data_16390_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16390
_Entry.PDB_ID 2KLC
_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
1 289 . 1 1 1 A 46 46 SER H H 24 8.950 8.378 0.572 1
1 290 . 1 1 1 A 46 46 SER HA H 24 4.900 4.512 0.388 1
1 293 . 1 1 1 A 46 46 SER C C 24 170.890 176.146 -5.256 1
1 294 . 1 1 1 A 46 46 SER CA C 24 56.980 56.030 0.950 1
1 295 . 1 1 1 A 46 46 SER CB C 24 65.590 33.327 32.263 1
1 296 . 1 1 1 A 46 46 SER N N 24 120.420 122.207 -1.787 1
1 297 . 1 1 1 A 47 47 VAL H H 25 9.140 8.296 0.844 1
1 298 . 1 1 1 A 47 47 VAL HA H 25 3.440 4.318 -0.878 1
1 306 . 1 1 1 A 47 47 VAL C C 25 175.060 175.475 -0.415 1
1 307 . 1 1 1 A 47 47 VAL CA C 25 67.250 61.477 5.773 1
1 308 . 1 1 1 A 47 47 VAL CB C 25 30.780 39.156 -8.376 1
1 311 . 1 1 1 A 47 47 VAL N N 25 123.970 125.905 -1.935 1
1 312 . 1 1 1 A 48 48 GLN H H 26 8.540 8.643 -0.103 1
1 313 . 1 1 1 A 48 48 GLN HA H 26 4.070 4.780 -0.710 1
1 320 . 1 1 1 A 48 48 GLN CA C 26 60.230 55.285 4.945 1
1 321 . 1 1 1 A 48 48 GLN CB C 26 28.490 33.346 -4.856 1
1 323 . 1 1 1 A 48 48 GLN N N 26 120.550 128.362 -7.812 1
1 325 . 1 1 1 A 49 49 GLN HA H 27 3.950 4.892 -0.942 1
1 332 . 1 1 1 A 49 49 GLN C C 27 176.230 175.280 0.950 1
1 333 . 1 1 1 A 49 49 GLN CA C 27 58.710 55.717 2.993 1
1 334 . 1 1 1 A 49 49 GLN CB C 27 28.820 32.943 -4.123 1
1 337 . 1 1 1 A 50 50 PHE H H 28 8.050 8.780 -0.730 1
1 338 . 1 1 1 A 50 50 PHE HA H 28 4.620 4.633 -0.013 1
1 345 . 1 1 1 A 50 50 PHE C C 28 175.190 175.410 -0.220 1
1 346 . 1 1 1 A 50 50 PHE CA C 28 58.030 61.429 -3.399 1
1 347 . 1 1 1 A 50 50 PHE CB C 28 39.190 32.642 6.548 1
1 350 . 1 1 1 A 50 50 PHE N N 28 121.710 125.956 -4.246 1
1 351 . 1 1 1 A 51 51 LYS H H 29 8.940 8.627 0.313 1
1 352 . 1 1 1 A 51 51 LYS HA H 29 3.340 4.791 -1.451 1
1 361 . 1 1 1 A 51 51 LYS C C 29 175.370 174.263 1.107 1
1 362 . 1 1 1 A 51 51 LYS CA C 29 60.660 62.755 -2.095 1
1 363 . 1 1 1 A 51 51 LYS CB C 29 33.190 69.911 -36.721 1
1 367 . 1 1 1 A 51 51 LYS N N 29 117.530 122.734 -5.204 1
1 368 . 1 1 1 A 52 52 GLU H H 30 7.700 9.399 -1.699 1
1 369 . 1 1 1 A 52 52 GLU HA H 30 3.750 4.767 -1.017 1
1 374 . 1 1 1 A 52 52 GLU C C 30 176.780 174.222 2.558 1
1 375 . 1 1 1 A 52 52 GLU CA C 30 59.890 61.289 -1.399 1
1 376 . 1 1 1 A 52 52 GLU CB C 30 28.840 33.474 -4.634 1
1 378 . 1 1 1 A 52 52 GLU N N 30 118.820 127.524 -8.704 1
1 379 . 1 1 1 A 53 53 GLU H H 31 7.370 9.151 -1.781 1
1 380 . 1 1 1 A 53 53 GLU HA H 31 4.150 4.933 -0.783 1
1 385 . 1 1 1 A 53 53 GLU C C 31 177.040 176.123 0.917 1
1 386 . 1 1 1 A 53 53 GLU CA C 31 58.860 55.217 3.643 1
1 387 . 1 1 1 A 53 53 GLU CB C 31 29.200 33.916 -4.716 1
1 389 . 1 1 1 A 53 53 GLU N N 31 119.150 128.827 -9.677 1
1 390 . 1 1 1 A 54 54 ILE H H 32 8.000 8.468 -0.468 1
1 391 . 1 1 1 A 54 54 ILE HA H 32 3.550 4.936 -1.386 1
1 401 . 1 1 1 A 54 54 ILE C C 32 175.420 174.043 1.377 1
1 402 . 1 1 1 A 54 54 ILE CA C 32 64.690 58.564 6.126 1
1 403 . 1 1 1 A 54 54 ILE CB C 32 37.820 69.890 -32.070 1
1 407 . 1 1 1 A 54 54 ILE N N 32 119.970 118.112 1.858 1
1 409 . 1 1 1 A 55 55 SER HA H 33 3.930 4.379 -0.449 1
1 412 . 1 1 1 A 55 55 SER C C 33 173.830 178.243 -4.413 1
1 413 . 1 1 1 A 55 55 SER CA C 33 61.620 65.161 -3.541 1
1 414 . 1 1 1 A 55 55 SER CB C 33 62.720 32.031 30.689 1
1 415 . 1 1 1 A 55 55 SER N N 33 115.780 136.181 -20.401 1
1 416 . 1 1 1 A 56 56 LYS H H 34 7.150 8.843 -1.693 1
1 417 . 1 1 1 A 56 56 LYS HA H 34 4.090 4.276 -0.186 1
1 424 . 1 1 1 A 56 56 LYS C C 34 176.080 176.817 -0.737 1
1 425 . 1 1 1 A 56 56 LYS CA C 34 58.950 58.418 0.532 1
1 426 . 1 1 1 A 56 56 LYS CB C 34 32.540 33.743 -1.203 1
1 429 . 1 1 1 A 56 56 LYS N N 34 119.100 116.690 2.410 1
1 430 . 1 1 1 A 57 57 ARG H H 35 7.530 7.828 -0.298 1
1 431 . 1 1 1 A 57 57 ARG HA H 35 4.110 4.650 -0.540 1
1 436 . 1 1 1 A 57 57 ARG C C 35 174.800 173.963 0.837 1
1 437 . 1 1 1 A 57 57 ARG CA C 35 57.090 55.559 1.531 1
1 438 . 1 1 1 A 57 57 ARG CB C 35 29.810 30.319 -0.509 1
1 440 . 1 1 1 A 57 57 ARG N N 35 119.370 113.668 5.702 1
1 441 . 1 1 1 A 58 58 PHE H H 36 8.320 8.571 -0.251 1
1 442 . 1 1 1 A 58 58 PHE HA H 36 4.340 5.260 -0.920 1
1 449 . 1 1 1 A 58 58 PHE C C 36 171.940 174.083 -2.143 1
1 450 . 1 1 1 A 58 58 PHE CA C 36 58.500 54.560 3.940 1
1 451 . 1 1 1 A 58 58 PHE CB C 36 38.130 35.497 2.633 1
1 454 . 1 1 1 A 58 58 PHE N N 36 113.980 117.336 -3.356 1
1 455 . 1 1 1 A 59 59 LYS H H 37 7.790 9.212 -1.422 1
1 456 . 1 1 1 A 59 59 LYS HA H 37 3.960 5.072 -1.112 1
1 463 . 1 1 1 A 59 59 LYS C C 37 172.670 174.237 -1.567 1
1 464 . 1 1 1 A 59 59 LYS CA C 37 57.140 54.567 2.573 1
1 465 . 1 1 1 A 59 59 LYS CB C 37 29.020 33.342 -4.322 1
1 468 . 1 1 1 A 59 59 LYS N N 37 118.810 122.757 -3.947 1
1 469 . 1 1 1 A 60 60 SER H H 38 7.750 8.363 -0.613 1
1 470 . 1 1 1 A 60 60 SER HA H 38 4.700 5.064 -0.364 1
1 473 . 1 1 1 A 60 60 SER C C 38 170.170 174.756 -4.586 1
1 474 . 1 1 1 A 60 60 SER CA C 38 57.130 55.489 1.641 1
1 475 . 1 1 1 A 60 60 SER CB C 38 66.820 33.084 33.736 1
1 476 . 1 1 1 A 60 60 SER N N 38 112.620 123.517 -10.897 1
1 477 . 1 1 1 A 61 61 HIS H H 39 8.630 9.269 -0.639 1
1 478 . 1 1 1 A 61 61 HIS N N 39 124.090 126.434 -2.344 1
1 479 . 1 1 1 A 62 62 THR HA H 40 3.610 5.322 -1.712 1
1 484 . 1 1 1 A 62 62 THR C C 40 174.350 176.606 -2.256 1
1 485 . 1 1 1 A 62 62 THR CA C 40 66.160 50.432 15.728 1
1 486 . 1 1 1 A 62 62 THR CB C 40 68.070 21.015 47.055 1
1 488 . 1 1 1 A 63 63 ASP H H 41 10.310 8.751 1.559 1
1 489 . 1 1 1 A 63 63 ASP HA H 41 4.420 4.967 -0.547 1
1 492 . 1 1 1 A 63 63 ASP C C 41 174.630 174.878 -0.248 1
1 493 . 1 1 1 A 63 63 ASP CA C 41 56.330 58.056 -1.726 1
1 494 . 1 1 1 A 63 63 ASP CB C 41 40.040 34.640 5.400 1
1 495 . 1 1 1 A 63 63 ASP N N 41 122.900 117.921 4.979 1
1 497 . 1 1 1 A 64 64 GLN HA H 42 4.270 4.542 -0.272 1
1 504 . 1 1 1 A 64 64 GLN C C 42 172.160 177.822 -5.662 1
1 505 . 1 1 1 A 64 64 GLN CA C 42 55.860 63.540 -7.680 1
1 506 . 1 1 1 A 64 64 GLN CB C 42 30.480 31.848 -1.368 1
1 508 . 1 1 1 A 64 64 GLN N N 42 115.750 137.567 -21.817 1
1 510 . 1 1 1 A 65 65 LEU H H 43 7.250 8.140 -0.890 1
1 511 . 1 1 1 A 65 65 LEU HA H 43 4.440 4.002 0.438 1
1 517 . 1 1 1 A 65 65 LEU C C 43 173.160 176.437 -3.277 1
1 518 . 1 1 1 A 65 65 LEU CA C 43 54.620 57.543 -2.923 1
1 519 . 1 1 1 A 65 65 LEU CB C 43 41.990 27.525 14.465 1
1 521 . 1 1 1 A 65 65 LEU N N 43 116.570 118.137 -1.567 1
1 522 . 1 1 1 A 66 66 VAL H H 44 8.690 7.913 0.777 1
1 523 . 1 1 1 A 66 66 VAL HA H 44 3.980 4.780 -0.800 1
1 528 . 1 1 1 A 66 66 VAL C C 44 171.340 175.731 -4.391 1
1 529 . 1 1 1 A 66 66 VAL CA C 44 61.910 54.987 6.923 1
1 530 . 1 1 1 A 66 66 VAL CB C 44 33.630 39.173 -5.543 1
1 532 . 1 1 1 A 66 66 VAL N N 44 125.260 118.691 6.569 1
1 533 . 1 1 1 A 67 67 LEU H H 45 8.570 7.729 0.841 1
1 534 . 1 1 1 A 67 67 LEU HA H 45 5.220 4.790 0.430 1
1 544 . 1 1 1 A 67 67 LEU C C 45 172.500 174.034 -1.534 1
1 545 . 1 1 1 A 67 67 LEU CA C 45 52.820 59.979 -7.159 1
1 546 . 1 1 1 A 67 67 LEU CB C 45 45.310 63.296 -17.986 1
1 550 . 1 1 1 A 67 67 LEU N N 45 126.690 116.260 10.430 1
1 551 . 1 1 1 A 68 68 ILE H H 46 9.040 8.598 0.442 1
1 552 . 1 1 1 A 68 68 ILE HA H 46 4.880 4.526 0.354 1
1 562 . 1 1 1 A 68 68 ILE C C 46 172.390 175.819 -3.429 1
1 563 . 1 1 1 A 68 68 ILE CA C 46 59.900 57.999 1.901 1
1 564 . 1 1 1 A 68 68 ILE CB C 46 41.940 64.474 -22.534 1
1 568 . 1 1 1 A 68 68 ILE N N 46 122.590 121.793 0.797 1
1 569 . 1 1 1 A 69 69 PHE H H 47 8.740 8.395 0.345 1
1 570 . 1 1 1 A 69 69 PHE N N 47 125.360 121.952 3.408 1
1 571 . 1 1 1 A 70 70 ALA HA H 48 3.600 4.036 -0.436 1
1 575 . 1 1 1 A 70 70 ALA C C 48 174.500 177.562 -3.062 1
1 576 . 1 1 1 A 70 70 ALA CA C 48 52.520 58.234 -5.714 1
1 577 . 1 1 1 A 70 70 ALA CB C 48 16.760 28.112 -11.352 1
1 578 . 1 1 1 A 71 71 GLY H H 49 8.210 7.719 0.491 1
1 581 . 1 1 1 A 71 71 GLY C C 49 170.850 178.012 -7.162 1
1 582 . 1 1 1 A 71 71 GLY CA C 49 45.380 57.408 -12.028 1
1 583 . 1 1 1 A 71 71 GLY N N 49 102.430 118.367 -15.937 1
1 584 . 1 1 1 A 72 72 LYS H H 50 7.840 8.244 -0.404 1
1 585 . 1 1 1 A 72 72 LYS HA H 50 4.530 4.074 0.456 1
1 594 . 1 1 1 A 72 72 LYS C C 50 171.800 177.643 -5.843 1
1 595 . 1 1 1 A 72 72 LYS CA C 50 54.630 61.208 -6.578 1
1 596 . 1 1 1 A 72 72 LYS CB C 50 34.630 38.905 -4.275 1
1 600 . 1 1 1 A 72 72 LYS N N 50 121.570 123.031 -1.461 1
1 601 . 1 1 1 A 73 73 ILE H H 51 8.250 8.292 -0.042 1
1 602 . 1 1 1 A 73 73 ILE HA H 51 4.260 3.868 0.392 1
1 612 . 1 1 1 A 73 73 ILE C C 51 174.300 178.203 -3.903 1
1 613 . 1 1 1 A 73 73 ILE CA C 51 61.270 58.234 3.036 1
1 614 . 1 1 1 A 73 73 ILE CB C 51 38.150 31.193 6.957 1
1 618 . 1 1 1 A 73 73 ILE N N 51 122.710 118.014 4.696 1
1 619 . 1 1 1 A 74 74 LEU H H 52 8.540 8.112 0.428 1
1 620 . 1 1 1 A 74 74 LEU HA H 52 3.980 4.104 -0.124 1
1 630 . 1 1 1 A 74 74 LEU C C 52 173.440 179.088 -5.648 1
1 631 . 1 1 1 A 74 74 LEU CA C 52 54.660 58.879 -4.219 1
1 632 . 1 1 1 A 74 74 LEU CB C 52 41.790 29.336 12.454 1
1 636 . 1 1 1 A 74 74 LEU N N 52 128.360 118.966 9.394 1
1 637 . 1 1 1 A 75 75 LYS H H 53 8.100 7.571 0.529 1
1 638 . 1 1 1 A 75 75 LYS HA H 53 4.440 3.922 0.518 1
1 645 . 1 1 1 A 75 75 LYS C C 53 175.170 178.987 -3.817 1
1 646 . 1 1 1 A 75 75 LYS CA C 53 55.340 58.781 -3.441 1
1 647 . 1 1 1 A 75 75 LYS CB C 53 32.680 29.094 3.586 1
1 650 . 1 1 1 A 75 75 LYS N N 53 123.470 119.787 3.683 1
1 651 . 1 1 1 A 76 76 ASP H H 54 8.310 7.078 1.232 1
1 652 . 1 1 1 A 76 76 ASP HA H 54 4.110 3.522 0.588 1
1 655 . 1 1 1 A 76 76 ASP C C 54 174.270 177.789 -3.519 1
1 656 . 1 1 1 A 76 76 ASP CA C 54 58.140 65.296 -7.156 1
1 657 . 1 1 1 A 76 76 ASP CB C 54 40.760 37.632 3.128 1
1 658 . 1 1 1 A 76 76 ASP N N 54 121.080 120.855 0.225 1
1 659 . 1 1 1 A 77 77 GLN H H 55 8.180 8.113 0.067 1
1 660 . 1 1 1 A 77 77 GLN HA H 55 4.360 4.165 0.195 1
1 667 . 1 1 1 A 77 77 GLN C C 55 173.710 176.577 -2.867 1
1 668 . 1 1 1 A 77 77 GLN CA C 55 56.350 61.264 -4.914 1
1 669 . 1 1 1 A 77 77 GLN CB C 55 28.090 62.730 -34.640 1
1 671 . 1 1 1 A 77 77 GLN N N 55 113.190 114.869 -1.679 1
1 673 . 1 1 1 A 78 78 ASP H H 56 7.770 7.738 0.032 1
1 674 . 1 1 1 A 78 78 ASP HA H 56 4.700 4.022 0.678 1
1 677 . 1 1 1 A 78 78 ASP C C 56 173.500 178.694 -5.194 1
1 678 . 1 1 1 A 78 78 ASP CA C 56 54.140 59.315 -5.175 1
1 679 . 1 1 1 A 78 78 ASP CB C 56 42.020 31.902 10.118 1
1 680 . 1 1 1 A 78 78 ASP N N 56 121.910 119.307 2.603 1
1 681 . 1 1 1 A 79 79 THR H H 57 8.490 7.948 0.542 1
1 682 . 1 1 1 A 79 79 THR HA H 57 4.700 4.075 0.625 1
1 687 . 1 1 1 A 79 79 THR C C 57 172.840 178.420 -5.580 1
1 688 . 1 1 1 A 79 79 THR CA C 57 59.980 59.191 0.789 1
1 689 . 1 1 1 A 79 79 THR CB C 57 70.640 30.452 40.188 1
1 691 . 1 1 1 A 79 79 THR N N 57 108.860 119.712 -10.852 1
1 692 . 1 1 1 A 80 80 LEU H H 58 7.700 8.102 -0.402 1
1 693 . 1 1 1 A 80 80 LEU HA H 58 3.880 4.618 -0.738 1
1 703 . 1 1 1 A 80 80 LEU C C 58 177.370 174.791 2.579 1
1 704 . 1 1 1 A 80 80 LEU CA C 58 58.450 57.398 1.052 1
1 705 . 1 1 1 A 80 80 LEU CB C 58 39.500 39.007 0.493 1
1 709 . 1 1 1 A 80 80 LEU N N 58 118.820 115.437 3.383 1
1 710 . 1 1 1 A 81 81 SER H H 59 8.810 7.623 1.187 1
1 711 . 1 1 1 A 81 81 SER HA H 59 4.050 3.773 0.277 1
1 714 . 1 1 1 A 81 81 SER C C 59 176.150 174.639 1.511 1
1 715 . 1 1 1 A 81 81 SER CA C 59 61.190 57.323 3.867 1
1 716 . 1 1 1 A 81 81 SER CB C 59 62.490 29.293 33.197 1
1 717 . 1 1 1 A 81 81 SER N N 59 114.240 116.481 -2.241 1
1 718 . 1 1 1 A 82 82 GLN H H 60 7.950 7.949 0.001 1
1 719 . 1 1 1 A 82 82 GLN HA H 60 4.090 4.865 -0.775 1
1 726 . 1 1 1 A 82 82 GLN C C 60 173.930 173.384 0.546 1
1 727 . 1 1 1 A 82 82 GLN CA C 60 58.080 57.415 0.665 1
1 728 . 1 1 1 A 82 82 GLN CB C 60 28.460 65.709 -37.249 1
1 730 . 1 1 1 A 82 82 GLN N N 60 122.620 113.863 8.757 1
1 732 . 1 1 1 A 83 83 HIS H H 61 6.990 8.561 -1.571 1
1 733 . 1 1 1 A 83 83 HIS HA H 61 4.490 4.820 -0.330 1
1 736 . 1 1 1 A 83 83 HIS C C 61 172.260 176.872 -4.612 1
1 737 . 1 1 1 A 83 83 HIS CA C 61 57.110 55.927 1.183 1
1 738 . 1 1 1 A 83 83 HIS CB C 61 32.780 30.576 2.204 1
1 739 . 1 1 1 A 83 83 HIS N N 61 116.940 120.726 -3.786 1
1 740 . 1 1 1 A 84 84 GLY H H 62 7.870 9.103 -1.233 1
1 743 . 1 1 1 A 84 84 GLY C C 62 171.040 176.538 -5.498 1
1 744 . 1 1 1 A 84 84 GLY CA C 62 45.390 65.645 -20.255 1
1 745 . 1 1 1 A 84 84 GLY N N 62 106.740 117.232 -10.492 1
1 746 . 1 1 1 A 85 85 ILE H H 63 6.810 8.209 -1.399 1
1 747 . 1 1 1 A 85 85 ILE HA H 63 3.050 4.421 -1.371 1
1 757 . 1 1 1 A 85 85 ILE C C 63 170.130 177.614 -7.484 1
1 758 . 1 1 1 A 85 85 ILE CA C 63 62.440 57.074 5.366 1
1 759 . 1 1 1 A 85 85 ILE CB C 63 36.110 40.889 -4.779 1
1 763 . 1 1 1 A 85 85 ILE N N 63 118.920 121.537 -2.617 1
1 764 . 1 1 1 A 86 86 HIS H H 64 6.020 7.483 -1.463 1
1 765 . 1 1 1 A 86 86 HIS HA H 64 5.030 4.390 0.640 1
1 768 . 1 1 1 A 86 86 HIS C C 64 170.090 175.444 -5.354 1
1 769 . 1 1 1 A 86 86 HIS CA C 64 53.500 56.468 -2.968 1
1 770 . 1 1 1 A 86 86 HIS CB C 64 31.860 29.246 2.614 1
1 771 . 1 1 1 A 86 86 HIS N N 64 122.440 115.724 6.716 1
1 772 . 1 1 1 A 87 87 ASP H H 65 8.340 7.265 1.075 1
1 773 . 1 1 1 A 87 87 ASP HA H 65 4.320 4.552 -0.232 1
1 776 . 1 1 1 A 87 87 ASP C C 65 174.370 175.370 -1.000 1
1 777 . 1 1 1 A 87 87 ASP CA C 65 56.440 53.536 2.904 1
1 778 . 1 1 1 A 87 87 ASP CB C 65 43.150 42.826 0.324 1
1 779 . 1 1 1 A 87 87 ASP N N 65 116.230 121.057 -4.827 1
1 780 . 1 1 1 A 88 88 GLY H H 66 9.330 8.826 0.504 1
1 783 . 1 1 1 A 88 88 GLY C C 66 172.330 174.433 -2.103 1
1 784 . 1 1 1 A 88 88 GLY CA C 66 45.270 60.474 -15.204 1
1 785 . 1 1 1 A 88 88 GLY N N 66 112.300 119.846 -7.546 1
1 786 . 1 1 1 A 89 89 LEU H H 67 7.640 9.066 -1.426 1
1 787 . 1 1 1 A 89 89 LEU HA H 67 4.720 4.578 0.142 1
1 797 . 1 1 1 A 89 89 LEU C C 67 172.460 176.055 -3.595 1
1 798 . 1 1 1 A 89 89 LEU CA C 67 54.420 54.355 0.065 1
1 799 . 1 1 1 A 89 89 LEU CB C 67 42.260 42.439 -0.179 1
1 803 . 1 1 1 A 89 89 LEU N N 67 120.310 128.164 -7.854 1
1 804 . 1 1 1 A 90 90 THR H H 68 8.110 8.756 -0.646 1
1 805 . 1 1 1 A 90 90 THR HA H 68 5.300 5.310 -0.010 1
1 810 . 1 1 1 A 90 90 THR C C 68 170.900 174.913 -4.013 1
1 811 . 1 1 1 A 90 90 THR CA C 68 61.870 60.241 1.629 1
1 812 . 1 1 1 A 90 90 THR CB C 68 71.320 41.208 30.112 1
1 814 . 1 1 1 A 90 90 THR N N 68 115.300 122.170 -6.870 1
1 815 . 1 1 1 A 91 91 VAL H H 69 9.290 9.125 0.165 1
1 816 . 1 1 1 A 91 91 VAL HA H 69 4.540 4.752 -0.212 1
1 824 . 1 1 1 A 91 91 VAL C C 69 170.890 174.661 -3.771 1
1 825 . 1 1 1 A 91 91 VAL CA C 69 60.310 57.908 2.402 1
1 826 . 1 1 1 A 91 91 VAL CB C 69 34.680 42.608 -7.928 1
1 829 . 1 1 1 A 91 91 VAL N N 69 124.200 126.914 -2.714 1
1 830 . 1 1 1 A 92 92 HIS H H 70 8.750 8.515 0.235 1
1 831 . 1 1 1 A 92 92 HIS HA H 70 5.020 3.838 1.182 1
1 835 . 1 1 1 A 92 92 HIS C C 70 170.890 177.090 -6.200 1
1 836 . 1 1 1 A 92 92 HIS CA C 70 56.750 53.219 3.531 1
1 837 . 1 1 1 A 92 92 HIS CB C 70 32.220 17.904 14.316 1
1 839 . 1 1 1 A 92 92 HIS N N 70 125.250 129.134 -3.884 1
1 840 . 1 1 1 A 93 93 LEU H H 71 8.290 8.452 -0.162 1
1 851 . 1 1 1 A 93 93 LEU C C 71 172.570 173.576 -1.006 1
1 852 . 1 1 1 A 93 93 LEU CA C 71 52.820 45.422 7.398 1
1 857 . 1 1 1 A 93 93 LEU N N 71 123.360 102.954 20.406 1
1 858 . 1 1 1 A 94 94 VAL H H 72 9.110 7.417 1.693 1
1 859 . 1 1 1 A 94 94 VAL HA H 72 4.080 4.939 -0.859 1
1 864 . 1 1 1 A 94 94 VAL C C 72 171.160 175.417 -4.257 1
1 865 . 1 1 1 A 94 94 VAL CA C 72 61.350 54.259 7.091 1
1 866 . 1 1 1 A 94 94 VAL CB C 72 34.640 35.915 -1.275 1
1 868 . 1 1 1 A 94 94 VAL N N 72 128.650 115.359 13.291 1
1 869 . 1 1 1 A 95 95 ILE H H 73 8.150 8.280 -0.130 1
1 870 . 1 1 1 A 95 95 ILE HA H 73 4.500 4.439 0.061 1
1 880 . 1 1 1 A 95 95 ILE C C 73 174.320 175.779 -1.459 1
1 881 . 1 1 1 A 95 95 ILE CA C 73 60.170 60.946 -0.776 1
1 882 . 1 1 1 A 95 95 ILE CB C 73 38.120 38.644 -0.524 1
1 886 . 1 1 1 A 95 95 ILE N N 73 125.560 118.960 6.600 1
1 887 . 1 1 1 A 96 96 LYS H H 74 9.280 8.849 0.431 1
1 888 . 1 1 1 A 96 96 LYS HA H 74 4.240 4.569 -0.329 1
1 891 . 1 1 1 A 96 96 LYS C C 74 173.510 176.223 -2.713 1
1 892 . 1 1 1 A 96 96 LYS CA C 74 56.730 54.121 2.609 1
1 893 . 1 1 1 A 96 96 LYS CB C 74 33.100 41.196 -8.096 1
1 894 . 1 1 1 A 96 96 LYS N N 74 129.290 127.173 2.117 1
1 895 . 1 1 1 A 97 97 THR H H 75 8.040 8.875 -0.835 1
1 896 . 1 1 1 A 97 97 THR HA H 75 4.230 4.612 -0.382 1
1 901 . 1 1 1 A 97 97 THR C C 75 171.800 177.516 -5.716 1
1 902 . 1 1 1 A 97 97 THR CA C 75 61.760 55.045 6.715 1
1 903 . 1 1 1 A 97 97 THR CB C 75 69.830 34.397 35.433 1
1 905 . 1 1 1 A 97 97 THR N N 75 114.420 125.203 -10.783 1
1 906 . 1 1 1 A 98 98 GLN H H 76 8.400 8.881 -0.481 1
1 907 . 1 1 1 A 98 98 GLN HA H 76 4.210 4.455 -0.245 1
1 914 . 1 1 1 A 98 98 GLN CA C 76 55.880 56.495 -0.615 1
1 915 . 1 1 1 A 98 98 GLN CB C 76 29.700 39.901 -10.201 1
1 917 . 1 1 1 A 98 98 GLN N N 76 122.370 121.146 1.224 1
1 919 . 1 1 1 A 99 99 ASN HA H 77 4.590 4.234 0.356 1
1 924 . 1 1 1 A 99 99 ASN C C 77 171.780 175.987 -4.207 1
1 925 . 1 1 1 A 99 99 ASN CA C 77 53.300 57.517 -4.217 1
1 926 . 1 1 1 A 99 99 ASN CB C 77 38.920 28.084 10.836 1
1 928 . 1 1 1 A 100 100 ARG H H 78 8.160 7.758 0.402 1
1 929 . 1 1 1 A 100 100 ARG HA H 78 4.560 4.849 -0.289 1
1 936 . 1 1 1 A 100 100 ARG CA C 78 53.860 53.614 0.246 1
1 937 . 1 1 1 A 100 100 ARG CB C 78 30.210 42.316 -12.106 1
1 940 . 1 1 1 A 100 100 ARG N N 78 122.840 121.023 1.817 1
1 941 . 1 1 1 A 101 101 PRO HA H 79 4.150 4.958 -0.808 1
1 948 . 1 1 1 A 101 101 PRO CA C 79 64.770 59.169 5.601 1
1 949 . 1 1 1 A 101 101 PRO CB C 79 32.040 71.593 -39.553 1
1 289 . 2 1 1 A 46 46 SER H H 24 8.950 8.439 0.511 1
1 290 . 2 1 1 A 46 46 SER HA H 24 4.900 4.500 0.400 1
1 293 . 2 1 1 A 46 46 SER C C 24 170.890 176.230 -5.340 1
1 294 . 2 1 1 A 46 46 SER CA C 24 56.980 55.976 1.004 1
1 295 . 2 1 1 A 46 46 SER CB C 24 65.590 33.436 32.154 1
1 296 . 2 1 1 A 46 46 SER N N 24 120.420 121.769 -1.349 1
1 297 . 2 1 1 A 47 47 VAL H H 25 9.140 8.266 0.874 1
1 298 . 2 1 1 A 47 47 VAL HA H 25 3.440 4.383 -0.943 1
1 306 . 2 1 1 A 47 47 VAL C C 25 175.060 176.031 -0.971 1
1 307 . 2 1 1 A 47 47 VAL CA C 25 67.250 61.197 6.053 1
1 308 . 2 1 1 A 47 47 VAL CB C 25 30.780 39.507 -8.727 1
1 311 . 2 1 1 A 47 47 VAL N N 25 123.970 126.071 -2.101 1
1 312 . 2 1 1 A 48 48 GLN H H 26 8.540 8.783 -0.243 1
1 313 . 2 1 1 A 48 48 GLN HA H 26 4.070 4.813 -0.743 1
1 320 . 2 1 1 A 48 48 GLN CA C 26 60.230 53.926 6.304 1
1 321 . 2 1 1 A 48 48 GLN CB C 26 28.490 32.573 -4.083 1
1 323 . 2 1 1 A 48 48 GLN N N 26 120.550 126.792 -6.242 1
1 325 . 2 1 1 A 49 49 GLN HA H 27 3.950 4.680 -0.730 1
1 332 . 2 1 1 A 49 49 GLN C C 27 176.230 175.410 0.820 1
1 333 . 2 1 1 A 49 49 GLN CA C 27 58.710 55.926 2.784 1
1 334 . 2 1 1 A 49 49 GLN CB C 27 28.820 32.214 -3.394 1
1 337 . 2 1 1 A 50 50 PHE H H 28 8.050 8.972 -0.922 1
1 338 . 2 1 1 A 50 50 PHE HA H 28 4.620 4.722 -0.102 1
1 345 . 2 1 1 A 50 50 PHE C C 28 175.190 175.207 -0.017 1
1 346 . 2 1 1 A 50 50 PHE CA C 28 58.030 61.491 -3.461 1
1 347 . 2 1 1 A 50 50 PHE CB C 28 39.190 32.666 6.524 1
1 350 . 2 1 1 A 50 50 PHE N N 28 121.710 125.140 -3.430 1
1 351 . 2 1 1 A 51 51 LYS H H 29 8.940 8.564 0.376 1
1 352 . 2 1 1 A 51 51 LYS HA H 29 3.340 4.717 -1.377 1
1 361 . 2 1 1 A 51 51 LYS C C 29 175.370 174.579 0.791 1
1 362 . 2 1 1 A 51 51 LYS CA C 29 60.660 62.555 -1.895 1
1 363 . 2 1 1 A 51 51 LYS CB C 29 33.190 70.045 -36.855 1
1 367 . 2 1 1 A 51 51 LYS N N 29 117.530 123.189 -5.659 1
1 368 . 2 1 1 A 52 52 GLU H H 30 7.700 9.171 -1.471 1
1 369 . 2 1 1 A 52 52 GLU HA H 30 3.750 4.931 -1.181 1
1 374 . 2 1 1 A 52 52 GLU C C 30 176.780 174.113 2.667 1
1 375 . 2 1 1 A 52 52 GLU CA C 30 59.890 61.423 -1.533 1
1 376 . 2 1 1 A 52 52 GLU CB C 30 28.840 34.961 -6.121 1
1 378 . 2 1 1 A 52 52 GLU N N 30 118.820 126.076 -7.256 1
1 379 . 2 1 1 A 53 53 GLU H H 31 7.370 9.244 -1.874 1
1 380 . 2 1 1 A 53 53 GLU HA H 31 4.150 5.036 -0.886 1
1 385 . 2 1 1 A 53 53 GLU C C 31 177.040 175.916 1.124 1
1 386 . 2 1 1 A 53 53 GLU CA C 31 58.860 55.125 3.735 1
1 387 . 2 1 1 A 53 53 GLU CB C 31 29.200 33.998 -4.798 1
1 389 . 2 1 1 A 53 53 GLU N N 31 119.150 129.395 -10.245 1
1 390 . 2 1 1 A 54 54 ILE H H 32 8.000 8.641 -0.641 1
1 391 . 2 1 1 A 54 54 ILE HA H 32 3.550 4.951 -1.401 1
1 401 . 2 1 1 A 54 54 ILE C C 32 175.420 174.123 1.297 1
1 402 . 2 1 1 A 54 54 ILE CA C 32 64.690 58.836 5.854 1
1 403 . 2 1 1 A 54 54 ILE CB C 32 37.820 70.034 -32.214 1
1 407 . 2 1 1 A 54 54 ILE N N 32 119.970 117.090 2.880 1
1 409 . 2 1 1 A 55 55 SER HA H 33 3.930 4.440 -0.510 1
1 412 . 2 1 1 A 55 55 SER C C 33 173.830 177.499 -3.669 1
1 413 . 2 1 1 A 55 55 SER CA C 33 61.620 64.651 -3.031 1
1 414 . 2 1 1 A 55 55 SER CB C 33 62.720 31.958 30.762 1
1 415 . 2 1 1 A 55 55 SER N N 33 115.780 136.939 -21.159 1
1 416 . 2 1 1 A 56 56 LYS H H 34 7.150 8.451 -1.301 1
1 417 . 2 1 1 A 56 56 LYS HA H 34 4.090 4.348 -0.258 1
1 424 . 2 1 1 A 56 56 LYS C C 34 176.080 176.741 -0.661 1
1 425 . 2 1 1 A 56 56 LYS CA C 34 58.950 57.335 1.615 1
1 426 . 2 1 1 A 56 56 LYS CB C 34 32.540 33.838 -1.298 1
1 429 . 2 1 1 A 56 56 LYS N N 34 119.100 116.738 2.362 1
1 430 . 2 1 1 A 57 57 ARG H H 35 7.530 7.863 -0.333 1
1 431 . 2 1 1 A 57 57 ARG HA H 35 4.110 4.655 -0.545 1
1 436 . 2 1 1 A 57 57 ARG C C 35 174.800 174.072 0.728 1
1 437 . 2 1 1 A 57 57 ARG CA C 35 57.090 55.583 1.507 1
1 438 . 2 1 1 A 57 57 ARG CB C 35 29.810 31.109 -1.299 1
1 440 . 2 1 1 A 57 57 ARG N N 35 119.370 114.009 5.361 1
1 441 . 2 1 1 A 58 58 PHE H H 36 8.320 8.793 -0.473 1
1 442 . 2 1 1 A 58 58 PHE HA H 36 4.340 5.507 -1.167 1
1 449 . 2 1 1 A 58 58 PHE C C 36 171.940 174.525 -2.585 1
1 450 . 2 1 1 A 58 58 PHE CA C 36 58.500 54.924 3.576 1
1 451 . 2 1 1 A 58 58 PHE CB C 36 38.130 36.216 1.914 1
1 454 . 2 1 1 A 58 58 PHE N N 36 113.980 117.437 -3.457 1
1 455 . 2 1 1 A 59 59 LYS H H 37 7.790 9.055 -1.265 1
1 456 . 2 1 1 A 59 59 LYS HA H 37 3.960 4.770 -0.810 1
1 463 . 2 1 1 A 59 59 LYS C C 37 172.670 174.228 -1.558 1
1 464 . 2 1 1 A 59 59 LYS CA C 37 57.140 54.536 2.604 1
1 465 . 2 1 1 A 59 59 LYS CB C 37 29.020 32.889 -3.869 1
1 468 . 2 1 1 A 59 59 LYS N N 37 118.810 123.308 -4.498 1
1 469 . 2 1 1 A 60 60 SER H H 38 7.750 8.566 -0.816 1
1 470 . 2 1 1 A 60 60 SER HA H 38 4.700 4.942 -0.242 1
1 473 . 2 1 1 A 60 60 SER C C 38 170.170 174.724 -4.554 1
1 474 . 2 1 1 A 60 60 SER CA C 38 57.130 55.132 1.998 1
1 475 . 2 1 1 A 60 60 SER CB C 38 66.820 32.298 34.522 1
1 476 . 2 1 1 A 60 60 SER N N 38 112.620 123.492 -10.872 1
1 477 . 2 1 1 A 61 61 HIS H H 39 8.630 9.549 -0.919 1
1 478 . 2 1 1 A 61 61 HIS N N 39 124.090 126.402 -2.312 1
1 479 . 2 1 1 A 62 62 THR HA H 40 3.610 4.705 -1.095 1
1 484 . 2 1 1 A 62 62 THR C C 40 174.350 177.068 -2.718 1
1 485 . 2 1 1 A 62 62 THR CA C 40 66.160 51.175 14.985 1
1 486 . 2 1 1 A 62 62 THR CB C 40 68.070 20.106 47.964 1
1 488 . 2 1 1 A 63 63 ASP H H 41 10.310 8.846 1.464 1
1 489 . 2 1 1 A 63 63 ASP HA H 41 4.420 4.960 -0.540 1
1 492 . 2 1 1 A 63 63 ASP C C 41 174.630 174.901 -0.271 1
1 493 . 2 1 1 A 63 63 ASP CA C 41 56.330 58.163 -1.833 1
1 494 . 2 1 1 A 63 63 ASP CB C 41 40.040 34.468 5.572 1
1 495 . 2 1 1 A 63 63 ASP N N 41 122.900 118.567 4.333 1
1 497 . 2 1 1 A 64 64 GLN HA H 42 4.270 4.576 -0.306 1
1 504 . 2 1 1 A 64 64 GLN C C 42 172.160 177.675 -5.515 1
1 505 . 2 1 1 A 64 64 GLN CA C 42 55.860 63.019 -7.159 1
1 506 . 2 1 1 A 64 64 GLN CB C 42 30.480 31.002 -0.522 1
1 508 . 2 1 1 A 64 64 GLN N N 42 115.750 138.394 -22.644 1
1 510 . 2 1 1 A 65 65 LEU H H 43 7.250 8.209 -0.959 1
1 511 . 2 1 1 A 65 65 LEU HA H 43 4.440 3.986 0.454 1
1 517 . 2 1 1 A 65 65 LEU C C 43 173.160 176.250 -3.090 1
1 518 . 2 1 1 A 65 65 LEU CA C 43 54.620 57.528 -2.908 1
1 519 . 2 1 1 A 65 65 LEU CB C 43 41.990 27.435 14.555 1
1 521 . 2 1 1 A 65 65 LEU N N 43 116.570 117.697 -1.127 1
1 522 . 2 1 1 A 66 66 VAL H H 44 8.690 8.338 0.352 1
1 523 . 2 1 1 A 66 66 VAL HA H 44 3.980 4.982 -1.002 1
1 528 . 2 1 1 A 66 66 VAL C C 44 171.340 174.829 -3.489 1
1 529 . 2 1 1 A 66 66 VAL CA C 44 61.910 52.907 9.003 1
1 530 . 2 1 1 A 66 66 VAL CB C 44 33.630 40.048 -6.418 1
1 532 . 2 1 1 A 66 66 VAL N N 44 125.260 117.127 8.133 1
1 533 . 2 1 1 A 67 67 LEU H H 45 8.570 7.674 0.896 1
1 534 . 2 1 1 A 67 67 LEU HA H 45 5.220 4.687 0.533 1
1 544 . 2 1 1 A 67 67 LEU C C 45 172.500 174.637 -2.137 1
1 545 . 2 1 1 A 67 67 LEU CA C 45 52.820 60.251 -7.431 1
1 546 . 2 1 1 A 67 67 LEU CB C 45 45.310 63.605 -18.295 1
1 550 . 2 1 1 A 67 67 LEU N N 45 126.690 117.640 9.050 1
1 551 . 2 1 1 A 68 68 ILE H H 46 9.040 8.464 0.576 1
1 552 . 2 1 1 A 68 68 ILE HA H 46 4.880 4.949 -0.069 1
1 562 . 2 1 1 A 68 68 ILE C C 46 172.390 176.102 -3.712 1
1 563 . 2 1 1 A 68 68 ILE CA C 46 59.900 57.238 2.662 1
1 564 . 2 1 1 A 68 68 ILE CB C 46 41.940 65.560 -23.620 1
1 568 . 2 1 1 A 68 68 ILE N N 46 122.590 119.570 3.020 1
1 569 . 2 1 1 A 69 69 PHE H H 47 8.740 8.612 0.128 1
1 570 . 2 1 1 A 69 69 PHE N N 47 125.360 121.597 3.763 1
1 571 . 2 1 1 A 70 70 ALA HA H 48 3.600 4.022 -0.422 1
1 575 . 2 1 1 A 70 70 ALA C C 48 174.500 177.860 -3.360 1
1 576 . 2 1 1 A 70 70 ALA CA C 48 52.520 58.804 -6.284 1
1 577 . 2 1 1 A 70 70 ALA CB C 48 16.760 28.489 -11.729 1
1 578 . 2 1 1 A 71 71 GLY H H 49 8.210 7.490 0.720 1
1 581 . 2 1 1 A 71 71 GLY C C 49 170.850 177.913 -7.063 1
1 582 . 2 1 1 A 71 71 GLY CA C 49 45.380 57.418 -12.038 1
1 583 . 2 1 1 A 71 71 GLY N N 49 102.430 117.737 -15.307 1
1 584 . 2 1 1 A 72 72 LYS H H 50 7.840 8.230 -0.390 1
1 585 . 2 1 1 A 72 72 LYS HA H 50 4.530 4.043 0.487 1
1 594 . 2 1 1 A 72 72 LYS C C 50 171.800 177.791 -5.991 1
1 595 . 2 1 1 A 72 72 LYS CA C 50 54.630 61.150 -6.520 1
1 596 . 2 1 1 A 72 72 LYS CB C 50 34.630 38.985 -4.355 1
1 600 . 2 1 1 A 72 72 LYS N N 50 121.570 122.947 -1.377 1
1 601 . 2 1 1 A 73 73 ILE H H 51 8.250 8.304 -0.054 1
1 602 . 2 1 1 A 73 73 ILE HA H 51 4.260 3.988 0.272 1
1 612 . 2 1 1 A 73 73 ILE C C 51 174.300 178.198 -3.898 1
1 613 . 2 1 1 A 73 73 ILE CA C 51 61.270 58.345 2.925 1
1 614 . 2 1 1 A 73 73 ILE CB C 51 38.150 31.280 6.870 1
1 618 . 2 1 1 A 73 73 ILE N N 51 122.710 117.993 4.717 1
1 619 . 2 1 1 A 74 74 LEU H H 52 8.540 8.108 0.432 1
1 620 . 2 1 1 A 74 74 LEU HA H 52 3.980 4.025 -0.045 1
1 630 . 2 1 1 A 74 74 LEU C C 52 173.440 178.971 -5.531 1
1 631 . 2 1 1 A 74 74 LEU CA C 52 54.660 59.124 -4.464 1
1 632 . 2 1 1 A 74 74 LEU CB C 52 41.790 29.233 12.557 1
1 636 . 2 1 1 A 74 74 LEU N N 52 128.360 119.318 9.042 1
1 637 . 2 1 1 A 75 75 LYS H H 53 8.100 7.587 0.513 1
1 638 . 2 1 1 A 75 75 LYS HA H 53 4.440 4.103 0.337 1
1 645 . 2 1 1 A 75 75 LYS C C 53 175.170 179.720 -4.550 1
1 646 . 2 1 1 A 75 75 LYS CA C 53 55.340 59.098 -3.758 1
1 647 . 2 1 1 A 75 75 LYS CB C 53 32.680 29.536 3.144 1
1 650 . 2 1 1 A 75 75 LYS N N 53 123.470 120.556 2.914 1
1 651 . 2 1 1 A 76 76 ASP H H 54 8.310 7.705 0.605 1
1 652 . 2 1 1 A 76 76 ASP HA H 54 4.110 4.146 -0.036 1
1 655 . 2 1 1 A 76 76 ASP C C 54 174.270 178.256 -3.986 1
1 656 . 2 1 1 A 76 76 ASP CA C 54 58.140 65.399 -7.259 1
1 657 . 2 1 1 A 76 76 ASP CB C 54 40.760 37.631 3.129 1
1 658 . 2 1 1 A 76 76 ASP N N 54 121.080 121.372 -0.292 1
1 659 . 2 1 1 A 77 77 GLN H H 55 8.180 7.966 0.214 1
1 660 . 2 1 1 A 77 77 GLN HA H 55 4.360 4.459 -0.099 1
1 667 . 2 1 1 A 77 77 GLN C C 55 173.710 176.447 -2.737 1
1 668 . 2 1 1 A 77 77 GLN CA C 55 56.350 61.357 -5.007 1
1 669 . 2 1 1 A 77 77 GLN CB C 55 28.090 62.936 -34.846 1
1 671 . 2 1 1 A 77 77 GLN N N 55 113.190 116.435 -3.245 1
1 673 . 2 1 1 A 78 78 ASP H H 56 7.770 7.665 0.105 1
1 674 . 2 1 1 A 78 78 ASP HA H 56 4.700 4.140 0.560 1
1 677 . 2 1 1 A 78 78 ASP C C 56 173.500 178.599 -5.099 1
1 678 . 2 1 1 A 78 78 ASP CA C 56 54.140 58.267 -4.127 1
1 679 . 2 1 1 A 78 78 ASP CB C 56 42.020 32.125 9.895 1
1 680 . 2 1 1 A 78 78 ASP N N 56 121.910 119.197 2.713 1
1 681 . 2 1 1 A 79 79 THR H H 57 8.490 7.873 0.617 1
1 682 . 2 1 1 A 79 79 THR HA H 57 4.700 4.148 0.552 1
1 687 . 2 1 1 A 79 79 THR C C 57 172.840 177.963 -5.123 1
1 688 . 2 1 1 A 79 79 THR CA C 57 59.980 58.579 1.401 1
1 689 . 2 1 1 A 79 79 THR CB C 57 70.640 30.831 39.809 1
1 691 . 2 1 1 A 79 79 THR N N 57 108.860 118.398 -9.538 1
1 692 . 2 1 1 A 80 80 LEU H H 58 7.700 8.205 -0.505 1
1 693 . 2 1 1 A 80 80 LEU HA H 58 3.880 4.616 -0.736 1
1 703 . 2 1 1 A 80 80 LEU C C 58 177.370 174.796 2.574 1
1 704 . 2 1 1 A 80 80 LEU CA C 58 58.450 57.597 0.853 1
1 705 . 2 1 1 A 80 80 LEU CB C 58 39.500 38.964 0.536 1
1 709 . 2 1 1 A 80 80 LEU N N 58 118.820 117.153 1.667 1
1 710 . 2 1 1 A 81 81 SER H H 59 8.810 7.545 1.265 1
1 711 . 2 1 1 A 81 81 SER HA H 59 4.050 3.979 0.071 1
1 714 . 2 1 1 A 81 81 SER C C 59 176.150 174.506 1.644 1
1 715 . 2 1 1 A 81 81 SER CA C 59 61.190 57.334 3.856 1
1 716 . 2 1 1 A 81 81 SER CB C 59 62.490 29.242 33.248 1
1 717 . 2 1 1 A 81 81 SER N N 59 114.240 116.577 -2.337 1
1 718 . 2 1 1 A 82 82 GLN H H 60 7.950 7.910 0.040 1
1 719 . 2 1 1 A 82 82 GLN HA H 60 4.090 4.985 -0.895 1
1 726 . 2 1 1 A 82 82 GLN C C 60 173.930 173.369 0.561 1
1 727 . 2 1 1 A 82 82 GLN CA C 60 58.080 57.346 0.734 1
1 728 . 2 1 1 A 82 82 GLN CB C 60 28.460 65.357 -36.897 1
1 730 . 2 1 1 A 82 82 GLN N N 60 122.620 114.270 8.350 1
1 732 . 2 1 1 A 83 83 HIS H H 61 6.990 8.816 -1.826 1
1 733 . 2 1 1 A 83 83 HIS HA H 61 4.490 4.553 -0.063 1
1 736 . 2 1 1 A 83 83 HIS C C 61 172.260 176.557 -4.297 1
1 737 . 2 1 1 A 83 83 HIS CA C 61 57.110 56.984 0.126 1
1 738 . 2 1 1 A 83 83 HIS CB C 61 32.780 30.804 1.976 1
1 739 . 2 1 1 A 83 83 HIS N N 61 116.940 125.119 -8.179 1
1 740 . 2 1 1 A 84 84 GLY H H 62 7.870 8.474 -0.604 1
1 743 . 2 1 1 A 84 84 GLY C C 62 171.040 175.818 -4.778 1
1 744 . 2 1 1 A 84 84 GLY CA C 62 45.390 65.752 -20.362 1
1 745 . 2 1 1 A 84 84 GLY N N 62 106.740 121.072 -14.332 1
1 746 . 2 1 1 A 85 85 ILE H H 63 6.810 8.044 -1.234 1
1 747 . 2 1 1 A 85 85 ILE HA H 63 3.050 4.338 -1.288 1
1 757 . 2 1 1 A 85 85 ILE C C 63 170.130 178.073 -7.943 1
1 758 . 2 1 1 A 85 85 ILE CA C 63 62.440 57.586 4.854 1
1 759 . 2 1 1 A 85 85 ILE CB C 63 36.110 40.141 -4.031 1
1 763 . 2 1 1 A 85 85 ILE N N 63 118.920 122.573 -3.653 1
1 764 . 2 1 1 A 86 86 HIS H H 64 6.020 7.367 -1.347 1
1 765 . 2 1 1 A 86 86 HIS HA H 64 5.030 4.427 0.603 1
1 768 . 2 1 1 A 86 86 HIS C C 64 170.090 175.379 -5.289 1
1 769 . 2 1 1 A 86 86 HIS CA C 64 53.500 55.710 -2.210 1
1 770 . 2 1 1 A 86 86 HIS CB C 64 31.860 29.594 2.266 1
1 771 . 2 1 1 A 86 86 HIS N N 64 122.440 116.292 6.148 1
1 772 . 2 1 1 A 87 87 ASP H H 65 8.340 7.211 1.129 1
1 773 . 2 1 1 A 87 87 ASP HA H 65 4.320 4.380 -0.060 1
1 776 . 2 1 1 A 87 87 ASP C C 65 174.370 175.376 -1.006 1
1 777 . 2 1 1 A 87 87 ASP CA C 65 56.440 54.010 2.430 1
1 778 . 2 1 1 A 87 87 ASP CB C 65 43.150 40.779 2.371 1
1 779 . 2 1 1 A 87 87 ASP N N 65 116.230 121.576 -5.346 1
1 780 . 2 1 1 A 88 88 GLY H H 66 9.330 8.403 0.927 1
1 783 . 2 1 1 A 88 88 GLY C C 66 172.330 175.223 -2.893 1
1 784 . 2 1 1 A 88 88 GLY CA C 66 45.270 60.662 -15.392 1
1 785 . 2 1 1 A 88 88 GLY N N 66 112.300 120.680 -8.380 1
1 786 . 2 1 1 A 89 89 LEU H H 67 7.640 8.949 -1.309 1
1 787 . 2 1 1 A 89 89 LEU HA H 67 4.720 4.617 0.103 1
1 797 . 2 1 1 A 89 89 LEU C C 67 172.460 176.158 -3.698 1
1 798 . 2 1 1 A 89 89 LEU CA C 67 54.420 54.314 0.106 1
1 799 . 2 1 1 A 89 89 LEU CB C 67 42.260 42.314 -0.054 1
1 803 . 2 1 1 A 89 89 LEU N N 67 120.310 127.718 -7.408 1
1 804 . 2 1 1 A 90 90 THR H H 68 8.110 8.826 -0.716 1
1 805 . 2 1 1 A 90 90 THR HA H 68 5.300 5.273 0.027 1
1 810 . 2 1 1 A 90 90 THR C C 68 170.900 175.004 -4.104 1
1 811 . 2 1 1 A 90 90 THR CA C 68 61.870 59.979 1.891 1
1 812 . 2 1 1 A 90 90 THR CB C 68 71.320 40.243 31.077 1
1 814 . 2 1 1 A 90 90 THR N N 68 115.300 122.318 -7.018 1
1 815 . 2 1 1 A 91 91 VAL H H 69 9.290 8.927 0.363 1
1 816 . 2 1 1 A 91 91 VAL HA H 69 4.540 4.710 -0.170 1
1 824 . 2 1 1 A 91 91 VAL C C 69 170.890 174.537 -3.647 1
1 825 . 2 1 1 A 91 91 VAL CA C 69 60.310 57.996 2.314 1
1 826 . 2 1 1 A 91 91 VAL CB C 69 34.680 42.274 -7.594 1
1 829 . 2 1 1 A 91 91 VAL N N 69 124.200 126.667 -2.467 1
1 830 . 2 1 1 A 92 92 HIS H H 70 8.750 8.711 0.039 1
1 831 . 2 1 1 A 92 92 HIS HA H 70 5.020 3.999 1.021 1
1 835 . 2 1 1 A 92 92 HIS C C 70 170.890 177.175 -6.285 1
1 836 . 2 1 1 A 92 92 HIS CA C 70 56.750 53.300 3.450 1
1 837 . 2 1 1 A 92 92 HIS CB C 70 32.220 17.996 14.224 1
1 839 . 2 1 1 A 92 92 HIS N N 70 125.250 129.235 -3.985 1
1 840 . 2 1 1 A 93 93 LEU H H 71 8.290 8.509 -0.219 1
1 851 . 2 1 1 A 93 93 LEU C C 71 172.570 173.517 -0.947 1
1 852 . 2 1 1 A 93 93 LEU CA C 71 52.820 45.428 7.392 1
1 857 . 2 1 1 A 93 93 LEU N N 71 123.360 102.786 20.574 1
1 858 . 2 1 1 A 94 94 VAL H H 72 9.110 7.261 1.849 1
1 859 . 2 1 1 A 94 94 VAL HA H 72 4.080 4.882 -0.802 1
1 864 . 2 1 1 A 94 94 VAL C C 72 171.160 175.211 -4.051 1
1 865 . 2 1 1 A 94 94 VAL CA C 72 61.350 54.128 7.222 1
1 866 . 2 1 1 A 94 94 VAL CB C 72 34.640 36.015 -1.375 1
1 868 . 2 1 1 A 94 94 VAL N N 72 128.650 115.144 13.506 1
1 869 . 2 1 1 A 95 95 ILE H H 73 8.150 8.257 -0.107 1
1 870 . 2 1 1 A 95 95 ILE HA H 73 4.500 4.551 -0.051 1
1 880 . 2 1 1 A 95 95 ILE C C 73 174.320 175.786 -1.466 1
1 881 . 2 1 1 A 95 95 ILE CA C 73 60.170 60.975 -0.805 1
1 882 . 2 1 1 A 95 95 ILE CB C 73 38.120 38.155 -0.035 1
1 886 . 2 1 1 A 95 95 ILE N N 73 125.560 118.780 6.780 1
1 887 . 2 1 1 A 96 96 LYS H H 74 9.280 8.766 0.514 1
1 888 . 2 1 1 A 96 96 LYS HA H 74 4.240 4.137 0.103 1
1 891 . 2 1 1 A 96 96 LYS C C 74 173.510 176.683 -3.173 1
1 892 . 2 1 1 A 96 96 LYS CA C 74 56.730 55.188 1.542 1
1 893 . 2 1 1 A 96 96 LYS CB C 74 33.100 41.364 -8.264 1
1 894 . 2 1 1 A 96 96 LYS N N 74 129.290 128.243 1.047 1
1 895 . 2 1 1 A 97 97 THR H H 75 8.040 8.819 -0.779 1
1 896 . 2 1 1 A 97 97 THR HA H 75 4.230 4.597 -0.367 1
1 901 . 2 1 1 A 97 97 THR C C 75 171.800 177.546 -5.746 1
1 902 . 2 1 1 A 97 97 THR CA C 75 61.760 54.800 6.960 1
1 903 . 2 1 1 A 97 97 THR CB C 75 69.830 34.365 35.465 1
1 905 . 2 1 1 A 97 97 THR N N 75 114.420 124.316 -9.896 1
1 906 . 2 1 1 A 98 98 GLN H H 76 8.400 8.982 -0.582 1
1 907 . 2 1 1 A 98 98 GLN HA H 76 4.210 4.383 -0.173 1
1 914 . 2 1 1 A 98 98 GLN CA C 76 55.880 56.772 -0.892 1
1 915 . 2 1 1 A 98 98 GLN CB C 76 29.700 39.905 -10.205 1
1 917 . 2 1 1 A 98 98 GLN N N 76 122.370 121.276 1.094 1
1 919 . 2 1 1 A 99 99 ASN HA H 77 4.590 4.293 0.297 1
1 924 . 2 1 1 A 99 99 ASN C C 77 171.780 175.344 -3.564 1
1 925 . 2 1 1 A 99 99 ASN CA C 77 53.300 56.484 -3.184 1
1 926 . 2 1 1 A 99 99 ASN CB C 77 38.920 28.127 10.793 1
1 928 . 2 1 1 A 100 100 ARG H H 78 8.160 7.744 0.416 1
1 929 . 2 1 1 A 100 100 ARG HA H 78 4.560 5.204 -0.644 1
1 936 . 2 1 1 A 100 100 ARG CA C 78 53.860 52.644 1.216 1
1 937 . 2 1 1 A 100 100 ARG CB C 78 30.210 43.234 -13.024 1
1 940 . 2 1 1 A 100 100 ARG N N 78 122.840 120.767 2.073 1
1 941 . 2 1 1 A 101 101 PRO HA H 79 4.150 4.944 -0.794 1
1 948 . 2 1 1 A 101 101 PRO CA C 79 64.770 59.245 5.525 1
1 949 . 2 1 1 A 101 101 PRO CB C 79 32.040 71.465 -39.425 1
1 289 . 3 1 1 A 46 46 SER H H 24 8.950 8.439 0.511 1
1 290 . 3 1 1 A 46 46 SER HA H 24 4.900 4.465 0.435 1
1 293 . 3 1 1 A 46 46 SER C C 24 170.890 176.248 -5.358 1
1 294 . 3 1 1 A 46 46 SER CA C 24 56.980 55.779 1.201 1
1 295 . 3 1 1 A 46 46 SER CB C 24 65.590 33.488 32.102 1
1 296 . 3 1 1 A 46 46 SER N N 24 120.420 122.483 -2.063 1
1 297 . 3 1 1 A 47 47 VAL H H 25 9.140 8.229 0.911 1
1 298 . 3 1 1 A 47 47 VAL HA H 25 3.440 4.305 -0.865 1
1 306 . 3 1 1 A 47 47 VAL C C 25 175.060 175.512 -0.452 1
1 307 . 3 1 1 A 47 47 VAL CA C 25 67.250 61.292 5.958 1
1 308 . 3 1 1 A 47 47 VAL CB C 25 30.780 39.282 -8.502 1
1 311 . 3 1 1 A 47 47 VAL N N 25 123.970 126.107 -2.137 1
1 312 . 3 1 1 A 48 48 GLN H H 26 8.540 8.451 0.089 1
1 313 . 3 1 1 A 48 48 GLN HA H 26 4.070 4.807 -0.737 1
1 320 . 3 1 1 A 48 48 GLN CA C 26 60.230 55.159 5.071 1
1 321 . 3 1 1 A 48 48 GLN CB C 26 28.490 33.503 -5.013 1
1 323 . 3 1 1 A 48 48 GLN N N 26 120.550 128.135 -7.585 1
1 325 . 3 1 1 A 49 49 GLN HA H 27 3.950 4.729 -0.779 1
1 332 . 3 1 1 A 49 49 GLN C C 27 176.230 175.437 0.793 1
1 333 . 3 1 1 A 49 49 GLN CA C 27 58.710 55.879 2.831 1
1 334 . 3 1 1 A 49 49 GLN CB C 27 28.820 32.671 -3.851 1
1 337 . 3 1 1 A 50 50 PHE H H 28 8.050 8.981 -0.931 1
1 338 . 3 1 1 A 50 50 PHE HA H 28 4.620 4.720 -0.100 1
1 345 . 3 1 1 A 50 50 PHE C C 28 175.190 175.181 0.009 1
1 346 . 3 1 1 A 50 50 PHE CA C 28 58.030 61.467 -3.437 1
1 347 . 3 1 1 A 50 50 PHE CB C 28 39.190 32.637 6.553 1
1 350 . 3 1 1 A 50 50 PHE N N 28 121.710 125.818 -4.108 1
1 351 . 3 1 1 A 51 51 LYS H H 29 8.940 8.350 0.590 1
1 352 . 3 1 1 A 51 51 LYS HA H 29 3.340 5.003 -1.663 1
1 361 . 3 1 1 A 51 51 LYS C C 29 175.370 174.503 0.867 1
1 362 . 3 1 1 A 51 51 LYS CA C 29 60.660 62.649 -1.989 1
1 363 . 3 1 1 A 51 51 LYS CB C 29 33.190 70.006 -36.816 1
1 367 . 3 1 1 A 51 51 LYS N N 29 117.530 123.175 -5.645 1
1 368 . 3 1 1 A 52 52 GLU H H 30 7.700 9.376 -1.676 1
1 369 . 3 1 1 A 52 52 GLU HA H 30 3.750 4.843 -1.093 1
1 374 . 3 1 1 A 52 52 GLU C C 30 176.780 174.076 2.704 1
1 375 . 3 1 1 A 52 52 GLU CA C 30 59.890 61.392 -1.502 1
1 376 . 3 1 1 A 52 52 GLU CB C 30 28.840 34.886 -6.046 1
1 378 . 3 1 1 A 52 52 GLU N N 30 118.820 127.165 -8.345 1
1 379 . 3 1 1 A 53 53 GLU H H 31 7.370 9.176 -1.806 1
1 380 . 3 1 1 A 53 53 GLU HA H 31 4.150 5.026 -0.876 1
1 385 . 3 1 1 A 53 53 GLU C C 31 177.040 176.054 0.986 1
1 386 . 3 1 1 A 53 53 GLU CA C 31 58.860 54.971 3.889 1
1 387 . 3 1 1 A 53 53 GLU CB C 31 29.200 34.386 -5.186 1
1 389 . 3 1 1 A 53 53 GLU N N 31 119.150 129.240 -10.090 1
1 390 . 3 1 1 A 54 54 ILE H H 32 8.000 8.588 -0.588 1
1 391 . 3 1 1 A 54 54 ILE HA H 32 3.550 5.240 -1.690 1
1 401 . 3 1 1 A 54 54 ILE C C 32 175.420 174.018 1.402 1
1 402 . 3 1 1 A 54 54 ILE CA C 32 64.690 58.713 5.977 1
1 403 . 3 1 1 A 54 54 ILE CB C 32 37.820 70.046 -32.226 1
1 407 . 3 1 1 A 54 54 ILE N N 32 119.970 117.453 2.517 1
1 409 . 3 1 1 A 55 55 SER HA H 33 3.930 4.479 -0.549 1
1 412 . 3 1 1 A 55 55 SER C C 33 173.830 178.390 -4.560 1
1 413 . 3 1 1 A 55 55 SER CA C 33 61.620 64.503 -2.883 1
1 414 . 3 1 1 A 55 55 SER CB C 33 62.720 31.717 31.003 1
1 415 . 3 1 1 A 55 55 SER N N 33 115.780 136.387 -20.607 1
1 416 . 3 1 1 A 56 56 LYS H H 34 7.150 8.380 -1.230 1
1 417 . 3 1 1 A 56 56 LYS HA H 34 4.090 4.244 -0.154 1
1 424 . 3 1 1 A 56 56 LYS C C 34 176.080 176.973 -0.893 1
1 425 . 3 1 1 A 56 56 LYS CA C 34 58.950 58.450 0.500 1
1 426 . 3 1 1 A 56 56 LYS CB C 34 32.540 33.307 -0.767 1
1 429 . 3 1 1 A 56 56 LYS N N 34 119.100 117.363 1.737 1
1 430 . 3 1 1 A 57 57 ARG H H 35 7.530 7.767 -0.237 1
1 431 . 3 1 1 A 57 57 ARG HA H 35 4.110 4.747 -0.637 1
1 436 . 3 1 1 A 57 57 ARG C C 35 174.800 174.642 0.158 1
1 437 . 3 1 1 A 57 57 ARG CA C 35 57.090 55.455 1.635 1
1 438 . 3 1 1 A 57 57 ARG CB C 35 29.810 31.514 -1.704 1
1 440 . 3 1 1 A 57 57 ARG N N 35 119.370 113.187 6.183 1
1 441 . 3 1 1 A 58 58 PHE H H 36 8.320 8.587 -0.267 1
1 442 . 3 1 1 A 58 58 PHE HA H 36 4.340 5.294 -0.954 1
1 449 . 3 1 1 A 58 58 PHE C C 36 171.940 174.985 -3.045 1
1 450 . 3 1 1 A 58 58 PHE CA C 36 58.500 55.066 3.434 1
1 451 . 3 1 1 A 58 58 PHE CB C 36 38.130 34.582 3.548 1
1 454 . 3 1 1 A 58 58 PHE N N 36 113.980 119.231 -5.251 1
1 455 . 3 1 1 A 59 59 LYS H H 37 7.790 8.746 -0.956 1
1 456 . 3 1 1 A 59 59 LYS HA H 37 3.960 4.735 -0.775 1
1 463 . 3 1 1 A 59 59 LYS C C 37 172.670 173.609 -0.939 1
1 464 . 3 1 1 A 59 59 LYS CA C 37 57.140 55.169 1.971 1
1 465 . 3 1 1 A 59 59 LYS CB C 37 29.020 33.937 -4.917 1
1 468 . 3 1 1 A 59 59 LYS N N 37 118.810 119.254 -0.444 1
1 469 . 3 1 1 A 60 60 SER H H 38 7.750 8.684 -0.934 1
1 470 . 3 1 1 A 60 60 SER HA H 38 4.700 4.961 -0.261 1
1 473 . 3 1 1 A 60 60 SER C C 38 170.170 174.636 -4.466 1
1 474 . 3 1 1 A 60 60 SER CA C 38 57.130 55.238 1.892 1
1 475 . 3 1 1 A 60 60 SER CB C 38 66.820 32.068 34.752 1
1 476 . 3 1 1 A 60 60 SER N N 38 112.620 124.912 -12.292 1
1 477 . 3 1 1 A 61 61 HIS H H 39 8.630 9.428 -0.798 1
1 478 . 3 1 1 A 61 61 HIS N N 39 124.090 125.478 -1.388 1
1 479 . 3 1 1 A 62 62 THR HA H 40 3.610 4.775 -1.165 1
1 484 . 3 1 1 A 62 62 THR C C 40 174.350 177.261 -2.911 1
1 485 . 3 1 1 A 62 62 THR CA C 40 66.160 51.096 15.064 1
1 486 . 3 1 1 A 62 62 THR CB C 40 68.070 20.017 48.053 1
1 488 . 3 1 1 A 63 63 ASP H H 41 10.310 8.862 1.448 1
1 489 . 3 1 1 A 63 63 ASP HA H 41 4.420 4.946 -0.526 1
1 492 . 3 1 1 A 63 63 ASP C C 41 174.630 174.730 -0.100 1
1 493 . 3 1 1 A 63 63 ASP CA C 41 56.330 58.111 -1.781 1
1 494 . 3 1 1 A 63 63 ASP CB C 41 40.040 34.525 5.515 1
1 495 . 3 1 1 A 63 63 ASP N N 41 122.900 118.327 4.573 1
1 497 . 3 1 1 A 64 64 GLN HA H 42 4.270 4.582 -0.312 1
1 504 . 3 1 1 A 64 64 GLN C C 42 172.160 177.712 -5.552 1
1 505 . 3 1 1 A 64 64 GLN CA C 42 55.860 62.986 -7.126 1
1 506 . 3 1 1 A 64 64 GLN CB C 42 30.480 30.613 -0.133 1
1 508 . 3 1 1 A 64 64 GLN N N 42 115.750 137.901 -22.151 1
1 510 . 3 1 1 A 65 65 LEU H H 43 7.250 8.195 -0.945 1
1 511 . 3 1 1 A 65 65 LEU HA H 43 4.440 3.998 0.442 1
1 517 . 3 1 1 A 65 65 LEU C C 43 173.160 176.363 -3.203 1
1 518 . 3 1 1 A 65 65 LEU CA C 43 54.620 57.298 -2.678 1
1 519 . 3 1 1 A 65 65 LEU CB C 43 41.990 27.396 14.594 1
1 521 . 3 1 1 A 65 65 LEU N N 43 116.570 118.066 -1.496 1
1 522 . 3 1 1 A 66 66 VAL H H 44 8.690 7.985 0.705 1
1 523 . 3 1 1 A 66 66 VAL HA H 44 3.980 4.963 -0.983 1
1 528 . 3 1 1 A 66 66 VAL C C 44 171.340 175.519 -4.179 1
1 529 . 3 1 1 A 66 66 VAL CA C 44 61.910 54.449 7.461 1
1 530 . 3 1 1 A 66 66 VAL CB C 44 33.630 39.753 -6.123 1
1 532 . 3 1 1 A 66 66 VAL N N 44 125.260 118.562 6.698 1
1 533 . 3 1 1 A 67 67 LEU H H 45 8.570 7.928 0.642 1
1 534 . 3 1 1 A 67 67 LEU HA H 45 5.220 4.436 0.784 1
1 544 . 3 1 1 A 67 67 LEU C C 45 172.500 174.035 -1.535 1
1 545 . 3 1 1 A 67 67 LEU CA C 45 52.820 59.927 -7.107 1
1 546 . 3 1 1 A 67 67 LEU CB C 45 45.310 63.233 -17.923 1
1 550 . 3 1 1 A 67 67 LEU N N 45 126.690 116.124 10.566 1
1 551 . 3 1 1 A 68 68 ILE H H 46 9.040 8.382 0.658 1
1 552 . 3 1 1 A 68 68 ILE HA H 46 4.880 4.676 0.204 1
1 562 . 3 1 1 A 68 68 ILE C C 46 172.390 176.208 -3.818 1
1 563 . 3 1 1 A 68 68 ILE CA C 46 59.900 57.678 2.222 1
1 564 . 3 1 1 A 68 68 ILE CB C 46 41.940 65.238 -23.298 1
1 568 . 3 1 1 A 68 68 ILE N N 46 122.590 121.056 1.534 1
1 569 . 3 1 1 A 69 69 PHE H H 47 8.740 8.559 0.181 1
1 570 . 3 1 1 A 69 69 PHE N N 47 125.360 121.849 3.511 1
1 571 . 3 1 1 A 70 70 ALA HA H 48 3.600 3.999 -0.399 1
1 575 . 3 1 1 A 70 70 ALA C C 48 174.500 178.181 -3.681 1
1 576 . 3 1 1 A 70 70 ALA CA C 48 52.520 59.272 -6.752 1
1 577 . 3 1 1 A 70 70 ALA CB C 48 16.760 28.070 -11.310 1
1 578 . 3 1 1 A 71 71 GLY H H 49 8.210 7.732 0.478 1
1 581 . 3 1 1 A 71 71 GLY C C 49 170.850 178.187 -7.337 1
1 582 . 3 1 1 A 71 71 GLY CA C 49 45.380 58.019 -12.639 1
1 583 . 3 1 1 A 71 71 GLY N N 49 102.430 118.794 -16.364 1
1 584 . 3 1 1 A 72 72 LYS H H 50 7.840 8.220 -0.380 1
1 585 . 3 1 1 A 72 72 LYS HA H 50 4.530 4.113 0.417 1
1 594 . 3 1 1 A 72 72 LYS C C 50 171.800 177.806 -6.006 1
1 595 . 3 1 1 A 72 72 LYS CA C 50 54.630 61.100 -6.470 1
1 596 . 3 1 1 A 72 72 LYS CB C 50 34.630 39.152 -4.522 1
1 600 . 3 1 1 A 72 72 LYS N N 50 121.570 120.754 0.816 1
1 601 . 3 1 1 A 73 73 ILE H H 51 8.250 8.244 0.006 1
1 602 . 3 1 1 A 73 73 ILE HA H 51 4.260 3.947 0.313 1
1 612 . 3 1 1 A 73 73 ILE C C 51 174.300 178.680 -4.380 1
1 613 . 3 1 1 A 73 73 ILE CA C 51 61.270 58.372 2.898 1
1 614 . 3 1 1 A 73 73 ILE CB C 51 38.150 31.251 6.899 1
1 618 . 3 1 1 A 73 73 ILE N N 51 122.710 118.018 4.692 1
1 619 . 3 1 1 A 74 74 LEU H H 52 8.540 8.395 0.145 1
1 620 . 3 1 1 A 74 74 LEU HA H 52 3.980 4.053 -0.073 1
1 630 . 3 1 1 A 74 74 LEU C C 52 173.440 179.353 -5.913 1
1 631 . 3 1 1 A 74 74 LEU CA C 52 54.660 59.495 -4.835 1
1 632 . 3 1 1 A 74 74 LEU CB C 52 41.790 29.307 12.483 1
1 636 . 3 1 1 A 74 74 LEU N N 52 128.360 119.038 9.322 1
1 637 . 3 1 1 A 75 75 LYS H H 53 8.100 7.971 0.129 1
1 638 . 3 1 1 A 75 75 LYS HA H 53 4.440 4.064 0.376 1
1 645 . 3 1 1 A 75 75 LYS C C 53 175.170 179.624 -4.454 1
1 646 . 3 1 1 A 75 75 LYS CA C 53 55.340 59.006 -3.666 1
1 647 . 3 1 1 A 75 75 LYS CB C 53 32.680 29.397 3.283 1
1 650 . 3 1 1 A 75 75 LYS N N 53 123.470 119.539 3.931 1
1 651 . 3 1 1 A 76 76 ASP H H 54 8.310 7.322 0.988 1
1 652 . 3 1 1 A 76 76 ASP HA H 54 4.110 3.903 0.207 1
1 655 . 3 1 1 A 76 76 ASP C C 54 174.270 178.257 -3.987 1
1 656 . 3 1 1 A 76 76 ASP CA C 54 58.140 64.773 -6.633 1
1 657 . 3 1 1 A 76 76 ASP CB C 54 40.760 37.408 3.352 1
1 658 . 3 1 1 A 76 76 ASP N N 54 121.080 121.343 -0.263 1
1 659 . 3 1 1 A 77 77 GLN H H 55 8.180 7.866 0.314 1
1 660 . 3 1 1 A 77 77 GLN HA H 55 4.360 4.403 -0.043 1
1 667 . 3 1 1 A 77 77 GLN C C 55 173.710 176.619 -2.909 1
1 668 . 3 1 1 A 77 77 GLN CA C 55 56.350 61.527 -5.177 1
1 669 . 3 1 1 A 77 77 GLN CB C 55 28.090 62.889 -34.799 1
1 671 . 3 1 1 A 77 77 GLN N N 55 113.190 116.205 -3.015 1
1 673 . 3 1 1 A 78 78 ASP H H 56 7.770 7.778 -0.008 1
1 674 . 3 1 1 A 78 78 ASP HA H 56 4.700 4.099 0.601 1
1 677 . 3 1 1 A 78 78 ASP C C 56 173.500 178.762 -5.262 1
1 678 . 3 1 1 A 78 78 ASP CA C 56 54.140 58.583 -4.443 1
1 679 . 3 1 1 A 78 78 ASP CB C 56 42.020 31.469 10.551 1
1 680 . 3 1 1 A 78 78 ASP N N 56 121.910 119.332 2.578 1
1 681 . 3 1 1 A 79 79 THR H H 57 8.490 7.913 0.577 1
1 682 . 3 1 1 A 79 79 THR HA H 57 4.700 4.038 0.662 1
1 687 . 3 1 1 A 79 79 THR C C 57 172.840 178.415 -5.575 1
1 688 . 3 1 1 A 79 79 THR CA C 57 59.980 58.986 0.994 1
