data_15614_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15614
_Entry.PDB_ID 2JZB
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 216 . 1 1 1 A 20 20 ASP H H 250 8.550 8.845 -0.295 1
1 217 . 1 1 1 A 20 20 ASP HA H 250 4.700 4.442 0.258 1
1 220 . 1 1 1 A 20 20 ASP CA C 250 52.650 52.734 -0.084 1
1 221 . 1 1 1 A 20 20 ASP CB C 250 41.420 40.607 0.813 1
1 222 . 1 1 1 A 20 20 ASP N N 250 125.190 123.958 1.232 1
1 223 . 1 1 1 A 21 21 PRO HA H 251 4.250 4.452 -0.202 1
1 230 . 1 1 1 A 21 21 PRO CA C 251 65.120 64.592 0.528 1
1 231 . 1 1 1 A 21 21 PRO CB C 251 32.310 32.162 0.148 1
1 234 . 1 1 1 A 22 22 ILE H H 252 8.630 7.726 0.904 1
1 235 . 1 1 1 A 22 22 ILE HA H 252 4.060 3.920 0.140 1
1 245 . 1 1 1 A 22 22 ILE CA C 252 62.990 63.116 -0.126 1
1 246 . 1 1 1 A 22 22 ILE CB C 252 37.520 37.687 -0.167 1
1 250 . 1 1 1 A 22 22 ILE N N 252 119.860 116.862 2.998 1
1 251 . 1 1 1 A 23 23 LEU H H 253 7.950 7.777 0.173 1
1 252 . 1 1 1 A 23 23 LEU HA H 253 3.710 4.151 -0.441 1
1 262 . 1 1 1 A 23 23 LEU CA C 253 56.510 57.871 -1.361 1
1 263 . 1 1 1 A 23 23 LEU CB C 253 41.190 41.820 -0.630 1
1 266 . 1 1 1 A 23 23 LEU N N 253 116.850 121.437 -4.587 1
1 267 . 1 1 1 A 24 24 LEU H H 254 7.370 8.018 -0.648 1
1 268 . 1 1 1 A 24 24 LEU HA H 254 4.310 4.392 -0.082 1
1 278 . 1 1 1 A 24 24 LEU CA C 254 54.890 57.880 -2.990 1
1 279 . 1 1 1 A 24 24 LEU CB C 254 41.960 41.400 0.560 1
1 283 . 1 1 1 A 24 24 LEU N N 254 115.210 119.371 -4.161 1
1 284 . 1 1 1 A 25 25 ARG H H 255 7.520 7.732 -0.212 1
1 285 . 1 1 1 A 25 25 ARG HA H 255 4.660 4.250 0.410 1
1 293 . 1 1 1 A 25 25 ARG CA C 255 52.840 54.497 -1.657 1
1 294 . 1 1 1 A 25 25 ARG CB C 255 28.130 29.932 -1.802 1
1 297 . 1 1 1 A 25 25 ARG N N 255 118.180 120.021 -1.841 1
1 298 . 1 1 1 A 26 26 PRO HA H 256 4.800 4.971 -0.171 1
1 305 . 1 1 1 A 26 26 PRO CA C 256 61.790 62.708 -0.918 1
1 306 . 1 1 1 A 26 26 PRO CB C 256 32.660 32.098 0.562 1
1 309 . 1 1 1 A 27 27 VAL H H 257 8.170 8.399 -0.229 1
1 310 . 1 1 1 A 27 27 VAL HA H 257 3.590 3.747 -0.157 1
1 318 . 1 1 1 A 27 27 VAL CA C 257 64.830 65.398 -0.568 1
1 319 . 1 1 1 A 27 27 VAL CB C 257 31.720 31.410 0.310 1
1 322 . 1 1 1 A 27 27 VAL N N 257 115.710 124.379 -8.669 1
1 323 . 1 1 1 A 28 28 ASP H H 258 8.240 8.099 0.141 1
1 324 . 1 1 1 A 28 28 ASP HA H 258 4.340 4.419 -0.079 1
1 327 . 1 1 1 A 28 28 ASP CA C 258 56.490 57.257 -0.767 1
1 328 . 1 1 1 A 28 28 ASP CB C 258 40.520 40.257 0.263 1
1 329 . 1 1 1 A 28 28 ASP N N 258 119.000 121.543 -2.543 1
1 330 . 1 1 1 A 29 29 ASP H H 259 8.000 9.134 -1.134 1
1 331 . 1 1 1 A 29 29 ASP HA H 259 4.390 4.414 -0.024 1
1 334 . 1 1 1 A 29 29 ASP CA C 259 56.210 56.205 0.005 1
1 335 . 1 1 1 A 29 29 ASP CB C 259 40.670 41.432 -0.762 1
1 336 . 1 1 1 A 29 29 ASP N N 259 118.900 118.489 0.411 1
1 337 . 1 1 1 A 30 30 LEU H H 260 7.760 7.206 0.554 1
1 338 . 1 1 1 A 30 30 LEU HA H 260 3.990 4.222 -0.232 1
1 348 . 1 1 1 A 30 30 LEU CA C 260 55.000 55.683 -0.683 1
1 349 . 1 1 1 A 30 30 LEU CB C 260 41.670 42.132 -0.462 1
1 353 . 1 1 1 A 30 30 LEU N N 260 116.300 121.441 -5.141 1
1 354 . 1 1 1 A 31 31 GLU H H 261 7.990 8.891 -0.901 1
1 355 . 1 1 1 A 31 31 GLU HA H 261 4.280 4.041 0.239 1
1 358 . 1 1 1 A 31 31 GLU CA C 261 56.860 59.505 -2.645 1
1 359 . 1 1 1 A 31 31 GLU CB C 261 27.010 29.547 -2.537 1
1 360 . 1 1 1 A 31 31 GLU N N 261 115.620 125.018 -9.398 1
1 361 . 1 1 1 A 32 32 LEU H H 262 8.000 7.343 0.657 1
1 362 . 1 1 1 A 32 32 LEU HA H 262 4.400 4.254 0.146 1
1 372 . 1 1 1 A 32 32 LEU CA C 262 53.860 54.990 -1.130 1
1 373 . 1 1 1 A 32 32 LEU CB C 262 44.450 42.299 2.151 1
1 377 . 1 1 1 A 32 32 LEU N N 262 118.860 122.370 -3.510 1
1 378 . 1 1 1 A 33 33 THR H H 263 10.020 8.584 1.436 1
1 379 . 1 1 1 A 33 33 THR HA H 263 4.130 4.473 -0.343 1
1 384 . 1 1 1 A 33 33 THR CA C 263 62.400 61.214 1.186 1
1 385 . 1 1 1 A 33 33 THR CB C 263 71.270 70.945 0.325 1
1 387 . 1 1 1 A 33 33 THR N N 263 114.610 114.892 -0.282 1
1 388 . 1 1 1 A 34 34 VAL H H 264 8.370 8.765 -0.395 1
1 389 . 1 1 1 A 34 34 VAL HA H 264 3.620 3.616 0.004 1
1 397 . 1 1 1 A 34 34 VAL CA C 264 66.340 66.592 -0.252 1
1 398 . 1 1 1 A 34 34 VAL CB C 264 31.670 31.663 0.007 1
1 401 . 1 1 1 A 34 34 VAL N N 264 122.110 122.431 -0.321 1
1 402 . 1 1 1 A 35 35 ARG H H 265 8.190 7.853 0.337 1
1 403 . 1 1 1 A 35 35 ARG HA H 265 4.070 3.960 0.110 1
1 411 . 1 1 1 A 35 35 ARG CA C 265 59.470 59.795 -0.325 1
1 412 . 1 1 1 A 35 35 ARG CB C 265 29.790 29.956 -0.166 1
1 415 . 1 1 1 A 35 35 ARG N N 265 117.340 121.244 -3.904 1
1 416 . 1 1 1 A 36 36 SER H H 266 7.610 7.739 -0.129 1
1 417 . 1 1 1 A 36 36 SER HA H 266 4.080 4.498 -0.418 1
1 420 . 1 1 1 A 36 36 SER CA C 266 63.080 61.615 1.465 1
1 421 . 1 1 1 A 36 36 SER CB C 266 63.280 63.026 0.254 1
1 422 . 1 1 1 A 36 36 SER N N 266 116.710 113.841 2.869 1
1 423 . 1 1 1 A 37 37 ALA H H 267 8.720 7.915 0.805 1
1 424 . 1 1 1 A 37 37 ALA HA H 267 3.760 4.072 -0.312 1
1 428 . 1 1 1 A 37 37 ALA CA C 267 55.900 55.100 0.800 1
1 429 . 1 1 1 A 37 37 ALA CB C 267 18.090 18.558 -0.468 1
1 430 . 1 1 1 A 37 37 ALA N N 267 124.170 122.538 1.632 1
1 431 . 1 1 1 A 38 38 ASN H H 268 8.850 9.386 -0.536 1
1 432 . 1 1 1 A 38 38 ASN HA H 268 4.420 4.500 -0.080 1
1 437 . 1 1 1 A 38 38 ASN CA C 268 55.700 56.346 -0.646 1
1 438 . 1 1 1 A 38 38 ASN CB C 268 37.180 37.784 -0.604 1
1 439 . 1 1 1 A 38 38 ASN N N 268 117.370 117.285 0.085 1
1 441 . 1 1 1 A 39 39 CYS H H 269 7.970 7.999 -0.029 1
1 442 . 1 1 1 A 39 39 CYS HA H 269 4.190 4.120 0.070 1
1 445 . 1 1 1 A 39 39 CYS CA C 269 63.340 62.780 0.560 1
1 446 . 1 1 1 A 39 39 CYS CB C 269 26.870 27.975 -1.105 1
1 447 . 1 1 1 A 39 39 CYS N N 269 120.510 118.716 1.794 1
1 448 . 1 1 1 A 40 40 LEU H H 270 7.600 7.685 -0.085 1
1 449 . 1 1 1 A 40 40 LEU HA H 270 3.880 3.907 -0.027 1
1 458 . 1 1 1 A 40 40 LEU CA C 270 57.810 57.923 -0.113 1
1 459 . 1 1 1 A 40 40 LEU CB C 270 40.030 41.222 -1.192 1
1 462 . 1 1 1 A 40 40 LEU N N 270 117.710 120.185 -2.475 1
1 463 . 1 1 1 A 41 41 LYS H H 271 7.980 9.015 -1.035 1
1 464 . 1 1 1 A 41 41 LYS HA H 271 3.820 4.352 -0.532 1
1 472 . 1 1 1 A 41 41 LYS CA C 271 59.840 59.094 0.746 1
1 473 . 1 1 1 A 41 41 LYS CB C 271 32.070 32.179 -0.109 1
1 476 . 1 1 1 A 41 41 LYS N N 271 120.070 120.253 -0.183 1
1 477 . 1 1 1 A 42 42 ALA H H 272 7.860 8.287 -0.427 1
1 478 . 1 1 1 A 42 42 ALA HA H 272 4.140 4.074 0.066 1
1 482 . 1 1 1 A 42 42 ALA CA C 272 54.670 54.551 0.119 1
1 483 . 1 1 1 A 42 42 ALA CB C 272 17.950 18.549 -0.599 1
1 484 . 1 1 1 A 42 42 ALA N N 272 122.880 121.718 1.162 1
1 485 . 1 1 1 A 43 43 GLU H H 273 7.210 8.102 -0.892 1
1 486 . 1 1 1 A 43 43 GLU HA H 273 4.260 4.442 -0.182 1
1 491 . 1 1 1 A 43 43 GLU CA C 273 55.020 56.007 -0.987 1
1 492 . 1 1 1 A 43 43 GLU CB C 273 29.880 29.366 0.514 1
1 494 . 1 1 1 A 43 43 GLU N N 273 116.590 115.501 1.089 1
1 495 . 1 1 1 A 44 44 ALA H H 274 7.880 8.172 -0.292 1
1 496 . 1 1 1 A 44 44 ALA HA H 274 3.680 3.945 -0.265 1
1 500 . 1 1 1 A 44 44 ALA CA C 274 52.960 53.206 -0.246 1
1 501 . 1 1 1 A 44 44 ALA CB C 274 16.110 17.203 -1.093 1
1 502 . 1 1 1 A 44 44 ALA N N 274 118.420 118.877 -0.457 1
1 503 . 1 1 1 A 45 45 ILE H H 275 7.600 7.309 0.291 1
1 504 . 1 1 1 A 45 45 ILE HA H 275 3.870 4.574 -0.704 1
1 514 . 1 1 1 A 45 45 ILE CA C 275 61.150 60.392 0.758 1
1 515 . 1 1 1 A 45 45 ILE CB C 275 37.090 40.167 -3.077 1
1 519 . 1 1 1 A 45 45 ILE N N 275 120.370 118.330 2.040 1
1 520 . 1 1 1 A 46 46 HIS H H 276 8.350 8.684 -0.334 1
1 521 . 1 1 1 A 46 46 HIS HA H 276 4.600 4.938 -0.338 1
1 526 . 1 1 1 A 46 46 HIS CA C 276 56.900 55.688 1.212 1
1 527 . 1 1 1 A 46 46 HIS CB C 276 31.910 31.459 0.451 1
1 529 . 1 1 1 A 46 46 HIS N N 276 123.250 121.437 1.813 1
1 530 . 1 1 1 A 47 47 TYR H H 277 8.850 7.244 1.606 1
1 531 . 1 1 1 A 47 47 TYR HA H 277 5.100 4.593 0.507 1
1 538 . 1 1 1 A 47 47 TYR CA C 277 57.430 56.913 0.517 1
1 539 . 1 1 1 A 47 47 TYR CB C 277 40.680 39.818 0.862 1
1 544 . 1 1 1 A 47 47 TYR N N 277 119.700 118.214 1.486 1
1 545 . 1 1 1 A 48 48 ILE H H 278 9.380 8.385 0.995 1
1 546 . 1 1 1 A 48 48 ILE HA H 278 3.340 3.618 -0.278 1
1 554 . 1 1 1 A 48 48 ILE CA C 278 67.640 65.036 2.604 1
1 555 . 1 1 1 A 48 48 ILE CB C 278 36.310 37.587 -1.277 1
1 558 . 1 1 1 A 48 48 ILE N N 278 125.650 124.666 0.984 1
1 559 . 1 1 1 A 49 49 GLY H H 279 9.430 8.472 0.958 1
1 560 . 1 1 1 A 49 49 GLY HA2 H 279 2.370 2.525 -0.155 1
1 561 . 1 1 1 A 49 49 GLY HA3 H 279 3.230 3.680 -0.450 1
1 562 . 1 1 1 A 49 49 GLY CA C 279 46.820 47.019 -0.199 1
1 563 . 1 1 1 A 49 49 GLY N N 279 105.200 108.639 -3.439 1
1 564 . 1 1 1 A 50 50 ASP H H 280 7.050 7.955 -0.905 1
1 565 . 1 1 1 A 50 50 ASP HA H 280 4.360 4.122 0.238 1
1 568 . 1 1 1 A 50 50 ASP CA C 280 57.110 56.973 0.137 1
1 569 . 1 1 1 A 50 50 ASP CB C 280 42.620 41.885 0.735 1
1 570 . 1 1 1 A 50 50 ASP N N 280 116.360 121.363 -5.003 1
1 571 . 1 1 1 A 51 51 LEU H H 281 7.170 8.137 -0.967 1
1 572 . 1 1 1 A 51 51 LEU HA H 281 3.880 3.944 -0.064 1
1 582 . 1 1 1 A 51 51 LEU CA C 281 57.900 58.166 -0.266 1
1 583 . 1 1 1 A 51 51 LEU CB C 281 41.870 41.531 0.339 1
1 587 . 1 1 1 A 51 51 LEU N N 281 120.130 120.461 -0.331 1
1 588 . 1 1 1 A 52 52 VAL H H 282 7.820 7.699 0.121 1
1 589 . 1 1 1 A 52 52 VAL HA H 282 3.980 3.922 0.058 1
1 597 . 1 1 1 A 52 52 VAL CA C 282 64.000 65.286 -1.286 1
1 598 . 1 1 1 A 52 52 VAL CB C 282 30.400 31.270 -0.870 1
1 601 . 1 1 1 A 52 52 VAL N N 282 105.550 114.771 -9.221 1
1 602 . 1 1 1 A 53 53 GLN H H 283 6.550 7.747 -1.197 1
1 603 . 1 1 1 A 53 53 GLN HA H 283 4.680 4.210 0.470 1
1 610 . 1 1 1 A 53 53 GLN CA C 283 56.210 58.548 -2.338 1
1 611 . 1 1 1 A 53 53 GLN CB C 283 31.710 28.662 3.048 1
1 613 . 1 1 1 A 53 53 GLN N N 283 114.060 119.787 -5.727 1
1 615 . 1 1 1 A 54 54 ARG H H 284 7.690 7.559 0.131 1
1 616 . 1 1 1 A 54 54 ARG HA H 284 4.520 4.733 -0.213 1
1 624 . 1 1 1 A 54 54 ARG CA C 284 54.600 54.476 0.124 1
1 625 . 1 1 1 A 54 54 ARG CB C 284 30.750 32.910 -2.160 1
1 628 . 1 1 1 A 54 54 ARG N N 284 119.810 117.368 2.442 1
1 629 . 1 1 1 A 55 55 THR H H 285 8.110 8.800 -0.690 1
1 630 . 1 1 1 A 55 55 THR HA H 285 4.430 4.655 -0.225 1
1 635 . 1 1 1 A 55 55 THR CA C 285 59.640 60.664 -1.024 1
1 636 . 1 1 1 A 55 55 THR CB C 285 71.310 70.669 0.641 1
1 638 . 1 1 1 A 55 55 THR N N 285 108.450 113.970 -5.520 1
1 639 . 1 1 1 A 56 56 GLU H H 286 8.910 9.122 -0.212 1
1 640 . 1 1 1 A 56 56 GLU HA H 286 3.660 3.976 -0.316 1
1 645 . 1 1 1 A 56 56 GLU CA C 286 60.650 59.723 0.927 1
1 646 . 1 1 1 A 56 56 GLU CB C 286 29.400 29.179 0.221 1
1 648 . 1 1 1 A 56 56 GLU N N 286 120.600 122.091 -1.491 1
1 649 . 1 1 1 A 57 57 VAL H H 287 7.600 8.098 -0.498 1
1 650 . 1 1 1 A 57 57 VAL HA H 287 3.620 3.537 0.083 1
1 658 . 1 1 1 A 57 57 VAL CA C 287 66.020 67.155 -1.135 1
1 659 . 1 1 1 A 57 57 VAL CB C 287 31.720 31.609 0.111 1
1 662 . 1 1 1 A 57 57 VAL N N 287 114.050 120.662 -6.612 1
1 663 . 1 1 1 A 58 58 GLU H H 288 7.350 8.152 -0.802 1
1 664 . 1 1 1 A 58 58 GLU HA H 288 3.830 4.068 -0.238 1
1 669 . 1 1 1 A 58 58 GLU CA C 288 59.250 59.669 -0.419 1
1 670 . 1 1 1 A 58 58 GLU CB C 288 30.030 29.292 0.738 1
1 672 . 1 1 1 A 58 58 GLU N N 288 117.610 119.035 -1.425 1
1 673 . 1 1 1 A 59 59 LEU H H 289 7.850 7.740 0.110 1
1 674 . 1 1 1 A 59 59 LEU HA H 289 4.150 4.138 0.012 1
1 683 . 1 1 1 A 59 59 LEU CA C 289 57.340 57.170 0.170 1
1 684 . 1 1 1 A 59 59 LEU CB C 289 41.170 41.726 -0.556 1
1 687 . 1 1 1 A 59 59 LEU N N 289 120.050 120.469 -0.419 1
1 688 . 1 1 1 A 60 60 LEU H H 290 7.670 8.996 -1.326 1
1 689 . 1 1 1 A 60 60 LEU HA H 290 4.540 4.143 0.397 1
1 696 . 1 1 1 A 60 60 LEU CA C 290 55.090 56.637 -1.547 1
1 697 . 1 1 1 A 60 60 LEU CB C 290 42.320 41.535 0.785 1
1 701 . 1 1 1 A 60 60 LEU N N 290 114.980 119.374 -4.394 1
1 702 . 1 1 1 A 61 61 LYS H H 291 7.440 7.247 0.193 1
1 703 . 1 1 1 A 61 61 LYS HA H 291 4.280 4.306 -0.026 1
1 710 . 1 1 1 A 61 61 LYS CA C 291 56.860 56.629 0.231 1
1 711 . 1 1 1 A 61 61 LYS CB C 291 31.900 32.816 -0.916 1
1 714 . 1 1 1 A 61 61 LYS N N 291 118.120 116.294 1.826 1
1 715 . 1 1 1 A 62 62 THR H H 292 7.310 7.401 -0.091 1
1 716 . 1 1 1 A 62 62 THR HA H 292 5.220 4.759 0.461 1
1 721 . 1 1 1 A 62 62 THR CA C 292 55.830 57.771 -1.941 1
1 722 . 1 1 1 A 62 62 THR CB C 292 69.970 71.460 -1.490 1
1 724 . 1 1 1 A 62 62 THR N N 292 111.890 114.681 -2.791 1
1 725 . 1 1 1 A 63 63 PRO HA H 293 4.570 4.475 0.095 1
1 730 . 1 1 1 A 63 63 PRO CA C 293 63.710 64.569 -0.859 1
1 731 . 1 1 1 A 63 63 PRO CB C 293 32.380 32.011 0.369 1
1 733 . 1 1 1 A 64 64 ASN H H 294 8.050 8.968 -0.918 1
1 734 . 1 1 1 A 64 64 ASN HA H 294 4.490 4.451 0.039 1
1 739 . 1 1 1 A 64 64 ASN CA C 294 55.630 55.524 0.106 1
1 740 . 1 1 1 A 64 64 ASN CB C 294 38.730 38.275 0.455 1
1 741 . 1 1 1 A 64 64 ASN N N 294 117.120 116.856 0.264 1
1 743 . 1 1 1 A 65 65 LEU H H 295 7.550 7.269 0.281 1
1 744 . 1 1 1 A 65 65 LEU HA H 295 4.640 4.435 0.205 1
1 754 . 1 1 1 A 65 65 LEU CA C 295 54.310 54.130 0.180 1
1 755 . 1 1 1 A 65 65 LEU CB C 295 43.640 42.893 0.747 1
1 758 . 1 1 1 A 65 65 LEU N N 295 119.930 119.808 0.122 1
1 759 . 1 1 1 A 66 66 GLY H H 296 7.850 8.849 -0.999 1
1 760 . 1 1 1 A 66 66 GLY HA2 H 296 3.810 4.308 -0.498 1
1 761 . 1 1 1 A 66 66 GLY HA3 H 296 4.110 4.308 -0.198 1
1 762 . 1 1 1 A 66 66 GLY CA C 296 43.570 43.863 -0.293 1
1 763 . 1 1 1 A 66 66 GLY N N 296 108.840 109.655 -0.815 1
1 764 . 1 1 1 A 67 67 LYS H H 297 8.820 8.752 0.068 1
1 765 . 1 1 1 A 67 67 LYS HA H 297 3.980 3.939 0.041 1
1 774 . 1 1 1 A 67 67 LYS CA C 297 60.100 59.461 0.639 1
1 775 . 1 1 1 A 67 67 LYS CB C 297 32.100 32.103 -0.003 1
1 779 . 1 1 1 A 67 67 LYS N N 297 120.130 120.497 -0.367 1
1 780 . 1 1 1 A 68 68 LYS H H 298 8.850 7.891 0.959 1
1 781 . 1 1 1 A 68 68 LYS HA H 298 4.060 4.082 -0.022 1
1 790 . 1 1 1 A 68 68 LYS CA C 298 60.600 58.734 1.866 1
1 791 . 1 1 1 A 68 68 LYS CB C 298 31.920 31.911 0.009 1
1 795 . 1 1 1 A 68 68 LYS N N 298 119.580 119.484 0.096 1
1 796 . 1 1 1 A 69 69 SER H H 299 8.100 8.318 -0.218 1
1 797 . 1 1 1 A 69 69 SER HA H 299 4.370 4.187 0.183 1
1 800 . 1 1 1 A 69 69 SER CA C 299 61.980 61.614 0.366 1
1 801 . 1 1 1 A 69 69 SER CB C 299 63.000 62.263 0.737 1
1 802 . 1 1 1 A 69 69 SER N N 299 116.360 115.447 0.913 1
1 803 . 1 1 1 A 70 70 LEU H H 300 8.240 7.944 0.296 1
1 804 . 1 1 1 A 70 70 LEU HA H 300 3.970 4.060 -0.090 1
1 814 . 1 1 1 A 70 70 LEU CA C 300 57.610 57.846 -0.236 1
1 815 . 1 1 1 A 70 70 LEU CB C 300 41.060 41.597 -0.537 1
1 819 . 1 1 1 A 70 70 LEU N N 300 123.330 124.931 -1.601 1
1 820 . 1 1 1 A 71 71 THR H H 301 8.550 7.660 0.890 1
1 821 . 1 1 1 A 71 71 THR HA H 301 3.690 3.835 -0.145 1
1 826 . 1 1 1 A 71 71 THR CA C 301 67.170 67.228 -0.058 1
1 827 . 1 1 1 A 71 71 THR CB C 301 68.810 68.610 0.200 1
1 829 . 1 1 1 A 71 71 THR N N 301 116.520 114.998 1.522 1
1 830 . 1 1 1 A 72 72 GLU H H 302 7.520 8.135 -0.615 1
1 831 . 1 1 1 A 72 72 GLU HA H 302 4.070 4.009 0.061 1
1 836 . 1 1 1 A 72 72 GLU CA C 302 59.470 59.487 -0.017 1
1 837 . 1 1 1 A 72 72 GLU CB C 302 29.090 29.339 -0.249 1
1 839 . 1 1 1 A 72 72 GLU N N 302 121.510 119.329 2.181 1
1 840 . 1 1 1 A 73 73 ILE H H 303 8.290 8.033 0.257 1
1 841 . 1 1 1 A 73 73 ILE HA H 303 3.380 3.589 -0.209 1
1 849 . 1 1 1 A 73 73 ILE CA C 303 66.010 65.444 0.566 1
1 850 . 1 1 1 A 73 73 ILE CB C 303 38.680 37.846 0.834 1
1 853 . 1 1 1 A 73 73 ILE N N 303 118.510 120.936 -2.426 1
1 854 . 1 1 1 A 74 74 LYS H H 304 8.550 8.066 0.484 1
1 855 . 1 1 1 A 74 74 LYS HA H 304 3.680 3.838 -0.158 1
1 864 . 1 1 1 A 74 74 LYS CA C 304 61.320 60.013 1.307 1
1 865 . 1 1 1 A 74 74 LYS CB C 304 32.060 32.141 -0.081 1
1 868 . 1 1 1 A 74 74 LYS N N 304 118.220 121.080 -2.860 1
1 869 . 1 1 1 A 75 75 ASP H H 305 8.450 7.884 0.566 1
1 870 . 1 1 1 A 75 75 ASP HA H 305 4.440 4.321 0.119 1
1 873 . 1 1 1 A 75 75 ASP CA C 305 57.690 57.651 0.039 1
1 874 . 1 1 1 A 75 75 ASP CB C 305 40.220 41.701 -1.481 1
1 875 . 1 1 1 A 75 75 ASP N N 305 121.790 119.701 2.089 1
1 876 . 1 1 1 A 76 76 VAL H H 306 8.680 7.883 0.797 1
1 877 . 1 1 1 A 76 76 VAL HA H 306 3.890 3.641 0.249 1
1 885 . 1 1 1 A 76 76 VAL CA C 306 66.020 66.269 -0.249 1
1 886 . 1 1 1 A 76 76 VAL CB C 306 31.250 31.433 -0.183 1
1 889 . 1 1 1 A 76 76 VAL N N 306 121.150 118.781 2.369 1
1 890 . 1 1 1 A 77 77 LEU H H 307 8.470 9.023 -0.553 1
1 891 . 1 1 1 A 77 77 LEU HA H 307 3.810 3.979 -0.169 1
1 901 . 1 1 1 A 77 77 LEU CA C 307 58.330 57.546 0.784 1
1 902 . 1 1 1 A 77 77 LEU CB C 307 41.250 41.028 0.222 1
1 906 . 1 1 1 A 77 77 LEU N N 307 120.830 120.280 0.550 1
1 907 . 1 1 1 A 78 78 ALA H H 308 8.280 8.406 -0.126 1
1 908 . 1 1 1 A 78 78 ALA HA H 308 4.320 4.099 0.221 1
1 912 . 1 1 1 A 78 78 ALA CA C 308 55.420 55.036 0.384 1
1 913 . 1 1 1 A 78 78 ALA CB C 308 17.750 18.133 -0.383 1
1 914 . 1 1 1 A 78 78 ALA N N 308 122.530 121.338 1.192 1
1 915 . 1 1 1 A 79 79 SER H H 309 7.900 7.681 0.219 1
1 916 . 1 1 1 A 79 79 SER HA H 309 4.340 4.446 -0.106 1
1 919 . 1 1 1 A 79 79 SER CA C 309 61.350 59.375 1.975 1
1 920 . 1 1 1 A 79 79 SER CB C 309 63.280 63.570 -0.290 1
1 921 . 1 1 1 A 79 79 SER N N 309 115.600 112.902 2.698 1
1 922 . 1 1 1 A 80 80 ARG H H 310 7.450 8.238 -0.788 1
1 923 . 1 1 1 A 80 80 ARG HA H 310 4.550 3.989 0.561 1
1 931 . 1 1 1 A 80 80 ARG CA C 310 54.200 57.291 -3.091 1
1 932 . 1 1 1 A 80 80 ARG CB C 310 30.680 27.174 3.506 1
1 935 . 1 1 1 A 80 80 ARG N N 310 119.360 117.773 1.587 1
1 936 . 1 1 1 A 81 81 GLY H H 311 7.940 8.217 -0.277 1
1 937 . 1 1 1 A 81 81 GLY HA2 H 311 3.840 3.950 -0.110 1
1 938 . 1 1 1 A 81 81 GLY HA3 H 311 4.070 3.952 0.118 1
1 939 . 1 1 1 A 81 81 GLY CA C 311 46.060 45.794 0.266 1
1 940 . 1 1 1 A 81 81 GLY N N 311 108.130 106.407 1.723 1
1 941 . 1 1 1 A 82 82 LEU H H 312 7.920 7.477 0.443 1
1 942 . 1 1 1 A 82 82 LEU HA H 312 4.680 4.756 -0.076 1
1 952 . 1 1 1 A 82 82 LEU CA C 312 53.070 52.492 0.578 1
1 953 . 1 1 1 A 82 82 LEU CB C 312 45.790 45.528 0.262 1
1 957 . 1 1 1 A 82 82 LEU N N 312 119.290 116.565 2.725 1
1 958 . 1 1 1 A 83 83 SER H H 313 7.530 8.958 -1.428 1
1 959 . 1 1 1 A 83 83 SER HA H 313 4.450 4.192 0.258 1
1 962 . 1 1 1 A 83 83 SER CA C 313 57.190 59.275 -2.085 1
1 963 . 1 1 1 A 83 83 SER CB C 313 66.080 62.799 3.281 1
1 964 . 1 1 1 A 83 83 SER N N 313 113.120 114.952 -1.832 1
1 965 . 1 1 1 A 84 84 LEU H H 314 8.340 8.312 0.028 1
1 966 . 1 1 1 A 84 84 LEU HA H 314 4.620 4.396 0.224 1
1 976 . 1 1 1 A 84 84 LEU CA C 314 54.720 54.800 -0.080 1
1 977 . 1 1 1 A 84 84 LEU CB C 314 41.620 42.266 -0.646 1
1 981 . 1 1 1 A 84 84 LEU N N 314 115.930 119.993 -4.063 1
1 982 . 1 1 1 A 85 85 GLY H H 315 8.270 7.839 0.431 1
1 983 . 1 1 1 A 85 85 GLY HA2 H 315 3.320 3.944 -0.624 1
1 984 . 1 1 1 A 85 85 GLY HA3 H 315 3.850 3.944 -0.094 1
1 985 . 1 1 1 A 85 85 GLY CA C 315 46.560 46.738 -0.178 1
1 986 . 1 1 1 A 85 85 GLY N N 315 111.010 108.368 2.642 1
1 987 . 1 1 1 A 86 86 MET H H 316 8.650 8.159 0.491 1
1 988 . 1 1 1 A 86 86 MET HA H 316 3.990 4.794 -0.804 1
1 996 . 1 1 1 A 86 86 MET CA C 316 56.730 55.256 1.474 1
1 997 . 1 1 1 A 86 86 MET CB C 316 33.600 35.141 -1.541 1
1 1000 . 1 1 1 A 86 86 MET N N 316 120.570 118.940 1.630 1
1 1001 . 1 1 1 A 87 87 ARG H H 317 8.360 8.522 -0.162 1
1 1002 . 1 1 1 A 87 87 ARG HA H 317 4.450 5.173 -0.723 1
1 1010 . 1 1 1 A 87 87 ARG CA C 317 55.310 54.557 0.753 1
1 1011 . 1 1 1 A 87 87 ARG CB C 317 30.490 32.909 -2.419 1
1 1014 . 1 1 1 A 87 87 ARG N N 317 122.290 119.334 2.956 1
1 1015 . 1 1 1 A 88 88 LEU H H 318 8.400 8.939 -0.539 1
1 1016 . 1 1 1 A 88 88 LEU HA H 318 4.670 4.901 -0.231 1
1 1026 . 1 1 1 A 88 88 LEU CA C 318 53.110 53.327 -0.217 1
1 1027 . 1 1 1 A 88 88 LEU CB C 318 43.600 44.338 -0.738 1
1 1031 . 1 1 1 A 88 88 LEU N N 318 126.420 125.643 0.777 1
1 1032 . 1 1 1 A 89 89 GLU H H 319 8.780 9.000 -0.220 1
1 1033 . 1 1 1 A 89 89 GLU HA H 319 4.340 4.062 0.278 1
1 1038 . 1 1 1 A 89 89 GLU CA C 319 56.490 59.082 -2.592 1
1 1039 . 1 1 1 A 89 89 GLU CB C 319 30.470 30.105 0.365 1
1 1041 . 1 1 1 A 89 89 GLU N N 319 123.070 123.180 -0.110 1
1 1042 . 1 1 1 A 90 90 ASN H H 320 8.900 8.284 0.616 1
1 1043 . 1 1 1 A 90 90 ASN HA H 320 4.410 5.006 -0.596 1
1 1048 . 1 1 1 A 90 90 ASN CA C 320 54.120 54.443 -0.323 1
1 1049 . 1 1 1 A 90 90 ASN CB C 320 37.640 41.016 -3.376 1
1 1050 . 1 1 1 A 90 90 ASN N N 320 116.540 113.014 3.526 1
1 1052 . 1 1 1 A 91 91 TRP H H 321 7.990 7.412 0.578 1
1 1053 . 1 1 1 A 91 91 TRP HA H 321 4.330 4.787 -0.457 1
1 1062 . 1 1 1 A 91 91 TRP CA C 321 54.590 58.483 -3.893 1
1 1063 . 1 1 1 A 91 91 TRP CB C 321 31.280 31.186 0.094 1
1 1069 . 1 1 1 A 91 91 TRP N N 321 119.230 114.567 4.663 1
1 1071 . 1 1 1 A 92 92 PRO HA H 322 4.800 3.915 0.885 1
1 1077 . 1 1 1 A 93 93 PRO HA H 323 4.450 4.547 -0.097 1
1 1084 . 1 1 1 A 93 93 PRO CA C 323 61.970 62.498 -0.528 1
1 1085 . 1 1 1 A 93 93 PRO CB C 323 32.830 32.605 0.225 1
1 1088 . 1 1 1 A 94 94 ALA H H 324 8.460 8.852 -0.392 1
1 1089 . 1 1 1 A 94 94 ALA HA H 324 4.000 4.038 -0.038 1
1 1093 . 1 1 1 A 94 94 ALA CA C 324 53.790 55.088 -1.298 1
1 1094 . 1 1 1 A 94 94 ALA CB C 324 18.640 17.892 0.748 1
1 1095 . 1 1 1 A 94 94 ALA N N 324 124.010 126.312 -2.302 1
1 1096 . 1 1 1 A 95 95 SER H H 325 7.950 8.046 -0.096 1
1 1097 . 1 1 1 A 95 95 SER HA H 325 4.210 4.204 0.006 1
1 1100 . 1 1 1 A 95 95 SER CA C 325 58.970 61.752 -2.782 1
1 1101 . 1 1 1 A 95 95 SER CB C 325 63.040 63.268 -0.228 1
1 1102 . 1 1 1 A 95 95 SER N N 325 111.520 113.556 -2.036 1
1 1103 . 1 1 1 A 96 96 ILE H H 326 7.480 7.666 -0.186 1
1 1104 . 1 1 1 A 96 96 ILE HA H 326 4.170 3.410 0.760 1
1 1114 . 1 1 1 A 96 96 ILE CA C 326 61.300 65.253 -3.953 1
1 1115 . 1 1 1 A 96 96 ILE CB C 326 38.530 37.350 1.180 1
1 1119 . 1 1 1 A 96 96 ILE N N 326 119.650 120.486 -0.836 1
1 1120 . 1 1 1 A 97 97 ALA H H 327 7.860 7.350 0.510 1
1 1121 . 1 1 1 A 97 97 ALA HA H 327 4.230 3.980 0.250 1
1 1125 . 1 1 1 A 97 97 ALA CA C 327 52.570 54.134 -1.564 1
1 1126 . 1 1 1 A 97 97 ALA CB C 327 19.590 17.791 1.799 1
1 1127 . 1 1 1 A 97 97 ALA N N 327 126.480 123.783 2.697 1
1 1128 . 1 1 1 A 98 98 ASP H H 328 8.250 8.763 -0.513 1
1 1129 . 1 1 1 A 98 98 ASP HA H 328 4.540 4.338 0.202 1
1 1132 . 1 1 1 A 98 98 ASP CA C 328 54.150 57.312 -3.162 1
1 1133 . 1 1 1 A 98 98 ASP CB C 328 41.120 40.866 0.254 1
1 1134 . 1 1 1 A 98 98 ASP N N 328 120.130 118.581 1.549 1
1 1150 . 1 2 2 B 6 6 ASP H H 427 8.160 9.130 -0.970 1
1 1151 . 1 2 2 B 6 6 ASP HA H 427 4.630 4.214 0.416 1
1 1154 . 1 2 2 B 6 6 ASP CA C 427 54.410 56.891 -2.481 1
1 1155 . 1 2 2 B 6 6 ASP CB C 427 41.250 40.640 0.610 1
1 1156 . 1 2 2 B 6 6 ASP N N 427 120.160 123.428 -3.268 1
1 1157 . 1 2 2 B 7 7 ASN H H 428 8.350 8.003 0.347 1
1 1158 . 1 2 2 B 7 7 ASN HA H 428 4.550 4.291 0.259 1
1 1163 . 1 2 2 B 7 7 ASN CA C 428 53.310 54.394 -1.084 1
1 1164 . 1 2 2 B 7 7 ASN CB C 428 38.850 36.894 1.956 1
1 1165 . 1 2 2 B 7 7 ASN N N 428 118.440 114.497 3.943 1
1 1167 . 1 2 2 B 8 8 LYS H H 429 8.030 7.843 0.187 1
1 1172 . 1 2 2 B 8 8 LYS CB C 429 33.280 33.183 0.097 1
1 1174 . 1 2 2 B 8 8 LYS N N 429 120.260 119.888 0.372 1
1 1175 . 1 2 2 B 9 9 PRO HA H 430 4.420 4.508 -0.088 1
1 1182 . 1 2 2 B 9 9 PRO CA C 430 62.280 62.698 -0.418 1
1 1183 . 1 2 2 B 9 9 PRO CB C 430 31.920 32.480 -0.560 1
1 1186 . 1 2 2 B 10 10 ALA H H 431 8.930 8.966 -0.036 1
1 1187 . 1 2 2 B 10 10 ALA HA H 431 4.350 4.525 -0.175 1
1 1191 . 1 2 2 B 10 10 ALA CA C 431 51.070 51.755 -0.685 1
1 1192 . 1 2 2 B 10 10 ALA CB C 431 20.920 19.652 1.268 1
1 1193 . 1 2 2 B 10 10 ALA N N 431 125.000 124.925 0.075 1
1 1194 . 1 2 2 B 11 11 ASP H H 432 8.530 9.077 -0.547 1
1 1195 . 1 2 2 B 11 11 ASP HA H 432 4.220 4.264 -0.044 1
1 1198 . 1 2 2 B 11 11 ASP CA C 432 57.520 57.437 0.083 1
1 1199 . 1 2 2 B 11 11 ASP CB C 432 40.470 40.328 0.142 1
1 1200 . 1 2 2 B 11 11 ASP N N 432 119.610 120.897 -1.287 1
1 1201 . 1 2 2 B 12 12 ASP H H 433 8.340 8.035 0.305 1
1 1202 . 1 2 2 B 12 12 ASP HA H 433 4.160 4.428 -0.268 1
1 1205 . 1 2 2 B 12 12 ASP CA C 433 56.090 57.356 -1.266 1
1 1206 . 1 2 2 B 12 12 ASP CB C 433 38.960 40.968 -2.008 1
1 1207 . 1 2 2 B 12 12 ASP N N 433 116.330 120.157 -3.827 1
1 1208 . 1 2 2 B 13 13 LEU H H 434 7.360 7.818 -0.458 1
1 1209 . 1 2 2 B 13 13 LEU HA H 434 4.050 4.108 -0.058 1
1 1219 . 1 2 2 B 13 13 LEU CA C 434 57.340 57.834 -0.494 1
1 1220 . 1 2 2 B 13 13 LEU CB C 434 42.960 41.705 1.255 1
1 1224 . 1 2 2 B 13 13 LEU N N 434 123.440 120.801 2.639 1
1 1225 . 1 2 2 B 14 14 LEU H H 435 7.670 8.214 -0.544 1
1 1226 . 1 2 2 B 14 14 LEU HA H 435 3.710 4.022 -0.312 1
1 1236 . 1 2 2 B 14 14 LEU CA C 435 57.170 57.637 -0.467 1
1 1237 . 1 2 2 B 14 14 LEU CB C 435 42.590 41.307 1.283 1
1 1241 . 1 2 2 B 14 14 LEU N N 435 115.170 119.689 -4.519 1
1 1242 . 1 2 2 B 15 15 ASN H H 436 7.490 8.114 -0.624 1
1 1243 . 1 2 2 B 15 15 ASN HA H 436 4.640 4.771 -0.131 1
1 1248 . 1 2 2 B 15 15 ASN CA C 436 52.920 52.848 0.072 1
1 1249 . 1 2 2 B 15 15 ASN CB C 436 39.350 38.687 0.663 1
1 1250 . 1 2 2 B 15 15 ASN N N 436 112.280 115.946 -3.666 1
1 1252 . 1 2 2 B 16 16 LEU H H 437 7.300 7.126 0.174 1
1 1253 . 1 2 2 B 16 16 LEU HA H 437 4.100 4.241 -0.141 1
1 1263 . 1 2 2 B 16 16 LEU CA C 437 55.310 55.226 0.084 1
1 1264 . 1 2 2 B 16 16 LEU CB C 437 41.800 43.094 -1.294 1
1 1268 . 1 2 2 B 16 16 LEU N N 437 125.180 121.128 4.052 1
1 1269 . 1 2 2 B 17 17 GLU H H 438 8.590 8.732 -0.142 1
1 1270 . 1 2 2 B 17 17 GLU HA H 438 3.920 4.025 -0.105 1
1 1275 . 1 2 2 B 17 17 GLU CA C 438 58.440 57.983 0.457 1
1 1276 . 1 2 2 B 17 17 GLU CB C 438 29.180 29.685 -0.505 1
1 1278 . 1 2 2 B 17 17 GLU N N 438 129.850 125.746 4.104 1
1 1279 . 1 2 2 B 18 18 GLY H H 439 8.580 8.797 -0.217 1
1 1280 . 1 2 2 B 18 18 GLY HA2 H 439 3.570 3.945 -0.375 1
1 1281 . 1 2 2 B 18 18 GLY HA3 H 439 4.220 3.947 0.273 1
1 1282 . 1 2 2 B 18 18 GLY CA C 439 44.710 45.390 -0.680 1
1 1283 . 1 2 2 B 18 18 GLY N N 439 112.250 114.822 -2.572 1
1 1284 . 1 2 2 B 19 19 VAL H H 440 7.900 7.329 0.571 1
1 1285 . 1 2 2 B 19 19 VAL HA H 440 3.950 4.489 -0.539 1
1 1293 . 1 2 2 B 19 19 VAL CA C 440 62.820 60.967 1.853 1
1 1294 . 1 2 2 B 19 19 VAL CB C 440 31.470 34.879 -3.409 1
1 1297 . 1 2 2 B 19 19 VAL N N 440 121.910 121.816 0.094 1
1 1298 . 1 2 2 B 20 20 ASP H H 441 7.390 8.191 -0.801 1
1 1299 . 1 2 2 B 20 20 ASP HA H 441 4.820 4.876 -0.056 1
1 1302 . 1 2 2 B 20 20 ASP CA C 441 51.920 51.620 0.300 1
1 1303 . 1 2 2 B 20 20 ASP CB C 441 42.090 42.103 -0.013 1
1 1304 . 1 2 2 B 20 20 ASP N N 441 124.850 125.606 -0.756 1
1 1305 . 1 2 2 B 21 21 ARG H H 442 8.630 8.414 0.216 1
1 1306 . 1 2 2 B 21 21 ARG HA H 442 3.810 3.271 0.539 1
1 1313 . 1 2 2 B 21 21 ARG CA C 442 60.710 59.654 1.056 1
1 1314 . 1 2 2 B 21 21 ARG CB C 442 30.020 29.557 0.463 1
1 1317 . 1 2 2 B 21 21 ARG N N 442 120.890 119.095 1.795 1
1 1318 . 1 2 2 B 22 22 ASP H H 443 8.140 7.883 0.257 1
1 1319 . 1 2 2 B 22 22 ASP HA H 443 4.420 4.426 -0.006 1
1 1322 . 1 2 2 B 22 22 ASP CA C 443 57.680 57.006 0.674 1
1 1323 . 1 2 2 B 22 22 ASP CB C 443 40.880 40.940 -0.060 1
1 1324 . 1 2 2 B 22 22 ASP N N 443 116.750 119.767 -3.017 1
1 1325 . 1 2 2 B 23 23 LEU H H 444 8.170 8.905 -0.735 1
1 1326 . 1 2 2 B 23 23 LEU HA H 444 4.130 3.999 0.131 1
1 1336 . 1 2 2 B 23 23 LEU CA C 444 57.770 57.909 -0.139 1
1 1337 . 1 2 2 B 23 23 LEU CB C 444 41.230 41.271 -0.041 1
1 1341 . 1 2 2 B 23 23 LEU N N 444 122.130 119.937 2.193 1
1 1342 . 1 2 2 B 24 24 ALA H H 445 8.630 8.351 0.279 1
1 1343 . 1 2 2 B 24 24 ALA HA H 445 3.790 4.004 -0.214 1
1 1347 . 1 2 2 B 24 24 ALA CA C 445 55.810 54.103 1.707 1
1 1348 . 1 2 2 B 24 24 ALA CB C 445 18.060 18.260 -0.200 1
1 1349 . 1 2 2 B 24 24 ALA N N 445 120.890 120.810 0.080 1
1 1350 . 1 2 2 B 25 25 PHE H H 446 8.160 7.566 0.594 1
1 1351 . 1 2 2 B 25 25 PHE HA H 446 4.080 4.269 -0.189 1
1 1358 . 1 2 2 B 25 25 PHE CA C 446 62.670 61.827 0.843 1
1 1359 . 1 2 2 B 25 25 PHE CB C 446 39.440 38.506 0.934 1
1 1364 . 1 2 2 B 25 25 PHE N N 446 115.360 116.099 -0.739 1
1 1365 . 1 2 2 B 26 26 LYS H H 447 8.040 7.975 0.065 1
1 1366 . 1 2 2 B 26 26 LYS HA H 447 4.110 3.965 0.145 1
1 1375 . 1 2 2 B 26 26 LYS CA C 447 60.140 59.409 0.731 1
1 1376 . 1 2 2 B 26 26 LYS CB C 447 32.880 32.604 0.276 1
1 1380 . 1 2 2 B 26 26 LYS N N 447 123.110 118.230 4.880 1
1 1381 . 1 2 2 B 27 27 LEU H H 448 8.630 8.160 0.470 1
1 1382 . 1 2 2 B 27 27 LEU HA H 448 3.840 4.076 -0.236 1
1 1392 . 1 2 2 B 27 27 LEU CA C 448 58.210 57.676 0.534 1
1 1393 . 1 2 2 B 27 27 LEU CB C 448 39.760 41.469 -1.709 1
1 1396 . 1 2 2 B 27 27 LEU N N 448 120.890 121.348 -0.458 1
1 1397 . 1 2 2 B 28 28 ALA H H 449 8.200 8.641 -0.441 1
1 1398 . 1 2 2 B 28 28 ALA HA H 449 3.760 4.559 -0.799 1
1 1402 . 1 2 2 B 28 28 ALA CA C 449 54.750 55.169 -0.419 1
1 1403 . 1 2 2 B 28 28 ALA CB C 449 18.050 18.375 -0.325 1
1 1404 . 1 2 2 B 28 28 ALA N N 449 123.710 120.670 3.040 1
1 1405 . 1 2 2 B 29 29 ALA H H 450 7.780 8.254 -0.474 1
1 1406 . 1 2 2 B 29 29 ALA HA H 450 4.170 4.103 0.067 1
1 1410 . 1 2 2 B 29 29 ALA CA C 450 54.430 54.579 -0.149 1
1 1411 . 1 2 2 B 29 29 ALA CB C 450 18.040 18.241 -0.201 1
1 1412 . 1 2 2 B 29 29 ALA N N 450 121.020 119.548 1.472 1
1 1413 . 1 2 2 B 30 30 ARG H H 451 7.390 7.553 -0.163 1
1 1414 . 1 2 2 B 30 30 ARG HA H 451 4.540 4.416 0.124 1
1 1421 . 1 2 2 B 30 30 ARG CA C 451 54.510 55.755 -1.245 1
1 1422 . 1 2 2 B 30 30 ARG CB C 451 29.950 29.729 0.221 1
1 1425 . 1 2 2 B 30 30 ARG N N 451 115.480 116.638 -1.158 1
1 1426 . 1 2 2 B 31 31 GLY H H 452 7.950 7.906 0.044 1
1 1427 . 1 2 2 B 31 31 GLY HA2 H 452 3.550 3.988 -0.438 1
1 1428 . 1 2 2 B 31 31 GLY HA3 H 452 4.200 3.989 0.211 1
1 1429 . 1 2 2 B 31 31 GLY CA C 452 45.380 45.365 0.015 1
1 1430 . 1 2 2 B 31 31 GLY N N 452 107.740 108.150 -0.410 1
1 1431 . 1 2 2 B 32 32 VAL H H 453 7.990 7.633 0.357 1
1 1432 . 1 2 2 B 32 32 VAL HA H 453 3.930 4.410 -0.480 1
1 1440 . 1 2 2 B 32 32 VAL CA C 453 61.420 62.789 -1.369 1
1 1441 . 1 2 2 B 32 32 VAL CB C 453 29.860 31.881 -2.021 1
1 1444 . 1 2 2 B 32 32 VAL N N 453 125.560 120.558 5.002 1
1 1445 . 1 2 2 B 33 33 CYS H H 454 8.460 8.815 -0.355 1
1 1446 . 1 2 2 B 33 33 CYS HA H 454 4.310 4.655 -0.345 1
1 1449 . 1 2 2 B 33 33 CYS CA C 454 60.260 59.988 0.272 1
1 1450 . 1 2 2 B 33 33 CYS CB C 454 30.330 30.884 -0.554 1
1 1451 . 1 2 2 B 33 33 CYS N N 454 119.460 125.001 -5.541 1
1 1452 . 1 2 2 B 34 34 THR H H 455 8.080 8.005 0.075 1
1 1453 . 1 2 2 B 34 34 THR HA H 455 4.840 4.802 0.038 1
1 1458 . 1 2 2 B 34 34 THR CA C 455 58.650 61.109 -2.459 1
1 1459 . 1 2 2 B 34 34 THR CB C 455 72.680 71.214 1.466 1
1 1461 . 1 2 2 B 34 34 THR N N 455 108.420 114.263 -5.843 1
1 1462 . 1 2 2 B 35 35 LEU H H 456 8.580 8.808 -0.228 1
1 1463 . 1 2 2 B 35 35 LEU HA H 456 3.790 4.011 -0.221 1
1 1473 . 1 2 2 B 35 35 LEU CA C 456 57.980 58.702 -0.722 1
1 1474 . 1 2 2 B 35 35 LEU CB C 456 42.220 41.584 0.636 1
1 1477 . 1 2 2 B 35 35 LEU N N 456 120.370 128.459 -8.089 1
1 1478 . 1 2 2 B 36 36 GLU H H 457 8.390 8.388 0.002 1
1 1479 . 1 2 2 B 36 36 GLU HA H 457 3.820 3.866 -0.046 1
1 1484 . 1 2 2 B 36 36 GLU CA C 457 59.640 60.073 -0.433 1
1 1485 . 1 2 2 B 36 36 GLU CB C 457 28.780 29.231 -0.451 1
1 1487 . 1 2 2 B 36 36 GLU N N 457 119.450 118.754 0.696 1
1 1488 . 1 2 2 B 37 37 ASP H H 458 7.750 8.119 -0.369 1
1 1489 . 1 2 2 B 37 37 ASP HA H 458 4.140 4.366 -0.226 1
1 1492 . 1 2 2 B 37 37 ASP CA C 458 57.150 57.512 -0.362 1
1 1493 . 1 2 2 B 37 37 ASP CB C 458 42.280 42.090 0.190 1
1 1494 . 1 2 2 B 37 37 ASP N N 458 117.430 120.228 -2.798 1
1 1495 . 1 2 2 B 38 38 LEU H H 459 7.700 7.902 -0.202 1
1 1496 . 1 2 2 B 38 38 LEU HA H 459 3.790 4.118 -0.328 1
1 1506 . 1 2 2 B 38 38 LEU CA C 459 58.080 57.850 0.230 1
1 1507 . 1 2 2 B 38 38 LEU CB C 459 41.130 41.220 -0.090 1
1 1511 . 1 2 2 B 38 38 LEU N N 459 121.280 120.521 0.759 1
1 1512 . 1 2 2 B 39 39 ALA H H 460 8.190 8.342 -0.152 1
1 1513 . 1 2 2 B 39 39 ALA HA H 460 3.640 4.002 -0.362 1
1 1517 . 1 2 2 B 39 39 ALA CA C 460 54.320 55.355 -1.035 1
1 1518 . 1 2 2 B 39 39 ALA CB C 460 17.140 18.258 -1.118 1
1 1519 . 1 2 2 B 39 39 ALA N N 460 119.400 120.237 -0.837 1
1 1520 . 1 2 2 B 40 40 GLU H H 461 7.340 7.834 -0.494 1
1 1521 . 1 2 2 B 40 40 GLU HA H 461 4.180 4.237 -0.057 1
1 1526 . 1 2 2 B 40 40 GLU CA C 461 57.800 59.134 -1.334 1
1 1527 . 1 2 2 B 40 40 GLU CB C 461 30.600 29.444 1.156 1
1 1529 . 1 2 2 B 40 40 GLU N N 461 110.680 115.959 -5.279 1
1 1530 . 1 2 2 B 41 41 GLN H H 462 7.940 7.607 0.333 1
1 1531 . 1 2 2 B 41 41 GLN HA H 462 4.100 4.425 -0.325 1
1 1538 . 1 2 2 B 41 41 GLN CA C 462 55.310 56.567 -1.257 1
1 1539 . 1 2 2 B 41 41 GLN CB C 462 28.780 29.515 -0.735 1
1 1541 . 1 2 2 B 41 41 GLN N N 462 120.720 117.834 2.886 1
1 1543 . 1 2 2 B 42 42 GLY H H 463 9.000 8.662 0.338 1
1 1544 . 1 2 2 B 42 42 GLY HA2 H 463 3.310 4.300 -0.990 1
1 1545 . 1 2 2 B 42 42 GLY HA3 H 463 4.820 4.302 0.518 1
1 1546 . 1 2 2 B 42 42 GLY CA C 463 42.650 43.931 -1.281 1
1 1547 . 1 2 2 B 42 42 GLY N N 463 104.110 108.569 -4.459 1
1 1548 . 1 2 2 B 43 43 ILE H H 464 7.900 8.779 -0.879 1
1 1549 . 1 2 2 B 43 43 ILE HA H 464 3.260 3.700 -0.440 1
1 1558 . 1 2 2 B 43 43 ILE CA C 464 66.570 64.354 2.216 1
1 1559 . 1 2 2 B 43 43 ILE CB C 464 38.770 37.387 1.383 1
1 1562 . 1 2 2 B 43 43 ILE N N 464 119.410 119.814 -0.404 1
1 1563 . 1 2 2 B 44 44 ASP H H 465 8.730 8.073 0.657 1
1 1564 . 1 2 2 B 44 44 ASP HA H 465 4.310 4.406 -0.096 1
1 1567 . 1 2 2 B 44 44 ASP CA C 465 56.740 57.073 -0.333 1
1 1568 . 1 2 2 B 44 44 ASP CB C 465 40.120 40.152 -0.032 1
1 1569 . 1 2 2 B 44 44 ASP N N 465 116.610 121.663 -5.053 1
1 1570 . 1 2 2 B 45 45 ASP H H 466 7.720 8.024 -0.304 1
1 1571 . 1 2 2 B 45 45 ASP HA H 466 4.480 4.474 0.006 1
1 1574 . 1 2 2 B 45 45 ASP CA C 466 57.000 57.190 -0.190 1
1 1575 . 1 2 2 B 45 45 ASP CB C 466 42.270 40.743 1.527 1
1 1576 . 1 2 2 B 45 45 ASP N N 466 117.560 120.916 -3.356 1
1 1577 . 1 2 2 B 46 46 LEU H H 467 7.370 8.090 -0.720 1
1 1578 . 1 2 2 B 46 46 LEU HA H 467 4.410 4.158 0.252 1
1 1587 . 1 2 2 B 46 46 LEU CA C 467 53.660 57.445 -3.785 1
1 1588 . 1 2 2 B 46 46 LEU CB C 467 42.260 41.428 0.832 1
1 1591 . 1 2 2 B 46 46 LEU N N 467 116.890 120.714 -3.824 1
1 1592 . 1 2 2 B 47 47 ALA H H 468 7.080 8.246 -1.166 1
1 1593 . 1 2 2 B 47 47 ALA HA H 468 4.120 4.036 0.084 1
1 1597 . 1 2 2 B 47 47 ALA CA C 468 54.130 54.886 -0.756 1
1 1598 . 1 2 2 B 47 47 ALA CB C 468 19.480 18.355 1.125 1
1 1599 . 1 2 2 B 47 47 ALA N N 468 120.150 122.596 -2.446 1
1 1600 . 1 2 2 B 48 48 ASP H H 469 8.560 8.180 0.380 1
1 1601 . 1 2 2 B 48 48 ASP HA H 469 4.410 4.453 -0.043 1
1 1604 . 1 2 2 B 48 48 ASP CA C 469 54.330 57.609 -3.279 1
1 1605 . 1 2 2 B 48 48 ASP CB C 469 39.760 40.683 -0.923 1
1 1606 . 1 2 2 B 48 48 ASP N N 469 114.660 116.676 -2.016 1
1 1607 . 1 2 2 B 49 49 ILE H H 470 7.870 7.949 -0.079 1
1 1608 . 1 2 2 B 49 49 ILE HA H 470 3.850 4.352 -0.502 1
1 1618 . 1 2 2 B 49 49 ILE CA C 470 61.680 60.654 1.026 1
1 1619 . 1 2 2 B 49 49 ILE CB C 470 37.120 38.494 -1.374 1
1 1623 . 1 2 2 B 49 49 ILE N N 470 121.600 119.920 1.680 1
1 1624 . 1 2 2 B 50 50 GLU H H 471 8.680 8.963 -0.283 1
1 1625 . 1 2 2 B 50 50 GLU HA H 471 3.940 4.046 -0.106 1
1 1630 . 1 2 2 B 50 50 GLU CA C 471 58.360 59.325 -0.965 1
1 1631 . 1 2 2 B 50 50 GLU CB C 471 29.530 29.463 0.067 1
1 1633 . 1 2 2 B 50 50 GLU N N 471 131.000 126.363 4.637 1
1 1634 . 1 2 2 B 51 51 GLY H H 472 8.860 8.143 0.717 1
1 1635 . 1 2 2 B 51 51 GLY HA2 H 472 3.640 3.993 -0.353 1
1 1636 . 1 2 2 B 51 51 GLY HA3 H 472 4.230 3.995 0.235 1
1 1637 . 1 2 2 B 51 51 GLY CA C 472 45.190 47.130 -1.940 1
1 1638 . 1 2 2 B 51 51 GLY N N 472 113.580 108.788 4.792 1
1 1639 . 1 2 2 B 52 52 LEU H H 473 7.850 7.417 0.433 1
1 1640 . 1 2 2 B 52 52 LEU HA H 473 4.680 4.790 -0.110 1
1 1650 . 1 2 2 B 52 52 LEU CA C 473 53.640 53.792 -0.152 1
1 1651 . 1 2 2 B 52 52 LEU CB C 473 42.990 43.443 -0.453 1
1 1655 . 1 2 2 B 52 52 LEU N N 473 123.020 120.017 3.003 1
1 1656 . 1 2 2 B 53 53 THR H H 474 7.550 8.908 -1.358 1
1 1657 . 1 2 2 B 53 53 THR HA H 474 4.560 4.818 -0.258 1
1 1662 . 1 2 2 B 53 53 THR CA C 474 60.060 60.880 -0.820 1
1 1663 . 1 2 2 B 53 53 THR CB C 474 71.520 71.318 0.202 1
1 1665 . 1 2 2 B 53 53 THR N N 474 115.070 118.254 -3.184 1
1 1666 . 1 2 2 B 54 54 ASP H H 475 8.900 9.019 -0.119 1
1 1667 . 1 2 2 B 54 54 ASP HA H 475 4.220 4.283 -0.063 1
1 1670 . 1 2 2 B 54 54 ASP CA C 475 57.520 57.998 -0.478 1
1 1671 . 1 2 2 B 54 54 ASP CB C 475 39.560 40.225 -0.665 1
1 1672 . 1 2 2 B 54 54 ASP N N 475 121.800 123.829 -2.029 1
1 1673 . 1 2 2 B 55 55 GLU H H 476 8.460 8.037 0.423 1
1 1674 . 1 2 2 B 55 55 GLU HA H 476 3.970 4.031 -0.061 1
1 1679 . 1 2 2 B 55 55 GLU CA C 476 59.440 59.151 0.289 1
1 1680 . 1 2 2 B 55 55 GLU CB C 476 29.650 29.397 0.253 1
1 1682 . 1 2 2 B 55 55 GLU N N 476 119.460 119.557 -0.097 1
1 1683 . 1 2 2 B 56 56 LYS H H 477 7.790 7.987 -0.197 1
1 1684 . 1 2 2 B 56 56 LYS HA H 477 4.120 4.116 0.004 1
1 1693 . 1 2 2 B 56 56 LYS CA C 477 58.890 58.379 0.511 1
1 1694 . 1 2 2 B 56 56 LYS CB C 477 32.600 32.114 0.486 1
1 1698 . 1 2 2 B 56 56 LYS N N 477 121.840 119.638 2.202 1
1 1699 . 1 2 2 B 57 57 ALA H H 478 8.900 9.289 -0.389 1
1 1700 . 1 2 2 B 57 57 ALA HA H 478 3.790 4.048 -0.258 1
1 1704 . 1 2 2 B 57 57 ALA CA C 478 55.810 55.638 0.172 1
1 1705 . 1 2 2 B 57 57 ALA CB C 478 18.590 18.192 0.398 1
1 1706 . 1 2 2 B 57 57 ALA N N 478 121.350 122.151 -0.801 1
1 1707 . 1 2 2 B 58 58 GLY H H 479 8.300 8.111 0.189 1
1 1708 . 1 2 2 B 58 58 GLY HA2 H 479 3.500 3.765 -0.265 1
1 1709 . 1 2 2 B 58 58 GLY HA3 H 479 3.890 3.768 0.122 1
1 1710 . 1 2 2 B 58 58 GLY CA C 479 47.360 47.138 0.222 1
1 1711 . 1 2 2 B 58 58 GLY N N 479 102.040 107.010 -4.970 1
1 1712 . 1 2 2 B 59 59 ALA H H 480 7.580 7.850 -0.270 1
1 1713 . 1 2 2 B 59 59 ALA HA H 480 4.110 4.073 0.037 1
1 1717 . 1 2 2 B 59 59 ALA CA C 480 55.580 54.483 1.097 1
1 1718 . 1 2 2 B 59 59 ALA CB C 480 18.130 18.778 -0.648 1
1 1719 . 1 2 2 B 59 59 ALA N N 480 123.180 124.837 -1.657 1
1 1720 . 1 2 2 B 60 60 LEU H H 481 8.290 8.029 0.261 1
1 1721 . 1 2 2 B 60 60 LEU HA H 481 4.020 4.023 -0.003 1
1 1731 . 1 2 2 B 60 60 LEU CA C 481 57.850 57.709 0.141 1
1 1732 . 1 2 2 B 60 60 LEU CB C 481 42.360 41.164 1.196 1
1 1736 . 1 2 2 B 60 60 LEU N N 481 120.560 119.438 1.122 1
1 1737 . 1 2 2 B 61 61 ILE H H 482 8.080 7.920 0.160 1
1 1738 . 1 2 2 B 61 61 ILE HA H 482 3.210 3.468 -0.258 1
1 1748 . 1 2 2 B 61 61 ILE CA C 482 66.250 65.059 1.191 1
1 1749 . 1 2 2 B 61 61 ILE CB C 482 39.400 38.262 1.138 1
1 1753 . 1 2 2 B 61 61 ILE N N 482 119.170 120.654 -1.484 1
1 1754 . 1 2 2 B 62 62 MET H H 483 8.110 8.175 -0.065 1
1 1755 . 1 2 2 B 62 62 MET HA H 483 4.410 4.231 0.179 1
1 1763 . 1 2 2 B 62 62 MET CA C 483 56.110 58.806 -2.696 1
1 1764 . 1 2 2 B 62 62 MET CB C 483 28.260 32.496 -4.236 1
1 1767 . 1 2 2 B 62 62 MET N N 483 114.420 117.819 -3.399 1
1 1768 . 1 2 2 B 63 63 ALA H H 484 8.240 7.949 0.291 1
1 1769 . 1 2 2 B 63 63 ALA HA H 484 4.130 4.019 0.111 1
1 1773 . 1 2 2 B 63 63 ALA CA C 484 55.300 55.238 0.062 1
1 1774 . 1 2 2 B 63 63 ALA CB C 484 18.280 17.972 0.308 1
1 1775 . 1 2 2 B 63 63 ALA N N 484 123.710 121.395 2.315 1
1 1776 . 1 2 2 B 64 64 ALA H H 485 8.050 8.278 -0.228 1
1 1777 . 1 2 2 B 64 64 ALA HA H 485 3.870 4.103 -0.233 1
1 1781 . 1 2 2 B 64 64 ALA CA C 485 55.330 55.218 0.112 1
1 1782 . 1 2 2 B 64 64 ALA CB C 485 17.660 18.187 -0.527 1
1 1783 . 1 2 2 B 64 64 ALA N N 485 120.070 119.817 0.253 1
1 1784 . 1 2 2 B 65 65 ARG H H 486 8.640 8.166 0.474 1
1 1785 . 1 2 2 B 65 65 ARG HA H 486 2.800 4.238 -1.438 1
1 1792 . 1 2 2 B 65 65 ARG CA C 486 60.600 59.420 1.180 1
1 1793 . 1 2 2 B 65 65 ARG CB C 486 29.910 29.995 -0.085 1
1 1796 . 1 2 2 B 65 65 ARG N N 486 118.730 118.896 -0.166 1
1 1797 . 1 2 2 B 66 66 ASN H H 487 8.710 8.845 -0.135 1
1 1798 . 1 2 2 B 66 66 ASN HA H 487 4.550 4.962 -0.412 1
1 1803 . 1 2 2 B 66 66 ASN CA C 487 56.390 56.491 -0.101 1
1 1804 . 1 2 2 B 66 66 ASN CB C 487 37.970 38.608 -0.638 1
1 1805 . 1 2 2 B 66 66 ASN N N 487 119.170 118.186 0.984 1
1 1807 . 1 2 2 B 67 67 ILE H H 488 7.250 7.781 -0.531 1
1 1808 . 1 2 2 B 67 67 ILE HA H 488 3.810 3.837 -0.027 1
1 1818 . 1 2 2 B 67 67 ILE CA C 488 64.350 65.059 -0.709 1
1 1819 . 1 2 2 B 67 67 ILE CB C 488 39.570 37.943 1.627 1
1 1823 . 1 2 2 B 67 67 ILE N N 488 117.890 120.124 -2.234 1
1 1824 . 1 2 2 B 68 68 CYS H H 489 8.350 8.095 0.255 1
1 1825 . 1 2 2 B 68 68 CYS HA H 489 4.080 4.065 0.015 1
1 1828 . 1 2 2 B 68 68 CYS CA C 489 62.670 62.676 -0.006 1
1 1829 . 1 2 2 B 68 68 CYS CB C 489 28.170 26.861 1.309 1
1 1830 . 1 2 2 B 68 68 CYS N N 489 115.230 120.685 -5.455 1
1 1831 . 1 2 2 B 69 69 TRP H H 490 8.230 8.804 -0.574 1
1 1832 . 1 2 2 B 69 69 TRP HA H 490 5.100 4.268 0.832 1
1 1841 . 1 2 2 B 69 69 TRP CA C 490 55.420 60.243 -4.823 1
1 1842 . 1 2 2 B 69 69 TRP CB C 490 31.010 29.208 1.802 1
1 1844 . 1 2 2 B 69 69 TRP N N 490 116.850 121.084 -4.234 1
1 1846 . 1 2 2 B 70 70 PHE H H 491 7.570 8.699 -1.129 1
1 1847 . 1 2 2 B 70 70 PHE HA H 491 5.240 4.735 0.505 1
1 1852 . 1 2 2 B 70 70 PHE CA C 491 55.490 58.207 -2.717 1
1 1853 . 1 2 2 B 70 70 PHE CB C 491 38.700 39.044 -0.344 1
1 1856 . 1 2 2 B 70 70 PHE N N 491 117.460 116.281 1.179 1
1 1857 . 1 2 2 B 71 71 GLY H H 492 8.420 8.273 0.147 1
1 1858 . 1 2 2 B 71 71 GLY HA2 H 492 3.920 3.833 0.087 1
1 1859 . 1 2 2 B 71 71 GLY HA3 H 492 4.080 3.870 0.210 1
1 1860 . 1 2 2 B 71 71 GLY CA C 492 46.210 47.179 -0.969 1
1 1861 . 1 2 2 B 71 71 GLY N N 492 110.040 108.812 1.228 1
1 1862 . 1 2 2 B 72 72 ASP H H 493 8.370 7.914 0.456 1
1 1863 . 1 2 2 B 72 72 ASP HA H 493 4.630 4.347 0.283 1
1 1866 . 1 2 2 B 72 72 ASP CA C 493 54.410 56.650 -2.240 1
1 1867 . 1 2 2 B 72 72 ASP CB C 493 41.250 40.379 0.871 1
1 1868 . 1 2 2 B 72 72 ASP N N 493 120.000 119.892 0.108 1
1 1869 . 1 2 2 B 73 73 GLU H H 494 8.230 7.611 0.619 1
1 1870 . 1 2 2 B 73 73 GLU HA H 494 4.260 4.663 -0.403 1
1 1875 . 1 2 2 B 73 73 GLU CA C 494 56.510 56.376 0.134 1
1 1876 . 1 2 2 B 73 73 GLU CB C 494 30.420 31.434 -1.014 1
1 1878 . 1 2 2 B 73 73 GLU N N 494 120.900 119.019 1.881 1
1 216 . 2 1 1 A 20 20 ASP H H 250 8.550 8.551 -0.001 1
1 217 . 2 1 1 A 20 20 ASP HA H 250 4.700 4.673 0.027 1
1 220 . 2 1 1 A 20 20 ASP CA C 250 52.650 52.187 0.463 1
1 221 . 2 1 1 A 20 20 ASP CB C 250 41.420 41.824 -0.404 1
1 222 . 2 1 1 A 20 20 ASP N N 250 125.190 121.839 3.351 1
1 223 . 2 1 1 A 21 21 PRO HA H 251 4.250 4.367 -0.117 1
1 230 . 2 1 1 A 21 21 PRO CA C 251 65.120 64.902 0.218 1
1 231 . 2 1 1 A 21 21 PRO CB C 251 32.310 32.271 0.039 1
1 234 . 2 1 1 A 22 22 ILE H H 252 8.630 7.829 0.801 1
1 235 . 2 1 1 A 22 22 ILE HA H 252 4.060 3.985 0.075 1
1 245 . 2 1 1 A 22 22 ILE CA C 252 62.990 63.111 -0.121 1
1 246 . 2 1 1 A 22 22 ILE CB C 252 37.520 37.621 -0.101 1
1 250 . 2 1 1 A 22 22 ILE N N 252 119.860 116.962 2.898 1
1 251 . 2 1 1 A 23 23 LEU H H 253 7.950 7.545 0.405 1
1 252 . 2 1 1 A 23 23 LEU HA H 253 3.710 4.212 -0.502 1
1 262 . 2 1 1 A 23 23 LEU CA C 253 56.510 58.077 -1.567 1
1 263 . 2 1 1 A 23 23 LEU CB C 253 41.190 41.979 -0.789 1
1 266 . 2 1 1 A 23 23 LEU N N 253 116.850 122.576 -5.726 1
1 267 . 2 1 1 A 24 24 LEU H H 254 7.370 7.432 -0.062 1
1 268 . 2 1 1 A 24 24 LEU HA H 254 4.310 4.776 -0.466 1
1 278 . 2 1 1 A 24 24 LEU CA C 254 54.890 56.365 -1.475 1
1 279 . 2 1 1 A 24 24 LEU CB C 254 41.960 42.463 -0.503 1
1 283 . 2 1 1 A 24 24 LEU N N 254 115.210 118.039 -2.829 1
1 284 . 2 1 1 A 25 25 ARG H H 255 7.520 7.321 0.199 1
1 285 . 2 1 1 A 25 25 ARG HA H 255 4.660 4.342 0.318 1
1 293 . 2 1 1 A 25 25 ARG CA C 255 52.840 54.559 -1.719 1
1 294 . 2 1 1 A 25 25 ARG CB C 255 28.130 29.706 -1.576 1
1 297 . 2 1 1 A 25 25 ARG N N 255 118.180 120.256 -2.076 1
1 298 . 2 1 1 A 26 26 PRO HA H 256 4.800 4.967 -0.167 1
1 305 . 2 1 1 A 26 26 PRO CA C 256 61.790 62.661 -0.871 1
1 306 . 2 1 1 A 26 26 PRO CB C 256 32.660 32.065 0.595 1
1 309 . 2 1 1 A 27 27 VAL H H 257 8.170 8.402 -0.232 1
1 310 . 2 1 1 A 27 27 VAL HA H 257 3.590 3.755 -0.165 1
1 318 . 2 1 1 A 27 27 VAL CA C 257 64.830 65.650 -0.820 1
1 319 . 2 1 1 A 27 27 VAL CB C 257 31.720 31.450 0.270 1
1 322 . 2 1 1 A 27 27 VAL N N 257 115.710 124.185 -8.475 1
1 323 . 2 1 1 A 28 28 ASP H H 258 8.240 8.017 0.223 1
1 324 . 2 1 1 A 28 28 ASP HA H 258 4.340 4.386 -0.046 1
1 327 . 2 1 1 A 28 28 ASP CA C 258 56.490 57.507 -1.017 1
1 328 . 2 1 1 A 28 28 ASP CB C 258 40.520 40.070 0.450 1
1 329 . 2 1 1 A 28 28 ASP N N 258 119.000 121.900 -2.900 1
1 330 . 2 1 1 A 29 29 ASP H H 259 8.000 8.808 -0.808 1
1 331 . 2 1 1 A 29 29 ASP HA H 259 4.390 4.613 -0.223 1
1 334 . 2 1 1 A 29 29 ASP CA C 259 56.210 55.776 0.434 1
1 335 . 2 1 1 A 29 29 ASP CB C 259 40.670 41.011 -0.341 1
1 336 . 2 1 1 A 29 29 ASP N N 259 118.900 117.585 1.315 1
1 337 . 2 1 1 A 30 30 LEU H H 260 7.760 7.524 0.236 1
1 338 . 2 1 1 A 30 30 LEU HA H 260 3.990 4.263 -0.273 1
1 348 . 2 1 1 A 30 30 LEU CA C 260 55.000 55.201 -0.201 1
1 349 . 2 1 1 A 30 30 LEU CB C 260 41.670 42.299 -0.629 1
1 353 . 2 1 1 A 30 30 LEU N N 260 116.300 121.180 -4.880 1
1 354 . 2 1 1 A 31 31 GLU H H 261 7.990 8.878 -0.888 1
1 355 . 2 1 1 A 31 31 GLU HA H 261 4.280 4.058 0.222 1
1 358 . 2 1 1 A 31 31 GLU CA C 261 56.860 58.974 -2.114 1
1 359 . 2 1 1 A 31 31 GLU CB C 261 27.010 29.641 -2.631 1
1 360 . 2 1 1 A 31 31 GLU N N 261 115.620 122.899 -7.279 1
1 361 . 2 1 1 A 32 32 LEU H H 262 8.000 7.391 0.609 1
1 362 . 2 1 1 A 32 32 LEU HA H 262 4.400 4.281 0.119 1
1 372 . 2 1 1 A 32 32 LEU CA C 262 53.860 54.899 -1.039 1
1 373 . 2 1 1 A 32 32 LEU CB C 262 44.450 42.240 2.210 1
1 377 . 2 1 1 A 32 32 LEU N N 262 118.860 122.473 -3.613 1
1 378 . 2 1 1 A 33 33 THR H H 263 10.020 8.662 1.358 1
1 379 . 2 1 1 A 33 33 THR HA H 263 4.130 4.696 -0.566 1
1 384 . 2 1 1 A 33 33 THR CA C 263 62.400 60.568 1.832 1
1 385 . 2 1 1 A 33 33 THR CB C 263 71.270 71.277 -0.007 1
1 387 . 2 1 1 A 33 33 THR N N 263 114.610 114.098 0.512 1
1 388 . 2 1 1 A 34 34 VAL H H 264 8.370 8.861 -0.491 1
1 389 . 2 1 1 A 34 34 VAL HA H 264 3.620 3.664 -0.044 1
1 397 . 2 1 1 A 34 34 VAL CA C 264 66.340 66.886 -0.546 1
1 398 . 2 1 1 A 34 34 VAL CB C 264 31.670 31.788 -0.118 1
1 401 . 2 1 1 A 34 34 VAL N N 264 122.110 122.477 -0.367 1
1 402 . 2 1 1 A 35 35 ARG H H 265 8.190 7.788 0.402 1
1 403 . 2 1 1 A 35 35 ARG HA H 265 4.070 3.920 0.150 1
1 411 . 2 1 1 A 35 35 ARG CA C 265 59.470 59.750 -0.280 1
1 412 . 2 1 1 A 35 35 ARG CB C 265 29.790 29.895 -0.105 1
1 415 . 2 1 1 A 35 35 ARG N N 265 117.340 121.008 -3.668 1
1 416 . 2 1 1 A 36 36 SER H H 266 7.610 7.771 -0.161 1
1 417 . 2 1 1 A 36 36 SER HA H 266 4.080 4.097 -0.017 1
1 420 . 2 1 1 A 36 36 SER CA C 266 63.080 61.604 1.476 1
1 421 . 2 1 1 A 36 36 SER CB C 266 63.280 63.002 0.278 1
1 422 . 2 1 1 A 36 36 SER N N 266 116.710 113.809 2.901 1
1 423 . 2 1 1 A 37 37 ALA H H 267 8.720 7.773 0.947 1
1 424 . 2 1 1 A 37 37 ALA HA H 267 3.760 4.004 -0.244 1
1 428 . 2 1 1 A 37 37 ALA CA C 267 55.900 55.331 0.569 1
1 429 . 2 1 1 A 37 37 ALA CB C 267 18.090 17.955 0.135 1
1 430 . 2 1 1 A 37 37 ALA N N 267 124.170 122.347 1.823 1
1 431 . 2 1 1 A 38 38 ASN H H 268 8.850 9.504 -0.654 1
1 432 . 2 1 1 A 38 38 ASN HA H 268 4.420 4.509 -0.089 1
1 437 . 2 1 1 A 38 38 ASN CA C 268 55.700 56.235 -0.535 1
1 438 . 2 1 1 A 38 38 ASN CB C 268 37.180 37.826 -0.646 1
1 439 . 2 1 1 A 38 38 ASN N N 268 117.370 117.551 -0.181 1
1 441 . 2 1 1 A 39 39 CYS H H 269 7.970 7.905 0.065 1
1 442 . 2 1 1 A 39 39 CYS HA H 269 4.190 4.123 0.067 1
1 445 . 2 1 1 A 39 39 CYS CA C 269 63.340 62.997 0.343 1
1 446 . 2 1 1 A 39 39 CYS CB C 269 26.870 27.500 -0.630 1
1 447 . 2 1 1 A 39 39 CYS N N 269 120.510 118.916 1.594 1
1 448 . 2 1 1 A 40 40 LEU H H 270 7.600 7.686 -0.086 1
1 449 . 2 1 1 A 40 40 LEU HA H 270 3.880 3.890 -0.010 1
1 458 . 2 1 1 A 40 40 LEU CA C 270 57.810 57.972 -0.162 1
1 459 . 2 1 1 A 40 40 LEU CB C 270 40.030 41.294 -1.264 1
1 462 . 2 1 1 A 40 40 LEU N N 270 117.710 120.498 -2.788 1
1 463 . 2 1 1 A 41 41 LYS H H 271 7.980 8.711 -0.731 1
1 464 . 2 1 1 A 41 41 LYS HA H 271 3.820 4.229 -0.409 1
1 472 . 2 1 1 A 41 41 LYS CA C 271 59.840 59.068 0.772 1
1 473 . 2 1 1 A 41 41 LYS CB C 271 32.070 32.097 -0.027 1
1 476 . 2 1 1 A 41 41 LYS N N 271 120.070 120.133 -0.063 1
1 477 . 2 1 1 A 42 42 ALA H H 272 7.860 8.652 -0.792 1
1 478 . 2 1 1 A 42 42 ALA HA H 272 4.140 4.019 0.121 1
1 482 . 2 1 1 A 42 42 ALA CA C 272 54.670 54.793 -0.123 1
1 483 . 2 1 1 A 42 42 ALA CB C 272 17.950 18.650 -0.700 1
1 484 . 2 1 1 A 42 42 ALA N N 272 122.880 121.616 1.264 1
1 485 . 2 1 1 A 43 43 GLU H H 273 7.210 7.895 -0.685 1
1 486 . 2 1 1 A 43 43 GLU HA H 273 4.260 4.415 -0.155 1
1 491 . 2 1 1 A 43 43 GLU CA C 273 55.020 55.870 -0.850 1
1 492 . 2 1 1 A 43 43 GLU CB C 273 29.880 29.498 0.382 1
1 494 . 2 1 1 A 43 43 GLU N N 273 116.590 115.427 1.163 1
1 495 . 2 1 1 A 44 44 ALA H H 274 7.880 8.259 -0.379 1
1 496 . 2 1 1 A 44 44 ALA HA H 274 3.680 3.796 -0.116 1
1 500 . 2 1 1 A 44 44 ALA CA C 274 52.960 53.049 -0.089 1
1 501 . 2 1 1 A 44 44 ALA CB C 274 16.110 17.234 -1.124 1
1 502 . 2 1 1 A 44 44 ALA N N 274 118.420 119.017 -0.597 1
1 503 . 2 1 1 A 45 45 ILE H H 275 7.600 7.346 0.254 1
1 504 . 2 1 1 A 45 45 ILE HA H 275 3.870 4.204 -0.334 1
1 514 . 2 1 1 A 45 45 ILE CA C 275 61.150 60.310 0.840 1
1 515 . 2 1 1 A 45 45 ILE CB C 275 37.090 39.165 -2.075 1
1 519 . 2 1 1 A 45 45 ILE N N 275 120.370 118.052 2.318 1
1 520 . 2 1 1 A 46 46 HIS H H 276 8.350 8.727 -0.377 1
1 521 . 2 1 1 A 46 46 HIS HA H 276 4.600 4.840 -0.240 1
1 526 . 2 1 1 A 46 46 HIS CA C 276 56.900 56.748 0.152 1
1 527 . 2 1 1 A 46 46 HIS CB C 276 31.910 31.224 0.686 1
1 529 . 2 1 1 A 46 46 HIS N N 276 123.250 125.546 -2.296 1
1 530 . 2 1 1 A 47 47 TYR H H 277 8.850 7.928 0.922 1
1 531 . 2 1 1 A 47 47 TYR HA H 277 5.100 4.925 0.175 1
1 538 . 2 1 1 A 47 47 TYR CA C 277 57.430 56.492 0.938 1
1 539 . 2 1 1 A 47 47 TYR CB C 277 40.680 40.900 -0.220 1
1 544 . 2 1 1 A 47 47 TYR N N 277 119.700 118.088 1.612 1
1 545 . 2 1 1 A 48 48 ILE H H 278 9.380 8.504 0.876 1
1 546 . 2 1 1 A 48 48 ILE HA H 278 3.340 3.639 -0.299 1
1 554 . 2 1 1 A 48 48 ILE CA C 278 67.640 64.950 2.690 1
1 555 . 2 1 1 A 48 48 ILE CB C 278 36.310 37.375 -1.065 1
1 558 . 2 1 1 A 48 48 ILE N N 278 125.650 124.534 1.116 1
1 559 . 2 1 1 A 49 49 GLY H H 279 9.430 8.011 1.419 1
1 560 . 2 1 1 A 49 49 GLY HA2 H 279 2.370 1.752 0.618 1
1 561 . 2 1 1 A 49 49 GLY HA3 H 279 3.230 3.226 0.004 1
1 562 . 2 1 1 A 49 49 GLY CA C 279 46.820 46.533 0.287 1
1 563 . 2 1 1 A 49 49 GLY N N 279 105.200 108.526 -3.326 1
1 564 . 2 1 1 A 50 50 ASP H H 280 7.050 7.368 -0.318 1
1 565 . 2 1 1 A 50 50 ASP HA H 280 4.360 4.067 0.293 1
1 568 . 2 1 1 A 50 50 ASP CA C 280 57.110 56.201 0.909 1
1 569 . 2 1 1 A 50 50 ASP CB C 280 42.620 40.496 2.124 1
1 570 . 2 1 1 A 50 50 ASP N N 280 116.360 120.936 -4.576 1
1 571 . 2 1 1 A 51 51 LEU H H 281 7.170 8.238 -1.068 1
1 572 . 2 1 1 A 51 51 LEU HA H 281 3.880 3.969 -0.089 1
1 582 . 2 1 1 A 51 51 LEU CA C 281 57.900 58.321 -0.421 1
1 583 . 2 1 1 A 51 51 LEU CB C 281 41.870 41.620 0.250 1
1 587 . 2 1 1 A 51 51 LEU N N 281 120.130 121.605 -1.475 1
1 588 . 2 1 1 A 52 52 VAL H H 282 7.820 7.579 0.241 1
1 589 . 2 1 1 A 52 52 VAL HA H 282 3.980 3.875 0.105 1
1 597 . 2 1 1 A 52 52 VAL CA C 282 64.000 65.620 -1.620 1
1 598 . 2 1 1 A 52 52 VAL CB C 282 30.400 31.425 -1.025 1
1 601 . 2 1 1 A 52 52 VAL N N 282 105.550 115.448 -9.898 1
1 602 . 2 1 1 A 53 53 GLN H H 283 6.550 7.796 -1.246 1
1 603 . 2 1 1 A 53 53 GLN HA H 283 4.680 4.045 0.635 1
1 610 . 2 1 1 A 53 53 GLN CA C 283 56.210 58.643 -2.433 1
1 611 . 2 1 1 A 53 53 GLN CB C 283 31.710 28.527 3.183 1
1 613 . 2 1 1 A 53 53 GLN N N 283 114.060 121.819 -7.759 1
1 615 . 2 1 1 A 54 54 ARG H H 284 7.690 7.539 0.151 1
1 616 . 2 1 1 A 54 54 ARG HA H 284 4.520 4.759 -0.239 1
1 624 . 2 1 1 A 54 54 ARG CA C 284 54.600 54.314 0.286 1
1 625 . 2 1 1 A 54 54 ARG CB C 284 30.750 32.943 -2.193 1
1 628 . 2 1 1 A 54 54 ARG N N 284 119.810 118.284 1.526 1
1 629 . 2 1 1 A 55 55 THR H H 285 8.110 8.579 -0.469 1
1 630 . 2 1 1 A 55 55 THR HA H 285 4.430 4.280 0.150 1
1 635 . 2 1 1 A 55 55 THR CA C 285 59.640 63.992 -4.352 1
1 636 . 2 1 1 A 55 55 THR CB C 285 71.310 69.192 2.118 1
1 638 . 2 1 1 A 55 55 THR N N 285 108.450 119.333 -10.883 1
1 639 . 2 1 1 A 56 56 GLU H H 286 8.910 9.017 -0.107 1
1 640 . 2 1 1 A 56 56 GLU HA H 286 3.660 3.924 -0.264 1
1 645 . 2 1 1 A 56 56 GLU CA C 286 60.650 59.839 0.811 1
1 646 . 2 1 1 A 56 56 GLU CB C 286 29.400 29.292 0.108 1
1 648 . 2 1 1 A 56 56 GLU N N 286 120.600 126.550 -5.950 1
1 649 . 2 1 1 A 57 57 VAL H H 287 7.600 8.097 -0.497 1
1 650 . 2 1 1 A 57 57 VAL HA H 287 3.620 3.518 0.102 1
1 658 . 2 1 1 A 57 57 VAL CA C 287 66.020 67.171 -1.151 1
1 659 . 2 1 1 A 57 57 VAL CB C 287 31.720 31.523 0.197 1
1 662 . 2 1 1 A 57 57 VAL N N 287 114.050 119.783 -5.733 1
1 663 . 2 1 1 A 58 58 GLU H H 288 7.350 8.241 -0.891 1
1 664 . 2 1 1 A 58 58 GLU HA H 288 3.830 4.066 -0.236 1
1 669 . 2 1 1 A 58 58 GLU CA C 288 59.250 59.675 -0.425 1
1 670 . 2 1 1 A 58 58 GLU CB C 288 30.030 29.284 0.746 1
1 672 . 2 1 1 A 58 58 GLU N N 288 117.610 118.891 -1.281 1
1 673 . 2 1 1 A 59 59 LEU H H 289 7.850 7.725 0.125 1
1 674 . 2 1 1 A 59 59 LEU HA H 289 4.150 4.125 0.025 1
1 683 . 2 1 1 A 59 59 LEU CA C 289 57.340 57.312 0.028 1
1 684 . 2 1 1 A 59 59 LEU CB C 289 41.170 41.685 -0.515 1
1 687 . 2 1 1 A 59 59 LEU N N 289 120.050 120.378 -0.328 1
1 688 . 2 1 1 A 60 60 LEU H H 290 7.670 8.718 -1.048 1
1 689 . 2 1 1 A 60 60 LEU HA H 290 4.540 3.995 0.545 1
1 696 . 2 1 1 A 60 60 LEU CA C 290 55.090 57.069 -1.979 1
1 697 . 2 1 1 A 60 60 LEU CB C 290 42.320 41.412 0.908 1
1 701 . 2 1 1 A 60 60 LEU N N 290 114.980 119.026 -4.046 1
1 702 . 2 1 1 A 61 61 LYS H H 291 7.440 7.317 0.123 1
1 703 . 2 1 1 A 61 61 LYS HA H 291 4.280 4.286 -0.006 1
1 710 . 2 1 1 A 61 61 LYS CA C 291 56.860 57.752 -0.892 1
1 711 . 2 1 1 A 61 61 LYS CB C 291 31.900 32.791 -0.891 1
1 714 . 2 1 1 A 61 61 LYS N N 291 118.120 116.545 1.575 1
1 715 . 2 1 1 A 62 62 THR H H 292 7.310 7.925 -0.615 1
1 716 . 2 1 1 A 62 62 THR HA H 292 5.220 4.381 0.839 1
1 721 . 2 1 1 A 62 62 THR CA C 292 55.830 61.367 -5.537 1
1 722 . 2 1 1 A 62 62 THR CB C 292 69.970 69.203 0.767 1
1 724 . 2 1 1 A 62 62 THR N N 292 111.890 115.619 -3.729 1
1 725 . 2 1 1 A 63 63 PRO HA H 293 4.570 4.589 -0.019 1
1 730 . 2 1 1 A 63 63 PRO CA C 293 63.710 64.361 -0.651 1
1 731 . 2 1 1 A 63 63 PRO CB C 293 32.380 31.766 0.614 1
1 733 . 2 1 1 A 64 64 ASN H H 294 8.050 8.558 -0.508 1
1 734 . 2 1 1 A 64 64 ASN HA H 294 4.490 4.703 -0.213 1
1 739 . 2 1 1 A 64 64 ASN CA C 294 55.630 53.520 2.110 1
1 740 . 2 1 1 A 64 64 ASN CB C 294 38.730 38.817 -0.087 1
1 741 . 2 1 1 A 64 64 ASN N N 294 117.120 115.904 1.216 1
1 743 . 2 1 1 A 65 65 LEU H H 295 7.550 6.998 0.552 1
1 744 . 2 1 1 A 65 65 LEU HA H 295 4.640 4.336 0.304 1
1 754 . 2 1 1 A 65 65 LEU CA C 295 54.310 54.310 0.000 1
1 755 . 2 1 1 A 65 65 LEU CB C 295 43.640 42.368 1.272 1
1 758 . 2 1 1 A 65 65 LEU N N 295 119.930 121.221 -1.291 1
1 759 . 2 1 1 A 66 66 GLY H H 296 7.850 9.206 -1.356 1
1 760 . 2 1 1 A 66 66 GLY HA2 H 296 3.810 4.307 -0.497 1
1 761 . 2 1 1 A 66 66 GLY HA3 H 296 4.110 4.307 -0.197 1
1 762 . 2 1 1 A 66 66 GLY CA C 296 43.570 44.250 -0.680 1
1 763 . 2 1 1 A 66 66 GLY N N 296 108.840 109.499 -0.659 1
1 764 . 2 1 1 A 67 67 LYS H H 297 8.820 8.917 -0.097 1
1 765 . 2 1 1 A 67 67 LYS HA H 297 3.980 3.901 0.079 1
1 774 . 2 1 1 A 67 67 LYS CA C 297 60.100 59.557 0.543 1
1 775 . 2 1 1 A 67 67 LYS CB C 297 32.100 32.187 -0.087 1
1 779 . 2 1 1 A 67 67 LYS N N 297 120.130 122.361 -2.231 1
1 780 . 2 1 1 A 68 68 LYS H H 298 8.850 8.000 0.850 1
1 781 . 2 1 1 A 68 68 LYS HA H 298 4.060 4.137 -0.077 1
1 790 . 2 1 1 A 68 68 LYS CA C 298 60.600 59.122 1.478 1
1 791 . 2 1 1 A 68 68 LYS CB C 298 31.920 31.841 0.079 1
1 795 . 2 1 1 A 68 68 LYS N N 298 119.580 119.136 0.444 1
1 796 . 2 1 1 A 69 69 SER H H 299 8.100 8.271 -0.171 1
1 797 . 2 1 1 A 69 69 SER HA H 299 4.370 4.240 0.130 1
1 800 . 2 1 1 A 69 69 SER CA C 299 61.980 61.434 0.546 1
1 801 . 2 1 1 A 69 69 SER CB C 299 63.000 62.620 0.380 1
1 802 . 2 1 1 A 69 69 SER N N 299 116.360 115.397 0.963 1
1 803 . 2 1 1 A 70 70 LEU H H 300 8.240 8.665 -0.425 1
1 804 . 2 1 1 A 70 70 LEU HA H 300 3.970 3.950 0.020 1
1 814 . 2 1 1 A 70 70 LEU CA C 300 57.610 58.079 -0.469 1
1 815 . 2 1 1 A 70 70 LEU CB C 300 41.060 41.523 -0.463 1
1 819 . 2 1 1 A 70 70 LEU N N 300 123.330 122.979 0.351 1
1 820 . 2 1 1 A 71 71 THR H H 301 8.550 8.120 0.430 1
1 821 . 2 1 1 A 71 71 THR HA H 301 3.690 3.841 -0.151 1
1 826 . 2 1 1 A 71 71 THR CA C 301 67.170 66.740 0.430 1
1 827 . 2 1 1 A 71 71 THR CB C 301 68.810 68.436 0.374 1
1 829 . 2 1 1 A 71 71 THR N N 301 116.520 115.822 0.698 1
1 830 . 2 1 1 A 72 72 GLU H H 302 7.520 7.739 -0.219 1
1 831 . 2 1 1 A 72 72 GLU HA H 302 4.070 3.984 0.086 1
1 836 . 2 1 1 A 72 72 GLU CA C 302 59.470 59.382 0.088 1
1 837 . 2 1 1 A 72 72 GLU CB C 302 29.090 29.272 -0.182 1
1 839 . 2 1 1 A 72 72 GLU N N 302 121.510 120.979 0.531 1
1 840 . 2 1 1 A 73 73 ILE H H 303 8.290 8.124 0.166 1
1 841 . 2 1 1 A 73 73 ILE HA H 303 3.380 3.595 -0.215 1
1 849 . 2 1 1 A 73 73 ILE CA C 303 66.010 65.540 0.470 1
1 850 . 2 1 1 A 73 73 ILE CB C 303 38.680 37.827 0.853 1
1 853 . 2 1 1 A 73 73 ILE N N 303 118.510 120.250 -1.740 1
1 854 . 2 1 1 A 74 74 LYS H H 304 8.550 7.939 0.611 1
1 855 . 2 1 1 A 74 74 LYS HA H 304 3.680 3.964 -0.284 1
1 864 . 2 1 1 A 74 74 LYS CA C 304 61.320 59.929 1.391 1
1 865 . 2 1 1 A 74 74 LYS CB C 304 32.060 32.083 -0.023 1
1 868 . 2 1 1 A 74 74 LYS N N 304 118.220 118.771 -0.551 1
1 869 . 2 1 1 A 75 75 ASP H H 305 8.450 7.810 0.640 1
1 870 . 2 1 1 A 75 75 ASP HA H 305 4.440 4.469 -0.029 1
1 873 . 2 1 1 A 75 75 ASP CA C 305 57.690 57.477 0.213 1
1 874 . 2 1 1 A 75 75 ASP CB C 305 40.220 40.996 -0.776 1
1 875 . 2 1 1 A 75 75 ASP N N 305 121.790 119.788 2.002 1
1 876 . 2 1 1 A 76 76 VAL H H 306 8.680 7.689 0.991 1
1 877 . 2 1 1 A 76 76 VAL HA H 306 3.890 3.554 0.336 1
1 885 . 2 1 1 A 76 76 VAL CA C 306 66.020 66.512 -0.492 1
1 886 . 2 1 1 A 76 76 VAL CB C 306 31.250 31.489 -0.239 1
1 889 . 2 1 1 A 76 76 VAL N N 306 121.150 120.310 0.840 1
1 890 . 2 1 1 A 77 77 LEU H H 307 8.470 8.224 0.246 1
1 891 . 2 1 1 A 77 77 LEU HA H 307 3.810 4.050 -0.240 1
1 901 . 2 1 1 A 77 77 LEU CA C 307 58.330 57.495 0.835 1
1 902 . 2 1 1 A 77 77 LEU CB C 307 41.250 41.154 0.096 1
1 906 . 2 1 1 A 77 77 LEU N N 307 120.830 118.380 2.450 1
1 907 . 2 1 1 A 78 78 ALA H H 308 8.280 8.348 -0.068 1
1 908 . 2 1 1 A 78 78 ALA HA H 308 4.320 4.104 0.216 1
1 912 . 2 1 1 A 78 78 ALA CA C 308 55.420 54.891 0.529 1
1 913 . 2 1 1 A 78 78 ALA CB C 308 17.750 17.963 -0.213 1
1 914 . 2 1 1 A 78 78 ALA N N 308 122.530 123.559 -1.029 1
1 915 . 2 1 1 A 79 79 SER H H 309 7.900 7.900 0.000 1
1 916 . 2 1 1 A 79 79 SER HA H 309 4.340 4.341 -0.001 1
1 919 . 2 1 1 A 79 79 SER CA C 309 61.350 60.233 1.117 1
1 920 . 2 1 1 A 79 79 SER CB C 309 63.280 63.642 -0.362 1
1 921 . 2 1 1 A 79 79 SER N N 309 115.600 113.487 2.113 1
1 922 . 2 1 1 A 80 80 ARG H H 310 7.450 8.291 -0.841 1
1 923 . 2 1 1 A 80 80 ARG HA H 310 4.550 3.998 0.552 1
1 931 . 2 1 1 A 80 80 ARG CA C 310 54.200 57.490 -3.290 1
1 932 . 2 1 1 A 80 80 ARG CB C 310 30.680 29.919 0.761 1
1 935 . 2 1 1 A 80 80 ARG N N 310 119.360 119.977 -0.617 1
1 936 . 2 1 1 A 81 81 GLY H H 311 7.940 8.264 -0.324 1
1 937 . 2 1 1 A 81 81 GLY HA2 H 311 3.840 3.962 -0.122 1
1 938 . 2 1 1 A 81 81 GLY HA3 H 311 4.070 3.964 0.106 1
1 939 . 2 1 1 A 81 81 GLY CA C 311 46.060 45.338 0.722 1
1 940 . 2 1 1 A 81 81 GLY N N 311 108.130 106.287 1.843 1
1 941 . 2 1 1 A 82 82 LEU H H 312 7.920 7.344 0.576 1
1 942 . 2 1 1 A 82 82 LEU HA H 312 4.680 4.751 -0.071 1
1 952 . 2 1 1 A 82 82 LEU CA C 312 53.070 53.095 -0.025 1
1 953 . 2 1 1 A 82 82 LEU CB C 312 45.790 45.604 0.186 1
1 957 . 2 1 1 A 82 82 LEU N N 312 119.290 117.373 1.917 1
1 958 . 2 1 1 A 83 83 SER H H 313 7.530 8.780 -1.250 1
1 959 . 2 1 1 A 83 83 SER HA H 313 4.450 4.078 0.372 1
1 962 . 2 1 1 A 83 83 SER CA C 313 57.190 58.877 -1.687 1
1 963 . 2 1 1 A 83 83 SER CB C 313 66.080 61.554 4.526 1
1 964 . 2 1 1 A 83 83 SER N N 313 113.120 114.845 -1.725 1
1 965 . 2 1 1 A 84 84 LEU H H 314 8.340 8.429 -0.089 1
1 966 . 2 1 1 A 84 84 LEU HA H 314 4.620 4.414 0.206 1
1 976 . 2 1 1 A 84 84 LEU CA C 314 54.720 54.851 -0.131 1
1 977 . 2 1 1 A 84 84 LEU CB C 314 41.620 42.202 -0.582 1
1 981 . 2 1 1 A 84 84 LEU N N 314 115.930 119.010 -3.080 1
1 982 . 2 1 1 A 85 85 GLY H H 315 8.270 7.861 0.409 1
1 983 . 2 1 1 A 85 85 GLY HA2 H 315 3.320 3.960 -0.640 1
1 984 . 2 1 1 A 85 85 GLY HA3 H 315 3.850 3.963 -0.113 1
1 985 . 2 1 1 A 85 85 GLY CA C 315 46.560 46.648 -0.088 1
1 986 . 2 1 1 A 85 85 GLY N N 315 111.010 108.286 2.724 1
1 987 . 2 1 1 A 86 86 MET H H 316 8.650 7.900 0.750 1
1 988 . 2 1 1 A 86 86 MET HA H 316 3.990 5.042 -1.052 1
1 996 . 2 1 1 A 86 86 MET CA C 316 56.730 53.043 3.687 1
1 997 . 2 1 1 A 86 86 MET CB C 316 33.600 35.795 -2.195 1
1 1000 . 2 1 1 A 86 86 MET N N 316 120.570 116.829 3.741 1
1 1001 . 2 1 1 A 87 87 ARG H H 317 8.360 8.709 -0.349 1
1 1002 . 2 1 1 A 87 87 ARG HA H 317 4.450 5.272 -0.822 1
1 1010 . 2 1 1 A 87 87 ARG CA C 317 55.310 54.566 0.744 1
1 1011 . 2 1 1 A 87 87 ARG CB C 317 30.490 34.147 -3.657 1
1 1014 . 2 1 1 A 87 87 ARG N N 317 122.290 118.871 3.419 1
1 1015 . 2 1 1 A 88 88 LEU H H 318 8.400 8.838 -0.438 1
1 1016 . 2 1 1 A 88 88 LEU HA H 318 4.670 4.936 -0.266 1
1 1026 . 2 1 1 A 88 88 LEU CA C 318 53.110 53.136 -0.026 1
1 1027 . 2 1 1 A 88 88 LEU CB C 318 43.600 45.156 -1.556 1
1 1031 . 2 1 1 A 88 88 LEU N N 318 126.420 124.337 2.083 1
1 1032 . 2 1 1 A 89 89 GLU H H 319 8.780 8.986 -0.206 1
1 1033 . 2 1 1 A 89 89 GLU HA H 319 4.340 3.996 0.344 1
1 1038 . 2 1 1 A 89 89 GLU CA C 319 56.490 59.446 -2.956 1
1 1039 . 2 1 1 A 89 89 GLU CB C 319 30.470 29.483 0.987 1
1 1041 . 2 1 1 A 89 89 GLU N N 319 123.070 122.293 0.777 1
1 1042 . 2 1 1 A 90 90 ASN H H 320 8.900 8.272 0.628 1
1 1043 . 2 1 1 A 90 90 ASN HA H 320 4.410 4.990 -0.580 1
1 1048 . 2 1 1 A 90 90 ASN CA C 320 54.120 54.092 0.028 1
1 1049 . 2 1 1 A 90 90 ASN CB C 320 37.640 40.043 -2.403 1
1 1050 . 2 1 1 A 90 90 ASN N N 320 116.540 113.306 3.234 1
1 1052 . 2 1 1 A 91 91 TRP H H 321 7.990 7.370 0.620 1
1 1053 . 2 1 1 A 91 91 TRP HA H 321 4.330 4.728 -0.398 1
1 1062 . 2 1 1 A 91 91 TRP CA C 321 54.590 58.395 -3.805 1
1 1063 . 2 1 1 A 91 91 TRP CB C 321 31.280 31.145 0.135 1
1 1069 . 2 1 1 A 91 91 TRP N N 321 119.230 114.624 4.606 1
1 1071 . 2 1 1 A 92 92 PRO HA H 322 4.800 3.860 0.940 1
1 1077 . 2 1 1 A 93 93 PRO HA H 323 4.450 4.395 0.055 1
1 1084 . 2 1 1 A 93 93 PRO CA C 323 61.970 62.391 -0.421 1
1 1085 . 2 1 1 A 93 93 PRO CB C 323 32.830 32.373 0.457 1
1 1088 . 2 1 1 A 94 94 ALA H H 324 8.460 8.668 -0.208 1
1 1089 . 2 1 1 A 94 94 ALA HA H 324 4.000 3.975 0.025 1
1 1093 . 2 1 1 A 94 94 ALA CA C 324 53.790 54.503 -0.713 1
1 1094 . 2 1 1 A 94 94 ALA CB C 324 18.640 18.328 0.312 1
1 1095 . 2 1 1 A 94 94 ALA N N 324 124.010 126.083 -2.073 1
1 1096 . 2 1 1 A 95 95 SER H H 325 7.950 8.387 -0.437 1
1 1097 . 2 1 1 A 95 95 SER HA H 325 4.210 4.251 -0.041 1
1 1100 . 2 1 1 A 95 95 SER CA C 325 58.970 61.429 -2.459 1
1 1101 . 2 1 1 A 95 95 SER CB C 325 63.040 62.739 0.301 1
1 1102 . 2 1 1 A 95 95 SER N N 325 111.520 112.650 -1.130 1
1 1103 . 2 1 1 A 96 96 ILE H H 326 7.480 7.714 -0.234 1
1 1104 . 2 1 1 A 96 96 ILE HA H 326 4.170 3.801 0.369 1
1 1114 . 2 1 1 A 96 96 ILE CA C 326 61.300 65.489 -4.189 1
1 1115 . 2 1 1 A 96 96 ILE CB C 326 38.530 37.252 1.278 1
1 1119 . 2 1 1 A 96 96 ILE N N 326 119.650 123.155 -3.505 1
1 1120 . 2 1 1 A 97 97 ALA H H 327 7.860 8.260 -0.400 1
1 1121 . 2 1 1 A 97 97 ALA HA H 327 4.230 3.995 0.235 1
1 1125 . 2 1 1 A 97 97 ALA CA C 327 52.570 55.220 -2.650 1
1 1126 . 2 1 1 A 97 97 ALA CB C 327 19.590 18.045 1.545 1
1 1127 . 2 1 1 A 97 97 ALA N N 327 126.480 121.755 4.725 1
1 1128 . 2 1 1 A 98 98 ASP H H 328 8.250 8.093 0.157 1
1 1129 . 2 1 1 A 98 98 ASP HA H 328 4.540 4.316 0.224 1
1 1132 . 2 1 1 A 98 98 ASP CA C 328 54.150 57.315 -3.165 1
1 1133 . 2 1 1 A 98 98 ASP CB C 328 41.120 40.657 0.463 1
1 1134 . 2 1 1 A 98 98 ASP N N 328 120.130 119.034 1.096 1
1 1150 . 2 2 2 B 6 6 ASP H H 427 8.160 7.893 0.267 1
1 1151 . 2 2 2 B 6 6 ASP HA H 427 4.630 4.330 0.300 1
1 1154 . 2 2 2 B 6 6 ASP CA C 427 54.410 56.717 -2.307 1
1 1155 . 2 2 2 B 6 6 ASP CB C 427 41.250 40.836 0.414 1
1 1156 . 2 2 2 B 6 6 ASP N N 427 120.160 121.215 -1.055 1
1 1157 . 2 2 2 B 7 7 ASN H H 428 8.350 7.716 0.634 1
1 1158 . 2 2 2 B 7 7 ASN HA H 428 4.550 4.830 -0.280 1
1 1163 . 2 2 2 B 7 7 ASN CA C 428 53.310 53.868 -0.558 1
1 1164 . 2 2 2 B 7 7 ASN CB C 428 38.850 38.872 -0.022 1
1 1165 . 2 2 2 B 7 7 ASN N N 428 118.440 115.269 3.171 1
1 1167 . 2 2 2 B 8 8 LYS H H 429 8.030 7.716 0.314 1
1 1172 . 2 2 2 B 8 8 LYS CB C 429 33.280 33.315 -0.035 1
1 1174 . 2 2 2 B 8 8 LYS N N 429 120.260 122.569 -2.309 1
1 1175 . 2 2 2 B 9 9 PRO HA H 430 4.420 4.508 -0.088 1
1 1182 . 2 2 2 B 9 9 PRO CA C 430 62.280 62.697 -0.417 1
1 1183 . 2 2 2 B 9 9 PRO CB C 430 31.920 32.476 -0.556 1
1 1186 . 2 2 2 B 10 10 ALA H H 431 8.930 9.391 -0.461 1
1 1187 . 2 2 2 B 10 10 ALA HA H 431 4.350 4.503 -0.153 1
1 1191 . 2 2 2 B 10 10 ALA CA C 431 51.070 51.984 -0.914 1
1 1192 . 2 2 2 B 10 10 ALA CB C 431 20.920 19.512 1.408 1
1 1193 . 2 2 2 B 10 10 ALA N N 431 125.000 124.904 0.096 1
1 1194 . 2 2 2 B 11 11 ASP H H 432 8.530 9.266 -0.736 1
1 1195 . 2 2 2 B 11 11 ASP HA H 432 4.220 4.287 -0.067 1
1 1198 . 2 2 2 B 11 11 ASP CA C 432 57.520 57.625 -0.105 1
1 1199 . 2 2 2 B 11 11 ASP CB C 432 40.470 40.319 0.151 1
1 1200 . 2 2 2 B 11 11 ASP N N 432 119.610 122.808 -3.198 1
1 1201 . 2 2 2 B 12 12 ASP H H 433 8.340 7.974 0.366 1
1 1202 . 2 2 2 B 12 12 ASP HA H 433 4.160 4.466 -0.306 1
1 1205 . 2 2 2 B 12 12 ASP CA C 433 56.090 57.595 -1.505 1
1 1206 . 2 2 2 B 12 12 ASP CB C 433 38.960 40.690 -1.730 1
1 1207 . 2 2 2 B 12 12 ASP N N 433 116.330 119.445 -3.115 1
1 1208 . 2 2 2 B 13 13 LEU H H 434 7.360 7.791 -0.431 1
1 1209 . 2 2 2 B 13 13 LEU HA H 434 4.050 4.089 -0.039 1
1 1219 . 2 2 2 B 13 13 LEU CA C 434 57.340 57.440 -0.100 1
1 1220 . 2 2 2 B 13 13 LEU CB C 434 42.960 41.340 1.620 1
1 1224 . 2 2 2 B 13 13 LEU N N 434 123.440 121.296 2.144 1
1 1225 . 2 2 2 B 14 14 LEU H H 435 7.670 7.605 0.065 1
1 1226 . 2 2 2 B 14 14 LEU HA H 435 3.710 4.079 -0.369 1
1 1236 . 2 2 2 B 14 14 LEU CA C 435 57.170 57.085 0.085 1
1 1237 . 2 2 2 B 14 14 LEU CB C 435 42.590 42.138 0.452 1
1 1241 . 2 2 2 B 14 14 LEU N N 435 115.170 119.611 -4.441 1
1 1242 . 2 2 2 B 15 15 ASN H H 436 7.490 8.308 -0.818 1
1 1243 . 2 2 2 B 15 15 ASN HA H 436 4.640 4.690 -0.050 1
1 1248 . 2 2 2 B 15 15 ASN CA C 436 52.920 54.669 -1.749 1
1 1249 . 2 2 2 B 15 15 ASN CB C 436 39.350 38.752 0.598 1
1 1250 . 2 2 2 B 15 15 ASN N N 436 112.280 115.415 -3.135 1
1 1252 . 2 2 2 B 16 16 LEU H H 437 7.300 7.422 -0.122 1
1 1253 . 2 2 2 B 16 16 LEU HA H 437 4.100 4.184 -0.084 1
1 1263 . 2 2 2 B 16 16 LEU CA C 437 55.310 55.346 -0.036 1
1 1264 . 2 2 2 B 16 16 LEU CB C 437 41.800 43.000 -1.200 1
1 1268 . 2 2 2 B 16 16 LEU N N 437 125.180 122.950 2.230 1
1 1269 . 2 2 2 B 17 17 GLU H H 438 8.590 8.777 -0.187 1
1 1270 . 2 2 2 B 17 17 GLU HA H 438 3.920 4.040 -0.120 1
1 1275 . 2 2 2 B 17 17 GLU CA C 438 58.440 57.995 0.445 1
1 1276 . 2 2 2 B 17 17 GLU CB C 438 29.180 29.727 -0.547 1
1 1278 . 2 2 2 B 17 17 GLU N N 438 129.850 125.822 4.028 1
1 1279 . 2 2 2 B 18 18 GLY H H 439 8.580 8.929 -0.349 1
1 1280 . 2 2 2 B 18 18 GLY HA2 H 439 3.570 3.932 -0.362 1
1 1281 . 2 2 2 B 18 18 GLY HA3 H 439 4.220 3.935 0.285 1
1 1282 . 2 2 2 B 18 18 GLY CA C 439 44.710 45.451 -0.741 1
1 1283 . 2 2 2 B 18 18 GLY N N 439 112.250 114.836 -2.586 1
1 1284 . 2 2 2 B 19 19 VAL H H 440 7.900 7.762 0.138 1
1 1285 . 2 2 2 B 19 19 VAL HA H 440 3.950 4.462 -0.512 1
1 1293 . 2 2 2 B 19 19 VAL CA C 440 62.820 60.940 1.880 1
1 1294 . 2 2 2 B 19 19 VAL CB C 440 31.470 34.690 -3.220 1
1 1297 . 2 2 2 B 19 19 VAL N N 440 121.910 121.861 0.049 1
1 1298 . 2 2 2 B 20 20 ASP H H 441 7.390 8.941 -1.551 1
1 1299 . 2 2 2 B 20 20 ASP HA H 441 4.820 4.850 -0.030 1
1 1302 . 2 2 2 B 20 20 ASP CA C 441 51.920 53.039 -1.119 1
1 1303 . 2 2 2 B 20 20 ASP CB C 441 42.090 41.998 0.092 1
1 1304 . 2 2 2 B 20 20 ASP N N 441 124.850 126.117 -1.267 1
1 1305 . 2 2 2 B 21 21 ARG H H 442 8.630 8.658 -0.028 1
1 1306 . 2 2 2 B 21 21 ARG HA H 442 3.810 3.438 0.372 1
1 1313 . 2 2 2 B 21 21 ARG CA C 442 60.710 59.922 0.788 1
1 1314 . 2 2 2 B 21 21 ARG CB C 442 30.020 29.856 0.164 1
1 1317 . 2 2 2 B 21 21 ARG N N 442 120.890 122.337 -1.447 1
1 1318 . 2 2 2 B 22 22 ASP H H 443 8.140 7.928 0.212 1
1 1319 . 2 2 2 B 22 22 ASP HA H 443 4.420 4.389 0.031 1
1 1322 . 2 2 2 B 22 22 ASP CA C 443 57.680 56.941 0.739 1
1 1323 . 2 2 2 B 22 22 ASP CB C 443 40.880 40.848 0.032 1
1 1324 . 2 2 2 B 22 22 ASP N N 443 116.750 119.892 -3.142 1
1 1325 . 2 2 2 B 23 23 LEU H H 444 8.170 8.015 0.155 1
1 1326 . 2 2 2 B 23 23 LEU HA H 444 4.130 3.890 0.240 1
1 1336 . 2 2 2 B 23 23 LEU CA C 444 57.770 57.858 -0.088 1
1 1337 . 2 2 2 B 23 23 LEU CB C 444 41.230 41.454 -0.224 1
1 1341 . 2 2 2 B 23 23 LEU N N 444 122.130 119.543 2.587 1
1 1342 . 2 2 2 B 24 24 ALA H H 445 8.630 8.435 0.195 1
1 1343 . 2 2 2 B 24 24 ALA HA H 445 3.790 4.012 -0.222 1
1 1347 . 2 2 2 B 24 24 ALA CA C 445 55.810 54.417 1.393 1
1 1348 . 2 2 2 B 24 24 ALA CB C 445 18.060 17.918 0.142 1
1 1349 . 2 2 2 B 24 24 ALA N N 445 120.890 120.326 0.564 1
1 1350 . 2 2 2 B 25 25 PHE H H 446 8.160 7.264 0.896 1
1 1351 . 2 2 2 B 25 25 PHE HA H 446 4.080 4.314 -0.234 1
1 1358 . 2 2 2 B 25 25 PHE CA C 446 62.670 61.698 0.972 1
1 1359 . 2 2 2 B 25 25 PHE CB C 446 39.440 38.520 0.920 1
1 1364 . 2 2 2 B 25 25 PHE N N 446 115.360 116.126 -0.766 1
1 1365 . 2 2 2 B 26 26 LYS H H 447 8.040 7.840 0.200 1
1 1366 . 2 2 2 B 26 26 LYS HA H 447 4.110 4.015 0.095 1
1 1375 . 2 2 2 B 26 26 LYS CA C 447 60.140 59.303 0.837 1
1 1376 . 2 2 2 B 26 26 LYS CB C 447 32.880 32.268 0.612 1
1 1380 . 2 2 2 B 26 26 LYS N N 447 123.110 118.544 4.566 1
1 1381 . 2 2 2 B 27 27 LEU H H 448 8.630 8.209 0.421 1
1 1382 . 2 2 2 B 27 27 LEU HA H 448 3.840 4.075 -0.235 1
1 1392 . 2 2 2 B 27 27 LEU CA C 448 58.210 57.664 0.546 1
1 1393 . 2 2 2 B 27 27 LEU CB C 448 39.760 41.418 -1.658 1
1 1396 . 2 2 2 B 27 27 LEU N N 448 120.890 121.388 -0.498 1
1 1397 . 2 2 2 B 28 28 ALA H H 449 8.200 8.631 -0.431 1
1 1398 . 2 2 2 B 28 28 ALA HA H 449 3.760 4.566 -0.806 1
1 1402 . 2 2 2 B 28 28 ALA CA C 449 54.750 55.175 -0.425 1
1 1403 . 2 2 2 B 28 28 ALA CB C 449 18.050 18.261 -0.211 1
1 1404 . 2 2 2 B 28 28 ALA N N 449 123.710 120.667 3.043 1
1 1405 . 2 2 2 B 29 29 ALA H H 450 7.780 8.040 -0.260 1
1 1406 . 2 2 2 B 29 29 ALA HA H 450 4.170 4.083 0.087 1
1 1410 . 2 2 2 B 29 29 ALA CA C 450 54.430 54.581 -0.151 1
1 1411 . 2 2 2 B 29 29 ALA CB C 450 18.040 18.473 -0.433 1
1 1412 . 2 2 2 B 29 29 ALA N N 450 121.020 119.512 1.508 1
1 1413 . 2 2 2 B 30 30 ARG H H 451 7.390 7.483 -0.093 1
1 1414 . 2 2 2 B 30 30 ARG HA H 451 4.540 4.447 0.093 1
1 1421 . 2 2 2 B 30 30 ARG CA C 451 54.510 55.639 -1.129 1
1 1422 . 2 2 2 B 30 30 ARG CB C 451 29.950 29.942 0.008 1
1 1425 . 2 2 2 B 30 30 ARG N N 451 115.480 116.634 -1.154 1
1 1426 . 2 2 2 B 31 31 GLY H H 452 7.950 8.023 -0.073 1
1 1427 . 2 2 2 B 31 31 GLY HA2 H 452 3.550 3.981 -0.431 1
1 1428 . 2 2 2 B 31 31 GLY HA3 H 452 4.200 3.983 0.217 1
1 1429 . 2 2 2 B 31 31 GLY CA C 452 45.380 45.403 -0.023 1
1 1430 . 2 2 2 B 31 31 GLY N N 452 107.740 108.171 -0.431 1
1 1431 . 2 2 2 B 32 32 VAL H H 453 7.990 7.699 0.291 1
1 1432 . 2 2 2 B 32 32 VAL HA H 453 3.930 3.939 -0.009 1
1 1440 . 2 2 2 B 32 32 VAL CA C 453 61.420 62.801 -1.381 1
1 1441 . 2 2 2 B 32 32 VAL CB C 453 29.860 31.949 -2.089 1
1 1444 . 2 2 2 B 32 32 VAL N N 453 125.560 120.481 5.079 1
1 1445 . 2 2 2 B 33 33 CYS H H 454 8.460 9.001 -0.541 1
1 1446 . 2 2 2 B 33 33 CYS HA H 454 4.310 4.826 -0.516 1
1 1449 . 2 2 2 B 33 33 CYS CA C 454 60.260 59.815 0.445 1
1 1450 . 2 2 2 B 33 33 CYS CB C 454 30.330 30.615 -0.285 1
1 1451 . 2 2 2 B 33 33 CYS N N 454 119.460 125.151 -5.691 1
1 1452 . 2 2 2 B 34 34 THR H H 455 8.080 7.858 0.222 1
1 1453 . 2 2 2 B 34 34 THR HA H 455 4.840 4.721 0.119 1
1 1458 . 2 2 2 B 34 34 THR CA C 455 58.650 61.129 -2.479 1
1 1459 . 2 2 2 B 34 34 THR CB C 455 72.680 71.499 1.181 1
1 1461 . 2 2 2 B 34 34 THR N N 455 108.420 113.760 -5.340 1
1 1462 . 2 2 2 B 35 35 LEU H H 456 8.580 8.788 -0.208 1
1 1463 . 2 2 2 B 35 35 LEU HA H 456 3.790 4.025 -0.235 1
1 1473 . 2 2 2 B 35 35 LEU CA C 456 57.980 58.699 -0.719 1
1 1474 . 2 2 2 B 35 35 LEU CB C 456 42.220 41.549 0.671 1
1 1477 . 2 2 2 B 35 35 LEU N N 456 120.370 128.112 -7.742 1
1 1478 . 2 2 2 B 36 36 GLU H H 457 8.390 8.424 -0.034 1
1 1479 . 2 2 2 B 36 36 GLU HA H 457 3.820 3.874 -0.054 1
1 1484 . 2 2 2 B 36 36 GLU CA C 457 59.640 59.995 -0.355 1
1 1485 . 2 2 2 B 36 36 GLU CB C 457 28.780 29.259 -0.479 1
1 1487 . 2 2 2 B 36 36 GLU N N 457 119.450 118.798 0.652 1
1 1488 . 2 2 2 B 37 37 ASP H H 458 7.750 8.108 -0.358 1
1 1489 . 2 2 2 B 37 37 ASP HA H 458 4.140 4.451 -0.311 1
1 1492 . 2 2 2 B 37 37 ASP CA C 458 57.150 57.313 -0.163 1
1 1493 . 2 2 2 B 37 37 ASP CB C 458 42.280 40.353 1.927 1
1 1494 . 2 2 2 B 37 37 ASP N N 458 117.430 120.528 -3.098 1
1 1495 . 2 2 2 B 38 38 LEU H H 459 7.700 7.843 -0.143 1
1 1496 . 2 2 2 B 38 38 LEU HA H 459 3.790 4.124 -0.334 1
1 1506 . 2 2 2 B 38 38 LEU CA C 459 58.080 58.113 -0.033 1
1 1507 . 2 2 2 B 38 38 LEU CB C 459 41.130 41.454 -0.324 1
1 1511 . 2 2 2 B 38 38 LEU N N 459 121.280 121.674 -0.394 1
1 1512 . 2 2 2 B 39 39 ALA H H 460 8.190 8.383 -0.193 1
1 1513 . 2 2 2 B 39 39 ALA HA H 460 3.640 3.983 -0.343 1
1 1517 . 2 2 2 B 39 39 ALA CA C 460 54.320 55.430 -1.110 1
1 1518 . 2 2 2 B 39 39 ALA CB C 460 17.140 18.201 -1.061 1
1 1519 . 2 2 2 B 39 39 ALA N N 460 119.400 121.091 -1.691 1
1 1520 . 2 2 2 B 40 40 GLU H H 461 7.340 7.878 -0.538 1
1 1521 . 2 2 2 B 40 40 GLU HA H 461 4.180 4.226 -0.046 1
1 1526 . 2 2 2 B 40 40 GLU CA C 461 57.800 59.001 -1.201 1
1 1527 . 2 2 2 B 40 40 GLU CB C 461 30.600 29.542 1.058 1
1 1529 . 2 2 2 B 40 40 GLU N N 461 110.680 115.921 -5.241 1
1 1530 . 2 2 2 B 41 41 GLN H H 462 7.940 7.981 -0.041 1
1 1531 . 2 2 2 B 41 41 GLN HA H 462 4.100 4.423 -0.323 1
1 1538 . 2 2 2 B 41 41 GLN CA C 462 55.310 56.146 -0.836 1
1 1539 . 2 2 2 B 41 41 GLN CB C 462 28.780 29.549 -0.769 1
1 1541 . 2 2 2 B 41 41 GLN N N 462 120.720 117.829 2.891 1
1 1543 . 2 2 2 B 42 42 GLY H H 463 9.000 8.647 0.353 1
1 1544 . 2 2 2 B 42 42 GLY HA2 H 463 3.310 4.359 -1.049 1
1 1545 . 2 2 2 B 42 42 GLY HA3 H 463 4.820 4.361 0.459 1
1 1546 . 2 2 2 B 42 42 GLY CA C 463 42.650 43.449 -0.799 1
1 1547 . 2 2 2 B 42 42 GLY N N 463 104.110 108.793 -4.683 1
1 1548 . 2 2 2 B 43 43 ILE H H 464 7.900 8.718 -0.818 1
1 1549 . 2 2 2 B 43 43 ILE HA H 464 3.260 3.705 -0.445 1
1 1558 . 2 2 2 B 43 43 ILE CA C 464 66.570 64.339 2.231 1
1 1559 . 2 2 2 B 43 43 ILE CB C 464 38.770 37.539 1.231 1
1 1562 . 2 2 2 B 43 43 ILE N N 464 119.410 120.511 -1.101 1
1 1563 . 2 2 2 B 44 44 ASP H H 465 8.730 8.317 0.413 1
1 1564 . 2 2 2 B 44 44 ASP HA H 465 4.310 4.316 -0.006 1
1 1567 . 2 2 2 B 44 44 ASP CA C 465 56.740 57.736 -0.996 1
1 1568 . 2 2 2 B 44 44 ASP CB C 465 40.120 40.986 -0.866 1
1 1569 . 2 2 2 B 44 44 ASP N N 465 116.610 122.218 -5.608 1
1 1570 . 2 2 2 B 45 45 ASP H H 466 7.720 8.262 -0.542 1
1 1571 . 2 2 2 B 45 45 ASP HA H 466 4.480 4.441 0.039 1
1 1574 . 2 2 2 B 45 45 ASP CA C 466 57.000 56.883 0.117 1
1 1575 . 2 2 2 B 45 45 ASP CB C 466 42.270 40.349 1.921 1
1 1576 . 2 2 2 B 45 45 ASP N N 466 117.560 118.011 -0.451 1
1 1577 . 2 2 2 B 46 46 LEU H H 467 7.370 7.451 -0.081 1
1 1578 . 2 2 2 B 46 46 LEU HA H 467 4.410 4.241 0.169 1
1 1587 . 2 2 2 B 46 46 LEU CA C 467 53.660 56.536 -2.876 1
1 1588 . 2 2 2 B 46 46 LEU CB C 467 42.260 42.160 0.100 1
1 1591 . 2 2 2 B 46 46 LEU N N 467 116.890 118.093 -1.203 1
1 1592 . 2 2 2 B 47 47 ALA H H 468 7.080 8.335 -1.255 1
1 1593 . 2 2 2 B 47 47 ALA HA H 468 4.120 4.023 0.097 1
1 1597 . 2 2 2 B 47 47 ALA CA C 468 54.130 54.820 -0.690 1
1 1598 . 2 2 2 B 47 47 ALA CB C 468 19.480 18.464 1.016 1
1 1599 . 2 2 2 B 47 47 ALA N N 468 120.150 122.702 -2.552 1
1 1600 . 2 2 2 B 48 48 ASP H H 469 8.560 8.208 0.352 1
1 1601 . 2 2 2 B 48 48 ASP HA H 469 4.410 4.463 -0.053 1
1 1604 . 2 2 2 B 48 48 ASP CA C 469 54.330 57.658 -3.328 1
1 1605 . 2 2 2 B 48 48 ASP CB C 469 39.760 40.522 -0.762 1
1 1606 . 2 2 2 B 48 48 ASP N N 469 114.660 116.235 -1.575 1
1 1607 . 2 2 2 B 49 49 ILE H H 470 7.870 7.864 0.006 1
1 1608 . 2 2 2 B 49 49 ILE HA H 470 3.850 4.348 -0.498 1
1 1618 . 2 2 2 B 49 49 ILE CA C 470 61.680 60.667 1.013 1
1 1619 . 2 2 2 B 49 49 ILE CB C 470 37.120 38.618 -1.498 1
1 1623 . 2 2 2 B 49 49 ILE N N 470 121.600 119.759 1.841 1
1 1624 . 2 2 2 B 50 50 GLU H H 471 8.680 9.094 -0.414 1
1 1625 . 2 2 2 B 50 50 GLU HA H 471 3.940 3.986 -0.046 1
1 1630 . 2 2 2 B 50 50 GLU CA C 471 58.360 59.687 -1.327 1
1 1631 . 2 2 2 B 50 50 GLU CB C 471 29.530 29.327 0.203 1
1 1633 . 2 2 2 B 50 50 GLU N N 471 131.000 128.154 2.846 1
1 1634 . 2 2 2 B 51 51 GLY H H 472 8.860 8.102 0.758 1
1 1635 . 2 2 2 B 51 51 GLY HA2 H 472 3.640 4.012 -0.372 1
1 1636 . 2 2 2 B 51 51 GLY HA3 H 472 4.230 4.014 0.216 1
1 1637 . 2 2 2 B 51 51 GLY CA C 472 45.190 46.959 -1.769 1
1 1638 . 2 2 2 B 51 51 GLY N N 472 113.580 106.812 6.768 1
1 1639 . 2 2 2 B 52 52 LEU H H 473 7.850 7.596 0.254 1
1 1640 . 2 2 2 B 52 52 LEU HA H 473 4.680 4.797 -0.117 1
1 1650 . 2 2 2 B 52 52 LEU CA C 473 53.640 53.693 -0.053 1
1 1651 . 2 2 2 B 52 52 LEU CB C 473 42.990 43.577 -0.587 1
1 1655 . 2 2 2 B 52 52 LEU N N 473 123.020 120.078 2.942 1
1 1656 . 2 2 2 B 53 53 THR H H 474 7.550 8.892 -1.342 1
1 1657 . 2 2 2 B 53 53 THR HA H 474 4.560 4.793 -0.233 1
1 1662 . 2 2 2 B 53 53 THR CA C 474 60.060 60.877 -0.817 1
1 1663 . 2 2 2 B 53 53 THR CB C 474 71.520 70.996 0.524 1
1 1665 . 2 2 2 B 53 53 THR N N 474 115.070 118.750 -3.680 1
1 1666 . 2 2 2 B 54 54 ASP H H 475 8.900 9.014 -0.114 1
1 1667 . 2 2 2 B 54 54 ASP HA H 475 4.220 4.289 -0.069 1
1 1670 . 2 2 2 B 54 54 ASP CA C 475 57.520 58.076 -0.556 1
1 1671 . 2 2 2 B 54 54 ASP CB C 475 39.560 40.282 -0.722 1
1 1672 . 2 2 2 B 54 54 ASP N N 475 121.800 123.788 -1.988 1
1 1673 . 2 2 2 B 55 55 GLU H H 476 8.460 7.884 0.576 1
1 1674 . 2 2 2 B 55 55 GLU HA H 476 3.970 4.163 -0.193 1
1 1679 . 2 2 2 B 55 55 GLU CA C 476 59.440 59.091 0.349 1
1 1680 . 2 2 2 B 55 55 GLU CB C 476 29.650 29.778 -0.128 1
1 1682 . 2 2 2 B 55 55 GLU N N 476 119.460 120.406 -0.946 1
1 1683 . 2 2 2 B 56 56 LYS H H 477 7.790 8.072 -0.282 1
1 1684 . 2 2 2 B 56 56 LYS HA H 477 4.120 4.062 0.058 1
1 1693 . 2 2 2 B 56 56 LYS CA C 477 58.890 59.286 -0.396 1
1 1694 . 2 2 2 B 56 56 LYS CB C 477 32.600 32.202 0.398 1
1 1698 . 2 2 2 B 56 56 LYS N N 477 121.840 121.327 0.513 1
1 1699 . 2 2 2 B 57 57 ALA H H 478 8.900 8.830 0.070 1
1 1700 . 2 2 2 B 57 57 ALA HA H 478 3.790 4.039 -0.249 1
1 1704 . 2 2 2 B 57 57 ALA CA C 478 55.810 55.336 0.474 1
1 1705 . 2 2 2 B 57 57 ALA CB C 478 18.590 18.337 0.253 1
1 1706 . 2 2 2 B 57 57 ALA N N 478 121.350 121.716 -0.366 1
1 1707 . 2 2 2 B 58 58 GLY H H 479 8.300 8.150 0.150 1
1 1708 . 2 2 2 B 58 58 GLY HA2 H 479 3.500 3.790 -0.290 1
1 1709 . 2 2 2 B 58 58 GLY HA3 H 479 3.890 3.793 0.097 1
1 1710 . 2 2 2 B 58 58 GLY CA C 479 47.360 47.273 0.087 1
1 1711 . 2 2 2 B 58 58 GLY N N 479 102.040 108.099 -6.059 1
1 1712 . 2 2 2 B 59 59 ALA H H 480 7.580 8.631 -1.051 1
1 1713 . 2 2 2 B 59 59 ALA HA H 480 4.110 4.019 0.091 1
1 1717 . 2 2 2 B 59 59 ALA CA C 480 55.580 54.968 0.612 1
1 1718 . 2 2 2 B 59 59 ALA CB C 480 18.130 17.953 0.177 1
1 1719 . 2 2 2 B 59 59 ALA N N 480 123.180 124.123 -0.943 1
1 1720 . 2 2 2 B 60 60 LEU H H 481 8.290 8.064 0.226 1
1 1721 . 2 2 2 B 60 60 LEU HA H 481 4.020 3.930 0.090 1
1 1731 . 2 2 2 B 60 60 LEU CA C 481 57.850 58.051 -0.201 1
1 1732 . 2 2 2 B 60 60 LEU CB C 481 42.360 41.917 0.443 1
1 1736 . 2 2 2 B 60 60 LEU N N 481 120.560 117.814 2.746 1
1 1737 . 2 2 2 B 61 61 ILE H H 482 8.080 8.247 -0.167 1
1 1738 . 2 2 2 B 61 61 ILE HA H 482 3.210 3.508 -0.298 1
1 1748 . 2 2 2 B 61 61 ILE CA C 482 66.250 65.400 0.850 1
1 1749 . 2 2 2 B 61 61 ILE CB C 482 39.400 37.688 1.712 1
1 1753 . 2 2 2 B 61 61 ILE N N 482 119.170 119.214 -0.044 1
1 1754 . 2 2 2 B 62 62 MET H H 483 8.110 8.335 -0.225 1
1 1755 . 2 2 2 B 62 62 MET HA H 483 4.410 4.151 0.259 1
1 1763 . 2 2 2 B 62 62 MET CA C 483 56.110 58.786 -2.676 1
1 1764 . 2 2 2 B 62 62 MET CB C 483 28.260 32.075 -3.815 1
1 1767 . 2 2 2 B 62 62 MET N N 483 114.420 118.147 -3.727 1
1 1768 . 2 2 2 B 63 63 ALA H H 484 8.240 7.875 0.365 1
1 1769 . 2 2 2 B 63 63 ALA HA H 484 4.130 4.056 0.074 1
1 1773 . 2 2 2 B 63 63 ALA CA C 484 55.300 55.162 0.138 1
1 1774 . 2 2 2 B 63 63 ALA CB C 484 18.280 18.299 -0.019 1
1 1775 . 2 2 2 B 63 63 ALA N N 484 123.710 121.321 2.389 1
1 1776 . 2 2 2 B 64 64 ALA H H 485 8.050 8.679 -0.629 1
1 1777 . 2 2 2 B 64 64 ALA HA H 485 3.870 4.068 -0.198 1
1 1781 . 2 2 2 B 64 64 ALA CA C 485 55.330 55.364 -0.034 1
1 1782 . 2 2 2 B 64 64 ALA CB C 485 17.660 18.352 -0.692 1
1 1783 . 2 2 2 B 64 64 ALA N N 485 120.070 119.683 0.387 1
1 1784 . 2 2 2 B 65 65 ARG H H 486 8.640 8.761 -0.121 1
1 1785 . 2 2 2 B 65 65 ARG HA H 486 2.800 4.195 -1.395 1
1 1792 . 2 2 2 B 65 65 ARG CA C 486 60.600 59.573 1.027 1
1 1793 . 2 2 2 B 65 65 ARG CB C 486 29.910 30.041 -0.131 1
1 1796 . 2 2 2 B 65 65 ARG N N 486 118.730 118.709 0.021 1
1 1797 . 2 2 2 B 66 66 ASN H H 487 8.710 8.626 0.084 1
1 1798 . 2 2 2 B 66 66 ASN HA H 487 4.550 4.820 -0.270 1
1 1803 . 2 2 2 B 66 66 ASN CA C 487 56.390 56.588 -0.198 1
1 1804 . 2 2 2 B 66 66 ASN CB C 487 37.970 38.746 -0.776 1
1 1805 . 2 2 2 B 66 66 ASN N N 487 119.170 118.030 1.140 1
1 1807 . 2 2 2 B 67 67 ILE H H 488 7.250 7.735 -0.485 1
1 1808 . 2 2 2 B 67 67 ILE HA H 488 3.810 3.841 -0.031 1
1 1818 . 2 2 2 B 67 67 ILE CA C 488 64.350 65.005 -0.655 1
1 1819 . 2 2 2 B 67 67 ILE CB C 488 39.570 37.687 1.883 1
1 1823 . 2 2 2 B 67 67 ILE N N 488 117.890 120.440 -2.550 1
1 1824 . 2 2 2 B 68 68 CYS H H 489 8.350 8.275 0.075 1
1 1825 . 2 2 2 B 68 68 CYS HA H 489 4.080 4.156 -0.076 1
1 1828 . 2 2 2 B 68 68 CYS CA C 489 62.670 63.464 -0.794 1
1 1829 . 2 2 2 B 68 68 CYS CB C 489 28.170 28.390 -0.220 1
1 1830 . 2 2 2 B 68 68 CYS N N 489 115.230 118.824 -3.594 1
1 1831 . 2 2 2 B 69 69 TRP H H 490 8.230 8.817 -0.587 1
1 1832 . 2 2 2 B 69 69 TRP HA H 490 5.100 4.187 0.913 1
1 1841 . 2 2 2 B 69 69 TRP CA C 490 55.420 60.226 -4.806 1
1 1842 . 2 2 2 B 69 69 TRP CB C 490 31.010 29.341 1.669 1
1 1844 . 2 2 2 B 69 69 TRP N N 490 116.850 121.108 -4.258 1
1 1846 . 2 2 2 B 70 70 PHE H H 491 7.570 8.170 -0.600 1
1 1847 . 2 2 2 B 70 70 PHE HA H 491 5.240 4.691 0.549 1
1 1852 . 2 2 2 B 70 70 PHE CA C 491 55.490 58.400 -2.910 1
1 1853 . 2 2 2 B 70 70 PHE CB C 491 38.700 38.734 -0.034 1
1 1856 . 2 2 2 B 70 70 PHE N N 491 117.460 116.105 1.355 1
1 1857 . 2 2 2 B 71 71 GLY H H 492 8.420 8.480 -0.060 1
1 1858 . 2 2 2 B 71 71 GLY HA2 H 492 3.920 3.802 0.118 1
1 1859 . 2 2 2 B 71 71 GLY HA3 H 492 4.080 3.838 0.242 1
1 1860 . 2 2 2 B 71 71 GLY CA C 492 46.210 47.252 -1.042 1
1 1861 . 2 2 2 B 71 71 GLY N N 492 110.040 108.787 1.253 1
1 1862 . 2 2 2 B 72 72 ASP H H 493 8.370 7.890 0.480 1
1 1863 . 2 2 2 B 72 72 ASP HA H 493 4.630 4.396 0.234 1
1 1866 . 2 2 2 B 72 72 ASP CA C 493 54.410 56.681 -2.271 1
1 1867 . 2 2 2 B 72 72 ASP CB C 493 41.250 40.548 0.702 1
1 1868 . 2 2 2 B 72 72 ASP N N 493 120.000 120.041 -0.041 1
1 1869 . 2 2 2 B 73 73 GLU H H 494 8.230 8.031 0.199 1
1 1870 . 2 2 2 B 73 73 GLU HA H 494 4.260 4.444 -0.184 1
1 1875 . 2 2 2 B 73 73 GLU CA C 494 56.510 57.714 -1.204 1
1 1876 . 2 2 2 B 73 73 GLU CB C 494 30.420 30.330 0.090 1
1 1878 . 2 2 2 B 73 73 GLU N N 494 120.900 118.440 2.460 1
1 216 . 3 1 1 A 20 20 ASP H H 250 8.550 8.380 0.170 1
1 217 . 3 1 1 A 20 20 ASP HA H 250 4.700 4.520 0.180 1
1 220 . 3 1 1 A 20 20 ASP CA C 250 52.650 52.889 -0.239 1
1 221 . 3 1 1 A 20 20 ASP CB C 250 41.420 40.520 0.900 1
1 222 . 3 1 1 A 20 20 ASP N N 250 125.190 124.388 0.802 1
1 223 . 3 1 1 A 21 21 PRO HA H 251 4.250 4.435 -0.185 1
1 230 . 3 1 1 A 21 21 PRO CA C 251 65.120 64.562 0.558 1
1 231 . 3 1 1 A 21 21 PRO CB C 251 32.310 32.071 0.239 1
1 234 . 3 1 1 A 22 22 ILE H H 252 8.630 7.786 0.844 1
1 235 . 3 1 1 A 22 22 ILE HA H 252 4.060 3.961 0.099 1
1 245 . 3 1 1 A 22 22 ILE CA C 252 62.990 62.764 0.226 1
1 246 . 3 1 1 A 22 22 ILE CB C 252 37.520 37.690 -0.170 1
1 250 . 3 1 1 A 22 22 ILE N N 252 119.860 117.272 2.588 1
1 251 . 3 1 1 A 23 23 LEU H H 253 7.950 7.878 0.072 1
1 252 . 3 1 1 A 23 23 LEU HA H 253 3.710 4.110 -0.400 1
1 262 . 3 1 1 A 23 23 LEU CA C 253 56.510 57.648 -1.138 1
1 263 . 3 1 1 A 23 23 LEU CB C 253 41.190 41.706 -0.516 1
1 266 . 3 1 1 A 23 23 LEU N N 253 116.850 121.212 -4.362 1
1 267 . 3 1 1 A 24 24 LEU H H 254 7.370 7.948 -0.578 1
1 268 . 3 1 1 A 24 24 LEU HA H 254 4.310 4.549 -0.239 1
1 278 . 3 1 1 A 24 24 LEU CA C 254 54.890 58.083 -3.193 1
1 279 . 3 1 1 A 24 24 LEU CB C 254 41.960 41.609 0.351 1
1 283 . 3 1 1 A 24 24 LEU N N 254 115.210 118.960 -3.750 1
1 284 . 3 1 1 A 25 25 ARG H H 255 7.520 7.582 -0.062 1
1 285 . 3 1 1 A 25 25 ARG HA H 255 4.660 4.238 0.422 1
1 293 . 3 1 1 A 25 25 ARG CA C 255 52.840 54.611 -1.771 1
1 294 . 3 1 1 A 25 25 ARG CB C 255 28.130 29.945 -1.815 1
1 297 . 3 1 1 A 25 25 ARG N N 255 118.180 119.605 -1.425 1
1 298 . 3 1 1 A 26 26 PRO HA H 256 4.800 4.890 -0.090 1
1 305 . 3 1 1 A 26 26 PRO CA C 256 61.790 62.637 -0.847 1
1 306 . 3 1 1 A 26 26 PRO CB C 256 32.660 32.267 0.393 1
1 309 . 3 1 1 A 27 27 VAL H H 257 8.170 8.360 -0.190 1
1 310 . 3 1 1 A 27 27 VAL HA H 257 3.590 3.716 -0.126 1
1 318 . 3 1 1 A 27 27 VAL CA C 257 64.830 65.713 -0.883 1
1 319 . 3 1 1 A 27 27 VAL CB C 257 31.720 31.622 0.098 1
1 322 . 3 1 1 A 27 27 VAL N N 257 115.710 123.816 -8.106 1
1 323 . 3 1 1 A 28 28 ASP H H 258 8.240 8.083 0.157 1
1 324 . 3 1 1 A 28 28 ASP HA H 258 4.340 4.381 -0.041 1
1 327 . 3 1 1 A 28 28 ASP CA C 258 56.490 57.531 -1.041 1
1 328 . 3 1 1 A 28 28 ASP CB C 258 40.520 40.363 0.157 1
1 329 . 3 1 1 A 28 28 ASP N N 258 119.000 122.373 -3.373 1
1 330 . 3 1 1 A 29 29 ASP H H 259 8.000 8.725 -0.725 1
1 331 . 3 1 1 A 29 29 ASP HA H 259 4.390 4.610 -0.220 1
1 334 . 3 1 1 A 29 29 ASP CA C 259 56.210 55.399 0.811 1
1 335 . 3 1 1 A 29 29 ASP CB C 259 40.670 41.144 -0.474 1
1 336 . 3 1 1 A 29 29 ASP N N 259 118.900 117.472 1.428 1
1 337 . 3 1 1 A 30 30 LEU H H 260 7.760 7.751 0.009 1
1 338 . 3 1 1 A 30 30 LEU HA H 260 3.990 4.213 -0.223 1
1 348 . 3 1 1 A 30 30 LEU CA C 260 55.000 55.366 -0.366 1
1 349 . 3 1 1 A 30 30 LEU CB C 260 41.670 42.172 -0.502 1
1 353 . 3 1 1 A 30 30 LEU N N 260 116.300 121.452 -5.152 1
1 354 . 3 1 1 A 31 31 GLU H H 261 7.990 8.937 -0.947 1
1 355 . 3 1 1 A 31 31 GLU HA H 261 4.280 4.032 0.248 1
1 358 . 3 1 1 A 31 31 GLU CA C 261 56.860 58.833 -1.973 1
1 359 . 3 1 1 A 31 31 GLU CB C 261 27.010 29.628 -2.618 1
1 360 . 3 1 1 A 31 31 GLU N N 261 115.620 123.127 -7.507 1
1 361 . 3 1 1 A 32 32 LEU H H 262 8.000 7.307 0.693 1
1 362 . 3 1 1 A 32 32 LEU HA H 262 4.400 4.273 0.127 1
1 372 . 3 1 1 A 32 32 LEU CA C 262 53.860 54.858 -0.998 1
1 373 . 3 1 1 A 32 32 LEU CB C 262 44.450 42.217 2.233 1
1 377 . 3 1 1 A 32 32 LEU N N 262 118.860 122.578 -3.718 1
1 378 . 3 1 1 A 33 33 THR H H 263 10.020 8.585 1.435 1
1 379 . 3 1 1 A 33 33 THR HA H 263 4.130 4.519 -0.389 1
1 384 . 3 1 1 A 33 33 THR CA C 263 62.400 61.024 1.376 1
1 385 . 3 1 1 A 33 33 THR CB C 263 71.270 71.104 0.166 1
1 387 . 3 1 1 A 33 33 THR N N 263 114.610 114.421 0.189 1
1 388 . 3 1 1 A 34 34 VAL H H 264 8.370 8.780 -0.410 1
1 389 . 3 1 1 A 34 34 VAL HA H 264 3.620 3.653 -0.033 1
1 397 . 3 1 1 A 34 34 VAL CA C 264 66.340 67.004 -0.664 1
1 398 . 3 1 1 A 34 34 VAL CB C 264 31.670 31.529 0.141 1
1 401 . 3 1 1 A 34 34 VAL N N 264 122.110 122.604 -0.494 1
1 402 . 3 1 1 A 35 35 ARG H H 265 8.190 8.134 0.056 1
1 403 . 3 1 1 A 35 35 ARG HA H 265 4.070 3.915 0.155 1
1 411 . 3 1 1 A 35 35 ARG CA C 265 59.470 59.781 -0.311 1
1 412 . 3 1 1 A 35 35 ARG CB C 265 29.790 29.874 -0.084 1
1 415 . 3 1 1 A 35 35 ARG N N 265 117.340 120.705 -3.365 1
1 416 . 3 1 1 A 36 36 SER H H 266 7.610 7.855 -0.245 1
1 417 . 3 1 1 A 36 36 SER HA H 266 4.080 4.081 -0.001 1
1 420 . 3 1 1 A 36 36 SER CA C 266 63.080 62.017 1.063 1
1 421 . 3 1 1 A 36 36 SER CB C 266 63.280 62.771 0.509 1
1 422 . 3 1 1 A 36 36 SER N N 266 116.710 116.926 -0.216 1
1 423 . 3 1 1 A 37 37 ALA H H 267 8.720 7.842 0.878 1
1 424 . 3 1 1 A 37 37 ALA HA H 267 3.760 4.010 -0.250 1
1 428 . 3 1 1 A 37 37 ALA CA C 267 55.900 55.254 0.646 1
1 429 . 3 1 1 A 37 37 ALA CB C 267 18.090 17.965 0.125 1
1 430 . 3 1 1 A 37 37 ALA N N 267 124.170 123.677 0.493 1
1 431 . 3 1 1 A 38 38 ASN H H 268 8.850 9.442 -0.592 1
1 432 . 3 1 1 A 38 38 ASN HA H 268 4.420 4.500 -0.080 1
1 437 . 3 1 1 A 38 38 ASN CA C 268 55.700 56.202 -0.502 1
1 438 . 3 1 1 A 38 38 ASN CB C 268 37.180 37.684 -0.504 1
1 439 . 3 1 1 A 38 38 ASN N N 268 117.370 117.438 -0.068 1
1 441 . 3 1 1 A 39 39 CYS H H 269 7.970 8.006 -0.036 1
1 442 . 3 1 1 A 39 39 CYS HA H 269 4.190 4.136 0.054 1
1 445 . 3 1 1 A 39 39 CYS CA C 269 63.340 63.006 0.334 1
1 446 . 3 1 1 A 39 39 CYS CB C 269 26.870 27.524 -0.654 1
1 447 . 3 1 1 A 39 39 CYS N N 269 120.510 118.924 1.586 1
1 448 . 3 1 1 A 40 40 LEU H H 270 7.600 7.720 -0.120 1
1 449 . 3 1 1 A 40 40 LEU HA H 270 3.880 3.928 -0.048 1
1 458 . 3 1 1 A 40 40 LEU CA C 270 57.810 58.133 -0.323 1
1 459 . 3 1 1 A 40 40 LEU CB C 270 40.030 41.426 -1.396 1
1 462 . 3 1 1 A 40 40 LEU N N 270 117.710 120.532 -2.822 1
1 463 . 3 1 1 A 41 41 LYS H H 271 7.980 8.459 -0.479 1
1 464 . 3 1 1 A 41 41 LYS HA H 271 3.820 4.398 -0.578 1
1 472 . 3 1 1 A 41 41 LYS CA C 271 59.840 59.142 0.698 1
1 473 . 3 1 1 A 41 41 LYS CB C 271 32.070 32.087 -0.017 1
1 476 . 3 1 1 A 41 41 LYS N N 271 120.070 120.243 -0.173 1
1 477 . 3 1 1 A 42 42 ALA H H 272 7.860 8.494 -0.634 1
1 478 . 3 1 1 A 42 42 ALA HA H 272 4.140 4.071 0.069 1
1 482 . 3 1 1 A 42 42 ALA CA C 272 54.670 54.572 0.098 1
1 483 . 3 1 1 A 42 42 ALA CB C 272 17.950 18.507 -0.557 1
1 484 . 3 1 1 A 42 42 ALA N N 272 122.880 121.582 1.298 1
1 485 . 3 1 1 A 43 43 GLU H H 273 7.210 8.022 -0.812 1
1 486 . 3 1 1 A 43 43 GLU HA H 273 4.260 4.446 -0.186 1
1 491 . 3 1 1 A 43 43 GLU CA C 273 55.020 56.011 -0.991 1
1 492 . 3 1 1 A 43 43 GLU CB C 273 29.880 29.397 0.483 1
1 494 . 3 1 1 A 43 43 GLU N N 273 116.590 115.487 1.103 1
1 495 . 3 1 1 A 44 44 ALA H H 274 7.880 8.182 -0.302 1
1 496 . 3 1 1 A 44 44 ALA HA H 274 3.680 3.956 -0.276 1
1 500 . 3 1 1 A 44 44 ALA CA C 274 52.960 53.206 -0.246 1
1 501 . 3 1 1 A 44 44 ALA CB C 274 16.110 17.250 -1.140 1
1 502 . 3 1 1 A 44 44 ALA N N 274 118.420 119.000 -0.580 1
1 503 . 3 1 1 A 45 45 ILE H H 275 7.600 7.337 0.263 1
1 504 . 3 1 1 A 45 45 ILE HA H 275 3.870 4.561 -0.691 1
1 514 . 3 1 1 A 45 45 ILE CA C 275 61.150 60.431 0.719 1
1 515 . 3 1 1 A 45 45 ILE CB C 275 37.090 39.853 -2.763 1
1 519 . 3 1 1 A 45 45 ILE N N 275 120.370 118.349 2.021 1
1 520 . 3 1 1 A 46 46 HIS H H 276 8.350 8.150 0.200 1
1 521 . 3 1 1 A 46 46 HIS HA H 276 4.600 4.888 -0.288 1
1 526 . 3 1 1 A 46 46 HIS CA C 276 56.900 55.693 1.207 1
1 527 . 3 1 1 A 46 46 HIS CB C 276 31.910 31.228 0.682 1
1 529 . 3 1 1 A 46 46 HIS N N 276 123.250 122.336 0.914 1
1 530 . 3 1 1 A 47 47 TYR H H 277 8.850 7.180 1.670 1
1 531 . 3 1 1 A 47 47 TYR HA H 277 5.100 4.657 0.443 1
1 538 . 3 1 1 A 47 47 TYR CA C 277 57.430 56.380 1.050 1
1 539 . 3 1 1 A 47 47 TYR CB C 277 40.680 40.085 0.595 1
1 544 . 3 1 1 A 47 47 TYR N N 277 119.700 118.183 1.517 1
1 545 . 3 1 1 A 48 48 ILE H H 278 9.380 8.327 1.053 1
1 546 . 3 1 1 A 48 48 ILE HA H 278 3.340 3.609 -0.269 1
1 554 . 3 1 1 A 48 48 ILE CA C 278 67.640 65.058 2.582 1
1 555 . 3 1 1 A 48 48 ILE CB C 278 36.310 37.622 -1.312 1
1 558 . 3 1 1 A 48 48 ILE N N 278 125.650 124.411 1.239 1
1 559 . 3 1 1 A 49 49 GLY H H 279 9.430 8.071 1.359 1
1 560 . 3 1 1 A 49 49 GLY HA2 H 279 2.370 2.198 0.172 1
1 561 . 3 1 1 A 49 49 GLY HA3 H 279 3.230 3.582 -0.352 1
1 562 . 3 1 1 A 49 49 GLY CA C 279 46.820 46.802 0.018 1
1 563 . 3 1 1 A 49 49 GLY N N 279 105.200 108.560 -3.360 1
1 564 . 3 1 1 A 50 50 ASP H H 280 7.050 7.550 -0.500 1
1 565 . 3 1 1 A 50 50 ASP HA H 280 4.360 4.139 0.221 1
1 568 . 3 1 1 A 50 50 ASP CA C 280 57.110 56.123 0.987 1
1 569 . 3 1 1 A 50 50 ASP CB C 280 42.620 40.514 2.106 1
1 570 . 3 1 1 A 50 50 ASP N N 280 116.360 121.000 -4.640 1
1 571 . 3 1 1 A 51 51 LEU H H 281 7.170 8.034 -0.864 1
1 572 . 3 1 1 A 51 51 LEU HA H 281 3.880 3.973 -0.093 1
1 582 . 3 1 1 A 51 51 LEU CA C 281 57.900 58.236 -0.336 1
1 583 . 3 1 1 A 51 51 LEU CB C 281 41.870 41.569 0.301 1
1 587 . 3 1 1 A 51 51 LEU N N 281 120.130 121.880 -1.750 1
1 588 . 3 1 1 A 52 52 VAL H H 282 7.820 7.591 0.229 1
1 589 . 3 1 1 A 52 52 VAL HA H 282 3.980 3.862 0.118 1
1 597 . 3 1 1 A 52 52 VAL CA C 282 64.000 65.485 -1.485 1
1 598 . 3 1 1 A 52 52 VAL CB C 282 30.400 31.578 -1.178 1
1 601 . 3 1 1 A 52 52 VAL N N 282 105.550 115.513 -9.963 1
1 602 . 3 1 1 A 53 53 GLN H H 283 6.550 8.151 -1.601 1
1 603 . 3 1 1 A 53 53 GLN HA H 283 4.680 4.132 0.548 1
1 610 . 3 1 1 A 53 53 GLN CA C 283 56.210 58.805 -2.595 1
1 611 . 3 1 1 A 53 53 GLN CB C 283 31.710 28.665 3.045 1
1 613 . 3 1 1 A 53 53 GLN N N 283 114.060 121.992 -7.932 1
1 615 . 3 1 1 A 54 54 ARG H H 284 7.690 7.562 0.128 1
1 616 . 3 1 1 A 54 54 ARG HA H 284 4.520 4.850 -0.330 1
1 624 . 3 1 1 A 54 54 ARG CA C 284 54.600 54.311 0.289 1
1 625 . 3 1 1 A 54 54 ARG CB C 284 30.750 32.992 -2.242 1
1 628 . 3 1 1 A 54 54 ARG N N 284 119.810 118.241 1.569 1
1 629 . 3 1 1 A 55 55 THR H H 285 8.110 8.626 -0.516 1
1 630 . 3 1 1 A 55 55 THR HA H 285 4.430 4.294 0.136 1
1 635 . 3 1 1 A 55 55 THR CA C 285 59.640 64.120 -4.480 1
1 636 . 3 1 1 A 55 55 THR CB C 285 71.310 69.315 1.995 1
1 638 . 3 1 1 A 55 55 THR N N 285 108.450 119.360 -10.910 1
1 639 . 3 1 1 A 56 56 GLU H H 286 8.910 8.882 0.028 1
1 640 . 3 1 1 A 56 56 GLU HA H 286 3.660 3.944 -0.284 1
1 645 . 3 1 1 A 56 56 GLU CA C 286 60.650 59.687 0.963 1
1 646 . 3 1 1 A 56 56 GLU CB C 286 29.400 29.145 0.255 1
1 648 . 3 1 1 A 56 56 GLU N N 286 120.600 126.439 -5.839 1
1 649 . 3 1 1 A 57 57 VAL H H 287 7.600 8.088 -0.488 1
1 650 . 3 1 1 A 57 57 VAL HA H 287 3.620 3.527 0.093 1
1 658 . 3 1 1 A 57 57 VAL CA C 287 66.020 67.124 -1.104 1
1 659 . 3 1 1 A 57 57 VAL CB C 287 31.720 31.568 0.152 1
1 662 . 3 1 1 A 57 57 VAL N N 287 114.050 119.996 -5.946 1
1 663 . 3 1 1 A 58 58 GLU H H 288 7.350 8.535 -1.185 1
1 664 . 3 1 1 A 58 58 GLU HA H 288 3.830 4.070 -0.240 1
1 669 . 3 1 1 A 58 58 GLU CA C 288 59.250 59.739 -0.489 1
1 670 . 3 1 1 A 58 58 GLU CB C 288 30.030 29.076 0.954 1
1 672 . 3 1 1 A 58 58 GLU N N 288 117.610 118.984 -1.374 1
1 673 . 3 1 1 A 59 59 LEU H H 289 7.850 7.780 0.070 1
1 674 . 3 1 1 A 59 59 LEU HA H 289 4.150 4.553 -0.403 1
1 683 . 3 1 1 A 59 59 LEU CA C 289 57.340 57.305 0.035 1
1 684 . 3 1 1 A 59 59 LEU CB C 289 41.170 41.304 -0.134 1
1 687 . 3 1 1 A 59 59 LEU N N 289 120.050 120.528 -0.478 1
1 688 . 3 1 1 A 60 60 LEU H H 290 7.670 8.429 -0.759 1
1 689 . 3 1 1 A 60 60 LEU HA H 290 4.540 3.965 0.575 1
1 696 . 3 1 1 A 60 60 LEU CA C 290 55.090 58.094 -3.004 1
1 697 . 3 1 1 A 60 60 LEU CB C 290 42.320 41.604 0.716 1
1 701 . 3 1 1 A 60 60 LEU N N 290 114.980 119.851 -4.871 1
1 702 . 3 1 1 A 61 61 LYS H H 291 7.440 7.361 0.079 1
1 703 . 3 1 1 A 61 61 LYS HA H 291 4.280 4.294 -0.014 1
1 710 . 3 1 1 A 61 61 LYS CA C 291 56.860 57.558 -0.698 1
1 711 . 3 1 1 A 61 61 LYS CB C 291 31.900 32.867 -0.967 1
1 714 . 3 1 1 A 61 61 LYS N N 291 118.120 117.494 0.626 1
1 715 . 3 1 1 A 62 62 THR H H 292 7.310 7.797 -0.487 1
1 716 . 3 1 1 A 62 62 THR HA H 292 5.220 4.387 0.833 1
1 721 . 3 1 1 A 62 62 THR CA C 292 55.830 61.391 -5.561 1
1 722 . 3 1 1 A 62 62 THR CB C 292 69.970 69.224 0.746 1
1 724 . 3 1 1 A 62 62 THR N N 292 111.890 115.584 -3.694 1
1 725 . 3 1 1 A 63 63 PRO HA H 293 4.570 4.595 -0.025 1
1 730 . 3 1 1 A 63 63 PRO CA C 293 63.710 64.195 -0.485 1
1 731 . 3 1 1 A 63 63 PRO CB C 293 32.380 31.747 0.633 1
1 733 . 3 1 1 A 64 64 ASN H H 294 8.050 8.537 -0.487 1
1 734 . 3 1 1 A 64 64 ASN HA H 294 4.490 4.705 -0.215 1
1 739 . 3 1 1 A 64 64 ASN CA C 294 55.630 53.510 2.120 1
1 740 . 3 1 1 A 64 64 ASN CB C 294 38.730 38.680 0.050 1
1 741 . 3 1 1 A 64 64 ASN N N 294 117.120 116.085 1.035 1
1 743 . 3 1 1 A 65 65 LEU H H 295 7.550 7.050 0.500 1
1 744 . 3 1 1 A 65 65 LEU HA H 295 4.640 4.350 0.290 1
1 754 . 3 1 1 A 65 65 LEU CA C 295 54.310 54.213 0.097 1
1 755 . 3 1 1 A 65 65 LEU CB C 295 43.640 42.798 0.842 1
1 758 . 3 1 1 A 65 65 LEU N N 295 119.930 121.003 -1.073 1
1 759 . 3 1 1 A 66 66 GLY H H 296 7.850 8.725 -0.875 1
1 760 . 3 1 1 A 66 66 GLY HA2 H 296 3.810 4.309 -0.499 1
1 761 . 3 1 1 A 66 66 GLY HA3 H 296 4.110 4.309 -0.199 1
1 762 . 3 1 1 A 66 66 GLY CA C 296 43.570 44.134 -0.564 1
1 763 . 3 1 1 A 66 66 GLY N N 296 108.840 109.669 -0.829 1
1 764 . 3 1 1 A 67 67 LYS H H 297 8.820 8.930 -0.110 1
1 765 . 3 1 1 A 67 67 LYS HA H 297 3.980 3.897 0.083 1
1 774 . 3 1 1 A 67 67 LYS CA C 297 60.100 59.745 0.355 1
1 775 . 3 1 1 A 67 67 LYS CB C 297 32.100 32.320 -0.220 1
1 779 . 3 1 1 A 67 67 LYS N N 297 120.130 122.324 -2.194 1
1 780 . 3 1 1 A 68 68 LYS H H 298 8.850 7.914 0.936 1
1 781 . 3 1 1 A 68 68 LYS HA H 298 4.060 4.121 -0.061 1
1 790 . 3 1 1 A 68 68 LYS CA C 298 60.600 58.557 2.043 1
1 791 . 3 1 1 A 68 68 LYS CB C 298 31.920 31.724 0.196 1
1 795 . 3 1 1 A 68 68 LYS N N 298 119.580 119.668 -0.088 1
1 796 . 3 1 1 A 69 69 SER H H 299 8.100 8.015 0.085 1
1 797 . 3 1 1 A 69 69 SER HA H 299 4.370 4.069 0.301 1
1 800 . 3 1 1 A 69 69 SER CA C 299 61.980 62.637 -0.657 1
1 801 . 3 1 1 A 69 69 SER CB C 299 63.000 62.747 0.253 1
1 802 . 3 1 1 A 69 69 SER N N 299 116.360 117.457 -1.097 1
1 803 . 3 1 1 A 70 70 LEU H H 300 8.240 8.660 -0.420 1
1 804 . 3 1 1 A 70 70 LEU HA H 300 3.970 3.980 -0.010 1
1 814 . 3 1 1 A 70 70 LEU CA C 300 57.610 58.064 -0.454 1
1 815 . 3 1 1 A 70 70 LEU CB C 300 41.060 41.612 -0.552 1
1 819 . 3 1 1 A 70 70 LEU N N 300 123.330 120.859 2.471 1
1 820 . 3 1 1 A 71 71 THR H H 301 8.550 8.005 0.545 1
1 821 . 3 1 1 A 71 71 THR HA H 301 3.690 3.817 -0.127 1
1 826 . 3 1 1 A 71 71 THR CA C 301 67.170 66.756 0.414 1
1 827 . 3 1 1 A 71 71 THR CB C 301 68.810 68.717 0.093 1
1 829 . 3 1 1 A 71 71 THR N N 301 116.520 115.334 1.186 1
1 830 . 3 1 1 A 72 72 GLU H H 302 7.520 7.984 -0.464 1
1 831 . 3 1 1 A 72 72 GLU HA H 302 4.070 3.974 0.096 1
1 836 . 3 1 1 A 72 72 GLU CA C 302 59.470 59.364 0.106 1
1 837 . 3 1 1 A 72 72 GLU CB C 302 29.090 29.271 -0.181 1
1 839 . 3 1 1 A 72 72 GLU N N 302 121.510 119.001 2.509 1
1 840 . 3 1 1 A 73 73 ILE H H 303 8.290 8.129 0.161 1
1 841 . 3 1 1 A 73 73 ILE HA H 303 3.380 3.580 -0.200 1
1 849 . 3 1 1 A 73 73 ILE CA C 303 66.010 65.472 0.538 1
1 850 . 3 1 1 A 73 73 ILE CB C 303 38.680 37.836 0.844 1
1 853 . 3 1 1 A 73 73 ILE N N 303 118.510 120.974 -2.464 1
1 854 . 3 1 1 A 74 74 LYS H H 304 8.550 8.111 0.439 1
1 855 . 3 1 1 A 74 74 LYS HA H 304 3.680 3.854 -0.174 1
1 864 . 3 1 1 A 74 74 LYS CA C 304 61.320 59.453 1.867 1
1 865 . 3 1 1 A 74 74 LYS CB C 304 32.060 31.960 0.100 1
1 868 . 3 1 1 A 74 74 LYS N N 304 118.220 120.548 -2.328 1
1 869 . 3 1 1 A 75 75 ASP H H 305 8.450 7.913 0.537 1
1 870 . 3 1 1 A 75 75 ASP HA H 305 4.440 4.425 0.015 1
1 873 . 3 1 1 A 75 75 ASP CA C 305 57.690 57.111 0.579 1
1 874 . 3 1 1 A 75 75 ASP CB C 305 40.220 40.882 -0.662 1
1 875 . 3 1 1 A 75 75 ASP N N 305 121.790 120.021 1.769 1
1 876 . 3 1 1 A 76 76 VAL H H 306 8.680 7.904 0.776 1
1 877 . 3 1 1 A 76 76 VAL HA H 306 3.890 3.579 0.311 1
1 885 . 3 1 1 A 76 76 VAL CA C 306 66.020 66.346 -0.326 1
1 886 . 3 1 1 A 76 76 VAL CB C 306 31.250 31.449 -0.199 1
1 889 . 3 1 1 A 76 76 VAL N N 306 121.150 119.750 1.400 1
1 890 . 3 1 1 A 77 77 LEU H H 307 8.470 8.625 -0.155 1
1 891 . 3 1 1 A 77 77 LEU HA H 307 3.810 4.132 -0.322 1
1 901 . 3 1 1 A 77 77 LEU CA C 307 58.330 57.243 1.087 1
1 902 . 3 1 1 A 77 77 LEU CB C 307 41.250 40.832 0.418 1
1 906 . 3 1 1 A 77 77 LEU N N 307 120.830 118.337 2.493 1
1 907 . 3 1 1 A 78 78 ALA H H 308 8.280 8.516 -0.236 1
1 908 . 3 1 1 A 78 78 ALA HA H 308 4.320 4.104 0.216 1
1 912 . 3 1 1 A 78 78 ALA CA C 308 55.420 55.002 0.418 1
1 913 . 3 1 1 A 78 78 ALA CB C 308 17.750 17.982 -0.232 1
1 914 . 3 1 1 A 78 78 ALA N N 308 122.530 123.318 -0.788 1
1 915 . 3 1 1 A 79 79 SER H H 309 7.900 7.666 0.234 1
1 916 . 3 1 1 A 79 79 SER HA H 309 4.340 4.334 0.006 1
1 919 . 3 1 1 A 79 79 SER CA C 309 61.350 58.747 2.603 1
1 920 . 3 1 1 A 79 79 SER CB C 309 63.280 63.884 -0.604 1
1 921 . 3 1 1 A 79 79 SER N N 309 115.600 111.444 4.156 1
1 922 . 3 1 1 A 80 80 ARG H H 310 7.450 8.217 -0.767 1
1 923 . 3 1 1 A 80 80 ARG HA H 310 4.550 3.965 0.585 1
1 931 . 3 1 1 A 80 80 ARG CA C 310 54.200 57.372 -3.172 1
1 932 . 3 1 1 A 80 80 ARG CB C 310 30.680 27.136 3.544 1
1 935 . 3 1 1 A 80 80 ARG N N 310 119.360 115.786 3.574 1
1 936 . 3 1 1 A 81 81 GLY H H 311 7.940 7.902 0.038 1
1 937 . 3 1 1 A 81 81 GLY HA2 H 311 3.840 3.841 -0.001 1
1 938 . 3 1 1 A 81 81 GLY HA3 H 311 4.070 3.856 0.214 1
1 939 . 3 1 1 A 81 81 GLY CA C 311 46.060 45.893 0.167 1
1 940 . 3 1 1 A 81 81 GLY N N 311 108.130 106.703 1.427 1
1 941 . 3 1 1 A 82 82 LEU H H 312 7.920 7.612 0.308 1
1 942 . 3 1 1 A 82 82 LEU HA H 312 4.680 4.729 -0.049 1
1 952 . 3 1 1 A 82 82 LEU CA C 312 53.070 52.826 0.244 1
1 953 . 3 1 1 A 82 82 LEU CB C 312 45.790 45.599 0.191 1
1 957 . 3 1 1 A 82 82 LEU N N 312 119.290 116.181 3.109 1
1 958 . 3 1 1 A 83 83 SER H H 313 7.530 8.713 -1.183 1
1 959 . 3 1 1 A 83 83 SER HA H 313 4.450 4.154 0.296 1
1 962 . 3 1 1 A 83 83 SER CA C 313 57.190 59.521 -2.331 1
1 963 . 3 1 1 A 83 83 SER CB C 313 66.080 61.289 4.791 1
1 964 . 3 1 1 A 83 83 SER N N 313 113.120 113.103 0.017 1
1 965 . 3 1 1 A 84 84 LEU H H 314 8.340 8.187 0.153 1
1 966 . 3 1 1 A 84 84 LEU HA H 314 4.620 4.165 0.455 1
1 976 . 3 1 1 A 84 84 LEU CA C 314 54.720 55.387 -0.667 1
1 977 . 3 1 1 A 84 84 LEU CB C 314 41.620 42.442 -0.822 1
1 981 . 3 1 1 A 84 84 LEU N N 314 115.930 120.295 -4.365 1
1 982 . 3 1 1 A 85 85 GLY H H 315 8.270 8.296 -0.026 1
1 983 . 3 1 1 A 85 85 GLY HA2 H 315 3.320 3.946 -0.626 1
1 984 . 3 1 1 A 85 85 GLY HA3 H 315 3.850 3.950 -0.100 1
1 985 . 3 1 1 A 85 85 GLY CA C 315 46.560 46.401 0.159 1
1 986 . 3 1 1 A 85 85 GLY N N 315 111.010 107.314 3.696 1
1 987 . 3 1 1 A 86 86 MET H H 316 8.650 7.889 0.761 1
1 988 . 3 1 1 A 86 86 MET HA H 316 3.990 5.056 -1.066 1
1 996 . 3 1 1 A 86 86 MET CA C 316 56.730 53.110 3.620 1
1 997 . 3 1 1 A 86 86 MET CB C 316 33.600 35.819 -2.219 1
1 1000 . 3 1 1 A 86 86 MET N N 316 120.570 116.887 3.683 1
1 1001 . 3 1 1 A 87 87 ARG H H 317 8.360 8.726 -0.366 1
1 1002 . 3 1 1 A 87 87 ARG HA H 317 4.450 5.351 -0.901 1
1 1010 . 3 1 1 A 87 87 ARG CA C 317 55.310 54.674 0.636 1
1 1011 . 3 1 1 A 87 87 ARG CB C 317 30.490 33.918 -3.428 1
1 1014 . 3 1 1 A 87 87 ARG N N 317 122.290 118.589 3.701 1
1 1015 . 3 1 1 A 88 88 LEU H H 318 8.400 8.876 -0.476 1
1 1016 . 3 1 1 A 88 88 LEU HA H 318 4.670 5.005 -0.335 1
1 1026 . 3 1 1 A 88 88 LEU CA C 318 53.110 53.216 -0.106 1
1 1027 . 3 1 1 A 88 88 LEU CB C 318 43.600 44.770 -1.170 1
1 1031 . 3 1 1 A 88 88 LEU N N 318 126.420 125.063 1.357 1
1 1032 . 3 1 1 A 89 89 GLU H H 319 8.780 8.881 -0.101 1
1 1033 . 3 1 1 A 89 89 GLU HA H 319 4.340 3.987 0.353 1
1 1038 . 3 1 1 A 89 89 GLU CA C 319 56.490 59.600 -3.110 1
1 1039 . 3 1 1 A 89 89 GLU CB C 319 30.470 29.674 0.796 1
1 1041 . 3 1 1 A 89 89 GLU N N 319 123.070 122.615 0.455 1
1 1042 . 3 1 1 A 90 90 ASN H H 320 8.900 8.613 0.287 1
1 1043 . 3 1 1 A 90 90 ASN HA H 320 4.410 5.104 -0.694 1
1 1048 . 3 1 1 A 90 90 ASN CA C 320 54.120 55.013 -0.893 1
1 1049 . 3 1 1 A 90 90 ASN CB C 320 37.640 40.981 -3.341 1
1 1050 . 3 1 1 A 90 90 ASN N N 320 116.540 116.991 -0.451 1
1 1052 . 3 1 1 A 91 91 TRP H H 321 7.990 7.300 0.690 1
1 1053 . 3 1 1 A 91 91 TRP HA H 321 4.330 4.676 -0.346 1
1 1062 . 3 1 1 A 91 91 TRP CA C 321 54.590 58.436 -3.846 1
1 1063 . 3 1 1 A 91 91 TRP CB C 321 31.280 31.112 0.168 1
1 1069 . 3 1 1 A 91 91 TRP N N 321 119.230 118.362 0.868 1
1 1071 . 3 1 1 A 92 92 PRO HA H 322 4.800 3.710 1.090 1
1 1077 . 3 1 1 A 93 93 PRO HA H 323 4.450 4.389 0.061 1
1 1084 . 3 1 1 A 93 93 PRO CA C 323 61.970 62.285 -0.315 1
1 1085 . 3 1 1 A 93 93 PRO CB C 323 32.830 32.554 0.276 1
1 1088 . 3 1 1 A 94 94 ALA H H 324 8.460 8.739 -0.279 1
1 1089 . 3 1 1 A 94 94 ALA HA H 324 4.000 3.963 0.037 1
1 1093 . 3 1 1 A 94 94 ALA CA C 324 53.790 54.604 -0.814 1
1 1094 . 3 1 1 A 94 94 ALA CB C 324 18.640 18.146 0.494 1
1 1095 . 3 1 1 A 94 94 ALA N N 324 124.010 126.452 -2.442 1
1 1096 . 3 1 1 A 95 95 SER H H 325 7.950 7.992 -0.042 1
1 1097 . 3 1 1 A 95 95 SER HA H 325 4.210 4.139 0.071 1
1 1100 . 3 1 1 A 95 95 SER CA C 325 58.970 62.216 -3.246 1
1 1101 . 3 1 1 A 95 95 SER CB C 325 63.040 63.196 -0.156 1
1 1102 . 3 1 1 A 95 95 SER N N 325 111.520 114.500 -2.980 1
1 1103 . 3 1 1 A 96 96 ILE H H 326 7.480 7.436 0.044 1
1 1104 . 3 1 1 A 96 96 ILE HA H 326 4.170 4.090 0.080 1
1 1114 . 3 1 1 A 96 96 ILE CA C 326 61.300 62.206 -0.906 1
1 1115 . 3 1 1 A 96 96 ILE CB C 326 38.530 37.693 0.837 1
1 1119 . 3 1 1 A 96 96 ILE N N 326 119.650 117.487 2.163 1
1 1120 . 3 1 1 A 97 97 ALA H H 327 7.860 7.452 0.408 1
1 1121 . 3 1 1 A 97 97 ALA HA H 327 4.230 3.986 0.244 1
1 1125 . 3 1 1 A 97 97 ALA CA C 327 52.570 55.180 -2.610 1
1 1126 . 3 1 1 A 97 97 ALA CB C 327 19.590 18.158 1.432 1
1 1127 . 3 1 1 A 97 97 ALA N N 327 126.480 125.722 0.758 1
1 1128 . 3 1 1 A 98 98 ASP H H 328 8.250 8.025 0.225 1
1 1129 . 3 1 1 A 98 98 ASP HA H 328 4.540 4.370 0.170 1
1 1132 . 3 1 1 A 98 98 ASP CA C 328 54.150 57.034 -2.884 1
1 1133 . 3 1 1 A 98 98 ASP CB C 328 41.120 41.475 -0.355 1
1 1134 . 3 1 1 A 98 98 ASP N N 328 120.130 118.461 1.669 1
1 1150 . 3 2 2 B 6 6 ASP H H 427 8.160 8.440 -0.280 1
1 1151 . 3 2 2 B 6 6 ASP HA H 427 4.630 4.342 0.288 1
1 1154 . 3 2 2 B 6 6 ASP CA C 427 54.410 56.941 -2.531 1
1 1155 . 3 2 2 B 6 6 ASP CB C 427 41.250 40.706 0.544 1
1 1156 . 3 2 2 B 6 6 ASP N N 427 120.160 119.095 1.065 1
1 1157 . 3 2 2 B 7 7 ASN H H 428 8.350 7.814 0.536 1
1 1158 . 3 2 2 B 7 7 ASN HA H 428 4.550 4.806 -0.256 1
1 1163 . 3 2 2 B 7 7 ASN CA C 428 53.310 53.978 -0.668 1
1 1164 . 3 2 2 B 7 7 ASN CB C 428 38.850 38.690 0.160 1
1 1165 . 3 2 2 B 7 7 ASN N N 428 118.440 115.312 3.128 1
1 1167 . 3 2 2 B 8 8 LYS H H 429 8.030 7.756 0.274 1
1 1172 . 3 2 2 B 8 8 LYS CB C 429 33.280 33.308 -0.028 1
1 1174 . 3 2 2 B 8 8 LYS N N 429 120.260 122.711 -2.451 1
1 1175 . 3 2 2 B 9 9 PRO HA H 430 4.420 4.345 0.075 1
1 1182 . 3 2 2 B 9 9 PRO CA C 430 62.280 62.443 -0.163 1
1 1183 . 3 2 2 B 9 9 PRO CB C 430 31.920 31.939 -0.019 1
1 1186 . 3 2 2 B 10 10 ALA H H 431 8.930 9.166 -0.236 1
1 1187 . 3 2 2 B 10 10 ALA HA H 431 4.350 4.424 -0.074 1
1 1191 . 3 2 2 B 10 10 ALA CA C 431 51.070 52.054 -0.984 1
1 1192 . 3 2 2 B 10 10 ALA CB C 431 20.920 19.375 1.545 1
1 1193 . 3 2 2 B 10 10 ALA N N 431 125.000 124.836 0.164 1
1 1194 . 3 2 2 B 11 11 ASP H H 432 8.530 9.175 -0.645 1
1 1195 . 3 2 2 B 11 11 ASP HA H 432 4.220 4.214 0.006 1
1 1198 . 3 2 2 B 11 11 ASP CA C 432 57.520 57.479 0.041 1
1 1199 . 3 2 2 B 11 11 ASP CB C 432 40.470 40.245 0.225 1
1 1200 . 3 2 2 B 11 11 ASP N N 432 119.610 122.675 -3.065 1
1 1201 . 3 2 2 B 12 12 ASP H H 433 8.340 7.932 0.408 1
1 1202 . 3 2 2 B 12 12 ASP HA H 433 4.160 4.409 -0.249 1
1 1205 . 3 2 2 B 12 12 ASP CA C 433 56.090 57.377 -1.287 1
1 1206 . 3 2 2 B 12 12 ASP CB C 433 38.960 41.095 -2.135 1
1 1207 . 3 2 2 B 12 12 ASP N N 433 116.330 119.810 -3.480 1
1 1208 . 3 2 2 B 13 13 LEU H H 434 7.360 7.770 -0.410 1
1 1209 . 3 2 2 B 13 13 LEU HA H 434 4.050 4.030 0.020 1
1 1219 . 3 2 2 B 13 13 LEU CA C 434 57.340 57.740 -0.400 1
1 1220 . 3 2 2 B 13 13 LEU CB C 434 42.960 41.638 1.322 1
1 1224 . 3 2 2 B 13 13 LEU N N 434 123.440 120.808 2.632 1
1 1225 . 3 2 2 B 14 14 LEU H H 435 7.670 8.386 -0.716 1
1 1226 . 3 2 2 B 14 14 LEU HA H 435 3.710 3.907 -0.197 1
1 1236 . 3 2 2 B 14 14 LEU CA C 435 57.170 57.858 -0.688 1
1 1237 . 3 2 2 B 14 14 LEU CB C 435 42.590 40.919 1.671 1
1 1241 . 3 2 2 B 14 14 LEU N N 435 115.170 119.626 -4.456 1
1 1242 . 3 2 2 B 15 15 ASN H H 436 7.490 7.662 -0.172 1
1 1243 . 3 2 2 B 15 15 ASN HA H 436 4.640 4.828 -0.188 1
1 1248 . 3 2 2 B 15 15 ASN CA C 436 52.920 53.261 -0.341 1
1 1249 . 3 2 2 B 15 15 ASN CB C 436 39.350 38.956 0.394 1
1 1250 . 3 2 2 B 15 15 ASN N N 436 112.280 114.965 -2.685 1
1 1252 . 3 2 2 B 16 16 LEU H H 437 7.300 7.218 0.082 1
1 1253 . 3 2 2 B 16 16 LEU HA H 437 4.100 4.228 -0.128 1
1 1263 . 3 2 2 B 16 16 LEU CA C 437 55.310 55.277 0.033 1
1 1264 . 3 2 2 B 16 16 LEU CB C 437 41.800 43.046 -1.246 1
1 1268 . 3 2 2 B 16 16 LEU N N 437 125.180 122.870 2.310 1
1 1269 . 3 2 2 B 17 17 GLU H H 438 8.590 8.732 -0.142 1
1 1270 . 3 2 2 B 17 17 GLU HA H 438 3.920 4.029 -0.109 1
1 1275 . 3 2 2 B 17 17 GLU CA C 438 58.440 57.990 0.450 1
1 1276 . 3 2 2 B 17 17 GLU CB C 438 29.180 29.702 -0.522 1
1 1278 . 3 2 2 B 17 17 GLU N N 438 129.850 125.878 3.972 1
1 1279 . 3 2 2 B 18 18 GLY H H 439 8.580 8.974 -0.394 1
1 1280 . 3 2 2 B 18 18 GLY HA2 H 439 3.570 3.960 -0.390 1
1 1281 . 3 2 2 B 18 18 GLY HA3 H 439 4.220 3.962 0.258 1
1 1282 . 3 2 2 B 18 18 GLY CA C 439 44.710 45.443 -0.733 1
1 1283 . 3 2 2 B 18 18 GLY N N 439 112.250 114.869 -2.619 1
1 1284 . 3 2 2 B 19 19 VAL H H 440 7.900 7.749 0.151 1
1 1285 . 3 2 2 B 19 19 VAL HA H 440 3.950 4.454 -0.504 1
1 1293 . 3 2 2 B 19 19 VAL CA C 440 62.820 60.868 1.952 1
1 1294 . 3 2 2 B 19 19 VAL CB C 440 31.470 34.580 -3.110 1
1 1297 . 3 2 2 B 19 19 VAL N N 440 121.910 121.671 0.239 1
1 1298 . 3 2 2 B 20 20 ASP H H 441 7.390 8.797 -1.407 1
1 1299 . 3 2 2 B 20 20 ASP HA H 441 4.820 4.744 0.076 1
1 1302 . 3 2 2 B 20 20 ASP CA C 441 51.920 53.777 -1.857 1
1 1303 . 3 2 2 B 20 20 ASP CB C 441 42.090 41.404 0.686 1
1 1304 . 3 2 2 B 20 20 ASP N N 441 124.850 126.191 -1.341 1
1 1305 . 3 2 2 B 21 21 ARG H H 442 8.630 8.785 -0.155 1
1 1306 . 3 2 2 B 21 21 ARG HA H 442 3.810 3.883 -0.073 1
