data_16110_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16110
_Entry.PDB_ID 2KDD
_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
1 143 . 1 1 1 A 21 21 LYS H H 225 8.503 8.782 -0.279 1
1 144 . 1 1 1 A 21 21 LYS HA H 225 4.349 4.598 -0.249 1
1 152 . 1 1 1 A 21 21 LYS CA C 225 54.872 56.718 -1.846 1
1 153 . 1 1 1 A 21 21 LYS CB C 225 31.667 35.031 -3.364 1
1 157 . 1 1 1 A 21 21 LYS N N 225 122.563 126.036 -3.473 1
1 158 . 1 1 1 A 22 22 GLU H H 226 7.688 7.802 -0.114 1
1 159 . 1 1 1 A 22 22 GLU HA H 226 4.264 4.536 -0.272 1
1 163 . 1 1 1 A 22 22 GLU CA C 226 55.728 56.072 -0.344 1
1 164 . 1 1 1 A 22 22 GLU CB C 226 30.636 31.084 -0.448 1
1 166 . 1 1 1 A 22 22 GLU N N 226 119.810 119.570 0.240 1
1 167 . 1 1 1 A 23 23 ILE H H 227 8.111 8.222 -0.111 1
1 168 . 1 1 1 A 23 23 ILE HA H 227 4.498 4.541 -0.043 1
1 178 . 1 1 1 A 23 23 ILE CA C 227 60.027 60.164 -0.137 1
1 179 . 1 1 1 A 23 23 ILE CB C 227 38.370 39.498 -1.128 1
1 183 . 1 1 1 A 23 23 ILE N N 227 122.085 124.219 -2.134 1
1 184 . 1 1 1 A 24 24 PHE H H 228 7.818 8.384 -0.566 1
1 185 . 1 1 1 A 24 24 PHE HA H 228 5.467 5.185 0.282 1
1 193 . 1 1 1 A 24 24 PHE CA C 228 54.551 55.852 -1.301 1
1 194 . 1 1 1 A 24 24 PHE CB C 228 41.685 41.377 0.308 1
1 200 . 1 1 1 A 24 24 PHE N N 228 118.840 122.706 -3.866 1
1 201 . 1 1 1 A 25 25 LEU H H 229 9.271 8.939 0.332 1
1 202 . 1 1 1 A 25 25 LEU HA H 229 4.953 5.255 -0.302 1
1 212 . 1 1 1 A 25 25 LEU CA C 229 52.892 53.451 -0.559 1
1 213 . 1 1 1 A 25 25 LEU CB C 229 44.755 44.912 -0.157 1
1 217 . 1 1 1 A 25 25 LEU N N 229 123.803 120.667 3.136 1
1 218 . 1 1 1 A 26 26 THR H H 230 8.493 8.980 -0.487 1
1 219 . 1 1 1 A 26 26 THR HA H 230 5.104 5.653 -0.549 1
1 224 . 1 1 1 A 26 26 THR CA C 230 61.771 60.830 0.941 1
1 225 . 1 1 1 A 26 26 THR CB C 230 68.733 70.438 -1.705 1
1 227 . 1 1 1 A 26 26 THR N N 230 121.119 115.772 5.347 1
1 228 . 1 1 1 A 27 27 VAL H H 231 9.001 8.978 0.023 1
1 229 . 1 1 1 A 27 27 VAL HA H 231 4.600 4.587 0.013 1
1 237 . 1 1 1 A 27 27 VAL CA C 231 56.940 59.282 -2.342 1
1 238 . 1 1 1 A 27 27 VAL CB C 231 33.730 33.004 0.726 1
1 241 . 1 1 1 A 27 27 VAL N N 231 124.749 127.083 -2.334 1
1 242 . 1 1 1 A 28 28 PRO HA H 232 4.661 4.661 0.000 1
1 249 . 1 1 1 A 28 28 PRO CA C 232 62.233 63.059 -0.826 1
1 250 . 1 1 1 A 28 28 PRO CB C 232 31.667 31.610 0.057 1
1 253 . 1 1 1 A 29 29 VAL H H 233 8.171 8.017 0.154 1
1 254 . 1 1 1 A 29 29 VAL HA H 233 4.565 3.892 0.673 1
1 262 . 1 1 1 A 29 29 VAL CA C 233 60.027 63.764 -3.737 1
1 263 . 1 1 1 A 29 29 VAL CB C 233 32.699 31.274 1.425 1
1 266 . 1 1 1 A 29 29 VAL N N 233 116.136 121.678 -5.542 1
1 267 . 1 1 1 A 30 30 GLY H H 234 8.143 8.955 -0.812 1
1 268 . 1 1 1 A 30 30 GLY HA2 H 234 3.824 3.887 -0.063 1
1 269 . 1 1 1 A 30 30 GLY HA3 H 234 4.209 3.887 0.322 1
1 270 . 1 1 1 A 30 30 GLY CA C 234 44.635 47.093 -2.458 1
1 271 . 1 1 1 A 30 30 GLY N N 234 110.455 114.977 -4.522 1
1 272 . 1 1 1 A 32 32 GLY H H 236 8.305 8.214 0.091 1
1 273 . 1 1 1 A 32 32 GLY HA2 H 236 3.836 4.199 -0.363 1
1 274 . 1 1 1 A 32 32 GLY HA3 H 236 4.103 4.199 -0.096 1
1 275 . 1 1 1 A 32 32 GLY CA C 236 44.635 46.319 -1.684 1
1 276 . 1 1 1 A 32 32 GLY N N 236 107.539 108.771 -1.232 1
1 277 . 1 1 1 A 33 33 GLU H H 237 7.583 8.331 -0.748 1
1 278 . 1 1 1 A 33 33 GLU HA H 237 4.564 4.405 0.159 1
1 283 . 1 1 1 A 33 33 GLU CA C 237 54.355 56.693 -2.338 1
1 284 . 1 1 1 A 33 33 GLU CB C 237 30.636 30.472 0.164 1
1 286 . 1 1 1 A 33 33 GLU N N 237 120.218 122.617 -2.399 1
1 287 . 1 1 1 A 34 34 SER H H 238 8.630 8.523 0.107 1
1 288 . 1 1 1 A 34 34 SER HA H 238 5.012 4.804 0.208 1
1 291 . 1 1 1 A 34 34 SER CA C 238 56.915 57.211 -0.296 1
1 292 . 1 1 1 A 34 34 SER CB C 238 64.663 64.018 0.645 1
1 293 . 1 1 1 A 34 34 SER N N 238 116.390 118.706 -2.316 1
1 294 . 1 1 1 A 35 35 LEU H H 239 8.838 8.516 0.322 1
1 295 . 1 1 1 A 35 35 LEU HA H 239 4.577 4.782 -0.205 1
1 305 . 1 1 1 A 35 35 LEU CA C 239 52.808 53.616 -0.808 1
1 306 . 1 1 1 A 35 35 LEU CB C 239 44.156 43.037 1.119 1
1 310 . 1 1 1 A 35 35 LEU N N 239 124.463 124.187 0.276 1
1 311 . 1 1 1 A 36 36 ARG H H 240 8.526 8.843 -0.317 1
1 312 . 1 1 1 A 36 36 ARG HA H 240 5.077 4.901 0.176 1
1 318 . 1 1 1 A 36 36 ARG CA C 240 54.483 54.814 -0.331 1
1 319 . 1 1 1 A 36 36 ARG CB C 240 30.777 31.682 -0.905 1
1 322 . 1 1 1 A 36 36 ARG N N 240 124.891 123.647 1.244 1
1 323 . 1 1 1 A 37 37 LEU H H 241 9.179 8.748 0.431 1
1 324 . 1 1 1 A 37 37 LEU HA H 241 4.740 5.034 -0.294 1
1 334 . 1 1 1 A 37 37 LEU CA C 241 52.292 53.560 -1.268 1
1 335 . 1 1 1 A 37 37 LEU CB C 241 43.208 44.963 -1.755 1
1 339 . 1 1 1 A 37 37 LEU N N 241 126.203 129.115 -2.912 1
1 340 . 1 1 1 A 38 38 LEU H H 242 8.825 8.545 0.280 1
1 341 . 1 1 1 A 38 38 LEU HA H 242 4.371 4.593 -0.222 1
1 351 . 1 1 1 A 38 38 LEU CA C 242 54.508 54.883 -0.375 1
1 352 . 1 1 1 A 38 38 LEU CB C 242 41.583 42.160 -0.577 1
1 356 . 1 1 1 A 38 38 LEU N N 242 124.999 128.256 -3.257 1
1 357 . 1 1 1 A 39 39 ALA H H 243 8.634 9.227 -0.593 1
1 358 . 1 1 1 A 39 39 ALA HA H 243 3.799 4.182 -0.383 1
1 362 . 1 1 1 A 39 39 ALA CA C 243 54.852 54.376 0.476 1
1 363 . 1 1 1 A 39 39 ALA CB C 243 18.243 18.693 -0.450 1
1 364 . 1 1 1 A 39 39 ALA N N 243 125.146 125.557 -0.411 1
1 365 . 1 1 1 A 40 40 SER H H 244 8.414 7.937 0.477 1
1 366 . 1 1 1 A 40 40 SER HA H 244 4.074 4.292 -0.218 1
1 369 . 1 1 1 A 40 40 SER CA C 244 58.977 60.569 -1.592 1
1 370 . 1 1 1 A 40 40 SER CB C 244 61.561 62.715 -1.154 1
1 371 . 1 1 1 A 40 40 SER N N 244 109.494 112.955 -3.461 1
1 372 . 1 1 1 A 41 41 ASP H H 245 7.434 7.242 0.192 1
1 373 . 1 1 1 A 41 41 ASP HA H 245 4.809 4.778 0.031 1
1 376 . 1 1 1 A 41 41 ASP CA C 245 52.990 54.827 -1.837 1
1 377 . 1 1 1 A 41 41 ASP CB C 245 41.792 43.102 -1.310 1
1 378 . 1 1 1 A 41 41 ASP N N 245 120.452 119.506 0.946 1
1 379 . 1 1 1 A 42 42 LEU H H 246 7.338 8.082 -0.744 1
1 380 . 1 1 1 A 42 42 LEU HA H 246 4.098 3.963 0.135 1
1 389 . 1 1 1 A 42 42 LEU CA C 246 55.068 55.671 -0.603 1
1 390 . 1 1 1 A 42 42 LEU CB C 246 41.861 40.606 1.255 1
1 393 . 1 1 1 A 42 42 LEU N N 246 121.293 120.080 1.213 1
1 394 . 1 1 1 A 43 43 GLN H H 247 8.170 8.087 0.083 1
1 395 . 1 1 1 A 43 43 GLN HA H 247 4.532 4.228 0.304 1
1 401 . 1 1 1 A 43 43 GLN CA C 247 53.005 56.091 -3.086 1
1 402 . 1 1 1 A 43 43 GLN CB C 247 30.978 28.750 2.228 1
1 404 . 1 1 1 A 43 43 GLN N N 247 122.477 121.915 0.562 1
1 406 . 1 1 1 A 44 44 ARG HA H 248 3.753 3.965 -0.212 1
1 412 . 1 1 1 A 44 44 ARG CA C 248 59.812 59.035 0.777 1
1 413 . 1 1 1 A 44 44 ARG CB C 248 29.306 29.933 -0.627 1
1 416 . 1 1 1 A 45 45 HIS H H 249 8.364 8.265 0.099 1
1 417 . 1 1 1 A 45 45 HIS HA H 249 4.294 4.286 0.008 1
1 422 . 1 1 1 A 45 45 HIS CA C 249 58.462 59.215 -0.753 1
1 423 . 1 1 1 A 45 45 HIS CB C 249 29.071 28.517 0.554 1
1 424 . 1 1 1 A 45 45 HIS N N 249 114.528 117.103 -2.575 1
1 425 . 1 1 1 A 46 46 SER H H 250 7.020 7.622 -0.602 1
1 426 . 1 1 1 A 46 46 SER HA H 250 4.153 4.479 -0.326 1
1 428 . 1 1 1 A 46 46 SER CA C 250 59.493 61.450 -1.957 1
1 429 . 1 1 1 A 46 46 SER CB C 250 62.071 62.521 -0.450 1
1 430 . 1 1 1 A 46 46 SER N N 250 113.900 115.257 -1.357 1
1 431 . 1 1 1 A 47 47 ILE H H 251 7.106 7.424 -0.318 1
1 432 . 1 1 1 A 47 47 ILE HA H 251 3.994 3.931 0.063 1
1 441 . 1 1 1 A 47 47 ILE CA C 251 60.337 63.318 -2.981 1
1 442 . 1 1 1 A 47 47 ILE CB C 251 36.727 37.788 -1.061 1
1 446 . 1 1 1 A 47 47 ILE N N 251 115.759 121.205 -5.446 1
1 447 . 1 1 1 A 48 48 ALA H H 252 8.117 7.633 0.484 1
1 448 . 1 1 1 A 48 48 ALA HA H 252 3.979 4.234 -0.255 1
1 452 . 1 1 1 A 48 48 ALA CA C 252 53.821 52.931 0.890 1
1 453 . 1 1 1 A 48 48 ALA CB C 252 17.727 18.474 -0.747 1
1 454 . 1 1 1 A 48 48 ALA N N 252 120.091 122.411 -2.320 1
1 455 . 1 1 1 A 49 49 GLN H H 253 7.346 7.991 -0.645 1
1 456 . 1 1 1 A 49 49 GLN HA H 253 4.324 4.362 -0.038 1
1 463 . 1 1 1 A 49 49 GLN CA C 253 54.552 55.434 -0.882 1
1 464 . 1 1 1 A 49 49 GLN CB C 253 28.255 28.745 -0.490 1
1 466 . 1 1 1 A 49 49 GLN N N 253 112.219 114.968 -2.749 1
1 468 . 1 1 1 A 50 50 LEU H H 254 7.243 6.966 0.277 1
1 469 . 1 1 1 A 50 50 LEU HA H 254 4.198 4.416 -0.218 1
1 479 . 1 1 1 A 50 50 LEU CA C 254 53.971 54.630 -0.659 1
1 480 . 1 1 1 A 50 50 LEU CB C 254 41.662 42.221 -0.559 1
1 484 . 1 1 1 A 50 50 LEU N N 254 120.510 122.545 -2.035 1
1 485 . 1 1 1 A 51 51 ASP H H 255 8.210 8.455 -0.245 1
1 486 . 1 1 1 A 51 51 ASP HA H 255 4.664 5.048 -0.384 1
1 489 . 1 1 1 A 51 51 ASP CA C 255 52.490 52.041 0.449 1
1 490 . 1 1 1 A 51 51 ASP CB C 255 40.259 41.660 -1.401 1
1 491 . 1 1 1 A 51 51 ASP N N 255 119.691 119.818 -0.127 1
1 492 . 1 1 1 A 52 52 PRO HA H 256 4.125 4.327 -0.202 1
1 499 . 1 1 1 A 52 52 PRO CA C 256 65.380 65.733 -0.353 1
1 500 . 1 1 1 A 52 52 PRO CB C 256 31.865 31.771 0.094 1
1 503 . 1 1 1 A 53 53 GLU H H 257 8.432 8.212 0.220 1
1 504 . 1 1 1 A 53 53 GLU HA H 257 4.073 4.132 -0.059 1
1 508 . 1 1 1 A 53 53 GLU CA C 257 58.677 59.408 -0.731 1
1 509 . 1 1 1 A 53 53 GLU CB C 257 28.771 29.150 -0.379 1
1 511 . 1 1 1 A 53 53 GLU N N 257 119.483 118.065 1.418 1
1 512 . 1 1 1 A 54 54 ALA H H 258 7.967 7.910 0.057 1
1 513 . 1 1 1 A 54 54 ALA HA H 258 4.240 3.998 0.242 1
1 517 . 1 1 1 A 54 54 ALA CA C 258 54.552 55.176 -0.624 1
1 518 . 1 1 1 A 54 54 ALA CB C 258 18.699 18.655 0.044 1
1 519 . 1 1 1 A 54 54 ALA N N 258 124.293 122.726 1.567 1
1 520 . 1 1 1 A 55 55 LEU H H 259 8.695 8.238 0.457 1
1 521 . 1 1 1 A 55 55 LEU HA H 259 3.902 3.931 -0.029 1
1 530 . 1 1 1 A 55 55 LEU CA C 259 57.130 58.081 -0.951 1
1 531 . 1 1 1 A 55 55 LEU CB C 259 41.192 41.756 -0.564 1
1 535 . 1 1 1 A 55 55 LEU N N 259 118.361 118.584 -0.223 1
1 536 . 1 1 1 A 56 56 GLY H H 260 8.177 7.898 0.279 1
1 537 . 1 1 1 A 56 56 GLY HA2 H 260 3.723 3.759 -0.036 1
1 538 . 1 1 1 A 56 56 GLY HA3 H 260 3.971 3.759 0.212 1
1 539 . 1 1 1 A 56 56 GLY CA C 260 46.302 47.330 -1.028 1
1 540 . 1 1 1 A 56 56 GLY N N 260 105.789 106.431 -0.642 1
1 541 . 1 1 1 A 57 57 ASN H H 261 7.914 7.373 0.541 1
1 542 . 1 1 1 A 57 57 ASN HA H 261 4.643 4.430 0.213 1
1 547 . 1 1 1 A 57 57 ASN CA C 261 54.945 55.697 -0.752 1
1 548 . 1 1 1 A 57 57 ASN CB C 261 37.533 38.600 -1.067 1
1 549 . 1 1 1 A 57 57 ASN N N 261 121.132 119.624 1.508 1
1 551 . 1 1 1 A 58 58 ILE H H 262 8.732 8.182 0.550 1
1 552 . 1 1 1 A 58 58 ILE HA H 262 3.712 3.638 0.074 1
1 562 . 1 1 1 A 58 58 ILE CA C 262 63.820 64.947 -1.127 1
1 563 . 1 1 1 A 58 58 ILE CB C 262 35.990 38.185 -2.195 1
1 567 . 1 1 1 A 58 58 ILE N N 262 125.309 120.794 4.515 1
1 568 . 1 1 1 A 59 59 LYS H H 263 8.416 8.116 0.300 1
1 569 . 1 1 1 A 59 59 LYS HA H 263 4.075 3.884 0.191 1
1 577 . 1 1 1 A 59 59 LYS CA C 263 59.708 60.472 -0.764 1
1 578 . 1 1 1 A 59 59 LYS CB C 263 31.343 32.414 -1.071 1
1 582 . 1 1 1 A 59 59 LYS N N 263 122.080 118.636 3.444 1
1 583 . 1 1 1 A 60 60 LYS H H 264 7.793 7.386 0.407 1
1 584 . 1 1 1 A 60 60 LYS HA H 264 4.036 4.030 0.006 1
1 591 . 1 1 1 A 60 60 LYS CA C 264 59.708 59.147 0.561 1
1 592 . 1 1 1 A 60 60 LYS CB C 264 31.865 31.914 -0.049 1
1 596 . 1 1 1 A 60 60 LYS N N 264 119.503 119.633 -0.130 1
1 597 . 1 1 1 A 61 61 LEU H H 265 7.797 8.021 -0.224 1
1 598 . 1 1 1 A 61 61 LEU HA H 265 4.106 4.037 0.069 1
1 608 . 1 1 1 A 61 61 LEU CA C 265 57.646 58.181 -0.535 1
1 609 . 1 1 1 A 61 61 LEU CB C 265 40.177 41.428 -1.251 1
1 613 . 1 1 1 A 61 61 LEU N N 265 121.392 122.303 -0.911 1
1 614 . 1 1 1 A 62 62 SER H H 266 8.775 7.922 0.853 1
1 615 . 1 1 1 A 62 62 SER HA H 266 4.001 4.173 -0.172 1
1 619 . 1 1 1 A 62 62 SER CA C 266 60.224 61.412 -1.188 1
1 620 . 1 1 1 A 62 62 SER CB C 266 62.758 62.849 -0.091 1
1 621 . 1 1 1 A 62 62 SER N N 266 112.902 114.528 -1.626 1
1 622 . 1 1 1 A 63 63 ASN H H 267 8.199 8.035 0.164 1
1 623 . 1 1 1 A 63 63 ASN HA H 267 4.393 4.394 -0.001 1
1 628 . 1 1 1 A 63 63 ASN CA C 267 55.583 56.585 -1.002 1
1 629 . 1 1 1 A 63 63 ASN CB C 267 37.537 38.102 -0.565 1
1 630 . 1 1 1 A 63 63 ASN N N 267 117.813 120.200 -2.387 1
1 632 . 1 1 1 A 64 64 ARG H H 268 8.000 7.839 0.161 1
1 633 . 1 1 1 A 64 64 ARG HA H 268 4.118 4.110 0.008 1
1 640 . 1 1 1 A 64 64 ARG CA C 268 57.646 58.916 -1.270 1
1 641 . 1 1 1 A 64 64 ARG CB C 268 29.307 30.076 -0.769 1
1 644 . 1 1 1 A 64 64 ARG N N 268 120.911 120.964 -0.053 1
1 645 . 1 1 1 A 65 65 LEU H H 269 9.119 7.951 1.168 1
1 646 . 1 1 1 A 65 65 LEU HA H 269 3.916 4.070 -0.154 1
1 656 . 1 1 1 A 65 65 LEU CA C 269 57.124 58.019 -0.895 1
1 657 . 1 1 1 A 65 65 LEU CB C 269 41.662 41.344 0.318 1
1 661 . 1 1 1 A 65 65 LEU N N 269 119.046 120.734 -1.688 1
1 662 . 1 1 1 A 66 66 ALA H H 270 8.245 8.518 -0.273 1
1 663 . 1 1 1 A 66 66 ALA HA H 270 3.997 3.898 0.099 1
1 667 . 1 1 1 A 66 66 ALA CA C 270 54.337 55.064 -0.727 1
1 668 . 1 1 1 A 66 66 ALA CB C 270 16.696 18.221 -1.525 1
1 669 . 1 1 1 A 66 66 ALA N N 270 121.047 120.881 0.166 1
1 670 . 1 1 1 A 67 67 GLN H H 271 7.704 7.555 0.149 1
1 671 . 1 1 1 A 67 67 GLN HA H 271 4.025 4.094 -0.069 1
1 678 . 1 1 1 A 67 67 GLN CA C 271 58.418 59.012 -0.594 1
1 679 . 1 1 1 A 67 67 GLN CB C 271 27.996 28.181 -0.185 1
1 681 . 1 1 1 A 67 67 GLN N N 271 118.440 117.276 1.164 1
1 683 . 1 1 1 A 68 68 ILE H H 272 8.142 7.813 0.329 1
1 684 . 1 1 1 A 68 68 ILE HA H 272 3.723 3.682 0.041 1
1 694 . 1 1 1 A 68 68 ILE CA C 272 64.605 65.660 -1.055 1
1 695 . 1 1 1 A 68 68 ILE CB C 272 37.793 37.758 0.035 1
1 699 . 1 1 1 A 68 68 ILE N N 272 119.521 119.439 0.082 1
1 700 . 1 1 1 A 69 69 CYS H H 273 8.817 7.993 0.824 1
1 701 . 1 1 1 A 69 69 CYS HA H 273 3.958 4.064 -0.106 1
1 704 . 1 1 1 A 69 69 CYS CA C 273 64.204 62.742 1.462 1
1 705 . 1 1 1 A 69 69 CYS CB C 273 26.337 26.959 -0.622 1
1 706 . 1 1 1 A 69 69 CYS N N 273 117.234 119.086 -1.852 1
1 707 . 1 1 1 A 70 70 SER H H 274 7.880 8.261 -0.381 1
1 708 . 1 1 1 A 70 70 SER HA H 274 4.246 4.318 -0.072 1
1 710 . 1 1 1 A 70 70 SER CA C 274 60.008 61.534 -1.526 1
1 711 . 1 1 1 A 70 70 SER CB C 274 62.071 62.498 -0.427 1
1 712 . 1 1 1 A 70 70 SER N N 274 114.227 117.429 -3.202 1
1 713 . 1 1 1 A 71 71 SER H H 275 7.609 7.729 -0.120 1
1 714 . 1 1 1 A 71 71 SER HA H 275 4.564 4.362 0.202 1
1 717 . 1 1 1 A 71 71 SER CA C 275 57.946 61.967 -4.021 1
1 718 . 1 1 1 A 71 71 SER CB C 275 63.618 63.081 0.537 1
1 719 . 1 1 1 A 71 71 SER N N 275 114.958 114.820 0.138 1
1 720 . 1 1 1 A 72 72 ILE H H 276 7.357 7.612 -0.255 1
1 721 . 1 1 1 A 72 72 ILE HA H 276 4.169 4.044 0.125 1
1 731 . 1 1 1 A 72 72 ILE CA C 276 60.967 61.758 -0.791 1
1 732 . 1 1 1 A 72 72 ILE CB C 276 38.276 38.183 0.093 1
1 736 . 1 1 1 A 72 72 ILE N N 276 123.513 121.182 2.331 1
1 737 . 1 1 1 A 73 73 ARG H H 277 8.508 8.601 -0.093 1
1 738 . 1 1 1 A 73 73 ARG HA H 277 4.446 4.762 -0.316 1
1 744 . 1 1 1 A 73 73 ARG CA C 277 55.324 55.338 -0.014 1
1 745 . 1 1 1 A 73 73 ARG CB C 277 30.499 30.359 0.140 1
1 748 . 1 1 1 A 73 73 ARG N N 277 126.709 126.710 -0.001 1
1 749 . 1 1 1 A 75 75 HIS HA H 279 4.602 4.616 -0.014 1
1 754 . 1 1 1 A 75 75 HIS CA C 279 55.840 56.754 -0.914 1
1 755 . 1 1 1 A 75 75 HIS CB C 279 30.426 30.439 -0.013 1
1 143 . 2 1 1 A 21 21 LYS H H 225 8.503 8.823 -0.320 1
1 144 . 2 1 1 A 21 21 LYS HA H 225 4.349 4.665 -0.316 1
1 152 . 2 1 1 A 21 21 LYS CA C 225 54.872 56.342 -1.470 1
1 153 . 2 1 1 A 21 21 LYS CB C 225 31.667 33.960 -2.293 1
1 157 . 2 1 1 A 21 21 LYS N N 225 122.563 123.114 -0.551 1
1 158 . 2 1 1 A 22 22 GLU H H 226 7.688 7.713 -0.025 1
1 159 . 2 1 1 A 22 22 GLU HA H 226 4.264 4.616 -0.352 1
1 163 . 2 1 1 A 22 22 GLU CA C 226 55.728 55.780 -0.052 1
1 164 . 2 1 1 A 22 22 GLU CB C 226 30.636 31.301 -0.665 1
1 166 . 2 1 1 A 22 22 GLU N N 226 119.810 118.222 1.588 1
1 167 . 2 1 1 A 23 23 ILE H H 227 8.111 8.248 -0.137 1
1 168 . 2 1 1 A 23 23 ILE HA H 227 4.498 4.554 -0.056 1
1 178 . 2 1 1 A 23 23 ILE CA C 227 60.027 60.172 -0.145 1
1 179 . 2 1 1 A 23 23 ILE CB C 227 38.370 39.509 -1.139 1
1 183 . 2 1 1 A 23 23 ILE N N 227 122.085 123.915 -1.830 1
1 184 . 2 1 1 A 24 24 PHE H H 228 7.818 8.351 -0.533 1
1 185 . 2 1 1 A 24 24 PHE HA H 228 5.467 5.189 0.278 1
1 193 . 2 1 1 A 24 24 PHE CA C 228 54.551 55.932 -1.381 1
1 194 . 2 1 1 A 24 24 PHE CB C 228 41.685 41.132 0.553 1
1 200 . 2 1 1 A 24 24 PHE N N 228 118.840 122.661 -3.821 1
1 201 . 2 1 1 A 25 25 LEU H H 229 9.271 8.704 0.567 1
1 202 . 2 1 1 A 25 25 LEU HA H 229 4.953 5.284 -0.331 1
1 212 . 2 1 1 A 25 25 LEU CA C 229 52.892 53.575 -0.683 1
1 213 . 2 1 1 A 25 25 LEU CB C 229 44.755 44.954 -0.199 1
1 217 . 2 1 1 A 25 25 LEU N N 229 123.803 120.314 3.489 1
1 218 . 2 1 1 A 26 26 THR H H 230 8.493 8.986 -0.493 1
1 219 . 2 1 1 A 26 26 THR HA H 230 5.104 5.611 -0.507 1
1 224 . 2 1 1 A 26 26 THR CA C 230 61.771 60.954 0.817 1
1 225 . 2 1 1 A 26 26 THR CB C 230 68.733 70.448 -1.715 1
1 227 . 2 1 1 A 26 26 THR N N 230 121.119 115.348 5.771 1
1 228 . 2 1 1 A 27 27 VAL H H 231 9.001 8.918 0.083 1
1 229 . 2 1 1 A 27 27 VAL HA H 231 4.600 4.563 0.037 1
1 237 . 2 1 1 A 27 27 VAL CA C 231 56.940 59.359 -2.419 1
1 238 . 2 1 1 A 27 27 VAL CB C 231 33.730 32.916 0.814 1
1 241 . 2 1 1 A 27 27 VAL N N 231 124.749 127.114 -2.365 1
1 242 . 2 1 1 A 28 28 PRO HA H 232 4.661 4.856 -0.195 1
1 249 . 2 1 1 A 28 28 PRO CA C 232 62.233 62.921 -0.688 1
1 250 . 2 1 1 A 28 28 PRO CB C 232 31.667 31.514 0.153 1
1 253 . 2 1 1 A 29 29 VAL H H 233 8.171 8.360 -0.189 1
1 254 . 2 1 1 A 29 29 VAL HA H 233 4.565 3.941 0.624 1
1 262 . 2 1 1 A 29 29 VAL CA C 233 60.027 63.660 -3.633 1
1 263 . 2 1 1 A 29 29 VAL CB C 233 32.699 31.253 1.446 1
1 266 . 2 1 1 A 29 29 VAL N N 233 116.136 121.493 -5.357 1
1 267 . 2 1 1 A 30 30 GLY H H 234 8.143 8.648 -0.505 1
1 268 . 2 1 1 A 30 30 GLY HA2 H 234 3.824 3.947 -0.123 1
1 269 . 2 1 1 A 30 30 GLY HA3 H 234 4.209 3.947 0.262 1
1 270 . 2 1 1 A 30 30 GLY CA C 234 44.635 46.239 -1.604 1
1 271 . 2 1 1 A 30 30 GLY N N 234 110.455 115.618 -5.163 1
1 272 . 2 1 1 A 32 32 GLY H H 236 8.305 8.402 -0.097 1
1 273 . 2 1 1 A 32 32 GLY HA2 H 236 3.836 4.019 -0.183 1
1 274 . 2 1 1 A 32 32 GLY HA3 H 236 4.103 4.019 0.084 1
1 275 . 2 1 1 A 32 32 GLY CA C 236 44.635 45.356 -0.721 1
1 276 . 2 1 1 A 32 32 GLY N N 236 107.539 110.155 -2.616 1
1 277 . 2 1 1 A 33 33 GLU H H 237 7.583 8.032 -0.449 1
1 278 . 2 1 1 A 33 33 GLU HA H 237 4.564 4.789 -0.225 1
1 283 . 2 1 1 A 33 33 GLU CA C 237 54.355 55.076 -0.721 1
1 284 . 2 1 1 A 33 33 GLU CB C 237 30.636 32.272 -1.636 1
1 286 . 2 1 1 A 33 33 GLU N N 237 120.218 120.993 -0.775 1
1 287 . 2 1 1 A 34 34 SER H H 238 8.630 8.914 -0.284 1
1 288 . 2 1 1 A 34 34 SER HA H 238 5.012 5.083 -0.071 1
1 291 . 2 1 1 A 34 34 SER CA C 238 56.915 56.846 0.069 1
1 292 . 2 1 1 A 34 34 SER CB C 238 64.663 64.469 0.194 1
1 293 . 2 1 1 A 34 34 SER N N 238 116.390 118.638 -2.248 1
1 294 . 2 1 1 A 35 35 LEU H H 239 8.838 8.581 0.257 1
1 295 . 2 1 1 A 35 35 LEU HA H 239 4.577 4.720 -0.143 1
1 305 . 2 1 1 A 35 35 LEU CA C 239 52.808 53.994 -1.186 1
1 306 . 2 1 1 A 35 35 LEU CB C 239 44.156 43.173 0.983 1
1 310 . 2 1 1 A 35 35 LEU N N 239 124.463 125.605 -1.142 1
1 311 . 2 1 1 A 36 36 ARG H H 240 8.526 8.833 -0.307 1
1 312 . 2 1 1 A 36 36 ARG HA H 240 5.077 4.897 0.180 1
1 318 . 2 1 1 A 36 36 ARG CA C 240 54.483 54.721 -0.238 1
1 319 . 2 1 1 A 36 36 ARG CB C 240 30.777 31.726 -0.949 1
1 322 . 2 1 1 A 36 36 ARG N N 240 124.891 123.896 0.995 1
1 323 . 2 1 1 A 37 37 LEU H H 241 9.179 8.640 0.539 1
1 324 . 2 1 1 A 37 37 LEU HA H 241 4.740 5.053 -0.313 1
1 334 . 2 1 1 A 37 37 LEU CA C 241 52.292 53.567 -1.275 1
1 335 . 2 1 1 A 37 37 LEU CB C 241 43.208 45.603 -2.395 1
1 339 . 2 1 1 A 37 37 LEU N N 241 126.203 128.939 -2.736 1
1 340 . 2 1 1 A 38 38 LEU H H 242 8.825 8.564 0.261 1
1 341 . 2 1 1 A 38 38 LEU HA H 242 4.371 4.627 -0.256 1
1 351 . 2 1 1 A 38 38 LEU CA C 242 54.508 54.732 -0.224 1
1 352 . 2 1 1 A 38 38 LEU CB C 242 41.583 42.161 -0.578 1
1 356 . 2 1 1 A 38 38 LEU N N 242 124.999 127.678 -2.679 1
1 357 . 2 1 1 A 39 39 ALA H H 243 8.634 9.287 -0.653 1
1 358 . 2 1 1 A 39 39 ALA HA H 243 3.799 3.990 -0.191 1
1 362 . 2 1 1 A 39 39 ALA CA C 243 54.852 55.097 -0.245 1
1 363 . 2 1 1 A 39 39 ALA CB C 243 18.243 18.448 -0.205 1
1 364 . 2 1 1 A 39 39 ALA N N 243 125.146 126.258 -1.112 1
1 365 . 2 1 1 A 40 40 SER H H 244 8.414 8.042 0.372 1
1 366 . 2 1 1 A 40 40 SER HA H 244 4.074 4.292 -0.218 1
1 369 . 2 1 1 A 40 40 SER CA C 244 58.977 60.750 -1.773 1
1 370 . 2 1 1 A 40 40 SER CB C 244 61.561 63.077 -1.516 1
1 371 . 2 1 1 A 40 40 SER N N 244 109.494 111.761 -2.267 1
1 372 . 2 1 1 A 41 41 ASP H H 245 7.434 7.929 -0.495 1
1 373 . 2 1 1 A 41 41 ASP HA H 245 4.809 4.908 -0.099 1
1 376 . 2 1 1 A 41 41 ASP CA C 245 52.990 53.033 -0.043 1
1 377 . 2 1 1 A 41 41 ASP CB C 245 41.792 41.717 0.075 1
1 378 . 2 1 1 A 41 41 ASP N N 245 120.452 120.626 -0.174 1
1 379 . 2 1 1 A 42 42 LEU H H 246 7.338 8.523 -1.185 1