1 689 . 3 1 1 A 79 79 THR CB C 57 70.640 30.461 40.179 1
1 691 . 3 1 1 A 79 79 THR N N 57 108.860 119.920 -11.060 1
1 692 . 3 1 1 A 80 80 LEU H H 58 7.700 8.060 -0.360 1
1 693 . 3 1 1 A 80 80 LEU HA H 58 3.880 4.608 -0.728 1
1 703 . 3 1 1 A 80 80 LEU C C 58 177.370 174.786 2.584 1
1 704 . 3 1 1 A 80 80 LEU CA C 58 58.450 57.388 1.062 1
1 705 . 3 1 1 A 80 80 LEU CB C 58 39.500 38.964 0.536 1
1 709 . 3 1 1 A 80 80 LEU N N 58 118.820 116.678 2.142 1
1 710 . 3 1 1 A 81 81 SER H H 59 8.810 7.512 1.298 1
1 711 . 3 1 1 A 81 81 SER HA H 59 4.050 3.777 0.273 1
1 714 . 3 1 1 A 81 81 SER C C 59 176.150 174.355 1.795 1
1 715 . 3 1 1 A 81 81 SER CA C 59 61.190 57.248 3.942 1
1 716 . 3 1 1 A 81 81 SER CB C 59 62.490 28.898 33.592 1
1 717 . 3 1 1 A 81 81 SER N N 59 114.240 116.501 -2.261 1
1 718 . 3 1 1 A 82 82 GLN H H 60 7.950 7.408 0.542 1
1 719 . 3 1 1 A 82 82 GLN HA H 60 4.090 4.816 -0.726 1
1 726 . 3 1 1 A 82 82 GLN C C 60 173.930 173.050 0.880 1
1 727 . 3 1 1 A 82 82 GLN CA C 60 58.080 56.135 1.945 1
1 728 . 3 1 1 A 82 82 GLN CB C 60 28.460 65.837 -37.377 1
1 730 . 3 1 1 A 82 82 GLN N N 60 122.620 113.536 9.084 1
1 732 . 3 1 1 A 83 83 HIS H H 61 6.990 8.642 -1.652 1
1 733 . 3 1 1 A 83 83 HIS HA H 61 4.490 4.690 -0.200 1
1 736 . 3 1 1 A 83 83 HIS C C 61 172.260 177.155 -4.895 1
1 737 . 3 1 1 A 83 83 HIS CA C 61 57.110 56.722 0.388 1
1 738 . 3 1 1 A 83 83 HIS CB C 61 32.780 30.681 2.099 1
1 739 . 3 1 1 A 83 83 HIS N N 61 116.940 123.430 -6.490 1
1 740 . 3 1 1 A 84 84 GLY H H 62 7.870 9.063 -1.193 1
1 743 . 3 1 1 A 84 84 GLY C C 62 171.040 176.332 -5.292 1
1 744 . 3 1 1 A 84 84 GLY CA C 62 45.390 65.649 -20.259 1
1 745 . 3 1 1 A 84 84 GLY N N 62 106.740 117.035 -10.295 1
1 746 . 3 1 1 A 85 85 ILE H H 63 6.810 8.206 -1.396 1
1 747 . 3 1 1 A 85 85 ILE HA H 63 3.050 4.436 -1.386 1
1 757 . 3 1 1 A 85 85 ILE C C 63 170.130 177.215 -7.085 1
1 758 . 3 1 1 A 85 85 ILE CA C 63 62.440 56.496 5.944 1
1 759 . 3 1 1 A 85 85 ILE CB C 63 36.110 40.844 -4.734 1
1 763 . 3 1 1 A 85 85 ILE N N 63 118.920 121.590 -2.670 1
1 764 . 3 1 1 A 86 86 HIS H H 64 6.020 7.498 -1.478 1
1 765 . 3 1 1 A 86 86 HIS HA H 64 5.030 4.409 0.621 1
1 768 . 3 1 1 A 86 86 HIS C C 64 170.090 174.768 -4.678 1
1 769 . 3 1 1 A 86 86 HIS CA C 64 53.500 56.018 -2.518 1
1 770 . 3 1 1 A 86 86 HIS CB C 64 31.860 29.383 2.477 1
1 771 . 3 1 1 A 86 86 HIS N N 64 122.440 116.308 6.132 1
1 772 . 3 1 1 A 87 87 ASP H H 65 8.340 7.362 0.978 1
1 773 . 3 1 1 A 87 87 ASP HA H 65 4.320 4.649 -0.329 1
1 776 . 3 1 1 A 87 87 ASP C C 65 174.370 175.598 -1.228 1
1 777 . 3 1 1 A 87 87 ASP CA C 65 56.440 53.698 2.742 1
1 778 . 3 1 1 A 87 87 ASP CB C 65 43.150 43.264 -0.114 1
1 779 . 3 1 1 A 87 87 ASP N N 65 116.230 121.206 -4.976 1
1 780 . 3 1 1 A 88 88 GLY H H 66 9.330 8.659 0.671 1
1 783 . 3 1 1 A 88 88 GLY C C 66 172.330 174.351 -2.021 1
1 784 . 3 1 1 A 88 88 GLY CA C 66 45.270 60.172 -14.902 1
1 785 . 3 1 1 A 88 88 GLY N N 66 112.300 118.910 -6.610 1
1 786 . 3 1 1 A 89 89 LEU H H 67 7.640 9.110 -1.470 1
1 787 . 3 1 1 A 89 89 LEU HA H 67 4.720 4.748 -0.028 1
1 797 . 3 1 1 A 89 89 LEU C C 67 172.460 175.896 -3.436 1
1 798 . 3 1 1 A 89 89 LEU CA C 67 54.420 54.242 0.178 1
1 799 . 3 1 1 A 89 89 LEU CB C 67 42.260 42.451 -0.191 1
1 803 . 3 1 1 A 89 89 LEU N N 67 120.310 127.874 -7.564 1
1 804 . 3 1 1 A 90 90 THR H H 68 8.110 8.811 -0.701 1
1 805 . 3 1 1 A 90 90 THR HA H 68 5.300 5.187 0.113 1
1 810 . 3 1 1 A 90 90 THR C C 68 170.900 174.853 -3.953 1
1 811 . 3 1 1 A 90 90 THR CA C 68 61.870 60.236 1.634 1
1 812 . 3 1 1 A 90 90 THR CB C 68 71.320 41.679 29.641 1
1 814 . 3 1 1 A 90 90 THR N N 68 115.300 121.648 -6.348 1
1 815 . 3 1 1 A 91 91 VAL H H 69 9.290 9.022 0.268 1
1 816 . 3 1 1 A 91 91 VAL HA H 69 4.540 4.730 -0.190 1
1 824 . 3 1 1 A 91 91 VAL C C 69 170.890 174.578 -3.688 1
1 825 . 3 1 1 A 91 91 VAL CA C 69 60.310 57.881 2.429 1
1 826 . 3 1 1 A 91 91 VAL CB C 69 34.680 42.603 -7.923 1
1 829 . 3 1 1 A 91 91 VAL N N 69 124.200 126.841 -2.641 1
1 830 . 3 1 1 A 92 92 HIS H H 70 8.750 8.384 0.366 1
1 831 . 3 1 1 A 92 92 HIS HA H 70 5.020 3.814 1.206 1
1 835 . 3 1 1 A 92 92 HIS C C 70 170.890 177.133 -6.243 1
1 836 . 3 1 1 A 92 92 HIS CA C 70 56.750 53.160 3.590 1
1 837 . 3 1 1 A 92 92 HIS CB C 70 32.220 17.944 14.276 1
1 839 . 3 1 1 A 92 92 HIS N N 70 125.250 129.065 -3.815 1
1 840 . 3 1 1 A 93 93 LEU H H 71 8.290 8.502 -0.212 1
1 851 . 3 1 1 A 93 93 LEU C C 71 172.570 173.489 -0.919 1
1 852 . 3 1 1 A 93 93 LEU CA C 71 52.820 45.462 7.358 1
1 857 . 3 1 1 A 93 93 LEU N N 71 123.360 102.819 20.541 1
1 858 . 3 1 1 A 94 94 VAL H H 72 9.110 7.261 1.849 1
1 859 . 3 1 1 A 94 94 VAL HA H 72 4.080 4.880 -0.800 1
1 864 . 3 1 1 A 94 94 VAL C C 72 171.160 175.307 -4.147 1
1 865 . 3 1 1 A 94 94 VAL CA C 72 61.350 54.227 7.123 1
1 866 . 3 1 1 A 94 94 VAL CB C 72 34.640 35.879 -1.239 1
1 868 . 3 1 1 A 94 94 VAL N N 72 128.650 114.923 13.727 1
1 869 . 3 1 1 A 95 95 ILE H H 73 8.150 8.295 -0.145 1
1 870 . 3 1 1 A 95 95 ILE HA H 73 4.500 4.388 0.112 1
1 880 . 3 1 1 A 95 95 ILE C C 73 174.320 175.744 -1.424 1
1 881 . 3 1 1 A 95 95 ILE CA C 73 60.170 61.122 -0.952 1
1 882 . 3 1 1 A 95 95 ILE CB C 73 38.120 38.657 -0.537 1
1 886 . 3 1 1 A 95 95 ILE N N 73 125.560 118.934 6.626 1
1 887 . 3 1 1 A 96 96 LYS H H 74 9.280 8.744 0.536 1
1 888 . 3 1 1 A 96 96 LYS HA H 74 4.240 4.562 -0.322 1
1 891 . 3 1 1 A 96 96 LYS C C 74 173.510 176.373 -2.863 1
1 892 . 3 1 1 A 96 96 LYS CA C 74 56.730 54.184 2.546 1
1 893 . 3 1 1 A 96 96 LYS CB C 74 33.100 41.414 -8.314 1
1 894 . 3 1 1 A 96 96 LYS N N 74 129.290 127.015 2.275 1
1 895 . 3 1 1 A 97 97 THR H H 75 8.040 9.014 -0.974 1
1 896 . 3 1 1 A 97 97 THR HA H 75 4.230 4.560 -0.330 1
1 901 . 3 1 1 A 97 97 THR C C 75 171.800 177.688 -5.888 1
1 902 . 3 1 1 A 97 97 THR CA C 75 61.760 55.314 6.446 1
1 903 . 3 1 1 A 97 97 THR CB C 75 69.830 33.427 36.403 1
1 905 . 3 1 1 A 97 97 THR N N 75 114.420 125.272 -10.852 1
1 906 . 3 1 1 A 98 98 GLN H H 76 8.400 8.988 -0.588 1
1 907 . 3 1 1 A 98 98 GLN HA H 76 4.210 4.333 -0.123 1
1 914 . 3 1 1 A 98 98 GLN CA C 76 55.880 56.993 -1.113 1
1 915 . 3 1 1 A 98 98 GLN CB C 76 29.700 39.822 -10.122 1
1 917 . 3 1 1 A 98 98 GLN N N 76 122.370 121.534 0.836 1
1 919 . 3 1 1 A 99 99 ASN HA H 77 4.590 4.146 0.444 1
1 924 . 3 1 1 A 99 99 ASN C C 77 171.780 175.480 -3.700 1
1 925 . 3 1 1 A 99 99 ASN CA C 77 53.300 57.680 -4.380 1
1 926 . 3 1 1 A 99 99 ASN CB C 77 38.920 27.571 11.349 1
1 928 . 3 1 1 A 100 100 ARG H H 78 8.160 7.574 0.586 1
1 929 . 3 1 1 A 100 100 ARG HA H 78 4.560 4.862 -0.302 1
1 936 . 3 1 1 A 100 100 ARG CA C 78 53.860 53.735 0.125 1
1 937 . 3 1 1 A 100 100 ARG CB C 78 30.210 42.879 -12.669 1
1 940 . 3 1 1 A 100 100 ARG N N 78 122.840 121.424 1.416 1
1 941 . 3 1 1 A 101 101 PRO HA H 79 4.150 4.929 -0.779 1
1 948 . 3 1 1 A 101 101 PRO CA C 79 64.770 59.180 5.590 1
1 949 . 3 1 1 A 101 101 PRO CB C 79 32.040 71.582 -39.542 1
1 289 . 4 1 1 A 46 46 SER H H 24 8.950 8.474 0.476 1
1 290 . 4 1 1 A 46 46 SER HA H 24 4.900 4.481 0.419 1
1 293 . 4 1 1 A 46 46 SER C C 24 170.890 176.185 -5.295 1
1 294 . 4 1 1 A 46 46 SER CA C 24 56.980 55.979 1.001 1
1 295 . 4 1 1 A 46 46 SER CB C 24 65.590 33.412 32.178 1
1 296 . 4 1 1 A 46 46 SER N N 24 120.420 121.248 -0.828 1
1 297 . 4 1 1 A 47 47 VAL H H 25 9.140 8.258 0.882 1
1 298 . 4 1 1 A 47 47 VAL HA H 25 3.440 4.381 -0.941 1
1 306 . 4 1 1 A 47 47 VAL C C 25 175.060 175.564 -0.504 1
1 307 . 4 1 1 A 47 47 VAL CA C 25 67.250 60.963 6.287 1
1 308 . 4 1 1 A 47 47 VAL CB C 25 30.780 39.621 -8.841 1
1 311 . 4 1 1 A 47 47 VAL N N 25 123.970 125.906 -1.936 1
1 312 . 4 1 1 A 48 48 GLN H H 26 8.540 8.660 -0.120 1
1 313 . 4 1 1 A 48 48 GLN HA H 26 4.070 4.750 -0.680 1
1 320 . 4 1 1 A 48 48 GLN CA C 26 60.230 55.148 5.082 1
1 321 . 4 1 1 A 48 48 GLN CB C 26 28.490 33.126 -4.636 1
1 323 . 4 1 1 A 48 48 GLN N N 26 120.550 128.303 -7.753 1
1 325 . 4 1 1 A 49 49 GLN HA H 27 3.950 4.959 -1.009 1
1 332 . 4 1 1 A 49 49 GLN C C 27 176.230 175.495 0.735 1
1 333 . 4 1 1 A 49 49 GLN CA C 27 58.710 56.105 2.605 1
1 334 . 4 1 1 A 49 49 GLN CB C 27 28.820 33.127 -4.307 1
1 337 . 4 1 1 A 50 50 PHE H H 28 8.050 9.226 -1.176 1
1 338 . 4 1 1 A 50 50 PHE HA H 28 4.620 4.777 -0.157 1
1 345 . 4 1 1 A 50 50 PHE C C 28 175.190 175.058 0.132 1
1 346 . 4 1 1 A 50 50 PHE CA C 28 58.030 61.070 -3.040 1
1 347 . 4 1 1 A 50 50 PHE CB C 28 39.190 33.642 5.548 1
1 350 . 4 1 1 A 50 50 PHE N N 28 121.710 125.363 -3.653 1
1 351 . 4 1 1 A 51 51 LYS H H 29 8.940 8.590 0.350 1
1 352 . 4 1 1 A 51 51 LYS HA H 29 3.340 4.714 -1.374 1
1 361 . 4 1 1 A 51 51 LYS C C 29 175.370 174.455 0.915 1
1 362 . 4 1 1 A 51 51 LYS CA C 29 60.660 62.686 -2.026 1
1 363 . 4 1 1 A 51 51 LYS CB C 29 33.190 70.013 -36.823 1
1 367 . 4 1 1 A 51 51 LYS N N 29 117.530 122.286 -4.756 1
1 368 . 4 1 1 A 52 52 GLU H H 30 7.700 9.065 -1.365 1
1 369 . 4 1 1 A 52 52 GLU HA H 30 3.750 4.956 -1.206 1
1 374 . 4 1 1 A 52 52 GLU C C 30 176.780 174.361 2.419 1
1 375 . 4 1 1 A 52 52 GLU CA C 30 59.890 61.127 -1.237 1
1 376 . 4 1 1 A 52 52 GLU CB C 30 28.840 35.205 -6.365 1
1 378 . 4 1 1 A 52 52 GLU N N 30 118.820 126.338 -7.518 1
1 379 . 4 1 1 A 53 53 GLU H H 31 7.370 9.091 -1.721 1
1 380 . 4 1 1 A 53 53 GLU HA H 31 4.150 4.838 -0.688 1
1 385 . 4 1 1 A 53 53 GLU C C 31 177.040 176.011 1.029 1
1 386 . 4 1 1 A 53 53 GLU CA C 31 58.860 55.254 3.606 1
1 387 . 4 1 1 A 53 53 GLU CB C 31 29.200 33.621 -4.421 1
1 389 . 4 1 1 A 53 53 GLU N N 31 119.150 128.676 -9.526 1
1 390 . 4 1 1 A 54 54 ILE H H 32 8.000 8.204 -0.204 1
1 391 . 4 1 1 A 54 54 ILE HA H 32 3.550 4.748 -1.198 1
1 401 . 4 1 1 A 54 54 ILE C C 32 175.420 173.959 1.461 1
1 402 . 4 1 1 A 54 54 ILE CA C 32 64.690 58.410 6.280 1
1 403 . 4 1 1 A 54 54 ILE CB C 32 37.820 69.451 -31.631 1
1 407 . 4 1 1 A 54 54 ILE N N 32 119.970 117.782 2.188 1
1 409 . 4 1 1 A 55 55 SER HA H 33 3.930 4.370 -0.440 1
1 412 . 4 1 1 A 55 55 SER C C 33 173.830 178.239 -4.409 1
1 413 . 4 1 1 A 55 55 SER CA C 33 61.620 64.811 -3.191 1
1 414 . 4 1 1 A 55 55 SER CB C 33 62.720 31.853 30.867 1
1 415 . 4 1 1 A 55 55 SER N N 33 115.780 136.123 -20.343 1
1 416 . 4 1 1 A 56 56 LYS H H 34 7.150 8.533 -1.383 1
1 417 . 4 1 1 A 56 56 LYS HA H 34 4.090 4.206 -0.116 1
1 424 . 4 1 1 A 56 56 LYS C C 34 176.080 176.956 -0.876 1
1 425 . 4 1 1 A 56 56 LYS CA C 34 58.950 58.503 0.447 1
1 426 . 4 1 1 A 56 56 LYS CB C 34 32.540 33.225 -0.685 1
1 429 . 4 1 1 A 56 56 LYS N N 34 119.100 117.583 1.517 1
1 430 . 4 1 1 A 57 57 ARG H H 35 7.530 7.555 -0.025 1
1 431 . 4 1 1 A 57 57 ARG HA H 35 4.110 4.649 -0.539 1
1 436 . 4 1 1 A 57 57 ARG C C 35 174.800 174.002 0.798 1
1 437 . 4 1 1 A 57 57 ARG CA C 35 57.090 55.562 1.528 1
1 438 . 4 1 1 A 57 57 ARG CB C 35 29.810 30.232 -0.422 1
1 440 . 4 1 1 A 57 57 ARG N N 35 119.370 113.452 5.918 1
1 441 . 4 1 1 A 58 58 PHE H H 36 8.320 8.569 -0.249 1
1 442 . 4 1 1 A 58 58 PHE HA H 36 4.340 5.244 -0.904 1
1 449 . 4 1 1 A 58 58 PHE C C 36 171.940 174.980 -3.040 1
1 450 . 4 1 1 A 58 58 PHE CA C 36 58.500 55.463 3.037 1
1 451 . 4 1 1 A 58 58 PHE CB C 36 38.130 34.215 3.915 1
1 454 . 4 1 1 A 58 58 PHE N N 36 113.980 118.864 -4.884 1
1 455 . 4 1 1 A 59 59 LYS H H 37 7.790 9.047 -1.257 1
1 456 . 4 1 1 A 59 59 LYS HA H 37 3.960 5.068 -1.108 1
1 463 . 4 1 1 A 59 59 LYS C C 37 172.670 174.007 -1.337 1
1 464 . 4 1 1 A 59 59 LYS CA C 37 57.140 54.587 2.553 1
1 465 . 4 1 1 A 59 59 LYS CB C 37 29.020 33.399 -4.379 1
1 468 . 4 1 1 A 59 59 LYS N N 37 118.810 122.578 -3.768 1
1 469 . 4 1 1 A 60 60 SER H H 38 7.750 8.557 -0.807 1
1 470 . 4 1 1 A 60 60 SER HA H 38 4.700 5.159 -0.459 1
1 473 . 4 1 1 A 60 60 SER C C 38 170.170 175.281 -5.111 1
1 474 . 4 1 1 A 60 60 SER CA C 38 57.130 54.698 2.432 1
1 475 . 4 1 1 A 60 60 SER CB C 38 66.820 31.642 35.178 1
1 476 . 4 1 1 A 60 60 SER N N 38 112.620 127.151 -14.531 1
1 477 . 4 1 1 A 61 61 HIS H H 39 8.630 9.442 -0.812 1
1 478 . 4 1 1 A 61 61 HIS N N 39 124.090 126.550 -2.460 1
1 479 . 4 1 1 A 62 62 THR HA H 40 3.610 5.264 -1.654 1
1 484 . 4 1 1 A 62 62 THR C C 40 174.350 175.971 -1.621 1
1 485 . 4 1 1 A 62 62 THR CA C 40 66.160 50.881 15.279 1
1 486 . 4 1 1 A 62 62 THR CB C 40 68.070 20.959 47.111 1
1 488 . 4 1 1 A 63 63 ASP H H 41 10.310 8.840 1.470 1
1 489 . 4 1 1 A 63 63 ASP HA H 41 4.420 4.955 -0.535 1
1 492 . 4 1 1 A 63 63 ASP C C 41 174.630 175.240 -0.610 1
1 493 . 4 1 1 A 63 63 ASP CA C 41 56.330 58.059 -1.729 1
1 494 . 4 1 1 A 63 63 ASP CB C 41 40.040 34.640 5.400 1
1 495 . 4 1 1 A 63 63 ASP N N 41 122.900 117.825 5.075 1
1 497 . 4 1 1 A 64 64 GLN HA H 42 4.270 4.534 -0.264 1
1 504 . 4 1 1 A 64 64 GLN C C 42 172.160 176.514 -4.354 1
1 505 . 4 1 1 A 64 64 GLN CA C 42 55.860 63.551 -7.691 1
1 506 . 4 1 1 A 64 64 GLN CB C 42 30.480 31.883 -1.403 1
1 508 . 4 1 1 A 64 64 GLN N N 42 115.750 138.260 -22.510 1
1 510 . 4 1 1 A 65 65 LEU H H 43 7.250 7.876 -0.626 1
1 511 . 4 1 1 A 65 65 LEU HA H 43 4.440 3.992 0.448 1
1 517 . 4 1 1 A 65 65 LEU C C 43 173.160 175.881 -2.721 1
1 518 . 4 1 1 A 65 65 LEU CA C 43 54.620 58.247 -3.627 1
1 519 . 4 1 1 A 65 65 LEU CB C 43 41.990 27.903 14.087 1
1 521 . 4 1 1 A 65 65 LEU N N 43 116.570 113.895 2.675 1
1 522 . 4 1 1 A 66 66 VAL H H 44 8.690 7.962 0.728 1
1 523 . 4 1 1 A 66 66 VAL HA H 44 3.980 4.918 -0.938 1
1 528 . 4 1 1 A 66 66 VAL C C 44 171.340 175.501 -4.161 1
1 529 . 4 1 1 A 66 66 VAL CA C 44 61.910 53.261 8.649 1
1 530 . 4 1 1 A 66 66 VAL CB C 44 33.630 40.037 -6.407 1
1 532 . 4 1 1 A 66 66 VAL N N 44 125.260 117.211 8.049 1
1 533 . 4 1 1 A 67 67 LEU H H 45 8.570 7.700 0.870 1
1 534 . 4 1 1 A 67 67 LEU HA H 45 5.220 4.331 0.889 1
1 544 . 4 1 1 A 67 67 LEU C C 45 172.500 174.224 -1.724 1
1 545 . 4 1 1 A 67 67 LEU CA C 45 52.820 60.412 -7.592 1
1 546 . 4 1 1 A 67 67 LEU CB C 45 45.310 63.641 -18.331 1
1 550 . 4 1 1 A 67 67 LEU N N 45 126.690 116.479 10.211 1
1 551 . 4 1 1 A 68 68 ILE H H 46 9.040 8.998 0.042 1
1 552 . 4 1 1 A 68 68 ILE HA H 46 4.880 4.579 0.301 1
1 562 . 4 1 1 A 68 68 ILE C C 46 172.390 175.851 -3.461 1
1 563 . 4 1 1 A 68 68 ILE CA C 46 59.900 57.921 1.979 1
1 564 . 4 1 1 A 68 68 ILE CB C 46 41.940 64.524 -22.584 1
1 568 . 4 1 1 A 68 68 ILE N N 46 122.590 120.714 1.876 1
1 569 . 4 1 1 A 69 69 PHE H H 47 8.740 8.831 -0.091 1
1 570 . 4 1 1 A 69 69 PHE N N 47 125.360 122.588 2.772 1
1 571 . 4 1 1 A 70 70 ALA HA H 48 3.600 4.085 -0.485 1
1 575 . 4 1 1 A 70 70 ALA C C 48 174.500 177.998 -3.498 1
1 576 . 4 1 1 A 70 70 ALA CA C 48 52.520 58.175 -5.655 1
1 577 . 4 1 1 A 70 70 ALA CB C 48 16.760 28.038 -11.278 1
1 578 . 4 1 1 A 71 71 GLY H H 49 8.210 7.596 0.614 1
1 581 . 4 1 1 A 71 71 GLY C C 49 170.850 178.519 -7.669 1
1 582 . 4 1 1 A 71 71 GLY CA C 49 45.380 58.014 -12.634 1
1 583 . 4 1 1 A 71 71 GLY N N 49 102.430 119.513 -17.083 1
1 584 . 4 1 1 A 72 72 LYS H H 50 7.840 8.172 -0.332 1
1 585 . 4 1 1 A 72 72 LYS HA H 50 4.530 4.010 0.520 1
1 594 . 4 1 1 A 72 72 LYS C C 50 171.800 177.827 -6.027 1
1 595 . 4 1 1 A 72 72 LYS CA C 50 54.630 61.168 -6.538 1
1 596 . 4 1 1 A 72 72 LYS CB C 50 34.630 39.102 -4.472 1
1 600 . 4 1 1 A 72 72 LYS N N 50 121.570 120.810 0.760 1
1 601 . 4 1 1 A 73 73 ILE H H 51 8.250 8.172 0.078 1
1 602 . 4 1 1 A 73 73 ILE HA H 51 4.260 3.826 0.434 1
1 612 . 4 1 1 A 73 73 ILE C C 51 174.300 178.079 -3.779 1
1 613 . 4 1 1 A 73 73 ILE CA C 51 61.270 58.217 3.053 1
1 614 . 4 1 1 A 73 73 ILE CB C 51 38.150 31.251 6.899 1
1 618 . 4 1 1 A 73 73 ILE N N 51 122.710 117.936 4.774 1
1 619 . 4 1 1 A 74 74 LEU H H 52 8.540 8.121 0.419 1
1 620 . 4 1 1 A 74 74 LEU HA H 52 3.980 4.080 -0.100 1
1 630 . 4 1 1 A 74 74 LEU C C 52 173.440 179.217 -5.777 1
1 631 . 4 1 1 A 74 74 LEU CA C 52 54.660 59.047 -4.387 1
1 632 . 4 1 1 A 74 74 LEU CB C 52 41.790 29.250 12.540 1
1 636 . 4 1 1 A 74 74 LEU N N 52 128.360 119.026 9.334 1
1 637 . 4 1 1 A 75 75 LYS H H 53 8.100 7.894 0.206 1
1 638 . 4 1 1 A 75 75 LYS HA H 53 4.440 4.117 0.323 1
1 645 . 4 1 1 A 75 75 LYS C C 53 175.170 179.901 -4.731 1
1 646 . 4 1 1 A 75 75 LYS CA C 53 55.340 59.216 -3.876 1
1 647 . 4 1 1 A 75 75 LYS CB C 53 32.680 29.770 2.910 1
1 650 . 4 1 1 A 75 75 LYS N N 53 123.470 120.833 2.637 1
1 651 . 4 1 1 A 76 76 ASP H H 54 8.310 7.284 1.026 1
1 652 . 4 1 1 A 76 76 ASP HA H 54 4.110 3.973 0.137 1
1 655 . 4 1 1 A 76 76 ASP C C 54 174.270 178.279 -4.009 1
1 656 . 4 1 1 A 76 76 ASP CA C 54 58.140 65.216 -7.076 1
1 657 . 4 1 1 A 76 76 ASP CB C 54 40.760 37.609 3.151 1
1 658 . 4 1 1 A 76 76 ASP N N 54 121.080 121.229 -0.149 1
1 659 . 4 1 1 A 77 77 GLN H H 55 8.180 7.889 0.291 1
1 660 . 4 1 1 A 77 77 GLN HA H 55 4.360 4.212 0.148 1
1 667 . 4 1 1 A 77 77 GLN C C 55 173.710 176.556 -2.846 1
1 668 . 4 1 1 A 77 77 GLN CA C 55 56.350 61.443 -5.093 1
1 669 . 4 1 1 A 77 77 GLN CB C 55 28.090 62.913 -34.823 1
1 671 . 4 1 1 A 77 77 GLN N N 55 113.190 116.528 -3.338 1
1 673 . 4 1 1 A 78 78 ASP H H 56 7.770 7.556 0.214 1
1 674 . 4 1 1 A 78 78 ASP HA H 56 4.700 4.043 0.657 1
1 677 . 4 1 1 A 78 78 ASP C C 56 173.500 178.552 -5.052 1
1 678 . 4 1 1 A 78 78 ASP CA C 56 54.140 59.062 -4.922 1
1 679 . 4 1 1 A 78 78 ASP CB C 56 42.020 31.858 10.162 1
1 680 . 4 1 1 A 78 78 ASP N N 56 121.910 119.146 2.764 1
1 681 . 4 1 1 A 79 79 THR H H 57 8.490 7.405 1.085 1
1 682 . 4 1 1 A 79 79 THR HA H 57 4.700 3.830 0.870 1
1 687 . 4 1 1 A 79 79 THR C C 57 172.840 176.986 -4.146 1
1 688 . 4 1 1 A 79 79 THR CA C 57 59.980 59.129 0.851 1
1 689 . 4 1 1 A 79 79 THR CB C 57 70.640 30.172 40.468 1
1 691 . 4 1 1 A 79 79 THR N N 57 108.860 119.265 -10.405 1
1 692 . 4 1 1 A 80 80 LEU H H 58 7.700 7.484 0.216 1
1 693 . 4 1 1 A 80 80 LEU HA H 58 3.880 4.572 -0.692 1
1 703 . 4 1 1 A 80 80 LEU C C 58 177.370 174.672 2.698 1
1 704 . 4 1 1 A 80 80 LEU CA C 58 58.450 57.463 0.987 1
1 705 . 4 1 1 A 80 80 LEU CB C 58 39.500 39.456 0.044 1
1 709 . 4 1 1 A 80 80 LEU N N 58 118.820 115.500 3.320 1
1 710 . 4 1 1 A 81 81 SER H H 59 8.810 7.666 1.144 1
1 711 . 4 1 1 A 81 81 SER HA H 59 4.050 3.770 0.280 1
1 714 . 4 1 1 A 81 81 SER C C 59 176.150 174.475 1.675 1
1 715 . 4 1 1 A 81 81 SER CA C 59 61.190 57.391 3.799 1
1 716 . 4 1 1 A 81 81 SER CB C 59 62.490 29.247 33.243 1
1 717 . 4 1 1 A 81 81 SER N N 59 114.240 116.269 -2.029 1
1 718 . 4 1 1 A 82 82 GLN H H 60 7.950 7.386 0.564 1
1 719 . 4 1 1 A 82 82 GLN HA H 60 4.090 4.713 -0.623 1
1 726 . 4 1 1 A 82 82 GLN C C 60 173.930 173.413 0.517 1
1 727 . 4 1 1 A 82 82 GLN CA C 60 58.080 57.514 0.566 1
1 728 . 4 1 1 A 82 82 GLN CB C 60 28.460 65.290 -36.830 1
1 730 . 4 1 1 A 82 82 GLN N N 60 122.620 114.044 8.576 1
1 732 . 4 1 1 A 83 83 HIS H H 61 6.990 8.531 -1.541 1
1 733 . 4 1 1 A 83 83 HIS HA H 61 4.490 4.587 -0.097 1
1 736 . 4 1 1 A 83 83 HIS C C 61 172.260 177.207 -4.947 1
1 737 . 4 1 1 A 83 83 HIS CA C 61 57.110 56.676 0.434 1
1 738 . 4 1 1 A 83 83 HIS CB C 61 32.780 30.782 1.998 1
1 739 . 4 1 1 A 83 83 HIS N N 61 116.940 124.878 -7.938 1
1 740 . 4 1 1 A 84 84 GLY H H 62 7.870 9.005 -1.135 1
1 743 . 4 1 1 A 84 84 GLY C C 62 171.040 176.454 -5.414 1
1 744 . 4 1 1 A 84 84 GLY CA C 62 45.390 66.136 -20.746 1
1 745 . 4 1 1 A 84 84 GLY N N 62 106.740 117.001 -10.261 1
1 746 . 4 1 1 A 85 85 ILE H H 63 6.810 8.225 -1.415 1
1 747 . 4 1 1 A 85 85 ILE HA H 63 3.050 4.370 -1.320 1
1 757 . 4 1 1 A 85 85 ILE C C 63 170.130 178.751 -8.621 1
1 758 . 4 1 1 A 85 85 ILE CA C 63 62.440 57.779 4.661 1
1 759 . 4 1 1 A 85 85 ILE CB C 63 36.110 41.086 -4.976 1
1 763 . 4 1 1 A 85 85 ILE N N 63 118.920 121.946 -3.026 1
1 764 . 4 1 1 A 86 86 HIS H H 64 6.020 7.718 -1.698 1
1 765 . 4 1 1 A 86 86 HIS HA H 64 5.030 4.305 0.725 1
1 768 . 4 1 1 A 86 86 HIS C C 64 170.090 176.558 -6.468 1
1 769 . 4 1 1 A 86 86 HIS CA C 64 53.500 57.540 -4.040 1
1 770 . 4 1 1 A 86 86 HIS CB C 64 31.860 29.307 2.553 1
1 771 . 4 1 1 A 86 86 HIS N N 64 122.440 117.151 5.289 1
1 772 . 4 1 1 A 87 87 ASP H H 65 8.340 7.139 1.201 1
1 773 . 4 1 1 A 87 87 ASP HA H 65 4.320 4.411 -0.091 1
1 776 . 4 1 1 A 87 87 ASP C C 65 174.370 176.028 -1.658 1
1 777 . 4 1 1 A 87 87 ASP CA C 65 56.440 54.079 2.361 1
1 778 . 4 1 1 A 87 87 ASP CB C 65 43.150 42.540 0.610 1
1 779 . 4 1 1 A 87 87 ASP N N 65 116.230 121.072 -4.842 1
1 780 . 4 1 1 A 88 88 GLY H H 66 9.330 8.893 0.437 1
1 783 . 4 1 1 A 88 88 GLY C C 66 172.330 174.534 -2.204 1
1 784 . 4 1 1 A 88 88 GLY CA C 66 45.270 60.122 -14.852 1
1 785 . 4 1 1 A 88 88 GLY N N 66 112.300 119.860 -7.560 1
1 786 . 4 1 1 A 89 89 LEU H H 67 7.640 9.031 -1.391 1
1 787 . 4 1 1 A 89 89 LEU HA H 67 4.720 4.795 -0.075 1
1 797 . 4 1 1 A 89 89 LEU C C 67 172.460 175.903 -3.443 1
1 798 . 4 1 1 A 89 89 LEU CA C 67 54.420 53.873 0.547 1
1 799 . 4 1 1 A 89 89 LEU CB C 67 42.260 42.762 -0.502 1
1 803 . 4 1 1 A 89 89 LEU N N 67 120.310 126.987 -6.677 1
1 804 . 4 1 1 A 90 90 THR H H 68 8.110 8.759 -0.649 1
1 805 . 4 1 1 A 90 90 THR HA H 68 5.300 5.390 -0.090 1
1 810 . 4 1 1 A 90 90 THR C C 68 170.900 174.906 -4.006 1
1 811 . 4 1 1 A 90 90 THR CA C 68 61.870 60.203 1.667 1
1 812 . 4 1 1 A 90 90 THR CB C 68 71.320 40.887 30.433 1
1 814 . 4 1 1 A 90 90 THR N N 68 115.300 122.222 -6.922 1
1 815 . 4 1 1 A 91 91 VAL H H 69 9.290 9.092 0.198 1
1 816 . 4 1 1 A 91 91 VAL HA H 69 4.540 4.710 -0.170 1
1 824 . 4 1 1 A 91 91 VAL C C 69 170.890 174.453 -3.563 1
1 825 . 4 1 1 A 91 91 VAL CA C 69 60.310 58.073 2.237 1
1 826 . 4 1 1 A 91 91 VAL CB C 69 34.680 42.145 -7.465 1
1 829 . 4 1 1 A 91 91 VAL N N 69 124.200 126.424 -2.224 1
1 830 . 4 1 1 A 92 92 HIS H H 70 8.750 8.487 0.263 1
1 831 . 4 1 1 A 92 92 HIS HA H 70 5.020 3.890 1.130 1
1 835 . 4 1 1 A 92 92 HIS C C 70 170.890 177.385 -6.495 1
1 836 . 4 1 1 A 92 92 HIS CA C 70 56.750 53.251 3.499 1
1 837 . 4 1 1 A 92 92 HIS CB C 70 32.220 18.025 14.195 1
1 839 . 4 1 1 A 92 92 HIS N N 70 125.250 128.666 -3.416 1
1 840 . 4 1 1 A 93 93 LEU H H 71 8.290 8.578 -0.288 1
1 851 . 4 1 1 A 93 93 LEU C C 71 172.570 173.458 -0.888 1
1 852 . 4 1 1 A 93 93 LEU CA C 71 52.820 45.678 7.142 1
1 857 . 4 1 1 A 93 93 LEU N N 71 123.360 102.771 20.589 1
1 858 . 4 1 1 A 94 94 VAL H H 72 9.110 7.194 1.916 1
1 859 . 4 1 1 A 94 94 VAL HA H 72 4.080 4.855 -0.775 1
1 864 . 4 1 1 A 94 94 VAL C C 72 171.160 175.091 -3.931 1
1 865 . 4 1 1 A 94 94 VAL CA C 72 61.350 54.438 6.912 1
1 866 . 4 1 1 A 94 94 VAL CB C 72 34.640 35.489 -0.849 1
1 868 . 4 1 1 A 94 94 VAL N N 72 128.650 114.730 13.920 1
1 869 . 4 1 1 A 95 95 ILE H H 73 8.150 8.205 -0.055 1
1 870 . 4 1 1 A 95 95 ILE HA H 73 4.500 4.747 -0.247 1
1 880 . 4 1 1 A 95 95 ILE C C 73 174.320 175.613 -1.293 1
1 881 . 4 1 1 A 95 95 ILE CA C 73 60.170 60.515 -0.345 1
1 882 . 4 1 1 A 95 95 ILE CB C 73 38.120 38.917 -0.797 1
1 886 . 4 1 1 A 95 95 ILE N N 73 125.560 119.361 6.199 1
1 887 . 4 1 1 A 96 96 LYS H H 74 9.280 8.733 0.547 1
1 888 . 4 1 1 A 96 96 LYS HA H 74 4.240 4.343 -0.103 1
1 891 . 4 1 1 A 96 96 LYS C C 74 173.510 176.413 -2.903 1
1 892 . 4 1 1 A 96 96 LYS CA C 74 56.730 54.488 2.242 1
1 893 . 4 1 1 A 96 96 LYS CB C 74 33.100 41.754 -8.654 1
1 894 . 4 1 1 A 96 96 LYS N N 74 129.290 127.570 1.720 1
1 895 . 4 1 1 A 97 97 THR H H 75 8.040 8.788 -0.748 1
1 896 . 4 1 1 A 97 97 THR HA H 75 4.230 4.629 -0.399 1
1 901 . 4 1 1 A 97 97 THR C C 75 171.800 177.691 -5.891 1
1 902 . 4 1 1 A 97 97 THR CA C 75 61.760 54.655 7.105 1
1 903 . 4 1 1 A 97 97 THR CB C 75 69.830 34.707 35.123 1
1 905 . 4 1 1 A 97 97 THR N N 75 114.420 123.563 -9.143 1
1 906 . 4 1 1 A 98 98 GLN H H 76 8.400 8.871 -0.471 1
1 907 . 4 1 1 A 98 98 GLN HA H 76 4.210 4.274 -0.064 1
1 914 . 4 1 1 A 98 98 GLN CA C 76 55.880 57.044 -1.164 1
1 915 . 4 1 1 A 98 98 GLN CB C 76 29.700 40.330 -10.630 1
1 917 . 4 1 1 A 98 98 GLN N N 76 122.370 121.735 0.635 1
1 919 . 4 1 1 A 99 99 ASN HA H 77 4.590 4.093 0.497 1
1 924 . 4 1 1 A 99 99 ASN C C 77 171.780 176.312 -4.532 1
1 925 . 4 1 1 A 99 99 ASN CA C 77 53.300 58.559 -5.259 1
1 926 . 4 1 1 A 99 99 ASN CB C 77 38.920 28.178 10.742 1
1 928 . 4 1 1 A 100 100 ARG H H 78 8.160 7.884 0.276 1
1 929 . 4 1 1 A 100 100 ARG HA H 78 4.560 4.953 -0.393 1
1 936 . 4 1 1 A 100 100 ARG CA C 78 53.860 53.629 0.231 1
1 937 . 4 1 1 A 100 100 ARG CB C 78 30.210 41.977 -11.767 1
1 940 . 4 1 1 A 100 100 ARG N N 78 122.840 119.962 2.878 1
1 941 . 4 1 1 A 101 101 PRO HA H 79 4.150 4.925 -0.775 1
1 948 . 4 1 1 A 101 101 PRO CA C 79 64.770 59.159 5.611 1
1 949 . 4 1 1 A 101 101 PRO CB C 79 32.040 71.635 -39.595 1
1 289 . 5 1 1 A 46 46 SER H H 24 8.950 8.462 0.488 1
1 290 . 5 1 1 A 46 46 SER HA H 24 4.900 4.475 0.425 1
1 293 . 5 1 1 A 46 46 SER C C 24 170.890 176.203 -5.313 1
1 294 . 5 1 1 A 46 46 SER CA C 24 56.980 55.958 1.022 1
1 295 . 5 1 1 A 46 46 SER CB C 24 65.590 33.453 32.137 1
1 296 . 5 1 1 A 46 46 SER N N 24 120.420 121.211 -0.791 1
1 297 . 5 1 1 A 47 47 VAL H H 25 9.140 8.272 0.868 1
1 298 . 5 1 1 A 47 47 VAL HA H 25 3.440 4.377 -0.937 1
1 306 . 5 1 1 A 47 47 VAL C C 25 175.060 176.015 -0.955 1
1 307 . 5 1 1 A 47 47 VAL CA C 25 67.250 60.954 6.296 1
1 308 . 5 1 1 A 47 47 VAL CB C 25 30.780 39.633 -8.853 1
1 311 . 5 1 1 A 47 47 VAL N N 25 123.970 126.177 -2.207 1
1 312 . 5 1 1 A 48 48 GLN H H 26 8.540 8.739 -0.199 1
1 313 . 5 1 1 A 48 48 GLN HA H 26 4.070 4.841 -0.771 1
1 320 . 5 1 1 A 48 48 GLN CA C 26 60.230 53.864 6.366 1
1 321 . 5 1 1 A 48 48 GLN CB C 26 28.490 32.453 -3.963 1
1 323 . 5 1 1 A 48 48 GLN N N 26 120.550 126.764 -6.214 1
1 325 . 5 1 1 A 49 49 GLN HA H 27 3.950 4.959 -1.009 1
1 332 . 5 1 1 A 49 49 GLN C C 27 176.230 175.315 0.915 1
1 333 . 5 1 1 A 49 49 GLN CA C 27 58.710 55.756 2.954 1
1 334 . 5 1 1 A 49 49 GLN CB C 27 28.820 31.890 -3.070 1
1 337 . 5 1 1 A 50 50 PHE H H 28 8.050 8.672 -0.622 1
1 338 . 5 1 1 A 50 50 PHE HA H 28 4.620 4.552 0.068 1
1 345 . 5 1 1 A 50 50 PHE C C 28 175.190 175.610 -0.420 1
1 346 . 5 1 1 A 50 50 PHE CA C 28 58.030 62.009 -3.979 1
1 347 . 5 1 1 A 50 50 PHE CB C 28 39.190 31.824 7.366 1
1 350 . 5 1 1 A 50 50 PHE N N 28 121.710 125.163 -3.453 1
1 351 . 5 1 1 A 51 51 LYS H H 29 8.940 8.738 0.202 1
1 352 . 5 1 1 A 51 51 LYS HA H 29 3.340 4.692 -1.352 1
1 361 . 5 1 1 A 51 51 LYS C C 29 175.370 174.192 1.178 1
1 362 . 5 1 1 A 51 51 LYS CA C 29 60.660 62.653 -1.993 1
1 363 . 5 1 1 A 51 51 LYS CB C 29 33.190 69.695 -36.505 1
1 367 . 5 1 1 A 51 51 LYS N N 29 117.530 123.400 -5.870 1
1 368 . 5 1 1 A 52 52 GLU H H 30 7.700 9.538 -1.838 1
1 369 . 5 1 1 A 52 52 GLU HA H 30 3.750 4.834 -1.084 1
1 374 . 5 1 1 A 52 52 GLU C C 30 176.780 174.351 2.429 1
1 375 . 5 1 1 A 52 52 GLU CA C 30 59.890 61.380 -1.490 1
1 376 . 5 1 1 A 52 52 GLU CB C 30 28.840 33.352 -4.512 1
1 378 . 5 1 1 A 52 52 GLU N N 30 118.820 128.526 -9.706 1
1 379 . 5 1 1 A 53 53 GLU H H 31 7.370 8.889 -1.519 1
1 380 . 5 1 1 A 53 53 GLU HA H 31 4.150 5.065 -0.915 1
1 385 . 5 1 1 A 53 53 GLU C C 31 177.040 175.826 1.214 1
1 386 . 5 1 1 A 53 53 GLU CA C 31 58.860 55.141 3.719 1
1 387 . 5 1 1 A 53 53 GLU CB C 31 29.200 34.151 -4.951 1
1 389 . 5 1 1 A 53 53 GLU N N 31 119.150 129.366 -10.216 1
1 390 . 5 1 1 A 54 54 ILE H H 32 8.000 8.508 -0.508 1
1 391 . 5 1 1 A 54 54 ILE HA H 32 3.550 4.896 -1.346 1
1 401 . 5 1 1 A 54 54 ILE C C 32 175.420 174.143 1.277 1
1 402 . 5 1 1 A 54 54 ILE CA C 32 64.690 58.842 5.848 1
1 403 . 5 1 1 A 54 54 ILE CB C 32 37.820 71.238 -33.418 1
1 407 . 5 1 1 A 54 54 ILE N N 32 119.970 116.237 3.733 1
1 409 . 5 1 1 A 55 55 SER HA H 33 3.930 4.493 -0.563 1
1 412 . 5 1 1 A 55 55 SER C C 33 173.830 178.270 -4.440 1
1 413 . 5 1 1 A 55 55 SER CA C 33 61.620 64.422 -2.802 1
1 414 . 5 1 1 A 55 55 SER CB C 33 62.720 31.742 30.978 1
1 415 . 5 1 1 A 55 55 SER N N 33 115.780 136.710 -20.930 1
1 416 . 5 1 1 A 56 56 LYS H H 34 7.150 8.716 -1.566 1
1 417 . 5 1 1 A 56 56 LYS HA H 34 4.090 4.176 -0.086 1
1 424 . 5 1 1 A 56 56 LYS C C 34 176.080 176.814 -0.734 1
1 425 . 5 1 1 A 56 56 LYS CA C 34 58.950 59.032 -0.082 1
1 426 . 5 1 1 A 56 56 LYS CB C 34 32.540 33.248 -0.708 1
1 429 . 5 1 1 A 56 56 LYS N N 34 119.100 117.703 1.397 1
1 430 . 5 1 1 A 57 57 ARG H H 35 7.530 7.816 -0.286 1
1 431 . 5 1 1 A 57 57 ARG HA H 35 4.110 4.699 -0.589 1
1 436 . 5 1 1 A 57 57 ARG C C 35 174.800 174.059 0.741 1
1 437 . 5 1 1 A 57 57 ARG CA C 35 57.090 55.425 1.665 1
1 438 . 5 1 1 A 57 57 ARG CB C 35 29.810 31.389 -1.579 1
1 440 . 5 1 1 A 57 57 ARG N N 35 119.370 113.147 6.223 1
1 441 . 5 1 1 A 58 58 PHE H H 36 8.320 8.522 -0.202 1
1 442 . 5 1 1 A 58 58 PHE HA H 36 4.340 5.363 -1.023 1
1 449 . 5 1 1 A 58 58 PHE C C 36 171.940 174.940 -3.000 1
1 450 . 5 1 1 A 58 58 PHE CA C 36 58.500 55.154 3.346 1
1 451 . 5 1 1 A 58 58 PHE CB C 36 38.130 34.897 3.233 1
1 454 . 5 1 1 A 58 58 PHE N N 36 113.980 119.113 -5.133 1
1 455 . 5 1 1 A 59 59 LYS H H 37 7.790 9.165 -1.375 1
1 456 . 5 1 1 A 59 59 LYS HA H 37 3.960 5.056 -1.096 1
1 463 . 5 1 1 A 59 59 LYS C C 37 172.670 174.179 -1.509 1
1 464 . 5 1 1 A 59 59 LYS CA C 37 57.140 54.887 2.253 1
1 465 . 5 1 1 A 59 59 LYS CB C 37 29.020 33.178 -4.158 1
1 468 . 5 1 1 A 59 59 LYS N N 37 118.810 121.602 -2.792 1
1 469 . 5 1 1 A 60 60 SER H H 38 7.750 8.704 -0.954 1
1 470 . 5 1 1 A 60 60 SER HA H 38 4.700 4.831 -0.131 1
1 473 . 5 1 1 A 60 60 SER C C 38 170.170 175.474 -5.304 1
1 474 . 5 1 1 A 60 60 SER CA C 38 57.130 54.928 2.202 1
1 475 . 5 1 1 A 60 60 SER CB C 38 66.820 30.760 36.060 1
1 476 . 5 1 1 A 60 60 SER N N 38 112.620 128.341 -15.721 1
1 477 . 5 1 1 A 61 61 HIS H H 39 8.630 9.340 -0.710 1
1 478 . 5 1 1 A 61 61 HIS N N 39 124.090 126.746 -2.656 1
1 479 . 5 1 1 A 62 62 THR HA H 40 3.610 5.543 -1.933 1
1 484 . 5 1 1 A 62 62 THR C C 40 174.350 176.170 -1.820 1
1 485 . 5 1 1 A 62 62 THR CA C 40 66.160 50.709 15.451 1
1 486 . 5 1 1 A 62 62 THR CB C 40 68.070 21.947 46.123 1
1 488 . 5 1 1 A 63 63 ASP H H 41 10.310 8.854 1.456 1
1 489 . 5 1 1 A 63 63 ASP HA H 41 4.420 4.903 -0.483 1
1 492 . 5 1 1 A 63 63 ASP C C 41 174.630 174.363 0.267 1
1 493 . 5 1 1 A 63 63 ASP CA C 41 56.330 58.260 -1.930 1
1 494 . 5 1 1 A 63 63 ASP CB C 41 40.040 34.923 5.117 1
1 495 . 5 1 1 A 63 63 ASP N N 41 122.900 117.359 5.541 1
1 497 . 5 1 1 A 64 64 GLN HA H 42 4.270 4.685 -0.415 1
1 504 . 5 1 1 A 64 64 GLN C C 42 172.160 177.667 -5.507 1
1 505 . 5 1 1 A 64 64 GLN CA C 42 55.860 62.666 -6.806 1
1 506 . 5 1 1 A 64 64 GLN CB C 42 30.480 29.709 0.771 1
1 508 . 5 1 1 A 64 64 GLN N N 42 115.750 139.242 -23.492 1
1 510 . 5 1 1 A 65 65 LEU H H 43 7.250 8.283 -1.033 1
1 511 . 5 1 1 A 65 65 LEU HA H 43 4.440 4.031 0.409 1
1 517 . 5 1 1 A 65 65 LEU C C 43 173.160 175.768 -2.608 1
1 518 . 5 1 1 A 65 65 LEU CA C 43 54.620 57.531 -2.911 1
1 519 . 5 1 1 A 65 65 LEU CB C 43 41.990 27.463 14.527 1
1 521 . 5 1 1 A 65 65 LEU N N 43 116.570 119.209 -2.639 1
1 522 . 5 1 1 A 66 66 VAL H H 44 8.690 8.180 0.510 1
1 523 . 5 1 1 A 66 66 VAL HA H 44 3.980 5.037 -1.057 1
1 528 . 5 1 1 A 66 66 VAL C C 44 171.340 175.164 -3.824 1
1 529 . 5 1 1 A 66 66 VAL CA C 44 61.910 53.698 8.212 1
1 530 . 5 1 1 A 66 66 VAL CB C 44 33.630 41.764 -8.134 1
1 532 . 5 1 1 A 66 66 VAL N N 44 125.260 118.506 6.754 1
1 533 . 5 1 1 A 67 67 LEU H H 45 8.570 7.768 0.802 1
1 534 . 5 1 1 A 67 67 LEU HA H 45 5.220 4.347 0.873 1
1 544 . 5 1 1 A 67 67 LEU C C 45 172.500 174.325 -1.825 1
1 545 . 5 1 1 A 67 67 LEU CA C 45 52.820 60.286 -7.466 1
1 546 . 5 1 1 A 67 67 LEU CB C 45 45.310 63.682 -18.372 1
1 550 . 5 1 1 A 67 67 LEU N N 45 126.690 116.998 9.692 1
1 551 . 5 1 1 A 68 68 ILE H H 46 9.040 8.934 0.106 1
1 552 . 5 1 1 A 68 68 ILE HA H 46 4.880 4.478 0.402 1
1 562 . 5 1 1 A 68 68 ILE C C 46 172.390 175.610 -3.220 1
1 563 . 5 1 1 A 68 68 ILE CA C 46 59.900 58.613 1.287 1
1 564 . 5 1 1 A 68 68 ILE CB C 46 41.940 64.229 -22.289 1
1 568 . 5 1 1 A 68 68 ILE N N 46 122.590 121.654 0.936 1
1 569 . 5 1 1 A 69 69 PHE H H 47 8.740 8.595 0.145 1
1 570 . 5 1 1 A 69 69 PHE N N 47 125.360 123.764 1.596 1
1 571 . 5 1 1 A 70 70 ALA HA H 48 3.600 3.977 -0.377 1
1 575 . 5 1 1 A 70 70 ALA C C 48 174.500 178.721 -4.221 1
1 576 . 5 1 1 A 70 70 ALA CA C 48 52.520 59.425 -6.905 1
1 577 . 5 1 1 A 70 70 ALA CB C 48 16.760 28.581 -11.821 1
1 578 . 5 1 1 A 71 71 GLY H H 49 8.210 7.935 0.275 1
1 581 . 5 1 1 A 71 71 GLY C C 49 170.850 178.209 -7.359 1
1 582 . 5 1 1 A 71 71 GLY CA C 49 45.380 58.055 -12.675 1
1 583 . 5 1 1 A 71 71 GLY N N 49 102.430 118.262 -15.832 1
1 584 . 5 1 1 A 72 72 LYS H H 50 7.840 8.228 -0.388 1
1 585 . 5 1 1 A 72 72 LYS HA H 50 4.530 4.083 0.447 1
1 594 . 5 1 1 A 72 72 LYS C C 50 171.800 177.704 -5.904 1
1 595 . 5 1 1 A 72 72 LYS CA C 50 54.630 61.053 -6.423 1
1 596 . 5 1 1 A 72 72 LYS CB C 50 34.630 38.828 -4.198 1
1 600 . 5 1 1 A 72 72 LYS N N 50 121.570 123.060 -1.490 1
1 601 . 5 1 1 A 73 73 ILE H H 51 8.250 8.159 0.091 1
1 602 . 5 1 1 A 73 73 ILE HA H 51 4.260 3.845 0.415 1
1 612 . 5 1 1 A 73 73 ILE C C 51 174.300 178.004 -3.704 1
1 613 . 5 1 1 A 73 73 ILE CA C 51 61.270 58.245 3.025 1
1 614 . 5 1 1 A 73 73 ILE CB C 51 38.150 31.240 6.910 1
1 618 . 5 1 1 A 73 73 ILE N N 51 122.710 118.205 4.505 1
1 619 . 5 1 1 A 74 74 LEU H H 52 8.540 8.240 0.300 1
1 620 . 5 1 1 A 74 74 LEU HA H 52 3.980 4.050 -0.070 1
1 630 . 5 1 1 A 74 74 LEU C C 52 173.440 179.212 -5.772 1
1 631 . 5 1 1 A 74 74 LEU CA C 52 54.660 59.128 -4.468 1
1 632 . 5 1 1 A 74 74 LEU CB C 52 41.790 29.171 12.619 1
1 636 . 5 1 1 A 74 74 LEU N N 52 128.360 119.094 9.266 1
1 637 . 5 1 1 A 75 75 LYS H H 53 8.100 7.443 0.657 1
1 638 . 5 1 1 A 75 75 LYS HA H 53 4.440 4.104 0.336 1
1 645 . 5 1 1 A 75 75 LYS C C 53 175.170 179.625 -4.455 1
1 646 . 5 1 1 A 75 75 LYS CA C 53 55.340 59.288 -3.948 1
1 647 . 5 1 1 A 75 75 LYS CB C 53 32.680 29.763 2.917 1
1 650 . 5 1 1 A 75 75 LYS N N 53 123.470 121.246 2.224 1
1 651 . 5 1 1 A 76 76 ASP H H 54 8.310 7.608 0.702 1
1 652 . 5 1 1 A 76 76 ASP HA H 54 4.110 4.056 0.054 1
1 655 . 5 1 1 A 76 76 ASP C C 54 174.270 178.139 -3.869 1
1 656 . 5 1 1 A 76 76 ASP CA C 54 58.140 65.411 -7.271 1
1 657 . 5 1 1 A 76 76 ASP CB C 54 40.760 37.343 3.417 1
1 658 . 5 1 1 A 76 76 ASP N N 54 121.080 121.358 -0.278 1
1 659 . 5 1 1 A 77 77 GLN H H 55 8.180 7.927 0.253 1
1 660 . 5 1 1 A 77 77 GLN HA H 55 4.360 4.270 0.090 1
1 667 . 5 1 1 A 77 77 GLN C C 55 173.710 176.433 -2.723 1
1 668 . 5 1 1 A 77 77 GLN CA C 55 56.350 61.319 -4.969 1
1 669 . 5 1 1 A 77 77 GLN CB C 55 28.090 63.006 -34.916 1
1 671 . 5 1 1 A 77 77 GLN N N 55 113.190 116.311 -3.121 1
1 673 . 5 1 1 A 78 78 ASP H H 56 7.770 8.115 -0.345 1
1 674 . 5 1 1 A 78 78 ASP HA H 56 4.700 4.127 0.573 1
1 677 . 5 1 1 A 78 78 ASP C C 56 173.500 178.969 -5.469 1
1 678 . 5 1 1 A 78 78 ASP CA C 56 54.140 58.959 -4.819 1
1 679 . 5 1 1 A 78 78 ASP CB C 56 42.020 32.099 9.921 1
1 680 . 5 1 1 A 78 78 ASP N N 56 121.910 119.505 2.405 1
1 681 . 5 1 1 A 79 79 THR H H 57 8.490 7.508 0.982 1
1 682 . 5 1 1 A 79 79 THR HA H 57 4.700 3.971 0.729 1
1 687 . 5 1 1 A 79 79 THR C C 57 172.840 178.214 -5.374 1
1 688 . 5 1 1 A 79 79 THR CA C 57 59.980 59.180 0.800 1
1 689 . 5 1 1 A 79 79 THR CB C 57 70.640 30.498 40.142 1
1 691 . 5 1 1 A 79 79 THR N N 57 108.860 119.391 -10.531 1
1 692 . 5 1 1 A 80 80 LEU H H 58 7.700 7.991 -0.291 1
1 693 . 5 1 1 A 80 80 LEU HA H 58 3.880 4.608 -0.728 1
1 703 . 5 1 1 A 80 80 LEU C C 58 177.370 174.791 2.579 1
1 704 . 5 1 1 A 80 80 LEU CA C 58 58.450 57.581 0.869 1
1 705 . 5 1 1 A 80 80 LEU CB C 58 39.500 38.938 0.562 1
1 709 . 5 1 1 A 80 80 LEU N N 58 118.820 117.258 1.562 1
1 710 . 5 1 1 A 81 81 SER H H 59 8.810 7.867 0.943 1
1 711 . 5 1 1 A 81 81 SER HA H 59 4.050 3.871 0.179 1
1 714 . 5 1 1 A 81 81 SER C C 59 176.150 174.405 1.745 1
1 715 . 5 1 1 A 81 81 SER CA C 59 61.190 57.283 3.907 1
1 716 . 5 1 1 A 81 81 SER CB C 59 62.490 29.244 33.246 1
1 717 . 5 1 1 A 81 81 SER N N 59 114.240 116.548 -2.308 1
1 718 . 5 1 1 A 82 82 GLN H H 60 7.950 7.416 0.534 1
1 719 . 5 1 1 A 82 82 GLN HA H 60 4.090 4.842 -0.752 1
1 726 . 5 1 1 A 82 82 GLN C C 60 173.930 173.183 0.747 1
1 727 . 5 1 1 A 82 82 GLN CA C 60 58.080 57.202 0.878 1
1 728 . 5 1 1 A 82 82 GLN CB C 60 28.460 65.547 -37.087 1
1 730 . 5 1 1 A 82 82 GLN N N 60 122.620 113.825 8.795 1
1 732 . 5 1 1 A 83 83 HIS H H 61 6.990 8.583 -1.593 1
1 733 . 5 1 1 A 83 83 HIS HA H 61 4.490 4.511 -0.021 1
1 736 . 5 1 1 A 83 83 HIS C C 61 172.260 177.177 -4.917 1
1 737 . 5 1 1 A 83 83 HIS CA C 61 57.110 57.136 -0.026 1
1 738 . 5 1 1 A 83 83 HIS CB C 61 32.780 30.567 2.213 1
1 739 . 5 1 1 A 83 83 HIS N N 61 116.940 123.840 -6.900 1
1 740 . 5 1 1 A 84 84 GLY H H 62 7.870 9.041 -1.171 1
1 743 . 5 1 1 A 84 84 GLY C C 62 171.040 175.524 -4.484 1
1 744 . 5 1 1 A 84 84 GLY CA C 62 45.390 66.039 -20.649 1
1 745 . 5 1 1 A 84 84 GLY N N 62 106.740 117.235 -10.495 1
1 746 . 5 1 1 A 85 85 ILE H H 63 6.810 8.827 -2.017 1
1 747 . 5 1 1 A 85 85 ILE HA H 63 3.050 4.308 -1.258 1
1 757 . 5 1 1 A 85 85 ILE C C 63 170.130 177.845 -7.715 1
1 758 . 5 1 1 A 85 85 ILE CA C 63 62.440 56.322 6.118 1
1 759 . 5 1 1 A 85 85 ILE CB C 63 36.110 39.143 -3.033 1
1 763 . 5 1 1 A 85 85 ILE N N 63 118.920 121.081 -2.161 1
1 764 . 5 1 1 A 86 86 HIS H H 64 6.020 7.695 -1.675 1
1 765 . 5 1 1 A 86 86 HIS HA H 64 5.030 4.274 0.756 1
1 768 . 5 1 1 A 86 86 HIS C C 64 170.090 177.018 -6.928 1
1 769 . 5 1 1 A 86 86 HIS CA C 64 53.500 57.731 -4.231 1
1 770 . 5 1 1 A 86 86 HIS CB C 64 31.860 29.154 2.706 1
1 771 . 5 1 1 A 86 86 HIS N N 64 122.440 117.091 5.349 1
1 772 . 5 1 1 A 87 87 ASP H H 65 8.340 7.614 0.726 1
1 773 . 5 1 1 A 87 87 ASP HA H 65 4.320 4.260 0.060 1
1 776 . 5 1 1 A 87 87 ASP C C 65 174.370 175.781 -1.411 1
1 777 . 5 1 1 A 87 87 ASP CA C 65 56.440 54.505 1.935 1
1 778 . 5 1 1 A 87 87 ASP CB C 65 43.150 40.638 2.512 1
1 779 . 5 1 1 A 87 87 ASP N N 65 116.230 121.479 -5.249 1
1 780 . 5 1 1 A 88 88 GLY H H 66 9.330 8.648 0.682 1
1 783 . 5 1 1 A 88 88 GLY C C 66 172.330 174.886 -2.556 1
1 784 . 5 1 1 A 88 88 GLY CA C 66 45.270 60.645 -15.375 1
1 785 . 5 1 1 A 88 88 GLY N N 66 112.300 121.139 -8.839 1
1 786 . 5 1 1 A 89 89 LEU H H 67 7.640 9.069 -1.429 1
1 787 . 5 1 1 A 89 89 LEU HA H 67 4.720 4.925 -0.205 1
1 797 . 5 1 1 A 89 89 LEU C C 67 172.460 175.976 -3.516 1
1 798 . 5 1 1 A 89 89 LEU CA C 67 54.420 53.776 0.644 1
1 799 . 5 1 1 A 89 89 LEU CB C 67 42.260 43.443 -1.183 1
1 803 . 5 1 1 A 89 89 LEU N N 67 120.310 127.738 -7.428 1
1 804 . 5 1 1 A 90 90 THR H H 68 8.110 8.817 -0.707 1
1 805 . 5 1 1 A 90 90 THR HA H 68 5.300 5.335 -0.035 1
1 810 . 5 1 1 A 90 90 THR C C 68 170.900 174.563 -3.663 1
1 811 . 5 1 1 A 90 90 THR CA C 68 61.870 60.258 1.612 1
1 812 . 5 1 1 A 90 90 THR CB C 68 71.320 40.795 30.525 1
1 814 . 5 1 1 A 90 90 THR N N 68 115.300 122.523 -7.223 1
1 815 . 5 1 1 A 91 91 VAL H H 69 9.290 9.055 0.235 1
1 816 . 5 1 1 A 91 91 VAL HA H 69 4.540 4.808 -0.268 1
1 824 . 5 1 1 A 91 91 VAL C C 69 170.890 174.755 -3.865 1
1 825 . 5 1 1 A 91 91 VAL CA C 69 60.310 57.406 2.904 1
1 826 . 5 1 1 A 91 91 VAL CB C 69 34.680 42.773 -8.093 1
1 829 . 5 1 1 A 91 91 VAL N N 69 124.200 126.891 -2.691 1
1 830 . 5 1 1 A 92 92 HIS H H 70 8.750 8.408 0.342 1
1 831 . 5 1 1 A 92 92 HIS HA H 70 5.020 3.785 1.235 1
1 835 . 5 1 1 A 92 92 HIS C C 70 170.890 177.228 -6.338 1
1 836 . 5 1 1 A 92 92 HIS CA C 70 56.750 53.110 3.640 1
1 837 . 5 1 1 A 92 92 HIS CB C 70 32.220 17.849 14.371 1
1 839 . 5 1 1 A 92 92 HIS N N 70 125.250 129.200 -3.950 1
1 840 . 5 1 1 A 93 93 LEU H H 71 8.290 8.490 -0.200 1
1 851 . 5 1 1 A 93 93 LEU C C 71 172.570 173.490 -0.920 1
1 852 . 5 1 1 A 93 93 LEU CA C 71 52.820 45.812 7.008 1
1 857 . 5 1 1 A 93 93 LEU N N 71 123.360 102.669 20.691 1
1 858 . 5 1 1 A 94 94 VAL H H 72 9.110 7.227 1.883 1
1 859 . 5 1 1 A 94 94 VAL HA H 72 4.080 4.852 -0.772 1
1 864 . 5 1 1 A 94 94 VAL C C 72 171.160 175.217 -4.057 1
1 865 . 5 1 1 A 94 94 VAL CA C 72 61.350 54.289 7.061 1
1 866 . 5 1 1 A 94 94 VAL CB C 72 34.640 35.400 -0.760 1
1 868 . 5 1 1 A 94 94 VAL N N 72 128.650 114.897 13.753 1
1 869 . 5 1 1 A 95 95 ILE H H 73 8.150 8.290 -0.140 1
1 870 . 5 1 1 A 95 95 ILE HA H 73 4.500 4.619 -0.119 1
1 880 . 5 1 1 A 95 95 ILE C C 73 174.320 175.808 -1.488 1
1 881 . 5 1 1 A 95 95 ILE CA C 73 60.170 60.575 -0.405 1
1 882 . 5 1 1 A 95 95 ILE CB C 73 38.120 38.972 -0.852 1
1 886 . 5 1 1 A 95 95 ILE N N 73 125.560 119.451 6.109 1
1 887 . 5 1 1 A 96 96 LYS H H 74 9.280 8.520 0.760 1
1 888 . 5 1 1 A 96 96 LYS HA H 74 4.240 4.448 -0.208 1
1 891 . 5 1 1 A 96 96 LYS C C 74 173.510 176.262 -2.752 1
1 892 . 5 1 1 A 96 96 LYS CA C 74 56.730 54.080 2.650 1
1 893 . 5 1 1 A 96 96 LYS CB C 74 33.100 42.522 -9.422 1
1 894 . 5 1 1 A 96 96 LYS N N 74 129.290 126.684 2.606 1
1 895 . 5 1 1 A 97 97 THR H H 75 8.040 8.439 -0.399 1
1 896 . 5 1 1 A 97 97 THR HA H 75 4.230 4.852 -0.622 1
1 901 . 5 1 1 A 97 97 THR C C 75 171.800 177.030 -5.230 1
1 902 . 5 1 1 A 97 97 THR CA C 75 61.760 54.513 7.247 1
1 903 . 5 1 1 A 97 97 THR CB C 75 69.830 34.995 34.835 1
1 905 . 5 1 1 A 97 97 THR N N 75 114.420 121.620 -7.200 1
1 906 . 5 1 1 A 98 98 GLN H H 76 8.400 9.158 -0.758 1
1 907 . 5 1 1 A 98 98 GLN HA H 76 4.210 4.491 -0.281 1
1 914 . 5 1 1 A 98 98 GLN CA C 76 55.880 56.120 -0.240 1
1 915 . 5 1 1 A 98 98 GLN CB C 76 29.700 40.135 -10.435 1
1 917 . 5 1 1 A 98 98 GLN N N 76 122.370 121.680 0.690 1
1 919 . 5 1 1 A 99 99 ASN HA H 77 4.590 4.185 0.405 1
1 924 . 5 1 1 A 99 99 ASN C C 77 171.780 175.112 -3.332 1
1 925 . 5 1 1 A 99 99 ASN CA C 77 53.300 57.505 -4.205 1
1 926 . 5 1 1 A 99 99 ASN CB C 77 38.920 27.625 11.295 1
1 928 . 5 1 1 A 100 100 ARG H H 78 8.160 7.692 0.468 1
1 929 . 5 1 1 A 100 100 ARG HA H 78 4.560 5.165 -0.605 1
1 936 . 5 1 1 A 100 100 ARG CA C 78 53.860 51.848 2.012 1
1 937 . 5 1 1 A 100 100 ARG CB C 78 30.210 42.938 -12.728 1
1 940 . 5 1 1 A 100 100 ARG N N 78 122.840 117.301 5.539 1
1 941 . 5 1 1 A 101 101 PRO HA H 79 4.150 4.935 -0.785 1
1 948 . 5 1 1 A 101 101 PRO CA C 79 64.770 59.398 5.372 1
1 949 . 5 1 1 A 101 101 PRO CB C 79 32.040 72.012 -39.972 1
1 289 . 6 1 1 A 46 46 SER H H 24 8.950 8.464 0.486 1
1 290 . 6 1 1 A 46 46 SER HA H 24 4.900 4.502 0.398 1
1 293 . 6 1 1 A 46 46 SER C C 24 170.890 176.137 -5.247 1
1 294 . 6 1 1 A 46 46 SER CA C 24 56.980 55.970 1.010 1
1 295 . 6 1 1 A 46 46 SER CB C 24 65.590 33.438 32.152 1
1 296 . 6 1 1 A 46 46 SER N N 24 120.420 121.098 -0.678 1
1 297 . 6 1 1 A 47 47 VAL H H 25 9.140 8.277 0.863 1
1 298 . 6 1 1 A 47 47 VAL HA H 25 3.440 4.493 -1.053 1
1 306 . 6 1 1 A 47 47 VAL C C 25 175.060 175.545 -0.485 1
1 307 . 6 1 1 A 47 47 VAL CA C 25 67.250 60.786 6.464 1
1 308 . 6 1 1 A 47 47 VAL CB C 25 30.780 39.843 -9.063 1
1 311 . 6 1 1 A 47 47 VAL N N 25 123.970 126.322 -2.352 1
1 312 . 6 1 1 A 48 48 GLN H H 26 8.540 8.610 -0.070 1
1 313 . 6 1 1 A 48 48 GLN HA H 26 4.070 4.664 -0.594 1
1 320 . 6 1 1 A 48 48 GLN CA C 26 60.230 55.224 5.006 1
1 321 . 6 1 1 A 48 48 GLN CB C 26 28.490 33.101 -4.611 1
1 323 . 6 1 1 A 48 48 GLN N N 26 120.550 127.966 -7.416 1
1 325 . 6 1 1 A 49 49 GLN HA H 27 3.950 4.925 -0.975 1
1 332 . 6 1 1 A 49 49 GLN C C 27 176.230 175.335 0.895 1
1 333 . 6 1 1 A 49 49 GLN CA C 27 58.710 55.910 2.800 1
1 334 . 6 1 1 A 49 49 GLN CB C 27 28.820 32.221 -3.401 1
1 337 . 6 1 1 A 50 50 PHE H H 28 8.050 8.673 -0.623 1
1 338 . 6 1 1 A 50 50 PHE HA H 28 4.620 4.679 -0.059 1
1 345 . 6 1 1 A 50 50 PHE C C 28 175.190 175.362 -0.172 1
1 346 . 6 1 1 A 50 50 PHE CA C 28 58.030 61.825 -3.795 1
1 347 . 6 1 1 A 50 50 PHE CB C 28 39.190 32.233 6.957 1
1 350 . 6 1 1 A 50 50 PHE N N 28 121.710 125.277 -3.567 1
1 351 . 6 1 1 A 51 51 LYS H H 29 8.940 8.484 0.456 1
1 352 . 6 1 1 A 51 51 LYS HA H 29 3.340 4.704 -1.364 1
1 361 . 6 1 1 A 51 51 LYS C C 29 175.370 174.392 0.978 1
1 362 . 6 1 1 A 51 51 LYS CA C 29 60.660 62.728 -2.068 1
1 363 . 6 1 1 A 51 51 LYS CB C 29 33.190 70.039 -36.849 1
1 367 . 6 1 1 A 51 51 LYS N N 29 117.530 123.608 -6.078 1
1 368 . 6 1 1 A 52 52 GLU H H 30 7.700 9.156 -1.456 1
1 369 . 6 1 1 A 52 52 GLU HA H 30 3.750 4.710 -0.960 1
1 374 . 6 1 1 A 52 52 GLU C C 30 176.780 174.182 2.598 1
1 375 . 6 1 1 A 52 52 GLU CA C 30 59.890 61.361 -1.471 1
1 376 . 6 1 1 A 52 52 GLU CB C 30 28.840 33.939 -5.099 1
1 378 . 6 1 1 A 52 52 GLU N N 30 118.820 127.452 -8.632 1
1 379 . 6 1 1 A 53 53 GLU H H 31 7.370 9.070 -1.700 1
1 380 . 6 1 1 A 53 53 GLU HA H 31 4.150 5.006 -0.856 1
1 385 . 6 1 1 A 53 53 GLU C C 31 177.040 175.953 1.087 1
1 386 . 6 1 1 A 53 53 GLU CA C 31 58.860 55.013 3.847 1
1 387 . 6 1 1 A 53 53 GLU CB C 31 29.200 34.065 -4.865 1
1 389 . 6 1 1 A 53 53 GLU N N 31 119.150 129.309 -10.159 1
1 390 . 6 1 1 A 54 54 ILE H H 32 8.000 8.774 -0.774 1
1 391 . 6 1 1 A 54 54 ILE HA H 32 3.550 4.912 -1.362 1
1 401 . 6 1 1 A 54 54 ILE C C 32 175.420 173.744 1.676 1
1 402 . 6 1 1 A 54 54 ILE CA C 32 64.690 58.637 6.053 1
1 403 . 6 1 1 A 54 54 ILE CB C 32 37.820 70.142 -32.322 1
1 407 . 6 1 1 A 54 54 ILE N N 32 119.970 116.945 3.025 1
1 409 . 6 1 1 A 55 55 SER HA H 33 3.930 4.546 -0.616 1
1 412 . 6 1 1 A 55 55 SER C C 33 173.830 175.977 -2.147 1
1 413 . 6 1 1 A 55 55 SER CA C 33 61.620 63.233 -1.613 1
1 414 . 6 1 1 A 55 55 SER CB C 33 62.720 30.576 32.144 1
1 415 . 6 1 1 A 55 55 SER N N 33 115.780 135.607 -19.827 1
1 416 . 6 1 1 A 56 56 LYS H H 34 7.150 7.787 -0.637 1
1 417 . 6 1 1 A 56 56 LYS HA H 34 4.090 4.559 -0.469 1
1 424 . 6 1 1 A 56 56 LYS C C 34 176.080 176.418 -0.338 1
1 425 . 6 1 1 A 56 56 LYS CA C 34 58.950 57.045 1.905 1
1 426 . 6 1 1 A 56 56 LYS CB C 34 32.540 35.054 -2.514 1
1 429 . 6 1 1 A 56 56 LYS N N 34 119.100 118.886 0.214 1
1 430 . 6 1 1 A 57 57 ARG H H 35 7.530 8.039 -0.509 1
1 431 . 6 1 1 A 57 57 ARG HA H 35 4.110 4.673 -0.563 1
1 436 . 6 1 1 A 57 57 ARG C C 35 174.800 174.127 0.673 1