1 1313 . 3 2 2 B 21 21 ARG CA C 442 60.710 59.976 0.734 1
1 1314 . 3 2 2 B 21 21 ARG CB C 442 30.020 30.086 -0.066 1
1 1317 . 3 2 2 B 21 21 ARG N N 442 120.890 122.799 -1.909 1
1 1318 . 3 2 2 B 22 22 ASP H H 443 8.140 8.317 -0.177 1
1 1319 . 3 2 2 B 22 22 ASP HA H 443 4.420 4.808 -0.388 1
1 1322 . 3 2 2 B 22 22 ASP CA C 443 57.680 57.506 0.174 1
1 1323 . 3 2 2 B 22 22 ASP CB C 443 40.880 40.577 0.303 1
1 1324 . 3 2 2 B 22 22 ASP N N 443 116.750 120.512 -3.762 1
1 1325 . 3 2 2 B 23 23 LEU H H 444 8.170 8.014 0.156 1
1 1326 . 3 2 2 B 23 23 LEU HA H 444 4.130 4.095 0.035 1
1 1336 . 3 2 2 B 23 23 LEU CA C 444 57.770 57.847 -0.077 1
1 1337 . 3 2 2 B 23 23 LEU CB C 444 41.230 41.201 0.029 1
1 1341 . 3 2 2 B 23 23 LEU N N 444 122.130 121.895 0.235 1
1 1342 . 3 2 2 B 24 24 ALA H H 445 8.630 8.353 0.277 1
1 1343 . 3 2 2 B 24 24 ALA HA H 445 3.790 3.976 -0.186 1
1 1347 . 3 2 2 B 24 24 ALA CA C 445 55.810 53.944 1.866 1
1 1348 . 3 2 2 B 24 24 ALA CB C 445 18.060 18.145 -0.085 1
1 1349 . 3 2 2 B 24 24 ALA N N 445 120.890 121.440 -0.550 1
1 1350 . 3 2 2 B 25 25 PHE H H 446 8.160 7.511 0.649 1
1 1351 . 3 2 2 B 25 25 PHE HA H 446 4.080 4.346 -0.266 1
1 1358 . 3 2 2 B 25 25 PHE CA C 446 62.670 61.590 1.080 1
1 1359 . 3 2 2 B 25 25 PHE CB C 446 39.440 38.532 0.908 1
1 1364 . 3 2 2 B 25 25 PHE N N 446 115.360 115.850 -0.490 1
1 1365 . 3 2 2 B 26 26 LYS H H 447 8.040 8.182 -0.142 1
1 1366 . 3 2 2 B 26 26 LYS HA H 447 4.110 4.026 0.084 1
1 1375 . 3 2 2 B 26 26 LYS CA C 447 60.140 60.008 0.132 1
1 1376 . 3 2 2 B 26 26 LYS CB C 447 32.880 32.130 0.750 1
1 1380 . 3 2 2 B 26 26 LYS N N 447 123.110 120.345 2.765 1
1 1381 . 3 2 2 B 27 27 LEU H H 448 8.630 8.156 0.474 1
1 1382 . 3 2 2 B 27 27 LEU HA H 448 3.840 4.061 -0.221 1
1 1392 . 3 2 2 B 27 27 LEU CA C 448 58.210 57.641 0.569 1
1 1393 . 3 2 2 B 27 27 LEU CB C 448 39.760 41.453 -1.693 1
1 1396 . 3 2 2 B 27 27 LEU N N 448 120.890 120.929 -0.039 1
1 1397 . 3 2 2 B 28 28 ALA H H 449 8.200 8.477 -0.277 1
1 1398 . 3 2 2 B 28 28 ALA HA H 449 3.760 4.463 -0.703 1
1 1402 . 3 2 2 B 28 28 ALA CA C 449 54.750 55.100 -0.350 1
1 1403 . 3 2 2 B 28 28 ALA CB C 449 18.050 18.286 -0.236 1
1 1404 . 3 2 2 B 28 28 ALA N N 449 123.710 120.421 3.289 1
1 1405 . 3 2 2 B 29 29 ALA H H 450 7.780 7.953 -0.173 1
1 1406 . 3 2 2 B 29 29 ALA HA H 450 4.170 4.076 0.094 1
1 1410 . 3 2 2 B 29 29 ALA CA C 450 54.430 54.716 -0.286 1
1 1411 . 3 2 2 B 29 29 ALA CB C 450 18.040 18.559 -0.519 1
1 1412 . 3 2 2 B 29 29 ALA N N 450 121.020 119.518 1.502 1
1 1413 . 3 2 2 B 30 30 ARG H H 451 7.390 7.846 -0.456 1
1 1414 . 3 2 2 B 30 30 ARG HA H 451 4.540 4.409 0.131 1
1 1421 . 3 2 2 B 30 30 ARG CA C 451 54.510 55.748 -1.238 1
1 1422 . 3 2 2 B 30 30 ARG CB C 451 29.950 29.691 0.259 1
1 1425 . 3 2 2 B 30 30 ARG N N 451 115.480 116.634 -1.154 1
1 1426 . 3 2 2 B 31 31 GLY H H 452 7.950 8.181 -0.231 1
1 1427 . 3 2 2 B 31 31 GLY HA2 H 452 3.550 3.976 -0.426 1
1 1428 . 3 2 2 B 31 31 GLY HA3 H 452 4.200 3.979 0.221 1
1 1429 . 3 2 2 B 31 31 GLY CA C 452 45.380 45.349 0.031 1
1 1430 . 3 2 2 B 31 31 GLY N N 452 107.740 107.546 0.194 1
1 1431 . 3 2 2 B 32 32 VAL H H 453 7.990 7.610 0.380 1
1 1432 . 3 2 2 B 32 32 VAL HA H 453 3.930 3.899 0.031 1
1 1440 . 3 2 2 B 32 32 VAL CA C 453 61.420 62.841 -1.421 1
1 1441 . 3 2 2 B 32 32 VAL CB C 453 29.860 31.773 -1.913 1
1 1444 . 3 2 2 B 32 32 VAL N N 453 125.560 120.619 4.941 1
1 1445 . 3 2 2 B 33 33 CYS H H 454 8.460 8.756 -0.296 1
1 1446 . 3 2 2 B 33 33 CYS HA H 454 4.310 4.757 -0.447 1
1 1449 . 3 2 2 B 33 33 CYS CA C 454 60.260 59.782 0.478 1
1 1450 . 3 2 2 B 33 33 CYS CB C 454 30.330 30.576 -0.246 1
1 1451 . 3 2 2 B 33 33 CYS N N 454 119.460 125.280 -5.820 1
1 1452 . 3 2 2 B 34 34 THR H H 455 8.080 8.126 -0.046 1
1 1453 . 3 2 2 B 34 34 THR HA H 455 4.840 4.563 0.277 1
1 1458 . 3 2 2 B 34 34 THR CA C 455 58.650 61.404 -2.754 1
1 1459 . 3 2 2 B 34 34 THR CB C 455 72.680 70.700 1.980 1
1 1461 . 3 2 2 B 34 34 THR N N 455 108.420 114.806 -6.386 1
1 1462 . 3 2 2 B 35 35 LEU H H 456 8.580 8.762 -0.182 1
1 1463 . 3 2 2 B 35 35 LEU HA H 456 3.790 3.947 -0.157 1
1 1473 . 3 2 2 B 35 35 LEU CA C 456 57.980 58.680 -0.700 1
1 1474 . 3 2 2 B 35 35 LEU CB C 456 42.220 41.542 0.678 1
1 1477 . 3 2 2 B 35 35 LEU N N 456 120.370 128.187 -7.817 1
1 1478 . 3 2 2 B 36 36 GLU H H 457 8.390 8.173 0.217 1
1 1479 . 3 2 2 B 36 36 GLU HA H 457 3.820 3.917 -0.097 1
1 1484 . 3 2 2 B 36 36 GLU CA C 457 59.640 59.834 -0.194 1
1 1485 . 3 2 2 B 36 36 GLU CB C 457 28.780 29.217 -0.437 1
1 1487 . 3 2 2 B 36 36 GLU N N 457 119.450 118.653 0.797 1
1 1488 . 3 2 2 B 37 37 ASP H H 458 7.750 7.920 -0.170 1
1 1489 . 3 2 2 B 37 37 ASP HA H 458 4.140 4.377 -0.237 1
1 1492 . 3 2 2 B 37 37 ASP CA C 458 57.150 57.314 -0.164 1
1 1493 . 3 2 2 B 37 37 ASP CB C 458 42.280 40.415 1.865 1
1 1494 . 3 2 2 B 37 37 ASP N N 458 117.430 119.726 -2.296 1
1 1495 . 3 2 2 B 38 38 LEU H H 459 7.700 7.802 -0.102 1
1 1496 . 3 2 2 B 38 38 LEU HA H 459 3.790 4.112 -0.322 1
1 1506 . 3 2 2 B 38 38 LEU CA C 459 58.080 57.927 0.153 1
1 1507 . 3 2 2 B 38 38 LEU CB C 459 41.130 41.204 -0.074 1
1 1511 . 3 2 2 B 38 38 LEU N N 459 121.280 121.732 -0.452 1
1 1512 . 3 2 2 B 39 39 ALA H H 460 8.190 8.283 -0.093 1
1 1513 . 3 2 2 B 39 39 ALA HA H 460 3.640 3.951 -0.311 1
1 1517 . 3 2 2 B 39 39 ALA CA C 460 54.320 55.384 -1.064 1
1 1518 . 3 2 2 B 39 39 ALA CB C 460 17.140 18.130 -0.990 1
1 1519 . 3 2 2 B 39 39 ALA N N 460 119.400 120.125 -0.725 1
1 1520 . 3 2 2 B 40 40 GLU H H 461 7.340 8.016 -0.676 1
1 1521 . 3 2 2 B 40 40 GLU HA H 461 4.180 4.054 0.126 1
1 1526 . 3 2 2 B 40 40 GLU CA C 461 57.800 58.945 -1.145 1
1 1527 . 3 2 2 B 40 40 GLU CB C 461 30.600 29.254 1.346 1
1 1529 . 3 2 2 B 40 40 GLU N N 461 110.680 117.401 -6.721 1
1 1530 . 3 2 2 B 41 41 GLN H H 462 7.940 7.730 0.210 1
1 1531 . 3 2 2 B 41 41 GLN HA H 462 4.100 4.477 -0.377 1
1 1538 . 3 2 2 B 41 41 GLN CA C 462 55.310 56.009 -0.699 1
1 1539 . 3 2 2 B 41 41 GLN CB C 462 28.780 29.329 -0.549 1
1 1541 . 3 2 2 B 41 41 GLN N N 462 120.720 118.885 1.835 1
1 1543 . 3 2 2 B 42 42 GLY H H 463 9.000 8.518 0.482 1
1 1544 . 3 2 2 B 42 42 GLY HA2 H 463 3.310 4.181 -0.871 1
1 1545 . 3 2 2 B 42 42 GLY HA3 H 463 4.820 4.183 0.637 1
1 1546 . 3 2 2 B 42 42 GLY CA C 463 42.650 44.380 -1.730 1
1 1547 . 3 2 2 B 42 42 GLY N N 463 104.110 109.651 -5.541 1
1 1548 . 3 2 2 B 43 43 ILE H H 464 7.900 8.728 -0.828 1
1 1549 . 3 2 2 B 43 43 ILE HA H 464 3.260 3.717 -0.457 1
1 1558 . 3 2 2 B 43 43 ILE CA C 464 66.570 64.334 2.236 1
1 1559 . 3 2 2 B 43 43 ILE CB C 464 38.770 37.618 1.152 1
1 1562 . 3 2 2 B 43 43 ILE N N 464 119.410 120.148 -0.738 1
1 1563 . 3 2 2 B 44 44 ASP H H 465 8.730 8.093 0.637 1
1 1564 . 3 2 2 B 44 44 ASP HA H 465 4.310 4.406 -0.096 1
1 1567 . 3 2 2 B 44 44 ASP CA C 465 56.740 57.163 -0.423 1
1 1568 . 3 2 2 B 44 44 ASP CB C 465 40.120 40.135 -0.015 1
1 1569 . 3 2 2 B 44 44 ASP N N 465 116.610 122.020 -5.410 1
1 1570 . 3 2 2 B 45 45 ASP H H 466 7.720 8.383 -0.663 1
1 1571 . 3 2 2 B 45 45 ASP HA H 466 4.480 4.428 0.052 1
1 1574 . 3 2 2 B 45 45 ASP CA C 466 57.000 57.232 -0.232 1
1 1575 . 3 2 2 B 45 45 ASP CB C 466 42.270 40.441 1.829 1
1 1576 . 3 2 2 B 45 45 ASP N N 466 117.560 120.226 -2.666 1
1 1577 . 3 2 2 B 46 46 LEU H H 467 7.370 7.670 -0.300 1
1 1578 . 3 2 2 B 46 46 LEU HA H 467 4.410 4.176 0.234 1
1 1587 . 3 2 2 B 46 46 LEU CA C 467 53.660 57.234 -3.574 1
1 1588 . 3 2 2 B 46 46 LEU CB C 467 42.260 41.550 0.710 1
1 1591 . 3 2 2 B 46 46 LEU N N 467 116.890 119.834 -2.944 1
1 1592 . 3 2 2 B 47 47 ALA H H 468 7.080 8.517 -1.437 1
1 1593 . 3 2 2 B 47 47 ALA HA H 468 4.120 4.021 0.099 1
1 1597 . 3 2 2 B 47 47 ALA CA C 468 54.130 54.847 -0.717 1
1 1598 . 3 2 2 B 47 47 ALA CB C 468 19.480 18.314 1.166 1
1 1599 . 3 2 2 B 47 47 ALA N N 468 120.150 122.768 -2.618 1
1 1600 . 3 2 2 B 48 48 ASP H H 469 8.560 8.143 0.417 1
1 1601 . 3 2 2 B 48 48 ASP HA H 469 4.410 4.393 0.017 1
1 1604 . 3 2 2 B 48 48 ASP CA C 469 54.330 56.633 -2.303 1
1 1605 . 3 2 2 B 48 48 ASP CB C 469 39.760 40.928 -1.168 1
1 1606 . 3 2 2 B 48 48 ASP N N 469 114.660 117.872 -3.212 1
1 1607 . 3 2 2 B 49 49 ILE H H 470 7.870 8.152 -0.282 1
1 1608 . 3 2 2 B 49 49 ILE HA H 470 3.850 4.343 -0.493 1
1 1618 . 3 2 2 B 49 49 ILE CA C 470 61.680 60.823 0.857 1
1 1619 . 3 2 2 B 49 49 ILE CB C 470 37.120 38.812 -1.692 1
1 1623 . 3 2 2 B 49 49 ILE N N 470 121.600 117.697 3.903 1
1 1624 . 3 2 2 B 50 50 GLU H H 471 8.680 8.836 -0.156 1
1 1625 . 3 2 2 B 50 50 GLU HA H 471 3.940 4.068 -0.128 1
1 1630 . 3 2 2 B 50 50 GLU CA C 471 58.360 59.324 -0.964 1
1 1631 . 3 2 2 B 50 50 GLU CB C 471 29.530 29.366 0.164 1
1 1633 . 3 2 2 B 50 50 GLU N N 471 131.000 126.706 4.294 1
1 1634 . 3 2 2 B 51 51 GLY H H 472 8.860 8.211 0.649 1
1 1635 . 3 2 2 B 51 51 GLY HA2 H 472 3.640 4.005 -0.365 1
1 1636 . 3 2 2 B 51 51 GLY HA3 H 472 4.230 4.008 0.222 1
1 1637 . 3 2 2 B 51 51 GLY CA C 472 45.190 47.202 -2.012 1
1 1638 . 3 2 2 B 51 51 GLY N N 472 113.580 108.785 4.795 1
1 1639 . 3 2 2 B 52 52 LEU H H 473 7.850 7.797 0.053 1
1 1640 . 3 2 2 B 52 52 LEU HA H 473 4.680 4.810 -0.130 1
1 1650 . 3 2 2 B 52 52 LEU CA C 473 53.640 53.715 -0.075 1
1 1651 . 3 2 2 B 52 52 LEU CB C 473 42.990 43.699 -0.709 1
1 1655 . 3 2 2 B 52 52 LEU N N 473 123.020 119.822 3.198 1
1 1656 . 3 2 2 B 53 53 THR H H 474 7.550 8.906 -1.356 1
1 1657 . 3 2 2 B 53 53 THR HA H 474 4.560 4.821 -0.261 1
1 1662 . 3 2 2 B 53 53 THR CA C 474 60.060 60.883 -0.823 1
1 1663 . 3 2 2 B 53 53 THR CB C 474 71.520 71.201 0.319 1
1 1665 . 3 2 2 B 53 53 THR N N 474 115.070 118.375 -3.305 1
1 1666 . 3 2 2 B 54 54 ASP H H 475 8.900 9.022 -0.122 1
1 1667 . 3 2 2 B 54 54 ASP HA H 475 4.220 4.276 -0.056 1
1 1670 . 3 2 2 B 54 54 ASP CA C 475 57.520 58.015 -0.495 1
1 1671 . 3 2 2 B 54 54 ASP CB C 475 39.560 40.279 -0.719 1
1 1672 . 3 2 2 B 54 54 ASP N N 475 121.800 123.826 -2.026 1
1 1673 . 3 2 2 B 55 55 GLU H H 476 8.460 7.943 0.517 1
1 1674 . 3 2 2 B 55 55 GLU HA H 476 3.970 4.028 -0.058 1
1 1679 . 3 2 2 B 55 55 GLU CA C 476 59.440 59.048 0.392 1
1 1680 . 3 2 2 B 55 55 GLU CB C 476 29.650 29.578 0.072 1
1 1682 . 3 2 2 B 55 55 GLU N N 476 119.460 119.406 0.054 1
1 1683 . 3 2 2 B 56 56 LYS H H 477 7.790 7.997 -0.207 1
1 1684 . 3 2 2 B 56 56 LYS HA H 477 4.120 4.099 0.021 1
1 1693 . 3 2 2 B 56 56 LYS CA C 477 58.890 59.540 -0.650 1
1 1694 . 3 2 2 B 56 56 LYS CB C 477 32.600 32.299 0.301 1
1 1698 . 3 2 2 B 56 56 LYS N N 477 121.840 119.707 2.133 1
1 1699 . 3 2 2 B 57 57 ALA H H 478 8.900 9.223 -0.323 1
1 1700 . 3 2 2 B 57 57 ALA HA H 478 3.790 4.066 -0.276 1
1 1704 . 3 2 2 B 57 57 ALA CA C 478 55.810 55.425 0.385 1
1 1705 . 3 2 2 B 57 57 ALA CB C 478 18.590 18.225 0.365 1
1 1706 . 3 2 2 B 57 57 ALA N N 478 121.350 121.623 -0.273 1
1 1707 . 3 2 2 B 58 58 GLY H H 479 8.300 8.074 0.226 1
1 1708 . 3 2 2 B 58 58 GLY HA2 H 479 3.500 3.800 -0.300 1
1 1709 . 3 2 2 B 58 58 GLY HA3 H 479 3.890 3.801 0.089 1
1 1710 . 3 2 2 B 58 58 GLY CA C 479 47.360 47.228 0.132 1
1 1711 . 3 2 2 B 58 58 GLY N N 479 102.040 108.223 -6.183 1
1 1712 . 3 2 2 B 59 59 ALA H H 480 7.580 8.061 -0.481 1
1 1713 . 3 2 2 B 59 59 ALA HA H 480 4.110 4.024 0.086 1
1 1717 . 3 2 2 B 59 59 ALA CA C 480 55.580 54.963 0.617 1
1 1718 . 3 2 2 B 59 59 ALA CB C 480 18.130 18.050 0.080 1
1 1719 . 3 2 2 B 59 59 ALA N N 480 123.180 124.265 -1.085 1
1 1720 . 3 2 2 B 60 60 LEU H H 481 8.290 8.035 0.255 1
1 1721 . 3 2 2 B 60 60 LEU HA H 481 4.020 3.908 0.112 1
1 1731 . 3 2 2 B 60 60 LEU CA C 481 57.850 58.102 -0.252 1
1 1732 . 3 2 2 B 60 60 LEU CB C 481 42.360 41.390 0.970 1
1 1736 . 3 2 2 B 60 60 LEU N N 481 120.560 117.755 2.805 1
1 1737 . 3 2 2 B 61 61 ILE H H 482 8.080 8.017 0.063 1
1 1738 . 3 2 2 B 61 61 ILE HA H 482 3.210 3.449 -0.239 1
1 1748 . 3 2 2 B 61 61 ILE CA C 482 66.250 64.938 1.312 1
1 1749 . 3 2 2 B 61 61 ILE CB C 482 39.400 38.252 1.148 1
1 1753 . 3 2 2 B 61 61 ILE N N 482 119.170 120.429 -1.259 1
1 1754 . 3 2 2 B 62 62 MET H H 483 8.110 8.407 -0.297 1
1 1755 . 3 2 2 B 62 62 MET HA H 483 4.410 4.112 0.298 1
1 1763 . 3 2 2 B 62 62 MET CA C 483 56.110 58.811 -2.701 1
1 1764 . 3 2 2 B 62 62 MET CB C 483 28.260 31.959 -3.699 1
1 1767 . 3 2 2 B 62 62 MET N N 483 114.420 118.084 -3.664 1
1 1768 . 3 2 2 B 63 63 ALA H H 484 8.240 7.905 0.335 1
1 1769 . 3 2 2 B 63 63 ALA HA H 484 4.130 3.967 0.163 1
1 1773 . 3 2 2 B 63 63 ALA CA C 484 55.300 55.137 0.163 1
1 1774 . 3 2 2 B 63 63 ALA CB C 484 18.280 18.497 -0.217 1
1 1775 . 3 2 2 B 63 63 ALA N N 484 123.710 121.555 2.155 1
1 1776 . 3 2 2 B 64 64 ALA H H 485 8.050 8.065 -0.015 1
1 1777 . 3 2 2 B 64 64 ALA HA H 485 3.870 3.928 -0.058 1
1 1781 . 3 2 2 B 64 64 ALA CA C 485 55.330 55.254 0.076 1
1 1782 . 3 2 2 B 64 64 ALA CB C 485 17.660 18.196 -0.536 1
1 1783 . 3 2 2 B 64 64 ALA N N 485 120.070 119.538 0.532 1
1 1784 . 3 2 2 B 65 65 ARG H H 486 8.640 8.818 -0.178 1
1 1785 . 3 2 2 B 65 65 ARG HA H 486 2.800 4.082 -1.282 1
1 1792 . 3 2 2 B 65 65 ARG CA C 486 60.600 59.555 1.045 1
1 1793 . 3 2 2 B 65 65 ARG CB C 486 29.910 29.925 -0.015 1
1 1796 . 3 2 2 B 65 65 ARG N N 486 118.730 117.914 0.816 1
1 1797 . 3 2 2 B 66 66 ASN H H 487 8.710 9.030 -0.320 1
1 1798 . 3 2 2 B 66 66 ASN HA H 487 4.550 3.916 0.634 1
1 1803 . 3 2 2 B 66 66 ASN CA C 487 56.390 55.650 0.740 1
1 1804 . 3 2 2 B 66 66 ASN CB C 487 37.970 37.907 0.063 1
1 1805 . 3 2 2 B 66 66 ASN N N 487 119.170 117.593 1.577 1
1 1807 . 3 2 2 B 67 67 ILE H H 488 7.250 7.695 -0.445 1
1 1808 . 3 2 2 B 67 67 ILE HA H 488 3.810 3.700 0.110 1
1 1818 . 3 2 2 B 67 67 ILE CA C 488 64.350 64.788 -0.438 1
1 1819 . 3 2 2 B 67 67 ILE CB C 488 39.570 37.672 1.898 1
1 1823 . 3 2 2 B 67 67 ILE N N 488 117.890 119.325 -1.435 1
1 1824 . 3 2 2 B 68 68 CYS H H 489 8.350 7.891 0.459 1
1 1825 . 3 2 2 B 68 68 CYS HA H 489 4.080 4.017 0.063 1
1 1828 . 3 2 2 B 68 68 CYS CA C 489 62.670 63.019 -0.349 1
1 1829 . 3 2 2 B 68 68 CYS CB C 489 28.170 27.770 0.400 1
1 1830 . 3 2 2 B 68 68 CYS N N 489 115.230 119.631 -4.401 1
1 1831 . 3 2 2 B 69 69 TRP H H 490 8.230 8.900 -0.670 1
1 1832 . 3 2 2 B 69 69 TRP HA H 490 5.100 4.423 0.677 1
1 1841 . 3 2 2 B 69 69 TRP CA C 490 55.420 60.600 -5.180 1
1 1842 . 3 2 2 B 69 69 TRP CB C 490 31.010 29.243 1.767 1
1 1844 . 3 2 2 B 69 69 TRP N N 490 116.850 120.738 -3.888 1
1 1846 . 3 2 2 B 70 70 PHE H H 491 7.570 8.563 -0.993 1
1 1847 . 3 2 2 B 70 70 PHE HA H 491 5.240 4.494 0.746 1
1 1852 . 3 2 2 B 70 70 PHE CA C 491 55.490 60.430 -4.940 1
1 1853 . 3 2 2 B 70 70 PHE CB C 491 38.700 37.504 1.196 1
1 1856 . 3 2 2 B 70 70 PHE N N 491 117.460 118.688 -1.228 1
1 1857 . 3 2 2 B 71 71 GLY H H 492 8.420 8.395 0.025 1
1 1858 . 3 2 2 B 71 71 GLY HA2 H 492 3.920 3.718 0.202 1
1 1859 . 3 2 2 B 71 71 GLY HA3 H 492 4.080 3.751 0.329 1
1 1860 . 3 2 2 B 71 71 GLY CA C 492 46.210 47.087 -0.877 1
1 1861 . 3 2 2 B 71 71 GLY N N 492 110.040 107.688 2.352 1
1 1862 . 3 2 2 B 72 72 ASP H H 493 8.370 7.541 0.829 1
1 1863 . 3 2 2 B 72 72 ASP HA H 493 4.630 4.358 0.272 1
1 1866 . 3 2 2 B 72 72 ASP CA C 493 54.410 56.621 -2.211 1
1 1867 . 3 2 2 B 72 72 ASP CB C 493 41.250 40.513 0.737 1
1 1868 . 3 2 2 B 72 72 ASP N N 493 120.000 120.105 -0.105 1
1 1869 . 3 2 2 B 73 73 GLU H H 494 8.230 7.607 0.623 1
1 1870 . 3 2 2 B 73 73 GLU HA H 494 4.260 4.904 -0.644 1
1 1875 . 3 2 2 B 73 73 GLU CA C 494 56.510 55.898 0.612 1
1 1876 . 3 2 2 B 73 73 GLU CB C 494 30.420 31.498 -1.078 1
1 1878 . 3 2 2 B 73 73 GLU N N 494 120.900 119.142 1.758 1
1 216 . 4 1 1 A 20 20 ASP H H 250 8.550 8.971 -0.421 1
1 217 . 4 1 1 A 20 20 ASP HA H 250 4.700 4.743 -0.043 1
1 220 . 4 1 1 A 20 20 ASP CA C 250 52.650 53.002 -0.352 1
1 221 . 4 1 1 A 20 20 ASP CB C 250 41.420 40.211 1.209 1
1 222 . 4 1 1 A 20 20 ASP N N 250 125.190 123.001 2.189 1
1 223 . 4 1 1 A 21 21 PRO HA H 251 4.250 4.427 -0.177 1
1 230 . 4 1 1 A 21 21 PRO CA C 251 65.120 64.616 0.504 1
1 231 . 4 1 1 A 21 21 PRO CB C 251 32.310 32.097 0.213 1
1 234 . 4 1 1 A 22 22 ILE H H 252 8.630 7.777 0.853 1
1 235 . 4 1 1 A 22 22 ILE HA H 252 4.060 3.922 0.138 1
1 245 . 4 1 1 A 22 22 ILE CA C 252 62.990 63.035 -0.045 1
1 246 . 4 1 1 A 22 22 ILE CB C 252 37.520 37.642 -0.122 1
1 250 . 4 1 1 A 22 22 ILE N N 252 119.860 117.166 2.694 1
1 251 . 4 1 1 A 23 23 LEU H H 253 7.950 7.846 0.104 1
1 252 . 4 1 1 A 23 23 LEU HA H 253 3.710 4.054 -0.344 1
1 262 . 4 1 1 A 23 23 LEU CA C 253 56.510 57.848 -1.338 1
1 263 . 4 1 1 A 23 23 LEU CB C 253 41.190 41.654 -0.464 1
1 266 . 4 1 1 A 23 23 LEU N N 253 116.850 121.301 -4.451 1
1 267 . 4 1 1 A 24 24 LEU H H 254 7.370 7.641 -0.271 1
1 268 . 4 1 1 A 24 24 LEU HA H 254 4.310 4.360 -0.050 1
1 278 . 4 1 1 A 24 24 LEU CA C 254 54.890 57.810 -2.920 1
1 279 . 4 1 1 A 24 24 LEU CB C 254 41.960 41.347 0.613 1
1 283 . 4 1 1 A 24 24 LEU N N 254 115.210 119.277 -4.067 1
1 284 . 4 1 1 A 25 25 ARG H H 255 7.520 7.419 0.101 1
1 285 . 4 1 1 A 25 25 ARG HA H 255 4.660 4.201 0.459 1
1 293 . 4 1 1 A 25 25 ARG CA C 255 52.840 54.478 -1.638 1
1 294 . 4 1 1 A 25 25 ARG CB C 255 28.130 29.848 -1.718 1
1 297 . 4 1 1 A 25 25 ARG N N 255 118.180 119.078 -0.898 1
1 298 . 4 1 1 A 26 26 PRO HA H 256 4.800 4.633 0.167 1
1 305 . 4 1 1 A 26 26 PRO CA C 256 61.790 62.709 -0.919 1
1 306 . 4 1 1 A 26 26 PRO CB C 256 32.660 32.071 0.589 1
1 309 . 4 1 1 A 27 27 VAL H H 257 8.170 8.395 -0.225 1
1 310 . 4 1 1 A 27 27 VAL HA H 257 3.590 3.711 -0.121 1
1 318 . 4 1 1 A 27 27 VAL CA C 257 64.830 65.698 -0.868 1
1 319 . 4 1 1 A 27 27 VAL CB C 257 31.720 31.525 0.195 1
1 322 . 4 1 1 A 27 27 VAL N N 257 115.710 124.252 -8.542 1
1 323 . 4 1 1 A 28 28 ASP H H 258 8.240 8.082 0.158 1
1 324 . 4 1 1 A 28 28 ASP HA H 258 4.340 4.407 -0.067 1
1 327 . 4 1 1 A 28 28 ASP CA C 258 56.490 57.525 -1.035 1
1 328 . 4 1 1 A 28 28 ASP CB C 258 40.520 42.050 -1.530 1
1 329 . 4 1 1 A 28 28 ASP N N 258 119.000 121.328 -2.328 1
1 330 . 4 1 1 A 29 29 ASP H H 259 8.000 8.785 -0.785 1
1 331 . 4 1 1 A 29 29 ASP HA H 259 4.390 4.595 -0.205 1
1 334 . 4 1 1 A 29 29 ASP CA C 259 56.210 55.815 0.395 1
1 335 . 4 1 1 A 29 29 ASP CB C 259 40.670 41.033 -0.363 1
1 336 . 4 1 1 A 29 29 ASP N N 259 118.900 117.247 1.653 1
1 337 . 4 1 1 A 30 30 LEU H H 260 7.760 7.579 0.181 1
1 338 . 4 1 1 A 30 30 LEU HA H 260 3.990 4.210 -0.220 1
1 348 . 4 1 1 A 30 30 LEU CA C 260 55.000 55.376 -0.376 1
1 349 . 4 1 1 A 30 30 LEU CB C 260 41.670 42.197 -0.527 1
1 353 . 4 1 1 A 30 30 LEU N N 260 116.300 121.190 -4.890 1
1 354 . 4 1 1 A 31 31 GLU H H 261 7.990 8.761 -0.771 1
1 355 . 4 1 1 A 31 31 GLU HA H 261 4.280 4.065 0.215 1
1 358 . 4 1 1 A 31 31 GLU CA C 261 56.860 59.217 -2.357 1
1 359 . 4 1 1 A 31 31 GLU CB C 261 27.010 29.349 -2.339 1
1 360 . 4 1 1 A 31 31 GLU N N 261 115.620 121.871 -6.251 1
1 361 . 4 1 1 A 32 32 LEU H H 262 8.000 7.296 0.704 1
1 362 . 4 1 1 A 32 32 LEU HA H 262 4.400 4.465 -0.065 1
1 372 . 4 1 1 A 32 32 LEU CA C 262 53.860 54.875 -1.015 1
1 373 . 4 1 1 A 32 32 LEU CB C 262 44.450 42.248 2.202 1
1 377 . 4 1 1 A 32 32 LEU N N 262 118.860 121.953 -3.093 1
1 378 . 4 1 1 A 33 33 THR H H 263 10.020 8.623 1.397 1
1 379 . 4 1 1 A 33 33 THR HA H 263 4.130 4.510 -0.380 1
1 384 . 4 1 1 A 33 33 THR CA C 263 62.400 60.968 1.432 1
1 385 . 4 1 1 A 33 33 THR CB C 263 71.270 71.080 0.190 1
1 387 . 4 1 1 A 33 33 THR N N 263 114.610 114.686 -0.076 1
1 388 . 4 1 1 A 34 34 VAL H H 264 8.370 8.748 -0.378 1
1 389 . 4 1 1 A 34 34 VAL HA H 264 3.620 3.635 -0.015 1
1 397 . 4 1 1 A 34 34 VAL CA C 264 66.340 66.698 -0.358 1
1 398 . 4 1 1 A 34 34 VAL CB C 264 31.670 31.331 0.339 1
1 401 . 4 1 1 A 34 34 VAL N N 264 122.110 122.450 -0.340 1
1 402 . 4 1 1 A 35 35 ARG H H 265 8.190 8.399 -0.209 1
1 403 . 4 1 1 A 35 35 ARG HA H 265 4.070 3.925 0.145 1
1 411 . 4 1 1 A 35 35 ARG CA C 265 59.470 60.176 -0.706 1
1 412 . 4 1 1 A 35 35 ARG CB C 265 29.790 30.066 -0.276 1
1 415 . 4 1 1 A 35 35 ARG N N 265 117.340 120.086 -2.746 1
1 416 . 4 1 1 A 36 36 SER H H 266 7.610 7.929 -0.319 1
1 417 . 4 1 1 A 36 36 SER HA H 266 4.080 4.205 -0.125 1
1 420 . 4 1 1 A 36 36 SER CA C 266 63.080 61.102 1.978 1
1 421 . 4 1 1 A 36 36 SER CB C 266 63.280 62.223 1.057 1
1 422 . 4 1 1 A 36 36 SER N N 266 116.710 114.024 2.686 1
1 423 . 4 1 1 A 37 37 ALA H H 267 8.720 7.824 0.896 1
1 424 . 4 1 1 A 37 37 ALA HA H 267 3.760 4.010 -0.250 1
1 428 . 4 1 1 A 37 37 ALA CA C 267 55.900 55.256 0.644 1
1 429 . 4 1 1 A 37 37 ALA CB C 267 18.090 17.979 0.111 1
1 430 . 4 1 1 A 37 37 ALA N N 267 124.170 123.051 1.119 1
1 431 . 4 1 1 A 38 38 ASN H H 268 8.850 9.314 -0.464 1
1 432 . 4 1 1 A 38 38 ASN HA H 268 4.420 4.491 -0.071 1
1 437 . 4 1 1 A 38 38 ASN CA C 268 55.700 56.258 -0.558 1
1 438 . 4 1 1 A 38 38 ASN CB C 268 37.180 37.744 -0.564 1
1 439 . 4 1 1 A 38 38 ASN N N 268 117.370 117.681 -0.311 1
1 441 . 4 1 1 A 39 39 CYS H H 269 7.970 8.200 -0.230 1
1 442 . 4 1 1 A 39 39 CYS HA H 269 4.190 4.092 0.098 1
1 445 . 4 1 1 A 39 39 CYS CA C 269 63.340 62.969 0.371 1
1 446 . 4 1 1 A 39 39 CYS CB C 269 26.870 27.068 -0.198 1
1 447 . 4 1 1 A 39 39 CYS N N 269 120.510 119.049 1.461 1
1 448 . 4 1 1 A 40 40 LEU H H 270 7.600 7.738 -0.138 1
1 449 . 4 1 1 A 40 40 LEU HA H 270 3.880 3.888 -0.008 1
1 458 . 4 1 1 A 40 40 LEU CA C 270 57.810 58.101 -0.291 1
1 459 . 4 1 1 A 40 40 LEU CB C 270 40.030 41.266 -1.236 1
1 462 . 4 1 1 A 40 40 LEU N N 270 117.710 120.319 -2.609 1
1 463 . 4 1 1 A 41 41 LYS H H 271 7.980 8.117 -0.137 1
1 464 . 4 1 1 A 41 41 LYS HA H 271 3.820 4.437 -0.617 1
1 472 . 4 1 1 A 41 41 LYS CA C 271 59.840 59.237 0.603 1
1 473 . 4 1 1 A 41 41 LYS CB C 271 32.070 32.184 -0.114 1
1 476 . 4 1 1 A 41 41 LYS N N 271 120.070 117.402 2.668 1
1 477 . 4 1 1 A 42 42 ALA H H 272 7.860 8.063 -0.203 1
1 478 . 4 1 1 A 42 42 ALA HA H 272 4.140 3.979 0.161 1
1 482 . 4 1 1 A 42 42 ALA CA C 272 54.670 54.787 -0.117 1
1 483 . 4 1 1 A 42 42 ALA CB C 272 17.950 18.713 -0.763 1
1 484 . 4 1 1 A 42 42 ALA N N 272 122.880 120.530 2.350 1
1 485 . 4 1 1 A 43 43 GLU H H 273 7.210 7.871 -0.661 1
1 486 . 4 1 1 A 43 43 GLU HA H 273 4.260 4.436 -0.176 1
1 491 . 4 1 1 A 43 43 GLU CA C 273 55.020 56.001 -0.981 1
1 492 . 4 1 1 A 43 43 GLU CB C 273 29.880 29.490 0.390 1
1 494 . 4 1 1 A 43 43 GLU N N 273 116.590 115.235 1.355 1
1 495 . 4 1 1 A 44 44 ALA H H 274 7.880 8.293 -0.413 1
1 496 . 4 1 1 A 44 44 ALA HA H 274 3.680 3.881 -0.201 1
1 500 . 4 1 1 A 44 44 ALA CA C 274 52.960 53.153 -0.193 1
1 501 . 4 1 1 A 44 44 ALA CB C 274 16.110 17.142 -1.032 1
1 502 . 4 1 1 A 44 44 ALA N N 274 118.420 118.759 -0.339 1
1 503 . 4 1 1 A 45 45 ILE H H 275 7.600 7.591 0.009 1
1 504 . 4 1 1 A 45 45 ILE HA H 275 3.870 4.548 -0.678 1
1 514 . 4 1 1 A 45 45 ILE CA C 275 61.150 60.455 0.695 1
1 515 . 4 1 1 A 45 45 ILE CB C 275 37.090 39.540 -2.450 1
1 519 . 4 1 1 A 45 45 ILE N N 275 120.370 118.744 1.626 1
1 520 . 4 1 1 A 46 46 HIS H H 276 8.350 8.748 -0.398 1
1 521 . 4 1 1 A 46 46 HIS HA H 276 4.600 4.899 -0.299 1
1 526 . 4 1 1 A 46 46 HIS CA C 276 56.900 55.713 1.187 1
1 527 . 4 1 1 A 46 46 HIS CB C 276 31.910 31.251 0.659 1
1 529 . 4 1 1 A 46 46 HIS N N 276 123.250 122.251 0.999 1
1 530 . 4 1 1 A 47 47 TYR H H 277 8.850 7.088 1.762 1
1 531 . 4 1 1 A 47 47 TYR HA H 277 5.100 4.499 0.601 1
1 538 . 4 1 1 A 47 47 TYR CA C 277 57.430 56.614 0.816 1
1 539 . 4 1 1 A 47 47 TYR CB C 277 40.680 39.836 0.844 1
1 544 . 4 1 1 A 47 47 TYR N N 277 119.700 118.061 1.639 1
1 545 . 4 1 1 A 48 48 ILE H H 278 9.380 8.331 1.049 1
1 546 . 4 1 1 A 48 48 ILE HA H 278 3.340 3.561 -0.221 1
1 554 . 4 1 1 A 48 48 ILE CA C 278 67.640 64.962 2.678 1
1 555 . 4 1 1 A 48 48 ILE CB C 278 36.310 37.570 -1.260 1
1 558 . 4 1 1 A 48 48 ILE N N 278 125.650 124.460 1.190 1
1 559 . 4 1 1 A 49 49 GLY H H 279 9.430 8.031 1.399 1
1 560 . 4 1 1 A 49 49 GLY HA2 H 279 2.370 2.126 0.244 1
1 561 . 4 1 1 A 49 49 GLY HA3 H 279 3.230 3.435 -0.205 1
1 562 . 4 1 1 A 49 49 GLY CA C 279 46.820 46.785 0.035 1
1 563 . 4 1 1 A 49 49 GLY N N 279 105.200 108.478 -3.278 1
1 564 . 4 1 1 A 50 50 ASP H H 280 7.050 7.448 -0.398 1
1 565 . 4 1 1 A 50 50 ASP HA H 280 4.360 4.110 0.250 1
1 568 . 4 1 1 A 50 50 ASP CA C 280 57.110 56.212 0.898 1
1 569 . 4 1 1 A 50 50 ASP CB C 280 42.620 40.462 2.158 1
1 570 . 4 1 1 A 50 50 ASP N N 280 116.360 120.784 -4.424 1
1 571 . 4 1 1 A 51 51 LEU H H 281 7.170 8.270 -1.100 1
1 572 . 4 1 1 A 51 51 LEU HA H 281 3.880 3.949 -0.069 1
1 582 . 4 1 1 A 51 51 LEU CA C 281 57.900 58.277 -0.377 1
1 583 . 4 1 1 A 51 51 LEU CB C 281 41.870 41.524 0.346 1
1 587 . 4 1 1 A 51 51 LEU N N 281 120.130 121.704 -1.574 1
1 588 . 4 1 1 A 52 52 VAL H H 282 7.820 7.533 0.287 1
1 589 . 4 1 1 A 52 52 VAL HA H 282 3.980 3.790 0.190 1
1 597 . 4 1 1 A 52 52 VAL CA C 282 64.000 65.460 -1.460 1
1 598 . 4 1 1 A 52 52 VAL CB C 282 30.400 31.131 -0.731 1
1 601 . 4 1 1 A 52 52 VAL N N 282 105.550 115.493 -9.943 1
1 602 . 4 1 1 A 53 53 GLN H H 283 6.550 7.723 -1.173 1
1 603 . 4 1 1 A 53 53 GLN HA H 283 4.680 4.045 0.635 1
1 610 . 4 1 1 A 53 53 GLN CA C 283 56.210 58.830 -2.620 1
1 611 . 4 1 1 A 53 53 GLN CB C 283 31.710 28.596 3.114 1
1 613 . 4 1 1 A 53 53 GLN N N 283 114.060 121.648 -7.588 1
1 615 . 4 1 1 A 54 54 ARG H H 284 7.690 7.579 0.111 1
1 616 . 4 1 1 A 54 54 ARG HA H 284 4.520 4.773 -0.253 1
1 624 . 4 1 1 A 54 54 ARG CA C 284 54.600 54.417 0.183 1
1 625 . 4 1 1 A 54 54 ARG CB C 284 30.750 32.841 -2.091 1
1 628 . 4 1 1 A 54 54 ARG N N 284 119.810 118.259 1.551 1
1 629 . 4 1 1 A 55 55 THR H H 285 8.110 8.693 -0.583 1
1 630 . 4 1 1 A 55 55 THR HA H 285 4.430 4.326 0.104 1
1 635 . 4 1 1 A 55 55 THR CA C 285 59.640 63.501 -3.861 1
1 636 . 4 1 1 A 55 55 THR CB C 285 71.310 69.261 2.049 1
1 638 . 4 1 1 A 55 55 THR N N 285 108.450 119.342 -10.892 1
1 639 . 4 1 1 A 56 56 GLU H H 286 8.910 8.945 -0.035 1
1 640 . 4 1 1 A 56 56 GLU HA H 286 3.660 3.942 -0.282 1
1 645 . 4 1 1 A 56 56 GLU CA C 286 60.650 59.804 0.846 1
1 646 . 4 1 1 A 56 56 GLU CB C 286 29.400 29.112 0.288 1
1 648 . 4 1 1 A 56 56 GLU N N 286 120.600 125.871 -5.271 1
1 649 . 4 1 1 A 57 57 VAL H H 287 7.600 8.123 -0.523 1
1 650 . 4 1 1 A 57 57 VAL HA H 287 3.620 3.517 0.103 1
1 658 . 4 1 1 A 57 57 VAL CA C 287 66.020 67.135 -1.115 1
1 659 . 4 1 1 A 57 57 VAL CB C 287 31.720 31.542 0.178 1
1 662 . 4 1 1 A 57 57 VAL N N 287 114.050 119.941 -5.891 1
1 663 . 4 1 1 A 58 58 GLU H H 288 7.350 8.179 -0.829 1
1 664 . 4 1 1 A 58 58 GLU HA H 288 3.830 4.075 -0.245 1
1 669 . 4 1 1 A 58 58 GLU CA C 288 59.250 59.612 -0.362 1
1 670 . 4 1 1 A 58 58 GLU CB C 288 30.030 29.148 0.882 1
1 672 . 4 1 1 A 58 58 GLU N N 288 117.610 119.229 -1.619 1
1 673 . 4 1 1 A 59 59 LEU H H 289 7.850 7.828 0.022 1
1 674 . 4 1 1 A 59 59 LEU HA H 289 4.150 4.095 0.055 1
1 683 . 4 1 1 A 59 59 LEU CA C 289 57.340 57.256 0.084 1
1 684 . 4 1 1 A 59 59 LEU CB C 289 41.170 41.258 -0.088 1
1 687 . 4 1 1 A 59 59 LEU N N 289 120.050 120.727 -0.677 1
1 688 . 4 1 1 A 60 60 LEU H H 290 7.670 8.041 -0.371 1
1 689 . 4 1 1 A 60 60 LEU HA H 290 4.540 4.060 0.480 1
1 696 . 4 1 1 A 60 60 LEU CA C 290 55.090 58.081 -2.991 1
1 697 . 4 1 1 A 60 60 LEU CB C 290 42.320 41.102 1.218 1
1 701 . 4 1 1 A 60 60 LEU N N 290 114.980 119.990 -5.010 1
1 702 . 4 1 1 A 61 61 LYS H H 291 7.440 7.358 0.082 1
1 703 . 4 1 1 A 61 61 LYS HA H 291 4.280 4.293 -0.013 1
1 710 . 4 1 1 A 61 61 LYS CA C 291 56.860 57.479 -0.619 1
1 711 . 4 1 1 A 61 61 LYS CB C 291 31.900 32.746 -0.846 1
1 714 . 4 1 1 A 61 61 LYS N N 291 118.120 117.695 0.425 1
1 715 . 4 1 1 A 62 62 THR H H 292 7.310 7.346 -0.036 1
1 716 . 4 1 1 A 62 62 THR HA H 292 5.220 4.382 0.838 1
1 721 . 4 1 1 A 62 62 THR CA C 292 55.830 60.626 -4.796 1
1 722 . 4 1 1 A 62 62 THR CB C 292 69.970 68.918 1.052 1
1 724 . 4 1 1 A 62 62 THR N N 292 111.890 115.363 -3.473 1
1 725 . 4 1 1 A 63 63 PRO HA H 293 4.570 4.450 0.120 1
1 730 . 4 1 1 A 63 63 PRO CA C 293 63.710 64.402 -0.692 1
1 731 . 4 1 1 A 63 63 PRO CB C 293 32.380 31.827 0.553 1
1 733 . 4 1 1 A 64 64 ASN H H 294 8.050 8.840 -0.790 1
1 734 . 4 1 1 A 64 64 ASN HA H 294 4.490 4.415 0.075 1
1 739 . 4 1 1 A 64 64 ASN CA C 294 55.630 55.650 -0.020 1
1 740 . 4 1 1 A 64 64 ASN CB C 294 38.730 38.288 0.442 1
1 741 . 4 1 1 A 64 64 ASN N N 294 117.120 116.883 0.237 1
1 743 . 4 1 1 A 65 65 LEU H H 295 7.550 7.128 0.422 1
1 744 . 4 1 1 A 65 65 LEU HA H 295 4.640 4.808 -0.168 1
1 754 . 4 1 1 A 65 65 LEU CA C 295 54.310 53.046 1.264 1
1 755 . 4 1 1 A 65 65 LEU CB C 295 43.640 44.040 -0.400 1
1 758 . 4 1 1 A 65 65 LEU N N 295 119.930 115.871 4.059 1
1 759 . 4 1 1 A 66 66 GLY H H 296 7.850 8.631 -0.781 1
1 760 . 4 1 1 A 66 66 GLY HA2 H 296 3.810 4.081 -0.271 1
1 761 . 4 1 1 A 66 66 GLY HA3 H 296 4.110 4.081 0.029 1
1 762 . 4 1 1 A 66 66 GLY CA C 296 43.570 44.560 -0.990 1
1 763 . 4 1 1 A 66 66 GLY N N 296 108.840 107.403 1.437 1
1 764 . 4 1 1 A 67 67 LYS H H 297 8.820 8.616 0.204 1
1 765 . 4 1 1 A 67 67 LYS HA H 297 3.980 3.868 0.112 1
1 774 . 4 1 1 A 67 67 LYS CA C 297 60.100 59.544 0.556 1
1 775 . 4 1 1 A 67 67 LYS CB C 297 32.100 32.321 -0.221 1
1 779 . 4 1 1 A 67 67 LYS N N 297 120.130 118.315 1.815 1
1 780 . 4 1 1 A 68 68 LYS H H 298 8.850 7.957 0.893 1
1 781 . 4 1 1 A 68 68 LYS HA H 298 4.060 4.027 0.033 1
1 790 . 4 1 1 A 68 68 LYS CA C 298 60.600 59.136 1.464 1
1 791 . 4 1 1 A 68 68 LYS CB C 298 31.920 31.990 -0.070 1
1 795 . 4 1 1 A 68 68 LYS N N 298 119.580 120.006 -0.426 1
1 796 . 4 1 1 A 69 69 SER H H 299 8.100 8.034 0.066 1
1 797 . 4 1 1 A 69 69 SER HA H 299 4.370 4.055 0.315 1
1 800 . 4 1 1 A 69 69 SER CA C 299 61.980 62.428 -0.448 1
1 801 . 4 1 1 A 69 69 SER CB C 299 63.000 62.830 0.170 1
1 802 . 4 1 1 A 69 69 SER N N 299 116.360 116.996 -0.636 1
1 803 . 4 1 1 A 70 70 LEU H H 300 8.240 7.702 0.538 1
1 804 . 4 1 1 A 70 70 LEU HA H 300 3.970 4.051 -0.081 1
1 814 . 4 1 1 A 70 70 LEU CA C 300 57.610 57.879 -0.269 1
1 815 . 4 1 1 A 70 70 LEU CB C 300 41.060 41.802 -0.742 1
1 819 . 4 1 1 A 70 70 LEU N N 300 123.330 122.917 0.413 1
1 820 . 4 1 1 A 71 71 THR H H 301 8.550 7.791 0.759 1
1 821 . 4 1 1 A 71 71 THR HA H 301 3.690 3.794 -0.104 1
1 826 . 4 1 1 A 71 71 THR CA C 301 67.170 66.247 0.923 1
1 827 . 4 1 1 A 71 71 THR CB C 301 68.810 68.460 0.350 1
1 829 . 4 1 1 A 71 71 THR N N 301 116.520 114.803 1.717 1
1 830 . 4 1 1 A 72 72 GLU H H 302 7.520 7.792 -0.272 1
1 831 . 4 1 1 A 72 72 GLU HA H 302 4.070 3.972 0.098 1
1 836 . 4 1 1 A 72 72 GLU CA C 302 59.470 59.417 0.053 1
1 837 . 4 1 1 A 72 72 GLU CB C 302 29.090 29.506 -0.416 1
1 839 . 4 1 1 A 72 72 GLU N N 302 121.510 120.733 0.777 1
1 840 . 4 1 1 A 73 73 ILE H H 303 8.290 8.207 0.083 1
1 841 . 4 1 1 A 73 73 ILE HA H 303 3.380 3.617 -0.237 1
1 849 . 4 1 1 A 73 73 ILE CA C 303 66.010 65.170 0.840 1
1 850 . 4 1 1 A 73 73 ILE CB C 303 38.680 38.204 0.476 1
1 853 . 4 1 1 A 73 73 ILE N N 303 118.510 120.237 -1.727 1
1 854 . 4 1 1 A 74 74 LYS H H 304 8.550 8.782 -0.232 1
1 855 . 4 1 1 A 74 74 LYS HA H 304 3.680 3.858 -0.178 1
1 864 . 4 1 1 A 74 74 LYS CA C 304 61.320 59.830 1.490 1
1 865 . 4 1 1 A 74 74 LYS CB C 304 32.060 32.234 -0.174 1
1 868 . 4 1 1 A 74 74 LYS N N 304 118.220 120.689 -2.469 1
1 869 . 4 1 1 A 75 75 ASP H H 305 8.450 8.196 0.254 1
1 870 . 4 1 1 A 75 75 ASP HA H 305 4.440 4.322 0.118 1
1 873 . 4 1 1 A 75 75 ASP CA C 305 57.690 57.660 0.030 1
1 874 . 4 1 1 A 75 75 ASP CB C 305 40.220 41.647 -1.427 1
1 875 . 4 1 1 A 75 75 ASP N N 305 121.790 119.652 2.138 1
1 876 . 4 1 1 A 76 76 VAL H H 306 8.680 7.810 0.870 1
1 877 . 4 1 1 A 76 76 VAL HA H 306 3.890 3.647 0.243 1
1 885 . 4 1 1 A 76 76 VAL CA C 306 66.020 66.124 -0.104 1
1 886 . 4 1 1 A 76 76 VAL CB C 306 31.250 31.503 -0.253 1
1 889 . 4 1 1 A 76 76 VAL N N 306 121.150 118.825 2.325 1
1 890 . 4 1 1 A 77 77 LEU H H 307 8.470 8.261 0.209 1
1 891 . 4 1 1 A 77 77 LEU HA H 307 3.810 4.125 -0.315 1
1 901 . 4 1 1 A 77 77 LEU CA C 307 58.330 57.116 1.214 1
1 902 . 4 1 1 A 77 77 LEU CB C 307 41.250 40.887 0.363 1
1 906 . 4 1 1 A 77 77 LEU N N 307 120.830 119.978 0.852 1
1 907 . 4 1 1 A 78 78 ALA H H 308 8.280 8.241 0.039 1
1 908 . 4 1 1 A 78 78 ALA HA H 308 4.320 4.102 0.218 1
1 912 . 4 1 1 A 78 78 ALA CA C 308 55.420 55.026 0.394 1
1 913 . 4 1 1 A 78 78 ALA CB C 308 17.750 18.172 -0.422 1
1 914 . 4 1 1 A 78 78 ALA N N 308 122.530 123.262 -0.732 1
1 915 . 4 1 1 A 79 79 SER H H 309 7.900 7.697 0.203 1
1 916 . 4 1 1 A 79 79 SER HA H 309 4.340 4.348 -0.008 1
1 919 . 4 1 1 A 79 79 SER CA C 309 61.350 58.805 2.545 1
1 920 . 4 1 1 A 79 79 SER CB C 309 63.280 64.020 -0.740 1
1 921 . 4 1 1 A 79 79 SER N N 309 115.600 111.501 4.099 1
1 922 . 4 1 1 A 80 80 ARG H H 310 7.450 8.329 -0.879 1
1 923 . 4 1 1 A 80 80 ARG HA H 310 4.550 4.016 0.534 1
1 931 . 4 1 1 A 80 80 ARG CA C 310 54.200 57.368 -3.168 1
1 932 . 4 1 1 A 80 80 ARG CB C 310 30.680 27.218 3.462 1
1 935 . 4 1 1 A 80 80 ARG N N 310 119.360 115.882 3.478 1
1 936 . 4 1 1 A 81 81 GLY H H 311 7.940 7.898 0.042 1
1 937 . 4 1 1 A 81 81 GLY HA2 H 311 3.840 3.872 -0.032 1
1 938 . 4 1 1 A 81 81 GLY HA3 H 311 4.070 3.890 0.180 1
1 939 . 4 1 1 A 81 81 GLY CA C 311 46.060 46.692 -0.632 1
1 940 . 4 1 1 A 81 81 GLY N N 311 108.130 107.108 1.022 1
1 941 . 4 1 1 A 82 82 LEU H H 312 7.920 7.420 0.500 1
1 942 . 4 1 1 A 82 82 LEU HA H 312 4.680 4.795 -0.115 1
1 952 . 4 1 1 A 82 82 LEU CA C 312 53.070 52.679 0.391 1
1 953 . 4 1 1 A 82 82 LEU CB C 312 45.790 45.440 0.350 1
1 957 . 4 1 1 A 82 82 LEU N N 312 119.290 115.031 4.259 1
1 958 . 4 1 1 A 83 83 SER H H 313 7.530 8.822 -1.292 1
1 959 . 4 1 1 A 83 83 SER HA H 313 4.450 4.073 0.377 1
1 962 . 4 1 1 A 83 83 SER CA C 313 57.190 58.851 -1.661 1
1 963 . 4 1 1 A 83 83 SER CB C 313 66.080 61.665 4.415 1
1 964 . 4 1 1 A 83 83 SER N N 313 113.120 114.498 -1.378 1
1 965 . 4 1 1 A 84 84 LEU H H 314 8.340 8.388 -0.048 1
1 966 . 4 1 1 A 84 84 LEU HA H 314 4.620 4.410 0.210 1
1 976 . 4 1 1 A 84 84 LEU CA C 314 54.720 54.785 -0.065 1
1 977 . 4 1 1 A 84 84 LEU CB C 314 41.620 42.179 -0.559 1
1 981 . 4 1 1 A 84 84 LEU N N 314 115.930 120.118 -4.188 1
1 982 . 4 1 1 A 85 85 GLY H H 315 8.270 7.902 0.368 1
1 983 . 4 1 1 A 85 85 GLY HA2 H 315 3.320 3.935 -0.615 1
1 984 . 4 1 1 A 85 85 GLY HA3 H 315 3.850 3.942 -0.092 1
1 985 . 4 1 1 A 85 85 GLY CA C 315 46.560 46.647 -0.087 1
1 986 . 4 1 1 A 85 85 GLY N N 315 111.010 108.284 2.726 1
1 987 . 4 1 1 A 86 86 MET H H 316 8.650 7.866 0.784 1
1 988 . 4 1 1 A 86 86 MET HA H 316 3.990 5.080 -1.090 1
1 996 . 4 1 1 A 86 86 MET CA C 316 56.730 53.090 3.640 1
1 997 . 4 1 1 A 86 86 MET CB C 316 33.600 35.402 -1.802 1
1 1000 . 4 1 1 A 86 86 MET N N 316 120.570 116.831 3.739 1
1 1001 . 4 1 1 A 87 87 ARG H H 317 8.360 8.925 -0.565 1
1 1002 . 4 1 1 A 87 87 ARG HA H 317 4.450 5.222 -0.772 1
1 1010 . 4 1 1 A 87 87 ARG CA C 317 55.310 54.631 0.679 1
1 1011 . 4 1 1 A 87 87 ARG CB C 317 30.490 33.392 -2.902 1
1 1014 . 4 1 1 A 87 87 ARG N N 317 122.290 122.084 0.206 1
1 1015 . 4 1 1 A 88 88 LEU H H 318 8.400 8.861 -0.461 1
1 1016 . 4 1 1 A 88 88 LEU HA H 318 4.670 4.919 -0.249 1
1 1026 . 4 1 1 A 88 88 LEU CA C 318 53.110 53.387 -0.277 1
1 1027 . 4 1 1 A 88 88 LEU CB C 318 43.600 43.688 -0.088 1
1 1031 . 4 1 1 A 88 88 LEU N N 318 126.420 127.307 -0.887 1
1 1032 . 4 1 1 A 89 89 GLU H H 319 8.780 9.168 -0.388 1
1 1033 . 4 1 1 A 89 89 GLU HA H 319 4.340 3.978 0.362 1
1 1038 . 4 1 1 A 89 89 GLU CA C 319 56.490 59.583 -3.093 1
1 1039 . 4 1 1 A 89 89 GLU CB C 319 30.470 29.529 0.941 1
1 1041 . 4 1 1 A 89 89 GLU N N 319 123.070 124.676 -1.606 1
1 1042 . 4 1 1 A 90 90 ASN H H 320 8.900 8.627 0.273 1
1 1043 . 4 1 1 A 90 90 ASN HA H 320 4.410 5.140 -0.730 1
1 1048 . 4 1 1 A 90 90 ASN CA C 320 54.120 55.147 -1.027 1
1 1049 . 4 1 1 A 90 90 ASN CB C 320 37.640 41.403 -3.763 1
1 1050 . 4 1 1 A 90 90 ASN N N 320 116.540 116.147 0.393 1
1 1052 . 4 1 1 A 91 91 TRP H H 321 7.990 7.479 0.511 1
1 1053 . 4 1 1 A 91 91 TRP HA H 321 4.330 4.795 -0.465 1
1 1062 . 4 1 1 A 91 91 TRP CA C 321 54.590 58.503 -3.913 1
1 1063 . 4 1 1 A 91 91 TRP CB C 321 31.280 31.133 0.147 1
1 1069 . 4 1 1 A 91 91 TRP N N 321 119.230 118.330 0.900 1
1 1071 . 4 1 1 A 92 92 PRO HA H 322 4.800 4.026 0.774 1
1 1077 . 4 1 1 A 93 93 PRO HA H 323 4.450 4.560 -0.110 1
1 1084 . 4 1 1 A 93 93 PRO CA C 323 61.970 62.618 -0.648 1
1 1085 . 4 1 1 A 93 93 PRO CB C 323 32.830 32.526 0.304 1
1 1088 . 4 1 1 A 94 94 ALA H H 324 8.460 8.727 -0.267 1
1 1089 . 4 1 1 A 94 94 ALA HA H 324 4.000 3.979 0.021 1
1 1093 . 4 1 1 A 94 94 ALA CA C 324 53.790 54.589 -0.799 1
1 1094 . 4 1 1 A 94 94 ALA CB C 324 18.640 18.146 0.494 1
1 1095 . 4 1 1 A 94 94 ALA N N 324 124.010 126.463 -2.453 1
1 1096 . 4 1 1 A 95 95 SER H H 325 7.950 7.825 0.125 1
1 1097 . 4 1 1 A 95 95 SER HA H 325 4.210 4.115 0.095 1
1 1100 . 4 1 1 A 95 95 SER CA C 325 58.970 61.392 -2.422 1
1 1101 . 4 1 1 A 95 95 SER CB C 325 63.040 62.938 0.102 1
1 1102 . 4 1 1 A 95 95 SER N N 325 111.520 113.047 -1.527 1
1 1103 . 4 1 1 A 96 96 ILE H H 326 7.480 7.227 0.253 1
1 1104 . 4 1 1 A 96 96 ILE HA H 326 4.170 4.317 -0.147 1
1 1114 . 4 1 1 A 96 96 ILE CA C 326 61.300 60.747 0.553 1
1 1115 . 4 1 1 A 96 96 ILE CB C 326 38.530 37.749 0.781 1
1 1119 . 4 1 1 A 96 96 ILE N N 326 119.650 112.710 6.940 1
1 1120 . 4 1 1 A 97 97 ALA H H 327 7.860 6.984 0.876 1
1 1121 . 4 1 1 A 97 97 ALA HA H 327 4.230 4.158 0.072 1
1 1125 . 4 1 1 A 97 97 ALA CA C 327 52.570 52.391 0.179 1
1 1126 . 4 1 1 A 97 97 ALA CB C 327 19.590 19.305 0.285 1
1 1127 . 4 1 1 A 97 97 ALA N N 327 126.480 127.342 -0.862 1
1 1128 . 4 1 1 A 98 98 ASP H H 328 8.250 8.894 -0.644 1
1 1129 . 4 1 1 A 98 98 ASP HA H 328 4.540 4.540 0.000 1
1 1132 . 4 1 1 A 98 98 ASP CA C 328 54.150 54.599 -0.449 1
1 1133 . 4 1 1 A 98 98 ASP CB C 328 41.120 39.503 1.617 1
1 1134 . 4 1 1 A 98 98 ASP N N 328 120.130 121.065 -0.935 1
1 1150 . 4 2 2 B 6 6 ASP H H 427 8.160 8.460 -0.300 1
1 1151 . 4 2 2 B 6 6 ASP HA H 427 4.630 4.234 0.396 1
1 1154 . 4 2 2 B 6 6 ASP CA C 427 54.410 56.872 -2.462 1
1 1155 . 4 2 2 B 6 6 ASP CB C 427 41.250 40.447 0.803 1
1 1156 . 4 2 2 B 6 6 ASP N N 427 120.160 118.513 1.647 1
1 1157 . 4 2 2 B 7 7 ASN H H 428 8.350 7.997 0.353 1
1 1158 . 4 2 2 B 7 7 ASN HA H 428 4.550 4.260 0.290 1
1 1163 . 4 2 2 B 7 7 ASN CA C 428 53.310 54.304 -0.994 1
1 1164 . 4 2 2 B 7 7 ASN CB C 428 38.850 36.903 1.947 1
1 1165 . 4 2 2 B 7 7 ASN N N 428 118.440 114.470 3.970 1
1 1167 . 4 2 2 B 8 8 LYS H H 429 8.030 7.833 0.197 1
1 1172 . 4 2 2 B 8 8 LYS CB C 429 33.280 33.186 0.094 1
1 1174 . 4 2 2 B 8 8 LYS N N 429 120.260 119.886 0.374 1
1 1175 . 4 2 2 B 9 9 PRO HA H 430 4.420 4.529 -0.109 1
1 1182 . 4 2 2 B 9 9 PRO CA C 430 62.280 62.660 -0.380 1
1 1183 . 4 2 2 B 9 9 PRO CB C 430 31.920 32.415 -0.495 1
1 1186 . 4 2 2 B 10 10 ALA H H 431 8.930 9.323 -0.393 1
1 1187 . 4 2 2 B 10 10 ALA HA H 431 4.350 4.520 -0.170 1
1 1191 . 4 2 2 B 10 10 ALA CA C 431 51.070 52.042 -0.972 1
1 1192 . 4 2 2 B 10 10 ALA CB C 431 20.920 19.495 1.425 1
1 1193 . 4 2 2 B 10 10 ALA N N 431 125.000 124.887 0.113 1
1 1194 . 4 2 2 B 11 11 ASP H H 432 8.530 9.268 -0.738 1
1 1195 . 4 2 2 B 11 11 ASP HA H 432 4.220 4.263 -0.043 1
1 1198 . 4 2 2 B 11 11 ASP CA C 432 57.520 57.661 -0.141 1
1 1199 . 4 2 2 B 11 11 ASP CB C 432 40.470 40.314 0.156 1
1 1200 . 4 2 2 B 11 11 ASP N N 432 119.610 122.187 -2.577 1
1 1201 . 4 2 2 B 12 12 ASP H H 433 8.340 8.016 0.324 1
1 1202 . 4 2 2 B 12 12 ASP HA H 433 4.160 4.419 -0.259 1
1 1205 . 4 2 2 B 12 12 ASP CA C 433 56.090 57.380 -1.290 1
1 1206 . 4 2 2 B 12 12 ASP CB C 433 38.960 40.988 -2.028 1
1 1207 . 4 2 2 B 12 12 ASP N N 433 116.330 119.717 -3.387 1
1 1208 . 4 2 2 B 13 13 LEU H H 434 7.360 7.903 -0.543 1
1 1209 . 4 2 2 B 13 13 LEU HA H 434 4.050 4.090 -0.040 1
1 1219 . 4 2 2 B 13 13 LEU CA C 434 57.340 57.781 -0.441 1
1 1220 . 4 2 2 B 13 13 LEU CB C 434 42.960 41.917 1.043 1
1 1224 . 4 2 2 B 13 13 LEU N N 434 123.440 121.363 2.077 1
1 1225 . 4 2 2 B 14 14 LEU H H 435 7.670 8.048 -0.378 1
1 1226 . 4 2 2 B 14 14 LEU HA H 435 3.710 4.083 -0.373 1
1 1236 . 4 2 2 B 14 14 LEU CA C 435 57.170 57.631 -0.461 1
1 1237 . 4 2 2 B 14 14 LEU CB C 435 42.590 41.449 1.141 1
1 1241 . 4 2 2 B 14 14 LEU N N 435 115.170 119.652 -4.482 1
1 1242 . 4 2 2 B 15 15 ASN H H 436 7.490 8.058 -0.568 1
1 1243 . 4 2 2 B 15 15 ASN HA H 436 4.640 4.822 -0.182 1
1 1248 . 4 2 2 B 15 15 ASN CA C 436 52.920 53.719 -0.799 1
1 1249 . 4 2 2 B 15 15 ASN CB C 436 39.350 38.929 0.421 1
1 1250 . 4 2 2 B 15 15 ASN N N 436 112.280 115.006 -2.726 1
1 1252 . 4 2 2 B 16 16 LEU H H 437 7.300 7.083 0.217 1
1 1253 . 4 2 2 B 16 16 LEU HA H 437 4.100 4.275 -0.175 1
1 1263 . 4 2 2 B 16 16 LEU CA C 437 55.310 55.203 0.107 1
1 1264 . 4 2 2 B 16 16 LEU CB C 437 41.800 42.964 -1.164 1
1 1268 . 4 2 2 B 16 16 LEU N N 437 125.180 122.979 2.201 1
1 1269 . 4 2 2 B 17 17 GLU H H 438 8.590 8.699 -0.109 1
1 1270 . 4 2 2 B 17 17 GLU HA H 438 3.920 4.267 -0.347 1
1 1275 . 4 2 2 B 17 17 GLU CA C 438 58.440 56.890 1.550 1
1 1276 . 4 2 2 B 17 17 GLU CB C 438 29.180 29.866 -0.686 1
1 1278 . 4 2 2 B 17 17 GLU N N 438 129.850 123.509 6.341 1
1 1279 . 4 2 2 B 18 18 GLY H H 439 8.580 8.880 -0.300 1
1 1280 . 4 2 2 B 18 18 GLY HA2 H 439 3.570 3.927 -0.357 1
1 1281 . 4 2 2 B 18 18 GLY HA3 H 439 4.220 3.930 0.290 1
1 1282 . 4 2 2 B 18 18 GLY CA C 439 44.710 45.442 -0.732 1
1 1283 . 4 2 2 B 18 18 GLY N N 439 112.250 112.158 0.092 1
1 1284 . 4 2 2 B 19 19 VAL H H 440 7.900 7.718 0.182 1
1 1285 . 4 2 2 B 19 19 VAL HA H 440 3.950 4.409 -0.459 1
1 1293 . 4 2 2 B 19 19 VAL CA C 440 62.820 60.915 1.905 1
1 1294 . 4 2 2 B 19 19 VAL CB C 440 31.470 34.363 -2.893 1
1 1297 . 4 2 2 B 19 19 VAL N N 440 121.910 121.568 0.342 1
1 1298 . 4 2 2 B 20 20 ASP H H 441 7.390 8.742 -1.352 1
1 1299 . 4 2 2 B 20 20 ASP HA H 441 4.820 4.669 0.151 1
1 1302 . 4 2 2 B 20 20 ASP CA C 441 51.920 53.701 -1.781 1
1 1303 . 4 2 2 B 20 20 ASP CB C 441 42.090 41.376 0.714 1
1 1304 . 4 2 2 B 20 20 ASP N N 441 124.850 126.504 -1.654 1
1 1305 . 4 2 2 B 21 21 ARG H H 442 8.630 8.619 0.011 1
1 1306 . 4 2 2 B 21 21 ARG HA H 442 3.810 3.507 0.303 1
1 1313 . 4 2 2 B 21 21 ARG CA C 442 60.710 59.500 1.210 1
1 1314 . 4 2 2 B 21 21 ARG CB C 442 30.020 29.840 0.180 1
1 1317 . 4 2 2 B 21 21 ARG N N 442 120.890 122.566 -1.676 1
1 1318 . 4 2 2 B 22 22 ASP H H 443 8.140 8.026 0.114 1
1 1319 . 4 2 2 B 22 22 ASP HA H 443 4.420 4.398 0.022 1
1 1322 . 4 2 2 B 22 22 ASP CA C 443 57.680 57.163 0.517 1
1 1323 . 4 2 2 B 22 22 ASP CB C 443 40.880 40.562 0.318 1
1 1324 . 4 2 2 B 22 22 ASP N N 443 116.750 120.051 -3.301 1
1 1325 . 4 2 2 B 23 23 LEU H H 444 8.170 7.833 0.337 1
1 1326 . 4 2 2 B 23 23 LEU HA H 444 4.130 4.160 -0.030 1
1 1336 . 4 2 2 B 23 23 LEU CA C 444 57.770 57.864 -0.094 1
1 1337 . 4 2 2 B 23 23 LEU CB C 444 41.230 41.206 0.024 1
1 1341 . 4 2 2 B 23 23 LEU N N 444 122.130 121.974 0.156 1
1 1342 . 4 2 2 B 24 24 ALA H H 445 8.630 8.387 0.243 1
1 1343 . 4 2 2 B 24 24 ALA HA H 445 3.790 4.010 -0.220 1
1 1347 . 4 2 2 B 24 24 ALA CA C 445 55.810 54.201 1.609 1
1 1348 . 4 2 2 B 24 24 ALA CB C 445 18.060 18.080 -0.020 1
1 1349 . 4 2 2 B 24 24 ALA N N 445 120.890 120.811 0.079 1
1 1350 . 4 2 2 B 25 25 PHE H H 446 8.160 7.261 0.899 1
1 1351 . 4 2 2 B 25 25 PHE HA H 446 4.080 4.326 -0.246 1
1 1358 . 4 2 2 B 25 25 PHE CA C 446 62.670 61.728 0.942 1
1 1359 . 4 2 2 B 25 25 PHE CB C 446 39.440 38.585 0.855 1
1 1364 . 4 2 2 B 25 25 PHE N N 446 115.360 116.281 -0.921 1
1 1365 . 4 2 2 B 26 26 LYS H H 447 8.040 7.622 0.418 1
1 1366 . 4 2 2 B 26 26 LYS HA H 447 4.110 4.012 0.098 1
1 1375 . 4 2 2 B 26 26 LYS CA C 447 60.140 59.297 0.843 1
1 1376 . 4 2 2 B 26 26 LYS CB C 447 32.880 32.318 0.562 1
1 1380 . 4 2 2 B 26 26 LYS N N 447 123.110 118.526 4.584 1
1 1381 . 4 2 2 B 27 27 LEU H H 448 8.630 7.926 0.704 1
1 1382 . 4 2 2 B 27 27 LEU HA H 448 3.840 4.080 -0.240 1
1 1392 . 4 2 2 B 27 27 LEU CA C 448 58.210 57.564 0.646 1
1 1393 . 4 2 2 B 27 27 LEU CB C 448 39.760 41.349 -1.589 1
1 1396 . 4 2 2 B 27 27 LEU N N 448 120.890 121.376 -0.486 1
1 1397 . 4 2 2 B 28 28 ALA H H 449 8.200 8.715 -0.515 1
1 1398 . 4 2 2 B 28 28 ALA HA H 449 3.760 4.575 -0.815 1
1 1402 . 4 2 2 B 28 28 ALA CA C 449 54.750 55.172 -0.422 1
1 1403 . 4 2 2 B 28 28 ALA CB C 449 18.050 18.170 -0.120 1
1 1404 . 4 2 2 B 28 28 ALA N N 449 123.710 120.881 2.829 1
1 1405 . 4 2 2 B 29 29 ALA H H 450 7.780 8.012 -0.232 1
1 1406 . 4 2 2 B 29 29 ALA HA H 450 4.170 4.094 0.076 1
1 1410 . 4 2 2 B 29 29 ALA CA C 450 54.430 54.577 -0.147 1
1 1411 . 4 2 2 B 29 29 ALA CB C 450 18.040 18.439 -0.399 1
1 1412 . 4 2 2 B 29 29 ALA N N 450 121.020 119.471 1.549 1
1 1413 . 4 2 2 B 30 30 ARG H H 451 7.390 7.550 -0.160 1
1 1414 . 4 2 2 B 30 30 ARG HA H 451 4.540 4.419 0.121 1
1 1421 . 4 2 2 B 30 30 ARG CA C 451 54.510 55.721 -1.211 1
1 1422 . 4 2 2 B 30 30 ARG CB C 451 29.950 29.722 0.228 1
1 1425 . 4 2 2 B 30 30 ARG N N 451 115.480 116.637 -1.157 1
1 1426 . 4 2 2 B 31 31 GLY H H 452 7.950 7.989 -0.039 1
1 1427 . 4 2 2 B 31 31 GLY HA2 H 452 3.550 3.984 -0.434 1
1 1428 . 4 2 2 B 31 31 GLY HA3 H 452 4.200 3.985 0.215 1
1 1429 . 4 2 2 B 31 31 GLY CA C 452 45.380 45.397 -0.017 1
1 1430 . 4 2 2 B 31 31 GLY N N 452 107.740 107.923 -0.183 1
1 1431 . 4 2 2 B 32 32 VAL H H 453 7.990 7.630 0.360 1
1 1432 . 4 2 2 B 32 32 VAL HA H 453 3.930 3.938 -0.008 1
1 1440 . 4 2 2 B 32 32 VAL CA C 453 61.420 62.871 -1.451 1
1 1441 . 4 2 2 B 32 32 VAL CB C 453 29.860 31.781 -1.921 1
1 1444 . 4 2 2 B 32 32 VAL N N 453 125.560 120.631 4.929 1
1 1445 . 4 2 2 B 33 33 CYS H H 454 8.460 8.787 -0.327 1
1 1446 . 4 2 2 B 33 33 CYS HA H 454 4.310 4.818 -0.508 1
1 1449 . 4 2 2 B 33 33 CYS CA C 454 60.260 59.828 0.432 1
1 1450 . 4 2 2 B 33 33 CYS CB C 454 30.330 30.607 -0.277 1
1 1451 . 4 2 2 B 33 33 CYS N N 454 119.460 125.081 -5.621 1
1 1452 . 4 2 2 B 34 34 THR H H 455 8.080 8.142 -0.062 1
1 1453 . 4 2 2 B 34 34 THR HA H 455 4.840 4.620 0.220 1
1 1458 . 4 2 2 B 34 34 THR CA C 455 58.650 61.492 -2.842 1
1 1459 . 4 2 2 B 34 34 THR CB C 455 72.680 70.751 1.929 1
1 1461 . 4 2 2 B 34 34 THR N N 455 108.420 114.838 -6.418 1
1 1462 . 4 2 2 B 35 35 LEU H H 456 8.580 8.776 -0.196 1
1 1463 . 4 2 2 B 35 35 LEU HA H 456 3.790 3.989 -0.199 1
1 1473 . 4 2 2 B 35 35 LEU CA C 456 57.980 58.717 -0.737 1
1 1474 . 4 2 2 B 35 35 LEU CB C 456 42.220 41.549 0.671 1
1 1477 . 4 2 2 B 35 35 LEU N N 456 120.370 128.320 -7.950 1
1 1478 . 4 2 2 B 36 36 GLU H H 457 8.390 8.177 0.213 1
1 1479 . 4 2 2 B 36 36 GLU HA H 457 3.820 3.957 -0.137 1
1 1484 . 4 2 2 B 36 36 GLU CA C 457 59.640 59.842 -0.202 1
1 1485 . 4 2 2 B 36 36 GLU CB C 457 28.780 29.236 -0.456 1
1 1487 . 4 2 2 B 36 36 GLU N N 457 119.450 118.711 0.739 1
1 1488 . 4 2 2 B 37 37 ASP H H 458 7.750 7.978 -0.228 1
1 1489 . 4 2 2 B 37 37 ASP HA H 458 4.140 4.339 -0.199 1
1 1492 . 4 2 2 B 37 37 ASP CA C 458 57.150 57.300 -0.150 1
1 1493 . 4 2 2 B 37 37 ASP CB C 458 42.280 40.530 1.750 1
1 1494 . 4 2 2 B 37 37 ASP N N 458 117.430 119.871 -2.441 1
1 1495 . 4 2 2 B 38 38 LEU H H 459 7.700 7.917 -0.217 1
1 1496 . 4 2 2 B 38 38 LEU HA H 459 3.790 4.102 -0.312 1
1 1506 . 4 2 2 B 38 38 LEU CA C 459 58.080 58.127 -0.047 1
1 1507 . 4 2 2 B 38 38 LEU CB C 459 41.130 41.459 -0.329 1
1 1511 . 4 2 2 B 38 38 LEU N N 459 121.280 121.715 -0.435 1
1 1512 . 4 2 2 B 39 39 ALA H H 460 8.190 8.363 -0.173 1
1 1513 . 4 2 2 B 39 39 ALA HA H 460 3.640 3.987 -0.347 1
1 1517 . 4 2 2 B 39 39 ALA CA C 460 54.320 55.510 -1.190 1
1 1518 . 4 2 2 B 39 39 ALA CB C 460 17.140 18.211 -1.071 1
1 1519 . 4 2 2 B 39 39 ALA N N 460 119.400 121.100 -1.700 1
1 1520 . 4 2 2 B 40 40 GLU H H 461 7.340 8.105 -0.765 1
1 1521 . 4 2 2 B 40 40 GLU HA H 461 4.180 4.044 0.136 1
1 1526 . 4 2 2 B 40 40 GLU CA C 461 57.800 59.298 -1.498 1
1 1527 . 4 2 2 B 40 40 GLU CB C 461 30.600 29.122 1.478 1
1 1529 . 4 2 2 B 40 40 GLU N N 461 110.680 117.826 -7.146 1
1 1530 . 4 2 2 B 41 41 GLN H H 462 7.940 7.858 0.082 1
1 1531 . 4 2 2 B 41 41 GLN HA H 462 4.100 4.420 -0.320 1
1 1538 . 4 2 2 B 41 41 GLN CA C 462 55.310 56.815 -1.505 1
1 1539 . 4 2 2 B 41 41 GLN CB C 462 28.780 29.488 -0.708 1
1 1541 . 4 2 2 B 41 41 GLN N N 462 120.720 119.138 1.582 1
1 1543 . 4 2 2 B 42 42 GLY H H 463 9.000 8.452 0.548 1
1 1544 . 4 2 2 B 42 42 GLY HA2 H 463 3.310 4.280 -0.970 1
1 1545 . 4 2 2 B 42 42 GLY HA3 H 463 4.820 4.285 0.535 1
1 1546 . 4 2 2 B 42 42 GLY CA C 463 42.650 43.884 -1.234 1
1 1547 . 4 2 2 B 42 42 GLY N N 463 104.110 108.449 -4.339 1
1 1548 . 4 2 2 B 43 43 ILE H H 464 7.900 8.739 -0.839 1
1 1549 . 4 2 2 B 43 43 ILE HA H 464 3.260 3.708 -0.448 1
1 1558 . 4 2 2 B 43 43 ILE CA C 464 66.570 64.608 1.962 1
1 1559 . 4 2 2 B 43 43 ILE CB C 464 38.770 37.670 1.100 1
1 1562 . 4 2 2 B 43 43 ILE N N 464 119.410 121.334 -1.924 1
1 1563 . 4 2 2 B 44 44 ASP H H 465 8.730 8.185 0.545 1
1 1564 . 4 2 2 B 44 44 ASP HA H 465 4.310 4.386 -0.076 1
1 1567 . 4 2 2 B 44 44 ASP CA C 465 56.740 57.740 -1.000 1
1 1568 . 4 2 2 B 44 44 ASP CB C 465 40.120 40.174 -0.054 1
1 1569 . 4 2 2 B 44 44 ASP N N 465 116.610 120.642 -4.032 1
1 1570 . 4 2 2 B 45 45 ASP H H 466 7.720 8.299 -0.579 1
1 1571 . 4 2 2 B 45 45 ASP HA H 466 4.480 4.409 0.071 1
1 1574 . 4 2 2 B 45 45 ASP CA C 466 57.000 56.765 0.235 1
1 1575 . 4 2 2 B 45 45 ASP CB C 466 42.270 40.383 1.887 1
1 1576 . 4 2 2 B 45 45 ASP N N 466 117.560 118.963 -1.403 1
1 1577 . 4 2 2 B 46 46 LEU H H 467 7.370 7.567 -0.197 1
1 1578 . 4 2 2 B 46 46 LEU HA H 467 4.410 4.316 0.094 1
1 1587 . 4 2 2 B 46 46 LEU CA C 467 53.660 55.549 -1.889 1
1 1588 . 4 2 2 B 46 46 LEU CB C 467 42.260 42.491 -0.231 1
1 1591 . 4 2 2 B 46 46 LEU N N 467 116.890 117.465 -0.575 1
1 1592 . 4 2 2 B 47 47 ALA H H 468 7.080 7.968 -0.888 1
1 1593 . 4 2 2 B 47 47 ALA HA H 468 4.120 4.142 -0.022 1
1 1597 . 4 2 2 B 47 47 ALA CA C 468 54.130 54.894 -0.764 1
1 1598 . 4 2 2 B 47 47 ALA CB C 468 19.480 18.062 1.418 1
1 1599 . 4 2 2 B 47 47 ALA N N 468 120.150 122.162 -2.012 1
1 1600 . 4 2 2 B 48 48 ASP H H 469 8.560 7.723 0.837 1
1 1601 . 4 2 2 B 48 48 ASP HA H 469 4.410 4.557 -0.147 1
1 1604 . 4 2 2 B 48 48 ASP CA C 469 54.330 54.123 0.207 1
1 1605 . 4 2 2 B 48 48 ASP CB C 469 39.760 39.661 0.099 1
1 1606 . 4 2 2 B 48 48 ASP N N 469 114.660 113.964 0.696 1
1 1607 . 4 2 2 B 49 49 ILE H H 470 7.870 7.416 0.454 1
1 1608 . 4 2 2 B 49 49 ILE HA H 470 3.850 4.317 -0.467 1
1 1618 . 4 2 2 B 49 49 ILE CA C 470 61.680 60.851 0.829 1
1 1619 . 4 2 2 B 49 49 ILE CB C 470 37.120 39.001 -1.881 1
1 1623 . 4 2 2 B 49 49 ILE N N 470 121.600 121.349 0.251 1
1 1624 . 4 2 2 B 50 50 GLU H H 471 8.680 8.856 -0.176 1
1 1625 . 4 2 2 B 50 50 GLU HA H 471 3.940 3.976 -0.036 1
1 1630 . 4 2 2 B 50 50 GLU CA C 471 58.360 58.662 -0.302 1
1 1631 . 4 2 2 B 50 50 GLU CB C 471 29.530 29.257 0.273 1
1 1633 . 4 2 2 B 50 50 GLU N N 471 131.000 127.460 3.540 1
1 1634 . 4 2 2 B 51 51 GLY H H 472 8.860 8.972 -0.112 1
1 1635 . 4 2 2 B 51 51 GLY HA2 H 472 3.640 3.973 -0.333 1
1 1636 . 4 2 2 B 51 51 GLY HA3 H 472 4.230 3.974 0.256 1
1 1637 . 4 2 2 B 51 51 GLY CA C 472 45.190 45.071 0.119 1
1 1638 . 4 2 2 B 51 51 GLY N N 472 113.580 112.551 1.029 1
1 1639 . 4 2 2 B 52 52 LEU H H 473 7.850 7.684 0.166 1
1 1640 . 4 2 2 B 52 52 LEU HA H 473 4.680 4.342 0.338 1
1 1650 . 4 2 2 B 52 52 LEU CA C 473 53.640 54.319 -0.679 1
1 1651 . 4 2 2 B 52 52 LEU CB C 473 42.990 41.644 1.346 1
1 1655 . 4 2 2 B 52 52 LEU N N 473 123.020 122.225 0.795 1
1 1656 . 4 2 2 B 53 53 THR H H 474 7.550 8.826 -1.276 1
1 1657 . 4 2 2 B 53 53 THR HA H 474 4.560 4.824 -0.264 1
1 1662 . 4 2 2 B 53 53 THR CA C 474 60.060 60.872 -0.812 1
1 1663 . 4 2 2 B 53 53 THR CB C 474 71.520 71.302 0.218 1
1 1665 . 4 2 2 B 53 53 THR N N 474 115.070 118.868 -3.798 1
1 1666 . 4 2 2 B 54 54 ASP H H 475 8.900 9.039 -0.139 1
1 1667 . 4 2 2 B 54 54 ASP HA H 475 4.220 4.297 -0.077 1
1 1670 . 4 2 2 B 54 54 ASP CA C 475 57.520 57.928 -0.408 1
1 1671 . 4 2 2 B 54 54 ASP CB C 475 39.560 40.247 -0.687 1
1 1672 . 4 2 2 B 54 54 ASP N N 475 121.800 123.819 -2.019 1
1 1673 . 4 2 2 B 55 55 GLU H H 476 8.460 7.894 0.566 1
1 1674 . 4 2 2 B 55 55 GLU HA H 476 3.970 4.035 -0.065 1
1 1679 . 4 2 2 B 55 55 GLU CA C 476 59.440 58.987 0.453 1
1 1680 . 4 2 2 B 55 55 GLU CB C 476 29.650 29.438 0.212 1
1 1682 . 4 2 2 B 55 55 GLU N N 476 119.460 119.160 0.300 1
1 1683 . 4 2 2 B 56 56 LYS H H 477 7.790 8.099 -0.309 1
1 1684 . 4 2 2 B 56 56 LYS HA H 477 4.120 4.073 0.047 1
1 1693 . 4 2 2 B 56 56 LYS CA C 477 58.890 59.336 -0.446 1
1 1694 . 4 2 2 B 56 56 LYS CB C 477 32.600 32.203 0.397 1
1 1698 . 4 2 2 B 56 56 LYS N N 477 121.840 119.810 2.030 1
1 1699 . 4 2 2 B 57 57 ALA H H 478 8.900 8.713 0.187 1
1 1700 . 4 2 2 B 57 57 ALA HA H 478 3.790 4.055 -0.265 1
1 1704 . 4 2 2 B 57 57 ALA CA C 478 55.810 55.133 0.677 1
1 1705 . 4 2 2 B 57 57 ALA CB C 478 18.590 18.387 0.203 1
1 1706 . 4 2 2 B 57 57 ALA N N 478 121.350 121.472 -0.122 1
1 1707 . 4 2 2 B 58 58 GLY H H 479 8.300 8.067 0.233 1
1 1708 . 4 2 2 B 58 58 GLY HA2 H 479 3.500 3.812 -0.312 1
1 1709 . 4 2 2 B 58 58 GLY HA3 H 479 3.890 3.817 0.073 1
1 1710 . 4 2 2 B 58 58 GLY CA C 479 47.360 47.064 0.296 1
1 1711 . 4 2 2 B 58 58 GLY N N 479 102.040 105.789 -3.749 1
1 1712 . 4 2 2 B 59 59 ALA H H 480 7.580 7.996 -0.416 1
1 1713 . 4 2 2 B 59 59 ALA HA H 480 4.110 3.997 0.113 1
1 1717 . 4 2 2 B 59 59 ALA CA C 480 55.580 54.620 0.960 1
1 1718 . 4 2 2 B 59 59 ALA CB C 480 18.130 18.433 -0.303 1
1 1719 . 4 2 2 B 59 59 ALA N N 480 123.180 125.226 -2.046 1
1 1720 . 4 2 2 B 60 60 LEU H H 481 8.290 8.086 0.204 1
1 1721 . 4 2 2 B 60 60 LEU HA H 481 4.020 4.047 -0.027 1
1 1731 . 4 2 2 B 60 60 LEU CA C 481 57.850 57.678 0.172 1
1 1732 . 4 2 2 B 60 60 LEU CB C 481 42.360 41.428 0.932 1
1 1736 . 4 2 2 B 60 60 LEU N N 481 120.560 118.665 1.895 1
1 1737 . 4 2 2 B 61 61 ILE H H 482 8.080 7.633 0.447 1
1 1738 . 4 2 2 B 61 61 ILE HA H 482 3.210 3.731 -0.521 1
1 1748 . 4 2 2 B 61 61 ILE CA C 482 66.250 65.006 1.244 1
1 1749 . 4 2 2 B 61 61 ILE CB C 482 39.400 37.963 1.437 1
1 1753 . 4 2 2 B 61 61 ILE N N 482 119.170 120.719 -1.549 1
1 1754 . 4 2 2 B 62 62 MET H H 483 8.110 8.282 -0.172 1
1 1755 . 4 2 2 B 62 62 MET HA H 483 4.410 4.151 0.259 1
1 1763 . 4 2 2 B 62 62 MET CA C 483 56.110 58.717 -2.607 1
1 1764 . 4 2 2 B 62 62 MET CB C 483 28.260 32.576 -4.316 1
1 1767 . 4 2 2 B 62 62 MET N N 483 114.420 118.411 -3.991 1
1 1768 . 4 2 2 B 63 63 ALA H H 484 8.240 7.872 0.368 1
1 1769 . 4 2 2 B 63 63 ALA HA H 484 4.130 4.139 -0.009 1
1 1773 . 4 2 2 B 63 63 ALA CA C 484 55.300 55.053 0.247 1
1 1774 . 4 2 2 B 63 63 ALA CB C 484 18.280 18.474 -0.194 1
1 1775 . 4 2 2 B 63 63 ALA N N 484 123.710 121.483 2.227 1
1 1776 . 4 2 2 B 64 64 ALA H H 485 8.050 8.087 -0.037 1
1 1777 . 4 2 2 B 64 64 ALA HA H 485 3.870 4.047 -0.177 1
1 1781 . 4 2 2 B 64 64 ALA CA C 485 55.330 55.290 0.040 1
1 1782 . 4 2 2 B 64 64 ALA CB C 485 17.660 18.236 -0.576 1
1 1783 . 4 2 2 B 64 64 ALA N N 485 120.070 119.842 0.228 1
1 1784 . 4 2 2 B 65 65 ARG H H 486 8.640 9.051 -0.411 1
1 1785 . 4 2 2 B 65 65 ARG HA H 486 2.800 4.180 -1.380 1
1 1792 . 4 2 2 B 65 65 ARG CA C 486 60.600 59.876 0.724 1
1 1793 . 4 2 2 B 65 65 ARG CB C 486 29.910 30.339 -0.429 1
1 1796 . 4 2 2 B 65 65 ARG N N 486 118.730 118.071 0.659 1
1 1797 . 4 2 2 B 66 66 ASN H H 487 8.710 8.549 0.161 1
1 1798 . 4 2 2 B 66 66 ASN HA H 487 4.550 5.012 -0.462 1
1 1803 . 4 2 2 B 66 66 ASN CA C 487 56.390 56.526 -0.136 1
1 1804 . 4 2 2 B 66 66 ASN CB C 487 37.970 38.757 -0.787 1
1 1805 . 4 2 2 B 66 66 ASN N N 487 119.170 118.090 1.080 1
1 1807 . 4 2 2 B 67 67 ILE H H 488 7.250 7.806 -0.556 1
1 1808 . 4 2 2 B 67 67 ILE HA H 488 3.810 3.832 -0.022 1
1 1818 . 4 2 2 B 67 67 ILE CA C 488 64.350 64.793 -0.443 1
1 1819 . 4 2 2 B 67 67 ILE CB C 488 39.570 37.404 2.166 1
1 1823 . 4 2 2 B 67 67 ILE N N 488 117.890 119.854 -1.964 1
1 1824 . 4 2 2 B 68 68 CYS H H 489 8.350 8.180 0.170 1
1 1825 . 4 2 2 B 68 68 CYS HA H 489 4.080 4.061 0.019 1
1 1828 . 4 2 2 B 68 68 CYS CA C 489 62.670 62.574 0.096 1
1 1829 . 4 2 2 B 68 68 CYS CB C 489 28.170 27.053 1.117 1
1 1830 . 4 2 2 B 68 68 CYS N N 489 115.230 120.392 -5.162 1
1 1831 . 4 2 2 B 69 69 TRP H H 490 8.230 8.844 -0.614 1
1 1832 . 4 2 2 B 69 69 TRP HA H 490 5.100 4.264 0.836 1
1 1841 . 4 2 2 B 69 69 TRP CA C 490 55.420 60.166 -4.746 1
1 1842 . 4 2 2 B 69 69 TRP CB C 490 31.010 29.004 2.006 1
1 1844 . 4 2 2 B 69 69 TRP N N 490 116.850 120.963 -4.113 1
1 1846 . 4 2 2 B 70 70 PHE H H 491 7.570 8.483 -0.913 1
1 1847 . 4 2 2 B 70 70 PHE HA H 491 5.240 4.738 0.502 1
1 1852 . 4 2 2 B 70 70 PHE CA C 491 55.490 58.137 -2.647 1
1 1853 . 4 2 2 B 70 70 PHE CB C 491 38.700 38.749 -0.049 1
1 1856 . 4 2 2 B 70 70 PHE N N 491 117.460 115.997 1.463 1
1 1857 . 4 2 2 B 71 71 GLY H H 492 8.420 8.282 0.138 1
1 1858 . 4 2 2 B 71 71 GLY HA2 H 492 3.920 4.026 -0.106 1
1 1859 . 4 2 2 B 71 71 GLY HA3 H 492 4.080 4.066 0.014 1
1 1860 . 4 2 2 B 71 71 GLY CA C 492 46.210 45.617 0.593 1
1 1861 . 4 2 2 B 71 71 GLY N N 492 110.040 107.924 2.116 1
1 1862 . 4 2 2 B 72 72 ASP H H 493 8.370 8.748 -0.378 1
1 1863 . 4 2 2 B 72 72 ASP HA H 493 4.630 4.238 0.392 1
1 1866 . 4 2 2 B 72 72 ASP CA C 493 54.410 57.308 -2.898 1
1 1867 . 4 2 2 B 72 72 ASP CB C 493 41.250 40.324 0.926 1
1 1868 . 4 2 2 B 72 72 ASP N N 493 120.000 122.320 -2.320 1
1 1869 . 4 2 2 B 73 73 GLU H H 494 8.230 8.281 -0.051 1
1 1870 . 4 2 2 B 73 73 GLU HA H 494 4.260 3.984 0.276 1
1 1875 . 4 2 2 B 73 73 GLU CA C 494 56.510 59.249 -2.739 1
1 1876 . 4 2 2 B 73 73 GLU CB C 494 30.420 29.136 1.284 1
1 1878 . 4 2 2 B 73 73 GLU N N 494 120.900 119.746 1.154 1
1 216 . 5 1 1 A 20 20 ASP H H 250 8.550 8.924 -0.374 1
1 217 . 5 1 1 A 20 20 ASP HA H 250 4.700 4.684 0.016 1
1 220 . 5 1 1 A 20 20 ASP CA C 250 52.650 53.024 -0.374 1
1 221 . 5 1 1 A 20 20 ASP CB C 250 41.420 40.164 1.256 1
1 222 . 5 1 1 A 20 20 ASP N N 250 125.190 125.106 0.084 1
1 223 . 5 1 1 A 21 21 PRO HA H 251 4.250 4.455 -0.205 1
1 230 . 5 1 1 A 21 21 PRO CA C 251 65.120 64.629 0.491 1
1 231 . 5 1 1 A 21 21 PRO CB C 251 32.310 32.085 0.225 1
1 234 . 5 1 1 A 22 22 ILE H H 252 8.630 7.850 0.780 1
1 235 . 5 1 1 A 22 22 ILE HA H 252 4.060 4.011 0.049 1
1 245 . 5 1 1 A 22 22 ILE CA C 252 62.990 62.966 0.024 1
1 246 . 5 1 1 A 22 22 ILE CB C 252 37.520 37.630 -0.110 1
1 250 . 5 1 1 A 22 22 ILE N N 252 119.860 117.316 2.544 1
1 251 . 5 1 1 A 23 23 LEU H H 253 7.950 7.812 0.138 1
1 252 . 5 1 1 A 23 23 LEU HA H 253 3.710 4.233 -0.523 1
1 262 . 5 1 1 A 23 23 LEU CA C 253 56.510 57.727 -1.217 1
1 263 . 5 1 1 A 23 23 LEU CB C 253 41.190 41.752 -0.562 1
1 266 . 5 1 1 A 23 23 LEU N N 253 116.850 121.323 -4.473 1
1 267 . 5 1 1 A 24 24 LEU H H 254 7.370 7.841 -0.471 1
1 268 . 5 1 1 A 24 24 LEU HA H 254 4.310 4.769 -0.459 1
1 278 . 5 1 1 A 24 24 LEU CA C 254 54.890 56.420 -1.530 1
1 279 . 5 1 1 A 24 24 LEU CB C 254 41.960 42.609 -0.649 1
1 283 . 5 1 1 A 24 24 LEU N N 254 115.210 119.736 -4.526 1
1 284 . 5 1 1 A 25 25 ARG H H 255 7.520 7.464 0.056 1
1 285 . 5 1 1 A 25 25 ARG HA H 255 4.660 4.491 0.169 1
1 293 . 5 1 1 A 25 25 ARG CA C 255 52.840 53.986 -1.146 1
1 294 . 5 1 1 A 25 25 ARG CB C 255 28.130 29.930 -1.800 1
1 297 . 5 1 1 A 25 25 ARG N N 255 118.180 119.411 -1.231 1
1 298 . 5 1 1 A 26 26 PRO HA H 256 4.800 4.808 -0.008 1
1 305 . 5 1 1 A 26 26 PRO CA C 256 61.790 62.617 -0.827 1
1 306 . 5 1 1 A 26 26 PRO CB C 256 32.660 32.149 0.511 1
1 309 . 5 1 1 A 27 27 VAL H H 257 8.170 8.487 -0.317 1
1 310 . 5 1 1 A 27 27 VAL HA H 257 3.590 3.738 -0.148 1
1 318 . 5 1 1 A 27 27 VAL CA C 257 64.830 65.744 -0.914 1
1 319 . 5 1 1 A 27 27 VAL CB C 257 31.720 31.638 0.082 1
1 322 . 5 1 1 A 27 27 VAL N N 257 115.710 123.811 -8.101 1
1 323 . 5 1 1 A 28 28 ASP H H 258 8.240 8.055 0.185 1
1 324 . 5 1 1 A 28 28 ASP HA H 258 4.340 4.378 -0.038 1
1 327 . 5 1 1 A 28 28 ASP CA C 258 56.490 57.495 -1.005 1
1 328 . 5 1 1 A 28 28 ASP CB C 258 40.520 40.161 0.359 1
1 329 . 5 1 1 A 28 28 ASP N N 258 119.000 122.039 -3.039 1
1 330 . 5 1 1 A 29 29 ASP H H 259 8.000 8.626 -0.626 1
1 331 . 5 1 1 A 29 29 ASP HA H 259 4.390 4.602 -0.212 1
1 334 . 5 1 1 A 29 29 ASP CA C 259 56.210 55.190 1.020 1
1 335 . 5 1 1 A 29 29 ASP CB C 259 40.670 41.217 -0.547 1
1 336 . 5 1 1 A 29 29 ASP N N 259 118.900 117.578 1.322 1
1 337 . 5 1 1 A 30 30 LEU H H 260 7.760 7.548 0.212 1
1 338 . 5 1 1 A 30 30 LEU HA H 260 3.990 4.260 -0.270 1
1 348 . 5 1 1 A 30 30 LEU CA C 260 55.000 55.091 -0.091 1
1 349 . 5 1 1 A 30 30 LEU CB C 260 41.670 42.227 -0.557 1
1 353 . 5 1 1 A 30 30 LEU N N 260 116.300 121.290 -4.990 1
1 354 . 5 1 1 A 31 31 GLU H H 261 7.990 8.953 -0.963 1
1 355 . 5 1 1 A 31 31 GLU HA H 261 4.280 4.040 0.240 1
1 358 . 5 1 1 A 31 31 GLU CA C 261 56.860 59.005 -2.145 1
1 359 . 5 1 1 A 31 31 GLU CB C 261 27.010 29.595 -2.585 1
1 360 . 5 1 1 A 31 31 GLU N N 261 115.620 123.043 -7.423 1
1 361 . 5 1 1 A 32 32 LEU H H 262 8.000 7.337 0.663 1
1 362 . 5 1 1 A 32 32 LEU HA H 262 4.400 4.309 0.091 1
1 372 . 5 1 1 A 32 32 LEU CA C 262 53.860 54.888 -1.028 1
1 373 . 5 1 1 A 32 32 LEU CB C 262 44.450 42.161 2.289 1
1 377 . 5 1 1 A 32 32 LEU N N 262 118.860 122.572 -3.712 1
1 378 . 5 1 1 A 33 33 THR H H 263 10.020 8.665 1.355 1
1 379 . 5 1 1 A 33 33 THR HA H 263 4.130 4.645 -0.515 1
1 384 . 5 1 1 A 33 33 THR CA C 263 62.400 60.806 1.594 1
1 385 . 5 1 1 A 33 33 THR CB C 263 71.270 71.159 0.111 1
1 387 . 5 1 1 A 33 33 THR N N 263 114.610 113.897 0.713 1
1 388 . 5 1 1 A 34 34 VAL H H 264 8.370 8.780 -0.410 1
1 389 . 5 1 1 A 34 34 VAL HA H 264 3.620 3.648 -0.028 1
1 397 . 5 1 1 A 34 34 VAL CA C 264 66.340 66.622 -0.282 1
1 398 . 5 1 1 A 34 34 VAL CB C 264 31.670 31.762 -0.092 1
1 401 . 5 1 1 A 34 34 VAL N N 264 122.110 122.421 -0.311 1
1 402 . 5 1 1 A 35 35 ARG H H 265 8.190 8.226 -0.036 1
1 403 . 5 1 1 A 35 35 ARG HA H 265 4.070 3.972 0.098 1
1 411 . 5 1 1 A 35 35 ARG CA C 265 59.470 60.005 -0.535 1
1 412 . 5 1 1 A 35 35 ARG CB C 265 29.790 29.800 -0.010 1
1 415 . 5 1 1 A 35 35 ARG N N 265 117.340 120.080 -2.740 1
1 416 . 5 1 1 A 36 36 SER H H 266 7.610 7.812 -0.202 1
1 417 . 5 1 1 A 36 36 SER HA H 266 4.080 4.111 -0.031 1
1 420 . 5 1 1 A 36 36 SER CA C 266 63.080 61.611 1.469 1
1 421 . 5 1 1 A 36 36 SER CB C 266 63.280 62.987 0.293 1
1 422 . 5 1 1 A 36 36 SER N N 266 116.710 115.343 1.367 1
1 423 . 5 1 1 A 37 37 ALA H H 267 8.720 7.603 1.117 1
1 424 . 5 1 1 A 37 37 ALA HA H 267 3.760 4.007 -0.247 1
1 428 . 5 1 1 A 37 37 ALA CA C 267 55.900 55.270 0.630 1
1 429 . 5 1 1 A 37 37 ALA CB C 267 18.090 17.961 0.129 1
1 430 . 5 1 1 A 37 37 ALA N N 267 124.170 122.308 1.862 1
1 431 . 5 1 1 A 38 38 ASN H H 268 8.850 9.049 -0.199 1
1 432 . 5 1 1 A 38 38 ASN HA H 268 4.420 4.523 -0.103 1
1 437 . 5 1 1 A 38 38 ASN CA C 268 55.700 56.330 -0.630 1
1 438 . 5 1 1 A 38 38 ASN CB C 268 37.180 37.734 -0.554 1
1 439 . 5 1 1 A 38 38 ASN N N 268 117.370 117.587 -0.217 1
1 441 . 5 1 1 A 39 39 CYS H H 269 7.970 8.033 -0.063 1
1 442 . 5 1 1 A 39 39 CYS HA H 269 4.190 4.104 0.086 1
1 445 . 5 1 1 A 39 39 CYS CA C 269 63.340 62.967 0.373 1
1 446 . 5 1 1 A 39 39 CYS CB C 269 26.870 27.236 -0.366 1
1 447 . 5 1 1 A 39 39 CYS N N 269 120.510 118.469 2.041 1
1 448 . 5 1 1 A 40 40 LEU H H 270 7.600 7.682 -0.082 1
1 449 . 5 1 1 A 40 40 LEU HA H 270 3.880 3.903 -0.023 1
1 458 . 5 1 1 A 40 40 LEU CA C 270 57.810 57.741 0.069 1
1 459 . 5 1 1 A 40 40 LEU CB C 270 40.030 41.081 -1.051 1
1 462 . 5 1 1 A 40 40 LEU N N 270 117.710 120.405 -2.695 1
1 463 . 5 1 1 A 41 41 LYS H H 271 7.980 8.878 -0.898 1
1 464 . 5 1 1 A 41 41 LYS HA H 271 3.820 4.251 -0.431 1
1 472 . 5 1 1 A 41 41 LYS CA C 271 59.840 59.151 0.689 1
1 473 . 5 1 1 A 41 41 LYS CB C 271 32.070 32.026 0.044 1
1 476 . 5 1 1 A 41 41 LYS N N 271 120.070 120.958 -0.888 1
1 477 . 5 1 1 A 42 42 ALA H H 272 7.860 8.643 -0.783 1
1 478 . 5 1 1 A 42 42 ALA HA H 272 4.140 4.049 0.091 1
1 482 . 5 1 1 A 42 42 ALA CA C 272 54.670 54.638 0.032 1
1 483 . 5 1 1 A 42 42 ALA CB C 272 17.950 18.555 -0.605 1
1 484 . 5 1 1 A 42 42 ALA N N 272 122.880 121.736 1.144 1
1 485 . 5 1 1 A 43 43 GLU H H 273 7.210 7.908 -0.698 1
1 486 . 5 1 1 A 43 43 GLU HA H 273 4.260 4.415 -0.155 1
1 491 . 5 1 1 A 43 43 GLU CA C 273 55.020 55.948 -0.928 1
1 492 . 5 1 1 A 43 43 GLU CB C 273 29.880 29.343 0.537 1
1 494 . 5 1 1 A 43 43 GLU N N 273 116.590 115.429 1.161 1
1 495 . 5 1 1 A 44 44 ALA H H 274 7.880 8.306 -0.426 1
1 496 . 5 1 1 A 44 44 ALA HA H 274 3.680 3.813 -0.133 1
1 500 . 5 1 1 A 44 44 ALA CA C 274 52.960 53.049 -0.089 1
1 501 . 5 1 1 A 44 44 ALA CB C 274 16.110 17.267 -1.157 1
1 502 . 5 1 1 A 44 44 ALA N N 274 118.420 119.046 -0.626 1
1 503 . 5 1 1 A 45 45 ILE H H 275 7.600 7.360 0.240 1
1 504 . 5 1 1 A 45 45 ILE HA H 275 3.870 4.192 -0.322 1
1 514 . 5 1 1 A 45 45 ILE CA C 275 61.150 60.284 0.866 1
1 515 . 5 1 1 A 45 45 ILE CB C 275 37.090 39.307 -2.217 1
1 519 . 5 1 1 A 45 45 ILE N N 275 120.370 117.772 2.598 1
1 520 . 5 1 1 A 46 46 HIS H H 276 8.350 8.766 -0.416 1
1 521 . 5 1 1 A 46 46 HIS HA H 276 4.600 4.807 -0.207 1
1 526 . 5 1 1 A 46 46 HIS CA C 276 56.900 56.686 0.214 1
1 527 . 5 1 1 A 46 46 HIS CB C 276 31.910 30.682 1.228 1
1 529 . 5 1 1 A 46 46 HIS N N 276 123.250 125.687 -2.437 1
1 530 . 5 1 1 A 47 47 TYR H H 277 8.850 7.928 0.922 1
1 531 . 5 1 1 A 47 47 TYR HA H 277 5.100 4.827 0.273 1
1 538 . 5 1 1 A 47 47 TYR CA C 277 57.430 56.444 0.986 1
1 539 . 5 1 1 A 47 47 TYR CB C 277 40.680 40.727 -0.047 1
1 544 . 5 1 1 A 47 47 TYR N N 277 119.700 118.125 1.575 1
1 545 . 5 1 1 A 48 48 ILE H H 278 9.380 8.561 0.819 1
1 546 . 5 1 1 A 48 48 ILE HA H 278 3.340 3.681 -0.341 1
1 554 . 5 1 1 A 48 48 ILE CA C 278 67.640 65.166 2.474 1
1 555 . 5 1 1 A 48 48 ILE CB C 278 36.310 37.315 -1.005 1
1 558 . 5 1 1 A 48 48 ILE N N 278 125.650 125.116 0.534 1
1 559 . 5 1 1 A 49 49 GLY H H 279 9.430 8.057 1.373 1
1 560 . 5 1 1 A 49 49 GLY HA2 H 279 2.370 2.611 -0.241 1
1 561 . 5 1 1 A 49 49 GLY HA3 H 279 3.230 3.713 -0.483 1
1 562 . 5 1 1 A 49 49 GLY CA C 279 46.820 46.979 -0.159 1
1 563 . 5 1 1 A 49 49 GLY N N 279 105.200 108.478 -3.278 1
1 564 . 5 1 1 A 50 50 ASP H H 280 7.050 7.214 -0.164 1
1 565 . 5 1 1 A 50 50 ASP HA H 280 4.360 4.106 0.254 1
1 568 . 5 1 1 A 50 50 ASP CA C 280 57.110 56.115 0.995 1
1 569 . 5 1 1 A 50 50 ASP CB C 280 42.620 40.407 2.213 1
1 570 . 5 1 1 A 50 50 ASP N N 280 116.360 121.024 -4.664 1
1 571 . 5 1 1 A 51 51 LEU H H 281 7.170 8.008 -0.838 1
1 572 . 5 1 1 A 51 51 LEU HA H 281 3.880 3.961 -0.081 1
1 582 . 5 1 1 A 51 51 LEU CA C 281 57.900 58.254 -0.354 1
1 583 . 5 1 1 A 51 51 LEU CB C 281 41.870 41.443 0.427 1
1 587 . 5 1 1 A 51 51 LEU N N 281 120.130 122.027 -1.897 1
1 588 . 5 1 1 A 52 52 VAL H H 282 7.820 7.661 0.159 1
1 589 . 5 1 1 A 52 52 VAL HA H 282 3.980 3.940 0.040 1
1 597 . 5 1 1 A 52 52 VAL CA C 282 64.000 65.304 -1.304 1
1 598 . 5 1 1 A 52 52 VAL CB C 282 30.400 31.301 -0.901 1
1 601 . 5 1 1 A 52 52 VAL N N 282 105.550 115.117 -9.567 1
1 602 . 5 1 1 A 53 53 GLN H H 283 6.550 7.860 -1.310 1
1 603 . 5 1 1 A 53 53 GLN HA H 283 4.680 4.080 0.600 1
1 610 . 5 1 1 A 53 53 GLN CA C 283 56.210 58.557 -2.347 1
1 611 . 5 1 1 A 53 53 GLN CB C 283 31.710 28.710 3.000 1
1 613 . 5 1 1 A 53 53 GLN N N 283 114.060 121.209 -7.149 1
1 615 . 5 1 1 A 54 54 ARG H H 284 7.690 7.630 0.060 1
1 616 . 5 1 1 A 54 54 ARG HA H 284 4.520 4.758 -0.238 1
1 624 . 5 1 1 A 54 54 ARG CA C 284 54.600 54.321 0.279 1
1 625 . 5 1 1 A 54 54 ARG CB C 284 30.750 32.731 -1.981 1
1 628 . 5 1 1 A 54 54 ARG N N 284 119.810 118.530 1.280 1
1 629 . 5 1 1 A 55 55 THR H H 285 8.110 8.602 -0.492 1
1 630 . 5 1 1 A 55 55 THR HA H 285 4.430 4.299 0.131 1
1 635 . 5 1 1 A 55 55 THR CA C 285 59.640 64.054 -4.414 1
1 636 . 5 1 1 A 55 55 THR CB C 285 71.310 69.269 2.041 1
1 638 . 5 1 1 A 55 55 THR N N 285 108.450 119.297 -10.847 1
1 639 . 5 1 1 A 56 56 GLU H H 286 8.910 8.923 -0.013 1
1 640 . 5 1 1 A 56 56 GLU HA H 286 3.660 3.931 -0.271 1
1 645 . 5 1 1 A 56 56 GLU CA C 286 60.650 59.760 0.890 1
1 646 . 5 1 1 A 56 56 GLU CB C 286 29.400 29.155 0.245 1
1 648 . 5 1 1 A 56 56 GLU N N 286 120.600 126.555 -5.955 1
1 649 . 5 1 1 A 57 57 VAL H H 287 7.600 8.128 -0.528 1
1 650 . 5 1 1 A 57 57 VAL HA H 287 3.620 3.518 0.102 1
1 658 . 5 1 1 A 57 57 VAL CA C 287 66.020 67.137 -1.117 1
1 659 . 5 1 1 A 57 57 VAL CB C 287 31.720 31.529 0.191 1
1 662 . 5 1 1 A 57 57 VAL N N 287 114.050 119.910 -5.860 1
1 663 . 5 1 1 A 58 58 GLU H H 288 7.350 8.179 -0.829 1
1 664 . 5 1 1 A 58 58 GLU HA H 288 3.830 4.068 -0.238 1
1 669 . 5 1 1 A 58 58 GLU CA C 288 59.250 59.699 -0.449 1
1 670 . 5 1 1 A 58 58 GLU CB C 288 30.030 29.192 0.838 1
1 672 . 5 1 1 A 58 58 GLU N N 288 117.610 119.261 -1.651 1
1 673 . 5 1 1 A 59 59 LEU H H 289 7.850 7.842 0.008 1
1 674 . 5 1 1 A 59 59 LEU HA H 289 4.150 4.338 -0.188 1
1 683 . 5 1 1 A 59 59 LEU CA C 289 57.340 57.775 -0.435 1
1 684 . 5 1 1 A 59 59 LEU CB C 289 41.170 41.307 -0.137 1
1 687 . 5 1 1 A 59 59 LEU N N 289 120.050 120.291 -0.241 1
1 688 . 5 1 1 A 60 60 LEU H H 290 7.670 8.078 -0.408 1
1 689 . 5 1 1 A 60 60 LEU HA H 290 4.540 4.015 0.525 1
1 696 . 5 1 1 A 60 60 LEU CA C 290 55.090 57.961 -2.871 1
1 697 . 5 1 1 A 60 60 LEU CB C 290 42.320 40.984 1.336 1
1 701 . 5 1 1 A 60 60 LEU N N 290 114.980 120.078 -5.098 1
1 702 . 5 1 1 A 61 61 LYS H H 291 7.440 7.256 0.184 1
1 703 . 5 1 1 A 61 61 LYS HA H 291 4.280 4.406 -0.126 1
1 710 . 5 1 1 A 61 61 LYS CA C 291 56.860 55.795 1.065 1
1 711 . 5 1 1 A 61 61 LYS CB C 291 31.900 32.394 -0.494 1
1 714 . 5 1 1 A 61 61 LYS N N 291 118.120 116.776 1.344 1
1 715 . 5 1 1 A 62 62 THR H H 292 7.310 7.275 0.035 1
1 716 . 5 1 1 A 62 62 THR HA H 292 5.220 4.707 0.513 1
1 721 . 5 1 1 A 62 62 THR CA C 292 55.830 58.867 -3.037 1
1 722 . 5 1 1 A 62 62 THR CB C 292 69.970 70.971 -1.001 1
1 724 . 5 1 1 A 62 62 THR N N 292 111.890 114.652 -2.762 1
1 725 . 5 1 1 A 63 63 PRO HA H 293 4.570 4.524 0.046 1
1 730 . 5 1 1 A 63 63 PRO CA C 293 63.710 64.262 -0.552 1
1 731 . 5 1 1 A 63 63 PRO CB C 293 32.380 31.949 0.431 1
1 733 . 5 1 1 A 64 64 ASN H H 294 8.050 8.887 -0.837 1
1 734 . 5 1 1 A 64 64 ASN HA H 294 4.490 4.480 0.010 1
1 739 . 5 1 1 A 64 64 ASN CA C 294 55.630 55.324 0.306 1
1 740 . 5 1 1 A 64 64 ASN CB C 294 38.730 38.100 0.630 1
1 741 . 5 1 1 A 64 64 ASN N N 294 117.120 116.993 0.127 1
1 743 . 5 1 1 A 65 65 LEU H H 295 7.550 7.775 -0.225 1
1 744 . 5 1 1 A 65 65 LEU HA H 295 4.640 4.552 0.088 1
1 754 . 5 1 1 A 65 65 LEU CA C 295 54.310 53.566 0.744 1
1 755 . 5 1 1 A 65 65 LEU CB C 295 43.640 42.294 1.346 1
1 758 . 5 1 1 A 65 65 LEU N N 295 119.930 118.813 1.117 1
1 759 . 5 1 1 A 66 66 GLY H H 296 7.850 8.424 -0.574 1
1 760 . 5 1 1 A 66 66 GLY HA2 H 296 3.810 4.135 -0.325 1
1 761 . 5 1 1 A 66 66 GLY HA3 H 296 4.110 4.136 -0.026 1
1 762 . 5 1 1 A 66 66 GLY CA C 296 43.570 44.307 -0.737 1
1 763 . 5 1 1 A 66 66 GLY N N 296 108.840 111.516 -2.676 1
1 764 . 5 1 1 A 67 67 LYS H H 297 8.820 8.565 0.255 1
1 765 . 5 1 1 A 67 67 LYS HA H 297 3.980 3.909 0.071 1
1 774 . 5 1 1 A 67 67 LYS CA C 297 60.100 59.459 0.641 1
1 775 . 5 1 1 A 67 67 LYS CB C 297 32.100 32.072 0.028 1
1 779 . 5 1 1 A 67 67 LYS N N 297 120.130 118.068 2.062 1
1 780 . 5 1 1 A 68 68 LYS H H 298 8.850 7.919 0.931 1
1 781 . 5 1 1 A 68 68 LYS HA H 298 4.060 4.104 -0.044 1
1 790 . 5 1 1 A 68 68 LYS CA C 298 60.600 59.236 1.364 1
1 791 . 5 1 1 A 68 68 LYS CB C 298 31.920 32.341 -0.421 1
1 795 . 5 1 1 A 68 68 LYS N N 298 119.580 119.948 -0.368 1
1 796 . 5 1 1 A 69 69 SER H H 299 8.100 8.061 0.039 1
1 797 . 5 1 1 A 69 69 SER HA H 299 4.370 4.085 0.285 1
1 800 . 5 1 1 A 69 69 SER CA C 299 61.980 62.185 -0.205 1
1 801 . 5 1 1 A 69 69 SER CB C 299 63.000 63.175 -0.175 1
1 802 . 5 1 1 A 69 69 SER N N 299 116.360 117.019 -0.659 1
1 803 . 5 1 1 A 70 70 LEU H H 300 8.240 7.989 0.251 1
1 804 . 5 1 1 A 70 70 LEU HA H 300 3.970 4.070 -0.100 1
1 814 . 5 1 1 A 70 70 LEU CA C 300 57.610 57.879 -0.269 1
1 815 . 5 1 1 A 70 70 LEU CB C 300 41.060 41.590 -0.530 1
1 819 . 5 1 1 A 70 70 LEU N N 300 123.330 122.680 0.650 1
1 820 . 5 1 1 A 71 71 THR H H 301 8.550 7.477 1.073 1
1 821 . 5 1 1 A 71 71 THR HA H 301 3.690 3.800 -0.110 1
1 826 . 5 1 1 A 71 71 THR CA C 301 67.170 66.598 0.572 1
1 827 . 5 1 1 A 71 71 THR CB C 301 68.810 68.538 0.272 1
1 829 . 5 1 1 A 71 71 THR N N 301 116.520 114.686 1.834 1
1 830 . 5 1 1 A 72 72 GLU H H 302 7.520 8.217 -0.697 1
1 831 . 5 1 1 A 72 72 GLU HA H 302 4.070 3.979 0.091 1
1 836 . 5 1 1 A 72 72 GLU CA C 302 59.470 59.556 -0.086 1
1 837 . 5 1 1 A 72 72 GLU CB C 302 29.090 29.341 -0.251 1
1 839 . 5 1 1 A 72 72 GLU N N 302 121.510 119.163 2.347 1
1 840 . 5 1 1 A 73 73 ILE H H 303 8.290 7.922 0.368 1
1 841 . 5 1 1 A 73 73 ILE HA H 303 3.380 3.599 -0.219 1
1 849 . 5 1 1 A 73 73 ILE CA C 303 66.010 65.538 0.472 1
1 850 . 5 1 1 A 73 73 ILE CB C 303 38.680 37.744 0.936 1
1 853 . 5 1 1 A 73 73 ILE N N 303 118.510 120.930 -2.420 1
1 854 . 5 1 1 A 74 74 LYS H H 304 8.550 8.058 0.492 1
1 855 . 5 1 1 A 74 74 LYS HA H 304 3.680 3.914 -0.234 1
1 864 . 5 1 1 A 74 74 LYS CA C 304 61.320 59.666 1.654 1
1 865 . 5 1 1 A 74 74 LYS CB C 304 32.060 32.270 -0.210 1
1 868 . 5 1 1 A 74 74 LYS N N 304 118.220 120.412 -2.192 1
1 869 . 5 1 1 A 75 75 ASP H H 305 8.450 8.028 0.422 1
1 870 . 5 1 1 A 75 75 ASP HA H 305 4.440 4.408 0.032 1
1 873 . 5 1 1 A 75 75 ASP CA C 305 57.690 57.133 0.557 1
1 874 . 5 1 1 A 75 75 ASP CB C 305 40.220 40.871 -0.651 1
1 875 . 5 1 1 A 75 75 ASP N N 305 121.790 119.867 1.923 1
1 876 . 5 1 1 A 76 76 VAL H H 306 8.680 7.820 0.860 1
1 877 . 5 1 1 A 76 76 VAL HA H 306 3.890 3.629 0.261 1
1 885 . 5 1 1 A 76 76 VAL CA C 306 66.020 66.319 -0.299 1
1 886 . 5 1 1 A 76 76 VAL CB C 306 31.250 31.515 -0.265 1
1 889 . 5 1 1 A 76 76 VAL N N 306 121.150 119.727 1.423 1
1 890 . 5 1 1 A 77 77 LEU H H 307 8.470 8.845 -0.375 1
1 891 . 5 1 1 A 77 77 LEU HA H 307 3.810 4.011 -0.201 1
1 901 . 5 1 1 A 77 77 LEU CA C 307 58.330 57.377 0.953 1
1 902 . 5 1 1 A 77 77 LEU CB C 307 41.250 41.072 0.178 1
1 906 . 5 1 1 A 77 77 LEU N N 307 120.830 119.936 0.894 1
1 907 . 5 1 1 A 78 78 ALA H H 308 8.280 8.458 -0.178 1
1 908 . 5 1 1 A 78 78 ALA HA H 308 4.320 4.100 0.220 1
1 912 . 5 1 1 A 78 78 ALA CA C 308 55.420 55.041 0.379 1
1 913 . 5 1 1 A 78 78 ALA CB C 308 17.750 18.197 -0.447 1
1 914 . 5 1 1 A 78 78 ALA N N 308 122.530 121.690 0.840 1
1 915 . 5 1 1 A 79 79 SER H H 309 7.900 7.766 0.134 1
1 916 . 5 1 1 A 79 79 SER HA H 309 4.340 4.285 0.055 1
1 919 . 5 1 1 A 79 79 SER CA C 309 61.350 59.992 1.358 1
1 920 . 5 1 1 A 79 79 SER CB C 309 63.280 63.639 -0.359 1
1 921 . 5 1 1 A 79 79 SER N N 309 115.600 113.169 2.431 1
1 922 . 5 1 1 A 80 80 ARG H H 310 7.450 8.067 -0.617 1
1 923 . 5 1 1 A 80 80 ARG HA H 310 4.550 4.024 0.526 1
1 931 . 5 1 1 A 80 80 ARG CA C 310 54.200 57.376 -3.176 1
1 932 . 5 1 1 A 80 80 ARG CB C 310 30.680 27.289 3.391 1
1 935 . 5 1 1 A 80 80 ARG N N 310 119.360 117.937 1.423 1
1 936 . 5 1 1 A 81 81 GLY H H 311 7.940 8.259 -0.319 1
1 937 . 5 1 1 A 81 81 GLY HA2 H 311 3.840 3.972 -0.132 1
1 938 . 5 1 1 A 81 81 GLY HA3 H 311 4.070 3.986 0.084 1
1 939 . 5 1 1 A 81 81 GLY CA C 311 46.060 45.289 0.771 1
1 940 . 5 1 1 A 81 81 GLY N N 311 108.130 106.642 1.488 1
1 941 . 5 1 1 A 82 82 LEU H H 312 7.920 7.638 0.282 1
1 942 . 5 1 1 A 82 82 LEU HA H 312 4.680 4.921 -0.241 1
1 952 . 5 1 1 A 82 82 LEU CA C 312 53.070 53.893 -0.823 1
1 953 . 5 1 1 A 82 82 LEU CB C 312 45.790 44.712 1.078 1
1 957 . 5 1 1 A 82 82 LEU N N 312 119.290 122.206 -2.916 1
1 958 . 5 1 1 A 83 83 SER H H 313 7.530 9.057 -1.527 1
1 959 . 5 1 1 A 83 83 SER HA H 313 4.450 4.149 0.301 1
1 962 . 5 1 1 A 83 83 SER CA C 313 57.190 58.997 -1.807 1
1 963 . 5 1 1 A 83 83 SER CB C 313 66.080 61.753 4.327 1
1 964 . 5 1 1 A 83 83 SER N N 313 113.120 121.595 -8.475 1
1 965 . 5 1 1 A 84 84 LEU H H 314 8.340 8.389 -0.049 1
1 966 . 5 1 1 A 84 84 LEU HA H 314 4.620 4.457 0.163 1
1 976 . 5 1 1 A 84 84 LEU CA C 314 54.720 54.533 0.187 1
1 977 . 5 1 1 A 84 84 LEU CB C 314 41.620 42.223 -0.603 1
1 981 . 5 1 1 A 84 84 LEU N N 314 115.930 120.386 -4.456 1
1 982 . 5 1 1 A 85 85 GLY H H 315 8.270 7.978 0.292 1
1 983 . 5 1 1 A 85 85 GLY HA2 H 315 3.320 3.941 -0.621 1
1 984 . 5 1 1 A 85 85 GLY HA3 H 315 3.850 3.945 -0.095 1
1 985 . 5 1 1 A 85 85 GLY CA C 315 46.560 46.801 -0.241 1
1 986 . 5 1 1 A 85 85 GLY N N 315 111.010 108.606 2.404 1
1 987 . 5 1 1 A 86 86 MET H H 316 8.650 8.213 0.437 1
1 988 . 5 1 1 A 86 86 MET HA H 316 3.990 4.787 -0.797 1
1 996 . 5 1 1 A 86 86 MET CA C 316 56.730 55.415 1.315 1
1 997 . 5 1 1 A 86 86 MET CB C 316 33.600 34.935 -1.335 1
1 1000 . 5 1 1 A 86 86 MET N N 316 120.570 118.923 1.647 1
1 1001 . 5 1 1 A 87 87 ARG H H 317 8.360 8.505 -0.145 1
1 1002 . 5 1 1 A 87 87 ARG HA H 317 4.450 5.235 -0.785 1
1 1010 . 5 1 1 A 87 87 ARG CA C 317 55.310 54.457 0.853 1
1 1011 . 5 1 1 A 87 87 ARG CB C 317 30.490 33.638 -3.148 1
1 1014 . 5 1 1 A 87 87 ARG N N 317 122.290 119.447 2.843 1
1 1015 . 5 1 1 A 88 88 LEU H H 318 8.400 8.958 -0.558 1
1 1016 . 5 1 1 A 88 88 LEU HA H 318 4.670 5.054 -0.384 1
1 1026 . 5 1 1 A 88 88 LEU CA C 318 53.110 53.197 -0.087 1
1 1027 . 5 1 1 A 88 88 LEU CB C 318 43.600 45.034 -1.434 1
1 1031 . 5 1 1 A 88 88 LEU N N 318 126.420 125.276 1.144 1
1 1032 . 5 1 1 A 89 89 GLU H H 319 8.780 9.082 -0.302 1
1 1033 . 5 1 1 A 89 89 GLU HA H 319 4.340 3.968 0.372 1
1 1038 . 5 1 1 A 89 89 GLU CA C 319 56.490 59.497 -3.007 1
1 1039 . 5 1 1 A 89 89 GLU CB C 319 30.470 29.483 0.987 1
1 1041 . 5 1 1 A 89 89 GLU N N 319 123.070 125.389 -2.319 1
1 1042 . 5 1 1 A 90 90 ASN H H 320 8.900 8.316 0.584 1
1 1043 . 5 1 1 A 90 90 ASN HA H 320 4.410 4.950 -0.540 1
1 1048 . 5 1 1 A 90 90 ASN CA C 320 54.120 54.414 -0.294 1
1 1049 . 5 1 1 A 90 90 ASN CB C 320 37.640 39.909 -2.269 1
1 1050 . 5 1 1 A 90 90 ASN N N 320 116.540 114.573 1.967 1
1 1052 . 5 1 1 A 91 91 TRP H H 321 7.990 7.411 0.579 1
1 1053 . 5 1 1 A 91 91 TRP HA H 321 4.330 4.637 -0.307 1
1 1062 . 5 1 1 A 91 91 TRP CA C 321 54.590 58.289 -3.699 1
1 1063 . 5 1 1 A 91 91 TRP CB C 321 31.280 31.092 0.188 1
1 1069 . 5 1 1 A 91 91 TRP N N 321 119.230 114.513 4.717 1
1 1071 . 5 1 1 A 92 92 PRO HA H 322 4.800 3.785 1.015 1
1 1077 . 5 1 1 A 93 93 PRO HA H 323 4.450 4.405 0.045 1
1 1084 . 5 1 1 A 93 93 PRO CA C 323 61.970 62.391 -0.421 1
1 1085 . 5 1 1 A 93 93 PRO CB C 323 32.830 32.496 0.334 1
1 1088 . 5 1 1 A 94 94 ALA H H 324 8.460 8.670 -0.210 1
1 1089 . 5 1 1 A 94 94 ALA HA H 324 4.000 3.988 0.012 1
1 1093 . 5 1 1 A 94 94 ALA CA C 324 53.790 54.793 -1.003 1
1 1094 . 5 1 1 A 94 94 ALA CB C 324 18.640 18.231 0.409 1
1 1095 . 5 1 1 A 94 94 ALA N N 324 124.010 126.093 -2.083 1
1 1096 . 5 1 1 A 95 95 SER H H 325 7.950 7.780 0.170 1
1 1097 . 5 1 1 A 95 95 SER HA H 325 4.210 4.247 -0.037 1
1 1100 . 5 1 1 A 95 95 SER CA C 325 58.970 61.470 -2.500 1
1 1101 . 5 1 1 A 95 95 SER CB C 325 63.040 62.871 0.169 1
1 1102 . 5 1 1 A 95 95 SER N N 325 111.520 113.266 -1.746 1
1 1103 . 5 1 1 A 96 96 ILE H H 326 7.480 7.948 -0.468 1
1 1104 . 5 1 1 A 96 96 ILE HA H 326 4.170 3.757 0.413 1
1 1114 . 5 1 1 A 96 96 ILE CA C 326 61.300 63.336 -2.036 1
1 1115 . 5 1 1 A 96 96 ILE CB C 326 38.530 37.530 1.000 1
1 1119 . 5 1 1 A 96 96 ILE N N 326 119.650 122.173 -2.523 1
1 1120 . 5 1 1 A 97 97 ALA H H 327 7.860 8.126 -0.266 1
1 1121 . 5 1 1 A 97 97 ALA HA H 327 4.230 4.025 0.205 1
1 1125 . 5 1 1 A 97 97 ALA CA C 327 52.570 55.119 -2.549 1
1 1126 . 5 1 1 A 97 97 ALA CB C 327 19.590 18.011 1.579 1
1 1127 . 5 1 1 A 97 97 ALA N N 327 126.480 123.832 2.648 1
1 1128 . 5 1 1 A 98 98 ASP H H 328 8.250 8.521 -0.271 1
1 1129 . 5 1 1 A 98 98 ASP HA H 328 4.540 4.289 0.251 1
1 1132 . 5 1 1 A 98 98 ASP CA C 328 54.150 57.270 -3.120 1
1 1133 . 5 1 1 A 98 98 ASP CB C 328 41.120 40.338 0.782 1
1 1134 . 5 1 1 A 98 98 ASP N N 328 120.130 119.181 0.949 1
1 1150 . 5 2 2 B 6 6 ASP H H 427 8.160 8.569 -0.409 1
1 1151 . 5 2 2 B 6 6 ASP HA H 427 4.630 4.321 0.309 1
1 1154 . 5 2 2 B 6 6 ASP CA C 427 54.410 56.962 -2.552 1
1 1155 . 5 2 2 B 6 6 ASP CB C 427 41.250 40.482 0.768 1
1 1156 . 5 2 2 B 6 6 ASP N N 427 120.160 126.371 -6.211 1
1 1157 . 5 2 2 B 7 7 ASN H H 428 8.350 7.990 0.360 1
1 1158 . 5 2 2 B 7 7 ASN HA H 428 4.550 4.290 0.260 1
1 1163 . 5 2 2 B 7 7 ASN CA C 428 53.310 54.552 -1.242 1
1 1164 . 5 2 2 B 7 7 ASN CB C 428 38.850 36.770 2.080 1
1 1165 . 5 2 2 B 7 7 ASN N N 428 118.440 114.803 3.637 1
1 1167 . 5 2 2 B 8 8 LYS H H 429 8.030 7.929 0.101 1
1 1172 . 5 2 2 B 8 8 LYS CB C 429 33.280 33.100 0.180 1
1 1174 . 5 2 2 B 8 8 LYS N N 429 120.260 119.019 1.241 1
1 1175 . 5 2 2 B 9 9 PRO HA H 430 4.420 4.332 0.088 1
1 1182 . 5 2 2 B 9 9 PRO CA C 430 62.280 62.446 -0.166 1
1 1183 . 5 2 2 B 9 9 PRO CB C 430 31.920 32.089 -0.169 1
1 1186 . 5 2 2 B 10 10 ALA H H 431 8.930 8.256 0.674 1
1 1187 . 5 2 2 B 10 10 ALA HA H 431 4.350 4.429 -0.079 1
1 1191 . 5 2 2 B 10 10 ALA CA C 431 51.070 52.328 -1.258 1
1 1192 . 5 2 2 B 10 10 ALA CB C 431 20.920 19.371 1.549 1
1 1193 . 5 2 2 B 10 10 ALA N N 431 125.000 124.707 0.293 1
1 1194 . 5 2 2 B 11 11 ASP H H 432 8.530 9.178 -0.648 1
1 1195 . 5 2 2 B 11 11 ASP HA H 432 4.220 4.208 0.012 1
1 1198 . 5 2 2 B 11 11 ASP CA C 432 57.520 57.604 -0.084 1
1 1199 . 5 2 2 B 11 11 ASP CB C 432 40.470 40.305 0.165 1
1 1200 . 5 2 2 B 11 11 ASP N N 432 119.610 122.557 -2.947 1
1 1201 . 5 2 2 B 12 12 ASP H H 433 8.340 7.961 0.379 1
1 1202 . 5 2 2 B 12 12 ASP HA H 433 4.160 4.436 -0.276 1
1 1205 . 5 2 2 B 12 12 ASP CA C 433 56.090 57.392 -1.302 1
1 1206 . 5 2 2 B 12 12 ASP CB C 433 38.960 40.741 -1.781 1
1 1207 . 5 2 2 B 12 12 ASP N N 433 116.330 119.740 -3.410 1
1 1208 . 5 2 2 B 13 13 LEU H H 434 7.360 7.706 -0.346 1
1 1209 . 5 2 2 B 13 13 LEU HA H 434 4.050 4.062 -0.012 1
1 1219 . 5 2 2 B 13 13 LEU CA C 434 57.340 57.777 -0.437 1
1 1220 . 5 2 2 B 13 13 LEU CB C 434 42.960 41.650 1.310 1
1 1224 . 5 2 2 B 13 13 LEU N N 434 123.440 120.902 2.538 1
1 1225 . 5 2 2 B 14 14 LEU H H 435 7.670 8.332 -0.662 1
1 1226 . 5 2 2 B 14 14 LEU HA H 435 3.710 3.930 -0.220 1
1 1236 . 5 2 2 B 14 14 LEU CA C 435 57.170 57.870 -0.700 1
1 1237 . 5 2 2 B 14 14 LEU CB C 435 42.590 40.968 1.622 1
1 1241 . 5 2 2 B 14 14 LEU N N 435 115.170 119.617 -4.447 1
1 1242 . 5 2 2 B 15 15 ASN H H 436 7.490 7.811 -0.321 1
1 1243 . 5 2 2 B 15 15 ASN HA H 436 4.640 4.846 -0.206 1
1 1248 . 5 2 2 B 15 15 ASN CA C 436 52.920 53.264 -0.344 1
1 1249 . 5 2 2 B 15 15 ASN CB C 436 39.350 39.107 0.243 1
1 1250 . 5 2 2 B 15 15 ASN N N 436 112.280 115.021 -2.741 1
1 1252 . 5 2 2 B 16 16 LEU H H 437 7.300 7.152 0.148 1
1 1253 . 5 2 2 B 16 16 LEU HA H 437 4.100 4.237 -0.137 1
1 1263 . 5 2 2 B 16 16 LEU CA C 437 55.310 55.238 0.072 1
1 1264 . 5 2 2 B 16 16 LEU CB C 437 41.800 43.048 -1.248 1
1 1268 . 5 2 2 B 16 16 LEU N N 437 125.180 122.919 2.261 1
1 1269 . 5 2 2 B 17 17 GLU H H 438 8.590 8.787 -0.197 1
1 1270 . 5 2 2 B 17 17 GLU HA H 438 3.920 4.049 -0.129 1
1 1275 . 5 2 2 B 17 17 GLU CA C 438 58.440 57.968 0.472 1
1 1276 . 5 2 2 B 17 17 GLU CB C 438 29.180 29.784 -0.604 1
1 1278 . 5 2 2 B 17 17 GLU N N 438 129.850 125.792 4.058 1
1 1279 . 5 2 2 B 18 18 GLY H H 439 8.580 8.888 -0.308 1
1 1280 . 5 2 2 B 18 18 GLY HA2 H 439 3.570 3.954 -0.384 1
1 1281 . 5 2 2 B 18 18 GLY HA3 H 439 4.220 3.954 0.266 1
1 1282 . 5 2 2 B 18 18 GLY CA C 439 44.710 45.195 -0.485 1
1 1283 . 5 2 2 B 18 18 GLY N N 439 112.250 115.021 -2.771 1
1 1284 . 5 2 2 B 19 19 VAL H H 440 7.900 7.310 0.590 1
1 1285 . 5 2 2 B 19 19 VAL HA H 440 3.950 4.484 -0.534 1
1 1293 . 5 2 2 B 19 19 VAL CA C 440 62.820 60.886 1.934 1
1 1294 . 5 2 2 B 19 19 VAL CB C 440 31.470 34.488 -3.018 1
1 1297 . 5 2 2 B 19 19 VAL N N 440 121.910 121.814 0.096 1
1 1298 . 5 2 2 B 20 20 ASP H H 441 7.390 8.854 -1.464 1
1 1299 . 5 2 2 B 20 20 ASP HA H 441 4.820 4.838 -0.018 1
1 1302 . 5 2 2 B 20 20 ASP CA C 441 51.920 53.519 -1.599 1
1 1303 . 5 2 2 B 20 20 ASP CB C 441 42.090 41.673 0.417 1
1 1304 . 5 2 2 B 20 20 ASP N N 441 124.850 125.799 -0.949 1
1 1305 . 5 2 2 B 21 21 ARG H H 442 8.630 8.854 -0.224 1
1 1306 . 5 2 2 B 21 21 ARG HA H 442 3.810 3.892 -0.082 1
1 1313 . 5 2 2 B 21 21 ARG CA C 442 60.710 59.879 0.831 1
1 1314 . 5 2 2 B 21 21 ARG CB C 442 30.020 30.092 -0.072 1
1 1317 . 5 2 2 B 21 21 ARG N N 442 120.890 122.876 -1.986 1
1 1318 . 5 2 2 B 22 22 ASP H H 443 8.140 8.228 -0.088 1
1 1319 . 5 2 2 B 22 22 ASP HA H 443 4.420 4.705 -0.285 1
1 1322 . 5 2 2 B 22 22 ASP CA C 443 57.680 57.494 0.186 1
1 1323 . 5 2 2 B 22 22 ASP CB C 443 40.880 40.553 0.327 1
1 1324 . 5 2 2 B 22 22 ASP N N 443 116.750 120.479 -3.729 1
1 1325 . 5 2 2 B 23 23 LEU H H 444 8.170 8.163 0.007 1
1 1326 . 5 2 2 B 23 23 LEU HA H 444 4.130 4.124 0.006 1
1 1336 . 5 2 2 B 23 23 LEU CA C 444 57.770 57.943 -0.173 1
1 1337 . 5 2 2 B 23 23 LEU CB C 444 41.230 40.851 0.379 1
1 1341 . 5 2 2 B 23 23 LEU N N 444 122.130 121.314 0.816 1
1 1342 . 5 2 2 B 24 24 ALA H H 445 8.630 8.559 0.071 1
1 1343 . 5 2 2 B 24 24 ALA HA H 445 3.790 3.985 -0.195 1
1 1347 . 5 2 2 B 24 24 ALA CA C 445 55.810 54.973 0.837 1
1 1348 . 5 2 2 B 24 24 ALA CB C 445 18.060 18.354 -0.294 1
1 1349 . 5 2 2 B 24 24 ALA N N 445 120.890 122.540 -1.650 1
1 1350 . 5 2 2 B 25 25 PHE H H 446 8.160 7.694 0.466 1
1 1351 . 5 2 2 B 25 25 PHE HA H 446 4.080 4.380 -0.300 1
1 1358 . 5 2 2 B 25 25 PHE CA C 446 62.670 61.553 1.117 1
1 1359 . 5 2 2 B 25 25 PHE CB C 446 39.440 38.390 1.050 1
1 1364 . 5 2 2 B 25 25 PHE N N 446 115.360 115.205 0.155 1
1 1365 . 5 2 2 B 26 26 LYS H H 447 8.040 8.189 -0.149 1
1 1366 . 5 2 2 B 26 26 LYS HA H 447 4.110 4.123 -0.013 1
1 1375 . 5 2 2 B 26 26 LYS CA C 447 60.140 59.724 0.416 1
1 1376 . 5 2 2 B 26 26 LYS CB C 447 32.880 32.199 0.681 1
1 1380 . 5 2 2 B 26 26 LYS N N 447 123.110 120.466 2.644 1
1 1381 . 5 2 2 B 27 27 LEU H H 448 8.630 8.279 0.351 1
1 1382 . 5 2 2 B 27 27 LEU HA H 448 3.840 4.057 -0.217 1
1 1392 . 5 2 2 B 27 27 LEU CA C 448 58.210 57.672 0.538 1
1 1393 . 5 2 2 B 27 27 LEU CB C 448 39.760 41.147 -1.387 1
1 1396 . 5 2 2 B 27 27 LEU N N 448 120.890 119.495 1.395 1
1 1397 . 5 2 2 B 28 28 ALA H H 449 8.200 8.140 0.060 1
1 1398 . 5 2 2 B 28 28 ALA HA H 449 3.760 4.484 -0.724 1
1 1402 . 5 2 2 B 28 28 ALA CA C 449 54.750 55.339 -0.589 1
1 1403 . 5 2 2 B 28 28 ALA CB C 449 18.050 18.201 -0.151 1
1 1404 . 5 2 2 B 28 28 ALA N N 449 123.710 121.884 1.826 1
1 1405 . 5 2 2 B 29 29 ALA H H 450 7.780 7.727 0.053 1
1 1406 . 5 2 2 B 29 29 ALA HA H 450 4.170 4.051 0.119 1
1 1410 . 5 2 2 B 29 29 ALA CA C 450 54.430 55.070 -0.640 1
1 1411 . 5 2 2 B 29 29 ALA CB C 450 18.040 18.713 -0.673 1
1 1412 . 5 2 2 B 29 29 ALA N N 450 121.020 119.038 1.982 1
1 1413 . 5 2 2 B 30 30 ARG H H 451 7.390 7.615 -0.225 1
1 1414 . 5 2 2 B 30 30 ARG HA H 451 4.540 4.403 0.137 1
1 1421 . 5 2 2 B 30 30 ARG CA C 451 54.510 55.685 -1.175 1
1 1422 . 5 2 2 B 30 30 ARG CB C 451 29.950 29.631 0.319 1
1 1425 . 5 2 2 B 30 30 ARG N N 451 115.480 115.940 -0.460 1
1 1426 . 5 2 2 B 31 31 GLY H H 452 7.950 9.117 -1.167 1
1 1427 . 5 2 2 B 31 31 GLY HA2 H 452 3.550 3.990 -0.440 1
1 1428 . 5 2 2 B 31 31 GLY HA3 H 452 4.200 3.993 0.207 1
1 1429 . 5 2 2 B 31 31 GLY CA C 452 45.380 45.435 -0.055 1
1 1430 . 5 2 2 B 31 31 GLY N N 452 107.740 107.383 0.357 1
1 1431 . 5 2 2 B 32 32 VAL H H 453 7.990 7.621 0.369 1
1 1432 . 5 2 2 B 32 32 VAL HA H 453 3.930 4.026 -0.096 1
1 1440 . 5 2 2 B 32 32 VAL CA C 453 61.420 63.009 -1.589 1
1 1441 . 5 2 2 B 32 32 VAL CB C 453 29.860 31.330 -1.470 1
1 1444 . 5 2 2 B 32 32 VAL N N 453 125.560 121.080 4.480 1
1 1445 . 5 2 2 B 33 33 CYS H H 454 8.460 8.612 -0.152 1
1 1446 . 5 2 2 B 33 33 CYS HA H 454 4.310 4.618 -0.308 1
1 1449 . 5 2 2 B 33 33 CYS CA C 454 60.260 59.406 0.854 1
1 1450 . 5 2 2 B 33 33 CYS CB C 454 30.330 29.494 0.836 1
1 1451 . 5 2 2 B 33 33 CYS N N 454 119.460 123.727 -4.267 1
1 1452 . 5 2 2 B 34 34 THR H H 455 8.080 7.245 0.835 1
1 1453 . 5 2 2 B 34 34 THR HA H 455 4.840 4.315 0.525 1
1 1458 . 5 2 2 B 34 34 THR CA C 455 58.650 62.683 -4.033 1
1 1459 . 5 2 2 B 34 34 THR CB C 455 72.680 69.966 2.714 1
1 1461 . 5 2 2 B 34 34 THR N N 455 108.420 114.567 -6.147 1
1 1462 . 5 2 2 B 35 35 LEU H H 456 8.580 8.698 -0.118 1
1 1463 . 5 2 2 B 35 35 LEU HA H 456 3.790 3.966 -0.176 1
1 1473 . 5 2 2 B 35 35 LEU CA C 456 57.980 58.675 -0.695 1
1 1474 . 5 2 2 B 35 35 LEU CB C 456 42.220 41.518 0.702 1
1 1477 . 5 2 2 B 35 35 LEU N N 456 120.370 127.506 -7.136 1
1 1478 . 5 2 2 B 36 36 GLU H H 457 8.390 8.294 0.096 1
1 1479 . 5 2 2 B 36 36 GLU HA H 457 3.820 3.789 0.031 1
1 1484 . 5 2 2 B 36 36 GLU CA C 457 59.640 60.038 -0.398 1
1 1485 . 5 2 2 B 36 36 GLU CB C 457 28.780 29.312 -0.532 1
1 1487 . 5 2 2 B 36 36 GLU N N 457 119.450 118.714 0.736 1
1 1488 . 5 2 2 B 37 37 ASP H H 458 7.750 7.827 -0.077 1
1 1489 . 5 2 2 B 37 37 ASP HA H 458 4.140 4.373 -0.233 1
1 1492 . 5 2 2 B 37 37 ASP CA C 458 57.150 57.328 -0.178 1
1 1493 . 5 2 2 B 37 37 ASP CB C 458 42.280 40.540 1.740 1
1 1494 . 5 2 2 B 37 37 ASP N N 458 117.430 120.427 -2.997 1
1 1495 . 5 2 2 B 38 38 LEU H H 459 7.700 7.920 -0.220 1
1 1496 . 5 2 2 B 38 38 LEU HA H 459 3.790 4.138 -0.348 1
1 1506 . 5 2 2 B 38 38 LEU CA C 459 58.080 57.850 0.230 1
1 1507 . 5 2 2 B 38 38 LEU CB C 459 41.130 41.326 -0.196 1
1 1511 . 5 2 2 B 38 38 LEU N N 459 121.280 122.001 -0.721 1
1 1512 . 5 2 2 B 39 39 ALA H H 460 8.190 8.261 -0.071 1
1 1513 . 5 2 2 B 39 39 ALA HA H 460 3.640 3.956 -0.316 1
1 1517 . 5 2 2 B 39 39 ALA CA C 460 54.320 55.208 -0.888 1
1 1518 . 5 2 2 B 39 39 ALA CB C 460 17.140 18.099 -0.959 1
1 1519 . 5 2 2 B 39 39 ALA N N 460 119.400 119.921 -0.521 1
1 1520 . 5 2 2 B 40 40 GLU H H 461 7.340 7.840 -0.500 1
1 1521 . 5 2 2 B 40 40 GLU HA H 461 4.180 4.254 -0.074 1
1 1526 . 5 2 2 B 40 40 GLU CA C 461 57.800 58.588 -0.788 1
1 1527 . 5 2 2 B 40 40 GLU CB C 461 30.600 29.673 0.927 1
1 1529 . 5 2 2 B 40 40 GLU N N 461 110.680 115.777 -5.097 1
1 1530 . 5 2 2 B 41 41 GLN H H 462 7.940 7.643 0.297 1
1 1531 . 5 2 2 B 41 41 GLN HA H 462 4.100 4.414 -0.314 1
1 1538 . 5 2 2 B 41 41 GLN CA C 462 55.310 56.027 -0.717 1
1 1539 . 5 2 2 B 41 41 GLN CB C 462 28.780 29.368 -0.588 1
1 1541 . 5 2 2 B 41 41 GLN N N 462 120.720 117.606 3.114 1
1 1543 . 5 2 2 B 42 42 GLY H H 463 9.000 8.465 0.535 1
1 1544 . 5 2 2 B 42 42 GLY HA2 H 463 3.310 4.129 -0.819 1
1 1545 . 5 2 2 B 42 42 GLY HA3 H 463 4.820 4.130 0.690 1
1 1546 . 5 2 2 B 42 42 GLY CA C 463 42.650 44.442 -1.792 1
1 1547 . 5 2 2 B 42 42 GLY N N 463 104.110 109.894 -5.784 1
1 1548 . 5 2 2 B 43 43 ILE H H 464 7.900 8.764 -0.864 1
1 1549 . 5 2 2 B 43 43 ILE HA H 464 3.260 3.708 -0.448 1
1 1558 . 5 2 2 B 43 43 ILE CA C 464 66.570 64.593 1.977 1
1 1559 . 5 2 2 B 43 43 ILE CB C 464 38.770 37.594 1.176 1
1 1562 . 5 2 2 B 43 43 ILE N N 464 119.410 120.611 -1.201 1
1 1563 . 5 2 2 B 44 44 ASP H H 465 8.730 8.151 0.579 1
1 1564 . 5 2 2 B 44 44 ASP HA H 465 4.310 4.345 -0.035 1
1 1567 . 5 2 2 B 44 44 ASP CA C 465 56.740 57.795 -1.055 1
1 1568 . 5 2 2 B 44 44 ASP CB C 465 40.120 41.971 -1.851 1
1 1569 . 5 2 2 B 44 44 ASP N N 465 116.610 121.564 -4.954 1
1 1570 . 5 2 2 B 45 45 ASP H H 466 7.720 8.455 -0.735 1
1 1571 . 5 2 2 B 45 45 ASP HA H 466 4.480 4.450 0.030 1
1 1574 . 5 2 2 B 45 45 ASP CA C 466 57.000 57.081 -0.081 1
1 1575 . 5 2 2 B 45 45 ASP CB C 466 42.270 40.662 1.608 1
1 1576 . 5 2 2 B 45 45 ASP N N 466 117.560 117.923 -0.363 1
1 1577 . 5 2 2 B 46 46 LEU H H 467 7.370 7.789 -0.419 1
1 1578 . 5 2 2 B 46 46 LEU HA H 467 4.410 4.155 0.255 1
1 1587 . 5 2 2 B 46 46 LEU CA C 467 53.660 57.203 -3.543 1
1 1588 . 5 2 2 B 46 46 LEU CB C 467 42.260 41.532 0.728 1
1 1591 . 5 2 2 B 46 46 LEU N N 467 116.890 119.910 -3.020 1
1 1592 . 5 2 2 B 47 47 ALA H H 468 7.080 8.354 -1.274 1
1 1593 . 5 2 2 B 47 47 ALA HA H 468 4.120 4.049 0.071 1
1 1597 . 5 2 2 B 47 47 ALA CA C 468 54.130 54.771 -0.641 1
1 1598 . 5 2 2 B 47 47 ALA CB C 468 19.480 18.488 0.992 1
1 1599 . 5 2 2 B 47 47 ALA N N 468 120.150 122.648 -2.498 1
1 1600 . 5 2 2 B 48 48 ASP H H 469 8.560 8.176 0.384 1
1 1601 . 5 2 2 B 48 48 ASP HA H 469 4.410 4.461 -0.051 1
1 1604 . 5 2 2 B 48 48 ASP CA C 469 54.330 57.587 -3.257 1
1 1605 . 5 2 2 B 48 48 ASP CB C 469 39.760 40.584 -0.824 1
1 1606 . 5 2 2 B 48 48 ASP N N 469 114.660 116.497 -1.837 1
1 1607 . 5 2 2 B 49 49 ILE H H 470 7.870 8.006 -0.136 1
1 1608 . 5 2 2 B 49 49 ILE HA H 470 3.850 4.324 -0.474 1
1 1618 . 5 2 2 B 49 49 ILE CA C 470 61.680 60.872 0.808 1
1 1619 . 5 2 2 B 49 49 ILE CB C 470 37.120 38.661 -1.541 1
1 1623 . 5 2 2 B 49 49 ILE N N 470 121.600 119.981 1.619 1
1 1624 . 5 2 2 B 50 50 GLU H H 471 8.680 8.990 -0.310 1
1 1625 . 5 2 2 B 50 50 GLU HA H 471 3.940 3.978 -0.038 1
1 1630 . 5 2 2 B 50 50 GLU CA C 471 58.360 59.926 -1.566 1
1 1631 . 5 2 2 B 50 50 GLU CB C 471 29.530 29.293 0.237 1
1 1633 . 5 2 2 B 50 50 GLU N N 471 131.000 129.045 1.955 1
1 1634 . 5 2 2 B 51 51 GLY H H 472 8.860 8.200 0.660 1
1 1635 . 5 2 2 B 51 51 GLY HA2 H 472 3.640 3.993 -0.353 1
1 1636 . 5 2 2 B 51 51 GLY HA3 H 472 4.230 3.996 0.234 1
1 1637 . 5 2 2 B 51 51 GLY CA C 472 45.190 47.200 -2.010 1
1 1638 . 5 2 2 B 51 51 GLY N N 472 113.580 107.001 6.579 1
1 1639 . 5 2 2 B 52 52 LEU H H 473 7.850 7.933 -0.083 1
1 1640 . 5 2 2 B 52 52 LEU HA H 473 4.680 4.918 -0.238 1
1 1650 . 5 2 2 B 52 52 LEU CA C 473 53.640 53.521 0.119 1
1 1651 . 5 2 2 B 52 52 LEU CB C 473 42.990 43.644 -0.654 1
1 1655 . 5 2 2 B 52 52 LEU N N 473 123.020 119.762 3.258 1
1 1656 . 5 2 2 B 53 53 THR H H 474 7.550 8.899 -1.349 1
1 1657 . 5 2 2 B 53 53 THR HA H 474 4.560 4.798 -0.238 1
1 1662 . 5 2 2 B 53 53 THR CA C 474 60.060 60.886 -0.826 1
1 1663 . 5 2 2 B 53 53 THR CB C 474 71.520 71.113 0.407 1
1 1665 . 5 2 2 B 53 53 THR N N 474 115.070 118.674 -3.604 1
1 1666 . 5 2 2 B 54 54 ASP H H 475 8.900 9.022 -0.122 1
1 1667 . 5 2 2 B 54 54 ASP HA H 475 4.220 4.293 -0.073 1
1 1670 . 5 2 2 B 54 54 ASP CA C 475 57.520 58.019 -0.499 1
1 1671 . 5 2 2 B 54 54 ASP CB C 475 39.560 40.279 -0.719 1
1 1672 . 5 2 2 B 54 54 ASP N N 475 121.800 123.800 -2.000 1
1 1673 . 5 2 2 B 55 55 GLU H H 476 8.460 8.043 0.417 1
1 1674 . 5 2 2 B 55 55 GLU HA H 476 3.970 4.026 -0.056 1
1 1679 . 5 2 2 B 55 55 GLU CA C 476 59.440 59.115 0.325 1
1 1680 . 5 2 2 B 55 55 GLU CB C 476 29.650 29.470 0.180 1
1 1682 . 5 2 2 B 55 55 GLU N N 476 119.460 119.379 0.081 1
1 1683 . 5 2 2 B 56 56 LYS H H 477 7.790 8.068 -0.278 1
1 1684 . 5 2 2 B 56 56 LYS HA H 477 4.120 4.088 0.032 1
1 1693 . 5 2 2 B 56 56 LYS CA C 477 58.890 59.370 -0.480 1
1 1694 . 5 2 2 B 56 56 LYS CB C 477 32.600 32.206 0.394 1
1 1698 . 5 2 2 B 56 56 LYS N N 477 121.840 119.802 2.038 1
1 1699 . 5 2 2 B 57 57 ALA H H 478 8.900 8.978 -0.078 1
1 1700 . 5 2 2 B 57 57 ALA HA H 478 3.790 4.054 -0.264 1
1 1704 . 5 2 2 B 57 57 ALA CA C 478 55.810 54.905 0.905 1
1 1705 . 5 2 2 B 57 57 ALA CB C 478 18.590 18.573 0.017 1
1 1706 . 5 2 2 B 57 57 ALA N N 478 121.350 121.435 -0.085 1
1 1707 . 5 2 2 B 58 58 GLY H H 479 8.300 8.063 0.237 1
1 1708 . 5 2 2 B 58 58 GLY HA2 H 479 3.500 3.783 -0.283 1
1 1709 . 5 2 2 B 58 58 GLY HA3 H 479 3.890 3.783 0.107 1
1 1710 . 5 2 2 B 58 58 GLY CA C 479 47.360 47.209 0.151 1
1 1711 . 5 2 2 B 58 58 GLY N N 479 102.040 105.338 -3.298 1
1 1712 . 5 2 2 B 59 59 ALA H H 480 7.580 7.857 -0.277 1
1 1713 . 5 2 2 B 59 59 ALA HA H 480 4.110 4.018 0.092 1
1 1717 . 5 2 2 B 59 59 ALA CA C 480 55.580 54.609 0.971 1
1 1718 . 5 2 2 B 59 59 ALA CB C 480 18.130 18.692 -0.562 1
1 1719 . 5 2 2 B 59 59 ALA N N 480 123.180 125.334 -2.154 1
1 1720 . 5 2 2 B 60 60 LEU H H 481 8.290 8.053 0.237 1
1 1721 . 5 2 2 B 60 60 LEU HA H 481 4.020 4.019 0.001 1
1 1731 . 5 2 2 B 60 60 LEU CA C 481 57.850 57.740 0.110 1
1 1732 . 5 2 2 B 60 60 LEU CB C 481 42.360 41.182 1.178 1
1 1736 . 5 2 2 B 60 60 LEU N N 481 120.560 118.578 1.982 1
1 1737 . 5 2 2 B 61 61 ILE H H 482 8.080 7.964 0.116 1
1 1738 . 5 2 2 B 61 61 ILE HA H 482 3.210 3.516 -0.306 1
1 1748 . 5 2 2 B 61 61 ILE CA C 482 66.250 65.086 1.164 1
1 1749 . 5 2 2 B 61 61 ILE CB C 482 39.400 38.250 1.150 1
1 1753 . 5 2 2 B 61 61 ILE N N 482 119.170 120.844 -1.674 1
1 1754 . 5 2 2 B 62 62 MET H H 483 8.110 8.256 -0.146 1
1 1755 . 5 2 2 B 62 62 MET HA H 483 4.410 4.116 0.294 1
1 1763 . 5 2 2 B 62 62 MET CA C 483 56.110 58.671 -2.561 1
1 1764 . 5 2 2 B 62 62 MET CB C 483 28.260 32.437 -4.177 1
1 1767 . 5 2 2 B 62 62 MET N N 483 114.420 118.093 -3.673 1
1 1768 . 5 2 2 B 63 63 ALA H H 484 8.240 7.861 0.379 1
1 1769 . 5 2 2 B 63 63 ALA HA H 484 4.130 4.108 0.022 1
1 1773 . 5 2 2 B 63 63 ALA CA C 484 55.300 55.054 0.246 1
1 1774 . 5 2 2 B 63 63 ALA CB C 484 18.280 18.257 0.023 1
1 1775 . 5 2 2 B 63 63 ALA N N 484 123.710 121.418 2.292 1
1 1776 . 5 2 2 B 64 64 ALA H H 485 8.050 8.180 -0.130 1
1 1777 . 5 2 2 B 64 64 ALA HA H 485 3.870 4.028 -0.158 1
1 1781 . 5 2 2 B 64 64 ALA CA C 485 55.330 55.204 0.126 1
1 1782 . 5 2 2 B 64 64 ALA CB C 485 17.660 18.064 -0.404 1
1 1783 . 5 2 2 B 64 64 ALA N N 485 120.070 119.791 0.279 1
1 1784 . 5 2 2 B 65 65 ARG H H 486 8.640 8.563 0.077 1
1 1785 . 5 2 2 B 65 65 ARG HA H 486 2.800 4.121 -1.321 1
1 1792 . 5 2 2 B 65 65 ARG CA C 486 60.600 59.387 1.213 1
1 1793 . 5 2 2 B 65 65 ARG CB C 486 29.910 29.948 -0.038 1
1 1796 . 5 2 2 B 65 65 ARG N N 486 118.730 118.569 0.161 1
1 1797 . 5 2 2 B 66 66 ASN H H 487 8.710 8.373 0.337 1
1 1798 . 5 2 2 B 66 66 ASN HA H 487 4.550 3.932 0.618 1
1 1803 . 5 2 2 B 66 66 ASN CA C 487 56.390 56.084 0.306 1
1 1804 . 5 2 2 B 66 66 ASN CB C 487 37.970 38.140 -0.170 1
1 1805 . 5 2 2 B 66 66 ASN N N 487 119.170 117.785 1.385 1
1 1807 . 5 2 2 B 67 67 ILE H H 488 7.250 7.730 -0.480 1
1 1808 . 5 2 2 B 67 67 ILE HA H 488 3.810 3.748 0.062 1
1 1818 . 5 2 2 B 67 67 ILE CA C 488 64.350 64.804 -0.454 1
1 1819 . 5 2 2 B 67 67 ILE CB C 488 39.570 37.452 2.118 1
1 1823 . 5 2 2 B 67 67 ILE N N 488 117.890 120.003 -2.113 1
1 1824 . 5 2 2 B 68 68 CYS H H 489 8.350 8.288 0.062 1
1 1825 . 5 2 2 B 68 68 CYS HA H 489 4.080 4.057 0.023 1
1 1828 . 5 2 2 B 68 68 CYS CA C 489 62.670 63.351 -0.681 1
1 1829 . 5 2 2 B 68 68 CYS CB C 489 28.170 28.112 0.058 1
1 1830 . 5 2 2 B 68 68 CYS N N 489 115.230 119.017 -3.787 1
1 1831 . 5 2 2 B 69 69 TRP H H 490 8.230 8.361 -0.131 1
1 1832 . 5 2 2 B 69 69 TRP HA H 490 5.100 4.255 0.845 1
1 1841 . 5 2 2 B 69 69 TRP CA C 490 55.420 60.337 -4.917 1
1 1842 . 5 2 2 B 69 69 TRP CB C 490 31.010 29.212 1.798 1
1 1844 . 5 2 2 B 69 69 TRP N N 490 116.850 120.765 -3.915 1
1 1846 . 5 2 2 B 70 70 PHE H H 491 7.570 7.985 -0.415 1
1 1847 . 5 2 2 B 70 70 PHE HA H 491 5.240 4.730 0.510 1
1 1852 . 5 2 2 B 70 70 PHE CA C 491 55.490 58.195 -2.705 1
1 1853 . 5 2 2 B 70 70 PHE CB C 491 38.700 39.142 -0.442 1
1 1856 . 5 2 2 B 70 70 PHE N N 491 117.460 116.631 0.829 1
1 1857 . 5 2 2 B 71 71 GLY H H 492 8.420 8.284 0.136 1
1 1858 . 5 2 2 B 71 71 GLY HA2 H 492 3.920 3.831 0.089 1
1 1859 . 5 2 2 B 71 71 GLY HA3 H 492 4.080 3.870 0.210 1
1 1860 . 5 2 2 B 71 71 GLY CA C 492 46.210 47.152 -0.942 1
1 1861 . 5 2 2 B 71 71 GLY N N 492 110.040 108.880 1.160 1
1 1862 . 5 2 2 B 72 72 ASP H H 493 8.370 7.964 0.406 1
1 1863 . 5 2 2 B 72 72 ASP HA H 493 4.630 4.393 0.237 1
1 1866 . 5 2 2 B 72 72 ASP CA C 493 54.410 56.733 -2.323 1
1 1867 . 5 2 2 B 72 72 ASP CB C 493 41.250 40.474 0.776 1
1 1868 . 5 2 2 B 72 72 ASP N N 493 120.000 120.089 -0.089 1
1 1869 . 5 2 2 B 73 73 GLU H H 494 8.230 7.753 0.477 1
1 1870 . 5 2 2 B 73 73 GLU HA H 494 4.260 4.477 -0.217 1
1 1875 . 5 2 2 B 73 73 GLU CA C 494 56.510 56.162 0.348 1
1 1876 . 5 2 2 B 73 73 GLU CB C 494 30.420 30.649 -0.229 1
1 1878 . 5 2 2 B 73 73 GLU N N 494 120.900 118.118 2.782 1
1 216 . 6 1 1 A 20 20 ASP H H 250 8.550 8.632 -0.082 1
1 217 . 6 1 1 A 20 20 ASP HA H 250 4.700 4.719 -0.019 1
1 220 . 6 1 1 A 20 20 ASP CA C 250 52.650 52.623 0.027 1
1 221 . 6 1 1 A 20 20 ASP CB C 250 41.420 40.343 1.077 1
1 222 . 6 1 1 A 20 20 ASP N N 250 125.190 121.918 3.272 1
1 223 . 6 1 1 A 21 21 PRO HA H 251 4.250 4.411 -0.161 1
1 230 . 6 1 1 A 21 21 PRO CA C 251 65.120 64.622 0.498 1
1 231 . 6 1 1 A 21 21 PRO CB C 251 32.310 32.153 0.157 1
1 234 . 6 1 1 A 22 22 ILE H H 252 8.630 7.791 0.839 1
1 235 . 6 1 1 A 22 22 ILE HA H 252 4.060 3.954 0.106 1
1 245 . 6 1 1 A 22 22 ILE CA C 252 62.990 63.027 -0.037 1
1 246 . 6 1 1 A 22 22 ILE CB C 252 37.520 37.539 -0.019 1
1 250 . 6 1 1 A 22 22 ILE N N 252 119.860 117.146 2.714 1
1 251 . 6 1 1 A 23 23 LEU H H 253 7.950 7.833 0.117 1
1 252 . 6 1 1 A 23 23 LEU HA H 253 3.710 4.141 -0.431 1
1 262 . 6 1 1 A 23 23 LEU CA C 253 56.510 57.926 -1.416 1
1 263 . 6 1 1 A 23 23 LEU CB C 253 41.190 41.826 -0.636 1
1 266 . 6 1 1 A 23 23 LEU N N 253 116.850 121.124 -4.274 1
1 267 . 6 1 1 A 24 24 LEU H H 254 7.370 7.991 -0.621 1
1 268 . 6 1 1 A 24 24 LEU HA H 254 4.310 4.613 -0.303 1
1 278 . 6 1 1 A 24 24 LEU CA C 254 54.890 57.235 -2.345 1
1 279 . 6 1 1 A 24 24 LEU CB C 254 41.960 42.305 -0.345 1
1 283 . 6 1 1 A 24 24 LEU N N 254 115.210 119.313 -4.103 1
1 284 . 6 1 1 A 25 25 ARG H H 255 7.520 7.306 0.214 1
1 285 . 6 1 1 A 25 25 ARG HA H 255 4.660 4.294 0.366 1
1 293 . 6 1 1 A 25 25 ARG CA C 255 52.840 54.206 -1.366 1
1 294 . 6 1 1 A 25 25 ARG CB C 255 28.130 29.785 -1.655 1
1 297 . 6 1 1 A 25 25 ARG N N 255 118.180 118.631 -0.451 1
1 298 . 6 1 1 A 26 26 PRO HA H 256 4.800 4.680 0.120 1
1 305 . 6 1 1 A 26 26 PRO CA C 256 61.790 62.664 -0.874 1
1 306 . 6 1 1 A 26 26 PRO CB C 256 32.660 31.961 0.699 1
1 309 . 6 1 1 A 27 27 VAL H H 257 8.170 8.319 -0.149 1
1 310 . 6 1 1 A 27 27 VAL HA H 257 3.590 3.729 -0.139 1
1 318 . 6 1 1 A 27 27 VAL CA C 257 64.830 65.699 -0.869 1
1 319 . 6 1 1 A 27 27 VAL CB C 257 31.720 31.435 0.285 1
1 322 . 6 1 1 A 27 27 VAL N N 257 115.710 124.393 -8.683 1
1 323 . 6 1 1 A 28 28 ASP H H 258 8.240 7.992 0.248 1
1 324 . 6 1 1 A 28 28 ASP HA H 258 4.340 4.378 -0.038 1
1 327 . 6 1 1 A 28 28 ASP CA C 258 56.490 57.495 -1.005 1
1 328 . 6 1 1 A 28 28 ASP CB C 258 40.520 40.086 0.434 1
1 329 . 6 1 1 A 28 28 ASP N N 258 119.000 121.962 -2.962 1
1 330 . 6 1 1 A 29 29 ASP H H 259 8.000 8.826 -0.826 1
1 331 . 6 1 1 A 29 29 ASP HA H 259 4.390 4.585 -0.195 1
1 334 . 6 1 1 A 29 29 ASP CA C 259 56.210 55.950 0.260 1
1 335 . 6 1 1 A 29 29 ASP CB C 259 40.670 40.907 -0.237 1
1 336 . 6 1 1 A 29 29 ASP N N 259 118.900 117.533 1.367 1
1 337 . 6 1 1 A 30 30 LEU H H 260 7.760 7.471 0.289 1
1 338 . 6 1 1 A 30 30 LEU HA H 260 3.990 4.199 -0.209 1
1 348 . 6 1 1 A 30 30 LEU CA C 260 55.000 55.495 -0.495 1
1 349 . 6 1 1 A 30 30 LEU CB C 260 41.670 42.097 -0.427 1
1 353 . 6 1 1 A 30 30 LEU N N 260 116.300 121.328 -5.028 1
1 354 . 6 1 1 A 31 31 GLU H H 261 7.990 8.768 -0.778 1
1 355 . 6 1 1 A 31 31 GLU HA H 261 4.280 4.127 0.153 1
1 358 . 6 1 1 A 31 31 GLU CA C 261 56.860 58.636 -1.776 1
1 359 . 6 1 1 A 31 31 GLU CB C 261 27.010 29.579 -2.569 1
1 360 . 6 1 1 A 31 31 GLU N N 261 115.620 122.629 -7.009 1
1 361 . 6 1 1 A 32 32 LEU H H 262 8.000 7.334 0.666 1
1 362 . 6 1 1 A 32 32 LEU HA H 262 4.400 4.327 0.073 1
1 372 . 6 1 1 A 32 32 LEU CA C 262 53.860 54.719 -0.859 1
1 373 . 6 1 1 A 32 32 LEU CB C 262 44.450 42.294 2.156 1
1 377 . 6 1 1 A 32 32 LEU N N 262 118.860 122.050 -3.190 1
1 378 . 6 1 1 A 33 33 THR H H 263 10.020 8.520 1.500 1
1 379 . 6 1 1 A 33 33 THR HA H 263 4.130 4.525 -0.395 1
1 384 . 6 1 1 A 33 33 THR CA C 263 62.400 61.102 1.298 1
1 385 . 6 1 1 A 33 33 THR CB C 263 71.270 71.076 0.194 1
1 387 . 6 1 1 A 33 33 THR N N 263 114.610 114.158 0.452 1
1 388 . 6 1 1 A 34 34 VAL H H 264 8.370 8.726 -0.356 1
1 389 . 6 1 1 A 34 34 VAL HA H 264 3.620 3.658 -0.038 1
1 397 . 6 1 1 A 34 34 VAL CA C 264 66.340 66.489 -0.149 1
1 398 . 6 1 1 A 34 34 VAL CB C 264 31.670 31.600 0.070 1
1 401 . 6 1 1 A 34 34 VAL N N 264 122.110 122.137 -0.027 1
1 402 . 6 1 1 A 35 35 ARG H H 265 8.190 8.246 -0.056 1
1 403 . 6 1 1 A 35 35 ARG HA H 265 4.070 3.990 0.080 1
1 411 . 6 1 1 A 35 35 ARG CA C 265 59.470 59.938 -0.468 1
1 412 . 6 1 1 A 35 35 ARG CB C 265 29.790 29.894 -0.104 1
1 415 . 6 1 1 A 35 35 ARG N N 265 117.340 119.872 -2.532 1
1 416 . 6 1 1 A 36 36 SER H H 266 7.610 7.752 -0.142 1
1 417 . 6 1 1 A 36 36 SER HA H 266 4.080 4.128 -0.048 1
1 420 . 6 1 1 A 36 36 SER CA C 266 63.080 61.881 1.199 1
1 421 . 6 1 1 A 36 36 SER CB C 266 63.280 62.809 0.471 1
1 422 . 6 1 1 A 36 36 SER N N 266 116.710 116.639 0.071 1
1 423 . 6 1 1 A 37 37 ALA H H 267 8.720 7.529 1.191 1
1 424 . 6 1 1 A 37 37 ALA HA H 267 3.760 4.019 -0.259 1
1 428 . 6 1 1 A 37 37 ALA CA C 267 55.900 55.313 0.587 1
1 429 . 6 1 1 A 37 37 ALA CB C 267 18.090 17.805 0.285 1
1 430 . 6 1 1 A 37 37 ALA N N 267 124.170 123.607 0.563 1
1 431 . 6 1 1 A 38 38 ASN H H 268 8.850 9.079 -0.229 1
1 432 . 6 1 1 A 38 38 ASN HA H 268 4.420 4.505 -0.085 1
1 437 . 6 1 1 A 38 38 ASN CA C 268 55.700 56.262 -0.562 1
1 438 . 6 1 1 A 38 38 ASN CB C 268 37.180 37.751 -0.571 1
1 439 . 6 1 1 A 38 38 ASN N N 268 117.370 117.609 -0.239 1
1 441 . 6 1 1 A 39 39 CYS H H 269 7.970 8.052 -0.082 1
1 442 . 6 1 1 A 39 39 CYS HA H 269 4.190 4.113 0.077 1
1 445 . 6 1 1 A 39 39 CYS CA C 269 63.340 62.968 0.372 1
1 446 . 6 1 1 A 39 39 CYS CB C 269 26.870 27.238 -0.368 1
1 447 . 6 1 1 A 39 39 CYS N N 269 120.510 118.934 1.576 1
1 448 . 6 1 1 A 40 40 LEU H H 270 7.600 7.735 -0.135 1
1 449 . 6 1 1 A 40 40 LEU HA H 270 3.880 3.918 -0.038 1
1 458 . 6 1 1 A 40 40 LEU CA C 270 57.810 58.009 -0.199 1
1 459 . 6 1 1 A 40 40 LEU CB C 270 40.030 41.401 -1.371 1
1 462 . 6 1 1 A 40 40 LEU N N 270 117.710 120.425 -2.715 1
1 463 . 6 1 1 A 41 41 LYS H H 271 7.980 8.561 -0.581 1
1 464 . 6 1 1 A 41 41 LYS HA H 271 3.820 4.441 -0.621 1
1 472 . 6 1 1 A 41 41 LYS CA C 271 59.840 59.095 0.745 1
1 473 . 6 1 1 A 41 41 LYS CB C 271 32.070 32.112 -0.042 1
1 476 . 6 1 1 A 41 41 LYS N N 271 120.070 120.521 -0.451 1
1 477 . 6 1 1 A 42 42 ALA H H 272 7.860 8.473 -0.613 1
1 478 . 6 1 1 A 42 42 ALA HA H 272 4.140 4.128 0.012 1
1 482 . 6 1 1 A 42 42 ALA CA C 272 54.670 54.447 0.223 1
1 483 . 6 1 1 A 42 42 ALA CB C 272 17.950 18.381 -0.431 1
1 484 . 6 1 1 A 42 42 ALA N N 272 122.880 121.538 1.342 1
1 485 . 6 1 1 A 43 43 GLU H H 273 7.210 8.150 -0.940 1
1 486 . 6 1 1 A 43 43 GLU HA H 273 4.260 4.441 -0.181 1
1 491 . 6 1 1 A 43 43 GLU CA C 273 55.020 55.916 -0.896 1
1 492 . 6 1 1 A 43 43 GLU CB C 273 29.880 29.552 0.328 1
1 494 . 6 1 1 A 43 43 GLU N N 273 116.590 115.724 0.866 1
1 495 . 6 1 1 A 44 44 ALA H H 274 7.880 8.205 -0.325 1
1 496 . 6 1 1 A 44 44 ALA HA H 274 3.680 3.925 -0.245 1
1 500 . 6 1 1 A 44 44 ALA CA C 274 52.960 53.192 -0.232 1
1 501 . 6 1 1 A 44 44 ALA CB C 274 16.110 17.189 -1.079 1
1 502 . 6 1 1 A 44 44 ALA N N 274 118.420 118.718 -0.298 1
1 503 . 6 1 1 A 45 45 ILE H H 275 7.600 7.229 0.371 1
1 504 . 6 1 1 A 45 45 ILE HA H 275 3.870 4.602 -0.732 1
1 514 . 6 1 1 A 45 45 ILE CA C 275 61.150 60.369 0.781 1
1 515 . 6 1 1 A 45 45 ILE CB C 275 37.090 40.350 -3.260 1
1 519 . 6 1 1 A 45 45 ILE N N 275 120.370 118.323 2.047 1
1 520 . 6 1 1 A 46 46 HIS H H 276 8.350 8.799 -0.449 1
1 521 . 6 1 1 A 46 46 HIS HA H 276 4.600 4.965 -0.365 1
1 526 . 6 1 1 A 46 46 HIS CA C 276 56.900 55.684 1.216 1
1 527 . 6 1 1 A 46 46 HIS CB C 276 31.910 31.424 0.486 1
1 529 . 6 1 1 A 46 46 HIS N N 276 123.250 121.436 1.814 1
1 530 . 6 1 1 A 47 47 TYR H H 277 8.850 7.395 1.455 1
1 531 . 6 1 1 A 47 47 TYR HA H 277 5.100 4.622 0.478 1
1 538 . 6 1 1 A 47 47 TYR CA C 277 57.430 56.569 0.861 1
1 539 . 6 1 1 A 47 47 TYR CB C 277 40.680 40.022 0.658 1
1 544 . 6 1 1 A 47 47 TYR N N 277 119.700 117.895 1.805 1
1 545 . 6 1 1 A 48 48 ILE H H 278 9.380 8.399 0.981 1
1 546 . 6 1 1 A 48 48 ILE HA H 278 3.340 3.588 -0.248 1
1 554 . 6 1 1 A 48 48 ILE CA C 278 67.640 64.879 2.761 1
1 555 . 6 1 1 A 48 48 ILE CB C 278 36.310 37.269 -0.959 1
1 558 . 6 1 1 A 48 48 ILE N N 278 125.650 124.721 0.929 1
1 559 . 6 1 1 A 49 49 GLY H H 279 9.430 8.317 1.113 1
1 560 . 6 1 1 A 49 49 GLY HA2 H 279 2.370 2.531 -0.161 1
1 561 . 6 1 1 A 49 49 GLY HA3 H 279 3.230 3.615 -0.385 1
1 562 . 6 1 1 A 49 49 GLY CA C 279 46.820 46.921 -0.101 1
1 563 . 6 1 1 A 49 49 GLY N N 279 105.200 108.766 -3.566 1
1 564 . 6 1 1 A 50 50 ASP H H 280 7.050 7.366 -0.316 1
1 565 . 6 1 1 A 50 50 ASP HA H 280 4.360 4.142 0.218 1
1 568 . 6 1 1 A 50 50 ASP CA C 280 57.110 56.255 0.855 1
1 569 . 6 1 1 A 50 50 ASP CB C 280 42.620 40.563 2.057 1
1 570 . 6 1 1 A 50 50 ASP N N 280 116.360 121.044 -4.684 1
1 571 . 6 1 1 A 51 51 LEU H H 281 7.170 8.392 -1.222 1
1 572 . 6 1 1 A 51 51 LEU HA H 281 3.880 3.986 -0.106 1
1 582 . 6 1 1 A 51 51 LEU CA C 281 57.900 58.325 -0.425 1
1 583 . 6 1 1 A 51 51 LEU CB C 281 41.870 41.569 0.301 1
1 587 . 6 1 1 A 51 51 LEU N N 281 120.130 121.700 -1.570 1
1 588 . 6 1 1 A 52 52 VAL H H 282 7.820 7.634 0.186 1
1 589 . 6 1 1 A 52 52 VAL HA H 282 3.980 3.863 0.117 1
1 597 . 6 1 1 A 52 52 VAL CA C 282 64.000 65.557 -1.557 1
1 598 . 6 1 1 A 52 52 VAL CB C 282 30.400 31.331 -0.931 1
1 601 . 6 1 1 A 52 52 VAL N N 282 105.550 115.576 -10.026 1
1 602 . 6 1 1 A 53 53 GLN H H 283 6.550 7.788 -1.238 1
1 603 . 6 1 1 A 53 53 GLN HA H 283 4.680 4.072 0.608 1
1 610 . 6 1 1 A 53 53 GLN CA C 283 56.210 58.830 -2.620 1
1 611 . 6 1 1 A 53 53 GLN CB C 283 31.710 28.531 3.179 1
1 613 . 6 1 1 A 53 53 GLN N N 283 114.060 121.401 -7.341 1
1 615 . 6 1 1 A 54 54 ARG H H 284 7.690 7.562 0.128 1
1 616 . 6 1 1 A 54 54 ARG HA H 284 4.520 4.685 -0.165 1
1 624 . 6 1 1 A 54 54 ARG CA C 284 54.600 54.578 0.022 1
1 625 . 6 1 1 A 54 54 ARG CB C 284 30.750 31.784 -1.034 1
1 628 . 6 1 1 A 54 54 ARG N N 284 119.810 118.666 1.144 1
1 629 . 6 1 1 A 55 55 THR H H 285 8.110 8.735 -0.625 1
1 630 . 6 1 1 A 55 55 THR HA H 285 4.430 4.372 0.058 1
1 635 . 6 1 1 A 55 55 THR CA C 285 59.640 63.292 -3.652 1
1 636 . 6 1 1 A 55 55 THR CB C 285 71.310 69.346 1.964 1
1 638 . 6 1 1 A 55 55 THR N N 285 108.450 118.567 -10.117 1
1 639 . 6 1 1 A 56 56 GLU H H 286 8.910 8.918 -0.008 1
1 640 . 6 1 1 A 56 56 GLU HA H 286 3.660 3.945 -0.285 1
1 645 . 6 1 1 A 56 56 GLU CA C 286 60.650 59.607 1.043 1
1 646 . 6 1 1 A 56 56 GLU CB C 286 29.400 29.184 0.216 1
1 648 . 6 1 1 A 56 56 GLU N N 286 120.600 126.033 -5.433 1
1 649 . 6 1 1 A 57 57 VAL H H 287 7.600 8.074 -0.474 1
1 650 . 6 1 1 A 57 57 VAL HA H 287 3.620 3.523 0.097 1
1 658 . 6 1 1 A 57 57 VAL CA C 287 66.020 67.182 -1.162 1
1 659 . 6 1 1 A 57 57 VAL CB C 287 31.720 31.527 0.193 1
1 662 . 6 1 1 A 57 57 VAL N N 287 114.050 119.830 -5.780 1
1 663 . 6 1 1 A 58 58 GLU H H 288 7.350 8.297 -0.947 1
1 664 . 6 1 1 A 58 58 GLU HA H 288 3.830 3.960 -0.130 1
1 669 . 6 1 1 A 58 58 GLU CA C 288 59.250 59.396 -0.146 1
1 670 . 6 1 1 A 58 58 GLU CB C 288 30.030 29.138 0.892 1
1 672 . 6 1 1 A 58 58 GLU N N 288 117.610 119.013 -1.403 1
1 673 . 6 1 1 A 59 59 LEU H H 289 7.850 7.548 0.302 1