1 380 . 2 1 1 A 42 42 LEU HA H 246 4.098 4.283 -0.185 1
1 389 . 2 1 1 A 42 42 LEU CA C 246 55.068 56.129 -1.061 1
1 390 . 2 1 1 A 42 42 LEU CB C 246 41.861 42.347 -0.486 1
1 393 . 2 1 1 A 42 42 LEU N N 246 121.293 124.751 -3.458 1
1 394 . 2 1 1 A 43 43 GLN H H 247 8.170 8.747 -0.577 1
1 395 . 2 1 1 A 43 43 GLN HA H 247 4.532 4.461 0.071 1
1 401 . 2 1 1 A 43 43 GLN CA C 247 53.005 54.859 -1.854 1
1 402 . 2 1 1 A 43 43 GLN CB C 247 30.978 29.842 1.136 1
1 404 . 2 1 1 A 43 43 GLN N N 247 122.477 126.195 -3.718 1
1 406 . 2 1 1 A 44 44 ARG HA H 248 3.753 3.988 -0.235 1
1 412 . 2 1 1 A 44 44 ARG CA C 248 59.812 58.919 0.893 1
1 413 . 2 1 1 A 44 44 ARG CB C 248 29.306 29.942 -0.636 1
1 416 . 2 1 1 A 45 45 HIS H H 249 8.364 8.150 0.214 1
1 417 . 2 1 1 A 45 45 HIS HA H 249 4.294 4.299 -0.005 1
1 422 . 2 1 1 A 45 45 HIS CA C 249 58.462 59.188 -0.726 1
1 423 . 2 1 1 A 45 45 HIS CB C 249 29.071 28.321 0.750 1
1 424 . 2 1 1 A 45 45 HIS N N 249 114.528 117.117 -2.589 1
1 425 . 2 1 1 A 46 46 SER H H 250 7.020 7.734 -0.714 1
1 426 . 2 1 1 A 46 46 SER HA H 250 4.153 4.002 0.151 1
1 428 . 2 1 1 A 46 46 SER CA C 250 59.493 61.151 -1.658 1
1 429 . 2 1 1 A 46 46 SER CB C 250 62.071 62.921 -0.850 1
1 430 . 2 1 1 A 46 46 SER N N 250 113.900 114.898 -0.998 1
1 431 . 2 1 1 A 47 47 ILE H H 251 7.106 7.348 -0.242 1
1 432 . 2 1 1 A 47 47 ILE HA H 251 3.994 4.137 -0.143 1
1 441 . 2 1 1 A 47 47 ILE CA C 251 60.337 62.264 -1.927 1
1 442 . 2 1 1 A 47 47 ILE CB C 251 36.727 38.390 -1.663 1
1 446 . 2 1 1 A 47 47 ILE N N 251 115.759 119.695 -3.936 1
1 447 . 2 1 1 A 48 48 ALA H H 252 8.117 7.729 0.388 1
1 448 . 2 1 1 A 48 48 ALA HA H 252 3.979 4.233 -0.254 1
1 452 . 2 1 1 A 48 48 ALA CA C 252 53.821 52.634 1.187 1
1 453 . 2 1 1 A 48 48 ALA CB C 252 17.727 19.204 -1.477 1
1 454 . 2 1 1 A 48 48 ALA N N 252 120.091 123.181 -3.090 1
1 455 . 2 1 1 A 49 49 GLN H H 253 7.346 7.623 -0.277 1
1 456 . 2 1 1 A 49 49 GLN HA H 253 4.324 4.452 -0.128 1
1 463 . 2 1 1 A 49 49 GLN CA C 253 54.552 55.330 -0.778 1
1 464 . 2 1 1 A 49 49 GLN CB C 253 28.255 29.833 -1.578 1
1 466 . 2 1 1 A 49 49 GLN N N 253 112.219 116.451 -4.232 1
1 468 . 2 1 1 A 50 50 LEU H H 254 7.243 7.380 -0.137 1
1 469 . 2 1 1 A 50 50 LEU HA H 254 4.198 4.443 -0.245 1
1 479 . 2 1 1 A 50 50 LEU CA C 254 53.971 54.506 -0.535 1
1 480 . 2 1 1 A 50 50 LEU CB C 254 41.662 42.462 -0.800 1
1 484 . 2 1 1 A 50 50 LEU N N 254 120.510 121.654 -1.144 1
1 485 . 2 1 1 A 51 51 ASP H H 255 8.210 8.492 -0.282 1
1 486 . 2 1 1 A 51 51 ASP HA H 255 4.664 5.113 -0.449 1
1 489 . 2 1 1 A 51 51 ASP CA C 255 52.490 50.965 1.525 1
1 490 . 2 1 1 A 51 51 ASP CB C 255 40.259 41.370 -1.111 1
1 491 . 2 1 1 A 51 51 ASP N N 255 119.691 119.336 0.355 1
1 492 . 2 1 1 A 52 52 PRO HA H 256 4.125 4.304 -0.179 1
1 499 . 2 1 1 A 52 52 PRO CA C 256 65.380 65.664 -0.284 1
1 500 . 2 1 1 A 52 52 PRO CB C 256 31.865 31.697 0.168 1
1 503 . 2 1 1 A 53 53 GLU H H 257 8.432 8.330 0.102 1
1 504 . 2 1 1 A 53 53 GLU HA H 257 4.073 4.117 -0.044 1
1 508 . 2 1 1 A 53 53 GLU CA C 257 58.677 59.475 -0.798 1
1 509 . 2 1 1 A 53 53 GLU CB C 257 28.771 29.180 -0.409 1
1 511 . 2 1 1 A 53 53 GLU N N 257 119.483 118.121 1.362 1
1 512 . 2 1 1 A 54 54 ALA H H 258 7.967 7.853 0.114 1
1 513 . 2 1 1 A 54 54 ALA HA H 258 4.240 3.988 0.252 1
1 517 . 2 1 1 A 54 54 ALA CA C 258 54.552 55.183 -0.631 1
1 518 . 2 1 1 A 54 54 ALA CB C 258 18.699 18.654 0.045 1
1 519 . 2 1 1 A 54 54 ALA N N 258 124.293 122.591 1.702 1
1 520 . 2 1 1 A 55 55 LEU H H 259 8.695 8.296 0.399 1
1 521 . 2 1 1 A 55 55 LEU HA H 259 3.902 3.940 -0.038 1
1 530 . 2 1 1 A 55 55 LEU CA C 259 57.130 58.078 -0.948 1
1 531 . 2 1 1 A 55 55 LEU CB C 259 41.192 41.713 -0.521 1
1 535 . 2 1 1 A 55 55 LEU N N 259 118.361 118.615 -0.254 1
1 536 . 2 1 1 A 56 56 GLY H H 260 8.177 7.947 0.230 1
1 537 . 2 1 1 A 56 56 GLY HA2 H 260 3.723 3.748 -0.025 1
1 538 . 2 1 1 A 56 56 GLY HA3 H 260 3.971 3.748 0.223 1
1 539 . 2 1 1 A 56 56 GLY CA C 260 46.302 47.318 -1.016 1
1 540 . 2 1 1 A 56 56 GLY N N 260 105.789 106.450 -0.661 1
1 541 . 2 1 1 A 57 57 ASN H H 261 7.914 7.401 0.513 1
1 542 . 2 1 1 A 57 57 ASN HA H 261 4.643 4.443 0.200 1
1 547 . 2 1 1 A 57 57 ASN CA C 261 54.945 55.696 -0.751 1
1 548 . 2 1 1 A 57 57 ASN CB C 261 37.533 38.468 -0.935 1
1 549 . 2 1 1 A 57 57 ASN N N 261 121.132 119.654 1.478 1
1 551 . 2 1 1 A 58 58 ILE H H 262 8.732 8.129 0.603 1
1 552 . 2 1 1 A 58 58 ILE HA H 262 3.712 3.594 0.118 1
1 562 . 2 1 1 A 58 58 ILE CA C 262 63.820 65.265 -1.445 1
1 563 . 2 1 1 A 58 58 ILE CB C 262 35.990 38.076 -2.086 1
1 567 . 2 1 1 A 58 58 ILE N N 262 125.309 120.782 4.527 1
1 568 . 2 1 1 A 59 59 LYS H H 263 8.416 7.934 0.482 1
1 569 . 2 1 1 A 59 59 LYS HA H 263 4.075 3.870 0.205 1
1 577 . 2 1 1 A 59 59 LYS CA C 263 59.708 60.480 -0.772 1
1 578 . 2 1 1 A 59 59 LYS CB C 263 31.343 32.332 -0.989 1
1 582 . 2 1 1 A 59 59 LYS N N 263 122.080 118.623 3.457 1
1 583 . 2 1 1 A 60 60 LYS H H 264 7.793 7.377 0.416 1
1 584 . 2 1 1 A 60 60 LYS HA H 264 4.036 4.028 0.008 1
1 591 . 2 1 1 A 60 60 LYS CA C 264 59.708 59.212 0.496 1
1 592 . 2 1 1 A 60 60 LYS CB C 264 31.865 31.909 -0.044 1
1 596 . 2 1 1 A 60 60 LYS N N 264 119.503 119.631 -0.128 1
1 597 . 2 1 1 A 61 61 LEU H H 265 7.797 7.978 -0.181 1
1 598 . 2 1 1 A 61 61 LEU HA H 265 4.106 4.024 0.082 1
1 608 . 2 1 1 A 61 61 LEU CA C 265 57.646 58.223 -0.577 1
1 609 . 2 1 1 A 61 61 LEU CB C 265 40.177 41.687 -1.510 1
1 613 . 2 1 1 A 61 61 LEU N N 265 121.392 122.283 -0.891 1
1 614 . 2 1 1 A 62 62 SER H H 266 8.775 8.054 0.721 1
1 615 . 2 1 1 A 62 62 SER HA H 266 4.001 4.198 -0.197 1
1 619 . 2 1 1 A 62 62 SER CA C 266 60.224 61.175 -0.951 1
1 620 . 2 1 1 A 62 62 SER CB C 266 62.758 62.880 -0.122 1
1 621 . 2 1 1 A 62 62 SER N N 266 112.902 114.285 -1.383 1
1 622 . 2 1 1 A 63 63 ASN H H 267 8.199 8.065 0.134 1
1 623 . 2 1 1 A 63 63 ASN HA H 267 4.393 4.358 0.035 1
1 628 . 2 1 1 A 63 63 ASN CA C 267 55.583 56.616 -1.033 1
1 629 . 2 1 1 A 63 63 ASN CB C 267 37.537 39.480 -1.943 1
1 630 . 2 1 1 A 63 63 ASN N N 267 117.813 119.188 -1.375 1
1 632 . 2 1 1 A 64 64 ARG H H 268 8.000 7.780 0.220 1
1 633 . 2 1 1 A 64 64 ARG HA H 268 4.118 4.182 -0.064 1
1 640 . 2 1 1 A 64 64 ARG CA C 268 57.646 58.704 -1.058 1
1 641 . 2 1 1 A 64 64 ARG CB C 268 29.307 30.096 -0.789 1
1 644 . 2 1 1 A 64 64 ARG N N 268 120.911 119.655 1.256 1
1 645 . 2 1 1 A 65 65 LEU H H 269 9.119 7.968 1.151 1
1 646 . 2 1 1 A 65 65 LEU HA H 269 3.916 4.048 -0.132 1
1 656 . 2 1 1 A 65 65 LEU CA C 269 57.124 58.136 -1.012 1
1 657 . 2 1 1 A 65 65 LEU CB C 269 41.662 41.417 0.245 1
1 661 . 2 1 1 A 65 65 LEU N N 269 119.046 120.869 -1.823 1
1 662 . 2 1 1 A 66 66 ALA H H 270 8.245 8.419 -0.174 1
1 663 . 2 1 1 A 66 66 ALA HA H 270 3.997 3.900 0.097 1
1 667 . 2 1 1 A 66 66 ALA CA C 270 54.337 55.061 -0.724 1
1 668 . 2 1 1 A 66 66 ALA CB C 270 16.696 18.159 -1.463 1
1 669 . 2 1 1 A 66 66 ALA N N 270 121.047 120.894 0.153 1
1 670 . 2 1 1 A 67 67 GLN H H 271 7.704 7.582 0.122 1
1 671 . 2 1 1 A 67 67 GLN HA H 271 4.025 4.068 -0.043 1
1 678 . 2 1 1 A 67 67 GLN CA C 271 58.418 58.967 -0.549 1
1 679 . 2 1 1 A 67 67 GLN CB C 271 27.996 28.160 -0.164 1
1 681 . 2 1 1 A 67 67 GLN N N 271 118.440 117.217 1.223 1
1 683 . 2 1 1 A 68 68 ILE H H 272 8.142 7.938 0.204 1
1 684 . 2 1 1 A 68 68 ILE HA H 272 3.723 3.752 -0.029 1
1 694 . 2 1 1 A 68 68 ILE CA C 272 64.605 65.201 -0.596 1
1 695 . 2 1 1 A 68 68 ILE CB C 272 37.793 37.658 0.135 1
1 699 . 2 1 1 A 68 68 ILE N N 272 119.521 119.828 -0.307 1
1 700 . 2 1 1 A 69 69 CYS H H 273 8.817 8.033 0.784 1
1 701 . 2 1 1 A 69 69 CYS HA H 273 3.958 4.323 -0.365 1
1 704 . 2 1 1 A 69 69 CYS CA C 273 64.204 60.203 4.001 1
1 705 . 2 1 1 A 69 69 CYS CB C 273 26.337 26.914 -0.577 1
1 706 . 2 1 1 A 69 69 CYS N N 273 117.234 118.834 -1.600 1
1 707 . 2 1 1 A 70 70 SER H H 274 7.880 7.997 -0.117 1
1 708 . 2 1 1 A 70 70 SER HA H 274 4.246 4.356 -0.110 1
1 710 . 2 1 1 A 70 70 SER CA C 274 60.008 60.482 -0.474 1
1 711 . 2 1 1 A 70 70 SER CB C 274 62.071 63.434 -1.363 1
1 712 . 2 1 1 A 70 70 SER N N 274 114.227 115.456 -1.229 1
1 713 . 2 1 1 A 71 71 SER H H 275 7.609 8.007 -0.398 1
1 714 . 2 1 1 A 71 71 SER HA H 275 4.564 4.617 -0.053 1
1 717 . 2 1 1 A 71 71 SER CA C 275 57.946 58.063 -0.117 1
1 718 . 2 1 1 A 71 71 SER CB C 275 63.618 63.480 0.138 1
1 719 . 2 1 1 A 71 71 SER N N 275 114.958 113.135 1.823 1
1 720 . 2 1 1 A 72 72 ILE H H 276 7.357 7.483 -0.126 1
1 721 . 2 1 1 A 72 72 ILE HA H 276 4.169 4.657 -0.488 1
1 731 . 2 1 1 A 72 72 ILE CA C 276 60.967 59.709 1.258 1
1 732 . 2 1 1 A 72 72 ILE CB C 276 38.276 40.812 -2.536 1
1 736 . 2 1 1 A 72 72 ILE N N 276 123.513 122.048 1.465 1
1 737 . 2 1 1 A 73 73 ARG H H 277 8.508 9.022 -0.514 1
1 738 . 2 1 1 A 73 73 ARG HA H 277 4.446 4.913 -0.467 1
1 744 . 2 1 1 A 73 73 ARG CA C 277 55.324 53.846 1.478 1
1 745 . 2 1 1 A 73 73 ARG CB C 277 30.499 33.860 -3.361 1
1 748 . 2 1 1 A 73 73 ARG N N 277 126.709 125.319 1.390 1
1 749 . 2 1 1 A 75 75 HIS HA H 279 4.602 4.810 -0.208 1
1 754 . 2 1 1 A 75 75 HIS CA C 279 55.840 55.228 0.612 1
1 755 . 2 1 1 A 75 75 HIS CB C 279 30.426 29.445 0.981 1
1 143 . 3 1 1 A 21 21 LYS H H 225 8.503 7.887 0.616 1
1 144 . 3 1 1 A 21 21 LYS HA H 225 4.349 3.864 0.485 1
1 152 . 3 1 1 A 21 21 LYS CA C 225 54.872 57.894 -3.022 1
1 153 . 3 1 1 A 21 21 LYS CB C 225 31.667 29.677 1.990 1
1 157 . 3 1 1 A 21 21 LYS N N 225 122.563 117.868 4.695 1
1 158 . 3 1 1 A 22 22 GLU H H 226 7.688 7.849 -0.161 1
1 159 . 3 1 1 A 22 22 GLU HA H 226 4.264 4.874 -0.610 1
1 163 . 3 1 1 A 22 22 GLU CA C 226 55.728 55.288 0.440 1
1 164 . 3 1 1 A 22 22 GLU CB C 226 30.636 32.427 -1.791 1
1 166 . 3 1 1 A 22 22 GLU N N 226 119.810 119.164 0.646 1
1 167 . 3 1 1 A 23 23 ILE H H 227 8.111 8.520 -0.409 1
1 168 . 3 1 1 A 23 23 ILE HA H 227 4.498 4.561 -0.063 1
1 178 . 3 1 1 A 23 23 ILE CA C 227 60.027 60.190 -0.163 1
1 179 . 3 1 1 A 23 23 ILE CB C 227 38.370 39.421 -1.051 1
1 183 . 3 1 1 A 23 23 ILE N N 227 122.085 126.436 -4.351 1
1 184 . 3 1 1 A 24 24 PHE H H 228 7.818 8.355 -0.537 1
1 185 . 3 1 1 A 24 24 PHE HA H 228 5.467 5.180 0.287 1
1 193 . 3 1 1 A 24 24 PHE CA C 228 54.551 55.875 -1.324 1
1 194 . 3 1 1 A 24 24 PHE CB C 228 41.685 41.297 0.388 1
1 200 . 3 1 1 A 24 24 PHE N N 228 118.840 123.182 -4.342 1
1 201 . 3 1 1 A 25 25 LEU H H 229 9.271 8.938 0.333 1
1 202 . 3 1 1 A 25 25 LEU HA H 229 4.953 5.245 -0.292 1
1 212 . 3 1 1 A 25 25 LEU CA C 229 52.892 53.585 -0.693 1
1 213 . 3 1 1 A 25 25 LEU CB C 229 44.755 44.461 0.294 1
1 217 . 3 1 1 A 25 25 LEU N N 229 123.803 120.450 3.353 1
1 218 . 3 1 1 A 26 26 THR H H 230 8.493 9.000 -0.507 1
1 219 . 3 1 1 A 26 26 THR HA H 230 5.104 4.900 0.204 1
1 224 . 3 1 1 A 26 26 THR CA C 230 61.771 62.189 -0.418 1
1 225 . 3 1 1 A 26 26 THR CB C 230 68.733 69.364 -0.631 1
1 227 . 3 1 1 A 26 26 THR N N 230 121.119 121.246 -0.127 1
1 228 . 3 1 1 A 27 27 VAL H H 231 9.001 8.503 0.498 1
1 229 . 3 1 1 A 27 27 VAL HA H 231 4.600 4.542 0.058 1
1 237 . 3 1 1 A 27 27 VAL CA C 231 56.940 59.419 -2.479 1
1 238 . 3 1 1 A 27 27 VAL CB C 231 33.730 32.669 1.061 1
1 241 . 3 1 1 A 27 27 VAL N N 231 124.749 127.077 -2.328 1
1 242 . 3 1 1 A 28 28 PRO HA H 232 4.661 4.738 -0.077 1
1 249 . 3 1 1 A 28 28 PRO CA C 232 62.233 62.633 -0.400 1
1 250 . 3 1 1 A 28 28 PRO CB C 232 31.667 31.569 0.098 1
1 253 . 3 1 1 A 29 29 VAL H H 233 8.171 8.044 0.127 1
1 254 . 3 1 1 A 29 29 VAL HA H 233 4.565 3.926 0.639 1
1 262 . 3 1 1 A 29 29 VAL CA C 233 60.027 63.738 -3.711 1
1 263 . 3 1 1 A 29 29 VAL CB C 233 32.699 31.311 1.388 1
1 266 . 3 1 1 A 29 29 VAL N N 233 116.136 120.568 -4.432 1
1 267 . 3 1 1 A 30 30 GLY H H 234 8.143 8.928 -0.785 1
1 268 . 3 1 1 A 30 30 GLY HA2 H 234 3.824 3.830 -0.006 1
1 269 . 3 1 1 A 30 30 GLY HA3 H 234 4.209 3.831 0.378 1
1 270 . 3 1 1 A 30 30 GLY CA C 234 44.635 47.278 -2.643 1
1 271 . 3 1 1 A 30 30 GLY N N 234 110.455 114.879 -4.424 1
1 272 . 3 1 1 A 32 32 GLY H H 236 8.305 8.411 -0.106 1
1 273 . 3 1 1 A 32 32 GLY HA2 H 236 3.836 4.134 -0.298 1
1 274 . 3 1 1 A 32 32 GLY HA3 H 236 4.103 4.134 -0.031 1
1 275 . 3 1 1 A 32 32 GLY CA C 236 44.635 46.069 -1.434 1
1 276 . 3 1 1 A 32 32 GLY N N 236 107.539 111.765 -4.226 1
1 277 . 3 1 1 A 33 33 GLU H H 237 7.583 8.228 -0.645 1
1 278 . 3 1 1 A 33 33 GLU HA H 237 4.564 4.648 -0.084 1
1 283 . 3 1 1 A 33 33 GLU CA C 237 54.355 55.307 -0.952 1
1 284 . 3 1 1 A 33 33 GLU CB C 237 30.636 31.116 -0.480 1
1 286 . 3 1 1 A 33 33 GLU N N 237 120.218 121.507 -1.289 1
1 287 . 3 1 1 A 34 34 SER H H 238 8.630 8.773 -0.143 1
1 288 . 3 1 1 A 34 34 SER HA H 238 5.012 5.339 -0.327 1
1 291 . 3 1 1 A 34 34 SER CA C 238 56.915 56.311 0.604 1
1 292 . 3 1 1 A 34 34 SER CB C 238 64.663 66.046 -1.383 1
1 293 . 3 1 1 A 34 34 SER N N 238 116.390 113.175 3.215 1
1 294 . 3 1 1 A 35 35 LEU H H 239 8.838 8.708 0.130 1
1 295 . 3 1 1 A 35 35 LEU HA H 239 4.577 4.811 -0.234 1
1 305 . 3 1 1 A 35 35 LEU CA C 239 52.808 53.553 -0.745 1
1 306 . 3 1 1 A 35 35 LEU CB C 239 44.156 43.808 0.348 1
1 310 . 3 1 1 A 35 35 LEU N N 239 124.463 124.397 0.066 1
1 311 . 3 1 1 A 36 36 ARG H H 240 8.526 8.799 -0.273 1
1 312 . 3 1 1 A 36 36 ARG HA H 240 5.077 4.781 0.296 1
1 318 . 3 1 1 A 36 36 ARG CA C 240 54.483 54.904 -0.421 1
1 319 . 3 1 1 A 36 36 ARG CB C 240 30.777 31.640 -0.863 1
1 322 . 3 1 1 A 36 36 ARG N N 240 124.891 124.551 0.340 1
1 323 . 3 1 1 A 37 37 LEU H H 241 9.179 8.547 0.632 1
1 324 . 3 1 1 A 37 37 LEU HA H 241 4.740 5.076 -0.336 1
1 334 . 3 1 1 A 37 37 LEU CA C 241 52.292 53.581 -1.289 1
1 335 . 3 1 1 A 37 37 LEU CB C 241 43.208 45.757 -2.549 1
1 339 . 3 1 1 A 37 37 LEU N N 241 126.203 128.488 -2.285 1
1 340 . 3 1 1 A 38 38 LEU H H 242 8.825 8.589 0.236 1
1 341 . 3 1 1 A 38 38 LEU HA H 242 4.371 4.723 -0.352 1
1 351 . 3 1 1 A 38 38 LEU CA C 242 54.508 54.343 0.165 1
1 352 . 3 1 1 A 38 38 LEU CB C 242 41.583 42.221 -0.638 1
1 356 . 3 1 1 A 38 38 LEU N N 242 124.999 127.264 -2.265 1
1 357 . 3 1 1 A 39 39 ALA H H 243 8.634 9.264 -0.630 1
1 358 . 3 1 1 A 39 39 ALA HA H 243 3.799 4.040 -0.241 1
1 362 . 3 1 1 A 39 39 ALA CA C 243 54.852 54.962 -0.110 1
1 363 . 3 1 1 A 39 39 ALA CB C 243 18.243 18.497 -0.254 1
1 364 . 3 1 1 A 39 39 ALA N N 243 125.146 125.735 -0.589 1
1 365 . 3 1 1 A 40 40 SER H H 244 8.414 8.021 0.393 1
1 366 . 3 1 1 A 40 40 SER HA H 244 4.074 4.315 -0.241 1
1 369 . 3 1 1 A 40 40 SER CA C 244 58.977 60.728 -1.751 1
1 370 . 3 1 1 A 40 40 SER CB C 244 61.561 63.208 -1.647 1
1 371 . 3 1 1 A 40 40 SER N N 244 109.494 112.957 -3.463 1
1 372 . 3 1 1 A 41 41 ASP H H 245 7.434 7.864 -0.430 1
1 373 . 3 1 1 A 41 41 ASP HA H 245 4.809 4.890 -0.081 1
1 376 . 3 1 1 A 41 41 ASP CA C 245 52.990 53.009 -0.019 1
1 377 . 3 1 1 A 41 41 ASP CB C 245 41.792 41.592 0.200 1
1 378 . 3 1 1 A 41 41 ASP N N 245 120.452 120.878 -0.426 1
1 379 . 3 1 1 A 42 42 LEU H H 246 7.338 8.115 -0.777 1
1 380 . 3 1 1 A 42 42 LEU HA H 246 4.098 4.289 -0.191 1
1 389 . 3 1 1 A 42 42 LEU CA C 246 55.068 55.888 -0.820 1
1 390 . 3 1 1 A 42 42 LEU CB C 246 41.861 42.264 -0.403 1
1 393 . 3 1 1 A 42 42 LEU N N 246 121.293 122.953 -1.660 1
1 394 . 3 1 1 A 43 43 GLN H H 247 8.170 8.687 -0.517 1
1 395 . 3 1 1 A 43 43 GLN HA H 247 4.532 4.337 0.195 1
1 401 . 3 1 1 A 43 43 GLN CA C 247 53.005 55.477 -2.472 1
1 402 . 3 1 1 A 43 43 GLN CB C 247 30.978 28.902 2.076 1
1 404 . 3 1 1 A 43 43 GLN N N 247 122.477 126.729 -4.252 1
1 406 . 3 1 1 A 44 44 ARG HA H 248 3.753 3.979 -0.226 1
1 412 . 3 1 1 A 44 44 ARG CA C 248 59.812 59.045 0.767 1
1 413 . 3 1 1 A 44 44 ARG CB C 248 29.306 29.964 -0.658 1
1 416 . 3 1 1 A 45 45 HIS H H 249 8.364 8.276 0.088 1
1 417 . 3 1 1 A 45 45 HIS HA H 249 4.294 4.293 0.001 1
1 422 . 3 1 1 A 45 45 HIS CA C 249 58.462 59.182 -0.720 1
1 423 . 3 1 1 A 45 45 HIS CB C 249 29.071 28.300 0.771 1
1 424 . 3 1 1 A 45 45 HIS N N 249 114.528 117.097 -2.569 1
1 425 . 3 1 1 A 46 46 SER H H 250 7.020 7.602 -0.582 1
1 426 . 3 1 1 A 46 46 SER HA H 250 4.153 3.994 0.159 1
1 428 . 3 1 1 A 46 46 SER CA C 250 59.493 61.028 -1.535 1
1 429 . 3 1 1 A 46 46 SER CB C 250 62.071 62.971 -0.900 1
1 430 . 3 1 1 A 46 46 SER N N 250 113.900 114.910 -1.010 1
1 431 . 3 1 1 A 47 47 ILE H H 251 7.106 7.206 -0.100 1
1 432 . 3 1 1 A 47 47 ILE HA H 251 3.994 4.126 -0.132 1
1 441 . 3 1 1 A 47 47 ILE CA C 251 60.337 62.491 -2.154 1
1 442 . 3 1 1 A 47 47 ILE CB C 251 36.727 38.273 -1.546 1
1 446 . 3 1 1 A 47 47 ILE N N 251 115.759 118.768 -3.009 1
1 447 . 3 1 1 A 48 48 ALA H H 252 8.117 7.671 0.446 1
1 448 . 3 1 1 A 48 48 ALA HA H 252 3.979 4.247 -0.268 1
1 452 . 3 1 1 A 48 48 ALA CA C 252 53.821 52.943 0.878 1
1 453 . 3 1 1 A 48 48 ALA CB C 252 17.727 19.005 -1.278 1
1 454 . 3 1 1 A 48 48 ALA N N 252 120.091 123.213 -3.122 1
1 455 . 3 1 1 A 49 49 GLN H H 253 7.346 8.077 -0.731 1
1 456 . 3 1 1 A 49 49 GLN HA H 253 4.324 4.363 -0.039 1
1 463 . 3 1 1 A 49 49 GLN CA C 253 54.552 55.204 -0.652 1
1 464 . 3 1 1 A 49 49 GLN CB C 253 28.255 28.520 -0.265 1
1 466 . 3 1 1 A 49 49 GLN N N 253 112.219 114.266 -2.047 1
1 468 . 3 1 1 A 50 50 LEU H H 254 7.243 7.407 -0.164 1
1 469 . 3 1 1 A 50 50 LEU HA H 254 4.198 4.467 -0.269 1
1 479 . 3 1 1 A 50 50 LEU CA C 254 53.971 54.452 -0.481 1
1 480 . 3 1 1 A 50 50 LEU CB C 254 41.662 42.497 -0.835 1
1 484 . 3 1 1 A 50 50 LEU N N 254 120.510 122.421 -1.911 1
1 485 . 3 1 1 A 51 51 ASP H H 255 8.210 8.525 -0.315 1
1 486 . 3 1 1 A 51 51 ASP HA H 255 4.664 5.116 -0.452 1
1 489 . 3 1 1 A 51 51 ASP CA C 255 52.490 50.948 1.542 1
1 490 . 3 1 1 A 51 51 ASP CB C 255 40.259 41.421 -1.162 1
1 491 . 3 1 1 A 51 51 ASP N N 255 119.691 119.333 0.358 1
1 492 . 3 1 1 A 52 52 PRO HA H 256 4.125 4.317 -0.192 1
1 499 . 3 1 1 A 52 52 PRO CA C 256 65.380 65.672 -0.292 1
1 500 . 3 1 1 A 52 52 PRO CB C 256 31.865 31.756 0.109 1
1 503 . 3 1 1 A 53 53 GLU H H 257 8.432 8.649 -0.217 1
1 504 . 3 1 1 A 53 53 GLU HA H 257 4.073 4.096 -0.023 1
1 508 . 3 1 1 A 53 53 GLU CA C 257 58.677 59.371 -0.694 1
1 509 . 3 1 1 A 53 53 GLU CB C 257 28.771 29.355 -0.584 1
1 511 . 3 1 1 A 53 53 GLU N N 257 119.483 118.283 1.200 1
1 512 . 3 1 1 A 54 54 ALA H H 258 7.967 7.485 0.482 1
1 513 . 3 1 1 A 54 54 ALA HA H 258 4.240 4.069 0.171 1
1 517 . 3 1 1 A 54 54 ALA CA C 258 54.552 55.209 -0.657 1
1 518 . 3 1 1 A 54 54 ALA CB C 258 18.699 18.503 0.196 1
1 519 . 3 1 1 A 54 54 ALA N N 258 124.293 122.306 1.987 1
1 520 . 3 1 1 A 55 55 LEU H H 259 8.695 8.385 0.310 1
1 521 . 3 1 1 A 55 55 LEU HA H 259 3.902 3.943 -0.041 1
1 530 . 3 1 1 A 55 55 LEU CA C 259 57.130 58.024 -0.894 1
1 531 . 3 1 1 A 55 55 LEU CB C 259 41.192 41.707 -0.515 1
1 535 . 3 1 1 A 55 55 LEU N N 259 118.361 118.654 -0.293 1
1 536 . 3 1 1 A 56 56 GLY H H 260 8.177 7.882 0.295 1
1 537 . 3 1 1 A 56 56 GLY HA2 H 260 3.723 3.748 -0.025 1
1 538 . 3 1 1 A 56 56 GLY HA3 H 260 3.971 3.748 0.223 1
1 539 . 3 1 1 A 56 56 GLY CA C 260 46.302 47.408 -1.106 1
1 540 . 3 1 1 A 56 56 GLY N N 260 105.789 106.573 -0.784 1
1 541 . 3 1 1 A 57 57 ASN H H 261 7.914 7.587 0.327 1
1 542 . 3 1 1 A 57 57 ASN HA H 261 4.643 4.445 0.198 1
1 547 . 3 1 1 A 57 57 ASN CA C 261 54.945 55.364 -0.419 1
1 548 . 3 1 1 A 57 57 ASN CB C 261 37.533 38.258 -0.725 1
1 549 . 3 1 1 A 57 57 ASN N N 261 121.132 120.161 0.971 1
1 551 . 3 1 1 A 58 58 ILE H H 262 8.732 7.791 0.941 1
1 552 . 3 1 1 A 58 58 ILE HA H 262 3.712 3.692 0.020 1
1 562 . 3 1 1 A 58 58 ILE CA C 262 63.820 65.001 -1.181 1
1 563 . 3 1 1 A 58 58 ILE CB C 262 35.990 37.692 -1.702 1
1 567 . 3 1 1 A 58 58 ILE N N 262 125.309 120.743 4.566 1
1 568 . 3 1 1 A 59 59 LYS H H 263 8.416 8.218 0.198 1
1 569 . 3 1 1 A 59 59 LYS HA H 263 4.075 3.867 0.208 1
1 577 . 3 1 1 A 59 59 LYS CA C 263 59.708 60.551 -0.843 1
1 578 . 3 1 1 A 59 59 LYS CB C 263 31.343 32.283 -0.940 1
1 582 . 3 1 1 A 59 59 LYS N N 263 122.080 118.769 3.311 1
1 583 . 3 1 1 A 60 60 LYS H H 264 7.793 7.982 -0.189 1
1 584 . 3 1 1 A 60 60 LYS HA H 264 4.036 4.080 -0.044 1
1 591 . 3 1 1 A 60 60 LYS CA C 264 59.708 58.886 0.822 1
1 592 . 3 1 1 A 60 60 LYS CB C 264 31.865 31.646 0.219 1
1 596 . 3 1 1 A 60 60 LYS N N 264 119.503 118.585 0.918 1
1 597 . 3 1 1 A 61 61 LEU H H 265 7.797 7.880 -0.083 1
1 598 . 3 1 1 A 61 61 LEU HA H 265 4.106 4.039 0.067 1
1 608 . 3 1 1 A 61 61 LEU CA C 265 57.646 58.184 -0.538 1
1 609 . 3 1 1 A 61 61 LEU CB C 265 40.177 41.664 -1.487 1
1 613 . 3 1 1 A 61 61 LEU N N 265 121.392 121.884 -0.492 1
1 614 . 3 1 1 A 62 62 SER H H 266 8.775 8.225 0.550 1
1 615 . 3 1 1 A 62 62 SER HA H 266 4.001 4.217 -0.216 1
1 619 . 3 1 1 A 62 62 SER CA C 266 60.224 61.200 -0.976 1
1 620 . 3 1 1 A 62 62 SER CB C 266 62.758 62.911 -0.153 1
1 621 . 3 1 1 A 62 62 SER N N 266 112.902 114.279 -1.377 1
1 622 . 3 1 1 A 63 63 ASN H H 267 8.199 8.050 0.149 1
1 623 . 3 1 1 A 63 63 ASN HA H 267 4.393 4.355 0.038 1