1 437 . 6 1 1 A 57 57 ARG CA C 35 57.090 55.582 1.508 1
1 438 . 6 1 1 A 57 57 ARG CB C 35 29.810 30.966 -1.156 1
1 440 . 6 1 1 A 57 57 ARG N N 35 119.370 114.478 4.892 1
1 441 . 6 1 1 A 58 58 PHE H H 36 8.320 8.737 -0.417 1
1 442 . 6 1 1 A 58 58 PHE HA H 36 4.340 5.680 -1.340 1
1 449 . 6 1 1 A 58 58 PHE C C 36 171.940 175.017 -3.077 1
1 450 . 6 1 1 A 58 58 PHE CA C 36 58.500 54.827 3.673 1
1 451 . 6 1 1 A 58 58 PHE CB C 36 38.130 36.244 1.886 1
1 454 . 6 1 1 A 58 58 PHE N N 36 113.980 117.556 -3.576 1
1 455 . 6 1 1 A 59 59 LYS H H 37 7.790 9.013 -1.223 1
1 456 . 6 1 1 A 59 59 LYS HA H 37 3.960 4.941 -0.981 1
1 463 . 6 1 1 A 59 59 LYS C C 37 172.670 174.145 -1.475 1
1 464 . 6 1 1 A 59 59 LYS CA C 37 57.140 54.338 2.802 1
1 465 . 6 1 1 A 59 59 LYS CB C 37 29.020 32.678 -3.658 1
1 468 . 6 1 1 A 59 59 LYS N N 37 118.810 122.111 -3.301 1
1 469 . 6 1 1 A 60 60 SER H H 38 7.750 8.502 -0.752 1
1 470 . 6 1 1 A 60 60 SER HA H 38 4.700 4.780 -0.080 1
1 473 . 6 1 1 A 60 60 SER C C 38 170.170 175.302 -5.132 1
1 474 . 6 1 1 A 60 60 SER CA C 38 57.130 54.971 2.159 1
1 475 . 6 1 1 A 60 60 SER CB C 38 66.820 31.511 35.309 1
1 476 . 6 1 1 A 60 60 SER N N 38 112.620 123.465 -10.845 1
1 477 . 6 1 1 A 61 61 HIS H H 39 8.630 9.399 -0.769 1
1 478 . 6 1 1 A 61 61 HIS N N 39 124.090 126.074 -1.984 1
1 479 . 6 1 1 A 62 62 THR HA H 40 3.610 5.407 -1.797 1
1 484 . 6 1 1 A 62 62 THR C C 40 174.350 175.837 -1.487 1
1 485 . 6 1 1 A 62 62 THR CA C 40 66.160 50.961 15.199 1
1 486 . 6 1 1 A 62 62 THR CB C 40 68.070 21.247 46.823 1
1 488 . 6 1 1 A 63 63 ASP H H 41 10.310 8.882 1.428 1
1 489 . 6 1 1 A 63 63 ASP HA H 41 4.420 4.941 -0.521 1
1 492 . 6 1 1 A 63 63 ASP C C 41 174.630 174.832 -0.202 1
1 493 . 6 1 1 A 63 63 ASP CA C 41 56.330 58.049 -1.719 1
1 494 . 6 1 1 A 63 63 ASP CB C 41 40.040 34.686 5.354 1
1 495 . 6 1 1 A 63 63 ASP N N 41 122.900 117.836 5.064 1
1 497 . 6 1 1 A 64 64 GLN HA H 42 4.270 4.570 -0.300 1
1 504 . 6 1 1 A 64 64 GLN C C 42 172.160 177.643 -5.483 1
1 505 . 6 1 1 A 64 64 GLN CA C 42 55.860 63.136 -7.276 1
1 506 . 6 1 1 A 64 64 GLN CB C 42 30.480 31.088 -0.608 1
1 508 . 6 1 1 A 64 64 GLN N N 42 115.750 137.802 -22.052 1
1 510 . 6 1 1 A 65 65 LEU H H 43 7.250 8.144 -0.894 1
1 511 . 6 1 1 A 65 65 LEU HA H 43 4.440 4.006 0.434 1
1 517 . 6 1 1 A 65 65 LEU C C 43 173.160 176.410 -3.250 1
1 518 . 6 1 1 A 65 65 LEU CA C 43 54.620 57.559 -2.939 1
1 519 . 6 1 1 A 65 65 LEU CB C 43 41.990 27.473 14.517 1
1 521 . 6 1 1 A 65 65 LEU N N 43 116.570 118.005 -1.435 1
1 522 . 6 1 1 A 66 66 VAL H H 44 8.690 7.930 0.760 1
1 523 . 6 1 1 A 66 66 VAL HA H 44 3.980 4.857 -0.877 1
1 528 . 6 1 1 A 66 66 VAL C C 44 171.340 175.710 -4.370 1
1 529 . 6 1 1 A 66 66 VAL CA C 44 61.910 54.874 7.036 1
1 530 . 6 1 1 A 66 66 VAL CB C 44 33.630 39.432 -5.802 1
1 532 . 6 1 1 A 66 66 VAL N N 44 125.260 118.819 6.441 1
1 533 . 6 1 1 A 67 67 LEU H H 45 8.570 7.787 0.783 1
1 534 . 6 1 1 A 67 67 LEU HA H 45 5.220 4.811 0.409 1
1 544 . 6 1 1 A 67 67 LEU C C 45 172.500 174.195 -1.695 1
1 545 . 6 1 1 A 67 67 LEU CA C 45 52.820 60.102 -7.282 1
1 546 . 6 1 1 A 67 67 LEU CB C 45 45.310 63.521 -18.211 1
1 550 . 6 1 1 A 67 67 LEU N N 45 126.690 116.692 9.998 1
1 551 . 6 1 1 A 68 68 ILE H H 46 9.040 8.386 0.654 1
1 552 . 6 1 1 A 68 68 ILE HA H 46 4.880 4.686 0.194 1
1 562 . 6 1 1 A 68 68 ILE C C 46 172.390 176.162 -3.772 1
1 563 . 6 1 1 A 68 68 ILE CA C 46 59.900 57.610 2.290 1
1 564 . 6 1 1 A 68 68 ILE CB C 46 41.940 65.201 -23.261 1
1 568 . 6 1 1 A 68 68 ILE N N 46 122.590 121.439 1.151 1
1 569 . 6 1 1 A 69 69 PHE H H 47 8.740 8.438 0.302 1
1 570 . 6 1 1 A 69 69 PHE N N 47 125.360 121.773 3.587 1
1 571 . 6 1 1 A 70 70 ALA HA H 48 3.600 4.011 -0.411 1
1 575 . 6 1 1 A 70 70 ALA C C 48 174.500 177.700 -3.200 1
1 576 . 6 1 1 A 70 70 ALA CA C 48 52.520 58.956 -6.436 1
1 577 . 6 1 1 A 70 70 ALA CB C 48 16.760 28.172 -11.412 1
1 578 . 6 1 1 A 71 71 GLY H H 49 8.210 7.767 0.443 1
1 581 . 6 1 1 A 71 71 GLY C C 49 170.850 177.467 -6.617 1
1 582 . 6 1 1 A 71 71 GLY CA C 49 45.380 56.822 -11.442 1
1 583 . 6 1 1 A 71 71 GLY N N 49 102.430 116.927 -14.497 1
1 584 . 6 1 1 A 72 72 LYS H H 50 7.840 8.021 -0.181 1
1 585 . 6 1 1 A 72 72 LYS HA H 50 4.530 4.057 0.473 1
1 594 . 6 1 1 A 72 72 LYS C C 50 171.800 177.679 -5.879 1
1 595 . 6 1 1 A 72 72 LYS CA C 50 54.630 61.066 -6.436 1
1 596 . 6 1 1 A 72 72 LYS CB C 50 34.630 39.113 -4.483 1
1 600 . 6 1 1 A 72 72 LYS N N 50 121.570 122.549 -0.979 1
1 601 . 6 1 1 A 73 73 ILE H H 51 8.250 8.182 0.068 1
1 602 . 6 1 1 A 73 73 ILE HA H 51 4.260 3.873 0.387 1
1 612 . 6 1 1 A 73 73 ILE C C 51 174.300 178.185 -3.885 1
1 613 . 6 1 1 A 73 73 ILE CA C 51 61.270 58.220 3.050 1
1 614 . 6 1 1 A 73 73 ILE CB C 51 38.150 31.181 6.969 1
1 618 . 6 1 1 A 73 73 ILE N N 51 122.710 117.905 4.805 1
1 619 . 6 1 1 A 74 74 LEU H H 52 8.540 8.325 0.215 1
1 620 . 6 1 1 A 74 74 LEU HA H 52 3.980 4.005 -0.025 1
1 630 . 6 1 1 A 74 74 LEU C C 52 173.440 179.250 -5.810 1
1 631 . 6 1 1 A 74 74 LEU CA C 52 54.660 58.887 -4.227 1
1 632 . 6 1 1 A 74 74 LEU CB C 52 41.790 29.351 12.439 1
1 636 . 6 1 1 A 74 74 LEU N N 52 128.360 118.948 9.412 1
1 637 . 6 1 1 A 75 75 LYS H H 53 8.100 7.478 0.622 1
1 638 . 6 1 1 A 75 75 LYS HA H 53 4.440 4.060 0.380 1
1 645 . 6 1 1 A 75 75 LYS C C 53 175.170 179.190 -4.020 1
1 646 . 6 1 1 A 75 75 LYS CA C 53 55.340 58.923 -3.583 1
1 647 . 6 1 1 A 75 75 LYS CB C 53 32.680 28.975 3.705 1
1 650 . 6 1 1 A 75 75 LYS N N 53 123.470 119.823 3.647 1
1 651 . 6 1 1 A 76 76 ASP H H 54 8.310 7.406 0.904 1
1 652 . 6 1 1 A 76 76 ASP HA H 54 4.110 3.807 0.303 1
1 655 . 6 1 1 A 76 76 ASP C C 54 174.270 178.383 -4.113 1
1 656 . 6 1 1 A 76 76 ASP CA C 54 58.140 65.480 -7.340 1
1 657 . 6 1 1 A 76 76 ASP CB C 54 40.760 37.530 3.230 1
1 658 . 6 1 1 A 76 76 ASP N N 54 121.080 121.390 -0.310 1
1 659 . 6 1 1 A 77 77 GLN H H 55 8.180 7.921 0.259 1
1 660 . 6 1 1 A 77 77 GLN HA H 55 4.360 4.356 0.004 1
1 667 . 6 1 1 A 77 77 GLN C C 55 173.710 175.728 -2.018 1
1 668 . 6 1 1 A 77 77 GLN CA C 55 56.350 61.183 -4.833 1
1 669 . 6 1 1 A 77 77 GLN CB C 55 28.090 62.800 -34.710 1
1 671 . 6 1 1 A 77 77 GLN N N 55 113.190 115.289 -2.099 1
1 673 . 6 1 1 A 78 78 ASP H H 56 7.770 8.100 -0.330 1
1 674 . 6 1 1 A 78 78 ASP HA H 56 4.700 4.146 0.554 1
1 677 . 6 1 1 A 78 78 ASP C C 56 173.500 178.707 -5.207 1
1 678 . 6 1 1 A 78 78 ASP CA C 56 54.140 58.780 -4.640 1
1 679 . 6 1 1 A 78 78 ASP CB C 56 42.020 32.456 9.564 1
1 680 . 6 1 1 A 78 78 ASP N N 56 121.910 121.696 0.214 1
1 681 . 6 1 1 A 79 79 THR H H 57 8.490 7.612 0.878 1
1 682 . 6 1 1 A 79 79 THR HA H 57 4.700 3.954 0.746 1
1 687 . 6 1 1 A 79 79 THR C C 57 172.840 177.727 -4.887 1
1 688 . 6 1 1 A 79 79 THR CA C 57 59.980 59.023 0.957 1
1 689 . 6 1 1 A 79 79 THR CB C 57 70.640 30.564 40.076 1
1 691 . 6 1 1 A 79 79 THR N N 57 108.860 119.408 -10.548 1
1 692 . 6 1 1 A 80 80 LEU H H 58 7.700 7.857 -0.157 1
1 693 . 6 1 1 A 80 80 LEU HA H 58 3.880 4.619 -0.739 1
1 703 . 6 1 1 A 80 80 LEU C C 58 177.370 174.805 2.565 1
1 704 . 6 1 1 A 80 80 LEU CA C 58 58.450 57.393 1.057 1
1 705 . 6 1 1 A 80 80 LEU CB C 58 39.500 39.210 0.290 1
1 709 . 6 1 1 A 80 80 LEU N N 58 118.820 116.834 1.986 1
1 710 . 6 1 1 A 81 81 SER H H 59 8.810 7.916 0.894 1
1 711 . 6 1 1 A 81 81 SER HA H 59 4.050 4.069 -0.019 1
1 714 . 6 1 1 A 81 81 SER C C 59 176.150 174.718 1.432 1
1 715 . 6 1 1 A 81 81 SER CA C 59 61.190 57.531 3.659 1
1 716 . 6 1 1 A 81 81 SER CB C 59 62.490 29.267 33.223 1
1 717 . 6 1 1 A 81 81 SER N N 59 114.240 116.388 -2.148 1
1 718 . 6 1 1 A 82 82 GLN H H 60 7.950 7.913 0.037 1
1 719 . 6 1 1 A 82 82 GLN HA H 60 4.090 4.921 -0.831 1
1 726 . 6 1 1 A 82 82 GLN C C 60 173.930 173.699 0.231 1
1 727 . 6 1 1 A 82 82 GLN CA C 60 58.080 57.608 0.472 1
1 728 . 6 1 1 A 82 82 GLN CB C 60 28.460 65.164 -36.704 1
1 730 . 6 1 1 A 82 82 GLN N N 60 122.620 114.006 8.614 1
1 732 . 6 1 1 A 83 83 HIS H H 61 6.990 8.795 -1.805 1
1 733 . 6 1 1 A 83 83 HIS HA H 61 4.490 4.533 -0.043 1
1 736 . 6 1 1 A 83 83 HIS C C 61 172.260 176.814 -4.554 1
1 737 . 6 1 1 A 83 83 HIS CA C 61 57.110 57.029 0.081 1
1 738 . 6 1 1 A 83 83 HIS CB C 61 32.780 30.800 1.980 1
1 739 . 6 1 1 A 83 83 HIS N N 61 116.940 124.411 -7.471 1
1 740 . 6 1 1 A 84 84 GLY H H 62 7.870 8.598 -0.728 1
1 743 . 6 1 1 A 84 84 GLY C C 62 171.040 176.232 -5.192 1
1 744 . 6 1 1 A 84 84 GLY CA C 62 45.390 65.983 -20.593 1
1 745 . 6 1 1 A 84 84 GLY N N 62 106.740 121.297 -14.557 1
1 746 . 6 1 1 A 85 85 ILE H H 63 6.810 8.110 -1.300 1
1 747 . 6 1 1 A 85 85 ILE HA H 63 3.050 4.513 -1.463 1
1 757 . 6 1 1 A 85 85 ILE C C 63 170.130 177.699 -7.569 1
1 758 . 6 1 1 A 85 85 ILE CA C 63 62.440 57.224 5.216 1
1 759 . 6 1 1 A 85 85 ILE CB C 63 36.110 41.882 -5.772 1
1 763 . 6 1 1 A 85 85 ILE N N 63 118.920 122.712 -3.792 1
1 764 . 6 1 1 A 86 86 HIS H H 64 6.020 7.670 -1.650 1
1 765 . 6 1 1 A 86 86 HIS HA H 64 5.030 4.401 0.629 1
1 768 . 6 1 1 A 86 86 HIS C C 64 170.090 175.361 -5.271 1
1 769 . 6 1 1 A 86 86 HIS CA C 64 53.500 56.156 -2.656 1
1 770 . 6 1 1 A 86 86 HIS CB C 64 31.860 29.335 2.525 1
1 771 . 6 1 1 A 86 86 HIS N N 64 122.440 115.516 6.924 1
1 772 . 6 1 1 A 87 87 ASP H H 65 8.340 7.367 0.973 1
1 773 . 6 1 1 A 87 87 ASP HA H 65 4.320 5.151 -0.831 1
1 776 . 6 1 1 A 87 87 ASP C C 65 174.370 175.809 -1.439 1
1 777 . 6 1 1 A 87 87 ASP CA C 65 56.440 52.835 3.605 1
1 778 . 6 1 1 A 87 87 ASP CB C 65 43.150 45.021 -1.871 1
1 779 . 6 1 1 A 87 87 ASP N N 65 116.230 116.731 -0.501 1
1 780 . 6 1 1 A 88 88 GLY H H 66 9.330 8.715 0.615 1
1 783 . 6 1 1 A 88 88 GLY C C 66 172.330 174.365 -2.035 1
1 784 . 6 1 1 A 88 88 GLY CA C 66 45.270 59.496 -14.226 1
1 785 . 6 1 1 A 88 88 GLY N N 66 112.300 119.396 -7.096 1
1 786 . 6 1 1 A 89 89 LEU H H 67 7.640 8.718 -1.078 1
1 787 . 6 1 1 A 89 89 LEU HA H 67 4.720 4.484 0.236 1
1 797 . 6 1 1 A 89 89 LEU C C 67 172.460 175.796 -3.336 1
1 798 . 6 1 1 A 89 89 LEU CA C 67 54.420 54.437 -0.017 1
1 799 . 6 1 1 A 89 89 LEU CB C 67 42.260 42.461 -0.201 1
1 803 . 6 1 1 A 89 89 LEU N N 67 120.310 126.808 -6.498 1
1 804 . 6 1 1 A 90 90 THR H H 68 8.110 8.672 -0.562 1
1 805 . 6 1 1 A 90 90 THR HA H 68 5.300 5.473 -0.173 1
1 810 . 6 1 1 A 90 90 THR C C 68 170.900 174.922 -4.022 1
1 811 . 6 1 1 A 90 90 THR CA C 68 61.870 60.217 1.653 1
1 812 . 6 1 1 A 90 90 THR CB C 68 71.320 40.795 30.525 1
1 814 . 6 1 1 A 90 90 THR N N 68 115.300 121.467 -6.167 1
1 815 . 6 1 1 A 91 91 VAL H H 69 9.290 8.973 0.317 1
1 816 . 6 1 1 A 91 91 VAL HA H 69 4.540 4.749 -0.209 1
1 824 . 6 1 1 A 91 91 VAL C C 69 170.890 174.508 -3.618 1
1 825 . 6 1 1 A 91 91 VAL CA C 69 60.310 58.048 2.262 1
1 826 . 6 1 1 A 91 91 VAL CB C 69 34.680 42.244 -7.564 1
1 829 . 6 1 1 A 91 91 VAL N N 69 124.200 126.682 -2.482 1
1 830 . 6 1 1 A 92 92 HIS H H 70 8.750 8.679 0.071 1
1 831 . 6 1 1 A 92 92 HIS HA H 70 5.020 3.985 1.035 1
1 835 . 6 1 1 A 92 92 HIS C C 70 170.890 177.209 -6.319 1
1 836 . 6 1 1 A 92 92 HIS CA C 70 56.750 53.357 3.393 1
1 837 . 6 1 1 A 92 92 HIS CB C 70 32.220 18.111 14.109 1
1 839 . 6 1 1 A 92 92 HIS N N 70 125.250 128.846 -3.596 1
1 840 . 6 1 1 A 93 93 LEU H H 71 8.290 8.561 -0.271 1
1 851 . 6 1 1 A 93 93 LEU C C 71 172.570 173.509 -0.939 1
1 852 . 6 1 1 A 93 93 LEU CA C 71 52.820 45.491 7.329 1
1 857 . 6 1 1 A 93 93 LEU N N 71 123.360 102.895 20.465 1
1 858 . 6 1 1 A 94 94 VAL H H 72 9.110 7.253 1.857 1
1 859 . 6 1 1 A 94 94 VAL HA H 72 4.080 4.861 -0.781 1
1 864 . 6 1 1 A 94 94 VAL C C 72 171.160 175.145 -3.985 1
1 865 . 6 1 1 A 94 94 VAL CA C 72 61.350 54.444 6.906 1
1 866 . 6 1 1 A 94 94 VAL CB C 72 34.640 35.354 -0.714 1
1 868 . 6 1 1 A 94 94 VAL N N 72 128.650 114.970 13.680 1
1 869 . 6 1 1 A 95 95 ILE H H 73 8.150 8.248 -0.098 1
1 870 . 6 1 1 A 95 95 ILE HA H 73 4.500 4.392 0.108 1
1 880 . 6 1 1 A 95 95 ILE C C 73 174.320 175.716 -1.396 1
1 881 . 6 1 1 A 95 95 ILE CA C 73 60.170 61.257 -1.087 1
1 882 . 6 1 1 A 95 95 ILE CB C 73 38.120 38.068 0.052 1
1 886 . 6 1 1 A 95 95 ILE N N 73 125.560 118.886 6.674 1
1 887 . 6 1 1 A 96 96 LYS H H 74 9.280 8.712 0.568 1
1 888 . 6 1 1 A 96 96 LYS HA H 74 4.240 4.266 -0.026 1
1 891 . 6 1 1 A 96 96 LYS C C 74 173.510 176.769 -3.259 1
1 892 . 6 1 1 A 96 96 LYS CA C 74 56.730 54.855 1.875 1
1 893 . 6 1 1 A 96 96 LYS CB C 74 33.100 41.975 -8.875 1
1 894 . 6 1 1 A 96 96 LYS N N 74 129.290 128.513 0.777 1
1 895 . 6 1 1 A 97 97 THR H H 75 8.040 8.622 -0.582 1
1 896 . 6 1 1 A 97 97 THR HA H 75 4.230 4.713 -0.483 1
1 901 . 6 1 1 A 97 97 THR C C 75 171.800 177.164 -5.364 1
1 902 . 6 1 1 A 97 97 THR CA C 75 61.760 54.428 7.332 1
1 903 . 6 1 1 A 97 97 THR CB C 75 69.830 34.821 35.009 1
1 905 . 6 1 1 A 97 97 THR N N 75 114.420 124.273 -9.853 1
1 906 . 6 1 1 A 98 98 GLN H H 76 8.400 8.997 -0.597 1
1 907 . 6 1 1 A 98 98 GLN HA H 76 4.210 4.416 -0.206 1
1 914 . 6 1 1 A 98 98 GLN CA C 76 55.880 56.654 -0.774 1
1 915 . 6 1 1 A 98 98 GLN CB C 76 29.700 39.882 -10.182 1
1 917 . 6 1 1 A 98 98 GLN N N 76 122.370 121.116 1.254 1
1 919 . 6 1 1 A 99 99 ASN HA H 77 4.590 4.256 0.334 1
1 924 . 6 1 1 A 99 99 ASN C C 77 171.780 175.515 -3.735 1
1 925 . 6 1 1 A 99 99 ASN CA C 77 53.300 57.062 -3.762 1
1 926 . 6 1 1 A 99 99 ASN CB C 77 38.920 28.104 10.816 1
1 928 . 6 1 1 A 100 100 ARG H H 78 8.160 7.714 0.446 1
1 929 . 6 1 1 A 100 100 ARG HA H 78 4.560 5.244 -0.684 1
1 936 . 6 1 1 A 100 100 ARG CA C 78 53.860 52.526 1.334 1
1 937 . 6 1 1 A 100 100 ARG CB C 78 30.210 43.004 -12.794 1
1 940 . 6 1 1 A 100 100 ARG N N 78 122.840 120.391 2.449 1
1 941 . 6 1 1 A 101 101 PRO HA H 79 4.150 4.975 -0.825 1
1 948 . 6 1 1 A 101 101 PRO CA C 79 64.770 59.225 5.545 1
1 949 . 6 1 1 A 101 101 PRO CB C 79 32.040 71.759 -39.719 1
1 289 . 7 1 1 A 46 46 SER H H 24 8.950 8.438 0.512 1
1 290 . 7 1 1 A 46 46 SER HA H 24 4.900 4.510 0.390 1
1 293 . 7 1 1 A 46 46 SER C C 24 170.890 176.156 -5.266 1
1 294 . 7 1 1 A 46 46 SER CA C 24 56.980 56.059 0.921 1
1 295 . 7 1 1 A 46 46 SER CB C 24 65.590 33.391 32.199 1
1 296 . 7 1 1 A 46 46 SER N N 24 120.420 121.334 -0.914 1
1 297 . 7 1 1 A 47 47 VAL H H 25 9.140 8.293 0.847 1
1 298 . 7 1 1 A 47 47 VAL HA H 25 3.440 4.319 -0.879 1
1 306 . 7 1 1 A 47 47 VAL C C 25 175.060 176.180 -1.120 1
1 307 . 7 1 1 A 47 47 VAL CA C 25 67.250 61.147 6.103 1
1 308 . 7 1 1 A 47 47 VAL CB C 25 30.780 39.618 -8.838 1
1 311 . 7 1 1 A 47 47 VAL N N 25 123.970 126.204 -2.234 1
1 312 . 7 1 1 A 48 48 GLN H H 26 8.540 8.799 -0.259 1
1 313 . 7 1 1 A 48 48 GLN HA H 26 4.070 4.792 -0.722 1
1 320 . 7 1 1 A 48 48 GLN CA C 26 60.230 53.806 6.424 1
1 321 . 7 1 1 A 48 48 GLN CB C 26 28.490 32.452 -3.962 1
1 323 . 7 1 1 A 48 48 GLN N N 26 120.550 125.760 -5.210 1
1 325 . 7 1 1 A 49 49 GLN HA H 27 3.950 4.980 -1.030 1
1 332 . 7 1 1 A 49 49 GLN C C 27 176.230 175.356 0.874 1
1 333 . 7 1 1 A 49 49 GLN CA C 27 58.710 55.845 2.865 1
1 334 . 7 1 1 A 49 49 GLN CB C 27 28.820 31.891 -3.071 1
1 337 . 7 1 1 A 50 50 PHE H H 28 8.050 8.606 -0.556 1
1 338 . 7 1 1 A 50 50 PHE HA H 28 4.620 4.525 0.095 1
1 345 . 7 1 1 A 50 50 PHE C C 28 175.190 175.621 -0.431 1
1 346 . 7 1 1 A 50 50 PHE CA C 28 58.030 61.740 -3.710 1
1 347 . 7 1 1 A 50 50 PHE CB C 28 39.190 32.258 6.932 1
1 350 . 7 1 1 A 50 50 PHE N N 28 121.710 125.154 -3.444 1
1 351 . 7 1 1 A 51 51 LYS H H 29 8.940 8.437 0.503 1
1 352 . 7 1 1 A 51 51 LYS HA H 29 3.340 4.924 -1.584 1
1 361 . 7 1 1 A 51 51 LYS C C 29 175.370 174.432 0.938 1
1 362 . 7 1 1 A 51 51 LYS CA C 29 60.660 62.704 -2.044 1
1 363 . 7 1 1 A 51 51 LYS CB C 29 33.190 70.002 -36.812 1
1 367 . 7 1 1 A 51 51 LYS N N 29 117.530 122.699 -5.169 1
1 368 . 7 1 1 A 52 52 GLU H H 30 7.700 9.263 -1.563 1
1 369 . 7 1 1 A 52 52 GLU HA H 30 3.750 4.888 -1.138 1
1 374 . 7 1 1 A 52 52 GLU C C 30 176.780 174.229 2.551 1
1 375 . 7 1 1 A 52 52 GLU CA C 30 59.890 61.074 -1.184 1
1 376 . 7 1 1 A 52 52 GLU CB C 30 28.840 35.138 -6.298 1
1 378 . 7 1 1 A 52 52 GLU N N 30 118.820 126.476 -7.656 1
1 379 . 7 1 1 A 53 53 GLU H H 31 7.370 9.164 -1.794 1
1 380 . 7 1 1 A 53 53 GLU HA H 31 4.150 4.947 -0.797 1
1 385 . 7 1 1 A 53 53 GLU C C 31 177.040 176.105 0.935 1
1 386 . 7 1 1 A 53 53 GLU CA C 31 58.860 55.083 3.777 1
1 387 . 7 1 1 A 53 53 GLU CB C 31 29.200 33.837 -4.637 1
1 389 . 7 1 1 A 53 53 GLU N N 31 119.150 128.849 -9.699 1
1 390 . 7 1 1 A 54 54 ILE H H 32 8.000 8.472 -0.472 1
1 391 . 7 1 1 A 54 54 ILE HA H 32 3.550 5.148 -1.598 1
1 401 . 7 1 1 A 54 54 ILE C C 32 175.420 174.047 1.373 1
1 402 . 7 1 1 A 54 54 ILE CA C 32 64.690 58.434 6.256 1
1 403 . 7 1 1 A 54 54 ILE CB C 32 37.820 69.518 -31.698 1
1 407 . 7 1 1 A 54 54 ILE N N 32 119.970 117.950 2.020 1
1 409 . 7 1 1 A 55 55 SER HA H 33 3.930 4.445 -0.515 1
1 412 . 7 1 1 A 55 55 SER C C 33 173.830 178.400 -4.570 1
1 413 . 7 1 1 A 55 55 SER CA C 33 61.620 64.644 -3.024 1
1 414 . 7 1 1 A 55 55 SER CB C 33 62.720 31.830 30.890 1
1 415 . 7 1 1 A 55 55 SER N N 33 115.780 137.145 -21.365 1
1 416 . 7 1 1 A 56 56 LYS H H 34 7.150 8.690 -1.540 1
1 417 . 7 1 1 A 56 56 LYS HA H 34 4.090 4.171 -0.081 1
1 424 . 7 1 1 A 56 56 LYS C C 34 176.080 176.863 -0.783 1
1 425 . 7 1 1 A 56 56 LYS CA C 34 58.950 59.022 -0.072 1
1 426 . 7 1 1 A 56 56 LYS CB C 34 32.540 33.378 -0.838 1
1 429 . 7 1 1 A 56 56 LYS N N 34 119.100 117.647 1.453 1
1 430 . 7 1 1 A 57 57 ARG H H 35 7.530 7.707 -0.177 1
1 431 . 7 1 1 A 57 57 ARG HA H 35 4.110 4.735 -0.625 1
1 436 . 7 1 1 A 57 57 ARG C C 35 174.800 174.135 0.665 1
1 437 . 7 1 1 A 57 57 ARG CA C 35 57.090 55.470 1.620 1
1 438 . 7 1 1 A 57 57 ARG CB C 35 29.810 31.305 -1.495 1
1 440 . 7 1 1 A 57 57 ARG N N 35 119.370 113.202 6.168 1
1 441 . 7 1 1 A 58 58 PHE H H 36 8.320 8.629 -0.309 1
1 442 . 7 1 1 A 58 58 PHE HA H 36 4.340 5.301 -0.961 1
1 449 . 7 1 1 A 58 58 PHE C C 36 171.940 174.998 -3.058 1
1 450 . 7 1 1 A 58 58 PHE CA C 36 58.500 55.134 3.366 1
1 451 . 7 1 1 A 58 58 PHE CB C 36 38.130 35.125 3.005 1
1 454 . 7 1 1 A 58 58 PHE N N 36 113.980 119.204 -5.224 1
1 455 . 7 1 1 A 59 59 LYS H H 37 7.790 8.633 -0.843 1
1 456 . 7 1 1 A 59 59 LYS HA H 37 3.960 4.823 -0.863 1
1 463 . 7 1 1 A 59 59 LYS C C 37 172.670 173.613 -0.943 1
1 464 . 7 1 1 A 59 59 LYS CA C 37 57.140 55.086 2.054 1
1 465 . 7 1 1 A 59 59 LYS CB C 37 29.020 33.909 -4.889 1
1 468 . 7 1 1 A 59 59 LYS N N 37 118.810 120.233 -1.423 1
1 469 . 7 1 1 A 60 60 SER H H 38 7.750 8.551 -0.801 1
1 470 . 7 1 1 A 60 60 SER HA H 38 4.700 5.233 -0.533 1
1 473 . 7 1 1 A 60 60 SER C C 38 170.170 174.820 -4.650 1
1 474 . 7 1 1 A 60 60 SER CA C 38 57.130 54.961 2.169 1
1 475 . 7 1 1 A 60 60 SER CB C 38 66.820 33.339 33.481 1
1 476 . 7 1 1 A 60 60 SER N N 38 112.620 125.405 -12.785 1
1 477 . 7 1 1 A 61 61 HIS H H 39 8.630 9.179 -0.549 1
1 478 . 7 1 1 A 61 61 HIS N N 39 124.090 124.157 -0.067 1
1 479 . 7 1 1 A 62 62 THR HA H 40 3.610 5.473 -1.863 1
1 484 . 7 1 1 A 62 62 THR C C 40 174.350 175.992 -1.642 1
1 485 . 7 1 1 A 62 62 THR CA C 40 66.160 50.911 15.249 1
1 486 . 7 1 1 A 62 62 THR CB C 40 68.070 21.155 46.915 1
1 488 . 7 1 1 A 63 63 ASP H H 41 10.310 8.771 1.539 1
1 489 . 7 1 1 A 63 63 ASP HA H 41 4.420 4.957 -0.537 1
1 492 . 7 1 1 A 63 63 ASP C C 41 174.630 174.631 -0.001 1
1 493 . 7 1 1 A 63 63 ASP CA C 41 56.330 58.167 -1.837 1
1 494 . 7 1 1 A 63 63 ASP CB C 41 40.040 34.721 5.319 1
1 495 . 7 1 1 A 63 63 ASP N N 41 122.900 117.874 5.026 1
1 497 . 7 1 1 A 64 64 GLN HA H 42 4.270 4.575 -0.305 1
1 504 . 7 1 1 A 64 64 GLN C C 42 172.160 177.646 -5.486 1
1 505 . 7 1 1 A 64 64 GLN CA C 42 55.860 62.826 -6.966 1
1 506 . 7 1 1 A 64 64 GLN CB C 42 30.480 30.229 0.251 1
1 508 . 7 1 1 A 64 64 GLN N N 42 115.750 137.948 -22.198 1
1 510 . 7 1 1 A 65 65 LEU H H 43 7.250 8.240 -0.990 1
1 511 . 7 1 1 A 65 65 LEU HA H 43 4.440 4.044 0.396 1
1 517 . 7 1 1 A 65 65 LEU C C 43 173.160 175.803 -2.643 1
1 518 . 7 1 1 A 65 65 LEU CA C 43 54.620 57.567 -2.947 1
1 519 . 7 1 1 A 65 65 LEU CB C 43 41.990 27.445 14.545 1
1 521 . 7 1 1 A 65 65 LEU N N 43 116.570 117.649 -1.079 1
1 522 . 7 1 1 A 66 66 VAL H H 44 8.690 8.099 0.591 1
1 523 . 7 1 1 A 66 66 VAL HA H 44 3.980 5.033 -1.053 1
1 528 . 7 1 1 A 66 66 VAL C C 44 171.340 175.149 -3.809 1
1 529 . 7 1 1 A 66 66 VAL CA C 44 61.910 52.587 9.323 1
1 530 . 7 1 1 A 66 66 VAL CB C 44 33.630 40.742 -7.112 1
1 532 . 7 1 1 A 66 66 VAL N N 44 125.260 118.643 6.617 1
1 533 . 7 1 1 A 67 67 LEU H H 45 8.570 7.828 0.742 1
1 534 . 7 1 1 A 67 67 LEU HA H 45 5.220 4.516 0.704 1
1 544 . 7 1 1 A 67 67 LEU C C 45 172.500 174.390 -1.890 1
1 545 . 7 1 1 A 67 67 LEU CA C 45 52.820 60.052 -7.232 1
1 546 . 7 1 1 A 67 67 LEU CB C 45 45.310 63.573 -18.263 1
1 550 . 7 1 1 A 67 67 LEU N N 45 126.690 116.007 10.683 1
1 551 . 7 1 1 A 68 68 ILE H H 46 9.040 9.160 -0.120 1
1 552 . 7 1 1 A 68 68 ILE HA H 46 4.880 4.543 0.337 1
1 562 . 7 1 1 A 68 68 ILE C C 46 172.390 175.730 -3.340 1
1 563 . 7 1 1 A 68 68 ILE CA C 46 59.900 58.037 1.863 1
1 564 . 7 1 1 A 68 68 ILE CB C 46 41.940 64.439 -22.499 1
1 568 . 7 1 1 A 68 68 ILE N N 46 122.590 120.707 1.883 1
1 569 . 7 1 1 A 69 69 PHE H H 47 8.740 8.695 0.045 1
1 570 . 7 1 1 A 69 69 PHE N N 47 125.360 123.368 1.992 1
1 571 . 7 1 1 A 70 70 ALA HA H 48 3.600 3.990 -0.390 1
1 575 . 7 1 1 A 70 70 ALA C C 48 174.500 177.334 -2.834 1
1 576 . 7 1 1 A 70 70 ALA CA C 48 52.520 58.199 -5.679 1
1 577 . 7 1 1 A 70 70 ALA CB C 48 16.760 28.003 -11.243 1
1 578 . 7 1 1 A 71 71 GLY H H 49 8.210 7.710 0.500 1
1 581 . 7 1 1 A 71 71 GLY C C 49 170.850 177.584 -6.734 1
1 582 . 7 1 1 A 71 71 GLY CA C 49 45.380 56.852 -11.472 1
1 583 . 7 1 1 A 71 71 GLY N N 49 102.430 118.004 -15.574 1
1 584 . 7 1 1 A 72 72 LYS H H 50 7.840 8.012 -0.172 1
1 585 . 7 1 1 A 72 72 LYS HA H 50 4.530 4.104 0.426 1
1 594 . 7 1 1 A 72 72 LYS C C 50 171.800 177.779 -5.979 1
1 595 . 7 1 1 A 72 72 LYS CA C 50 54.630 61.124 -6.494 1
1 596 . 7 1 1 A 72 72 LYS CB C 50 34.630 38.983 -4.353 1
1 600 . 7 1 1 A 72 72 LYS N N 50 121.570 122.885 -1.315 1
1 601 . 7 1 1 A 73 73 ILE H H 51 8.250 8.329 -0.079 1
1 602 . 7 1 1 A 73 73 ILE HA H 51 4.260 3.838 0.422 1
1 612 . 7 1 1 A 73 73 ILE C C 51 174.300 178.503 -4.203 1
1 613 . 7 1 1 A 73 73 ILE CA C 51 61.270 58.364 2.906 1
1 614 . 7 1 1 A 73 73 ILE CB C 51 38.150 31.202 6.948 1
1 618 . 7 1 1 A 73 73 ILE N N 51 122.710 118.047 4.663 1
1 619 . 7 1 1 A 74 74 LEU H H 52 8.540 8.425 0.115 1
1 620 . 7 1 1 A 74 74 LEU HA H 52 3.980 4.056 -0.076 1
1 630 . 7 1 1 A 74 74 LEU C C 52 173.440 179.329 -5.889 1
1 631 . 7 1 1 A 74 74 LEU CA C 52 54.660 59.008 -4.348 1
1 632 . 7 1 1 A 74 74 LEU CB C 52 41.790 29.269 12.521 1
1 636 . 7 1 1 A 74 74 LEU N N 52 128.360 118.921 9.439 1
1 637 . 7 1 1 A 75 75 LYS H H 53 8.100 7.546 0.554 1
1 638 . 7 1 1 A 75 75 LYS HA H 53 4.440 4.138 0.302 1
1 645 . 7 1 1 A 75 75 LYS C C 53 175.170 179.447 -4.277 1
1 646 . 7 1 1 A 75 75 LYS CA C 53 55.340 59.039 -3.699 1
1 647 . 7 1 1 A 75 75 LYS CB C 53 32.680 29.178 3.502 1
1 650 . 7 1 1 A 75 75 LYS N N 53 123.470 119.594 3.876 1
1 651 . 7 1 1 A 76 76 ASP H H 54 8.310 7.303 1.007 1
1 652 . 7 1 1 A 76 76 ASP HA H 54 4.110 4.027 0.083 1
1 655 . 7 1 1 A 76 76 ASP C C 54 174.270 178.237 -3.967 1
1 656 . 7 1 1 A 76 76 ASP CA C 54 58.140 64.096 -5.956 1
1 657 . 7 1 1 A 76 76 ASP CB C 54 40.760 36.740 4.020 1
1 658 . 7 1 1 A 76 76 ASP N N 54 121.080 121.958 -0.878 1
1 659 . 7 1 1 A 77 77 GLN H H 55 8.180 8.055 0.125 1
1 660 . 7 1 1 A 77 77 GLN HA H 55 4.360 4.165 0.195 1
1 667 . 7 1 1 A 77 77 GLN C C 55 173.710 176.430 -2.720 1
1 668 . 7 1 1 A 77 77 GLN CA C 55 56.350 61.722 -5.372 1
1 669 . 7 1 1 A 77 77 GLN CB C 55 28.090 62.393 -34.303 1
1 671 . 7 1 1 A 77 77 GLN N N 55 113.190 115.721 -2.531 1
1 673 . 7 1 1 A 78 78 ASP H H 56 7.770 8.095 -0.325 1
1 674 . 7 1 1 A 78 78 ASP HA H 56 4.700 4.124 0.576 1
1 677 . 7 1 1 A 78 78 ASP C C 56 173.500 178.703 -5.203 1
1 678 . 7 1 1 A 78 78 ASP CA C 56 54.140 58.992 -4.852 1
1 679 . 7 1 1 A 78 78 ASP CB C 56 42.020 32.009 10.011 1
1 680 . 7 1 1 A 78 78 ASP N N 56 121.910 120.773 1.137 1
1 681 . 7 1 1 A 79 79 THR H H 57 8.490 7.889 0.601 1
1 682 . 7 1 1 A 79 79 THR HA H 57 4.700 4.069 0.631 1
1 687 . 7 1 1 A 79 79 THR C C 57 172.840 176.342 -3.502 1
1 688 . 7 1 1 A 79 79 THR CA C 57 59.980 58.645 1.335 1
1 689 . 7 1 1 A 79 79 THR CB C 57 70.640 31.282 39.358 1
1 691 . 7 1 1 A 79 79 THR N N 57 108.860 120.106 -11.246 1
1 692 . 7 1 1 A 80 80 LEU H H 58 7.700 8.650 -0.950 1
1 693 . 7 1 1 A 80 80 LEU HA H 58 3.880 4.730 -0.850 1
1 703 . 7 1 1 A 80 80 LEU C C 58 177.370 175.157 2.213 1
1 704 . 7 1 1 A 80 80 LEU CA C 58 58.450 56.792 1.658 1
1 705 . 7 1 1 A 80 80 LEU CB C 58 39.500 38.363 1.137 1
1 709 . 7 1 1 A 80 80 LEU N N 58 118.820 117.230 1.590 1
1 710 . 7 1 1 A 81 81 SER H H 59 8.810 8.434 0.376 1
1 711 . 7 1 1 A 81 81 SER HA H 59 4.050 4.300 -0.250 1
1 714 . 7 1 1 A 81 81 SER C C 59 176.150 175.727 0.423 1
1 715 . 7 1 1 A 81 81 SER CA C 59 61.190 56.383 4.807 1
1 716 . 7 1 1 A 81 81 SER CB C 59 62.490 30.560 31.930 1
1 717 . 7 1 1 A 81 81 SER N N 59 114.240 125.241 -11.001 1
1 718 . 7 1 1 A 82 82 GLN H H 60 7.950 8.376 -0.426 1
1 719 . 7 1 1 A 82 82 GLN HA H 60 4.090 5.077 -0.987 1
1 726 . 7 1 1 A 82 82 GLN C C 60 173.930 172.205 1.725 1
1 727 . 7 1 1 A 82 82 GLN CA C 60 58.080 57.764 0.316 1
1 728 . 7 1 1 A 82 82 GLN CB C 60 28.460 67.139 -38.679 1
1 730 . 7 1 1 A 82 82 GLN N N 60 122.620 118.783 3.837 1
1 732 . 7 1 1 A 83 83 HIS H H 61 6.990 8.820 -1.830 1
1 733 . 7 1 1 A 83 83 HIS HA H 61 4.490 4.722 -0.232 1
1 736 . 7 1 1 A 83 83 HIS C C 61 172.260 176.772 -4.512 1
1 737 . 7 1 1 A 83 83 HIS CA C 61 57.110 56.748 0.362 1
1 738 . 7 1 1 A 83 83 HIS CB C 61 32.780 31.090 1.690 1
1 739 . 7 1 1 A 83 83 HIS N N 61 116.940 123.321 -6.381 1
1 740 . 7 1 1 A 84 84 GLY H H 62 7.870 8.648 -0.778 1
1 743 . 7 1 1 A 84 84 GLY C C 62 171.040 176.231 -5.191 1
1 744 . 7 1 1 A 84 84 GLY CA C 62 45.390 65.692 -20.302 1
1 745 . 7 1 1 A 84 84 GLY N N 62 106.740 120.313 -13.573 1
1 746 . 7 1 1 A 85 85 ILE H H 63 6.810 7.746 -0.936 1
1 747 . 7 1 1 A 85 85 ILE HA H 63 3.050 4.348 -1.298 1
1 757 . 7 1 1 A 85 85 ILE C C 63 170.130 178.581 -8.451 1
1 758 . 7 1 1 A 85 85 ILE CA C 63 62.440 57.100 5.340 1
1 759 . 7 1 1 A 85 85 ILE CB C 63 36.110 41.261 -5.151 1
1 763 . 7 1 1 A 85 85 ILE N N 63 118.920 121.352 -2.432 1
1 764 . 7 1 1 A 86 86 HIS H H 64 6.020 7.789 -1.769 1
1 765 . 7 1 1 A 86 86 HIS HA H 64 5.030 4.289 0.741 1
1 768 . 7 1 1 A 86 86 HIS C C 64 170.090 176.574 -6.484 1
1 769 . 7 1 1 A 86 86 HIS CA C 64 53.500 57.550 -4.050 1
1 770 . 7 1 1 A 86 86 HIS CB C 64 31.860 29.113 2.747 1
1 771 . 7 1 1 A 86 86 HIS N N 64 122.440 116.737 5.703 1
1 772 . 7 1 1 A 87 87 ASP H H 65 8.340 7.194 1.146 1
1 773 . 7 1 1 A 87 87 ASP HA H 65 4.320 4.433 -0.113 1
1 776 . 7 1 1 A 87 87 ASP C C 65 174.370 175.271 -0.901 1
1 777 . 7 1 1 A 87 87 ASP CA C 65 56.440 53.723 2.717 1
1 778 . 7 1 1 A 87 87 ASP CB C 65 43.150 40.966 2.184 1
1 779 . 7 1 1 A 87 87 ASP N N 65 116.230 121.306 -5.076 1
1 780 . 7 1 1 A 88 88 GLY H H 66 9.330 8.641 0.689 1
1 783 . 7 1 1 A 88 88 GLY C C 66 172.330 174.844 -2.514 1
1 784 . 7 1 1 A 88 88 GLY CA C 66 45.270 60.422 -15.152 1
1 785 . 7 1 1 A 88 88 GLY N N 66 112.300 119.973 -7.673 1
1 786 . 7 1 1 A 89 89 LEU H H 67 7.640 9.034 -1.394 1
1 787 . 7 1 1 A 89 89 LEU HA H 67 4.720 4.505 0.215 1
1 797 . 7 1 1 A 89 89 LEU C C 67 172.460 176.042 -3.582 1
1 798 . 7 1 1 A 89 89 LEU CA C 67 54.420 54.344 0.076 1
1 799 . 7 1 1 A 89 89 LEU CB C 67 42.260 42.477 -0.217 1
1 803 . 7 1 1 A 89 89 LEU N N 67 120.310 127.591 -7.281 1
1 804 . 7 1 1 A 90 90 THR H H 68 8.110 8.773 -0.663 1
1 805 . 7 1 1 A 90 90 THR HA H 68 5.300 5.393 -0.093 1
1 810 . 7 1 1 A 90 90 THR C C 68 170.900 174.939 -4.039 1
1 811 . 7 1 1 A 90 90 THR CA C 68 61.870 59.926 1.944 1
1 812 . 7 1 1 A 90 90 THR CB C 68 71.320 40.373 30.947 1
1 814 . 7 1 1 A 90 90 THR N N 68 115.300 121.866 -6.566 1
1 815 . 7 1 1 A 91 91 VAL H H 69 9.290 9.079 0.211 1
1 816 . 7 1 1 A 91 91 VAL HA H 69 4.540 4.718 -0.178 1
1 824 . 7 1 1 A 91 91 VAL C C 69 170.890 174.616 -3.726 1
1 825 . 7 1 1 A 91 91 VAL CA C 69 60.310 58.031 2.279 1
1 826 . 7 1 1 A 91 91 VAL CB C 69 34.680 42.513 -7.833 1
1 829 . 7 1 1 A 91 91 VAL N N 69 124.200 126.617 -2.417 1
1 830 . 7 1 1 A 92 92 HIS H H 70 8.750 8.517 0.233 1
1 831 . 7 1 1 A 92 92 HIS HA H 70 5.020 3.869 1.151 1
1 835 . 7 1 1 A 92 92 HIS C C 70 170.890 177.362 -6.472 1
1 836 . 7 1 1 A 92 92 HIS CA C 70 56.750 53.207 3.543 1
1 837 . 7 1 1 A 92 92 HIS CB C 70 32.220 17.932 14.288 1
1 839 . 7 1 1 A 92 92 HIS N N 70 125.250 129.209 -3.959 1
1 840 . 7 1 1 A 93 93 LEU H H 71 8.290 8.609 -0.319 1
1 851 . 7 1 1 A 93 93 LEU C C 71 172.570 173.539 -0.969 1
1 852 . 7 1 1 A 93 93 LEU CA C 71 52.820 45.562 7.258 1
1 857 . 7 1 1 A 93 93 LEU N N 71 123.360 102.726 20.634 1
1 858 . 7 1 1 A 94 94 VAL H H 72 9.110 7.276 1.834 1
1 859 . 7 1 1 A 94 94 VAL HA H 72 4.080 4.926 -0.846 1
1 864 . 7 1 1 A 94 94 VAL C C 72 171.160 174.706 -3.546 1
1 865 . 7 1 1 A 94 94 VAL CA C 72 61.350 54.303 7.047 1
1 866 . 7 1 1 A 94 94 VAL CB C 72 34.640 35.999 -1.359 1
1 868 . 7 1 1 A 94 94 VAL N N 72 128.650 114.891 13.759 1
1 869 . 7 1 1 A 95 95 ILE H H 73 8.150 8.184 -0.034 1
1 870 . 7 1 1 A 95 95 ILE HA H 73 4.500 5.063 -0.563 1
1 880 . 7 1 1 A 95 95 ILE C C 73 174.320 175.507 -1.187 1
1 881 . 7 1 1 A 95 95 ILE CA C 73 60.170 60.255 -0.085 1
1 882 . 7 1 1 A 95 95 ILE CB C 73 38.120 38.968 -0.848 1
1 886 . 7 1 1 A 95 95 ILE N N 73 125.560 118.800 6.760 1
1 887 . 7 1 1 A 96 96 LYS H H 74 9.280 8.755 0.525 1
1 888 . 7 1 1 A 96 96 LYS HA H 74 4.240 4.299 -0.059 1
1 891 . 7 1 1 A 96 96 LYS C C 74 173.510 176.474 -2.964 1
1 892 . 7 1 1 A 96 96 LYS CA C 74 56.730 54.588 2.142 1
1 893 . 7 1 1 A 96 96 LYS CB C 74 33.100 40.655 -7.555 1
1 894 . 7 1 1 A 96 96 LYS N N 74 129.290 128.432 0.858 1
1 895 . 7 1 1 A 97 97 THR H H 75 8.040 8.798 -0.758 1
1 896 . 7 1 1 A 97 97 THR HA H 75 4.230 4.671 -0.441 1
1 901 . 7 1 1 A 97 97 THR C C 75 171.800 177.310 -5.510 1
1 902 . 7 1 1 A 97 97 THR CA C 75 61.760 54.333 7.427 1
1 903 . 7 1 1 A 97 97 THR CB C 75 69.830 34.750 35.080 1
1 905 . 7 1 1 A 97 97 THR N N 75 114.420 124.680 -10.260 1
1 906 . 7 1 1 A 98 98 GLN H H 76 8.400 8.738 -0.338 1
1 907 . 7 1 1 A 98 98 GLN HA H 76 4.210 4.274 -0.064 1
1 914 . 7 1 1 A 98 98 GLN CA C 76 55.880 56.610 -0.730 1
1 915 . 7 1 1 A 98 98 GLN CB C 76 29.700 40.366 -10.666 1
1 917 . 7 1 1 A 98 98 GLN N N 76 122.370 121.154 1.216 1
1 919 . 7 1 1 A 99 99 ASN HA H 77 4.590 4.191 0.399 1
1 924 . 7 1 1 A 99 99 ASN C C 77 171.780 176.105 -4.325 1
1 925 . 7 1 1 A 99 99 ASN CA C 77 53.300 58.029 -4.729 1
1 926 . 7 1 1 A 99 99 ASN CB C 77 38.920 28.142 10.778 1
1 928 . 7 1 1 A 100 100 ARG H H 78 8.160 7.955 0.205 1
1 929 . 7 1 1 A 100 100 ARG HA H 78 4.560 4.929 -0.369 1
1 936 . 7 1 1 A 100 100 ARG CA C 78 53.860 53.361 0.499 1
1 937 . 7 1 1 A 100 100 ARG CB C 78 30.210 41.962 -11.752 1
1 940 . 7 1 1 A 100 100 ARG N N 78 122.840 120.153 2.687 1
1 941 . 7 1 1 A 101 101 PRO HA H 79 4.150 4.919 -0.769 1
1 948 . 7 1 1 A 101 101 PRO CA C 79 64.770 59.241 5.529 1
1 949 . 7 1 1 A 101 101 PRO CB C 79 32.040 71.753 -39.713 1
1 289 . 8 1 1 A 46 46 SER H H 24 8.950 8.461 0.489 1
1 290 . 8 1 1 A 46 46 SER HA H 24 4.900 4.789 0.111 1
1 293 . 8 1 1 A 46 46 SER C C 24 170.890 175.489 -4.599 1
1 294 . 8 1 1 A 46 46 SER CA C 24 56.980 55.066 1.914 1
1 295 . 8 1 1 A 46 46 SER CB C 24 65.590 35.440 30.150 1
1 296 . 8 1 1 A 46 46 SER N N 24 120.420 121.195 -0.775 1
1 297 . 8 1 1 A 47 47 VAL H H 25 9.140 8.535 0.605 1
1 298 . 8 1 1 A 47 47 VAL HA H 25 3.440 4.372 -0.932 1
1 306 . 8 1 1 A 47 47 VAL C C 25 175.060 175.498 -0.438 1
1 307 . 8 1 1 A 47 47 VAL CA C 25 67.250 61.245 6.005 1
1 308 . 8 1 1 A 47 47 VAL CB C 25 30.780 39.532 -8.752 1
1 311 . 8 1 1 A 47 47 VAL N N 25 123.970 126.104 -2.134 1
1 312 . 8 1 1 A 48 48 GLN H H 26 8.540 8.540 0.000 1
1 313 . 8 1 1 A 48 48 GLN HA H 26 4.070 4.713 -0.643 1
1 320 . 8 1 1 A 48 48 GLN CA C 26 60.230 54.934 5.296 1
1 321 . 8 1 1 A 48 48 GLN CB C 26 28.490 32.546 -4.056 1
1 323 . 8 1 1 A 48 48 GLN N N 26 120.550 127.750 -7.200 1
1 325 . 8 1 1 A 49 49 GLN HA H 27 3.950 4.866 -0.916 1
1 332 . 8 1 1 A 49 49 GLN C C 27 176.230 175.370 0.860 1
1 333 . 8 1 1 A 49 49 GLN CA C 27 58.710 55.871 2.839 1
1 334 . 8 1 1 A 49 49 GLN CB C 27 28.820 31.871 -3.051 1
1 337 . 8 1 1 A 50 50 PHE H H 28 8.050 8.721 -0.671 1
1 338 . 8 1 1 A 50 50 PHE HA H 28 4.620 4.558 0.062 1
1 345 . 8 1 1 A 50 50 PHE C C 28 175.190 175.613 -0.423 1
1 346 . 8 1 1 A 50 50 PHE CA C 28 58.030 62.092 -4.062 1
1 347 . 8 1 1 A 50 50 PHE CB C 28 39.190 31.767 7.423 1
1 350 . 8 1 1 A 50 50 PHE N N 28 121.710 125.228 -3.518 1
1 351 . 8 1 1 A 51 51 LYS H H 29 8.940 8.662 0.278 1
1 352 . 8 1 1 A 51 51 LYS HA H 29 3.340 4.881 -1.541 1
1 361 . 8 1 1 A 51 51 LYS C C 29 175.370 174.277 1.093 1
1 362 . 8 1 1 A 51 51 LYS CA C 29 60.660 62.408 -1.748 1
1 363 . 8 1 1 A 51 51 LYS CB C 29 33.190 69.308 -36.118 1
1 367 . 8 1 1 A 51 51 LYS N N 29 117.530 123.774 -6.244 1
1 368 . 8 1 1 A 52 52 GLU H H 30 7.700 9.473 -1.773 1
1 369 . 8 1 1 A 52 52 GLU HA H 30 3.750 4.825 -1.075 1
1 374 . 8 1 1 A 52 52 GLU C C 30 176.780 174.759 2.021 1
1 375 . 8 1 1 A 52 52 GLU CA C 30 59.890 61.626 -1.736 1
1 376 . 8 1 1 A 52 52 GLU CB C 30 28.840 32.820 -3.980 1
1 378 . 8 1 1 A 52 52 GLU N N 30 118.820 128.513 -9.693 1
1 379 . 8 1 1 A 53 53 GLU H H 31 7.370 9.007 -1.637 1
1 380 . 8 1 1 A 53 53 GLU HA H 31 4.150 5.111 -0.961 1
1 385 . 8 1 1 A 53 53 GLU C C 31 177.040 175.867 1.173 1
1 386 . 8 1 1 A 53 53 GLU CA C 31 58.860 55.051 3.809 1
1 387 . 8 1 1 A 53 53 GLU CB C 31 29.200 34.368 -5.168 1
1 389 . 8 1 1 A 53 53 GLU N N 31 119.150 129.284 -10.134 1
1 390 . 8 1 1 A 54 54 ILE H H 32 8.000 8.549 -0.549 1
1 391 . 8 1 1 A 54 54 ILE HA H 32 3.550 4.963 -1.413 1
1 401 . 8 1 1 A 54 54 ILE C C 32 175.420 174.057 1.363 1
1 402 . 8 1 1 A 54 54 ILE CA C 32 64.690 58.883 5.807 1
1 403 . 8 1 1 A 54 54 ILE CB C 32 37.820 70.983 -33.163 1
1 407 . 8 1 1 A 54 54 ILE N N 32 119.970 116.679 3.291 1
1 409 . 8 1 1 A 55 55 SER HA H 33 3.930 4.499 -0.569 1
1 412 . 8 1 1 A 55 55 SER C C 33 173.830 178.417 -4.587 1
1 413 . 8 1 1 A 55 55 SER CA C 33 61.620 64.532 -2.912 1
1 414 . 8 1 1 A 55 55 SER CB C 33 62.720 31.752 30.968 1
1 415 . 8 1 1 A 55 55 SER N N 33 115.780 136.444 -20.664 1
1 416 . 8 1 1 A 56 56 LYS H H 34 7.150 8.779 -1.629 1
1 417 . 8 1 1 A 56 56 LYS HA H 34 4.090 4.243 -0.153 1
1 424 . 8 1 1 A 56 56 LYS C C 34 176.080 176.960 -0.880 1
1 425 . 8 1 1 A 56 56 LYS CA C 34 58.950 58.774 0.176 1
1 426 . 8 1 1 A 56 56 LYS CB C 34 32.540 33.378 -0.838 1
1 429 . 8 1 1 A 56 56 LYS N N 34 119.100 117.510 1.590 1
1 430 . 8 1 1 A 57 57 ARG H H 35 7.530 7.885 -0.355 1
1 431 . 8 1 1 A 57 57 ARG HA H 35 4.110 4.737 -0.627 1
1 436 . 8 1 1 A 57 57 ARG C C 35 174.800 174.182 0.618 1
1 437 . 8 1 1 A 57 57 ARG CA C 35 57.090 55.350 1.740 1
1 438 . 8 1 1 A 57 57 ARG CB C 35 29.810 31.391 -1.581 1
1 440 . 8 1 1 A 57 57 ARG N N 35 119.370 113.209 6.161 1
1 441 . 8 1 1 A 58 58 PHE H H 36 8.320 8.508 -0.188 1
1 442 . 8 1 1 A 58 58 PHE HA H 36 4.340 5.214 -0.874 1
1 449 . 8 1 1 A 58 58 PHE C C 36 171.940 175.181 -3.241 1
1 450 . 8 1 1 A 58 58 PHE CA C 36 58.500 55.368 3.132 1
1 451 . 8 1 1 A 58 58 PHE CB C 36 38.130 34.328 3.802 1
1 454 . 8 1 1 A 58 58 PHE N N 36 113.980 119.172 -5.192 1
1 455 . 8 1 1 A 59 59 LYS H H 37 7.790 9.198 -1.408 1
1 456 . 8 1 1 A 59 59 LYS HA H 37 3.960 4.993 -1.033 1
1 463 . 8 1 1 A 59 59 LYS C C 37 172.670 174.250 -1.580 1
1 464 . 8 1 1 A 59 59 LYS CA C 37 57.140 54.885 2.255 1
1 465 . 8 1 1 A 59 59 LYS CB C 37 29.020 32.637 -3.617 1
1 468 . 8 1 1 A 59 59 LYS N N 37 118.810 122.286 -3.476 1
1 469 . 8 1 1 A 60 60 SER H H 38 7.750 8.667 -0.917 1
1 470 . 8 1 1 A 60 60 SER HA H 38 4.700 4.950 -0.250 1
1 473 . 8 1 1 A 60 60 SER C C 38 170.170 175.248 -5.078 1
1 474 . 8 1 1 A 60 60 SER CA C 38 57.130 54.896 2.234 1
1 475 . 8 1 1 A 60 60 SER CB C 38 66.820 30.776 36.044 1
1 476 . 8 1 1 A 60 60 SER N N 38 112.620 128.600 -15.980 1
1 477 . 8 1 1 A 61 61 HIS H H 39 8.630 9.379 -0.749 1
1 478 . 8 1 1 A 61 61 HIS N N 39 124.090 126.716 -2.626 1
1 479 . 8 1 1 A 62 62 THR HA H 40 3.610 5.434 -1.824 1
1 484 . 8 1 1 A 62 62 THR C C 40 174.350 176.228 -1.878 1
1 485 . 8 1 1 A 62 62 THR CA C 40 66.160 50.653 15.507 1
1 486 . 8 1 1 A 62 62 THR CB C 40 68.070 21.108 46.962 1
1 488 . 8 1 1 A 63 63 ASP H H 41 10.310 8.880 1.430 1
1 489 . 8 1 1 A 63 63 ASP HA H 41 4.420 4.945 -0.525 1
1 492 . 8 1 1 A 63 63 ASP C C 41 174.630 174.830 -0.200 1
1 493 . 8 1 1 A 63 63 ASP CA C 41 56.330 58.053 -1.723 1
1 494 . 8 1 1 A 63 63 ASP CB C 41 40.040 34.652 5.388 1
1 495 . 8 1 1 A 63 63 ASP N N 41 122.900 117.853 5.047 1
1 497 . 8 1 1 A 64 64 GLN HA H 42 4.270 4.573 -0.303 1
1 504 . 8 1 1 A 64 64 GLN C C 42 172.160 177.896 -5.736 1
1 505 . 8 1 1 A 64 64 GLN CA C 42 55.860 63.053 -7.193 1
1 506 . 8 1 1 A 64 64 GLN CB C 42 30.480 30.966 -0.486 1
1 508 . 8 1 1 A 64 64 GLN N N 42 115.750 137.633 -21.883 1
1 510 . 8 1 1 A 65 65 LEU H H 43 7.250 8.159 -0.909 1
1 511 . 8 1 1 A 65 65 LEU HA H 43 4.440 3.994 0.446 1
1 517 . 8 1 1 A 65 65 LEU C C 43 173.160 176.109 -2.949 1
1 518 . 8 1 1 A 65 65 LEU CA C 43 54.620 57.574 -2.954 1
1 519 . 8 1 1 A 65 65 LEU CB C 43 41.990 27.486 14.504 1
1 521 . 8 1 1 A 65 65 LEU N N 43 116.570 118.102 -1.532 1
1 522 . 8 1 1 A 66 66 VAL H H 44 8.690 7.939 0.751 1
1 523 . 8 1 1 A 66 66 VAL HA H 44 3.980 4.950 -0.970 1
1 528 . 8 1 1 A 66 66 VAL C C 44 171.340 175.603 -4.263 1
1 529 . 8 1 1 A 66 66 VAL CA C 44 61.910 54.169 7.741 1
1 530 . 8 1 1 A 66 66 VAL CB C 44 33.630 39.815 -6.185 1
1 532 . 8 1 1 A 66 66 VAL N N 44 125.260 118.544 6.716 1
1 533 . 8 1 1 A 67 67 LEU H H 45 8.570 7.826 0.744 1
1 534 . 8 1 1 A 67 67 LEU HA H 45 5.220 4.337 0.883 1
1 544 . 8 1 1 A 67 67 LEU C C 45 172.500 173.922 -1.422 1
1 545 . 8 1 1 A 67 67 LEU CA C 45 52.820 59.687 -6.867 1
1 546 . 8 1 1 A 67 67 LEU CB C 45 45.310 62.865 -17.555 1
1 550 . 8 1 1 A 67 67 LEU N N 45 126.690 115.865 10.825 1
1 551 . 8 1 1 A 68 68 ILE H H 46 9.040 8.476 0.564 1
1 552 . 8 1 1 A 68 68 ILE HA H 46 4.880 4.473 0.407 1
1 562 . 8 1 1 A 68 68 ILE C C 46 172.390 175.546 -3.156 1
1 563 . 8 1 1 A 68 68 ILE CA C 46 59.900 58.300 1.600 1
1 564 . 8 1 1 A 68 68 ILE CB C 46 41.940 64.265 -22.325 1
1 568 . 8 1 1 A 68 68 ILE N N 46 122.590 121.653 0.937 1
1 569 . 8 1 1 A 69 69 PHE H H 47 8.740 8.450 0.290 1
1 570 . 8 1 1 A 69 69 PHE N N 47 125.360 123.259 2.101 1
1 571 . 8 1 1 A 70 70 ALA HA H 48 3.600 4.027 -0.427 1
1 575 . 8 1 1 A 70 70 ALA C C 48 174.500 177.555 -3.055 1
1 576 . 8 1 1 A 70 70 ALA CA C 48 52.520 58.228 -5.708 1
1 577 . 8 1 1 A 70 70 ALA CB C 48 16.760 28.091 -11.331 1
1 578 . 8 1 1 A 71 71 GLY H H 49 8.210 7.770 0.440 1
1 581 . 8 1 1 A 71 71 GLY C C 49 170.850 178.355 -7.505 1
1 582 . 8 1 1 A 71 71 GLY CA C 49 45.380 57.865 -12.485 1
1 583 . 8 1 1 A 71 71 GLY N N 49 102.430 119.609 -17.179 1
1 584 . 8 1 1 A 72 72 LYS H H 50 7.840 7.964 -0.124 1
1 585 . 8 1 1 A 72 72 LYS HA H 50 4.530 4.037 0.493 1
1 594 . 8 1 1 A 72 72 LYS C C 50 171.800 177.700 -5.900 1
1 595 . 8 1 1 A 72 72 LYS CA C 50 54.630 61.143 -6.513 1
1 596 . 8 1 1 A 72 72 LYS CB C 50 34.630 38.901 -4.271 1
1 600 . 8 1 1 A 72 72 LYS N N 50 121.570 120.694 0.876 1
1 601 . 8 1 1 A 73 73 ILE H H 51 8.250 8.118 0.132 1
1 602 . 8 1 1 A 73 73 ILE HA H 51 4.260 3.880 0.380 1
1 612 . 8 1 1 A 73 73 ILE C C 51 174.300 178.352 -4.052 1
1 613 . 8 1 1 A 73 73 ILE CA C 51 61.270 58.327 2.943 1
1 614 . 8 1 1 A 73 73 ILE CB C 51 38.150 31.330 6.820 1
1 618 . 8 1 1 A 73 73 ILE N N 51 122.710 118.008 4.702 1
1 619 . 8 1 1 A 74 74 LEU H H 52 8.540 8.394 0.146 1
1 620 . 8 1 1 A 74 74 LEU HA H 52 3.980 3.975 0.005 1
1 630 . 8 1 1 A 74 74 LEU C C 52 173.440 179.190 -5.750 1
1 631 . 8 1 1 A 74 74 LEU CA C 52 54.660 59.400 -4.740 1
1 632 . 8 1 1 A 74 74 LEU CB C 52 41.790 29.219 12.571 1
1 636 . 8 1 1 A 74 74 LEU N N 52 128.360 119.088 9.272 1
1 637 . 8 1 1 A 75 75 LYS H H 53 8.100 7.895 0.205 1
1 638 . 8 1 1 A 75 75 LYS HA H 53 4.440 4.059 0.381 1
1 645 . 8 1 1 A 75 75 LYS C C 53 175.170 179.421 -4.251 1
1 646 . 8 1 1 A 75 75 LYS CA C 53 55.340 58.969 -3.629 1
1 647 . 8 1 1 A 75 75 LYS CB C 53 32.680 29.277 3.403 1
1 650 . 8 1 1 A 75 75 LYS N N 53 123.470 119.304 4.166 1
1 651 . 8 1 1 A 76 76 ASP H H 54 8.310 7.355 0.955 1
1 652 . 8 1 1 A 76 76 ASP HA H 54 4.110 3.989 0.121 1
1 655 . 8 1 1 A 76 76 ASP C C 54 174.270 178.152 -3.882 1
1 656 . 8 1 1 A 76 76 ASP CA C 54 58.140 65.441 -7.301 1
1 657 . 8 1 1 A 76 76 ASP CB C 54 40.760 37.497 3.263 1
1 658 . 8 1 1 A 76 76 ASP N N 54 121.080 121.118 -0.038 1
1 659 . 8 1 1 A 77 77 GLN H H 55 8.180 7.834 0.346 1
1 660 . 8 1 1 A 77 77 GLN HA H 55 4.360 4.324 0.036 1
1 667 . 8 1 1 A 77 77 GLN C C 55 173.710 176.491 -2.781 1
1 668 . 8 1 1 A 77 77 GLN CA C 55 56.350 61.570 -5.220 1
1 669 . 8 1 1 A 77 77 GLN CB C 55 28.090 62.759 -34.669 1
1 671 . 8 1 1 A 77 77 GLN N N 55 113.190 116.333 -3.143 1
1 673 . 8 1 1 A 78 78 ASP H H 56 7.770 8.039 -0.269 1
1 674 . 8 1 1 A 78 78 ASP HA H 56 4.700 4.085 0.615 1
1 677 . 8 1 1 A 78 78 ASP C C 56 173.500 178.734 -5.234 1
1 678 . 8 1 1 A 78 78 ASP CA C 56 54.140 58.775 -4.635 1
1 679 . 8 1 1 A 78 78 ASP CB C 56 42.020 31.616 10.404 1
1 680 . 8 1 1 A 78 78 ASP N N 56 121.910 119.118 2.792 1
1 681 . 8 1 1 A 79 79 THR H H 57 8.490 7.653 0.837 1
1 682 . 8 1 1 A 79 79 THR HA H 57 4.700 4.048 0.652 1
1 687 . 8 1 1 A 79 79 THR C C 57 172.840 177.518 -4.678 1
1 688 . 8 1 1 A 79 79 THR CA C 57 59.980 58.608 1.372 1
1 689 . 8 1 1 A 79 79 THR CB C 57 70.640 31.007 39.633 1
1 691 . 8 1 1 A 79 79 THR N N 57 108.860 118.941 -10.081 1
1 692 . 8 1 1 A 80 80 LEU H H 58 7.700 7.922 -0.222 1
1 693 . 8 1 1 A 80 80 LEU HA H 58 3.880 4.571 -0.691 1
1 703 . 8 1 1 A 80 80 LEU C C 58 177.370 174.768 2.602 1
1 704 . 8 1 1 A 80 80 LEU CA C 58 58.450 57.458 0.992 1
1 705 . 8 1 1 A 80 80 LEU CB C 58 39.500 39.536 -0.036 1
1 709 . 8 1 1 A 80 80 LEU N N 58 118.820 115.863 2.957 1
1 710 . 8 1 1 A 81 81 SER H H 59 8.810 7.513 1.297 1
1 711 . 8 1 1 A 81 81 SER HA H 59 4.050 3.774 0.276 1
1 714 . 8 1 1 A 81 81 SER C C 59 176.150 174.704 1.446 1
1 715 . 8 1 1 A 81 81 SER CA C 59 61.190 57.240 3.950 1
1 716 . 8 1 1 A 81 81 SER CB C 59 62.490 29.139 33.351 1
1 717 . 8 1 1 A 81 81 SER N N 59 114.240 116.416 -2.176 1
1 718 . 8 1 1 A 82 82 GLN H H 60 7.950 7.503 0.447 1
1 719 . 8 1 1 A 82 82 GLN HA H 60 4.090 4.868 -0.778 1
1 726 . 8 1 1 A 82 82 GLN C C 60 173.930 173.046 0.884 1
1 727 . 8 1 1 A 82 82 GLN CA C 60 58.080 57.517 0.563 1
1 728 . 8 1 1 A 82 82 GLN CB C 60 28.460 65.922 -37.462 1
1 730 . 8 1 1 A 82 82 GLN N N 60 122.620 113.631 8.989 1
1 732 . 8 1 1 A 83 83 HIS H H 61 6.990 8.755 -1.765 1
1 733 . 8 1 1 A 83 83 HIS HA H 61 4.490 4.531 -0.041 1
1 736 . 8 1 1 A 83 83 HIS C C 61 172.260 177.228 -4.968 1
1 737 . 8 1 1 A 83 83 HIS CA C 61 57.110 56.959 0.151 1
1 738 . 8 1 1 A 83 83 HIS CB C 61 32.780 30.368 2.412 1
1 739 . 8 1 1 A 83 83 HIS N N 61 116.940 124.712 -7.772 1
1 740 . 8 1 1 A 84 84 GLY H H 62 7.870 8.990 -1.120 1
1 743 . 8 1 1 A 84 84 GLY C C 62 171.040 176.404 -5.364 1
1 744 . 8 1 1 A 84 84 GLY CA C 62 45.390 65.728 -20.338 1
1 745 . 8 1 1 A 84 84 GLY N N 62 106.740 117.186 -10.446 1
1 746 . 8 1 1 A 85 85 ILE H H 63 6.810 8.306 -1.496 1
1 747 . 8 1 1 A 85 85 ILE HA H 63 3.050 4.465 -1.415 1
1 757 . 8 1 1 A 85 85 ILE C C 63 170.130 177.831 -7.701 1
1 758 . 8 1 1 A 85 85 ILE CA C 63 62.440 57.508 4.932 1
1 759 . 8 1 1 A 85 85 ILE CB C 63 36.110 41.555 -5.445 1
1 763 . 8 1 1 A 85 85 ILE N N 63 118.920 121.672 -2.752 1
1 764 . 8 1 1 A 86 86 HIS H H 64 6.020 7.527 -1.507 1
1 765 . 8 1 1 A 86 86 HIS HA H 64 5.030 4.324 0.706 1
1 768 . 8 1 1 A 86 86 HIS C C 64 170.090 175.953 -5.863 1
1 769 . 8 1 1 A 86 86 HIS CA C 64 53.500 56.133 -2.633 1
1 770 . 8 1 1 A 86 86 HIS CB C 64 31.860 29.246 2.614 1
1 771 . 8 1 1 A 86 86 HIS N N 64 122.440 116.362 6.078 1
1 772 . 8 1 1 A 87 87 ASP H H 65 8.340 7.502 0.838 1
1 773 . 8 1 1 A 87 87 ASP HA H 65 4.320 4.411 -0.091 1
1 776 . 8 1 1 A 87 87 ASP C C 65 174.370 175.284 -0.914 1
1 777 . 8 1 1 A 87 87 ASP CA C 65 56.440 54.128 2.312 1
1 778 . 8 1 1 A 87 87 ASP CB C 65 43.150 40.289 2.861 1
1 779 . 8 1 1 A 87 87 ASP N N 65 116.230 121.832 -5.602 1
1 780 . 8 1 1 A 88 88 GLY H H 66 9.330 8.150 1.180 1
1 783 . 8 1 1 A 88 88 GLY C C 66 172.330 175.319 -2.989 1
1 784 . 8 1 1 A 88 88 GLY CA C 66 45.270 61.022 -15.752 1
1 785 . 8 1 1 A 88 88 GLY N N 66 112.300 121.410 -9.110 1
1 786 . 8 1 1 A 89 89 LEU H H 67 7.640 8.894 -1.254 1
1 787 . 8 1 1 A 89 89 LEU HA H 67 4.720 4.699 0.021 1
1 797 . 8 1 1 A 89 89 LEU C C 67 172.460 176.245 -3.785 1
1 798 . 8 1 1 A 89 89 LEU CA C 67 54.420 54.392 0.028 1
1 799 . 8 1 1 A 89 89 LEU CB C 67 42.260 42.249 0.011 1
1 803 . 8 1 1 A 89 89 LEU N N 67 120.310 127.982 -7.672 1
1 804 . 8 1 1 A 90 90 THR H H 68 8.110 8.802 -0.692 1
1 805 . 8 1 1 A 90 90 THR HA H 68 5.300 5.284 0.016 1
1 810 . 8 1 1 A 90 90 THR C C 68 170.900 174.894 -3.994 1
1 811 . 8 1 1 A 90 90 THR CA C 68 61.870 59.736 2.134 1
1 812 . 8 1 1 A 90 90 THR CB C 68 71.320 40.441 30.879 1
1 814 . 8 1 1 A 90 90 THR N N 68 115.300 122.257 -6.957 1
1 815 . 8 1 1 A 91 91 VAL H H 69 9.290 9.051 0.239 1
1 816 . 8 1 1 A 91 91 VAL HA H 69 4.540 4.744 -0.204 1
1 824 . 8 1 1 A 91 91 VAL C C 69 170.890 174.596 -3.706 1
1 825 . 8 1 1 A 91 91 VAL CA C 69 60.310 57.912 2.398 1