1 674 . 6 1 1 A 59 59 LEU HA H 289 4.150 4.094 0.056 1
1 683 . 6 1 1 A 59 59 LEU CA C 289 57.340 57.816 -0.476 1
1 684 . 6 1 1 A 59 59 LEU CB C 289 41.170 41.735 -0.565 1
1 687 . 6 1 1 A 59 59 LEU N N 289 120.050 122.193 -2.143 1
1 688 . 6 1 1 A 60 60 LEU H H 290 7.670 8.050 -0.380 1
1 689 . 6 1 1 A 60 60 LEU HA H 290 4.540 4.055 0.485 1
1 696 . 6 1 1 A 60 60 LEU CA C 290 55.090 56.858 -1.768 1
1 697 . 6 1 1 A 60 60 LEU CB C 290 42.320 41.635 0.685 1
1 701 . 6 1 1 A 60 60 LEU N N 290 114.980 118.597 -3.617 1
1 702 . 6 1 1 A 61 61 LYS H H 291 7.440 7.414 0.026 1
1 703 . 6 1 1 A 61 61 LYS HA H 291 4.280 4.282 -0.002 1
1 710 . 6 1 1 A 61 61 LYS CA C 291 56.860 57.598 -0.738 1
1 711 . 6 1 1 A 61 61 LYS CB C 291 31.900 32.857 -0.957 1
1 714 . 6 1 1 A 61 61 LYS N N 291 118.120 116.820 1.300 1
1 715 . 6 1 1 A 62 62 THR H H 292 7.310 7.368 -0.058 1
1 716 . 6 1 1 A 62 62 THR HA H 292 5.220 4.432 0.788 1
1 721 . 6 1 1 A 62 62 THR CA C 292 55.830 60.779 -4.949 1
1 722 . 6 1 1 A 62 62 THR CB C 292 69.970 69.009 0.961 1
1 724 . 6 1 1 A 62 62 THR N N 292 111.890 115.232 -3.342 1
1 725 . 6 1 1 A 63 63 PRO HA H 293 4.570 4.490 0.080 1
1 730 . 6 1 1 A 63 63 PRO CA C 293 63.710 64.253 -0.543 1
1 731 . 6 1 1 A 63 63 PRO CB C 293 32.380 31.847 0.533 1
1 733 . 6 1 1 A 64 64 ASN H H 294 8.050 8.858 -0.808 1
1 734 . 6 1 1 A 64 64 ASN HA H 294 4.490 4.495 -0.005 1
1 739 . 6 1 1 A 64 64 ASN CA C 294 55.630 55.114 0.516 1
1 740 . 6 1 1 A 64 64 ASN CB C 294 38.730 38.061 0.669 1
1 741 . 6 1 1 A 64 64 ASN N N 294 117.120 116.990 0.130 1
1 743 . 6 1 1 A 65 65 LEU H H 295 7.550 7.404 0.146 1
1 744 . 6 1 1 A 65 65 LEU HA H 295 4.640 4.558 0.082 1
1 754 . 6 1 1 A 65 65 LEU CA C 295 54.310 53.390 0.920 1
1 755 . 6 1 1 A 65 65 LEU CB C 295 43.640 42.988 0.652 1
1 758 . 6 1 1 A 65 65 LEU N N 295 119.930 118.867 1.063 1
1 759 . 6 1 1 A 66 66 GLY H H 296 7.850 8.626 -0.776 1
1 760 . 6 1 1 A 66 66 GLY HA2 H 296 3.810 4.071 -0.261 1
1 761 . 6 1 1 A 66 66 GLY HA3 H 296 4.110 4.071 0.039 1
1 762 . 6 1 1 A 66 66 GLY CA C 296 43.570 44.999 -1.429 1
1 763 . 6 1 1 A 66 66 GLY N N 296 108.840 109.823 -0.983 1
1 764 . 6 1 1 A 67 67 LYS H H 297 8.820 8.657 0.163 1
1 765 . 6 1 1 A 67 67 LYS HA H 297 3.980 3.878 0.102 1
1 774 . 6 1 1 A 67 67 LYS CA C 297 60.100 59.476 0.624 1
1 775 . 6 1 1 A 67 67 LYS CB C 297 32.100 32.077 0.023 1
1 779 . 6 1 1 A 67 67 LYS N N 297 120.130 119.878 0.252 1
1 780 . 6 1 1 A 68 68 LYS H H 298 8.850 7.914 0.936 1
1 781 . 6 1 1 A 68 68 LYS HA H 298 4.060 4.089 -0.029 1
1 790 . 6 1 1 A 68 68 LYS CA C 298 60.600 59.159 1.441 1
1 791 . 6 1 1 A 68 68 LYS CB C 298 31.920 32.329 -0.409 1
1 795 . 6 1 1 A 68 68 LYS N N 298 119.580 120.015 -0.435 1
1 796 . 6 1 1 A 69 69 SER H H 299 8.100 8.027 0.073 1
1 797 . 6 1 1 A 69 69 SER HA H 299 4.370 4.106 0.264 1
1 800 . 6 1 1 A 69 69 SER CA C 299 61.980 62.285 -0.305 1
1 801 . 6 1 1 A 69 69 SER CB C 299 63.000 63.195 -0.195 1
1 802 . 6 1 1 A 69 69 SER N N 299 116.360 116.939 -0.579 1
1 803 . 6 1 1 A 70 70 LEU H H 300 8.240 8.435 -0.195 1
1 804 . 6 1 1 A 70 70 LEU HA H 300 3.970 3.987 -0.017 1
1 814 . 6 1 1 A 70 70 LEU CA C 300 57.610 58.065 -0.455 1
1 815 . 6 1 1 A 70 70 LEU CB C 300 41.060 41.609 -0.549 1
1 819 . 6 1 1 A 70 70 LEU N N 300 123.330 120.985 2.345 1
1 820 . 6 1 1 A 71 71 THR H H 301 8.550 7.571 0.979 1
1 821 . 6 1 1 A 71 71 THR HA H 301 3.690 3.817 -0.127 1
1 826 . 6 1 1 A 71 71 THR CA C 301 67.170 66.788 0.382 1
1 827 . 6 1 1 A 71 71 THR CB C 301 68.810 68.588 0.222 1
1 829 . 6 1 1 A 71 71 THR N N 301 116.520 115.274 1.246 1
1 830 . 6 1 1 A 72 72 GLU H H 302 7.520 8.142 -0.622 1
1 831 . 6 1 1 A 72 72 GLU HA H 302 4.070 3.980 0.090 1
1 836 . 6 1 1 A 72 72 GLU CA C 302 59.470 59.464 0.006 1
1 837 . 6 1 1 A 72 72 GLU CB C 302 29.090 29.430 -0.340 1
1 839 . 6 1 1 A 72 72 GLU N N 302 121.510 118.934 2.576 1
1 840 . 6 1 1 A 73 73 ILE H H 303 8.290 7.975 0.315 1
1 841 . 6 1 1 A 73 73 ILE HA H 303 3.380 3.579 -0.199 1
1 849 . 6 1 1 A 73 73 ILE CA C 303 66.010 65.351 0.659 1
1 850 . 6 1 1 A 73 73 ILE CB C 303 38.680 37.914 0.766 1
1 853 . 6 1 1 A 73 73 ILE N N 303 118.510 121.006 -2.496 1
1 854 . 6 1 1 A 74 74 LYS H H 304 8.550 8.122 0.428 1
1 855 . 6 1 1 A 74 74 LYS HA H 304 3.680 3.847 -0.167 1
1 864 . 6 1 1 A 74 74 LYS CA C 304 61.320 59.902 1.418 1
1 865 . 6 1 1 A 74 74 LYS CB C 304 32.060 32.141 -0.081 1
1 868 . 6 1 1 A 74 74 LYS N N 304 118.220 120.917 -2.697 1
1 869 . 6 1 1 A 75 75 ASP H H 305 8.450 7.915 0.535 1
1 870 . 6 1 1 A 75 75 ASP HA H 305 4.440 4.329 0.111 1
1 873 . 6 1 1 A 75 75 ASP CA C 305 57.690 57.646 0.044 1
1 874 . 6 1 1 A 75 75 ASP CB C 305 40.220 41.493 -1.273 1
1 875 . 6 1 1 A 75 75 ASP N N 305 121.790 119.707 2.083 1
1 876 . 6 1 1 A 76 76 VAL H H 306 8.680 7.980 0.700 1
1 877 . 6 1 1 A 76 76 VAL HA H 306 3.890 3.612 0.278 1
1 885 . 6 1 1 A 76 76 VAL CA C 306 66.020 66.591 -0.571 1
1 886 . 6 1 1 A 76 76 VAL CB C 306 31.250 31.189 0.061 1
1 889 . 6 1 1 A 76 76 VAL N N 306 121.150 118.980 2.170 1
1 890 . 6 1 1 A 77 77 LEU H H 307 8.470 8.261 0.209 1
1 891 . 6 1 1 A 77 77 LEU HA H 307 3.810 4.028 -0.218 1
1 901 . 6 1 1 A 77 77 LEU CA C 307 58.330 57.452 0.878 1
1 902 . 6 1 1 A 77 77 LEU CB C 307 41.250 41.154 0.096 1
1 906 . 6 1 1 A 77 77 LEU N N 307 120.830 119.949 0.881 1
1 907 . 6 1 1 A 78 78 ALA H H 308 8.280 8.335 -0.055 1
1 908 . 6 1 1 A 78 78 ALA HA H 308 4.320 4.093 0.227 1
1 912 . 6 1 1 A 78 78 ALA CA C 308 55.420 55.134 0.286 1
1 913 . 6 1 1 A 78 78 ALA CB C 308 17.750 17.928 -0.178 1
1 914 . 6 1 1 A 78 78 ALA N N 308 122.530 123.303 -0.773 1
1 915 . 6 1 1 A 79 79 SER H H 309 7.900 7.907 -0.007 1
1 916 . 6 1 1 A 79 79 SER HA H 309 4.340 4.183 0.157 1
1 919 . 6 1 1 A 79 79 SER CA C 309 61.350 60.740 0.610 1
1 920 . 6 1 1 A 79 79 SER CB C 309 63.280 63.567 -0.287 1
1 921 . 6 1 1 A 79 79 SER N N 309 115.600 113.712 1.888 1
1 922 . 6 1 1 A 80 80 ARG H H 310 7.450 8.258 -0.808 1
1 923 . 6 1 1 A 80 80 ARG HA H 310 4.550 3.970 0.580 1
1 931 . 6 1 1 A 80 80 ARG CA C 310 54.200 57.462 -3.262 1
1 932 . 6 1 1 A 80 80 ARG CB C 310 30.680 29.914 0.766 1
1 935 . 6 1 1 A 80 80 ARG N N 310 119.360 119.943 -0.583 1
1 936 . 6 1 1 A 81 81 GLY H H 311 7.940 8.263 -0.323 1
1 937 . 6 1 1 A 81 81 GLY HA2 H 311 3.840 3.929 -0.089 1
1 938 . 6 1 1 A 81 81 GLY HA3 H 311 4.070 3.948 0.122 1
1 939 . 6 1 1 A 81 81 GLY CA C 311 46.060 45.210 0.850 1
1 940 . 6 1 1 A 81 81 GLY N N 311 108.130 106.624 1.506 1
1 941 . 6 1 1 A 82 82 LEU H H 312 7.920 7.417 0.503 1
1 942 . 6 1 1 A 82 82 LEU HA H 312 4.680 4.771 -0.091 1
1 952 . 6 1 1 A 82 82 LEU CA C 312 53.070 52.647 0.423 1
1 953 . 6 1 1 A 82 82 LEU CB C 312 45.790 45.467 0.323 1
1 957 . 6 1 1 A 82 82 LEU N N 312 119.290 117.720 1.570 1
1 958 . 6 1 1 A 83 83 SER H H 313 7.530 8.980 -1.450 1
1 959 . 6 1 1 A 83 83 SER HA H 313 4.450 4.075 0.375 1
1 962 . 6 1 1 A 83 83 SER CA C 313 57.190 58.873 -1.683 1
1 963 . 6 1 1 A 83 83 SER CB C 313 66.080 61.490 4.590 1
1 964 . 6 1 1 A 83 83 SER N N 313 113.120 114.639 -1.519 1
1 965 . 6 1 1 A 84 84 LEU H H 314 8.340 8.416 -0.076 1
1 966 . 6 1 1 A 84 84 LEU HA H 314 4.620 4.382 0.238 1
1 976 . 6 1 1 A 84 84 LEU CA C 314 54.720 54.746 -0.026 1
1 977 . 6 1 1 A 84 84 LEU CB C 314 41.620 42.206 -0.586 1
1 981 . 6 1 1 A 84 84 LEU N N 314 115.930 119.977 -4.047 1
1 982 . 6 1 1 A 85 85 GLY H H 315 8.270 8.063 0.207 1
1 983 . 6 1 1 A 85 85 GLY HA2 H 315 3.320 3.958 -0.638 1
1 984 . 6 1 1 A 85 85 GLY HA3 H 315 3.850 3.962 -0.112 1
1 985 . 6 1 1 A 85 85 GLY CA C 315 46.560 46.306 0.254 1
1 986 . 6 1 1 A 85 85 GLY N N 315 111.010 107.830 3.180 1
1 987 . 6 1 1 A 86 86 MET H H 316 8.650 7.872 0.778 1
1 988 . 6 1 1 A 86 86 MET HA H 316 3.990 5.076 -1.086 1
1 996 . 6 1 1 A 86 86 MET CA C 316 56.730 53.208 3.522 1
1 997 . 6 1 1 A 86 86 MET CB C 316 33.600 35.426 -1.826 1
1 1000 . 6 1 1 A 86 86 MET N N 316 120.570 116.918 3.652 1
1 1001 . 6 1 1 A 87 87 ARG H H 317 8.360 8.946 -0.586 1
1 1002 . 6 1 1 A 87 87 ARG HA H 317 4.450 5.273 -0.823 1
1 1010 . 6 1 1 A 87 87 ARG CA C 317 55.310 54.609 0.701 1
1 1011 . 6 1 1 A 87 87 ARG CB C 317 30.490 33.833 -3.343 1
1 1014 . 6 1 1 A 87 87 ARG N N 317 122.290 119.315 2.975 1
1 1015 . 6 1 1 A 88 88 LEU H H 318 8.400 8.866 -0.466 1
1 1016 . 6 1 1 A 88 88 LEU HA H 318 4.670 5.059 -0.389 1
1 1026 . 6 1 1 A 88 88 LEU CA C 318 53.110 53.181 -0.071 1
1 1027 . 6 1 1 A 88 88 LEU CB C 318 43.600 44.820 -1.220 1
1 1031 . 6 1 1 A 88 88 LEU N N 318 126.420 123.965 2.455 1
1 1032 . 6 1 1 A 89 89 GLU H H 319 8.780 9.100 -0.320 1
1 1033 . 6 1 1 A 89 89 GLU HA H 319 4.340 3.973 0.367 1
1 1038 . 6 1 1 A 89 89 GLU CA C 319 56.490 59.469 -2.979 1
1 1039 . 6 1 1 A 89 89 GLU CB C 319 30.470 29.407 1.063 1
1 1041 . 6 1 1 A 89 89 GLU N N 319 123.070 124.409 -1.339 1
1 1042 . 6 1 1 A 90 90 ASN H H 320 8.900 8.529 0.371 1
1 1043 . 6 1 1 A 90 90 ASN HA H 320 4.410 5.132 -0.722 1
1 1048 . 6 1 1 A 90 90 ASN CA C 320 54.120 55.056 -0.936 1
1 1049 . 6 1 1 A 90 90 ASN CB C 320 37.640 40.978 -3.338 1
1 1050 . 6 1 1 A 90 90 ASN N N 320 116.540 116.234 0.306 1
1 1052 . 6 1 1 A 91 91 TRP H H 321 7.990 7.344 0.646 1
1 1053 . 6 1 1 A 91 91 TRP HA H 321 4.330 4.719 -0.389 1
1 1062 . 6 1 1 A 91 91 TRP CA C 321 54.590 58.360 -3.770 1
1 1063 . 6 1 1 A 91 91 TRP CB C 321 31.280 31.176 0.104 1
1 1069 . 6 1 1 A 91 91 TRP N N 321 119.230 118.452 0.778 1
1 1071 . 6 1 1 A 92 92 PRO HA H 322 4.800 3.841 0.959 1
1 1077 . 6 1 1 A 93 93 PRO HA H 323 4.450 4.256 0.194 1
1 1084 . 6 1 1 A 93 93 PRO CA C 323 61.970 62.105 -0.135 1
1 1085 . 6 1 1 A 93 93 PRO CB C 323 32.830 32.011 0.819 1
1 1088 . 6 1 1 A 94 94 ALA H H 324 8.460 8.554 -0.094 1
1 1089 . 6 1 1 A 94 94 ALA HA H 324 4.000 3.962 0.038 1
1 1093 . 6 1 1 A 94 94 ALA CA C 324 53.790 54.686 -0.896 1
1 1094 . 6 1 1 A 94 94 ALA CB C 324 18.640 18.194 0.446 1
1 1095 . 6 1 1 A 94 94 ALA N N 324 124.010 125.999 -1.989 1
1 1096 . 6 1 1 A 95 95 SER H H 325 7.950 7.929 0.021 1
1 1097 . 6 1 1 A 95 95 SER HA H 325 4.210 4.180 0.030 1
1 1100 . 6 1 1 A 95 95 SER CA C 325 58.970 61.957 -2.987 1
1 1101 . 6 1 1 A 95 95 SER CB C 325 63.040 63.129 -0.089 1
1 1102 . 6 1 1 A 95 95 SER N N 325 111.520 115.056 -3.536 1
1 1103 . 6 1 1 A 96 96 ILE H H 326 7.480 7.697 -0.217 1
1 1104 . 6 1 1 A 96 96 ILE HA H 326 4.170 3.846 0.324 1
1 1114 . 6 1 1 A 96 96 ILE CA C 326 61.300 63.163 -1.863 1
1 1115 . 6 1 1 A 96 96 ILE CB C 326 38.530 37.628 0.902 1
1 1119 . 6 1 1 A 96 96 ILE N N 326 119.650 121.820 -2.170 1
1 1120 . 6 1 1 A 97 97 ALA H H 327 7.860 7.325 0.535 1
1 1121 . 6 1 1 A 97 97 ALA HA H 327 4.230 4.140 0.090 1
1 1125 . 6 1 1 A 97 97 ALA CA C 327 52.570 52.285 0.285 1
1 1126 . 6 1 1 A 97 97 ALA CB C 327 19.590 19.641 -0.051 1
1 1127 . 6 1 1 A 97 97 ALA N N 327 126.480 124.546 1.934 1
1 1128 . 6 1 1 A 98 98 ASP H H 328 8.250 8.916 -0.666 1
1 1129 . 6 1 1 A 98 98 ASP HA H 328 4.540 4.258 0.282 1
1 1132 . 6 1 1 A 98 98 ASP CA C 328 54.150 57.783 -3.633 1
1 1133 . 6 1 1 A 98 98 ASP CB C 328 41.120 40.477 0.643 1
1 1134 . 6 1 1 A 98 98 ASP N N 328 120.130 123.251 -3.121 1
1 1150 . 6 2 2 B 6 6 ASP H H 427 8.160 8.749 -0.589 1
1 1151 . 6 2 2 B 6 6 ASP HA H 427 4.630 4.232 0.398 1
1 1154 . 6 2 2 B 6 6 ASP CA C 427 54.410 56.996 -2.586 1
1 1155 . 6 2 2 B 6 6 ASP CB C 427 41.250 40.585 0.665 1
1 1156 . 6 2 2 B 6 6 ASP N N 427 120.160 120.172 -0.012 1
1 1157 . 6 2 2 B 7 7 ASN H H 428 8.350 7.662 0.688 1
1 1158 . 6 2 2 B 7 7 ASN HA H 428 4.550 4.865 -0.315 1
1 1163 . 6 2 2 B 7 7 ASN CA C 428 53.310 53.709 -0.399 1
1 1164 . 6 2 2 B 7 7 ASN CB C 428 38.850 38.882 -0.032 1
1 1165 . 6 2 2 B 7 7 ASN N N 428 118.440 115.110 3.330 1
1 1167 . 6 2 2 B 8 8 LYS H H 429 8.030 7.687 0.343 1
1 1172 . 6 2 2 B 8 8 LYS CB C 429 33.280 33.311 -0.031 1
1 1174 . 6 2 2 B 8 8 LYS N N 429 120.260 122.494 -2.234 1
1 1175 . 6 2 2 B 9 9 PRO HA H 430 4.420 4.550 -0.130 1
1 1182 . 6 2 2 B 9 9 PRO CA C 430 62.280 62.658 -0.378 1
1 1183 . 6 2 2 B 9 9 PRO CB C 430 31.920 32.309 -0.389 1
1 1186 . 6 2 2 B 10 10 ALA H H 431 8.930 9.108 -0.178 1
1 1187 . 6 2 2 B 10 10 ALA HA H 431 4.350 4.436 -0.086 1
1 1191 . 6 2 2 B 10 10 ALA CA C 431 51.070 52.054 -0.984 1
1 1192 . 6 2 2 B 10 10 ALA CB C 431 20.920 19.814 1.106 1
1 1193 . 6 2 2 B 10 10 ALA N N 431 125.000 124.948 0.052 1
1 1194 . 6 2 2 B 11 11 ASP H H 432 8.530 9.264 -0.734 1
1 1195 . 6 2 2 B 11 11 ASP HA H 432 4.220 4.290 -0.070 1
1 1198 . 6 2 2 B 11 11 ASP CA C 432 57.520 57.630 -0.110 1
1 1199 . 6 2 2 B 11 11 ASP CB C 432 40.470 40.295 0.175 1
1 1200 . 6 2 2 B 11 11 ASP N N 432 119.610 121.803 -2.193 1
1 1201 . 6 2 2 B 12 12 ASP H H 433 8.340 7.981 0.359 1
1 1202 . 6 2 2 B 12 12 ASP HA H 433 4.160 4.405 -0.245 1
1 1205 . 6 2 2 B 12 12 ASP CA C 433 56.090 57.407 -1.317 1
1 1206 . 6 2 2 B 12 12 ASP CB C 433 38.960 40.999 -2.039 1
1 1207 . 6 2 2 B 12 12 ASP N N 433 116.330 119.279 -2.949 1
1 1208 . 6 2 2 B 13 13 LEU H H 434 7.360 7.684 -0.324 1
1 1209 . 6 2 2 B 13 13 LEU HA H 434 4.050 4.086 -0.036 1
1 1219 . 6 2 2 B 13 13 LEU CA C 434 57.340 57.859 -0.519 1
1 1220 . 6 2 2 B 13 13 LEU CB C 434 42.960 41.726 1.234 1
1 1224 . 6 2 2 B 13 13 LEU N N 434 123.440 121.162 2.278 1
1 1225 . 6 2 2 B 14 14 LEU H H 435 7.670 8.290 -0.620 1
1 1226 . 6 2 2 B 14 14 LEU HA H 435 3.710 4.088 -0.378 1
1 1236 . 6 2 2 B 14 14 LEU CA C 435 57.170 57.460 -0.290 1
1 1237 . 6 2 2 B 14 14 LEU CB C 435 42.590 41.478 1.112 1
1 1241 . 6 2 2 B 14 14 LEU N N 435 115.170 119.604 -4.434 1
1 1242 . 6 2 2 B 15 15 ASN H H 436 7.490 8.432 -0.942 1
1 1243 . 6 2 2 B 15 15 ASN HA H 436 4.640 4.792 -0.152 1
1 1248 . 6 2 2 B 15 15 ASN CA C 436 52.920 52.491 0.429 1
1 1249 . 6 2 2 B 15 15 ASN CB C 436 39.350 38.671 0.679 1
1 1250 . 6 2 2 B 15 15 ASN N N 436 112.280 115.961 -3.681 1
1 1252 . 6 2 2 B 16 16 LEU H H 437 7.300 7.420 -0.120 1
1 1253 . 6 2 2 B 16 16 LEU HA H 437 4.100 4.331 -0.231 1
1 1263 . 6 2 2 B 16 16 LEU CA C 437 55.310 55.048 0.262 1
1 1264 . 6 2 2 B 16 16 LEU CB C 437 41.800 43.029 -1.229 1
1 1268 . 6 2 2 B 16 16 LEU N N 437 125.180 121.155 4.025 1
1 1269 . 6 2 2 B 17 17 GLU H H 438 8.590 8.699 -0.109 1
1 1270 . 6 2 2 B 17 17 GLU HA H 438 3.920 4.266 -0.346 1
1 1275 . 6 2 2 B 17 17 GLU CA C 438 58.440 56.752 1.688 1
1 1276 . 6 2 2 B 17 17 GLU CB C 438 29.180 29.861 -0.681 1
1 1278 . 6 2 2 B 17 17 GLU N N 438 129.850 123.779 6.071 1
1 1279 . 6 2 2 B 18 18 GLY H H 439 8.580 8.971 -0.391 1
1 1280 . 6 2 2 B 18 18 GLY HA2 H 439 3.570 3.940 -0.370 1
1 1281 . 6 2 2 B 18 18 GLY HA3 H 439 4.220 3.943 0.277 1
1 1282 . 6 2 2 B 18 18 GLY CA C 439 44.710 45.447 -0.737 1
1 1283 . 6 2 2 B 18 18 GLY N N 439 112.250 112.120 0.130 1
1 1284 . 6 2 2 B 19 19 VAL H H 440 7.900 7.710 0.190 1
1 1285 . 6 2 2 B 19 19 VAL HA H 440 3.950 4.378 -0.428 1
1 1293 . 6 2 2 B 19 19 VAL CA C 440 62.820 60.917 1.903 1
1 1294 . 6 2 2 B 19 19 VAL CB C 440 31.470 34.349 -2.879 1
1 1297 . 6 2 2 B 19 19 VAL N N 440 121.910 121.529 0.381 1
1 1298 . 6 2 2 B 20 20 ASP H H 441 7.390 8.731 -1.341 1
1 1299 . 6 2 2 B 20 20 ASP HA H 441 4.820 4.662 0.158 1
1 1302 . 6 2 2 B 20 20 ASP CA C 441 51.920 53.753 -1.833 1
1 1303 . 6 2 2 B 20 20 ASP CB C 441 42.090 41.239 0.851 1
1 1304 . 6 2 2 B 20 20 ASP N N 441 124.850 126.541 -1.691 1
1 1305 . 6 2 2 B 21 21 ARG H H 442 8.630 8.616 0.014 1
1 1306 . 6 2 2 B 21 21 ARG HA H 442 3.810 3.563 0.247 1
1 1313 . 6 2 2 B 21 21 ARG CA C 442 60.710 59.471 1.239 1
1 1314 . 6 2 2 B 21 21 ARG CB C 442 30.020 29.862 0.158 1
1 1317 . 6 2 2 B 21 21 ARG N N 442 120.890 122.558 -1.668 1
1 1318 . 6 2 2 B 22 22 ASP H H 443 8.140 7.967 0.173 1
1 1319 . 6 2 2 B 22 22 ASP HA H 443 4.420 4.313 0.107 1
1 1322 . 6 2 2 B 22 22 ASP CA C 443 57.680 57.151 0.529 1
1 1323 . 6 2 2 B 22 22 ASP CB C 443 40.880 40.677 0.203 1
1 1324 . 6 2 2 B 22 22 ASP N N 443 116.750 120.054 -3.304 1
1 1325 . 6 2 2 B 23 23 LEU H H 444 8.170 7.865 0.305 1
1 1326 . 6 2 2 B 23 23 LEU HA H 444 4.130 4.067 0.063 1
1 1336 . 6 2 2 B 23 23 LEU CA C 444 57.770 57.792 -0.022 1
1 1337 . 6 2 2 B 23 23 LEU CB C 444 41.230 41.138 0.092 1
1 1341 . 6 2 2 B 23 23 LEU N N 444 122.130 121.780 0.350 1
1 1342 . 6 2 2 B 24 24 ALA H H 445 8.630 8.336 0.294 1
1 1343 . 6 2 2 B 24 24 ALA HA H 445 3.790 4.015 -0.225 1
1 1347 . 6 2 2 B 24 24 ALA CA C 445 55.810 54.346 1.464 1
1 1348 . 6 2 2 B 24 24 ALA CB C 445 18.060 18.074 -0.014 1
1 1349 . 6 2 2 B 24 24 ALA N N 445 120.890 120.961 -0.071 1
1 1350 . 6 2 2 B 25 25 PHE H H 446 8.160 7.031 1.129 1
1 1351 . 6 2 2 B 25 25 PHE HA H 446 4.080 4.366 -0.286 1
1 1358 . 6 2 2 B 25 25 PHE CA C 446 62.670 60.940 1.730 1
1 1359 . 6 2 2 B 25 25 PHE CB C 446 39.440 38.313 1.127 1
1 1364 . 6 2 2 B 25 25 PHE N N 446 115.360 116.153 -0.793 1
1 1365 . 6 2 2 B 26 26 LYS H H 447 8.040 7.827 0.213 1
1 1366 . 6 2 2 B 26 26 LYS HA H 447 4.110 3.992 0.118 1
1 1375 . 6 2 2 B 26 26 LYS CA C 447 60.140 59.533 0.607 1
1 1376 . 6 2 2 B 26 26 LYS CB C 447 32.880 32.485 0.395 1
1 1380 . 6 2 2 B 26 26 LYS N N 447 123.110 118.865 4.245 1
1 1381 . 6 2 2 B 27 27 LEU H H 448 8.630 7.968 0.662 1
1 1382 . 6 2 2 B 27 27 LEU HA H 448 3.840 4.082 -0.242 1
1 1392 . 6 2 2 B 27 27 LEU CA C 448 58.210 57.800 0.410 1
1 1393 . 6 2 2 B 27 27 LEU CB C 448 39.760 41.333 -1.573 1
1 1396 . 6 2 2 B 27 27 LEU N N 448 120.890 121.603 -0.713 1
1 1397 . 6 2 2 B 28 28 ALA H H 449 8.200 8.510 -0.310 1
1 1398 . 6 2 2 B 28 28 ALA HA H 449 3.760 4.523 -0.763 1
1 1402 . 6 2 2 B 28 28 ALA CA C 449 54.750 55.303 -0.553 1
1 1403 . 6 2 2 B 28 28 ALA CB C 449 18.050 18.108 -0.058 1
1 1404 . 6 2 2 B 28 28 ALA N N 449 123.710 120.297 3.413 1
1 1405 . 6 2 2 B 29 29 ALA H H 450 7.780 8.151 -0.371 1
1 1406 . 6 2 2 B 29 29 ALA HA H 450 4.170 4.141 0.029 1
1 1410 . 6 2 2 B 29 29 ALA CA C 450 54.430 54.373 0.057 1
1 1411 . 6 2 2 B 29 29 ALA CB C 450 18.040 18.236 -0.196 1
1 1412 . 6 2 2 B 29 29 ALA N N 450 121.020 119.478 1.542 1
1 1413 . 6 2 2 B 30 30 ARG H H 451 7.390 7.951 -0.561 1
1 1414 . 6 2 2 B 30 30 ARG HA H 451 4.540 4.414 0.126 1
1 1421 . 6 2 2 B 30 30 ARG CA C 451 54.510 55.791 -1.281 1
1 1422 . 6 2 2 B 30 30 ARG CB C 451 29.950 29.731 0.219 1
1 1425 . 6 2 2 B 30 30 ARG N N 451 115.480 116.631 -1.151 1
1 1426 . 6 2 2 B 31 31 GLY H H 452 7.950 7.809 0.141 1
1 1427 . 6 2 2 B 31 31 GLY HA2 H 452 3.550 3.994 -0.444 1
1 1428 . 6 2 2 B 31 31 GLY HA3 H 452 4.200 3.994 0.206 1
1 1429 . 6 2 2 B 31 31 GLY CA C 452 45.380 45.341 0.039 1
1 1430 . 6 2 2 B 31 31 GLY N N 452 107.740 108.153 -0.413 1
1 1431 . 6 2 2 B 32 32 VAL H H 453 7.990 7.648 0.342 1
1 1432 . 6 2 2 B 32 32 VAL HA H 453 3.930 4.248 -0.318 1
1 1440 . 6 2 2 B 32 32 VAL CA C 453 61.420 62.857 -1.437 1
1 1441 . 6 2 2 B 32 32 VAL CB C 453 29.860 31.677 -1.817 1
1 1444 . 6 2 2 B 32 32 VAL N N 453 125.560 120.593 4.967 1
1 1445 . 6 2 2 B 33 33 CYS H H 454 8.460 8.786 -0.326 1
1 1446 . 6 2 2 B 33 33 CYS HA H 454 4.310 4.808 -0.498 1
1 1449 . 6 2 2 B 33 33 CYS CA C 454 60.260 59.728 0.532 1
1 1450 . 6 2 2 B 33 33 CYS CB C 454 30.330 30.471 -0.141 1
1 1451 . 6 2 2 B 33 33 CYS N N 454 119.460 125.340 -5.880 1
1 1452 . 6 2 2 B 34 34 THR H H 455 8.080 8.030 0.050 1
1 1453 . 6 2 2 B 34 34 THR HA H 455 4.840 4.717 0.123 1
1 1458 . 6 2 2 B 34 34 THR CA C 455 58.650 61.298 -2.648 1
1 1459 . 6 2 2 B 34 34 THR CB C 455 72.680 71.138 1.542 1
1 1461 . 6 2 2 B 34 34 THR N N 455 108.420 113.991 -5.571 1
1 1462 . 6 2 2 B 35 35 LEU H H 456 8.580 8.801 -0.221 1
1 1463 . 6 2 2 B 35 35 LEU HA H 456 3.790 3.998 -0.208 1
1 1473 . 6 2 2 B 35 35 LEU CA C 456 57.980 58.684 -0.704 1
1 1474 . 6 2 2 B 35 35 LEU CB C 456 42.220 41.586 0.634 1
1 1477 . 6 2 2 B 35 35 LEU N N 456 120.370 129.316 -8.946 1
1 1478 . 6 2 2 B 36 36 GLU H H 457 8.390 8.277 0.113 1
1 1479 . 6 2 2 B 36 36 GLU HA H 457 3.820 3.975 -0.155 1
1 1484 . 6 2 2 B 36 36 GLU CA C 457 59.640 59.853 -0.213 1
1 1485 . 6 2 2 B 36 36 GLU CB C 457 28.780 29.277 -0.497 1
1 1487 . 6 2 2 B 36 36 GLU N N 457 119.450 118.930 0.520 1
1 1488 . 6 2 2 B 37 37 ASP H H 458 7.750 8.241 -0.491 1
1 1489 . 6 2 2 B 37 37 ASP HA H 458 4.140 4.335 -0.195 1
1 1492 . 6 2 2 B 37 37 ASP CA C 458 57.150 57.775 -0.625 1
1 1493 . 6 2 2 B 37 37 ASP CB C 458 42.280 41.987 0.293 1
1 1494 . 6 2 2 B 37 37 ASP N N 458 117.430 120.170 -2.740 1
1 1495 . 6 2 2 B 38 38 LEU H H 459 7.700 7.888 -0.188 1
1 1496 . 6 2 2 B 38 38 LEU HA H 459 3.790 4.117 -0.327 1
1 1506 . 6 2 2 B 38 38 LEU CA C 459 58.080 58.092 -0.012 1
1 1507 . 6 2 2 B 38 38 LEU CB C 459 41.130 41.406 -0.276 1
1 1511 . 6 2 2 B 38 38 LEU N N 459 121.280 120.580 0.700 1
1 1512 . 6 2 2 B 39 39 ALA H H 460 8.190 8.332 -0.142 1
1 1513 . 6 2 2 B 39 39 ALA HA H 460 3.640 3.952 -0.312 1
1 1517 . 6 2 2 B 39 39 ALA CA C 460 54.320 55.458 -1.138 1
1 1518 . 6 2 2 B 39 39 ALA CB C 460 17.140 18.225 -1.085 1
1 1519 . 6 2 2 B 39 39 ALA N N 460 119.400 120.909 -1.509 1
1 1520 . 6 2 2 B 40 40 GLU H H 461 7.340 7.825 -0.485 1
1 1521 . 6 2 2 B 40 40 GLU HA H 461 4.180 4.265 -0.085 1
1 1526 . 6 2 2 B 40 40 GLU CA C 461 57.800 58.796 -0.996 1
1 1527 . 6 2 2 B 40 40 GLU CB C 461 30.600 29.868 0.732 1
1 1529 . 6 2 2 B 40 40 GLU N N 461 110.680 115.843 -5.163 1
1 1530 . 6 2 2 B 41 41 GLN H H 462 7.940 7.950 -0.010 1
1 1531 . 6 2 2 B 41 41 GLN HA H 462 4.100 4.413 -0.313 1
1 1538 . 6 2 2 B 41 41 GLN CA C 462 55.310 56.315 -1.005 1
1 1539 . 6 2 2 B 41 41 GLN CB C 462 28.780 29.790 -1.010 1
1 1541 . 6 2 2 B 41 41 GLN N N 462 120.720 118.057 2.663 1
1 1543 . 6 2 2 B 42 42 GLY H H 463 9.000 8.569 0.431 1
1 1544 . 6 2 2 B 42 42 GLY HA2 H 463 3.310 4.377 -1.067 1
1 1545 . 6 2 2 B 42 42 GLY HA3 H 463 4.820 4.380 0.440 1
1 1546 . 6 2 2 B 42 42 GLY CA C 463 42.650 43.495 -0.845 1
1 1547 . 6 2 2 B 42 42 GLY N N 463 104.110 107.539 -3.429 1
1 1548 . 6 2 2 B 43 43 ILE H H 464 7.900 8.657 -0.757 1
1 1549 . 6 2 2 B 43 43 ILE HA H 464 3.260 3.707 -0.447 1
1 1558 . 6 2 2 B 43 43 ILE CA C 464 66.570 64.362 2.208 1
1 1559 . 6 2 2 B 43 43 ILE CB C 464 38.770 37.497 1.273 1
1 1562 . 6 2 2 B 43 43 ILE N N 464 119.410 121.373 -1.963 1
1 1563 . 6 2 2 B 44 44 ASP H H 465 8.730 8.309 0.421 1
1 1564 . 6 2 2 B 44 44 ASP HA H 465 4.310 4.340 -0.030 1
1 1567 . 6 2 2 B 44 44 ASP CA C 465 56.740 57.509 -0.769 1
1 1568 . 6 2 2 B 44 44 ASP CB C 465 40.120 40.935 -0.815 1
1 1569 . 6 2 2 B 44 44 ASP N N 465 116.610 122.325 -5.715 1
1 1570 . 6 2 2 B 45 45 ASP H H 466 7.720 8.000 -0.280 1
1 1571 . 6 2 2 B 45 45 ASP HA H 466 4.480 4.495 -0.015 1
1 1574 . 6 2 2 B 45 45 ASP CA C 466 57.000 57.209 -0.209 1
1 1575 . 6 2 2 B 45 45 ASP CB C 466 42.270 41.066 1.204 1
1 1576 . 6 2 2 B 45 45 ASP N N 466 117.560 117.862 -0.302 1
1 1577 . 6 2 2 B 46 46 LEU H H 467 7.370 8.066 -0.696 1
1 1578 . 6 2 2 B 46 46 LEU HA H 467 4.410 4.146 0.264 1
1 1587 . 6 2 2 B 46 46 LEU CA C 467 53.660 57.698 -4.038 1
1 1588 . 6 2 2 B 46 46 LEU CB C 467 42.260 41.017 1.243 1
1 1591 . 6 2 2 B 46 46 LEU N N 467 116.890 121.199 -4.309 1
1 1592 . 6 2 2 B 47 47 ALA H H 468 7.080 8.401 -1.321 1
1 1593 . 6 2 2 B 47 47 ALA HA H 468 4.120 4.021 0.099 1
1 1597 . 6 2 2 B 47 47 ALA CA C 468 54.130 54.813 -0.683 1
1 1598 . 6 2 2 B 47 47 ALA CB C 468 19.480 18.612 0.868 1
1 1599 . 6 2 2 B 47 47 ALA N N 468 120.150 122.000 -1.850 1
1 1600 . 6 2 2 B 48 48 ASP H H 469 8.560 8.128 0.432 1
1 1601 . 6 2 2 B 48 48 ASP HA H 469 4.410 4.405 0.005 1
1 1604 . 6 2 2 B 48 48 ASP CA C 469 54.330 57.703 -3.373 1
1 1605 . 6 2 2 B 48 48 ASP CB C 469 39.760 40.775 -1.015 1
1 1606 . 6 2 2 B 48 48 ASP N N 469 114.660 116.664 -2.004 1
1 1607 . 6 2 2 B 49 49 ILE H H 470 7.870 7.977 -0.107 1
1 1608 . 6 2 2 B 49 49 ILE HA H 470 3.850 4.323 -0.473 1
1 1618 . 6 2 2 B 49 49 ILE CA C 470 61.680 60.697 0.983 1
1 1619 . 6 2 2 B 49 49 ILE CB C 470 37.120 38.323 -1.203 1
1 1623 . 6 2 2 B 49 49 ILE N N 470 121.600 119.971 1.629 1
1 1624 . 6 2 2 B 50 50 GLU H H 471 8.680 8.823 -0.143 1
1 1625 . 6 2 2 B 50 50 GLU HA H 471 3.940 4.045 -0.105 1
1 1630 . 6 2 2 B 50 50 GLU CA C 471 58.360 59.369 -1.009 1
1 1631 . 6 2 2 B 50 50 GLU CB C 471 29.530 29.250 0.280 1
1 1633 . 6 2 2 B 50 50 GLU N N 471 131.000 126.527 4.473 1
1 1634 . 6 2 2 B 51 51 GLY H H 472 8.860 8.202 0.658 1
1 1635 . 6 2 2 B 51 51 GLY HA2 H 472 3.640 3.972 -0.332 1
1 1636 . 6 2 2 B 51 51 GLY HA3 H 472 4.230 3.973 0.257 1
1 1637 . 6 2 2 B 51 51 GLY CA C 472 45.190 47.224 -2.034 1
1 1638 . 6 2 2 B 51 51 GLY N N 472 113.580 108.622 4.958 1
1 1639 . 6 2 2 B 52 52 LEU H H 473 7.850 7.325 0.525 1
1 1640 . 6 2 2 B 52 52 LEU HA H 473 4.680 4.744 -0.064 1
1 1650 . 6 2 2 B 52 52 LEU CA C 473 53.640 53.730 -0.090 1
1 1651 . 6 2 2 B 52 52 LEU CB C 473 42.990 44.472 -1.482 1
1 1655 . 6 2 2 B 52 52 LEU N N 473 123.020 121.989 1.031 1
1 1656 . 6 2 2 B 53 53 THR H H 474 7.550 8.909 -1.359 1
1 1657 . 6 2 2 B 53 53 THR HA H 474 4.560 4.756 -0.196 1
1 1662 . 6 2 2 B 53 53 THR CA C 474 60.060 60.830 -0.770 1
1 1663 . 6 2 2 B 53 53 THR CB C 474 71.520 71.077 0.443 1
1 1665 . 6 2 2 B 53 53 THR N N 474 115.070 120.294 -5.224 1
1 1666 . 6 2 2 B 54 54 ASP H H 475 8.900 8.984 -0.084 1
1 1667 . 6 2 2 B 54 54 ASP HA H 475 4.220 4.252 -0.032 1
1 1670 . 6 2 2 B 54 54 ASP CA C 475 57.520 58.176 -0.656 1
1 1671 . 6 2 2 B 54 54 ASP CB C 475 39.560 40.232 -0.672 1
1 1672 . 6 2 2 B 54 54 ASP N N 475 121.800 123.799 -1.999 1
1 1673 . 6 2 2 B 55 55 GLU H H 476 8.460 7.873 0.587 1
1 1674 . 6 2 2 B 55 55 GLU HA H 476 3.970 4.170 -0.200 1
1 1679 . 6 2 2 B 55 55 GLU CA C 476 59.440 59.057 0.383 1
1 1680 . 6 2 2 B 55 55 GLU CB C 476 29.650 29.862 -0.212 1
1 1682 . 6 2 2 B 55 55 GLU N N 476 119.460 120.177 -0.717 1
1 1683 . 6 2 2 B 56 56 LYS H H 477 7.790 8.060 -0.270 1
1 1684 . 6 2 2 B 56 56 LYS HA H 477 4.120 4.077 0.043 1
1 1693 . 6 2 2 B 56 56 LYS CA C 477 58.890 58.785 0.105 1
1 1694 . 6 2 2 B 56 56 LYS CB C 477 32.600 32.157 0.443 1
1 1698 . 6 2 2 B 56 56 LYS N N 477 121.840 121.278 0.562 1
1 1699 . 6 2 2 B 57 57 ALA H H 478 8.900 8.757 0.143 1
1 1700 . 6 2 2 B 57 57 ALA HA H 478 3.790 4.030 -0.240 1
1 1704 . 6 2 2 B 57 57 ALA CA C 478 55.810 54.960 0.850 1
1 1705 . 6 2 2 B 57 57 ALA CB C 478 18.590 18.750 -0.160 1
1 1706 . 6 2 2 B 57 57 ALA N N 478 121.350 121.898 -0.548 1
1 1707 . 6 2 2 B 58 58 GLY H H 479 8.300 8.198 0.102 1
1 1708 . 6 2 2 B 58 58 GLY HA2 H 479 3.500 3.821 -0.321 1
1 1709 . 6 2 2 B 58 58 GLY HA3 H 479 3.890 3.825 0.065 1
1 1710 . 6 2 2 B 58 58 GLY CA C 479 47.360 47.234 0.126 1
1 1711 . 6 2 2 B 58 58 GLY N N 479 102.040 107.864 -5.824 1
1 1712 . 6 2 2 B 59 59 ALA H H 480 7.580 8.654 -1.074 1
1 1713 . 6 2 2 B 59 59 ALA HA H 480 4.110 4.031 0.079 1
1 1717 . 6 2 2 B 59 59 ALA CA C 480 55.580 54.831 0.749 1
1 1718 . 6 2 2 B 59 59 ALA CB C 480 18.130 17.982 0.148 1
1 1719 . 6 2 2 B 59 59 ALA N N 480 123.180 124.045 -0.865 1
1 1720 . 6 2 2 B 60 60 LEU H H 481 8.290 7.939 0.351 1
1 1721 . 6 2 2 B 60 60 LEU HA H 481 4.020 3.929 0.091 1
1 1731 . 6 2 2 B 60 60 LEU CA C 481 57.850 58.049 -0.199 1
1 1732 . 6 2 2 B 60 60 LEU CB C 481 42.360 41.589 0.771 1
1 1736 . 6 2 2 B 60 60 LEU N N 481 120.560 117.831 2.729 1
1 1737 . 6 2 2 B 61 61 ILE H H 482 8.080 8.119 -0.039 1
1 1738 . 6 2 2 B 61 61 ILE HA H 482 3.210 3.532 -0.322 1
1 1748 . 6 2 2 B 61 61 ILE CA C 482 66.250 65.453 0.797 1
1 1749 . 6 2 2 B 61 61 ILE CB C 482 39.400 37.726 1.674 1
1 1753 . 6 2 2 B 61 61 ILE N N 482 119.170 119.728 -0.558 1
1 1754 . 6 2 2 B 62 62 MET H H 483 8.110 8.262 -0.152 1
1 1755 . 6 2 2 B 62 62 MET HA H 483 4.410 4.179 0.231 1
1 1763 . 6 2 2 B 62 62 MET CA C 483 56.110 58.765 -2.655 1
1 1764 . 6 2 2 B 62 62 MET CB C 483 28.260 32.245 -3.985 1
1 1767 . 6 2 2 B 62 62 MET N N 483 114.420 118.140 -3.720 1
1 1768 . 6 2 2 B 63 63 ALA H H 484 8.240 7.850 0.390 1
1 1769 . 6 2 2 B 63 63 ALA HA H 484 4.130 4.122 0.008 1
1 1773 . 6 2 2 B 63 63 ALA CA C 484 55.300 55.170 0.130 1
1 1774 . 6 2 2 B 63 63 ALA CB C 484 18.280 18.251 0.029 1
1 1775 . 6 2 2 B 63 63 ALA N N 484 123.710 121.211 2.499 1
1 1776 . 6 2 2 B 64 64 ALA H H 485 8.050 8.996 -0.946 1
1 1777 . 6 2 2 B 64 64 ALA HA H 485 3.870 4.087 -0.217 1
1 1781 . 6 2 2 B 64 64 ALA CA C 485 55.330 55.436 -0.106 1
1 1782 . 6 2 2 B 64 64 ALA CB C 485 17.660 18.241 -0.581 1
1 1783 . 6 2 2 B 64 64 ALA N N 485 120.070 120.266 -0.196 1
1 1784 . 6 2 2 B 65 65 ARG H H 486 8.640 8.975 -0.335 1
1 1785 . 6 2 2 B 65 65 ARG HA H 486 2.800 4.222 -1.422 1
1 1792 . 6 2 2 B 65 65 ARG CA C 486 60.600 59.693 0.907 1
1 1793 . 6 2 2 B 65 65 ARG CB C 486 29.910 30.195 -0.285 1
1 1796 . 6 2 2 B 65 65 ARG N N 486 118.730 118.098 0.632 1
1 1797 . 6 2 2 B 66 66 ASN H H 487 8.710 8.623 0.087 1
1 1798 . 6 2 2 B 66 66 ASN HA H 487 4.550 4.896 -0.346 1
1 1803 . 6 2 2 B 66 66 ASN CA C 487 56.390 56.578 -0.188 1
1 1804 . 6 2 2 B 66 66 ASN CB C 487 37.970 38.642 -0.672 1
1 1805 . 6 2 2 B 66 66 ASN N N 487 119.170 117.968 1.202 1
1 1807 . 6 2 2 B 67 67 ILE H H 488 7.250 7.935 -0.685 1
1 1808 . 6 2 2 B 67 67 ILE HA H 488 3.810 3.887 -0.077 1
1 1818 . 6 2 2 B 67 67 ILE CA C 488 64.350 65.313 -0.963 1
1 1819 . 6 2 2 B 67 67 ILE CB C 488 39.570 37.626 1.944 1
1 1823 . 6 2 2 B 67 67 ILE N N 488 117.890 119.744 -1.854 1
1 1824 . 6 2 2 B 68 68 CYS H H 489 8.350 7.838 0.512 1
1 1825 . 6 2 2 B 68 68 CYS HA H 489 4.080 4.121 -0.041 1
1 1828 . 6 2 2 B 68 68 CYS CA C 489 62.670 62.408 0.262 1
1 1829 . 6 2 2 B 68 68 CYS CB C 489 28.170 27.261 0.909 1
1 1830 . 6 2 2 B 68 68 CYS N N 489 115.230 120.364 -5.134 1
1 1831 . 6 2 2 B 69 69 TRP H H 490 8.230 8.878 -0.648 1
1 1832 . 6 2 2 B 69 69 TRP HA H 490 5.100 4.272 0.828 1
1 1841 . 6 2 2 B 69 69 TRP CA C 490 55.420 60.420 -5.000 1
1 1842 . 6 2 2 B 69 69 TRP CB C 490 31.010 29.061 1.949 1
1 1844 . 6 2 2 B 69 69 TRP N N 490 116.850 120.597 -3.747 1
1 1846 . 6 2 2 B 70 70 PHE H H 491 7.570 8.941 -1.371 1
1 1847 . 6 2 2 B 70 70 PHE HA H 491 5.240 4.531 0.709 1
1 1852 . 6 2 2 B 70 70 PHE CA C 491 55.490 60.557 -5.067 1
1 1853 . 6 2 2 B 70 70 PHE CB C 491 38.700 37.745 0.955 1
1 1856 . 6 2 2 B 70 70 PHE N N 491 117.460 117.971 -0.511 1
1 1857 . 6 2 2 B 71 71 GLY H H 492 8.420 8.445 -0.025 1
1 1858 . 6 2 2 B 71 71 GLY HA2 H 492 3.920 3.803 0.117 1
1 1859 . 6 2 2 B 71 71 GLY HA3 H 492 4.080 3.831 0.249 1
1 1860 . 6 2 2 B 71 71 GLY CA C 492 46.210 47.059 -0.849 1
1 1861 . 6 2 2 B 71 71 GLY N N 492 110.040 107.883 2.157 1
1 1862 . 6 2 2 B 72 72 ASP H H 493 8.370 7.581 0.789 1
1 1863 . 6 2 2 B 72 72 ASP HA H 493 4.630 4.306 0.324 1
1 1866 . 6 2 2 B 72 72 ASP CA C 493 54.410 56.934 -2.524 1
1 1867 . 6 2 2 B 72 72 ASP CB C 493 41.250 40.409 0.841 1
1 1868 . 6 2 2 B 72 72 ASP N N 493 120.000 121.744 -1.744 1
1 1869 . 6 2 2 B 73 73 GLU H H 494 8.230 8.069 0.161 1
1 1870 . 6 2 2 B 73 73 GLU HA H 494 4.260 4.067 0.193 1
1 1875 . 6 2 2 B 73 73 GLU CA C 494 56.510 59.247 -2.737 1
1 1876 . 6 2 2 B 73 73 GLU CB C 494 30.420 29.540 0.880 1
1 1878 . 6 2 2 B 73 73 GLU N N 494 120.900 120.077 0.823 1
1 216 . 7 1 1 A 20 20 ASP H H 250 8.550 8.989 -0.439 1
1 217 . 7 1 1 A 20 20 ASP HA H 250 4.700 4.511 0.189 1
1 220 . 7 1 1 A 20 20 ASP CA C 250 52.650 52.785 -0.135 1
1 221 . 7 1 1 A 20 20 ASP CB C 250 41.420 40.491 0.929 1
1 222 . 7 1 1 A 20 20 ASP N N 250 125.190 123.738 1.452 1
1 223 . 7 1 1 A 21 21 PRO HA H 251 4.250 4.548 -0.298 1
1 230 . 7 1 1 A 21 21 PRO CA C 251 65.120 64.564 0.556 1
1 231 . 7 1 1 A 21 21 PRO CB C 251 32.310 32.084 0.226 1
1 234 . 7 1 1 A 22 22 ILE H H 252 8.630 7.738 0.892 1
1 235 . 7 1 1 A 22 22 ILE HA H 252 4.060 3.936 0.124 1
1 245 . 7 1 1 A 22 22 ILE CA C 252 62.990 63.325 -0.335 1
1 246 . 7 1 1 A 22 22 ILE CB C 252 37.520 37.722 -0.202 1
1 250 . 7 1 1 A 22 22 ILE N N 252 119.860 117.316 2.544 1
1 251 . 7 1 1 A 23 23 LEU H H 253 7.950 7.888 0.062 1
1 252 . 7 1 1 A 23 23 LEU HA H 253 3.710 4.169 -0.459 1
1 262 . 7 1 1 A 23 23 LEU CA C 253 56.510 57.892 -1.382 1
1 263 . 7 1 1 A 23 23 LEU CB C 253 41.190 41.842 -0.652 1
1 266 . 7 1 1 A 23 23 LEU N N 253 116.850 121.486 -4.636 1
1 267 . 7 1 1 A 24 24 LEU H H 254 7.370 7.928 -0.558 1
1 268 . 7 1 1 A 24 24 LEU HA H 254 4.310 4.591 -0.281 1
1 278 . 7 1 1 A 24 24 LEU CA C 254 54.890 58.068 -3.178 1
1 279 . 7 1 1 A 24 24 LEU CB C 254 41.960 41.473 0.487 1
1 283 . 7 1 1 A 24 24 LEU N N 254 115.210 119.297 -4.087 1
1 284 . 7 1 1 A 25 25 ARG H H 255 7.520 7.642 -0.122 1
1 285 . 7 1 1 A 25 25 ARG HA H 255 4.660 4.351 0.309 1
1 293 . 7 1 1 A 25 25 ARG CA C 255 52.840 54.659 -1.819 1
1 294 . 7 1 1 A 25 25 ARG CB C 255 28.130 29.723 -1.593 1
1 297 . 7 1 1 A 25 25 ARG N N 255 118.180 119.068 -0.888 1
1 298 . 7 1 1 A 26 26 PRO HA H 256 4.800 4.861 -0.061 1
1 305 . 7 1 1 A 26 26 PRO CA C 256 61.790 62.759 -0.969 1
1 306 . 7 1 1 A 26 26 PRO CB C 256 32.660 31.857 0.803 1
1 309 . 7 1 1 A 27 27 VAL H H 257 8.170 8.515 -0.345 1
1 310 . 7 1 1 A 27 27 VAL HA H 257 3.590 3.755 -0.165 1
1 318 . 7 1 1 A 27 27 VAL CA C 257 64.830 65.477 -0.647 1
1 319 . 7 1 1 A 27 27 VAL CB C 257 31.720 31.424 0.296 1
1 322 . 7 1 1 A 27 27 VAL N N 257 115.710 124.450 -8.740 1
1 323 . 7 1 1 A 28 28 ASP H H 258 8.240 8.035 0.205 1
1 324 . 7 1 1 A 28 28 ASP HA H 258 4.340 4.374 -0.034 1
1 327 . 7 1 1 A 28 28 ASP CA C 258 56.490 57.452 -0.962 1
1 328 . 7 1 1 A 28 28 ASP CB C 258 40.520 40.112 0.408 1
1 329 . 7 1 1 A 28 28 ASP N N 258 119.000 121.657 -2.657 1
1 330 . 7 1 1 A 29 29 ASP H H 259 8.000 8.790 -0.790 1
1 331 . 7 1 1 A 29 29 ASP HA H 259 4.390 4.618 -0.228 1
1 334 . 7 1 1 A 29 29 ASP CA C 259 56.210 55.319 0.891 1
1 335 . 7 1 1 A 29 29 ASP CB C 259 40.670 41.126 -0.456 1
1 336 . 7 1 1 A 29 29 ASP N N 259 118.900 117.589 1.311 1
1 337 . 7 1 1 A 30 30 LEU H H 260 7.760 7.269 0.491 1
1 338 . 7 1 1 A 30 30 LEU HA H 260 3.990 4.103 -0.113 1
1 348 . 7 1 1 A 30 30 LEU CA C 260 55.000 55.675 -0.675 1
1 349 . 7 1 1 A 30 30 LEU CB C 260 41.670 42.627 -0.957 1
1 353 . 7 1 1 A 30 30 LEU N N 260 116.300 121.457 -5.157 1
1 354 . 7 1 1 A 31 31 GLU H H 261 7.990 8.728 -0.738 1
1 355 . 7 1 1 A 31 31 GLU HA H 261 4.280 4.054 0.226 1
1 358 . 7 1 1 A 31 31 GLU CA C 261 56.860 58.987 -2.127 1
1 359 . 7 1 1 A 31 31 GLU CB C 261 27.010 29.434 -2.424 1
1 360 . 7 1 1 A 31 31 GLU N N 261 115.620 124.486 -8.866 1
1 361 . 7 1 1 A 32 32 LEU H H 262 8.000 7.393 0.607 1
1 362 . 7 1 1 A 32 32 LEU HA H 262 4.400 4.430 -0.030 1
1 372 . 7 1 1 A 32 32 LEU CA C 262 53.860 54.500 -0.640 1
1 373 . 7 1 1 A 32 32 LEU CB C 262 44.450 42.304 2.146 1
1 377 . 7 1 1 A 32 32 LEU N N 262 118.860 121.672 -2.812 1
1 378 . 7 1 1 A 33 33 THR H H 263 10.020 8.638 1.382 1
1 379 . 7 1 1 A 33 33 THR HA H 263 4.130 4.670 -0.540 1
1 384 . 7 1 1 A 33 33 THR CA C 263 62.400 60.587 1.813 1
1 385 . 7 1 1 A 33 33 THR CB C 263 71.270 71.164 0.106 1
1 387 . 7 1 1 A 33 33 THR N N 263 114.610 112.615 1.995 1
1 388 . 7 1 1 A 34 34 VAL H H 264 8.370 8.782 -0.412 1
1 389 . 7 1 1 A 34 34 VAL HA H 264 3.620 3.644 -0.024 1
1 397 . 7 1 1 A 34 34 VAL CA C 264 66.340 66.498 -0.158 1
1 398 . 7 1 1 A 34 34 VAL CB C 264 31.670 31.563 0.107 1
1 401 . 7 1 1 A 34 34 VAL N N 264 122.110 122.299 -0.189 1
1 402 . 7 1 1 A 35 35 ARG H H 265 8.190 8.082 0.108 1
1 403 . 7 1 1 A 35 35 ARG HA H 265 4.070 3.924 0.146 1
1 411 . 7 1 1 A 35 35 ARG CA C 265 59.470 59.781 -0.311 1
1 412 . 7 1 1 A 35 35 ARG CB C 265 29.790 29.889 -0.099 1
1 415 . 7 1 1 A 35 35 ARG N N 265 117.340 121.350 -4.010 1
1 416 . 7 1 1 A 36 36 SER H H 266 7.610 7.861 -0.251 1
1 417 . 7 1 1 A 36 36 SER HA H 266 4.080 4.132 -0.052 1
1 420 . 7 1 1 A 36 36 SER CA C 266 63.080 61.898 1.182 1
1 421 . 7 1 1 A 36 36 SER CB C 266 63.280 62.804 0.476 1
1 422 . 7 1 1 A 36 36 SER N N 266 116.710 116.530 0.180 1
1 423 . 7 1 1 A 37 37 ALA H H 267 8.720 7.937 0.783 1
1 424 . 7 1 1 A 37 37 ALA HA H 267 3.760 4.027 -0.267 1
1 428 . 7 1 1 A 37 37 ALA CA C 267 55.900 55.263 0.637 1
1 429 . 7 1 1 A 37 37 ALA CB C 267 18.090 17.943 0.147 1
1 430 . 7 1 1 A 37 37 ALA N N 267 124.170 123.470 0.700 1
1 431 . 7 1 1 A 38 38 ASN H H 268 8.850 8.954 -0.104 1
1 432 . 7 1 1 A 38 38 ASN HA H 268 4.420 4.550 -0.130 1
1 437 . 7 1 1 A 38 38 ASN CA C 268 55.700 56.043 -0.343 1
1 438 . 7 1 1 A 38 38 ASN CB C 268 37.180 37.606 -0.426 1
1 439 . 7 1 1 A 38 38 ASN N N 268 117.370 117.539 -0.169 1
1 441 . 7 1 1 A 39 39 CYS H H 269 7.970 8.116 -0.146 1
1 442 . 7 1 1 A 39 39 CYS HA H 269 4.190 4.124 0.066 1
1 445 . 7 1 1 A 39 39 CYS CA C 269 63.340 62.772 0.568 1
1 446 . 7 1 1 A 39 39 CYS CB C 269 26.870 28.006 -1.136 1
1 447 . 7 1 1 A 39 39 CYS N N 269 120.510 118.819 1.691 1
1 448 . 7 1 1 A 40 40 LEU H H 270 7.600 7.855 -0.255 1
1 449 . 7 1 1 A 40 40 LEU HA H 270 3.880 3.893 -0.013 1
1 458 . 7 1 1 A 40 40 LEU CA C 270 57.810 58.110 -0.300 1
1 459 . 7 1 1 A 40 40 LEU CB C 270 40.030 41.776 -1.746 1
1 462 . 7 1 1 A 40 40 LEU N N 270 117.710 120.516 -2.806 1
1 463 . 7 1 1 A 41 41 LYS H H 271 7.980 8.359 -0.379 1
1 464 . 7 1 1 A 41 41 LYS HA H 271 3.820 4.206 -0.386 1
1 472 . 7 1 1 A 41 41 LYS CA C 271 59.840 59.176 0.664 1
1 473 . 7 1 1 A 41 41 LYS CB C 271 32.070 31.976 0.094 1
1 476 . 7 1 1 A 41 41 LYS N N 271 120.070 120.242 -0.172 1
1 477 . 7 1 1 A 42 42 ALA H H 272 7.860 8.059 -0.199 1
1 478 . 7 1 1 A 42 42 ALA HA H 272 4.140 4.078 0.062 1
1 482 . 7 1 1 A 42 42 ALA CA C 272 54.670 54.515 0.155 1
1 483 . 7 1 1 A 42 42 ALA CB C 272 17.950 18.551 -0.601 1
1 484 . 7 1 1 A 42 42 ALA N N 272 122.880 121.404 1.476 1
1 485 . 7 1 1 A 43 43 GLU H H 273 7.210 7.977 -0.767 1
1 486 . 7 1 1 A 43 43 GLU HA H 273 4.260 4.416 -0.156 1
1 491 . 7 1 1 A 43 43 GLU CA C 273 55.020 55.866 -0.846 1
1 492 . 7 1 1 A 43 43 GLU CB C 273 29.880 29.492 0.388 1
1 494 . 7 1 1 A 43 43 GLU N N 273 116.590 115.493 1.097 1
1 495 . 7 1 1 A 44 44 ALA H H 274 7.880 8.204 -0.324 1
1 496 . 7 1 1 A 44 44 ALA HA H 274 3.680 3.801 -0.121 1
1 500 . 7 1 1 A 44 44 ALA CA C 274 52.960 53.060 -0.100 1
1 501 . 7 1 1 A 44 44 ALA CB C 274 16.110 17.113 -1.003 1
1 502 . 7 1 1 A 44 44 ALA N N 274 118.420 118.728 -0.308 1
1 503 . 7 1 1 A 45 45 ILE H H 275 7.600 7.431 0.169 1
1 504 . 7 1 1 A 45 45 ILE HA H 275 3.870 4.188 -0.318 1
1 514 . 7 1 1 A 45 45 ILE CA C 275 61.150 60.324 0.826 1
1 515 . 7 1 1 A 45 45 ILE CB C 275 37.090 38.885 -1.795 1
1 519 . 7 1 1 A 45 45 ILE N N 275 120.370 118.279 2.091 1
1 520 . 7 1 1 A 46 46 HIS H H 276 8.350 8.758 -0.408 1
1 521 . 7 1 1 A 46 46 HIS HA H 276 4.600 4.841 -0.241 1
1 526 . 7 1 1 A 46 46 HIS CA C 276 56.900 57.076 -0.176 1
1 527 . 7 1 1 A 46 46 HIS CB C 276 31.910 31.021 0.889 1
1 529 . 7 1 1 A 46 46 HIS N N 276 123.250 125.996 -2.746 1
1 530 . 7 1 1 A 47 47 TYR H H 277 8.850 7.966 0.884 1
1 531 . 7 1 1 A 47 47 TYR HA H 277 5.100 4.846 0.254 1
1 538 . 7 1 1 A 47 47 TYR CA C 277 57.430 56.471 0.959 1
1 539 . 7 1 1 A 47 47 TYR CB C 277 40.680 40.640 0.040 1
1 544 . 7 1 1 A 47 47 TYR N N 277 119.700 117.802 1.898 1
1 545 . 7 1 1 A 48 48 ILE H H 278 9.380 8.543 0.837 1
1 546 . 7 1 1 A 48 48 ILE HA H 278 3.340 3.659 -0.319 1
1 554 . 7 1 1 A 48 48 ILE CA C 278 67.640 65.067 2.573 1
1 555 . 7 1 1 A 48 48 ILE CB C 278 36.310 37.286 -0.976 1
1 558 . 7 1 1 A 48 48 ILE N N 278 125.650 125.079 0.571 1
1 559 . 7 1 1 A 49 49 GLY H H 279 9.430 8.652 0.778 1
1 560 . 7 1 1 A 49 49 GLY HA2 H 279 2.370 2.361 0.009 1
1 561 . 7 1 1 A 49 49 GLY HA3 H 279 3.230 3.572 -0.342 1
1 562 . 7 1 1 A 49 49 GLY CA C 279 46.820 46.725 0.095 1
1 563 . 7 1 1 A 49 49 GLY N N 279 105.200 108.471 -3.271 1
1 564 . 7 1 1 A 50 50 ASP H H 280 7.050 7.238 -0.188 1
1 565 . 7 1 1 A 50 50 ASP HA H 280 4.360 4.074 0.286 1
1 568 . 7 1 1 A 50 50 ASP CA C 280 57.110 56.016 1.094 1
1 569 . 7 1 1 A 50 50 ASP CB C 280 42.620 40.508 2.112 1
1 570 . 7 1 1 A 50 50 ASP N N 280 116.360 121.306 -4.946 1
1 571 . 7 1 1 A 51 51 LEU H H 281 7.170 7.777 -0.607 1
1 572 . 7 1 1 A 51 51 LEU HA H 281 3.880 3.977 -0.097 1
1 582 . 7 1 1 A 51 51 LEU CA C 281 57.900 58.179 -0.279 1
1 583 . 7 1 1 A 51 51 LEU CB C 281 41.870 41.542 0.328 1
1 587 . 7 1 1 A 51 51 LEU N N 281 120.130 121.612 -1.482 1
1 588 . 7 1 1 A 52 52 VAL H H 282 7.820 7.614 0.206 1
1 589 . 7 1 1 A 52 52 VAL HA H 282 3.980 3.920 0.060 1
1 597 . 7 1 1 A 52 52 VAL CA C 282 64.000 65.273 -1.273 1
1 598 . 7 1 1 A 52 52 VAL CB C 282 30.400 31.245 -0.845 1
1 601 . 7 1 1 A 52 52 VAL N N 282 105.550 114.732 -9.182 1
1 602 . 7 1 1 A 53 53 GLN H H 283 6.550 7.683 -1.133 1
1 603 . 7 1 1 A 53 53 GLN HA H 283 4.680 4.111 0.569 1
1 610 . 7 1 1 A 53 53 GLN CA C 283 56.210 58.454 -2.244 1
1 611 . 7 1 1 A 53 53 GLN CB C 283 31.710 28.809 2.901 1
1 613 . 7 1 1 A 53 53 GLN N N 283 114.060 120.889 -6.829 1
1 615 . 7 1 1 A 54 54 ARG H H 284 7.690 7.632 0.058 1
1 616 . 7 1 1 A 54 54 ARG HA H 284 4.520 4.756 -0.236 1
1 624 . 7 1 1 A 54 54 ARG CA C 284 54.600 54.313 0.287 1
1 625 . 7 1 1 A 54 54 ARG CB C 284 30.750 32.741 -1.991 1
1 628 . 7 1 1 A 54 54 ARG N N 284 119.810 118.509 1.301 1
1 629 . 7 1 1 A 55 55 THR H H 285 8.110 8.681 -0.571 1
1 630 . 7 1 1 A 55 55 THR HA H 285 4.430 4.272 0.158 1
1 635 . 7 1 1 A 55 55 THR CA C 285 59.640 64.254 -4.614 1
1 636 . 7 1 1 A 55 55 THR CB C 285 71.310 69.299 2.011 1
1 638 . 7 1 1 A 55 55 THR N N 285 108.450 119.305 -10.855 1
1 639 . 7 1 1 A 56 56 GLU H H 286 8.910 8.873 0.037 1
1 640 . 7 1 1 A 56 56 GLU HA H 286 3.660 3.940 -0.280 1
1 645 . 7 1 1 A 56 56 GLU CA C 286 60.650 59.635 1.015 1
1 646 . 7 1 1 A 56 56 GLU CB C 286 29.400 29.192 0.208 1
1 648 . 7 1 1 A 56 56 GLU N N 286 120.600 126.311 -5.711 1
1 649 . 7 1 1 A 57 57 VAL H H 287 7.600 8.065 -0.465 1
1 650 . 7 1 1 A 57 57 VAL HA H 287 3.620 3.520 0.100 1
1 658 . 7 1 1 A 57 57 VAL CA C 287 66.020 67.122 -1.102 1
1 659 . 7 1 1 A 57 57 VAL CB C 287 31.720 31.572 0.148 1
1 662 . 7 1 1 A 57 57 VAL N N 287 114.050 120.055 -6.005 1
1 663 . 7 1 1 A 58 58 GLU H H 288 7.350 8.509 -1.159 1
1 664 . 7 1 1 A 58 58 GLU HA H 288 3.830 4.062 -0.232 1
1 669 . 7 1 1 A 58 58 GLU CA C 288 59.250 59.655 -0.405 1
1 670 . 7 1 1 A 58 58 GLU CB C 288 30.030 29.280 0.750 1
1 672 . 7 1 1 A 58 58 GLU N N 288 117.610 119.232 -1.622 1
1 673 . 7 1 1 A 59 59 LEU H H 289 7.850 7.984 -0.134 1
1 674 . 7 1 1 A 59 59 LEU HA H 289 4.150 4.525 -0.375 1
1 683 . 7 1 1 A 59 59 LEU CA C 289 57.340 57.673 -0.333 1
1 684 . 7 1 1 A 59 59 LEU CB C 289 41.170 41.165 0.005 1
1 687 . 7 1 1 A 59 59 LEU N N 289 120.050 120.376 -0.326 1
1 688 . 7 1 1 A 60 60 LEU H H 290 7.670 8.382 -0.712 1
1 689 . 7 1 1 A 60 60 LEU HA H 290 4.540 3.957 0.583 1
1 696 . 7 1 1 A 60 60 LEU CA C 290 55.090 58.107 -3.017 1
1 697 . 7 1 1 A 60 60 LEU CB C 290 42.320 41.606 0.714 1
1 701 . 7 1 1 A 60 60 LEU N N 290 114.980 119.985 -5.005 1
1 702 . 7 1 1 A 61 61 LYS H H 291 7.440 7.316 0.124 1
1 703 . 7 1 1 A 61 61 LYS HA H 291 4.280 4.313 -0.033 1
1 710 . 7 1 1 A 61 61 LYS CA C 291 56.860 56.285 0.575 1
1 711 . 7 1 1 A 61 61 LYS CB C 291 31.900 32.675 -0.775 1
1 714 . 7 1 1 A 61 61 LYS N N 291 118.120 116.999 1.121 1
1 715 . 7 1 1 A 62 62 THR H H 292 7.310 7.835 -0.525 1
1 716 . 7 1 1 A 62 62 THR HA H 292 5.220 4.598 0.622 1
1 721 . 7 1 1 A 62 62 THR CA C 292 55.830 59.259 -3.429 1
1 722 . 7 1 1 A 62 62 THR CB C 292 69.970 70.031 -0.061 1
1 724 . 7 1 1 A 62 62 THR N N 292 111.890 114.814 -2.924 1
1 725 . 7 1 1 A 63 63 PRO HA H 293 4.570 4.543 0.027 1
1 730 . 7 1 1 A 63 63 PRO CA C 293 63.710 64.120 -0.410 1
1 731 . 7 1 1 A 63 63 PRO CB C 293 32.380 31.900 0.480 1
1 733 . 7 1 1 A 64 64 ASN H H 294 8.050 8.813 -0.763 1
1 734 . 7 1 1 A 64 64 ASN HA H 294 4.490 4.483 0.007 1
1 739 . 7 1 1 A 64 64 ASN CA C 294 55.630 54.962 0.668 1
1 740 . 7 1 1 A 64 64 ASN CB C 294 38.730 37.944 0.786 1
1 741 . 7 1 1 A 64 64 ASN N N 294 117.120 116.827 0.293 1
1 743 . 7 1 1 A 65 65 LEU H H 295 7.550 7.147 0.403 1
1 744 . 7 1 1 A 65 65 LEU HA H 295 4.640 4.390 0.250 1
1 754 . 7 1 1 A 65 65 LEU CA C 295 54.310 54.340 -0.030 1
1 755 . 7 1 1 A 65 65 LEU CB C 295 43.640 42.363 1.277 1
1 758 . 7 1 1 A 65 65 LEU N N 295 119.930 120.527 -0.597 1
1 759 . 7 1 1 A 66 66 GLY H H 296 7.850 8.675 -0.825 1
1 760 . 7 1 1 A 66 66 GLY HA2 H 296 3.810 4.324 -0.514 1
1 761 . 7 1 1 A 66 66 GLY HA3 H 296 4.110 4.324 -0.214 1
1 762 . 7 1 1 A 66 66 GLY CA C 296 43.570 43.846 -0.276 1
1 763 . 7 1 1 A 66 66 GLY N N 296 108.840 109.242 -0.402 1
1 764 . 7 1 1 A 67 67 LYS H H 297 8.820 8.790 0.030 1
1 765 . 7 1 1 A 67 67 LYS HA H 297 3.980 3.916 0.064 1
1 774 . 7 1 1 A 67 67 LYS CA C 297 60.100 59.382 0.718 1
1 775 . 7 1 1 A 67 67 LYS CB C 297 32.100 32.183 -0.083 1
1 779 . 7 1 1 A 67 67 LYS N N 297 120.130 121.577 -1.447 1
1 780 . 7 1 1 A 68 68 LYS H H 298 8.850 7.908 0.942 1
1 781 . 7 1 1 A 68 68 LYS HA H 298 4.060 4.060 0.000 1
1 790 . 7 1 1 A 68 68 LYS CA C 298 60.600 59.167 1.433 1
1 791 . 7 1 1 A 68 68 LYS CB C 298 31.920 32.295 -0.375 1
1 795 . 7 1 1 A 68 68 LYS N N 298 119.580 119.230 0.350 1
1 796 . 7 1 1 A 69 69 SER H H 299 8.100 8.074 0.026 1
1 797 . 7 1 1 A 69 69 SER HA H 299 4.370 4.454 -0.084 1
1 800 . 7 1 1 A 69 69 SER CA C 299 61.980 62.370 -0.390 1
1 801 . 7 1 1 A 69 69 SER CB C 299 63.000 62.655 0.345 1
1 802 . 7 1 1 A 69 69 SER N N 299 116.360 116.632 -0.272 1
1 803 . 7 1 1 A 70 70 LEU H H 300 8.240 8.378 -0.138 1
1 804 . 7 1 1 A 70 70 LEU HA H 300 3.970 4.064 -0.094 1
1 814 . 7 1 1 A 70 70 LEU CA C 300 57.610 57.899 -0.289 1
1 815 . 7 1 1 A 70 70 LEU CB C 300 41.060 41.620 -0.560 1
1 819 . 7 1 1 A 70 70 LEU N N 300 123.330 122.688 0.642 1
1 820 . 7 1 1 A 71 71 THR H H 301 8.550 7.991 0.559 1
1 821 . 7 1 1 A 71 71 THR HA H 301 3.690 3.905 -0.215 1
1 826 . 7 1 1 A 71 71 THR CA C 301 67.170 67.092 0.078 1
1 827 . 7 1 1 A 71 71 THR CB C 301 68.810 68.683 0.127 1
1 829 . 7 1 1 A 71 71 THR N N 301 116.520 115.165 1.355 1
1 830 . 7 1 1 A 72 72 GLU H H 302 7.520 7.742 -0.222 1
1 831 . 7 1 1 A 72 72 GLU HA H 302 4.070 4.015 0.055 1
1 836 . 7 1 1 A 72 72 GLU CA C 302 59.470 59.175 0.295 1
1 837 . 7 1 1 A 72 72 GLU CB C 302 29.090 29.745 -0.655 1
1 839 . 7 1 1 A 72 72 GLU N N 302 121.510 120.171 1.339 1
1 840 . 7 1 1 A 73 73 ILE H H 303 8.290 8.126 0.164 1
1 841 . 7 1 1 A 73 73 ILE HA H 303 3.380 3.588 -0.208 1
1 849 . 7 1 1 A 73 73 ILE CA C 303 66.010 65.420 0.590 1
1 850 . 7 1 1 A 73 73 ILE CB C 303 38.680 37.749 0.931 1
1 853 . 7 1 1 A 73 73 ILE N N 303 118.510 121.011 -2.501 1
1 854 . 7 1 1 A 74 74 LYS H H 304 8.550 7.988 0.562 1
1 855 . 7 1 1 A 74 74 LYS HA H 304 3.680 3.898 -0.218 1
1 864 . 7 1 1 A 74 74 LYS CA C 304 61.320 59.043 2.277 1
1 865 . 7 1 1 A 74 74 LYS CB C 304 32.060 31.896 0.164 1
1 868 . 7 1 1 A 74 74 LYS N N 304 118.220 120.162 -1.942 1
1 869 . 7 1 1 A 75 75 ASP H H 305 8.450 7.960 0.490 1
1 870 . 7 1 1 A 75 75 ASP HA H 305 4.440 4.424 0.016 1
1 873 . 7 1 1 A 75 75 ASP CA C 305 57.690 57.160 0.530 1
1 874 . 7 1 1 A 75 75 ASP CB C 305 40.220 40.861 -0.641 1
1 875 . 7 1 1 A 75 75 ASP N N 305 121.790 119.928 1.862 1
1 876 . 7 1 1 A 76 76 VAL H H 306 8.680 7.895 0.785 1
1 877 . 7 1 1 A 76 76 VAL HA H 306 3.890 3.564 0.326 1
1 885 . 7 1 1 A 76 76 VAL CA C 306 66.020 66.422 -0.402 1
1 886 . 7 1 1 A 76 76 VAL CB C 306 31.250 31.476 -0.226 1
1 889 . 7 1 1 A 76 76 VAL N N 306 121.150 119.840 1.310 1
1 890 . 7 1 1 A 77 77 LEU H H 307 8.470 8.050 0.420 1
1 891 . 7 1 1 A 77 77 LEU HA H 307 3.810 3.919 -0.109 1
1 901 . 7 1 1 A 77 77 LEU CA C 307 58.330 57.783 0.547 1
1 902 . 7 1 1 A 77 77 LEU CB C 307 41.250 41.542 -0.292 1
1 906 . 7 1 1 A 77 77 LEU N N 307 120.830 119.906 0.924 1
1 907 . 7 1 1 A 78 78 ALA H H 308 8.280 8.125 0.155 1
1 908 . 7 1 1 A 78 78 ALA HA H 308 4.320 4.095 0.225 1
1 912 . 7 1 1 A 78 78 ALA CA C 308 55.420 54.963 0.457 1
1 913 . 7 1 1 A 78 78 ALA CB C 308 17.750 17.909 -0.159 1
1 914 . 7 1 1 A 78 78 ALA N N 308 122.530 121.146 1.384 1
1 915 . 7 1 1 A 79 79 SER H H 309 7.900 7.853 0.047 1
1 916 . 7 1 1 A 79 79 SER HA H 309 4.340 4.380 -0.040 1
1 919 . 7 1 1 A 79 79 SER CA C 309 61.350 58.459 2.891 1
1 920 . 7 1 1 A 79 79 SER CB C 309 63.280 63.752 -0.472 1
1 921 . 7 1 1 A 79 79 SER N N 309 115.600 111.384 4.216 1
1 922 . 7 1 1 A 80 80 ARG H H 310 7.450 8.268 -0.818 1
1 923 . 7 1 1 A 80 80 ARG HA H 310 4.550 4.001 0.549 1
1 931 . 7 1 1 A 80 80 ARG CA C 310 54.200 57.332 -3.132 1
1 932 . 7 1 1 A 80 80 ARG CB C 310 30.680 27.149 3.531 1
1 935 . 7 1 1 A 80 80 ARG N N 310 119.360 115.817 3.543 1
1 936 . 7 1 1 A 81 81 GLY H H 311 7.940 7.855 0.085 1
1 937 . 7 1 1 A 81 81 GLY HA2 H 311 3.840 3.847 -0.007 1
1 938 . 7 1 1 A 81 81 GLY HA3 H 311 4.070 3.851 0.219 1
1 939 . 7 1 1 A 81 81 GLY CA C 311 46.060 46.968 -0.908 1
1 940 . 7 1 1 A 81 81 GLY N N 311 108.130 106.324 1.806 1
1 941 . 7 1 1 A 82 82 LEU H H 312 7.920 7.716 0.204 1
1 942 . 7 1 1 A 82 82 LEU HA H 312 4.680 4.693 -0.013 1
1 952 . 7 1 1 A 82 82 LEU CA C 312 53.070 52.944 0.126 1
1 953 . 7 1 1 A 82 82 LEU CB C 312 45.790 45.509 0.281 1
1 957 . 7 1 1 A 82 82 LEU N N 312 119.290 115.040 4.250 1
1 958 . 7 1 1 A 83 83 SER H H 313 7.530 8.915 -1.385 1
1 959 . 7 1 1 A 83 83 SER HA H 313 4.450 4.271 0.179 1
1 962 . 7 1 1 A 83 83 SER CA C 313 57.190 59.339 -2.149 1
1 963 . 7 1 1 A 83 83 SER CB C 313 66.080 60.987 5.093 1
1 964 . 7 1 1 A 83 83 SER N N 313 113.120 117.133 -4.013 1
1 965 . 7 1 1 A 84 84 LEU H H 314 8.340 8.248 0.092 1
1 966 . 7 1 1 A 84 84 LEU HA H 314 4.620 4.374 0.246 1
1 976 . 7 1 1 A 84 84 LEU CA C 314 54.720 54.825 -0.105 1
1 977 . 7 1 1 A 84 84 LEU CB C 314 41.620 42.236 -0.616 1
1 981 . 7 1 1 A 84 84 LEU N N 314 115.930 120.926 -4.996 1
1 982 . 7 1 1 A 85 85 GLY H H 315 8.270 7.892 0.378 1
1 983 . 7 1 1 A 85 85 GLY HA2 H 315 3.320 3.922 -0.602 1
1 984 . 7 1 1 A 85 85 GLY HA3 H 315 3.850 3.923 -0.073 1
1 985 . 7 1 1 A 85 85 GLY CA C 315 46.560 46.853 -0.293 1
1 986 . 7 1 1 A 85 85 GLY N N 315 111.010 108.787 2.223 1
1 987 . 7 1 1 A 86 86 MET H H 316 8.650 8.181 0.469 1
1 988 . 7 1 1 A 86 86 MET HA H 316 3.990 4.794 -0.804 1
1 996 . 7 1 1 A 86 86 MET CA C 316 56.730 55.310 1.420 1
1 997 . 7 1 1 A 86 86 MET CB C 316 33.600 34.893 -1.293 1
1 1000 . 7 1 1 A 86 86 MET N N 316 120.570 118.836 1.734 1
1 1001 . 7 1 1 A 87 87 ARG H H 317 8.360 8.432 -0.072 1
1 1002 . 7 1 1 A 87 87 ARG HA H 317 4.450 5.219 -0.769 1
1 1010 . 7 1 1 A 87 87 ARG CA C 317 55.310 54.446 0.864 1
1 1011 . 7 1 1 A 87 87 ARG CB C 317 30.490 33.508 -3.018 1
1 1014 . 7 1 1 A 87 87 ARG N N 317 122.290 119.056 3.234 1
1 1015 . 7 1 1 A 88 88 LEU H H 318 8.400 8.889 -0.489 1
1 1016 . 7 1 1 A 88 88 LEU HA H 318 4.670 5.006 -0.336 1
1 1026 . 7 1 1 A 88 88 LEU CA C 318 53.110 53.205 -0.095 1
1 1027 . 7 1 1 A 88 88 LEU CB C 318 43.600 45.463 -1.863 1
1 1031 . 7 1 1 A 88 88 LEU N N 318 126.420 124.988 1.432 1
1 1032 . 7 1 1 A 89 89 GLU H H 319 8.780 8.961 -0.181 1
1 1033 . 7 1 1 A 89 89 GLU HA H 319 4.340 3.963 0.377 1
1 1038 . 7 1 1 A 89 89 GLU CA C 319 56.490 59.689 -3.199 1
1 1039 . 7 1 1 A 89 89 GLU CB C 319 30.470 29.740 0.730 1
1 1041 . 7 1 1 A 89 89 GLU N N 319 123.070 122.651 0.419 1
1 1042 . 7 1 1 A 90 90 ASN H H 320 8.900 8.374 0.526 1
1 1043 . 7 1 1 A 90 90 ASN HA H 320 4.410 4.973 -0.563 1
1 1048 . 7 1 1 A 90 90 ASN CA C 320 54.120 54.372 -0.252 1
1 1049 . 7 1 1 A 90 90 ASN CB C 320 37.640 40.476 -2.836 1
1 1050 . 7 1 1 A 90 90 ASN N N 320 116.540 112.958 3.582 1
1 1052 . 7 1 1 A 91 91 TRP H H 321 7.990 7.383 0.607 1
1 1053 . 7 1 1 A 91 91 TRP HA H 321 4.330 4.754 -0.424 1
1 1062 . 7 1 1 A 91 91 TRP CA C 321 54.590 58.462 -3.872 1
1 1063 . 7 1 1 A 91 91 TRP CB C 321 31.280 31.178 0.102 1
1 1069 . 7 1 1 A 91 91 TRP N N 321 119.230 114.363 4.867 1
1 1071 . 7 1 1 A 92 92 PRO HA H 322 4.800 3.839 0.961 1
1 1077 . 7 1 1 A 93 93 PRO HA H 323 4.450 4.533 -0.083 1
1 1084 . 7 1 1 A 93 93 PRO CA C 323 61.970 62.453 -0.483 1
1 1085 . 7 1 1 A 93 93 PRO CB C 323 32.830 32.687 0.143 1
1 1088 . 7 1 1 A 94 94 ALA H H 324 8.460 8.804 -0.344 1
1 1089 . 7 1 1 A 94 94 ALA HA H 324 4.000 3.987 0.013 1
1 1093 . 7 1 1 A 94 94 ALA CA C 324 53.790 54.725 -0.935 1
1 1094 . 7 1 1 A 94 94 ALA CB C 324 18.640 18.196 0.444 1
1 1095 . 7 1 1 A 94 94 ALA N N 324 124.010 126.448 -2.438 1
1 1096 . 7 1 1 A 95 95 SER H H 325 7.950 8.075 -0.125 1
1 1097 . 7 1 1 A 95 95 SER HA H 325 4.210 4.171 0.039 1
1 1100 . 7 1 1 A 95 95 SER CA C 325 58.970 62.417 -3.447 1
1 1101 . 7 1 1 A 95 95 SER CB C 325 63.040 63.250 -0.210 1
1 1102 . 7 1 1 A 95 95 SER N N 325 111.520 114.845 -3.325 1
1 1103 . 7 1 1 A 96 96 ILE H H 326 7.480 7.743 -0.263 1
1 1104 . 7 1 1 A 96 96 ILE HA H 326 4.170 3.010 1.160 1
1 1114 . 7 1 1 A 96 96 ILE CA C 326 61.300 65.138 -3.838 1
1 1115 . 7 1 1 A 96 96 ILE CB C 326 38.530 36.926 1.604 1
1 1119 . 7 1 1 A 96 96 ILE N N 326 119.650 122.021 -2.371 1
1 1120 . 7 1 1 A 97 97 ALA H H 327 7.860 8.144 -0.284 1
1 1121 . 7 1 1 A 97 97 ALA HA H 327 4.230 3.949 0.281 1
1 1125 . 7 1 1 A 97 97 ALA CA C 327 52.570 55.132 -2.562 1
1 1126 . 7 1 1 A 97 97 ALA CB C 327 19.590 18.125 1.465 1
1 1127 . 7 1 1 A 97 97 ALA N N 327 126.480 122.232 4.248 1
1 1128 . 7 1 1 A 98 98 ASP H H 328 8.250 7.949 0.301 1
1 1129 . 7 1 1 A 98 98 ASP HA H 328 4.540 4.315 0.225 1
1 1132 . 7 1 1 A 98 98 ASP CA C 328 54.150 57.346 -3.196 1
1 1133 . 7 1 1 A 98 98 ASP CB C 328 41.120 40.495 0.625 1
1 1134 . 7 1 1 A 98 98 ASP N N 328 120.130 118.711 1.419 1
1 1150 . 7 2 2 B 6 6 ASP H H 427 8.160 8.996 -0.836 1
1 1151 . 7 2 2 B 6 6 ASP HA H 427 4.630 4.193 0.437 1
1 1154 . 7 2 2 B 6 6 ASP CA C 427 54.410 56.957 -2.547 1
1 1155 . 7 2 2 B 6 6 ASP CB C 427 41.250 40.513 0.737 1
1 1156 . 7 2 2 B 6 6 ASP N N 427 120.160 125.859 -5.699 1
1 1157 . 7 2 2 B 7 7 ASN H H 428 8.350 7.961 0.389 1
1 1158 . 7 2 2 B 7 7 ASN HA H 428 4.550 4.234 0.316 1
1 1163 . 7 2 2 B 7 7 ASN CA C 428 53.310 54.380 -1.070 1
1 1164 . 7 2 2 B 7 7 ASN CB C 428 38.850 36.684 2.166 1
1 1165 . 7 2 2 B 7 7 ASN N N 428 118.440 114.776 3.664 1
1 1167 . 7 2 2 B 8 8 LYS H H 429 8.030 7.824 0.206 1
1 1172 . 7 2 2 B 8 8 LYS CB C 429 33.280 33.274 0.006 1
1 1174 . 7 2 2 B 8 8 LYS N N 429 120.260 118.930 1.330 1
1 1175 . 7 2 2 B 9 9 PRO HA H 430 4.420 4.568 -0.148 1
1 1182 . 7 2 2 B 9 9 PRO CA C 430 62.280 62.683 -0.403 1
1 1183 . 7 2 2 B 9 9 PRO CB C 430 31.920 32.365 -0.445 1
1 1186 . 7 2 2 B 10 10 ALA H H 431 8.930 8.437 0.493 1
1 1187 . 7 2 2 B 10 10 ALA HA H 431 4.350 4.499 -0.149 1
1 1191 . 7 2 2 B 10 10 ALA CA C 431 51.070 51.620 -0.550 1
1 1192 . 7 2 2 B 10 10 ALA CB C 431 20.920 19.993 0.927 1
1 1193 . 7 2 2 B 10 10 ALA N N 431 125.000 125.102 -0.102 1
1 1194 . 7 2 2 B 11 11 ASP H H 432 8.530 9.060 -0.530 1
1 1195 . 7 2 2 B 11 11 ASP HA H 432 4.220 4.268 -0.048 1
1 1198 . 7 2 2 B 11 11 ASP CA C 432 57.520 57.673 -0.153 1
1 1199 . 7 2 2 B 11 11 ASP CB C 432 40.470 40.239 0.231 1
1 1200 . 7 2 2 B 11 11 ASP N N 432 119.610 120.600 -0.990 1
1 1201 . 7 2 2 B 12 12 ASP H H 433 8.340 7.993 0.347 1
1 1202 . 7 2 2 B 12 12 ASP HA H 433 4.160 4.399 -0.239 1
1 1205 . 7 2 2 B 12 12 ASP CA C 433 56.090 57.352 -1.262 1
1 1206 . 7 2 2 B 12 12 ASP CB C 433 38.960 40.957 -1.997 1
1 1207 . 7 2 2 B 12 12 ASP N N 433 116.330 119.672 -3.342 1
1 1208 . 7 2 2 B 13 13 LEU H H 434 7.360 7.957 -0.597 1
1 1209 . 7 2 2 B 13 13 LEU HA H 434 4.050 4.083 -0.033 1
1 1219 . 7 2 2 B 13 13 LEU CA C 434 57.340 57.723 -0.383 1
1 1220 . 7 2 2 B 13 13 LEU CB C 434 42.960 41.735 1.225 1
1 1224 . 7 2 2 B 13 13 LEU N N 434 123.440 121.752 1.688 1
1 1225 . 7 2 2 B 14 14 LEU H H 435 7.670 7.919 -0.249 1
1 1226 . 7 2 2 B 14 14 LEU HA H 435 3.710 4.053 -0.343 1
1 1236 . 7 2 2 B 14 14 LEU CA C 435 57.170 57.080 0.090 1
1 1237 . 7 2 2 B 14 14 LEU CB C 435 42.590 41.832 0.758 1
1 1241 . 7 2 2 B 14 14 LEU N N 435 115.170 119.440 -4.270 1
1 1242 . 7 2 2 B 15 15 ASN H H 436 7.490 8.270 -0.780 1
1 1243 . 7 2 2 B 15 15 ASN HA H 436 4.640 4.782 -0.142 1
1 1248 . 7 2 2 B 15 15 ASN CA C 436 52.920 52.739 0.181 1
1 1249 . 7 2 2 B 15 15 ASN CB C 436 39.350 38.623 0.727 1
1 1250 . 7 2 2 B 15 15 ASN N N 436 112.280 116.204 -3.924 1
1 1252 . 7 2 2 B 16 16 LEU H H 437 7.300 7.399 -0.099 1
1 1253 . 7 2 2 B 16 16 LEU HA H 437 4.100 4.303 -0.203 1
1 1263 . 7 2 2 B 16 16 LEU CA C 437 55.310 54.987 0.323 1
1 1264 . 7 2 2 B 16 16 LEU CB C 437 41.800 43.026 -1.226 1
1 1268 . 7 2 2 B 16 16 LEU N N 437 125.180 121.151 4.029 1
1 1269 . 7 2 2 B 17 17 GLU H H 438 8.590 8.766 -0.176 1
1 1270 . 7 2 2 B 17 17 GLU HA H 438 3.920 3.931 -0.011 1
1 1275 . 7 2 2 B 17 17 GLU CA C 438 58.440 58.301 0.139 1
1 1276 . 7 2 2 B 17 17 GLU CB C 438 29.180 29.330 -0.150 1
1 1278 . 7 2 2 B 17 17 GLU N N 438 129.850 125.916 3.934 1
1 1279 . 7 2 2 B 18 18 GLY H H 439 8.580 8.913 -0.333 1
1 1280 . 7 2 2 B 18 18 GLY HA2 H 439 3.570 3.925 -0.355 1
1 1281 . 7 2 2 B 18 18 GLY HA3 H 439 4.220 3.929 0.291 1
1 1282 . 7 2 2 B 18 18 GLY CA C 439 44.710 45.533 -0.823 1
1 1283 . 7 2 2 B 18 18 GLY N N 439 112.250 114.829 -2.579 1
1 1284 . 7 2 2 B 19 19 VAL H H 440 7.900 7.463 0.437 1
1 1285 . 7 2 2 B 19 19 VAL HA H 440 3.950 4.427 -0.477 1
1 1293 . 7 2 2 B 19 19 VAL CA C 440 62.820 60.905 1.915 1
1 1294 . 7 2 2 B 19 19 VAL CB C 440 31.470 34.423 -2.953 1
1 1297 . 7 2 2 B 19 19 VAL N N 440 121.910 121.949 -0.039 1
1 1298 . 7 2 2 B 20 20 ASP H H 441 7.390 8.792 -1.402 1
1 1299 . 7 2 2 B 20 20 ASP HA H 441 4.820 4.934 -0.114 1
1 1302 . 7 2 2 B 20 20 ASP CA C 441 51.920 53.068 -1.148 1
1 1303 . 7 2 2 B 20 20 ASP CB C 441 42.090 42.549 -0.459 1
1 1304 . 7 2 2 B 20 20 ASP N N 441 124.850 126.710 -1.860 1
1 1305 . 7 2 2 B 21 21 ARG H H 442 8.630 8.775 -0.145 1
1 1306 . 7 2 2 B 21 21 ARG HA H 442 3.810 3.509 0.301 1
1 1313 . 7 2 2 B 21 21 ARG CA C 442 60.710 59.818 0.892 1
1 1314 . 7 2 2 B 21 21 ARG CB C 442 30.020 29.784 0.236 1
1 1317 . 7 2 2 B 21 21 ARG N N 442 120.890 122.397 -1.507 1
1 1318 . 7 2 2 B 22 22 ASP H H 443 8.140 7.896 0.244 1
1 1319 . 7 2 2 B 22 22 ASP HA H 443 4.420 4.389 0.031 1
1 1322 . 7 2 2 B 22 22 ASP CA C 443 57.680 57.014 0.666 1
1 1323 . 7 2 2 B 22 22 ASP CB C 443 40.880 40.854 0.026 1
1 1324 . 7 2 2 B 22 22 ASP N N 443 116.750 119.568 -2.818 1
1 1325 . 7 2 2 B 23 23 LEU H H 444 8.170 7.809 0.361 1
1 1326 . 7 2 2 B 23 23 LEU HA H 444 4.130 4.069 0.061 1
1 1336 . 7 2 2 B 23 23 LEU CA C 444 57.770 57.846 -0.076 1
1 1337 . 7 2 2 B 23 23 LEU CB C 444 41.230 41.127 0.103 1
1 1341 . 7 2 2 B 23 23 LEU N N 444 122.130 121.467 0.663 1
1 1342 . 7 2 2 B 24 24 ALA H H 445 8.630 8.251 0.379 1
1 1343 . 7 2 2 B 24 24 ALA HA H 445 3.790 4.010 -0.220 1
1 1347 . 7 2 2 B 24 24 ALA CA C 445 55.810 54.514 1.296 1
1 1348 . 7 2 2 B 24 24 ALA CB C 445 18.060 18.147 -0.087 1
1 1349 . 7 2 2 B 24 24 ALA N N 445 120.890 120.842 0.048 1
1 1350 . 7 2 2 B 25 25 PHE H H 446 8.160 7.480 0.680 1
1 1351 . 7 2 2 B 25 25 PHE HA H 446 4.080 4.304 -0.224 1
1 1358 . 7 2 2 B 25 25 PHE CA C 446 62.670 61.888 0.782 1
1 1359 . 7 2 2 B 25 25 PHE CB C 446 39.440 38.638 0.802 1
1 1364 . 7 2 2 B 25 25 PHE N N 446 115.360 116.297 -0.937 1
1 1365 . 7 2 2 B 26 26 LYS H H 447 8.040 7.749 0.291 1
1 1366 . 7 2 2 B 26 26 LYS HA H 447 4.110 3.964 0.146 1
1 1375 . 7 2 2 B 26 26 LYS CA C 447 60.140 59.379 0.761 1
1 1376 . 7 2 2 B 26 26 LYS CB C 447 32.880 32.569 0.311 1
1 1380 . 7 2 2 B 26 26 LYS N N 447 123.110 118.318 4.792 1
1 1381 . 7 2 2 B 27 27 LEU H H 448 8.630 8.163 0.467 1
1 1382 . 7 2 2 B 27 27 LEU HA H 448 3.840 3.963 -0.123 1
1 1392 . 7 2 2 B 27 27 LEU CA C 448 58.210 57.879 0.331 1
1 1393 . 7 2 2 B 27 27 LEU CB C 448 39.760 41.609 -1.849 1
1 1396 . 7 2 2 B 27 27 LEU N N 448 120.890 120.139 0.751 1
1 1397 . 7 2 2 B 28 28 ALA H H 449 8.200 8.350 -0.150 1
1 1398 . 7 2 2 B 28 28 ALA HA H 449 3.760 4.465 -0.705 1
1 1402 . 7 2 2 B 28 28 ALA CA C 449 54.750 55.443 -0.693 1
1 1403 . 7 2 2 B 28 28 ALA CB C 449 18.050 18.187 -0.137 1
1 1404 . 7 2 2 B 28 28 ALA N N 449 123.710 121.842 1.868 1
1 1405 . 7 2 2 B 29 29 ALA H H 450 7.780 7.999 -0.219 1
1 1406 . 7 2 2 B 29 29 ALA HA H 450 4.170 4.023 0.147 1
1 1410 . 7 2 2 B 29 29 ALA CA C 450 54.430 55.219 -0.789 1
1 1411 . 7 2 2 B 29 29 ALA CB C 450 18.040 18.725 -0.685 1
1 1412 . 7 2 2 B 29 29 ALA N N 450 121.020 119.029 1.991 1
1 1413 . 7 2 2 B 30 30 ARG H H 451 7.390 7.568 -0.178 1
1 1414 . 7 2 2 B 30 30 ARG HA H 451 4.540 4.405 0.135 1
1 1421 . 7 2 2 B 30 30 ARG CA C 451 54.510 55.696 -1.186 1
1 1422 . 7 2 2 B 30 30 ARG CB C 451 29.950 29.677 0.273 1
1 1425 . 7 2 2 B 30 30 ARG N N 451 115.480 115.957 -0.477 1
1 1426 . 7 2 2 B 31 31 GLY H H 452 7.950 8.609 -0.659 1
1 1427 . 7 2 2 B 31 31 GLY HA2 H 452 3.550 4.006 -0.456 1
1 1428 . 7 2 2 B 31 31 GLY HA3 H 452 4.200 4.008 0.192 1
1 1429 . 7 2 2 B 31 31 GLY CA C 452 45.380 45.442 -0.062 1
1 1430 . 7 2 2 B 31 31 GLY N N 452 107.740 107.488 0.252 1
1 1431 . 7 2 2 B 32 32 VAL H H 453 7.990 7.194 0.796 1
1 1432 . 7 2 2 B 32 32 VAL HA H 453 3.930 4.026 -0.096 1
1 1440 . 7 2 2 B 32 32 VAL CA C 453 61.420 63.020 -1.600 1
1 1441 . 7 2 2 B 32 32 VAL CB C 453 29.860 31.371 -1.511 1
1 1444 . 7 2 2 B 32 32 VAL N N 453 125.560 121.217 4.343 1
1 1445 . 7 2 2 B 33 33 CYS H H 454 8.460 8.608 -0.148 1
1 1446 . 7 2 2 B 33 33 CYS HA H 454 4.310 4.783 -0.473 1
1 1449 . 7 2 2 B 33 33 CYS CA C 454 60.260 59.501 0.759 1
1 1450 . 7 2 2 B 33 33 CYS CB C 454 30.330 30.036 0.294 1
1 1451 . 7 2 2 B 33 33 CYS N N 454 119.460 126.254 -6.794 1
1 1452 . 7 2 2 B 34 34 THR H H 455 8.080 7.308 0.772 1
1 1453 . 7 2 2 B 34 34 THR HA H 455 4.840 4.404 0.436 1
1 1458 . 7 2 2 B 34 34 THR CA C 455 58.650 63.105 -4.455 1
1 1459 . 7 2 2 B 34 34 THR CB C 455 72.680 69.302 3.378 1
1 1461 . 7 2 2 B 34 34 THR N N 455 108.420 115.049 -6.629 1
1 1462 . 7 2 2 B 35 35 LEU H H 456 8.580 8.799 -0.219 1
1 1463 . 7 2 2 B 35 35 LEU HA H 456 3.790 3.992 -0.202 1
1 1473 . 7 2 2 B 35 35 LEU CA C 456 57.980 58.696 -0.716 1
1 1474 . 7 2 2 B 35 35 LEU CB C 456 42.220 41.483 0.737 1
1 1477 . 7 2 2 B 35 35 LEU N N 456 120.370 128.464 -8.094 1
1 1478 . 7 2 2 B 36 36 GLU H H 457 8.390 8.247 0.143 1
1 1479 . 7 2 2 B 36 36 GLU HA H 457 3.820 3.917 -0.097 1
1 1484 . 7 2 2 B 36 36 GLU CA C 457 59.640 59.532 0.108 1
1 1485 . 7 2 2 B 36 36 GLU CB C 457 28.780 28.848 -0.068 1
1 1487 . 7 2 2 B 36 36 GLU N N 457 119.450 118.980 0.470 1
1 1488 . 7 2 2 B 37 37 ASP H H 458 7.750 8.192 -0.442 1
1 1489 . 7 2 2 B 37 37 ASP HA H 458 4.140 4.454 -0.314 1
1 1492 . 7 2 2 B 37 37 ASP CA C 458 57.150 57.269 -0.119 1
1 1493 . 7 2 2 B 37 37 ASP CB C 458 42.280 40.845 1.435 1
1 1494 . 7 2 2 B 37 37 ASP N N 458 117.430 120.399 -2.969 1
1 1495 . 7 2 2 B 38 38 LEU H H 459 7.700 8.022 -0.322 1
1 1496 . 7 2 2 B 38 38 LEU HA H 459 3.790 4.068 -0.278 1
1 1506 . 7 2 2 B 38 38 LEU CA C 459 58.080 57.743 0.337 1
1 1507 . 7 2 2 B 38 38 LEU CB C 459 41.130 41.398 -0.268 1
1 1511 . 7 2 2 B 38 38 LEU N N 459 121.280 121.598 -0.318 1
1 1512 . 7 2 2 B 39 39 ALA H H 460 8.190 8.236 -0.046 1
1 1513 . 7 2 2 B 39 39 ALA HA H 460 3.640 4.015 -0.375 1
1 1517 . 7 2 2 B 39 39 ALA CA C 460 54.320 55.063 -0.743 1
1 1518 . 7 2 2 B 39 39 ALA CB C 460 17.140 18.209 -1.069 1
1 1519 . 7 2 2 B 39 39 ALA N N 460 119.400 120.357 -0.957 1
1 1520 . 7 2 2 B 40 40 GLU H H 461 7.340 7.697 -0.357 1
1 1521 . 7 2 2 B 40 40 GLU HA H 461 4.180 4.264 -0.084 1
1 1526 . 7 2 2 B 40 40 GLU CA C 461 57.800 58.673 -0.873 1
1 1527 . 7 2 2 B 40 40 GLU CB C 461 30.600 29.933 0.667 1
1 1529 . 7 2 2 B 40 40 GLU N N 461 110.680 115.489 -4.809 1
1 1530 . 7 2 2 B 41 41 GLN H H 462 7.940 7.663 0.277 1
1 1531 . 7 2 2 B 41 41 GLN HA H 462 4.100 4.408 -0.308 1
1 1538 . 7 2 2 B 41 41 GLN CA C 462 55.310 56.963 -1.653 1
1 1539 . 7 2 2 B 41 41 GLN CB C 462 28.780 29.588 -0.808 1
1 1541 . 7 2 2 B 41 41 GLN N N 462 120.720 118.177 2.543 1
1 1543 . 7 2 2 B 42 42 GLY H H 463 9.000 8.599 0.401 1
1 1544 . 7 2 2 B 42 42 GLY HA2 H 463 3.310 4.352 -1.042 1
1 1545 . 7 2 2 B 42 42 GLY HA3 H 463 4.820 4.354 0.466 1
1 1546 . 7 2 2 B 42 42 GLY CA C 463 42.650 43.504 -0.854 1
1 1547 . 7 2 2 B 42 42 GLY N N 463 104.110 108.054 -3.944 1
1 1548 . 7 2 2 B 43 43 ILE H H 464 7.900 8.684 -0.784 1
1 1549 . 7 2 2 B 43 43 ILE HA H 464 3.260 3.705 -0.445 1
1 1558 . 7 2 2 B 43 43 ILE CA C 464 66.570 64.355 2.215 1
1 1559 . 7 2 2 B 43 43 ILE CB C 464 38.770 37.378 1.392 1
1 1562 . 7 2 2 B 43 43 ILE N N 464 119.410 121.281 -1.871 1
1 1563 . 7 2 2 B 44 44 ASP H H 465 8.730 8.092 0.638 1
1 1564 . 7 2 2 B 44 44 ASP HA H 465 4.310 4.404 -0.094 1
1 1567 . 7 2 2 B 44 44 ASP CA C 465 56.740 57.380 -0.640 1
1 1568 . 7 2 2 B 44 44 ASP CB C 465 40.120 39.937 0.183 1
1 1569 . 7 2 2 B 44 44 ASP N N 465 116.610 120.832 -4.222 1
1 1570 . 7 2 2 B 45 45 ASP H H 466 7.720 8.059 -0.339 1
1 1571 . 7 2 2 B 45 45 ASP HA H 466 4.480 4.478 0.002 1
1 1574 . 7 2 2 B 45 45 ASP CA C 466 57.000 57.179 -0.179 1
1 1575 . 7 2 2 B 45 45 ASP CB C 466 42.270 40.741 1.529 1
1 1576 . 7 2 2 B 45 45 ASP N N 466 117.560 120.352 -2.792 1
1 1577 . 7 2 2 B 46 46 LEU H H 467 7.370 8.138 -0.768 1
1 1578 . 7 2 2 B 46 46 LEU HA H 467 4.410 4.146 0.264 1
1 1587 . 7 2 2 B 46 46 LEU CA C 467 53.660 57.544 -3.884 1
1 1588 . 7 2 2 B 46 46 LEU CB C 467 42.260 41.431 0.829 1
1 1591 . 7 2 2 B 46 46 LEU N N 467 116.890 120.636 -3.746 1
1 1592 . 7 2 2 B 47 47 ALA H H 468 7.080 8.402 -1.322 1
1 1593 . 7 2 2 B 47 47 ALA HA H 468 4.120 4.037 0.083 1
1 1597 . 7 2 2 B 47 47 ALA CA C 468 54.130 54.884 -0.754 1
1 1598 . 7 2 2 B 47 47 ALA CB C 468 19.480 18.378 1.102 1
1 1599 . 7 2 2 B 47 47 ALA N N 468 120.150 122.640 -2.490 1
1 1600 . 7 2 2 B 48 48 ASP H H 469 8.560 8.156 0.404 1
1 1601 . 7 2 2 B 48 48 ASP HA H 469 4.410 4.457 -0.047 1
1 1604 . 7 2 2 B 48 48 ASP CA C 469 54.330 57.542 -3.212 1
1 1605 . 7 2 2 B 48 48 ASP CB C 469 39.760 40.554 -0.794 1
1 1606 . 7 2 2 B 48 48 ASP N N 469 114.660 116.443 -1.783 1
1 1607 . 7 2 2 B 49 49 ILE H H 470 7.870 8.059 -0.189 1
1 1608 . 7 2 2 B 49 49 ILE HA H 470 3.850 4.401 -0.551 1
1 1618 . 7 2 2 B 49 49 ILE CA C 470 61.680 60.546 1.134 1
1 1619 . 7 2 2 B 49 49 ILE CB C 470 37.120 38.982 -1.862 1
1 1623 . 7 2 2 B 49 49 ILE N N 470 121.600 119.965 1.635 1
1 1624 . 7 2 2 B 50 50 GLU H H 471 8.680 8.977 -0.297 1
1 1625 . 7 2 2 B 50 50 GLU HA H 471 3.940 4.055 -0.115 1
1 1630 . 7 2 2 B 50 50 GLU CA C 471 58.360 59.332 -0.972 1
1 1631 . 7 2 2 B 50 50 GLU CB C 471 29.530 29.336 0.194 1
1 1633 . 7 2 2 B 50 50 GLU N N 471 131.000 126.315 4.685 1
1 1634 . 7 2 2 B 51 51 GLY H H 472 8.860 8.246 0.614 1
1 1635 . 7 2 2 B 51 51 GLY HA2 H 472 3.640 4.006 -0.366 1
1 1636 . 7 2 2 B 51 51 GLY HA3 H 472 4.230 4.008 0.222 1
1 1637 . 7 2 2 B 51 51 GLY CA C 472 45.190 47.019 -1.829 1
1 1638 . 7 2 2 B 51 51 GLY N N 472 113.580 108.873 4.707 1
1 1639 . 7 2 2 B 52 52 LEU H H 473 7.850 7.696 0.154 1
1 1640 . 7 2 2 B 52 52 LEU HA H 473 4.680 4.838 -0.158 1
1 1650 . 7 2 2 B 52 52 LEU CA C 473 53.640 53.602 0.038 1
1 1651 . 7 2 2 B 52 52 LEU CB C 473 42.990 43.531 -0.541 1
1 1655 . 7 2 2 B 52 52 LEU N N 473 123.020 120.033 2.987 1
1 1656 . 7 2 2 B 53 53 THR H H 474 7.550 8.900 -1.350 1
1 1657 . 7 2 2 B 53 53 THR HA H 474 4.560 4.823 -0.263 1
1 1662 . 7 2 2 B 53 53 THR CA C 474 60.060 60.950 -0.890 1
1 1663 . 7 2 2 B 53 53 THR CB C 474 71.520 71.107 0.413 1
1 1665 . 7 2 2 B 53 53 THR N N 474 115.070 118.759 -3.689 1
1 1666 . 7 2 2 B 54 54 ASP H H 475 8.900 9.033 -0.133 1
1 1667 . 7 2 2 B 54 54 ASP HA H 475 4.220 4.289 -0.069 1
1 1670 . 7 2 2 B 54 54 ASP CA C 475 57.520 57.989 -0.469 1
1 1671 . 7 2 2 B 54 54 ASP CB C 475 39.560 40.254 -0.694 1
1 1672 . 7 2 2 B 54 54 ASP N N 475 121.800 123.827 -2.027 1
1 1673 . 7 2 2 B 55 55 GLU H H 476 8.460 7.940 0.520 1
1 1674 . 7 2 2 B 55 55 GLU HA H 476 3.970 4.031 -0.061 1
1 1679 . 7 2 2 B 55 55 GLU CA C 476 59.440 59.031 0.409 1
1 1680 . 7 2 2 B 55 55 GLU CB C 476 29.650 29.577 0.073 1
1 1682 . 7 2 2 B 55 55 GLU N N 476 119.460 119.419 0.041 1
1 1683 . 7 2 2 B 56 56 LYS H H 477 7.790 7.999 -0.209 1
1 1684 . 7 2 2 B 56 56 LYS HA H 477 4.120 4.105 0.015 1
1 1693 . 7 2 2 B 56 56 LYS CA C 477 58.890 59.419 -0.529 1
1 1694 . 7 2 2 B 56 56 LYS CB C 477 32.600 32.315 0.285 1
1 1698 . 7 2 2 B 56 56 LYS N N 477 121.840 119.719 2.121 1
1 1699 . 7 2 2 B 57 57 ALA H H 478 8.900 9.197 -0.297 1
1 1700 . 7 2 2 B 57 57 ALA HA H 478 3.790 4.053 -0.263 1
1 1704 . 7 2 2 B 57 57 ALA CA C 478 55.810 55.415 0.395 1
1 1705 . 7 2 2 B 57 57 ALA CB C 478 18.590 18.256 0.334 1
1 1706 . 7 2 2 B 57 57 ALA N N 478 121.350 121.667 -0.317 1
1 1707 . 7 2 2 B 58 58 GLY H H 479 8.300 8.062 0.238 1
1 1708 . 7 2 2 B 58 58 GLY HA2 H 479 3.500 3.841 -0.341 1
1 1709 . 7 2 2 B 58 58 GLY HA3 H 479 3.890 3.843 0.047 1
1 1710 . 7 2 2 B 58 58 GLY CA C 479 47.360 47.247 0.113 1
1 1711 . 7 2 2 B 58 58 GLY N N 479 102.040 107.497 -5.457 1
1 1712 . 7 2 2 B 59 59 ALA H H 480 7.580 8.160 -0.580 1
1 1713 . 7 2 2 B 59 59 ALA HA H 480 4.110 4.015 0.095 1
1 1717 . 7 2 2 B 59 59 ALA CA C 480 55.580 54.641 0.939 1
1 1718 . 7 2 2 B 59 59 ALA CB C 480 18.130 18.545 -0.415 1
1 1719 . 7 2 2 B 59 59 ALA N N 480 123.180 124.471 -1.291 1
1 1720 . 7 2 2 B 60 60 LEU H H 481 8.290 7.945 0.345 1
1 1721 . 7 2 2 B 60 60 LEU HA H 481 4.020 4.038 -0.018 1
1 1731 . 7 2 2 B 60 60 LEU CA C 481 57.850 57.637 0.213 1
1 1732 . 7 2 2 B 60 60 LEU CB C 481 42.360 41.195 1.165 1
1 1736 . 7 2 2 B 60 60 LEU N N 481 120.560 119.348 1.212 1
1 1737 . 7 2 2 B 61 61 ILE H H 482 8.080 7.958 0.122 1
1 1738 . 7 2 2 B 61 61 ILE HA H 482 3.210 3.480 -0.270 1
1 1748 . 7 2 2 B 61 61 ILE CA C 482 66.250 65.184 1.066 1
1 1749 . 7 2 2 B 61 61 ILE CB C 482 39.400 38.140 1.260 1
1 1753 . 7 2 2 B 61 61 ILE N N 482 119.170 120.379 -1.209 1
1 1754 . 7 2 2 B 62 62 MET H H 483 8.110 8.194 -0.084 1
1 1755 . 7 2 2 B 62 62 MET HA H 483 4.410 4.194 0.216 1
1 1763 . 7 2 2 B 62 62 MET CA C 483 56.110 58.925 -2.815 1
1 1764 . 7 2 2 B 62 62 MET CB C 483 28.260 32.127 -3.867 1
1 1767 . 7 2 2 B 62 62 MET N N 483 114.420 117.744 -3.324 1
1 1768 . 7 2 2 B 63 63 ALA H H 484 8.240 7.905 0.335 1
1 1769 . 7 2 2 B 63 63 ALA HA H 484 4.130 4.090 0.040 1
1 1773 . 7 2 2 B 63 63 ALA CA C 484 55.300 55.183 0.117 1
1 1774 . 7 2 2 B 63 63 ALA CB C 484 18.280 18.331 -0.051 1
1 1775 . 7 2 2 B 63 63 ALA N N 484 123.710 121.376 2.334 1
1 1776 . 7 2 2 B 64 64 ALA H H 485 8.050 8.838 -0.788 1
1 1777 . 7 2 2 B 64 64 ALA HA H 485 3.870 4.053 -0.183 1
1 1781 . 7 2 2 B 64 64 ALA CA C 485 55.330 55.362 -0.032 1
1 1782 . 7 2 2 B 64 64 ALA CB C 485 17.660 18.344 -0.684 1
1 1783 . 7 2 2 B 64 64 ALA N N 485 120.070 119.577 0.493 1
1 1784 . 7 2 2 B 65 65 ARG H H 486 8.640 8.613 0.027 1
1 1785 . 7 2 2 B 65 65 ARG HA H 486 2.800 4.117 -1.317 1
1 1792 . 7 2 2 B 65 65 ARG CA C 486 60.600 59.462 1.138 1
1 1793 . 7 2 2 B 65 65 ARG CB C 486 29.910 30.064 -0.154 1
1 1796 . 7 2 2 B 65 65 ARG N N 486 118.730 118.683 0.047 1
1 1797 . 7 2 2 B 66 66 ASN H H 487 8.710 8.616 0.094 1
1 1798 . 7 2 2 B 66 66 ASN HA H 487 4.550 4.513 0.037 1
1 1803 . 7 2 2 B 66 66 ASN CA C 487 56.390 56.287 0.103 1
1 1804 . 7 2 2 B 66 66 ASN CB C 487 37.970 38.590 -0.620 1
1 1805 . 7 2 2 B 66 66 ASN N N 487 119.170 118.072 1.098 1
1 1807 . 7 2 2 B 67 67 ILE H H 488 7.250 7.742 -0.492 1
1 1808 . 7 2 2 B 67 67 ILE HA H 488 3.810 4.051 -0.241 1
1 1818 . 7 2 2 B 67 67 ILE CA C 488 64.350 65.168 -0.818 1
1 1819 . 7 2 2 B 67 67 ILE CB C 488 39.570 37.688 1.882 1
1 1823 . 7 2 2 B 67 67 ILE N N 488 117.890 119.882 -1.992 1
1 1824 . 7 2 2 B 68 68 CYS H H 489 8.350 8.004 0.346 1
1 1825 . 7 2 2 B 68 68 CYS HA H 489 4.080 3.945 0.135 1
1 1828 . 7 2 2 B 68 68 CYS CA C 489 62.670 62.861 -0.191 1
1 1829 . 7 2 2 B 68 68 CYS CB C 489 28.170 26.397 1.773 1
1 1830 . 7 2 2 B 68 68 CYS N N 489 115.230 120.662 -5.432 1
1 1831 . 7 2 2 B 69 69 TRP H H 490 8.230 8.103 0.127 1
1 1832 . 7 2 2 B 69 69 TRP HA H 490 5.100 4.282 0.818 1
1 1841 . 7 2 2 B 69 69 TRP CA C 490 55.420 60.578 -5.158 1
1 1842 . 7 2 2 B 69 69 TRP CB C 490 31.010 29.157 1.853 1
1 1844 . 7 2 2 B 69 69 TRP N N 490 116.850 120.729 -3.879 1
1 1846 . 7 2 2 B 70 70 PHE H H 491 7.570 8.272 -0.702 1
1 1847 . 7 2 2 B 70 70 PHE HA H 491 5.240 4.434 0.806 1
1 1852 . 7 2 2 B 70 70 PHE CA C 491 55.490 60.088 -4.598 1
1 1853 . 7 2 2 B 70 70 PHE CB C 491 38.700 37.266 1.434 1
1 1856 . 7 2 2 B 70 70 PHE N N 491 117.460 118.408 -0.948 1
1 1857 . 7 2 2 B 71 71 GLY H H 492 8.420 8.417 0.003 1
1 1858 . 7 2 2 B 71 71 GLY HA2 H 492 3.920 3.773 0.147 1
1 1859 . 7 2 2 B 71 71 GLY HA3 H 492 4.080 3.806 0.274 1
1 1860 . 7 2 2 B 71 71 GLY CA C 492 46.210 47.164 -0.954 1
1 1861 . 7 2 2 B 71 71 GLY N N 492 110.040 107.763 2.277 1
1 1862 . 7 2 2 B 72 72 ASP H H 493 8.370 8.266 0.104 1
1 1863 . 7 2 2 B 72 72 ASP HA H 493 4.630 4.307 0.323 1
1 1866 . 7 2 2 B 72 72 ASP CA C 493 54.410 57.504 -3.094 1
1 1867 . 7 2 2 B 72 72 ASP CB C 493 41.250 41.820 -0.570 1
1 1868 . 7 2 2 B 72 72 ASP N N 493 120.000 121.910 -1.910 1
1 1869 . 7 2 2 B 73 73 GLU H H 494 8.230 7.962 0.268 1
1 1870 . 7 2 2 B 73 73 GLU HA H 494 4.260 4.043 0.217 1
1 1875 . 7 2 2 B 73 73 GLU CA C 494 56.510 59.416 -2.906 1
1 1876 . 7 2 2 B 73 73 GLU CB C 494 30.420 29.362 1.058 1
1 1878 . 7 2 2 B 73 73 GLU N N 494 120.900 118.566 2.334 1
1 216 . 8 1 1 A 20 20 ASP H H 250 8.550 8.458 0.092 1
1 217 . 8 1 1 A 20 20 ASP HA H 250 4.700 4.670 0.030 1
1 220 . 8 1 1 A 20 20 ASP CA C 250 52.650 52.862 -0.212 1
1 221 . 8 1 1 A 20 20 ASP CB C 250 41.420 41.298 0.122 1
1 222 . 8 1 1 A 20 20 ASP N N 250 125.190 125.461 -0.271 1
1 223 . 8 1 1 A 21 21 PRO HA H 251 4.250 4.401 -0.151 1
1 230 . 8 1 1 A 21 21 PRO CA C 251 65.120 64.795 0.325 1
1 231 . 8 1 1 A 21 21 PRO CB C 251 32.310 32.155 0.155 1
1 234 . 8 1 1 A 22 22 ILE H H 252 8.630 7.846 0.784 1
1 235 . 8 1 1 A 22 22 ILE HA H 252 4.060 3.944 0.116 1
1 245 . 8 1 1 A 22 22 ILE CA C 252 62.990 63.528 -0.538 1
1 246 . 8 1 1 A 22 22 ILE CB C 252 37.520 37.880 -0.360 1
1 250 . 8 1 1 A 22 22 ILE N N 252 119.860 117.187 2.673 1
1 251 . 8 1 1 A 23 23 LEU H H 253 7.950 7.813 0.137 1
1 252 . 8 1 1 A 23 23 LEU HA H 253 3.710 4.195 -0.485 1
1 262 . 8 1 1 A 23 23 LEU CA C 253 56.510 57.922 -1.412 1
1 263 . 8 1 1 A 23 23 LEU CB C 253 41.190 41.637 -0.447 1
1 266 . 8 1 1 A 23 23 LEU N N 253 116.850 121.289 -4.439 1
1 267 . 8 1 1 A 24 24 LEU H H 254 7.370 7.891 -0.521 1
1 268 . 8 1 1 A 24 24 LEU HA H 254 4.310 4.664 -0.354 1
1 278 . 8 1 1 A 24 24 LEU CA C 254 54.890 56.537 -1.647 1
1 279 . 8 1 1 A 24 24 LEU CB C 254 41.960 42.467 -0.507 1
1 283 . 8 1 1 A 24 24 LEU N N 254 115.210 119.882 -4.672 1
1 284 . 8 1 1 A 25 25 ARG H H 255 7.520 7.827 -0.307 1
1 285 . 8 1 1 A 25 25 ARG HA H 255 4.660 4.371 0.289 1
1 293 . 8 1 1 A 25 25 ARG CA C 255 52.840 53.912 -1.072 1
1 294 . 8 1 1 A 25 25 ARG CB C 255 28.130 29.939 -1.809 1
1 297 . 8 1 1 A 25 25 ARG N N 255 118.180 119.177 -0.997 1
1 298 . 8 1 1 A 26 26 PRO HA H 256 4.800 4.319 0.481 1
1 305 . 8 1 1 A 26 26 PRO CA C 256 61.790 62.555 -0.765 1
1 306 . 8 1 1 A 26 26 PRO CB C 256 32.660 31.992 0.668 1
1 309 . 8 1 1 A 27 27 VAL H H 257 8.170 8.393 -0.223 1
1 310 . 8 1 1 A 27 27 VAL HA H 257 3.590 3.732 -0.142 1
1 318 . 8 1 1 A 27 27 VAL CA C 257 64.830 65.400 -0.570 1
1 319 . 8 1 1 A 27 27 VAL CB C 257 31.720 31.413 0.307 1
1 322 . 8 1 1 A 27 27 VAL N N 257 115.710 124.241 -8.531 1
1 323 . 8 1 1 A 28 28 ASP H H 258 8.240 8.033 0.207 1
1 324 . 8 1 1 A 28 28 ASP HA H 258 4.340 4.381 -0.041 1
1 327 . 8 1 1 A 28 28 ASP CA C 258 56.490 57.330 -0.840 1
1 328 . 8 1 1 A 28 28 ASP CB C 258 40.520 40.126 0.394 1
1 329 . 8 1 1 A 28 28 ASP N N 258 119.000 121.551 -2.551 1
1 330 . 8 1 1 A 29 29 ASP H H 259 8.000 8.821 -0.821 1
1 331 . 8 1 1 A 29 29 ASP HA H 259 4.390 4.613 -0.223 1
1 334 . 8 1 1 A 29 29 ASP CA C 259 56.210 55.367 0.843 1
1 335 . 8 1 1 A 29 29 ASP CB C 259 40.670 41.054 -0.384 1
1 336 . 8 1 1 A 29 29 ASP N N 259 118.900 117.629 1.271 1
1 337 . 8 1 1 A 30 30 LEU H H 260 7.760 7.335 0.425 1
1 338 . 8 1 1 A 30 30 LEU HA H 260 3.990 4.223 -0.233 1
1 348 . 8 1 1 A 30 30 LEU CA C 260 55.000 55.316 -0.316 1
1 349 . 8 1 1 A 30 30 LEU CB C 260 41.670 42.005 -0.335 1
1 353 . 8 1 1 A 30 30 LEU N N 260 116.300 121.277 -4.977 1
1 354 . 8 1 1 A 31 31 GLU H H 261 7.990 8.739 -0.749 1
1 355 . 8 1 1 A 31 31 GLU HA H 261 4.280 4.129 0.151 1
1 358 . 8 1 1 A 31 31 GLU CA C 261 56.860 59.111 -2.251 1
1 359 . 8 1 1 A 31 31 GLU CB C 261 27.010 29.560 -2.550 1
1 360 . 8 1 1 A 31 31 GLU N N 261 115.620 122.723 -7.103 1
1 361 . 8 1 1 A 32 32 LEU H H 262 8.000 7.332 0.668 1
1 362 . 8 1 1 A 32 32 LEU HA H 262 4.400 4.310 0.090 1
1 372 . 8 1 1 A 32 32 LEU CA C 262 53.860 54.891 -1.031 1
1 373 . 8 1 1 A 32 32 LEU CB C 262 44.450 42.260 2.190 1
1 377 . 8 1 1 A 32 32 LEU N N 262 118.860 122.212 -3.352 1
1 378 . 8 1 1 A 33 33 THR H H 263 10.020 8.615 1.405 1
1 379 . 8 1 1 A 33 33 THR HA H 263 4.130 4.600 -0.470 1
1 384 . 8 1 1 A 33 33 THR CA C 263 62.400 60.893 1.507 1
1 385 . 8 1 1 A 33 33 THR CB C 263 71.270 71.219 0.051 1
1 387 . 8 1 1 A 33 33 THR N N 263 114.610 114.328 0.282 1
1 388 . 8 1 1 A 34 34 VAL H H 264 8.370 8.729 -0.359 1
1 389 . 8 1 1 A 34 34 VAL HA H 264 3.620 3.661 -0.041 1
1 397 . 8 1 1 A 34 34 VAL CA C 264 66.340 66.469 -0.129 1
1 398 . 8 1 1 A 34 34 VAL CB C 264 31.670 31.414 0.256 1
1 401 . 8 1 1 A 34 34 VAL N N 264 122.110 122.152 -0.042 1
1 402 . 8 1 1 A 35 35 ARG H H 265 8.190 8.206 -0.016 1
1 403 . 8 1 1 A 35 35 ARG HA H 265 4.070 3.924 0.146 1
1 411 . 8 1 1 A 35 35 ARG CA C 265 59.470 59.790 -0.320 1
1 412 . 8 1 1 A 35 35 ARG CB C 265 29.790 30.055 -0.265 1
1 415 . 8 1 1 A 35 35 ARG N N 265 117.340 121.525 -4.185 1
1 416 . 8 1 1 A 36 36 SER H H 266 7.610 8.023 -0.413 1
1 417 . 8 1 1 A 36 36 SER HA H 266 4.080 4.206 -0.126 1
1 420 . 8 1 1 A 36 36 SER CA C 266 63.080 61.365 1.715 1
1 421 . 8 1 1 A 36 36 SER CB C 266 63.280 62.300 0.980 1
1 422 . 8 1 1 A 36 36 SER N N 266 116.710 115.313 1.397 1
1 423 . 8 1 1 A 37 37 ALA H H 267 8.720 7.666 1.054 1
1 424 . 8 1 1 A 37 37 ALA HA H 267 3.760 3.985 -0.225 1
1 428 . 8 1 1 A 37 37 ALA CA C 267 55.900 55.385 0.515 1
1 429 . 8 1 1 A 37 37 ALA CB C 267 18.090 17.855 0.235 1
1 430 . 8 1 1 A 37 37 ALA N N 267 124.170 123.428 0.742 1
1 431 . 8 1 1 A 38 38 ASN H H 268 8.850 9.421 -0.571 1
1 432 . 8 1 1 A 38 38 ASN HA H 268 4.420 4.461 -0.041 1
1 437 . 8 1 1 A 38 38 ASN CA C 268 55.700 56.353 -0.653 1
1 438 . 8 1 1 A 38 38 ASN CB C 268 37.180 37.979 -0.799 1
1 439 . 8 1 1 A 38 38 ASN N N 268 117.370 117.597 -0.227 1
1 441 . 8 1 1 A 39 39 CYS H H 269 7.970 7.842 0.128 1
1 442 . 8 1 1 A 39 39 CYS HA H 269 4.190 4.105 0.085 1
1 445 . 8 1 1 A 39 39 CYS CA C 269 63.340 62.968 0.372 1
1 446 . 8 1 1 A 39 39 CYS CB C 269 26.870 27.159 -0.289 1
1 447 . 8 1 1 A 39 39 CYS N N 269 120.510 118.881 1.629 1
1 448 . 8 1 1 A 40 40 LEU H H 270 7.600 7.737 -0.137 1
1 449 . 8 1 1 A 40 40 LEU HA H 270 3.880 3.918 -0.038 1
1 458 . 8 1 1 A 40 40 LEU CA C 270 57.810 58.133 -0.323 1
1 459 . 8 1 1 A 40 40 LEU CB C 270 40.030 41.656 -1.626 1
1 462 . 8 1 1 A 40 40 LEU N N 270 117.710 120.507 -2.797 1
1 463 . 8 1 1 A 41 41 LYS H H 271 7.980 8.213 -0.233 1
1 464 . 8 1 1 A 41 41 LYS HA H 271 3.820 4.412 -0.592 1
1 472 . 8 1 1 A 41 41 LYS CA C 271 59.840 59.435 0.405 1
1 473 . 8 1 1 A 41 41 LYS CB C 271 32.070 32.103 -0.033 1
1 476 . 8 1 1 A 41 41 LYS N N 271 120.070 117.491 2.579 1
1 477 . 8 1 1 A 42 42 ALA H H 272 7.860 8.222 -0.362 1
1 478 . 8 1 1 A 42 42 ALA HA H 272 4.140 3.998 0.142 1
1 482 . 8 1 1 A 42 42 ALA CA C 272 54.670 54.881 -0.211 1
1 483 . 8 1 1 A 42 42 ALA CB C 272 17.950 18.693 -0.743 1
1 484 . 8 1 1 A 42 42 ALA N N 272 122.880 120.498 2.382 1
1 485 . 8 1 1 A 43 43 GLU H H 273 7.210 7.851 -0.641 1
1 486 . 8 1 1 A 43 43 GLU HA H 273 4.260 4.444 -0.184 1
1 491 . 8 1 1 A 43 43 GLU CA C 273 55.020 55.944 -0.924 1
1 492 . 8 1 1 A 43 43 GLU CB C 273 29.880 29.514 0.366 1
1 494 . 8 1 1 A 43 43 GLU N N 273 116.590 115.281 1.309 1
1 495 . 8 1 1 A 44 44 ALA H H 274 7.880 8.273 -0.393 1
1 496 . 8 1 1 A 44 44 ALA HA H 274 3.680 3.895 -0.215 1
1 500 . 8 1 1 A 44 44 ALA CA C 274 52.960 53.133 -0.173 1
1 501 . 8 1 1 A 44 44 ALA CB C 274 16.110 17.172 -1.062 1
1 502 . 8 1 1 A 44 44 ALA N N 274 118.420 118.794 -0.374 1
1 503 . 8 1 1 A 45 45 ILE H H 275 7.600 7.549 0.051 1
1 504 . 8 1 1 A 45 45 ILE HA H 275 3.870 4.531 -0.661 1
1 514 . 8 1 1 A 45 45 ILE CA C 275 61.150 60.518 0.632 1
1 515 . 8 1 1 A 45 45 ILE CB C 275 37.090 40.120 -3.030 1
1 519 . 8 1 1 A 45 45 ILE N N 275 120.370 118.474 1.896 1
1 520 . 8 1 1 A 46 46 HIS H H 276 8.350 8.237 0.113 1
1 521 . 8 1 1 A 46 46 HIS HA H 276 4.600 4.882 -0.282 1
1 526 . 8 1 1 A 46 46 HIS CA C 276 56.900 55.901 0.999 1
1 527 . 8 1 1 A 46 46 HIS CB C 276 31.910 31.177 0.733 1
1 529 . 8 1 1 A 46 46 HIS N N 276 123.250 122.329 0.921 1
1 530 . 8 1 1 A 47 47 TYR H H 277 8.850 7.057 1.793 1
1 531 . 8 1 1 A 47 47 TYR HA H 277 5.100 4.539 0.561 1
1 538 . 8 1 1 A 47 47 TYR CA C 277 57.430 56.868 0.562 1
1 539 . 8 1 1 A 47 47 TYR CB C 277 40.680 39.751 0.929 1
1 544 . 8 1 1 A 47 47 TYR N N 277 119.700 118.009 1.691 1
1 545 . 8 1 1 A 48 48 ILE H H 278 9.380 8.335 1.045 1
1 546 . 8 1 1 A 48 48 ILE HA H 278 3.340 3.627 -0.287 1
1 554 . 8 1 1 A 48 48 ILE CA C 278 67.640 65.046 2.594 1
1 555 . 8 1 1 A 48 48 ILE CB C 278 36.310 37.629 -1.319 1
1 558 . 8 1 1 A 48 48 ILE N N 278 125.650 124.265 1.385 1
1 559 . 8 1 1 A 49 49 GLY H H 279 9.430 8.076 1.354 1
1 560 . 8 1 1 A 49 49 GLY HA2 H 279 2.370 2.223 0.147 1
1 561 . 8 1 1 A 49 49 GLY HA3 H 279 3.230 3.561 -0.331 1
1 562 . 8 1 1 A 49 49 GLY CA C 279 46.820 46.874 -0.054 1
1 563 . 8 1 1 A 49 49 GLY N N 279 105.200 108.640 -3.440 1
1 564 . 8 1 1 A 50 50 ASP H H 280 7.050 7.513 -0.463 1
1 565 . 8 1 1 A 50 50 ASP HA H 280 4.360 4.088 0.272 1
1 568 . 8 1 1 A 50 50 ASP CA C 280 57.110 56.238 0.872 1
1 569 . 8 1 1 A 50 50 ASP CB C 280 42.620 40.492 2.128 1
1 570 . 8 1 1 A 50 50 ASP N N 280 116.360 120.787 -4.427 1
1 571 . 8 1 1 A 51 51 LEU H H 281 7.170 8.160 -0.990 1
1 572 . 8 1 1 A 51 51 LEU HA H 281 3.880 3.948 -0.068 1
1 582 . 8 1 1 A 51 51 LEU CA C 281 57.900 58.288 -0.388 1
1 583 . 8 1 1 A 51 51 LEU CB C 281 41.870 41.413 0.457 1
1 587 . 8 1 1 A 51 51 LEU N N 281 120.130 122.048 -1.918 1
1 588 . 8 1 1 A 52 52 VAL H H 282 7.820 7.591 0.229 1
1 589 . 8 1 1 A 52 52 VAL HA H 282 3.980 3.890 0.090 1
1 597 . 8 1 1 A 52 52 VAL CA C 282 64.000 65.438 -1.438 1
1 598 . 8 1 1 A 52 52 VAL CB C 282 30.400 31.516 -1.116 1
1 601 . 8 1 1 A 52 52 VAL N N 282 105.550 115.580 -10.030 1
1 602 . 8 1 1 A 53 53 GLN H H 283 6.550 7.823 -1.273 1
1 603 . 8 1 1 A 53 53 GLN HA H 283 4.680 4.062 0.618 1
1 610 . 8 1 1 A 53 53 GLN CA C 283 56.210 58.834 -2.624 1
1 611 . 8 1 1 A 53 53 GLN CB C 283 31.710 28.520 3.190 1
1 613 . 8 1 1 A 53 53 GLN N N 283 114.060 121.481 -7.421 1
1 615 . 8 1 1 A 54 54 ARG H H 284 7.690 7.495 0.195 1
1 616 . 8 1 1 A 54 54 ARG HA H 284 4.520 4.820 -0.300 1
1 624 . 8 1 1 A 54 54 ARG CA C 284 54.600 54.115 0.485 1
1 625 . 8 1 1 A 54 54 ARG CB C 284 30.750 32.497 -1.747 1
1 628 . 8 1 1 A 54 54 ARG N N 284 119.810 118.394 1.416 1
1 629 . 8 1 1 A 55 55 THR H H 285 8.110 8.839 -0.729 1
1 630 . 8 1 1 A 55 55 THR HA H 285 4.430 4.678 -0.248 1
1 635 . 8 1 1 A 55 55 THR CA C 285 59.640 60.611 -0.971 1
1 636 . 8 1 1 A 55 55 THR CB C 285 71.310 71.127 0.183 1
1 638 . 8 1 1 A 55 55 THR N N 285 108.450 113.547 -5.097 1
1 639 . 8 1 1 A 56 56 GLU H H 286 8.910 9.106 -0.196 1
1 640 . 8 1 1 A 56 56 GLU HA H 286 3.660 4.045 -0.385 1
1 645 . 8 1 1 A 56 56 GLU CA C 286 60.650 59.581 1.069 1
1 646 . 8 1 1 A 56 56 GLU CB C 286 29.400 29.133 0.267 1
1 648 . 8 1 1 A 56 56 GLU N N 286 120.600 121.558 -0.958 1
1 649 . 8 1 1 A 57 57 VAL H H 287 7.600 8.084 -0.484 1
1 650 . 8 1 1 A 57 57 VAL HA H 287 3.620 3.531 0.089 1
1 658 . 8 1 1 A 57 57 VAL CA C 287 66.020 67.129 -1.109 1
1 659 . 8 1 1 A 57 57 VAL CB C 287 31.720 31.575 0.145 1
1 662 . 8 1 1 A 57 57 VAL N N 287 114.050 120.459 -6.409 1
1 663 . 8 1 1 A 58 58 GLU H H 288 7.350 8.004 -0.654 1
1 664 . 8 1 1 A 58 58 GLU HA H 288 3.830 4.081 -0.251 1
1 669 . 8 1 1 A 58 58 GLU CA C 288 59.250 59.553 -0.303 1
1 670 . 8 1 1 A 58 58 GLU CB C 288 30.030 29.072 0.958 1
1 672 . 8 1 1 A 58 58 GLU N N 288 117.610 119.058 -1.448 1
1 673 . 8 1 1 A 59 59 LEU H H 289 7.850 7.541 0.309 1
1 674 . 8 1 1 A 59 59 LEU HA H 289 4.150 4.070 0.080 1
1 683 . 8 1 1 A 59 59 LEU CA C 289 57.340 57.745 -0.405 1
1 684 . 8 1 1 A 59 59 LEU CB C 289 41.170 41.392 -0.222 1
1 687 . 8 1 1 A 59 59 LEU N N 289 120.050 120.457 -0.407 1
1 688 . 8 1 1 A 60 60 LEU H H 290 7.670 8.447 -0.777 1
1 689 . 8 1 1 A 60 60 LEU HA H 290 4.540 3.960 0.580 1
1 696 . 8 1 1 A 60 60 LEU CA C 290 55.090 58.139 -3.049 1
1 697 . 8 1 1 A 60 60 LEU CB C 290 42.320 41.729 0.591 1
1 701 . 8 1 1 A 60 60 LEU N N 290 114.980 119.831 -4.851 1
1 702 . 8 1 1 A 61 61 LYS H H 291 7.440 7.441 -0.001 1
1 703 . 8 1 1 A 61 61 LYS HA H 291 4.280 4.275 0.005 1
1 710 . 8 1 1 A 61 61 LYS CA C 291 56.860 57.534 -0.674 1
1 711 . 8 1 1 A 61 61 LYS CB C 291 31.900 32.901 -1.001 1
1 714 . 8 1 1 A 61 61 LYS N N 291 118.120 118.004 0.116 1
1 715 . 8 1 1 A 62 62 THR H H 292 7.310 7.848 -0.538 1
1 716 . 8 1 1 A 62 62 THR HA H 292 5.220 4.417 0.803 1
1 721 . 8 1 1 A 62 62 THR CA C 292 55.830 59.814 -3.984 1
1 722 . 8 1 1 A 62 62 THR CB C 292 69.970 69.113 0.857 1
1 724 . 8 1 1 A 62 62 THR N N 292 111.890 115.145 -3.255 1
1 725 . 8 1 1 A 63 63 PRO HA H 293 4.570 4.477 0.093 1
1 730 . 8 1 1 A 63 63 PRO CA C 293 63.710 64.167 -0.457 1
1 731 . 8 1 1 A 63 63 PRO CB C 293 32.380 31.920 0.460 1
1 733 . 8 1 1 A 64 64 ASN H H 294 8.050 8.919 -0.869 1
1 734 . 8 1 1 A 64 64 ASN HA H 294 4.490 4.418 0.072 1
1 739 . 8 1 1 A 64 64 ASN CA C 294 55.630 56.184 -0.554 1
1 740 . 8 1 1 A 64 64 ASN CB C 294 38.730 38.184 0.546 1
1 741 . 8 1 1 A 64 64 ASN N N 294 117.120 117.305 -0.185 1
1 743 . 8 1 1 A 65 65 LEU H H 295 7.550 7.570 -0.020 1
1 744 . 8 1 1 A 65 65 LEU HA H 295 4.640 4.640 0.000 1
1 754 . 8 1 1 A 65 65 LEU CA C 295 54.310 53.482 0.828 1
1 755 . 8 1 1 A 65 65 LEU CB C 295 43.640 43.132 0.508 1
1 758 . 8 1 1 A 65 65 LEU N N 295 119.930 117.284 2.646 1
1 759 . 8 1 1 A 66 66 GLY H H 296 7.850 8.467 -0.617 1
1 760 . 8 1 1 A 66 66 GLY HA2 H 296 3.810 4.096 -0.286 1
1 761 . 8 1 1 A 66 66 GLY HA3 H 296 4.110 4.096 0.014 1
1 762 . 8 1 1 A 66 66 GLY CA C 296 43.570 44.659 -1.089 1
1 763 . 8 1 1 A 66 66 GLY N N 296 108.840 107.609 1.231 1
1 764 . 8 1 1 A 67 67 LYS H H 297 8.820 8.696 0.124 1
1 765 . 8 1 1 A 67 67 LYS HA H 297 3.980 3.938 0.042 1
1 774 . 8 1 1 A 67 67 LYS CA C 297 60.100 59.071 1.029 1
1 775 . 8 1 1 A 67 67 LYS CB C 297 32.100 32.084 0.016 1
1 779 . 8 1 1 A 67 67 LYS N N 297 120.130 120.123 0.007 1
1 780 . 8 1 1 A 68 68 LYS H H 298 8.850 7.910 0.940 1
1 781 . 8 1 1 A 68 68 LYS HA H 298 4.060 4.056 0.004 1
1 790 . 8 1 1 A 68 68 LYS CA C 298 60.600 59.132 1.468 1
1 791 . 8 1 1 A 68 68 LYS CB C 298 31.920 32.232 -0.312 1
1 795 . 8 1 1 A 68 68 LYS N N 298 119.580 119.418 0.162 1
1 796 . 8 1 1 A 69 69 SER H H 299 8.100 8.021 0.079 1
1 797 . 8 1 1 A 69 69 SER HA H 299 4.370 4.062 0.308 1
1 800 . 8 1 1 A 69 69 SER CA C 299 61.980 62.534 -0.554 1
1 801 . 8 1 1 A 69 69 SER CB C 299 63.000 62.940 0.060 1
1 802 . 8 1 1 A 69 69 SER N N 299 116.360 116.918 -0.558 1
1 803 . 8 1 1 A 70 70 LEU H H 300 8.240 7.710 0.530 1
1 804 . 8 1 1 A 70 70 LEU HA H 300 3.970 4.053 -0.083 1
1 814 . 8 1 1 A 70 70 LEU CA C 300 57.610 57.920 -0.310 1
1 815 . 8 1 1 A 70 70 LEU CB C 300 41.060 41.718 -0.658 1
1 819 . 8 1 1 A 70 70 LEU N N 300 123.330 122.901 0.429 1
1 820 . 8 1 1 A 71 71 THR H H 301 8.550 7.843 0.707 1
1 821 . 8 1 1 A 71 71 THR HA H 301 3.690 3.914 -0.224 1
1 826 . 8 1 1 A 71 71 THR CA C 301 67.170 67.519 -0.349 1
1 827 . 8 1 1 A 71 71 THR CB C 301 68.810 68.303 0.507 1
1 829 . 8 1 1 A 71 71 THR N N 301 116.520 115.266 1.254 1
1 830 . 8 1 1 A 72 72 GLU H H 302 7.520 7.675 -0.155 1
1 831 . 8 1 1 A 72 72 GLU HA H 302 4.070 4.070 0.000 1
1 836 . 8 1 1 A 72 72 GLU CA C 302 59.470 59.236 0.234 1
1 837 . 8 1 1 A 72 72 GLU CB C 302 29.090 29.571 -0.481 1
1 839 . 8 1 1 A 72 72 GLU N N 302 121.510 119.700 1.810 1
1 840 . 8 1 1 A 73 73 ILE H H 303 8.290 8.267 0.023 1
1 841 . 8 1 1 A 73 73 ILE HA H 303 3.380 3.602 -0.222 1
1 849 . 8 1 1 A 73 73 ILE CA C 303 66.010 65.154 0.856 1
1 850 . 8 1 1 A 73 73 ILE CB C 303 38.680 38.107 0.573 1
1 853 . 8 1 1 A 73 73 ILE N N 303 118.510 121.053 -2.543 1
1 854 . 8 1 1 A 74 74 LYS H H 304 8.550 8.245 0.305 1
1 855 . 8 1 1 A 74 74 LYS HA H 304 3.680 3.879 -0.199 1
1 864 . 8 1 1 A 74 74 LYS CA C 304 61.320 60.200 1.120 1
1 865 . 8 1 1 A 74 74 LYS CB C 304 32.060 32.150 -0.090 1
1 868 . 8 1 1 A 74 74 LYS N N 304 118.220 118.918 -0.698 1
1 869 . 8 1 1 A 75 75 ASP H H 305 8.450 7.915 0.535 1
1 870 . 8 1 1 A 75 75 ASP HA H 305 4.440 4.431 0.009 1
1 873 . 8 1 1 A 75 75 ASP CA C 305 57.690 57.112 0.578 1
1 874 . 8 1 1 A 75 75 ASP CB C 305 40.220 40.992 -0.772 1
1 875 . 8 1 1 A 75 75 ASP N N 305 121.790 119.433 2.357 1
1 876 . 8 1 1 A 76 76 VAL H H 306 8.680 7.786 0.894 1
1 877 . 8 1 1 A 76 76 VAL HA H 306 3.890 3.640 0.250 1
1 885 . 8 1 1 A 76 76 VAL CA C 306 66.020 66.268 -0.248 1
1 886 . 8 1 1 A 76 76 VAL CB C 306 31.250 31.442 -0.192 1
1 889 . 8 1 1 A 76 76 VAL N N 306 121.150 119.713 1.437 1
1 890 . 8 1 1 A 77 77 LEU H H 307 8.470 9.240 -0.770 1
1 891 . 8 1 1 A 77 77 LEU HA H 307 3.810 4.167 -0.357 1
1 901 . 8 1 1 A 77 77 LEU CA C 307 58.330 57.089 1.241 1
1 902 . 8 1 1 A 77 77 LEU CB C 307 41.250 40.800 0.450 1
1 906 . 8 1 1 A 77 77 LEU N N 307 120.830 119.200 1.630 1
1 907 . 8 1 1 A 78 78 ALA H H 308 8.280 8.547 -0.267 1
1 908 . 8 1 1 A 78 78 ALA HA H 308 4.320 4.112 0.208 1
1 912 . 8 1 1 A 78 78 ALA CA C 308 55.420 55.039 0.381 1
1 913 . 8 1 1 A 78 78 ALA CB C 308 17.750 18.161 -0.411 1
1 914 . 8 1 1 A 78 78 ALA N N 308 122.530 123.192 -0.662 1
1 915 . 8 1 1 A 79 79 SER H H 309 7.900 7.524 0.376 1
1 916 . 8 1 1 A 79 79 SER HA H 309 4.340 4.508 -0.168 1
1 919 . 8 1 1 A 79 79 SER CA C 309 61.350 58.472 2.878 1
1 920 . 8 1 1 A 79 79 SER CB C 309 63.280 63.645 -0.365 1
1 921 . 8 1 1 A 79 79 SER N N 309 115.600 112.729 2.871 1
1 922 . 8 1 1 A 80 80 ARG H H 310 7.450 8.285 -0.835 1
1 923 . 8 1 1 A 80 80 ARG HA H 310 4.550 3.989 0.561 1
1 931 . 8 1 1 A 80 80 ARG CA C 310 54.200 57.440 -3.240 1
1 932 . 8 1 1 A 80 80 ARG CB C 310 30.680 27.622 3.058 1
1 935 . 8 1 1 A 80 80 ARG N N 310 119.360 117.133 2.227 1
1 936 . 8 1 1 A 81 81 GLY H H 311 7.940 8.162 -0.222 1
1 937 . 8 1 1 A 81 81 GLY HA2 H 311 3.840 3.891 -0.051 1
1 938 . 8 1 1 A 81 81 GLY HA3 H 311 4.070 3.895 0.175 1
1 939 . 8 1 1 A 81 81 GLY CA C 311 46.060 46.296 -0.236 1
1 940 . 8 1 1 A 81 81 GLY N N 311 108.130 107.715 0.415 1
1 941 . 8 1 1 A 82 82 LEU H H 312 7.920 7.717 0.203 1
1 942 . 8 1 1 A 82 82 LEU HA H 312 4.680 4.647 0.033 1
1 952 . 8 1 1 A 82 82 LEU CA C 312 53.070 53.189 -0.119 1
1 953 . 8 1 1 A 82 82 LEU CB C 312 45.790 45.228 0.562 1
1 957 . 8 1 1 A 82 82 LEU N N 312 119.290 120.868 -1.578 1
1 958 . 8 1 1 A 83 83 SER H H 313 7.530 8.693 -1.163 1
1 959 . 8 1 1 A 83 83 SER HA H 313 4.450 4.014 0.436 1
1 962 . 8 1 1 A 83 83 SER CA C 313 57.190 58.916 -1.726 1
1 963 . 8 1 1 A 83 83 SER CB C 313 66.080 61.500 4.580 1
1 964 . 8 1 1 A 83 83 SER N N 313 113.120 115.444 -2.324 1
1 965 . 8 1 1 A 84 84 LEU H H 314 8.340 8.422 -0.082 1
1 966 . 8 1 1 A 84 84 LEU HA H 314 4.620 4.436 0.184 1
1 976 . 8 1 1 A 84 84 LEU CA C 314 54.720 54.671 0.049 1
1 977 . 8 1 1 A 84 84 LEU CB C 314 41.620 42.282 -0.662 1
1 981 . 8 1 1 A 84 84 LEU N N 314 115.930 119.220 -3.290 1
1 982 . 8 1 1 A 85 85 GLY H H 315 8.270 8.007 0.263 1
1 983 . 8 1 1 A 85 85 GLY HA2 H 315 3.320 3.970 -0.650 1
1 984 . 8 1 1 A 85 85 GLY HA3 H 315 3.850 3.973 -0.123 1
1 985 . 8 1 1 A 85 85 GLY CA C 315 46.560 46.388 0.172 1
1 986 . 8 1 1 A 85 85 GLY N N 315 111.010 108.116 2.894 1
1 987 . 8 1 1 A 86 86 MET H H 316 8.650 7.886 0.764 1
1 988 . 8 1 1 A 86 86 MET HA H 316 3.990 5.108 -1.118 1
1 996 . 8 1 1 A 86 86 MET CA C 316 56.730 53.341 3.389 1
1 997 . 8 1 1 A 86 86 MET CB C 316 33.600 35.239 -1.639 1
1 1000 . 8 1 1 A 86 86 MET N N 316 120.570 117.358 3.212 1
1 1001 . 8 1 1 A 87 87 ARG H H 317 8.360 9.028 -0.668 1
1 1002 . 8 1 1 A 87 87 ARG HA H 317 4.450 5.235 -0.785 1
1 1010 . 8 1 1 A 87 87 ARG CA C 317 55.310 54.573 0.737 1
1 1011 . 8 1 1 A 87 87 ARG CB C 317 30.490 34.049 -3.559 1
1 1014 . 8 1 1 A 87 87 ARG N N 317 122.290 119.879 2.411 1
1 1015 . 8 1 1 A 88 88 LEU H H 318 8.400 8.869 -0.469 1
1 1016 . 8 1 1 A 88 88 LEU HA H 318 4.670 4.995 -0.325 1
1 1026 . 8 1 1 A 88 88 LEU CA C 318 53.110 53.209 -0.099 1
1 1027 . 8 1 1 A 88 88 LEU CB C 318 43.600 44.721 -1.121 1
1 1031 . 8 1 1 A 88 88 LEU N N 318 126.420 124.079 2.341 1
1 1032 . 8 1 1 A 89 89 GLU H H 319 8.780 9.009 -0.229 1
1 1033 . 8 1 1 A 89 89 GLU HA H 319 4.340 3.977 0.363 1
1 1038 . 8 1 1 A 89 89 GLU CA C 319 56.490 59.653 -3.163 1
1 1039 . 8 1 1 A 89 89 GLU CB C 319 30.470 29.630 0.840 1
1 1041 . 8 1 1 A 89 89 GLU N N 319 123.070 122.265 0.805 1
1 1042 . 8 1 1 A 90 90 ASN H H 320 8.900 8.231 0.669 1
1 1043 . 8 1 1 A 90 90 ASN HA H 320 4.410 4.995 -0.585 1
1 1048 . 8 1 1 A 90 90 ASN CA C 320 54.120 54.349 -0.229 1
1 1049 . 8 1 1 A 90 90 ASN CB C 320 37.640 39.759 -2.119 1
1 1050 . 8 1 1 A 90 90 ASN N N 320 116.540 113.299 3.241 1
1 1052 . 8 1 1 A 91 91 TRP H H 321 7.990 7.370 0.620 1
1 1053 . 8 1 1 A 91 91 TRP HA H 321 4.330 4.622 -0.292 1
1 1062 . 8 1 1 A 91 91 TRP CA C 321 54.590 58.364 -3.774 1
1 1063 . 8 1 1 A 91 91 TRP CB C 321 31.280 31.078 0.202 1
1 1069 . 8 1 1 A 91 91 TRP N N 321 119.230 114.541 4.689 1
1 1071 . 8 1 1 A 92 92 PRO HA H 322 4.800 3.858 0.942 1
1 1077 . 8 1 1 A 93 93 PRO HA H 323 4.450 4.469 -0.019 1
1 1084 . 8 1 1 A 93 93 PRO CA C 323 61.970 62.288 -0.318 1
1 1085 . 8 1 1 A 93 93 PRO CB C 323 32.830 32.618 0.212 1
1 1088 . 8 1 1 A 94 94 ALA H H 324 8.460 8.766 -0.306 1
1 1089 . 8 1 1 A 94 94 ALA HA H 324 4.000 3.989 0.011 1
1 1093 . 8 1 1 A 94 94 ALA CA C 324 53.790 54.544 -0.754 1
1 1094 . 8 1 1 A 94 94 ALA CB C 324 18.640 18.185 0.455 1
1 1095 . 8 1 1 A 94 94 ALA N N 324 124.010 126.233 -2.223 1
1 1096 . 8 1 1 A 95 95 SER H H 325 7.950 8.305 -0.355 1
1 1097 . 8 1 1 A 95 95 SER HA H 325 4.210 4.248 -0.038 1
1 1100 . 8 1 1 A 95 95 SER CA C 325 58.970 61.350 -2.380 1
1 1101 . 8 1 1 A 95 95 SER CB C 325 63.040 62.625 0.415 1
1 1102 . 8 1 1 A 95 95 SER N N 325 111.520 112.616 -1.096 1
1 1103 . 8 1 1 A 96 96 ILE H H 326 7.480 7.662 -0.182 1
1 1104 . 8 1 1 A 96 96 ILE HA H 326 4.170 4.144 0.026 1
1 1114 . 8 1 1 A 96 96 ILE CA C 326 61.300 61.444 -0.144 1
1 1115 . 8 1 1 A 96 96 ILE CB C 326 38.530 37.887 0.643 1
1 1119 . 8 1 1 A 96 96 ILE N N 326 119.650 118.877 0.773 1
1 1120 . 8 1 1 A 97 97 ALA H H 327 7.860 7.825 0.035 1
1 1121 . 8 1 1 A 97 97 ALA HA H 327 4.230 4.030 0.200 1
1 1125 . 8 1 1 A 97 97 ALA CA C 327 52.570 55.181 -2.611 1
1 1126 . 8 1 1 A 97 97 ALA CB C 327 19.590 18.133 1.457 1
1 1127 . 8 1 1 A 97 97 ALA N N 327 126.480 125.932 0.548 1
1 1128 . 8 1 1 A 98 98 ASP H H 328 8.250 8.400 -0.150 1
1 1129 . 8 1 1 A 98 98 ASP HA H 328 4.540 4.299 0.241 1
1 1132 . 8 1 1 A 98 98 ASP CA C 328 54.150 57.191 -3.041 1
1 1133 . 8 1 1 A 98 98 ASP CB C 328 41.120 40.094 1.026 1
1 1134 . 8 1 1 A 98 98 ASP N N 328 120.130 119.553 0.577 1
1 1150 . 8 2 2 B 6 6 ASP H H 427 8.160 8.651 -0.491 1
1 1151 . 8 2 2 B 6 6 ASP HA H 427 4.630 4.238 0.392 1
1 1154 . 8 2 2 B 6 6 ASP CA C 427 54.410 56.998 -2.588 1
1 1155 . 8 2 2 B 6 6 ASP CB C 427 41.250 40.695 0.555 1
1 1156 . 8 2 2 B 6 6 ASP N N 427 120.160 124.149 -3.989 1
1 1157 . 8 2 2 B 7 7 ASN H H 428 8.350 8.020 0.330 1
1 1158 . 8 2 2 B 7 7 ASN HA H 428 4.550 4.306 0.244 1
1 1163 . 8 2 2 B 7 7 ASN CA C 428 53.310 54.405 -1.095 1
1 1164 . 8 2 2 B 7 7 ASN CB C 428 38.850 36.931 1.919 1
1 1165 . 8 2 2 B 7 7 ASN N N 428 118.440 114.495 3.945 1
1 1167 . 8 2 2 B 8 8 LYS H H 429 8.030 7.966 0.064 1
1 1172 . 8 2 2 B 8 8 LYS CB C 429 33.280 32.607 0.673 1
1 1174 . 8 2 2 B 8 8 LYS N N 429 120.260 119.337 0.923 1
1 1175 . 8 2 2 B 9 9 PRO HA H 430 4.420 4.416 0.004 1
1 1182 . 8 2 2 B 9 9 PRO CA C 430 62.280 62.529 -0.249 1
1 1183 . 8 2 2 B 9 9 PRO CB C 430 31.920 31.941 -0.021 1
1 1186 . 8 2 2 B 10 10 ALA H H 431 8.930 9.175 -0.245 1
1 1187 . 8 2 2 B 10 10 ALA HA H 431 4.350 4.435 -0.085 1
1 1191 . 8 2 2 B 10 10 ALA CA C 431 51.070 52.083 -1.013 1
1 1192 . 8 2 2 B 10 10 ALA CB C 431 20.920 19.367 1.553 1
1 1193 . 8 2 2 B 10 10 ALA N N 431 125.000 124.928 0.072 1
1 1194 . 8 2 2 B 11 11 ASP H H 432 8.530 9.013 -0.483 1
1 1195 . 8 2 2 B 11 11 ASP HA H 432 4.220 4.232 -0.012 1
1 1198 . 8 2 2 B 11 11 ASP CA C 432 57.520 57.381 0.139 1
1 1199 . 8 2 2 B 11 11 ASP CB C 432 40.470 40.159 0.311 1
1 1200 . 8 2 2 B 11 11 ASP N N 432 119.610 122.757 -3.147 1
1 1201 . 8 2 2 B 12 12 ASP H H 433 8.340 7.997 0.343 1
1 1202 . 8 2 2 B 12 12 ASP HA H 433 4.160 4.430 -0.270 1
1 1205 . 8 2 2 B 12 12 ASP CA C 433 56.090 57.376 -1.286 1
1 1206 . 8 2 2 B 12 12 ASP CB C 433 38.960 40.959 -1.999 1
1 1207 . 8 2 2 B 12 12 ASP N N 433 116.330 120.555 -4.225 1
1 1208 . 8 2 2 B 13 13 LEU H H 434 7.360 7.536 -0.176 1
1 1209 . 8 2 2 B 13 13 LEU HA H 434 4.050 4.060 -0.010 1
1 1219 . 8 2 2 B 13 13 LEU CA C 434 57.340 57.731 -0.391 1
1 1220 . 8 2 2 B 13 13 LEU CB C 434 42.960 41.639 1.321 1
1 1224 . 8 2 2 B 13 13 LEU N N 434 123.440 120.853 2.587 1
1 1225 . 8 2 2 B 14 14 LEU H H 435 7.670 8.087 -0.417 1
1 1226 . 8 2 2 B 14 14 LEU HA H 435 3.710 3.930 -0.220 1
1 1236 . 8 2 2 B 14 14 LEU CA C 435 57.170 57.653 -0.483 1
1 1237 . 8 2 2 B 14 14 LEU CB C 435 42.590 41.213 1.377 1
1 1241 . 8 2 2 B 14 14 LEU N N 435 115.170 119.577 -4.407 1
1 1242 . 8 2 2 B 15 15 ASN H H 436 7.490 7.783 -0.293 1
1 1243 . 8 2 2 B 15 15 ASN HA H 436 4.640 4.840 -0.200 1
1 1248 . 8 2 2 B 15 15 ASN CA C 436 52.920 53.253 -0.333 1
1 1249 . 8 2 2 B 15 15 ASN CB C 436 39.350 39.151 0.199 1
1 1250 . 8 2 2 B 15 15 ASN N N 436 112.280 114.983 -2.703 1
1 1252 . 8 2 2 B 16 16 LEU H H 437 7.300 7.100 0.200 1
1 1253 . 8 2 2 B 16 16 LEU HA H 437 4.100 4.260 -0.160 1
1 1263 . 8 2 2 B 16 16 LEU CA C 437 55.310 55.217 0.093 1
1 1264 . 8 2 2 B 16 16 LEU CB C 437 41.800 43.013 -1.213 1
1 1268 . 8 2 2 B 16 16 LEU N N 437 125.180 122.866 2.314 1
1 1269 . 8 2 2 B 17 17 GLU H H 438 8.590 8.757 -0.167 1
1 1270 . 8 2 2 B 17 17 GLU HA H 438 3.920 4.018 -0.098 1
1 1275 . 8 2 2 B 17 17 GLU CA C 438 58.440 57.977 0.463 1
1 1276 . 8 2 2 B 17 17 GLU CB C 438 29.180 29.769 -0.589 1
1 1278 . 8 2 2 B 17 17 GLU N N 438 129.850 125.735 4.115 1
1 1279 . 8 2 2 B 18 18 GLY H H 439 8.580 8.884 -0.304 1
1 1280 . 8 2 2 B 18 18 GLY HA2 H 439 3.570 3.951 -0.381 1
1 1281 . 8 2 2 B 18 18 GLY HA3 H 439 4.220 3.952 0.268 1
1 1282 . 8 2 2 B 18 18 GLY CA C 439 44.710 45.229 -0.519 1
1 1283 . 8 2 2 B 18 18 GLY N N 439 112.250 115.000 -2.750 1
1 1284 . 8 2 2 B 19 19 VAL H H 440 7.900 7.776 0.124 1
1 1285 . 8 2 2 B 19 19 VAL HA H 440 3.950 4.458 -0.508 1
1 1293 . 8 2 2 B 19 19 VAL CA C 440 62.820 60.844 1.976 1
1 1294 . 8 2 2 B 19 19 VAL CB C 440 31.470 34.494 -3.024 1
1 1297 . 8 2 2 B 19 19 VAL N N 440 121.910 121.924 -0.014 1
1 1298 . 8 2 2 B 20 20 ASP H H 441 7.390 8.589 -1.199 1
1 1299 . 8 2 2 B 20 20 ASP HA H 441 4.820 4.790 0.030 1
1 1302 . 8 2 2 B 20 20 ASP CA C 441 51.920 54.432 -2.512 1
1 1303 . 8 2 2 B 20 20 ASP CB C 441 42.090 43.192 -1.102 1
1 1304 . 8 2 2 B 20 20 ASP N N 441 124.850 126.956 -2.106 1
1 1305 . 8 2 2 B 21 21 ARG H H 442 8.630 8.737 -0.107 1
1 1306 . 8 2 2 B 21 21 ARG HA H 442 3.810 3.830 -0.020 1
1 1313 . 8 2 2 B 21 21 ARG CA C 442 60.710 59.891 0.819 1
1 1314 . 8 2 2 B 21 21 ARG CB C 442 30.020 30.078 -0.058 1
1 1317 . 8 2 2 B 21 21 ARG N N 442 120.890 125.442 -4.552 1
1 1318 . 8 2 2 B 22 22 ASP H H 443 8.140 8.326 -0.186 1
1 1319 . 8 2 2 B 22 22 ASP HA H 443 4.420 4.788 -0.368 1
1 1322 . 8 2 2 B 22 22 ASP CA C 443 57.680 57.482 0.198 1
1 1323 . 8 2 2 B 22 22 ASP CB C 443 40.880 40.578 0.302 1
1 1324 . 8 2 2 B 22 22 ASP N N 443 116.750 120.476 -3.726 1
1 1325 . 8 2 2 B 23 23 LEU H H 444 8.170 8.050 0.120 1
1 1326 . 8 2 2 B 23 23 LEU HA H 444 4.130 4.086 0.044 1
1 1336 . 8 2 2 B 23 23 LEU CA C 444 57.770 57.564 0.206 1
1 1337 . 8 2 2 B 23 23 LEU CB C 444 41.230 41.378 -0.148 1
1 1341 . 8 2 2 B 23 23 LEU N N 444 122.130 121.378 0.752 1
1 1342 . 8 2 2 B 24 24 ALA H H 445 8.630 8.335 0.295 1
1 1343 . 8 2 2 B 24 24 ALA HA H 445 3.790 3.982 -0.192 1
1 1347 . 8 2 2 B 24 24 ALA CA C 445 55.810 54.015 1.795 1
1 1348 . 8 2 2 B 24 24 ALA CB C 445 18.060 18.077 -0.017 1
1 1349 . 8 2 2 B 24 24 ALA N N 445 120.890 121.557 -0.667 1
1 1350 . 8 2 2 B 25 25 PHE H H 446 8.160 7.439 0.721 1
1 1351 . 8 2 2 B 25 25 PHE HA H 446 4.080 4.298 -0.218 1
1 1358 . 8 2 2 B 25 25 PHE CA C 446 62.670 61.834 0.836 1
1 1359 . 8 2 2 B 25 25 PHE CB C 446 39.440 38.508 0.932 1
1 1364 . 8 2 2 B 25 25 PHE N N 446 115.360 115.878 -0.518 1
1 1365 . 8 2 2 B 26 26 LYS H H 447 8.040 8.169 -0.129 1
1 1366 . 8 2 2 B 26 26 LYS HA H 447 4.110 4.081 0.029 1
1 1375 . 8 2 2 B 26 26 LYS CA C 447 60.140 59.863 0.277 1
1 1376 . 8 2 2 B 26 26 LYS CB C 447 32.880 32.136 0.744 1
1 1380 . 8 2 2 B 26 26 LYS N N 447 123.110 120.213 2.897 1
1 1381 . 8 2 2 B 27 27 LEU H H 448 8.630 8.063 0.567 1
1 1382 . 8 2 2 B 27 27 LEU HA H 448 3.840 4.102 -0.262 1
1 1392 . 8 2 2 B 27 27 LEU CA C 448 58.210 57.444 0.766 1
1 1393 . 8 2 2 B 27 27 LEU CB C 448 39.760 41.462 -1.702 1
1 1396 . 8 2 2 B 27 27 LEU N N 448 120.890 121.067 -0.177 1
1 1397 . 8 2 2 B 28 28 ALA H H 449 8.200 8.505 -0.305 1
1 1398 . 8 2 2 B 28 28 ALA HA H 449 3.760 4.510 -0.750 1
1 1402 . 8 2 2 B 28 28 ALA CA C 449 54.750 55.153 -0.403 1
1 1403 . 8 2 2 B 28 28 ALA CB C 449 18.050 18.199 -0.149 1
1 1404 . 8 2 2 B 28 28 ALA N N 449 123.710 120.647 3.063 1
1 1405 . 8 2 2 B 29 29 ALA H H 450 7.780 7.978 -0.198 1
1 1406 . 8 2 2 B 29 29 ALA HA H 450 4.170 4.151 0.019 1
1 1410 . 8 2 2 B 29 29 ALA CA C 450 54.430 54.433 -0.003 1
1 1411 . 8 2 2 B 29 29 ALA CB C 450 18.040 18.275 -0.235 1
1 1412 . 8 2 2 B 29 29 ALA N N 450 121.020 119.508 1.512 1
1 1413 . 8 2 2 B 30 30 ARG H H 451 7.390 7.786 -0.396 1
1 1414 . 8 2 2 B 30 30 ARG HA H 451 4.540 4.413 0.127 1
1 1421 . 8 2 2 B 30 30 ARG CA C 451 54.510 55.764 -1.254 1
1 1422 . 8 2 2 B 30 30 ARG CB C 451 29.950 29.656 0.294 1
1 1425 . 8 2 2 B 30 30 ARG N N 451 115.480 116.662 -1.182 1
1 1426 . 8 2 2 B 31 31 GLY H H 452 7.950 7.962 -0.012 1
1 1427 . 8 2 2 B 31 31 GLY HA2 H 452 3.550 3.983 -0.433 1
1 1428 . 8 2 2 B 31 31 GLY HA3 H 452 4.200 3.986 0.214 1
1 1429 . 8 2 2 B 31 31 GLY CA C 452 45.380 45.362 0.018 1
1 1430 . 8 2 2 B 31 31 GLY N N 452 107.740 107.898 -0.158 1
1 1431 . 8 2 2 B 32 32 VAL H H 453 7.990 7.603 0.387 1
1 1432 . 8 2 2 B 32 32 VAL HA H 453 3.930 3.925 0.005 1
1 1440 . 8 2 2 B 32 32 VAL CA C 453 61.420 62.641 -1.221 1
1 1441 . 8 2 2 B 32 32 VAL CB C 453 29.860 31.554 -1.694 1
1 1444 . 8 2 2 B 32 32 VAL N N 453 125.560 120.598 4.962 1
1 1445 . 8 2 2 B 33 33 CYS H H 454 8.460 8.761 -0.301 1
1 1446 . 8 2 2 B 33 33 CYS HA H 454 4.310 4.785 -0.475 1
1 1449 . 8 2 2 B 33 33 CYS CA C 454 60.260 59.746 0.514 1
1 1450 . 8 2 2 B 33 33 CYS CB C 454 30.330 30.652 -0.322 1
1 1451 . 8 2 2 B 33 33 CYS N N 454 119.460 125.200 -5.740 1
1 1452 . 8 2 2 B 34 34 THR H H 455 8.080 7.675 0.405 1
1 1453 . 8 2 2 B 34 34 THR HA H 455 4.840 4.746 0.094 1
1 1458 . 8 2 2 B 34 34 THR CA C 455 58.650 60.886 -2.236 1
1 1459 . 8 2 2 B 34 34 THR CB C 455 72.680 71.397 1.283 1
1 1461 . 8 2 2 B 34 34 THR N N 455 108.420 113.876 -5.456 1
1 1462 . 8 2 2 B 35 35 LEU H H 456 8.580 8.887 -0.307 1
1 1463 . 8 2 2 B 35 35 LEU HA H 456 3.790 4.014 -0.224 1
1 1473 . 8 2 2 B 35 35 LEU CA C 456 57.980 58.607 -0.627 1
1 1474 . 8 2 2 B 35 35 LEU CB C 456 42.220 41.288 0.932 1
1 1477 . 8 2 2 B 35 35 LEU N N 456 120.370 127.721 -7.351 1
1 1478 . 8 2 2 B 36 36 GLU H H 457 8.390 8.427 -0.037 1
1 1479 . 8 2 2 B 36 36 GLU HA H 457 3.820 3.857 -0.037 1
1 1484 . 8 2 2 B 36 36 GLU CA C 457 59.640 59.984 -0.344 1
1 1485 . 8 2 2 B 36 36 GLU CB C 457 28.780 29.181 -0.401 1
1 1487 . 8 2 2 B 36 36 GLU N N 457 119.450 118.849 0.601 1
1 1488 . 8 2 2 B 37 37 ASP H H 458 7.750 7.900 -0.150 1
1 1489 . 8 2 2 B 37 37 ASP HA H 458 4.140 4.448 -0.308 1
1 1492 . 8 2 2 B 37 37 ASP CA C 458 57.150 57.247 -0.097 1
1 1493 . 8 2 2 B 37 37 ASP CB C 458 42.280 40.458 1.822 1
1 1494 . 8 2 2 B 37 37 ASP N N 458 117.430 120.458 -3.028 1
1 1495 . 8 2 2 B 38 38 LEU H H 459 7.700 7.867 -0.167 1
1 1496 . 8 2 2 B 38 38 LEU HA H 459 3.790 4.076 -0.286 1
1 1506 . 8 2 2 B 38 38 LEU CA C 459 58.080 57.789 0.291 1
1 1507 . 8 2 2 B 38 38 LEU CB C 459 41.130 41.225 -0.095 1
1 1511 . 8 2 2 B 38 38 LEU N N 459 121.280 121.741 -0.461 1
1 1512 . 8 2 2 B 39 39 ALA H H 460 8.190 8.346 -0.156 1
1 1513 . 8 2 2 B 39 39 ALA HA H 460 3.640 4.036 -0.396 1
1 1517 . 8 2 2 B 39 39 ALA CA C 460 54.320 55.347 -1.027 1
1 1518 . 8 2 2 B 39 39 ALA CB C 460 17.140 18.049 -0.909 1
1 1519 . 8 2 2 B 39 39 ALA N N 460 119.400 120.488 -1.088 1
1 1520 . 8 2 2 B 40 40 GLU H H 461 7.340 7.840 -0.500 1
1 1521 . 8 2 2 B 40 40 GLU HA H 461 4.180 4.242 -0.062 1
1 1526 . 8 2 2 B 40 40 GLU CA C 461 57.800 59.082 -1.282 1
1 1527 . 8 2 2 B 40 40 GLU CB C 461 30.600 29.588 1.012 1
1 1529 . 8 2 2 B 40 40 GLU N N 461 110.680 116.172 -5.492 1
1 1530 . 8 2 2 B 41 41 GLN H H 462 7.940 7.597 0.343 1
1 1531 . 8 2 2 B 41 41 GLN HA H 462 4.100 4.493 -0.393 1
1 1538 . 8 2 2 B 41 41 GLN CA C 462 55.310 56.583 -1.273 1
1 1539 . 8 2 2 B 41 41 GLN CB C 462 28.780 29.443 -0.663 1
1 1541 . 8 2 2 B 41 41 GLN N N 462 120.720 118.052 2.668 1
1 1543 . 8 2 2 B 42 42 GLY H H 463 9.000 8.492 0.508 1
1 1544 . 8 2 2 B 42 42 GLY HA2 H 463 3.310 4.243 -0.933 1
1 1545 . 8 2 2 B 42 42 GLY HA3 H 463 4.820 4.245 0.575 1
1 1546 . 8 2 2 B 42 42 GLY CA C 463 42.650 44.276 -1.626 1
1 1547 . 8 2 2 B 42 42 GLY N N 463 104.110 108.951 -4.841 1
1 1548 . 8 2 2 B 43 43 ILE H H 464 7.900 8.787 -0.887 1
1 1549 . 8 2 2 B 43 43 ILE HA H 464 3.260 3.720 -0.460 1
1 1558 . 8 2 2 B 43 43 ILE CA C 464 66.570 64.338 2.232 1
1 1559 . 8 2 2 B 43 43 ILE CB C 464 38.770 37.565 1.205 1
1 1562 . 8 2 2 B 43 43 ILE N N 464 119.410 120.705 -1.295 1
1 1563 . 8 2 2 B 44 44 ASP H H 465 8.730 8.061 0.669 1
1 1564 . 8 2 2 B 44 44 ASP HA H 465 4.310 4.437 -0.127 1
1 1567 . 8 2 2 B 44 44 ASP CA C 465 56.740 57.553 -0.813 1
1 1568 . 8 2 2 B 44 44 ASP CB C 465 40.120 40.028 0.092 1
1 1569 . 8 2 2 B 44 44 ASP N N 465 116.610 121.879 -5.269 1
1 1570 . 8 2 2 B 45 45 ASP H H 466 7.720 8.480 -0.760 1
1 1571 . 8 2 2 B 45 45 ASP HA H 466 4.480 4.440 0.040 1
1 1574 . 8 2 2 B 45 45 ASP CA C 466 57.000 57.306 -0.306 1
1 1575 . 8 2 2 B 45 45 ASP CB C 466 42.270 40.450 1.820 1
1 1576 . 8 2 2 B 45 45 ASP N N 466 117.560 120.134 -2.574 1
1 1577 . 8 2 2 B 46 46 LEU H H 467 7.370 7.742 -0.372 1
1 1578 . 8 2 2 B 46 46 LEU HA H 467 4.410 4.175 0.235 1
1 1587 . 8 2 2 B 46 46 LEU CA C 467 53.660 57.502 -3.842 1
1 1588 . 8 2 2 B 46 46 LEU CB C 467 42.260 41.514 0.746 1
1 1591 . 8 2 2 B 46 46 LEU N N 467 116.890 120.411 -3.521 1
1 1592 . 8 2 2 B 47 47 ALA H H 468 7.080 8.702 -1.622 1
1 1593 . 8 2 2 B 47 47 ALA HA H 468 4.120 3.972 0.148 1
1 1597 . 8 2 2 B 47 47 ALA CA C 468 54.130 55.155 -1.025 1
1 1598 . 8 2 2 B 47 47 ALA CB C 468 19.480 18.290 1.190 1
1 1599 . 8 2 2 B 47 47 ALA N N 468 120.150 122.635 -2.485 1
1 1600 . 8 2 2 B 48 48 ASP H H 469 8.560 7.840 0.720 1
1 1601 . 8 2 2 B 48 48 ASP HA H 469 4.410 4.371 0.039 1
1 1604 . 8 2 2 B 48 48 ASP CA C 469 54.330 56.795 -2.465 1
1 1605 . 8 2 2 B 48 48 ASP CB C 469 39.760 40.800 -1.040 1
1 1606 . 8 2 2 B 48 48 ASP N N 469 114.660 117.864 -3.204 1
1 1607 . 8 2 2 B 49 49 ILE H H 470 7.870 8.141 -0.271 1
1 1608 . 8 2 2 B 49 49 ILE HA H 470 3.850 4.340 -0.490 1
1 1618 . 8 2 2 B 49 49 ILE CA C 470 61.680 60.824 0.856 1
1 1619 . 8 2 2 B 49 49 ILE CB C 470 37.120 38.727 -1.607 1
1 1623 . 8 2 2 B 49 49 ILE N N 470 121.600 117.821 3.779 1
1 1624 . 8 2 2 B 50 50 GLU H H 471 8.680 8.857 -0.177 1
1 1625 . 8 2 2 B 50 50 GLU HA H 471 3.940 4.071 -0.131 1
1 1630 . 8 2 2 B 50 50 GLU CA C 471 58.360 59.230 -0.870 1
1 1631 . 8 2 2 B 50 50 GLU CB C 471 29.530 29.320 0.210 1
1 1633 . 8 2 2 B 50 50 GLU N N 471 131.000 127.175 3.825 1
1 1634 . 8 2 2 B 51 51 GLY H H 472 8.860 8.293 0.567 1
1 1635 . 8 2 2 B 51 51 GLY HA2 H 472 3.640 4.018 -0.378 1
1 1636 . 8 2 2 B 51 51 GLY HA3 H 472 4.230 4.021 0.209 1
1 1637 . 8 2 2 B 51 51 GLY CA C 472 45.190 46.972 -1.782 1
1 1638 . 8 2 2 B 51 51 GLY N N 472 113.580 108.762 4.818 1
1 1639 . 8 2 2 B 52 52 LEU H H 473 7.850 7.973 -0.123 1
1 1640 . 8 2 2 B 52 52 LEU HA H 473 4.680 4.819 -0.139 1
1 1650 . 8 2 2 B 52 52 LEU CA C 473 53.640 53.689 -0.049 1
1 1651 . 8 2 2 B 52 52 LEU CB C 473 42.990 43.509 -0.519 1
1 1655 . 8 2 2 B 52 52 LEU N N 473 123.020 120.109 2.911 1
1 1656 . 8 2 2 B 53 53 THR H H 474 7.550 8.777 -1.227 1
1 1657 . 8 2 2 B 53 53 THR HA H 474 4.560 4.799 -0.239 1
1 1662 . 8 2 2 B 53 53 THR CA C 474 60.060 60.987 -0.927 1
1 1663 . 8 2 2 B 53 53 THR CB C 474 71.520 71.499 0.021 1
1 1665 . 8 2 2 B 53 53 THR N N 474 115.070 117.721 -2.651 1
1 1666 . 8 2 2 B 54 54 ASP H H 475 8.900 9.033 -0.133 1
1 1667 . 8 2 2 B 54 54 ASP HA H 475 4.220 4.290 -0.070 1
1 1670 . 8 2 2 B 54 54 ASP CA C 475 57.520 57.981 -0.461 1
1 1671 . 8 2 2 B 54 54 ASP CB C 475 39.560 40.252 -0.692 1
1 1672 . 8 2 2 B 54 54 ASP N N 475 121.800 123.724 -1.924 1
1 1673 . 8 2 2 B 55 55 GLU H H 476 8.460 7.899 0.561 1
1 1674 . 8 2 2 B 55 55 GLU HA H 476 3.970 4.029 -0.059 1
1 1679 . 8 2 2 B 55 55 GLU CA C 476 59.440 59.031 0.409 1
1 1680 . 8 2 2 B 55 55 GLU CB C 476 29.650 29.483 0.167 1
1 1682 . 8 2 2 B 55 55 GLU N N 476 119.460 119.416 0.044 1
1 1683 . 8 2 2 B 56 56 LYS H H 477 7.790 8.060 -0.270 1
1 1684 . 8 2 2 B 56 56 LYS HA H 477 4.120 4.079 0.041 1
1 1693 . 8 2 2 B 56 56 LYS CA C 477 58.890 59.045 -0.155 1
1 1694 . 8 2 2 B 56 56 LYS CB C 477 32.600 32.242 0.358 1
1 1698 . 8 2 2 B 56 56 LYS N N 477 121.840 119.828 2.012 1
1 1699 . 8 2 2 B 57 57 ALA H H 478 8.900 8.947 -0.047 1
1 1700 . 8 2 2 B 57 57 ALA HA H 478 3.790 4.040 -0.250 1
1 1704 . 8 2 2 B 57 57 ALA CA C 478 55.810 55.529 0.281 1
1 1705 . 8 2 2 B 57 57 ALA CB C 478 18.590 18.271 0.319 1
1 1706 . 8 2 2 B 57 57 ALA N N 478 121.350 121.594 -0.244 1
1 1707 . 8 2 2 B 58 58 GLY H H 479 8.300 8.104 0.196 1
1 1708 . 8 2 2 B 58 58 GLY HA2 H 479 3.500 3.822 -0.322 1
1 1709 . 8 2 2 B 58 58 GLY HA3 H 479 3.890 3.824 0.066 1
1 1710 . 8 2 2 B 58 58 GLY CA C 479 47.360 46.977 0.383 1
1 1711 . 8 2 2 B 58 58 GLY N N 479 102.040 107.294 -5.254 1
1 1712 . 8 2 2 B 59 59 ALA H H 480 7.580 7.974 -0.394 1
1 1713 . 8 2 2 B 59 59 ALA HA H 480 4.110 3.995 0.115 1
1 1717 . 8 2 2 B 59 59 ALA CA C 480 55.580 54.589 0.991 1