1 628 . 3 1 1 A 63 63 ASN CA C 267 55.583 56.618 -1.035 1
1 629 . 3 1 1 A 63 63 ASN CB C 267 37.537 39.474 -1.937 1
1 630 . 3 1 1 A 63 63 ASN N N 267 117.813 119.193 -1.380 1
1 632 . 3 1 1 A 64 64 ARG H H 268 8.000 7.763 0.237 1
1 633 . 3 1 1 A 64 64 ARG HA H 268 4.118 4.163 -0.045 1
1 640 . 3 1 1 A 64 64 ARG CA C 268 57.646 58.807 -1.161 1
1 641 . 3 1 1 A 64 64 ARG CB C 268 29.307 30.095 -0.788 1
1 644 . 3 1 1 A 64 64 ARG N N 268 120.911 119.624 1.287 1
1 645 . 3 1 1 A 65 65 LEU H H 269 9.119 7.854 1.265 1
1 646 . 3 1 1 A 65 65 LEU HA H 269 3.916 4.073 -0.157 1
1 656 . 3 1 1 A 65 65 LEU CA C 269 57.124 58.032 -0.908 1
1 657 . 3 1 1 A 65 65 LEU CB C 269 41.662 41.336 0.326 1
1 661 . 3 1 1 A 65 65 LEU N N 269 119.046 120.864 -1.818 1
1 662 . 3 1 1 A 66 66 ALA H H 270 8.245 8.601 -0.356 1
1 663 . 3 1 1 A 66 66 ALA HA H 270 3.997 3.940 0.057 1
1 667 . 3 1 1 A 66 66 ALA CA C 270 54.337 55.099 -0.762 1
1 668 . 3 1 1 A 66 66 ALA CB C 270 16.696 18.146 -1.450 1
1 669 . 3 1 1 A 66 66 ALA N N 270 121.047 121.266 -0.219 1
1 670 . 3 1 1 A 67 67 GLN H H 271 7.704 7.645 0.059 1
1 671 . 3 1 1 A 67 67 GLN HA H 271 4.025 3.985 0.040 1
1 678 . 3 1 1 A 67 67 GLN CA C 271 58.418 58.833 -0.415 1
1 679 . 3 1 1 A 67 67 GLN CB C 271 27.996 28.320 -0.324 1
1 681 . 3 1 1 A 67 67 GLN N N 271 118.440 117.614 0.826 1
1 683 . 3 1 1 A 68 68 ILE H H 272 8.142 7.914 0.228 1
1 684 . 3 1 1 A 68 68 ILE HA H 272 3.723 3.712 0.011 1
1 694 . 3 1 1 A 68 68 ILE CA C 272 64.605 65.268 -0.663 1
1 695 . 3 1 1 A 68 68 ILE CB C 272 37.793 38.032 -0.239 1
1 699 . 3 1 1 A 68 68 ILE N N 272 119.521 119.685 -0.164 1
1 700 . 3 1 1 A 69 69 CYS H H 273 8.817 8.236 0.581 1
1 701 . 3 1 1 A 69 69 CYS HA H 273 3.958 4.327 -0.369 1
1 704 . 3 1 1 A 69 69 CYS CA C 273 64.204 61.064 3.140 1
1 705 . 3 1 1 A 69 69 CYS CB C 273 26.337 27.203 -0.866 1
1 706 . 3 1 1 A 69 69 CYS N N 273 117.234 120.891 -3.657 1
1 707 . 3 1 1 A 70 70 SER H H 274 7.880 7.697 0.183 1
1 708 . 3 1 1 A 70 70 SER HA H 274 4.246 4.334 -0.088 1
1 710 . 3 1 1 A 70 70 SER CA C 274 60.008 60.910 -0.902 1
1 711 . 3 1 1 A 70 70 SER CB C 274 62.071 63.185 -1.114 1
1 712 . 3 1 1 A 70 70 SER N N 274 114.227 114.845 -0.618 1
1 713 . 3 1 1 A 71 71 SER H H 275 7.609 7.707 -0.098 1
1 714 . 3 1 1 A 71 71 SER HA H 275 4.564 4.488 0.076 1
1 717 . 3 1 1 A 71 71 SER CA C 275 57.946 58.464 -0.518 1
1 718 . 3 1 1 A 71 71 SER CB C 275 63.618 63.592 0.026 1
1 719 . 3 1 1 A 71 71 SER N N 275 114.958 114.430 0.528 1
1 720 . 3 1 1 A 72 72 ILE H H 276 7.357 7.688 -0.331 1
1 721 . 3 1 1 A 72 72 ILE HA H 276 4.169 4.321 -0.152 1
1 731 . 3 1 1 A 72 72 ILE CA C 276 60.967 60.235 0.732 1
1 732 . 3 1 1 A 72 72 ILE CB C 276 38.276 39.997 -1.721 1
1 736 . 3 1 1 A 72 72 ILE N N 276 123.513 122.893 0.620 1
1 737 . 3 1 1 A 73 73 ARG H H 277 8.508 8.667 -0.159 1
1 738 . 3 1 1 A 73 73 ARG HA H 277 4.446 5.073 -0.627 1
1 744 . 3 1 1 A 73 73 ARG CA C 277 55.324 54.517 0.807 1
1 745 . 3 1 1 A 73 73 ARG CB C 277 30.499 33.588 -3.089 1
1 748 . 3 1 1 A 73 73 ARG N N 277 126.709 125.995 0.714 1
1 749 . 3 1 1 A 75 75 HIS HA H 279 4.602 4.617 -0.015 1
1 754 . 3 1 1 A 75 75 HIS CA C 279 55.840 57.315 -1.475 1
1 755 . 3 1 1 A 75 75 HIS CB C 279 30.426 31.083 -0.657 1
1 143 . 4 1 1 A 21 21 LYS H H 225 8.503 8.429 0.074 1
1 144 . 4 1 1 A 21 21 LYS HA H 225 4.349 4.418 -0.069 1
1 152 . 4 1 1 A 21 21 LYS CA C 225 54.872 57.321 -2.449 1
1 153 . 4 1 1 A 21 21 LYS CB C 225 31.667 33.544 -1.877 1
1 157 . 4 1 1 A 21 21 LYS N N 225 122.563 128.386 -5.823 1
1 158 . 4 1 1 A 22 22 GLU H H 226 7.688 7.704 -0.016 1
1 159 . 4 1 1 A 22 22 GLU HA H 226 4.264 4.424 -0.160 1
1 163 . 4 1 1 A 22 22 GLU CA C 226 55.728 56.814 -1.086 1
1 164 . 4 1 1 A 22 22 GLU CB C 226 30.636 29.989 0.647 1
1 166 . 4 1 1 A 22 22 GLU N N 226 119.810 117.451 2.359 1
1 167 . 4 1 1 A 23 23 ILE H H 227 8.111 8.379 -0.268 1
1 168 . 4 1 1 A 23 23 ILE HA H 227 4.498 4.594 -0.096 1
1 178 . 4 1 1 A 23 23 ILE CA C 227 60.027 60.144 -0.117 1
1 179 . 4 1 1 A 23 23 ILE CB C 227 38.370 39.434 -1.064 1
1 183 . 4 1 1 A 23 23 ILE N N 227 122.085 124.892 -2.807 1
1 184 . 4 1 1 A 24 24 PHE H H 228 7.818 8.352 -0.534 1
1 185 . 4 1 1 A 24 24 PHE HA H 228 5.467 5.301 0.166 1
1 193 . 4 1 1 A 24 24 PHE CA C 228 54.551 55.916 -1.365 1
1 194 . 4 1 1 A 24 24 PHE CB C 228 41.685 41.168 0.517 1
1 200 . 4 1 1 A 24 24 PHE N N 228 118.840 122.604 -3.764 1
1 201 . 4 1 1 A 25 25 LEU H H 229 9.271 8.897 0.374 1
1 202 . 4 1 1 A 25 25 LEU HA H 229 4.953 5.252 -0.299 1
1 212 . 4 1 1 A 25 25 LEU CA C 229 52.892 53.580 -0.688 1
1 213 . 4 1 1 A 25 25 LEU CB C 229 44.755 44.914 -0.159 1
1 217 . 4 1 1 A 25 25 LEU N N 229 123.803 120.567 3.236 1
1 218 . 4 1 1 A 26 26 THR H H 230 8.493 8.982 -0.489 1
1 219 . 4 1 1 A 26 26 THR HA H 230 5.104 5.106 -0.002 1
1 224 . 4 1 1 A 26 26 THR CA C 230 61.771 61.963 -0.192 1
1 225 . 4 1 1 A 26 26 THR CB C 230 68.733 69.680 -0.947 1
1 227 . 4 1 1 A 26 26 THR N N 230 121.119 120.020 1.099 1
1 228 . 4 1 1 A 27 27 VAL H H 231 9.001 8.746 0.255 1
1 229 . 4 1 1 A 27 27 VAL HA H 231 4.600 4.553 0.047 1
1 237 . 4 1 1 A 27 27 VAL CA C 231 56.940 59.252 -2.312 1
1 238 . 4 1 1 A 27 27 VAL CB C 231 33.730 32.860 0.870 1
1 241 . 4 1 1 A 27 27 VAL N N 231 124.749 127.053 -2.304 1
1 242 . 4 1 1 A 28 28 PRO HA H 232 4.661 4.913 -0.252 1
1 249 . 4 1 1 A 28 28 PRO CA C 232 62.233 62.502 -0.269 1
1 250 . 4 1 1 A 28 28 PRO CB C 232 31.667 31.662 0.005 1
1 253 . 4 1 1 A 29 29 VAL H H 233 8.171 8.108 0.063 1
1 254 . 4 1 1 A 29 29 VAL HA H 233 4.565 3.916 0.649 1
1 262 . 4 1 1 A 29 29 VAL CA C 233 60.027 63.749 -3.722 1
1 263 . 4 1 1 A 29 29 VAL CB C 233 32.699 31.259 1.440 1
1 266 . 4 1 1 A 29 29 VAL N N 233 116.136 121.224 -5.088 1
1 267 . 4 1 1 A 30 30 GLY H H 234 8.143 8.948 -0.805 1
1 268 . 4 1 1 A 30 30 GLY HA2 H 234 3.824 3.827 -0.003 1
1 269 . 4 1 1 A 30 30 GLY HA3 H 234 4.209 3.827 0.382 1
1 270 . 4 1 1 A 30 30 GLY CA C 234 44.635 47.275 -2.640 1
1 271 . 4 1 1 A 30 30 GLY N N 234 110.455 114.921 -4.466 1
1 272 . 4 1 1 A 32 32 GLY H H 236 8.305 8.489 -0.184 1
1 273 . 4 1 1 A 32 32 GLY HA2 H 236 3.836 4.151 -0.315 1
1 274 . 4 1 1 A 32 32 GLY HA3 H 236 4.103 4.152 -0.049 1
1 275 . 4 1 1 A 32 32 GLY CA C 236 44.635 46.090 -1.455 1
1 276 . 4 1 1 A 32 32 GLY N N 236 107.539 110.892 -3.353 1
1 277 . 4 1 1 A 33 33 GLU H H 237 7.583 8.225 -0.642 1
1 278 . 4 1 1 A 33 33 GLU HA H 237 4.564 4.632 -0.068 1
1 283 . 4 1 1 A 33 33 GLU CA C 237 54.355 55.307 -0.952 1
1 284 . 4 1 1 A 33 33 GLU CB C 237 30.636 31.040 -0.404 1
1 286 . 4 1 1 A 33 33 GLU N N 237 120.218 121.474 -1.256 1
1 287 . 4 1 1 A 34 34 SER H H 238 8.630 8.675 -0.045 1
1 288 . 4 1 1 A 34 34 SER HA H 238 5.012 5.172 -0.160 1
1 291 . 4 1 1 A 34 34 SER CA C 238 56.915 57.344 -0.429 1
1 292 . 4 1 1 A 34 34 SER CB C 238 64.663 65.938 -1.275 1
1 293 . 4 1 1 A 34 34 SER N N 238 116.390 117.905 -1.515 1
1 294 . 4 1 1 A 35 35 LEU H H 239 8.838 9.147 -0.309 1
1 295 . 4 1 1 A 35 35 LEU HA H 239 4.577 5.063 -0.486 1
1 305 . 4 1 1 A 35 35 LEU CA C 239 52.808 53.338 -0.530 1
1 306 . 4 1 1 A 35 35 LEU CB C 239 44.156 43.191 0.965 1
1 310 . 4 1 1 A 35 35 LEU N N 239 124.463 124.756 -0.293 1
1 311 . 4 1 1 A 36 36 ARG H H 240 8.526 8.912 -0.386 1
1 312 . 4 1 1 A 36 36 ARG HA H 240 5.077 5.122 -0.045 1
1 318 . 4 1 1 A 36 36 ARG CA C 240 54.483 54.952 -0.469 1
1 319 . 4 1 1 A 36 36 ARG CB C 240 30.777 32.081 -1.304 1
1 322 . 4 1 1 A 36 36 ARG N N 240 124.891 125.600 -0.709 1
1 323 . 4 1 1 A 37 37 LEU H H 241 9.179 8.809 0.370 1
1 324 . 4 1 1 A 37 37 LEU HA H 241 4.740 5.019 -0.279 1
1 334 . 4 1 1 A 37 37 LEU CA C 241 52.292 53.647 -1.355 1
1 335 . 4 1 1 A 37 37 LEU CB C 241 43.208 45.802 -2.594 1
1 339 . 4 1 1 A 37 37 LEU N N 241 126.203 128.534 -2.331 1
1 340 . 4 1 1 A 38 38 LEU H H 242 8.825 8.496 0.329 1
1 341 . 4 1 1 A 38 38 LEU HA H 242 4.371 4.701 -0.330 1
1 351 . 4 1 1 A 38 38 LEU CA C 242 54.508 54.750 -0.242 1
1 352 . 4 1 1 A 38 38 LEU CB C 242 41.583 42.235 -0.652 1
1 356 . 4 1 1 A 38 38 LEU N N 242 124.999 127.280 -2.281 1
1 357 . 4 1 1 A 39 39 ALA H H 243 8.634 9.295 -0.661 1
1 358 . 4 1 1 A 39 39 ALA HA H 243 3.799 4.078 -0.279 1
1 362 . 4 1 1 A 39 39 ALA CA C 243 54.852 55.189 -0.337 1
1 363 . 4 1 1 A 39 39 ALA CB C 243 18.243 18.357 -0.114 1
1 364 . 4 1 1 A 39 39 ALA N N 243 125.146 125.838 -0.692 1
1 365 . 4 1 1 A 40 40 SER H H 244 8.414 8.306 0.108 1
1 366 . 4 1 1 A 40 40 SER HA H 244 4.074 4.276 -0.202 1
1 369 . 4 1 1 A 40 40 SER CA C 244 58.977 60.942 -1.965 1
1 370 . 4 1 1 A 40 40 SER CB C 244 61.561 62.849 -1.288 1
1 371 . 4 1 1 A 40 40 SER N N 244 109.494 112.346 -2.852 1
1 372 . 4 1 1 A 41 41 ASP H H 245 7.434 8.070 -0.636 1
1 373 . 4 1 1 A 41 41 ASP HA H 245 4.809 4.905 -0.096 1
1 376 . 4 1 1 A 41 41 ASP CA C 245 52.990 53.030 -0.040 1
1 377 . 4 1 1 A 41 41 ASP CB C 245 41.792 41.607 0.185 1
1 378 . 4 1 1 A 41 41 ASP N N 245 120.452 119.056 1.396 1
1 379 . 4 1 1 A 42 42 LEU H H 246 7.338 8.235 -0.897 1
1 380 . 4 1 1 A 42 42 LEU HA H 246 4.098 4.376 -0.278 1
1 389 . 4 1 1 A 42 42 LEU CA C 246 55.068 55.572 -0.504 1
1 390 . 4 1 1 A 42 42 LEU CB C 246 41.861 42.199 -0.338 1
1 393 . 4 1 1 A 42 42 LEU N N 246 121.293 122.731 -1.438 1
1 394 . 4 1 1 A 43 43 GLN H H 247 8.170 8.643 -0.473 1
1 395 . 4 1 1 A 43 43 GLN HA H 247 4.532 4.381 0.151 1
1 401 . 4 1 1 A 43 43 GLN CA C 247 53.005 55.685 -2.680 1
1 402 . 4 1 1 A 43 43 GLN CB C 247 30.978 28.917 2.061 1
1 404 . 4 1 1 A 43 43 GLN N N 247 122.477 126.998 -4.521 1
1 406 . 4 1 1 A 44 44 ARG HA H 248 3.753 3.975 -0.222 1
1 412 . 4 1 1 A 44 44 ARG CA C 248 59.812 59.519 0.293 1
1 413 . 4 1 1 A 44 44 ARG CB C 248 29.306 30.475 -1.169 1
1 416 . 4 1 1 A 45 45 HIS H H 249 8.364 8.619 -0.255 1
1 417 . 4 1 1 A 45 45 HIS HA H 249 4.294 4.264 0.030 1
1 422 . 4 1 1 A 45 45 HIS CA C 249 58.462 59.228 -0.766 1
1 423 . 4 1 1 A 45 45 HIS CB C 249 29.071 28.511 0.560 1
1 424 . 4 1 1 A 45 45 HIS N N 249 114.528 117.194 -2.666 1
1 425 . 4 1 1 A 46 46 SER H H 250 7.020 7.446 -0.426 1
1 426 . 4 1 1 A 46 46 SER HA H 250 4.153 4.131 0.022 1
1 428 . 4 1 1 A 46 46 SER CA C 250 59.493 62.135 -2.642 1
1 429 . 4 1 1 A 46 46 SER CB C 250 62.071 62.699 -0.628 1
1 430 . 4 1 1 A 46 46 SER N N 250 113.900 115.284 -1.384 1
1 431 . 4 1 1 A 47 47 ILE H H 251 7.106 7.325 -0.219 1
1 432 . 4 1 1 A 47 47 ILE HA H 251 3.994 4.075 -0.081 1
1 441 . 4 1 1 A 47 47 ILE CA C 251 60.337 62.648 -2.311 1
1 442 . 4 1 1 A 47 47 ILE CB C 251 36.727 38.377 -1.650 1
1 446 . 4 1 1 A 47 47 ILE N N 251 115.759 120.562 -4.803 1
1 447 . 4 1 1 A 48 48 ALA H H 252 8.117 7.640 0.477 1
1 448 . 4 1 1 A 48 48 ALA HA H 252 3.979 4.253 -0.274 1
1 452 . 4 1 1 A 48 48 ALA CA C 252 53.821 52.864 0.957 1
1 453 . 4 1 1 A 48 48 ALA CB C 252 17.727 18.576 -0.849 1
1 454 . 4 1 1 A 48 48 ALA N N 252 120.091 123.143 -3.052 1
1 455 . 4 1 1 A 49 49 GLN H H 253 7.346 7.969 -0.623 1
1 456 . 4 1 1 A 49 49 GLN HA H 253 4.324 4.356 -0.032 1
1 463 . 4 1 1 A 49 49 GLN CA C 253 54.552 55.227 -0.675 1
1 464 . 4 1 1 A 49 49 GLN CB C 253 28.255 28.687 -0.432 1
1 466 . 4 1 1 A 49 49 GLN N N 253 112.219 114.676 -2.457 1
1 468 . 4 1 1 A 50 50 LEU H H 254 7.243 7.289 -0.046 1
1 469 . 4 1 1 A 50 50 LEU HA H 254 4.198 4.373 -0.175 1
1 479 . 4 1 1 A 50 50 LEU CA C 254 53.971 54.693 -0.722 1
1 480 . 4 1 1 A 50 50 LEU CB C 254 41.662 42.135 -0.473 1
1 484 . 4 1 1 A 50 50 LEU N N 254 120.510 122.405 -1.895 1
1 485 . 4 1 1 A 51 51 ASP H H 255 8.210 8.365 -0.155 1
1 486 . 4 1 1 A 51 51 ASP HA H 255 4.664 4.874 -0.210 1
1 489 . 4 1 1 A 51 51 ASP CA C 255 52.490 51.906 0.584 1
1 490 . 4 1 1 A 51 51 ASP CB C 255 40.259 42.311 -2.052 1
1 491 . 4 1 1 A 51 51 ASP N N 255 119.691 121.371 -1.680 1
1 492 . 4 1 1 A 52 52 PRO HA H 256 4.125 4.336 -0.211 1
1 499 . 4 1 1 A 52 52 PRO CA C 256 65.380 65.699 -0.319 1
1 500 . 4 1 1 A 52 52 PRO CB C 256 31.865 31.724 0.141 1
1 503 . 4 1 1 A 53 53 GLU H H 257 8.432 8.415 0.017 1
1 504 . 4 1 1 A 53 53 GLU HA H 257 4.073 4.103 -0.030 1
1 508 . 4 1 1 A 53 53 GLU CA C 257 58.677 59.511 -0.834 1
1 509 . 4 1 1 A 53 53 GLU CB C 257 28.771 29.331 -0.560 1
1 511 . 4 1 1 A 53 53 GLU N N 257 119.483 118.418 1.065 1
1 512 . 4 1 1 A 54 54 ALA H H 258 7.967 7.835 0.132 1
1 513 . 4 1 1 A 54 54 ALA HA H 258 4.240 4.109 0.131 1
1 517 . 4 1 1 A 54 54 ALA CA C 258 54.552 55.335 -0.783 1
1 518 . 4 1 1 A 54 54 ALA CB C 258 18.699 17.904 0.795 1
1 519 . 4 1 1 A 54 54 ALA N N 258 124.293 122.760 1.533 1
1 520 . 4 1 1 A 55 55 LEU H H 259 8.695 8.322 0.373 1
1 521 . 4 1 1 A 55 55 LEU HA H 259 3.902 3.960 -0.058 1
1 530 . 4 1 1 A 55 55 LEU CA C 259 57.130 57.910 -0.780 1
1 531 . 4 1 1 A 55 55 LEU CB C 259 41.192 41.667 -0.475 1
1 535 . 4 1 1 A 55 55 LEU N N 259 118.361 118.995 -0.634 1
1 536 . 4 1 1 A 56 56 GLY H H 260 8.177 8.056 0.121 1
1 537 . 4 1 1 A 56 56 GLY HA2 H 260 3.723 3.743 -0.020 1
1 538 . 4 1 1 A 56 56 GLY HA3 H 260 3.971 3.743 0.228 1
1 539 . 4 1 1 A 56 56 GLY CA C 260 46.302 47.404 -1.102 1
1 540 . 4 1 1 A 56 56 GLY N N 260 105.789 106.664 -0.875 1
1 541 . 4 1 1 A 57 57 ASN H H 261 7.914 7.606 0.308 1
1 542 . 4 1 1 A 57 57 ASN HA H 261 4.643 4.431 0.212 1
1 547 . 4 1 1 A 57 57 ASN CA C 261 54.945 55.507 -0.562 1
1 548 . 4 1 1 A 57 57 ASN CB C 261 37.533 38.317 -0.784 1
1 549 . 4 1 1 A 57 57 ASN N N 261 121.132 119.787 1.345 1
1 551 . 4 1 1 A 58 58 ILE H H 262 8.732 8.023 0.709 1
1 552 . 4 1 1 A 58 58 ILE HA H 262 3.712 3.586 0.126 1
1 562 . 4 1 1 A 58 58 ILE CA C 262 63.820 65.300 -1.480 1
1 563 . 4 1 1 A 58 58 ILE CB C 262 35.990 38.137 -2.147 1
1 567 . 4 1 1 A 58 58 ILE N N 262 125.309 120.504 4.805 1
1 568 . 4 1 1 A 59 59 LYS H H 263 8.416 7.913 0.503 1
1 569 . 4 1 1 A 59 59 LYS HA H 263 4.075 3.857 0.218 1
1 577 . 4 1 1 A 59 59 LYS CA C 263 59.708 60.541 -0.833 1
1 578 . 4 1 1 A 59 59 LYS CB C 263 31.343 32.276 -0.933 1
1 582 . 4 1 1 A 59 59 LYS N N 263 122.080 118.609 3.471 1
1 583 . 4 1 1 A 60 60 LYS H H 264 7.793 7.379 0.414 1
1 584 . 4 1 1 A 60 60 LYS HA H 264 4.036 4.030 0.006 1
1 591 . 4 1 1 A 60 60 LYS CA C 264 59.708 59.135 0.573 1
1 592 . 4 1 1 A 60 60 LYS CB C 264 31.865 31.874 -0.009 1
1 596 . 4 1 1 A 60 60 LYS N N 264 119.503 119.565 -0.062 1
1 597 . 4 1 1 A 61 61 LEU H H 265 7.797 7.966 -0.169 1
1 598 . 4 1 1 A 61 61 LEU HA H 265 4.106 4.021 0.085 1
1 608 . 4 1 1 A 61 61 LEU CA C 265 57.646 58.192 -0.546 1
1 609 . 4 1 1 A 61 61 LEU CB C 265 40.177 41.612 -1.435 1
1 613 . 4 1 1 A 61 61 LEU N N 265 121.392 122.237 -0.845 1
1 614 . 4 1 1 A 62 62 SER H H 266 8.775 8.075 0.700 1
1 615 . 4 1 1 A 62 62 SER HA H 266 4.001 4.140 -0.139 1
1 619 . 4 1 1 A 62 62 SER CA C 266 60.224 61.667 -1.443 1
1 620 . 4 1 1 A 62 62 SER CB C 266 62.758 62.889 -0.131 1
1 621 . 4 1 1 A 62 62 SER N N 266 112.902 116.570 -3.668 1
1 622 . 4 1 1 A 63 63 ASN H H 267 8.199 8.162 0.037 1
1 623 . 4 1 1 A 63 63 ASN HA H 267 4.393 4.366 0.027 1
1 628 . 4 1 1 A 63 63 ASN CA C 267 55.583 56.587 -1.004 1
1 629 . 4 1 1 A 63 63 ASN CB C 267 37.537 38.105 -0.568 1
1 630 . 4 1 1 A 63 63 ASN N N 267 117.813 120.686 -2.873 1
1 632 . 4 1 1 A 64 64 ARG H H 268 8.000 7.747 0.253 1
1 633 . 4 1 1 A 64 64 ARG HA H 268 4.118 4.094 0.024 1
1 640 . 4 1 1 A 64 64 ARG CA C 268 57.646 58.991 -1.345 1
1 641 . 4 1 1 A 64 64 ARG CB C 268 29.307 29.962 -0.655 1
1 644 . 4 1 1 A 64 64 ARG N N 268 120.911 120.808 0.103 1
1 645 . 4 1 1 A 65 65 LEU H H 269 9.119 8.031 1.088 1
1 646 . 4 1 1 A 65 65 LEU HA H 269 3.916 4.089 -0.173 1
1 656 . 4 1 1 A 65 65 LEU CA C 269 57.124 57.975 -0.851 1
1 657 . 4 1 1 A 65 65 LEU CB C 269 41.662 41.343 0.319 1
1 661 . 4 1 1 A 65 65 LEU N N 269 119.046 120.718 -1.672 1
1 662 . 4 1 1 A 66 66 ALA H H 270 8.245 8.554 -0.309 1
1 663 . 4 1 1 A 66 66 ALA HA H 270 3.997 3.951 0.046 1
1 667 . 4 1 1 A 66 66 ALA CA C 270 54.337 54.881 -0.544 1
1 668 . 4 1 1 A 66 66 ALA CB C 270 16.696 18.327 -1.631 1
1 669 . 4 1 1 A 66 66 ALA N N 270 121.047 120.771 0.276 1
1 670 . 4 1 1 A 67 67 GLN H H 271 7.704 7.459 0.245 1
1 671 . 4 1 1 A 67 67 GLN HA H 271 4.025 4.079 -0.054 1
1 678 . 4 1 1 A 67 67 GLN CA C 271 58.418 58.938 -0.520 1
1 679 . 4 1 1 A 67 67 GLN CB C 271 27.996 28.472 -0.476 1
1 681 . 4 1 1 A 67 67 GLN N N 271 118.440 117.310 1.130 1
1 683 . 4 1 1 A 68 68 ILE H H 272 8.142 7.740 0.402 1
1 684 . 4 1 1 A 68 68 ILE HA H 272 3.723 3.641 0.082 1
1 694 . 4 1 1 A 68 68 ILE CA C 272 64.605 65.518 -0.913 1
1 695 . 4 1 1 A 68 68 ILE CB C 272 37.793 38.129 -0.336 1
1 699 . 4 1 1 A 68 68 ILE N N 272 119.521 119.666 -0.145 1
1 700 . 4 1 1 A 69 69 CYS H H 273 8.817 8.226 0.591 1
1 701 . 4 1 1 A 69 69 CYS HA H 273 3.958 4.352 -0.394 1
1 704 . 4 1 1 A 69 69 CYS CA C 273 64.204 61.056 3.148 1
1 705 . 4 1 1 A 69 69 CYS CB C 273 26.337 26.994 -0.657 1
1 706 . 4 1 1 A 69 69 CYS N N 273 117.234 118.602 -1.368 1
1 707 . 4 1 1 A 70 70 SER H H 274 7.880 7.793 0.087 1
1 708 . 4 1 1 A 70 70 SER HA H 274 4.246 4.340 -0.094 1
1 710 . 4 1 1 A 70 70 SER CA C 274 60.008 60.811 -0.803 1
1 711 . 4 1 1 A 70 70 SER CB C 274 62.071 63.167 -1.096 1
1 712 . 4 1 1 A 70 70 SER N N 274 114.227 116.751 -2.524 1
1 713 . 4 1 1 A 71 71 SER H H 275 7.609 7.702 -0.093 1
1 714 . 4 1 1 A 71 71 SER HA H 275 4.564 4.517 0.047 1
1 717 . 4 1 1 A 71 71 SER CA C 275 57.946 58.261 -0.315 1
1 718 . 4 1 1 A 71 71 SER CB C 275 63.618 63.745 -0.127 1
1 719 . 4 1 1 A 71 71 SER N N 275 114.958 113.838 1.120 1
1 720 . 4 1 1 A 72 72 ILE H H 276 7.357 7.328 0.029 1
1 721 . 4 1 1 A 72 72 ILE HA H 276 4.169 3.939 0.230 1
1 731 . 4 1 1 A 72 72 ILE CA C 276 60.967 62.054 -1.087 1
1 732 . 4 1 1 A 72 72 ILE CB C 276 38.276 38.208 0.068 1
1 736 . 4 1 1 A 72 72 ILE N N 276 123.513 123.225 0.288 1
1 737 . 4 1 1 A 73 73 ARG H H 277 8.508 8.683 -0.175 1
1 738 . 4 1 1 A 73 73 ARG HA H 277 4.446 4.664 -0.218 1
1 744 . 4 1 1 A 73 73 ARG CA C 277 55.324 55.430 -0.106 1
1 745 . 4 1 1 A 73 73 ARG CB C 277 30.499 30.174 0.325 1
1 748 . 4 1 1 A 73 73 ARG N N 277 126.709 128.115 -1.406 1
1 749 . 4 1 1 A 75 75 HIS HA H 279 4.602 4.773 -0.171 1
1 754 . 4 1 1 A 75 75 HIS CA C 279 55.840 57.147 -1.307 1
1 755 . 4 1 1 A 75 75 HIS CB C 279 30.426 32.256 -1.830 1
1 143 . 5 1 1 A 21 21 LYS H H 225 8.503 8.174 0.329 1
1 144 . 5 1 1 A 21 21 LYS HA H 225 4.349 4.270 0.079 1
1 152 . 5 1 1 A 21 21 LYS CA C 225 54.872 57.242 -2.370 1
1 153 . 5 1 1 A 21 21 LYS CB C 225 31.667 32.641 -0.974 1
1 157 . 5 1 1 A 21 21 LYS N N 225 122.563 126.937 -4.374 1
1 158 . 5 1 1 A 22 22 GLU H H 226 7.688 7.788 -0.100 1
1 159 . 5 1 1 A 22 22 GLU HA H 226 4.264 4.927 -0.663 1
1 163 . 5 1 1 A 22 22 GLU CA C 226 55.728 55.694 0.034 1
1 164 . 5 1 1 A 22 22 GLU CB C 226 30.636 32.070 -1.434 1
1 166 . 5 1 1 A 22 22 GLU N N 226 119.810 121.012 -1.202 1
1 167 . 5 1 1 A 23 23 ILE H H 227 8.111 8.397 -0.286 1
1 168 . 5 1 1 A 23 23 ILE HA H 227 4.498 4.653 -0.155 1
1 178 . 5 1 1 A 23 23 ILE CA C 227 60.027 60.287 -0.260 1
1 179 . 5 1 1 A 23 23 ILE CB C 227 38.370 39.503 -1.133 1
1 183 . 5 1 1 A 23 23 ILE N N 227 122.085 125.838 -3.753 1
1 184 . 5 1 1 A 24 24 PHE H H 228 7.818 8.457 -0.639 1
1 185 . 5 1 1 A 24 24 PHE HA H 228 5.467 5.187 0.280 1
1 193 . 5 1 1 A 24 24 PHE CA C 228 54.551 55.809 -1.258 1
1 194 . 5 1 1 A 24 24 PHE CB C 228 41.685 41.703 -0.018 1
1 200 . 5 1 1 A 24 24 PHE N N 228 118.840 123.631 -4.791 1
1 201 . 5 1 1 A 25 25 LEU H H 229 9.271 9.029 0.242 1
1 202 . 5 1 1 A 25 25 LEU HA H 229 4.953 5.080 -0.127 1
1 212 . 5 1 1 A 25 25 LEU CA C 229 52.892 53.468 -0.576 1
1 213 . 5 1 1 A 25 25 LEU CB C 229 44.755 44.407 0.348 1
1 217 . 5 1 1 A 25 25 LEU N N 229 123.803 120.888 2.915 1
1 218 . 5 1 1 A 26 26 THR H H 230 8.493 9.014 -0.521 1
1 219 . 5 1 1 A 26 26 THR HA H 230 5.104 5.113 -0.009 1
1 224 . 5 1 1 A 26 26 THR CA C 230 61.771 62.212 -0.441 1
1 225 . 5 1 1 A 26 26 THR CB C 230 68.733 69.242 -0.509 1
1 227 . 5 1 1 A 26 26 THR N N 230 121.119 121.713 -0.594 1
1 228 . 5 1 1 A 27 27 VAL H H 231 9.001 8.689 0.312 1
1 229 . 5 1 1 A 27 27 VAL HA H 231 4.600 4.544 0.056 1
1 237 . 5 1 1 A 27 27 VAL CA C 231 56.940 59.164 -2.224 1
1 238 . 5 1 1 A 27 27 VAL CB C 231 33.730 32.765 0.965 1
1 241 . 5 1 1 A 27 27 VAL N N 231 124.749 127.299 -2.550 1
1 242 . 5 1 1 A 28 28 PRO HA H 232 4.661 4.938 -0.277 1
1 249 . 5 1 1 A 28 28 PRO CA C 232 62.233 62.334 -0.101 1
1 250 . 5 1 1 A 28 28 PRO CB C 232 31.667 31.734 -0.067 1
1 253 . 5 1 1 A 29 29 VAL H H 233 8.171 8.071 0.100 1
1 254 . 5 1 1 A 29 29 VAL HA H 233 4.565 3.922 0.643 1
1 262 . 5 1 1 A 29 29 VAL CA C 233 60.027 63.757 -3.730 1
1 263 . 5 1 1 A 29 29 VAL CB C 233 32.699 31.302 1.397 1
1 266 . 5 1 1 A 29 29 VAL N N 233 116.136 121.246 -5.110 1
1 267 . 5 1 1 A 30 30 GLY H H 234 8.143 8.653 -0.510 1
1 268 . 5 1 1 A 30 30 GLY HA2 H 234 3.824 3.832 -0.008 1
1 269 . 5 1 1 A 30 30 GLY HA3 H 234 4.209 3.832 0.377 1