1 826 . 8 1 1 A 91 91 VAL CB C 69 34.680 42.673 -7.993 1
1 829 . 8 1 1 A 91 91 VAL N N 69 124.200 126.830 -2.630 1
1 830 . 8 1 1 A 92 92 HIS H H 70 8.750 8.628 0.122 1
1 831 . 8 1 1 A 92 92 HIS HA H 70 5.020 3.955 1.065 1
1 835 . 8 1 1 A 92 92 HIS C C 70 170.890 177.166 -6.276 1
1 836 . 8 1 1 A 92 92 HIS CA C 70 56.750 53.296 3.454 1
1 837 . 8 1 1 A 92 92 HIS CB C 70 32.220 18.049 14.171 1
1 839 . 8 1 1 A 92 92 HIS N N 70 125.250 129.224 -3.974 1
1 840 . 8 1 1 A 93 93 LEU H H 71 8.290 8.532 -0.242 1
1 851 . 8 1 1 A 93 93 LEU C C 71 172.570 173.511 -0.941 1
1 852 . 8 1 1 A 93 93 LEU CA C 71 52.820 45.359 7.461 1
1 857 . 8 1 1 A 93 93 LEU N N 71 123.360 102.873 20.487 1
1 858 . 8 1 1 A 94 94 VAL H H 72 9.110 7.350 1.760 1
1 859 . 8 1 1 A 94 94 VAL HA H 72 4.080 4.887 -0.807 1
1 864 . 8 1 1 A 94 94 VAL C C 72 171.160 175.220 -4.060 1
1 865 . 8 1 1 A 94 94 VAL CA C 72 61.350 54.206 7.144 1
1 866 . 8 1 1 A 94 94 VAL CB C 72 34.640 36.196 -1.556 1
1 868 . 8 1 1 A 94 94 VAL N N 72 128.650 115.205 13.445 1
1 869 . 8 1 1 A 95 95 ILE H H 73 8.150 8.239 -0.089 1
1 870 . 8 1 1 A 95 95 ILE HA H 73 4.500 4.559 -0.059 1
1 880 . 8 1 1 A 95 95 ILE C C 73 174.320 175.619 -1.299 1
1 881 . 8 1 1 A 95 95 ILE CA C 73 60.170 60.892 -0.722 1
1 882 . 8 1 1 A 95 95 ILE CB C 73 38.120 38.293 -0.173 1
1 886 . 8 1 1 A 95 95 ILE N N 73 125.560 119.408 6.152 1
1 887 . 8 1 1 A 96 96 LYS H H 74 9.280 8.804 0.476 1
1 888 . 8 1 1 A 96 96 LYS HA H 74 4.240 4.518 -0.278 1
1 891 . 8 1 1 A 96 96 LYS C C 74 173.510 176.306 -2.796 1
1 892 . 8 1 1 A 96 96 LYS CA C 74 56.730 54.337 2.393 1
1 893 . 8 1 1 A 96 96 LYS CB C 74 33.100 41.533 -8.433 1
1 894 . 8 1 1 A 96 96 LYS N N 74 129.290 127.592 1.698 1
1 895 . 8 1 1 A 97 97 THR H H 75 8.040 8.665 -0.625 1
1 896 . 8 1 1 A 97 97 THR HA H 75 4.230 4.688 -0.458 1
1 901 . 8 1 1 A 97 97 THR C C 75 171.800 177.255 -5.455 1
1 902 . 8 1 1 A 97 97 THR CA C 75 61.760 54.342 7.418 1
1 903 . 8 1 1 A 97 97 THR CB C 75 69.830 34.771 35.059 1
1 905 . 8 1 1 A 97 97 THR N N 75 114.420 124.086 -9.666 1
1 906 . 8 1 1 A 98 98 GLN H H 76 8.400 9.023 -0.623 1
1 907 . 8 1 1 A 98 98 GLN HA H 76 4.210 4.338 -0.128 1
1 914 . 8 1 1 A 98 98 GLN CA C 76 55.880 57.069 -1.189 1
1 915 . 8 1 1 A 98 98 GLN CB C 76 29.700 40.065 -10.365 1
1 917 . 8 1 1 A 98 98 GLN N N 76 122.370 121.174 1.196 1
1 919 . 8 1 1 A 99 99 ASN HA H 77 4.590 4.235 0.355 1
1 924 . 8 1 1 A 99 99 ASN C C 77 171.780 176.347 -4.567 1
1 925 . 8 1 1 A 99 99 ASN CA C 77 53.300 57.587 -4.287 1
1 926 . 8 1 1 A 99 99 ASN CB C 77 38.920 27.911 11.009 1
1 928 . 8 1 1 A 100 100 ARG H H 78 8.160 7.850 0.310 1
1 929 . 8 1 1 A 100 100 ARG HA H 78 4.560 4.804 -0.244 1
1 936 . 8 1 1 A 100 100 ARG CA C 78 53.860 53.974 -0.114 1
1 937 . 8 1 1 A 100 100 ARG CB C 78 30.210 41.800 -11.590 1
1 940 . 8 1 1 A 100 100 ARG N N 78 122.840 120.945 1.895 1
1 941 . 8 1 1 A 101 101 PRO HA H 79 4.150 4.929 -0.779 1
1 948 . 8 1 1 A 101 101 PRO CA C 79 64.770 59.249 5.521 1
1 949 . 8 1 1 A 101 101 PRO CB C 79 32.040 71.623 -39.583 1
1 289 . 9 1 1 A 46 46 SER H H 24 8.950 8.454 0.496 1
1 290 . 9 1 1 A 46 46 SER HA H 24 4.900 4.499 0.401 1
1 293 . 9 1 1 A 46 46 SER C C 24 170.890 176.217 -5.327 1
1 294 . 9 1 1 A 46 46 SER CA C 24 56.980 55.658 1.322 1
1 295 . 9 1 1 A 46 46 SER CB C 24 65.590 33.708 31.882 1
1 296 . 9 1 1 A 46 46 SER N N 24 120.420 121.181 -0.761 1
1 297 . 9 1 1 A 47 47 VAL H H 25 9.140 8.251 0.889 1
1 298 . 9 1 1 A 47 47 VAL HA H 25 3.440 4.349 -0.909 1
1 306 . 9 1 1 A 47 47 VAL C C 25 175.060 176.063 -1.003 1
1 307 . 9 1 1 A 47 47 VAL CA C 25 67.250 60.889 6.361 1
1 308 . 9 1 1 A 47 47 VAL CB C 25 30.780 39.769 -8.989 1
1 311 . 9 1 1 A 47 47 VAL N N 25 123.970 126.085 -2.115 1
1 312 . 9 1 1 A 48 48 GLN H H 26 8.540 8.590 -0.050 1
1 313 . 9 1 1 A 48 48 GLN HA H 26 4.070 4.824 -0.754 1
1 320 . 9 1 1 A 48 48 GLN CA C 26 60.230 53.677 6.553 1
1 321 . 9 1 1 A 48 48 GLN CB C 26 28.490 32.411 -3.921 1
1 323 . 9 1 1 A 48 48 GLN N N 26 120.550 125.852 -5.302 1
1 325 . 9 1 1 A 49 49 GLN HA H 27 3.950 5.077 -1.127 1
1 332 . 9 1 1 A 49 49 GLN C C 27 176.230 175.373 0.857 1
1 333 . 9 1 1 A 49 49 GLN CA C 27 58.710 56.063 2.647 1
1 334 . 9 1 1 A 49 49 GLN CB C 27 28.820 32.864 -4.044 1
1 337 . 9 1 1 A 50 50 PHE H H 28 8.050 9.065 -1.015 1
1 338 . 9 1 1 A 50 50 PHE HA H 28 4.620 4.787 -0.167 1
1 345 . 9 1 1 A 50 50 PHE C C 28 175.190 175.149 0.041 1
1 346 . 9 1 1 A 50 50 PHE CA C 28 58.030 61.261 -3.231 1
1 347 . 9 1 1 A 50 50 PHE CB C 28 39.190 33.313 5.877 1
1 350 . 9 1 1 A 50 50 PHE N N 28 121.710 125.570 -3.860 1
1 351 . 9 1 1 A 51 51 LYS H H 29 8.940 8.711 0.229 1
1 352 . 9 1 1 A 51 51 LYS HA H 29 3.340 4.592 -1.252 1
1 361 . 9 1 1 A 51 51 LYS C C 29 175.370 174.180 1.190 1
1 362 . 9 1 1 A 51 51 LYS CA C 29 60.660 62.654 -1.994 1
1 363 . 9 1 1 A 51 51 LYS CB C 29 33.190 69.364 -36.174 1
1 367 . 9 1 1 A 51 51 LYS N N 29 117.530 122.661 -5.131 1
1 368 . 9 1 1 A 52 52 GLU H H 30 7.700 9.579 -1.879 1
1 369 . 9 1 1 A 52 52 GLU HA H 30 3.750 4.765 -1.015 1
1 374 . 9 1 1 A 52 52 GLU C C 30 176.780 174.339 2.441 1
1 375 . 9 1 1 A 52 52 GLU CA C 30 59.890 61.555 -1.665 1
1 376 . 9 1 1 A 52 52 GLU CB C 30 28.840 33.225 -4.385 1
1 378 . 9 1 1 A 52 52 GLU N N 30 118.820 128.592 -9.772 1
1 379 . 9 1 1 A 53 53 GLU H H 31 7.370 9.084 -1.714 1
1 380 . 9 1 1 A 53 53 GLU HA H 31 4.150 4.970 -0.820 1
1 385 . 9 1 1 A 53 53 GLU C C 31 177.040 176.132 0.908 1
1 386 . 9 1 1 A 53 53 GLU CA C 31 58.860 55.191 3.669 1
1 387 . 9 1 1 A 53 53 GLU CB C 31 29.200 33.903 -4.703 1
1 389 . 9 1 1 A 53 53 GLU N N 31 119.150 128.573 -9.423 1
1 390 . 9 1 1 A 54 54 ILE H H 32 8.000 8.508 -0.508 1
1 391 . 9 1 1 A 54 54 ILE HA H 32 3.550 4.894 -1.344 1
1 401 . 9 1 1 A 54 54 ILE C C 32 175.420 174.144 1.276 1
1 402 . 9 1 1 A 54 54 ILE CA C 32 64.690 58.472 6.218 1
1 403 . 9 1 1 A 54 54 ILE CB C 32 37.820 69.456 -31.636 1
1 407 . 9 1 1 A 54 54 ILE N N 32 119.970 118.059 1.911 1
1 409 . 9 1 1 A 55 55 SER HA H 33 3.930 4.453 -0.523 1
1 412 . 9 1 1 A 55 55 SER C C 33 173.830 177.832 -4.002 1
1 413 . 9 1 1 A 55 55 SER CA C 33 61.620 64.460 -2.840 1
1 414 . 9 1 1 A 55 55 SER CB C 33 62.720 31.685 31.035 1
1 415 . 9 1 1 A 55 55 SER N N 33 115.780 136.329 -20.549 1
1 416 . 9 1 1 A 56 56 LYS H H 34 7.150 8.183 -1.033 1
1 417 . 9 1 1 A 56 56 LYS HA H 34 4.090 4.261 -0.171 1
1 424 . 9 1 1 A 56 56 LYS C C 34 176.080 176.694 -0.614 1
1 425 . 9 1 1 A 56 56 LYS CA C 34 58.950 57.770 1.180 1
1 426 . 9 1 1 A 56 56 LYS CB C 34 32.540 33.606 -1.066 1
1 429 . 9 1 1 A 56 56 LYS N N 34 119.100 117.185 1.915 1
1 430 . 9 1 1 A 57 57 ARG H H 35 7.530 7.613 -0.083 1
1 431 . 9 1 1 A 57 57 ARG HA H 35 4.110 4.678 -0.568 1
1 436 . 9 1 1 A 57 57 ARG C C 35 174.800 174.007 0.793 1
1 437 . 9 1 1 A 57 57 ARG CA C 35 57.090 55.445 1.645 1
1 438 . 9 1 1 A 57 57 ARG CB C 35 29.810 31.271 -1.461 1
1 440 . 9 1 1 A 57 57 ARG N N 35 119.370 113.031 6.339 1
1 441 . 9 1 1 A 58 58 PHE H H 36 8.320 8.567 -0.247 1
1 442 . 9 1 1 A 58 58 PHE HA H 36 4.340 5.562 -1.222 1
1 449 . 9 1 1 A 58 58 PHE C C 36 171.940 174.939 -2.999 1
1 450 . 9 1 1 A 58 58 PHE CA C 36 58.500 54.515 3.985 1
1 451 . 9 1 1 A 58 58 PHE CB C 36 38.130 35.713 2.417 1
1 454 . 9 1 1 A 58 58 PHE N N 36 113.980 119.276 -5.296 1
1 455 . 9 1 1 A 59 59 LYS H H 37 7.790 8.690 -0.900 1
1 456 . 9 1 1 A 59 59 LYS HA H 37 3.960 4.711 -0.751 1
1 463 . 9 1 1 A 59 59 LYS C C 37 172.670 173.583 -0.913 1
1 464 . 9 1 1 A 59 59 LYS CA C 37 57.140 55.266 1.874 1
1 465 . 9 1 1 A 59 59 LYS CB C 37 29.020 33.636 -4.616 1
1 468 . 9 1 1 A 59 59 LYS N N 37 118.810 119.520 -0.710 1
1 469 . 9 1 1 A 60 60 SER H H 38 7.750 8.588 -0.838 1
1 470 . 9 1 1 A 60 60 SER HA H 38 4.700 5.050 -0.350 1
1 473 . 9 1 1 A 60 60 SER C C 38 170.170 175.251 -5.081 1
1 474 . 9 1 1 A 60 60 SER CA C 38 57.130 54.931 2.199 1
1 475 . 9 1 1 A 60 60 SER CB C 38 66.820 31.798 35.022 1
1 476 . 9 1 1 A 60 60 SER N N 38 112.620 126.705 -14.085 1
1 477 . 9 1 1 A 61 61 HIS H H 39 8.630 9.297 -0.667 1
1 478 . 9 1 1 A 61 61 HIS N N 39 124.090 125.833 -1.743 1
1 479 . 9 1 1 A 62 62 THR HA H 40 3.610 5.387 -1.777 1
1 484 . 9 1 1 A 62 62 THR C C 40 174.350 176.203 -1.853 1
1 485 . 9 1 1 A 62 62 THR CA C 40 66.160 50.681 15.479 1
1 486 . 9 1 1 A 62 62 THR CB C 40 68.070 21.255 46.815 1
1 488 . 9 1 1 A 63 63 ASP H H 41 10.310 8.797 1.513 1
1 489 . 9 1 1 A 63 63 ASP HA H 41 4.420 4.909 -0.489 1
1 492 . 9 1 1 A 63 63 ASP C C 41 174.630 174.818 -0.188 1
1 493 . 9 1 1 A 63 63 ASP CA C 41 56.330 58.075 -1.745 1
1 494 . 9 1 1 A 63 63 ASP CB C 41 40.040 34.836 5.204 1
1 495 . 9 1 1 A 63 63 ASP N N 41 122.900 118.263 4.637 1
1 497 . 9 1 1 A 64 64 GLN HA H 42 4.270 4.553 -0.283 1
1 504 . 9 1 1 A 64 64 GLN C C 42 172.160 177.852 -5.692 1
1 505 . 9 1 1 A 64 64 GLN CA C 42 55.860 63.076 -7.216 1
1 506 . 9 1 1 A 64 64 GLN CB C 42 30.480 30.930 -0.450 1
1 508 . 9 1 1 A 64 64 GLN N N 42 115.750 138.274 -22.524 1
1 510 . 9 1 1 A 65 65 LEU H H 43 7.250 8.150 -0.900 1
1 511 . 9 1 1 A 65 65 LEU HA H 43 4.440 3.969 0.471 1
1 517 . 9 1 1 A 65 65 LEU C C 43 173.160 176.040 -2.880 1
1 518 . 9 1 1 A 65 65 LEU CA C 43 54.620 57.282 -2.662 1
1 519 . 9 1 1 A 65 65 LEU CB C 43 41.990 27.398 14.592 1
1 521 . 9 1 1 A 65 65 LEU N N 43 116.570 118.180 -1.610 1
1 522 . 9 1 1 A 66 66 VAL H H 44 8.690 7.973 0.717 1
1 523 . 9 1 1 A 66 66 VAL HA H 44 3.980 4.969 -0.989 1
1 528 . 9 1 1 A 66 66 VAL C C 44 171.340 175.350 -4.010 1
1 529 . 9 1 1 A 66 66 VAL CA C 44 61.910 52.753 9.157 1
1 530 . 9 1 1 A 66 66 VAL CB C 44 33.630 40.458 -6.828 1
1 532 . 9 1 1 A 66 66 VAL N N 44 125.260 118.020 7.240 1
1 533 . 9 1 1 A 67 67 LEU H H 45 8.570 7.762 0.808 1
1 534 . 9 1 1 A 67 67 LEU HA H 45 5.220 4.628 0.592 1
1 544 . 9 1 1 A 67 67 LEU C C 45 172.500 174.650 -2.150 1
1 545 . 9 1 1 A 67 67 LEU CA C 45 52.820 60.124 -7.304 1
1 546 . 9 1 1 A 67 67 LEU CB C 45 45.310 63.547 -18.237 1
1 550 . 9 1 1 A 67 67 LEU N N 45 126.690 116.370 10.320 1
1 551 . 9 1 1 A 68 68 ILE H H 46 9.040 8.568 0.472 1
1 552 . 9 1 1 A 68 68 ILE HA H 46 4.880 4.898 -0.018 1
1 562 . 9 1 1 A 68 68 ILE C C 46 172.390 176.038 -3.648 1
1 563 . 9 1 1 A 68 68 ILE CA C 46 59.900 57.393 2.507 1
1 564 . 9 1 1 A 68 68 ILE CB C 46 41.940 65.477 -23.537 1
1 568 . 9 1 1 A 68 68 ILE N N 46 122.590 119.680 2.910 1
1 569 . 9 1 1 A 69 69 PHE H H 47 8.740 8.686 0.054 1
1 570 . 9 1 1 A 69 69 PHE N N 47 125.360 121.437 3.923 1
1 571 . 9 1 1 A 70 70 ALA HA H 48 3.600 4.024 -0.424 1
1 575 . 9 1 1 A 70 70 ALA C C 48 174.500 177.604 -3.104 1
1 576 . 9 1 1 A 70 70 ALA CA C 48 52.520 58.769 -6.249 1
1 577 . 9 1 1 A 70 70 ALA CB C 48 16.760 28.418 -11.658 1
1 578 . 9 1 1 A 71 71 GLY H H 49 8.210 7.445 0.765 1
1 581 . 9 1 1 A 71 71 GLY C C 49 170.850 178.295 -7.445 1
1 582 . 9 1 1 A 71 71 GLY CA C 49 45.380 57.715 -12.335 1
1 583 . 9 1 1 A 71 71 GLY N N 49 102.430 117.916 -15.486 1
1 584 . 9 1 1 A 72 72 LYS H H 50 7.840 8.211 -0.371 1
1 585 . 9 1 1 A 72 72 LYS HA H 50 4.530 4.012 0.518 1
1 594 . 9 1 1 A 72 72 LYS C C 50 171.800 177.829 -6.029 1
1 595 . 9 1 1 A 72 72 LYS CA C 50 54.630 61.267 -6.637 1
1 596 . 9 1 1 A 72 72 LYS CB C 50 34.630 39.055 -4.425 1
1 600 . 9 1 1 A 72 72 LYS N N 50 121.570 122.602 -1.032 1
1 601 . 9 1 1 A 73 73 ILE H H 51 8.250 8.287 -0.037 1
1 602 . 9 1 1 A 73 73 ILE HA H 51 4.260 3.881 0.379 1
1 612 . 9 1 1 A 73 73 ILE C C 51 174.300 178.442 -4.142 1
1 613 . 9 1 1 A 73 73 ILE CA C 51 61.270 58.231 3.039 1
1 614 . 9 1 1 A 73 73 ILE CB C 51 38.150 31.305 6.845 1
1 618 . 9 1 1 A 73 73 ILE N N 51 122.710 117.946 4.764 1
1 619 . 9 1 1 A 74 74 LEU H H 52 8.540 8.073 0.467 1
1 620 . 9 1 1 A 74 74 LEU HA H 52 3.980 4.031 -0.051 1
1 630 . 9 1 1 A 74 74 LEU C C 52 173.440 179.041 -5.601 1
1 631 . 9 1 1 A 74 74 LEU CA C 52 54.660 59.682 -5.022 1
1 632 . 9 1 1 A 74 74 LEU CB C 52 41.790 29.392 12.398 1
1 636 . 9 1 1 A 74 74 LEU N N 52 128.360 119.352 9.008 1
1 637 . 9 1 1 A 75 75 LYS H H 53 8.100 8.039 0.061 1
1 638 . 9 1 1 A 75 75 LYS HA H 53 4.440 3.983 0.457 1
1 645 . 9 1 1 A 75 75 LYS C C 53 175.170 179.416 -4.246 1
1 646 . 9 1 1 A 75 75 LYS CA C 53 55.340 58.894 -3.554 1
1 647 . 9 1 1 A 75 75 LYS CB C 53 32.680 29.226 3.454 1
1 650 . 9 1 1 A 75 75 LYS N N 53 123.470 120.101 3.369 1
1 651 . 9 1 1 A 76 76 ASP H H 54 8.310 7.084 1.226 1
1 652 . 9 1 1 A 76 76 ASP HA H 54 4.110 3.607 0.503 1
1 655 . 9 1 1 A 76 76 ASP C C 54 174.270 178.028 -3.758 1
1 656 . 9 1 1 A 76 76 ASP CA C 54 58.140 64.807 -6.667 1
1 657 . 9 1 1 A 76 76 ASP CB C 54 40.760 37.453 3.307 1
1 658 . 9 1 1 A 76 76 ASP N N 54 121.080 120.589 0.491 1
1 659 . 9 1 1 A 77 77 GLN H H 55 8.180 7.866 0.314 1
1 660 . 9 1 1 A 77 77 GLN HA H 55 4.360 4.266 0.094 1
1 667 . 9 1 1 A 77 77 GLN C C 55 173.710 176.542 -2.832 1
1 668 . 9 1 1 A 77 77 GLN CA C 55 56.350 61.678 -5.328 1
1 669 . 9 1 1 A 77 77 GLN CB C 55 28.090 62.956 -34.866 1
1 671 . 9 1 1 A 77 77 GLN N N 55 113.190 116.050 -2.860 1
1 673 . 9 1 1 A 78 78 ASP H H 56 7.770 7.938 -0.168 1
1 674 . 9 1 1 A 78 78 ASP HA H 56 4.700 4.174 0.526 1
1 677 . 9 1 1 A 78 78 ASP C C 56 173.500 178.515 -5.015 1
1 678 . 9 1 1 A 78 78 ASP CA C 56 54.140 58.339 -4.199 1
1 679 . 9 1 1 A 78 78 ASP CB C 56 42.020 31.281 10.739 1
1 680 . 9 1 1 A 78 78 ASP N N 56 121.910 119.322 2.588 1
1 681 . 9 1 1 A 79 79 THR H H 57 8.490 7.672 0.818 1
1 682 . 9 1 1 A 79 79 THR HA H 57 4.700 4.093 0.607 1
1 687 . 9 1 1 A 79 79 THR C C 57 172.840 178.376 -5.536 1
1 688 . 9 1 1 A 79 79 THR CA C 57 59.980 58.716 1.264 1
1 689 . 9 1 1 A 79 79 THR CB C 57 70.640 30.712 39.928 1
1 691 . 9 1 1 A 79 79 THR N N 57 108.860 120.288 -11.428 1
1 692 . 9 1 1 A 80 80 LEU H H 58 7.700 7.854 -0.154 1
1 693 . 9 1 1 A 80 80 LEU HA H 58 3.880 4.630 -0.750 1
1 703 . 9 1 1 A 80 80 LEU C C 58 177.370 174.887 2.483 1
1 704 . 9 1 1 A 80 80 LEU CA C 58 58.450 57.603 0.847 1
1 705 . 9 1 1 A 80 80 LEU CB C 58 39.500 38.930 0.570 1
1 709 . 9 1 1 A 80 80 LEU N N 58 118.820 117.305 1.515 1
1 710 . 9 1 1 A 81 81 SER H H 59 8.810 7.625 1.185 1
1 711 . 9 1 1 A 81 81 SER HA H 59 4.050 4.003 0.047 1
1 714 . 9 1 1 A 81 81 SER C C 59 176.150 174.625 1.525 1
1 715 . 9 1 1 A 81 81 SER CA C 59 61.190 57.308 3.882 1
1 716 . 9 1 1 A 81 81 SER CB C 59 62.490 29.060 33.430 1
1 717 . 9 1 1 A 81 81 SER N N 59 114.240 116.484 -2.244 1
1 718 . 9 1 1 A 82 82 GLN H H 60 7.950 7.625 0.325 1
1 719 . 9 1 1 A 82 82 GLN HA H 60 4.090 4.852 -0.762 1
1 726 . 9 1 1 A 82 82 GLN C C 60 173.930 173.629 0.301 1
1 727 . 9 1 1 A 82 82 GLN CA C 60 58.080 57.659 0.421 1
1 728 . 9 1 1 A 82 82 GLN CB C 60 28.460 65.066 -36.606 1
1 730 . 9 1 1 A 82 82 GLN N N 60 122.620 114.296 8.324 1
1 732 . 9 1 1 A 83 83 HIS H H 61 6.990 8.757 -1.767 1
1 733 . 9 1 1 A 83 83 HIS HA H 61 4.490 4.599 -0.109 1
1 736 . 9 1 1 A 83 83 HIS C C 61 172.260 176.479 -4.219 1
1 737 . 9 1 1 A 83 83 HIS CA C 61 57.110 56.679 0.431 1
1 738 . 9 1 1 A 83 83 HIS CB C 61 32.780 31.180 1.600 1
1 739 . 9 1 1 A 83 83 HIS N N 61 116.940 124.221 -7.281 1
1 740 . 9 1 1 A 84 84 GLY H H 62 7.870 8.797 -0.927 1
1 743 . 9 1 1 A 84 84 GLY C C 62 171.040 175.735 -4.695 1
1 744 . 9 1 1 A 84 84 GLY CA C 62 45.390 65.744 -20.354 1
1 745 . 9 1 1 A 84 84 GLY N N 62 106.740 121.666 -14.926 1
1 746 . 9 1 1 A 85 85 ILE H H 63 6.810 7.483 -0.673 1
1 747 . 9 1 1 A 85 85 ILE HA H 63 3.050 4.392 -1.342 1
1 757 . 9 1 1 A 85 85 ILE C C 63 170.130 178.319 -8.189 1
1 758 . 9 1 1 A 85 85 ILE CA C 63 62.440 57.082 5.358 1
1 759 . 9 1 1 A 85 85 ILE CB C 63 36.110 40.373 -4.263 1
1 763 . 9 1 1 A 85 85 ILE N N 63 118.920 122.199 -3.279 1
1 764 . 9 1 1 A 86 86 HIS H H 64 6.020 7.468 -1.448 1
1 765 . 9 1 1 A 86 86 HIS HA H 64 5.030 4.359 0.671 1
1 768 . 9 1 1 A 86 86 HIS C C 64 170.090 175.959 -5.869 1
1 769 . 9 1 1 A 86 86 HIS CA C 64 53.500 57.200 -3.700 1
1 770 . 9 1 1 A 86 86 HIS CB C 64 31.860 29.666 2.194 1
1 771 . 9 1 1 A 86 86 HIS N N 64 122.440 117.266 5.174 1
1 772 . 9 1 1 A 87 87 ASP H H 65 8.340 7.425 0.915 1
1 773 . 9 1 1 A 87 87 ASP HA H 65 4.320 4.623 -0.303 1
1 776 . 9 1 1 A 87 87 ASP C C 65 174.370 176.145 -1.775 1
1 777 . 9 1 1 A 87 87 ASP CA C 65 56.440 54.136 2.304 1
1 778 . 9 1 1 A 87 87 ASP CB C 65 43.150 42.345 0.805 1
1 779 . 9 1 1 A 87 87 ASP N N 65 116.230 118.324 -2.094 1
1 780 . 9 1 1 A 88 88 GLY H H 66 9.330 8.886 0.444 1
1 783 . 9 1 1 A 88 88 GLY C C 66 172.330 174.786 -2.456 1
1 784 . 9 1 1 A 88 88 GLY CA C 66 45.270 59.603 -14.333 1
1 785 . 9 1 1 A 88 88 GLY N N 66 112.300 120.758 -8.458 1
1 786 . 9 1 1 A 89 89 LEU H H 67 7.640 8.725 -1.085 1
1 787 . 9 1 1 A 89 89 LEU HA H 67 4.720 4.565 0.155 1
1 797 . 9 1 1 A 89 89 LEU C C 67 172.460 175.765 -3.305 1
1 798 . 9 1 1 A 89 89 LEU CA C 67 54.420 54.322 0.098 1
1 799 . 9 1 1 A 89 89 LEU CB C 67 42.260 42.538 -0.278 1
1 803 . 9 1 1 A 89 89 LEU N N 67 120.310 126.224 -5.914 1
1 804 . 9 1 1 A 90 90 THR H H 68 8.110 8.747 -0.637 1
1 805 . 9 1 1 A 90 90 THR HA H 68 5.300 5.286 0.014 1
1 810 . 9 1 1 A 90 90 THR C C 68 170.900 174.736 -3.836 1
1 811 . 9 1 1 A 90 90 THR CA C 68 61.870 60.299 1.571 1
1 812 . 9 1 1 A 90 90 THR CB C 68 71.320 41.811 29.509 1
1 814 . 9 1 1 A 90 90 THR N N 68 115.300 121.799 -6.499 1
1 815 . 9 1 1 A 91 91 VAL H H 69 9.290 8.949 0.341 1
1 816 . 9 1 1 A 91 91 VAL HA H 69 4.540 4.756 -0.216 1
1 824 . 9 1 1 A 91 91 VAL C C 69 170.890 174.653 -3.763 1
1 825 . 9 1 1 A 91 91 VAL CA C 69 60.310 57.697 2.613 1
1 826 . 9 1 1 A 91 91 VAL CB C 69 34.680 42.635 -7.955 1
1 829 . 9 1 1 A 91 91 VAL N N 69 124.200 126.639 -2.439 1
1 830 . 9 1 1 A 92 92 HIS H H 70 8.750 8.309 0.441 1
1 831 . 9 1 1 A 92 92 HIS HA H 70 5.020 3.711 1.309 1
1 835 . 9 1 1 A 92 92 HIS C C 70 170.890 176.926 -6.036 1
1 836 . 9 1 1 A 92 92 HIS CA C 70 56.750 53.067 3.683 1
1 837 . 9 1 1 A 92 92 HIS CB C 70 32.220 17.824 14.396 1
1 839 . 9 1 1 A 92 92 HIS N N 70 125.250 128.845 -3.595 1
1 840 . 9 1 1 A 93 93 LEU H H 71 8.290 8.316 -0.026 1
1 851 . 9 1 1 A 93 93 LEU C C 71 172.570 173.695 -1.125 1
1 852 . 9 1 1 A 93 93 LEU CA C 71 52.820 45.254 7.566 1
1 857 . 9 1 1 A 93 93 LEU N N 71 123.360 102.710 20.650 1
1 858 . 9 1 1 A 94 94 VAL H H 72 9.110 7.324 1.786 1
1 859 . 9 1 1 A 94 94 VAL HA H 72 4.080 4.820 -0.740 1
1 864 . 9 1 1 A 94 94 VAL C C 72 171.160 175.653 -4.493 1
1 865 . 9 1 1 A 94 94 VAL CA C 72 61.350 54.633 6.717 1
1 866 . 9 1 1 A 94 94 VAL CB C 72 34.640 35.074 -0.434 1
1 868 . 9 1 1 A 94 94 VAL N N 72 128.650 116.261 12.389 1
1 869 . 9 1 1 A 95 95 ILE H H 73 8.150 8.287 -0.137 1
1 870 . 9 1 1 A 95 95 ILE HA H 73 4.500 4.266 0.234 1
1 880 . 9 1 1 A 95 95 ILE C C 73 174.320 175.775 -1.455 1
1 881 . 9 1 1 A 95 95 ILE CA C 73 60.170 61.120 -0.950 1
1 882 . 9 1 1 A 95 95 ILE CB C 73 38.120 38.540 -0.420 1
1 886 . 9 1 1 A 95 95 ILE N N 73 125.560 118.923 6.637 1
1 887 . 9 1 1 A 96 96 LYS H H 74 9.280 8.985 0.295 1
1 888 . 9 1 1 A 96 96 LYS HA H 74 4.240 4.749 -0.509 1
1 891 . 9 1 1 A 96 96 LYS C C 74 173.510 176.360 -2.850 1
1 892 . 9 1 1 A 96 96 LYS CA C 74 56.730 53.981 2.749 1
1 893 . 9 1 1 A 96 96 LYS CB C 74 33.100 42.295 -9.195 1
1 894 . 9 1 1 A 96 96 LYS N N 74 129.290 127.186 2.104 1
1 895 . 9 1 1 A 97 97 THR H H 75 8.040 8.886 -0.846 1
1 896 . 9 1 1 A 97 97 THR HA H 75 4.230 4.612 -0.382 1
1 901 . 9 1 1 A 97 97 THR C C 75 171.800 177.631 -5.831 1
1 902 . 9 1 1 A 97 97 THR CA C 75 61.760 55.111 6.649 1
1 903 . 9 1 1 A 97 97 THR CB C 75 69.830 34.053 35.777 1
1 905 . 9 1 1 A 97 97 THR N N 75 114.420 123.731 -9.311 1
1 906 . 9 1 1 A 98 98 GLN H H 76 8.400 8.998 -0.598 1
1 907 . 9 1 1 A 98 98 GLN HA H 76 4.210 4.371 -0.161 1
1 914 . 9 1 1 A 98 98 GLN CA C 76 55.880 56.784 -0.904 1
1 915 . 9 1 1 A 98 98 GLN CB C 76 29.700 39.937 -10.237 1
1 917 . 9 1 1 A 98 98 GLN N N 76 122.370 121.251 1.119 1
1 919 . 9 1 1 A 99 99 ASN HA H 77 4.590 4.140 0.450 1
1 924 . 9 1 1 A 99 99 ASN C C 77 171.780 176.245 -4.465 1
1 925 . 9 1 1 A 99 99 ASN CA C 77 53.300 58.652 -5.352 1
1 926 . 9 1 1 A 99 99 ASN CB C 77 38.920 28.048 10.872 1
1 928 . 9 1 1 A 100 100 ARG H H 78 8.160 7.827 0.333 1
1 929 . 9 1 1 A 100 100 ARG HA H 78 4.560 4.781 -0.221 1
1 936 . 9 1 1 A 100 100 ARG CA C 78 53.860 54.227 -0.367 1
1 937 . 9 1 1 A 100 100 ARG CB C 78 30.210 41.868 -11.658 1
1 940 . 9 1 1 A 100 100 ARG N N 78 122.840 119.717 3.123 1
1 941 . 9 1 1 A 101 101 PRO HA H 79 4.150 5.014 -0.864 1
1 948 . 9 1 1 A 101 101 PRO CA C 79 64.770 59.346 5.424 1
1 949 . 9 1 1 A 101 101 PRO CB C 79 32.040 71.723 -39.683 1
1 289 . 10 1 1 A 46 46 SER H H 24 8.950 8.670 0.280 1
1 290 . 10 1 1 A 46 46 SER HA H 24 4.900 4.850 0.050 1
1 293 . 10 1 1 A 46 46 SER C C 24 170.890 174.854 -3.964 1
1 294 . 10 1 1 A 46 46 SER CA C 24 56.980 55.033 1.947 1
1 295 . 10 1 1 A 46 46 SER CB C 24 65.590 36.383 29.207 1
1 296 . 10 1 1 A 46 46 SER N N 24 120.420 121.963 -1.543 1
1 297 . 10 1 1 A 47 47 VAL H H 25 9.140 8.387 0.753 1
1 298 . 10 1 1 A 47 47 VAL HA H 25 3.440 4.359 -0.919 1
1 306 . 10 1 1 A 47 47 VAL C C 25 175.060 175.591 -0.531 1
1 307 . 10 1 1 A 47 47 VAL CA C 25 67.250 61.413 5.837 1
1 308 . 10 1 1 A 47 47 VAL CB C 25 30.780 39.292 -8.512 1
1 311 . 10 1 1 A 47 47 VAL N N 25 123.970 125.465 -1.495 1
1 312 . 10 1 1 A 48 48 GLN H H 26 8.540 8.661 -0.121 1
1 313 . 10 1 1 A 48 48 GLN HA H 26 4.070 4.687 -0.617 1
1 320 . 10 1 1 A 48 48 GLN CA C 26 60.230 55.191 5.039 1
1 321 . 10 1 1 A 48 48 GLN CB C 26 28.490 33.047 -4.557 1
1 323 . 10 1 1 A 48 48 GLN N N 26 120.550 127.991 -7.441 1
1 325 . 10 1 1 A 49 49 GLN HA H 27 3.950 4.769 -0.819 1
1 332 . 10 1 1 A 49 49 GLN C C 27 176.230 175.375 0.855 1
1 333 . 10 1 1 A 49 49 GLN CA C 27 58.710 55.569 3.141 1
1 334 . 10 1 1 A 49 49 GLN CB C 27 28.820 31.774 -2.954 1
1 337 . 10 1 1 A 50 50 PHE H H 28 8.050 8.433 -0.383 1
1 338 . 10 1 1 A 50 50 PHE HA H 28 4.620 4.539 0.081 1
1 345 . 10 1 1 A 50 50 PHE C C 28 175.190 175.538 -0.348 1
1 346 . 10 1 1 A 50 50 PHE CA C 28 58.030 62.014 -3.984 1
1 347 . 10 1 1 A 50 50 PHE CB C 28 39.190 31.908 7.282 1
1 350 . 10 1 1 A 50 50 PHE N N 28 121.710 125.095 -3.385 1
1 351 . 10 1 1 A 51 51 LYS H H 29 8.940 8.746 0.194 1
1 352 . 10 1 1 A 51 51 LYS HA H 29 3.340 4.745 -1.405 1
1 361 . 10 1 1 A 51 51 LYS C C 29 175.370 174.430 0.940 1
1 362 . 10 1 1 A 51 51 LYS CA C 29 60.660 62.661 -2.001 1
1 363 . 10 1 1 A 51 51 LYS CB C 29 33.190 70.038 -36.848 1
1 367 . 10 1 1 A 51 51 LYS N N 29 117.530 123.552 -6.022 1
1 368 . 10 1 1 A 52 52 GLU H H 30 7.700 9.167 -1.467 1
1 369 . 10 1 1 A 52 52 GLU HA H 30 3.750 4.820 -1.070 1
1 374 . 10 1 1 A 52 52 GLU C C 30 176.780 174.234 2.546 1
1 375 . 10 1 1 A 52 52 GLU CA C 30 59.890 61.155 -1.265 1
1 376 . 10 1 1 A 52 52 GLU CB C 30 28.840 35.126 -6.286 1
1 378 . 10 1 1 A 52 52 GLU N N 30 118.820 126.314 -7.494 1
1 379 . 10 1 1 A 53 53 GLU H H 31 7.370 9.243 -1.873 1
1 380 . 10 1 1 A 53 53 GLU HA H 31 4.150 4.919 -0.769 1
1 385 . 10 1 1 A 53 53 GLU C C 31 177.040 176.428 0.612 1
1 386 . 10 1 1 A 53 53 GLU CA C 31 58.860 54.989 3.871 1
1 387 . 10 1 1 A 53 53 GLU CB C 31 29.200 34.191 -4.991 1
1 389 . 10 1 1 A 53 53 GLU N N 31 119.150 128.820 -9.670 1
1 390 . 10 1 1 A 54 54 ILE H H 32 8.000 8.769 -0.769 1
1 391 . 10 1 1 A 54 54 ILE HA H 32 3.550 4.838 -1.288 1
1 401 . 10 1 1 A 54 54 ILE C C 32 175.420 174.289 1.131 1
1 402 . 10 1 1 A 54 54 ILE CA C 32 64.690 58.773 5.917 1
1 403 . 10 1 1 A 54 54 ILE CB C 32 37.820 69.952 -32.132 1
1 407 . 10 1 1 A 54 54 ILE N N 32 119.970 117.482 2.488 1
1 409 . 10 1 1 A 55 55 SER HA H 33 3.930 4.332 -0.402 1
1 412 . 10 1 1 A 55 55 SER C C 33 173.830 178.249 -4.419 1
1 413 . 10 1 1 A 55 55 SER CA C 33 61.620 65.246 -3.626 1
1 414 . 10 1 1 A 55 55 SER CB C 33 62.720 31.969 30.751 1
1 415 . 10 1 1 A 55 55 SER N N 33 115.780 136.411 -20.631 1
1 416 . 10 1 1 A 56 56 LYS H H 34 7.150 8.509 -1.359 1
1 417 . 10 1 1 A 56 56 LYS HA H 34 4.090 4.220 -0.130 1
1 424 . 10 1 1 A 56 56 LYS C C 34 176.080 176.894 -0.814 1
1 425 . 10 1 1 A 56 56 LYS CA C 34 58.950 58.567 0.383 1
1 426 . 10 1 1 A 56 56 LYS CB C 34 32.540 32.840 -0.300 1
1 429 . 10 1 1 A 56 56 LYS N N 34 119.100 116.830 2.270 1
1 430 . 10 1 1 A 57 57 ARG H H 35 7.530 7.869 -0.339 1
1 431 . 10 1 1 A 57 57 ARG HA H 35 4.110 4.834 -0.724 1
1 436 . 10 1 1 A 57 57 ARG C C 35 174.800 174.012 0.788 1
1 437 . 10 1 1 A 57 57 ARG CA C 35 57.090 54.690 2.400 1
1 438 . 10 1 1 A 57 57 ARG CB C 35 29.810 31.730 -1.920 1
1 440 . 10 1 1 A 57 57 ARG N N 35 119.370 113.291 6.079 1
1 441 . 10 1 1 A 58 58 PHE H H 36 8.320 8.805 -0.485 1
1 442 . 10 1 1 A 58 58 PHE HA H 36 4.340 5.317 -0.977 1
1 449 . 10 1 1 A 58 58 PHE C C 36 171.940 174.472 -2.532 1
1 450 . 10 1 1 A 58 58 PHE CA C 36 58.500 54.564 3.936 1
1 451 . 10 1 1 A 58 58 PHE CB C 36 38.130 35.762 2.368 1
1 454 . 10 1 1 A 58 58 PHE N N 36 113.980 116.974 -2.994 1
1 455 . 10 1 1 A 59 59 LYS H H 37 7.790 9.089 -1.299 1
1 456 . 10 1 1 A 59 59 LYS HA H 37 3.960 5.087 -1.127 1
1 463 . 10 1 1 A 59 59 LYS C C 37 172.670 173.899 -1.229 1
1 464 . 10 1 1 A 59 59 LYS CA C 37 57.140 54.720 2.420 1
1 465 . 10 1 1 A 59 59 LYS CB C 37 29.020 33.412 -4.392 1
1 468 . 10 1 1 A 59 59 LYS N N 37 118.810 121.978 -3.168 1
1 469 . 10 1 1 A 60 60 SER H H 38 7.750 8.759 -1.009 1
1 470 . 10 1 1 A 60 60 SER HA H 38 4.700 4.806 -0.106 1
1 473 . 10 1 1 A 60 60 SER C C 38 170.170 175.556 -5.386 1
1 474 . 10 1 1 A 60 60 SER CA C 38 57.130 54.816 2.314 1
1 475 . 10 1 1 A 60 60 SER CB C 38 66.820 31.019 35.801 1
1 476 . 10 1 1 A 60 60 SER N N 38 112.620 127.698 -15.078 1
1 477 . 10 1 1 A 61 61 HIS H H 39 8.630 9.206 -0.576 1
1 478 . 10 1 1 A 61 61 HIS N N 39 124.090 126.934 -2.844 1
1 479 . 10 1 1 A 62 62 THR HA H 40 3.610 5.226 -1.616 1
1 484 . 10 1 1 A 62 62 THR C C 40 174.350 175.916 -1.566 1
1 485 . 10 1 1 A 62 62 THR CA C 40 66.160 50.956 15.204 1
1 486 . 10 1 1 A 62 62 THR CB C 40 68.070 21.014 47.056 1
1 488 . 10 1 1 A 63 63 ASP H H 41 10.310 8.908 1.402 1
1 489 . 10 1 1 A 63 63 ASP HA H 41 4.420 4.967 -0.547 1
1 492 . 10 1 1 A 63 63 ASP C C 41 174.630 174.665 -0.035 1
1 493 . 10 1 1 A 63 63 ASP CA C 41 56.330 58.033 -1.703 1
1 494 . 10 1 1 A 63 63 ASP CB C 41 40.040 34.528 5.512 1
1 495 . 10 1 1 A 63 63 ASP N N 41 122.900 117.850 5.050 1
1 497 . 10 1 1 A 64 64 GLN HA H 42 4.270 4.572 -0.302 1
1 504 . 10 1 1 A 64 64 GLN C C 42 172.160 176.980 -4.820 1
1 505 . 10 1 1 A 64 64 GLN CA C 42 55.860 62.913 -7.053 1
1 506 . 10 1 1 A 64 64 GLN CB C 42 30.480 30.323 0.157 1
1 508 . 10 1 1 A 64 64 GLN N N 42 115.750 137.381 -21.631 1
1 510 . 10 1 1 A 65 65 LEU H H 43 7.250 8.041 -0.791 1
1 511 . 10 1 1 A 65 65 LEU HA H 43 4.440 3.973 0.467 1
1 517 . 10 1 1 A 65 65 LEU C C 43 173.160 175.903 -2.743 1
1 518 . 10 1 1 A 65 65 LEU CA C 43 54.620 58.349 -3.729 1
1 519 . 10 1 1 A 65 65 LEU CB C 43 41.990 27.590 14.400 1
1 521 . 10 1 1 A 65 65 LEU N N 43 116.570 113.437 3.133 1
1 522 . 10 1 1 A 66 66 VAL H H 44 8.690 7.973 0.717 1
1 523 . 10 1 1 A 66 66 VAL HA H 44 3.980 4.971 -0.991 1
1 528 . 10 1 1 A 66 66 VAL C C 44 171.340 175.543 -4.203 1
1 529 . 10 1 1 A 66 66 VAL CA C 44 61.910 54.055 7.855 1
1 530 . 10 1 1 A 66 66 VAL CB C 44 33.630 40.486 -6.856 1
1 532 . 10 1 1 A 66 66 VAL N N 44 125.260 117.310 7.950 1
1 533 . 10 1 1 A 67 67 LEU H H 45 8.570 7.885 0.685 1
1 534 . 10 1 1 A 67 67 LEU HA H 45 5.220 4.369 0.851 1
1 544 . 10 1 1 A 67 67 LEU C C 45 172.500 173.908 -1.408 1
1 545 . 10 1 1 A 67 67 LEU CA C 45 52.820 59.750 -6.930 1
1 546 . 10 1 1 A 67 67 LEU CB C 45 45.310 63.132 -17.822 1
1 550 . 10 1 1 A 67 67 LEU N N 45 126.690 116.530 10.160 1
1 551 . 10 1 1 A 68 68 ILE H H 46 9.040 8.443 0.597 1
1 552 . 10 1 1 A 68 68 ILE HA H 46 4.880 4.708 0.172 1
1 562 . 10 1 1 A 68 68 ILE C C 46 172.390 176.203 -3.813 1
1 563 . 10 1 1 A 68 68 ILE CA C 46 59.900 57.872 2.028 1
1 564 . 10 1 1 A 68 68 ILE CB C 46 41.940 65.181 -23.241 1
1 568 . 10 1 1 A 68 68 ILE N N 46 122.590 121.059 1.531 1
1 569 . 10 1 1 A 69 69 PHE H H 47 8.740 8.429 0.311 1
1 570 . 10 1 1 A 69 69 PHE N N 47 125.360 121.860 3.500 1
1 571 . 10 1 1 A 70 70 ALA HA H 48 3.600 4.029 -0.429 1
1 575 . 10 1 1 A 70 70 ALA C C 48 174.500 177.816 -3.316 1
1 576 . 10 1 1 A 70 70 ALA CA C 48 52.520 58.912 -6.392 1
1 577 . 10 1 1 A 70 70 ALA CB C 48 16.760 28.273 -11.513 1
1 578 . 10 1 1 A 71 71 GLY H H 49 8.210 7.626 0.584 1
1 581 . 10 1 1 A 71 71 GLY C C 49 170.850 178.343 -7.493 1
1 582 . 10 1 1 A 71 71 GLY CA C 49 45.380 57.884 -12.504 1
1 583 . 10 1 1 A 71 71 GLY N N 49 102.430 118.161 -15.731 1
1 584 . 10 1 1 A 72 72 LYS H H 50 7.840 8.245 -0.405 1
1 585 . 10 1 1 A 72 72 LYS HA H 50 4.530 4.076 0.454 1
1 594 . 10 1 1 A 72 72 LYS C C 50 171.800 177.685 -5.885 1
1 595 . 10 1 1 A 72 72 LYS CA C 50 54.630 61.251 -6.621 1
1 596 . 10 1 1 A 72 72 LYS CB C 50 34.630 38.939 -4.309 1
1 600 . 10 1 1 A 72 72 LYS N N 50 121.570 120.741 0.829 1
1 601 . 10 1 1 A 73 73 ILE H H 51 8.250 7.944 0.306 1
1 602 . 10 1 1 A 73 73 ILE HA H 51 4.260 3.855 0.405 1
1 612 . 10 1 1 A 73 73 ILE C C 51 174.300 178.436 -4.136 1
1 613 . 10 1 1 A 73 73 ILE CA C 51 61.270 58.306 2.964 1
1 614 . 10 1 1 A 73 73 ILE CB C 51 38.150 31.322 6.828 1
1 618 . 10 1 1 A 73 73 ILE N N 51 122.710 117.916 4.794 1
1 619 . 10 1 1 A 74 74 LEU H H 52 8.540 8.452 0.088 1
1 620 . 10 1 1 A 74 74 LEU HA H 52 3.980 4.013 -0.033 1
1 630 . 10 1 1 A 74 74 LEU C C 52 173.440 179.013 -5.573 1
1 631 . 10 1 1 A 74 74 LEU CA C 52 54.660 59.246 -4.586 1
1 632 . 10 1 1 A 74 74 LEU CB C 52 41.790 29.356 12.434 1
1 636 . 10 1 1 A 74 74 LEU N N 52 128.360 119.091 9.269 1
1 637 . 10 1 1 A 75 75 LYS H H 53 8.100 7.623 0.477 1
1 638 . 10 1 1 A 75 75 LYS HA H 53 4.440 4.076 0.364 1
1 645 . 10 1 1 A 75 75 LYS C C 53 175.170 178.833 -3.663 1
1 646 . 10 1 1 A 75 75 LYS CA C 53 55.340 59.307 -3.967 1
1 647 . 10 1 1 A 75 75 LYS CB C 53 32.680 28.956 3.724 1
1 650 . 10 1 1 A 75 75 LYS N N 53 123.470 118.256 5.214 1
1 651 . 10 1 1 A 76 76 ASP H H 54 8.310 7.410 0.900 1
1 652 . 10 1 1 A 76 76 ASP HA H 54 4.110 3.665 0.445 1
1 655 . 10 1 1 A 76 76 ASP C C 54 174.270 178.103 -3.833 1
1 656 . 10 1 1 A 76 76 ASP CA C 54 58.140 64.044 -5.904 1
1 657 . 10 1 1 A 76 76 ASP CB C 54 40.760 36.047 4.713 1
1 658 . 10 1 1 A 76 76 ASP N N 54 121.080 121.590 -0.510 1
1 659 . 10 1 1 A 77 77 GLN H H 55 8.180 7.702 0.478 1
1 660 . 10 1 1 A 77 77 GLN HA H 55 4.360 4.273 0.087 1
1 667 . 10 1 1 A 77 77 GLN C C 55 173.710 176.527 -2.817 1
1 668 . 10 1 1 A 77 77 GLN CA C 55 56.350 61.288 -4.938 1
1 669 . 10 1 1 A 77 77 GLN CB C 55 28.090 63.075 -34.985 1
1 671 . 10 1 1 A 77 77 GLN N N 55 113.190 116.785 -3.595 1
1 673 . 10 1 1 A 78 78 ASP H H 56 7.770 7.920 -0.150 1
1 674 . 10 1 1 A 78 78 ASP HA H 56 4.700 4.032 0.668 1
1 677 . 10 1 1 A 78 78 ASP C C 56 173.500 178.802 -5.302 1
1 678 . 10 1 1 A 78 78 ASP CA C 56 54.140 59.289 -5.149 1
1 679 . 10 1 1 A 78 78 ASP CB C 56 42.020 32.055 9.965 1
1 680 . 10 1 1 A 78 78 ASP N N 56 121.910 119.215 2.695 1
1 681 . 10 1 1 A 79 79 THR H H 57 8.490 7.559 0.931 1
1 682 . 10 1 1 A 79 79 THR HA H 57 4.700 3.848 0.852 1
1 687 . 10 1 1 A 79 79 THR C C 57 172.840 177.653 -4.813 1
1 688 . 10 1 1 A 79 79 THR CA C 57 59.980 58.938 1.042 1
1 689 . 10 1 1 A 79 79 THR CB C 57 70.640 29.995 40.645 1
1 691 . 10 1 1 A 79 79 THR N N 57 108.860 119.891 -11.031 1
1 692 . 10 1 1 A 80 80 LEU H H 58 7.700 7.407 0.293 1
1 693 . 10 1 1 A 80 80 LEU HA H 58 3.880 4.553 -0.673 1
1 703 . 10 1 1 A 80 80 LEU C C 58 177.370 174.661 2.709 1
1 704 . 10 1 1 A 80 80 LEU CA C 58 58.450 57.514 0.936 1
1 705 . 10 1 1 A 80 80 LEU CB C 58 39.500 39.529 -0.029 1
1 709 . 10 1 1 A 80 80 LEU N N 58 118.820 114.650 4.170 1
1 710 . 10 1 1 A 81 81 SER H H 59 8.810 7.887 0.923 1
1 711 . 10 1 1 A 81 81 SER HA H 59 4.050 3.926 0.124 1
1 714 . 10 1 1 A 81 81 SER C C 59 176.150 174.172 1.978 1
1 715 . 10 1 1 A 81 81 SER CA C 59 61.190 57.473 3.717 1
1 716 . 10 1 1 A 81 81 SER CB C 59 62.490 29.194 33.296 1
1 717 . 10 1 1 A 81 81 SER N N 59 114.240 116.013 -1.773 1
1 718 . 10 1 1 A 82 82 GLN H H 60 7.950 7.830 0.120 1
1 719 . 10 1 1 A 82 82 GLN HA H 60 4.090 4.790 -0.700 1
1 726 . 10 1 1 A 82 82 GLN C C 60 173.930 173.445 0.485 1
1 727 . 10 1 1 A 82 82 GLN CA C 60 58.080 55.982 2.098 1
1 728 . 10 1 1 A 82 82 GLN CB C 60 28.460 65.886 -37.426 1
1 730 . 10 1 1 A 82 82 GLN N N 60 122.620 113.592 9.028 1
1 732 . 10 1 1 A 83 83 HIS H H 61 6.990 8.741 -1.751 1
1 733 . 10 1 1 A 83 83 HIS HA H 61 4.490 4.732 -0.242 1
1 736 . 10 1 1 A 83 83 HIS C C 61 172.260 177.116 -4.856 1
1 737 . 10 1 1 A 83 83 HIS CA C 61 57.110 56.642 0.468 1
1 738 . 10 1 1 A 83 83 HIS CB C 61 32.780 30.485 2.295 1
1 739 . 10 1 1 A 83 83 HIS N N 61 116.940 122.381 -5.441 1
1 740 . 10 1 1 A 84 84 GLY H H 62 7.870 9.144 -1.274 1
1 743 . 10 1 1 A 84 84 GLY C C 62 171.040 176.433 -5.393 1
1 744 . 10 1 1 A 84 84 GLY CA C 62 45.390 66.103 -20.713 1
1 745 . 10 1 1 A 84 84 GLY N N 62 106.740 117.217 -10.477 1
1 746 . 10 1 1 A 85 85 ILE H H 63 6.810 8.274 -1.464 1
1 747 . 10 1 1 A 85 85 ILE HA H 63 3.050 4.399 -1.349 1
1 757 . 10 1 1 A 85 85 ILE C C 63 170.130 178.158 -8.028 1
1 758 . 10 1 1 A 85 85 ILE CA C 63 62.440 57.399 5.041 1
1 759 . 10 1 1 A 85 85 ILE CB C 63 36.110 41.327 -5.217 1
1 763 . 10 1 1 A 85 85 ILE N N 63 118.920 122.109 -3.189 1
1 764 . 10 1 1 A 86 86 HIS H H 64 6.020 7.729 -1.709 1
1 765 . 10 1 1 A 86 86 HIS HA H 64 5.030 4.360 0.670 1
1 768 . 10 1 1 A 86 86 HIS C C 64 170.090 176.019 -5.929 1
1 769 . 10 1 1 A 86 86 HIS CA C 64 53.500 57.533 -4.033 1
1 770 . 10 1 1 A 86 86 HIS CB C 64 31.860 29.458 2.402 1
1 771 . 10 1 1 A 86 86 HIS N N 64 122.440 116.237 6.203 1
1 772 . 10 1 1 A 87 87 ASP H H 65 8.340 7.374 0.966 1
1 773 . 10 1 1 A 87 87 ASP HA H 65 4.320 4.668 -0.348 1
1 776 . 10 1 1 A 87 87 ASP C C 65 174.370 176.120 -1.750 1
1 777 . 10 1 1 A 87 87 ASP CA C 65 56.440 53.713 2.727 1
1 778 . 10 1 1 A 87 87 ASP CB C 65 43.150 42.856 0.294 1
1 779 . 10 1 1 A 87 87 ASP N N 65 116.230 117.753 -1.523 1
1 780 . 10 1 1 A 88 88 GLY H H 66 9.330 8.876 0.454 1
1 783 . 10 1 1 A 88 88 GLY C C 66 172.330 174.311 -1.981 1
1 784 . 10 1 1 A 88 88 GLY CA C 66 45.270 59.488 -14.218 1
1 785 . 10 1 1 A 88 88 GLY N N 66 112.300 119.550 -7.250 1
1 786 . 10 1 1 A 89 89 LEU H H 67 7.640 8.755 -1.115 1
1 787 . 10 1 1 A 89 89 LEU HA H 67 4.720 4.998 -0.278 1
1 797 . 10 1 1 A 89 89 LEU C C 67 172.460 176.301 -3.841 1
1 798 . 10 1 1 A 89 89 LEU CA C 67 54.420 53.919 0.501 1
1 799 . 10 1 1 A 89 89 LEU CB C 67 42.260 43.040 -0.780 1
1 803 . 10 1 1 A 89 89 LEU N N 67 120.310 126.228 -5.918 1
1 804 . 10 1 1 A 90 90 THR H H 68 8.110 8.789 -0.679 1
1 805 . 10 1 1 A 90 90 THR HA H 68 5.300 5.316 -0.016 1
1 810 . 10 1 1 A 90 90 THR C C 68 170.900 175.070 -4.170 1
1 811 . 10 1 1 A 90 90 THR CA C 68 61.870 59.815 2.055 1
1 812 . 10 1 1 A 90 90 THR CB C 68 71.320 40.337 30.983 1
1 814 . 10 1 1 A 90 90 THR N N 68 115.300 123.029 -7.729 1
1 815 . 10 1 1 A 91 91 VAL H H 69 9.290 9.082 0.208 1
1 816 . 10 1 1 A 91 91 VAL HA H 69 4.540 4.608 -0.068 1
1 824 . 10 1 1 A 91 91 VAL C C 69 170.890 174.503 -3.613 1
1 825 . 10 1 1 A 91 91 VAL CA C 69 60.310 57.936 2.374 1
1 826 . 10 1 1 A 91 91 VAL CB C 69 34.680 42.550 -7.870 1
1 829 . 10 1 1 A 91 91 VAL N N 69 124.200 126.650 -2.450 1
1 830 . 10 1 1 A 92 92 HIS H H 70 8.750 8.399 0.351 1
1 831 . 10 1 1 A 92 92 HIS HA H 70 5.020 3.806 1.214 1
1 835 . 10 1 1 A 92 92 HIS C C 70 170.890 177.116 -6.226 1
1 836 . 10 1 1 A 92 92 HIS CA C 70 56.750 53.139 3.611 1
1 837 . 10 1 1 A 92 92 HIS CB C 70 32.220 17.908 14.312 1
1 839 . 10 1 1 A 92 92 HIS N N 70 125.250 129.039 -3.789 1
1 840 . 10 1 1 A 93 93 LEU H H 71 8.290 8.429 -0.139 1
1 851 . 10 1 1 A 93 93 LEU C C 71 172.570 173.478 -0.908 1
1 852 . 10 1 1 A 93 93 LEU CA C 71 52.820 45.454 7.366 1
1 857 . 10 1 1 A 93 93 LEU N N 71 123.360 102.724 20.636 1
1 858 . 10 1 1 A 94 94 VAL H H 72 9.110 7.210 1.900 1
1 859 . 10 1 1 A 94 94 VAL HA H 72 4.080 4.867 -0.787 1
1 864 . 10 1 1 A 94 94 VAL C C 72 171.160 175.180 -4.020 1
1 865 . 10 1 1 A 94 94 VAL CA C 72 61.350 54.229 7.121 1
1 866 . 10 1 1 A 94 94 VAL CB C 72 34.640 35.824 -1.184 1
1 868 . 10 1 1 A 94 94 VAL N N 72 128.650 114.850 13.800 1
1 869 . 10 1 1 A 95 95 ILE H H 73 8.150 8.208 -0.058 1
1 870 . 10 1 1 A 95 95 ILE HA H 73 4.500 4.696 -0.196 1
1 880 . 10 1 1 A 95 95 ILE C C 73 174.320 175.896 -1.576 1
1 881 . 10 1 1 A 95 95 ILE CA C 73 60.170 60.611 -0.441 1
1 882 . 10 1 1 A 95 95 ILE CB C 73 38.120 38.963 -0.843 1
1 886 . 10 1 1 A 95 95 ILE N N 73 125.560 119.276 6.284 1
1 887 . 10 1 1 A 96 96 LYS H H 74 9.280 8.589 0.691 1
1 888 . 10 1 1 A 96 96 LYS HA H 74 4.240 4.281 -0.041 1
1 891 . 10 1 1 A 96 96 LYS C C 74 173.510 176.692 -3.182 1
1 892 . 10 1 1 A 96 96 LYS CA C 74 56.730 54.877 1.853 1
1 893 . 10 1 1 A 96 96 LYS CB C 74 33.100 42.197 -9.097 1
1 894 . 10 1 1 A 96 96 LYS N N 74 129.290 126.232 3.058 1
1 895 . 10 1 1 A 97 97 THR H H 75 8.040 8.982 -0.942 1
1 896 . 10 1 1 A 97 97 THR HA H 75 4.230 4.612 -0.382 1
1 901 . 10 1 1 A 97 97 THR C C 75 171.800 177.340 -5.540 1
1 902 . 10 1 1 A 97 97 THR CA C 75 61.760 54.634 7.126 1
1 903 . 10 1 1 A 97 97 THR CB C 75 69.830 34.632 35.198 1
1 905 . 10 1 1 A 97 97 THR N N 75 114.420 122.478 -8.058 1
1 906 . 10 1 1 A 98 98 GLN H H 76 8.400 8.998 -0.598 1
1 907 . 10 1 1 A 98 98 GLN HA H 76 4.210 4.392 -0.182 1
1 914 . 10 1 1 A 98 98 GLN CA C 76 55.880 56.978 -1.098 1
1 915 . 10 1 1 A 98 98 GLN CB C 76 29.700 39.853 -10.153 1
1 917 . 10 1 1 A 98 98 GLN N N 76 122.370 121.552 0.818 1
1 919 . 10 1 1 A 99 99 ASN HA H 77 4.590 4.287 0.303 1
1 924 . 10 1 1 A 99 99 ASN C C 77 171.780 175.341 -3.561 1
1 925 . 10 1 1 A 99 99 ASN CA C 77 53.300 56.777 -3.477 1
1 926 . 10 1 1 A 99 99 ASN CB C 77 38.920 28.064 10.856 1
1 928 . 10 1 1 A 100 100 ARG H H 78 8.160 7.486 0.674 1
1 929 . 10 1 1 A 100 100 ARG HA H 78 4.560 4.948 -0.388 1
1 936 . 10 1 1 A 100 100 ARG CA C 78 53.860 53.773 0.087 1
1 937 . 10 1 1 A 100 100 ARG CB C 78 30.210 42.813 -12.603 1
1 940 . 10 1 1 A 100 100 ARG N N 78 122.840 121.648 1.192 1
1 941 . 10 1 1 A 101 101 PRO HA H 79 4.150 4.924 -0.774 1
1 948 . 10 1 1 A 101 101 PRO CA C 79 64.770 59.332 5.438 1
1 949 . 10 1 1 A 101 101 PRO CB C 79 32.040 71.775 -39.735 1
1 289 . 11 1 1 A 46 46 SER H H 24 8.950 8.467 0.483 1
1 290 . 11 1 1 A 46 46 SER HA H 24 4.900 4.485 0.415 1
1 293 . 11 1 1 A 46 46 SER C C 24 170.890 176.286 -5.396 1
1 294 . 11 1 1 A 46 46 SER CA C 24 56.980 56.021 0.959 1
1 295 . 11 1 1 A 46 46 SER CB C 24 65.590 33.307 32.283 1
1 296 . 11 1 1 A 46 46 SER N N 24 120.420 121.125 -0.705 1
1 297 . 11 1 1 A 47 47 VAL H H 25 9.140 8.293 0.847 1
1 298 . 11 1 1 A 47 47 VAL HA H 25 3.440 4.284 -0.844 1
1 306 . 11 1 1 A 47 47 VAL C C 25 175.060 175.628 -0.568 1
1 307 . 11 1 1 A 47 47 VAL CA C 25 67.250 61.239 6.011 1
1 308 . 11 1 1 A 47 47 VAL CB C 25 30.780 39.236 -8.456 1
1 311 . 11 1 1 A 47 47 VAL N N 25 123.970 126.160 -2.190 1
1 312 . 11 1 1 A 48 48 GLN H H 26 8.540 8.607 -0.067 1
1 313 . 11 1 1 A 48 48 GLN HA H 26 4.070 4.705 -0.635 1
1 320 . 11 1 1 A 48 48 GLN CA C 26 60.230 55.266 4.964 1
1 321 . 11 1 1 A 48 48 GLN CB C 26 28.490 33.225 -4.735 1
1 323 . 11 1 1 A 48 48 GLN N N 26 120.550 127.764 -7.214 1
1 325 . 11 1 1 A 49 49 GLN HA H 27 3.950 4.860 -0.910 1
1 332 . 11 1 1 A 49 49 GLN C C 27 176.230 175.393 0.837 1
1 333 . 11 1 1 A 49 49 GLN CA C 27 58.710 55.685 3.025 1
1 334 . 11 1 1 A 49 49 GLN CB C 27 28.820 31.787 -2.967 1
1 337 . 11 1 1 A 50 50 PHE H H 28 8.050 8.601 -0.551 1
1 338 . 11 1 1 A 50 50 PHE HA H 28 4.620 4.638 -0.018 1
1 345 . 11 1 1 A 50 50 PHE C C 28 175.190 175.425 -0.235 1
1 346 . 11 1 1 A 50 50 PHE CA C 28 58.030 61.848 -3.818 1
1 347 . 11 1 1 A 50 50 PHE CB C 28 39.190 32.041 7.149 1
1 350 . 11 1 1 A 50 50 PHE N N 28 121.710 125.249 -3.539 1
1 351 . 11 1 1 A 51 51 LYS H H 29 8.940 8.314 0.626 1
1 352 . 11 1 1 A 51 51 LYS HA H 29 3.340 4.752 -1.412 1
1 361 . 11 1 1 A 51 51 LYS C C 29 175.370 174.260 1.110 1
1 362 . 11 1 1 A 51 51 LYS CA C 29 60.660 62.701 -2.041 1
1 363 . 11 1 1 A 51 51 LYS CB C 29 33.190 70.110 -36.920 1
1 367 . 11 1 1 A 51 51 LYS N N 29 117.530 123.600 -6.070 1
1 368 . 11 1 1 A 52 52 GLU H H 30 7.700 9.104 -1.404 1
1 369 . 11 1 1 A 52 52 GLU HA H 30 3.750 4.963 -1.213 1
1 374 . 11 1 1 A 52 52 GLU C C 30 176.780 174.149 2.631 1
1 375 . 11 1 1 A 52 52 GLU CA C 30 59.890 60.483 -0.593 1
1 376 . 11 1 1 A 52 52 GLU CB C 30 28.840 35.362 -6.522 1
1 378 . 11 1 1 A 52 52 GLU N N 30 118.820 125.451 -6.631 1
1 379 . 11 1 1 A 53 53 GLU H H 31 7.370 9.139 -1.769 1
1 380 . 11 1 1 A 53 53 GLU HA H 31 4.150 5.180 -1.030 1
1 385 . 11 1 1 A 53 53 GLU C C 31 177.040 175.450 1.590 1
1 386 . 11 1 1 A 53 53 GLU CA C 31 58.860 54.530 4.330 1
1 387 . 11 1 1 A 53 53 GLU CB C 31 29.200 35.504 -6.304 1
1 389 . 11 1 1 A 53 53 GLU N N 31 119.150 128.493 -9.343 1
1 390 . 11 1 1 A 54 54 ILE H H 32 8.000 8.937 -0.937 1
1 391 . 11 1 1 A 54 54 ILE HA H 32 3.550 5.077 -1.527 1
1 401 . 11 1 1 A 54 54 ILE C C 32 175.420 174.255 1.165 1
1 402 . 11 1 1 A 54 54 ILE CA C 32 64.690 58.657 6.033 1
1 403 . 11 1 1 A 54 54 ILE CB C 32 37.820 69.749 -31.929 1
1 407 . 11 1 1 A 54 54 ILE N N 32 119.970 117.558 2.412 1
1 409 . 11 1 1 A 55 55 SER HA H 33 3.930 4.465 -0.535 1
1 412 . 11 1 1 A 55 55 SER C C 33 173.830 177.644 -3.814 1
1 413 . 11 1 1 A 55 55 SER CA C 33 61.620 64.569 -2.949 1
1 414 . 11 1 1 A 55 55 SER CB C 33 62.720 31.815 30.905 1
1 415 . 11 1 1 A 55 55 SER N N 33 115.780 136.699 -20.919 1
1 416 . 11 1 1 A 56 56 LYS H H 34 7.150 8.536 -1.386 1
1 417 . 11 1 1 A 56 56 LYS HA H 34 4.090 4.277 -0.187 1
1 424 . 11 1 1 A 56 56 LYS C C 34 176.080 176.754 -0.674 1
1 425 . 11 1 1 A 56 56 LYS CA C 34 58.950 57.190 1.760 1
1 426 . 11 1 1 A 56 56 LYS CB C 34 32.540 33.848 -1.308 1
1 429 . 11 1 1 A 56 56 LYS N N 34 119.100 116.915 2.185 1
1 430 . 11 1 1 A 57 57 ARG H H 35 7.530 7.802 -0.272 1
1 431 . 11 1 1 A 57 57 ARG HA H 35 4.110 4.685 -0.575 1
1 436 . 11 1 1 A 57 57 ARG C C 35 174.800 173.754 1.046 1
1 437 . 11 1 1 A 57 57 ARG CA C 35 57.090 55.537 1.553 1
1 438 . 11 1 1 A 57 57 ARG CB C 35 29.810 30.815 -1.005 1
1 440 . 11 1 1 A 57 57 ARG N N 35 119.370 114.106 5.264 1
1 441 . 11 1 1 A 58 58 PHE H H 36 8.320 8.526 -0.206 1
1 442 . 11 1 1 A 58 58 PHE HA H 36 4.340 5.207 -0.867 1
1 449 . 11 1 1 A 58 58 PHE C C 36 171.940 174.499 -2.559 1
1 450 . 11 1 1 A 58 58 PHE CA C 36 58.500 55.388 3.112 1
1 451 . 11 1 1 A 58 58 PHE CB C 36 38.130 36.488 1.642 1
1 454 . 11 1 1 A 58 58 PHE N N 36 113.980 121.159 -7.179 1
1 455 . 11 1 1 A 59 59 LYS H H 37 7.790 8.935 -1.145 1
1 456 . 11 1 1 A 59 59 LYS HA H 37 3.960 4.760 -0.800 1
1 463 . 11 1 1 A 59 59 LYS C C 37 172.670 173.585 -0.915 1
1 464 . 11 1 1 A 59 59 LYS CA C 37 57.140 55.057 2.083 1
1 465 . 11 1 1 A 59 59 LYS CB C 37 29.020 33.181 -4.161 1
1 468 . 11 1 1 A 59 59 LYS N N 37 118.810 124.882 -6.072 1
1 469 . 11 1 1 A 60 60 SER H H 38 7.750 8.661 -0.911 1
1 470 . 11 1 1 A 60 60 SER HA H 38 4.700 4.931 -0.231 1
1 473 . 11 1 1 A 60 60 SER C C 38 170.170 175.062 -4.892 1
1 474 . 11 1 1 A 60 60 SER CA C 38 57.130 55.139 1.991 1
1 475 . 11 1 1 A 60 60 SER CB C 38 66.820 31.828 34.992 1
1 476 . 11 1 1 A 60 60 SER N N 38 112.620 126.770 -14.150 1
1 477 . 11 1 1 A 61 61 HIS H H 39 8.630 9.247 -0.617 1
1 478 . 11 1 1 A 61 61 HIS N N 39 124.090 125.132 -1.042 1
1 479 . 11 1 1 A 62 62 THR HA H 40 3.610 5.157 -1.547 1
1 484 . 11 1 1 A 62 62 THR C C 40 174.350 176.025 -1.675 1
1 485 . 11 1 1 A 62 62 THR CA C 40 66.160 50.900 15.260 1
1 486 . 11 1 1 A 62 62 THR CB C 40 68.070 20.477 47.593 1
1 488 . 11 1 1 A 63 63 ASP H H 41 10.310 8.751 1.559 1
1 489 . 11 1 1 A 63 63 ASP HA H 41 4.420 4.992 -0.572 1
1 492 . 11 1 1 A 63 63 ASP C C 41 174.630 175.126 -0.496 1
1 493 . 11 1 1 A 63 63 ASP CA C 41 56.330 58.005 -1.675 1
1 494 . 11 1 1 A 63 63 ASP CB C 41 40.040 34.303 5.737 1
1 495 . 11 1 1 A 63 63 ASP N N 41 122.900 117.737 5.163 1
1 497 . 11 1 1 A 64 64 GLN HA H 42 4.270 4.520 -0.250 1
1 504 . 11 1 1 A 64 64 GLN C C 42 172.160 177.814 -5.654 1
1 505 . 11 1 1 A 64 64 GLN CA C 42 55.860 63.459 -7.599 1
1 506 . 11 1 1 A 64 64 GLN CB C 42 30.480 31.972 -1.492 1
1 508 . 11 1 1 A 64 64 GLN N N 42 115.750 137.933 -22.183 1
1 510 . 11 1 1 A 65 65 LEU H H 43 7.250 8.185 -0.935 1
1 511 . 11 1 1 A 65 65 LEU HA H 43 4.440 3.948 0.492 1
1 517 . 11 1 1 A 65 65 LEU C C 43 173.160 176.105 -2.945 1
1 518 . 11 1 1 A 65 65 LEU CA C 43 54.620 57.509 -2.889 1
1 519 . 11 1 1 A 65 65 LEU CB C 43 41.990 27.432 14.558 1
1 521 . 11 1 1 A 65 65 LEU N N 43 116.570 118.162 -1.592 1
1 522 . 11 1 1 A 66 66 VAL H H 44 8.690 7.947 0.743 1
1 523 . 11 1 1 A 66 66 VAL HA H 44 3.980 4.956 -0.976 1
1 528 . 11 1 1 A 66 66 VAL C C 44 171.340 175.399 -4.059 1
1 529 . 11 1 1 A 66 66 VAL CA C 44 61.910 53.282 8.628 1
1 530 . 11 1 1 A 66 66 VAL CB C 44 33.630 40.073 -6.443 1
1 532 . 11 1 1 A 66 66 VAL N N 44 125.260 118.414 6.846 1
1 533 . 11 1 1 A 67 67 LEU H H 45 8.570 7.762 0.808 1
1 534 . 11 1 1 A 67 67 LEU HA H 45 5.220 4.370 0.850 1
1 544 . 11 1 1 A 67 67 LEU C C 45 172.500 174.091 -1.591 1
1 545 . 11 1 1 A 67 67 LEU CA C 45 52.820 60.194 -7.374 1
1 546 . 11 1 1 A 67 67 LEU CB C 45 45.310 63.527 -18.217 1
1 550 . 11 1 1 A 67 67 LEU N N 45 126.690 116.653 10.037 1
1 551 . 11 1 1 A 68 68 ILE H H 46 9.040 8.750 0.290 1
1 552 . 11 1 1 A 68 68 ILE HA H 46 4.880 4.698 0.182 1
1 562 . 11 1 1 A 68 68 ILE C C 46 172.390 176.203 -3.813 1
1 563 . 11 1 1 A 68 68 ILE CA C 46 59.900 57.645 2.255 1