1 1718 . 8 2 2 B 59 59 ALA CB C 480 18.130 18.313 -0.183 1
1 1719 . 8 2 2 B 59 59 ALA N N 480 123.180 125.213 -2.033 1
1 1720 . 8 2 2 B 60 60 LEU H H 481 8.290 8.003 0.287 1
1 1721 . 8 2 2 B 60 60 LEU HA H 481 4.020 4.022 -0.002 1
1 1731 . 8 2 2 B 60 60 LEU CA C 481 57.850 57.699 0.151 1
1 1732 . 8 2 2 B 60 60 LEU CB C 481 42.360 41.358 1.002 1
1 1736 . 8 2 2 B 60 60 LEU N N 481 120.560 119.187 1.373 1
1 1737 . 8 2 2 B 61 61 ILE H H 482 8.080 7.879 0.201 1
1 1738 . 8 2 2 B 61 61 ILE HA H 482 3.210 3.524 -0.314 1
1 1748 . 8 2 2 B 61 61 ILE CA C 482 66.250 65.103 1.147 1
1 1749 . 8 2 2 B 61 61 ILE CB C 482 39.400 38.266 1.134 1
1 1753 . 8 2 2 B 61 61 ILE N N 482 119.170 120.629 -1.459 1
1 1754 . 8 2 2 B 62 62 MET H H 483 8.110 8.261 -0.151 1
1 1755 . 8 2 2 B 62 62 MET HA H 483 4.410 4.086 0.324 1
1 1763 . 8 2 2 B 62 62 MET CA C 483 56.110 58.673 -2.563 1
1 1764 . 8 2 2 B 62 62 MET CB C 483 28.260 32.536 -4.276 1
1 1767 . 8 2 2 B 62 62 MET N N 483 114.420 118.280 -3.860 1
1 1768 . 8 2 2 B 63 63 ALA H H 484 8.240 7.813 0.427 1
1 1769 . 8 2 2 B 63 63 ALA HA H 484 4.130 4.163 -0.033 1
1 1773 . 8 2 2 B 63 63 ALA CA C 484 55.300 55.002 0.298 1
1 1774 . 8 2 2 B 63 63 ALA CB C 484 18.280 18.538 -0.258 1
1 1775 . 8 2 2 B 63 63 ALA N N 484 123.710 121.385 2.325 1
1 1776 . 8 2 2 B 64 64 ALA H H 485 8.050 8.481 -0.431 1
1 1777 . 8 2 2 B 64 64 ALA HA H 485 3.870 4.087 -0.217 1
1 1781 . 8 2 2 B 64 64 ALA CA C 485 55.330 55.273 0.057 1
1 1782 . 8 2 2 B 64 64 ALA CB C 485 17.660 18.236 -0.576 1
1 1783 . 8 2 2 B 64 64 ALA N N 485 120.070 120.159 -0.089 1
1 1784 . 8 2 2 B 65 65 ARG H H 486 8.640 8.929 -0.289 1
1 1785 . 8 2 2 B 65 65 ARG HA H 486 2.800 4.183 -1.383 1
1 1792 . 8 2 2 B 65 65 ARG CA C 486 60.600 59.496 1.104 1
1 1793 . 8 2 2 B 65 65 ARG CB C 486 29.910 30.077 -0.167 1
1 1796 . 8 2 2 B 65 65 ARG N N 486 118.730 118.771 -0.041 1
1 1797 . 8 2 2 B 66 66 ASN H H 487 8.710 8.095 0.615 1
1 1798 . 8 2 2 B 66 66 ASN HA H 487 4.550 4.451 0.099 1
1 1803 . 8 2 2 B 66 66 ASN CA C 487 56.390 56.293 0.097 1
1 1804 . 8 2 2 B 66 66 ASN CB C 487 37.970 38.708 -0.738 1
1 1805 . 8 2 2 B 66 66 ASN N N 487 119.170 117.933 1.237 1
1 1807 . 8 2 2 B 67 67 ILE H H 488 7.250 7.767 -0.517 1
1 1808 . 8 2 2 B 67 67 ILE HA H 488 3.810 3.893 -0.083 1
1 1818 . 8 2 2 B 67 67 ILE CA C 488 64.350 64.906 -0.556 1
1 1819 . 8 2 2 B 67 67 ILE CB C 488 39.570 37.707 1.863 1
1 1823 . 8 2 2 B 67 67 ILE N N 488 117.890 120.001 -2.111 1
1 1824 . 8 2 2 B 68 68 CYS H H 489 8.350 8.235 0.115 1
1 1825 . 8 2 2 B 68 68 CYS HA H 489 4.080 4.064 0.016 1
1 1828 . 8 2 2 B 68 68 CYS CA C 489 62.670 62.737 -0.067 1
1 1829 . 8 2 2 B 68 68 CYS CB C 489 28.170 26.804 1.366 1
1 1830 . 8 2 2 B 68 68 CYS N N 489 115.230 120.515 -5.285 1
1 1831 . 8 2 2 B 69 69 TRP H H 490 8.230 8.671 -0.441 1
1 1832 . 8 2 2 B 69 69 TRP HA H 490 5.100 4.256 0.844 1
1 1841 . 8 2 2 B 69 69 TRP CA C 490 55.420 60.393 -4.973 1
1 1842 . 8 2 2 B 69 69 TRP CB C 490 31.010 28.975 2.035 1
1 1844 . 8 2 2 B 69 69 TRP N N 490 116.850 120.695 -3.845 1
1 1846 . 8 2 2 B 70 70 PHE H H 491 7.570 8.052 -0.482 1
1 1847 . 8 2 2 B 70 70 PHE HA H 491 5.240 4.461 0.779 1
1 1852 . 8 2 2 B 70 70 PHE CA C 491 55.490 60.396 -4.906 1
1 1853 . 8 2 2 B 70 70 PHE CB C 491 38.700 39.029 -0.329 1
1 1856 . 8 2 2 B 70 70 PHE N N 491 117.460 117.808 -0.348 1
1 1857 . 8 2 2 B 71 71 GLY H H 492 8.420 8.507 -0.087 1
1 1858 . 8 2 2 B 71 71 GLY HA2 H 492 3.920 3.908 0.012 1
1 1859 . 8 2 2 B 71 71 GLY HA3 H 492 4.080 3.909 0.171 1
1 1860 . 8 2 2 B 71 71 GLY CA C 492 46.210 46.856 -0.646 1
1 1861 . 8 2 2 B 71 71 GLY N N 492 110.040 108.118 1.922 1
1 1862 . 8 2 2 B 72 72 ASP H H 493 8.370 9.075 -0.705 1
1 1863 . 8 2 2 B 72 72 ASP HA H 493 4.630 4.354 0.276 1
1 1866 . 8 2 2 B 72 72 ASP CA C 493 54.410 57.073 -2.663 1
1 1867 . 8 2 2 B 72 72 ASP CB C 493 41.250 40.448 0.802 1
1 1868 . 8 2 2 B 72 72 ASP N N 493 120.000 126.370 -6.370 1
1 1869 . 8 2 2 B 73 73 GLU H H 494 8.230 8.010 0.220 1
1 1870 . 8 2 2 B 73 73 GLU HA H 494 4.260 3.990 0.270 1
1 1875 . 8 2 2 B 73 73 GLU CA C 494 56.510 59.261 -2.751 1
1 1876 . 8 2 2 B 73 73 GLU CB C 494 30.420 29.497 0.923 1
1 1878 . 8 2 2 B 73 73 GLU N N 494 120.900 119.710 1.190 1
1 216 . 9 1 1 A 20 20 ASP H H 250 8.550 8.854 -0.304 1
1 217 . 9 1 1 A 20 20 ASP HA H 250 4.700 4.557 0.143 1
1 220 . 9 1 1 A 20 20 ASP CA C 250 52.650 52.885 -0.235 1
1 221 . 9 1 1 A 20 20 ASP CB C 250 41.420 40.221 1.199 1
1 222 . 9 1 1 A 20 20 ASP N N 250 125.190 125.556 -0.366 1
1 223 . 9 1 1 A 21 21 PRO HA H 251 4.250 4.432 -0.182 1
1 230 . 9 1 1 A 21 21 PRO CA C 251 65.120 64.876 0.244 1
1 231 . 9 1 1 A 21 21 PRO CB C 251 32.310 32.223 0.087 1
1 234 . 9 1 1 A 22 22 ILE H H 252 8.630 7.833 0.797 1
1 235 . 9 1 1 A 22 22 ILE HA H 252 4.060 4.008 0.052 1
1 245 . 9 1 1 A 22 22 ILE CA C 252 62.990 62.662 0.328 1
1 246 . 9 1 1 A 22 22 ILE CB C 252 37.520 37.552 -0.032 1
1 250 . 9 1 1 A 22 22 ILE N N 252 119.860 117.054 2.806 1
1 251 . 9 1 1 A 23 23 LEU H H 253 7.950 7.831 0.119 1
1 252 . 9 1 1 A 23 23 LEU HA H 253 3.710 4.096 -0.386 1
1 262 . 9 1 1 A 23 23 LEU CA C 253 56.510 57.843 -1.333 1
1 263 . 9 1 1 A 23 23 LEU CB C 253 41.190 41.659 -0.469 1
1 266 . 9 1 1 A 23 23 LEU N N 253 116.850 121.608 -4.758 1
1 267 . 9 1 1 A 24 24 LEU H H 254 7.370 7.765 -0.395 1
1 268 . 9 1 1 A 24 24 LEU HA H 254 4.310 4.529 -0.219 1
1 278 . 9 1 1 A 24 24 LEU CA C 254 54.890 57.938 -3.048 1
1 279 . 9 1 1 A 24 24 LEU CB C 254 41.960 41.448 0.512 1
1 283 . 9 1 1 A 24 24 LEU N N 254 115.210 119.320 -4.110 1
1 284 . 9 1 1 A 25 25 ARG H H 255 7.520 7.428 0.092 1
1 285 . 9 1 1 A 25 25 ARG HA H 255 4.660 4.253 0.407 1
1 293 . 9 1 1 A 25 25 ARG CA C 255 52.840 54.338 -1.498 1
1 294 . 9 1 1 A 25 25 ARG CB C 255 28.130 29.715 -1.585 1
1 297 . 9 1 1 A 25 25 ARG N N 255 118.180 118.667 -0.487 1
1 298 . 9 1 1 A 26 26 PRO HA H 256 4.800 4.527 0.273 1
1 305 . 9 1 1 A 26 26 PRO CA C 256 61.790 62.577 -0.787 1
1 306 . 9 1 1 A 26 26 PRO CB C 256 32.660 32.268 0.392 1
1 309 . 9 1 1 A 27 27 VAL H H 257 8.170 8.403 -0.233 1
1 310 . 9 1 1 A 27 27 VAL HA H 257 3.590 3.711 -0.121 1
1 318 . 9 1 1 A 27 27 VAL CA C 257 64.830 65.712 -0.882 1
1 319 . 9 1 1 A 27 27 VAL CB C 257 31.720 31.605 0.115 1
1 322 . 9 1 1 A 27 27 VAL N N 257 115.710 123.765 -8.055 1
1 323 . 9 1 1 A 28 28 ASP H H 258 8.240 8.080 0.160 1
1 324 . 9 1 1 A 28 28 ASP HA H 258 4.340 4.368 -0.028 1
1 327 . 9 1 1 A 28 28 ASP CA C 258 56.490 57.505 -1.015 1
1 328 . 9 1 1 A 28 28 ASP CB C 258 40.520 40.358 0.162 1
1 329 . 9 1 1 A 28 28 ASP N N 258 119.000 122.624 -3.624 1
1 330 . 9 1 1 A 29 29 ASP H H 259 8.000 8.705 -0.705 1
1 331 . 9 1 1 A 29 29 ASP HA H 259 4.390 4.596 -0.206 1
1 334 . 9 1 1 A 29 29 ASP CA C 259 56.210 55.670 0.540 1
1 335 . 9 1 1 A 29 29 ASP CB C 259 40.670 41.008 -0.338 1
1 336 . 9 1 1 A 29 29 ASP N N 259 118.900 117.510 1.390 1
1 337 . 9 1 1 A 30 30 LEU H H 260 7.760 7.753 0.007 1
1 338 . 9 1 1 A 30 30 LEU HA H 260 3.990 4.244 -0.254 1
1 348 . 9 1 1 A 30 30 LEU CA C 260 55.000 55.148 -0.148 1
1 349 . 9 1 1 A 30 30 LEU CB C 260 41.670 42.277 -0.607 1
1 353 . 9 1 1 A 30 30 LEU N N 260 116.300 121.186 -4.886 1
1 354 . 9 1 1 A 31 31 GLU H H 261 7.990 8.796 -0.806 1
1 355 . 9 1 1 A 31 31 GLU HA H 261 4.280 4.047 0.233 1
1 358 . 9 1 1 A 31 31 GLU CA C 261 56.860 59.486 -2.626 1
1 359 . 9 1 1 A 31 31 GLU CB C 261 27.010 29.361 -2.351 1
1 360 . 9 1 1 A 31 31 GLU N N 261 115.620 121.640 -6.020 1
1 361 . 9 1 1 A 32 32 LEU H H 262 8.000 7.332 0.668 1
1 362 . 9 1 1 A 32 32 LEU HA H 262 4.400 4.275 0.125 1
1 372 . 9 1 1 A 32 32 LEU CA C 262 53.860 54.892 -1.032 1
1 373 . 9 1 1 A 32 32 LEU CB C 262 44.450 42.261 2.189 1
1 377 . 9 1 1 A 32 32 LEU N N 262 118.860 122.163 -3.303 1
1 378 . 9 1 1 A 33 33 THR H H 263 10.020 8.664 1.356 1
1 379 . 9 1 1 A 33 33 THR HA H 263 4.130 4.642 -0.512 1
1 384 . 9 1 1 A 33 33 THR CA C 263 62.400 60.786 1.614 1
1 385 . 9 1 1 A 33 33 THR CB C 263 71.270 71.056 0.214 1
1 387 . 9 1 1 A 33 33 THR N N 263 114.610 114.145 0.465 1
1 388 . 9 1 1 A 34 34 VAL H H 264 8.370 8.819 -0.449 1
1 389 . 9 1 1 A 34 34 VAL HA H 264 3.620 3.655 -0.035 1
1 397 . 9 1 1 A 34 34 VAL CA C 264 66.340 67.028 -0.688 1
1 398 . 9 1 1 A 34 34 VAL CB C 264 31.670 31.590 0.080 1
1 401 . 9 1 1 A 34 34 VAL N N 264 122.110 122.612 -0.502 1
1 402 . 9 1 1 A 35 35 ARG H H 265 8.190 8.168 0.022 1
1 403 . 9 1 1 A 35 35 ARG HA H 265 4.070 3.925 0.145 1
1 411 . 9 1 1 A 35 35 ARG CA C 265 59.470 59.733 -0.263 1
1 412 . 9 1 1 A 35 35 ARG CB C 265 29.790 29.916 -0.126 1
1 415 . 9 1 1 A 35 35 ARG N N 265 117.340 120.700 -3.360 1
1 416 . 9 1 1 A 36 36 SER H H 266 7.610 7.648 -0.038 1
1 417 . 9 1 1 A 36 36 SER HA H 266 4.080 4.094 -0.014 1
1 420 . 9 1 1 A 36 36 SER CA C 266 63.080 61.598 1.482 1
1 421 . 9 1 1 A 36 36 SER CB C 266 63.280 63.015 0.265 1
1 422 . 9 1 1 A 36 36 SER N N 266 116.710 113.800 2.910 1
1 423 . 9 1 1 A 37 37 ALA H H 267 8.720 7.951 0.769 1
1 424 . 9 1 1 A 37 37 ALA HA H 267 3.760 3.997 -0.237 1
1 428 . 9 1 1 A 37 37 ALA CA C 267 55.900 55.342 0.558 1
1 429 . 9 1 1 A 37 37 ALA CB C 267 18.090 17.952 0.138 1
1 430 . 9 1 1 A 37 37 ALA N N 267 124.170 122.369 1.801 1
1 431 . 9 1 1 A 38 38 ASN H H 268 8.850 9.399 -0.549 1
1 432 . 9 1 1 A 38 38 ASN HA H 268 4.420 4.501 -0.081 1
1 437 . 9 1 1 A 38 38 ASN CA C 268 55.700 56.200 -0.500 1
1 438 . 9 1 1 A 38 38 ASN CB C 268 37.180 37.685 -0.505 1
1 439 . 9 1 1 A 38 38 ASN N N 268 117.370 117.607 -0.237 1
1 441 . 9 1 1 A 39 39 CYS H H 269 7.970 7.997 -0.027 1
1 442 . 9 1 1 A 39 39 CYS HA H 269 4.190 4.084 0.106 1
1 445 . 9 1 1 A 39 39 CYS CA C 269 63.340 63.141 0.199 1
1 446 . 9 1 1 A 39 39 CYS CB C 269 26.870 27.070 -0.200 1
1 447 . 9 1 1 A 39 39 CYS N N 269 120.510 118.758 1.752 1
1 448 . 9 1 1 A 40 40 LEU H H 270 7.600 7.755 -0.155 1
1 449 . 9 1 1 A 40 40 LEU HA H 270 3.880 3.929 -0.049 1
1 458 . 9 1 1 A 40 40 LEU CA C 270 57.810 58.062 -0.252 1
1 459 . 9 1 1 A 40 40 LEU CB C 270 40.030 41.486 -1.456 1
1 462 . 9 1 1 A 40 40 LEU N N 270 117.710 120.448 -2.738 1
1 463 . 9 1 1 A 41 41 LYS H H 271 7.980 8.263 -0.283 1
1 464 . 9 1 1 A 41 41 LYS HA H 271 3.820 4.474 -0.654 1
1 472 . 9 1 1 A 41 41 LYS CA C 271 59.840 59.730 0.110 1
1 473 . 9 1 1 A 41 41 LYS CB C 271 32.070 32.157 -0.087 1
1 476 . 9 1 1 A 41 41 LYS N N 271 120.070 117.269 2.801 1
1 477 . 9 1 1 A 42 42 ALA H H 272 7.860 8.357 -0.497 1
1 478 . 9 1 1 A 42 42 ALA HA H 272 4.140 4.031 0.109 1
1 482 . 9 1 1 A 42 42 ALA CA C 272 54.670 54.821 -0.151 1
1 483 . 9 1 1 A 42 42 ALA CB C 272 17.950 18.677 -0.727 1
1 484 . 9 1 1 A 42 42 ALA N N 272 122.880 121.122 1.758 1
1 485 . 9 1 1 A 43 43 GLU H H 273 7.210 7.950 -0.740 1
1 486 . 9 1 1 A 43 43 GLU HA H 273 4.260 4.448 -0.188 1
1 491 . 9 1 1 A 43 43 GLU CA C 273 55.020 55.978 -0.958 1
1 492 . 9 1 1 A 43 43 GLU CB C 273 29.880 29.527 0.353 1
1 494 . 9 1 1 A 43 43 GLU N N 273 116.590 115.482 1.108 1
1 495 . 9 1 1 A 44 44 ALA H H 274 7.880 8.284 -0.404 1
1 496 . 9 1 1 A 44 44 ALA HA H 274 3.680 3.894 -0.214 1
1 500 . 9 1 1 A 44 44 ALA CA C 274 52.960 53.148 -0.188 1
1 501 . 9 1 1 A 44 44 ALA CB C 274 16.110 17.206 -1.096 1
1 502 . 9 1 1 A 44 44 ALA N N 274 118.420 118.849 -0.429 1
1 503 . 9 1 1 A 45 45 ILE H H 275 7.600 7.651 -0.051 1
1 504 . 9 1 1 A 45 45 ILE HA H 275 3.870 4.678 -0.808 1
1 514 . 9 1 1 A 45 45 ILE CA C 275 61.150 60.452 0.698 1
1 515 . 9 1 1 A 45 45 ILE CB C 275 37.090 39.816 -2.726 1
1 519 . 9 1 1 A 45 45 ILE N N 275 120.370 118.044 2.326 1
1 520 . 9 1 1 A 46 46 HIS H H 276 8.350 8.183 0.167 1
1 521 . 9 1 1 A 46 46 HIS HA H 276 4.600 4.864 -0.264 1
1 526 . 9 1 1 A 46 46 HIS CA C 276 56.900 56.072 0.828 1
1 527 . 9 1 1 A 46 46 HIS CB C 276 31.910 31.092 0.818 1
1 529 . 9 1 1 A 46 46 HIS N N 276 123.250 122.738 0.512 1
1 530 . 9 1 1 A 47 47 TYR H H 277 8.850 6.950 1.900 1
1 531 . 9 1 1 A 47 47 TYR HA H 277 5.100 4.560 0.540 1
1 538 . 9 1 1 A 47 47 TYR CA C 277 57.430 56.635 0.795 1
1 539 . 9 1 1 A 47 47 TYR CB C 277 40.680 39.868 0.812 1
1 544 . 9 1 1 A 47 47 TYR N N 277 119.700 118.099 1.601 1
1 545 . 9 1 1 A 48 48 ILE H H 278 9.380 8.394 0.986 1
1 546 . 9 1 1 A 48 48 ILE HA H 278 3.340 3.581 -0.241 1
1 554 . 9 1 1 A 48 48 ILE CA C 278 67.640 64.986 2.654 1
1 555 . 9 1 1 A 48 48 ILE CB C 278 36.310 37.547 -1.237 1
1 558 . 9 1 1 A 48 48 ILE N N 278 125.650 124.222 1.428 1
1 559 . 9 1 1 A 49 49 GLY H H 279 9.430 7.891 1.539 1
1 560 . 9 1 1 A 49 49 GLY HA2 H 279 2.370 2.087 0.283 1
1 561 . 9 1 1 A 49 49 GLY HA3 H 279 3.230 3.469 -0.239 1
1 562 . 9 1 1 A 49 49 GLY CA C 279 46.820 46.695 0.125 1
1 563 . 9 1 1 A 49 49 GLY N N 279 105.200 108.509 -3.309 1
1 564 . 9 1 1 A 50 50 ASP H H 280 7.050 7.590 -0.540 1
1 565 . 9 1 1 A 50 50 ASP HA H 280 4.360 4.141 0.219 1
1 568 . 9 1 1 A 50 50 ASP CA C 280 57.110 56.178 0.932 1
1 569 . 9 1 1 A 50 50 ASP CB C 280 42.620 40.474 2.146 1
1 570 . 9 1 1 A 50 50 ASP N N 280 116.360 121.014 -4.654 1
1 571 . 9 1 1 A 51 51 LEU H H 281 7.170 8.237 -1.067 1
1 572 . 9 1 1 A 51 51 LEU HA H 281 3.880 3.981 -0.101 1
1 582 . 9 1 1 A 51 51 LEU CA C 281 57.900 58.273 -0.373 1
1 583 . 9 1 1 A 51 51 LEU CB C 281 41.870 41.593 0.277 1
1 587 . 9 1 1 A 51 51 LEU N N 281 120.130 121.900 -1.770 1
1 588 . 9 1 1 A 52 52 VAL H H 282 7.820 7.632 0.188 1
1 589 . 9 1 1 A 52 52 VAL HA H 282 3.980 3.895 0.085 1
1 597 . 9 1 1 A 52 52 VAL CA C 282 64.000 65.326 -1.326 1
1 598 . 9 1 1 A 52 52 VAL CB C 282 30.400 31.304 -0.904 1
1 601 . 9 1 1 A 52 52 VAL N N 282 105.550 115.301 -9.751 1
1 602 . 9 1 1 A 53 53 GLN H H 283 6.550 7.624 -1.074 1
1 603 . 9 1 1 A 53 53 GLN HA H 283 4.680 4.049 0.631 1
1 610 . 9 1 1 A 53 53 GLN CA C 283 56.210 58.844 -2.634 1
1 611 . 9 1 1 A 53 53 GLN CB C 283 31.710 28.839 2.871 1
1 613 . 9 1 1 A 53 53 GLN N N 283 114.060 120.808 -6.748 1
1 615 . 9 1 1 A 54 54 ARG H H 284 7.690 7.565 0.125 1
1 616 . 9 1 1 A 54 54 ARG HA H 284 4.520 4.723 -0.203 1
1 624 . 9 1 1 A 54 54 ARG CA C 284 54.600 54.458 0.142 1
1 625 . 9 1 1 A 54 54 ARG CB C 284 30.750 31.533 -0.783 1
1 628 . 9 1 1 A 54 54 ARG N N 284 119.810 118.546 1.264 1
1 629 . 9 1 1 A 55 55 THR H H 285 8.110 8.739 -0.629 1
1 630 . 9 1 1 A 55 55 THR HA H 285 4.430 4.548 -0.118 1
1 635 . 9 1 1 A 55 55 THR CA C 285 59.640 62.391 -2.751 1
1 636 . 9 1 1 A 55 55 THR CB C 285 71.310 69.847 1.463 1
1 638 . 9 1 1 A 55 55 THR N N 285 108.450 117.814 -9.364 1
1 639 . 9 1 1 A 56 56 GLU H H 286 8.910 9.098 -0.188 1
1 640 . 9 1 1 A 56 56 GLU HA H 286 3.660 4.012 -0.352 1
1 645 . 9 1 1 A 56 56 GLU CA C 286 60.650 59.587 1.063 1
1 646 . 9 1 1 A 56 56 GLU CB C 286 29.400 29.206 0.194 1
1 648 . 9 1 1 A 56 56 GLU N N 286 120.600 125.010 -4.410 1
1 649 . 9 1 1 A 57 57 VAL H H 287 7.600 8.184 -0.584 1
1 650 . 9 1 1 A 57 57 VAL HA H 287 3.620 3.523 0.097 1
1 658 . 9 1 1 A 57 57 VAL CA C 287 66.020 67.097 -1.077 1
1 659 . 9 1 1 A 57 57 VAL CB C 287 31.720 31.590 0.130 1
1 662 . 9 1 1 A 57 57 VAL N N 287 114.050 120.458 -6.408 1
1 663 . 9 1 1 A 58 58 GLU H H 288 7.350 8.505 -1.155 1
1 664 . 9 1 1 A 58 58 GLU HA H 288 3.830 4.059 -0.229 1
1 669 . 9 1 1 A 58 58 GLU CA C 288 59.250 59.620 -0.370 1
1 670 . 9 1 1 A 58 58 GLU CB C 288 30.030 29.180 0.850 1
1 672 . 9 1 1 A 58 58 GLU N N 288 117.610 119.324 -1.714 1
1 673 . 9 1 1 A 59 59 LEU H H 289 7.850 8.066 -0.216 1
1 674 . 9 1 1 A 59 59 LEU HA H 289 4.150 4.068 0.082 1
1 683 . 9 1 1 A 59 59 LEU CA C 289 57.340 57.957 -0.617 1
1 684 . 9 1 1 A 59 59 LEU CB C 289 41.170 41.507 -0.337 1
1 687 . 9 1 1 A 59 59 LEU N N 289 120.050 120.432 -0.382 1
1 688 . 9 1 1 A 60 60 LEU H H 290 7.670 8.235 -0.565 1
1 689 . 9 1 1 A 60 60 LEU HA H 290 4.540 3.991 0.549 1
1 696 . 9 1 1 A 60 60 LEU CA C 290 55.090 57.176 -2.086 1
1 697 . 9 1 1 A 60 60 LEU CB C 290 42.320 41.231 1.089 1
1 701 . 9 1 1 A 60 60 LEU N N 290 114.980 119.160 -4.180 1
1 702 . 9 1 1 A 61 61 LYS H H 291 7.440 7.399 0.041 1
1 703 . 9 1 1 A 61 61 LYS HA H 291 4.280 4.326 -0.046 1
1 710 . 9 1 1 A 61 61 LYS CA C 291 56.860 57.113 -0.253 1
1 711 . 9 1 1 A 61 61 LYS CB C 291 31.900 32.950 -1.050 1
1 714 . 9 1 1 A 61 61 LYS N N 291 118.120 116.232 1.888 1
1 715 . 9 1 1 A 62 62 THR H H 292 7.310 7.466 -0.156 1
1 716 . 9 1 1 A 62 62 THR HA H 292 5.220 4.399 0.821 1
1 721 . 9 1 1 A 62 62 THR CA C 292 55.830 60.166 -4.336 1
1 722 . 9 1 1 A 62 62 THR CB C 292 69.970 69.101 0.869 1
1 724 . 9 1 1 A 62 62 THR N N 292 111.890 115.373 -3.483 1
1 725 . 9 1 1 A 63 63 PRO HA H 293 4.570 4.479 0.091 1
1 730 . 9 1 1 A 63 63 PRO CA C 293 63.710 64.201 -0.491 1
1 731 . 9 1 1 A 63 63 PRO CB C 293 32.380 31.763 0.617 1
1 733 . 9 1 1 A 64 64 ASN H H 294 8.050 8.757 -0.707 1
1 734 . 9 1 1 A 64 64 ASN HA H 294 4.490 4.469 0.021 1
1 739 . 9 1 1 A 64 64 ASN CA C 294 55.630 55.030 0.600 1
1 740 . 9 1 1 A 64 64 ASN CB C 294 38.730 38.104 0.626 1
1 741 . 9 1 1 A 64 64 ASN N N 294 117.120 117.150 -0.030 1
1 743 . 9 1 1 A 65 65 LEU H H 295 7.550 7.288 0.262 1
1 744 . 9 1 1 A 65 65 LEU HA H 295 4.640 4.428 0.212 1
1 754 . 9 1 1 A 65 65 LEU CA C 295 54.310 54.129 0.181 1
1 755 . 9 1 1 A 65 65 LEU CB C 295 43.640 42.727 0.913 1
1 758 . 9 1 1 A 65 65 LEU N N 295 119.930 119.792 0.138 1
1 759 . 9 1 1 A 66 66 GLY H H 296 7.850 8.523 -0.673 1
1 760 . 9 1 1 A 66 66 GLY HA2 H 296 3.810 4.109 -0.299 1
1 761 . 9 1 1 A 66 66 GLY HA3 H 296 4.110 4.109 0.001 1
1 762 . 9 1 1 A 66 66 GLY CA C 296 43.570 44.387 -0.817 1
1 763 . 9 1 1 A 66 66 GLY N N 296 108.840 109.396 -0.556 1
1 764 . 9 1 1 A 67 67 LYS H H 297 8.820 8.584 0.236 1
1 765 . 9 1 1 A 67 67 LYS HA H 297 3.980 3.874 0.106 1
1 774 . 9 1 1 A 67 67 LYS CA C 297 60.100 59.562 0.538 1
1 775 . 9 1 1 A 67 67 LYS CB C 297 32.100 32.147 -0.047 1
1 779 . 9 1 1 A 67 67 LYS N N 297 120.130 118.206 1.924 1
1 780 . 9 1 1 A 68 68 LYS H H 298 8.850 7.894 0.956 1
1 781 . 9 1 1 A 68 68 LYS HA H 298 4.060 4.072 -0.012 1
1 790 . 9 1 1 A 68 68 LYS CA C 298 60.600 59.115 1.485 1
1 791 . 9 1 1 A 68 68 LYS CB C 298 31.920 32.031 -0.111 1
1 795 . 9 1 1 A 68 68 LYS N N 298 119.580 121.136 -1.556 1
1 796 . 9 1 1 A 69 69 SER H H 299 8.100 8.095 0.005 1
1 797 . 9 1 1 A 69 69 SER HA H 299 4.370 4.090 0.280 1
1 800 . 9 1 1 A 69 69 SER CA C 299 61.980 62.214 -0.234 1
1 801 . 9 1 1 A 69 69 SER CB C 299 63.000 63.281 -0.281 1
1 802 . 9 1 1 A 69 69 SER N N 299 116.360 117.278 -0.918 1
1 803 . 9 1 1 A 70 70 LEU H H 300 8.240 8.534 -0.294 1
1 804 . 9 1 1 A 70 70 LEU HA H 300 3.970 3.961 0.009 1
1 814 . 9 1 1 A 70 70 LEU CA C 300 57.610 58.011 -0.401 1
1 815 . 9 1 1 A 70 70 LEU CB C 300 41.060 41.434 -0.374 1
1 819 . 9 1 1 A 70 70 LEU N N 300 123.330 121.150 2.180 1
1 820 . 9 1 1 A 71 71 THR H H 301 8.550 7.792 0.758 1
1 821 . 9 1 1 A 71 71 THR HA H 301 3.690 3.831 -0.141 1
1 826 . 9 1 1 A 71 71 THR CA C 301 67.170 66.797 0.373 1
1 827 . 9 1 1 A 71 71 THR CB C 301 68.810 68.631 0.179 1
1 829 . 9 1 1 A 71 71 THR N N 301 116.520 115.385 1.135 1
1 830 . 9 1 1 A 72 72 GLU H H 302 7.520 8.330 -0.810 1
1 831 . 9 1 1 A 72 72 GLU HA H 302 4.070 3.971 0.099 1
1 836 . 9 1 1 A 72 72 GLU CA C 302 59.470 59.487 -0.017 1
1 837 . 9 1 1 A 72 72 GLU CB C 302 29.090 29.355 -0.265 1
1 839 . 9 1 1 A 72 72 GLU N N 302 121.510 119.236 2.274 1
1 840 . 9 1 1 A 73 73 ILE H H 303 8.290 7.924 0.366 1
1 841 . 9 1 1 A 73 73 ILE HA H 303 3.380 3.595 -0.215 1
1 849 . 9 1 1 A 73 73 ILE CA C 303 66.010 65.230 0.780 1
1 850 . 9 1 1 A 73 73 ILE CB C 303 38.680 38.167 0.513 1
1 853 . 9 1 1 A 73 73 ILE N N 303 118.510 121.004 -2.494 1
1 854 . 9 1 1 A 74 74 LYS H H 304 8.550 7.946 0.604 1
1 855 . 9 1 1 A 74 74 LYS HA H 304 3.680 3.814 -0.134 1
1 864 . 9 1 1 A 74 74 LYS CA C 304 61.320 60.393 0.927 1
1 865 . 9 1 1 A 74 74 LYS CB C 304 32.060 32.176 -0.116 1
1 868 . 9 1 1 A 74 74 LYS N N 304 118.220 118.920 -0.700 1
1 869 . 9 1 1 A 75 75 ASP H H 305 8.450 8.020 0.430 1
1 870 . 9 1 1 A 75 75 ASP HA H 305 4.440 4.372 0.068 1
1 873 . 9 1 1 A 75 75 ASP CA C 305 57.690 57.258 0.432 1
1 874 . 9 1 1 A 75 75 ASP CB C 305 40.220 40.785 -0.565 1
1 875 . 9 1 1 A 75 75 ASP N N 305 121.790 119.491 2.299 1
1 876 . 9 1 1 A 76 76 VAL H H 306 8.680 7.870 0.810 1
1 877 . 9 1 1 A 76 76 VAL HA H 306 3.890 3.609 0.281 1
1 885 . 9 1 1 A 76 76 VAL CA C 306 66.020 66.439 -0.419 1
1 886 . 9 1 1 A 76 76 VAL CB C 306 31.250 31.420 -0.170 1
1 889 . 9 1 1 A 76 76 VAL N N 306 121.150 119.945 1.205 1
1 890 . 9 1 1 A 77 77 LEU H H 307 8.470 8.318 0.152 1
1 891 . 9 1 1 A 77 77 LEU HA H 307 3.810 4.033 -0.223 1
1 901 . 9 1 1 A 77 77 LEU CA C 307 58.330 57.490 0.840 1
1 902 . 9 1 1 A 77 77 LEU CB C 307 41.250 41.150 0.100 1
1 906 . 9 1 1 A 77 77 LEU N N 307 120.830 119.524 1.306 1
1 907 . 9 1 1 A 78 78 ALA H H 308 8.280 8.326 -0.046 1
1 908 . 9 1 1 A 78 78 ALA HA H 308 4.320 4.092 0.228 1
1 912 . 9 1 1 A 78 78 ALA CA C 308 55.420 55.012 0.408 1
1 913 . 9 1 1 A 78 78 ALA CB C 308 17.750 18.141 -0.391 1
1 914 . 9 1 1 A 78 78 ALA N N 308 122.530 123.378 -0.848 1
1 915 . 9 1 1 A 79 79 SER H H 309 7.900 8.040 -0.140 1
1 916 . 9 1 1 A 79 79 SER HA H 309 4.340 4.336 0.004 1
1 919 . 9 1 1 A 79 79 SER CA C 309 61.350 60.157 1.193 1
1 920 . 9 1 1 A 79 79 SER CB C 309 63.280 63.637 -0.357 1
1 921 . 9 1 1 A 79 79 SER N N 309 115.600 113.278 2.322 1
1 922 . 9 1 1 A 80 80 ARG H H 310 7.450 8.118 -0.668 1
1 923 . 9 1 1 A 80 80 ARG HA H 310 4.550 4.017 0.533 1
1 931 . 9 1 1 A 80 80 ARG CA C 310 54.200 57.317 -3.117 1
1 932 . 9 1 1 A 80 80 ARG CB C 310 30.680 27.320 3.360 1
1 935 . 9 1 1 A 80 80 ARG N N 310 119.360 117.901 1.459 1
1 936 . 9 1 1 A 81 81 GLY H H 311 7.940 8.301 -0.361 1
1 937 . 9 1 1 A 81 81 GLY HA2 H 311 3.840 3.957 -0.117 1
1 938 . 9 1 1 A 81 81 GLY HA3 H 311 4.070 3.959 0.111 1
1 939 . 9 1 1 A 81 81 GLY CA C 311 46.060 45.236 0.824 1
1 940 . 9 1 1 A 81 81 GLY N N 311 108.130 105.925 2.205 1
1 941 . 9 1 1 A 82 82 LEU H H 312 7.920 7.422 0.498 1
1 942 . 9 1 1 A 82 82 LEU HA H 312 4.680 4.670 0.010 1
1 952 . 9 1 1 A 82 82 LEU CA C 312 53.070 52.847 0.223 1
1 953 . 9 1 1 A 82 82 LEU CB C 312 45.790 45.163 0.627 1
1 957 . 9 1 1 A 82 82 LEU N N 312 119.290 117.742 1.548 1
1 958 . 9 1 1 A 83 83 SER H H 313 7.530 8.864 -1.334 1
1 959 . 9 1 1 A 83 83 SER HA H 313 4.450 4.136 0.314 1
1 962 . 9 1 1 A 83 83 SER CA C 313 57.190 58.910 -1.720 1
1 963 . 9 1 1 A 83 83 SER CB C 313 66.080 62.767 3.313 1
1 964 . 9 1 1 A 83 83 SER N N 313 113.120 115.263 -2.143 1
1 965 . 9 1 1 A 84 84 LEU H H 314 8.340 8.369 -0.029 1
1 966 . 9 1 1 A 84 84 LEU HA H 314 4.620 4.399 0.221 1
1 976 . 9 1 1 A 84 84 LEU CA C 314 54.720 54.803 -0.083 1
1 977 . 9 1 1 A 84 84 LEU CB C 314 41.620 42.152 -0.532 1
1 981 . 9 1 1 A 84 84 LEU N N 314 115.930 119.196 -3.266 1
1 982 . 9 1 1 A 85 85 GLY H H 315 8.270 7.845 0.425 1
1 983 . 9 1 1 A 85 85 GLY HA2 H 315 3.320 3.954 -0.634 1
1 984 . 9 1 1 A 85 85 GLY HA3 H 315 3.850 3.955 -0.105 1
1 985 . 9 1 1 A 85 85 GLY CA C 315 46.560 46.576 -0.016 1
1 986 . 9 1 1 A 85 85 GLY N N 315 111.010 108.108 2.902 1
1 987 . 9 1 1 A 86 86 MET H H 316 8.650 8.102 0.548 1
1 988 . 9 1 1 A 86 86 MET HA H 316 3.990 4.782 -0.792 1
1 996 . 9 1 1 A 86 86 MET CA C 316 56.730 55.452 1.278 1
1 997 . 9 1 1 A 86 86 MET CB C 316 33.600 34.916 -1.316 1
1 1000 . 9 1 1 A 86 86 MET N N 316 120.570 119.293 1.277 1
1 1001 . 9 1 1 A 87 87 ARG H H 317 8.360 8.414 -0.054 1
1 1002 . 9 1 1 A 87 87 ARG HA H 317 4.450 5.256 -0.806 1
1 1010 . 9 1 1 A 87 87 ARG CA C 317 55.310 54.624 0.686 1
1 1011 . 9 1 1 A 87 87 ARG CB C 317 30.490 33.792 -3.302 1
1 1014 . 9 1 1 A 87 87 ARG N N 317 122.290 119.463 2.827 1
1 1015 . 9 1 1 A 88 88 LEU H H 318 8.400 8.831 -0.431 1
1 1016 . 9 1 1 A 88 88 LEU HA H 318 4.670 4.969 -0.299 1
1 1026 . 9 1 1 A 88 88 LEU CA C 318 53.110 53.249 -0.139 1
1 1027 . 9 1 1 A 88 88 LEU CB C 318 43.600 45.506 -1.906 1
1 1031 . 9 1 1 A 88 88 LEU N N 318 126.420 125.127 1.293 1
1 1032 . 9 1 1 A 89 89 GLU H H 319 8.780 9.064 -0.284 1
1 1033 . 9 1 1 A 89 89 GLU HA H 319 4.340 4.015 0.325 1
1 1038 . 9 1 1 A 89 89 GLU CA C 319 56.490 59.505 -3.015 1
1 1039 . 9 1 1 A 89 89 GLU CB C 319 30.470 29.595 0.875 1
1 1041 . 9 1 1 A 89 89 GLU N N 319 123.070 124.592 -1.522 1
1 1042 . 9 1 1 A 90 90 ASN H H 320 8.900 8.360 0.540 1
1 1043 . 9 1 1 A 90 90 ASN HA H 320 4.410 4.979 -0.569 1
1 1048 . 9 1 1 A 90 90 ASN CA C 320 54.120 54.522 -0.402 1
1 1049 . 9 1 1 A 90 90 ASN CB C 320 37.640 40.276 -2.636 1
1 1050 . 9 1 1 A 90 90 ASN N N 320 116.540 114.829 1.711 1
1 1052 . 9 1 1 A 91 91 TRP H H 321 7.990 7.400 0.590 1
1 1053 . 9 1 1 A 91 91 TRP HA H 321 4.330 4.784 -0.454 1
1 1062 . 9 1 1 A 91 91 TRP CA C 321 54.590 58.419 -3.829 1
1 1063 . 9 1 1 A 91 91 TRP CB C 321 31.280 31.209 0.071 1
1 1069 . 9 1 1 A 91 91 TRP N N 321 119.230 114.627 4.603 1
1 1071 . 9 1 1 A 92 92 PRO HA H 322 4.800 3.954 0.846 1
1 1077 . 9 1 1 A 93 93 PRO HA H 323 4.450 4.474 -0.024 1
1 1084 . 9 1 1 A 93 93 PRO CA C 323 61.970 62.568 -0.598 1
1 1085 . 9 1 1 A 93 93 PRO CB C 323 32.830 32.698 0.132 1
1 1088 . 9 1 1 A 94 94 ALA H H 324 8.460 8.845 -0.385 1
1 1089 . 9 1 1 A 94 94 ALA HA H 324 4.000 3.991 0.009 1
1 1093 . 9 1 1 A 94 94 ALA CA C 324 53.790 54.994 -1.204 1
1 1094 . 9 1 1 A 94 94 ALA CB C 324 18.640 17.742 0.898 1
1 1095 . 9 1 1 A 94 94 ALA N N 324 124.010 127.094 -3.084 1
1 1096 . 9 1 1 A 95 95 SER H H 325 7.950 7.914 0.036 1
1 1097 . 9 1 1 A 95 95 SER HA H 325 4.210 4.075 0.135 1
1 1100 . 9 1 1 A 95 95 SER CA C 325 58.970 61.896 -2.926 1
1 1101 . 9 1 1 A 95 95 SER CB C 325 63.040 62.907 0.133 1
1 1102 . 9 1 1 A 95 95 SER N N 325 111.520 114.017 -2.497 1
1 1103 . 9 1 1 A 96 96 ILE H H 326 7.480 7.964 -0.484 1
1 1104 . 9 1 1 A 96 96 ILE HA H 326 4.170 3.440 0.730 1
1 1114 . 9 1 1 A 96 96 ILE CA C 326 61.300 62.970 -1.670 1
1 1115 . 9 1 1 A 96 96 ILE CB C 326 38.530 37.689 0.841 1
1 1119 . 9 1 1 A 96 96 ILE N N 326 119.650 121.238 -1.588 1
1 1120 . 9 1 1 A 97 97 ALA H H 327 7.860 6.945 0.915 1
1 1121 . 9 1 1 A 97 97 ALA HA H 327 4.230 4.054 0.176 1
1 1125 . 9 1 1 A 97 97 ALA CA C 327 52.570 52.434 0.136 1
1 1126 . 9 1 1 A 97 97 ALA CB C 327 19.590 19.514 0.076 1
1 1127 . 9 1 1 A 97 97 ALA N N 327 126.480 124.438 2.042 1
1 1128 . 9 1 1 A 98 98 ASP H H 328 8.250 8.826 -0.576 1
1 1129 . 9 1 1 A 98 98 ASP HA H 328 4.540 4.224 0.316 1
1 1132 . 9 1 1 A 98 98 ASP CA C 328 54.150 57.558 -3.408 1
1 1133 . 9 1 1 A 98 98 ASP CB C 328 41.120 40.484 0.636 1
1 1134 . 9 1 1 A 98 98 ASP N N 328 120.130 123.399 -3.269 1
1 1150 . 9 2 2 B 6 6 ASP H H 427 8.160 8.051 0.109 1
1 1151 . 9 2 2 B 6 6 ASP HA H 427 4.630 4.337 0.293 1
1 1154 . 9 2 2 B 6 6 ASP CA C 427 54.410 56.731 -2.321 1
1 1155 . 9 2 2 B 6 6 ASP CB C 427 41.250 40.640 0.610 1
1 1156 . 9 2 2 B 6 6 ASP N N 427 120.160 121.030 -0.870 1
1 1157 . 9 2 2 B 7 7 ASN H H 428 8.350 7.769 0.581 1
1 1158 . 9 2 2 B 7 7 ASN HA H 428 4.550 4.816 -0.266 1
1 1163 . 9 2 2 B 7 7 ASN CA C 428 53.310 53.733 -0.423 1
1 1164 . 9 2 2 B 7 7 ASN CB C 428 38.850 38.914 -0.064 1
1 1165 . 9 2 2 B 7 7 ASN N N 428 118.440 115.244 3.196 1
1 1167 . 9 2 2 B 8 8 LYS H H 429 8.030 7.714 0.316 1
1 1172 . 9 2 2 B 8 8 LYS CB C 429 33.280 33.322 -0.042 1
1 1174 . 9 2 2 B 8 8 LYS N N 429 120.260 122.652 -2.392 1
1 1175 . 9 2 2 B 9 9 PRO HA H 430 4.420 4.544 -0.124 1
1 1182 . 9 2 2 B 9 9 PRO CA C 430 62.280 62.672 -0.392 1
1 1183 . 9 2 2 B 9 9 PRO CB C 430 31.920 32.266 -0.346 1
1 1186 . 9 2 2 B 10 10 ALA H H 431 8.930 9.368 -0.438 1
1 1187 . 9 2 2 B 10 10 ALA HA H 431 4.350 4.505 -0.155 1
1 1191 . 9 2 2 B 10 10 ALA CA C 431 51.070 52.182 -1.112 1
1 1192 . 9 2 2 B 10 10 ALA CB C 431 20.920 19.550 1.370 1
1 1193 . 9 2 2 B 10 10 ALA N N 431 125.000 125.007 -0.007 1
1 1194 . 9 2 2 B 11 11 ASP H H 432 8.530 9.402 -0.872 1
1 1195 . 9 2 2 B 11 11 ASP HA H 432 4.220 4.280 -0.060 1
1 1198 . 9 2 2 B 11 11 ASP CA C 432 57.520 57.788 -0.268 1
1 1199 . 9 2 2 B 11 11 ASP CB C 432 40.470 40.316 0.154 1
1 1200 . 9 2 2 B 11 11 ASP N N 432 119.610 123.011 -3.401 1
1 1201 . 9 2 2 B 12 12 ASP H H 433 8.340 8.005 0.335 1
1 1202 . 9 2 2 B 12 12 ASP HA H 433 4.160 4.443 -0.283 1
1 1205 . 9 2 2 B 12 12 ASP CA C 433 56.090 57.502 -1.412 1
1 1206 . 9 2 2 B 12 12 ASP CB C 433 38.960 40.739 -1.779 1
1 1207 . 9 2 2 B 12 12 ASP N N 433 116.330 119.263 -2.933 1
1 1208 . 9 2 2 B 13 13 LEU H H 434 7.360 7.775 -0.415 1
1 1209 . 9 2 2 B 13 13 LEU HA H 434 4.050 4.079 -0.029 1
1 1219 . 9 2 2 B 13 13 LEU CA C 434 57.340 57.665 -0.325 1
1 1220 . 9 2 2 B 13 13 LEU CB C 434 42.960 41.608 1.352 1
1 1224 . 9 2 2 B 13 13 LEU N N 434 123.440 121.324 2.116 1
1 1225 . 9 2 2 B 14 14 LEU H H 435 7.670 7.647 0.023 1
1 1226 . 9 2 2 B 14 14 LEU HA H 435 3.710 4.051 -0.341 1
1 1236 . 9 2 2 B 14 14 LEU CA C 435 57.170 57.265 -0.095 1
1 1237 . 9 2 2 B 14 14 LEU CB C 435 42.590 41.890 0.700 1
1 1241 . 9 2 2 B 14 14 LEU N N 435 115.170 119.591 -4.421 1
1 1242 . 9 2 2 B 15 15 ASN H H 436 7.490 8.276 -0.786 1
1 1243 . 9 2 2 B 15 15 ASN HA H 436 4.640 4.744 -0.104 1
1 1248 . 9 2 2 B 15 15 ASN CA C 436 52.920 54.109 -1.189 1
1 1249 . 9 2 2 B 15 15 ASN CB C 436 39.350 38.776 0.574 1
1 1250 . 9 2 2 B 15 15 ASN N N 436 112.280 115.204 -2.924 1
1 1252 . 9 2 2 B 16 16 LEU H H 437 7.300 7.406 -0.106 1
1 1253 . 9 2 2 B 16 16 LEU HA H 437 4.100 4.236 -0.136 1
1 1263 . 9 2 2 B 16 16 LEU CA C 437 55.310 55.225 0.085 1
1 1264 . 9 2 2 B 16 16 LEU CB C 437 41.800 43.101 -1.301 1
1 1268 . 9 2 2 B 16 16 LEU N N 437 125.180 122.742 2.438 1
1 1269 . 9 2 2 B 17 17 GLU H H 438 8.590 8.730 -0.140 1
1 1270 . 9 2 2 B 17 17 GLU HA H 438 3.920 3.978 -0.058 1
1 1275 . 9 2 2 B 17 17 GLU CA C 438 58.440 58.164 0.276 1
1 1276 . 9 2 2 B 17 17 GLU CB C 438 29.180 29.552 -0.372 1
1 1278 . 9 2 2 B 17 17 GLU N N 438 129.850 125.641 4.209 1
1 1279 . 9 2 2 B 18 18 GLY H H 439 8.580 8.939 -0.359 1
1 1280 . 9 2 2 B 18 18 GLY HA2 H 439 3.570 3.960 -0.390 1
1 1281 . 9 2 2 B 18 18 GLY HA3 H 439 4.220 3.964 0.256 1
1 1282 . 9 2 2 B 18 18 GLY CA C 439 44.710 45.468 -0.758 1
1 1283 . 9 2 2 B 18 18 GLY N N 439 112.250 114.700 -2.450 1
1 1284 . 9 2 2 B 19 19 VAL H H 440 7.900 7.798 0.102 1
1 1285 . 9 2 2 B 19 19 VAL HA H 440 3.950 4.419 -0.469 1
1 1293 . 9 2 2 B 19 19 VAL CA C 440 62.820 61.054 1.766 1
1 1294 . 9 2 2 B 19 19 VAL CB C 440 31.470 34.655 -3.185 1
1 1297 . 9 2 2 B 19 19 VAL N N 440 121.910 121.747 0.163 1
1 1298 . 9 2 2 B 20 20 ASP H H 441 7.390 8.869 -1.479 1
1 1299 . 9 2 2 B 20 20 ASP HA H 441 4.820 4.803 0.017 1
1 1302 . 9 2 2 B 20 20 ASP CA C 441 51.920 53.190 -1.270 1
1 1303 . 9 2 2 B 20 20 ASP CB C 441 42.090 41.747 0.343 1
1 1304 . 9 2 2 B 20 20 ASP N N 441 124.850 126.857 -2.007 1
1 1305 . 9 2 2 B 21 21 ARG H H 442 8.630 8.705 -0.075 1
1 1306 . 9 2 2 B 21 21 ARG HA H 442 3.810 3.422 0.388 1
1 1313 . 9 2 2 B 21 21 ARG CA C 442 60.710 60.018 0.692 1
1 1314 . 9 2 2 B 21 21 ARG CB C 442 30.020 30.082 -0.062 1
1 1317 . 9 2 2 B 21 21 ARG N N 442 120.890 122.393 -1.503 1
1 1318 . 9 2 2 B 22 22 ASP H H 443 8.140 7.972 0.168 1
1 1319 . 9 2 2 B 22 22 ASP HA H 443 4.420 4.494 -0.074 1
1 1322 . 9 2 2 B 22 22 ASP CA C 443 57.680 57.105 0.575 1
1 1323 . 9 2 2 B 22 22 ASP CB C 443 40.880 41.103 -0.223 1
1 1324 . 9 2 2 B 22 22 ASP N N 443 116.750 119.872 -3.122 1
1 1325 . 9 2 2 B 23 23 LEU H H 444 8.170 7.996 0.174 1
1 1326 . 9 2 2 B 23 23 LEU HA H 444 4.130 4.077 0.053 1
1 1336 . 9 2 2 B 23 23 LEU CA C 444 57.770 57.739 0.031 1
1 1337 . 9 2 2 B 23 23 LEU CB C 444 41.230 41.215 0.015 1
1 1341 . 9 2 2 B 23 23 LEU N N 444 122.130 121.259 0.871 1
1 1342 . 9 2 2 B 24 24 ALA H H 445 8.630 8.681 -0.051 1
1 1343 . 9 2 2 B 24 24 ALA HA H 445 3.790 3.988 -0.198 1
1 1347 . 9 2 2 B 24 24 ALA CA C 445 55.810 54.142 1.668 1
1 1348 . 9 2 2 B 24 24 ALA CB C 445 18.060 17.994 0.066 1
1 1349 . 9 2 2 B 24 24 ALA N N 445 120.890 121.344 -0.454 1
1 1350 . 9 2 2 B 25 25 PHE H H 446 8.160 7.320 0.840 1
1 1351 . 9 2 2 B 25 25 PHE HA H 446 4.080 4.321 -0.241 1
1 1358 . 9 2 2 B 25 25 PHE CA C 446 62.670 61.799 0.871 1
1 1359 . 9 2 2 B 25 25 PHE CB C 446 39.440 38.608 0.832 1
1 1364 . 9 2 2 B 25 25 PHE N N 446 115.360 115.946 -0.586 1
1 1365 . 9 2 2 B 26 26 LYS H H 447 8.040 8.109 -0.069 1
1 1366 . 9 2 2 B 26 26 LYS HA H 447 4.110 4.045 0.065 1
1 1375 . 9 2 2 B 26 26 LYS CA C 447 60.140 60.052 0.088 1
1 1376 . 9 2 2 B 26 26 LYS CB C 447 32.880 31.922 0.958 1
1 1380 . 9 2 2 B 26 26 LYS N N 447 123.110 120.254 2.856 1
1 1381 . 9 2 2 B 27 27 LEU H H 448 8.630 8.036 0.594 1
1 1382 . 9 2 2 B 27 27 LEU HA H 448 3.840 4.111 -0.271 1
1 1392 . 9 2 2 B 27 27 LEU CA C 448 58.210 57.445 0.765 1
1 1393 . 9 2 2 B 27 27 LEU CB C 448 39.760 41.418 -1.658 1
1 1396 . 9 2 2 B 27 27 LEU N N 448 120.890 120.886 0.004 1
1 1397 . 9 2 2 B 28 28 ALA H H 449 8.200 8.646 -0.446 1
1 1398 . 9 2 2 B 28 28 ALA HA H 449 3.760 4.526 -0.766 1
1 1402 . 9 2 2 B 28 28 ALA CA C 449 54.750 55.171 -0.421 1
1 1403 . 9 2 2 B 28 28 ALA CB C 449 18.050 18.352 -0.302 1
1 1404 . 9 2 2 B 28 28 ALA N N 449 123.710 120.741 2.969 1
1 1405 . 9 2 2 B 29 29 ALA H H 450 7.780 7.926 -0.146 1
1 1406 . 9 2 2 B 29 29 ALA HA H 450 4.170 4.066 0.104 1
1 1410 . 9 2 2 B 29 29 ALA CA C 450 54.430 54.783 -0.353 1
1 1411 . 9 2 2 B 29 29 ALA CB C 450 18.040 18.619 -0.579 1
1 1412 . 9 2 2 B 29 29 ALA N N 450 121.020 119.649 1.371 1
1 1413 . 9 2 2 B 30 30 ARG H H 451 7.390 7.627 -0.237 1
1 1414 . 9 2 2 B 30 30 ARG HA H 451 4.540 4.406 0.134 1
1 1421 . 9 2 2 B 30 30 ARG CA C 451 54.510 55.704 -1.194 1
1 1422 . 9 2 2 B 30 30 ARG CB C 451 29.950 29.729 0.221 1
1 1425 . 9 2 2 B 30 30 ARG N N 451 115.480 116.468 -0.988 1
1 1426 . 9 2 2 B 31 31 GLY H H 452 7.950 8.341 -0.391 1
1 1427 . 9 2 2 B 31 31 GLY HA2 H 452 3.550 3.987 -0.437 1
1 1428 . 9 2 2 B 31 31 GLY HA3 H 452 4.200 3.989 0.211 1
1 1429 . 9 2 2 B 31 31 GLY CA C 452 45.380 45.408 -0.028 1
1 1430 . 9 2 2 B 31 31 GLY N N 452 107.740 107.435 0.305 1
1 1431 . 9 2 2 B 32 32 VAL H H 453 7.990 7.602 0.388 1
1 1432 . 9 2 2 B 32 32 VAL HA H 453 3.930 3.945 -0.015 1
1 1440 . 9 2 2 B 32 32 VAL CA C 453 61.420 62.752 -1.332 1
1 1441 . 9 2 2 B 32 32 VAL CB C 453 29.860 31.530 -1.670 1
1 1444 . 9 2 2 B 32 32 VAL N N 453 125.560 120.661 4.899 1
1 1445 . 9 2 2 B 33 33 CYS H H 454 8.460 8.347 0.113 1
1 1446 . 9 2 2 B 33 33 CYS HA H 454 4.310 4.776 -0.466 1
1 1449 . 9 2 2 B 33 33 CYS CA C 454 60.260 59.832 0.428 1
1 1450 . 9 2 2 B 33 33 CYS CB C 454 30.330 30.503 -0.173 1
1 1451 . 9 2 2 B 33 33 CYS N N 454 119.460 125.230 -5.770 1
1 1452 . 9 2 2 B 34 34 THR H H 455 8.080 7.760 0.320 1
1 1453 . 9 2 2 B 34 34 THR HA H 455 4.840 4.541 0.299 1
1 1458 . 9 2 2 B 34 34 THR CA C 455 58.650 61.281 -2.631 1
1 1459 . 9 2 2 B 34 34 THR CB C 455 72.680 70.820 1.860 1
1 1461 . 9 2 2 B 34 34 THR N N 455 108.420 114.143 -5.723 1
1 1462 . 9 2 2 B 35 35 LEU H H 456 8.580 8.778 -0.198 1
1 1463 . 9 2 2 B 35 35 LEU HA H 456 3.790 4.003 -0.213 1
1 1473 . 9 2 2 B 35 35 LEU CA C 456 57.980 58.718 -0.738 1
1 1474 . 9 2 2 B 35 35 LEU CB C 456 42.220 41.538 0.682 1
1 1477 . 9 2 2 B 35 35 LEU N N 456 120.370 127.590 -7.220 1
1 1478 . 9 2 2 B 36 36 GLU H H 457 8.390 8.315 0.075 1
1 1479 . 9 2 2 B 36 36 GLU HA H 457 3.820 3.829 -0.009 1
1 1484 . 9 2 2 B 36 36 GLU CA C 457 59.640 60.082 -0.442 1
1 1485 . 9 2 2 B 36 36 GLU CB C 457 28.780 29.222 -0.442 1
1 1487 . 9 2 2 B 36 36 GLU N N 457 119.450 118.808 0.642 1
1 1488 . 9 2 2 B 37 37 ASP H H 458 7.750 7.919 -0.169 1
1 1489 . 9 2 2 B 37 37 ASP HA H 458 4.140 4.389 -0.249 1
1 1492 . 9 2 2 B 37 37 ASP CA C 458 57.150 57.358 -0.208 1
1 1493 . 9 2 2 B 37 37 ASP CB C 458 42.280 40.447 1.833 1
1 1494 . 9 2 2 B 37 37 ASP N N 458 117.430 120.577 -3.147 1
1 1495 . 9 2 2 B 38 38 LEU H H 459 7.700 7.862 -0.162 1
1 1496 . 9 2 2 B 38 38 LEU HA H 459 3.790 4.180 -0.390 1
1 1506 . 9 2 2 B 38 38 LEU CA C 459 58.080 57.975 0.105 1
1 1507 . 9 2 2 B 38 38 LEU CB C 459 41.130 41.395 -0.265 1
1 1511 . 9 2 2 B 38 38 LEU N N 459 121.280 121.815 -0.535 1
1 1512 . 9 2 2 B 39 39 ALA H H 460 8.190 8.303 -0.113 1
1 1513 . 9 2 2 B 39 39 ALA HA H 460 3.640 3.985 -0.345 1
1 1517 . 9 2 2 B 39 39 ALA CA C 460 54.320 55.263 -0.943 1
1 1518 . 9 2 2 B 39 39 ALA CB C 460 17.140 18.159 -1.019 1
1 1519 . 9 2 2 B 39 39 ALA N N 460 119.400 120.734 -1.334 1
1 1520 . 9 2 2 B 40 40 GLU H H 461 7.340 7.830 -0.490 1
1 1521 . 9 2 2 B 40 40 GLU HA H 461 4.180 4.168 0.012 1
1 1526 . 9 2 2 B 40 40 GLU CA C 461 57.800 59.143 -1.343 1
1 1527 . 9 2 2 B 40 40 GLU CB C 461 30.600 29.486 1.114 1
1 1529 . 9 2 2 B 40 40 GLU N N 461 110.680 115.843 -5.163 1
1 1530 . 9 2 2 B 41 41 GLN H H 462 7.940 7.709 0.231 1
1 1531 . 9 2 2 B 41 41 GLN HA H 462 4.100 4.427 -0.327 1
1 1538 . 9 2 2 B 41 41 GLN CA C 462 55.310 56.573 -1.263 1
1 1539 . 9 2 2 B 41 41 GLN CB C 462 28.780 29.583 -0.803 1
1 1541 . 9 2 2 B 41 41 GLN N N 462 120.720 117.978 2.742 1
1 1543 . 9 2 2 B 42 42 GLY H H 463 9.000 8.669 0.331 1
1 1544 . 9 2 2 B 42 42 GLY HA2 H 463 3.310 4.360 -1.050 1
1 1545 . 9 2 2 B 42 42 GLY HA3 H 463 4.820 4.363 0.457 1
1 1546 . 9 2 2 B 42 42 GLY CA C 463 42.650 43.502 -0.852 1
1 1547 . 9 2 2 B 42 42 GLY N N 463 104.110 107.641 -3.531 1
1 1548 . 9 2 2 B 43 43 ILE H H 464 7.900 8.695 -0.795 1
1 1549 . 9 2 2 B 43 43 ILE HA H 464 3.260 3.727 -0.467 1
1 1558 . 9 2 2 B 43 43 ILE CA C 464 66.570 64.521 2.049 1
1 1559 . 9 2 2 B 43 43 ILE CB C 464 38.770 37.560 1.210 1
1 1562 . 9 2 2 B 43 43 ILE N N 464 119.410 121.461 -2.051 1
1 1563 . 9 2 2 B 44 44 ASP H H 465 8.730 8.319 0.411 1
1 1564 . 9 2 2 B 44 44 ASP HA H 465 4.310 4.374 -0.064 1
1 1567 . 9 2 2 B 44 44 ASP CA C 465 56.740 57.621 -0.881 1
1 1568 . 9 2 2 B 44 44 ASP CB C 465 40.120 40.144 -0.024 1
1 1569 . 9 2 2 B 44 44 ASP N N 465 116.610 120.466 -3.856 1
1 1570 . 9 2 2 B 45 45 ASP H H 466 7.720 8.026 -0.306 1
1 1571 . 9 2 2 B 45 45 ASP HA H 466 4.480 4.441 0.039 1
1 1574 . 9 2 2 B 45 45 ASP CA C 466 57.000 57.251 -0.251 1
1 1575 . 9 2 2 B 45 45 ASP CB C 466 42.270 40.200 2.070 1
1 1576 . 9 2 2 B 45 45 ASP N N 466 117.560 119.643 -2.083 1
1 1577 . 9 2 2 B 46 46 LEU H H 467 7.370 7.972 -0.602 1
1 1578 . 9 2 2 B 46 46 LEU HA H 467 4.410 4.139 0.271 1
1 1587 . 9 2 2 B 46 46 LEU CA C 467 53.660 57.370 -3.710 1
1 1588 . 9 2 2 B 46 46 LEU CB C 467 42.260 41.654 0.606 1
1 1591 . 9 2 2 B 46 46 LEU N N 467 116.890 120.535 -3.645 1
1 1592 . 9 2 2 B 47 47 ALA H H 468 7.080 8.424 -1.344 1
1 1593 . 9 2 2 B 47 47 ALA HA H 468 4.120 4.023 0.097 1
1 1597 . 9 2 2 B 47 47 ALA CA C 468 54.130 55.045 -0.915 1
1 1598 . 9 2 2 B 47 47 ALA CB C 468 19.480 18.271 1.209 1
1 1599 . 9 2 2 B 47 47 ALA N N 468 120.150 122.795 -2.645 1
1 1600 . 9 2 2 B 48 48 ASP H H 469 8.560 8.172 0.388 1
1 1601 . 9 2 2 B 48 48 ASP HA H 469 4.410 4.428 -0.018 1
1 1604 . 9 2 2 B 48 48 ASP CA C 469 54.330 57.562 -3.232 1
1 1605 . 9 2 2 B 48 48 ASP CB C 469 39.760 40.718 -0.958 1
1 1606 . 9 2 2 B 48 48 ASP N N 469 114.660 116.813 -2.153 1
1 1607 . 9 2 2 B 49 49 ILE H H 470 7.870 7.903 -0.033 1
1 1608 . 9 2 2 B 49 49 ILE HA H 470 3.850 4.337 -0.487 1
1 1618 . 9 2 2 B 49 49 ILE CA C 470 61.680 60.674 1.006 1
1 1619 . 9 2 2 B 49 49 ILE CB C 470 37.120 38.470 -1.350 1
1 1623 . 9 2 2 B 49 49 ILE N N 470 121.600 119.943 1.657 1
1 1624 . 9 2 2 B 50 50 GLU H H 471 8.680 9.016 -0.336 1
1 1625 . 9 2 2 B 50 50 GLU HA H 471 3.940 3.996 -0.056 1
1 1630 . 9 2 2 B 50 50 GLU CA C 471 58.360 59.852 -1.492 1
1 1631 . 9 2 2 B 50 50 GLU CB C 471 29.530 29.506 0.024 1
1 1633 . 9 2 2 B 50 50 GLU N N 471 131.000 128.643 2.357 1
1 1634 . 9 2 2 B 51 51 GLY H H 472 8.860 8.189 0.671 1
1 1635 . 9 2 2 B 51 51 GLY HA2 H 472 3.640 4.011 -0.371 1
1 1636 . 9 2 2 B 51 51 GLY HA3 H 472 4.230 4.013 0.217 1
1 1637 . 9 2 2 B 51 51 GLY CA C 472 45.190 46.640 -1.450 1
1 1638 . 9 2 2 B 51 51 GLY N N 472 113.580 106.813 6.767 1
1 1639 . 9 2 2 B 52 52 LEU H H 473 7.850 7.777 0.073 1
1 1640 . 9 2 2 B 52 52 LEU HA H 473 4.680 4.894 -0.214 1
1 1650 . 9 2 2 B 52 52 LEU CA C 473 53.640 53.727 -0.087 1
1 1651 . 9 2 2 B 52 52 LEU CB C 473 42.990 43.523 -0.533 1
1 1655 . 9 2 2 B 52 52 LEU N N 473 123.020 120.255 2.765 1
1 1656 . 9 2 2 B 53 53 THR H H 474 7.550 8.711 -1.161 1
1 1657 . 9 2 2 B 53 53 THR HA H 474 4.560 4.798 -0.238 1
1 1662 . 9 2 2 B 53 53 THR CA C 474 60.060 61.011 -0.951 1
1 1663 . 9 2 2 B 53 53 THR CB C 474 71.520 71.493 0.027 1
1 1665 . 9 2 2 B 53 53 THR N N 474 115.070 117.682 -2.612 1
1 1666 . 9 2 2 B 54 54 ASP H H 475 8.900 9.024 -0.124 1
1 1667 . 9 2 2 B 54 54 ASP HA H 475 4.220 4.281 -0.061 1
1 1670 . 9 2 2 B 54 54 ASP CA C 475 57.520 58.031 -0.511 1
1 1671 . 9 2 2 B 54 54 ASP CB C 475 39.560 40.284 -0.724 1
1 1672 . 9 2 2 B 54 54 ASP N N 475 121.800 123.724 -1.924 1
1 1673 . 9 2 2 B 55 55 GLU H H 476 8.460 7.944 0.516 1
1 1674 . 9 2 2 B 55 55 GLU HA H 476 3.970 4.029 -0.059 1
1 1679 . 9 2 2 B 55 55 GLU CA C 476 59.440 59.048 0.392 1
1 1680 . 9 2 2 B 55 55 GLU CB C 476 29.650 29.486 0.164 1
1 1682 . 9 2 2 B 55 55 GLU N N 476 119.460 119.419 0.041 1
1 1683 . 9 2 2 B 56 56 LYS H H 477 7.790 7.997 -0.207 1
1 1684 . 9 2 2 B 56 56 LYS HA H 477 4.120 4.084 0.036 1
1 1693 . 9 2 2 B 56 56 LYS CA C 477 58.890 58.883 0.007 1
1 1694 . 9 2 2 B 56 56 LYS CB C 477 32.600 32.247 0.353 1
1 1698 . 9 2 2 B 56 56 LYS N N 477 121.840 119.762 2.078 1
1 1699 . 9 2 2 B 57 57 ALA H H 478 8.900 9.177 -0.277 1
1 1700 . 9 2 2 B 57 57 ALA HA H 478 3.790 4.060 -0.270 1
1 1704 . 9 2 2 B 57 57 ALA CA C 478 55.810 55.297 0.513 1
1 1705 . 9 2 2 B 57 57 ALA CB C 478 18.590 18.394 0.196 1
1 1706 . 9 2 2 B 57 57 ALA N N 478 121.350 121.875 -0.525 1
1 1707 . 9 2 2 B 58 58 GLY H H 479 8.300 8.108 0.192 1
1 1708 . 9 2 2 B 58 58 GLY HA2 H 479 3.500 3.767 -0.267 1
1 1709 . 9 2 2 B 58 58 GLY HA3 H 479 3.890 3.771 0.119 1
1 1710 . 9 2 2 B 58 58 GLY CA C 479 47.360 47.297 0.063 1
1 1711 . 9 2 2 B 58 58 GLY N N 479 102.040 106.644 -4.604 1
1 1712 . 9 2 2 B 59 59 ALA H H 480 7.580 7.899 -0.319 1
1 1713 . 9 2 2 B 59 59 ALA HA H 480 4.110 4.033 0.077 1
1 1717 . 9 2 2 B 59 59 ALA CA C 480 55.580 54.582 0.998 1
1 1718 . 9 2 2 B 59 59 ALA CB C 480 18.130 18.698 -0.568 1
1 1719 . 9 2 2 B 59 59 ALA N N 480 123.180 125.158 -1.978 1
1 1720 . 9 2 2 B 60 60 LEU H H 481 8.290 7.912 0.378 1
1 1721 . 9 2 2 B 60 60 LEU HA H 481 4.020 3.995 0.025 1
1 1731 . 9 2 2 B 60 60 LEU CA C 481 57.850 57.715 0.135 1
1 1732 . 9 2 2 B 60 60 LEU CB C 481 42.360 41.576 0.784 1
1 1736 . 9 2 2 B 60 60 LEU N N 481 120.560 118.355 2.205 1
1 1737 . 9 2 2 B 61 61 ILE H H 482 8.080 7.977 0.103 1
1 1738 . 9 2 2 B 61 61 ILE HA H 482 3.210 3.508 -0.298 1
1 1748 . 9 2 2 B 61 61 ILE CA C 482 66.250 65.225 1.025 1
1 1749 . 9 2 2 B 61 61 ILE CB C 482 39.400 38.079 1.321 1
1 1753 . 9 2 2 B 61 61 ILE N N 482 119.170 120.157 -0.987 1
1 1754 . 9 2 2 B 62 62 MET H H 483 8.110 8.286 -0.176 1
1 1755 . 9 2 2 B 62 62 MET HA H 483 4.410 4.138 0.272 1
1 1763 . 9 2 2 B 62 62 MET CA C 483 56.110 58.812 -2.702 1
1 1764 . 9 2 2 B 62 62 MET CB C 483 28.260 32.672 -4.412 1
1 1767 . 9 2 2 B 62 62 MET N N 483 114.420 118.232 -3.812 1
1 1768 . 9 2 2 B 63 63 ALA H H 484 8.240 7.889 0.351 1
1 1769 . 9 2 2 B 63 63 ALA HA H 484 4.130 4.117 0.013 1
1 1773 . 9 2 2 B 63 63 ALA CA C 484 55.300 55.069 0.231 1
1 1774 . 9 2 2 B 63 63 ALA CB C 484 18.280 18.379 -0.099 1
1 1775 . 9 2 2 B 63 63 ALA N N 484 123.710 121.439 2.271 1
1 1776 . 9 2 2 B 64 64 ALA H H 485 8.050 8.303 -0.253 1
1 1777 . 9 2 2 B 64 64 ALA HA H 485 3.870 4.069 -0.199 1
1 1781 . 9 2 2 B 64 64 ALA CA C 485 55.330 55.256 0.074 1
1 1782 . 9 2 2 B 64 64 ALA CB C 485 17.660 18.185 -0.525 1
1 1783 . 9 2 2 B 64 64 ALA N N 485 120.070 119.977 0.093 1
1 1784 . 9 2 2 B 65 65 ARG H H 486 8.640 8.710 -0.070 1
1 1785 . 9 2 2 B 65 65 ARG HA H 486 2.800 4.259 -1.459 1
1 1792 . 9 2 2 B 65 65 ARG CA C 486 60.600 59.469 1.131 1
1 1793 . 9 2 2 B 65 65 ARG CB C 486 29.910 30.036 -0.126 1
1 1796 . 9 2 2 B 65 65 ARG N N 486 118.730 118.758 -0.028 1
1 1797 . 9 2 2 B 66 66 ASN H H 487 8.710 8.584 0.126 1
1 1798 . 9 2 2 B 66 66 ASN HA H 487 4.550 4.956 -0.406 1
1 1803 . 9 2 2 B 66 66 ASN CA C 487 56.390 56.469 -0.079 1
1 1804 . 9 2 2 B 66 66 ASN CB C 487 37.970 38.639 -0.669 1
1 1805 . 9 2 2 B 66 66 ASN N N 487 119.170 118.103 1.067 1
1 1807 . 9 2 2 B 67 67 ILE H H 488 7.250 7.839 -0.589 1
1 1808 . 9 2 2 B 67 67 ILE HA H 488 3.810 3.812 -0.002 1
1 1818 . 9 2 2 B 67 67 ILE CA C 488 64.350 64.870 -0.520 1
1 1819 . 9 2 2 B 67 67 ILE CB C 488 39.570 37.732 1.838 1
1 1823 . 9 2 2 B 67 67 ILE N N 488 117.890 119.998 -2.108 1
1 1824 . 9 2 2 B 68 68 CYS H H 489 8.350 8.257 0.093 1
1 1825 . 9 2 2 B 68 68 CYS HA H 489 4.080 4.050 0.030 1
1 1828 . 9 2 2 B 68 68 CYS CA C 489 62.670 62.666 0.004 1
1 1829 . 9 2 2 B 68 68 CYS CB C 489 28.170 26.776 1.394 1
1 1830 . 9 2 2 B 68 68 CYS N N 489 115.230 120.499 -5.269 1
1 1831 . 9 2 2 B 69 69 TRP H H 490 8.230 8.539 -0.309 1
1 1832 . 9 2 2 B 69 69 TRP HA H 490 5.100 4.255 0.845 1
1 1841 . 9 2 2 B 69 69 TRP CA C 490 55.420 60.330 -4.910 1
1 1842 . 9 2 2 B 69 69 TRP CB C 490 31.010 29.409 1.601 1
1 1844 . 9 2 2 B 69 69 TRP N N 490 116.850 120.949 -4.099 1
1 1846 . 9 2 2 B 70 70 PHE H H 491 7.570 8.662 -1.092 1
1 1847 . 9 2 2 B 70 70 PHE HA H 491 5.240 4.743 0.497 1
1 1852 . 9 2 2 B 70 70 PHE CA C 491 55.490 58.151 -2.661 1
1 1853 . 9 2 2 B 70 70 PHE CB C 491 38.700 38.897 -0.197 1
1 1856 . 9 2 2 B 70 70 PHE N N 491 117.460 116.455 1.005 1
1 1857 . 9 2 2 B 71 71 GLY H H 492 8.420 8.458 -0.038 1
1 1858 . 9 2 2 B 71 71 GLY HA2 H 492 3.920 3.772 0.148 1
1 1859 . 9 2 2 B 71 71 GLY HA3 H 492 4.080 3.813 0.267 1
1 1860 . 9 2 2 B 71 71 GLY CA C 492 46.210 47.097 -0.887 1
1 1861 . 9 2 2 B 71 71 GLY N N 492 110.040 109.025 1.015 1
1 1862 . 9 2 2 B 72 72 ASP H H 493 8.370 7.963 0.407 1
1 1863 . 9 2 2 B 72 72 ASP HA H 493 4.630 4.325 0.305 1
1 1866 . 9 2 2 B 72 72 ASP CA C 493 54.410 56.985 -2.575 1
1 1867 . 9 2 2 B 72 72 ASP CB C 493 41.250 40.346 0.904 1
1 1868 . 9 2 2 B 72 72 ASP N N 493 120.000 121.769 -1.769 1
1 1869 . 9 2 2 B 73 73 GLU H H 494 8.230 7.803 0.427 1
1 1870 . 9 2 2 B 73 73 GLU HA H 494 4.260 4.081 0.179 1
1 1875 . 9 2 2 B 73 73 GLU CA C 494 56.510 59.076 -2.566 1
1 1876 . 9 2 2 B 73 73 GLU CB C 494 30.420 29.981 0.439 1
1 1878 . 9 2 2 B 73 73 GLU N N 494 120.900 119.289 1.611 1
1 216 . 10 1 1 A 20 20 ASP H H 250 8.550 8.931 -0.381 1
1 217 . 10 1 1 A 20 20 ASP HA H 250 4.700 4.547 0.153 1
1 220 . 10 1 1 A 20 20 ASP CA C 250 52.650 52.635 0.015 1
1 221 . 10 1 1 A 20 20 ASP CB C 250 41.420 40.335 1.085 1
1 222 . 10 1 1 A 20 20 ASP N N 250 125.190 122.938 2.252 1
1 223 . 10 1 1 A 21 21 PRO HA H 251 4.250 4.537 -0.287 1
1 230 . 10 1 1 A 21 21 PRO CA C 251 65.120 64.614 0.506 1
1 231 . 10 1 1 A 21 21 PRO CB C 251 32.310 32.129 0.181 1
1 234 . 10 1 1 A 22 22 ILE H H 252 8.630 7.683 0.947 1
1 235 . 10 1 1 A 22 22 ILE HA H 252 4.060 3.962 0.098 1
1 245 . 10 1 1 A 22 22 ILE CA C 252 62.990 63.169 -0.179 1
1 246 . 10 1 1 A 22 22 ILE CB C 252 37.520 37.651 -0.131 1
1 250 . 10 1 1 A 22 22 ILE N N 252 119.860 117.040 2.820 1
1 251 . 10 1 1 A 23 23 LEU H H 253 7.950 7.657 0.293 1
1 252 . 10 1 1 A 23 23 LEU HA H 253 3.710 4.158 -0.448 1
1 262 . 10 1 1 A 23 23 LEU CA C 253 56.510 57.956 -1.446 1
1 263 . 10 1 1 A 23 23 LEU CB C 253 41.190 41.945 -0.755 1
1 266 . 10 1 1 A 23 23 LEU N N 253 116.850 122.344 -5.494 1
1 267 . 10 1 1 A 24 24 LEU H H 254 7.370 7.464 -0.094 1
1 268 . 10 1 1 A 24 24 LEU HA H 254 4.310 4.774 -0.464 1
1 278 . 10 1 1 A 24 24 LEU CA C 254 54.890 56.356 -1.466 1
1 279 . 10 1 1 A 24 24 LEU CB C 254 41.960 43.091 -1.131 1
1 283 . 10 1 1 A 24 24 LEU N N 254 115.210 117.698 -2.488 1
1 284 . 10 1 1 A 25 25 ARG H H 255 7.520 7.712 -0.192 1
1 285 . 10 1 1 A 25 25 ARG HA H 255 4.660 4.300 0.360 1
1 293 . 10 1 1 A 25 25 ARG CA C 255 52.840 54.394 -1.554 1
1 294 . 10 1 1 A 25 25 ARG CB C 255 28.130 30.439 -2.309 1
1 297 . 10 1 1 A 25 25 ARG N N 255 118.180 121.277 -3.097 1
1 298 . 10 1 1 A 26 26 PRO HA H 256 4.800 4.698 0.102 1
1 305 . 10 1 1 A 26 26 PRO CA C 256 61.790 62.626 -0.836 1
1 306 . 10 1 1 A 26 26 PRO CB C 256 32.660 32.593 0.067 1
1 309 . 10 1 1 A 27 27 VAL H H 257 8.170 8.415 -0.245 1
1 310 . 10 1 1 A 27 27 VAL HA H 257 3.590 3.704 -0.114 1
1 318 . 10 1 1 A 27 27 VAL CA C 257 64.830 65.676 -0.846 1
1 319 . 10 1 1 A 27 27 VAL CB C 257 31.720 31.584 0.136 1
1 322 . 10 1 1 A 27 27 VAL N N 257 115.710 123.124 -7.414 1
1 323 . 10 1 1 A 28 28 ASP H H 258 8.240 8.789 -0.549 1
1 324 . 10 1 1 A 28 28 ASP HA H 258 4.340 4.281 0.059 1
1 327 . 10 1 1 A 28 28 ASP CA C 258 56.490 56.958 -0.468 1
1 328 . 10 1 1 A 28 28 ASP CB C 258 40.520 39.780 0.740 1
1 329 . 10 1 1 A 28 28 ASP N N 258 119.000 121.332 -2.332 1
1 330 . 10 1 1 A 29 29 ASP H H 259 8.000 7.891 0.109 1
1 331 . 10 1 1 A 29 29 ASP HA H 259 4.390 4.613 -0.223 1
1 334 . 10 1 1 A 29 29 ASP CA C 259 56.210 55.672 0.538 1
1 335 . 10 1 1 A 29 29 ASP CB C 259 40.670 41.074 -0.404 1
1 336 . 10 1 1 A 29 29 ASP N N 259 118.900 117.157 1.743 1
1 337 . 10 1 1 A 30 30 LEU H H 260 7.760 7.701 0.059 1
1 338 . 10 1 1 A 30 30 LEU HA H 260 3.990 4.229 -0.239 1
1 348 . 10 1 1 A 30 30 LEU CA C 260 55.000 55.302 -0.302 1
1 349 . 10 1 1 A 30 30 LEU CB C 260 41.670 42.214 -0.544 1
1 353 . 10 1 1 A 30 30 LEU N N 260 116.300 121.316 -5.016 1
1 354 . 10 1 1 A 31 31 GLU H H 261 7.990 8.854 -0.864 1
1 355 . 10 1 1 A 31 31 GLU HA H 261 4.280 4.104 0.176 1
1 358 . 10 1 1 A 31 31 GLU CA C 261 56.860 58.460 -1.600 1
1 359 . 10 1 1 A 31 31 GLU CB C 261 27.010 29.070 -2.060 1
1 360 . 10 1 1 A 31 31 GLU N N 261 115.620 121.628 -6.008 1
1 361 . 10 1 1 A 32 32 LEU H H 262 8.000 7.361 0.639 1
1 362 . 10 1 1 A 32 32 LEU HA H 262 4.400 4.346 0.054 1
1 372 . 10 1 1 A 32 32 LEU CA C 262 53.860 54.862 -1.002 1
1 373 . 10 1 1 A 32 32 LEU CB C 262 44.450 42.512 1.938 1
1 377 . 10 1 1 A 32 32 LEU N N 262 118.860 123.219 -4.359 1
1 378 . 10 1 1 A 33 33 THR H H 263 10.020 8.346 1.674 1
1 379 . 10 1 1 A 33 33 THR HA H 263 4.130 4.717 -0.587 1
1 384 . 10 1 1 A 33 33 THR CA C 263 62.400 60.536 1.864 1
1 385 . 10 1 1 A 33 33 THR CB C 263 71.270 71.354 -0.084 1
1 387 . 10 1 1 A 33 33 THR N N 263 114.610 112.955 1.655 1
1 388 . 10 1 1 A 34 34 VAL H H 264 8.370 8.835 -0.465 1
1 389 . 10 1 1 A 34 34 VAL HA H 264 3.620 3.623 -0.003 1
1 397 . 10 1 1 A 34 34 VAL CA C 264 66.340 66.572 -0.232 1
1 398 . 10 1 1 A 34 34 VAL CB C 264 31.670 31.390 0.280 1
1 401 . 10 1 1 A 34 34 VAL N N 264 122.110 122.224 -0.114 1
1 402 . 10 1 1 A 35 35 ARG H H 265 8.190 8.152 0.038 1
1 403 . 10 1 1 A 35 35 ARG HA H 265 4.070 3.920 0.150 1
1 411 . 10 1 1 A 35 35 ARG CA C 265 59.470 59.816 -0.346 1
1 412 . 10 1 1 A 35 35 ARG CB C 265 29.790 29.866 -0.076 1
1 415 . 10 1 1 A 35 35 ARG N N 265 117.340 121.160 -3.820 1
1 416 . 10 1 1 A 36 36 SER H H 266 7.610 8.142 -0.532 1
1 417 . 10 1 1 A 36 36 SER HA H 266 4.080 4.196 -0.116 1
1 420 . 10 1 1 A 36 36 SER CA C 266 63.080 61.398 1.682 1
1 421 . 10 1 1 A 36 36 SER CB C 266 63.280 62.380 0.900 1
1 422 . 10 1 1 A 36 36 SER N N 266 116.710 115.288 1.422 1
1 423 . 10 1 1 A 37 37 ALA H H 267 8.720 7.810 0.910 1
1 424 . 10 1 1 A 37 37 ALA HA H 267 3.760 3.984 -0.224 1
1 428 . 10 1 1 A 37 37 ALA CA C 267 55.900 55.333 0.567 1
1 429 . 10 1 1 A 37 37 ALA CB C 267 18.090 17.791 0.299 1
1 430 . 10 1 1 A 37 37 ALA N N 267 124.170 123.516 0.654 1
1 431 . 10 1 1 A 38 38 ASN H H 268 8.850 9.407 -0.557 1
1 432 . 10 1 1 A 38 38 ASN HA H 268 4.420 4.515 -0.095 1
1 437 . 10 1 1 A 38 38 ASN CA C 268 55.700 56.094 -0.394 1
1 438 . 10 1 1 A 38 38 ASN CB C 268 37.180 37.559 -0.379 1
1 439 . 10 1 1 A 38 38 ASN N N 268 117.370 117.563 -0.193 1
1 441 . 10 1 1 A 39 39 CYS H H 269 7.970 7.825 0.145 1
1 442 . 10 1 1 A 39 39 CYS HA H 269 4.190 4.108 0.082 1
1 445 . 10 1 1 A 39 39 CYS CA C 269 63.340 62.791 0.549 1
1 446 . 10 1 1 A 39 39 CYS CB C 269 26.870 27.747 -0.877 1
1 447 . 10 1 1 A 39 39 CYS N N 269 120.510 118.901 1.609 1
1 448 . 10 1 1 A 40 40 LEU H H 270 7.600 7.703 -0.103 1
1 449 . 10 1 1 A 40 40 LEU HA H 270 3.880 3.904 -0.024 1
1 458 . 10 1 1 A 40 40 LEU CA C 270 57.810 58.005 -0.195 1
1 459 . 10 1 1 A 40 40 LEU CB C 270 40.030 41.507 -1.477 1
1 462 . 10 1 1 A 40 40 LEU N N 270 117.710 120.406 -2.696 1
1 463 . 10 1 1 A 41 41 LYS H H 271 7.980 8.506 -0.526 1
1 464 . 10 1 1 A 41 41 LYS HA H 271 3.820 4.250 -0.430 1
1 472 . 10 1 1 A 41 41 LYS CA C 271 59.840 59.013 0.827 1
1 473 . 10 1 1 A 41 41 LYS CB C 271 32.070 32.115 -0.045 1
1 476 . 10 1 1 A 41 41 LYS N N 271 120.070 120.161 -0.091 1
1 477 . 10 1 1 A 42 42 ALA H H 272 7.860 8.491 -0.631 1
1 478 . 10 1 1 A 42 42 ALA HA H 272 4.140 4.076 0.064 1
1 482 . 10 1 1 A 42 42 ALA CA C 272 54.670 54.503 0.167 1
1 483 . 10 1 1 A 42 42 ALA CB C 272 17.950 18.446 -0.496 1
1 484 . 10 1 1 A 42 42 ALA N N 272 122.880 121.521 1.359 1
1 485 . 10 1 1 A 43 43 GLU H H 273 7.210 7.874 -0.664 1
1 486 . 10 1 1 A 43 43 GLU HA H 273 4.260 4.424 -0.164 1
1 491 . 10 1 1 A 43 43 GLU CA C 273 55.020 55.954 -0.934 1
1 492 . 10 1 1 A 43 43 GLU CB C 273 29.880 29.390 0.490 1
1 494 . 10 1 1 A 43 43 GLU N N 273 116.590 115.468 1.122 1
1 495 . 10 1 1 A 44 44 ALA H H 274 7.880 8.117 -0.237 1
1 496 . 10 1 1 A 44 44 ALA HA H 274 3.680 3.840 -0.160 1
1 500 . 10 1 1 A 44 44 ALA CA C 274 52.960 53.091 -0.131 1
1 501 . 10 1 1 A 44 44 ALA CB C 274 16.110 17.229 -1.119 1
1 502 . 10 1 1 A 44 44 ALA N N 274 118.420 119.004 -0.584 1
1 503 . 10 1 1 A 45 45 ILE H H 275 7.600 7.386 0.214 1
1 504 . 10 1 1 A 45 45 ILE HA H 275 3.870 4.190 -0.320 1
1 514 . 10 1 1 A 45 45 ILE CA C 275 61.150 60.325 0.825 1
1 515 . 10 1 1 A 45 45 ILE CB C 275 37.090 38.890 -1.800 1
1 519 . 10 1 1 A 45 45 ILE N N 275 120.370 118.135 2.235 1
1 520 . 10 1 1 A 46 46 HIS H H 276 8.350 8.832 -0.482 1
1 521 . 10 1 1 A 46 46 HIS HA H 276 4.600 4.815 -0.215 1
1 526 . 10 1 1 A 46 46 HIS CA C 276 56.900 56.644 0.256 1
1 527 . 10 1 1 A 46 46 HIS CB C 276 31.910 30.775 1.135 1
1 529 . 10 1 1 A 46 46 HIS N N 276 123.250 125.603 -2.353 1
1 530 . 10 1 1 A 47 47 TYR H H 277 8.850 7.970 0.880 1
1 531 . 10 1 1 A 47 47 TYR HA H 277 5.100 4.868 0.232 1
1 538 . 10 1 1 A 47 47 TYR CA C 277 57.430 56.284 1.146 1
1 539 . 10 1 1 A 47 47 TYR CB C 277 40.680 40.784 -0.104 1
1 544 . 10 1 1 A 47 47 TYR N N 277 119.700 118.351 1.349 1
1 545 . 10 1 1 A 48 48 ILE H H 278 9.380 8.455 0.925 1
1 546 . 10 1 1 A 48 48 ILE HA H 278 3.340 3.629 -0.289 1
1 554 . 10 1 1 A 48 48 ILE CA C 278 67.640 65.069 2.571 1
1 555 . 10 1 1 A 48 48 ILE CB C 278 36.310 37.288 -0.978 1
1 558 . 10 1 1 A 48 48 ILE N N 278 125.650 124.848 0.802 1
1 559 . 10 1 1 A 49 49 GLY H H 279 9.430 7.677 1.753 1
1 560 . 10 1 1 A 49 49 GLY HA2 H 279 2.370 1.981 0.389 1
1 561 . 10 1 1 A 49 49 GLY HA3 H 279 3.230 3.348 -0.118 1
1 562 . 10 1 1 A 49 49 GLY CA C 279 46.820 46.617 0.203 1
1 563 . 10 1 1 A 49 49 GLY N N 279 105.200 108.401 -3.201 1
1 564 . 10 1 1 A 50 50 ASP H H 280 7.050 7.224 -0.174 1
1 565 . 10 1 1 A 50 50 ASP HA H 280 4.360 4.115 0.245 1
1 568 . 10 1 1 A 50 50 ASP CA C 280 57.110 56.182 0.928 1
1 569 . 10 1 1 A 50 50 ASP CB C 280 42.620 40.502 2.118 1
1 570 . 10 1 1 A 50 50 ASP N N 280 116.360 120.911 -4.551 1
1 571 . 10 1 1 A 51 51 LEU H H 281 7.170 8.112 -0.942 1
1 572 . 10 1 1 A 51 51 LEU HA H 281 3.880 3.956 -0.076 1
1 582 . 10 1 1 A 51 51 LEU CA C 281 57.900 58.244 -0.344 1
1 583 . 10 1 1 A 51 51 LEU CB C 281 41.870 41.524 0.346 1
1 587 . 10 1 1 A 51 51 LEU N N 281 120.130 121.858 -1.728 1
1 588 . 10 1 1 A 52 52 VAL H H 282 7.820 7.560 0.260 1
1 589 . 10 1 1 A 52 52 VAL HA H 282 3.980 3.874 0.106 1
1 597 . 10 1 1 A 52 52 VAL CA C 282 64.000 65.258 -1.258 1
1 598 . 10 1 1 A 52 52 VAL CB C 282 30.400 31.206 -0.806 1
1 601 . 10 1 1 A 52 52 VAL N N 282 105.550 115.189 -9.639 1
1 602 . 10 1 1 A 53 53 GLN H H 283 6.550 7.606 -1.056 1
1 603 . 10 1 1 A 53 53 GLN HA H 283 4.680 4.049 0.631 1
1 610 . 10 1 1 A 53 53 GLN CA C 283 56.210 58.574 -2.364 1
1 611 . 10 1 1 A 53 53 GLN CB C 283 31.710 28.770 2.940 1
1 613 . 10 1 1 A 53 53 GLN N N 283 114.060 120.892 -6.832 1
1 615 . 10 1 1 A 54 54 ARG H H 284 7.690 7.521 0.169 1
1 616 . 10 1 1 A 54 54 ARG HA H 284 4.520 4.634 -0.114 1
1 624 . 10 1 1 A 54 54 ARG CA C 284 54.600 54.861 -0.261 1
1 625 . 10 1 1 A 54 54 ARG CB C 284 30.750 31.867 -1.117 1
1 628 . 10 1 1 A 54 54 ARG N N 284 119.810 118.704 1.106 1
1 629 . 10 1 1 A 55 55 THR H H 285 8.110 8.747 -0.637 1
1 630 . 10 1 1 A 55 55 THR HA H 285 4.430 4.273 0.157 1
1 635 . 10 1 1 A 55 55 THR CA C 285 59.640 63.697 -4.057 1
1 636 . 10 1 1 A 55 55 THR CB C 285 71.310 69.090 2.220 1
1 638 . 10 1 1 A 55 55 THR N N 285 108.450 119.367 -10.917 1
1 639 . 10 1 1 A 56 56 GLU H H 286 8.910 8.993 -0.083 1
1 640 . 10 1 1 A 56 56 GLU HA H 286 3.660 3.957 -0.297 1
1 645 . 10 1 1 A 56 56 GLU CA C 286 60.650 59.887 0.763 1
1 646 . 10 1 1 A 56 56 GLU CB C 286 29.400 29.205 0.195 1
1 648 . 10 1 1 A 56 56 GLU N N 286 120.600 126.480 -5.880 1
1 649 . 10 1 1 A 57 57 VAL H H 287 7.600 8.076 -0.476 1
1 650 . 10 1 1 A 57 57 VAL HA H 287 3.620 3.500 0.120 1
1 658 . 10 1 1 A 57 57 VAL CA C 287 66.020 67.132 -1.112 1
1 659 . 10 1 1 A 57 57 VAL CB C 287 31.720 31.574 0.146 1
1 662 . 10 1 1 A 57 57 VAL N N 287 114.050 119.756 -5.706 1
1 663 . 10 1 1 A 58 58 GLU H H 288 7.350 8.291 -0.941 1
1 664 . 10 1 1 A 58 58 GLU HA H 288 3.830 4.023 -0.193 1
1 669 . 10 1 1 A 58 58 GLU CA C 288 59.250 59.509 -0.259 1
1 670 . 10 1 1 A 58 58 GLU CB C 288 30.030 29.025 1.005 1
1 672 . 10 1 1 A 58 58 GLU N N 288 117.610 119.206 -1.596 1
1 673 . 10 1 1 A 59 59 LEU H H 289 7.850 8.064 -0.214 1
1 674 . 10 1 1 A 59 59 LEU HA H 289 4.150 4.026 0.124 1
1 683 . 10 1 1 A 59 59 LEU CA C 289 57.340 57.997 -0.657 1
1 684 . 10 1 1 A 59 59 LEU CB C 289 41.170 41.594 -0.424 1
1 687 . 10 1 1 A 59 59 LEU N N 289 120.050 120.662 -0.612 1
1 688 . 10 1 1 A 60 60 LEU H H 290 7.670 8.244 -0.574 1
1 689 . 10 1 1 A 60 60 LEU HA H 290 4.540 3.960 0.580 1
1 696 . 10 1 1 A 60 60 LEU CA C 290 55.090 57.447 -2.357 1
1 697 . 10 1 1 A 60 60 LEU CB C 290 42.320 41.230 1.090 1
1 701 . 10 1 1 A 60 60 LEU N N 290 114.980 119.117 -4.137 1
1 702 . 10 1 1 A 61 61 LYS H H 291 7.440 7.378 0.062 1
1 703 . 10 1 1 A 61 61 LYS HA H 291 4.280 4.306 -0.026 1
1 710 . 10 1 1 A 61 61 LYS CA C 291 56.860 57.202 -0.342 1
1 711 . 10 1 1 A 61 61 LYS CB C 291 31.900 32.800 -0.900 1
1 714 . 10 1 1 A 61 61 LYS N N 291 118.120 116.694 1.426 1
1 715 . 10 1 1 A 62 62 THR H H 292 7.310 7.439 -0.129 1
1 716 . 10 1 1 A 62 62 THR HA H 292 5.220 4.395 0.825 1
1 721 . 10 1 1 A 62 62 THR CA C 292 55.830 59.868 -4.038 1
1 722 . 10 1 1 A 62 62 THR CB C 292 69.970 69.004 0.966 1
1 724 . 10 1 1 A 62 62 THR N N 292 111.890 115.413 -3.523 1
1 725 . 10 1 1 A 63 63 PRO HA H 293 4.570 4.467 0.103 1
1 730 . 10 1 1 A 63 63 PRO CA C 293 63.710 64.328 -0.618 1
1 731 . 10 1 1 A 63 63 PRO CB C 293 32.380 31.828 0.552 1
1 733 . 10 1 1 A 64 64 ASN H H 294 8.050 8.850 -0.800 1
1 734 . 10 1 1 A 64 64 ASN HA H 294 4.490 4.473 0.017 1
1 739 . 10 1 1 A 64 64 ASN CA C 294 55.630 55.199 0.431 1
1 740 . 10 1 1 A 64 64 ASN CB C 294 38.730 38.066 0.664 1
1 741 . 10 1 1 A 64 64 ASN N N 294 117.120 117.043 0.077 1
1 743 . 10 1 1 A 65 65 LEU H H 295 7.550 7.332 0.218 1
1 744 . 10 1 1 A 65 65 LEU HA H 295 4.640 4.458 0.182 1
1 754 . 10 1 1 A 65 65 LEU CA C 295 54.310 53.953 0.357 1
1 755 . 10 1 1 A 65 65 LEU CB C 295 43.640 42.749 0.891 1
1 758 . 10 1 1 A 65 65 LEU N N 295 119.930 118.918 1.012 1
1 759 . 10 1 1 A 66 66 GLY H H 296 7.850 8.502 -0.652 1
1 760 . 10 1 1 A 66 66 GLY HA2 H 296 3.810 4.140 -0.330 1
1 761 . 10 1 1 A 66 66 GLY HA3 H 296 4.110 4.140 -0.030 1
1 762 . 10 1 1 A 66 66 GLY CA C 296 43.570 44.147 -0.577 1
1 763 . 10 1 1 A 66 66 GLY N N 296 108.840 110.064 -1.224 1
1 764 . 10 1 1 A 67 67 LYS H H 297 8.820 8.516 0.304 1
1 765 . 10 1 1 A 67 67 LYS HA H 297 3.980 3.867 0.113 1
1 774 . 10 1 1 A 67 67 LYS CA C 297 60.100 59.615 0.485 1
1 775 . 10 1 1 A 67 67 LYS CB C 297 32.100 32.211 -0.111 1
1 779 . 10 1 1 A 67 67 LYS N N 297 120.130 118.102 2.028 1
1 780 . 10 1 1 A 68 68 LYS H H 298 8.850 7.968 0.882 1
1 781 . 10 1 1 A 68 68 LYS HA H 298 4.060 4.056 0.004 1
1 790 . 10 1 1 A 68 68 LYS CA C 298 60.600 59.165 1.435 1
1 791 . 10 1 1 A 68 68 LYS CB C 298 31.920 32.283 -0.363 1
1 795 . 10 1 1 A 68 68 LYS N N 298 119.580 120.233 -0.653 1
1 796 . 10 1 1 A 69 69 SER H H 299 8.100 8.093 0.007 1
1 797 . 10 1 1 A 69 69 SER HA H 299 4.370 4.119 0.251 1
1 800 . 10 1 1 A 69 69 SER CA C 299 61.980 62.183 -0.203 1
1 801 . 10 1 1 A 69 69 SER CB C 299 63.000 63.296 -0.296 1
1 802 . 10 1 1 A 69 69 SER N N 299 116.360 117.447 -1.087 1
1 803 . 10 1 1 A 70 70 LEU H H 300 8.240 7.964 0.276 1
1 804 . 10 1 1 A 70 70 LEU HA H 300 3.970 4.059 -0.089 1
1 814 . 10 1 1 A 70 70 LEU CA C 300 57.610 57.865 -0.255 1
1 815 . 10 1 1 A 70 70 LEU CB C 300 41.060 41.475 -0.415 1
1 819 . 10 1 1 A 70 70 LEU N N 300 123.330 122.701 0.629 1
1 820 . 10 1 1 A 71 71 THR H H 301 8.550 7.863 0.687 1
1 821 . 10 1 1 A 71 71 THR HA H 301 3.690 3.883 -0.193 1
1 826 . 10 1 1 A 71 71 THR CA C 301 67.170 67.086 0.084 1
1 827 . 10 1 1 A 71 71 THR CB C 301 68.810 68.458 0.352 1
1 829 . 10 1 1 A 71 71 THR N N 301 116.520 114.875 1.645 1
1 830 . 10 1 1 A 72 72 GLU H H 302 7.520 8.048 -0.528 1
1 831 . 10 1 1 A 72 72 GLU HA H 302 4.070 4.021 0.049 1
1 836 . 10 1 1 A 72 72 GLU CA C 302 59.470 59.258 0.212 1
1 837 . 10 1 1 A 72 72 GLU CB C 302 29.090 29.642 -0.552 1
1 839 . 10 1 1 A 72 72 GLU N N 302 121.510 119.682 1.828 1
1 840 . 10 1 1 A 73 73 ILE H H 303 8.290 8.080 0.210 1
1 841 . 10 1 1 A 73 73 ILE HA H 303 3.380 3.577 -0.197 1
1 849 . 10 1 1 A 73 73 ILE CA C 303 66.010 65.470 0.540 1
1 850 . 10 1 1 A 73 73 ILE CB C 303 38.680 37.823 0.857 1
1 853 . 10 1 1 A 73 73 ILE N N 303 118.510 120.961 -2.451 1
1 854 . 10 1 1 A 74 74 LYS H H 304 8.550 8.035 0.515 1
1 855 . 10 1 1 A 74 74 LYS HA H 304 3.680 3.787 -0.107 1
1 864 . 10 1 1 A 74 74 LYS CA C 304 61.320 60.529 0.791 1
1 865 . 10 1 1 A 74 74 LYS CB C 304 32.060 31.923 0.137 1
1 868 . 10 1 1 A 74 74 LYS N N 304 118.220 118.714 -0.494 1
1 869 . 10 1 1 A 75 75 ASP H H 305 8.450 8.047 0.403 1
1 870 . 10 1 1 A 75 75 ASP HA H 305 4.440 4.370 0.070 1
1 873 . 10 1 1 A 75 75 ASP CA C 305 57.690 57.239 0.451 1
1 874 . 10 1 1 A 75 75 ASP CB C 305 40.220 40.900 -0.680 1
1 875 . 10 1 1 A 75 75 ASP N N 305 121.790 119.454 2.336 1
1 876 . 10 1 1 A 76 76 VAL H H 306 8.680 7.976 0.704 1
1 877 . 10 1 1 A 76 76 VAL HA H 306 3.890 3.589 0.301 1
1 885 . 10 1 1 A 76 76 VAL CA C 306 66.020 66.404 -0.384 1
1 886 . 10 1 1 A 76 76 VAL CB C 306 31.250 31.376 -0.126 1
1 889 . 10 1 1 A 76 76 VAL N N 306 121.150 119.619 1.531 1
1 890 . 10 1 1 A 77 77 LEU H H 307 8.470 8.529 -0.059 1
1 891 . 10 1 1 A 77 77 LEU HA H 307 3.810 3.943 -0.133 1
1 901 . 10 1 1 A 77 77 LEU CA C 307 58.330 57.697 0.633 1
1 902 . 10 1 1 A 77 77 LEU CB C 307 41.250 41.617 -0.367 1
1 906 . 10 1 1 A 77 77 LEU N N 307 120.830 119.842 0.988 1
1 907 . 10 1 1 A 78 78 ALA H H 308 8.280 8.278 0.002 1
1 908 . 10 1 1 A 78 78 ALA HA H 308 4.320 4.110 0.210 1
1 912 . 10 1 1 A 78 78 ALA CA C 308 55.420 55.007 0.413 1
1 913 . 10 1 1 A 78 78 ALA CB C 308 17.750 18.088 -0.338 1
1 914 . 10 1 1 A 78 78 ALA N N 308 122.530 121.324 1.206 1
1 915 . 10 1 1 A 79 79 SER H H 309 7.900 7.962 -0.062 1
1 916 . 10 1 1 A 79 79 SER HA H 309 4.340 4.448 -0.108 1
1 919 . 10 1 1 A 79 79 SER CA C 309 61.350 59.553 1.797 1
1 920 . 10 1 1 A 79 79 SER CB C 309 63.280 63.577 -0.297 1
1 921 . 10 1 1 A 79 79 SER N N 309 115.600 112.958 2.642 1
1 922 . 10 1 1 A 80 80 ARG H H 310 7.450 8.063 -0.613 1
1 923 . 10 1 1 A 80 80 ARG HA H 310 4.550 4.009 0.541 1
1 931 . 10 1 1 A 80 80 ARG CA C 310 54.200 57.363 -3.163 1
1 932 . 10 1 1 A 80 80 ARG CB C 310 30.680 27.150 3.530 1
1 935 . 10 1 1 A 80 80 ARG N N 310 119.360 117.833 1.527 1
1 936 . 10 1 1 A 81 81 GLY H H 311 7.940 8.145 -0.205 1
1 937 . 10 1 1 A 81 81 GLY HA2 H 311 3.840 3.954 -0.114 1
1 938 . 10 1 1 A 81 81 GLY HA3 H 311 4.070 3.957 0.113 1
1 939 . 10 1 1 A 81 81 GLY CA C 311 46.060 46.060 0.000 1
1 940 . 10 1 1 A 81 81 GLY N N 311 108.130 106.768 1.362 1
1 941 . 10 1 1 A 82 82 LEU H H 312 7.920 7.499 0.421 1
1 942 . 10 1 1 A 82 82 LEU HA H 312 4.680 4.774 -0.094 1
1 952 . 10 1 1 A 82 82 LEU CA C 312 53.070 52.505 0.565 1
1 953 . 10 1 1 A 82 82 LEU CB C 312 45.790 45.395 0.395 1
1 957 . 10 1 1 A 82 82 LEU N N 312 119.290 115.839 3.451 1
1 958 . 10 1 1 A 83 83 SER H H 313 7.530 8.918 -1.388 1
1 959 . 10 1 1 A 83 83 SER HA H 313 4.450 4.169 0.281 1
1 962 . 10 1 1 A 83 83 SER CA C 313 57.190 58.996 -1.806 1
1 963 . 10 1 1 A 83 83 SER CB C 313 66.080 62.254 3.826 1
1 964 . 10 1 1 A 83 83 SER N N 313 113.120 114.979 -1.859 1
1 965 . 10 1 1 A 84 84 LEU H H 314 8.340 8.331 0.009 1
1 966 . 10 1 1 A 84 84 LEU HA H 314 4.620 4.390 0.230 1
1 976 . 10 1 1 A 84 84 LEU CA C 314 54.720 54.819 -0.099 1
1 977 . 10 1 1 A 84 84 LEU CB C 314 41.620 42.279 -0.659 1
1 981 . 10 1 1 A 84 84 LEU N N 314 115.930 119.831 -3.901 1
1 982 . 10 1 1 A 85 85 GLY H H 315 8.270 7.843 0.427 1
1 983 . 10 1 1 A 85 85 GLY HA2 H 315 3.320 3.957 -0.637 1
1 984 . 10 1 1 A 85 85 GLY HA3 H 315 3.850 3.960 -0.110 1
1 985 . 10 1 1 A 85 85 GLY CA C 315 46.560 46.492 0.068 1
1 986 . 10 1 1 A 85 85 GLY N N 315 111.010 108.028 2.982 1
1 987 . 10 1 1 A 86 86 MET H H 316 8.650 8.070 0.580 1
1 988 . 10 1 1 A 86 86 MET HA H 316 3.990 4.793 -0.803 1
1 996 . 10 1 1 A 86 86 MET CA C 316 56.730 55.340 1.390 1
1 997 . 10 1 1 A 86 86 MET CB C 316 33.600 35.040 -1.440 1
1 1000 . 10 1 1 A 86 86 MET N N 316 120.570 118.985 1.585 1
1 1001 . 10 1 1 A 87 87 ARG H H 317 8.360 8.413 -0.053 1
1 1002 . 10 1 1 A 87 87 ARG HA H 317 4.450 5.206 -0.756 1
1 1010 . 10 1 1 A 87 87 ARG CA C 317 55.310 54.419 0.891 1
1 1011 . 10 1 1 A 87 87 ARG CB C 317 30.490 33.521 -3.031 1
1 1014 . 10 1 1 A 87 87 ARG N N 317 122.290 119.420 2.870 1
1 1015 . 10 1 1 A 88 88 LEU H H 318 8.400 8.686 -0.286 1
1 1016 . 10 1 1 A 88 88 LEU HA H 318 4.670 4.965 -0.295 1
1 1026 . 10 1 1 A 88 88 LEU CA C 318 53.110 53.172 -0.062 1
1 1027 . 10 1 1 A 88 88 LEU CB C 318 43.600 46.024 -2.424 1
1 1031 . 10 1 1 A 88 88 LEU N N 318 126.420 125.632 0.788 1
1 1032 . 10 1 1 A 89 89 GLU H H 319 8.780 9.045 -0.265 1
1 1033 . 10 1 1 A 89 89 GLU HA H 319 4.340 4.006 0.334 1
1 1038 . 10 1 1 A 89 89 GLU CA C 319 56.490 59.450 -2.960 1
1 1039 . 10 1 1 A 89 89 GLU CB C 319 30.470 29.743 0.727 1
1 1041 . 10 1 1 A 89 89 GLU N N 319 123.070 125.474 -2.404 1
1 1042 . 10 1 1 A 90 90 ASN H H 320 8.900 8.133 0.767 1
1 1043 . 10 1 1 A 90 90 ASN HA H 320 4.410 5.115 -0.705 1
1 1048 . 10 1 1 A 90 90 ASN CA C 320 54.120 52.067 2.053 1
1 1049 . 10 1 1 A 90 90 ASN CB C 320 37.640 39.284 -1.644 1
1 1050 . 10 1 1 A 90 90 ASN N N 320 116.540 116.332 0.208 1
1 1052 . 10 1 1 A 91 91 TRP H H 321 7.990 8.017 -0.027 1
1 1053 . 10 1 1 A 91 91 TRP HA H 321 4.330 4.325 0.005 1
1 1062 . 10 1 1 A 91 91 TRP CA C 321 54.590 58.043 -3.453 1
1 1063 . 10 1 1 A 91 91 TRP CB C 321 31.280 27.615 3.665 1
1 1069 . 10 1 1 A 91 91 TRP N N 321 119.230 120.791 -1.561 1
1 1071 . 10 1 1 A 92 92 PRO HA H 322 4.800 4.541 0.259 1
1 1077 . 10 1 1 A 93 93 PRO HA H 323 4.450 4.575 -0.125 1
1 1084 . 10 1 1 A 93 93 PRO CA C 323 61.970 62.502 -0.532 1
1 1085 . 10 1 1 A 93 93 PRO CB C 323 32.830 31.776 1.054 1
1 1088 . 10 1 1 A 94 94 ALA H H 324 8.460 8.680 -0.220 1
1 1089 . 10 1 1 A 94 94 ALA HA H 324 4.000 4.012 -0.012 1
1 1093 . 10 1 1 A 94 94 ALA CA C 324 53.790 54.984 -1.194 1
1 1094 . 10 1 1 A 94 94 ALA CB C 324 18.640 18.040 0.600 1
1 1095 . 10 1 1 A 94 94 ALA N N 324 124.010 128.162 -4.152 1
1 1096 . 10 1 1 A 95 95 SER H H 325 7.950 8.000 -0.050 1
1 1097 . 10 1 1 A 95 95 SER HA H 325 4.210 4.104 0.106 1
1 1100 . 10 1 1 A 95 95 SER CA C 325 58.970 62.294 -3.324 1
1 1101 . 10 1 1 A 95 95 SER CB C 325 63.040 63.263 -0.223 1
1 1102 . 10 1 1 A 95 95 SER N N 325 111.520 114.255 -2.735 1
1 1103 . 10 1 1 A 96 96 ILE H H 326 7.480 7.627 -0.147 1
1 1104 . 10 1 1 A 96 96 ILE HA H 326 4.170 3.658 0.512 1
1 1114 . 10 1 1 A 96 96 ILE CA C 326 61.300 65.041 -3.741 1
1 1115 . 10 1 1 A 96 96 ILE CB C 326 38.530 37.644 0.886 1
1 1119 . 10 1 1 A 96 96 ILE N N 326 119.650 118.896 0.754 1
1 1120 . 10 1 1 A 97 97 ALA H H 327 7.860 6.912 0.948 1
1 1121 . 10 1 1 A 97 97 ALA HA H 327 4.230 4.145 0.085 1
1 1125 . 10 1 1 A 97 97 ALA CA C 327 52.570 52.158 0.412 1
1 1126 . 10 1 1 A 97 97 ALA CB C 327 19.590 19.467 0.123 1
1 1127 . 10 1 1 A 97 97 ALA N N 327 126.480 123.493 2.987 1
1 1128 . 10 1 1 A 98 98 ASP H H 328 8.250 8.755 -0.505 1
1 1129 . 10 1 1 A 98 98 ASP HA H 328 4.540 4.287 0.253 1
1 1132 . 10 1 1 A 98 98 ASP CA C 328 54.150 57.475 -3.325 1
1 1133 . 10 1 1 A 98 98 ASP CB C 328 41.120 40.926 0.194 1
1 1134 . 10 1 1 A 98 98 ASP N N 328 120.130 122.387 -2.257 1
1 1150 . 10 2 2 B 6 6 ASP H H 427 8.160 8.921 -0.761 1
1 1151 . 10 2 2 B 6 6 ASP HA H 427 4.630 4.273 0.357 1
1 1154 . 10 2 2 B 6 6 ASP CA C 427 54.410 56.987 -2.577 1
1 1155 . 10 2 2 B 6 6 ASP CB C 427 41.250 40.629 0.621 1
1 1156 . 10 2 2 B 6 6 ASP N N 427 120.160 120.191 -0.031 1
1 1157 . 10 2 2 B 7 7 ASN H H 428 8.350 8.006 0.344 1
1 1158 . 10 2 2 B 7 7 ASN HA H 428 4.550 4.266 0.284 1
1 1163 . 10 2 2 B 7 7 ASN CA C 428 53.310 54.398 -1.088 1
1 1164 . 10 2 2 B 7 7 ASN CB C 428 38.850 36.767 2.083 1
1 1165 . 10 2 2 B 7 7 ASN N N 428 118.440 114.787 3.653 1
1 1167 . 10 2 2 B 8 8 LYS H H 429 8.030 7.902 0.128 1
1 1172 . 10 2 2 B 8 8 LYS CB C 429 33.280 33.057 0.223 1
1 1174 . 10 2 2 B 8 8 LYS N N 429 120.260 118.990 1.270 1
1 1175 . 10 2 2 B 9 9 PRO HA H 430 4.420 4.340 0.080 1
1 1182 . 10 2 2 B 9 9 PRO CA C 430 62.280 62.462 -0.182 1
1 1183 . 10 2 2 B 9 9 PRO CB C 430 31.920 32.120 -0.200 1
1 1186 . 10 2 2 B 10 10 ALA H H 431 8.930 8.159 0.771 1
1 1187 . 10 2 2 B 10 10 ALA HA H 431 4.350 4.457 -0.107 1
1 1191 . 10 2 2 B 10 10 ALA CA C 431 51.070 52.019 -0.949 1
1 1192 . 10 2 2 B 10 10 ALA CB C 431 20.920 19.477 1.443 1
1 1193 . 10 2 2 B 10 10 ALA N N 431 125.000 124.709 0.291 1
1 1194 . 10 2 2 B 11 11 ASP H H 432 8.530 8.933 -0.403 1
1 1195 . 10 2 2 B 11 11 ASP HA H 432 4.220 4.238 -0.018 1
1 1198 . 10 2 2 B 11 11 ASP CA C 432 57.520 57.201 0.319 1
1 1199 . 10 2 2 B 11 11 ASP CB C 432 40.470 40.348 0.122 1
1 1200 . 10 2 2 B 11 11 ASP N N 432 119.610 120.516 -0.906 1
1 1201 . 10 2 2 B 12 12 ASP H H 433 8.340 8.094 0.246 1
1 1202 . 10 2 2 B 12 12 ASP HA H 433 4.160 4.428 -0.268 1
1 1205 . 10 2 2 B 12 12 ASP CA C 433 56.090 57.445 -1.355 1
1 1206 . 10 2 2 B 12 12 ASP CB C 433 38.960 40.880 -1.920 1
1 1207 . 10 2 2 B 12 12 ASP N N 433 116.330 121.022 -4.692 1
1 1208 . 10 2 2 B 13 13 LEU H H 434 7.360 7.716 -0.356 1
1 1209 . 10 2 2 B 13 13 LEU HA H 434 4.050 4.060 -0.010 1
1 1219 . 10 2 2 B 13 13 LEU CA C 434 57.340 57.822 -0.482 1
1 1220 . 10 2 2 B 13 13 LEU CB C 434 42.960 41.584 1.376 1
1 1224 . 10 2 2 B 13 13 LEU N N 434 123.440 120.892 2.548 1
1 1225 . 10 2 2 B 14 14 LEU H H 435 7.670 8.098 -0.428 1
1 1226 . 10 2 2 B 14 14 LEU HA H 435 3.710 3.925 -0.215 1
1 1236 . 10 2 2 B 14 14 LEU CA C 435 57.170 57.967 -0.797 1
1 1237 . 10 2 2 B 14 14 LEU CB C 435 42.590 41.228 1.362 1
1 1241 . 10 2 2 B 14 14 LEU N N 435 115.170 119.709 -4.539 1
1 1242 . 10 2 2 B 15 15 ASN H H 436 7.490 7.573 -0.083 1
1 1243 . 10 2 2 B 15 15 ASN HA H 436 4.640 4.821 -0.181 1
1 1248 . 10 2 2 B 15 15 ASN CA C 436 52.920 53.093 -0.173 1
1 1249 . 10 2 2 B 15 15 ASN CB C 436 39.350 39.177 0.173 1
1 1250 . 10 2 2 B 15 15 ASN N N 436 112.280 114.797 -2.517 1
1 1252 . 10 2 2 B 16 16 LEU H H 437 7.300 7.300 0.000 1
1 1253 . 10 2 2 B 16 16 LEU HA H 437 4.100 4.284 -0.184 1
1 1263 . 10 2 2 B 16 16 LEU CA C 437 55.310 55.045 0.265 1
1 1264 . 10 2 2 B 16 16 LEU CB C 437 41.800 42.949 -1.149 1
1 1268 . 10 2 2 B 16 16 LEU N N 437 125.180 122.835 2.345 1
1 1269 . 10 2 2 B 17 17 GLU H H 438 8.590 8.774 -0.184 1
1 1270 . 10 2 2 B 17 17 GLU HA H 438 3.920 3.968 -0.048 1
1 1275 . 10 2 2 B 17 17 GLU CA C 438 58.440 58.157 0.283 1
1 1276 . 10 2 2 B 17 17 GLU CB C 438 29.180 29.610 -0.430 1
1 1278 . 10 2 2 B 17 17 GLU N N 438 129.850 125.644 4.206 1
1 1279 . 10 2 2 B 18 18 GLY H H 439 8.580 8.919 -0.339 1
1 1280 . 10 2 2 B 18 18 GLY HA2 H 439 3.570 3.956 -0.386 1
1 1281 . 10 2 2 B 18 18 GLY HA3 H 439 4.220 3.957 0.263 1
1 1282 . 10 2 2 B 18 18 GLY CA C 439 44.710 45.298 -0.588 1
1 1283 . 10 2 2 B 18 18 GLY N N 439 112.250 115.043 -2.793 1
1 1284 . 10 2 2 B 19 19 VAL H H 440 7.900 7.437 0.463 1
1 1285 . 10 2 2 B 19 19 VAL HA H 440 3.950 4.271 -0.321 1
1 1293 . 10 2 2 B 19 19 VAL CA C 440 62.820 61.490 1.330 1
1 1294 . 10 2 2 B 19 19 VAL CB C 440 31.470 33.351 -1.881 1
1 1297 . 10 2 2 B 19 19 VAL N N 440 121.910 122.377 -0.467 1
1 1298 . 10 2 2 B 20 20 ASP H H 441 7.390 8.801 -1.411 1
1 1299 . 10 2 2 B 20 20 ASP HA H 441 4.820 4.784 0.036 1
1 1302 . 10 2 2 B 20 20 ASP CA C 441 51.920 53.978 -2.058 1
1 1303 . 10 2 2 B 20 20 ASP CB C 441 42.090 41.814 0.276 1
1 1304 . 10 2 2 B 20 20 ASP N N 441 124.850 127.317 -2.467 1
1 1305 . 10 2 2 B 21 21 ARG H H 442 8.630 8.875 -0.245 1
1 1306 . 10 2 2 B 21 21 ARG HA H 442 3.810 3.888 -0.078 1
1 1313 . 10 2 2 B 21 21 ARG CA C 442 60.710 60.024 0.686 1
1 1314 . 10 2 2 B 21 21 ARG CB C 442 30.020 30.204 -0.184 1
1 1317 . 10 2 2 B 21 21 ARG N N 442 120.890 122.700 -1.810 1
1 1318 . 10 2 2 B 22 22 ASP H H 443 8.140 8.327 -0.187 1
1 1319 . 10 2 2 B 22 22 ASP HA H 443 4.420 4.749 -0.329 1
1 1322 . 10 2 2 B 22 22 ASP CA C 443 57.680 57.525 0.155 1
1 1323 . 10 2 2 B 22 22 ASP CB C 443 40.880 40.453 0.427 1
1 1324 . 10 2 2 B 22 22 ASP N N 443 116.750 120.336 -3.586 1
1 1325 . 10 2 2 B 23 23 LEU H H 444 8.170 8.079 0.091 1
1 1326 . 10 2 2 B 23 23 LEU HA H 444 4.130 4.165 -0.035 1
1 1336 . 10 2 2 B 23 23 LEU CA C 444 57.770 57.951 -0.181 1
1 1337 . 10 2 2 B 23 23 LEU CB C 444 41.230 41.251 -0.021 1
1 1341 . 10 2 2 B 23 23 LEU N N 444 122.130 122.199 -0.069 1
1 1342 . 10 2 2 B 24 24 ALA H H 445 8.630 8.749 -0.119 1
1 1343 . 10 2 2 B 24 24 ALA HA H 445 3.790 4.036 -0.246 1
1 1347 . 10 2 2 B 24 24 ALA CA C 445 55.810 54.981 0.829 1
1 1348 . 10 2 2 B 24 24 ALA CB C 445 18.060 18.438 -0.378 1
1 1349 . 10 2 2 B 24 24 ALA N N 445 120.890 121.270 -0.380 1
1 1350 . 10 2 2 B 25 25 PHE H H 446 8.160 7.897 0.263 1
1 1351 . 10 2 2 B 25 25 PHE HA H 446 4.080 4.325 -0.245 1
1 1358 . 10 2 2 B 25 25 PHE CA C 446 62.670 61.950 0.720 1
1 1359 . 10 2 2 B 25 25 PHE CB C 446 39.440 38.430 1.010 1
1 1364 . 10 2 2 B 25 25 PHE N N 446 115.360 116.171 -0.811 1
1 1365 . 10 2 2 B 26 26 LYS H H 447 8.040 7.615 0.425 1
1 1366 . 10 2 2 B 26 26 LYS HA H 447 4.110 4.007 0.103 1
1 1375 . 10 2 2 B 26 26 LYS CA C 447 60.140 58.725 1.415 1
1 1376 . 10 2 2 B 26 26 LYS CB C 447 32.880 32.223 0.657 1
1 1380 . 10 2 2 B 26 26 LYS N N 447 123.110 118.816 4.294 1
1 1381 . 10 2 2 B 27 27 LEU H H 448 8.630 8.170 0.460 1
1 1382 . 10 2 2 B 27 27 LEU HA H 448 3.840 4.044 -0.204 1
1 1392 . 10 2 2 B 27 27 LEU CA C 448 58.210 57.729 0.481 1
1 1393 . 10 2 2 B 27 27 LEU CB C 448 39.760 40.822 -1.062 1
1 1396 . 10 2 2 B 27 27 LEU N N 448 120.890 120.029 0.861 1
1 1397 . 10 2 2 B 28 28 ALA H H 449 8.200 8.190 0.010 1
1 1398 . 10 2 2 B 28 28 ALA HA H 449 3.760 4.491 -0.731 1
1 1402 . 10 2 2 B 28 28 ALA CA C 449 54.750 55.266 -0.516 1
1 1403 . 10 2 2 B 28 28 ALA CB C 449 18.050 18.237 -0.187 1
1 1404 . 10 2 2 B 28 28 ALA N N 449 123.710 122.033 1.677 1
1 1405 . 10 2 2 B 29 29 ALA H H 450 7.780 7.728 0.052 1
1 1406 . 10 2 2 B 29 29 ALA HA H 450 4.170 4.050 0.120 1
1 1410 . 10 2 2 B 29 29 ALA CA C 450 54.430 55.097 -0.667 1
1 1411 . 10 2 2 B 29 29 ALA CB C 450 18.040 18.663 -0.623 1
1 1412 . 10 2 2 B 29 29 ALA N N 450 121.020 119.125 1.895 1
1 1413 . 10 2 2 B 30 30 ARG H H 451 7.390 7.409 -0.019 1
1 1414 . 10 2 2 B 30 30 ARG HA H 451 4.540 4.405 0.135 1
1 1421 . 10 2 2 B 30 30 ARG CA C 451 54.510 55.756 -1.246 1
1 1422 . 10 2 2 B 30 30 ARG CB C 451 29.950 29.680 0.270 1
1 1425 . 10 2 2 B 30 30 ARG N N 451 115.480 115.914 -0.434 1
1 1426 . 10 2 2 B 31 31 GLY H H 452 7.950 8.991 -1.041 1
1 1427 . 10 2 2 B 31 31 GLY HA2 H 452 3.550 3.992 -0.442 1
1 1428 . 10 2 2 B 31 31 GLY HA3 H 452 4.200 3.994 0.206 1
1 1429 . 10 2 2 B 31 31 GLY CA C 452 45.380 45.433 -0.053 1
1 1430 . 10 2 2 B 31 31 GLY N N 452 107.740 107.484 0.256 1
1 1431 . 10 2 2 B 32 32 VAL H H 453 7.990 7.588 0.402 1
1 1432 . 10 2 2 B 32 32 VAL HA H 453 3.930 4.015 -0.085 1
1 1440 . 10 2 2 B 32 32 VAL CA C 453 61.420 63.010 -1.590 1
1 1441 . 10 2 2 B 32 32 VAL CB C 453 29.860 31.309 -1.449 1
1 1444 . 10 2 2 B 32 32 VAL N N 453 125.560 121.084 4.476 1
1 1445 . 10 2 2 B 33 33 CYS H H 454 8.460 8.592 -0.132 1
1 1446 . 10 2 2 B 33 33 CYS HA H 454 4.310 4.678 -0.368 1
1 1449 . 10 2 2 B 33 33 CYS CA C 454 60.260 59.654 0.606 1
1 1450 . 10 2 2 B 33 33 CYS CB C 454 30.330 30.345 -0.015 1
1 1451 . 10 2 2 B 33 33 CYS N N 454 119.460 126.458 -6.998 1
1 1452 . 10 2 2 B 34 34 THR H H 455 8.080 7.346 0.734 1
1 1453 . 10 2 2 B 34 34 THR HA H 455 4.840 4.306 0.534 1
1 1458 . 10 2 2 B 34 34 THR CA C 455 58.650 62.996 -4.346 1
1 1459 . 10 2 2 B 34 34 THR CB C 455 72.680 69.297 3.383 1
1 1461 . 10 2 2 B 34 34 THR N N 455 108.420 115.121 -6.701 1
1 1462 . 10 2 2 B 35 35 LEU H H 456 8.580 8.741 -0.161 1
1 1463 . 10 2 2 B 35 35 LEU HA H 456 3.790 3.968 -0.178 1
1 1473 . 10 2 2 B 35 35 LEU CA C 456 57.980 58.705 -0.725 1
1 1474 . 10 2 2 B 35 35 LEU CB C 456 42.220 41.575 0.645 1
1 1477 . 10 2 2 B 35 35 LEU N N 456 120.370 128.489 -8.119 1
1 1478 . 10 2 2 B 36 36 GLU H H 457 8.390 8.270 0.120 1
1 1479 . 10 2 2 B 36 36 GLU HA H 457 3.820 3.838 -0.018 1
1 1484 . 10 2 2 B 36 36 GLU CA C 457 59.640 59.928 -0.288 1
1 1485 . 10 2 2 B 36 36 GLU CB C 457 28.780 28.915 -0.135 1
1 1487 . 10 2 2 B 36 36 GLU N N 457 119.450 118.671 0.779 1
1 1488 . 10 2 2 B 37 37 ASP H H 458 7.750 8.142 -0.392 1
1 1489 . 10 2 2 B 37 37 ASP HA H 458 4.140 4.431 -0.291 1
1 1492 . 10 2 2 B 37 37 ASP CA C 458 57.150 57.283 -0.133 1
1 1493 . 10 2 2 B 37 37 ASP CB C 458 42.280 40.744 1.536 1
1 1494 . 10 2 2 B 37 37 ASP N N 458 117.430 120.445 -3.015 1
1 1495 . 10 2 2 B 38 38 LEU H H 459 7.700 7.870 -0.170 1
1 1496 . 10 2 2 B 38 38 LEU HA H 459 3.790 4.056 -0.266 1
1 1506 . 10 2 2 B 38 38 LEU CA C 459 58.080 57.629 0.451 1
1 1507 . 10 2 2 B 38 38 LEU CB C 459 41.130 41.339 -0.209 1
1 1511 . 10 2 2 B 38 38 LEU N N 459 121.280 121.495 -0.215 1
1 1512 . 10 2 2 B 39 39 ALA H H 460 8.190 8.220 -0.030 1
1 1513 . 10 2 2 B 39 39 ALA HA H 460 3.640 4.020 -0.380 1
1 1517 . 10 2 2 B 39 39 ALA CA C 460 54.320 55.156 -0.836 1
1 1518 . 10 2 2 B 39 39 ALA CB C 460 17.140 18.262 -1.122 1
1 1519 . 10 2 2 B 39 39 ALA N N 460 119.400 120.528 -1.128 1
1 1520 . 10 2 2 B 40 40 GLU H H 461 7.340 7.742 -0.402 1
1 1521 . 10 2 2 B 40 40 GLU HA H 461 4.180 4.335 -0.155 1
1 1526 . 10 2 2 B 40 40 GLU CA C 461 57.800 58.580 -0.780 1
1 1527 . 10 2 2 B 40 40 GLU CB C 461 30.600 30.090 0.510 1
1 1529 . 10 2 2 B 40 40 GLU N N 461 110.680 115.251 -4.571 1
1 1530 . 10 2 2 B 41 41 GLN H H 462 7.940 7.681 0.259 1
1 1531 . 10 2 2 B 41 41 GLN HA H 462 4.100 4.417 -0.317 1
1 1538 . 10 2 2 B 41 41 GLN CA C 462 55.310 56.464 -1.154 1
1 1539 . 10 2 2 B 41 41 GLN CB C 462 28.780 29.402 -0.622 1
1 1541 . 10 2 2 B 41 41 GLN N N 462 120.720 117.769 2.951 1
1 1543 . 10 2 2 B 42 42 GLY H H 463 9.000 8.475 0.525 1
1 1544 . 10 2 2 B 42 42 GLY HA2 H 463 3.310 4.251 -0.941 1
1 1545 . 10 2 2 B 42 42 GLY HA3 H 463 4.820 4.255 0.565 1
1 1546 . 10 2 2 B 42 42 GLY CA C 463 42.650 44.050 -1.400 1
1 1547 . 10 2 2 B 42 42 GLY N N 463 104.110 108.465 -4.355 1
1 1548 . 10 2 2 B 43 43 ILE H H 464 7.900 8.788 -0.888 1
1 1549 . 10 2 2 B 43 43 ILE HA H 464 3.260 3.730 -0.470 1
1 1558 . 10 2 2 B 43 43 ILE CA C 464 66.570 64.350 2.220 1
1 1559 . 10 2 2 B 43 43 ILE CB C 464 38.770 37.607 1.163 1
1 1562 . 10 2 2 B 43 43 ILE N N 464 119.410 121.178 -1.768 1
1 1563 . 10 2 2 B 44 44 ASP H H 465 8.730 8.349 0.381 1
1 1564 . 10 2 2 B 44 44 ASP HA H 465 4.310 4.337 -0.027 1
1 1567 . 10 2 2 B 44 44 ASP CA C 465 56.740 57.862 -1.122 1
1 1568 . 10 2 2 B 44 44 ASP CB C 465 40.120 41.260 -1.140 1
1 1569 . 10 2 2 B 44 44 ASP N N 465 116.610 122.279 -5.669 1
1 1570 . 10 2 2 B 45 45 ASP H H 466 7.720 8.387 -0.667 1
1 1571 . 10 2 2 B 45 45 ASP HA H 466 4.480 4.433 0.047 1
1 1574 . 10 2 2 B 45 45 ASP CA C 466 57.000 57.254 -0.254 1
1 1575 . 10 2 2 B 45 45 ASP CB C 466 42.270 40.105 2.165 1
1 1576 . 10 2 2 B 45 45 ASP N N 466 117.560 118.253 -0.693 1
1 1577 . 10 2 2 B 46 46 LEU H H 467 7.370 7.875 -0.505 1
1 1578 . 10 2 2 B 46 46 LEU HA H 467 4.410 4.155 0.255 1
1 1587 . 10 2 2 B 46 46 LEU CA C 467 53.660 57.364 -3.704 1
1 1588 . 10 2 2 B 46 46 LEU CB C 467 42.260 41.774 0.486 1
1 1591 . 10 2 2 B 46 46 LEU N N 467 116.890 120.197 -3.307 1
1 1592 . 10 2 2 B 47 47 ALA H H 468 7.080 8.040 -0.960 1
1 1593 . 10 2 2 B 47 47 ALA HA H 468 4.120 4.055 0.065 1
1 1597 . 10 2 2 B 47 47 ALA CA C 468 54.130 54.782 -0.652 1
1 1598 . 10 2 2 B 47 47 ALA CB C 468 19.480 18.611 0.869 1
1 1599 . 10 2 2 B 47 47 ALA N N 468 120.150 122.722 -2.572 1
1 1600 . 10 2 2 B 48 48 ASP H H 469 8.560 8.177 0.383 1
1 1601 . 10 2 2 B 48 48 ASP HA H 469 4.410 4.446 -0.036 1
1 1604 . 10 2 2 B 48 48 ASP CA C 469 54.330 57.564 -3.234 1
1 1605 . 10 2 2 B 48 48 ASP CB C 469 39.760 40.721 -0.961 1
1 1606 . 10 2 2 B 48 48 ASP N N 469 114.660 116.540 -1.880 1
1 1607 . 10 2 2 B 49 49 ILE H H 470 7.870 7.804 0.066 1
1 1608 . 10 2 2 B 49 49 ILE HA H 470 3.850 4.307 -0.457 1
1 1618 . 10 2 2 B 49 49 ILE CA C 470 61.680 60.730 0.950 1
1 1619 . 10 2 2 B 49 49 ILE CB C 470 37.120 38.568 -1.448 1
1 1623 . 10 2 2 B 49 49 ILE N N 470 121.600 119.772 1.828 1
1 1624 . 10 2 2 B 50 50 GLU H H 471 8.680 8.846 -0.166 1
1 1625 . 10 2 2 B 50 50 GLU HA H 471 3.940 4.038 -0.098 1
1 1630 . 10 2 2 B 50 50 GLU CA C 471 58.360 59.437 -1.077 1
1 1631 . 10 2 2 B 50 50 GLU CB C 471 29.530 29.222 0.308 1
1 1633 . 10 2 2 B 50 50 GLU N N 471 131.000 126.796 4.204 1
1 1634 . 10 2 2 B 51 51 GLY H H 472 8.860 8.265 0.595 1
1 1635 . 10 2 2 B 51 51 GLY HA2 H 472 3.640 3.998 -0.358 1
1 1636 . 10 2 2 B 51 51 GLY HA3 H 472 4.230 4.003 0.227 1
1 1637 . 10 2 2 B 51 51 GLY CA C 472 45.190 46.924 -1.734 1
1 1638 . 10 2 2 B 51 51 GLY N N 472 113.580 109.163 4.417 1
1 1639 . 10 2 2 B 52 52 LEU H H 473 7.850 7.897 -0.047 1
1 1640 . 10 2 2 B 52 52 LEU HA H 473 4.680 4.531 0.149 1
1 1650 . 10 2 2 B 52 52 LEU CA C 473 53.640 54.019 -0.379 1
1 1651 . 10 2 2 B 52 52 LEU CB C 473 42.990 42.925 0.065 1
1 1655 . 10 2 2 B 52 52 LEU N N 473 123.020 120.607 2.413 1
1 1656 . 10 2 2 B 53 53 THR H H 474 7.550 8.712 -1.162 1
1 1657 . 10 2 2 B 53 53 THR HA H 474 4.560 4.771 -0.211 1
1 1662 . 10 2 2 B 53 53 THR CA C 474 60.060 60.980 -0.920 1
1 1663 . 10 2 2 B 53 53 THR CB C 474 71.520 71.488 0.032 1
1 1665 . 10 2 2 B 53 53 THR N N 474 115.070 118.468 -3.398 1
1 1666 . 10 2 2 B 54 54 ASP H H 475 8.900 9.015 -0.115 1
1 1667 . 10 2 2 B 54 54 ASP HA H 475 4.220 4.286 -0.066 1
1 1670 . 10 2 2 B 54 54 ASP CA C 475 57.520 58.045 -0.525 1
1 1671 . 10 2 2 B 54 54 ASP CB C 475 39.560 40.262 -0.702 1
1 1672 . 10 2 2 B 54 54 ASP N N 475 121.800 123.708 -1.908 1
1 1673 . 10 2 2 B 55 55 GLU H H 476 8.460 8.066 0.394 1
1 1674 . 10 2 2 B 55 55 GLU HA H 476 3.970 4.045 -0.075 1
1 1679 . 10 2 2 B 55 55 GLU CA C 476 59.440 59.122 0.318 1
1 1680 . 10 2 2 B 55 55 GLU CB C 476 29.650 29.436 0.214 1
1 1682 . 10 2 2 B 55 55 GLU N N 476 119.460 119.430 0.030 1
1 1683 . 10 2 2 B 56 56 LYS H H 477 7.790 8.068 -0.278 1
1 1684 . 10 2 2 B 56 56 LYS HA H 477 4.120 4.079 0.041 1
1 1693 . 10 2 2 B 56 56 LYS CA C 477 58.890 59.212 -0.322 1
1 1694 . 10 2 2 B 56 56 LYS CB C 477 32.600 32.239 0.361 1
1 1698 . 10 2 2 B 56 56 LYS N N 477 121.840 119.742 2.098 1
1 1699 . 10 2 2 B 57 57 ALA H H 478 8.900 8.820 0.080 1
1 1700 . 10 2 2 B 57 57 ALA HA H 478 3.790 4.083 -0.293 1
1 1704 . 10 2 2 B 57 57 ALA CA C 478 55.810 55.200 0.610 1
1 1705 . 10 2 2 B 57 57 ALA CB C 478 18.590 18.405 0.185 1
1 1706 . 10 2 2 B 57 57 ALA N N 478 121.350 121.748 -0.398 1
1 1707 . 10 2 2 B 58 58 GLY H H 479 8.300 8.107 0.193 1
1 1708 . 10 2 2 B 58 58 GLY HA2 H 479 3.500 3.791 -0.291 1
1 1709 . 10 2 2 B 58 58 GLY HA3 H 479 3.890 3.794 0.096 1
1 1710 . 10 2 2 B 58 58 GLY CA C 479 47.360 47.256 0.104 1
1 1711 . 10 2 2 B 58 58 GLY N N 479 102.040 106.110 -4.070 1
1 1712 . 10 2 2 B 59 59 ALA H H 480 7.580 8.089 -0.509 1
1 1713 . 10 2 2 B 59 59 ALA HA H 480 4.110 4.065 0.045 1
1 1717 . 10 2 2 B 59 59 ALA CA C 480 55.580 54.508 1.072 1
1 1718 . 10 2 2 B 59 59 ALA CB C 480 18.130 18.565 -0.435 1
1 1719 . 10 2 2 B 59 59 ALA N N 480 123.180 125.153 -1.973 1
1 1720 . 10 2 2 B 60 60 LEU H H 481 8.290 8.015 0.275 1
1 1721 . 10 2 2 B 60 60 LEU HA H 481 4.020 4.006 0.014 1
1 1731 . 10 2 2 B 60 60 LEU CA C 481 57.850 57.880 -0.030 1
1 1732 . 10 2 2 B 60 60 LEU CB C 481 42.360 42.006 0.354 1
1 1736 . 10 2 2 B 60 60 LEU N N 481 120.560 118.970 1.590 1
1 1737 . 10 2 2 B 61 61 ILE H H 482 8.080 8.231 -0.151 1
1 1738 . 10 2 2 B 61 61 ILE HA H 482 3.210 3.522 -0.312 1
1 1748 . 10 2 2 B 61 61 ILE CA C 482 66.250 65.237 1.013 1
1 1749 . 10 2 2 B 61 61 ILE CB C 482 39.400 37.758 1.642 1
1 1753 . 10 2 2 B 61 61 ILE N N 482 119.170 119.382 -0.212 1
1 1754 . 10 2 2 B 62 62 MET H H 483 8.110 8.257 -0.147 1
1 1755 . 10 2 2 B 62 62 MET HA H 483 4.410 4.124 0.286 1
1 1763 . 10 2 2 B 62 62 MET CA C 483 56.110 58.696 -2.586 1
1 1764 . 10 2 2 B 62 62 MET CB C 483 28.260 32.557 -4.297 1
1 1767 . 10 2 2 B 62 62 MET N N 483 114.420 117.943 -3.523 1
1 1768 . 10 2 2 B 63 63 ALA H H 484 8.240 7.870 0.370 1
1 1769 . 10 2 2 B 63 63 ALA HA H 484 4.130 4.125 0.005 1
1 1773 . 10 2 2 B 63 63 ALA CA C 484 55.300 54.951 0.349 1
1 1774 . 10 2 2 B 63 63 ALA CB C 484 18.280 18.506 -0.226 1
1 1775 . 10 2 2 B 63 63 ALA N N 484 123.710 121.365 2.345 1
1 1776 . 10 2 2 B 64 64 ALA H H 485 8.050 8.580 -0.530 1
1 1777 . 10 2 2 B 64 64 ALA HA H 485 3.870 4.075 -0.205 1
1 1781 . 10 2 2 B 64 64 ALA CA C 485 55.330 55.215 0.115 1
1 1782 . 10 2 2 B 64 64 ALA CB C 485 17.660 18.045 -0.385 1
1 1783 . 10 2 2 B 64 64 ALA N N 485 120.070 119.925 0.145 1
1 1784 . 10 2 2 B 65 65 ARG H H 486 8.640 8.679 -0.039 1
1 1785 . 10 2 2 B 65 65 ARG HA H 486 2.800 4.241 -1.441 1
1 1792 . 10 2 2 B 65 65 ARG CA C 486 60.600 59.558 1.042 1
1 1793 . 10 2 2 B 65 65 ARG CB C 486 29.910 30.073 -0.163 1
1 1796 . 10 2 2 B 65 65 ARG N N 486 118.730 118.770 -0.040 1
1 1797 . 10 2 2 B 66 66 ASN H H 487 8.710 8.231 0.479 1
1 1798 . 10 2 2 B 66 66 ASN HA H 487 4.550 5.014 -0.464 1
1 1803 . 10 2 2 B 66 66 ASN CA C 487 56.390 56.496 -0.106 1
1 1804 . 10 2 2 B 66 66 ASN CB C 487 37.970 38.625 -0.655 1
1 1805 . 10 2 2 B 66 66 ASN N N 487 119.170 117.999 1.171 1
1 1807 . 10 2 2 B 67 67 ILE H H 488 7.250 7.824 -0.574 1
1 1808 . 10 2 2 B 67 67 ILE HA H 488 3.810 3.855 -0.045 1
1 1818 . 10 2 2 B 67 67 ILE CA C 488 64.350 64.995 -0.645 1
1 1819 . 10 2 2 B 67 67 ILE CB C 488 39.570 37.752 1.818 1
1 1823 . 10 2 2 B 67 67 ILE N N 488 117.890 120.014 -2.124 1
1 1824 . 10 2 2 B 68 68 CYS H H 489 8.350 8.168 0.182 1
1 1825 . 10 2 2 B 68 68 CYS HA H 489 4.080 4.088 -0.008 1
1 1828 . 10 2 2 B 68 68 CYS CA C 489 62.670 62.624 0.046 1
1 1829 . 10 2 2 B 68 68 CYS CB C 489 28.170 27.160 1.010 1
1 1830 . 10 2 2 B 68 68 CYS N N 489 115.230 120.407 -5.177 1
1 1831 . 10 2 2 B 69 69 TRP H H 490 8.230 8.851 -0.621 1
1 1832 . 10 2 2 B 69 69 TRP HA H 490 5.100 4.241 0.859 1
1 1841 . 10 2 2 B 69 69 TRP CA C 490 55.420 60.257 -4.837 1
1 1842 . 10 2 2 B 69 69 TRP CB C 490 31.010 29.327 1.683 1
1 1844 . 10 2 2 B 69 69 TRP N N 490 116.850 120.776 -3.926 1
1 1846 . 10 2 2 B 70 70 PHE H H 491 7.570 8.655 -1.085 1
1 1847 . 10 2 2 B 70 70 PHE HA H 491 5.240 4.682 0.558 1
1 1852 . 10 2 2 B 70 70 PHE CA C 491 55.490 58.481 -2.991 1
1 1853 . 10 2 2 B 70 70 PHE CB C 491 38.700 38.940 -0.240 1
1 1856 . 10 2 2 B 70 70 PHE N N 491 117.460 116.427 1.033 1
1 1857 . 10 2 2 B 71 71 GLY H H 492 8.420 8.490 -0.070 1
1 1858 . 10 2 2 B 71 71 GLY HA2 H 492 3.920 3.825 0.095 1
1 1859 . 10 2 2 B 71 71 GLY HA3 H 492 4.080 3.863 0.217 1
1 1860 . 10 2 2 B 71 71 GLY CA C 492 46.210 47.059 -0.849 1
1 1861 . 10 2 2 B 71 71 GLY N N 492 110.040 108.681 1.359 1
1 1862 . 10 2 2 B 72 72 ASP H H 493 8.370 8.449 -0.079 1
1 1863 . 10 2 2 B 72 72 ASP HA H 493 4.630 4.350 0.280 1
1 1866 . 10 2 2 B 72 72 ASP CA C 493 54.410 57.418 -3.008 1
1 1867 . 10 2 2 B 72 72 ASP CB C 493 41.250 41.947 -0.697 1
1 1868 . 10 2 2 B 72 72 ASP N N 493 120.000 121.672 -1.672 1
1 1869 . 10 2 2 B 73 73 GLU H H 494 8.230 7.666 0.564 1
1 1870 . 10 2 2 B 73 73 GLU HA H 494 4.260 4.425 -0.165 1
1 1875 . 10 2 2 B 73 73 GLU CA C 494 56.510 56.977 -0.467 1
1 1876 . 10 2 2 B 73 73 GLU CB C 494 30.420 30.250 0.170 1
1 1878 . 10 2 2 B 73 73 GLU N N 494 120.900 119.077 1.823 1
1 216 . 11 1 1 A 20 20 ASP H H 250 8.550 7.446 1.104 1
1 217 . 11 1 1 A 20 20 ASP HA H 250 4.700 4.453 0.247 1
1 220 . 11 1 1 A 20 20 ASP CA C 250 52.650 51.931 0.719 1
1 221 . 11 1 1 A 20 20 ASP CB C 250 41.420 41.404 0.016 1
1 222 . 11 1 1 A 20 20 ASP N N 250 125.190 124.018 1.172 1
1 223 . 11 1 1 A 21 21 PRO HA H 251 4.250 4.412 -0.162 1
1 230 . 11 1 1 A 21 21 PRO CA C 251 65.120 64.610 0.510 1
1 231 . 11 1 1 A 21 21 PRO CB C 251 32.310 32.111 0.199 1
1 234 . 11 1 1 A 22 22 ILE H H 252 8.630 7.750 0.880 1
1 235 . 11 1 1 A 22 22 ILE HA H 252 4.060 3.950 0.110 1
1 245 . 11 1 1 A 22 22 ILE CA C 252 62.990 62.963 0.027 1
1 246 . 11 1 1 A 22 22 ILE CB C 252 37.520 37.667 -0.147 1
1 250 . 11 1 1 A 22 22 ILE N N 252 119.860 117.215 2.645 1
1 251 . 11 1 1 A 23 23 LEU H H 253 7.950 7.812 0.138 1
1 252 . 11 1 1 A 23 23 LEU HA H 253 3.710 4.201 -0.491 1
1 262 . 11 1 1 A 23 23 LEU CA C 253 56.510 57.919 -1.409 1
1 263 . 11 1 1 A 23 23 LEU CB C 253 41.190 41.867 -0.677 1
1 266 . 11 1 1 A 23 23 LEU N N 253 116.850 121.611 -4.761 1
1 267 . 11 1 1 A 24 24 LEU H H 254 7.370 7.874 -0.504 1
1 268 . 11 1 1 A 24 24 LEU HA H 254 4.310 4.606 -0.296 1
1 278 . 11 1 1 A 24 24 LEU CA C 254 54.890 57.357 -2.467 1
1 279 . 11 1 1 A 24 24 LEU CB C 254 41.960 41.779 0.181 1
1 283 . 11 1 1 A 24 24 LEU N N 254 115.210 119.289 -4.079 1
1 284 . 11 1 1 A 25 25 ARG H H 255 7.520 7.322 0.198 1
1 285 . 11 1 1 A 25 25 ARG HA H 255 4.660 4.310 0.350 1
1 293 . 11 1 1 A 25 25 ARG CA C 255 52.840 54.724 -1.884 1
1 294 . 11 1 1 A 25 25 ARG CB C 255 28.130 29.805 -1.675 1
1 297 . 11 1 1 A 25 25 ARG N N 255 118.180 119.945 -1.765 1
1 298 . 11 1 1 A 26 26 PRO HA H 256 4.800 4.972 -0.172 1
1 305 . 11 1 1 A 26 26 PRO CA C 256 61.790 62.773 -0.983 1
1 306 . 11 1 1 A 26 26 PRO CB C 256 32.660 31.661 0.999 1
1 309 . 11 1 1 A 27 27 VAL H H 257 8.170 8.657 -0.487 1
1 310 . 11 1 1 A 27 27 VAL HA H 257 3.590 3.778 -0.188 1
1 318 . 11 1 1 A 27 27 VAL CA C 257 64.830 65.501 -0.671 1
1 319 . 11 1 1 A 27 27 VAL CB C 257 31.720 31.398 0.322 1
1 322 . 11 1 1 A 27 27 VAL N N 257 115.710 124.400 -8.690 1
1 323 . 11 1 1 A 28 28 ASP H H 258 8.240 8.011 0.229 1
1 324 . 11 1 1 A 28 28 ASP HA H 258 4.340 4.388 -0.048 1
1 327 . 11 1 1 A 28 28 ASP CA C 258 56.490 57.479 -0.989 1
1 328 . 11 1 1 A 28 28 ASP CB C 258 40.520 40.084 0.436 1
1 329 . 11 1 1 A 28 28 ASP N N 258 119.000 121.594 -2.594 1
1 330 . 11 1 1 A 29 29 ASP H H 259 8.000 9.033 -1.033 1
1 331 . 11 1 1 A 29 29 ASP HA H 259 4.390 4.449 -0.059 1
1 334 . 11 1 1 A 29 29 ASP CA C 259 56.210 55.879 0.331 1
1 335 . 11 1 1 A 29 29 ASP CB C 259 40.670 40.939 -0.269 1
1 336 . 11 1 1 A 29 29 ASP N N 259 118.900 118.030 0.870 1
1 337 . 11 1 1 A 30 30 LEU H H 260 7.760 7.390 0.370 1
1 338 . 11 1 1 A 30 30 LEU HA H 260 3.990 4.207 -0.217 1
1 348 . 11 1 1 A 30 30 LEU CA C 260 55.000 55.724 -0.724 1
1 349 . 11 1 1 A 30 30 LEU CB C 260 41.670 42.093 -0.423 1
1 353 . 11 1 1 A 30 30 LEU N N 260 116.300 121.644 -5.344 1
1 354 . 11 1 1 A 31 31 GLU H H 261 7.990 8.664 -0.674 1
1 355 . 11 1 1 A 31 31 GLU HA H 261 4.280 4.015 0.265 1
1 358 . 11 1 1 A 31 31 GLU CA C 261 56.860 59.265 -2.405 1
1 359 . 11 1 1 A 31 31 GLU CB C 261 27.010 29.240 -2.230 1
1 360 . 11 1 1 A 31 31 GLU N N 261 115.620 123.758 -8.138 1
1 361 . 11 1 1 A 32 32 LEU H H 262 8.000 7.374 0.626 1
1 362 . 11 1 1 A 32 32 LEU HA H 262 4.400 4.313 0.087 1
1 372 . 11 1 1 A 32 32 LEU CA C 262 53.860 54.937 -1.077 1
1 373 . 11 1 1 A 32 32 LEU CB C 262 44.450 42.205 2.245 1
1 377 . 11 1 1 A 32 32 LEU N N 262 118.860 122.267 -3.407 1
1 378 . 11 1 1 A 33 33 THR H H 263 10.020 8.573 1.447 1
1 379 . 11 1 1 A 33 33 THR HA H 263 4.130 4.524 -0.394 1
1 384 . 11 1 1 A 33 33 THR CA C 263 62.400 61.058 1.342 1
1 385 . 11 1 1 A 33 33 THR CB C 263 71.270 71.165 0.105 1
1 387 . 11 1 1 A 33 33 THR N N 263 114.610 114.114 0.496 1
1 388 . 11 1 1 A 34 34 VAL H H 264 8.370 8.738 -0.368 1
1 389 . 11 1 1 A 34 34 VAL HA H 264 3.620 3.673 -0.053 1
1 397 . 11 1 1 A 34 34 VAL CA C 264 66.340 66.503 -0.163 1
1 398 . 11 1 1 A 34 34 VAL CB C 264 31.670 31.378 0.292 1
1 401 . 11 1 1 A 34 34 VAL N N 264 122.110 122.214 -0.104 1
1 402 . 11 1 1 A 35 35 ARG H H 265 8.190 8.178 0.012 1
1 403 . 11 1 1 A 35 35 ARG HA H 265 4.070 3.948 0.122 1
1 411 . 11 1 1 A 35 35 ARG CA C 265 59.470 59.786 -0.316 1
1 412 . 11 1 1 A 35 35 ARG CB C 265 29.790 29.919 -0.129 1
1 415 . 11 1 1 A 35 35 ARG N N 265 117.340 119.865 -2.525 1
1 416 . 11 1 1 A 36 36 SER H H 266 7.610 7.810 -0.200 1
1 417 . 11 1 1 A 36 36 SER HA H 266 4.080 4.129 -0.049 1
1 420 . 11 1 1 A 36 36 SER CA C 266 63.080 61.884 1.196 1
1 421 . 11 1 1 A 36 36 SER CB C 266 63.280 62.850 0.430 1
1 422 . 11 1 1 A 36 36 SER N N 266 116.710 116.719 -0.009 1
1 423 . 11 1 1 A 37 37 ALA H H 267 8.720 7.474 1.246 1
1 424 . 11 1 1 A 37 37 ALA HA H 267 3.760 4.047 -0.287 1
1 428 . 11 1 1 A 37 37 ALA CA C 267 55.900 55.339 0.561 1
1 429 . 11 1 1 A 37 37 ALA CB C 267 18.090 17.814 0.276 1
1 430 . 11 1 1 A 37 37 ALA N N 267 124.170 123.656 0.514 1
1 431 . 11 1 1 A 38 38 ASN H H 268 8.850 8.974 -0.124 1
1 432 . 11 1 1 A 38 38 ASN HA H 268 4.420 4.516 -0.096 1
1 437 . 11 1 1 A 38 38 ASN CA C 268 55.700 56.237 -0.537 1
1 438 . 11 1 1 A 38 38 ASN CB C 268 37.180 37.645 -0.465 1
1 439 . 11 1 1 A 38 38 ASN N N 268 117.370 117.460 -0.090 1
1 441 . 11 1 1 A 39 39 CYS H H 269 7.970 8.138 -0.168 1
1 442 . 11 1 1 A 39 39 CYS HA H 269 4.190 4.120 0.070 1
1 445 . 11 1 1 A 39 39 CYS CA C 269 63.340 62.957 0.383 1
1 446 . 11 1 1 A 39 39 CYS CB C 269 26.870 27.213 -0.343 1
1 447 . 11 1 1 A 39 39 CYS N N 269 120.510 118.926 1.584 1
1 448 . 11 1 1 A 40 40 LEU H H 270 7.600 7.686 -0.086 1
1 449 . 11 1 1 A 40 40 LEU HA H 270 3.880 3.900 -0.020 1
1 458 . 11 1 1 A 40 40 LEU CA C 270 57.810 57.861 -0.051 1
1 459 . 11 1 1 A 40 40 LEU CB C 270 40.030 41.059 -1.029 1
1 462 . 11 1 1 A 40 40 LEU N N 270 117.710 120.409 -2.699 1
1 463 . 11 1 1 A 41 41 LYS H H 271 7.980 8.705 -0.725 1
1 464 . 11 1 1 A 41 41 LYS HA H 271 3.820 4.261 -0.441 1
1 472 . 11 1 1 A 41 41 LYS CA C 271 59.840 59.060 0.780 1
1 473 . 11 1 1 A 41 41 LYS CB C 271 32.070 32.086 -0.016 1
1 476 . 11 1 1 A 41 41 LYS N N 271 120.070 120.569 -0.499 1
1 477 . 11 1 1 A 42 42 ALA H H 272 7.860 8.636 -0.776 1
1 478 . 11 1 1 A 42 42 ALA HA H 272 4.140 4.038 0.102 1
1 482 . 11 1 1 A 42 42 ALA CA C 272 54.670 54.659 0.011 1
1 483 . 11 1 1 A 42 42 ALA CB C 272 17.950 18.637 -0.687 1
1 484 . 11 1 1 A 42 42 ALA N N 272 122.880 121.485 1.395 1
1 485 . 11 1 1 A 43 43 GLU H H 273 7.210 7.943 -0.733 1
1 486 . 11 1 1 A 43 43 GLU HA H 273 4.260 4.410 -0.150 1
1 491 . 11 1 1 A 43 43 GLU CA C 273 55.020 55.951 -0.931 1
1 492 . 11 1 1 A 43 43 GLU CB C 273 29.880 29.371 0.509 1
1 494 . 11 1 1 A 43 43 GLU N N 273 116.590 115.412 1.178 1
1 495 . 11 1 1 A 44 44 ALA H H 274 7.880 8.253 -0.373 1
1 496 . 11 1 1 A 44 44 ALA HA H 274 3.680 3.805 -0.125 1
1 500 . 11 1 1 A 44 44 ALA CA C 274 52.960 53.063 -0.103 1
1 501 . 11 1 1 A 44 44 ALA CB C 274 16.110 17.176 -1.066 1
1 502 . 11 1 1 A 44 44 ALA N N 274 118.420 118.964 -0.544 1
1 503 . 11 1 1 A 45 45 ILE H H 275 7.600 7.428 0.172 1
1 504 . 11 1 1 A 45 45 ILE HA H 275 3.870 4.168 -0.298 1
1 514 . 11 1 1 A 45 45 ILE CA C 275 61.150 60.308 0.842 1
1 515 . 11 1 1 A 45 45 ILE CB C 275 37.090 38.884 -1.794 1
1 519 . 11 1 1 A 45 45 ILE N N 275 120.370 118.148 2.222 1
1 520 . 11 1 1 A 46 46 HIS H H 276 8.350 8.718 -0.368 1
1 521 . 11 1 1 A 46 46 HIS HA H 276 4.600 4.830 -0.230 1
1 526 . 11 1 1 A 46 46 HIS CA C 276 56.900 57.087 -0.187 1
1 527 . 11 1 1 A 46 46 HIS CB C 276 31.910 31.099 0.811 1
1 529 . 11 1 1 A 46 46 HIS N N 276 123.250 125.995 -2.745 1
1 530 . 11 1 1 A 47 47 TYR H H 277 8.850 7.950 0.900 1
1 531 . 11 1 1 A 47 47 TYR HA H 277 5.100 4.893 0.207 1
1 538 . 11 1 1 A 47 47 TYR CA C 277 57.430 56.791 0.639 1
1 539 . 11 1 1 A 47 47 TYR CB C 277 40.680 40.393 0.287 1
1 544 . 11 1 1 A 47 47 TYR N N 277 119.700 117.743 1.957 1
1 545 . 11 1 1 A 48 48 ILE H H 278 9.380 8.495 0.885 1
1 546 . 11 1 1 A 48 48 ILE HA H 278 3.340 3.660 -0.320 1
1 554 . 11 1 1 A 48 48 ILE CA C 278 67.640 65.072 2.568 1
1 555 . 11 1 1 A 48 48 ILE CB C 278 36.310 37.422 -1.112 1
1 558 . 11 1 1 A 48 48 ILE N N 278 125.650 125.125 0.525 1
1 559 . 11 1 1 A 49 49 GLY H H 279 9.430 8.086 1.344 1
1 560 . 11 1 1 A 49 49 GLY HA2 H 279 2.370 2.191 0.179 1
1 561 . 11 1 1 A 49 49 GLY HA3 H 279 3.230 3.571 -0.341 1
1 562 . 11 1 1 A 49 49 GLY CA C 279 46.820 46.693 0.127 1
1 563 . 11 1 1 A 49 49 GLY N N 279 105.200 108.545 -3.345 1
1 564 . 11 1 1 A 50 50 ASP H H 280 7.050 7.231 -0.181 1
1 565 . 11 1 1 A 50 50 ASP HA H 280 4.360 4.108 0.252 1
1 568 . 11 1 1 A 50 50 ASP CA C 280 57.110 56.069 1.041 1
1 569 . 11 1 1 A 50 50 ASP CB C 280 42.620 40.492 2.128 1
1 570 . 11 1 1 A 50 50 ASP N N 280 116.360 121.142 -4.782 1
1 571 . 11 1 1 A 51 51 LEU H H 281 7.170 8.234 -1.064 1
1 572 . 11 1 1 A 51 51 LEU HA H 281 3.880 3.971 -0.091 1
1 582 . 11 1 1 A 51 51 LEU CA C 281 57.900 58.210 -0.310 1
1 583 . 11 1 1 A 51 51 LEU CB C 281 41.870 41.628 0.242 1
1 587 . 11 1 1 A 51 51 LEU N N 281 120.130 121.970 -1.840 1
1 588 . 11 1 1 A 52 52 VAL H H 282 7.820 7.577 0.243 1
1 589 . 11 1 1 A 52 52 VAL HA H 282 3.980 3.921 0.059 1
1 597 . 11 1 1 A 52 52 VAL CA C 282 64.000 65.338 -1.338 1
1 598 . 11 1 1 A 52 52 VAL CB C 282 30.400 31.267 -0.867 1
1 601 . 11 1 1 A 52 52 VAL N N 282 105.550 115.097 -9.547 1
1 602 . 11 1 1 A 53 53 GLN H H 283 6.550 7.764 -1.214 1
1 603 . 11 1 1 A 53 53 GLN HA H 283 4.680 4.095 0.585 1
1 610 . 11 1 1 A 53 53 GLN CA C 283 56.210 58.560 -2.350 1
1 611 . 11 1 1 A 53 53 GLN CB C 283 31.710 28.800 2.910 1
1 613 . 11 1 1 A 53 53 GLN N N 283 114.060 120.950 -6.890 1
1 615 . 11 1 1 A 54 54 ARG H H 284 7.690 7.507 0.183 1
1 616 . 11 1 1 A 54 54 ARG HA H 284 4.520 4.825 -0.305 1
1 624 . 11 1 1 A 54 54 ARG CA C 284 54.600 54.020 0.580 1
1 625 . 11 1 1 A 54 54 ARG CB C 284 30.750 32.792 -2.042 1
1 628 . 11 1 1 A 54 54 ARG N N 284 119.810 118.102 1.708 1
1 629 . 11 1 1 A 55 55 THR H H 285 8.110 8.578 -0.468 1
1 630 . 11 1 1 A 55 55 THR HA H 285 4.430 4.320 0.110 1
1 635 . 11 1 1 A 55 55 THR CA C 285 59.640 63.814 -4.174 1
1 636 . 11 1 1 A 55 55 THR CB C 285 71.310 69.348 1.962 1
1 638 . 11 1 1 A 55 55 THR N N 285 108.450 118.969 -10.519 1
1 639 . 11 1 1 A 56 56 GLU H H 286 8.910 8.955 -0.045 1
1 640 . 11 1 1 A 56 56 GLU HA H 286 3.660 3.954 -0.294 1
1 645 . 11 1 1 A 56 56 GLU CA C 286 60.650 59.789 0.861 1
1 646 . 11 1 1 A 56 56 GLU CB C 286 29.400 29.277 0.123 1
1 648 . 11 1 1 A 56 56 GLU N N 286 120.600 126.476 -5.876 1
1 649 . 11 1 1 A 57 57 VAL H H 287 7.600 8.230 -0.630 1
1 650 . 11 1 1 A 57 57 VAL HA H 287 3.620 3.522 0.098 1
1 658 . 11 1 1 A 57 57 VAL CA C 287 66.020 67.126 -1.106 1
1 659 . 11 1 1 A 57 57 VAL CB C 287 31.720 31.564 0.156 1
1 662 . 11 1 1 A 57 57 VAL N N 287 114.050 119.968 -5.918 1
1 663 . 11 1 1 A 58 58 GLU H H 288 7.350 8.194 -0.844 1
1 664 . 11 1 1 A 58 58 GLU HA H 288 3.830 4.047 -0.217 1
1 669 . 11 1 1 A 58 58 GLU CA C 288 59.250 59.633 -0.383 1
1 670 . 11 1 1 A 58 58 GLU CB C 288 30.030 29.134 0.896 1
1 672 . 11 1 1 A 58 58 GLU N N 288 117.610 119.028 -1.418 1
1 673 . 11 1 1 A 59 59 LEU H H 289 7.850 7.897 -0.047 1
1 674 . 11 1 1 A 59 59 LEU HA H 289 4.150 4.057 0.093 1
1 683 . 11 1 1 A 59 59 LEU CA C 289 57.340 57.740 -0.400 1
1 684 . 11 1 1 A 59 59 LEU CB C 289 41.170 41.700 -0.530 1
1 687 . 11 1 1 A 59 59 LEU N N 289 120.050 120.548 -0.498 1
1 688 . 11 1 1 A 60 60 LEU H H 290 7.670 8.453 -0.783 1
1 689 . 11 1 1 A 60 60 LEU HA H 290 4.540 3.985 0.555 1
1 696 . 11 1 1 A 60 60 LEU CA C 290 55.090 57.093 -2.003 1
1 697 . 11 1 1 A 60 60 LEU CB C 290 42.320 41.464 0.856 1
1 701 . 11 1 1 A 60 60 LEU N N 290 114.980 118.794 -3.814 1
1 702 . 11 1 1 A 61 61 LYS H H 291 7.440 7.346 0.094 1
1 703 . 11 1 1 A 61 61 LYS HA H 291 4.280 4.276 0.004 1
1 710 . 11 1 1 A 61 61 LYS CA C 291 56.860 58.239 -1.379 1
1 711 . 11 1 1 A 61 61 LYS CB C 291 31.900 32.763 -0.863 1
1 714 . 11 1 1 A 61 61 LYS N N 291 118.120 116.524 1.596 1
1 715 . 11 1 1 A 62 62 THR H H 292 7.310 7.755 -0.445 1
1 716 . 11 1 1 A 62 62 THR HA H 292 5.220 4.385 0.835 1
1 721 . 11 1 1 A 62 62 THR CA C 292 55.830 61.352 -5.522 1
1 722 . 11 1 1 A 62 62 THR CB C 292 69.970 69.155 0.815 1
1 724 . 11 1 1 A 62 62 THR N N 292 111.890 116.000 -4.110 1
1 725 . 11 1 1 A 63 63 PRO HA H 293 4.570 4.540 0.030 1
1 730 . 11 1 1 A 63 63 PRO CA C 293 63.710 64.245 -0.535 1
1 731 . 11 1 1 A 63 63 PRO CB C 293 32.380 31.849 0.531 1
1 733 . 11 1 1 A 64 64 ASN H H 294 8.050 8.789 -0.739 1
1 734 . 11 1 1 A 64 64 ASN HA H 294 4.490 4.478 0.012 1
1 739 . 11 1 1 A 64 64 ASN CA C 294 55.630 55.083 0.547 1
1 740 . 11 1 1 A 64 64 ASN CB C 294 38.730 38.177 0.553 1
1 741 . 11 1 1 A 64 64 ASN N N 294 117.120 116.783 0.337 1
1 743 . 11 1 1 A 65 65 LEU H H 295 7.550 7.138 0.412 1
1 744 . 11 1 1 A 65 65 LEU HA H 295 4.640 4.215 0.425 1
1 754 . 11 1 1 A 65 65 LEU CA C 295 54.310 55.286 -0.976 1
1 755 . 11 1 1 A 65 65 LEU CB C 295 43.640 42.420 1.220 1
1 758 . 11 1 1 A 65 65 LEU N N 295 119.930 120.954 -1.024 1
1 759 . 11 1 1 A 66 66 GLY H H 296 7.850 8.732 -0.882 1
1 760 . 11 1 1 A 66 66 GLY HA2 H 296 3.810 4.231 -0.421 1
1 761 . 11 1 1 A 66 66 GLY HA3 H 296 4.110 4.232 -0.122 1
1 762 . 11 1 1 A 66 66 GLY CA C 296 43.570 44.301 -0.731 1
1 763 . 11 1 1 A 66 66 GLY N N 296 108.840 109.654 -0.814 1
1 764 . 11 1 1 A 67 67 LYS H H 297 8.820 8.567 0.253 1
1 765 . 11 1 1 A 67 67 LYS HA H 297 3.980 3.901 0.079 1
1 774 . 11 1 1 A 67 67 LYS CA C 297 60.100 59.566 0.534 1
1 775 . 11 1 1 A 67 67 LYS CB C 297 32.100 32.105 -0.005 1
1 779 . 11 1 1 A 67 67 LYS N N 297 120.130 121.347 -1.217 1
1 780 . 11 1 1 A 68 68 LYS H H 298 8.850 8.017 0.833 1
1 781 . 11 1 1 A 68 68 LYS HA H 298 4.060 4.117 -0.057 1
1 790 . 11 1 1 A 68 68 LYS CA C 298 60.600 59.173 1.427 1
1 791 . 11 1 1 A 68 68 LYS CB C 298 31.920 32.071 -0.151 1
1 795 . 11 1 1 A 68 68 LYS N N 298 119.580 119.434 0.146 1
1 796 . 11 1 1 A 69 69 SER H H 299 8.100 8.317 -0.217 1
1 797 . 11 1 1 A 69 69 SER HA H 299 4.370 4.179 0.191 1
1 800 . 11 1 1 A 69 69 SER CA C 299 61.980 61.467 0.513 1
1 801 . 11 1 1 A 69 69 SER CB C 299 63.000 62.426 0.574 1
1 802 . 11 1 1 A 69 69 SER N N 299 116.360 114.907 1.453 1
1 803 . 11 1 1 A 70 70 LEU H H 300 8.240 8.083 0.157 1
1 804 . 11 1 1 A 70 70 LEU HA H 300 3.970 4.069 -0.099 1
1 814 . 11 1 1 A 70 70 LEU CA C 300 57.610 57.910 -0.300 1
1 815 . 11 1 1 A 70 70 LEU CB C 300 41.060 41.566 -0.506 1
1 819 . 11 1 1 A 70 70 LEU N N 300 123.330 124.303 -0.973 1
1 820 . 11 1 1 A 71 71 THR H H 301 8.550 7.929 0.621 1
1 821 . 11 1 1 A 71 71 THR HA H 301 3.690 3.796 -0.106 1
1 826 . 11 1 1 A 71 71 THR CA C 301 67.170 66.582 0.588 1
1 827 . 11 1 1 A 71 71 THR CB C 301 68.810 68.495 0.315 1
1 829 . 11 1 1 A 71 71 THR N N 301 116.520 114.456 2.064 1
1 830 . 11 1 1 A 72 72 GLU H H 302 7.520 8.101 -0.581 1
1 831 . 11 1 1 A 72 72 GLU HA H 302 4.070 4.027 0.043 1
1 836 . 11 1 1 A 72 72 GLU CA C 302 59.470 59.496 -0.026 1
1 837 . 11 1 1 A 72 72 GLU CB C 302 29.090 29.387 -0.297 1
1 839 . 11 1 1 A 72 72 GLU N N 302 121.510 119.139 2.371 1
1 840 . 11 1 1 A 73 73 ILE H H 303 8.290 8.121 0.169 1
1 841 . 11 1 1 A 73 73 ILE HA H 303 3.380 3.609 -0.229 1
1 849 . 11 1 1 A 73 73 ILE CA C 303 66.010 65.616 0.394 1
1 850 . 11 1 1 A 73 73 ILE CB C 303 38.680 37.787 0.893 1
1 853 . 11 1 1 A 73 73 ILE N N 303 118.510 120.955 -2.445 1
1 854 . 11 1 1 A 74 74 LYS H H 304 8.550 8.404 0.146 1
1 855 . 11 1 1 A 74 74 LYS HA H 304 3.680 3.785 -0.105 1
1 864 . 11 1 1 A 74 74 LYS CA C 304 61.320 60.454 0.866 1
1 865 . 11 1 1 A 74 74 LYS CB C 304 32.060 31.997 0.063 1
1 868 . 11 1 1 A 74 74 LYS N N 304 118.220 119.010 -0.790 1
1 869 . 11 1 1 A 75 75 ASP H H 305 8.450 7.904 0.546 1
1 870 . 11 1 1 A 75 75 ASP HA H 305 4.440 4.437 0.003 1
1 873 . 11 1 1 A 75 75 ASP CA C 305 57.690 57.058 0.632 1
1 874 . 11 1 1 A 75 75 ASP CB C 305 40.220 40.930 -0.710 1
1 875 . 11 1 1 A 75 75 ASP N N 305 121.790 119.498 2.292 1
1 876 . 11 1 1 A 76 76 VAL H H 306 8.680 7.731 0.949 1
1 877 . 11 1 1 A 76 76 VAL HA H 306 3.890 3.616 0.274 1
1 885 . 11 1 1 A 76 76 VAL CA C 306 66.020 66.329 -0.309 1
1 886 . 11 1 1 A 76 76 VAL CB C 306 31.250 31.503 -0.253 1
1 889 . 11 1 1 A 76 76 VAL N N 306 121.150 119.877 1.273 1
1 890 . 11 1 1 A 77 77 LEU H H 307 8.470 9.180 -0.710 1
1 891 . 11 1 1 A 77 77 LEU HA H 307 3.810 4.013 -0.203 1
1 901 . 11 1 1 A 77 77 LEU CA C 307 58.330 57.538 0.792 1
1 902 . 11 1 1 A 77 77 LEU CB C 307 41.250 41.064 0.186 1
1 906 . 11 1 1 A 77 77 LEU N N 307 120.830 120.492 0.338 1
1 907 . 11 1 1 A 78 78 ALA H H 308 8.280 8.343 -0.063 1
1 908 . 11 1 1 A 78 78 ALA HA H 308 4.320 4.094 0.226 1
1 912 . 11 1 1 A 78 78 ALA CA C 308 55.420 54.855 0.565 1
1 913 . 11 1 1 A 78 78 ALA CB C 308 17.750 17.913 -0.163 1
1 914 . 11 1 1 A 78 78 ALA N N 308 122.530 121.434 1.096 1
1 915 . 11 1 1 A 79 79 SER H H 309 7.900 7.656 0.244 1
1 916 . 11 1 1 A 79 79 SER HA H 309 4.340 4.366 -0.026 1
1 919 . 11 1 1 A 79 79 SER CA C 309 61.350 60.069 1.281 1
1 920 . 11 1 1 A 79 79 SER CB C 309 63.280 63.624 -0.344 1
1 921 . 11 1 1 A 79 79 SER N N 309 115.600 113.315 2.285 1
1 922 . 11 1 1 A 80 80 ARG H H 310 7.450 8.106 -0.656 1
1 923 . 11 1 1 A 80 80 ARG HA H 310 4.550 3.997 0.553 1
1 931 . 11 1 1 A 80 80 ARG CA C 310 54.200 57.439 -3.239 1
1 932 . 11 1 1 A 80 80 ARG CB C 310 30.680 27.643 3.037 1
1 935 . 11 1 1 A 80 80 ARG N N 310 119.360 117.606 1.754 1
1 936 . 11 1 1 A 81 81 GLY H H 311 7.940 8.147 -0.207 1
1 937 . 11 1 1 A 81 81 GLY HA2 H 311 3.840 3.838 0.002 1
1 938 . 11 1 1 A 81 81 GLY HA3 H 311 4.070 3.859 0.211 1
1 939 . 11 1 1 A 81 81 GLY CA C 311 46.060 45.943 0.117 1
1 940 . 11 1 1 A 81 81 GLY N N 311 108.130 107.242 0.888 1
1 941 . 11 1 1 A 82 82 LEU H H 312 7.920 7.751 0.169 1
1 942 . 11 1 1 A 82 82 LEU HA H 312 4.680 4.741 -0.061 1
1 952 . 11 1 1 A 82 82 LEU CA C 312 53.070 53.252 -0.182 1
1 953 . 11 1 1 A 82 82 LEU CB C 312 45.790 45.260 0.530 1
1 957 . 11 1 1 A 82 82 LEU N N 312 119.290 120.872 -1.582 1
1 958 . 11 1 1 A 83 83 SER H H 313 7.530 8.529 -0.999 1
1 959 . 11 1 1 A 83 83 SER HA H 313 4.450 4.568 -0.118 1
1 962 . 11 1 1 A 83 83 SER CA C 313 57.190 59.103 -1.913 1
1 963 . 11 1 1 A 83 83 SER CB C 313 66.080 63.888 2.192 1
1 964 . 11 1 1 A 83 83 SER N N 313 113.120 116.585 -3.465 1
1 965 . 11 1 1 A 84 84 LEU H H 314 8.340 8.892 -0.552 1
1 966 . 11 1 1 A 84 84 LEU HA H 314 4.620 4.012 0.608 1
1 976 . 11 1 1 A 84 84 LEU CA C 314 54.720 56.134 -1.414 1
1 977 . 11 1 1 A 84 84 LEU CB C 314 41.620 40.183 1.437 1
1 981 . 11 1 1 A 84 84 LEU N N 314 115.930 120.147 -4.217 1
1 982 . 11 1 1 A 85 85 GLY H H 315 8.270 8.694 -0.424 1
1 983 . 11 1 1 A 85 85 GLY HA2 H 315 3.320 3.929 -0.609 1
1 984 . 11 1 1 A 85 85 GLY HA3 H 315 3.850 3.930 -0.080 1
1 985 . 11 1 1 A 85 85 GLY CA C 315 46.560 46.989 -0.429 1
1 986 . 11 1 1 A 85 85 GLY N N 315 111.010 104.866 6.144 1
1 987 . 11 1 1 A 86 86 MET H H 316 8.650 7.667 0.983 1
1 988 . 11 1 1 A 86 86 MET HA H 316 3.990 4.542 -0.552 1
1 996 . 11 1 1 A 86 86 MET CA C 316 56.730 56.186 0.544 1
1 997 . 11 1 1 A 86 86 MET CB C 316 33.600 33.667 -0.067 1
1 1000 . 11 1 1 A 86 86 MET N N 316 120.570 119.058 1.512 1
1 1001 . 11 1 1 A 87 87 ARG H H 317 8.360 8.552 -0.192 1
1 1002 . 11 1 1 A 87 87 ARG HA H 317 4.450 5.276 -0.826 1
1 1010 . 11 1 1 A 87 87 ARG CA C 317 55.310 54.626 0.684 1
1 1011 . 11 1 1 A 87 87 ARG CB C 317 30.490 33.600 -3.110 1
1 1014 . 11 1 1 A 87 87 ARG N N 317 122.290 119.399 2.891 1
1 1015 . 11 1 1 A 88 88 LEU H H 318 8.400 8.779 -0.379 1
1 1016 . 11 1 1 A 88 88 LEU HA H 318 4.670 4.947 -0.277 1
1 1026 . 11 1 1 A 88 88 LEU CA C 318 53.110 53.365 -0.255 1
1 1027 . 11 1 1 A 88 88 LEU CB C 318 43.600 45.674 -2.074 1
1 1031 . 11 1 1 A 88 88 LEU N N 318 126.420 125.225 1.195 1
1 1032 . 11 1 1 A 89 89 GLU H H 319 8.780 8.992 -0.212 1
1 1033 . 11 1 1 A 89 89 GLU HA H 319 4.340 3.997 0.343 1
1 1038 . 11 1 1 A 89 89 GLU CA C 319 56.490 59.480 -2.990 1
1 1039 . 11 1 1 A 89 89 GLU CB C 319 30.470 29.501 0.969 1
1 1041 . 11 1 1 A 89 89 GLU N N 319 123.070 123.891 -0.821 1
1 1042 . 11 1 1 A 90 90 ASN H H 320 8.900 8.587 0.313 1
1 1043 . 11 1 1 A 90 90 ASN HA H 320 4.410 5.126 -0.716 1
1 1048 . 11 1 1 A 90 90 ASN CA C 320 54.120 55.096 -0.976 1
1 1049 . 11 1 1 A 90 90 ASN CB C 320 37.640 41.605 -3.965 1
1 1050 . 11 1 1 A 90 90 ASN N N 320 116.540 115.514 1.026 1
1 1052 . 11 1 1 A 91 91 TRP H H 321 7.990 7.362 0.628 1
1 1053 . 11 1 1 A 91 91 TRP HA H 321 4.330 4.661 -0.331 1
1 1062 . 11 1 1 A 91 91 TRP CA C 321 54.590 58.359 -3.769 1
1 1063 . 11 1 1 A 91 91 TRP CB C 321 31.280 31.078 0.202 1
1 1069 . 11 1 1 A 91 91 TRP N N 321 119.230 118.116 1.114 1
1 1071 . 11 1 1 A 92 92 PRO HA H 322 4.800 3.785 1.015 1
1 1077 . 11 1 1 A 93 93 PRO HA H 323 4.450 4.446 0.004 1
1 1084 . 11 1 1 A 93 93 PRO CA C 323 61.970 62.294 -0.324 1
1 1085 . 11 1 1 A 93 93 PRO CB C 323 32.830 32.476 0.354 1
1 1088 . 11 1 1 A 94 94 ALA H H 324 8.460 8.729 -0.269 1
1 1089 . 11 1 1 A 94 94 ALA HA H 324 4.000 3.990 0.010 1
1 1093 . 11 1 1 A 94 94 ALA CA C 324 53.790 54.682 -0.892 1
1 1094 . 11 1 1 A 94 94 ALA CB C 324 18.640 18.144 0.496 1
1 1095 . 11 1 1 A 94 94 ALA N N 324 124.010 126.195 -2.185 1
1 1096 . 11 1 1 A 95 95 SER H H 325 7.950 7.916 0.034 1
1 1097 . 11 1 1 A 95 95 SER HA H 325 4.210 4.201 0.009 1
1 1100 . 11 1 1 A 95 95 SER CA C 325 58.970 61.531 -2.561 1
1 1101 . 11 1 1 A 95 95 SER CB C 325 63.040 63.019 0.021 1