1 270 . 5 1 1 A 30 30 GLY CA C 234 44.635 47.277 -2.642 1
1 271 . 5 1 1 A 30 30 GLY N N 234 110.455 114.946 -4.491 1
1 272 . 5 1 1 A 32 32 GLY H H 236 8.305 8.342 -0.037 1
1 273 . 5 1 1 A 32 32 GLY HA2 H 236 3.836 4.196 -0.360 1
1 274 . 5 1 1 A 32 32 GLY HA3 H 236 4.103 4.196 -0.093 1
1 275 . 5 1 1 A 32 32 GLY CA C 236 44.635 46.200 -1.565 1
1 276 . 5 1 1 A 32 32 GLY N N 236 107.539 110.748 -3.209 1
1 277 . 5 1 1 A 33 33 GLU H H 237 7.583 8.147 -0.564 1
1 278 . 5 1 1 A 33 33 GLU HA H 237 4.564 4.509 0.055 1
1 283 . 5 1 1 A 33 33 GLU CA C 237 54.355 55.632 -1.277 1
1 284 . 5 1 1 A 33 33 GLU CB C 237 30.636 30.883 -0.247 1
1 286 . 5 1 1 A 33 33 GLU N N 237 120.218 121.267 -1.049 1
1 287 . 5 1 1 A 34 34 SER H H 238 8.630 8.707 -0.077 1
1 288 . 5 1 1 A 34 34 SER HA H 238 5.012 5.509 -0.497 1
1 291 . 5 1 1 A 34 34 SER CA C 238 56.915 56.239 0.676 1
1 292 . 5 1 1 A 34 34 SER CB C 238 64.663 66.001 -1.338 1
1 293 . 5 1 1 A 34 34 SER N N 238 116.390 113.225 3.165 1
1 294 . 5 1 1 A 35 35 LEU H H 239 8.838 9.053 -0.215 1
1 295 . 5 1 1 A 35 35 LEU HA H 239 4.577 4.945 -0.368 1
1 305 . 5 1 1 A 35 35 LEU CA C 239 52.808 53.643 -0.835 1
1 306 . 5 1 1 A 35 35 LEU CB C 239 44.156 43.674 0.482 1
1 310 . 5 1 1 A 35 35 LEU N N 239 124.463 125.090 -0.627 1
1 311 . 5 1 1 A 36 36 ARG H H 240 8.526 8.875 -0.349 1
1 312 . 5 1 1 A 36 36 ARG HA H 240 5.077 4.835 0.242 1
1 318 . 5 1 1 A 36 36 ARG CA C 240 54.483 54.979 -0.496 1
1 319 . 5 1 1 A 36 36 ARG CB C 240 30.777 31.815 -1.038 1
1 322 . 5 1 1 A 36 36 ARG N N 240 124.891 124.633 0.258 1
1 323 . 5 1 1 A 37 37 LEU H H 241 9.179 8.729 0.450 1
1 324 . 5 1 1 A 37 37 LEU HA H 241 4.740 5.039 -0.299 1
1 334 . 5 1 1 A 37 37 LEU CA C 241 52.292 53.589 -1.297 1
1 335 . 5 1 1 A 37 37 LEU CB C 241 43.208 45.808 -2.600 1
1 339 . 5 1 1 A 37 37 LEU N N 241 126.203 128.557 -2.354 1
1 340 . 5 1 1 A 38 38 LEU H H 242 8.825 8.490 0.335 1
1 341 . 5 1 1 A 38 38 LEU HA H 242 4.371 4.616 -0.245 1
1 351 . 5 1 1 A 38 38 LEU CA C 242 54.508 54.645 -0.137 1
1 352 . 5 1 1 A 38 38 LEU CB C 242 41.583 42.143 -0.560 1
1 356 . 5 1 1 A 38 38 LEU N N 242 124.999 127.613 -2.614 1
1 357 . 5 1 1 A 39 39 ALA H H 243 8.634 9.259 -0.625 1
1 358 . 5 1 1 A 39 39 ALA HA H 243 3.799 4.011 -0.212 1
1 362 . 5 1 1 A 39 39 ALA CA C 243 54.852 55.345 -0.493 1
1 363 . 5 1 1 A 39 39 ALA CB C 243 18.243 18.275 -0.032 1
1 364 . 5 1 1 A 39 39 ALA N N 243 125.146 125.849 -0.703 1
1 365 . 5 1 1 A 40 40 SER H H 244 8.414 8.360 0.054 1
1 366 . 5 1 1 A 40 40 SER HA H 244 4.074 4.164 -0.090 1
1 369 . 5 1 1 A 40 40 SER CA C 244 58.977 61.095 -2.118 1
1 370 . 5 1 1 A 40 40 SER CB C 244 61.561 63.185 -1.624 1
1 371 . 5 1 1 A 40 40 SER N N 244 109.494 112.748 -3.254 1
1 372 . 5 1 1 A 41 41 ASP H H 245 7.434 7.931 -0.497 1
1 373 . 5 1 1 A 41 41 ASP HA H 245 4.809 4.910 -0.101 1
1 376 . 5 1 1 A 41 41 ASP CA C 245 52.990 53.088 -0.098 1
1 377 . 5 1 1 A 41 41 ASP CB C 245 41.792 41.396 0.396 1
1 378 . 5 1 1 A 41 41 ASP N N 245 120.452 118.966 1.486 1
1 379 . 5 1 1 A 42 42 LEU H H 246 7.338 8.078 -0.740 1
1 380 . 5 1 1 A 42 42 LEU HA H 246 4.098 4.320 -0.222 1
1 389 . 5 1 1 A 42 42 LEU CA C 246 55.068 55.725 -0.657 1
1 390 . 5 1 1 A 42 42 LEU CB C 246 41.861 41.991 -0.130 1
1 393 . 5 1 1 A 42 42 LEU N N 246 121.293 122.757 -1.464 1
1 394 . 5 1 1 A 43 43 GLN H H 247 8.170 8.768 -0.598 1
1 395 . 5 1 1 A 43 43 GLN HA H 247 4.532 4.395 0.137 1
1 401 . 5 1 1 A 43 43 GLN CA C 247 53.005 55.188 -2.183 1
1 402 . 5 1 1 A 43 43 GLN CB C 247 30.978 29.455 1.523 1
1 404 . 5 1 1 A 43 43 GLN N N 247 122.477 126.623 -4.146 1
1 406 . 5 1 1 A 44 44 ARG HA H 248 3.753 3.901 -0.148 1
1 412 . 5 1 1 A 44 44 ARG CA C 248 59.812 59.506 0.306 1
1 413 . 5 1 1 A 44 44 ARG CB C 248 29.306 30.352 -1.046 1
1 416 . 5 1 1 A 45 45 HIS H H 249 8.364 8.337 0.027 1
1 417 . 5 1 1 A 45 45 HIS HA H 249 4.294 4.282 0.012 1
1 422 . 5 1 1 A 45 45 HIS CA C 249 58.462 59.277 -0.815 1
1 423 . 5 1 1 A 45 45 HIS CB C 249 29.071 28.492 0.579 1
1 424 . 5 1 1 A 45 45 HIS N N 249 114.528 117.211 -2.683 1
1 425 . 5 1 1 A 46 46 SER H H 250 7.020 7.569 -0.549 1
1 426 . 5 1 1 A 46 46 SER HA H 250 4.153 4.397 -0.244 1
1 428 . 5 1 1 A 46 46 SER CA C 250 59.493 62.297 -2.804 1
1 429 . 5 1 1 A 46 46 SER CB C 250 62.071 62.926 -0.855 1
1 430 . 5 1 1 A 46 46 SER N N 250 113.900 115.506 -1.606 1
1 431 . 5 1 1 A 47 47 ILE H H 251 7.106 7.531 -0.425 1
1 432 . 5 1 1 A 47 47 ILE HA H 251 3.994 4.055 -0.061 1
1 441 . 5 1 1 A 47 47 ILE CA C 251 60.337 62.669 -2.332 1
1 442 . 5 1 1 A 47 47 ILE CB C 251 36.727 38.324 -1.597 1
1 446 . 5 1 1 A 47 47 ILE N N 251 115.759 120.417 -4.658 1
1 447 . 5 1 1 A 48 48 ALA H H 252 8.117 7.674 0.443 1
1 448 . 5 1 1 A 48 48 ALA HA H 252 3.979 4.204 -0.225 1
1 452 . 5 1 1 A 48 48 ALA CA C 252 53.821 52.733 1.088 1
1 453 . 5 1 1 A 48 48 ALA CB C 252 17.727 18.834 -1.107 1
1 454 . 5 1 1 A 48 48 ALA N N 252 120.091 123.202 -3.111 1
1 455 . 5 1 1 A 49 49 GLN H H 253 7.346 8.051 -0.705 1
1 456 . 5 1 1 A 49 49 GLN HA H 253 4.324 4.349 -0.025 1
1 463 . 5 1 1 A 49 49 GLN CA C 253 54.552 55.410 -0.858 1
1 464 . 5 1 1 A 49 49 GLN CB C 253 28.255 28.469 -0.214 1
1 466 . 5 1 1 A 49 49 GLN N N 253 112.219 114.596 -2.377 1
1 468 . 5 1 1 A 50 50 LEU H H 254 7.243 7.397 -0.154 1
1 469 . 5 1 1 A 50 50 LEU HA H 254 4.198 4.458 -0.260 1
1 479 . 5 1 1 A 50 50 LEU CA C 254 53.971 54.424 -0.453 1
1 480 . 5 1 1 A 50 50 LEU CB C 254 41.662 42.524 -0.862 1
1 484 . 5 1 1 A 50 50 LEU N N 254 120.510 122.305 -1.795 1
1 485 . 5 1 1 A 51 51 ASP H H 255 8.210 8.577 -0.367 1
1 486 . 5 1 1 A 51 51 ASP HA H 255 4.664 5.123 -0.459 1
1 489 . 5 1 1 A 51 51 ASP CA C 255 52.490 51.012 1.478 1
1 490 . 5 1 1 A 51 51 ASP CB C 255 40.259 41.337 -1.078 1
1 491 . 5 1 1 A 51 51 ASP N N 255 119.691 119.174 0.517 1
1 492 . 5 1 1 A 52 52 PRO HA H 256 4.125 4.306 -0.181 1
1 499 . 5 1 1 A 52 52 PRO CA C 256 65.380 65.672 -0.292 1
1 500 . 5 1 1 A 52 52 PRO CB C 256 31.865 31.690 0.175 1
1 503 . 5 1 1 A 53 53 GLU H H 257 8.432 8.389 0.043 1
1 504 . 5 1 1 A 53 53 GLU HA H 257 4.073 4.110 -0.037 1
1 508 . 5 1 1 A 53 53 GLU CA C 257 58.677 59.475 -0.798 1
1 509 . 5 1 1 A 53 53 GLU CB C 257 28.771 29.157 -0.386 1
1 511 . 5 1 1 A 53 53 GLU N N 257 119.483 118.153 1.330 1
1 512 . 5 1 1 A 54 54 ALA H H 258 7.967 7.783 0.184 1
1 513 . 5 1 1 A 54 54 ALA HA H 258 4.240 3.987 0.253 1
1 517 . 5 1 1 A 54 54 ALA CA C 258 54.552 55.174 -0.622 1
1 518 . 5 1 1 A 54 54 ALA CB C 258 18.699 18.590 0.109 1
1 519 . 5 1 1 A 54 54 ALA N N 258 124.293 122.623 1.670 1
1 520 . 5 1 1 A 55 55 LEU H H 259 8.695 8.310 0.385 1
1 521 . 5 1 1 A 55 55 LEU HA H 259 3.902 3.931 -0.029 1
1 530 . 5 1 1 A 55 55 LEU CA C 259 57.130 58.084 -0.954 1
1 531 . 5 1 1 A 55 55 LEU CB C 259 41.192 41.746 -0.554 1
1 535 . 5 1 1 A 55 55 LEU N N 259 118.361 118.653 -0.292 1
1 536 . 5 1 1 A 56 56 GLY H H 260 8.177 7.883 0.294 1
1 537 . 5 1 1 A 56 56 GLY HA2 H 260 3.723 3.735 -0.012 1
1 538 . 5 1 1 A 56 56 GLY HA3 H 260 3.971 3.736 0.235 1
1 539 . 5 1 1 A 56 56 GLY CA C 260 46.302 47.383 -1.081 1
1 540 . 5 1 1 A 56 56 GLY N N 260 105.789 106.234 -0.445 1
1 541 . 5 1 1 A 57 57 ASN H H 261 7.914 7.434 0.480 1
1 542 . 5 1 1 A 57 57 ASN HA H 261 4.643 4.450 0.193 1
1 547 . 5 1 1 A 57 57 ASN CA C 261 54.945 55.507 -0.562 1
1 548 . 5 1 1 A 57 57 ASN CB C 261 37.533 38.078 -0.545 1
1 549 . 5 1 1 A 57 57 ASN N N 261 121.132 120.220 0.912 1
1 551 . 5 1 1 A 58 58 ILE H H 262 8.732 7.885 0.847 1
1 552 . 5 1 1 A 58 58 ILE HA H 262 3.712 3.697 0.015 1
1 562 . 5 1 1 A 58 58 ILE CA C 262 63.820 64.925 -1.105 1
1 563 . 5 1 1 A 58 58 ILE CB C 262 35.990 38.002 -2.012 1
1 567 . 5 1 1 A 58 58 ILE N N 262 125.309 120.657 4.652 1
1 568 . 5 1 1 A 59 59 LYS H H 263 8.416 8.125 0.291 1
1 569 . 5 1 1 A 59 59 LYS HA H 263 4.075 3.848 0.227 1
1 577 . 5 1 1 A 59 59 LYS CA C 263 59.708 60.484 -0.776 1
1 578 . 5 1 1 A 59 59 LYS CB C 263 31.343 32.328 -0.985 1
1 582 . 5 1 1 A 59 59 LYS N N 263 122.080 118.799 3.281 1
1 583 . 5 1 1 A 60 60 LYS H H 264 7.793 7.952 -0.159 1
1 584 . 5 1 1 A 60 60 LYS HA H 264 4.036 4.058 -0.022 1
1 591 . 5 1 1 A 60 60 LYS CA C 264 59.708 58.855 0.853 1
1 592 . 5 1 1 A 60 60 LYS CB C 264 31.865 31.740 0.125 1
1 596 . 5 1 1 A 60 60 LYS N N 264 119.503 118.422 1.081 1
1 597 . 5 1 1 A 61 61 LEU H H 265 7.797 7.736 0.061 1
1 598 . 5 1 1 A 61 61 LEU HA H 265 4.106 4.039 0.067 1
1 608 . 5 1 1 A 61 61 LEU CA C 265 57.646 58.156 -0.510 1
1 609 . 5 1 1 A 61 61 LEU CB C 265 40.177 41.460 -1.283 1
1 613 . 5 1 1 A 61 61 LEU N N 265 121.392 121.970 -0.578 1
1 614 . 5 1 1 A 62 62 SER H H 266 8.775 8.142 0.633 1
1 615 . 5 1 1 A 62 62 SER HA H 266 4.001 4.222 -0.221 1
1 619 . 5 1 1 A 62 62 SER CA C 266 60.224 61.289 -1.065 1
1 620 . 5 1 1 A 62 62 SER CB C 266 62.758 62.663 0.095 1
1 621 . 5 1 1 A 62 62 SER N N 266 112.902 114.467 -1.565 1
1 622 . 5 1 1 A 63 63 ASN H H 267 8.199 8.211 -0.012 1
1 623 . 5 1 1 A 63 63 ASN HA H 267 4.393 4.384 0.009 1
1 628 . 5 1 1 A 63 63 ASN CA C 267 55.583 56.554 -0.971 1
1 629 . 5 1 1 A 63 63 ASN CB C 267 37.537 38.105 -0.568 1
1 630 . 5 1 1 A 63 63 ASN N N 267 117.813 120.394 -2.581 1
1 632 . 5 1 1 A 64 64 ARG H H 268 8.000 7.814 0.186 1
1 633 . 5 1 1 A 64 64 ARG HA H 268 4.118 4.100 0.018 1
1 640 . 5 1 1 A 64 64 ARG CA C 268 57.646 59.108 -1.462 1
1 641 . 5 1 1 A 64 64 ARG CB C 268 29.307 29.884 -0.577 1
1 644 . 5 1 1 A 64 64 ARG N N 268 120.911 120.947 -0.036 1
1 645 . 5 1 1 A 65 65 LEU H H 269 9.119 7.906 1.213 1
1 646 . 5 1 1 A 65 65 LEU HA H 269 3.916 4.070 -0.154 1
1 656 . 5 1 1 A 65 65 LEU CA C 269 57.124 58.032 -0.908 1
1 657 . 5 1 1 A 65 65 LEU CB C 269 41.662 41.297 0.365 1
1 661 . 5 1 1 A 65 65 LEU N N 269 119.046 120.622 -1.576 1
1 662 . 5 1 1 A 66 66 ALA H H 270 8.245 8.461 -0.216 1
1 663 . 5 1 1 A 66 66 ALA HA H 270 3.997 3.940 0.057 1
1 667 . 5 1 1 A 66 66 ALA CA C 270 54.337 55.068 -0.731 1
1 668 . 5 1 1 A 66 66 ALA CB C 270 16.696 18.163 -1.467 1
1 669 . 5 1 1 A 66 66 ALA N N 270 121.047 120.713 0.334 1
1 670 . 5 1 1 A 67 67 GLN H H 271 7.704 7.583 0.121 1
1 671 . 5 1 1 A 67 67 GLN HA H 271 4.025 4.002 0.023 1
1 678 . 5 1 1 A 67 67 GLN CA C 271 58.418 58.804 -0.386 1
1 679 . 5 1 1 A 67 67 GLN CB C 271 27.996 28.211 -0.215 1
1 681 . 5 1 1 A 67 67 GLN N N 271 118.440 117.788 0.652 1
1 683 . 5 1 1 A 68 68 ILE H H 272 8.142 7.700 0.442 1
1 684 . 5 1 1 A 68 68 ILE HA H 272 3.723 3.733 -0.010 1
1 694 . 5 1 1 A 68 68 ILE CA C 272 64.605 65.192 -0.587 1
1 695 . 5 1 1 A 68 68 ILE CB C 272 37.793 37.793 0.000 1
1 699 . 5 1 1 A 68 68 ILE N N 272 119.521 119.675 -0.154 1
1 700 . 5 1 1 A 69 69 CYS H H 273 8.817 7.982 0.835 1
1 701 . 5 1 1 A 69 69 CYS HA H 273 3.958 4.079 -0.121 1
1 704 . 5 1 1 A 69 69 CYS CA C 273 64.204 62.721 1.483 1
1 705 . 5 1 1 A 69 69 CYS CB C 273 26.337 27.000 -0.663 1
1 706 . 5 1 1 A 69 69 CYS N N 273 117.234 119.626 -2.392 1
1 707 . 5 1 1 A 70 70 SER H H 274 7.880 7.770 0.110 1
1 708 . 5 1 1 A 70 70 SER HA H 274 4.246 4.254 -0.008 1
1 710 . 5 1 1 A 70 70 SER CA C 274 60.008 61.251 -1.243 1
1 711 . 5 1 1 A 70 70 SER CB C 274 62.071 63.239 -1.168 1
1 712 . 5 1 1 A 70 70 SER N N 274 114.227 116.078 -1.851 1
1 713 . 5 1 1 A 71 71 SER H H 275 7.609 7.443 0.166 1
1 714 . 5 1 1 A 71 71 SER HA H 275 4.564 4.211 0.353 1
1 717 . 5 1 1 A 71 71 SER CA C 275 57.946 61.182 -3.236 1
1 718 . 5 1 1 A 71 71 SER CB C 275 63.618 63.243 0.375 1
1 719 . 5 1 1 A 71 71 SER N N 275 114.958 114.031 0.927 1
1 720 . 5 1 1 A 72 72 ILE H H 276 7.357 7.544 -0.187 1
1 721 . 5 1 1 A 72 72 ILE HA H 276 4.169 3.981 0.188 1
1 731 . 5 1 1 A 72 72 ILE CA C 276 60.967 62.047 -1.080 1
1 732 . 5 1 1 A 72 72 ILE CB C 276 38.276 38.105 0.171 1
1 736 . 5 1 1 A 72 72 ILE N N 276 123.513 122.324 1.189 1
1 737 . 5 1 1 A 73 73 ARG H H 277 8.508 8.608 -0.100 1
1 738 . 5 1 1 A 73 73 ARG HA H 277 4.446 4.510 -0.064 1
1 744 . 5 1 1 A 73 73 ARG CA C 277 55.324 55.930 -0.606 1
1 745 . 5 1 1 A 73 73 ARG CB C 277 30.499 29.254 1.245 1
1 748 . 5 1 1 A 73 73 ARG N N 277 126.709 128.206 -1.497 1
1 749 . 5 1 1 A 75 75 HIS HA H 279 4.602 4.270 0.332 1
1 754 . 5 1 1 A 75 75 HIS CA C 279 55.840 59.105 -3.265 1
1 755 . 5 1 1 A 75 75 HIS CB C 279 30.426 29.926 0.500 1
1 143 . 6 1 1 A 21 21 LYS H H 225 8.503 8.826 -0.323 1
1 144 . 6 1 1 A 21 21 LYS HA H 225 4.349 4.265 0.084 1
1 152 . 6 1 1 A 21 21 LYS CA C 225 54.872 57.632 -2.760 1
1 153 . 6 1 1 A 21 21 LYS CB C 225 31.667 32.900 -1.233 1
1 157 . 6 1 1 A 21 21 LYS N N 225 122.563 127.141 -4.578 1
1 158 . 6 1 1 A 22 22 GLU H H 226 7.688 7.894 -0.206 1
1 159 . 6 1 1 A 22 22 GLU HA H 226 4.264 4.267 -0.003 1
1 163 . 6 1 1 A 22 22 GLU CA C 226 55.728 56.683 -0.955 1
1 164 . 6 1 1 A 22 22 GLU CB C 226 30.636 30.279 0.357 1
1 166 . 6 1 1 A 22 22 GLU N N 226 119.810 119.994 -0.184 1
1 167 . 6 1 1 A 23 23 ILE H H 227 8.111 8.286 -0.175 1
1 168 . 6 1 1 A 23 23 ILE HA H 227 4.498 4.552 -0.054 1
1 178 . 6 1 1 A 23 23 ILE CA C 227 60.027 60.189 -0.162 1
1 179 . 6 1 1 A 23 23 ILE CB C 227 38.370 39.576 -1.206 1
1 183 . 6 1 1 A 23 23 ILE N N 227 122.085 125.169 -3.084 1
1 184 . 6 1 1 A 24 24 PHE H H 228 7.818 8.302 -0.484 1
1 185 . 6 1 1 A 24 24 PHE HA H 228 5.467 5.290 0.177 1
1 193 . 6 1 1 A 24 24 PHE CA C 228 54.551 55.837 -1.286 1
1 194 . 6 1 1 A 24 24 PHE CB C 228 41.685 41.722 -0.037 1
1 200 . 6 1 1 A 24 24 PHE N N 228 118.840 122.608 -3.768 1
1 201 . 6 1 1 A 25 25 LEU H H 229 9.271 8.931 0.340 1
1 202 . 6 1 1 A 25 25 LEU HA H 229 4.953 5.154 -0.201 1
1 212 . 6 1 1 A 25 25 LEU CA C 229 52.892 53.574 -0.682 1
1 213 . 6 1 1 A 25 25 LEU CB C 229 44.755 44.586 0.169 1
1 217 . 6 1 1 A 25 25 LEU N N 229 123.803 120.652 3.151 1
1 218 . 6 1 1 A 26 26 THR H H 230 8.493 8.986 -0.493 1
1 219 . 6 1 1 A 26 26 THR HA H 230 5.104 4.924 0.180 1
1 224 . 6 1 1 A 26 26 THR CA C 230 61.771 62.196 -0.425 1
1 225 . 6 1 1 A 26 26 THR CB C 230 68.733 69.532 -0.799 1
1 227 . 6 1 1 A 26 26 THR N N 230 121.119 121.233 -0.114 1
1 228 . 6 1 1 A 27 27 VAL H H 231 9.001 8.468 0.533 1
1 229 . 6 1 1 A 27 27 VAL HA H 231 4.600 4.589 0.011 1
1 237 . 6 1 1 A 27 27 VAL CA C 231 56.940 59.358 -2.418 1
1 238 . 6 1 1 A 27 27 VAL CB C 231 33.730 32.757 0.973 1
1 241 . 6 1 1 A 27 27 VAL N N 231 124.749 127.074 -2.325 1
1 242 . 6 1 1 A 28 28 PRO HA H 232 4.661 4.624 0.037 1
1 249 . 6 1 1 A 28 28 PRO CA C 232 62.233 63.065 -0.832 1
1 250 . 6 1 1 A 28 28 PRO CB C 232 31.667 31.640 0.027 1
1 253 . 6 1 1 A 29 29 VAL H H 233 8.171 8.118 0.053 1
1 254 . 6 1 1 A 29 29 VAL HA H 233 4.565 3.909 0.656 1
1 262 . 6 1 1 A 29 29 VAL CA C 233 60.027 63.694 -3.667 1
1 263 . 6 1 1 A 29 29 VAL CB C 233 32.699 31.301 1.398 1
1 266 . 6 1 1 A 29 29 VAL N N 233 116.136 121.175 -5.039 1
1 267 . 6 1 1 A 30 30 GLY H H 234 8.143 8.982 -0.839 1
1 268 . 6 1 1 A 30 30 GLY HA2 H 234 3.824 3.833 -0.009 1
1 269 . 6 1 1 A 30 30 GLY HA3 H 234 4.209 3.833 0.376 1
1 270 . 6 1 1 A 30 30 GLY CA C 234 44.635 47.294 -2.659 1
1 271 . 6 1 1 A 30 30 GLY N N 234 110.455 114.882 -4.427 1
1 272 . 6 1 1 A 32 32 GLY H H 236 8.305 8.085 0.220 1
1 273 . 6 1 1 A 32 32 GLY HA2 H 236 3.836 4.189 -0.353 1
1 274 . 6 1 1 A 32 32 GLY HA3 H 236 4.103 4.189 -0.086 1
1 275 . 6 1 1 A 32 32 GLY CA C 236 44.635 46.291 -1.656 1
1 276 . 6 1 1 A 32 32 GLY N N 236 107.539 107.614 -0.075 1
1 277 . 6 1 1 A 33 33 GLU H H 237 7.583 8.233 -0.650 1
1 278 . 6 1 1 A 33 33 GLU HA H 237 4.564 4.387 0.177 1
1 283 . 6 1 1 A 33 33 GLU CA C 237 54.355 56.234 -1.879 1
1 284 . 6 1 1 A 33 33 GLU CB C 237 30.636 30.633 0.003 1
1 286 . 6 1 1 A 33 33 GLU N N 237 120.218 121.320 -1.102 1
1 287 . 6 1 1 A 34 34 SER H H 238 8.630 8.598 0.032 1
1 288 . 6 1 1 A 34 34 SER HA H 238 5.012 5.545 -0.533 1
1 291 . 6 1 1 A 34 34 SER CA C 238 56.915 56.168 0.747 1
1 292 . 6 1 1 A 34 34 SER CB C 238 64.663 66.001 -1.338 1
1 293 . 6 1 1 A 34 34 SER N N 238 116.390 113.223 3.167 1
1 294 . 6 1 1 A 35 35 LEU H H 239 8.838 8.984 -0.146 1
1 295 . 6 1 1 A 35 35 LEU HA H 239 4.577 4.818 -0.241 1
1 305 . 6 1 1 A 35 35 LEU CA C 239 52.808 53.690 -0.882 1
1 306 . 6 1 1 A 35 35 LEU CB C 239 44.156 43.915 0.241 1
1 310 . 6 1 1 A 35 35 LEU N N 239 124.463 125.180 -0.717 1
1 311 . 6 1 1 A 36 36 ARG H H 240 8.526 8.845 -0.319 1
1 312 . 6 1 1 A 36 36 ARG HA H 240 5.077 4.800 0.277 1
1 318 . 6 1 1 A 36 36 ARG CA C 240 54.483 55.041 -0.558 1
1 319 . 6 1 1 A 36 36 ARG CB C 240 30.777 31.616 -0.839 1
1 322 . 6 1 1 A 36 36 ARG N N 240 124.891 124.549 0.342 1
1 323 . 6 1 1 A 37 37 LEU H H 241 9.179 8.490 0.689 1
1 324 . 6 1 1 A 37 37 LEU HA H 241 4.740 4.997 -0.257 1
1 334 . 6 1 1 A 37 37 LEU CA C 241 52.292 53.723 -1.431 1
1 335 . 6 1 1 A 37 37 LEU CB C 241 43.208 45.846 -2.638 1
1 339 . 6 1 1 A 37 37 LEU N N 241 126.203 128.260 -2.057 1
1 340 . 6 1 1 A 38 38 LEU H H 242 8.825 8.502 0.323 1
1 341 . 6 1 1 A 38 38 LEU HA H 242 4.371 4.709 -0.338 1
1 351 . 6 1 1 A 38 38 LEU CA C 242 54.508 54.326 0.182 1
1 352 . 6 1 1 A 38 38 LEU CB C 242 41.583 42.009 -0.426 1
1 356 . 6 1 1 A 38 38 LEU N N 242 124.999 127.168 -2.169 1
1 357 . 6 1 1 A 39 39 ALA H H 243 8.634 9.201 -0.567 1
1 358 . 6 1 1 A 39 39 ALA HA H 243 3.799 4.093 -0.294 1
1 362 . 6 1 1 A 39 39 ALA CA C 243 54.852 54.994 -0.142 1
1 363 . 6 1 1 A 39 39 ALA CB C 243 18.243 18.424 -0.181 1
1 364 . 6 1 1 A 39 39 ALA N N 243 125.146 125.199 -0.053 1
1 365 . 6 1 1 A 40 40 SER H H 244 8.414 8.095 0.319 1
1 366 . 6 1 1 A 40 40 SER HA H 244 4.074 4.292 -0.218 1
1 369 . 6 1 1 A 40 40 SER CA C 244 58.977 60.791 -1.814 1
1 370 . 6 1 1 A 40 40 SER CB C 244 61.561 62.972 -1.411 1
1 371 . 6 1 1 A 40 40 SER N N 244 109.494 111.996 -2.502 1
1 372 . 6 1 1 A 41 41 ASP H H 245 7.434 8.049 -0.615 1
1 373 . 6 1 1 A 41 41 ASP HA H 245 4.809 4.884 -0.075 1
1 376 . 6 1 1 A 41 41 ASP CA C 245 52.990 53.145 -0.155 1
1 377 . 6 1 1 A 41 41 ASP CB C 245 41.792 41.615 0.177 1
1 378 . 6 1 1 A 41 41 ASP N N 245 120.452 120.666 -0.214 1
1 379 . 6 1 1 A 42 42 LEU H H 246 7.338 8.372 -1.034 1
1 380 . 6 1 1 A 42 42 LEU HA H 246 4.098 4.380 -0.282 1
1 389 . 6 1 1 A 42 42 LEU CA C 246 55.068 55.502 -0.434 1
1 390 . 6 1 1 A 42 42 LEU CB C 246 41.861 42.185 -0.324 1
1 393 . 6 1 1 A 42 42 LEU N N 246 121.293 123.561 -2.268 1
1 394 . 6 1 1 A 43 43 GLN H H 247 8.170 8.650 -0.480 1
1 395 . 6 1 1 A 43 43 GLN HA H 247 4.532 4.247 0.285 1
1 401 . 6 1 1 A 43 43 GLN CA C 247 53.005 55.555 -2.550 1
1 402 . 6 1 1 A 43 43 GLN CB C 247 30.978 28.738 2.240 1
1 404 . 6 1 1 A 43 43 GLN N N 247 122.477 126.947 -4.470 1
1 406 . 6 1 1 A 44 44 ARG HA H 248 3.753 3.813 -0.060 1
1 412 . 6 1 1 A 44 44 ARG CA C 248 59.812 59.136 0.676 1
1 413 . 6 1 1 A 44 44 ARG CB C 248 29.306 30.040 -0.734 1
1 416 . 6 1 1 A 45 45 HIS H H 249 8.364 8.386 -0.022 1
1 417 . 6 1 1 A 45 45 HIS HA H 249 4.294 4.282 0.012 1
1 422 . 6 1 1 A 45 45 HIS CA C 249 58.462 59.279 -0.817 1
1 423 . 6 1 1 A 45 45 HIS CB C 249 29.071 28.498 0.573 1
1 424 . 6 1 1 A 45 45 HIS N N 249 114.528 117.845 -3.317 1
1 425 . 6 1 1 A 46 46 SER H H 250 7.020 7.549 -0.529 1
1 426 . 6 1 1 A 46 46 SER HA H 250 4.153 4.116 0.037 1
1 428 . 6 1 1 A 46 46 SER CA C 250 59.493 62.287 -2.794 1
1 429 . 6 1 1 A 46 46 SER CB C 250 62.071 62.916 -0.845 1
1 430 . 6 1 1 A 46 46 SER N N 250 113.900 115.492 -1.592 1
1 431 . 6 1 1 A 47 47 ILE H H 251 7.106 7.511 -0.405 1
1 432 . 6 1 1 A 47 47 ILE HA H 251 3.994 4.020 -0.026 1
1 441 . 6 1 1 A 47 47 ILE CA C 251 60.337 62.681 -2.344 1
1 442 . 6 1 1 A 47 47 ILE CB C 251 36.727 38.195 -1.468 1
1 446 . 6 1 1 A 47 47 ILE N N 251 115.759 120.417 -4.658 1
1 447 . 6 1 1 A 48 48 ALA H H 252 8.117 7.648 0.469 1
1 448 . 6 1 1 A 48 48 ALA HA H 252 3.979 4.212 -0.233 1
1 452 . 6 1 1 A 48 48 ALA CA C 252 53.821 52.678 1.143 1
1 453 . 6 1 1 A 48 48 ALA CB C 252 17.727 18.773 -1.046 1
1 454 . 6 1 1 A 48 48 ALA N N 252 120.091 123.117 -3.026 1
1 455 . 6 1 1 A 49 49 GLN H H 253 7.346 7.972 -0.626 1
1 456 . 6 1 1 A 49 49 GLN HA H 253 4.324 4.361 -0.037 1
1 463 . 6 1 1 A 49 49 GLN CA C 253 54.552 55.298 -0.746 1
1 464 . 6 1 1 A 49 49 GLN CB C 253 28.255 28.759 -0.504 1
1 466 . 6 1 1 A 49 49 GLN N N 253 112.219 114.474 -2.255 1
1 468 . 6 1 1 A 50 50 LEU H H 254 7.243 7.347 -0.104 1
1 469 . 6 1 1 A 50 50 LEU HA H 254 4.198 4.392 -0.194 1
1 479 . 6 1 1 A 50 50 LEU CA C 254 53.971 54.657 -0.686 1
1 480 . 6 1 1 A 50 50 LEU CB C 254 41.662 42.235 -0.573 1
1 484 . 6 1 1 A 50 50 LEU N N 254 120.510 122.469 -1.959 1
1 485 . 6 1 1 A 51 51 ASP H H 255 8.210 8.461 -0.251 1
1 486 . 6 1 1 A 51 51 ASP HA H 255 4.664 5.071 -0.407 1
1 489 . 6 1 1 A 51 51 ASP CA C 255 52.490 52.043 0.447 1
1 490 . 6 1 1 A 51 51 ASP CB C 255 40.259 41.421 -1.162 1
1 491 . 6 1 1 A 51 51 ASP N N 255 119.691 120.393 -0.702 1
1 492 . 6 1 1 A 52 52 PRO HA H 256 4.125 4.341 -0.216 1
1 499 . 6 1 1 A 52 52 PRO CA C 256 65.380 65.742 -0.362 1