1 564 . 11 1 1 A 68 68 ILE CB C 46 41.940 65.169 -23.229 1
1 568 . 11 1 1 A 68 68 ILE N N 46 122.590 121.354 1.236 1
1 569 . 11 1 1 A 69 69 PHE H H 47 8.740 8.429 0.311 1
1 570 . 11 1 1 A 69 69 PHE N N 47 125.360 121.868 3.492 1
1 571 . 11 1 1 A 70 70 ALA HA H 48 3.600 4.046 -0.446 1
1 575 . 11 1 1 A 70 70 ALA C C 48 174.500 177.915 -3.415 1
1 576 . 11 1 1 A 70 70 ALA CA C 48 52.520 58.803 -6.283 1
1 577 . 11 1 1 A 70 70 ALA CB C 48 16.760 28.346 -11.586 1
1 578 . 11 1 1 A 71 71 GLY H H 49 8.210 7.742 0.468 1
1 581 . 11 1 1 A 71 71 GLY C C 49 170.850 178.005 -7.155 1
1 582 . 11 1 1 A 71 71 GLY CA C 49 45.380 57.798 -12.418 1
1 583 . 11 1 1 A 71 71 GLY N N 49 102.430 118.191 -15.761 1
1 584 . 11 1 1 A 72 72 LYS H H 50 7.840 8.090 -0.250 1
1 585 . 11 1 1 A 72 72 LYS HA H 50 4.530 4.092 0.438 1
1 594 . 11 1 1 A 72 72 LYS C C 50 171.800 177.656 -5.856 1
1 595 . 11 1 1 A 72 72 LYS CA C 50 54.630 61.105 -6.475 1
1 596 . 11 1 1 A 72 72 LYS CB C 50 34.630 39.107 -4.477 1
1 600 . 11 1 1 A 72 72 LYS N N 50 121.570 120.757 0.813 1
1 601 . 11 1 1 A 73 73 ILE H H 51 8.250 8.187 0.063 1
1 602 . 11 1 1 A 73 73 ILE HA H 51 4.260 3.814 0.446 1
1 612 . 11 1 1 A 73 73 ILE C C 51 174.300 178.279 -3.979 1
1 613 . 11 1 1 A 73 73 ILE CA C 51 61.270 58.142 3.128 1
1 614 . 11 1 1 A 73 73 ILE CB C 51 38.150 31.192 6.958 1
1 618 . 11 1 1 A 73 73 ILE N N 51 122.710 117.844 4.866 1
1 619 . 11 1 1 A 74 74 LEU H H 52 8.540 8.291 0.249 1
1 620 . 11 1 1 A 74 74 LEU HA H 52 3.980 4.104 -0.124 1
1 630 . 11 1 1 A 74 74 LEU C C 52 173.440 179.154 -5.714 1
1 631 . 11 1 1 A 74 74 LEU CA C 52 54.660 58.897 -4.237 1
1 632 . 11 1 1 A 74 74 LEU CB C 52 41.790 29.343 12.447 1
1 636 . 11 1 1 A 74 74 LEU N N 52 128.360 119.017 9.343 1
1 637 . 11 1 1 A 75 75 LYS H H 53 8.100 7.941 0.159 1
1 638 . 11 1 1 A 75 75 LYS HA H 53 4.440 4.058 0.382 1
1 645 . 11 1 1 A 75 75 LYS C C 53 175.170 179.478 -4.308 1
1 646 . 11 1 1 A 75 75 LYS CA C 53 55.340 58.962 -3.622 1
1 647 . 11 1 1 A 75 75 LYS CB C 53 32.680 29.333 3.347 1
1 650 . 11 1 1 A 75 75 LYS N N 53 123.470 119.957 3.513 1
1 651 . 11 1 1 A 76 76 ASP H H 54 8.310 7.302 1.008 1
1 652 . 11 1 1 A 76 76 ASP HA H 54 4.110 3.667 0.443 1
1 655 . 11 1 1 A 76 76 ASP C C 54 174.270 177.995 -3.725 1
1 656 . 11 1 1 A 76 76 ASP CA C 54 58.140 64.767 -6.627 1
1 657 . 11 1 1 A 76 76 ASP CB C 54 40.760 37.434 3.326 1
1 658 . 11 1 1 A 76 76 ASP N N 54 121.080 121.239 -0.159 1
1 659 . 11 1 1 A 77 77 GLN H H 55 8.180 8.086 0.094 1
1 660 . 11 1 1 A 77 77 GLN HA H 55 4.360 4.197 0.163 1
1 667 . 11 1 1 A 77 77 GLN C C 55 173.710 176.644 -2.934 1
1 668 . 11 1 1 A 77 77 GLN CA C 55 56.350 61.333 -4.983 1
1 669 . 11 1 1 A 77 77 GLN CB C 55 28.090 62.591 -34.501 1
1 671 . 11 1 1 A 77 77 GLN N N 55 113.190 115.381 -2.191 1
1 673 . 11 1 1 A 78 78 ASP H H 56 7.770 7.647 0.123 1
1 674 . 11 1 1 A 78 78 ASP HA H 56 4.700 4.054 0.646 1
1 677 . 11 1 1 A 78 78 ASP C C 56 173.500 178.723 -5.223 1
1 678 . 11 1 1 A 78 78 ASP CA C 56 54.140 59.236 -5.096 1
1 679 . 11 1 1 A 78 78 ASP CB C 56 42.020 31.904 10.116 1
1 680 . 11 1 1 A 78 78 ASP N N 56 121.910 119.621 2.289 1
1 681 . 11 1 1 A 79 79 THR H H 57 8.490 7.939 0.551 1
1 682 . 11 1 1 A 79 79 THR HA H 57 4.700 3.982 0.718 1
1 687 . 11 1 1 A 79 79 THR C C 57 172.840 178.248 -5.408 1
1 688 . 11 1 1 A 79 79 THR CA C 57 59.980 59.054 0.926 1
1 689 . 11 1 1 A 79 79 THR CB C 57 70.640 30.054 40.586 1
1 691 . 11 1 1 A 79 79 THR N N 57 108.860 119.988 -11.128 1
1 692 . 11 1 1 A 80 80 LEU H H 58 7.700 7.874 -0.174 1
1 693 . 11 1 1 A 80 80 LEU HA H 58 3.880 4.612 -0.732 1
1 703 . 11 1 1 A 80 80 LEU C C 58 177.370 174.744 2.626 1
1 704 . 11 1 1 A 80 80 LEU CA C 58 58.450 57.496 0.954 1
1 705 . 11 1 1 A 80 80 LEU CB C 58 39.500 38.957 0.543 1
1 709 . 11 1 1 A 80 80 LEU N N 58 118.820 116.432 2.388 1
1 710 . 11 1 1 A 81 81 SER H H 59 8.810 7.534 1.276 1
1 711 . 11 1 1 A 81 81 SER HA H 59 4.050 3.782 0.268 1
1 714 . 11 1 1 A 81 81 SER C C 59 176.150 174.669 1.481 1
1 715 . 11 1 1 A 81 81 SER CA C 59 61.190 57.426 3.764 1
1 716 . 11 1 1 A 81 81 SER CB C 59 62.490 29.300 33.190 1
1 717 . 11 1 1 A 81 81 SER N N 59 114.240 116.346 -2.106 1
1 718 . 11 1 1 A 82 82 GLN H H 60 7.950 7.674 0.276 1
1 719 . 11 1 1 A 82 82 GLN HA H 60 4.090 4.926 -0.836 1
1 726 . 11 1 1 A 82 82 GLN C C 60 173.930 172.982 0.948 1
1 727 . 11 1 1 A 82 82 GLN CA C 60 58.080 55.721 2.359 1
1 728 . 11 1 1 A 82 82 GLN CB C 60 28.460 65.846 -37.386 1
1 730 . 11 1 1 A 82 82 GLN N N 60 122.620 113.213 9.407 1
1 732 . 11 1 1 A 83 83 HIS H H 61 6.990 8.422 -1.432 1
1 733 . 11 1 1 A 83 83 HIS HA H 61 4.490 4.895 -0.405 1
1 736 . 11 1 1 A 83 83 HIS C C 61 172.260 176.878 -4.618 1
1 737 . 11 1 1 A 83 83 HIS CA C 61 57.110 55.803 1.307 1
1 738 . 11 1 1 A 83 83 HIS CB C 61 32.780 30.876 1.904 1
1 739 . 11 1 1 A 83 83 HIS N N 61 116.940 120.570 -3.630 1
1 740 . 11 1 1 A 84 84 GLY H H 62 7.870 9.168 -1.298 1
1 743 . 11 1 1 A 84 84 GLY C C 62 171.040 176.348 -5.308 1
1 744 . 11 1 1 A 84 84 GLY CA C 62 45.390 65.815 -20.425 1
1 745 . 11 1 1 A 84 84 GLY N N 62 106.740 117.356 -10.616 1
1 746 . 11 1 1 A 85 85 ILE H H 63 6.810 8.309 -1.499 1
1 747 . 11 1 1 A 85 85 ILE HA H 63 3.050 4.406 -1.356 1
1 757 . 11 1 1 A 85 85 ILE C C 63 170.130 178.060 -7.930 1
1 758 . 11 1 1 A 85 85 ILE CA C 63 62.440 57.639 4.801 1
1 759 . 11 1 1 A 85 85 ILE CB C 63 36.110 42.370 -6.260 1
1 763 . 11 1 1 A 85 85 ILE N N 63 118.920 121.582 -2.662 1
1 764 . 11 1 1 A 86 86 HIS H H 64 6.020 7.590 -1.570 1
1 765 . 11 1 1 A 86 86 HIS HA H 64 5.030 4.327 0.703 1
1 768 . 11 1 1 A 86 86 HIS C C 64 170.090 176.020 -5.930 1
1 769 . 11 1 1 A 86 86 HIS CA C 64 53.500 57.086 -3.586 1
1 770 . 11 1 1 A 86 86 HIS CB C 64 31.860 29.643 2.217 1
1 771 . 11 1 1 A 86 86 HIS N N 64 122.440 115.973 6.467 1
1 772 . 11 1 1 A 87 87 ASP H H 65 8.340 7.625 0.715 1
1 773 . 11 1 1 A 87 87 ASP HA H 65 4.320 5.362 -1.042 1
1 776 . 11 1 1 A 87 87 ASP C C 65 174.370 176.134 -1.764 1
1 777 . 11 1 1 A 87 87 ASP CA C 65 56.440 53.086 3.354 1
1 778 . 11 1 1 A 87 87 ASP CB C 65 43.150 44.397 -1.247 1
1 779 . 11 1 1 A 87 87 ASP N N 65 116.230 116.728 -0.498 1
1 780 . 11 1 1 A 88 88 GLY H H 66 9.330 8.875 0.455 1
1 783 . 11 1 1 A 88 88 GLY C C 66 172.330 173.999 -1.669 1
1 784 . 11 1 1 A 88 88 GLY CA C 66 45.270 59.438 -14.168 1
1 785 . 11 1 1 A 88 88 GLY N N 66 112.300 119.252 -6.952 1
1 786 . 11 1 1 A 89 89 LEU H H 67 7.640 8.718 -1.078 1
1 787 . 11 1 1 A 89 89 LEU HA H 67 4.720 5.081 -0.361 1
1 797 . 11 1 1 A 89 89 LEU C C 67 172.460 175.995 -3.535 1
1 798 . 11 1 1 A 89 89 LEU CA C 67 54.420 53.751 0.669 1
1 799 . 11 1 1 A 89 89 LEU CB C 67 42.260 43.320 -1.060 1
1 803 . 11 1 1 A 89 89 LEU N N 67 120.310 126.112 -5.802 1
1 804 . 11 1 1 A 90 90 THR H H 68 8.110 8.810 -0.700 1
1 805 . 11 1 1 A 90 90 THR HA H 68 5.300 5.276 0.024 1
1 810 . 11 1 1 A 90 90 THR C C 68 170.900 174.863 -3.963 1
1 811 . 11 1 1 A 90 90 THR CA C 68 61.870 60.178 1.692 1
1 812 . 11 1 1 A 90 90 THR CB C 68 71.320 41.136 30.184 1
1 814 . 11 1 1 A 90 90 THR N N 68 115.300 122.452 -7.152 1
1 815 . 11 1 1 A 91 91 VAL H H 69 9.290 9.092 0.198 1
1 816 . 11 1 1 A 91 91 VAL HA H 69 4.540 4.797 -0.257 1
1 824 . 11 1 1 A 91 91 VAL C C 69 170.890 174.747 -3.857 1
1 825 . 11 1 1 A 91 91 VAL CA C 69 60.310 57.715 2.595 1
1 826 . 11 1 1 A 91 91 VAL CB C 69 34.680 42.698 -8.018 1
1 829 . 11 1 1 A 91 91 VAL N N 69 124.200 126.731 -2.531 1
1 830 . 11 1 1 A 92 92 HIS H H 70 8.750 8.495 0.255 1
1 831 . 11 1 1 A 92 92 HIS HA H 70 5.020 3.782 1.238 1
1 835 . 11 1 1 A 92 92 HIS C C 70 170.890 177.201 -6.311 1
1 836 . 11 1 1 A 92 92 HIS CA C 70 56.750 53.134 3.616 1
1 837 . 11 1 1 A 92 92 HIS CB C 70 32.220 17.901 14.319 1
1 839 . 11 1 1 A 92 92 HIS N N 70 125.250 129.160 -3.910 1
1 840 . 11 1 1 A 93 93 LEU H H 71 8.290 8.506 -0.216 1
1 851 . 11 1 1 A 93 93 LEU C C 71 172.570 173.564 -0.994 1
1 852 . 11 1 1 A 93 93 LEU CA C 71 52.820 45.375 7.445 1
1 857 . 11 1 1 A 93 93 LEU N N 71 123.360 102.850 20.510 1
1 858 . 11 1 1 A 94 94 VAL H H 72 9.110 7.404 1.706 1
1 859 . 11 1 1 A 94 94 VAL HA H 72 4.080 4.948 -0.868 1
1 864 . 11 1 1 A 94 94 VAL C C 72 171.160 175.458 -4.298 1
1 865 . 11 1 1 A 94 94 VAL CA C 72 61.350 54.439 6.911 1
1 866 . 11 1 1 A 94 94 VAL CB C 72 34.640 35.341 -0.701 1
1 868 . 11 1 1 A 94 94 VAL N N 72 128.650 115.847 12.803 1
1 869 . 11 1 1 A 95 95 ILE H H 73 8.150 8.299 -0.149 1
1 870 . 11 1 1 A 95 95 ILE HA H 73 4.500 4.349 0.151 1
1 880 . 11 1 1 A 95 95 ILE C C 73 174.320 175.726 -1.406 1
1 881 . 11 1 1 A 95 95 ILE CA C 73 60.170 60.891 -0.721 1
1 882 . 11 1 1 A 95 95 ILE CB C 73 38.120 38.256 -0.136 1
1 886 . 11 1 1 A 95 95 ILE N N 73 125.560 119.039 6.521 1
1 887 . 11 1 1 A 96 96 LYS H H 74 9.280 8.766 0.514 1
1 888 . 11 1 1 A 96 96 LYS HA H 74 4.240 4.541 -0.301 1
1 891 . 11 1 1 A 96 96 LYS C C 74 173.510 176.278 -2.768 1
1 892 . 11 1 1 A 96 96 LYS CA C 74 56.730 54.330 2.400 1
1 893 . 11 1 1 A 96 96 LYS CB C 74 33.100 40.521 -7.421 1
1 894 . 11 1 1 A 96 96 LYS N N 74 129.290 128.273 1.017 1
1 895 . 11 1 1 A 97 97 THR H H 75 8.040 8.795 -0.755 1
1 896 . 11 1 1 A 97 97 THR HA H 75 4.230 4.585 -0.355 1
1 901 . 11 1 1 A 97 97 THR C C 75 171.800 177.491 -5.691 1
1 902 . 11 1 1 A 97 97 THR CA C 75 61.760 55.282 6.478 1
1 903 . 11 1 1 A 97 97 THR CB C 75 69.830 33.933 35.897 1
1 905 . 11 1 1 A 97 97 THR N N 75 114.420 125.043 -10.623 1
1 906 . 11 1 1 A 98 98 GLN H H 76 8.400 8.887 -0.487 1
1 907 . 11 1 1 A 98 98 GLN HA H 76 4.210 4.459 -0.249 1
1 914 . 11 1 1 A 98 98 GLN CA C 76 55.880 56.602 -0.722 1
1 915 . 11 1 1 A 98 98 GLN CB C 76 29.700 39.919 -10.219 1
1 917 . 11 1 1 A 98 98 GLN N N 76 122.370 121.107 1.263 1
1 919 . 11 1 1 A 99 99 ASN HA H 77 4.590 4.245 0.345 1
1 924 . 11 1 1 A 99 99 ASN C C 77 171.780 175.379 -3.599 1
1 925 . 11 1 1 A 99 99 ASN CA C 77 53.300 56.938 -3.638 1
1 926 . 11 1 1 A 99 99 ASN CB C 77 38.920 28.075 10.845 1
1 928 . 11 1 1 A 100 100 ARG H H 78 8.160 7.671 0.489 1
1 929 . 11 1 1 A 100 100 ARG HA H 78 4.560 5.173 -0.613 1
1 936 . 11 1 1 A 100 100 ARG CA C 78 53.860 52.753 1.107 1
1 937 . 11 1 1 A 100 100 ARG CB C 78 30.210 43.291 -13.081 1
1 940 . 11 1 1 A 100 100 ARG N N 78 122.840 120.943 1.897 1
1 941 . 11 1 1 A 101 101 PRO HA H 79 4.150 5.028 -0.878 1
1 948 . 11 1 1 A 101 101 PRO CA C 79 64.770 59.413 5.357 1
1 949 . 11 1 1 A 101 101 PRO CB C 79 32.040 71.866 -39.826 1
1 289 . 12 1 1 A 46 46 SER H H 24 8.950 8.479 0.471 1
1 290 . 12 1 1 A 46 46 SER HA H 24 4.900 4.458 0.442 1
1 293 . 12 1 1 A 46 46 SER C C 24 170.890 176.162 -5.272 1
1 294 . 12 1 1 A 46 46 SER CA C 24 56.980 55.775 1.205 1
1 295 . 12 1 1 A 46 46 SER CB C 24 65.590 33.514 32.076 1
1 296 . 12 1 1 A 46 46 SER N N 24 120.420 122.654 -2.234 1
1 297 . 12 1 1 A 47 47 VAL H H 25 9.140 8.233 0.907 1
1 298 . 12 1 1 A 47 47 VAL HA H 25 3.440 4.285 -0.845 1
1 306 . 12 1 1 A 47 47 VAL C C 25 175.060 175.476 -0.416 1
1 307 . 12 1 1 A 47 47 VAL CA C 25 67.250 61.145 6.105 1
1 308 . 12 1 1 A 47 47 VAL CB C 25 30.780 39.351 -8.571 1
1 311 . 12 1 1 A 47 47 VAL N N 25 123.970 125.938 -1.968 1
1 312 . 12 1 1 A 48 48 GLN H H 26 8.540 8.414 0.126 1
1 313 . 12 1 1 A 48 48 GLN HA H 26 4.070 4.752 -0.682 1
1 320 . 12 1 1 A 48 48 GLN CA C 26 60.230 55.154 5.076 1
1 321 . 12 1 1 A 48 48 GLN CB C 26 28.490 33.291 -4.801 1
1 323 . 12 1 1 A 48 48 GLN N N 26 120.550 127.224 -6.674 1
1 325 . 12 1 1 A 49 49 GLN HA H 27 3.950 4.915 -0.965 1
1 332 . 12 1 1 A 49 49 GLN C C 27 176.230 175.355 0.875 1
1 333 . 12 1 1 A 49 49 GLN CA C 27 58.710 55.631 3.079 1
1 334 . 12 1 1 A 49 49 GLN CB C 27 28.820 32.431 -3.611 1
1 337 . 12 1 1 A 50 50 PHE H H 28 8.050 8.654 -0.604 1
1 338 . 12 1 1 A 50 50 PHE HA H 28 4.620 4.629 -0.009 1
1 345 . 12 1 1 A 50 50 PHE C C 28 175.190 175.603 -0.413 1
1 346 . 12 1 1 A 50 50 PHE CA C 28 58.030 62.002 -3.972 1
1 347 . 12 1 1 A 50 50 PHE CB C 28 39.190 32.306 6.884 1
1 350 . 12 1 1 A 50 50 PHE N N 28 121.710 125.311 -3.601 1
1 351 . 12 1 1 A 51 51 LYS H H 29 8.940 8.445 0.495 1
1 352 . 12 1 1 A 51 51 LYS HA H 29 3.340 4.669 -1.329 1
1 361 . 12 1 1 A 51 51 LYS C C 29 175.370 174.316 1.054 1
1 362 . 12 1 1 A 51 51 LYS CA C 29 60.660 62.682 -2.022 1
1 363 . 12 1 1 A 51 51 LYS CB C 29 33.190 70.015 -36.825 1
1 367 . 12 1 1 A 51 51 LYS N N 29 117.530 123.204 -5.674 1
1 368 . 12 1 1 A 52 52 GLU H H 30 7.700 8.928 -1.228 1
1 369 . 12 1 1 A 52 52 GLU HA H 30 3.750 5.149 -1.399 1
1 374 . 12 1 1 A 52 52 GLU C C 30 176.780 174.553 2.227 1
1 375 . 12 1 1 A 52 52 GLU CA C 30 59.890 60.608 -0.718 1
1 376 . 12 1 1 A 52 52 GLU CB C 30 28.840 35.010 -6.170 1
1 378 . 12 1 1 A 52 52 GLU N N 30 118.820 125.678 -6.858 1
1 379 . 12 1 1 A 53 53 GLU H H 31 7.370 8.920 -1.550 1
1 380 . 12 1 1 A 53 53 GLU HA H 31 4.150 5.491 -1.341 1
1 385 . 12 1 1 A 53 53 GLU C C 31 177.040 175.014 2.026 1
1 386 . 12 1 1 A 53 53 GLU CA C 31 58.860 54.717 4.143 1
1 387 . 12 1 1 A 53 53 GLU CB C 31 29.200 36.207 -7.007 1
1 389 . 12 1 1 A 53 53 GLU N N 31 119.150 127.903 -8.753 1
1 390 . 12 1 1 A 54 54 ILE H H 32 8.000 8.891 -0.891 1
1 391 . 12 1 1 A 54 54 ILE HA H 32 3.550 5.116 -1.566 1
1 401 . 12 1 1 A 54 54 ILE C C 32 175.420 174.029 1.391 1
1 402 . 12 1 1 A 54 54 ILE CA C 32 64.690 58.630 6.060 1
1 403 . 12 1 1 A 54 54 ILE CB C 32 37.820 69.673 -31.853 1
1 407 . 12 1 1 A 54 54 ILE N N 32 119.970 117.336 2.634 1
1 409 . 12 1 1 A 55 55 SER HA H 33 3.930 4.566 -0.636 1
1 412 . 12 1 1 A 55 55 SER C C 33 173.830 177.385 -3.555 1
1 413 . 12 1 1 A 55 55 SER CA C 33 61.620 64.242 -2.622 1
1 414 . 12 1 1 A 55 55 SER CB C 33 62.720 31.609 31.111 1
1 415 . 12 1 1 A 55 55 SER N N 33 115.780 136.577 -20.797 1
1 416 . 12 1 1 A 56 56 LYS H H 34 7.150 8.472 -1.322 1
1 417 . 12 1 1 A 56 56 LYS HA H 34 4.090 4.319 -0.229 1
1 424 . 12 1 1 A 56 56 LYS C C 34 176.080 176.706 -0.626 1
1 425 . 12 1 1 A 56 56 LYS CA C 34 58.950 57.283 1.667 1
1 426 . 12 1 1 A 56 56 LYS CB C 34 32.540 33.477 -0.937 1
1 429 . 12 1 1 A 56 56 LYS N N 34 119.100 116.481 2.619 1
1 430 . 12 1 1 A 57 57 ARG H H 35 7.530 8.019 -0.489 1
1 431 . 12 1 1 A 57 57 ARG HA H 35 4.110 4.651 -0.541 1
1 436 . 12 1 1 A 57 57 ARG C C 35 174.800 174.026 0.774 1
1 437 . 12 1 1 A 57 57 ARG CA C 35 57.090 55.599 1.491 1
1 438 . 12 1 1 A 57 57 ARG CB C 35 29.810 30.883 -1.073 1
1 440 . 12 1 1 A 57 57 ARG N N 35 119.370 113.624 5.746 1
1 441 . 12 1 1 A 58 58 PHE H H 36 8.320 8.888 -0.568 1
1 442 . 12 1 1 A 58 58 PHE HA H 36 4.340 5.551 -1.211 1
1 449 . 12 1 1 A 58 58 PHE C C 36 171.940 174.563 -2.623 1
1 450 . 12 1 1 A 58 58 PHE CA C 36 58.500 54.583 3.917 1
1 451 . 12 1 1 A 58 58 PHE CB C 36 38.130 36.914 1.216 1
1 454 . 12 1 1 A 58 58 PHE N N 36 113.980 116.623 -2.643 1
1 455 . 12 1 1 A 59 59 LYS H H 37 7.790 8.821 -1.031 1
1 456 . 12 1 1 A 59 59 LYS HA H 37 3.960 4.552 -0.592 1
1 463 . 12 1 1 A 59 59 LYS C C 37 172.670 173.536 -0.866 1
1 464 . 12 1 1 A 59 59 LYS CA C 37 57.140 55.611 1.529 1
1 465 . 12 1 1 A 59 59 LYS CB C 37 29.020 33.829 -4.809 1
1 468 . 12 1 1 A 59 59 LYS N N 37 118.810 118.964 -0.154 1
1 469 . 12 1 1 A 60 60 SER H H 38 7.750 8.650 -0.900 1
1 470 . 12 1 1 A 60 60 SER HA H 38 4.700 4.866 -0.166 1
1 473 . 12 1 1 A 60 60 SER C C 38 170.170 174.703 -4.533 1
1 474 . 12 1 1 A 60 60 SER CA C 38 57.130 54.863 2.267 1
1 475 . 12 1 1 A 60 60 SER CB C 38 66.820 32.287 34.533 1
1 476 . 12 1 1 A 60 60 SER N N 38 112.620 126.300 -13.680 1
1 477 . 12 1 1 A 61 61 HIS H H 39 8.630 9.146 -0.516 1
1 478 . 12 1 1 A 61 61 HIS N N 39 124.090 124.333 -0.243 1
1 479 . 12 1 1 A 62 62 THR HA H 40 3.610 4.993 -1.383 1
1 484 . 12 1 1 A 62 62 THR C C 40 174.350 176.204 -1.854 1
1 485 . 12 1 1 A 62 62 THR CA C 40 66.160 50.810 15.350 1
1 486 . 12 1 1 A 62 62 THR CB C 40 68.070 19.977 48.093 1
1 488 . 12 1 1 A 63 63 ASP H H 41 10.310 8.721 1.589 1
1 489 . 12 1 1 A 63 63 ASP HA H 41 4.420 4.992 -0.572 1
1 492 . 12 1 1 A 63 63 ASP C C 41 174.630 174.906 -0.276 1
1 493 . 12 1 1 A 63 63 ASP CA C 41 56.330 58.270 -1.940 1
1 494 . 12 1 1 A 63 63 ASP CB C 41 40.040 33.929 6.111 1
1 495 . 12 1 1 A 63 63 ASP N N 41 122.900 118.990 3.910 1
1 497 . 12 1 1 A 64 64 GLN HA H 42 4.270 4.585 -0.315 1
1 504 . 12 1 1 A 64 64 GLN C C 42 172.160 177.731 -5.571 1
1 505 . 12 1 1 A 64 64 GLN CA C 42 55.860 62.866 -7.006 1
1 506 . 12 1 1 A 64 64 GLN CB C 42 30.480 30.173 0.307 1
1 508 . 12 1 1 A 64 64 GLN N N 42 115.750 137.181 -21.431 1
1 510 . 12 1 1 A 65 65 LEU H H 43 7.250 8.323 -1.073 1
1 511 . 12 1 1 A 65 65 LEU HA H 43 4.440 4.070 0.370 1
1 517 . 12 1 1 A 65 65 LEU C C 43 173.160 176.154 -2.994 1
1 518 . 12 1 1 A 65 65 LEU CA C 43 54.620 57.635 -3.015 1
1 519 . 12 1 1 A 65 65 LEU CB C 43 41.990 27.529 14.461 1
1 521 . 12 1 1 A 65 65 LEU N N 43 116.570 118.263 -1.693 1
1 522 . 12 1 1 A 66 66 VAL H H 44 8.690 7.933 0.757 1
1 523 . 12 1 1 A 66 66 VAL HA H 44 3.980 4.962 -0.982 1
1 528 . 12 1 1 A 66 66 VAL C C 44 171.340 175.799 -4.459 1
1 529 . 12 1 1 A 66 66 VAL CA C 44 61.910 54.395 7.515 1
1 530 . 12 1 1 A 66 66 VAL CB C 44 33.630 40.003 -6.373 1
1 532 . 12 1 1 A 66 66 VAL N N 44 125.260 118.486 6.774 1
1 533 . 12 1 1 A 67 67 LEU H H 45 8.570 7.826 0.744 1
1 534 . 12 1 1 A 67 67 LEU HA H 45 5.220 4.331 0.889 1
1 544 . 12 1 1 A 67 67 LEU C C 45 172.500 174.304 -1.804 1
1 545 . 12 1 1 A 67 67 LEU CA C 45 52.820 60.219 -7.399 1
1 546 . 12 1 1 A 67 67 LEU CB C 45 45.310 63.635 -18.325 1
1 550 . 12 1 1 A 67 67 LEU N N 45 126.690 115.989 10.701 1
1 551 . 12 1 1 A 68 68 ILE H H 46 9.040 8.854 0.186 1
1 552 . 12 1 1 A 68 68 ILE HA H 46 4.880 4.498 0.382 1
1 562 . 12 1 1 A 68 68 ILE C C 46 172.390 175.581 -3.191 1
1 563 . 12 1 1 A 68 68 ILE CA C 46 59.900 58.330 1.570 1
1 564 . 12 1 1 A 68 68 ILE CB C 46 41.940 64.231 -22.291 1
1 568 . 12 1 1 A 68 68 ILE N N 46 122.590 121.804 0.786 1
1 569 . 12 1 1 A 69 69 PHE H H 47 8.740 8.457 0.283 1
1 570 . 12 1 1 A 69 69 PHE N N 47 125.360 123.609 1.751 1
1 571 . 12 1 1 A 70 70 ALA HA H 48 3.600 3.966 -0.366 1
1 575 . 12 1 1 A 70 70 ALA C C 48 174.500 178.623 -4.123 1
1 576 . 12 1 1 A 70 70 ALA CA C 48 52.520 59.415 -6.895 1
1 577 . 12 1 1 A 70 70 ALA CB C 48 16.760 28.669 -11.909 1
1 578 . 12 1 1 A 71 71 GLY H H 49 8.210 7.702 0.508 1
1 581 . 12 1 1 A 71 71 GLY C C 49 170.850 178.431 -7.581 1
1 582 . 12 1 1 A 71 71 GLY CA C 49 45.380 58.326 -12.946 1
1 583 . 12 1 1 A 71 71 GLY N N 49 102.430 119.128 -16.698 1
1 584 . 12 1 1 A 72 72 LYS H H 50 7.840 8.218 -0.378 1
1 585 . 12 1 1 A 72 72 LYS HA H 50 4.530 4.067 0.463 1
1 594 . 12 1 1 A 72 72 LYS C C 50 171.800 177.600 -5.800 1
1 595 . 12 1 1 A 72 72 LYS CA C 50 54.630 61.078 -6.448 1
1 596 . 12 1 1 A 72 72 LYS CB C 50 34.630 38.976 -4.346 1
1 600 . 12 1 1 A 72 72 LYS N N 50 121.570 120.582 0.988 1
1 601 . 12 1 1 A 73 73 ILE H H 51 8.250 8.315 -0.065 1
1 602 . 12 1 1 A 73 73 ILE HA H 51 4.260 3.834 0.426 1
1 612 . 12 1 1 A 73 73 ILE C C 51 174.300 178.555 -4.255 1
1 613 . 12 1 1 A 73 73 ILE CA C 51 61.270 58.358 2.912 1
1 614 . 12 1 1 A 73 73 ILE CB C 51 38.150 31.176 6.974 1
1 618 . 12 1 1 A 73 73 ILE N N 51 122.710 118.118 4.592 1
1 619 . 12 1 1 A 74 74 LEU H H 52 8.540 8.286 0.254 1
1 620 . 12 1 1 A 74 74 LEU HA H 52 3.980 3.934 0.046 1
1 630 . 12 1 1 A 74 74 LEU C C 52 173.440 179.186 -5.746 1
1 631 . 12 1 1 A 74 74 LEU CA C 52 54.660 59.428 -4.768 1
1 632 . 12 1 1 A 74 74 LEU CB C 52 41.790 29.327 12.463 1
1 636 . 12 1 1 A 74 74 LEU N N 52 128.360 118.818 9.542 1
1 637 . 12 1 1 A 75 75 LYS H H 53 8.100 7.455 0.645 1
1 638 . 12 1 1 A 75 75 LYS HA H 53 4.440 4.000 0.440 1
1 645 . 12 1 1 A 75 75 LYS C C 53 175.170 179.147 -3.977 1
1 646 . 12 1 1 A 75 75 LYS CA C 53 55.340 58.838 -3.498 1
1 647 . 12 1 1 A 75 75 LYS CB C 53 32.680 28.947 3.733 1
1 650 . 12 1 1 A 75 75 LYS N N 53 123.470 118.560 4.910 1
1 651 . 12 1 1 A 76 76 ASP H H 54 8.310 7.257 1.053 1
1 652 . 12 1 1 A 76 76 ASP HA H 54 4.110 3.692 0.418 1
1 655 . 12 1 1 A 76 76 ASP C C 54 174.270 177.847 -3.577 1
1 656 . 12 1 1 A 76 76 ASP CA C 54 58.140 65.593 -7.453 1
1 657 . 12 1 1 A 76 76 ASP CB C 54 40.760 37.615 3.145 1
1 658 . 12 1 1 A 76 76 ASP N N 54 121.080 121.064 0.016 1
1 659 . 12 1 1 A 77 77 GLN H H 55 8.180 7.935 0.245 1
1 660 . 12 1 1 A 77 77 GLN HA H 55 4.360 4.494 -0.134 1
1 667 . 12 1 1 A 77 77 GLN C C 55 173.710 176.458 -2.748 1
1 668 . 12 1 1 A 77 77 GLN CA C 55 56.350 61.473 -5.123 1
1 669 . 12 1 1 A 77 77 GLN CB C 55 28.090 62.276 -34.186 1
1 671 . 12 1 1 A 77 77 GLN N N 55 113.190 115.298 -2.108 1
1 673 . 12 1 1 A 78 78 ASP H H 56 7.770 7.995 -0.225 1
1 674 . 12 1 1 A 78 78 ASP HA H 56 4.700 4.025 0.675 1
1 677 . 12 1 1 A 78 78 ASP C C 56 173.500 178.954 -5.454 1
1 678 . 12 1 1 A 78 78 ASP CA C 56 54.140 58.550 -4.410 1
1 679 . 12 1 1 A 78 78 ASP CB C 56 42.020 31.541 10.479 1
1 680 . 12 1 1 A 78 78 ASP N N 56 121.910 119.677 2.233 1
1 681 . 12 1 1 A 79 79 THR H H 57 8.490 7.573 0.917 1
1 682 . 12 1 1 A 79 79 THR HA H 57 4.700 4.081 0.619 1
1 687 . 12 1 1 A 79 79 THR C C 57 172.840 178.237 -5.397 1
1 688 . 12 1 1 A 79 79 THR CA C 57 59.980 59.024 0.956 1
1 689 . 12 1 1 A 79 79 THR CB C 57 70.640 30.874 39.766 1
1 691 . 12 1 1 A 79 79 THR N N 57 108.860 119.448 -10.588 1
1 692 . 12 1 1 A 80 80 LEU H H 58 7.700 8.087 -0.387 1
1 693 . 12 1 1 A 80 80 LEU HA H 58 3.880 4.628 -0.748 1
1 703 . 12 1 1 A 80 80 LEU C C 58 177.370 174.869 2.501 1
1 704 . 12 1 1 A 80 80 LEU CA C 58 58.450 57.912 0.538 1
1 705 . 12 1 1 A 80 80 LEU CB C 58 39.500 38.793 0.707 1
1 709 . 12 1 1 A 80 80 LEU N N 58 118.820 118.250 0.570 1
1 710 . 12 1 1 A 81 81 SER H H 59 8.810 7.880 0.930 1
1 711 . 12 1 1 A 81 81 SER HA H 59 4.050 3.841 0.209 1
1 714 . 12 1 1 A 81 81 SER C C 59 176.150 174.673 1.477 1
1 715 . 12 1 1 A 81 81 SER CA C 59 61.190 57.428 3.762 1
1 716 . 12 1 1 A 81 81 SER CB C 59 62.490 28.947 33.543 1
1 717 . 12 1 1 A 81 81 SER N N 59 114.240 116.259 -2.019 1
1 718 . 12 1 1 A 82 82 GLN H H 60 7.950 7.489 0.461 1
1 719 . 12 1 1 A 82 82 GLN HA H 60 4.090 5.039 -0.949 1
1 726 . 12 1 1 A 82 82 GLN C C 60 173.930 173.453 0.477 1
1 727 . 12 1 1 A 82 82 GLN CA C 60 58.080 57.645 0.435 1
1 728 . 12 1 1 A 82 82 GLN CB C 60 28.460 65.298 -36.838 1
1 730 . 12 1 1 A 82 82 GLN N N 60 122.620 113.807 8.813 1
1 732 . 12 1 1 A 83 83 HIS H H 61 6.990 8.975 -1.985 1
1 733 . 12 1 1 A 83 83 HIS HA H 61 4.490 4.693 -0.203 1
1 736 . 12 1 1 A 83 83 HIS C C 61 172.260 177.091 -4.831 1
1 737 . 12 1 1 A 83 83 HIS CA C 61 57.110 56.467 0.643 1
1 738 . 12 1 1 A 83 83 HIS CB C 61 32.780 31.033 1.747 1
1 739 . 12 1 1 A 83 83 HIS N N 61 116.940 125.235 -8.295 1
1 740 . 12 1 1 A 84 84 GLY H H 62 7.870 8.997 -1.127 1
1 743 . 12 1 1 A 84 84 GLY C C 62 171.040 176.392 -5.352 1
1 744 . 12 1 1 A 84 84 GLY CA C 62 45.390 65.358 -19.968 1
1 745 . 12 1 1 A 84 84 GLY N N 62 106.740 116.571 -9.831 1
1 746 . 12 1 1 A 85 85 ILE H H 63 6.810 8.163 -1.353 1
1 747 . 12 1 1 A 85 85 ILE HA H 63 3.050 4.377 -1.327 1
1 757 . 12 1 1 A 85 85 ILE C C 63 170.130 178.161 -8.031 1
1 758 . 12 1 1 A 85 85 ILE CA C 63 62.440 57.722 4.718 1
1 759 . 12 1 1 A 85 85 ILE CB C 63 36.110 41.251 -5.141 1
1 763 . 12 1 1 A 85 85 ILE N N 63 118.920 121.675 -2.755 1
1 764 . 12 1 1 A 86 86 HIS H H 64 6.020 7.820 -1.800 1
1 765 . 12 1 1 A 86 86 HIS HA H 64 5.030 4.344 0.686 1
1 768 . 12 1 1 A 86 86 HIS C C 64 170.090 176.088 -5.998 1
1 769 . 12 1 1 A 86 86 HIS CA C 64 53.500 57.143 -3.643 1
1 770 . 12 1 1 A 86 86 HIS CB C 64 31.860 29.187 2.673 1
1 771 . 12 1 1 A 86 86 HIS N N 64 122.440 116.190 6.250 1
1 772 . 12 1 1 A 87 87 ASP H H 65 8.340 7.584 0.756 1
1 773 . 12 1 1 A 87 87 ASP HA H 65 4.320 4.530 -0.210 1
1 776 . 12 1 1 A 87 87 ASP C C 65 174.370 175.808 -1.438 1
1 777 . 12 1 1 A 87 87 ASP CA C 65 56.440 53.686 2.754 1
1 778 . 12 1 1 A 87 87 ASP CB C 65 43.150 42.884 0.266 1
1 779 . 12 1 1 A 87 87 ASP N N 65 116.230 120.893 -4.663 1
1 780 . 12 1 1 A 88 88 GLY H H 66 9.330 8.584 0.746 1
1 783 . 12 1 1 A 88 88 GLY C C 66 172.330 174.517 -2.187 1
1 784 . 12 1 1 A 88 88 GLY CA C 66 45.270 60.019 -14.749 1
1 785 . 12 1 1 A 88 88 GLY N N 66 112.300 118.856 -6.556 1
1 786 . 12 1 1 A 89 89 LEU H H 67 7.640 8.486 -0.846 1
1 787 . 12 1 1 A 89 89 LEU HA H 67 4.720 4.573 0.147 1
1 797 . 12 1 1 A 89 89 LEU C C 67 172.460 175.740 -3.280 1
1 798 . 12 1 1 A 89 89 LEU CA C 67 54.420 54.459 -0.039 1
1 799 . 12 1 1 A 89 89 LEU CB C 67 42.260 42.428 -0.168 1
1 803 . 12 1 1 A 89 89 LEU N N 67 120.310 127.525 -7.215 1
1 804 . 12 1 1 A 90 90 THR H H 68 8.110 8.872 -0.762 1
1 805 . 12 1 1 A 90 90 THR HA H 68 5.300 5.372 -0.072 1
1 810 . 12 1 1 A 90 90 THR C C 68 170.900 174.984 -4.084 1
1 811 . 12 1 1 A 90 90 THR CA C 68 61.870 60.225 1.645 1
1 812 . 12 1 1 A 90 90 THR CB C 68 71.320 40.888 30.432 1
1 814 . 12 1 1 A 90 90 THR N N 68 115.300 121.512 -6.212 1
1 815 . 12 1 1 A 91 91 VAL H H 69 9.290 9.052 0.238 1
1 816 . 12 1 1 A 91 91 VAL HA H 69 4.540 4.797 -0.257 1
1 824 . 12 1 1 A 91 91 VAL C C 69 170.890 174.462 -3.572 1
1 825 . 12 1 1 A 91 91 VAL CA C 69 60.310 58.140 2.170 1
1 826 . 12 1 1 A 91 91 VAL CB C 69 34.680 42.264 -7.584 1
1 829 . 12 1 1 A 91 91 VAL N N 69 124.200 126.573 -2.373 1
1 830 . 12 1 1 A 92 92 HIS H H 70 8.750 8.547 0.203 1
1 831 . 12 1 1 A 92 92 HIS HA H 70 5.020 3.942 1.078 1
1 835 . 12 1 1 A 92 92 HIS C C 70 170.890 177.201 -6.311 1
1 836 . 12 1 1 A 92 92 HIS CA C 70 56.750 53.307 3.443 1
1 837 . 12 1 1 A 92 92 HIS CB C 70 32.220 18.001 14.219 1
1 839 . 12 1 1 A 92 92 HIS N N 70 125.250 128.645 -3.395 1
1 840 . 12 1 1 A 93 93 LEU H H 71 8.290 8.544 -0.254 1
1 851 . 12 1 1 A 93 93 LEU C C 71 172.570 173.545 -0.975 1
1 852 . 12 1 1 A 93 93 LEU CA C 71 52.820 45.452 7.368 1
1 857 . 12 1 1 A 93 93 LEU N N 71 123.360 102.928 20.432 1
1 858 . 12 1 1 A 94 94 VAL H H 72 9.110 7.430 1.680 1
1 859 . 12 1 1 A 94 94 VAL HA H 72 4.080 4.906 -0.826 1
1 864 . 12 1 1 A 94 94 VAL C C 72 171.160 175.192 -4.032 1
1 865 . 12 1 1 A 94 94 VAL CA C 72 61.350 54.109 7.241 1
1 866 . 12 1 1 A 94 94 VAL CB C 72 34.640 35.964 -1.324 1
1 868 . 12 1 1 A 94 94 VAL N N 72 128.650 115.226 13.424 1
1 869 . 12 1 1 A 95 95 ILE H H 73 8.150 8.152 -0.002 1
1 870 . 12 1 1 A 95 95 ILE HA H 73 4.500 4.822 -0.322 1
1 880 . 12 1 1 A 95 95 ILE C C 73 174.320 175.472 -1.152 1
1 881 . 12 1 1 A 95 95 ILE CA C 73 60.170 60.474 -0.304 1
1 882 . 12 1 1 A 95 95 ILE CB C 73 38.120 39.076 -0.956 1
1 886 . 12 1 1 A 95 95 ILE N N 73 125.560 119.194 6.366 1
1 887 . 12 1 1 A 96 96 LYS H H 74 9.280 8.814 0.466 1
1 888 . 12 1 1 A 96 96 LYS HA H 74 4.240 4.551 -0.311 1
1 891 . 12 1 1 A 96 96 LYS C C 74 173.510 175.975 -2.465 1
1 892 . 12 1 1 A 96 96 LYS CA C 74 56.730 54.322 2.408 1
1 893 . 12 1 1 A 96 96 LYS CB C 74 33.100 40.967 -7.867 1
1 894 . 12 1 1 A 96 96 LYS N N 74 129.290 127.767 1.523 1
1 895 . 12 1 1 A 97 97 THR H H 75 8.040 8.782 -0.742 1
1 896 . 12 1 1 A 97 97 THR HA H 75 4.230 4.640 -0.410 1
1 901 . 12 1 1 A 97 97 THR C C 75 171.800 177.482 -5.682 1
1 902 . 12 1 1 A 97 97 THR CA C 75 61.760 54.493 7.267 1
1 903 . 12 1 1 A 97 97 THR CB C 75 69.830 34.703 35.127 1
1 905 . 12 1 1 A 97 97 THR N N 75 114.420 124.747 -10.327 1
1 906 . 12 1 1 A 98 98 GLN H H 76 8.400 8.900 -0.500 1
1 907 . 12 1 1 A 98 98 GLN HA H 76 4.210 4.457 -0.247 1
1 914 . 12 1 1 A 98 98 GLN CA C 76 55.880 56.097 -0.217 1
1 915 . 12 1 1 A 98 98 GLN CB C 76 29.700 39.954 -10.254 1
1 917 . 12 1 1 A 98 98 GLN N N 76 122.370 121.174 1.196 1
1 919 . 12 1 1 A 99 99 ASN HA H 77 4.590 4.144 0.446 1
1 924 . 12 1 1 A 99 99 ASN C C 77 171.780 176.181 -4.401 1
1 925 . 12 1 1 A 99 99 ASN CA C 77 53.300 58.618 -5.318 1
1 926 . 12 1 1 A 99 99 ASN CB C 77 38.920 27.922 10.998 1
1 928 . 12 1 1 A 100 100 ARG H H 78 8.160 7.914 0.246 1
1 929 . 12 1 1 A 100 100 ARG HA H 78 4.560 5.144 -0.584 1
1 936 . 12 1 1 A 100 100 ARG CA C 78 53.860 53.157 0.703 1
1 937 . 12 1 1 A 100 100 ARG CB C 78 30.210 42.180 -11.970 1
1 940 . 12 1 1 A 100 100 ARG N N 78 122.840 119.249 3.591 1
1 941 . 12 1 1 A 101 101 PRO HA H 79 4.150 4.948 -0.798 1
1 948 . 12 1 1 A 101 101 PRO CA C 79 64.770 59.237 5.533 1
1 949 . 12 1 1 A 101 101 PRO CB C 79 32.040 71.782 -39.742 1
1 289 . 13 1 1 A 46 46 SER H H 24 8.950 8.404 0.546 1
1 290 . 13 1 1 A 46 46 SER HA H 24 4.900 4.514 0.386 1
1 293 . 13 1 1 A 46 46 SER C C 24 170.890 176.176 -5.286 1
1 294 . 13 1 1 A 46 46 SER CA C 24 56.980 55.967 1.013 1
1 295 . 13 1 1 A 46 46 SER CB C 24 65.590 33.354 32.236 1
1 296 . 13 1 1 A 46 46 SER N N 24 120.420 121.689 -1.269 1
1 297 . 13 1 1 A 47 47 VAL H H 25 9.140 8.262 0.878 1
1 298 . 13 1 1 A 47 47 VAL HA H 25 3.440 4.376 -0.936 1
1 306 . 13 1 1 A 47 47 VAL C C 25 175.060 176.025 -0.965 1
1 307 . 13 1 1 A 47 47 VAL CA C 25 67.250 61.181 6.069 1
1 308 . 13 1 1 A 47 47 VAL CB C 25 30.780 39.557 -8.777 1
1 311 . 13 1 1 A 47 47 VAL N N 25 123.970 125.937 -1.967 1
1 312 . 13 1 1 A 48 48 GLN H H 26 8.540 8.866 -0.326 1
1 313 . 13 1 1 A 48 48 GLN HA H 26 4.070 4.833 -0.763 1
1 320 . 13 1 1 A 48 48 GLN CA C 26 60.230 53.752 6.478 1
1 321 . 13 1 1 A 48 48 GLN CB C 26 28.490 32.467 -3.977 1
1 323 . 13 1 1 A 48 48 GLN N N 26 120.550 126.632 -6.082 1
1 325 . 13 1 1 A 49 49 GLN HA H 27 3.950 4.818 -0.868 1
1 332 . 13 1 1 A 49 49 GLN C C 27 176.230 175.383 0.847 1
1 333 . 13 1 1 A 49 49 GLN CA C 27 58.710 55.607 3.103 1
1 334 . 13 1 1 A 49 49 GLN CB C 27 28.820 31.706 -2.886 1
1 337 . 13 1 1 A 50 50 PHE H H 28 8.050 8.823 -0.773 1
1 338 . 13 1 1 A 50 50 PHE HA H 28 4.620 4.725 -0.105 1
1 345 . 13 1 1 A 50 50 PHE C C 28 175.190 175.477 -0.287 1
1 346 . 13 1 1 A 50 50 PHE CA C 28 58.030 61.579 -3.549 1
1 347 . 13 1 1 A 50 50 PHE CB C 28 39.190 32.816 6.374 1
1 350 . 13 1 1 A 50 50 PHE N N 28 121.710 125.410 -3.700 1
1 351 . 13 1 1 A 51 51 LYS H H 29 8.940 8.648 0.292 1
1 352 . 13 1 1 A 51 51 LYS HA H 29 3.340 4.630 -1.290 1
1 361 . 13 1 1 A 51 51 LYS C C 29 175.370 174.576 0.794 1
1 362 . 13 1 1 A 51 51 LYS CA C 29 60.660 62.676 -2.016 1
1 363 . 13 1 1 A 51 51 LYS CB C 29 33.190 70.031 -36.841 1
1 367 . 13 1 1 A 51 51 LYS N N 29 117.530 122.829 -5.299 1
1 368 . 13 1 1 A 52 52 GLU H H 30 7.700 8.923 -1.223 1
1 369 . 13 1 1 A 52 52 GLU HA H 30 3.750 4.882 -1.132 1
1 374 . 13 1 1 A 52 52 GLU C C 30 176.780 174.037 2.743 1
1 375 . 13 1 1 A 52 52 GLU CA C 30 59.890 61.322 -1.432 1
1 376 . 13 1 1 A 52 52 GLU CB C 30 28.840 34.669 -5.829 1
1 378 . 13 1 1 A 52 52 GLU N N 30 118.820 126.760 -7.940 1
1 379 . 13 1 1 A 53 53 GLU H H 31 7.370 9.163 -1.793 1
1 380 . 13 1 1 A 53 53 GLU HA H 31 4.150 4.966 -0.816 1
1 385 . 13 1 1 A 53 53 GLU C C 31 177.040 176.124 0.916 1
1 386 . 13 1 1 A 53 53 GLU CA C 31 58.860 55.143 3.717 1
1 387 . 13 1 1 A 53 53 GLU CB C 31 29.200 34.000 -4.800 1
1 389 . 13 1 1 A 53 53 GLU N N 31 119.150 129.189 -10.039 1
1 390 . 13 1 1 A 54 54 ILE H H 32 8.000 8.762 -0.762 1
1 391 . 13 1 1 A 54 54 ILE HA H 32 3.550 5.123 -1.573 1
1 401 . 13 1 1 A 54 54 ILE C C 32 175.420 173.924 1.496 1
1 402 . 13 1 1 A 54 54 ILE CA C 32 64.690 58.747 5.943 1
1 403 . 13 1 1 A 54 54 ILE CB C 32 37.820 69.934 -32.114 1
1 407 . 13 1 1 A 54 54 ILE N N 32 119.970 117.088 2.882 1
1 409 . 13 1 1 A 55 55 SER HA H 33 3.930 4.539 -0.609 1
1 412 . 13 1 1 A 55 55 SER C C 33 173.830 177.034 -3.204 1
1 413 . 13 1 1 A 55 55 SER CA C 33 61.620 63.878 -2.258 1
1 414 . 13 1 1 A 55 55 SER CB C 33 62.720 31.727 30.993 1
1 415 . 13 1 1 A 55 55 SER N N 33 115.780 135.516 -19.736 1
1 416 . 13 1 1 A 56 56 LYS H H 34 7.150 8.336 -1.186 1
1 417 . 13 1 1 A 56 56 LYS HA H 34 4.090 4.668 -0.578 1
1 424 . 13 1 1 A 56 56 LYS C C 34 176.080 175.643 0.437 1
1 425 . 13 1 1 A 56 56 LYS CA C 34 58.950 56.371 2.579 1
1 426 . 13 1 1 A 56 56 LYS CB C 34 32.540 34.913 -2.373 1
1 429 . 13 1 1 A 56 56 LYS N N 34 119.100 115.642 3.458 1
1 430 . 13 1 1 A 57 57 ARG H H 35 7.530 7.720 -0.190 1
1 431 . 13 1 1 A 57 57 ARG HA H 35 4.110 4.645 -0.535 1
1 436 . 13 1 1 A 57 57 ARG C C 35 174.800 174.009 0.791 1
1 437 . 13 1 1 A 57 57 ARG CA C 35 57.090 55.472 1.618 1
1 438 . 13 1 1 A 57 57 ARG CB C 35 29.810 30.522 -0.712 1
1 440 . 13 1 1 A 57 57 ARG N N 35 119.370 116.419 2.951 1
1 441 . 13 1 1 A 58 58 PHE H H 36 8.320 8.906 -0.586 1
1 442 . 13 1 1 A 58 58 PHE HA H 36 4.340 5.636 -1.296 1
1 449 . 13 1 1 A 58 58 PHE C C 36 171.940 174.234 -2.294 1
1 450 . 13 1 1 A 58 58 PHE CA C 36 58.500 54.861 3.639 1
1 451 . 13 1 1 A 58 58 PHE CB C 36 38.130 37.092 1.038 1
1 454 . 13 1 1 A 58 58 PHE N N 36 113.980 116.582 -2.602 1
1 455 . 13 1 1 A 59 59 LYS H H 37 7.790 8.554 -0.764 1
1 456 . 13 1 1 A 59 59 LYS HA H 37 3.960 4.626 -0.666 1
1 463 . 13 1 1 A 59 59 LYS C C 37 172.670 173.639 -0.969 1
1 464 . 13 1 1 A 59 59 LYS CA C 37 57.140 55.174 1.966 1
1 465 . 13 1 1 A 59 59 LYS CB C 37 29.020 33.404 -4.384 1
1 468 . 13 1 1 A 59 59 LYS N N 37 118.810 119.216 -0.406 1
1 469 . 13 1 1 A 60 60 SER H H 38 7.750 8.583 -0.833 1
1 470 . 13 1 1 A 60 60 SER HA H 38 4.700 4.930 -0.230 1
1 473 . 13 1 1 A 60 60 SER C C 38 170.170 175.424 -5.254 1
1 474 . 13 1 1 A 60 60 SER CA C 38 57.130 54.801 2.329 1
1 475 . 13 1 1 A 60 60 SER CB C 38 66.820 30.738 36.082 1
1 476 . 13 1 1 A 60 60 SER N N 38 112.620 126.808 -14.188 1
1 477 . 13 1 1 A 61 61 HIS H H 39 8.630 9.010 -0.380 1
1 478 . 13 1 1 A 61 61 HIS N N 39 124.090 126.738 -2.648 1
1 479 . 13 1 1 A 62 62 THR HA H 40 3.610 5.432 -1.822 1
1 484 . 13 1 1 A 62 62 THR C C 40 174.350 176.157 -1.807 1
1 485 . 13 1 1 A 62 62 THR CA C 40 66.160 50.691 15.469 1
1 486 . 13 1 1 A 62 62 THR CB C 40 68.070 21.062 47.008 1
1 488 . 13 1 1 A 63 63 ASP H H 41 10.310 8.835 1.475 1
1 489 . 13 1 1 A 63 63 ASP HA H 41 4.420 4.966 -0.546 1
1 492 . 13 1 1 A 63 63 ASP C C 41 174.630 174.609 0.021 1
1 493 . 13 1 1 A 63 63 ASP CA C 41 56.330 58.180 -1.850 1
1 494 . 13 1 1 A 63 63 ASP CB C 41 40.040 34.818 5.222 1
1 495 . 13 1 1 A 63 63 ASP N N 41 122.900 117.909 4.991 1
1 497 . 13 1 1 A 64 64 GLN HA H 42 4.270 4.599 -0.329 1
1 504 . 13 1 1 A 64 64 GLN C C 42 172.160 177.603 -5.443 1
1 505 . 13 1 1 A 64 64 GLN CA C 42 55.860 62.841 -6.981 1
1 506 . 13 1 1 A 64 64 GLN CB C 42 30.480 30.081 0.399 1
1 508 . 13 1 1 A 64 64 GLN N N 42 115.750 138.103 -22.353 1
1 510 . 13 1 1 A 65 65 LEU H H 43 7.250 8.353 -1.103 1
1 511 . 13 1 1 A 65 65 LEU HA H 43 4.440 4.033 0.407 1
1 517 . 13 1 1 A 65 65 LEU C C 43 173.160 175.940 -2.780 1
1 518 . 13 1 1 A 65 65 LEU CA C 43 54.620 57.562 -2.942 1
1 519 . 13 1 1 A 65 65 LEU CB C 43 41.990 27.476 14.514 1
1 521 . 13 1 1 A 65 65 LEU N N 43 116.570 117.962 -1.392 1
1 522 . 13 1 1 A 66 66 VAL H H 44 8.690 7.992 0.698 1
1 523 . 13 1 1 A 66 66 VAL HA H 44 3.980 5.030 -1.050 1
1 528 . 13 1 1 A 66 66 VAL C C 44 171.340 175.510 -4.170 1
1 529 . 13 1 1 A 66 66 VAL CA C 44 61.910 53.881 8.029 1
1 530 . 13 1 1 A 66 66 VAL CB C 44 33.630 41.471 -7.841 1
1 532 . 13 1 1 A 66 66 VAL N N 44 125.260 118.293 6.967 1
1 533 . 13 1 1 A 67 67 LEU H H 45 8.570 7.780 0.790 1
1 534 . 13 1 1 A 67 67 LEU HA H 45 5.220 4.338 0.882 1
1 544 . 13 1 1 A 67 67 LEU C C 45 172.500 174.469 -1.969 1
1 545 . 13 1 1 A 67 67 LEU CA C 45 52.820 60.363 -7.543 1
1 546 . 13 1 1 A 67 67 LEU CB C 45 45.310 63.614 -18.304 1
1 550 . 13 1 1 A 67 67 LEU N N 45 126.690 116.525 10.165 1
1 551 . 13 1 1 A 68 68 ILE H H 46 9.040 8.586 0.454 1
1 552 . 13 1 1 A 68 68 ILE HA H 46 4.880 4.908 -0.028 1
1 562 . 13 1 1 A 68 68 ILE C C 46 172.390 176.031 -3.641 1
1 563 . 13 1 1 A 68 68 ILE CA C 46 59.900 57.355 2.545 1
1 564 . 13 1 1 A 68 68 ILE CB C 46 41.940 65.584 -23.644 1
1 568 . 13 1 1 A 68 68 ILE N N 46 122.590 120.701 1.889 1
1 569 . 13 1 1 A 69 69 PHE H H 47 8.740 8.550 0.190 1
1 570 . 13 1 1 A 69 69 PHE N N 47 125.360 121.421 3.939 1
1 571 . 13 1 1 A 70 70 ALA HA H 48 3.600 4.049 -0.449 1
1 575 . 13 1 1 A 70 70 ALA C C 48 174.500 177.898 -3.398 1
1 576 . 13 1 1 A 70 70 ALA CA C 48 52.520 58.764 -6.244 1
1 577 . 13 1 1 A 70 70 ALA CB C 48 16.760 28.273 -11.513 1
1 578 . 13 1 1 A 71 71 GLY H H 49 8.210 7.578 0.632 1
1 581 . 13 1 1 A 71 71 GLY C C 49 170.850 178.463 -7.613 1
1 582 . 13 1 1 A 71 71 GLY CA C 49 45.380 57.942 -12.562 1
1 583 . 13 1 1 A 71 71 GLY N N 49 102.430 118.371 -15.941 1
1 584 . 13 1 1 A 72 72 LYS H H 50 7.840 8.079 -0.239 1
1 585 . 13 1 1 A 72 72 LYS HA H 50 4.530 4.032 0.498 1
1 594 . 13 1 1 A 72 72 LYS C C 50 171.800 177.786 -5.986 1
1 595 . 13 1 1 A 72 72 LYS CA C 50 54.630 61.166 -6.536 1
1 596 . 13 1 1 A 72 72 LYS CB C 50 34.630 39.087 -4.457 1
1 600 . 13 1 1 A 72 72 LYS N N 50 121.570 120.582 0.988 1
1 601 . 13 1 1 A 73 73 ILE H H 51 8.250 8.208 0.042 1
1 602 . 13 1 1 A 73 73 ILE HA H 51 4.260 4.002 0.258 1
1 612 . 13 1 1 A 73 73 ILE C C 51 174.300 178.410 -4.110 1
1 613 . 13 1 1 A 73 73 ILE CA C 51 61.270 58.361 2.909 1
1 614 . 13 1 1 A 73 73 ILE CB C 51 38.150 31.297 6.853 1
1 618 . 13 1 1 A 73 73 ILE N N 51 122.710 117.951 4.759 1
1 619 . 13 1 1 A 74 74 LEU H H 52 8.540 8.101 0.439 1
1 620 . 13 1 1 A 74 74 LEU HA H 52 3.980 4.063 -0.083 1
1 630 . 13 1 1 A 74 74 LEU C C 52 173.440 179.105 -5.665 1
1 631 . 13 1 1 A 74 74 LEU CA C 52 54.660 59.204 -4.544 1
1 632 . 13 1 1 A 74 74 LEU CB C 52 41.790 29.270 12.520 1
1 636 . 13 1 1 A 74 74 LEU N N 52 128.360 119.143 9.217 1
1 637 . 13 1 1 A 75 75 LYS H H 53 8.100 7.689 0.411 1
1 638 . 13 1 1 A 75 75 LYS HA H 53 4.440 3.890 0.550 1
1 645 . 13 1 1 A 75 75 LYS C C 53 175.170 178.977 -3.807 1
1 646 . 13 1 1 A 75 75 LYS CA C 53 55.340 58.856 -3.516 1
1 647 . 13 1 1 A 75 75 LYS CB C 53 32.680 28.780 3.900 1
1 650 . 13 1 1 A 75 75 LYS N N 53 123.470 120.420 3.050 1
1 651 . 13 1 1 A 76 76 ASP H H 54 8.310 7.187 1.123 1
1 652 . 13 1 1 A 76 76 ASP HA H 54 4.110 3.480 0.630 1
1 655 . 13 1 1 A 76 76 ASP C C 54 174.270 177.928 -3.658 1
1 656 . 13 1 1 A 76 76 ASP CA C 54 58.140 65.375 -7.235 1
1 657 . 13 1 1 A 76 76 ASP CB C 54 40.760 37.871 2.889 1
1 658 . 13 1 1 A 76 76 ASP N N 54 121.080 120.870 0.210 1
1 659 . 13 1 1 A 77 77 GLN H H 55 8.180 8.077 0.103 1
1 660 . 13 1 1 A 77 77 GLN HA H 55 4.360 4.171 0.189 1
1 667 . 13 1 1 A 77 77 GLN C C 55 173.710 176.385 -2.675 1
1 668 . 13 1 1 A 77 77 GLN CA C 55 56.350 61.616 -5.266 1
1 669 . 13 1 1 A 77 77 GLN CB C 55 28.090 62.441 -34.351 1
1 671 . 13 1 1 A 77 77 GLN N N 55 113.190 114.948 -1.758 1
1 673 . 13 1 1 A 78 78 ASP H H 56 7.770 7.837 -0.067 1
1 674 . 13 1 1 A 78 78 ASP HA H 56 4.700 4.085 0.615 1
1 677 . 13 1 1 A 78 78 ASP C C 56 173.500 178.776 -5.276 1
1 678 . 13 1 1 A 78 78 ASP CA C 56 54.140 58.911 -4.771 1
1 679 . 13 1 1 A 78 78 ASP CB C 56 42.020 31.855 10.165 1
1 680 . 13 1 1 A 78 78 ASP N N 56 121.910 120.658 1.252 1
1 681 . 13 1 1 A 79 79 THR H H 57 8.490 7.730 0.760 1
1 682 . 13 1 1 A 79 79 THR HA H 57 4.700 4.024 0.676 1
1 687 . 13 1 1 A 79 79 THR C C 57 172.840 178.535 -5.695 1
1 688 . 13 1 1 A 79 79 THR CA C 57 59.980 59.029 0.951 1
1 689 . 13 1 1 A 79 79 THR CB C 57 70.640 30.229 40.411 1
1 691 . 13 1 1 A 79 79 THR N N 57 108.860 119.997 -11.137 1
1 692 . 13 1 1 A 80 80 LEU H H 58 7.700 7.993 -0.293 1
1 693 . 13 1 1 A 80 80 LEU HA H 58 3.880 4.593 -0.713 1
1 703 . 13 1 1 A 80 80 LEU C C 58 177.370 175.100 2.270 1
1 704 . 13 1 1 A 80 80 LEU CA C 58 58.450 58.138 0.312 1
1 705 . 13 1 1 A 80 80 LEU CB C 58 39.500 39.139 0.361 1
1 709 . 13 1 1 A 80 80 LEU N N 58 118.820 117.174 1.646 1
1 710 . 13 1 1 A 81 81 SER H H 59 8.810 7.599 1.211 1
1 711 . 13 1 1 A 81 81 SER HA H 59 4.050 3.890 0.160 1
1 714 . 13 1 1 A 81 81 SER C C 59 176.150 174.996 1.154 1
1 715 . 13 1 1 A 81 81 SER CA C 59 61.190 57.528 3.662 1
1 716 . 13 1 1 A 81 81 SER CB C 59 62.490 29.264 33.226 1
1 717 . 13 1 1 A 81 81 SER N N 59 114.240 116.420 -2.180 1
1 718 . 13 1 1 A 82 82 GLN H H 60 7.950 8.044 -0.094 1
1 719 . 13 1 1 A 82 82 GLN HA H 60 4.090 4.545 -0.455 1
1 726 . 13 1 1 A 82 82 GLN C C 60 173.930 173.151 0.779 1
1 727 . 13 1 1 A 82 82 GLN CA C 60 58.080 57.441 0.639 1
1 728 . 13 1 1 A 82 82 GLN CB C 60 28.460 65.719 -37.259 1
1 730 . 13 1 1 A 82 82 GLN N N 60 122.620 113.833 8.787 1
1 732 . 13 1 1 A 83 83 HIS H H 61 6.990 8.509 -1.519 1
1 733 . 13 1 1 A 83 83 HIS HA H 61 4.490 5.100 -0.610 1
1 736 . 13 1 1 A 83 83 HIS C C 61 172.260 175.978 -3.718 1
1 737 . 13 1 1 A 83 83 HIS CA C 61 57.110 54.478 2.632 1
1 738 . 13 1 1 A 83 83 HIS CB C 61 32.780 32.571 0.209 1
1 739 . 13 1 1 A 83 83 HIS N N 61 116.940 117.737 -0.797 1
1 740 . 13 1 1 A 84 84 GLY H H 62 7.870 9.135 -1.265 1
1 743 . 13 1 1 A 84 84 GLY C C 62 171.040 176.411 -5.371 1
1 744 . 13 1 1 A 84 84 GLY CA C 62 45.390 65.786 -20.396 1
1 745 . 13 1 1 A 84 84 GLY N N 62 106.740 117.260 -10.520 1
1 746 . 13 1 1 A 85 85 ILE H H 63 6.810 8.481 -1.671 1
1 747 . 13 1 1 A 85 85 ILE HA H 63 3.050 4.487 -1.437 1
1 757 . 13 1 1 A 85 85 ILE C C 63 170.130 177.617 -7.487 1
1 758 . 13 1 1 A 85 85 ILE CA C 63 62.440 56.967 5.473 1
1 759 . 13 1 1 A 85 85 ILE CB C 63 36.110 41.158 -5.048 1
1 763 . 13 1 1 A 85 85 ILE N N 63 118.920 121.668 -2.748 1
1 764 . 13 1 1 A 86 86 HIS H H 64 6.020 7.833 -1.813 1
1 765 . 13 1 1 A 86 86 HIS HA H 64 5.030 4.373 0.657 1
1 768 . 13 1 1 A 86 86 HIS C C 64 170.090 175.212 -5.122 1
1 769 . 13 1 1 A 86 86 HIS CA C 64 53.500 55.858 -2.358 1
1 770 . 13 1 1 A 86 86 HIS CB C 64 31.860 28.599 3.261 1
1 771 . 13 1 1 A 86 86 HIS N N 64 122.440 114.740 7.700 1
1 772 . 13 1 1 A 87 87 ASP H H 65 8.340 7.185 1.155 1
1 773 . 13 1 1 A 87 87 ASP HA H 65 4.320 5.404 -1.084 1
1 776 . 13 1 1 A 87 87 ASP C C 65 174.370 175.901 -1.531 1
1 777 . 13 1 1 A 87 87 ASP CA C 65 56.440 52.723 3.717 1
1 778 . 13 1 1 A 87 87 ASP CB C 65 43.150 44.791 -1.641 1
1 779 . 13 1 1 A 87 87 ASP N N 65 116.230 116.918 -0.688 1
1 780 . 13 1 1 A 88 88 GLY H H 66 9.330 8.526 0.804 1
1 783 . 13 1 1 A 88 88 GLY C C 66 172.330 174.351 -2.021 1
1 784 . 13 1 1 A 88 88 GLY CA C 66 45.270 59.280 -14.010 1
1 785 . 13 1 1 A 88 88 GLY N N 66 112.300 117.927 -5.627 1
1 786 . 13 1 1 A 89 89 LEU H H 67 7.640 8.555 -0.915 1
1 787 . 13 1 1 A 89 89 LEU HA H 67 4.720 4.786 -0.066 1
1 797 . 13 1 1 A 89 89 LEU C C 67 172.460 175.963 -3.503 1
1 798 . 13 1 1 A 89 89 LEU CA C 67 54.420 54.397 0.023 1
1 799 . 13 1 1 A 89 89 LEU CB C 67 42.260 42.519 -0.259 1
1 803 . 13 1 1 A 89 89 LEU N N 67 120.310 125.297 -4.987 1
1 804 . 13 1 1 A 90 90 THR H H 68 8.110 8.710 -0.600 1
1 805 . 13 1 1 A 90 90 THR HA H 68 5.300 5.284 0.016 1
1 810 . 13 1 1 A 90 90 THR C C 68 170.900 174.653 -3.753 1
1 811 . 13 1 1 A 90 90 THR CA C 68 61.870 60.224 1.646 1
1 812 . 13 1 1 A 90 90 THR CB C 68 71.320 41.172 30.148 1
1 814 . 13 1 1 A 90 90 THR N N 68 115.300 121.638 -6.338 1
1 815 . 13 1 1 A 91 91 VAL H H 69 9.290 9.061 0.229 1
1 816 . 13 1 1 A 91 91 VAL HA H 69 4.540 4.849 -0.309 1
1 824 . 13 1 1 A 91 91 VAL C C 69 170.890 174.817 -3.927 1
1 825 . 13 1 1 A 91 91 VAL CA C 69 60.310 57.537 2.773 1
1 826 . 13 1 1 A 91 91 VAL CB C 69 34.680 42.839 -8.159 1
1 829 . 13 1 1 A 91 91 VAL N N 69 124.200 126.548 -2.348 1
1 830 . 13 1 1 A 92 92 HIS H H 70 8.750 8.526 0.224 1
1 831 . 13 1 1 A 92 92 HIS HA H 70 5.020 3.753 1.267 1
1 835 . 13 1 1 A 92 92 HIS C C 70 170.890 177.004 -6.114 1
1 836 . 13 1 1 A 92 92 HIS CA C 70 56.750 53.094 3.656 1
1 837 . 13 1 1 A 92 92 HIS CB C 70 32.220 17.824 14.396 1
1 839 . 13 1 1 A 92 92 HIS N N 70 125.250 129.409 -4.159 1
1 840 . 13 1 1 A 93 93 LEU H H 71 8.290 8.342 -0.052 1
1 851 . 13 1 1 A 93 93 LEU C C 71 172.570 173.958 -1.388 1
1 852 . 13 1 1 A 93 93 LEU CA C 71 52.820 45.235 7.585 1
1 857 . 13 1 1 A 93 93 LEU N N 71 123.360 102.940 20.420 1
1 858 . 13 1 1 A 94 94 VAL H H 72 9.110 7.499 1.611 1
1 859 . 13 1 1 A 94 94 VAL HA H 72 4.080 4.577 -0.497 1
1 864 . 13 1 1 A 94 94 VAL C C 72 171.160 175.896 -4.736 1
1 865 . 13 1 1 A 94 94 VAL CA C 72 61.350 55.532 5.818 1
1 866 . 13 1 1 A 94 94 VAL CB C 72 34.640 33.937 0.703 1
1 868 . 13 1 1 A 94 94 VAL N N 72 128.650 117.659 10.991 1
1 869 . 13 1 1 A 95 95 ILE H H 73 8.150 8.396 -0.246 1
1 870 . 13 1 1 A 95 95 ILE HA H 73 4.500 4.413 0.087 1
1 880 . 13 1 1 A 95 95 ILE C C 73 174.320 175.762 -1.442 1
1 881 . 13 1 1 A 95 95 ILE CA C 73 60.170 61.140 -0.970 1
1 882 . 13 1 1 A 95 95 ILE CB C 73 38.120 38.489 -0.369 1
1 886 . 13 1 1 A 95 95 ILE N N 73 125.560 119.074 6.486 1
1 887 . 13 1 1 A 96 96 LYS H H 74 9.280 8.759 0.521 1
1 888 . 13 1 1 A 96 96 LYS HA H 74 4.240 4.533 -0.293 1
1 891 . 13 1 1 A 96 96 LYS C C 74 173.510 176.244 -2.734 1
1 892 . 13 1 1 A 96 96 LYS CA C 74 56.730 53.955 2.775 1
1 893 . 13 1 1 A 96 96 LYS CB C 74 33.100 41.139 -8.039 1
1 894 . 13 1 1 A 96 96 LYS N N 74 129.290 127.096 2.194 1
1 895 . 13 1 1 A 97 97 THR H H 75 8.040 8.895 -0.855 1
1 896 . 13 1 1 A 97 97 THR HA H 75 4.230 4.616 -0.386 1
1 901 . 13 1 1 A 97 97 THR C C 75 171.800 177.517 -5.717 1
1 902 . 13 1 1 A 97 97 THR CA C 75 61.760 55.114 6.646 1
1 903 . 13 1 1 A 97 97 THR CB C 75 69.830 34.308 35.522 1
1 905 . 13 1 1 A 97 97 THR N N 75 114.420 124.883 -10.463 1
1 906 . 13 1 1 A 98 98 GLN H H 76 8.400 8.905 -0.505 1
1 907 . 13 1 1 A 98 98 GLN HA H 76 4.210 4.486 -0.276 1
1 914 . 13 1 1 A 98 98 GLN CA C 76 55.880 56.470 -0.590 1
1 915 . 13 1 1 A 98 98 GLN CB C 76 29.700 39.949 -10.249 1
1 917 . 13 1 1 A 98 98 GLN N N 76 122.370 121.167 1.203 1
1 919 . 13 1 1 A 99 99 ASN HA H 77 4.590 4.232 0.358 1
1 924 . 13 1 1 A 99 99 ASN C C 77 171.780 175.866 -4.086 1
1 925 . 13 1 1 A 99 99 ASN CA C 77 53.300 57.380 -4.080 1
1 926 . 13 1 1 A 99 99 ASN CB C 77 38.920 28.098 10.822 1
1 928 . 13 1 1 A 100 100 ARG H H 78 8.160 7.757 0.403 1