1 1102 . 11 1 1 A 95 95 SER N N 325 111.520 113.033 -1.513 1
1 1103 . 11 1 1 A 96 96 ILE H H 326 7.480 7.584 -0.104 1
1 1104 . 11 1 1 A 96 96 ILE HA H 326 4.170 3.746 0.424 1
1 1114 . 11 1 1 A 96 96 ILE CA C 326 61.300 65.692 -4.392 1
1 1115 . 11 1 1 A 96 96 ILE CB C 326 38.530 37.361 1.169 1
1 1119 . 11 1 1 A 96 96 ILE N N 326 119.650 121.364 -1.714 1
1 1120 . 11 1 1 A 97 97 ALA H H 327 7.860 8.281 -0.421 1
1 1121 . 11 1 1 A 97 97 ALA HA H 327 4.230 3.991 0.239 1
1 1125 . 11 1 1 A 97 97 ALA CA C 327 52.570 55.206 -2.636 1
1 1126 . 11 1 1 A 97 97 ALA CB C 327 19.590 17.982 1.608 1
1 1127 . 11 1 1 A 97 97 ALA N N 327 126.480 121.380 5.100 1
1 1128 . 11 1 1 A 98 98 ASP H H 328 8.250 7.849 0.401 1
1 1129 . 11 1 1 A 98 98 ASP HA H 328 4.540 4.301 0.239 1
1 1132 . 11 1 1 A 98 98 ASP CA C 328 54.150 57.270 -3.120 1
1 1133 . 11 1 1 A 98 98 ASP CB C 328 41.120 40.163 0.957 1
1 1134 . 11 1 1 A 98 98 ASP N N 328 120.130 119.032 1.098 1
1 1150 . 11 2 2 B 6 6 ASP H H 427 8.160 8.090 0.070 1
1 1151 . 11 2 2 B 6 6 ASP HA H 427 4.630 4.345 0.285 1
1 1154 . 11 2 2 B 6 6 ASP CA C 427 54.410 56.711 -2.301 1
1 1155 . 11 2 2 B 6 6 ASP CB C 427 41.250 40.398 0.852 1
1 1156 . 11 2 2 B 6 6 ASP N N 427 120.160 121.004 -0.844 1
1 1157 . 11 2 2 B 7 7 ASN H H 428 8.350 7.752 0.598 1
1 1158 . 11 2 2 B 7 7 ASN HA H 428 4.550 4.914 -0.364 1
1 1163 . 11 2 2 B 7 7 ASN CA C 428 53.310 53.111 0.199 1
1 1164 . 11 2 2 B 7 7 ASN CB C 428 38.850 38.629 0.221 1
1 1165 . 11 2 2 B 7 7 ASN N N 428 118.440 114.961 3.479 1
1 1167 . 11 2 2 B 8 8 LYS H H 429 8.030 7.672 0.358 1
1 1172 . 11 2 2 B 8 8 LYS CB C 429 33.280 33.428 -0.148 1
1 1174 . 11 2 2 B 8 8 LYS N N 429 120.260 122.210 -1.950 1
1 1175 . 11 2 2 B 9 9 PRO HA H 430 4.420 4.536 -0.116 1
1 1182 . 11 2 2 B 9 9 PRO CA C 430 62.280 62.649 -0.369 1
1 1183 . 11 2 2 B 9 9 PRO CB C 430 31.920 32.481 -0.561 1
1 1186 . 11 2 2 B 10 10 ALA H H 431 8.930 8.207 0.723 1
1 1187 . 11 2 2 B 10 10 ALA HA H 431 4.350 4.456 -0.106 1
1 1191 . 11 2 2 B 10 10 ALA CA C 431 51.070 52.561 -1.491 1
1 1192 . 11 2 2 B 10 10 ALA CB C 431 20.920 19.257 1.663 1
1 1193 . 11 2 2 B 10 10 ALA N N 431 125.000 124.771 0.229 1
1 1194 . 11 2 2 B 11 11 ASP H H 432 8.530 9.100 -0.570 1
1 1195 . 11 2 2 B 11 11 ASP HA H 432 4.220 4.263 -0.043 1
1 1198 . 11 2 2 B 11 11 ASP CA C 432 57.520 57.429 0.091 1
1 1199 . 11 2 2 B 11 11 ASP CB C 432 40.470 40.267 0.203 1
1 1200 . 11 2 2 B 11 11 ASP N N 432 119.610 123.069 -3.459 1
1 1201 . 11 2 2 B 12 12 ASP H H 433 8.340 7.941 0.399 1
1 1202 . 11 2 2 B 12 12 ASP HA H 433 4.160 4.434 -0.274 1
1 1205 . 11 2 2 B 12 12 ASP CA C 433 56.090 57.369 -1.279 1
1 1206 . 11 2 2 B 12 12 ASP CB C 433 38.960 41.047 -2.087 1
1 1207 . 11 2 2 B 12 12 ASP N N 433 116.330 120.253 -3.923 1
1 1208 . 11 2 2 B 13 13 LEU H H 434 7.360 7.496 -0.136 1
1 1209 . 11 2 2 B 13 13 LEU HA H 434 4.050 4.083 -0.033 1
1 1219 . 11 2 2 B 13 13 LEU CA C 434 57.340 57.819 -0.479 1
1 1220 . 11 2 2 B 13 13 LEU CB C 434 42.960 41.650 1.310 1
1 1224 . 11 2 2 B 13 13 LEU N N 434 123.440 120.848 2.592 1
1 1225 . 11 2 2 B 14 14 LEU H H 435 7.670 8.376 -0.706 1
1 1226 . 11 2 2 B 14 14 LEU HA H 435 3.710 4.047 -0.337 1
1 1236 . 11 2 2 B 14 14 LEU CA C 435 57.170 57.697 -0.527 1
1 1237 . 11 2 2 B 14 14 LEU CB C 435 42.590 41.166 1.424 1
1 1241 . 11 2 2 B 14 14 LEU N N 435 115.170 119.677 -4.507 1
1 1242 . 11 2 2 B 15 15 ASN H H 436 7.490 7.911 -0.421 1
1 1243 . 11 2 2 B 15 15 ASN HA H 436 4.640 4.813 -0.173 1
1 1248 . 11 2 2 B 15 15 ASN CA C 436 52.920 53.259 -0.339 1
1 1249 . 11 2 2 B 15 15 ASN CB C 436 39.350 39.193 0.157 1
1 1250 . 11 2 2 B 15 15 ASN N N 436 112.280 115.049 -2.769 1
1 1252 . 11 2 2 B 16 16 LEU H H 437 7.300 7.108 0.192 1
1 1253 . 11 2 2 B 16 16 LEU HA H 437 4.100 4.204 -0.104 1
1 1263 . 11 2 2 B 16 16 LEU CA C 437 55.310 55.254 0.056 1
1 1264 . 11 2 2 B 16 16 LEU CB C 437 41.800 43.070 -1.270 1
1 1268 . 11 2 2 B 16 16 LEU N N 437 125.180 122.923 2.257 1
1 1269 . 11 2 2 B 17 17 GLU H H 438 8.590 8.739 -0.149 1
1 1270 . 11 2 2 B 17 17 GLU HA H 438 3.920 4.070 -0.150 1
1 1275 . 11 2 2 B 17 17 GLU CA C 438 58.440 57.920 0.520 1
1 1276 . 11 2 2 B 17 17 GLU CB C 438 29.180 29.733 -0.553 1
1 1278 . 11 2 2 B 17 17 GLU N N 438 129.850 125.866 3.984 1
1 1279 . 11 2 2 B 18 18 GLY H H 439 8.580 8.831 -0.251 1
1 1280 . 11 2 2 B 18 18 GLY HA2 H 439 3.570 3.915 -0.345 1
1 1281 . 11 2 2 B 18 18 GLY HA3 H 439 4.220 3.915 0.305 1
1 1282 . 11 2 2 B 18 18 GLY CA C 439 44.710 45.422 -0.712 1
1 1283 . 11 2 2 B 18 18 GLY N N 439 112.250 114.772 -2.522 1
1 1284 . 11 2 2 B 19 19 VAL H H 440 7.900 7.739 0.161 1
1 1285 . 11 2 2 B 19 19 VAL HA H 440 3.950 4.415 -0.465 1
1 1293 . 11 2 2 B 19 19 VAL CA C 440 62.820 60.816 2.004 1
1 1294 . 11 2 2 B 19 19 VAL CB C 440 31.470 34.382 -2.912 1
1 1297 . 11 2 2 B 19 19 VAL N N 440 121.910 121.735 0.175 1
1 1298 . 11 2 2 B 20 20 ASP H H 441 7.390 8.781 -1.391 1
1 1299 . 11 2 2 B 20 20 ASP HA H 441 4.820 4.751 0.069 1
1 1302 . 11 2 2 B 20 20 ASP CA C 441 51.920 53.539 -1.619 1
1 1303 . 11 2 2 B 20 20 ASP CB C 441 42.090 41.465 0.625 1
1 1304 . 11 2 2 B 20 20 ASP N N 441 124.850 125.827 -0.977 1
1 1305 . 11 2 2 B 21 21 ARG H H 442 8.630 8.713 -0.083 1
1 1306 . 11 2 2 B 21 21 ARG HA H 442 3.810 3.558 0.252 1
1 1313 . 11 2 2 B 21 21 ARG CA C 442 60.710 59.700 1.010 1
1 1314 . 11 2 2 B 21 21 ARG CB C 442 30.020 29.801 0.219 1
1 1317 . 11 2 2 B 21 21 ARG N N 442 120.890 122.630 -1.740 1
1 1318 . 11 2 2 B 22 22 ASP H H 443 8.140 7.872 0.268 1
1 1319 . 11 2 2 B 22 22 ASP HA H 443 4.420 4.156 0.264 1
1 1322 . 11 2 2 B 22 22 ASP CA C 443 57.680 56.851 0.829 1
1 1323 . 11 2 2 B 22 22 ASP CB C 443 40.880 40.581 0.299 1
1 1324 . 11 2 2 B 22 22 ASP N N 443 116.750 119.591 -2.841 1
1 1325 . 11 2 2 B 23 23 LEU H H 444 8.170 7.734 0.436 1
1 1326 . 11 2 2 B 23 23 LEU HA H 444 4.130 4.032 0.098 1
1 1336 . 11 2 2 B 23 23 LEU CA C 444 57.770 57.911 -0.141 1
1 1337 . 11 2 2 B 23 23 LEU CB C 444 41.230 41.045 0.185 1
1 1341 . 11 2 2 B 23 23 LEU N N 444 122.130 121.493 0.637 1
1 1342 . 11 2 2 B 24 24 ALA H H 445 8.630 8.354 0.276 1
1 1343 . 11 2 2 B 24 24 ALA HA H 445 3.790 4.010 -0.220 1
1 1347 . 11 2 2 B 24 24 ALA CA C 445 55.810 54.238 1.572 1
1 1348 . 11 2 2 B 24 24 ALA CB C 445 18.060 18.172 -0.112 1
1 1349 . 11 2 2 B 24 24 ALA N N 445 120.890 120.745 0.145 1
1 1350 . 11 2 2 B 25 25 PHE H H 446 8.160 7.435 0.725 1
1 1351 . 11 2 2 B 25 25 PHE HA H 446 4.080 4.296 -0.216 1
1 1358 . 11 2 2 B 25 25 PHE CA C 446 62.670 61.847 0.823 1
1 1359 . 11 2 2 B 25 25 PHE CB C 446 39.440 38.573 0.867 1
1 1364 . 11 2 2 B 25 25 PHE N N 446 115.360 116.365 -1.005 1
1 1365 . 11 2 2 B 26 26 LYS H H 447 8.040 7.588 0.452 1
1 1366 . 11 2 2 B 26 26 LYS HA H 447 4.110 3.997 0.113 1
1 1375 . 11 2 2 B 26 26 LYS CA C 447 60.140 59.032 1.108 1
1 1376 . 11 2 2 B 26 26 LYS CB C 447 32.880 32.351 0.529 1
1 1380 . 11 2 2 B 26 26 LYS N N 447 123.110 118.431 4.679 1
1 1381 . 11 2 2 B 27 27 LEU H H 448 8.630 8.128 0.502 1
1 1382 . 11 2 2 B 27 27 LEU HA H 448 3.840 3.960 -0.120 1
1 1392 . 11 2 2 B 27 27 LEU CA C 448 58.210 57.844 0.366 1
1 1393 . 11 2 2 B 27 27 LEU CB C 448 39.760 41.637 -1.877 1
1 1396 . 11 2 2 B 27 27 LEU N N 448 120.890 120.225 0.665 1
1 1397 . 11 2 2 B 28 28 ALA H H 449 8.200 8.333 -0.133 1
1 1398 . 11 2 2 B 28 28 ALA HA H 449 3.760 4.506 -0.746 1
1 1402 . 11 2 2 B 28 28 ALA CA C 449 54.750 55.357 -0.607 1
1 1403 . 11 2 2 B 28 28 ALA CB C 449 18.050 18.305 -0.255 1
1 1404 . 11 2 2 B 28 28 ALA N N 449 123.710 121.564 2.146 1
1 1405 . 11 2 2 B 29 29 ALA H H 450 7.780 7.788 -0.008 1
1 1406 . 11 2 2 B 29 29 ALA HA H 450 4.170 4.037 0.133 1
1 1410 . 11 2 2 B 29 29 ALA CA C 450 54.430 55.106 -0.676 1
1 1411 . 11 2 2 B 29 29 ALA CB C 450 18.040 18.607 -0.567 1
1 1412 . 11 2 2 B 29 29 ALA N N 450 121.020 119.065 1.955 1
1 1413 . 11 2 2 B 30 30 ARG H H 451 7.390 7.544 -0.154 1
1 1414 . 11 2 2 B 30 30 ARG HA H 451 4.540 4.402 0.138 1
1 1421 . 11 2 2 B 30 30 ARG CA C 451 54.510 55.729 -1.219 1
1 1422 . 11 2 2 B 30 30 ARG CB C 451 29.950 29.677 0.273 1
1 1425 . 11 2 2 B 30 30 ARG N N 451 115.480 115.956 -0.476 1
1 1426 . 11 2 2 B 31 31 GLY H H 452 7.950 8.872 -0.922 1
1 1427 . 11 2 2 B 31 31 GLY HA2 H 452 3.550 4.002 -0.452 1
1 1428 . 11 2 2 B 31 31 GLY HA3 H 452 4.200 4.004 0.196 1
1 1429 . 11 2 2 B 31 31 GLY CA C 452 45.380 45.435 -0.055 1
1 1430 . 11 2 2 B 31 31 GLY N N 452 107.740 107.490 0.250 1
1 1431 . 11 2 2 B 32 32 VAL H H 453 7.990 7.628 0.362 1
1 1432 . 11 2 2 B 32 32 VAL HA H 453 3.930 4.036 -0.106 1
1 1440 . 11 2 2 B 32 32 VAL CA C 453 61.420 62.935 -1.515 1
1 1441 . 11 2 2 B 32 32 VAL CB C 453 29.860 31.243 -1.383 1
1 1444 . 11 2 2 B 32 32 VAL N N 453 125.560 121.105 4.455 1
1 1445 . 11 2 2 B 33 33 CYS H H 454 8.460 8.532 -0.072 1
1 1446 . 11 2 2 B 33 33 CYS HA H 454 4.310 4.720 -0.410 1
1 1449 . 11 2 2 B 33 33 CYS CA C 454 60.260 59.545 0.715 1
1 1450 . 11 2 2 B 33 33 CYS CB C 454 30.330 30.145 0.185 1
1 1451 . 11 2 2 B 33 33 CYS N N 454 119.460 126.413 -6.953 1
1 1452 . 11 2 2 B 34 34 THR H H 455 8.080 7.708 0.372 1
1 1453 . 11 2 2 B 34 34 THR HA H 455 4.840 4.335 0.505 1
1 1458 . 11 2 2 B 34 34 THR CA C 455 58.650 63.451 -4.801 1
1 1459 . 11 2 2 B 34 34 THR CB C 455 72.680 69.276 3.404 1
1 1461 . 11 2 2 B 34 34 THR N N 455 108.420 115.139 -6.719 1
1 1462 . 11 2 2 B 35 35 LEU H H 456 8.580 8.722 -0.142 1
1 1463 . 11 2 2 B 35 35 LEU HA H 456 3.790 3.994 -0.204 1
1 1473 . 11 2 2 B 35 35 LEU CA C 456 57.980 58.632 -0.652 1
1 1474 . 11 2 2 B 35 35 LEU CB C 456 42.220 41.241 0.979 1
1 1477 . 11 2 2 B 35 35 LEU N N 456 120.370 128.221 -7.851 1
1 1478 . 11 2 2 B 36 36 GLU H H 457 8.390 8.144 0.246 1
1 1479 . 11 2 2 B 36 36 GLU HA H 457 3.820 3.905 -0.085 1
1 1484 . 11 2 2 B 36 36 GLU CA C 457 59.640 59.885 -0.245 1
1 1485 . 11 2 2 B 36 36 GLU CB C 457 28.780 29.282 -0.502 1
1 1487 . 11 2 2 B 36 36 GLU N N 457 119.450 118.778 0.672 1
1 1488 . 11 2 2 B 37 37 ASP H H 458 7.750 7.884 -0.134 1
1 1489 . 11 2 2 B 37 37 ASP HA H 458 4.140 4.385 -0.245 1
1 1492 . 11 2 2 B 37 37 ASP CA C 458 57.150 57.326 -0.176 1
1 1493 . 11 2 2 B 37 37 ASP CB C 458 42.280 40.774 1.506 1
1 1494 . 11 2 2 B 37 37 ASP N N 458 117.430 119.864 -2.434 1
1 1495 . 11 2 2 B 38 38 LEU H H 459 7.700 7.933 -0.233 1
1 1496 . 11 2 2 B 38 38 LEU HA H 459 3.790 4.131 -0.341 1
1 1506 . 11 2 2 B 38 38 LEU CA C 459 58.080 57.809 0.271 1
1 1507 . 11 2 2 B 38 38 LEU CB C 459 41.130 41.362 -0.232 1
1 1511 . 11 2 2 B 38 38 LEU N N 459 121.280 121.726 -0.446 1
1 1512 . 11 2 2 B 39 39 ALA H H 460 8.190 8.407 -0.217 1
1 1513 . 11 2 2 B 39 39 ALA HA H 460 3.640 3.966 -0.326 1
1 1517 . 11 2 2 B 39 39 ALA CA C 460 54.320 55.330 -1.010 1
1 1518 . 11 2 2 B 39 39 ALA CB C 460 17.140 17.980 -0.840 1
1 1519 . 11 2 2 B 39 39 ALA N N 460 119.400 120.077 -0.677 1
1 1520 . 11 2 2 B 40 40 GLU H H 461 7.340 7.785 -0.445 1
1 1521 . 11 2 2 B 40 40 GLU HA H 461 4.180 4.226 -0.046 1
1 1526 . 11 2 2 B 40 40 GLU CA C 461 57.800 59.097 -1.297 1
1 1527 . 11 2 2 B 40 40 GLU CB C 461 30.600 29.512 1.088 1
1 1529 . 11 2 2 B 40 40 GLU N N 461 110.680 115.773 -5.093 1
1 1530 . 11 2 2 B 41 41 GLN H H 462 7.940 7.659 0.281 1
1 1531 . 11 2 2 B 41 41 GLN HA H 462 4.100 4.420 -0.320 1
1 1538 . 11 2 2 B 41 41 GLN CA C 462 55.310 56.513 -1.203 1
1 1539 . 11 2 2 B 41 41 GLN CB C 462 28.780 29.501 -0.721 1
1 1541 . 11 2 2 B 41 41 GLN N N 462 120.720 117.769 2.951 1
1 1543 . 11 2 2 B 42 42 GLY H H 463 9.000 8.624 0.376 1
1 1544 . 11 2 2 B 42 42 GLY HA2 H 463 3.310 4.293 -0.983 1
1 1545 . 11 2 2 B 42 42 GLY HA3 H 463 4.820 4.296 0.524 1
1 1546 . 11 2 2 B 42 42 GLY CA C 463 42.650 43.816 -1.166 1
1 1547 . 11 2 2 B 42 42 GLY N N 463 104.110 108.116 -4.006 1
1 1548 . 11 2 2 B 43 43 ILE H H 464 7.900 8.767 -0.867 1
1 1549 . 11 2 2 B 43 43 ILE HA H 464 3.260 3.686 -0.426 1
1 1558 . 11 2 2 B 43 43 ILE CA C 464 66.570 64.356 2.214 1
1 1559 . 11 2 2 B 43 43 ILE CB C 464 38.770 37.483 1.287 1
1 1562 . 11 2 2 B 43 43 ILE N N 464 119.410 120.247 -0.837 1
1 1563 . 11 2 2 B 44 44 ASP H H 465 8.730 8.291 0.439 1
1 1564 . 11 2 2 B 44 44 ASP HA H 465 4.310 4.333 -0.023 1
1 1567 . 11 2 2 B 44 44 ASP CA C 465 56.740 57.420 -0.680 1
1 1568 . 11 2 2 B 44 44 ASP CB C 465 40.120 40.901 -0.781 1
1 1569 . 11 2 2 B 44 44 ASP N N 465 116.610 122.261 -5.651 1
1 1570 . 11 2 2 B 45 45 ASP H H 466 7.720 7.986 -0.266 1
1 1571 . 11 2 2 B 45 45 ASP HA H 466 4.480 4.478 0.002 1
1 1574 . 11 2 2 B 45 45 ASP CA C 466 57.000 57.141 -0.141 1
1 1575 . 11 2 2 B 45 45 ASP CB C 466 42.270 40.859 1.411 1
1 1576 . 11 2 2 B 45 45 ASP N N 466 117.560 117.940 -0.380 1
1 1577 . 11 2 2 B 46 46 LEU H H 467 7.370 8.155 -0.785 1
1 1578 . 11 2 2 B 46 46 LEU HA H 467 4.410 4.158 0.252 1
1 1587 . 11 2 2 B 46 46 LEU CA C 467 53.660 57.542 -3.882 1
1 1588 . 11 2 2 B 46 46 LEU CB C 467 42.260 41.269 0.991 1
1 1591 . 11 2 2 B 46 46 LEU N N 467 116.890 120.829 -3.939 1
1 1592 . 11 2 2 B 47 47 ALA H H 468 7.080 8.270 -1.190 1
1 1593 . 11 2 2 B 47 47 ALA HA H 468 4.120 4.073 0.047 1
1 1597 . 11 2 2 B 47 47 ALA CA C 468 54.130 54.588 -0.458 1
1 1598 . 11 2 2 B 47 47 ALA CB C 468 19.480 18.501 0.979 1
1 1599 . 11 2 2 B 47 47 ALA N N 468 120.150 122.303 -2.153 1
1 1600 . 11 2 2 B 48 48 ASP H H 469 8.560 8.127 0.433 1
1 1601 . 11 2 2 B 48 48 ASP HA H 469 4.410 4.488 -0.078 1
1 1604 . 11 2 2 B 48 48 ASP CA C 469 54.330 57.364 -3.034 1
1 1605 . 11 2 2 B 48 48 ASP CB C 469 39.760 40.674 -0.914 1
1 1606 . 11 2 2 B 48 48 ASP N N 469 114.660 116.114 -1.454 1
1 1607 . 11 2 2 B 49 49 ILE H H 470 7.870 7.434 0.436 1
1 1608 . 11 2 2 B 49 49 ILE HA H 470 3.850 4.097 -0.247 1
1 1618 . 11 2 2 B 49 49 ILE CA C 470 61.680 61.198 0.482 1
1 1619 . 11 2 2 B 49 49 ILE CB C 470 37.120 38.088 -0.968 1
1 1623 . 11 2 2 B 49 49 ILE N N 470 121.600 119.912 1.688 1
1 1624 . 11 2 2 B 50 50 GLU H H 471 8.680 8.902 -0.222 1
1 1625 . 11 2 2 B 50 50 GLU HA H 471 3.940 3.950 -0.010 1
1 1630 . 11 2 2 B 50 50 GLU CA C 471 58.360 58.434 -0.074 1
1 1631 . 11 2 2 B 50 50 GLU CB C 471 29.530 29.770 -0.240 1
1 1633 . 11 2 2 B 50 50 GLU N N 471 131.000 126.802 4.198 1
1 1634 . 11 2 2 B 51 51 GLY H H 472 8.860 8.912 -0.052 1
1 1635 . 11 2 2 B 51 51 GLY HA2 H 472 3.640 3.974 -0.334 1
1 1636 . 11 2 2 B 51 51 GLY HA3 H 472 4.230 3.974 0.256 1
1 1637 . 11 2 2 B 51 51 GLY CA C 472 45.190 45.081 0.109 1
1 1638 . 11 2 2 B 51 51 GLY N N 472 113.580 112.274 1.306 1
1 1639 . 11 2 2 B 52 52 LEU H H 473 7.850 7.402 0.448 1
1 1640 . 11 2 2 B 52 52 LEU HA H 473 4.680 4.324 0.356 1
1 1650 . 11 2 2 B 52 52 LEU CA C 473 53.640 54.343 -0.703 1
1 1651 . 11 2 2 B 52 52 LEU CB C 473 42.990 41.553 1.437 1
1 1655 . 11 2 2 B 52 52 LEU N N 473 123.020 122.300 0.720 1
1 1656 . 11 2 2 B 53 53 THR H H 474 7.550 8.814 -1.264 1
1 1657 . 11 2 2 B 53 53 THR HA H 474 4.560 4.745 -0.185 1
1 1662 . 11 2 2 B 53 53 THR CA C 474 60.060 60.907 -0.847 1
1 1663 . 11 2 2 B 53 53 THR CB C 474 71.520 71.307 0.213 1
1 1665 . 11 2 2 B 53 53 THR N N 474 115.070 119.037 -3.967 1
1 1666 . 11 2 2 B 54 54 ASP H H 475 8.900 9.040 -0.140 1
1 1667 . 11 2 2 B 54 54 ASP HA H 475 4.220 4.297 -0.077 1
1 1670 . 11 2 2 B 54 54 ASP CA C 475 57.520 57.858 -0.338 1
1 1671 . 11 2 2 B 54 54 ASP CB C 475 39.560 40.218 -0.658 1
1 1672 . 11 2 2 B 54 54 ASP N N 475 121.800 123.825 -2.025 1
1 1673 . 11 2 2 B 55 55 GLU H H 476 8.460 7.975 0.485 1
1 1674 . 11 2 2 B 55 55 GLU HA H 476 3.970 4.021 -0.051 1
1 1679 . 11 2 2 B 55 55 GLU CA C 476 59.440 59.051 0.389 1
1 1680 . 11 2 2 B 55 55 GLU CB C 476 29.650 29.493 0.157 1
1 1682 . 11 2 2 B 55 55 GLU N N 476 119.460 119.544 -0.084 1
1 1683 . 11 2 2 B 56 56 LYS H H 477 7.790 7.994 -0.204 1
1 1684 . 11 2 2 B 56 56 LYS HA H 477 4.120 4.073 0.047 1
1 1693 . 11 2 2 B 56 56 LYS CA C 477 58.890 59.516 -0.626 1
1 1694 . 11 2 2 B 56 56 LYS CB C 477 32.600 32.273 0.327 1
1 1698 . 11 2 2 B 56 56 LYS N N 477 121.840 119.800 2.040 1
1 1699 . 11 2 2 B 57 57 ALA H H 478 8.900 9.002 -0.102 1
1 1700 . 11 2 2 B 57 57 ALA HA H 478 3.790 4.061 -0.271 1
1 1704 . 11 2 2 B 57 57 ALA CA C 478 55.810 55.348 0.462 1
1 1705 . 11 2 2 B 57 57 ALA CB C 478 18.590 18.229 0.361 1
1 1706 . 11 2 2 B 57 57 ALA N N 478 121.350 121.608 -0.258 1
1 1707 . 11 2 2 B 58 58 GLY H H 479 8.300 8.089 0.211 1
1 1708 . 11 2 2 B 58 58 GLY HA2 H 479 3.500 3.781 -0.281 1
1 1709 . 11 2 2 B 58 58 GLY HA3 H 479 3.890 3.784 0.106 1
1 1710 . 11 2 2 B 58 58 GLY CA C 479 47.360 47.282 0.078 1
1 1711 . 11 2 2 B 58 58 GLY N N 479 102.040 107.871 -5.831 1
1 1712 . 11 2 2 B 59 59 ALA H H 480 7.580 8.090 -0.510 1
1 1713 . 11 2 2 B 59 59 ALA HA H 480 4.110 4.012 0.098 1
1 1717 . 11 2 2 B 59 59 ALA CA C 480 55.580 54.892 0.688 1
1 1718 . 11 2 2 B 59 59 ALA CB C 480 18.130 17.803 0.327 1
1 1719 . 11 2 2 B 59 59 ALA N N 480 123.180 124.018 -0.838 1
1 1720 . 11 2 2 B 60 60 LEU H H 481 8.290 8.014 0.276 1
1 1721 . 11 2 2 B 60 60 LEU HA H 481 4.020 3.927 0.093 1
1 1731 . 11 2 2 B 60 60 LEU CA C 481 57.850 58.029 -0.179 1
1 1732 . 11 2 2 B 60 60 LEU CB C 481 42.360 41.423 0.937 1
1 1736 . 11 2 2 B 60 60 LEU N N 481 120.560 117.781 2.779 1
1 1737 . 11 2 2 B 61 61 ILE H H 482 8.080 7.993 0.087 1
1 1738 . 11 2 2 B 61 61 ILE HA H 482 3.210 3.439 -0.229 1
1 1748 . 11 2 2 B 61 61 ILE CA C 482 66.250 65.042 1.208 1
1 1749 . 11 2 2 B 61 61 ILE CB C 482 39.400 38.210 1.190 1
1 1753 . 11 2 2 B 61 61 ILE N N 482 119.170 120.504 -1.334 1
1 1754 . 11 2 2 B 62 62 MET H H 483 8.110 8.352 -0.242 1
1 1755 . 11 2 2 B 62 62 MET HA H 483 4.410 4.162 0.248 1
1 1763 . 11 2 2 B 62 62 MET CA C 483 56.110 58.827 -2.717 1
1 1764 . 11 2 2 B 62 62 MET CB C 483 28.260 32.023 -3.763 1
1 1767 . 11 2 2 B 62 62 MET N N 483 114.420 118.078 -3.658 1
1 1768 . 11 2 2 B 63 63 ALA H H 484 8.240 8.003 0.237 1
1 1769 . 11 2 2 B 63 63 ALA HA H 484 4.130 3.954 0.176 1
1 1773 . 11 2 2 B 63 63 ALA CA C 484 55.300 55.211 0.089 1
1 1774 . 11 2 2 B 63 63 ALA CB C 484 18.280 18.477 -0.197 1
1 1775 . 11 2 2 B 63 63 ALA N N 484 123.710 121.688 2.022 1
1 1776 . 11 2 2 B 64 64 ALA H H 485 8.050 8.108 -0.058 1
1 1777 . 11 2 2 B 64 64 ALA HA H 485 3.870 3.940 -0.070 1
1 1781 . 11 2 2 B 64 64 ALA CA C 485 55.330 55.291 0.039 1
1 1782 . 11 2 2 B 64 64 ALA CB C 485 17.660 18.176 -0.516 1
1 1783 . 11 2 2 B 64 64 ALA N N 485 120.070 119.530 0.540 1
1 1784 . 11 2 2 B 65 65 ARG H H 486 8.640 8.681 -0.041 1
1 1785 . 11 2 2 B 65 65 ARG HA H 486 2.800 4.101 -1.301 1
1 1792 . 11 2 2 B 65 65 ARG CA C 486 60.600 59.688 0.912 1
1 1793 . 11 2 2 B 65 65 ARG CB C 486 29.910 30.196 -0.286 1
1 1796 . 11 2 2 B 65 65 ARG N N 486 118.730 117.815 0.915 1
1 1797 . 11 2 2 B 66 66 ASN H H 487 8.710 9.093 -0.383 1
1 1798 . 11 2 2 B 66 66 ASN HA H 487 4.550 4.444 0.106 1
1 1803 . 11 2 2 B 66 66 ASN CA C 487 56.390 55.981 0.409 1
1 1804 . 11 2 2 B 66 66 ASN CB C 487 37.970 38.012 -0.042 1
1 1805 . 11 2 2 B 66 66 ASN N N 487 119.170 117.778 1.392 1
1 1807 . 11 2 2 B 67 67 ILE H H 488 7.250 7.647 -0.397 1
1 1808 . 11 2 2 B 67 67 ILE HA H 488 3.810 3.590 0.220 1
1 1818 . 11 2 2 B 67 67 ILE CA C 488 64.350 64.863 -0.513 1
1 1819 . 11 2 2 B 67 67 ILE CB C 488 39.570 37.545 2.025 1
1 1823 . 11 2 2 B 67 67 ILE N N 488 117.890 119.492 -1.602 1
1 1824 . 11 2 2 B 68 68 CYS H H 489 8.350 8.073 0.277 1
1 1825 . 11 2 2 B 68 68 CYS HA H 489 4.080 4.025 0.055 1
1 1828 . 11 2 2 B 68 68 CYS CA C 489 62.670 63.194 -0.524 1
1 1829 . 11 2 2 B 68 68 CYS CB C 489 28.170 27.633 0.537 1
1 1830 . 11 2 2 B 68 68 CYS N N 489 115.230 120.108 -4.878 1
1 1831 . 11 2 2 B 69 69 TRP H H 490 8.230 8.950 -0.720 1
1 1832 . 11 2 2 B 69 69 TRP HA H 490 5.100 4.388 0.712 1
1 1841 . 11 2 2 B 69 69 TRP CA C 490 55.420 60.905 -5.485 1
1 1842 . 11 2 2 B 69 69 TRP CB C 490 31.010 29.103 1.907 1
1 1844 . 11 2 2 B 69 69 TRP N N 490 116.850 121.139 -4.289 1
1 1846 . 11 2 2 B 70 70 PHE H H 491 7.570 8.588 -1.018 1
1 1847 . 11 2 2 B 70 70 PHE HA H 491 5.240 4.470 0.770 1
1 1852 . 11 2 2 B 70 70 PHE CA C 491 55.490 60.524 -5.034 1
1 1853 . 11 2 2 B 70 70 PHE CB C 491 38.700 37.874 0.826 1
1 1856 . 11 2 2 B 70 70 PHE N N 491 117.460 118.658 -1.198 1
1 1857 . 11 2 2 B 71 71 GLY H H 492 8.420 8.436 -0.016 1
1 1858 . 11 2 2 B 71 71 GLY HA2 H 492 3.920 3.739 0.181 1
1 1859 . 11 2 2 B 71 71 GLY HA3 H 492 4.080 3.765 0.315 1
1 1860 . 11 2 2 B 71 71 GLY CA C 492 46.210 47.031 -0.821 1
1 1861 . 11 2 2 B 71 71 GLY N N 492 110.040 107.648 2.392 1
1 1862 . 11 2 2 B 72 72 ASP H H 493 8.370 8.043 0.327 1
1 1863 . 11 2 2 B 72 72 ASP HA H 493 4.630 4.353 0.277 1
1 1866 . 11 2 2 B 72 72 ASP CA C 493 54.410 56.932 -2.522 1
1 1867 . 11 2 2 B 72 72 ASP CB C 493 41.250 40.305 0.945 1
1 1868 . 11 2 2 B 72 72 ASP N N 493 120.000 121.720 -1.720 1
1 1869 . 11 2 2 B 73 73 GLU H H 494 8.230 7.882 0.348 1
1 1870 . 11 2 2 B 73 73 GLU HA H 494 4.260 4.023 0.237 1
1 1875 . 11 2 2 B 73 73 GLU CA C 494 56.510 59.255 -2.745 1
1 1876 . 11 2 2 B 73 73 GLU CB C 494 30.420 29.415 1.005 1
1 1878 . 11 2 2 B 73 73 GLU N N 494 120.900 119.919 0.981 1
1 216 . 12 1 1 A 20 20 ASP H H 250 8.550 8.967 -0.417 1
1 217 . 12 1 1 A 20 20 ASP HA H 250 4.700 4.539 0.161 1
1 220 . 12 1 1 A 20 20 ASP CA C 250 52.650 52.919 -0.269 1
1 221 . 12 1 1 A 20 20 ASP CB C 250 41.420 40.501 0.919 1
1 222 . 12 1 1 A 20 20 ASP N N 250 125.190 125.077 0.113 1
1 223 . 12 1 1 A 21 21 PRO HA H 251 4.250 4.479 -0.229 1
1 230 . 12 1 1 A 21 21 PRO CA C 251 65.120 64.722 0.398 1
1 231 . 12 1 1 A 21 21 PRO CB C 251 32.310 32.232 0.078 1
1 234 . 12 1 1 A 22 22 ILE H H 252 8.630 7.765 0.865 1
1 235 . 12 1 1 A 22 22 ILE HA H 252 4.060 3.922 0.138 1
1 245 . 12 1 1 A 22 22 ILE CA C 252 62.990 63.032 -0.042 1
1 246 . 12 1 1 A 22 22 ILE CB C 252 37.520 37.662 -0.142 1
1 250 . 12 1 1 A 22 22 ILE N N 252 119.860 117.073 2.787 1
1 251 . 12 1 1 A 23 23 LEU H H 253 7.950 7.847 0.103 1
1 252 . 12 1 1 A 23 23 LEU HA H 253 3.710 4.070 -0.360 1
1 262 . 12 1 1 A 23 23 LEU CA C 253 56.510 57.786 -1.276 1
1 263 . 12 1 1 A 23 23 LEU CB C 253 41.190 41.733 -0.543 1
1 266 . 12 1 1 A 23 23 LEU N N 253 116.850 121.305 -4.455 1
1 267 . 12 1 1 A 24 24 LEU H H 254 7.370 7.790 -0.420 1
1 268 . 12 1 1 A 24 24 LEU HA H 254 4.310 4.337 -0.027 1
1 278 . 12 1 1 A 24 24 LEU CA C 254 54.890 57.542 -2.652 1
1 279 . 12 1 1 A 24 24 LEU CB C 254 41.960 41.875 0.085 1
1 283 . 12 1 1 A 24 24 LEU N N 254 115.210 119.127 -3.917 1
1 284 . 12 1 1 A 25 25 ARG H H 255 7.520 7.288 0.232 1
1 285 . 12 1 1 A 25 25 ARG HA H 255 4.660 4.111 0.549 1
1 293 . 12 1 1 A 25 25 ARG CA C 255 52.840 54.140 -1.300 1
1 294 . 12 1 1 A 25 25 ARG CB C 255 28.130 30.621 -2.491 1
1 297 . 12 1 1 A 25 25 ARG N N 255 118.180 120.929 -2.749 1
1 298 . 12 1 1 A 26 26 PRO HA H 256 4.800 4.941 -0.141 1
1 305 . 12 1 1 A 26 26 PRO CA C 256 61.790 62.841 -1.051 1
1 306 . 12 1 1 A 26 26 PRO CB C 256 32.660 31.758 0.902 1
1 309 . 12 1 1 A 27 27 VAL H H 257 8.170 8.373 -0.203 1
1 310 . 12 1 1 A 27 27 VAL HA H 257 3.590 3.731 -0.141 1
1 318 . 12 1 1 A 27 27 VAL CA C 257 64.830 65.387 -0.557 1
1 319 . 12 1 1 A 27 27 VAL CB C 257 31.720 31.396 0.324 1
1 322 . 12 1 1 A 27 27 VAL N N 257 115.710 124.364 -8.654 1
1 323 . 12 1 1 A 28 28 ASP H H 258 8.240 8.117 0.123 1
1 324 . 12 1 1 A 28 28 ASP HA H 258 4.340 4.380 -0.040 1
1 327 . 12 1 1 A 28 28 ASP CA C 258 56.490 57.386 -0.896 1
1 328 . 12 1 1 A 28 28 ASP CB C 258 40.520 40.127 0.393 1
1 329 . 12 1 1 A 28 28 ASP N N 258 119.000 121.471 -2.471 1
1 330 . 12 1 1 A 29 29 ASP H H 259 8.000 8.762 -0.762 1
1 331 . 12 1 1 A 29 29 ASP HA H 259 4.390 4.618 -0.228 1
1 334 . 12 1 1 A 29 29 ASP CA C 259 56.210 55.325 0.885 1
1 335 . 12 1 1 A 29 29 ASP CB C 259 40.670 41.126 -0.456 1
1 336 . 12 1 1 A 29 29 ASP N N 259 118.900 117.596 1.304 1
1 337 . 12 1 1 A 30 30 LEU H H 260 7.760 7.361 0.399 1
1 338 . 12 1 1 A 30 30 LEU HA H 260 3.990 4.170 -0.180 1
1 348 . 12 1 1 A 30 30 LEU CA C 260 55.000 55.836 -0.836 1
1 349 . 12 1 1 A 30 30 LEU CB C 260 41.670 42.307 -0.637 1
1 353 . 12 1 1 A 30 30 LEU N N 260 116.300 121.705 -5.405 1
1 354 . 12 1 1 A 31 31 GLU H H 261 7.990 8.700 -0.710 1
1 355 . 12 1 1 A 31 31 GLU HA H 261 4.280 4.010 0.270 1
1 358 . 12 1 1 A 31 31 GLU CA C 261 56.860 59.419 -2.559 1
1 359 . 12 1 1 A 31 31 GLU CB C 261 27.010 29.338 -2.328 1
1 360 . 12 1 1 A 31 31 GLU N N 261 115.620 124.467 -8.847 1
1 361 . 12 1 1 A 32 32 LEU H H 262 8.000 7.462 0.538 1
1 362 . 12 1 1 A 32 32 LEU HA H 262 4.400 4.332 0.068 1
1 372 . 12 1 1 A 32 32 LEU CA C 262 53.860 54.816 -0.956 1
1 373 . 12 1 1 A 32 32 LEU CB C 262 44.450 42.773 1.677 1
1 377 . 12 1 1 A 32 32 LEU N N 262 118.860 122.191 -3.331 1
1 378 . 12 1 1 A 33 33 THR H H 263 10.020 8.663 1.357 1
1 379 . 12 1 1 A 33 33 THR HA H 263 4.130 4.682 -0.552 1
1 384 . 12 1 1 A 33 33 THR CA C 263 62.400 60.598 1.802 1
1 385 . 12 1 1 A 33 33 THR CB C 263 71.270 71.198 0.072 1
1 387 . 12 1 1 A 33 33 THR N N 263 114.610 113.232 1.378 1
1 388 . 12 1 1 A 34 34 VAL H H 264 8.370 8.807 -0.437 1
1 389 . 12 1 1 A 34 34 VAL HA H 264 3.620 3.638 -0.018 1
1 397 . 12 1 1 A 34 34 VAL CA C 264 66.340 66.621 -0.281 1
1 398 . 12 1 1 A 34 34 VAL CB C 264 31.670 31.579 0.091 1
1 401 . 12 1 1 A 34 34 VAL N N 264 122.110 122.325 -0.215 1
1 402 . 12 1 1 A 35 35 ARG H H 265 8.190 8.221 -0.031 1
1 403 . 12 1 1 A 35 35 ARG HA H 265 4.070 3.951 0.119 1
1 411 . 12 1 1 A 35 35 ARG CA C 265 59.470 59.776 -0.306 1
1 412 . 12 1 1 A 35 35 ARG CB C 265 29.790 29.889 -0.099 1
1 415 . 12 1 1 A 35 35 ARG N N 265 117.340 120.977 -3.637 1
1 416 . 12 1 1 A 36 36 SER H H 266 7.610 7.953 -0.343 1
1 417 . 12 1 1 A 36 36 SER HA H 266 4.080 4.117 -0.037 1
1 420 . 12 1 1 A 36 36 SER CA C 266 63.080 61.902 1.178 1
1 421 . 12 1 1 A 36 36 SER CB C 266 63.280 62.841 0.439 1
1 422 . 12 1 1 A 36 36 SER N N 266 116.710 116.721 -0.011 1
1 423 . 12 1 1 A 37 37 ALA H H 267 8.720 7.621 1.099 1
1 424 . 12 1 1 A 37 37 ALA HA H 267 3.760 3.991 -0.231 1
1 428 . 12 1 1 A 37 37 ALA CA C 267 55.900 55.288 0.612 1
1 429 . 12 1 1 A 37 37 ALA CB C 267 18.090 17.786 0.304 1
1 430 . 12 1 1 A 37 37 ALA N N 267 124.170 123.498 0.672 1
1 431 . 12 1 1 A 38 38 ASN H H 268 8.850 9.194 -0.344 1
1 432 . 12 1 1 A 38 38 ASN HA H 268 4.420 4.513 -0.093 1
1 437 . 12 1 1 A 38 38 ASN CA C 268 55.700 56.133 -0.433 1
1 438 . 12 1 1 A 38 38 ASN CB C 268 37.180 37.582 -0.402 1
1 439 . 12 1 1 A 38 38 ASN N N 268 117.370 117.499 -0.129 1
1 441 . 12 1 1 A 39 39 CYS H H 269 7.970 7.949 0.021 1
1 442 . 12 1 1 A 39 39 CYS HA H 269 4.190 4.099 0.091 1
1 445 . 12 1 1 A 39 39 CYS CA C 269 63.340 62.844 0.496 1
1 446 . 12 1 1 A 39 39 CYS CB C 269 26.870 27.236 -0.366 1
1 447 . 12 1 1 A 39 39 CYS N N 269 120.510 119.678 0.832 1
1 448 . 12 1 1 A 40 40 LEU H H 270 7.600 7.752 -0.152 1
1 449 . 12 1 1 A 40 40 LEU HA H 270 3.880 3.914 -0.034 1
1 458 . 12 1 1 A 40 40 LEU CA C 270 57.810 57.989 -0.179 1
1 459 . 12 1 1 A 40 40 LEU CB C 270 40.030 41.364 -1.334 1
1 462 . 12 1 1 A 40 40 LEU N N 270 117.710 120.613 -2.903 1
1 463 . 12 1 1 A 41 41 LYS H H 271 7.980 8.516 -0.536 1
1 464 . 12 1 1 A 41 41 LYS HA H 271 3.820 4.190 -0.370 1
1 472 . 12 1 1 A 41 41 LYS CA C 271 59.840 59.282 0.558 1
1 473 . 12 1 1 A 41 41 LYS CB C 271 32.070 32.060 0.010 1
1 476 . 12 1 1 A 41 41 LYS N N 271 120.070 120.493 -0.423 1
1 477 . 12 1 1 A 42 42 ALA H H 272 7.860 8.226 -0.366 1
1 478 . 12 1 1 A 42 42 ALA HA H 272 4.140 4.089 0.051 1
1 482 . 12 1 1 A 42 42 ALA CA C 272 54.670 54.408 0.262 1
1 483 . 12 1 1 A 42 42 ALA CB C 272 17.950 18.159 -0.209 1
1 484 . 12 1 1 A 42 42 ALA N N 272 122.880 121.374 1.506 1
1 485 . 12 1 1 A 43 43 GLU H H 273 7.210 7.964 -0.754 1
1 486 . 12 1 1 A 43 43 GLU HA H 273 4.260 4.446 -0.186 1
1 491 . 12 1 1 A 43 43 GLU CA C 273 55.020 56.008 -0.988 1
1 492 . 12 1 1 A 43 43 GLU CB C 273 29.880 29.362 0.518 1
1 494 . 12 1 1 A 43 43 GLU N N 273 116.590 115.505 1.085 1
1 495 . 12 1 1 A 44 44 ALA H H 274 7.880 8.009 -0.129 1
1 496 . 12 1 1 A 44 44 ALA HA H 274 3.680 3.952 -0.272 1
1 500 . 12 1 1 A 44 44 ALA CA C 274 52.960 53.234 -0.274 1
1 501 . 12 1 1 A 44 44 ALA CB C 274 16.110 17.203 -1.093 1
1 502 . 12 1 1 A 44 44 ALA N N 274 118.420 119.221 -0.801 1
1 503 . 12 1 1 A 45 45 ILE H H 275 7.600 7.307 0.293 1
1 504 . 12 1 1 A 45 45 ILE HA H 275 3.870 4.550 -0.680 1
1 514 . 12 1 1 A 45 45 ILE CA C 275 61.150 60.383 0.767 1
1 515 . 12 1 1 A 45 45 ILE CB C 275 37.090 39.832 -2.742 1
1 519 . 12 1 1 A 45 45 ILE N N 275 120.370 118.560 1.810 1
1 520 . 12 1 1 A 46 46 HIS H H 276 8.350 8.719 -0.369 1
1 521 . 12 1 1 A 46 46 HIS HA H 276 4.600 4.859 -0.259 1
1 526 . 12 1 1 A 46 46 HIS CA C 276 56.900 55.722 1.178 1
1 527 . 12 1 1 A 46 46 HIS CB C 276 31.910 31.029 0.881 1
1 529 . 12 1 1 A 46 46 HIS N N 276 123.250 122.467 0.783 1
1 530 . 12 1 1 A 47 47 TYR H H 277 8.850 7.154 1.696 1
1 531 . 12 1 1 A 47 47 TYR HA H 277 5.100 4.501 0.599 1
1 538 . 12 1 1 A 47 47 TYR CA C 277 57.430 56.416 1.014 1
1 539 . 12 1 1 A 47 47 TYR CB C 277 40.680 39.825 0.855 1
1 544 . 12 1 1 A 47 47 TYR N N 277 119.700 118.049 1.651 1
1 545 . 12 1 1 A 48 48 ILE H H 278 9.380 8.358 1.022 1
1 546 . 12 1 1 A 48 48 ILE HA H 278 3.340 3.564 -0.224 1
1 554 . 12 1 1 A 48 48 ILE CA C 278 67.640 64.967 2.673 1
1 555 . 12 1 1 A 48 48 ILE CB C 278 36.310 37.529 -1.219 1
1 558 . 12 1 1 A 48 48 ILE N N 278 125.650 124.575 1.075 1
1 559 . 12 1 1 A 49 49 GLY H H 279 9.430 8.229 1.201 1
1 560 . 12 1 1 A 49 49 GLY HA2 H 279 2.370 2.138 0.232 1
1 561 . 12 1 1 A 49 49 GLY HA3 H 279 3.230 3.569 -0.339 1
1 562 . 12 1 1 A 49 49 GLY CA C 279 46.820 46.809 0.011 1
1 563 . 12 1 1 A 49 49 GLY N N 279 105.200 108.464 -3.264 1
1 564 . 12 1 1 A 50 50 ASP H H 280 7.050 7.525 -0.475 1
1 565 . 12 1 1 A 50 50 ASP HA H 280 4.360 4.210 0.150 1
1 568 . 12 1 1 A 50 50 ASP CA C 280 57.110 56.283 0.827 1
1 569 . 12 1 1 A 50 50 ASP CB C 280 42.620 40.569 2.051 1
1 570 . 12 1 1 A 50 50 ASP N N 280 116.360 120.871 -4.511 1
1 571 . 12 1 1 A 51 51 LEU H H 281 7.170 8.270 -1.100 1
1 572 . 12 1 1 A 51 51 LEU HA H 281 3.880 3.994 -0.114 1
1 582 . 12 1 1 A 51 51 LEU CA C 281 57.900 58.311 -0.411 1
1 583 . 12 1 1 A 51 51 LEU CB C 281 41.870 41.634 0.236 1
1 587 . 12 1 1 A 51 51 LEU N N 281 120.130 121.621 -1.491 1
1 588 . 12 1 1 A 52 52 VAL H H 282 7.820 7.638 0.182 1
1 589 . 12 1 1 A 52 52 VAL HA H 282 3.980 3.876 0.104 1
1 597 . 12 1 1 A 52 52 VAL CA C 282 64.000 65.569 -1.569 1
1 598 . 12 1 1 A 52 52 VAL CB C 282 30.400 31.383 -0.983 1
1 601 . 12 1 1 A 52 52 VAL N N 282 105.550 115.529 -9.979 1
1 602 . 12 1 1 A 53 53 GLN H H 283 6.550 7.951 -1.401 1
1 603 . 12 1 1 A 53 53 GLN HA H 283 4.680 4.105 0.575 1
1 610 . 12 1 1 A 53 53 GLN CA C 283 56.210 58.823 -2.613 1
1 611 . 12 1 1 A 53 53 GLN CB C 283 31.710 28.620 3.090 1
1 613 . 12 1 1 A 53 53 GLN N N 283 114.060 121.889 -7.829 1
1 615 . 12 1 1 A 54 54 ARG H H 284 7.690 7.586 0.104 1
1 616 . 12 1 1 A 54 54 ARG HA H 284 4.520 4.678 -0.158 1
1 624 . 12 1 1 A 54 54 ARG CA C 284 54.600 54.787 -0.187 1
1 625 . 12 1 1 A 54 54 ARG CB C 284 30.750 32.262 -1.512 1
1 628 . 12 1 1 A 54 54 ARG N N 284 119.810 118.694 1.116 1
1 629 . 12 1 1 A 55 55 THR H H 285 8.110 8.723 -0.613 1
1 630 . 12 1 1 A 55 55 THR HA H 285 4.430 4.328 0.102 1
1 635 . 12 1 1 A 55 55 THR CA C 285 59.640 63.508 -3.868 1
1 636 . 12 1 1 A 55 55 THR CB C 285 71.310 69.325 1.985 1
1 638 . 12 1 1 A 55 55 THR N N 285 108.450 119.353 -10.903 1
1 639 . 12 1 1 A 56 56 GLU H H 286 8.910 8.953 -0.043 1
1 640 . 12 1 1 A 56 56 GLU HA H 286 3.660 3.955 -0.295 1
1 645 . 12 1 1 A 56 56 GLU CA C 286 60.650 59.676 0.974 1
1 646 . 12 1 1 A 56 56 GLU CB C 286 29.400 29.163 0.237 1
1 648 . 12 1 1 A 56 56 GLU N N 286 120.600 125.868 -5.268 1
1 649 . 12 1 1 A 57 57 VAL H H 287 7.600 8.127 -0.527 1
1 650 . 12 1 1 A 57 57 VAL HA H 287 3.620 3.524 0.096 1
1 658 . 12 1 1 A 57 57 VAL CA C 287 66.020 67.132 -1.112 1
1 659 . 12 1 1 A 57 57 VAL CB C 287 31.720 31.565 0.155 1
1 662 . 12 1 1 A 57 57 VAL N N 287 114.050 119.864 -5.814 1
1 663 . 12 1 1 A 58 58 GLU H H 288 7.350 8.244 -0.894 1
1 664 . 12 1 1 A 58 58 GLU HA H 288 3.830 4.080 -0.250 1
1 669 . 12 1 1 A 58 58 GLU CA C 288 59.250 59.622 -0.372 1
1 670 . 12 1 1 A 58 58 GLU CB C 288 30.030 29.123 0.907 1
1 672 . 12 1 1 A 58 58 GLU N N 288 117.610 119.302 -1.692 1
1 673 . 12 1 1 A 59 59 LEU H H 289 7.850 7.938 -0.088 1
1 674 . 12 1 1 A 59 59 LEU HA H 289 4.150 4.098 0.052 1
1 683 . 12 1 1 A 59 59 LEU CA C 289 57.340 57.362 -0.022 1
1 684 . 12 1 1 A 59 59 LEU CB C 289 41.170 41.367 -0.197 1
1 687 . 12 1 1 A 59 59 LEU N N 289 120.050 120.406 -0.356 1
1 688 . 12 1 1 A 60 60 LEU H H 290 7.670 7.978 -0.308 1
1 689 . 12 1 1 A 60 60 LEU HA H 290 4.540 4.099 0.441 1
1 696 . 12 1 1 A 60 60 LEU CA C 290 55.090 57.864 -2.774 1
1 697 . 12 1 1 A 60 60 LEU CB C 290 42.320 41.266 1.054 1
1 701 . 12 1 1 A 60 60 LEU N N 290 114.980 119.984 -5.004 1
1 702 . 12 1 1 A 61 61 LYS H H 291 7.440 7.394 0.046 1
1 703 . 12 1 1 A 61 61 LYS HA H 291 4.280 4.288 -0.008 1
1 710 . 12 1 1 A 61 61 LYS CA C 291 56.860 57.498 -0.638 1
1 711 . 12 1 1 A 61 61 LYS CB C 291 31.900 32.849 -0.949 1
1 714 . 12 1 1 A 61 61 LYS N N 291 118.120 117.723 0.397 1
1 715 . 12 1 1 A 62 62 THR H H 292 7.310 7.212 0.098 1
1 716 . 12 1 1 A 62 62 THR HA H 292 5.220 4.377 0.843 1
1 721 . 12 1 1 A 62 62 THR CA C 292 55.830 60.342 -4.512 1
1 722 . 12 1 1 A 62 62 THR CB C 292 69.970 69.059 0.911 1
1 724 . 12 1 1 A 62 62 THR N N 292 111.890 115.352 -3.462 1
1 725 . 12 1 1 A 63 63 PRO HA H 293 4.570 4.465 0.105 1
1 730 . 12 1 1 A 63 63 PRO CA C 293 63.710 64.276 -0.566 1
1 731 . 12 1 1 A 63 63 PRO CB C 293 32.380 31.848 0.532 1
1 733 . 12 1 1 A 64 64 ASN H H 294 8.050 8.862 -0.812 1
1 734 . 12 1 1 A 64 64 ASN HA H 294 4.490 4.415 0.075 1
1 739 . 12 1 1 A 64 64 ASN CA C 294 55.630 55.805 -0.175 1
1 740 . 12 1 1 A 64 64 ASN CB C 294 38.730 38.378 0.352 1
1 741 . 12 1 1 A 64 64 ASN N N 294 117.120 117.238 -0.118 1
1 743 . 12 1 1 A 65 65 LEU H H 295 7.550 7.113 0.437 1
1 744 . 12 1 1 A 65 65 LEU HA H 295 4.640 4.794 -0.154 1
1 754 . 12 1 1 A 65 65 LEU CA C 295 54.310 53.116 1.194 1
1 755 . 12 1 1 A 65 65 LEU CB C 295 43.640 44.270 -0.630 1
1 758 . 12 1 1 A 65 65 LEU N N 295 119.930 116.046 3.884 1
1 759 . 12 1 1 A 66 66 GLY H H 296 7.850 8.369 -0.519 1
1 760 . 12 1 1 A 66 66 GLY HA2 H 296 3.810 4.078 -0.268 1
1 761 . 12 1 1 A 66 66 GLY HA3 H 296 4.110 4.078 0.032 1
1 762 . 12 1 1 A 66 66 GLY CA C 296 43.570 44.557 -0.987 1
1 763 . 12 1 1 A 66 66 GLY N N 296 108.840 107.888 0.952 1
1 764 . 12 1 1 A 67 67 LYS H H 297 8.820 8.684 0.136 1
1 765 . 12 1 1 A 67 67 LYS HA H 297 3.980 3.927 0.053 1
1 774 . 12 1 1 A 67 67 LYS CA C 297 60.100 59.263 0.837 1
1 775 . 12 1 1 A 67 67 LYS CB C 297 32.100 32.057 0.043 1
1 779 . 12 1 1 A 67 67 LYS N N 297 120.130 120.050 0.080 1
1 780 . 12 1 1 A 68 68 LYS H H 298 8.850 7.858 0.992 1
1 781 . 12 1 1 A 68 68 LYS HA H 298 4.060 4.055 0.005 1
1 790 . 12 1 1 A 68 68 LYS CA C 298 60.600 59.130 1.470 1
1 791 . 12 1 1 A 68 68 LYS CB C 298 31.920 32.274 -0.354 1
1 795 . 12 1 1 A 68 68 LYS N N 298 119.580 119.345 0.235 1
1 796 . 12 1 1 A 69 69 SER H H 299 8.100 8.023 0.077 1
1 797 . 12 1 1 A 69 69 SER HA H 299 4.370 4.067 0.303 1
1 800 . 12 1 1 A 69 69 SER CA C 299 61.980 62.561 -0.581 1
1 801 . 12 1 1 A 69 69 SER CB C 299 63.000 62.686 0.314 1
1 802 . 12 1 1 A 69 69 SER N N 299 116.360 116.911 -0.551 1
1 803 . 12 1 1 A 70 70 LEU H H 300 8.240 7.680 0.560 1
1 804 . 12 1 1 A 70 70 LEU HA H 300 3.970 4.017 -0.047 1
1 814 . 12 1 1 A 70 70 LEU CA C 300 57.610 57.769 -0.159 1
1 815 . 12 1 1 A 70 70 LEU CB C 300 41.060 41.892 -0.832 1
1 819 . 12 1 1 A 70 70 LEU N N 300 123.330 122.789 0.541 1
1 820 . 12 1 1 A 71 71 THR H H 301 8.550 8.035 0.515 1
1 821 . 12 1 1 A 71 71 THR HA H 301 3.690 3.814 -0.124 1
1 826 . 12 1 1 A 71 71 THR CA C 301 67.170 66.497 0.673 1
1 827 . 12 1 1 A 71 71 THR CB C 301 68.810 68.426 0.384 1
1 829 . 12 1 1 A 71 71 THR N N 301 116.520 114.740 1.780 1
1 830 . 12 1 1 A 72 72 GLU H H 302 7.520 7.722 -0.202 1
1 831 . 12 1 1 A 72 72 GLU HA H 302 4.070 4.296 -0.226 1
1 836 . 12 1 1 A 72 72 GLU CA C 302 59.470 59.394 0.076 1
1 837 . 12 1 1 A 72 72 GLU CB C 302 29.090 29.472 -0.382 1
1 839 . 12 1 1 A 72 72 GLU N N 302 121.510 120.809 0.701 1
1 840 . 12 1 1 A 73 73 ILE H H 303 8.290 8.129 0.161 1
1 841 . 12 1 1 A 73 73 ILE HA H 303 3.380 3.585 -0.205 1
1 849 . 12 1 1 A 73 73 ILE CA C 303 66.010 65.261 0.749 1
1 850 . 12 1 1 A 73 73 ILE CB C 303 38.680 38.011 0.669 1
1 853 . 12 1 1 A 73 73 ILE N N 303 118.510 120.063 -1.553 1
1 854 . 12 1 1 A 74 74 LYS H H 304 8.550 8.615 -0.065 1
1 855 . 12 1 1 A 74 74 LYS HA H 304 3.680 3.863 -0.183 1
1 864 . 12 1 1 A 74 74 LYS CA C 304 61.320 59.847 1.473 1
1 865 . 12 1 1 A 74 74 LYS CB C 304 32.060 32.072 -0.012 1
1 868 . 12 1 1 A 74 74 LYS N N 304 118.220 120.907 -2.687 1
1 869 . 12 1 1 A 75 75 ASP H H 305 8.450 8.406 0.044 1
1 870 . 12 1 1 A 75 75 ASP HA H 305 4.440 4.349 0.091 1
1 873 . 12 1 1 A 75 75 ASP CA C 305 57.690 57.238 0.452 1
1 874 . 12 1 1 A 75 75 ASP CB C 305 40.220 40.645 -0.425 1
1 875 . 12 1 1 A 75 75 ASP N N 305 121.790 120.006 1.784 1
1 876 . 12 1 1 A 76 76 VAL H H 306 8.680 7.804 0.876 1
1 877 . 12 1 1 A 76 76 VAL HA H 306 3.890 3.581 0.309 1
1 885 . 12 1 1 A 76 76 VAL CA C 306 66.020 66.439 -0.419 1
1 886 . 12 1 1 A 76 76 VAL CB C 306 31.250 31.384 -0.134 1
1 889 . 12 1 1 A 76 76 VAL N N 306 121.150 119.878 1.272 1
1 890 . 12 1 1 A 77 77 LEU H H 307 8.470 8.375 0.095 1
1 891 . 12 1 1 A 77 77 LEU HA H 307 3.810 4.054 -0.244 1
1 901 . 12 1 1 A 77 77 LEU CA C 307 58.330 57.460 0.870 1
1 902 . 12 1 1 A 77 77 LEU CB C 307 41.250 41.138 0.112 1
1 906 . 12 1 1 A 77 77 LEU N N 307 120.830 119.462 1.368 1
1 907 . 12 1 1 A 78 78 ALA H H 308 8.280 8.188 0.092 1
1 908 . 12 1 1 A 78 78 ALA HA H 308 4.320 4.113 0.207 1
1 912 . 12 1 1 A 78 78 ALA CA C 308 55.420 55.012 0.408 1
1 913 . 12 1 1 A 78 78 ALA CB C 308 17.750 18.163 -0.413 1
1 914 . 12 1 1 A 78 78 ALA N N 308 122.530 122.967 -0.437 1
1 915 . 12 1 1 A 79 79 SER H H 309 7.900 8.124 -0.224 1
1 916 . 12 1 1 A 79 79 SER HA H 309 4.340 4.335 0.005 1
1 919 . 12 1 1 A 79 79 SER CA C 309 61.350 59.100 2.250 1
1 920 . 12 1 1 A 79 79 SER CB C 309 63.280 64.060 -0.780 1
1 921 . 12 1 1 A 79 79 SER N N 309 115.600 111.451 4.149 1
1 922 . 12 1 1 A 80 80 ARG H H 310 7.450 8.412 -0.962 1
1 923 . 12 1 1 A 80 80 ARG HA H 310 4.550 3.962 0.588 1
1 931 . 12 1 1 A 80 80 ARG CA C 310 54.200 57.374 -3.174 1
1 932 . 12 1 1 A 80 80 ARG CB C 310 30.680 26.969 3.711 1
1 935 . 12 1 1 A 80 80 ARG N N 310 119.360 116.137 3.223 1
1 936 . 12 1 1 A 81 81 GLY H H 311 7.940 8.256 -0.316 1
1 937 . 12 1 1 A 81 81 GLY HA2 H 311 3.840 3.958 -0.118 1
1 938 . 12 1 1 A 81 81 GLY HA3 H 311 4.070 3.962 0.108 1
1 939 . 12 1 1 A 81 81 GLY CA C 311 46.060 45.236 0.824 1
1 940 . 12 1 1 A 81 81 GLY N N 311 108.130 105.779 2.351 1
1 941 . 12 1 1 A 82 82 LEU H H 312 7.920 7.461 0.459 1
1 942 . 12 1 1 A 82 82 LEU HA H 312 4.680 4.710 -0.030 1
1 952 . 12 1 1 A 82 82 LEU CA C 312 53.070 52.820 0.250 1
1 953 . 12 1 1 A 82 82 LEU CB C 312 45.790 45.406 0.384 1
1 957 . 12 1 1 A 82 82 LEU N N 312 119.290 117.735 1.555 1
1 958 . 12 1 1 A 83 83 SER H H 313 7.530 8.901 -1.371 1
1 959 . 12 1 1 A 83 83 SER HA H 313 4.450 4.062 0.388 1
1 962 . 12 1 1 A 83 83 SER CA C 313 57.190 58.884 -1.694 1
1 963 . 12 1 1 A 83 83 SER CB C 313 66.080 61.827 4.253 1
1 964 . 12 1 1 A 83 83 SER N N 313 113.120 113.735 -0.615 1
1 965 . 12 1 1 A 84 84 LEU H H 314 8.340 8.355 -0.015 1
1 966 . 12 1 1 A 84 84 LEU HA H 314 4.620 4.401 0.219 1
1 976 . 12 1 1 A 84 84 LEU CA C 314 54.720 54.668 0.052 1
1 977 . 12 1 1 A 84 84 LEU CB C 314 41.620 42.365 -0.745 1
1 981 . 12 1 1 A 84 84 LEU N N 314 115.930 119.223 -3.293 1
1 982 . 12 1 1 A 85 85 GLY H H 315 8.270 7.886 0.384 1
1 983 . 12 1 1 A 85 85 GLY HA2 H 315 3.320 3.944 -0.624 1
1 984 . 12 1 1 A 85 85 GLY HA3 H 315 3.850 3.945 -0.095 1
1 985 . 12 1 1 A 85 85 GLY CA C 315 46.560 46.763 -0.203 1
1 986 . 12 1 1 A 85 85 GLY N N 315 111.010 108.489 2.521 1
1 987 . 12 1 1 A 86 86 MET H H 316 8.650 8.123 0.527 1
1 988 . 12 1 1 A 86 86 MET HA H 316 3.990 4.798 -0.808 1
1 996 . 12 1 1 A 86 86 MET CA C 316 56.730 55.243 1.487 1
1 997 . 12 1 1 A 86 86 MET CB C 316 33.600 35.027 -1.427 1
1 1000 . 12 1 1 A 86 86 MET N N 316 120.570 118.732 1.838 1
1 1001 . 12 1 1 A 87 87 ARG H H 317 8.360 8.522 -0.162 1
1 1002 . 12 1 1 A 87 87 ARG HA H 317 4.450 5.171 -0.721 1
1 1010 . 12 1 1 A 87 87 ARG CA C 317 55.310 54.438 0.872 1
1 1011 . 12 1 1 A 87 87 ARG CB C 317 30.490 32.613 -2.123 1
1 1014 . 12 1 1 A 87 87 ARG N N 317 122.290 119.303 2.987 1
1 1015 . 12 1 1 A 88 88 LEU H H 318 8.400 8.942 -0.542 1
1 1016 . 12 1 1 A 88 88 LEU HA H 318 4.670 4.886 -0.216 1
1 1026 . 12 1 1 A 88 88 LEU CA C 318 53.110 53.255 -0.145 1
1 1027 . 12 1 1 A 88 88 LEU CB C 318 43.600 44.268 -0.668 1
1 1031 . 12 1 1 A 88 88 LEU N N 318 126.420 125.654 0.766 1
1 1032 . 12 1 1 A 89 89 GLU H H 319 8.780 8.944 -0.164 1
1 1033 . 12 1 1 A 89 89 GLU HA H 319 4.340 3.994 0.346 1
1 1038 . 12 1 1 A 89 89 GLU CA C 319 56.490 59.481 -2.991 1
1 1039 . 12 1 1 A 89 89 GLU CB C 319 30.470 29.884 0.586 1
1 1041 . 12 1 1 A 89 89 GLU N N 319 123.070 122.322 0.748 1
1 1042 . 12 1 1 A 90 90 ASN H H 320 8.900 8.180 0.720 1
1 1043 . 12 1 1 A 90 90 ASN HA H 320 4.410 4.993 -0.583 1
1 1048 . 12 1 1 A 90 90 ASN CA C 320 54.120 54.506 -0.386 1
1 1049 . 12 1 1 A 90 90 ASN CB C 320 37.640 41.568 -3.928 1
1 1050 . 12 1 1 A 90 90 ASN N N 320 116.540 112.710 3.830 1
1 1052 . 12 1 1 A 91 91 TRP H H 321 7.990 7.478 0.512 1
1 1053 . 12 1 1 A 91 91 TRP HA H 321 4.330 4.799 -0.469 1
1 1062 . 12 1 1 A 91 91 TRP CA C 321 54.590 58.489 -3.899 1
1 1063 . 12 1 1 A 91 91 TRP CB C 321 31.280 31.170 0.110 1
1 1069 . 12 1 1 A 91 91 TRP N N 321 119.230 114.771 4.459 1
1 1071 . 12 1 1 A 92 92 PRO HA H 322 4.800 3.908 0.892 1
1 1077 . 12 1 1 A 93 93 PRO HA H 323 4.450 4.551 -0.101 1
1 1084 . 12 1 1 A 93 93 PRO CA C 323 61.970 62.621 -0.651 1
1 1085 . 12 1 1 A 93 93 PRO CB C 323 32.830 32.744 0.086 1
1 1088 . 12 1 1 A 94 94 ALA H H 324 8.460 8.661 -0.201 1
1 1089 . 12 1 1 A 94 94 ALA HA H 324 4.000 3.993 0.007 1
1 1093 . 12 1 1 A 94 94 ALA CA C 324 53.790 54.584 -0.794 1
1 1094 . 12 1 1 A 94 94 ALA CB C 324 18.640 18.319 0.321 1
1 1095 . 12 1 1 A 94 94 ALA N N 324 124.010 126.027 -2.017 1
1 1096 . 12 1 1 A 95 95 SER H H 325 7.950 8.179 -0.229 1
1 1097 . 12 1 1 A 95 95 SER HA H 325 4.210 4.449 -0.239 1
1 1100 . 12 1 1 A 95 95 SER CA C 325 58.970 60.735 -1.765 1
1 1101 . 12 1 1 A 95 95 SER CB C 325 63.040 63.023 0.017 1
1 1102 . 12 1 1 A 95 95 SER N N 325 111.520 112.033 -0.513 1
1 1103 . 12 1 1 A 96 96 ILE H H 326 7.480 7.816 -0.336 1
1 1104 . 12 1 1 A 96 96 ILE HA H 326 4.170 3.467 0.703 1
1 1114 . 12 1 1 A 96 96 ILE CA C 326 61.300 63.067 -1.767 1
1 1115 . 12 1 1 A 96 96 ILE CB C 326 38.530 37.594 0.936 1
1 1119 . 12 1 1 A 96 96 ILE N N 326 119.650 122.878 -3.228 1
1 1120 . 12 1 1 A 97 97 ALA H H 327 7.860 7.380 0.480 1
1 1121 . 12 1 1 A 97 97 ALA HA H 327 4.230 4.117 0.113 1
1 1125 . 12 1 1 A 97 97 ALA CA C 327 52.570 52.310 0.260 1
1 1126 . 12 1 1 A 97 97 ALA CB C 327 19.590 19.331 0.259 1
1 1127 . 12 1 1 A 97 97 ALA N N 327 126.480 124.306 2.174 1
1 1128 . 12 1 1 A 98 98 ASP H H 328 8.250 8.789 -0.539 1
1 1129 . 12 1 1 A 98 98 ASP HA H 328 4.540 4.248 0.292 1
1 1132 . 12 1 1 A 98 98 ASP CA C 328 54.150 57.554 -3.404 1
1 1133 . 12 1 1 A 98 98 ASP CB C 328 41.120 40.511 0.609 1
1 1134 . 12 1 1 A 98 98 ASP N N 328 120.130 123.745 -3.615 1
1 1150 . 12 2 2 B 6 6 ASP H H 427 8.160 7.946 0.214 1
1 1151 . 12 2 2 B 6 6 ASP HA H 427 4.630 4.340 0.290 1
1 1154 . 12 2 2 B 6 6 ASP CA C 427 54.410 56.704 -2.294 1
1 1155 . 12 2 2 B 6 6 ASP CB C 427 41.250 40.443 0.807 1
1 1156 . 12 2 2 B 6 6 ASP N N 427 120.160 121.246 -1.086 1
1 1157 . 12 2 2 B 7 7 ASN H H 428 8.350 7.717 0.633 1
1 1158 . 12 2 2 B 7 7 ASN HA H 428 4.550 4.807 -0.257 1
1 1163 . 12 2 2 B 7 7 ASN CA C 428 53.310 53.748 -0.438 1
1 1164 . 12 2 2 B 7 7 ASN CB C 428 38.850 38.845 0.005 1
1 1165 . 12 2 2 B 7 7 ASN N N 428 118.440 115.363 3.077 1
1 1167 . 12 2 2 B 8 8 LYS H H 429 8.030 7.768 0.262 1
1 1172 . 12 2 2 B 8 8 LYS CB C 429 33.280 33.263 0.017 1
1 1174 . 12 2 2 B 8 8 LYS N N 429 120.260 122.642 -2.382 1
1 1175 . 12 2 2 B 9 9 PRO HA H 430 4.420 4.507 -0.087 1
1 1182 . 12 2 2 B 9 9 PRO CA C 430 62.280 62.682 -0.402 1
1 1183 . 12 2 2 B 9 9 PRO CB C 430 31.920 32.252 -0.332 1
1 1186 . 12 2 2 B 10 10 ALA H H 431 8.930 8.824 0.106 1
1 1187 . 12 2 2 B 10 10 ALA HA H 431 4.350 4.505 -0.155 1
1 1191 . 12 2 2 B 10 10 ALA CA C 431 51.070 51.689 -0.619 1
1 1192 . 12 2 2 B 10 10 ALA CB C 431 20.920 19.985 0.935 1
1 1193 . 12 2 2 B 10 10 ALA N N 431 125.000 125.171 -0.171 1
1 1194 . 12 2 2 B 11 11 ASP H H 432 8.530 9.085 -0.555 1
1 1195 . 12 2 2 B 11 11 ASP HA H 432 4.220 4.292 -0.072 1
1 1198 . 12 2 2 B 11 11 ASP CA C 432 57.520 57.585 -0.065 1
1 1199 . 12 2 2 B 11 11 ASP CB C 432 40.470 40.245 0.225 1
1 1200 . 12 2 2 B 11 11 ASP N N 432 119.610 120.586 -0.976 1
1 1201 . 12 2 2 B 12 12 ASP H H 433 8.340 7.946 0.394 1
1 1202 . 12 2 2 B 12 12 ASP HA H 433 4.160 4.400 -0.240 1
1 1205 . 12 2 2 B 12 12 ASP CA C 433 56.090 57.366 -1.276 1
1 1206 . 12 2 2 B 12 12 ASP CB C 433 38.960 41.001 -2.041 1
1 1207 . 12 2 2 B 12 12 ASP N N 433 116.330 119.517 -3.187 1
1 1208 . 12 2 2 B 13 13 LEU H H 434 7.360 7.869 -0.509 1
1 1209 . 12 2 2 B 13 13 LEU HA H 434 4.050 4.095 -0.045 1
1 1219 . 12 2 2 B 13 13 LEU CA C 434 57.340 57.836 -0.496 1
1 1220 . 12 2 2 B 13 13 LEU CB C 434 42.960 41.704 1.256 1
1 1224 . 12 2 2 B 13 13 LEU N N 434 123.440 121.280 2.160 1
1 1225 . 12 2 2 B 14 14 LEU H H 435 7.670 8.364 -0.694 1
1 1226 . 12 2 2 B 14 14 LEU HA H 435 3.710 4.045 -0.335 1
1 1236 . 12 2 2 B 14 14 LEU CA C 435 57.170 57.430 -0.260 1
1 1237 . 12 2 2 B 14 14 LEU CB C 435 42.590 41.468 1.122 1
1 1241 . 12 2 2 B 14 14 LEU N N 435 115.170 119.578 -4.408 1
1 1242 . 12 2 2 B 15 15 ASN H H 436 7.490 8.472 -0.982 1
1 1243 . 12 2 2 B 15 15 ASN HA H 436 4.640 4.810 -0.170 1
1 1248 . 12 2 2 B 15 15 ASN CA C 436 52.920 53.073 -0.153 1
1 1249 . 12 2 2 B 15 15 ASN CB C 436 39.350 39.221 0.129 1
1 1250 . 12 2 2 B 15 15 ASN N N 436 112.280 115.090 -2.810 1
1 1252 . 12 2 2 B 16 16 LEU H H 437 7.300 7.408 -0.108 1
1 1253 . 12 2 2 B 16 16 LEU HA H 437 4.100 4.275 -0.175 1
1 1263 . 12 2 2 B 16 16 LEU CA C 437 55.310 55.200 0.110 1
1 1264 . 12 2 2 B 16 16 LEU CB C 437 41.800 43.009 -1.209 1
1 1268 . 12 2 2 B 16 16 LEU N N 437 125.180 122.860 2.320 1
1 1269 . 12 2 2 B 17 17 GLU H H 438 8.590 8.775 -0.185 1
1 1270 . 12 2 2 B 17 17 GLU HA H 438 3.920 3.979 -0.059 1
1 1275 . 12 2 2 B 17 17 GLU CA C 438 58.440 58.162 0.278 1
1 1276 . 12 2 2 B 17 17 GLU CB C 438 29.180 29.641 -0.461 1
1 1278 . 12 2 2 B 17 17 GLU N N 438 129.850 125.703 4.147 1
1 1279 . 12 2 2 B 18 18 GLY H H 439 8.580 8.862 -0.282 1
1 1280 . 12 2 2 B 18 18 GLY HA2 H 439 3.570 3.942 -0.372 1
1 1281 . 12 2 2 B 18 18 GLY HA3 H 439 4.220 3.944 0.276 1
1 1282 . 12 2 2 B 18 18 GLY CA C 439 44.710 45.223 -0.513 1
1 1283 . 12 2 2 B 18 18 GLY N N 439 112.250 114.975 -2.725 1
1 1284 . 12 2 2 B 19 19 VAL H H 440 7.900 7.394 0.506 1
1 1285 . 12 2 2 B 19 19 VAL HA H 440 3.950 4.487 -0.537 1
1 1293 . 12 2 2 B 19 19 VAL CA C 440 62.820 60.927 1.893 1
1 1294 . 12 2 2 B 19 19 VAL CB C 440 31.470 34.623 -3.153 1
1 1297 . 12 2 2 B 19 19 VAL N N 440 121.910 121.813 0.097 1
1 1298 . 12 2 2 B 20 20 ASP H H 441 7.390 8.202 -0.812 1
1 1299 . 12 2 2 B 20 20 ASP HA H 441 4.820 4.881 -0.061 1
1 1302 . 12 2 2 B 20 20 ASP CA C 441 51.920 51.618 0.302 1
1 1303 . 12 2 2 B 20 20 ASP CB C 441 42.090 42.129 -0.039 1
1 1304 . 12 2 2 B 20 20 ASP N N 441 124.850 125.712 -0.862 1
1 1305 . 12 2 2 B 21 21 ARG H H 442 8.630 8.411 0.219 1
1 1306 . 12 2 2 B 21 21 ARG HA H 442 3.810 3.309 0.501 1
1 1313 . 12 2 2 B 21 21 ARG CA C 442 60.710 59.628 1.082 1
1 1314 . 12 2 2 B 21 21 ARG CB C 442 30.020 29.565 0.455 1
1 1317 . 12 2 2 B 21 21 ARG N N 442 120.890 118.935 1.955 1
1 1318 . 12 2 2 B 22 22 ASP H H 443 8.140 7.950 0.190 1
1 1319 . 12 2 2 B 22 22 ASP HA H 443 4.420 4.481 -0.061 1
1 1322 . 12 2 2 B 22 22 ASP CA C 443 57.680 57.057 0.623 1
1 1323 . 12 2 2 B 22 22 ASP CB C 443 40.880 40.908 -0.028 1
1 1324 . 12 2 2 B 22 22 ASP N N 443 116.750 120.043 -3.293 1
1 1325 . 12 2 2 B 23 23 LEU H H 444 8.170 8.907 -0.737 1
1 1326 . 12 2 2 B 23 23 LEU HA H 444 4.130 4.151 -0.021 1
1 1336 . 12 2 2 B 23 23 LEU CA C 444 57.770 57.820 -0.050 1
1 1337 . 12 2 2 B 23 23 LEU CB C 444 41.230 40.937 0.293 1
1 1341 . 12 2 2 B 23 23 LEU N N 444 122.130 121.314 0.816 1
1 1342 . 12 2 2 B 24 24 ALA H H 445 8.630 8.257 0.373 1
1 1343 . 12 2 2 B 24 24 ALA HA H 445 3.790 4.016 -0.226 1
1 1347 . 12 2 2 B 24 24 ALA CA C 445 55.810 54.498 1.312 1
1 1348 . 12 2 2 B 24 24 ALA CB C 445 18.060 18.035 0.025 1
1 1349 . 12 2 2 B 24 24 ALA N N 445 120.890 121.041 -0.151 1
1 1350 . 12 2 2 B 25 25 PHE H H 446 8.160 7.411 0.749 1
1 1351 . 12 2 2 B 25 25 PHE HA H 446 4.080 4.272 -0.192 1
1 1358 . 12 2 2 B 25 25 PHE CA C 446 62.670 61.835 0.835 1
1 1359 . 12 2 2 B 25 25 PHE CB C 446 39.440 38.489 0.951 1
1 1364 . 12 2 2 B 25 25 PHE N N 446 115.360 115.993 -0.633 1
1 1365 . 12 2 2 B 26 26 LYS H H 447 8.040 8.168 -0.128 1
1 1366 . 12 2 2 B 26 26 LYS HA H 447 4.110 4.054 0.056 1
1 1375 . 12 2 2 B 26 26 LYS CA C 447 60.140 59.890 0.250 1
1 1376 . 12 2 2 B 26 26 LYS CB C 447 32.880 32.114 0.766 1
1 1380 . 12 2 2 B 26 26 LYS N N 447 123.110 120.591 2.519 1
1 1381 . 12 2 2 B 27 27 LEU H H 448 8.630 8.301 0.329 1
1 1382 . 12 2 2 B 27 27 LEU HA H 448 3.840 4.086 -0.246 1
1 1392 . 12 2 2 B 27 27 LEU CA C 448 58.210 57.788 0.422 1
1 1393 . 12 2 2 B 27 27 LEU CB C 448 39.760 41.147 -1.387 1
1 1396 . 12 2 2 B 27 27 LEU N N 448 120.890 121.145 -0.255 1
1 1397 . 12 2 2 B 28 28 ALA H H 449 8.200 8.263 -0.063 1
1 1398 . 12 2 2 B 28 28 ALA HA H 449 3.760 4.535 -0.775 1
1 1402 . 12 2 2 B 28 28 ALA CA C 449 54.750 55.337 -0.587 1
1 1403 . 12 2 2 B 28 28 ALA CB C 449 18.050 18.011 0.039 1
1 1404 . 12 2 2 B 28 28 ALA N N 449 123.710 120.598 3.112 1
1 1405 . 12 2 2 B 29 29 ALA H H 450 7.780 8.004 -0.224 1
1 1406 . 12 2 2 B 29 29 ALA HA H 450 4.170 4.073 0.097 1
1 1410 . 12 2 2 B 29 29 ALA CA C 450 54.430 54.638 -0.208 1
1 1411 . 12 2 2 B 29 29 ALA CB C 450 18.040 18.558 -0.518 1
1 1412 . 12 2 2 B 29 29 ALA N N 450 121.020 119.272 1.748 1
1 1413 . 12 2 2 B 30 30 ARG H H 451 7.390 7.963 -0.573 1
1 1414 . 12 2 2 B 30 30 ARG HA H 451 4.540 4.410 0.130 1
1 1421 . 12 2 2 B 30 30 ARG CA C 451 54.510 55.779 -1.269 1
1 1422 . 12 2 2 B 30 30 ARG CB C 451 29.950 29.715 0.235 1
1 1425 . 12 2 2 B 30 30 ARG N N 451 115.480 116.633 -1.153 1
1 1426 . 12 2 2 B 31 31 GLY H H 452 7.950 7.965 -0.015 1
1 1427 . 12 2 2 B 31 31 GLY HA2 H 452 3.550 3.981 -0.431 1
1 1428 . 12 2 2 B 31 31 GLY HA3 H 452 4.200 3.983 0.217 1
1 1429 . 12 2 2 B 31 31 GLY CA C 452 45.380 45.357 0.023 1
1 1430 . 12 2 2 B 31 31 GLY N N 452 107.740 108.144 -0.404 1
1 1431 . 12 2 2 B 32 32 VAL H H 453 7.990 7.636 0.354 1
1 1432 . 12 2 2 B 32 32 VAL HA H 453 3.930 3.933 -0.003 1
1 1440 . 12 2 2 B 32 32 VAL CA C 453 61.420 62.859 -1.439 1
1 1441 . 12 2 2 B 32 32 VAL CB C 453 29.860 31.781 -1.921 1
1 1444 . 12 2 2 B 32 32 VAL N N 453 125.560 120.627 4.933 1
1 1445 . 12 2 2 B 33 33 CYS H H 454 8.460 8.771 -0.311 1
1 1446 . 12 2 2 B 33 33 CYS HA H 454 4.310 4.820 -0.510 1
1 1449 . 12 2 2 B 33 33 CYS CA C 454 60.260 59.915 0.345 1
1 1450 . 12 2 2 B 33 33 CYS CB C 454 30.330 30.591 -0.261 1
1 1451 . 12 2 2 B 33 33 CYS N N 454 119.460 124.938 -5.478 1
1 1452 . 12 2 2 B 34 34 THR H H 455 8.080 8.039 0.041 1
1 1453 . 12 2 2 B 34 34 THR HA H 455 4.840 4.727 0.113 1
1 1458 . 12 2 2 B 34 34 THR CA C 455 58.650 61.273 -2.623 1
1 1459 . 12 2 2 B 34 34 THR CB C 455 72.680 71.193 1.487 1
1 1461 . 12 2 2 B 34 34 THR N N 455 108.420 113.847 -5.427 1
1 1462 . 12 2 2 B 35 35 LEU H H 456 8.580 8.783 -0.203 1
1 1463 . 12 2 2 B 35 35 LEU HA H 456 3.790 3.979 -0.189 1
1 1473 . 12 2 2 B 35 35 LEU CA C 456 57.980 58.664 -0.684 1
1 1474 . 12 2 2 B 35 35 LEU CB C 456 42.220 41.564 0.656 1
1 1477 . 12 2 2 B 35 35 LEU N N 456 120.370 128.849 -8.479 1
1 1478 . 12 2 2 B 36 36 GLU H H 457 8.390 8.246 0.144 1
1 1479 . 12 2 2 B 36 36 GLU HA H 457 3.820 3.936 -0.116 1
1 1484 . 12 2 2 B 36 36 GLU CA C 457 59.640 59.806 -0.166 1
1 1485 . 12 2 2 B 36 36 GLU CB C 457 28.780 29.156 -0.376 1
1 1487 . 12 2 2 B 36 36 GLU N N 457 119.450 118.909 0.541 1
1 1488 . 12 2 2 B 37 37 ASP H H 458 7.750 8.015 -0.265 1
1 1489 . 12 2 2 B 37 37 ASP HA H 458 4.140 4.382 -0.242 1
1 1492 . 12 2 2 B 37 37 ASP CA C 458 57.150 57.270 -0.120 1
1 1493 . 12 2 2 B 37 37 ASP CB C 458 42.280 40.402 1.878 1
1 1494 . 12 2 2 B 37 37 ASP N N 458 117.430 120.035 -2.605 1
1 1495 . 12 2 2 B 38 38 LEU H H 459 7.700 7.802 -0.102 1
1 1496 . 12 2 2 B 38 38 LEU HA H 459 3.790 4.139 -0.349 1
1 1506 . 12 2 2 B 38 38 LEU CA C 459 58.080 58.053 0.027 1
1 1507 . 12 2 2 B 38 38 LEU CB C 459 41.130 41.398 -0.268 1
1 1511 . 12 2 2 B 38 38 LEU N N 459 121.280 121.766 -0.486 1
1 1512 . 12 2 2 B 39 39 ALA H H 460 8.190 8.356 -0.166 1
1 1513 . 12 2 2 B 39 39 ALA HA H 460 3.640 3.941 -0.301 1
1 1517 . 12 2 2 B 39 39 ALA CA C 460 54.320 55.222 -0.902 1
1 1518 . 12 2 2 B 39 39 ALA CB C 460 17.140 18.161 -1.021 1
1 1519 . 12 2 2 B 39 39 ALA N N 460 119.400 120.772 -1.372 1
1 1520 . 12 2 2 B 40 40 GLU H H 461 7.340 7.800 -0.460 1
1 1521 . 12 2 2 B 40 40 GLU HA H 461 4.180 4.263 -0.083 1
1 1526 . 12 2 2 B 40 40 GLU CA C 461 57.800 58.498 -0.698 1
1 1527 . 12 2 2 B 40 40 GLU CB C 461 30.600 29.951 0.649 1
1 1529 . 12 2 2 B 40 40 GLU N N 461 110.680 115.529 -4.849 1
1 1530 . 12 2 2 B 41 41 GLN H H 462 7.940 8.116 -0.176 1
1 1531 . 12 2 2 B 41 41 GLN HA H 462 4.100 4.432 -0.332 1
1 1538 . 12 2 2 B 41 41 GLN CA C 462 55.310 55.542 -0.232 1
1 1539 . 12 2 2 B 41 41 GLN CB C 462 28.780 30.131 -1.351 1
1 1541 . 12 2 2 B 41 41 GLN N N 462 120.720 117.919 2.801 1
1 1543 . 12 2 2 B 42 42 GLY H H 463 9.000 8.696 0.304 1
1 1544 . 12 2 2 B 42 42 GLY HA2 H 463 3.310 4.338 -1.028 1
1 1545 . 12 2 2 B 42 42 GLY HA3 H 463 4.820 4.339 0.481 1
1 1546 . 12 2 2 B 42 42 GLY CA C 463 42.650 43.483 -0.833 1
1 1547 . 12 2 2 B 42 42 GLY N N 463 104.110 107.616 -3.506 1
1 1548 . 12 2 2 B 43 43 ILE H H 464 7.900 8.714 -0.814 1
1 1549 . 12 2 2 B 43 43 ILE HA H 464 3.260 3.712 -0.452 1
1 1558 . 12 2 2 B 43 43 ILE CA C 464 66.570 64.629 1.941 1
1 1559 . 12 2 2 B 43 43 ILE CB C 464 38.770 37.639 1.131 1
1 1562 . 12 2 2 B 43 43 ILE N N 464 119.410 121.688 -2.278 1
1 1563 . 12 2 2 B 44 44 ASP H H 465 8.730 8.211 0.519 1
1 1564 . 12 2 2 B 44 44 ASP HA H 465 4.310 4.421 -0.111 1
1 1567 . 12 2 2 B 44 44 ASP CA C 465 56.740 57.691 -0.951 1
1 1568 . 12 2 2 B 44 44 ASP CB C 465 40.120 40.331 -0.211 1
1 1569 . 12 2 2 B 44 44 ASP N N 465 116.610 120.220 -3.610 1
1 1570 . 12 2 2 B 45 45 ASP H H 466 7.720 8.201 -0.481 1
1 1571 . 12 2 2 B 45 45 ASP HA H 466 4.480 4.434 0.046 1
1 1574 . 12 2 2 B 45 45 ASP CA C 466 57.000 57.209 -0.209 1
1 1575 . 12 2 2 B 45 45 ASP CB C 466 42.270 40.399 1.871 1
1 1576 . 12 2 2 B 45 45 ASP N N 466 117.560 119.570 -2.010 1
1 1577 . 12 2 2 B 46 46 LEU H H 467 7.370 7.978 -0.608 1
1 1578 . 12 2 2 B 46 46 LEU HA H 467 4.410 4.157 0.253 1
1 1587 . 12 2 2 B 46 46 LEU CA C 467 53.660 57.514 -3.854 1
1 1588 . 12 2 2 B 46 46 LEU CB C 467 42.260 41.627 0.633 1
1 1591 . 12 2 2 B 46 46 LEU N N 467 116.890 120.186 -3.296 1
1 1592 . 12 2 2 B 47 47 ALA H H 468 7.080 8.526 -1.446 1
1 1593 . 12 2 2 B 47 47 ALA HA H 468 4.120 4.029 0.091 1
1 1597 . 12 2 2 B 47 47 ALA CA C 468 54.130 54.932 -0.802 1
1 1598 . 12 2 2 B 47 47 ALA CB C 468 19.480 18.389 1.091 1
1 1599 . 12 2 2 B 47 47 ALA N N 468 120.150 122.614 -2.464 1
1 1600 . 12 2 2 B 48 48 ASP H H 469 8.560 8.079 0.481 1
1 1601 . 12 2 2 B 48 48 ASP HA H 469 4.410 4.428 -0.018 1
1 1604 . 12 2 2 B 48 48 ASP CA C 469 54.330 57.429 -3.099 1
1 1605 . 12 2 2 B 48 48 ASP CB C 469 39.760 40.785 -1.025 1
1 1606 . 12 2 2 B 48 48 ASP N N 469 114.660 116.764 -2.104 1
1 1607 . 12 2 2 B 49 49 ILE H H 470 7.870 8.081 -0.211 1
1 1608 . 12 2 2 B 49 49 ILE HA H 470 3.850 4.349 -0.499 1
1 1618 . 12 2 2 B 49 49 ILE CA C 470 61.680 60.815 0.865 1
1 1619 . 12 2 2 B 49 49 ILE CB C 470 37.120 38.646 -1.526 1
1 1623 . 12 2 2 B 49 49 ILE N N 470 121.600 119.979 1.621 1
1 1624 . 12 2 2 B 50 50 GLU H H 471 8.680 8.834 -0.154 1
1 1625 . 12 2 2 B 50 50 GLU HA H 471 3.940 4.070 -0.130 1
1 1630 . 12 2 2 B 50 50 GLU CA C 471 58.360 59.328 -0.968 1
1 1631 . 12 2 2 B 50 50 GLU CB C 471 29.530 29.325 0.205 1
1 1633 . 12 2 2 B 50 50 GLU N N 471 131.000 126.741 4.259 1
1 1634 . 12 2 2 B 51 51 GLY H H 472 8.860 8.193 0.667 1
1 1635 . 12 2 2 B 51 51 GLY HA2 H 472 3.640 4.006 -0.366 1
1 1636 . 12 2 2 B 51 51 GLY HA3 H 472 4.230 4.007 0.223 1
1 1637 . 12 2 2 B 51 51 GLY CA C 472 45.190 46.887 -1.697 1
1 1638 . 12 2 2 B 51 51 GLY N N 472 113.580 108.746 4.834 1
1 1639 . 12 2 2 B 52 52 LEU H H 473 7.850 7.793 0.057 1
1 1640 . 12 2 2 B 52 52 LEU HA H 473 4.680 4.934 -0.254 1
1 1650 . 12 2 2 B 52 52 LEU CA C 473 53.640 53.586 0.054 1
1 1651 . 12 2 2 B 52 52 LEU CB C 473 42.990 43.644 -0.654 1
1 1655 . 12 2 2 B 52 52 LEU N N 473 123.020 120.027 2.993 1
1 1656 . 12 2 2 B 53 53 THR H H 474 7.550 8.873 -1.323 1
1 1657 . 12 2 2 B 53 53 THR HA H 474 4.560 4.795 -0.235 1
1 1662 . 12 2 2 B 53 53 THR CA C 474 60.060 60.914 -0.854 1
1 1663 . 12 2 2 B 53 53 THR CB C 474 71.520 71.049 0.471 1
1 1665 . 12 2 2 B 53 53 THR N N 474 115.070 118.633 -3.563 1
1 1666 . 12 2 2 B 54 54 ASP H H 475 8.900 9.023 -0.123 1
1 1667 . 12 2 2 B 54 54 ASP HA H 475 4.220 4.300 -0.080 1
1 1670 . 12 2 2 B 54 54 ASP CA C 475 57.520 57.938 -0.418 1
1 1671 . 12 2 2 B 54 54 ASP CB C 475 39.560 40.264 -0.704 1
1 1672 . 12 2 2 B 54 54 ASP N N 475 121.800 123.803 -2.003 1
1 1673 . 12 2 2 B 55 55 GLU H H 476 8.460 8.041 0.419 1
1 1674 . 12 2 2 B 55 55 GLU HA H 476 3.970 4.023 -0.053 1
1 1679 . 12 2 2 B 55 55 GLU CA C 476 59.440 59.066 0.374 1
1 1680 . 12 2 2 B 55 55 GLU CB C 476 29.650 29.460 0.190 1
1 1682 . 12 2 2 B 55 55 GLU N N 476 119.460 119.522 -0.062 1
1 1683 . 12 2 2 B 56 56 LYS H H 477 7.790 7.994 -0.204 1
1 1684 . 12 2 2 B 56 56 LYS HA H 477 4.120 4.081 0.039 1
1 1693 . 12 2 2 B 56 56 LYS CA C 477 58.890 58.860 0.030 1
1 1694 . 12 2 2 B 56 56 LYS CB C 477 32.600 32.364 0.236 1
1 1698 . 12 2 2 B 56 56 LYS N N 477 121.840 119.724 2.116 1
1 1699 . 12 2 2 B 57 57 ALA H H 478 8.900 8.896 0.004 1
1 1700 . 12 2 2 B 57 57 ALA HA H 478 3.790 4.043 -0.253 1
1 1704 . 12 2 2 B 57 57 ALA CA C 478 55.810 55.048 0.762 1
1 1705 . 12 2 2 B 57 57 ALA CB C 478 18.590 18.425 0.165 1
1 1706 . 12 2 2 B 57 57 ALA N N 478 121.350 121.912 -0.562 1
1 1707 . 12 2 2 B 58 58 GLY H H 479 8.300 8.084 0.216 1
1 1708 . 12 2 2 B 58 58 GLY HA2 H 479 3.500 3.769 -0.269 1
1 1709 . 12 2 2 B 58 58 GLY HA3 H 479 3.890 3.770 0.120 1
1 1710 . 12 2 2 B 58 58 GLY CA C 479 47.360 47.164 0.196 1
1 1711 . 12 2 2 B 58 58 GLY N N 479 102.040 105.069 -3.029 1
1 1712 . 12 2 2 B 59 59 ALA H H 480 7.580 7.894 -0.314 1
1 1713 . 12 2 2 B 59 59 ALA HA H 480 4.110 4.023 0.087 1
1 1717 . 12 2 2 B 59 59 ALA CA C 480 55.580 54.585 0.995 1
1 1718 . 12 2 2 B 59 59 ALA CB C 480 18.130 18.672 -0.542 1
1 1719 . 12 2 2 B 59 59 ALA N N 480 123.180 125.116 -1.936 1
1 1720 . 12 2 2 B 60 60 LEU H H 481 8.290 7.903 0.387 1
1 1721 . 12 2 2 B 60 60 LEU HA H 481 4.020 3.992 0.028 1
1 1731 . 12 2 2 B 60 60 LEU CA C 481 57.850 57.676 0.174 1
1 1732 . 12 2 2 B 60 60 LEU CB C 481 42.360 41.418 0.942 1
1 1736 . 12 2 2 B 60 60 LEU N N 481 120.560 118.432 2.128 1
1 1737 . 12 2 2 B 61 61 ILE H H 482 8.080 7.877 0.203 1
1 1738 . 12 2 2 B 61 61 ILE HA H 482 3.210 3.481 -0.271 1
1 1748 . 12 2 2 B 61 61 ILE CA C 482 66.250 65.196 1.054 1
1 1749 . 12 2 2 B 61 61 ILE CB C 482 39.400 38.211 1.189 1
1 1753 . 12 2 2 B 61 61 ILE N N 482 119.170 120.292 -1.122 1
1 1754 . 12 2 2 B 62 62 MET H H 483 8.110 8.294 -0.184 1
1 1755 . 12 2 2 B 62 62 MET HA H 483 4.410 4.075 0.335 1
1 1763 . 12 2 2 B 62 62 MET CA C 483 56.110 58.667 -2.557 1
1 1764 . 12 2 2 B 62 62 MET CB C 483 28.260 32.367 -4.107 1
1 1767 . 12 2 2 B 62 62 MET N N 483 114.420 118.120 -3.700 1
1 1768 . 12 2 2 B 63 63 ALA H H 484 8.240 7.781 0.459 1
1 1769 . 12 2 2 B 63 63 ALA HA H 484 4.130 4.127 0.003 1
1 1773 . 12 2 2 B 63 63 ALA CA C 484 55.300 54.969 0.331 1
1 1774 . 12 2 2 B 63 63 ALA CB C 484 18.280 18.320 -0.040 1
1 1775 . 12 2 2 B 63 63 ALA N N 484 123.710 121.406 2.304 1
1 1776 . 12 2 2 B 64 64 ALA H H 485 8.050 8.380 -0.330 1
1 1777 . 12 2 2 B 64 64 ALA HA H 485 3.870 4.018 -0.148 1
1 1781 . 12 2 2 B 64 64 ALA CA C 485 55.330 55.369 -0.039 1
1 1782 . 12 2 2 B 64 64 ALA CB C 485 17.660 18.194 -0.534 1
1 1783 . 12 2 2 B 64 64 ALA N N 485 120.070 120.294 -0.224 1
1 1784 . 12 2 2 B 65 65 ARG H H 486 8.640 8.588 0.052 1
1 1785 . 12 2 2 B 65 65 ARG HA H 486 2.800 4.082 -1.282 1
1 1792 . 12 2 2 B 65 65 ARG CA C 486 60.600 59.666 0.934 1
1 1793 . 12 2 2 B 65 65 ARG CB C 486 29.910 30.142 -0.232 1
1 1796 . 12 2 2 B 65 65 ARG N N 486 118.730 118.025 0.705 1
1 1797 . 12 2 2 B 66 66 ASN H H 487 8.710 7.965 0.745 1
1 1798 . 12 2 2 B 66 66 ASN HA H 487 4.550 3.752 0.798 1
1 1803 . 12 2 2 B 66 66 ASN CA C 487 56.390 55.731 0.659 1
1 1804 . 12 2 2 B 66 66 ASN CB C 487 37.970 38.370 -0.400 1
1 1805 . 12 2 2 B 66 66 ASN N N 487 119.170 117.624 1.546 1
1 1807 . 12 2 2 B 67 67 ILE H H 488 7.250 7.565 -0.315 1
1 1808 . 12 2 2 B 67 67 ILE HA H 488 3.810 3.799 0.011 1
1 1818 . 12 2 2 B 67 67 ILE CA C 488 64.350 64.602 -0.252 1
1 1819 . 12 2 2 B 67 67 ILE CB C 488 39.570 37.241 2.329 1
1 1823 . 12 2 2 B 67 67 ILE N N 488 117.890 119.972 -2.082 1
1 1824 . 12 2 2 B 68 68 CYS H H 489 8.350 7.912 0.438 1
1 1825 . 12 2 2 B 68 68 CYS HA H 489 4.080 4.019 0.061 1
1 1828 . 12 2 2 B 68 68 CYS CA C 489 62.670 62.516 0.154 1
1 1829 . 12 2 2 B 68 68 CYS CB C 489 28.170 26.939 1.231 1
1 1830 . 12 2 2 B 68 68 CYS N N 489 115.230 120.385 -5.155 1
1 1831 . 12 2 2 B 69 69 TRP H H 490 8.230 8.654 -0.424 1
1 1832 . 12 2 2 B 69 69 TRP HA H 490 5.100 4.351 0.749 1
1 1841 . 12 2 2 B 69 69 TRP CA C 490 55.420 60.441 -5.021 1
1 1842 . 12 2 2 B 69 69 TRP CB C 490 31.010 29.156 1.854 1
1 1844 . 12 2 2 B 69 69 TRP N N 490 116.850 120.822 -3.972 1
1 1846 . 12 2 2 B 70 70 PHE H H 491 7.570 7.485 0.085 1
1 1847 . 12 2 2 B 70 70 PHE HA H 491 5.240 4.502 0.738 1
1 1852 . 12 2 2 B 70 70 PHE CA C 491 55.490 59.952 -4.462 1
1 1853 . 12 2 2 B 70 70 PHE CB C 491 38.700 39.189 -0.489 1
1 1856 . 12 2 2 B 70 70 PHE N N 491 117.460 117.891 -0.431 1
1 1857 . 12 2 2 B 71 71 GLY H H 492 8.420 8.303 0.117 1
1 1858 . 12 2 2 B 71 71 GLY HA2 H 492 3.920 3.888 0.032 1
1 1859 . 12 2 2 B 71 71 GLY HA3 H 492 4.080 3.903 0.177 1
1 1860 . 12 2 2 B 71 71 GLY CA C 492 46.210 47.021 -0.811 1
1 1861 . 12 2 2 B 71 71 GLY N N 492 110.040 108.141 1.899 1
1 1862 . 12 2 2 B 72 72 ASP H H 493 8.370 8.866 -0.496 1
1 1863 . 12 2 2 B 72 72 ASP HA H 493 4.630 4.330 0.300 1
1 1866 . 12 2 2 B 72 72 ASP CA C 493 54.410 56.793 -2.383 1
1 1867 . 12 2 2 B 72 72 ASP CB C 493 41.250 40.709 0.541 1
1 1868 . 12 2 2 B 72 72 ASP N N 493 120.000 126.644 -6.644 1
1 1869 . 12 2 2 B 73 73 GLU H H 494 8.230 7.518 0.712 1
1 1870 . 12 2 2 B 73 73 GLU HA H 494 4.260 4.197 0.063 1
1 1875 . 12 2 2 B 73 73 GLU CA C 494 56.510 56.974 -0.464 1
1 1876 . 12 2 2 B 73 73 GLU CB C 494 30.420 30.345 0.075 1
1 1878 . 12 2 2 B 73 73 GLU N N 494 120.900 118.702 2.198 1
1 216 . 13 1 1 A 20 20 ASP H H 250 8.550 7.105 1.445 1
1 217 . 13 1 1 A 20 20 ASP HA H 250 4.700 4.544 0.156 1
1 220 . 13 1 1 A 20 20 ASP CA C 250 52.650 51.986 0.664 1
1 221 . 13 1 1 A 20 20 ASP CB C 250 41.420 41.308 0.112 1
1 222 . 13 1 1 A 20 20 ASP N N 250 125.190 123.023 2.167 1
1 223 . 13 1 1 A 21 21 PRO HA H 251 4.250 4.398 -0.148 1
1 230 . 13 1 1 A 21 21 PRO CA C 251 65.120 64.500 0.620 1
1 231 . 13 1 1 A 21 21 PRO CB C 251 32.310 32.048 0.262 1
1 234 . 13 1 1 A 22 22 ILE H H 252 8.630 7.713 0.917 1
1 235 . 13 1 1 A 22 22 ILE HA H 252 4.060 3.917 0.143 1
1 245 . 13 1 1 A 22 22 ILE CA C 252 62.990 63.129 -0.139 1
1 246 . 13 1 1 A 22 22 ILE CB C 252 37.520 37.665 -0.145 1
1 250 . 13 1 1 A 22 22 ILE N N 252 119.860 117.226 2.634 1
1 251 . 13 1 1 A 23 23 LEU H H 253 7.950 7.649 0.301 1
1 252 . 13 1 1 A 23 23 LEU HA H 253 3.710 4.116 -0.406 1
1 262 . 13 1 1 A 23 23 LEU CA C 253 56.510 58.148 -1.638 1
1 263 . 13 1 1 A 23 23 LEU CB C 253 41.190 41.898 -0.708 1
1 266 . 13 1 1 A 23 23 LEU N N 253 116.850 122.797 -5.947 1
1 267 . 13 1 1 A 24 24 LEU H H 254 7.370 7.690 -0.320 1
1 268 . 13 1 1 A 24 24 LEU HA H 254 4.310 4.455 -0.145 1
1 278 . 13 1 1 A 24 24 LEU CA C 254 54.890 55.781 -0.891 1
1 279 . 13 1 1 A 24 24 LEU CB C 254 41.960 42.612 -0.652 1
1 283 . 13 1 1 A 24 24 LEU N N 254 115.210 117.649 -2.439 1
1 284 . 13 1 1 A 25 25 ARG H H 255 7.520 7.883 -0.363 1
1 285 . 13 1 1 A 25 25 ARG HA H 255 4.660 4.183 0.477 1
1 293 . 13 1 1 A 25 25 ARG CA C 255 52.840 54.286 -1.446 1
1 294 . 13 1 1 A 25 25 ARG CB C 255 28.130 30.385 -2.255 1
1 297 . 13 1 1 A 25 25 ARG N N 255 118.180 121.596 -3.416 1
1 298 . 13 1 1 A 26 26 PRO HA H 256 4.800 4.875 -0.075 1
1 305 . 13 1 1 A 26 26 PRO CA C 256 61.790 62.586 -0.796 1
1 306 . 13 1 1 A 26 26 PRO CB C 256 32.660 32.012 0.648 1
1 309 . 13 1 1 A 27 27 VAL H H 257 8.170 8.396 -0.226 1
1 310 . 13 1 1 A 27 27 VAL HA H 257 3.590 3.759 -0.169 1
1 318 . 13 1 1 A 27 27 VAL CA C 257 64.830 65.772 -0.942 1
1 319 . 13 1 1 A 27 27 VAL CB C 257 31.720 31.556 0.164 1
1 322 . 13 1 1 A 27 27 VAL N N 257 115.710 124.250 -8.540 1
1 323 . 13 1 1 A 28 28 ASP H H 258 8.240 8.078 0.162 1
1 324 . 13 1 1 A 28 28 ASP HA H 258 4.340 4.387 -0.047 1
1 327 . 13 1 1 A 28 28 ASP CA C 258 56.490 57.501 -1.011 1
1 328 . 13 1 1 A 28 28 ASP CB C 258 40.520 40.065 0.455 1
1 329 . 13 1 1 A 28 28 ASP N N 258 119.000 122.004 -3.004 1
1 330 . 13 1 1 A 29 29 ASP H H 259 8.000 8.618 -0.618 1
1 331 . 13 1 1 A 29 29 ASP HA H 259 4.390 4.593 -0.203 1
1 334 . 13 1 1 A 29 29 ASP CA C 259 56.210 55.957 0.253 1
1 335 . 13 1 1 A 29 29 ASP CB C 259 40.670 40.857 -0.187 1
1 336 . 13 1 1 A 29 29 ASP N N 259 118.900 117.836 1.064 1
1 337 . 13 1 1 A 30 30 LEU H H 260 7.760 7.678 0.082 1
1 338 . 13 1 1 A 30 30 LEU HA H 260 3.990 4.227 -0.237 1
1 348 . 13 1 1 A 30 30 LEU CA C 260 55.000 55.195 -0.195 1
1 349 . 13 1 1 A 30 30 LEU CB C 260 41.670 41.829 -0.159 1
1 353 . 13 1 1 A 30 30 LEU N N 260 116.300 121.054 -4.754 1
1 354 . 13 1 1 A 31 31 GLU H H 261 7.990 8.773 -0.783 1
1 355 . 13 1 1 A 31 31 GLU HA H 261 4.280 4.154 0.126 1
1 358 . 13 1 1 A 31 31 GLU CA C 261 56.860 58.801 -1.941 1
1 359 . 13 1 1 A 31 31 GLU CB C 261 27.010 29.701 -2.691 1
1 360 . 13 1 1 A 31 31 GLU N N 261 115.620 122.486 -6.866 1
1 361 . 13 1 1 A 32 32 LEU H H 262 8.000 7.320 0.680 1
1 362 . 13 1 1 A 32 32 LEU HA H 262 4.400 4.349 0.051 1
1 372 . 13 1 1 A 32 32 LEU CA C 262 53.860 55.095 -1.235 1
1 373 . 13 1 1 A 32 32 LEU CB C 262 44.450 42.355 2.095 1
1 377 . 13 1 1 A 32 32 LEU N N 262 118.860 122.828 -3.968 1
1 378 . 13 1 1 A 33 33 THR H H 263 10.020 8.665 1.355 1
1 379 . 13 1 1 A 33 33 THR HA H 263 4.130 4.693 -0.563 1
1 384 . 13 1 1 A 33 33 THR CA C 263 62.400 60.571 1.829 1
1 385 . 13 1 1 A 33 33 THR CB C 263 71.270 71.221 0.049 1
1 387 . 13 1 1 A 33 33 THR N N 263 114.610 113.345 1.265 1
1 388 . 13 1 1 A 34 34 VAL H H 264 8.370 8.812 -0.442 1
1 389 . 13 1 1 A 34 34 VAL HA H 264 3.620 3.620 0.000 1
1 397 . 13 1 1 A 34 34 VAL CA C 264 66.340 66.566 -0.226 1
1 398 . 13 1 1 A 34 34 VAL CB C 264 31.670 31.588 0.082 1
1 401 . 13 1 1 A 34 34 VAL N N 264 122.110 122.293 -0.183 1
1 402 . 13 1 1 A 35 35 ARG H H 265 8.190 8.254 -0.064 1
1 403 . 13 1 1 A 35 35 ARG HA H 265 4.070 3.928 0.142 1
1 411 . 13 1 1 A 35 35 ARG CA C 265 59.470 59.778 -0.308 1
1 412 . 13 1 1 A 35 35 ARG CB C 265 29.790 29.803 -0.013 1
1 415 . 13 1 1 A 35 35 ARG N N 265 117.340 121.066 -3.726 1
1 416 . 13 1 1 A 36 36 SER H H 266 7.610 7.871 -0.261 1
1 417 . 13 1 1 A 36 36 SER HA H 266 4.080 4.110 -0.030 1
1 420 . 13 1 1 A 36 36 SER CA C 266 63.080 61.932 1.148 1
1 421 . 13 1 1 A 36 36 SER CB C 266 63.280 62.788 0.492 1
1 422 . 13 1 1 A 36 36 SER N N 266 116.710 116.974 -0.264 1
1 423 . 13 1 1 A 37 37 ALA H H 267 8.720 7.646 1.074 1
1 424 . 13 1 1 A 37 37 ALA HA H 267 3.760 4.037 -0.277 1
1 428 . 13 1 1 A 37 37 ALA CA C 267 55.900 55.327 0.573 1
1 429 . 13 1 1 A 37 37 ALA CB C 267 18.090 18.419 -0.329 1
1 430 . 13 1 1 A 37 37 ALA N N 267 124.170 123.682 0.488 1
1 431 . 13 1 1 A 38 38 ASN H H 268 8.850 9.305 -0.455 1
1 432 . 13 1 1 A 38 38 ASN HA H 268 4.420 4.530 -0.110 1
1 437 . 13 1 1 A 38 38 ASN CA C 268 55.700 56.176 -0.476 1
1 438 . 13 1 1 A 38 38 ASN CB C 268 37.180 37.800 -0.620 1
1 439 . 13 1 1 A 38 38 ASN N N 268 117.370 117.385 -0.015 1
1 441 . 13 1 1 A 39 39 CYS H H 269 7.970 7.975 -0.005 1
1 442 . 13 1 1 A 39 39 CYS HA H 269 4.190 4.107 0.083 1
1 445 . 13 1 1 A 39 39 CYS CA C 269 63.340 62.966 0.374 1
1 446 . 13 1 1 A 39 39 CYS CB C 269 26.870 27.300 -0.430 1
1 447 . 13 1 1 A 39 39 CYS N N 269 120.510 118.828 1.682 1
1 448 . 13 1 1 A 40 40 LEU H H 270 7.600 7.680 -0.080 1
1 449 . 13 1 1 A 40 40 LEU HA H 270 3.880 3.920 -0.040 1
1 458 . 13 1 1 A 40 40 LEU CA C 270 57.810 57.860 -0.050 1
1 459 . 13 1 1 A 40 40 LEU CB C 270 40.030 41.170 -1.140 1
1 462 . 13 1 1 A 40 40 LEU N N 270 117.710 120.418 -2.708 1
1 463 . 13 1 1 A 41 41 LYS H H 271 7.980 8.697 -0.717 1
1 464 . 13 1 1 A 41 41 LYS HA H 271 3.820 4.232 -0.412 1
1 472 . 13 1 1 A 41 41 LYS CA C 271 59.840 59.122 0.718 1
1 473 . 13 1 1 A 41 41 LYS CB C 271 32.070 32.031 0.039 1
1 476 . 13 1 1 A 41 41 LYS N N 271 120.070 120.650 -0.580 1
1 477 . 13 1 1 A 42 42 ALA H H 272 7.860 8.505 -0.645 1
1 478 . 13 1 1 A 42 42 ALA HA H 272 4.140 4.088 0.052 1
1 482 . 13 1 1 A 42 42 ALA CA C 272 54.670 54.081 0.589 1
1 483 . 13 1 1 A 42 42 ALA CB C 272 17.950 18.189 -0.239 1
1 484 . 13 1 1 A 42 42 ALA N N 272 122.880 121.048 1.832 1
1 485 . 13 1 1 A 43 43 GLU H H 273 7.210 7.912 -0.702 1
1 486 . 13 1 1 A 43 43 GLU HA H 273 4.260 4.417 -0.157 1
1 491 . 13 1 1 A 43 43 GLU CA C 273 55.020 55.870 -0.850 1
1 492 . 13 1 1 A 43 43 GLU CB C 273 29.880 29.508 0.372 1
1 494 . 13 1 1 A 43 43 GLU N N 273 116.590 115.590 1.000 1
1 495 . 13 1 1 A 44 44 ALA H H 274 7.880 7.681 0.199 1
1 496 . 13 1 1 A 44 44 ALA HA H 274 3.680 3.843 -0.163 1
1 500 . 13 1 1 A 44 44 ALA CA C 274 52.960 53.361 -0.401 1
1 501 . 13 1 1 A 44 44 ALA CB C 274 16.110 17.872 -1.762 1
1 502 . 13 1 1 A 44 44 ALA N N 274 118.420 118.524 -0.104 1
1 503 . 13 1 1 A 45 45 ILE H H 275 7.600 7.535 0.065 1
1 504 . 13 1 1 A 45 45 ILE HA H 275 3.870 4.279 -0.409 1
1 514 . 13 1 1 A 45 45 ILE CA C 275 61.150 60.214 0.936 1
1 515 . 13 1 1 A 45 45 ILE CB C 275 37.090 39.041 -1.951 1
1 519 . 13 1 1 A 45 45 ILE N N 275 120.370 118.027 2.343 1
1 520 . 13 1 1 A 46 46 HIS H H 276 8.350 8.844 -0.494 1
1 521 . 13 1 1 A 46 46 HIS HA H 276 4.600 4.834 -0.234 1
1 526 . 13 1 1 A 46 46 HIS CA C 276 56.900 56.917 -0.017 1
1 527 . 13 1 1 A 46 46 HIS CB C 276 31.910 31.738 0.172 1
1 529 . 13 1 1 A 46 46 HIS N N 276 123.250 125.125 -1.875 1
1 530 . 13 1 1 A 47 47 TYR H H 277 8.850 8.085 0.765 1
1 531 . 13 1 1 A 47 47 TYR HA H 277 5.100 5.002 0.098 1
1 538 . 13 1 1 A 47 47 TYR CA C 277 57.430 57.134 0.296 1
1 539 . 13 1 1 A 47 47 TYR CB C 277 40.680 40.961 -0.281 1
1 544 . 13 1 1 A 47 47 TYR N N 277 119.700 117.959 1.741 1
1 545 . 13 1 1 A 48 48 ILE H H 278 9.380 8.675 0.705 1
1 546 . 13 1 1 A 48 48 ILE HA H 278 3.340 3.819 -0.479 1
1 554 . 13 1 1 A 48 48 ILE CA C 278 67.640 64.934 2.706 1
1 555 . 13 1 1 A 48 48 ILE CB C 278 36.310 37.582 -1.272 1
1 558 . 13 1 1 A 48 48 ILE N N 278 125.650 125.285 0.365 1
1 559 . 13 1 1 A 49 49 GLY H H 279 9.430 8.563 0.867 1
1 560 . 13 1 1 A 49 49 GLY HA2 H 279 2.370 3.799 -1.429 1
1 561 . 13 1 1 A 49 49 GLY HA3 H 279 3.230 3.824 -0.594 1
1 562 . 13 1 1 A 49 49 GLY CA C 279 46.820 47.589 -0.769 1
1 563 . 13 1 1 A 49 49 GLY N N 279 105.200 108.842 -3.642 1
1 564 . 13 1 1 A 50 50 ASP H H 280 7.050 8.473 -1.423 1
1 565 . 13 1 1 A 50 50 ASP HA H 280 4.360 4.581 -0.221 1
1 568 . 13 1 1 A 50 50 ASP CA C 280 57.110 56.665 0.445 1
1 569 . 13 1 1 A 50 50 ASP CB C 280 42.620 40.644 1.976 1
1 570 . 13 1 1 A 50 50 ASP N N 280 116.360 121.695 -5.335 1
1 571 . 13 1 1 A 51 51 LEU H H 281 7.170 8.576 -1.406 1
1 572 . 13 1 1 A 51 51 LEU HA H 281 3.880 4.078 -0.198 1
1 582 . 13 1 1 A 51 51 LEU CA C 281 57.900 58.428 -0.528 1
1 583 . 13 1 1 A 51 51 LEU CB C 281 41.870 41.626 0.244 1
1 587 . 13 1 1 A 51 51 LEU N N 281 120.130 122.245 -2.115 1
1 588 . 13 1 1 A 52 52 VAL H H 282 7.820 7.728 0.092 1
1 589 . 13 1 1 A 52 52 VAL HA H 282 3.980 3.902 0.078 1
1 597 . 13 1 1 A 52 52 VAL CA C 282 64.000 65.612 -1.612 1
1 598 . 13 1 1 A 52 52 VAL CB C 282 30.400 31.409 -1.009 1
1 601 . 13 1 1 A 52 52 VAL N N 282 105.550 115.674 -10.124 1
1 602 . 13 1 1 A 53 53 GLN H H 283 6.550 8.050 -1.500 1
1 603 . 13 1 1 A 53 53 GLN HA H 283 4.680 4.115 0.565 1
1 610 . 13 1 1 A 53 53 GLN CA C 283 56.210 58.874 -2.664 1
1 611 . 13 1 1 A 53 53 GLN CB C 283 31.710 28.740 2.970 1
1 613 . 13 1 1 A 53 53 GLN N N 283 114.060 121.935 -7.875 1
1 615 . 13 1 1 A 54 54 ARG H H 284 7.690 7.629 0.061 1
1 616 . 13 1 1 A 54 54 ARG HA H 284 4.520 4.804 -0.284 1
1 624 . 13 1 1 A 54 54 ARG CA C 284 54.600 54.468 0.132 1
1 625 . 13 1 1 A 54 54 ARG CB C 284 30.750 32.934 -2.184 1
1 628 . 13 1 1 A 54 54 ARG N N 284 119.810 118.299 1.511 1
1 629 . 13 1 1 A 55 55 THR H H 285 8.110 8.843 -0.733 1
1 630 . 13 1 1 A 55 55 THR HA H 285 4.430 4.613 -0.183 1
1 635 . 13 1 1 A 55 55 THR CA C 285 59.640 60.812 -1.172 1
1 636 . 13 1 1 A 55 55 THR CB C 285 71.310 70.787 0.523 1
1 638 . 13 1 1 A 55 55 THR N N 285 108.450 114.091 -5.641 1
1 639 . 13 1 1 A 56 56 GLU H H 286 8.910 9.131 -0.221 1
1 640 . 13 1 1 A 56 56 GLU HA H 286 3.660 4.017 -0.357 1
1 645 . 13 1 1 A 56 56 GLU CA C 286 60.650 59.630 1.020 1
1 646 . 13 1 1 A 56 56 GLU CB C 286 29.400 29.197 0.203 1
1 648 . 13 1 1 A 56 56 GLU N N 286 120.600 121.652 -1.052 1
1 649 . 13 1 1 A 57 57 VAL H H 287 7.600 8.132 -0.532 1
1 650 . 13 1 1 A 57 57 VAL HA H 287 3.620 3.536 0.084 1
1 658 . 13 1 1 A 57 57 VAL CA C 287 66.020 67.170 -1.150 1
1 659 . 13 1 1 A 57 57 VAL CB C 287 31.720 31.577 0.143 1
1 662 . 13 1 1 A 57 57 VAL N N 287 114.050 120.754 -6.704 1
1 663 . 13 1 1 A 58 58 GLU H H 288 7.350 8.121 -0.771 1
1 664 . 13 1 1 A 58 58 GLU HA H 288 3.830 4.049 -0.219 1
1 669 . 13 1 1 A 58 58 GLU CA C 288 59.250 59.646 -0.396 1
1 670 . 13 1 1 A 58 58 GLU CB C 288 30.030 29.293 0.737 1
1 672 . 13 1 1 A 58 58 GLU N N 288 117.610 119.232 -1.622 1
1 673 . 13 1 1 A 59 59 LEU H H 289 7.850 7.793 0.057 1
1 674 . 13 1 1 A 59 59 LEU HA H 289 4.150 4.170 -0.020 1
1 683 . 13 1 1 A 59 59 LEU CA C 289 57.340 57.126 0.214 1
1 684 . 13 1 1 A 59 59 LEU CB C 289 41.170 41.523 -0.353 1
1 687 . 13 1 1 A 59 59 LEU N N 289 120.050 120.539 -0.489 1
1 688 . 13 1 1 A 60 60 LEU H H 290 7.670 8.663 -0.993 1
1 689 . 13 1 1 A 60 60 LEU HA H 290 4.540 4.128 0.412 1
1 696 . 13 1 1 A 60 60 LEU CA C 290 55.090 56.608 -1.518 1
1 697 . 13 1 1 A 60 60 LEU CB C 290 42.320 41.614 0.706 1
1 701 . 13 1 1 A 60 60 LEU N N 290 114.980 119.885 -4.905 1
1 702 . 13 1 1 A 61 61 LYS H H 291 7.440 7.344 0.096 1
1 703 . 13 1 1 A 61 61 LYS HA H 291 4.280 4.297 -0.017 1
1 710 . 13 1 1 A 61 61 LYS CA C 291 56.860 56.705 0.155 1
1 711 . 13 1 1 A 61 61 LYS CB C 291 31.900 32.884 -0.984 1
1 714 . 13 1 1 A 61 61 LYS N N 291 118.120 116.158 1.962 1
1 715 . 13 1 1 A 62 62 THR H H 292 7.310 7.280 0.030 1
1 716 . 13 1 1 A 62 62 THR HA H 292 5.220 4.755 0.465 1
1 721 . 13 1 1 A 62 62 THR CA C 292 55.830 57.892 -2.062 1
1 722 . 13 1 1 A 62 62 THR CB C 292 69.970 71.789 -1.819 1
1 724 . 13 1 1 A 62 62 THR N N 292 111.890 114.390 -2.500 1
1 725 . 13 1 1 A 63 63 PRO HA H 293 4.570 4.494 0.076 1
1 730 . 13 1 1 A 63 63 PRO CA C 293 63.710 64.416 -0.706 1
1 731 . 13 1 1 A 63 63 PRO CB C 293 32.380 31.851 0.529 1
1 733 . 13 1 1 A 64 64 ASN H H 294 8.050 8.871 -0.821 1
1 734 . 13 1 1 A 64 64 ASN HA H 294 4.490 4.407 0.083 1
1 739 . 13 1 1 A 64 64 ASN CA C 294 55.630 56.112 -0.482 1
1 740 . 13 1 1 A 64 64 ASN CB C 294 38.730 38.387 0.343 1
1 741 . 13 1 1 A 64 64 ASN N N 294 117.120 116.955 0.165 1
1 743 . 13 1 1 A 65 65 LEU H H 295 7.550 7.732 -0.182 1
1 744 . 13 1 1 A 65 65 LEU HA H 295 4.640 4.797 -0.157 1
1 754 . 13 1 1 A 65 65 LEU CA C 295 54.310 53.093 1.217 1
1 755 . 13 1 1 A 65 65 LEU CB C 295 43.640 44.181 -0.541 1
1 758 . 13 1 1 A 65 65 LEU N N 295 119.930 116.119 3.811 1
1 759 . 13 1 1 A 66 66 GLY H H 296 7.850 8.216 -0.366 1
1 760 . 13 1 1 A 66 66 GLY HA2 H 296 3.810 4.138 -0.328 1
1 761 . 13 1 1 A 66 66 GLY HA3 H 296 4.110 4.138 -0.028 1
1 762 . 13 1 1 A 66 66 GLY CA C 296 43.570 44.145 -0.575 1
1 763 . 13 1 1 A 66 66 GLY N N 296 108.840 108.039 0.801 1
1 764 . 13 1 1 A 67 67 LYS H H 297 8.820 8.744 0.076 1
1 765 . 13 1 1 A 67 67 LYS HA H 297 3.980 3.955 0.025 1
1 774 . 13 1 1 A 67 67 LYS CA C 297 60.100 58.999 1.101 1
1 775 . 13 1 1 A 67 67 LYS CB C 297 32.100 32.119 -0.019 1
1 779 . 13 1 1 A 67 67 LYS N N 297 120.130 119.545 0.585 1
1 780 . 13 1 1 A 68 68 LYS H H 298 8.850 7.903 0.947 1
1 781 . 13 1 1 A 68 68 LYS HA H 298 4.060 4.024 0.036 1
1 790 . 13 1 1 A 68 68 LYS CA C 298 60.600 59.170 1.430 1
1 791 . 13 1 1 A 68 68 LYS CB C 298 31.920 32.103 -0.183 1
1 795 . 13 1 1 A 68 68 LYS N N 298 119.580 118.981 0.599 1
1 796 . 13 1 1 A 69 69 SER H H 299 8.100 8.067 0.033 1
1 797 . 13 1 1 A 69 69 SER HA H 299 4.370 4.118 0.252 1
1 800 . 13 1 1 A 69 69 SER CA C 299 61.980 62.178 -0.198 1
1 801 . 13 1 1 A 69 69 SER CB C 299 63.000 62.952 0.048 1
1 802 . 13 1 1 A 69 69 SER N N 299 116.360 117.083 -0.723 1
1 803 . 13 1 1 A 70 70 LEU H H 300 8.240 7.783 0.457 1
1 804 . 13 1 1 A 70 70 LEU HA H 300 3.970 4.080 -0.110 1
1 814 . 13 1 1 A 70 70 LEU CA C 300 57.610 57.918 -0.308 1
1 815 . 13 1 1 A 70 70 LEU CB C 300 41.060 41.563 -0.503 1
1 819 . 13 1 1 A 70 70 LEU N N 300 123.330 122.914 0.416 1
1 820 . 13 1 1 A 71 71 THR H H 301 8.550 7.572 0.978 1
1 821 . 13 1 1 A 71 71 THR HA H 301 3.690 3.792 -0.102 1
1 826 . 13 1 1 A 71 71 THR CA C 301 67.170 66.709 0.461 1
1 827 . 13 1 1 A 71 71 THR CB C 301 68.810 68.504 0.306 1
1 829 . 13 1 1 A 71 71 THR N N 301 116.520 114.494 2.026 1
1 830 . 13 1 1 A 72 72 GLU H H 302 7.520 7.975 -0.455 1
1 831 . 13 1 1 A 72 72 GLU HA H 302 4.070 3.989 0.081 1
1 836 . 13 1 1 A 72 72 GLU CA C 302 59.470 59.425 0.045 1
1 837 . 13 1 1 A 72 72 GLU CB C 302 29.090 29.428 -0.338 1
1 839 . 13 1 1 A 72 72 GLU N N 302 121.510 120.708 0.802 1
1 840 . 13 1 1 A 73 73 ILE H H 303 8.290 8.021 0.269 1
1 841 . 13 1 1 A 73 73 ILE HA H 303 3.380 3.648 -0.268 1
1 849 . 13 1 1 A 73 73 ILE CA C 303 66.010 65.503 0.507 1
1 850 . 13 1 1 A 73 73 ILE CB C 303 38.680 37.780 0.900 1
1 853 . 13 1 1 A 73 73 ILE N N 303 118.510 120.346 -1.836 1
1 854 . 13 1 1 A 74 74 LYS H H 304 8.550 8.072 0.478 1
1 855 . 13 1 1 A 74 74 LYS HA H 304 3.680 3.816 -0.136 1
1 864 . 13 1 1 A 74 74 LYS CA C 304 61.320 60.552 0.768 1
1 865 . 13 1 1 A 74 74 LYS CB C 304 32.060 31.962 0.098 1
1 868 . 13 1 1 A 74 74 LYS N N 304 118.220 119.042 -0.822 1
1 869 . 13 1 1 A 75 75 ASP H H 305 8.450 7.964 0.486 1
1 870 . 13 1 1 A 75 75 ASP HA H 305 4.440 4.336 0.104 1
1 873 . 13 1 1 A 75 75 ASP CA C 305 57.690 57.651 0.039 1
1 874 . 13 1 1 A 75 75 ASP CB C 305 40.220 41.657 -1.437 1
1 875 . 13 1 1 A 75 75 ASP N N 305 121.790 119.943 1.847 1
1 876 . 13 1 1 A 76 76 VAL H H 306 8.680 7.862 0.818 1
1 877 . 13 1 1 A 76 76 VAL HA H 306 3.890 3.622 0.268 1
1 885 . 13 1 1 A 76 76 VAL CA C 306 66.020 66.256 -0.236 1
1 886 . 13 1 1 A 76 76 VAL CB C 306 31.250 31.444 -0.194 1
1 889 . 13 1 1 A 76 76 VAL N N 306 121.150 119.124 2.026 1
1 890 . 13 1 1 A 77 77 LEU H H 307 8.470 8.822 -0.352 1
1 891 . 13 1 1 A 77 77 LEU HA H 307 3.810 4.159 -0.349 1
1 901 . 13 1 1 A 77 77 LEU CA C 307 58.330 57.573 0.757 1
1 902 . 13 1 1 A 77 77 LEU CB C 307 41.250 41.256 -0.006 1
1 906 . 13 1 1 A 77 77 LEU N N 307 120.830 120.276 0.554 1
1 907 . 13 1 1 A 78 78 ALA H H 308 8.280 8.273 0.007 1
1 908 . 13 1 1 A 78 78 ALA HA H 308 4.320 4.115 0.205 1
1 912 . 13 1 1 A 78 78 ALA CA C 308 55.420 55.048 0.372 1
1 913 . 13 1 1 A 78 78 ALA CB C 308 17.750 17.930 -0.180 1
1 914 . 13 1 1 A 78 78 ALA N N 308 122.530 121.368 1.162 1
1 915 . 13 1 1 A 79 79 SER H H 309 7.900 7.637 0.263 1
1 916 . 13 1 1 A 79 79 SER HA H 309 4.340 4.524 -0.184 1
1 919 . 13 1 1 A 79 79 SER CA C 309 61.350 58.037 3.313 1
1 920 . 13 1 1 A 79 79 SER CB C 309 63.280 63.265 0.015 1
1 921 . 13 1 1 A 79 79 SER N N 309 115.600 112.952 2.648 1
1 922 . 13 1 1 A 80 80 ARG H H 310 7.450 8.251 -0.801 1
1 923 . 13 1 1 A 80 80 ARG HA H 310 4.550 3.986 0.564 1
1 931 . 13 1 1 A 80 80 ARG CA C 310 54.200 57.476 -3.276 1
1 932 . 13 1 1 A 80 80 ARG CB C 310 30.680 27.297 3.383 1
1 935 . 13 1 1 A 80 80 ARG N N 310 119.360 116.837 2.523 1
1 936 . 13 1 1 A 81 81 GLY H H 311 7.940 8.090 -0.150 1
1 937 . 13 1 1 A 81 81 GLY HA2 H 311 3.840 3.617 0.223 1
1 938 . 13 1 1 A 81 81 GLY HA3 H 311 4.070 3.637 0.433 1
1 939 . 13 1 1 A 81 81 GLY CA C 311 46.060 47.373 -1.313 1
1 940 . 13 1 1 A 81 81 GLY N N 311 108.130 107.117 1.013 1
1 941 . 13 1 1 A 82 82 LEU H H 312 7.920 7.669 0.251 1
1 942 . 13 1 1 A 82 82 LEU HA H 312 4.680 4.784 -0.104 1
1 952 . 13 1 1 A 82 82 LEU CA C 312 53.070 52.680 0.390 1
1 953 . 13 1 1 A 82 82 LEU CB C 312 45.790 45.749 0.041 1
1 957 . 13 1 1 A 82 82 LEU N N 312 119.290 114.690 4.600 1
1 958 . 13 1 1 A 83 83 SER H H 313 7.530 9.037 -1.507 1
1 959 . 13 1 1 A 83 83 SER HA H 313 4.450 4.244 0.206 1
1 962 . 13 1 1 A 83 83 SER CA C 313 57.190 59.311 -2.121 1
1 963 . 13 1 1 A 83 83 SER CB C 313 66.080 62.884 3.196 1
1 964 . 13 1 1 A 83 83 SER N N 313 113.120 114.858 -1.738 1
1 965 . 13 1 1 A 84 84 LEU H H 314 8.340 8.232 0.108 1
1 966 . 13 1 1 A 84 84 LEU HA H 314 4.620 4.301 0.319 1
1 976 . 13 1 1 A 84 84 LEU CA C 314 54.720 55.207 -0.487 1
1 977 . 13 1 1 A 84 84 LEU CB C 314 41.620 42.456 -0.836 1
1 981 . 13 1 1 A 84 84 LEU N N 314 115.930 120.068 -4.138 1
1 982 . 13 1 1 A 85 85 GLY H H 315 8.270 7.948 0.322 1
1 983 . 13 1 1 A 85 85 GLY HA2 H 315 3.320 3.960 -0.640 1
1 984 . 13 1 1 A 85 85 GLY HA3 H 315 3.850 3.961 -0.111 1
1 985 . 13 1 1 A 85 85 GLY CA C 315 46.560 46.651 -0.091 1
1 986 . 13 1 1 A 85 85 GLY N N 315 111.010 108.171 2.839 1
1 987 . 13 1 1 A 86 86 MET H H 316 8.650 7.883 0.767 1
1 988 . 13 1 1 A 86 86 MET HA H 316 3.990 5.043 -1.053 1
1 996 . 13 1 1 A 86 86 MET CA C 316 56.730 53.147 3.583 1
1 997 . 13 1 1 A 86 86 MET CB C 316 33.600 35.640 -2.040 1
1 1000 . 13 1 1 A 86 86 MET N N 316 120.570 116.955 3.615 1
1 1001 . 13 1 1 A 87 87 ARG H H 317 8.360 8.719 -0.359 1
1 1002 . 13 1 1 A 87 87 ARG HA H 317 4.450 5.020 -0.570 1
1 1010 . 13 1 1 A 87 87 ARG CA C 317 55.310 54.765 0.545 1
1 1011 . 13 1 1 A 87 87 ARG CB C 317 30.490 33.312 -2.822 1
1 1014 . 13 1 1 A 87 87 ARG N N 317 122.290 119.041 3.249 1
1 1015 . 13 1 1 A 88 88 LEU H H 318 8.400 8.807 -0.407 1
1 1016 . 13 1 1 A 88 88 LEU HA H 318 4.670 4.828 -0.158 1
1 1026 . 13 1 1 A 88 88 LEU CA C 318 53.110 53.337 -0.227 1
1 1027 . 13 1 1 A 88 88 LEU CB C 318 43.600 43.666 -0.066 1
1 1031 . 13 1 1 A 88 88 LEU N N 318 126.420 125.207 1.213 1
1 1032 . 13 1 1 A 89 89 GLU H H 319 8.780 9.088 -0.308 1
1 1033 . 13 1 1 A 89 89 GLU HA H 319 4.340 3.985 0.355 1
1 1038 . 13 1 1 A 89 89 GLU CA C 319 56.490 59.430 -2.940 1
1 1039 . 13 1 1 A 89 89 GLU CB C 319 30.470 29.391 1.079 1
1 1041 . 13 1 1 A 89 89 GLU N N 319 123.070 123.997 -0.927 1
1 1042 . 13 1 1 A 90 90 ASN H H 320 8.900 8.681 0.219 1
1 1043 . 13 1 1 A 90 90 ASN HA H 320 4.410 5.127 -0.717 1
1 1048 . 13 1 1 A 90 90 ASN CA C 320 54.120 55.155 -1.035 1
1 1049 . 13 1 1 A 90 90 ASN CB C 320 37.640 40.640 -3.000 1
1 1050 . 13 1 1 A 90 90 ASN N N 320 116.540 115.938 0.602 1
1 1052 . 13 1 1 A 91 91 TRP H H 321 7.990 7.512 0.478 1
1 1053 . 13 1 1 A 91 91 TRP HA H 321 4.330 4.809 -0.479 1
1 1062 . 13 1 1 A 91 91 TRP CA C 321 54.590 58.150 -3.560 1
1 1063 . 13 1 1 A 91 91 TRP CB C 321 31.280 31.598 -0.318 1
1 1069 . 13 1 1 A 91 91 TRP N N 321 119.230 118.279 0.951 1
1 1071 . 13 1 1 A 92 92 PRO HA H 322 4.800 4.635 0.165 1
1 1077 . 13 1 1 A 93 93 PRO HA H 323 4.450 4.584 -0.134 1
1 1084 . 13 1 1 A 93 93 PRO CA C 323 61.970 62.672 -0.702 1
1 1085 . 13 1 1 A 93 93 PRO CB C 323 32.830 32.752 0.078 1
1 1088 . 13 1 1 A 94 94 ALA H H 324 8.460 8.770 -0.310 1
1 1089 . 13 1 1 A 94 94 ALA HA H 324 4.000 4.041 -0.041 1
1 1093 . 13 1 1 A 94 94 ALA CA C 324 53.790 55.092 -1.302 1
1 1094 . 13 1 1 A 94 94 ALA CB C 324 18.640 17.997 0.643 1
1 1095 . 13 1 1 A 94 94 ALA N N 324 124.010 126.218 -2.208 1
1 1096 . 13 1 1 A 95 95 SER H H 325 7.950 8.042 -0.092 1
1 1097 . 13 1 1 A 95 95 SER HA H 325 4.210 4.164 0.046 1
1 1100 . 13 1 1 A 95 95 SER CA C 325 58.970 62.630 -3.660 1
1 1101 . 13 1 1 A 95 95 SER CB C 325 63.040 63.116 -0.076 1
1 1102 . 13 1 1 A 95 95 SER N N 325 111.520 114.519 -2.999 1
1 1103 . 13 1 1 A 96 96 ILE H H 326 7.480 7.940 -0.460 1
1 1104 . 13 1 1 A 96 96 ILE HA H 326 4.170 3.835 0.335 1
1 1114 . 13 1 1 A 96 96 ILE CA C 326 61.300 65.493 -4.193 1
1 1115 . 13 1 1 A 96 96 ILE CB C 326 38.530 38.025 0.505 1
1 1119 . 13 1 1 A 96 96 ILE N N 326 119.650 119.439 0.211 1
1 1120 . 13 1 1 A 97 97 ALA H H 327 7.860 7.373 0.487 1
1 1121 . 13 1 1 A 97 97 ALA HA H 327 4.230 4.287 -0.057 1
1 1125 . 13 1 1 A 97 97 ALA CA C 327 52.570 52.135 0.435 1
1 1126 . 13 1 1 A 97 97 ALA CB C 327 19.590 19.737 -0.147 1
1 1127 . 13 1 1 A 97 97 ALA N N 327 126.480 123.395 3.085 1
1 1128 . 13 1 1 A 98 98 ASP H H 328 8.250 8.988 -0.738 1
1 1129 . 13 1 1 A 98 98 ASP HA H 328 4.540 4.268 0.272 1
1 1132 . 13 1 1 A 98 98 ASP CA C 328 54.150 57.656 -3.506 1
1 1133 . 13 1 1 A 98 98 ASP CB C 328 41.120 41.274 -0.154 1
1 1134 . 13 1 1 A 98 98 ASP N N 328 120.130 123.122 -2.992 1
1 1150 . 13 2 2 B 6 6 ASP H H 427 8.160 7.995 0.165 1
1 1151 . 13 2 2 B 6 6 ASP HA H 427 4.630 4.266 0.364 1
1 1154 . 13 2 2 B 6 6 ASP CA C 427 54.410 56.931 -2.521 1
1 1155 . 13 2 2 B 6 6 ASP CB C 427 41.250 40.496 0.754 1
1 1156 . 13 2 2 B 6 6 ASP N N 427 120.160 121.473 -1.313 1
1 1157 . 13 2 2 B 7 7 ASN H H 428 8.350 7.983 0.367 1
1 1158 . 13 2 2 B 7 7 ASN HA H 428 4.550 4.267 0.283 1
1 1163 . 13 2 2 B 7 7 ASN CA C 428 53.310 54.455 -1.145 1
1 1164 . 13 2 2 B 7 7 ASN CB C 428 38.850 36.664 2.186 1
1 1165 . 13 2 2 B 7 7 ASN N N 428 118.440 114.736 3.704 1
1 1167 . 13 2 2 B 8 8 LYS H H 429 8.030 7.919 0.111 1
1 1172 . 13 2 2 B 8 8 LYS CB C 429 33.280 32.658 0.622 1
1 1174 . 13 2 2 B 8 8 LYS N N 429 120.260 118.523 1.737 1
1 1175 . 13 2 2 B 9 9 PRO HA H 430 4.420 4.522 -0.102 1
1 1182 . 13 2 2 B 9 9 PRO CA C 430 62.280 62.694 -0.414 1
1 1183 . 13 2 2 B 9 9 PRO CB C 430 31.920 32.511 -0.591 1
1 1186 . 13 2 2 B 10 10 ALA H H 431 8.930 8.245 0.685 1
1 1187 . 13 2 2 B 10 10 ALA HA H 431 4.350 4.501 -0.151 1
1 1191 . 13 2 2 B 10 10 ALA CA C 431 51.070 52.283 -1.213 1
1 1192 . 13 2 2 B 10 10 ALA CB C 431 20.920 19.437 1.483 1
1 1193 . 13 2 2 B 10 10 ALA N N 431 125.000 124.787 0.213 1
1 1194 . 13 2 2 B 11 11 ASP H H 432 8.530 9.281 -0.751 1
1 1195 . 13 2 2 B 11 11 ASP HA H 432 4.220 4.270 -0.050 1
1 1198 . 13 2 2 B 11 11 ASP CA C 432 57.520 57.480 0.040 1
1 1199 . 13 2 2 B 11 11 ASP CB C 432 40.470 40.299 0.171 1
1 1200 . 13 2 2 B 11 11 ASP N N 432 119.610 122.647 -3.037 1
1 1201 . 13 2 2 B 12 12 ASP H H 433 8.340 8.001 0.339 1
1 1202 . 13 2 2 B 12 12 ASP HA H 433 4.160 4.427 -0.267 1
1 1205 . 13 2 2 B 12 12 ASP CA C 433 56.090 57.365 -1.275 1
1 1206 . 13 2 2 B 12 12 ASP CB C 433 38.960 41.199 -2.239 1
1 1207 . 13 2 2 B 12 12 ASP N N 433 116.330 120.084 -3.754 1
1 1208 . 13 2 2 B 13 13 LEU H H 434 7.360 7.871 -0.511 1
1 1209 . 13 2 2 B 13 13 LEU HA H 434 4.050 4.067 -0.017 1
1 1219 . 13 2 2 B 13 13 LEU CA C 434 57.340 57.845 -0.505 1
1 1220 . 13 2 2 B 13 13 LEU CB C 434 42.960 41.594 1.366 1
1 1224 . 13 2 2 B 13 13 LEU N N 434 123.440 121.263 2.177 1
1 1225 . 13 2 2 B 14 14 LEU H H 435 7.670 8.399 -0.729 1
1 1226 . 13 2 2 B 14 14 LEU HA H 435 3.710 4.000 -0.290 1
1 1236 . 13 2 2 B 14 14 LEU CA C 435 57.170 57.938 -0.768 1
1 1237 . 13 2 2 B 14 14 LEU CB C 435 42.590 40.998 1.592 1
1 1241 . 13 2 2 B 14 14 LEU N N 435 115.170 119.692 -4.522 1
1 1242 . 13 2 2 B 15 15 ASN H H 436 7.490 7.821 -0.331 1
1 1243 . 13 2 2 B 15 15 ASN HA H 436 4.640 4.835 -0.195 1
1 1248 . 13 2 2 B 15 15 ASN CA C 436 52.920 53.368 -0.448 1
1 1249 . 13 2 2 B 15 15 ASN CB C 436 39.350 39.023 0.327 1
1 1250 . 13 2 2 B 15 15 ASN N N 436 112.280 115.056 -2.776 1
1 1252 . 13 2 2 B 16 16 LEU H H 437 7.300 7.175 0.125 1
1 1253 . 13 2 2 B 16 16 LEU HA H 437 4.100 4.239 -0.139 1
1 1263 . 13 2 2 B 16 16 LEU CA C 437 55.310 55.240 0.070 1
1 1264 . 13 2 2 B 16 16 LEU CB C 437 41.800 43.005 -1.205 1
1 1268 . 13 2 2 B 16 16 LEU N N 437 125.180 122.950 2.230 1
1 1269 . 13 2 2 B 17 17 GLU H H 438 8.590 8.724 -0.134 1
1 1270 . 13 2 2 B 17 17 GLU HA H 438 3.920 4.064 -0.144 1
1 1275 . 13 2 2 B 17 17 GLU CA C 438 58.440 57.935 0.505 1
1 1276 . 13 2 2 B 17 17 GLU CB C 438 29.180 29.870 -0.690 1
1 1278 . 13 2 2 B 17 17 GLU N N 438 129.850 126.085 3.765 1
1 1279 . 13 2 2 B 18 18 GLY H H 439 8.580 8.974 -0.394 1
1 1280 . 13 2 2 B 18 18 GLY HA2 H 439 3.570 3.923 -0.353 1
1 1281 . 13 2 2 B 18 18 GLY HA3 H 439 4.220 3.927 0.293 1
1 1282 . 13 2 2 B 18 18 GLY CA C 439 44.710 45.481 -0.771 1
1 1283 . 13 2 2 B 18 18 GLY N N 439 112.250 114.940 -2.690 1
1 1284 . 13 2 2 B 19 19 VAL H H 440 7.900 7.735 0.165 1
1 1285 . 13 2 2 B 19 19 VAL HA H 440 3.950 4.389 -0.439 1
1 1293 . 13 2 2 B 19 19 VAL CA C 440 62.820 61.051 1.769 1
1 1294 . 13 2 2 B 19 19 VAL CB C 440 31.470 34.239 -2.769 1
1 1297 . 13 2 2 B 19 19 VAL N N 440 121.910 121.696 0.214 1
1 1298 . 13 2 2 B 20 20 ASP H H 441 7.390 8.771 -1.381 1
1 1299 . 13 2 2 B 20 20 ASP HA H 441 4.820 4.724 0.096 1
1 1302 . 13 2 2 B 20 20 ASP CA C 441 51.920 53.697 -1.777 1
1 1303 . 13 2 2 B 20 20 ASP CB C 441 42.090 41.579 0.511 1
1 1304 . 13 2 2 B 20 20 ASP N N 441 124.850 126.622 -1.772 1
1 1305 . 13 2 2 B 21 21 ARG H H 442 8.630 8.760 -0.130 1
1 1306 . 13 2 2 B 21 21 ARG HA H 442 3.810 3.526 0.284 1
1 1313 . 13 2 2 B 21 21 ARG CA C 442 60.710 59.925 0.785 1
1 1314 . 13 2 2 B 21 21 ARG CB C 442 30.020 29.911 0.109 1
1 1317 . 13 2 2 B 21 21 ARG N N 442 120.890 122.654 -1.764 1
1 1318 . 13 2 2 B 22 22 ASP H H 443 8.140 7.872 0.268 1
1 1319 . 13 2 2 B 22 22 ASP HA H 443 4.420 4.332 0.088 1
1 1322 . 13 2 2 B 22 22 ASP CA C 443 57.680 56.956 0.724 1
1 1323 . 13 2 2 B 22 22 ASP CB C 443 40.880 40.486 0.394 1
1 1324 . 13 2 2 B 22 22 ASP N N 443 116.750 119.624 -2.874 1
1 1325 . 13 2 2 B 23 23 LEU H H 444 8.170 7.732 0.438 1
1 1326 . 13 2 2 B 23 23 LEU HA H 444 4.130 4.068 0.062 1
1 1336 . 13 2 2 B 23 23 LEU CA C 444 57.770 57.844 -0.074 1
1 1337 . 13 2 2 B 23 23 LEU CB C 444 41.230 41.147 0.083 1
1 1341 . 13 2 2 B 23 23 LEU N N 444 122.130 121.497 0.633 1
1 1342 . 13 2 2 B 24 24 ALA H H 445 8.630 8.298 0.332 1
1 1343 . 13 2 2 B 24 24 ALA HA H 445 3.790 3.999 -0.209 1
1 1347 . 13 2 2 B 24 24 ALA CA C 445 55.810 54.379 1.431 1
1 1348 . 13 2 2 B 24 24 ALA CB C 445 18.060 18.110 -0.050 1
1 1349 . 13 2 2 B 24 24 ALA N N 445 120.890 120.595 0.295 1
1 1350 . 13 2 2 B 25 25 PHE H H 446 8.160 7.336 0.824 1
1 1351 . 13 2 2 B 25 25 PHE HA H 446 4.080 4.325 -0.245 1
1 1358 . 13 2 2 B 25 25 PHE CA C 446 62.670 61.750 0.920 1
1 1359 . 13 2 2 B 25 25 PHE CB C 446 39.440 38.568 0.872 1
1 1364 . 13 2 2 B 25 25 PHE N N 446 115.360 116.336 -0.976 1
1 1365 . 13 2 2 B 26 26 LYS H H 447 8.040 7.601 0.439 1
1 1366 . 13 2 2 B 26 26 LYS HA H 447 4.110 3.998 0.112 1
1 1375 . 13 2 2 B 26 26 LYS CA C 447 60.140 59.060 1.080 1
1 1376 . 13 2 2 B 26 26 LYS CB C 447 32.880 32.402 0.478 1
1 1380 . 13 2 2 B 26 26 LYS N N 447 123.110 118.568 4.542 1
1 1381 . 13 2 2 B 27 27 LEU H H 448 8.630 7.929 0.701 1
1 1382 . 13 2 2 B 27 27 LEU HA H 448 3.840 4.114 -0.274 1
1 1392 . 13 2 2 B 27 27 LEU CA C 448 58.210 58.080 0.130 1
1 1393 . 13 2 2 B 27 27 LEU CB C 448 39.760 41.458 -1.698 1
1 1396 . 13 2 2 B 27 27 LEU N N 448 120.890 121.376 -0.486 1
1 1397 . 13 2 2 B 28 28 ALA H H 449 8.200 8.232 -0.032 1
1 1398 . 13 2 2 B 28 28 ALA HA H 449 3.760 4.509 -0.749 1
1 1402 . 13 2 2 B 28 28 ALA CA C 449 54.750 55.303 -0.553 1
1 1403 . 13 2 2 B 28 28 ALA CB C 449 18.050 18.202 -0.152 1
1 1404 . 13 2 2 B 28 28 ALA N N 449 123.710 120.624 3.086 1
1 1405 . 13 2 2 B 29 29 ALA H H 450 7.780 7.813 -0.033 1
1 1406 . 13 2 2 B 29 29 ALA HA H 450 4.170 4.013 0.157 1
1 1410 . 13 2 2 B 29 29 ALA CA C 450 54.430 55.191 -0.761 1
1 1411 . 13 2 2 B 29 29 ALA CB C 450 18.040 18.671 -0.631 1
1 1412 . 13 2 2 B 29 29 ALA N N 450 121.020 119.340 1.680 1
1 1413 . 13 2 2 B 30 30 ARG H H 451 7.390 7.648 -0.258 1
1 1414 . 13 2 2 B 30 30 ARG HA H 451 4.540 4.407 0.133 1
1 1421 . 13 2 2 B 30 30 ARG CA C 451 54.510 55.691 -1.181 1
1 1422 . 13 2 2 B 30 30 ARG CB C 451 29.950 29.659 0.291 1
1 1425 . 13 2 2 B 30 30 ARG N N 451 115.480 116.096 -0.616 1
1 1426 . 13 2 2 B 31 31 GLY H H 452 7.950 8.495 -0.545 1
1 1427 . 13 2 2 B 31 31 GLY HA2 H 452 3.550 3.994 -0.444 1
1 1428 . 13 2 2 B 31 31 GLY HA3 H 452 4.200 3.996 0.204 1
1 1429 . 13 2 2 B 31 31 GLY CA C 452 45.380 45.371 0.009 1
1 1430 . 13 2 2 B 31 31 GLY N N 452 107.740 107.391 0.349 1
1 1431 . 13 2 2 B 32 32 VAL H H 453 7.990 7.596 0.394 1
1 1432 . 13 2 2 B 32 32 VAL HA H 453 3.930 4.032 -0.102 1
1 1440 . 13 2 2 B 32 32 VAL CA C 453 61.420 63.023 -1.603 1
1 1441 . 13 2 2 B 32 32 VAL CB C 453 29.860 31.296 -1.436 1
1 1444 . 13 2 2 B 32 32 VAL N N 453 125.560 121.100 4.460 1
1 1445 . 13 2 2 B 33 33 CYS H H 454 8.460 8.610 -0.150 1
1 1446 . 13 2 2 B 33 33 CYS HA H 454 4.310 4.794 -0.484 1
1 1449 . 13 2 2 B 33 33 CYS CA C 454 60.260 59.354 0.906 1
1 1450 . 13 2 2 B 33 33 CYS CB C 454 30.330 30.008 0.322 1
1 1451 . 13 2 2 B 33 33 CYS N N 454 119.460 126.472 -7.012 1
1 1452 . 13 2 2 B 34 34 THR H H 455 8.080 7.853 0.227 1
1 1453 . 13 2 2 B 34 34 THR HA H 455 4.840 4.427 0.413 1
1 1458 . 13 2 2 B 34 34 THR CA C 455 58.650 63.151 -4.501 1
1 1459 . 13 2 2 B 34 34 THR CB C 455 72.680 69.469 3.211 1
1 1461 . 13 2 2 B 34 34 THR N N 455 108.420 114.881 -6.461 1
1 1462 . 13 2 2 B 35 35 LEU H H 456 8.580 8.725 -0.145 1
1 1463 . 13 2 2 B 35 35 LEU HA H 456 3.790 3.989 -0.199 1
1 1473 . 13 2 2 B 35 35 LEU CA C 456 57.980 58.696 -0.716 1
1 1474 . 13 2 2 B 35 35 LEU CB C 456 42.220 41.500 0.720 1
1 1477 . 13 2 2 B 35 35 LEU N N 456 120.370 128.276 -7.906 1
1 1478 . 13 2 2 B 36 36 GLU H H 457 8.390 8.285 0.105 1
1 1479 . 13 2 2 B 36 36 GLU HA H 457 3.820 3.783 0.037 1
1 1484 . 13 2 2 B 36 36 GLU CA C 457 59.640 60.048 -0.408 1
1 1485 . 13 2 2 B 36 36 GLU CB C 457 28.780 29.317 -0.537 1
1 1487 . 13 2 2 B 36 36 GLU N N 457 119.450 118.804 0.646 1
1 1488 . 13 2 2 B 37 37 ASP H H 458 7.750 7.920 -0.170 1
1 1489 . 13 2 2 B 37 37 ASP HA H 458 4.140 4.400 -0.260 1
1 1492 . 13 2 2 B 37 37 ASP CA C 458 57.150 57.309 -0.159 1
1 1493 . 13 2 2 B 37 37 ASP CB C 458 42.280 40.596 1.684 1
1 1494 . 13 2 2 B 37 37 ASP N N 458 117.430 120.445 -3.015 1
1 1495 . 13 2 2 B 38 38 LEU H H 459 7.700 7.868 -0.168 1
1 1496 . 13 2 2 B 38 38 LEU HA H 459 3.790 4.117 -0.327 1
1 1506 . 13 2 2 B 38 38 LEU CA C 459 58.080 57.864 0.216 1
1 1507 . 13 2 2 B 38 38 LEU CB C 459 41.130 41.191 -0.061 1
1 1511 . 13 2 2 B 38 38 LEU N N 459 121.280 121.856 -0.576 1
1 1512 . 13 2 2 B 39 39 ALA H H 460 8.190 8.392 -0.202 1
1 1513 . 13 2 2 B 39 39 ALA HA H 460 3.640 4.032 -0.392 1
1 1517 . 13 2 2 B 39 39 ALA CA C 460 54.320 55.395 -1.075 1
1 1518 . 13 2 2 B 39 39 ALA CB C 460 17.140 18.159 -1.019 1
1 1519 . 13 2 2 B 39 39 ALA N N 460 119.400 120.173 -0.773 1
1 1520 . 13 2 2 B 40 40 GLU H H 461 7.340 7.923 -0.583 1
1 1521 . 13 2 2 B 40 40 GLU HA H 461 4.180 4.227 -0.047 1
1 1526 . 13 2 2 B 40 40 GLU CA C 461 57.800 58.489 -0.689 1
1 1527 . 13 2 2 B 40 40 GLU CB C 461 30.600 29.613 0.987 1
1 1529 . 13 2 2 B 40 40 GLU N N 461 110.680 115.939 -5.259 1
1 1530 . 13 2 2 B 41 41 GLN H H 462 7.940 7.654 0.286 1
1 1531 . 13 2 2 B 41 41 GLN HA H 462 4.100 4.465 -0.365 1
1 1538 . 13 2 2 B 41 41 GLN CA C 462 55.310 55.761 -0.451 1
1 1539 . 13 2 2 B 41 41 GLN CB C 462 28.780 29.350 -0.570 1
1 1541 . 13 2 2 B 41 41 GLN N N 462 120.720 117.879 2.841 1
1 1543 . 13 2 2 B 42 42 GLY H H 463 9.000 8.440 0.560 1
1 1544 . 13 2 2 B 42 42 GLY HA2 H 463 3.310 4.150 -0.840 1
1 1545 . 13 2 2 B 42 42 GLY HA3 H 463 4.820 4.154 0.666 1
1 1546 . 13 2 2 B 42 42 GLY CA C 463 42.650 44.403 -1.753 1
1 1547 . 13 2 2 B 42 42 GLY N N 463 104.110 109.731 -5.621 1
1 1548 . 13 2 2 B 43 43 ILE H H 464 7.900 8.773 -0.873 1
1 1549 . 13 2 2 B 43 43 ILE HA H 464 3.260 3.726 -0.466 1
1 1558 . 13 2 2 B 43 43 ILE CA C 464 66.570 64.341 2.229 1
1 1559 . 13 2 2 B 43 43 ILE CB C 464 38.770 37.538 1.232 1
1 1562 . 13 2 2 B 43 43 ILE N N 464 119.410 119.801 -0.391 1
1 1563 . 13 2 2 B 44 44 ASP H H 465 8.730 8.341 0.389 1
1 1564 . 13 2 2 B 44 44 ASP HA H 465 4.310 4.330 -0.020 1
1 1567 . 13 2 2 B 44 44 ASP CA C 465 56.740 57.849 -1.109 1
1 1568 . 13 2 2 B 44 44 ASP CB C 465 40.120 40.958 -0.838 1
1 1569 . 13 2 2 B 44 44 ASP N N 465 116.610 122.276 -5.666 1
1 1570 . 13 2 2 B 45 45 ASP H H 466 7.720 8.271 -0.551 1
1 1571 . 13 2 2 B 45 45 ASP HA H 466 4.480 4.441 0.039 1
1 1574 . 13 2 2 B 45 45 ASP CA C 466 57.000 57.422 -0.422 1
1 1575 . 13 2 2 B 45 45 ASP CB C 466 42.270 40.315 1.955 1
1 1576 . 13 2 2 B 45 45 ASP N N 466 117.560 118.397 -0.837 1
1 1577 . 13 2 2 B 46 46 LEU H H 467 7.370 7.899 -0.529 1
1 1578 . 13 2 2 B 46 46 LEU HA H 467 4.410 4.137 0.273 1
1 1587 . 13 2 2 B 46 46 LEU CA C 467 53.660 57.370 -3.710 1
1 1588 . 13 2 2 B 46 46 LEU CB C 467 42.260 41.646 0.614 1
1 1591 . 13 2 2 B 46 46 LEU N N 467 116.890 120.612 -3.722 1
1 1592 . 13 2 2 B 47 47 ALA H H 468 7.080 8.116 -1.036 1
1 1593 . 13 2 2 B 47 47 ALA HA H 468 4.120 4.056 0.064 1
1 1597 . 13 2 2 B 47 47 ALA CA C 468 54.130 54.719 -0.589 1
1 1598 . 13 2 2 B 47 47 ALA CB C 468 19.480 18.675 0.805 1
1 1599 . 13 2 2 B 47 47 ALA N N 468 120.150 122.594 -2.444 1
1 1600 . 13 2 2 B 48 48 ASP H H 469 8.560 8.154 0.406 1
1 1601 . 13 2 2 B 48 48 ASP HA H 469 4.410 4.447 -0.037 1
1 1604 . 13 2 2 B 48 48 ASP CA C 469 54.330 57.552 -3.222 1
1 1605 . 13 2 2 B 48 48 ASP CB C 469 39.760 40.676 -0.916 1
1 1606 . 13 2 2 B 48 48 ASP N N 469 114.660 116.320 -1.660 1
1 1607 . 13 2 2 B 49 49 ILE H H 470 7.870 7.939 -0.069 1
1 1608 . 13 2 2 B 49 49 ILE HA H 470 3.850 4.370 -0.520 1
1 1618 . 13 2 2 B 49 49 ILE CA C 470 61.680 60.551 1.129 1
1 1619 . 13 2 2 B 49 49 ILE CB C 470 37.120 39.103 -1.983 1
1 1623 . 13 2 2 B 49 49 ILE N N 470 121.600 119.807 1.793 1
1 1624 . 13 2 2 B 50 50 GLU H H 471 8.680 8.933 -0.253 1
1 1625 . 13 2 2 B 50 50 GLU HA H 471 3.940 4.063 -0.123 1
1 1630 . 13 2 2 B 50 50 GLU CA C 471 58.360 59.329 -0.969 1
1 1631 . 13 2 2 B 50 50 GLU CB C 471 29.530 29.338 0.192 1
1 1633 . 13 2 2 B 50 50 GLU N N 471 131.000 126.290 4.710 1
1 1634 . 13 2 2 B 51 51 GLY H H 472 8.860 8.230 0.630 1
1 1635 . 13 2 2 B 51 51 GLY HA2 H 472 3.640 4.011 -0.371 1
1 1636 . 13 2 2 B 51 51 GLY HA3 H 472 4.230 4.013 0.217 1
1 1637 . 13 2 2 B 51 51 GLY CA C 472 45.190 46.852 -1.662 1
1 1638 . 13 2 2 B 51 51 GLY N N 472 113.580 108.474 5.106 1
1 1639 . 13 2 2 B 52 52 LEU H H 473 7.850 7.694 0.156 1
1 1640 . 13 2 2 B 52 52 LEU HA H 473 4.680 4.769 -0.089 1
1 1650 . 13 2 2 B 52 52 LEU CA C 473 53.640 53.717 -0.077 1
1 1651 . 13 2 2 B 52 52 LEU CB C 473 42.990 43.453 -0.463 1
1 1655 . 13 2 2 B 52 52 LEU N N 473 123.020 120.381 2.639 1
1 1656 . 13 2 2 B 53 53 THR H H 474 7.550 8.899 -1.349 1
1 1657 . 13 2 2 B 53 53 THR HA H 474 4.560 4.822 -0.262 1
1 1662 . 13 2 2 B 53 53 THR CA C 474 60.060 60.875 -0.815 1
1 1663 . 13 2 2 B 53 53 THR CB C 474 71.520 71.288 0.232 1
1 1665 . 13 2 2 B 53 53 THR N N 474 115.070 118.973 -3.903 1
1 1666 . 13 2 2 B 54 54 ASP H H 475 8.900 9.047 -0.147 1
1 1667 . 13 2 2 B 54 54 ASP HA H 475 4.220 4.303 -0.083 1
1 1670 . 13 2 2 B 54 54 ASP CA C 475 57.520 57.875 -0.355 1
1 1671 . 13 2 2 B 54 54 ASP CB C 475 39.560 40.289 -0.729 1
1 1672 . 13 2 2 B 54 54 ASP N N 475 121.800 123.829 -2.029 1
1 1673 . 13 2 2 B 55 55 GLU H H 476 8.460 7.892 0.568 1
1 1674 . 13 2 2 B 55 55 GLU HA H 476 3.970 4.032 -0.062 1
1 1679 . 13 2 2 B 55 55 GLU CA C 476 59.440 59.049 0.391 1
1 1680 . 13 2 2 B 55 55 GLU CB C 476 29.650 29.594 0.056 1
1 1682 . 13 2 2 B 55 55 GLU N N 476 119.460 119.227 0.233 1
1 1683 . 13 2 2 B 56 56 LYS H H 477 7.790 8.013 -0.223 1
1 1684 . 13 2 2 B 56 56 LYS HA H 477 4.120 4.105 0.015 1
1 1693 . 13 2 2 B 56 56 LYS CA C 477 58.890 58.747 0.143 1
1 1694 . 13 2 2 B 56 56 LYS CB C 477 32.600 32.317 0.283 1
1 1698 . 13 2 2 B 56 56 LYS N N 477 121.840 119.726 2.114 1
1 1699 . 13 2 2 B 57 57 ALA H H 478 8.900 9.069 -0.169 1
1 1700 . 13 2 2 B 57 57 ALA HA H 478 3.790 4.047 -0.257 1
1 1704 . 13 2 2 B 57 57 ALA CA C 478 55.810 55.261 0.549 1
1 1705 . 13 2 2 B 57 57 ALA CB C 478 18.590 18.460 0.130 1
1 1706 . 13 2 2 B 57 57 ALA N N 478 121.350 121.930 -0.580 1
1 1707 . 13 2 2 B 58 58 GLY H H 479 8.300 8.106 0.194 1
1 1708 . 13 2 2 B 58 58 GLY HA2 H 479 3.500 3.787 -0.287 1
1 1709 . 13 2 2 B 58 58 GLY HA3 H 479 3.890 3.790 0.100 1
1 1710 . 13 2 2 B 58 58 GLY CA C 479 47.360 47.253 0.107 1
1 1711 . 13 2 2 B 58 58 GLY N N 479 102.040 106.578 -4.538 1
1 1712 . 13 2 2 B 59 59 ALA H H 480 7.580 7.955 -0.375 1
1 1713 . 13 2 2 B 59 59 ALA HA H 480 4.110 4.057 0.053 1
1 1717 . 13 2 2 B 59 59 ALA CA C 480 55.580 54.667 0.913 1
1 1718 . 13 2 2 B 59 59 ALA CB C 480 18.130 18.797 -0.667 1
1 1719 . 13 2 2 B 59 59 ALA N N 480 123.180 124.947 -1.767 1
1 1720 . 13 2 2 B 60 60 LEU H H 481 8.290 7.950 0.340 1
1 1721 . 13 2 2 B 60 60 LEU HA H 481 4.020 3.973 0.047 1
1 1731 . 13 2 2 B 60 60 LEU CA C 481 57.850 57.786 0.064 1
1 1732 . 13 2 2 B 60 60 LEU CB C 481 42.360 41.619 0.741 1
1 1736 . 13 2 2 B 60 60 LEU N N 481 120.560 117.917 2.643 1
1 1737 . 13 2 2 B 61 61 ILE H H 482 8.080 8.155 -0.075 1
1 1738 . 13 2 2 B 61 61 ILE HA H 482 3.210 3.458 -0.248 1
1 1748 . 13 2 2 B 61 61 ILE CA C 482 66.250 65.203 1.047 1
1 1749 . 13 2 2 B 61 61 ILE CB C 482 39.400 38.099 1.301 1
1 1753 . 13 2 2 B 61 61 ILE N N 482 119.170 119.870 -0.700 1
1 1754 . 13 2 2 B 62 62 MET H H 483 8.110 8.290 -0.180 1
1 1755 . 13 2 2 B 62 62 MET HA H 483 4.410 4.159 0.251 1
1 1763 . 13 2 2 B 62 62 MET CA C 483 56.110 58.767 -2.657 1
1 1764 . 13 2 2 B 62 62 MET CB C 483 28.260 32.527 -4.267 1
1 1767 . 13 2 2 B 62 62 MET N N 483 114.420 117.876 -3.456 1
1 1768 . 13 2 2 B 63 63 ALA H H 484 8.240 7.946 0.294 1
1 1769 . 13 2 2 B 63 63 ALA HA H 484 4.130 4.156 -0.026 1
1 1773 . 13 2 2 B 63 63 ALA CA C 484 55.300 55.032 0.268 1
1 1774 . 13 2 2 B 63 63 ALA CB C 484 18.280 18.570 -0.290 1
1 1775 . 13 2 2 B 63 63 ALA N N 484 123.710 121.208 2.502 1
1 1776 . 13 2 2 B 64 64 ALA H H 485 8.050 8.862 -0.812 1
1 1777 . 13 2 2 B 64 64 ALA HA H 485 3.870 4.061 -0.191 1
1 1781 . 13 2 2 B 64 64 ALA CA C 485 55.330 55.291 0.039 1
1 1782 . 13 2 2 B 64 64 ALA CB C 485 17.660 18.237 -0.577 1
1 1783 . 13 2 2 B 64 64 ALA N N 485 120.070 119.852 0.218 1
1 1784 . 13 2 2 B 65 65 ARG H H 486 8.640 8.934 -0.294 1
1 1785 . 13 2 2 B 65 65 ARG HA H 486 2.800 4.143 -1.343 1
1 1792 . 13 2 2 B 65 65 ARG CA C 486 60.600 59.844 0.756 1
1 1793 . 13 2 2 B 65 65 ARG CB C 486 29.910 30.208 -0.298 1
1 1796 . 13 2 2 B 65 65 ARG N N 486 118.730 118.087 0.643 1
1 1797 . 13 2 2 B 66 66 ASN H H 487 8.710 8.348 0.362 1
1 1798 . 13 2 2 B 66 66 ASN HA H 487 4.550 4.713 -0.163 1
1 1803 . 13 2 2 B 66 66 ASN CA C 487 56.390 56.473 -0.083 1
1 1804 . 13 2 2 B 66 66 ASN CB C 487 37.970 38.685 -0.715 1
1 1805 . 13 2 2 B 66 66 ASN N N 487 119.170 118.079 1.091 1
1 1807 . 13 2 2 B 67 67 ILE H H 488 7.250 7.933 -0.683 1
1 1808 . 13 2 2 B 67 67 ILE HA H 488 3.810 3.896 -0.086 1
1 1818 . 13 2 2 B 67 67 ILE CA C 488 64.350 65.148 -0.798 1
1 1819 . 13 2 2 B 67 67 ILE CB C 488 39.570 37.725 1.845 1
1 1823 . 13 2 2 B 67 67 ILE N N 488 117.890 119.725 -1.835 1
1 1824 . 13 2 2 B 68 68 CYS H H 489 8.350 8.070 0.280 1
1 1825 . 13 2 2 B 68 68 CYS HA H 489 4.080 4.125 -0.045 1
1 1828 . 13 2 2 B 68 68 CYS CA C 489 62.670 63.511 -0.841 1
1 1829 . 13 2 2 B 68 68 CYS CB C 489 28.170 28.144 0.026 1
1 1830 . 13 2 2 B 68 68 CYS N N 489 115.230 119.036 -3.806 1
1 1831 . 13 2 2 B 69 69 TRP H H 490 8.230 8.782 -0.552 1
1 1832 . 13 2 2 B 69 69 TRP HA H 490 5.100 4.254 0.846 1
1 1841 . 13 2 2 B 69 69 TRP CA C 490 55.420 60.352 -4.932 1
1 1842 . 13 2 2 B 69 69 TRP CB C 490 31.010 29.146 1.864 1
1 1844 . 13 2 2 B 69 69 TRP N N 490 116.850 120.601 -3.751 1
1 1846 . 13 2 2 B 70 70 PHE H H 491 7.570 8.255 -0.685 1
1 1847 . 13 2 2 B 70 70 PHE HA H 491 5.240 4.491 0.749 1
1 1852 . 13 2 2 B 70 70 PHE CA C 491 55.490 60.365 -4.875 1
1 1853 . 13 2 2 B 70 70 PHE CB C 491 38.700 39.433 -0.733 1
1 1856 . 13 2 2 B 70 70 PHE N N 491 117.460 117.377 0.083 1
1 1857 . 13 2 2 B 71 71 GLY H H 492 8.420 8.115 0.305 1
1 1858 . 13 2 2 B 71 71 GLY HA2 H 492 3.920 4.003 -0.083 1
1 1859 . 13 2 2 B 71 71 GLY HA3 H 492 4.080 4.012 0.068 1
1 1860 . 13 2 2 B 71 71 GLY CA C 492 46.210 46.655 -0.445 1
1 1861 . 13 2 2 B 71 71 GLY N N 492 110.040 107.219 2.821 1
1 1862 . 13 2 2 B 72 72 ASP H H 493 8.370 8.446 -0.076 1
1 1863 . 13 2 2 B 72 72 ASP HA H 493 4.630 4.344 0.286 1
1 1866 . 13 2 2 B 72 72 ASP CA C 493 54.410 57.019 -2.609 1
1 1867 . 13 2 2 B 72 72 ASP CB C 493 41.250 40.759 0.491 1
1 1868 . 13 2 2 B 72 72 ASP N N 493 120.000 120.277 -0.277 1
1 1869 . 13 2 2 B 73 73 GLU H H 494 8.230 8.215 0.015 1
1 1870 . 13 2 2 B 73 73 GLU HA H 494 4.260 4.059 0.201 1
1 1875 . 13 2 2 B 73 73 GLU CA C 494 56.510 59.236 -2.726 1
1 1876 . 13 2 2 B 73 73 GLU CB C 494 30.420 29.463 0.957 1
1 1878 . 13 2 2 B 73 73 GLU N N 494 120.900 119.972 0.928 1
1 216 . 14 1 1 A 20 20 ASP H H 250 8.550 8.998 -0.448 1
1 217 . 14 1 1 A 20 20 ASP HA H 250 4.700 4.794 -0.094 1
1 220 . 14 1 1 A 20 20 ASP CA C 250 52.650 53.048 -0.398 1
1 221 . 14 1 1 A 20 20 ASP CB C 250 41.420 40.286 1.134 1
1 222 . 14 1 1 A 20 20 ASP N N 250 125.190 125.262 -0.072 1
1 223 . 14 1 1 A 21 21 PRO HA H 251 4.250 4.429 -0.179 1
1 230 . 14 1 1 A 21 21 PRO CA C 251 65.120 64.614 0.506 1
1 231 . 14 1 1 A 21 21 PRO CB C 251 32.310 32.082 0.228 1
1 234 . 14 1 1 A 22 22 ILE H H 252 8.630 7.803 0.827 1
1 235 . 14 1 1 A 22 22 ILE HA H 252 4.060 3.966 0.094 1
1 245 . 14 1 1 A 22 22 ILE CA C 252 62.990 62.834 0.156 1
1 246 . 14 1 1 A 22 22 ILE CB C 252 37.520 37.746 -0.226 1
1 250 . 14 1 1 A 22 22 ILE N N 252 119.860 117.225 2.635 1
1 251 . 14 1 1 A 23 23 LEU H H 253 7.950 7.666 0.284 1
1 252 . 14 1 1 A 23 23 LEU HA H 253 3.710 4.180 -0.470 1
1 262 . 14 1 1 A 23 23 LEU CA C 253 56.510 57.638 -1.128 1
1 263 . 14 1 1 A 23 23 LEU CB C 253 41.190 41.358 -0.168 1
1 266 . 14 1 1 A 23 23 LEU N N 253 116.850 122.424 -5.574 1
1 267 . 14 1 1 A 24 24 LEU H H 254 7.370 7.772 -0.402 1
1 268 . 14 1 1 A 24 24 LEU HA H 254 4.310 4.806 -0.496 1
1 278 . 14 1 1 A 24 24 LEU CA C 254 54.890 55.457 -0.567 1
1 279 . 14 1 1 A 24 24 LEU CB C 254 41.960 42.704 -0.744 1
1 283 . 14 1 1 A 24 24 LEU N N 254 115.210 117.830 -2.620 1
1 284 . 14 1 1 A 25 25 ARG H H 255 7.520 7.793 -0.273 1
1 285 . 14 1 1 A 25 25 ARG HA H 255 4.660 4.246 0.414 1
1 293 . 14 1 1 A 25 25 ARG CA C 255 52.840 54.639 -1.799 1
1 294 . 14 1 1 A 25 25 ARG CB C 255 28.130 29.673 -1.543 1
1 297 . 14 1 1 A 25 25 ARG N N 255 118.180 119.813 -1.633 1
1 298 . 14 1 1 A 26 26 PRO HA H 256 4.800 4.744 0.056 1
1 305 . 14 1 1 A 26 26 PRO CA C 256 61.790 62.675 -0.885 1
1 306 . 14 1 1 A 26 26 PRO CB C 256 32.660 31.664 0.996 1
1 309 . 14 1 1 A 27 27 VAL H H 257 8.170 8.466 -0.296 1
1 310 . 14 1 1 A 27 27 VAL HA H 257 3.590 3.727 -0.137 1
1 318 . 14 1 1 A 27 27 VAL CA C 257 64.830 65.465 -0.635 1
1 319 . 14 1 1 A 27 27 VAL CB C 257 31.720 31.393 0.327 1
1 322 . 14 1 1 A 27 27 VAL N N 257 115.710 124.319 -8.609 1
1 323 . 14 1 1 A 28 28 ASP H H 258 8.240 8.127 0.113 1
1 324 . 14 1 1 A 28 28 ASP HA H 258 4.340 4.380 -0.040 1
1 327 . 14 1 1 A 28 28 ASP CA C 258 56.490 57.459 -0.969 1
1 328 . 14 1 1 A 28 28 ASP CB C 258 40.520 41.730 -1.210 1
1 329 . 14 1 1 A 28 28 ASP N N 258 119.000 120.918 -1.918 1
1 330 . 14 1 1 A 29 29 ASP H H 259 8.000 8.821 -0.821 1
1 331 . 14 1 1 A 29 29 ASP HA H 259 4.390 4.606 -0.216 1
1 334 . 14 1 1 A 29 29 ASP CA C 259 56.210 55.687 0.523 1
1 335 . 14 1 1 A 29 29 ASP CB C 259 40.670 41.062 -0.392 1
1 336 . 14 1 1 A 29 29 ASP N N 259 118.900 117.254 1.646 1
1 337 . 14 1 1 A 30 30 LEU H H 260 7.760 7.456 0.304 1
1 338 . 14 1 1 A 30 30 LEU HA H 260 3.990 4.202 -0.212 1
1 348 . 14 1 1 A 30 30 LEU CA C 260 55.000 55.587 -0.587 1
1 349 . 14 1 1 A 30 30 LEU CB C 260 41.670 42.145 -0.475 1
1 353 . 14 1 1 A 30 30 LEU N N 260 116.300 121.474 -5.174 1
1 354 . 14 1 1 A 31 31 GLU H H 261 7.990 8.759 -0.769 1
1 355 . 14 1 1 A 31 31 GLU HA H 261 4.280 4.204 0.076 1
1 358 . 14 1 1 A 31 31 GLU CA C 261 56.860 58.655 -1.795 1
1 359 . 14 1 1 A 31 31 GLU CB C 261 27.010 29.896 -2.886 1
1 360 . 14 1 1 A 31 31 GLU N N 261 115.620 122.779 -7.159 1
1 361 . 14 1 1 A 32 32 LEU H H 262 8.000 7.336 0.664 1
1 362 . 14 1 1 A 32 32 LEU HA H 262 4.400 4.306 0.094 1
1 372 . 14 1 1 A 32 32 LEU CA C 262 53.860 54.905 -1.045 1
1 373 . 14 1 1 A 32 32 LEU CB C 262 44.450 42.149 2.301 1
1 377 . 14 1 1 A 32 32 LEU N N 262 118.860 122.453 -3.593 1
1 378 . 14 1 1 A 33 33 THR H H 263 10.020 8.601 1.419 1
1 379 . 14 1 1 A 33 33 THR HA H 263 4.130 4.590 -0.460 1
1 384 . 14 1 1 A 33 33 THR CA C 263 62.400 60.876 1.524 1
1 385 . 14 1 1 A 33 33 THR CB C 263 71.270 71.112 0.158 1
1 387 . 14 1 1 A 33 33 THR N N 263 114.610 113.956 0.654 1
1 388 . 14 1 1 A 34 34 VAL H H 264 8.370 8.768 -0.398 1
1 389 . 14 1 1 A 34 34 VAL HA H 264 3.620 3.649 -0.029 1
1 397 . 14 1 1 A 34 34 VAL CA C 264 66.340 66.718 -0.378 1
1 398 . 14 1 1 A 34 34 VAL CB C 264 31.670 31.589 0.081 1