1 500 . 6 1 1 A 52 52 PRO CB C 256 31.865 31.764 0.101 1
1 503 . 6 1 1 A 53 53 GLU H H 257 8.432 8.058 0.374 1
1 504 . 6 1 1 A 53 53 GLU HA H 257 4.073 4.131 -0.058 1
1 508 . 6 1 1 A 53 53 GLU CA C 257 58.677 59.404 -0.727 1
1 509 . 6 1 1 A 53 53 GLU CB C 257 28.771 29.094 -0.323 1
1 511 . 6 1 1 A 53 53 GLU N N 257 119.483 118.136 1.347 1
1 512 . 6 1 1 A 54 54 ALA H H 258 7.967 8.128 -0.161 1
1 513 . 6 1 1 A 54 54 ALA HA H 258 4.240 4.125 0.115 1
1 517 . 6 1 1 A 54 54 ALA CA C 258 54.552 55.227 -0.675 1
1 518 . 6 1 1 A 54 54 ALA CB C 258 18.699 17.927 0.772 1
1 519 . 6 1 1 A 54 54 ALA N N 258 124.293 122.639 1.654 1
1 520 . 6 1 1 A 55 55 LEU H H 259 8.695 7.971 0.724 1
1 521 . 6 1 1 A 55 55 LEU HA H 259 3.902 3.959 -0.057 1
1 530 . 6 1 1 A 55 55 LEU CA C 259 57.130 58.022 -0.892 1
1 531 . 6 1 1 A 55 55 LEU CB C 259 41.192 41.708 -0.516 1
1 535 . 6 1 1 A 55 55 LEU N N 259 118.361 118.965 -0.604 1
1 536 . 6 1 1 A 56 56 GLY H H 260 8.177 8.037 0.140 1
1 537 . 6 1 1 A 56 56 GLY HA2 H 260 3.723 3.743 -0.020 1
1 538 . 6 1 1 A 56 56 GLY HA3 H 260 3.971 3.743 0.228 1
1 539 . 6 1 1 A 56 56 GLY CA C 260 46.302 47.440 -1.138 1
1 540 . 6 1 1 A 56 56 GLY N N 260 105.789 106.568 -0.779 1
1 541 . 6 1 1 A 57 57 ASN H H 261 7.914 7.568 0.346 1
1 542 . 6 1 1 A 57 57 ASN HA H 261 4.643 4.450 0.193 1
1 547 . 6 1 1 A 57 57 ASN CA C 261 54.945 55.440 -0.495 1
1 548 . 6 1 1 A 57 57 ASN CB C 261 37.533 38.153 -0.620 1
1 549 . 6 1 1 A 57 57 ASN N N 261 121.132 120.268 0.864 1
1 551 . 6 1 1 A 58 58 ILE H H 262 8.732 7.807 0.925 1
1 552 . 6 1 1 A 58 58 ILE HA H 262 3.712 3.713 -0.001 1
1 562 . 6 1 1 A 58 58 ILE CA C 262 63.820 64.927 -1.107 1
1 563 . 6 1 1 A 58 58 ILE CB C 262 35.990 37.998 -2.008 1
1 567 . 6 1 1 A 58 58 ILE N N 262 125.309 120.626 4.683 1
1 568 . 6 1 1 A 59 59 LYS H H 263 8.416 8.045 0.371 1
1 569 . 6 1 1 A 59 59 LYS HA H 263 4.075 3.835 0.240 1
1 577 . 6 1 1 A 59 59 LYS CA C 263 59.708 60.472 -0.764 1
1 578 . 6 1 1 A 59 59 LYS CB C 263 31.343 32.367 -1.024 1
1 582 . 6 1 1 A 59 59 LYS N N 263 122.080 118.892 3.188 1
1 583 . 6 1 1 A 60 60 LYS H H 264 7.793 7.926 -0.133 1
1 584 . 6 1 1 A 60 60 LYS HA H 264 4.036 4.059 -0.023 1
1 591 . 6 1 1 A 60 60 LYS CA C 264 59.708 58.854 0.854 1
1 592 . 6 1 1 A 60 60 LYS CB C 264 31.865 31.786 0.079 1
1 596 . 6 1 1 A 60 60 LYS N N 264 119.503 118.555 0.948 1
1 597 . 6 1 1 A 61 61 LEU H H 265 7.797 7.723 0.074 1
1 598 . 6 1 1 A 61 61 LEU HA H 265 4.106 4.055 0.051 1
1 608 . 6 1 1 A 61 61 LEU CA C 265 57.646 58.112 -0.466 1
1 609 . 6 1 1 A 61 61 LEU CB C 265 40.177 41.391 -1.214 1
1 613 . 6 1 1 A 61 61 LEU N N 265 121.392 122.026 -0.634 1
1 614 . 6 1 1 A 62 62 SER H H 266 8.775 8.178 0.597 1
1 615 . 6 1 1 A 62 62 SER HA H 266 4.001 4.192 -0.191 1
1 619 . 6 1 1 A 62 62 SER CA C 266 60.224 61.161 -0.937 1
1 620 . 6 1 1 A 62 62 SER CB C 266 62.758 63.011 -0.253 1
1 621 . 6 1 1 A 62 62 SER N N 266 112.902 114.267 -1.365 1
1 622 . 6 1 1 A 63 63 ASN H H 267 8.199 7.982 0.217 1
1 623 . 6 1 1 A 63 63 ASN HA H 267 4.393 4.386 0.007 1
1 628 . 6 1 1 A 63 63 ASN CA C 267 55.583 56.544 -0.961 1
1 629 . 6 1 1 A 63 63 ASN CB C 267 37.537 38.932 -1.395 1
1 630 . 6 1 1 A 63 63 ASN N N 267 117.813 119.521 -1.708 1
1 632 . 6 1 1 A 64 64 ARG H H 268 8.000 7.973 0.027 1
1 633 . 6 1 1 A 64 64 ARG HA H 268 4.118 4.192 -0.074 1
1 640 . 6 1 1 A 64 64 ARG CA C 268 57.646 58.616 -0.970 1
1 641 . 6 1 1 A 64 64 ARG CB C 268 29.307 30.062 -0.755 1
1 644 . 6 1 1 A 64 64 ARG N N 268 120.911 119.656 1.255 1
1 645 . 6 1 1 A 65 65 LEU H H 269 9.119 7.804 1.315 1
1 646 . 6 1 1 A 65 65 LEU HA H 269 3.916 4.094 -0.178 1
1 656 . 6 1 1 A 65 65 LEU CA C 269 57.124 58.012 -0.888 1
1 657 . 6 1 1 A 65 65 LEU CB C 269 41.662 41.555 0.107 1
1 661 . 6 1 1 A 65 65 LEU N N 269 119.046 121.312 -2.266 1
1 662 . 6 1 1 A 66 66 ALA H H 270 8.245 8.559 -0.314 1
1 663 . 6 1 1 A 66 66 ALA HA H 270 3.997 3.937 0.060 1
1 667 . 6 1 1 A 66 66 ALA CA C 270 54.337 55.107 -0.770 1
1 668 . 6 1 1 A 66 66 ALA CB C 270 16.696 18.093 -1.397 1
1 669 . 6 1 1 A 66 66 ALA N N 270 121.047 121.699 -0.652 1
1 670 . 6 1 1 A 67 67 GLN H H 271 7.704 7.762 -0.058 1
1 671 . 6 1 1 A 67 67 GLN HA H 271 4.025 3.996 0.029 1
1 678 . 6 1 1 A 67 67 GLN CA C 271 58.418 58.863 -0.445 1
1 679 . 6 1 1 A 67 67 GLN CB C 271 27.996 28.325 -0.329 1
1 681 . 6 1 1 A 67 67 GLN N N 271 118.440 117.777 0.663 1
1 683 . 6 1 1 A 68 68 ILE H H 272 8.142 7.887 0.255 1
1 684 . 6 1 1 A 68 68 ILE HA H 272 3.723 3.657 0.066 1
1 694 . 6 1 1 A 68 68 ILE CA C 272 64.605 65.064 -0.459 1
1 695 . 6 1 1 A 68 68 ILE CB C 272 37.793 37.743 0.050 1
1 699 . 6 1 1 A 68 68 ILE N N 272 119.521 119.636 -0.115 1
1 700 . 6 1 1 A 69 69 CYS H H 273 8.817 8.203 0.614 1
1 701 . 6 1 1 A 69 69 CYS HA H 273 3.958 4.328 -0.370 1
1 704 . 6 1 1 A 69 69 CYS CA C 273 64.204 60.476 3.728 1
1 705 . 6 1 1 A 69 69 CYS CB C 273 26.337 26.846 -0.509 1
1 706 . 6 1 1 A 69 69 CYS N N 273 117.234 118.782 -1.548 1
1 707 . 6 1 1 A 70 70 SER H H 274 7.880 7.617 0.263 1
1 708 . 6 1 1 A 70 70 SER HA H 274 4.246 4.346 -0.100 1
1 710 . 6 1 1 A 70 70 SER CA C 274 60.008 60.755 -0.747 1
1 711 . 6 1 1 A 70 70 SER CB C 274 62.071 63.209 -1.138 1
1 712 . 6 1 1 A 70 70 SER N N 274 114.227 116.156 -1.929 1
1 713 . 6 1 1 A 71 71 SER H H 275 7.609 7.604 0.005 1
1 714 . 6 1 1 A 71 71 SER HA H 275 4.564 4.501 0.063 1
1 717 . 6 1 1 A 71 71 SER CA C 275 57.946 58.578 -0.632 1
1 718 . 6 1 1 A 71 71 SER CB C 275 63.618 64.147 -0.529 1
1 719 . 6 1 1 A 71 71 SER N N 275 114.958 111.199 3.759 1
1 720 . 6 1 1 A 72 72 ILE H H 276 7.357 7.399 -0.042 1
1 721 . 6 1 1 A 72 72 ILE HA H 276 4.169 4.026 0.143 1
1 731 . 6 1 1 A 72 72 ILE CA C 276 60.967 61.488 -0.521 1
1 732 . 6 1 1 A 72 72 ILE CB C 276 38.276 38.338 -0.062 1
1 736 . 6 1 1 A 72 72 ILE N N 276 123.513 124.021 -0.508 1
1 737 . 6 1 1 A 73 73 ARG H H 277 8.508 8.445 0.063 1
1 738 . 6 1 1 A 73 73 ARG HA H 277 4.446 5.001 -0.555 1
1 744 . 6 1 1 A 73 73 ARG CA C 277 55.324 54.487 0.837 1
1 745 . 6 1 1 A 73 73 ARG CB C 277 30.499 33.243 -2.744 1
1 748 . 6 1 1 A 73 73 ARG N N 277 126.709 125.586 1.123 1
1 749 . 6 1 1 A 75 75 HIS HA H 279 4.602 4.204 0.398 1
1 754 . 6 1 1 A 75 75 HIS CA C 279 55.840 56.660 -0.820 1
1 755 . 6 1 1 A 75 75 HIS CB C 279 30.426 28.133 2.293 1
1 143 . 7 1 1 A 21 21 LYS H H 225 8.503 8.774 -0.271 1
1 144 . 7 1 1 A 21 21 LYS HA H 225 4.349 3.902 0.447 1
1 152 . 7 1 1 A 21 21 LYS CA C 225 54.872 58.049 -3.177 1
1 153 . 7 1 1 A 21 21 LYS CB C 225 31.667 30.422 1.245 1
1 157 . 7 1 1 A 21 21 LYS N N 225 122.563 118.061 4.502 1
1 158 . 7 1 1 A 22 22 GLU H H 226 7.688 7.871 -0.183 1
1 159 . 7 1 1 A 22 22 GLU HA H 226 4.264 5.006 -0.742 1
1 163 . 7 1 1 A 22 22 GLU CA C 226 55.728 55.077 0.651 1
1 164 . 7 1 1 A 22 22 GLU CB C 226 30.636 33.076 -2.440 1
1 166 . 7 1 1 A 22 22 GLU N N 226 119.810 118.909 0.901 1
1 167 . 7 1 1 A 23 23 ILE H H 227 8.111 8.420 -0.309 1
1 168 . 7 1 1 A 23 23 ILE HA H 227 4.498 4.627 -0.129 1
1 178 . 7 1 1 A 23 23 ILE CA C 227 60.027 60.259 -0.232 1
1 179 . 7 1 1 A 23 23 ILE CB C 227 38.370 39.134 -0.764 1
1 183 . 7 1 1 A 23 23 ILE N N 227 122.085 127.247 -5.162 1
1 184 . 7 1 1 A 24 24 PHE H H 228 7.818 8.390 -0.572 1
1 185 . 7 1 1 A 24 24 PHE HA H 228 5.467 5.167 0.300 1
1 193 . 7 1 1 A 24 24 PHE CA C 228 54.551 55.817 -1.266 1
1 194 . 7 1 1 A 24 24 PHE CB C 228 41.685 41.746 -0.061 1
1 200 . 7 1 1 A 24 24 PHE N N 228 118.840 123.708 -4.868 1
1 201 . 7 1 1 A 25 25 LEU H H 229 9.271 8.987 0.284 1
1 202 . 7 1 1 A 25 25 LEU HA H 229 4.953 5.132 -0.179 1
1 212 . 7 1 1 A 25 25 LEU CA C 229 52.892 53.435 -0.543 1
1 213 . 7 1 1 A 25 25 LEU CB C 229 44.755 44.512 0.243 1
1 217 . 7 1 1 A 25 25 LEU N N 229 123.803 120.886 2.917 1
1 218 . 7 1 1 A 26 26 THR H H 230 8.493 8.995 -0.502 1
1 219 . 7 1 1 A 26 26 THR HA H 230 5.104 4.938 0.166 1
1 224 . 7 1 1 A 26 26 THR CA C 230 61.771 62.265 -0.494 1
1 225 . 7 1 1 A 26 26 THR CB C 230 68.733 69.239 -0.506 1
1 227 . 7 1 1 A 26 26 THR N N 230 121.119 121.730 -0.611 1
1 228 . 7 1 1 A 27 27 VAL H H 231 9.001 8.428 0.573 1
1 229 . 7 1 1 A 27 27 VAL HA H 231 4.600 4.541 0.059 1
1 237 . 7 1 1 A 27 27 VAL CA C 231 56.940 59.413 -2.473 1
1 238 . 7 1 1 A 27 27 VAL CB C 231 33.730 32.620 1.110 1
1 241 . 7 1 1 A 27 27 VAL N N 231 124.749 127.201 -2.452 1
1 242 . 7 1 1 A 28 28 PRO HA H 232 4.661 4.692 -0.031 1
1 249 . 7 1 1 A 28 28 PRO CA C 232 62.233 62.661 -0.428 1
1 250 . 7 1 1 A 28 28 PRO CB C 232 31.667 31.593 0.074 1
1 253 . 7 1 1 A 29 29 VAL H H 233 8.171 8.074 0.097 1
1 254 . 7 1 1 A 29 29 VAL HA H 233 4.565 3.924 0.641 1
1 262 . 7 1 1 A 29 29 VAL CA C 233 60.027 63.737 -3.710 1
1 263 . 7 1 1 A 29 29 VAL CB C 233 32.699 31.311 1.388 1
1 266 . 7 1 1 A 29 29 VAL N N 233 116.136 120.562 -4.426 1
1 267 . 7 1 1 A 30 30 GLY H H 234 8.143 8.642 -0.499 1
1 268 . 7 1 1 A 30 30 GLY HA2 H 234 3.824 3.832 -0.008 1
1 269 . 7 1 1 A 30 30 GLY HA3 H 234 4.209 3.832 0.377 1
1 270 . 7 1 1 A 30 30 GLY CA C 234 44.635 47.292 -2.657 1
1 271 . 7 1 1 A 30 30 GLY N N 234 110.455 114.880 -4.425 1
1 272 . 7 1 1 A 32 32 GLY H H 236 8.305 8.354 -0.049 1
1 273 . 7 1 1 A 32 32 GLY HA2 H 236 3.836 4.165 -0.329 1
1 274 . 7 1 1 A 32 32 GLY HA3 H 236 4.103 4.165 -0.062 1
1 275 . 7 1 1 A 32 32 GLY CA C 236 44.635 46.182 -1.547 1
1 276 . 7 1 1 A 32 32 GLY N N 236 107.539 110.665 -3.126 1
1 277 . 7 1 1 A 33 33 GLU H H 237 7.583 8.106 -0.523 1
1 278 . 7 1 1 A 33 33 GLU HA H 237 4.564 4.604 -0.040 1
1 283 . 7 1 1 A 33 33 GLU CA C 237 54.355 55.475 -1.120 1
1 284 . 7 1 1 A 33 33 GLU CB C 237 30.636 31.352 -0.716 1
1 286 . 7 1 1 A 33 33 GLU N N 237 120.218 121.299 -1.081 1
1 287 . 7 1 1 A 34 34 SER H H 238 8.630 8.761 -0.131 1
1 288 . 7 1 1 A 34 34 SER HA H 238 5.012 5.376 -0.364 1
1 291 . 7 1 1 A 34 34 SER CA C 238 56.915 56.311 0.604 1
1 292 . 7 1 1 A 34 34 SER CB C 238 64.663 66.055 -1.392 1
1 293 . 7 1 1 A 34 34 SER N N 238 116.390 113.333 3.057 1
1 294 . 7 1 1 A 35 35 LEU H H 239 8.838 8.721 0.117 1
1 295 . 7 1 1 A 35 35 LEU HA H 239 4.577 4.814 -0.237 1
1 305 . 7 1 1 A 35 35 LEU CA C 239 52.808 53.699 -0.891 1
1 306 . 7 1 1 A 35 35 LEU CB C 239 44.156 43.709 0.447 1
1 310 . 7 1 1 A 35 35 LEU N N 239 124.463 124.392 0.071 1
1 311 . 7 1 1 A 36 36 ARG H H 240 8.526 8.794 -0.268 1
1 312 . 7 1 1 A 36 36 ARG HA H 240 5.077 4.735 0.342 1
1 318 . 7 1 1 A 36 36 ARG CA C 240 54.483 55.163 -0.680 1
1 319 . 7 1 1 A 36 36 ARG CB C 240 30.777 31.534 -0.757 1
1 322 . 7 1 1 A 36 36 ARG N N 240 124.891 124.727 0.164 1
1 323 . 7 1 1 A 37 37 LEU H H 241 9.179 8.522 0.657 1
1 324 . 7 1 1 A 37 37 LEU HA H 241 4.740 5.044 -0.304 1
1 334 . 7 1 1 A 37 37 LEU CA C 241 52.292 53.650 -1.358 1
1 335 . 7 1 1 A 37 37 LEU CB C 241 43.208 45.748 -2.540 1
1 339 . 7 1 1 A 37 37 LEU N N 241 126.203 128.505 -2.302 1
1 340 . 7 1 1 A 38 38 LEU H H 242 8.825 8.602 0.223 1
1 341 . 7 1 1 A 38 38 LEU HA H 242 4.371 4.674 -0.303 1
1 351 . 7 1 1 A 38 38 LEU CA C 242 54.508 54.646 -0.138 1
1 352 . 7 1 1 A 38 38 LEU CB C 242 41.583 42.102 -0.519 1
1 356 . 7 1 1 A 38 38 LEU N N 242 124.999 127.578 -2.579 1
1 357 . 7 1 1 A 39 39 ALA H H 243 8.634 9.172 -0.538 1
1 358 . 7 1 1 A 39 39 ALA HA H 243 3.799 3.990 -0.191 1
1 362 . 7 1 1 A 39 39 ALA CA C 243 54.852 55.246 -0.394 1
1 363 . 7 1 1 A 39 39 ALA CB C 243 18.243 18.369 -0.126 1
1 364 . 7 1 1 A 39 39 ALA N N 243 125.146 126.021 -0.875 1
1 365 . 7 1 1 A 40 40 SER H H 244 8.414 8.314 0.100 1
1 366 . 7 1 1 A 40 40 SER HA H 244 4.074 4.280 -0.206 1
1 369 . 7 1 1 A 40 40 SER CA C 244 58.977 60.901 -1.924 1
1 370 . 7 1 1 A 40 40 SER CB C 244 61.561 62.799 -1.238 1
1 371 . 7 1 1 A 40 40 SER N N 244 109.494 112.507 -3.013 1
1 372 . 7 1 1 A 41 41 ASP H H 245 7.434 8.019 -0.585 1
1 373 . 7 1 1 A 41 41 ASP HA H 245 4.809 4.892 -0.083 1
1 376 . 7 1 1 A 41 41 ASP CA C 245 52.990 52.923 0.067 1
1 377 . 7 1 1 A 41 41 ASP CB C 245 41.792 41.547 0.245 1
1 378 . 7 1 1 A 41 41 ASP N N 245 120.452 119.280 1.172 1
1 379 . 7 1 1 A 42 42 LEU H H 246 7.338 7.999 -0.661 1
1 380 . 7 1 1 A 42 42 LEU HA H 246 4.098 4.216 -0.118 1
1 389 . 7 1 1 A 42 42 LEU CA C 246 55.068 56.083 -1.015 1
1 390 . 7 1 1 A 42 42 LEU CB C 246 41.861 42.419 -0.558 1
1 393 . 7 1 1 A 42 42 LEU N N 246 121.293 123.287 -1.994 1
1 394 . 7 1 1 A 43 43 GLN H H 247 8.170 8.751 -0.581 1
1 395 . 7 1 1 A 43 43 GLN HA H 247 4.532 4.492 0.040 1
1 401 . 7 1 1 A 43 43 GLN CA C 247 53.005 54.709 -1.704 1
1 402 . 7 1 1 A 43 43 GLN CB C 247 30.978 30.124 0.854 1
1 404 . 7 1 1 A 43 43 GLN N N 247 122.477 125.903 -3.426 1
1 406 . 7 1 1 A 44 44 ARG HA H 248 3.753 3.906 -0.153 1
1 412 . 7 1 1 A 44 44 ARG CA C 248 59.812 59.424 0.388 1
1 413 . 7 1 1 A 44 44 ARG CB C 248 29.306 30.358 -1.052 1
1 416 . 7 1 1 A 45 45 HIS H H 249 8.364 8.355 0.009 1
1 417 . 7 1 1 A 45 45 HIS HA H 249 4.294 4.287 0.007 1
1 422 . 7 1 1 A 45 45 HIS CA C 249 58.462 59.221 -0.759 1
1 423 . 7 1 1 A 45 45 HIS CB C 249 29.071 28.573 0.498 1
1 424 . 7 1 1 A 45 45 HIS N N 249 114.528 117.185 -2.657 1
1 425 . 7 1 1 A 46 46 SER H H 250 7.020 7.598 -0.578 1
1 426 . 7 1 1 A 46 46 SER HA H 250 4.153 4.012 0.141 1
1 428 . 7 1 1 A 46 46 SER CA C 250 59.493 61.064 -1.571 1
1 429 . 7 1 1 A 46 46 SER CB C 250 62.071 63.014 -0.943 1
1 430 . 7 1 1 A 46 46 SER N N 250 113.900 115.049 -1.149 1
1 431 . 7 1 1 A 47 47 ILE H H 251 7.106 7.321 -0.215 1
1 432 . 7 1 1 A 47 47 ILE HA H 251 3.994 4.156 -0.162 1
1 441 . 7 1 1 A 47 47 ILE CA C 251 60.337 62.312 -1.975 1
1 442 . 7 1 1 A 47 47 ILE CB C 251 36.727 38.272 -1.545 1
1 446 . 7 1 1 A 47 47 ILE N N 251 115.759 118.792 -3.033 1
1 447 . 7 1 1 A 48 48 ALA H H 252 8.117 7.571 0.546 1
1 448 . 7 1 1 A 48 48 ALA HA H 252 3.979 4.299 -0.320 1
1 452 . 7 1 1 A 48 48 ALA CA C 252 53.821 52.943 0.878 1
1 453 . 7 1 1 A 48 48 ALA CB C 252 17.727 18.940 -1.213 1
1 454 . 7 1 1 A 48 48 ALA N N 252 120.091 123.211 -3.120 1
1 455 . 7 1 1 A 49 49 GLN H H 253 7.346 8.055 -0.709 1
1 456 . 7 1 1 A 49 49 GLN HA H 253 4.324 4.375 -0.051 1
1 463 . 7 1 1 A 49 49 GLN CA C 253 54.552 55.238 -0.686 1
1 464 . 7 1 1 A 49 49 GLN CB C 253 28.255 28.464 -0.209 1
1 466 . 7 1 1 A 49 49 GLN N N 253 112.219 114.273 -2.054 1
1 468 . 7 1 1 A 50 50 LEU H H 254 7.243 7.413 -0.170 1
1 469 . 7 1 1 A 50 50 LEU HA H 254 4.198 4.509 -0.311 1
1 479 . 7 1 1 A 50 50 LEU CA C 254 53.971 54.362 -0.391 1
1 480 . 7 1 1 A 50 50 LEU CB C 254 41.662 42.545 -0.883 1
1 484 . 7 1 1 A 50 50 LEU N N 254 120.510 122.313 -1.803 1
1 485 . 7 1 1 A 51 51 ASP H H 255 8.210 8.542 -0.332 1
1 486 . 7 1 1 A 51 51 ASP HA H 255 4.664 5.098 -0.434 1
1 489 . 7 1 1 A 51 51 ASP CA C 255 52.490 50.931 1.559 1
1 490 . 7 1 1 A 51 51 ASP CB C 255 40.259 41.500 -1.241 1
1 491 . 7 1 1 A 51 51 ASP N N 255 119.691 119.796 -0.105 1
1 492 . 7 1 1 A 52 52 PRO HA H 256 4.125 4.301 -0.176 1
1 499 . 7 1 1 A 52 52 PRO CA C 256 65.380 65.670 -0.290 1
1 500 . 7 1 1 A 52 52 PRO CB C 256 31.865 31.690 0.175 1
1 503 . 7 1 1 A 53 53 GLU H H 257 8.432 8.421 0.011 1
1 504 . 7 1 1 A 53 53 GLU HA H 257 4.073 4.101 -0.028 1
1 508 . 7 1 1 A 53 53 GLU CA C 257 58.677 59.444 -0.767 1
1 509 . 7 1 1 A 53 53 GLU CB C 257 28.771 29.321 -0.550 1
1 511 . 7 1 1 A 53 53 GLU N N 257 119.483 118.158 1.325 1
1 512 . 7 1 1 A 54 54 ALA H H 258 7.967 7.732 0.235 1
1 513 . 7 1 1 A 54 54 ALA HA H 258 4.240 4.104 0.136 1
1 517 . 7 1 1 A 54 54 ALA CA C 258 54.552 55.239 -0.687 1
1 518 . 7 1 1 A 54 54 ALA CB C 258 18.699 18.393 0.306 1
1 519 . 7 1 1 A 54 54 ALA N N 258 124.293 122.654 1.639 1
1 520 . 7 1 1 A 55 55 LEU H H 259 8.695 8.251 0.444 1
1 521 . 7 1 1 A 55 55 LEU HA H 259 3.902 3.961 -0.059 1
1 530 . 7 1 1 A 55 55 LEU CA C 259 57.130 57.911 -0.781 1
1 531 . 7 1 1 A 55 55 LEU CB C 259 41.192 41.646 -0.454 1
1 535 . 7 1 1 A 55 55 LEU N N 259 118.361 118.668 -0.307 1
1 536 . 7 1 1 A 56 56 GLY H H 260 8.177 7.820 0.357 1
1 537 . 7 1 1 A 56 56 GLY HA2 H 260 3.723 3.756 -0.033 1
1 538 . 7 1 1 A 56 56 GLY HA3 H 260 3.971 3.756 0.215 1
1 539 . 7 1 1 A 56 56 GLY CA C 260 46.302 47.399 -1.097 1
1 540 . 7 1 1 A 56 56 GLY N N 260 105.789 106.643 -0.854 1
1 541 . 7 1 1 A 57 57 ASN H H 261 7.914 7.560 0.354 1
1 542 . 7 1 1 A 57 57 ASN HA H 261 4.643 4.448 0.195 1
1 547 . 7 1 1 A 57 57 ASN CA C 261 54.945 55.430 -0.485 1
1 548 . 7 1 1 A 57 57 ASN CB C 261 37.533 38.169 -0.636 1
1 549 . 7 1 1 A 57 57 ASN N N 261 121.132 120.290 0.842 1
1 551 . 7 1 1 A 58 58 ILE H H 262 8.732 7.795 0.937 1
1 552 . 7 1 1 A 58 58 ILE HA H 262 3.712 3.651 0.061 1
1 562 . 7 1 1 A 58 58 ILE CA C 262 63.820 65.022 -1.202 1
1 563 . 7 1 1 A 58 58 ILE CB C 262 35.990 37.630 -1.640 1
1 567 . 7 1 1 A 58 58 ILE N N 262 125.309 120.676 4.633 1
1 568 . 7 1 1 A 59 59 LYS H H 263 8.416 8.230 0.186 1
1 569 . 7 1 1 A 59 59 LYS HA H 263 4.075 3.854 0.221 1
1 577 . 7 1 1 A 59 59 LYS CA C 263 59.708 60.539 -0.831 1
1 578 . 7 1 1 A 59 59 LYS CB C 263 31.343 32.337 -0.994 1
1 582 . 7 1 1 A 59 59 LYS N N 263 122.080 118.879 3.201 1
1 583 . 7 1 1 A 60 60 LYS H H 264 7.793 7.905 -0.112 1
1 584 . 7 1 1 A 60 60 LYS HA H 264 4.036 4.079 -0.043 1
1 591 . 7 1 1 A 60 60 LYS CA C 264 59.708 58.946 0.762 1
1 592 . 7 1 1 A 60 60 LYS CB C 264 31.865 31.651 0.214 1
1 596 . 7 1 1 A 60 60 LYS N N 264 119.503 118.585 0.918 1
1 597 . 7 1 1 A 61 61 LEU H H 265 7.797 7.853 -0.056 1
1 598 . 7 1 1 A 61 61 LEU HA H 265 4.106 4.043 0.063 1
1 608 . 7 1 1 A 61 61 LEU CA C 265 57.646 58.173 -0.527 1
1 609 . 7 1 1 A 61 61 LEU CB C 265 40.177 41.417 -1.240 1
1 613 . 7 1 1 A 61 61 LEU N N 265 121.392 121.756 -0.364 1
1 614 . 7 1 1 A 62 62 SER H H 266 8.775 8.081 0.694 1
1 615 . 7 1 1 A 62 62 SER HA H 266 4.001 4.287 -0.286 1
1 619 . 7 1 1 A 62 62 SER CA C 266 60.224 61.305 -1.081 1
1 620 . 7 1 1 A 62 62 SER CB C 266 62.758 63.170 -0.412 1
1 621 . 7 1 1 A 62 62 SER N N 266 112.902 116.692 -3.790 1
1 622 . 7 1 1 A 63 63 ASN H H 267 8.199 8.041 0.158 1
1 623 . 7 1 1 A 63 63 ASN HA H 267 4.393 4.391 0.002 1
1 628 . 7 1 1 A 63 63 ASN CA C 267 55.583 56.582 -0.999 1
1 629 . 7 1 1 A 63 63 ASN CB C 267 37.537 39.228 -1.691 1
1 630 . 7 1 1 A 63 63 ASN N N 267 117.813 120.051 -2.238 1
1 632 . 7 1 1 A 64 64 ARG H H 268 8.000 7.972 0.028 1
1 633 . 7 1 1 A 64 64 ARG HA H 268 4.118 4.188 -0.070 1
1 640 . 7 1 1 A 64 64 ARG CA C 268 57.646 58.458 -0.812 1
1 641 . 7 1 1 A 64 64 ARG CB C 268 29.307 30.010 -0.703 1
1 644 . 7 1 1 A 64 64 ARG N N 268 120.911 119.727 1.184 1
1 645 . 7 1 1 A 65 65 LEU H H 269 9.119 7.726 1.393 1
1 646 . 7 1 1 A 65 65 LEU HA H 269 3.916 4.074 -0.158 1
1 656 . 7 1 1 A 65 65 LEU CA C 269 57.124 58.041 -0.917 1
1 657 . 7 1 1 A 65 65 LEU CB C 269 41.662 41.329 0.333 1
1 661 . 7 1 1 A 65 65 LEU N N 269 119.046 121.061 -2.015 1
1 662 . 7 1 1 A 66 66 ALA H H 270 8.245 8.547 -0.302 1
1 663 . 7 1 1 A 66 66 ALA HA H 270 3.997 3.974 0.023 1
1 667 . 7 1 1 A 66 66 ALA CA C 270 54.337 55.203 -0.866 1
1 668 . 7 1 1 A 66 66 ALA CB C 270 16.696 18.146 -1.450 1
1 669 . 7 1 1 A 66 66 ALA N N 270 121.047 121.481 -0.434 1
1 670 . 7 1 1 A 67 67 GLN H H 271 7.704 7.849 -0.145 1
1 671 . 7 1 1 A 67 67 GLN HA H 271 4.025 3.977 0.048 1
1 678 . 7 1 1 A 67 67 GLN CA C 271 58.418 59.153 -0.735 1
1 679 . 7 1 1 A 67 67 GLN CB C 271 27.996 28.537 -0.541 1
1 681 . 7 1 1 A 67 67 GLN N N 271 118.440 117.822 0.618 1
1 683 . 7 1 1 A 68 68 ILE H H 272 8.142 7.954 0.188 1
1 684 . 7 1 1 A 68 68 ILE HA H 272 3.723 3.703 0.020 1
1 694 . 7 1 1 A 68 68 ILE CA C 272 64.605 64.961 -0.356 1
1 695 . 7 1 1 A 68 68 ILE CB C 272 37.793 37.713 0.080 1
1 699 . 7 1 1 A 68 68 ILE N N 272 119.521 119.407 0.114 1
1 700 . 7 1 1 A 69 69 CYS H H 273 8.817 8.192 0.625 1
1 701 . 7 1 1 A 69 69 CYS HA H 273 3.958 4.368 -0.410 1
1 704 . 7 1 1 A 69 69 CYS CA C 273 64.204 60.795 3.409 1
1 705 . 7 1 1 A 69 69 CYS CB C 273 26.337 27.168 -0.831 1
1 706 . 7 1 1 A 69 69 CYS N N 273 117.234 120.841 -3.607 1
1 707 . 7 1 1 A 70 70 SER H H 274 7.880 7.691 0.189 1
1 708 . 7 1 1 A 70 70 SER HA H 274 4.246 4.350 -0.104 1
1 710 . 7 1 1 A 70 70 SER CA C 274 60.008 60.796 -0.788 1
1 711 . 7 1 1 A 70 70 SER CB C 274 62.071 63.221 -1.150 1
1 712 . 7 1 1 A 70 70 SER N N 274 114.227 114.933 -0.706 1
1 713 . 7 1 1 A 71 71 SER H H 275 7.609 7.726 -0.117 1
1 714 . 7 1 1 A 71 71 SER HA H 275 4.564 4.497 0.067 1
1 717 . 7 1 1 A 71 71 SER CA C 275 57.946 58.400 -0.454 1
1 718 . 7 1 1 A 71 71 SER CB C 275 63.618 63.567 0.051 1
1 719 . 7 1 1 A 71 71 SER N N 275 114.958 114.221 0.737 1
1 720 . 7 1 1 A 72 72 ILE H H 276 7.357 7.605 -0.248 1
1 721 . 7 1 1 A 72 72 ILE HA H 276 4.169 4.200 -0.031 1
1 731 . 7 1 1 A 72 72 ILE CA C 276 60.967 60.373 0.594 1
1 732 . 7 1 1 A 72 72 ILE CB C 276 38.276 39.017 -0.741 1
1 736 . 7 1 1 A 72 72 ILE N N 276 123.513 123.141 0.372 1
1 737 . 7 1 1 A 73 73 ARG H H 277 8.508 8.545 -0.037 1
