74 54.932 55.220 -0.288 1
1 871 . 7 1 1 A 74 74 ASN CB C 74 38.113 38.294 -0.181 1
1 872 . 7 1 1 A 74 74 ASN N N 74 116.792 117.103 -0.311 1
1 874 . 7 1 1 A 75 75 LEU H H 75 7.303 7.758 -0.455 1
1 875 . 7 1 1 A 75 75 LEU HA H 75 4.289 4.496 -0.207 1
1 885 . 7 1 1 A 75 75 LEU C C 75 175.821 176.479 -0.658 1
1 886 . 7 1 1 A 75 75 LEU CA C 75 54.106 54.525 -0.419 1
1 887 . 7 1 1 A 75 75 LEU CB C 75 41.239 43.117 -1.878 1
1 891 . 7 1 1 A 75 75 LEU N N 75 117.094 116.983 0.111 1
1 892 . 7 1 1 A 76 76 VAL H H 76 7.181 7.638 -0.457 1
1 893 . 7 1 1 A 76 76 VAL HA H 76 4.970 4.789 0.181 1
1 901 . 7 1 1 A 76 76 VAL C C 76 175.702 174.433 1.269 1
1 902 . 7 1 1 A 76 76 VAL CA C 76 61.733 60.247 1.486 1
1 903 . 7 1 1 A 76 76 VAL CB C 76 31.822 34.510 -2.688 1
1 905 . 7 1 1 A 76 76 VAL N N 76 124.716 121.218 3.498 1
1 906 . 7 1 1 A 77 77 GLN H H 77 8.791 8.601 0.190 1
1 907 . 7 1 1 A 77 77 GLN HA H 77 4.695 5.061 -0.366 1
1 914 . 7 1 1 A 77 77 GLN C C 77 173.553 173.444 0.109 1
1 915 . 7 1 1 A 77 77 GLN CA C 77 54.038 54.509 -0.471 1
1 916 . 7 1 1 A 77 77 GLN CB C 77 33.018 32.545 0.473 1
1 918 . 7 1 1 A 77 77 GLN N N 77 124.898 122.466 2.432 1
1 920 . 7 1 1 A 78 78 ARG H H 78 8.530 8.532 -0.002 1
1 921 . 7 1 1 A 78 78 ARG HA H 78 5.107 5.445 -0.338 1
1 928 . 7 1 1 A 78 78 ARG C C 78 176.182 175.271 0.911 1
1 929 . 7 1 1 A 78 78 ARG CA C 78 55.355 54.932 0.423 1
1 930 . 7 1 1 A 78 78 ARG CB C 78 31.150 31.909 -0.759 1
1 933 . 7 1 1 A 78 78 ARG N N 78 123.413 119.632 3.781 1
1 934 . 7 1 1 A 79 79 VAL H H 79 9.300 8.774 0.526 1
1 935 . 7 1 1 A 79 79 VAL HA H 79 4.824 4.564 0.260 1
1 943 . 7 1 1 A 79 79 VAL CA C 79 58.731 58.987 -0.256 1
1 944 . 7 1 1 A 79 79 VAL CB C 79 34.836 32.538 2.298 1
1 947 . 7 1 1 A 79 79 VAL N N 79 125.252 125.264 -0.012 1
1 948 . 7 1 1 A 80 80 PRO HA H 80 4.339 4.899 -0.560 1
1 955 . 7 1 1 A 80 80 PRO C C 80 176.902 178.077 -1.175 1
1 956 . 7 1 1 A 80 80 PRO CA C 80 62.969 63.088 -0.119 1
1 957 . 7 1 1 A 80 80 PRO CB C 80 32.431 32.152 0.279 1
1 960 . 7 1 1 A 81 81 LYS H H 81 7.816 9.178 -1.362 1
1 961 . 7 1 1 A 81 81 LYS HA H 81 3.790 4.060 -0.270 1
1 970 . 7 1 1 A 81 81 LYS C C 81 177.808 178.932 -1.124 1
1 971 . 7 1 1 A 81 81 LYS CA C 81 59.874 59.765 0.109 1
1 972 . 7 1 1 A 81 81 LYS CB C 81 32.670 32.080 0.590 1
1 976 . 7 1 1 A 81 81 LYS N N 81 120.948 124.936 -3.988 1
1 977 . 7 1 1 A 82 82 ASP H H 82 8.069 8.190 -0.121 1
1 978 . 7 1 1 A 82 82 ASP HA H 82 4.243 4.392 -0.149 1
1 981 . 7 1 1 A 82 82 ASP C C 82 177.157 178.842 -1.685 1
1 982 . 7 1 1 A 82 82 ASP CA C 82 55.527 57.357 -1.830 1
1 983 . 7 1 1 A 82 82 ASP CB C 82 40.005 41.417 -1.412 1
1 984 . 7 1 1 A 82 82 ASP N N 82 116.004 119.927 -3.923 1
1 985 . 7 1 1 A 83 83 VAL H H 83 7.150 7.820 -0.670 1
1 986 . 7 1 1 A 83 83 VAL HA H 83 3.719 3.440 0.279 1
1 994 . 7 1 1 A 83 83 VAL C C 83 176.346 176.944 -0.598 1
1 995 . 7 1 1 A 83 83 VAL CA C 83 63.868 65.954 -2.086 1
1 996 . 7 1 1 A 83 83 VAL CB C 83 31.689 31.340 0.349 1
1 999 . 7 1 1 A 83 83 VAL N N 83 117.199 119.172 -1.973 1
1 1000 . 7 1 1 A 84 84 PHE H H 84 7.365 7.756 -0.391 1
1 1001 . 7 1 1 A 84 84 PHE HA H 84 4.389 4.575 -0.186 1
1 1009 . 7 1 1 A 84 84 PHE C C 84 175.265 176.460 -1.195 1
1 1010 . 7 1 1 A 84 84 PHE CA C 84 57.210 56.982 0.228 1
1 1011 . 7 1 1 A 84 84 PHE CB C 84 38.968 37.643 1.325 1
1 1015 . 7 1 1 A 84 84 PHE N N 84 119.897 117.230 2.667 1
1 1016 . 7 1 1 A 85 85 MET H H 85 7.765 8.139 -0.374 1
1 1017 . 7 1 1 A 85 85 MET HA H 85 4.277 4.335 -0.058 1
1 1025 . 7 1 1 A 85 85 MET C C 85 176.856 177.229 -0.373 1
1 1026 . 7 1 1 A 85 85 MET CA C 85 56.389 57.773 -1.384 1
1 1027 . 7 1 1 A 85 85 MET CB C 85 32.715 32.344 0.371 1
1 1030 . 7 1 1 A 85 85 MET N N 85 121.131 119.109 2.022 1
1 1031 . 7 1 1 A 86 86 GLY H H 86 8.499 8.144 0.355 1
1 1032 . 7 1 1 A 86 86 GLY HA2 H 86 3.928 3.928 0.000 1
1 1033 . 7 1 1 A 86 86 GLY HA3 H 86 3.793 3.929 -0.136 1
1 1034 . 7 1 1 A 86 86 GLY C C 86 174.168 173.819 0.349 1
1 1035 . 7 1 1 A 86 86 GLY CA C 86 45.637 45.196 0.441 1
1 1036 . 7 1 1 A 86 86 GLY N N 86 111.268 107.756 3.512 1
1 1037 . 7 1 1 A 87 87 VAL H H 87 7.564 7.488 0.076 1
1 1038 . 7 1 1 A 87 87 VAL HA H 87 4.083 4.061 0.022 1
1 1046 . 7 1 1 A 87 87 VAL C C 87 175.649 175.810 -0.161 1
1 1047 . 7 1 1 A 87 87 VAL CA C 87 61.809 62.133 -0.324 1
1 1048 . 7 1 1 A 87 87 VAL CB C 87 32.667 32.474 0.193 1
1 1051 . 7 1 1 A 87 87 VAL N N 87 118.839 120.529 -1.690 1
1 1052 . 7 1 1 A 88 88 ASP H H 88 8.270 8.778 -0.508 1
1 1053 . 7 1 1 A 88 88 ASP HA H 88 4.421 4.492 -0.071 1
1 1056 . 7 1 1 A 88 88 ASP C C 88 175.977 175.232 0.745 1
1 1057 . 7 1 1 A 88 88 ASP CA C 88 55.655 56.668 -1.013 1
1 1058 . 7 1 1 A 88 88 ASP CB C 88 41.364 40.860 0.504 1
1 1059 . 7 1 1 A 88 88 ASP N N 88 124.401 126.232 -1.831 1
1 1060 . 7 1 1 A 89 89 GLU H H 89 7.833 7.828 0.005 1
1 1061 . 7 1 1 A 89 89 GLU HA H 89 4.206 4.671 -0.465 1
1 1066 . 7 1 1 A 89 89 GLU C C 89 174.912 175.290 -0.378 1
1 1067 . 7 1 1 A 89 89 GLU CA C 89 55.739 55.217 0.522 1
1 1068 . 7 1 1 A 89 89 GLU CB C 89 30.603 32.220 -1.617 1
1 1070 . 7 1 1 A 89 89 GLU N N 89 119.378 115.688 3.690 1
1 1071 . 7 1 1 A 90 90 LEU H H 90 8.051 8.674 -0.623 1
1 1072 . 7 1 1 A 90 90 LEU HA H 90 4.127 4.383 -0.256 1
1 1082 . 7 1 1 A 90 90 LEU C C 90 175.753 176.607 -0.854 1
1 1083 . 7 1 1 A 90 90 LEU CA C 90 54.929 55.464 -0.535 1
1 1084 . 7 1 1 A 90 90 LEU CB C 90 42.710 41.753 0.957 1
1 1088 . 7 1 1 A 90 90 LEU N N 90 124.432 126.589 -2.157 1
1 1089 . 7 1 1 A 91 91 GLN H H 91 7.341 8.641 -1.300 1
1 1090 . 7 1 1 A 91 91 GLN HA H 91 4.546 4.649 -0.103 1
1 1097 . 7 1 1 A 91 91 GLN C C 91 174.655 174.377 0.278 1
1 1098 . 7 1 1 A 91 91 GLN CA C 91 53.671 54.680 -1.009 1
1 1099 . 7 1 1 A 91 91 GLN CB C 91 32.850 32.734 0.116 1
1 1101 . 7 1 1 A 91 91 GLN N N 91 120.186 123.703 -3.517 1
1 1103 . 7 1 1 A 92 92 VAL H H 92 8.442 8.458 -0.016 1
1 1104 . 7 1 1 A 92 92 VAL HA H 92 3.278 3.884 -0.606 1
1 1112 . 7 1 1 A 92 92 VAL C C 92 177.098 177.081 0.017 1
1 1113 . 7 1 1 A 92 92 VAL CA C 92 64.953 64.316 0.637 1
1 1114 . 7 1 1 A 92 92 VAL CB C 92 31.601 31.650 -0.049 1
1 1117 . 7 1 1 A 92 92 VAL N N 92 121.899 123.813 -1.914 1
1 1118 . 7 1 1 A 93 93 GLY H H 93 9.002 9.449 -0.447 1
1 1119 . 7 1 1 A 93 93 GLY HA2 H 93 4.327 3.920 0.407 1
1 1120 . 7 1 1 A 93 93 GLY HA3 H 93 3.770 3.941 -0.171 1
1 1121 . 7 1 1 A 93 93 GLY C C 93 174.547 174.330 0.217 1
1 1122 . 7 1 1 A 93 93 GLY CA C 93 44.446 45.051 -0.605 1
1 1123 . 7 1 1 A 93 93 GLY N N 93 116.485 115.218 1.267 1
1 1124 . 7 1 1 A 94 94 MET H H 94 7.445 7.804 -0.359 1
1 1125 . 7 1 1 A 94 94 MET HA H 94 4.182 4.608 -0.426 1
1 1133 . 7 1 1 A 94 94 MET C C 94 174.531 174.843 -0.312 1
1 1134 . 7 1 1 A 94 94 MET CA C 94 57.193 55.324 1.869 1
1 1135 . 7 1 1 A 94 94 MET CB C 94 34.474 33.512 0.962 1
1 1138 . 7 1 1 A 94 94 MET N N 94 120.304 120.186 0.118 1
1 1139 . 7 1 1 A 95 95 ARG H H 95 8.169 8.551 -0.382 1
1 1140 . 7 1 1 A 95 95 ARG HA H 95 5.343 4.945 0.398 1
1 1147 . 7 1 1 A 95 95 ARG C C 95 175.593 174.959 0.634 1
1 1148 . 7 1 1 A 95 95 ARG CA C 95 54.898 54.616 0.282 1
1 1149 . 7 1 1 A 95 95 ARG CB C 95 32.928 32.978 -0.050 1
1 1152 . 7 1 1 A 95 95 ARG N N 95 122.066 122.294 -0.228 1
1 1153 . 7 1 1 A 96 96 PHE H H 96 8.440 8.156 0.284 1
1 1154 . 7 1 1 A 96 96 PHE HA H 96 4.738 5.089 -0.351 1
1 1162 . 7 1 1 A 96 96 PHE C C 96 173.273 171.853 1.420 1
1 1163 . 7 1 1 A 96 96 PHE CA C 96 56.174 56.172 0.002 1
1 1164 . 7 1 1 A 96 96 PHE CB C 96 42.474 40.631 1.843 1
1 1168 . 7 1 1 A 96 96 PHE N N 96 119.938 118.834 1.104 1
1 1169 . 7 1 1 A 97 97 LEU H H 97 8.459 8.816 -0.357 1
1 1170 . 7 1 1 A 97 97 LEU HA H 97 4.625 4.996 -0.371 1
1 1180 . 7 1 1 A 97 97 LEU C C 97 175.664 175.266 0.398 1
1 1181 . 7 1 1 A 97 97 LEU CA C 97 53.547 54.296 -0.749 1
1 1182 . 7 1 1 A 97 97 LEU CB C 97 42.379 44.495 -2.116 1
1 1186 . 7 1 1 A 97 97 LEU N N 97 122.014 122.155 -0.141 1
1 1187 . 7 1 1 A 98 98 ALA H H 98 8.812 8.928 -0.116 1
1 1188 . 7 1 1 A 98 98 ALA HA H 98 4.520 5.342 -0.822 1
1 1192 . 7 1 1 A 98 98 ALA C C 98 176.373 176.067 0.306 1
1 1193 . 7 1 1 A 98 98 ALA CA C 98 50.639 50.429 0.210 1
1 1194 . 7 1 1 A 98 98 ALA CB C 98 20.939 22.523 -1.584 1
1 1195 . 7 1 1 A 98 98 ALA N N 98 129.296 128.808 0.488 1
1 1196 . 7 1 1 A 99 99 GLU H H 99 8.504 8.640 -0.136 1
1 1197 . 7 1 1 A 99 99 GLU HA H 99 4.150 4.808 -0.658 1
1 1202 . 7 1 1 A 99 99 GLU C C 99 176.351 176.550 -0.199 1
1 1203 . 7 1 1 A 99 99 GLU CA C 99 56.830 56.645 0.185 1
1 1204 . 7 1 1 A 99 99 GLU CB C 99 29.639 30.785 -1.146 1
1 1206 . 7 1 1 A 99 99 GLU N N 99 121.993 122.064 -0.071 1
1 1207 . 7 1 1 A 100 100 THR H H 100 7.393 8.546 -1.153 1
1 1208 . 7 1 1 A 100 100 THR HA H 100 4.819 4.835 -0.016 1
1 1213 . 7 1 1 A 100 100 THR C C 100 175.882 174.803 1.079 1
1 1214 . 7 1 1 A 100 100 THR CA C 100 60.329 60.249 0.080 1
1 1215 . 7 1 1 A 100 100 THR CB C 100 73.452 71.834 1.618 1
1 1217 . 7 1 1 A 100 100 THR N N 100 115.598 113.309 2.289 1
1 1218 . 7 1 1 A 101 101 ASP H H 101 8.988 8.731 0.257 1
1 1219 . 7 1 1 A 101 101 ASP HA H 101 4.357 4.509 -0.152 1
1 1222 . 7 1 1 A 101 101 ASP C C 101 176.848 176.454 0.394 1
1 1223 . 7 1 1 A 101 101 ASP CA C 101 56.493 56.844 -0.351 1
1 1224 . 7 1 1 A 101 101 ASP CB C 101 39.973 40.400 -0.427 1
1 1225 . 7 1 1 A 101 101 ASP N N 101 121.468 119.657 1.811 1
1 1226 . 7 1 1 A 102 102 GLN H H 102 7.937 7.693 0.244 1
1 1227 . 7 1 1 A 102 102 GLN HA H 102 4.415 4.442 -0.027 1
1 1234 . 7 1 1 A 102 102 GLN C C 102 175.252 176.150 -0.898 1
1 1235 . 7 1 1 A 102 102 GLN CA C 102 55.097 54.803 0.294 1
1 1236 . 7 1 1 A 102 102 GLN CB C 102 29.121 28.410 0.711 1
1 1238 . 7 1 1 A 102 102 GLN N N 102 117.199 115.115 2.084 1
1 1240 . 7 1 1 A 103 103 GLY H H 103 7.431 7.964 -0.533 1
1 1241 . 7 1 1 A 103 103 GLY HA2 H 103 4.504 4.219 0.285 1
1 1242 . 7 1 1 A 103 103 GLY HA3 H 103 3.868 4.219 -0.351 1
1 1243 . 7 1 1 A 103 103 GLY CA C 103 44.051 44.455 -0.404 1
1 1244 . 7 1 1 A 103 103 GLY N N 103 110.056 110.404 -0.348 1
1 1245 . 7 1 1 A 104 104 PRO HA H 104 5.057 5.016 0.041 1
1 1252 . 7 1 1 A 104 104 PRO C C 104 177.873 175.690 2.183 1
1 1253 . 7 1 1 A 104 104 PRO CA C 104 62.464 63.035 -0.571 1
1 1254 . 7 1 1 A 104 104 PRO CB C 104 31.939 32.238 -0.299 1
1 1257 . 7 1 1 A 105 105 VAL H H 105 8.960 9.553 -0.593 1
1 1258 . 7 1 1 A 105 105 VAL HA H 105 4.678 4.541 0.137 1
1 1266 . 7 1 1 A 105 105 VAL CA C 105 58.474 59.208 -0.734 1
1 1267 . 7 1 1 A 105 105 VAL CB C 105 35.512 34.934 0.578 1
1 1270 . 7 1 1 A 105 105 VAL N N 105 123.240 123.187 0.053 1
1 1271 . 7 1 1 A 106 106 PRO HA H 106 4.777 5.057 -0.280 1
1 1278 . 7 1 1 A 106 106 PRO C C 106 176.823 176.501 0.322 1
1 1279 . 7 1 1 A 106 106 PRO CA C 106 62.508 62.133 0.375 1
1 1280 . 7 1 1 A 106 106 PRO CB C 106 31.650 31.692 -0.042 1
1 1283 . 7 1 1 A 107 107 VAL H H 107 8.835 7.965 0.870 1
1 1284 . 7 1 1 A 107 107 VAL HA H 107 4.719 4.960 -0.241 1
1 1292 . 7 1 1 A 107 107 VAL C C 107 173.661 173.316 0.345 1
1 1293 . 7 1 1 A 107 107 VAL CA C 107 59.026 59.180 -0.154 1
1 1294 . 7 1 1 A 107 107 VAL CB C 107 36.406 35.210 1.196 1
1 1297 . 7 1 1 A 107 107 VAL N N 107 117.474 116.735 0.739 1
1 1298 . 7 1 1 A 108 108 GLU H H 108 7.698 8.639 -0.941 1
1 1299 . 7 1 1 A 108 108 GLU HA H 108 5.133 5.141 -0.008 1
1 1304 . 7 1 1 A 108 108 GLU C C 108 176.394 174.965 1.429 1
1 1305 . 7 1 1 A 108 108 GLU CA C 108 53.808 54.385 -0.577 1
1 1306 . 7 1 1 A 108 108 GLU CB C 108 33.984 33.548 0.436 1
1 1308 . 7 1 1 A 108 108 GLU N N 108 120.646 120.317 0.329 1
1 1309 . 7 1 1 A 109 109 ILE H H 109 8.690 8.926 -0.236 1
1 1310 . 7 1 1 A 109 109 ILE HA H 109 4.484 4.185 0.299 1
1 1320 . 7 1 1 A 109 109 ILE C C 109 177.313 177.087 0.226 1
1 1321 . 7 1 1 A 109 109 ILE CA C 109 61.789 61.702 0.087 1
1 1322 . 7 1 1 A 109 109 ILE CB C 109 36.628 37.612 -0.984 1
1 1326 . 7 1 1 A 109 109 ILE N N 109 124.739 127.542 -2.803 1
1 1327 . 7 1 1 A 110 110 THR H H 110 9.300 9.497 -0.197 1
1 1328 . 7 1 1 A 110 110 THR HA H 110 4.547 4.528 0.019 1
1 1333 . 7 1 1 A 110 110 THR C C 110 174.904 174.607 0.297 1
1 1334 . 7 1 1 A 110 110 THR CA C 110 62.260 61.489 0.771 1
1 1335 . 7 1 1 A 110 110 THR CB C 110 69.100 69.666 -0.566 1
1 1337 . 7 1 1 A 110 110 THR N N 110 122.544 118.418 4.126 1
1 1338 . 7 1 1 A 111 111 ALA H H 111 7.673 7.535 0.138 1
1 1339 . 7 1 1 A 111 111 ALA HA H 111 4.367 4.610 -0.243 1
1 1343 . 7 1 1 A 111 111 ALA C C 111 175.019 174.961 0.058 1
1 1344 . 7 1 1 A 111 111 ALA CA C 111 53.125 51.769 1.356 1
1 1345 . 7 1 1 A 111 111 ALA CB C 111 21.539 22.371 -0.832 1
1 1346 . 7 1 1 A 111 111 ALA N N 111 123.153 121.001 2.152 1
1 1347 . 7 1 1 A 112 112 VAL H H 112 8.707 8.475 0.232 1
1 1348 . 7 1 1 A 112 112 VAL HA H 112 4.129 4.553 -0.424 1
1 1356 . 7 1 1 A 112 112 VAL C C 112 174.755 175.038 -0.283 1
1 1357 . 7 1 1 A 112 112 VAL CA C 112 62.898 61.579 1.319 1
1 1358 . 7 1 1 A 112 112 VAL CB C 112 33.379 34.402 -1.023 1
1 1361 . 7 1 1 A 112 112 VAL N N 112 122.369 120.059 2.310 1
1 1362 . 7 1 1 A 113 113 GLU H H 113 8.144 8.935 -0.791 1
1 1363 . 7 1 1 A 113 113 GLU HA H 113 4.645 4.558 0.087 1
1 1368 . 7 1 1 A 113 113 GLU C C 113 175.102 177.282 -2.180 1
1 1369 . 7 1 1 A 113 113 GLU CA C 113 54.080 55.151 -1.071 1
1 1370 . 7 1 1 A 113 113 GLU CB C 113 31.234 30.926 0.308 1
1 1372 . 7 1 1 A 113 113 GLU N N 113 127.435 126.771 0.664 1
1 1373 . 7 1 1 A 114 114 ASP H H 114 8.472 8.428 0.044 1
1 1374 . 7 1 1 A 114 114 ASP HA H 114 4.209 4.260 -0.051 1
1 1377 . 7 1 1 A 114 114 ASP C C 114 177.679 177.146 0.533 1
1 1378 . 7 1 1 A 114 114 ASP CA C 114 58.334 56.386 1.948 1
1 1379 . 7 1 1 A 114 114 ASP CB C 114 40.347 41.276 -0.929 1
1 1380 . 7 1 1 A 114 114 ASP N N 114 119.844 120.786 -0.942 1
1 1381 . 7 1 1 A 115 115 ASP H H 115 8.475 8.020 0.455 1
1 1382 . 7 1 1 A 115 115 ASP HA H 115 4.848 4.830 0.018 1
1 1385 . 7 1 1 A 115 115 ASP C C 115 175.968 175.208 0.760 1
1 1386 . 7 1 1 A 115 115 ASP CA C 115 53.290 54.117 -0.827 1
1 1387 . 7 1 1 A 115 115 ASP CB C 115 42.080 42.828 -0.748 1
1 1388 . 7 1 1 A 115 115 ASP N N 115 114.364 115.918 -1.554 1
1 1389 . 7 1 1 A 116 116 HIS H H 116 7.185 7.415 -0.230 1
1 1390 . 7 1 1 A 116 116 HIS HA H 116 5.106 5.515 -0.409 1
1 1395 . 7 1 1 A 116 116 HIS C C 116 172.393 172.702 -0.309 1
1 1396 . 7 1 1 A 116 116 HIS CA C 116 56.099 54.405 1.694 1
1 1397 . 7 1 1 A 116 116 HIS CB C 116 33.289 32.775 0.514 1
1 1400 . 7 1 1 A 116 116 HIS N N 116 117.212 116.071 1.141 1
1 1401 . 7 1 1 A 117 117 VAL H H 117 9.130 9.133 -0.003 1
1 1402 . 7 1 1 A 117 117 VAL HA H 117 4.649 4.969 -0.320 1
1 1410 . 7 1 1 A 117 117 VAL C C 117 173.832 174.657 -0.825 1
1 1411 . 7 1 1 A 117 117 VAL CA C 117 59.555 59.732 -0.177 1
1 1412 . 7 1 1 A 117 117 VAL CB C 117 34.676 35.464 -0.788 1
1 1415 . 7 1 1 A 117 117 VAL N N 117 114.046 117.233 -3.187 1
1 1416 . 7 1 1 A 118 118 VAL H H 118 8.680 8.805 -0.125 1
1 1417 . 7 1 1 A 118 118 VAL HA H 118 4.747 4.993 -0.246 1
1 1425 . 7 1 1 A 118 118 VAL C C 118 175.836 175.092 0.744 1
1 1426 . 7 1 1 A 118 118 VAL CA C 118 62.159 60.814 1.345 1
1 1427 . 7 1 1 A 118 118 VAL CB C 118 31.887 34.047 -2.160 1
1 1430 . 7 1 1 A 118 118 VAL N N 118 125.095 121.651 3.444 1
1 1431 . 7 1 1 A 119 119 VAL H H 119 9.057 8.673 0.384 1
1 1432 . 7 1 1 A 119 119 VAL HA H 119 5.231 5.016 0.215 1
1 1440 . 7 1 1 A 119 119 VAL C C 119 173.747 173.632 0.115 1
1 1441 . 7 1 1 A 119 119 VAL CA C 119 58.326 59.653 -1.327 1
1 1442 . 7 1 1 A 119 119 VAL CB C 119 34.387 34.559 -0.172 1
1 1445 . 7 1 1 A 119 119 VAL N N 119 121.494 122.303 -0.809 1
1 1446 . 7 1 1 A 120 120 ASP H H 120 8.926 8.746 0.180 1
1 1447 . 7 1 1 A 120 120 ASP HA H 120 5.174 5.108 0.066 1
1 1450 . 7 1 1 A 120 120 ASP C C 120 177.982 176.737 1.245 1
1 1451 . 7 1 1 A 120 120 ASP CA C 120 52.749 52.650 0.099 1
1 1452 . 7 1 1 A 120 120 ASP CB C 120 44.542 43.927 0.615 1
1 1453 . 7 1 1 A 120 120 ASP N N 120 121.454 125.864 -4.410 1
1 1454 . 7 1 1 A 121 121 GLY H H 121 8.674 8.583 0.091 1
1 1455 . 7 1 1 A 121 121 GLY HA2 H 121 4.702 3.990 0.712 1
1 1456 . 7 1 1 A 121 121 GLY HA3 H 121 3.573 4.008 -0.435 1
1 1457 . 7 1 1 A 121 121 GLY C C 121 175.041 174.126 0.915 1
1 1458 . 7 1 1 A 121 121 GLY CA C 121 45.319 45.282 0.037 1
1 1459 . 7 1 1 A 121 121 GLY N N 121 114.850 111.559 3.291 1
1 1460 . 7 1 1 A 122 122 ASN H H 122 8.762 8.264 0.498 1
1 1461 . 7 1 1 A 122 122 ASN HA H 122 4.183 5.399 -1.216 1
1 1466 . 7 1 1 A 122 122 ASN C C 122 175.406 174.684 0.722 1
1 1467 . 7 1 1 A 122 122 ASN CA C 122 54.686 51.593 3.093 1
1 1468 . 7 1 1 A 122 122 ASN CB C 122 40.139 42.774 -2.635 1
1 1469 . 7 1 1 A 122 122 ASN N N 122 121.618 117.275 4.343 1
1 1471 . 7 1 1 A 123 123 HIS H H 123 8.929 8.732 0.197 1
1 1472 . 7 1 1 A 123 123 HIS HA H 123 4.005 4.843 -0.838 1
1 1477 . 7 1 1 A 123 123 HIS C C 123 177.325 175.691 1.634 1
1 1478 . 7 1 1 A 123 123 HIS CA C 123 58.768 55.864 2.904 1
1 1479 . 7 1 1 A 123 123 HIS CB C 123 31.172 31.875 -0.703 1
1 1482 . 7 1 1 A 123 123 HIS N N 123 124.165 116.838 7.327 1
1 1483 . 7 1 1 A 124 124 MET H H 124 8.266 8.007 0.259 1
1 1484 . 7 1 1 A 124 124 MET HA H 124 4.048 4.041 0.007 1
1 1492 . 7 1 1 A 124 124 MET CA C 124 58.994 57.281 1.713 1
1 1493 . 7 1 1 A 124 124 MET CB C 124 32.777 31.854 0.923 1
1 1496 . 7 1 1 A 124 124 MET N N 124 129.443 118.415 11.028 1
1 1497 . 7 1 1 A 125 125 LEU H H 125 8.094 7.673 0.421 1
1 1498 . 7 1 1 A 125 125 LEU HA H 125 4.455 4.340 0.115 1
1 1504 . 7 1 1 A 125 125 LEU C C 125 177.860 176.561 1.299 1
1 1505 . 7 1 1 A 125 125 LEU CA C 125 53.517 55.917 -2.400 1
1 1506 . 7 1 1 A 125 125 LEU CB C 125 42.462 42.313 0.149 1
1 1509 . 7 1 1 A 126 126 ALA H H 126 8.089 7.612 0.477 1
1 1510 . 7 1 1 A 126 126 ALA HA H 126 3.966 4.666 -0.700 1
1 1514 . 7 1 1 A 126 126 ALA C C 126 179.135 177.215 1.920 1
1 1515 . 7 1 1 A 126 126 ALA CA C 126 54.170 51.253 2.917 1
1 1516 . 7 1 1 A 126 126 ALA CB C 126 18.687 20.932 -2.245 1
1 1517 . 7 1 1 A 126 126 ALA N N 126 126.095 120.035 6.060 1
1 1518 . 7 1 1 A 127 127 GLY H H 127 9.499 8.407 1.092 1
1 1519 . 7 1 1 A 127 127 GLY HA2 H 127 4.207 4.018 0.189 1
1 1520 . 7 1 1 A 127 127 GLY HA3 H 127 3.598 4.022 -0.424 1
1 1521 . 7 1 1 A 127 127 GLY C C 127 173.568 174.536 -0.968 1
1 1522 . 7 1 1 A 127 127 GLY CA C 127 45.846 45.074 0.772 1
1 1523 . 7 1 1 A 127 127 GLY N N 127 110.073 107.559 2.514 1
1 1524 . 7 1 1 A 128 128 GLN H H 128 7.514 7.901 -0.387 1
1 1525 . 7 1 1 A 128 128 GLN HA H 128 4.496 4.323 0.173 1
1 1532 . 7 1 1 A 128 128 GLN C C 128 174.790 175.306 -0.516 1
1 1533 . 7 1 1 A 128 128 GLN CA C 128 54.948 56.044 -1.096 1
1 1534 . 7 1 1 A 128 128 GLN CB C 128 29.181 29.000 0.181 1
1 1536 . 7 1 1 A 128 128 GLN N N 128 117.842 121.246 -3.404 1
1 1538 . 7 1 1 A 129 129 ASN H H 129 8.689 8.768 -0.079 1
1 1539 . 7 1 1 A 129 129 ASN HA H 129 4.857 5.106 -0.249 1
1 1544 . 7 1 1 A 129 129 ASN C C 129 174.325 174.710 -0.385 1
1 1545 . 7 1 1 A 129 129 ASN CA C 129 52.568 53.243 -0.675 1
1 1546 . 7 1 1 A 129 129 ASN CB C 129 38.035 39.259 -1.224 1
1 1547 . 7 1 1 A 129 129 ASN N N 129 122.739 123.454 -0.715 1
1 1549 . 7 1 1 A 130 130 LEU H H 130 8.742 9.060 -0.318 1
1 1550 . 7 1 1 A 130 130 LEU HA H 130 4.918 4.954 -0.036 1
1 1560 . 7 1 1 A 130 130 LEU C C 130 176.095 175.786 0.309 1
1 1561 . 7 1 1 A 130 130 LEU CA C 130 53.691 52.967 0.724 1
1 1562 . 7 1 1 A 130 130 LEU CB C 130 46.814 44.966 1.848 1
1 1566 . 7 1 1 A 130 130 LEU N N 130 121.242 125.764 -4.522 1
1 1567 . 7 1 1 A 131 131 LYS H H 131 8.809 9.009 -0.200 1
1 1568 . 7 1 1 A 131 131 LYS HA H 131 4.918 4.962 -0.044 1
1 1577 . 7 1 1 A 131 131 LYS C C 131 175.508 175.239 0.269 1
1 1578 . 7 1 1 A 131 131 LYS CA C 131 55.333 54.669 0.664 1
1 1579 . 7 1 1 A 131 131 LYS CB C 131 33.962 34.813 -0.851 1
1 1583 . 7 1 1 A 131 131 LYS N N 131 122.071 120.221 1.850 1
1 1584 . 7 1 1 A 132 132 PHE H H 132 9.436 9.363 0.073 1
1 1585 . 7 1 1 A 132 132 PHE HA H 132 5.427 5.714 -0.287 1
1 1593 . 7 1 1 A 132 132 PHE C C 132 175.715 174.601 1.114 1
1 1594 . 7 1 1 A 132 132 PHE CA C 132 56.665 56.551 0.114 1
1 1595 . 7 1 1 A 132 132 PHE CB C 132 42.263 42.413 -0.150 1
1 1599 . 7 1 1 A 132 132 PHE N N 132 125.247 123.003 2.244 1
1 1600 . 7 1 1 A 133 133 ASN H H 133 8.680 8.644 0.036 1
1 1601 . 7 1 1 A 133 133 ASN HA H 133 5.249 5.152 0.097 1
1 1606 . 7 1 1 A 133 133 ASN C C 133 174.433 173.976 0.457 1
1 1607 . 7 1 1 A 133 133 ASN CA C 133 53.952 52.691 1.261 1
1 1608 . 7 1 1 A 133 133 ASN CB C 133 41.492 39.557 1.935 1
1 1609 . 7 1 1 A 133 133 ASN N N 133 122.056 121.468 0.588 1
1 1611 . 7 1 1 A 134 134 VAL H H 134 8.762 8.641 0.121 1
1 1612 . 7 1 1 A 134 134 VAL HA H 134 4.805 4.722 0.083 1
1 1620 . 7 1 1 A 134 134 VAL C C 134 173.555 174.977 -1.422 1
1 1621 . 7 1 1 A 134 134 VAL CA C 134 60.374 61.387 -1.013 1
1 1622 . 7 1 1 A 134 134 VAL CB C 134 34.848 32.848 2.000 1
1 1625 . 7 1 1 A 134 134 VAL N N 134 122.014 125.921 -3.907 1
1 1626 . 7 1 1 A 135 135 GLU H H 135 8.869 9.664 -0.795 1
1 1627 . 7 1 1 A 135 135 GLU HA H 135 5.240 4.958 0.282 1
1 1632 . 7 1 1 A 135 135 GLU C C 135 175.578 175.239 0.339 1
1 1633 . 7 1 1 A 135 135 GLU CA C 135 54.376 55.348 -0.972 1
1 1634 . 7 1 1 A 135 135 GLU CB C 135 33.264 30.870 2.394 1
1 1636 . 7 1 1 A 135 135 GLU N N 135 125.197 126.981 -1.784 1
1 1637 . 7 1 1 A 136 136 VAL H H 136 8.270 8.541 -0.271 1
1 1638 . 7 1 1 A 136 136 VAL HA H 136 4.066 4.265 -0.199 1
1 1646 . 7 1 1 A 136 136 VAL C C 136 176.119 175.563 0.556 1
1 1647 . 7 1 1 A 136 136 VAL CA C 136 62.910 62.742 0.168 1
1 1648 . 7 1 1 A 136 136 VAL CB C 136 30.573 32.027 -1.454 1
1 1651 . 7 1 1 A 136 136 VAL N N 136 126.347 127.157 -0.810 1
1 1652 . 7 1 1 A 137 137 VAL H H 137 8.865 8.518 0.347 1
1 1653 . 7 1 1 A 137 137 VAL HA H 137 4.022 3.983 0.039 1
1 1661 . 7 1 1 A 137 137 VAL C C 137 175.208 176.189 -0.981 1
1 1662 . 7 1 1 A 137 137 VAL CA C 137 64.424 64.495 -0.071 1
1 1663 . 7 1 1 A 137 137 VAL CB C 137 32.943 32.333 0.610 1
1 1666 . 7 1 1 A 137 137 VAL N N 137 130.810 130.604 0.206 1
1 1667 . 7 1 1 A 138 138 ALA H H 138 7.677 7.727 -0.050 1
1 1668 . 7 1 1 A 138 138 ALA HA H 138 4.496 4.712 -0.216 1
1 1672 . 7 1 1 A 138 138 ALA C C 138 174.405 175.259 -0.854 1
1 1673 . 7 1 1 A 138 138 ALA CA C 138 52.556 51.747 0.809 1
1 1674 . 7 1 1 A 138 138 ALA CB C 138 21.874 22.657 -0.783 1
1 1675 . 7 1 1 A 138 138 ALA N N 138 119.194 117.688 1.506 1
1 1676 . 7 1 1 A 139 139 ILE H H 139 8.052 8.503 -0.451 1
1 1677 . 7 1 1 A 139 139 ILE HA H 139 4.640 4.912 -0.272 1
1 1687 . 7 1 1 A 139 139 ILE C C 139 173.734 174.328 -0.594 1
1 1688 . 7 1 1 A 139 139 ILE CA C 139 61.623 60.263 1.360 1
1 1689 . 7 1 1 A 139 139 ILE CB C 139 43.363 40.882 2.481 1
1 1693 . 7 1 1 A 139 139 ILE N N 139 119.307 120.256 -0.949 1
1 1694 . 7 1 1 A 140 140 ARG H H 140 8.912 9.170 -0.258 1
1 1695 . 7 1 1 A 140 140 ARG HA H 140 4.760 4.805 -0.045 1
1 1702 . 7 1 1 A 140 140 ARG C C 140 174.181 174.869 -0.688 1
1 1703 . 7 1 1 A 140 140 ARG CA C 140 54.243 54.529 -0.286 1
1 1704 . 7 1 1 A 140 140 ARG CB C 140 33.438 34.345 -0.907 1
1 1707 . 7 1 1 A 140 140 ARG N N 140 122.820 128.227 -5.407 1
1 1708 . 7 1 1 A 141 141 GLU H H 141 8.545 8.486 0.059 1
1 1709 . 7 1 1 A 141 141 GLU HA H 141 4.254 4.295 -0.041 1
1 1714 . 7 1 1 A 141 141 GLU C C 141 177.299 176.170 1.129 1
1 1715 . 7 1 1 A 141 141 GLU CA C 141 57.165 56.806 0.359 1
1 1716 . 7 1 1 A 141 141 GLU CB C 141 30.048 29.927 0.121 1
1 1718 . 7 1 1 A 141 141 GLU N N 141 119.458 124.728 -5.270 1
1 1719 . 7 1 1 A 142 142 ALA H H 142 8.380 8.282 0.098 1
1 1720 . 7 1 1 A 142 142 ALA HA H 142 4.388 4.589 -0.201 1
1 1724 . 7 1 1 A 142 142 ALA C C 142 178.495 178.937 -0.442 1
1 1725 . 7 1 1 A 142 142 ALA CA C 142 51.113 51.621 -0.508 1
1 1726 . 7 1 1 A 142 142 ALA CB C 142 21.044 20.254 0.790 1
1 1727 . 7 1 1 A 142 142 ALA N N 142 127.330 125.458 1.872 1
1 1728 . 7 1 1 A 143 143 THR H H 143 9.502 8.176 1.326 1
1 1729 . 7 1 1 A 143 143 THR HA H 143 4.362 4.770 -0.408 1
1 1734 . 7 1 1 A 143 143 THR C C 143 175.241 175.218 0.023 1
1 1735 . 7 1 1 A 143 143 THR CA C 143 60.541 61.068 -0.527 1
1 1736 . 7 1 1 A 143 143 THR CB C 143 70.879 68.718 2.161 1
1 1738 . 7 1 1 A 143 143 THR N N 143 114.561 110.179 4.382 1
1 1739 . 7 1 1 A 144 144 GLU H H 144 8.787 8.179 0.608 1
1 1740 . 7 1 1 A 144 144 GLU HA H 144 3.817 3.795 0.022 1
1 1745 . 7 1 1 A 144 144 GLU C C 144 179.490 176.829 2.661 1
1 1746 . 7 1 1 A 144 144 GLU CA C 144 60.102 58.956 1.146 1
1 1747 . 7 1 1 A 144 144 GLU CB C 144 29.338 27.400 1.938 1
1 1749 . 7 1 1 A 144 144 GLU N N 144 120.475 115.329 5.146 1
1 1750 . 7 1 1 A 145 145 GLU H H 145 8.321 8.725 -0.404 1
1 1751 . 7 1 1 A 145 145 GLU HA H 145 3.899 3.798 0.101 1
1 1756 . 7 1 1 A 145 145 GLU C C 145 178.521 179.281 -0.760 1
1 1757 . 7 1 1 A 145 145 GLU CA C 145 59.588 58.961 0.627 1
1 1758 . 7 1 1 A 145 145 GLU CB C 145 29.658 29.016 0.642 1
1 1760 . 7 1 1 A 145 145 GLU N N 145 119.761 118.679 1.082 1
1 1761 . 7 1 1 A 146 146 GLU H H 146 7.514 8.079 -0.565 1
1 1762 . 7 1 1 A 146 146 GLU HA H 146 3.856 3.915 -0.059 1
1 1767 . 7 1 1 A 146 146 GLU C C 146 179.189 179.560 -0.371 1
1 1768 . 7 1 1 A 146 146 GLU CA C 146 59.148 59.093 0.055 1
1 1769 . 7 1 1 A 146 146 GLU CB C 146 29.834 29.189 0.645 1
1 1771 . 7 1 1 A 146 146 GLU N N 146 121.118 120.405 0.713 1
1 1772 . 7 1 1 A 147 147 LEU H H 147 7.823 8.028 -0.205 1
1 1773 . 7 1 1 A 147 147 LEU HA H 147 3.662 3.782 -0.120 1
1 1783 . 7 1 1 A 147 147 LEU C C 147 179.341 178.615 0.726 1
1 1784 . 7 1 1 A 147 147 LEU CA C 147 57.277 57.569 -0.292 1
1 1785 . 7 1 1 A 147 147 LEU CB C 147 41.239 41.642 -0.403 1
1 1789 . 7 1 1 A 147 147 LEU N N 147 117.199 120.827 -3.628 1
1 1790 . 7 1 1 A 148 148 ALA H H 148 7.788 8.504 -0.716 1
1 1791 . 7 1 1 A 148 148 ALA HA H 148 3.958 4.052 -0.094 1
1 1795 . 7 1 1 A 148 148 ALA C C 148 179.777 178.802 0.975 1
1 1796 . 7 1 1 A 148 148 ALA CA C 148 54.509 54.590 -0.081 1
1 1797 . 7 1 1 A 148 148 ALA CB C 148 18.064 18.073 -0.009 1
1 1798 . 7 1 1 A 148 148 ALA N N 148 121.696 120.265 1.431 1
1 1799 . 7 1 1 A 149 149 HIS H H 149 7.726 7.321 0.405 1
1 1800 . 7 1 1 A 149 149 HIS HA H 149 4.477 4.677 -0.200 1
1 1805 . 7 1 1 A 149 149 HIS C C 149 176.099 175.489 0.610 1
1 1806 . 7 1 1 A 149 149 HIS CA C 149 55.802 55.982 -0.180 1
1 1807 . 7 1 1 A 149 149 HIS CB C 149 30.406 30.310 0.096 1
1 1810 . 7 1 1 A 149 149 HIS N N 149 114.463 112.705 1.758 1
1 1811 . 7 1 1 A 150 150 GLY H H 150 8.076 9.042 -0.966 1
1 1812 . 7 1 1 A 150 150 GLY HA2 H 150 3.927 3.535 0.392 1
1 1813 . 7 1 1 A 150 150 GLY HA3 H 150 3.237 3.843 -0.606 1
1 1814 . 7 1 1 A 150 150 GLY C C 150 173.382 173.503 -0.121 1
1 1815 . 7 1 1 A 150 150 GLY CA C 150 46.117 46.009 0.108 1
1 1816 . 7 1 1 A 150 150 GLY N N 150 109.417 108.895 0.522 1
1 1817 . 7 1 1 A 151 151 HIS H H 151 7.518 7.455 0.063 1
1 1818 . 7 1 1 A 151 151 HIS HA H 151 4.563 5.059 -0.496 1
1 1823 . 7 1 1 A 151 151 HIS C C 151 173.157 173.064 0.093 1
1 1824 . 7 1 1 A 151 151 HIS CA C 151 54.731 54.717 0.014 1
1 1825 . 7 1 1 A 151 151 HIS CB C 151 31.611 30.857 0.754 1
1 1828 . 7 1 1 A 151 151 HIS N N 151 114.828 114.321 0.507 1
1 1829 . 7 1 1 A 152 152 VAL H H 152 7.931 8.813 -0.882 1
1 1830 . 7 1 1 A 152 152 VAL HA H 152 3.951 3.831 0.120 1
1 1838 . 7 1 1 A 152 152 VAL C C 152 175.848 174.932 0.916 1
1 1839 . 7 1 1 A 152 152 VAL CA C 152 62.190 63.580 -1.390 1
1 1840 . 7 1 1 A 152 152 VAL CB C 152 32.703 32.122 0.581 1
1 1843 . 7 1 1 A 152 152 VAL N N 152 118.551 121.029 -2.478 1
1 1844 . 7 1 1 A 153 153 HIS H H 153 9.784 9.004 0.780 1
1 1845 . 7 1 1 A 153 153 HIS HA H 153 4.604 4.928 -0.324 1
1 1850 . 7 1 1 A 153 153 HIS C C 153 175.795 174.359 1.436 1
1 1851 . 7 1 1 A 153 153 HIS CA C 153 56.753 53.927 2.826 1
1 1852 . 7 1 1 A 153 153 HIS CB C 153 30.325 30.725 -0.400 1
1 1855 . 7 1 1 A 153 153 HIS N N 153 127.403 126.454 0.949 1
1 1856 . 7 1 1 A 154 154 GLY H H 154 8.447 8.087 0.360 1
1 1857 . 7 1 1 A 154 154 GLY HA2 H 154 3.797 3.883 -0.086 1
1 1858 . 7 1 1 A 154 154 GLY HA3 H 154 3.797 3.950 -0.153 1
1 1859 . 7 1 1 A 154 154 GLY C C 154 173.848 174.978 -1.130 1
1 1860 . 7 1 1 A 154 154 GLY CA C 154 45.153 45.168 -0.015 1
1 1861 . 7 1 1 A 154 154 GLY N N 154 112.233 112.027 0.206 1
1 1862 . 7 1 1 A 155 155 ALA H H 155 8.074 7.804 0.270 1
1 1863 . 7 1 1 A 155 155 ALA HA H 155 4.101 4.480 -0.379 1
1 1867 . 7 1 1 A 155 155 ALA C C 155 177.651 177.965 -0.314 1
1 1868 . 7 1 1 A 155 155 ALA CA C 155 52.795 53.733 -0.938 1
1 1869 . 7 1 1 A 155 155 ALA CB C 155 19.258 19.984 -0.726 1
1 1870 . 7 1 1 A 155 155 ALA N N 155 124.092 121.699 2.393 1
1 1871 . 7 1 1 A 156 156 HIS H H 156 8.201 7.943 0.258 1
1 1872 . 7 1 1 A 156 156 HIS HA H 156 4.474 4.256 0.218 1
1 1875 . 7 1 1 A 156 156 HIS C C 156 174.758 173.519 1.239 1
1 1876 . 7 1 1 A 156 156 HIS CA C 156 55.756 56.785 -1.029 1
1 1877 . 7 1 1 A 156 156 HIS CB C 156 30.060 28.294 1.766 1
1 1878 . 7 1 1 A 156 156 HIS N N 156 118.170 116.307 1.863 1
1 1879 . 7 1 1 A 157 157 ASP H H 157 8.001 8.246 -0.245 1
1 1880 . 7 1 1 A 157 157 ASP HA H 157 4.436 4.810 -0.374 1
1 1883 . 7 1 1 A 157 157 ASP CA C 157 54.185 53.562 0.623 1
1 1884 . 7 1 1 A 157 157 ASP CB C 157 41.016 41.496 -0.480 1
1 1885 . 7 1 1 A 157 157 ASP N N 157 121.683 124.952 -3.269 1
1 1886 . 7 1 1 A 160 160 HIS HA H 160 4.502 5.109 -0.607 1
1 1889 . 7 1 1 A 160 160 HIS C C 160 174.722 174.341 0.381 1
1 1890 . 7 1 1 A 160 160 HIS CA C 160 55.979 54.509 1.470 1
1 1891 . 7 1 1 A 160 160 HIS CB C 160 30.058 32.244 -2.186 1
1 1892 . 7 1 1 A 161 161 ASP H H 161 8.270 8.762 -0.492 1
1 1893 . 7 1 1 A 161 161 ASP HA H 161 4.446 5.401 -0.955 1
1 1896 . 7 1 1 A 161 161 ASP C C 161 176.107 174.885 1.222 1
1 1897 . 7 1 1 A 161 161 ASP CA C 161 54.474 52.884 1.590 1
1 1898 . 7 1 1 A 161 161 ASP CB C 161 40.820 43.756 -2.936 1
1 1899 . 7 1 1 A 161 161 ASP N N 161 121.957 123.081 -1.124 1
1 1900 . 7 1 1 A 162 162 HIS H H 162 8.212 8.343 -0.131 1
1 1901 . 7 1 1 A 162 162 HIS HA H 162 4.289 4.858 -0.569 1
1 1904 . 7 1 1 A 162 162 HIS C C 162 175.036 172.960 2.076 1
1 1905 . 7 1 1 A 162 162 HIS CA C 162 56.185 54.858 1.327 1
1 1906 . 7 1 1 A 162 162 HIS CB C 162 30.108 32.160 -2.052 1
1 1907 . 7 1 1 A 162 162 HIS N N 162 119.766 115.858 3.908 1
1 1908 . 7 1 1 A 163 163 ASP H H 163 8.163 8.681 -0.518 1
1 1909 . 7 1 1 A 163 163 ASP HA H 163 4.428 4.109 0.319 1
1 1912 . 7 1 1 A 163 163 ASP C C 163 176.161 174.549 1.612 1
1 1913 . 7 1 1 A 163 163 ASP CA C 163 54.585 55.105 -0.520 1
1 1914 . 7 1 1 A 163 163 ASP CB C 163 40.823 39.298 1.525 1
1 1915 . 7 1 1 A 163 163 ASP N N 163 121.265 117.709 3.556 1
1 1916 . 7 1 1 A 164 164 HIS H H 164 8.106 7.559 0.547 1
1 1917 . 7 1 1 A 164 164 HIS HA H 164 4.422 5.174 -0.752 1
1 1920 . 7 1 1 A 164 164 HIS C C 164 174.904 173.513 1.391 1
1 1921 . 7 1 1 A 164 164 HIS CA C 164 56.361 53.338 3.023 1
1 1922 . 7 1 1 A 164 164 HIS CB C 164 30.305 33.182 -2.877 1
1 1923 . 7 1 1 A 164 164 HIS N N 164 119.729 114.228 5.501 1
1 1924 . 7 1 1 A 165 165 ASP H H 165 8.118 8.724 -0.606 1
1 1925 . 7 1 1 A 165 165 ASP HA H 165 4.394 5.070 -0.676 1
1 1928 . 7 1 1 A 165 165 ASP C C 165 176.054 174.762 1.292 1
1 1929 . 7 1 1 A 165 165 ASP CA C 165 54.364 53.914 0.450 1
1 1930 . 7 1 1 A 165 165 ASP CB C 165 40.818 44.064 -3.246 1
1 1931 . 7 1 1 A 165 165 ASP N N 165 121.062 120.305 0.757 1
1 1932 . 7 1 1 A 166 166 HIS H H 166 8.092 9.121 -1.029 1
1 1933 . 7 1 1 A 166 166 HIS CA C 166 56.114 55.537 0.577 1
1 1934 . 7 1 1 A 166 166 HIS CB C 166 29.702 29.927 -0.225 1
1 1935 . 7 1 1 A 166 166 HIS N N 166 120.001 125.058 -5.057 1
1 1936 . 7 1 1 A 170 170 HIS HA H 170 4.514 4.686 -0.172 1
1 1939 . 7 1 1 A 170 170 HIS C C 170 173.952 172.670 1.282 1
1 1940 . 7 1 1 A 170 170 HIS CA C 170 55.995 53.764 2.231 1
1 1941 . 7 1 1 A 170 170 HIS CB C 170 30.161 31.507 -1.346 1
1 14 . 8 1 1 A 2 2 LYS H H 2 7.540 8.933 -1.393 1
1 15 . 8 1 1 A 2 2 LYS HA H 2 4.729 5.053 -0.324 1
1 24 . 8 1 1 A 2 2 LYS C C 2 175.948 175.513 0.435 1
1 25 . 8 1 1 A 2 2 LYS CA C 2 53.978 54.551 -0.573 1
1 26 . 8 1 1 A 2 2 LYS CB C 2 35.985 35.413 0.572 1
1 30 . 8 1 1 A 2 2 LYS N N 2 120.764 120.889 -0.125 1
1 31 . 8 1 1 A 3 3 VAL H H 3 8.738 8.511 0.227 1
1 32 . 8 1 1 A 3 3 VAL HA H 3 2.800 4.432 -1.632 1