1 929 . 13 1 1 A 100 100 ARG HA H 78 4.560 4.958 -0.398 1
1 936 . 13 1 1 A 100 100 ARG CA C 78 53.860 52.895 0.965 1
1 937 . 13 1 1 A 100 100 ARG CB C 78 30.210 42.498 -12.288 1
1 940 . 13 1 1 A 100 100 ARG N N 78 122.840 120.824 2.016 1
1 941 . 13 1 1 A 101 101 PRO HA H 79 4.150 4.957 -0.807 1
1 948 . 13 1 1 A 101 101 PRO CA C 79 64.770 59.285 5.485 1
1 949 . 13 1 1 A 101 101 PRO CB C 79 32.040 71.728 -39.688 1
1 289 . 14 1 1 A 46 46 SER H H 24 8.950 8.475 0.475 1
1 290 . 14 1 1 A 46 46 SER HA H 24 4.900 4.483 0.417 1
1 293 . 14 1 1 A 46 46 SER C C 24 170.890 176.217 -5.327 1
1 294 . 14 1 1 A 46 46 SER CA C 24 56.980 56.015 0.965 1
1 295 . 14 1 1 A 46 46 SER CB C 24 65.590 33.387 32.203 1
1 296 . 14 1 1 A 46 46 SER N N 24 120.420 121.085 -0.665 1
1 297 . 14 1 1 A 47 47 VAL H H 25 9.140 8.332 0.808 1
1 298 . 14 1 1 A 47 47 VAL HA H 25 3.440 4.338 -0.898 1
1 306 . 14 1 1 A 47 47 VAL C C 25 175.060 175.940 -0.880 1
1 307 . 14 1 1 A 47 47 VAL CA C 25 67.250 61.207 6.043 1
1 308 . 14 1 1 A 47 47 VAL CB C 25 30.780 39.296 -8.516 1
1 311 . 14 1 1 A 47 47 VAL N N 25 123.970 126.066 -2.096 1
1 312 . 14 1 1 A 48 48 GLN H H 26 8.540 8.606 -0.066 1
1 313 . 14 1 1 A 48 48 GLN HA H 26 4.070 4.895 -0.825 1
1 320 . 14 1 1 A 48 48 GLN CA C 26 60.230 53.995 6.235 1
1 321 . 14 1 1 A 48 48 GLN CB C 26 28.490 32.552 -4.062 1
1 323 . 14 1 1 A 48 48 GLN N N 26 120.550 126.813 -6.263 1
1 325 . 14 1 1 A 49 49 GLN HA H 27 3.950 5.005 -1.055 1
1 332 . 14 1 1 A 49 49 GLN C C 27 176.230 175.343 0.887 1
1 333 . 14 1 1 A 49 49 GLN CA C 27 58.710 55.598 3.112 1
1 334 . 14 1 1 A 49 49 GLN CB C 27 28.820 31.808 -2.988 1
1 337 . 14 1 1 A 50 50 PHE H H 28 8.050 8.659 -0.609 1
1 338 . 14 1 1 A 50 50 PHE HA H 28 4.620 4.531 0.089 1
1 345 . 14 1 1 A 50 50 PHE C C 28 175.190 175.767 -0.577 1
1 346 . 14 1 1 A 50 50 PHE CA C 28 58.030 61.935 -3.905 1
1 347 . 14 1 1 A 50 50 PHE CB C 28 39.190 32.107 7.083 1
1 350 . 14 1 1 A 50 50 PHE N N 28 121.710 125.109 -3.399 1
1 351 . 14 1 1 A 51 51 LYS H H 29 8.940 8.466 0.474 1
1 352 . 14 1 1 A 51 51 LYS HA H 29 3.340 4.811 -1.471 1
1 361 . 14 1 1 A 51 51 LYS C C 29 175.370 174.469 0.901 1
1 362 . 14 1 1 A 51 51 LYS CA C 29 60.660 62.716 -2.056 1
1 363 . 14 1 1 A 51 51 LYS CB C 29 33.190 70.092 -36.902 1
1 367 . 14 1 1 A 51 51 LYS N N 29 117.530 123.016 -5.486 1
1 368 . 14 1 1 A 52 52 GLU H H 30 7.700 9.201 -1.501 1
1 369 . 14 1 1 A 52 52 GLU HA H 30 3.750 4.826 -1.076 1
1 374 . 14 1 1 A 52 52 GLU C C 30 176.780 174.058 2.722 1
1 375 . 14 1 1 A 52 52 GLU CA C 30 59.890 61.067 -1.177 1
1 376 . 14 1 1 A 52 52 GLU CB C 30 28.840 35.098 -6.258 1
1 378 . 14 1 1 A 52 52 GLU N N 30 118.820 126.326 -7.506 1
1 379 . 14 1 1 A 53 53 GLU H H 31 7.370 9.198 -1.828 1
1 380 . 14 1 1 A 53 53 GLU HA H 31 4.150 5.001 -0.851 1
1 385 . 14 1 1 A 53 53 GLU C C 31 177.040 176.015 1.025 1
1 386 . 14 1 1 A 53 53 GLU CA C 31 58.860 55.084 3.776 1
1 387 . 14 1 1 A 53 53 GLU CB C 31 29.200 34.149 -4.949 1
1 389 . 14 1 1 A 53 53 GLU N N 31 119.150 128.982 -9.832 1
1 390 . 14 1 1 A 54 54 ILE H H 32 8.000 8.630 -0.630 1
1 391 . 14 1 1 A 54 54 ILE HA H 32 3.550 5.026 -1.476 1
1 401 . 14 1 1 A 54 54 ILE C C 32 175.420 174.048 1.372 1
1 402 . 14 1 1 A 54 54 ILE CA C 32 64.690 58.443 6.247 1
1 403 . 14 1 1 A 54 54 ILE CB C 32 37.820 69.364 -31.544 1
1 407 . 14 1 1 A 54 54 ILE N N 32 119.970 117.648 2.322 1
1 409 . 14 1 1 A 55 55 SER HA H 33 3.930 4.424 -0.494 1
1 412 . 14 1 1 A 55 55 SER C C 33 173.830 178.315 -4.485 1
1 413 . 14 1 1 A 55 55 SER CA C 33 61.620 64.725 -3.105 1
1 414 . 14 1 1 A 55 55 SER CB C 33 62.720 31.939 30.781 1
1 415 . 14 1 1 A 55 55 SER N N 33 115.780 137.551 -21.771 1
1 416 . 14 1 1 A 56 56 LYS H H 34 7.150 8.632 -1.482 1
1 417 . 14 1 1 A 56 56 LYS HA H 34 4.090 4.242 -0.152 1
1 424 . 14 1 1 A 56 56 LYS C C 34 176.080 176.912 -0.832 1
1 425 . 14 1 1 A 56 56 LYS CA C 34 58.950 58.220 0.730 1
1 426 . 14 1 1 A 56 56 LYS CB C 34 32.540 33.350 -0.810 1
1 429 . 14 1 1 A 56 56 LYS N N 34 119.100 117.188 1.912 1
1 430 . 14 1 1 A 57 57 ARG H H 35 7.530 7.775 -0.245 1
1 431 . 14 1 1 A 57 57 ARG HA H 35 4.110 4.713 -0.603 1
1 436 . 14 1 1 A 57 57 ARG C C 35 174.800 173.880 0.920 1
1 437 . 14 1 1 A 57 57 ARG CA C 35 57.090 55.585 1.505 1
1 438 . 14 1 1 A 57 57 ARG CB C 35 29.810 31.495 -1.685 1
1 440 . 14 1 1 A 57 57 ARG N N 35 119.370 113.252 6.118 1
1 441 . 14 1 1 A 58 58 PHE H H 36 8.320 8.642 -0.322 1
1 442 . 14 1 1 A 58 58 PHE HA H 36 4.340 5.681 -1.341 1
1 449 . 14 1 1 A 58 58 PHE C C 36 171.940 175.226 -3.286 1
1 450 . 14 1 1 A 58 58 PHE CA C 36 58.500 54.687 3.813 1
1 451 . 14 1 1 A 58 58 PHE CB C 36 38.130 35.691 2.439 1
1 454 . 14 1 1 A 58 58 PHE N N 36 113.980 119.146 -5.166 1
1 455 . 14 1 1 A 59 59 LYS H H 37 7.790 9.109 -1.319 1
1 456 . 14 1 1 A 59 59 LYS HA H 37 3.960 4.979 -1.019 1
1 463 . 14 1 1 A 59 59 LYS C C 37 172.670 174.271 -1.601 1
1 464 . 14 1 1 A 59 59 LYS CA C 37 57.140 54.528 2.612 1
1 465 . 14 1 1 A 59 59 LYS CB C 37 29.020 32.932 -3.912 1
1 468 . 14 1 1 A 59 59 LYS N N 37 118.810 122.723 -3.913 1
1 469 . 14 1 1 A 60 60 SER H H 38 7.750 8.327 -0.577 1
1 470 . 14 1 1 A 60 60 SER HA H 38 4.700 4.936 -0.236 1
1 473 . 14 1 1 A 60 60 SER C C 38 170.170 175.003 -4.833 1
1 474 . 14 1 1 A 60 60 SER CA C 38 57.130 55.279 1.851 1
1 475 . 14 1 1 A 60 60 SER CB C 38 66.820 31.359 35.461 1
1 476 . 14 1 1 A 60 60 SER N N 38 112.620 122.578 -9.958 1
1 477 . 14 1 1 A 61 61 HIS H H 39 8.630 9.180 -0.550 1
1 478 . 14 1 1 A 61 61 HIS N N 39 124.090 124.794 -0.704 1
1 479 . 14 1 1 A 62 62 THR HA H 40 3.610 5.321 -1.711 1
1 484 . 14 1 1 A 62 62 THR C C 40 174.350 176.022 -1.672 1
1 485 . 14 1 1 A 62 62 THR CA C 40 66.160 50.895 15.265 1
1 486 . 14 1 1 A 62 62 THR CB C 40 68.070 20.886 47.184 1
1 488 . 14 1 1 A 63 63 ASP H H 41 10.310 8.859 1.451 1
1 489 . 14 1 1 A 63 63 ASP HA H 41 4.420 4.951 -0.531 1
1 492 . 14 1 1 A 63 63 ASP C C 41 174.630 175.260 -0.630 1
1 493 . 14 1 1 A 63 63 ASP CA C 41 56.330 58.092 -1.762 1
1 494 . 14 1 1 A 63 63 ASP CB C 41 40.040 34.718 5.322 1
1 495 . 14 1 1 A 63 63 ASP N N 41 122.900 117.843 5.057 1
1 497 . 14 1 1 A 64 64 GLN HA H 42 4.270 4.529 -0.259 1
1 504 . 14 1 1 A 64 64 GLN C C 42 172.160 176.508 -4.348 1
1 505 . 14 1 1 A 64 64 GLN CA C 42 55.860 63.557 -7.697 1
1 506 . 14 1 1 A 64 64 GLN CB C 42 30.480 31.896 -1.416 1
1 508 . 14 1 1 A 64 64 GLN N N 42 115.750 138.585 -22.835 1
1 510 . 14 1 1 A 65 65 LEU H H 43 7.250 7.936 -0.686 1
1 511 . 14 1 1 A 65 65 LEU HA H 43 4.440 3.972 0.468 1
1 517 . 14 1 1 A 65 65 LEU C C 43 173.160 175.877 -2.717 1
1 518 . 14 1 1 A 65 65 LEU CA C 43 54.620 58.294 -3.674 1
1 519 . 14 1 1 A 65 65 LEU CB C 43 41.990 27.552 14.438 1
1 521 . 14 1 1 A 65 65 LEU N N 43 116.570 113.859 2.711 1
1 522 . 14 1 1 A 66 66 VAL H H 44 8.690 7.982 0.708 1
1 523 . 14 1 1 A 66 66 VAL HA H 44 3.980 4.931 -0.951 1
1 528 . 14 1 1 A 66 66 VAL C C 44 171.340 175.512 -4.172 1
1 529 . 14 1 1 A 66 66 VAL CA C 44 61.910 53.270 8.640 1
1 530 . 14 1 1 A 66 66 VAL CB C 44 33.630 40.031 -6.401 1
1 532 . 14 1 1 A 66 66 VAL N N 44 125.260 117.205 8.055 1
1 533 . 14 1 1 A 67 67 LEU H H 45 8.570 7.714 0.856 1
1 534 . 14 1 1 A 67 67 LEU HA H 45 5.220 4.515 0.705 1
1 544 . 14 1 1 A 67 67 LEU C C 45 172.500 174.347 -1.847 1
1 545 . 14 1 1 A 67 67 LEU CA C 45 52.820 60.264 -7.444 1
1 546 . 14 1 1 A 67 67 LEU CB C 45 45.310 63.709 -18.399 1
1 550 . 14 1 1 A 67 67 LEU N N 45 126.690 116.643 10.047 1
1 551 . 14 1 1 A 68 68 ILE H H 46 9.040 8.753 0.287 1
1 552 . 14 1 1 A 68 68 ILE HA H 46 4.880 4.507 0.373 1
1 562 . 14 1 1 A 68 68 ILE C C 46 172.390 175.778 -3.388 1
1 563 . 14 1 1 A 68 68 ILE CA C 46 59.900 58.325 1.575 1
1 564 . 14 1 1 A 68 68 ILE CB C 46 41.940 64.378 -22.438 1
1 568 . 14 1 1 A 68 68 ILE N N 46 122.590 121.318 1.272 1
1 569 . 14 1 1 A 69 69 PHE H H 47 8.740 8.700 0.040 1
1 570 . 14 1 1 A 69 69 PHE N N 47 125.360 123.450 1.910 1
1 571 . 14 1 1 A 70 70 ALA HA H 48 3.600 4.010 -0.410 1
1 575 . 14 1 1 A 70 70 ALA C C 48 174.500 177.810 -3.310 1
1 576 . 14 1 1 A 70 70 ALA CA C 48 52.520 59.012 -6.492 1
1 577 . 14 1 1 A 70 70 ALA CB C 48 16.760 28.094 -11.334 1
1 578 . 14 1 1 A 71 71 GLY H H 49 8.210 7.626 0.584 1
1 581 . 14 1 1 A 71 71 GLY C C 49 170.850 177.836 -6.986 1
1 582 . 14 1 1 A 71 71 GLY CA C 49 45.380 56.951 -11.571 1
1 583 . 14 1 1 A 71 71 GLY N N 49 102.430 116.775 -14.345 1
1 584 . 14 1 1 A 72 72 LYS H H 50 7.840 8.119 -0.279 1
1 585 . 14 1 1 A 72 72 LYS HA H 50 4.530 4.063 0.467 1
1 594 . 14 1 1 A 72 72 LYS C C 50 171.800 177.836 -6.036 1
1 595 . 14 1 1 A 72 72 LYS CA C 50 54.630 61.084 -6.454 1
1 596 . 14 1 1 A 72 72 LYS CB C 50 34.630 39.105 -4.475 1
1 600 . 14 1 1 A 72 72 LYS N N 50 121.570 123.095 -1.525 1
1 601 . 14 1 1 A 73 73 ILE H H 51 8.250 7.965 0.285 1
1 602 . 14 1 1 A 73 73 ILE HA H 51 4.260 3.886 0.374 1
1 612 . 14 1 1 A 73 73 ILE C C 51 174.300 178.016 -3.716 1
1 613 . 14 1 1 A 73 73 ILE CA C 51 61.270 58.223 3.047 1
1 614 . 14 1 1 A 73 73 ILE CB C 51 38.150 31.252 6.898 1
1 618 . 14 1 1 A 73 73 ILE N N 51 122.710 117.900 4.810 1
1 619 . 14 1 1 A 74 74 LEU H H 52 8.540 8.226 0.314 1
1 620 . 14 1 1 A 74 74 LEU HA H 52 3.980 4.061 -0.081 1
1 630 . 14 1 1 A 74 74 LEU C C 52 173.440 179.340 -5.900 1
1 631 . 14 1 1 A 74 74 LEU CA C 52 54.660 59.148 -4.488 1
1 632 . 14 1 1 A 74 74 LEU CB C 52 41.790 29.045 12.745 1
1 636 . 14 1 1 A 74 74 LEU N N 52 128.360 119.049 9.311 1
1 637 . 14 1 1 A 75 75 LYS H H 53 8.100 7.696 0.404 1
1 638 . 14 1 1 A 75 75 LYS HA H 53 4.440 4.126 0.314 1
1 645 . 14 1 1 A 75 75 LYS C C 53 175.170 179.376 -4.206 1
1 646 . 14 1 1 A 75 75 LYS CA C 53 55.340 59.157 -3.817 1
1 647 . 14 1 1 A 75 75 LYS CB C 53 32.680 28.955 3.725 1
1 650 . 14 1 1 A 75 75 LYS N N 53 123.470 120.502 2.968 1
1 651 . 14 1 1 A 76 76 ASP H H 54 8.310 7.475 0.835 1
1 652 . 14 1 1 A 76 76 ASP HA H 54 4.110 3.914 0.196 1
1 655 . 14 1 1 A 76 76 ASP C C 54 174.270 178.032 -3.762 1
1 656 . 14 1 1 A 76 76 ASP CA C 54 58.140 64.370 -6.230 1
1 657 . 14 1 1 A 76 76 ASP CB C 54 40.760 36.289 4.471 1
1 658 . 14 1 1 A 76 76 ASP N N 54 121.080 121.729 -0.649 1
1 659 . 14 1 1 A 77 77 GLN H H 55 8.180 8.014 0.166 1
1 660 . 14 1 1 A 77 77 GLN HA H 55 4.360 4.400 -0.040 1
1 667 . 14 1 1 A 77 77 GLN C C 55 173.710 176.665 -2.955 1
1 668 . 14 1 1 A 77 77 GLN CA C 55 56.350 61.238 -4.888 1
1 669 . 14 1 1 A 77 77 GLN CB C 55 28.090 62.589 -34.499 1
1 671 . 14 1 1 A 77 77 GLN N N 55 113.190 116.069 -2.879 1
1 673 . 14 1 1 A 78 78 ASP H H 56 7.770 8.129 -0.359 1
1 674 . 14 1 1 A 78 78 ASP HA H 56 4.700 4.096 0.604 1
1 677 . 14 1 1 A 78 78 ASP C C 56 173.500 178.793 -5.293 1
1 678 . 14 1 1 A 78 78 ASP CA C 56 54.140 58.640 -4.500 1
1 679 . 14 1 1 A 78 78 ASP CB C 56 42.020 31.585 10.435 1
1 680 . 14 1 1 A 78 78 ASP N N 56 121.910 119.150 2.760 1
1 681 . 14 1 1 A 79 79 THR H H 57 8.490 7.957 0.533 1
1 682 . 14 1 1 A 79 79 THR HA H 57 4.700 4.040 0.660 1
1 687 . 14 1 1 A 79 79 THR C C 57 172.840 178.151 -5.311 1
1 688 . 14 1 1 A 79 79 THR CA C 57 59.980 59.058 0.922 1
1 689 . 14 1 1 A 79 79 THR CB C 57 70.640 30.569 40.071 1
1 691 . 14 1 1 A 79 79 THR N N 57 108.860 119.953 -11.093 1
1 692 . 14 1 1 A 80 80 LEU H H 58 7.700 8.039 -0.339 1
1 693 . 14 1 1 A 80 80 LEU HA H 58 3.880 4.609 -0.729 1
1 703 . 14 1 1 A 80 80 LEU C C 58 177.370 174.779 2.591 1
1 704 . 14 1 1 A 80 80 LEU CA C 58 58.450 57.352 1.098 1
1 705 . 14 1 1 A 80 80 LEU CB C 58 39.500 39.128 0.372 1
1 709 . 14 1 1 A 80 80 LEU N N 58 118.820 115.763 3.057 1
1 710 . 14 1 1 A 81 81 SER H H 59 8.810 7.592 1.218 1
1 711 . 14 1 1 A 81 81 SER HA H 59 4.050 3.830 0.220 1
1 714 . 14 1 1 A 81 81 SER C C 59 176.150 174.398 1.752 1
1 715 . 14 1 1 A 81 81 SER CA C 59 61.190 57.355 3.835 1
1 716 . 14 1 1 A 81 81 SER CB C 59 62.490 28.936 33.554 1
1 717 . 14 1 1 A 81 81 SER N N 59 114.240 116.256 -2.016 1
1 718 . 14 1 1 A 82 82 GLN H H 60 7.950 7.566 0.384 1
1 719 . 14 1 1 A 82 82 GLN HA H 60 4.090 4.704 -0.614 1
1 726 . 14 1 1 A 82 82 GLN C C 60 173.930 173.535 0.395 1
1 727 . 14 1 1 A 82 82 GLN CA C 60 58.080 57.410 0.670 1
1 728 . 14 1 1 A 82 82 GLN CB C 60 28.460 65.321 -36.861 1
1 730 . 14 1 1 A 82 82 GLN N N 60 122.620 113.780 8.840 1
1 732 . 14 1 1 A 83 83 HIS H H 61 6.990 8.489 -1.499 1
1 733 . 14 1 1 A 83 83 HIS HA H 61 4.490 4.620 -0.130 1
1 736 . 14 1 1 A 83 83 HIS C C 61 172.260 177.088 -4.828 1
1 737 . 14 1 1 A 83 83 HIS CA C 61 57.110 56.731 0.379 1
1 738 . 14 1 1 A 83 83 HIS CB C 61 32.780 30.388 2.392 1
1 739 . 14 1 1 A 83 83 HIS N N 61 116.940 122.646 -5.706 1
1 740 . 14 1 1 A 84 84 GLY H H 62 7.870 9.088 -1.218 1
1 743 . 14 1 1 A 84 84 GLY C C 62 171.040 175.261 -4.221 1
1 744 . 14 1 1 A 84 84 GLY CA C 62 45.390 65.071 -19.681 1
1 745 . 14 1 1 A 84 84 GLY N N 62 106.740 117.272 -10.532 1
1 746 . 14 1 1 A 85 85 ILE H H 63 6.810 8.962 -2.152 1
1 747 . 14 1 1 A 85 85 ILE HA H 63 3.050 4.345 -1.295 1
1 757 . 14 1 1 A 85 85 ILE C C 63 170.130 177.937 -7.807 1
1 758 . 14 1 1 A 85 85 ILE CA C 63 62.440 56.129 6.311 1
1 759 . 14 1 1 A 85 85 ILE CB C 63 36.110 39.431 -3.321 1
1 763 . 14 1 1 A 85 85 ILE N N 63 118.920 121.767 -2.847 1
1 764 . 14 1 1 A 86 86 HIS H H 64 6.020 7.813 -1.793 1
1 765 . 14 1 1 A 86 86 HIS HA H 64 5.030 4.288 0.742 1
1 768 . 14 1 1 A 86 86 HIS C C 64 170.090 176.895 -6.805 1
1 769 . 14 1 1 A 86 86 HIS CA C 64 53.500 57.624 -4.124 1
1 770 . 14 1 1 A 86 86 HIS CB C 64 31.860 29.212 2.648 1
1 771 . 14 1 1 A 86 86 HIS N N 64 122.440 117.148 5.292 1
1 772 . 14 1 1 A 87 87 ASP H H 65 8.340 7.163 1.177 1
1 773 . 14 1 1 A 87 87 ASP HA H 65 4.320 4.369 -0.049 1
1 776 . 14 1 1 A 87 87 ASP C C 65 174.370 175.748 -1.378 1
1 777 . 14 1 1 A 87 87 ASP CA C 65 56.440 54.195 2.245 1
1 778 . 14 1 1 A 87 87 ASP CB C 65 43.150 40.781 2.369 1
1 779 . 14 1 1 A 87 87 ASP N N 65 116.230 121.399 -5.169 1
1 780 . 14 1 1 A 88 88 GLY H H 66 9.330 8.754 0.576 1
1 783 . 14 1 1 A 88 88 GLY C C 66 172.330 174.537 -2.207 1
1 784 . 14 1 1 A 88 88 GLY CA C 66 45.270 60.492 -15.222 1
1 785 . 14 1 1 A 88 88 GLY N N 66 112.300 120.305 -8.005 1
1 786 . 14 1 1 A 89 89 LEU H H 67 7.640 9.037 -1.397 1
1 787 . 14 1 1 A 89 89 LEU HA H 67 4.720 4.982 -0.262 1
1 797 . 14 1 1 A 89 89 LEU C C 67 172.460 176.456 -3.996 1
1 798 . 14 1 1 A 89 89 LEU CA C 67 54.420 53.964 0.456 1
1 799 . 14 1 1 A 89 89 LEU CB C 67 42.260 42.849 -0.589 1
1 803 . 14 1 1 A 89 89 LEU N N 67 120.310 127.838 -7.528 1
1 804 . 14 1 1 A 90 90 THR H H 68 8.110 8.952 -0.842 1
1 805 . 14 1 1 A 90 90 THR HA H 68 5.300 5.344 -0.044 1
1 810 . 14 1 1 A 90 90 THR C C 68 170.900 175.128 -4.228 1
1 811 . 14 1 1 A 90 90 THR CA C 68 61.870 60.027 1.843 1
1 812 . 14 1 1 A 90 90 THR CB C 68 71.320 39.944 31.376 1
1 814 . 14 1 1 A 90 90 THR N N 68 115.300 124.379 -9.079 1
1 815 . 14 1 1 A 91 91 VAL H H 69 9.290 9.079 0.211 1
1 816 . 14 1 1 A 91 91 VAL HA H 69 4.540 4.705 -0.165 1
1 824 . 14 1 1 A 91 91 VAL C C 69 170.890 174.621 -3.731 1
1 825 . 14 1 1 A 91 91 VAL CA C 69 60.310 57.721 2.589 1
1 826 . 14 1 1 A 91 91 VAL CB C 69 34.680 42.688 -8.008 1
1 829 . 14 1 1 A 91 91 VAL N N 69 124.200 126.875 -2.675 1
1 830 . 14 1 1 A 92 92 HIS H H 70 8.750 8.433 0.317 1
1 831 . 14 1 1 A 92 92 HIS HA H 70 5.020 3.738 1.282 1
1 835 . 14 1 1 A 92 92 HIS C C 70 170.890 177.202 -6.312 1
1 836 . 14 1 1 A 92 92 HIS CA C 70 56.750 53.103 3.647 1
1 837 . 14 1 1 A 92 92 HIS CB C 70 32.220 17.803 14.417 1
1 839 . 14 1 1 A 92 92 HIS N N 70 125.250 129.189 -3.939 1
1 840 . 14 1 1 A 93 93 LEU H H 71 8.290 8.484 -0.194 1
1 851 . 14 1 1 A 93 93 LEU C C 71 172.570 173.546 -0.976 1
1 852 . 14 1 1 A 93 93 LEU CA C 71 52.820 45.539 7.281 1
1 857 . 14 1 1 A 93 93 LEU N N 71 123.360 102.869 20.491 1
1 858 . 14 1 1 A 94 94 VAL H H 72 9.110 7.294 1.816 1
1 859 . 14 1 1 A 94 94 VAL HA H 72 4.080 4.897 -0.817 1
1 864 . 14 1 1 A 94 94 VAL C C 72 171.160 175.123 -3.963 1
1 865 . 14 1 1 A 94 94 VAL CA C 72 61.350 54.151 7.199 1
1 866 . 14 1 1 A 94 94 VAL CB C 72 34.640 35.987 -1.347 1
1 868 . 14 1 1 A 94 94 VAL N N 72 128.650 114.745 13.905 1
1 869 . 14 1 1 A 95 95 ILE H H 73 8.150 8.237 -0.087 1
1 870 . 14 1 1 A 95 95 ILE HA H 73 4.500 4.701 -0.201 1
1 880 . 14 1 1 A 95 95 ILE C C 73 174.320 175.661 -1.341 1
1 881 . 14 1 1 A 95 95 ILE CA C 73 60.170 60.475 -0.305 1
1 882 . 14 1 1 A 95 95 ILE CB C 73 38.120 39.000 -0.880 1
1 886 . 14 1 1 A 95 95 ILE N N 73 125.560 119.394 6.166 1
1 887 . 14 1 1 A 96 96 LYS H H 74 9.280 8.878 0.402 1
1 888 . 14 1 1 A 96 96 LYS HA H 74 4.240 4.380 -0.140 1
1 891 . 14 1 1 A 96 96 LYS C C 74 173.510 176.529 -3.019 1
1 892 . 14 1 1 A 96 96 LYS CA C 74 56.730 54.347 2.383 1
1 893 . 14 1 1 A 96 96 LYS CB C 74 33.100 41.273 -8.173 1
1 894 . 14 1 1 A 96 96 LYS N N 74 129.290 127.683 1.607 1
1 895 . 14 1 1 A 97 97 THR H H 75 8.040 8.965 -0.925 1
1 896 . 14 1 1 A 97 97 THR HA H 75 4.230 4.628 -0.398 1
1 901 . 14 1 1 A 97 97 THR C C 75 171.800 177.568 -5.768 1
1 902 . 14 1 1 A 97 97 THR CA C 75 61.760 54.997 6.763 1
1 903 . 14 1 1 A 97 97 THR CB C 75 69.830 34.643 35.187 1
1 905 . 14 1 1 A 97 97 THR N N 75 114.420 124.107 -9.687 1
1 906 . 14 1 1 A 98 98 GLN H H 76 8.400 8.894 -0.494 1
1 907 . 14 1 1 A 98 98 GLN HA H 76 4.210 4.378 -0.168 1
1 914 . 14 1 1 A 98 98 GLN CA C 76 55.880 56.736 -0.856 1
1 915 . 14 1 1 A 98 98 GLN CB C 76 29.700 40.011 -10.311 1
1 917 . 14 1 1 A 98 98 GLN N N 76 122.370 121.204 1.166 1
1 919 . 14 1 1 A 99 99 ASN HA H 77 4.590 4.254 0.336 1
1 924 . 14 1 1 A 99 99 ASN C C 77 171.780 175.521 -3.741 1
1 925 . 14 1 1 A 99 99 ASN CA C 77 53.300 57.163 -3.863 1
1 926 . 14 1 1 A 99 99 ASN CB C 77 38.920 28.116 10.804 1
1 928 . 14 1 1 A 100 100 ARG H H 78 8.160 7.633 0.527 1
1 929 . 14 1 1 A 100 100 ARG HA H 78 4.560 5.138 -0.578 1
1 936 . 14 1 1 A 100 100 ARG CA C 78 53.860 52.640 1.220 1
1 937 . 14 1 1 A 100 100 ARG CB C 78 30.210 42.873 -12.663 1
1 940 . 14 1 1 A 100 100 ARG N N 78 122.840 120.732 2.108 1
1 941 . 14 1 1 A 101 101 PRO HA H 79 4.150 4.940 -0.790 1
1 948 . 14 1 1 A 101 101 PRO CA C 79 64.770 59.269 5.501 1
1 949 . 14 1 1 A 101 101 PRO CB C 79 32.040 71.611 -39.571 1
1 289 . 15 1 1 A 46 46 SER H H 24 8.950 8.456 0.494 1
1 290 . 15 1 1 A 46 46 SER HA H 24 4.900 4.453 0.447 1
1 293 . 15 1 1 A 46 46 SER C C 24 170.890 176.327 -5.437 1
1 294 . 15 1 1 A 46 46 SER CA C 24 56.980 55.813 1.167 1
1 295 . 15 1 1 A 46 46 SER CB C 24 65.590 33.511 32.079 1
1 296 . 15 1 1 A 46 46 SER N N 24 120.420 121.570 -1.150 1
1 297 . 15 1 1 A 47 47 VAL H H 25 9.140 8.223 0.917 1
1 298 . 15 1 1 A 47 47 VAL HA H 25 3.440 4.269 -0.829 1
1 306 . 15 1 1 A 47 47 VAL C C 25 175.060 175.466 -0.406 1
1 307 . 15 1 1 A 47 47 VAL CA C 25 67.250 61.141 6.109 1
1 308 . 15 1 1 A 47 47 VAL CB C 25 30.780 39.343 -8.563 1
1 311 . 15 1 1 A 47 47 VAL N N 25 123.970 126.195 -2.225 1
1 312 . 15 1 1 A 48 48 GLN H H 26 8.540 8.450 0.090 1
1 313 . 15 1 1 A 48 48 GLN HA H 26 4.070 4.731 -0.661 1
1 320 . 15 1 1 A 48 48 GLN CA C 26 60.230 55.206 5.024 1
1 321 . 15 1 1 A 48 48 GLN CB C 26 28.490 33.225 -4.735 1
1 323 . 15 1 1 A 48 48 GLN N N 26 120.550 126.750 -6.200 1
1 325 . 15 1 1 A 49 49 GLN HA H 27 3.950 4.906 -0.956 1
1 332 . 15 1 1 A 49 49 GLN C C 27 176.230 175.257 0.973 1
1 333 . 15 1 1 A 49 49 GLN CA C 27 58.710 55.563 3.147 1
1 334 . 15 1 1 A 49 49 GLN CB C 27 28.820 31.998 -3.178 1
1 337 . 15 1 1 A 50 50 PHE H H 28 8.050 8.652 -0.602 1
1 338 . 15 1 1 A 50 50 PHE HA H 28 4.620 4.462 0.158 1
1 345 . 15 1 1 A 50 50 PHE C C 28 175.190 175.780 -0.590 1
1 346 . 15 1 1 A 50 50 PHE CA C 28 58.030 61.967 -3.937 1
1 347 . 15 1 1 A 50 50 PHE CB C 28 39.190 31.900 7.290 1
1 350 . 15 1 1 A 50 50 PHE N N 28 121.710 125.038 -3.328 1
1 351 . 15 1 1 A 51 51 LYS H H 29 8.940 8.594 0.346 1
1 352 . 15 1 1 A 51 51 LYS HA H 29 3.340 4.913 -1.573 1
1 361 . 15 1 1 A 51 51 LYS C C 29 175.370 174.361 1.009 1
1 362 . 15 1 1 A 51 51 LYS CA C 29 60.660 62.523 -1.863 1
1 363 . 15 1 1 A 51 51 LYS CB C 29 33.190 70.129 -36.939 1
1 367 . 15 1 1 A 51 51 LYS N N 29 117.530 123.022 -5.492 1
1 368 . 15 1 1 A 52 52 GLU H H 30 7.700 9.185 -1.485 1
1 369 . 15 1 1 A 52 52 GLU HA H 30 3.750 4.820 -1.070 1
1 374 . 15 1 1 A 52 52 GLU C C 30 176.780 174.021 2.759 1
1 375 . 15 1 1 A 52 52 GLU CA C 30 59.890 61.214 -1.324 1
1 376 . 15 1 1 A 52 52 GLU CB C 30 28.840 35.311 -6.471 1
1 378 . 15 1 1 A 52 52 GLU N N 30 118.820 125.672 -6.852 1
1 379 . 15 1 1 A 53 53 GLU H H 31 7.370 9.267 -1.897 1
1 380 . 15 1 1 A 53 53 GLU HA H 31 4.150 4.978 -0.828 1
1 385 . 15 1 1 A 53 53 GLU C C 31 177.040 176.198 0.842 1
1 386 . 15 1 1 A 53 53 GLU CA C 31 58.860 55.155 3.705 1
1 387 . 15 1 1 A 53 53 GLU CB C 31 29.200 34.103 -4.903 1
1 389 . 15 1 1 A 53 53 GLU N N 31 119.150 128.820 -9.670 1
1 390 . 15 1 1 A 54 54 ILE H H 32 8.000 8.563 -0.563 1
1 391 . 15 1 1 A 54 54 ILE HA H 32 3.550 4.848 -1.298 1
1 401 . 15 1 1 A 54 54 ILE C C 32 175.420 173.906 1.514 1
1 402 . 15 1 1 A 54 54 ILE CA C 32 64.690 58.693 5.997 1
1 403 . 15 1 1 A 54 54 ILE CB C 32 37.820 70.038 -32.218 1
1 407 . 15 1 1 A 54 54 ILE N N 32 119.970 117.223 2.747 1
1 409 . 15 1 1 A 55 55 SER HA H 33 3.930 4.422 -0.492 1
1 412 . 15 1 1 A 55 55 SER C C 33 173.830 177.614 -3.784 1
1 413 . 15 1 1 A 55 55 SER CA C 33 61.620 64.680 -3.060 1
1 414 . 15 1 1 A 55 55 SER CB C 33 62.720 31.817 30.903 1
1 415 . 15 1 1 A 55 55 SER N N 33 115.780 136.083 -20.303 1
1 416 . 15 1 1 A 56 56 LYS H H 34 7.150 8.115 -0.965 1
1 417 . 15 1 1 A 56 56 LYS HA H 34 4.090 4.307 -0.217 1
1 424 . 15 1 1 A 56 56 LYS C C 34 176.080 176.515 -0.435 1
1 425 . 15 1 1 A 56 56 LYS CA C 34 58.950 57.222 1.728 1
1 426 . 15 1 1 A 56 56 LYS CB C 34 32.540 34.049 -1.509 1
1 429 . 15 1 1 A 56 56 LYS N N 34 119.100 116.396 2.704 1
1 430 . 15 1 1 A 57 57 ARG H H 35 7.530 7.759 -0.229 1
1 431 . 15 1 1 A 57 57 ARG HA H 35 4.110 4.639 -0.529 1
1 436 . 15 1 1 A 57 57 ARG C C 35 174.800 173.712 1.088 1
1 437 . 15 1 1 A 57 57 ARG CA C 35 57.090 55.497 1.593 1
1 438 . 15 1 1 A 57 57 ARG CB C 35 29.810 31.028 -1.218 1
1 440 . 15 1 1 A 57 57 ARG N N 35 119.370 113.951 5.419 1
1 441 . 15 1 1 A 58 58 PHE H H 36 8.320 8.626 -0.306 1
1 442 . 15 1 1 A 58 58 PHE HA H 36 4.340 5.592 -1.252 1
1 449 . 15 1 1 A 58 58 PHE C C 36 171.940 174.886 -2.946 1
1 450 . 15 1 1 A 58 58 PHE CA C 36 58.500 54.815 3.685 1
1 451 . 15 1 1 A 58 58 PHE CB C 36 38.130 35.709 2.421 1
1 454 . 15 1 1 A 58 58 PHE N N 36 113.980 121.232 -7.252 1
1 455 . 15 1 1 A 59 59 LYS H H 37 7.790 9.057 -1.267 1
1 456 . 15 1 1 A 59 59 LYS HA H 37 3.960 4.841 -0.881 1
1 463 . 15 1 1 A 59 59 LYS C C 37 172.670 174.581 -1.911 1
1 464 . 15 1 1 A 59 59 LYS CA C 37 57.140 54.583 2.557 1
1 465 . 15 1 1 A 59 59 LYS CB C 37 29.020 32.837 -3.817 1
1 468 . 15 1 1 A 59 59 LYS N N 37 118.810 125.981 -7.171 1
1 469 . 15 1 1 A 60 60 SER H H 38 7.750 8.500 -0.750 1
1 470 . 15 1 1 A 60 60 SER HA H 38 4.700 5.049 -0.349 1
1 473 . 15 1 1 A 60 60 SER C C 38 170.170 174.548 -4.378 1
1 474 . 15 1 1 A 60 60 SER CA C 38 57.130 54.949 2.181 1
1 475 . 15 1 1 A 60 60 SER CB C 38 66.820 33.012 33.808 1
1 476 . 15 1 1 A 60 60 SER N N 38 112.620 122.048 -9.428 1
1 477 . 15 1 1 A 61 61 HIS H H 39 8.630 8.989 -0.359 1
1 478 . 15 1 1 A 61 61 HIS N N 39 124.090 124.685 -0.595 1
1 479 . 15 1 1 A 62 62 THR HA H 40 3.610 5.215 -1.605 1
1 484 . 15 1 1 A 62 62 THR C C 40 174.350 176.240 -1.890 1
1 485 . 15 1 1 A 62 62 THR CA C 40 66.160 50.516 15.644 1
1 486 . 15 1 1 A 62 62 THR CB C 40 68.070 20.467 47.603 1
1 488 . 15 1 1 A 63 63 ASP H H 41 10.310 8.846 1.464 1
1 489 . 15 1 1 A 63 63 ASP HA H 41 4.420 4.979 -0.559 1
1 492 . 15 1 1 A 63 63 ASP C C 41 174.630 174.445 0.185 1
1 493 . 15 1 1 A 63 63 ASP CA C 41 56.330 57.925 -1.595 1
1 494 . 15 1 1 A 63 63 ASP CB C 41 40.040 34.251 5.789 1
1 495 . 15 1 1 A 63 63 ASP N N 41 122.900 117.674 5.226 1
1 497 . 15 1 1 A 64 64 GLN HA H 42 4.270 4.567 -0.297 1
1 504 . 15 1 1 A 64 64 GLN C C 42 172.160 177.678 -5.518 1
1 505 . 15 1 1 A 64 64 GLN CA C 42 55.860 62.839 -6.979 1
1 506 . 15 1 1 A 64 64 GLN CB C 42 30.480 30.255 0.225 1
1 508 . 15 1 1 A 64 64 GLN N N 42 115.750 137.427 -21.677 1
1 510 . 15 1 1 A 65 65 LEU H H 43 7.250 8.209 -0.959 1
1 511 . 15 1 1 A 65 65 LEU HA H 43 4.440 3.951 0.489 1
1 517 . 15 1 1 A 65 65 LEU C C 43 173.160 175.757 -2.597 1
1 518 . 15 1 1 A 65 65 LEU CA C 43 54.620 57.505 -2.885 1
1 519 . 15 1 1 A 65 65 LEU CB C 43 41.990 27.466 14.524 1
1 521 . 15 1 1 A 65 65 LEU N N 43 116.570 118.568 -1.998 1
1 522 . 15 1 1 A 66 66 VAL H H 44 8.690 8.034 0.656 1
1 523 . 15 1 1 A 66 66 VAL HA H 44 3.980 5.014 -1.034 1
1 528 . 15 1 1 A 66 66 VAL C C 44 171.340 175.111 -3.771 1
1 529 . 15 1 1 A 66 66 VAL CA C 44 61.910 52.555 9.355 1
1 530 . 15 1 1 A 66 66 VAL CB C 44 33.630 40.801 -7.171 1
1 532 . 15 1 1 A 66 66 VAL N N 44 125.260 118.407 6.853 1
1 533 . 15 1 1 A 67 67 LEU H H 45 8.570 7.688 0.882 1
1 534 . 15 1 1 A 67 67 LEU HA H 45 5.220 4.355 0.865 1
1 544 . 15 1 1 A 67 67 LEU C C 45 172.500 174.516 -2.016 1
1 545 . 15 1 1 A 67 67 LEU CA C 45 52.820 60.146 -7.326 1
1 546 . 15 1 1 A 67 67 LEU CB C 45 45.310 63.368 -18.058 1
1 550 . 15 1 1 A 67 67 LEU N N 45 126.690 116.150 10.540 1
1 551 . 15 1 1 A 68 68 ILE H H 46 9.040 8.864 0.176 1
1 552 . 15 1 1 A 68 68 ILE HA H 46 4.880 4.454 0.426 1
1 562 . 15 1 1 A 68 68 ILE C C 46 172.390 175.680 -3.290 1
1 563 . 15 1 1 A 68 68 ILE CA C 46 59.900 58.768 1.132 1
1 564 . 15 1 1 A 68 68 ILE CB C 46 41.940 64.078 -22.138 1
1 568 . 15 1 1 A 68 68 ILE N N 46 122.590 122.094 0.496 1
1 569 . 15 1 1 A 69 69 PHE H H 47 8.740 8.715 0.025 1
1 570 . 15 1 1 A 69 69 PHE N N 47 125.360 123.846 1.514 1
1 571 . 15 1 1 A 70 70 ALA HA H 48 3.600 3.996 -0.396 1
1 575 . 15 1 1 A 70 70 ALA C C 48 174.500 178.549 -4.049 1
1 576 . 15 1 1 A 70 70 ALA CA C 48 52.520 59.345 -6.825 1
1 577 . 15 1 1 A 70 70 ALA CB C 48 16.760 28.472 -11.712 1
1 578 . 15 1 1 A 71 71 GLY H H 49 8.210 7.793 0.417 1
1 581 . 15 1 1 A 71 71 GLY C C 49 170.850 178.199 -7.349 1
1 582 . 15 1 1 A 71 71 GLY CA C 49 45.380 58.352 -12.972 1
1 583 . 15 1 1 A 71 71 GLY N N 49 102.430 118.823 -16.393 1
1 584 . 15 1 1 A 72 72 LYS H H 50 7.840 8.143 -0.303 1
1 585 . 15 1 1 A 72 72 LYS HA H 50 4.530 4.106 0.424 1
1 594 . 15 1 1 A 72 72 LYS C C 50 171.800 177.719 -5.919 1
1 595 . 15 1 1 A 72 72 LYS CA C 50 54.630 61.114 -6.484 1
1 596 . 15 1 1 A 72 72 LYS CB C 50 34.630 39.144 -4.514 1
1 600 . 15 1 1 A 72 72 LYS N N 50 121.570 120.690 0.880 1
1 601 . 15 1 1 A 73 73 ILE H H 51 8.250 8.200 0.050 1
1 602 . 15 1 1 A 73 73 ILE HA H 51 4.260 3.744 0.516 1
1 612 . 15 1 1 A 73 73 ILE C C 51 174.300 178.463 -4.163 1
1 613 . 15 1 1 A 73 73 ILE CA C 51 61.270 58.200 3.070 1
1 614 . 15 1 1 A 73 73 ILE CB C 51 38.150 31.257 6.893 1
1 618 . 15 1 1 A 73 73 ILE N N 51 122.710 118.011 4.699 1
1 619 . 15 1 1 A 74 74 LEU H H 52 8.540 8.149 0.391 1
1 620 . 15 1 1 A 74 74 LEU HA H 52 3.980 4.046 -0.066 1
1 630 . 15 1 1 A 74 74 LEU C C 52 173.440 179.186 -5.746 1
1 631 . 15 1 1 A 74 74 LEU CA C 52 54.660 59.039 -4.379 1
1 632 . 15 1 1 A 74 74 LEU CB C 52 41.790 29.314 12.476 1
1 636 . 15 1 1 A 74 74 LEU N N 52 128.360 119.043 9.317 1
1 637 . 15 1 1 A 75 75 LYS H H 53 8.100 8.077 0.023 1
1 638 . 15 1 1 A 75 75 LYS HA H 53 4.440 4.008 0.432 1
1 645 . 15 1 1 A 75 75 LYS C C 53 175.170 179.427 -4.257 1
1 646 . 15 1 1 A 75 75 LYS CA C 53 55.340 59.007 -3.667 1
1 647 . 15 1 1 A 75 75 LYS CB C 53 32.680 29.088 3.592 1
1 650 . 15 1 1 A 75 75 LYS N N 53 123.470 120.222 3.248 1
1 651 . 15 1 1 A 76 76 ASP H H 54 8.310 7.138 1.172 1
1 652 . 15 1 1 A 76 76 ASP HA H 54 4.110 3.685 0.425 1
1 655 . 15 1 1 A 76 76 ASP C C 54 174.270 177.834 -3.564 1
1 656 . 15 1 1 A 76 76 ASP CA C 54 58.140 63.394 -5.254 1
1 657 . 15 1 1 A 76 76 ASP CB C 54 40.760 35.902 4.858 1
1 658 . 15 1 1 A 76 76 ASP N N 54 121.080 121.253 -0.173 1
1 659 . 15 1 1 A 77 77 GLN H H 55 8.180 7.991 0.189 1
1 660 . 15 1 1 A 77 77 GLN HA H 55 4.360 4.062 0.298 1
1 667 . 15 1 1 A 77 77 GLN C C 55 173.710 176.607 -2.897 1
1 668 . 15 1 1 A 77 77 GLN CA C 55 56.350 61.933 -5.583 1
1 669 . 15 1 1 A 77 77 GLN CB C 55 28.090 62.821 -34.731 1
1 671 . 15 1 1 A 77 77 GLN N N 55 113.190 117.177 -3.987 1
1 673 . 15 1 1 A 78 78 ASP H H 56 7.770 7.793 -0.023 1
1 674 . 15 1 1 A 78 78 ASP HA H 56 4.700 4.081 0.619 1
1 677 . 15 1 1 A 78 78 ASP C C 56 173.500 178.779 -5.279 1
1 678 . 15 1 1 A 78 78 ASP CA C 56 54.140 58.581 -4.441 1
1 679 . 15 1 1 A 78 78 ASP CB C 56 42.020 31.424 10.596 1
1 680 . 15 1 1 A 78 78 ASP N N 56 121.910 119.198 2.712 1
1 681 . 15 1 1 A 79 79 THR H H 57 8.490 7.866 0.624 1
1 682 . 15 1 1 A 79 79 THR HA H 57 4.700 3.996 0.704 1
1 687 . 15 1 1 A 79 79 THR C C 57 172.840 177.889 -5.049 1
1 688 . 15 1 1 A 79 79 THR CA C 57 59.980 58.830 1.150 1
1 689 . 15 1 1 A 79 79 THR CB C 57 70.640 30.539 40.101 1
1 691 . 15 1 1 A 79 79 THR N N 57 108.860 119.919 -11.059 1
1 692 . 15 1 1 A 80 80 LEU H H 58 7.700 7.707 -0.007 1
1 693 . 15 1 1 A 80 80 LEU HA H 58 3.880 4.592 -0.712 1
1 703 . 15 1 1 A 80 80 LEU C C 58 177.370 174.933 2.437 1
1 704 . 15 1 1 A 80 80 LEU CA C 58 58.450 57.390 1.060 1
1 705 . 15 1 1 A 80 80 LEU CB C 58 39.500 39.392 0.108 1
1 709 . 15 1 1 A 80 80 LEU N N 58 118.820 115.196 3.624 1
1 710 . 15 1 1 A 81 81 SER H H 59 8.810 7.670 1.140 1
1 711 . 15 1 1 A 81 81 SER HA H 59 4.050 3.856 0.194 1
1 714 . 15 1 1 A 81 81 SER C C 59 176.150 175.192 0.958 1
1 715 . 15 1 1 A 81 81 SER CA C 59 61.190 57.618 3.572 1
1 716 . 15 1 1 A 81 81 SER CB C 59 62.490 29.274 33.216 1
1 717 . 15 1 1 A 81 81 SER N N 59 114.240 116.294 -2.054 1
1 718 . 15 1 1 A 82 82 GLN H H 60 7.950 7.667 0.283 1
1 719 . 15 1 1 A 82 82 GLN HA H 60 4.090 4.791 -0.701 1
1 726 . 15 1 1 A 82 82 GLN C C 60 173.930 173.529 0.401 1
1 727 . 15 1 1 A 82 82 GLN CA C 60 58.080 58.033 0.047 1
1 728 . 15 1 1 A 82 82 GLN CB C 60 28.460 65.495 -37.035 1
1 730 . 15 1 1 A 82 82 GLN N N 60 122.620 114.526 8.094 1
1 732 . 15 1 1 A 83 83 HIS H H 61 6.990 8.760 -1.770 1
1 733 . 15 1 1 A 83 83 HIS HA H 61 4.490 4.932 -0.442 1
1 736 . 15 1 1 A 83 83 HIS C C 61 172.260 176.750 -4.490 1
1 737 . 15 1 1 A 83 83 HIS CA C 61 57.110 55.498 1.612 1
1 738 . 15 1 1 A 83 83 HIS CB C 61 32.780 31.453 1.327 1
1 739 . 15 1 1 A 83 83 HIS N N 61 116.940 120.526 -3.586 1
1 740 . 15 1 1 A 84 84 GLY H H 62 7.870 9.165 -1.295 1
1 743 . 15 1 1 A 84 84 GLY C C 62 171.040 176.318 -5.278 1
1 744 . 15 1 1 A 84 84 GLY CA C 62 45.390 65.972 -20.582 1
1 745 . 15 1 1 A 84 84 GLY N N 62 106.740 117.467 -10.727 1
1 746 . 15 1 1 A 85 85 ILE H H 63 6.810 8.187 -1.377 1
1 747 . 15 1 1 A 85 85 ILE HA H 63 3.050 4.496 -1.446 1
1 757 . 15 1 1 A 85 85 ILE C C 63 170.130 178.171 -8.041 1
1 758 . 15 1 1 A 85 85 ILE CA C 63 62.440 57.033 5.407 1
1 759 . 15 1 1 A 85 85 ILE CB C 63 36.110 41.486 -5.376 1
1 763 . 15 1 1 A 85 85 ILE N N 63 118.920 121.733 -2.813 1
1 764 . 15 1 1 A 86 86 HIS H H 64 6.020 7.871 -1.851 1
1 765 . 15 1 1 A 86 86 HIS HA H 64 5.030 4.333 0.697 1
1 768 . 15 1 1 A 86 86 HIS C C 64 170.090 176.564 -6.474 1
1 769 . 15 1 1 A 86 86 HIS CA C 64 53.500 57.242 -3.742 1
1 770 . 15 1 1 A 86 86 HIS CB C 64 31.860 29.317 2.543 1
1 771 . 15 1 1 A 86 86 HIS N N 64 122.440 116.057 6.383 1
1 772 . 15 1 1 A 87 87 ASP H H 65 8.340 7.322 1.018 1
1 773 . 15 1 1 A 87 87 ASP HA H 65 4.320 4.400 -0.080 1
1 776 . 15 1 1 A 87 87 ASP C C 65 174.370 176.037 -1.667 1
1 777 . 15 1 1 A 87 87 ASP CA C 65 56.440 54.026 2.414 1
1 778 . 15 1 1 A 87 87 ASP CB C 65 43.150 41.431 1.719 1
1 779 . 15 1 1 A 87 87 ASP N N 65 116.230 121.278 -5.048 1
1 780 . 15 1 1 A 88 88 GLY H H 66 9.330 8.815 0.515 1
1 783 . 15 1 1 A 88 88 GLY C C 66 172.330 174.673 -2.343 1
1 784 . 15 1 1 A 88 88 GLY CA C 66 45.270 60.324 -15.054 1
1 785 . 15 1 1 A 88 88 GLY N N 66 112.300 119.919 -7.619 1
1 786 . 15 1 1 A 89 89 LEU H H 67 7.640 9.093 -1.453 1
1 787 . 15 1 1 A 89 89 LEU HA H 67 4.720 4.820 -0.100 1
1 797 . 15 1 1 A 89 89 LEU C C 67 172.460 176.237 -3.777 1
1 798 . 15 1 1 A 89 89 LEU CA C 67 54.420 54.408 0.012 1
1 799 . 15 1 1 A 89 89 LEU CB C 67 42.260 42.319 -0.059 1
1 803 . 15 1 1 A 89 89 LEU N N 67 120.310 127.423 -7.113 1
1 804 . 15 1 1 A 90 90 THR H H 68 8.110 8.876 -0.766 1
1 805 . 15 1 1 A 90 90 THR HA H 68 5.300 5.375 -0.075 1
1 810 . 15 1 1 A 90 90 THR C C 68 170.900 175.008 -4.108 1
1 811 . 15 1 1 A 90 90 THR CA C 68 61.870 59.806 2.064 1
1 812 . 15 1 1 A 90 90 THR CB C 68 71.320 40.619 30.701 1
1 814 . 15 1 1 A 90 90 THR N N 68 115.300 122.165 -6.865 1
1 815 . 15 1 1 A 91 91 VAL H H 69 9.290 9.143 0.147 1
1 816 . 15 1 1 A 91 91 VAL HA H 69 4.540 4.878 -0.338 1
1 824 . 15 1 1 A 91 91 VAL C C 69 170.890 174.823 -3.933 1
1 825 . 15 1 1 A 91 91 VAL CA C 69 60.310 57.882 2.428 1
1 826 . 15 1 1 A 91 91 VAL CB C 69 34.680 42.768 -8.088 1
1 829 . 15 1 1 A 91 91 VAL N N 69 124.200 126.871 -2.671 1
1 830 . 15 1 1 A 92 92 HIS H H 70 8.750 8.432 0.318 1
1 831 . 15 1 1 A 92 92 HIS HA H 70 5.020 3.778 1.242 1
1 835 . 15 1 1 A 92 92 HIS C C 70 170.890 177.380 -6.490 1
1 836 . 15 1 1 A 92 92 HIS CA C 70 56.750 53.152 3.598 1
1 837 . 15 1 1 A 92 92 HIS CB C 70 32.220 17.902 14.318 1
1 839 . 15 1 1 A 92 92 HIS N N 70 125.250 128.993 -3.743 1
1 840 . 15 1 1 A 93 93 LEU H H 71 8.290 8.606 -0.316 1
1 851 . 15 1 1 A 93 93 LEU C C 71 172.570 173.503 -0.933 1
1 852 . 15 1 1 A 93 93 LEU CA C 71 52.820 45.972 6.848 1
1 857 . 15 1 1 A 93 93 LEU N N 71 123.360 102.828 20.532 1
1 858 . 15 1 1 A 94 94 VAL H H 72 9.110 7.274 1.836 1
1 859 . 15 1 1 A 94 94 VAL HA H 72 4.080 4.878 -0.798 1
1 864 . 15 1 1 A 94 94 VAL C C 72 171.160 175.311 -4.151 1
1 865 . 15 1 1 A 94 94 VAL CA C 72 61.350 54.447 6.903 1
1 866 . 15 1 1 A 94 94 VAL CB C 72 34.640 35.320 -0.680 1
1 868 . 15 1 1 A 94 94 VAL N N 72 128.650 114.861 13.789 1
1 869 . 15 1 1 A 95 95 ILE H H 73 8.150 8.293 -0.143 1
1 870 . 15 1 1 A 95 95 ILE HA H 73 4.500 4.539 -0.039 1
1 880 . 15 1 1 A 95 95 ILE C C 73 174.320 175.669 -1.349 1
1 881 . 15 1 1 A 95 95 ILE CA C 73 60.170 60.794 -0.624 1
1 882 . 15 1 1 A 95 95 ILE CB C 73 38.120 38.326 -0.206 1
1 886 . 15 1 1 A 95 95 ILE N N 73 125.560 119.183 6.377 1
1 887 . 15 1 1 A 96 96 LYS H H 74 9.280 8.917 0.363 1
1 888 . 15 1 1 A 96 96 LYS HA H 74 4.240 4.377 -0.137 1
1 891 . 15 1 1 A 96 96 LYS C C 74 173.510 176.452 -2.942 1
1 892 . 15 1 1 A 96 96 LYS CA C 74 56.730 54.376 2.354 1
1 893 . 15 1 1 A 96 96 LYS CB C 74 33.100 41.308 -8.208 1
1 894 . 15 1 1 A 96 96 LYS N N 74 129.290 128.178 1.112 1
1 895 . 15 1 1 A 97 97 THR H H 75 8.040 8.927 -0.887 1
1 896 . 15 1 1 A 97 97 THR HA H 75 4.230 4.623 -0.393 1
1 901 . 15 1 1 A 97 97 THR C C 75 171.800 177.486 -5.686 1
1 902 . 15 1 1 A 97 97 THR CA C 75 61.760 54.937 6.823 1
1 903 . 15 1 1 A 97 97 THR CB C 75 69.830 34.702 35.128 1
1 905 . 15 1 1 A 97 97 THR N N 75 114.420 123.467 -9.047 1
1 906 . 15 1 1 A 98 98 GLN H H 76 8.400 8.824 -0.424 1
1 907 . 15 1 1 A 98 98 GLN HA H 76 4.210 4.455 -0.245 1
1 914 . 15 1 1 A 98 98 GLN CA C 76 55.880 56.446 -0.566 1
1 915 . 15 1 1 A 98 98 GLN CB C 76 29.700 39.947 -10.247 1
1 917 . 15 1 1 A 98 98 GLN N N 76 122.370 121.075 1.295 1
1 919 . 15 1 1 A 99 99 ASN HA H 77 4.590 4.257 0.333 1
1 924 . 15 1 1 A 99 99 ASN C C 77 171.780 175.801 -4.021 1
1 925 . 15 1 1 A 99 99 ASN CA C 77 53.300 57.042 -3.742 1
1 926 . 15 1 1 A 99 99 ASN CB C 77 38.920 27.984 10.936 1
1 928 . 15 1 1 A 100 100 ARG H H 78 8.160 7.650 0.510 1
1 929 . 15 1 1 A 100 100 ARG HA H 78 4.560 4.911 -0.351 1
1 936 . 15 1 1 A 100 100 ARG CA C 78 53.860 52.708 1.152 1
1 937 . 15 1 1 A 100 100 ARG CB C 78 30.210 42.292 -12.082 1
1 940 . 15 1 1 A 100 100 ARG N N 78 122.840 120.830 2.010 1
1 941 . 15 1 1 A 101 101 PRO HA H 79 4.150 4.673 -0.523 1
1 948 . 15 1 1 A 101 101 PRO CA C 79 64.770 61.525 3.245 1
1 949 . 15 1 1 A 101 101 PRO CB C 79 32.040 71.714 -39.674 1
1 289 . 16 1 1 A 46 46 SER H H 24 8.950 8.441 0.509 1
1 290 . 16 1 1 A 46 46 SER HA H 24 4.900 4.493 0.407 1
1 293 . 16 1 1 A 46 46 SER C C 24 170.890 176.047 -5.157 1
1 294 . 16 1 1 A 46 46 SER CA C 24 56.980 55.960 1.020 1
1 295 . 16 1 1 A 46 46 SER CB C 24 65.590 33.358 32.232 1
1 296 . 16 1 1 A 46 46 SER N N 24 120.420 121.689 -1.269 1
1 297 . 16 1 1 A 47 47 VAL H H 25 9.140 8.302 0.838 1
1 298 . 16 1 1 A 47 47 VAL HA H 25 3.440 4.390 -0.950 1
1 306 . 16 1 1 A 47 47 VAL C C 25 175.060 175.434 -0.374 1
1 307 . 16 1 1 A 47 47 VAL CA C 25 67.250 60.795 6.455 1
1 308 . 16 1 1 A 47 47 VAL CB C 25 30.780 39.787 -9.007 1
1 311 . 16 1 1 A 47 47 VAL N N 25 123.970 125.899 -1.929 1
1 312 . 16 1 1 A 48 48 GLN H H 26 8.540 8.559 -0.019 1
1 313 . 16 1 1 A 48 48 GLN HA H 26 4.070 4.732 -0.662 1
1 320 . 16 1 1 A 48 48 GLN CA C 26 60.230 54.868 5.362 1
1 321 . 16 1 1 A 48 48 GLN CB C 26 28.490 32.609 -4.119 1
1 323 . 16 1 1 A 48 48 GLN N N 26 120.550 127.752 -7.202 1
1 325 . 16 1 1 A 49 49 GLN HA H 27 3.950 4.619 -0.669 1
1 332 . 16 1 1 A 49 49 GLN C C 27 176.230 175.298 0.932 1
1 333 . 16 1 1 A 49 49 GLN CA C 27 58.710 55.554 3.156 1
1 334 . 16 1 1 A 49 49 GLN CB C 27 28.820 31.753 -2.933 1
1 337 . 16 1 1 A 50 50 PHE H H 28 8.050 8.708 -0.658 1
1 338 . 16 1 1 A 50 50 PHE HA H 28 4.620 4.512 0.108 1
1 345 . 16 1 1 A 50 50 PHE C C 28 175.190 175.651 -0.461 1
1 346 . 16 1 1 A 50 50 PHE CA C 28 58.030 62.024 -3.994 1
1 347 . 16 1 1 A 50 50 PHE CB C 28 39.190 31.853 7.337 1
1 350 . 16 1 1 A 50 50 PHE N N 28 121.710 125.041 -3.331 1
1 351 . 16 1 1 A 51 51 LYS H H 29 8.940 8.616 0.324 1
1 352 . 16 1 1 A 51 51 LYS HA H 29 3.340 4.640 -1.300 1
1 361 . 16 1 1 A 51 51 LYS C C 29 175.370 174.233 1.137 1
1 362 . 16 1 1 A 51 51 LYS CA C 29 60.660 62.771 -2.111 1
1 363 . 16 1 1 A 51 51 LYS CB C 29 33.190 69.791 -36.601 1
1 367 . 16 1 1 A 51 51 LYS N N 29 117.530 123.250 -5.720 1
1 368 . 16 1 1 A 52 52 GLU H H 30 7.700 9.239 -1.539 1
1 369 . 16 1 1 A 52 52 GLU HA H 30 3.750 4.707 -0.957 1
1 374 . 16 1 1 A 52 52 GLU C C 30 176.780 174.207 2.573 1
1 375 . 16 1 1 A 52 52 GLU CA C 30 59.890 61.381 -1.491 1
1 376 . 16 1 1 A 52 52 GLU CB C 30 28.840 33.665 -4.825 1
1 378 . 16 1 1 A 52 52 GLU N N 30 118.820 127.874 -9.054 1
1 379 . 16 1 1 A 53 53 GLU H H 31 7.370 9.162 -1.792 1
1 380 . 16 1 1 A 53 53 GLU HA H 31 4.150 5.053 -0.903 1
1 385 . 16 1 1 A 53 53 GLU C C 31 177.040 175.822 1.218 1
1 386 . 16 1 1 A 53 53 GLU CA C 31 58.860 55.156 3.704 1
1 387 . 16 1 1 A 53 53 GLU CB C 31 29.200 34.202 -5.002 1
1 389 . 16 1 1 A 53 53 GLU N N 31 119.150 129.436 -10.286 1
1 390 . 16 1 1 A 54 54 ILE H H 32 8.000 8.802 -0.802 1
1 391 . 16 1 1 A 54 54 ILE HA H 32 3.550 5.179 -1.629 1
1 401 . 16 1 1 A 54 54 ILE C C 32 175.420 173.936 1.484 1
1 402 . 16 1 1 A 54 54 ILE CA C 32 64.690 58.513 6.177 1
1 403 . 16 1 1 A 54 54 ILE CB C 32 37.820 70.526 -32.706 1
1 407 . 16 1 1 A 54 54 ILE N N 32 119.970 115.151 4.819 1
1 409 . 16 1 1 A 55 55 SER HA H 33 3.930 4.562 -0.632 1
1 412 . 16 1 1 A 55 55 SER C C 33 173.830 176.986 -3.156 1
1 413 . 16 1 1 A 55 55 SER CA C 33 61.620 63.226 -1.606 1
1 414 . 16 1 1 A 55 55 SER CB C 33 62.720 30.407 32.313 1
1 415 . 16 1 1 A 55 55 SER N N 33 115.780 135.809 -20.029 1
1 416 . 16 1 1 A 56 56 LYS H H 34 7.150 8.201 -1.051 1
1 417 . 16 1 1 A 56 56 LYS HA H 34 4.090 4.567 -0.477 1
1 424 . 16 1 1 A 56 56 LYS C C 34 176.080 175.609 0.471 1
1 425 . 16 1 1 A 56 56 LYS CA C 34 58.950 56.569 2.381 1
1 426 . 16 1 1 A 56 56 LYS CB C 34 32.540 34.873 -2.333 1
1 429 . 16 1 1 A 56 56 LYS N N 34 119.100 116.556 2.544 1
1 430 . 16 1 1 A 57 57 ARG H H 35 7.530 7.734 -0.204 1
1 431 . 16 1 1 A 57 57 ARG HA H 35 4.110 4.635 -0.525 1
1 436 . 16 1 1 A 57 57 ARG C C 35 174.800 174.174 0.626 1
1 437 . 16 1 1 A 57 57 ARG CA C 35 57.090 55.519 1.571 1
1 438 . 16 1 1 A 57 57 ARG CB C 35 29.810 30.840 -1.030 1
1 440 . 16 1 1 A 57 57 ARG N N 35 119.370 116.480 2.890 1
1 441 . 16 1 1 A 58 58 PHE H H 36 8.320 8.909 -0.589 1
1 442 . 16 1 1 A 58 58 PHE HA H 36 4.340 5.369 -1.029 1
1 449 . 16 1 1 A 58 58 PHE C C 36 171.940 174.253 -2.313 1
1 450 . 16 1 1 A 58 58 PHE CA C 36 58.500 55.032 3.468 1
1 451 . 16 1 1 A 58 58 PHE CB C 36 38.130 36.776 1.354 1
1 454 . 16 1 1 A 58 58 PHE N N 36 113.980 117.420 -3.440 1
1 455 . 16 1 1 A 59 59 LYS H H 37 7.790 8.933 -1.143 1
1 456 . 16 1 1 A 59 59 LYS HA H 37 3.960 4.793 -0.833 1
1 463 . 16 1 1 A 59 59 LYS C C 37 172.670 174.356 -1.686 1
1 464 . 16 1 1 A 59 59 LYS CA C 37 57.140 54.199 2.941 1
1 465 . 16 1 1 A 59 59 LYS CB C 37 29.020 34.047 -5.027 1
1 468 . 16 1 1 A 59 59 LYS N N 37 118.810 120.220 -1.410 1
1 469 . 16 1 1 A 60 60 SER H H 38 7.750 8.203 -0.453 1
1 470 . 16 1 1 A 60 60 SER HA H 38 4.700 5.052 -0.352 1
1 473 . 16 1 1 A 60 60 SER C C 38 170.170 174.077 -3.907 1
1 474 . 16 1 1 A 60 60 SER CA C 38 57.130 55.052 2.078 1
1 475 . 16 1 1 A 60 60 SER CB C 38 66.820 33.516 33.304 1
1 476 . 16 1 1 A 60 60 SER N N 38 112.620 121.055 -8.435 1
1 477 . 16 1 1 A 61 61 HIS H H 39 8.630 9.123 -0.493 1
1 478 . 16 1 1 A 61 61 HIS N N 39 124.090 124.089 0.001 1
1 479 . 16 1 1 A 62 62 THR HA H 40 3.610 4.901 -1.291 1
1 484 . 16 1 1 A 62 62 THR C C 40 174.350 177.214 -2.864 1
1 485 . 16 1 1 A 62 62 THR CA C 40 66.160 50.999 15.161 1
1 486 . 16 1 1 A 62 62 THR CB C 40 68.070 20.406 47.664 1
1 488 . 16 1 1 A 63 63 ASP H H 41 10.310 8.750 1.560 1
1 489 . 16 1 1 A 63 63 ASP HA H 41 4.420 4.997 -0.577 1
1 492 . 16 1 1 A 63 63 ASP C C 41 174.630 174.958 -0.328 1
1 493 . 16 1 1 A 63 63 ASP CA C 41 56.330 58.092 -1.762 1
1 494 . 16 1 1 A 63 63 ASP CB C 41 40.040 34.600 5.440 1
1 495 . 16 1 1 A 63 63 ASP N N 41 122.900 117.505 5.395 1
1 497 . 16 1 1 A 64 64 GLN HA H 42 4.270 4.570 -0.300 1
1 504 . 16 1 1 A 64 64 GLN C C 42 172.160 177.841 -5.681 1
1 505 . 16 1 1 A 64 64 GLN CA C 42 55.860 63.047 -7.187 1
1 506 . 16 1 1 A 64 64 GLN CB C 42 30.480 31.080 -0.600 1
1 508 . 16 1 1 A 64 64 GLN N N 42 115.750 137.820 -22.070 1
1 510 . 16 1 1 A 65 65 LEU H H 43 7.250 8.183 -0.933 1
1 511 . 16 1 1 A 65 65 LEU HA H 43 4.440 3.994 0.446 1
1 517 . 16 1 1 A 65 65 LEU C C 43 173.160 176.131 -2.971 1
1 518 . 16 1 1 A 65 65 LEU CA C 43 54.620 57.542 -2.922 1
1 519 . 16 1 1 A 65 65 LEU CB C 43 41.990 27.503 14.487 1
1 521 . 16 1 1 A 65 65 LEU N N 43 116.570 118.079 -1.509 1
1 522 . 16 1 1 A 66 66 VAL H H 44 8.690 7.957 0.733 1
1 523 . 16 1 1 A 66 66 VAL HA H 44 3.980 4.961 -0.981 1
1 528 . 16 1 1 A 66 66 VAL C C 44 171.340 175.520 -4.180 1
1 529 . 16 1 1 A 66 66 VAL CA C 44 61.910 53.301 8.609 1
1 530 . 16 1 1 A 66 66 VAL CB C 44 33.630 40.251 -6.621 1
1 532 . 16 1 1 A 66 66 VAL N N 44 125.260 118.229 7.031 1
1 533 . 16 1 1 A 67 67 LEU H H 45 8.570 7.737 0.833 1
1 534 . 16 1 1 A 67 67 LEU HA H 45 5.220 4.372 0.848 1
1 544 . 16 1 1 A 67 67 LEU C C 45 172.500 173.990 -1.490 1
1 545 . 16 1 1 A 67 67 LEU CA C 45 52.820 59.754 -6.934 1
1 546 . 16 1 1 A 67 67 LEU CB C 45 45.310 63.163 -17.853 1
1 550 . 16 1 1 A 67 67 LEU N N 45 126.690 116.698 9.992 1
1 551 . 16 1 1 A 68 68 ILE H H 46 9.040 8.370 0.670 1
1 552 . 16 1 1 A 68 68 ILE HA H 46 4.880 4.722 0.158 1
1 562 . 16 1 1 A 68 68 ILE C C 46 172.390 176.186 -3.796 1
1 563 . 16 1 1 A 68 68 ILE CA C 46 59.900 57.549 2.351 1
1 564 . 16 1 1 A 68 68 ILE CB C 46 41.940 65.288 -23.348 1
1 568 . 16 1 1 A 68 68 ILE N N 46 122.590 120.892 1.698 1
1 569 . 16 1 1 A 69 69 PHE H H 47 8.740 8.772 -0.032 1
1 570 . 16 1 1 A 69 69 PHE N N 47 125.360 121.772 3.588 1
1 571 . 16 1 1 A 70 70 ALA HA H 48 3.600 4.002 -0.402 1
1 575 . 16 1 1 A 70 70 ALA C C 48 174.500 177.635 -3.135 1
1 576 . 16 1 1 A 70 70 ALA CA C 48 52.520 58.853 -6.333 1
1 577 . 16 1 1 A 70 70 ALA CB C 48 16.760 28.466 -11.706 1
1 578 . 16 1 1 A 71 71 GLY H H 49 8.210 7.779 0.431 1
1 581 . 16 1 1 A 71 71 GLY C C 49 170.850 177.509 -6.659 1
1 582 . 16 1 1 A 71 71 GLY CA C 49 45.380 56.526 -11.146 1
1 583 . 16 1 1 A 71 71 GLY N N 49 102.430 117.662 -15.232 1
1 584 . 16 1 1 A 72 72 LYS H H 50 7.840 8.193 -0.353 1
1 585 . 16 1 1 A 72 72 LYS HA H 50 4.530 4.097 0.433 1
1 594 . 16 1 1 A 72 72 LYS C C 50 171.800 177.698 -5.898 1
1 595 . 16 1 1 A 72 72 LYS CA C 50 54.630 61.066 -6.436 1
1 596 . 16 1 1 A 72 72 LYS CB C 50 34.630 39.138 -4.508 1
1 600 . 16 1 1 A 72 72 LYS N N 50 121.570 122.743 -1.173 1
1 601 . 16 1 1 A 73 73 ILE H H 51 8.250 8.181 0.069 1
1 602 . 16 1 1 A 73 73 ILE HA H 51 4.260 3.844 0.416 1
1 612 . 16 1 1 A 73 73 ILE C C 51 174.300 178.478 -4.178 1
1 613 . 16 1 1 A 73 73 ILE CA C 51 61.270 58.312 2.958 1
1 614 . 16 1 1 A 73 73 ILE CB C 51 38.150 31.182 6.968 1
1 618 . 16 1 1 A 73 73 ILE N N 51 122.710 118.114 4.596 1
1 619 . 16 1 1 A 74 74 LEU H H 52 8.540 8.300 0.240 1
1 620 . 16 1 1 A 74 74 LEU HA H 52 3.980 3.955 0.025 1
1 630 . 16 1 1 A 74 74 LEU C C 52 173.440 179.177 -5.737 1
1 631 . 16 1 1 A 74 74 LEU CA C 52 54.660 59.426 -4.766 1
1 632 . 16 1 1 A 74 74 LEU CB C 52 41.790 29.264 12.526 1
1 636 . 16 1 1 A 74 74 LEU N N 52 128.360 118.843 9.517 1
1 637 . 16 1 1 A 75 75 LYS H H 53 8.100 7.974 0.126 1
1 638 . 16 1 1 A 75 75 LYS HA H 53 4.440 3.934 0.506 1
1 645 . 16 1 1 A 75 75 LYS C C 53 175.170 179.382 -4.212 1
1 646 . 16 1 1 A 75 75 LYS CA C 53 55.340 58.886 -3.546 1
1 647 . 16 1 1 A 75 75 LYS CB C 53 32.680 29.032 3.648 1
1 650 . 16 1 1 A 75 75 LYS N N 53 123.470 119.744 3.726 1
1 651 . 16 1 1 A 76 76 ASP H H 54 8.310 6.986 1.324 1
1 652 . 16 1 1 A 76 76 ASP HA H 54 4.110 3.646 0.464 1
1 655 . 16 1 1 A 76 76 ASP C C 54 174.270 177.816 -3.546 1
1 656 . 16 1 1 A 76 76 ASP CA C 54 58.140 64.792 -6.652 1