1 738 . 7 1 1 A 73 73 ARG HA H 277 4.446 5.101 -0.655 1
1 744 . 7 1 1 A 73 73 ARG CA C 277 55.324 54.584 0.740 1
1 745 . 7 1 1 A 73 73 ARG CB C 277 30.499 32.393 -1.894 1
1 748 . 7 1 1 A 73 73 ARG N N 277 126.709 125.062 1.647 1
1 749 . 7 1 1 A 75 75 HIS HA H 279 4.602 5.025 -0.423 1
1 754 . 7 1 1 A 75 75 HIS CA C 279 55.840 54.714 1.126 1
1 755 . 7 1 1 A 75 75 HIS CB C 279 30.426 31.264 -0.838 1
1 143 . 8 1 1 A 21 21 LYS H H 225 8.503 8.657 -0.154 1
1 144 . 8 1 1 A 21 21 LYS HA H 225 4.349 4.674 -0.325 1
1 152 . 8 1 1 A 21 21 LYS CA C 225 54.872 55.955 -1.083 1
1 153 . 8 1 1 A 21 21 LYS CB C 225 31.667 34.238 -2.571 1
1 157 . 8 1 1 A 21 21 LYS N N 225 122.563 124.905 -2.342 1
1 158 . 8 1 1 A 22 22 GLU H H 226 7.688 7.778 -0.090 1
1 159 . 8 1 1 A 22 22 GLU HA H 226 4.264 4.929 -0.665 1
1 163 . 8 1 1 A 22 22 GLU CA C 226 55.728 55.801 -0.073 1
1 164 . 8 1 1 A 22 22 GLU CB C 226 30.636 31.900 -1.264 1
1 166 . 8 1 1 A 22 22 GLU N N 226 119.810 121.272 -1.462 1
1 167 . 8 1 1 A 23 23 ILE H H 227 8.111 8.414 -0.303 1
1 168 . 8 1 1 A 23 23 ILE HA H 227 4.498 4.549 -0.051 1
1 178 . 8 1 1 A 23 23 ILE CA C 227 60.027 60.348 -0.321 1
1 179 . 8 1 1 A 23 23 ILE CB C 227 38.370 39.353 -0.983 1
1 183 . 8 1 1 A 23 23 ILE N N 227 122.085 125.701 -3.616 1
1 184 . 8 1 1 A 24 24 PHE H H 228 7.818 8.330 -0.512 1
1 185 . 8 1 1 A 24 24 PHE HA H 228 5.467 5.215 0.252 1
1 193 . 8 1 1 A 24 24 PHE CA C 228 54.551 55.922 -1.371 1
1 194 . 8 1 1 A 24 24 PHE CB C 228 41.685 41.290 0.395 1
1 200 . 8 1 1 A 24 24 PHE N N 228 118.840 123.215 -4.375 1
1 201 . 8 1 1 A 25 25 LEU H H 229 9.271 8.847 0.424 1
1 202 . 8 1 1 A 25 25 LEU HA H 229 4.953 5.222 -0.269 1
1 212 . 8 1 1 A 25 25 LEU CA C 229 52.892 53.647 -0.755 1
1 213 . 8 1 1 A 25 25 LEU CB C 229 44.755 44.801 -0.046 1
1 217 . 8 1 1 A 25 25 LEU N N 229 123.803 120.484 3.319 1
1 218 . 8 1 1 A 26 26 THR H H 230 8.493 8.926 -0.433 1
1 219 . 8 1 1 A 26 26 THR HA H 230 5.104 4.912 0.192 1
1 224 . 8 1 1 A 26 26 THR CA C 230 61.771 62.171 -0.400 1
1 225 . 8 1 1 A 26 26 THR CB C 230 68.733 69.471 -0.738 1
1 227 . 8 1 1 A 26 26 THR N N 230 121.119 120.632 0.487 1
1 228 . 8 1 1 A 27 27 VAL H H 231 9.001 8.975 0.026 1
1 229 . 8 1 1 A 27 27 VAL HA H 231 4.600 4.554 0.046 1
1 237 . 8 1 1 A 27 27 VAL CA C 231 56.940 59.335 -2.395 1
1 238 . 8 1 1 A 27 27 VAL CB C 231 33.730 32.781 0.949 1
1 241 . 8 1 1 A 27 27 VAL N N 231 124.749 127.083 -2.334 1
1 242 . 8 1 1 A 28 28 PRO HA H 232 4.661 4.941 -0.280 1
1 249 . 8 1 1 A 28 28 PRO CA C 232 62.233 62.366 -0.133 1
1 250 . 8 1 1 A 28 28 PRO CB C 232 31.667 31.658 0.009 1
1 253 . 8 1 1 A 29 29 VAL H H 233 8.171 8.078 0.093 1
1 254 . 8 1 1 A 29 29 VAL HA H 233 4.565 3.907 0.658 1
1 262 . 8 1 1 A 29 29 VAL CA C 233 60.027 63.811 -3.784 1
1 263 . 8 1 1 A 29 29 VAL CB C 233 32.699 31.299 1.400 1
1 266 . 8 1 1 A 29 29 VAL N N 233 116.136 121.322 -5.186 1
1 267 . 8 1 1 A 30 30 GLY H H 234 8.143 8.703 -0.560 1
1 268 . 8 1 1 A 30 30 GLY HA2 H 234 3.824 3.832 -0.008 1
1 269 . 8 1 1 A 30 30 GLY HA3 H 234 4.209 3.832 0.377 1
1 270 . 8 1 1 A 30 30 GLY CA C 234 44.635 47.278 -2.643 1
1 271 . 8 1 1 A 30 30 GLY N N 234 110.455 114.881 -4.426 1
1 272 . 8 1 1 A 32 32 GLY H H 236 8.305 8.278 0.027 1
1 273 . 8 1 1 A 32 32 GLY HA2 H 236 3.836 4.193 -0.357 1
1 274 . 8 1 1 A 32 32 GLY HA3 H 236 4.103 4.193 -0.090 1
1 275 . 8 1 1 A 32 32 GLY CA C 236 44.635 46.297 -1.662 1
1 276 . 8 1 1 A 32 32 GLY N N 236 107.539 109.162 -1.623 1
1 277 . 8 1 1 A 33 33 GLU H H 237 7.583 8.241 -0.658 1
1 278 . 8 1 1 A 33 33 GLU HA H 237 4.564 4.434 0.130 1
1 283 . 8 1 1 A 33 33 GLU CA C 237 54.355 55.695 -1.340 1
1 284 . 8 1 1 A 33 33 GLU CB C 237 30.636 30.634 0.002 1
1 286 . 8 1 1 A 33 33 GLU N N 237 120.218 121.270 -1.052 1
1 287 . 8 1 1 A 34 34 SER H H 238 8.630 8.571 0.059 1
1 288 . 8 1 1 A 34 34 SER HA H 238 5.012 5.575 -0.563 1
1 291 . 8 1 1 A 34 34 SER CA C 238 56.915 56.135 0.780 1
1 292 . 8 1 1 A 34 34 SER CB C 238 64.663 65.904 -1.241 1
1 293 . 8 1 1 A 34 34 SER N N 238 116.390 113.619 2.771 1
1 294 . 8 1 1 A 35 35 LEU H H 239 8.838 8.647 0.191 1
1 295 . 8 1 1 A 35 35 LEU HA H 239 4.577 4.815 -0.238 1
1 305 . 8 1 1 A 35 35 LEU CA C 239 52.808 53.538 -0.730 1
1 306 . 8 1 1 A 35 35 LEU CB C 239 44.156 43.862 0.294 1
1 310 . 8 1 1 A 35 35 LEU N N 239 124.463 125.166 -0.703 1
1 311 . 8 1 1 A 36 36 ARG H H 240 8.526 8.822 -0.296 1
1 312 . 8 1 1 A 36 36 ARG HA H 240 5.077 4.779 0.298 1
1 318 . 8 1 1 A 36 36 ARG CA C 240 54.483 54.852 -0.369 1
1 319 . 8 1 1 A 36 36 ARG CB C 240 30.777 31.627 -0.850 1
1 322 . 8 1 1 A 36 36 ARG N N 240 124.891 124.399 0.492 1
1 323 . 8 1 1 A 37 37 LEU H H 241 9.179 8.572 0.607 1
1 324 . 8 1 1 A 37 37 LEU HA H 241 4.740 5.077 -0.337 1
1 334 . 8 1 1 A 37 37 LEU CA C 241 52.292 53.560 -1.268 1
1 335 . 8 1 1 A 37 37 LEU CB C 241 43.208 45.886 -2.678 1
1 339 . 8 1 1 A 37 37 LEU N N 241 126.203 128.812 -2.609 1
1 340 . 8 1 1 A 38 38 LEU H H 242 8.825 8.585 0.240 1
1 341 . 8 1 1 A 38 38 LEU HA H 242 4.371 4.742 -0.371 1
1 351 . 8 1 1 A 38 38 LEU CA C 242 54.508 54.318 0.190 1
1 352 . 8 1 1 A 38 38 LEU CB C 242 41.583 42.286 -0.703 1
1 356 . 8 1 1 A 38 38 LEU N N 242 124.999 127.258 -2.259 1
1 357 . 8 1 1 A 39 39 ALA H H 243 8.634 9.270 -0.636 1
1 358 . 8 1 1 A 39 39 ALA HA H 243 3.799 4.011 -0.212 1
1 362 . 8 1 1 A 39 39 ALA CA C 243 54.852 55.182 -0.330 1
1 363 . 8 1 1 A 39 39 ALA CB C 243 18.243 18.321 -0.078 1
1 364 . 8 1 1 A 39 39 ALA N N 243 125.146 125.750 -0.604 1
1 365 . 8 1 1 A 40 40 SER H H 244 8.414 8.286 0.128 1
1 366 . 8 1 1 A 40 40 SER HA H 244 4.074 4.271 -0.197 1
1 369 . 8 1 1 A 40 40 SER CA C 244 58.977 60.884 -1.907 1
1 370 . 8 1 1 A 40 40 SER CB C 244 61.561 62.759 -1.198 1
1 371 . 8 1 1 A 40 40 SER N N 244 109.494 112.358 -2.864 1
1 372 . 8 1 1 A 41 41 ASP H H 245 7.434 7.768 -0.334 1
1 373 . 8 1 1 A 41 41 ASP HA H 245 4.809 4.892 -0.083 1
1 376 . 8 1 1 A 41 41 ASP CA C 245 52.990 53.019 -0.029 1
1 377 . 8 1 1 A 41 41 ASP CB C 245 41.792 41.664 0.128 1
1 378 . 8 1 1 A 41 41 ASP N N 245 120.452 119.236 1.216 1
1 379 . 8 1 1 A 42 42 LEU H H 246 7.338 8.217 -0.879 1
1 380 . 8 1 1 A 42 42 LEU HA H 246 4.098 4.376 -0.278 1
1 389 . 8 1 1 A 42 42 LEU CA C 246 55.068 55.388 -0.320 1
1 390 . 8 1 1 A 42 42 LEU CB C 246 41.861 42.221 -0.360 1
1 393 . 8 1 1 A 42 42 LEU N N 246 121.293 122.814 -1.521 1
1 394 . 8 1 1 A 43 43 GLN H H 247 8.170 8.619 -0.449 1
1 395 . 8 1 1 A 43 43 GLN HA H 247 4.532 4.165 0.367 1
1 401 . 8 1 1 A 43 43 GLN CA C 247 53.005 55.829 -2.824 1
1 402 . 8 1 1 A 43 43 GLN CB C 247 30.978 28.566 2.412 1
1 404 . 8 1 1 A 43 43 GLN N N 247 122.477 127.141 -4.664 1
1 406 . 8 1 1 A 44 44 ARG HA H 248 3.753 3.961 -0.208 1
1 412 . 8 1 1 A 44 44 ARG CA C 248 59.812 58.951 0.861 1
1 413 . 8 1 1 A 44 44 ARG CB C 248 29.306 29.934 -0.628 1
1 416 . 8 1 1 A 45 45 HIS H H 249 8.364 8.131 0.233 1
1 417 . 8 1 1 A 45 45 HIS HA H 249 4.294 4.291 0.003 1
1 422 . 8 1 1 A 45 45 HIS CA C 249 58.462 59.191 -0.729 1
1 423 . 8 1 1 A 45 45 HIS CB C 249 29.071 28.387 0.684 1
1 424 . 8 1 1 A 45 45 HIS N N 249 114.528 117.105 -2.577 1
1 425 . 8 1 1 A 46 46 SER H H 250 7.020 7.647 -0.627 1
1 426 . 8 1 1 A 46 46 SER HA H 250 4.153 4.330 -0.177 1
1 428 . 8 1 1 A 46 46 SER CA C 250 59.493 62.268 -2.775 1
1 429 . 8 1 1 A 46 46 SER CB C 250 62.071 62.848 -0.777 1
1 430 . 8 1 1 A 46 46 SER N N 250 113.900 115.580 -1.680 1
1 431 . 8 1 1 A 47 47 ILE H H 251 7.106 7.373 -0.267 1
1 432 . 8 1 1 A 47 47 ILE HA H 251 3.994 4.036 -0.042 1
1 441 . 8 1 1 A 47 47 ILE CA C 251 60.337 62.742 -2.405 1
1 442 . 8 1 1 A 47 47 ILE CB C 251 36.727 38.407 -1.680 1
1 446 . 8 1 1 A 47 47 ILE N N 251 115.759 120.632 -4.873 1
1 447 . 8 1 1 A 48 48 ALA H H 252 8.117 7.636 0.481 1
1 448 . 8 1 1 A 48 48 ALA HA H 252 3.979 4.259 -0.280 1
1 452 . 8 1 1 A 48 48 ALA CA C 252 53.821 52.935 0.886 1
1 453 . 8 1 1 A 48 48 ALA CB C 252 17.727 18.544 -0.817 1
1 454 . 8 1 1 A 48 48 ALA N N 252 120.091 123.139 -3.048 1
1 455 . 8 1 1 A 49 49 GLN H H 253 7.346 7.988 -0.642 1
1 456 . 8 1 1 A 49 49 GLN HA H 253 4.324 4.360 -0.036 1
1 463 . 8 1 1 A 49 49 GLN CA C 253 54.552 55.207 -0.655 1
1 464 . 8 1 1 A 49 49 GLN CB C 253 28.255 28.532 -0.277 1
1 466 . 8 1 1 A 49 49 GLN N N 253 112.219 114.576 -2.357 1
1 468 . 8 1 1 A 50 50 LEU H H 254 7.243 7.004 0.239 1
1 469 . 8 1 1 A 50 50 LEU HA H 254 4.198 4.429 -0.231 1
1 479 . 8 1 1 A 50 50 LEU CA C 254 53.971 54.551 -0.580 1
1 480 . 8 1 1 A 50 50 LEU CB C 254 41.662 42.343 -0.681 1
1 484 . 8 1 1 A 50 50 LEU N N 254 120.510 122.503 -1.993 1
1 485 . 8 1 1 A 51 51 ASP H H 255 8.210 8.654 -0.444 1
1 486 . 8 1 1 A 51 51 ASP HA H 255 4.664 5.091 -0.427 1
1 489 . 8 1 1 A 51 51 ASP CA C 255 52.490 51.385 1.105 1
1 490 . 8 1 1 A 51 51 ASP CB C 255 40.259 41.271 -1.012 1
1 491 . 8 1 1 A 51 51 ASP N N 255 119.691 119.535 0.156 1
1 492 . 8 1 1 A 52 52 PRO HA H 256 4.125 4.330 -0.205 1
1 499 . 8 1 1 A 52 52 PRO CA C 256 65.380 65.663 -0.283 1
1 500 . 8 1 1 A 52 52 PRO CB C 256 31.865 31.741 0.124 1
1 503 . 8 1 1 A 53 53 GLU H H 257 8.432 8.500 -0.068 1
1 504 . 8 1 1 A 53 53 GLU HA H 257 4.073 4.101 -0.028 1
1 508 . 8 1 1 A 53 53 GLU CA C 257 58.677 59.454 -0.777 1
1 509 . 8 1 1 A 53 53 GLU CB C 257 28.771 29.321 -0.550 1
1 511 . 8 1 1 A 53 53 GLU N N 257 119.483 118.310 1.173 1
1 512 . 8 1 1 A 54 54 ALA H H 258 7.967 7.644 0.323 1
1 513 . 8 1 1 A 54 54 ALA HA H 258 4.240 3.948 0.292 1
1 517 . 8 1 1 A 54 54 ALA CA C 258 54.552 55.220 -0.668 1
1 518 . 8 1 1 A 54 54 ALA CB C 258 18.699 18.649 0.050 1
1 519 . 8 1 1 A 54 54 ALA N N 258 124.293 122.425 1.868 1
1 520 . 8 1 1 A 55 55 LEU H H 259 8.695 8.509 0.186 1
1 521 . 8 1 1 A 55 55 LEU HA H 259 3.902 3.945 -0.043 1
1 530 . 8 1 1 A 55 55 LEU CA C 259 57.130 58.020 -0.890 1
1 531 . 8 1 1 A 55 55 LEU CB C 259 41.192 41.702 -0.510 1
1 535 . 8 1 1 A 55 55 LEU N N 259 118.361 118.625 -0.264 1
1 536 . 8 1 1 A 56 56 GLY H H 260 8.177 7.910 0.267 1
1 537 . 8 1 1 A 56 56 GLY HA2 H 260 3.723 3.725 -0.002 1
1 538 . 8 1 1 A 56 56 GLY HA3 H 260 3.971 3.725 0.246 1
1 539 . 8 1 1 A 56 56 GLY CA C 260 46.302 47.398 -1.096 1
1 540 . 8 1 1 A 56 56 GLY N N 260 105.789 106.613 -0.824 1
1 541 . 8 1 1 A 57 57 ASN H H 261 7.914 7.626 0.288 1
1 542 . 8 1 1 A 57 57 ASN HA H 261 4.643 4.430 0.213 1
1 547 . 8 1 1 A 57 57 ASN CA C 261 54.945 55.697 -0.752 1
1 548 . 8 1 1 A 57 57 ASN CB C 261 37.533 38.389 -0.856 1
1 549 . 8 1 1 A 57 57 ASN N N 261 121.132 119.991 1.141 1
1 551 . 8 1 1 A 58 58 ILE H H 262 8.732 8.038 0.694 1
1 552 . 8 1 1 A 58 58 ILE HA H 262 3.712 3.674 0.038 1
1 562 . 8 1 1 A 58 58 ILE CA C 262 63.820 64.934 -1.114 1
1 563 . 8 1 1 A 58 58 ILE CB C 262 35.990 38.162 -2.172 1
1 567 . 8 1 1 A 58 58 ILE N N 262 125.309 120.799 4.510 1
1 568 . 8 1 1 A 59 59 LYS H H 263 8.416 7.936 0.480 1
1 569 . 8 1 1 A 59 59 LYS HA H 263 4.075 3.866 0.209 1
1 577 . 8 1 1 A 59 59 LYS CA C 263 59.708 60.478 -0.770 1
1 578 . 8 1 1 A 59 59 LYS CB C 263 31.343 32.336 -0.993 1
1 582 . 8 1 1 A 59 59 LYS N N 263 122.080 118.792 3.288 1
1 583 . 8 1 1 A 60 60 LYS H H 264 7.793 7.338 0.455 1
1 584 . 8 1 1 A 60 60 LYS HA H 264 4.036 4.002 0.034 1
1 591 . 8 1 1 A 60 60 LYS CA C 264 59.708 59.426 0.282 1
1 592 . 8 1 1 A 60 60 LYS CB C 264 31.865 32.140 -0.275 1
1 596 . 8 1 1 A 60 60 LYS N N 264 119.503 119.782 -0.279 1
1 597 . 8 1 1 A 61 61 LEU H H 265 7.797 8.044 -0.247 1
1 598 . 8 1 1 A 61 61 LEU HA H 265 4.106 4.022 0.084 1
1 608 . 8 1 1 A 61 61 LEU CA C 265 57.646 58.235 -0.589 1
1 609 . 8 1 1 A 61 61 LEU CB C 265 40.177 41.778 -1.601 1
1 613 . 8 1 1 A 61 61 LEU N N 265 121.392 122.305 -0.913 1
1 614 . 8 1 1 A 62 62 SER H H 266 8.775 8.056 0.719 1
1 615 . 8 1 1 A 62 62 SER HA H 266 4.001 4.153 -0.152 1
1 619 . 8 1 1 A 62 62 SER CA C 266 60.224 61.445 -1.221 1
1 620 . 8 1 1 A 62 62 SER CB C 266 62.758 62.976 -0.218 1
1 621 . 8 1 1 A 62 62 SER N N 266 112.902 114.418 -1.516 1
1 622 . 8 1 1 A 63 63 ASN H H 267 8.199 8.228 -0.029 1
1 623 . 8 1 1 A 63 63 ASN HA H 267 4.393 4.391 0.002 1
1 628 . 8 1 1 A 63 63 ASN CA C 267 55.583 56.711 -1.128 1
1 629 . 8 1 1 A 63 63 ASN CB C 267 37.537 37.995 -0.458 1
1 630 . 8 1 1 A 63 63 ASN N N 267 117.813 120.252 -2.439 1
1 632 . 8 1 1 A 64 64 ARG H H 268 8.000 7.687 0.313 1
1 633 . 8 1 1 A 64 64 ARG HA H 268 4.118 4.167 -0.049 1
1 640 . 8 1 1 A 64 64 ARG CA C 268 57.646 58.637 -0.991 1
1 641 . 8 1 1 A 64 64 ARG CB C 268 29.307 30.092 -0.785 1
1 644 . 8 1 1 A 64 64 ARG N N 268 120.911 120.777 0.134 1
1 645 . 8 1 1 A 65 65 LEU H H 269 9.119 7.963 1.156 1
1 646 . 8 1 1 A 65 65 LEU HA H 269 3.916 4.085 -0.169 1
1 656 . 8 1 1 A 65 65 LEU CA C 269 57.124 58.024 -0.900 1
1 657 . 8 1 1 A 65 65 LEU CB C 269 41.662 41.398 0.264 1
1 661 . 8 1 1 A 65 65 LEU N N 269 119.046 121.190 -2.144 1
1 662 . 8 1 1 A 66 66 ALA H H 270 8.245 8.672 -0.427 1
1 663 . 8 1 1 A 66 66 ALA HA H 270 3.997 3.934 0.063 1
1 667 . 8 1 1 A 66 66 ALA CA C 270 54.337 55.044 -0.707 1
1 668 . 8 1 1 A 66 66 ALA CB C 270 16.696 18.251 -1.555 1
1 669 . 8 1 1 A 66 66 ALA N N 270 121.047 121.191 -0.144 1
1 670 . 8 1 1 A 67 67 GLN H H 271 7.704 7.704 0.000 1
1 671 . 8 1 1 A 67 67 GLN HA H 271 4.025 3.970 0.055 1
1 678 . 8 1 1 A 67 67 GLN CA C 271 58.418 59.123 -0.705 1
1 679 . 8 1 1 A 67 67 GLN CB C 271 27.996 28.285 -0.289 1
1 681 . 8 1 1 A 67 67 GLN N N 271 118.440 117.726 0.714 1
1 683 . 8 1 1 A 68 68 ILE H H 272 8.142 7.769 0.373 1
1 684 . 8 1 1 A 68 68 ILE HA H 272 3.723 3.688 0.035 1
1 694 . 8 1 1 A 68 68 ILE CA C 272 64.605 65.528 -0.923 1
1 695 . 8 1 1 A 68 68 ILE CB C 272 37.793 37.865 -0.072 1
1 699 . 8 1 1 A 68 68 ILE N N 272 119.521 119.496 0.025 1
1 700 . 8 1 1 A 69 69 CYS H H 273 8.817 7.923 0.894 1
1 701 . 8 1 1 A 69 69 CYS HA H 273 3.958 4.271 -0.313 1
1 704 . 8 1 1 A 69 69 CYS CA C 273 64.204 61.253 2.951 1
1 705 . 8 1 1 A 69 69 CYS CB C 273 26.337 26.495 -0.158 1
1 706 . 8 1 1 A 69 69 CYS N N 273 117.234 118.831 -1.597 1
1 707 . 8 1 1 A 70 70 SER H H 274 7.880 7.706 0.174 1
1 708 . 8 1 1 A 70 70 SER HA H 274 4.246 4.326 -0.080 1
1 710 . 8 1 1 A 70 70 SER CA C 274 60.008 61.397 -1.389 1
1 711 . 8 1 1 A 70 70 SER CB C 274 62.071 63.163 -1.092 1
1 712 . 8 1 1 A 70 70 SER N N 274 114.227 116.343 -2.116 1
1 713 . 8 1 1 A 71 71 SER H H 275 7.609 7.696 -0.087 1
1 714 . 8 1 1 A 71 71 SER HA H 275 4.564 4.470 0.094 1
1 717 . 8 1 1 A 71 71 SER CA C 275 57.946 58.402 -0.456 1
1 718 . 8 1 1 A 71 71 SER CB C 275 63.618 63.723 -0.105 1
1 719 . 8 1 1 A 71 71 SER N N 275 114.958 114.100 0.858 1
1 720 . 8 1 1 A 72 72 ILE H H 276 7.357 7.596 -0.239 1
1 721 . 8 1 1 A 72 72 ILE HA H 276 4.169 4.598 -0.429 1
1 731 . 8 1 1 A 72 72 ILE CA C 276 60.967 59.567 1.400 1
1 732 . 8 1 1 A 72 72 ILE CB C 276 38.276 41.058 -2.782 1
1 736 . 8 1 1 A 72 72 ILE N N 276 123.513 121.965 1.548 1
1 737 . 8 1 1 A 73 73 ARG H H 277 8.508 8.681 -0.173 1
1 738 . 8 1 1 A 73 73 ARG HA H 277 4.446 4.732 -0.286 1
1 744 . 8 1 1 A 73 73 ARG CA C 277 55.324 53.979 1.345 1
1 745 . 8 1 1 A 73 73 ARG CB C 277 30.499 32.905 -2.406 1
1 748 . 8 1 1 A 73 73 ARG N N 277 126.709 124.892 1.817 1
1 749 . 8 1 1 A 75 75 HIS HA H 279 4.602 4.609 -0.007 1
1 754 . 8 1 1 A 75 75 HIS CA C 279 55.840 56.349 -0.509 1
1 755 . 8 1 1 A 75 75 HIS CB C 279 30.426 30.741 -0.315 1
1 143 . 9 1 1 A 21 21 LYS H H 225 8.503 8.729 -0.226 1
1 144 . 9 1 1 A 21 21 LYS HA H 225 4.349 4.406 -0.057 1
1 152 . 9 1 1 A 21 21 LYS CA C 225 54.872 56.840 -1.968 1
1 153 . 9 1 1 A 21 21 LYS CB C 225 31.667 32.936 -1.269 1
1 157 . 9 1 1 A 21 21 LYS N N 225 122.563 128.413 -5.850 1
1 158 . 9 1 1 A 22 22 GLU H H 226 7.688 7.818 -0.130 1
1 159 . 9 1 1 A 22 22 GLU HA H 226 4.264 4.955 -0.691 1
1 163 . 9 1 1 A 22 22 GLU CA C 226 55.728 55.492 0.236 1
1 164 . 9 1 1 A 22 22 GLU CB C 226 30.636 32.027 -1.391 1
1 166 . 9 1 1 A 22 22 GLU N N 226 119.810 116.777 3.033 1
1 167 . 9 1 1 A 23 23 ILE H H 227 8.111 8.338 -0.227 1
1 168 . 9 1 1 A 23 23 ILE HA H 227 4.498 4.619 -0.121 1
1 178 . 9 1 1 A 23 23 ILE CA C 227 60.027 60.070 -0.043 1
1 179 . 9 1 1 A 23 23 ILE CB C 227 38.370 39.492 -1.122 1
1 183 . 9 1 1 A 23 23 ILE N N 227 122.085 124.230 -2.145 1
1 184 . 9 1 1 A 24 24 PHE H H 228 7.818 8.412 -0.594 1
1 185 . 9 1 1 A 24 24 PHE HA H 228 5.467 5.152 0.315 1
1 193 . 9 1 1 A 24 24 PHE CA C 228 54.551 55.852 -1.301 1
1 194 . 9 1 1 A 24 24 PHE CB C 228 41.685 40.991 0.694 1
1 200 . 9 1 1 A 24 24 PHE N N 228 118.840 122.580 -3.740 1
1 201 . 9 1 1 A 25 25 LEU H H 229 9.271 8.749 0.522 1
1 202 . 9 1 1 A 25 25 LEU HA H 229 4.953 5.289 -0.336 1
1 212 . 9 1 1 A 25 25 LEU CA C 229 52.892 53.479 -0.587 1
1 213 . 9 1 1 A 25 25 LEU CB C 229 44.755 44.875 -0.120 1
1 217 . 9 1 1 A 25 25 LEU N N 229 123.803 120.585 3.218 1
1 218 . 9 1 1 A 26 26 THR H H 230 8.493 9.021 -0.528 1
1 219 . 9 1 1 A 26 26 THR HA H 230 5.104 5.475 -0.371 1
1 224 . 9 1 1 A 26 26 THR CA C 230 61.771 60.925 0.846 1
1 225 . 9 1 1 A 26 26 THR CB C 230 68.733 70.332 -1.599 1
1 227 . 9 1 1 A 26 26 THR N N 230 121.119 116.041 5.078 1
1 228 . 9 1 1 A 27 27 VAL H H 231 9.001 8.935 0.066 1
1 229 . 9 1 1 A 27 27 VAL HA H 231 4.600 4.577 0.023 1
1 237 . 9 1 1 A 27 27 VAL CA C 231 56.940 59.364 -2.424 1
1 238 . 9 1 1 A 27 27 VAL CB C 231 33.730 32.750 0.980 1
1 241 . 9 1 1 A 27 27 VAL N N 231 124.749 127.144 -2.395 1
1 242 . 9 1 1 A 28 28 PRO HA H 232 4.661 4.757 -0.096 1
1 249 . 9 1 1 A 28 28 PRO CA C 232 62.233 62.774 -0.541 1
1 250 . 9 1 1 A 28 28 PRO CB C 232 31.667 31.531 0.136 1
1 253 . 9 1 1 A 29 29 VAL H H 233 8.171 8.078 0.093 1
1 254 . 9 1 1 A 29 29 VAL HA H 233 4.565 3.907 0.658 1
1 262 . 9 1 1 A 29 29 VAL CA C 233 60.027 63.827 -3.800 1
1 263 . 9 1 1 A 29 29 VAL CB C 233 32.699 31.285 1.414 1
1 266 . 9 1 1 A 29 29 VAL N N 233 116.136 121.916 -5.780 1
1 267 . 9 1 1 A 30 30 GLY H H 234 8.143 8.882 -0.739 1
1 268 . 9 1 1 A 30 30 GLY HA2 H 234 3.824 3.845 -0.021 1
1 269 . 9 1 1 A 30 30 GLY HA3 H 234 4.209 3.845 0.364 1
1 270 . 9 1 1 A 30 30 GLY CA C 234 44.635 47.325 -2.690 1
1 271 . 9 1 1 A 30 30 GLY N N 234 110.455 114.994 -4.539 1
1 272 . 9 1 1 A 32 32 GLY H H 236 8.305 8.327 -0.022 1
1 273 . 9 1 1 A 32 32 GLY HA2 H 236 3.836 4.218 -0.382 1
1 274 . 9 1 1 A 32 32 GLY HA3 H 236 4.103 4.218 -0.115 1
1 275 . 9 1 1 A 32 32 GLY CA C 236 44.635 46.229 -1.594 1
1 276 . 9 1 1 A 32 32 GLY N N 236 107.539 110.537 -2.998 1
1 277 . 9 1 1 A 33 33 GLU H H 237 7.583 8.197 -0.614 1
1 278 . 9 1 1 A 33 33 GLU HA H 237 4.564 4.421 0.143 1
1 283 . 9 1 1 A 33 33 GLU CA C 237 54.355 56.350 -1.995 1
1 284 . 9 1 1 A 33 33 GLU CB C 237 30.636 30.716 -0.080 1
1 286 . 9 1 1 A 33 33 GLU N N 237 120.218 121.775 -1.557 1
1 287 . 9 1 1 A 34 34 SER H H 238 8.630 8.565 0.065 1
1 288 . 9 1 1 A 34 34 SER HA H 238 5.012 4.924 0.088 1
1 291 . 9 1 1 A 34 34 SER CA C 238 56.915 57.038 -0.123 1
1 292 . 9 1 1 A 34 34 SER CB C 238 64.663 64.408 0.255 1
1 293 . 9 1 1 A 34 34 SER N N 238 116.390 118.427 -2.037 1
1 294 . 9 1 1 A 35 35 LEU H H 239 8.838 8.557 0.281 1
1 295 . 9 1 1 A 35 35 LEU HA H 239 4.577 4.897 -0.320 1
1 305 . 9 1 1 A 35 35 LEU CA C 239 52.808 53.589 -0.781 1
1 306 . 9 1 1 A 35 35 LEU CB C 239 44.156 43.434 0.722 1
1 310 . 9 1 1 A 35 35 LEU N N 239 124.463 124.221 0.242 1
1 311 . 9 1 1 A 36 36 ARG H H 240 8.526 8.654 -0.128 1
1 312 . 9 1 1 A 36 36 ARG HA H 240 5.077 4.938 0.139 1
1 318 . 9 1 1 A 36 36 ARG CA C 240 54.483 54.944 -0.461 1
1 319 . 9 1 1 A 36 36 ARG CB C 240 30.777 32.667 -1.890 1
1 322 . 9 1 1 A 36 36 ARG N N 240 124.891 122.482 2.409 1
1 323 . 9 1 1 A 37 37 LEU H H 241 9.179 8.763 0.416 1
1 324 . 9 1 1 A 37 37 LEU HA H 241 4.740 5.024 -0.284 1
1 334 . 9 1 1 A 37 37 LEU CA C 241 52.292 53.552 -1.260 1
1 335 . 9 1 1 A 37 37 LEU CB C 241 43.208 45.232 -2.024 1
1 339 . 9 1 1 A 37 37 LEU N N 241 126.203 128.948 -2.745 1
1 340 . 9 1 1 A 38 38 LEU H H 242 8.825 8.530 0.295 1
1 341 . 9 1 1 A 38 38 LEU HA H 242 4.371 4.637 -0.266 1
1 351 . 9 1 1 A 38 38 LEU CA C 242 54.508 55.055 -0.547 1
1 352 . 9 1 1 A 38 38 LEU CB C 242 41.583 42.015 -0.432 1
1 356 . 9 1 1 A 38 38 LEU N N 242 124.999 127.822 -2.823 1
1 357 . 9 1 1 A 39 39 ALA H H 243 8.634 9.264 -0.630 1
1 358 . 9 1 1 A 39 39 ALA HA H 243 3.799 3.991 -0.192 1
1 362 . 9 1 1 A 39 39 ALA CA C 243 54.852 55.225 -0.373 1
1 363 . 9 1 1 A 39 39 ALA CB C 243 18.243 18.303 -0.060 1
1 364 . 9 1 1 A 39 39 ALA N N 243 125.146 126.398 -1.252 1
1 365 . 9 1 1 A 40 40 SER H H 244 8.414 8.358 0.056 1
1 366 . 9 1 1 A 40 40 SER HA H 244 4.074 4.231 -0.157 1
1 369 . 9 1 1 A 40 40 SER CA C 244 58.977 61.053 -2.076 1
1 370 . 9 1 1 A 40 40 SER CB C 244 61.561 62.939 -1.378 1
1 371 . 9 1 1 A 40 40 SER N N 244 109.494 112.461 -2.967 1
1 372 . 9 1 1 A 41 41 ASP H H 245 7.434 7.844 -0.410 1
1 373 . 9 1 1 A 41 41 ASP HA H 245 4.809 4.921 -0.112 1