1 40 . 8 1 1 A 3 3 VAL C C 3 175.018 175.296 -0.278 1
1 41 . 8 1 1 A 3 3 VAL CA C 3 66.598 62.090 4.508 1
1 42 . 8 1 1 A 3 3 VAL CB C 3 31.218 32.505 -1.287 1
1 45 . 8 1 1 A 3 3 VAL N N 3 120.055 121.818 -1.763 1
1 46 . 8 1 1 A 4 4 ALA H H 4 6.584 8.894 -2.310 1
1 47 . 8 1 1 A 4 4 ALA HA H 4 4.223 4.742 -0.519 1
1 51 . 8 1 1 A 4 4 ALA C C 4 174.117 175.535 -1.418 1
1 52 . 8 1 1 A 4 4 ALA CA C 4 50.358 50.965 -0.607 1
1 53 . 8 1 1 A 4 4 ALA CB C 4 22.137 23.486 -1.349 1
1 54 . 8 1 1 A 4 4 ALA N N 4 129.800 130.575 -0.775 1
1 55 . 8 1 1 A 5 5 LYS H H 5 8.596 8.563 0.033 1
1 56 . 8 1 1 A 5 5 LYS HA H 5 3.793 4.154 -0.361 1
1 65 . 8 1 1 A 5 5 LYS C C 5 175.260 177.042 -1.782 1
1 66 . 8 1 1 A 5 5 LYS CA C 5 57.700 57.369 0.331 1
1 67 . 8 1 1 A 5 5 LYS CB C 5 32.400 32.633 -0.233 1
1 71 . 8 1 1 A 5 5 LYS N N 5 118.708 120.312 -1.604 1
1 72 . 8 1 1 A 6 6 ASP H H 6 8.679 8.842 -0.163 1
1 73 . 8 1 1 A 6 6 ASP HA H 6 4.040 4.418 -0.378 1
1 76 . 8 1 1 A 6 6 ASP C C 6 173.331 175.507 -2.176 1
1 77 . 8 1 1 A 6 6 ASP CA C 6 57.508 55.868 1.640 1
1 78 . 8 1 1 A 6 6 ASP CB C 6 37.604 39.338 -1.734 1
1 79 . 8 1 1 A 6 6 ASP N N 6 115.415 120.960 -5.545 1
1 80 . 8 1 1 A 7 7 LEU H H 7 7.376 7.741 -0.365 1
1 81 . 8 1 1 A 7 7 LEU HA H 7 4.689 4.395 0.294 1
1 91 . 8 1 1 A 7 7 LEU C C 7 175.906 176.020 -0.114 1
1 92 . 8 1 1 A 7 7 LEU CA C 7 53.509 53.946 -0.437 1
1 93 . 8 1 1 A 7 7 LEU CB C 7 42.419 41.746 0.673 1
1 97 . 8 1 1 A 7 7 LEU N N 7 117.619 121.194 -3.575 1
1 98 . 8 1 1 A 8 8 VAL H H 8 8.646 8.614 0.032 1
1 99 . 8 1 1 A 8 8 VAL HA H 8 4.397 4.163 0.234 1
1 107 . 8 1 1 A 8 8 VAL C C 8 175.244 175.070 0.174 1
1 108 . 8 1 1 A 8 8 VAL CA C 8 62.028 63.086 -1.058 1
1 109 . 8 1 1 A 8 8 VAL CB C 8 31.515 32.314 -0.799 1
1 112 . 8 1 1 A 8 8 VAL N N 8 121.164 127.272 -6.108 1
1 113 . 8 1 1 A 9 9 VAL H H 9 8.607 8.327 0.280 1
1 114 . 8 1 1 A 9 9 VAL HA H 9 4.281 4.676 -0.395 1
1 122 . 8 1 1 A 9 9 VAL C C 9 174.156 174.480 -0.324 1
1 123 . 8 1 1 A 9 9 VAL CA C 9 60.614 60.693 -0.079 1
1 124 . 8 1 1 A 9 9 VAL CB C 9 33.985 36.161 -2.176 1
1 127 . 8 1 1 A 9 9 VAL N N 9 134.014 129.148 4.866 1
1 128 . 8 1 1 A 10 10 SER H H 10 8.684 8.793 -0.109 1
1 129 . 8 1 1 A 10 10 SER HA H 10 5.736 5.310 0.426 1
1 132 . 8 1 1 A 10 10 SER C C 10 173.544 173.390 0.154 1
1 133 . 8 1 1 A 10 10 SER CA C 10 56.533 58.047 -1.514 1
1 134 . 8 1 1 A 10 10 SER CB C 10 63.385 64.177 -0.792 1
1 135 . 8 1 1 A 10 10 SER N N 10 121.492 125.273 -3.781 1
1 136 . 8 1 1 A 11 11 LEU H H 11 9.939 8.754 1.185 1
1 137 . 8 1 1 A 11 11 LEU HA H 11 5.133 5.058 0.075 1
1 147 . 8 1 1 A 11 11 LEU C C 11 174.843 174.152 0.691 1
1 148 . 8 1 1 A 11 11 LEU CA C 11 53.770 53.559 0.211 1
1 149 . 8 1 1 A 11 11 LEU CB C 11 47.469 46.742 0.727 1
1 153 . 8 1 1 A 11 11 LEU N N 11 128.460 127.614 0.846 1
1 154 . 8 1 1 A 12 12 ALA H H 12 8.770 9.164 -0.394 1
1 155 . 8 1 1 A 12 12 ALA HA H 12 4.830 5.608 -0.778 1
1 159 . 8 1 1 A 12 12 ALA C C 12 176.974 175.729 1.245 1
1 160 . 8 1 1 A 12 12 ALA CA C 12 50.231 50.198 0.033 1
1 161 . 8 1 1 A 12 12 ALA CB C 12 21.270 23.058 -1.788 1
1 162 . 8 1 1 A 12 12 ALA N N 12 127.500 126.672 0.828 1
1 163 . 8 1 1 A 13 13 TYR H H 13 8.749 8.834 -0.085 1
1 164 . 8 1 1 A 13 13 TYR HA H 13 5.797 5.539 0.258 1
1 171 . 8 1 1 A 13 13 TYR C C 13 173.952 172.287 1.665 1
1 172 . 8 1 1 A 13 13 TYR CA C 13 56.390 56.353 0.037 1
1 173 . 8 1 1 A 13 13 TYR CB C 13 41.159 40.525 0.634 1
1 176 . 8 1 1 A 13 13 TYR N N 13 117.737 116.619 1.118 1
1 177 . 8 1 1 A 14 14 GLN H H 14 8.492 8.471 0.021 1
1 178 . 8 1 1 A 14 14 GLN HA H 14 4.611 5.084 -0.473 1
1 185 . 8 1 1 A 14 14 GLN C C 14 174.492 173.622 0.870 1
1 186 . 8 1 1 A 14 14 GLN CA C 14 55.626 54.458 1.168 1
1 187 . 8 1 1 A 14 14 GLN CB C 14 32.734 32.078 0.656 1
1 189 . 8 1 1 A 14 14 GLN N N 14 116.962 120.319 -3.357 1
1 191 . 8 1 1 A 15 15 VAL H H 15 8.403 9.236 -0.833 1
1 192 . 8 1 1 A 15 15 VAL HA H 15 4.614 5.329 -0.715 1
1 200 . 8 1 1 A 15 15 VAL C C 15 173.389 174.900 -1.511 1
1 201 . 8 1 1 A 15 15 VAL CA C 15 59.711 60.108 -0.397 1
1 202 . 8 1 1 A 15 15 VAL CB C 15 33.639 34.431 -0.792 1
1 205 . 8 1 1 A 15 15 VAL N N 15 121.203 127.085 -5.882 1
1 206 . 8 1 1 A 16 16 ARG H H 16 8.584 9.066 -0.482 1
1 207 . 8 1 1 A 16 16 ARG HA H 16 5.584 4.843 0.741 1
1 214 . 8 1 1 A 16 16 ARG C C 16 176.585 175.037 1.548 1
1 215 . 8 1 1 A 16 16 ARG CA C 16 53.453 54.041 -0.588 1
1 216 . 8 1 1 A 16 16 ARG CB C 16 34.968 33.752 1.216 1
1 219 . 8 1 1 A 16 16 ARG N N 16 126.883 126.560 0.323 1
1 220 . 8 1 1 A 17 17 THR H H 17 8.270 8.065 0.205 1
1 221 . 8 1 1 A 17 17 THR HA H 17 4.573 4.719 -0.146 1
1 226 . 8 1 1 A 17 17 THR C C 17 177.860 176.018 1.842 1
1 227 . 8 1 1 A 17 17 THR CA C 17 61.073 60.115 0.958 1
1 228 . 8 1 1 A 17 17 THR CB C 17 69.823 72.010 -2.187 1
1 230 . 8 1 1 A 17 17 THR N N 17 109.730 111.563 -1.833 1
1 231 . 8 1 1 A 18 18 GLU H H 18 9.147 8.825 0.322 1
1 232 . 8 1 1 A 18 18 GLU HA H 18 3.770 4.024 -0.254 1
1 237 . 8 1 1 A 18 18 GLU C C 18 176.683 178.006 -1.323 1
1 238 . 8 1 1 A 18 18 GLU CA C 18 59.866 58.890 0.976 1
1 239 . 8 1 1 A 18 18 GLU CB C 18 29.752 29.156 0.596 1
1 241 . 8 1 1 A 18 18 GLU N N 18 122.491 120.611 1.880 1
1 242 . 8 1 1 A 19 19 ASP H H 19 7.900 7.697 0.203 1
1 243 . 8 1 1 A 19 19 ASP HA H 19 4.456 4.680 -0.224 1
1 246 . 8 1 1 A 19 19 ASP C C 19 176.670 176.219 0.451 1
1 247 . 8 1 1 A 19 19 ASP CA C 19 53.833 54.174 -0.341 1
1 248 . 8 1 1 A 19 19 ASP CB C 19 40.180 41.247 -1.067 1
1 249 . 8 1 1 A 19 19 ASP N N 19 116.200 117.565 -1.365 1
1 250 . 8 1 1 A 20 20 GLY H H 20 8.149 7.766 0.383 1
1 251 . 8 1 1 A 20 20 GLY HA2 H 20 4.145 3.950 0.195 1
1 252 . 8 1 1 A 20 20 GLY HA3 H 20 3.531 3.956 -0.425 1
1 253 . 8 1 1 A 20 20 GLY C C 20 173.987 174.449 -0.462 1
1 254 . 8 1 1 A 20 20 GLY CA C 20 45.463 44.920 0.543 1
1 255 . 8 1 1 A 20 20 GLY N N 20 108.869 107.719 1.150 1
1 256 . 8 1 1 A 21 21 VAL H H 21 7.261 7.875 -0.614 1
1 257 . 8 1 1 A 21 21 VAL HA H 21 3.645 4.119 -0.474 1
1 265 . 8 1 1 A 21 21 VAL C C 21 175.265 174.923 0.342 1
1 266 . 8 1 1 A 21 21 VAL CA C 21 63.368 62.038 1.330 1
1 267 . 8 1 1 A 21 21 VAL CB C 21 31.614 32.324 -0.710 1
1 270 . 8 1 1 A 21 21 VAL N N 21 124.283 122.083 2.200 1
1 271 . 8 1 1 A 22 22 LEU H H 22 8.407 8.427 -0.020 1
1 272 . 8 1 1 A 22 22 LEU HA H 22 4.333 4.406 -0.073 1
1 282 . 8 1 1 A 22 22 LEU C C 22 176.660 176.860 -0.200 1
1 283 . 8 1 1 A 22 22 LEU CA C 22 55.724 55.395 0.329 1
1 284 . 8 1 1 A 22 22 LEU CB C 22 42.272 42.470 -0.198 1
1 288 . 8 1 1 A 22 22 LEU N N 22 128.533 130.035 -1.502 1
1 289 . 8 1 1 A 23 23 VAL H H 23 8.887 8.849 0.038 1
1 290 . 8 1 1 A 23 23 VAL HA H 23 4.237 4.348 -0.111 1
1 298 . 8 1 1 A 23 23 VAL C C 23 175.265 175.619 -0.354 1
1 299 . 8 1 1 A 23 23 VAL CA C 23 62.348 62.495 -0.147 1
1 300 . 8 1 1 A 23 23 VAL CB C 23 33.383 32.914 0.469 1
1 303 . 8 1 1 A 23 23 VAL N N 23 125.041 121.701 3.340 1
1 304 . 8 1 1 A 24 24 ASP H H 24 7.480 7.462 0.018 1
1 305 . 8 1 1 A 24 24 ASP HA H 24 4.763 5.034 -0.271 1
1 308 . 8 1 1 A 24 24 ASP C C 24 173.160 173.993 -0.833 1
1 309 . 8 1 1 A 24 24 ASP CA C 24 53.893 53.736 0.157 1
1 310 . 8 1 1 A 24 24 ASP CB C 24 43.680 44.323 -0.643 1
1 311 . 8 1 1 A 24 24 ASP N N 24 117.159 120.295 -3.136 1
1 312 . 8 1 1 A 25 25 GLU H H 25 8.187 8.768 -0.581 1
1 313 . 8 1 1 A 25 25 GLU HA H 25 4.491 4.762 -0.271 1
1 318 . 8 1 1 A 25 25 GLU C C 25 174.586 173.559 1.027 1
1 319 . 8 1 1 A 25 25 GLU CA C 25 55.475 55.320 0.155 1
1 320 . 8 1 1 A 25 25 GLU CB C 25 33.033 33.467 -0.434 1
1 322 . 8 1 1 A 25 25 GLU N N 25 118.821 118.669 0.152 1
1 323 . 8 1 1 A 26 26 SER H H 26 8.003 8.669 -0.666 1
1 324 . 8 1 1 A 26 26 SER HA H 26 4.782 4.875 -0.093 1
1 327 . 8 1 1 A 26 26 SER CA C 26 56.490 55.019 1.471 1
1 328 . 8 1 1 A 26 26 SER CB C 26 64.977 65.080 -0.103 1
1 329 . 8 1 1 A 26 26 SER N N 26 119.346 117.105 2.241 1
1 330 . 8 1 1 A 27 27 PRO HA H 27 4.633 4.586 0.047 1
1 337 . 8 1 1 A 27 27 PRO C C 27 177.016 177.160 -0.144 1
1 338 . 8 1 1 A 27 27 PRO CA C 27 61.943 62.602 -0.659 1
1 339 . 8 1 1 A 27 27 PRO CB C 27 32.492 33.117 -0.625 1
1 342 . 8 1 1 A 28 28 VAL H H 28 8.383 8.841 -0.458 1
1 343 . 8 1 1 A 28 28 VAL HA H 28 3.385 3.977 -0.592 1
1 351 . 8 1 1 A 28 28 VAL C C 28 176.069 177.392 -1.323 1
1 352 . 8 1 1 A 28 28 VAL CA C 28 65.888 64.175 1.713 1
1 353 . 8 1 1 A 28 28 VAL CB C 28 31.220 31.728 -0.508 1
1 356 . 8 1 1 A 28 28 VAL N N 28 119.349 123.539 -4.190 1
1 357 . 8 1 1 A 29 29 SER H H 29 7.365 7.862 -0.497 1
1 358 . 8 1 1 A 29 29 SER HA H 29 4.101 4.256 -0.155 1
1 361 . 8 1 1 A 29 29 SER C C 29 174.535 174.620 -0.085 1
1 362 . 8 1 1 A 29 29 SER CA C 29 58.609 61.111 -2.502 1
1 363 . 8 1 1 A 29 29 SER CB C 29 63.198 63.261 -0.063 1
1 364 . 8 1 1 A 29 29 SER N N 29 109.365 114.429 -5.064 1
1 365 . 8 1 1 A 30 30 ALA H H 30 7.457 7.794 -0.337 1
1 366 . 8 1 1 A 30 30 ALA HA H 30 4.548 4.731 -0.183 1
1 370 . 8 1 1 A 30 30 ALA CA C 30 50.789 49.088 1.701 1
1 371 . 8 1 1 A 30 30 ALA CB C 30 18.608 21.282 -2.674 1
1 372 . 8 1 1 A 30 30 ALA N N 30 126.056 122.331 3.725 1
1 373 . 8 1 1 A 31 31 PRO HA H 31 4.332 4.647 -0.315 1
1 380 . 8 1 1 A 31 31 PRO C C 31 175.841 175.985 -0.144 1
1 381 . 8 1 1 A 31 31 PRO CA C 31 62.996 62.404 0.592 1
1 382 . 8 1 1 A 31 31 PRO CB C 31 32.696 32.528 0.168 1
1 385 . 8 1 1 A 32 32 LEU H H 32 8.717 9.236 -0.519 1
1 386 . 8 1 1 A 32 32 LEU HA H 32 4.452 4.807 -0.355 1
1 396 . 8 1 1 A 32 32 LEU C C 32 175.298 174.509 0.789 1
1 397 . 8 1 1 A 32 32 LEU CA C 32 54.510 54.544 -0.034 1
1 398 . 8 1 1 A 32 32 LEU CB C 32 43.899 44.145 -0.246 1
1 402 . 8 1 1 A 32 32 LEU N N 32 123.702 122.283 1.419 1
1 403 . 8 1 1 A 33 33 ASP H H 33 8.258 8.672 -0.414 1
1 404 . 8 1 1 A 33 33 ASP HA H 33 5.919 5.452 0.467 1
1 407 . 8 1 1 A 33 33 ASP C C 33 175.927 174.337 1.590 1
1 408 . 8 1 1 A 33 33 ASP CA C 33 52.619 52.760 -0.141 1
1 409 . 8 1 1 A 33 33 ASP CB C 33 42.205 43.005 -0.800 1
1 410 . 8 1 1 A 33 33 ASP N N 33 128.453 125.901 2.552 1
1 411 . 8 1 1 A 34 34 TYR H H 34 9.144 8.563 0.581 1
1 412 . 8 1 1 A 34 34 TYR HA H 34 4.689 5.135 -0.446 1
1 419 . 8 1 1 A 34 34 TYR C C 34 170.622 174.174 -3.552 1
1 420 . 8 1 1 A 34 34 TYR CA C 34 55.930 56.641 -0.711 1
1 421 . 8 1 1 A 34 34 TYR CB C 34 41.905 43.402 -1.497 1
1 424 . 8 1 1 A 34 34 TYR N N 34 121.657 120.395 1.262 1
1 425 . 8 1 1 A 35 35 LEU H H 35 8.324 8.978 -0.654 1
1 426 . 8 1 1 A 35 35 LEU HA H 35 4.396 5.054 -0.658 1
1 436 . 8 1 1 A 35 35 LEU C C 35 175.301 176.306 -1.005 1
1 437 . 8 1 1 A 35 35 LEU CA C 35 52.909 53.422 -0.513 1
1 438 . 8 1 1 A 35 35 LEU CB C 35 42.816 44.270 -1.454 1
1 442 . 8 1 1 A 35 35 LEU N N 35 124.514 123.038 1.476 1
1 443 . 8 1 1 A 36 36 HIS H H 36 8.763 8.312 0.451 1
1 444 . 8 1 1 A 36 36 HIS HA H 36 4.382 4.315 0.067 1
1 449 . 8 1 1 A 36 36 HIS C C 36 176.514 176.391 0.123 1
1 450 . 8 1 1 A 36 36 HIS CA C 36 59.570 57.866 1.704 1
1 451 . 8 1 1 A 36 36 HIS CB C 36 31.257 29.629 1.628 1
1 454 . 8 1 1 A 36 36 HIS N N 36 132.209 126.535 5.674 1
1 455 . 8 1 1 A 37 37 GLY H H 37 8.745 8.257 0.488 1
1 456 . 8 1 1 A 37 37 GLY HA2 H 37 4.021 3.739 0.282 1
1 457 . 8 1 1 A 37 37 GLY HA3 H 37 3.592 3.907 -0.315 1
1 458 . 8 1 1 A 37 37 GLY C C 37 175.081 174.256 0.825 1
1 459 . 8 1 1 A 37 37 GLY CA C 37 45.621 45.379 0.242 1
1 460 . 8 1 1 A 37 37 GLY N N 37 117.737 115.170 2.567 1
1 461 . 8 1 1 A 38 38 HIS H H 38 8.470 7.737 0.733 1
1 462 . 8 1 1 A 38 38 HIS HA H 38 4.584 4.675 -0.091 1
1 467 . 8 1 1 A 38 38 HIS C C 38 175.334 175.070 0.264 1
1 468 . 8 1 1 A 38 38 HIS CA C 38 55.899 56.127 -0.228 1
1 469 . 8 1 1 A 38 38 HIS CB C 38 30.865 30.938 -0.073 1
1 472 . 8 1 1 A 38 38 HIS N N 38 119.813 117.292 2.521 1
1 473 . 8 1 1 A 39 39 GLY H H 39 8.936 7.699 1.237 1
1 474 . 8 1 1 A 39 39 GLY HA2 H 39 3.895 3.924 -0.029 1
1 475 . 8 1 1 A 39 39 GLY HA3 H 39 3.895 3.964 -0.069 1
1 476 . 8 1 1 A 39 39 GLY C C 39 175.557 174.218 1.339 1
1 477 . 8 1 1 A 39 39 GLY CA C 39 46.938 44.922 2.016 1
1 478 . 8 1 1 A 39 39 GLY N N 39 112.442 108.211 4.231 1
1 479 . 8 1 1 A 40 40 SER H H 40 9.249 8.162 1.087 1
1 480 . 8 1 1 A 40 40 SER HA H 40 4.299 4.641 -0.342 1
1 483 . 8 1 1 A 40 40 SER C C 40 174.138 174.837 -0.699 1
1 484 . 8 1 1 A 40 40 SER CA C 40 60.809 59.524 1.285 1
1 485 . 8 1 1 A 40 40 SER CB C 40 64.041 65.437 -1.396 1
1 486 . 8 1 1 A 40 40 SER N N 40 117.098 118.170 -1.072 1
1 487 . 8 1 1 A 41 41 LEU H H 41 7.386 8.015 -0.629 1
1 488 . 8 1 1 A 41 41 LEU HA H 41 4.429 4.270 0.159 1
1 498 . 8 1 1 A 41 41 LEU C C 41 176.526 176.020 0.506 1
1 499 . 8 1 1 A 41 41 LEU CA C 41 52.295 55.083 -2.788 1
1 500 . 8 1 1 A 41 41 LEU CB C 41 44.147 42.512 1.635 1
1 504 . 8 1 1 A 41 41 LEU N N 41 120.541 115.374 5.167 1
1 505 . 8 1 1 A 42 42 ILE H H 42 7.407 7.548 -0.141 1
1 506 . 8 1 1 A 42 42 ILE HA H 42 3.756 4.423 -0.667 1
1 516 . 8 1 1 A 42 42 ILE C C 42 178.081 176.243 1.838 1
1 517 . 8 1 1 A 42 42 ILE CA C 42 62.257 58.958 3.299 1
1 518 . 8 1 1 A 42 42 ILE CB C 42 38.256 39.787 -1.531 1
1 522 . 8 1 1 A 42 42 ILE N N 42 115.050 117.975 -2.925 1
1 523 . 8 1 1 A 43 43 SER H H 43 8.581 8.701 -0.120 1
1 524 . 8 1 1 A 43 43 SER HA H 43 3.957 4.326 -0.369 1
1 527 . 8 1 1 A 43 43 SER C C 43 177.830 176.678 1.152 1
1 528 . 8 1 1 A 43 43 SER CA C 43 61.958 60.706 1.252 1
1 529 . 8 1 1 A 43 43 SER CB C 43 62.680 63.919 -1.239 1
1 530 . 8 1 1 A 43 43 SER N N 43 121.456 116.477 4.979 1
1 531 . 8 1 1 A 44 44 GLY H H 44 8.892 8.735 0.157 1
1 532 . 8 1 1 A 44 44 GLY HA2 H 44 3.514 3.793 -0.279 1
1 533 . 8 1 1 A 44 44 GLY HA3 H 44 3.854 3.810 0.044 1
1 534 . 8 1 1 A 44 44 GLY C C 44 175.296 175.492 -0.196 1
1 535 . 8 1 1 A 44 44 GLY CA C 44 46.854 47.019 -0.165 1
1 536 . 8 1 1 A 44 44 GLY N N 44 106.351 108.647 -2.296 1
1 537 . 8 1 1 A 45 45 LEU H H 45 6.824 8.023 -1.199 1
1 538 . 8 1 1 A 45 45 LEU HA H 45 3.909 4.129 -0.220 1
1 548 . 8 1 1 A 45 45 LEU C C 45 176.738 178.553 -1.815 1
1 549 . 8 1 1 A 45 45 LEU CA C 45 56.356 57.042 -0.686 1
1 550 . 8 1 1 A 45 45 LEU CB C 45 42.296 41.125 1.171 1
1 554 . 8 1 1 A 45 45 LEU N N 45 119.207 123.044 -3.837 1
1 555 . 8 1 1 A 46 46 GLU H H 46 7.556 8.311 -0.755 1
1 556 . 8 1 1 A 46 46 GLU HA H 46 3.664 4.102 -0.438 1
1 561 . 8 1 1 A 46 46 GLU C C 46 179.231 179.641 -0.410 1
1 562 . 8 1 1 A 46 46 GLU CA C 46 62.316 59.589 2.727 1
1 563 . 8 1 1 A 46 46 GLU CB C 46 29.147 29.041 0.106 1
1 565 . 8 1 1 A 46 46 GLU N N 46 119.049 118.582 0.467 1
1 566 . 8 1 1 A 47 47 THR H H 47 8.219 8.087 0.132 1
1 567 . 8 1 1 A 47 47 THR HA H 47 3.965 3.918 0.047 1
1 572 . 8 1 1 A 47 47 THR C C 47 176.251 176.431 -0.180 1
1 573 . 8 1 1 A 47 47 THR CA C 47 65.947 66.477 -0.530 1
1 574 . 8 1 1 A 47 47 THR CB C 47 69.014 68.378 0.636 1
1 576 . 8 1 1 A 47 47 THR N N 47 111.770 117.446 -5.676 1
1 577 . 8 1 1 A 48 48 ALA H H 48 6.794 8.031 -1.237 1
1 578 . 8 1 1 A 48 48 ALA HA H 48 4.171 4.158 0.013 1
1 582 . 8 1 1 A 48 48 ALA C C 48 178.639 180.600 -1.961 1
1 583 . 8 1 1 A 48 48 ALA CA C 48 54.072 55.203 -1.131 1
1 584 . 8 1 1 A 48 48 ALA CB C 48 19.752 18.547 1.205 1
1 585 . 8 1 1 A 48 48 ALA N N 48 122.697 123.707 -1.010 1
1 586 . 8 1 1 A 49 49 LEU H H 49 7.691 8.408 -0.717 1
1 587 . 8 1 1 A 49 49 LEU HA H 49 3.902 4.402 -0.500 1
1 597 . 8 1 1 A 49 49 LEU C C 49 176.823 177.733 -0.910 1
1 598 . 8 1 1 A 49 49 LEU CA C 49 57.190 57.834 -0.644 1
1 599 . 8 1 1 A 49 49 LEU CB C 49 43.628 41.664 1.964 1
1 603 . 8 1 1 A 49 49 LEU N N 49 117.159 118.123 -0.964 1
1 604 . 8 1 1 A 50 50 GLU H H 50 6.963 7.751 -0.788 1
1 605 . 8 1 1 A 50 50 GLU HA H 50 3.220 4.075 -0.855 1
1 610 . 8 1 1 A 50 50 GLU C C 50 176.691 177.558 -0.867 1
1 611 . 8 1 1 A 50 50 GLU CA C 50 58.769 58.608 0.161 1
1 612 . 8 1 1 A 50 50 GLU CB C 50 29.792 29.872 -0.080 1
1 614 . 8 1 1 A 50 50 GLU N N 50 118.761 119.615 -0.854 1
1 615 . 8 1 1 A 51 51 GLY H H 51 8.541 8.493 0.048 1
1 616 . 8 1 1 A 51 51 GLY HA2 H 51 4.140 3.974 0.166 1
1 617 . 8 1 1 A 51 51 GLY HA3 H 51 3.488 3.975 -0.487 1
1 618 . 8 1 1 A 51 51 GLY C C 51 173.801 173.572 0.229 1
1 619 . 8 1 1 A 51 51 GLY CA C 51 45.498 45.593 -0.095 1
1 620 . 8 1 1 A 51 51 GLY N N 51 113.511 111.897 1.614 1
1 621 . 8 1 1 A 52 52 HIS H H 52 7.656 7.491 0.165 1
1 622 . 8 1 1 A 52 52 HIS HA H 52 4.318 5.212 -0.894 1
1 627 . 8 1 1 A 52 52 HIS C C 52 172.815 173.264 -0.449 1
1 628 . 8 1 1 A 52 52 HIS CA C 52 57.562 53.700 3.862 1
1 629 . 8 1 1 A 52 52 HIS CB C 52 28.670 32.655 -3.985 1
1 632 . 8 1 1 A 52 52 HIS N N 52 116.844 115.224 1.620 1
1 633 . 8 1 1 A 53 53 GLU H H 53 8.331 8.606 -0.275 1
1 634 . 8 1 1 A 53 53 GLU HA H 53 4.636 4.700 -0.064 1
1 639 . 8 1 1 A 53 53 GLU C C 53 176.145 175.906 0.239 1
1 640 . 8 1 1 A 53 53 GLU CA C 53 54.891 54.645 0.246 1
1 641 . 8 1 1 A 53 53 GLU CB C 53 33.837 31.953 1.884 1
1 643 . 8 1 1 A 53 53 GLU N N 53 118.873 119.642 -0.769 1
1 644 . 8 1 1 A 54 54 VAL H H 54 8.585 8.370 0.215 1
1 645 . 8 1 1 A 54 54 VAL HA H 54 3.227 3.938 -0.711 1
1 653 . 8 1 1 A 54 54 VAL C C 54 177.218 176.433 0.785 1
1 654 . 8 1 1 A 54 54 VAL CA C 54 65.848 63.392 2.456 1
1 655 . 8 1 1 A 54 54 VAL CB C 54 31.189 31.419 -0.230 1
1 658 . 8 1 1 A 54 54 VAL N N 54 120.580 121.055 -0.475 1
1 659 . 8 1 1 A 55 55 GLY H H 55 8.912 8.693 0.219 1
1 660 . 8 1 1 A 55 55 GLY HA2 H 55 4.441 4.023 0.418 1
1 661 . 8 1 1 A 55 55 GLY HA3 H 55 3.865 4.027 -0.162 1
1 662 . 8 1 1 A 55 55 GLY C C 55 174.827 174.035 0.792 1
1 663 . 8 1 1 A 55 55 GLY CA C 55 44.370 44.745 -0.375 1
1 664 . 8 1 1 A 55 55 GLY N N 55 118.078 115.105 2.973 1
1 665 . 8 1 1 A 56 56 ASP H H 56 8.098 7.680 0.418 1
1 666 . 8 1 1 A 56 56 ASP HA H 56 4.547 4.733 -0.186 1
1 669 . 8 1 1 A 56 56 ASP C C 56 174.859 175.313 -0.454 1
1 670 . 8 1 1 A 56 56 ASP CA C 56 55.629 54.263 1.366 1
1 671 . 8 1 1 A 56 56 ASP CB C 56 40.906 41.786 -0.880 1
1 672 . 8 1 1 A 56 56 ASP N N 56 123.094 122.039 1.055 1
1 673 . 8 1 1 A 57 57 LYS H H 57 8.168 8.735 -0.567 1
1 674 . 8 1 1 A 57 57 LYS HA H 57 5.471 6.061 -0.590 1
1 683 . 8 1 1 A 57 57 LYS C C 57 175.732 175.004 0.728 1
1 684 . 8 1 1 A 57 57 LYS CA C 57 55.056 55.297 -0.241 1
1 685 . 8 1 1 A 57 57 LYS CB C 57 35.302 36.119 -0.817 1
1 689 . 8 1 1 A 57 57 LYS N N 57 122.301 125.232 -2.931 1
1 690 . 8 1 1 A 58 58 PHE H H 58 8.355 8.522 -0.167 1
1 691 . 8 1 1 A 58 58 PHE HA H 58 4.858 5.139 -0.281 1
1 699 . 8 1 1 A 58 58 PHE C C 58 171.549 172.348 -0.799 1
1 700 . 8 1 1 A 58 58 PHE CA C 58 56.195 56.581 -0.386 1
1 701 . 8 1 1 A 58 58 PHE CB C 58 39.335 39.830 -0.495 1
1 705 . 8 1 1 A 58 58 PHE N N 58 121.026 120.921 0.105 1
1 706 . 8 1 1 A 59 59 ASP H H 59 8.407 8.946 -0.539 1
1 707 . 8 1 1 A 59 59 ASP HA H 59 5.743 5.786 -0.043 1
1 710 . 8 1 1 A 59 59 ASP C C 59 176.302 175.267 1.035 1
1 711 . 8 1 1 A 59 59 ASP CA C 59 52.579 52.800 -0.221 1
1 712 . 8 1 1 A 59 59 ASP CB C 59 43.628 42.649 0.979 1
1 713 . 8 1 1 A 59 59 ASP N N 59 119.234 119.581 -0.347 1
1 714 . 8 1 1 A 60 60 VAL H H 60 8.915 9.383 -0.468 1
1 715 . 8 1 1 A 60 60 VAL HA H 60 4.374 5.102 -0.728 1
1 723 . 8 1 1 A 60 60 VAL C C 60 173.140 174.911 -1.771 1
1 724 . 8 1 1 A 60 60 VAL CA C 60 61.252 60.280 0.972 1
1 725 . 8 1 1 A 60 60 VAL CB C 60 35.620 35.384 0.236 1
1 728 . 8 1 1 A 60 60 VAL N N 60 119.758 121.333 -1.575 1
1 729 . 8 1 1 A 61 61 ALA H H 61 8.761 8.993 -0.232 1
1 730 . 8 1 1 A 61 61 ALA HA H 61 5.091 5.393 -0.302 1
1 734 . 8 1 1 A 61 61 ALA C C 61 176.460 176.196 0.264 1
1 735 . 8 1 1 A 61 61 ALA CA C 61 51.019 51.085 -0.066 1
1 736 . 8 1 1 A 61 61 ALA CB C 61 19.447 21.446 -1.999 1
1 737 . 8 1 1 A 61 61 ALA N N 61 133.341 127.721 5.620 1
1 738 . 8 1 1 A 62 62 VAL H H 62 8.929 8.918 0.011 1
1 739 . 8 1 1 A 62 62 VAL HA H 62 4.236 4.720 -0.484 1
1 747 . 8 1 1 A 62 62 VAL C C 62 174.733 175.401 -0.668 1
1 748 . 8 1 1 A 62 62 VAL CA C 62 61.007 60.710 0.297 1
1 749 . 8 1 1 A 62 62 VAL CB C 62 34.387 36.316 -1.929 1
1 752 . 8 1 1 A 62 62 VAL N N 62 124.165 122.609 1.556 1
1 753 . 8 1 1 A 63 63 GLY H H 63 8.995 8.671 0.324 1
1 754 . 8 1 1 A 63 63 GLY HA2 H 63 4.229 4.107 0.122 1
1 755 . 8 1 1 A 63 63 GLY HA3 H 63 3.637 4.119 -0.482 1
1 756 . 8 1 1 A 63 63 GLY C C 63 175.306 174.891 0.415 1
1 757 . 8 1 1 A 63 63 GLY CA C 63 44.620 45.233 -0.613 1
1 758 . 8 1 1 A 63 63 GLY N N 63 115.598 111.795 3.803 1
1 759 . 8 1 1 A 64 64 ALA H H 64 8.106 9.222 -1.116 1
1 760 . 8 1 1 A 64 64 ALA HA H 64 4.010 4.070 -0.060 1
1 764 . 8 1 1 A 64 64 ALA C C 64 180.218 179.267 0.951 1
1 765 . 8 1 1 A 64 64 ALA CA C 64 55.897 54.640 1.257 1
1 766 . 8 1 1 A 64 64 ALA CB C 64 18.347 18.354 -0.007 1
1 767 . 8 1 1 A 64 64 ALA N N 64 122.859 123.920 -1.061 1
1 768 . 8 1 1 A 65 65 ASN H H 65 8.748 8.658 0.090 1
1 769 . 8 1 1 A 65 65 ASN HA H 65 4.230 4.500 -0.270 1
1 774 . 8 1 1 A 65 65 ASN C C 65 176.085 175.534 0.551 1
1 775 . 8 1 1 A 65 65 ASN CA C 65 56.064 54.828 1.236 1
1 776 . 8 1 1 A 65 65 ASN CB C 65 37.871 36.648 1.223 1
1 777 . 8 1 1 A 65 65 ASN N N 65 114.590 114.116 0.474 1
1 779 . 8 1 1 A 66 66 ASP H H 66 7.598 8.171 -0.573 1
1 780 . 8 1 1 A 66 66 ASP HA H 66 4.682 4.741 -0.059 1
1 783 . 8 1 1 A 66 66 ASP C C 66 173.061 175.764 -2.703 1
1 784 . 8 1 1 A 66 66 ASP CA C 66 53.549 54.329 -0.780 1
1 785 . 8 1 1 A 66 66 ASP CB C 66 42.204 41.803 0.401 1
1 786 . 8 1 1 A 66 66 ASP N N 66 118.065 118.936 -0.871 1
1 787 . 8 1 1 A 67 67 ALA H H 67 7.434 7.875 -0.441 1
1 788 . 8 1 1 A 67 67 ALA HA H 67 4.316 4.754 -0.438 1
1 792 . 8 1 1 A 67 67 ALA C C 67 175.615 176.829 -1.214 1
1 793 . 8 1 1 A 67 67 ALA CA C 67 50.814 52.285 -1.471 1
1 794 . 8 1 1 A 67 67 ALA CB C 67 18.618 20.130 -1.512 1
1 795 . 8 1 1 A 67 67 ALA N N 67 124.890 122.358 2.532 1
1 796 . 8 1 1 A 68 68 TYR H H 68 8.390 8.226 0.164 1
1 797 . 8 1 1 A 68 68 TYR HA H 68 4.195 4.910 -0.715 1
1 804 . 8 1 1 A 68 68 TYR C C 68 174.964 174.444 0.520 1
1 805 . 8 1 1 A 68 68 TYR CA C 68 59.566 56.591 2.975 1
1 806 . 8 1 1 A 68 68 TYR CB C 68 36.992 40.625 -3.633 1
1 809 . 8 1 1 A 68 68 TYR N N 68 121.083 112.957 8.126 1
1 810 . 8 1 1 A 69 69 GLY H H 69 8.149 8.776 -0.627 1
1 811 . 8 1 1 A 69 69 GLY HA2 H 69 4.254 3.780 0.474 1
1 812 . 8 1 1 A 69 69 GLY HA3 H 69 3.624 3.924 -0.300 1
1 813 . 8 1 1 A 69 69 GLY C C 69 173.161 174.863 -1.702 1
1 814 . 8 1 1 A 69 69 GLY CA C 69 44.465 45.664 -1.199 1
1 815 . 8 1 1 A 69 69 GLY N N 69 108.762 109.036 -0.274 1
1 816 . 8 1 1 A 70 70 GLN H H 70 8.450 7.791 0.659 1
1 817 . 8 1 1 A 70 70 GLN HA H 70 4.140 4.327 -0.187 1
1 824 . 8 1 1 A 70 70 GLN C C 70 176.138 174.743 1.395 1
1 825 . 8 1 1 A 70 70 GLN CA C 70 54.680 56.162 -1.482 1
1 826 . 8 1 1 A 70 70 GLN CB C 70 29.210 29.276 -0.066 1
1 828 . 8 1 1 A 70 70 GLN N N 70 117.002 120.172 -3.170 1
1 830 . 8 1 1 A 71 71 TYR H H 71 8.991 8.825 0.166 1
1 831 . 8 1 1 A 71 71 TYR HA H 71 3.752 5.211 -1.459 1
1 838 . 8 1 1 A 71 71 TYR C C 71 174.548 173.812 0.736 1
1 839 . 8 1 1 A 71 71 TYR CA C 71 59.868 56.507 3.361 1
1 840 . 8 1 1 A 71 71 TYR CB C 71 38.961 40.623 -1.662 1
1 843 . 8 1 1 A 71 71 TYR N N 71 125.112 126.383 -1.271 1
1 844 . 8 1 1 A 72 72 ASP H H 72 8.819 8.614 0.205 1
1 845 . 8 1 1 A 72 72 ASP HA H 72 4.773 4.889 -0.116 1
1 848 . 8 1 1 A 72 72 ASP C C 72 177.709 176.593 1.116 1
1 849 . 8 1 1 A 72 72 ASP CA C 72 52.382 52.335 0.047 1
1 850 . 8 1 1 A 72 72 ASP CB C 72 42.197 40.386 1.811 1
1 851 . 8 1 1 A 72 72 ASP N N 72 129.918 129.154 0.764 1
1 852 . 8 1 1 A 73 73 GLU H H 73 9.409 8.894 0.515 1
1 853 . 8 1 1 A 73 73 GLU HA H 73 3.937 4.338 -0.401 1
1 858 . 8 1 1 A 73 73 GLU C C 73 177.581 177.189 0.392 1
1 859 . 8 1 1 A 73 73 GLU CA C 73 58.962 58.454 0.508 1
1 860 . 8 1 1 A 73 73 GLU CB C 73 29.155 28.336 0.819 1
1 862 . 8 1 1 A 73 73 GLU N N 73 129.624 124.692 4.932 1
1 863 . 8 1 1 A 74 74 ASN H H 74 8.700 8.212 0.488 1
1 864 . 8 1 1 A 74 74 ASN HA H 74 4.550 4.623 -0.073 1
1 869 . 8 1 1 A 74 74 ASN C C 74 176.190 177.444 -1.254 1
1 870 . 8 1 1 A 74 74 ASN CA C 74 54.932 54.961 -0.029 1
1 871 . 8 1 1 A 74 74 ASN CB C 74 38.113 37.899 0.214 1
1 872 . 8 1 1 A 74 74 ASN N N 74 116.792 117.677 -0.885 1
1 874 . 8 1 1 A 75 75 LEU H H 75 7.303 7.820 -0.517 1
1 875 . 8 1 1 A 75 75 LEU HA H 75 4.289 4.319 -0.030 1
1 885 . 8 1 1 A 75 75 LEU C C 75 175.821 176.752 -0.931 1
1 886 . 8 1 1 A 75 75 LEU CA C 75 54.106 56.205 -2.099 1
1 887 . 8 1 1 A 75 75 LEU CB C 75 41.239 42.617 -1.378 1
1 891 . 8 1 1 A 75 75 LEU N N 75 117.094 120.207 -3.113 1
1 892 . 8 1 1 A 76 76 VAL H H 76 7.181 7.079 0.102 1
1 893 . 8 1 1 A 76 76 VAL HA H 76 4.970 4.111 0.859 1
1 901 . 8 1 1 A 76 76 VAL C C 76 175.702 174.813 0.889 1
1 902 . 8 1 1 A 76 76 VAL CA C 76 61.733 62.447 -0.714 1
1 903 . 8 1 1 A 76 76 VAL CB C 76 31.822 32.337 -0.515 1
1 905 . 8 1 1 A 76 76 VAL N N 76 124.716 119.262 5.454 1
1 906 . 8 1 1 A 77 77 GLN H H 77 8.791 8.717 0.074 1
1 907 . 8 1 1 A 77 77 GLN HA H 77 4.695 5.010 -0.315 1
1 914 . 8 1 1 A 77 77 GLN C C 77 173.553 173.107 0.446 1
1 915 . 8 1 1 A 77 77 GLN CA C 77 54.038 54.456 -0.418 1
1 916 . 8 1 1 A 77 77 GLN CB C 77 33.018 32.374 0.644 1
1 918 . 8 1 1 A 77 77 GLN N N 77 124.898 124.622 0.276 1
1 920 . 8 1 1 A 78 78 ARG H H 78 8.530 8.436 0.094 1
1 921 . 8 1 1 A 78 78 ARG HA H 78 5.107 5.605 -0.498 1
1 928 . 8 1 1 A 78 78 ARG C C 78 176.182 175.250 0.932 1
1 929 . 8 1 1 A 78 78 ARG CA C 78 55.355 54.589 0.766 1
1 930 . 8 1 1 A 78 78 ARG CB C 78 31.150 33.716 -2.566 1
1 933 . 8 1 1 A 78 78 ARG N N 78 123.413 119.353 4.060 1
1 934 . 8 1 1 A 79 79 VAL H H 79 9.300 9.210 0.090 1
1 935 . 8 1 1 A 79 79 VAL HA H 79 4.824 4.604 0.220 1
1 943 . 8 1 1 A 79 79 VAL CA C 79 58.731 59.055 -0.324 1
1 944 . 8 1 1 A 79 79 VAL CB C 79 34.836 35.559 -0.723 1
1 947 . 8 1 1 A 79 79 VAL N N 79 125.252 121.500 3.752 1
1 948 . 8 1 1 A 80 80 PRO HA H 80 4.339 4.663 -0.324 1
1 955 . 8 1 1 A 80 80 PRO C C 80 176.902 178.002 -1.100 1
1 956 . 8 1 1 A 80 80 PRO CA C 80 62.969 63.166 -0.197 1
1 957 . 8 1 1 A 80 80 PRO CB C 80 32.431 32.282 0.149 1
1 960 . 8 1 1 A 81 81 LYS H H 81 7.816 9.085 -1.269 1
1 961 . 8 1 1 A 81 81 LYS HA H 81 3.790 4.011 -0.221 1
1 970 . 8 1 1 A 81 81 LYS C C 81 177.808 178.919 -1.111 1
1 971 . 8 1 1 A 81 81 LYS CA C 81 59.874 60.004 -0.130 1
1 972 . 8 1 1 A 81 81 LYS CB C 81 32.670 32.127 0.543 1
1 976 . 8 1 1 A 81 81 LYS N N 81 120.948 124.976 -4.028 1
1 977 . 8 1 1 A 82 82 ASP H H 82 8.069 8.127 -0.058 1
1 978 . 8 1 1 A 82 82 ASP HA H 82 4.243 4.367 -0.124 1
1 981 . 8 1 1 A 82 82 ASP C C 82 177.157 178.768 -1.611 1
1 982 . 8 1 1 A 82 82 ASP CA C 82 55.527 57.270 -1.743 1
1 983 . 8 1 1 A 82 82 ASP CB C 82 40.005 41.305 -1.300 1
1 984 . 8 1 1 A 82 82 ASP N N 82 116.004 119.863 -3.859 1
1 985 . 8 1 1 A 83 83 VAL H H 83 7.150 7.598 -0.448 1
1 986 . 8 1 1 A 83 83 VAL HA H 83 3.719 3.514 0.205 1
1 994 . 8 1 1 A 83 83 VAL C C 83 176.346 176.699 -0.353 1
1 995 . 8 1 1 A 83 83 VAL CA C 83 63.868 65.637 -1.769 1
1 996 . 8 1 1 A 83 83 VAL CB C 83 31.689 31.452 0.237 1
1 999 . 8 1 1 A 83 83 VAL N N 83 117.199 119.033 -1.834 1
1 1000 . 8 1 1 A 84 84 PHE H H 84 7.365 7.406 -0.041 1
1 1001 . 8 1 1 A 84 84 PHE HA H 84 4.389 4.706 -0.317 1
1 1009 . 8 1 1 A 84 84 PHE C C 84 175.265 176.102 -0.837 1
1 1010 . 8 1 1 A 84 84 PHE CA C 84 57.210 56.850 0.360 1
1 1011 . 8 1 1 A 84 84 PHE CB C 84 38.968 38.280 0.688 1
1 1015 . 8 1 1 A 84 84 PHE N N 84 119.897 116.907 2.990 1
1 1016 . 8 1 1 A 85 85 MET H H 85 7.765 7.988 -0.223 1
1 1017 . 8 1 1 A 85 85 MET HA H 85 4.277 4.321 -0.044 1
1 1025 . 8 1 1 A 85 85 MET C C 85 176.856 177.453 -0.597 1
1 1026 . 8 1 1 A 85 85 MET CA C 85 56.389 57.694 -1.305 1
1 1027 . 8 1 1 A 85 85 MET CB C 85 32.715 32.420 0.295 1
1 1030 . 8 1 1 A 85 85 MET N N 85 121.131 119.266 1.865 1
1 1031 . 8 1 1 A 86 86 GLY H H 86 8.499 8.216 0.283 1
1 1032 . 8 1 1 A 86 86 GLY HA2 H 86 3.928 3.953 -0.025 1
1 1033 . 8 1 1 A 86 86 GLY HA3 H 86 3.793 3.955 -0.162 1
1 1034 . 8 1 1 A 86 86 GLY C C 86 174.168 174.051 0.117 1
1 1035 . 8 1 1 A 86 86 GLY CA C 86 45.637 45.278 0.359 1
1 1036 . 8 1 1 A 86 86 GLY N N 86 111.268 108.039 3.229 1
1 1037 . 8 1 1 A 87 87 VAL H H 87 7.564 7.846 -0.282 1
1 1038 . 8 1 1 A 87 87 VAL HA H 87 4.083 4.046 0.037 1
1 1046 . 8 1 1 A 87 87 VAL C C 87 175.649 175.877 -0.228 1
1 1047 . 8 1 1 A 87 87 VAL CA C 87 61.809 61.704 0.105 1
1 1048 . 8 1 1 A 87 87 VAL CB C 87 32.667 32.507 0.160 1
1 1051 . 8 1 1 A 87 87 VAL N N 87 118.839 120.343 -1.504 1
1 1052 . 8 1 1 A 88 88 ASP H H 88 8.270 8.783 -0.513 1
1 1053 . 8 1 1 A 88 88 ASP HA H 88 4.421 4.270 0.151 1
1 1056 . 8 1 1 A 88 88 ASP C C 88 175.977 175.129 0.848 1
1 1057 . 8 1 1 A 88 88 ASP CA C 88 55.655 57.137 -1.482 1
1 1058 . 8 1 1 A 88 88 ASP CB C 88 41.364 41.253 0.111 1
1 1059 . 8 1 1 A 88 88 ASP N N 88 124.401 125.248 -0.847 1
1 1060 . 8 1 1 A 89 89 GLU H H 89 7.833 8.050 -0.217 1
1 1061 . 8 1 1 A 89 89 GLU HA H 89 4.206 4.677 -0.471 1
1 1066 . 8 1 1 A 89 89 GLU C C 89 174.912 175.396 -0.484 1
1 1067 . 8 1 1 A 89 89 GLU CA C 89 55.739 55.032 0.707 1
1 1068 . 8 1 1 A 89 89 GLU CB C 89 30.603 31.498 -0.895 1
1 1070 . 8 1 1 A 89 89 GLU N N 89 119.378 116.113 3.265 1
1 1071 . 8 1 1 A 90 90 LEU H H 90 8.051 8.732 -0.681 1
1 1072 . 8 1 1 A 90 90 LEU HA H 90 4.127 4.347 -0.220 1
1 1082 . 8 1 1 A 90 90 LEU C C 90 175.753 175.873 -0.120 1
1 1083 . 8 1 1 A 90 90 LEU CA C 90 54.929 55.425 -0.496 1
1 1084 . 8 1 1 A 90 90 LEU CB C 90 42.710 41.185 1.525 1
1 1088 . 8 1 1 A 90 90 LEU N N 90 124.432 126.690 -2.258 1
1 1089 . 8 1 1 A 91 91 GLN H H 91 7.341 8.783 -1.442 1
1 1090 . 8 1 1 A 91 91 GLN HA H 91 4.546 4.969 -0.423 1
1 1097 . 8 1 1 A 91 91 GLN C C 91 174.655 174.405 0.250 1
1 1098 . 8 1 1 A 91 91 GLN CA C 91 53.671 54.011 -0.340 1
1 1099 . 8 1 1 A 91 91 GLN CB C 91 32.850 32.456 0.394 1
1 1101 . 8 1 1 A 91 91 GLN N N 91 120.186 126.056 -5.870 1
1 1103 . 8 1 1 A 92 92 VAL H H 92 8.442 8.516 -0.074 1
1 1104 . 8 1 1 A 92 92 VAL HA H 92 3.278 3.864 -0.586 1
1 1112 . 8 1 1 A 92 92 VAL C C 92 177.098 177.216 -0.118 1
1 1113 . 8 1 1 A 92 92 VAL CA C 92 64.953 64.510 0.443 1
1 1114 . 8 1 1 A 92 92 VAL CB C 92 31.601 31.700 -0.099 1
1 1117 . 8 1 1 A 92 92 VAL N N 92 121.899 123.529 -1.630 1
1 1118 . 8 1 1 A 93 93 GLY H H 93 9.002 9.585 -0.583 1
1 1119 . 8 1 1 A 93 93 GLY HA2 H 93 4.327 3.948 0.379 1
1 1120 . 8 1 1 A 93 93 GLY HA3 H 93 3.770 3.962 -0.192 1
1 1121 . 8 1 1 A 93 93 GLY C C 93 174.547 174.321 0.226 1
1 1122 . 8 1 1 A 93 93 GLY CA C 93 44.446 45.108 -0.662 1
1 1123 . 8 1 1 A 93 93 GLY N N 93 116.485 115.212 1.273 1
1 1124 . 8 1 1 A 94 94 MET H H 94 7.445 7.410 0.035 1
1 1125 . 8 1 1 A 94 94 MET HA H 94 4.182 4.513 -0.331 1
1 1133 . 8 1 1 A 94 94 MET C C 94 174.531 174.923 -0.392 1
1 1134 . 8 1 1 A 94 94 MET CA C 94 57.193 55.754 1.439 1
1 1135 . 8 1 1 A 94 94 MET CB C 94 34.474 33.313 1.161 1
1 1138 . 8 1 1 A 94 94 MET N N 94 120.304 120.327 -0.023 1
1 1139 . 8 1 1 A 95 95 ARG H H 95 8.169 8.644 -0.475 1
1 1140 . 8 1 1 A 95 95 ARG HA H 95 5.343 4.842 0.501 1
1 1147 . 8 1 1 A 95 95 ARG C C 95 175.593 175.003 0.590 1
1 1148 . 8 1 1 A 95 95 ARG CA C 95 54.898 54.512 0.386 1
1 1149 . 8 1 1 A 95 95 ARG CB C 95 32.928 33.030 -0.102 1
1 1152 . 8 1 1 A 95 95 ARG N N 95 122.066 122.908 -0.842 1
1 1153 . 8 1 1 A 96 96 PHE H H 96 8.440 8.037 0.403 1
1 1154 . 8 1 1 A 96 96 PHE HA H 96 4.738 5.050 -0.312 1
1 1162 . 8 1 1 A 96 96 PHE C C 96 173.273 172.247 1.026 1
1 1163 . 8 1 1 A 96 96 PHE CA C 96 56.174 56.163 0.011 1
1 1164 . 8 1 1 A 96 96 PHE CB C 96 42.474 40.567 1.907 1
1 1168 . 8 1 1 A 96 96 PHE N N 96 119.938 118.785 1.153 1
1 1169 . 8 1 1 A 97 97 LEU H H 97 8.459 8.765 -0.306 1
1 1170 . 8 1 1 A 97 97 LEU HA H 97 4.625 4.969 -0.344 1
1 1180 . 8 1 1 A 97 97 LEU C C 97 175.664 176.462 -0.798 1
1 1181 . 8 1 1 A 97 97 LEU CA C 97 53.547 54.139 -0.592 1
1 1182 . 8 1 1 A 97 97 LEU CB C 97 42.379 43.370 -0.991 1
1 1186 . 8 1 1 A 97 97 LEU N N 97 122.014 121.123 0.891 1
1 1187 . 8 1 1 A 98 98 ALA H H 98 8.812 9.064 -0.252 1
1 1188 . 8 1 1 A 98 98 ALA HA H 98 4.520 5.389 -0.869 1
1 1192 . 8 1 1 A 98 98 ALA C C 98 176.373 175.918 0.455 1
1 1193 . 8 1 1 A 98 98 ALA CA C 98 50.639 50.524 0.115 1
1 1194 . 8 1 1 A 98 98 ALA CB C 98 20.939 21.087 -0.148 1
1 1195 . 8 1 1 A 98 98 ALA N N 98 129.296 127.550 1.746 1
1 1196 . 8 1 1 A 99 99 GLU H H 99 8.504 9.045 -0.541 1
1 1197 . 8 1 1 A 99 99 GLU HA H 99 4.150 4.699 -0.549 1