1 657 . 16 1 1 A 76 76 ASP CB C 54 40.760 37.456 3.304 1
1 658 . 16 1 1 A 76 76 ASP N N 54 121.080 120.977 0.103 1
1 659 . 16 1 1 A 77 77 GLN H H 55 8.180 7.964 0.216 1
1 660 . 16 1 1 A 77 77 GLN HA H 55 4.360 4.157 0.203 1
1 667 . 16 1 1 A 77 77 GLN C C 55 173.710 176.452 -2.742 1
1 668 . 16 1 1 A 77 77 GLN CA C 55 56.350 61.344 -4.994 1
1 669 . 16 1 1 A 77 77 GLN CB C 55 28.090 62.652 -34.562 1
1 671 . 16 1 1 A 77 77 GLN N N 55 113.190 115.377 -2.187 1
1 673 . 16 1 1 A 78 78 ASP H H 56 7.770 7.603 0.167 1
1 674 . 16 1 1 A 78 78 ASP HA H 56 4.700 4.030 0.670 1
1 677 . 16 1 1 A 78 78 ASP C C 56 173.500 178.899 -5.399 1
1 678 . 16 1 1 A 78 78 ASP CA C 56 54.140 59.319 -5.179 1
1 679 . 16 1 1 A 78 78 ASP CB C 56 42.020 32.090 9.930 1
1 680 . 16 1 1 A 78 78 ASP N N 56 121.910 119.438 2.472 1
1 681 . 16 1 1 A 79 79 THR H H 57 8.490 7.969 0.521 1
1 682 . 16 1 1 A 79 79 THR HA H 57 4.700 4.013 0.687 1
1 687 . 16 1 1 A 79 79 THR C C 57 172.840 178.052 -5.212 1
1 688 . 16 1 1 A 79 79 THR CA C 57 59.980 59.208 0.772 1
1 689 . 16 1 1 A 79 79 THR CB C 57 70.640 30.266 40.374 1
1 691 . 16 1 1 A 79 79 THR N N 57 108.860 119.990 -11.130 1
1 692 . 16 1 1 A 80 80 LEU H H 58 7.700 8.021 -0.321 1
1 693 . 16 1 1 A 80 80 LEU HA H 58 3.880 4.597 -0.717 1
1 703 . 16 1 1 A 80 80 LEU C C 58 177.370 174.716 2.654 1
1 704 . 16 1 1 A 80 80 LEU CA C 58 58.450 57.370 1.080 1
1 705 . 16 1 1 A 80 80 LEU CB C 58 39.500 39.448 0.052 1
1 709 . 16 1 1 A 80 80 LEU N N 58 118.820 115.191 3.629 1
1 710 . 16 1 1 A 81 81 SER H H 59 8.810 7.569 1.241 1
1 711 . 16 1 1 A 81 81 SER HA H 59 4.050 3.780 0.270 1
1 714 . 16 1 1 A 81 81 SER C C 59 176.150 174.554 1.596 1
1 715 . 16 1 1 A 81 81 SER CA C 59 61.190 57.386 3.804 1
1 716 . 16 1 1 A 81 81 SER CB C 59 62.490 29.307 33.183 1
1 717 . 16 1 1 A 81 81 SER N N 59 114.240 116.350 -2.110 1
1 718 . 16 1 1 A 82 82 GLN H H 60 7.950 7.768 0.182 1
1 719 . 16 1 1 A 82 82 GLN HA H 60 4.090 4.985 -0.895 1
1 726 . 16 1 1 A 82 82 GLN C C 60 173.930 173.183 0.747 1
1 727 . 16 1 1 A 82 82 GLN CA C 60 58.080 57.278 0.802 1
1 728 . 16 1 1 A 82 82 GLN CB C 60 28.460 65.879 -37.419 1
1 730 . 16 1 1 A 82 82 GLN N N 60 122.620 113.648 8.972 1
1 732 . 16 1 1 A 83 83 HIS H H 61 6.990 8.747 -1.757 1
1 733 . 16 1 1 A 83 83 HIS HA H 61 4.490 4.651 -0.161 1
1 736 . 16 1 1 A 83 83 HIS C C 61 172.260 177.156 -4.896 1
1 737 . 16 1 1 A 83 83 HIS CA C 61 57.110 56.557 0.553 1
1 738 . 16 1 1 A 83 83 HIS CB C 61 32.780 30.272 2.508 1
1 739 . 16 1 1 A 83 83 HIS N N 61 116.940 122.081 -5.141 1
1 740 . 16 1 1 A 84 84 GLY H H 62 7.870 9.126 -1.256 1
1 743 . 16 1 1 A 84 84 GLY C C 62 171.040 176.336 -5.296 1
1 744 . 16 1 1 A 84 84 GLY CA C 62 45.390 66.173 -20.783 1
1 745 . 16 1 1 A 84 84 GLY N N 62 106.740 117.412 -10.672 1
1 746 . 16 1 1 A 85 85 ILE H H 63 6.810 8.411 -1.601 1
1 747 . 16 1 1 A 85 85 ILE HA H 63 3.050 4.436 -1.386 1
1 757 . 16 1 1 A 85 85 ILE C C 63 170.130 178.507 -8.377 1
1 758 . 16 1 1 A 85 85 ILE CA C 63 62.440 57.635 4.805 1
1 759 . 16 1 1 A 85 85 ILE CB C 63 36.110 42.361 -6.251 1
1 763 . 16 1 1 A 85 85 ILE N N 63 118.920 122.391 -3.471 1
1 764 . 16 1 1 A 86 86 HIS H H 64 6.020 7.661 -1.641 1
1 765 . 16 1 1 A 86 86 HIS HA H 64 5.030 4.278 0.752 1
1 768 . 16 1 1 A 86 86 HIS C C 64 170.090 175.953 -5.863 1
1 769 . 16 1 1 A 86 86 HIS CA C 64 53.500 57.650 -4.150 1
1 770 . 16 1 1 A 86 86 HIS CB C 64 31.860 29.299 2.561 1
1 771 . 16 1 1 A 86 86 HIS N N 64 122.440 116.304 6.136 1
1 772 . 16 1 1 A 87 87 ASP H H 65 8.340 7.539 0.801 1
1 773 . 16 1 1 A 87 87 ASP HA H 65 4.320 4.898 -0.578 1
1 776 . 16 1 1 A 87 87 ASP C C 65 174.370 176.130 -1.760 1
1 777 . 16 1 1 A 87 87 ASP CA C 65 56.440 53.146 3.294 1
1 778 . 16 1 1 A 87 87 ASP CB C 65 43.150 43.776 -0.626 1
1 779 . 16 1 1 A 87 87 ASP N N 65 116.230 117.358 -1.128 1
1 780 . 16 1 1 A 88 88 GLY H H 66 9.330 8.724 0.606 1
1 783 . 16 1 1 A 88 88 GLY C C 66 172.330 174.171 -1.841 1
1 784 . 16 1 1 A 88 88 GLY CA C 66 45.270 59.445 -14.175 1
1 785 . 16 1 1 A 88 88 GLY N N 66 112.300 118.257 -5.957 1
1 786 . 16 1 1 A 89 89 LEU H H 67 7.640 8.734 -1.094 1
1 787 . 16 1 1 A 89 89 LEU HA H 67 4.720 4.771 -0.051 1
1 797 . 16 1 1 A 89 89 LEU C C 67 172.460 175.932 -3.472 1
1 798 . 16 1 1 A 89 89 LEU CA C 67 54.420 53.953 0.467 1
1 799 . 16 1 1 A 89 89 LEU CB C 67 42.260 42.907 -0.647 1
1 803 . 16 1 1 A 89 89 LEU N N 67 120.310 126.253 -5.943 1
1 804 . 16 1 1 A 90 90 THR H H 68 8.110 8.716 -0.606 1
1 805 . 16 1 1 A 90 90 THR HA H 68 5.300 5.345 -0.045 1
1 810 . 16 1 1 A 90 90 THR C C 68 170.900 174.824 -3.924 1
1 811 . 16 1 1 A 90 90 THR CA C 68 61.870 60.305 1.565 1
1 812 . 16 1 1 A 90 90 THR CB C 68 71.320 41.420 29.900 1
1 814 . 16 1 1 A 90 90 THR N N 68 115.300 122.516 -7.216 1
1 815 . 16 1 1 A 91 91 VAL H H 69 9.290 9.164 0.126 1
1 816 . 16 1 1 A 91 91 VAL HA H 69 4.540 4.872 -0.332 1
1 824 . 16 1 1 A 91 91 VAL C C 69 170.890 174.757 -3.867 1
1 825 . 16 1 1 A 91 91 VAL CA C 69 60.310 57.647 2.663 1
1 826 . 16 1 1 A 91 91 VAL CB C 69 34.680 42.792 -8.112 1
1 829 . 16 1 1 A 91 91 VAL N N 69 124.200 126.628 -2.428 1
1 830 . 16 1 1 A 92 92 HIS H H 70 8.750 8.543 0.207 1
1 831 . 16 1 1 A 92 92 HIS HA H 70 5.020 3.743 1.277 1
1 835 . 16 1 1 A 92 92 HIS C C 70 170.890 176.980 -6.090 1
1 836 . 16 1 1 A 92 92 HIS CA C 70 56.750 53.095 3.655 1
1 837 . 16 1 1 A 92 92 HIS CB C 70 32.220 17.713 14.507 1
1 839 . 16 1 1 A 92 92 HIS N N 70 125.250 129.403 -4.153 1
1 840 . 16 1 1 A 93 93 LEU H H 71 8.290 8.351 -0.061 1
1 851 . 16 1 1 A 93 93 LEU C C 71 172.570 173.563 -0.993 1
1 852 . 16 1 1 A 93 93 LEU CA C 71 52.820 45.303 7.517 1
1 857 . 16 1 1 A 93 93 LEU N N 71 123.360 102.925 20.435 1
1 858 . 16 1 1 A 94 94 VAL H H 72 9.110 7.399 1.711 1
1 859 . 16 1 1 A 94 94 VAL HA H 72 4.080 4.914 -0.834 1
1 864 . 16 1 1 A 94 94 VAL C C 72 171.160 175.414 -4.254 1
1 865 . 16 1 1 A 94 94 VAL CA C 72 61.350 54.226 7.124 1
1 866 . 16 1 1 A 94 94 VAL CB C 72 34.640 35.960 -1.320 1
1 868 . 16 1 1 A 94 94 VAL N N 72 128.650 115.241 13.409 1
1 869 . 16 1 1 A 95 95 ILE H H 73 8.150 8.238 -0.088 1
1 870 . 16 1 1 A 95 95 ILE HA H 73 4.500 4.714 -0.214 1
1 880 . 16 1 1 A 95 95 ILE C C 73 174.320 175.771 -1.451 1
1 881 . 16 1 1 A 95 95 ILE CA C 73 60.170 60.657 -0.487 1
1 882 . 16 1 1 A 95 95 ILE CB C 73 38.120 38.819 -0.699 1
1 886 . 16 1 1 A 95 95 ILE N N 73 125.560 119.421 6.139 1
1 887 . 16 1 1 A 96 96 LYS H H 74 9.280 8.621 0.659 1
1 888 . 16 1 1 A 96 96 LYS HA H 74 4.240 4.905 -0.665 1
1 891 . 16 1 1 A 96 96 LYS C C 74 173.510 176.488 -2.978 1
1 892 . 16 1 1 A 96 96 LYS CA C 74 56.730 53.781 2.949 1
1 893 . 16 1 1 A 96 96 LYS CB C 74 33.100 43.171 -10.071 1
1 894 . 16 1 1 A 96 96 LYS N N 74 129.290 127.010 2.280 1
1 895 . 16 1 1 A 97 97 THR H H 75 8.040 8.601 -0.561 1
1 896 . 16 1 1 A 97 97 THR HA H 75 4.230 4.702 -0.472 1
1 901 . 16 1 1 A 97 97 THR C C 75 171.800 176.836 -5.036 1
1 902 . 16 1 1 A 97 97 THR CA C 75 61.760 54.281 7.479 1
1 903 . 16 1 1 A 97 97 THR CB C 75 69.830 34.915 34.915 1
1 905 . 16 1 1 A 97 97 THR N N 75 114.420 123.395 -8.975 1
1 906 . 16 1 1 A 98 98 GLN H H 76 8.400 8.973 -0.573 1
1 907 . 16 1 1 A 98 98 GLN HA H 76 4.210 4.192 0.018 1
1 914 . 16 1 1 A 98 98 GLN CA C 76 55.880 58.277 -2.397 1
1 915 . 16 1 1 A 98 98 GLN CB C 76 29.700 41.057 -11.357 1
1 917 . 16 1 1 A 98 98 GLN N N 76 122.370 123.439 -1.069 1
1 919 . 16 1 1 A 99 99 ASN HA H 77 4.590 4.121 0.469 1
1 924 . 16 1 1 A 99 99 ASN C C 77 171.780 175.936 -4.156 1
1 925 . 16 1 1 A 99 99 ASN CA C 77 53.300 57.827 -4.527 1
1 926 . 16 1 1 A 99 99 ASN CB C 77 38.920 27.889 11.031 1
1 928 . 16 1 1 A 100 100 ARG H H 78 8.160 8.046 0.114 1
1 929 . 16 1 1 A 100 100 ARG HA H 78 4.560 4.882 -0.322 1
1 936 . 16 1 1 A 100 100 ARG CA C 78 53.860 52.766 1.094 1
1 937 . 16 1 1 A 100 100 ARG CB C 78 30.210 41.397 -11.187 1
1 940 . 16 1 1 A 100 100 ARG N N 78 122.840 116.762 6.078 1
1 941 . 16 1 1 A 101 101 PRO HA H 79 4.150 4.436 -0.286 1
1 948 . 16 1 1 A 101 101 PRO CA C 79 64.770 61.596 3.174 1
1 949 . 16 1 1 A 101 101 PRO CB C 79 32.040 70.039 -37.999 1
1 289 . 17 1 1 A 46 46 SER H H 24 8.950 8.375 0.575 1
1 290 . 17 1 1 A 46 46 SER HA H 24 4.900 4.598 0.302 1
1 293 . 17 1 1 A 46 46 SER C C 24 170.890 176.499 -5.609 1
1 294 . 17 1 1 A 46 46 SER CA C 24 56.980 55.553 1.427 1
1 295 . 17 1 1 A 46 46 SER CB C 24 65.590 33.877 31.713 1
1 296 . 17 1 1 A 46 46 SER N N 24 120.420 120.810 -0.390 1
1 297 . 17 1 1 A 47 47 VAL H H 25 9.140 8.238 0.902 1
1 298 . 17 1 1 A 47 47 VAL HA H 25 3.440 4.350 -0.910 1
1 306 . 17 1 1 A 47 47 VAL C C 25 175.060 176.090 -1.030 1
1 307 . 17 1 1 A 47 47 VAL CA C 25 67.250 61.083 6.167 1
1 308 . 17 1 1 A 47 47 VAL CB C 25 30.780 39.700 -8.920 1
1 311 . 17 1 1 A 47 47 VAL N N 25 123.970 126.145 -2.175 1
1 312 . 17 1 1 A 48 48 GLN H H 26 8.540 8.751 -0.211 1
1 313 . 17 1 1 A 48 48 GLN HA H 26 4.070 4.820 -0.750 1
1 320 . 17 1 1 A 48 48 GLN CA C 26 60.230 53.681 6.549 1
1 321 . 17 1 1 A 48 48 GLN CB C 26 28.490 32.460 -3.970 1
1 323 . 17 1 1 A 48 48 GLN N N 26 120.550 126.152 -5.602 1
1 325 . 17 1 1 A 49 49 GLN HA H 27 3.950 4.975 -1.025 1
1 332 . 17 1 1 A 49 49 GLN C C 27 176.230 175.412 0.818 1
1 333 . 17 1 1 A 49 49 GLN CA C 27 58.710 55.588 3.122 1
1 334 . 17 1 1 A 49 49 GLN CB C 27 28.820 31.707 -2.887 1
1 337 . 17 1 1 A 50 50 PHE H H 28 8.050 8.669 -0.619 1
1 338 . 17 1 1 A 50 50 PHE HA H 28 4.620 4.550 0.070 1
1 345 . 17 1 1 A 50 50 PHE C C 28 175.190 175.429 -0.239 1
1 346 . 17 1 1 A 50 50 PHE CA C 28 58.030 61.762 -3.732 1
1 347 . 17 1 1 A 50 50 PHE CB C 28 39.190 32.241 6.949 1
1 350 . 17 1 1 A 50 50 PHE N N 28 121.710 125.192 -3.482 1
1 351 . 17 1 1 A 51 51 LYS H H 29 8.940 8.840 0.100 1
1 352 . 17 1 1 A 51 51 LYS HA H 29 3.340 5.083 -1.743 1
1 361 . 17 1 1 A 51 51 LYS C C 29 175.370 174.175 1.195 1
1 362 . 17 1 1 A 51 51 LYS CA C 29 60.660 62.466 -1.806 1
1 363 . 17 1 1 A 51 51 LYS CB C 29 33.190 69.254 -36.064 1
1 367 . 17 1 1 A 51 51 LYS N N 29 117.530 122.852 -5.322 1
1 368 . 17 1 1 A 52 52 GLU H H 30 7.700 9.442 -1.742 1
1 369 . 17 1 1 A 52 52 GLU HA H 30 3.750 4.699 -0.949 1
1 374 . 17 1 1 A 52 52 GLU C C 30 176.780 174.419 2.361 1
1 375 . 17 1 1 A 52 52 GLU CA C 30 59.890 61.635 -1.745 1
1 376 . 17 1 1 A 52 52 GLU CB C 30 28.840 32.926 -4.086 1
1 378 . 17 1 1 A 52 52 GLU N N 30 118.820 128.378 -9.558 1
1 379 . 17 1 1 A 53 53 GLU H H 31 7.370 8.996 -1.626 1
1 380 . 17 1 1 A 53 53 GLU HA H 31 4.150 5.056 -0.906 1
1 385 . 17 1 1 A 53 53 GLU C C 31 177.040 175.953 1.087 1
1 386 . 17 1 1 A 53 53 GLU CA C 31 58.860 54.959 3.901 1
1 387 . 17 1 1 A 53 53 GLU CB C 31 29.200 34.307 -5.107 1
1 389 . 17 1 1 A 53 53 GLU N N 31 119.150 129.289 -10.139 1
1 390 . 17 1 1 A 54 54 ILE H H 32 8.000 8.759 -0.759 1
1 391 . 17 1 1 A 54 54 ILE HA H 32 3.550 5.205 -1.655 1
1 401 . 17 1 1 A 54 54 ILE C C 32 175.420 173.889 1.531 1
1 402 . 17 1 1 A 54 54 ILE CA C 32 64.690 58.750 5.940 1
1 403 . 17 1 1 A 54 54 ILE CB C 32 37.820 70.263 -32.443 1
1 407 . 17 1 1 A 54 54 ILE N N 32 119.970 117.157 2.813 1
1 409 . 17 1 1 A 55 55 SER HA H 33 3.930 4.559 -0.629 1
1 412 . 17 1 1 A 55 55 SER C C 33 173.830 177.035 -3.205 1
1 413 . 17 1 1 A 55 55 SER CA C 33 61.620 63.620 -2.000 1
1 414 . 17 1 1 A 55 55 SER CB C 33 62.720 31.108 31.612 1
1 415 . 17 1 1 A 55 55 SER N N 33 115.780 135.736 -19.956 1
1 416 . 17 1 1 A 56 56 LYS H H 34 7.150 8.179 -1.029 1
1 417 . 17 1 1 A 56 56 LYS HA H 34 4.090 4.570 -0.480 1
1 424 . 17 1 1 A 56 56 LYS C C 34 176.080 175.614 0.466 1
1 425 . 17 1 1 A 56 56 LYS CA C 34 58.950 56.555 2.395 1
1 426 . 17 1 1 A 56 56 LYS CB C 34 32.540 34.912 -2.372 1
1 429 . 17 1 1 A 56 56 LYS N N 34 119.100 116.288 2.812 1
1 430 . 17 1 1 A 57 57 ARG H H 35 7.530 7.781 -0.251 1
1 431 . 17 1 1 A 57 57 ARG HA H 35 4.110 4.636 -0.526 1
1 436 . 17 1 1 A 57 57 ARG C C 35 174.800 174.060 0.740 1
1 437 . 17 1 1 A 57 57 ARG CA C 35 57.090 55.589 1.501 1
1 438 . 17 1 1 A 57 57 ARG CB C 35 29.810 30.501 -0.691 1
1 440 . 17 1 1 A 57 57 ARG N N 35 119.370 116.515 2.855 1
1 441 . 17 1 1 A 58 58 PHE H H 36 8.320 8.893 -0.573 1
1 442 . 17 1 1 A 58 58 PHE HA H 36 4.340 5.566 -1.226 1
1 449 . 17 1 1 A 58 58 PHE C C 36 171.940 174.469 -2.529 1
1 450 . 17 1 1 A 58 58 PHE CA C 36 58.500 54.727 3.773 1
1 451 . 17 1 1 A 58 58 PHE CB C 36 38.130 37.363 0.767 1
1 454 . 17 1 1 A 58 58 PHE N N 36 113.980 116.605 -2.625 1
1 455 . 17 1 1 A 59 59 LYS H H 37 7.790 8.716 -0.926 1
1 456 . 17 1 1 A 59 59 LYS HA H 37 3.960 4.723 -0.763 1
1 463 . 17 1 1 A 59 59 LYS C C 37 172.670 174.054 -1.384 1
1 464 . 17 1 1 A 59 59 LYS CA C 37 57.140 55.292 1.848 1
1 465 . 17 1 1 A 59 59 LYS CB C 37 29.020 33.996 -4.976 1
1 468 . 17 1 1 A 59 59 LYS N N 37 118.810 119.308 -0.498 1
1 469 . 17 1 1 A 60 60 SER H H 38 7.750 8.598 -0.848 1
1 470 . 17 1 1 A 60 60 SER HA H 38 4.700 5.448 -0.748 1
1 473 . 17 1 1 A 60 60 SER C C 38 170.170 175.378 -5.208 1
1 474 . 17 1 1 A 60 60 SER CA C 38 57.130 54.872 2.258 1
1 475 . 17 1 1 A 60 60 SER CB C 38 66.820 32.960 33.860 1
1 476 . 17 1 1 A 60 60 SER N N 38 112.620 125.043 -12.423 1
1 477 . 17 1 1 A 61 61 HIS H H 39 8.630 9.368 -0.738 1
1 478 . 17 1 1 A 61 61 HIS N N 39 124.090 126.047 -1.957 1
1 479 . 17 1 1 A 62 62 THR HA H 40 3.610 5.286 -1.676 1
1 484 . 17 1 1 A 62 62 THR C C 40 174.350 175.892 -1.542 1
1 485 . 17 1 1 A 62 62 THR CA C 40 66.160 50.950 15.210 1
1 486 . 17 1 1 A 62 62 THR CB C 40 68.070 20.733 47.337 1
1 488 . 17 1 1 A 63 63 ASP H H 41 10.310 8.782 1.528 1
1 489 . 17 1 1 A 63 63 ASP HA H 41 4.420 4.971 -0.551 1
1 492 . 17 1 1 A 63 63 ASP C C 41 174.630 174.989 -0.359 1
1 493 . 17 1 1 A 63 63 ASP CA C 41 56.330 58.092 -1.762 1
1 494 . 17 1 1 A 63 63 ASP CB C 41 40.040 34.636 5.404 1
1 495 . 17 1 1 A 63 63 ASP N N 41 122.900 117.877 5.023 1
1 497 . 17 1 1 A 64 64 GLN HA H 42 4.270 4.547 -0.277 1
1 504 . 17 1 1 A 64 64 GLN C C 42 172.160 177.774 -5.614 1
1 505 . 17 1 1 A 64 64 GLN CA C 42 55.860 63.312 -7.452 1
1 506 . 17 1 1 A 64 64 GLN CB C 42 30.480 31.432 -0.952 1
1 508 . 17 1 1 A 64 64 GLN N N 42 115.750 138.086 -22.336 1
1 510 . 17 1 1 A 65 65 LEU H H 43 7.250 8.166 -0.916 1
1 511 . 17 1 1 A 65 65 LEU HA H 43 4.440 4.041 0.399 1
1 517 . 17 1 1 A 65 65 LEU C C 43 173.160 176.405 -3.245 1
1 518 . 17 1 1 A 65 65 LEU CA C 43 54.620 57.579 -2.959 1
1 519 . 17 1 1 A 65 65 LEU CB C 43 41.990 27.502 14.488 1
1 521 . 17 1 1 A 65 65 LEU N N 43 116.570 117.843 -1.273 1
1 522 . 17 1 1 A 66 66 VAL H H 44 8.690 7.934 0.756 1
1 523 . 17 1 1 A 66 66 VAL HA H 44 3.980 4.932 -0.952 1
1 528 . 17 1 1 A 66 66 VAL C C 44 171.340 175.863 -4.523 1
1 529 . 17 1 1 A 66 66 VAL CA C 44 61.910 54.343 7.567 1
1 530 . 17 1 1 A 66 66 VAL CB C 44 33.630 39.833 -6.203 1
1 532 . 17 1 1 A 66 66 VAL N N 44 125.260 118.810 6.450 1
1 533 . 17 1 1 A 67 67 LEU H H 45 8.570 7.869 0.701 1
1 534 . 17 1 1 A 67 67 LEU HA H 45 5.220 4.322 0.898 1
1 544 . 17 1 1 A 67 67 LEU C C 45 172.500 174.551 -2.051 1
1 545 . 17 1 1 A 67 67 LEU CA C 45 52.820 60.346 -7.526 1
1 546 . 17 1 1 A 67 67 LEU CB C 45 45.310 63.603 -18.293 1
1 550 . 17 1 1 A 67 67 LEU N N 45 126.690 116.406 10.284 1
1 551 . 17 1 1 A 68 68 ILE H H 46 9.040 8.925 0.115 1
1 552 . 17 1 1 A 68 68 ILE HA H 46 4.880 4.479 0.401 1
1 562 . 17 1 1 A 68 68 ILE C C 46 172.390 175.650 -3.260 1
1 563 . 17 1 1 A 68 68 ILE CA C 46 59.900 58.638 1.262 1
1 564 . 17 1 1 A 68 68 ILE CB C 46 41.940 64.320 -22.380 1
1 568 . 17 1 1 A 68 68 ILE N N 46 122.590 121.595 0.995 1
1 569 . 17 1 1 A 69 69 PHE H H 47 8.740 8.535 0.205 1
1 570 . 17 1 1 A 69 69 PHE N N 47 125.360 123.501 1.859 1
1 571 . 17 1 1 A 70 70 ALA HA H 48 3.600 4.000 -0.400 1
1 575 . 17 1 1 A 70 70 ALA C C 48 174.500 177.272 -2.772 1
1 576 . 17 1 1 A 70 70 ALA CA C 48 52.520 58.129 -5.609 1
1 577 . 17 1 1 A 70 70 ALA CB C 48 16.760 28.171 -11.411 1
1 578 . 17 1 1 A 71 71 GLY H H 49 8.210 7.694 0.516 1
1 581 . 17 1 1 A 71 71 GLY C C 49 170.850 177.383 -6.533 1
1 582 . 17 1 1 A 71 71 GLY CA C 49 45.380 55.723 -10.343 1
1 583 . 17 1 1 A 71 71 GLY N N 49 102.430 117.950 -15.520 1
1 584 . 17 1 1 A 72 72 LYS H H 50 7.840 8.009 -0.169 1
1 585 . 17 1 1 A 72 72 LYS HA H 50 4.530 4.046 0.484 1
1 594 . 17 1 1 A 72 72 LYS C C 50 171.800 177.631 -5.831 1
1 595 . 17 1 1 A 72 72 LYS CA C 50 54.630 61.214 -6.584 1
1 596 . 17 1 1 A 72 72 LYS CB C 50 34.630 38.990 -4.360 1
1 600 . 17 1 1 A 72 72 LYS N N 50 121.570 122.481 -0.911 1
1 601 . 17 1 1 A 73 73 ILE H H 51 8.250 8.142 0.108 1
1 602 . 17 1 1 A 73 73 ILE HA H 51 4.260 3.853 0.407 1
1 612 . 17 1 1 A 73 73 ILE C C 51 174.300 178.324 -4.024 1
1 613 . 17 1 1 A 73 73 ILE CA C 51 61.270 58.332 2.938 1
1 614 . 17 1 1 A 73 73 ILE CB C 51 38.150 31.212 6.938 1
1 618 . 17 1 1 A 73 73 ILE N N 51 122.710 117.932 4.778 1
1 619 . 17 1 1 A 74 74 LEU H H 52 8.540 8.320 0.220 1
1 620 . 17 1 1 A 74 74 LEU HA H 52 3.980 4.001 -0.021 1
1 630 . 17 1 1 A 74 74 LEU C C 52 173.440 179.239 -5.799 1
1 631 . 17 1 1 A 74 74 LEU CA C 52 54.660 59.371 -4.711 1
1 632 . 17 1 1 A 74 74 LEU CB C 52 41.790 29.182 12.608 1
1 636 . 17 1 1 A 74 74 LEU N N 52 128.360 119.099 9.261 1
1 637 . 17 1 1 A 75 75 LYS H H 53 8.100 8.025 0.075 1
1 638 . 17 1 1 A 75 75 LYS HA H 53 4.440 4.051 0.389 1
1 645 . 17 1 1 A 75 75 LYS C C 53 175.170 179.591 -4.421 1
1 646 . 17 1 1 A 75 75 LYS CA C 53 55.340 59.007 -3.667 1
1 647 . 17 1 1 A 75 75 LYS CB C 53 32.680 29.361 3.319 1
1 650 . 17 1 1 A 75 75 LYS N N 53 123.470 119.603 3.867 1
1 651 . 17 1 1 A 76 76 ASP H H 54 8.310 7.260 1.050 1
1 652 . 17 1 1 A 76 76 ASP HA H 54 4.110 3.968 0.142 1
1 655 . 17 1 1 A 76 76 ASP C C 54 174.270 178.104 -3.834 1
1 656 . 17 1 1 A 76 76 ASP CA C 54 58.140 65.160 -7.020 1
1 657 . 17 1 1 A 76 76 ASP CB C 54 40.760 37.404 3.356 1
1 658 . 17 1 1 A 76 76 ASP N N 54 121.080 121.281 -0.201 1
1 659 . 17 1 1 A 77 77 GLN H H 55 8.180 7.854 0.326 1
1 660 . 17 1 1 A 77 77 GLN HA H 55 4.360 4.507 -0.147 1
1 667 . 17 1 1 A 77 77 GLN C C 55 173.710 176.575 -2.865 1
1 668 . 17 1 1 A 77 77 GLN CA C 55 56.350 61.671 -5.321 1
1 669 . 17 1 1 A 77 77 GLN CB C 55 28.090 63.049 -34.959 1
1 671 . 17 1 1 A 77 77 GLN N N 55 113.190 116.405 -3.215 1
1 673 . 17 1 1 A 78 78 ASP H H 56 7.770 7.649 0.121 1
1 674 . 17 1 1 A 78 78 ASP HA H 56 4.700 4.112 0.588 1
1 677 . 17 1 1 A 78 78 ASP C C 56 173.500 178.858 -5.358 1
1 678 . 17 1 1 A 78 78 ASP CA C 56 54.140 58.896 -4.756 1
1 679 . 17 1 1 A 78 78 ASP CB C 56 42.020 31.539 10.481 1
1 680 . 17 1 1 A 78 78 ASP N N 56 121.910 119.381 2.529 1
1 681 . 17 1 1 A 79 79 THR H H 57 8.490 8.021 0.469 1
1 682 . 17 1 1 A 79 79 THR HA H 57 4.700 4.068 0.632 1
1 687 . 17 1 1 A 79 79 THR C C 57 172.840 178.209 -5.369 1
1 688 . 17 1 1 A 79 79 THR CA C 57 59.980 59.008 0.972 1
1 689 . 17 1 1 A 79 79 THR CB C 57 70.640 30.593 40.047 1
1 691 . 17 1 1 A 79 79 THR N N 57 108.860 120.049 -11.189 1
1 692 . 17 1 1 A 80 80 LEU H H 58 7.700 8.137 -0.437 1
1 693 . 17 1 1 A 80 80 LEU HA H 58 3.880 4.615 -0.735 1
1 703 . 17 1 1 A 80 80 LEU C C 58 177.370 174.804 2.566 1
1 704 . 17 1 1 A 80 80 LEU CA C 58 58.450 57.307 1.143 1
1 705 . 17 1 1 A 80 80 LEU CB C 58 39.500 39.251 0.249 1
1 709 . 17 1 1 A 80 80 LEU N N 58 118.820 115.295 3.525 1
1 710 . 17 1 1 A 81 81 SER H H 59 8.810 7.930 0.880 1
1 711 . 17 1 1 A 81 81 SER HA H 59 4.050 3.875 0.175 1
1 714 . 17 1 1 A 81 81 SER C C 59 176.150 174.562 1.588 1
1 715 . 17 1 1 A 81 81 SER CA C 59 61.190 57.338 3.852 1
1 716 . 17 1 1 A 81 81 SER CB C 59 62.490 29.163 33.327 1
1 717 . 17 1 1 A 81 81 SER N N 59 114.240 116.564 -2.324 1
1 718 . 17 1 1 A 82 82 GLN H H 60 7.950 7.659 0.291 1
1 719 . 17 1 1 A 82 82 GLN HA H 60 4.090 4.921 -0.831 1
1 726 . 17 1 1 A 82 82 GLN C C 60 173.930 173.113 0.817 1
1 727 . 17 1 1 A 82 82 GLN CA C 60 58.080 57.417 0.663 1
1 728 . 17 1 1 A 82 82 GLN CB C 60 28.460 65.353 -36.893 1
1 730 . 17 1 1 A 82 82 GLN N N 60 122.620 113.753 8.867 1
1 732 . 17 1 1 A 83 83 HIS H H 61 6.990 8.775 -1.785 1
1 733 . 17 1 1 A 83 83 HIS HA H 61 4.490 4.577 -0.087 1
1 736 . 17 1 1 A 83 83 HIS C C 61 172.260 177.405 -5.145 1
1 737 . 17 1 1 A 83 83 HIS CA C 61 57.110 56.804 0.306 1
1 738 . 17 1 1 A 83 83 HIS CB C 61 32.780 30.320 2.460 1
1 739 . 17 1 1 A 83 83 HIS N N 61 116.940 124.548 -7.608 1
1 740 . 17 1 1 A 84 84 GLY H H 62 7.870 8.975 -1.105 1
1 743 . 17 1 1 A 84 84 GLY C C 62 171.040 175.822 -4.782 1
1 744 . 17 1 1 A 84 84 GLY CA C 62 45.390 66.063 -20.673 1
1 745 . 17 1 1 A 84 84 GLY N N 62 106.740 117.221 -10.481 1
1 746 . 17 1 1 A 85 85 ILE H H 63 6.810 8.358 -1.548 1
1 747 . 17 1 1 A 85 85 ILE HA H 63 3.050 4.438 -1.388 1
1 757 . 17 1 1 A 85 85 ILE C C 63 170.130 177.862 -7.732 1
1 758 . 17 1 1 A 85 85 ILE CA C 63 62.440 57.357 5.083 1
1 759 . 17 1 1 A 85 85 ILE CB C 63 36.110 40.295 -4.185 1
1 763 . 17 1 1 A 85 85 ILE N N 63 118.920 122.007 -3.087 1
1 764 . 17 1 1 A 86 86 HIS H H 64 6.020 7.555 -1.535 1
1 765 . 17 1 1 A 86 86 HIS HA H 64 5.030 4.320 0.710 1
1 768 . 17 1 1 A 86 86 HIS C C 64 170.090 175.864 -5.774 1
1 769 . 17 1 1 A 86 86 HIS CA C 64 53.500 57.095 -3.595 1
1 770 . 17 1 1 A 86 86 HIS CB C 64 31.860 29.656 2.204 1
1 771 . 17 1 1 A 86 86 HIS N N 64 122.440 116.997 5.443 1
1 772 . 17 1 1 A 87 87 ASP H H 65 8.340 7.676 0.664 1
1 773 . 17 1 1 A 87 87 ASP HA H 65 4.320 5.048 -0.728 1
1 776 . 17 1 1 A 87 87 ASP C C 65 174.370 176.007 -1.637 1
1 777 . 17 1 1 A 87 87 ASP CA C 65 56.440 52.905 3.535 1
1 778 . 17 1 1 A 87 87 ASP CB C 65 43.150 44.803 -1.653 1
1 779 . 17 1 1 A 87 87 ASP N N 65 116.230 116.104 0.126 1
1 780 . 17 1 1 A 88 88 GLY H H 66 9.330 8.641 0.689 1
1 783 . 17 1 1 A 88 88 GLY C C 66 172.330 174.041 -1.711 1
1 784 . 17 1 1 A 88 88 GLY CA C 66 45.270 59.167 -13.897 1
1 785 . 17 1 1 A 88 88 GLY N N 66 112.300 117.512 -5.212 1
1 786 . 17 1 1 A 89 89 LEU H H 67 7.640 8.592 -0.952 1
1 787 . 17 1 1 A 89 89 LEU HA H 67 4.720 5.115 -0.395 1
1 797 . 17 1 1 A 89 89 LEU C C 67 172.460 175.688 -3.228 1
1 798 . 17 1 1 A 89 89 LEU CA C 67 54.420 53.483 0.937 1
1 799 . 17 1 1 A 89 89 LEU CB C 67 42.260 44.008 -1.748 1
1 803 . 17 1 1 A 89 89 LEU N N 67 120.310 125.478 -5.168 1
1 804 . 17 1 1 A 90 90 THR H H 68 8.110 8.893 -0.783 1
1 805 . 17 1 1 A 90 90 THR HA H 68 5.300 5.182 0.118 1
1 810 . 17 1 1 A 90 90 THR C C 68 170.900 174.770 -3.870 1
1 811 . 17 1 1 A 90 90 THR CA C 68 61.870 60.414 1.456 1
1 812 . 17 1 1 A 90 90 THR CB C 68 71.320 41.919 29.401 1
1 814 . 17 1 1 A 90 90 THR N N 68 115.300 121.642 -6.342 1
1 815 . 17 1 1 A 91 91 VAL H H 69 9.290 9.124 0.166 1
1 816 . 17 1 1 A 91 91 VAL HA H 69 4.540 4.868 -0.328 1
1 824 . 17 1 1 A 91 91 VAL C C 69 170.890 174.836 -3.946 1
1 825 . 17 1 1 A 91 91 VAL CA C 69 60.310 57.818 2.492 1
1 826 . 17 1 1 A 91 91 VAL CB C 69 34.680 42.642 -7.962 1
1 829 . 17 1 1 A 91 91 VAL N N 69 124.200 126.750 -2.550 1
1 830 . 17 1 1 A 92 92 HIS H H 70 8.750 8.463 0.287 1
1 831 . 17 1 1 A 92 92 HIS HA H 70 5.020 3.770 1.250 1
1 835 . 17 1 1 A 92 92 HIS C C 70 170.890 176.964 -6.074 1
1 836 . 17 1 1 A 92 92 HIS CA C 70 56.750 53.174 3.576 1
1 837 . 17 1 1 A 92 92 HIS CB C 70 32.220 17.857 14.363 1
1 839 . 17 1 1 A 92 92 HIS N N 70 125.250 129.072 -3.822 1
1 840 . 17 1 1 A 93 93 LEU H H 71 8.290 8.351 -0.061 1
1 851 . 17 1 1 A 93 93 LEU C C 71 172.570 173.894 -1.324 1
1 852 . 17 1 1 A 93 93 LEU CA C 71 52.820 45.223 7.597 1
1 857 . 17 1 1 A 93 93 LEU N N 71 123.360 102.955 20.405 1
1 858 . 17 1 1 A 94 94 VAL H H 72 9.110 7.481 1.629 1
1 859 . 17 1 1 A 94 94 VAL HA H 72 4.080 4.801 -0.721 1
1 864 . 17 1 1 A 94 94 VAL C C 72 171.160 175.583 -4.423 1
1 865 . 17 1 1 A 94 94 VAL CA C 72 61.350 54.677 6.673 1
1 866 . 17 1 1 A 94 94 VAL CB C 72 34.640 34.944 -0.304 1
1 868 . 17 1 1 A 94 94 VAL N N 72 128.650 116.531 12.119 1
1 869 . 17 1 1 A 95 95 ILE H H 73 8.150 8.190 -0.040 1
1 870 . 17 1 1 A 95 95 ILE HA H 73 4.500 4.459 0.041 1
1 880 . 17 1 1 A 95 95 ILE C C 73 174.320 175.603 -1.283 1
1 881 . 17 1 1 A 95 95 ILE CA C 73 60.170 60.652 -0.482 1
1 882 . 17 1 1 A 95 95 ILE CB C 73 38.120 38.738 -0.618 1
1 886 . 17 1 1 A 95 95 ILE N N 73 125.560 119.206 6.354 1
1 887 . 17 1 1 A 96 96 LYS H H 74 9.280 8.680 0.600 1
1 888 . 17 1 1 A 96 96 LYS HA H 74 4.240 4.443 -0.203 1
1 891 . 17 1 1 A 96 96 LYS C C 74 173.510 176.136 -2.626 1
1 892 . 17 1 1 A 96 96 LYS CA C 74 56.730 54.476 2.254 1
1 893 . 17 1 1 A 96 96 LYS CB C 74 33.100 41.577 -8.477 1
1 894 . 17 1 1 A 96 96 LYS N N 74 129.290 127.548 1.742 1
1 895 . 17 1 1 A 97 97 THR H H 75 8.040 8.822 -0.782 1
1 896 . 17 1 1 A 97 97 THR HA H 75 4.230 4.655 -0.425 1
1 901 . 17 1 1 A 97 97 THR C C 75 171.800 177.445 -5.645 1
1 902 . 17 1 1 A 97 97 THR CA C 75 61.760 54.309 7.451 1
1 903 . 17 1 1 A 97 97 THR CB C 75 69.830 34.758 35.072 1
1 905 . 17 1 1 A 97 97 THR N N 75 114.420 123.667 -9.247 1
1 906 . 17 1 1 A 98 98 GLN H H 76 8.400 8.922 -0.522 1
1 907 . 17 1 1 A 98 98 GLN HA H 76 4.210 4.410 -0.200 1
1 914 . 17 1 1 A 98 98 GLN CA C 76 55.880 56.738 -0.858 1
1 915 . 17 1 1 A 98 98 GLN CB C 76 29.700 39.881 -10.181 1
1 917 . 17 1 1 A 98 98 GLN N N 76 122.370 121.177 1.193 1
1 919 . 17 1 1 A 99 99 ASN HA H 77 4.590 4.221 0.369 1
1 924 . 17 1 1 A 99 99 ASN C C 77 171.780 175.884 -4.104 1
1 925 . 17 1 1 A 99 99 ASN CA C 77 53.300 57.457 -4.157 1
1 926 . 17 1 1 A 99 99 ASN CB C 77 38.920 28.066 10.854 1
1 928 . 17 1 1 A 100 100 ARG H H 78 8.160 7.666 0.494 1
1 929 . 17 1 1 A 100 100 ARG HA H 78 4.560 4.827 -0.267 1
1 936 . 17 1 1 A 100 100 ARG CA C 78 53.860 53.370 0.490 1
1 937 . 17 1 1 A 100 100 ARG CB C 78 30.210 42.735 -12.525 1
1 940 . 17 1 1 A 100 100 ARG N N 78 122.840 121.241 1.599 1
1 941 . 17 1 1 A 101 101 PRO HA H 79 4.150 4.954 -0.804 1
1 948 . 17 1 1 A 101 101 PRO CA C 79 64.770 59.320 5.450 1
1 949 . 17 1 1 A 101 101 PRO CB C 79 32.040 71.392 -39.352 1
1 289 . 18 1 1 A 46 46 SER H H 24 8.950 8.603 0.347 1
1 290 . 18 1 1 A 46 46 SER HA H 24 4.900 4.853 0.047 1
1 293 . 18 1 1 A 46 46 SER C C 24 170.890 174.808 -3.918 1
1 294 . 18 1 1 A 46 46 SER CA C 24 56.980 55.008 1.972 1
1 295 . 18 1 1 A 46 46 SER CB C 24 65.590 36.239 29.351 1
1 296 . 18 1 1 A 46 46 SER N N 24 120.420 121.280 -0.860 1
1 297 . 18 1 1 A 47 47 VAL H H 25 9.140 8.354 0.786 1
1 298 . 18 1 1 A 47 47 VAL HA H 25 3.440 4.357 -0.917 1
1 306 . 18 1 1 A 47 47 VAL C C 25 175.060 175.515 -0.455 1
1 307 . 18 1 1 A 47 47 VAL CA C 25 67.250 61.194 6.056 1
1 308 . 18 1 1 A 47 47 VAL CB C 25 30.780 39.487 -8.707 1
1 311 . 18 1 1 A 47 47 VAL N N 25 123.970 125.942 -1.972 1
1 312 . 18 1 1 A 48 48 GLN H H 26 8.540 8.703 -0.163 1
1 313 . 18 1 1 A 48 48 GLN HA H 26 4.070 4.479 -0.409 1
1 320 . 18 1 1 A 48 48 GLN CA C 26 60.230 55.109 5.121 1
1 321 . 18 1 1 A 48 48 GLN CB C 26 28.490 32.928 -4.438 1
1 323 . 18 1 1 A 48 48 GLN N N 26 120.550 128.212 -7.662 1
1 325 . 18 1 1 A 49 49 GLN HA H 27 3.950 4.660 -0.710 1
1 332 . 18 1 1 A 49 49 GLN C C 27 176.230 175.273 0.957 1
1 333 . 18 1 1 A 49 49 GLN CA C 27 58.710 55.517 3.193 1
1 334 . 18 1 1 A 49 49 GLN CB C 27 28.820 31.776 -2.956 1
1 337 . 18 1 1 A 50 50 PHE H H 28 8.050 8.765 -0.715 1
1 338 . 18 1 1 A 50 50 PHE HA H 28 4.620 4.446 0.174 1
1 345 . 18 1 1 A 50 50 PHE C C 28 175.190 175.647 -0.457 1
1 346 . 18 1 1 A 50 50 PHE CA C 28 58.030 62.017 -3.987 1
1 347 . 18 1 1 A 50 50 PHE CB C 28 39.190 31.791 7.399 1
1 350 . 18 1 1 A 50 50 PHE N N 28 121.710 125.140 -3.430 1
1 351 . 18 1 1 A 51 51 LYS H H 29 8.940 8.773 0.167 1
1 352 . 18 1 1 A 51 51 LYS HA H 29 3.340 5.041 -1.701 1
1 361 . 18 1 1 A 51 51 LYS C C 29 175.370 174.432 0.938 1
1 362 . 18 1 1 A 51 51 LYS CA C 29 60.660 62.734 -2.074 1
1 363 . 18 1 1 A 51 51 LYS CB C 29 33.190 70.011 -36.821 1
1 367 . 18 1 1 A 51 51 LYS N N 29 117.530 122.895 -5.365 1
1 368 . 18 1 1 A 52 52 GLU H H 30 7.700 9.340 -1.640 1
1 369 . 18 1 1 A 52 52 GLU HA H 30 3.750 4.926 -1.176 1
1 374 . 18 1 1 A 52 52 GLU C C 30 176.780 174.205 2.575 1
1 375 . 18 1 1 A 52 52 GLU CA C 30 59.890 61.126 -1.236 1
1 376 . 18 1 1 A 52 52 GLU CB C 30 28.840 35.058 -6.218 1
1 378 . 18 1 1 A 52 52 GLU N N 30 118.820 126.672 -7.852 1
1 379 . 18 1 1 A 53 53 GLU H H 31 7.370 9.113 -1.743 1
1 380 . 18 1 1 A 53 53 GLU HA H 31 4.150 4.922 -0.772 1
1 385 . 18 1 1 A 53 53 GLU C C 31 177.040 176.438 0.602 1
1 386 . 18 1 1 A 53 53 GLU CA C 31 58.860 54.976 3.884 1
1 387 . 18 1 1 A 53 53 GLU CB C 31 29.200 34.004 -4.804 1
1 389 . 18 1 1 A 53 53 GLU N N 31 119.150 128.748 -9.598 1
1 390 . 18 1 1 A 54 54 ILE H H 32 8.000 8.622 -0.622 1
1 391 . 18 1 1 A 54 54 ILE HA H 32 3.550 4.809 -1.259 1
1 401 . 18 1 1 A 54 54 ILE C C 32 175.420 174.431 0.989 1
1 402 . 18 1 1 A 54 54 ILE CA C 32 64.690 58.745 5.945 1
1 403 . 18 1 1 A 54 54 ILE CB C 32 37.820 69.859 -32.039 1
1 407 . 18 1 1 A 54 54 ILE N N 32 119.970 117.706 2.264 1
1 409 . 18 1 1 A 55 55 SER HA H 33 3.930 4.474 -0.544 1
1 412 . 18 1 1 A 55 55 SER C C 33 173.830 177.001 -3.171 1
1 413 . 18 1 1 A 55 55 SER CA C 33 61.620 64.255 -2.635 1
1 414 . 18 1 1 A 55 55 SER CB C 33 62.720 31.419 31.301 1
1 415 . 18 1 1 A 55 55 SER N N 33 115.780 135.463 -19.683 1
1 416 . 18 1 1 A 56 56 LYS H H 34 7.150 7.952 -0.802 1
1 417 . 18 1 1 A 56 56 LYS HA H 34 4.090 4.408 -0.318 1
1 424 . 18 1 1 A 56 56 LYS C C 34 176.080 176.656 -0.576 1
1 425 . 18 1 1 A 56 56 LYS CA C 34 58.950 56.889 2.061 1
1 426 . 18 1 1 A 56 56 LYS CB C 34 32.540 34.428 -1.888 1
1 429 . 18 1 1 A 56 56 LYS N N 34 119.100 116.146 2.954 1
1 430 . 18 1 1 A 57 57 ARG H H 35 7.530 7.728 -0.198 1
1 431 . 18 1 1 A 57 57 ARG HA H 35 4.110 4.713 -0.603 1
1 436 . 18 1 1 A 57 57 ARG C C 35 174.800 173.804 0.996 1
1 437 . 18 1 1 A 57 57 ARG CA C 35 57.090 55.019 2.071 1
1 438 . 18 1 1 A 57 57 ARG CB C 35 29.810 31.033 -1.223 1
1 440 . 18 1 1 A 57 57 ARG N N 35 119.370 114.530 4.840 1
1 441 . 18 1 1 A 58 58 PHE H H 36 8.320 8.780 -0.460 1
1 442 . 18 1 1 A 58 58 PHE HA H 36 4.340 5.327 -0.987 1
1 449 . 18 1 1 A 58 58 PHE C C 36 171.940 174.621 -2.681 1
1 450 . 18 1 1 A 58 58 PHE CA C 36 58.500 54.404 4.096 1
1 451 . 18 1 1 A 58 58 PHE CB C 36 38.130 36.227 1.903 1
1 454 . 18 1 1 A 58 58 PHE N N 36 113.980 116.549 -2.569 1
1 455 . 18 1 1 A 59 59 LYS H H 37 7.790 8.868 -1.078 1
1 456 . 18 1 1 A 59 59 LYS HA H 37 3.960 5.011 -1.051 1
1 463 . 18 1 1 A 59 59 LYS C C 37 172.670 174.050 -1.380 1
1 464 . 18 1 1 A 59 59 LYS CA C 37 57.140 54.890 2.250 1
1 465 . 18 1 1 A 59 59 LYS CB C 37 29.020 33.818 -4.798 1
1 468 . 18 1 1 A 59 59 LYS N N 37 118.810 120.326 -1.516 1
1 469 . 18 1 1 A 60 60 SER H H 38 7.750 8.685 -0.935 1
1 470 . 18 1 1 A 60 60 SER HA H 38 4.700 5.323 -0.623 1
1 473 . 18 1 1 A 60 60 SER C C 38 170.170 174.629 -4.459 1
1 474 . 18 1 1 A 60 60 SER CA C 38 57.130 54.779 2.351 1
1 475 . 18 1 1 A 60 60 SER CB C 38 66.820 33.432 33.388 1
1 476 . 18 1 1 A 60 60 SER N N 38 112.620 125.249 -12.629 1
1 477 . 18 1 1 A 61 61 HIS H H 39 8.630 9.319 -0.689 1
1 478 . 18 1 1 A 61 61 HIS N N 39 124.090 124.621 -0.531 1
1 479 . 18 1 1 A 62 62 THR HA H 40 3.610 5.372 -1.762 1
1 484 . 18 1 1 A 62 62 THR C C 40 174.350 176.807 -2.457 1
1 485 . 18 1 1 A 62 62 THR CA C 40 66.160 50.433 15.727 1
1 486 . 18 1 1 A 62 62 THR CB C 40 68.070 20.893 47.177 1
1 488 . 18 1 1 A 63 63 ASP H H 41 10.310 8.573 1.737 1
1 489 . 18 1 1 A 63 63 ASP HA H 41 4.420 4.795 -0.375 1
1 492 . 18 1 1 A 63 63 ASP C C 41 174.630 175.063 -0.433 1
1 493 . 18 1 1 A 63 63 ASP CA C 41 56.330 58.078 -1.748 1
1 494 . 18 1 1 A 63 63 ASP CB C 41 40.040 34.761 5.279 1
1 495 . 18 1 1 A 63 63 ASP N N 41 122.900 117.700 5.200 1
1 497 . 18 1 1 A 64 64 GLN HA H 42 4.270 4.481 -0.211 1
1 504 . 18 1 1 A 64 64 GLN C C 42 172.160 176.778 -4.618 1
1 505 . 18 1 1 A 64 64 GLN CA C 42 55.860 63.410 -7.550 1
1 506 . 18 1 1 A 64 64 GLN CB C 42 30.480 31.680 -1.200 1
1 508 . 18 1 1 A 64 64 GLN N N 42 115.750 139.503 -23.753 1
1 510 . 18 1 1 A 65 65 LEU H H 43 7.250 7.994 -0.744 1
1 511 . 18 1 1 A 65 65 LEU HA H 43 4.440 3.946 0.494 1
1 517 . 18 1 1 A 65 65 LEU C C 43 173.160 175.417 -2.257 1
1 518 . 18 1 1 A 65 65 LEU CA C 43 54.620 58.261 -3.641 1
1 519 . 18 1 1 A 65 65 LEU CB C 43 41.990 27.470 14.520 1
1 521 . 18 1 1 A 65 65 LEU N N 43 116.570 113.876 2.694 1
1 522 . 18 1 1 A 66 66 VAL H H 44 8.690 8.086 0.604 1
1 523 . 18 1 1 A 66 66 VAL HA H 44 3.980 4.950 -0.970 1
1 528 . 18 1 1 A 66 66 VAL C C 44 171.340 175.343 -4.003 1
1 529 . 18 1 1 A 66 66 VAL CA C 44 61.910 52.861 9.049 1
1 530 . 18 1 1 A 66 66 VAL CB C 44 33.630 41.144 -7.514 1
1 532 . 18 1 1 A 66 66 VAL N N 44 125.260 117.535 7.725 1
1 533 . 18 1 1 A 67 67 LEU H H 45 8.570 7.740 0.830 1
1 534 . 18 1 1 A 67 67 LEU HA H 45 5.220 4.309 0.911 1
1 544 . 18 1 1 A 67 67 LEU C C 45 172.500 174.256 -1.756 1
1 545 . 18 1 1 A 67 67 LEU CA C 45 52.820 60.194 -7.374 1
1 546 . 18 1 1 A 67 67 LEU CB C 45 45.310 63.637 -18.327 1
1 550 . 18 1 1 A 67 67 LEU N N 45 126.690 116.755 9.935 1
1 551 . 18 1 1 A 68 68 ILE H H 46 9.040 8.737 0.303 1
1 552 . 18 1 1 A 68 68 ILE HA H 46 4.880 4.583 0.297 1
1 562 . 18 1 1 A 68 68 ILE C C 46 172.390 176.194 -3.804 1
1 563 . 18 1 1 A 68 68 ILE CA C 46 59.900 57.621 2.279 1
1 564 . 18 1 1 A 68 68 ILE CB C 46 41.940 65.123 -23.183 1
1 568 . 18 1 1 A 68 68 ILE N N 46 122.590 121.592 0.998 1
1 569 . 18 1 1 A 69 69 PHE H H 47 8.740 8.674 0.066 1
1 570 . 18 1 1 A 69 69 PHE N N 47 125.360 121.784 3.576 1
1 571 . 18 1 1 A 70 70 ALA HA H 48 3.600 3.981 -0.381 1
1 575 . 18 1 1 A 70 70 ALA C C 48 174.500 178.490 -3.990 1
1 576 . 18 1 1 A 70 70 ALA CA C 48 52.520 59.141 -6.621 1
1 577 . 18 1 1 A 70 70 ALA CB C 48 16.760 28.147 -11.387 1
1 578 . 18 1 1 A 71 71 GLY H H 49 8.210 7.688 0.522 1
1 581 . 18 1 1 A 71 71 GLY C C 49 170.850 178.460 -7.610 1
1 582 . 18 1 1 A 71 71 GLY CA C 49 45.380 58.318 -12.938 1
1 583 . 18 1 1 A 71 71 GLY N N 49 102.430 118.851 -16.421 1
1 584 . 18 1 1 A 72 72 LYS H H 50 7.840 8.109 -0.269 1
1 585 . 18 1 1 A 72 72 LYS HA H 50 4.530 4.055 0.475 1
1 594 . 18 1 1 A 72 72 LYS C C 50 171.800 177.670 -5.870 1
1 595 . 18 1 1 A 72 72 LYS CA C 50 54.630 61.099 -6.469 1
1 596 . 18 1 1 A 72 72 LYS CB C 50 34.630 38.840 -4.210 1
1 600 . 18 1 1 A 72 72 LYS N N 50 121.570 120.518 1.052 1
1 601 . 18 1 1 A 73 73 ILE H H 51 8.250 8.209 0.041 1
1 602 . 18 1 1 A 73 73 ILE HA H 51 4.260 3.809 0.451 1
1 612 . 18 1 1 A 73 73 ILE C C 51 174.300 178.321 -4.021 1
1 613 . 18 1 1 A 73 73 ILE CA C 51 61.270 58.197 3.073 1
1 614 . 18 1 1 A 73 73 ILE CB C 51 38.150 31.201 6.949 1
1 618 . 18 1 1 A 73 73 ILE N N 51 122.710 118.201 4.509 1
1 619 . 18 1 1 A 74 74 LEU H H 52 8.540 8.333 0.207 1
1 620 . 18 1 1 A 74 74 LEU HA H 52 3.980 3.965 0.015 1
1 630 . 18 1 1 A 74 74 LEU C C 52 173.440 179.289 -5.849 1
1 631 . 18 1 1 A 74 74 LEU CA C 52 54.660 59.558 -4.898 1
1 632 . 18 1 1 A 74 74 LEU CB C 52 41.790 29.044 12.746 1
1 636 . 18 1 1 A 74 74 LEU N N 52 128.360 119.106 9.254 1
1 637 . 18 1 1 A 75 75 LYS H H 53 8.100 8.118 -0.018 1
1 638 . 18 1 1 A 75 75 LYS HA H 53 4.440 3.963 0.477 1
1 645 . 18 1 1 A 75 75 LYS C C 53 175.170 179.187 -4.017 1
1 646 . 18 1 1 A 75 75 LYS CA C 53 55.340 59.101 -3.761 1
1 647 . 18 1 1 A 75 75 LYS CB C 53 32.680 29.520 3.160 1
1 650 . 18 1 1 A 75 75 LYS N N 53 123.470 120.003 3.467 1
1 651 . 18 1 1 A 76 76 ASP H H 54 8.310 7.305 1.005 1
1 652 . 18 1 1 A 76 76 ASP HA H 54 4.110 3.493 0.617 1
1 655 . 18 1 1 A 76 76 ASP C C 54 174.270 177.973 -3.703 1
1 656 . 18 1 1 A 76 76 ASP CA C 54 58.140 65.358 -7.218 1
1 657 . 18 1 1 A 76 76 ASP CB C 54 40.760 37.619 3.141 1
1 658 . 18 1 1 A 76 76 ASP N N 54 121.080 121.002 0.078 1
1 659 . 18 1 1 A 77 77 GLN H H 55 8.180 7.964 0.216 1
1 660 . 18 1 1 A 77 77 GLN HA H 55 4.360 4.072 0.288 1
1 667 . 18 1 1 A 77 77 GLN C C 55 173.710 177.101 -3.391 1
1 668 . 18 1 1 A 77 77 GLN CA C 55 56.350 61.925 -5.575 1
1 669 . 18 1 1 A 77 77 GLN CB C 55 28.090 62.854 -34.764 1
1 671 . 18 1 1 A 77 77 GLN N N 55 113.190 116.074 -2.884 1
1 673 . 18 1 1 A 78 78 ASP H H 56 7.770 7.710 0.060 1
1 674 . 18 1 1 A 78 78 ASP HA H 56 4.700 4.068 0.632 1
1 677 . 18 1 1 A 78 78 ASP C C 56 173.500 178.883 -5.383 1
1 678 . 18 1 1 A 78 78 ASP CA C 56 54.140 58.900 -4.760 1
1 679 . 18 1 1 A 78 78 ASP CB C 56 42.020 31.610 10.410 1
1 680 . 18 1 1 A 78 78 ASP N N 56 121.910 119.389 2.521 1
1 681 . 18 1 1 A 79 79 THR H H 57 8.490 7.250 1.240 1
1 682 . 18 1 1 A 79 79 THR HA H 57 4.700 3.852 0.848 1
1 687 . 18 1 1 A 79 79 THR C C 57 172.840 177.465 -4.625 1
1 688 . 18 1 1 A 79 79 THR CA C 57 59.980 58.755 1.225 1
1 689 . 18 1 1 A 79 79 THR CB C 57 70.640 30.087 40.553 1
1 691 . 18 1 1 A 79 79 THR N N 57 108.860 119.929 -11.069 1
1 692 . 18 1 1 A 80 80 LEU H H 58 7.700 7.476 0.224 1
1 693 . 18 1 1 A 80 80 LEU HA H 58 3.880 4.608 -0.728 1
1 703 . 18 1 1 A 80 80 LEU C C 58 177.370 174.393 2.977 1
1 704 . 18 1 1 A 80 80 LEU CA C 58 58.450 57.302 1.148 1
1 705 . 18 1 1 A 80 80 LEU CB C 58 39.500 38.920 0.580 1
1 709 . 18 1 1 A 80 80 LEU N N 58 118.820 114.116 4.704 1
1 710 . 18 1 1 A 81 81 SER H H 59 8.810 7.927 0.883 1
1 711 . 18 1 1 A 81 81 SER HA H 59 4.050 3.788 0.262 1
1 714 . 18 1 1 A 81 81 SER C C 59 176.150 174.711 1.439 1
1 715 . 18 1 1 A 81 81 SER CA C 59 61.190 57.357 3.833 1
1 716 . 18 1 1 A 81 81 SER CB C 59 62.490 29.334 33.156 1
1 717 . 18 1 1 A 81 81 SER N N 59 114.240 115.789 -1.549 1
1 718 . 18 1 1 A 82 82 GLN H H 60 7.950 7.779 0.171 1
1 719 . 18 1 1 A 82 82 GLN HA H 60 4.090 5.097 -1.007 1
1 726 . 18 1 1 A 82 82 GLN C C 60 173.930 171.876 2.054 1
1 727 . 18 1 1 A 82 82 GLN CA C 60 58.080 57.561 0.519 1
1 728 . 18 1 1 A 82 82 GLN CB C 60 28.460 66.521 -38.061 1
1 730 . 18 1 1 A 82 82 GLN N N 60 122.620 113.227 9.393 1
1 732 . 18 1 1 A 83 83 HIS H H 61 6.990 8.765 -1.775 1
1 733 . 18 1 1 A 83 83 HIS HA H 61 4.490 4.833 -0.343 1
1 736 . 18 1 1 A 83 83 HIS C C 61 172.260 176.578 -4.318 1
1 737 . 18 1 1 A 83 83 HIS CA C 61 57.110 54.867 2.243 1
1 738 . 18 1 1 A 83 83 HIS CB C 61 32.780 31.788 0.992 1
1 739 . 18 1 1 A 83 83 HIS N N 61 116.940 123.061 -6.121 1
1 740 . 18 1 1 A 84 84 GLY H H 62 7.870 8.778 -0.908 1
1 743 . 18 1 1 A 84 84 GLY C C 62 171.040 176.034 -4.994 1
1 744 . 18 1 1 A 84 84 GLY CA C 62 45.390 65.722 -20.332 1
1 745 . 18 1 1 A 84 84 GLY N N 62 106.740 121.424 -14.684 1
1 746 . 18 1 1 A 85 85 ILE H H 63 6.810 7.897 -1.087 1
1 747 . 18 1 1 A 85 85 ILE HA H 63 3.050 4.424 -1.374 1
1 757 . 18 1 1 A 85 85 ILE C C 63 170.130 177.619 -7.489 1
1 758 . 18 1 1 A 85 85 ILE CA C 63 62.440 57.312 5.128 1
1 759 . 18 1 1 A 85 85 ILE CB C 63 36.110 41.909 -5.799 1
1 763 . 18 1 1 A 85 85 ILE N N 63 118.920 122.064 -3.144 1
1 764 . 18 1 1 A 86 86 HIS H H 64 6.020 8.177 -2.157 1
1 765 . 18 1 1 A 86 86 HIS HA H 64 5.030 4.390 0.640 1
1 768 . 18 1 1 A 86 86 HIS C C 64 170.090 175.300 -5.210 1
1 769 . 18 1 1 A 86 86 HIS CA C 64 53.500 55.644 -2.144 1
1 770 . 18 1 1 A 86 86 HIS CB C 64 31.860 28.084 3.776 1
1 771 . 18 1 1 A 86 86 HIS N N 64 122.440 114.642 7.798 1
1 772 . 18 1 1 A 87 87 ASP H H 65 8.340 7.422 0.918 1
1 773 . 18 1 1 A 87 87 ASP HA H 65 4.320 4.689 -0.369 1
1 776 . 18 1 1 A 87 87 ASP C C 65 174.370 175.558 -1.188 1
1 777 . 18 1 1 A 87 87 ASP CA C 65 56.440 53.518 2.922 1
1 778 . 18 1 1 A 87 87 ASP CB C 65 43.150 43.089 0.061 1
1 779 . 18 1 1 A 87 87 ASP N N 65 116.230 122.077 -5.847 1
1 780 . 18 1 1 A 88 88 GLY H H 66 9.330 8.973 0.357 1
1 783 . 18 1 1 A 88 88 GLY C C 66 172.330 174.640 -2.310 1
1 784 . 18 1 1 A 88 88 GLY CA C 66 45.270 59.968 -14.698 1
1 785 . 18 1 1 A 88 88 GLY N N 66 112.300 119.299 -6.999 1
1 786 . 18 1 1 A 89 89 LEU H H 67 7.640 8.860 -1.220 1
1 787 . 18 1 1 A 89 89 LEU HA H 67 4.720 4.989 -0.269 1
1 797 . 18 1 1 A 89 89 LEU C C 67 172.460 175.890 -3.430 1
1 798 . 18 1 1 A 89 89 LEU CA C 67 54.420 53.952 0.468 1
1 799 . 18 1 1 A 89 89 LEU CB C 67 42.260 42.834 -0.574 1
1 803 . 18 1 1 A 89 89 LEU N N 67 120.310 126.916 -6.606 1
1 804 . 18 1 1 A 90 90 THR H H 68 8.110 8.802 -0.692 1
1 805 . 18 1 1 A 90 90 THR HA H 68 5.300 5.435 -0.135 1
1 810 . 18 1 1 A 90 90 THR C C 68 170.900 174.706 -3.806 1
1 811 . 18 1 1 A 90 90 THR CA C 68 61.870 60.394 1.476 1
1 812 . 18 1 1 A 90 90 THR CB C 68 71.320 41.316 30.004 1
1 814 . 18 1 1 A 90 90 THR N N 68 115.300 121.792 -6.492 1
1 815 . 18 1 1 A 91 91 VAL H H 69 9.290 9.107 0.183 1
1 816 . 18 1 1 A 91 91 VAL HA H 69 4.540 5.014 -0.474 1
1 824 . 18 1 1 A 91 91 VAL C C 69 170.890 174.990 -4.100 1
1 825 . 18 1 1 A 91 91 VAL CA C 69 60.310 57.580 2.730 1
1 826 . 18 1 1 A 91 91 VAL CB C 69 34.680 43.051 -8.371 1
1 829 . 18 1 1 A 91 91 VAL N N 69 124.200 126.610 -2.410 1
1 830 . 18 1 1 A 92 92 HIS H H 70 8.750 8.633 0.117 1
1 831 . 18 1 1 A 92 92 HIS HA H 70 5.020 3.817 1.203 1
1 835 . 18 1 1 A 92 92 HIS C C 70 170.890 177.153 -6.263 1
1 836 . 18 1 1 A 92 92 HIS CA C 70 56.750 53.180 3.570 1
1 837 . 18 1 1 A 92 92 HIS CB C 70 32.220 17.865 14.355 1
1 839 . 18 1 1 A 92 92 HIS N N 70 125.250 129.624 -4.374 1
1 840 . 18 1 1 A 93 93 LEU H H 71 8.290 8.525 -0.235 1
1 851 . 18 1 1 A 93 93 LEU C C 71 172.570 173.607 -1.037 1
1 852 . 18 1 1 A 93 93 LEU CA C 71 52.820 45.488 7.332 1
1 857 . 18 1 1 A 93 93 LEU N N 71 123.360 103.168 20.192 1
1 858 . 18 1 1 A 94 94 VAL H H 72 9.110 7.395 1.715 1
1 859 . 18 1 1 A 94 94 VAL HA H 72 4.080 4.908 -0.828 1
1 864 . 18 1 1 A 94 94 VAL C C 72 171.160 175.280 -4.120 1
1 865 . 18 1 1 A 94 94 VAL CA C 72 61.350 54.345 7.005 1
1 866 . 18 1 1 A 94 94 VAL CB C 72 34.640 36.110 -1.470 1
1 868 . 18 1 1 A 94 94 VAL N N 72 128.650 115.257 13.393 1
1 869 . 18 1 1 A 95 95 ILE H H 73 8.150 8.201 -0.051 1
1 870 . 18 1 1 A 95 95 ILE HA H 73 4.500 4.423 0.077 1
1 880 . 18 1 1 A 95 95 ILE C C 73 174.320 175.794 -1.474 1
1 881 . 18 1 1 A 95 95 ILE CA C 73 60.170 61.082 -0.912 1
1 882 . 18 1 1 A 95 95 ILE CB C 73 38.120 38.171 -0.051 1
1 886 . 18 1 1 A 95 95 ILE N N 73 125.560 118.871 6.689 1
1 887 . 18 1 1 A 96 96 LYS H H 74 9.280 8.809 0.471 1
1 888 . 18 1 1 A 96 96 LYS HA H 74 4.240 4.329 -0.089 1
1 891 . 18 1 1 A 96 96 LYS C C 74 173.510 176.446 -2.936 1
1 892 . 18 1 1 A 96 96 LYS CA C 74 56.730 54.521 2.209 1
1 893 . 18 1 1 A 96 96 LYS CB C 74 33.100 41.008 -7.908 1
1 894 . 18 1 1 A 96 96 LYS N N 74 129.290 128.213 1.077 1
1 895 . 18 1 1 A 97 97 THR H H 75 8.040 8.829 -0.789 1
1 896 . 18 1 1 A 97 97 THR HA H 75 4.230 4.588 -0.358 1
1 901 . 18 1 1 A 97 97 THR C C 75 171.800 177.454 -5.654 1
1 902 . 18 1 1 A 97 97 THR CA C 75 61.760 54.784 6.976 1
1 903 . 18 1 1 A 97 97 THR CB C 75 69.830 34.256 35.574 1
1 905 . 18 1 1 A 97 97 THR N N 75 114.420 124.732 -10.312 1
1 906 . 18 1 1 A 98 98 GLN H H 76 8.400 8.981 -0.581 1
1 907 . 18 1 1 A 98 98 GLN HA H 76 4.210 4.355 -0.145 1
1 914 . 18 1 1 A 98 98 GLN CA C 76 55.880 56.546 -0.666 1
1 915 . 18 1 1 A 98 98 GLN CB C 76 29.700 39.852 -10.152 1
1 917 . 18 1 1 A 98 98 GLN N N 76 122.370 121.259 1.111 1
1 919 . 18 1 1 A 99 99 ASN HA H 77 4.590 4.191 0.399 1
1 924 . 18 1 1 A 99 99 ASN C C 77 171.780 176.234 -4.454 1
1 925 . 18 1 1 A 99 99 ASN CA C 77 53.300 57.635 -4.335 1
1 926 . 18 1 1 A 99 99 ASN CB C 77 38.920 27.928 10.992 1
1 928 . 18 1 1 A 100 100 ARG H H 78 8.160 7.914 0.246 1
1 929 . 18 1 1 A 100 100 ARG HA H 78 4.560 4.764 -0.204 1
1 936 . 18 1 1 A 100 100 ARG CA C 78 53.860 53.873 -0.013 1
1 937 . 18 1 1 A 100 100 ARG CB C 78 30.210 41.701 -11.491 1
1 940 . 18 1 1 A 100 100 ARG N N 78 122.840 120.997 1.843 1
1 941 . 18 1 1 A 101 101 PRO HA H 79 4.150 4.920 -0.770 1
1 948 . 18 1 1 A 101 101 PRO CA C 79 64.770 59.203 5.567 1
1 949 . 18 1 1 A 101 101 PRO CB C 79 32.040 71.762 -39.722 1
1 289 . 19 1 1 A 46 46 SER H H 24 8.950 8.459 0.491 1
1 290 . 19 1 1 A 46 46 SER HA H 24 4.900 4.531 0.369 1
1 293 . 19 1 1 A 46 46 SER C C 24 170.890 176.190 -5.300 1
1 294 . 19 1 1 A 46 46 SER CA C 24 56.980 56.022 0.958 1
1 295 . 19 1 1 A 46 46 SER CB C 24 65.590 33.489 32.101 1
1 296 . 19 1 1 A 46 46 SER N N 24 120.420 122.518 -2.098 1
1 297 . 19 1 1 A 47 47 VAL H H 25 9.140 8.291 0.849 1
1 298 . 19 1 1 A 47 47 VAL HA H 25 3.440 4.320 -0.880 1
1 306 . 19 1 1 A 47 47 VAL C C 25 175.060 175.500 -0.440 1
1 307 . 19 1 1 A 47 47 VAL CA C 25 67.250 61.157 6.093 1
1 308 . 19 1 1 A 47 47 VAL CB C 25 30.780 39.601 -8.821 1
1 311 . 19 1 1 A 47 47 VAL N N 25 123.970 126.184 -2.214 1
1 312 . 19 1 1 A 48 48 GLN H H 26 8.540 8.433 0.107 1
1 313 . 19 1 1 A 48 48 GLN HA H 26 4.070 4.709 -0.639 1
1 320 . 19 1 1 A 48 48 GLN CA C 26 60.230 54.783 5.447 1
1 321 . 19 1 1 A 48 48 GLN CB C 26 28.490 32.614 -4.124 1
1 323 . 19 1 1 A 48 48 GLN N N 26 120.550 127.443 -6.893 1
1 325 . 19 1 1 A 49 49 GLN HA H 27 3.950 4.985 -1.035 1
1 332 . 19 1 1 A 49 49 GLN C C 27 176.230 175.461 0.769 1
1 333 . 19 1 1 A 49 49 GLN CA C 27 58.710 55.656 3.054 1
1 334 . 19 1 1 A 49 49 GLN CB C 27 28.820 31.716 -2.896 1
1 337 . 19 1 1 A 50 50 PHE H H 28 8.050 8.636 -0.586 1
1 338 . 19 1 1 A 50 50 PHE HA H 28 4.620 4.670 -0.050 1
1 345 . 19 1 1 A 50 50 PHE C C 28 175.190 175.494 -0.304 1
1 346 . 19 1 1 A 50 50 PHE CA C 28 58.030 61.852 -3.822 1
1 347 . 19 1 1 A 50 50 PHE CB C 28 39.190 32.441 6.749 1
1 350 . 19 1 1 A 50 50 PHE N N 28 121.710 125.524 -3.814 1
1 351 . 19 1 1 A 51 51 LYS H H 29 8.940 8.675 0.265 1
1 352 . 19 1 1 A 51 51 LYS HA H 29 3.340 4.710 -1.370 1
1 361 . 19 1 1 A 51 51 LYS C C 29 175.370 174.271 1.099 1
1 362 . 19 1 1 A 51 51 LYS CA C 29 60.660 62.586 -1.926 1
1 363 . 19 1 1 A 51 51 LYS CB C 29 33.190 69.441 -36.251 1
1 367 . 19 1 1 A 51 51 LYS N N 29 117.530 123.295 -5.765 1