1 401 . 14 1 1 A 34 34 VAL N N 264 122.110 122.585 -0.475 1
1 402 . 14 1 1 A 35 35 ARG H H 265 8.190 8.290 -0.100 1
1 403 . 14 1 1 A 35 35 ARG HA H 265 4.070 3.902 0.168 1
1 411 . 14 1 1 A 35 35 ARG CA C 265 59.470 60.103 -0.633 1
1 412 . 14 1 1 A 35 35 ARG CB C 265 29.790 29.889 -0.099 1
1 415 . 14 1 1 A 35 35 ARG N N 265 117.340 120.205 -2.865 1
1 416 . 14 1 1 A 36 36 SER H H 266 7.610 7.726 -0.116 1
1 417 . 14 1 1 A 36 36 SER HA H 266 4.080 4.107 -0.027 1
1 420 . 14 1 1 A 36 36 SER CA C 266 63.080 61.598 1.482 1
1 421 . 14 1 1 A 36 36 SER CB C 266 63.280 62.990 0.290 1
1 422 . 14 1 1 A 36 36 SER N N 266 116.710 115.151 1.559 1
1 423 . 14 1 1 A 37 37 ALA H H 267 8.720 7.661 1.059 1
1 424 . 14 1 1 A 37 37 ALA HA H 267 3.760 4.038 -0.278 1
1 428 . 14 1 1 A 37 37 ALA CA C 267 55.900 55.370 0.530 1
1 429 . 14 1 1 A 37 37 ALA CB C 267 18.090 18.093 -0.003 1
1 430 . 14 1 1 A 37 37 ALA N N 267 124.170 122.345 1.825 1
1 431 . 14 1 1 A 38 38 ASN H H 268 8.850 9.185 -0.335 1
1 432 . 14 1 1 A 38 38 ASN HA H 268 4.420 4.489 -0.069 1
1 437 . 14 1 1 A 38 38 ASN CA C 268 55.700 56.155 -0.455 1
1 438 . 14 1 1 A 38 38 ASN CB C 268 37.180 37.972 -0.792 1
1 439 . 14 1 1 A 38 38 ASN N N 268 117.370 117.485 -0.115 1
1 441 . 14 1 1 A 39 39 CYS H H 269 7.970 7.766 0.204 1
1 442 . 14 1 1 A 39 39 CYS HA H 269 4.190 4.049 0.141 1
1 445 . 14 1 1 A 39 39 CYS CA C 269 63.340 62.251 1.089 1
1 446 . 14 1 1 A 39 39 CYS CB C 269 26.870 26.530 0.340 1
1 447 . 14 1 1 A 39 39 CYS N N 269 120.510 119.381 1.129 1
1 448 . 14 1 1 A 40 40 LEU H H 270 7.600 7.811 -0.211 1
1 449 . 14 1 1 A 40 40 LEU HA H 270 3.880 3.922 -0.042 1
1 458 . 14 1 1 A 40 40 LEU CA C 270 57.810 57.946 -0.136 1
1 459 . 14 1 1 A 40 40 LEU CB C 270 40.030 41.177 -1.147 1
1 462 . 14 1 1 A 40 40 LEU N N 270 117.710 121.120 -3.410 1
1 463 . 14 1 1 A 41 41 LYS H H 271 7.980 8.694 -0.714 1
1 464 . 14 1 1 A 41 41 LYS HA H 271 3.820 4.479 -0.659 1
1 472 . 14 1 1 A 41 41 LYS CA C 271 59.840 59.653 0.187 1
1 473 . 14 1 1 A 41 41 LYS CB C 271 32.070 32.089 -0.019 1
1 476 . 14 1 1 A 41 41 LYS N N 271 120.070 117.445 2.625 1
1 477 . 14 1 1 A 42 42 ALA H H 272 7.860 8.257 -0.397 1
1 478 . 14 1 1 A 42 42 ALA HA H 272 4.140 4.064 0.076 1
1 482 . 14 1 1 A 42 42 ALA CA C 272 54.670 54.701 -0.031 1
1 483 . 14 1 1 A 42 42 ALA CB C 272 17.950 18.571 -0.621 1
1 484 . 14 1 1 A 42 42 ALA N N 272 122.880 120.953 1.927 1
1 485 . 14 1 1 A 43 43 GLU H H 273 7.210 7.813 -0.603 1
1 486 . 14 1 1 A 43 43 GLU HA H 273 4.260 4.441 -0.181 1
1 491 . 14 1 1 A 43 43 GLU CA C 273 55.020 56.008 -0.988 1
1 492 . 14 1 1 A 43 43 GLU CB C 273 29.880 29.363 0.517 1
1 494 . 14 1 1 A 43 43 GLU N N 273 116.590 115.478 1.112 1
1 495 . 14 1 1 A 44 44 ALA H H 274 7.880 8.131 -0.251 1
1 496 . 14 1 1 A 44 44 ALA HA H 274 3.680 3.923 -0.243 1
1 500 . 14 1 1 A 44 44 ALA CA C 274 52.960 53.159 -0.199 1
1 501 . 14 1 1 A 44 44 ALA CB C 274 16.110 17.122 -1.012 1
1 502 . 14 1 1 A 44 44 ALA N N 274 118.420 118.867 -0.447 1
1 503 . 14 1 1 A 45 45 ILE H H 275 7.600 7.576 0.024 1
1 504 . 14 1 1 A 45 45 ILE HA H 275 3.870 4.576 -0.706 1
1 514 . 14 1 1 A 45 45 ILE CA C 275 61.150 60.526 0.624 1
1 515 . 14 1 1 A 45 45 ILE CB C 275 37.090 40.217 -3.127 1
1 519 . 14 1 1 A 45 45 ILE N N 275 120.370 118.357 2.013 1
1 520 . 14 1 1 A 46 46 HIS H H 276 8.350 8.686 -0.336 1
1 521 . 14 1 1 A 46 46 HIS HA H 276 4.600 4.928 -0.328 1
1 526 . 14 1 1 A 46 46 HIS CA C 276 56.900 55.675 1.225 1
1 527 . 14 1 1 A 46 46 HIS CB C 276 31.910 31.410 0.500 1
1 529 . 14 1 1 A 46 46 HIS N N 276 123.250 121.447 1.803 1
1 530 . 14 1 1 A 47 47 TYR H H 277 8.850 7.302 1.548 1
1 531 . 14 1 1 A 47 47 TYR HA H 277 5.100 4.588 0.512 1
1 538 . 14 1 1 A 47 47 TYR CA C 277 57.430 56.216 1.214 1
1 539 . 14 1 1 A 47 47 TYR CB C 277 40.680 40.074 0.606 1
1 544 . 14 1 1 A 47 47 TYR N N 277 119.700 118.112 1.588 1
1 545 . 14 1 1 A 48 48 ILE H H 278 9.380 8.532 0.848 1
1 546 . 14 1 1 A 48 48 ILE HA H 278 3.340 3.584 -0.244 1
1 554 . 14 1 1 A 48 48 ILE CA C 278 67.640 65.030 2.610 1
1 555 . 14 1 1 A 48 48 ILE CB C 278 36.310 37.604 -1.294 1
1 558 . 14 1 1 A 48 48 ILE N N 278 125.650 124.415 1.235 1
1 559 . 14 1 1 A 49 49 GLY H H 279 9.430 8.147 1.283 1
1 560 . 14 1 1 A 49 49 GLY HA2 H 279 2.370 2.418 -0.048 1
1 561 . 14 1 1 A 49 49 GLY HA3 H 279 3.230 3.700 -0.470 1
1 562 . 14 1 1 A 49 49 GLY CA C 279 46.820 46.961 -0.141 1
1 563 . 14 1 1 A 49 49 GLY N N 279 105.200 108.712 -3.512 1
1 564 . 14 1 1 A 50 50 ASP H H 280 7.050 7.509 -0.459 1
1 565 . 14 1 1 A 50 50 ASP HA H 280 4.360 4.135 0.225 1
1 568 . 14 1 1 A 50 50 ASP CA C 280 57.110 56.191 0.919 1
1 569 . 14 1 1 A 50 50 ASP CB C 280 42.620 40.500 2.120 1
1 570 . 14 1 1 A 50 50 ASP N N 280 116.360 120.845 -4.485 1
1 571 . 14 1 1 A 51 51 LEU H H 281 7.170 8.172 -1.002 1
1 572 . 14 1 1 A 51 51 LEU HA H 281 3.880 3.958 -0.078 1
1 582 . 14 1 1 A 51 51 LEU CA C 281 57.900 58.183 -0.283 1
1 583 . 14 1 1 A 51 51 LEU CB C 281 41.870 41.481 0.389 1
1 587 . 14 1 1 A 51 51 LEU N N 281 120.130 122.039 -1.909 1
1 588 . 14 1 1 A 52 52 VAL H H 282 7.820 7.632 0.188 1
1 589 . 14 1 1 A 52 52 VAL HA H 282 3.980 3.881 0.099 1
1 597 . 14 1 1 A 52 52 VAL CA C 282 64.000 65.591 -1.591 1
1 598 . 14 1 1 A 52 52 VAL CB C 282 30.400 31.449 -1.049 1
1 601 . 14 1 1 A 52 52 VAL N N 282 105.550 115.594 -10.044 1
1 602 . 14 1 1 A 53 53 GLN H H 283 6.550 7.840 -1.290 1
1 603 . 14 1 1 A 53 53 GLN HA H 283 4.680 4.085 0.595 1
1 610 . 14 1 1 A 53 53 GLN CA C 283 56.210 58.781 -2.571 1
1 611 . 14 1 1 A 53 53 GLN CB C 283 31.710 28.483 3.227 1
1 613 . 14 1 1 A 53 53 GLN N N 283 114.060 121.706 -7.646 1
1 615 . 14 1 1 A 54 54 ARG H H 284 7.690 7.589 0.101 1
1 616 . 14 1 1 A 54 54 ARG HA H 284 4.520 4.779 -0.259 1
1 624 . 14 1 1 A 54 54 ARG CA C 284 54.600 54.554 0.046 1
1 625 . 14 1 1 A 54 54 ARG CB C 284 30.750 32.609 -1.859 1
1 628 . 14 1 1 A 54 54 ARG N N 284 119.810 118.383 1.427 1
1 629 . 14 1 1 A 55 55 THR H H 285 8.110 8.644 -0.534 1
1 630 . 14 1 1 A 55 55 THR HA H 285 4.430 4.335 0.095 1
1 635 . 14 1 1 A 55 55 THR CA C 285 59.640 63.779 -4.139 1
1 636 . 14 1 1 A 55 55 THR CB C 285 71.310 69.266 2.044 1
1 638 . 14 1 1 A 55 55 THR N N 285 108.450 119.431 -10.981 1
1 639 . 14 1 1 A 56 56 GLU H H 286 8.910 8.867 0.043 1
1 640 . 14 1 1 A 56 56 GLU HA H 286 3.660 4.053 -0.393 1
1 645 . 14 1 1 A 56 56 GLU CA C 286 60.650 59.015 1.635 1
1 646 . 14 1 1 A 56 56 GLU CB C 286 29.400 28.992 0.408 1
1 648 . 14 1 1 A 56 56 GLU N N 286 120.600 124.500 -3.900 1
1 649 . 14 1 1 A 57 57 VAL H H 287 7.600 8.112 -0.512 1
1 650 . 14 1 1 A 57 57 VAL HA H 287 3.620 3.506 0.114 1
1 658 . 14 1 1 A 57 57 VAL CA C 287 66.020 67.134 -1.114 1
1 659 . 14 1 1 A 57 57 VAL CB C 287 31.720 31.584 0.136 1
1 662 . 14 1 1 A 57 57 VAL N N 287 114.050 121.422 -7.372 1
1 663 . 14 1 1 A 58 58 GLU H H 288 7.350 8.166 -0.816 1
1 664 . 14 1 1 A 58 58 GLU HA H 288 3.830 4.071 -0.241 1
1 669 . 14 1 1 A 58 58 GLU CA C 288 59.250 59.657 -0.407 1
1 670 . 14 1 1 A 58 58 GLU CB C 288 30.030 29.119 0.911 1
1 672 . 14 1 1 A 58 58 GLU N N 288 117.610 119.323 -1.713 1
1 673 . 14 1 1 A 59 59 LEU H H 289 7.850 7.989 -0.139 1
1 674 . 14 1 1 A 59 59 LEU HA H 289 4.150 4.214 -0.064 1
1 683 . 14 1 1 A 59 59 LEU CA C 289 57.340 57.862 -0.522 1
1 684 . 14 1 1 A 59 59 LEU CB C 289 41.170 41.503 -0.333 1
1 687 . 14 1 1 A 59 59 LEU N N 289 120.050 120.567 -0.517 1
1 688 . 14 1 1 A 60 60 LEU H H 290 7.670 8.258 -0.588 1
1 689 . 14 1 1 A 60 60 LEU HA H 290 4.540 3.950 0.590 1
1 696 . 14 1 1 A 60 60 LEU CA C 290 55.090 57.263 -2.173 1
1 697 . 14 1 1 A 60 60 LEU CB C 290 42.320 41.167 1.153 1
1 701 . 14 1 1 A 60 60 LEU N N 290 114.980 118.573 -3.593 1
1 702 . 14 1 1 A 61 61 LYS H H 291 7.440 7.365 0.075 1
1 703 . 14 1 1 A 61 61 LYS HA H 291 4.280 4.298 -0.018 1
1 710 . 14 1 1 A 61 61 LYS CA C 291 56.860 57.972 -1.112 1
1 711 . 14 1 1 A 61 61 LYS CB C 291 31.900 32.907 -1.007 1
1 714 . 14 1 1 A 61 61 LYS N N 291 118.120 117.040 1.080 1
1 715 . 14 1 1 A 62 62 THR H H 292 7.310 7.534 -0.224 1
1 716 . 14 1 1 A 62 62 THR HA H 292 5.220 4.402 0.818 1
1 721 . 14 1 1 A 62 62 THR CA C 292 55.830 60.382 -4.552 1
1 722 . 14 1 1 A 62 62 THR CB C 292 69.970 69.016 0.954 1
1 724 . 14 1 1 A 62 62 THR N N 292 111.890 115.153 -3.263 1
1 725 . 14 1 1 A 63 63 PRO HA H 293 4.570 4.521 0.049 1
1 730 . 14 1 1 A 63 63 PRO CA C 293 63.710 63.921 -0.211 1
1 731 . 14 1 1 A 63 63 PRO CB C 293 32.380 31.898 0.482 1
1 733 . 14 1 1 A 64 64 ASN H H 294 8.050 8.797 -0.747 1
1 734 . 14 1 1 A 64 64 ASN HA H 294 4.490 4.450 0.040 1
1 739 . 14 1 1 A 64 64 ASN CA C 294 55.630 55.693 -0.063 1
1 740 . 14 1 1 A 64 64 ASN CB C 294 38.730 38.323 0.407 1
1 741 . 14 1 1 A 64 64 ASN N N 294 117.120 117.673 -0.553 1
1 743 . 14 1 1 A 65 65 LEU H H 295 7.550 7.037 0.513 1
1 744 . 14 1 1 A 65 65 LEU HA H 295 4.640 4.722 -0.082 1
1 754 . 14 1 1 A 65 65 LEU CA C 295 54.310 53.399 0.911 1
1 755 . 14 1 1 A 65 65 LEU CB C 295 43.640 43.426 0.214 1
1 758 . 14 1 1 A 65 65 LEU N N 295 119.930 116.692 3.238 1
1 759 . 14 1 1 A 66 66 GLY H H 296 7.850 8.616 -0.766 1
1 760 . 14 1 1 A 66 66 GLY HA2 H 296 3.810 4.092 -0.282 1
1 761 . 14 1 1 A 66 66 GLY HA3 H 296 4.110 4.092 0.018 1
1 762 . 14 1 1 A 66 66 GLY CA C 296 43.570 44.558 -0.988 1
1 763 . 14 1 1 A 66 66 GLY N N 296 108.840 108.042 0.798 1
1 764 . 14 1 1 A 67 67 LYS H H 297 8.820 8.620 0.200 1
1 765 . 14 1 1 A 67 67 LYS HA H 297 3.980 3.872 0.108 1
1 774 . 14 1 1 A 67 67 LYS CA C 297 60.100 59.465 0.635 1
1 775 . 14 1 1 A 67 67 LYS CB C 297 32.100 32.213 -0.113 1
1 779 . 14 1 1 A 67 67 LYS N N 297 120.130 118.363 1.767 1
1 780 . 14 1 1 A 68 68 LYS H H 298 8.850 8.017 0.833 1
1 781 . 14 1 1 A 68 68 LYS HA H 298 4.060 4.004 0.056 1
1 790 . 14 1 1 A 68 68 LYS CA C 298 60.600 59.249 1.351 1
1 791 . 14 1 1 A 68 68 LYS CB C 298 31.920 31.905 0.015 1
1 795 . 14 1 1 A 68 68 LYS N N 298 119.580 120.379 -0.799 1
1 796 . 14 1 1 A 69 69 SER H H 299 8.100 8.321 -0.221 1
1 797 . 14 1 1 A 69 69 SER HA H 299 4.370 4.189 0.181 1
1 800 . 14 1 1 A 69 69 SER CA C 299 61.980 61.577 0.403 1
1 801 . 14 1 1 A 69 69 SER CB C 299 63.000 62.437 0.563 1
1 802 . 14 1 1 A 69 69 SER N N 299 116.360 114.699 1.661 1
1 803 . 14 1 1 A 70 70 LEU H H 300 8.240 7.648 0.592 1
1 804 . 14 1 1 A 70 70 LEU HA H 300 3.970 4.044 -0.074 1
1 814 . 14 1 1 A 70 70 LEU CA C 300 57.610 57.850 -0.240 1
1 815 . 14 1 1 A 70 70 LEU CB C 300 41.060 41.797 -0.737 1
1 819 . 14 1 1 A 70 70 LEU N N 300 123.330 124.731 -1.401 1
1 820 . 14 1 1 A 71 71 THR H H 301 8.550 7.891 0.659 1
1 821 . 14 1 1 A 71 71 THR HA H 301 3.690 3.862 -0.172 1
1 826 . 14 1 1 A 71 71 THR CA C 301 67.170 66.994 0.176 1
1 827 . 14 1 1 A 71 71 THR CB C 301 68.810 68.527 0.283 1
1 829 . 14 1 1 A 71 71 THR N N 301 116.520 114.822 1.698 1
1 830 . 14 1 1 A 72 72 GLU H H 302 7.520 8.317 -0.797 1
1 831 . 14 1 1 A 72 72 GLU HA H 302 4.070 4.026 0.044 1
1 836 . 14 1 1 A 72 72 GLU CA C 302 59.470 59.168 0.302 1
1 837 . 14 1 1 A 72 72 GLU CB C 302 29.090 29.507 -0.417 1
1 839 . 14 1 1 A 72 72 GLU N N 302 121.510 120.992 0.518 1
1 840 . 14 1 1 A 73 73 ILE H H 303 8.290 8.345 -0.055 1
1 841 . 14 1 1 A 73 73 ILE HA H 303 3.380 3.593 -0.213 1
1 849 . 14 1 1 A 73 73 ILE CA C 303 66.010 65.473 0.537 1
1 850 . 14 1 1 A 73 73 ILE CB C 303 38.680 37.828 0.852 1
1 853 . 14 1 1 A 73 73 ILE N N 303 118.510 120.122 -1.612 1
1 854 . 14 1 1 A 74 74 LYS H H 304 8.550 8.599 -0.049 1
1 855 . 14 1 1 A 74 74 LYS HA H 304 3.680 3.838 -0.158 1
1 864 . 14 1 1 A 74 74 LYS CA C 304 61.320 60.005 1.315 1
1 865 . 14 1 1 A 74 74 LYS CB C 304 32.060 32.199 -0.139 1
1 868 . 14 1 1 A 74 74 LYS N N 304 118.220 120.976 -2.756 1
1 869 . 14 1 1 A 75 75 ASP H H 305 8.450 7.962 0.488 1
1 870 . 14 1 1 A 75 75 ASP HA H 305 4.440 4.330 0.110 1
1 873 . 14 1 1 A 75 75 ASP CA C 305 57.690 57.623 0.067 1
1 874 . 14 1 1 A 75 75 ASP CB C 305 40.220 41.653 -1.433 1
1 875 . 14 1 1 A 75 75 ASP N N 305 121.790 119.680 2.110 1
1 876 . 14 1 1 A 76 76 VAL H H 306 8.680 7.794 0.886 1
1 877 . 14 1 1 A 76 76 VAL HA H 306 3.890 3.621 0.269 1
1 885 . 14 1 1 A 76 76 VAL CA C 306 66.020 66.166 -0.146 1
1 886 . 14 1 1 A 76 76 VAL CB C 306 31.250 31.502 -0.252 1
1 889 . 14 1 1 A 76 76 VAL N N 306 121.150 119.165 1.985 1
1 890 . 14 1 1 A 77 77 LEU H H 307 8.470 8.239 0.231 1
1 891 . 14 1 1 A 77 77 LEU HA H 307 3.810 4.083 -0.273 1
1 901 . 14 1 1 A 77 77 LEU CA C 307 58.330 57.332 0.998 1
1 902 . 14 1 1 A 77 77 LEU CB C 307 41.250 41.187 0.063 1
1 906 . 14 1 1 A 77 77 LEU N N 307 120.830 119.884 0.946 1
1 907 . 14 1 1 A 78 78 ALA H H 308 8.280 8.366 -0.086 1
1 908 . 14 1 1 A 78 78 ALA HA H 308 4.320 4.079 0.241 1
1 912 . 14 1 1 A 78 78 ALA CA C 308 55.420 54.970 0.450 1
1 913 . 14 1 1 A 78 78 ALA CB C 308 17.750 18.098 -0.348 1
1 914 . 14 1 1 A 78 78 ALA N N 308 122.530 123.401 -0.871 1
1 915 . 14 1 1 A 79 79 SER H H 309 7.900 7.783 0.117 1
1 916 . 14 1 1 A 79 79 SER HA H 309 4.340 4.314 0.026 1
1 919 . 14 1 1 A 79 79 SER CA C 309 61.350 60.101 1.249 1
1 920 . 14 1 1 A 79 79 SER CB C 309 63.280 63.638 -0.358 1
1 921 . 14 1 1 A 79 79 SER N N 309 115.600 113.309 2.291 1
1 922 . 14 1 1 A 80 80 ARG H H 310 7.450 8.429 -0.979 1
1 923 . 14 1 1 A 80 80 ARG HA H 310 4.550 4.001 0.549 1
1 931 . 14 1 1 A 80 80 ARG CA C 310 54.200 57.547 -3.347 1
1 932 . 14 1 1 A 80 80 ARG CB C 310 30.680 30.026 0.654 1
1 935 . 14 1 1 A 80 80 ARG N N 310 119.360 120.095 -0.735 1
1 936 . 14 1 1 A 81 81 GLY H H 311 7.940 8.241 -0.301 1
1 937 . 14 1 1 A 81 81 GLY HA2 H 311 3.840 4.002 -0.162 1
1 938 . 14 1 1 A 81 81 GLY HA3 H 311 4.070 4.005 0.065 1
1 939 . 14 1 1 A 81 81 GLY CA C 311 46.060 45.307 0.753 1
1 940 . 14 1 1 A 81 81 GLY N N 311 108.130 106.564 1.566 1
1 941 . 14 1 1 A 82 82 LEU H H 312 7.920 7.544 0.376 1
1 942 . 14 1 1 A 82 82 LEU HA H 312 4.680 4.655 0.025 1
1 952 . 14 1 1 A 82 82 LEU CA C 312 53.070 53.149 -0.079 1
1 953 . 14 1 1 A 82 82 LEU CB C 312 45.790 44.667 1.123 1
1 957 . 14 1 1 A 82 82 LEU N N 312 119.290 120.422 -1.132 1
1 958 . 14 1 1 A 83 83 SER H H 313 7.530 8.856 -1.326 1
1 959 . 14 1 1 A 83 83 SER HA H 313 4.450 3.982 0.468 1
1 962 . 14 1 1 A 83 83 SER CA C 313 57.190 58.855 -1.665 1
1 963 . 14 1 1 A 83 83 SER CB C 313 66.080 61.665 4.415 1
1 964 . 14 1 1 A 83 83 SER N N 313 113.120 118.061 -4.941 1
1 965 . 14 1 1 A 84 84 LEU H H 314 8.340 8.447 -0.107 1
1 966 . 14 1 1 A 84 84 LEU HA H 314 4.620 4.397 0.223 1
1 976 . 14 1 1 A 84 84 LEU CA C 314 54.720 54.832 -0.112 1
1 977 . 14 1 1 A 84 84 LEU CB C 314 41.620 42.302 -0.682 1
1 981 . 14 1 1 A 84 84 LEU N N 314 115.930 119.317 -3.387 1
1 982 . 14 1 1 A 85 85 GLY H H 315 8.270 7.957 0.313 1
1 983 . 14 1 1 A 85 85 GLY HA2 H 315 3.320 3.971 -0.651 1
1 984 . 14 1 1 A 85 85 GLY HA3 H 315 3.850 3.974 -0.124 1
1 985 . 14 1 1 A 85 85 GLY CA C 315 46.560 46.535 0.025 1
1 986 . 14 1 1 A 85 85 GLY N N 315 111.010 108.046 2.964 1
1 987 . 14 1 1 A 86 86 MET H H 316 8.650 7.927 0.723 1
1 988 . 14 1 1 A 86 86 MET HA H 316 3.990 5.071 -1.081 1
1 996 . 14 1 1 A 86 86 MET CA C 316 56.730 53.202 3.528 1
1 997 . 14 1 1 A 86 86 MET CB C 316 33.600 35.571 -1.971 1
1 1000 . 14 1 1 A 86 86 MET N N 316 120.570 116.845 3.725 1
1 1001 . 14 1 1 A 87 87 ARG H H 317 8.360 8.916 -0.556 1
1 1002 . 14 1 1 A 87 87 ARG HA H 317 4.450 5.152 -0.702 1
1 1010 . 14 1 1 A 87 87 ARG CA C 317 55.310 54.578 0.732 1
1 1011 . 14 1 1 A 87 87 ARG CB C 317 30.490 33.659 -3.169 1
1 1014 . 14 1 1 A 87 87 ARG N N 317 122.290 120.656 1.634 1
1 1015 . 14 1 1 A 88 88 LEU H H 318 8.400 8.904 -0.504 1
1 1016 . 14 1 1 A 88 88 LEU HA H 318 4.670 4.853 -0.183 1
1 1026 . 14 1 1 A 88 88 LEU CA C 318 53.110 53.469 -0.359 1
1 1027 . 14 1 1 A 88 88 LEU CB C 318 43.600 43.485 0.115 1
1 1031 . 14 1 1 A 88 88 LEU N N 318 126.420 127.466 -1.046 1
1 1032 . 14 1 1 A 89 89 GLU H H 319 8.780 8.983 -0.203 1
1 1033 . 14 1 1 A 89 89 GLU HA H 319 4.340 3.965 0.375 1
1 1038 . 14 1 1 A 89 89 GLU CA C 319 56.490 59.610 -3.120 1
1 1039 . 14 1 1 A 89 89 GLU CB C 319 30.470 29.699 0.771 1
1 1041 . 14 1 1 A 89 89 GLU N N 319 123.070 122.156 0.914 1
1 1042 . 14 1 1 A 90 90 ASN H H 320 8.900 8.641 0.259 1
1 1043 . 14 1 1 A 90 90 ASN HA H 320 4.410 5.110 -0.700 1
1 1048 . 14 1 1 A 90 90 ASN CA C 320 54.120 55.063 -0.943 1
1 1049 . 14 1 1 A 90 90 ASN CB C 320 37.640 41.013 -3.373 1
1 1050 . 14 1 1 A 90 90 ASN N N 320 116.540 116.643 -0.103 1
1 1052 . 14 1 1 A 91 91 TRP H H 321 7.990 7.327 0.663 1
1 1053 . 14 1 1 A 91 91 TRP HA H 321 4.330 4.697 -0.367 1
1 1062 . 14 1 1 A 91 91 TRP CA C 321 54.590 58.388 -3.798 1
1 1063 . 14 1 1 A 91 91 TRP CB C 321 31.280 31.078 0.202 1
1 1069 . 14 1 1 A 91 91 TRP N N 321 119.230 118.027 1.203 1
1 1071 . 14 1 1 A 92 92 PRO HA H 322 4.800 3.803 0.997 1
1 1077 . 14 1 1 A 93 93 PRO HA H 323 4.450 4.391 0.059 1
1 1084 . 14 1 1 A 93 93 PRO CA C 323 61.970 62.155 -0.185 1
1 1085 . 14 1 1 A 93 93 PRO CB C 323 32.830 32.182 0.648 1
1 1088 . 14 1 1 A 94 94 ALA H H 324 8.460 8.613 -0.153 1
1 1089 . 14 1 1 A 94 94 ALA HA H 324 4.000 3.941 0.059 1
1 1093 . 14 1 1 A 94 94 ALA CA C 324 53.790 54.287 -0.497 1
1 1094 . 14 1 1 A 94 94 ALA CB C 324 18.640 18.477 0.163 1
1 1095 . 14 1 1 A 94 94 ALA N N 324 124.010 126.067 -2.057 1
1 1096 . 14 1 1 A 95 95 SER H H 325 7.950 8.112 -0.162 1
1 1097 . 14 1 1 A 95 95 SER HA H 325 4.210 4.182 0.028 1
1 1100 . 14 1 1 A 95 95 SER CA C 325 58.970 62.234 -3.264 1
1 1101 . 14 1 1 A 95 95 SER CB C 325 63.040 63.390 -0.350 1
1 1102 . 14 1 1 A 95 95 SER N N 325 111.520 114.574 -3.054 1
1 1103 . 14 1 1 A 96 96 ILE H H 326 7.480 7.152 0.328 1
1 1104 . 14 1 1 A 96 96 ILE HA H 326 4.170 4.311 -0.141 1
1 1114 . 14 1 1 A 96 96 ILE CA C 326 61.300 61.176 0.124 1
1 1115 . 14 1 1 A 96 96 ILE CB C 326 38.530 38.118 0.412 1
1 1119 . 14 1 1 A 96 96 ILE N N 326 119.650 112.880 6.770 1
1 1120 . 14 1 1 A 97 97 ALA H H 327 7.860 6.981 0.879 1
1 1121 . 14 1 1 A 97 97 ALA HA H 327 4.230 4.090 0.140 1
1 1125 . 14 1 1 A 97 97 ALA CA C 327 52.570 52.514 0.056 1
1 1126 . 14 1 1 A 97 97 ALA CB C 327 19.590 19.138 0.452 1
1 1127 . 14 1 1 A 97 97 ALA N N 327 126.480 127.411 -0.931 1
1 1128 . 14 1 1 A 98 98 ASP H H 328 8.250 8.783 -0.533 1
1 1129 . 14 1 1 A 98 98 ASP HA H 328 4.540 4.253 0.287 1
1 1132 . 14 1 1 A 98 98 ASP CA C 328 54.150 57.270 -3.120 1
1 1133 . 14 1 1 A 98 98 ASP CB C 328 41.120 40.640 0.480 1
1 1134 . 14 1 1 A 98 98 ASP N N 328 120.130 123.743 -3.613 1
1 1150 . 14 2 2 B 6 6 ASP H H 427 8.160 7.909 0.251 1
1 1151 . 14 2 2 B 6 6 ASP HA H 427 4.630 4.335 0.295 1
1 1154 . 14 2 2 B 6 6 ASP CA C 427 54.410 56.653 -2.243 1
1 1155 . 14 2 2 B 6 6 ASP CB C 427 41.250 40.379 0.871 1
1 1156 . 14 2 2 B 6 6 ASP N N 427 120.160 121.485 -1.325 1
1 1157 . 14 2 2 B 7 7 ASN H H 428 8.350 7.696 0.654 1
1 1158 . 14 2 2 B 7 7 ASN HA H 428 4.550 4.862 -0.312 1
1 1163 . 14 2 2 B 7 7 ASN CA C 428 53.310 53.652 -0.342 1
1 1164 . 14 2 2 B 7 7 ASN CB C 428 38.850 38.904 -0.054 1
1 1165 . 14 2 2 B 7 7 ASN N N 428 118.440 115.197 3.243 1
1 1167 . 14 2 2 B 8 8 LYS H H 429 8.030 7.518 0.512 1
1 1172 . 14 2 2 B 8 8 LYS CB C 429 33.280 33.389 -0.109 1
1 1174 . 14 2 2 B 8 8 LYS N N 429 120.260 122.622 -2.362 1
1 1175 . 14 2 2 B 9 9 PRO HA H 430 4.420 4.536 -0.116 1
1 1182 . 14 2 2 B 9 9 PRO CA C 430 62.280 62.661 -0.381 1
1 1183 . 14 2 2 B 9 9 PRO CB C 430 31.920 32.317 -0.397 1
1 1186 . 14 2 2 B 10 10 ALA H H 431 8.930 9.347 -0.417 1
1 1187 . 14 2 2 B 10 10 ALA HA H 431 4.350 4.459 -0.109 1
1 1191 . 14 2 2 B 10 10 ALA CA C 431 51.070 52.149 -1.079 1
1 1192 . 14 2 2 B 10 10 ALA CB C 431 20.920 19.428 1.492 1
1 1193 . 14 2 2 B 10 10 ALA N N 431 125.000 125.024 -0.024 1
1 1194 . 14 2 2 B 11 11 ASP H H 432 8.530 9.122 -0.592 1
1 1195 . 14 2 2 B 11 11 ASP HA H 432 4.220 4.291 -0.071 1
1 1198 . 14 2 2 B 11 11 ASP CA C 432 57.520 57.706 -0.186 1
1 1199 . 14 2 2 B 11 11 ASP CB C 432 40.470 41.007 -0.537 1
1 1200 . 14 2 2 B 11 11 ASP N N 432 119.610 123.532 -3.922 1
1 1201 . 14 2 2 B 12 12 ASP H H 433 8.340 8.024 0.316 1
1 1202 . 14 2 2 B 12 12 ASP HA H 433 4.160 4.448 -0.288 1
1 1205 . 14 2 2 B 12 12 ASP CA C 433 56.090 57.497 -1.407 1
1 1206 . 14 2 2 B 12 12 ASP CB C 433 38.960 40.703 -1.743 1
1 1207 . 14 2 2 B 12 12 ASP N N 433 116.330 118.257 -1.927 1
1 1208 . 14 2 2 B 13 13 LEU H H 434 7.360 7.804 -0.444 1
1 1209 . 14 2 2 B 13 13 LEU HA H 434 4.050 4.091 -0.041 1
1 1219 . 14 2 2 B 13 13 LEU CA C 434 57.340 57.489 -0.149 1
1 1220 . 14 2 2 B 13 13 LEU CB C 434 42.960 41.456 1.504 1
1 1224 . 14 2 2 B 13 13 LEU N N 434 123.440 121.344 2.096 1
1 1225 . 14 2 2 B 14 14 LEU H H 435 7.670 7.595 0.075 1
1 1226 . 14 2 2 B 14 14 LEU HA H 435 3.710 4.055 -0.345 1
1 1236 . 14 2 2 B 14 14 LEU CA C 435 57.170 57.179 -0.009 1
1 1237 . 14 2 2 B 14 14 LEU CB C 435 42.590 41.926 0.664 1
1 1241 . 14 2 2 B 14 14 LEU N N 435 115.170 119.720 -4.550 1
1 1242 . 14 2 2 B 15 15 ASN H H 436 7.490 8.273 -0.783 1
1 1243 . 14 2 2 B 15 15 ASN HA H 436 4.640 4.699 -0.059 1
1 1248 . 14 2 2 B 15 15 ASN CA C 436 52.920 54.486 -1.566 1
1 1249 . 14 2 2 B 15 15 ASN CB C 436 39.350 38.687 0.663 1
1 1250 . 14 2 2 B 15 15 ASN N N 436 112.280 115.284 -3.004 1
1 1252 . 14 2 2 B 16 16 LEU H H 437 7.300 7.397 -0.097 1
1 1253 . 14 2 2 B 16 16 LEU HA H 437 4.100 4.209 -0.109 1
1 1263 . 14 2 2 B 16 16 LEU CA C 437 55.310 55.294 0.016 1
1 1264 . 14 2 2 B 16 16 LEU CB C 437 41.800 42.989 -1.189 1
1 1268 . 14 2 2 B 16 16 LEU N N 437 125.180 122.805 2.375 1
1 1269 . 14 2 2 B 17 17 GLU H H 438 8.590 8.730 -0.140 1
1 1270 . 14 2 2 B 17 17 GLU HA H 438 3.920 4.011 -0.091 1
1 1275 . 14 2 2 B 17 17 GLU CA C 438 58.440 58.144 0.296 1
1 1276 . 14 2 2 B 17 17 GLU CB C 438 29.180 29.674 -0.494 1
1 1278 . 14 2 2 B 17 17 GLU N N 438 129.850 125.652 4.198 1
1 1279 . 14 2 2 B 18 18 GLY H H 439 8.580 8.945 -0.365 1
1 1280 . 14 2 2 B 18 18 GLY HA2 H 439 3.570 3.961 -0.391 1
1 1281 . 14 2 2 B 18 18 GLY HA3 H 439 4.220 3.964 0.256 1
1 1282 . 14 2 2 B 18 18 GLY CA C 439 44.710 45.450 -0.740 1
1 1283 . 14 2 2 B 18 18 GLY N N 439 112.250 114.939 -2.689 1
1 1284 . 14 2 2 B 19 19 VAL H H 440 7.900 7.764 0.136 1
1 1285 . 14 2 2 B 19 19 VAL HA H 440 3.950 4.424 -0.474 1
1 1293 . 14 2 2 B 19 19 VAL CA C 440 62.820 60.969 1.851 1
1 1294 . 14 2 2 B 19 19 VAL CB C 440 31.470 34.595 -3.125 1
1 1297 . 14 2 2 B 19 19 VAL N N 440 121.910 121.754 0.156 1
1 1298 . 14 2 2 B 20 20 ASP H H 441 7.390 8.794 -1.404 1
1 1299 . 14 2 2 B 20 20 ASP HA H 441 4.820 4.923 -0.103 1
1 1302 . 14 2 2 B 20 20 ASP CA C 441 51.920 53.487 -1.567 1
1 1303 . 14 2 2 B 20 20 ASP CB C 441 42.090 42.647 -0.557 1
1 1304 . 14 2 2 B 20 20 ASP N N 441 124.850 127.252 -2.402 1
1 1305 . 14 2 2 B 21 21 ARG H H 442 8.630 8.758 -0.128 1
1 1306 . 14 2 2 B 21 21 ARG HA H 442 3.810 3.493 0.317 1
1 1313 . 14 2 2 B 21 21 ARG CA C 442 60.710 59.919 0.791 1
1 1314 . 14 2 2 B 21 21 ARG CB C 442 30.020 29.908 0.112 1
1 1317 . 14 2 2 B 21 21 ARG N N 442 120.890 124.367 -3.477 1
1 1318 . 14 2 2 B 22 22 ASP H H 443 8.140 7.814 0.326 1
1 1319 . 14 2 2 B 22 22 ASP HA H 443 4.420 4.420 0.000 1
1 1322 . 14 2 2 B 22 22 ASP CA C 443 57.680 57.015 0.665 1
1 1323 . 14 2 2 B 22 22 ASP CB C 443 40.880 40.893 -0.013 1
1 1324 . 14 2 2 B 22 22 ASP N N 443 116.750 119.679 -2.929 1
1 1325 . 14 2 2 B 23 23 LEU H H 444 8.170 7.909 0.261 1
1 1326 . 14 2 2 B 23 23 LEU HA H 444 4.130 4.046 0.084 1
1 1336 . 14 2 2 B 23 23 LEU CA C 444 57.770 57.901 -0.131 1
1 1337 . 14 2 2 B 23 23 LEU CB C 444 41.230 41.131 0.099 1
1 1341 . 14 2 2 B 23 23 LEU N N 444 122.130 121.476 0.654 1
1 1342 . 14 2 2 B 24 24 ALA H H 445 8.630 8.649 -0.019 1
1 1343 . 14 2 2 B 24 24 ALA HA H 445 3.790 3.998 -0.208 1
1 1347 . 14 2 2 B 24 24 ALA CA C 445 55.810 54.407 1.403 1
1 1348 . 14 2 2 B 24 24 ALA CB C 445 18.060 18.063 -0.003 1
1 1349 . 14 2 2 B 24 24 ALA N N 445 120.890 121.097 -0.207 1
1 1350 . 14 2 2 B 25 25 PHE H H 446 8.160 7.398 0.762 1
1 1351 . 14 2 2 B 25 25 PHE HA H 446 4.080 4.328 -0.248 1
1 1358 . 14 2 2 B 25 25 PHE CA C 446 62.670 61.807 0.863 1
1 1359 . 14 2 2 B 25 25 PHE CB C 446 39.440 38.506 0.934 1
1 1364 . 14 2 2 B 25 25 PHE N N 446 115.360 116.156 -0.796 1
1 1365 . 14 2 2 B 26 26 LYS H H 447 8.040 7.980 0.060 1
1 1366 . 14 2 2 B 26 26 LYS HA H 447 4.110 3.954 0.156 1
1 1375 . 14 2 2 B 26 26 LYS CA C 447 60.140 59.385 0.755 1
1 1376 . 14 2 2 B 26 26 LYS CB C 447 32.880 32.532 0.348 1
1 1380 . 14 2 2 B 26 26 LYS N N 447 123.110 118.237 4.873 1
1 1381 . 14 2 2 B 27 27 LEU H H 448 8.630 8.128 0.502 1
1 1382 . 14 2 2 B 27 27 LEU HA H 448 3.840 4.089 -0.249 1
1 1392 . 14 2 2 B 27 27 LEU CA C 448 58.210 57.718 0.492 1
1 1393 . 14 2 2 B 27 27 LEU CB C 448 39.760 41.326 -1.566 1
1 1396 . 14 2 2 B 27 27 LEU N N 448 120.890 121.501 -0.611 1
1 1397 . 14 2 2 B 28 28 ALA H H 449 8.200 8.815 -0.615 1
1 1398 . 14 2 2 B 28 28 ALA HA H 449 3.760 4.503 -0.743 1
1 1402 . 14 2 2 B 28 28 ALA CA C 449 54.750 55.181 -0.431 1
1 1403 . 14 2 2 B 28 28 ALA CB C 449 18.050 18.386 -0.336 1
1 1404 . 14 2 2 B 28 28 ALA N N 449 123.710 120.359 3.351 1
1 1405 . 14 2 2 B 29 29 ALA H H 450 7.780 8.141 -0.361 1
1 1406 . 14 2 2 B 29 29 ALA HA H 450 4.170 4.079 0.091 1
1 1410 . 14 2 2 B 29 29 ALA CA C 450 54.430 54.641 -0.211 1
1 1411 . 14 2 2 B 29 29 ALA CB C 450 18.040 18.561 -0.521 1
1 1412 . 14 2 2 B 29 29 ALA N N 450 121.020 119.553 1.467 1
1 1413 . 14 2 2 B 30 30 ARG H H 451 7.390 7.638 -0.248 1
1 1414 . 14 2 2 B 30 30 ARG HA H 451 4.540 4.420 0.120 1
1 1421 . 14 2 2 B 30 30 ARG CA C 451 54.510 55.634 -1.124 1
1 1422 . 14 2 2 B 30 30 ARG CB C 451 29.950 29.728 0.222 1
1 1425 . 14 2 2 B 30 30 ARG N N 451 115.480 116.637 -1.157 1
1 1426 . 14 2 2 B 31 31 GLY H H 452 7.950 8.100 -0.150 1
1 1427 . 14 2 2 B 31 31 GLY HA2 H 452 3.550 3.985 -0.435 1
1 1428 . 14 2 2 B 31 31 GLY HA3 H 452 4.200 3.987 0.213 1
1 1429 . 14 2 2 B 31 31 GLY CA C 452 45.380 45.398 -0.018 1
1 1430 . 14 2 2 B 31 31 GLY N N 452 107.740 107.922 -0.182 1
1 1431 . 14 2 2 B 32 32 VAL H H 453 7.990 7.697 0.293 1
1 1432 . 14 2 2 B 32 32 VAL HA H 453 3.930 3.938 -0.008 1
1 1440 . 14 2 2 B 32 32 VAL CA C 453 61.420 62.875 -1.455 1
1 1441 . 14 2 2 B 32 32 VAL CB C 453 29.860 31.778 -1.918 1
1 1444 . 14 2 2 B 32 32 VAL N N 453 125.560 120.629 4.931 1
1 1445 . 14 2 2 B 33 33 CYS H H 454 8.460 8.635 -0.175 1
1 1446 . 14 2 2 B 33 33 CYS HA H 454 4.310 4.787 -0.477 1
1 1449 . 14 2 2 B 33 33 CYS CA C 454 60.260 58.995 1.265 1
1 1450 . 14 2 2 B 33 33 CYS CB C 454 30.330 29.915 0.415 1
1 1451 . 14 2 2 B 33 33 CYS N N 454 119.460 122.337 -2.877 1
1 1452 . 14 2 2 B 34 34 THR H H 455 8.080 7.664 0.416 1
1 1453 . 14 2 2 B 34 34 THR HA H 455 4.840 4.716 0.124 1
1 1458 . 14 2 2 B 34 34 THR CA C 455 58.650 60.568 -1.918 1
1 1459 . 14 2 2 B 34 34 THR CB C 455 72.680 71.534 1.146 1
1 1461 . 14 2 2 B 34 34 THR N N 455 108.420 113.842 -5.422 1
1 1462 . 14 2 2 B 35 35 LEU H H 456 8.580 8.741 -0.161 1
1 1463 . 14 2 2 B 35 35 LEU HA H 456 3.790 4.040 -0.250 1
1 1473 . 14 2 2 B 35 35 LEU CA C 456 57.980 58.666 -0.686 1
1 1474 . 14 2 2 B 35 35 LEU CB C 456 42.220 41.308 0.912 1
1 1477 . 14 2 2 B 35 35 LEU N N 456 120.370 127.179 -6.809 1
1 1478 . 14 2 2 B 36 36 GLU H H 457 8.390 8.301 0.089 1
1 1479 . 14 2 2 B 36 36 GLU HA H 457 3.820 3.802 0.018 1
1 1484 . 14 2 2 B 36 36 GLU CA C 457 59.640 60.022 -0.382 1
1 1485 . 14 2 2 B 36 36 GLU CB C 457 28.780 29.260 -0.480 1
1 1487 . 14 2 2 B 36 36 GLU N N 457 119.450 118.879 0.571 1
1 1488 . 14 2 2 B 37 37 ASP H H 458 7.750 7.839 -0.089 1
1 1489 . 14 2 2 B 37 37 ASP HA H 458 4.140 4.373 -0.233 1
1 1492 . 14 2 2 B 37 37 ASP CA C 458 57.150 57.328 -0.178 1
1 1493 . 14 2 2 B 37 37 ASP CB C 458 42.280 40.486 1.794 1
1 1494 . 14 2 2 B 37 37 ASP N N 458 117.430 120.492 -3.062 1
1 1495 . 14 2 2 B 38 38 LEU H H 459 7.700 7.802 -0.102 1
1 1496 . 14 2 2 B 38 38 LEU HA H 459 3.790 4.140 -0.350 1
1 1506 . 14 2 2 B 38 38 LEU CA C 459 58.080 57.919 0.161 1
1 1507 . 14 2 2 B 38 38 LEU CB C 459 41.130 41.270 -0.140 1
1 1511 . 14 2 2 B 38 38 LEU N N 459 121.280 121.655 -0.375 1
1 1512 . 14 2 2 B 39 39 ALA H H 460 8.190 8.300 -0.110 1
1 1513 . 14 2 2 B 39 39 ALA HA H 460 3.640 3.960 -0.320 1
1 1517 . 14 2 2 B 39 39 ALA CA C 460 54.320 55.389 -1.069 1
1 1518 . 14 2 2 B 39 39 ALA CB C 460 17.140 18.106 -0.966 1
1 1519 . 14 2 2 B 39 39 ALA N N 460 119.400 120.465 -1.065 1
1 1520 . 14 2 2 B 40 40 GLU H H 461 7.340 7.711 -0.371 1
1 1521 . 14 2 2 B 40 40 GLU HA H 461 4.180 4.251 -0.071 1
1 1526 . 14 2 2 B 40 40 GLU CA C 461 57.800 59.014 -1.214 1
1 1527 . 14 2 2 B 40 40 GLU CB C 461 30.600 29.579 1.021 1
1 1529 . 14 2 2 B 40 40 GLU N N 461 110.680 115.793 -5.113 1
1 1530 . 14 2 2 B 41 41 GLN H H 462 7.940 7.775 0.165 1
1 1531 . 14 2 2 B 41 41 GLN HA H 462 4.100 4.400 -0.300 1
1 1538 . 14 2 2 B 41 41 GLN CA C 462 55.310 56.897 -1.587 1
1 1539 . 14 2 2 B 41 41 GLN CB C 462 28.780 29.699 -0.919 1
1 1541 . 14 2 2 B 41 41 GLN N N 462 120.720 118.206 2.514 1
1 1543 . 14 2 2 B 42 42 GLY H H 463 9.000 8.615 0.385 1
1 1544 . 14 2 2 B 42 42 GLY HA2 H 463 3.310 4.408 -1.098 1
1 1545 . 14 2 2 B 42 42 GLY HA3 H 463 4.820 4.412 0.408 1
1 1546 . 14 2 2 B 42 42 GLY CA C 463 42.650 43.496 -0.846 1
1 1547 . 14 2 2 B 42 42 GLY N N 463 104.110 107.578 -3.468 1
1 1548 . 14 2 2 B 43 43 ILE H H 464 7.900 8.704 -0.804 1
1 1549 . 14 2 2 B 43 43 ILE HA H 464 3.260 3.707 -0.447 1
1 1558 . 14 2 2 B 43 43 ILE CA C 464 66.570 64.359 2.211 1
1 1559 . 14 2 2 B 43 43 ILE CB C 464 38.770 37.414 1.356 1
1 1562 . 14 2 2 B 43 43 ILE N N 464 119.410 121.546 -2.136 1
1 1563 . 14 2 2 B 44 44 ASP H H 465 8.730 8.287 0.443 1
1 1564 . 14 2 2 B 44 44 ASP HA H 465 4.310 4.324 -0.014 1
1 1567 . 14 2 2 B 44 44 ASP CA C 465 56.740 57.865 -1.125 1
1 1568 . 14 2 2 B 44 44 ASP CB C 465 40.120 41.713 -1.593 1
1 1569 . 14 2 2 B 44 44 ASP N N 465 116.610 121.854 -5.244 1
1 1570 . 14 2 2 B 45 45 ASP H H 466 7.720 7.965 -0.245 1
1 1571 . 14 2 2 B 45 45 ASP HA H 466 4.480 4.477 0.003 1
1 1574 . 14 2 2 B 45 45 ASP CA C 466 57.000 57.200 -0.200 1
1 1575 . 14 2 2 B 45 45 ASP CB C 466 42.270 40.717 1.553 1
1 1576 . 14 2 2 B 45 45 ASP N N 466 117.560 118.107 -0.547 1
1 1577 . 14 2 2 B 46 46 LEU H H 467 7.370 8.073 -0.703 1
1 1578 . 14 2 2 B 46 46 LEU HA H 467 4.410 4.156 0.254 1
1 1587 . 14 2 2 B 46 46 LEU CA C 467 53.660 57.449 -3.789 1
1 1588 . 14 2 2 B 46 46 LEU CB C 467 42.260 41.528 0.732 1
1 1591 . 14 2 2 B 46 46 LEU N N 467 116.890 120.687 -3.797 1
1 1592 . 14 2 2 B 47 47 ALA H H 468 7.080 8.556 -1.476 1
1 1593 . 14 2 2 B 47 47 ALA HA H 468 4.120 4.037 0.083 1
1 1597 . 14 2 2 B 47 47 ALA CA C 468 54.130 54.897 -0.767 1
1 1598 . 14 2 2 B 47 47 ALA CB C 468 19.480 18.446 1.034 1
1 1599 . 14 2 2 B 47 47 ALA N N 468 120.150 122.573 -2.423 1
1 1600 . 14 2 2 B 48 48 ASP H H 469 8.560 8.174 0.386 1
1 1601 . 14 2 2 B 48 48 ASP HA H 469 4.410 4.450 -0.040 1
1 1604 . 14 2 2 B 48 48 ASP CA C 469 54.330 57.529 -3.199 1
1 1605 . 14 2 2 B 48 48 ASP CB C 469 39.760 40.679 -0.919 1
1 1606 . 14 2 2 B 48 48 ASP N N 469 114.660 116.348 -1.688 1
1 1607 . 14 2 2 B 49 49 ILE H H 470 7.870 7.996 -0.126 1
1 1608 . 14 2 2 B 49 49 ILE HA H 470 3.850 4.343 -0.493 1
1 1618 . 14 2 2 B 49 49 ILE CA C 470 61.680 60.573 1.107 1
1 1619 . 14 2 2 B 49 49 ILE CB C 470 37.120 38.952 -1.832 1
1 1623 . 14 2 2 B 49 49 ILE N N 470 121.600 119.944 1.656 1
1 1624 . 14 2 2 B 50 50 GLU H H 471 8.680 9.076 -0.396 1
1 1625 . 14 2 2 B 50 50 GLU HA H 471 3.940 3.977 -0.037 1
1 1630 . 14 2 2 B 50 50 GLU CA C 471 58.360 59.816 -1.456 1
1 1631 . 14 2 2 B 50 50 GLU CB C 471 29.530 29.343 0.187 1
1 1633 . 14 2 2 B 50 50 GLU N N 471 131.000 128.192 2.808 1
1 1634 . 14 2 2 B 51 51 GLY H H 472 8.860 8.221 0.639 1
1 1635 . 14 2 2 B 51 51 GLY HA2 H 472 3.640 3.990 -0.350 1
1 1636 . 14 2 2 B 51 51 GLY HA3 H 472 4.230 3.994 0.236 1
1 1637 . 14 2 2 B 51 51 GLY CA C 472 45.190 47.200 -2.010 1
1 1638 . 14 2 2 B 51 51 GLY N N 472 113.580 106.793 6.787 1
1 1639 . 14 2 2 B 52 52 LEU H H 473 7.850 7.706 0.144 1
1 1640 . 14 2 2 B 52 52 LEU HA H 473 4.680 4.867 -0.187 1
1 1650 . 14 2 2 B 52 52 LEU CA C 473 53.640 53.669 -0.029 1
1 1651 . 14 2 2 B 52 52 LEU CB C 473 42.990 43.482 -0.492 1
1 1655 . 14 2 2 B 52 52 LEU N N 473 123.020 119.818 3.202 1
1 1656 . 14 2 2 B 53 53 THR H H 474 7.550 8.858 -1.308 1
1 1657 . 14 2 2 B 53 53 THR HA H 474 4.560 4.824 -0.264 1
1 1662 . 14 2 2 B 53 53 THR CA C 474 60.060 60.948 -0.888 1
1 1663 . 14 2 2 B 53 53 THR CB C 474 71.520 71.122 0.398 1
1 1665 . 14 2 2 B 53 53 THR N N 474 115.070 118.900 -3.830 1
1 1666 . 14 2 2 B 54 54 ASP H H 475 8.900 9.037 -0.137 1
1 1667 . 14 2 2 B 54 54 ASP HA H 475 4.220 4.297 -0.077 1
1 1670 . 14 2 2 B 54 54 ASP CA C 475 57.520 57.946 -0.426 1
1 1671 . 14 2 2 B 54 54 ASP CB C 475 39.560 40.242 -0.682 1
1 1672 . 14 2 2 B 54 54 ASP N N 475 121.800 123.830 -2.030 1
1 1673 . 14 2 2 B 55 55 GLU H H 476 8.460 7.940 0.520 1
1 1674 . 14 2 2 B 55 55 GLU HA H 476 3.970 4.027 -0.057 1
1 1679 . 14 2 2 B 55 55 GLU CA C 476 59.440 59.052 0.388 1
1 1680 . 14 2 2 B 55 55 GLU CB C 476 29.650 29.494 0.156 1
1 1682 . 14 2 2 B 55 55 GLU N N 476 119.460 119.443 0.017 1
1 1683 . 14 2 2 B 56 56 LYS H H 477 7.790 8.010 -0.220 1
1 1684 . 14 2 2 B 56 56 LYS HA H 477 4.120 4.095 0.025 1
1 1693 . 14 2 2 B 56 56 LYS CA C 477 58.890 58.753 0.137 1
1 1694 . 14 2 2 B 56 56 LYS CB C 477 32.600 32.273 0.327 1
1 1698 . 14 2 2 B 56 56 LYS N N 477 121.840 119.691 2.149 1
1 1699 . 14 2 2 B 57 57 ALA H H 478 8.900 9.172 -0.272 1
1 1700 . 14 2 2 B 57 57 ALA HA H 478 3.790 4.050 -0.260 1
1 1704 . 14 2 2 B 57 57 ALA CA C 478 55.810 55.698 0.112 1
1 1705 . 14 2 2 B 57 57 ALA CB C 478 18.590 18.127 0.463 1
1 1706 . 14 2 2 B 57 57 ALA N N 478 121.350 121.894 -0.544 1
1 1707 . 14 2 2 B 58 58 GLY H H 479 8.300 8.141 0.159 1
1 1708 . 14 2 2 B 58 58 GLY HA2 H 479 3.500 3.781 -0.281 1
1 1709 . 14 2 2 B 58 58 GLY HA3 H 479 3.890 3.786 0.104 1
1 1710 . 14 2 2 B 58 58 GLY CA C 479 47.360 47.270 0.090 1
1 1711 . 14 2 2 B 58 58 GLY N N 479 102.040 107.986 -5.946 1
1 1712 . 14 2 2 B 59 59 ALA H H 480 7.580 7.943 -0.363 1
1 1713 . 14 2 2 B 59 59 ALA HA H 480 4.110 4.045 0.065 1
1 1717 . 14 2 2 B 59 59 ALA CA C 480 55.580 54.693 0.887 1
1 1718 . 14 2 2 B 59 59 ALA CB C 480 18.130 18.795 -0.665 1
1 1719 . 14 2 2 B 59 59 ALA N N 480 123.180 124.859 -1.679 1
1 1720 . 14 2 2 B 60 60 LEU H H 481 8.290 7.964 0.326 1
1 1721 . 14 2 2 B 60 60 LEU HA H 481 4.020 3.955 0.065 1
1 1731 . 14 2 2 B 60 60 LEU CA C 481 57.850 57.890 -0.040 1
1 1732 . 14 2 2 B 60 60 LEU CB C 481 42.360 42.050 0.310 1
1 1736 . 14 2 2 B 60 60 LEU N N 481 120.560 117.703 2.857 1
1 1737 . 14 2 2 B 61 61 ILE H H 482 8.080 8.211 -0.131 1
1 1738 . 14 2 2 B 61 61 ILE HA H 482 3.210 3.545 -0.335 1
1 1748 . 14 2 2 B 61 61 ILE CA C 482 66.250 65.410 0.840 1
1 1749 . 14 2 2 B 61 61 ILE CB C 482 39.400 37.721 1.679 1
1 1753 . 14 2 2 B 61 61 ILE N N 482 119.170 119.260 -0.090 1
1 1754 . 14 2 2 B 62 62 MET H H 483 8.110 8.328 -0.218 1
1 1755 . 14 2 2 B 62 62 MET HA H 483 4.410 4.172 0.238 1
1 1763 . 14 2 2 B 62 62 MET CA C 483 56.110 58.813 -2.703 1
1 1764 . 14 2 2 B 62 62 MET CB C 483 28.260 32.710 -4.450 1
1 1767 . 14 2 2 B 62 62 MET N N 483 114.420 118.078 -3.658 1
1 1768 . 14 2 2 B 63 63 ALA H H 484 8.240 7.812 0.428 1
1 1769 . 14 2 2 B 63 63 ALA HA H 484 4.130 4.081 0.049 1
1 1773 . 14 2 2 B 63 63 ALA CA C 484 55.300 55.142 0.158 1
1 1774 . 14 2 2 B 63 63 ALA CB C 484 18.280 18.217 0.063 1
1 1775 . 14 2 2 B 63 63 ALA N N 484 123.710 121.260 2.450 1
1 1776 . 14 2 2 B 64 64 ALA H H 485 8.050 8.326 -0.276 1
1 1777 . 14 2 2 B 64 64 ALA HA H 485 3.870 4.085 -0.215 1
1 1781 . 14 2 2 B 64 64 ALA CA C 485 55.330 55.328 0.002 1
1 1782 . 14 2 2 B 64 64 ALA CB C 485 17.660 18.215 -0.555 1
1 1783 . 14 2 2 B 64 64 ALA N N 485 120.070 120.470 -0.400 1
1 1784 . 14 2 2 B 65 65 ARG H H 486 8.640 8.543 0.097 1
1 1785 . 14 2 2 B 65 65 ARG HA H 486 2.800 4.208 -1.408 1
1 1792 . 14 2 2 B 65 65 ARG CA C 486 60.600 59.951 0.649 1
1 1793 . 14 2 2 B 65 65 ARG CB C 486 29.910 30.379 -0.469 1
1 1796 . 14 2 2 B 65 65 ARG N N 486 118.730 117.981 0.749 1
1 1797 . 14 2 2 B 66 66 ASN H H 487 8.710 8.507 0.203 1
1 1798 . 14 2 2 B 66 66 ASN HA H 487 4.550 5.033 -0.483 1
1 1803 . 14 2 2 B 66 66 ASN CA C 487 56.390 56.524 -0.134 1
1 1804 . 14 2 2 B 66 66 ASN CB C 487 37.970 38.771 -0.801 1
1 1805 . 14 2 2 B 66 66 ASN N N 487 119.170 117.864 1.306 1
1 1807 . 14 2 2 B 67 67 ILE H H 488 7.250 7.814 -0.564 1
1 1808 . 14 2 2 B 67 67 ILE HA H 488 3.810 3.865 -0.055 1
1 1818 . 14 2 2 B 67 67 ILE CA C 488 64.350 64.670 -0.320 1
1 1819 . 14 2 2 B 67 67 ILE CB C 488 39.570 37.328 2.242 1
1 1823 . 14 2 2 B 67 67 ILE N N 488 117.890 119.696 -1.806 1
1 1824 . 14 2 2 B 68 68 CYS H H 489 8.350 8.264 0.086 1
1 1825 . 14 2 2 B 68 68 CYS HA H 489 4.080 4.081 -0.001 1
1 1828 . 14 2 2 B 68 68 CYS CA C 489 62.670 62.551 0.119 1
1 1829 . 14 2 2 B 68 68 CYS CB C 489 28.170 27.253 0.917 1
1 1830 . 14 2 2 B 68 68 CYS N N 489 115.230 120.387 -5.157 1
1 1831 . 14 2 2 B 69 69 TRP H H 490 8.230 9.069 -0.839 1
1 1832 . 14 2 2 B 69 69 TRP HA H 490 5.100 4.248 0.852 1
1 1841 . 14 2 2 B 69 69 TRP CA C 490 55.420 60.322 -4.902 1
1 1842 . 14 2 2 B 69 69 TRP CB C 490 31.010 29.046 1.964 1
1 1844 . 14 2 2 B 69 69 TRP N N 490 116.850 120.979 -4.129 1
1 1846 . 14 2 2 B 70 70 PHE H H 491 7.570 8.210 -0.640 1
1 1847 . 14 2 2 B 70 70 PHE HA H 491 5.240 4.686 0.554 1
1 1852 . 14 2 2 B 70 70 PHE CA C 491 55.490 58.155 -2.665 1
1 1853 . 14 2 2 B 70 70 PHE CB C 491 38.700 38.751 -0.051 1
1 1856 . 14 2 2 B 70 70 PHE N N 491 117.460 115.942 1.518 1
1 1857 . 14 2 2 B 71 71 GLY H H 492 8.420 8.033 0.387 1
1 1858 . 14 2 2 B 71 71 GLY HA2 H 492 3.920 4.028 -0.108 1
1 1859 . 14 2 2 B 71 71 GLY HA3 H 492 4.080 4.067 0.013 1
1 1860 . 14 2 2 B 71 71 GLY CA C 492 46.210 45.387 0.823 1
1 1861 . 14 2 2 B 71 71 GLY N N 492 110.040 107.941 2.099 1
1 1862 . 14 2 2 B 72 72 ASP H H 493 8.370 8.689 -0.319 1
1 1863 . 14 2 2 B 72 72 ASP HA H 493 4.630 4.238 0.392 1
1 1866 . 14 2 2 B 72 72 ASP CA C 493 54.410 57.136 -2.726 1
1 1867 . 14 2 2 B 72 72 ASP CB C 493 41.250 40.364 0.886 1
1 1868 . 14 2 2 B 72 72 ASP N N 493 120.000 122.768 -2.768 1
1 1869 . 14 2 2 B 73 73 GLU H H 494 8.230 8.572 -0.342 1
1 1870 . 14 2 2 B 73 73 GLU HA H 494 4.260 4.003 0.257 1
1 1875 . 14 2 2 B 73 73 GLU CA C 494 56.510 59.534 -3.024 1
1 1876 . 14 2 2 B 73 73 GLU CB C 494 30.420 29.246 1.174 1
1 1878 . 14 2 2 B 73 73 GLU N N 494 120.900 119.345 1.555 1
1 216 . 15 1 1 A 20 20 ASP H H 250 8.550 8.964 -0.414 1
1 217 . 15 1 1 A 20 20 ASP HA H 250 4.700 4.545 0.155 1
1 220 . 15 1 1 A 20 20 ASP CA C 250 52.650 52.800 -0.150 1
1 221 . 15 1 1 A 20 20 ASP CB C 250 41.420 40.629 0.791 1
1 222 . 15 1 1 A 20 20 ASP N N 250 125.190 125.146 0.044 1
1 223 . 15 1 1 A 21 21 PRO HA H 251 4.250 4.484 -0.234 1
1 230 . 15 1 1 A 21 21 PRO CA C 251 65.120 64.653 0.467 1
1 231 . 15 1 1 A 21 21 PRO CB C 251 32.310 32.237 0.073 1
1 234 . 15 1 1 A 22 22 ILE H H 252 8.630 7.797 0.833 1
1 235 . 15 1 1 A 22 22 ILE HA H 252 4.060 3.986 0.074 1
1 245 . 15 1 1 A 22 22 ILE CA C 252 62.990 62.733 0.257 1
1 246 . 15 1 1 A 22 22 ILE CB C 252 37.520 37.652 -0.132 1
1 250 . 15 1 1 A 22 22 ILE N N 252 119.860 117.225 2.635 1
1 251 . 15 1 1 A 23 23 LEU H H 253 7.950 7.754 0.196 1
1 252 . 15 1 1 A 23 23 LEU HA H 253 3.710 4.133 -0.423 1
1 262 . 15 1 1 A 23 23 LEU CA C 253 56.510 57.853 -1.343 1
1 263 . 15 1 1 A 23 23 LEU CB C 253 41.190 41.765 -0.575 1
1 266 . 15 1 1 A 23 23 LEU N N 253 116.850 121.295 -4.445 1
1 267 . 15 1 1 A 24 24 LEU H H 254 7.370 7.611 -0.241 1
1 268 . 15 1 1 A 24 24 LEU HA H 254 4.310 4.578 -0.268 1
1 278 . 15 1 1 A 24 24 LEU CA C 254 54.890 57.437 -2.547 1
1 279 . 15 1 1 A 24 24 LEU CB C 254 41.960 42.384 -0.424 1
1 283 . 15 1 1 A 24 24 LEU N N 254 115.210 119.415 -4.205 1
1 284 . 15 1 1 A 25 25 ARG H H 255 7.520 8.144 -0.624 1
1 285 . 15 1 1 A 25 25 ARG HA H 255 4.660 4.155 0.505 1
1 293 . 15 1 1 A 25 25 ARG CA C 255 52.840 54.208 -1.368 1
1 294 . 15 1 1 A 25 25 ARG CB C 255 28.130 30.622 -2.492 1
1 297 . 15 1 1 A 25 25 ARG N N 255 118.180 121.573 -3.393 1
1 298 . 15 1 1 A 26 26 PRO HA H 256 4.800 4.843 -0.043 1
1 305 . 15 1 1 A 26 26 PRO CA C 256 61.790 62.908 -1.118 1
1 306 . 15 1 1 A 26 26 PRO CB C 256 32.660 31.796 0.864 1
1 309 . 15 1 1 A 27 27 VAL H H 257 8.170 8.430 -0.260 1
1 310 . 15 1 1 A 27 27 VAL HA H 257 3.590 3.755 -0.165 1
1 318 . 15 1 1 A 27 27 VAL CA C 257 64.830 65.416 -0.586 1
1 319 . 15 1 1 A 27 27 VAL CB C 257 31.720 31.416 0.304 1
1 322 . 15 1 1 A 27 27 VAL N N 257 115.710 124.373 -8.663 1
1 323 . 15 1 1 A 28 28 ASP H H 258 8.240 8.206 0.034 1
1 324 . 15 1 1 A 28 28 ASP HA H 258 4.340 4.362 -0.022 1
1 327 . 15 1 1 A 28 28 ASP CA C 258 56.490 57.133 -0.643 1
1 328 . 15 1 1 A 28 28 ASP CB C 258 40.520 41.177 -0.657 1
1 329 . 15 1 1 A 28 28 ASP N N 258 119.000 120.702 -1.702 1
1 330 . 15 1 1 A 29 29 ASP H H 259 8.000 8.916 -0.916 1
1 331 . 15 1 1 A 29 29 ASP HA H 259 4.390 4.596 -0.206 1
1 334 . 15 1 1 A 29 29 ASP CA C 259 56.210 56.061 0.149 1
1 335 . 15 1 1 A 29 29 ASP CB C 259 40.670 40.899 -0.229 1
1 336 . 15 1 1 A 29 29 ASP N N 259 118.900 117.590 1.310 1
1 337 . 15 1 1 A 30 30 LEU H H 260 7.760 7.347 0.413 1
1 338 . 15 1 1 A 30 30 LEU HA H 260 3.990 4.219 -0.229 1
1 348 . 15 1 1 A 30 30 LEU CA C 260 55.000 55.306 -0.306 1
1 349 . 15 1 1 A 30 30 LEU CB C 260 41.670 42.041 -0.371 1
1 353 . 15 1 1 A 30 30 LEU N N 260 116.300 121.048 -4.748 1
1 354 . 15 1 1 A 31 31 GLU H H 261 7.990 8.892 -0.902 1
1 355 . 15 1 1 A 31 31 GLU HA H 261 4.280 4.022 0.258 1
1 358 . 15 1 1 A 31 31 GLU CA C 261 56.860 59.083 -2.223 1
1 359 . 15 1 1 A 31 31 GLU CB C 261 27.010 29.768 -2.758 1
1 360 . 15 1 1 A 31 31 GLU N N 261 115.620 124.018 -8.398 1
1 361 . 15 1 1 A 32 32 LEU H H 262 8.000 7.298 0.702 1
1 362 . 15 1 1 A 32 32 LEU HA H 262 4.400 4.346 0.054 1
1 372 . 15 1 1 A 32 32 LEU CA C 262 53.860 55.054 -1.194 1
1 373 . 15 1 1 A 32 32 LEU CB C 262 44.450 42.482 1.968 1
1 377 . 15 1 1 A 32 32 LEU N N 262 118.860 122.611 -3.751 1
1 378 . 15 1 1 A 33 33 THR H H 263 10.020 8.687 1.333 1
1 379 . 15 1 1 A 33 33 THR HA H 263 4.130 4.741 -0.611 1
1 384 . 15 1 1 A 33 33 THR CA C 263 62.400 60.519 1.881 1
1 385 . 15 1 1 A 33 33 THR CB C 263 71.270 71.281 -0.011 1
1 387 . 15 1 1 A 33 33 THR N N 263 114.610 112.928 1.682 1
1 388 . 15 1 1 A 34 34 VAL H H 264 8.370 8.873 -0.503 1
1 389 . 15 1 1 A 34 34 VAL HA H 264 3.620 3.661 -0.041 1
1 397 . 15 1 1 A 34 34 VAL CA C 264 66.340 66.930 -0.590 1
1 398 . 15 1 1 A 34 34 VAL CB C 264 31.670 31.494 0.176 1
1 401 . 15 1 1 A 34 34 VAL N N 264 122.110 122.379 -0.269 1
1 402 . 15 1 1 A 35 35 ARG H H 265 8.190 8.065 0.125 1
1 403 . 15 1 1 A 35 35 ARG HA H 265 4.070 3.900 0.170 1
1 411 . 15 1 1 A 35 35 ARG CA C 265 59.470 59.807 -0.337 1
1 412 . 15 1 1 A 35 35 ARG CB C 265 29.790 29.912 -0.122 1
1 415 . 15 1 1 A 35 35 ARG N N 265 117.340 120.938 -3.598 1
1 416 . 15 1 1 A 36 36 SER H H 266 7.610 7.857 -0.247 1
1 417 . 15 1 1 A 36 36 SER HA H 266 4.080 4.111 -0.031 1
1 420 . 15 1 1 A 36 36 SER CA C 266 63.080 61.958 1.122 1
1 421 . 15 1 1 A 36 36 SER CB C 266 63.280 62.814 0.466 1
1 422 . 15 1 1 A 36 36 SER N N 266 116.710 116.820 -0.110 1
1 423 . 15 1 1 A 37 37 ALA H H 267 8.720 7.719 1.001 1
1 424 . 15 1 1 A 37 37 ALA HA H 267 3.760 4.028 -0.268 1
1 428 . 15 1 1 A 37 37 ALA CA C 267 55.900 55.280 0.620 1
1 429 . 15 1 1 A 37 37 ALA CB C 267 18.090 17.858 0.232 1
1 430 . 15 1 1 A 37 37 ALA N N 267 124.170 123.700 0.470 1
1 431 . 15 1 1 A 38 38 ASN H H 268 8.850 9.367 -0.517 1
1 432 . 15 1 1 A 38 38 ASN HA H 268 4.420 4.491 -0.071 1
1 437 . 15 1 1 A 38 38 ASN CA C 268 55.700 56.156 -0.456 1
1 438 . 15 1 1 A 38 38 ASN CB C 268 37.180 37.693 -0.513 1
1 439 . 15 1 1 A 38 38 ASN N N 268 117.370 117.536 -0.166 1
1 441 . 15 1 1 A 39 39 CYS H H 269 7.970 8.078 -0.108 1
1 442 . 15 1 1 A 39 39 CYS HA H 269 4.190 4.135 0.055 1
1 445 . 15 1 1 A 39 39 CYS CA C 269 63.340 62.832 0.508 1
1 446 . 15 1 1 A 39 39 CYS CB C 269 26.870 27.511 -0.641 1
1 447 . 15 1 1 A 39 39 CYS N N 269 120.510 118.869 1.641 1
1 448 . 15 1 1 A 40 40 LEU H H 270 7.600 7.761 -0.161 1
1 449 . 15 1 1 A 40 40 LEU HA H 270 3.880 3.912 -0.032 1
1 458 . 15 1 1 A 40 40 LEU CA C 270 57.810 58.118 -0.308 1
1 459 . 15 1 1 A 40 40 LEU CB C 270 40.030 41.772 -1.742 1
1 462 . 15 1 1 A 40 40 LEU N N 270 117.710 120.534 -2.824 1
1 463 . 15 1 1 A 41 41 LYS H H 271 7.980 8.378 -0.398 1
1 464 . 15 1 1 A 41 41 LYS HA H 271 3.820 4.484 -0.664 1
1 472 . 15 1 1 A 41 41 LYS CA C 271 59.840 59.682 0.158 1
1 473 . 15 1 1 A 41 41 LYS CB C 271 32.070 32.097 -0.027 1
1 476 . 15 1 1 A 41 41 LYS N N 271 120.070 117.371 2.699 1
1 477 . 15 1 1 A 42 42 ALA H H 272 7.860 8.507 -0.647 1
1 478 . 15 1 1 A 42 42 ALA HA H 272 4.140 4.027 0.113 1
1 482 . 15 1 1 A 42 42 ALA CA C 272 54.670 54.824 -0.154 1
1 483 . 15 1 1 A 42 42 ALA CB C 272 17.950 18.684 -0.734 1
1 484 . 15 1 1 A 42 42 ALA N N 272 122.880 121.107 1.773 1
1 485 . 15 1 1 A 43 43 GLU H H 273 7.210 7.840 -0.630 1
1 486 . 15 1 1 A 43 43 GLU HA H 273 4.260 4.438 -0.178 1
1 491 . 15 1 1 A 43 43 GLU CA C 273 55.020 56.005 -0.985 1
1 492 . 15 1 1 A 43 43 GLU CB C 273 29.880 29.479 0.401 1
1 494 . 15 1 1 A 43 43 GLU N N 273 116.590 115.435 1.155 1
1 495 . 15 1 1 A 44 44 ALA H H 274 7.880 8.198 -0.318 1
1 496 . 15 1 1 A 44 44 ALA HA H 274 3.680 3.911 -0.231 1
1 500 . 15 1 1 A 44 44 ALA CA C 274 52.960 53.118 -0.158 1
1 501 . 15 1 1 A 44 44 ALA CB C 274 16.110 17.124 -1.014 1
1 502 . 15 1 1 A 44 44 ALA N N 274 118.420 118.795 -0.375 1
1 503 . 15 1 1 A 45 45 ILE H H 275 7.600 7.539 0.061 1
1 504 . 15 1 1 A 45 45 ILE HA H 275 3.870 4.494 -0.624 1
1 514 . 15 1 1 A 45 45 ILE CA C 275 61.150 60.444 0.706 1
1 515 . 15 1 1 A 45 45 ILE CB C 275 37.090 40.093 -3.003 1
1 519 . 15 1 1 A 45 45 ILE N N 275 120.370 118.269 2.101 1
1 520 . 15 1 1 A 46 46 HIS H H 276 8.350 8.226 0.124 1
1 521 . 15 1 1 A 46 46 HIS HA H 276 4.600 4.791 -0.191 1
1 526 . 15 1 1 A 46 46 HIS CA C 276 56.900 56.010 0.890 1
1 527 . 15 1 1 A 46 46 HIS CB C 276 31.910 30.906 1.004 1
1 529 . 15 1 1 A 46 46 HIS N N 276 123.250 122.573 0.677 1
1 530 . 15 1 1 A 47 47 TYR H H 277 8.850 6.828 2.022 1
1 531 . 15 1 1 A 47 47 TYR HA H 277 5.100 4.559 0.541 1
1 538 . 15 1 1 A 47 47 TYR CA C 277 57.430 56.724 0.706 1
1 539 . 15 1 1 A 47 47 TYR CB C 277 40.680 39.878 0.802 1
1 544 . 15 1 1 A 47 47 TYR N N 277 119.700 118.065 1.635 1
1 545 . 15 1 1 A 48 48 ILE H H 278 9.380 8.439 0.941 1
1 546 . 15 1 1 A 48 48 ILE HA H 278 3.340 3.610 -0.270 1
1 554 . 15 1 1 A 48 48 ILE CA C 278 67.640 65.022 2.618 1
1 555 . 15 1 1 A 48 48 ILE CB C 278 36.310 37.611 -1.301 1
1 558 . 15 1 1 A 48 48 ILE N N 278 125.650 124.540 1.110 1
1 559 . 15 1 1 A 49 49 GLY H H 279 9.430 8.761 0.669 1
1 560 . 15 1 1 A 49 49 GLY HA2 H 279 2.370 2.612 -0.242 1
1 561 . 15 1 1 A 49 49 GLY HA3 H 279 3.230 3.686 -0.456 1
1 562 . 15 1 1 A 49 49 GLY CA C 279 46.820 46.943 -0.123 1
1 563 . 15 1 1 A 49 49 GLY N N 279 105.200 108.604 -3.404 1
1 564 . 15 1 1 A 50 50 ASP H H 280 7.050 7.546 -0.496 1
1 565 . 15 1 1 A 50 50 ASP HA H 280 4.360 4.136 0.224 1
1 568 . 15 1 1 A 50 50 ASP CA C 280 57.110 56.157 0.953 1
1 569 . 15 1 1 A 50 50 ASP CB C 280 42.620 40.487 2.133 1
1 570 . 15 1 1 A 50 50 ASP N N 280 116.360 120.973 -4.613 1
1 571 . 15 1 1 A 51 51 LEU H H 281 7.170 8.088 -0.918 1
1 572 . 15 1 1 A 51 51 LEU HA H 281 3.880 3.945 -0.065 1
1 582 . 15 1 1 A 51 51 LEU CA C 281 57.900 58.277 -0.377 1
1 583 . 15 1 1 A 51 51 LEU CB C 281 41.870 41.402 0.468 1
1 587 . 15 1 1 A 51 51 LEU N N 281 120.130 121.876 -1.746 1
1 588 . 15 1 1 A 52 52 VAL H H 282 7.820 7.652 0.168 1
1 589 . 15 1 1 A 52 52 VAL HA H 282 3.980 3.908 0.072 1
1 597 . 15 1 1 A 52 52 VAL CA C 282 64.000 65.338 -1.338 1
1 598 . 15 1 1 A 52 52 VAL CB C 282 30.400 31.203 -0.803 1
1 601 . 15 1 1 A 52 52 VAL N N 282 105.550 115.217 -9.667 1
1 602 . 15 1 1 A 53 53 GLN H H 283 6.550 7.832 -1.282 1
1 603 . 15 1 1 A 53 53 GLN HA H 283 4.680 4.032 0.648 1
1 610 . 15 1 1 A 53 53 GLN CA C 283 56.210 58.860 -2.650 1
1 611 . 15 1 1 A 53 53 GLN CB C 283 31.710 28.722 2.988 1
1 613 . 15 1 1 A 53 53 GLN N N 283 114.060 120.811 -6.751 1
1 615 . 15 1 1 A 54 54 ARG H H 284 7.690 7.558 0.132 1
1 616 . 15 1 1 A 54 54 ARG HA H 284 4.520 4.703 -0.183 1
1 624 . 15 1 1 A 54 54 ARG CA C 284 54.600 54.633 -0.033 1
1 625 . 15 1 1 A 54 54 ARG CB C 284 30.750 31.308 -0.558 1
1 628 . 15 1 1 A 54 54 ARG N N 284 119.810 118.607 1.203 1
1 629 . 15 1 1 A 55 55 THR H H 285 8.110 8.748 -0.638 1
1 630 . 15 1 1 A 55 55 THR HA H 285 4.430 4.364 0.066 1
1 635 . 15 1 1 A 55 55 THR CA C 285 59.640 63.776 -4.136 1
1 636 . 15 1 1 A 55 55 THR CB C 285 71.310 69.148 2.162 1
1 638 . 15 1 1 A 55 55 THR N N 285 108.450 117.414 -8.964 1
1 639 . 15 1 1 A 56 56 GLU H H 286 8.910 8.935 -0.025 1
1 640 . 15 1 1 A 56 56 GLU HA H 286 3.660 3.923 -0.263 1
1 645 . 15 1 1 A 56 56 GLU CA C 286 60.650 59.761 0.889 1
1 646 . 15 1 1 A 56 56 GLU CB C 286 29.400 29.213 0.187 1
1 648 . 15 1 1 A 56 56 GLU N N 286 120.600 126.616 -6.016 1
1 649 . 15 1 1 A 57 57 VAL H H 287 7.600 8.148 -0.548 1
1 650 . 15 1 1 A 57 57 VAL HA H 287 3.620 3.530 0.090 1
1 658 . 15 1 1 A 57 57 VAL CA C 287 66.020 67.109 -1.089 1
1 659 . 15 1 1 A 57 57 VAL CB C 287 31.720 31.568 0.152 1
1 662 . 15 1 1 A 57 57 VAL N N 287 114.050 119.943 -5.893 1
1 663 . 15 1 1 A 58 58 GLU H H 288 7.350 8.399 -1.049 1
1 664 . 15 1 1 A 58 58 GLU HA H 288 3.830 4.027 -0.197 1
1 669 . 15 1 1 A 58 58 GLU CA C 288 59.250 59.475 -0.225 1
1 670 . 15 1 1 A 58 58 GLU CB C 288 30.030 29.012 1.018 1
1 672 . 15 1 1 A 58 58 GLU N N 288 117.610 119.008 -1.398 1
1 673 . 15 1 1 A 59 59 LEU H H 289 7.850 8.025 -0.175 1
1 674 . 15 1 1 A 59 59 LEU HA H 289 4.150 4.070 0.080 1
1 683 . 15 1 1 A 59 59 LEU CA C 289 57.340 58.004 -0.664 1
1 684 . 15 1 1 A 59 59 LEU CB C 289 41.170 41.673 -0.503 1
1 687 . 15 1 1 A 59 59 LEU N N 289 120.050 120.977 -0.927 1
1 688 . 15 1 1 A 60 60 LEU H H 290 7.670 8.210 -0.540 1
1 689 . 15 1 1 A 60 60 LEU HA H 290 4.540 3.999 0.541 1
1 696 . 15 1 1 A 60 60 LEU CA C 290 55.090 57.078 -1.988 1
1 697 . 15 1 1 A 60 60 LEU CB C 290 42.320 41.372 0.948 1
1 701 . 15 1 1 A 60 60 LEU N N 290 114.980 118.836 -3.856 1
1 702 . 15 1 1 A 61 61 LYS H H 291 7.440 7.189 0.251 1
1 703 . 15 1 1 A 61 61 LYS HA H 291 4.280 4.328 -0.048 1
1 710 . 15 1 1 A 61 61 LYS CA C 291 56.860 56.626 0.234 1
1 711 . 15 1 1 A 61 61 LYS CB C 291 31.900 33.021 -1.121 1
1 714 . 15 1 1 A 61 61 LYS N N 291 118.120 116.087 2.033 1
1 715 . 15 1 1 A 62 62 THR H H 292 7.310 7.589 -0.279 1
1 716 . 15 1 1 A 62 62 THR HA H 292 5.220 4.402 0.818 1
1 721 . 15 1 1 A 62 62 THR CA C 292 55.830 59.795 -3.965 1
1 722 . 15 1 1 A 62 62 THR CB C 292 69.970 69.054 0.916 1
1 724 . 15 1 1 A 62 62 THR N N 292 111.890 115.324 -3.434 1
1 725 . 15 1 1 A 63 63 PRO HA H 293 4.570 4.430 0.140 1
1 730 . 15 1 1 A 63 63 PRO CA C 293 63.710 64.377 -0.667 1
1 731 . 15 1 1 A 63 63 PRO CB C 293 32.380 31.880 0.500 1
1 733 . 15 1 1 A 64 64 ASN H H 294 8.050 8.857 -0.807 1
1 734 . 15 1 1 A 64 64 ASN HA H 294 4.490 4.452 0.038 1
1 739 . 15 1 1 A 64 64 ASN CA C 294 55.630 55.377 0.253 1
1 740 . 15 1 1 A 64 64 ASN CB C 294 38.730 38.083 0.647 1
1 741 . 15 1 1 A 64 64 ASN N N 294 117.120 117.004 0.116 1
1 743 . 15 1 1 A 65 65 LEU H H 295 7.550 7.296 0.254 1
1 744 . 15 1 1 A 65 65 LEU HA H 295 4.640 4.566 0.074 1
1 754 . 15 1 1 A 65 65 LEU CA C 295 54.310 54.026 0.284 1
1 755 . 15 1 1 A 65 65 LEU CB C 295 43.640 42.812 0.828 1
1 758 . 15 1 1 A 65 65 LEU N N 295 119.930 119.608 0.322 1
1 759 . 15 1 1 A 66 66 GLY H H 296 7.850 8.514 -0.664 1
1 760 . 15 1 1 A 66 66 GLY HA2 H 296 3.810 4.104 -0.294 1
1 761 . 15 1 1 A 66 66 GLY HA3 H 296 4.110 4.104 0.006 1
1 762 . 15 1 1 A 66 66 GLY CA C 296 43.570 44.444 -0.874 1
1 763 . 15 1 1 A 66 66 GLY N N 296 108.840 109.568 -0.728 1
1 764 . 15 1 1 A 67 67 LYS H H 297 8.820 8.699 0.121 1
1 765 . 15 1 1 A 67 67 LYS HA H 297 3.980 3.914 0.066 1
1 774 . 15 1 1 A 67 67 LYS CA C 297 60.100 59.453 0.647 1
1 775 . 15 1 1 A 67 67 LYS CB C 297 32.100 32.099 0.001 1
1 779 . 15 1 1 A 67 67 LYS N N 297 120.130 120.295 -0.165 1
1 780 . 15 1 1 A 68 68 LYS H H 298 8.850 7.909 0.941 1
1 781 . 15 1 1 A 68 68 LYS HA H 298 4.060 4.121 -0.061 1
1 790 . 15 1 1 A 68 68 LYS CA C 298 60.600 58.670 1.930 1
1 791 . 15 1 1 A 68 68 LYS CB C 298 31.920 31.935 -0.015 1
1 795 . 15 1 1 A 68 68 LYS N N 298 119.580 119.636 -0.056 1
1 796 . 15 1 1 A 69 69 SER H H 299 8.100 8.005 0.095 1
1 797 . 15 1 1 A 69 69 SER HA H 299 4.370 4.085 0.285 1
1 800 . 15 1 1 A 69 69 SER CA C 299 61.980 62.197 -0.217 1
1 801 . 15 1 1 A 69 69 SER CB C 299 63.000 63.237 -0.237 1
1 802 . 15 1 1 A 69 69 SER N N 299 116.360 117.483 -1.123 1
1 803 . 15 1 1 A 70 70 LEU H H 300 8.240 8.372 -0.132 1
1 804 . 15 1 1 A 70 70 LEU HA H 300 3.970 3.955 0.015 1
1 814 . 15 1 1 A 70 70 LEU CA C 300 57.610 57.971 -0.361 1
1 815 . 15 1 1 A 70 70 LEU CB C 300 41.060 41.766 -0.706 1
1 819 . 15 1 1 A 70 70 LEU N N 300 123.330 121.135 2.195 1
1 820 . 15 1 1 A 71 71 THR H H 301 8.550 7.657 0.893 1
1 821 . 15 1 1 A 71 71 THR HA H 301 3.690 3.777 -0.087 1
1 826 . 15 1 1 A 71 71 THR CA C 301 67.170 66.729 0.441 1
1 827 . 15 1 1 A 71 71 THR CB C 301 68.810 68.613 0.197 1
1 829 . 15 1 1 A 71 71 THR N N 301 116.520 114.935 1.585 1
1 830 . 15 1 1 A 72 72 GLU H H 302 7.520 8.366 -0.846 1
1 831 . 15 1 1 A 72 72 GLU HA H 302 4.070 3.959 0.111 1
1 836 . 15 1 1 A 72 72 GLU CA C 302 59.470 59.499 -0.029 1
1 837 . 15 1 1 A 72 72 GLU CB C 302 29.090 29.278 -0.188 1
1 839 . 15 1 1 A 72 72 GLU N N 302 121.510 118.937 2.573 1
1 840 . 15 1 1 A 73 73 ILE H H 303 8.290 7.835 0.455 1
1 841 . 15 1 1 A 73 73 ILE HA H 303 3.380 3.598 -0.218 1
1 849 . 15 1 1 A 73 73 ILE CA C 303 66.010 65.330 0.680 1
1 850 . 15 1 1 A 73 73 ILE CB C 303 38.680 37.829 0.851 1
1 853 . 15 1 1 A 73 73 ILE N N 303 118.510 120.950 -2.440 1
1 854 . 15 1 1 A 74 74 LYS H H 304 8.550 8.035 0.515 1
1 855 . 15 1 1 A 74 74 LYS HA H 304 3.680 3.880 -0.200 1
1 864 . 15 1 1 A 74 74 LYS CA C 304 61.320 59.713 1.607 1
1 865 . 15 1 1 A 74 74 LYS CB C 304 32.060 32.114 -0.054 1
1 868 . 15 1 1 A 74 74 LYS N N 304 118.220 120.917 -2.697 1
1 869 . 15 1 1 A 75 75 ASP H H 305 8.450 7.815 0.635 1
1 870 . 15 1 1 A 75 75 ASP HA H 305 4.440 4.434 0.006 1
1 873 . 15 1 1 A 75 75 ASP CA C 305 57.690 57.075 0.615 1
1 874 . 15 1 1 A 75 75 ASP CB C 305 40.220 40.942 -0.722 1
1 875 . 15 1 1 A 75 75 ASP N N 305 121.790 119.648 2.142 1
1 876 . 15 1 1 A 76 76 VAL H H 306 8.680 7.855 0.825 1
1 877 . 15 1 1 A 76 76 VAL HA H 306 3.890 3.614 0.276 1
1 885 . 15 1 1 A 76 76 VAL CA C 306 66.020 66.400 -0.380 1
1 886 . 15 1 1 A 76 76 VAL CB C 306 31.250 31.398 -0.148 1
1 889 . 15 1 1 A 76 76 VAL N N 306 121.150 119.751 1.399 1
1 890 . 15 1 1 A 77 77 LEU H H 307 8.470 8.580 -0.110 1
1 891 . 15 1 1 A 77 77 LEU HA H 307 3.810 4.043 -0.233 1
1 901 . 15 1 1 A 77 77 LEU CA C 307 58.330 57.504 0.826 1
1 902 . 15 1 1 A 77 77 LEU CB C 307 41.250 41.287 -0.037 1
1 906 . 15 1 1 A 77 77 LEU N N 307 120.830 119.985 0.845 1
1 907 . 15 1 1 A 78 78 ALA H H 308 8.280 8.289 -0.009 1
1 908 . 15 1 1 A 78 78 ALA HA H 308 4.320 4.113 0.207 1
1 912 . 15 1 1 A 78 78 ALA CA C 308 55.420 54.897 0.523 1
1 913 . 15 1 1 A 78 78 ALA CB C 308 17.750 17.945 -0.195 1
1 914 . 15 1 1 A 78 78 ALA N N 308 122.530 123.463 -0.933 1
1 915 . 15 1 1 A 79 79 SER H H 309 7.900 7.983 -0.083 1
1 916 . 15 1 1 A 79 79 SER HA H 309 4.340 4.216 0.124 1
1 919 . 15 1 1 A 79 79 SER CA C 309 61.350 60.955 0.395 1
1 920 . 15 1 1 A 79 79 SER CB C 309 63.280 63.595 -0.315 1
1 921 . 15 1 1 A 79 79 SER N N 309 115.600 113.372 2.228 1
1 922 . 15 1 1 A 80 80 ARG H H 310 7.450 7.712 -0.262 1
1 923 . 15 1 1 A 80 80 ARG HA H 310 4.550 3.974 0.576 1
1 931 . 15 1 1 A 80 80 ARG CA C 310 54.200 57.856 -3.656 1
1 932 . 15 1 1 A 80 80 ARG CB C 310 30.680 27.981 2.699 1
1 935 . 15 1 1 A 80 80 ARG N N 310 119.360 118.423 0.937 1
1 936 . 15 1 1 A 81 81 GLY H H 311 7.940 8.168 -0.228 1
1 937 . 15 1 1 A 81 81 GLY HA2 H 311 3.840 3.913 -0.073 1
1 938 . 15 1 1 A 81 81 GLY HA3 H 311 4.070 3.916 0.154 1
1 939 . 15 1 1 A 81 81 GLY CA C 311 46.060 46.349 -0.289 1
1 940 . 15 1 1 A 81 81 GLY N N 311 108.130 107.306 0.824 1
1 941 . 15 1 1 A 82 82 LEU H H 312 7.920 7.656 0.264 1
1 942 . 15 1 1 A 82 82 LEU HA H 312 4.680 4.895 -0.215 1
1 952 . 15 1 1 A 82 82 LEU CA C 312 53.070 52.748 0.322 1
1 953 . 15 1 1 A 82 82 LEU CB C 312 45.790 44.984 0.806 1
1 957 . 15 1 1 A 82 82 LEU N N 312 119.290 115.564 3.726 1
1 958 . 15 1 1 A 83 83 SER H H 313 7.530 9.047 -1.517 1
1 959 . 15 1 1 A 83 83 SER HA H 313 4.450 4.363 0.087 1
1 962 . 15 1 1 A 83 83 SER CA C 313 57.190 59.279 -2.089 1
1 963 . 15 1 1 A 83 83 SER CB C 313 66.080 63.290 2.790 1
1 964 . 15 1 1 A 83 83 SER N N 313 113.120 114.042 -0.922 1
1 965 . 15 1 1 A 84 84 LEU H H 314 8.340 8.882 -0.542 1
1 966 . 15 1 1 A 84 84 LEU HA H 314 4.620 4.001 0.619 1
1 976 . 15 1 1 A 84 84 LEU CA C 314 54.720 56.153 -1.433 1
1 977 . 15 1 1 A 84 84 LEU CB C 314 41.620 40.158 1.462 1
1 981 . 15 1 1 A 84 84 LEU N N 314 115.930 122.112 -6.182 1
1 982 . 15 1 1 A 85 85 GLY H H 315 8.270 8.687 -0.417 1
1 983 . 15 1 1 A 85 85 GLY HA2 H 315 3.320 3.911 -0.591 1
1 984 . 15 1 1 A 85 85 GLY HA3 H 315 3.850 3.911 -0.061 1
1 985 . 15 1 1 A 85 85 GLY CA C 315 46.560 47.001 -0.441 1
1 986 . 15 1 1 A 85 85 GLY N N 315 111.010 104.858 6.152 1
1 987 . 15 1 1 A 86 86 MET H H 316 8.650 7.729 0.921 1
1 988 . 15 1 1 A 86 86 MET HA H 316 3.990 4.567 -0.577 1
1 996 . 15 1 1 A 86 86 MET CA C 316 56.730 55.915 0.815 1
1 997 . 15 1 1 A 86 86 MET CB C 316 33.600 33.799 -0.199 1
1 1000 . 15 1 1 A 86 86 MET N N 316 120.570 118.913 1.657 1
1 1001 . 15 1 1 A 87 87 ARG H H 317 8.360 8.496 -0.136 1
1 1002 . 15 1 1 A 87 87 ARG HA H 317 4.450 5.182 -0.732 1
1 1010 . 15 1 1 A 87 87 ARG CA C 317 55.310 54.583 0.727 1
1 1011 . 15 1 1 A 87 87 ARG CB C 317 30.490 32.667 -2.177 1
1 1014 . 15 1 1 A 87 87 ARG N N 317 122.290 119.263 3.027 1
1 1015 . 15 1 1 A 88 88 LEU H H 318 8.400 8.861 -0.461 1
1 1016 . 15 1 1 A 88 88 LEU HA H 318 4.670 4.955 -0.285 1
1 1026 . 15 1 1 A 88 88 LEU CA C 318 53.110 53.237 -0.127 1
1 1027 . 15 1 1 A 88 88 LEU CB C 318 43.600 45.122 -1.522 1
1 1031 . 15 1 1 A 88 88 LEU N N 318 126.420 125.426 0.994 1
1 1032 . 15 1 1 A 89 89 GLU H H 319 8.780 8.883 -0.103 1
1 1033 . 15 1 1 A 89 89 GLU HA H 319 4.340 4.017 0.323 1
1 1038 . 15 1 1 A 89 89 GLU CA C 319 56.490 59.665 -3.175 1
1 1039 . 15 1 1 A 89 89 GLU CB C 319 30.470 29.873 0.597 1
1 1041 . 15 1 1 A 89 89 GLU N N 319 123.070 122.633 0.437 1
1 1042 . 15 1 1 A 90 90 ASN H H 320 8.900 8.154 0.746 1
1 1043 . 15 1 1 A 90 90 ASN HA H 320 4.410 5.016 -0.606 1
1 1048 . 15 1 1 A 90 90 ASN CA C 320 54.120 54.570 -0.450 1
1 1049 . 15 1 1 A 90 90 ASN CB C 320 37.640 41.703 -4.063 1
1 1050 . 15 1 1 A 90 90 ASN N N 320 116.540 112.723 3.817 1
1 1052 . 15 1 1 A 91 91 TRP H H 321 7.990 7.464 0.526 1
1 1053 . 15 1 1 A 91 91 TRP HA H 321 4.330 4.816 -0.486 1
1 1062 . 15 1 1 A 91 91 TRP CA C 321 54.590 58.477 -3.887 1
1 1063 . 15 1 1 A 91 91 TRP CB C 321 31.280 31.106 0.174 1
1 1069 . 15 1 1 A 91 91 TRP N N 321 119.230 115.058 4.172 1
1 1071 . 15 1 1 A 92 92 PRO HA H 322 4.800 3.824 0.976 1
1 1077 . 15 1 1 A 93 93 PRO HA H 323 4.450 4.521 -0.071 1
1 1084 . 15 1 1 A 93 93 PRO CA C 323 61.970 62.640 -0.670 1
1 1085 . 15 1 1 A 93 93 PRO CB C 323 32.830 32.726 0.104 1
1 1088 . 15 1 1 A 94 94 ALA H H 324 8.460 8.862 -0.402 1
1 1089 . 15 1 1 A 94 94 ALA HA H 324 4.000 4.009 -0.009 1
1 1093 . 15 1 1 A 94 94 ALA CA C 324 53.790 54.929 -1.139 1
1 1094 . 15 1 1 A 94 94 ALA CB C 324 18.640 17.990 0.650 1
1 1095 . 15 1 1 A 94 94 ALA N N 324 124.010 126.793 -2.783 1
1 1096 . 15 1 1 A 95 95 SER H H 325 7.950 8.006 -0.056 1
1 1097 . 15 1 1 A 95 95 SER HA H 325 4.210 4.174 0.036 1
1 1100 . 15 1 1 A 95 95 SER CA C 325 58.970 62.407 -3.437 1
1 1101 . 15 1 1 A 95 95 SER CB C 325 63.040 63.328 -0.288 1
1 1102 . 15 1 1 A 95 95 SER N N 325 111.520 114.646 -3.126 1
1 1103 . 15 1 1 A 96 96 ILE H H 326 7.480 7.891 -0.411 1
1 1104 . 15 1 1 A 96 96 ILE HA H 326 4.170 2.834 1.336 1
1 1114 . 15 1 1 A 96 96 ILE CA C 326 61.300 65.284 -3.984 1
1 1115 . 15 1 1 A 96 96 ILE CB C 326 38.530 37.309 1.221 1
1 1119 . 15 1 1 A 96 96 ILE N N 326 119.650 121.708 -2.058 1
1 1120 . 15 1 1 A 97 97 ALA H H 327 7.860 8.228 -0.368 1
1 1121 . 15 1 1 A 97 97 ALA HA H 327 4.230 3.957 0.273 1
1 1125 . 15 1 1 A 97 97 ALA CA C 327 52.570 55.135 -2.565 1
1 1126 . 15 1 1 A 97 97 ALA CB C 327 19.590 18.115 1.475 1
1 1127 . 15 1 1 A 97 97 ALA N N 327 126.480 122.003 4.477 1
1 1128 . 15 1 1 A 98 98 ASP H H 328 8.250 7.818 0.432 1
1 1129 . 15 1 1 A 98 98 ASP HA H 328 4.540 4.363 0.177 1
1 1132 . 15 1 1 A 98 98 ASP CA C 328 54.150 57.527 -3.377 1
1 1133 . 15 1 1 A 98 98 ASP CB C 328 41.120 41.207 -0.087 1
1 1134 . 15 1 1 A 98 98 ASP N N 328 120.130 119.149 0.981 1
1 1150 . 15 2 2 B 6 6 ASP H H 427 8.160 7.878 0.282 1
1 1151 . 15 2 2 B 6 6 ASP HA H 427 4.630 4.271 0.359 1
1 1154 . 15 2 2 B 6 6 ASP CA C 427 54.410 56.939 -2.529 1
1 1155 . 15 2 2 B 6 6 ASP CB C 427 41.250 40.495 0.755 1
1 1156 . 15 2 2 B 6 6 ASP N N 427 120.160 121.571 -1.411 1
1 1157 . 15 2 2 B 7 7 ASN H H 428 8.350 7.972 0.378 1
1 1158 . 15 2 2 B 7 7 ASN HA H 428 4.550 4.266 0.284 1
1 1163 . 15 2 2 B 7 7 ASN CA C 428 53.310 54.519 -1.209 1
1 1164 . 15 2 2 B 7 7 ASN CB C 428 38.850 36.688 2.162 1
1 1165 . 15 2 2 B 7 7 ASN N N 428 118.440 114.735 3.705 1
1 1167 . 15 2 2 B 8 8 LYS H H 429 8.030 7.819 0.211 1
1 1172 . 15 2 2 B 8 8 LYS CB C 429 33.280 33.329 -0.049 1
1 1174 . 15 2 2 B 8 8 LYS N N 429 120.260 118.891 1.369 1
1 1175 . 15 2 2 B 9 9 PRO HA H 430 4.420 4.536 -0.116 1
1 1182 . 15 2 2 B 9 9 PRO CA C 430 62.280 62.697 -0.417 1
1 1183 . 15 2 2 B 9 9 PRO CB C 430 31.920 32.519 -0.599 1
1 1186 . 15 2 2 B 10 10 ALA H H 431 8.930 8.278 0.652 1
1 1187 . 15 2 2 B 10 10 ALA HA H 431 4.350 4.463 -0.113 1
1 1191 . 15 2 2 B 10 10 ALA CA C 431 51.070 52.477 -1.407 1
1 1192 . 15 2 2 B 10 10 ALA CB C 431 20.920 19.240 1.680 1
1 1193 . 15 2 2 B 10 10 ALA N N 431 125.000 124.805 0.195 1
1 1194 . 15 2 2 B 11 11 ASP H H 432 8.530 9.287 -0.757 1
1 1195 . 15 2 2 B 11 11 ASP HA H 432 4.220 4.271 -0.051 1
1 1198 . 15 2 2 B 11 11 ASP CA C 432 57.520 57.664 -0.144 1
1 1199 . 15 2 2 B 11 11 ASP CB C 432 40.470 40.310 0.160 1
1 1200 . 15 2 2 B 11 11 ASP N N 432 119.610 123.011 -3.401 1
1 1201 . 15 2 2 B 12 12 ASP H H 433 8.340 7.988 0.352 1
1 1202 . 15 2 2 B 12 12 ASP HA H 433 4.160 4.452 -0.292 1
1 1205 . 15 2 2 B 12 12 ASP CA C 433 56.090 57.456 -1.366 1
1 1206 . 15 2 2 B 12 12 ASP CB C 433 38.960 40.792 -1.832 1
1 1207 . 15 2 2 B 12 12 ASP N N 433 116.330 119.488 -3.158 1
1 1208 . 15 2 2 B 13 13 LEU H H 434 7.360 7.751 -0.391 1
1 1209 . 15 2 2 B 13 13 LEU HA H 434 4.050 4.104 -0.054 1
1 1219 . 15 2 2 B 13 13 LEU CA C 434 57.340 57.818 -0.478 1
1 1220 . 15 2 2 B 13 13 LEU CB C 434 42.960 41.754 1.206 1
1 1224 . 15 2 2 B 13 13 LEU N N 434 123.440 120.967 2.473 1
1 1225 . 15 2 2 B 14 14 LEU H H 435 7.670 8.277 -0.607 1
1 1226 . 15 2 2 B 14 14 LEU HA H 435 3.710 3.993 -0.283 1
1 1236 . 15 2 2 B 14 14 LEU CA C 435 57.170 57.946 -0.776 1
1 1237 . 15 2 2 B 14 14 LEU CB C 435 42.590 41.108 1.482 1
1 1241 . 15 2 2 B 14 14 LEU N N 435 115.170 119.698 -4.528 1
1 1242 . 15 2 2 B 15 15 ASN H H 436 7.490 7.764 -0.274 1
1 1243 . 15 2 2 B 15 15 ASN HA H 436 4.640 4.856 -0.216 1
1 1248 . 15 2 2 B 15 15 ASN CA C 436 52.920 53.338 -0.418 1
1 1249 . 15 2 2 B 15 15 ASN CB C 436 39.350 39.021 0.329 1
1 1250 . 15 2 2 B 15 15 ASN N N 436 112.280 114.980 -2.700 1
1 1252 . 15 2 2 B 16 16 LEU H H 437 7.300 7.226 0.074 1
1 1253 . 15 2 2 B 16 16 LEU HA H 437 4.100 4.329 -0.229 1
1 1263 . 15 2 2 B 16 16 LEU CA C 437 55.310 55.044 0.266 1
1 1264 . 15 2 2 B 16 16 LEU CB C 437 41.800 43.199 -1.399 1
1 1268 . 15 2 2 B 16 16 LEU N N 437 125.180 122.881 2.299 1
1 1269 . 15 2 2 B 17 17 GLU H H 438 8.590 8.768 -0.178 1
1 1270 . 15 2 2 B 17 17 GLU HA H 438 3.920 4.031 -0.111 1
1 1275 . 15 2 2 B 17 17 GLU CA C 438 58.440 57.982 0.458 1
1 1276 . 15 2 2 B 17 17 GLU CB C 438 29.180 29.759 -0.579 1
1 1278 . 15 2 2 B 17 17 GLU N N 438 129.850 125.968 3.882 1
1 1279 . 15 2 2 B 18 18 GLY H H 439 8.580 8.862 -0.282 1
1 1280 . 15 2 2 B 18 18 GLY HA2 H 439 3.570 3.942 -0.372 1
1 1281 . 15 2 2 B 18 18 GLY HA3 H 439 4.220 3.944 0.276 1
1 1282 . 15 2 2 B 18 18 GLY CA C 439 44.710 45.392 -0.682 1
1 1283 . 15 2 2 B 18 18 GLY N N 439 112.250 114.986 -2.736 1
1 1284 . 15 2 2 B 19 19 VAL H H 440 7.900 7.759 0.141 1
1 1285 . 15 2 2 B 19 19 VAL HA H 440 3.950 4.367 -0.417 1
1 1293 . 15 2 2 B 19 19 VAL CA C 440 62.820 61.036 1.784 1
1 1294 . 15 2 2 B 19 19 VAL CB C 440 31.470 34.425 -2.955 1
1 1297 . 15 2 2 B 19 19 VAL N N 440 121.910 121.747 0.163 1
1 1298 . 15 2 2 B 20 20 ASP H H 441 7.390 8.773 -1.383 1
1 1299 . 15 2 2 B 20 20 ASP HA H 441 4.820 4.707 0.113 1
1 1302 . 15 2 2 B 20 20 ASP CA C 441 51.920 53.662 -1.742 1
1 1303 . 15 2 2 B 20 20 ASP CB C 441 42.090 41.553 0.537 1
1 1304 . 15 2 2 B 20 20 ASP N N 441 124.850 126.698 -1.848 1
1 1305 . 15 2 2 B 21 21 ARG H H 442 8.630 8.731 -0.101 1
1 1306 . 15 2 2 B 21 21 ARG HA H 442 3.810 3.494 0.316 1
1 1313 . 15 2 2 B 21 21 ARG CA C 442 60.710 59.711 0.999 1
1 1314 . 15 2 2 B 21 21 ARG CB C 442 30.020 29.846 0.174 1
1 1317 . 15 2 2 B 21 21 ARG N N 442 120.890 122.631 -1.741 1
1 1318 . 15 2 2 B 22 22 ASP H H 443 8.140 7.948 0.192 1
1 1319 . 15 2 2 B 22 22 ASP HA H 443 4.420 4.423 -0.003 1
1 1322 . 15 2 2 B 22 22 ASP CA C 443 57.680 56.965 0.715 1
1 1323 . 15 2 2 B 22 22 ASP CB C 443 40.880 40.736 0.144 1
1 1324 . 15 2 2 B 22 22 ASP N N 443 116.750 119.753 -3.003 1
1 1325 . 15 2 2 B 23 23 LEU H H 444 8.170 7.767 0.403 1
1 1326 . 15 2 2 B 23 23 LEU HA H 444 4.130 4.093 0.037 1
1 1336 . 15 2 2 B 23 23 LEU CA C 444 57.770 57.895 -0.125 1
1 1337 . 15 2 2 B 23 23 LEU CB C 444 41.230 41.173 0.057 1
1 1341 . 15 2 2 B 23 23 LEU N N 444 122.130 121.454 0.676 1
1 1342 . 15 2 2 B 24 24 ALA H H 445 8.630 8.548 0.082 1
1 1343 . 15 2 2 B 24 24 ALA HA H 445 3.790 4.004 -0.214 1
1 1347 . 15 2 2 B 24 24 ALA CA C 445 55.810 54.326 1.484 1
1 1348 . 15 2 2 B 24 24 ALA CB C 445 18.060 18.112 -0.052 1
1 1349 . 15 2 2 B 24 24 ALA N N 445 120.890 120.659 0.231 1
1 1350 . 15 2 2 B 25 25 PHE H H 446 8.160 7.403 0.757 1
1 1351 . 15 2 2 B 25 25 PHE HA H 446 4.080 4.322 -0.242 1
1 1358 . 15 2 2 B 25 25 PHE CA C 446 62.670 61.850 0.820 1
1 1359 . 15 2 2 B 25 25 PHE CB C 446 39.440 38.605 0.835 1
1 1364 . 15 2 2 B 25 25 PHE N N 446 115.360 116.282 -0.922 1
1 1365 . 15 2 2 B 26 26 LYS H H 447 8.040 7.596 0.444 1
1 1366 . 15 2 2 B 26 26 LYS HA H 447 4.110 3.986 0.124 1
1 1375 . 15 2 2 B 26 26 LYS CA C 447 60.140 59.078 1.062 1
1 1376 . 15 2 2 B 26 26 LYS CB C 447 32.880 32.496 0.384 1
1 1380 . 15 2 2 B 26 26 LYS N N 447 123.110 118.304 4.806 1
1 1381 . 15 2 2 B 27 27 LEU H H 448 8.630 8.198 0.432 1
1 1382 . 15 2 2 B 27 27 LEU HA H 448 3.840 4.005 -0.165 1
1 1392 . 15 2 2 B 27 27 LEU CA C 448 58.210 57.744 0.466 1
1 1393 . 15 2 2 B 27 27 LEU CB C 448 39.760 41.344 -1.584 1
1 1396 . 15 2 2 B 27 27 LEU N N 448 120.890 120.145 0.745 1
1 1397 . 15 2 2 B 28 28 ALA H H 449 8.200 8.305 -0.105 1
1 1398 . 15 2 2 B 28 28 ALA HA H 449 3.760 4.527 -0.767 1
1 1402 . 15 2 2 B 28 28 ALA CA C 449 54.750 55.276 -0.526 1
1 1403 . 15 2 2 B 28 28 ALA CB C 449 18.050 18.355 -0.305 1
1 1404 . 15 2 2 B 28 28 ALA N N 449 123.710 121.692 2.018 1
1 1405 . 15 2 2 B 29 29 ALA H H 450 7.780 7.683 0.097 1
1 1406 . 15 2 2 B 29 29 ALA HA H 450 4.170 4.040 0.130 1
1 1410 . 15 2 2 B 29 29 ALA CA C 450 54.430 55.261 -0.831 1
1 1411 . 15 2 2 B 29 29 ALA CB C 450 18.040 18.661 -0.621 1
1 1412 . 15 2 2 B 29 29 ALA N N 450 121.020 119.406 1.614 1
1 1413 . 15 2 2 B 30 30 ARG H H 451 7.390 7.448 -0.058 1
1 1414 . 15 2 2 B 30 30 ARG HA H 451 4.540 4.407 0.133 1
1 1421 . 15 2 2 B 30 30 ARG CA C 451 54.510 55.736 -1.226 1
1 1422 . 15 2 2 B 30 30 ARG CB C 451 29.950 29.668 0.282 1
1 1425 . 15 2 2 B 30 30 ARG N N 451 115.480 115.889 -0.409 1
1 1426 . 15 2 2 B 31 31 GLY H H 452 7.950 8.906 -0.956 1
1 1427 . 15 2 2 B 31 31 GLY HA2 H 452 3.550 4.000 -0.450 1
1 1428 . 15 2 2 B 31 31 GLY HA3 H 452 4.200 4.002 0.198 1
1 1429 . 15 2 2 B 31 31 GLY CA C 452 45.380 45.378 0.002 1
1 1430 . 15 2 2 B 31 31 GLY N N 452 107.740 107.501 0.239 1
1 1431 . 15 2 2 B 32 32 VAL H H 453 7.990 7.601 0.389 1
1 1432 . 15 2 2 B 32 32 VAL HA H 453 3.930 4.039 -0.109 1
1 1440 . 15 2 2 B 32 32 VAL CA C 453 61.420 63.020 -1.600 1
1 1441 . 15 2 2 B 32 32 VAL CB C 453 29.860 31.255 -1.395 1
1 1444 . 15 2 2 B 32 32 VAL N N 453 125.560 121.250 4.310 1
1 1445 . 15 2 2 B 33 33 CYS H H 454 8.460 8.243 0.217 1
1 1446 . 15 2 2 B 33 33 CYS HA H 454 4.310 4.753 -0.443 1
1 1449 . 15 2 2 B 33 33 CYS CA C 454 60.260 59.710 0.550 1
1 1450 . 15 2 2 B 33 33 CYS CB C 454 30.330 30.447 -0.117 1
1 1451 . 15 2 2 B 33 33 CYS N N 454 119.460 126.491 -7.031 1
1 1452 . 15 2 2 B 34 34 THR H H 455 8.080 7.369 0.711 1
1 1453 . 15 2 2 B 34 34 THR HA H 455 4.840 4.346 0.494 1
1 1458 . 15 2 2 B 34 34 THR CA C 455 58.650 63.037 -4.387 1
1 1459 . 15 2 2 B 34 34 THR CB C 455 72.680 69.463 3.217 1
1 1461 . 15 2 2 B 34 34 THR N N 455 108.420 114.789 -6.369 1
1 1462 . 15 2 2 B 35 35 LEU H H 456 8.580 8.751 -0.171 1
1 1463 . 15 2 2 B 35 35 LEU HA H 456 3.790 3.991 -0.201 1
1 1473 . 15 2 2 B 35 35 LEU CA C 456 57.980 58.731 -0.751 1
1 1474 . 15 2 2 B 35 35 LEU CB C 456 42.220 41.535 0.685 1
1 1477 . 15 2 2 B 35 35 LEU N N 456 120.370 127.923 -7.553 1
1 1478 . 15 2 2 B 36 36 GLU H H 457 8.390 8.339 0.051 1
1 1479 . 15 2 2 B 36 36 GLU HA H 457 3.820 3.852 -0.032 1
1 1484 . 15 2 2 B 36 36 GLU CA C 457 59.640 60.098 -0.458 1
1 1485 . 15 2 2 B 36 36 GLU CB C 457 28.780 29.278 -0.498 1
1 1487 . 15 2 2 B 36 36 GLU N N 457 119.450 118.771 0.679 1
1 1488 . 15 2 2 B 37 37 ASP H H 458 7.750 8.005 -0.255 1
1 1489 . 15 2 2 B 37 37 ASP HA H 458 4.140 4.392 -0.252 1
1 1492 . 15 2 2 B 37 37 ASP CA C 458 57.150 57.324 -0.174 1
1 1493 . 15 2 2 B 37 37 ASP CB C 458 42.280 40.449 1.831 1
1 1494 . 15 2 2 B 37 37 ASP N N 458 117.430 120.401 -2.971 1
1 1495 . 15 2 2 B 38 38 LEU H H 459 7.700 7.819 -0.119 1
1 1496 . 15 2 2 B 38 38 LEU HA H 459 3.790 4.133 -0.343 1
1 1506 . 15 2 2 B 38 38 LEU CA C 459 58.080 58.028 0.052 1
1 1507 . 15 2 2 B 38 38 LEU CB C 459 41.130 41.240 -0.110 1
1 1511 . 15 2 2 B 38 38 LEU N N 459 121.280 121.645 -0.365 1
1 1512 . 15 2 2 B 39 39 ALA H H 460 8.190 8.335 -0.145 1
1 1513 . 15 2 2 B 39 39 ALA HA H 460 3.640 4.001 -0.361 1
1 1517 . 15 2 2 B 39 39 ALA CA C 460 54.320 55.365 -1.045 1
1 1518 . 15 2 2 B 39 39 ALA CB C 460 17.140 18.116 -0.976 1
1 1519 . 15 2 2 B 39 39 ALA N N 460 119.400 120.490 -1.090 1
1 1520 . 15 2 2 B 40 40 GLU H H 461 7.340 7.998 -0.658 1
1 1521 . 15 2 2 B 40 40 GLU HA H 461 4.180 4.090 0.090 1
1 1526 . 15 2 2 B 40 40 GLU CA C 461 57.800 58.844 -1.044 1
1 1527 . 15 2 2 B 40 40 GLU CB C 461 30.600 29.256 1.344 1
1 1529 . 15 2 2 B 40 40 GLU N N 461 110.680 117.316 -6.636 1
1 1530 . 15 2 2 B 41 41 GLN H H 462 7.940 7.686 0.254 1
1 1531 . 15 2 2 B 41 41 GLN HA H 462 4.100 4.466 -0.366 1
1 1538 . 15 2 2 B 41 41 GLN CA C 462 55.310 56.032 -0.722 1
1 1539 . 15 2 2 B 41 41 GLN CB C 462 28.780 29.395 -0.615 1
1 1541 . 15 2 2 B 41 41 GLN N N 462 120.720 119.104 1.616 1
1 1543 . 15 2 2 B 42 42 GLY H H 463 9.000 8.369 0.631 1
1 1544 . 15 2 2 B 42 42 GLY HA2 H 463 3.310 4.180 -0.870 1
1 1545 . 15 2 2 B 42 42 GLY HA3 H 463 4.820 4.182 0.638 1
1 1546 . 15 2 2 B 42 42 GLY CA C 463 42.650 44.390 -1.740 1
1 1547 . 15 2 2 B 42 42 GLY N N 463 104.110 109.707 -5.597 1
1 1548 . 15 2 2 B 43 43 ILE H H 464 7.900 8.725 -0.825 1
1 1549 . 15 2 2 B 43 43 ILE HA H 464 3.260 3.713 -0.453 1
1 1558 . 15 2 2 B 43 43 ILE CA C 464 66.570 64.328 2.242 1
1 1559 . 15 2 2 B 43 43 ILE CB C 464 38.770 37.514 1.256 1
1 1562 . 15 2 2 B 43 43 ILE N N 464 119.410 119.721 -0.311 1
1 1563 . 15 2 2 B 44 44 ASP H H 465 8.730 8.085 0.645 1
1 1564 . 15 2 2 B 44 44 ASP HA H 465 4.310 4.384 -0.074 1
1 1567 . 15 2 2 B 44 44 ASP CA C 465 56.740 57.312 -0.572 1
1 1568 . 15 2 2 B 44 44 ASP CB C 465 40.120 40.002 0.118 1
1 1569 . 15 2 2 B 44 44 ASP N N 465 116.610 121.952 -5.342 1
1 1570 . 15 2 2 B 45 45 ASP H H 466 7.720 8.099 -0.379 1
1 1571 . 15 2 2 B 45 45 ASP HA H 466 4.480 4.460 0.020 1
1 1574 . 15 2 2 B 45 45 ASP CA C 466 57.000 57.454 -0.454 1
1 1575 . 15 2 2 B 45 45 ASP CB C 466 42.270 40.421 1.849 1
1 1576 . 15 2 2 B 45 45 ASP N N 466 117.560 119.388 -1.828 1
1 1577 . 15 2 2 B 46 46 LEU H H 467 7.370 7.750 -0.380 1
1 1578 . 15 2 2 B 46 46 LEU HA H 467 4.410 4.157 0.253 1
1 1587 . 15 2 2 B 46 46 LEU CA C 467 53.660 57.108 -3.448 1
1 1588 . 15 2 2 B 46 46 LEU CB C 467 42.260 41.531 0.729 1
1 1591 . 15 2 2 B 46 46 LEU N N 467 116.890 120.373 -3.483 1
1 1592 . 15 2 2 B 47 47 ALA H H 468 7.080 8.122 -1.042 1
1 1593 . 15 2 2 B 47 47 ALA HA H 468 4.120 4.091 0.029 1
1 1597 . 15 2 2 B 47 47 ALA CA C 468 54.130 54.811 -0.681 1
1 1598 . 15 2 2 B 47 47 ALA CB C 468 19.480 18.530 0.950 1
1 1599 . 15 2 2 B 47 47 ALA N N 468 120.150 122.548 -2.398 1
1 1600 . 15 2 2 B 48 48 ASP H H 469 8.560 7.725 0.835 1
1 1601 . 15 2 2 B 48 48 ASP HA H 469 4.410 4.452 -0.042 1
1 1604 . 15 2 2 B 48 48 ASP CA C 469 54.330 57.495 -3.165 1
1 1605 . 15 2 2 B 48 48 ASP CB C 469 39.760 40.718 -0.958 1
1 1606 . 15 2 2 B 48 48 ASP N N 469 114.660 116.795 -2.135 1
1 1607 . 15 2 2 B 49 49 ILE H H 470 7.870 7.710 0.160 1
1 1608 . 15 2 2 B 49 49 ILE HA H 470 3.850 4.354 -0.504 1
1 1618 . 15 2 2 B 49 49 ILE CA C 470 61.680 60.647 1.033 1
1 1619 . 15 2 2 B 49 49 ILE CB C 470 37.120 38.658 -1.538 1
1 1623 . 15 2 2 B 49 49 ILE N N 470 121.600 119.764 1.836 1
1 1624 . 15 2 2 B 50 50 GLU H H 471 8.680 9.178 -0.498 1
1 1625 . 15 2 2 B 50 50 GLU HA H 471 3.940 3.961 -0.021 1
1 1630 . 15 2 2 B 50 50 GLU CA C 471 58.360 59.872 -1.512 1
1 1631 . 15 2 2 B 50 50 GLU CB C 471 29.530 29.380 0.150 1
1 1633 . 15 2 2 B 50 50 GLU N N 471 131.000 128.448 2.552 1
1 1634 . 15 2 2 B 51 51 GLY H H 472 8.860 8.272 0.588 1
1 1635 . 15 2 2 B 51 51 GLY HA2 H 472 3.640 3.999 -0.359 1
1 1636 . 15 2 2 B 51 51 GLY HA3 H 472 4.230 4.001 0.229 1
1 1637 . 15 2 2 B 51 51 GLY CA C 472 45.190 47.072 -1.882 1
1 1638 . 15 2 2 B 51 51 GLY N N 472 113.580 107.399 6.181 1
1 1639 . 15 2 2 B 52 52 LEU H H 473 7.850 7.709 0.141 1
1 1640 . 15 2 2 B 52 52 LEU HA H 473 4.680 4.605 0.075 1
1 1650 . 15 2 2 B 52 52 LEU CA C 473 53.640 53.791 -0.151 1
1 1651 . 15 2 2 B 52 52 LEU CB C 473 42.990 43.373 -0.383 1
1 1655 . 15 2 2 B 52 52 LEU N N 473 123.020 120.199 2.821 1
1 1656 . 15 2 2 B 53 53 THR H H 474 7.550 8.802 -1.252 1
1 1657 . 15 2 2 B 53 53 THR HA H 474 4.560 4.816 -0.256 1
1 1662 . 15 2 2 B 53 53 THR CA C 474 60.060 60.853 -0.793 1
1 1663 . 15 2 2 B 53 53 THR CB C 474 71.520 71.314 0.206 1
1 1665 . 15 2 2 B 53 53 THR N N 474 115.070 119.072 -4.002 1
1 1666 . 15 2 2 B 54 54 ASP H H 475 8.900 9.005 -0.105 1
1 1667 . 15 2 2 B 54 54 ASP HA H 475 4.220 4.268 -0.048 1
1 1670 . 15 2 2 B 54 54 ASP CA C 475 57.520 58.021 -0.501 1
1 1671 . 15 2 2 B 54 54 ASP CB C 475 39.560 40.255 -0.695 1
1 1672 . 15 2 2 B 54 54 ASP N N 475 121.800 123.824 -2.024 1
1 1673 . 15 2 2 B 55 55 GLU H H 476 8.460 8.075 0.385 1
1 1674 . 15 2 2 B 55 55 GLU HA H 476 3.970 4.035 -0.065 1
1 1679 . 15 2 2 B 55 55 GLU CA C 476 59.440 59.148 0.292 1
1 1680 . 15 2 2 B 55 55 GLU CB C 476 29.650 29.478 0.172 1
1 1682 . 15 2 2 B 55 55 GLU N N 476 119.460 119.424 0.036 1
1 1683 . 15 2 2 B 56 56 LYS H H 477 7.790 8.054 -0.264 1
1 1684 . 15 2 2 B 56 56 LYS HA H 477 4.120 4.067 0.053 1
1 1693 . 15 2 2 B 56 56 LYS CA C 477 58.890 59.257 -0.367 1
1 1694 . 15 2 2 B 56 56 LYS CB C 477 32.600 32.185 0.415 1
1 1698 . 15 2 2 B 56 56 LYS N N 477 121.840 119.754 2.086 1
1 1699 . 15 2 2 B 57 57 ALA H H 478 8.900 8.891 0.009 1
1 1700 . 15 2 2 B 57 57 ALA HA H 478 3.790 4.051 -0.261 1
1 1704 . 15 2 2 B 57 57 ALA CA C 478 55.810 55.416 0.394 1
1 1705 . 15 2 2 B 57 57 ALA CB C 478 18.590 18.269 0.321 1
1 1706 . 15 2 2 B 57 57 ALA N N 478 121.350 121.654 -0.304 1
1 1707 . 15 2 2 B 58 58 GLY H H 479 8.300 8.169 0.131 1
1 1708 . 15 2 2 B 58 58 GLY HA2 H 479 3.500 3.768 -0.268 1
1 1709 . 15 2 2 B 58 58 GLY HA3 H 479 3.890 3.770 0.120 1
1 1710 . 15 2 2 B 58 58 GLY CA C 479 47.360 47.308 0.052 1
1 1711 . 15 2 2 B 58 58 GLY N N 479 102.040 108.718 -6.678 1
1 1712 . 15 2 2 B 59 59 ALA H H 480 7.580 8.011 -0.431 1
1 1713 . 15 2 2 B 59 59 ALA HA H 480 4.110 4.055 0.055 1
1 1717 . 15 2 2 B 59 59 ALA CA C 480 55.580 54.497 1.083 1
1 1718 . 15 2 2 B 59 59 ALA CB C 480 18.130 18.711 -0.581 1
1 1719 . 15 2 2 B 59 59 ALA N N 480 123.180 125.012 -1.832 1
1 1720 . 15 2 2 B 60 60 LEU H H 481 8.290 8.026 0.264 1
1 1721 . 15 2 2 B 60 60 LEU HA H 481 4.020 3.970 0.050 1
1 1731 . 15 2 2 B 60 60 LEU CA C 481 57.850 57.857 -0.007 1
1 1732 . 15 2 2 B 60 60 LEU CB C 481 42.360 41.999 0.361 1
1 1736 . 15 2 2 B 60 60 LEU N N 481 120.560 118.428 2.132 1
1 1737 . 15 2 2 B 61 61 ILE H H 482 8.080 8.227 -0.147 1
1 1738 . 15 2 2 B 61 61 ILE HA H 482 3.210 3.477 -0.267 1
1 1748 . 15 2 2 B 61 61 ILE CA C 482 66.250 65.178 1.072 1
1 1749 . 15 2 2 B 61 61 ILE CB C 482 39.400 37.962 1.438 1
1 1753 . 15 2 2 B 61 61 ILE N N 482 119.170 119.679 -0.509 1
1 1754 . 15 2 2 B 62 62 MET H H 483 8.110 8.259 -0.149 1
1 1755 . 15 2 2 B 62 62 MET HA H 483 4.410 4.050 0.360 1
1 1763 . 15 2 2 B 62 62 MET CA C 483 56.110 58.659 -2.549 1
1 1764 . 15 2 2 B 62 62 MET CB C 483 28.260 32.388 -4.128 1
1 1767 . 15 2 2 B 62 62 MET N N 483 114.420 117.945 -3.525 1
1 1768 . 15 2 2 B 63 63 ALA H H 484 8.240 7.804 0.436 1
1 1769 . 15 2 2 B 63 63 ALA HA H 484 4.130 4.102 0.028 1
1 1773 . 15 2 2 B 63 63 ALA CA C 484 55.300 54.969 0.331 1
1 1774 . 15 2 2 B 63 63 ALA CB C 484 18.280 18.326 -0.046 1
1 1775 . 15 2 2 B 63 63 ALA N N 484 123.710 121.393 2.317 1
1 1776 . 15 2 2 B 64 64 ALA H H 485 8.050 8.461 -0.411 1
1 1777 . 15 2 2 B 64 64 ALA HA H 485 3.870 4.063 -0.193 1
1 1781 . 15 2 2 B 64 64 ALA CA C 485 55.330 55.405 -0.075 1
1 1782 . 15 2 2 B 64 64 ALA CB C 485 17.660 18.353 -0.693 1
1 1783 . 15 2 2 B 64 64 ALA N N 485 120.070 119.856 0.214 1
1 1784 . 15 2 2 B 65 65 ARG H H 486 8.640 9.009 -0.369 1
1 1785 . 15 2 2 B 65 65 ARG HA H 486 2.800 4.203 -1.403 1
1 1792 . 15 2 2 B 65 65 ARG CA C 486 60.600 59.634 0.966 1
1 1793 . 15 2 2 B 65 65 ARG CB C 486 29.910 29.862 0.048 1
1 1796 . 15 2 2 B 65 65 ARG N N 486 118.730 118.822 -0.092 1
1 1797 . 15 2 2 B 66 66 ASN H H 487 8.710 8.089 0.621 1
1 1798 . 15 2 2 B 66 66 ASN HA H 487 4.550 4.826 -0.276 1
1 1803 . 15 2 2 B 66 66 ASN CA C 487 56.390 56.442 -0.052 1
1 1804 . 15 2 2 B 66 66 ASN CB C 487 37.970 38.534 -0.564 1
1 1805 . 15 2 2 B 66 66 ASN N N 487 119.170 117.839 1.331 1
1 1807 . 15 2 2 B 67 67 ILE H H 488 7.250 7.809 -0.559 1
1 1808 . 15 2 2 B 67 67 ILE HA H 488 3.810 3.871 -0.061 1
1 1818 . 15 2 2 B 67 67 ILE CA C 488 64.350 65.106 -0.756 1
1 1819 . 15 2 2 B 67 67 ILE CB C 488 39.570 37.802 1.768 1
1 1823 . 15 2 2 B 67 67 ILE N N 488 117.890 119.718 -1.828 1
1 1824 . 15 2 2 B 68 68 CYS H H 489 8.350 8.517 -0.167 1
1 1825 . 15 2 2 B 68 68 CYS HA H 489 4.080 4.206 -0.126 1
1 1828 . 15 2 2 B 68 68 CYS CA C 489 62.670 63.660 -0.990 1
1 1829 . 15 2 2 B 68 68 CYS CB C 489 28.170 28.245 -0.075 1
1 1830 . 15 2 2 B 68 68 CYS N N 489 115.230 118.954 -3.724 1
1 1831 . 15 2 2 B 69 69 TRP H H 490 8.230 9.368 -1.138 1
1 1832 . 15 2 2 B 69 69 TRP HA H 490 5.100 4.242 0.858 1
1 1841 . 15 2 2 B 69 69 TRP CA C 490 55.420 60.389 -4.969 1
1 1842 . 15 2 2 B 69 69 TRP CB C 490 31.010 29.443 1.567 1
1 1844 . 15 2 2 B 69 69 TRP N N 490 116.850 120.836 -3.986 1
1 1846 . 15 2 2 B 70 70 PHE H H 491 7.570 8.497 -0.927 1
1 1847 . 15 2 2 B 70 70 PHE HA H 491 5.240 4.554 0.686 1
1 1852 . 15 2 2 B 70 70 PHE CA C 491 55.490 58.805 -3.315 1
1 1853 . 15 2 2 B 70 70 PHE CB C 491 38.700 39.412 -0.712 1
1 1856 . 15 2 2 B 70 70 PHE N N 491 117.460 117.353 0.107 1
1 1857 . 15 2 2 B 71 71 GLY H H 492 8.420 8.295 0.125 1
1 1858 . 15 2 2 B 71 71 GLY HA2 H 492 3.920 3.970 -0.050 1
1 1859 . 15 2 2 B 71 71 GLY HA3 H 492 4.080 3.981 0.099 1
1 1860 . 15 2 2 B 71 71 GLY CA C 492 46.210 47.314 -1.104 1
1 1861 . 15 2 2 B 71 71 GLY N N 492 110.040 107.559 2.481 1
1 1862 . 15 2 2 B 72 72 ASP H H 493 8.370 8.639 -0.269 1
1 1863 . 15 2 2 B 72 72 ASP HA H 493 4.630 5.065 -0.435 1
1 1866 . 15 2 2 B 72 72 ASP CA C 493 54.410 52.976 1.434 1
1 1867 . 15 2 2 B 72 72 ASP CB C 493 41.250 40.956 0.294 1
1 1868 . 15 2 2 B 72 72 ASP N N 493 120.000 125.176 -5.176 1
1 1869 . 15 2 2 B 73 73 GLU H H 494 8.230 8.553 -0.323 1
1 1870 . 15 2 2 B 73 73 GLU HA H 494 4.260 4.278 -0.018 1
1 1875 . 15 2 2 B 73 73 GLU CA C 494 56.510 57.684 -1.174 1
1 1876 . 15 2 2 B 73 73 GLU CB C 494 30.420 30.233 0.187 1
1 1878 . 15 2 2 B 73 73 GLU N N 494 120.900 123.958 -3.058 1
1 216 . 16 1 1 A 20 20 ASP H H 250 8.550 8.388 0.162 1
1 217 . 16 1 1 A 20 20 ASP HA H 250 4.700 4.608 0.092 1
1 220 . 16 1 1 A 20 20 ASP CA C 250 52.650 51.980 0.670 1
1 221 . 16 1 1 A 20 20 ASP CB C 250 41.420 42.090 -0.670 1
1 222 . 16 1 1 A 20 20 ASP N N 250 125.190 124.348 0.842 1
1 223 . 16 1 1 A 21 21 PRO HA H 251 4.250 4.478 -0.228 1
1 230 . 16 1 1 A 21 21 PRO CA C 251 65.120 64.852 0.268 1
1 231 . 16 1 1 A 21 21 PRO CB C 251 32.310 32.156 0.154 1
1 234 . 16 1 1 A 22 22 ILE H H 252 8.630 7.851 0.779 1
1 235 . 16 1 1 A 22 22 ILE HA H 252 4.060 4.038 0.022 1
1 245 . 16 1 1 A 22 22 ILE CA C 252 62.990 62.801 0.189 1
1 246 . 16 1 1 A 22 22 ILE CB C 252 37.520 37.593 -0.073 1
1 250 . 16 1 1 A 22 22 ILE N N 252 119.860 117.154 2.706 1
1 251 . 16 1 1 A 23 23 LEU H H 253 7.950 7.857 0.093 1
1 252 . 16 1 1 A 23 23 LEU HA H 253 3.710 4.224 -0.514 1
1 262 . 16 1 1 A 23 23 LEU CA C 253 56.510 57.978 -1.468 1
1 263 . 16 1 1 A 23 23 LEU CB C 253 41.190 41.856 -0.666 1
1 266 . 16 1 1 A 23 23 LEU N N 253 116.850 121.388 -4.538 1
1 267 . 16 1 1 A 24 24 LEU H H 254 7.370 7.690 -0.320 1
1 268 . 16 1 1 A 24 24 LEU HA H 254 4.310 4.562 -0.252 1
1 278 . 16 1 1 A 24 24 LEU CA C 254 54.890 57.563 -2.673 1
1 279 . 16 1 1 A 24 24 LEU CB C 254 41.960 42.108 -0.148 1
1 283 . 16 1 1 A 24 24 LEU N N 254 115.210 119.617 -4.407 1
1 284 . 16 1 1 A 25 25 ARG H H 255 7.520 7.549 -0.029 1
1 285 . 16 1 1 A 25 25 ARG HA H 255 4.660 4.508 0.152 1
1 293 . 16 1 1 A 25 25 ARG CA C 255 52.840 54.095 -1.255 1
1 294 . 16 1 1 A 25 25 ARG CB C 255 28.130 30.335 -2.205 1
1 297 . 16 1 1 A 25 25 ARG N N 255 118.180 119.445 -1.265 1
1 298 . 16 1 1 A 26 26 PRO HA H 256 4.800 4.741 0.059 1
1 305 . 16 1 1 A 26 26 PRO CA C 256 61.790 62.661 -0.871 1
1 306 . 16 1 1 A 26 26 PRO CB C 256 32.660 32.386 0.274 1
1 309 . 16 1 1 A 27 27 VAL H H 257 8.170 8.558 -0.388 1
1 310 . 16 1 1 A 27 27 VAL HA H 257 3.590 3.754 -0.164 1
1 318 . 16 1 1 A 27 27 VAL CA C 257 64.830 65.747 -0.917 1
1 319 . 16 1 1 A 27 27 VAL CB C 257 31.720 31.641 0.079 1
1 322 . 16 1 1 A 27 27 VAL N N 257 115.710 123.648 -7.938 1
1 323 . 16 1 1 A 28 28 ASP H H 258 8.240 8.054 0.186 1
1 324 . 16 1 1 A 28 28 ASP HA H 258 4.340 4.374 -0.034 1
1 327 . 16 1 1 A 28 28 ASP CA C 258 56.490 57.517 -1.027 1
1 328 . 16 1 1 A 28 28 ASP CB C 258 40.520 40.248 0.272 1
1 329 . 16 1 1 A 28 28 ASP N N 258 119.000 122.806 -3.806 1
1 330 . 16 1 1 A 29 29 ASP H H 259 8.000 8.594 -0.594 1
1 331 . 16 1 1 A 29 29 ASP HA H 259 4.390 4.618 -0.228 1
1 334 . 16 1 1 A 29 29 ASP CA C 259 56.210 55.398 0.812 1
1 335 . 16 1 1 A 29 29 ASP CB C 259 40.670 41.222 -0.552 1
1 336 . 16 1 1 A 29 29 ASP N N 259 118.900 117.521 1.379 1
1 337 . 16 1 1 A 30 30 LEU H H 260 7.760 7.647 0.113 1
1 338 . 16 1 1 A 30 30 LEU HA H 260 3.990 4.264 -0.274 1
1 348 . 16 1 1 A 30 30 LEU CA C 260 55.000 55.269 -0.269 1
1 349 . 16 1 1 A 30 30 LEU CB C 260 41.670 42.300 -0.630 1
1 353 . 16 1 1 A 30 30 LEU N N 260 116.300 121.216 -4.916 1
1 354 . 16 1 1 A 31 31 GLU H H 261 7.990 8.826 -0.836 1
1 355 . 16 1 1 A 31 31 GLU HA H 261 4.280 4.049 0.231 1
1 358 . 16 1 1 A 31 31 GLU CA C 261 56.860 59.468 -2.608 1
1 359 . 16 1 1 A 31 31 GLU CB C 261 27.010 29.437 -2.427 1
1 360 . 16 1 1 A 31 31 GLU N N 261 115.620 121.679 -6.059 1
1 361 . 16 1 1 A 32 32 LEU H H 262 8.000 7.382 0.618 1
1 362 . 16 1 1 A 32 32 LEU HA H 262 4.400 4.263 0.137 1
1 372 . 16 1 1 A 32 32 LEU CA C 262 53.860 55.031 -1.171 1
1 373 . 16 1 1 A 32 32 LEU CB C 262 44.450 42.254 2.196 1
1 377 . 16 1 1 A 32 32 LEU N N 262 118.860 122.418 -3.558 1
1 378 . 16 1 1 A 33 33 THR H H 263 10.020 8.670 1.350 1
1 379 . 16 1 1 A 33 33 THR HA H 263 4.130 4.698 -0.568 1
1 384 . 16 1 1 A 33 33 THR CA C 263 62.400 60.594 1.806 1
1 385 . 16 1 1 A 33 33 THR CB C 263 71.270 71.260 0.010 1
1 387 . 16 1 1 A 33 33 THR N N 263 114.610 114.043 0.567 1
1 388 . 16 1 1 A 34 34 VAL H H 264 8.370 8.848 -0.478 1
1 389 . 16 1 1 A 34 34 VAL HA H 264 3.620 3.662 -0.042 1
1 397 . 16 1 1 A 34 34 VAL CA C 264 66.340 67.084 -0.744 1
1 398 . 16 1 1 A 34 34 VAL CB C 264 31.670 31.611 0.059 1
1 401 . 16 1 1 A 34 34 VAL N N 264 122.110 122.500 -0.390 1
1 402 . 16 1 1 A 35 35 ARG H H 265 8.190 8.197 -0.007 1
1 403 . 16 1 1 A 35 35 ARG HA H 265 4.070 3.935 0.135 1
1 411 . 16 1 1 A 35 35 ARG CA C 265 59.470 59.680 -0.210 1
1 412 . 16 1 1 A 35 35 ARG CB C 265 29.790 30.087 -0.297 1
1 415 . 16 1 1 A 35 35 ARG N N 265 117.340 120.651 -3.311 1
1 416 . 16 1 1 A 36 36 SER H H 266 7.610 7.978 -0.368 1
1 417 . 16 1 1 A 36 36 SER HA H 266 4.080 4.092 -0.012 1
1 420 . 16 1 1 A 36 36 SER CA C 266 63.080 62.154 0.926 1
1 421 . 16 1 1 A 36 36 SER CB C 266 63.280 63.092 0.188 1
1 422 . 16 1 1 A 36 36 SER N N 266 116.710 117.115 -0.405 1
1 423 . 16 1 1 A 37 37 ALA H H 267 8.720 8.215 0.505 1
1 424 . 16 1 1 A 37 37 ALA HA H 267 3.760 4.046 -0.286 1
1 428 . 16 1 1 A 37 37 ALA CA C 267 55.900 55.211 0.689 1
1 429 . 16 1 1 A 37 37 ALA CB C 267 18.090 18.127 -0.037 1
1 430 . 16 1 1 A 37 37 ALA N N 267 124.170 123.458 0.712 1
1 431 . 16 1 1 A 38 38 ASN H H 268 8.850 9.466 -0.616 1
1 432 . 16 1 1 A 38 38 ASN HA H 268 4.420 4.492 -0.072 1
1 437 . 16 1 1 A 38 38 ASN CA C 268 55.700 56.161 -0.461 1
1 438 . 16 1 1 A 38 38 ASN CB C 268 37.180 37.778 -0.598 1
1 439 . 16 1 1 A 38 38 ASN N N 268 117.370 117.338 0.032 1
1 441 . 16 1 1 A 39 39 CYS H H 269 7.970 7.796 0.174 1
1 442 . 16 1 1 A 39 39 CYS HA H 269 4.190 4.086 0.104 1
1 445 . 16 1 1 A 39 39 CYS CA C 269 63.340 62.964 0.376 1
1 446 . 16 1 1 A 39 39 CYS CB C 269 26.870 27.180 -0.310 1
1 447 . 16 1 1 A 39 39 CYS N N 269 120.510 119.091 1.419 1
1 448 . 16 1 1 A 40 40 LEU H H 270 7.600 7.699 -0.099 1
1 449 . 16 1 1 A 40 40 LEU HA H 270 3.880 3.903 -0.023 1
1 458 . 16 1 1 A 40 40 LEU CA C 270 57.810 57.905 -0.095 1
1 459 . 16 1 1 A 40 40 LEU CB C 270 40.030 41.201 -1.171 1
1 462 . 16 1 1 A 40 40 LEU N N 270 117.710 120.579 -2.869 1
1 463 . 16 1 1 A 41 41 LYS H H 271 7.980 8.359 -0.379 1
1 464 . 16 1 1 A 41 41 LYS HA H 271 3.820 4.200 -0.380 1
1 472 . 16 1 1 A 41 41 LYS CA C 271 59.840 59.148 0.692 1
1 473 . 16 1 1 A 41 41 LYS CB C 271 32.070 32.006 0.064 1
1 476 . 16 1 1 A 41 41 LYS N N 271 120.070 120.570 -0.500 1
1 477 . 16 1 1 A 42 42 ALA H H 272 7.860 8.941 -1.081 1
1 478 . 16 1 1 A 42 42 ALA HA H 272 4.140 4.086 0.054 1
1 482 . 16 1 1 A 42 42 ALA CA C 272 54.670 54.462 0.208 1
1 483 . 16 1 1 A 42 42 ALA CB C 272 17.950 18.498 -0.548 1
1 484 . 16 1 1 A 42 42 ALA N N 272 122.880 121.173 1.707 1
1 485 . 16 1 1 A 43 43 GLU H H 273 7.210 8.300 -1.090 1
1 486 . 16 1 1 A 43 43 GLU HA H 273 4.260 4.467 -0.207 1
1 491 . 16 1 1 A 43 43 GLU CA C 273 55.020 55.408 -0.388 1
1 492 . 16 1 1 A 43 43 GLU CB C 273 29.880 29.728 0.152 1
1 494 . 16 1 1 A 43 43 GLU N N 273 116.590 117.668 -1.078 1
1 495 . 16 1 1 A 44 44 ALA H H 274 7.880 8.348 -0.468 1
1 496 . 16 1 1 A 44 44 ALA HA H 274 3.680 3.842 -0.162 1
1 500 . 16 1 1 A 44 44 ALA CA C 274 52.960 53.094 -0.134 1
1 501 . 16 1 1 A 44 44 ALA CB C 274 16.110 17.257 -1.147 1
1 502 . 16 1 1 A 44 44 ALA N N 274 118.420 119.788 -1.368 1
1 503 . 16 1 1 A 45 45 ILE H H 275 7.600 7.387 0.213 1
1 504 . 16 1 1 A 45 45 ILE HA H 275 3.870 4.231 -0.361 1
1 514 . 16 1 1 A 45 45 ILE CA C 275 61.150 60.332 0.818 1
1 515 . 16 1 1 A 45 45 ILE CB C 275 37.090 39.107 -2.017 1
1 519 . 16 1 1 A 45 45 ILE N N 275 120.370 118.140 2.230 1
1 520 . 16 1 1 A 46 46 HIS H H 276 8.350 8.861 -0.511 1
1 521 . 16 1 1 A 46 46 HIS HA H 276 4.600 4.821 -0.221 1
1 526 . 16 1 1 A 46 46 HIS CA C 276 56.900 57.022 -0.122 1
1 527 . 16 1 1 A 46 46 HIS CB C 276 31.910 31.250 0.660 1
1 529 . 16 1 1 A 46 46 HIS N N 276 123.250 125.866 -2.616 1
1 530 . 16 1 1 A 47 47 TYR H H 277 8.850 7.993 0.857 1
1 531 . 16 1 1 A 47 47 TYR HA H 277 5.100 4.828 0.272 1
1 538 . 16 1 1 A 47 47 TYR CA C 277 57.430 56.498 0.932 1
1 539 . 16 1 1 A 47 47 TYR CB C 277 40.680 40.524 0.156 1
1 544 . 16 1 1 A 47 47 TYR N N 277 119.700 117.789 1.911 1
1 545 . 16 1 1 A 48 48 ILE H H 278 9.380 8.487 0.893 1
1 546 . 16 1 1 A 48 48 ILE HA H 278 3.340 3.656 -0.316 1
1 554 . 16 1 1 A 48 48 ILE CA C 278 67.640 65.012 2.628 1
1 555 . 16 1 1 A 48 48 ILE CB C 278 36.310 37.447 -1.137 1
1 558 . 16 1 1 A 48 48 ILE N N 278 125.650 125.054 0.596 1
1 559 . 16 1 1 A 49 49 GLY H H 279 9.430 7.847 1.583 1
1 560 . 16 1 1 A 49 49 GLY HA2 H 279 2.370 2.438 -0.068 1
1 561 . 16 1 1 A 49 49 GLY HA3 H 279 3.230 3.648 -0.418 1
1 562 . 16 1 1 A 49 49 GLY CA C 279 46.820 46.833 -0.013 1
1 563 . 16 1 1 A 49 49 GLY N N 279 105.200 108.326 -3.126 1
1 564 . 16 1 1 A 50 50 ASP H H 280 7.050 7.260 -0.210 1
1 565 . 16 1 1 A 50 50 ASP HA H 280 4.360 4.088 0.272 1
1 568 . 16 1 1 A 50 50 ASP CA C 280 57.110 56.083 1.027 1
1 569 . 16 1 1 A 50 50 ASP CB C 280 42.620 40.524 2.096 1
1 570 . 16 1 1 A 50 50 ASP N N 280 116.360 121.239 -4.879 1
1 571 . 16 1 1 A 51 51 LEU H H 281 7.170 7.849 -0.679 1
1 572 . 16 1 1 A 51 51 LEU HA H 281 3.880 3.952 -0.072 1
1 582 . 16 1 1 A 51 51 LEU CA C 281 57.900 58.234 -0.334 1
1 583 . 16 1 1 A 51 51 LEU CB C 281 41.870 41.585 0.285 1
1 587 . 16 1 1 A 51 51 LEU N N 281 120.130 121.794 -1.664 1
1 588 . 16 1 1 A 52 52 VAL H H 282 7.820 7.570 0.250 1
1 589 . 16 1 1 A 52 52 VAL HA H 282 3.980 3.903 0.077 1
1 597 . 16 1 1 A 52 52 VAL CA C 282 64.000 65.288 -1.288 1
1 598 . 16 1 1 A 52 52 VAL CB C 282 30.400 31.215 -0.815 1
1 601 . 16 1 1 A 52 52 VAL N N 282 105.550 114.740 -9.190 1
1 602 . 16 1 1 A 53 53 GLN H H 283 6.550 7.715 -1.165 1
1 603 . 16 1 1 A 53 53 GLN HA H 283 4.680 4.076 0.604 1
1 610 . 16 1 1 A 53 53 GLN CA C 283 56.210 58.362 -2.152 1
1 611 . 16 1 1 A 53 53 GLN CB C 283 31.710 28.803 2.907 1
1 613 . 16 1 1 A 53 53 GLN N N 283 114.060 120.905 -6.845 1
1 615 . 16 1 1 A 54 54 ARG H H 284 7.690 7.503 0.187 1
1 616 . 16 1 1 A 54 54 ARG HA H 284 4.520 4.827 -0.307 1
1 624 . 16 1 1 A 54 54 ARG CA C 284 54.600 54.271 0.329 1
1 625 . 16 1 1 A 54 54 ARG CB C 284 30.750 33.169 -2.419 1
1 628 . 16 1 1 A 54 54 ARG N N 284 119.810 118.063 1.747 1
1 629 . 16 1 1 A 55 55 THR H H 285 8.110 8.599 -0.489 1
1 630 . 16 1 1 A 55 55 THR HA H 285 4.430 4.281 0.149 1
1 635 . 16 1 1 A 55 55 THR CA C 285 59.640 64.126 -4.486 1
1 636 . 16 1 1 A 55 55 THR CB C 285 71.310 69.289 2.021 1
1 638 . 16 1 1 A 55 55 THR N N 285 108.450 119.206 -10.756 1
1 639 . 16 1 1 A 56 56 GLU H H 286 8.910 8.872 0.038 1
1 640 . 16 1 1 A 56 56 GLU HA H 286 3.660 3.939 -0.279 1
1 645 . 16 1 1 A 56 56 GLU CA C 286 60.650 59.680 0.970 1
1 646 . 16 1 1 A 56 56 GLU CB C 286 29.400 29.142 0.258 1
1 648 . 16 1 1 A 56 56 GLU N N 286 120.600 126.293 -5.693 1
1 649 . 16 1 1 A 57 57 VAL H H 287 7.600 8.051 -0.451 1
1 650 . 16 1 1 A 57 57 VAL HA H 287 3.620 3.520 0.100 1
1 658 . 16 1 1 A 57 57 VAL CA C 287 66.020 67.133 -1.113 1
1 659 . 16 1 1 A 57 57 VAL CB C 287 31.720 31.570 0.150 1
1 662 . 16 1 1 A 57 57 VAL N N 287 114.050 119.936 -5.886 1
1 663 . 16 1 1 A 58 58 GLU H H 288 7.350 8.530 -1.180 1
1 664 . 16 1 1 A 58 58 GLU HA H 288 3.830 4.061 -0.231 1
1 669 . 16 1 1 A 58 58 GLU CA C 288 59.250 59.506 -0.256 1
1 670 . 16 1 1 A 58 58 GLU CB C 288 30.030 29.003 1.027 1
1 672 . 16 1 1 A 58 58 GLU N N 288 117.610 119.197 -1.587 1
1 673 . 16 1 1 A 59 59 LEU H H 289 7.850 7.924 -0.074 1
1 674 . 16 1 1 A 59 59 LEU HA H 289 4.150 4.385 -0.235 1
1 683 . 16 1 1 A 59 59 LEU CA C 289 57.340 57.364 -0.024 1
1 684 . 16 1 1 A 59 59 LEU CB C 289 41.170 41.181 -0.011 1
1 687 . 16 1 1 A 59 59 LEU N N 289 120.050 120.584 -0.534 1
1 688 . 16 1 1 A 60 60 LEU H H 290 7.670 8.495 -0.825 1
1 689 . 16 1 1 A 60 60 LEU HA H 290 4.540 4.007 0.533 1
1 696 . 16 1 1 A 60 60 LEU CA C 290 55.090 58.054 -2.964 1
1 697 . 16 1 1 A 60 60 LEU CB C 290 42.320 41.241 1.079 1
1 701 . 16 1 1 A 60 60 LEU N N 290 114.980 119.799 -4.819 1
1 702 . 16 1 1 A 61 61 LYS H H 291 7.440 7.231 0.209 1
1 703 . 16 1 1 A 61 61 LYS HA H 291 4.280 4.306 -0.026 1
1 710 . 16 1 1 A 61 61 LYS CA C 291 56.860 56.483 0.377 1
1 711 . 16 1 1 A 61 61 LYS CB C 291 31.900 32.638 -0.738 1
1 714 . 16 1 1 A 61 61 LYS N N 291 118.120 116.972 1.148 1
1 715 . 16 1 1 A 62 62 THR H H 292 7.310 7.671 -0.361 1
1 716 . 16 1 1 A 62 62 THR HA H 292 5.220 4.656 0.564 1
1 721 . 16 1 1 A 62 62 THR CA C 292 55.830 59.138 -3.308 1
1 722 . 16 1 1 A 62 62 THR CB C 292 69.970 70.685 -0.715 1
1 724 . 16 1 1 A 62 62 THR N N 292 111.890 114.749 -2.859 1
1 725 . 16 1 1 A 63 63 PRO HA H 293 4.570 4.524 0.046 1
1 730 . 16 1 1 A 63 63 PRO CA C 293 63.710 64.367 -0.657 1
1 731 . 16 1 1 A 63 63 PRO CB C 293 32.380 31.900 0.480 1
1 733 . 16 1 1 A 64 64 ASN H H 294 8.050 8.941 -0.891 1
1 734 . 16 1 1 A 64 64 ASN HA H 294 4.490 4.479 0.011 1
1 739 . 16 1 1 A 64 64 ASN CA C 294 55.630 55.252 0.378 1
1 740 . 16 1 1 A 64 64 ASN CB C 294 38.730 38.035 0.695 1
1 741 . 16 1 1 A 64 64 ASN N N 294 117.120 116.900 0.220 1
1 743 . 16 1 1 A 65 65 LEU H H 295 7.550 7.205 0.345 1
1 744 . 16 1 1 A 65 65 LEU HA H 295 4.640 4.300 0.340 1
1 754 . 16 1 1 A 65 65 LEU CA C 295 54.310 54.405 -0.095 1
1 755 . 16 1 1 A 65 65 LEU CB C 295 43.640 42.202 1.438 1
1 758 . 16 1 1 A 65 65 LEU N N 295 119.930 120.547 -0.617 1
1 759 . 16 1 1 A 66 66 GLY H H 296 7.850 8.616 -0.766 1
1 760 . 16 1 1 A 66 66 GLY HA2 H 296 3.810 4.138 -0.328 1
1 761 . 16 1 1 A 66 66 GLY HA3 H 296 4.110 4.138 -0.028 1
1 762 . 16 1 1 A 66 66 GLY CA C 296 43.570 44.580 -1.010 1
1 763 . 16 1 1 A 66 66 GLY N N 296 108.840 110.273 -1.433 1
1 764 . 16 1 1 A 67 67 LYS H H 297 8.820 8.615 0.205 1
1 765 . 16 1 1 A 67 67 LYS HA H 297 3.980 3.884 0.096 1
1 774 . 16 1 1 A 67 67 LYS CA C 297 60.100 59.554 0.546 1
1 775 . 16 1 1 A 67 67 LYS CB C 297 32.100 32.179 -0.079 1
1 779 . 16 1 1 A 67 67 LYS N N 297 120.130 121.576 -1.446 1
1 780 . 16 1 1 A 68 68 LYS H H 298 8.850 7.958 0.892 1
1 781 . 16 1 1 A 68 68 LYS HA H 298 4.060 4.053 0.007 1
1 790 . 16 1 1 A 68 68 LYS CA C 298 60.600 59.122 1.478 1
1 791 . 16 1 1 A 68 68 LYS CB C 298 31.920 32.323 -0.403 1
1 795 . 16 1 1 A 68 68 LYS N N 298 119.580 119.936 -0.356 1
1 796 . 16 1 1 A 69 69 SER H H 299 8.100 8.058 0.042 1
1 797 . 16 1 1 A 69 69 SER HA H 299 4.370 4.090 0.280 1
1 800 . 16 1 1 A 69 69 SER CA C 299 61.980 62.629 -0.649 1
1 801 . 16 1 1 A 69 69 SER CB C 299 63.000 62.687 0.313 1
1 802 . 16 1 1 A 69 69 SER N N 299 116.360 116.688 -0.328 1
1 803 . 16 1 1 A 70 70 LEU H H 300 8.240 8.223 0.017 1
1 804 . 16 1 1 A 70 70 LEU HA H 300 3.970 4.052 -0.082 1
1 814 . 16 1 1 A 70 70 LEU CA C 300 57.610 57.883 -0.273 1
1 815 . 16 1 1 A 70 70 LEU CB C 300 41.060 41.588 -0.528 1
1 819 . 16 1 1 A 70 70 LEU N N 300 123.330 122.865 0.465 1
1 820 . 16 1 1 A 71 71 THR H H 301 8.550 7.614 0.936 1
1 821 . 16 1 1 A 71 71 THR HA H 301 3.690 3.831 -0.141 1
1 826 . 16 1 1 A 71 71 THR CA C 301 67.170 66.939 0.231 1
1 827 . 16 1 1 A 71 71 THR CB C 301 68.810 68.527 0.283 1
1 829 . 16 1 1 A 71 71 THR N N 301 116.520 114.861 1.659 1
1 830 . 16 1 1 A 72 72 GLU H H 302 7.520 7.845 -0.325 1
1 831 . 16 1 1 A 72 72 GLU HA H 302 4.070 3.974 0.096 1
1 836 . 16 1 1 A 72 72 GLU CA C 302 59.470 59.363 0.107 1
1 837 . 16 1 1 A 72 72 GLU CB C 302 29.090 29.517 -0.427 1
1 839 . 16 1 1 A 72 72 GLU N N 302 121.510 120.980 0.530 1
1 840 . 16 1 1 A 73 73 ILE H H 303 8.290 8.448 -0.158 1
1 841 . 16 1 1 A 73 73 ILE HA H 303 3.380 3.594 -0.214 1
1 849 . 16 1 1 A 73 73 ILE CA C 303 66.010 65.471 0.539 1
1 850 . 16 1 1 A 73 73 ILE CB C 303 38.680 37.836 0.844 1
1 853 . 16 1 1 A 73 73 ILE N N 303 118.510 120.154 -1.644 1
1 854 . 16 1 1 A 74 74 LYS H H 304 8.550 8.337 0.213 1
1 855 . 16 1 1 A 74 74 LYS HA H 304 3.680 3.843 -0.163 1
1 864 . 16 1 1 A 74 74 LYS CA C 304 61.320 59.979 1.341 1
1 865 . 16 1 1 A 74 74 LYS CB C 304 32.060 32.199 -0.139 1
1 868 . 16 1 1 A 74 74 LYS N N 304 118.220 120.921 -2.701 1
1 869 . 16 1 1 A 75 75 ASP H H 305 8.450 7.834 0.616 1
1 870 . 16 1 1 A 75 75 ASP HA H 305 4.440 4.390 0.050 1
1 873 . 16 1 1 A 75 75 ASP CA C 305 57.690 57.501 0.189 1
1 874 . 16 1 1 A 75 75 ASP CB C 305 40.220 41.386 -1.166 1
1 875 . 16 1 1 A 75 75 ASP N N 305 121.790 119.569 2.221 1
1 876 . 16 1 1 A 76 76 VAL H H 306 8.680 7.726 0.954 1
1 877 . 16 1 1 A 76 76 VAL HA H 306 3.890 3.648 0.242 1
1 885 . 16 1 1 A 76 76 VAL CA C 306 66.020 66.164 -0.144 1
1 886 . 16 1 1 A 76 76 VAL CB C 306 31.250 31.453 -0.203 1
1 889 . 16 1 1 A 76 76 VAL N N 306 121.150 119.407 1.743 1
1 890 . 16 1 1 A 77 77 LEU H H 307 8.470 8.492 -0.022 1
1 891 . 16 1 1 A 77 77 LEU HA H 307 3.810 4.115 -0.305 1
1 901 . 16 1 1 A 77 77 LEU CA C 307 58.330 57.199 1.131 1
1 902 . 16 1 1 A 77 77 LEU CB C 307 41.250 40.879 0.371 1
1 906 . 16 1 1 A 77 77 LEU N N 307 120.830 119.902 0.928 1
1 907 . 16 1 1 A 78 78 ALA H H 308 8.280 8.373 -0.093 1
1 908 . 16 1 1 A 78 78 ALA HA H 308 4.320 4.113 0.207 1
1 912 . 16 1 1 A 78 78 ALA CA C 308 55.420 54.695 0.725 1
1 913 . 16 1 1 A 78 78 ALA CB C 308 17.750 17.530 0.220 1
1 914 . 16 1 1 A 78 78 ALA N N 308 122.530 123.592 -1.062 1
1 915 . 16 1 1 A 79 79 SER H H 309 7.900 7.618 0.282 1
1 916 . 16 1 1 A 79 79 SER HA H 309 4.340 4.351 -0.011 1
1 919 . 16 1 1 A 79 79 SER CA C 309 61.350 60.121 1.229 1
1 920 . 16 1 1 A 79 79 SER CB C 309 63.280 63.640 -0.360 1
1 921 . 16 1 1 A 79 79 SER N N 309 115.600 113.534 2.066 1
1 922 . 16 1 1 A 80 80 ARG H H 310 7.450 8.060 -0.610 1
1 923 . 16 1 1 A 80 80 ARG HA H 310 4.550 4.016 0.534 1
1 931 . 16 1 1 A 80 80 ARG CA C 310 54.200 57.407 -3.207 1
1 932 . 16 1 1 A 80 80 ARG CB C 310 30.680 27.200 3.480 1
1 935 . 16 1 1 A 80 80 ARG N N 310 119.360 117.831 1.529 1
1 936 . 16 1 1 A 81 81 GLY H H 311 7.940 8.166 -0.226 1
1 937 . 16 1 1 A 81 81 GLY HA2 H 311 3.840 3.957 -0.117 1
1 938 . 16 1 1 A 81 81 GLY HA3 H 311 4.070 3.958 0.112 1
1 939 . 16 1 1 A 81 81 GLY CA C 311 46.060 45.913 0.147 1
1 940 . 16 1 1 A 81 81 GLY N N 311 108.130 106.764 1.366 1
1 941 . 16 1 1 A 82 82 LEU H H 312 7.920 7.561 0.359 1
1 942 . 16 1 1 A 82 82 LEU HA H 312 4.680 4.840 -0.160 1
1 952 . 16 1 1 A 82 82 LEU CA C 312 53.070 52.721 0.349 1
1 953 . 16 1 1 A 82 82 LEU CB C 312 45.790 45.363 0.427 1
1 957 . 16 1 1 A 82 82 LEU N N 312 119.290 116.617 2.673 1
1 958 . 16 1 1 A 83 83 SER H H 313 7.530 8.980 -1.450 1
1 959 . 16 1 1 A 83 83 SER HA H 313 4.450 4.185 0.265 1
1 962 . 16 1 1 A 83 83 SER CA C 313 57.190 59.066 -1.876 1
1 963 . 16 1 1 A 83 83 SER CB C 313 66.080 62.445 3.635 1
1 964 . 16 1 1 A 83 83 SER N N 313 113.120 115.432 -2.312 1
1 965 . 16 1 1 A 84 84 LEU H H 314 8.340 8.348 -0.008 1
1 966 . 16 1 1 A 84 84 LEU HA H 314 4.620 4.397 0.223 1
1 976 . 16 1 1 A 84 84 LEU CA C 314 54.720 54.806 -0.086 1
1 977 . 16 1 1 A 84 84 LEU CB C 314 41.620 42.224 -0.604 1
1 981 . 16 1 1 A 84 84 LEU N N 314 115.930 120.133 -4.203 1
1 982 . 16 1 1 A 85 85 GLY H H 315 8.270 7.886 0.384 1
1 983 . 16 1 1 A 85 85 GLY HA2 H 315 3.320 3.927 -0.607 1
1 984 . 16 1 1 A 85 85 GLY HA3 H 315 3.850 3.928 -0.078 1
1 985 . 16 1 1 A 85 85 GLY CA C 315 46.560 46.791 -0.231 1
1 986 . 16 1 1 A 85 85 GLY N N 315 111.010 108.303 2.707 1
1 987 . 16 1 1 A 86 86 MET H H 316 8.650 8.154 0.496 1
1 988 . 16 1 1 A 86 86 MET HA H 316 3.990 4.783 -0.793 1
1 996 . 16 1 1 A 86 86 MET CA C 316 56.730 55.563 1.167 1
1 997 . 16 1 1 A 86 86 MET CB C 316 33.600 34.729 -1.129 1
1 1000 . 16 1 1 A 86 86 MET N N 316 120.570 118.922 1.648 1
1 1001 . 16 1 1 A 87 87 ARG H H 317 8.360 8.474 -0.114 1
1 1002 . 16 1 1 A 87 87 ARG HA H 317 4.450 5.191 -0.741 1
1 1010 . 16 1 1 A 87 87 ARG CA C 317 55.310 54.503 0.807 1
1 1011 . 16 1 1 A 87 87 ARG CB C 317 30.490 33.348 -2.858 1
1 1014 . 16 1 1 A 87 87 ARG N N 317 122.290 119.486 2.804 1
1 1015 . 16 1 1 A 88 88 LEU H H 318 8.400 8.744 -0.344 1
1 1016 . 16 1 1 A 88 88 LEU HA H 318 4.670 4.999 -0.329 1
1 1026 . 16 1 1 A 88 88 LEU CA C 318 53.110 53.051 0.059 1
1 1027 . 16 1 1 A 88 88 LEU CB C 318 43.600 45.415 -1.815 1
1 1031 . 16 1 1 A 88 88 LEU N N 318 126.420 125.265 1.155 1
1 1032 . 16 1 1 A 89 89 GLU H H 319 8.780 9.030 -0.250 1
1 1033 . 16 1 1 A 89 89 GLU HA H 319 4.340 4.009 0.331 1
1 1038 . 16 1 1 A 89 89 GLU CA C 319 56.490 59.367 -2.877 1
1 1039 . 16 1 1 A 89 89 GLU CB C 319 30.470 29.453 1.017 1
1 1041 . 16 1 1 A 89 89 GLU N N 319 123.070 122.783 0.287 1
1 1042 . 16 1 1 A 90 90 ASN H H 320 8.900 8.594 0.306 1
1 1043 . 16 1 1 A 90 90 ASN HA H 320 4.410 5.140 -0.730 1
1 1048 . 16 1 1 A 90 90 ASN CA C 320 54.120 55.116 -0.996 1
1 1049 . 16 1 1 A 90 90 ASN CB C 320 37.640 40.845 -3.205 1
1 1050 . 16 1 1 A 90 90 ASN N N 320 116.540 116.486 0.054 1
1 1052 . 16 1 1 A 91 91 TRP H H 321 7.990 7.389 0.601 1
1 1053 . 16 1 1 A 91 91 TRP HA H 321 4.330 4.749 -0.419 1
1 1062 . 16 1 1 A 91 91 TRP CA C 321 54.590 58.330 -3.740 1
1 1063 . 16 1 1 A 91 91 TRP CB C 321 31.280 31.203 0.077 1
1 1069 . 16 1 1 A 91 91 TRP N N 321 119.230 118.120 1.110 1
1 1071 . 16 1 1 A 92 92 PRO HA H 322 4.800 3.939 0.861 1
1 1077 . 16 1 1 A 93 93 PRO HA H 323 4.450 4.548 -0.098 1
1 1084 . 16 1 1 A 93 93 PRO CA C 323 61.970 62.420 -0.450 1
1 1085 . 16 1 1 A 93 93 PRO CB C 323 32.830 32.739 0.091 1
1 1088 . 16 1 1 A 94 94 ALA H H 324 8.460 8.730 -0.270 1
1 1089 . 16 1 1 A 94 94 ALA HA H 324 4.000 3.975 0.025 1
1 1093 . 16 1 1 A 94 94 ALA CA C 324 53.790 55.039 -1.249 1
1 1094 . 16 1 1 A 94 94 ALA CB C 324 18.640 17.930 0.710 1
1 1095 . 16 1 1 A 94 94 ALA N N 324 124.010 126.067 -2.057 1
1 1096 . 16 1 1 A 95 95 SER H H 325 7.950 7.947 0.003 1
1 1097 . 16 1 1 A 95 95 SER HA H 325 4.210 4.011 0.199 1
1 1100 . 16 1 1 A 95 95 SER CA C 325 58.970 62.443 -3.473 1
1 1101 . 16 1 1 A 95 95 SER CB C 325 63.040 62.855 0.185 1
1 1102 . 16 1 1 A 95 95 SER N N 325 111.520 114.366 -2.846 1
1 1103 . 16 1 1 A 96 96 ILE H H 326 7.480 7.333 0.147 1
1 1104 . 16 1 1 A 96 96 ILE HA H 326 4.170 3.368 0.802 1
1 1114 . 16 1 1 A 96 96 ILE CA C 326 61.300 65.179 -3.879 1
1 1115 . 16 1 1 A 96 96 ILE CB C 326 38.530 37.266 1.264 1
1 1119 . 16 1 1 A 96 96 ILE N N 326 119.650 119.656 -0.006 1
1 1120 . 16 1 1 A 97 97 ALA H H 327 7.860 6.917 0.943 1
1 1121 . 16 1 1 A 97 97 ALA HA H 327 4.230 4.068 0.162 1
1 1125 . 16 1 1 A 97 97 ALA CA C 327 52.570 52.314 0.256 1
1 1126 . 16 1 1 A 97 97 ALA CB C 327 19.590 19.440 0.150 1
1 1127 . 16 1 1 A 97 97 ALA N N 327 126.480 123.400 3.080 1
1 1128 . 16 1 1 A 98 98 ASP H H 328 8.250 8.781 -0.531 1
1 1129 . 16 1 1 A 98 98 ASP HA H 328 4.540 4.207 0.333 1
1 1132 . 16 1 1 A 98 98 ASP CA C 328 54.150 57.365 -3.215 1
1 1133 . 16 1 1 A 98 98 ASP CB C 328 41.120 40.571 0.549 1
1 1134 . 16 1 1 A 98 98 ASP N N 328 120.130 123.342 -3.212 1
1 1150 . 16 2 2 B 6 6 ASP H H 427 8.160 9.132 -0.972 1
1 1151 . 16 2 2 B 6 6 ASP HA H 427 4.630 4.241 0.389 1
1 1154 . 16 2 2 B 6 6 ASP CA C 427 54.410 57.007 -2.597 1
1 1155 . 16 2 2 B 6 6 ASP CB C 427 41.250 40.725 0.525 1
1 1156 . 16 2 2 B 6 6 ASP N N 427 120.160 123.021 -2.861 1
1 1157 . 16 2 2 B 7 7 ASN H H 428 8.350 7.957 0.393 1
1 1158 . 16 2 2 B 7 7 ASN HA H 428 4.550 4.259 0.291 1
1 1163 . 16 2 2 B 7 7 ASN CA C 428 53.310 54.504 -1.194 1
1 1164 . 16 2 2 B 7 7 ASN CB C 428 38.850 36.724 2.126 1
1 1165 . 16 2 2 B 7 7 ASN N N 428 118.440 114.759 3.681 1
1 1167 . 16 2 2 B 8 8 LYS H H 429 8.030 7.784 0.246 1
1 1172 . 16 2 2 B 8 8 LYS CB C 429 33.280 32.721 0.559 1
1 1174 . 16 2 2 B 8 8 LYS N N 429 120.260 119.117 1.143 1
1 1175 . 16 2 2 B 9 9 PRO HA H 430 4.420 4.582 -0.162 1
1 1182 . 16 2 2 B 9 9 PRO CA C 430 62.280 62.688 -0.408 1
1 1183 . 16 2 2 B 9 9 PRO CB C 430 31.920 32.507 -0.587 1
1 1186 . 16 2 2 B 10 10 ALA H H 431 8.930 9.110 -0.180 1
1 1187 . 16 2 2 B 10 10 ALA HA H 431 4.350 4.505 -0.155 1
1 1191 . 16 2 2 B 10 10 ALA CA C 431 51.070 51.724 -0.654 1
1 1192 . 16 2 2 B 10 10 ALA CB C 431 20.920 20.003 0.917 1
1 1193 . 16 2 2 B 10 10 ALA N N 431 125.000 124.768 0.232 1
1 1194 . 16 2 2 B 11 11 ASP H H 432 8.530 9.001 -0.471 1
1 1195 . 16 2 2 B 11 11 ASP HA H 432 4.220 4.275 -0.055 1
1 1198 . 16 2 2 B 11 11 ASP CA C 432 57.520 57.754 -0.234 1
1 1199 . 16 2 2 B 11 11 ASP CB C 432 40.470 40.374 0.096 1
1 1200 . 16 2 2 B 11 11 ASP N N 432 119.610 119.553 0.057 1
1 1201 . 16 2 2 B 12 12 ASP H H 433 8.340 8.036 0.304 1
1 1202 . 16 2 2 B 12 12 ASP HA H 433 4.160 4.410 -0.250 1
1 1205 . 16 2 2 B 12 12 ASP CA C 433 56.090 57.350 -1.260 1
1 1206 . 16 2 2 B 12 12 ASP CB C 433 38.960 40.948 -1.988 1
1 1207 . 16 2 2 B 12 12 ASP N N 433 116.330 119.428 -3.098 1
1 1208 . 16 2 2 B 13 13 LEU H H 434 7.360 7.919 -0.559 1
1 1209 . 16 2 2 B 13 13 LEU HA H 434 4.050 4.115 -0.065 1
1 1219 . 16 2 2 B 13 13 LEU CA C 434 57.340 57.857 -0.517 1
1 1220 . 16 2 2 B 13 13 LEU CB C 434 42.960 41.538 1.422 1
1 1224 . 16 2 2 B 13 13 LEU N N 434 123.440 121.341 2.099 1
1 1225 . 16 2 2 B 14 14 LEU H H 435 7.670 8.210 -0.540 1
1 1226 . 16 2 2 B 14 14 LEU HA H 435 3.710 4.033 -0.323 1
1 1236 . 16 2 2 B 14 14 LEU CA C 435 57.170 57.771 -0.601 1
1 1237 . 16 2 2 B 14 14 LEU CB C 435 42.590 41.460 1.130 1
1 1241 . 16 2 2 B 14 14 LEU N N 435 115.170 119.687 -4.517 1
1 1242 . 16 2 2 B 15 15 ASN H H 436 7.490 8.356 -0.866 1
1 1243 . 16 2 2 B 15 15 ASN HA H 436 4.640 4.816 -0.176 1
1 1248 . 16 2 2 B 15 15 ASN CA C 436 52.920 53.578 -0.658 1
1 1249 . 16 2 2 B 15 15 ASN CB C 436 39.350 38.919 0.431 1
1 1250 . 16 2 2 B 15 15 ASN N N 436 112.280 115.184 -2.904 1
1 1252 . 16 2 2 B 16 16 LEU H H 437 7.300 7.098 0.202 1
1 1253 . 16 2 2 B 16 16 LEU HA H 437 4.100 4.246 -0.146 1
1 1263 . 16 2 2 B 16 16 LEU CA C 437 55.310 55.219 0.091 1
1 1264 . 16 2 2 B 16 16 LEU CB C 437 41.800 42.934 -1.134 1
1 1268 . 16 2 2 B 16 16 LEU N N 437 125.180 122.874 2.306 1
1 1269 . 16 2 2 B 17 17 GLU H H 438 8.590 8.731 -0.141 1
1 1270 . 16 2 2 B 17 17 GLU HA H 438 3.920 3.966 -0.046 1
1 1275 . 16 2 2 B 17 17 GLU CA C 438 58.440 58.172 0.268 1
1 1276 . 16 2 2 B 17 17 GLU CB C 438 29.180 29.585 -0.405 1
1 1278 . 16 2 2 B 17 17 GLU N N 438 129.850 125.851 3.999 1
1 1279 . 16 2 2 B 18 18 GLY H H 439 8.580 8.941 -0.361 1
1 1280 . 16 2 2 B 18 18 GLY HA2 H 439 3.570 3.956 -0.386 1
1 1281 . 16 2 2 B 18 18 GLY HA3 H 439 4.220 3.959 0.261 1
1 1282 . 16 2 2 B 18 18 GLY CA C 439 44.710 45.452 -0.742 1
1 1283 . 16 2 2 B 18 18 GLY N N 439 112.250 114.691 -2.441 1
1 1284 . 16 2 2 B 19 19 VAL H H 440 7.900 7.330 0.570 1
1 1285 . 16 2 2 B 19 19 VAL HA H 440 3.950 4.501 -0.551 1
1 1293 . 16 2 2 B 19 19 VAL CA C 440 62.820 60.985 1.835 1
1 1294 . 16 2 2 B 19 19 VAL CB C 440 31.470 34.905 -3.435 1
1 1297 . 16 2 2 B 19 19 VAL N N 440 121.910 121.374 0.536 1
1 1298 . 16 2 2 B 20 20 ASP H H 441 7.390 8.335 -0.945 1
1 1299 . 16 2 2 B 20 20 ASP HA H 441 4.820 4.910 -0.090 1
1 1302 . 16 2 2 B 20 20 ASP CA C 441 51.920 51.681 0.239 1
1 1303 . 16 2 2 B 20 20 ASP CB C 441 42.090 42.034 0.056 1
1 1304 . 16 2 2 B 20 20 ASP N N 441 124.850 126.421 -1.571 1
1 1305 . 16 2 2 B 21 21 ARG H H 442 8.630 8.317 0.313 1
1 1306 . 16 2 2 B 21 21 ARG HA H 442 3.810 3.363 0.447 1
1 1313 . 16 2 2 B 21 21 ARG CA C 442 60.710 59.820 0.890 1
1 1314 . 16 2 2 B 21 21 ARG CB C 442 30.020 29.952 0.068 1
1 1317 . 16 2 2 B 21 21 ARG N N 442 120.890 117.923 2.967 1
1 1318 . 16 2 2 B 22 22 ASP H H 443 8.140 7.890 0.250 1
1 1319 . 16 2 2 B 22 22 ASP HA H 443 4.420 4.305 0.115 1
1 1322 . 16 2 2 B 22 22 ASP CA C 443 57.680 56.845 0.835 1
1 1323 . 16 2 2 B 22 22 ASP CB C 443 40.880 40.648 0.232 1
1 1324 . 16 2 2 B 22 22 ASP N N 443 116.750 119.582 -2.832 1
1 1325 . 16 2 2 B 23 23 LEU H H 444 8.170 8.741 -0.571 1
1 1326 . 16 2 2 B 23 23 LEU HA H 444 4.130 4.042 0.088 1
1 1336 . 16 2 2 B 23 23 LEU CA C 444 57.770 57.900 -0.130 1
1 1337 . 16 2 2 B 23 23 LEU CB C 444 41.230 41.092 0.138 1
1 1341 . 16 2 2 B 23 23 LEU N N 444 122.130 121.326 0.804 1
1 1342 . 16 2 2 B 24 24 ALA H H 445 8.630 8.377 0.253 1
1 1343 . 16 2 2 B 24 24 ALA HA H 445 3.790 4.022 -0.232 1
1 1347 . 16 2 2 B 24 24 ALA CA C 445 55.810 54.459 1.351 1
1 1348 . 16 2 2 B 24 24 ALA CB C 445 18.060 17.974 0.086 1
1 1349 . 16 2 2 B 24 24 ALA N N 445 120.890 120.769 0.121 1
1 1350 . 16 2 2 B 25 25 PHE H H 446 8.160 7.354 0.806 1
1 1351 . 16 2 2 B 25 25 PHE HA H 446 4.080 4.309 -0.229 1
1 1358 . 16 2 2 B 25 25 PHE CA C 446 62.670 61.872 0.798 1
1 1359 . 16 2 2 B 25 25 PHE CB C 446 39.440 38.566 0.874 1
1 1364 . 16 2 2 B 25 25 PHE N N 446 115.360 116.053 -0.693 1
1 1365 . 16 2 2 B 26 26 LYS H H 447 8.040 7.823 0.217 1
1 1366 . 16 2 2 B 26 26 LYS HA H 447 4.110 4.000 0.110 1
1 1375 . 16 2 2 B 26 26 LYS CA C 447 60.140 59.212 0.928 1
1 1376 . 16 2 2 B 26 26 LYS CB C 447 32.880 32.311 0.569 1
1 1380 . 16 2 2 B 26 26 LYS N N 447 123.110 118.632 4.478 1
1 1381 . 16 2 2 B 27 27 LEU H H 448 8.630 8.098 0.532 1
1 1382 . 16 2 2 B 27 27 LEU HA H 448 3.840 4.095 -0.255 1
1 1392 . 16 2 2 B 27 27 LEU CA C 448 58.210 57.856 0.354 1
1 1393 . 16 2 2 B 27 27 LEU CB C 448 39.760 41.360 -1.600 1
1 1396 . 16 2 2 B 27 27 LEU N N 448 120.890 121.268 -0.378 1
1 1397 . 16 2 2 B 28 28 ALA H H 449 8.200 8.325 -0.125 1
1 1398 . 16 2 2 B 28 28 ALA HA H 449 3.760 4.538 -0.778 1
1 1402 . 16 2 2 B 28 28 ALA CA C 449 54.750 55.179 -0.429 1
1 1403 . 16 2 2 B 28 28 ALA CB C 449 18.050 18.261 -0.211 1
1 1404 . 16 2 2 B 28 28 ALA N N 449 123.710 120.281 3.429 1
1 1405 . 16 2 2 B 29 29 ALA H H 450 7.780 8.004 -0.224 1