1 1202 . 8 1 1 A 99 99 GLU C C 99 176.351 176.455 -0.104 1
1 1203 . 8 1 1 A 99 99 GLU CA C 99 56.830 55.822 1.008 1
1 1204 . 8 1 1 A 99 99 GLU CB C 99 29.639 29.920 -0.281 1
1 1206 . 8 1 1 A 99 99 GLU N N 99 121.993 123.319 -1.326 1
1 1207 . 8 1 1 A 100 100 THR H H 100 7.393 8.646 -1.253 1
1 1208 . 8 1 1 A 100 100 THR HA H 100 4.819 4.786 0.033 1
1 1213 . 8 1 1 A 100 100 THR C C 100 175.882 175.840 0.042 1
1 1214 . 8 1 1 A 100 100 THR CA C 100 60.329 60.334 -0.005 1
1 1215 . 8 1 1 A 100 100 THR CB C 100 73.452 71.144 2.308 1
1 1217 . 8 1 1 A 100 100 THR N N 100 115.598 117.798 -2.200 1
1 1218 . 8 1 1 A 101 101 ASP H H 101 8.988 8.809 0.179 1
1 1219 . 8 1 1 A 101 101 ASP HA H 101 4.357 4.336 0.021 1
1 1222 . 8 1 1 A 101 101 ASP C C 101 176.848 177.310 -0.462 1
1 1223 . 8 1 1 A 101 101 ASP CA C 101 56.493 57.996 -1.503 1
1 1224 . 8 1 1 A 101 101 ASP CB C 101 39.973 40.531 -0.558 1
1 1225 . 8 1 1 A 101 101 ASP N N 101 121.468 121.230 0.238 1
1 1226 . 8 1 1 A 102 102 GLN H H 102 7.937 7.989 -0.052 1
1 1227 . 8 1 1 A 102 102 GLN HA H 102 4.415 4.321 0.094 1
1 1234 . 8 1 1 A 102 102 GLN C C 102 175.252 175.978 -0.726 1
1 1235 . 8 1 1 A 102 102 GLN CA C 102 55.097 54.913 0.184 1
1 1236 . 8 1 1 A 102 102 GLN CB C 102 29.121 27.497 1.624 1
1 1238 . 8 1 1 A 102 102 GLN N N 102 117.199 113.911 3.288 1
1 1240 . 8 1 1 A 103 103 GLY H H 103 7.431 7.917 -0.486 1
1 1241 . 8 1 1 A 103 103 GLY HA2 H 103 4.504 4.156 0.348 1
1 1242 . 8 1 1 A 103 103 GLY HA3 H 103 3.868 4.158 -0.290 1
1 1243 . 8 1 1 A 103 103 GLY CA C 103 44.051 44.438 -0.387 1
1 1244 . 8 1 1 A 103 103 GLY N N 103 110.056 110.536 -0.480 1
1 1245 . 8 1 1 A 104 104 PRO HA H 104 5.057 5.171 -0.114 1
1 1252 . 8 1 1 A 104 104 PRO C C 104 177.873 175.467 2.406 1
1 1253 . 8 1 1 A 104 104 PRO CA C 104 62.464 62.846 -0.382 1
1 1254 . 8 1 1 A 104 104 PRO CB C 104 31.939 32.654 -0.715 1
1 1257 . 8 1 1 A 105 105 VAL H H 105 8.960 8.625 0.335 1
1 1258 . 8 1 1 A 105 105 VAL HA H 105 4.678 4.548 0.130 1
1 1266 . 8 1 1 A 105 105 VAL CA C 105 58.474 59.200 -0.726 1
1 1267 . 8 1 1 A 105 105 VAL CB C 105 35.512 35.223 0.289 1
1 1270 . 8 1 1 A 105 105 VAL N N 105 123.240 122.286 0.954 1
1 1271 . 8 1 1 A 106 106 PRO HA H 106 4.777 4.824 -0.047 1
1 1278 . 8 1 1 A 106 106 PRO C C 106 176.823 176.181 0.642 1
1 1279 . 8 1 1 A 106 106 PRO CA C 106 62.508 62.258 0.250 1
1 1280 . 8 1 1 A 106 106 PRO CB C 106 31.650 31.481 0.169 1
1 1283 . 8 1 1 A 107 107 VAL H H 107 8.835 7.808 1.027 1
1 1284 . 8 1 1 A 107 107 VAL HA H 107 4.719 4.884 -0.165 1
1 1292 . 8 1 1 A 107 107 VAL C C 107 173.661 173.374 0.287 1
1 1293 . 8 1 1 A 107 107 VAL CA C 107 59.026 59.105 -0.079 1
1 1294 . 8 1 1 A 107 107 VAL CB C 107 36.406 34.818 1.588 1
1 1297 . 8 1 1 A 107 107 VAL N N 107 117.474 117.115 0.359 1
1 1298 . 8 1 1 A 108 108 GLU H H 108 7.698 8.451 -0.753 1
1 1299 . 8 1 1 A 108 108 GLU HA H 108 5.133 4.913 0.220 1
1 1304 . 8 1 1 A 108 108 GLU C C 108 176.394 175.429 0.965 1
1 1305 . 8 1 1 A 108 108 GLU CA C 108 53.808 54.334 -0.526 1
1 1306 . 8 1 1 A 108 108 GLU CB C 108 33.984 32.869 1.115 1
1 1308 . 8 1 1 A 108 108 GLU N N 108 120.646 121.689 -1.043 1
1 1309 . 8 1 1 A 109 109 ILE H H 109 8.690 8.958 -0.268 1
1 1310 . 8 1 1 A 109 109 ILE HA H 109 4.484 4.370 0.114 1
1 1320 . 8 1 1 A 109 109 ILE C C 109 177.313 177.022 0.291 1
1 1321 . 8 1 1 A 109 109 ILE CA C 109 61.789 61.438 0.351 1
1 1322 . 8 1 1 A 109 109 ILE CB C 109 36.628 37.670 -1.042 1
1 1326 . 8 1 1 A 109 109 ILE N N 109 124.739 127.404 -2.665 1
1 1327 . 8 1 1 A 110 110 THR H H 110 9.300 9.699 -0.399 1
1 1328 . 8 1 1 A 110 110 THR HA H 110 4.547 4.634 -0.087 1
1 1333 . 8 1 1 A 110 110 THR C C 110 174.904 174.423 0.481 1
1 1334 . 8 1 1 A 110 110 THR CA C 110 62.260 61.122 1.138 1
1 1335 . 8 1 1 A 110 110 THR CB C 110 69.100 69.550 -0.450 1
1 1337 . 8 1 1 A 110 110 THR N N 110 122.544 117.784 4.760 1
1 1338 . 8 1 1 A 111 111 ALA H H 111 7.673 7.529 0.144 1
1 1339 . 8 1 1 A 111 111 ALA HA H 111 4.367 4.577 -0.210 1
1 1343 . 8 1 1 A 111 111 ALA C C 111 175.019 175.075 -0.056 1
1 1344 . 8 1 1 A 111 111 ALA CA C 111 53.125 51.861 1.264 1
1 1345 . 8 1 1 A 111 111 ALA CB C 111 21.539 22.349 -0.810 1
1 1346 . 8 1 1 A 111 111 ALA N N 111 123.153 120.676 2.477 1
1 1347 . 8 1 1 A 112 112 VAL H H 112 8.707 8.409 0.298 1
1 1348 . 8 1 1 A 112 112 VAL HA H 112 4.129 4.605 -0.476 1
1 1356 . 8 1 1 A 112 112 VAL C C 112 174.755 174.973 -0.218 1
1 1357 . 8 1 1 A 112 112 VAL CA C 112 62.898 61.623 1.275 1
1 1358 . 8 1 1 A 112 112 VAL CB C 112 33.379 34.535 -1.156 1
1 1361 . 8 1 1 A 112 112 VAL N N 112 122.369 119.994 2.375 1
1 1362 . 8 1 1 A 113 113 GLU H H 113 8.144 9.016 -0.872 1
1 1363 . 8 1 1 A 113 113 GLU HA H 113 4.645 4.608 0.037 1
1 1368 . 8 1 1 A 113 113 GLU C C 113 175.102 177.157 -2.055 1
1 1369 . 8 1 1 A 113 113 GLU CA C 113 54.080 55.012 -0.932 1
1 1370 . 8 1 1 A 113 113 GLU CB C 113 31.234 31.121 0.113 1
1 1372 . 8 1 1 A 113 113 GLU N N 113 127.435 127.288 0.147 1
1 1373 . 8 1 1 A 114 114 ASP H H 114 8.472 8.500 -0.028 1
1 1374 . 8 1 1 A 114 114 ASP HA H 114 4.209 4.345 -0.136 1
1 1377 . 8 1 1 A 114 114 ASP C C 114 177.679 177.237 0.442 1
1 1378 . 8 1 1 A 114 114 ASP CA C 114 58.334 56.449 1.885 1
1 1379 . 8 1 1 A 114 114 ASP CB C 114 40.347 41.023 -0.676 1
1 1380 . 8 1 1 A 114 114 ASP N N 114 119.844 120.788 -0.944 1
1 1381 . 8 1 1 A 115 115 ASP H H 115 8.475 7.898 0.577 1
1 1382 . 8 1 1 A 115 115 ASP HA H 115 4.848 4.871 -0.023 1
1 1385 . 8 1 1 A 115 115 ASP C C 115 175.968 175.007 0.961 1
1 1386 . 8 1 1 A 115 115 ASP CA C 115 53.290 53.403 -0.113 1
1 1387 . 8 1 1 A 115 115 ASP CB C 115 42.080 43.304 -1.224 1
1 1388 . 8 1 1 A 115 115 ASP N N 115 114.364 114.321 0.043 1
1 1389 . 8 1 1 A 116 116 HIS H H 116 7.185 7.665 -0.480 1
1 1390 . 8 1 1 A 116 116 HIS HA H 116 5.106 5.515 -0.409 1
1 1395 . 8 1 1 A 116 116 HIS C C 116 172.393 172.797 -0.404 1
1 1396 . 8 1 1 A 116 116 HIS CA C 116 56.099 54.305 1.794 1
1 1397 . 8 1 1 A 116 116 HIS CB C 116 33.289 33.548 -0.259 1
1 1400 . 8 1 1 A 116 116 HIS N N 116 117.212 114.528 2.684 1
1 1401 . 8 1 1 A 117 117 VAL H H 117 9.130 9.512 -0.382 1
1 1402 . 8 1 1 A 117 117 VAL HA H 117 4.649 4.987 -0.338 1
1 1410 . 8 1 1 A 117 117 VAL C C 117 173.832 174.679 -0.847 1
1 1411 . 8 1 1 A 117 117 VAL CA C 117 59.555 59.829 -0.274 1
1 1412 . 8 1 1 A 117 117 VAL CB C 117 34.676 34.904 -0.228 1
1 1415 . 8 1 1 A 117 117 VAL N N 117 114.046 116.186 -2.140 1
1 1416 . 8 1 1 A 118 118 VAL H H 118 8.680 8.996 -0.316 1
1 1417 . 8 1 1 A 118 118 VAL HA H 118 4.747 4.959 -0.212 1
1 1425 . 8 1 1 A 118 118 VAL C C 118 175.836 175.371 0.465 1
1 1426 . 8 1 1 A 118 118 VAL CA C 118 62.159 61.085 1.074 1
1 1427 . 8 1 1 A 118 118 VAL CB C 118 31.887 33.544 -1.657 1
1 1430 . 8 1 1 A 118 118 VAL N N 118 125.095 121.683 3.412 1
1 1431 . 8 1 1 A 119 119 VAL H H 119 9.057 9.070 -0.013 1
1 1432 . 8 1 1 A 119 119 VAL HA H 119 5.231 5.367 -0.136 1
1 1440 . 8 1 1 A 119 119 VAL C C 119 173.747 173.587 0.160 1
1 1441 . 8 1 1 A 119 119 VAL CA C 119 58.326 59.048 -0.722 1
1 1442 . 8 1 1 A 119 119 VAL CB C 119 34.387 34.779 -0.392 1
1 1445 . 8 1 1 A 119 119 VAL N N 119 121.494 121.821 -0.327 1
1 1446 . 8 1 1 A 120 120 ASP H H 120 8.926 8.738 0.188 1
1 1447 . 8 1 1 A 120 120 ASP HA H 120 5.174 5.394 -0.220 1
1 1450 . 8 1 1 A 120 120 ASP C C 120 177.982 174.907 3.075 1
1 1451 . 8 1 1 A 120 120 ASP CA C 120 52.749 52.419 0.330 1
1 1452 . 8 1 1 A 120 120 ASP CB C 120 44.542 44.421 0.121 1
1 1453 . 8 1 1 A 120 120 ASP N N 120 121.454 124.721 -3.267 1
1 1454 . 8 1 1 A 121 121 GLY H H 121 8.674 8.584 0.090 1
1 1455 . 8 1 1 A 121 121 GLY HA2 H 121 4.702 4.139 0.563 1
1 1456 . 8 1 1 A 121 121 GLY HA3 H 121 3.573 4.156 -0.583 1
1 1457 . 8 1 1 A 121 121 GLY C C 121 175.041 173.920 1.121 1
1 1458 . 8 1 1 A 121 121 GLY CA C 121 45.319 45.650 -0.331 1
1 1459 . 8 1 1 A 121 121 GLY N N 121 114.850 111.414 3.436 1
1 1460 . 8 1 1 A 122 122 ASN H H 122 8.762 7.520 1.242 1
1 1461 . 8 1 1 A 122 122 ASN HA H 122 4.183 4.527 -0.344 1
1 1466 . 8 1 1 A 122 122 ASN C C 122 175.406 175.117 0.289 1
1 1467 . 8 1 1 A 122 122 ASN CA C 122 54.686 54.519 0.167 1
1 1468 . 8 1 1 A 122 122 ASN CB C 122 40.139 38.668 1.471 1
1 1469 . 8 1 1 A 122 122 ASN N N 122 121.618 117.811 3.807 1
1 1471 . 8 1 1 A 123 123 HIS H H 123 8.929 8.511 0.418 1
1 1472 . 8 1 1 A 123 123 HIS HA H 123 4.005 4.685 -0.680 1
1 1477 . 8 1 1 A 123 123 HIS C C 123 177.325 175.986 1.339 1
1 1478 . 8 1 1 A 123 123 HIS CA C 123 58.768 56.965 1.803 1
1 1479 . 8 1 1 A 123 123 HIS CB C 123 31.172 30.783 0.389 1
1 1482 . 8 1 1 A 123 123 HIS N N 123 124.165 121.834 2.331 1
1 1483 . 8 1 1 A 124 124 MET H H 124 8.266 8.390 -0.124 1
1 1484 . 8 1 1 A 124 124 MET HA H 124 4.048 4.065 -0.017 1
1 1492 . 8 1 1 A 124 124 MET CA C 124 58.994 58.246 0.748 1
1 1493 . 8 1 1 A 124 124 MET CB C 124 32.777 32.855 -0.078 1
1 1496 . 8 1 1 A 124 124 MET N N 124 129.443 117.498 11.945 1
1 1497 . 8 1 1 A 125 125 LEU H H 125 8.094 8.264 -0.170 1
1 1498 . 8 1 1 A 125 125 LEU HA H 125 4.455 4.648 -0.193 1
1 1504 . 8 1 1 A 125 125 LEU C C 125 177.860 176.836 1.024 1
1 1505 . 8 1 1 A 125 125 LEU CA C 125 53.517 54.284 -0.767 1
1 1506 . 8 1 1 A 125 125 LEU CB C 125 42.462 42.288 0.174 1
1 1509 . 8 1 1 A 126 126 ALA H H 126 8.089 7.748 0.341 1
1 1510 . 8 1 1 A 126 126 ALA HA H 126 3.966 4.604 -0.638 1
1 1514 . 8 1 1 A 126 126 ALA C C 126 179.135 178.274 0.861 1
1 1515 . 8 1 1 A 126 126 ALA CA C 126 54.170 54.684 -0.514 1
1 1516 . 8 1 1 A 126 126 ALA CB C 126 18.687 19.096 -0.409 1
1 1517 . 8 1 1 A 126 126 ALA N N 126 126.095 123.984 2.111 1
1 1518 . 8 1 1 A 127 127 GLY H H 127 9.499 8.042 1.457 1
1 1519 . 8 1 1 A 127 127 GLY HA2 H 127 4.207 3.900 0.307 1
1 1520 . 8 1 1 A 127 127 GLY HA3 H 127 3.598 3.903 -0.305 1
1 1521 . 8 1 1 A 127 127 GLY C C 127 173.568 174.571 -1.003 1
1 1522 . 8 1 1 A 127 127 GLY CA C 127 45.846 45.145 0.701 1
1 1523 . 8 1 1 A 127 127 GLY N N 127 110.073 106.682 3.391 1
1 1524 . 8 1 1 A 128 128 GLN H H 128 7.514 7.860 -0.346 1
1 1525 . 8 1 1 A 128 128 GLN HA H 128 4.496 4.265 0.231 1
1 1532 . 8 1 1 A 128 128 GLN C C 128 174.790 175.339 -0.549 1
1 1533 . 8 1 1 A 128 128 GLN CA C 128 54.948 56.795 -1.847 1
1 1534 . 8 1 1 A 128 128 GLN CB C 128 29.181 29.525 -0.344 1
1 1536 . 8 1 1 A 128 128 GLN N N 128 117.842 120.886 -3.044 1
1 1538 . 8 1 1 A 129 129 ASN H H 129 8.689 8.671 0.018 1
1 1539 . 8 1 1 A 129 129 ASN HA H 129 4.857 5.022 -0.165 1
1 1544 . 8 1 1 A 129 129 ASN C C 129 174.325 174.443 -0.118 1
1 1545 . 8 1 1 A 129 129 ASN CA C 129 52.568 52.736 -0.168 1
1 1546 . 8 1 1 A 129 129 ASN CB C 129 38.035 39.646 -1.611 1
1 1547 . 8 1 1 A 129 129 ASN N N 129 122.739 123.239 -0.500 1
1 1549 . 8 1 1 A 130 130 LEU H H 130 8.742 9.230 -0.488 1
1 1550 . 8 1 1 A 130 130 LEU HA H 130 4.918 4.848 0.070 1
1 1560 . 8 1 1 A 130 130 LEU C C 130 176.095 175.691 0.404 1
1 1561 . 8 1 1 A 130 130 LEU CA C 130 53.691 52.847 0.844 1
1 1562 . 8 1 1 A 130 130 LEU CB C 130 46.814 44.767 2.047 1
1 1566 . 8 1 1 A 130 130 LEU N N 130 121.242 125.437 -4.195 1
1 1567 . 8 1 1 A 131 131 LYS H H 131 8.809 9.039 -0.230 1
1 1568 . 8 1 1 A 131 131 LYS HA H 131 4.918 4.993 -0.075 1
1 1577 . 8 1 1 A 131 131 LYS C C 131 175.508 175.100 0.408 1
1 1578 . 8 1 1 A 131 131 LYS CA C 131 55.333 54.678 0.655 1
1 1579 . 8 1 1 A 131 131 LYS CB C 131 33.962 34.863 -0.901 1
1 1583 . 8 1 1 A 131 131 LYS N N 131 122.071 120.298 1.773 1
1 1584 . 8 1 1 A 132 132 PHE H H 132 9.436 9.318 0.118 1
1 1585 . 8 1 1 A 132 132 PHE HA H 132 5.427 5.695 -0.268 1
1 1593 . 8 1 1 A 132 132 PHE C C 132 175.715 174.526 1.189 1
1 1594 . 8 1 1 A 132 132 PHE CA C 132 56.665 56.549 0.116 1
1 1595 . 8 1 1 A 132 132 PHE CB C 132 42.263 42.046 0.217 1
1 1599 . 8 1 1 A 132 132 PHE N N 132 125.247 123.346 1.901 1
1 1600 . 8 1 1 A 133 133 ASN H H 133 8.680 8.944 -0.264 1
1 1601 . 8 1 1 A 133 133 ASN HA H 133 5.249 5.242 0.007 1
1 1606 . 8 1 1 A 133 133 ASN C C 133 174.433 174.096 0.337 1
1 1607 . 8 1 1 A 133 133 ASN CA C 133 53.952 52.828 1.124 1
1 1608 . 8 1 1 A 133 133 ASN CB C 133 41.492 39.307 2.185 1
1 1609 . 8 1 1 A 133 133 ASN N N 133 122.056 121.552 0.504 1
1 1611 . 8 1 1 A 134 134 VAL H H 134 8.762 8.953 -0.191 1
1 1612 . 8 1 1 A 134 134 VAL HA H 134 4.805 4.664 0.141 1
1 1620 . 8 1 1 A 134 134 VAL C C 134 173.555 174.944 -1.389 1
1 1621 . 8 1 1 A 134 134 VAL CA C 134 60.374 61.371 -0.997 1
1 1622 . 8 1 1 A 134 134 VAL CB C 134 34.848 33.185 1.663 1
1 1625 . 8 1 1 A 134 134 VAL N N 134 122.014 125.886 -3.872 1
1 1626 . 8 1 1 A 135 135 GLU H H 135 8.869 9.536 -0.667 1
1 1627 . 8 1 1 A 135 135 GLU HA H 135 5.240 5.002 0.238 1
1 1632 . 8 1 1 A 135 135 GLU C C 135 175.578 175.743 -0.165 1
1 1633 . 8 1 1 A 135 135 GLU CA C 135 54.376 55.268 -0.892 1
1 1634 . 8 1 1 A 135 135 GLU CB C 135 33.264 30.813 2.451 1
1 1636 . 8 1 1 A 135 135 GLU N N 135 125.197 127.039 -1.842 1
1 1637 . 8 1 1 A 136 136 VAL H H 136 8.270 8.507 -0.237 1
1 1638 . 8 1 1 A 136 136 VAL HA H 136 4.066 4.091 -0.025 1
1 1646 . 8 1 1 A 136 136 VAL C C 136 176.119 175.176 0.943 1
1 1647 . 8 1 1 A 136 136 VAL CA C 136 62.910 62.853 0.057 1
1 1648 . 8 1 1 A 136 136 VAL CB C 136 30.573 32.420 -1.847 1
1 1651 . 8 1 1 A 136 136 VAL N N 136 126.347 127.012 -0.665 1
1 1652 . 8 1 1 A 137 137 VAL H H 137 8.865 8.871 -0.006 1
1 1653 . 8 1 1 A 137 137 VAL HA H 137 4.022 4.267 -0.245 1
1 1661 . 8 1 1 A 137 137 VAL C C 137 175.208 175.644 -0.436 1
1 1662 . 8 1 1 A 137 137 VAL CA C 137 64.424 63.473 0.951 1
1 1663 . 8 1 1 A 137 137 VAL CB C 137 32.943 33.755 -0.812 1
1 1666 . 8 1 1 A 137 137 VAL N N 137 130.810 127.240 3.570 1
1 1667 . 8 1 1 A 138 138 ALA H H 138 7.677 7.542 0.135 1
1 1668 . 8 1 1 A 138 138 ALA HA H 138 4.496 4.688 -0.192 1
1 1672 . 8 1 1 A 138 138 ALA C C 138 174.405 175.195 -0.790 1
1 1673 . 8 1 1 A 138 138 ALA CA C 138 52.556 51.590 0.966 1
1 1674 . 8 1 1 A 138 138 ALA CB C 138 21.874 22.763 -0.889 1
1 1675 . 8 1 1 A 138 138 ALA N N 138 119.194 118.247 0.947 1
1 1676 . 8 1 1 A 139 139 ILE H H 139 8.052 8.503 -0.451 1
1 1677 . 8 1 1 A 139 139 ILE HA H 139 4.640 4.905 -0.265 1
1 1687 . 8 1 1 A 139 139 ILE C C 139 173.734 174.193 -0.459 1
1 1688 . 8 1 1 A 139 139 ILE CA C 139 61.623 60.022 1.601 1
1 1689 . 8 1 1 A 139 139 ILE CB C 139 43.363 41.816 1.547 1
1 1693 . 8 1 1 A 139 139 ILE N N 139 119.307 120.336 -1.029 1
1 1694 . 8 1 1 A 140 140 ARG H H 140 8.912 8.992 -0.080 1
1 1695 . 8 1 1 A 140 140 ARG HA H 140 4.760 5.033 -0.273 1
1 1702 . 8 1 1 A 140 140 ARG C C 140 174.181 175.148 -0.967 1
1 1703 . 8 1 1 A 140 140 ARG CA C 140 54.243 54.063 0.180 1
1 1704 . 8 1 1 A 140 140 ARG CB C 140 33.438 34.031 -0.593 1
1 1707 . 8 1 1 A 140 140 ARG N N 140 122.820 127.672 -4.852 1
1 1708 . 8 1 1 A 141 141 GLU H H 141 8.545 8.517 0.028 1
1 1709 . 8 1 1 A 141 141 GLU HA H 141 4.254 4.678 -0.424 1
1 1714 . 8 1 1 A 141 141 GLU C C 141 177.299 176.296 1.003 1
1 1715 . 8 1 1 A 141 141 GLU CA C 141 57.165 56.024 1.141 1
1 1716 . 8 1 1 A 141 141 GLU CB C 141 30.048 30.492 -0.444 1
1 1718 . 8 1 1 A 141 141 GLU N N 141 119.458 122.457 -2.999 1
1 1719 . 8 1 1 A 142 142 ALA H H 142 8.380 8.686 -0.306 1
1 1720 . 8 1 1 A 142 142 ALA HA H 142 4.388 4.537 -0.149 1
1 1724 . 8 1 1 A 142 142 ALA C C 142 178.495 179.104 -0.609 1
1 1725 . 8 1 1 A 142 142 ALA CA C 142 51.113 52.076 -0.963 1
1 1726 . 8 1 1 A 142 142 ALA CB C 142 21.044 19.563 1.481 1
1 1727 . 8 1 1 A 142 142 ALA N N 142 127.330 126.632 0.698 1
1 1728 . 8 1 1 A 143 143 THR H H 143 9.502 8.984 0.518 1
1 1729 . 8 1 1 A 143 143 THR HA H 143 4.362 4.778 -0.416 1
1 1734 . 8 1 1 A 143 143 THR C C 143 175.241 175.188 0.053 1
1 1735 . 8 1 1 A 143 143 THR CA C 143 60.541 61.170 -0.629 1
1 1736 . 8 1 1 A 143 143 THR CB C 143 70.879 68.745 2.134 1
1 1738 . 8 1 1 A 143 143 THR N N 143 114.561 111.218 3.343 1
1 1739 . 8 1 1 A 144 144 GLU H H 144 8.787 8.158 0.629 1
1 1740 . 8 1 1 A 144 144 GLU HA H 144 3.817 3.819 -0.002 1
1 1745 . 8 1 1 A 144 144 GLU C C 144 179.490 176.733 2.757 1
1 1746 . 8 1 1 A 144 144 GLU CA C 144 60.102 58.909 1.193 1
1 1747 . 8 1 1 A 144 144 GLU CB C 144 29.338 27.396 1.942 1
1 1749 . 8 1 1 A 144 144 GLU N N 144 120.475 115.312 5.163 1
1 1750 . 8 1 1 A 145 145 GLU H H 145 8.321 8.670 -0.349 1
1 1751 . 8 1 1 A 145 145 GLU HA H 145 3.899 3.752 0.147 1
1 1756 . 8 1 1 A 145 145 GLU C C 145 178.521 178.569 -0.048 1
1 1757 . 8 1 1 A 145 145 GLU CA C 145 59.588 59.240 0.348 1
1 1758 . 8 1 1 A 145 145 GLU CB C 145 29.658 29.334 0.324 1
1 1760 . 8 1 1 A 145 145 GLU N N 145 119.761 119.218 0.543 1
1 1761 . 8 1 1 A 146 146 GLU H H 146 7.514 8.088 -0.574 1
1 1762 . 8 1 1 A 146 146 GLU HA H 146 3.856 4.231 -0.375 1
1 1767 . 8 1 1 A 146 146 GLU C C 146 179.189 179.242 -0.053 1
1 1768 . 8 1 1 A 146 146 GLU CA C 146 59.148 59.110 0.038 1
1 1769 . 8 1 1 A 146 146 GLU CB C 146 29.834 29.086 0.748 1
1 1771 . 8 1 1 A 146 146 GLU N N 146 121.118 118.789 2.329 1
1 1772 . 8 1 1 A 147 147 LEU H H 147 7.823 8.142 -0.319 1
1 1773 . 8 1 1 A 147 147 LEU HA H 147 3.662 3.729 -0.067 1
1 1783 . 8 1 1 A 147 147 LEU C C 147 179.341 178.460 0.881 1
1 1784 . 8 1 1 A 147 147 LEU CA C 147 57.277 57.558 -0.281 1
1 1785 . 8 1 1 A 147 147 LEU CB C 147 41.239 41.518 -0.279 1
1 1789 . 8 1 1 A 147 147 LEU N N 147 117.199 120.530 -3.331 1
1 1790 . 8 1 1 A 148 148 ALA H H 148 7.788 8.657 -0.869 1
1 1791 . 8 1 1 A 148 148 ALA HA H 148 3.958 4.048 -0.090 1
1 1795 . 8 1 1 A 148 148 ALA C C 148 179.777 179.266 0.511 1
1 1796 . 8 1 1 A 148 148 ALA CA C 148 54.509 54.817 -0.308 1
1 1797 . 8 1 1 A 148 148 ALA CB C 148 18.064 18.037 0.027 1
1 1798 . 8 1 1 A 148 148 ALA N N 148 121.696 120.646 1.050 1
1 1799 . 8 1 1 A 149 149 HIS H H 149 7.726 7.355 0.371 1
1 1800 . 8 1 1 A 149 149 HIS HA H 149 4.477 4.566 -0.089 1
1 1805 . 8 1 1 A 149 149 HIS C C 149 176.099 175.347 0.752 1
1 1806 . 8 1 1 A 149 149 HIS CA C 149 55.802 55.958 -0.156 1
1 1807 . 8 1 1 A 149 149 HIS CB C 149 30.406 30.043 0.363 1
1 1810 . 8 1 1 A 149 149 HIS N N 149 114.463 112.911 1.552 1
1 1811 . 8 1 1 A 150 150 GLY H H 150 8.076 9.206 -1.130 1
1 1812 . 8 1 1 A 150 150 GLY HA2 H 150 3.927 3.560 0.367 1
1 1813 . 8 1 1 A 150 150 GLY HA3 H 150 3.237 3.666 -0.429 1
1 1814 . 8 1 1 A 150 150 GLY C C 150 173.382 173.384 -0.002 1
1 1815 . 8 1 1 A 150 150 GLY CA C 150 46.117 45.520 0.597 1
1 1816 . 8 1 1 A 150 150 GLY N N 150 109.417 108.706 0.711 1
1 1817 . 8 1 1 A 151 151 HIS H H 151 7.518 7.369 0.149 1
1 1818 . 8 1 1 A 151 151 HIS HA H 151 4.563 4.856 -0.293 1
1 1823 . 8 1 1 A 151 151 HIS C C 151 173.157 174.617 -1.460 1
1 1824 . 8 1 1 A 151 151 HIS CA C 151 54.731 54.757 -0.026 1
1 1825 . 8 1 1 A 151 151 HIS CB C 151 31.611 31.360 0.251 1
1 1828 . 8 1 1 A 151 151 HIS N N 151 114.828 114.163 0.665 1
1 1829 . 8 1 1 A 152 152 VAL H H 152 7.931 9.118 -1.187 1
1 1830 . 8 1 1 A 152 152 VAL HA H 152 3.951 3.618 0.333 1
1 1838 . 8 1 1 A 152 152 VAL C C 152 175.848 176.207 -0.359 1
1 1839 . 8 1 1 A 152 152 VAL CA C 152 62.190 66.712 -4.522 1
1 1840 . 8 1 1 A 152 152 VAL CB C 152 32.703 31.642 1.061 1
1 1843 . 8 1 1 A 152 152 VAL N N 152 118.551 120.431 -1.880 1
1 1844 . 8 1 1 A 153 153 HIS H H 153 9.784 7.948 1.836 1
1 1845 . 8 1 1 A 153 153 HIS HA H 153 4.604 3.961 0.643 1
1 1850 . 8 1 1 A 153 153 HIS C C 153 175.795 174.426 1.369 1
1 1851 . 8 1 1 A 153 153 HIS CA C 153 56.753 56.785 -0.032 1
1 1852 . 8 1 1 A 153 153 HIS CB C 153 30.325 28.439 1.886 1
1 1855 . 8 1 1 A 153 153 HIS N N 153 127.403 119.371 8.032 1
1 1856 . 8 1 1 A 154 154 GLY H H 154 8.447 8.250 0.197 1
1 1857 . 8 1 1 A 154 154 GLY HA2 H 154 3.797 3.631 0.166 1
1 1858 . 8 1 1 A 154 154 GLY HA3 H 154 3.797 3.669 0.128 1
1 1859 . 8 1 1 A 154 154 GLY C C 154 173.848 173.725 0.123 1
1 1860 . 8 1 1 A 154 154 GLY CA C 154 45.153 45.979 -0.826 1
1 1861 . 8 1 1 A 154 154 GLY N N 154 112.233 105.991 6.242 1
1 1862 . 8 1 1 A 155 155 ALA H H 155 8.074 8.471 -0.397 1
1 1863 . 8 1 1 A 155 155 ALA HA H 155 4.101 3.972 0.129 1
1 1867 . 8 1 1 A 155 155 ALA C C 155 177.651 175.617 2.034 1
1 1868 . 8 1 1 A 155 155 ALA CA C 155 52.795 54.238 -1.443 1
1 1869 . 8 1 1 A 155 155 ALA CB C 155 19.258 17.811 1.447 1
1 1870 . 8 1 1 A 155 155 ALA N N 155 124.092 125.637 -1.545 1
1 1871 . 8 1 1 A 156 156 HIS H H 156 8.201 8.820 -0.619 1
1 1872 . 8 1 1 A 156 156 HIS HA H 156 4.474 5.240 -0.766 1
1 1875 . 8 1 1 A 156 156 HIS C C 156 174.758 173.526 1.232 1
1 1876 . 8 1 1 A 156 156 HIS CA C 156 55.756 54.856 0.900 1
1 1877 . 8 1 1 A 156 156 HIS CB C 156 30.060 32.032 -1.972 1
1 1878 . 8 1 1 A 156 156 HIS N N 156 118.170 116.472 1.698 1
1 1879 . 8 1 1 A 157 157 ASP H H 157 8.001 8.781 -0.780 1
1 1880 . 8 1 1 A 157 157 ASP HA H 157 4.436 4.791 -0.355 1
1 1883 . 8 1 1 A 157 157 ASP CA C 157 54.185 55.681 -1.496 1
1 1884 . 8 1 1 A 157 157 ASP CB C 157 41.016 42.733 -1.717 1
1 1885 . 8 1 1 A 157 157 ASP N N 157 121.683 123.293 -1.610 1
1 1886 . 8 1 1 A 160 160 HIS HA H 160 4.502 5.105 -0.603 1
1 1889 . 8 1 1 A 160 160 HIS C C 160 174.722 174.273 0.449 1
1 1890 . 8 1 1 A 160 160 HIS CA C 160 55.979 54.512 1.467 1
1 1891 . 8 1 1 A 160 160 HIS CB C 160 30.058 32.129 -2.071 1
1 1892 . 8 1 1 A 161 161 ASP H H 161 8.270 8.890 -0.620 1
1 1893 . 8 1 1 A 161 161 ASP HA H 161 4.446 4.928 -0.482 1
1 1896 . 8 1 1 A 161 161 ASP C C 161 176.107 176.024 0.083 1
1 1897 . 8 1 1 A 161 161 ASP CA C 161 54.474 52.837 1.637 1
1 1898 . 8 1 1 A 161 161 ASP CB C 161 40.820 43.480 -2.660 1
1 1899 . 8 1 1 A 161 161 ASP N N 161 121.957 121.483 0.474 1
1 1900 . 8 1 1 A 162 162 HIS H H 162 8.212 8.359 -0.147 1
1 1901 . 8 1 1 A 162 162 HIS HA H 162 4.289 3.979 0.310 1
1 1904 . 8 1 1 A 162 162 HIS C C 162 175.036 174.858 0.178 1
1 1905 . 8 1 1 A 162 162 HIS CA C 162 56.185 56.646 -0.461 1
1 1906 . 8 1 1 A 162 162 HIS CB C 162 30.108 26.805 3.303 1
1 1907 . 8 1 1 A 162 162 HIS N N 162 119.766 118.996 0.770 1
1 1908 . 8 1 1 A 163 163 ASP H H 163 8.163 7.817 0.346 1
1 1909 . 8 1 1 A 163 163 ASP HA H 163 4.428 4.386 0.042 1
1 1912 . 8 1 1 A 163 163 ASP C C 163 176.161 176.025 0.136 1
1 1913 . 8 1 1 A 163 163 ASP CA C 163 54.585 56.614 -2.029 1
1 1914 . 8 1 1 A 163 163 ASP CB C 163 40.823 41.912 -1.089 1
1 1915 . 8 1 1 A 163 163 ASP N N 163 121.265 118.385 2.880 1
1 1916 . 8 1 1 A 164 164 HIS H H 164 8.106 7.337 0.769 1
1 1917 . 8 1 1 A 164 164 HIS HA H 164 4.422 4.882 -0.460 1
1 1920 . 8 1 1 A 164 164 HIS C C 164 174.904 174.787 0.117 1
1 1921 . 8 1 1 A 164 164 HIS CA C 164 56.361 54.022 2.339 1
1 1922 . 8 1 1 A 164 164 HIS CB C 164 30.305 31.561 -1.256 1
1 1923 . 8 1 1 A 164 164 HIS N N 164 119.729 112.561 7.168 1
1 1924 . 8 1 1 A 165 165 ASP H H 165 8.118 9.364 -1.246 1
1 1925 . 8 1 1 A 165 165 ASP HA H 165 4.394 4.500 -0.106 1
1 1928 . 8 1 1 A 165 165 ASP C C 165 176.054 176.510 -0.456 1
1 1929 . 8 1 1 A 165 165 ASP CA C 165 54.364 54.955 -0.591 1
1 1930 . 8 1 1 A 165 165 ASP CB C 165 40.818 39.538 1.280 1
1 1931 . 8 1 1 A 165 165 ASP N N 165 121.062 120.301 0.761 1
1 1932 . 8 1 1 A 166 166 HIS H H 166 8.092 8.141 -0.049 1
1 1933 . 8 1 1 A 166 166 HIS CA C 166 56.114 57.695 -1.581 1
1 1934 . 8 1 1 A 166 166 HIS CB C 166 29.702 30.993 -1.291 1
1 1935 . 8 1 1 A 166 166 HIS N N 166 120.001 119.475 0.526 1
1 1936 . 8 1 1 A 170 170 HIS HA H 170 4.514 5.272 -0.758 1
1 1939 . 8 1 1 A 170 170 HIS C C 170 173.952 174.600 -0.648 1
1 1940 . 8 1 1 A 170 170 HIS CA C 170 55.995 54.534 1.461 1
1 1941 . 8 1 1 A 170 170 HIS CB C 170 30.161 32.965 -2.804 1
1 14 . 9 1 1 A 2 2 LYS H H 2 7.540 8.885 -1.345 1
1 15 . 9 1 1 A 2 2 LYS HA H 2 4.729 5.019 -0.290 1
1 24 . 9 1 1 A 2 2 LYS C C 2 175.948 175.435 0.513 1
1 25 . 9 1 1 A 2 2 LYS CA C 2 53.978 54.350 -0.372 1
1 26 . 9 1 1 A 2 2 LYS CB C 2 35.985 35.294 0.691 1
1 30 . 9 1 1 A 2 2 LYS N N 2 120.764 120.354 0.410 1
1 31 . 9 1 1 A 3 3 VAL H H 3 8.738 8.432 0.306 1
1 32 . 9 1 1 A 3 3 VAL HA H 3 2.800 4.404 -1.604 1
1 40 . 9 1 1 A 3 3 VAL C C 3 175.018 175.147 -0.129 1
1 41 . 9 1 1 A 3 3 VAL CA C 3 66.598 62.016 4.582 1
1 42 . 9 1 1 A 3 3 VAL CB C 3 31.218 32.463 -1.245 1
1 45 . 9 1 1 A 3 3 VAL N N 3 120.055 121.521 -1.466 1
1 46 . 9 1 1 A 4 4 ALA H H 4 6.584 8.720 -2.136 1
1 47 . 9 1 1 A 4 4 ALA HA H 4 4.223 4.646 -0.423 1
1 51 . 9 1 1 A 4 4 ALA C C 4 174.117 175.408 -1.291 1
1 52 . 9 1 1 A 4 4 ALA CA C 4 50.358 50.842 -0.484 1
1 53 . 9 1 1 A 4 4 ALA CB C 4 22.137 22.932 -0.795 1
1 54 . 9 1 1 A 4 4 ALA N N 4 129.800 130.145 -0.345 1
1 55 . 9 1 1 A 5 5 LYS H H 5 8.596 8.457 0.139 1
1 56 . 9 1 1 A 5 5 LYS HA H 5 3.793 4.136 -0.343 1
1 65 . 9 1 1 A 5 5 LYS C C 5 175.260 177.011 -1.751 1
1 66 . 9 1 1 A 5 5 LYS CA C 5 57.700 57.380 0.320 1
1 67 . 9 1 1 A 5 5 LYS CB C 5 32.400 32.528 -0.128 1
1 71 . 9 1 1 A 5 5 LYS N N 5 118.708 120.018 -1.310 1
1 72 . 9 1 1 A 6 6 ASP H H 6 8.679 8.902 -0.223 1
1 73 . 9 1 1 A 6 6 ASP HA H 6 4.040 4.338 -0.298 1
1 76 . 9 1 1 A 6 6 ASP C C 6 173.331 175.279 -1.948 1
1 77 . 9 1 1 A 6 6 ASP CA C 6 57.508 55.803 1.705 1
1 78 . 9 1 1 A 6 6 ASP CB C 6 37.604 39.724 -2.120 1
1 79 . 9 1 1 A 6 6 ASP N N 6 115.415 120.918 -5.503 1
1 80 . 9 1 1 A 7 7 LEU H H 7 7.376 7.528 -0.152 1
1 81 . 9 1 1 A 7 7 LEU HA H 7 4.689 4.294 0.395 1
1 91 . 9 1 1 A 7 7 LEU C C 7 175.906 175.638 0.268 1
1 92 . 9 1 1 A 7 7 LEU CA C 7 53.509 53.904 -0.395 1
1 93 . 9 1 1 A 7 7 LEU CB C 7 42.419 41.603 0.816 1
1 97 . 9 1 1 A 7 7 LEU N N 7 117.619 120.488 -2.869 1
1 98 . 9 1 1 A 8 8 VAL H H 8 8.646 8.584 0.062 1
1 99 . 9 1 1 A 8 8 VAL HA H 8 4.397 4.038 0.359 1
1 107 . 9 1 1 A 8 8 VAL C C 8 175.244 174.800 0.444 1
1 108 . 9 1 1 A 8 8 VAL CA C 8 62.028 62.714 -0.686 1
1 109 . 9 1 1 A 8 8 VAL CB C 8 31.515 32.383 -0.868 1
1 112 . 9 1 1 A 8 8 VAL N N 8 121.164 126.767 -5.603 1
1 113 . 9 1 1 A 9 9 VAL H H 9 8.607 8.213 0.394 1
1 114 . 9 1 1 A 9 9 VAL HA H 9 4.281 5.150 -0.869 1
1 122 . 9 1 1 A 9 9 VAL C C 9 174.156 174.301 -0.145 1
1 123 . 9 1 1 A 9 9 VAL CA C 9 60.614 58.726 1.888 1
1 124 . 9 1 1 A 9 9 VAL CB C 9 33.985 35.806 -1.821 1
1 127 . 9 1 1 A 9 9 VAL N N 9 134.014 122.744 11.270 1
1 128 . 9 1 1 A 10 10 SER H H 10 8.684 8.531 0.153 1
1 129 . 9 1 1 A 10 10 SER HA H 10 5.736 5.881 -0.145 1
1 132 . 9 1 1 A 10 10 SER C C 10 173.544 173.718 -0.174 1
1 133 . 9 1 1 A 10 10 SER CA C 10 56.533 57.813 -1.280 1
1 134 . 9 1 1 A 10 10 SER CB C 10 63.385 64.385 -1.000 1
1 135 . 9 1 1 A 10 10 SER N N 10 121.492 118.791 2.701 1
1 136 . 9 1 1 A 11 11 LEU H H 11 9.939 8.890 1.049 1
1 137 . 9 1 1 A 11 11 LEU HA H 11 5.133 5.466 -0.333 1
1 147 . 9 1 1 A 11 11 LEU C C 11 174.843 175.318 -0.475 1
1 148 . 9 1 1 A 11 11 LEU CA C 11 53.770 53.334 0.436 1
1 149 . 9 1 1 A 11 11 LEU CB C 11 47.469 46.368 1.101 1
1 153 . 9 1 1 A 11 11 LEU N N 11 128.460 122.272 6.188 1
1 154 . 9 1 1 A 12 12 ALA H H 12 8.770 9.593 -0.823 1
1 155 . 9 1 1 A 12 12 ALA HA H 12 4.830 5.172 -0.342 1
1 159 . 9 1 1 A 12 12 ALA C C 12 176.974 175.676 1.298 1
1 160 . 9 1 1 A 12 12 ALA CA C 12 50.231 50.668 -0.437 1
1 161 . 9 1 1 A 12 12 ALA CB C 12 21.270 20.548 0.722 1
1 162 . 9 1 1 A 12 12 ALA N N 12 127.500 121.765 5.735 1
1 163 . 9 1 1 A 13 13 TYR H H 13 8.749 8.748 0.001 1
1 164 . 9 1 1 A 13 13 TYR HA H 13 5.797 6.354 -0.557 1
1 171 . 9 1 1 A 13 13 TYR C C 13 173.952 172.847 1.105 1
1 172 . 9 1 1 A 13 13 TYR CA C 13 56.390 54.910 1.480 1
1 173 . 9 1 1 A 13 13 TYR CB C 13 41.159 41.862 -0.703 1
1 176 . 9 1 1 A 13 13 TYR N N 13 117.737 120.760 -3.023 1
1 177 . 9 1 1 A 14 14 GLN H H 14 8.492 8.779 -0.287 1
1 178 . 9 1 1 A 14 14 GLN HA H 14 4.611 5.019 -0.408 1
1 185 . 9 1 1 A 14 14 GLN C C 14 174.492 173.685 0.807 1
1 186 . 9 1 1 A 14 14 GLN CA C 14 55.626 54.476 1.150 1
1 187 . 9 1 1 A 14 14 GLN CB C 14 32.734 31.919 0.815 1
1 189 . 9 1 1 A 14 14 GLN N N 14 116.962 120.133 -3.171 1
1 191 . 9 1 1 A 15 15 VAL H H 15 8.403 9.092 -0.689 1
1 192 . 9 1 1 A 15 15 VAL HA H 15 4.614 5.082 -0.468 1
1 200 . 9 1 1 A 15 15 VAL C C 15 173.389 174.582 -1.193 1
1 201 . 9 1 1 A 15 15 VAL CA C 15 59.711 60.342 -0.631 1
1 202 . 9 1 1 A 15 15 VAL CB C 15 33.639 34.017 -0.378 1
1 205 . 9 1 1 A 15 15 VAL N N 15 121.203 126.888 -5.685 1
1 206 . 9 1 1 A 16 16 ARG H H 16 8.584 9.249 -0.665 1
1 207 . 9 1 1 A 16 16 ARG HA H 16 5.584 5.018 0.566 1
1 214 . 9 1 1 A 16 16 ARG C C 16 176.585 175.421 1.164 1
1 215 . 9 1 1 A 16 16 ARG CA C 16 53.453 53.942 -0.489 1
1 216 . 9 1 1 A 16 16 ARG CB C 16 34.968 33.930 1.038 1
1 219 . 9 1 1 A 16 16 ARG N N 16 126.883 129.949 -3.066 1
1 220 . 9 1 1 A 17 17 THR H H 17 8.270 8.526 -0.256 1
1 221 . 9 1 1 A 17 17 THR HA H 17 4.573 4.707 -0.134 1
1 226 . 9 1 1 A 17 17 THR C C 17 177.860 176.147 1.713 1
1 227 . 9 1 1 A 17 17 THR CA C 17 61.073 60.630 0.443 1
1 228 . 9 1 1 A 17 17 THR CB C 17 69.823 71.840 -2.017 1
1 230 . 9 1 1 A 17 17 THR N N 17 109.730 115.478 -5.748 1
1 231 . 9 1 1 A 18 18 GLU H H 18 9.147 8.958 0.189 1
1 232 . 9 1 1 A 18 18 GLU HA H 18 3.770 4.018 -0.248 1
1 237 . 9 1 1 A 18 18 GLU C C 18 176.683 178.402 -1.719 1
1 238 . 9 1 1 A 18 18 GLU CA C 18 59.866 59.714 0.152 1
1 239 . 9 1 1 A 18 18 GLU CB C 18 29.752 29.102 0.650 1
1 241 . 9 1 1 A 18 18 GLU N N 18 122.491 120.978 1.513 1
1 242 . 9 1 1 A 19 19 ASP H H 19 7.900 7.795 0.105 1
1 243 . 9 1 1 A 19 19 ASP HA H 19 4.456 4.637 -0.181 1
1 246 . 9 1 1 A 19 19 ASP C C 19 176.670 176.220 0.450 1
1 247 . 9 1 1 A 19 19 ASP CA C 19 53.833 54.343 -0.510 1
1 248 . 9 1 1 A 19 19 ASP CB C 19 40.180 41.343 -1.163 1
1 249 . 9 1 1 A 19 19 ASP N N 19 116.200 117.462 -1.262 1
1 250 . 9 1 1 A 20 20 GLY H H 20 8.149 7.883 0.266 1
1 251 . 9 1 1 A 20 20 GLY HA2 H 20 4.145 3.945 0.200 1
1 252 . 9 1 1 A 20 20 GLY HA3 H 20 3.531 3.951 -0.420 1
1 253 . 9 1 1 A 20 20 GLY C C 20 173.987 173.912 0.075 1
1 254 . 9 1 1 A 20 20 GLY CA C 20 45.463 45.130 0.333 1
1 255 . 9 1 1 A 20 20 GLY N N 20 108.869 107.729 1.140 1
1 256 . 9 1 1 A 21 21 VAL H H 21 7.261 7.845 -0.584 1
1 257 . 9 1 1 A 21 21 VAL HA H 21 3.645 4.280 -0.635 1
1 265 . 9 1 1 A 21 21 VAL C C 21 175.265 174.764 0.501 1
1 266 . 9 1 1 A 21 21 VAL CA C 21 63.368 61.846 1.522 1
1 267 . 9 1 1 A 21 21 VAL CB C 21 31.614 32.737 -1.123 1
1 270 . 9 1 1 A 21 21 VAL N N 21 124.283 122.064 2.219 1
1 271 . 9 1 1 A 22 22 LEU H H 22 8.407 8.537 -0.130 1
1 272 . 9 1 1 A 22 22 LEU HA H 22 4.333 4.535 -0.202 1
1 282 . 9 1 1 A 22 22 LEU C C 22 176.660 176.652 0.008 1
1 283 . 9 1 1 A 22 22 LEU CA C 22 55.724 54.614 1.110 1
1 284 . 9 1 1 A 22 22 LEU CB C 22 42.272 42.490 -0.218 1
1 288 . 9 1 1 A 22 22 LEU N N 22 128.533 129.495 -0.962 1
1 289 . 9 1 1 A 23 23 VAL H H 23 8.887 8.726 0.161 1
1 290 . 9 1 1 A 23 23 VAL HA H 23 4.237 4.279 -0.042 1
1 298 . 9 1 1 A 23 23 VAL C C 23 175.265 175.493 -0.228 1
1 299 . 9 1 1 A 23 23 VAL CA C 23 62.348 62.615 -0.267 1
1 300 . 9 1 1 A 23 23 VAL CB C 23 33.383 32.725 0.658 1
1 303 . 9 1 1 A 23 23 VAL N N 23 125.041 121.918 3.123 1
1 304 . 9 1 1 A 24 24 ASP H H 24 7.480 7.253 0.227 1
1 305 . 9 1 1 A 24 24 ASP HA H 24 4.763 5.035 -0.272 1
1 308 . 9 1 1 A 24 24 ASP C C 24 173.160 173.943 -0.783 1
1 309 . 9 1 1 A 24 24 ASP CA C 24 53.893 53.766 0.127 1
1 310 . 9 1 1 A 24 24 ASP CB C 24 43.680 44.066 -0.386 1
1 311 . 9 1 1 A 24 24 ASP N N 24 117.159 120.103 -2.944 1
1 312 . 9 1 1 A 25 25 GLU H H 25 8.187 8.699 -0.512 1
1 313 . 9 1 1 A 25 25 GLU HA H 25 4.491 4.692 -0.201 1
1 318 . 9 1 1 A 25 25 GLU C C 25 174.586 173.861 0.725 1
1 319 . 9 1 1 A 25 25 GLU CA C 25 55.475 55.117 0.358 1
1 320 . 9 1 1 A 25 25 GLU CB C 25 33.033 33.415 -0.382 1
1 322 . 9 1 1 A 25 25 GLU N N 25 118.821 120.465 -1.644 1
1 323 . 9 1 1 A 26 26 SER H H 26 8.003 8.476 -0.473 1
1 324 . 9 1 1 A 26 26 SER HA H 26 4.782 4.834 -0.052 1
1 327 . 9 1 1 A 26 26 SER CA C 26 56.490 55.429 1.061 1
1 328 . 9 1 1 A 26 26 SER CB C 26 64.977 64.130 0.847 1
1 329 . 9 1 1 A 26 26 SER N N 26 119.346 119.014 0.332 1
1 330 . 9 1 1 A 27 27 PRO HA H 27 4.633 4.546 0.087 1
1 337 . 9 1 1 A 27 27 PRO C C 27 177.016 177.450 -0.434 1
1 338 . 9 1 1 A 27 27 PRO CA C 27 61.943 62.608 -0.665 1
1 339 . 9 1 1 A 27 27 PRO CB C 27 32.492 32.872 -0.380 1
1 342 . 9 1 1 A 28 28 VAL H H 28 8.383 8.635 -0.252 1
1 343 . 9 1 1 A 28 28 VAL HA H 28 3.385 3.743 -0.358 1
1 351 . 9 1 1 A 28 28 VAL C C 28 176.069 176.942 -0.873 1
1 352 . 9 1 1 A 28 28 VAL CA C 28 65.888 65.109 0.779 1