1 376 . 9 1 1 A 41 41 ASP CA C 245 52.990 53.017 -0.027 1
1 377 . 9 1 1 A 41 41 ASP CB C 245 41.792 41.545 0.247 1
1 378 . 9 1 1 A 41 41 ASP N N 245 120.452 118.995 1.457 1
1 379 . 9 1 1 A 42 42 LEU H H 246 7.338 8.458 -1.120 1
1 380 . 9 1 1 A 42 42 LEU HA H 246 4.098 4.385 -0.287 1
1 389 . 9 1 1 A 42 42 LEU CA C 246 55.068 55.228 -0.160 1
1 390 . 9 1 1 A 42 42 LEU CB C 246 41.861 42.165 -0.304 1
1 393 . 9 1 1 A 42 42 LEU N N 246 121.293 124.077 -2.784 1
1 394 . 9 1 1 A 43 43 GLN H H 247 8.170 8.582 -0.412 1
1 395 . 9 1 1 A 43 43 GLN HA H 247 4.532 4.236 0.296 1
1 401 . 9 1 1 A 43 43 GLN CA C 247 53.005 55.878 -2.873 1
1 402 . 9 1 1 A 43 43 GLN CB C 247 30.978 28.601 2.377 1
1 404 . 9 1 1 A 43 43 GLN N N 247 122.477 127.094 -4.617 1
1 406 . 9 1 1 A 44 44 ARG HA H 248 3.753 3.976 -0.223 1
1 412 . 9 1 1 A 44 44 ARG CA C 248 59.812 58.963 0.849 1
1 413 . 9 1 1 A 44 44 ARG CB C 248 29.306 30.106 -0.800 1
1 416 . 9 1 1 A 45 45 HIS H H 249 8.364 8.324 0.040 1
1 417 . 9 1 1 A 45 45 HIS HA H 249 4.294 4.292 0.002 1
1 422 . 9 1 1 A 45 45 HIS CA C 249 58.462 59.171 -0.709 1
1 423 . 9 1 1 A 45 45 HIS CB C 249 29.071 28.456 0.615 1
1 424 . 9 1 1 A 45 45 HIS N N 249 114.528 116.838 -2.310 1
1 425 . 9 1 1 A 46 46 SER H H 250 7.020 7.515 -0.495 1
1 426 . 9 1 1 A 46 46 SER HA H 250 4.153 4.247 -0.094 1
1 428 . 9 1 1 A 46 46 SER CA C 250 59.493 62.237 -2.744 1
1 429 . 9 1 1 A 46 46 SER CB C 250 62.071 62.864 -0.793 1
1 430 . 9 1 1 A 46 46 SER N N 250 113.900 115.443 -1.543 1
1 431 . 9 1 1 A 47 47 ILE H H 251 7.106 7.305 -0.199 1
1 432 . 9 1 1 A 47 47 ILE HA H 251 3.994 4.067 -0.073 1
1 441 . 9 1 1 A 47 47 ILE CA C 251 60.337 62.657 -2.320 1
1 442 . 9 1 1 A 47 47 ILE CB C 251 36.727 38.323 -1.596 1
1 446 . 9 1 1 A 47 47 ILE N N 251 115.759 120.398 -4.639 1
1 447 . 9 1 1 A 48 48 ALA H H 252 8.117 7.560 0.557 1
1 448 . 9 1 1 A 48 48 ALA HA H 252 3.979 4.199 -0.220 1
1 452 . 9 1 1 A 48 48 ALA CA C 252 53.821 52.732 1.089 1
1 453 . 9 1 1 A 48 48 ALA CB C 252 17.727 18.894 -1.167 1
1 454 . 9 1 1 A 48 48 ALA N N 252 120.091 123.197 -3.106 1
1 455 . 9 1 1 A 49 49 GLN H H 253 7.346 8.050 -0.704 1
1 456 . 9 1 1 A 49 49 GLN HA H 253 4.324 4.362 -0.038 1
1 463 . 9 1 1 A 49 49 GLN CA C 253 54.552 55.370 -0.818 1
1 464 . 9 1 1 A 49 49 GLN CB C 253 28.255 28.700 -0.445 1
1 466 . 9 1 1 A 49 49 GLN N N 253 112.219 114.585 -2.366 1
1 468 . 9 1 1 A 50 50 LEU H H 254 7.243 7.375 -0.132 1
1 469 . 9 1 1 A 50 50 LEU HA H 254 4.198 4.436 -0.238 1
1 479 . 9 1 1 A 50 50 LEU CA C 254 53.971 54.554 -0.583 1
1 480 . 9 1 1 A 50 50 LEU CB C 254 41.662 42.410 -0.748 1
1 484 . 9 1 1 A 50 50 LEU N N 254 120.510 122.302 -1.792 1
1 485 . 9 1 1 A 51 51 ASP H H 255 8.210 8.689 -0.479 1
1 486 . 9 1 1 A 51 51 ASP HA H 255 4.664 5.033 -0.369 1
1 489 . 9 1 1 A 51 51 ASP CA C 255 52.490 51.670 0.820 1
1 490 . 9 1 1 A 51 51 ASP CB C 255 40.259 41.148 -0.889 1
1 491 . 9 1 1 A 51 51 ASP N N 255 119.691 119.585 0.106 1
1 492 . 9 1 1 A 52 52 PRO HA H 256 4.125 4.314 -0.189 1
1 499 . 9 1 1 A 52 52 PRO CA C 256 65.380 65.696 -0.316 1
1 500 . 9 1 1 A 52 52 PRO CB C 256 31.865 31.736 0.129 1
1 503 . 9 1 1 A 53 53 GLU H H 257 8.432 8.169 0.263 1
1 504 . 9 1 1 A 53 53 GLU HA H 257 4.073 4.130 -0.057 1
1 508 . 9 1 1 A 53 53 GLU CA C 257 58.677 59.479 -0.802 1
1 509 . 9 1 1 A 53 53 GLU CB C 257 28.771 29.166 -0.395 1
1 511 . 9 1 1 A 53 53 GLU N N 257 119.483 118.185 1.298 1
1 512 . 9 1 1 A 54 54 ALA H H 258 7.967 7.855 0.112 1
1 513 . 9 1 1 A 54 54 ALA HA H 258 4.240 4.006 0.234 1
1 517 . 9 1 1 A 54 54 ALA CA C 258 54.552 55.284 -0.732 1
1 518 . 9 1 1 A 54 54 ALA CB C 258 18.699 18.652 0.047 1
1 519 . 9 1 1 A 54 54 ALA N N 258 124.293 122.561 1.732 1
1 520 . 9 1 1 A 55 55 LEU H H 259 8.695 8.238 0.457 1
1 521 . 9 1 1 A 55 55 LEU HA H 259 3.902 3.961 -0.059 1
1 530 . 9 1 1 A 55 55 LEU CA C 259 57.130 57.912 -0.782 1
1 531 . 9 1 1 A 55 55 LEU CB C 259 41.192 41.698 -0.506 1
1 535 . 9 1 1 A 55 55 LEU N N 259 118.361 118.583 -0.222 1
1 536 . 9 1 1 A 56 56 GLY H H 260 8.177 7.829 0.348 1
1 537 . 9 1 1 A 56 56 GLY HA2 H 260 3.723 3.780 -0.057 1
1 538 . 9 1 1 A 56 56 GLY HA3 H 260 3.971 3.780 0.191 1
1 539 . 9 1 1 A 56 56 GLY CA C 260 46.302 47.233 -0.931 1
1 540 . 9 1 1 A 56 56 GLY N N 260 105.789 106.569 -0.780 1
1 541 . 9 1 1 A 57 57 ASN H H 261 7.914 8.024 -0.110 1
1 542 . 9 1 1 A 57 57 ASN HA H 261 4.643 4.420 0.223 1
1 547 . 9 1 1 A 57 57 ASN CA C 261 54.945 55.834 -0.889 1
1 548 . 9 1 1 A 57 57 ASN CB C 261 37.533 37.184 0.349 1
1 549 . 9 1 1 A 57 57 ASN N N 261 121.132 120.329 0.803 1
1 551 . 9 1 1 A 58 58 ILE H H 262 8.732 7.860 0.872 1
1 552 . 9 1 1 A 58 58 ILE HA H 262 3.712 3.611 0.101 1
1 562 . 9 1 1 A 58 58 ILE CA C 262 63.820 65.183 -1.363 1
1 563 . 9 1 1 A 58 58 ILE CB C 262 35.990 37.643 -1.653 1
1 567 . 9 1 1 A 58 58 ILE N N 262 125.309 121.036 4.273 1
1 568 . 9 1 1 A 59 59 LYS H H 263 8.416 8.016 0.400 1
1 569 . 9 1 1 A 59 59 LYS HA H 263 4.075 3.866 0.209 1
1 577 . 9 1 1 A 59 59 LYS CA C 263 59.708 60.482 -0.774 1
1 578 . 9 1 1 A 59 59 LYS CB C 263 31.343 32.433 -1.090 1
1 582 . 9 1 1 A 59 59 LYS N N 263 122.080 118.743 3.337 1
1 583 . 9 1 1 A 60 60 LYS H H 264 7.793 7.343 0.450 1
1 584 . 9 1 1 A 60 60 LYS HA H 264 4.036 4.036 0.000 1
1 591 . 9 1 1 A 60 60 LYS CA C 264 59.708 59.380 0.328 1
1 592 . 9 1 1 A 60 60 LYS CB C 264 31.865 32.091 -0.226 1
1 596 . 9 1 1 A 60 60 LYS N N 264 119.503 119.444 0.059 1
1 597 . 9 1 1 A 61 61 LEU H H 265 7.797 7.886 -0.089 1
1 598 . 9 1 1 A 61 61 LEU HA H 265 4.106 4.025 0.081 1
1 608 . 9 1 1 A 61 61 LEU CA C 265 57.646 58.159 -0.513 1
1 609 . 9 1 1 A 61 61 LEU CB C 265 40.177 41.437 -1.260 1
1 613 . 9 1 1 A 61 61 LEU N N 265 121.392 122.260 -0.868 1
1 614 . 9 1 1 A 62 62 SER H H 266 8.775 8.086 0.689 1
1 615 . 9 1 1 A 62 62 SER HA H 266 4.001 4.201 -0.200 1
1 619 . 9 1 1 A 62 62 SER CA C 266 60.224 61.146 -0.922 1
1 620 . 9 1 1 A 62 62 SER CB C 266 62.758 63.018 -0.260 1
1 621 . 9 1 1 A 62 62 SER N N 266 112.902 114.457 -1.555 1
1 622 . 9 1 1 A 63 63 ASN H H 267 8.199 8.057 0.142 1
1 623 . 9 1 1 A 63 63 ASN HA H 267 4.393 4.368 0.025 1
1 628 . 9 1 1 A 63 63 ASN CA C 267 55.583 56.610 -1.027 1
1 629 . 9 1 1 A 63 63 ASN CB C 267 37.537 39.335 -1.798 1
1 630 . 9 1 1 A 63 63 ASN N N 267 117.813 119.442 -1.629 1
1 632 . 9 1 1 A 64 64 ARG H H 268 8.000 7.886 0.114 1
1 633 . 9 1 1 A 64 64 ARG HA H 268 4.118 4.200 -0.082 1
1 640 . 9 1 1 A 64 64 ARG CA C 268 57.646 58.704 -1.058 1
1 641 . 9 1 1 A 64 64 ARG CB C 268 29.307 30.038 -0.731 1
1 644 . 9 1 1 A 64 64 ARG N N 268 120.911 119.802 1.109 1
1 645 . 9 1 1 A 65 65 LEU H H 269 9.119 7.841 1.278 1
1 646 . 9 1 1 A 65 65 LEU HA H 269 3.916 4.087 -0.171 1
1 656 . 9 1 1 A 65 65 LEU CA C 269 57.124 58.039 -0.915 1
1 657 . 9 1 1 A 65 65 LEU CB C 269 41.662 41.417 0.245 1
1 661 . 9 1 1 A 65 65 LEU N N 269 119.046 120.979 -1.933 1
1 662 . 9 1 1 A 66 66 ALA H H 270 8.245 8.547 -0.302 1
1 663 . 9 1 1 A 66 66 ALA HA H 270 3.997 3.958 0.039 1
1 667 . 9 1 1 A 66 66 ALA CA C 270 54.337 55.162 -0.825 1
1 668 . 9 1 1 A 66 66 ALA CB C 270 16.696 18.085 -1.389 1
1 669 . 9 1 1 A 66 66 ALA N N 270 121.047 121.411 -0.364 1
1 670 . 9 1 1 A 67 67 GLN H H 271 7.704 7.922 -0.218 1
1 671 . 9 1 1 A 67 67 GLN HA H 271 4.025 4.031 -0.006 1
1 678 . 9 1 1 A 67 67 GLN CA C 271 58.418 59.085 -0.667 1
1 679 . 9 1 1 A 67 67 GLN CB C 271 27.996 28.643 -0.647 1
1 681 . 9 1 1 A 67 67 GLN N N 271 118.440 117.902 0.538 1
1 683 . 9 1 1 A 68 68 ILE H H 272 8.142 7.914 0.228 1
1 684 . 9 1 1 A 68 68 ILE HA H 272 3.723 3.700 0.023 1
1 694 . 9 1 1 A 68 68 ILE CA C 272 64.605 64.744 -0.139 1
1 695 . 9 1 1 A 68 68 ILE CB C 272 37.793 37.308 0.485 1
1 699 . 9 1 1 A 68 68 ILE N N 272 119.521 119.553 -0.032 1
1 700 . 9 1 1 A 69 69 CYS H H 273 8.817 8.307 0.510 1
1 701 . 9 1 1 A 69 69 CYS HA H 273 3.958 4.379 -0.421 1
1 704 . 9 1 1 A 69 69 CYS CA C 273 64.204 60.525 3.679 1
1 705 . 9 1 1 A 69 69 CYS CB C 273 26.337 27.115 -0.778 1
1 706 . 9 1 1 A 69 69 CYS N N 273 117.234 120.855 -3.621 1
1 707 . 9 1 1 A 70 70 SER H H 274 7.880 7.582 0.298 1
1 708 . 9 1 1 A 70 70 SER HA H 274 4.246 4.356 -0.110 1
1 710 . 9 1 1 A 70 70 SER CA C 274 60.008 59.663 0.345 1
1 711 . 9 1 1 A 70 70 SER CB C 274 62.071 63.397 -1.326 1
1 712 . 9 1 1 A 70 70 SER N N 274 114.227 114.809 -0.582 1
1 713 . 9 1 1 A 71 71 SER H H 275 7.609 7.613 -0.004 1
1 714 . 9 1 1 A 71 71 SER HA H 275 4.564 4.481 0.083 1
1 717 . 9 1 1 A 71 71 SER CA C 275 57.946 58.145 -0.199 1
1 718 . 9 1 1 A 71 71 SER CB C 275 63.618 63.998 -0.380 1
1 719 . 9 1 1 A 71 71 SER N N 275 114.958 111.082 3.876 1
1 720 . 9 1 1 A 72 72 ILE H H 276 7.357 7.409 -0.052 1
1 721 . 9 1 1 A 72 72 ILE HA H 276 4.169 3.994 0.175 1
1 731 . 9 1 1 A 72 72 ILE CA C 276 60.967 61.537 -0.570 1
1 732 . 9 1 1 A 72 72 ILE CB C 276 38.276 38.187 0.089 1
1 736 . 9 1 1 A 72 72 ILE N N 276 123.513 123.790 -0.277 1
1 737 . 9 1 1 A 73 73 ARG H H 277 8.508 8.594 -0.086 1
1 738 . 9 1 1 A 73 73 ARG HA H 277 4.446 4.721 -0.275 1
1 744 . 9 1 1 A 73 73 ARG CA C 277 55.324 55.635 -0.311 1
1 745 . 9 1 1 A 73 73 ARG CB C 277 30.499 31.625 -1.126 1
1 748 . 9 1 1 A 73 73 ARG N N 277 126.709 127.741 -1.032 1
1 749 . 9 1 1 A 75 75 HIS HA H 279 4.602 4.834 -0.232 1
1 754 . 9 1 1 A 75 75 HIS CA C 279 55.840 55.850 -0.010 1
1 755 . 9 1 1 A 75 75 HIS CB C 279 30.426 31.324 -0.898 1
1 143 . 10 1 1 A 21 21 LYS H H 225 8.503 8.698 -0.195 1
1 144 . 10 1 1 A 21 21 LYS HA H 225 4.349 4.526 -0.177 1
1 152 . 10 1 1 A 21 21 LYS CA C 225 54.872 56.258 -1.386 1
1 153 . 10 1 1 A 21 21 LYS CB C 225 31.667 32.697 -1.030 1
1 157 . 10 1 1 A 21 21 LYS N N 225 122.563 123.590 -1.027 1
1 158 . 10 1 1 A 22 22 GLU H H 226 7.688 7.770 -0.082 1
1 159 . 10 1 1 A 22 22 GLU HA H 226 4.264 5.056 -0.792 1
1 163 . 10 1 1 A 22 22 GLU CA C 226 55.728 55.351 0.377 1
1 164 . 10 1 1 A 22 22 GLU CB C 226 30.636 32.840 -2.204 1
1 166 . 10 1 1 A 22 22 GLU N N 226 119.810 121.346 -1.536 1
1 167 . 10 1 1 A 23 23 ILE H H 227 8.111 8.599 -0.488 1
1 168 . 10 1 1 A 23 23 ILE HA H 227 4.498 4.644 -0.146 1
1 178 . 10 1 1 A 23 23 ILE CA C 227 60.027 60.334 -0.307 1
1 179 . 10 1 1 A 23 23 ILE CB C 227 38.370 39.031 -0.661 1
1 183 . 10 1 1 A 23 23 ILE N N 227 122.085 125.912 -3.827 1
1 184 . 10 1 1 A 24 24 PHE H H 228 7.818 8.313 -0.495 1
1 185 . 10 1 1 A 24 24 PHE HA H 228 5.467 5.213 0.254 1
1 193 . 10 1 1 A 24 24 PHE CA C 228 54.551 55.911 -1.360 1
1 194 . 10 1 1 A 24 24 PHE CB C 228 41.685 41.228 0.457 1
1 200 . 10 1 1 A 24 24 PHE N N 228 118.840 123.742 -4.902 1
1 201 . 10 1 1 A 25 25 LEU H H 229 9.271 9.014 0.257 1
1 202 . 10 1 1 A 25 25 LEU HA H 229 4.953 5.260 -0.307 1
1 212 . 10 1 1 A 25 25 LEU CA C 229 52.892 53.643 -0.751 1
1 213 . 10 1 1 A 25 25 LEU CB C 229 44.755 44.829 -0.074 1
1 217 . 10 1 1 A 25 25 LEU N N 229 123.803 120.489 3.314 1
1 218 . 10 1 1 A 26 26 THR H H 230 8.493 8.923 -0.430 1
1 219 . 10 1 1 A 26 26 THR HA H 230 5.104 4.938 0.166 1
1 224 . 10 1 1 A 26 26 THR CA C 230 61.771 62.208 -0.437 1
1 225 . 10 1 1 A 26 26 THR CB C 230 68.733 69.493 -0.760 1
1 227 . 10 1 1 A 26 26 THR N N 230 121.119 120.353 0.766 1
1 228 . 10 1 1 A 27 27 VAL H H 231 9.001 8.570 0.431 1
1 229 . 10 1 1 A 27 27 VAL HA H 231 4.600 4.531 0.069 1
1 237 . 10 1 1 A 27 27 VAL CA C 231 56.940 59.186 -2.246 1
1 238 . 10 1 1 A 27 27 VAL CB C 231 33.730 32.979 0.751 1
1 241 . 10 1 1 A 27 27 VAL N N 231 124.749 126.771 -2.022 1
1 242 . 10 1 1 A 28 28 PRO HA H 232 4.661 4.975 -0.314 1
1 249 . 10 1 1 A 28 28 PRO CA C 232 62.233 62.402 -0.169 1
1 250 . 10 1 1 A 28 28 PRO CB C 232 31.667 31.676 -0.009 1
1 253 . 10 1 1 A 29 29 VAL H H 233 8.171 8.087 0.084 1
1 254 . 10 1 1 A 29 29 VAL HA H 233 4.565 3.913 0.652 1
1 262 . 10 1 1 A 29 29 VAL CA C 233 60.027 63.657 -3.630 1
1 263 . 10 1 1 A 29 29 VAL CB C 233 32.699 31.304 1.395 1
1 266 . 10 1 1 A 29 29 VAL N N 233 116.136 120.560 -4.424 1
1 267 . 10 1 1 A 30 30 GLY H H 234 8.143 8.726 -0.583 1
1 268 . 10 1 1 A 30 30 GLY HA2 H 234 3.824 3.830 -0.006 1
1 269 . 10 1 1 A 30 30 GLY HA3 H 234 4.209 3.830 0.379 1
1 270 . 10 1 1 A 30 30 GLY CA C 234 44.635 47.292 -2.657 1
1 271 . 10 1 1 A 30 30 GLY N N 234 110.455 114.831 -4.376 1
1 272 . 10 1 1 A 32 32 GLY H H 236 8.305 8.211 0.094 1
1 273 . 10 1 1 A 32 32 GLY HA2 H 236 3.836 4.189 -0.353 1
1 274 . 10 1 1 A 32 32 GLY HA3 H 236 4.103 4.189 -0.086 1
1 275 . 10 1 1 A 32 32 GLY CA C 236 44.635 46.217 -1.582 1
1 276 . 10 1 1 A 32 32 GLY N N 236 107.539 108.962 -1.423 1
1 277 . 10 1 1 A 33 33 GLU H H 237 7.583 8.160 -0.577 1
1 278 . 10 1 1 A 33 33 GLU HA H 237 4.564 4.470 0.094 1
1 283 . 10 1 1 A 33 33 GLU CA C 237 54.355 55.706 -1.351 1
1 284 . 10 1 1 A 33 33 GLU CB C 237 30.636 30.676 -0.040 1
1 286 . 10 1 1 A 33 33 GLU N N 237 120.218 121.216 -0.998 1
1 287 . 10 1 1 A 34 34 SER H H 238 8.630 8.706 -0.076 1
1 288 . 10 1 1 A 34 34 SER HA H 238 5.012 5.436 -0.424 1
1 291 . 10 1 1 A 34 34 SER CA C 238 56.915 56.109 0.806 1
1 292 . 10 1 1 A 34 34 SER CB C 238 64.663 65.989 -1.326 1
1 293 . 10 1 1 A 34 34 SER N N 238 116.390 113.217 3.173 1
1 294 . 10 1 1 A 35 35 LEU H H 239 8.838 8.904 -0.066 1
1 295 . 10 1 1 A 35 35 LEU HA H 239 4.577 4.801 -0.224 1
1 305 . 10 1 1 A 35 35 LEU CA C 239 52.808 53.664 -0.856 1
1 306 . 10 1 1 A 35 35 LEU CB C 239 44.156 43.877 0.279 1
1 310 . 10 1 1 A 35 35 LEU N N 239 124.463 124.786 -0.323 1
1 311 . 10 1 1 A 36 36 ARG H H 240 8.526 8.791 -0.265 1
1 312 . 10 1 1 A 36 36 ARG HA H 240 5.077 4.741 0.336 1
1 318 . 10 1 1 A 36 36 ARG CA C 240 54.483 55.206 -0.723 1
1 319 . 10 1 1 A 36 36 ARG CB C 240 30.777 31.495 -0.718 1
1 322 . 10 1 1 A 36 36 ARG N N 240 124.891 124.693 0.198 1
1 323 . 10 1 1 A 37 37 LEU H H 241 9.179 8.578 0.601 1
1 324 . 10 1 1 A 37 37 LEU HA H 241 4.740 5.104 -0.364 1
1 334 . 10 1 1 A 37 37 LEU CA C 241 52.292 53.549 -1.257 1
1 335 . 10 1 1 A 37 37 LEU CB C 241 43.208 45.885 -2.677 1
1 339 . 10 1 1 A 37 37 LEU N N 241 126.203 128.665 -2.462 1
1 340 . 10 1 1 A 38 38 LEU H H 242 8.825 8.645 0.180 1
1 341 . 10 1 1 A 38 38 LEU HA H 242 4.371 4.700 -0.329 1
1 351 . 10 1 1 A 38 38 LEU CA C 242 54.508 54.213 0.295 1
1 352 . 10 1 1 A 38 38 LEU CB C 242 41.583 42.434 -0.851 1
1 356 . 10 1 1 A 38 38 LEU N N 242 124.999 127.106 -2.107 1
1 357 . 10 1 1 A 39 39 ALA H H 243 8.634 9.112 -0.478 1
1 358 . 10 1 1 A 39 39 ALA HA H 243 3.799 3.996 -0.197 1
1 362 . 10 1 1 A 39 39 ALA CA C 243 54.852 55.163 -0.311 1
1 363 . 10 1 1 A 39 39 ALA CB C 243 18.243 18.311 -0.068 1
1 364 . 10 1 1 A 39 39 ALA N N 243 125.146 126.084 -0.938 1
1 365 . 10 1 1 A 40 40 SER H H 244 8.414 8.091 0.323 1
1 366 . 10 1 1 A 40 40 SER HA H 244 4.074 4.304 -0.230 1
1 369 . 10 1 1 A 40 40 SER CA C 244 58.977 61.126 -2.149 1
1 370 . 10 1 1 A 40 40 SER CB C 244 61.561 63.244 -1.683 1
1 371 . 10 1 1 A 40 40 SER N N 244 109.494 112.748 -3.254 1
1 372 . 10 1 1 A 41 41 ASP H H 245 7.434 7.906 -0.472 1
1 373 . 10 1 1 A 41 41 ASP HA H 245 4.809 4.905 -0.096 1
1 376 . 10 1 1 A 41 41 ASP CA C 245 52.990 52.965 0.025 1
1 377 . 10 1 1 A 41 41 ASP CB C 245 41.792 41.545 0.247 1
1 378 . 10 1 1 A 41 41 ASP N N 245 120.452 120.764 -0.312 1
1 379 . 10 1 1 A 42 42 LEU H H 246 7.338 8.061 -0.723 1
1 380 . 10 1 1 A 42 42 LEU HA H 246 4.098 4.287 -0.189 1
1 389 . 10 1 1 A 42 42 LEU CA C 246 55.068 55.969 -0.901 1
1 390 . 10 1 1 A 42 42 LEU CB C 246 41.861 42.318 -0.457 1
1 393 . 10 1 1 A 42 42 LEU N N 246 121.293 122.913 -1.620 1
1 394 . 10 1 1 A 43 43 GLN H H 247 8.170 8.764 -0.594 1
1 395 . 10 1 1 A 43 43 GLN HA H 247 4.532 4.495 0.037 1
1 401 . 10 1 1 A 43 43 GLN CA C 247 53.005 55.475 -2.470 1
1 402 . 10 1 1 A 43 43 GLN CB C 247 30.978 29.388 1.590 1
1 404 . 10 1 1 A 43 43 GLN N N 247 122.477 126.961 -4.484 1
1 406 . 10 1 1 A 44 44 ARG HA H 248 3.753 3.900 -0.147 1
1 412 . 10 1 1 A 44 44 ARG CA C 248 59.812 59.149 0.663 1
1 413 . 10 1 1 A 44 44 ARG CB C 248 29.306 30.116 -0.810 1
1 416 . 10 1 1 A 45 45 HIS H H 249 8.364 8.566 -0.202 1
1 417 . 10 1 1 A 45 45 HIS HA H 249 4.294 4.292 0.002 1
1 422 . 10 1 1 A 45 45 HIS CA C 249 58.462 59.194 -0.732 1
1 423 . 10 1 1 A 45 45 HIS CB C 249 29.071 28.420 0.651 1
1 424 . 10 1 1 A 45 45 HIS N N 249 114.528 117.869 -3.341 1
1 425 . 10 1 1 A 46 46 SER H H 250 7.020 7.590 -0.570 1
1 426 . 10 1 1 A 46 46 SER HA H 250 4.153 3.957 0.196 1
1 428 . 10 1 1 A 46 46 SER CA C 250 59.493 60.902 -1.409 1
1 429 . 10 1 1 A 46 46 SER CB C 250 62.071 62.833 -0.762 1
1 430 . 10 1 1 A 46 46 SER N N 250 113.900 114.760 -0.860 1
1 431 . 10 1 1 A 47 47 ILE H H 251 7.106 7.340 -0.234 1
1 432 . 10 1 1 A 47 47 ILE HA H 251 3.994 4.068 -0.074 1
1 441 . 10 1 1 A 47 47 ILE CA C 251 60.337 62.649 -2.312 1
1 442 . 10 1 1 A 47 47 ILE CB C 251 36.727 38.404 -1.677 1
1 446 . 10 1 1 A 47 47 ILE N N 251 115.759 119.003 -3.244 1
1 447 . 10 1 1 A 48 48 ALA H H 252 8.117 7.632 0.485 1
1 448 . 10 1 1 A 48 48 ALA HA H 252 3.979 4.247 -0.268 1
1 452 . 10 1 1 A 48 48 ALA CA C 252 53.821 52.799 1.022 1
1 453 . 10 1 1 A 48 48 ALA CB C 252 17.727 19.092 -1.365 1
1 454 . 10 1 1 A 48 48 ALA N N 252 120.091 123.357 -3.266 1
1 455 . 10 1 1 A 49 49 GLN H H 253 7.346 8.115 -0.769 1
1 456 . 10 1 1 A 49 49 GLN HA H 253 4.324 4.361 -0.037 1
1 463 . 10 1 1 A 49 49 GLN CA C 253 54.552 55.210 -0.658 1
1 464 . 10 1 1 A 49 49 GLN CB C 253 28.255 28.396 -0.141 1
1 466 . 10 1 1 A 49 49 GLN N N 253 112.219 114.545 -2.326 1
1 468 . 10 1 1 A 50 50 LEU H H 254 7.243 7.394 -0.151 1
1 469 . 10 1 1 A 50 50 LEU HA H 254 4.198 4.462 -0.264 1
1 479 . 10 1 1 A 50 50 LEU CA C 254 53.971 54.400 -0.429 1
1 480 . 10 1 1 A 50 50 LEU CB C 254 41.662 42.741 -1.079 1
1 484 . 10 1 1 A 50 50 LEU N N 254 120.510 122.238 -1.728 1
1 485 . 10 1 1 A 51 51 ASP H H 255 8.210 8.521 -0.311 1
1 486 . 10 1 1 A 51 51 ASP HA H 255 4.664 5.124 -0.460 1
1 489 . 10 1 1 A 51 51 ASP CA C 255 52.490 50.897 1.593 1
1 490 . 10 1 1 A 51 51 ASP CB C 255 40.259 41.467 -1.208 1
1 491 . 10 1 1 A 51 51 ASP N N 255 119.691 119.319 0.372 1
1 492 . 10 1 1 A 52 52 PRO HA H 256 4.125 4.304 -0.179 1
1 499 . 10 1 1 A 52 52 PRO CA C 256 65.380 65.662 -0.282 1
1 500 . 10 1 1 A 52 52 PRO CB C 256 31.865 31.717 0.148 1
1 503 . 10 1 1 A 53 53 GLU H H 257 8.432 8.483 -0.051 1
1 504 . 10 1 1 A 53 53 GLU HA H 257 4.073 4.092 -0.019 1
1 508 . 10 1 1 A 53 53 GLU CA C 257 58.677 59.451 -0.774 1
1 509 . 10 1 1 A 53 53 GLU CB C 257 28.771 29.402 -0.631 1
1 511 . 10 1 1 A 53 53 GLU N N 257 119.483 118.212 1.271 1
1 512 . 10 1 1 A 54 54 ALA H H 258 7.967 7.520 0.447 1
1 513 . 10 1 1 A 54 54 ALA HA H 258 4.240 4.041 0.199 1
1 517 . 10 1 1 A 54 54 ALA CA C 258 54.552 55.217 -0.665 1
1 518 . 10 1 1 A 54 54 ALA CB C 258 18.699 18.535 0.164 1
1 519 . 10 1 1 A 54 54 ALA N N 258 124.293 122.481 1.812 1
1 520 . 10 1 1 A 55 55 LEU H H 259 8.695 8.425 0.270 1
1 521 . 10 1 1 A 55 55 LEU HA H 259 3.902 3.958 -0.056 1
1 530 . 10 1 1 A 55 55 LEU CA C 259 57.130 58.015 -0.885 1
1 531 . 10 1 1 A 55 55 LEU CB C 259 41.192 41.699 -0.507 1
1 535 . 10 1 1 A 55 55 LEU N N 259 118.361 118.622 -0.261 1
1 536 . 10 1 1 A 56 56 GLY H H 260 8.177 7.935 0.242 1
1 537 . 10 1 1 A 56 56 GLY HA2 H 260 3.723 3.748 -0.025 1
1 538 . 10 1 1 A 56 56 GLY HA3 H 260 3.971 3.748 0.223 1
1 539 . 10 1 1 A 56 56 GLY CA C 260 46.302 47.373 -1.071 1
1 540 . 10 1 1 A 56 56 GLY N N 260 105.789 106.571 -0.782 1
1 541 . 10 1 1 A 57 57 ASN H H 261 7.914 7.549 0.365 1
1 542 . 10 1 1 A 57 57 ASN HA H 261 4.643 4.458 0.185 1
1 547 . 10 1 1 A 57 57 ASN CA C 261 54.945 55.537 -0.592 1
1 548 . 10 1 1 A 57 57 ASN CB C 261 37.533 37.930 -0.397 1
1 549 . 10 1 1 A 57 57 ASN N N 261 121.132 120.368 0.764 1
1 551 . 10 1 1 A 58 58 ILE H H 262 8.732 7.815 0.917 1
1 552 . 10 1 1 A 58 58 ILE HA H 262 3.712 3.654 0.058 1
1 562 . 10 1 1 A 58 58 ILE CA C 262 63.820 65.023 -1.203 1
1 563 . 10 1 1 A 58 58 ILE CB C 262 35.990 37.715 -1.725 1
1 567 . 10 1 1 A 58 58 ILE N N 262 125.309 120.482 4.827 1
1 568 . 10 1 1 A 59 59 LYS H H 263 8.416 8.146 0.270 1
1 569 . 10 1 1 A 59 59 LYS HA H 263 4.075 3.845 0.230 1
1 577 . 10 1 1 A 59 59 LYS CA C 263 59.708 60.464 -0.756 1
1 578 . 10 1 1 A 59 59 LYS CB C 263 31.343 32.368 -1.025 1
1 582 . 10 1 1 A 59 59 LYS N N 263 122.080 118.868 3.212 1
1 583 . 10 1 1 A 60 60 LYS H H 264 7.793 7.891 -0.098 1
1 584 . 10 1 1 A 60 60 LYS HA H 264 4.036 4.072 -0.036 1
1 591 . 10 1 1 A 60 60 LYS CA C 264 59.708 58.934 0.774 1
1 592 . 10 1 1 A 60 60 LYS CB C 264 31.865 31.687 0.178 1
1 596 . 10 1 1 A 60 60 LYS N N 264 119.503 118.632 0.871 1
1 597 . 10 1 1 A 61 61 LEU H H 265 7.797 7.822 -0.025 1
1 598 . 10 1 1 A 61 61 LEU HA H 265 4.106 4.037 0.069 1
1 608 . 10 1 1 A 61 61 LEU CA C 265 57.646 58.119 -0.473 1
1 609 . 10 1 1 A 61 61 LEU CB C 265 40.177 41.429 -1.252 1