1 1406 . 16 2 2 B 29 29 ALA HA H 450 4.170 4.143 0.027 1
1 1410 . 16 2 2 B 29 29 ALA CA C 450 54.430 54.430 0.000 1
1 1411 . 16 2 2 B 29 29 ALA CB C 450 18.040 18.277 -0.237 1
1 1412 . 16 2 2 B 29 29 ALA N N 450 121.020 119.578 1.442 1
1 1413 . 16 2 2 B 30 30 ARG H H 451 7.390 7.715 -0.325 1
1 1414 . 16 2 2 B 30 30 ARG HA H 451 4.540 4.418 0.122 1
1 1421 . 16 2 2 B 30 30 ARG CA C 451 54.510 55.657 -1.147 1
1 1422 . 16 2 2 B 30 30 ARG CB C 451 29.950 29.736 0.214 1
1 1425 . 16 2 2 B 30 30 ARG N N 451 115.480 116.644 -1.164 1
1 1426 . 16 2 2 B 31 31 GLY H H 452 7.950 8.052 -0.102 1
1 1427 . 16 2 2 B 31 31 GLY HA2 H 452 3.550 3.987 -0.437 1
1 1428 . 16 2 2 B 31 31 GLY HA3 H 452 4.200 3.988 0.212 1
1 1429 . 16 2 2 B 31 31 GLY CA C 452 45.380 45.410 -0.030 1
1 1430 . 16 2 2 B 31 31 GLY N N 452 107.740 107.905 -0.165 1
1 1431 . 16 2 2 B 32 32 VAL H H 453 7.990 7.633 0.357 1
1 1432 . 16 2 2 B 32 32 VAL HA H 453 3.930 3.936 -0.006 1
1 1440 . 16 2 2 B 32 32 VAL CA C 453 61.420 62.787 -1.367 1
1 1441 . 16 2 2 B 32 32 VAL CB C 453 29.860 31.922 -2.062 1
1 1444 . 16 2 2 B 32 32 VAL N N 453 125.560 120.631 4.929 1
1 1445 . 16 2 2 B 33 33 CYS H H 454 8.460 8.804 -0.344 1
1 1446 . 16 2 2 B 33 33 CYS HA H 454 4.310 4.823 -0.513 1
1 1449 . 16 2 2 B 33 33 CYS CA C 454 60.260 59.778 0.482 1
1 1450 . 16 2 2 B 33 33 CYS CB C 454 30.330 30.606 -0.276 1
1 1451 . 16 2 2 B 33 33 CYS N N 454 119.460 124.897 -5.437 1
1 1452 . 16 2 2 B 34 34 THR H H 455 8.080 8.053 0.027 1
1 1453 . 16 2 2 B 34 34 THR HA H 455 4.840 4.694 0.146 1
1 1458 . 16 2 2 B 34 34 THR CA C 455 58.650 61.087 -2.437 1
1 1459 . 16 2 2 B 34 34 THR CB C 455 72.680 71.211 1.469 1
1 1461 . 16 2 2 B 34 34 THR N N 455 108.420 113.966 -5.546 1
1 1462 . 16 2 2 B 35 35 LEU H H 456 8.580 8.972 -0.392 1
1 1463 . 16 2 2 B 35 35 LEU HA H 456 3.790 4.051 -0.261 1
1 1473 . 16 2 2 B 35 35 LEU CA C 456 57.980 58.597 -0.617 1
1 1474 . 16 2 2 B 35 35 LEU CB C 456 42.220 41.246 0.974 1
1 1477 . 16 2 2 B 35 35 LEU N N 456 120.370 127.807 -7.437 1
1 1478 . 16 2 2 B 36 36 GLU H H 457 8.390 8.187 0.203 1
1 1479 . 16 2 2 B 36 36 GLU HA H 457 3.820 3.975 -0.155 1
1 1484 . 16 2 2 B 36 36 GLU CA C 457 59.640 59.933 -0.293 1
1 1485 . 16 2 2 B 36 36 GLU CB C 457 28.780 29.356 -0.576 1
1 1487 . 16 2 2 B 36 36 GLU N N 457 119.450 119.194 0.256 1
1 1488 . 16 2 2 B 37 37 ASP H H 458 7.750 7.852 -0.102 1
1 1489 . 16 2 2 B 37 37 ASP HA H 458 4.140 4.365 -0.225 1
1 1492 . 16 2 2 B 37 37 ASP CA C 458 57.150 57.320 -0.170 1
1 1493 . 16 2 2 B 37 37 ASP CB C 458 42.280 40.517 1.763 1
1 1494 . 16 2 2 B 37 37 ASP N N 458 117.430 119.973 -2.543 1
1 1495 . 16 2 2 B 38 38 LEU H H 459 7.700 7.842 -0.142 1
1 1496 . 16 2 2 B 38 38 LEU HA H 459 3.790 4.122 -0.332 1
1 1506 . 16 2 2 B 38 38 LEU CA C 459 58.080 57.969 0.111 1
1 1507 . 16 2 2 B 38 38 LEU CB C 459 41.130 41.130 0.000 1
1 1511 . 16 2 2 B 38 38 LEU N N 459 121.280 121.572 -0.292 1
1 1512 . 16 2 2 B 39 39 ALA H H 460 8.190 8.295 -0.105 1
1 1513 . 16 2 2 B 39 39 ALA HA H 460 3.640 4.031 -0.391 1
1 1517 . 16 2 2 B 39 39 ALA CA C 460 54.320 55.343 -1.023 1
1 1518 . 16 2 2 B 39 39 ALA CB C 460 17.140 18.097 -0.957 1
1 1519 . 16 2 2 B 39 39 ALA N N 460 119.400 120.192 -0.792 1
1 1520 . 16 2 2 B 40 40 GLU H H 461 7.340 7.919 -0.579 1
1 1521 . 16 2 2 B 40 40 GLU HA H 461 4.180 4.112 0.068 1
1 1526 . 16 2 2 B 40 40 GLU CA C 461 57.800 58.257 -0.457 1
1 1527 . 16 2 2 B 40 40 GLU CB C 461 30.600 29.734 0.866 1
1 1529 . 16 2 2 B 40 40 GLU N N 461 110.680 117.726 -7.046 1
1 1530 . 16 2 2 B 41 41 GLN H H 462 7.940 8.093 -0.153 1
1 1531 . 16 2 2 B 41 41 GLN HA H 462 4.100 4.410 -0.310 1
1 1538 . 16 2 2 B 41 41 GLN CA C 462 55.310 55.942 -0.632 1
1 1539 . 16 2 2 B 41 41 GLN CB C 462 28.780 29.495 -0.715 1
1 1541 . 16 2 2 B 41 41 GLN N N 462 120.720 119.080 1.640 1
1 1543 . 16 2 2 B 42 42 GLY H H 463 9.000 8.639 0.361 1
1 1544 . 16 2 2 B 42 42 GLY HA2 H 463 3.310 4.270 -0.960 1
1 1545 . 16 2 2 B 42 42 GLY HA3 H 463 4.820 4.272 0.548 1
1 1546 . 16 2 2 B 42 42 GLY CA C 463 42.650 43.953 -1.303 1
1 1547 . 16 2 2 B 42 42 GLY N N 463 104.110 108.770 -4.660 1
1 1548 . 16 2 2 B 43 43 ILE H H 464 7.900 8.771 -0.871 1
1 1549 . 16 2 2 B 43 43 ILE HA H 464 3.260 3.689 -0.429 1
1 1558 . 16 2 2 B 43 43 ILE CA C 464 66.570 64.354 2.216 1
1 1559 . 16 2 2 B 43 43 ILE CB C 464 38.770 37.373 1.397 1
1 1562 . 16 2 2 B 43 43 ILE N N 464 119.410 120.715 -1.305 1
1 1563 . 16 2 2 B 44 44 ASP H H 465 8.730 8.104 0.626 1
1 1564 . 16 2 2 B 44 44 ASP HA H 465 4.310 4.401 -0.091 1
1 1567 . 16 2 2 B 44 44 ASP CA C 465 56.740 57.105 -0.365 1
1 1568 . 16 2 2 B 44 44 ASP CB C 465 40.120 40.166 -0.046 1
1 1569 . 16 2 2 B 44 44 ASP N N 465 116.610 122.012 -5.402 1
1 1570 . 16 2 2 B 45 45 ASP H H 466 7.720 7.992 -0.272 1
1 1571 . 16 2 2 B 45 45 ASP HA H 466 4.480 4.456 0.024 1
1 1574 . 16 2 2 B 45 45 ASP CA C 466 57.000 57.206 -0.206 1
1 1575 . 16 2 2 B 45 45 ASP CB C 466 42.270 40.671 1.599 1
1 1576 . 16 2 2 B 45 45 ASP N N 466 117.560 120.369 -2.809 1
1 1577 . 16 2 2 B 46 46 LEU H H 467 7.370 8.104 -0.734 1
1 1578 . 16 2 2 B 46 46 LEU HA H 467 4.410 4.144 0.266 1
1 1587 . 16 2 2 B 46 46 LEU CA C 467 53.660 57.509 -3.849 1
1 1588 . 16 2 2 B 46 46 LEU CB C 467 42.260 41.344 0.916 1
1 1591 . 16 2 2 B 46 46 LEU N N 467 116.890 120.769 -3.879 1
1 1592 . 16 2 2 B 47 47 ALA H H 468 7.080 8.310 -1.230 1
1 1593 . 16 2 2 B 47 47 ALA HA H 468 4.120 4.036 0.084 1
1 1597 . 16 2 2 B 47 47 ALA CA C 468 54.130 54.872 -0.742 1
1 1598 . 16 2 2 B 47 47 ALA CB C 468 19.480 18.436 1.044 1
1 1599 . 16 2 2 B 47 47 ALA N N 468 120.150 122.586 -2.436 1
1 1600 . 16 2 2 B 48 48 ASP H H 469 8.560 8.131 0.429 1
1 1601 . 16 2 2 B 48 48 ASP HA H 469 4.410 4.456 -0.046 1
1 1604 . 16 2 2 B 48 48 ASP CA C 469 54.330 57.500 -3.170 1
1 1605 . 16 2 2 B 48 48 ASP CB C 469 39.760 40.718 -0.958 1
1 1606 . 16 2 2 B 48 48 ASP N N 469 114.660 116.341 -1.681 1
1 1607 . 16 2 2 B 49 49 ILE H H 470 7.870 7.988 -0.118 1
1 1608 . 16 2 2 B 49 49 ILE HA H 470 3.850 4.346 -0.496 1
1 1618 . 16 2 2 B 49 49 ILE CA C 470 61.680 60.632 1.048 1
1 1619 . 16 2 2 B 49 49 ILE CB C 470 37.120 38.849 -1.729 1
1 1623 . 16 2 2 B 49 49 ILE N N 470 121.600 119.922 1.678 1
1 1624 . 16 2 2 B 50 50 GLU H H 471 8.680 8.987 -0.307 1
1 1625 . 16 2 2 B 50 50 GLU HA H 471 3.940 4.035 -0.095 1
1 1630 . 16 2 2 B 50 50 GLU CA C 471 58.360 59.336 -0.976 1
1 1631 . 16 2 2 B 50 50 GLU CB C 471 29.530 29.328 0.202 1
1 1633 . 16 2 2 B 50 50 GLU N N 471 131.000 126.062 4.938 1
1 1634 . 16 2 2 B 51 51 GLY H H 472 8.860 8.235 0.625 1
1 1635 . 16 2 2 B 51 51 GLY HA2 H 472 3.640 4.003 -0.363 1
1 1636 . 16 2 2 B 51 51 GLY HA3 H 472 4.230 4.005 0.225 1
1 1637 . 16 2 2 B 51 51 GLY CA C 472 45.190 46.961 -1.771 1
1 1638 . 16 2 2 B 51 51 GLY N N 472 113.580 108.896 4.684 1
1 1639 . 16 2 2 B 52 52 LEU H H 473 7.850 7.597 0.253 1
1 1640 . 16 2 2 B 52 52 LEU HA H 473 4.680 4.765 -0.085 1
1 1650 . 16 2 2 B 52 52 LEU CA C 473 53.640 53.716 -0.076 1
1 1651 . 16 2 2 B 52 52 LEU CB C 473 42.990 43.491 -0.501 1
1 1655 . 16 2 2 B 52 52 LEU N N 473 123.020 120.377 2.643 1
1 1656 . 16 2 2 B 53 53 THR H H 474 7.550 8.860 -1.310 1
1 1657 . 16 2 2 B 53 53 THR HA H 474 4.560 4.818 -0.258 1
1 1662 . 16 2 2 B 53 53 THR CA C 474 60.060 60.858 -0.798 1
1 1663 . 16 2 2 B 53 53 THR CB C 474 71.520 71.106 0.414 1
1 1665 . 16 2 2 B 53 53 THR N N 474 115.070 118.927 -3.857 1
1 1666 . 16 2 2 B 54 54 ASP H H 475 8.900 9.006 -0.106 1
1 1667 . 16 2 2 B 54 54 ASP HA H 475 4.220 4.264 -0.044 1
1 1670 . 16 2 2 B 54 54 ASP CA C 475 57.520 58.050 -0.530 1
1 1671 . 16 2 2 B 54 54 ASP CB C 475 39.560 40.256 -0.696 1
1 1672 . 16 2 2 B 54 54 ASP N N 475 121.800 123.823 -2.023 1
1 1673 . 16 2 2 B 55 55 GLU H H 476 8.460 8.009 0.451 1
1 1674 . 16 2 2 B 55 55 GLU HA H 476 3.970 4.021 -0.051 1
1 1679 . 16 2 2 B 55 55 GLU CA C 476 59.440 59.051 0.389 1
1 1680 . 16 2 2 B 55 55 GLU CB C 476 29.650 29.463 0.187 1
1 1682 . 16 2 2 B 55 55 GLU N N 476 119.460 119.356 0.104 1
1 1683 . 16 2 2 B 56 56 LYS H H 477 7.790 7.974 -0.184 1
1 1684 . 16 2 2 B 56 56 LYS HA H 477 4.120 4.094 0.026 1
1 1693 . 16 2 2 B 56 56 LYS CA C 477 58.890 59.495 -0.605 1
1 1694 . 16 2 2 B 56 56 LYS CB C 477 32.600 32.298 0.302 1
1 1698 . 16 2 2 B 56 56 LYS N N 477 121.840 119.805 2.035 1
1 1699 . 16 2 2 B 57 57 ALA H H 478 8.900 9.318 -0.418 1
1 1700 . 16 2 2 B 57 57 ALA HA H 478 3.790 4.077 -0.287 1
1 1704 . 16 2 2 B 57 57 ALA CA C 478 55.810 55.384 0.426 1
1 1705 . 16 2 2 B 57 57 ALA CB C 478 18.590 18.218 0.372 1
1 1706 . 16 2 2 B 57 57 ALA N N 478 121.350 121.623 -0.273 1
1 1707 . 16 2 2 B 58 58 GLY H H 479 8.300 8.135 0.165 1
1 1708 . 16 2 2 B 58 58 GLY HA2 H 479 3.500 3.767 -0.267 1
1 1709 . 16 2 2 B 58 58 GLY HA3 H 479 3.890 3.770 0.120 1
1 1710 . 16 2 2 B 58 58 GLY CA C 479 47.360 47.305 0.055 1
1 1711 . 16 2 2 B 58 58 GLY N N 479 102.040 108.682 -6.642 1
1 1712 . 16 2 2 B 59 59 ALA H H 480 7.580 7.979 -0.399 1
1 1713 . 16 2 2 B 59 59 ALA HA H 480 4.110 4.057 0.053 1
1 1717 . 16 2 2 B 59 59 ALA CA C 480 55.580 54.540 1.040 1
1 1718 . 16 2 2 B 59 59 ALA CB C 480 18.130 18.784 -0.654 1
1 1719 . 16 2 2 B 59 59 ALA N N 480 123.180 124.707 -1.527 1
1 1720 . 16 2 2 B 60 60 LEU H H 481 8.290 7.967 0.323 1
1 1721 . 16 2 2 B 60 60 LEU HA H 481 4.020 4.020 0.000 1
1 1731 . 16 2 2 B 60 60 LEU CA C 481 57.850 57.776 0.074 1
1 1732 . 16 2 2 B 60 60 LEU CB C 481 42.360 41.258 1.102 1
1 1736 . 16 2 2 B 60 60 LEU N N 481 120.560 118.985 1.575 1
1 1737 . 16 2 2 B 61 61 ILE H H 482 8.080 7.834 0.246 1
1 1738 . 16 2 2 B 61 61 ILE HA H 482 3.210 3.547 -0.337 1
1 1748 . 16 2 2 B 61 61 ILE CA C 482 66.250 65.113 1.137 1
1 1749 . 16 2 2 B 61 61 ILE CB C 482 39.400 38.294 1.106 1
1 1753 . 16 2 2 B 61 61 ILE N N 482 119.170 121.110 -1.940 1
1 1754 . 16 2 2 B 62 62 MET H H 483 8.110 8.189 -0.079 1
1 1755 . 16 2 2 B 62 62 MET HA H 483 4.410 4.170 0.240 1
1 1763 . 16 2 2 B 62 62 MET CA C 483 56.110 58.798 -2.688 1
1 1764 . 16 2 2 B 62 62 MET CB C 483 28.260 32.288 -4.028 1
1 1767 . 16 2 2 B 62 62 MET N N 483 114.420 117.903 -3.483 1
1 1768 . 16 2 2 B 63 63 ALA H H 484 8.240 7.921 0.319 1
1 1769 . 16 2 2 B 63 63 ALA HA H 484 4.130 4.103 0.027 1
1 1773 . 16 2 2 B 63 63 ALA CA C 484 55.300 55.099 0.201 1
1 1774 . 16 2 2 B 63 63 ALA CB C 484 18.280 18.416 -0.136 1
1 1775 . 16 2 2 B 63 63 ALA N N 484 123.710 121.297 2.413 1
1 1776 . 16 2 2 B 64 64 ALA H H 485 8.050 8.326 -0.276 1
1 1777 . 16 2 2 B 64 64 ALA HA H 485 3.870 4.050 -0.180 1
1 1781 . 16 2 2 B 64 64 ALA CA C 485 55.330 55.319 0.011 1
1 1782 . 16 2 2 B 64 64 ALA CB C 485 17.660 18.397 -0.737 1
1 1783 . 16 2 2 B 64 64 ALA N N 485 120.070 119.857 0.213 1
1 1784 . 16 2 2 B 65 65 ARG H H 486 8.640 8.965 -0.325 1
1 1785 . 16 2 2 B 65 65 ARG HA H 486 2.800 4.216 -1.416 1
1 1792 . 16 2 2 B 65 65 ARG CA C 486 60.600 59.659 0.941 1
1 1793 . 16 2 2 B 65 65 ARG CB C 486 29.910 29.999 -0.089 1
1 1796 . 16 2 2 B 65 65 ARG N N 486 118.730 118.629 0.101 1
1 1797 . 16 2 2 B 66 66 ASN H H 487 8.710 8.579 0.131 1
1 1798 . 16 2 2 B 66 66 ASN HA H 487 4.550 4.922 -0.372 1
1 1803 . 16 2 2 B 66 66 ASN CA C 487 56.390 56.565 -0.175 1
1 1804 . 16 2 2 B 66 66 ASN CB C 487 37.970 38.549 -0.579 1
1 1805 . 16 2 2 B 66 66 ASN N N 487 119.170 117.927 1.243 1
1 1807 . 16 2 2 B 67 67 ILE H H 488 7.250 8.009 -0.759 1
1 1808 . 16 2 2 B 67 67 ILE HA H 488 3.810 3.890 -0.080 1
1 1818 . 16 2 2 B 67 67 ILE CA C 488 64.350 65.152 -0.802 1
1 1819 . 16 2 2 B 67 67 ILE CB C 488 39.570 37.579 1.991 1
1 1823 . 16 2 2 B 67 67 ILE N N 488 117.890 119.678 -1.788 1
1 1824 . 16 2 2 B 68 68 CYS H H 489 8.350 7.979 0.371 1
1 1825 . 16 2 2 B 68 68 CYS HA H 489 4.080 4.187 -0.107 1
1 1828 . 16 2 2 B 68 68 CYS CA C 489 62.670 62.477 0.193 1
1 1829 . 16 2 2 B 68 68 CYS CB C 489 28.170 27.461 0.709 1
1 1830 . 16 2 2 B 68 68 CYS N N 489 115.230 120.393 -5.163 1
1 1831 . 16 2 2 B 69 69 TRP H H 490 8.230 8.699 -0.469 1
1 1832 . 16 2 2 B 69 69 TRP HA H 490 5.100 4.248 0.852 1
1 1841 . 16 2 2 B 69 69 TRP CA C 490 55.420 60.555 -5.135 1
1 1842 . 16 2 2 B 69 69 TRP CB C 490 31.010 29.162 1.848 1
1 1844 . 16 2 2 B 69 69 TRP N N 490 116.850 120.722 -3.872 1
1 1846 . 16 2 2 B 70 70 PHE H H 491 7.570 9.139 -1.569 1
1 1847 . 16 2 2 B 70 70 PHE HA H 491 5.240 4.502 0.738 1
1 1852 . 16 2 2 B 70 70 PHE CA C 491 55.490 60.589 -5.099 1
1 1853 . 16 2 2 B 70 70 PHE CB C 491 38.700 37.836 0.864 1
1 1856 . 16 2 2 B 70 70 PHE N N 491 117.460 117.860 -0.400 1
1 1857 . 16 2 2 B 71 71 GLY H H 492 8.420 8.513 -0.093 1
1 1858 . 16 2 2 B 71 71 GLY HA2 H 492 3.920 3.786 0.134 1
1 1859 . 16 2 2 B 71 71 GLY HA3 H 492 4.080 3.806 0.274 1
1 1860 . 16 2 2 B 71 71 GLY CA C 492 46.210 47.187 -0.977 1
1 1861 . 16 2 2 B 71 71 GLY N N 492 110.040 107.824 2.216 1
1 1862 . 16 2 2 B 72 72 ASP H H 493 8.370 7.711 0.659 1
1 1863 . 16 2 2 B 72 72 ASP HA H 493 4.630 4.367 0.263 1
1 1866 . 16 2 2 B 72 72 ASP CA C 493 54.410 56.651 -2.241 1
1 1867 . 16 2 2 B 72 72 ASP CB C 493 41.250 40.543 0.707 1
1 1868 . 16 2 2 B 72 72 ASP N N 493 120.000 119.849 0.151 1
1 1869 . 16 2 2 B 73 73 GLU H H 494 8.230 7.490 0.740 1
1 1870 . 16 2 2 B 73 73 GLU HA H 494 4.260 4.409 -0.149 1
1 1875 . 16 2 2 B 73 73 GLU CA C 494 56.510 56.997 -0.487 1
1 1876 . 16 2 2 B 73 73 GLU CB C 494 30.420 30.148 0.272 1
1 1878 . 16 2 2 B 73 73 GLU N N 494 120.900 118.262 2.638 1
1 216 . 17 1 1 A 20 20 ASP H H 250 8.550 8.984 -0.434 1
1 217 . 17 1 1 A 20 20 ASP HA H 250 4.700 4.728 -0.028 1
1 220 . 17 1 1 A 20 20 ASP CA C 250 52.650 52.939 -0.289 1
1 221 . 17 1 1 A 20 20 ASP CB C 250 41.420 40.505 0.915 1
1 222 . 17 1 1 A 20 20 ASP N N 250 125.190 123.517 1.673 1
1 223 . 17 1 1 A 21 21 PRO HA H 251 4.250 4.411 -0.161 1
1 230 . 17 1 1 A 21 21 PRO CA C 251 65.120 64.539 0.581 1
1 231 . 17 1 1 A 21 21 PRO CB C 251 32.310 32.087 0.223 1
1 234 . 17 1 1 A 22 22 ILE H H 252 8.630 7.816 0.814 1
1 235 . 17 1 1 A 22 22 ILE HA H 252 4.060 3.995 0.065 1
1 245 . 17 1 1 A 22 22 ILE CA C 252 62.990 63.093 -0.103 1
1 246 . 17 1 1 A 22 22 ILE CB C 252 37.520 37.597 -0.077 1
1 250 . 17 1 1 A 22 22 ILE N N 252 119.860 117.300 2.560 1
1 251 . 17 1 1 A 23 23 LEU H H 253 7.950 7.951 -0.001 1
1 252 . 17 1 1 A 23 23 LEU HA H 253 3.710 4.251 -0.541 1
1 262 . 17 1 1 A 23 23 LEU CA C 253 56.510 58.021 -1.511 1
1 263 . 17 1 1 A 23 23 LEU CB C 253 41.190 41.907 -0.717 1
1 266 . 17 1 1 A 23 23 LEU N N 253 116.850 121.377 -4.527 1
1 267 . 17 1 1 A 24 24 LEU H H 254 7.370 8.021 -0.651 1
1 268 . 17 1 1 A 24 24 LEU HA H 254 4.310 4.208 0.102 1
1 278 . 17 1 1 A 24 24 LEU CA C 254 54.890 57.283 -2.393 1
1 279 . 17 1 1 A 24 24 LEU CB C 254 41.960 41.779 0.181 1
1 283 . 17 1 1 A 24 24 LEU N N 254 115.210 119.127 -3.917 1
1 284 . 17 1 1 A 25 25 ARG H H 255 7.520 7.605 -0.085 1
1 285 . 17 1 1 A 25 25 ARG HA H 255 4.660 4.500 0.160 1
1 293 . 17 1 1 A 25 25 ARG CA C 255 52.840 54.713 -1.873 1
1 294 . 17 1 1 A 25 25 ARG CB C 255 28.130 29.752 -1.622 1
1 297 . 17 1 1 A 25 25 ARG N N 255 118.180 119.167 -0.987 1
1 298 . 17 1 1 A 26 26 PRO HA H 256 4.800 4.565 0.235 1
1 305 . 17 1 1 A 26 26 PRO CA C 256 61.790 62.735 -0.945 1
1 306 . 17 1 1 A 26 26 PRO CB C 256 32.660 32.000 0.660 1
1 309 . 17 1 1 A 27 27 VAL H H 257 8.170 8.477 -0.307 1
1 310 . 17 1 1 A 27 27 VAL HA H 257 3.590 3.763 -0.173 1
1 318 . 17 1 1 A 27 27 VAL CA C 257 64.830 65.737 -0.907 1
1 319 . 17 1 1 A 27 27 VAL CB C 257 31.720 31.451 0.269 1
1 322 . 17 1 1 A 27 27 VAL N N 257 115.710 124.345 -8.635 1
1 323 . 17 1 1 A 28 28 ASP H H 258 8.240 8.033 0.207 1
1 324 . 17 1 1 A 28 28 ASP HA H 258 4.340 4.367 -0.027 1
1 327 . 17 1 1 A 28 28 ASP CA C 258 56.490 57.443 -0.953 1
1 328 . 17 1 1 A 28 28 ASP CB C 258 40.520 41.563 -1.043 1
1 329 . 17 1 1 A 28 28 ASP N N 258 119.000 120.954 -1.954 1
1 330 . 17 1 1 A 29 29 ASP H H 259 8.000 8.725 -0.725 1
1 331 . 17 1 1 A 29 29 ASP HA H 259 4.390 4.632 -0.242 1
1 334 . 17 1 1 A 29 29 ASP CA C 259 56.210 55.494 0.716 1
1 335 . 17 1 1 A 29 29 ASP CB C 259 40.670 41.118 -0.448 1
1 336 . 17 1 1 A 29 29 ASP N N 259 118.900 117.296 1.604 1
1 337 . 17 1 1 A 30 30 LEU H H 260 7.760 7.433 0.327 1
1 338 . 17 1 1 A 30 30 LEU HA H 260 3.990 4.248 -0.258 1
1 348 . 17 1 1 A 30 30 LEU CA C 260 55.000 55.367 -0.367 1
1 349 . 17 1 1 A 30 30 LEU CB C 260 41.670 42.136 -0.466 1
1 353 . 17 1 1 A 30 30 LEU N N 260 116.300 121.337 -5.037 1
1 354 . 17 1 1 A 31 31 GLU H H 261 7.990 8.820 -0.830 1
1 355 . 17 1 1 A 31 31 GLU HA H 261 4.280 4.039 0.241 1
1 358 . 17 1 1 A 31 31 GLU CA C 261 56.860 58.837 -1.977 1
1 359 . 17 1 1 A 31 31 GLU CB C 261 27.010 29.795 -2.785 1
1 360 . 17 1 1 A 31 31 GLU N N 261 115.620 124.520 -8.900 1
1 361 . 17 1 1 A 32 32 LEU H H 262 8.000 7.368 0.632 1
1 362 . 17 1 1 A 32 32 LEU HA H 262 4.400 4.284 0.116 1
1 372 . 17 1 1 A 32 32 LEU CA C 262 53.860 54.963 -1.103 1
1 373 . 17 1 1 A 32 32 LEU CB C 262 44.450 42.264 2.186 1
1 377 . 17 1 1 A 32 32 LEU N N 262 118.860 122.754 -3.894 1
1 378 . 17 1 1 A 33 33 THR H H 263 10.020 8.639 1.381 1
1 379 . 17 1 1 A 33 33 THR HA H 263 4.130 4.600 -0.470 1
1 384 . 17 1 1 A 33 33 THR CA C 263 62.400 60.875 1.525 1
1 385 . 17 1 1 A 33 33 THR CB C 263 71.270 71.178 0.092 1
1 387 . 17 1 1 A 33 33 THR N N 263 114.610 114.438 0.172 1
1 388 . 17 1 1 A 34 34 VAL H H 264 8.370 8.812 -0.442 1
1 389 . 17 1 1 A 34 34 VAL HA H 264 3.620 3.647 -0.027 1
1 397 . 17 1 1 A 34 34 VAL CA C 264 66.340 66.716 -0.376 1
1 398 . 17 1 1 A 34 34 VAL CB C 264 31.670 31.510 0.160 1
1 401 . 17 1 1 A 34 34 VAL N N 264 122.110 122.452 -0.342 1
1 402 . 17 1 1 A 35 35 ARG H H 265 8.190 8.244 -0.054 1
1 403 . 17 1 1 A 35 35 ARG HA H 265 4.070 3.917 0.153 1
1 411 . 17 1 1 A 35 35 ARG CA C 265 59.470 59.739 -0.269 1
1 412 . 17 1 1 A 35 35 ARG CB C 265 29.790 29.912 -0.122 1
1 415 . 17 1 1 A 35 35 ARG N N 265 117.340 120.927 -3.587 1
1 416 . 17 1 1 A 36 36 SER H H 266 7.610 7.758 -0.148 1
1 417 . 17 1 1 A 36 36 SER HA H 266 4.080 4.104 -0.024 1
1 420 . 17 1 1 A 36 36 SER CA C 266 63.080 61.615 1.465 1
1 421 . 17 1 1 A 36 36 SER CB C 266 63.280 63.004 0.276 1
1 422 . 17 1 1 A 36 36 SER N N 266 116.710 113.723 2.987 1
1 423 . 17 1 1 A 37 37 ALA H H 267 8.720 7.505 1.215 1
1 424 . 17 1 1 A 37 37 ALA HA H 267 3.760 4.071 -0.311 1
1 428 . 17 1 1 A 37 37 ALA CA C 267 55.900 55.071 0.829 1
1 429 . 17 1 1 A 37 37 ALA CB C 267 18.090 18.227 -0.137 1
1 430 . 17 1 1 A 37 37 ALA N N 267 124.170 122.213 1.957 1
1 431 . 17 1 1 A 38 38 ASN H H 268 8.850 9.138 -0.288 1
1 432 . 17 1 1 A 38 38 ASN HA H 268 4.420 4.490 -0.070 1
1 437 . 17 1 1 A 38 38 ASN CA C 268 55.700 56.236 -0.536 1
1 438 . 17 1 1 A 38 38 ASN CB C 268 37.180 37.968 -0.788 1
1 439 . 17 1 1 A 38 38 ASN N N 268 117.370 116.968 0.402 1
1 441 . 17 1 1 A 39 39 CYS H H 269 7.970 8.004 -0.034 1
1 442 . 17 1 1 A 39 39 CYS HA H 269 4.190 4.086 0.104 1
1 445 . 17 1 1 A 39 39 CYS CA C 269 63.340 62.948 0.392 1
1 446 . 17 1 1 A 39 39 CYS CB C 269 26.870 27.184 -0.314 1
1 447 . 17 1 1 A 39 39 CYS N N 269 120.510 118.235 2.275 1
1 448 . 17 1 1 A 40 40 LEU H H 270 7.600 7.587 0.013 1
1 449 . 17 1 1 A 40 40 LEU HA H 270 3.880 4.008 -0.128 1
1 458 . 17 1 1 A 40 40 LEU CA C 270 57.810 57.517 0.293 1
1 459 . 17 1 1 A 40 40 LEU CB C 270 40.030 41.319 -1.289 1
1 462 . 17 1 1 A 40 40 LEU N N 270 117.710 120.424 -2.714 1
1 463 . 17 1 1 A 41 41 LYS H H 271 7.980 8.979 -0.999 1
1 464 . 17 1 1 A 41 41 LYS HA H 271 3.820 4.211 -0.391 1
1 472 . 17 1 1 A 41 41 LYS CA C 271 59.840 59.031 0.809 1
1 473 . 17 1 1 A 41 41 LYS CB C 271 32.070 32.144 -0.074 1
1 476 . 17 1 1 A 41 41 LYS N N 271 120.070 121.263 -1.193 1
1 477 . 17 1 1 A 42 42 ALA H H 272 7.860 8.626 -0.766 1
1 478 . 17 1 1 A 42 42 ALA HA H 272 4.140 4.082 0.058 1
1 482 . 17 1 1 A 42 42 ALA CA C 272 54.670 54.162 0.508 1
1 483 . 17 1 1 A 42 42 ALA CB C 272 17.950 18.156 -0.206 1
1 484 . 17 1 1 A 42 42 ALA N N 272 122.880 120.998 1.882 1
1 485 . 17 1 1 A 43 43 GLU H H 273 7.210 7.673 -0.463 1
1 486 . 17 1 1 A 43 43 GLU HA H 273 4.260 4.448 -0.188 1
1 491 . 17 1 1 A 43 43 GLU CA C 273 55.020 55.647 -0.627 1
1 492 . 17 1 1 A 43 43 GLU CB C 273 29.880 29.735 0.145 1
1 494 . 17 1 1 A 43 43 GLU N N 273 116.590 118.283 -1.693 1
1 495 . 17 1 1 A 44 44 ALA H H 274 7.880 7.671 0.209 1
1 496 . 17 1 1 A 44 44 ALA HA H 274 3.680 3.875 -0.195 1
1 500 . 17 1 1 A 44 44 ALA CA C 274 52.960 53.360 -0.400 1
1 501 . 17 1 1 A 44 44 ALA CB C 274 16.110 17.914 -1.804 1
1 502 . 17 1 1 A 44 44 ALA N N 274 118.420 119.757 -1.337 1
1 503 . 17 1 1 A 45 45 ILE H H 275 7.600 7.472 0.128 1
1 504 . 17 1 1 A 45 45 ILE HA H 275 3.870 4.393 -0.523 1
1 514 . 17 1 1 A 45 45 ILE CA C 275 61.150 60.153 0.997 1
1 515 . 17 1 1 A 45 45 ILE CB C 275 37.090 39.730 -2.640 1
1 519 . 17 1 1 A 45 45 ILE N N 275 120.370 117.866 2.504 1
1 520 . 17 1 1 A 46 46 HIS H H 276 8.350 8.902 -0.552 1
1 521 . 17 1 1 A 46 46 HIS HA H 276 4.600 4.664 -0.064 1
1 526 . 17 1 1 A 46 46 HIS CA C 276 56.900 57.037 -0.137 1
1 527 . 17 1 1 A 46 46 HIS CB C 276 31.910 31.793 0.117 1
1 529 . 17 1 1 A 46 46 HIS N N 276 123.250 124.898 -1.648 1
1 530 . 17 1 1 A 47 47 TYR H H 277 8.850 8.014 0.836 1
1 531 . 17 1 1 A 47 47 TYR HA H 277 5.100 4.879 0.221 1
1 538 . 17 1 1 A 47 47 TYR CA C 277 57.430 57.259 0.171 1
1 539 . 17 1 1 A 47 47 TYR CB C 277 40.680 40.473 0.207 1
1 544 . 17 1 1 A 47 47 TYR N N 277 119.700 117.141 2.559 1
1 545 . 17 1 1 A 48 48 ILE H H 278 9.380 8.685 0.695 1
1 546 . 17 1 1 A 48 48 ILE HA H 278 3.340 3.768 -0.428 1
1 554 . 17 1 1 A 48 48 ILE CA C 278 67.640 65.174 2.466 1
1 555 . 17 1 1 A 48 48 ILE CB C 278 36.310 37.507 -1.197 1
1 558 . 17 1 1 A 48 48 ILE N N 278 125.650 125.217 0.433 1
1 559 . 17 1 1 A 49 49 GLY H H 279 9.430 8.823 0.607 1
1 560 . 17 1 1 A 49 49 GLY HA2 H 279 2.370 3.814 -1.444 1
1 561 . 17 1 1 A 49 49 GLY HA3 H 279 3.230 4.072 -0.842 1
1 562 . 17 1 1 A 49 49 GLY CA C 279 46.820 47.489 -0.669 1
1 563 . 17 1 1 A 49 49 GLY N N 279 105.200 108.852 -3.652 1
1 564 . 17 1 1 A 50 50 ASP H H 280 7.050 8.044 -0.994 1
1 565 . 17 1 1 A 50 50 ASP HA H 280 4.360 4.256 0.104 1
1 568 . 17 1 1 A 50 50 ASP CA C 280 57.110 56.276 0.834 1
1 569 . 17 1 1 A 50 50 ASP CB C 280 42.620 40.562 2.058 1
1 570 . 17 1 1 A 50 50 ASP N N 280 116.360 121.384 -5.024 1
1 571 . 17 1 1 A 51 51 LEU H H 281 7.170 8.017 -0.847 1
1 572 . 17 1 1 A 51 51 LEU HA H 281 3.880 3.965 -0.085 1
1 582 . 17 1 1 A 51 51 LEU CA C 281 57.900 58.268 -0.368 1
1 583 . 17 1 1 A 51 51 LEU CB C 281 41.870 41.525 0.345 1
1 587 . 17 1 1 A 51 51 LEU N N 281 120.130 122.052 -1.922 1
1 588 . 17 1 1 A 52 52 VAL H H 282 7.820 7.628 0.192 1
1 589 . 17 1 1 A 52 52 VAL HA H 282 3.980 3.857 0.123 1
1 597 . 17 1 1 A 52 52 VAL CA C 282 64.000 65.225 -1.225 1
1 598 . 17 1 1 A 52 52 VAL CB C 282 30.400 31.116 -0.716 1
1 601 . 17 1 1 A 52 52 VAL N N 282 105.550 115.161 -9.611 1
1 602 . 17 1 1 A 53 53 GLN H H 283 6.550 7.838 -1.288 1
1 603 . 17 1 1 A 53 53 GLN HA H 283 4.680 3.992 0.688 1
1 610 . 17 1 1 A 53 53 GLN CA C 283 56.210 58.577 -2.367 1
1 611 . 17 1 1 A 53 53 GLN CB C 283 31.710 28.543 3.167 1
1 613 . 17 1 1 A 53 53 GLN N N 283 114.060 121.017 -6.957 1
1 615 . 17 1 1 A 54 54 ARG H H 284 7.690 7.596 0.094 1
1 616 . 17 1 1 A 54 54 ARG HA H 284 4.520 4.730 -0.210 1
1 624 . 17 1 1 A 54 54 ARG CA C 284 54.600 54.400 0.200 1
1 625 . 17 1 1 A 54 54 ARG CB C 284 30.750 32.676 -1.926 1
1 628 . 17 1 1 A 54 54 ARG N N 284 119.810 118.287 1.523 1
1 629 . 17 1 1 A 55 55 THR H H 285 8.110 8.628 -0.518 1
1 630 . 17 1 1 A 55 55 THR HA H 285 4.430 4.252 0.178 1
1 635 . 17 1 1 A 55 55 THR CA C 285 59.640 63.992 -4.352 1
1 636 . 17 1 1 A 55 55 THR CB C 285 71.310 69.275 2.035 1
1 638 . 17 1 1 A 55 55 THR N N 285 108.450 119.417 -10.967 1
1 639 . 17 1 1 A 56 56 GLU H H 286 8.910 8.946 -0.036 1
1 640 . 17 1 1 A 56 56 GLU HA H 286 3.660 3.946 -0.286 1
1 645 . 17 1 1 A 56 56 GLU CA C 286 60.650 59.798 0.852 1
1 646 . 17 1 1 A 56 56 GLU CB C 286 29.400 29.212 0.188 1
1 648 . 17 1 1 A 56 56 GLU N N 286 120.600 126.549 -5.949 1
1 649 . 17 1 1 A 57 57 VAL H H 287 7.600 8.123 -0.523 1
1 650 . 17 1 1 A 57 57 VAL HA H 287 3.620 3.525 0.095 1
1 658 . 17 1 1 A 57 57 VAL CA C 287 66.020 67.067 -1.047 1
1 659 . 17 1 1 A 57 57 VAL CB C 287 31.720 31.529 0.191 1
1 662 . 17 1 1 A 57 57 VAL N N 287 114.050 119.798 -5.748 1
1 663 . 17 1 1 A 58 58 GLU H H 288 7.350 8.287 -0.937 1
1 664 . 17 1 1 A 58 58 GLU HA H 288 3.830 4.063 -0.233 1
1 669 . 17 1 1 A 58 58 GLU CA C 288 59.250 59.657 -0.407 1
1 670 . 17 1 1 A 58 58 GLU CB C 288 30.030 29.096 0.934 1
1 672 . 17 1 1 A 58 58 GLU N N 288 117.610 119.244 -1.634 1
1 673 . 17 1 1 A 59 59 LEU H H 289 7.850 8.129 -0.279 1
1 674 . 17 1 1 A 59 59 LEU HA H 289 4.150 4.014 0.136 1
1 683 . 17 1 1 A 59 59 LEU CA C 289 57.340 57.920 -0.580 1
1 684 . 17 1 1 A 59 59 LEU CB C 289 41.170 41.650 -0.480 1
1 687 . 17 1 1 A 59 59 LEU N N 289 120.050 120.497 -0.447 1
1 688 . 17 1 1 A 60 60 LEU H H 290 7.670 8.093 -0.423 1
1 689 . 17 1 1 A 60 60 LEU HA H 290 4.540 4.100 0.440 1
1 696 . 17 1 1 A 60 60 LEU CA C 290 55.090 56.912 -1.822 1
1 697 . 17 1 1 A 60 60 LEU CB C 290 42.320 41.536 0.784 1
1 701 . 17 1 1 A 60 60 LEU N N 290 114.980 119.612 -4.632 1
1 702 . 17 1 1 A 61 61 LYS H H 291 7.440 7.228 0.212 1
1 703 . 17 1 1 A 61 61 LYS HA H 291 4.280 4.410 -0.130 1
1 710 . 17 1 1 A 61 61 LYS CA C 291 56.860 55.943 0.917 1
1 711 . 17 1 1 A 61 61 LYS CB C 291 31.900 32.434 -0.534 1
1 714 . 17 1 1 A 61 61 LYS N N 291 118.120 116.018 2.102 1
1 715 . 17 1 1 A 62 62 THR H H 292 7.310 7.409 -0.099 1
1 716 . 17 1 1 A 62 62 THR HA H 292 5.220 4.703 0.517 1
1 721 . 17 1 1 A 62 62 THR CA C 292 55.830 59.023 -3.193 1
1 722 . 17 1 1 A 62 62 THR CB C 292 69.970 72.249 -2.279 1
1 724 . 17 1 1 A 62 62 THR N N 292 111.890 114.322 -2.432 1
1 725 . 17 1 1 A 63 63 PRO HA H 293 4.570 4.432 0.138 1
1 730 . 17 1 1 A 63 63 PRO CA C 293 63.710 64.478 -0.768 1
1 731 . 17 1 1 A 63 63 PRO CB C 293 32.380 31.851 0.529 1
1 733 . 17 1 1 A 64 64 ASN H H 294 8.050 8.859 -0.809 1
1 734 . 17 1 1 A 64 64 ASN HA H 294 4.490 4.466 0.024 1
1 739 . 17 1 1 A 64 64 ASN CA C 294 55.630 55.379 0.251 1
1 740 . 17 1 1 A 64 64 ASN CB C 294 38.730 38.072 0.658 1
1 741 . 17 1 1 A 64 64 ASN N N 294 117.120 116.970 0.150 1
1 743 . 17 1 1 A 65 65 LEU H H 295 7.550 7.370 0.180 1
1 744 . 17 1 1 A 65 65 LEU HA H 295 4.640 4.543 0.097 1
1 754 . 17 1 1 A 65 65 LEU CA C 295 54.310 53.436 0.874 1
1 755 . 17 1 1 A 65 65 LEU CB C 295 43.640 42.256 1.384 1
1 758 . 17 1 1 A 65 65 LEU N N 295 119.930 119.255 0.675 1
1 759 . 17 1 1 A 66 66 GLY H H 296 7.850 8.628 -0.778 1
1 760 . 17 1 1 A 66 66 GLY HA2 H 296 3.810 4.083 -0.273 1
1 761 . 17 1 1 A 66 66 GLY HA3 H 296 4.110 4.083 0.027 1
1 762 . 17 1 1 A 66 66 GLY CA C 296 43.570 44.860 -1.290 1
1 763 . 17 1 1 A 66 66 GLY N N 296 108.840 111.621 -2.781 1
1 764 . 17 1 1 A 67 67 LYS H H 297 8.820 8.665 0.155 1
1 765 . 17 1 1 A 67 67 LYS HA H 297 3.980 3.880 0.100 1
1 774 . 17 1 1 A 67 67 LYS CA C 297 60.100 59.561 0.539 1
1 775 . 17 1 1 A 67 67 LYS CB C 297 32.100 32.037 0.063 1
1 779 . 17 1 1 A 67 67 LYS N N 297 120.130 120.173 -0.043 1
1 780 . 17 1 1 A 68 68 LYS H H 298 8.850 7.886 0.964 1
1 781 . 17 1 1 A 68 68 LYS HA H 298 4.060 4.039 0.021 1
1 790 . 17 1 1 A 68 68 LYS CA C 298 60.600 59.250 1.350 1
1 791 . 17 1 1 A 68 68 LYS CB C 298 31.920 32.144 -0.224 1
1 795 . 17 1 1 A 68 68 LYS N N 298 119.580 120.289 -0.709 1
1 796 . 17 1 1 A 69 69 SER H H 299 8.100 7.855 0.245 1
1 797 . 17 1 1 A 69 69 SER HA H 299 4.370 4.131 0.239 1
1 800 . 17 1 1 A 69 69 SER CA C 299 61.980 62.352 -0.372 1
1 801 . 17 1 1 A 69 69 SER CB C 299 63.000 63.230 -0.230 1
1 802 . 17 1 1 A 69 69 SER N N 299 116.360 117.250 -0.890 1
1 803 . 17 1 1 A 70 70 LEU H H 300 8.240 8.202 0.038 1
1 804 . 17 1 1 A 70 70 LEU HA H 300 3.970 4.072 -0.102 1
1 814 . 17 1 1 A 70 70 LEU CA C 300 57.610 57.907 -0.297 1
1 815 . 17 1 1 A 70 70 LEU CB C 300 41.060 41.593 -0.533 1
1 819 . 17 1 1 A 70 70 LEU N N 300 123.330 122.673 0.657 1
1 820 . 17 1 1 A 71 71 THR H H 301 8.550 8.112 0.438 1
1 821 . 17 1 1 A 71 71 THR HA H 301 3.690 3.832 -0.142 1
1 826 . 17 1 1 A 71 71 THR CA C 301 67.170 67.095 0.075 1
1 827 . 17 1 1 A 71 71 THR CB C 301 68.810 68.686 0.124 1
1 829 . 17 1 1 A 71 71 THR N N 301 116.520 115.030 1.490 1
1 830 . 17 1 1 A 72 72 GLU H H 302 7.520 8.068 -0.548 1
1 831 . 17 1 1 A 72 72 GLU HA H 302 4.070 4.012 0.058 1
1 836 . 17 1 1 A 72 72 GLU CA C 302 59.470 59.245 0.225 1
1 837 . 17 1 1 A 72 72 GLU CB C 302 29.090 29.623 -0.533 1
1 839 . 17 1 1 A 72 72 GLU N N 302 121.510 119.282 2.228 1
1 840 . 17 1 1 A 73 73 ILE H H 303 8.290 8.099 0.191 1
1 841 . 17 1 1 A 73 73 ILE HA H 303 3.380 3.617 -0.237 1
1 849 . 17 1 1 A 73 73 ILE CA C 303 66.010 65.196 0.814 1
1 850 . 17 1 1 A 73 73 ILE CB C 303 38.680 38.204 0.476 1
1 853 . 17 1 1 A 73 73 ILE N N 303 118.510 121.019 -2.509 1
1 854 . 17 1 1 A 74 74 LYS H H 304 8.550 8.211 0.339 1
1 855 . 17 1 1 A 74 74 LYS HA H 304 3.680 3.854 -0.174 1
1 864 . 17 1 1 A 74 74 LYS CA C 304 61.320 60.008 1.312 1
1 865 . 17 1 1 A 74 74 LYS CB C 304 32.060 32.144 -0.084 1
1 868 . 17 1 1 A 74 74 LYS N N 304 118.220 120.716 -2.496 1
1 869 . 17 1 1 A 75 75 ASP H H 305 8.450 8.026 0.424 1
1 870 . 17 1 1 A 75 75 ASP HA H 305 4.440 4.431 0.009 1
1 873 . 17 1 1 A 75 75 ASP CA C 305 57.690 57.353 0.337 1
1 874 . 17 1 1 A 75 75 ASP CB C 305 40.220 40.837 -0.617 1
1 875 . 17 1 1 A 75 75 ASP N N 305 121.790 119.924 1.866 1
1 876 . 17 1 1 A 76 76 VAL H H 306 8.680 7.673 1.007 1
1 877 . 17 1 1 A 76 76 VAL HA H 306 3.890 3.588 0.302 1
1 885 . 17 1 1 A 76 76 VAL CA C 306 66.020 66.342 -0.322 1
1 886 . 17 1 1 A 76 76 VAL CB C 306 31.250 31.411 -0.161 1
1 889 . 17 1 1 A 76 76 VAL N N 306 121.150 120.456 0.694 1
1 890 . 17 1 1 A 77 77 LEU H H 307 8.470 8.524 -0.054 1
1 891 . 17 1 1 A 77 77 LEU HA H 307 3.810 4.045 -0.235 1
1 901 . 17 1 1 A 77 77 LEU CA C 307 58.330 57.517 0.813 1
1 902 . 17 1 1 A 77 77 LEU CB C 307 41.250 41.147 0.103 1
1 906 . 17 1 1 A 77 77 LEU N N 307 120.830 118.919 1.911 1
1 907 . 17 1 1 A 78 78 ALA H H 308 8.280 8.399 -0.119 1
1 908 . 17 1 1 A 78 78 ALA HA H 308 4.320 4.118 0.202 1
1 912 . 17 1 1 A 78 78 ALA CA C 308 55.420 54.729 0.691 1
1 913 . 17 1 1 A 78 78 ALA CB C 308 17.750 17.655 0.095 1
1 914 . 17 1 1 A 78 78 ALA N N 308 122.530 123.642 -1.112 1
1 915 . 17 1 1 A 79 79 SER H H 309 7.900 7.947 -0.047 1
1 916 . 17 1 1 A 79 79 SER HA H 309 4.340 4.291 0.049 1
1 919 . 17 1 1 A 79 79 SER CA C 309 61.350 59.465 1.885 1
1 920 . 17 1 1 A 79 79 SER CB C 309 63.280 64.221 -0.941 1
1 921 . 17 1 1 A 79 79 SER N N 309 115.600 111.605 3.995 1
1 922 . 17 1 1 A 80 80 ARG H H 310 7.450 8.140 -0.690 1
1 923 . 17 1 1 A 80 80 ARG HA H 310 4.550 4.030 0.520 1
1 931 . 17 1 1 A 80 80 ARG CA C 310 54.200 57.485 -3.285 1
1 932 . 17 1 1 A 80 80 ARG CB C 310 30.680 29.975 0.705 1
1 935 . 17 1 1 A 80 80 ARG N N 310 119.360 120.640 -1.280 1
1 936 . 17 1 1 A 81 81 GLY H H 311 7.940 8.059 -0.119 1
1 937 . 17 1 1 A 81 81 GLY HA2 H 311 3.840 3.983 -0.143 1
1 938 . 17 1 1 A 81 81 GLY HA3 H 311 4.070 3.988 0.082 1
1 939 . 17 1 1 A 81 81 GLY CA C 311 46.060 45.914 0.146 1
1 940 . 17 1 1 A 81 81 GLY N N 311 108.130 106.869 1.261 1
1 941 . 17 1 1 A 82 82 LEU H H 312 7.920 7.530 0.390 1
1 942 . 17 1 1 A 82 82 LEU HA H 312 4.680 4.905 -0.225 1
1 952 . 17 1 1 A 82 82 LEU CA C 312 53.070 52.542 0.528 1
1 953 . 17 1 1 A 82 82 LEU CB C 312 45.790 45.416 0.374 1
1 957 . 17 1 1 A 82 82 LEU N N 312 119.290 116.163 3.127 1
1 958 . 17 1 1 A 83 83 SER H H 313 7.530 8.978 -1.448 1
1 959 . 17 1 1 A 83 83 SER HA H 313 4.450 4.130 0.320 1
1 962 . 17 1 1 A 83 83 SER CA C 313 57.190 58.918 -1.728 1
1 963 . 17 1 1 A 83 83 SER CB C 313 66.080 62.016 4.064 1
1 964 . 17 1 1 A 83 83 SER N N 313 113.120 115.268 -2.148 1
1 965 . 17 1 1 A 84 84 LEU H H 314 8.340 8.350 -0.010 1
1 966 . 17 1 1 A 84 84 LEU HA H 314 4.620 4.402 0.218 1
1 976 . 17 1 1 A 84 84 LEU CA C 314 54.720 54.675 0.045 1
1 977 . 17 1 1 A 84 84 LEU CB C 314 41.620 42.248 -0.628 1
1 981 . 17 1 1 A 84 84 LEU N N 314 115.930 120.248 -4.318 1
1 982 . 17 1 1 A 85 85 GLY H H 315 8.270 7.856 0.414 1
1 983 . 17 1 1 A 85 85 GLY HA2 H 315 3.320 3.884 -0.564 1
1 984 . 17 1 1 A 85 85 GLY HA3 H 315 3.850 3.894 -0.044 1
1 985 . 17 1 1 A 85 85 GLY CA C 315 46.560 47.010 -0.450 1
1 986 . 17 1 1 A 85 85 GLY N N 315 111.010 108.854 2.156 1
1 987 . 17 1 1 A 86 86 MET H H 316 8.650 7.785 0.865 1
1 988 . 17 1 1 A 86 86 MET HA H 316 3.990 5.054 -1.064 1
1 996 . 17 1 1 A 86 86 MET CA C 316 56.730 53.540 3.190 1
1 997 . 17 1 1 A 86 86 MET CB C 316 33.600 35.268 -1.668 1
1 1000 . 17 1 1 A 86 86 MET N N 316 120.570 115.734 4.836 1
1 1001 . 17 1 1 A 87 87 ARG H H 317 8.360 8.775 -0.415 1
1 1002 . 17 1 1 A 87 87 ARG HA H 317 4.450 4.754 -0.304 1
1 1010 . 17 1 1 A 87 87 ARG CA C 317 55.310 55.062 0.248 1
1 1011 . 17 1 1 A 87 87 ARG CB C 317 30.490 32.423 -1.933 1
1 1014 . 17 1 1 A 87 87 ARG N N 317 122.290 121.760 0.530 1
1 1015 . 17 1 1 A 88 88 LEU H H 318 8.400 8.679 -0.279 1
1 1016 . 17 1 1 A 88 88 LEU HA H 318 4.670 4.658 0.012 1
1 1026 . 17 1 1 A 88 88 LEU CA C 318 53.110 53.363 -0.253 1
1 1027 . 17 1 1 A 88 88 LEU CB C 318 43.600 42.937 0.663 1
1 1031 . 17 1 1 A 88 88 LEU N N 318 126.420 124.407 2.013 1
1 1032 . 17 1 1 A 89 89 GLU H H 319 8.780 9.027 -0.247 1
1 1033 . 17 1 1 A 89 89 GLU HA H 319 4.340 4.125 0.215 1
1 1038 . 17 1 1 A 89 89 GLU CA C 319 56.490 58.405 -1.915 1
1 1039 . 17 1 1 A 89 89 GLU CB C 319 30.470 30.389 0.081 1
1 1041 . 17 1 1 A 89 89 GLU N N 319 123.070 126.260 -3.190 1
1 1042 . 17 1 1 A 90 90 ASN H H 320 8.900 7.958 0.942 1
1 1043 . 17 1 1 A 90 90 ASN HA H 320 4.410 5.071 -0.661 1
1 1048 . 17 1 1 A 90 90 ASN CA C 320 54.120 52.574 1.546 1
1 1049 . 17 1 1 A 90 90 ASN CB C 320 37.640 39.787 -2.147 1
1 1050 . 17 1 1 A 90 90 ASN N N 320 116.540 116.652 -0.112 1
1 1052 . 17 1 1 A 91 91 TRP H H 321 7.990 7.794 0.196 1
1 1053 . 17 1 1 A 91 91 TRP HA H 321 4.330 4.541 -0.211 1
1 1062 . 17 1 1 A 91 91 TRP CA C 321 54.590 55.851 -1.261 1
1 1063 . 17 1 1 A 91 91 TRP CB C 321 31.280 29.021 2.259 1
1 1069 . 17 1 1 A 91 91 TRP N N 321 119.230 119.471 -0.241 1
1 1071 . 17 1 1 A 92 92 PRO HA H 322 4.800 4.522 0.278 1
1 1077 . 17 1 1 A 93 93 PRO HA H 323 4.450 4.638 -0.188 1
1 1084 . 17 1 1 A 93 93 PRO CA C 323 61.970 62.701 -0.731 1
1 1085 . 17 1 1 A 93 93 PRO CB C 323 32.830 32.766 0.064 1
1 1088 . 17 1 1 A 94 94 ALA H H 324 8.460 8.729 -0.269 1
1 1089 . 17 1 1 A 94 94 ALA HA H 324 4.000 4.014 -0.014 1
1 1093 . 17 1 1 A 94 94 ALA CA C 324 53.790 54.956 -1.166 1
1 1094 . 17 1 1 A 94 94 ALA CB C 324 18.640 18.082 0.558 1
1 1095 . 17 1 1 A 94 94 ALA N N 324 124.010 126.766 -2.756 1
1 1096 . 17 1 1 A 95 95 SER H H 325 7.950 7.975 -0.025 1
1 1097 . 17 1 1 A 95 95 SER HA H 325 4.210 4.059 0.151 1
1 1100 . 17 1 1 A 95 95 SER CA C 325 58.970 62.138 -3.168 1
1 1101 . 17 1 1 A 95 95 SER CB C 325 63.040 62.900 0.140 1
1 1102 . 17 1 1 A 95 95 SER N N 325 111.520 113.968 -2.448 1
1 1103 . 17 1 1 A 96 96 ILE H H 326 7.480 7.747 -0.267 1
1 1104 . 17 1 1 A 96 96 ILE HA H 326 4.170 3.803 0.367 1
1 1114 . 17 1 1 A 96 96 ILE CA C 326 61.300 63.172 -1.872 1
1 1115 . 17 1 1 A 96 96 ILE CB C 326 38.530 37.493 1.037 1
1 1119 . 17 1 1 A 96 96 ILE N N 326 119.650 120.937 -1.287 1
1 1120 . 17 1 1 A 97 97 ALA H H 327 7.860 7.332 0.528 1
1 1121 . 17 1 1 A 97 97 ALA HA H 327 4.230 4.187 0.043 1
1 1125 . 17 1 1 A 97 97 ALA CA C 327 52.570 52.211 0.359 1
1 1126 . 17 1 1 A 97 97 ALA CB C 327 19.590 19.459 0.131 1
1 1127 . 17 1 1 A 97 97 ALA N N 327 126.480 124.445 2.035 1
1 1128 . 17 1 1 A 98 98 ASP H H 328 8.250 8.809 -0.559 1
1 1129 . 17 1 1 A 98 98 ASP HA H 328 4.540 4.254 0.286 1
1 1132 . 17 1 1 A 98 98 ASP CA C 328 54.150 57.299 -3.149 1
1 1133 . 17 1 1 A 98 98 ASP CB C 328 41.120 40.710 0.410 1
1 1134 . 17 1 1 A 98 98 ASP N N 328 120.130 123.368 -3.238 1
1 1150 . 17 2 2 B 6 6 ASP H H 427 8.160 8.779 -0.619 1
1 1151 . 17 2 2 B 6 6 ASP HA H 427 4.630 4.339 0.291 1
1 1154 . 17 2 2 B 6 6 ASP CA C 427 54.410 57.013 -2.603 1
1 1155 . 17 2 2 B 6 6 ASP CB C 427 41.250 40.492 0.758 1
1 1156 . 17 2 2 B 6 6 ASP N N 427 120.160 123.030 -2.870 1
1 1157 . 17 2 2 B 7 7 ASN H H 428 8.350 8.032 0.318 1
1 1158 . 17 2 2 B 7 7 ASN HA H 428 4.550 4.534 0.016 1
1 1163 . 17 2 2 B 7 7 ASN CA C 428 53.310 55.959 -2.649 1
1 1164 . 17 2 2 B 7 7 ASN CB C 428 38.850 37.747 1.103 1
1 1165 . 17 2 2 B 7 7 ASN N N 428 118.440 116.351 2.089 1
1 1167 . 17 2 2 B 8 8 LYS H H 429 8.030 7.566 0.464 1
1 1172 . 17 2 2 B 8 8 LYS CB C 429 33.280 33.325 -0.045 1
1 1174 . 17 2 2 B 8 8 LYS N N 429 120.260 120.790 -0.530 1
1 1175 . 17 2 2 B 9 9 PRO HA H 430 4.420 4.495 -0.075 1
1 1182 . 17 2 2 B 9 9 PRO CA C 430 62.280 62.709 -0.429 1
1 1183 . 17 2 2 B 9 9 PRO CB C 430 31.920 32.394 -0.474 1
1 1186 . 17 2 2 B 10 10 ALA H H 431 8.930 9.325 -0.395 1
1 1187 . 17 2 2 B 10 10 ALA HA H 431 4.350 4.529 -0.179 1
1 1191 . 17 2 2 B 10 10 ALA CA C 431 51.070 51.844 -0.774 1
1 1192 . 17 2 2 B 10 10 ALA CB C 431 20.920 19.683 1.237 1
1 1193 . 17 2 2 B 10 10 ALA N N 431 125.000 124.797 0.203 1
1 1194 . 17 2 2 B 11 11 ASP H H 432 8.530 9.144 -0.614 1
1 1195 . 17 2 2 B 11 11 ASP HA H 432 4.220 4.257 -0.037 1
1 1198 . 17 2 2 B 11 11 ASP CA C 432 57.520 57.448 0.072 1
1 1199 . 17 2 2 B 11 11 ASP CB C 432 40.470 40.261 0.209 1
1 1200 . 17 2 2 B 11 11 ASP N N 432 119.610 120.511 -0.901 1
1 1201 . 17 2 2 B 12 12 ASP H H 433 8.340 8.003 0.337 1
1 1202 . 17 2 2 B 12 12 ASP HA H 433 4.160 4.433 -0.273 1
1 1205 . 17 2 2 B 12 12 ASP CA C 433 56.090 57.341 -1.251 1
1 1206 . 17 2 2 B 12 12 ASP CB C 433 38.960 40.984 -2.024 1
1 1207 . 17 2 2 B 12 12 ASP N N 433 116.330 120.115 -3.785 1
1 1208 . 17 2 2 B 13 13 LEU H H 434 7.360 7.908 -0.548 1
1 1209 . 17 2 2 B 13 13 LEU HA H 434 4.050 4.114 -0.064 1
1 1219 . 17 2 2 B 13 13 LEU CA C 434 57.340 57.818 -0.478 1
1 1220 . 17 2 2 B 13 13 LEU CB C 434 42.960 41.501 1.459 1
1 1224 . 17 2 2 B 13 13 LEU N N 434 123.440 121.332 2.108 1
1 1225 . 17 2 2 B 14 14 LEU H H 435 7.670 8.033 -0.363 1
1 1226 . 17 2 2 B 14 14 LEU HA H 435 3.710 4.022 -0.312 1
1 1236 . 17 2 2 B 14 14 LEU CA C 435 57.170 57.743 -0.573 1
1 1237 . 17 2 2 B 14 14 LEU CB C 435 42.590 41.386 1.204 1
1 1241 . 17 2 2 B 14 14 LEU N N 435 115.170 119.680 -4.510 1
1 1242 . 17 2 2 B 15 15 ASN H H 436 7.490 8.075 -0.585 1
1 1243 . 17 2 2 B 15 15 ASN HA H 436 4.640 4.826 -0.186 1
1 1248 . 17 2 2 B 15 15 ASN CA C 436 52.920 53.350 -0.430 1
1 1249 . 17 2 2 B 15 15 ASN CB C 436 39.350 38.943 0.407 1
1 1250 . 17 2 2 B 15 15 ASN N N 436 112.280 115.082 -2.802 1
1 1252 . 17 2 2 B 16 16 LEU H H 437 7.300 7.108 0.192 1
1 1253 . 17 2 2 B 16 16 LEU HA H 437 4.100 4.288 -0.188 1
1 1263 . 17 2 2 B 16 16 LEU CA C 437 55.310 55.102 0.208 1
1 1264 . 17 2 2 B 16 16 LEU CB C 437 41.800 42.964 -1.164 1
1 1268 . 17 2 2 B 16 16 LEU N N 437 125.180 122.887 2.293 1
1 1269 . 17 2 2 B 17 17 GLU H H 438 8.590 8.774 -0.184 1
1 1270 . 17 2 2 B 17 17 GLU HA H 438 3.920 4.031 -0.111 1
1 1275 . 17 2 2 B 17 17 GLU CA C 438 58.440 57.972 0.468 1
1 1276 . 17 2 2 B 17 17 GLU CB C 438 29.180 29.704 -0.524 1
1 1278 . 17 2 2 B 17 17 GLU N N 438 129.850 125.967 3.883 1
1 1279 . 17 2 2 B 18 18 GLY H H 439 8.580 8.821 -0.241 1
1 1280 . 17 2 2 B 18 18 GLY HA2 H 439 3.570 3.948 -0.378 1
1 1281 . 17 2 2 B 18 18 GLY HA3 H 439 4.220 3.951 0.269 1
1 1282 . 17 2 2 B 18 18 GLY CA C 439 44.710 45.340 -0.630 1
1 1283 . 17 2 2 B 18 18 GLY N N 439 112.250 114.975 -2.725 1
1 1284 . 17 2 2 B 19 19 VAL H H 440 7.900 7.757 0.143 1
1 1285 . 17 2 2 B 19 19 VAL HA H 440 3.950 4.419 -0.469 1
1 1293 . 17 2 2 B 19 19 VAL CA C 440 62.820 60.958 1.862 1
1 1294 . 17 2 2 B 19 19 VAL CB C 440 31.470 34.810 -3.340 1
1 1297 . 17 2 2 B 19 19 VAL N N 440 121.910 121.702 0.208 1
1 1298 . 17 2 2 B 20 20 ASP H H 441 7.390 8.778 -1.388 1
1 1299 . 17 2 2 B 20 20 ASP HA H 441 4.820 4.762 0.058 1
1 1302 . 17 2 2 B 20 20 ASP CA C 441 51.920 53.417 -1.497 1
1 1303 . 17 2 2 B 20 20 ASP CB C 441 42.090 41.603 0.487 1
1 1304 . 17 2 2 B 20 20 ASP N N 441 124.850 126.087 -1.237 1
1 1305 . 17 2 2 B 21 21 ARG H H 442 8.630 8.729 -0.099 1
1 1306 . 17 2 2 B 21 21 ARG HA H 442 3.810 3.506 0.304 1
1 1313 . 17 2 2 B 21 21 ARG CA C 442 60.710 59.517 1.193 1
1 1314 . 17 2 2 B 21 21 ARG CB C 442 30.020 29.820 0.200 1
1 1317 . 17 2 2 B 21 21 ARG N N 442 120.890 122.679 -1.789 1
1 1318 . 17 2 2 B 22 22 ASP H H 443 8.140 7.887 0.253 1
1 1319 . 17 2 2 B 22 22 ASP HA H 443 4.420 4.385 0.035 1
1 1322 . 17 2 2 B 22 22 ASP CA C 443 57.680 57.083 0.597 1
1 1323 . 17 2 2 B 22 22 ASP CB C 443 40.880 40.957 -0.077 1
1 1324 . 17 2 2 B 22 22 ASP N N 443 116.750 119.871 -3.121 1
1 1325 . 17 2 2 B 23 23 LEU H H 444 8.170 8.027 0.143 1
1 1326 . 17 2 2 B 23 23 LEU HA H 444 4.130 3.944 0.186 1
1 1336 . 17 2 2 B 23 23 LEU CA C 444 57.770 58.218 -0.448 1
1 1337 . 17 2 2 B 23 23 LEU CB C 444 41.230 41.232 -0.002 1
1 1341 . 17 2 2 B 23 23 LEU N N 444 122.130 120.219 1.911 1
1 1342 . 17 2 2 B 24 24 ALA H H 445 8.630 8.350 0.280 1
1 1343 . 17 2 2 B 24 24 ALA HA H 445 3.790 4.003 -0.213 1
1 1347 . 17 2 2 B 24 24 ALA CA C 445 55.810 54.798 1.012 1
1 1348 . 17 2 2 B 24 24 ALA CB C 445 18.060 18.247 -0.187 1
1 1349 . 17 2 2 B 24 24 ALA N N 445 120.890 120.904 -0.014 1
1 1350 . 17 2 2 B 25 25 PHE H H 446 8.160 7.409 0.751 1
1 1351 . 17 2 2 B 25 25 PHE HA H 446 4.080 4.332 -0.252 1
1 1358 . 17 2 2 B 25 25 PHE CA C 446 62.670 61.861 0.809 1
1 1359 . 17 2 2 B 25 25 PHE CB C 446 39.440 38.595 0.845 1
1 1364 . 17 2 2 B 25 25 PHE N N 446 115.360 116.071 -0.711 1
1 1365 . 17 2 2 B 26 26 LYS H H 447 8.040 7.798 0.242 1
1 1366 . 17 2 2 B 26 26 LYS HA H 447 4.110 4.007 0.103 1
1 1375 . 17 2 2 B 26 26 LYS CA C 447 60.140 59.490 0.650 1
1 1376 . 17 2 2 B 26 26 LYS CB C 447 32.880 32.403 0.477 1
1 1380 . 17 2 2 B 26 26 LYS N N 447 123.110 118.383 4.727 1
1 1381 . 17 2 2 B 27 27 LEU H H 448 8.630 8.133 0.497 1
1 1382 . 17 2 2 B 27 27 LEU HA H 448 3.840 4.087 -0.247 1
1 1392 . 17 2 2 B 27 27 LEU CA C 448 58.210 57.662 0.548 1
1 1393 . 17 2 2 B 27 27 LEU CB C 448 39.760 41.272 -1.512 1
1 1396 . 17 2 2 B 27 27 LEU N N 448 120.890 121.572 -0.682 1
1 1397 . 17 2 2 B 28 28 ALA H H 449 8.200 8.915 -0.715 1
1 1398 . 17 2 2 B 28 28 ALA HA H 449 3.760 4.521 -0.761 1
1 1402 . 17 2 2 B 28 28 ALA CA C 449 54.750 55.150 -0.400 1
1 1403 . 17 2 2 B 28 28 ALA CB C 449 18.050 18.346 -0.296 1
1 1404 . 17 2 2 B 28 28 ALA N N 449 123.710 120.507 3.203 1
1 1405 . 17 2 2 B 29 29 ALA H H 450 7.780 7.873 -0.093 1
1 1406 . 17 2 2 B 29 29 ALA HA H 450 4.170 4.041 0.129 1
1 1410 . 17 2 2 B 29 29 ALA CA C 450 54.430 54.724 -0.294 1
1 1411 . 17 2 2 B 29 29 ALA CB C 450 18.040 18.613 -0.573 1
1 1412 . 17 2 2 B 29 29 ALA N N 450 121.020 119.586 1.434 1
1 1413 . 17 2 2 B 30 30 ARG H H 451 7.390 7.809 -0.419 1
1 1414 . 17 2 2 B 30 30 ARG HA H 451 4.540 4.405 0.135 1
1 1421 . 17 2 2 B 30 30 ARG CA C 451 54.510 55.706 -1.196 1
1 1422 . 17 2 2 B 30 30 ARG CB C 451 29.950 29.741 0.209 1
1 1425 . 17 2 2 B 30 30 ARG N N 451 115.480 116.453 -0.973 1
1 1426 . 17 2 2 B 31 31 GLY H H 452 7.950 8.394 -0.444 1
1 1427 . 17 2 2 B 31 31 GLY HA2 H 452 3.550 3.988 -0.438 1
1 1428 . 17 2 2 B 31 31 GLY HA3 H 452 4.200 3.990 0.210 1
1 1429 . 17 2 2 B 31 31 GLY CA C 452 45.380 45.407 -0.027 1
1 1430 . 17 2 2 B 31 31 GLY N N 452 107.740 107.561 0.179 1
1 1431 . 17 2 2 B 32 32 VAL H H 453 7.990 7.673 0.317 1
1 1432 . 17 2 2 B 32 32 VAL HA H 453 3.930 3.946 -0.016 1
1 1440 . 17 2 2 B 32 32 VAL CA C 453 61.420 62.844 -1.424 1
1 1441 . 17 2 2 B 32 32 VAL CB C 453 29.860 31.443 -1.583 1
1 1444 . 17 2 2 B 32 32 VAL N N 453 125.560 120.658 4.902 1
1 1445 . 17 2 2 B 33 33 CYS H H 454 8.460 8.425 0.035 1
1 1446 . 17 2 2 B 33 33 CYS HA H 454 4.310 4.814 -0.504 1
1 1449 . 17 2 2 B 33 33 CYS CA C 454 60.260 59.731 0.529 1
1 1450 . 17 2 2 B 33 33 CYS CB C 454 30.330 30.489 -0.159 1
1 1451 . 17 2 2 B 33 33 CYS N N 454 119.460 125.419 -5.959 1
1 1452 . 17 2 2 B 34 34 THR H H 455 8.080 7.494 0.586 1
1 1453 . 17 2 2 B 34 34 THR HA H 455 4.840 4.542 0.298 1
1 1458 . 17 2 2 B 34 34 THR CA C 455 58.650 61.671 -3.021 1
1 1459 . 17 2 2 B 34 34 THR CB C 455 72.680 71.001 1.679 1
1 1461 . 17 2 2 B 34 34 THR N N 455 108.420 114.963 -6.543 1
1 1462 . 17 2 2 B 35 35 LEU H H 456 8.580 8.787 -0.207 1
1 1463 . 17 2 2 B 35 35 LEU HA H 456 3.790 4.022 -0.232 1
1 1473 . 17 2 2 B 35 35 LEU CA C 456 57.980 58.607 -0.627 1
1 1474 . 17 2 2 B 35 35 LEU CB C 456 42.220 41.340 0.880 1
1 1477 . 17 2 2 B 35 35 LEU N N 456 120.370 127.661 -7.291 1
1 1478 . 17 2 2 B 36 36 GLU H H 457 8.390 8.340 0.050 1
1 1479 . 17 2 2 B 36 36 GLU HA H 457 3.820 3.859 -0.039 1
1 1484 . 17 2 2 B 36 36 GLU CA C 457 59.640 60.087 -0.447 1
1 1485 . 17 2 2 B 36 36 GLU CB C 457 28.780 29.175 -0.395 1
1 1487 . 17 2 2 B 36 36 GLU N N 457 119.450 119.078 0.372 1
1 1488 . 17 2 2 B 37 37 ASP H H 458 7.750 7.823 -0.073 1
1 1489 . 17 2 2 B 37 37 ASP HA H 458 4.140 4.401 -0.261 1
1 1492 . 17 2 2 B 37 37 ASP CA C 458 57.150 57.358 -0.208 1
1 1493 . 17 2 2 B 37 37 ASP CB C 458 42.280 40.447 1.833 1
1 1494 . 17 2 2 B 37 37 ASP N N 458 117.430 120.622 -3.192 1
1 1495 . 17 2 2 B 38 38 LEU H H 459 7.700 7.819 -0.119 1
1 1496 . 17 2 2 B 38 38 LEU HA H 459 3.790 4.111 -0.321 1
1 1506 . 17 2 2 B 38 38 LEU CA C 459 58.080 57.995 0.085 1
1 1507 . 17 2 2 B 38 38 LEU CB C 459 41.130 41.091 0.039 1
1 1511 . 17 2 2 B 38 38 LEU N N 459 121.280 121.559 -0.279 1
1 1512 . 17 2 2 B 39 39 ALA H H 460 8.190 8.077 0.113 1
1 1513 . 17 2 2 B 39 39 ALA HA H 460 3.640 4.113 -0.473 1
1 1517 . 17 2 2 B 39 39 ALA CA C 460 54.320 54.847 -0.527 1
1 1518 . 17 2 2 B 39 39 ALA CB C 460 17.140 18.087 -0.947 1
1 1519 . 17 2 2 B 39 39 ALA N N 460 119.400 120.116 -0.716 1
1 1520 . 17 2 2 B 40 40 GLU H H 461 7.340 8.084 -0.744 1
1 1521 . 17 2 2 B 40 40 GLU HA H 461 4.180 4.316 -0.136 1
1 1526 . 17 2 2 B 40 40 GLU CA C 461 57.800 58.246 -0.446 1
1 1527 . 17 2 2 B 40 40 GLU CB C 461 30.600 30.078 0.522 1
1 1529 . 17 2 2 B 40 40 GLU N N 461 110.680 115.597 -4.917 1
1 1530 . 17 2 2 B 41 41 GLN H H 462 7.940 7.722 0.218 1
1 1531 . 17 2 2 B 41 41 GLN HA H 462 4.100 4.459 -0.359 1
1 1538 . 17 2 2 B 41 41 GLN CA C 462 55.310 55.548 -0.238 1
1 1539 . 17 2 2 B 41 41 GLN CB C 462 28.780 29.883 -1.103 1
1 1541 . 17 2 2 B 41 41 GLN N N 462 120.720 118.108 2.612 1
1 1543 . 17 2 2 B 42 42 GLY H H 463 9.000 8.708 0.292 1
1 1544 . 17 2 2 B 42 42 GLY HA2 H 463 3.310 4.381 -1.071 1
1 1545 . 17 2 2 B 42 42 GLY HA3 H 463 4.820 4.382 0.438 1
1 1546 . 17 2 2 B 42 42 GLY CA C 463 42.650 43.477 -0.827 1
1 1547 . 17 2 2 B 42 42 GLY N N 463 104.110 108.105 -3.995 1
1 1548 . 17 2 2 B 43 43 ILE H H 464 7.900 8.769 -0.869 1
1 1549 . 17 2 2 B 43 43 ILE HA H 464 3.260 3.707 -0.447 1
1 1558 . 17 2 2 B 43 43 ILE CA C 464 66.570 64.348 2.222 1
1 1559 . 17 2 2 B 43 43 ILE CB C 464 38.770 37.653 1.117 1
1 1562 . 17 2 2 B 43 43 ILE N N 464 119.410 121.617 -2.207 1
1 1563 . 17 2 2 B 44 44 ASP H H 465 8.730 8.891 -0.161 1
1 1564 . 17 2 2 B 44 44 ASP HA H 465 4.310 4.288 0.022 1
1 1567 . 17 2 2 B 44 44 ASP CA C 465 56.740 56.992 -0.252 1
1 1568 . 17 2 2 B 44 44 ASP CB C 465 40.120 39.645 0.475 1
1 1569 . 17 2 2 B 44 44 ASP N N 465 116.610 119.909 -3.299 1
1 1570 . 17 2 2 B 45 45 ASP H H 466 7.720 8.239 -0.519 1
1 1571 . 17 2 2 B 45 45 ASP HA H 466 4.480 4.515 -0.035 1
1 1574 . 17 2 2 B 45 45 ASP CA C 466 57.000 57.121 -0.121 1
1 1575 . 17 2 2 B 45 45 ASP CB C 466 42.270 41.064 1.206 1
1 1576 . 17 2 2 B 45 45 ASP N N 466 117.560 120.654 -3.094 1
1 1577 . 17 2 2 B 46 46 LEU H H 467 7.370 8.087 -0.717 1
1 1578 . 17 2 2 B 46 46 LEU HA H 467 4.410 4.156 0.254 1
1 1587 . 17 2 2 B 46 46 LEU CA C 467 53.660 57.770 -4.110 1
1 1588 . 17 2 2 B 46 46 LEU CB C 467 42.260 40.902 1.358 1
1 1591 . 17 2 2 B 46 46 LEU N N 467 116.890 121.018 -4.128 1
1 1592 . 17 2 2 B 47 47 ALA H H 468 7.080 8.521 -1.441 1
1 1593 . 17 2 2 B 47 47 ALA HA H 468 4.120 4.011 0.109 1
1 1597 . 17 2 2 B 47 47 ALA CA C 468 54.130 54.904 -0.774 1
1 1598 . 17 2 2 B 47 47 ALA CB C 468 19.480 18.247 1.233 1
1 1599 . 17 2 2 B 47 47 ALA N N 468 120.150 122.454 -2.304 1
1 1600 . 17 2 2 B 48 48 ASP H H 469 8.560 8.111 0.449 1
1 1601 . 17 2 2 B 48 48 ASP HA H 469 4.410 4.455 -0.045 1
1 1604 . 17 2 2 B 48 48 ASP CA C 469 54.330 57.347 -3.017 1
1 1605 . 17 2 2 B 48 48 ASP CB C 469 39.760 40.435 -0.675 1
1 1606 . 17 2 2 B 48 48 ASP N N 469 114.660 116.239 -1.579 1
1 1607 . 17 2 2 B 49 49 ILE H H 470 7.870 7.462 0.408 1
1 1608 . 17 2 2 B 49 49 ILE HA H 470 3.850 4.099 -0.249 1
1 1618 . 17 2 2 B 49 49 ILE CA C 470 61.680 61.299 0.381 1
1 1619 . 17 2 2 B 49 49 ILE CB C 470 37.120 38.167 -1.047 1
1 1623 . 17 2 2 B 49 49 ILE N N 470 121.600 119.721 1.879 1
1 1624 . 17 2 2 B 50 50 GLU H H 471 8.680 8.872 -0.192 1
1 1625 . 17 2 2 B 50 50 GLU HA H 471 3.940 4.053 -0.113 1
1 1630 . 17 2 2 B 50 50 GLU CA C 471 58.360 58.126 0.234 1
1 1631 . 17 2 2 B 50 50 GLU CB C 471 29.530 29.855 -0.325 1
1 1633 . 17 2 2 B 50 50 GLU N N 471 131.000 126.478 4.522 1
1 1634 . 17 2 2 B 51 51 GLY H H 472 8.860 8.900 -0.040 1
1 1635 . 17 2 2 B 51 51 GLY HA2 H 472 3.640 3.978 -0.338 1
1 1636 . 17 2 2 B 51 51 GLY HA3 H 472 4.230 3.979 0.251 1
1 1637 . 17 2 2 B 51 51 GLY CA C 472 45.190 45.089 0.101 1
1 1638 . 17 2 2 B 51 51 GLY N N 472 113.580 112.575 1.005 1
1 1639 . 17 2 2 B 52 52 LEU H H 473 7.850 7.613 0.237 1
1 1640 . 17 2 2 B 52 52 LEU HA H 473 4.680 4.503 0.177 1
1 1650 . 17 2 2 B 52 52 LEU CA C 473 53.640 54.042 -0.402 1
1 1651 . 17 2 2 B 52 52 LEU CB C 473 42.990 43.060 -0.070 1
1 1655 . 17 2 2 B 52 52 LEU N N 473 123.020 122.032 0.988 1
1 1656 . 17 2 2 B 53 53 THR H H 474 7.550 8.868 -1.318 1
1 1657 . 17 2 2 B 53 53 THR HA H 474 4.560 4.817 -0.257 1
1 1662 . 17 2 2 B 53 53 THR CA C 474 60.060 60.856 -0.796 1
1 1663 . 17 2 2 B 53 53 THR CB C 474 71.520 71.103 0.417 1
1 1665 . 17 2 2 B 53 53 THR N N 474 115.070 118.818 -3.748 1
1 1666 . 17 2 2 B 54 54 ASP H H 475 8.900 9.005 -0.105 1
1 1667 . 17 2 2 B 54 54 ASP HA H 475 4.220 4.273 -0.053 1
1 1670 . 17 2 2 B 54 54 ASP CA C 475 57.520 57.995 -0.475 1
1 1671 . 17 2 2 B 54 54 ASP CB C 475 39.560 40.246 -0.686 1
1 1672 . 17 2 2 B 54 54 ASP N N 475 121.800 123.827 -2.027 1
1 1673 . 17 2 2 B 55 55 GLU H H 476 8.460 8.098 0.362 1
1 1674 . 17 2 2 B 55 55 GLU HA H 476 3.970 4.052 -0.082 1
1 1679 . 17 2 2 B 55 55 GLU CA C 476 59.440 59.268 0.172 1
1 1680 . 17 2 2 B 55 55 GLU CB C 476 29.650 29.438 0.212 1
1 1682 . 17 2 2 B 55 55 GLU N N 476 119.460 119.626 -0.166 1
1 1683 . 17 2 2 B 56 56 LYS H H 477 7.790 8.039 -0.249 1
1 1684 . 17 2 2 B 56 56 LYS HA H 477 4.120 4.082 0.038 1
1 1693 . 17 2 2 B 56 56 LYS CA C 477 58.890 59.173 -0.283 1
1 1694 . 17 2 2 B 56 56 LYS CB C 477 32.600 32.188 0.412 1
1 1698 . 17 2 2 B 56 56 LYS N N 477 121.840 119.761 2.079 1
1 1699 . 17 2 2 B 57 57 ALA H H 478 8.900 8.928 -0.028 1
1 1700 . 17 2 2 B 57 57 ALA HA H 478 3.790 4.056 -0.266 1
1 1704 . 17 2 2 B 57 57 ALA CA C 478 55.810 55.257 0.553 1
1 1705 . 17 2 2 B 57 57 ALA CB C 478 18.590 18.316 0.274 1
1 1706 . 17 2 2 B 57 57 ALA N N 478 121.350 121.790 -0.440 1
1 1707 . 17 2 2 B 58 58 GLY H H 479 8.300 8.098 0.202 1
1 1708 . 17 2 2 B 58 58 GLY HA2 H 479 3.500 3.781 -0.281 1
1 1709 . 17 2 2 B 58 58 GLY HA3 H 479 3.890 3.783 0.107 1
1 1710 . 17 2 2 B 58 58 GLY CA C 479 47.360 47.255 0.105 1
1 1711 . 17 2 2 B 58 58 GLY N N 479 102.040 106.830 -4.790 1
1 1712 . 17 2 2 B 59 59 ALA H H 480 7.580 8.022 -0.442 1
1 1713 . 17 2 2 B 59 59 ALA HA H 480 4.110 4.056 0.054 1
1 1717 . 17 2 2 B 59 59 ALA CA C 480 55.580 54.605 0.975 1
1 1718 . 17 2 2 B 59 59 ALA CB C 480 18.130 18.805 -0.675 1
1 1719 . 17 2 2 B 59 59 ALA N N 480 123.180 124.672 -1.492 1
1 1720 . 17 2 2 B 60 60 LEU H H 481 8.290 8.076 0.214 1
1 1721 . 17 2 2 B 60 60 LEU HA H 481 4.020 4.022 -0.002 1
1 1731 . 17 2 2 B 60 60 LEU CA C 481 57.850 57.801 0.049 1
1 1732 . 17 2 2 B 60 60 LEU CB C 481 42.360 41.364 0.996 1
1 1736 . 17 2 2 B 60 60 LEU N N 481 120.560 118.233 2.327 1
1 1737 . 17 2 2 B 61 61 ILE H H 482 8.080 7.892 0.188 1
1 1738 . 17 2 2 B 61 61 ILE HA H 482 3.210 3.531 -0.321 1
1 1748 . 17 2 2 B 61 61 ILE CA C 482 66.250 65.082 1.168 1
1 1749 . 17 2 2 B 61 61 ILE CB C 482 39.400 38.293 1.107 1
1 1753 . 17 2 2 B 61 61 ILE N N 482 119.170 120.717 -1.547 1
1 1754 . 17 2 2 B 62 62 MET H H 483 8.110 8.403 -0.293 1
1 1755 . 17 2 2 B 62 62 MET HA H 483 4.410 4.085 0.325 1
1 1763 . 17 2 2 B 62 62 MET CA C 483 56.110 58.672 -2.562 1
1 1764 . 17 2 2 B 62 62 MET CB C 483 28.260 32.470 -4.210 1
1 1767 . 17 2 2 B 62 62 MET N N 483 114.420 118.281 -3.861 1
1 1768 . 17 2 2 B 63 63 ALA H H 484 8.240 7.909 0.331 1
1 1769 . 17 2 2 B 63 63 ALA HA H 484 4.130 4.115 0.015 1
1 1773 . 17 2 2 B 63 63 ALA CA C 484 55.300 55.046 0.254 1
1 1774 . 17 2 2 B 63 63 ALA CB C 484 18.280 18.361 -0.081 1
1 1775 . 17 2 2 B 63 63 ALA N N 484 123.710 121.281 2.429 1
1 1776 . 17 2 2 B 64 64 ALA H H 485 8.050 8.069 -0.019 1
1 1777 . 17 2 2 B 64 64 ALA HA H 485 3.870 4.072 -0.202 1
1 1781 . 17 2 2 B 64 64 ALA CA C 485 55.330 55.373 -0.043 1
1 1782 . 17 2 2 B 64 64 ALA CB C 485 17.660 18.347 -0.687 1
1 1783 . 17 2 2 B 64 64 ALA N N 485 120.070 120.016 0.054 1
1 1784 . 17 2 2 B 65 65 ARG H H 486 8.640 8.553 0.087 1
1 1785 . 17 2 2 B 65 65 ARG HA H 486 2.800 4.188 -1.388 1
1 1792 . 17 2 2 B 65 65 ARG CA C 486 60.600 59.620 0.980 1
1 1793 . 17 2 2 B 65 65 ARG CB C 486 29.910 29.899 0.011 1
1 1796 . 17 2 2 B 65 65 ARG N N 486 118.730 118.758 -0.028 1
1 1797 . 17 2 2 B 66 66 ASN H H 487 8.710 8.395 0.315 1
1 1798 . 17 2 2 B 66 66 ASN HA H 487 4.550 4.726 -0.176 1
1 1803 . 17 2 2 B 66 66 ASN CA C 487 56.390 56.448 -0.058 1
1 1804 . 17 2 2 B 66 66 ASN CB C 487 37.970 38.633 -0.663 1
1 1805 . 17 2 2 B 66 66 ASN N N 487 119.170 117.883 1.287 1
1 1807 . 17 2 2 B 67 67 ILE H H 488 7.250 8.031 -0.781 1
1 1808 . 17 2 2 B 67 67 ILE HA H 488 3.810 3.883 -0.073 1
1 1818 . 17 2 2 B 67 67 ILE CA C 488 64.350 65.049 -0.699 1
1 1819 . 17 2 2 B 67 67 ILE CB C 488 39.570 37.718 1.852 1
1 1823 . 17 2 2 B 67 67 ILE N N 488 117.890 119.880 -1.990 1
1 1824 . 17 2 2 B 68 68 CYS H H 489 8.350 8.419 -0.069 1
1 1825 . 17 2 2 B 68 68 CYS HA H 489 4.080 4.148 -0.068 1
1 1828 . 17 2 2 B 68 68 CYS CA C 489 62.670 63.296 -0.626 1
1 1829 . 17 2 2 B 68 68 CYS CB C 489 28.170 28.429 -0.259 1
1 1830 . 17 2 2 B 68 68 CYS N N 489 115.230 118.885 -3.655 1
1 1831 . 17 2 2 B 69 69 TRP H H 490 8.230 9.280 -1.050 1
1 1832 . 17 2 2 B 69 69 TRP HA H 490 5.100 4.246 0.854 1
1 1841 . 17 2 2 B 69 69 TRP CA C 490 55.420 60.090 -4.670 1
1 1842 . 17 2 2 B 69 69 TRP CB C 490 31.010 28.958 2.052 1
1 1844 . 17 2 2 B 69 69 TRP N N 490 116.850 121.114 -4.264 1
1 1846 . 17 2 2 B 70 70 PHE H H 491 7.570 8.571 -1.001 1
1 1847 . 17 2 2 B 70 70 PHE HA H 491 5.240 4.728 0.512 1
1 1852 . 17 2 2 B 70 70 PHE CA C 491 55.490 58.005 -2.515 1
1 1853 . 17 2 2 B 70 70 PHE CB C 491 38.700 38.928 -0.228 1
1 1856 . 17 2 2 B 70 70 PHE N N 491 117.460 115.755 1.705 1
1 1857 . 17 2 2 B 71 71 GLY H H 492 8.420 8.189 0.231 1
1 1858 . 17 2 2 B 71 71 GLY HA2 H 492 3.920 4.018 -0.098 1
1 1859 . 17 2 2 B 71 71 GLY HA3 H 492 4.080 4.050 0.030 1
1 1860 . 17 2 2 B 71 71 GLY CA C 492 46.210 45.625 0.585 1
1 1861 . 17 2 2 B 71 71 GLY N N 492 110.040 107.885 2.155 1
1 1862 . 17 2 2 B 72 72 ASP H H 493 8.370 8.757 -0.387 1
1 1863 . 17 2 2 B 72 72 ASP HA H 493 4.630 4.260 0.370 1
1 1866 . 17 2 2 B 72 72 ASP CA C 493 54.410 57.089 -2.679 1
1 1867 . 17 2 2 B 72 72 ASP CB C 493 41.250 40.377 0.873 1
1 1868 . 17 2 2 B 72 72 ASP N N 493 120.000 122.794 -2.794 1
1 1869 . 17 2 2 B 73 73 GLU H H 494 8.230 8.582 -0.352 1
1 1870 . 17 2 2 B 73 73 GLU HA H 494 4.260 4.023 0.237 1
1 1875 . 17 2 2 B 73 73 GLU CA C 494 56.510 59.481 -2.971 1
1 1876 . 17 2 2 B 73 73 GLU CB C 494 30.420 29.293 1.127 1
1 1878 . 17 2 2 B 73 73 GLU N N 494 120.900 119.662 1.238 1
1 216 . 18 1 1 A 20 20 ASP H H 250 8.550 8.717 -0.167 1
1 217 . 18 1 1 A 20 20 ASP HA H 250 4.700 4.671 0.029 1
1 220 . 18 1 1 A 20 20 ASP CA C 250 52.650 52.977 -0.327 1
1 221 . 18 1 1 A 20 20 ASP CB C 250 41.420 40.276 1.144 1
1 222 . 18 1 1 A 20 20 ASP N N 250 125.190 124.501 0.689 1
1 223 . 18 1 1 A 21 21 PRO HA H 251 4.250 4.357 -0.107 1
1 230 . 18 1 1 A 21 21 PRO CA C 251 65.120 65.153 -0.033 1
1 231 . 18 1 1 A 21 21 PRO CB C 251 32.310 32.099 0.211 1
1 234 . 18 1 1 A 22 22 ILE H H 252 8.630 7.864 0.766 1
1 235 . 18 1 1 A 22 22 ILE HA H 252 4.060 3.975 0.085 1
1 245 . 18 1 1 A 22 22 ILE CA C 252 62.990 63.526 -0.536 1
1 246 . 18 1 1 A 22 22 ILE CB C 252 37.520 37.892 -0.372 1
1 250 . 18 1 1 A 22 22 ILE N N 252 119.860 116.849 3.011 1
1 251 . 18 1 1 A 23 23 LEU H H 253 7.950 7.626 0.324 1
1 252 . 18 1 1 A 23 23 LEU HA H 253 3.710 4.247 -0.537 1
1 262 . 18 1 1 A 23 23 LEU CA C 253 56.510 57.440 -0.930 1
1 263 . 18 1 1 A 23 23 LEU CB C 253 41.190 41.445 -0.255 1
1 266 . 18 1 1 A 23 23 LEU N N 253 116.850 122.048 -5.198 1
1 267 . 18 1 1 A 24 24 LEU H H 254 7.370 8.245 -0.875 1
1 268 . 18 1 1 A 24 24 LEU HA H 254 4.310 4.791 -0.481 1
1 278 . 18 1 1 A 24 24 LEU CA C 254 54.890 55.570 -0.680 1
1 279 . 18 1 1 A 24 24 LEU CB C 254 41.960 42.581 -0.621 1
1 283 . 18 1 1 A 24 24 LEU N N 254 115.210 117.844 -2.634 1
1 284 . 18 1 1 A 25 25 ARG H H 255 7.520 7.986 -0.466 1
1 285 . 18 1 1 A 25 25 ARG HA H 255 4.660 4.462 0.198 1
1 293 . 18 1 1 A 25 25 ARG CA C 255 52.840 54.372 -1.532 1
1 294 . 18 1 1 A 25 25 ARG CB C 255 28.130 29.698 -1.568 1
1 297 . 18 1 1 A 25 25 ARG N N 255 118.180 119.724 -1.544 1
1 298 . 18 1 1 A 26 26 PRO HA H 256 4.800 4.626 0.174 1
1 305 . 18 1 1 A 26 26 PRO CA C 256 61.790 62.650 -0.860 1
1 306 . 18 1 1 A 26 26 PRO CB C 256 32.660 32.256 0.404 1
1 309 . 18 1 1 A 27 27 VAL H H 257 8.170 8.454 -0.284 1
1 310 . 18 1 1 A 27 27 VAL HA H 257 3.590 3.731 -0.141 1
1 318 . 18 1 1 A 27 27 VAL CA C 257 64.830 65.722 -0.892 1
1 319 . 18 1 1 A 27 27 VAL CB C 257 31.720 31.542 0.178 1
1 322 . 18 1 1 A 27 27 VAL N N 257 115.710 123.570 -7.860 1
1 323 . 18 1 1 A 28 28 ASP H H 258 8.240 8.036 0.204 1
1 324 . 18 1 1 A 28 28 ASP HA H 258 4.340 4.367 -0.027 1
1 327 . 18 1 1 A 28 28 ASP CA C 258 56.490 57.498 -1.008 1
1 328 . 18 1 1 A 28 28 ASP CB C 258 40.520 40.135 0.385 1
1 329 . 18 1 1 A 28 28 ASP N N 258 119.000 122.083 -3.083 1
1 330 . 18 1 1 A 29 29 ASP H H 259 8.000 8.754 -0.754 1
1 331 . 18 1 1 A 29 29 ASP HA H 259 4.390 4.600 -0.210 1
1 334 . 18 1 1 A 29 29 ASP CA C 259 56.210 55.551 0.659 1
1 335 . 18 1 1 A 29 29 ASP CB C 259 40.670 41.145 -0.475 1
1 336 . 18 1 1 A 29 29 ASP N N 259 118.900 117.405 1.495 1
1 337 . 18 1 1 A 30 30 LEU H H 260 7.760 7.472 0.288 1
1 338 . 18 1 1 A 30 30 LEU HA H 260 3.990 4.248 -0.258 1
1 348 . 18 1 1 A 30 30 LEU CA C 260 55.000 55.380 -0.380 1
1 349 . 18 1 1 A 30 30 LEU CB C 260 41.670 42.360 -0.690 1
1 353 . 18 1 1 A 30 30 LEU N N 260 116.300 121.404 -5.104 1
1 354 . 18 1 1 A 31 31 GLU H H 261 7.990 8.764 -0.774 1
1 355 . 18 1 1 A 31 31 GLU HA H 261 4.280 4.099 0.181 1
1 358 . 18 1 1 A 31 31 GLU CA C 261 56.860 59.027 -2.167 1
1 359 . 18 1 1 A 31 31 GLU CB C 261 27.010 29.493 -2.483 1
1 360 . 18 1 1 A 31 31 GLU N N 261 115.620 121.825 -6.205 1
1 361 . 18 1 1 A 32 32 LEU H H 262 8.000 7.380 0.620 1
1 362 . 18 1 1 A 32 32 LEU HA H 262 4.400 4.309 0.091 1
1 372 . 18 1 1 A 32 32 LEU CA C 262 53.860 54.892 -1.032 1
1 373 . 18 1 1 A 32 32 LEU CB C 262 44.450 42.158 2.292 1
1 377 . 18 1 1 A 32 32 LEU N N 262 118.860 122.177 -3.317 1
1 378 . 18 1 1 A 33 33 THR H H 263 10.020 8.674 1.346 1
1 379 . 18 1 1 A 33 33 THR HA H 263 4.130 4.693 -0.563 1
1 384 . 18 1 1 A 33 33 THR CA C 263 62.400 60.727 1.673 1
1 385 . 18 1 1 A 33 33 THR CB C 263 71.270 71.115 0.155 1
1 387 . 18 1 1 A 33 33 THR N N 263 114.610 114.056 0.554 1
1 388 . 18 1 1 A 34 34 VAL H H 264 8.370 8.833 -0.463 1
1 389 . 18 1 1 A 34 34 VAL HA H 264 3.620 3.649 -0.029 1
1 397 . 18 1 1 A 34 34 VAL CA C 264 66.340 66.990 -0.650 1
1 398 . 18 1 1 A 34 34 VAL CB C 264 31.670 31.605 0.065 1
1 401 . 18 1 1 A 34 34 VAL N N 264 122.110 122.555 -0.445 1
1 402 . 18 1 1 A 35 35 ARG H H 265 8.190 8.117 0.073 1
1 403 . 18 1 1 A 35 35 ARG HA H 265 4.070 3.935 0.135 1
1 411 . 18 1 1 A 35 35 ARG CA C 265 59.470 59.769 -0.299 1
1 412 . 18 1 1 A 35 35 ARG CB C 265 29.790 29.814 -0.024 1
1 415 . 18 1 1 A 35 35 ARG N N 265 117.340 120.945 -3.605 1
1 416 . 18 1 1 A 36 36 SER H H 266 7.610 8.084 -0.474 1
1 417 . 18 1 1 A 36 36 SER HA H 266 4.080 4.106 -0.026 1
1 420 . 18 1 1 A 36 36 SER CA C 266 63.080 61.968 1.112 1
1 421 . 18 1 1 A 36 36 SER CB C 266 63.280 62.877 0.403 1
1 422 . 18 1 1 A 36 36 SER N N 266 116.710 117.069 -0.359 1
1 423 . 18 1 1 A 37 37 ALA H H 267 8.720 7.941 0.779 1
1 424 . 18 1 1 A 37 37 ALA HA H 267 3.760 3.982 -0.222 1
1 428 . 18 1 1 A 37 37 ALA CA C 267 55.900 55.338 0.562 1
1 429 . 18 1 1 A 37 37 ALA CB C 267 18.090 18.149 -0.059 1
1 430 . 18 1 1 A 37 37 ALA N N 267 124.170 123.501 0.669 1
1 431 . 18 1 1 A 38 38 ASN H H 268 8.850 9.328 -0.478 1
1 432 . 18 1 1 A 38 38 ASN HA H 268 4.420 4.516 -0.096 1
1 437 . 18 1 1 A 38 38 ASN CA C 268 55.700 56.132 -0.432 1
1 438 . 18 1 1 A 38 38 ASN CB C 268 37.180 37.545 -0.365 1
1 439 . 18 1 1 A 38 38 ASN N N 268 117.370 117.382 -0.012 1
1 441 . 18 1 1 A 39 39 CYS H H 269 7.970 7.903 0.067 1
1 442 . 18 1 1 A 39 39 CYS HA H 269 4.190 4.101 0.089 1
1 445 . 18 1 1 A 39 39 CYS CA C 269 63.340 62.776 0.564 1
1 446 . 18 1 1 A 39 39 CYS CB C 269 26.870 27.878 -1.008 1
1 447 . 18 1 1 A 39 39 CYS N N 269 120.510 118.810 1.700 1
1 448 . 18 1 1 A 40 40 LEU H H 270 7.600 7.747 -0.147 1
1 449 . 18 1 1 A 40 40 LEU HA H 270 3.880 3.880 0.000 1
1 458 . 18 1 1 A 40 40 LEU CA C 270 57.810 58.109 -0.299 1
1 459 . 18 1 1 A 40 40 LEU CB C 270 40.030 41.530 -1.500 1
1 462 . 18 1 1 A 40 40 LEU N N 270 117.710 120.497 -2.787 1
1 463 . 18 1 1 A 41 41 LYS H H 271 7.980 8.590 -0.610 1
1 464 . 18 1 1 A 41 41 LYS HA H 271 3.820 4.217 -0.397 1
1 472 . 18 1 1 A 41 41 LYS CA C 271 59.840 58.934 0.906 1
1 473 . 18 1 1 A 41 41 LYS CB C 271 32.070 32.150 -0.080 1
1 476 . 18 1 1 A 41 41 LYS N N 271 120.070 120.100 -0.030 1
1 477 . 18 1 1 A 42 42 ALA H H 272 7.860 7.823 0.037 1
1 478 . 18 1 1 A 42 42 ALA HA H 272 4.140 4.154 -0.014 1
1 482 . 18 1 1 A 42 42 ALA CA C 272 54.670 54.039 0.631 1
1 483 . 18 1 1 A 42 42 ALA CB C 272 17.950 18.234 -0.284 1
1 484 . 18 1 1 A 42 42 ALA N N 272 122.880 121.275 1.605 1
1 485 . 18 1 1 A 43 43 GLU H H 273 7.210 8.464 -1.254 1
1 486 . 18 1 1 A 43 43 GLU HA H 273 4.260 4.465 -0.205 1
1 491 . 18 1 1 A 43 43 GLU CA C 273 55.020 55.316 -0.296 1
1 492 . 18 1 1 A 43 43 GLU CB C 273 29.880 29.694 0.186 1
1 494 . 18 1 1 A 43 43 GLU N N 273 116.590 117.712 -1.122 1
1 495 . 18 1 1 A 44 44 ALA H H 274 7.880 7.897 -0.017 1
1 496 . 18 1 1 A 44 44 ALA HA H 274 3.680 3.855 -0.175 1
1 500 . 18 1 1 A 44 44 ALA CA C 274 52.960 53.070 -0.110 1
1 501 . 18 1 1 A 44 44 ALA CB C 274 16.110 17.464 -1.354 1
1 502 . 18 1 1 A 44 44 ALA N N 274 118.420 119.746 -1.326 1
1 503 . 18 1 1 A 45 45 ILE H H 275 7.600 7.455 0.145 1
1 504 . 18 1 1 A 45 45 ILE HA H 275 3.870 4.150 -0.280 1
1 514 . 18 1 1 A 45 45 ILE CA C 275 61.150 60.187 0.963 1
1 515 . 18 1 1 A 45 45 ILE CB C 275 37.090 38.770 -1.680 1
1 519 . 18 1 1 A 45 45 ILE N N 275 120.370 118.085 2.285 1
1 520 . 18 1 1 A 46 46 HIS H H 276 8.350 8.776 -0.426 1
1 521 . 18 1 1 A 46 46 HIS HA H 276 4.600 4.810 -0.210 1
1 526 . 18 1 1 A 46 46 HIS CA C 276 56.900 56.863 0.037 1
1 527 . 18 1 1 A 46 46 HIS CB C 276 31.910 31.097 0.813 1
1 529 . 18 1 1 A 46 46 HIS N N 276 123.250 125.761 -2.511 1
1 530 . 18 1 1 A 47 47 TYR H H 277 8.850 7.946 0.904 1
1 531 . 18 1 1 A 47 47 TYR HA H 277 5.100 4.847 0.253 1
1 538 . 18 1 1 A 47 47 TYR CA C 277 57.430 56.321 1.109 1
1 539 . 18 1 1 A 47 47 TYR CB C 277 40.680 40.590 0.090 1
1 544 . 18 1 1 A 47 47 TYR N N 277 119.700 117.857 1.843 1
1 545 . 18 1 1 A 48 48 ILE H H 278 9.380 8.471 0.909 1
1 546 . 18 1 1 A 48 48 ILE HA H 278 3.340 3.652 -0.312 1
1 554 . 18 1 1 A 48 48 ILE CA C 278 67.640 65.118 2.522 1
1 555 . 18 1 1 A 48 48 ILE CB C 278 36.310 37.638 -1.328 1
1 558 . 18 1 1 A 48 48 ILE N N 278 125.650 124.970 0.680 1
1 559 . 18 1 1 A 49 49 GLY H H 279 9.430 7.843 1.587 1
1 560 . 18 1 1 A 49 49 GLY HA2 H 279 2.370 2.567 -0.197 1
1 561 . 18 1 1 A 49 49 GLY HA3 H 279 3.230 3.730 -0.500 1
1 562 . 18 1 1 A 49 49 GLY CA C 279 46.820 47.025 -0.205 1
1 563 . 18 1 1 A 49 49 GLY N N 279 105.200 108.629 -3.429 1
1 564 . 18 1 1 A 50 50 ASP H H 280 7.050 7.352 -0.302 1
1 565 . 18 1 1 A 50 50 ASP HA H 280 4.360 4.132 0.228 1
1 568 . 18 1 1 A 50 50 ASP CA C 280 57.110 56.203 0.907 1
1 569 . 18 1 1 A 50 50 ASP CB C 280 42.620 40.507 2.113 1
1 570 . 18 1 1 A 50 50 ASP N N 280 116.360 121.012 -4.652 1
1 571 . 18 1 1 A 51 51 LEU H H 281 7.170 8.175 -1.005 1
1 572 . 18 1 1 A 51 51 LEU HA H 281 3.880 3.967 -0.087 1
1 582 . 18 1 1 A 51 51 LEU CA C 281 57.900 58.283 -0.383 1
1 583 . 18 1 1 A 51 51 LEU CB C 281 41.870 41.447 0.423 1
1 587 . 18 1 1 A 51 51 LEU N N 281 120.130 121.838 -1.708 1
1 588 . 18 1 1 A 52 52 VAL H H 282 7.820 7.643 0.177 1
1 589 . 18 1 1 A 52 52 VAL HA H 282 3.980 3.896 0.084 1
1 597 . 18 1 1 A 52 52 VAL CA C 282 64.000 65.570 -1.570 1
1 598 . 18 1 1 A 52 52 VAL CB C 282 30.400 31.331 -0.931 1
1 601 . 18 1 1 A 52 52 VAL N N 282 105.550 115.476 -9.926 1
1 602 . 18 1 1 A 53 53 GLN H H 283 6.550 7.756 -1.206 1
1 603 . 18 1 1 A 53 53 GLN HA H 283 4.680 4.158 0.522 1
1 610 . 18 1 1 A 53 53 GLN CA C 283 56.210 58.804 -2.594 1
1 611 . 18 1 1 A 53 53 GLN CB C 283 31.710 28.394 3.316 1
1 613 . 18 1 1 A 53 53 GLN N N 283 114.060 119.706 -5.646 1
1 615 . 18 1 1 A 54 54 ARG H H 284 7.690 7.517 0.173 1
1 616 . 18 1 1 A 54 54 ARG HA H 284 4.520 4.709 -0.189 1
1 624 . 18 1 1 A 54 54 ARG CA C 284 54.600 54.633 -0.033 1
1 625 . 18 1 1 A 54 54 ARG CB C 284 30.750 31.378 -0.628 1
1 628 . 18 1 1 A 54 54 ARG N N 284 119.810 117.086 2.724 1
1 629 . 18 1 1 A 55 55 THR H H 285 8.110 8.760 -0.650 1
1 630 . 18 1 1 A 55 55 THR HA H 285 4.430 4.390 0.040 1
1 635 . 18 1 1 A 55 55 THR CA C 285 59.640 63.599 -3.959 1
1 636 . 18 1 1 A 55 55 THR CB C 285 71.310 69.294 2.016 1
1 638 . 18 1 1 A 55 55 THR N N 285 108.450 117.767 -9.317 1
1 639 . 18 1 1 A 56 56 GLU H H 286 8.910 8.987 -0.077 1
1 640 . 18 1 1 A 56 56 GLU HA H 286 3.660 3.939 -0.279 1
1 645 . 18 1 1 A 56 56 GLU CA C 286 60.650 59.804 0.846 1
1 646 . 18 1 1 A 56 56 GLU CB C 286 29.400 29.222 0.178 1
1 648 . 18 1 1 A 56 56 GLU N N 286 120.600 126.570 -5.970 1
1 649 . 18 1 1 A 57 57 VAL H H 287 7.600 8.164 -0.564 1
1 650 . 18 1 1 A 57 57 VAL HA H 287 3.620 3.525 0.095 1
1 658 . 18 1 1 A 57 57 VAL CA C 287 66.020 67.185 -1.165 1
1 659 . 18 1 1 A 57 57 VAL CB C 287 31.720 31.569 0.151 1
1 662 . 18 1 1 A 57 57 VAL N N 287 114.050 119.960 -5.910 1
1 663 . 18 1 1 A 58 58 GLU H H 288 7.350 8.179 -0.829 1
1 664 . 18 1 1 A 58 58 GLU HA H 288 3.830 4.065 -0.235 1
1 669 . 18 1 1 A 58 58 GLU CA C 288 59.250 59.650 -0.400 1
1 670 . 18 1 1 A 58 58 GLU CB C 288 30.030 29.141 0.889 1
1 672 . 18 1 1 A 58 58 GLU N N 288 117.610 119.159 -1.549 1
1 673 . 18 1 1 A 59 59 LEU H H 289 7.850 7.969 -0.119 1
1 674 . 18 1 1 A 59 59 LEU HA H 289 4.150 3.960 0.190 1
1 683 . 18 1 1 A 59 59 LEU CA C 289 57.340 57.731 -0.391 1
1 684 . 18 1 1 A 59 59 LEU CB C 289 41.170 41.533 -0.363 1
1 687 . 18 1 1 A 59 59 LEU N N 289 120.050 120.448 -0.398 1
1 688 . 18 1 1 A 60 60 LEU H H 290 7.670 7.853 -0.183 1
1 689 . 18 1 1 A 60 60 LEU HA H 290 4.540 3.957 0.583 1
1 696 . 18 1 1 A 60 60 LEU CA C 290 55.090 58.147 -3.057 1
1 697 . 18 1 1 A 60 60 LEU CB C 290 42.320 41.580 0.740 1
1 701 . 18 1 1 A 60 60 LEU N N 290 114.980 119.805 -4.825 1
1 702 . 18 1 1 A 61 61 LYS H H 291 7.440 7.445 -0.005 1
1 703 . 18 1 1 A 61 61 LYS HA H 291 4.280 4.290 -0.010 1
1 710 . 18 1 1 A 61 61 LYS CA C 291 56.860 57.549 -0.689 1
1 711 . 18 1 1 A 61 61 LYS CB C 291 31.900 32.981 -1.081 1
1 714 . 18 1 1 A 61 61 LYS N N 291 118.120 118.108 0.012 1
1 715 . 18 1 1 A 62 62 THR H H 292 7.310 7.599 -0.289 1
1 716 . 18 1 1 A 62 62 THR HA H 292 5.220 4.428 0.792 1
1 721 . 18 1 1 A 62 62 THR CA C 292 55.830 60.429 -4.599 1
1 722 . 18 1 1 A 62 62 THR CB C 292 69.970 68.866 1.104 1
1 724 . 18 1 1 A 62 62 THR N N 292 111.890 115.241 -3.351 1
1 725 . 18 1 1 A 63 63 PRO HA H 293 4.570 4.446 0.124 1
1 730 . 18 1 1 A 63 63 PRO CA C 293 63.710 64.284 -0.574 1
1 731 . 18 1 1 A 63 63 PRO CB C 293 32.380 31.910 0.470 1
1 733 . 18 1 1 A 64 64 ASN H H 294 8.050 8.845 -0.795 1
1 734 . 18 1 1 A 64 64 ASN HA H 294 4.490 4.468 0.022 1
1 739 . 18 1 1 A 64 64 ASN CA C 294 55.630 55.282 0.348 1
1 740 . 18 1 1 A 64 64 ASN CB C 294 38.730 38.093 0.637 1
1 741 . 18 1 1 A 64 64 ASN N N 294 117.120 116.942 0.178 1
1 743 . 18 1 1 A 65 65 LEU H H 295 7.550 7.410 0.140 1
1 744 . 18 1 1 A 65 65 LEU HA H 295 4.640 4.575 0.065 1
1 754 . 18 1 1 A 65 65 LEU CA C 295 54.310 53.332 0.978 1
1 755 . 18 1 1 A 65 65 LEU CB C 295 43.640 42.592 1.048 1
1 758 . 18 1 1 A 65 65 LEU N N 295 119.930 118.747 1.183 1
1 759 . 18 1 1 A 66 66 GLY H H 296 7.850 8.609 -0.759 1
1 760 . 18 1 1 A 66 66 GLY HA2 H 296 3.810 4.067 -0.257 1
1 761 . 18 1 1 A 66 66 GLY HA3 H 296 4.110 4.067 0.043 1
1 762 . 18 1 1 A 66 66 GLY CA C 296 43.570 45.139 -1.569 1
1 763 . 18 1 1 A 66 66 GLY N N 296 108.840 111.322 -2.482 1
1 764 . 18 1 1 A 67 67 LYS H H 297 8.820 8.619 0.201 1
1 765 . 18 1 1 A 67 67 LYS HA H 297 3.980 3.900 0.080 1
1 774 . 18 1 1 A 67 67 LYS CA C 297 60.100 59.577 0.523 1
1 775 . 18 1 1 A 67 67 LYS CB C 297 32.100 32.222 -0.122 1
1 779 . 18 1 1 A 67 67 LYS N N 297 120.130 120.961 -0.831 1
1 780 . 18 1 1 A 68 68 LYS H H 298 8.850 7.899 0.951 1
1 781 . 18 1 1 A 68 68 LYS HA H 298 4.060 4.050 0.010 1
1 790 . 18 1 1 A 68 68 LYS CA C 298 60.600 59.092 1.508 1
1 791 . 18 1 1 A 68 68 LYS CB C 298 31.920 31.980 -0.060 1
1 795 . 18 1 1 A 68 68 LYS N N 298 119.580 119.449 0.131 1
1 796 . 18 1 1 A 69 69 SER H H 299 8.100 8.336 -0.236 1
1 797 . 18 1 1 A 69 69 SER HA H 299 4.370 4.172 0.198 1
1 800 . 18 1 1 A 69 69 SER CA C 299 61.980 61.432 0.548 1
1 801 . 18 1 1 A 69 69 SER CB C 299 63.000 62.378 0.622 1
1 802 . 18 1 1 A 69 69 SER N N 299 116.360 115.511 0.849 1
1 803 . 18 1 1 A 70 70 LEU H H 300 8.240 8.009 0.231 1
1 804 . 18 1 1 A 70 70 LEU HA H 300 3.970 4.071 -0.101 1
1 814 . 18 1 1 A 70 70 LEU CA C 300 57.610 57.875 -0.265 1
1 815 . 18 1 1 A 70 70 LEU CB C 300 41.060 41.623 -0.563 1
1 819 . 18 1 1 A 70 70 LEU N N 300 123.330 123.765 -0.435 1
1 820 . 18 1 1 A 71 71 THR H H 301 8.550 7.608 0.942 1
1 821 . 18 1 1 A 71 71 THR HA H 301 3.690 3.802 -0.112 1
1 826 . 18 1 1 A 71 71 THR CA C 301 67.170 66.635 0.535 1
1 827 . 18 1 1 A 71 71 THR CB C 301 68.810 68.564 0.246 1
1 829 . 18 1 1 A 71 71 THR N N 301 116.520 114.571 1.949 1
1 830 . 18 1 1 A 72 72 GLU H H 302 7.520 8.208 -0.688 1
1 831 . 18 1 1 A 72 72 GLU HA H 302 4.070 3.986 0.084 1
1 836 . 18 1 1 A 72 72 GLU CA C 302 59.470 59.535 -0.065 1
1 837 . 18 1 1 A 72 72 GLU CB C 302 29.090 29.275 -0.185 1
1 839 . 18 1 1 A 72 72 GLU N N 302 121.510 119.206 2.304 1
1 840 . 18 1 1 A 73 73 ILE H H 303 8.290 7.960 0.330 1
1 841 . 18 1 1 A 73 73 ILE HA H 303 3.380 3.669 -0.289 1
1 849 . 18 1 1 A 73 73 ILE CA C 303 66.010 65.747 0.263 1
1 850 . 18 1 1 A 73 73 ILE CB C 303 38.680 37.569 1.111 1
1 853 . 18 1 1 A 73 73 ILE N N 303 118.510 120.889 -2.379 1
1 854 . 18 1 1 A 74 74 LYS H H 304 8.550 7.990 0.560 1
1 855 . 18 1 1 A 74 74 LYS HA H 304 3.680 3.959 -0.279 1
1 864 . 18 1 1 A 74 74 LYS CA C 304 61.320 60.186 1.134 1
1 865 . 18 1 1 A 74 74 LYS CB C 304 32.060 32.083 -0.023 1
1 868 . 18 1 1 A 74 74 LYS N N 304 118.220 119.499 -1.279 1
1 869 . 18 1 1 A 75 75 ASP H H 305 8.450 7.840 0.610 1
1 870 . 18 1 1 A 75 75 ASP HA H 305 4.440 4.441 -0.001 1
1 873 . 18 1 1 A 75 75 ASP CA C 305 57.690 57.140 0.550 1
1 874 . 18 1 1 A 75 75 ASP CB C 305 40.220 40.925 -0.705 1
1 875 . 18 1 1 A 75 75 ASP N N 305 121.790 119.716 2.074 1
1 876 . 18 1 1 A 76 76 VAL H H 306 8.680 7.766 0.914 1
1 877 . 18 1 1 A 76 76 VAL HA H 306 3.890 3.628 0.262 1
1 885 . 18 1 1 A 76 76 VAL CA C 306 66.020 66.370 -0.350 1
1 886 . 18 1 1 A 76 76 VAL CB C 306 31.250 31.492 -0.242 1
1 889 . 18 1 1 A 76 76 VAL N N 306 121.150 119.501 1.649 1
1 890 . 18 1 1 A 77 77 LEU H H 307 8.470 9.145 -0.675 1
1 891 . 18 1 1 A 77 77 LEU HA H 307 3.810 4.011 -0.201 1
1 901 . 18 1 1 A 77 77 LEU CA C 307 58.330 57.576 0.754 1
1 902 . 18 1 1 A 77 77 LEU CB C 307 41.250 41.261 -0.011 1
1 906 . 18 1 1 A 77 77 LEU N N 307 120.830 120.267 0.563 1
1 907 . 18 1 1 A 78 78 ALA H H 308 8.280 8.221 0.059 1
1 908 . 18 1 1 A 78 78 ALA HA H 308 4.320 4.107 0.213 1
1 912 . 18 1 1 A 78 78 ALA CA C 308 55.420 55.057 0.363 1
1 913 . 18 1 1 A 78 78 ALA CB C 308 17.750 18.255 -0.505 1
1 914 . 18 1 1 A 78 78 ALA N N 308 122.530 121.351 1.179 1
1 915 . 18 1 1 A 79 79 SER H H 309 7.900 7.762 0.138 1
1 916 . 18 1 1 A 79 79 SER HA H 309 4.340 4.464 -0.124 1
1 919 . 18 1 1 A 79 79 SER CA C 309 61.350 58.642 2.708 1
1 920 . 18 1 1 A 79 79 SER CB C 309 63.280 63.599 -0.319 1
1 921 . 18 1 1 A 79 79 SER N N 309 115.600 112.964 2.636 1
1 922 . 18 1 1 A 80 80 ARG H H 310 7.450 8.253 -0.803 1
1 923 . 18 1 1 A 80 80 ARG HA H 310 4.550 4.032 0.518 1
1 931 . 18 1 1 A 80 80 ARG CA C 310 54.200 57.325 -3.125 1
1 932 . 18 1 1 A 80 80 ARG CB C 310 30.680 27.340 3.340 1
1 935 . 18 1 1 A 80 80 ARG N N 310 119.360 117.960 1.400 1
1 936 . 18 1 1 A 81 81 GLY H H 311 7.940 8.264 -0.324 1
1 937 . 18 1 1 A 81 81 GLY HA2 H 311 3.840 3.981 -0.141 1
1 938 . 18 1 1 A 81 81 GLY HA3 H 311 4.070 3.984 0.086 1
1 939 . 18 1 1 A 81 81 GLY CA C 311 46.060 45.372 0.688 1
1 940 . 18 1 1 A 81 81 GLY N N 311 108.130 106.413 1.717 1
1 941 . 18 1 1 A 82 82 LEU H H 312 7.920 7.705 0.215 1
1 942 . 18 1 1 A 82 82 LEU HA H 312 4.680 4.727 -0.047 1
1 952 . 18 1 1 A 82 82 LEU CA C 312 53.070 53.160 -0.090 1
1 953 . 18 1 1 A 82 82 LEU CB C 312 45.790 45.151 0.639 1
1 957 . 18 1 1 A 82 82 LEU N N 312 119.290 120.909 -1.619 1
1 958 . 18 1 1 A 83 83 SER H H 313 7.530 8.837 -1.307 1
1 959 . 18 1 1 A 83 83 SER HA H 313 4.450 4.105 0.345 1
1 962 . 18 1 1 A 83 83 SER CA C 313 57.190 58.740 -1.550 1
1 963 . 18 1 1 A 83 83 SER CB C 313 66.080 61.794 4.286 1
1 964 . 18 1 1 A 83 83 SER N N 313 113.120 116.962 -3.842 1
1 965 . 18 1 1 A 84 84 LEU H H 314 8.340 8.463 -0.123 1
1 966 . 18 1 1 A 84 84 LEU HA H 314 4.620 4.452 0.168 1
1 976 . 18 1 1 A 84 84 LEU CA C 314 54.720 54.654 0.066 1
1 977 . 18 1 1 A 84 84 LEU CB C 314 41.620 42.364 -0.744 1
1 981 . 18 1 1 A 84 84 LEU N N 314 115.930 119.687 -3.757 1
1 982 . 18 1 1 A 85 85 GLY H H 315 8.270 7.955 0.315 1
1 983 . 18 1 1 A 85 85 GLY HA2 H 315 3.320 3.970 -0.650 1
1 984 . 18 1 1 A 85 85 GLY HA3 H 315 3.850 3.971 -0.121 1
1 985 . 18 1 1 A 85 85 GLY CA C 315 46.560 46.296 0.264 1
1 986 . 18 1 1 A 85 85 GLY N N 315 111.010 108.127 2.883 1
1 987 . 18 1 1 A 86 86 MET H H 316 8.650 7.938 0.712 1
1 988 . 18 1 1 A 86 86 MET HA H 316 3.990 4.996 -1.006 1
1 996 . 18 1 1 A 86 86 MET CA C 316 56.730 53.592 3.138 1
1 997 . 18 1 1 A 86 86 MET CB C 316 33.600 35.352 -1.752 1
1 1000 . 18 1 1 A 86 86 MET N N 316 120.570 117.924 2.646 1
1 1001 . 18 1 1 A 87 87 ARG H H 317 8.360 8.724 -0.364 1
1 1002 . 18 1 1 A 87 87 ARG HA H 317 4.450 5.139 -0.689 1
1 1010 . 18 1 1 A 87 87 ARG CA C 317 55.310 54.595 0.715 1
1 1011 . 18 1 1 A 87 87 ARG CB C 317 30.490 33.977 -3.487 1
1 1014 . 18 1 1 A 87 87 ARG N N 317 122.290 119.364 2.926 1
1 1015 . 18 1 1 A 88 88 LEU H H 318 8.400 8.790 -0.390 1
1 1016 . 18 1 1 A 88 88 LEU HA H 318 4.670 4.997 -0.327 1
1 1026 . 18 1 1 A 88 88 LEU CA C 318 53.110 53.138 -0.028 1
1 1027 . 18 1 1 A 88 88 LEU CB C 318 43.600 45.087 -1.487 1
1 1031 . 18 1 1 A 88 88 LEU N N 318 126.420 122.825 3.595 1
1 1032 . 18 1 1 A 89 89 GLU H H 319 8.780 9.084 -0.304 1
1 1033 . 18 1 1 A 89 89 GLU HA H 319 4.340 4.048 0.292 1
1 1038 . 18 1 1 A 89 89 GLU CA C 319 56.490 59.374 -2.884 1
1 1039 . 18 1 1 A 89 89 GLU CB C 319 30.470 29.565 0.905 1
1 1041 . 18 1 1 A 89 89 GLU N N 319 123.070 123.765 -0.695 1
1 1042 . 18 1 1 A 90 90 ASN H H 320 8.900 8.225 0.675 1
1 1043 . 18 1 1 A 90 90 ASN HA H 320 4.410 4.988 -0.578 1
1 1048 . 18 1 1 A 90 90 ASN CA C 320 54.120 54.349 -0.229 1
1 1049 . 18 1 1 A 90 90 ASN CB C 320 37.640 40.002 -2.362 1
1 1050 . 18 1 1 A 90 90 ASN N N 320 116.540 114.497 2.043 1
1 1052 . 18 1 1 A 91 91 TRP H H 321 7.990 7.387 0.603 1
1 1053 . 18 1 1 A 91 91 TRP HA H 321 4.330 4.658 -0.328 1
1 1062 . 18 1 1 A 91 91 TRP CA C 321 54.590 58.313 -3.723 1
1 1063 . 18 1 1 A 91 91 TRP CB C 321 31.280 31.099 0.181 1
1 1069 . 18 1 1 A 91 91 TRP N N 321 119.230 114.592 4.638 1
1 1071 . 18 1 1 A 92 92 PRO HA H 322 4.800 3.829 0.971 1
1 1077 . 18 1 1 A 93 93 PRO HA H 323 4.450 4.454 -0.004 1
1 1084 . 18 1 1 A 93 93 PRO CA C 323 61.970 62.310 -0.340 1
1 1085 . 18 1 1 A 93 93 PRO CB C 323 32.830 32.389 0.441 1
1 1088 . 18 1 1 A 94 94 ALA H H 324 8.460 8.771 -0.311 1
1 1089 . 18 1 1 A 94 94 ALA HA H 324 4.000 4.030 -0.030 1
1 1093 . 18 1 1 A 94 94 ALA CA C 324 53.790 54.813 -1.023 1
1 1094 . 18 1 1 A 94 94 ALA CB C 324 18.640 18.169 0.471 1
1 1095 . 18 1 1 A 94 94 ALA N N 324 124.010 126.221 -2.211 1
1 1096 . 18 1 1 A 95 95 SER H H 325 7.950 8.129 -0.179 1
1 1097 . 18 1 1 A 95 95 SER HA H 325 4.210 4.222 -0.012 1
1 1100 . 18 1 1 A 95 95 SER CA C 325 58.970 62.044 -3.074 1
1 1101 . 18 1 1 A 95 95 SER CB C 325 63.040 63.218 -0.178 1
1 1102 . 18 1 1 A 95 95 SER N N 325 111.520 115.030 -3.510 1
1 1103 . 18 1 1 A 96 96 ILE H H 326 7.480 7.631 -0.151 1
1 1104 . 18 1 1 A 96 96 ILE HA H 326 4.170 3.910 0.260 1
1 1114 . 18 1 1 A 96 96 ILE CA C 326 61.300 63.267 -1.967 1
1 1115 . 18 1 1 A 96 96 ILE CB C 326 38.530 37.636 0.894 1
1 1119 . 18 1 1 A 96 96 ILE N N 326 119.650 121.546 -1.896 1
1 1120 . 18 1 1 A 97 97 ALA H H 327 7.860 7.405 0.455 1
1 1121 . 18 1 1 A 97 97 ALA HA H 327 4.230 4.229 0.001 1
1 1125 . 18 1 1 A 97 97 ALA CA C 327 52.570 52.110 0.460 1
1 1126 . 18 1 1 A 97 97 ALA CB C 327 19.590 19.637 -0.047 1
1 1127 . 18 1 1 A 97 97 ALA N N 327 126.480 124.643 1.837 1
1 1128 . 18 1 1 A 98 98 ASP H H 328 8.250 8.832 -0.582 1
1 1129 . 18 1 1 A 98 98 ASP HA H 328 4.540 4.300 0.240 1
1 1132 . 18 1 1 A 98 98 ASP CA C 328 54.150 57.509 -3.359 1
1 1133 . 18 1 1 A 98 98 ASP CB C 328 41.120 40.857 0.263 1
1 1134 . 18 1 1 A 98 98 ASP N N 328 120.130 122.863 -2.733 1
1 1150 . 18 2 2 B 6 6 ASP H H 427 8.160 8.736 -0.576 1
1 1151 . 18 2 2 B 6 6 ASP HA H 427 4.630 4.343 0.287 1
1 1154 . 18 2 2 B 6 6 ASP CA C 427 54.410 56.937 -2.527 1
1 1155 . 18 2 2 B 6 6 ASP CB C 427 41.250 40.726 0.524 1
1 1156 . 18 2 2 B 6 6 ASP N N 427 120.160 120.016 0.144 1
1 1157 . 18 2 2 B 7 7 ASN H H 428 8.350 8.025 0.325 1
1 1158 . 18 2 2 B 7 7 ASN HA H 428 4.550 4.281 0.269 1
1 1163 . 18 2 2 B 7 7 ASN CA C 428 53.310 54.344 -1.034 1
1 1164 . 18 2 2 B 7 7 ASN CB C 428 38.850 36.906 1.944 1
1 1165 . 18 2 2 B 7 7 ASN N N 428 118.440 114.573 3.867 1
1 1167 . 18 2 2 B 8 8 LYS H H 429 8.030 7.861 0.169 1
1 1172 . 18 2 2 B 8 8 LYS CB C 429 33.280 32.951 0.329 1
1 1174 . 18 2 2 B 8 8 LYS N N 429 120.260 119.655 0.605 1
1 1175 . 18 2 2 B 9 9 PRO HA H 430 4.420 4.397 0.023 1
1 1182 . 18 2 2 B 9 9 PRO CA C 430 62.280 62.492 -0.212 1
1 1183 . 18 2 2 B 9 9 PRO CB C 430 31.920 32.118 -0.198 1
1 1186 . 18 2 2 B 10 10 ALA H H 431 8.930 9.199 -0.269 1
1 1187 . 18 2 2 B 10 10 ALA HA H 431 4.350 4.427 -0.077 1
1 1191 . 18 2 2 B 10 10 ALA CA C 431 51.070 51.820 -0.750 1
1 1192 . 18 2 2 B 10 10 ALA CB C 431 20.920 19.663 1.257 1
1 1193 . 18 2 2 B 10 10 ALA N N 431 125.000 124.795 0.205 1
1 1194 . 18 2 2 B 11 11 ASP H H 432 8.530 9.052 -0.522 1
1 1195 . 18 2 2 B 11 11 ASP HA H 432 4.220 4.219 0.001 1
1 1198 . 18 2 2 B 11 11 ASP CA C 432 57.520 57.511 0.009 1
1 1199 . 18 2 2 B 11 11 ASP CB C 432 40.470 40.497 -0.027 1
1 1200 . 18 2 2 B 11 11 ASP N N 432 119.610 121.962 -2.352 1
1 1201 . 18 2 2 B 12 12 ASP H H 433 8.340 8.038 0.302 1
1 1202 . 18 2 2 B 12 12 ASP HA H 433 4.160 4.462 -0.302 1
1 1205 . 18 2 2 B 12 12 ASP CA C 433 56.090 57.386 -1.296 1
1 1206 . 18 2 2 B 12 12 ASP CB C 433 38.960 40.480 -1.520 1
1 1207 . 18 2 2 B 12 12 ASP N N 433 116.330 117.947 -1.617 1
1 1208 . 18 2 2 B 13 13 LEU H H 434 7.360 7.671 -0.311 1
1 1209 . 18 2 2 B 13 13 LEU HA H 434 4.050 4.074 -0.024 1
1 1219 . 18 2 2 B 13 13 LEU CA C 434 57.340 57.620 -0.280 1
1 1220 . 18 2 2 B 13 13 LEU CB C 434 42.960 41.527 1.433 1
1 1224 . 18 2 2 B 13 13 LEU N N 434 123.440 120.660 2.780 1
1 1225 . 18 2 2 B 14 14 LEU H H 435 7.670 7.648 0.022 1
1 1226 . 18 2 2 B 14 14 LEU HA H 435 3.710 4.055 -0.345 1
1 1236 . 18 2 2 B 14 14 LEU CA C 435 57.170 56.931 0.239 1
1 1237 . 18 2 2 B 14 14 LEU CB C 435 42.590 42.197 0.393 1
1 1241 . 18 2 2 B 14 14 LEU N N 435 115.170 119.599 -4.429 1
1 1242 . 18 2 2 B 15 15 ASN H H 436 7.490 8.475 -0.985 1
1 1243 . 18 2 2 B 15 15 ASN HA H 436 4.640 4.695 -0.055 1
1 1248 . 18 2 2 B 15 15 ASN CA C 436 52.920 53.153 -0.233 1
1 1249 . 18 2 2 B 15 15 ASN CB C 436 39.350 37.307 2.043 1
1 1250 . 18 2 2 B 15 15 ASN N N 436 112.280 114.546 -2.266 1
1 1252 . 18 2 2 B 16 16 LEU H H 437 7.300 7.395 -0.095 1
1 1253 . 18 2 2 B 16 16 LEU HA H 437 4.100 4.286 -0.186 1
1 1263 . 18 2 2 B 16 16 LEU CA C 437 55.310 55.006 0.304 1
1 1264 . 18 2 2 B 16 16 LEU CB C 437 41.800 42.971 -1.171 1
1 1268 . 18 2 2 B 16 16 LEU N N 437 125.180 123.074 2.106 1
1 1269 . 18 2 2 B 17 17 GLU H H 438 8.590 8.772 -0.182 1
1 1270 . 18 2 2 B 17 17 GLU HA H 438 3.920 3.966 -0.046 1
1 1275 . 18 2 2 B 17 17 GLU CA C 438 58.440 58.240 0.200 1
1 1276 . 18 2 2 B 17 17 GLU CB C 438 29.180 29.527 -0.347 1
1 1278 . 18 2 2 B 17 17 GLU N N 438 129.850 125.776 4.074 1
1 1279 . 18 2 2 B 18 18 GLY H H 439 8.580 8.949 -0.369 1
1 1280 . 18 2 2 B 18 18 GLY HA2 H 439 3.570 3.954 -0.384 1
1 1281 . 18 2 2 B 18 18 GLY HA3 H 439 4.220 3.954 0.266 1
1 1282 . 18 2 2 B 18 18 GLY CA C 439 44.710 45.465 -0.755 1
1 1283 . 18 2 2 B 18 18 GLY N N 439 112.250 114.795 -2.545 1
1 1284 . 18 2 2 B 19 19 VAL H H 440 7.900 7.352 0.548 1
1 1285 . 18 2 2 B 19 19 VAL HA H 440 3.950 4.493 -0.543 1
1 1293 . 18 2 2 B 19 19 VAL CA C 440 62.820 61.039 1.781 1
1 1294 . 18 2 2 B 19 19 VAL CB C 440 31.470 34.739 -3.269 1
1 1297 . 18 2 2 B 19 19 VAL N N 440 121.910 121.906 0.004 1
1 1298 . 18 2 2 B 20 20 ASP H H 441 7.390 8.909 -1.519 1
1 1299 . 18 2 2 B 20 20 ASP HA H 441 4.820 4.941 -0.121 1
1 1302 . 18 2 2 B 20 20 ASP CA C 441 51.920 53.138 -1.218 1
1 1303 . 18 2 2 B 20 20 ASP CB C 441 42.090 42.610 -0.520 1
1 1304 . 18 2 2 B 20 20 ASP N N 441 124.850 126.583 -1.733 1
1 1305 . 18 2 2 B 21 21 ARG H H 442 8.630 8.935 -0.305 1
1 1306 . 18 2 2 B 21 21 ARG HA H 442 3.810 3.809 0.001 1
1 1313 . 18 2 2 B 21 21 ARG CA C 442 60.710 60.186 0.524 1
1 1314 . 18 2 2 B 21 21 ARG CB C 442 30.020 30.230 -0.210 1
1 1317 . 18 2 2 B 21 21 ARG N N 442 120.890 122.788 -1.898 1
1 1318 . 18 2 2 B 22 22 ASP H H 443 8.140 8.165 -0.025 1
1 1319 . 18 2 2 B 22 22 ASP HA H 443 4.420 4.714 -0.294 1
1 1322 . 18 2 2 B 22 22 ASP CA C 443 57.680 57.420 0.260 1
1 1323 . 18 2 2 B 22 22 ASP CB C 443 40.880 40.950 -0.070 1
1 1324 . 18 2 2 B 22 22 ASP N N 443 116.750 120.073 -3.323 1
1 1325 . 18 2 2 B 23 23 LEU H H 444 8.170 8.048 0.122 1
1 1326 . 18 2 2 B 23 23 LEU HA H 444 4.130 4.142 -0.012 1
1 1336 . 18 2 2 B 23 23 LEU CA C 444 57.770 57.956 -0.186 1
1 1337 . 18 2 2 B 23 23 LEU CB C 444 41.230 41.138 0.092 1
1 1341 . 18 2 2 B 23 23 LEU N N 444 122.130 121.631 0.499 1
1 1342 . 18 2 2 B 24 24 ALA H H 445 8.630 8.769 -0.139 1
1 1343 . 18 2 2 B 24 24 ALA HA H 445 3.790 4.002 -0.212 1
1 1347 . 18 2 2 B 24 24 ALA CA C 445 55.810 54.883 0.927 1
1 1348 . 18 2 2 B 24 24 ALA CB C 445 18.060 18.317 -0.257 1
1 1349 . 18 2 2 B 24 24 ALA N N 445 120.890 121.245 -0.355 1
1 1350 . 18 2 2 B 25 25 PHE H H 446 8.160 8.034 0.126 1
1 1351 . 18 2 2 B 25 25 PHE HA H 446 4.080 4.301 -0.221 1
1 1358 . 18 2 2 B 25 25 PHE CA C 446 62.670 61.845 0.825 1
1 1359 . 18 2 2 B 25 25 PHE CB C 446 39.440 38.540 0.900 1
1 1364 . 18 2 2 B 25 25 PHE N N 446 115.360 116.245 -0.885 1
1 1365 . 18 2 2 B 26 26 LYS H H 447 8.040 7.720 0.320 1
1 1366 . 18 2 2 B 26 26 LYS HA H 447 4.110 3.966 0.144 1
1 1375 . 18 2 2 B 26 26 LYS CA C 447 60.140 59.215 0.925 1
1 1376 . 18 2 2 B 26 26 LYS CB C 447 32.880 32.495 0.385 1
1 1380 . 18 2 2 B 26 26 LYS N N 447 123.110 118.297 4.813 1
1 1381 . 18 2 2 B 27 27 LEU H H 448 8.630 7.913 0.717 1
1 1382 . 18 2 2 B 27 27 LEU HA H 448 3.840 4.109 -0.269 1
1 1392 . 18 2 2 B 27 27 LEU CA C 448 58.210 57.455 0.755 1
1 1393 . 18 2 2 B 27 27 LEU CB C 448 39.760 41.676 -1.916 1
1 1396 . 18 2 2 B 27 27 LEU N N 448 120.890 121.280 -0.390 1
1 1397 . 18 2 2 B 28 28 ALA H H 449 8.200 9.182 -0.982 1
1 1398 . 18 2 2 B 28 28 ALA HA H 449 3.760 4.476 -0.716 1
1 1402 . 18 2 2 B 28 28 ALA CA C 449 54.750 55.139 -0.389 1
1 1403 . 18 2 2 B 28 28 ALA CB C 449 18.050 18.201 -0.151 1
1 1404 . 18 2 2 B 28 28 ALA N N 449 123.710 120.780 2.930 1
1 1405 . 18 2 2 B 29 29 ALA H H 450 7.780 8.257 -0.477 1
1 1406 . 18 2 2 B 29 29 ALA HA H 450 4.170 4.165 0.005 1
1 1410 . 18 2 2 B 29 29 ALA CA C 450 54.430 54.435 -0.005 1
1 1411 . 18 2 2 B 29 29 ALA CB C 450 18.040 18.281 -0.241 1
1 1412 . 18 2 2 B 29 29 ALA N N 450 121.020 119.573 1.447 1
1 1413 . 18 2 2 B 30 30 ARG H H 451 7.390 7.658 -0.268 1
1 1414 . 18 2 2 B 30 30 ARG HA H 451 4.540 4.432 0.108 1
1 1421 . 18 2 2 B 30 30 ARG CA C 451 54.510 55.629 -1.119 1
1 1422 . 18 2 2 B 30 30 ARG CB C 451 29.950 29.722 0.228 1
1 1425 . 18 2 2 B 30 30 ARG N N 451 115.480 116.634 -1.154 1
1 1426 . 18 2 2 B 31 31 GLY H H 452 7.950 7.937 0.013 1
1 1427 . 18 2 2 B 31 31 GLY HA2 H 452 3.550 3.979 -0.429 1
1 1428 . 18 2 2 B 31 31 GLY HA3 H 452 4.200 3.982 0.218 1
1 1429 . 18 2 2 B 31 31 GLY CA C 452 45.380 45.394 -0.014 1
1 1430 . 18 2 2 B 31 31 GLY N N 452 107.740 107.919 -0.179 1
1 1431 . 18 2 2 B 32 32 VAL H H 453 7.990 7.614 0.376 1
1 1432 . 18 2 2 B 32 32 VAL HA H 453 3.930 3.918 0.012 1
1 1440 . 18 2 2 B 32 32 VAL CA C 453 61.420 62.761 -1.341 1
1 1441 . 18 2 2 B 32 32 VAL CB C 453 29.860 31.773 -1.913 1
1 1444 . 18 2 2 B 32 32 VAL N N 453 125.560 120.549 5.011 1
1 1445 . 18 2 2 B 33 33 CYS H H 454 8.460 8.449 0.011 1
1 1446 . 18 2 2 B 33 33 CYS HA H 454 4.310 4.768 -0.458 1
1 1449 . 18 2 2 B 33 33 CYS CA C 454 60.260 59.728 0.532 1
1 1450 . 18 2 2 B 33 33 CYS CB C 454 30.330 30.496 -0.166 1
1 1451 . 18 2 2 B 33 33 CYS N N 454 119.460 125.141 -5.681 1
1 1452 . 18 2 2 B 34 34 THR H H 455 8.080 7.925 0.155 1
1 1453 . 18 2 2 B 34 34 THR HA H 455 4.840 4.684 0.156 1
1 1458 . 18 2 2 B 34 34 THR CA C 455 58.650 60.989 -2.339 1
1 1459 . 18 2 2 B 34 34 THR CB C 455 72.680 71.506 1.174 1
1 1461 . 18 2 2 B 34 34 THR N N 455 108.420 113.520 -5.100 1
1 1462 . 18 2 2 B 35 35 LEU H H 456 8.580 8.695 -0.115 1
1 1463 . 18 2 2 B 35 35 LEU HA H 456 3.790 4.012 -0.222 1
1 1473 . 18 2 2 B 35 35 LEU CA C 456 57.980 58.607 -0.627 1
1 1474 . 18 2 2 B 35 35 LEU CB C 456 42.220 41.301 0.919 1
1 1477 . 18 2 2 B 35 35 LEU N N 456 120.370 127.471 -7.101 1
1 1478 . 18 2 2 B 36 36 GLU H H 457 8.390 8.332 0.058 1
1 1479 . 18 2 2 B 36 36 GLU HA H 457 3.820 3.801 0.019 1
1 1484 . 18 2 2 B 36 36 GLU CA C 457 59.640 60.058 -0.418 1
1 1485 . 18 2 2 B 36 36 GLU CB C 457 28.780 29.153 -0.373 1
1 1487 . 18 2 2 B 36 36 GLU N N 457 119.450 118.881 0.569 1
1 1488 . 18 2 2 B 37 37 ASP H H 458 7.750 7.817 -0.067 1
1 1489 . 18 2 2 B 37 37 ASP HA H 458 4.140 4.387 -0.247 1
1 1492 . 18 2 2 B 37 37 ASP CA C 458 57.150 57.307 -0.157 1
1 1493 . 18 2 2 B 37 37 ASP CB C 458 42.280 40.603 1.677 1
1 1494 . 18 2 2 B 37 37 ASP N N 458 117.430 120.559 -3.129 1
1 1495 . 18 2 2 B 38 38 LEU H H 459 7.700 7.874 -0.174 1
1 1496 . 18 2 2 B 38 38 LEU HA H 459 3.790 4.195 -0.405 1
1 1506 . 18 2 2 B 38 38 LEU CA C 459 58.080 57.873 0.207 1
1 1507 . 18 2 2 B 38 38 LEU CB C 459 41.130 41.288 -0.158 1
1 1511 . 18 2 2 B 38 38 LEU N N 459 121.280 122.180 -0.900 1
1 1512 . 18 2 2 B 39 39 ALA H H 460 8.190 8.450 -0.260 1
1 1513 . 18 2 2 B 39 39 ALA HA H 460 3.640 3.976 -0.336 1
1 1517 . 18 2 2 B 39 39 ALA CA C 460 54.320 55.364 -1.044 1
1 1518 . 18 2 2 B 39 39 ALA CB C 460 17.140 18.213 -1.073 1
1 1519 . 18 2 2 B 39 39 ALA N N 460 119.400 120.652 -1.252 1
1 1520 . 18 2 2 B 40 40 GLU H H 461 7.340 7.880 -0.540 1
1 1521 . 18 2 2 B 40 40 GLU HA H 461 4.180 4.221 -0.041 1
1 1526 . 18 2 2 B 40 40 GLU CA C 461 57.800 58.840 -1.040 1
1 1527 . 18 2 2 B 40 40 GLU CB C 461 30.600 29.415 1.185 1
1 1529 . 18 2 2 B 40 40 GLU N N 461 110.680 115.950 -5.270 1
1 1530 . 18 2 2 B 41 41 GLN H H 462 7.940 7.789 0.151 1
1 1531 . 18 2 2 B 41 41 GLN HA H 462 4.100 4.391 -0.291 1
1 1538 . 18 2 2 B 41 41 GLN CA C 462 55.310 55.785 -0.475 1
1 1539 . 18 2 2 B 41 41 GLN CB C 462 28.780 29.526 -0.746 1
1 1541 . 18 2 2 B 41 41 GLN N N 462 120.720 117.755 2.965 1
1 1543 . 18 2 2 B 42 42 GLY H H 463 9.000 8.394 0.606 1
1 1544 . 18 2 2 B 42 42 GLY HA2 H 463 3.310 4.268 -0.958 1
1 1545 . 18 2 2 B 42 42 GLY HA3 H 463 4.820 4.269 0.551 1
1 1546 . 18 2 2 B 42 42 GLY CA C 463 42.650 43.922 -1.272 1
1 1547 . 18 2 2 B 42 42 GLY N N 463 104.110 108.897 -4.787 1
1 1548 . 18 2 2 B 43 43 ILE H H 464 7.900 8.719 -0.819 1
1 1549 . 18 2 2 B 43 43 ILE HA H 464 3.260 3.707 -0.447 1
1 1558 . 18 2 2 B 43 43 ILE CA C 464 66.570 64.471 2.099 1
1 1559 . 18 2 2 B 43 43 ILE CB C 464 38.770 37.629 1.141 1
1 1562 . 18 2 2 B 43 43 ILE N N 464 119.410 121.247 -1.837 1
1 1563 . 18 2 2 B 44 44 ASP H H 465 8.730 8.318 0.412 1
1 1564 . 18 2 2 B 44 44 ASP HA H 465 4.310 4.304 0.006 1
1 1567 . 18 2 2 B 44 44 ASP CA C 465 56.740 57.909 -1.169 1
1 1568 . 18 2 2 B 44 44 ASP CB C 465 40.120 41.227 -1.107 1
1 1569 . 18 2 2 B 44 44 ASP N N 465 116.610 122.155 -5.545 1
1 1570 . 18 2 2 B 45 45 ASP H H 466 7.720 8.406 -0.686 1
1 1571 . 18 2 2 B 45 45 ASP HA H 466 4.480 4.439 0.041 1
1 1574 . 18 2 2 B 45 45 ASP CA C 466 57.000 56.906 0.094 1
1 1575 . 18 2 2 B 45 45 ASP CB C 466 42.270 40.203 2.067 1
1 1576 . 18 2 2 B 45 45 ASP N N 466 117.560 118.191 -0.631 1
1 1577 . 18 2 2 B 46 46 LEU H H 467 7.370 7.505 -0.135 1
1 1578 . 18 2 2 B 46 46 LEU HA H 467 4.410 4.192 0.218 1
1 1587 . 18 2 2 B 46 46 LEU CA C 467 53.660 56.696 -3.036 1
1 1588 . 18 2 2 B 46 46 LEU CB C 467 42.260 42.164 0.096 1
1 1591 . 18 2 2 B 46 46 LEU N N 467 116.890 119.079 -2.189 1
1 1592 . 18 2 2 B 47 47 ALA H H 468 7.080 8.247 -1.167 1
1 1593 . 18 2 2 B 47 47 ALA HA H 468 4.120 4.031 0.089 1
1 1597 . 18 2 2 B 47 47 ALA CA C 468 54.130 54.887 -0.757 1
1 1598 . 18 2 2 B 47 47 ALA CB C 468 19.480 18.385 1.095 1
1 1599 . 18 2 2 B 47 47 ALA N N 468 120.150 122.977 -2.827 1
1 1600 . 18 2 2 B 48 48 ASP H H 469 8.560 8.182 0.378 1
1 1601 . 18 2 2 B 48 48 ASP HA H 469 4.410 4.438 -0.028 1
1 1604 . 18 2 2 B 48 48 ASP CA C 469 54.330 57.518 -3.188 1
1 1605 . 18 2 2 B 48 48 ASP CB C 469 39.760 40.719 -0.959 1
1 1606 . 18 2 2 B 48 48 ASP N N 469 114.660 116.664 -2.004 1
1 1607 . 18 2 2 B 49 49 ILE H H 470 7.870 7.897 -0.027 1
1 1608 . 18 2 2 B 49 49 ILE HA H 470 3.850 4.317 -0.467 1
1 1618 . 18 2 2 B 49 49 ILE CA C 470 61.680 60.691 0.989 1
1 1619 . 18 2 2 B 49 49 ILE CB C 470 37.120 38.456 -1.336 1
1 1623 . 18 2 2 B 49 49 ILE N N 470 121.600 119.746 1.854 1
1 1624 . 18 2 2 B 50 50 GLU H H 471 8.680 9.012 -0.332 1
1 1625 . 18 2 2 B 50 50 GLU HA H 471 3.940 3.934 0.006 1
1 1630 . 18 2 2 B 50 50 GLU CA C 471 58.360 59.630 -1.270 1
1 1631 . 18 2 2 B 50 50 GLU CB C 471 29.530 29.391 0.139 1
1 1633 . 18 2 2 B 50 50 GLU N N 471 131.000 128.836 2.164 1
1 1634 . 18 2 2 B 51 51 GLY H H 472 8.860 8.182 0.678 1
1 1635 . 18 2 2 B 51 51 GLY HA2 H 472 3.640 3.990 -0.350 1
1 1636 . 18 2 2 B 51 51 GLY HA3 H 472 4.230 3.994 0.236 1
1 1637 . 18 2 2 B 51 51 GLY CA C 472 45.190 47.094 -1.904 1
1 1638 . 18 2 2 B 51 51 GLY N N 472 113.580 107.042 6.538 1
1 1639 . 18 2 2 B 52 52 LEU H H 473 7.850 7.586 0.264 1
1 1640 . 18 2 2 B 52 52 LEU HA H 473 4.680 4.778 -0.098 1
1 1650 . 18 2 2 B 52 52 LEU CA C 473 53.640 53.708 -0.068 1
1 1651 . 18 2 2 B 52 52 LEU CB C 473 42.990 43.497 -0.507 1
1 1655 . 18 2 2 B 52 52 LEU N N 473 123.020 120.194 2.826 1
1 1656 . 18 2 2 B 53 53 THR H H 474 7.550 8.869 -1.319 1
1 1657 . 18 2 2 B 53 53 THR HA H 474 4.560 4.797 -0.237 1
1 1662 . 18 2 2 B 53 53 THR CA C 474 60.060 60.833 -0.773 1
1 1663 . 18 2 2 B 53 53 THR CB C 474 71.520 71.060 0.460 1
1 1665 . 18 2 2 B 53 53 THR N N 474 115.070 118.937 -3.867 1
1 1666 . 18 2 2 B 54 54 ASP H H 475 8.900 8.988 -0.088 1
1 1667 . 18 2 2 B 54 54 ASP HA H 475 4.220 4.261 -0.041 1
1 1670 . 18 2 2 B 54 54 ASP CA C 475 57.520 58.101 -0.581 1
1 1671 . 18 2 2 B 54 54 ASP CB C 475 39.560 40.222 -0.662 1
1 1672 . 18 2 2 B 54 54 ASP N N 475 121.800 123.815 -2.015 1
1 1673 . 18 2 2 B 55 55 GLU H H 476 8.460 8.191 0.269 1
1 1674 . 18 2 2 B 55 55 GLU HA H 476 3.970 4.025 -0.055 1
1 1679 . 18 2 2 B 55 55 GLU CA C 476 59.440 59.271 0.169 1
1 1680 . 18 2 2 B 55 55 GLU CB C 476 29.650 29.454 0.196 1
1 1682 . 18 2 2 B 55 55 GLU N N 476 119.460 119.812 -0.352 1
1 1683 . 18 2 2 B 56 56 LYS H H 477 7.790 8.052 -0.262 1
1 1684 . 18 2 2 B 56 56 LYS HA H 477 4.120 4.073 0.047 1
1 1693 . 18 2 2 B 56 56 LYS CA C 477 58.890 59.313 -0.423 1
1 1694 . 18 2 2 B 56 56 LYS CB C 477 32.600 32.205 0.395 1
1 1698 . 18 2 2 B 56 56 LYS N N 477 121.840 119.780 2.060 1
1 1699 . 18 2 2 B 57 57 ALA H H 478 8.900 8.868 0.032 1
1 1700 . 18 2 2 B 57 57 ALA HA H 478 3.790 4.055 -0.265 1
1 1704 . 18 2 2 B 57 57 ALA CA C 478 55.810 55.227 0.583 1
1 1705 . 18 2 2 B 57 57 ALA CB C 478 18.590 18.353 0.237 1
1 1706 . 18 2 2 B 57 57 ALA N N 478 121.350 121.602 -0.252 1
1 1707 . 18 2 2 B 58 58 GLY H H 479 8.300 8.120 0.180 1
1 1708 . 18 2 2 B 58 58 GLY HA2 H 479 3.500 3.771 -0.271 1
1 1709 . 18 2 2 B 58 58 GLY HA3 H 479 3.890 3.771 0.119 1
1 1710 . 18 2 2 B 58 58 GLY CA C 479 47.360 47.324 0.036 1
1 1711 . 18 2 2 B 58 58 GLY N N 479 102.040 107.078 -5.038 1
1 1712 . 18 2 2 B 59 59 ALA H H 480 7.580 7.954 -0.374 1
1 1713 . 18 2 2 B 59 59 ALA HA H 480 4.110 4.082 0.028 1
1 1717 . 18 2 2 B 59 59 ALA CA C 480 55.580 54.517 1.063 1
1 1718 . 18 2 2 B 59 59 ALA CB C 480 18.130 18.823 -0.693 1
1 1719 . 18 2 2 B 59 59 ALA N N 480 123.180 124.867 -1.687 1
1 1720 . 18 2 2 B 60 60 LEU H H 481 8.290 7.965 0.325 1
1 1721 . 18 2 2 B 60 60 LEU HA H 481 4.020 4.014 0.006 1
1 1731 . 18 2 2 B 60 60 LEU CA C 481 57.850 57.785 0.065 1
1 1732 . 18 2 2 B 60 60 LEU CB C 481 42.360 41.766 0.594 1
1 1736 . 18 2 2 B 60 60 LEU N N 481 120.560 118.616 1.944 1
1 1737 . 18 2 2 B 61 61 ILE H H 482 8.080 8.168 -0.088 1
1 1738 . 18 2 2 B 61 61 ILE HA H 482 3.210 3.480 -0.270 1
1 1748 . 18 2 2 B 61 61 ILE CA C 482 66.250 65.166 1.084 1
1 1749 . 18 2 2 B 61 61 ILE CB C 482 39.400 37.927 1.473 1
1 1753 . 18 2 2 B 61 61 ILE N N 482 119.170 119.558 -0.388 1
1 1754 . 18 2 2 B 62 62 MET H H 483 8.110 8.327 -0.217 1
1 1755 . 18 2 2 B 62 62 MET HA H 483 4.410 4.113 0.297 1
1 1763 . 18 2 2 B 62 62 MET CA C 483 56.110 58.716 -2.606 1
1 1764 . 18 2 2 B 62 62 MET CB C 483 28.260 32.334 -4.074 1
1 1767 . 18 2 2 B 62 62 MET N N 483 114.420 118.087 -3.667 1
1 1768 . 18 2 2 B 63 63 ALA H H 484 8.240 7.881 0.359 1
1 1769 . 18 2 2 B 63 63 ALA HA H 484 4.130 4.043 0.087 1
1 1773 . 18 2 2 B 63 63 ALA CA C 484 55.300 55.060 0.240 1
1 1774 . 18 2 2 B 63 63 ALA CB C 484 18.280 18.103 0.177 1
1 1775 . 18 2 2 B 63 63 ALA N N 484 123.710 121.365 2.345 1
1 1776 . 18 2 2 B 64 64 ALA H H 485 8.050 8.303 -0.253 1
1 1777 . 18 2 2 B 64 64 ALA HA H 485 3.870 4.054 -0.184 1
1 1781 . 18 2 2 B 64 64 ALA CA C 485 55.330 55.196 0.134 1
1 1782 . 18 2 2 B 64 64 ALA CB C 485 17.660 18.106 -0.446 1
1 1783 . 18 2 2 B 64 64 ALA N N 485 120.070 119.794 0.276 1
1 1784 . 18 2 2 B 65 65 ARG H H 486 8.640 8.955 -0.315 1
1 1785 . 18 2 2 B 65 65 ARG HA H 486 2.800 4.082 -1.282 1
1 1792 . 18 2 2 B 65 65 ARG CA C 486 60.600 59.491 1.109 1
1 1793 . 18 2 2 B 65 65 ARG CB C 486 29.910 29.902 0.008 1
1 1796 . 18 2 2 B 65 65 ARG N N 486 118.730 118.701 0.029 1
1 1797 . 18 2 2 B 66 66 ASN H H 487 8.710 8.459 0.251 1
1 1798 . 18 2 2 B 66 66 ASN HA H 487 4.550 3.891 0.659 1
1 1803 . 18 2 2 B 66 66 ASN CA C 487 56.390 55.870 0.520 1
1 1804 . 18 2 2 B 66 66 ASN CB C 487 37.970 38.503 -0.533 1
1 1805 . 18 2 2 B 66 66 ASN N N 487 119.170 117.763 1.407 1
1 1807 . 18 2 2 B 67 67 ILE H H 488 7.250 7.645 -0.395 1
1 1808 . 18 2 2 B 67 67 ILE HA H 488 3.810 3.791 0.019 1
1 1818 . 18 2 2 B 67 67 ILE CA C 488 64.350 64.930 -0.580 1
1 1819 . 18 2 2 B 67 67 ILE CB C 488 39.570 37.508 2.062 1
1 1823 . 18 2 2 B 67 67 ILE N N 488 117.890 119.485 -1.595 1
1 1824 . 18 2 2 B 68 68 CYS H H 489 8.350 8.530 -0.180 1
1 1825 . 18 2 2 B 68 68 CYS HA H 489 4.080 4.035 0.045 1
1 1828 . 18 2 2 B 68 68 CYS CA C 489 62.670 63.623 -0.953 1
1 1829 . 18 2 2 B 68 68 CYS CB C 489 28.170 27.675 0.495 1
1 1830 . 18 2 2 B 68 68 CYS N N 489 115.230 118.625 -3.395 1
1 1831 . 18 2 2 B 69 69 TRP H H 490 8.230 8.460 -0.230 1
1 1832 . 18 2 2 B 69 69 TRP HA H 490 5.100 4.293 0.807 1
1 1841 . 18 2 2 B 69 69 TRP CA C 490 55.420 60.474 -5.054 1
1 1842 . 18 2 2 B 69 69 TRP CB C 490 31.010 29.132 1.878 1
1 1844 . 18 2 2 B 69 69 TRP N N 490 116.850 120.805 -3.955 1
1 1846 . 18 2 2 B 70 70 PHE H H 491 7.570 8.220 -0.650 1
1 1847 . 18 2 2 B 70 70 PHE HA H 491 5.240 4.548 0.692 1
1 1852 . 18 2 2 B 70 70 PHE CA C 491 55.490 60.322 -4.832 1
1 1853 . 18 2 2 B 70 70 PHE CB C 491 38.700 38.233 0.467 1
1 1856 . 18 2 2 B 70 70 PHE N N 491 117.460 118.015 -0.555 1
1 1857 . 18 2 2 B 71 71 GLY H H 492 8.420 8.646 -0.226 1
1 1858 . 18 2 2 B 71 71 GLY HA2 H 492 3.920 3.688 0.232 1
1 1859 . 18 2 2 B 71 71 GLY HA3 H 492 4.080 3.729 0.351 1
1 1860 . 18 2 2 B 71 71 GLY CA C 492 46.210 47.075 -0.865 1
1 1861 . 18 2 2 B 71 71 GLY N N 492 110.040 108.193 1.847 1
1 1862 . 18 2 2 B 72 72 ASP H H 493 8.370 7.980 0.390 1
1 1863 . 18 2 2 B 72 72 ASP HA H 493 4.630 4.359 0.271 1
1 1866 . 18 2 2 B 72 72 ASP CA C 493 54.410 56.521 -2.111 1
1 1867 . 18 2 2 B 72 72 ASP CB C 493 41.250 40.515 0.735 1
1 1868 . 18 2 2 B 72 72 ASP N N 493 120.000 120.257 -0.257 1
1 1869 . 18 2 2 B 73 73 GLU H H 494 8.230 7.737 0.493 1
1 1870 . 18 2 2 B 73 73 GLU HA H 494 4.260 4.631 -0.371 1
1 1875 . 18 2 2 B 73 73 GLU CA C 494 56.510 55.291 1.219 1
1 1876 . 18 2 2 B 73 73 GLU CB C 494 30.420 32.160 -1.740 1
1 1878 . 18 2 2 B 73 73 GLU N N 494 120.900 118.081 2.819 1
1 216 . 19 1 1 A 20 20 ASP H H 250 8.550 8.968 -0.418 1
1 217 . 19 1 1 A 20 20 ASP HA H 250 4.700 4.528 0.172 1
1 220 . 19 1 1 A 20 20 ASP CA C 250 52.650 52.998 -0.348 1
1 221 . 19 1 1 A 20 20 ASP CB C 250 41.420 40.308 1.112 1
1 222 . 19 1 1 A 20 20 ASP N N 250 125.190 125.492 -0.302 1
1 223 . 19 1 1 A 21 21 PRO HA H 251 4.250 4.422 -0.172 1
1 230 . 19 1 1 A 21 21 PRO CA C 251 65.120 64.991 0.129 1
1 231 . 19 1 1 A 21 21 PRO CB C 251 32.310 32.233 0.077 1
1 234 . 19 1 1 A 22 22 ILE H H 252 8.630 7.844 0.786 1
1 235 . 19 1 1 A 22 22 ILE HA H 252 4.060 4.016 0.044 1
1 245 . 19 1 1 A 22 22 ILE CA C 252 62.990 62.774 0.216 1
1 246 . 19 1 1 A 22 22 ILE CB C 252 37.520 37.556 -0.036 1
1 250 . 19 1 1 A 22 22 ILE N N 252 119.860 117.042 2.818 1
1 251 . 19 1 1 A 23 23 LEU H H 253 7.950 7.861 0.089 1
1 252 . 19 1 1 A 23 23 LEU HA H 253 3.710 4.105 -0.395 1
1 262 . 19 1 1 A 23 23 LEU CA C 253 56.510 57.828 -1.318 1
1 263 . 19 1 1 A 23 23 LEU CB C 253 41.190 41.783 -0.593 1
1 266 . 19 1 1 A 23 23 LEU N N 253 116.850 121.334 -4.484 1
1 267 . 19 1 1 A 24 24 LEU H H 254 7.370 7.804 -0.434 1
1 268 . 19 1 1 A 24 24 LEU HA H 254 4.310 4.509 -0.199 1
1 278 . 19 1 1 A 24 24 LEU CA C 254 54.890 57.984 -3.094 1
1 279 . 19 1 1 A 24 24 LEU CB C 254 41.960 41.752 0.208 1
1 283 . 19 1 1 A 24 24 LEU N N 254 115.210 119.275 -4.065 1
1 284 . 19 1 1 A 25 25 ARG H H 255 7.520 7.830 -0.310 1
1 285 . 19 1 1 A 25 25 ARG HA H 255 4.660 4.247 0.413 1
1 293 . 19 1 1 A 25 25 ARG CA C 255 52.840 54.407 -1.567 1
1 294 . 19 1 1 A 25 25 ARG CB C 255 28.130 30.415 -2.285 1
1 297 . 19 1 1 A 25 25 ARG N N 255 118.180 120.179 -1.999 1
1 298 . 19 1 1 A 26 26 PRO HA H 256 4.800 4.916 -0.116 1
1 305 . 19 1 1 A 26 26 PRO CA C 256 61.790 62.801 -1.011 1
1 306 . 19 1 1 A 26 26 PRO CB C 256 32.660 31.691 0.969 1
1 309 . 19 1 1 A 27 27 VAL H H 257 8.170 8.501 -0.331 1
1 310 . 19 1 1 A 27 27 VAL HA H 257 3.590 3.738 -0.148 1
1 318 . 19 1 1 A 27 27 VAL CA C 257 64.830 65.736 -0.906 1
1 319 . 19 1 1 A 27 27 VAL CB C 257 31.720 31.587 0.133 1
1 322 . 19 1 1 A 27 27 VAL N N 257 115.710 124.503 -8.793 1
1 323 . 19 1 1 A 28 28 ASP H H 258 8.240 8.042 0.198 1
1 324 . 19 1 1 A 28 28 ASP HA H 258 4.340 4.382 -0.042 1
1 327 . 19 1 1 A 28 28 ASP CA C 258 56.490 57.520 -1.030 1
1 328 . 19 1 1 A 28 28 ASP CB C 258 40.520 40.217 0.303 1
1 329 . 19 1 1 A 28 28 ASP N N 258 119.000 121.998 -2.998 1
1 330 . 19 1 1 A 29 29 ASP H H 259 8.000 8.721 -0.721 1
1 331 . 19 1 1 A 29 29 ASP HA H 259 4.390 4.605 -0.215 1
1 334 . 19 1 1 A 29 29 ASP CA C 259 56.210 55.501 0.709 1
1 335 . 19 1 1 A 29 29 ASP CB C 259 40.670 41.178 -0.508 1
1 336 . 19 1 1 A 29 29 ASP N N 259 118.900 117.574 1.326 1
1 337 . 19 1 1 A 30 30 LEU H H 260 7.760 7.510 0.250 1
1 338 . 19 1 1 A 30 30 LEU HA H 260 3.990 4.223 -0.233 1
1 348 . 19 1 1 A 30 30 LEU CA C 260 55.000 55.473 -0.473 1
1 349 . 19 1 1 A 30 30 LEU CB C 260 41.670 42.162 -0.492 1
1 353 . 19 1 1 A 30 30 LEU N N 260 116.300 121.260 -4.960 1
1 354 . 19 1 1 A 31 31 GLU H H 261 7.990 8.796 -0.806 1
1 355 . 19 1 1 A 31 31 GLU HA H 261 4.280 4.026 0.254 1
1 358 . 19 1 1 A 31 31 GLU CA C 261 56.860 59.494 -2.634 1
1 359 . 19 1 1 A 31 31 GLU CB C 261 27.010 29.270 -2.260 1
1 360 . 19 1 1 A 31 31 GLU N N 261 115.620 122.570 -6.950 1
1 361 . 19 1 1 A 32 32 LEU H H 262 8.000 7.426 0.574 1
1 362 . 19 1 1 A 32 32 LEU HA H 262 4.400 4.345 0.055 1
1 372 . 19 1 1 A 32 32 LEU CA C 262 53.860 55.023 -1.163 1
1 373 . 19 1 1 A 32 32 LEU CB C 262 44.450 42.575 1.875 1
1 377 . 19 1 1 A 32 32 LEU N N 262 118.860 122.474 -3.614 1
1 378 . 19 1 1 A 33 33 THR H H 263 10.020 8.692 1.328 1
1 379 . 19 1 1 A 33 33 THR HA H 263 4.130 4.732 -0.602 1
1 384 . 19 1 1 A 33 33 THR CA C 263 62.400 60.592 1.808 1
1 385 . 19 1 1 A 33 33 THR CB C 263 71.270 71.269 0.001 1
1 387 . 19 1 1 A 33 33 THR N N 263 114.610 112.959 1.651 1
1 388 . 19 1 1 A 34 34 VAL H H 264 8.370 8.823 -0.453 1
1 389 . 19 1 1 A 34 34 VAL HA H 264 3.620 3.643 -0.023 1
1 397 . 19 1 1 A 34 34 VAL CA C 264 66.340 66.633 -0.293 1
1 398 . 19 1 1 A 34 34 VAL CB C 264 31.670 31.306 0.364 1
1 401 . 19 1 1 A 34 34 VAL N N 264 122.110 122.282 -0.172 1
1 402 . 19 1 1 A 35 35 ARG H H 265 8.190 8.153 0.037 1
1 403 . 19 1 1 A 35 35 ARG HA H 265 4.070 3.945 0.125 1
1 411 . 19 1 1 A 35 35 ARG CA C 265 59.470 59.773 -0.303 1
1 412 . 19 1 1 A 35 35 ARG CB C 265 29.790 29.821 -0.031 1
1 415 . 19 1 1 A 35 35 ARG N N 265 117.340 121.032 -3.692 1
1 416 . 19 1 1 A 36 36 SER H H 266 7.610 8.166 -0.556 1
1 417 . 19 1 1 A 36 36 SER HA H 266 4.080 4.198 -0.118 1
1 420 . 19 1 1 A 36 36 SER CA C 266 63.080 61.391 1.689 1
1 421 . 19 1 1 A 36 36 SER CB C 266 63.280 62.264 1.016 1
1 422 . 19 1 1 A 36 36 SER N N 266 116.710 115.282 1.428 1
1 423 . 19 1 1 A 37 37 ALA H H 267 8.720 7.706 1.014 1
1 424 . 19 1 1 A 37 37 ALA HA H 267 3.760 3.998 -0.238 1
1 428 . 19 1 1 A 37 37 ALA CA C 267 55.900 55.312 0.588 1
1 429 . 19 1 1 A 37 37 ALA CB C 267 18.090 17.823 0.267 1
1 430 . 19 1 1 A 37 37 ALA N N 267 124.170 123.436 0.734 1
1 431 . 19 1 1 A 38 38 ASN H H 268 8.850 9.412 -0.562 1
1 432 . 19 1 1 A 38 38 ASN HA H 268 4.420 4.527 -0.107 1
1 437 . 19 1 1 A 38 38 ASN CA C 268 55.700 56.074 -0.374 1
1 438 . 19 1 1 A 38 38 ASN CB C 268 37.180 37.648 -0.468 1
1 439 . 19 1 1 A 38 38 ASN N N 268 117.370 117.558 -0.188 1
1 441 . 19 1 1 A 39 39 CYS H H 269 7.970 7.723 0.247 1
1 442 . 19 1 1 A 39 39 CYS HA H 269 4.190 4.003 0.187 1
1 445 . 19 1 1 A 39 39 CYS CA C 269 63.340 62.304 1.036 1
1 446 . 19 1 1 A 39 39 CYS CB C 269 26.870 26.895 -0.025 1
1 447 . 19 1 1 A 39 39 CYS N N 269 120.510 119.555 0.955 1
1 448 . 19 1 1 A 40 40 LEU H H 270 7.600 7.732 -0.132 1
1 449 . 19 1 1 A 40 40 LEU HA H 270 3.880 3.884 -0.004 1
1 458 . 19 1 1 A 40 40 LEU CA C 270 57.810 58.108 -0.298 1
1 459 . 19 1 1 A 40 40 LEU CB C 270 40.030 41.714 -1.684 1
1 462 . 19 1 1 A 40 40 LEU N N 270 117.710 120.878 -3.168 1
1 463 . 19 1 1 A 41 41 LYS H H 271 7.980 8.290 -0.310 1
1 464 . 19 1 1 A 41 41 LYS HA H 271 3.820 4.245 -0.425 1
1 472 . 19 1 1 A 41 41 LYS CA C 271 59.840 58.966 0.874 1
1 473 . 19 1 1 A 41 41 LYS CB C 271 32.070 32.081 -0.011 1
1 476 . 19 1 1 A 41 41 LYS N N 271 120.070 120.185 -0.115 1
1 477 . 19 1 1 A 42 42 ALA H H 272 7.860 8.486 -0.626 1
1 478 . 19 1 1 A 42 42 ALA HA H 272 4.140 4.092 0.048 1
1 482 . 19 1 1 A 42 42 ALA CA C 272 54.670 54.424 0.246 1
1 483 . 19 1 1 A 42 42 ALA CB C 272 17.950 18.368 -0.418 1
1 484 . 19 1 1 A 42 42 ALA N N 272 122.880 121.629 1.251 1
1 485 . 19 1 1 A 43 43 GLU H H 273 7.210 7.915 -0.705 1
1 486 . 19 1 1 A 43 43 GLU HA H 273 4.260 4.404 -0.144 1
1 491 . 19 1 1 A 43 43 GLU CA C 273 55.020 55.857 -0.837 1
1 492 . 19 1 1 A 43 43 GLU CB C 273 29.880 29.513 0.367 1
1 494 . 19 1 1 A 43 43 GLU N N 273 116.590 115.658 0.932 1
1 495 . 19 1 1 A 44 44 ALA H H 274 7.880 8.235 -0.355 1
1 496 . 19 1 1 A 44 44 ALA HA H 274 3.680 3.792 -0.112 1
1 500 . 19 1 1 A 44 44 ALA CA C 274 52.960 53.025 -0.065 1
1 501 . 19 1 1 A 44 44 ALA CB C 274 16.110 17.220 -1.110 1
1 502 . 19 1 1 A 44 44 ALA N N 274 118.420 118.749 -0.329 1
1 503 . 19 1 1 A 45 45 ILE H H 275 7.600 7.456 0.144 1
1 504 . 19 1 1 A 45 45 ILE HA H 275 3.870 4.201 -0.331 1
1 514 . 19 1 1 A 45 45 ILE CA C 275 61.150 60.240 0.910 1
1 515 . 19 1 1 A 45 45 ILE CB C 275 37.090 39.154 -2.064 1
1 519 . 19 1 1 A 45 45 ILE N N 275 120.370 118.158 2.212 1
1 520 . 19 1 1 A 46 46 HIS H H 276 8.350 8.804 -0.454 1
1 521 . 19 1 1 A 46 46 HIS HA H 276 4.600 4.853 -0.253 1
1 526 . 19 1 1 A 46 46 HIS CA C 276 56.900 57.045 -0.145 1
1 527 . 19 1 1 A 46 46 HIS CB C 276 31.910 30.865 1.045 1
1 529 . 19 1 1 A 46 46 HIS N N 276 123.250 125.616 -2.366 1
1 530 . 19 1 1 A 47 47 TYR H H 277 8.850 7.799 1.051 1
1 531 . 19 1 1 A 47 47 TYR HA H 277 5.100 4.820 0.280 1
1 538 . 19 1 1 A 47 47 TYR CA C 277 57.430 56.984 0.446 1
1 539 . 19 1 1 A 47 47 TYR CB C 277 40.680 40.341 0.339 1
1 544 . 19 1 1 A 47 47 TYR N N 277 119.700 117.609 2.091 1
1 545 . 19 1 1 A 48 48 ILE H H 278 9.380 8.330 1.050 1
1 546 . 19 1 1 A 48 48 ILE HA H 278 3.340 3.647 -0.307 1
1 554 . 19 1 1 A 48 48 ILE CA C 278 67.640 64.917 2.723 1
1 555 . 19 1 1 A 48 48 ILE CB C 278 36.310 37.473 -1.163 1
1 558 . 19 1 1 A 48 48 ILE N N 278 125.650 124.900 0.750 1
1 559 . 19 1 1 A 49 49 GLY H H 279 9.430 8.249 1.181 1
1 560 . 19 1 1 A 49 49 GLY HA2 H 279 2.370 1.685 0.685 1
1 561 . 19 1 1 A 49 49 GLY HA3 H 279 3.230 3.397 -0.167 1
1 562 . 19 1 1 A 49 49 GLY CA C 279 46.820 46.650 0.170 1
1 563 . 19 1 1 A 49 49 GLY N N 279 105.200 108.217 -3.017 1
1 564 . 19 1 1 A 50 50 ASP H H 280 7.050 7.470 -0.420 1
1 565 . 19 1 1 A 50 50 ASP HA H 280 4.360 4.171 0.189 1
1 568 . 19 1 1 A 50 50 ASP CA C 280 57.110 56.149 0.961 1
1 569 . 19 1 1 A 50 50 ASP CB C 280 42.620 40.523 2.097 1
1 570 . 19 1 1 A 50 50 ASP N N 280 116.360 120.763 -4.403 1
1 571 . 19 1 1 A 51 51 LEU H H 281 7.170 8.043 -0.873 1
1 572 . 19 1 1 A 51 51 LEU HA H 281 3.880 3.950 -0.070 1
1 582 . 19 1 1 A 51 51 LEU CA C 281 57.900 58.198 -0.298 1
1 583 . 19 1 1 A 51 51 LEU CB C 281 41.870 41.492 0.378 1
1 587 . 19 1 1 A 51 51 LEU N N 281 120.130 121.978 -1.848 1
1 588 . 19 1 1 A 52 52 VAL H H 282 7.820 7.691 0.129 1
1 589 . 19 1 1 A 52 52 VAL HA H 282 3.980 3.912 0.068 1
1 597 . 19 1 1 A 52 52 VAL CA C 282 64.000 65.286 -1.286 1
1 598 . 19 1 1 A 52 52 VAL CB C 282 30.400 31.267 -0.867 1
1 601 . 19 1 1 A 52 52 VAL N N 282 105.550 114.783 -9.233 1
1 602 . 19 1 1 A 53 53 GLN H H 283 6.550 8.009 -1.459 1
1 603 . 19 1 1 A 53 53 GLN HA H 283 4.680 4.085 0.595 1
1 610 . 19 1 1 A 53 53 GLN CA C 283 56.210 58.740 -2.530 1
1 611 . 19 1 1 A 53 53 GLN CB C 283 31.710 28.625 3.085 1
1 613 . 19 1 1 A 53 53 GLN N N 283 114.060 121.269 -7.209 1
1 615 . 19 1 1 A 54 54 ARG H H 284 7.690 7.595 0.095 1
1 616 . 19 1 1 A 54 54 ARG HA H 284 4.520 4.669 -0.149 1
1 624 . 19 1 1 A 54 54 ARG CA C 284 54.600 54.716 -0.116 1
1 625 . 19 1 1 A 54 54 ARG CB C 284 30.750 32.494 -1.744 1
1 628 . 19 1 1 A 54 54 ARG N N 284 119.810 118.698 1.112 1
1 629 . 19 1 1 A 55 55 THR H H 285 8.110 8.744 -0.634 1
1 630 . 19 1 1 A 55 55 THR HA H 285 4.430 4.567 -0.137 1
1 635 . 19 1 1 A 55 55 THR CA C 285 59.640 61.174 -1.534 1
1 636 . 19 1 1 A 55 55 THR CB C 285 71.310 70.300 1.010 1
1 638 . 19 1 1 A 55 55 THR N N 285 108.450 114.284 -5.834 1
1 639 . 19 1 1 A 56 56 GLU H H 286 8.910 8.942 -0.032 1
1 640 . 19 1 1 A 56 56 GLU HA H 286 3.660 3.969 -0.309 1
1 645 . 19 1 1 A 56 56 GLU CA C 286 60.650 59.736 0.914 1
1 646 . 19 1 1 A 56 56 GLU CB C 286 29.400 29.314 0.086 1
1 648 . 19 1 1 A 56 56 GLU N N 286 120.600 122.544 -1.944 1
1 649 . 19 1 1 A 57 57 VAL H H 287 7.600 8.146 -0.546 1
1 650 . 19 1 1 A 57 57 VAL HA H 287 3.620 3.518 0.102 1
1 658 . 19 1 1 A 57 57 VAL CA C 287 66.020 67.140 -1.120 1
1 659 . 19 1 1 A 57 57 VAL CB C 287 31.720 31.582 0.138 1
1 662 . 19 1 1 A 57 57 VAL N N 287 114.050 119.641 -5.591 1
1 663 . 19 1 1 A 58 58 GLU H H 288 7.350 8.299 -0.949 1
1 664 . 19 1 1 A 58 58 GLU HA H 288 3.830 4.066 -0.236 1
1 669 . 19 1 1 A 58 58 GLU CA C 288 59.250 59.611 -0.361 1
1 670 . 19 1 1 A 58 58 GLU CB C 288 30.030 29.126 0.904 1
1 672 . 19 1 1 A 58 58 GLU N N 288 117.610 119.215 -1.605 1
1 673 . 19 1 1 A 59 59 LEU H H 289 7.850 7.930 -0.080 1
1 674 . 19 1 1 A 59 59 LEU HA H 289 4.150 4.201 -0.051 1
1 683 . 19 1 1 A 59 59 LEU CA C 289 57.340 57.963 -0.623 1
1 684 . 19 1 1 A 59 59 LEU CB C 289 41.170 41.533 -0.363 1
1 687 . 19 1 1 A 59 59 LEU N N 289 120.050 120.304 -0.254 1
1 688 . 19 1 1 A 60 60 LEU H H 290 7.670 8.220 -0.550 1
1 689 . 19 1 1 A 60 60 LEU HA H 290 4.540 4.010 0.530 1
1 696 . 19 1 1 A 60 60 LEU CA C 290 55.090 57.952 -2.862 1