1 353 . 9 1 1 A 28 28 VAL CB C 28 31.220 31.677 -0.457 1
1 356 . 9 1 1 A 28 28 VAL N N 28 119.349 122.667 -3.318 1
1 357 . 9 1 1 A 29 29 SER H H 29 7.365 7.794 -0.429 1
1 358 . 9 1 1 A 29 29 SER HA H 29 4.101 4.363 -0.262 1
1 361 . 9 1 1 A 29 29 SER C C 29 174.535 174.599 -0.064 1
1 362 . 9 1 1 A 29 29 SER CA C 29 58.609 59.872 -1.263 1
1 363 . 9 1 1 A 29 29 SER CB C 29 63.198 63.727 -0.529 1
1 364 . 9 1 1 A 29 29 SER N N 29 109.365 114.219 -4.854 1
1 365 . 9 1 1 A 30 30 ALA H H 30 7.457 7.491 -0.034 1
1 366 . 9 1 1 A 30 30 ALA HA H 30 4.548 4.728 -0.180 1
1 370 . 9 1 1 A 30 30 ALA CA C 30 50.789 49.399 1.390 1
1 371 . 9 1 1 A 30 30 ALA CB C 30 18.608 21.293 -2.685 1
1 372 . 9 1 1 A 30 30 ALA N N 30 126.056 122.257 3.799 1
1 373 . 9 1 1 A 31 31 PRO HA H 31 4.332 4.677 -0.345 1
1 380 . 9 1 1 A 31 31 PRO C C 31 175.841 176.427 -0.586 1
1 381 . 9 1 1 A 31 31 PRO CA C 31 62.996 62.514 0.482 1
1 382 . 9 1 1 A 31 31 PRO CB C 31 32.696 32.499 0.197 1
1 385 . 9 1 1 A 32 32 LEU H H 32 8.717 9.234 -0.517 1
1 386 . 9 1 1 A 32 32 LEU HA H 32 4.452 4.541 -0.089 1
1 396 . 9 1 1 A 32 32 LEU C C 32 175.298 174.694 0.604 1
1 397 . 9 1 1 A 32 32 LEU CA C 32 54.510 55.324 -0.814 1
1 398 . 9 1 1 A 32 32 LEU CB C 32 43.899 42.873 1.026 1
1 402 . 9 1 1 A 32 32 LEU N N 32 123.702 122.876 0.826 1
1 403 . 9 1 1 A 33 33 ASP H H 33 8.258 8.730 -0.472 1
1 404 . 9 1 1 A 33 33 ASP HA H 33 5.919 5.593 0.326 1
1 407 . 9 1 1 A 33 33 ASP C C 33 175.927 174.978 0.949 1
1 408 . 9 1 1 A 33 33 ASP CA C 33 52.619 53.034 -0.415 1
1 409 . 9 1 1 A 33 33 ASP CB C 33 42.205 42.516 -0.311 1
1 410 . 9 1 1 A 33 33 ASP N N 33 128.453 125.910 2.543 1
1 411 . 9 1 1 A 34 34 TYR H H 34 9.144 8.445 0.699 1
1 412 . 9 1 1 A 34 34 TYR HA H 34 4.689 5.257 -0.568 1
1 419 . 9 1 1 A 34 34 TYR C C 34 170.622 172.554 -1.932 1
1 420 . 9 1 1 A 34 34 TYR CA C 34 55.930 55.999 -0.069 1
1 421 . 9 1 1 A 34 34 TYR CB C 34 41.905 41.310 0.595 1
1 424 . 9 1 1 A 34 34 TYR N N 34 121.657 119.806 1.851 1
1 425 . 9 1 1 A 35 35 LEU H H 35 8.324 8.444 -0.120 1
1 426 . 9 1 1 A 35 35 LEU HA H 35 4.396 4.582 -0.186 1
1 436 . 9 1 1 A 35 35 LEU C C 35 175.301 175.987 -0.686 1
1 437 . 9 1 1 A 35 35 LEU CA C 35 52.909 54.246 -1.337 1
1 438 . 9 1 1 A 35 35 LEU CB C 35 42.816 42.973 -0.157 1
1 442 . 9 1 1 A 35 35 LEU N N 35 124.514 123.477 1.037 1
1 443 . 9 1 1 A 36 36 HIS H H 36 8.763 8.380 0.383 1
1 444 . 9 1 1 A 36 36 HIS HA H 36 4.382 4.584 -0.202 1
1 449 . 9 1 1 A 36 36 HIS C C 36 176.514 176.276 0.238 1
1 450 . 9 1 1 A 36 36 HIS CA C 36 59.570 57.651 1.919 1
1 451 . 9 1 1 A 36 36 HIS CB C 36 31.257 29.506 1.751 1
1 454 . 9 1 1 A 36 36 HIS N N 36 132.209 126.087 6.122 1
1 455 . 9 1 1 A 37 37 GLY H H 37 8.745 8.613 0.132 1
1 456 . 9 1 1 A 37 37 GLY HA2 H 37 4.021 3.943 0.078 1
1 457 . 9 1 1 A 37 37 GLY HA3 H 37 3.592 4.073 -0.481 1
1 458 . 9 1 1 A 37 37 GLY C C 37 175.081 173.628 1.453 1
1 459 . 9 1 1 A 37 37 GLY CA C 37 45.621 45.433 0.188 1
1 460 . 9 1 1 A 37 37 GLY N N 37 117.737 114.835 2.902 1
1 461 . 9 1 1 A 38 38 HIS H H 38 8.470 7.586 0.884 1
1 462 . 9 1 1 A 38 38 HIS HA H 38 4.584 4.845 -0.261 1
1 467 . 9 1 1 A 38 38 HIS C C 38 175.334 174.718 0.616 1
1 468 . 9 1 1 A 38 38 HIS CA C 38 55.899 54.352 1.547 1
1 469 . 9 1 1 A 38 38 HIS CB C 38 30.865 29.312 1.553 1
1 472 . 9 1 1 A 38 38 HIS N N 38 119.813 114.460 5.353 1
1 473 . 9 1 1 A 39 39 GLY H H 39 8.936 8.390 0.546 1
1 474 . 9 1 1 A 39 39 GLY HA2 H 39 3.895 4.009 -0.114 1
1 475 . 9 1 1 A 39 39 GLY HA3 H 39 3.895 4.063 -0.168 1
1 476 . 9 1 1 A 39 39 GLY C C 39 175.557 174.222 1.335 1
1 477 . 9 1 1 A 39 39 GLY CA C 39 46.938 45.716 1.222 1
1 478 . 9 1 1 A 39 39 GLY N N 39 112.442 108.260 4.182 1
1 479 . 9 1 1 A 40 40 SER H H 40 9.249 8.463 0.786 1
1 480 . 9 1 1 A 40 40 SER HA H 40 4.299 4.635 -0.336 1
1 483 . 9 1 1 A 40 40 SER C C 40 174.138 174.784 -0.646 1
1 484 . 9 1 1 A 40 40 SER CA C 40 60.809 60.042 0.767 1
1 485 . 9 1 1 A 40 40 SER CB C 40 64.041 65.035 -0.994 1
1 486 . 9 1 1 A 40 40 SER N N 40 117.098 119.262 -2.164 1
1 487 . 9 1 1 A 41 41 LEU H H 41 7.386 7.593 -0.207 1
1 488 . 9 1 1 A 41 41 LEU HA H 41 4.429 3.904 0.525 1
1 498 . 9 1 1 A 41 41 LEU C C 41 176.526 177.259 -0.733 1
1 499 . 9 1 1 A 41 41 LEU CA C 41 52.295 55.270 -2.975 1
1 500 . 9 1 1 A 41 41 LEU CB C 41 44.147 41.450 2.697 1
1 504 . 9 1 1 A 41 41 LEU N N 41 120.541 119.681 0.860 1
1 505 . 9 1 1 A 42 42 ILE H H 42 7.407 8.153 -0.746 1
1 506 . 9 1 1 A 42 42 ILE HA H 42 3.756 4.045 -0.289 1
1 516 . 9 1 1 A 42 42 ILE C C 42 178.081 176.971 1.110 1
1 517 . 9 1 1 A 42 42 ILE CA C 42 62.257 60.423 1.834 1
1 518 . 9 1 1 A 42 42 ILE CB C 42 38.256 39.531 -1.275 1
1 522 . 9 1 1 A 42 42 ILE N N 42 115.050 122.138 -7.088 1
1 523 . 9 1 1 A 43 43 SER H H 43 8.581 8.790 -0.209 1
1 524 . 9 1 1 A 43 43 SER HA H 43 3.957 4.044 -0.087 1
1 527 . 9 1 1 A 43 43 SER C C 43 177.830 176.859 0.971 1
1 528 . 9 1 1 A 43 43 SER CA C 43 61.958 62.569 -0.611 1
1 529 . 9 1 1 A 43 43 SER CB C 43 62.680 62.415 0.265 1
1 530 . 9 1 1 A 43 43 SER N N 43 121.456 117.094 4.362 1
1 531 . 9 1 1 A 44 44 GLY H H 44 8.892 8.034 0.858 1
1 532 . 9 1 1 A 44 44 GLY HA2 H 44 3.514 3.771 -0.257 1
1 533 . 9 1 1 A 44 44 GLY HA3 H 44 3.854 3.784 0.070 1
1 534 . 9 1 1 A 44 44 GLY C C 44 175.296 175.482 -0.186 1
1 535 . 9 1 1 A 44 44 GLY CA C 44 46.854 47.347 -0.493 1
1 536 . 9 1 1 A 44 44 GLY N N 44 106.351 109.666 -3.315 1
1 537 . 9 1 1 A 45 45 LEU H H 45 6.824 7.968 -1.144 1
1 538 . 9 1 1 A 45 45 LEU HA H 45 3.909 4.029 -0.120 1
1 548 . 9 1 1 A 45 45 LEU C C 45 176.738 178.493 -1.755 1
1 549 . 9 1 1 A 45 45 LEU CA C 45 56.356 57.197 -0.841 1
1 550 . 9 1 1 A 45 45 LEU CB C 45 42.296 41.220 1.076 1
1 554 . 9 1 1 A 45 45 LEU N N 45 119.207 122.697 -3.490 1
1 555 . 9 1 1 A 46 46 GLU H H 46 7.556 7.896 -0.340 1
1 556 . 9 1 1 A 46 46 GLU HA H 46 3.664 4.067 -0.403 1
1 561 . 9 1 1 A 46 46 GLU C C 46 179.231 179.585 -0.354 1
1 562 . 9 1 1 A 46 46 GLU CA C 46 62.316 59.639 2.677 1
1 563 . 9 1 1 A 46 46 GLU CB C 46 29.147 29.257 -0.110 1
1 565 . 9 1 1 A 46 46 GLU N N 46 119.049 117.972 1.077 1
1 566 . 9 1 1 A 47 47 THR H H 47 8.219 8.054 0.165 1
1 567 . 9 1 1 A 47 47 THR HA H 47 3.965 3.887 0.078 1
1 572 . 9 1 1 A 47 47 THR C C 47 176.251 176.412 -0.161 1
1 573 . 9 1 1 A 47 47 THR CA C 47 65.947 66.440 -0.493 1
1 574 . 9 1 1 A 47 47 THR CB C 47 69.014 68.371 0.643 1
1 576 . 9 1 1 A 47 47 THR N N 47 111.770 117.632 -5.862 1
1 577 . 9 1 1 A 48 48 ALA H H 48 6.794 8.264 -1.470 1
1 578 . 9 1 1 A 48 48 ALA HA H 48 4.171 4.175 -0.004 1
1 582 . 9 1 1 A 48 48 ALA C C 48 178.639 180.540 -1.901 1
1 583 . 9 1 1 A 48 48 ALA CA C 48 54.072 55.203 -1.131 1
1 584 . 9 1 1 A 48 48 ALA CB C 48 19.752 18.590 1.162 1
1 585 . 9 1 1 A 48 48 ALA N N 48 122.697 123.607 -0.910 1
1 586 . 9 1 1 A 49 49 LEU H H 49 7.691 8.282 -0.591 1
1 587 . 9 1 1 A 49 49 LEU HA H 49 3.902 4.483 -0.581 1
1 597 . 9 1 1 A 49 49 LEU C C 49 176.823 177.757 -0.934 1
1 598 . 9 1 1 A 49 49 LEU CA C 49 57.190 57.910 -0.720 1
1 599 . 9 1 1 A 49 49 LEU CB C 49 43.628 41.389 2.239 1
1 603 . 9 1 1 A 49 49 LEU N N 49 117.159 118.487 -1.328 1
1 604 . 9 1 1 A 50 50 GLU H H 50 6.963 7.997 -1.034 1
1 605 . 9 1 1 A 50 50 GLU HA H 50 3.220 4.071 -0.851 1
1 610 . 9 1 1 A 50 50 GLU C C 50 176.691 177.406 -0.715 1
1 611 . 9 1 1 A 50 50 GLU CA C 50 58.769 58.479 0.290 1
1 612 . 9 1 1 A 50 50 GLU CB C 50 29.792 29.665 0.127 1
1 614 . 9 1 1 A 50 50 GLU N N 50 118.761 119.491 -0.730 1
1 615 . 9 1 1 A 51 51 GLY H H 51 8.541 8.279 0.262 1
1 616 . 9 1 1 A 51 51 GLY HA2 H 51 4.140 3.778 0.362 1
1 617 . 9 1 1 A 51 51 GLY HA3 H 51 3.488 3.868 -0.380 1
1 618 . 9 1 1 A 51 51 GLY C C 51 173.801 173.896 -0.095 1
1 619 . 9 1 1 A 51 51 GLY CA C 51 45.498 45.370 0.128 1
1 620 . 9 1 1 A 51 51 GLY N N 51 113.511 111.704 1.807 1
1 621 . 9 1 1 A 52 52 HIS H H 52 7.656 7.501 0.155 1
1 622 . 9 1 1 A 52 52 HIS HA H 52 4.318 4.615 -0.297 1
1 627 . 9 1 1 A 52 52 HIS C C 52 172.815 174.181 -1.366 1
1 628 . 9 1 1 A 52 52 HIS CA C 52 57.562 56.035 1.527 1
1 629 . 9 1 1 A 52 52 HIS CB C 52 28.670 31.066 -2.396 1
1 632 . 9 1 1 A 52 52 HIS N N 52 116.844 118.756 -1.912 1
1 633 . 9 1 1 A 53 53 GLU H H 53 8.331 8.608 -0.277 1
1 634 . 9 1 1 A 53 53 GLU HA H 53 4.636 4.834 -0.198 1
1 639 . 9 1 1 A 53 53 GLU C C 53 176.145 176.067 0.078 1
1 640 . 9 1 1 A 53 53 GLU CA C 53 54.891 54.420 0.471 1
1 641 . 9 1 1 A 53 53 GLU CB C 53 33.837 33.321 0.516 1
1 643 . 9 1 1 A 53 53 GLU N N 53 118.873 119.813 -0.940 1
1 644 . 9 1 1 A 54 54 VAL H H 54 8.585 8.420 0.165 1
1 645 . 9 1 1 A 54 54 VAL HA H 54 3.227 4.009 -0.782 1
1 653 . 9 1 1 A 54 54 VAL C C 54 177.218 176.465 0.753 1
1 654 . 9 1 1 A 54 54 VAL CA C 54 65.848 63.541 2.307 1
1 655 . 9 1 1 A 54 54 VAL CB C 54 31.189 31.534 -0.345 1
1 658 . 9 1 1 A 54 54 VAL N N 54 120.580 121.510 -0.930 1
1 659 . 9 1 1 A 55 55 GLY H H 55 8.912 9.630 -0.718 1
1 660 . 9 1 1 A 55 55 GLY HA2 H 55 4.441 4.019 0.422 1
1 661 . 9 1 1 A 55 55 GLY HA3 H 55 3.865 4.022 -0.157 1
1 662 . 9 1 1 A 55 55 GLY C C 55 174.827 174.101 0.726 1
1 663 . 9 1 1 A 55 55 GLY CA C 55 44.370 44.983 -0.613 1
1 664 . 9 1 1 A 55 55 GLY N N 55 118.078 114.912 3.166 1
1 665 . 9 1 1 A 56 56 ASP H H 56 8.098 7.630 0.468 1
1 666 . 9 1 1 A 56 56 ASP HA H 56 4.547 4.700 -0.153 1
1 669 . 9 1 1 A 56 56 ASP C C 56 174.859 175.021 -0.162 1
1 670 . 9 1 1 A 56 56 ASP CA C 56 55.629 54.024 1.605 1
1 671 . 9 1 1 A 56 56 ASP CB C 56 40.906 41.354 -0.448 1
1 672 . 9 1 1 A 56 56 ASP N N 56 123.094 121.051 2.043 1
1 673 . 9 1 1 A 57 57 LYS H H 57 8.168 8.653 -0.485 1
1 674 . 9 1 1 A 57 57 LYS HA H 57 5.471 5.878 -0.407 1
1 683 . 9 1 1 A 57 57 LYS C C 57 175.732 175.054 0.678 1
1 684 . 9 1 1 A 57 57 LYS CA C 57 55.056 54.983 0.073 1
1 685 . 9 1 1 A 57 57 LYS CB C 57 35.302 36.228 -0.926 1
1 689 . 9 1 1 A 57 57 LYS N N 57 122.301 122.348 -0.047 1
1 690 . 9 1 1 A 58 58 PHE H H 58 8.355 8.472 -0.117 1
1 691 . 9 1 1 A 58 58 PHE HA H 58 4.858 5.144 -0.286 1
1 699 . 9 1 1 A 58 58 PHE C C 58 171.549 172.378 -0.829 1
1 700 . 9 1 1 A 58 58 PHE CA C 58 56.195 56.059 0.136 1
1 701 . 9 1 1 A 58 58 PHE CB C 58 39.335 40.832 -1.497 1
1 705 . 9 1 1 A 58 58 PHE N N 58 121.026 120.942 0.084 1
1 706 . 9 1 1 A 59 59 ASP H H 59 8.407 9.118 -0.711 1
1 707 . 9 1 1 A 59 59 ASP HA H 59 5.743 5.576 0.167 1
1 710 . 9 1 1 A 59 59 ASP C C 59 176.302 174.669 1.633 1
1 711 . 9 1 1 A 59 59 ASP CA C 59 52.579 52.202 0.377 1
1 712 . 9 1 1 A 59 59 ASP CB C 59 43.628 44.413 -0.785 1
1 713 . 9 1 1 A 59 59 ASP N N 59 119.234 119.084 0.150 1
1 714 . 9 1 1 A 60 60 VAL H H 60 8.915 8.948 -0.033 1
1 715 . 9 1 1 A 60 60 VAL HA H 60 4.374 4.972 -0.598 1
1 723 . 9 1 1 A 60 60 VAL C C 60 173.140 174.489 -1.349 1
1 724 . 9 1 1 A 60 60 VAL CA C 60 61.252 60.354 0.898 1
1 725 . 9 1 1 A 60 60 VAL CB C 60 35.620 36.103 -0.483 1
1 728 . 9 1 1 A 60 60 VAL N N 60 119.758 120.278 -0.520 1
1 729 . 9 1 1 A 61 61 ALA H H 61 8.761 8.943 -0.182 1
1 730 . 9 1 1 A 61 61 ALA HA H 61 5.091 5.290 -0.199 1
1 734 . 9 1 1 A 61 61 ALA C C 61 176.460 176.309 0.151 1
1 735 . 9 1 1 A 61 61 ALA CA C 61 51.019 50.896 0.123 1
1 736 . 9 1 1 A 61 61 ALA CB C 61 19.447 21.331 -1.884 1
1 737 . 9 1 1 A 61 61 ALA N N 61 133.341 128.309 5.032 1
1 738 . 9 1 1 A 62 62 VAL H H 62 8.929 9.270 -0.341 1
1 739 . 9 1 1 A 62 62 VAL HA H 62 4.236 4.734 -0.498 1
1 747 . 9 1 1 A 62 62 VAL C C 62 174.733 175.594 -0.861 1
1 748 . 9 1 1 A 62 62 VAL CA C 62 61.007 61.026 -0.019 1
1 749 . 9 1 1 A 62 62 VAL CB C 62 34.387 35.329 -0.942 1
1 752 . 9 1 1 A 62 62 VAL N N 62 124.165 122.820 1.345 1
1 753 . 9 1 1 A 63 63 GLY H H 63 8.995 8.705 0.290 1
1 754 . 9 1 1 A 63 63 GLY HA2 H 63 4.229 4.120 0.109 1
1 755 . 9 1 1 A 63 63 GLY HA3 H 63 3.637 4.121 -0.484 1
1 756 . 9 1 1 A 63 63 GLY C C 63 175.306 174.892 0.414 1
1 757 . 9 1 1 A 63 63 GLY CA C 63 44.620 45.190 -0.570 1
1 758 . 9 1 1 A 63 63 GLY N N 63 115.598 113.370 2.228 1
1 759 . 9 1 1 A 64 64 ALA H H 64 8.106 8.929 -0.823 1
1 760 . 9 1 1 A 64 64 ALA HA H 64 4.010 4.035 -0.025 1
1 764 . 9 1 1 A 64 64 ALA C C 64 180.218 179.560 0.658 1
1 765 . 9 1 1 A 64 64 ALA CA C 64 55.897 54.728 1.169 1
1 766 . 9 1 1 A 64 64 ALA CB C 64 18.347 18.431 -0.084 1
1 767 . 9 1 1 A 64 64 ALA N N 64 122.859 123.851 -0.992 1
1 768 . 9 1 1 A 65 65 ASN H H 65 8.748 8.555 0.193 1
1 769 . 9 1 1 A 65 65 ASN HA H 65 4.230 4.429 -0.199 1
1 774 . 9 1 1 A 65 65 ASN C C 65 176.085 176.512 -0.427 1
1 775 . 9 1 1 A 65 65 ASN CA C 65 56.064 55.663 0.401 1
1 776 . 9 1 1 A 65 65 ASN CB C 65 37.871 37.483 0.388 1
1 777 . 9 1 1 A 65 65 ASN N N 65 114.590 114.513 0.077 1
1 779 . 9 1 1 A 66 66 ASP H H 66 7.598 7.761 -0.163 1
1 780 . 9 1 1 A 66 66 ASP HA H 66 4.682 4.553 0.129 1
1 783 . 9 1 1 A 66 66 ASP C C 66 173.061 176.525 -3.464 1
1 784 . 9 1 1 A 66 66 ASP CA C 66 53.549 55.421 -1.872 1
1 785 . 9 1 1 A 66 66 ASP CB C 66 42.204 41.654 0.550 1
1 786 . 9 1 1 A 66 66 ASP N N 66 118.065 118.125 -0.060 1
1 787 . 9 1 1 A 67 67 ALA H H 67 7.434 7.789 -0.355 1
1 788 . 9 1 1 A 67 67 ALA HA H 67 4.316 4.346 -0.030 1
1 792 . 9 1 1 A 67 67 ALA C C 67 175.615 178.106 -2.491 1
1 793 . 9 1 1 A 67 67 ALA CA C 67 50.814 50.519 0.295 1
1 794 . 9 1 1 A 67 67 ALA CB C 67 18.618 19.713 -1.095 1
1 795 . 9 1 1 A 67 67 ALA N N 67 124.890 121.517 3.373 1
1 796 . 9 1 1 A 68 68 TYR H H 68 8.390 8.439 -0.049 1
1 797 . 9 1 1 A 68 68 TYR HA H 68 4.195 4.155 0.040 1
1 804 . 9 1 1 A 68 68 TYR C C 68 174.964 176.347 -1.383 1
1 805 . 9 1 1 A 68 68 TYR CA C 68 59.566 60.665 -1.099 1
1 806 . 9 1 1 A 68 68 TYR CB C 68 36.992 39.035 -2.043 1
1 809 . 9 1 1 A 68 68 TYR N N 68 121.083 118.025 3.058 1
1 810 . 9 1 1 A 69 69 GLY H H 69 8.149 8.238 -0.089 1
1 811 . 9 1 1 A 69 69 GLY HA2 H 69 4.254 4.007 0.247 1
1 812 . 9 1 1 A 69 69 GLY HA3 H 69 3.624 4.020 -0.396 1
1 813 . 9 1 1 A 69 69 GLY C C 69 173.161 174.292 -1.131 1
1 814 . 9 1 1 A 69 69 GLY CA C 69 44.465 45.133 -0.668 1
1 815 . 9 1 1 A 69 69 GLY N N 69 108.762 107.676 1.086 1
1 816 . 9 1 1 A 70 70 GLN H H 70 8.450 7.861 0.589 1
1 817 . 9 1 1 A 70 70 GLN HA H 70 4.140 4.720 -0.580 1
1 824 . 9 1 1 A 70 70 GLN C C 70 176.138 175.031 1.107 1
1 825 . 9 1 1 A 70 70 GLN CA C 70 54.680 55.043 -0.363 1
1 826 . 9 1 1 A 70 70 GLN CB C 70 29.210 30.582 -1.372 1
1 828 . 9 1 1 A 70 70 GLN N N 70 117.002 119.848 -2.846 1
1 830 . 9 1 1 A 71 71 TYR H H 71 8.991 8.780 0.211 1
1 831 . 9 1 1 A 71 71 TYR HA H 71 3.752 4.524 -0.772 1
1 838 . 9 1 1 A 71 71 TYR C C 71 174.548 174.773 -0.225 1
1 839 . 9 1 1 A 71 71 TYR CA C 71 59.868 58.151 1.717 1
1 840 . 9 1 1 A 71 71 TYR CB C 71 38.961 39.306 -0.345 1
1 843 . 9 1 1 A 71 71 TYR N N 71 125.112 120.827 4.285 1
1 844 . 9 1 1 A 72 72 ASP H H 72 8.819 8.335 0.484 1
1 845 . 9 1 1 A 72 72 ASP HA H 72 4.773 4.422 0.351 1
1 848 . 9 1 1 A 72 72 ASP C C 72 177.709 176.752 0.957 1
1 849 . 9 1 1 A 72 72 ASP CA C 72 52.382 52.476 -0.094 1
1 850 . 9 1 1 A 72 72 ASP CB C 72 42.197 39.982 2.215 1
1 851 . 9 1 1 A 72 72 ASP N N 72 129.918 123.452 6.466 1
1 852 . 9 1 1 A 73 73 GLU H H 73 9.409 8.038 1.371 1
1 853 . 9 1 1 A 73 73 GLU HA H 73 3.937 4.150 -0.213 1
1 858 . 9 1 1 A 73 73 GLU C C 73 177.581 176.861 0.720 1
1 859 . 9 1 1 A 73 73 GLU CA C 73 58.962 58.229 0.733 1
1 860 . 9 1 1 A 73 73 GLU CB C 73 29.155 28.561 0.594 1
1 862 . 9 1 1 A 73 73 GLU N N 73 129.624 125.986 3.638 1
1 863 . 9 1 1 A 74 74 ASN H H 74 8.700 7.812 0.888 1
1 864 . 9 1 1 A 74 74 ASN HA H 74 4.550 4.586 -0.036 1
1 869 . 9 1 1 A 74 74 ASN C C 74 176.190 176.994 -0.804 1
1 870 . 9 1 1 A 74 74 ASN CA C 74 54.932 54.852 0.080 1
1 871 . 9 1 1 A 74 74 ASN CB C 74 38.113 38.767 -0.654 1
1 872 . 9 1 1 A 74 74 ASN N N 74 116.792 117.513 -0.721 1
1 874 . 9 1 1 A 75 75 LEU H H 75 7.303 7.975 -0.672 1
1 875 . 9 1 1 A 75 75 LEU HA H 75 4.289 4.204 0.085 1
1 885 . 9 1 1 A 75 75 LEU C C 75 175.821 177.039 -1.218 1
1 886 . 9 1 1 A 75 75 LEU CA C 75 54.106 56.680 -2.574 1
1 887 . 9 1 1 A 75 75 LEU CB C 75 41.239 42.160 -0.921 1
1 891 . 9 1 1 A 75 75 LEU N N 75 117.094 119.594 -2.500 1
1 892 . 9 1 1 A 76 76 VAL H H 76 7.181 7.450 -0.269 1
1 893 . 9 1 1 A 76 76 VAL HA H 76 4.970 4.077 0.893 1
1 901 . 9 1 1 A 76 76 VAL C C 76 175.702 175.636 0.066 1
1 902 . 9 1 1 A 76 76 VAL CA C 76 61.733 63.025 -1.292 1
1 903 . 9 1 1 A 76 76 VAL CB C 76 31.822 32.288 -0.466 1
1 905 . 9 1 1 A 76 76 VAL N N 76 124.716 121.333 3.383 1
1 906 . 9 1 1 A 77 77 GLN H H 77 8.791 8.817 -0.026 1
1 907 . 9 1 1 A 77 77 GLN HA H 77 4.695 4.967 -0.272 1
1 914 . 9 1 1 A 77 77 GLN C C 77 173.553 173.932 -0.379 1
1 915 . 9 1 1 A 77 77 GLN CA C 77 54.038 54.076 -0.038 1
1 916 . 9 1 1 A 77 77 GLN CB C 77 33.018 32.148 0.870 1
1 918 . 9 1 1 A 77 77 GLN N N 77 124.898 122.546 2.352 1
1 920 . 9 1 1 A 78 78 ARG H H 78 8.530 8.475 0.055 1
1 921 . 9 1 1 A 78 78 ARG HA H 78 5.107 5.297 -0.190 1
1 928 . 9 1 1 A 78 78 ARG C C 78 176.182 175.592 0.590 1
1 929 . 9 1 1 A 78 78 ARG CA C 78 55.355 55.301 0.054 1
1 930 . 9 1 1 A 78 78 ARG CB C 78 31.150 32.333 -1.183 1
1 933 . 9 1 1 A 78 78 ARG N N 78 123.413 120.498 2.915 1
1 934 . 9 1 1 A 79 79 VAL H H 79 9.300 8.799 0.501 1
1 935 . 9 1 1 A 79 79 VAL HA H 79 4.824 4.588 0.236 1
1 943 . 9 1 1 A 79 79 VAL CA C 79 58.731 58.964 -0.233 1
1 944 . 9 1 1 A 79 79 VAL CB C 79 34.836 35.629 -0.793 1
1 947 . 9 1 1 A 79 79 VAL N N 79 125.252 122.283 2.969 1
1 948 . 9 1 1 A 80 80 PRO HA H 80 4.339 4.698 -0.359 1
1 955 . 9 1 1 A 80 80 PRO C C 80 176.902 177.903 -1.001 1
1 956 . 9 1 1 A 80 80 PRO CA C 80 62.969 63.335 -0.366 1
1 957 . 9 1 1 A 80 80 PRO CB C 80 32.431 31.823 0.608 1
1 960 . 9 1 1 A 81 81 LYS H H 81 7.816 8.632 -0.816 1
1 961 . 9 1 1 A 81 81 LYS HA H 81 3.790 4.110 -0.320 1
1 970 . 9 1 1 A 81 81 LYS C C 81 177.808 178.913 -1.105 1
1 971 . 9 1 1 A 81 81 LYS CA C 81 59.874 59.341 0.533 1
1 972 . 9 1 1 A 81 81 LYS CB C 81 32.670 32.021 0.649 1
1 976 . 9 1 1 A 81 81 LYS N N 81 120.948 123.421 -2.473 1
1 977 . 9 1 1 A 82 82 ASP H H 82 8.069 8.238 -0.169 1
1 978 . 9 1 1 A 82 82 ASP HA H 82 4.243 4.428 -0.185 1
1 981 . 9 1 1 A 82 82 ASP C C 82 177.157 178.931 -1.774 1
1 982 . 9 1 1 A 82 82 ASP CA C 82 55.527 56.660 -1.133 1
1 983 . 9 1 1 A 82 82 ASP CB C 82 40.005 41.432 -1.427 1
1 984 . 9 1 1 A 82 82 ASP N N 82 116.004 120.128 -4.124 1
1 985 . 9 1 1 A 83 83 VAL H H 83 7.150 8.017 -0.867 1
1 986 . 9 1 1 A 83 83 VAL HA H 83 3.719 3.467 0.252 1
1 994 . 9 1 1 A 83 83 VAL C C 83 176.346 176.967 -0.621 1
1 995 . 9 1 1 A 83 83 VAL CA C 83 63.868 66.132 -2.264 1
1 996 . 9 1 1 A 83 83 VAL CB C 83 31.689 31.452 0.237 1
1 999 . 9 1 1 A 83 83 VAL N N 83 117.199 118.977 -1.778 1
1 1000 . 9 1 1 A 84 84 PHE H H 84 7.365 7.806 -0.441 1
1 1001 . 9 1 1 A 84 84 PHE HA H 84 4.389 4.569 -0.180 1
1 1009 . 9 1 1 A 84 84 PHE C C 84 175.265 176.614 -1.349 1
1 1010 . 9 1 1 A 84 84 PHE CA C 84 57.210 56.998 0.212 1
1 1011 . 9 1 1 A 84 84 PHE CB C 84 38.968 37.635 1.333 1
1 1015 . 9 1 1 A 84 84 PHE N N 84 119.897 116.967 2.930 1
1 1016 . 9 1 1 A 85 85 MET H H 85 7.765 8.002 -0.237 1
1 1017 . 9 1 1 A 85 85 MET HA H 85 4.277 4.332 -0.055 1
1 1025 . 9 1 1 A 85 85 MET C C 85 176.856 177.239 -0.383 1
1 1026 . 9 1 1 A 85 85 MET CA C 85 56.389 57.726 -1.337 1
1 1027 . 9 1 1 A 85 85 MET CB C 85 32.715 32.440 0.275 1
1 1030 . 9 1 1 A 85 85 MET N N 85 121.131 119.125 2.006 1
1 1031 . 9 1 1 A 86 86 GLY H H 86 8.499 8.244 0.255 1
1 1032 . 9 1 1 A 86 86 GLY HA2 H 86 3.928 3.954 -0.026 1
1 1033 . 9 1 1 A 86 86 GLY HA3 H 86 3.793 3.955 -0.162 1
1 1034 . 9 1 1 A 86 86 GLY C C 86 174.168 174.051 0.117 1
1 1035 . 9 1 1 A 86 86 GLY CA C 86 45.637 45.247 0.390 1
1 1036 . 9 1 1 A 86 86 GLY N N 86 111.268 107.731 3.537 1
1 1037 . 9 1 1 A 87 87 VAL H H 87 7.564 7.848 -0.284 1
1 1038 . 9 1 1 A 87 87 VAL HA H 87 4.083 4.104 -0.021 1
1 1046 . 9 1 1 A 87 87 VAL C C 87 175.649 176.066 -0.417 1
1 1047 . 9 1 1 A 87 87 VAL CA C 87 61.809 61.712 0.097 1
1 1048 . 9 1 1 A 87 87 VAL CB C 87 32.667 32.808 -0.141 1
1 1051 . 9 1 1 A 87 87 VAL N N 87 118.839 120.338 -1.499 1
1 1052 . 9 1 1 A 88 88 ASP H H 88 8.270 8.800 -0.530 1
1 1053 . 9 1 1 A 88 88 ASP HA H 88 4.421 4.296 0.125 1
1 1056 . 9 1 1 A 88 88 ASP C C 88 175.977 175.234 0.743 1
1 1057 . 9 1 1 A 88 88 ASP CA C 88 55.655 57.156 -1.501 1
1 1058 . 9 1 1 A 88 88 ASP CB C 88 41.364 41.119 0.245 1
1 1059 . 9 1 1 A 88 88 ASP N N 88 124.401 125.267 -0.866 1
1 1060 . 9 1 1 A 89 89 GLU H H 89 7.833 7.903 -0.070 1
1 1061 . 9 1 1 A 89 89 GLU HA H 89 4.206 4.723 -0.517 1
1 1066 . 9 1 1 A 89 89 GLU C C 89 174.912 175.534 -0.622 1
1 1067 . 9 1 1 A 89 89 GLU CA C 89 55.739 55.047 0.692 1
1 1068 . 9 1 1 A 89 89 GLU CB C 89 30.603 32.645 -2.042 1
1 1070 . 9 1 1 A 89 89 GLU N N 89 119.378 115.757 3.621 1
1 1071 . 9 1 1 A 90 90 LEU H H 90 8.051 8.761 -0.710 1
1 1072 . 9 1 1 A 90 90 LEU HA H 90 4.127 4.328 -0.201 1
1 1082 . 9 1 1 A 90 90 LEU C C 90 175.753 175.870 -0.117 1
1 1083 . 9 1 1 A 90 90 LEU CA C 90 54.929 55.340 -0.411 1
1 1084 . 9 1 1 A 90 90 LEU CB C 90 42.710 41.083 1.627 1
1 1088 . 9 1 1 A 90 90 LEU N N 90 124.432 126.194 -1.762 1
1 1089 . 9 1 1 A 91 91 GLN H H 91 7.341 8.774 -1.433 1
1 1090 . 9 1 1 A 91 91 GLN HA H 91 4.546 4.918 -0.372 1
1 1097 . 9 1 1 A 91 91 GLN C C 91 174.655 174.440 0.215 1
1 1098 . 9 1 1 A 91 91 GLN CA C 91 53.671 53.929 -0.258 1
1 1099 . 9 1 1 A 91 91 GLN CB C 91 32.850 32.477 0.373 1
1 1101 . 9 1 1 A 91 91 GLN N N 91 120.186 125.991 -5.805 1
1 1103 . 9 1 1 A 92 92 VAL H H 92 8.442 8.517 -0.075 1
1 1104 . 9 1 1 A 92 92 VAL HA H 92 3.278 3.904 -0.626 1
1 1112 . 9 1 1 A 92 92 VAL C C 92 177.098 177.225 -0.127 1
1 1113 . 9 1 1 A 92 92 VAL CA C 92 64.953 64.388 0.565 1
1 1114 . 9 1 1 A 92 92 VAL CB C 92 31.601 31.838 -0.237 1
1 1117 . 9 1 1 A 92 92 VAL N N 92 121.899 123.558 -1.659 1
1 1118 . 9 1 1 A 93 93 GLY H H 93 9.002 9.433 -0.431 1
1 1119 . 9 1 1 A 93 93 GLY HA2 H 93 4.327 3.943 0.384 1
1 1120 . 9 1 1 A 93 93 GLY HA3 H 93 3.770 3.959 -0.189 1
1 1121 . 9 1 1 A 93 93 GLY C C 93 174.547 174.202 0.345 1
1 1122 . 9 1 1 A 93 93 GLY CA C 93 44.446 45.111 -0.665 1
1 1123 . 9 1 1 A 93 93 GLY N N 93 116.485 115.094 1.391 1
1 1124 . 9 1 1 A 94 94 MET H H 94 7.445 7.858 -0.413 1
1 1125 . 9 1 1 A 94 94 MET HA H 94 4.182 4.535 -0.353 1
1 1133 . 9 1 1 A 94 94 MET C C 94 174.531 175.171 -0.640 1
1 1134 . 9 1 1 A 94 94 MET CA C 94 57.193 55.386 1.807 1
1 1135 . 9 1 1 A 94 94 MET CB C 94 34.474 33.243 1.231 1
1 1138 . 9 1 1 A 94 94 MET N N 94 120.304 120.300 0.004 1
1 1139 . 9 1 1 A 95 95 ARG H H 95 8.169 8.642 -0.473 1
1 1140 . 9 1 1 A 95 95 ARG HA H 95 5.343 4.908 0.435 1
1 1147 . 9 1 1 A 95 95 ARG C C 95 175.593 175.096 0.497 1
1 1148 . 9 1 1 A 95 95 ARG CA C 95 54.898 54.534 0.364 1
1 1149 . 9 1 1 A 95 95 ARG CB C 95 32.928 33.048 -0.120 1
1 1152 . 9 1 1 A 95 95 ARG N N 95 122.066 122.961 -0.895 1
1 1153 . 9 1 1 A 96 96 PHE H H 96 8.440 8.377 0.063 1
1 1154 . 9 1 1 A 96 96 PHE HA H 96 4.738 5.097 -0.359 1
1 1162 . 9 1 1 A 96 96 PHE C C 96 173.273 172.102 1.171 1
1 1163 . 9 1 1 A 96 96 PHE CA C 96 56.174 56.115 0.059 1
1 1164 . 9 1 1 A 96 96 PHE CB C 96 42.474 40.644 1.830 1
1 1168 . 9 1 1 A 96 96 PHE N N 96 119.938 118.811 1.127 1
1 1169 . 9 1 1 A 97 97 LEU H H 97 8.459 8.792 -0.333 1
1 1170 . 9 1 1 A 97 97 LEU HA H 97 4.625 5.039 -0.414 1
1 1180 . 9 1 1 A 97 97 LEU C C 97 175.664 174.931 0.733 1
1 1181 . 9 1 1 A 97 97 LEU CA C 97 53.547 53.719 -0.172 1
1 1182 . 9 1 1 A 97 97 LEU CB C 97 42.379 44.574 -2.195 1
1 1186 . 9 1 1 A 97 97 LEU N N 97 122.014 122.281 -0.267 1
1 1187 . 9 1 1 A 98 98 ALA H H 98 8.812 8.500 0.312 1
1 1188 . 9 1 1 A 98 98 ALA HA H 98 4.520 4.998 -0.478 1
1 1192 . 9 1 1 A 98 98 ALA C C 98 176.373 176.511 -0.138 1
1 1193 . 9 1 1 A 98 98 ALA CA C 98 50.639 51.572 -0.933 1
1 1194 . 9 1 1 A 98 98 ALA CB C 98 20.939 19.797 1.142 1
1 1195 . 9 1 1 A 98 98 ALA N N 98 129.296 127.734 1.562 1
1 1196 . 9 1 1 A 99 99 GLU H H 99 8.504 8.812 -0.308 1
1 1197 . 9 1 1 A 99 99 GLU HA H 99 4.150 4.240 -0.090 1
1 1202 . 9 1 1 A 99 99 GLU C C 99 176.351 176.888 -0.537 1
1 1203 . 9 1 1 A 99 99 GLU CA C 99 56.830 57.309 -0.479 1
1 1204 . 9 1 1 A 99 99 GLU CB C 99 29.639 29.970 -0.331 1
1 1206 . 9 1 1 A 99 99 GLU N N 99 121.993 122.282 -0.289 1
1 1207 . 9 1 1 A 100 100 THR H H 100 7.393 8.829 -1.436 1
1 1208 . 9 1 1 A 100 100 THR HA H 100 4.819 4.856 -0.037 1
1 1213 . 9 1 1 A 100 100 THR C C 100 175.882 175.842 0.040 1
1 1214 . 9 1 1 A 100 100 THR CA C 100 60.329 60.001 0.328 1
1 1215 . 9 1 1 A 100 100 THR CB C 100 73.452 71.254 2.198 1
1 1217 . 9 1 1 A 100 100 THR N N 100 115.598 116.564 -0.966 1
1 1218 . 9 1 1 A 101 101 ASP H H 101 8.988 8.822 0.166 1
1 1219 . 9 1 1 A 101 101 ASP HA H 101 4.357 4.283 0.074 1
1 1222 . 9 1 1 A 101 101 ASP C C 101 176.848 177.047 -0.199 1
1 1223 . 9 1 1 A 101 101 ASP CA C 101 56.493 57.366 -0.873 1
1 1224 . 9 1 1 A 101 101 ASP CB C 101 39.973 40.533 -0.560 1
1 1225 . 9 1 1 A 101 101 ASP N N 101 121.468 120.897 0.571 1
1 1226 . 9 1 1 A 102 102 GLN H H 102 7.937 7.523 0.414 1
1 1227 . 9 1 1 A 102 102 GLN HA H 102 4.415 4.320 0.095 1
1 1234 . 9 1 1 A 102 102 GLN C C 102 175.252 176.078 -0.826 1
1 1235 . 9 1 1 A 102 102 GLN CA C 102 55.097 54.912 0.185 1
1 1236 . 9 1 1 A 102 102 GLN CB C 102 29.121 27.524 1.597 1
1 1238 . 9 1 1 A 102 102 GLN N N 102 117.199 113.918 3.281 1
1 1240 . 9 1 1 A 103 103 GLY H H 103 7.431 8.284 -0.853 1
1 1241 . 9 1 1 A 103 103 GLY HA2 H 103 4.504 4.199 0.305 1
1 1242 . 9 1 1 A 103 103 GLY HA3 H 103 3.868 4.200 -0.332 1
1 1243 . 9 1 1 A 103 103 GLY CA C 103 44.051 44.441 -0.390 1
1 1244 . 9 1 1 A 103 103 GLY N N 103 110.056 110.520 -0.464 1
1 1245 . 9 1 1 A 104 104 PRO HA H 104 5.057 4.755 0.302 1
1 1252 . 9 1 1 A 104 104 PRO C C 104 177.873 175.821 2.052 1
1 1253 . 9 1 1 A 104 104 PRO CA C 104 62.464 62.949 -0.485 1
1 1254 . 9 1 1 A 104 104 PRO CB C 104 31.939 31.732 0.207 1
1 1257 . 9 1 1 A 105 105 VAL H H 105 8.960 8.690 0.270 1
1 1258 . 9 1 1 A 105 105 VAL HA H 105 4.678 4.517 0.161 1
1 1266 . 9 1 1 A 105 105 VAL CA C 105 58.474 59.277 -0.803 1
1 1267 . 9 1 1 A 105 105 VAL CB C 105 35.512 33.439 2.073 1
1 1270 . 9 1 1 A 105 105 VAL N N 105 123.240 122.879 0.361 1
1 1271 . 9 1 1 A 106 106 PRO HA H 106 4.777 4.614 0.163 1
1 1278 . 9 1 1 A 106 106 PRO C C 106 176.823 176.338 0.485 1
1 1279 . 9 1 1 A 106 106 PRO CA C 106 62.508 63.100 -0.592 1
1 1280 . 9 1 1 A 106 106 PRO CB C 106 31.650 31.875 -0.225 1
1 1283 . 9 1 1 A 107 107 VAL H H 107 8.835 8.266 0.569 1
1 1284 . 9 1 1 A 107 107 VAL HA H 107 4.719 4.849 -0.130 1
1 1292 . 9 1 1 A 107 107 VAL C C 107 173.661 173.197 0.464 1
1 1293 . 9 1 1 A 107 107 VAL CA C 107 59.026 59.243 -0.217 1
1 1294 . 9 1 1 A 107 107 VAL CB C 107 36.406 36.026 0.380 1
1 1297 . 9 1 1 A 107 107 VAL N N 107 117.474 117.357 0.117 1
1 1298 . 9 1 1 A 108 108 GLU H H 108 7.698 8.768 -1.070 1
1 1299 . 9 1 1 A 108 108 GLU HA H 108 5.133 5.064 0.069 1
1 1304 . 9 1 1 A 108 108 GLU C C 108 176.394 175.370 1.024 1
1 1305 . 9 1 1 A 108 108 GLU CA C 108 53.808 54.366 -0.558 1
1 1306 . 9 1 1 A 108 108 GLU CB C 108 33.984 33.001 0.983 1
1 1308 . 9 1 1 A 108 108 GLU N N 108 120.646 121.432 -0.786 1
1 1309 . 9 1 1 A 109 109 ILE H H 109 8.690 8.883 -0.193 1
1 1310 . 9 1 1 A 109 109 ILE HA H 109 4.484 4.251 0.233 1
1 1320 . 9 1 1 A 109 109 ILE C C 109 177.313 177.197 0.116 1
1 1321 . 9 1 1 A 109 109 ILE CA C 109 61.789 61.950 -0.161 1
1 1322 . 9 1 1 A 109 109 ILE CB C 109 36.628 37.725 -1.097 1
1 1326 . 9 1 1 A 109 109 ILE N N 109 124.739 127.613 -2.874 1
1 1327 . 9 1 1 A 110 110 THR H H 110 9.300 9.692 -0.392 1
1 1328 . 9 1 1 A 110 110 THR HA H 110 4.547 4.612 -0.065 1
1 1333 . 9 1 1 A 110 110 THR C C 110 174.904 174.494 0.410 1
1 1334 . 9 1 1 A 110 110 THR CA C 110 62.260 61.204 1.056 1
1 1335 . 9 1 1 A 110 110 THR CB C 110 69.100 69.796 -0.696 1
1 1337 . 9 1 1 A 110 110 THR N N 110 122.544 118.188 4.356 1
1 1338 . 9 1 1 A 111 111 ALA H H 111 7.673 7.589 0.084 1
1 1339 . 9 1 1 A 111 111 ALA HA H 111 4.367 4.644 -0.277 1
1 1343 . 9 1 1 A 111 111 ALA C C 111 175.019 175.064 -0.045 1
1 1344 . 9 1 1 A 111 111 ALA CA C 111 53.125 51.826 1.299 1
1 1345 . 9 1 1 A 111 111 ALA CB C 111 21.539 22.549 -1.010 1
1 1346 . 9 1 1 A 111 111 ALA N N 111 123.153 121.052 2.101 1
1 1347 . 9 1 1 A 112 112 VAL H H 112 8.707 8.495 0.212 1
1 1348 . 9 1 1 A 112 112 VAL HA H 112 4.129 4.639 -0.510 1
1 1356 . 9 1 1 A 112 112 VAL C C 112 174.755 175.084 -0.329 1
1 1357 . 9 1 1 A 112 112 VAL CA C 112 62.898 61.630 1.268 1
1 1358 . 9 1 1 A 112 112 VAL CB C 112 33.379 34.695 -1.316 1
1 1361 . 9 1 1 A 112 112 VAL N N 112 122.369 120.125 2.244 1
1 1362 . 9 1 1 A 113 113 GLU H H 113 8.144 8.862 -0.718 1
1 1363 . 9 1 1 A 113 113 GLU HA H 113 4.645 4.546 0.099 1
1 1368 . 9 1 1 A 113 113 GLU C C 113 175.102 177.370 -2.268 1
1 1369 . 9 1 1 A 113 113 GLU CA C 113 54.080 55.102 -1.022 1
1 1370 . 9 1 1 A 113 113 GLU CB C 113 31.234 30.979 0.255 1
1 1372 . 9 1 1 A 113 113 GLU N N 113 127.435 127.058 0.377 1
1 1373 . 9 1 1 A 114 114 ASP H H 114 8.472 8.452 0.020 1
1 1374 . 9 1 1 A 114 114 ASP HA H 114 4.209 4.246 -0.037 1
1 1377 . 9 1 1 A 114 114 ASP C C 114 177.679 177.346 0.333 1
1 1378 . 9 1 1 A 114 114 ASP CA C 114 58.334 57.536 0.798 1
1 1379 . 9 1 1 A 114 114 ASP CB C 114 40.347 40.489 -0.142 1
1 1380 . 9 1 1 A 114 114 ASP N N 114 119.844 121.107 -1.263 1
1 1381 . 9 1 1 A 115 115 ASP H H 115 8.475 7.976 0.499 1
1 1382 . 9 1 1 A 115 115 ASP HA H 115 4.848 4.783 0.065 1
1 1385 . 9 1 1 A 115 115 ASP C C 115 175.968 175.767 0.201 1
1 1386 . 9 1 1 A 115 115 ASP CA C 115 53.290 55.057 -1.767 1
1 1387 . 9 1 1 A 115 115 ASP CB C 115 42.080 42.698 -0.618 1
1 1388 . 9 1 1 A 115 115 ASP N N 115 114.364 116.524 -2.160 1
1 1389 . 9 1 1 A 116 116 HIS H H 116 7.185 7.441 -0.256 1
1 1390 . 9 1 1 A 116 116 HIS HA H 116 5.106 5.449 -0.343 1
1 1395 . 9 1 1 A 116 116 HIS C C 116 172.393 173.578 -1.185 1
1 1396 . 9 1 1 A 116 116 HIS CA C 116 56.099 54.272 1.827 1
1 1397 . 9 1 1 A 116 116 HIS CB C 116 33.289 32.743 0.546 1
1 1400 . 9 1 1 A 116 116 HIS N N 116 117.212 115.262 1.950 1
1 1401 . 9 1 1 A 117 117 VAL H H 117 9.130 8.912 0.218 1
1 1402 . 9 1 1 A 117 117 VAL HA H 117 4.649 4.920 -0.271 1
1 1410 . 9 1 1 A 117 117 VAL C C 117 173.832 175.101 -1.269 1
1 1411 . 9 1 1 A 117 117 VAL CA C 117 59.555 60.191 -0.636 1
1 1412 . 9 1 1 A 117 117 VAL CB C 117 34.676 33.918 0.758 1
1 1415 . 9 1 1 A 117 117 VAL N N 117 114.046 117.446 -3.400 1
1 1416 . 9 1 1 A 118 118 VAL H H 118 8.680 8.702 -0.022 1
1 1417 . 9 1 1 A 118 118 VAL HA H 118 4.747 5.140 -0.393 1
1 1425 . 9 1 1 A 118 118 VAL C C 118 175.836 175.160 0.676 1
1 1426 . 9 1 1 A 118 118 VAL CA C 118 62.159 61.214 0.945 1
1 1427 . 9 1 1 A 118 118 VAL CB C 118 31.887 33.997 -2.110 1
1 1430 . 9 1 1 A 118 118 VAL N N 118 125.095 121.944 3.151 1
1 1431 . 9 1 1 A 119 119 VAL H H 119 9.057 9.073 -0.016 1
1 1432 . 9 1 1 A 119 119 VAL HA H 119 5.231 5.092 0.139 1
1 1440 . 9 1 1 A 119 119 VAL C C 119 173.747 174.000 -0.253 1
1 1441 . 9 1 1 A 119 119 VAL CA C 119 58.326 59.134 -0.808 1
1 1442 . 9 1 1 A 119 119 VAL CB C 119 34.387 34.703 -0.316 1
1 1445 . 9 1 1 A 119 119 VAL N N 119 121.494 121.373 0.121 1
1 1446 . 9 1 1 A 120 120 ASP H H 120 8.926 8.595 0.331 1
1 1447 . 9 1 1 A 120 120 ASP HA H 120 5.174 4.863 0.311 1
1 1450 . 9 1 1 A 120 120 ASP C C 120 177.982 176.585 1.397 1
1 1451 . 9 1 1 A 120 120 ASP CA C 120 52.749 54.043 -1.294 1
1 1452 . 9 1 1 A 120 120 ASP CB C 120 44.542 42.265 2.277 1
1 1453 . 9 1 1 A 120 120 ASP N N 120 121.454 125.167 -3.713 1
1 1454 . 9 1 1 A 121 121 GLY H H 121 8.674 8.527 0.147 1
1 1455 . 9 1 1 A 121 121 GLY HA2 H 121 4.702 4.095 0.607 1
1 1456 . 9 1 1 A 121 121 GLY HA3 H 121 3.573 4.143 -0.570 1
1 1457 . 9 1 1 A 121 121 GLY C C 121 175.041 173.646 1.395 1
1 1458 . 9 1 1 A 121 121 GLY CA C 121 45.319 45.477 -0.158 1
1 1459 . 9 1 1 A 121 121 GLY N N 121 114.850 111.791 3.059 1
1 1460 . 9 1 1 A 122 122 ASN H H 122 8.762 7.807 0.955 1
1 1461 . 9 1 1 A 122 122 ASN HA H 122 4.183 5.208 -1.025 1
1 1466 . 9 1 1 A 122 122 ASN C C 122 175.406 173.877 1.529 1
1 1467 . 9 1 1 A 122 122 ASN CA C 122 54.686 51.391 3.295 1
1 1468 . 9 1 1 A 122 122 ASN CB C 122 40.139 40.914 -0.775 1
1 1469 . 9 1 1 A 122 122 ASN N N 122 121.618 117.858 3.760 1
1 1471 . 9 1 1 A 123 123 HIS H H 123 8.929 8.524 0.405 1