1 613 . 10 1 1 A 61 61 LEU N N 265 121.392 121.916 -0.524 1
1 614 . 10 1 1 A 62 62 SER H H 266 8.775 8.147 0.628 1
1 615 . 10 1 1 A 62 62 SER HA H 266 4.001 4.207 -0.206 1
1 619 . 10 1 1 A 62 62 SER CA C 266 60.224 61.159 -0.935 1
1 620 . 10 1 1 A 62 62 SER CB C 266 62.758 62.981 -0.223 1
1 621 . 10 1 1 A 62 62 SER N N 266 112.902 114.349 -1.447 1
1 622 . 10 1 1 A 63 63 ASN H H 267 8.199 8.067 0.132 1
1 623 . 10 1 1 A 63 63 ASN HA H 267 4.393 4.387 0.006 1
1 628 . 10 1 1 A 63 63 ASN CA C 267 55.583 56.544 -0.961 1
1 629 . 10 1 1 A 63 63 ASN CB C 267 37.537 39.030 -1.493 1
1 630 . 10 1 1 A 63 63 ASN N N 267 117.813 119.582 -1.769 1
1 632 . 10 1 1 A 64 64 ARG H H 268 8.000 8.017 -0.017 1
1 633 . 10 1 1 A 64 64 ARG HA H 268 4.118 4.212 -0.094 1
1 640 . 10 1 1 A 64 64 ARG CA C 268 57.646 58.275 -0.629 1
1 641 . 10 1 1 A 64 64 ARG CB C 268 29.307 29.915 -0.608 1
1 644 . 10 1 1 A 64 64 ARG N N 268 120.911 119.606 1.305 1
1 645 . 10 1 1 A 65 65 LEU H H 269 9.119 7.710 1.409 1
1 646 . 10 1 1 A 65 65 LEU HA H 269 3.916 4.085 -0.169 1
1 656 . 10 1 1 A 65 65 LEU CA C 269 57.124 58.038 -0.914 1
1 657 . 10 1 1 A 65 65 LEU CB C 269 41.662 41.461 0.201 1
1 661 . 10 1 1 A 65 65 LEU N N 269 119.046 121.310 -2.264 1
1 662 . 10 1 1 A 66 66 ALA H H 270 8.245 8.360 -0.115 1
1 663 . 10 1 1 A 66 66 ALA HA H 270 3.997 3.948 0.049 1
1 667 . 10 1 1 A 66 66 ALA CA C 270 54.337 55.035 -0.698 1
1 668 . 10 1 1 A 66 66 ALA CB C 270 16.696 18.182 -1.486 1
1 669 . 10 1 1 A 66 66 ALA N N 270 121.047 121.333 -0.286 1
1 670 . 10 1 1 A 67 67 GLN H H 271 7.704 7.544 0.160 1
1 671 . 10 1 1 A 67 67 GLN HA H 271 4.025 4.020 0.005 1
1 678 . 10 1 1 A 67 67 GLN CA C 271 58.418 58.822 -0.404 1
1 679 . 10 1 1 A 67 67 GLN CB C 271 27.996 28.253 -0.257 1
1 681 . 10 1 1 A 67 67 GLN N N 271 118.440 117.676 0.764 1
1 683 . 10 1 1 A 68 68 ILE H H 272 8.142 7.818 0.324 1
1 684 . 10 1 1 A 68 68 ILE HA H 272 3.723 3.648 0.075 1
1 694 . 10 1 1 A 68 68 ILE CA C 272 64.605 65.022 -0.417 1
1 695 . 10 1 1 A 68 68 ILE CB C 272 37.793 37.806 -0.013 1
1 699 . 10 1 1 A 68 68 ILE N N 272 119.521 119.923 -0.402 1
1 700 . 10 1 1 A 69 69 CYS H H 273 8.817 8.080 0.737 1
1 701 . 10 1 1 A 69 69 CYS HA H 273 3.958 4.329 -0.371 1
1 704 . 10 1 1 A 69 69 CYS CA C 273 64.204 60.513 3.691 1
1 705 . 10 1 1 A 69 69 CYS CB C 273 26.337 26.938 -0.601 1
1 706 . 10 1 1 A 69 69 CYS N N 273 117.234 118.772 -1.538 1
1 707 . 10 1 1 A 70 70 SER H H 274 7.880 7.599 0.281 1
1 708 . 10 1 1 A 70 70 SER HA H 274 4.246 4.347 -0.101 1
1 710 . 10 1 1 A 70 70 SER CA C 274 60.008 60.747 -0.739 1
1 711 . 10 1 1 A 70 70 SER CB C 274 62.071 63.211 -1.140 1
1 712 . 10 1 1 A 70 70 SER N N 274 114.227 116.050 -1.823 1
1 713 . 10 1 1 A 71 71 SER H H 275 7.609 7.911 -0.302 1
1 714 . 10 1 1 A 71 71 SER HA H 275 4.564 4.632 -0.068 1
1 717 . 10 1 1 A 71 71 SER CA C 275 57.946 58.331 -0.385 1
1 718 . 10 1 1 A 71 71 SER CB C 275 63.618 64.072 -0.454 1
1 719 . 10 1 1 A 71 71 SER N N 275 114.958 113.944 1.014 1
1 720 . 10 1 1 A 72 72 ILE H H 276 7.357 7.687 -0.330 1
1 721 . 10 1 1 A 72 72 ILE HA H 276 4.169 4.480 -0.311 1
1 731 . 10 1 1 A 72 72 ILE CA C 276 60.967 59.838 1.129 1
1 732 . 10 1 1 A 72 72 ILE CB C 276 38.276 40.538 -2.262 1
1 736 . 10 1 1 A 72 72 ILE N N 276 123.513 122.200 1.313 1
1 737 . 10 1 1 A 73 73 ARG H H 277 8.508 8.719 -0.211 1
1 738 . 10 1 1 A 73 73 ARG HA H 277 4.446 4.814 -0.368 1
1 744 . 10 1 1 A 73 73 ARG CA C 277 55.324 54.867 0.457 1
1 745 . 10 1 1 A 73 73 ARG CB C 277 30.499 31.632 -1.133 1
1 748 . 10 1 1 A 73 73 ARG N N 277 126.709 126.465 0.244 1
1 749 . 10 1 1 A 75 75 HIS HA H 279 4.602 4.735 -0.133 1
1 754 . 10 1 1 A 75 75 HIS CA C 279 55.840 56.914 -1.074 1
1 755 . 10 1 1 A 75 75 HIS CB C 279 30.426 32.506 -2.080 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 0 0.000 1
2 1 1 1 "RMS(OBS, PRED)" CA 53 1.458 1
3 1 1 1 "RMS(OBS, PRED)" CB 50 1.036 1
4 1 1 1 "RMS(OBS, PRED)" H 49 0.444 1
5 1 1 1 "RMS(OBS, PRED)" HA 56 0.225 1
6 1 1 1 "RMS(OBS, PRED)" N 49 2.509 1
7 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1
8 1 2 1 "RMS(OBS, PRED)" CA 53 1.273 1
9 1 2 1 "RMS(OBS, PRED)" CB 50 1.238 1
10 1 2 1 "RMS(OBS, PRED)" H 49 0.455 1
11 1 2 1 "RMS(OBS, PRED)" HA 56 0.235 1
12 1 2 1 "RMS(OBS, PRED)" N 49 2.514 1
13 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1
14 1 3 1 "RMS(OBS, PRED)" CA 53 1.332 1
15 1 3 1 "RMS(OBS, PRED)" CB 50 1.161 1
16 1 3 1 "RMS(OBS, PRED)" H 49 0.460 1
17 1 3 1 "RMS(OBS, PRED)" HA 56 0.251 1
18 1 3 1 "RMS(OBS, PRED)" N 49 2.452 1
19 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1
20 1 4 1 "RMS(OBS, PRED)" CA 53 1.357 1
21 1 4 1 "RMS(OBS, PRED)" CB 50 1.061 1
22 1 4 1 "RMS(OBS, PRED)" H 49 0.430 1
23 1 4 1 "RMS(OBS, PRED)" HA 56 0.208 1
24 1 4 1 "RMS(OBS, PRED)" N 49 2.571 1
25 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1
26 1 5 1 "RMS(OBS, PRED)" CA 53 1.441 1
27 1 5 1 "RMS(OBS, PRED)" CB 50 0.959 1
28 1 5 1 "RMS(OBS, PRED)" H 49 0.439 1
29 1 5 1 "RMS(OBS, PRED)" HA 56 0.237 1
30 1 5 1 "RMS(OBS, PRED)" N 49 2.508 1
31 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1
32 1 6 1 "RMS(OBS, PRED)" CA 53 1.401 1
33 1 6 1 "RMS(OBS, PRED)" CB 50 1.083 1
34 1 6 1 "RMS(OBS, PRED)" H 49 0.474 1
35 1 6 1 "RMS(OBS, PRED)" HA 56 0.232 1
36 1 6 1 "RMS(OBS, PRED)" N 49 2.436 1
37 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1
38 1 7 1 "RMS(OBS, PRED)" CA 53 1.327 1
39 1 7 1 "RMS(OBS, PRED)" CB 50 1.028 1
40 1 7 1 "RMS(OBS, PRED)" H 49 0.447 1
41 1 7 1 "RMS(OBS, PRED)" HA 56 0.261 1
42 1 7 1 "RMS(OBS, PRED)" N 49 2.502 1
43 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1
44 1 8 1 "RMS(OBS, PRED)" CA 53 1.352 1
45 1 8 1 "RMS(OBS, PRED)" CB 50 1.149 1
46 1 8 1 "RMS(OBS, PRED)" H 49 0.444 1
47 1 8 1 "RMS(OBS, PRED)" HA 56 0.258 1
48 1 8 1 "RMS(OBS, PRED)" N 49 2.411 1
49 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1
50 1 9 1 "RMS(OBS, PRED)" CA 53 1.380 1
51 1 9 1 "RMS(OBS, PRED)" CB 50 1.023 1
52 1 9 1 "RMS(OBS, PRED)" H 49 0.454 1
53 1 9 1 "RMS(OBS, PRED)" HA 56 0.238 1
54 1 9 1 "RMS(OBS, PRED)" N 49 2.740 1
55 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1
56 1 10 1 "RMS(OBS, PRED)" CA 53 1.309 1
57 1 10 1 "RMS(OBS, PRED)" CB 50 1.093 1
58 1 10 1 "RMS(OBS, PRED)" H 49 0.450 1
59 1 10 1 "RMS(OBS, PRED)" HA 56 0.253 1
60 1 10 1 "RMS(OBS, PRED)" N 49 2.320 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
1 143 . 1 1 A 21 21 LYS H H 225 8.503 8.578 -0.075 2
1 144 . 1 1 A 21 21 LYS HA H 225 4.349 4.359 -0.010 2
1 152 . 1 1 A 21 21 LYS CA C 225 54.872 57.025 -2.153 2
1 153 . 1 1 A 21 21 LYS CB C 225 31.667 32.805 -1.138 2
1 157 . 1 1 A 21 21 LYS N N 225 122.563 124.445 -1.882 2
1 158 . 1 1 A 22 22 GLU H H 226 7.688 7.799 -0.111 2
1 159 . 1 1 A 22 22 GLU HA H 226 4.264 4.759 -0.495 2
1 163 . 1 1 A 22 22 GLU CA C 226 55.728 55.805 -0.077 2
1 164 . 1 1 A 22 22 GLU CB C 226 30.636 31.699 -1.063 2
1 166 . 1 1 A 22 22 GLU N N 226 119.810 119.372 0.438 2
1 167 . 1 1 A 23 23 ILE H H 227 8.111 8.382 -0.271 2
1 168 . 1 1 A 23 23 ILE HA H 227 4.498 4.589 -0.091 2
1 178 . 1 1 A 23 23 ILE CA C 227 60.027 60.216 -0.189 2
1 179 . 1 1 A 23 23 ILE CB C 227 38.370 39.395 -1.025 2
1 183 . 1 1 A 23 23 ILE N N 227 122.085 125.356 -3.271 2
1 184 . 1 1 A 24 24 PHE H H 228 7.818 8.365 -0.547 2
1 185 . 1 1 A 24 24 PHE HA H 228 5.467 5.208 0.259 2
1 193 . 1 1 A 24 24 PHE CA C 228 54.551 55.872 -1.321 2
1 194 . 1 1 A 24 24 PHE CB C 228 41.685 41.365 0.320 2
1 200 . 1 1 A 24 24 PHE N N 228 118.840 123.064 -4.224 2
1 201 . 1 1 A 25 25 LEU H H 229 9.271 8.903 0.368 2
1 202 . 1 1 A 25 25 LEU HA H 229 4.953 5.217 -0.264 2
1 212 . 1 1 A 25 25 LEU CA C 229 52.892 53.544 -0.652 2
1 213 . 1 1 A 25 25 LEU CB C 229 44.755 44.725 0.030 2
1 217 . 1 1 A 25 25 LEU N N 229 123.803 120.598 3.205 2
1 218 . 1 1 A 26 26 THR H H 230 8.493 8.981 -0.488 2
1 219 . 1 1 A 26 26 THR HA H 230 5.104 5.157 -0.053 2
1 224 . 1 1 A 26 26 THR CA C 230 61.771 61.791 -0.020 2
1 225 . 1 1 A 26 26 THR CB C 230 68.733 69.724 -0.991 2
1 227 . 1 1 A 26 26 THR N N 230 121.119 119.409 1.710 2
1 228 . 1 1 A 27 27 VAL H H 231 9.001 8.721 0.280 2
1 229 . 1 1 A 27 27 VAL HA H 231 4.600 4.558 0.042 2
1 237 . 1 1 A 27 27 VAL CA C 231 56.940 59.313 -2.373 2
1 238 . 1 1 A 27 27 VAL CB C 231 33.730 32.810 0.920 2
1 241 . 1 1 A 27 27 VAL N N 231 124.749 127.090 -2.341 2
1 242 . 1 1 A 28 28 PRO HA H 232 4.661 4.809 -0.148 2
1 249 . 1 1 A 28 28 PRO CA C 232 62.233 62.672 -0.439 2
1 250 . 1 1 A 28 28 PRO CB C 232 31.667 31.619 0.048 2
1 253 . 1 1 A 29 29 VAL H H 233 8.171 8.104 0.067 2
1 254 . 1 1 A 29 29 VAL HA H 233 4.565 3.916 0.649 2
1 262 . 1 1 A 29 29 VAL CA C 233 60.027 63.739 -3.712 2
1 263 . 1 1 A 29 29 VAL CB C 233 32.699 31.290 1.409 2
1 266 . 1 1 A 29 29 VAL N N 233 116.136 121.174 -5.038 2
1 267 . 1 1 A 30 30 GLY H H 234 8.143 8.807 -0.664 2
1 268 . 1 1 A 30 30 GLY HA2 H 234 3.824 3.849 -0.026 2
1 269 . 1 1 A 30 30 GLY HA3 H 234 4.209 3.850 0.359 2
1 270 . 1 1 A 30 30 GLY CA C 234 44.635 47.164 -2.529 2
1 271 . 1 1 A 30 30 GLY N N 234 110.455 114.981 -4.526 2
1 272 . 1 1 A 32 32 GLY H H 236 8.305 8.311 -0.006 2
1 273 . 1 1 A 32 32 GLY HA2 H 236 3.836 4.165 -0.329 2
1 274 . 1 1 A 32 32 GLY HA3 H 236 4.103 4.165 -0.062 2
1 275 . 1 1 A 32 32 GLY CA C 236 44.635 46.125 -1.490 2
1 276 . 1 1 A 32 32 GLY N N 236 107.539 109.927 -2.388 2
1 277 . 1 1 A 33 33 GLU H H 237 7.583 8.190 -0.607 2
1 278 . 1 1 A 33 33 GLU HA H 237 4.564 4.530 0.034 2
1 283 . 1 1 A 33 33 GLU CA C 237 54.355 55.748 -1.393 2
1 284 . 1 1 A 33 33 GLU CB C 237 30.636 30.979 -0.343 2
1 286 . 1 1 A 33 33 GLU N N 237 120.218 121.474 -1.256 2
1 287 . 1 1 A 34 34 SER H H 238 8.630 8.679 -0.049 2
1 288 . 1 1 A 34 34 SER HA H 238 5.012 5.276 -0.264 2
1 291 . 1 1 A 34 34 SER CA C 238 56.915 56.571 0.344 2
1 292 . 1 1 A 34 34 SER CB C 238 64.663 65.483 -0.820 2
1 293 . 1 1 A 34 34 SER N N 238 116.390 115.347 1.043 2
1 294 . 1 1 A 35 35 LEU H H 239 8.838 8.782 0.056 2
1 295 . 1 1 A 35 35 LEU HA H 239 4.577 4.847 -0.270 2
1 305 . 1 1 A 35 35 LEU CA C 239 52.808 53.632 -0.824 2
1 306 . 1 1 A 35 35 LEU CB C 239 44.156 43.568 0.588 2
1 310 . 1 1 A 35 35 LEU N N 239 124.463 124.778 -0.315 2
1 311 . 1 1 A 36 36 ARG H H 240 8.526 8.817 -0.291 2
1 312 . 1 1 A 36 36 ARG HA H 240 5.077 4.853 0.224 2
1 318 . 1 1 A 36 36 ARG CA C 240 54.483 54.958 -0.475 2
1 319 . 1 1 A 36 36 ARG CB C 240 30.777 31.788 -1.011 2
1 322 . 1 1 A 36 36 ARG N N 240 124.891 124.318 0.573 2
1 323 . 1 1 A 37 37 LEU H H 241 9.179 8.640 0.539 2
1 324 . 1 1 A 37 37 LEU HA H 241 4.740 5.047 -0.307 2
1 334 . 1 1 A 37 37 LEU CA C 241 52.292 53.598 -1.306 2
1 335 . 1 1 A 37 37 LEU CB C 241 43.208 45.653 -2.445 2
1 339 . 1 1 A 37 37 LEU N N 241 126.203 128.682 -2.479 2
1 340 . 1 1 A 38 38 LEU H H 242 8.825 8.555 0.270 2
1 341 . 1 1 A 38 38 LEU HA H 242 4.371 4.672 -0.301 2
1 351 . 1 1 A 38 38 LEU CA C 242 54.508 54.591 -0.083 2
1 352 . 1 1 A 38 38 LEU CB C 242 41.583 42.177 -0.594 2
1 356 . 1 1 A 38 38 LEU N N 242 124.999 127.502 -2.503 2
1 357 . 1 1 A 39 39 ALA H H 243 8.634 9.235 -0.601 2
1 358 . 1 1 A 39 39 ALA HA H 243 3.799 4.038 -0.239 2
1 362 . 1 1 A 39 39 ALA CA C 243 54.852 55.078 -0.226 2
1 363 . 1 1 A 39 39 ALA CB C 243 18.243 18.400 -0.157 2
1 364 . 1 1 A 39 39 ALA N N 243 125.146 125.869 -0.723 2
1 365 . 1 1 A 40 40 SER H H 244 8.414 8.181 0.233 2
1 366 . 1 1 A 40 40 SER HA H 244 4.074 4.272 -0.198 2
1 369 . 1 1 A 40 40 SER CA C 244 58.977 60.884 -1.907 2
1 370 . 1 1 A 40 40 SER CB C 244 61.561 62.975 -1.414 2
1 371 . 1 1 A 40 40 SER N N 244 109.494 112.484 -2.990 2
1 372 . 1 1 A 41 41 ASP H H 245 7.434 7.862 -0.428 2
1 373 . 1 1 A 41 41 ASP HA H 245 4.809 4.888 -0.080 2
1 376 . 1 1 A 41 41 ASP CA C 245 52.990 53.206 -0.216 2
1 377 . 1 1 A 41 41 ASP CB C 245 41.792 41.733 0.059 2
1 378 . 1 1 A 41 41 ASP N N 245 120.452 119.797 0.655 2
1 379 . 1 1 A 42 42 LEU H H 246 7.338 8.214 -0.876 2
1 380 . 1 1 A 42 42 LEU HA H 246 4.098 4.287 -0.190 2
1 389 . 1 1 A 42 42 LEU CA C 246 55.068 55.715 -0.648 2
1 390 . 1 1 A 42 42 LEU CB C 246 41.861 42.072 -0.211 2
1 393 . 1 1 A 42 42 LEU N N 246 121.293 122.992 -1.699 2
1 394 . 1 1 A 43 43 GLN H H 247 8.170 8.630 -0.460 2
1 395 . 1 1 A 43 43 GLN HA H 247 4.532 4.344 0.188 2
1 401 . 1 1 A 43 43 GLN CA C 247 53.005 55.475 -2.470 2
1 402 . 1 1 A 43 43 GLN CB C 247 30.978 29.128 1.850 2
1 404 . 1 1 A 43 43 GLN N N 247 122.477 126.251 -3.774 2
1 406 . 1 1 A 44 44 ARG HA H 248 3.753 3.936 -0.183 2
1 412 . 1 1 A 44 44 ARG CA C 248 59.812 59.165 0.647 2
1 413 . 1 1 A 44 44 ARG CB C 248 29.306 30.122 -0.816 2
1 416 . 1 1 A 45 45 HIS H H 249 8.364 8.341 0.023 2
1 417 . 1 1 A 45 45 HIS HA H 249 4.294 4.287 0.007 2
1 422 . 1 1 A 45 45 HIS CA C 249 58.462 59.215 -0.753 2
1 423 . 1 1 A 45 45 HIS CB C 249 29.071 28.448 0.624 2
1 424 . 1 1 A 45 45 HIS N N 249 114.528 117.256 -2.728 2
1 425 . 1 1 A 46 46 SER H H 250 7.020 7.587 -0.567 2
1 426 . 1 1 A 46 46 SER HA H 250 4.153 4.167 -0.014 2
1 428 . 1 1 A 46 46 SER CA C 250 59.493 61.682 -2.189 2
1 429 . 1 1 A 46 46 SER CB C 250 62.071 62.851 -0.780 2
1 430 . 1 1 A 46 46 SER N N 250 113.900 115.218 -1.318 2
1 431 . 1 1 A 47 47 ILE H H 251 7.106 7.368 -0.262 2
1 432 . 1 1 A 47 47 ILE HA H 251 3.994 4.067 -0.073 2
1 441 . 1 1 A 47 47 ILE CA C 251 60.337 62.643 -2.306 2
1 442 . 1 1 A 47 47 ILE CB C 251 36.727 38.275 -1.548 2
1 446 . 1 1 A 47 47 ILE N N 251 115.759 119.989 -4.230 2
1 447 . 1 1 A 48 48 ALA H H 252 8.117 7.639 0.478 2
1 448 . 1 1 A 48 48 ALA HA H 252 3.979 4.239 -0.260 2
1 452 . 1 1 A 48 48 ALA CA C 252 53.821 52.819 1.002 2
1 453 . 1 1 A 48 48 ALA CB C 252 17.727 18.834 -1.107 2
1 454 . 1 1 A 48 48 ALA N N 252 120.091 123.117 -3.026 2
1 455 . 1 1 A 49 49 GLN H H 253 7.346 7.989 -0.643 2
1 456 . 1 1 A 49 49 GLN HA H 253 4.324 4.370 -0.046 2
1 463 . 1 1 A 49 49 GLN CA C 253 54.552 55.293 -0.741 2
1 464 . 1 1 A 49 49 GLN CB C 253 28.255 28.710 -0.456 2
1 466 . 1 1 A 49 49 GLN N N 253 112.219 114.741 -2.522 2
1 468 . 1 1 A 50 50 LEU H H 254 7.243 7.297 -0.054 2
1 469 . 1 1 A 50 50 LEU HA H 254 4.198 4.439 -0.240 2
1 479 . 1 1 A 50 50 LEU CA C 254 53.971 54.523 -0.552 2
1 480 . 1 1 A 50 50 LEU CB C 254 41.662 42.411 -0.749 2
1 484 . 1 1 A 50 50 LEU N N 254 120.510 122.316 -1.805 2
1 485 . 1 1 A 51 51 ASP H H 255 8.210 8.528 -0.318 2
1 486 . 1 1 A 51 51 ASP HA H 255 4.664 5.069 -0.405 2
1 489 . 1 1 A 51 51 ASP CA C 255 52.490 51.380 1.110 2
1 490 . 1 1 A 51 51 ASP CB C 255 40.259 41.491 -1.232 2
1 491 . 1 1 A 51 51 ASP N N 255 119.691 119.766 -0.075 2
1 492 . 1 1 A 52 52 PRO HA H 256 4.125 4.318 -0.193 2
1 499 . 1 1 A 52 52 PRO CA C 256 65.380 65.687 -0.307 2
1 500 . 1 1 A 52 52 PRO CB C 256 31.865 31.729 0.136 2
1 503 . 1 1 A 53 53 GLU H H 257 8.432 8.363 0.069 2
1 504 . 1 1 A 53 53 GLU HA H 257 4.073 4.111 -0.038 2
1 508 . 1 1 A 53 53 GLU CA C 257 58.677 59.447 -0.770 2
1 509 . 1 1 A 53 53 GLU CB C 257 28.771 29.248 -0.477 2
1 511 . 1 1 A 53 53 GLU N N 257 119.483 118.204 1.279 2
1 512 . 1 1 A 54 54 ALA H H 258 7.967 7.774 0.193 2
1 513 . 1 1 A 54 54 ALA HA H 258 4.240 4.037 0.203 2
1 517 . 1 1 A 54 54 ALA CA C 258 54.552 55.226 -0.674 2
1 518 . 1 1 A 54 54 ALA CB C 258 18.699 18.446 0.253 2
1 519 . 1 1 A 54 54 ALA N N 258 124.293 122.577 1.716 2
1 520 . 1 1 A 55 55 LEU H H 259 8.695 8.294 0.400 2
1 521 . 1 1 A 55 55 LEU HA H 259 3.902 3.949 -0.047 2
1 530 . 1 1 A 55 55 LEU CA C 259 57.130 58.006 -0.876 2
1 531 . 1 1 A 55 55 LEU CB C 259 41.192 41.704 -0.512 2
1 535 . 1 1 A 55 55 LEU N N 259 118.361 118.696 -0.335 2
1 536 . 1 1 A 56 56 GLY H H 260 8.177 7.920 0.257 2
1 537 . 1 1 A 56 56 GLY HA2 H 260 3.723 3.748 -0.026 2
1 538 . 1 1 A 56 56 GLY HA3 H 260 3.971 3.749 0.222 2
1 539 . 1 1 A 56 56 GLY CA C 260 46.302 47.369 -1.067 2
1 540 . 1 1 A 56 56 GLY N N 260 105.789 106.532 -0.743 2
1 541 . 1 1 A 57 57 ASN H H 261 7.914 7.573 0.341 2
1 542 . 1 1 A 57 57 ASN HA H 261 4.643 4.441 0.203 2
1 547 . 1 1 A 57 57 ASN CA C 261 54.945 55.571 -0.626 2
1 548 . 1 1 A 57 57 ASN CB C 261 37.533 38.155 -0.622 2
1 549 . 1 1 A 57 57 ASN N N 261 121.132 120.069 1.063 2
1 551 . 1 1 A 58 58 ILE H H 262 8.732 7.933 0.799 2
1 552 . 1 1 A 58 58 ILE HA H 262 3.712 3.651 0.061 2
1 562 . 1 1 A 58 58 ILE CA C 262 63.820 65.053 -1.233 2
1 563 . 1 1 A 58 58 ILE CB C 262 35.990 37.924 -1.934 2
1 567 . 1 1 A 58 58 ILE N N 262 125.309 120.710 4.599 2
1 568 . 1 1 A 59 59 LYS H H 263 8.416 8.068 0.348 2
1 569 . 1 1 A 59 59 LYS HA H 263 4.075 3.859 0.216 2
1 577 . 1 1 A 59 59 LYS CA C 263 59.708 60.496 -0.788 2
1 578 . 1 1 A 59 59 LYS CB C 263 31.343 32.347 -1.004 2
1 582 . 1 1 A 59 59 LYS N N 263 122.080 118.761 3.319 2
1 583 . 1 1 A 60 60 LYS H H 264 7.793 7.648 0.145 2
1 584 . 1 1 A 60 60 LYS HA H 264 4.036 4.047 -0.011 2
1 591 . 1 1 A 60 60 LYS CA C 264 59.708 59.078 0.630 2
1 592 . 1 1 A 60 60 LYS CB C 264 31.865 31.844 0.021 2
1 596 . 1 1 A 60 60 LYS N N 264 119.503 119.083 0.420 2
1 597 . 1 1 A 61 61 LEU H H 265 7.797 7.891 -0.094 2
1 598 . 1 1 A 61 61 LEU HA H 265 4.106 4.034 0.072 2
1 608 . 1 1 A 61 61 LEU CA C 265 57.646 58.173 -0.527 2
1 609 . 1 1 A 61 61 LEU CB C 265 40.177 41.530 -1.353 2
1 613 . 1 1 A 61 61 LEU N N 265 121.392 122.094 -0.702 2
1 614 . 1 1 A 62 62 SER H H 266 8.775 8.097 0.678 2
1 615 . 1 1 A 62 62 SER HA H 266 4.001 4.199 -0.198 2
1 619 . 1 1 A 62 62 SER CA C 266 60.224 61.296 -1.072 2
1 620 . 1 1 A 62 62 SER CB C 266 62.758 62.935 -0.177 2
1 621 . 1 1 A 62 62 SER N N 266 112.902 114.831 -1.929 2
1 622 . 1 1 A 63 63 ASN H H 267 8.199 8.090 0.109 2
1 623 . 1 1 A 63 63 ASN HA H 267 4.393 4.378 0.015 2
1 628 . 1 1 A 63 63 ASN CA C 267 55.583 56.595 -1.012 2
1 629 . 1 1 A 63 63 ASN CB C 267 37.537 38.779 -1.242 2
1 630 . 1 1 A 63 63 ASN N N 267 117.813 119.851 -2.038 2
1 632 . 1 1 A 64 64 ARG H H 268 8.000 7.848 0.152 2
1 633 . 1 1 A 64 64 ARG HA H 268 4.118 4.161 -0.043 2
1 640 . 1 1 A 64 64 ARG CA C 268 57.646 58.722 -1.076 2
1 641 . 1 1 A 64 64 ARG CB C 268 29.307 30.023 -0.716 2
1 644 . 1 1 A 64 64 ARG N N 268 120.911 120.157 0.754 2
1 645 . 1 1 A 65 65 LEU H H 269 9.119 7.875 1.244 2
1 646 . 1 1 A 65 65 LEU HA H 269 3.916 4.077 -0.162 2
1 656 . 1 1 A 65 65 LEU CA C 269 57.124 58.035 -0.911 2
1 657 . 1 1 A 65 65 LEU CB C 269 41.662 41.390 0.272 2
1 661 . 1 1 A 65 65 LEU N N 269 119.046 120.966 -1.920 2
1 662 . 1 1 A 66 66 ALA H H 270 8.245 8.524 -0.279 2
1 663 . 1 1 A 66 66 ALA HA H 270 3.997 3.938 0.059 2
1 667 . 1 1 A 66 66 ALA CA C 270 54.337 55.072 -0.735 2
1 668 . 1 1 A 66 66 ALA CB C 270 16.696 18.177 -1.481 2
1 669 . 1 1 A 66 66 ALA N N 270 121.047 121.164 -0.117 2
1 670 . 1 1 A 67 67 GLN H H 271 7.704 7.660 0.043 2
1 671 . 1 1 A 67 67 GLN HA H 271 4.025 4.022 0.003 2
1 678 . 1 1 A 67 67 GLN CA C 271 58.418 58.960 -0.542 2
1 679 . 1 1 A 67 67 GLN CB C 271 27.996 28.339 -0.343 2
1 681 . 1 1 A 67 67 GLN N N 271 118.440 117.611 0.829 2
1 683 . 1 1 A 68 68 ILE H H 272 8.142 7.845 0.297 2
1 684 . 1 1 A 68 68 ILE HA H 272 3.723 3.692 0.031 2
1 694 . 1 1 A 68 68 ILE CA C 272 64.605 65.216 -0.611 2
1 695 . 1 1 A 68 68 ILE CB C 272 37.793 37.781 0.012 2
1 699 . 1 1 A 68 68 ILE N N 272 119.521 119.631 -0.110 2
1 700 . 1 1 A 69 69 CYS H H 273 8.817 8.117 0.700 2
1 701 . 1 1 A 69 69 CYS HA H 273 3.958 4.282 -0.324 2
1 704 . 1 1 A 69 69 CYS CA C 273 64.204 61.135 3.069 2
1 705 . 1 1 A 69 69 CYS CB C 273 26.337 26.963 -0.626 2
1 706 . 1 1 A 69 69 CYS N N 273 117.234 119.512 -2.278 2
1 707 . 1 1 A 70 70 SER H H 274 7.880 7.771 0.109 2
1 708 . 1 1 A 70 70 SER HA H 274 4.246 4.333 -0.087 2
1 710 . 1 1 A 70 70 SER CA C 274 60.008 60.835 -0.827 2
1 711 . 1 1 A 70 70 SER CB C 274 62.071 63.172 -1.101 2
1 712 . 1 1 A 70 70 SER N N 274 114.227 115.885 -1.658 2
1 713 . 1 1 A 71 71 SER H H 275 7.609 7.714 -0.105 2
1 714 . 1 1 A 71 71 SER HA H 275 4.564 4.478 0.086 2
1 717 . 1 1 A 71 71 SER CA C 275 57.946 58.979 -1.033 2
1 718 . 1 1 A 71 71 SER CB C 275 63.618 63.665 -0.047 2
1 719 . 1 1 A 71 71 SER N N 275 114.958 113.480 1.478 2
1 720 . 1 1 A 72 72 ILE H H 276 7.357 7.535 -0.178 2
1 721 . 1 1 A 72 72 ILE HA H 276 4.169 4.224 -0.055 2
1 731 . 1 1 A 72 72 ILE CA C 276 60.967 60.861 0.106 2
1 732 . 1 1 A 72 72 ILE CB C 276 38.276 39.244 -0.968 2
1 736 . 1 1 A 72 72 ILE N N 276 123.513 122.679 0.834 2
1 737 . 1 1 A 73 73 ARG H H 277 8.508 8.656 -0.148 2
1 738 . 1 1 A 73 73 ARG HA H 277 4.446 4.829 -0.383 2
1 744 . 1 1 A 73 73 ARG CA C 277 55.324 54.861 0.463 2
1 745 . 1 1 A 73 73 ARG CB C 277 30.499 31.903 -1.404 2
1 748 . 1 1 A 73 73 ARG N N 277 126.709 126.409 0.300 2
1 749 . 1 1 A 75 75 HIS HA H 279 4.602 4.649 -0.047 2
1 754 . 1 1 A 75 75 HIS CA C 279 55.840 56.604 -0.764 2
1 755 . 1 1 A 75 75 HIS CB C 279 30.426 30.712 -0.286 2
stop_
save_