1 697 . 19 1 1 A 60 60 LEU CB C 290 42.320 41.078 1.242 1
1 701 . 19 1 1 A 60 60 LEU N N 290 114.980 120.132 -5.152 1
1 702 . 19 1 1 A 61 61 LYS H H 291 7.440 7.306 0.134 1
1 703 . 19 1 1 A 61 61 LYS HA H 291 4.280 4.311 -0.031 1
1 710 . 19 1 1 A 61 61 LYS CA C 291 56.860 56.514 0.346 1
1 711 . 19 1 1 A 61 61 LYS CB C 291 31.900 32.709 -0.809 1
1 714 . 19 1 1 A 61 61 LYS N N 291 118.120 116.869 1.251 1
1 715 . 19 1 1 A 62 62 THR H H 292 7.310 7.530 -0.220 1
1 716 . 19 1 1 A 62 62 THR HA H 292 5.220 4.748 0.472 1
1 721 . 19 1 1 A 62 62 THR CA C 292 55.830 58.959 -3.129 1
1 722 . 19 1 1 A 62 62 THR CB C 292 69.970 71.130 -1.160 1
1 724 . 19 1 1 A 62 62 THR N N 292 111.890 114.391 -2.501 1
1 725 . 19 1 1 A 63 63 PRO HA H 293 4.570 4.473 0.097 1
1 730 . 19 1 1 A 63 63 PRO CA C 293 63.710 64.619 -0.909 1
1 731 . 19 1 1 A 63 63 PRO CB C 293 32.380 32.047 0.333 1
1 733 . 19 1 1 A 64 64 ASN H H 294 8.050 8.844 -0.794 1
1 734 . 19 1 1 A 64 64 ASN HA H 294 4.490 4.496 -0.006 1
1 739 . 19 1 1 A 64 64 ASN CA C 294 55.630 55.056 0.574 1
1 740 . 19 1 1 A 64 64 ASN CB C 294 38.730 38.047 0.683 1
1 741 . 19 1 1 A 64 64 ASN N N 294 117.120 116.620 0.500 1
1 743 . 19 1 1 A 65 65 LEU H H 295 7.550 7.446 0.104 1
1 744 . 19 1 1 A 65 65 LEU HA H 295 4.640 4.632 0.008 1
1 754 . 19 1 1 A 65 65 LEU CA C 295 54.310 53.163 1.147 1
1 755 . 19 1 1 A 65 65 LEU CB C 295 43.640 43.202 0.438 1
1 758 . 19 1 1 A 65 65 LEU N N 295 119.930 119.044 0.886 1
1 759 . 19 1 1 A 66 66 GLY H H 296 7.850 8.624 -0.774 1
1 760 . 19 1 1 A 66 66 GLY HA2 H 296 3.810 4.143 -0.333 1
1 761 . 19 1 1 A 66 66 GLY HA3 H 296 4.110 4.144 -0.034 1
1 762 . 19 1 1 A 66 66 GLY CA C 296 43.570 44.255 -0.685 1
1 763 . 19 1 1 A 66 66 GLY N N 296 108.840 111.540 -2.700 1
1 764 . 19 1 1 A 67 67 LYS H H 297 8.820 8.743 0.077 1
1 765 . 19 1 1 A 67 67 LYS HA H 297 3.980 3.913 0.067 1
1 774 . 19 1 1 A 67 67 LYS CA C 297 60.100 59.600 0.500 1
1 775 . 19 1 1 A 67 67 LYS CB C 297 32.100 32.203 -0.103 1
1 779 . 19 1 1 A 67 67 LYS N N 297 120.130 120.143 -0.013 1
1 780 . 19 1 1 A 68 68 LYS H H 298 8.850 7.983 0.867 1
1 781 . 19 1 1 A 68 68 LYS HA H 298 4.060 4.090 -0.030 1
1 790 . 19 1 1 A 68 68 LYS CA C 298 60.600 59.143 1.457 1
1 791 . 19 1 1 A 68 68 LYS CB C 298 31.920 32.269 -0.349 1
1 795 . 19 1 1 A 68 68 LYS N N 298 119.580 119.103 0.477 1
1 796 . 19 1 1 A 69 69 SER H H 299 8.100 7.860 0.240 1
1 797 . 19 1 1 A 69 69 SER HA H 299 4.370 4.137 0.233 1
1 800 . 19 1 1 A 69 69 SER CA C 299 61.980 61.710 0.270 1
1 801 . 19 1 1 A 69 69 SER CB C 299 63.000 63.351 -0.351 1
1 802 . 19 1 1 A 69 69 SER N N 299 116.360 115.005 1.355 1
1 803 . 19 1 1 A 70 70 LEU H H 300 8.240 7.967 0.273 1
1 804 . 19 1 1 A 70 70 LEU HA H 300 3.970 4.050 -0.080 1
1 814 . 19 1 1 A 70 70 LEU CA C 300 57.610 57.897 -0.287 1
1 815 . 19 1 1 A 70 70 LEU CB C 300 41.060 41.581 -0.521 1
1 819 . 19 1 1 A 70 70 LEU N N 300 123.330 122.293 1.037 1
1 820 . 19 1 1 A 71 71 THR H H 301 8.550 7.667 0.883 1
1 821 . 19 1 1 A 71 71 THR HA H 301 3.690 3.833 -0.143 1
1 826 . 19 1 1 A 71 71 THR CA C 301 67.170 67.099 0.071 1
1 827 . 19 1 1 A 71 71 THR CB C 301 68.810 68.642 0.168 1
1 829 . 19 1 1 A 71 71 THR N N 301 116.520 114.940 1.580 1
1 830 . 19 1 1 A 72 72 GLU H H 302 7.520 8.102 -0.582 1
1 831 . 19 1 1 A 72 72 GLU HA H 302 4.070 3.972 0.098 1
1 836 . 19 1 1 A 72 72 GLU CA C 302 59.470 59.399 0.071 1
1 837 . 19 1 1 A 72 72 GLU CB C 302 29.090 29.476 -0.386 1
1 839 . 19 1 1 A 72 72 GLU N N 302 121.510 121.104 0.406 1
1 840 . 19 1 1 A 73 73 ILE H H 303 8.290 8.046 0.244 1
1 841 . 19 1 1 A 73 73 ILE HA H 303 3.380 3.642 -0.262 1
1 849 . 19 1 1 A 73 73 ILE CA C 303 66.010 65.530 0.480 1
1 850 . 19 1 1 A 73 73 ILE CB C 303 38.680 37.719 0.961 1
1 853 . 19 1 1 A 73 73 ILE N N 303 118.510 120.083 -1.573 1
1 854 . 19 1 1 A 74 74 LYS H H 304 8.550 7.956 0.594 1
1 855 . 19 1 1 A 74 74 LYS HA H 304 3.680 3.897 -0.217 1
1 864 . 19 1 1 A 74 74 LYS CA C 304 61.320 59.561 1.759 1
1 865 . 19 1 1 A 74 74 LYS CB C 304 32.060 32.054 0.006 1
1 868 . 19 1 1 A 74 74 LYS N N 304 118.220 120.384 -2.164 1
1 869 . 19 1 1 A 75 75 ASP H H 305 8.450 8.082 0.368 1
1 870 . 19 1 1 A 75 75 ASP HA H 305 4.440 4.406 0.034 1
1 873 . 19 1 1 A 75 75 ASP CA C 305 57.690 57.178 0.512 1
1 874 . 19 1 1 A 75 75 ASP CB C 305 40.220 40.920 -0.700 1
1 875 . 19 1 1 A 75 75 ASP N N 305 121.790 119.888 1.902 1
1 876 . 19 1 1 A 76 76 VAL H H 306 8.680 7.808 0.872 1
1 877 . 19 1 1 A 76 76 VAL HA H 306 3.890 3.616 0.274 1
1 885 . 19 1 1 A 76 76 VAL CA C 306 66.020 66.186 -0.166 1
1 886 . 19 1 1 A 76 76 VAL CB C 306 31.250 31.435 -0.185 1
1 889 . 19 1 1 A 76 76 VAL N N 306 121.150 119.891 1.259 1
1 890 . 19 1 1 A 77 77 LEU H H 307 8.470 8.669 -0.199 1
1 891 . 19 1 1 A 77 77 LEU HA H 307 3.810 4.119 -0.309 1
1 901 . 19 1 1 A 77 77 LEU CA C 307 58.330 57.521 0.809 1
1 902 . 19 1 1 A 77 77 LEU CB C 307 41.250 41.037 0.213 1
1 906 . 19 1 1 A 77 77 LEU N N 307 120.830 120.491 0.339 1
1 907 . 19 1 1 A 78 78 ALA H H 308 8.280 8.411 -0.131 1
1 908 . 19 1 1 A 78 78 ALA HA H 308 4.320 4.087 0.233 1
1 912 . 19 1 1 A 78 78 ALA CA C 308 55.420 55.036 0.384 1
1 913 . 19 1 1 A 78 78 ALA CB C 308 17.750 18.163 -0.413 1
1 914 . 19 1 1 A 78 78 ALA N N 308 122.530 121.339 1.191 1
1 915 . 19 1 1 A 79 79 SER H H 309 7.900 7.677 0.223 1
1 916 . 19 1 1 A 79 79 SER HA H 309 4.340 4.331 0.009 1
1 919 . 19 1 1 A 79 79 SER CA C 309 61.350 59.176 2.174 1
1 920 . 19 1 1 A 79 79 SER CB C 309 63.280 64.071 -0.791 1
1 921 . 19 1 1 A 79 79 SER N N 309 115.600 111.576 4.024 1
1 922 . 19 1 1 A 80 80 ARG H H 310 7.450 8.317 -0.867 1
1 923 . 19 1 1 A 80 80 ARG HA H 310 4.550 4.001 0.549 1
1 931 . 19 1 1 A 80 80 ARG CA C 310 54.200 57.248 -3.048 1
1 932 . 19 1 1 A 80 80 ARG CB C 310 30.680 27.158 3.522 1
1 935 . 19 1 1 A 80 80 ARG N N 310 119.360 116.099 3.261 1
1 936 . 19 1 1 A 81 81 GLY H H 311 7.940 8.292 -0.352 1
1 937 . 19 1 1 A 81 81 GLY HA2 H 311 3.840 3.956 -0.116 1
1 938 . 19 1 1 A 81 81 GLY HA3 H 311 4.070 3.959 0.111 1
1 939 . 19 1 1 A 81 81 GLY CA C 311 46.060 45.329 0.731 1
1 940 . 19 1 1 A 81 81 GLY N N 311 108.130 105.996 2.134 1
1 941 . 19 1 1 A 82 82 LEU H H 312 7.920 7.744 0.176 1
1 942 . 19 1 1 A 82 82 LEU HA H 312 4.680 4.893 -0.213 1
1 952 . 19 1 1 A 82 82 LEU CA C 312 53.070 54.088 -1.018 1
1 953 . 19 1 1 A 82 82 LEU CB C 312 45.790 44.889 0.901 1
1 957 . 19 1 1 A 82 82 LEU N N 312 119.290 121.242 -1.952 1
1 958 . 19 1 1 A 83 83 SER H H 313 7.530 8.993 -1.463 1
1 959 . 19 1 1 A 83 83 SER HA H 313 4.450 4.171 0.279 1
1 962 . 19 1 1 A 83 83 SER CA C 313 57.190 59.088 -1.898 1
1 963 . 19 1 1 A 83 83 SER CB C 313 66.080 62.457 3.623 1
1 964 . 19 1 1 A 83 83 SER N N 313 113.120 121.538 -8.418 1
1 965 . 19 1 1 A 84 84 LEU H H 314 8.340 8.386 -0.046 1
1 966 . 19 1 1 A 84 84 LEU HA H 314 4.620 4.395 0.225 1
1 976 . 19 1 1 A 84 84 LEU CA C 314 54.720 54.837 -0.117 1
1 977 . 19 1 1 A 84 84 LEU CB C 314 41.620 42.301 -0.681 1
1 981 . 19 1 1 A 84 84 LEU N N 314 115.930 119.834 -3.904 1
1 982 . 19 1 1 A 85 85 GLY H H 315 8.270 7.824 0.446 1
1 983 . 19 1 1 A 85 85 GLY HA2 H 315 3.320 3.960 -0.640 1
1 984 . 19 1 1 A 85 85 GLY HA3 H 315 3.850 3.960 -0.110 1
1 985 . 19 1 1 A 85 85 GLY CA C 315 46.560 46.533 0.027 1
1 986 . 19 1 1 A 85 85 GLY N N 315 111.010 108.066 2.944 1
1 987 . 19 1 1 A 86 86 MET H H 316 8.650 8.146 0.504 1
1 988 . 19 1 1 A 86 86 MET HA H 316 3.990 4.784 -0.794 1
1 996 . 19 1 1 A 86 86 MET CA C 316 56.730 55.498 1.232 1
1 997 . 19 1 1 A 86 86 MET CB C 316 33.600 34.776 -1.176 1
1 1000 . 19 1 1 A 86 86 MET N N 316 120.570 119.346 1.224 1
1 1001 . 19 1 1 A 87 87 ARG H H 317 8.360 8.411 -0.051 1
1 1002 . 19 1 1 A 87 87 ARG HA H 317 4.450 5.254 -0.804 1
1 1010 . 19 1 1 A 87 87 ARG CA C 317 55.310 54.610 0.700 1
1 1011 . 19 1 1 A 87 87 ARG CB C 317 30.490 33.598 -3.108 1
1 1014 . 19 1 1 A 87 87 ARG N N 317 122.290 119.424 2.866 1
1 1015 . 19 1 1 A 88 88 LEU H H 318 8.400 8.774 -0.374 1
1 1016 . 19 1 1 A 88 88 LEU HA H 318 4.670 4.955 -0.285 1
1 1026 . 19 1 1 A 88 88 LEU CA C 318 53.110 53.200 -0.090 1
1 1027 . 19 1 1 A 88 88 LEU CB C 318 43.600 45.589 -1.989 1
1 1031 . 19 1 1 A 88 88 LEU N N 318 126.420 125.067 1.353 1
1 1032 . 19 1 1 A 89 89 GLU H H 319 8.780 8.958 -0.178 1
1 1033 . 19 1 1 A 89 89 GLU HA H 319 4.340 4.005 0.335 1
1 1038 . 19 1 1 A 89 89 GLU CA C 319 56.490 59.353 -2.863 1
1 1039 . 19 1 1 A 89 89 GLU CB C 319 30.470 29.608 0.862 1
1 1041 . 19 1 1 A 89 89 GLU N N 319 123.070 123.061 0.009 1
1 1042 . 19 1 1 A 90 90 ASN H H 320 8.900 8.342 0.558 1
1 1043 . 19 1 1 A 90 90 ASN HA H 320 4.410 4.997 -0.587 1
1 1048 . 19 1 1 A 90 90 ASN CA C 320 54.120 54.502 -0.382 1
1 1049 . 19 1 1 A 90 90 ASN CB C 320 37.640 41.032 -3.392 1
1 1050 . 19 1 1 A 90 90 ASN N N 320 116.540 112.910 3.630 1
1 1052 . 19 1 1 A 91 91 TRP H H 321 7.990 7.374 0.616 1
1 1053 . 19 1 1 A 91 91 TRP HA H 321 4.330 4.783 -0.453 1
1 1062 . 19 1 1 A 91 91 TRP CA C 321 54.590 58.543 -3.953 1
1 1063 . 19 1 1 A 91 91 TRP CB C 321 31.280 31.195 0.085 1
1 1069 . 19 1 1 A 91 91 TRP N N 321 119.230 114.564 4.666 1
1 1071 . 19 1 1 A 92 92 PRO HA H 322 4.800 3.916 0.884 1
1 1077 . 19 1 1 A 93 93 PRO HA H 323 4.450 4.510 -0.060 1
1 1084 . 19 1 1 A 93 93 PRO CA C 323 61.970 62.378 -0.408 1
1 1085 . 19 1 1 A 93 93 PRO CB C 323 32.830 32.684 0.146 1
1 1088 . 19 1 1 A 94 94 ALA H H 324 8.460 8.804 -0.344 1
1 1089 . 19 1 1 A 94 94 ALA HA H 324 4.000 3.969 0.031 1
1 1093 . 19 1 1 A 94 94 ALA CA C 324 53.790 54.729 -0.939 1
1 1094 . 19 1 1 A 94 94 ALA CB C 324 18.640 18.132 0.508 1
1 1095 . 19 1 1 A 94 94 ALA N N 324 124.010 126.472 -2.462 1
1 1096 . 19 1 1 A 95 95 SER H H 325 7.950 8.027 -0.077 1
1 1097 . 19 1 1 A 95 95 SER HA H 325 4.210 4.073 0.137 1
1 1100 . 19 1 1 A 95 95 SER CA C 325 58.970 62.146 -3.176 1
1 1101 . 19 1 1 A 95 95 SER CB C 325 63.040 63.259 -0.219 1
1 1102 . 19 1 1 A 95 95 SER N N 325 111.520 114.874 -3.354 1
1 1103 . 19 1 1 A 96 96 ILE H H 326 7.480 7.218 0.262 1
1 1104 . 19 1 1 A 96 96 ILE HA H 326 4.170 3.213 0.957 1
1 1114 . 19 1 1 A 96 96 ILE CA C 326 61.300 65.117 -3.817 1
1 1115 . 19 1 1 A 96 96 ILE CB C 326 38.530 37.489 1.041 1
1 1119 . 19 1 1 A 96 96 ILE N N 326 119.650 119.841 -0.191 1
1 1120 . 19 1 1 A 97 97 ALA H H 327 7.860 7.314 0.546 1
1 1121 . 19 1 1 A 97 97 ALA HA H 327 4.230 4.141 0.089 1
1 1125 . 19 1 1 A 97 97 ALA CA C 327 52.570 52.101 0.469 1
1 1126 . 19 1 1 A 97 97 ALA CB C 327 19.590 19.512 0.078 1
1 1127 . 19 1 1 A 97 97 ALA N N 327 126.480 123.233 3.247 1
1 1128 . 19 1 1 A 98 98 ASP H H 328 8.250 8.937 -0.687 1
1 1129 . 19 1 1 A 98 98 ASP HA H 328 4.540 4.256 0.284 1
1 1132 . 19 1 1 A 98 98 ASP CA C 328 54.150 57.428 -3.278 1
1 1133 . 19 1 1 A 98 98 ASP CB C 328 41.120 40.627 0.493 1
1 1134 . 19 1 1 A 98 98 ASP N N 328 120.130 122.161 -2.031 1
1 1150 . 19 2 2 B 6 6 ASP H H 427 8.160 8.240 -0.080 1
1 1151 . 19 2 2 B 6 6 ASP HA H 427 4.630 4.347 0.283 1
1 1154 . 19 2 2 B 6 6 ASP CA C 427 54.410 56.719 -2.309 1
1 1155 . 19 2 2 B 6 6 ASP CB C 427 41.250 40.574 0.676 1
1 1156 . 19 2 2 B 6 6 ASP N N 427 120.160 121.919 -1.759 1
1 1157 . 19 2 2 B 7 7 ASN H H 428 8.350 7.618 0.732 1
1 1158 . 19 2 2 B 7 7 ASN HA H 428 4.550 4.938 -0.388 1
1 1163 . 19 2 2 B 7 7 ASN CA C 428 53.310 53.026 0.284 1
1 1164 . 19 2 2 B 7 7 ASN CB C 428 38.850 38.644 0.206 1
1 1165 . 19 2 2 B 7 7 ASN N N 428 118.440 114.758 3.682 1
1 1167 . 19 2 2 B 8 8 LYS H H 429 8.030 7.508 0.522 1
1 1172 . 19 2 2 B 8 8 LYS CB C 429 33.280 33.264 0.016 1
1 1174 . 19 2 2 B 8 8 LYS N N 429 120.260 122.176 -1.916 1
1 1175 . 19 2 2 B 9 9 PRO HA H 430 4.420 4.585 -0.165 1
1 1182 . 19 2 2 B 9 9 PRO CA C 430 62.280 62.729 -0.449 1
1 1183 . 19 2 2 B 9 9 PRO CB C 430 31.920 32.440 -0.520 1
1 1186 . 19 2 2 B 10 10 ALA H H 431 8.930 8.091 0.839 1
1 1187 . 19 2 2 B 10 10 ALA HA H 431 4.350 4.498 -0.148 1
1 1191 . 19 2 2 B 10 10 ALA CA C 431 51.070 52.274 -1.204 1
1 1192 . 19 2 2 B 10 10 ALA CB C 431 20.920 19.431 1.489 1
1 1193 . 19 2 2 B 10 10 ALA N N 431 125.000 124.664 0.336 1
1 1194 . 19 2 2 B 11 11 ASP H H 432 8.530 9.120 -0.590 1
1 1195 . 19 2 2 B 11 11 ASP HA H 432 4.220 4.257 -0.037 1
1 1198 . 19 2 2 B 11 11 ASP CA C 432 57.520 57.233 0.287 1
1 1199 . 19 2 2 B 11 11 ASP CB C 432 40.470 40.277 0.193 1
1 1200 . 19 2 2 B 11 11 ASP N N 432 119.610 122.162 -2.552 1
1 1201 . 19 2 2 B 12 12 ASP H H 433 8.340 8.040 0.300 1
1 1202 . 19 2 2 B 12 12 ASP HA H 433 4.160 4.430 -0.270 1
1 1205 . 19 2 2 B 12 12 ASP CA C 433 56.090 57.339 -1.249 1
1 1206 . 19 2 2 B 12 12 ASP CB C 433 38.960 40.973 -2.013 1
1 1207 . 19 2 2 B 12 12 ASP N N 433 116.330 120.962 -4.632 1
1 1208 . 19 2 2 B 13 13 LEU H H 434 7.360 7.820 -0.460 1
1 1209 . 19 2 2 B 13 13 LEU HA H 434 4.050 4.061 -0.011 1
1 1219 . 19 2 2 B 13 13 LEU CA C 434 57.340 57.911 -0.571 1
1 1220 . 19 2 2 B 13 13 LEU CB C 434 42.960 41.687 1.273 1
1 1224 . 19 2 2 B 13 13 LEU N N 434 123.440 121.286 2.154 1
1 1225 . 19 2 2 B 14 14 LEU H H 435 7.670 8.265 -0.595 1
1 1226 . 19 2 2 B 14 14 LEU HA H 435 3.710 4.040 -0.330 1
1 1236 . 19 2 2 B 14 14 LEU CA C 435 57.170 57.703 -0.533 1
1 1237 . 19 2 2 B 14 14 LEU CB C 435 42.590 41.234 1.356 1
1 1241 . 19 2 2 B 14 14 LEU N N 435 115.170 119.417 -4.247 1
1 1242 . 19 2 2 B 15 15 ASN H H 436 7.490 7.891 -0.401 1
1 1243 . 19 2 2 B 15 15 ASN HA H 436 4.640 4.814 -0.174 1
1 1248 . 19 2 2 B 15 15 ASN CA C 436 52.920 52.374 0.546 1
1 1249 . 19 2 2 B 15 15 ASN CB C 436 39.350 38.659 0.691 1
1 1250 . 19 2 2 B 15 15 ASN N N 436 112.280 115.750 -3.470 1
1 1252 . 19 2 2 B 16 16 LEU H H 437 7.300 7.160 0.140 1
1 1253 . 19 2 2 B 16 16 LEU HA H 437 4.100 4.351 -0.251 1
1 1263 . 19 2 2 B 16 16 LEU CA C 437 55.310 54.778 0.532 1
1 1264 . 19 2 2 B 16 16 LEU CB C 437 41.800 42.885 -1.085 1
1 1268 . 19 2 2 B 16 16 LEU N N 437 125.180 121.146 4.034 1
1 1269 . 19 2 2 B 17 17 GLU H H 438 8.590 8.739 -0.149 1
1 1270 . 19 2 2 B 17 17 GLU HA H 438 3.920 4.127 -0.207 1
1 1275 . 19 2 2 B 17 17 GLU CA C 438 58.440 57.422 1.018 1
1 1276 . 19 2 2 B 17 17 GLU CB C 438 29.180 29.461 -0.281 1
1 1278 . 19 2 2 B 17 17 GLU N N 438 129.850 124.748 5.102 1
1 1279 . 19 2 2 B 18 18 GLY H H 439 8.580 8.850 -0.270 1
1 1280 . 19 2 2 B 18 18 GLY HA2 H 439 3.570 3.948 -0.378 1
1 1281 . 19 2 2 B 18 18 GLY HA3 H 439 4.220 3.951 0.269 1
1 1282 . 19 2 2 B 18 18 GLY CA C 439 44.710 45.115 -0.405 1
1 1283 . 19 2 2 B 18 18 GLY N N 439 112.250 112.371 -0.121 1
1 1284 . 19 2 2 B 19 19 VAL H H 440 7.900 7.462 0.438 1
1 1285 . 19 2 2 B 19 19 VAL HA H 440 3.950 4.384 -0.434 1
1 1293 . 19 2 2 B 19 19 VAL CA C 440 62.820 61.027 1.793 1
1 1294 . 19 2 2 B 19 19 VAL CB C 440 31.470 34.356 -2.886 1
1 1297 . 19 2 2 B 19 19 VAL N N 440 121.910 121.894 0.016 1
1 1298 . 19 2 2 B 20 20 ASP H H 441 7.390 8.794 -1.404 1
1 1299 . 19 2 2 B 20 20 ASP HA H 441 4.820 4.774 0.046 1
1 1302 . 19 2 2 B 20 20 ASP CA C 441 51.920 53.554 -1.634 1
1 1303 . 19 2 2 B 20 20 ASP CB C 441 42.090 41.503 0.587 1
1 1304 . 19 2 2 B 20 20 ASP N N 441 124.850 126.401 -1.551 1
1 1305 . 19 2 2 B 21 21 ARG H H 442 8.630 8.717 -0.087 1
1 1306 . 19 2 2 B 21 21 ARG HA H 442 3.810 3.578 0.232 1
1 1313 . 19 2 2 B 21 21 ARG CA C 442 60.710 59.741 0.969 1
1 1314 . 19 2 2 B 21 21 ARG CB C 442 30.020 29.841 0.179 1
1 1317 . 19 2 2 B 21 21 ARG N N 442 120.890 122.674 -1.784 1
1 1318 . 19 2 2 B 22 22 ASP H H 443 8.140 7.917 0.223 1
1 1319 . 19 2 2 B 22 22 ASP HA H 443 4.420 4.156 0.264 1
1 1322 . 19 2 2 B 22 22 ASP CA C 443 57.680 56.949 0.731 1
1 1323 . 19 2 2 B 22 22 ASP CB C 443 40.880 40.897 -0.017 1
1 1324 . 19 2 2 B 22 22 ASP N N 443 116.750 119.710 -2.960 1
1 1325 . 19 2 2 B 23 23 LEU H H 444 8.170 7.759 0.411 1
1 1326 . 19 2 2 B 23 23 LEU HA H 444 4.130 4.016 0.114 1
1 1336 . 19 2 2 B 23 23 LEU CA C 444 57.770 57.876 -0.106 1
1 1337 . 19 2 2 B 23 23 LEU CB C 444 41.230 41.071 0.159 1
1 1341 . 19 2 2 B 23 23 LEU N N 444 122.130 121.445 0.685 1
1 1342 . 19 2 2 B 24 24 ALA H H 445 8.630 8.411 0.219 1
1 1343 . 19 2 2 B 24 24 ALA HA H 445 3.790 4.002 -0.212 1
1 1347 . 19 2 2 B 24 24 ALA CA C 445 55.810 54.393 1.417 1
1 1348 . 19 2 2 B 24 24 ALA CB C 445 18.060 18.140 -0.080 1
1 1349 . 19 2 2 B 24 24 ALA N N 445 120.890 120.855 0.035 1
1 1350 . 19 2 2 B 25 25 PHE H H 446 8.160 7.253 0.907 1
1 1351 . 19 2 2 B 25 25 PHE HA H 446 4.080 4.342 -0.262 1
1 1358 . 19 2 2 B 25 25 PHE CA C 446 62.670 61.514 1.156 1
1 1359 . 19 2 2 B 25 25 PHE CB C 446 39.440 38.475 0.965 1
1 1364 . 19 2 2 B 25 25 PHE N N 446 115.360 116.198 -0.838 1
1 1365 . 19 2 2 B 26 26 LYS H H 447 8.040 7.665 0.375 1
1 1366 . 19 2 2 B 26 26 LYS HA H 447 4.110 4.009 0.101 1
1 1375 . 19 2 2 B 26 26 LYS CA C 447 60.140 59.236 0.904 1
1 1376 . 19 2 2 B 26 26 LYS CB C 447 32.880 32.284 0.596 1
1 1380 . 19 2 2 B 26 26 LYS N N 447 123.110 119.059 4.051 1
1 1381 . 19 2 2 B 27 27 LEU H H 448 8.630 8.175 0.455 1
1 1382 . 19 2 2 B 27 27 LEU HA H 448 3.840 3.949 -0.109 1
1 1392 . 19 2 2 B 27 27 LEU CA C 448 58.210 57.843 0.367 1
1 1393 . 19 2 2 B 27 27 LEU CB C 448 39.760 41.620 -1.860 1
1 1396 . 19 2 2 B 27 27 LEU N N 448 120.890 120.062 0.828 1
1 1397 . 19 2 2 B 28 28 ALA H H 449 8.200 8.237 -0.037 1
1 1398 . 19 2 2 B 28 28 ALA HA H 449 3.760 4.505 -0.745 1
1 1402 . 19 2 2 B 28 28 ALA CA C 449 54.750 55.518 -0.768 1
1 1403 . 19 2 2 B 28 28 ALA CB C 449 18.050 18.103 -0.053 1
1 1404 . 19 2 2 B 28 28 ALA N N 449 123.710 121.845 1.865 1
1 1405 . 19 2 2 B 29 29 ALA H H 450 7.780 8.017 -0.237 1
1 1406 . 19 2 2 B 29 29 ALA HA H 450 4.170 4.035 0.135 1
1 1410 . 19 2 2 B 29 29 ALA CA C 450 54.430 54.978 -0.548 1
1 1411 . 19 2 2 B 29 29 ALA CB C 450 18.040 18.594 -0.554 1
1 1412 . 19 2 2 B 29 29 ALA N N 450 121.020 119.044 1.976 1
1 1413 . 19 2 2 B 30 30 ARG H H 451 7.390 7.626 -0.236 1
1 1414 . 19 2 2 B 30 30 ARG HA H 451 4.540 4.403 0.137 1
1 1421 . 19 2 2 B 30 30 ARG CA C 451 54.510 55.688 -1.178 1
1 1422 . 19 2 2 B 30 30 ARG CB C 451 29.950 29.674 0.276 1
1 1425 . 19 2 2 B 30 30 ARG N N 451 115.480 116.106 -0.626 1
1 1426 . 19 2 2 B 31 31 GLY H H 452 7.950 9.003 -1.053 1
1 1427 . 19 2 2 B 31 31 GLY HA2 H 452 3.550 4.002 -0.452 1
1 1428 . 19 2 2 B 31 31 GLY HA3 H 452 4.200 4.004 0.196 1
1 1429 . 19 2 2 B 31 31 GLY CA C 452 45.380 45.441 -0.061 1
1 1430 . 19 2 2 B 31 31 GLY N N 452 107.740 107.480 0.260 1
1 1431 . 19 2 2 B 32 32 VAL H H 453 7.990 7.682 0.308 1
1 1432 . 19 2 2 B 32 32 VAL HA H 453 3.930 4.063 -0.133 1
1 1440 . 19 2 2 B 32 32 VAL CA C 453 61.420 62.996 -1.576 1
1 1441 . 19 2 2 B 32 32 VAL CB C 453 29.860 31.423 -1.563 1
1 1444 . 19 2 2 B 32 32 VAL N N 453 125.560 121.195 4.365 1
1 1445 . 19 2 2 B 33 33 CYS H H 454 8.460 8.609 -0.149 1
1 1446 . 19 2 2 B 33 33 CYS HA H 454 4.310 4.744 -0.434 1
1 1449 . 19 2 2 B 33 33 CYS CA C 454 60.260 59.507 0.753 1
1 1450 . 19 2 2 B 33 33 CYS CB C 454 30.330 30.285 0.045 1
1 1451 . 19 2 2 B 33 33 CYS N N 454 119.460 126.254 -6.794 1
1 1452 . 19 2 2 B 34 34 THR H H 455 8.080 7.748 0.332 1
1 1453 . 19 2 2 B 34 34 THR HA H 455 4.840 4.379 0.461 1
1 1458 . 19 2 2 B 34 34 THR CA C 455 58.650 63.138 -4.488 1
1 1459 . 19 2 2 B 34 34 THR CB C 455 72.680 69.290 3.390 1
1 1461 . 19 2 2 B 34 34 THR N N 455 108.420 114.793 -6.373 1
1 1462 . 19 2 2 B 35 35 LEU H H 456 8.580 8.756 -0.176 1
1 1463 . 19 2 2 B 35 35 LEU HA H 456 3.790 3.964 -0.174 1
1 1473 . 19 2 2 B 35 35 LEU CA C 456 57.980 58.710 -0.730 1
1 1474 . 19 2 2 B 35 35 LEU CB C 456 42.220 41.703 0.517 1
1 1477 . 19 2 2 B 35 35 LEU N N 456 120.370 128.525 -8.155 1
1 1478 . 19 2 2 B 36 36 GLU H H 457 8.390 8.159 0.231 1
1 1479 . 19 2 2 B 36 36 GLU HA H 457 3.820 3.998 -0.178 1
1 1484 . 19 2 2 B 36 36 GLU CA C 457 59.640 59.925 -0.285 1
1 1485 . 19 2 2 B 36 36 GLU CB C 457 28.780 29.351 -0.571 1
1 1487 . 19 2 2 B 36 36 GLU N N 457 119.450 118.774 0.676 1
1 1488 . 19 2 2 B 37 37 ASP H H 458 7.750 7.912 -0.162 1
1 1489 . 19 2 2 B 37 37 ASP HA H 458 4.140 4.401 -0.261 1
1 1492 . 19 2 2 B 37 37 ASP CA C 458 57.150 57.370 -0.220 1
1 1493 . 19 2 2 B 37 37 ASP CB C 458 42.280 40.664 1.616 1
1 1494 . 19 2 2 B 37 37 ASP N N 458 117.430 119.809 -2.379 1
1 1495 . 19 2 2 B 38 38 LEU H H 459 7.700 7.944 -0.244 1
1 1496 . 19 2 2 B 38 38 LEU HA H 459 3.790 4.113 -0.323 1
1 1506 . 19 2 2 B 38 38 LEU CA C 459 58.080 57.827 0.253 1
1 1507 . 19 2 2 B 38 38 LEU CB C 459 41.130 41.462 -0.332 1
1 1511 . 19 2 2 B 38 38 LEU N N 459 121.280 121.413 -0.133 1
1 1512 . 19 2 2 B 39 39 ALA H H 460 8.190 8.314 -0.124 1
1 1513 . 19 2 2 B 39 39 ALA HA H 460 3.640 3.970 -0.330 1
1 1517 . 19 2 2 B 39 39 ALA CA C 460 54.320 55.409 -1.089 1
1 1518 . 19 2 2 B 39 39 ALA CB C 460 17.140 18.091 -0.951 1
1 1519 . 19 2 2 B 39 39 ALA N N 460 119.400 120.401 -1.001 1
1 1520 . 19 2 2 B 40 40 GLU H H 461 7.340 7.856 -0.516 1
1 1521 . 19 2 2 B 40 40 GLU HA H 461 4.180 4.221 -0.041 1
1 1526 . 19 2 2 B 40 40 GLU CA C 461 57.800 58.907 -1.107 1
1 1527 . 19 2 2 B 40 40 GLU CB C 461 30.600 29.467 1.133 1
1 1529 . 19 2 2 B 40 40 GLU N N 461 110.680 115.896 -5.216 1
1 1530 . 19 2 2 B 41 41 GLN H H 462 7.940 7.702 0.238 1
1 1531 . 19 2 2 B 41 41 GLN HA H 462 4.100 4.412 -0.312 1
1 1538 . 19 2 2 B 41 41 GLN CA C 462 55.310 55.919 -0.609 1
1 1539 . 19 2 2 B 41 41 GLN CB C 462 28.780 29.342 -0.562 1
1 1541 . 19 2 2 B 41 41 GLN N N 462 120.720 117.726 2.994 1
1 1543 . 19 2 2 B 42 42 GLY H H 463 9.000 8.416 0.584 1
1 1544 . 19 2 2 B 42 42 GLY HA2 H 463 3.310 4.280 -0.970 1
1 1545 . 19 2 2 B 42 42 GLY HA3 H 463 4.820 4.282 0.538 1
1 1546 . 19 2 2 B 42 42 GLY CA C 463 42.650 43.722 -1.072 1
1 1547 . 19 2 2 B 42 42 GLY N N 463 104.110 108.807 -4.697 1
1 1548 . 19 2 2 B 43 43 ILE H H 464 7.900 8.721 -0.821 1
1 1549 . 19 2 2 B 43 43 ILE HA H 464 3.260 3.723 -0.463 1
1 1558 . 19 2 2 B 43 43 ILE CA C 464 66.570 64.345 2.225 1
1 1559 . 19 2 2 B 43 43 ILE CB C 464 38.770 37.593 1.177 1
1 1562 . 19 2 2 B 43 43 ILE N N 464 119.410 121.299 -1.889 1
1 1563 . 19 2 2 B 44 44 ASP H H 465 8.730 8.163 0.567 1
1 1564 . 19 2 2 B 44 44 ASP HA H 465 4.310 4.432 -0.122 1
1 1567 . 19 2 2 B 44 44 ASP CA C 465 56.740 57.542 -0.802 1
1 1568 . 19 2 2 B 44 44 ASP CB C 465 40.120 40.069 0.051 1
1 1569 . 19 2 2 B 44 44 ASP N N 465 116.610 121.653 -5.043 1
1 1570 . 19 2 2 B 45 45 ASP H H 466 7.720 8.457 -0.737 1
1 1571 . 19 2 2 B 45 45 ASP HA H 466 4.480 4.471 0.009 1
1 1574 . 19 2 2 B 45 45 ASP CA C 466 57.000 57.053 -0.053 1
1 1575 . 19 2 2 B 45 45 ASP CB C 466 42.270 40.545 1.725 1
1 1576 . 19 2 2 B 45 45 ASP N N 466 117.560 120.086 -2.526 1
1 1577 . 19 2 2 B 46 46 LEU H H 467 7.370 7.651 -0.281 1
1 1578 . 19 2 2 B 46 46 LEU HA H 467 4.410 4.170 0.240 1
1 1587 . 19 2 2 B 46 46 LEU CA C 467 53.660 57.243 -3.583 1
1 1588 . 19 2 2 B 46 46 LEU CB C 467 42.260 41.540 0.720 1
1 1591 . 19 2 2 B 46 46 LEU N N 467 116.890 119.729 -2.839 1
1 1592 . 19 2 2 B 47 47 ALA H H 468 7.080 8.738 -1.658 1
1 1593 . 19 2 2 B 47 47 ALA HA H 468 4.120 4.025 0.095 1
1 1597 . 19 2 2 B 47 47 ALA CA C 468 54.130 54.890 -0.760 1
1 1598 . 19 2 2 B 47 47 ALA CB C 468 19.480 18.367 1.113 1
1 1599 . 19 2 2 B 47 47 ALA N N 468 120.150 122.671 -2.521 1
1 1600 . 19 2 2 B 48 48 ASP H H 469 8.560 8.133 0.427 1
1 1601 . 19 2 2 B 48 48 ASP HA H 469 4.410 4.442 -0.032 1
1 1604 . 19 2 2 B 48 48 ASP CA C 469 54.330 57.561 -3.231 1
1 1605 . 19 2 2 B 48 48 ASP CB C 469 39.760 40.676 -0.916 1
1 1606 . 19 2 2 B 48 48 ASP N N 469 114.660 116.669 -2.009 1
1 1607 . 19 2 2 B 49 49 ILE H H 470 7.870 8.079 -0.209 1
1 1608 . 19 2 2 B 49 49 ILE HA H 470 3.850 4.337 -0.487 1
1 1618 . 19 2 2 B 49 49 ILE CA C 470 61.680 60.658 1.022 1
1 1619 . 19 2 2 B 49 49 ILE CB C 470 37.120 38.721 -1.601 1
1 1623 . 19 2 2 B 49 49 ILE N N 470 121.600 119.940 1.660 1
1 1624 . 19 2 2 B 50 50 GLU H H 471 8.680 8.996 -0.316 1
1 1625 . 19 2 2 B 50 50 GLU HA H 471 3.940 4.060 -0.120 1
1 1630 . 19 2 2 B 50 50 GLU CA C 471 58.360 59.222 -0.862 1
1 1631 . 19 2 2 B 50 50 GLU CB C 471 29.530 29.309 0.221 1
1 1633 . 19 2 2 B 50 50 GLU N N 471 131.000 126.388 4.612 1
1 1634 . 19 2 2 B 51 51 GLY H H 472 8.860 8.228 0.632 1
1 1635 . 19 2 2 B 51 51 GLY HA2 H 472 3.640 4.011 -0.371 1
1 1636 . 19 2 2 B 51 51 GLY HA3 H 472 4.230 4.012 0.218 1
1 1637 . 19 2 2 B 51 51 GLY CA C 472 45.190 46.688 -1.498 1
1 1638 . 19 2 2 B 51 51 GLY N N 472 113.580 108.398 5.182 1
1 1639 . 19 2 2 B 52 52 LEU H H 473 7.850 7.841 0.009 1
1 1640 . 19 2 2 B 52 52 LEU HA H 473 4.680 4.694 -0.014 1
1 1650 . 19 2 2 B 52 52 LEU CA C 473 53.640 53.842 -0.202 1
1 1651 . 19 2 2 B 52 52 LEU CB C 473 42.990 43.389 -0.399 1
1 1655 . 19 2 2 B 52 52 LEU N N 473 123.020 120.484 2.536 1
1 1656 . 19 2 2 B 53 53 THR H H 474 7.550 8.818 -1.268 1
1 1657 . 19 2 2 B 53 53 THR HA H 474 4.560 4.817 -0.257 1
1 1662 . 19 2 2 B 53 53 THR CA C 474 60.060 60.896 -0.836 1
1 1663 . 19 2 2 B 53 53 THR CB C 474 71.520 71.109 0.411 1
1 1665 . 19 2 2 B 53 53 THR N N 474 115.070 119.050 -3.980 1
1 1666 . 19 2 2 B 54 54 ASP H H 475 8.900 8.985 -0.085 1
1 1667 . 19 2 2 B 54 54 ASP HA H 475 4.220 4.246 -0.026 1
1 1670 . 19 2 2 B 54 54 ASP CA C 475 57.520 58.108 -0.588 1
1 1671 . 19 2 2 B 54 54 ASP CB C 475 39.560 40.233 -0.673 1
1 1672 . 19 2 2 B 54 54 ASP N N 475 121.800 123.821 -2.021 1
1 1673 . 19 2 2 B 55 55 GLU H H 476 8.460 7.910 0.550 1
1 1674 . 19 2 2 B 55 55 GLU HA H 476 3.970 4.159 -0.189 1
1 1679 . 19 2 2 B 55 55 GLU CA C 476 59.440 59.084 0.356 1
1 1680 . 19 2 2 B 55 55 GLU CB C 476 29.650 29.907 -0.257 1
1 1682 . 19 2 2 B 55 55 GLU N N 476 119.460 120.504 -1.044 1
1 1683 . 19 2 2 B 56 56 LYS H H 477 7.790 8.060 -0.270 1
1 1684 . 19 2 2 B 56 56 LYS HA H 477 4.120 4.066 0.054 1
1 1693 . 19 2 2 B 56 56 LYS CA C 477 58.890 59.242 -0.352 1
1 1694 . 19 2 2 B 56 56 LYS CB C 477 32.600 32.189 0.411 1
1 1698 . 19 2 2 B 56 56 LYS N N 477 121.840 121.324 0.516 1
1 1699 . 19 2 2 B 57 57 ALA H H 478 8.900 9.014 -0.114 1
1 1700 . 19 2 2 B 57 57 ALA HA H 478 3.790 4.026 -0.236 1
1 1704 . 19 2 2 B 57 57 ALA CA C 478 55.810 55.378 0.432 1
1 1705 . 19 2 2 B 57 57 ALA CB C 478 18.590 18.494 0.096 1
1 1706 . 19 2 2 B 57 57 ALA N N 478 121.350 121.720 -0.370 1
1 1707 . 19 2 2 B 58 58 GLY H H 479 8.300 8.173 0.127 1
1 1708 . 19 2 2 B 58 58 GLY HA2 H 479 3.500 3.830 -0.330 1
1 1709 . 19 2 2 B 58 58 GLY HA3 H 479 3.890 3.831 0.059 1
1 1710 . 19 2 2 B 58 58 GLY CA C 479 47.360 47.210 0.150 1
1 1711 . 19 2 2 B 58 58 GLY N N 479 102.040 107.428 -5.388 1
1 1712 . 19 2 2 B 59 59 ALA H H 480 7.580 8.620 -1.040 1
1 1713 . 19 2 2 B 59 59 ALA HA H 480 4.110 4.007 0.103 1
1 1717 . 19 2 2 B 59 59 ALA CA C 480 55.580 54.769 0.811 1
1 1718 . 19 2 2 B 59 59 ALA CB C 480 18.130 18.302 -0.172 1
1 1719 . 19 2 2 B 59 59 ALA N N 480 123.180 124.287 -1.107 1
1 1720 . 19 2 2 B 60 60 LEU H H 481 8.290 8.069 0.221 1
1 1721 . 19 2 2 B 60 60 LEU HA H 481 4.020 3.964 0.056 1
1 1731 . 19 2 2 B 60 60 LEU CA C 481 57.850 57.801 0.049 1
1 1732 . 19 2 2 B 60 60 LEU CB C 481 42.360 41.714 0.646 1
1 1736 . 19 2 2 B 60 60 LEU N N 481 120.560 117.671 2.889 1
1 1737 . 19 2 2 B 61 61 ILE H H 482 8.080 8.338 -0.258 1
1 1738 . 19 2 2 B 61 61 ILE HA H 482 3.210 3.489 -0.279 1
1 1748 . 19 2 2 B 61 61 ILE CA C 482 66.250 65.213 1.037 1
1 1749 . 19 2 2 B 61 61 ILE CB C 482 39.400 37.636 1.764 1
1 1753 . 19 2 2 B 61 61 ILE N N 482 119.170 119.582 -0.412 1
1 1754 . 19 2 2 B 62 62 MET H H 483 8.110 8.371 -0.261 1
1 1755 . 19 2 2 B 62 62 MET HA H 483 4.410 4.119 0.291 1
1 1763 . 19 2 2 B 62 62 MET CA C 483 56.110 58.755 -2.645 1
1 1764 . 19 2 2 B 62 62 MET CB C 483 28.260 32.317 -4.057 1
1 1767 . 19 2 2 B 62 62 MET N N 483 114.420 118.137 -3.717 1
1 1768 . 19 2 2 B 63 63 ALA H H 484 8.240 7.869 0.371 1
1 1769 . 19 2 2 B 63 63 ALA HA H 484 4.130 4.048 0.082 1
1 1773 . 19 2 2 B 63 63 ALA CA C 484 55.300 55.211 0.089 1
1 1774 . 19 2 2 B 63 63 ALA CB C 484 18.280 18.584 -0.304 1
1 1775 . 19 2 2 B 63 63 ALA N N 484 123.710 121.487 2.223 1
1 1776 . 19 2 2 B 64 64 ALA H H 485 8.050 8.347 -0.297 1
1 1777 . 19 2 2 B 64 64 ALA HA H 485 3.870 3.957 -0.087 1
1 1781 . 19 2 2 B 64 64 ALA CA C 485 55.330 55.204 0.126 1
1 1782 . 19 2 2 B 64 64 ALA CB C 485 17.660 18.672 -1.012 1
1 1783 . 19 2 2 B 64 64 ALA N N 485 120.070 120.026 0.044 1
1 1784 . 19 2 2 B 65 65 ARG H H 486 8.640 8.820 -0.180 1
1 1785 . 19 2 2 B 65 65 ARG HA H 486 2.800 4.119 -1.319 1
1 1792 . 19 2 2 B 65 65 ARG CA C 486 60.600 59.629 0.971 1
1 1793 . 19 2 2 B 65 65 ARG CB C 486 29.910 30.076 -0.166 1
1 1796 . 19 2 2 B 65 65 ARG N N 486 118.730 117.997 0.733 1
1 1797 . 19 2 2 B 66 66 ASN H H 487 8.710 8.589 0.121 1
1 1798 . 19 2 2 B 66 66 ASN HA H 487 4.550 3.802 0.748 1
1 1803 . 19 2 2 B 66 66 ASN CA C 487 56.390 55.733 0.657 1
1 1804 . 19 2 2 B 66 66 ASN CB C 487 37.970 38.355 -0.385 1
1 1805 . 19 2 2 B 66 66 ASN N N 487 119.170 117.670 1.500 1
1 1807 . 19 2 2 B 67 67 ILE H H 488 7.250 7.550 -0.300 1
1 1808 . 19 2 2 B 67 67 ILE HA H 488 3.810 3.769 0.041 1
1 1818 . 19 2 2 B 67 67 ILE CA C 488 64.350 64.834 -0.484 1
1 1819 . 19 2 2 B 67 67 ILE CB C 488 39.570 37.402 2.168 1
1 1823 . 19 2 2 B 67 67 ILE N N 488 117.890 119.137 -1.247 1
1 1824 . 19 2 2 B 68 68 CYS H H 489 8.350 8.316 0.034 1
1 1825 . 19 2 2 B 68 68 CYS HA H 489 4.080 4.057 0.023 1
1 1828 . 19 2 2 B 68 68 CYS CA C 489 62.670 63.539 -0.869 1
1 1829 . 19 2 2 B 68 68 CYS CB C 489 28.170 27.826 0.344 1
1 1830 . 19 2 2 B 68 68 CYS N N 489 115.230 118.789 -3.559 1
1 1831 . 19 2 2 B 69 69 TRP H H 490 8.230 8.752 -0.522 1
1 1832 . 19 2 2 B 69 69 TRP HA H 490 5.100 4.292 0.808 1
1 1841 . 19 2 2 B 69 69 TRP CA C 490 55.420 60.480 -5.060 1
1 1842 . 19 2 2 B 69 69 TRP CB C 490 31.010 29.286 1.724 1
1 1844 . 19 2 2 B 69 69 TRP N N 490 116.850 120.700 -3.850 1
1 1846 . 19 2 2 B 70 70 PHE H H 491 7.570 7.696 -0.126 1
1 1847 . 19 2 2 B 70 70 PHE HA H 491 5.240 4.466 0.774 1
1 1852 . 19 2 2 B 70 70 PHE CA C 491 55.490 60.337 -4.847 1
1 1853 . 19 2 2 B 70 70 PHE CB C 491 38.700 39.127 -0.427 1
1 1856 . 19 2 2 B 70 70 PHE N N 491 117.460 117.537 -0.077 1
1 1857 . 19 2 2 B 71 71 GLY H H 492 8.420 8.611 -0.191 1
1 1858 . 19 2 2 B 71 71 GLY HA2 H 492 3.920 3.887 0.033 1
1 1859 . 19 2 2 B 71 71 GLY HA3 H 492 4.080 3.898 0.182 1
1 1860 . 19 2 2 B 71 71 GLY CA C 492 46.210 46.991 -0.781 1
1 1861 . 19 2 2 B 71 71 GLY N N 492 110.040 107.931 2.109 1
1 1862 . 19 2 2 B 72 72 ASP H H 493 8.370 9.121 -0.751 1
1 1863 . 19 2 2 B 72 72 ASP HA H 493 4.630 4.365 0.265 1
1 1866 . 19 2 2 B 72 72 ASP CA C 493 54.410 57.058 -2.648 1
1 1867 . 19 2 2 B 72 72 ASP CB C 493 41.250 40.481 0.769 1
1 1868 . 19 2 2 B 72 72 ASP N N 493 120.000 126.698 -6.698 1
1 1869 . 19 2 2 B 73 73 GLU H H 494 8.230 7.757 0.473 1
1 1870 . 19 2 2 B 73 73 GLU HA H 494 4.260 4.143 0.117 1
1 1875 . 19 2 2 B 73 73 GLU CA C 494 56.510 59.179 -2.669 1
1 1876 . 19 2 2 B 73 73 GLU CB C 494 30.420 30.030 0.390 1
1 1878 . 19 2 2 B 73 73 GLU N N 494 120.900 118.862 2.038 1
1 216 . 20 1 1 A 20 20 ASP H H 250 8.550 8.729 -0.179 1
1 217 . 20 1 1 A 20 20 ASP HA H 250 4.700 4.564 0.136 1
1 220 . 20 1 1 A 20 20 ASP CA C 250 52.650 52.554 0.096 1
1 221 . 20 1 1 A 20 20 ASP CB C 250 41.420 41.570 -0.150 1
1 222 . 20 1 1 A 20 20 ASP N N 250 125.190 123.464 1.726 1
1 223 . 20 1 1 A 21 21 PRO HA H 251 4.250 4.497 -0.247 1
1 230 . 20 1 1 A 21 21 PRO CA C 251 65.120 64.658 0.462 1
1 231 . 20 1 1 A 21 21 PRO CB C 251 32.310 32.149 0.161 1
1 234 . 20 1 1 A 22 22 ILE H H 252 8.630 7.746 0.884 1
1 235 . 20 1 1 A 22 22 ILE HA H 252 4.060 3.947 0.113 1
1 245 . 20 1 1 A 22 22 ILE CA C 252 62.990 63.166 -0.176 1
1 246 . 20 1 1 A 22 22 ILE CB C 252 37.520 37.692 -0.172 1
1 250 . 20 1 1 A 22 22 ILE N N 252 119.860 117.123 2.737 1
1 251 . 20 1 1 A 23 23 LEU H H 253 7.950 7.592 0.358 1
1 252 . 20 1 1 A 23 23 LEU HA H 253 3.710 4.216 -0.506 1
1 262 . 20 1 1 A 23 23 LEU CA C 253 56.510 57.588 -1.078 1
1 263 . 20 1 1 A 23 23 LEU CB C 253 41.190 41.322 -0.132 1
1 266 . 20 1 1 A 23 23 LEU N N 253 116.850 122.238 -5.388 1
1 267 . 20 1 1 A 24 24 LEU H H 254 7.370 7.401 -0.031 1
1 268 . 20 1 1 A 24 24 LEU HA H 254 4.310 4.823 -0.513 1
1 278 . 20 1 1 A 24 24 LEU CA C 254 54.890 54.949 -0.059 1
1 279 . 20 1 1 A 24 24 LEU CB C 254 41.960 42.492 -0.532 1
1 283 . 20 1 1 A 24 24 LEU N N 254 115.210 118.241 -3.031 1
1 284 . 20 1 1 A 25 25 ARG H H 255 7.520 8.067 -0.547 1
1 285 . 20 1 1 A 25 25 ARG HA H 255 4.660 4.313 0.347 1
1 293 . 20 1 1 A 25 25 ARG CA C 255 52.840 54.679 -1.839 1
1 294 . 20 1 1 A 25 25 ARG CB C 255 28.130 29.646 -1.516 1
1 297 . 20 1 1 A 25 25 ARG N N 255 118.180 120.279 -2.099 1
1 298 . 20 1 1 A 26 26 PRO HA H 256 4.800 4.944 -0.144 1
1 305 . 20 1 1 A 26 26 PRO CA C 256 61.790 62.791 -1.001 1
1 306 . 20 1 1 A 26 26 PRO CB C 256 32.660 31.960 0.700 1
1 309 . 20 1 1 A 27 27 VAL H H 257 8.170 8.486 -0.316 1
1 310 . 20 1 1 A 27 27 VAL HA H 257 3.590 3.754 -0.164 1
1 318 . 20 1 1 A 27 27 VAL CA C 257 64.830 65.525 -0.695 1
1 319 . 20 1 1 A 27 27 VAL CB C 257 31.720 31.455 0.265 1
1 322 . 20 1 1 A 27 27 VAL N N 257 115.710 124.445 -8.735 1
1 323 . 20 1 1 A 28 28 ASP H H 258 8.240 8.170 0.070 1
1 324 . 20 1 1 A 28 28 ASP HA H 258 4.340 4.374 -0.034 1
1 327 . 20 1 1 A 28 28 ASP CA C 258 56.490 57.482 -0.992 1
1 328 . 20 1 1 A 28 28 ASP CB C 258 40.520 41.631 -1.111 1
1 329 . 20 1 1 A 28 28 ASP N N 258 119.000 121.069 -2.069 1
1 330 . 20 1 1 A 29 29 ASP H H 259 8.000 8.864 -0.864 1
1 331 . 20 1 1 A 29 29 ASP HA H 259 4.390 4.589 -0.199 1
1 334 . 20 1 1 A 29 29 ASP CA C 259 56.210 55.977 0.233 1
1 335 . 20 1 1 A 29 29 ASP CB C 259 40.670 40.849 -0.179 1
1 336 . 20 1 1 A 29 29 ASP N N 259 118.900 117.246 1.654 1
1 337 . 20 1 1 A 30 30 LEU H H 260 7.760 7.481 0.279 1
1 338 . 20 1 1 A 30 30 LEU HA H 260 3.990 4.226 -0.236 1
1 348 . 20 1 1 A 30 30 LEU CA C 260 55.000 55.087 -0.087 1
1 349 . 20 1 1 A 30 30 LEU CB C 260 41.670 42.242 -0.572 1
1 353 . 20 1 1 A 30 30 LEU N N 260 116.300 121.016 -4.716 1
1 354 . 20 1 1 A 31 31 GLU H H 261 7.990 8.897 -0.907 1
1 355 . 20 1 1 A 31 31 GLU HA H 261 4.280 4.024 0.256 1
1 358 . 20 1 1 A 31 31 GLU CA C 261 56.860 58.825 -1.965 1
1 359 . 20 1 1 A 31 31 GLU CB C 261 27.010 29.773 -2.763 1
1 360 . 20 1 1 A 31 31 GLU N N 261 115.620 123.049 -7.429 1
1 361 . 20 1 1 A 32 32 LEU H H 262 8.000 7.360 0.640 1
1 362 . 20 1 1 A 32 32 LEU HA H 262 4.400 4.318 0.082 1
1 372 . 20 1 1 A 32 32 LEU CA C 262 53.860 54.909 -1.049 1
1 373 . 20 1 1 A 32 32 LEU CB C 262 44.450 42.152 2.298 1
1 377 . 20 1 1 A 32 32 LEU N N 262 118.860 122.823 -3.963 1
1 378 . 20 1 1 A 33 33 THR H H 263 10.020 8.655 1.365 1
1 379 . 20 1 1 A 33 33 THR HA H 263 4.130 4.611 -0.481 1
1 384 . 20 1 1 A 33 33 THR CA C 263 62.400 60.852 1.548 1
1 385 . 20 1 1 A 33 33 THR CB C 263 71.270 71.234 0.036 1
1 387 . 20 1 1 A 33 33 THR N N 263 114.610 113.880 0.730 1
1 388 . 20 1 1 A 34 34 VAL H H 264 8.370 8.760 -0.390 1
1 389 . 20 1 1 A 34 34 VAL HA H 264 3.620 3.644 -0.024 1
1 397 . 20 1 1 A 34 34 VAL CA C 264 66.340 66.515 -0.175 1
1 398 . 20 1 1 A 34 34 VAL CB C 264 31.670 31.332 0.338 1
1 401 . 20 1 1 A 34 34 VAL N N 264 122.110 122.156 -0.046 1
1 402 . 20 1 1 A 35 35 ARG H H 265 8.190 8.250 -0.060 1
1 403 . 20 1 1 A 35 35 ARG HA H 265 4.070 3.968 0.102 1
1 411 . 20 1 1 A 35 35 ARG CA C 265 59.470 59.992 -0.522 1
1 412 . 20 1 1 A 35 35 ARG CB C 265 29.790 29.897 -0.107 1
1 415 . 20 1 1 A 35 35 ARG N N 265 117.340 120.036 -2.696 1
1 416 . 20 1 1 A 36 36 SER H H 266 7.610 7.416 0.194 1
1 417 . 20 1 1 A 36 36 SER HA H 266 4.080 4.097 -0.017 1
1 420 . 20 1 1 A 36 36 SER CA C 266 63.080 61.603 1.477 1
1 421 . 20 1 1 A 36 36 SER CB C 266 63.280 63.026 0.254 1
1 422 . 20 1 1 A 36 36 SER N N 266 116.710 115.217 1.493 1
1 423 . 20 1 1 A 37 37 ALA H H 267 8.720 7.704 1.016 1
1 424 . 20 1 1 A 37 37 ALA HA H 267 3.760 4.039 -0.279 1
1 428 . 20 1 1 A 37 37 ALA CA C 267 55.900 55.240 0.660 1
1 429 . 20 1 1 A 37 37 ALA CB C 267 18.090 18.277 -0.187 1
1 430 . 20 1 1 A 37 37 ALA N N 267 124.170 122.346 1.824 1
1 431 . 20 1 1 A 38 38 ASN H H 268 8.850 9.012 -0.162 1
1 432 . 20 1 1 A 38 38 ASN HA H 268 4.420 4.527 -0.107 1
1 437 . 20 1 1 A 38 38 ASN CA C 268 55.700 56.185 -0.485 1
1 438 . 20 1 1 A 38 38 ASN CB C 268 37.180 37.723 -0.543 1
1 439 . 20 1 1 A 38 38 ASN N N 268 117.370 117.492 -0.122 1
1 441 . 20 1 1 A 39 39 CYS H H 269 7.970 8.227 -0.257 1
1 442 . 20 1 1 A 39 39 CYS HA H 269 4.190 4.088 0.102 1
1 445 . 20 1 1 A 39 39 CYS CA C 269 63.340 62.973 0.367 1
1 446 . 20 1 1 A 39 39 CYS CB C 269 26.870 27.061 -0.191 1
1 447 . 20 1 1 A 39 39 CYS N N 269 120.510 118.662 1.848 1
1 448 . 20 1 1 A 40 40 LEU H H 270 7.600 7.705 -0.105 1
1 449 . 20 1 1 A 40 40 LEU HA H 270 3.880 3.906 -0.026 1
1 458 . 20 1 1 A 40 40 LEU CA C 270 57.810 57.942 -0.132 1
1 459 . 20 1 1 A 40 40 LEU CB C 270 40.030 41.272 -1.242 1
1 462 . 20 1 1 A 40 40 LEU N N 270 117.710 120.403 -2.693 1
1 463 . 20 1 1 A 41 41 LYS H H 271 7.980 8.379 -0.399 1
1 464 . 20 1 1 A 41 41 LYS HA H 271 3.820 4.224 -0.404 1
1 472 . 20 1 1 A 41 41 LYS CA C 271 59.840 59.707 0.133 1
1 473 . 20 1 1 A 41 41 LYS CB C 271 32.070 32.194 -0.124 1
1 476 . 20 1 1 A 41 41 LYS N N 271 120.070 117.197 2.873 1
1 477 . 20 1 1 A 42 42 ALA H H 272 7.860 9.078 -1.218 1
1 478 . 20 1 1 A 42 42 ALA HA H 272 4.140 4.056 0.084 1
1 482 . 20 1 1 A 42 42 ALA CA C 272 54.670 54.570 0.100 1
1 483 . 20 1 1 A 42 42 ALA CB C 272 17.950 18.568 -0.618 1
1 484 . 20 1 1 A 42 42 ALA N N 272 122.880 120.738 2.142 1
1 485 . 20 1 1 A 43 43 GLU H H 273 7.210 8.210 -1.000 1
1 486 . 20 1 1 A 43 43 GLU HA H 273 4.260 4.437 -0.177 1
1 491 . 20 1 1 A 43 43 GLU CA C 273 55.020 55.298 -0.278 1
1 492 . 20 1 1 A 43 43 GLU CB C 273 29.880 29.686 0.194 1
1 494 . 20 1 1 A 43 43 GLU N N 273 116.590 117.480 -0.890 1
1 495 . 20 1 1 A 44 44 ALA H H 274 7.880 8.198 -0.318 1
1 496 . 20 1 1 A 44 44 ALA HA H 274 3.680 3.827 -0.147 1
1 500 . 20 1 1 A 44 44 ALA CA C 274 52.960 53.045 -0.085 1
1 501 . 20 1 1 A 44 44 ALA CB C 274 16.110 17.037 -0.927 1
1 502 . 20 1 1 A 44 44 ALA N N 274 118.420 119.682 -1.262 1
1 503 . 20 1 1 A 45 45 ILE H H 275 7.600 7.423 0.177 1
1 504 . 20 1 1 A 45 45 ILE HA H 275 3.870 4.192 -0.322 1
1 514 . 20 1 1 A 45 45 ILE CA C 275 61.150 60.279 0.871 1
1 515 . 20 1 1 A 45 45 ILE CB C 275 37.090 39.147 -2.057 1
1 519 . 20 1 1 A 45 45 ILE N N 275 120.370 117.739 2.631 1
1 520 . 20 1 1 A 46 46 HIS H H 276 8.350 8.639 -0.289 1
1 521 . 20 1 1 A 46 46 HIS HA H 276 4.600 4.709 -0.109 1
1 526 . 20 1 1 A 46 46 HIS CA C 276 56.900 57.226 -0.326 1
1 527 . 20 1 1 A 46 46 HIS CB C 276 31.910 30.416 1.494 1
1 529 . 20 1 1 A 46 46 HIS N N 276 123.250 125.987 -2.737 1
1 530 . 20 1 1 A 47 47 TYR H H 277 8.850 7.762 1.088 1
1 531 . 20 1 1 A 47 47 TYR HA H 277 5.100 4.821 0.279 1
1 538 . 20 1 1 A 47 47 TYR CA C 277 57.430 57.095 0.335 1
1 539 . 20 1 1 A 47 47 TYR CB C 277 40.680 40.268 0.412 1
1 544 . 20 1 1 A 47 47 TYR N N 277 119.700 117.970 1.730 1
1 545 . 20 1 1 A 48 48 ILE H H 278 9.380 8.409 0.971 1
1 546 . 20 1 1 A 48 48 ILE HA H 278 3.340 3.693 -0.353 1
1 554 . 20 1 1 A 48 48 ILE CA C 278 67.640 64.835 2.805 1
1 555 . 20 1 1 A 48 48 ILE CB C 278 36.310 37.500 -1.190 1
1 558 . 20 1 1 A 48 48 ILE N N 278 125.650 125.024 0.626 1
1 559 . 20 1 1 A 49 49 GLY H H 279 9.430 8.065 1.365 1
1 560 . 20 1 1 A 49 49 GLY HA2 H 279 2.370 2.874 -0.504 1
1 561 . 20 1 1 A 49 49 GLY HA3 H 279 3.230 3.758 -0.528 1
1 562 . 20 1 1 A 49 49 GLY CA C 279 46.820 47.168 -0.348 1
1 563 . 20 1 1 A 49 49 GLY N N 279 105.200 108.550 -3.350 1
1 564 . 20 1 1 A 50 50 ASP H H 280 7.050 7.533 -0.483 1
1 565 . 20 1 1 A 50 50 ASP HA H 280 4.360 4.168 0.192 1
1 568 . 20 1 1 A 50 50 ASP CA C 280 57.110 56.258 0.852 1
1 569 . 20 1 1 A 50 50 ASP CB C 280 42.620 40.483 2.137 1
1 570 . 20 1 1 A 50 50 ASP N N 280 116.360 120.913 -4.553 1
1 571 . 20 1 1 A 51 51 LEU H H 281 7.170 8.302 -1.132 1
1 572 . 20 1 1 A 51 51 LEU HA H 281 3.880 3.956 -0.076 1
1 582 . 20 1 1 A 51 51 LEU CA C 281 57.900 58.363 -0.463 1
1 583 . 20 1 1 A 51 51 LEU CB C 281 41.870 41.693 0.177 1
1 587 . 20 1 1 A 51 51 LEU N N 281 120.130 122.103 -1.973 1
1 588 . 20 1 1 A 52 52 VAL H H 282 7.820 7.659 0.161 1
1 589 . 20 1 1 A 52 52 VAL HA H 282 3.980 3.847 0.133 1
1 597 . 20 1 1 A 52 52 VAL CA C 282 64.000 65.463 -1.463 1
1 598 . 20 1 1 A 52 52 VAL CB C 282 30.400 31.303 -0.903 1
1 601 . 20 1 1 A 52 52 VAL N N 282 105.550 115.681 -10.131 1
1 602 . 20 1 1 A 53 53 GLN H H 283 6.550 7.849 -1.299 1
1 603 . 20 1 1 A 53 53 GLN HA H 283 4.680 4.151 0.529 1
1 610 . 20 1 1 A 53 53 GLN CA C 283 56.210 58.796 -2.586 1
1 611 . 20 1 1 A 53 53 GLN CB C 283 31.710 28.498 3.212 1
1 613 . 20 1 1 A 53 53 GLN N N 283 114.060 121.699 -7.639 1
1 615 . 20 1 1 A 54 54 ARG H H 284 7.690 7.660 0.030 1
1 616 . 20 1 1 A 54 54 ARG HA H 284 4.520 4.636 -0.116 1
1 624 . 20 1 1 A 54 54 ARG CA C 284 54.600 55.064 -0.464 1
1 625 . 20 1 1 A 54 54 ARG CB C 284 30.750 31.834 -1.084 1
1 628 . 20 1 1 A 54 54 ARG N N 284 119.810 118.836 0.974 1
1 629 . 20 1 1 A 55 55 THR H H 285 8.110 8.661 -0.551 1
1 630 . 20 1 1 A 55 55 THR HA H 285 4.430 4.312 0.118 1
1 635 . 20 1 1 A 55 55 THR CA C 285 59.640 63.801 -4.161 1
1 636 . 20 1 1 A 55 55 THR CB C 285 71.310 69.235 2.075 1
1 638 . 20 1 1 A 55 55 THR N N 285 108.450 119.146 -10.696 1
1 639 . 20 1 1 A 56 56 GLU H H 286 8.910 9.021 -0.111 1
1 640 . 20 1 1 A 56 56 GLU HA H 286 3.660 3.956 -0.296 1
1 645 . 20 1 1 A 56 56 GLU CA C 286 60.650 59.690 0.960 1
1 646 . 20 1 1 A 56 56 GLU CB C 286 29.400 29.212 0.188 1
1 648 . 20 1 1 A 56 56 GLU N N 286 120.600 126.470 -5.870 1
1 649 . 20 1 1 A 57 57 VAL H H 287 7.600 8.102 -0.502 1
1 650 . 20 1 1 A 57 57 VAL HA H 287 3.620 3.524 0.096 1
1 658 . 20 1 1 A 57 57 VAL CA C 287 66.020 67.132 -1.112 1
1 659 . 20 1 1 A 57 57 VAL CB C 287 31.720 31.566 0.154 1
1 662 . 20 1 1 A 57 57 VAL N N 287 114.050 119.831 -5.781 1
1 663 . 20 1 1 A 58 58 GLU H H 288 7.350 8.224 -0.874 1
1 664 . 20 1 1 A 58 58 GLU HA H 288 3.830 4.047 -0.217 1
1 669 . 20 1 1 A 58 58 GLU CA C 288 59.250 59.563 -0.313 1
1 670 . 20 1 1 A 58 58 GLU CB C 288 30.030 29.017 1.013 1
1 672 . 20 1 1 A 58 58 GLU N N 288 117.610 119.153 -1.543 1
1 673 . 20 1 1 A 59 59 LEU H H 289 7.850 8.089 -0.239 1
1 674 . 20 1 1 A 59 59 LEU HA H 289 4.150 3.989 0.161 1
1 683 . 20 1 1 A 59 59 LEU CA C 289 57.340 57.906 -0.566 1
1 684 . 20 1 1 A 59 59 LEU CB C 289 41.170 41.641 -0.471 1
1 687 . 20 1 1 A 59 59 LEU N N 289 120.050 120.749 -0.699 1
1 688 . 20 1 1 A 60 60 LEU H H 290 7.670 8.274 -0.604 1
1 689 . 20 1 1 A 60 60 LEU HA H 290 4.540 3.948 0.592 1
1 696 . 20 1 1 A 60 60 LEU CA C 290 55.090 57.308 -2.218 1
1 697 . 20 1 1 A 60 60 LEU CB C 290 42.320 41.180 1.140 1
1 701 . 20 1 1 A 60 60 LEU N N 290 114.980 118.394 -3.414 1
1 702 . 20 1 1 A 61 61 LYS H H 291 7.440 7.435 0.005 1
1 703 . 20 1 1 A 61 61 LYS HA H 291 4.280 4.312 -0.032 1
1 710 . 20 1 1 A 61 61 LYS CA C 291 56.860 57.309 -0.449 1
1 711 . 20 1 1 A 61 61 LYS CB C 291 31.900 33.057 -1.157 1
1 714 . 20 1 1 A 61 61 LYS N N 291 118.120 116.618 1.502 1
1 715 . 20 1 1 A 62 62 THR H H 292 7.310 7.650 -0.340 1
1 716 . 20 1 1 A 62 62 THR HA H 292 5.220 4.386 0.834 1
1 721 . 20 1 1 A 62 62 THR CA C 292 55.830 60.370 -4.540 1
1 722 . 20 1 1 A 62 62 THR CB C 292 69.970 69.027 0.943 1
1 724 . 20 1 1 A 62 62 THR N N 292 111.890 115.052 -3.162 1
1 725 . 20 1 1 A 63 63 PRO HA H 293 4.570 4.447 0.123 1
1 730 . 20 1 1 A 63 63 PRO CA C 293 63.710 64.317 -0.607 1
1 731 . 20 1 1 A 63 63 PRO CB C 293 32.380 31.938 0.442 1
1 733 . 20 1 1 A 64 64 ASN H H 294 8.050 8.851 -0.801 1
1 734 . 20 1 1 A 64 64 ASN HA H 294 4.490 4.447 0.043 1
1 739 . 20 1 1 A 64 64 ASN CA C 294 55.630 55.515 0.115 1
1 740 . 20 1 1 A 64 64 ASN CB C 294 38.730 38.173 0.557 1
1 741 . 20 1 1 A 64 64 ASN N N 294 117.120 117.006 0.114 1
1 743 . 20 1 1 A 65 65 LEU H H 295 7.550 7.320 0.230 1
1 744 . 20 1 1 A 65 65 LEU HA H 295 4.640 4.476 0.164 1
1 754 . 20 1 1 A 65 65 LEU CA C 295 54.310 53.808 0.502 1
1 755 . 20 1 1 A 65 65 LEU CB C 295 43.640 42.858 0.782 1
1 758 . 20 1 1 A 65 65 LEU N N 295 119.930 118.629 1.301 1
1 759 . 20 1 1 A 66 66 GLY H H 296 7.850 8.631 -0.781 1
1 760 . 20 1 1 A 66 66 GLY HA2 H 296 3.810 4.101 -0.291 1
1 761 . 20 1 1 A 66 66 GLY HA3 H 296 4.110 4.102 0.008 1
1 762 . 20 1 1 A 66 66 GLY CA C 296 43.570 44.584 -1.014 1
1 763 . 20 1 1 A 66 66 GLY N N 296 108.840 109.456 -0.616 1
1 764 . 20 1 1 A 67 67 LYS H H 297 8.820 8.620 0.200 1
1 765 . 20 1 1 A 67 67 LYS HA H 297 3.980 3.911 0.069 1
1 774 . 20 1 1 A 67 67 LYS CA C 297 60.100 59.630 0.470 1
1 775 . 20 1 1 A 67 67 LYS CB C 297 32.100 32.220 -0.120 1
1 779 . 20 1 1 A 67 67 LYS N N 297 120.130 120.368 -0.238 1
1 780 . 20 1 1 A 68 68 LYS H H 298 8.850 7.951 0.899 1
1 781 . 20 1 1 A 68 68 LYS HA H 298 4.060 4.057 0.003 1
1 790 . 20 1 1 A 68 68 LYS CA C 298 60.600 59.164 1.436 1
1 791 . 20 1 1 A 68 68 LYS CB C 298 31.920 32.358 -0.438 1
1 795 . 20 1 1 A 68 68 LYS N N 298 119.580 119.074 0.506 1
1 796 . 20 1 1 A 69 69 SER H H 299 8.100 7.799 0.301 1
1 797 . 20 1 1 A 69 69 SER HA H 299 4.370 4.142 0.228 1
1 800 . 20 1 1 A 69 69 SER CA C 299 61.980 61.715 0.265 1
1 801 . 20 1 1 A 69 69 SER CB C 299 63.000 63.272 -0.272 1
1 802 . 20 1 1 A 69 69 SER N N 299 116.360 114.677 1.683 1
1 803 . 20 1 1 A 70 70 LEU H H 300 8.240 8.347 -0.107 1
1 804 . 20 1 1 A 70 70 LEU HA H 300 3.970 3.952 0.018 1
1 814 . 20 1 1 A 70 70 LEU CA C 300 57.610 57.971 -0.361 1
1 815 . 20 1 1 A 70 70 LEU CB C 300 41.060 41.690 -0.630 1
1 819 . 20 1 1 A 70 70 LEU N N 300 123.330 121.839 1.491 1
1 820 . 20 1 1 A 71 71 THR H H 301 8.550 7.892 0.658 1
1 821 . 20 1 1 A 71 71 THR HA H 301 3.690 3.783 -0.093 1
1 826 . 20 1 1 A 71 71 THR CA C 301 67.170 66.605 0.565 1
1 827 . 20 1 1 A 71 71 THR CB C 301 68.810 68.456 0.354 1
1 829 . 20 1 1 A 71 71 THR N N 301 116.520 114.874 1.646 1
1 830 . 20 1 1 A 72 72 GLU H H 302 7.520 8.481 -0.961 1
1 831 . 20 1 1 A 72 72 GLU HA H 302 4.070 3.967 0.103 1
1 836 . 20 1 1 A 72 72 GLU CA C 302 59.470 59.503 -0.033 1
1 837 . 20 1 1 A 72 72 GLU CB C 302 29.090 29.280 -0.190 1
1 839 . 20 1 1 A 72 72 GLU N N 302 121.510 119.162 2.348 1
1 840 . 20 1 1 A 73 73 ILE H H 303 8.290 7.942 0.348 1
1 841 . 20 1 1 A 73 73 ILE HA H 303 3.380 3.587 -0.207 1
1 849 . 20 1 1 A 73 73 ILE CA C 303 66.010 65.534 0.476 1
1 850 . 20 1 1 A 73 73 ILE CB C 303 38.680 37.811 0.869 1
1 853 . 20 1 1 A 73 73 ILE N N 303 118.510 120.953 -2.443 1
1 854 . 20 1 1 A 74 74 LYS H H 304 8.550 7.901 0.649 1
1 855 . 20 1 1 A 74 74 LYS HA H 304 3.680 3.835 -0.155 1
1 864 . 20 1 1 A 74 74 LYS CA C 304 61.320 60.541 0.779 1
1 865 . 20 1 1 A 74 74 LYS CB C 304 32.060 31.926 0.134 1
1 868 . 20 1 1 A 74 74 LYS N N 304 118.220 118.635 -0.415 1
1 869 . 20 1 1 A 75 75 ASP H H 305 8.450 7.912 0.538 1
1 870 . 20 1 1 A 75 75 ASP HA H 305 4.440 4.427 0.013 1
1 873 . 20 1 1 A 75 75 ASP CA C 305 57.690 57.081 0.609 1
1 874 . 20 1 1 A 75 75 ASP CB C 305 40.220 40.882 -0.662 1
1 875 . 20 1 1 A 75 75 ASP N N 305 121.790 119.645 2.145 1
1 876 . 20 1 1 A 76 76 VAL H H 306 8.680 8.285 0.395 1
1 877 . 20 1 1 A 76 76 VAL HA H 306 3.890 3.589 0.301 1
1 885 . 20 1 1 A 76 76 VAL CA C 306 66.020 66.669 -0.649 1
1 886 . 20 1 1 A 76 76 VAL CB C 306 31.250 31.437 -0.187 1
1 889 . 20 1 1 A 76 76 VAL N N 306 121.150 119.685 1.465 1
1 890 . 20 1 1 A 77 77 LEU H H 307 8.470 8.639 -0.169 1
1 891 . 20 1 1 A 77 77 LEU HA H 307 3.810 4.039 -0.229 1
1 901 . 20 1 1 A 77 77 LEU CA C 307 58.330 57.721 0.609 1
1 902 . 20 1 1 A 77 77 LEU CB C 307 41.250 41.643 -0.393 1
1 906 . 20 1 1 A 77 77 LEU N N 307 120.830 119.812 1.018 1
1 907 . 20 1 1 A 78 78 ALA H H 308 8.280 8.318 -0.038 1
1 908 . 20 1 1 A 78 78 ALA HA H 308 4.320 4.127 0.193 1
1 912 . 20 1 1 A 78 78 ALA CA C 308 55.420 55.172 0.248 1
1 913 . 20 1 1 A 78 78 ALA CB C 308 17.750 17.932 -0.182 1
1 914 . 20 1 1 A 78 78 ALA N N 308 122.530 121.421 1.109 1
1 915 . 20 1 1 A 79 79 SER H H 309 7.900 7.839 0.061 1
1 916 . 20 1 1 A 79 79 SER HA H 309 4.340 4.465 -0.125 1
1 919 . 20 1 1 A 79 79 SER CA C 309 61.350 58.928 2.422 1
1 920 . 20 1 1 A 79 79 SER CB C 309 63.280 63.569 -0.289 1
1 921 . 20 1 1 A 79 79 SER N N 309 115.600 112.663 2.937 1
1 922 . 20 1 1 A 80 80 ARG H H 310 7.450 8.107 -0.657 1
1 923 . 20 1 1 A 80 80 ARG HA H 310 4.550 3.988 0.562 1
1 931 . 20 1 1 A 80 80 ARG CA C 310 54.200 57.496 -3.296 1
1 932 . 20 1 1 A 80 80 ARG CB C 310 30.680 27.244 3.436 1
1 935 . 20 1 1 A 80 80 ARG N N 310 119.360 117.229 2.131 1
1 936 . 20 1 1 A 81 81 GLY H H 311 7.940 8.163 -0.223 1
1 937 . 20 1 1 A 81 81 GLY HA2 H 311 3.840 3.876 -0.036 1
1 938 . 20 1 1 A 81 81 GLY HA3 H 311 4.070 3.883 0.187 1
1 939 . 20 1 1 A 81 81 GLY CA C 311 46.060 46.379 -0.319 1
1 940 . 20 1 1 A 81 81 GLY N N 311 108.130 107.056 1.074 1
1 941 . 20 1 1 A 82 82 LEU H H 312 7.920 7.684 0.236 1
1 942 . 20 1 1 A 82 82 LEU HA H 312 4.680 4.774 -0.094 1
1 952 . 20 1 1 A 82 82 LEU CA C 312 53.070 53.073 -0.003 1
1 953 . 20 1 1 A 82 82 LEU CB C 312 45.790 45.354 0.436 1
1 957 . 20 1 1 A 82 82 LEU N N 312 119.290 115.119 4.171 1
1 958 . 20 1 1 A 83 83 SER H H 313 7.530 8.713 -1.183 1
1 959 . 20 1 1 A 83 83 SER HA H 313 4.450 4.137 0.313 1
1 962 . 20 1 1 A 83 83 SER CA C 313 57.190 59.473 -2.283 1
1 963 . 20 1 1 A 83 83 SER CB C 313 66.080 61.728 4.352 1
1 964 . 20 1 1 A 83 83 SER N N 313 113.120 113.049 0.071 1
1 965 . 20 1 1 A 84 84 LEU H H 314 8.340 8.255 0.085 1
1 966 . 20 1 1 A 84 84 LEU HA H 314 4.620 4.317 0.303 1
1 976 . 20 1 1 A 84 84 LEU CA C 314 54.720 55.115 -0.395 1
1 977 . 20 1 1 A 84 84 LEU CB C 314 41.620 42.492 -0.872 1
1 981 . 20 1 1 A 84 84 LEU N N 314 115.930 119.904 -3.974 1
1 982 . 20 1 1 A 85 85 GLY H H 315 8.270 7.942 0.328 1
1 983 . 20 1 1 A 85 85 GLY HA2 H 315 3.320 3.968 -0.648 1
1 984 . 20 1 1 A 85 85 GLY HA3 H 315 3.850 3.969 -0.119 1
1 985 . 20 1 1 A 85 85 GLY CA C 315 46.560 46.486 0.074 1
1 986 . 20 1 1 A 85 85 GLY N N 315 111.010 107.721 3.289 1
1 987 . 20 1 1 A 86 86 MET H H 316 8.650 7.947 0.703 1
1 988 . 20 1 1 A 86 86 MET HA H 316 3.990 4.950 -0.960 1
1 996 . 20 1 1 A 86 86 MET CA C 316 56.730 53.681 3.049 1
1 997 . 20 1 1 A 86 86 MET CB C 316 33.600 35.741 -2.141 1
1 1000 . 20 1 1 A 86 86 MET N N 316 120.570 117.281 3.289 1
1 1001 . 20 1 1 A 87 87 ARG H H 317 8.360 8.583 -0.223 1
1 1002 . 20 1 1 A 87 87 ARG HA H 317 4.450 5.308 -0.858 1
1 1010 . 20 1 1 A 87 87 ARG CA C 317 55.310 54.695 0.615 1
1 1011 . 20 1 1 A 87 87 ARG CB C 317 30.490 33.840 -3.350 1
1 1014 . 20 1 1 A 87 87 ARG N N 317 122.290 118.224 4.066 1
1 1015 . 20 1 1 A 88 88 LEU H H 318 8.400 8.841 -0.441 1
1 1016 . 20 1 1 A 88 88 LEU HA H 318 4.670 4.959 -0.289 1
1 1026 . 20 1 1 A 88 88 LEU CA C 318 53.110 53.180 -0.070 1
1 1027 . 20 1 1 A 88 88 LEU CB C 318 43.600 44.713 -1.113 1
1 1031 . 20 1 1 A 88 88 LEU N N 318 126.420 124.825 1.595 1
1 1032 . 20 1 1 A 89 89 GLU H H 319 8.780 9.062 -0.282 1
1 1033 . 20 1 1 A 89 89 GLU HA H 319 4.340 4.036 0.304 1
1 1038 . 20 1 1 A 89 89 GLU CA C 319 56.490 59.492 -3.002 1
1 1039 . 20 1 1 A 89 89 GLU CB C 319 30.470 29.362 1.108 1
1 1041 . 20 1 1 A 89 89 GLU N N 319 123.070 123.911 -0.841 1
1 1042 . 20 1 1 A 90 90 ASN H H 320 8.900 8.700 0.200 1
1 1043 . 20 1 1 A 90 90 ASN HA H 320 4.410 5.158 -0.748 1
1 1048 . 20 1 1 A 90 90 ASN CA C 320 54.120 55.233 -1.113 1
1 1049 . 20 1 1 A 90 90 ASN CB C 320 37.640 40.952 -3.312 1
1 1050 . 20 1 1 A 90 90 ASN N N 320 116.540 116.052 0.488 1
1 1052 . 20 1 1 A 91 91 TRP H H 321 7.990 7.550 0.440 1
1 1053 . 20 1 1 A 91 91 TRP HA H 321 4.330 4.806 -0.476 1
1 1062 . 20 1 1 A 91 91 TRP CA C 321 54.590 58.519 -3.929 1
1 1063 . 20 1 1 A 91 91 TRP CB C 321 31.280 31.080 0.200 1
1 1069 . 20 1 1 A 91 91 TRP N N 321 119.230 118.443 0.787 1
1 1071 . 20 1 1 A 92 92 PRO HA H 322 4.800 3.805 0.995 1
1 1077 . 20 1 1 A 93 93 PRO HA H 323 4.450 4.523 -0.073 1
1 1084 . 20 1 1 A 93 93 PRO CA C 323 61.970 62.401 -0.431 1
1 1085 . 20 1 1 A 93 93 PRO CB C 323 32.830 32.677 0.153 1
1 1088 . 20 1 1 A 94 94 ALA H H 324 8.460 8.769 -0.309 1
1 1089 . 20 1 1 A 94 94 ALA HA H 324 4.000 3.990 0.010 1
1 1093 . 20 1 1 A 94 94 ALA CA C 324 53.790 54.752 -0.962 1
1 1094 . 20 1 1 A 94 94 ALA CB C 324 18.640 18.147 0.493 1
1 1095 . 20 1 1 A 94 94 ALA N N 324 124.010 126.185 -2.175 1
1 1096 . 20 1 1 A 95 95 SER H H 325 7.950 8.072 -0.122 1
1 1097 . 20 1 1 A 95 95 SER HA H 325 4.210 4.170 0.040 1
1 1100 . 20 1 1 A 95 95 SER CA C 325 58.970 62.351 -3.381 1
1 1101 . 20 1 1 A 95 95 SER CB C 325 63.040 63.363 -0.323 1
1 1102 . 20 1 1 A 95 95 SER N N 325 111.520 114.931 -3.411 1
1 1103 . 20 1 1 A 96 96 ILE H H 326 7.480 7.485 -0.005 1
1 1104 . 20 1 1 A 96 96 ILE HA H 326 4.170 2.608 1.562 1
1 1114 . 20 1 1 A 96 96 ILE CA C 326 61.300 64.981 -3.681 1
1 1115 . 20 1 1 A 96 96 ILE CB C 326 38.530 37.290 1.240 1
1 1119 . 20 1 1 A 96 96 ILE N N 326 119.650 120.108 -0.458 1
1 1120 . 20 1 1 A 97 97 ALA H H 327 7.860 7.230 0.630 1
1 1121 . 20 1 1 A 97 97 ALA HA H 327 4.230 4.068 0.162 1
1 1125 . 20 1 1 A 97 97 ALA CA C 327 52.570 52.255 0.315 1
1 1126 . 20 1 1 A 97 97 ALA CB C 327 19.590 19.513 0.077 1
1 1127 . 20 1 1 A 97 97 ALA N N 327 126.480 123.381 3.099 1
1 1128 . 20 1 1 A 98 98 ASP H H 328 8.250 8.870 -0.620 1
1 1129 . 20 1 1 A 98 98 ASP HA H 328 4.540 4.269 0.271 1
1 1132 . 20 1 1 A 98 98 ASP CA C 328 54.150 57.658 -3.508 1
1 1133 . 20 1 1 A 98 98 ASP CB C 328 41.120 40.488 0.632 1
1 1134 . 20 1 1 A 98 98 ASP N N 328 120.130 123.105 -2.975 1
1 1150 . 20 2 2 B 6 6 ASP H H 427 8.160 8.361 -0.201 1
1 1151 . 20 2 2 B 6 6 ASP HA H 427 4.630 4.334 0.296 1
1 1154 . 20 2 2 B 6 6 ASP CA C 427 54.410 56.743 -2.333 1
1 1155 . 20 2 2 B 6 6 ASP CB C 427 41.250 40.695 0.555 1
1 1156 . 20 2 2 B 6 6 ASP N N 427 120.160 120.549 -0.389 1
1 1157 . 20 2 2 B 7 7 ASN H H 428 8.350 7.869 0.481 1
1 1158 . 20 2 2 B 7 7 ASN HA H 428 4.550 4.978 -0.428 1
1 1163 . 20 2 2 B 7 7 ASN CA C 428 53.310 52.417 0.893 1
1 1164 . 20 2 2 B 7 7 ASN CB C 428 38.850 39.467 -0.617 1
1 1165 . 20 2 2 B 7 7 ASN N N 428 118.440 115.736 2.704 1
1 1167 . 20 2 2 B 8 8 LYS H H 429 8.030 6.980 1.050 1
1 1172 . 20 2 2 B 8 8 LYS CB C 429 33.280 32.369 0.911 1
1 1174 . 20 2 2 B 8 8 LYS N N 429 120.260 118.714 1.546 1
1 1175 . 20 2 2 B 9 9 PRO HA H 430 4.420 4.543 -0.123 1
1 1182 . 20 2 2 B 9 9 PRO CA C 430 62.280 62.640 -0.360 1
1 1183 . 20 2 2 B 9 9 PRO CB C 430 31.920 32.467 -0.547 1
1 1186 . 20 2 2 B 10 10 ALA H H 431 8.930 8.125 0.805 1
1 1187 . 20 2 2 B 10 10 ALA HA H 431 4.350 4.488 -0.138 1
1 1191 . 20 2 2 B 10 10 ALA CA C 431 51.070 51.744 -0.674 1
1 1192 . 20 2 2 B 10 10 ALA CB C 431 20.920 19.823 1.097 1
1 1193 . 20 2 2 B 10 10 ALA N N 431 125.000 124.958 0.042 1
1 1194 . 20 2 2 B 11 11 ASP H H 432 8.530 9.191 -0.661 1
1 1195 . 20 2 2 B 11 11 ASP HA H 432 4.220 4.371 -0.151 1
1 1198 . 20 2 2 B 11 11 ASP CA C 432 57.520 56.921 0.599 1
1 1199 . 20 2 2 B 11 11 ASP CB C 432 40.470 39.755 0.715 1
1 1200 . 20 2 2 B 11 11 ASP N N 432 119.610 119.193 0.417 1
1 1201 . 20 2 2 B 12 12 ASP H H 433 8.340 8.065 0.275 1
1 1202 . 20 2 2 B 12 12 ASP HA H 433 4.160 4.422 -0.262 1
1 1205 . 20 2 2 B 12 12 ASP CA C 433 56.090 57.346 -1.256 1
1 1206 . 20 2 2 B 12 12 ASP CB C 433 38.960 41.032 -2.072 1
1 1207 . 20 2 2 B 12 12 ASP N N 433 116.330 120.862 -4.532 1
1 1208 . 20 2 2 B 13 13 LEU H H 434 7.360 7.892 -0.532 1
1 1209 . 20 2 2 B 13 13 LEU HA H 434 4.050 4.068 -0.018 1
1 1219 . 20 2 2 B 13 13 LEU CA C 434 57.340 57.918 -0.578 1
1 1220 . 20 2 2 B 13 13 LEU CB C 434 42.960 41.617 1.343 1
1 1224 . 20 2 2 B 13 13 LEU N N 434 123.440 121.189 2.251 1
1 1225 . 20 2 2 B 14 14 LEU H H 435 7.670 8.143 -0.473 1
1 1226 . 20 2 2 B 14 14 LEU HA H 435 3.710 4.035 -0.325 1
1 1236 . 20 2 2 B 14 14 LEU CA C 435 57.170 57.842 -0.672 1
1 1237 . 20 2 2 B 14 14 LEU CB C 435 42.590 41.305 1.285 1
1 1241 . 20 2 2 B 14 14 LEU N N 435 115.170 119.303 -4.133 1
1 1242 . 20 2 2 B 15 15 ASN H H 436 7.490 8.353 -0.863 1
1 1243 . 20 2 2 B 15 15 ASN HA H 436 4.640 4.827 -0.187 1
1 1248 . 20 2 2 B 15 15 ASN CA C 436 52.920 53.497 -0.577 1
1 1249 . 20 2 2 B 15 15 ASN CB C 436 39.350 39.013 0.337 1
1 1250 . 20 2 2 B 15 15 ASN N N 436 112.280 115.026 -2.746 1
1 1252 . 20 2 2 B 16 16 LEU H H 437 7.300 7.397 -0.097 1
1 1253 . 20 2 2 B 16 16 LEU HA H 437 4.100 4.237 -0.137 1
1 1263 . 20 2 2 B 16 16 LEU CA C 437 55.310 55.278 0.032 1
1 1264 . 20 2 2 B 16 16 LEU CB C 437 41.800 43.030 -1.230 1
1 1268 . 20 2 2 B 16 16 LEU N N 437 125.180 122.980 2.200 1
1 1269 . 20 2 2 B 17 17 GLU H H 438 8.590 8.726 -0.136 1
1 1270 . 20 2 2 B 17 17 GLU HA H 438 3.920 4.014 -0.094 1
1 1275 . 20 2 2 B 17 17 GLU CA C 438 58.440 58.131 0.309 1
1 1276 . 20 2 2 B 17 17 GLU CB C 438 29.180 29.680 -0.500 1
1 1278 . 20 2 2 B 17 17 GLU N N 438 129.850 125.887 3.963 1
1 1279 . 20 2 2 B 18 18 GLY H H 439 8.580 8.849 -0.269 1
1 1280 . 20 2 2 B 18 18 GLY HA2 H 439 3.570 3.927 -0.357 1
1 1281 . 20 2 2 B 18 18 GLY HA3 H 439 4.220 3.930 0.290 1
1 1282 . 20 2 2 B 18 18 GLY CA C 439 44.710 45.442 -0.732 1
1 1283 . 20 2 2 B 18 18 GLY N N 439 112.250 114.849 -2.599 1
1 1284 . 20 2 2 B 19 19 VAL H H 440 7.900 7.755 0.145 1
1 1285 . 20 2 2 B 19 19 VAL HA H 440 3.950 4.440 -0.490 1
1 1293 . 20 2 2 B 19 19 VAL CA C 440 62.820 60.878 1.942 1
1 1294 . 20 2 2 B 19 19 VAL CB C 440 31.470 34.506 -3.036 1
1 1297 . 20 2 2 B 19 19 VAL N N 440 121.910 121.839 0.071 1
1 1298 . 20 2 2 B 20 20 ASP H H 441 7.390 8.938 -1.548 1
1 1299 . 20 2 2 B 20 20 ASP HA H 441 4.820 4.831 -0.011 1
1 1302 . 20 2 2 B 20 20 ASP CA C 441 51.920 53.164 -1.244 1
1 1303 . 20 2 2 B 20 20 ASP CB C 441 42.090 41.746 0.344 1
1 1304 . 20 2 2 B 20 20 ASP N N 441 124.850 126.062 -1.212 1
1 1305 . 20 2 2 B 21 21 ARG H H 442 8.630 8.710 -0.080 1
1 1306 . 20 2 2 B 21 21 ARG HA H 442 3.810 3.432 0.378 1
1 1313 . 20 2 2 B 21 21 ARG CA C 442 60.710 59.667 1.043 1
1 1314 . 20 2 2 B 21 21 ARG CB C 442 30.020 29.773 0.247 1
1 1317 . 20 2 2 B 21 21 ARG N N 442 120.890 122.515 -1.625 1
1 1318 . 20 2 2 B 22 22 ASP H H 443 8.140 7.936 0.204 1
1 1319 . 20 2 2 B 22 22 ASP HA H 443 4.420 4.413 0.007 1
1 1322 . 20 2 2 B 22 22 ASP CA C 443 57.680 57.233 0.447 1
1 1323 . 20 2 2 B 22 22 ASP CB C 443 40.880 40.559 0.321 1
1 1324 . 20 2 2 B 22 22 ASP N N 443 116.750 119.952 -3.202 1
1 1325 . 20 2 2 B 23 23 LEU H H 444 8.170 8.046 0.124 1
1 1326 . 20 2 2 B 23 23 LEU HA H 444 4.130 4.015 0.115 1
1 1336 . 20 2 2 B 23 23 LEU CA C 444 57.770 57.944 -0.174 1
1 1337 . 20 2 2 B 23 23 LEU CB C 444 41.230 41.718 -0.488 1
1 1341 . 20 2 2 B 23 23 LEU N N 444 122.130 120.785 1.345 1
1 1342 . 20 2 2 B 24 24 ALA H H 445 8.630 8.513 0.117 1
1 1343 . 20 2 2 B 24 24 ALA HA H 445 3.790 3.999 -0.209 1
1 1347 . 20 2 2 B 24 24 ALA CA C 445 55.810 54.281 1.529 1
1 1348 . 20 2 2 B 24 24 ALA CB C 445 18.060 18.076 -0.016 1
1 1349 . 20 2 2 B 24 24 ALA N N 445 120.890 120.801 0.089 1
1 1350 . 20 2 2 B 25 25 PHE H H 446 8.160 7.350 0.810 1
1 1351 . 20 2 2 B 25 25 PHE HA H 446 4.080 4.422 -0.342 1
1 1358 . 20 2 2 B 25 25 PHE CA C 446 62.670 60.153 2.517 1
1 1359 . 20 2 2 B 25 25 PHE CB C 446 39.440 38.174 1.266 1
1 1364 . 20 2 2 B 25 25 PHE N N 446 115.360 115.803 -0.443 1
1 1365 . 20 2 2 B 26 26 LYS H H 447 8.040 7.748 0.292 1
1 1366 . 20 2 2 B 26 26 LYS HA H 447 4.110 4.013 0.097 1
1 1375 . 20 2 2 B 26 26 LYS CA C 447 60.140 59.137 1.003 1
1 1376 . 20 2 2 B 26 26 LYS CB C 447 32.880 32.345 0.535 1
1 1380 . 20 2 2 B 26 26 LYS N N 447 123.110 119.031 4.079 1
1 1381 . 20 2 2 B 27 27 LEU H H 448 8.630 8.240 0.390 1
1 1382 . 20 2 2 B 27 27 LEU HA H 448 3.840 4.025 -0.185 1
1 1392 . 20 2 2 B 27 27 LEU CA C 448 58.210 57.727 0.483 1
1 1393 . 20 2 2 B 27 27 LEU CB C 448 39.760 41.136 -1.376 1
1 1396 . 20 2 2 B 27 27 LEU N N 448 120.890 120.022 0.868 1
1 1397 . 20 2 2 B 28 28 ALA H H 449 8.200 8.286 -0.086 1
1 1398 . 20 2 2 B 28 28 ALA HA H 449 3.760 4.519 -0.759 1
1 1402 . 20 2 2 B 28 28 ALA CA C 449 54.750 55.166 -0.416 1
1 1403 . 20 2 2 B 28 28 ALA CB C 449 18.050 18.224 -0.174 1
1 1404 . 20 2 2 B 28 28 ALA N N 449 123.710 121.882 1.828 1
1 1405 . 20 2 2 B 29 29 ALA H H 450 7.780 8.059 -0.279 1
1 1406 . 20 2 2 B 29 29 ALA HA H 450 4.170 3.999 0.171 1
1 1410 . 20 2 2 B 29 29 ALA CA C 450 54.430 55.127 -0.697 1
1 1411 . 20 2 2 B 29 29 ALA CB C 450 18.040 18.606 -0.566 1
1 1412 . 20 2 2 B 29 29 ALA N N 450 121.020 119.298 1.722 1
1 1413 . 20 2 2 B 30 30 ARG H H 451 7.390 7.722 -0.332 1
1 1414 . 20 2 2 B 30 30 ARG HA H 451 4.540 4.406 0.134 1
1 1421 . 20 2 2 B 30 30 ARG CA C 451 54.510 55.697 -1.187 1
1 1422 . 20 2 2 B 30 30 ARG CB C 451 29.950 29.671 0.279 1
1 1425 . 20 2 2 B 30 30 ARG N N 451 115.480 116.117 -0.637 1
1 1426 . 20 2 2 B 31 31 GLY H H 452 7.950 8.482 -0.532 1
1 1427 . 20 2 2 B 31 31 GLY HA2 H 452 3.550 4.007 -0.457 1
1 1428 . 20 2 2 B 31 31 GLY HA3 H 452 4.200 4.009 0.191 1
1 1429 . 20 2 2 B 31 31 GLY CA C 452 45.380 45.444 -0.064 1
1 1430 . 20 2 2 B 31 31 GLY N N 452 107.740 107.496 0.244 1
1 1431 . 20 2 2 B 32 32 VAL H H 453 7.990 7.228 0.762 1
1 1432 . 20 2 2 B 32 32 VAL HA H 453 3.930 4.065 -0.135 1
1 1440 . 20 2 2 B 32 32 VAL CA C 453 61.420 62.978 -1.558 1
1 1441 . 20 2 2 B 32 32 VAL CB C 453 29.860 31.177 -1.317 1
1 1444 . 20 2 2 B 32 32 VAL N N 453 125.560 121.050 4.510 1
1 1445 . 20 2 2 B 33 33 CYS H H 454 8.460 8.568 -0.108 1
1 1446 . 20 2 2 B 33 33 CYS HA H 454 4.310 4.731 -0.421 1
1 1449 . 20 2 2 B 33 33 CYS CA C 454 60.260 59.778 0.482 1
1 1450 . 20 2 2 B 33 33 CYS CB C 454 30.330 30.445 -0.115 1
1 1451 . 20 2 2 B 33 33 CYS N N 454 119.460 126.432 -6.972 1
1 1452 . 20 2 2 B 34 34 THR H H 455 8.080 7.657 0.423 1
1 1453 . 20 2 2 B 34 34 THR HA H 455 4.840 4.304 0.536 1
1 1458 . 20 2 2 B 34 34 THR CA C 455 58.650 63.249 -4.599 1
1 1459 . 20 2 2 B 34 34 THR CB C 455 72.680 69.348 3.332 1
1 1461 . 20 2 2 B 34 34 THR N N 455 108.420 115.170 -6.750 1
1 1462 . 20 2 2 B 35 35 LEU H H 456 8.580 8.758 -0.178 1
1 1463 . 20 2 2 B 35 35 LEU HA H 456 3.790 4.026 -0.236 1
1 1473 . 20 2 2 B 35 35 LEU CA C 456 57.980 58.545 -0.565 1
1 1474 . 20 2 2 B 35 35 LEU CB C 456 42.220 41.250 0.970 1
1 1477 . 20 2 2 B 35 35 LEU N N 456 120.370 128.477 -8.107 1
1 1478 . 20 2 2 B 36 36 GLU H H 457 8.390 8.180 0.210 1
1 1479 . 20 2 2 B 36 36 GLU HA H 457 3.820 3.914 -0.094 1
1 1484 . 20 2 2 B 36 36 GLU CA C 457 59.640 59.931 -0.291 1
1 1485 . 20 2 2 B 36 36 GLU CB C 457 28.780 29.339 -0.559 1
1 1487 . 20 2 2 B 36 36 GLU N N 457 119.450 119.329 0.121 1
1 1488 . 20 2 2 B 37 37 ASP H H 458 7.750 8.157 -0.407 1
1 1489 . 20 2 2 B 37 37 ASP HA H 458 4.140 4.454 -0.314 1
1 1492 . 20 2 2 B 37 37 ASP CA C 458 57.150 57.245 -0.095 1
1 1493 . 20 2 2 B 37 37 ASP CB C 458 42.280 40.619 1.661 1
1 1494 . 20 2 2 B 37 37 ASP N N 458 117.430 119.941 -2.511 1
1 1495 . 20 2 2 B 38 38 LEU H H 459 7.700 7.932 -0.232 1
1 1496 . 20 2 2 B 38 38 LEU HA H 459 3.790 4.130 -0.340 1
1 1506 . 20 2 2 B 38 38 LEU CA C 459 58.080 57.858 0.222 1
1 1507 . 20 2 2 B 38 38 LEU CB C 459 41.130 41.218 -0.088 1
1 1511 . 20 2 2 B 38 38 LEU N N 459 121.280 121.829 -0.549 1
1 1512 . 20 2 2 B 39 39 ALA H H 460 8.190 8.217 -0.027 1
1 1513 . 20 2 2 B 39 39 ALA HA H 460 3.640 4.005 -0.365 1
1 1517 . 20 2 2 B 39 39 ALA CA C 460 54.320 55.136 -0.816 1
1 1518 . 20 2 2 B 39 39 ALA CB C 460 17.140 18.142 -1.002 1
1 1519 . 20 2 2 B 39 39 ALA N N 460 119.400 120.084 -0.684 1
1 1520 . 20 2 2 B 40 40 GLU H H 461 7.340 7.798 -0.458 1
1 1521 . 20 2 2 B 40 40 GLU HA H 461 4.180 4.320 -0.140 1
1 1526 . 20 2 2 B 40 40 GLU CA C 461 57.800 58.383 -0.583 1
1 1527 . 20 2 2 B 40 40 GLU CB C 461 30.600 30.051 0.549 1
1 1529 . 20 2 2 B 40 40 GLU N N 461 110.680 115.430 -4.750 1
1 1530 . 20 2 2 B 41 41 GLN H H 462 7.940 7.785 0.155 1
1 1531 . 20 2 2 B 41 41 GLN HA H 462 4.100 4.431 -0.331 1
1 1538 . 20 2 2 B 41 41 GLN CA C 462 55.310 56.194 -0.884 1
1 1539 . 20 2 2 B 41 41 GLN CB C 462 28.780 29.811 -1.031 1
1 1541 . 20 2 2 B 41 41 GLN N N 462 120.720 117.920 2.800 1
1 1543 . 20 2 2 B 42 42 GLY H H 463 9.000 8.582 0.418 1
1 1544 . 20 2 2 B 42 42 GLY HA2 H 463 3.310 4.401 -1.091 1
1 1545 . 20 2 2 B 42 42 GLY HA3 H 463 4.820 4.405 0.415 1
1 1546 . 20 2 2 B 42 42 GLY CA C 463 42.650 43.382 -0.732 1
1 1547 . 20 2 2 B 42 42 GLY N N 463 104.110 106.878 -2.768 1
1 1548 . 20 2 2 B 43 43 ILE H H 464 7.900 8.663 -0.763 1
1 1549 . 20 2 2 B 43 43 ILE HA H 464 3.260 3.693 -0.433 1
1 1558 . 20 2 2 B 43 43 ILE CA C 464 66.570 64.338 2.232 1
1 1559 . 20 2 2 B 43 43 ILE CB C 464 38.770 37.490 1.280 1
1 1562 . 20 2 2 B 43 43 ILE N N 464 119.410 121.153 -1.743 1
1 1563 . 20 2 2 B 44 44 ASP H H 465 8.730 8.122 0.608 1
1 1564 . 20 2 2 B 44 44 ASP HA H 465 4.310 4.410 -0.100 1
1 1567 . 20 2 2 B 44 44 ASP CA C 465 56.740 57.070 -0.330 1
1 1568 . 20 2 2 B 44 44 ASP CB C 465 40.120 40.061 0.059 1
1 1569 . 20 2 2 B 44 44 ASP N N 465 116.610 121.725 -5.115 1
1 1570 . 20 2 2 B 45 45 ASP H H 466 7.720 8.032 -0.312 1
1 1571 . 20 2 2 B 45 45 ASP HA H 466 4.480 4.483 -0.003 1
1 1574 . 20 2 2 B 45 45 ASP CA C 466 57.000 57.159 -0.159 1
1 1575 . 20 2 2 B 45 45 ASP CB C 466 42.270 41.009 1.261 1
1 1576 . 20 2 2 B 45 45 ASP N N 466 117.560 120.760 -3.200 1
1 1577 . 20 2 2 B 46 46 LEU H H 467 7.370 8.073 -0.703 1
1 1578 . 20 2 2 B 46 46 LEU HA H 467 4.410 4.164 0.246 1
1 1587 . 20 2 2 B 46 46 LEU CA C 467 53.660 57.365 -3.705 1
1 1588 . 20 2 2 B 46 46 LEU CB C 467 42.260 41.325 0.935 1
1 1591 . 20 2 2 B 46 46 LEU N N 467 116.890 120.833 -3.943 1
1 1592 . 20 2 2 B 47 47 ALA H H 468 7.080 8.216 -1.136 1
1 1593 . 20 2 2 B 47 47 ALA HA H 468 4.120 4.031 0.089 1
1 1597 . 20 2 2 B 47 47 ALA CA C 468 54.130 54.904 -0.774 1
1 1598 . 20 2 2 B 47 47 ALA CB C 468 19.480 18.406 1.074 1
1 1599 . 20 2 2 B 47 47 ALA N N 468 120.150 122.770 -2.620 1
1 1600 . 20 2 2 B 48 48 ASP H H 469 8.560 7.785 0.775 1
1 1601 . 20 2 2 B 48 48 ASP HA H 469 4.410 4.401 0.009 1
1 1604 . 20 2 2 B 48 48 ASP CA C 469 54.330 57.581 -3.251 1
1 1605 . 20 2 2 B 48 48 ASP CB C 469 39.760 40.557 -0.797 1
1 1606 . 20 2 2 B 48 48 ASP N N 469 114.660 116.876 -2.216 1
1 1607 . 20 2 2 B 49 49 ILE H H 470 7.870 7.993 -0.123 1
1 1608 . 20 2 2 B 49 49 ILE HA H 470 3.850 4.373 -0.523 1
1 1618 . 20 2 2 B 49 49 ILE CA C 470 61.680 60.664 1.016 1
1 1619 . 20 2 2 B 49 49 ILE CB C 470 37.120 38.835 -1.715 1
1 1623 . 20 2 2 B 49 49 ILE N N 470 121.600 119.963 1.637 1
1 1624 . 20 2 2 B 50 50 GLU H H 471 8.680 9.072 -0.392 1
1 1625 . 20 2 2 B 50 50 GLU HA H 471 3.940 3.952 -0.012 1
1 1630 . 20 2 2 B 50 50 GLU CA C 471 58.360 59.665 -1.305 1
1 1631 . 20 2 2 B 50 50 GLU CB C 471 29.530 29.425 0.105 1
1 1633 . 20 2 2 B 50 50 GLU N N 471 131.000 128.333 2.667 1
1 1634 . 20 2 2 B 51 51 GLY H H 472 8.860 8.100 0.760 1
1 1635 . 20 2 2 B 51 51 GLY HA2 H 472 3.640 4.002 -0.362 1
1 1636 . 20 2 2 B 51 51 GLY HA3 H 472 4.230 4.003 0.227 1
1 1637 . 20 2 2 B 51 51 GLY CA C 472 45.190 47.081 -1.891 1
1 1638 . 20 2 2 B 51 51 GLY N N 472 113.580 107.203 6.377 1
1 1639 . 20 2 2 B 52 52 LEU H H 473 7.850 7.649 0.201 1
1 1640 . 20 2 2 B 52 52 LEU HA H 473 4.680 4.702 -0.022 1
1 1650 . 20 2 2 B 52 52 LEU CA C 473 53.640 53.812 -0.172 1
1 1651 . 20 2 2 B 52 52 LEU CB C 473 42.990 43.431 -0.441 1
1 1655 . 20 2 2 B 52 52 LEU N N 473 123.020 120.214 2.806 1
1 1656 . 20 2 2 B 53 53 THR H H 474 7.550 8.737 -1.187 1
1 1657 . 20 2 2 B 53 53 THR HA H 474 4.560 4.780 -0.220 1
1 1662 . 20 2 2 B 53 53 THR CA C 474 60.060 60.878 -0.818 1
1 1663 . 20 2 2 B 53 53 THR CB C 474 71.520 71.417 0.103 1
1 1665 . 20 2 2 B 53 53 THR N N 474 115.070 117.762 -2.692 1
1 1666 . 20 2 2 B 54 54 ASP H H 475 8.900 9.011 -0.111 1
1 1667 . 20 2 2 B 54 54 ASP HA H 475 4.220 4.283 -0.063 1
1 1670 . 20 2 2 B 54 54 ASP CA C 475 57.520 58.007 -0.487 1
1 1671 . 20 2 2 B 54 54 ASP CB C 475 39.560 40.245 -0.685 1
1 1672 . 20 2 2 B 54 54 ASP N N 475 121.800 123.572 -1.772 1
1 1673 . 20 2 2 B 55 55 GLU H H 476 8.460 8.080 0.380 1
1 1674 . 20 2 2 B 55 55 GLU HA H 476 3.970 4.034 -0.064 1
1 1679 . 20 2 2 B 55 55 GLU CA C 476 59.440 59.157 0.283 1
1 1680 . 20 2 2 B 55 55 GLU CB C 476 29.650 29.443 0.207 1
1 1682 . 20 2 2 B 55 55 GLU N N 476 119.460 119.466 -0.006 1
1 1683 . 20 2 2 B 56 56 LYS H H 477 7.790 7.976 -0.186 1
1 1684 . 20 2 2 B 56 56 LYS HA H 477 4.120 4.084 0.036 1
1 1693 . 20 2 2 B 56 56 LYS CA C 477 58.890 58.900 -0.010 1
1 1694 . 20 2 2 B 56 56 LYS CB C 477 32.600 32.175 0.425 1
1 1698 . 20 2 2 B 56 56 LYS N N 477 121.840 119.719 2.121 1
1 1699 . 20 2 2 B 57 57 ALA H H 478 8.900 9.016 -0.116 1
1 1700 . 20 2 2 B 57 57 ALA HA H 478 3.790 4.054 -0.264 1
1 1704 . 20 2 2 B 57 57 ALA CA C 478 55.810 55.510 0.300 1
1 1705 . 20 2 2 B 57 57 ALA CB C 478 18.590 18.249 0.341 1
1 1706 . 20 2 2 B 57 57 ALA N N 478 121.350 121.548 -0.198 1
1 1707 . 20 2 2 B 58 58 GLY H H 479 8.300 8.173 0.127 1
1 1708 . 20 2 2 B 58 58 GLY HA2 H 479 3.500 3.779 -0.279 1
1 1709 . 20 2 2 B 58 58 GLY HA3 H 479 3.890 3.784 0.106 1
1 1710 . 20 2 2 B 58 58 GLY CA C 479 47.360 47.318 0.042 1
1 1711 . 20 2 2 B 58 58 GLY N N 479 102.040 108.813 -6.773 1
1 1712 . 20 2 2 B 59 59 ALA H H 480 7.580 7.934 -0.354 1
1 1713 . 20 2 2 B 59 59 ALA HA H 480 4.110 4.046 0.064 1
1 1717 . 20 2 2 B 59 59 ALA CA C 480 55.580 54.729 0.851 1
1 1718 . 20 2 2 B 59 59 ALA CB C 480 18.130 18.493 -0.363 1
1 1719 . 20 2 2 B 59 59 ALA N N 480 123.180 124.634 -1.454 1
1 1720 . 20 2 2 B 60 60 LEU H H 481 8.290 7.990 0.300 1
1 1721 . 20 2 2 B 60 60 LEU HA H 481 4.020 3.978 0.042 1
1 1731 . 20 2 2 B 60 60 LEU CA C 481 57.850 57.917 -0.067 1
1 1732 . 20 2 2 B 60 60 LEU CB C 481 42.360 41.514 0.846 1
1 1736 . 20 2 2 B 60 60 LEU N N 481 120.560 118.010 2.550 1
1 1737 . 20 2 2 B 61 61 ILE H H 482 8.080 8.017 0.063 1
1 1738 . 20 2 2 B 61 61 ILE HA H 482 3.210 3.503 -0.293 1
1 1748 . 20 2 2 B 61 61 ILE CA C 482 66.250 65.075 1.175 1
1 1749 . 20 2 2 B 61 61 ILE CB C 482 39.400 38.263 1.137 1
1 1753 . 20 2 2 B 61 61 ILE N N 482 119.170 120.614 -1.444 1
1 1754 . 20 2 2 B 62 62 MET H H 483 8.110 8.445 -0.335 1
1 1755 . 20 2 2 B 62 62 MET HA H 483 4.410 4.131 0.279 1
1 1763 . 20 2 2 B 62 62 MET CA C 483 56.110 58.710 -2.600 1
1 1764 . 20 2 2 B 62 62 MET CB C 483 28.260 32.544 -4.284 1
1 1767 . 20 2 2 B 62 62 MET N N 483 114.420 118.017 -3.597 1
1 1768 . 20 2 2 B 63 63 ALA H H 484 8.240 7.806 0.434 1
1 1769 . 20 2 2 B 63 63 ALA HA H 484 4.130 4.126 0.004 1
1 1773 . 20 2 2 B 63 63 ALA CA C 484 55.300 54.978 0.322 1
1 1774 . 20 2 2 B 63 63 ALA CB C 484 18.280 18.709 -0.429 1
1 1775 . 20 2 2 B 63 63 ALA N N 484 123.710 121.437 2.273 1
1 1776 . 20 2 2 B 64 64 ALA H H 485 8.050 8.360 -0.310 1
1 1777 . 20 2 2 B 64 64 ALA HA H 485 3.870 4.050 -0.180 1
1 1781 . 20 2 2 B 64 64 ALA CA C 485 55.330 55.444 -0.114 1
1 1782 . 20 2 2 B 64 64 ALA CB C 485 17.660 18.480 -0.820 1
1 1783 . 20 2 2 B 64 64 ALA N N 485 120.070 119.931 0.139 1
1 1784 . 20 2 2 B 65 65 ARG H H 486 8.640 9.083 -0.443 1
1 1785 . 20 2 2 B 65 65 ARG HA H 486 2.800 4.178 -1.378 1
1 1792 . 20 2 2 B 65 65 ARG CA C 486 60.600 59.680 0.920 1
1 1793 . 20 2 2 B 65 65 ARG CB C 486 29.910 30.054 -0.144 1
1 1796 . 20 2 2 B 65 65 ARG N N 486 118.730 118.738 -0.008 1
1 1797 . 20 2 2 B 66 66 ASN H H 487 8.710 8.040 0.670 1
1 1798 . 20 2 2 B 66 66 ASN HA H 487 4.550 4.935 -0.385 1
1 1803 . 20 2 2 B 66 66 ASN CA C 487 56.390 56.523 -0.133 1
1 1804 . 20 2 2 B 66 66 ASN CB C 487 37.970 38.466 -0.496 1
1 1805 . 20 2 2 B 66 66 ASN N N 487 119.170 117.569 1.601 1
1 1807 . 20 2 2 B 67 67 ILE H H 488 7.250 7.892 -0.642 1
1 1808 . 20 2 2 B 67 67 ILE HA H 488 3.810 3.874 -0.064 1
1 1818 . 20 2 2 B 67 67 ILE CA C 488 64.350 65.202 -0.852 1
1 1819 . 20 2 2 B 67 67 ILE CB C 488 39.570 37.537 2.033 1
1 1823 . 20 2 2 B 67 67 ILE N N 488 117.890 120.060 -2.170 1
1 1824 . 20 2 2 B 68 68 CYS H H 489 8.350 8.320 0.030 1
1 1825 . 20 2 2 B 68 68 CYS HA H 489 4.080 4.031 0.049 1
1 1828 . 20 2 2 B 68 68 CYS CA C 489 62.670 62.701 -0.031 1
1 1829 . 20 2 2 B 68 68 CYS CB C 489 28.170 26.699 1.471 1
1 1830 . 20 2 2 B 68 68 CYS N N 489 115.230 120.499 -5.269 1
1 1831 . 20 2 2 B 69 69 TRP H H 490 8.230 8.435 -0.205 1
1 1832 . 20 2 2 B 69 69 TRP HA H 490 5.100 4.326 0.774 1
1 1841 . 20 2 2 B 69 69 TRP CA C 490 55.420 60.576 -5.156 1
1 1842 . 20 2 2 B 69 69 TRP CB C 490 31.010 29.428 1.582 1
1 1844 . 20 2 2 B 69 69 TRP N N 490 116.850 120.654 -3.804 1
1 1846 . 20 2 2 B 70 70 PHE H H 491 7.570 8.945 -1.375 1
1 1847 . 20 2 2 B 70 70 PHE HA H 491 5.240 4.576 0.664 1
1 1852 . 20 2 2 B 70 70 PHE CA C 491 55.490 59.980 -4.490 1
1 1853 . 20 2 2 B 70 70 PHE CB C 491 38.700 39.180 -0.480 1
1 1856 . 20 2 2 B 70 70 PHE N N 491 117.460 117.477 -0.017 1
1 1857 . 20 2 2 B 71 71 GLY H H 492 8.420 8.761 -0.341 1
1 1858 . 20 2 2 B 71 71 GLY HA2 H 492 3.920 3.988 -0.068 1
1 1859 . 20 2 2 B 71 71 GLY HA3 H 492 4.080 3.989 0.091 1
1 1860 . 20 2 2 B 71 71 GLY CA C 492 46.210 46.065 0.145 1
1 1861 . 20 2 2 B 71 71 GLY N N 492 110.040 108.107 1.933 1
1 1862 . 20 2 2 B 72 72 ASP H H 493 8.370 8.671 -0.301 1
1 1863 . 20 2 2 B 72 72 ASP HA H 493 4.630 4.234 0.396 1
1 1866 . 20 2 2 B 72 72 ASP CA C 493 54.410 56.611 -2.201 1
1 1867 . 20 2 2 B 72 72 ASP CB C 493 41.250 39.307 1.943 1
1 1868 . 20 2 2 B 72 72 ASP N N 493 120.000 113.654 6.346 1
1 1869 . 20 2 2 B 73 73 GLU H H 494 8.230 8.772 -0.542 1
1 1870 . 20 2 2 B 73 73 GLU HA H 494 4.260 4.514 -0.254 1
1 1875 . 20 2 2 B 73 73 GLU CA C 494 56.510 55.964 0.546 1
1 1876 . 20 2 2 B 73 73 GLU CB C 494 30.420 30.753 -0.333 1
1 1878 . 20 2 2 B 73 73 GLU N N 494 120.900 117.818 3.082 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 78 1.375 1
3 1 1 1 "RMS(OBS, PRED)" CB 74 1.222 1
4 1 1 1 "RMS(OBS, PRED)" H 74 0.660 1
5 1 1 1 "RMS(OBS, PRED)" HA 83 0.320 1
6 1 1 1 "RMS(OBS, PRED)" N 74 3.163 1
7 1 1 2 "RMS(OBS, PRED)" C 0 0.000 1
8 1 1 2 "RMS(OBS, PRED)" CA 67 1.367 1
9 1 1 2 "RMS(OBS, PRED)" CB 62 1.170 1
10 1 1 2 "RMS(OBS, PRED)" H 67 0.487 1
11 1 1 2 "RMS(OBS, PRED)" HA 73 0.354 1
12 1 1 2 "RMS(OBS, PRED)" N 67 3.127 1
13 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1
14 1 2 1 "RMS(OBS, PRED)" CA 78 1.633 1
15 1 2 1 "RMS(OBS, PRED)" CB 74 1.242 1
16 1 2 1 "RMS(OBS, PRED)" H 74 0.621 1
17 1 2 1 "RMS(OBS, PRED)" HA 83 0.336 1
18 1 2 1 "RMS(OBS, PRED)" N 74 3.447 1
19 1 2 2 "RMS(OBS, PRED)" C 0 0.000 1
20 1 2 2 "RMS(OBS, PRED)" CA 67 1.348 1
21 1 2 2 "RMS(OBS, PRED)" CB 62 1.110 1
22 1 2 2 "RMS(OBS, PRED)" H 67 0.497 1
23 1 2 2 "RMS(OBS, PRED)" HA 73 0.349 1
24 1 2 2 "RMS(OBS, PRED)" N 67 3.046 1
25 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1
26 1 3 1 "RMS(OBS, PRED)" CA 78 1.677 1
27 1 3 1 "RMS(OBS, PRED)" CB 74 1.345 1
28 1 3 1 "RMS(OBS, PRED)" H 74 0.620 1
29 1 3 1 "RMS(OBS, PRED)" HA 83 0.353 1
30 1 3 1 "RMS(OBS, PRED)" N 74 3.423 1
31 1 3 2 "RMS(OBS, PRED)" C 0 0.000 1
32 1 3 2 "RMS(OBS, PRED)" CA 67 1.466 1
33 1 3 2 "RMS(OBS, PRED)" CB 62 1.160 1
34 1 3 2 "RMS(OBS, PRED)" H 67 0.500 1
35 1 3 2 "RMS(OBS, PRED)" HA 73 0.347 1
36 1 3 2 "RMS(OBS, PRED)" N 67 3.151 1
37 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1
38 1 4 1 "RMS(OBS, PRED)" CA 78 1.525 1
39 1 4 1 "RMS(OBS, PRED)" CB 74 1.320 1
40 1 4 1 "RMS(OBS, PRED)" H 74 0.612 1
41 1 4 1 "RMS(OBS, PRED)" HA 83 0.329 1
42 1 4 1 "RMS(OBS, PRED)" N 74 3.435 1
43 1 4 2 "RMS(OBS, PRED)" C 0 0.000 1
44 1 4 2 "RMS(OBS, PRED)" CA 67 1.320 1
45 1 4 2 "RMS(OBS, PRED)" CB 62 1.225 1
46 1 4 2 "RMS(OBS, PRED)" H 67 0.476 1
47 1 4 2 "RMS(OBS, PRED)" HA 73 0.353 1
48 1 4 2 "RMS(OBS, PRED)" N 67 2.959 1
49 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1
50 1 5 1 "RMS(OBS, PRED)" CA 78 1.429 1
51 1 5 1 "RMS(OBS, PRED)" CB 74 1.268 1
52 1 5 1 "RMS(OBS, PRED)" H 74 0.594 1
53 1 5 1 "RMS(OBS, PRED)" HA 83 0.309 1
54 1 5 1 "RMS(OBS, PRED)" N 74 3.494 1
55 1 5 2 "RMS(OBS, PRED)" C 0 0.000 1
56 1 5 2 "RMS(OBS, PRED)" CA 67 1.438 1
57 1 5 2 "RMS(OBS, PRED)" CB 62 1.210 1
58 1 5 2 "RMS(OBS, PRED)" H 67 0.486 1
59 1 5 2 "RMS(OBS, PRED)" HA 73 0.340 1
60 1 5 2 "RMS(OBS, PRED)" N 67 3.003 1
61 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1
62 1 6 1 "RMS(OBS, PRED)" CA 78 1.508 1
63 1 6 1 "RMS(OBS, PRED)" CB 74 1.247 1
64 1 6 1 "RMS(OBS, PRED)" H 74 0.627 1
65 1 6 1 "RMS(OBS, PRED)" HA 83 0.337 1
66 1 6 1 "RMS(OBS, PRED)" N 74 3.288 1
67 1 6 2 "RMS(OBS, PRED)" C 0 0.000 1
68 1 6 2 "RMS(OBS, PRED)" CA 67 1.565 1
69 1 6 2 "RMS(OBS, PRED)" CB 62 1.118 1
70 1 6 2 "RMS(OBS, PRED)" H 67 0.564 1
71 1 6 2 "RMS(OBS, PRED)" HA 73 0.355 1
72 1 6 2 "RMS(OBS, PRED)" N 67 3.160 1
73 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1
74 1 7 1 "RMS(OBS, PRED)" CA 78 1.607 1
75 1 7 1 "RMS(OBS, PRED)" CB 74 1.302 1
76 1 7 1 "RMS(OBS, PRED)" H 74 0.550 1
77 1 7 1 "RMS(OBS, PRED)" HA 83 0.334 1
78 1 7 1 "RMS(OBS, PRED)" N 74 3.527 1
79 1 7 2 "RMS(OBS, PRED)" C 0 0.000 1
80 1 7 2 "RMS(OBS, PRED)" CA 67 1.596 1
81 1 7 2 "RMS(OBS, PRED)" CB 62 1.221 1
82 1 7 2 "RMS(OBS, PRED)" H 67 0.510 1
83 1 7 2 "RMS(OBS, PRED)" HA 73 0.351 1
84 1 7 2 "RMS(OBS, PRED)" N 67 3.156 1
85 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1
86 1 8 1 "RMS(OBS, PRED)" CA 78 1.445 1
87 1 8 1 "RMS(OBS, PRED)" CB 74 1.268 1
88 1 8 1 "RMS(OBS, PRED)" H 74 0.622 1
89 1 8 1 "RMS(OBS, PRED)" HA 83 0.343 1
90 1 8 1 "RMS(OBS, PRED)" N 74 3.102 1
91 1 8 2 "RMS(OBS, PRED)" C 0 0.000 1
92 1 8 2 "RMS(OBS, PRED)" CA 67 1.515 1
93 1 8 2 "RMS(OBS, PRED)" CB 62 1.193 1
94 1 8 2 "RMS(OBS, PRED)" H 67 0.477 1
95 1 8 2 "RMS(OBS, PRED)" HA 73 0.347 1
96 1 8 2 "RMS(OBS, PRED)" N 67 3.231 1
97 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1
98 1 9 1 "RMS(OBS, PRED)" CA 78 1.423 1
99 1 9 1 "RMS(OBS, PRED)" CB 74 1.184 1
100 1 9 1 "RMS(OBS, PRED)" H 74 0.630 1
101 1 9 1 "RMS(OBS, PRED)" HA 83 0.336 1
102 1 9 1 "RMS(OBS, PRED)" N 74 3.230 1
103 1 9 2 "RMS(OBS, PRED)" C 0 0.000 1
104 1 9 2 "RMS(OBS, PRED)" CA 67 1.406 1
105 1 9 2 "RMS(OBS, PRED)" CB 62 1.157 1
106 1 9 2 "RMS(OBS, PRED)" H 67 0.478 1
107 1 9 2 "RMS(OBS, PRED)" HA 73 0.350 1
108 1 9 2 "RMS(OBS, PRED)" N 67 2.942 1
109 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1
110 1 10 1 "RMS(OBS, PRED)" CA 78 1.472 1
111 1 10 1 "RMS(OBS, PRED)" CB 74 1.286 1
112 1 10 1 "RMS(OBS, PRED)" H 74 0.599 1
113 1 10 1 "RMS(OBS, PRED)" HA 83 0.300 1
114 1 10 1 "RMS(OBS, PRED)" N 74 3.280 1
115 1 10 2 "RMS(OBS, PRED)" C 0 0.000 1
116 1 10 2 "RMS(OBS, PRED)" CA 67 1.468 1
117 1 10 2 "RMS(OBS, PRED)" CB 62 1.168 1
118 1 10 2 "RMS(OBS, PRED)" H 67 0.482 1
119 1 10 2 "RMS(OBS, PRED)" HA 73 0.346 1
120 1 10 2 "RMS(OBS, PRED)" N 67 3.045 1
121 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1
122 1 11 1 "RMS(OBS, PRED)" CA 78 1.589 1
123 1 11 1 "RMS(OBS, PRED)" CB 74 1.202 1
124 1 11 1 "RMS(OBS, PRED)" H 74 0.616 1
125 1 11 1 "RMS(OBS, PRED)" HA 83 0.318 1
126 1 11 1 "RMS(OBS, PRED)" N 74 3.382 1
127 1 11 2 "RMS(OBS, PRED)" C 0 0.000 1
128 1 11 2 "RMS(OBS, PRED)" CA 67 1.610 1
129 1 11 2 "RMS(OBS, PRED)" CB 62 1.187 1
130 1 11 2 "RMS(OBS, PRED)" H 67 0.487 1
131 1 11 2 "RMS(OBS, PRED)" HA 73 0.339 1
132 1 11 2 "RMS(OBS, PRED)" N 67 3.029 1
133 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1
134 1 12 1 "RMS(OBS, PRED)" CA 78 1.488 1
135 1 12 1 "RMS(OBS, PRED)" CB 74 1.264 1
136 1 12 1 "RMS(OBS, PRED)" H 74 0.607 1
137 1 12 1 "RMS(OBS, PRED)" HA 83 0.328 1
138 1 12 1 "RMS(OBS, PRED)" N 74 3.462 1
139 1 12 2 "RMS(OBS, PRED)" C 0 0.000 1
140 1 12 2 "RMS(OBS, PRED)" CA 67 1.391 1
141 1 12 2 "RMS(OBS, PRED)" CB 62 1.144 1
142 1 12 2 "RMS(OBS, PRED)" H 67 0.479 1
143 1 12 2 "RMS(OBS, PRED)" HA 73 0.353 1
144 1 12 2 "RMS(OBS, PRED)" N 67 2.999 1
145 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1
146 1 13 1 "RMS(OBS, PRED)" CA 78 1.479 1
147 1 13 1 "RMS(OBS, PRED)" CB 74 1.191 1
148 1 13 1 "RMS(OBS, PRED)" H 74 0.647 1
149 1 13 1 "RMS(OBS, PRED)" HA 83 0.341 1
150 1 13 1 "RMS(OBS, PRED)" N 74 3.231 1
151 1 13 2 "RMS(OBS, PRED)" C 0 0.000 1
152 1 13 2 "RMS(OBS, PRED)" CA 67 1.589 1
153 1 13 2 "RMS(OBS, PRED)" CB 62 1.241 1
154 1 13 2 "RMS(OBS, PRED)" H 67 0.488 1
155 1 13 2 "RMS(OBS, PRED)" HA 73 0.344 1
156 1 13 2 "RMS(OBS, PRED)" N 67 3.094 1
157 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1
158 1 14 1 "RMS(OBS, PRED)" CA 78 1.491 1
159 1 14 1 "RMS(OBS, PRED)" CB 74 1.274 1
160 1 14 1 "RMS(OBS, PRED)" H 74 0.617 1
161 1 14 1 "RMS(OBS, PRED)" HA 83 0.343 1
162 1 14 1 "RMS(OBS, PRED)" N 74 3.464 1
163 1 14 2 "RMS(OBS, PRED)" C 0 0.000 1
164 1 14 2 "RMS(OBS, PRED)" CA 67 1.431 1
165 1 14 2 "RMS(OBS, PRED)" CB 62 1.198 1
166 1 14 2 "RMS(OBS, PRED)" H 67 0.485 1
167 1 14 2 "RMS(OBS, PRED)" HA 73 0.348 1
168 1 14 2 "RMS(OBS, PRED)" N 67 3.040 1
169 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1
170 1 15 1 "RMS(OBS, PRED)" CA 78 1.566 1
171 1 15 1 "RMS(OBS, PRED)" CB 74 1.236 1
172 1 15 1 "RMS(OBS, PRED)" H 74 0.635 1
173 1 15 1 "RMS(OBS, PRED)" HA 83 0.360 1
174 1 15 1 "RMS(OBS, PRED)" N 74 3.460 1
175 1 15 2 "RMS(OBS, PRED)" C 0 0.000 1
176 1 15 2 "RMS(OBS, PRED)" CA 67 1.480 1
177 1 15 2 "RMS(OBS, PRED)" CB 62 1.199 1
178 1 15 2 "RMS(OBS, PRED)" H 67 0.513 1
179 1 15 2 "RMS(OBS, PRED)" HA 73 0.350 1
180 1 15 2 "RMS(OBS, PRED)" N 67 3.222 1
181 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1
182 1 16 1 "RMS(OBS, PRED)" CA 78 1.513 1
183 1 16 1 "RMS(OBS, PRED)" CB 74 1.239 1
184 1 16 1 "RMS(OBS, PRED)" H 74 0.605 1
185 1 16 1 "RMS(OBS, PRED)" HA 83 0.319 1
186 1 16 1 "RMS(OBS, PRED)" N 74 3.217 1
187 1 16 2 "RMS(OBS, PRED)" C 0 0.000 1
188 1 16 2 "RMS(OBS, PRED)" CA 67 1.462 1
189 1 16 2 "RMS(OBS, PRED)" CB 62 1.178 1
190 1 16 2 "RMS(OBS, PRED)" H 67 0.525 1
191 1 16 2 "RMS(OBS, PRED)" HA 73 0.355 1
192 1 16 2 "RMS(OBS, PRED)" N 67 3.118 1
193 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1
194 1 17 1 "RMS(OBS, PRED)" CA 78 1.393 1
195 1 17 1 "RMS(OBS, PRED)" CB 74 1.191 1
196 1 17 1 "RMS(OBS, PRED)" H 74 0.591 1
197 1 17 1 "RMS(OBS, PRED)" HA 83 0.335 1
198 1 17 1 "RMS(OBS, PRED)" N 74 3.477 1
199 1 17 2 "RMS(OBS, PRED)" C 0 0.000 1
200 1 17 2 "RMS(OBS, PRED)" CA 67 1.410 1
201 1 17 2 "RMS(OBS, PRED)" CB 62 1.147 1
202 1 17 2 "RMS(OBS, PRED)" H 67 0.508 1
203 1 17 2 "RMS(OBS, PRED)" HA 73 0.343 1
204 1 17 2 "RMS(OBS, PRED)" N 67 2.921 1
205 1 18 1 "RMS(OBS, PRED)" C 0 0.000 1
206 1 18 1 "RMS(OBS, PRED)" CA 78 1.510 1
207 1 18 1 "RMS(OBS, PRED)" CB 74 1.244 1
208 1 18 1 "RMS(OBS, PRED)" H 74 0.618 1
209 1 18 1 "RMS(OBS, PRED)" HA 83 0.314 1
210 1 18 1 "RMS(OBS, PRED)" N 74 3.272 1
211 1 18 2 "RMS(OBS, PRED)" C 0 0.000 1
212 1 18 2 "RMS(OBS, PRED)" CA 67 1.421 1
213 1 18 2 "RMS(OBS, PRED)" CB 62 1.199 1
214 1 18 2 "RMS(OBS, PRED)" H 67 0.475 1
215 1 18 2 "RMS(OBS, PRED)" HA 73 0.345 1
216 1 18 2 "RMS(OBS, PRED)" N 67 2.943 1
217 1 19 1 "RMS(OBS, PRED)" C 0 0.000 1
218 1 19 1 "RMS(OBS, PRED)" CA 78 1.476 1
219 1 19 1 "RMS(OBS, PRED)" CB 74 1.242 1
220 1 19 1 "RMS(OBS, PRED)" H 74 0.602 1
221 1 19 1 "RMS(OBS, PRED)" HA 83 0.324 1
222 1 19 1 "RMS(OBS, PRED)" N 74 3.276 1
223 1 19 2 "RMS(OBS, PRED)" C 0 0.000 1
224 1 19 2 "RMS(OBS, PRED)" CA 67 1.571 1
225 1 19 2 "RMS(OBS, PRED)" CB 62 1.191 1
226 1 19 2 "RMS(OBS, PRED)" H 67 0.530 1
227 1 19 2 "RMS(OBS, PRED)" HA 73 0.355 1
228 1 19 2 "RMS(OBS, PRED)" N 67 3.207 1
229 1 20 1 "RMS(OBS, PRED)" C 0 0.000 1
230 1 20 1 "RMS(OBS, PRED)" CA 78 1.551 1
231 1 20 1 "RMS(OBS, PRED)" CB 74 1.293 1
232 1 20 1 "RMS(OBS, PRED)" H 74 0.610 1
233 1 20 1 "RMS(OBS, PRED)" HA 83 0.375 1
234 1 20 1 "RMS(OBS, PRED)" N 74 3.411 1
235 1 20 2 "RMS(OBS, PRED)" C 0 0.000 1
236 1 20 2 "RMS(OBS, PRED)" CA 67 1.536 1
237 1 20 2 "RMS(OBS, PRED)" CB 62 1.220 1
238 1 20 2 "RMS(OBS, PRED)" H 67 0.539 1
239 1 20 2 "RMS(OBS, PRED)" HA 73 0.356 1
240 1 20 2 "RMS(OBS, PRED)" N 67 3.189 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
1 355 . 1 1 A 31 31 GLU HA H 261 4.280 4.067 0.213 2
1 359 . 1 1 A 31 31 GLU CB C 261 27.010 29.524 -2.514 2
1 478 . 1 1 A 42 42 ALA HA H 272 4.140 4.064 0.076 2
1 483 . 1 1 A 42 42 ALA CB C 272 17.950 18.489 -0.539 2
1 560 . 1 1 A 49 49 GLY HA2 H 279 2.370 2.447 -0.077 2
1 561 . 1 1 A 49 49 GLY HA3 H 279 3.230 3.608 -0.378 2
1 572 . 1 1 A 51 51 LEU HA H 281 3.880 3.969 -0.089 2
1 583 . 1 1 A 51 51 LEU CB C 281 41.870 41.542 0.328 2
1 664 . 1 1 A 58 58 GLU HA H 288 3.830 4.055 -0.225 2
1 670 . 1 1 A 58 58 GLU CB C 288 30.030 29.138 0.892 2
1 760 . 1 1 A 66 66 GLY HA2 H 296 3.810 4.153 -0.343 2
1 761 . 1 1 A 66 66 GLY HA3 H 296 4.110 4.153 -0.043 2
1 821 . 1 1 A 71 71 THR HA H 301 3.690 3.828 -0.138 2
1 827 . 1 1 A 71 71 THR CB C 301 68.810 68.543 0.267 2
1 854 . 1 1 A 74 74 LYS H H 304 8.550 8.171 0.379 2
1 855 . 1 1 A 74 74 LYS HA H 304 3.680 3.861 -0.181 2
1 864 . 1 1 A 74 74 LYS CA C 304 61.320 59.990 1.330 2
1 865 . 1 1 A 74 74 LYS CB C 304 32.060 32.086 -0.026 2
1 868 . 1 1 A 74 74 LYS N N 304 118.220 120.007 -1.787 2
1 869 . 1 1 A 75 75 ASP H H 305 8.450 7.972 0.478 2
1 870 . 1 1 A 75 75 ASP HA H 305 4.440 4.393 0.047 2
1 873 . 1 1 A 75 75 ASP CA C 305 57.690 57.317 0.373 2
1 874 . 1 1 A 75 75 ASP CB C 305 40.220 41.095 -0.875 2
1 875 . 1 1 A 75 75 ASP N N 305 121.790 119.728 2.062 2
1 876 . 1 1 A 76 76 VAL H H 306 8.680 7.846 0.834 2
1 877 . 1 1 A 76 76 VAL HA H 306 3.890 3.609 0.281 2
1 885 . 1 1 A 76 76 VAL CA C 306 66.020 66.351 -0.331 2
1 886 . 1 1 A 76 76 VAL CB C 306 31.250 31.438 -0.188 2
1 889 . 1 1 A 76 76 VAL N N 306 121.150 119.611 1.539 2
1 890 . 1 1 A 77 77 LEU H H 307 8.470 8.602 -0.132 2
1 891 . 1 1 A 77 77 LEU HA H 307 3.810 4.053 -0.243 2
1 901 . 1 1 A 77 77 LEU CA C 307 58.330 57.461 0.869 2
1 902 . 1 1 A 77 77 LEU CB C 307 41.250 41.157 0.093 2
1 906 . 1 1 A 77 77 LEU N N 307 120.830 119.741 1.089 2
1 907 . 1 1 A 78 78 ALA H H 308 8.280 8.338 -0.058 2
1 908 . 1 1 A 78 78 ALA HA H 308 4.320 4.104 0.216 2
1 912 . 1 1 A 78 78 ALA CA C 308 55.420 54.981 0.439 2
1 913 . 1 1 A 78 78 ALA CB C 308 17.750 18.013 -0.263 2
1 914 . 1 1 A 78 78 ALA N N 308 122.530 122.474 0.056 2
1 915 . 1 1 A 79 79 SER H H 309 7.900 7.801 0.099 2
1 916 . 1 1 A 79 79 SER HA H 309 4.340 4.363 -0.023 2
1 919 . 1 1 A 79 79 SER CA C 309 61.350 59.456 1.894 2
1 920 . 1 1 A 79 79 SER CB C 309 63.280 63.711 -0.431 2
1 921 . 1 1 A 79 79 SER N N 309 115.600 112.665 2.935 2
1 922 . 1 1 A 80 80 ARG H H 310 7.450 8.196 -0.746 2
1 923 . 1 1 A 80 80 ARG HA H 310 4.550 3.998 0.552 2
1 931 . 1 1 A 80 80 ARG CA C 310 54.200 57.423 -3.223 2
1 932 . 1 1 A 80 80 ARG CB C 310 30.680 27.836 2.844 2
1 935 . 1 1 A 80 80 ARG N N 310 119.360 117.742 1.618 2
1 936 . 1 1 A 81 81 GLY H H 311 7.940 8.156 -0.216 2
1 937 . 1 1 A 81 81 GLY HA2 H 311 3.840 3.913 -0.073 2
1 938 . 1 1 A 81 81 GLY HA3 H 311 4.070 3.920 0.150 2
1 939 . 1 1 A 81 81 GLY CA C 311 46.060 45.895 0.165 2
1 940 . 1 1 A 81 81 GLY N N 311 108.130 106.680 1.450 2
1 941 . 1 1 A 82 82 LEU H H 312 7.920 7.578 0.342 2
1 942 . 1 1 A 82 82 LEU HA H 312 4.680 4.772 -0.092 2
1 952 . 1 1 A 82 82 LEU CA C 312 53.070 52.968 0.102 2
1 953 . 1 1 A 82 82 LEU CB C 312 45.790 45.294 0.496 2
1 957 . 1 1 A 82 82 LEU N N 312 119.290 117.695 1.595 2
1 958 . 1 1 A 83 83 SER H H 313 7.530 8.879 -1.349 2
1 959 . 1 1 A 83 83 SER HA H 313 4.450 4.163 0.287 2
1 962 . 1 1 A 83 83 SER CA C 313 57.190 59.064 -1.874 2
1 963 . 1 1 A 83 83 SER CB C 313 66.080 62.103 3.977 2
1 964 . 1 1 A 83 83 SER N N 313 113.120 115.799 -2.679 2
1 965 . 1 1 A 84 84 LEU H H 314 8.340 8.405 -0.065 2
1 966 . 1 1 A 84 84 LEU HA H 314 4.620 4.345 0.275 2
1 976 . 1 1 A 84 84 LEU CA C 314 54.720 54.965 -0.245 2
1 977 . 1 1 A 84 84 LEU CB C 314 41.620 42.078 -0.458 2
1 981 . 1 1 A 84 84 LEU N N 314 115.930 119.981 -4.051 2
1 982 . 1 1 A 85 85 GLY H H 315 8.270 8.008 0.262 2
1 983 . 1 1 A 85 85 GLY HA2 H 315 3.320 3.946 -0.626 2
1 984 . 1 1 A 85 85 GLY HA3 H 315 3.850 3.948 -0.098 2
1 985 . 1 1 A 85 85 GLY CA C 315 46.560 46.645 -0.085 2
1 986 . 1 1 A 85 85 GLY N N 315 111.010 107.861 3.149 2
1 987 . 1 1 A 86 86 MET H H 316 8.650 7.972 0.678 2
1 988 . 1 1 A 86 86 MET HA H 316 3.990 4.895 -0.905 2
1 996 . 1 1 A 86 86 MET CA C 316 56.730 54.407 2.323 2
1 997 . 1 1 A 86 86 MET CB C 316 33.600 35.109 -1.509 2
1 1000 . 1 1 A 86 86 MET N N 316 120.570 117.975 2.595 2
1 1001 . 1 1 A 87 87 ARG H H 317 8.360 8.640 -0.280 2
1 1002 . 1 1 A 87 87 ARG HA H 317 4.450 5.194 -0.744 2
1 1010 . 1 1 A 87 87 ARG CA C 317 55.310 54.601 0.709 2
1 1011 . 1 1 A 87 87 ARG CB C 317 30.490 33.487 -2.997 2
1 1014 . 1 1 A 87 87 ARG N N 317 122.290 119.569 2.721 2
1 1015 . 1 1 A 88 88 LEU H H 318 8.400 8.837 -0.437 2
1 1016 . 1 1 A 88 88 LEU HA H 318 4.670 4.942 -0.272 2
1 1026 . 1 1 A 88 88 LEU CA C 318 53.110 53.244 -0.134 2
1 1027 . 1 1 A 88 88 LEU CB C 318 43.600 44.774 -1.174 2
1 1031 . 1 1 A 88 88 LEU N N 318 126.420 125.139 1.281 2
1 1032 . 1 1 A 89 89 GLU H H 319 8.780 9.017 -0.237 2
1 1033 . 1 1 A 89 89 GLU HA H 319 4.340 4.005 0.335 2
1 1038 . 1 1 A 89 89 GLU CA C 319 56.490 59.432 -2.942 2
1 1039 . 1 1 A 89 89 GLU CB C 319 30.470 29.656 0.814 2
1 1041 . 1 1 A 89 89 GLU N N 319 123.070 123.616 -0.546 2
1 1042 . 1 1 A 90 90 ASN H H 320 8.900 8.390 0.510 2
1 1043 . 1 1 A 90 90 ASN HA H 320 4.410 5.056 -0.645 2
1 1048 . 1 1 A 90 90 ASN CA C 320 54.120 54.482 -0.362 2
1 1049 . 1 1 A 90 90 ASN CB C 320 37.640 40.664 -3.024 2
1 1050 . 1 1 A 90 90 ASN N N 320 116.540 114.890 1.650 2
1 1052 . 1 1 A 91 91 TRP H H 321 7.990 7.456 0.534 2
1 1053 . 1 1 A 91 91 TRP HA H 321 4.330 4.707 -0.377 2
1 1062 . 1 1 A 91 91 TRP CA C 321 54.590 58.259 -3.669 2
1 1063 . 1 1 A 91 91 TRP CB C 321 31.280 30.878 0.402 2
1 1069 . 1 1 A 91 91 TRP N N 321 119.230 116.631 2.599 2
1 1071 . 1 1 A 92 92 PRO HA H 322 4.800 3.965 0.835 2
1 1077 . 1 1 A 93 93 PRO HA H 323 4.450 4.488 -0.038 2
1 1084 . 1 1 A 93 93 PRO CA C 323 61.970 62.435 -0.465 2
1 1085 . 1 1 A 93 93 PRO CB C 323 32.830 32.524 0.306 2
1 1088 . 1 1 A 94 94 ALA H H 324 8.460 8.737 -0.277 2
1 1089 . 1 1 A 94 94 ALA HA H 324 4.000 3.992 0.008 2
1 1093 . 1 1 A 94 94 ALA CA C 324 53.790 54.769 -0.979 2
1 1094 . 1 1 A 94 94 ALA CB C 324 18.640 18.124 0.516 2
1 1095 . 1 1 A 94 94 ALA N N 324 124.010 126.418 -2.408 2
1 1096 . 1 1 A 95 95 SER H H 325 7.950 8.033 -0.083 2
1 1097 . 1 1 A 95 95 SER HA H 325 4.210 4.172 0.038 2
1 1100 . 1 1 A 95 95 SER CA C 325 58.970 61.942 -2.972 2
1 1101 . 1 1 A 95 95 SER CB C 325 63.040 63.083 -0.043 2
1 1102 . 1 1 A 95 95 SER N N 325 111.520 113.989 -2.469 2
1 1103 . 1 1 A 96 96 ILE H H 326 7.480 7.624 -0.144 2
1 1104 . 1 1 A 96 96 ILE HA H 326 4.170 3.628 0.542 2
1 1114 . 1 1 A 96 96 ILE CA C 326 61.300 63.861 -2.561 2
1 1115 . 1 1 A 96 96 ILE CB C 326 38.530 37.546 0.984 2
1 1119 . 1 1 A 96 96 ILE N N 326 119.650 119.961 -0.311 2
1 1120 . 1 1 A 97 97 ALA H H 327 7.860 7.488 0.372 2
1 1121 . 1 1 A 97 97 ALA HA H 327 4.230 4.080 0.150 2
1 1125 . 1 1 A 97 97 ALA CA C 327 52.570 53.376 -0.806 2
1 1126 . 1 1 A 97 97 ALA CB C 327 19.590 18.903 0.687 2
1 1127 . 1 1 A 97 97 ALA N N 327 126.480 124.034 2.446 2
1 1128 . 1 1 A 98 98 ASP H H 328 8.250 8.580 -0.330 2
1 1129 . 1 1 A 98 98 ASP HA H 328 4.540 4.298 0.242 2
1 1132 . 1 1 A 98 98 ASP CA C 328 54.150 57.271 -3.121 2
1 1133 . 1 1 A 98 98 ASP CB C 328 41.120 40.618 0.502 2
1 1134 . 1 1 A 98 98 ASP N N 328 120.130 121.363 -1.233 2
1 1150 . 2 2 B 6 6 ASP H H 427 8.160 8.446 -0.286 2
1 1151 . 2 2 B 6 6 ASP HA H 427 4.630 4.294 0.336 2
1 1154 . 2 2 B 6 6 ASP CA C 427 54.410 56.870 -2.460 2
1 1155 . 2 2 B 6 6 ASP CB C 427 41.250 40.580 0.670 2
1 1156 . 2 2 B 6 6 ASP N N 427 120.160 121.767 -1.607 2
1 1157 . 2 2 B 7 7 ASN H H 428 8.350 7.878 0.472 2
1 1158 . 2 2 B 7 7 ASN HA H 428 4.550 4.553 -0.004 2
1 1163 . 2 2 B 7 7 ASN CA C 428 53.310 54.073 -0.763 2
1 1164 . 2 2 B 7 7 ASN CB C 428 38.850 37.776 1.074 2
1 1165 . 2 2 B 7 7 ASN N N 428 118.440 114.997 3.443 2
1 1167 . 2 2 B 8 8 LYS H H 429 8.030 7.728 0.302 2
1 1172 . 2 2 B 8 8 LYS CB C 429 33.280 33.118 0.162 2
1 1174 . 2 2 B 8 8 LYS N N 429 120.260 120.591 -0.331 2
1 1175 . 2 2 B 9 9 PRO HA H 430 4.420 4.494 -0.074 2
1 1182 . 2 2 B 9 9 PRO CA C 430 62.280 62.629 -0.349 2
1 1183 . 2 2 B 9 9 PRO CB C 430 31.920 32.320 -0.400 2
1 1186 . 2 2 B 10 10 ALA H H 431 8.930 8.805 0.125 2
1 1187 . 2 2 B 10 10 ALA HA H 431 4.350 4.478 -0.128 2
1 1191 . 2 2 B 10 10 ALA CA C 431 51.070 52.034 -0.964 2
1 1192 . 2 2 B 10 10 ALA CB C 431 20.920 19.578 1.342 2
1 1193 . 2 2 B 10 10 ALA N N 431 125.000 124.875 0.125 2
1 1194 . 2 2 B 11 11 ASP H H 432 8.530 9.151 -0.621 2
1 1195 . 2 2 B 11 11 ASP HA H 432 4.220 4.266 -0.046 2
1 1198 . 2 2 B 11 11 ASP CA C 432 57.520 57.511 0.010 2
1 1199 . 2 2 B 11 11 ASP CB C 432 40.470 40.308 0.162 2
1 1200 . 2 2 B 11 11 ASP N N 432 119.610 121.802 -2.192 2
1 1201 . 2 2 B 12 12 ASP H H 433 8.340 8.004 0.336 2
1 1202 . 2 2 B 12 12 ASP HA H 433 4.160 4.429 -0.269 2
1 1205 . 2 2 B 12 12 ASP CA C 433 56.090 57.400 -1.310 2
1 1206 . 2 2 B 12 12 ASP CB C 433 38.960 40.909 -1.949 2
1 1207 . 2 2 B 12 12 ASP N N 433 116.330 119.779 -3.449 2
1 1208 . 2 2 B 13 13 LEU H H 434 7.360 7.783 -0.423 2
1 1209 . 2 2 B 13 13 LEU HA H 434 4.050 4.081 -0.031 2
1 1219 . 2 2 B 13 13 LEU CA C 434 57.340 57.765 -0.425 2
1 1220 . 2 2 B 13 13 LEU CB C 434 42.960 41.629 1.331 2
1 1224 . 2 2 B 13 13 LEU N N 434 123.440 121.133 2.307 2
1 1225 . 2 2 B 14 14 LEU H H 435 7.670 8.097 -0.427 2
1 1226 . 2 2 B 14 14 LEU HA H 435 3.710 4.020 -0.310 2
1 1236 . 2 2 B 14 14 LEU CA C 435 57.170 57.584 -0.414 2
1 1237 . 2 2 B 14 14 LEU CB C 435 42.590 41.434 1.157 2
1 1241 . 2 2 B 14 14 LEU N N 435 115.170 119.608 -4.438 2
1 1242 . 2 2 B 15 15 ASN H H 436 7.490 8.084 -0.594 2
1 1243 . 2 2 B 15 15 ASN HA H 436 4.640 4.796 -0.156 2
1 1248 . 2 2 B 15 15 ASN CA C 436 52.920 53.346 -0.426 2
1 1249 . 2 2 B 15 15 ASN CB C 436 39.350 38.841 0.509 2
1 1250 . 2 2 B 15 15 ASN N N 436 112.280 115.227 -2.947 2
1 1252 . 2 2 B 16 16 LEU H H 437 7.300 7.255 0.045 2
1 1253 . 2 2 B 16 16 LEU HA H 437 4.100 4.262 -0.162 2
1 1263 . 2 2 B 16 16 LEU CA C 437 55.310 55.161 0.149 2
1 1264 . 2 2 B 16 16 LEU CB C 437 41.800 43.016 -1.216 2
1 1268 . 2 2 B 16 16 LEU N N 437 125.180 122.549 2.631 2
1 1269 . 2 2 B 17 17 GLU H H 438 8.590 8.747 -0.157 2
1 1270 . 2 2 B 17 17 GLU HA H 438 3.920 4.042 -0.121 2
1 1275 . 2 2 B 17 17 GLU CA C 438 58.440 57.913 0.527 2
1 1276 . 2 2 B 17 17 GLU CB C 438 29.180 29.676 -0.496 2
1 1278 . 2 2 B 17 17 GLU N N 438 129.850 125.548 4.302 2
1 1279 . 2 2 B 18 18 GLY H H 439 8.580 8.899 -0.319 2
1 1280 . 2 2 B 18 18 GLY HA2 H 439 3.570 3.943 -0.373 2
1 1281 . 2 2 B 18 18 GLY HA3 H 439 4.220 3.946 0.274 2
1 1282 . 2 2 B 18 18 GLY CA C 439 44.710 45.384 -0.674 2
1 1283 . 2 2 B 18 18 GLY N N 439 112.250 114.485 -2.235 2
1 1284 . 2 2 B 19 19 VAL H H 440 7.900 7.605 0.295 2
1 1285 . 2 2 B 19 19 VAL HA H 440 3.950 4.428 -0.478 2
1 1293 . 2 2 B 19 19 VAL CA C 440 62.820 60.974 1.846 2
1 1294 . 2 2 B 19 19 VAL CB C 440 31.470 34.493 -3.023 2
1 1297 . 2 2 B 19 19 VAL N N 440 121.910 121.786 0.124 2
1 1298 . 2 2 B 20 20 ASP H H 441 7.390 8.680 -1.290 2
1 1299 . 2 2 B 20 20 ASP HA H 441 4.820 4.705 0.115 2
1 1302 . 2 2 B 20 20 ASP CA C 441 51.920 52.970 -1.050 2
1 1303 . 2 2 B 20 20 ASP CB C 441 42.090 41.321 0.769 2
1 1304 . 2 2 B 20 20 ASP N N 441 124.850 125.250 -0.400 2
1 1305 . 2 2 B 21 21 ARG H H 442 8.630 8.691 -0.061 2
1 1306 . 2 2 B 21 21 ARG HA H 442 3.810 4.003 -0.193 2
1 1313 . 2 2 B 21 21 ARG CA C 442 60.710 62.251 -1.541 2
1 1314 . 2 2 B 21 21 ARG CB C 442 30.020 31.024 -1.004 2
1 1317 . 2 2 B 21 21 ARG N N 442 120.890 122.248 -1.358 2
1 1318 . 2 2 B 22 22 ASP H H 443 8.140 7.898 0.242 2
1 1319 . 2 2 B 22 22 ASP HA H 443 4.420 4.214 0.206 2
1 1322 . 2 2 B 22 22 ASP CA C 443 57.680 60.088 -2.408 2
1 1323 . 2 2 B 22 22 ASP CB C 443 40.880 39.202 1.678 2
1 1324 . 2 2 B 22 22 ASP N N 443 116.750 118.541 -1.791 2
1 1325 . 2 2 B 23 23 LEU H H 444 8.170 7.922 0.248 2
1 1326 . 2 2 B 23 23 LEU HA H 444 4.130 4.114 0.016 2
1 1336 . 2 2 B 23 23 LEU CA C 444 57.770 57.862 -0.092 2
1 1337 . 2 2 B 23 23 LEU CB C 444 41.230 41.463 -0.233 2
1 1341 . 2 2 B 23 23 LEU N N 444 122.130 121.473 0.657 2
1 1342 . 2 2 B 24 24 ALA H H 445 8.630 8.120 0.510 2
1 1343 . 2 2 B 24 24 ALA HA H 445 3.790 4.294 -0.504 2
1 1347 . 2 2 B 24 24 ALA CA C 445 55.810 55.698 0.112 2
1 1348 . 2 2 B 24 24 ALA CB C 445 18.060 30.125 -12.065 2
1 1349 . 2 2 B 24 24 ALA N N 445 120.890 119.973 0.917 2
1 1350 . 2 2 B 25 25 PHE H H 446 8.160 7.544 0.616 2
1 1351 . 2 2 B 25 25 PHE HA H 446 4.080 4.316 -0.236 2
1 1358 . 2 2 B 25 25 PHE CA C 446 62.670 58.026 4.644 2
1 1359 . 2 2 B 25 25 PHE CB C 446 39.440 34.251 5.189 2
1 1364 . 2 2 B 25 25 PHE N N 446 115.360 117.984 -2.624 2
1 1365 . 2 2 B 26 26 LYS H H 447 8.040 7.848 0.192 2
1 1366 . 2 2 B 26 26 LYS HA H 447 4.110 4.393 -0.283 2
1 1375 . 2 2 B 26 26 LYS CA C 447 60.140 61.049 -0.909 2
1 1376 . 2 2 B 26 26 LYS CB C 447 32.880 32.177 0.703 2
1 1380 . 2 2 B 26 26 LYS N N 447 123.110 119.005 4.104 2
1 1381 . 2 2 B 27 27 LEU H H 448 8.630 8.281 0.349 2
1 1382 . 2 2 B 27 27 LEU HA H 448 3.840 3.899 -0.059 2
1 1392 . 2 2 B 27 27 LEU CA C 448 58.210 61.660 -3.450 2
1 1393 . 2 2 B 27 27 LEU CB C 448 39.760 36.435 3.325 2
1 1396 . 2 2 B 27 27 LEU N N 448 120.890 122.487 -1.597 2
1 1397 . 2 2 B 28 28 ALA H H 449 8.200 8.296 -0.096 2
1 1398 . 2 2 B 28 28 ALA HA H 449 3.760 4.445 -0.685 2
1 1402 . 2 2 B 28 28 ALA CA C 449 54.750 56.334 -1.584 2
1 1403 . 2 2 B 28 28 ALA CB C 449 18.050 29.378 -11.328 2
1 1404 . 2 2 B 28 28 ALA N N 449 123.710 121.353 2.357 2
1 1405 . 2 2 B 29 29 ALA H H 450 7.780 8.358 -0.578 2
1 1406 . 2 2 B 29 29 ALA HA H 450 4.170 4.331 -0.161 2
1 1410 . 2 2 B 29 29 ALA CA C 450 54.430 55.229 -0.799 2
1 1411 . 2 2 B 29 29 ALA CB C 450 18.040 29.794 -11.754 2
1 1412 . 2 2 B 29 29 ALA N N 450 121.020 118.468 2.552 2
1 1413 . 2 2 B 30 30 ARG H H 451 7.390 7.577 -0.187 2
1 1414 . 2 2 B 30 30 ARG HA H 451 4.540 4.316 0.224 2
1 1421 . 2 2 B 30 30 ARG CA C 451 54.510 55.552 -1.042 2
1 1422 . 2 2 B 30 30 ARG CB C 451 29.950 35.951 -6.001 2
1 1425 . 2 2 B 30 30 ARG N N 451 115.480 118.839 -3.359 2
1 1426 . 2 2 B 31 31 GLY H H 452 7.950 8.583 -0.633 2
1 1427 . 2 2 B 31 31 GLY HA2 H 452 3.550 3.990 -0.440 2
1 1428 . 2 2 B 31 31 GLY HA3 H 452 4.200 3.992 0.208 2
1 1429 . 2 2 B 31 31 GLY CA C 452 45.380 52.226 -6.846 2
1 1430 . 2 2 B 31 31 GLY N N 452 107.740 115.366 -7.626 2
1 1431 . 2 2 B 32 32 VAL H H 453 7.990 7.474 0.516 2
1 1432 . 2 2 B 32 32 VAL HA H 453 3.930 4.168 -0.238 2
1 1440 . 2 2 B 32 32 VAL CA C 453 61.420 58.892 2.528 2
1 1441 . 2 2 B 32 32 VAL CB C 453 29.860 36.935 -7.075 2
1 1444 . 2 2 B 32 32 VAL N N 453 125.560 121.614 3.946 2
1 1445 . 2 2 B 33 33 CYS H H 454 8.460 8.628 -0.168 2
1 1446 . 2 2 B 33 33 CYS HA H 454 4.310 4.695 -0.385 2
1 1449 . 2 2 B 33 33 CYS CA C 454 60.260 60.227 0.033 2
1 1450 . 2 2 B 33 33 CYS CB C 454 30.330 50.777 -20.447 2
1 1451 . 2 2 B 33 33 CYS N N 454 119.460 119.617 -0.157 2
1 1452 . 2 2 B 34 34 THR H H 455 8.080 8.273 -0.193 2
1 1453 . 2 2 B 34 34 THR HA H 455 4.840 4.096 0.744 2
1 1458 . 2 2 B 34 34 THR CA C 455 58.650 64.328 -5.678 2
1 1459 . 2 2 B 34 34 THR CB C 455 72.680 51.000 21.680 2
1 1461 . 2 2 B 34 34 THR N N 455 108.420 118.422 -10.002 2
1 1462 . 2 2 B 35 35 LEU H H 456 8.580 8.469 0.111 2
1 1463 . 2 2 B 35 35 LEU HA H 456 3.790 3.967 -0.177 2
1 1473 . 2 2 B 35 35 LEU CA C 456 57.980 59.253 -1.273 2
1 1474 . 2 2 B 35 35 LEU CB C 456 42.220 35.684 6.536 2
1 1477 . 2 2 B 35 35 LEU N N 456 120.370 124.423 -4.053 2
1 1478 . 2 2 B 36 36 GLU H H 457 8.390 8.066 0.324 2
1 1479 . 2 2 B 36 36 GLU HA H 457 3.820 4.014 -0.194 2
1 1484 . 2 2 B 36 36 GLU CA C 457 59.640 60.826 -1.186 2
1 1485 . 2 2 B 36 36 GLU CB C 457 28.780 46.006 -17.226 2
1 1487 . 2 2 B 36 36 GLU N N 457 119.450 117.239 2.211 2
1 1488 . 2 2 B 37 37 ASP H H 458 7.750 7.865 -0.115 2
1 1489 . 2 2 B 37 37 ASP HA H 458 4.140 4.207 -0.067 2
1 1492 . 2 2 B 37 37 ASP CA C 458 57.150 56.312 0.838 2
1 1493 . 2 2 B 37 37 ASP CB C 458 42.280 29.358 12.922 2
1 1494 . 2 2 B 37 37 ASP N N 458 117.430 121.678 -4.248 2
1 1495 . 2 2 B 38 38 LEU H H 459 7.700 8.572 -0.872 2
1 1496 . 2 2 B 38 38 LEU HA H 459 3.790 4.314 -0.524 2
1 1506 . 2 2 B 38 38 LEU CA C 459 58.080 57.056 1.024 2
1 1507 . 2 2 B 38 38 LEU CB C 459 41.130 39.520 1.610 2
1 1511 . 2 2 B 38 38 LEU N N 459 121.280 119.541 1.739 2
1 1512 . 2 2 B 39 39 ALA H H 460 8.190 8.144 0.046 2
1 1513 . 2 2 B 39 39 ALA HA H 460 3.640 4.047 -0.407 2
1 1517 . 2 2 B 39 39 ALA CA C 460 54.320 59.079 -4.759 2
1 1518 . 2 2 B 39 39 ALA CB C 460 17.140 22.737 -5.597 2
1 1519 . 2 2 B 39 39 ALA N N 460 119.400 119.683 -0.283 2
1 1520 . 2 2 B 40 40 GLU H H 461 7.340 7.795 -0.455 2
1 1521 . 2 2 B 40 40 GLU HA H 461 4.180 4.064 0.116 2
1 1526 . 2 2 B 40 40 GLU CA C 461 57.800 58.384 -0.584 2
1 1527 . 2 2 B 40 40 GLU CB C 461 30.600 35.509 -4.909 2
1 1529 . 2 2 B 40 40 GLU N N 461 110.680 118.314 -7.634 2
1 1530 . 2 2 B 41 41 GLN H H 462 7.940 8.152 -0.212 2
1 1531 . 2 2 B 41 41 GLN HA H 462 4.100 4.370 -0.270 2
1 1538 . 2 2 B 41 41 GLN CA C 462 55.310 57.733 -2.423 2
1 1539 . 2 2 B 41 41 GLN CB C 462 28.780 30.829 -2.049 2
1 1541 . 2 2 B 41 41 GLN N N 462 120.720 118.833 1.887 2
1 1543 . 2 2 B 42 42 GLY H H 463 9.000 8.496 0.504 2
1 1544 . 2 2 B 42 42 GLY HA2 H 463 3.310 4.290 -0.980 2
1 1545 . 2 2 B 42 42 GLY HA3 H 463 4.820 4.293 0.527 2
1 1546 . 2 2 B 42 42 GLY CA C 463 42.650 49.195 -6.545 2
1 1547 . 2 2 B 42 42 GLY N N 463 104.110 114.881 -10.771 2
1 1548 . 2 2 B 43 43 ILE H H 464 7.900 8.357 -0.457 2
1 1549 . 2 2 B 43 43 ILE HA H 464 3.260 4.072 -0.812 2
1 1558 . 2 2 B 43 43 ILE CA C 464 66.570 60.122 6.448 2
1 1559 . 2 2 B 43 43 ILE CB C 464 38.770 33.519 5.251 2
1 1562 . 2 2 B 43 43 ILE N N 464 119.410 118.405 1.005 2
1 1563 . 2 2 B 44 44 ASP H H 465 8.730 8.192 0.538 2
1 1564 . 2 2 B 44 44 ASP HA H 465 4.310 4.119 0.191 2
1 1567 . 2 2 B 44 44 ASP CA C 465 56.740 55.325 1.415 2
1 1568 . 2 2 B 44 44 ASP CB C 465 40.120 28.905 11.215 2
1 1569 . 2 2 B 44 44 ASP N N 465 116.610 120.320 -3.710 2
1 1570 . 2 2 B 45 45 ASP H H 466 7.720 7.820 -0.100 2
1 1571 . 2 2 B 45 45 ASP HA H 466 4.480 4.416 0.064 2
1 1574 . 2 2 B 45 45 ASP CA C 466 57.000 58.754 -1.754 2
1 1575 . 2 2 B 45 45 ASP CB C 466 42.270 40.035 2.235 2
1 1576 . 2 2 B 45 45 ASP N N 466 117.560 118.740 -1.180 2
1 1577 . 2 2 B 46 46 LEU H H 467 7.370 8.267 -0.897 2
1 1578 . 2 2 B 46 46 LEU HA H 467 4.410 4.506 -0.096 2
1 1587 . 2 2 B 46 46 LEU CA C 467 53.660 56.838 -3.178 2
1 1588 . 2 2 B 46 46 LEU CB C 467 42.260 36.359 5.901 2
1 1591 . 2 2 B 46 46 LEU N N 467 116.890 122.105 -5.215 2
1 1592 . 2 2 B 47 47 ALA H H 468 7.080 7.964 -0.884 2
1 1593 . 2 2 B 47 47 ALA HA H 468 4.120 4.387 -0.267 2
1 1597 . 2 2 B 47 47 ALA CA C 468 54.130 55.760 -1.630 2
1 1598 . 2 2 B 47 47 ALA CB C 468 19.480 29.350 -9.870 2
1 1599 . 2 2 B 47 47 ALA N N 468 120.150 120.272 -0.122 2
1 1600 . 2 2 B 48 48 ASP H H 469 8.560 8.265 0.295 2
1 1601 . 2 2 B 48 48 ASP HA H 469 4.410 4.043 0.367 2
1 1604 . 2 2 B 48 48 ASP CA C 469 54.330 61.149 -6.819 2
1 1605 . 2 2 B 48 48 ASP CB C 469 39.760 39.060 0.700 2
1 1606 . 2 2 B 48 48 ASP N N 469 114.660 120.653 -5.993 2
1 1607 . 2 2 B 49 49 ILE H H 470 7.870 8.043 -0.173 2
1 1608 . 2 2 B 49 49 ILE HA H 470 3.850 4.319 -0.469 2
1 1618 . 2 2 B 49 49 ILE CA C 470 61.680 53.829 7.851 2
1 1619 . 2 2 B 49 49 ILE CB C 470 37.120 38.657 -1.537 2
1 1623 . 2 2 B 49 49 ILE N N 470 121.600 114.152 7.448 2
1 1624 . 2 2 B 50 50 GLU H H 471 8.680 8.238 0.442 2
1 1625 . 2 2 B 50 50 GLU HA H 471 3.940 4.085 -0.145 2
1 1630 . 2 2 B 50 50 GLU CA C 471 58.360 57.793 0.567 2
1 1631 . 2 2 B 50 50 GLU CB C 471 29.530 34.985 -5.455 2
1 1633 . 2 2 B 50 50 GLU N N 471 131.000 124.169 6.831 2
1 1634 . 2 2 B 51 51 GLY H H 472 8.860 8.235 0.625 2
1 1635 . 2 2 B 51 51 GLY HA2 H 472 3.640 3.997 -0.357 2
1 1636 . 2 2 B 51 51 GLY HA3 H 472 4.230 3.999 0.231 2
1 1637 . 2 2 B 51 51 GLY CA C 472 45.190 52.492 -7.302 2
1 1638 . 2 2 B 51 51 GLY N N 472 113.580 115.257 -1.677 2
1 1639 . 2 2 B 52 52 LEU H H 473 7.850 7.655 0.195 2
1 1640 . 2 2 B 52 52 LEU HA H 473 4.680 4.304 0.376 2
1 1650 . 2 2 B 52 52 LEU CA C 473 53.640 59.608 -5.968 2
1 1651 . 2 2 B 52 52 LEU CB C 473 42.990 37.315 5.675 2
1 1655 . 2 2 B 52 52 LEU N N 473 123.020 117.915 5.105 2
1 1656 . 2 2 B 53 53 THR H H 474 7.550 8.331 -0.781 2
1 1657 . 2 2 B 53 53 THR HA H 474 4.560 4.445 0.115 2
1 1662 . 2 2 B 53 53 THR CA C 474 60.060 59.802 0.258 2
1 1663 . 2 2 B 53 53 THR CB C 474 71.520 49.933 21.587 2
1 1665 . 2 2 B 53 53 THR N N 474 115.070 119.944 -4.874 2
1 1666 . 2 2 B 54 54 ASP H H 475 8.900 8.293 0.607 2
1 1667 . 2 2 B 54 54 ASP HA H 475 4.220 4.512 -0.292 2
1 1670 . 2 2 B 54 54 ASP CA C 475 57.520 56.247 1.273 2
1 1671 . 2 2 B 54 54 ASP CB C 475 39.560 36.334 3.226 2
1 1672 . 2 2 B 54 54 ASP N N 475 121.800 121.059 0.741 2
1 1673 . 2 2 B 55 55 GLU H H 476 8.460 8.343 0.117 2
1 1674 . 2 2 B 55 55 GLU HA H 476 3.970 4.219 -0.249 2
1 1679 . 2 2 B 55 55 GLU CA C 476 59.440 61.121 -1.681 2
1 1680 . 2 2 B 55 55 GLU CB C 476 29.650 49.560 -19.910 2
1 1682 . 2 2 B 55 55 GLU N N 476 119.460 118.767 0.693 2
1 1683 . 2 2 B 56 56 LYS H H 477 7.790 8.501 -0.711 2
1 1684 . 2 2 B 56 56 LYS HA H 477 4.120 4.024 0.096 2
1 1693 . 2 2 B 56 56 LYS CA C 477 58.890 59.405 -0.515 2
1 1694 . 2 2 B 56 56 LYS CB C 477 32.600 30.711 1.889 2
1 1698 . 2 2 B 56 56 LYS N N 477 121.840 122.653 -0.813 2
1 1699 . 2 2 B 57 57 ALA H H 478 8.900 8.561 0.339 2
1 1700 . 2 2 B 57 57 ALA HA H 478 3.790 3.787 0.003 2
1 1704 . 2 2 B 57 57 ALA CA C 478 55.810 61.227 -5.417 2
1 1705 . 2 2 B 57 57 ALA CB C 478 18.590 24.955 -6.365 2
1 1706 . 2 2 B 57 57 ALA N N 478 121.350 120.911 0.439 2
1 1707 . 2 2 B 58 58 GLY H H 479 8.300 8.197 0.103 2
1 1708 . 2 2 B 58 58 GLY HA2 H 479 3.500 3.790 -0.290 2
1 1709 . 2 2 B 58 58 GLY HA3 H 479 3.890 3.793 0.097 2
1 1710 . 2 2 B 58 58 GLY CA C 479 47.360 53.419 -6.059 2
1 1711 . 2 2 B 58 58 GLY N N 479 102.040 113.200 -11.160 2
1 1712 . 2 2 B 59 59 ALA H H 480 7.580 7.984 -0.404 2
1 1713 . 2 2 B 59 59 ALA HA H 480 4.110 4.098 0.013 2
1 1717 . 2 2 B 59 59 ALA CA C 480 55.580 56.157 -0.577 2
1 1718 . 2 2 B 59 59 ALA CB C 480 18.130 29.999 -11.869 2
1 1719 . 2 2 B 59 59 ALA N N 480 123.180 122.677 0.503 2
1 1720 . 2 2 B 60 60 LEU H H 481 8.290 8.153 0.137 2
1 1721 . 2 2 B 60 60 LEU HA H 481 4.020 4.000 0.020 2
1 1731 . 2 2 B 60 60 LEU CA C 481 57.850 57.661 0.189 2
1 1732 . 2 2 B 60 60 LEU CB C 481 42.360 41.462 0.898 2
1 1736 . 2 2 B 60 60 LEU N N 481 120.560 118.913 1.647 2
1 1737 . 2 2 B 61 61 ILE H H 482 8.080 7.686 0.394 2
1 1738 . 2 2 B 61 61 ILE HA H 482 3.210 3.910 -0.700 2
1 1748 . 2 2 B 61 61 ILE CA C 482 66.250 61.129 5.121 2
1 1749 . 2 2 B 61 61 ILE CB C 482 39.400 35.426 3.974 2
1 1753 . 2 2 B 61 61 ILE N N 482 119.170 118.525 0.645 2
1 1754 . 2 2 B 62 62 MET H H 483 8.110 7.923 0.187 2
1 1755 . 2 2 B 62 62 MET HA H 483 4.410 4.320 0.090 2
1 1763 . 2 2 B 62 62 MET CA C 483 56.110 59.316 -3.206 2
1 1764 . 2 2 B 62 62 MET CB C 483 28.260 51.093 -22.833 2
1 1767 . 2 2 B 62 62 MET N N 483 114.420 116.582 -2.162 2
1 1768 . 2 2 B 63 63 ALA H H 484 8.240 7.876 0.364 2
1 1769 . 2 2 B 63 63 ALA HA H 484 4.130 4.291 -0.161 2
1 1773 . 2 2 B 63 63 ALA CA C 484 55.300 59.697 -4.397 2
1 1774 . 2 2 B 63 63 ALA CB C 484 18.280 25.128 -6.848 2
1 1775 . 2 2 B 63 63 ALA N N 484 123.710 121.388 2.321 2
1 1776 . 2 2 B 64 64 ALA H H 485 8.050 8.613 -0.563 2
1 1777 . 2 2 B 64 64 ALA HA H 485 3.870 4.264 -0.394 2
1 1781 . 2 2 B 64 64 ALA CA C 485 55.330 55.267 0.063 2
1 1782 . 2 2 B 64 64 ALA CB C 485 17.660 28.239 -10.579 2
1 1783 . 2 2 B 64 64 ALA N N 485 120.070 118.408 1.662 2
1 1784 . 2 2 B 65 65 ARG H H 486 8.640 8.036 0.604 2
1 1785 . 2 2 B 65 65 ARG HA H 486 2.800 4.348 -1.548 2
1 1792 . 2 2 B 65 65 ARG CA C 486 60.600 56.699 3.901 2
1 1793 . 2 2 B 65 65 ARG CB C 486 29.910 36.500 -6.590 2
1 1796 . 2 2 B 65 65 ARG N N 486 118.730 118.663 0.067 2
1 1797 . 2 2 B 66 66 ASN H H 487 8.710 8.545 0.165 2
1 1798 . 2 2 B 66 66 ASN HA H 487 4.550 4.576 -0.026 2
1 1803 . 2 2 B 66 66 ASN CA C 487 56.390 50.358 6.032 2
1 1804 . 2 2 B 66 66 ASN CB C 487 37.970 38.512 -0.542 2
1 1805 . 2 2 B 66 66 ASN N N 487 119.170 113.726 5.444 2
1 1807 . 2 2 B 67 67 ILE H H 488 7.250 8.234 -0.984 2
1 1808 . 2 2 B 67 67 ILE HA H 488 3.810 3.868 -0.058 2
1 1818 . 2 2 B 67 67 ILE CA C 488 64.350 62.220 2.130 2
1 1819 . 2 2 B 67 67 ILE CB C 488 39.570 34.880 4.690 2
1 1823 . 2 2 B 67 67 ILE N N 488 117.890 119.963 -2.073 2
1 1824 . 2 2 B 68 68 CYS H H 489 8.350 8.057 0.293 2
1 1825 . 2 2 B 68 68 CYS HA H 489 4.080 4.074 0.006 2
1 1828 . 2 2 B 68 68 CYS CA C 489 62.670 61.028 1.642 2
1 1829 . 2 2 B 68 68 CYS CB C 489 28.170 29.781 -1.611 2
1 1830 . 2 2 B 68 68 CYS N N 489 115.230 119.774 -4.544 2
1 1831 . 2 2 B 69 69 TRP H H 490 8.230 8.422 -0.192 2
1 1832 . 2 2 B 69 69 TRP HA H 490 5.100 4.209 0.891 2
1 1841 . 2 2 B 69 69 TRP CA C 490 55.420 61.246 -5.826 2
1 1842 . 2 2 B 69 69 TRP CB C 490 31.010 46.036 -15.026 2
1 1844 . 2 2 B 69 69 TRP N N 490 116.850 118.613 -1.763 2
1 1846 . 2 2 B 70 70 PHE H H 491 7.570 8.260 -0.690 2
1 1847 . 2 2 B 70 70 PHE HA H 491 5.240 4.309 0.931 2
1 1852 . 2 2 B 70 70 PHE CA C 491 55.490 58.663 -3.173 2
1 1853 . 2 2 B 70 70 PHE CB C 491 38.700 40.141 -1.441 2
1 1856 . 2 2 B 70 70 PHE N N 491 117.460 119.968 -2.508 2
1 1857 . 2 2 B 71 71 GLY H H 492 8.420 8.101 0.319 2
1 1858 . 2 2 B 71 71 GLY HA2 H 492 3.920 3.864 0.056 2
1 1859 . 2 2 B 71 71 GLY HA3 H 492 4.080 3.891 0.189 2
1 1860 . 2 2 B 71 71 GLY CA C 492 46.210 56.815 -10.605 2
1 1861 . 2 2 B 71 71 GLY N N 492 110.040 111.534 -1.493 2
1 1862 . 2 2 B 72 72 ASP H H 493 8.370 8.183 0.187 2
1 1863 . 2 2 B 72 72 ASP HA H 493 4.630 4.187 0.443 2
1 1866 . 2 2 B 72 72 ASP CA C 493 54.410 58.064 -3.654 2
1 1867 . 2 2 B 72 72 ASP CB C 493 41.250 35.006 6.244 2
1 1868 . 2 2 B 72 72 ASP N N 493 120.000 120.825 -0.825 2
1 1869 . 2 2 B 73 73 GLU H H 494 8.230 8.040 0.190 2
1 1870 . 2 2 B 73 73 GLU HA H 494 4.260 3.936 0.324 2
1 1875 . 2 2 B 73 73 GLU CA C 494 56.510 61.686 -5.176 2
1 1876 . 2 2 B 73 73 GLU CB C 494 30.420 34.009 -3.589 2
1 1878 . 2 2 B 73 73 GLU N N 494 120.900 119.992 0.908 2
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