1 1472 . 9 1 1 A 123 123 HIS HA H 123 4.005 4.942 -0.937 1
1 1477 . 9 1 1 A 123 123 HIS C C 123 177.325 175.910 1.415 1
1 1478 . 9 1 1 A 123 123 HIS CA C 123 58.768 54.900 3.868 1
1 1479 . 9 1 1 A 123 123 HIS CB C 123 31.172 34.042 -2.870 1
1 1482 . 9 1 1 A 123 123 HIS N N 123 124.165 115.838 8.327 1
1 1483 . 9 1 1 A 124 124 MET H H 124 8.266 8.987 -0.721 1
1 1484 . 9 1 1 A 124 124 MET HA H 124 4.048 4.275 -0.227 1
1 1492 . 9 1 1 A 124 124 MET CA C 124 58.994 57.273 1.721 1
1 1493 . 9 1 1 A 124 124 MET CB C 124 32.777 31.861 0.916 1
1 1496 . 9 1 1 A 124 124 MET N N 124 129.443 119.717 9.726 1
1 1497 . 9 1 1 A 125 125 LEU H H 125 8.094 7.760 0.334 1
1 1498 . 9 1 1 A 125 125 LEU HA H 125 4.455 4.544 -0.089 1
1 1504 . 9 1 1 A 125 125 LEU C C 125 177.860 176.544 1.316 1
1 1505 . 9 1 1 A 125 125 LEU CA C 125 53.517 54.227 -0.710 1
1 1506 . 9 1 1 A 125 125 LEU CB C 125 42.462 41.018 1.444 1
1 1509 . 9 1 1 A 126 126 ALA H H 126 8.089 7.557 0.532 1
1 1510 . 9 1 1 A 126 126 ALA HA H 126 3.966 4.412 -0.446 1
1 1514 . 9 1 1 A 126 126 ALA C C 126 179.135 177.899 1.236 1
1 1515 . 9 1 1 A 126 126 ALA CA C 126 54.170 51.408 2.762 1
1 1516 . 9 1 1 A 126 126 ALA CB C 126 18.687 19.117 -0.430 1
1 1517 . 9 1 1 A 126 126 ALA N N 126 126.095 123.310 2.785 1
1 1518 . 9 1 1 A 127 127 GLY H H 127 9.499 8.540 0.959 1
1 1519 . 9 1 1 A 127 127 GLY HA2 H 127 4.207 3.979 0.228 1
1 1520 . 9 1 1 A 127 127 GLY HA3 H 127 3.598 3.989 -0.391 1
1 1521 . 9 1 1 A 127 127 GLY C C 127 173.568 174.139 -0.571 1
1 1522 . 9 1 1 A 127 127 GLY CA C 127 45.846 45.622 0.224 1
1 1523 . 9 1 1 A 127 127 GLY N N 127 110.073 107.237 2.836 1
1 1524 . 9 1 1 A 128 128 GLN H H 128 7.514 7.828 -0.314 1
1 1525 . 9 1 1 A 128 128 GLN HA H 128 4.496 4.394 0.102 1
1 1532 . 9 1 1 A 128 128 GLN C C 128 174.790 175.912 -1.122 1
1 1533 . 9 1 1 A 128 128 GLN CA C 128 54.948 55.790 -0.842 1
1 1534 . 9 1 1 A 128 128 GLN CB C 128 29.181 29.474 -0.293 1
1 1536 . 9 1 1 A 128 128 GLN N N 128 117.842 119.642 -1.800 1
1 1538 . 9 1 1 A 129 129 ASN H H 129 8.689 8.558 0.131 1
1 1539 . 9 1 1 A 129 129 ASN HA H 129 4.857 4.855 0.002 1
1 1544 . 9 1 1 A 129 129 ASN C C 129 174.325 175.154 -0.829 1
1 1545 . 9 1 1 A 129 129 ASN CA C 129 52.568 53.096 -0.528 1
1 1546 . 9 1 1 A 129 129 ASN CB C 129 38.035 38.943 -0.908 1
1 1547 . 9 1 1 A 129 129 ASN N N 129 122.739 122.550 0.189 1
1 1549 . 9 1 1 A 130 130 LEU H H 130 8.742 8.666 0.076 1
1 1550 . 9 1 1 A 130 130 LEU HA H 130 4.918 4.922 -0.004 1
1 1560 . 9 1 1 A 130 130 LEU C C 130 176.095 175.510 0.585 1
1 1561 . 9 1 1 A 130 130 LEU CA C 130 53.691 53.422 0.269 1
1 1562 . 9 1 1 A 130 130 LEU CB C 130 46.814 45.540 1.274 1
1 1566 . 9 1 1 A 130 130 LEU N N 130 121.242 122.216 -0.974 1
1 1567 . 9 1 1 A 131 131 LYS H H 131 8.809 8.782 0.027 1
1 1568 . 9 1 1 A 131 131 LYS HA H 131 4.918 5.040 -0.122 1
1 1577 . 9 1 1 A 131 131 LYS C C 131 175.508 175.226 0.282 1
1 1578 . 9 1 1 A 131 131 LYS CA C 131 55.333 54.584 0.749 1
1 1579 . 9 1 1 A 131 131 LYS CB C 131 33.962 34.979 -1.017 1
1 1583 . 9 1 1 A 131 131 LYS N N 131 122.071 120.403 1.668 1
1 1584 . 9 1 1 A 132 132 PHE H H 132 9.436 9.659 -0.223 1
1 1585 . 9 1 1 A 132 132 PHE HA H 132 5.427 5.750 -0.323 1
1 1593 . 9 1 1 A 132 132 PHE C C 132 175.715 174.589 1.126 1
1 1594 . 9 1 1 A 132 132 PHE CA C 132 56.665 56.517 0.148 1
1 1595 . 9 1 1 A 132 132 PHE CB C 132 42.263 42.572 -0.309 1
1 1599 . 9 1 1 A 132 132 PHE N N 132 125.247 122.122 3.125 1
1 1600 . 9 1 1 A 133 133 ASN H H 133 8.680 8.742 -0.062 1
1 1601 . 9 1 1 A 133 133 ASN HA H 133 5.249 5.137 0.112 1
1 1606 . 9 1 1 A 133 133 ASN C C 133 174.433 174.162 0.271 1
1 1607 . 9 1 1 A 133 133 ASN CA C 133 53.952 52.686 1.266 1
1 1608 . 9 1 1 A 133 133 ASN CB C 133 41.492 39.466 2.026 1
1 1609 . 9 1 1 A 133 133 ASN N N 133 122.056 121.312 0.744 1
1 1611 . 9 1 1 A 134 134 VAL H H 134 8.762 8.546 0.216 1
1 1612 . 9 1 1 A 134 134 VAL HA H 134 4.805 4.659 0.146 1
1 1620 . 9 1 1 A 134 134 VAL C C 134 173.555 175.240 -1.685 1
1 1621 . 9 1 1 A 134 134 VAL CA C 134 60.374 61.107 -0.733 1
1 1622 . 9 1 1 A 134 134 VAL CB C 134 34.848 33.091 1.757 1
1 1625 . 9 1 1 A 134 134 VAL N N 134 122.014 126.034 -4.020 1
1 1626 . 9 1 1 A 135 135 GLU H H 135 8.869 8.768 0.101 1
1 1627 . 9 1 1 A 135 135 GLU HA H 135 5.240 5.007 0.233 1
1 1632 . 9 1 1 A 135 135 GLU C C 135 175.578 175.041 0.537 1
1 1633 . 9 1 1 A 135 135 GLU CA C 135 54.376 55.119 -0.743 1
1 1634 . 9 1 1 A 135 135 GLU CB C 135 33.264 31.285 1.979 1
1 1636 . 9 1 1 A 135 135 GLU N N 135 125.197 126.726 -1.529 1
1 1637 . 9 1 1 A 136 136 VAL H H 136 8.270 8.725 -0.455 1
1 1638 . 9 1 1 A 136 136 VAL HA H 136 4.066 4.388 -0.322 1
1 1646 . 9 1 1 A 136 136 VAL C C 136 176.119 176.494 -0.375 1
1 1647 . 9 1 1 A 136 136 VAL CA C 136 62.910 62.478 0.432 1
1 1648 . 9 1 1 A 136 136 VAL CB C 136 30.573 31.810 -1.237 1
1 1651 . 9 1 1 A 136 136 VAL N N 136 126.347 127.200 -0.853 1
1 1652 . 9 1 1 A 137 137 VAL H H 137 8.865 8.654 0.211 1
1 1653 . 9 1 1 A 137 137 VAL HA H 137 4.022 4.114 -0.092 1
1 1661 . 9 1 1 A 137 137 VAL C C 137 175.208 176.080 -0.872 1
1 1662 . 9 1 1 A 137 137 VAL CA C 137 64.424 63.323 1.101 1
1 1663 . 9 1 1 A 137 137 VAL CB C 137 32.943 32.077 0.866 1
1 1666 . 9 1 1 A 137 137 VAL N N 137 130.810 125.222 5.588 1
1 1667 . 9 1 1 A 138 138 ALA H H 138 7.677 7.168 0.509 1
1 1668 . 9 1 1 A 138 138 ALA HA H 138 4.496 4.721 -0.225 1
1 1672 . 9 1 1 A 138 138 ALA C C 138 174.405 175.206 -0.801 1
1 1673 . 9 1 1 A 138 138 ALA CA C 138 52.556 51.689 0.867 1
1 1674 . 9 1 1 A 138 138 ALA CB C 138 21.874 22.541 -0.667 1
1 1675 . 9 1 1 A 138 138 ALA N N 138 119.194 120.698 -1.504 1
1 1676 . 9 1 1 A 139 139 ILE H H 139 8.052 8.476 -0.424 1
1 1677 . 9 1 1 A 139 139 ILE HA H 139 4.640 4.861 -0.221 1
1 1687 . 9 1 1 A 139 139 ILE C C 139 173.734 174.401 -0.667 1
1 1688 . 9 1 1 A 139 139 ILE CA C 139 61.623 60.005 1.618 1
1 1689 . 9 1 1 A 139 139 ILE CB C 139 43.363 41.204 2.159 1
1 1693 . 9 1 1 A 139 139 ILE N N 139 119.307 120.270 -0.963 1
1 1694 . 9 1 1 A 140 140 ARG H H 140 8.912 8.822 0.090 1
1 1695 . 9 1 1 A 140 140 ARG HA H 140 4.760 4.857 -0.097 1
1 1702 . 9 1 1 A 140 140 ARG C C 140 174.181 174.755 -0.574 1
1 1703 . 9 1 1 A 140 140 ARG CA C 140 54.243 54.480 -0.237 1
1 1704 . 9 1 1 A 140 140 ARG CB C 140 33.438 34.170 -0.732 1
1 1707 . 9 1 1 A 140 140 ARG N N 140 122.820 127.576 -4.756 1
1 1708 . 9 1 1 A 141 141 GLU H H 141 8.545 8.509 0.036 1
1 1709 . 9 1 1 A 141 141 GLU HA H 141 4.254 4.556 -0.302 1
1 1714 . 9 1 1 A 141 141 GLU C C 141 177.299 176.049 1.250 1
1 1715 . 9 1 1 A 141 141 GLU CA C 141 57.165 56.027 1.138 1
1 1716 . 9 1 1 A 141 141 GLU CB C 141 30.048 30.261 -0.213 1
1 1718 . 9 1 1 A 141 141 GLU N N 141 119.458 123.656 -4.198 1
1 1719 . 9 1 1 A 142 142 ALA H H 142 8.380 8.400 -0.020 1
1 1720 . 9 1 1 A 142 142 ALA HA H 142 4.388 4.386 0.002 1
1 1724 . 9 1 1 A 142 142 ALA C C 142 178.495 179.181 -0.686 1
1 1725 . 9 1 1 A 142 142 ALA CA C 142 51.113 52.220 -1.107 1
1 1726 . 9 1 1 A 142 142 ALA CB C 142 21.044 19.770 1.274 1
1 1727 . 9 1 1 A 142 142 ALA N N 142 127.330 127.267 0.063 1
1 1728 . 9 1 1 A 143 143 THR H H 143 9.502 9.110 0.392 1
1 1729 . 9 1 1 A 143 143 THR HA H 143 4.362 4.605 -0.243 1
1 1734 . 9 1 1 A 143 143 THR C C 143 175.241 175.504 -0.263 1
1 1735 . 9 1 1 A 143 143 THR CA C 143 60.541 61.678 -1.137 1
1 1736 . 9 1 1 A 143 143 THR CB C 143 70.879 68.763 2.116 1
1 1738 . 9 1 1 A 143 143 THR N N 143 114.561 112.328 2.233 1
1 1739 . 9 1 1 A 144 144 GLU H H 144 8.787 8.021 0.766 1
1 1740 . 9 1 1 A 144 144 GLU HA H 144 3.817 3.865 -0.048 1
1 1745 . 9 1 1 A 144 144 GLU C C 144 179.490 176.591 2.899 1
1 1746 . 9 1 1 A 144 144 GLU CA C 144 60.102 58.888 1.214 1
1 1747 . 9 1 1 A 144 144 GLU CB C 144 29.338 27.403 1.935 1
1 1749 . 9 1 1 A 144 144 GLU N N 144 120.475 115.351 5.124 1
1 1750 . 9 1 1 A 145 145 GLU H H 145 8.321 8.579 -0.258 1
1 1751 . 9 1 1 A 145 145 GLU HA H 145 3.899 3.865 0.034 1
1 1756 . 9 1 1 A 145 145 GLU C C 145 178.521 179.304 -0.783 1
1 1757 . 9 1 1 A 145 145 GLU CA C 145 59.588 59.180 0.408 1
1 1758 . 9 1 1 A 145 145 GLU CB C 145 29.658 29.308 0.350 1
1 1760 . 9 1 1 A 145 145 GLU N N 145 119.761 119.334 0.427 1
1 1761 . 9 1 1 A 146 146 GLU H H 146 7.514 7.702 -0.188 1
1 1762 . 9 1 1 A 146 146 GLU HA H 146 3.856 4.083 -0.227 1
1 1767 . 9 1 1 A 146 146 GLU C C 146 179.189 179.334 -0.145 1
1 1768 . 9 1 1 A 146 146 GLU CA C 146 59.148 59.193 -0.045 1
1 1769 . 9 1 1 A 146 146 GLU CB C 146 29.834 28.985 0.849 1
1 1771 . 9 1 1 A 146 146 GLU N N 146 121.118 120.593 0.525 1
1 1772 . 9 1 1 A 147 147 LEU H H 147 7.823 8.188 -0.365 1
1 1773 . 9 1 1 A 147 147 LEU HA H 147 3.662 4.141 -0.479 1
1 1783 . 9 1 1 A 147 147 LEU C C 147 179.341 178.798 0.543 1
1 1784 . 9 1 1 A 147 147 LEU CA C 147 57.277 57.800 -0.523 1
1 1785 . 9 1 1 A 147 147 LEU CB C 147 41.239 41.745 -0.506 1
1 1789 . 9 1 1 A 147 147 LEU N N 147 117.199 120.694 -3.495 1
1 1790 . 9 1 1 A 148 148 ALA H H 148 7.788 8.622 -0.834 1
1 1791 . 9 1 1 A 148 148 ALA HA H 148 3.958 4.113 -0.155 1
1 1795 . 9 1 1 A 148 148 ALA C C 148 179.777 179.269 0.508 1
1 1796 . 9 1 1 A 148 148 ALA CA C 148 54.509 54.815 -0.306 1
1 1797 . 9 1 1 A 148 148 ALA CB C 148 18.064 18.291 -0.227 1
1 1798 . 9 1 1 A 148 148 ALA N N 148 121.696 120.755 0.941 1
1 1799 . 9 1 1 A 149 149 HIS H H 149 7.726 7.413 0.313 1
1 1800 . 9 1 1 A 149 149 HIS HA H 149 4.477 4.591 -0.114 1
1 1805 . 9 1 1 A 149 149 HIS C C 149 176.099 175.307 0.792 1
1 1806 . 9 1 1 A 149 149 HIS CA C 149 55.802 56.032 -0.230 1
1 1807 . 9 1 1 A 149 149 HIS CB C 149 30.406 30.037 0.369 1
1 1810 . 9 1 1 A 149 149 HIS N N 149 114.463 113.181 1.282 1
1 1811 . 9 1 1 A 150 150 GLY H H 150 8.076 9.259 -1.183 1
1 1812 . 9 1 1 A 150 150 GLY HA2 H 150 3.927 3.606 0.321 1
1 1813 . 9 1 1 A 150 150 GLY HA3 H 150 3.237 3.617 -0.380 1
1 1814 . 9 1 1 A 150 150 GLY C C 150 173.382 173.267 0.115 1
1 1815 . 9 1 1 A 150 150 GLY CA C 150 46.117 45.476 0.641 1
1 1816 . 9 1 1 A 150 150 GLY N N 150 109.417 108.636 0.781 1
1 1817 . 9 1 1 A 151 151 HIS H H 151 7.518 7.360 0.158 1
1 1818 . 9 1 1 A 151 151 HIS HA H 151 4.563 4.745 -0.182 1
1 1823 . 9 1 1 A 151 151 HIS C C 151 173.157 174.510 -1.353 1
1 1824 . 9 1 1 A 151 151 HIS CA C 151 54.731 54.746 -0.015 1
1 1825 . 9 1 1 A 151 151 HIS CB C 151 31.611 31.154 0.457 1
1 1828 . 9 1 1 A 151 151 HIS N N 151 114.828 114.085 0.743 1
1 1829 . 9 1 1 A 152 152 VAL H H 152 7.931 9.187 -1.256 1
1 1830 . 9 1 1 A 152 152 VAL HA H 152 3.951 3.622 0.329 1
1 1838 . 9 1 1 A 152 152 VAL C C 152 175.848 176.245 -0.397 1
1 1839 . 9 1 1 A 152 152 VAL CA C 152 62.190 66.628 -4.438 1
1 1840 . 9 1 1 A 152 152 VAL CB C 152 32.703 31.854 0.849 1
1 1843 . 9 1 1 A 152 152 VAL N N 152 118.551 120.470 -1.919 1
1 1844 . 9 1 1 A 153 153 HIS H H 153 9.784 8.125 1.659 1
1 1845 . 9 1 1 A 153 153 HIS HA H 153 4.604 4.136 0.468 1
1 1850 . 9 1 1 A 153 153 HIS C C 153 175.795 174.203 1.592 1
1 1851 . 9 1 1 A 153 153 HIS CA C 153 56.753 56.753 0.000 1
1 1852 . 9 1 1 A 153 153 HIS CB C 153 30.325 28.466 1.859 1
1 1855 . 9 1 1 A 153 153 HIS N N 153 127.403 119.341 8.062 1
1 1856 . 9 1 1 A 154 154 GLY H H 154 8.447 7.894 0.553 1
1 1857 . 9 1 1 A 154 154 GLY HA2 H 154 3.797 3.996 -0.199 1
1 1858 . 9 1 1 A 154 154 GLY HA3 H 154 3.797 4.067 -0.270 1
1 1859 . 9 1 1 A 154 154 GLY C C 154 173.848 173.642 0.206 1
1 1860 . 9 1 1 A 154 154 GLY CA C 154 45.153 46.032 -0.879 1
1 1861 . 9 1 1 A 154 154 GLY N N 154 112.233 106.186 6.047 1
1 1862 . 9 1 1 A 155 155 ALA H H 155 8.074 8.492 -0.418 1
1 1863 . 9 1 1 A 155 155 ALA HA H 155 4.101 3.906 0.195 1
1 1867 . 9 1 1 A 155 155 ALA C C 155 177.651 175.904 1.747 1
1 1868 . 9 1 1 A 155 155 ALA CA C 155 52.795 52.873 -0.078 1
1 1869 . 9 1 1 A 155 155 ALA CB C 155 19.258 17.411 1.847 1
1 1870 . 9 1 1 A 155 155 ALA N N 155 124.092 124.505 -0.413 1
1 1871 . 9 1 1 A 156 156 HIS H H 156 8.201 7.883 0.318 1
1 1872 . 9 1 1 A 156 156 HIS HA H 156 4.474 4.863 -0.389 1
1 1875 . 9 1 1 A 156 156 HIS C C 156 174.758 172.216 2.542 1
1 1876 . 9 1 1 A 156 156 HIS CA C 156 55.756 55.422 0.334 1
1 1877 . 9 1 1 A 156 156 HIS CB C 156 30.060 31.157 -1.097 1
1 1878 . 9 1 1 A 156 156 HIS N N 156 118.170 115.975 2.195 1
1 1879 . 9 1 1 A 157 157 ASP H H 157 8.001 9.004 -1.003 1
1 1880 . 9 1 1 A 157 157 ASP HA H 157 4.436 5.372 -0.936 1
1 1883 . 9 1 1 A 157 157 ASP CA C 157 54.185 52.955 1.230 1
1 1884 . 9 1 1 A 157 157 ASP CB C 157 41.016 44.192 -3.176 1
1 1885 . 9 1 1 A 157 157 ASP N N 157 121.683 128.317 -6.634 1
1 1886 . 9 1 1 A 160 160 HIS HA H 160 4.502 4.697 -0.195 1
1 1889 . 9 1 1 A 160 160 HIS C C 160 174.722 173.217 1.505 1
1 1890 . 9 1 1 A 160 160 HIS CA C 160 55.979 53.895 2.084 1
1 1891 . 9 1 1 A 160 160 HIS CB C 160 30.058 29.714 0.344 1
1 1892 . 9 1 1 A 161 161 ASP H H 161 8.270 8.491 -0.221 1
1 1893 . 9 1 1 A 161 161 ASP HA H 161 4.446 5.129 -0.683 1
1 1896 . 9 1 1 A 161 161 ASP C C 161 176.107 174.105 2.002 1
1 1897 . 9 1 1 A 161 161 ASP CA C 161 54.474 53.091 1.383 1
1 1898 . 9 1 1 A 161 161 ASP CB C 161 40.820 44.680 -3.860 1
1 1899 . 9 1 1 A 161 161 ASP N N 161 121.957 126.053 -4.096 1
1 1900 . 9 1 1 A 162 162 HIS H H 162 8.212 8.620 -0.408 1
1 1901 . 9 1 1 A 162 162 HIS HA H 162 4.289 4.768 -0.479 1
1 1904 . 9 1 1 A 162 162 HIS C C 162 175.036 172.820 2.216 1
1 1905 . 9 1 1 A 162 162 HIS CA C 162 56.185 55.437 0.748 1
1 1906 . 9 1 1 A 162 162 HIS CB C 162 30.108 30.124 -0.016 1
1 1907 . 9 1 1 A 162 162 HIS N N 162 119.766 124.919 -5.153 1
1 1908 . 9 1 1 A 163 163 ASP H H 163 8.163 8.353 -0.190 1
1 1909 . 9 1 1 A 163 163 ASP HA H 163 4.428 4.769 -0.341 1
1 1912 . 9 1 1 A 163 163 ASP C C 163 176.161 175.466 0.695 1
1 1913 . 9 1 1 A 163 163 ASP CA C 163 54.585 53.926 0.659 1
1 1914 . 9 1 1 A 163 163 ASP CB C 163 40.823 41.909 -1.086 1
1 1915 . 9 1 1 A 163 163 ASP N N 163 121.265 127.389 -6.124 1
1 1916 . 9 1 1 A 164 164 HIS H H 164 8.106 8.859 -0.753 1
1 1917 . 9 1 1 A 164 164 HIS HA H 164 4.422 5.368 -0.946 1
1 1920 . 9 1 1 A 164 164 HIS C C 164 174.904 174.372 0.532 1
1 1921 . 9 1 1 A 164 164 HIS CA C 164 56.361 53.413 2.948 1
1 1922 . 9 1 1 A 164 164 HIS CB C 164 30.305 32.594 -2.289 1
1 1923 . 9 1 1 A 164 164 HIS N N 164 119.729 117.892 1.837 1
1 1924 . 9 1 1 A 165 165 ASP H H 165 8.118 8.341 -0.223 1
1 1925 . 9 1 1 A 165 165 ASP HA H 165 4.394 4.436 -0.042 1
1 1928 . 9 1 1 A 165 165 ASP C C 165 176.054 176.210 -0.156 1
1 1929 . 9 1 1 A 165 165 ASP CA C 165 54.364 55.723 -1.359 1
1 1930 . 9 1 1 A 165 165 ASP CB C 165 40.818 41.963 -1.145 1
1 1931 . 9 1 1 A 165 165 ASP N N 165 121.062 121.176 -0.114 1
1 1932 . 9 1 1 A 166 166 HIS H H 166 8.092 7.712 0.380 1
1 1933 . 9 1 1 A 166 166 HIS CA C 166 56.114 54.553 1.561 1
1 1934 . 9 1 1 A 166 166 HIS CB C 166 29.702 29.945 -0.243 1
1 1935 . 9 1 1 A 166 166 HIS N N 166 120.001 115.952 4.049 1
1 1936 . 9 1 1 A 170 170 HIS HA H 170 4.514 4.127 0.387 1
1 1939 . 9 1 1 A 170 170 HIS C C 170 173.952 175.246 -1.294 1
1 1940 . 9 1 1 A 170 170 HIS CA C 170 55.995 56.701 -0.706 1
1 1941 . 9 1 1 A 170 170 HIS CB C 170 30.161 28.012 2.149 1
1 14 . 10 1 1 A 2 2 LYS H H 2 7.540 8.899 -1.359 1
1 15 . 10 1 1 A 2 2 LYS HA H 2 4.729 5.120 -0.391 1
1 24 . 10 1 1 A 2 2 LYS C C 2 175.948 174.804 1.144 1
1 25 . 10 1 1 A 2 2 LYS CA C 2 53.978 53.858 0.120 1
1 26 . 10 1 1 A 2 2 LYS CB C 2 35.985 36.016 -0.031 1
1 30 . 10 1 1 A 2 2 LYS N N 2 120.764 119.118 1.646 1
1 31 . 10 1 1 A 3 3 VAL H H 3 8.738 8.221 0.517 1
1 32 . 10 1 1 A 3 3 VAL HA H 3 2.800 4.429 -1.629 1
1 40 . 10 1 1 A 3 3 VAL C C 3 175.018 174.859 0.159 1
1 41 . 10 1 1 A 3 3 VAL CA C 3 66.598 61.395 5.203 1
1 42 . 10 1 1 A 3 3 VAL CB C 3 31.218 32.237 -1.019 1
1 45 . 10 1 1 A 3 3 VAL N N 3 120.055 121.060 -1.005 1
1 46 . 10 1 1 A 4 4 ALA H H 4 6.584 8.663 -2.079 1
1 47 . 10 1 1 A 4 4 ALA HA H 4 4.223 4.459 -0.236 1
1 51 . 10 1 1 A 4 4 ALA C C 4 174.117 175.392 -1.275 1
1 52 . 10 1 1 A 4 4 ALA CA C 4 50.358 50.821 -0.463 1
1 53 . 10 1 1 A 4 4 ALA CB C 4 22.137 22.294 -0.157 1
1 54 . 10 1 1 A 4 4 ALA N N 4 129.800 129.882 -0.082 1
1 55 . 10 1 1 A 5 5 LYS H H 5 8.596 8.444 0.152 1
1 56 . 10 1 1 A 5 5 LYS HA H 5 3.793 4.111 -0.318 1
1 65 . 10 1 1 A 5 5 LYS C C 5 175.260 177.085 -1.825 1
1 66 . 10 1 1 A 5 5 LYS CA C 5 57.700 57.329 0.371 1
1 67 . 10 1 1 A 5 5 LYS CB C 5 32.400 32.750 -0.350 1
1 71 . 10 1 1 A 5 5 LYS N N 5 118.708 119.658 -0.950 1
1 72 . 10 1 1 A 6 6 ASP H H 6 8.679 9.255 -0.576 1
1 73 . 10 1 1 A 6 6 ASP HA H 6 4.040 4.492 -0.452 1
1 76 . 10 1 1 A 6 6 ASP C C 6 173.331 175.238 -1.907 1
1 77 . 10 1 1 A 6 6 ASP CA C 6 57.508 55.308 2.200 1
1 78 . 10 1 1 A 6 6 ASP CB C 6 37.604 38.803 -1.199 1
1 79 . 10 1 1 A 6 6 ASP N N 6 115.415 126.091 -10.676 1
1 80 . 10 1 1 A 7 7 LEU H H 7 7.376 7.632 -0.256 1
1 81 . 10 1 1 A 7 7 LEU HA H 7 4.689 4.304 0.385 1
1 91 . 10 1 1 A 7 7 LEU C C 7 175.906 175.776 0.130 1
1 92 . 10 1 1 A 7 7 LEU CA C 7 53.509 53.753 -0.244 1
1 93 . 10 1 1 A 7 7 LEU CB C 7 42.419 41.161 1.258 1
1 97 . 10 1 1 A 7 7 LEU N N 7 117.619 122.152 -4.533 1
1 98 . 10 1 1 A 8 8 VAL H H 8 8.646 8.574 0.072 1
1 99 . 10 1 1 A 8 8 VAL HA H 8 4.397 4.049 0.348 1
1 107 . 10 1 1 A 8 8 VAL C C 8 175.244 174.972 0.272 1
1 108 . 10 1 1 A 8 8 VAL CA C 8 62.028 62.891 -0.863 1
1 109 . 10 1 1 A 8 8 VAL CB C 8 31.515 32.175 -0.660 1
1 112 . 10 1 1 A 8 8 VAL N N 8 121.164 126.963 -5.799 1
1 113 . 10 1 1 A 9 9 VAL H H 9 8.607 8.181 0.426 1
1 114 . 10 1 1 A 9 9 VAL HA H 9 4.281 4.816 -0.535 1
1 122 . 10 1 1 A 9 9 VAL C C 9 174.156 173.788 0.368 1
1 123 . 10 1 1 A 9 9 VAL CA C 9 60.614 58.996 1.618 1
1 124 . 10 1 1 A 9 9 VAL CB C 9 33.985 35.959 -1.974 1
1 127 . 10 1 1 A 9 9 VAL N N 9 134.014 122.210 11.804 1
1 128 . 10 1 1 A 10 10 SER H H 10 8.684 8.584 0.100 1
1 129 . 10 1 1 A 10 10 SER HA H 10 5.736 5.279 0.457 1
1 132 . 10 1 1 A 10 10 SER C C 10 173.544 173.288 0.256 1
1 133 . 10 1 1 A 10 10 SER CA C 10 56.533 57.932 -1.399 1
1 134 . 10 1 1 A 10 10 SER CB C 10 63.385 64.003 -0.618 1
1 135 . 10 1 1 A 10 10 SER N N 10 121.492 119.565 1.927 1
1 136 . 10 1 1 A 11 11 LEU H H 11 9.939 9.383 0.556 1
1 137 . 10 1 1 A 11 11 LEU HA H 11 5.133 5.234 -0.101 1
1 147 . 10 1 1 A 11 11 LEU C C 11 174.843 174.284 0.559 1
1 148 . 10 1 1 A 11 11 LEU CA C 11 53.770 53.639 0.131 1
1 149 . 10 1 1 A 11 11 LEU CB C 11 47.469 46.969 0.500 1
1 153 . 10 1 1 A 11 11 LEU N N 11 128.460 128.193 0.267 1
1 154 . 10 1 1 A 12 12 ALA H H 12 8.770 9.443 -0.673 1
1 155 . 10 1 1 A 12 12 ALA HA H 12 4.830 5.649 -0.819 1
1 159 . 10 1 1 A 12 12 ALA C C 12 176.974 175.760 1.214 1
1 160 . 10 1 1 A 12 12 ALA CA C 12 50.231 50.083 0.148 1
1 161 . 10 1 1 A 12 12 ALA CB C 12 21.270 22.753 -1.483 1
1 162 . 10 1 1 A 12 12 ALA N N 12 127.500 127.516 -0.016 1
1 163 . 10 1 1 A 13 13 TYR H H 13 8.749 8.939 -0.190 1
1 164 . 10 1 1 A 13 13 TYR HA H 13 5.797 5.712 0.085 1
1 171 . 10 1 1 A 13 13 TYR C C 13 173.952 172.320 1.632 1
1 172 . 10 1 1 A 13 13 TYR CA C 13 56.390 56.158 0.232 1
1 173 . 10 1 1 A 13 13 TYR CB C 13 41.159 40.857 0.302 1
1 176 . 10 1 1 A 13 13 TYR N N 13 117.737 116.477 1.260 1
1 177 . 10 1 1 A 14 14 GLN H H 14 8.492 8.766 -0.274 1
1 178 . 10 1 1 A 14 14 GLN HA H 14 4.611 5.082 -0.471 1
1 185 . 10 1 1 A 14 14 GLN C C 14 174.492 174.311 0.181 1
1 186 . 10 1 1 A 14 14 GLN CA C 14 55.626 54.411 1.215 1
1 187 . 10 1 1 A 14 14 GLN CB C 14 32.734 32.126 0.608 1
1 189 . 10 1 1 A 14 14 GLN N N 14 116.962 120.275 -3.313 1
1 191 . 10 1 1 A 15 15 VAL H H 15 8.403 9.820 -1.417 1
1 192 . 10 1 1 A 15 15 VAL HA H 15 4.614 5.035 -0.421 1
1 200 . 10 1 1 A 15 15 VAL C C 15 173.389 175.007 -1.618 1
1 201 . 10 1 1 A 15 15 VAL CA C 15 59.711 61.861 -2.150 1
1 202 . 10 1 1 A 15 15 VAL CB C 15 33.639 32.709 0.930 1
1 205 . 10 1 1 A 15 15 VAL N N 15 121.203 127.460 -6.257 1
1 206 . 10 1 1 A 16 16 ARG H H 16 8.584 9.266 -0.682 1
1 207 . 10 1 1 A 16 16 ARG HA H 16 5.584 5.107 0.477 1
1 214 . 10 1 1 A 16 16 ARG C C 16 176.585 174.986 1.599 1
1 215 . 10 1 1 A 16 16 ARG CA C 16 53.453 54.312 -0.859 1
1 216 . 10 1 1 A 16 16 ARG CB C 16 34.968 33.665 1.303 1
1 219 . 10 1 1 A 16 16 ARG N N 16 126.883 124.807 2.076 1
1 220 . 10 1 1 A 17 17 THR H H 17 8.270 8.368 -0.098 1
1 221 . 10 1 1 A 17 17 THR HA H 17 4.573 4.567 0.006 1
1 226 . 10 1 1 A 17 17 THR C C 17 177.860 176.127 1.733 1
1 227 . 10 1 1 A 17 17 THR CA C 17 61.073 60.972 0.101 1
1 228 . 10 1 1 A 17 17 THR CB C 17 69.823 71.241 -1.418 1
1 230 . 10 1 1 A 17 17 THR N N 17 109.730 112.955 -3.225 1
1 231 . 10 1 1 A 18 18 GLU H H 18 9.147 8.951 0.196 1
1 232 . 10 1 1 A 18 18 GLU HA H 18 3.770 3.946 -0.176 1
1 237 . 10 1 1 A 18 18 GLU C C 18 176.683 178.024 -1.341 1
1 238 . 10 1 1 A 18 18 GLU CA C 18 59.866 59.844 0.022 1
1 239 . 10 1 1 A 18 18 GLU CB C 18 29.752 29.195 0.557 1
1 241 . 10 1 1 A 18 18 GLU N N 18 122.491 121.427 1.064 1
1 242 . 10 1 1 A 19 19 ASP H H 19 7.900 8.043 -0.143 1
1 243 . 10 1 1 A 19 19 ASP HA H 19 4.456 4.553 -0.097 1
1 246 . 10 1 1 A 19 19 ASP C C 19 176.670 176.651 0.019 1
1 247 . 10 1 1 A 19 19 ASP CA C 19 53.833 54.188 -0.355 1
1 248 . 10 1 1 A 19 19 ASP CB C 19 40.180 41.081 -0.901 1
1 249 . 10 1 1 A 19 19 ASP N N 19 116.200 117.479 -1.279 1
1 250 . 10 1 1 A 20 20 GLY H H 20 8.149 8.209 -0.060 1
1 251 . 10 1 1 A 20 20 GLY HA2 H 20 4.145 3.956 0.189 1
1 252 . 10 1 1 A 20 20 GLY HA3 H 20 3.531 3.960 -0.429 1
1 253 . 10 1 1 A 20 20 GLY C C 20 173.987 174.210 -0.223 1
1 254 . 10 1 1 A 20 20 GLY CA C 20 45.463 45.350 0.113 1
1 255 . 10 1 1 A 20 20 GLY N N 20 108.869 106.940 1.929 1
1 256 . 10 1 1 A 21 21 VAL H H 21 7.261 7.871 -0.610 1
1 257 . 10 1 1 A 21 21 VAL HA H 21 3.645 4.188 -0.543 1
1 265 . 10 1 1 A 21 21 VAL C C 21 175.265 174.857 0.408 1
1 266 . 10 1 1 A 21 21 VAL CA C 21 63.368 61.966 1.402 1
1 267 . 10 1 1 A 21 21 VAL CB C 21 31.614 32.486 -0.872 1
1 270 . 10 1 1 A 21 21 VAL N N 21 124.283 122.454 1.829 1
1 271 . 10 1 1 A 22 22 LEU H H 22 8.407 8.380 0.027 1
1 272 . 10 1 1 A 22 22 LEU HA H 22 4.333 4.341 -0.008 1
1 282 . 10 1 1 A 22 22 LEU C C 22 176.660 176.698 -0.038 1
1 283 . 10 1 1 A 22 22 LEU CA C 22 55.724 55.930 -0.206 1
1 284 . 10 1 1 A 22 22 LEU CB C 22 42.272 42.376 -0.104 1
1 288 . 10 1 1 A 22 22 LEU N N 22 128.533 128.741 -0.208 1
1 289 . 10 1 1 A 23 23 VAL H H 23 8.887 9.177 -0.290 1
1 290 . 10 1 1 A 23 23 VAL HA H 23 4.237 4.403 -0.166 1
1 298 . 10 1 1 A 23 23 VAL C C 23 175.265 175.515 -0.250 1
1 299 . 10 1 1 A 23 23 VAL CA C 23 62.348 62.138 0.210 1
1 300 . 10 1 1 A 23 23 VAL CB C 23 33.383 33.427 -0.044 1
1 303 . 10 1 1 A 23 23 VAL N N 23 125.041 121.346 3.695 1
1 304 . 10 1 1 A 24 24 ASP H H 24 7.480 7.702 -0.222 1
1 305 . 10 1 1 A 24 24 ASP HA H 24 4.763 5.016 -0.253 1
1 308 . 10 1 1 A 24 24 ASP C C 24 173.160 173.885 -0.725 1
1 309 . 10 1 1 A 24 24 ASP CA C 24 53.893 53.456 0.437 1
1 310 . 10 1 1 A 24 24 ASP CB C 24 43.680 44.415 -0.735 1
1 311 . 10 1 1 A 24 24 ASP N N 24 117.159 120.534 -3.375 1
1 312 . 10 1 1 A 25 25 GLU H H 25 8.187 8.657 -0.470 1
1 313 . 10 1 1 A 25 25 GLU HA H 25 4.491 4.640 -0.149 1
1 318 . 10 1 1 A 25 25 GLU C C 25 174.586 173.857 0.729 1
1 319 . 10 1 1 A 25 25 GLU CA C 25 55.475 56.090 -0.615 1
1 320 . 10 1 1 A 25 25 GLU CB C 25 33.033 34.291 -1.258 1
1 322 . 10 1 1 A 25 25 GLU N N 25 118.821 123.665 -4.844 1
1 323 . 10 1 1 A 26 26 SER H H 26 8.003 8.168 -0.165 1
1 324 . 10 1 1 A 26 26 SER HA H 26 4.782 4.814 -0.032 1
1 327 . 10 1 1 A 26 26 SER CA C 26 56.490 55.029 1.461 1
1 328 . 10 1 1 A 26 26 SER CB C 26 64.977 64.362 0.615 1
1 329 . 10 1 1 A 26 26 SER N N 26 119.346 122.316 -2.970 1
1 330 . 10 1 1 A 27 27 PRO HA H 27 4.633 4.610 0.023 1
1 337 . 10 1 1 A 27 27 PRO C C 27 177.016 177.034 -0.018 1
1 338 . 10 1 1 A 27 27 PRO CA C 27 61.943 62.605 -0.662 1
1 339 . 10 1 1 A 27 27 PRO CB C 27 32.492 33.248 -0.756 1
1 342 . 10 1 1 A 28 28 VAL H H 28 8.383 8.648 -0.265 1
1 343 . 10 1 1 A 28 28 VAL HA H 28 3.385 3.810 -0.425 1
1 351 . 10 1 1 A 28 28 VAL C C 28 176.069 177.632 -1.563 1
1 352 . 10 1 1 A 28 28 VAL CA C 28 65.888 64.962 0.926 1
1 353 . 10 1 1 A 28 28 VAL CB C 28 31.220 31.549 -0.329 1
1 356 . 10 1 1 A 28 28 VAL N N 28 119.349 121.841 -2.492 1
1 357 . 10 1 1 A 29 29 SER H H 29 7.365 7.833 -0.468 1
1 358 . 10 1 1 A 29 29 SER HA H 29 4.101 4.283 -0.182 1
1 361 . 10 1 1 A 29 29 SER C C 29 174.535 174.869 -0.334 1
1 362 . 10 1 1 A 29 29 SER CA C 29 58.609 60.807 -2.198 1
1 363 . 10 1 1 A 29 29 SER CB C 29 63.198 63.409 -0.211 1
1 364 . 10 1 1 A 29 29 SER N N 29 109.365 114.144 -4.779 1
1 365 . 10 1 1 A 30 30 ALA H H 30 7.457 7.793 -0.336 1
1 366 . 10 1 1 A 30 30 ALA HA H 30 4.548 4.743 -0.195 1
1 370 . 10 1 1 A 30 30 ALA CA C 30 50.789 49.418 1.371 1
1 371 . 10 1 1 A 30 30 ALA CB C 30 18.608 21.246 -2.638 1
1 372 . 10 1 1 A 30 30 ALA N N 30 126.056 122.465 3.591 1
1 373 . 10 1 1 A 31 31 PRO HA H 31 4.332 4.696 -0.364 1
1 380 . 10 1 1 A 31 31 PRO C C 31 175.841 176.146 -0.305 1
1 381 . 10 1 1 A 31 31 PRO CA C 31 62.996 62.584 0.412 1
1 382 . 10 1 1 A 31 31 PRO CB C 31 32.696 32.694 0.002 1
1 385 . 10 1 1 A 32 32 LEU H H 32 8.717 8.990 -0.273 1
1 386 . 10 1 1 A 32 32 LEU HA H 32 4.452 4.734 -0.282 1
1 396 . 10 1 1 A 32 32 LEU C C 32 175.298 174.590 0.708 1
1 397 . 10 1 1 A 32 32 LEU CA C 32 54.510 55.083 -0.573 1
1 398 . 10 1 1 A 32 32 LEU CB C 32 43.899 43.283 0.616 1
1 402 . 10 1 1 A 32 32 LEU N N 32 123.702 122.699 1.003 1
1 403 . 10 1 1 A 33 33 ASP H H 33 8.258 8.889 -0.631 1
1 404 . 10 1 1 A 33 33 ASP HA H 33 5.919 5.588 0.331 1
1 407 . 10 1 1 A 33 33 ASP C C 33 175.927 174.954 0.973 1
1 408 . 10 1 1 A 33 33 ASP CA C 33 52.619 53.011 -0.392 1
1 409 . 10 1 1 A 33 33 ASP CB C 33 42.205 42.850 -0.645 1
1 410 . 10 1 1 A 33 33 ASP N N 33 128.453 126.452 2.001 1
1 411 . 10 1 1 A 34 34 TYR H H 34 9.144 8.375 0.769 1
1 412 . 10 1 1 A 34 34 TYR HA H 34 4.689 5.388 -0.699 1
1 419 . 10 1 1 A 34 34 TYR C C 34 170.622 172.422 -1.800 1
1 420 . 10 1 1 A 34 34 TYR CA C 34 55.930 55.784 0.146 1
1 421 . 10 1 1 A 34 34 TYR CB C 34 41.905 41.828 0.077 1
1 424 . 10 1 1 A 34 34 TYR N N 34 121.657 119.621 2.036 1
1 425 . 10 1 1 A 35 35 LEU H H 35 8.324 8.932 -0.608 1
1 426 . 10 1 1 A 35 35 LEU HA H 35 4.396 4.978 -0.582 1
1 436 . 10 1 1 A 35 35 LEU C C 35 175.301 176.043 -0.742 1
1 437 . 10 1 1 A 35 35 LEU CA C 35 52.909 53.358 -0.449 1
1 438 . 10 1 1 A 35 35 LEU CB C 35 42.816 44.397 -1.581 1
1 442 . 10 1 1 A 35 35 LEU N N 35 124.514 123.554 0.960 1
1 443 . 10 1 1 A 36 36 HIS H H 36 8.763 8.670 0.093 1
1 444 . 10 1 1 A 36 36 HIS HA H 36 4.382 4.773 -0.391 1
1 449 . 10 1 1 A 36 36 HIS C C 36 176.514 176.378 0.136 1
1 450 . 10 1 1 A 36 36 HIS CA C 36 59.570 57.842 1.728 1
1 451 . 10 1 1 A 36 36 HIS CB C 36 31.257 29.619 1.638 1
1 454 . 10 1 1 A 36 36 HIS N N 36 132.209 126.917 5.292 1
1 455 . 10 1 1 A 37 37 GLY H H 37 8.745 9.168 -0.423 1
1 456 . 10 1 1 A 37 37 GLY HA2 H 37 4.021 3.886 0.135 1
1 457 . 10 1 1 A 37 37 GLY HA3 H 37 3.592 3.983 -0.391 1
1 458 . 10 1 1 A 37 37 GLY C C 37 175.081 174.182 0.899 1
1 459 . 10 1 1 A 37 37 GLY CA C 37 45.621 45.282 0.339 1
1 460 . 10 1 1 A 37 37 GLY N N 37 117.737 115.512 2.225 1
1 461 . 10 1 1 A 38 38 HIS H H 38 8.470 8.060 0.410 1
1 462 . 10 1 1 A 38 38 HIS HA H 38 4.584 4.718 -0.134 1
1 467 . 10 1 1 A 38 38 HIS C C 38 175.334 174.563 0.771 1
1 468 . 10 1 1 A 38 38 HIS CA C 38 55.899 56.431 -0.532 1
1 469 . 10 1 1 A 38 38 HIS CB C 38 30.865 31.142 -0.277 1
1 472 . 10 1 1 A 38 38 HIS N N 38 119.813 117.629 2.184 1
1 473 . 10 1 1 A 39 39 GLY H H 39 8.936 7.287 1.649 1
1 474 . 10 1 1 A 39 39 GLY HA2 H 39 3.895 3.950 -0.055 1
1 475 . 10 1 1 A 39 39 GLY HA3 H 39 3.895 4.028 -0.133 1
1 476 . 10 1 1 A 39 39 GLY C C 39 175.557 174.078 1.479 1
1 477 . 10 1 1 A 39 39 GLY CA C 39 46.938 45.474 1.464 1
1 478 . 10 1 1 A 39 39 GLY N N 39 112.442 107.620 4.822 1
1 479 . 10 1 1 A 40 40 SER H H 40 9.249 8.185 1.064 1
1 480 . 10 1 1 A 40 40 SER HA H 40 4.299 4.414 -0.115 1
1 483 . 10 1 1 A 40 40 SER C C 40 174.138 173.644 0.494 1
1 484 . 10 1 1 A 40 40 SER CA C 40 60.809 57.272 3.537 1
1 485 . 10 1 1 A 40 40 SER CB C 40 64.041 62.972 1.069 1
1 486 . 10 1 1 A 40 40 SER N N 40 117.098 119.444 -2.346 1
1 487 . 10 1 1 A 41 41 LEU H H 41 7.386 7.827 -0.441 1
1 488 . 10 1 1 A 41 41 LEU HA H 41 4.429 3.867 0.562 1
1 498 . 10 1 1 A 41 41 LEU C C 41 176.526 176.228 0.298 1
1 499 . 10 1 1 A 41 41 LEU CA C 41 52.295 55.158 -2.863 1
1 500 . 10 1 1 A 41 41 LEU CB C 41 44.147 39.459 4.688 1
1 504 . 10 1 1 A 41 41 LEU N N 41 120.541 119.513 1.028 1
1 505 . 10 1 1 A 42 42 ILE H H 42 7.407 8.464 -1.057 1
1 506 . 10 1 1 A 42 42 ILE HA H 42 3.756 3.893 -0.137 1
1 516 . 10 1 1 A 42 42 ILE C C 42 178.081 176.592 1.489 1
1 517 . 10 1 1 A 42 42 ILE CA C 42 62.257 61.489 0.768 1
1 518 . 10 1 1 A 42 42 ILE CB C 42 38.256 35.453 2.803 1
1 522 . 10 1 1 A 42 42 ILE N N 42 115.050 123.146 -8.096 1
1 523 . 10 1 1 A 43 43 SER H H 43 8.581 8.678 -0.097 1
1 524 . 10 1 1 A 43 43 SER HA H 43 3.957 4.611 -0.654 1
1 527 . 10 1 1 A 43 43 SER C C 43 177.830 176.913 0.917 1
1 528 . 10 1 1 A 43 43 SER CA C 43 61.958 61.652 0.306 1
1 529 . 10 1 1 A 43 43 SER CB C 43 62.680 62.713 -0.033 1
1 530 . 10 1 1 A 43 43 SER N N 43 121.456 120.493 0.963 1
1 531 . 10 1 1 A 44 44 GLY H H 44 8.892 8.457 0.435 1
1 532 . 10 1 1 A 44 44 GLY HA2 H 44 3.514 3.775 -0.261 1
1 533 . 10 1 1 A 44 44 GLY HA3 H 44 3.854 3.777 0.077 1
1 534 . 10 1 1 A 44 44 GLY C C 44 175.296 175.485 -0.189 1
1 535 . 10 1 1 A 44 44 GLY CA C 44 46.854 47.375 -0.521 1
1 536 . 10 1 1 A 44 44 GLY N N 44 106.351 109.070 -2.719 1
1 537 . 10 1 1 A 45 45 LEU H H 45 6.824 7.796 -0.972 1
1 538 . 10 1 1 A 45 45 LEU HA H 45 3.909 4.143 -0.234 1
1 548 . 10 1 1 A 45 45 LEU C C 45 176.738 178.579 -1.841 1
1 549 . 10 1 1 A 45 45 LEU CA C 45 56.356 57.046 -0.690 1
1 550 . 10 1 1 A 45 45 LEU CB C 45 42.296 41.117 1.179 1
1 554 . 10 1 1 A 45 45 LEU N N 45 119.207 122.940 -3.733 1
1 555 . 10 1 1 A 46 46 GLU H H 46 7.556 8.747 -1.191 1
1 556 . 10 1 1 A 46 46 GLU HA H 46 3.664 4.000 -0.336 1
1 561 . 10 1 1 A 46 46 GLU C C 46 179.231 179.392 -0.161 1
1 562 . 10 1 1 A 46 46 GLU CA C 46 62.316 59.772 2.544 1
1 563 . 10 1 1 A 46 46 GLU CB C 46 29.147 29.235 -0.088 1
1 565 . 10 1 1 A 46 46 GLU N N 46 119.049 118.606 0.443 1
1 566 . 10 1 1 A 47 47 THR H H 47 8.219 7.849 0.370 1
1 567 . 10 1 1 A 47 47 THR HA H 47 3.965 3.931 0.034 1
1 572 . 10 1 1 A 47 47 THR C C 47 176.251 176.489 -0.238 1
1 573 . 10 1 1 A 47 47 THR CA C 47 65.947 66.058 -0.111 1
1 574 . 10 1 1 A 47 47 THR CB C 47 69.014 68.287 0.727 1
1 576 . 10 1 1 A 47 47 THR N N 47 111.770 117.297 -5.527 1
1 577 . 10 1 1 A 48 48 ALA H H 48 6.794 7.818 -1.024 1
1 578 . 10 1 1 A 48 48 ALA HA H 48 4.171 4.198 -0.027 1
1 582 . 10 1 1 A 48 48 ALA C C 48 178.639 180.278 -1.639 1
1 583 . 10 1 1 A 48 48 ALA CA C 48 54.072 55.210 -1.138 1
1 584 . 10 1 1 A 48 48 ALA CB C 48 19.752 18.505 1.247 1
1 585 . 10 1 1 A 48 48 ALA N N 48 122.697 123.496 -0.799 1
1 586 . 10 1 1 A 49 49 LEU H H 49 7.691 8.782 -1.091 1
1 587 . 10 1 1 A 49 49 LEU HA H 49 3.902 4.413 -0.511 1
1 597 . 10 1 1 A 49 49 LEU C C 49 176.823 177.514 -0.691 1
1 598 . 10 1 1 A 49 49 LEU CA C 49 57.190 57.903 -0.713 1
1 599 . 10 1 1 A 49 49 LEU CB C 49 43.628 41.349 2.279 1
1 603 . 10 1 1 A 49 49 LEU N N 49 117.159 118.263 -1.104 1
1 604 . 10 1 1 A 50 50 GLU H H 50 6.963 7.708 -0.745 1
1 605 . 10 1 1 A 50 50 GLU HA H 50 3.220 4.064 -0.844 1
1 610 . 10 1 1 A 50 50 GLU C C 50 176.691 177.341 -0.650 1
1 611 . 10 1 1 A 50 50 GLU CA C 50 58.769 58.453 0.316 1
1 612 . 10 1 1 A 50 50 GLU CB C 50 29.792 29.739 0.053 1
1 614 . 10 1 1 A 50 50 GLU N N 50 118.761 119.459 -0.698 1
1 615 . 10 1 1 A 51 51 GLY H H 51 8.541 8.300 0.241 1
1 616 . 10 1 1 A 51 51 GLY HA2 H 51 4.140 3.898 0.242 1
1 617 . 10 1 1 A 51 51 GLY HA3 H 51 3.488 3.914 -0.426 1
1 618 . 10 1 1 A 51 51 GLY C C 51 173.801 173.848 -0.047 1
1 619 . 10 1 1 A 51 51 GLY CA C 51 45.498 45.420 0.078 1
1 620 . 10 1 1 A 51 51 GLY N N 51 113.511 111.772 1.739 1
1 621 . 10 1 1 A 52 52 HIS H H 52 7.656 7.146 0.510 1
1 622 . 10 1 1 A 52 52 HIS HA H 52 4.318 4.875 -0.557 1
1 627 . 10 1 1 A 52 52 HIS C C 52 172.815 173.942 -1.127 1
1 628 . 10 1 1 A 52 52 HIS CA C 52 57.562 54.403 3.159 1
1 629 . 10 1 1 A 52 52 HIS CB C 52 28.670 32.608 -3.938 1
1 632 . 10 1 1 A 52 52 HIS N N 52 116.844 117.618 -0.774 1
1 633 . 10 1 1 A 53 53 GLU H H 53 8.331 9.114 -0.783 1
1 634 . 10 1 1 A 53 53 GLU HA H 53 4.636 4.812 -0.176 1
1 639 . 10 1 1 A 53 53 GLU C C 53 176.145 176.167 -0.022 1
1 640 . 10 1 1 A 53 53 GLU CA C 53 54.891 54.771 0.120 1
1 641 . 10 1 1 A 53 53 GLU CB C 53 33.837 33.283 0.554 1
1 643 . 10 1 1 A 53 53 GLU N N 53 118.873 118.757 0.116 1
1 644 . 10 1 1 A 54 54 VAL H H 54 8.585 8.428 0.157 1
1 645 . 10 1 1 A 54 54 VAL HA H 54 3.227 4.042 -0.815 1
1 653 . 10 1 1 A 54 54 VAL C C 54 177.218 176.565 0.653 1
1 654 . 10 1 1 A 54 54 VAL CA C 54 65.848 63.609 2.239 1
1 655 . 10 1 1 A 54 54 VAL CB C 54 31.189 31.499 -0.310 1
1 658 . 10 1 1 A 54 54 VAL N N 54 120.580 121.223 -0.643 1
1 659 . 10 1 1 A 55 55 GLY H H 55 8.912 9.342 -0.430 1
1 660 . 10 1 1 A 55 55 GLY HA2 H 55 4.441 4.053 0.388 1
1 661 . 10 1 1 A 55 55 GLY HA3 H 55 3.865 4.056 -0.191 1
1 662 . 10 1 1 A 55 55 GLY C C 55 174.827 173.996 0.831 1
1 663 . 10 1 1 A 55 55 GLY CA C 55 44.370 44.863 -0.493 1
1 664 . 10 1 1 A 55 55 GLY N N 55 118.078 115.326 2.752 1
1 665 . 10 1 1 A 56 56 ASP H H 56 8.098 7.796 0.302 1
1 666 . 10 1 1 A 56 56 ASP HA H 56 4.547 4.675 -0.128 1
1 669 . 10 1 1 A 56 56 ASP C C 56 174.859 174.935 -0.076 1
1 670 . 10 1 1 A 56 56 ASP CA C 56 55.629 54.649 0.980 1
1 671 . 10 1 1 A 56 56 ASP CB C 56 40.906 41.147 -0.241 1
1 672 . 10 1 1 A 56 56 ASP N N 56 123.094 121.947 1.147 1
1 673 . 10 1 1 A 57 57 LYS H H 57 8.168 8.621 -0.453 1
1 674 . 10 1 1 A 57 57 LYS HA H 57 5.471 5.831 -0.360 1
1 683 . 10 1 1 A 57 57 LYS C C 57 175.732 175.181 0.551 1
1 684 . 10 1 1 A 57 57 LYS CA C 57 55.056 55.026 0.030 1
1 685 . 10 1 1 A 57 57 LYS CB C 57 35.302 35.983 -0.681 1
1 689 . 10 1 1 A 57 57 LYS N N 57 122.301 122.924 -0.623 1
1 690 . 10 1 1 A 58 58 PHE H H 58 8.355 8.416 -0.061 1
1 691 . 10 1 1 A 58 58 PHE HA H 58 4.858 5.217 -0.359 1
1 699 . 10 1 1 A 58 58 PHE C C 58 171.549 171.935 -0.386 1
1 700 . 10 1 1 A 58 58 PHE CA C 58 56.195 55.872 0.323 1
1 701 . 10 1 1 A 58 58 PHE CB C 58 39.335 41.151 -1.816 1
1 705 . 10 1 1 A 58 58 PHE N N 58 121.026 121.331 -0.305 1
1 706 . 10 1 1 A 59 59 ASP H H 59 8.407 8.908 -0.501 1
1 707 . 10 1 1 A 59 59 ASP HA H 59 5.743 5.675 0.068 1
1 710 . 10 1 1 A 59 59 ASP C C 59 176.302 175.308 0.994 1
1 711 . 10 1 1 A 59 59 ASP CA C 59 52.579 52.541 0.038 1
1 712 . 10 1 1 A 59 59 ASP CB C 59 43.628 44.020 -0.392 1
1 713 . 10 1 1 A 59 59 ASP N N 59 119.234 119.475 -0.241 1
1 714 . 10 1 1 A 60 60 VAL H H 60 8.915 8.961 -0.046 1
1 715 . 10 1 1 A 60 60 VAL HA H 60 4.374 5.019 -0.645 1
1 723 . 10 1 1 A 60 60 VAL C C 60 173.140 174.384 -1.244 1
1 724 . 10 1 1 A 60 60 VAL CA C 60 61.252 60.229 1.023 1
1 725 . 10 1 1 A 60 60 VAL CB C 60 35.620 35.736 -0.116 1
1 728 . 10 1 1 A 60 60 VAL N N 60 119.758 121.102 -1.344 1
1 729 . 10 1 1 A 61 61 ALA H H 61 8.761 8.881 -0.120 1
1 730 . 10 1 1 A 61 61 ALA HA H 61 5.091 5.106 -0.015 1
1 734 . 10 1 1 A 61 61 ALA C C 61 176.460 176.209 0.251 1
1 735 . 10 1 1 A 61 61 ALA CA C 61 51.019 50.886 0.133 1
1 736 . 10 1 1 A 61 61 ALA CB C 61 19.447 21.306 -1.859 1
1 737 . 10 1 1 A 61 61 ALA N N 61 133.341 128.242 5.099 1
1 738 . 10 1 1 A 62 62 VAL H H 62 8.929 8.669 0.260 1
1 739 . 10 1 1 A 62 62 VAL HA H 62 4.236 4.714 -0.478 1
1 747 . 10 1 1 A 62 62 VAL C C 62 174.733 175.494 -0.761 1
1 748 . 10 1 1 A 62 62 VAL CA C 62 61.007 60.702 0.305 1
1 749 . 10 1 1 A 62 62 VAL CB C 62 34.387 35.993 -1.606 1
1 752 . 10 1 1 A 62 62 VAL N N 62 124.165 122.757 1.408 1
1 753 . 10 1 1 A 63 63 GLY H H 63 8.995 8.640 0.355 1
1 754 . 10 1 1 A 63 63 GLY HA2 H 63 4.229 4.118 0.111 1
1 755 . 10 1 1 A 63 63 GLY HA3 H 63 3.637 4.125 -0.488 1
1 756 . 10 1 1 A 63 63 GLY C C 63 175.306 174.918 0.388 1
1 757 . 10 1 1 A 63 63 GLY CA C 63 44.620 45.196 -0.576 1
1 758 . 10 1 1 A 63 63 GLY N N 63 115.598 111.654 3.944 1
1 759 . 10 1 1 A 64 64 ALA H H 64 8.106 8.903 -0.797 1
1 760 . 10 1 1 A 64 64 ALA HA H 64 4.010 4.580 -0.570 1
1 764 . 10 1 1 A 64 64 ALA C C 64 180.218 178.901 1.317 1
1 765 . 10 1 1 A 64 64 ALA CA C 64 55.897 54.673 1.224 1
1 766 . 10 1 1 A 64 64 ALA CB C 64 18.347 18.460 -0.113 1
1 767 . 10 1 1 A 64 64 ALA N N 64 122.859 123.877 -1.018 1
1 768 . 10 1 1 A 65 65 ASN H H 65 8.748 8.122 0.626 1
1 769 . 10 1 1 A 65 65 ASN HA H 65 4.230 4.517 -0.287 1
1 774 . 10 1 1 A 65 65 ASN C C 65 176.085 175.777 0.308 1
1 775 . 10 1 1 A 65 65 ASN CA C 65 56.064 55.619 0.445 1
1 776 . 10 1 1 A 65 65 ASN CB C 65 37.871 38.460 -0.589 1
1 777 . 10 1 1 A 65 65 ASN N N 65 114.590 117.161 -2.571 1
1 779 . 10 1 1 A 66 66 ASP H H 66 7.598 8.105 -0.507 1
1 780 . 10 1 1 A 66 66 ASP HA H 66 4.682 4.701 -0.019 1
1 783 . 10 1 1 A 66 66 ASP C C 66 173.061 175.741 -2.680 1
1 784 . 10 1 1 A 66 66 ASP CA C 66 53.549 54.666 -1.117 1
1 785 . 10 1 1 A 66 66 ASP CB C 66 42.204 42.731 -0.527 1
1 786 . 10 1 1 A 66 66 ASP N N 66 118.065 116.768 1.297 1
1 787 . 10 1 1 A 67 67 ALA H H 67 7.434 7.712 -0.278 1
1 788 . 10 1 1 A 67 67 ALA HA H 67 4.316 4.369 -0.053 1
1 792 . 10 1 1 A 67 67 ALA C C 67 175.615 176.572 -0.957 1
1 793 . 10 1 1 A 67 67 ALA CA C 67 50.814 49.967 0.847 1
1 794 . 10 1 1 A 67 67 ALA CB C 67 18.618 20.871 -2.253 1
1 795 . 10 1 1 A 67 67 ALA N N 67 124.890 120.286 4.604 1
1 796 . 10 1 1 A 68 68 TYR H H 68 8.390 8.302 0.088 1
1 797 . 10 1 1 A 68 68 TYR HA H 68 4.195 4.576 -0.381 1
1 804 . 10 1 1 A 68 68 TYR C C 68 174.964 176.939 -1.975 1
1 805 . 10 1 1 A 68 68 TYR CA C 68 59.566 58.232 1.334 1
1 806 . 10 1 1 A 68 68 TYR CB C 68 36.992 39.494 -2.502 1
1 809 . 10 1 1 A 68 68 TYR N N 68 121.083 117.588 3.495 1
1 810 . 10 1 1 A 69 69 GLY H H 69 8.149 8.935 -0.786 1
1 811 . 10 1 1 A 69 69 GLY HA2 H 69 4.254 3.968 0.286 1
1 812 . 10 1 1 A 69 69 GLY HA3 H 69 3.624 3.977 -0.353 1
1 813 . 10 1 1 A 69 69 GLY C C 69 173.161 175.049 -1.888 1
1 814 . 10 1 1 A 69 69 GLY CA C 69 44.465 45.573 -1.108 1
1 815 . 10 1 1 A 69 69 GLY N N 69 108.762 110.386 -1.624 1
1 816 . 10 1 1 A 70 70 GLN H H 70 8.450 7.761 0.689 1
1 817 . 10 1 1 A 70 70 GLN HA H 70 4.140 4.408 -0.268 1
1 824 . 10 1 1 A 70 70 GLN C C 70 176.138 175.074 1.064 1
1 825 . 10 1 1 A 70 70 GLN CA C 70 54.680 55.632 -0.952 1
1 826 . 10 1 1 A 70 70 GLN CB C 70 29.210 30.224 -1.014 1
1 828 . 10 1 1 A 70 70 GLN N N 70 117.002 119.504 -2.502 1
1 830 . 10 1 1 A 71 71 TYR H H 71 8.991 8.244 0.747 1
1 831 . 10 1 1 A 71 71 TYR HA H 71 3.752 4.602 -0.850 1
1 838 . 10 1 1 A 71 71 TYR C C 71 174.548 174.855 -0.307 1
1 839 . 10 1 1 A 71 71 TYR CA C 71 59.868 57.678 2.190 1
1 840 . 10 1 1 A 71 71 TYR CB C 71 38.961 39.473 -0.512 1
1 843 . 10 1 1 A 71 71 TYR N N 71 125.112 120.277 4.835 1
1 844 . 10 1 1 A 72 72 ASP H H 72 8.819 8.620 0.199 1
1 845 . 10 1 1 A 72 72 ASP HA H 72 4.773 4.618 0.155 1
1 848 . 10 1 1 A 72 72 ASP C C 72 177.709 177.275 0.434 1
1 849 . 10 1 1 A 72 72 ASP CA C 72 52.382 53.852 -1.470 1
1 850 . 10 1 1 A 72 72 ASP CB C 72 42.197 40.851 1.346 1
1 851 . 10 1 1 A 72 72 ASP N N 72 129.918 122.892 7.026 1
1 852 . 10 1 1 A 73 73 GLU H H 73 9.409 8.867 0.542 1
1 853 . 10 1 1 A 73 73 GLU HA H 73 3.937 4.340 -0.403 1
1 858 . 10 1 1 A 73 73 GLU C C 73 177.581 177.712 -0.131 1
1 859 . 10 1 1 A 73 73 GLU CA C 73 58.962 58.407 0.555 1
1 860 . 10 1 1 A 73 73 GLU CB C 73 29.155 28.811 0.344 1
1 862 . 10 1 1 A 73 73 GLU N N 73 129.624 126.059 3.565 1
1 863 . 10 1 1 A 74 74 ASN H H 74 8.700 7.843 0.857 1
1 864 . 10 1 1 A 74 74 ASN HA H 74 4.550 4.663 -0.113 1
1 869 . 10 1 1 A 74 74 ASN C C 74 176.190 176.322 -0.132 1
1 870 . 10 1 1 A 74 74 ASN CA C 74 54.932 55.411 -0.479 1
1 871 . 10 1 1 A 74 74 ASN CB C 74 38.113 38.362 -0.249 1
1 872 . 10 1 1 A 74 74 ASN N N 74 116.792 118.567 -1.775 1
1 874 . 10 1 1 A 75 75 LEU H H 75 7.303 7.562 -0.259 1
1 875 . 10 1 1 A 75 75 LEU HA H 75 4.289 4.488 -0.199 1
1 885 . 10 1 1 A 75 75 LEU C C 75 175.821 175.706 0.115 1
1 886 . 10 1 1 A 75 75 LEU CA C 75 54.106 54.859 -0.753 1
1 887 . 10 1 1 A 75 75 LEU CB C 75 41.239 43.075 -1.836 1
1 891 . 10 1 1 A 75 75 LEU N N 75 117.094 116.934 0.160 1
1 892 . 10 1 1 A 76 76 VAL H H 76 7.181 7.582 -0.401 1
1 893 . 10 1 1 A 76 76 VAL HA H 76 4.970 5.352 -0.382 1
1 901 . 10 1 1 A 76 76 VAL C C 76 175.702 174.196 1.506 1
1 902 . 10 1 1 A 76 76 VAL CA C 76 61.733 59.782 1.951 1
1 903 . 10 1 1 A 76 76 VAL CB C 76 31.822 35.035 -3.213 1
1 905 . 10 1 1 A 76 76 VAL N N 76 124.716 117.920 6.796 1
1 906 . 10 1 1 A 77 77 GLN H H 77 8.791 8.588 0.203 1
1 907 . 10 1 1 A 77 77 GLN HA H 77 4.695 5.061 -0.366 1
1 914 . 10 1 1 A 77 77 GLN C C 77 173.553 173.637 -0.084 1
1 915 . 10 1 1 A 77 77 GLN CA C 77 54.038 53.832 0.206 1
1 916 . 10 1 1 A 77 77 GLN CB C 77 33.018 32.472 0.546 1
1 918 . 10 1 1 A 77 77 GLN N N 77 124.898 126.327 -1.429 1
1 920 . 10 1 1 A 78 78 ARG H H 78 8.530 8.566 -0.036 1
1 921 . 10 1 1 A 78 78 ARG HA H 78 5.107 5.233 -0.126 1
1 928 . 10 1 1 A 78 78 ARG C C 78 176.182 175.279 0.903 1
1 929 . 10 1 1 A 78 78 ARG CA C 78 55.355 55.040 0.315 1
1 930 . 10 1 1 A 78 78 ARG CB C 78 31.150 31.430 -0.280 1
1 933 . 10 1 1 A 78 78 ARG N N 78 123.413 119.997 3.416 1
1 934 . 10 1 1 A 79 79 VAL H H 79 9.300 9.027 0.273 1
1 935 . 10 1 1 A 79 79 VAL HA H 79 4.824 4.556 0.268 1
1 943 . 10 1 1 A 79 79 VAL CA C 79 58.731 58.690 0.041 1
1 944 . 10 1 1 A 79 79 VAL CB C 79 34.836 34.175 0.661 1
1 947 . 10 1 1 A 79 79 VAL N N 79 125.252 124.260 0.992 1
1 948 . 10 1 1 A 80 80 PRO HA H 80 4.339 4.925 -0.586 1
1 955 . 10 1 1 A 80 80 PRO C C 80 176.902 177.872 -0.970 1
1 956 . 10 1 1 A 80 80 PRO CA C 80 62.969 63.075 -0.106 1
1 957 . 10 1 1 A 80 80 PRO CB C 80 32.431 32.001 0.430 1
1 960 . 10 1 1 A 81 81 LYS H H 81 7.816 8.921 -1.105 1
1 961 . 10 1 1 A 81 81 LYS HA H 81 3.790 4.125 -0.335 1
1 970 . 10 1 1 A 81 81 LYS C C 81 177.808 178.681 -0.873 1
1 971 . 10 1 1 A 81 81 LYS CA C 81 59.874 59.361 0.513 1
1 972 . 10 1 1 A 81 81 LYS CB C 81 32.670 32.023 0.647 1
1 976 . 10 1 1 A 81 81 LYS N N 81 120.948 123.960 -3.012 1
1 977 . 10 1 1 A 82 82 ASP H H 82 8.069 8.172 -0.103 1
1 978 . 10 1 1 A 82 82 ASP HA H 82 4.243 4.453 -0.210 1
1 981 . 10 1 1 A 82 82 ASP C C 82 177.157 178.877 -1.720 1
1 982 . 10 1 1 A 82 82 ASP CA C 82 55.527 56.630 -1.103 1
1 983 . 10 1 1 A 82 82 ASP CB C 82 40.005 40.883 -0.878 1
1 984 . 10 1 1 A 82 82 ASP N N 82 116.004 119.990 -3.986 1
1 985 . 10 1 1 A 83 83 VAL H H 83 7.150 7.935 -0.785 1
1 986 . 10 1 1 A 83 83 VAL HA H 83 3.719 3.554 0.165 1
1 994 . 10 1 1 A 83 83 VAL C C 83 176.346 176.820 -0.474 1
1 995 . 10 1 1 A 83 83 VAL CA C 83 63.868 65.857 -1.989 1
1 996 . 10 1 1 A 83 83 VAL CB C 83 31.689 31.457 0.232 1
1 999 . 10 1 1 A 83 83 VAL N N 83 117.199 118.944 -1.745 1
1 1000 . 10 1 1 A 84 84 PHE H H 84 7.365 7.713 -0.348 1
1 1001 . 10 1 1 A 84 84 PHE HA H 84 4.389 4.545 -0.156 1
1 1009 . 10 1 1 A 84 84 PHE C C 84 175.265 176.423 -1.158 1
1 1010 . 10 1 1 A 84 84 PHE CA C 84 57.210 56.876 0.334 1
1 1011 . 10 1 1 A 84 84 PHE CB C 84 38.968 37.611 1.357 1
1 1015 . 10 1 1 A 84 84 PHE N N 84 119.897 117.163 2.734 1
1 1016 . 10 1 1 A 85 85 MET H H 85 7.765 8.127 -0.362 1
1 1017 . 10 1 1 A 85 85 MET HA H 85 4.277 4.321 -0.044 1
1 1025 . 10 1 1 A 85 85 MET C C 85 176.856 176.982 -0.126 1
1 1026 . 10 1 1 A 85 85 MET CA C 85 56.389 57.719 -1.330 1
1 1027 . 10 1 1 A 85 85 MET CB C 85 32.715 32.305 0.410 1
1 1030 . 10 1 1 A 85 85 MET N N 85 121.131 119.352 1.779 1
1 1031 . 10 1 1 A 86 86 GLY H H 86 8.499 8.167 0.332 1
1 1032 . 10 1 1 A 86 86 GLY HA2 H 86 3.928 3.936 -0.008 1
1 1033 . 10 1 1 A 86 86 GLY HA3 H 86 3.793 3.937 -0.144 1
1 1034 . 10 1 1 A 86 86 GLY C C 86 174.168 173.559 0.609 1
1 1035 . 10 1 1 A 86 86 GLY CA C 86 45.637 45.214 0.423 1
1 1036 . 10 1 1 A 86 86 GLY N N 86 111.268 107.597 3.671 1
1 1037 . 10 1 1 A 87 87 VAL H H 87 7.564 7.713 -0.149 1
1 1038 . 10 1 1 A 87 87 VAL HA H 87 4.083 4.265 -0.182 1
1 1046 . 10 1 1 A 87 87 VAL C C 87 175.649 175.838 -0.189 1
1 1047 . 10 1 1 A 87 87 VAL CA C 87 61.809 60.452 1.357 1
1 1048 . 10 1 1 A 87 87 VAL CB C 87 32.667 33.474 -0.807 1
1 1051 . 10 1 1 A 87 87 VAL N N 87 118.839 120.373 -1.534 1
1 1052 . 10 1 1 A 88 88 ASP H H 88 8.270 8.933 -0.663 1
1 1053 . 10 1 1 A 88 88 ASP HA H 88 4.421 4.499 -0.078 1
1 1056 . 10 1 1 A 88 88 ASP C C 88 175.977 175.115 0.862 1
1 1057 . 10 1 1 A 88 88 ASP CA C 88 55.655 56.732 -1.077 1
1 1058 . 10 1 1 A 88 88 ASP CB C 88 41.364 40.906 0.458 1
1 1059 . 10 1 1 A 88 88 ASP N N 88 124.401 126.353 -1.952 1
1 1060 . 10 1 1 A 89 89 GLU H H 89 7.833 7.876 -0.043 1
1 1061 . 10 1 1 A 89 89 GLU HA H 89 4.206 4.693 -0.487 1
1 1066 . 10 1 1 A 89 89 GLU C C 89 174.912 175.612 -0.700 1
1 1067 . 10 1 1 A 89 89 GLU CA C 89 55.739 55.018 0.721 1
1 1068 . 10 1 1 A 89 89 GLU CB C 89 30.603 32.894 -2.291 1
1 1070 . 10 1 1 A 89 89 GLU N N 89 119.378 115.457 3.921 1
1 1071 . 10 1 1 A 90 90 LEU H H 90 8.051 8.717 -0.666 1
1 1072 . 10 1 1 A 90 90 LEU HA H 90 4.127 4.309 -0.182 1
1 1082 . 10 1 1 A 90 90 LEU C C 90 175.753 176.079 -0.326 1
1 1083 . 10 1 1 A 90 90 LEU CA C 90 54.929 55.306 -0.377 1
1 1084 . 10 1 1 A 90 90 LEU CB C 90 42.710 40.965 1.745 1
1 1088 . 10 1 1 A 90 90 LEU N N 90 124.432 125.638 -1.206 1
1 1089 . 10 1 1 A 91 91 GLN H H 91 7.341 8.769 -1.428 1
1 1090 . 10 1 1 A 91 91 GLN HA H 91 4.546 4.826 -0.280 1
1 1097 . 10 1 1 A 91 91 GLN C C 91 174.655 175.113 -0.458 1
1 1098 . 10 1 1 A 91 91 GLN CA C 91 53.671 53.923 -0.252 1
1 1099 . 10 1 1 A 91 91 GLN CB C 91 32.850 32.071 0.779 1
1 1101 . 10 1 1 A 91 91 GLN N N 91 120.186 125.538 -5.352 1
1 1103 . 10 1 1 A 92 92 VAL H H 92 8.442 8.546 -0.104 1
1 1104 . 10 1 1 A 92 92 VAL HA H 92 3.278 3.546 -0.268 1
1 1112 . 10 1 1 A 92 92 VAL C C 92 177.098 177.117 -0.019 1
1 1113 . 10 1 1 A 92 92 VAL CA C 92 64.953 65.560 -0.607 1
1 1114 . 10 1 1 A 92 92 VAL CB C 92 31.601 31.350 0.251 1
1 1117 . 10 1 1 A 92 92 VAL N N 92 121.899 124.306 -2.407 1
1 1118 . 10 1 1 A 93 93 GLY H H 93 9.002 9.754 -0.752 1
1 1119 . 10 1 1 A 93 93 GLY HA2 H 93 4.327 3.943 0.384 1
1 1120 . 10 1 1 A 93 93 GLY HA3 H 93 3.770 3.958 -0.188 1
1 1121 . 10 1 1 A 93 93 GLY C C 93 174.547 174.241 0.306 1
1 1122 . 10 1 1 A 93 93 GLY CA C 93 44.446 44.867 -0.421 1
1 1123 . 10 1 1 A 93 93 GLY N N 93 116.485 115.472 1.013 1
1 1124 . 10 1 1 A 94 94 MET H H 94 7.445 7.632 -0.187 1
1 1125 . 10 1 1 A 94 94 MET HA H 94 4.182 4.395 -0.213 1
1 1133 . 10 1 1 A 94 94 MET C C 94 174.531 174.740 -0.209 1
1 1134 . 10 1 1 A 94 94 MET CA C 94 57.193 56.313 0.880 1
1 1135 . 10 1 1 A 94 94 MET CB C 94 34.474 33.417 1.057 1
1 1138 . 10 1 1 A 94 94 MET N N 94 120.304 121.262 -0.958 1
1 1139 . 10 1 1 A 95 95 ARG H H 95 8.169 8.630 -0.461 1
1 1140 . 10 1 1 A 95 95 ARG HA H 95 5.343 4.960 0.383 1
1 1147 . 10 1 1 A 95 95 ARG C C 95 175.593 175.039 0.554 1
1 1148 . 10 1 1 A 95 95 ARG CA C 95 54.898 54.508 0.390 1
1 1149 . 10 1 1 A 95 95 ARG CB C 95 32.928 33.191 -0.263 1
1 1152 . 10 1 1 A 95 95 ARG N N 95 122.066 122.507 -0.441 1
1 1153 . 10 1 1 A 96 96 PHE H H 96 8.440 8.249 0.191 1
1 1154 . 10 1 1 A 96 96 PHE HA H 96 4.738 5.069 -0.331 1
1 1162 . 10 1 1 A 96 96 PHE C C 96 173.273 171.962 1.311 1
1 1163 . 10 1 1 A 96 96 PHE CA C 96 56.174 56.187 -0.013 1
1 1164 . 10 1 1 A 96 96 PHE CB C 96 42.474 40.594 1.880 1
1 1168 . 10 1 1 A 96 96 PHE N N 96 119.938 118.739 1.199 1
1 1169 . 10 1 1 A 97 97 LEU H H 97 8.459 8.709 -0.250 1
1 1170 . 10 1 1 A 97 97 LEU HA H 97 4.625 4.730 -0.105 1
1 1180 . 10 1 1 A 97 97 LEU C C 97 175.664 175.781 -0.117 1
1 1181 . 10 1 1 A 97 97 LEU CA C 97 53.547 55.170 -1.623 1
1 1182 . 10 1 1 A 97 97 LEU CB C 97 42.379 43.493 -1.114 1
1 1186 . 10 1 1 A 97 97 LEU N N 97 122.014 122.090 -0.076 1
1 1187 . 10 1 1 A 98 98 ALA H H 98 8.812 8.382 0.430 1
1 1188 . 10 1 1 A 98 98 ALA HA H 98 4.520 5.333 -0.813 1
1 1192 . 10 1 1 A 98 98 ALA C C 98 176.373 175.782 0.591 1
1 1193 . 10 1 1 A 98 98 ALA CA C 98 50.639 50.402 0.237 1
1 1194 . 10 1 1 A 98 98 ALA CB C 98 20.939 23.590 -2.651 1
1 1195 . 10 1 1 A 98 98 ALA N N 98 129.296 128.216 1.080 1
1 1196 . 10 1 1 A 99 99 GLU H H 99 8.504 8.706 -0.202 1
1 1197 . 10 1 1 A 99 99 GLU HA H 99 4.150 5.088 -0.938 1
1 1202 . 10 1 1 A 99 99 GLU C C 99 176.351 176.328 0.023 1
1 1203 . 10 1 1 A 99 99 GLU CA C 99 56.830 55.396 1.434 1
1 1204 . 10 1 1 A 99 99 GLU CB C 99 29.639 32.047 -2.408 1
1 1206 . 10 1 1 A 99 99 GLU N N 99 121.993 121.155 0.838 1
1 1207 . 10 1 1 A 100 100 THR H H 100 7.393 8.437 -1.044 1
1 1208 . 10 1 1 A 100 100 THR HA H 100 4.819 4.833 -0.014 1
1 1213 . 10 1 1 A 100 100 THR C C 100 175.882 174.624 1.258 1
1 1214 . 10 1 1 A 100 100 THR CA C 100 60.329 60.360 -0.031 1
1 1215 . 10 1 1 A 100 100 THR CB C 100 73.452 71.594 1.858 1
1 1217 . 10 1 1 A 100 100 THR N N 100 115.598 114.101 1.497 1
1 1218 . 10 1 1 A 101 101 ASP H H 101 8.988 8.848 0.140 1
1 1219 . 10 1 1 A 101 101 ASP HA H 101 4.357 4.426 -0.069 1
1 1222 . 10 1 1 A 101 101 ASP C C 101 176.848 177.754 -0.906 1
1 1223 . 10 1 1 A 101 101 ASP CA C 101 56.493 57.019 -0.526 1
1 1224 . 10 1 1 A 101 101 ASP CB C 101 39.973 40.489 -0.516 1
1 1225 . 10 1 1 A 101 101 ASP N N 101 121.468 120.051 1.417 1
1 1226 . 10 1 1 A 102 102 GLN H H 102 7.937 7.608 0.329 1
1 1227 . 10 1 1 A 102 102 GLN HA H 102 4.415 4.417 -0.002 1
1 1234 . 10 1 1 A 102 102 GLN C C 102 175.252 175.967 -0.715 1
1 1235 . 10 1 1 A 102 102 GLN CA C 102 55.097 55.487 -0.390 1
1 1236 . 10 1 1 A 102 102 GLN CB C 102 29.121 28.613 0.508 1
1 1238 . 10 1 1 A 102 102 GLN N N 102 117.199 115.441 1.758 1
1 1240 . 10 1 1 A 103 103 GLY H H 103 7.431 7.803 -0.372 1
1 1241 . 10 1 1 A 103 103 GLY HA2 H 103 4.504 4.290 0.214 1
1 1242 . 10 1 1 A 103 103 GLY HA3 H 103 3.868 4.291 -0.423 1
1 1243 . 10 1 1 A 103 103 GLY CA C 103 44.051 44.411 -0.360 1
1 1244 . 10 1 1 A 103 103 GLY N N 103 110.056 107.557 2.499 1
1 1245 . 10 1 1 A 104 104 PRO HA H 104 5.057 5.179 -0.122 1
1 1252 . 10 1 1 A 104 104 PRO C C 104 177.873 175.832 2.041 1
1 1253 . 10 1 1 A 104 104 PRO CA C 104 62.464 63.109 -0.645 1
1 1254 . 10 1 1 A 104 104 PRO CB C 104 31.939 31.840 0.099 1
1 1257 . 10 1 1 A 105 105 VAL H H 105 8.960 9.283 -0.323 1
1 1258 . 10 1 1 A 105 105 VAL HA H 105 4.678 4.474 0.204 1
1 1266 . 10 1 1 A 105 105 VAL CA C 105 58.474 59.497 -1.023 1
1 1267 . 10 1 1 A 105 105 VAL CB C 105 35.512 34.015 1.497 1
1 1270 . 10 1 1 A 105 105 VAL N N 105 123.240 123.152 0.088 1
1 1271 . 10 1 1 A 106 106 PRO HA H 106 4.777 4.780 -0.003 1
1 1278 . 10 1 1 A 106 106 PRO C C 106 176.823 176.383 0.440 1
1 1279 . 10 1 1 A 106 106 PRO CA C 106 62.508 62.513 -0.005 1
1 1280 . 10 1 1 A 106 106 PRO CB C 106 31.650 31.732 -0.082 1
1 1283 . 10 1 1 A 107 107 VAL H H 107 8.835 8.216 0.619 1
1 1284 . 10 1 1 A 107 107 VAL HA H 107 4.719 5.002 -0.283 1
1 1292 . 10 1 1 A 107 107 VAL C C 107 173.661 173.343 0.318 1
1 1293 . 10 1 1 A 107 107 VAL CA C 107 59.026 59.199 -0.173 1
1 1294 . 10 1 1 A 107 107 VAL CB C 107 36.406 35.181 1.225 1
1 1297 . 10 1 1 A 107 107 VAL N N 107 117.474 117.120 0.354 1
1 1298 . 10 1 1 A 108 108 GLU H H 108 7.698 8.610 -0.912 1
1 1299 . 10 1 1 A 108 108 GLU HA H 108 5.133 4.945 0.188 1
1 1304 . 10 1 1 A 108 108 GLU C C 108 176.394 174.940 1.454 1
1 1305 . 10 1 1 A 108 108 GLU CA C 108 53.808 54.492 -0.684 1
1 1306 . 10 1 1 A 108 108 GLU CB C 108 33.984 33.595 0.389 1
1 1308 . 10 1 1 A 108 108 GLU N N 108 120.646 120.135 0.511 1
1 1309 . 10 1 1 A 109 109 ILE H H 109 8.690 9.152 -0.462 1
1 1310 . 10 1 1 A 109 109 ILE HA H 109 4.484 4.172 0.312 1
1 1320 . 10 1 1 A 109 109 ILE C C 109 177.313 177.043 0.270 1
1 1321 . 10 1 1 A 109 109 ILE CA C 109 61.789 61.598 0.191 1
1 1322 . 10 1 1 A 109 109 ILE CB C 109 36.628 37.206 -0.578 1
1 1326 . 10 1 1 A 109 109 ILE N N 109 124.739 127.585 -2.846 1
1 1327 . 10 1 1 A 110 110 THR H H 110 9.300 9.260 0.040 1
1 1328 . 10 1 1 A 110 110 THR HA H 110 4.547 4.472 0.075 1
1 1333 . 10 1 1 A 110 110 THR C C 110 174.904 174.916 -0.012 1
1 1334 . 10 1 1 A 110 110 THR CA C 110 62.260 62.091 0.169 1
1 1335 . 10 1 1 A 110 110 THR CB C 110 69.100 69.421 -0.321 1
1 1337 . 10 1 1 A 110 110 THR N N 110 122.544 119.517 3.027 1
1 1338 . 10 1 1 A 111 111 ALA H H 111 7.673 7.511 0.162 1
1 1339 . 10 1 1 A 111 111 ALA HA H 111 4.367 4.559 -0.192 1
1 1343 . 10 1 1 A 111 111 ALA C C 111 175.019 174.925 0.094 1
1 1344 . 10 1 1 A 111 111 ALA CA C 111 53.125 51.844 1.281 1
1 1345 . 10 1 1 A 111 111 ALA CB C 111 21.539 22.424 -0.885 1
1 1346 . 10 1 1 A 111 111 ALA N N 111 123.153 121.004 2.149 1
1 1347 . 10 1 1 A 112 112 VAL H H 112 8.707 8.511 0.196 1
1 1348 . 10 1 1 A 112 112 VAL HA H 112 4.129 4.503 -0.374 1
1 1356 . 10 1 1 A 112 112 VAL C C 112 174.755 175.266 -0.511 1
1 1357 . 10 1 1 A 112 112 VAL CA C 112 62.898 61.599 1.299 1
1 1358 . 10 1 1 A 112 112 VAL CB C 112 33.379 34.407 -1.028 1
1 1361 . 10 1 1 A 112 112 VAL N N 112 122.369 119.841 2.528 1
1 1362 . 10 1 1 A 113 113 GLU H H 113 8.144 8.826 -0.682 1
1 1363 . 10 1 1 A 113 113 GLU HA H 113 4.645 4.440 0.205 1
1 1368 . 10 1 1 A 113 113 GLU C C 113 175.102 177.744 -2.642 1
1 1369 . 10 1 1 A 113 113 GLU CA C 113 54.080 55.400 -1.320 1
1 1370 . 10 1 1 A 113 113 GLU CB C 113 31.234 30.582 0.652 1
1 1372 . 10 1 1 A 113 113 GLU N N 113 127.435 126.737 0.698 1
1 1373 . 10 1 1 A 114 114 ASP H H 114 8.472 8.795 -0.323 1
1 1374 . 10 1 1 A 114 114 ASP HA H 114 4.209 4.249 -0.040 1
1 1377 . 10 1 1 A 114 114 ASP C C 114 177.679 177.087 0.592 1
1 1378 . 10 1 1 A 114 114 ASP CA C 114 58.334 57.703 0.631 1
1 1379 . 10 1 1 A 114 114 ASP CB C 114 40.347 41.340 -0.993 1
1 1380 . 10 1 1 A 114 114 ASP N N 114 119.844 122.834 -2.990 1
1 1381 . 10 1 1 A 115 115 ASP H H 115 8.475 8.364 0.111 1
1 1382 . 10 1 1 A 115 115 ASP HA H 115 4.848 4.896 -0.048 1
1 1385 . 10 1 1 A 115 115 ASP C C 115 175.968 175.411 0.557 1
1 1386 . 10 1 1 A 115 115 ASP CA C 115 53.290 53.239 0.051 1
1 1387 . 10 1 1 A 115 115 ASP CB C 115 42.080 41.622 0.458 1
1 1388 . 10 1 1 A 115 115 ASP N N 115 114.364 117.638 -3.274 1
1 1389 . 10 1 1 A 116 116 HIS H H 116 7.185 7.463 -0.278 1
1 1390 . 10 1 1 A 116 116 HIS HA H 116 5.106 5.482 -0.376 1
1 1395 . 10 1 1 A 116 116 HIS C C 116 172.393 172.751 -0.358 1
1 1396 . 10 1 1 A 116 116 HIS CA C 116 56.099 54.382 1.717 1
1 1397 . 10 1 1 A 116 116 HIS CB C 116 33.289 32.500 0.789 1
1 1400 . 10 1 1 A 116 116 HIS N N 116 117.212 116.359 0.853 1
1 1401 . 10 1 1 A 117 117 VAL H H 117 9.130 9.224 -0.094 1
1 1402 . 10 1 1 A 117 117 VAL HA H 117 4.649 4.984 -0.335 1
1 1410 . 10 1 1 A 117 117 VAL C C 117 173.832 174.608 -0.776 1
1 1411 . 10 1 1 A 117 117 VAL CA C 117 59.555 60.100 -0.545 1
1 1412 . 10 1 1 A 117 117 VAL CB C 117 34.676 34.482 0.194 1
1 1415 . 10 1 1 A 117 117 VAL N N 117 114.046 117.364 -3.318 1
1 1416 . 10 1 1 A 118 118 VAL H H 118 8.680 8.461 0.219 1
1 1417 . 10 1 1 A 118 118 VAL HA H 118 4.747 5.057 -0.310 1
1 1425 . 10 1 1 A 118 118 VAL C C 118 175.836 175.035 0.801 1
1 1426 . 10 1 1 A 118 118 VAL CA C 118 62.159 60.930 1.229 1
1 1427 . 10 1 1 A 118 118 VAL CB C 118 31.887 34.343 -2.456 1
1 1430 . 10 1 1 A 118 118 VAL N N 118 125.095 121.567 3.528 1
1 1431 . 10 1 1 A 119 119 VAL H H 119 9.057 8.600 0.457 1
1 1432 . 10 1 1 A 119 119 VAL HA H 119 5.231 5.174 0.057 1
1 1440 . 10 1 1 A 119 119 VAL C C 119 173.747 174.235 -0.488 1
1 1441 . 10 1 1 A 119 119 VAL CA C 119 58.326 59.680 -1.354 1
1 1442 . 10 1 1 A 119 119 VAL CB C 119 34.387 34.312 0.075 1
1 1445 . 10 1 1 A 119 119 VAL N N 119 121.494 122.480 -0.986 1
1 1446 . 10 1 1 A 120 120 ASP H H 120 8.926 8.595 0.331 1
1 1447 . 10 1 1 A 120 120 ASP HA H 120 5.174 5.288 -0.114 1
1 1450 . 10 1 1 A 120 120 ASP C C 120 177.982 176.002 1.980 1
1 1451 . 10 1 1 A 120 120 ASP CA C 120 52.749 52.491 0.258 1
1 1452 . 10 1 1 A 120 120 ASP CB C 120 44.542 43.712 0.830 1
1 1453 . 10 1 1 A 120 120 ASP N N 120 121.454 124.404 -2.950 1
1 1454 . 10 1 1 A 121 121 GLY H H 121 8.674 8.586 0.088 1
1 1455 . 10 1 1 A 121 121 GLY HA2 H 121 4.702 4.116 0.586 1
1 1456 . 10 1 1 A 121 121 GLY HA3 H 121 3.573 4.117 -0.544 1
1 1457 . 10 1 1 A 121 121 GLY C C 121 175.041 173.865 1.176 1
1 1458 . 10 1 1 A 121 121 GLY CA C 121 45.319 45.442 -0.123 1
1 1459 . 10 1 1 A 121 121 GLY N N 121 114.850 111.354 3.496 1
1 1460 . 10 1 1 A 122 122 ASN H H 122 8.762 7.862 0.900 1
1 1461 . 10 1 1 A 122 122 ASN HA H 122 4.183 5.192 -1.009 1
1 1466 . 10 1 1 A 122 122 ASN C C 122 175.406 174.258 1.148 1
1 1467 . 10 1 1 A 122 122 ASN CA C 122 54.686 51.434 3.252 1
1 1468 . 10 1 1 A 122 122 ASN CB C 122 40.139 42.665 -2.526 1
1 1469 . 10 1 1 A 122 122 ASN N N 122 121.618 117.018 4.600 1
1 1471 . 10 1 1 A 123 123 HIS H H 123 8.929 8.572 0.357 1
1 1472 . 10 1 1 A 123 123 HIS HA H 123 4.005 4.865 -0.860 1
1 1477 . 10 1 1 A 123 123 HIS C C 123 177.325 175.642 1.683 1
1 1478 . 10 1 1 A 123 123 HIS CA C 123 58.768 55.965 2.803 1
1 1479 . 10 1 1 A 123 123 HIS CB C 123 31.172 31.810 -0.638 1
1 1482 . 10 1 1 A 123 123 HIS N N 123 124.165 116.175 7.990 1
1 1483 . 10 1 1 A 124 124 MET H H 124 8.266 8.082 0.184 1
1 1484 . 10 1 1 A 124 124 MET HA H 124 4.048 4.280 -0.232 1
1 1492 . 10 1 1 A 124 124 MET CA C 124 58.994 57.193 1.801 1
1 1493 . 10 1 1 A 124 124 MET CB C 124 32.777 32.467 0.310 1
1 1496 . 10 1 1 A 124 124 MET N N 124 129.443 118.797 10.646 1
1 1497 . 10 1 1 A 125 125 LEU H H 125 8.094 7.710 0.384 1
1 1498 . 10 1 1 A 125 125 LEU HA H 125 4.455 4.525 -0.070 1
1 1504 . 10 1 1 A 125 125 LEU C C 125 177.860 176.453 1.407 1
1 1505 . 10 1 1 A 125 125 LEU CA C 125 53.517 54.153 -0.636 1
1 1506 . 10 1 1 A 125 125 LEU CB C 125 42.462 41.337 1.125 1
1 1509 . 10 1 1 A 126 126 ALA H H 126 8.089 7.736 0.353 1
1 1510 . 10 1 1 A 126 126 ALA HA H 126 3.966 4.591 -0.625 1
1 1514 . 10 1 1 A 126 126 ALA C C 126 179.135 177.793 1.342 1
1 1515 . 10 1 1 A 126 126 ALA CA C 126 54.170 50.962 3.208 1
1 1516 . 10 1 1 A 126 126 ALA CB C 126 18.687 21.275 -2.588 1
1 1517 . 10 1 1 A 126 126 ALA N N 126 126.095 122.061 4.034 1
1 1518 . 10 1 1 A 127 127 GLY H H 127 9.499 8.594 0.905 1
1 1519 . 10 1 1 A 127 127 GLY HA2 H 127 4.207 4.020 0.187 1
1 1520 . 10 1 1 A 127 127 GLY HA3 H 127 3.598 4.021 -0.423 1
1 1521 . 10 1 1 A 127 127 GLY C C 127 173.568 174.434 -0.866 1
1 1522 . 10 1 1 A 127 127 GLY CA C 127 45.846 44.935 0.911 1
1 1523 . 10 1 1 A 127 127 GLY N N 127 110.073 109.233 0.840 1
1 1524 . 10 1 1 A 128 128 GLN H H 128 7.514 7.866 -0.352 1
1 1525 . 10 1 1 A 128 128 GLN HA H 128 4.496 4.426 0.070 1
1 1532 . 10 1 1 A 128 128 GLN C C 128 174.790 175.492 -0.702 1
1 1533 . 10 1 1 A 128 128 GLN CA C 128 54.948 55.329 -0.381 1
1 1534 . 10 1 1 A 128 128 GLN CB C 128 29.181 29.223 -0.042 1
1 1536 . 10 1 1 A 128 128 GLN N N 128 117.842 120.480 -2.638 1
1 1538 . 10 1 1 A 129 129 ASN H H 129 8.689 8.621 0.068 1
1 1539 . 10 1 1 A 129 129 ASN HA H 129 4.857 4.916 -0.059 1
1 1544 . 10 1 1 A 129 129 ASN C C 129 174.325 174.915 -0.590 1
1 1545 . 10 1 1 A 129 129 ASN CA C 129 52.568 52.443 0.125 1
1 1546 . 10 1 1 A 129 129 ASN CB C 129 38.035 39.752 -1.717 1
1 1547 . 10 1 1 A 129 129 ASN N N 129 122.739 122.583 0.156 1
1 1549 . 10 1 1 A 130 130 LEU H H 130 8.742 8.344 0.398 1
1 1550 . 10 1 1 A 130 130 LEU HA H 130 4.918 4.864 0.054 1
1 1560 . 10 1 1 A 130 130 LEU C C 130 176.095 175.221 0.874 1
1 1561 . 10 1 1 A 130 130 LEU CA C 130 53.691 53.429 0.262 1
1 1562 . 10 1 1 A 130 130 LEU CB C 130 46.814 45.607 1.207 1
1 1566 . 10 1 1 A 130 130 LEU N N 130 121.242 121.383 -0.141 1
1 1567 . 10 1 1 A 131 131 LYS H H 131 8.809 8.484 0.325 1
1 1568 . 10 1 1 A 131 131 LYS HA H 131 4.918 4.775 0.143 1
1 1577 . 10 1 1 A 131 131 LYS C C 131 175.508 175.285 0.223 1
1 1578 . 10 1 1 A 131 131 LYS CA C 131 55.333 54.624 0.709 1
1 1579 . 10 1 1 A 131 131 LYS CB C 131 33.962 34.871 -0.909 1
1 1583 . 10 1 1 A 131 131 LYS N N 131 122.071 120.481 1.590 1
1 1584 . 10 1 1 A 132 132 PHE H H 132 9.436 9.500 -0.064 1
1 1585 . 10 1 1 A 132 132 PHE HA H 132 5.427 5.336 0.091 1
1 1593 . 10 1 1 A 132 132 PHE C C 132 175.715 174.602 1.113 1
1 1594 . 10 1 1 A 132 132 PHE CA C 132 56.665 56.526 0.139 1
1 1595 . 10 1 1 A 132 132 PHE CB C 132 42.263 42.488 -0.225 1
1 1599 . 10 1 1 A 132 132 PHE N N 132 125.247 122.215 3.032 1
1 1600 . 10 1 1 A 133 133 ASN H H 133 8.680 9.076 -0.396 1
1 1601 . 10 1 1 A 133 133 ASN HA H 133 5.249 5.154 0.095 1
1 1606 . 10 1 1 A 133 133 ASN C C 133 174.433 174.059 0.374 1
1 1607 . 10 1 1 A 133 133 ASN CA C 133 53.952 52.753 1.199 1
1 1608 . 10 1 1 A 133 133 ASN CB C 133 41.492 39.533 1.959 1
1 1609 . 10 1 1 A 133 133 ASN N N 133 122.056 121.331 0.725 1
1 1611 . 10 1 1 A 134 134 VAL H H 134 8.762 8.422 0.340 1
1 1612 . 10 1 1 A 134 134 VAL HA H 134 4.805 4.675 0.130 1
1 1620 . 10 1 1 A 134 134 VAL C C 134 173.555 175.116 -1.561 1
1 1621 . 10 1 1 A 134 134 VAL CA C 134 60.374 61.372 -0.998 1
1 1622 . 10 1 1 A 134 134 VAL CB C 134 34.848 33.040 1.808 1
1 1625 . 10 1 1 A 134 134 VAL N N 134 122.014 125.845 -3.831 1
1 1626 . 10 1 1 A 135 135 GLU H H 135 8.869 9.643 -0.774 1
1 1627 . 10 1 1 A 135 135 GLU HA H 135 5.240 4.956 0.284 1
1 1632 . 10 1 1 A 135 135 GLU C C 135 175.578 175.144 0.434 1
1 1633 . 10 1 1 A 135 135 GLU CA C 135 54.376 55.256 -0.880 1
1 1634 . 10 1 1 A 135 135 GLU CB C 135 33.264 31.149 2.115 1
1 1636 . 10 1 1 A 135 135 GLU N N 135 125.197 127.089 -1.892 1
1 1637 . 10 1 1 A 136 136 VAL H H 136 8.270 8.607 -0.337 1
1 1638 . 10 1 1 A 136 136 VAL HA H 136 4.066 4.451 -0.385 1
1 1646 . 10 1 1 A 136 136 VAL C C 136 176.119 175.468 0.651 1
1 1647 . 10 1 1 A 136 136 VAL CA C 136 62.910 62.531 0.379 1
1 1648 . 10 1 1 A 136 136 VAL CB C 136 30.573 31.950 -1.377 1
1 1651 . 10 1 1 A 136 136 VAL N N 136 126.347 127.455 -1.108 1
1 1652 . 10 1 1 A 137 137 VAL H H 137 8.865 8.523 0.342 1
1 1653 . 10 1 1 A 137 137 VAL HA H 137 4.022 4.002 0.020 1
1 1661 . 10 1 1 A 137 137 VAL C C 137 175.208 176.187 -0.979 1
1 1662 . 10 1 1 A 137 137 VAL CA C 137 64.424 64.534 -0.110 1
1 1663 . 10 1 1 A 137 137 VAL CB C 137 32.943 32.390 0.553 1
1 1666 . 10 1 1 A 137 137 VAL N N 137 130.810 130.755 0.055 1
1 1667 . 10 1 1 A 138 138 ALA H H 138 7.677 7.518 0.159 1
1 1668 . 10 1 1 A 138 138 ALA HA H 138 4.496 4.720 -0.224 1
1 1672 . 10 1 1 A 138 138 ALA C C 138 174.405 175.093 -0.688 1
1 1673 . 10 1 1 A 138 138 ALA CA C 138 52.556 51.652 0.904 1
1 1674 . 10 1 1 A 138 138 ALA CB C 138 21.874 22.712 -0.838 1
1 1675 . 10 1 1 A 138 138 ALA N N 138 119.194 117.614 1.580 1
1 1676 . 10 1 1 A 139 139 ILE H H 139 8.052 8.502 -0.450 1
1 1677 . 10 1 1 A 139 139 ILE HA H 139 4.640 4.938 -0.298 1
1 1687 . 10 1 1 A 139 139 ILE C C 139 173.734 174.472 -0.738 1
1 1688 . 10 1 1 A 139 139 ILE CA C 139 61.623 59.702 1.921 1
1 1689 . 10 1 1 A 139 139 ILE CB C 139 43.363 41.460 1.903 1
1 1693 . 10 1 1 A 139 139 ILE N N 139 119.307 120.149 -0.842 1
1 1694 . 10 1 1 A 140 140 ARG H H 140 8.912 8.930 -0.018 1
1 1695 . 10 1 1 A 140 140 ARG HA H 140 4.760 4.727 0.033 1
1 1702 . 10 1 1 A 140 140 ARG C C 140 174.181 174.754 -0.573 1
1 1703 . 10 1 1 A 140 140 ARG CA C 140 54.243 54.582 -0.339 1
1 1704 . 10 1 1 A 140 140 ARG CB C 140 33.438 34.309 -0.871 1
1 1707 . 10 1 1 A 140 140 ARG N N 140 122.820 126.297 -3.477 1
1 1708 . 10 1 1 A 141 141 GLU H H 141 8.545 8.499 0.046 1
1 1709 . 10 1 1 A 141 141 GLU HA H 141 4.254 4.545 -0.291 1
1 1714 . 10 1 1 A 141 141 GLU C C 141 177.299 176.119 1.180 1
1 1715 . 10 1 1 A 141 141 GLU CA C 141 57.165 56.039 1.126 1
1 1716 . 10 1 1 A 141 141 GLU CB C 141 30.048 30.248 -0.200 1
1 1718 . 10 1 1 A 141 141 GLU N N 141 119.458 124.134 -4.676 1
1 1719 . 10 1 1 A 142 142 ALA H H 142 8.380 8.370 0.010 1
1 1720 . 10 1 1 A 142 142 ALA HA H 142 4.388 4.398 -0.010 1
1 1724 . 10 1 1 A 142 142 ALA C C 142 178.495 179.202 -0.707 1
1 1725 . 10 1 1 A 142 142 ALA CA C 142 51.113 52.183 -1.070 1
1 1726 . 10 1 1 A 142 142 ALA CB C 142 21.044 19.650 1.394 1
1 1727 . 10 1 1 A 142 142 ALA N N 142 127.330 127.230 0.100 1
1 1728 . 10 1 1 A 143 143 THR H H 143 9.502 8.677 0.825 1
1 1729 . 10 1 1 A 143 143 THR HA H 143 4.362 4.640 -0.278 1
1 1734 . 10 1 1 A 143 143 THR C C 143 175.241 175.311 -0.070 1
1 1735 . 10 1 1 A 143 143 THR CA C 143 60.541 61.417 -0.876 1
1 1736 . 10 1 1 A 143 143 THR CB C 143 70.879 68.439 2.440 1
1 1738 . 10 1 1 A 143 143 THR N N 143 114.561 112.319 2.242 1
1 1739 . 10 1 1 A 144 144 GLU H H 144 8.787 7.972 0.815 1
1 1740 . 10 1 1 A 144 144 GLU HA H 144 3.817 3.791 0.026 1
1 1745 . 10 1 1 A 144 144 GLU C C 144 179.490 176.559 2.931 1
1 1746 . 10 1 1 A 144 144 GLU CA C 144 60.102 58.869 1.233 1
1 1747 . 10 1 1 A 144 144 GLU CB C 144 29.338 27.363 1.975 1
1 1749 . 10 1 1 A 144 144 GLU N N 144 120.475 115.258 5.217 1
1 1750 . 10 1 1 A 145 145 GLU H H 145 8.321 8.693 -0.372 1
1 1751 . 10 1 1 A 145 145 GLU HA H 145 3.899 3.771 0.128 1
1 1756 . 10 1 1 A 145 145 GLU C C 145 178.521 179.244 -0.723 1
1 1757 . 10 1 1 A 145 145 GLU CA C 145 59.588 58.823 0.765 1
1 1758 . 10 1 1 A 145 145 GLU CB C 145 29.658 29.161 0.497 1
1 1760 . 10 1 1 A 145 145 GLU N N 145 119.761 119.145 0.616 1
1 1761 . 10 1 1 A 146 146 GLU H H 146 7.514 7.560 -0.046 1
1 1762 . 10 1 1 A 146 146 GLU HA H 146 3.856 3.842 0.014 1
1 1767 . 10 1 1 A 146 146 GLU C C 146 179.189 179.356 -0.167 1
1 1768 . 10 1 1 A 146 146 GLU CA C 146 59.148 59.022 0.126 1
1 1769 . 10 1 1 A 146 146 GLU CB C 146 29.834 28.847 0.987 1
1 1771 . 10 1 1 A 146 146 GLU N N 146 121.118 120.491 0.627 1
1 1772 . 10 1 1 A 147 147 LEU H H 147 7.823 8.040 -0.217 1
1 1773 . 10 1 1 A 147 147 LEU HA H 147 3.662 3.884 -0.222 1
1 1783 . 10 1 1 A 147 147 LEU C C 147 179.341 178.979 0.362 1
1 1784 . 10 1 1 A 147 147 LEU CA C 147 57.277 57.574 -0.297 1
1 1785 . 10 1 1 A 147 147 LEU CB C 147 41.239 41.522 -0.283 1
1 1789 . 10 1 1 A 147 147 LEU N N 147 117.199 120.535 -3.336 1
1 1790 . 10 1 1 A 148 148 ALA H H 148 7.788 8.459 -0.671 1
1 1791 . 10 1 1 A 148 148 ALA HA H 148 3.958 4.117 -0.159 1
1 1795 . 10 1 1 A 148 148 ALA C C 148 179.777 178.957 0.820 1
1 1796 . 10 1 1 A 148 148 ALA CA C 148 54.509 54.654 -0.145 1
1 1797 . 10 1 1 A 148 148 ALA CB C 148 18.064 18.112 -0.048 1
1 1798 . 10 1 1 A 148 148 ALA N N 148 121.696 120.580 1.116 1
1 1799 . 10 1 1 A 149 149 HIS H H 149 7.726 7.327 0.399 1
1 1800 . 10 1 1 A 149 149 HIS HA H 149 4.477 4.665 -0.188 1
1 1805 . 10 1 1 A 149 149 HIS C C 149 176.099 175.795 0.304 1
1 1806 . 10 1 1 A 149 149 HIS CA C 149 55.802 56.319 -0.517 1
1 1807 . 10 1 1 A 149 149 HIS CB C 149 30.406 30.739 -0.333 1
1 1810 . 10 1 1 A 149 149 HIS N N 149 114.463 113.303 1.160 1
1 1811 . 10 1 1 A 150 150 GLY H H 150 8.076 8.885 -0.809 1
1 1812 . 10 1 1 A 150 150 GLY HA2 H 150 3.927 3.569 0.358 1
1 1813 . 10 1 1 A 150 150 GLY HA3 H 150 3.237 3.907 -0.670 1
1 1814 . 10 1 1 A 150 150 GLY C C 150 173.382 173.591 -0.209 1
1 1815 . 10 1 1 A 150 150 GLY CA C 150 46.117 45.639 0.478 1
1 1816 . 10 1 1 A 150 150 GLY N N 150 109.417 107.564 1.853 1
1 1817 . 10 1 1 A 151 151 HIS H H 151 7.518 7.346 0.172 1
1 1818 . 10 1 1 A 151 151 HIS HA H 151 4.563 5.105 -0.542 1
1 1823 . 10 1 1 A 151 151 HIS C C 151 173.157 173.007 0.150 1
1 1824 . 10 1 1 A 151 151 HIS CA C 151 54.731 54.134 0.597 1
1 1825 . 10 1 1 A 151 151 HIS CB C 151 31.611 31.506 0.105 1
1 1828 . 10 1 1 A 151 151 HIS N N 151 114.828 114.027 0.801 1
1 1829 . 10 1 1 A 152 152 VAL H H 152 7.931 8.967 -1.036 1
1 1830 . 10 1 1 A 152 152 VAL HA H 152 3.951 3.873 0.078 1
1 1838 . 10 1 1 A 152 152 VAL C C 152 175.848 175.655 0.193 1
1 1839 . 10 1 1 A 152 152 VAL CA C 152 62.190 63.483 -1.293 1
1 1840 . 10 1 1 A 152 152 VAL CB C 152 32.703 31.817 0.886 1
1 1843 . 10 1 1 A 152 152 VAL N N 152 118.551 120.601 -2.050 1
1 1844 . 10 1 1 A 153 153 HIS H H 153 9.784 8.799 0.985 1
1 1845 . 10 1 1 A 153 153 HIS HA H 153 4.604 4.420 0.184 1
1 1850 . 10 1 1 A 153 153 HIS C C 153 175.795 174.901 0.894 1
1 1851 . 10 1 1 A 153 153 HIS CA C 153 56.753 58.024 -1.271 1
1 1852 . 10 1 1 A 153 153 HIS CB C 153 30.325 31.359 -1.034 1
1 1855 . 10 1 1 A 153 153 HIS N N 153 127.403 126.954 0.449 1
1 1856 . 10 1 1 A 154 154 GLY H H 154 8.447 7.743 0.704 1
1 1857 . 10 1 1 A 154 154 GLY HA2 H 154 3.797 4.115 -0.318 1
1 1858 . 10 1 1 A 154 154 GLY HA3 H 154 3.797 4.153 -0.356 1
1 1859 . 10 1 1 A 154 154 GLY C C 154 173.848 173.182 0.666 1
1 1860 . 10 1 1 A 154 154 GLY CA C 154 45.153 44.846 0.307 1
1 1861 . 10 1 1 A 154 154 GLY N N 154 112.233 105.994 6.239 1
1 1862 . 10 1 1 A 155 155 ALA H H 155 8.074 8.684 -0.610 1
1 1863 . 10 1 1 A 155 155 ALA HA H 155 4.101 4.567 -0.466 1
1 1867 . 10 1 1 A 155 155 ALA C C 155 177.651 176.306 1.345 1
1 1868 . 10 1 1 A 155 155 ALA CA C 155 52.795 53.450 -0.655 1
1 1869 . 10 1 1 A 155 155 ALA CB C 155 19.258 21.143 -1.885 1
1 1870 . 10 1 1 A 155 155 ALA N N 155 124.092 127.802 -3.710 1
1 1871 . 10 1 1 A 156 156 HIS H H 156 8.201 8.134 0.067 1
1 1872 . 10 1 1 A 156 156 HIS HA H 156 4.474 4.902 -0.428 1
1 1875 . 10 1 1 A 156 156 HIS C C 156 174.758 174.607 0.151 1
1 1876 . 10 1 1 A 156 156 HIS CA C 156 55.756 54.372 1.384 1
1 1877 . 10 1 1 A 156 156 HIS CB C 156 30.060 29.598 0.462 1
1 1878 . 10 1 1 A 156 156 HIS N N 156 118.170 114.111 4.059 1
1 1879 . 10 1 1 A 157 157 ASP H H 157 8.001 8.846 -0.845 1
1 1880 . 10 1 1 A 157 157 ASP HA H 157 4.436 4.436 0.000 1
1 1883 . 10 1 1 A 157 157 ASP CA C 157 54.185 56.380 -2.195 1
1 1884 . 10 1 1 A 157 157 ASP CB C 157 41.016 40.889 0.127 1
1 1885 . 10 1 1 A 157 157 ASP N N 157 121.683 125.404 -3.721 1
1 1886 . 10 1 1 A 160 160 HIS HA H 160 4.502 4.335 0.167 1
1 1889 . 10 1 1 A 160 160 HIS C C 160 174.722 176.663 -1.941 1
1 1890 . 10 1 1 A 160 160 HIS CA C 160 55.979 58.101 -2.122 1
1 1891 . 10 1 1 A 160 160 HIS CB C 160 30.058 30.527 -0.469 1
1 1892 . 10 1 1 A 161 161 ASP H H 161 8.270 8.280 -0.010 1
1 1893 . 10 1 1 A 161 161 ASP HA H 161 4.446 4.166 0.280 1
1 1896 . 10 1 1 A 161 161 ASP C C 161 176.107 176.449 -0.342 1
1 1897 . 10 1 1 A 161 161 ASP CA C 161 54.474 57.027 -2.553 1
1 1898 . 10 1 1 A 161 161 ASP CB C 161 40.820 41.217 -0.397 1
1 1899 . 10 1 1 A 161 161 ASP N N 161 121.957 118.556 3.401 1
1 1900 . 10 1 1 A 162 162 HIS H H 162 8.212 7.783 0.429 1
1 1901 . 10 1 1 A 162 162 HIS HA H 162 4.289 4.684 -0.395 1
1 1904 . 10 1 1 A 162 162 HIS C C 162 175.036 173.885 1.151 1
1 1905 . 10 1 1 A 162 162 HIS CA C 162 56.185 54.800 1.385 1
1 1906 . 10 1 1 A 162 162 HIS CB C 162 30.108 28.131 1.977 1
1 1907 . 10 1 1 A 162 162 HIS N N 162 119.766 115.563 4.203 1
1 1908 . 10 1 1 A 163 163 ASP H H 163 8.163 8.747 -0.584 1
1 1909 . 10 1 1 A 163 163 ASP HA H 163 4.428 4.739 -0.311 1
1 1912 . 10 1 1 A 163 163 ASP C C 163 176.161 176.748 -0.587 1
1 1913 . 10 1 1 A 163 163 ASP CA C 163 54.585 54.627 -0.042 1
1 1914 . 10 1 1 A 163 163 ASP CB C 163 40.823 40.690 0.133 1
1 1915 . 10 1 1 A 163 163 ASP N N 163 121.265 123.560 -2.295 1
1 1916 . 10 1 1 A 164 164 HIS H H 164 8.106 9.060 -0.954 1
1 1917 . 10 1 1 A 164 164 HIS HA H 164 4.422 4.676 -0.254 1
1 1920 . 10 1 1 A 164 164 HIS C C 164 174.904 175.748 -0.844 1
1 1921 . 10 1 1 A 164 164 HIS CA C 164 56.361 55.243 1.118 1
1 1922 . 10 1 1 A 164 164 HIS CB C 164 30.305 29.038 1.267 1
1 1923 . 10 1 1 A 164 164 HIS N N 164 119.729 120.387 -0.658 1
1 1924 . 10 1 1 A 165 165 ASP H H 165 8.118 8.260 -0.142 1
1 1925 . 10 1 1 A 165 165 ASP HA H 165 4.394 4.214 0.180 1
1 1928 . 10 1 1 A 165 165 ASP C C 165 176.054 176.948 -0.894 1
1 1929 . 10 1 1 A 165 165 ASP CA C 165 54.364 57.560 -3.196 1
1 1930 . 10 1 1 A 165 165 ASP CB C 165 40.818 41.742 -0.924 1
1 1931 . 10 1 1 A 165 165 ASP N N 165 121.062 121.134 -0.072 1
1 1932 . 10 1 1 A 166 166 HIS H H 166 8.092 8.132 -0.040 1
1 1933 . 10 1 1 A 166 166 HIS CA C 166 56.114 55.207 0.907 1
1 1934 . 10 1 1 A 166 166 HIS CB C 166 29.702 28.218 1.484 1
1 1935 . 10 1 1 A 166 166 HIS N N 166 120.001 116.171 3.830 1
1 1936 . 10 1 1 A 170 170 HIS HA H 170 4.514 3.987 0.527 1
1 1939 . 10 1 1 A 170 170 HIS C C 170 173.952 173.608 0.344 1
1 1940 . 10 1 1 A 170 170 HIS CA C 170 55.995 56.723 -0.728 1
1 1941 . 10 1 1 A 170 170 HIS CB C 170 30.161 28.353 1.808 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 156 0.955 1
2 1 1 1 "RMS(OBS, PRED)" CA 164 1.034 1
3 1 1 1 "RMS(OBS, PRED)" CB 149 1.233 1
4 1 1 1 "RMS(OBS, PRED)" H 157 0.562 1
5 1 1 1 "RMS(OBS, PRED)" HA 178 0.366 1
6 1 1 1 "RMS(OBS, PRED)" N 156 3.292 1
7 1 2 1 "RMS(OBS, PRED)" C 156 1.025 1
8 1 2 1 "RMS(OBS, PRED)" CA 164 1.216 1
9 1 2 1 "RMS(OBS, PRED)" CB 149 1.268 1
10 1 2 1 "RMS(OBS, PRED)" H 157 0.575 1
11 1 2 1 "RMS(OBS, PRED)" HA 178 0.357 1
12 1 2 1 "RMS(OBS, PRED)" N 156 3.340 1
13 1 3 1 "RMS(OBS, PRED)" C 156 0.986 1
14 1 3 1 "RMS(OBS, PRED)" CA 164 1.114 1
15 1 3 1 "RMS(OBS, PRED)" CB 149 1.266 1
16 1 3 1 "RMS(OBS, PRED)" H 157 0.561 1
17 1 3 1 "RMS(OBS, PRED)" HA 178 0.364 1
18 1 3 1 "RMS(OBS, PRED)" N 156 3.219 1
19 1 4 1 "RMS(OBS, PRED)" C 156 1.057 1
20 1 4 1 "RMS(OBS, PRED)" CA 164 1.200 1
21 1 4 1 "RMS(OBS, PRED)" CB 149 1.246 1
22 1 4 1 "RMS(OBS, PRED)" H 157 0.553 1
23 1 4 1 "RMS(OBS, PRED)" HA 178 0.397 1
24 1 4 1 "RMS(OBS, PRED)" N 156 3.197 1
25 1 5 1 "RMS(OBS, PRED)" C 156 0.999 1
26 1 5 1 "RMS(OBS, PRED)" CA 164 1.273 1
27 1 5 1 "RMS(OBS, PRED)" CB 149 1.226 1
28 1 5 1 "RMS(OBS, PRED)" H 157 0.591 1
29 1 5 1 "RMS(OBS, PRED)" HA 178 0.384 1
30 1 5 1 "RMS(OBS, PRED)" N 156 3.211 1
31 1 6 1 "RMS(OBS, PRED)" C 156 1.044 1
32 1 6 1 "RMS(OBS, PRED)" CA 164 1.236 1
33 1 6 1 "RMS(OBS, PRED)" CB 149 1.225 1
34 1 6 1 "RMS(OBS, PRED)" H 157 0.616 1
35 1 6 1 "RMS(OBS, PRED)" HA 178 0.393 1
36 1 6 1 "RMS(OBS, PRED)" N 156 3.254 1
37 1 7 1 "RMS(OBS, PRED)" C 156 1.025 1
38 1 7 1 "RMS(OBS, PRED)" CA 164 1.140 1
39 1 7 1 "RMS(OBS, PRED)" CB 149 1.266 1
40 1 7 1 "RMS(OBS, PRED)" H 157 0.555 1
41 1 7 1 "RMS(OBS, PRED)" HA 178 0.372 1
42 1 7 1 "RMS(OBS, PRED)" N 156 3.180 1
43 1 8 1 "RMS(OBS, PRED)" C 156 1.020 1
44 1 8 1 "RMS(OBS, PRED)" CA 164 1.238 1
45 1 8 1 "RMS(OBS, PRED)" CB 149 1.295 1
46 1 8 1 "RMS(OBS, PRED)" H 157 0.600 1
47 1 8 1 "RMS(OBS, PRED)" HA 178 0.395 1
48 1 8 1 "RMS(OBS, PRED)" N 156 3.076 1
49 1 9 1 "RMS(OBS, PRED)" C 156 1.051 1
50 1 9 1 "RMS(OBS, PRED)" CA 164 1.215 1
51 1 9 1 "RMS(OBS, PRED)" CB 149 1.259 1
52 1 9 1 "RMS(OBS, PRED)" H 157 0.579 1
53 1 9 1 "RMS(OBS, PRED)" HA 178 0.374 1
54 1 9 1 "RMS(OBS, PRED)" N 156 3.333 1
55 1 10 1 "RMS(OBS, PRED)" C 156 0.986 1
56 1 10 1 "RMS(OBS, PRED)" CA 164 1.235 1
57 1 10 1 "RMS(OBS, PRED)" CB 149 1.303 1
58 1 10 1 "RMS(OBS, PRED)" H 157 0.580 1
59 1 10 1 "RMS(OBS, PRED)" HA 178 0.369 1
60 1 10 1 "RMS(OBS, PRED)" N 156 3.265 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 14 . 1 1 A 2 2 LYS H H 2 7.540 8.822 -1.282 2
1 15 . 1 1 A 2 2 LYS HA H 2 4.729 4.978 -0.249 2
1 24 . 1 1 A 2 2 LYS C C 2 175.948 175.327 0.620 2
1 25 . 1 1 A 2 2 LYS CA C 2 53.978 54.468 -0.490 2
1 26 . 1 1 A 2 2 LYS CB C 2 35.985 35.166 0.819 2
1 30 . 1 1 A 2 2 LYS N N 2 120.764 119.985 0.779 2
1 31 . 1 1 A 3 3 VAL H H 3 8.738 8.358 0.379 2
1 32 . 1 1 A 3 3 VAL HA H 3 2.800 4.347 -1.547 2
1 40 . 1 1 A 3 3 VAL C C 3 175.018 175.114 -0.096 2
1 41 . 1 1 A 3 3 VAL CA C 3 66.598 62.029 4.569 2
1 42 . 1 1 A 3 3 VAL CB C 3 31.218 32.227 -1.009 2
1 45 . 1 1 A 3 3 VAL N N 3 120.055 121.721 -1.666 2
1 46 . 1 1 A 4 4 ALA H H 4 6.584 8.761 -2.177 2
1 47 . 1 1 A 4 4 ALA HA H 4 4.223 4.614 -0.391 2
1 51 . 1 1 A 4 4 ALA C C 4 174.117 175.473 -1.356 2
1 52 . 1 1 A 4 4 ALA CA C 4 50.358 50.888 -0.530 2
1 53 . 1 1 A 4 4 ALA CB C 4 22.137 22.944 -0.807 2
1 54 . 1 1 A 4 4 ALA N N 4 129.800 130.252 -0.452 2
1 55 . 1 1 A 5 5 LYS H H 5 8.596 8.497 0.099 2
1 56 . 1 1 A 5 5 LYS HA H 5 3.793 4.135 -0.342 2
1 65 . 1 1 A 5 5 LYS C C 5 175.260 177.038 -1.779 2
1 66 . 1 1 A 5 5 LYS CA C 5 57.700 57.351 0.349 2
1 67 . 1 1 A 5 5 LYS CB C 5 32.400 32.655 -0.255 2
1 71 . 1 1 A 5 5 LYS N N 5 118.708 120.022 -1.314 2
1 72 . 1 1 A 6 6 ASP H H 6 8.679 8.933 -0.254 2
1 73 . 1 1 A 6 6 ASP HA H 6 4.040 4.433 -0.393 2
1 76 . 1 1 A 6 6 ASP C C 6 173.331 175.330 -1.999 2
1 77 . 1 1 A 6 6 ASP CA C 6 57.508 55.584 1.924 2
1 78 . 1 1 A 6 6 ASP CB C 6 37.604 39.241 -1.637 2
1 79 . 1 1 A 6 6 ASP N N 6 115.415 122.886 -7.471 2
1 80 . 1 1 A 7 7 LEU H H 7 7.376 7.682 -0.306 2
1 81 . 1 1 A 7 7 LEU HA H 7 4.689 4.427 0.262 2
1 91 . 1 1 A 7 7 LEU C C 7 175.906 175.814 0.092 2
1 92 . 1 1 A 7 7 LEU CA C 7 53.509 53.834 -0.325 2
1 93 . 1 1 A 7 7 LEU CB C 7 42.419 41.991 0.428 2
1 97 . 1 1 A 7 7 LEU N N 7 117.619 121.299 -3.680 2
1 98 . 1 1 A 8 8 VAL H H 8 8.646 8.709 -0.063 2
1 99 . 1 1 A 8 8 VAL HA H 8 4.397 4.284 0.113 2
1 107 . 1 1 A 8 8 VAL C C 8 175.244 175.072 0.172 2
1 108 . 1 1 A 8 8 VAL CA C 8 62.028 62.327 -0.299 2
1 109 . 1 1 A 8 8 VAL CB C 8 31.515 32.791 -1.276 2
1 112 . 1 1 A 8 8 VAL N N 8 121.164 125.850 -4.686 2
1 113 . 1 1 A 9 9 VAL H H 9 8.607 8.447 0.160 2
1 114 . 1 1 A 9 9 VAL HA H 9 4.281 4.910 -0.629 2
1 122 . 1 1 A 9 9 VAL C C 9 174.156 174.287 -0.131 2
1 123 . 1 1 A 9 9 VAL CA C 9 60.614 59.435 1.179 2
1 124 . 1 1 A 9 9 VAL CB C 9 33.985 35.930 -1.945 2
1 127 . 1 1 A 9 9 VAL N N 9 134.014 124.133 9.881 2
1 128 . 1 1 A 10 10 SER H H 10 8.684 8.749 -0.065 2
1 129 . 1 1 A 10 10 SER HA H 10 5.736 5.547 0.189 2
1 132 . 1 1 A 10 10 SER C C 10 173.544 173.577 -0.032 2
1 133 . 1 1 A 10 10 SER CA C 10 56.533 57.800 -1.267 2
1 134 . 1 1 A 10 10 SER CB C 10 63.385 64.474 -1.089 2
1 135 . 1 1 A 10 10 SER N N 10 121.492 121.056 0.436 2
1 136 . 1 1 A 11 11 LEU H H 11 9.939 8.957 0.982 2
1 137 . 1 1 A 11 11 LEU HA H 11 5.133 5.246 -0.113 2
1 147 . 1 1 A 11 11 LEU C C 11 174.843 174.938 -0.095 2
1 148 . 1 1 A 11 11 LEU CA C 11 53.770 53.373 0.397 2
1 149 . 1 1 A 11 11 LEU CB C 11 47.469 46.329 1.140 2
1 153 . 1 1 A 11 11 LEU N N 11 128.460 123.083 5.377 2
1 154 . 1 1 A 12 12 ALA H H 12 8.770 9.281 -0.511 2
1 155 . 1 1 A 12 12 ALA HA H 12 4.830 5.363 -0.533 2
1 159 . 1 1 A 12 12 ALA C C 12 176.974 175.859 1.115 2
1 160 . 1 1 A 12 12 ALA CA C 12 50.231 50.513 -0.282 2
1 161 . 1 1 A 12 12 ALA CB C 12 21.270 21.743 -0.473 2
1 162 . 1 1 A 12 12 ALA N N 12 127.500 123.144 4.356 2
1 163 . 1 1 A 13 13 TYR H H 13 8.749 8.652 0.097 2
1 164 . 1 1 A 13 13 TYR HA H 13 5.797 5.886 -0.089 2
1 171 . 1 1 A 13 13 TYR C C 13 173.952 172.590 1.362 2
1 172 . 1 1 A 13 13 TYR CA C 13 56.390 55.658 0.732 2
1 173 . 1 1 A 13 13 TYR CB C 13 41.159 41.424 -0.265 2
1 176 . 1 1 A 13 13 TYR N N 13 117.737 117.966 -0.229 2
1 177 . 1 1 A 14 14 GLN H H 14 8.492 8.634 -0.142 2
1 178 . 1 1 A 14 14 GLN HA H 14 4.611 5.080 -0.469 2
1 185 . 1 1 A 14 14 GLN C C 14 174.492 173.880 0.612 2
1 186 . 1 1 A 14 14 GLN CA C 14 55.626 54.453 1.173 2
1 187 . 1 1 A 14 14 GLN CB C 14 32.734 31.983 0.751 2
1 189 . 1 1 A 14 14 GLN N N 14 116.962 120.279 -3.317 2
1 191 . 1 1 A 15 15 VAL H H 15 8.403 9.255 -0.852 2
1 192 . 1 1 A 15 15 VAL HA H 15 4.614 5.167 -0.553 2
1 200 . 1 1 A 15 15 VAL C C 15 173.389 174.958 -1.569 2
1 201 . 1 1 A 15 15 VAL CA C 15 59.711 60.766 -1.055 2
1 202 . 1 1 A 15 15 VAL CB C 15 33.639 33.798 -0.160 2
1 205 . 1 1 A 15 15 VAL N N 15 121.203 127.149 -5.946 2
1 206 . 1 1 A 16 16 ARG H H 16 8.584 9.241 -0.657 2
1 207 . 1 1 A 16 16 ARG HA H 16 5.584 5.088 0.496 2
1 214 . 1 1 A 16 16 ARG C C 16 176.585 175.093 1.492 2
1 215 . 1 1 A 16 16 ARG CA C 16 53.453 54.071 -0.618 2
1 216 . 1 1 A 16 16 ARG CB C 16 34.968 33.822 1.146 2
1 219 . 1 1 A 16 16 ARG N N 16 126.883 126.776 0.107 2
1 220 . 1 1 A 17 17 THR H H 17 8.270 8.482 -0.212 2
1 221 . 1 1 A 17 17 THR HA H 17 4.573 4.622 -0.049 2
1 226 . 1 1 A 17 17 THR C C 17 177.860 176.139 1.721 2
1 227 . 1 1 A 17 17 THR CA C 17 61.073 60.655 0.418 2
1 228 . 1 1 A 17 17 THR CB C 17 69.823 71.581 -1.758 2
1 230 . 1 1 A 17 17 THR N N 17 109.730 113.168 -3.438 2
1 231 . 1 1 A 18 18 GLU H H 18 9.147 8.862 0.285 2
1 232 . 1 1 A 18 18 GLU HA H 18 3.770 4.016 -0.246 2
1 237 . 1 1 A 18 18 GLU C C 18 176.683 177.973 -1.290 2
1 238 . 1 1 A 18 18 GLU CA C 18 59.866 59.340 0.526 2
1 239 . 1 1 A 18 18 GLU CB C 18 29.752 29.182 0.570 2
1 241 . 1 1 A 18 18 GLU N N 18 122.491 120.988 1.503 2
1 242 . 1 1 A 19 19 ASP H H 19 7.900 7.830 0.070 2
1 243 . 1 1 A 19 19 ASP HA H 19 4.456 4.666 -0.210 2
1 246 . 1 1 A 19 19 ASP C C 19 176.670 176.300 0.370 2
1 247 . 1 1 A 19 19 ASP CA C 19 53.833 54.196 -0.363 2
1 248 . 1 1 A 19 19 ASP CB C 19 40.180 41.245 -1.066 2
1 249 . 1 1 A 19 19 ASP N N 19 116.200 117.483 -1.283 2
1 250 . 1 1 A 20 20 GLY H H 20 8.149 7.970 0.179 2
1 251 . 1 1 A 20 20 GLY HA2 H 20 4.145 3.950 0.196 2
1 252 . 1 1 A 20 20 GLY HA3 H 20 3.531 3.957 -0.426 2
1 253 . 1 1 A 20 20 GLY C C 20 173.987 174.286 -0.299 2
1 254 . 1 1 A 20 20 GLY CA C 20 45.463 45.187 0.276 2
1 255 . 1 1 A 20 20 GLY N N 20 108.869 107.162 1.707 2
1 256 . 1 1 A 21 21 VAL H H 21 7.261 7.735 -0.474 2
1 257 . 1 1 A 21 21 VAL HA H 21 3.645 4.167 -0.522 2
1 265 . 1 1 A 21 21 VAL C C 21 175.265 174.923 0.342 2
1 266 . 1 1 A 21 21 VAL CA C 21 63.368 61.903 1.465 2
1 267 . 1 1 A 21 21 VAL CB C 21 31.614 32.551 -0.937 2
1 270 . 1 1 A 21 21 VAL N N 21 124.283 121.834 2.449 2
1 271 . 1 1 A 22 22 LEU H H 22 8.407 8.467 -0.060 2
1 272 . 1 1 A 22 22 LEU HA H 22 4.333 4.455 -0.122 2
1 282 . 1 1 A 22 22 LEU C C 22 176.660 176.672 -0.012 2
1 283 . 1 1 A 22 22 LEU CA C 22 55.724 55.546 0.178 2
1 284 . 1 1 A 22 22 LEU CB C 22 42.272 42.507 -0.235 2
1 288 . 1 1 A 22 22 LEU N N 22 128.533 129.028 -0.495 2
1 289 . 1 1 A 23 23 VAL H H 23 8.887 9.035 -0.148 2
1 290 . 1 1 A 23 23 VAL HA H 23 4.237 4.353 -0.116 2
1 298 . 1 1 A 23 23 VAL C C 23 175.265 175.487 -0.222 2
1 299 . 1 1 A 23 23 VAL CA C 23 62.348 62.401 -0.053 2
1 300 . 1 1 A 23 23 VAL CB C 23 33.383 33.228 0.155 2
1 303 . 1 1 A 23 23 VAL N N 23 125.041 122.006 3.035 2
1 304 . 1 1 A 24 24 ASP H H 24 7.480 7.508 -0.028 2
1 305 . 1 1 A 24 24 ASP HA H 24 4.763 5.042 -0.279 2
1 308 . 1 1 A 24 24 ASP C C 24 173.160 173.906 -0.746 2
1 309 . 1 1 A 24 24 ASP CA C 24 53.893 53.548 0.345 2
1 310 . 1 1 A 24 24 ASP CB C 24 43.680 44.304 -0.624 2
1 311 . 1 1 A 24 24 ASP N N 24 117.159 120.207 -3.049 2
1 312 . 1 1 A 25 25 GLU H H 25 8.187 8.694 -0.507 2
1 313 . 1 1 A 25 25 GLU HA H 25 4.491 4.647 -0.156 2
1 318 . 1 1 A 25 25 GLU C C 25 174.586 173.853 0.733 2
1 319 . 1 1 A 25 25 GLU CA C 25 55.475 55.787 -0.312 2
1 320 . 1 1 A 25 25 GLU CB C 25 33.033 33.955 -0.922 2
1 322 . 1 1 A 25 25 GLU N N 25 118.821 122.193 -3.372 2
1 323 . 1 1 A 26 26 SER H H 26 8.003 8.477 -0.474 2
1 324 . 1 1 A 26 26 SER HA H 26 4.782 4.837 -0.055 2
1 327 . 1 1 A 26 26 SER CA C 26 56.490 55.114 1.376 2
1 328 . 1 1 A 26 26 SER CB C 26 64.977 64.216 0.761 2
1 329 . 1 1 A 26 26 SER N N 26 119.346 121.477 -2.131 2
1 330 . 1 1 A 27 27 PRO HA H 27 4.633 4.607 0.026 2
1 337 . 1 1 A 27 27 PRO C C 27 177.016 177.320 -0.304 2
1 338 . 1 1 A 27 27 PRO CA C 27 61.943 62.636 -0.693 2
1 339 . 1 1 A 27 27 PRO CB C 27 32.492 33.038 -0.546 2
1 342 . 1 1 A 28 28 VAL H H 28 8.383 8.653 -0.270 2
1 343 . 1 1 A 28 28 VAL HA H 28 3.385 3.793 -0.409 2
1 351 . 1 1 A 28 28 VAL C C 28 176.069 177.208 -1.139 2
1 352 . 1 1 A 28 28 VAL CA C 28 65.888 64.968 0.920 2
1 353 . 1 1 A 28 28 VAL CB C 28 31.220 31.630 -0.410 2
1 356 . 1 1 A 28 28 VAL N N 28 119.349 122.541 -3.192 2
1 357 . 1 1 A 29 29 SER H H 29 7.365 7.795 -0.430 2
1 358 . 1 1 A 29 29 SER HA H 29 4.101 4.348 -0.247 2
1 361 . 1 1 A 29 29 SER C C 29 174.535 174.657 -0.122 2
1 362 . 1 1 A 29 29 SER CA C 29 58.609 60.232 -1.623 2
1 363 . 1 1 A 29 29 SER CB C 29 63.198 63.568 -0.370 2
1 364 . 1 1 A 29 29 SER N N 29 109.365 114.268 -4.903 2
1 365 . 1 1 A 30 30 ALA H H 30 7.457 7.704 -0.247 2
1 366 . 1 1 A 30 30 ALA HA H 30 4.548 4.719 -0.171 2
1 370 . 1 1 A 30 30 ALA CA C 30 50.789 49.306 1.483 2
1 371 . 1 1 A 30 30 ALA CB C 30 18.608 21.268 -2.660 2
1 372 . 1 1 A 30 30 ALA N N 30 126.056 122.405 3.651 2
1 373 . 1 1 A 31 31 PRO HA H 31 4.332 4.700 -0.368 2
1 380 . 1 1 A 31 31 PRO C C 31 175.841 176.184 -0.343 2
1 381 . 1 1 A 31 31 PRO CA C 31 62.996 62.461 0.535 2
1 382 . 1 1 A 31 31 PRO CB C 31 32.696 32.599 0.097 2
1 385 . 1 1 A 32 32 LEU H H 32 8.717 9.109 -0.392 2
1 386 . 1 1 A 32 32 LEU HA H 32 4.452 4.760 -0.308 2
1 396 . 1 1 A 32 32 LEU C C 32 175.298 174.917 0.381 2
1 397 . 1 1 A 32 32 LEU CA C 32 54.510 54.850 -0.340 2
1 398 . 1 1 A 32 32 LEU CB C 32 43.899 43.712 0.187 2
1 402 . 1 1 A 32 32 LEU N N 32 123.702 122.484 1.218 2
1 403 . 1 1 A 33 33 ASP H H 33 8.258 8.855 -0.598 2
1 404 . 1 1 A 33 33 ASP HA H 33 5.919 5.463 0.456 2
1 407 . 1 1 A 33 33 ASP C C 33 175.927 174.786 1.141 2
1 408 . 1 1 A 33 33 ASP CA C 33 52.619 52.898 -0.278 2
1 409 . 1 1 A 33 33 ASP CB C 33 42.205 43.083 -0.878 2
1 410 . 1 1 A 33 33 ASP N N 33 128.453 125.836 2.617 2
1 411 . 1 1 A 34 34 TYR H H 34 9.144 8.440 0.704 2
1 412 . 1 1 A 34 34 TYR HA H 34 4.689 5.232 -0.543 2
1 419 . 1 1 A 34 34 TYR C C 34 170.622 173.200 -2.578 2
1 420 . 1 1 A 34 34 TYR CA C 34 55.930 56.236 -0.306 2
1 421 . 1 1 A 34 34 TYR CB C 34 41.905 41.865 0.040 2
1 424 . 1 1 A 34 34 TYR N N 34 121.657 119.710 1.947 2
1 425 . 1 1 A 35 35 LEU H H 35 8.324 8.691 -0.367 2
1 426 . 1 1 A 35 35 LEU HA H 35 4.396 4.879 -0.483 2
1 436 . 1 1 A 35 35 LEU C C 35 175.301 176.117 -0.816 2
1 437 . 1 1 A 35 35 LEU CA C 35 52.909 53.689 -0.780 2
1 438 . 1 1 A 35 35 LEU CB C 35 42.816 43.877 -1.060 2
1 442 . 1 1 A 35 35 LEU N N 35 124.514 123.491 1.023 2
1 443 . 1 1 A 36 36 HIS H H 36 8.763 8.539 0.224 2
1 444 . 1 1 A 36 36 HIS HA H 36 4.382 4.572 -0.190 2
1 449 . 1 1 A 36 36 HIS C C 36 176.514 176.401 0.113 2
1 450 . 1 1 A 36 36 HIS CA C 36 59.570 57.829 1.741 2
1 451 . 1 1 A 36 36 HIS CB C 36 31.257 29.627 1.630 2
1 454 . 1 1 A 36 36 HIS N N 36 132.209 126.587 5.622 2
1 455 . 1 1 A 37 37 GLY H H 37 8.745 8.690 0.055 2
1 456 . 1 1 A 37 37 GLY HA2 H 37 4.021 3.814 0.207 2
1 457 . 1 1 A 37 37 GLY HA3 H 37 3.592 3.948 -0.356 2
1 458 . 1 1 A 37 37 GLY C C 37 175.081 174.257 0.824 2
1 459 . 1 1 A 37 37 GLY CA C 37 45.621 45.596 0.025 2
1 460 . 1 1 A 37 37 GLY N N 37 117.737 114.960 2.777 2
1 461 . 1 1 A 38 38 HIS H H 38 8.470 8.026 0.444 2
1 462 . 1 1 A 38 38 HIS HA H 38 4.584 4.728 -0.144 2
1 467 . 1 1 A 38 38 HIS C C 38 175.334 174.964 0.370 2
1 468 . 1 1 A 38 38 HIS CA C 38 55.899 55.875 0.024 2
1 469 . 1 1 A 38 38 HIS CB C 38 30.865 31.047 -0.182 2
1 472 . 1 1 A 38 38 HIS N N 38 119.813 116.850 2.963 2
1 473 . 1 1 A 39 39 GLY H H 39 8.936 7.705 1.231 2
1 474 . 1 1 A 39 39 GLY HA2 H 39 3.895 3.901 -0.006 2
1 475 . 1 1 A 39 39 GLY HA3 H 39 3.895 3.950 -0.054 2
1 476 . 1 1 A 39 39 GLY C C 39 175.557 174.556 1.001 2
1 477 . 1 1 A 39 39 GLY CA C 39 46.938 45.740 1.198 2
1 478 . 1 1 A 39 39 GLY N N 39 112.442 108.134 4.308 2
1 479 . 1 1 A 40 40 SER H H 40 9.249 8.234 1.015 2
1 480 . 1 1 A 40 40 SER HA H 40 4.299 4.407 -0.108 2
1 483 . 1 1 A 40 40 SER C C 40 174.138 174.588 -0.450 2
1 484 . 1 1 A 40 40 SER CA C 40 60.809 60.251 0.558 2
1 485 . 1 1 A 40 40 SER CB C 40 64.041 64.190 -0.149 2
1 486 . 1 1 A 40 40 SER N N 40 117.098 116.702 0.396 2
1 487 . 1 1 A 41 41 LEU H H 41 7.386 7.474 -0.088 2
1 488 . 1 1 A 41 41 LEU HA H 41 4.429 4.293 0.136 2
1 498 . 1 1 A 41 41 LEU C C 41 176.526 175.890 0.636 2
1 499 . 1 1 A 41 41 LEU CA C 41 52.295 54.510 -2.215 2
1 500 . 1 1 A 41 41 LEU CB C 41 44.147 42.415 1.732 2
1 504 . 1 1 A 41 41 LEU N N 41 120.541 116.262 4.279 2
1 505 . 1 1 A 42 42 ILE H H 42 7.407 7.946 -0.539 2
1 506 . 1 1 A 42 42 ILE HA H 42 3.756 4.155 -0.399 2
1 516 . 1 1 A 42 42 ILE C C 42 178.081 176.549 1.532 2
1 517 . 1 1 A 42 42 ILE CA C 42 62.257 60.286 1.971 2
1 518 . 1 1 A 42 42 ILE CB C 42 38.256 38.790 -0.534 2
1 522 . 1 1 A 42 42 ILE N N 42 115.050 118.717 -3.667 2
1 523 . 1 1 A 43 43 SER H H 43 8.581 8.790 -0.209 2
1 524 . 1 1 A 43 43 SER HA H 43 3.957 4.184 -0.227 2
1 527 . 1 1 A 43 43 SER C C 43 177.830 176.788 1.042 2
1 528 . 1 1 A 43 43 SER CA C 43 61.958 61.405 0.553 2
1 529 . 1 1 A 43 43 SER CB C 43 62.680 62.917 -0.237 2
1 530 . 1 1 A 43 43 SER N N 43 121.456 118.548 2.908 2
1 531 . 1 1 A 44 44 GLY H H 44 8.892 8.411 0.481 2
1 532 . 1 1 A 44 44 GLY HA2 H 44 3.514 3.803 -0.289 2
1 533 . 1 1 A 44 44 GLY HA3 H 44 3.854 3.814 0.040 2
1 534 . 1 1 A 44 44 GLY C C 44 175.296 175.512 -0.216 2
1 535 . 1 1 A 44 44 GLY CA C 44 46.854 47.236 -0.382 2
1 536 . 1 1 A 44 44 GLY N N 44 106.351 108.755 -2.404 2
1 537 . 1 1 A 45 45 LEU H H 45 6.824 7.903 -1.079 2
1 538 . 1 1 A 45 45 LEU HA H 45 3.909 4.081 -0.172 2
1 548 . 1 1 A 45 45 LEU C C 45 176.738 178.571 -1.833 2
1 549 . 1 1 A 45 45 LEU CA C 45 56.356 57.137 -0.781 2
1 550 . 1 1 A 45 45 LEU CB C 45 42.296 41.212 1.084 2
1 554 . 1 1 A 45 45 LEU N N 45 119.207 122.980 -3.773 2
1 555 . 1 1 A 46 46 GLU H H 46 7.556 8.133 -0.577 2
1 556 . 1 1 A 46 46 GLU HA H 46 3.664 4.070 -0.406 2
1 561 . 1 1 A 46 46 GLU C C 46 179.231 179.558 -0.327 2
1 562 . 1 1 A 46 46 GLU CA C 46 62.316 59.696 2.620 2
1 563 . 1 1 A 46 46 GLU CB C 46 29.147 29.136 0.011 2
1 565 . 1 1 A 46 46 GLU N N 46 119.049 118.301 0.748 2
1 566 . 1 1 A 47 47 THR H H 47 8.219 8.039 0.180 2
1 567 . 1 1 A 47 47 THR HA H 47 3.965 3.976 -0.011 2
1 572 . 1 1 A 47 47 THR C C 47 176.251 176.394 -0.143 2
1 573 . 1 1 A 47 47 THR CA C 47 65.947 66.269 -0.322 2
1 574 . 1 1 A 47 47 THR CB C 47 69.014 68.353 0.661 2
1 576 . 1 1 A 47 47 THR N N 47 111.770 117.551 -5.781 2
1 577 . 1 1 A 48 48 ALA H H 48 6.794 7.947 -1.153 2
1 578 . 1 1 A 48 48 ALA HA H 48 4.171 4.197 -0.026 2
1 582 . 1 1 A 48 48 ALA C C 48 178.639 180.347 -1.708 2
1 583 . 1 1 A 48 48 ALA CA C 48 54.072 55.180 -1.108 2
1 584 . 1 1 A 48 48 ALA CB C 48 19.752 18.457 1.295 2
1 585 . 1 1 A 48 48 ALA N N 48 122.697 123.568 -0.871 2
1 586 . 1 1 A 49 49 LEU H H 49 7.691 8.584 -0.893 2
1 587 . 1 1 A 49 49 LEU HA H 49 3.902 4.424 -0.522 2
1 597 . 1 1 A 49 49 LEU C C 49 176.823 177.772 -0.949 2
1 598 . 1 1 A 49 49 LEU CA C 49 57.190 57.986 -0.796 2
1 599 . 1 1 A 49 49 LEU CB C 49 43.628 41.568 2.060 2
1 603 . 1 1 A 49 49 LEU N N 49 117.159 118.020 -0.861 2
1 604 . 1 1 A 50 50 GLU H H 50 6.963 7.802 -0.839 2
1 605 . 1 1 A 50 50 GLU HA H 50 3.220 4.082 -0.862 2
1 610 . 1 1 A 50 50 GLU C C 50 176.691 177.421 -0.730 2
1 611 . 1 1 A 50 50 GLU CA C 50 58.769 58.520 0.249 2
1 612 . 1 1 A 50 50 GLU CB C 50 29.792 29.725 0.067 2
1 614 . 1 1 A 50 50 GLU N N 50 118.761 119.540 -0.779 2
1 615 . 1 1 A 51 51 GLY H H 51 8.541 8.398 0.143 2
1 616 . 1 1 A 51 51 GLY HA2 H 51 4.140 3.857 0.283 2
1 617 . 1 1 A 51 51 GLY HA3 H 51 3.488 3.911 -0.423 2
1 618 . 1 1 A 51 51 GLY C C 51 173.801 173.919 -0.118 2
1 619 . 1 1 A 51 51 GLY CA C 51 45.498 45.286 0.212 2
1 620 . 1 1 A 51 51 GLY N N 51 113.511 111.951 1.560 2
1 621 . 1 1 A 52 52 HIS H H 52 7.656 7.452 0.204 2
1 622 . 1 1 A 52 52 HIS HA H 52 4.318 4.856 -0.538 2
1 627 . 1 1 A 52 52 HIS C C 52 172.815 173.895 -1.080 2
1 628 . 1 1 A 52 52 HIS CA C 52 57.562 55.000 2.562 2
1 629 . 1 1 A 52 52 HIS CB C 52 28.670 32.167 -3.497 2
1 632 . 1 1 A 52 52 HIS N N 52 116.844 117.510 -0.666 2
1 633 . 1 1 A 53 53 GLU H H 53 8.331 8.951 -0.620 2
1 634 . 1 1 A 53 53 GLU HA H 53 4.636 4.823 -0.187 2
1 639 . 1 1 A 53 53 GLU C C 53 176.145 176.089 0.056 2
1 640 . 1 1 A 53 53 GLU CA C 53 54.891 54.540 0.351 2
1 641 . 1 1 A 53 53 GLU CB C 53 33.837 33.129 0.708 2
1 643 . 1 1 A 53 53 GLU N N 53 118.873 119.189 -0.316 2
1 644 . 1 1 A 54 54 VAL H H 54 8.585 8.410 0.175 2
1 645 . 1 1 A 54 54 VAL HA H 54 3.227 4.007 -0.780 2
1 653 . 1 1 A 54 54 VAL C C 54 177.218 176.511 0.707 2
1 654 . 1 1 A 54 54 VAL CA C 54 65.848 63.514 2.334 2
1 655 . 1 1 A 54 54 VAL CB C 54 31.189 31.491 -0.302 2
1 658 . 1 1 A 54 54 VAL N N 54 120.580 121.019 -0.439 2
1 659 . 1 1 A 55 55 GLY H H 55 8.912 9.359 -0.447 2
1 660 . 1 1 A 55 55 GLY HA2 H 55 4.441 4.040 0.401 2
1 661 . 1 1 A 55 55 GLY HA3 H 55 3.865 4.042 -0.177 2
1 662 . 1 1 A 55 55 GLY C C 55 174.827 173.967 0.860 2
1 663 . 1 1 A 55 55 GLY CA C 55 44.370 44.881 -0.511 2
1 664 . 1 1 A 55 55 GLY N N 55 118.078 115.161 2.917 2
1 665 . 1 1 A 56 56 ASP H H 56 8.098 7.819 0.279 2
1 666 . 1 1 A 56 56 ASP HA H 56 4.547 4.697 -0.149 2
1 669 . 1 1 A 56 56 ASP C C 56 174.859 175.084 -0.225 2
1 670 . 1 1 A 56 56 ASP CA C 56 55.629 54.622 1.007 2
1 671 . 1 1 A 56 56 ASP CB C 56 40.906 41.599 -0.693 2
1 672 . 1 1 A 56 56 ASP N N 56 123.094 121.990 1.105 2
1 673 . 1 1 A 57 57 LYS H H 57 8.168 8.627 -0.459 2
1 674 . 1 1 A 57 57 LYS HA H 57 5.471 5.906 -0.435 2
1 683 . 1 1 A 57 57 LYS C C 57 175.732 175.028 0.704 2
1 684 . 1 1 A 57 57 LYS CA C 57 55.056 55.196 -0.140 2
1 685 . 1 1 A 57 57 LYS CB C 57 35.302 35.989 -0.687 2
1 689 . 1 1 A 57 57 LYS N N 57 122.301 123.827 -1.526 2
1 690 . 1 1 A 58 58 PHE H H 58 8.355 8.454 -0.099 2
1 691 . 1 1 A 58 58 PHE HA H 58 4.858 5.093 -0.235 2
1 699 . 1 1 A 58 58 PHE C C 58 171.549 172.021 -0.472 2
1 700 . 1 1 A 58 58 PHE CA C 58 56.195 56.260 -0.065 2
1 701 . 1 1 A 58 58 PHE CB C 58 39.335 40.584 -1.250 2
1 705 . 1 1 A 58 58 PHE N N 58 121.026 120.967 0.059 2
1 706 . 1 1 A 59 59 ASP H H 59 8.407 8.879 -0.472 2
1 707 . 1 1 A 59 59 ASP HA H 59 5.743 5.497 0.246 2
1 710 . 1 1 A 59 59 ASP C C 59 176.302 175.326 0.976 2
1 711 . 1 1 A 59 59 ASP CA C 59 52.579 53.246 -0.667 2
1 712 . 1 1 A 59 59 ASP CB C 59 43.628 43.047 0.581 2
1 713 . 1 1 A 59 59 ASP N N 59 119.234 119.826 -0.592 2
1 714 . 1 1 A 60 60 VAL H H 60 8.915 8.994 -0.079 2
1 715 . 1 1 A 60 60 VAL HA H 60 4.374 5.037 -0.663 2
1 723 . 1 1 A 60 60 VAL C C 60 173.140 174.683 -1.543 2
1 724 . 1 1 A 60 60 VAL CA C 60 61.252 60.369 0.883 2
1 725 . 1 1 A 60 60 VAL CB C 60 35.620 35.491 0.129 2
1 728 . 1 1 A 60 60 VAL N N 60 119.758 122.350 -2.592 2
1 729 . 1 1 A 61 61 ALA H H 61 8.761 8.938 -0.177 2
1 730 . 1 1 A 61 61 ALA HA H 61 5.091 5.333 -0.242 2
1 734 . 1 1 A 61 61 ALA C C 61 176.460 176.206 0.255 2
1 735 . 1 1 A 61 61 ALA CA C 61 51.019 50.980 0.039 2
1 736 . 1 1 A 61 61 ALA CB C 61 19.447 21.294 -1.847 2
1 737 . 1 1 A 61 61 ALA N N 61 133.341 128.199 5.142 2
1 738 . 1 1 A 62 62 VAL H H 62 8.929 8.929 -0.000 2
1 739 . 1 1 A 62 62 VAL HA H 62 4.236 4.752 -0.516 2
1 747 . 1 1 A 62 62 VAL C C 62 174.733 175.537 -0.804 2
1 748 . 1 1 A 62 62 VAL CA C 62 61.007 60.755 0.253 2
1 749 . 1 1 A 62 62 VAL CB C 62 34.387 35.729 -1.342 2
1 752 . 1 1 A 62 62 VAL N N 62 124.165 122.282 1.883 2
1 753 . 1 1 A 63 63 GLY H H 63 8.995 8.669 0.326 2
1 754 . 1 1 A 63 63 GLY HA2 H 63 4.229 4.120 0.109 2
1 755 . 1 1 A 63 63 GLY HA3 H 63 3.637 4.129 -0.492 2
1 756 . 1 1 A 63 63 GLY C C 63 175.306 174.896 0.410 2
1 757 . 1 1 A 63 63 GLY CA C 63 44.620 45.181 -0.561 2
1 758 . 1 1 A 63 63 GLY N N 63 115.598 111.944 3.654 2
1 759 . 1 1 A 64 64 ALA H H 64 8.106 8.942 -0.836 2
1 760 . 1 1 A 64 64 ALA HA H 64 4.010 4.302 -0.292 2
1 764 . 1 1 A 64 64 ALA C C 64 180.218 179.293 0.925 2
1 765 . 1 1 A 64 64 ALA CA C 64 55.897 54.621 1.276 2
1 766 . 1 1 A 64 64 ALA CB C 64 18.347 18.429 -0.082 2
1 767 . 1 1 A 64 64 ALA N N 64 122.859 124.150 -1.291 2
1 768 . 1 1 A 65 65 ASN H H 65 8.748 8.501 0.247 2
1 769 . 1 1 A 65 65 ASN HA H 65 4.230 4.535 -0.304 2
1 774 . 1 1 A 65 65 ASN C C 65 176.085 176.071 0.014 2
1 775 . 1 1 A 65 65 ASN CA C 65 56.064 55.558 0.506 2
1 776 . 1 1 A 65 65 ASN CB C 65 37.871 37.828 0.043 2
1 777 . 1 1 A 65 65 ASN N N 65 114.590 115.813 -1.223 2
1 779 . 1 1 A 66 66 ASP H H 66 7.598 8.083 -0.485 2
1 780 . 1 1 A 66 66 ASP HA H 66 4.682 4.771 -0.089 2
1 783 . 1 1 A 66 66 ASP C C 66 173.061 176.156 -3.095 2
1 784 . 1 1 A 66 66 ASP CA C 66 53.549 54.670 -1.121 2
1 785 . 1 1 A 66 66 ASP CB C 66 42.204 42.388 -0.184 2
1 786 . 1 1 A 66 66 ASP N N 66 118.065 117.647 0.418 2
1 787 . 1 1 A 67 67 ALA H H 67 7.434 7.693 -0.259 2
1 788 . 1 1 A 67 67 ALA HA H 67 4.316 4.432 -0.116 2
1 792 . 1 1 A 67 67 ALA C C 67 175.615 176.854 -1.239 2
1 793 . 1 1 A 67 67 ALA CA C 67 50.814 51.328 -0.514 2
1 794 . 1 1 A 67 67 ALA CB C 67 18.618 20.433 -1.815 2
1 795 . 1 1 A 67 67 ALA N N 67 124.890 121.013 3.877 2
1 796 . 1 1 A 68 68 TYR H H 68 8.390 8.317 0.073 2
1 797 . 1 1 A 68 68 TYR HA H 68 4.195 4.619 -0.424 2
1 804 . 1 1 A 68 68 TYR C C 68 174.964 176.027 -1.063 2
1 805 . 1 1 A 68 68 TYR CA C 68 59.566 57.963 1.603 2
1 806 . 1 1 A 68 68 TYR CB C 68 36.992 39.701 -2.709 2
1 809 . 1 1 A 68 68 TYR N N 68 121.083 116.458 4.625 2
1 810 . 1 1 A 69 69 GLY H H 69 8.149 8.835 -0.686 2
1 811 . 1 1 A 69 69 GLY HA2 H 69 4.254 3.952 0.302 2
1 812 . 1 1 A 69 69 GLY HA3 H 69 3.624 4.006 -0.382 2
1 813 . 1 1 A 69 69 GLY C C 69 173.161 174.923 -1.762 2
1 814 . 1 1 A 69 69 GLY CA C 69 44.465 45.530 -1.065 2
1 815 . 1 1 A 69 69 GLY N N 69 108.762 109.847 -1.085 2
1 816 . 1 1 A 70 70 GLN H H 70 8.450 7.795 0.655 2
1 817 . 1 1 A 70 70 GLN HA H 70 4.140 4.441 -0.300 2
1 824 . 1 1 A 70 70 GLN C C 70 176.138 175.222 0.916 2
1 825 . 1 1 A 70 70 GLN CA C 70 54.680 55.961 -1.281 2
1 826 . 1 1 A 70 70 GLN CB C 70 29.210 30.039 -0.829 2
1 828 . 1 1 A 70 70 GLN N N 70 117.002 119.850 -2.848 2
1 830 . 1 1 A 71 71 TYR H H 71 8.991 8.649 0.342 2
1 831 . 1 1 A 71 71 TYR HA H 71 3.752 4.736 -0.984 2
1 838 . 1 1 A 71 71 TYR C C 71 174.548 174.432 0.116 2
1 839 . 1 1 A 71 71 TYR CA C 71 59.868 58.320 1.548 2
1 840 . 1 1 A 71 71 TYR CB C 71 38.961 39.450 -0.489 2
1 843 . 1 1 A 71 71 TYR N N 71 125.112 122.700 2.412 2
1 844 . 1 1 A 72 72 ASP H H 72 8.819 8.597 0.223 2
1 845 . 1 1 A 72 72 ASP HA H 72 4.773 4.706 0.067 2
1 848 . 1 1 A 72 72 ASP C C 72 177.709 176.475 1.234 2
1 849 . 1 1 A 72 72 ASP CA C 72 52.382 52.889 -0.507 2
1 850 . 1 1 A 72 72 ASP CB C 72 42.197 41.346 0.851 2
1 851 . 1 1 A 72 72 ASP N N 72 129.918 126.091 3.827 2
1 852 . 1 1 A 73 73 GLU H H 73 9.409 8.649 0.760 2
1 853 . 1 1 A 73 73 GLU HA H 73 3.937 4.065 -0.128 2
1 858 . 1 1 A 73 73 GLU C C 73 177.581 177.227 0.354 2
1 859 . 1 1 A 73 73 GLU CA C 73 58.962 58.226 0.736 2
1 860 . 1 1 A 73 73 GLU CB C 73 29.155 28.743 0.412 2
1 862 . 1 1 A 73 73 GLU N N 73 129.624 125.228 4.396 2
1 863 . 1 1 A 74 74 ASN H H 74 8.700 8.009 0.691 2
1 864 . 1 1 A 74 74 ASN HA H 74 4.550 4.585 -0.035 2
1 869 . 1 1 A 74 74 ASN C C 74 176.190 176.642 -0.452 2
1 870 . 1 1 A 74 74 ASN CA C 74 54.932 54.877 0.055 2
1 871 . 1 1 A 74 74 ASN CB C 74 38.113 38.178 -0.065 2
1 872 . 1 1 A 74 74 ASN N N 74 116.792 117.729 -0.937 2
1 874 . 1 1 A 75 75 LEU H H 75 7.303 7.668 -0.365 2
1 875 . 1 1 A 75 75 LEU HA H 75 4.289 4.324 -0.035 2
1 885 . 1 1 A 75 75 LEU C C 75 175.821 176.505 -0.684 2
1 886 . 1 1 A 75 75 LEU CA C 75 54.106 55.773 -1.667 2
1 887 . 1 1 A 75 75 LEU CB C 75 41.239 42.639 -1.401 2
1 891 . 1 1 A 75 75 LEU N N 75 117.094 118.991 -1.897 2
1 892 . 1 1 A 76 76 VAL H H 76 7.181 7.466 -0.285 2
1 893 . 1 1 A 76 76 VAL HA H 76 4.970 4.639 0.331 2
1 901 . 1 1 A 76 76 VAL C C 76 175.702 174.750 0.952 2
1 902 . 1 1 A 76 76 VAL CA C 76 61.733 60.926 0.807 2
1 903 . 1 1 A 76 76 VAL CB C 76 31.822 33.769 -1.947 2
1 905 . 1 1 A 76 76 VAL N N 76 124.716 119.723 4.993 2
1 906 . 1 1 A 77 77 GLN H H 77 8.791 8.786 0.005 2
1 907 . 1 1 A 77 77 GLN HA H 77 4.695 5.011 -0.316 2
1 914 . 1 1 A 77 77 GLN C C 77 173.553 173.483 0.070 2
1 915 . 1 1 A 77 77 GLN CA C 77 54.038 54.302 -0.264 2
1 916 . 1 1 A 77 77 GLN CB C 77 33.018 32.240 0.778 2
1 918 . 1 1 A 77 77 GLN N N 77 124.898 124.488 0.410 2
1 920 . 1 1 A 78 78 ARG H H 78 8.530 8.513 0.017 2
1 921 . 1 1 A 78 78 ARG HA H 78 5.107 5.344 -0.237 2
1 928 . 1 1 A 78 78 ARG C C 78 176.182 175.319 0.863 2
1 929 . 1 1 A 78 78 ARG CA C 78 55.355 54.969 0.386 2
1 930 . 1 1 A 78 78 ARG CB C 78 31.150 32.097 -0.947 2
1 933 . 1 1 A 78 78 ARG N N 78 123.413 119.828 3.585 2
1 934 . 1 1 A 79 79 VAL H H 79 9.300 8.810 0.490 2
1 935 . 1 1 A 79 79 VAL HA H 79 4.824 4.570 0.254 2
1 943 . 1 1 A 79 79 VAL CA C 79 58.731 58.863 -0.132 2
1 944 . 1 1 A 79 79 VAL CB C 79 34.836 34.071 0.765 2
1 947 . 1 1 A 79 79 VAL N N 79 125.252 123.949 1.303 2
1 948 . 1 1 A 80 80 PRO HA H 80 4.339 4.778 -0.439 2
1 955 . 1 1 A 80 80 PRO C C 80 176.902 177.980 -1.078 2
1 956 . 1 1 A 80 80 PRO CA C 80 62.969 63.149 -0.180 2
1 957 . 1 1 A 80 80 PRO CB C 80 32.431 32.132 0.299 2
1 960 . 1 1 A 81 81 LYS H H 81 7.816 8.976 -1.160 2
1 961 . 1 1 A 81 81 LYS HA H 81 3.790 4.085 -0.295 2
1 970 . 1 1 A 81 81 LYS C C 81 177.808 178.849 -1.041 2
1 971 . 1 1 A 81 81 LYS CA C 81 59.874 59.701 0.173 2
1 972 . 1 1 A 81 81 LYS CB C 81 32.670 32.104 0.566 2
1 976 . 1 1 A 81 81 LYS N N 81 120.948 124.395 -3.447 2
1 977 . 1 1 A 82 82 ASP H H 82 8.069 8.178 -0.109 2
1 978 . 1 1 A 82 82 ASP HA H 82 4.243 4.393 -0.150 2
1 981 . 1 1 A 82 82 ASP C C 82 177.157 178.646 -1.489 2
1 982 . 1 1 A 82 82 ASP CA C 82 55.527 57.118 -1.591 2
1 983 . 1 1 A 82 82 ASP CB C 82 40.005 41.343 -1.338 2
1 984 . 1 1 A 82 82 ASP N N 82 116.004 119.954 -3.950 2
1 985 . 1 1 A 83 83 VAL H H 83 7.150 7.737 -0.587 2
1 986 . 1 1 A 83 83 VAL HA H 83 3.719 3.556 0.163 2
1 994 . 1 1 A 83 83 VAL C C 83 176.346 176.768 -0.422 2
1 995 . 1 1 A 83 83 VAL CA C 83 63.868 65.661 -1.793 2
1 996 . 1 1 A 83 83 VAL CB C 83 31.689 31.392 0.297 2
1 999 . 1 1 A 83 83 VAL N N 83 117.199 118.498 -1.299 2
1 1000 . 1 1 A 84 84 PHE H H 84 7.365 7.607 -0.242 2
1 1001 . 1 1 A 84 84 PHE HA H 84 4.389 4.635 -0.246 2
1 1009 . 1 1 A 84 84 PHE C C 84 175.265 176.292 -1.027 2
1 1010 . 1 1 A 84 84 PHE CA C 84 57.210 56.949 0.261 2
1 1011 . 1 1 A 84 84 PHE CB C 84 38.968 37.943 1.025 2
1 1015 . 1 1 A 84 84 PHE N N 84 119.897 117.593 2.304 2
1 1016 . 1 1 A 85 85 MET H H 85 7.765 8.061 -0.296 2
1 1017 . 1 1 A 85 85 MET HA H 85 4.277 4.313 -0.036 2
1 1025 . 1 1 A 85 85 MET C C 85 176.856 177.451 -0.595 2
1 1026 . 1 1 A 85 85 MET CA C 85 56.389 57.755 -1.366 2
1 1027 . 1 1 A 85 85 MET CB C 85 32.715 32.396 0.319 2
1 1030 . 1 1 A 85 85 MET N N 85 121.131 119.221 1.910 2
1 1031 . 1 1 A 86 86 GLY H H 86 8.499 8.184 0.315 2
1 1032 . 1 1 A 86 86 GLY HA2 H 86 3.928 3.947 -0.019 2
1 1033 . 1 1 A 86 86 GLY HA3 H 86 3.793 3.949 -0.156 2
1 1034 . 1 1 A 86 86 GLY C C 86 174.168 173.949 0.219 2
1 1035 . 1 1 A 86 86 GLY CA C 86 45.637 45.262 0.375 2
1 1036 . 1 1 A 86 86 GLY N N 86 111.268 107.879 3.390 2
1 1037 . 1 1 A 87 87 VAL H H 87 7.564 7.685 -0.121 2
1 1038 . 1 1 A 87 87 VAL HA H 87 4.083 4.092 -0.009 2
1 1046 . 1 1 A 87 87 VAL C C 87 175.649 176.029 -0.380 2
1 1047 . 1 1 A 87 87 VAL CA C 87 61.809 61.581 0.228 2
1 1048 . 1 1 A 87 87 VAL CB C 87 32.667 32.740 -0.073 2
1 1051 . 1 1 A 87 87 VAL N N 87 118.839 120.436 -1.597 2
1 1052 . 1 1 A 88 88 ASP H H 88 8.270 8.791 -0.521 2
1 1053 . 1 1 A 88 88 ASP HA H 88 4.421 4.364 0.057 2
1 1056 . 1 1 A 88 88 ASP C C 88 175.977 175.279 0.698 2
1 1057 . 1 1 A 88 88 ASP CA C 88 55.655 56.990 -1.335 2
1 1058 . 1 1 A 88 88 ASP CB C 88 41.364 41.121 0.243 2
1 1059 . 1 1 A 88 88 ASP N N 88 124.401 125.890 -1.489 2
1 1060 . 1 1 A 89 89 GLU H H 89 7.833 7.863 -0.030 2
1 1061 . 1 1 A 89 89 GLU HA H 89 4.206 4.694 -0.488 2
1 1066 . 1 1 A 89 89 GLU C C 89 174.912 175.370 -0.458 2
1 1067 . 1 1 A 89 89 GLU CA C 89 55.739 55.226 0.513 2
1 1068 . 1 1 A 89 89 GLU CB C 89 30.603 32.460 -1.857 2
1 1070 . 1 1 A 89 89 GLU N N 89 119.378 115.922 3.456 2
1 1071 . 1 1 A 90 90 LEU H H 90 8.051 8.684 -0.633 2
1 1072 . 1 1 A 90 90 LEU HA H 90 4.127 4.355 -0.228 2
1 1082 . 1 1 A 90 90 LEU C C 90 175.753 176.077 -0.324 2
1 1083 . 1 1 A 90 90 LEU CA C 90 54.929 55.326 -0.397 2
1 1084 . 1 1 A 90 90 LEU CB C 90 42.710 41.186 1.524 2
1 1088 . 1 1 A 90 90 LEU N N 90 124.432 126.366 -1.934 2
1 1089 . 1 1 A 91 91 GLN H H 91 7.341 8.734 -1.393 2
1 1090 . 1 1 A 91 91 GLN HA H 91 4.546 4.875 -0.329 2
1 1097 . 1 1 A 91 91 GLN C C 91 174.655 174.556 0.099 2
1 1098 . 1 1 A 91 91 GLN CA C 91 53.671 54.076 -0.405 2
1 1099 . 1 1 A 91 91 GLN CB C 91 32.850 32.407 0.443 2
1 1101 . 1 1 A 91 91 GLN N N 91 120.186 125.550 -5.365 2
1 1103 . 1 1 A 92 92 VAL H H 92 8.442 8.503 -0.061 2
1 1104 . 1 1 A 92 92 VAL HA H 92 3.278 3.824 -0.546 2
1 1112 . 1 1 A 92 92 VAL C C 92 177.098 177.223 -0.125 2
1 1113 . 1 1 A 92 92 VAL CA C 92 64.953 64.546 0.407 2
1 1114 . 1 1 A 92 92 VAL CB C 92 31.601 31.740 -0.139 2
1 1117 . 1 1 A 92 92 VAL N N 92 121.899 123.733 -1.834 2
1 1118 . 1 1 A 93 93 GLY H H 93 9.002 9.506 -0.504 2
1 1119 . 1 1 A 93 93 GLY HA2 H 93 4.327 3.952 0.375 2
1 1120 . 1 1 A 93 93 GLY HA3 H 93 3.770 3.965 -0.195 2
1 1121 . 1 1 A 93 93 GLY C C 93 174.547 174.230 0.317 2
1 1122 . 1 1 A 93 93 GLY CA C 93 44.446 45.123 -0.677 2
1 1123 . 1 1 A 93 93 GLY N N 93 116.485 115.140 1.345 2
1 1124 . 1 1 A 94 94 MET H H 94 7.445 7.755 -0.310 2
1 1125 . 1 1 A 94 94 MET HA H 94 4.182 4.525 -0.343 2
1 1133 . 1 1 A 94 94 MET C C 94 174.531 175.061 -0.530 2
1 1134 . 1 1 A 94 94 MET CA C 94 57.193 55.583 1.610 2
1 1135 . 1 1 A 94 94 MET CB C 94 34.474 33.345 1.129 2
1 1138 . 1 1 A 94 94 MET N N 94 120.304 120.393 -0.089 2
1 1139 . 1 1 A 95 95 ARG H H 95 8.169 8.631 -0.462 2
1 1140 . 1 1 A 95 95 ARG HA H 95 5.343 4.949 0.395 2
1 1147 . 1 1 A 95 95 ARG C C 95 175.593 175.023 0.570 2
1 1148 . 1 1 A 95 95 ARG CA C 95 54.898 54.605 0.293 2
1 1149 . 1 1 A 95 95 ARG CB C 95 32.928 33.175 -0.248 2
1 1152 . 1 1 A 95 95 ARG N N 95 122.066 122.879 -0.813 2
1 1153 . 1 1 A 96 96 PHE H H 96 8.440 8.232 0.208 2
1 1154 . 1 1 A 96 96 PHE HA H 96 4.738 5.070 -0.332 2
1 1162 . 1 1 A 96 96 PHE C C 96 173.273 172.010 1.263 2
1 1163 . 1 1 A 96 96 PHE CA C 96 56.174 56.128 0.046 2
1 1164 . 1 1 A 96 96 PHE CB C 96 42.474 40.641 1.833 2
1 1168 . 1 1 A 96 96 PHE N N 96 119.938 118.971 0.968 2
1 1169 . 1 1 A 97 97 LEU H H 97 8.459 8.750 -0.291 2
1 1170 . 1 1 A 97 97 LEU HA H 97 4.625 4.888 -0.263 2
1 1180 . 1 1 A 97 97 LEU C C 97 175.664 175.428 0.236 2
1 1181 . 1 1 A 97 97 LEU CA C 97 53.547 54.480 -0.933 2
1 1182 . 1 1 A 97 97 LEU CB C 97 42.379 43.827 -1.448 2
1 1186 . 1 1 A 97 97 LEU N N 97 122.014 122.063 -0.049 2
1 1187 . 1 1 A 98 98 ALA H H 98 8.812 8.862 -0.050 2
1 1188 . 1 1 A 98 98 ALA HA H 98 4.520 5.315 -0.795 2
1 1192 . 1 1 A 98 98 ALA C C 98 176.373 176.239 0.134 2
1 1193 . 1 1 A 98 98 ALA CA C 98 50.639 50.709 -0.070 2
1 1194 . 1 1 A 98 98 ALA CB C 98 20.939 21.596 -0.657 2
1 1195 . 1 1 A 98 98 ALA N N 98 129.296 128.935 0.361 2
1 1196 . 1 1 A 99 99 GLU H H 99 8.504 8.807 -0.303 2
1 1197 . 1 1 A 99 99 GLU HA H 99 4.150 4.743 -0.593 2
1 1202 . 1 1 A 99 99 GLU C C 99 176.351 176.435 -0.084 2
1 1203 . 1 1 A 99 99 GLU CA C 99 56.830 56.271 0.559 2
1 1204 . 1 1 A 99 99 GLU CB C 99 29.639 30.680 -1.041 2
1 1206 . 1 1 A 99 99 GLU N N 99 121.993 121.844 0.149 2
1 1207 . 1 1 A 100 100 THR H H 100 7.393 8.557 -1.165 2
1 1208 . 1 1 A 100 100 THR HA H 100 4.819 4.818 0.001 2
1 1213 . 1 1 A 100 100 THR C C 100 175.882 174.984 0.898 2
1 1214 . 1 1 A 100 100 THR CA C 100 60.329 60.266 0.063 2
1 1215 . 1 1 A 100 100 THR CB C 100 73.452 71.694 1.758 2
1 1217 . 1 1 A 100 100 THR N N 100 115.598 115.584 0.014 2
1 1218 . 1 1 A 101 101 ASP H H 101 8.988 8.868 0.120 2
1 1219 . 1 1 A 101 101 ASP HA H 101 4.357 4.360 -0.003 2
1 1222 . 1 1 A 101 101 ASP C C 101 176.848 177.080 -0.232 2
1 1223 . 1 1 A 101 101 ASP CA C 101 56.493 57.434 -0.941 2
1 1224 . 1 1 A 101 101 ASP CB C 101 39.973 40.515 -0.542 2
1 1225 . 1 1 A 101 101 ASP N N 101 121.468 120.880 0.588 2
1 1226 . 1 1 A 102 102 GLN H H 102 7.937 7.705 0.233 2
1 1227 . 1 1 A 102 102 GLN HA H 102 4.415 4.362 0.053 2
1 1234 . 1 1 A 102 102 GLN C C 102 175.252 176.012 -0.761 2
1 1235 . 1 1 A 102 102 GLN CA C 102 55.097 55.037 0.060 2
1 1236 . 1 1 A 102 102 GLN CB C 102 29.121 27.977 1.144 2
1 1238 . 1 1 A 102 102 GLN N N 102 117.199 114.495 2.705 2
1 1240 . 1 1 A 103 103 GLY H H 103 7.431 7.944 -0.512 2
1 1241 . 1 1 A 103 103 GLY HA2 H 103 4.504 4.222 0.282 2
1 1242 . 1 1 A 103 103 GLY HA3 H 103 3.868 4.223 -0.355 2
1 1243 . 1 1 A 103 103 GLY CA C 103 44.051 44.420 -0.369 2
1 1244 . 1 1 A 103 103 GLY N N 103 110.056 109.603 0.453 2
1 1245 . 1 1 A 104 104 PRO HA H 104 5.057 5.030 0.027 2
1 1252 . 1 1 A 104 104 PRO C C 104 177.873 175.677 2.196 2
1 1253 . 1 1 A 104 104 PRO CA C 104 62.464 62.985 -0.521 2
1 1254 . 1 1 A 104 104 PRO CB C 104 31.939 32.130 -0.191 2
1 1257 . 1 1 A 105 105 VAL H H 105 8.960 9.044 -0.084 2
1 1258 . 1 1 A 105 105 VAL HA H 105 4.678 4.536 0.142 2
1 1266 . 1 1 A 105 105 VAL CA C 105 58.474 59.282 -0.808 2
1 1267 . 1 1 A 105 105 VAL CB C 105 35.512 34.596 0.916 2
1 1270 . 1 1 A 105 105 VAL N N 105 123.240 122.979 0.261 2
1 1271 . 1 1 A 106 106 PRO HA H 106 4.777 4.822 -0.044 2
1 1278 . 1 1 A 106 106 PRO C C 106 176.823 176.301 0.522 2
1 1279 . 1 1 A 106 106 PRO CA C 106 62.508 62.413 0.095 2
1 1280 . 1 1 A 106 106 PRO CB C 106 31.650 31.576 0.074 2
1 1283 . 1 1 A 107 107 VAL H H 107 8.835 7.971 0.864 2
1 1284 . 1 1 A 107 107 VAL HA H 107 4.719 4.952 -0.233 2
1 1292 . 1 1 A 107 107 VAL C C 107 173.661 173.355 0.306 2
1 1293 . 1 1 A 107 107 VAL CA C 107 59.026 59.176 -0.150 2
1 1294 . 1 1 A 107 107 VAL CB C 107 36.406 35.205 1.201 2
1 1297 . 1 1 A 107 107 VAL N N 107 117.474 117.118 0.356 2
1 1298 . 1 1 A 108 108 GLU H H 108 7.698 8.595 -0.897 2
1 1299 . 1 1 A 108 108 GLU HA H 108 5.133 4.979 0.155 2
1 1304 . 1 1 A 108 108 GLU C C 108 176.394 175.128 1.266 2
1 1305 . 1 1 A 108 108 GLU CA C 108 53.808 54.441 -0.633 2
1 1306 . 1 1 A 108 108 GLU CB C 108 33.984 33.298 0.686 2
1 1308 . 1 1 A 108 108 GLU N N 108 120.646 120.734 -0.088 2
1 1309 . 1 1 A 109 109 ILE H H 109 8.690 8.982 -0.292 2
1 1310 . 1 1 A 109 109 ILE HA H 109 4.484 4.261 0.223 2
1 1320 . 1 1 A 109 109 ILE C C 109 177.313 177.054 0.259 2
1 1321 . 1 1 A 109 109 ILE CA C 109 61.789 61.643 0.146 2
1 1322 . 1 1 A 109 109 ILE CB C 109 36.628 37.592 -0.964 2
1 1326 . 1 1 A 109 109 ILE N N 109 124.739 127.470 -2.731 2
1 1327 . 1 1 A 110 110 THR H H 110 9.300 9.573 -0.273 2
1 1328 . 1 1 A 110 110 THR HA H 110 4.547 4.577 -0.030 2
1 1333 . 1 1 A 110 110 THR C C 110 174.904 174.572 0.332 2
1 1334 . 1 1 A 110 110 THR CA C 110 62.260 61.419 0.841 2
1 1335 . 1 1 A 110 110 THR CB C 110 69.100 69.638 -0.538 2
1 1337 . 1 1 A 110 110 THR N N 110 122.544 118.513 4.031 2
1 1338 . 1 1 A 111 111 ALA H H 111 7.673 7.445 0.228 2
1 1339 . 1 1 A 111 111 ALA HA H 111 4.367 4.588 -0.220 2
1 1343 . 1 1 A 111 111 ALA C C 111 175.019 175.011 0.008 2
1 1344 . 1 1 A 111 111 ALA CA C 111 53.125 51.831 1.294 2
1 1345 . 1 1 A 111 111 ALA CB C 111 21.539 22.378 -0.839 2
1 1346 . 1 1 A 111 111 ALA N N 111 123.153 120.891 2.263 2
1 1347 . 1 1 A 112 112 VAL H H 112 8.707 8.449 0.258 2
1 1348 . 1 1 A 112 112 VAL HA H 112 4.129 4.582 -0.453 2
1 1356 . 1 1 A 112 112 VAL C C 112 174.755 175.098 -0.343 2
1 1357 . 1 1 A 112 112 VAL CA C 112 62.898 61.577 1.321 2
1 1358 . 1 1 A 112 112 VAL CB C 112 33.379 34.507 -1.128 2
1 1361 . 1 1 A 112 112 VAL N N 112 122.369 119.978 2.391 2
1 1362 . 1 1 A 113 113 GLU H H 113 8.144 8.973 -0.829 2
1 1363 . 1 1 A 113 113 GLU HA H 113 4.645 4.545 0.100 2
1 1368 . 1 1 A 113 113 GLU C C 113 175.102 177.532 -2.430 2
1 1369 . 1 1 A 113 113 GLU CA C 113 54.080 55.189 -1.109 2
1 1370 . 1 1 A 113 113 GLU CB C 113 31.234 30.936 0.298 2
1 1372 . 1 1 A 113 113 GLU N N 113 127.435 127.008 0.427 2
1 1373 . 1 1 A 114 114 ASP H H 114 8.472 8.629 -0.156 2
1 1374 . 1 1 A 114 114 ASP HA H 114 4.209 4.269 -0.060 2
1 1377 . 1 1 A 114 114 ASP C C 114 177.679 177.012 0.667 2
1 1378 . 1 1 A 114 114 ASP CA C 114 58.334 57.288 1.046 2
1 1379 . 1 1 A 114 114 ASP CB C 114 40.347 41.000 -0.653 2
1 1380 . 1 1 A 114 114 ASP N N 114 119.844 121.849 -2.005 2
1 1381 . 1 1 A 115 115 ASP H H 115 8.475 7.996 0.479 2
1 1382 . 1 1 A 115 115 ASP HA H 115 4.848 4.835 0.013 2
1 1385 . 1 1 A 115 115 ASP C C 115 175.968 175.387 0.581 2
1 1386 . 1 1 A 115 115 ASP CA C 115 53.290 53.928 -0.638 2
1 1387 . 1 1 A 115 115 ASP CB C 115 42.080 42.553 -0.473 2
1 1388 . 1 1 A 115 115 ASP N N 115 114.364 115.674 -1.310 2
1 1389 . 1 1 A 116 116 HIS H H 116 7.185 7.529 -0.344 2
1 1390 . 1 1 A 116 116 HIS HA H 116 5.106 5.496 -0.390 2
1 1395 . 1 1 A 116 116 HIS C C 116 172.393 172.965 -0.572 2
1 1396 . 1 1 A 116 116 HIS CA C 116 56.099 54.191 1.908 2
1 1397 . 1 1 A 116 116 HIS CB C 116 33.289 33.060 0.229 2
1 1400 . 1 1 A 116 116 HIS N N 116 117.212 115.287 1.925 2
1 1401 . 1 1 A 117 117 VAL H H 117 9.130 9.230 -0.101 2
1 1402 . 1 1 A 117 117 VAL HA H 117 4.649 4.948 -0.299 2
1 1410 . 1 1 A 117 117 VAL C C 117 173.832 174.743 -0.911 2
1 1411 . 1 1 A 117 117 VAL CA C 117 59.555 59.923 -0.368 2
1 1412 . 1 1 A 117 117 VAL CB C 117 34.676 34.635 0.041 2
1 1415 . 1 1 A 117 117 VAL N N 117 114.046 116.728 -2.682 2
1 1416 . 1 1 A 118 118 VAL H H 118 8.680 8.889 -0.209 2
1 1417 . 1 1 A 118 118 VAL HA H 118 4.747 4.924 -0.177 2
1 1425 . 1 1 A 118 118 VAL C C 118 175.836 175.223 0.613 2
1 1426 . 1 1 A 118 118 VAL CA C 118 62.159 61.053 1.106 2
1 1427 . 1 1 A 118 118 VAL CB C 118 31.887 33.711 -1.824 2
1 1430 . 1 1 A 118 118 VAL N N 118 125.095 121.754 3.341 2
1 1431 . 1 1 A 119 119 VAL H H 119 9.057 8.883 0.174 2
1 1432 . 1 1 A 119 119 VAL HA H 119 5.231 5.157 0.074 2
1 1440 . 1 1 A 119 119 VAL C C 119 173.747 173.901 -0.154 2
1 1441 . 1 1 A 119 119 VAL CA C 119 58.326 59.626 -1.300 2
1 1442 . 1 1 A 119 119 VAL CB C 119 34.387 34.438 -0.051 2
1 1445 . 1 1 A 119 119 VAL N N 119 121.494 122.836 -1.342 2
1 1446 . 1 1 A 120 120 ASP H H 120 8.926 8.671 0.255 2
1 1447 . 1 1 A 120 120 ASP HA H 120 5.174 5.192 -0.018 2
1 1450 . 1 1 A 120 120 ASP C C 120 177.982 175.868 2.114 2
1 1451 . 1 1 A 120 120 ASP CA C 120 52.749 52.709 0.039 2
1 1452 . 1 1 A 120 120 ASP CB C 120 44.542 43.773 0.769 2
1 1453 . 1 1 A 120 120 ASP N N 120 121.454 125.428 -3.974 2
1 1454 . 1 1 A 121 121 GLY H H 121 8.674 8.603 0.071 2
1 1455 . 1 1 A 121 121 GLY HA2 H 121 4.702 4.014 0.688 2
1 1456 . 1 1 A 121 121 GLY HA3 H 121 3.573 4.032 -0.458 2
1 1457 . 1 1 A 121 121 GLY C C 121 175.041 174.046 0.995 2
1 1458 . 1 1 A 121 121 GLY CA C 121 45.319 45.624 -0.305 2
1 1459 . 1 1 A 121 121 GLY N N 121 114.850 112.192 2.658 2
1 1460 . 1 1 A 122 122 ASN H H 122 8.762 7.917 0.845 2
1 1461 . 1 1 A 122 122 ASN HA H 122 4.183 5.263 -1.080 2
1 1466 . 1 1 A 122 122 ASN C C 122 175.406 174.373 1.033 2
1 1467 . 1 1 A 122 122 ASN CA C 122 54.686 51.980 2.706 2
1 1468 . 1 1 A 122 122 ASN CB C 122 40.139 40.901 -0.762 2
1 1469 . 1 1 A 122 122 ASN N N 122 121.618 117.420 4.198 2
1 1471 . 1 1 A 123 123 HIS H H 123 8.929 8.810 0.119 2
1 1472 . 1 1 A 123 123 HIS HA H 123 4.005 4.796 -0.791 2
1 1477 . 1 1 A 123 123 HIS C C 123 177.325 176.104 1.221 2
1 1478 . 1 1 A 123 123 HIS CA C 123 58.768 56.489 2.279 2
1 1479 . 1 1 A 123 123 HIS CB C 123 31.172 31.895 -0.723 2
1 1482 . 1 1 A 123 123 HIS N N 123 124.165 119.649 4.516 2
1 1483 . 1 1 A 124 124 MET H H 124 8.266 8.588 -0.322 2
1 1484 . 1 1 A 124 124 MET HA H 124 4.048 4.149 -0.101 2
1 1492 . 1 1 A 124 124 MET CA C 124 58.994 57.832 1.162 2
1 1493 . 1 1 A 124 124 MET CB C 124 32.777 32.233 0.544 2
1 1496 . 1 1 A 124 124 MET N N 124 129.443 119.866 9.577 2
1 1497 . 1 1 A 125 125 LEU H H 125 8.094 7.801 0.293 2
1 1498 . 1 1 A 125 125 LEU HA H 125 4.455 4.432 0.023 2
1 1504 . 1 1 A 125 125 LEU C C 125 177.860 176.802 1.059 2
1 1505 . 1 1 A 125 125 LEU CA C 125 53.517 54.890 -1.373 2
1 1506 . 1 1 A 125 125 LEU CB C 125 42.462 42.193 0.269 2
1 1509 . 1 1 A 126 126 ALA H H 126 8.089 7.768 0.321 2
1 1510 . 1 1 A 126 126 ALA HA H 126 3.966 4.418 -0.452 2
1 1514 . 1 1 A 126 126 ALA C C 126 179.135 178.089 1.046 2
1 1515 . 1 1 A 126 126 ALA CA C 126 54.170 52.889 1.280 2
1 1516 . 1 1 A 126 126 ALA CB C 126 18.687 19.698 -1.011 2
1 1517 . 1 1 A 126 126 ALA N N 126 126.095 121.450 4.646 2
1 1518 . 1 1 A 127 127 GLY H H 127 9.499 8.531 0.968 2
1 1519 . 1 1 A 127 127 GLY HA2 H 127 4.207 3.980 0.227 2
1 1520 . 1 1 A 127 127 GLY HA3 H 127 3.598 3.991 -0.393 2
1 1521 . 1 1 A 127 127 GLY C C 127 173.568 174.426 -0.858 2
1 1522 . 1 1 A 127 127 GLY CA C 127 45.846 45.213 0.633 2
1 1523 . 1 1 A 127 127 GLY N N 127 110.073 108.177 1.896 2
1 1524 . 1 1 A 128 128 GLN H H 128 7.514 7.902 -0.389 2
1 1525 . 1 1 A 128 128 GLN HA H 128 4.496 4.338 0.158 2
1 1532 . 1 1 A 128 128 GLN C C 128 174.790 175.242 -0.452 2
1 1533 . 1 1 A 128 128 GLN CA C 128 54.948 55.913 -0.965 2
1 1534 . 1 1 A 128 128 GLN CB C 128 29.181 29.456 -0.276 2
1 1536 . 1 1 A 128 128 GLN N N 128 117.842 120.453 -2.611 2
1 1538 . 1 1 A 129 129 ASN H H 129 8.689 8.733 -0.044 2
1 1539 . 1 1 A 129 129 ASN HA H 129 4.857 5.157 -0.300 2
1 1544 . 1 1 A 129 129 ASN C C 129 174.325 174.552 -0.227 2
1 1545 . 1 1 A 129 129 ASN CA C 129 52.568 52.602 -0.034 2
1 1546 . 1 1 A 129 129 ASN CB C 129 38.035 40.127 -2.092 2
1 1547 . 1 1 A 129 129 ASN N N 129 122.739 122.399 0.340 2
1 1549 . 1 1 A 130 130 LEU H H 130 8.742 8.792 -0.050 2
1 1550 . 1 1 A 130 130 LEU HA H 130 4.918 4.934 -0.015 2
1 1560 . 1 1 A 130 130 LEU C C 130 176.095 175.526 0.569 2
1 1561 . 1 1 A 130 130 LEU CA C 130 53.691 53.092 0.599 2
1 1562 . 1 1 A 130 130 LEU CB C 130 46.814 45.147 1.667 2
1 1566 . 1 1 A 130 130 LEU N N 130 121.242 122.224 -0.982 2
1 1567 . 1 1 A 131 131 LYS H H 131 8.809 9.047 -0.238 2
1 1568 . 1 1 A 131 131 LYS HA H 131 4.918 5.008 -0.089 2
1 1577 . 1 1 A 131 131 LYS C C 131 175.508 175.159 0.349 2
1 1578 . 1 1 A 131 131 LYS CA C 131 55.333 54.593 0.740 2
1 1579 . 1 1 A 131 131 LYS CB C 131 33.962 34.825 -0.863 2
1 1583 . 1 1 A 131 131 LYS N N 131 122.071 120.823 1.248 2
1 1584 . 1 1 A 132 132 PHE H H 132 9.436 9.452 -0.016 2
1 1585 . 1 1 A 132 132 PHE HA H 132 5.427 5.606 -0.179 2
1 1593 . 1 1 A 132 132 PHE C C 132 175.715 174.597 1.117 2
1 1594 . 1 1 A 132 132 PHE CA C 132 56.665 56.568 0.097 2
1 1595 . 1 1 A 132 132 PHE CB C 132 42.263 42.211 0.052 2
1 1599 . 1 1 A 132 132 PHE N N 132 125.247 122.755 2.492 2
1 1600 . 1 1 A 133 133 ASN H H 133 8.680 9.000 -0.320 2
1 1601 . 1 1 A 133 133 ASN HA H 133 5.249 5.182 0.067 2
1 1606 . 1 1 A 133 133 ASN C C 133 174.433 174.069 0.364 2
1 1607 . 1 1 A 133 133 ASN CA C 133 53.952 52.823 1.129 2
1 1608 . 1 1 A 133 133 ASN CB C 133 41.492 39.412 2.080 2
1 1609 . 1 1 A 133 133 ASN N N 133 122.056 121.523 0.533 2
1 1611 . 1 1 A 134 134 VAL H H 134 8.762 8.706 0.056 2
1 1612 . 1 1 A 134 134 VAL HA H 134 4.805 4.690 0.115 2
1 1620 . 1 1 A 134 134 VAL C C 134 173.555 175.079 -1.524 2
1 1621 . 1 1 A 134 134 VAL CA C 134 60.374 61.223 -0.849 2
1 1622 . 1 1 A 134 134 VAL CB C 134 34.848 33.095 1.753 2
1 1625 . 1 1 A 134 134 VAL N N 134 122.014 125.882 -3.868 2
1 1626 . 1 1 A 135 135 GLU H H 135 8.869 9.340 -0.471 2
1 1627 . 1 1 A 135 135 GLU HA H 135 5.240 4.991 0.249 2
1 1632 . 1 1 A 135 135 GLU C C 135 175.578 175.241 0.337 2
1 1633 . 1 1 A 135 135 GLU CA C 135 54.376 55.278 -0.902 2
1 1634 . 1 1 A 135 135 GLU CB C 135 33.264 31.024 2.240 2
1 1636 . 1 1 A 135 135 GLU N N 135 125.197 126.780 -1.583 2
1 1637 . 1 1 A 136 136 VAL H H 136 8.270 8.600 -0.330 2
1 1638 . 1 1 A 136 136 VAL HA H 136 4.066 4.284 -0.218 2
1 1646 . 1 1 A 136 136 VAL C C 136 176.119 175.508 0.611 2
1 1647 . 1 1 A 136 136 VAL CA C 136 62.910 62.842 0.068 2
1 1648 . 1 1 A 136 136 VAL CB C 136 30.573 31.990 -1.417 2
1 1651 . 1 1 A 136 136 VAL N N 136 126.347 127.300 -0.953 2
1 1652 . 1 1 A 137 137 VAL H H 137 8.865 8.606 0.259 2
1 1653 . 1 1 A 137 137 VAL HA H 137 4.022 4.026 -0.004 2
1 1661 . 1 1 A 137 137 VAL C C 137 175.208 176.112 -0.904 2
1 1662 . 1 1 A 137 137 VAL CA C 137 64.424 64.282 0.142 2
1 1663 . 1 1 A 137 137 VAL CB C 137 32.943 32.462 0.481 2
1 1666 . 1 1 A 137 137 VAL N N 137 130.810 129.673 1.136 2
1 1667 . 1 1 A 138 138 ALA H H 138 7.677 7.462 0.215 2
1 1668 . 1 1 A 138 138 ALA HA H 138 4.496 4.705 -0.209 2
1 1672 . 1 1 A 138 138 ALA C C 138 174.405 175.185 -0.780 2
1 1673 . 1 1 A 138 138 ALA CA C 138 52.556 51.681 0.875 2
1 1674 . 1 1 A 138 138 ALA CB C 138 21.874 22.633 -0.759 2
1 1675 . 1 1 A 138 138 ALA N N 138 119.194 118.076 1.118 2
1 1676 . 1 1 A 139 139 ILE H H 139 8.052 8.487 -0.435 2
1 1677 . 1 1 A 139 139 ILE HA H 139 4.640 4.872 -0.232 2
1 1687 . 1 1 A 139 139 ILE C C 139 173.734 174.393 -0.658 2
1 1688 . 1 1 A 139 139 ILE CA C 139 61.623 59.978 1.645 2
1 1689 . 1 1 A 139 139 ILE CB C 139 43.363 41.564 1.799 2
1 1693 . 1 1 A 139 139 ILE N N 139 119.307 120.254 -0.947 2
1 1694 . 1 1 A 140 140 ARG H H 140 8.912 9.000 -0.088 2
1 1695 . 1 1 A 140 140 ARG HA H 140 4.760 4.845 -0.085 2
1 1702 . 1 1 A 140 140 ARG C C 140 174.181 174.841 -0.660 2
1 1703 . 1 1 A 140 140 ARG CA C 140 54.243 54.414 -0.171 2
1 1704 . 1 1 A 140 140 ARG CB C 140 33.438 34.170 -0.732 2
1 1707 . 1 1 A 140 140 ARG N N 140 122.820 127.135 -4.315 2
1 1708 . 1 1 A 141 141 GLU H H 141 8.545 8.483 0.062 2
1 1709 . 1 1 A 141 141 GLU HA H 141 4.254 4.390 -0.136 2
1 1714 . 1 1 A 141 141 GLU C C 141 177.299 176.122 1.177 2
1 1715 . 1 1 A 141 141 GLU CA C 141 57.165 56.442 0.723 2
1 1716 . 1 1 A 141 141 GLU CB C 141 30.048 29.981 0.067 2
1 1718 . 1 1 A 141 141 GLU N N 141 119.458 123.765 -4.307 2
1 1719 . 1 1 A 142 142 ALA H H 142 8.380 8.328 0.052 2
1 1720 . 1 1 A 142 142 ALA HA H 142 4.388 4.488 -0.100 2
1 1724 . 1 1 A 142 142 ALA C C 142 178.495 179.017 -0.522 2
1 1725 . 1 1 A 142 142 ALA CA C 142 51.113 52.101 -0.988 2
1 1726 . 1 1 A 142 142 ALA CB C 142 21.044 19.704 1.340 2
1 1727 . 1 1 A 142 142 ALA N N 142 127.330 127.183 0.147 2
1 1728 . 1 1 A 143 143 THR H H 143 9.502 8.918 0.585 2
1 1729 . 1 1 A 143 143 THR HA H 143 4.362 4.722 -0.360 2
1 1734 . 1 1 A 143 143 THR C C 143 175.241 175.150 0.091 2
1 1735 . 1 1 A 143 143 THR CA C 143 60.541 61.173 -0.632 2
1 1736 . 1 1 A 143 143 THR CB C 143 70.879 68.637 2.242 2
1 1738 . 1 1 A 143 143 THR N N 143 114.561 111.463 3.099 2
1 1739 . 1 1 A 144 144 GLU H H 144 8.787 8.107 0.680 2
1 1740 . 1 1 A 144 144 GLU HA H 144 3.817 3.835 -0.018 2
1 1745 . 1 1 A 144 144 GLU C C 144 179.490 176.668 2.822 2
1 1746 . 1 1 A 144 144 GLU CA C 144 60.102 58.804 1.298 2
1 1747 . 1 1 A 144 144 GLU CB C 144 29.338 27.383 1.955 2
1 1749 . 1 1 A 144 144 GLU N N 144 120.475 115.296 5.179 2
1 1750 . 1 1 A 145 145 GLU H H 145 8.321 8.544 -0.224 2
1 1751 . 1 1 A 145 145 GLU HA H 145 3.899 3.799 0.100 2
1 1756 . 1 1 A 145 145 GLU C C 145 178.521 179.141 -0.620 2
1 1757 . 1 1 A 145 145 GLU CA C 145 59.588 59.072 0.516 2
1 1758 . 1 1 A 145 145 GLU CB C 145 29.658 29.180 0.478 2
1 1760 . 1 1 A 145 145 GLU N N 145 119.761 119.128 0.633 2
1 1761 . 1 1 A 146 146 GLU H H 146 7.514 7.987 -0.473 2
1 1762 . 1 1 A 146 146 GLU HA H 146 3.856 4.094 -0.238 2
1 1767 . 1 1 A 146 146 GLU C C 146 179.189 179.323 -0.134 2
1 1768 . 1 1 A 146 146 GLU CA C 146 59.148 59.093 0.054 2
1 1769 . 1 1 A 146 146 GLU CB C 146 29.834 29.090 0.744 2
1 1771 . 1 1 A 146 146 GLU N N 146 121.118 120.108 1.010 2
1 1772 . 1 1 A 147 147 LEU H H 147 7.823 8.127 -0.304 2
1 1773 . 1 1 A 147 147 LEU HA H 147 3.662 3.913 -0.251 2
1 1783 . 1 1 A 147 147 LEU C C 147 179.341 178.696 0.645 2
1 1784 . 1 1 A 147 147 LEU CA C 147 57.277 57.664 -0.387 2
1 1785 . 1 1 A 147 147 LEU CB C 147 41.239 41.635 -0.396 2
1 1789 . 1 1 A 147 147 LEU N N 147 117.199 120.580 -3.381 2
1 1790 . 1 1 A 148 148 ALA H H 148 7.788 8.604 -0.816 2
1 1791 . 1 1 A 148 148 ALA HA H 148 3.958 4.076 -0.118 2
1 1795 . 1 1 A 148 148 ALA C C 148 179.777 179.129 0.648 2
1 1796 . 1 1 A 148 148 ALA CA C 148 54.509 54.761 -0.252 2
1 1797 . 1 1 A 148 148 ALA CB C 148 18.064 18.239 -0.175 2
1 1798 . 1 1 A 148 148 ALA N N 148 121.696 120.534 1.162 2
1 1799 . 1 1 A 149 149 HIS H H 149 7.726 7.386 0.340 2
1 1800 . 1 1 A 149 149 HIS HA H 149 4.477 4.650 -0.173 2
1 1805 . 1 1 A 149 149 HIS C C 149 176.099 175.521 0.578 2
1 1806 . 1 1 A 149 149 HIS CA C 149 55.802 56.064 -0.262 2
1 1807 . 1 1 A 149 149 HIS CB C 149 30.406 30.349 0.057 2
1 1810 . 1 1 A 149 149 HIS N N 149 114.463 112.927 1.536 2
1 1811 . 1 1 A 150 150 GLY H H 150 8.076 9.083 -1.007 2
1 1812 . 1 1 A 150 150 GLY HA2 H 150 3.927 3.598 0.329 2
1 1813 . 1 1 A 150 150 GLY HA3 H 150 3.237 3.765 -0.528 2
1 1814 . 1 1 A 150 150 GLY C C 150 173.382 173.400 -0.019 2
1 1815 . 1 1 A 150 150 GLY CA C 150 46.117 45.670 0.447 2
1 1816 . 1 1 A 150 150 GLY N N 150 109.417 108.356 1.061 2
1 1817 . 1 1 A 151 151 HIS H H 151 7.518 7.479 0.039 2
1 1818 . 1 1 A 151 151 HIS HA H 151 4.563 4.927 -0.364 2
1 1823 . 1 1 A 151 151 HIS C C 151 173.157 174.191 -1.034 2
1 1824 . 1 1 A 151 151 HIS CA C 151 54.731 54.566 0.165 2
1 1825 . 1 1 A 151 151 HIS CB C 151 31.611 31.806 -0.195 2
1 1828 . 1 1 A 151 151 HIS N N 151 114.828 114.784 0.044 2
1 1829 . 1 1 A 152 152 VAL H H 152 7.931 8.960 -1.029 2
1 1830 . 1 1 A 152 152 VAL HA H 152 3.951 3.723 0.228 2
1 1838 . 1 1 A 152 152 VAL C C 152 175.848 176.029 -0.181 2
1 1839 . 1 1 A 152 152 VAL CA C 152 62.190 65.157 -2.967 2
1 1840 . 1 1 A 152 152 VAL CB C 152 32.703 32.071 0.632 2
1 1843 . 1 1 A 152 152 VAL N N 152 118.551 120.838 -2.287 2
1 1844 . 1 1 A 153 153 HIS H H 153 9.784 8.239 1.545 2
1 1845 . 1 1 A 153 153 HIS HA H 153 4.604 4.344 0.260 2
1 1850 . 1 1 A 153 153 HIS C C 153 175.795 174.729 1.066 2
1 1851 . 1 1 A 153 153 HIS CA C 153 56.753 56.545 0.208 2
1 1852 . 1 1 A 153 153 HIS CB C 153 30.325 29.391 0.934 2
1 1855 . 1 1 A 153 153 HIS N N 153 127.403 120.822 6.581 2
1 1856 . 1 1 A 154 154 GLY H H 154 8.447 8.053 0.394 2
1 1857 . 1 1 A 154 154 GLY HA2 H 154 3.797 3.775 0.022 2
1 1858 . 1 1 A 154 154 GLY HA3 H 154 3.797 3.844 -0.046 2
1 1859 . 1 1 A 154 154 GLY C C 154 173.848 173.852 -0.004 2
1 1860 . 1 1 A 154 154 GLY CA C 154 45.153 45.660 -0.507 2
1 1861 . 1 1 A 154 154 GLY N N 154 112.233 108.254 3.979 2
1 1862 . 1 1 A 155 155 ALA H H 155 8.074 8.114 -0.040 2
1 1863 . 1 1 A 155 155 ALA HA H 155 4.101 4.277 -0.176 2
1 1867 . 1 1 A 155 155 ALA C C 155 177.651 176.828 0.823 2
1 1868 . 1 1 A 155 155 ALA CA C 155 52.795 52.902 -0.107 2
1 1869 . 1 1 A 155 155 ALA CB C 155 19.258 19.641 -0.383 2
1 1870 . 1 1 A 155 155 ALA N N 155 124.092 123.622 0.470 2
1 1871 . 1 1 A 156 156 HIS H H 156 8.201 8.128 0.073 2
1 1872 . 1 1 A 156 156 HIS HA H 156 4.474 4.612 -0.138 2
1 1875 . 1 1 A 156 156 HIS C C 156 174.758 173.970 0.788 2
1 1876 . 1 1 A 156 156 HIS CA C 156 55.756 55.937 -0.181 2
1 1877 . 1 1 A 156 156 HIS CB C 156 30.060 29.777 0.283 2
1 1878 . 1 1 A 156 156 HIS N N 156 118.170 115.786 2.384 2
1 1879 . 1 1 A 157 157 ASP H H 157 8.001 8.300 -0.299 2
1 1880 . 1 1 A 157 157 ASP HA H 157 4.436 4.732 -0.296 2
1 1883 . 1 1 A 157 157 ASP CA C 157 54.185 54.239 -0.053 2
1 1884 . 1 1 A 157 157 ASP CB C 157 41.016 41.754 -0.738 2
1 1885 . 1 1 A 157 157 ASP N N 157 121.683 122.401 -0.718 2
1 1886 . 1 1 A 160 160 HIS HA H 160 4.502 4.827 -0.326 2
1 1889 . 1 1 A 160 160 HIS C C 160 174.722 174.395 0.327 2
1 1890 . 1 1 A 160 160 HIS CA C 160 55.979 55.286 0.693 2
1 1891 . 1 1 A 160 160 HIS CB C 160 30.058 30.929 -0.871 2
1 1892 . 1 1 A 161 161 ASP H H 161 8.270 8.600 -0.330 2
1 1893 . 1 1 A 161 161 ASP HA H 161 4.446 4.806 -0.360 2
1 1896 . 1 1 A 161 161 ASP C C 161 176.107 175.668 0.439 2
1 1897 . 1 1 A 161 161 ASP CA C 161 54.474 53.949 0.525 2
1 1898 . 1 1 A 161 161 ASP CB C 161 40.820 42.709 -1.889 2
1 1899 . 1 1 A 161 161 ASP N N 161 121.957 122.068 -0.111 2
1 1900 . 1 1 A 162 162 HIS H H 162 8.212 8.366 -0.154 2
1 1901 . 1 1 A 162 162 HIS HA H 162 4.289 4.615 -0.326 2
1 1904 . 1 1 A 162 162 HIS C C 162 175.036 174.185 0.851 2
1 1905 . 1 1 A 162 162 HIS CA C 162 56.185 55.898 0.287 2
1 1906 . 1 1 A 162 162 HIS CB C 162 30.108 29.923 0.185 2
1 1907 . 1 1 A 162 162 HIS N N 162 119.766 118.961 0.805 2
1 1908 . 1 1 A 163 163 ASP H H 163 8.163 8.191 -0.028 2
1 1909 . 1 1 A 163 163 ASP HA H 163 4.428 4.489 -0.061 2
1 1912 . 1 1 A 163 163 ASP C C 163 176.161 175.571 0.590 2
1 1913 . 1 1 A 163 163 ASP CA C 163 54.585 54.468 0.117 2
1 1914 . 1 1 A 163 163 ASP CB C 163 40.823 40.878 -0.055 2
1 1915 . 1 1 A 163 163 ASP N N 163 121.265 121.267 -0.002 2
1 1916 . 1 1 A 164 164 HIS H H 164 8.106 8.195 -0.089 2
1 1917 . 1 1 A 164 164 HIS HA H 164 4.422 4.892 -0.470 2
1 1920 . 1 1 A 164 164 HIS C C 164 174.904 174.339 0.565 2
1 1921 . 1 1 A 164 164 HIS CA C 164 56.361 54.534 1.827 2
1 1922 . 1 1 A 164 164 HIS CB C 164 30.305 30.770 -0.465 2
1 1923 . 1 1 A 164 164 HIS N N 164 119.729 117.001 2.728 2
1 1924 . 1 1 A 165 165 ASP H H 165 8.118 8.429 -0.311 2
1 1925 . 1 1 A 165 165 ASP HA H 165 4.394 4.609 -0.215 2
1 1928 . 1 1 A 165 165 ASP C C 165 176.054 175.911 0.143 2
1 1929 . 1 1 A 165 165 ASP CA C 165 54.364 54.816 -0.452 2
1 1930 . 1 1 A 165 165 ASP CB C 165 40.818 42.037 -1.219 2
1 1931 . 1 1 A 165 165 ASP N N 165 121.062 121.085 -0.023 2
1 1932 . 1 1 A 166 166 HIS H H 166 8.092 8.364 -0.272 2
1 1933 . 1 1 A 166 166 HIS CA C 166 56.114 55.956 0.158 2
1 1934 . 1 1 A 166 166 HIS CB C 166 29.702 29.590 0.112 2
1 1935 . 1 1 A 166 166 HIS N N 166 120.001 119.323 0.678 2
1 1936 . 1 1 A 170 170 HIS HA H 170 4.514 4.478 0.036 2
1 1939 . 1 1 A 170 170 HIS C C 170 173.952 174.085 -0.133 2
1 1940 . 1 1 A 170 170 HIS CA C 170 55.995 55.919 0.076 2
1 1941 . 1 1 A 170 170 HIS CB C 170 30.161 30.400 -0.239 2
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