1 368 . 19 1 1 A 52 52 GLU H H 30 7.700 9.509 -1.809 1
1 369 . 19 1 1 A 52 52 GLU HA H 30 3.750 4.716 -0.966 1
1 374 . 19 1 1 A 52 52 GLU C C 30 176.780 174.254 2.526 1
1 375 . 19 1 1 A 52 52 GLU CA C 30 59.890 61.360 -1.470 1
1 376 . 19 1 1 A 52 52 GLU CB C 30 28.840 33.335 -4.495 1
1 378 . 19 1 1 A 52 52 GLU N N 30 118.820 128.624 -9.804 1
1 379 . 19 1 1 A 53 53 GLU H H 31 7.370 9.066 -1.696 1
1 380 . 19 1 1 A 53 53 GLU HA H 31 4.150 5.293 -1.143 1
1 385 . 19 1 1 A 53 53 GLU C C 31 177.040 175.035 2.005 1
1 386 . 19 1 1 A 53 53 GLU CA C 31 58.860 54.583 4.277 1
1 387 . 19 1 1 A 53 53 GLU CB C 31 29.200 35.972 -6.772 1
1 389 . 19 1 1 A 53 53 GLU N N 31 119.150 128.685 -9.535 1
1 390 . 19 1 1 A 54 54 ILE H H 32 8.000 8.851 -0.851 1
1 391 . 19 1 1 A 54 54 ILE HA H 32 3.550 5.172 -1.622 1
1 401 . 19 1 1 A 54 54 ILE C C 32 175.420 174.260 1.160 1
1 402 . 19 1 1 A 54 54 ILE CA C 32 64.690 58.416 6.274 1
1 403 . 19 1 1 A 54 54 ILE CB C 32 37.820 69.790 -31.970 1
1 407 . 19 1 1 A 54 54 ILE N N 32 119.970 117.389 2.581 1
1 409 . 19 1 1 A 55 55 SER HA H 33 3.930 4.511 -0.581 1
1 412 . 19 1 1 A 55 55 SER C C 33 173.830 177.503 -3.673 1
1 413 . 19 1 1 A 55 55 SER CA C 33 61.620 64.246 -2.626 1
1 414 . 19 1 1 A 55 55 SER CB C 33 62.720 31.573 31.147 1
1 415 . 19 1 1 A 55 55 SER N N 33 115.780 135.527 -19.747 1
1 416 . 19 1 1 A 56 56 LYS H H 34 7.150 7.911 -0.761 1
1 417 . 19 1 1 A 56 56 LYS HA H 34 4.090 4.359 -0.269 1
1 424 . 19 1 1 A 56 56 LYS C C 34 176.080 176.708 -0.628 1
1 425 . 19 1 1 A 56 56 LYS CA C 34 58.950 57.093 1.857 1
1 426 . 19 1 1 A 56 56 LYS CB C 34 32.540 33.460 -0.920 1
1 429 . 19 1 1 A 56 56 LYS N N 34 119.100 116.491 2.609 1
1 430 . 19 1 1 A 57 57 ARG H H 35 7.530 7.965 -0.435 1
1 431 . 19 1 1 A 57 57 ARG HA H 35 4.110 4.671 -0.561 1
1 436 . 19 1 1 A 57 57 ARG C C 35 174.800 174.008 0.792 1
1 437 . 19 1 1 A 57 57 ARG CA C 35 57.090 55.592 1.498 1
1 438 . 19 1 1 A 57 57 ARG CB C 35 29.810 30.559 -0.749 1
1 440 . 19 1 1 A 57 57 ARG N N 35 119.370 113.666 5.704 1
1 441 . 19 1 1 A 58 58 PHE H H 36 8.320 8.713 -0.393 1
1 442 . 19 1 1 A 58 58 PHE HA H 36 4.340 5.553 -1.213 1
1 449 . 19 1 1 A 58 58 PHE C C 36 171.940 174.494 -2.554 1
1 450 . 19 1 1 A 58 58 PHE CA C 36 58.500 54.509 3.991 1
1 451 . 19 1 1 A 58 58 PHE CB C 36 38.130 36.864 1.266 1
1 454 . 19 1 1 A 58 58 PHE N N 36 113.980 116.899 -2.919 1
1 455 . 19 1 1 A 59 59 LYS H H 37 7.790 8.999 -1.209 1
1 456 . 19 1 1 A 59 59 LYS HA H 37 3.960 4.814 -0.854 1
1 463 . 19 1 1 A 59 59 LYS C C 37 172.670 173.611 -0.941 1
1 464 . 19 1 1 A 59 59 LYS CA C 37 57.140 54.783 2.357 1
1 465 . 19 1 1 A 59 59 LYS CB C 37 29.020 33.081 -4.061 1
1 468 . 19 1 1 A 59 59 LYS N N 37 118.810 120.163 -1.353 1
1 469 . 19 1 1 A 60 60 SER H H 38 7.750 8.642 -0.892 1
1 470 . 19 1 1 A 60 60 SER HA H 38 4.700 5.007 -0.307 1
1 473 . 19 1 1 A 60 60 SER C C 38 170.170 175.051 -4.881 1
1 474 . 19 1 1 A 60 60 SER CA C 38 57.130 55.036 2.094 1
1 475 . 19 1 1 A 60 60 SER CB C 38 66.820 32.263 34.557 1
1 476 . 19 1 1 A 60 60 SER N N 38 112.620 126.704 -14.084 1
1 477 . 19 1 1 A 61 61 HIS H H 39 8.630 9.249 -0.619 1
1 478 . 19 1 1 A 61 61 HIS N N 39 124.090 125.151 -1.061 1
1 479 . 19 1 1 A 62 62 THR HA H 40 3.610 5.194 -1.584 1
1 484 . 19 1 1 A 62 62 THR C C 40 174.350 175.749 -1.399 1
1 485 . 19 1 1 A 62 62 THR CA C 40 66.160 51.144 15.016 1
1 486 . 19 1 1 A 62 62 THR CB C 40 68.070 20.768 47.302 1
1 488 . 19 1 1 A 63 63 ASP H H 41 10.310 8.788 1.522 1
1 489 . 19 1 1 A 63 63 ASP HA H 41 4.420 4.987 -0.567 1
1 492 . 19 1 1 A 63 63 ASP C C 41 174.630 175.072 -0.442 1
1 493 . 19 1 1 A 63 63 ASP CA C 41 56.330 58.072 -1.742 1
1 494 . 19 1 1 A 63 63 ASP CB C 41 40.040 34.698 5.342 1
1 495 . 19 1 1 A 63 63 ASP N N 41 122.900 118.179 4.721 1
1 497 . 19 1 1 A 64 64 GLN HA H 42 4.270 4.542 -0.272 1
1 504 . 19 1 1 A 64 64 GLN C C 42 172.160 176.518 -4.358 1
1 505 . 19 1 1 A 64 64 GLN CA C 42 55.860 63.509 -7.649 1
1 506 . 19 1 1 A 64 64 GLN CB C 42 30.480 31.847 -1.367 1
1 508 . 19 1 1 A 64 64 GLN N N 42 115.750 137.803 -22.053 1
1 510 . 19 1 1 A 65 65 LEU H H 43 7.250 8.001 -0.751 1
1 511 . 19 1 1 A 65 65 LEU HA H 43 4.440 4.037 0.403 1
1 517 . 19 1 1 A 65 65 LEU C C 43 173.160 175.943 -2.783 1
1 518 . 19 1 1 A 65 65 LEU CA C 43 54.620 58.156 -3.536 1
1 519 . 19 1 1 A 65 65 LEU CB C 43 41.990 27.525 14.465 1
1 521 . 19 1 1 A 65 65 LEU N N 43 116.570 113.639 2.931 1
1 522 . 19 1 1 A 66 66 VAL H H 44 8.690 7.939 0.751 1
1 523 . 19 1 1 A 66 66 VAL HA H 44 3.980 4.943 -0.963 1
1 528 . 19 1 1 A 66 66 VAL C C 44 171.340 175.849 -4.509 1
1 529 . 19 1 1 A 66 66 VAL CA C 44 61.910 54.313 7.597 1
1 530 . 19 1 1 A 66 66 VAL CB C 44 33.630 39.623 -5.993 1
1 532 . 19 1 1 A 66 66 VAL N N 44 125.260 117.317 7.943 1
1 533 . 19 1 1 A 67 67 LEU H H 45 8.570 7.764 0.806 1
1 534 . 19 1 1 A 67 67 LEU HA H 45 5.220 4.330 0.890 1
1 544 . 19 1 1 A 67 67 LEU C C 45 172.500 174.281 -1.781 1
1 545 . 19 1 1 A 67 67 LEU CA C 45 52.820 60.394 -7.574 1
1 546 . 19 1 1 A 67 67 LEU CB C 45 45.310 63.588 -18.278 1
1 550 . 19 1 1 A 67 67 LEU N N 45 126.690 116.516 10.174 1
1 551 . 19 1 1 A 68 68 ILE H H 46 9.040 8.562 0.478 1
1 552 . 19 1 1 A 68 68 ILE HA H 46 4.880 4.832 0.048 1
1 562 . 19 1 1 A 68 68 ILE C C 46 172.390 176.069 -3.679 1
1 563 . 19 1 1 A 68 68 ILE CA C 46 59.900 57.427 2.473 1
1 564 . 19 1 1 A 68 68 ILE CB C 46 41.940 65.307 -23.367 1
1 568 . 19 1 1 A 68 68 ILE N N 46 122.590 121.072 1.518 1
1 569 . 19 1 1 A 69 69 PHE H H 47 8.740 8.411 0.329 1
1 570 . 19 1 1 A 69 69 PHE N N 47 125.360 121.774 3.586 1
1 571 . 19 1 1 A 70 70 ALA HA H 48 3.600 3.988 -0.388 1
1 575 . 19 1 1 A 70 70 ALA C C 48 174.500 178.510 -4.010 1
1 576 . 19 1 1 A 70 70 ALA CA C 48 52.520 59.155 -6.635 1
1 577 . 19 1 1 A 70 70 ALA CB C 48 16.760 28.133 -11.373 1
1 578 . 19 1 1 A 71 71 GLY H H 49 8.210 7.558 0.652 1
1 581 . 19 1 1 A 71 71 GLY C C 49 170.850 178.391 -7.541 1
1 582 . 19 1 1 A 71 71 GLY CA C 49 45.380 58.243 -12.863 1
1 583 . 19 1 1 A 71 71 GLY N N 49 102.430 118.833 -16.403 1
1 584 . 19 1 1 A 72 72 LYS H H 50 7.840 8.331 -0.491 1
1 585 . 19 1 1 A 72 72 LYS HA H 50 4.530 4.056 0.474 1
1 594 . 19 1 1 A 72 72 LYS C C 50 171.800 177.794 -5.994 1
1 595 . 19 1 1 A 72 72 LYS CA C 50 54.630 61.136 -6.506 1
1 596 . 19 1 1 A 72 72 LYS CB C 50 34.630 38.927 -4.297 1
1 600 . 19 1 1 A 72 72 LYS N N 50 121.570 120.477 1.093 1
1 601 . 19 1 1 A 73 73 ILE H H 51 8.250 8.311 -0.061 1
1 602 . 19 1 1 A 73 73 ILE HA H 51 4.260 3.894 0.366 1
1 612 . 19 1 1 A 73 73 ILE C C 51 174.300 178.302 -4.002 1
1 613 . 19 1 1 A 73 73 ILE CA C 51 61.270 58.297 2.973 1
1 614 . 19 1 1 A 73 73 ILE CB C 51 38.150 31.261 6.889 1
1 618 . 19 1 1 A 73 73 ILE N N 51 122.710 118.063 4.647 1
1 619 . 19 1 1 A 74 74 LEU H H 52 8.540 8.147 0.393 1
1 620 . 19 1 1 A 74 74 LEU HA H 52 3.980 4.083 -0.103 1
1 630 . 19 1 1 A 74 74 LEU C C 52 173.440 179.007 -5.567 1
1 631 . 19 1 1 A 74 74 LEU CA C 52 54.660 59.196 -4.536 1
1 632 . 19 1 1 A 74 74 LEU CB C 52 41.790 29.306 12.484 1
1 636 . 19 1 1 A 74 74 LEU N N 52 128.360 119.070 9.290 1
1 637 . 19 1 1 A 75 75 LYS H H 53 8.100 7.629 0.471 1
1 638 . 19 1 1 A 75 75 LYS HA H 53 4.440 4.071 0.369 1
1 645 . 19 1 1 A 75 75 LYS C C 53 175.170 179.498 -4.328 1
1 646 . 19 1 1 A 75 75 LYS CA C 53 55.340 59.122 -3.782 1
1 647 . 19 1 1 A 75 75 LYS CB C 53 32.680 29.375 3.305 1
1 650 . 19 1 1 A 75 75 LYS N N 53 123.470 120.084 3.386 1
1 651 . 19 1 1 A 76 76 ASP H H 54 8.310 7.461 0.849 1
1 652 . 19 1 1 A 76 76 ASP HA H 54 4.110 3.960 0.150 1
1 655 . 19 1 1 A 76 76 ASP C C 54 174.270 177.850 -3.580 1
1 656 . 19 1 1 A 76 76 ASP CA C 54 58.140 65.578 -7.438 1
1 657 . 19 1 1 A 76 76 ASP CB C 54 40.760 37.575 3.185 1
1 658 . 19 1 1 A 76 76 ASP N N 54 121.080 121.183 -0.103 1
1 659 . 19 1 1 A 77 77 GLN H H 55 8.180 7.981 0.199 1
1 660 . 19 1 1 A 77 77 GLN HA H 55 4.360 4.484 -0.124 1
1 667 . 19 1 1 A 77 77 GLN C C 55 173.710 176.651 -2.941 1
1 668 . 19 1 1 A 77 77 GLN CA C 55 56.350 61.549 -5.199 1
1 669 . 19 1 1 A 77 77 GLN CB C 55 28.090 62.364 -34.274 1
1 671 . 19 1 1 A 77 77 GLN N N 55 113.190 115.299 -2.109 1
1 673 . 19 1 1 A 78 78 ASP H H 56 7.770 7.591 0.179 1
1 674 . 19 1 1 A 78 78 ASP HA H 56 4.700 4.032 0.668 1
1 677 . 19 1 1 A 78 78 ASP C C 56 173.500 178.884 -5.384 1
1 678 . 19 1 1 A 78 78 ASP CA C 56 54.140 59.305 -5.165 1
1 679 . 19 1 1 A 78 78 ASP CB C 56 42.020 32.052 9.968 1
1 680 . 19 1 1 A 78 78 ASP N N 56 121.910 119.991 1.919 1
1 681 . 19 1 1 A 79 79 THR H H 57 8.490 7.872 0.618 1
1 682 . 19 1 1 A 79 79 THR HA H 57 4.700 3.913 0.787 1
1 687 . 19 1 1 A 79 79 THR C C 57 172.840 178.020 -5.180 1
1 688 . 19 1 1 A 79 79 THR CA C 57 59.980 59.356 0.624 1
1 689 . 19 1 1 A 79 79 THR CB C 57 70.640 30.257 40.383 1
1 691 . 19 1 1 A 79 79 THR N N 57 108.860 119.335 -10.475 1
1 692 . 19 1 1 A 80 80 LEU H H 58 7.700 7.758 -0.058 1
1 693 . 19 1 1 A 80 80 LEU HA H 58 3.880 4.590 -0.710 1
1 703 . 19 1 1 A 80 80 LEU C C 58 177.370 174.803 2.567 1
1 704 . 19 1 1 A 80 80 LEU CA C 58 58.450 57.317 1.133 1
1 705 . 19 1 1 A 80 80 LEU CB C 58 39.500 39.060 0.440 1
1 709 . 19 1 1 A 80 80 LEU N N 58 118.820 117.211 1.609 1
1 710 . 19 1 1 A 81 81 SER H H 59 8.810 7.844 0.966 1
1 711 . 19 1 1 A 81 81 SER HA H 59 4.050 3.759 0.291 1
1 714 . 19 1 1 A 81 81 SER C C 59 176.150 174.467 1.683 1
1 715 . 19 1 1 A 81 81 SER CA C 59 61.190 57.311 3.879 1
1 716 . 19 1 1 A 81 81 SER CB C 59 62.490 29.027 33.463 1
1 717 . 19 1 1 A 81 81 SER N N 59 114.240 116.134 -1.894 1
1 718 . 19 1 1 A 82 82 GLN H H 60 7.950 7.584 0.366 1
1 719 . 19 1 1 A 82 82 GLN HA H 60 4.090 4.778 -0.688 1
1 726 . 19 1 1 A 82 82 GLN C C 60 173.930 173.243 0.687 1
1 727 . 19 1 1 A 82 82 GLN CA C 60 58.080 57.366 0.714 1
1 728 . 19 1 1 A 82 82 GLN CB C 60 28.460 65.501 -37.041 1
1 730 . 19 1 1 A 82 82 GLN N N 60 122.620 113.509 9.111 1
1 732 . 19 1 1 A 83 83 HIS H H 61 6.990 8.626 -1.636 1
1 733 . 19 1 1 A 83 83 HIS HA H 61 4.490 4.675 -0.185 1
1 736 . 19 1 1 A 83 83 HIS C C 61 172.260 177.098 -4.838 1
1 737 . 19 1 1 A 83 83 HIS CA C 61 57.110 56.630 0.480 1
1 738 . 19 1 1 A 83 83 HIS CB C 61 32.780 31.000 1.780 1
1 739 . 19 1 1 A 83 83 HIS N N 61 116.940 125.135 -8.195 1
1 740 . 19 1 1 A 84 84 GLY H H 62 7.870 9.048 -1.178 1
1 743 . 19 1 1 A 84 84 GLY C C 62 171.040 175.995 -4.955 1
1 744 . 19 1 1 A 84 84 GLY CA C 62 45.390 66.226 -20.836 1
1 745 . 19 1 1 A 84 84 GLY N N 62 106.740 116.682 -9.942 1
1 746 . 19 1 1 A 85 85 ILE H H 63 6.810 8.293 -1.483 1
1 747 . 19 1 1 A 85 85 ILE HA H 63 3.050 4.363 -1.313 1
1 757 . 19 1 1 A 85 85 ILE C C 63 170.130 178.189 -8.059 1
1 758 . 19 1 1 A 85 85 ILE CA C 63 62.440 57.608 4.832 1
1 759 . 19 1 1 A 85 85 ILE CB C 63 36.110 40.092 -3.982 1
1 763 . 19 1 1 A 85 85 ILE N N 63 118.920 122.339 -3.419 1
1 764 . 19 1 1 A 86 86 HIS H H 64 6.020 7.704 -1.684 1
1 765 . 19 1 1 A 86 86 HIS HA H 64 5.030 4.350 0.680 1
1 768 . 19 1 1 A 86 86 HIS C C 64 170.090 175.824 -5.734 1
1 769 . 19 1 1 A 86 86 HIS CA C 64 53.500 57.173 -3.673 1
1 770 . 19 1 1 A 86 86 HIS CB C 64 31.860 29.622 2.238 1
1 771 . 19 1 1 A 86 86 HIS N N 64 122.440 116.783 5.657 1
1 772 . 19 1 1 A 87 87 ASP H H 65 8.340 7.336 1.004 1
1 773 . 19 1 1 A 87 87 ASP HA H 65 4.320 5.253 -0.933 1
1 776 . 19 1 1 A 87 87 ASP C C 65 174.370 175.909 -1.539 1
1 777 . 19 1 1 A 87 87 ASP CA C 65 56.440 52.698 3.742 1
1 778 . 19 1 1 A 87 87 ASP CB C 65 43.150 45.451 -2.301 1
1 779 . 19 1 1 A 87 87 ASP N N 65 116.230 116.294 -0.064 1
1 780 . 19 1 1 A 88 88 GLY H H 66 9.330 8.703 0.627 1
1 783 . 19 1 1 A 88 88 GLY C C 66 172.330 174.182 -1.852 1
1 784 . 19 1 1 A 88 88 GLY CA C 66 45.270 59.811 -14.541 1
1 785 . 19 1 1 A 88 88 GLY N N 66 112.300 117.983 -5.683 1
1 786 . 19 1 1 A 89 89 LEU H H 67 7.640 8.968 -1.328 1
1 787 . 19 1 1 A 89 89 LEU HA H 67 4.720 4.695 0.025 1
1 797 . 19 1 1 A 89 89 LEU C C 67 172.460 176.304 -3.844 1
1 798 . 19 1 1 A 89 89 LEU CA C 67 54.420 54.321 0.099 1
1 799 . 19 1 1 A 89 89 LEU CB C 67 42.260 42.621 -0.361 1
1 803 . 19 1 1 A 89 89 LEU N N 67 120.310 127.523 -7.213 1
1 804 . 19 1 1 A 90 90 THR H H 68 8.110 8.925 -0.815 1
1 805 . 19 1 1 A 90 90 THR HA H 68 5.300 5.230 0.070 1
1 810 . 19 1 1 A 90 90 THR C C 68 170.900 175.029 -4.129 1
1 811 . 19 1 1 A 90 90 THR CA C 68 61.870 59.769 2.101 1
1 812 . 19 1 1 A 90 90 THR CB C 68 71.320 40.324 30.996 1
1 814 . 19 1 1 A 90 90 THR N N 68 115.300 123.111 -7.811 1
1 815 . 19 1 1 A 91 91 VAL H H 69 9.290 9.086 0.204 1
1 816 . 19 1 1 A 91 91 VAL HA H 69 4.540 4.743 -0.203 1
1 824 . 19 1 1 A 91 91 VAL C C 69 170.890 174.618 -3.728 1
1 825 . 19 1 1 A 91 91 VAL CA C 69 60.310 57.852 2.458 1
1 826 . 19 1 1 A 91 91 VAL CB C 69 34.680 42.615 -7.935 1
1 829 . 19 1 1 A 91 91 VAL N N 69 124.200 126.888 -2.688 1
1 830 . 19 1 1 A 92 92 HIS H H 70 8.750 8.385 0.365 1
1 831 . 19 1 1 A 92 92 HIS HA H 70 5.020 3.759 1.261 1
1 835 . 19 1 1 A 92 92 HIS C C 70 170.890 177.112 -6.222 1
1 836 . 19 1 1 A 92 92 HIS CA C 70 56.750 53.128 3.622 1
1 837 . 19 1 1 A 92 92 HIS CB C 70 32.220 17.926 14.294 1
1 839 . 19 1 1 A 92 92 HIS N N 70 125.250 129.064 -3.814 1
1 840 . 19 1 1 A 93 93 LEU H H 71 8.290 8.513 -0.223 1
1 851 . 19 1 1 A 93 93 LEU C C 71 172.570 173.589 -1.019 1
1 852 . 19 1 1 A 93 93 LEU CA C 71 52.820 45.404 7.416 1
1 857 . 19 1 1 A 93 93 LEU N N 71 123.360 102.856 20.504 1
1 858 . 19 1 1 A 94 94 VAL H H 72 9.110 7.379 1.731 1
1 859 . 19 1 1 A 94 94 VAL HA H 72 4.080 4.906 -0.826 1
1 864 . 19 1 1 A 94 94 VAL C C 72 171.160 175.211 -4.051 1
1 865 . 19 1 1 A 94 94 VAL CA C 72 61.350 54.230 7.120 1
1 866 . 19 1 1 A 94 94 VAL CB C 72 34.640 36.147 -1.507 1
1 868 . 19 1 1 A 94 94 VAL N N 72 128.650 115.421 13.229 1
1 869 . 19 1 1 A 95 95 ILE H H 73 8.150 8.195 -0.045 1
1 870 . 19 1 1 A 95 95 ILE HA H 73 4.500 4.827 -0.327 1
1 880 . 19 1 1 A 95 95 ILE C C 73 174.320 175.636 -1.316 1
1 881 . 19 1 1 A 95 95 ILE CA C 73 60.170 60.392 -0.222 1
1 882 . 19 1 1 A 95 95 ILE CB C 73 38.120 38.794 -0.674 1
1 886 . 19 1 1 A 95 95 ILE N N 73 125.560 119.608 5.952 1
1 887 . 19 1 1 A 96 96 LYS H H 74 9.280 8.874 0.406 1
1 888 . 19 1 1 A 96 96 LYS HA H 74 4.240 4.305 -0.065 1
1 891 . 19 1 1 A 96 96 LYS C C 74 173.510 176.288 -2.778 1
1 892 . 19 1 1 A 96 96 LYS CA C 74 56.730 54.394 2.336 1
1 893 . 19 1 1 A 96 96 LYS CB C 74 33.100 40.448 -7.348 1
1 894 . 19 1 1 A 96 96 LYS N N 74 129.290 128.491 0.799 1
1 895 . 19 1 1 A 97 97 THR H H 75 8.040 8.833 -0.793 1
1 896 . 19 1 1 A 97 97 THR HA H 75 4.230 4.549 -0.319 1
1 901 . 19 1 1 A 97 97 THR C C 75 171.800 177.728 -5.928 1
1 902 . 19 1 1 A 97 97 THR CA C 75 61.760 55.315 6.445 1
1 903 . 19 1 1 A 97 97 THR CB C 75 69.830 33.454 36.376 1
1 905 . 19 1 1 A 97 97 THR N N 75 114.420 124.987 -10.567 1
1 906 . 19 1 1 A 98 98 GLN H H 76 8.400 8.953 -0.553 1
1 907 . 19 1 1 A 98 98 GLN HA H 76 4.210 4.390 -0.180 1
1 914 . 19 1 1 A 98 98 GLN CA C 76 55.880 56.632 -0.752 1
1 915 . 19 1 1 A 98 98 GLN CB C 76 29.700 39.914 -10.214 1
1 917 . 19 1 1 A 98 98 GLN N N 76 122.370 121.176 1.194 1
1 919 . 19 1 1 A 99 99 ASN HA H 77 4.590 4.247 0.343 1
1 924 . 19 1 1 A 99 99 ASN C C 77 171.780 175.888 -4.108 1
1 925 . 19 1 1 A 99 99 ASN CA C 77 53.300 57.360 -4.060 1
1 926 . 19 1 1 A 99 99 ASN CB C 77 38.920 27.966 10.954 1
1 928 . 19 1 1 A 100 100 ARG H H 78 8.160 7.736 0.424 1
1 929 . 19 1 1 A 100 100 ARG HA H 78 4.560 5.072 -0.512 1
1 936 . 19 1 1 A 100 100 ARG CA C 78 53.860 52.845 1.015 1
1 937 . 19 1 1 A 100 100 ARG CB C 78 30.210 42.414 -12.204 1
1 940 . 19 1 1 A 100 100 ARG N N 78 122.840 120.787 2.053 1
1 941 . 19 1 1 A 101 101 PRO HA H 79 4.150 5.010 -0.860 1
1 948 . 19 1 1 A 101 101 PRO CA C 79 64.770 59.580 5.190 1
1 949 . 19 1 1 A 101 101 PRO CB C 79 32.040 71.769 -39.729 1
1 289 . 20 1 1 A 46 46 SER H H 24 8.950 8.435 0.515 1
1 290 . 20 1 1 A 46 46 SER HA H 24 4.900 4.711 0.189 1
1 293 . 20 1 1 A 46 46 SER C C 24 170.890 175.929 -5.039 1
1 294 . 20 1 1 A 46 46 SER CA C 24 56.980 55.164 1.816 1
1 295 . 20 1 1 A 46 46 SER CB C 24 65.590 35.172 30.418 1
1 296 . 20 1 1 A 46 46 SER N N 24 120.420 120.654 -0.234 1
1 297 . 20 1 1 A 47 47 VAL H H 25 9.140 8.400 0.740 1
1 298 . 20 1 1 A 47 47 VAL HA H 25 3.440 4.384 -0.944 1
1 306 . 20 1 1 A 47 47 VAL C C 25 175.060 175.581 -0.521 1
1 307 . 20 1 1 A 47 47 VAL CA C 25 67.250 61.241 6.009 1
1 308 . 20 1 1 A 47 47 VAL CB C 25 30.780 39.365 -8.585 1
1 311 . 20 1 1 A 47 47 VAL N N 25 123.970 125.960 -1.990 1
1 312 . 20 1 1 A 48 48 GLN H H 26 8.540 8.712 -0.172 1
1 313 . 20 1 1 A 48 48 GLN HA H 26 4.070 4.714 -0.644 1
1 320 . 20 1 1 A 48 48 GLN CA C 26 60.230 54.968 5.262 1
1 321 . 20 1 1 A 48 48 GLN CB C 26 28.490 32.798 -4.308 1
1 323 . 20 1 1 A 48 48 GLN N N 26 120.550 128.105 -7.555 1
1 325 . 20 1 1 A 49 49 GLN HA H 27 3.950 4.888 -0.938 1
1 332 . 20 1 1 A 49 49 GLN C C 27 176.230 175.415 0.815 1
1 333 . 20 1 1 A 49 49 GLN CA C 27 58.710 55.740 2.970 1
1 334 . 20 1 1 A 49 49 GLN CB C 27 28.820 31.811 -2.991 1
1 337 . 20 1 1 A 50 50 PHE H H 28 8.050 8.700 -0.650 1
1 338 . 20 1 1 A 50 50 PHE HA H 28 4.620 4.540 0.080 1
1 345 . 20 1 1 A 50 50 PHE C C 28 175.190 175.444 -0.254 1
1 346 . 20 1 1 A 50 50 PHE CA C 28 58.030 62.067 -4.037 1
1 347 . 20 1 1 A 50 50 PHE CB C 28 39.190 31.790 7.400 1
1 350 . 20 1 1 A 50 50 PHE N N 28 121.710 125.139 -3.429 1
1 351 . 20 1 1 A 51 51 LYS H H 29 8.940 8.714 0.226 1
1 352 . 20 1 1 A 51 51 LYS HA H 29 3.340 4.681 -1.341 1
1 361 . 20 1 1 A 51 51 LYS C C 29 175.370 174.284 1.086 1
1 362 . 20 1 1 A 51 51 LYS CA C 29 60.660 62.679 -2.019 1
1 363 . 20 1 1 A 51 51 LYS CB C 29 33.190 69.922 -36.732 1
1 367 . 20 1 1 A 51 51 LYS N N 29 117.530 123.636 -6.106 1
1 368 . 20 1 1 A 52 52 GLU H H 30 7.700 9.368 -1.668 1
1 369 . 20 1 1 A 52 52 GLU HA H 30 3.750 4.994 -1.244 1
1 374 . 20 1 1 A 52 52 GLU C C 30 176.780 174.066 2.714 1
1 375 . 20 1 1 A 52 52 GLU CA C 30 59.890 61.337 -1.447 1
1 376 . 20 1 1 A 52 52 GLU CB C 30 28.840 33.845 -5.005 1
1 378 . 20 1 1 A 52 52 GLU N N 30 118.820 127.714 -8.894 1
1 379 . 20 1 1 A 53 53 GLU H H 31 7.370 9.135 -1.765 1
1 380 . 20 1 1 A 53 53 GLU HA H 31 4.150 5.104 -0.954 1
1 385 . 20 1 1 A 53 53 GLU C C 31 177.040 175.982 1.058 1
1 386 . 20 1 1 A 53 53 GLU CA C 31 58.860 55.095 3.765 1
1 387 . 20 1 1 A 53 53 GLU CB C 31 29.200 34.578 -5.378 1
1 389 . 20 1 1 A 53 53 GLU N N 31 119.150 129.231 -10.081 1
1 390 . 20 1 1 A 54 54 ILE H H 32 8.000 8.299 -0.299 1
1 391 . 20 1 1 A 54 54 ILE HA H 32 3.550 5.162 -1.612 1
1 401 . 20 1 1 A 54 54 ILE C C 32 175.420 174.093 1.327 1
1 402 . 20 1 1 A 54 54 ILE CA C 32 64.690 58.605 6.085 1
1 403 . 20 1 1 A 54 54 ILE CB C 32 37.820 69.689 -31.869 1
1 407 . 20 1 1 A 54 54 ILE N N 32 119.970 117.806 2.164 1
1 409 . 20 1 1 A 55 55 SER HA H 33 3.930 4.511 -0.581 1
1 412 . 20 1 1 A 55 55 SER C C 33 173.830 177.271 -3.441 1
1 413 . 20 1 1 A 55 55 SER CA C 33 61.620 64.527 -2.907 1
1 414 . 20 1 1 A 55 55 SER CB C 33 62.720 31.795 30.925 1
1 415 . 20 1 1 A 55 55 SER N N 33 115.780 136.328 -20.548 1
1 416 . 20 1 1 A 56 56 LYS H H 34 7.150 8.066 -0.916 1
1 417 . 20 1 1 A 56 56 LYS HA H 34 4.090 4.449 -0.359 1
1 424 . 20 1 1 A 56 56 LYS C C 34 176.080 176.454 -0.374 1
1 425 . 20 1 1 A 56 56 LYS CA C 34 58.950 56.976 1.974 1
1 426 . 20 1 1 A 56 56 LYS CB C 34 32.540 34.328 -1.788 1
1 429 . 20 1 1 A 56 56 LYS N N 34 119.100 116.280 2.820 1
1 430 . 20 1 1 A 57 57 ARG H H 35 7.530 8.071 -0.541 1
1 431 . 20 1 1 A 57 57 ARG HA H 35 4.110 4.629 -0.519 1
1 436 . 20 1 1 A 57 57 ARG C C 35 174.800 174.179 0.621 1
1 437 . 20 1 1 A 57 57 ARG CA C 35 57.090 55.420 1.670 1
1 438 . 20 1 1 A 57 57 ARG CB C 35 29.810 30.891 -1.081 1
1 440 . 20 1 1 A 57 57 ARG N N 35 119.370 113.911 5.459 1
1 441 . 20 1 1 A 58 58 PHE H H 36 8.320 8.860 -0.540 1
1 442 . 20 1 1 A 58 58 PHE HA H 36 4.340 5.625 -1.285 1
1 449 . 20 1 1 A 58 58 PHE C C 36 171.940 174.262 -2.322 1
1 450 . 20 1 1 A 58 58 PHE CA C 36 58.500 54.989 3.511 1
1 451 . 20 1 1 A 58 58 PHE CB C 36 38.130 36.769 1.361 1
1 454 . 20 1 1 A 58 58 PHE N N 36 113.980 117.236 -3.256 1
1 455 . 20 1 1 A 59 59 LYS H H 37 7.790 8.673 -0.883 1
1 456 . 20 1 1 A 59 59 LYS HA H 37 3.960 4.677 -0.717 1
1 463 . 20 1 1 A 59 59 LYS C C 37 172.670 173.747 -1.077 1
1 464 . 20 1 1 A 59 59 LYS CA C 37 57.140 55.541 1.599 1
1 465 . 20 1 1 A 59 59 LYS CB C 37 29.020 33.625 -4.605 1
1 468 . 20 1 1 A 59 59 LYS N N 37 118.810 119.296 -0.486 1
1 469 . 20 1 1 A 60 60 SER H H 38 7.750 8.774 -1.024 1
1 470 . 20 1 1 A 60 60 SER HA H 38 4.700 5.064 -0.364 1
1 473 . 20 1 1 A 60 60 SER C C 38 170.170 175.258 -5.088 1
1 474 . 20 1 1 A 60 60 SER CA C 38 57.130 54.676 2.454 1
1 475 . 20 1 1 A 60 60 SER CB C 38 66.820 30.744 36.076 1
1 476 . 20 1 1 A 60 60 SER N N 38 112.620 126.756 -14.136 1
1 477 . 20 1 1 A 61 61 HIS H H 39 8.630 9.217 -0.587 1
1 478 . 20 1 1 A 61 61 HIS N N 39 124.090 126.799 -2.709 1
1 479 . 20 1 1 A 62 62 THR HA H 40 3.610 5.249 -1.639 1
1 484 . 20 1 1 A 62 62 THR C C 40 174.350 176.529 -2.179 1
1 485 . 20 1 1 A 62 62 THR CA C 40 66.160 50.468 15.692 1
1 486 . 20 1 1 A 62 62 THR CB C 40 68.070 20.670 47.400 1
1 488 . 20 1 1 A 63 63 ASP H H 41 10.310 8.708 1.602 1
1 489 . 20 1 1 A 63 63 ASP HA H 41 4.420 4.939 -0.519 1
1 492 . 20 1 1 A 63 63 ASP C C 41 174.630 175.090 -0.460 1
1 493 . 20 1 1 A 63 63 ASP CA C 41 56.330 58.061 -1.731 1
1 494 . 20 1 1 A 63 63 ASP CB C 41 40.040 34.531 5.509 1
1 495 . 20 1 1 A 63 63 ASP N N 41 122.900 118.038 4.862 1
1 497 . 20 1 1 A 64 64 GLN HA H 42 4.270 4.524 -0.254 1
1 504 . 20 1 1 A 64 64 GLN C C 42 172.160 177.898 -5.738 1
1 505 . 20 1 1 A 64 64 GLN CA C 42 55.860 63.522 -7.662 1
1 506 . 20 1 1 A 64 64 GLN CB C 42 30.480 32.034 -1.554 1
1 508 . 20 1 1 A 64 64 GLN N N 42 115.750 137.922 -22.172 1
1 510 . 20 1 1 A 65 65 LEU H H 43 7.250 8.127 -0.877 1
1 511 . 20 1 1 A 65 65 LEU HA H 43 4.440 3.931 0.509 1
1 517 . 20 1 1 A 65 65 LEU C C 43 173.160 176.115 -2.955 1
1 518 . 20 1 1 A 65 65 LEU CA C 43 54.620 57.325 -2.705 1
1 519 . 20 1 1 A 65 65 LEU CB C 43 41.990 27.364 14.626 1
1 521 . 20 1 1 A 65 65 LEU N N 43 116.570 118.159 -1.589 1
1 522 . 20 1 1 A 66 66 VAL H H 44 8.690 7.961 0.729 1
1 523 . 20 1 1 A 66 66 VAL HA H 44 3.980 4.928 -0.948 1
1 528 . 20 1 1 A 66 66 VAL C C 44 171.340 175.384 -4.044 1
1 529 . 20 1 1 A 66 66 VAL CA C 44 61.910 53.172 8.738 1
1 530 . 20 1 1 A 66 66 VAL CB C 44 33.630 39.922 -6.292 1
1 532 . 20 1 1 A 66 66 VAL N N 44 125.260 118.636 6.624 1
1 533 . 20 1 1 A 67 67 LEU H H 45 8.570 7.765 0.805 1
1 534 . 20 1 1 A 67 67 LEU HA H 45 5.220 4.338 0.882 1
1 544 . 20 1 1 A 67 67 LEU C C 45 172.500 174.304 -1.804 1
1 545 . 20 1 1 A 67 67 LEU CA C 45 52.820 60.077 -7.257 1
1 546 . 20 1 1 A 67 67 LEU CB C 45 45.310 63.525 -18.215 1
1 550 . 20 1 1 A 67 67 LEU N N 45 126.690 116.629 10.061 1
1 551 . 20 1 1 A 68 68 ILE H H 46 9.040 8.680 0.360 1
1 552 . 20 1 1 A 68 68 ILE HA H 46 4.880 4.768 0.112 1
1 562 . 20 1 1 A 68 68 ILE C C 46 172.390 176.047 -3.657 1
1 563 . 20 1 1 A 68 68 ILE CA C 46 59.900 57.522 2.378 1
1 564 . 20 1 1 A 68 68 ILE CB C 46 41.940 65.199 -23.259 1
1 568 . 20 1 1 A 68 68 ILE N N 46 122.590 121.294 1.296 1
1 569 . 20 1 1 A 69 69 PHE H H 47 8.740 8.719 0.021 1
1 570 . 20 1 1 A 69 69 PHE N N 47 125.360 121.736 3.624 1
1 571 . 20 1 1 A 70 70 ALA HA H 48 3.600 3.996 -0.396 1
1 575 . 20 1 1 A 70 70 ALA C C 48 174.500 178.168 -3.668 1
1 576 . 20 1 1 A 70 70 ALA CA C 48 52.520 59.161 -6.641 1
1 577 . 20 1 1 A 70 70 ALA CB C 48 16.760 27.967 -11.207 1
1 578 . 20 1 1 A 71 71 GLY H H 49 8.210 7.432 0.778 1
1 581 . 20 1 1 A 71 71 GLY C C 49 170.850 178.356 -7.506 1
1 582 . 20 1 1 A 71 71 GLY CA C 49 45.380 57.979 -12.599 1
1 583 . 20 1 1 A 71 71 GLY N N 49 102.430 118.501 -16.071 1
1 584 . 20 1 1 A 72 72 LYS H H 50 7.840 8.108 -0.268 1
1 585 . 20 1 1 A 72 72 LYS HA H 50 4.530 4.040 0.490 1
1 594 . 20 1 1 A 72 72 LYS C C 50 171.800 177.701 -5.901 1
1 595 . 20 1 1 A 72 72 LYS CA C 50 54.630 61.093 -6.463 1
1 596 . 20 1 1 A 72 72 LYS CB C 50 34.630 39.006 -4.376 1
1 600 . 20 1 1 A 72 72 LYS N N 50 121.570 120.716 0.854 1
1 601 . 20 1 1 A 73 73 ILE H H 51 8.250 8.057 0.193 1
1 602 . 20 1 1 A 73 73 ILE HA H 51 4.260 3.806 0.454 1
1 612 . 20 1 1 A 73 73 ILE C C 51 174.300 178.530 -4.230 1
1 613 . 20 1 1 A 73 73 ILE CA C 51 61.270 58.220 3.050 1
1 614 . 20 1 1 A 73 73 ILE CB C 51 38.150 31.190 6.960 1
1 618 . 20 1 1 A 73 73 ILE N N 51 122.710 118.154 4.556 1
1 619 . 20 1 1 A 74 74 LEU H H 52 8.540 8.337 0.203 1
1 620 . 20 1 1 A 74 74 LEU HA H 52 3.980 3.968 0.012 1
1 630 . 20 1 1 A 74 74 LEU C C 52 173.440 179.210 -5.770 1
1 631 . 20 1 1 A 74 74 LEU CA C 52 54.660 59.437 -4.777 1
1 632 . 20 1 1 A 74 74 LEU CB C 52 41.790 29.174 12.616 1
1 636 . 20 1 1 A 74 74 LEU N N 52 128.360 119.025 9.335 1
1 637 . 20 1 1 A 75 75 LYS H H 53 8.100 7.561 0.539 1
1 638 . 20 1 1 A 75 75 LYS HA H 53 4.440 4.119 0.321 1
1 645 . 20 1 1 A 75 75 LYS C C 53 175.170 179.167 -3.997 1
1 646 . 20 1 1 A 75 75 LYS CA C 53 55.340 59.000 -3.660 1
1 647 . 20 1 1 A 75 75 LYS CB C 53 32.680 28.962 3.718 1
1 650 . 20 1 1 A 75 75 LYS N N 53 123.470 118.504 4.966 1
1 651 . 20 1 1 A 76 76 ASP H H 54 8.310 7.287 1.023 1
1 652 . 20 1 1 A 76 76 ASP HA H 54 4.110 3.959 0.151 1
1 655 . 20 1 1 A 76 76 ASP C C 54 174.270 178.047 -3.777 1
1 656 . 20 1 1 A 76 76 ASP CA C 54 58.140 65.209 -7.069 1
1 657 . 20 1 1 A 76 76 ASP CB C 54 40.760 37.301 3.459 1
1 658 . 20 1 1 A 76 76 ASP N N 54 121.080 121.113 -0.033 1
1 659 . 20 1 1 A 77 77 GLN H H 55 8.180 7.895 0.285 1
1 660 . 20 1 1 A 77 77 GLN HA H 55 4.360 4.589 -0.229 1
1 667 . 20 1 1 A 77 77 GLN C C 55 173.710 176.566 -2.856 1
1 668 . 20 1 1 A 77 77 GLN CA C 55 56.350 61.603 -5.253 1
1 669 . 20 1 1 A 77 77 GLN CB C 55 28.090 62.262 -34.172 1
1 671 . 20 1 1 A 77 77 GLN N N 55 113.190 115.746 -2.556 1
1 673 . 20 1 1 A 78 78 ASP H H 56 7.770 8.034 -0.264 1
1 674 . 20 1 1 A 78 78 ASP HA H 56 4.700 4.087 0.613 1
1 677 . 20 1 1 A 78 78 ASP C C 56 173.500 178.804 -5.304 1
1 678 . 20 1 1 A 78 78 ASP CA C 56 54.140 59.041 -4.901 1
1 679 . 20 1 1 A 78 78 ASP CB C 56 42.020 31.987 10.033 1
1 680 . 20 1 1 A 78 78 ASP N N 56 121.910 119.683 2.227 1
1 681 . 20 1 1 A 79 79 THR H H 57 8.490 7.944 0.546 1
1 682 . 20 1 1 A 79 79 THR HA H 57 4.700 4.059 0.641 1
1 687 . 20 1 1 A 79 79 THR C C 57 172.840 177.952 -5.112 1
1 688 . 20 1 1 A 79 79 THR CA C 57 59.980 58.875 1.105 1
1 689 . 20 1 1 A 79 79 THR CB C 57 70.640 30.941 39.699 1
1 691 . 20 1 1 A 79 79 THR N N 57 108.860 120.003 -11.143 1
1 692 . 20 1 1 A 80 80 LEU H H 58 7.700 8.136 -0.436 1
1 693 . 20 1 1 A 80 80 LEU HA H 58 3.880 4.553 -0.673 1
1 703 . 20 1 1 A 80 80 LEU C C 58 177.370 174.686 2.684 1
1 704 . 20 1 1 A 80 80 LEU CA C 58 58.450 57.489 0.961 1
1 705 . 20 1 1 A 80 80 LEU CB C 58 39.500 39.617 -0.117 1
1 709 . 20 1 1 A 80 80 LEU N N 58 118.820 114.280 4.540 1
1 710 . 20 1 1 A 81 81 SER H H 59 8.810 7.898 0.912 1
1 711 . 20 1 1 A 81 81 SER HA H 59 4.050 3.773 0.277 1
1 714 . 20 1 1 A 81 81 SER C C 59 176.150 174.524 1.626 1
1 715 . 20 1 1 A 81 81 SER CA C 59 61.190 57.271 3.919 1
1 716 . 20 1 1 A 81 81 SER CB C 59 62.490 29.024 33.466 1
1 717 . 20 1 1 A 81 81 SER N N 59 114.240 116.168 -1.928 1
1 718 . 20 1 1 A 82 82 GLN H H 60 7.950 7.579 0.371 1
1 719 . 20 1 1 A 82 82 GLN HA H 60 4.090 4.827 -0.737 1
1 726 . 20 1 1 A 82 82 GLN C C 60 173.930 173.234 0.696 1
1 727 . 20 1 1 A 82 82 GLN CA C 60 58.080 57.399 0.681 1
1 728 . 20 1 1 A 82 82 GLN CB C 60 28.460 65.571 -37.111 1
1 730 . 20 1 1 A 82 82 GLN N N 60 122.620 113.599 9.021 1
1 732 . 20 1 1 A 83 83 HIS H H 61 6.990 8.645 -1.655 1
1 733 . 20 1 1 A 83 83 HIS HA H 61 4.490 4.516 -0.026 1
1 736 . 20 1 1 A 83 83 HIS C C 61 172.260 177.254 -4.994 1
1 737 . 20 1 1 A 83 83 HIS CA C 61 57.110 56.912 0.198 1
1 738 . 20 1 1 A 83 83 HIS CB C 61 32.780 30.622 2.158 1
1 739 . 20 1 1 A 83 83 HIS N N 61 116.940 125.196 -8.256 1
1 740 . 20 1 1 A 84 84 GLY H H 62 7.870 9.031 -1.161 1
1 743 . 20 1 1 A 84 84 GLY C C 62 171.040 176.345 -5.305 1
1 744 . 20 1 1 A 84 84 GLY CA C 62 45.390 65.276 -19.886 1
1 745 . 20 1 1 A 84 84 GLY N N 62 106.740 117.153 -10.413 1
1 746 . 20 1 1 A 85 85 ILE H H 63 6.810 8.245 -1.435 1
1 747 . 20 1 1 A 85 85 ILE HA H 63 3.050 4.347 -1.297 1
1 757 . 20 1 1 A 85 85 ILE C C 63 170.130 178.043 -7.913 1
1 758 . 20 1 1 A 85 85 ILE CA C 63 62.440 57.907 4.533 1
1 759 . 20 1 1 A 85 85 ILE CB C 63 36.110 41.128 -5.018 1
1 763 . 20 1 1 A 85 85 ILE N N 63 118.920 121.612 -2.692 1
1 764 . 20 1 1 A 86 86 HIS H H 64 6.020 7.351 -1.331 1
1 765 . 20 1 1 A 86 86 HIS HA H 64 5.030 4.363 0.667 1
1 768 . 20 1 1 A 86 86 HIS C C 64 170.090 175.623 -5.533 1
1 769 . 20 1 1 A 86 86 HIS CA C 64 53.500 55.846 -2.346 1
1 770 . 20 1 1 A 86 86 HIS CB C 64 31.860 29.244 2.616 1
1 771 . 20 1 1 A 86 86 HIS N N 64 122.440 115.876 6.564 1
1 772 . 20 1 1 A 87 87 ASP H H 65 8.340 7.464 0.876 1
1 773 . 20 1 1 A 87 87 ASP HA H 65 4.320 4.418 -0.098 1
1 776 . 20 1 1 A 87 87 ASP C C 65 174.370 175.636 -1.266 1
1 777 . 20 1 1 A 87 87 ASP CA C 65 56.440 53.808 2.632 1
1 778 . 20 1 1 A 87 87 ASP CB C 65 43.150 41.675 1.475 1
1 779 . 20 1 1 A 87 87 ASP N N 65 116.230 121.586 -5.356 1
1 780 . 20 1 1 A 88 88 GLY H H 66 9.330 8.730 0.600 1
1 783 . 20 1 1 A 88 88 GLY C C 66 172.330 174.361 -2.031 1
1 784 . 20 1 1 A 88 88 GLY CA C 66 45.270 60.353 -15.083 1
1 785 . 20 1 1 A 88 88 GLY N N 66 112.300 119.572 -7.272 1
1 786 . 20 1 1 A 89 89 LEU H H 67 7.640 9.067 -1.427 1
1 787 . 20 1 1 A 89 89 LEU HA H 67 4.720 4.715 0.005 1
1 797 . 20 1 1 A 89 89 LEU C C 67 172.460 176.259 -3.799 1
1 798 . 20 1 1 A 89 89 LEU CA C 67 54.420 54.330 0.090 1
1 799 . 20 1 1 A 89 89 LEU CB C 67 42.260 42.648 -0.388 1
1 803 . 20 1 1 A 89 89 LEU N N 67 120.310 128.209 -7.899 1
1 804 . 20 1 1 A 90 90 THR H H 68 8.110 8.747 -0.637 1
1 805 . 20 1 1 A 90 90 THR HA H 68 5.300 5.319 -0.019 1
1 810 . 20 1 1 A 90 90 THR C C 68 170.900 174.838 -3.938 1
1 811 . 20 1 1 A 90 90 THR CA C 68 61.870 59.839 2.031 1
1 812 . 20 1 1 A 90 90 THR CB C 68 71.320 40.525 30.795 1
1 814 . 20 1 1 A 90 90 THR N N 68 115.300 123.113 -7.813 1
1 815 . 20 1 1 A 91 91 VAL H H 69 9.290 9.024 0.266 1
1 816 . 20 1 1 A 91 91 VAL HA H 69 4.540 4.789 -0.249 1
1 824 . 20 1 1 A 91 91 VAL C C 69 170.890 174.701 -3.811 1
1 825 . 20 1 1 A 91 91 VAL CA C 69 60.310 57.673 2.637 1
1 826 . 20 1 1 A 91 91 VAL CB C 69 34.680 42.675 -7.995 1
1 829 . 20 1 1 A 91 91 VAL N N 69 124.200 126.803 -2.603 1
1 830 . 20 1 1 A 92 92 HIS H H 70 8.750 8.523 0.227 1
1 831 . 20 1 1 A 92 92 HIS HA H 70 5.020 3.872 1.148 1
1 835 . 20 1 1 A 92 92 HIS C C 70 170.890 176.867 -5.977 1
1 836 . 20 1 1 A 92 92 HIS CA C 70 56.750 53.777 2.973 1
1 837 . 20 1 1 A 92 92 HIS CB C 70 32.220 18.123 14.097 1
1 839 . 20 1 1 A 92 92 HIS N N 70 125.250 129.191 -3.941 1
1 840 . 20 1 1 A 93 93 LEU H H 71 8.290 8.359 -0.069 1
1 851 . 20 1 1 A 93 93 LEU C C 71 172.570 174.173 -1.603 1
1 852 . 20 1 1 A 93 93 LEU CA C 71 52.820 45.036 7.784 1
1 857 . 20 1 1 A 93 93 LEU N N 71 123.360 103.770 19.590 1
1 858 . 20 1 1 A 94 94 VAL H H 72 9.110 7.452 1.658 1
1 859 . 20 1 1 A 94 94 VAL HA H 72 4.080 4.573 -0.493 1
1 864 . 20 1 1 A 94 94 VAL C C 72 171.160 175.893 -4.733 1
1 865 . 20 1 1 A 94 94 VAL CA C 72 61.350 55.521 5.829 1
1 866 . 20 1 1 A 94 94 VAL CB C 72 34.640 33.642 0.998 1
1 868 . 20 1 1 A 94 94 VAL N N 72 128.650 117.739 10.911 1
1 869 . 20 1 1 A 95 95 ILE H H 73 8.150 8.299 -0.149 1
1 870 . 20 1 1 A 95 95 ILE HA H 73 4.500 4.341 0.159 1
1 880 . 20 1 1 A 95 95 ILE C C 73 174.320 175.701 -1.381 1
1 881 . 20 1 1 A 95 95 ILE CA C 73 60.170 61.065 -0.895 1
1 882 . 20 1 1 A 95 95 ILE CB C 73 38.120 38.109 0.011 1
1 886 . 20 1 1 A 95 95 ILE N N 73 125.560 118.999 6.561 1
1 887 . 20 1 1 A 96 96 LYS H H 74 9.280 8.742 0.538 1
1 888 . 20 1 1 A 96 96 LYS HA H 74 4.240 4.117 0.123 1
1 891 . 20 1 1 A 96 96 LYS C C 74 173.510 176.882 -3.372 1
1 892 . 20 1 1 A 96 96 LYS CA C 74 56.730 55.598 1.132 1
1 893 . 20 1 1 A 96 96 LYS CB C 74 33.100 41.556 -8.456 1
1 894 . 20 1 1 A 96 96 LYS N N 74 129.290 128.277 1.013 1
1 895 . 20 1 1 A 97 97 THR H H 75 8.040 8.681 -0.641 1
1 896 . 20 1 1 A 97 97 THR HA H 75 4.230 4.487 -0.257 1
1 901 . 20 1 1 A 97 97 THR C C 75 171.800 177.595 -5.795 1
1 902 . 20 1 1 A 97 97 THR CA C 75 61.760 55.614 6.146 1
1 903 . 20 1 1 A 97 97 THR CB C 75 69.830 33.352 36.478 1
1 905 . 20 1 1 A 97 97 THR N N 75 114.420 124.670 -10.250 1
1 906 . 20 1 1 A 98 98 GLN H H 76 8.400 9.012 -0.612 1
1 907 . 20 1 1 A 98 98 GLN HA H 76 4.210 4.318 -0.108 1
1 914 . 20 1 1 A 98 98 GLN CA C 76 55.880 56.563 -0.683 1
1 915 . 20 1 1 A 98 98 GLN CB C 76 29.700 39.751 -10.051 1
1 917 . 20 1 1 A 98 98 GLN N N 76 122.370 121.880 0.490 1
1 919 . 20 1 1 A 99 99 ASN HA H 77 4.590 4.115 0.475 1
1 924 . 20 1 1 A 99 99 ASN C C 77 171.780 175.946 -4.166 1
1 925 . 20 1 1 A 99 99 ASN CA C 77 53.300 58.757 -5.457 1
1 926 . 20 1 1 A 99 99 ASN CB C 77 38.920 28.073 10.847 1
1 928 . 20 1 1 A 100 100 ARG H H 78 8.160 8.007 0.153 1
1 929 . 20 1 1 A 100 100 ARG HA H 78 4.560 4.856 -0.296 1
1 936 . 20 1 1 A 100 100 ARG CA C 78 53.860 53.146 0.714 1
1 937 . 20 1 1 A 100 100 ARG CB C 78 30.210 41.699 -11.489 1
1 940 . 20 1 1 A 100 100 ARG N N 78 122.840 117.517 5.323 1
1 941 . 20 1 1 A 101 101 PRO HA H 79 4.150 4.544 -0.394 1
1 948 . 20 1 1 A 101 101 PRO CA C 79 64.770 61.043 3.727 1
1 949 . 20 1 1 A 101 101 PRO CB C 79 32.040 70.847 -38.807 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 50 3.823 1
2 1 1 1 "RMS(OBS, PRED)" CA 54 5.976 1
3 1 1 1 "RMS(OBS, PRED)" CB 50 19.838 1
4 1 1 1 "RMS(OBS, PRED)" H 49 0.903 1
5 1 1 1 "RMS(OBS, PRED)" HA 50 0.704 1
6 1 1 1 "RMS(OBS, PRED)" N 51 8.136 1
7 1 2 1 "RMS(OBS, PRED)" C 50 3.812 1
8 1 2 1 "RMS(OBS, PRED)" CA 54 6.003 1
9 1 2 1 "RMS(OBS, PRED)" CB 50 19.974 1
10 1 2 1 "RMS(OBS, PRED)" H 49 0.888 1
11 1 2 1 "RMS(OBS, PRED)" HA 50 0.664 1
12 1 2 1 "RMS(OBS, PRED)" N 51 8.291 1
13 1 3 1 "RMS(OBS, PRED)" C 50 3.870 1
14 1 3 1 "RMS(OBS, PRED)" CA 54 5.960 1
15 1 3 1 "RMS(OBS, PRED)" CB 50 20.037 1
16 1 3 1 "RMS(OBS, PRED)" H 49 0.902 1
17 1 3 1 "RMS(OBS, PRED)" HA 50 0.697 1
18 1 3 1 "RMS(OBS, PRED)" N 51 8.256 1
19 1 4 1 "RMS(OBS, PRED)" C 50 3.925 1
20 1 4 1 "RMS(OBS, PRED)" CA 54 6.057 1
21 1 4 1 "RMS(OBS, PRED)" CB 50 19.904 1
22 1 4 1 "RMS(OBS, PRED)" H 49 0.895 1
23 1 4 1 "RMS(OBS, PRED)" HA 50 0.701 1
24 1 4 1 "RMS(OBS, PRED)" N 51 8.307 1
25 1 5 1 "RMS(OBS, PRED)" C 50 3.890 1
26 1 5 1 "RMS(OBS, PRED)" CA 54 6.116 1
27 1 5 1 "RMS(OBS, PRED)" CB 50 19.984 1
28 1 5 1 "RMS(OBS, PRED)" H 49 0.921 1
29 1 5 1 "RMS(OBS, PRED)" HA 50 0.733 1
30 1 5 1 "RMS(OBS, PRED)" N 51 8.426 1
31 1 6 1 "RMS(OBS, PRED)" C 50 3.748 1
32 1 6 1 "RMS(OBS, PRED)" CA 54 5.915 1
33 1 6 1 "RMS(OBS, PRED)" CB 50 19.962 1
34 1 6 1 "RMS(OBS, PRED)" H 49 0.846 1
35 1 6 1 "RMS(OBS, PRED)" HA 50 0.726 1
36 1 6 1 "RMS(OBS, PRED)" N 51 8.124 1
37 1 7 1 "RMS(OBS, PRED)" C 50 3.830 1
38 1 7 1 "RMS(OBS, PRED)" CA 54 6.023 1
39 1 7 1 "RMS(OBS, PRED)" CB 50 19.833 1
40 1 7 1 "RMS(OBS, PRED)" H 49 0.865 1
41 1 7 1 "RMS(OBS, PRED)" HA 50 0.740 1
42 1 7 1 "RMS(OBS, PRED)" N 51 8.351 1
43 1 8 1 "RMS(OBS, PRED)" C 50 3.872 1
44 1 8 1 "RMS(OBS, PRED)" CA 54 6.029 1
45 1 8 1 "RMS(OBS, PRED)" CB 50 19.879 1
46 1 8 1 "RMS(OBS, PRED)" H 49 0.904 1
47 1 8 1 "RMS(OBS, PRED)" HA 50 0.716 1
48 1 8 1 "RMS(OBS, PRED)" N 51 8.476 1
49 1 9 1 "RMS(OBS, PRED)" C 50 3.880 1
50 1 9 1 "RMS(OBS, PRED)" CA 54 6.047 1
51 1 9 1 "RMS(OBS, PRED)" CB 50 19.861 1
52 1 9 1 "RMS(OBS, PRED)" H 49 0.856 1
53 1 9 1 "RMS(OBS, PRED)" HA 50 0.711 1
54 1 9 1 "RMS(OBS, PRED)" N 51 8.322 1
55 1 10 1 "RMS(OBS, PRED)" C 50 3.822 1
56 1 10 1 "RMS(OBS, PRED)" CA 54 5.988 1
57 1 10 1 "RMS(OBS, PRED)" CB 50 19.947 1
58 1 10 1 "RMS(OBS, PRED)" H 49 0.897 1
59 1 10 1 "RMS(OBS, PRED)" HA 50 0.698 1
60 1 10 1 "RMS(OBS, PRED)" N 51 8.232 1
61 1 11 1 "RMS(OBS, PRED)" C 50 3.862 1
62 1 11 1 "RMS(OBS, PRED)" CA 54 5.973 1
63 1 11 1 "RMS(OBS, PRED)" CB 50 20.032 1
64 1 11 1 "RMS(OBS, PRED)" H 49 0.860 1
65 1 11 1 "RMS(OBS, PRED)" HA 50 0.737 1
66 1 11 1 "RMS(OBS, PRED)" N 51 8.206 1
67 1 12 1 "RMS(OBS, PRED)" C 50 3.881 1
68 1 12 1 "RMS(OBS, PRED)" CA 54 6.011 1
69 1 12 1 "RMS(OBS, PRED)" CB 50 19.931 1
70 1 12 1 "RMS(OBS, PRED)" H 49 0.874 1
71 1 12 1 "RMS(OBS, PRED)" HA 50 0.734 1
72 1 12 1 "RMS(OBS, PRED)" N 51 8.128 1
73 1 13 1 "RMS(OBS, PRED)" C 50 3.811 1
74 1 13 1 "RMS(OBS, PRED)" CA 54 5.996 1
75 1 13 1 "RMS(OBS, PRED)" CB 50 20.002 1
76 1 13 1 "RMS(OBS, PRED)" H 49 0.874 1
77 1 13 1 "RMS(OBS, PRED)" HA 50 0.749 1
78 1 13 1 "RMS(OBS, PRED)" N 51 7.953 1
79 1 14 1 "RMS(OBS, PRED)" C 50 3.862 1
80 1 14 1 "RMS(OBS, PRED)" CA 54 6.002 1
81 1 14 1 "RMS(OBS, PRED)" CB 50 19.953 1
82 1 14 1 "RMS(OBS, PRED)" H 49 0.921 1
83 1 14 1 "RMS(OBS, PRED)" HA 50 0.728 1
84 1 14 1 "RMS(OBS, PRED)" N 51 8.209 1
85 1 15 1 "RMS(OBS, PRED)" C 50 3.896 1
86 1 15 1 "RMS(OBS, PRED)" CA 54 6.021 1
87 1 15 1 "RMS(OBS, PRED)" CB 50 19.926 1
88 1 15 1 "RMS(OBS, PRED)" H 49 0.891 1
89 1 15 1 "RMS(OBS, PRED)" HA 50 0.719 1
90 1 15 1 "RMS(OBS, PRED)" N 51 8.094 1
91 1 16 1 "RMS(OBS, PRED)" C 50 3.822 1
92 1 16 1 "RMS(OBS, PRED)" CA 54 5.975 1
93 1 16 1 "RMS(OBS, PRED)" CB 50 19.918 1
94 1 16 1 "RMS(OBS, PRED)" H 49 0.874 1
95 1 16 1 "RMS(OBS, PRED)" HA 50 0.708 1
96 1 16 1 "RMS(OBS, PRED)" N 51 7.981 1
97 1 17 1 "RMS(OBS, PRED)" C 50 3.829 1
98 1 17 1 "RMS(OBS, PRED)" CA 54 5.926 1
99 1 17 1 "RMS(OBS, PRED)" CB 50 19.831 1
100 1 17 1 "RMS(OBS, PRED)" H 49 0.847 1
101 1 17 1 "RMS(OBS, PRED)" HA 50 0.756 1
102 1 17 1 "RMS(OBS, PRED)" N 51 7.947 1
103 1 18 1 "RMS(OBS, PRED)" C 50 3.764 1
104 1 18 1 "RMS(OBS, PRED)" CA 54 6.116 1
105 1 18 1 "RMS(OBS, PRED)" CB 50 19.879 1
106 1 18 1 "RMS(OBS, PRED)" H 49 0.871 1
107 1 18 1 "RMS(OBS, PRED)" HA 50 0.736 1
108 1 18 1 "RMS(OBS, PRED)" N 51 8.393 1
109 1 19 1 "RMS(OBS, PRED)" C 50 3.861 1
110 1 19 1 "RMS(OBS, PRED)" CA 54 6.072 1
111 1 19 1 "RMS(OBS, PRED)" CB 50 19.957 1
112 1 19 1 "RMS(OBS, PRED)" H 49 0.878 1
113 1 19 1 "RMS(OBS, PRED)" HA 50 0.736 1
114 1 19 1 "RMS(OBS, PRED)" N 51 8.196 1
115 1 20 1 "RMS(OBS, PRED)" C 50 3.893 1
116 1 20 1 "RMS(OBS, PRED)" CA 54 5.988 1
117 1 20 1 "RMS(OBS, PRED)" CB 50 19.908 1
118 1 20 1 "RMS(OBS, PRED)" H 49 0.851 1
119 1 20 1 "RMS(OBS, PRED)" HA 50 0.701 1
120 1 20 1 "RMS(OBS, PRED)" N 51 8.269 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
1 289 . 1 1 A 46 46 SER H H 24 8.950 8.464 0.486 2
1 290 . 1 1 A 46 46 SER HA H 24 4.900 4.558 0.342 2
1 293 . 1 1 A 46 46 SER C C 24 170.890 176.025 -5.135 2
1 294 . 1 1 A 46 46 SER CA C 24 56.980 55.740 1.240 2
1 295 . 1 1 A 46 46 SER CB C 24 65.590 33.934 31.656 2
1 296 . 1 1 A 46 46 SER N N 24 120.420 121.538 -1.118 2
1 297 . 1 1 A 47 47 VAL H H 25 9.140 8.300 0.840 2
1 298 . 1 1 A 47 47 VAL HA H 25 3.440 4.350 -0.910 2
1 306 . 1 1 A 47 47 VAL C C 25 175.060 175.706 -0.646 2
1 307 . 1 1 A 47 47 VAL CA C 25 67.250 61.137 6.113 2
1 308 . 1 1 A 47 47 VAL CB C 25 30.780 39.499 -8.719 2
1 311 . 1 1 A 47 47 VAL N N 25 123.970 126.039 -2.069 2
1 312 . 1 1 A 48 48 GLN H H 26 8.540 8.629 -0.089 2
1 313 . 1 1 A 48 48 GLN HA H 26 4.070 4.752 -0.682 2
1 320 . 1 1 A 48 48 GLN CA C 26 60.230 54.650 5.580 2
1 321 . 1 1 A 48 48 GLN CB C 26 28.490 32.836 -4.346 2
1 323 . 1 1 A 48 48 GLN N N 26 120.550 127.326 -6.776 2
1 325 . 1 1 A 49 49 GLN HA H 27 3.950 4.873 -0.923 2
1 332 . 1 1 A 49 49 GLN C C 27 176.230 175.367 0.863 2
1 333 . 1 1 A 49 49 GLN CA C 27 58.710 55.739 2.971 2
1 334 . 1 1 A 49 49 GLN CB C 27 28.820 32.098 -3.278 2
1 337 . 1 1 A 50 50 PHE H H 28 8.050 8.750 -0.700 2
1 338 . 1 1 A 50 50 PHE HA H 28 4.620 4.610 0.010 2
1 345 . 1 1 A 50 50 PHE C C 28 175.190 175.473 -0.283 2
1 346 . 1 1 A 50 50 PHE CA C 28 58.030 61.773 -3.743 2
1 347 . 1 1 A 50 50 PHE CB C 28 39.190 32.309 6.881 2
1 350 . 1 1 A 50 50 PHE N N 28 121.710 125.296 -3.586 2
1 351 . 1 1 A 51 51 LYS H H 29 8.940 8.600 0.340 2
1 352 . 1 1 A 51 51 LYS HA H 29 3.340 4.785 -1.445 2
1 361 . 1 1 A 51 51 LYS C C 29 175.370 174.354 1.016 2
1 362 . 1 1 A 51 51 LYS CA C 29 60.660 62.649 -1.989 2
1 363 . 1 1 A 51 51 LYS CB C 29 33.190 69.861 -36.671 2
1 367 . 1 1 A 51 51 LYS N N 29 117.530 123.134 -5.604 2
1 368 . 1 1 A 52 52 GLU H H 30 7.700 9.271 -1.571 2
1 369 . 1 1 A 52 52 GLU HA H 30 3.750 4.851 -1.101 2
1 374 . 1 1 A 52 52 GLU C C 30 176.780 174.242 2.538 2
1 375 . 1 1 A 52 52 GLU CA C 30 59.890 61.246 -1.356 2
1 376 . 1 1 A 52 52 GLU CB C 30 28.840 34.320 -5.480 2
1 378 . 1 1 A 52 52 GLU N N 30 118.820 127.106 -8.286 2
1 379 . 1 1 A 53 53 GLU H H 31 7.370 9.114 -1.744 2
1 380 . 1 1 A 53 53 GLU HA H 31 4.150 5.045 -0.895 2
1 385 . 1 1 A 53 53 GLU C C 31 177.040 175.922 1.118 2
1 386 . 1 1 A 53 53 GLU CA C 31 58.860 55.022 3.838 2
1 387 . 1 1 A 53 53 GLU CB C 31 29.200 34.373 -5.173 2
1 389 . 1 1 A 53 53 GLU N N 31 119.150 128.956 -9.806 2
1 390 . 1 1 A 54 54 ILE H H 32 8.000 8.630 -0.630 2
1 391 . 1 1 A 54 54 ILE HA H 32 3.550 5.012 -1.462 2
1 401 . 1 1 A 54 54 ILE C C 32 175.420 174.067 1.353 2
1 402 . 1 1 A 54 54 ILE CA C 32 64.690 58.638 6.052 2
1 403 . 1 1 A 54 54 ILE CB C 32 37.820 69.980 -32.160 2
1 407 . 1 1 A 54 54 ILE N N 32 119.970 117.293 2.677 2
1 409 . 1 1 A 55 55 SER HA H 33 3.930 4.473 -0.543 2
1 412 . 1 1 A 55 55 SER C C 33 173.830 177.665 -3.835 2
1 413 . 1 1 A 55 55 SER CA C 33 61.620 64.382 -2.762 2
1 414 . 1 1 A 55 55 SER CB C 33 62.720 31.616 31.104 2
1 415 . 1 1 A 55 55 SER N N 33 115.780 136.278 -20.498 2
1 416 . 1 1 A 56 56 LYS H H 34 7.150 8.364 -1.214 2
1 417 . 1 1 A 56 56 LYS HA H 34 4.090 4.343 -0.254 2
1 424 . 1 1 A 56 56 LYS C C 34 176.080 176.585 -0.505 2
1 425 . 1 1 A 56 56 LYS CA C 34 58.950 57.664 1.286 2
1 426 . 1 1 A 56 56 LYS CB C 34 32.540 33.863 -1.323 2
1 429 . 1 1 A 56 56 LYS N N 34 119.100 116.926 2.174 2
1 430 . 1 1 A 57 57 ARG H H 35 7.530 7.815 -0.285 2
1 431 . 1 1 A 57 57 ARG HA H 35 4.110 4.684 -0.574 2
1 436 . 1 1 A 57 57 ARG C C 35 174.800 174.040 0.760 2
1 437 . 1 1 A 57 57 ARG CA C 35 57.090 55.447 1.642 2
1 438 . 1 1 A 57 57 ARG CB C 35 29.810 30.990 -1.180 2
1 440 . 1 1 A 57 57 ARG N N 35 119.370 114.056 5.314 2
1 441 . 1 1 A 58 58 PHE H H 36 8.320 8.702 -0.382 2
1 442 . 1 1 A 58 58 PHE HA H 36 4.340 5.442 -1.102 2
1 449 . 1 1 A 58 58 PHE C C 36 171.940 174.681 -2.741 2
1 450 . 1 1 A 58 58 PHE CA C 36 58.500 54.879 3.621 2
1 451 . 1 1 A 58 58 PHE CB C 36 38.130 35.924 2.206 2
1 454 . 1 1 A 58 58 PHE N N 36 113.980 118.181 -4.201 2
1 455 . 1 1 A 59 59 LYS H H 37 7.790 8.926 -1.136 2
1 456 . 1 1 A 59 59 LYS HA H 37 3.960 4.852 -0.892 2
1 463 . 1 1 A 59 59 LYS C C 37 172.670 173.959 -1.289 2
1 464 . 1 1 A 59 59 LYS CA C 37 57.140 54.885 2.255 2
1 465 . 1 1 A 59 59 LYS CB C 37 29.020 33.388 -4.368 2
1 468 . 1 1 A 59 59 LYS N N 37 118.810 121.335 -2.525 2
1 469 . 1 1 A 60 60 SER H H 38 7.750 8.578 -0.828 2
1 470 . 1 1 A 60 60 SER HA H 38 4.700 5.019 -0.319 2
1 473 . 1 1 A 60 60 SER C C 38 170.170 175.009 -4.839 2
1 474 . 1 1 A 60 60 SER CA C 38 57.130 54.975 2.155 2
1 475 . 1 1 A 60 60 SER CB C 38 66.820 32.022 34.798 2
1 476 . 1 1 A 60 60 SER N N 38 112.620 125.430 -12.810 2
1 477 . 1 1 A 61 61 HIS H H 39 8.630 9.267 -0.637 2
1 478 . 1 1 A 61 61 HIS N N 39 124.090 125.686 -1.596 2
1 479 . 1 1 A 62 62 THR HA H 40 3.610 5.233 -1.623 2
1 484 . 1 1 A 62 62 THR C C 40 174.350 176.305 -1.955 2
1 485 . 1 1 A 62 62 THR CA C 40 66.160 50.813 15.347 2
1 486 . 1 1 A 62 62 THR CB C 40 68.070 20.808 47.262 2
1 488 . 1 1 A 63 63 ASP H H 41 10.310 8.800 1.510 2
1 489 . 1 1 A 63 63 ASP HA H 41 4.420 4.951 -0.531 2
1 492 . 1 1 A 63 63 ASP C C 41 174.630 174.870 -0.240 2
1 493 . 1 1 A 63 63 ASP CA C 41 56.330 58.095 -1.765 2
1 494 . 1 1 A 63 63 ASP CB C 41 40.040 34.593 5.447 2
1 495 . 1 1 A 63 63 ASP N N 41 122.900 117.956 4.944 2
1 497 . 1 1 A 64 64 GLN HA H 42 4.270 4.561 -0.291 2
1 504 . 1 1 A 64 64 GLN C C 42 172.160 177.477 -5.317 2
1 505 . 1 1 A 64 64 GLN CA C 42 55.860 63.156 -7.296 2
1 506 . 1 1 A 64 64 GLN CB C 42 30.480 31.052 -0.572 2
1 508 . 1 1 A 64 64 GLN N N 42 115.750 138.038 -22.288 2
1 510 . 1 1 A 65 65 LEU H H 43 7.250 8.146 -0.896 2
1 511 . 1 1 A 65 65 LEU HA H 43 4.440 3.996 0.444 2
1 517 . 1 1 A 65 65 LEU C C 43 173.160 176.040 -2.880 2
1 518 . 1 1 A 65 65 LEU CA C 43 54.620 57.692 -3.072 2
1 519 . 1 1 A 65 65 LEU CB C 43 41.990 27.497 14.493 2
1 521 . 1 1 A 65 65 LEU N N 43 116.570 117.039 -0.469 2
1 522 . 1 1 A 66 66 VAL H H 44 8.690 8.003 0.687 2
1 523 . 1 1 A 66 66 VAL HA H 44 3.980 4.953 -0.973 2
1 528 . 1 1 A 66 66 VAL C C 44 171.340 175.469 -4.129 2
1 529 . 1 1 A 66 66 VAL CA C 44 61.910 53.656 8.254 2
1 530 . 1 1 A 66 66 VAL CB C 44 33.630 40.243 -6.613 2
1 532 . 1 1 A 66 66 VAL N N 44 125.260 118.138 7.122 2
1 533 . 1 1 A 67 67 LEU H H 45 8.570 7.777 0.793 2
1 534 . 1 1 A 67 67 LEU HA H 45 5.220 4.442 0.778 2
1 544 . 1 1 A 67 67 LEU C C 45 172.500 174.271 -1.771 2
1 545 . 1 1 A 67 67 LEU CA C 45 52.820 60.126 -7.306 2
1 546 . 1 1 A 67 67 LEU CB C 45 45.310 63.473 -18.163 2
1 550 . 1 1 A 67 67 LEU N N 45 126.690 116.496 10.194 2
1 551 . 1 1 A 68 68 ILE H H 46 9.040 8.675 0.365 2
1 552 . 1 1 A 68 68 ILE HA H 46 4.880 4.648 0.232 2
1 562 . 1 1 A 68 68 ILE C C 46 172.390 175.934 -3.544 2
1 563 . 1 1 A 68 68 ILE CA C 46 59.900 57.892 2.008 2
1 564 . 1 1 A 68 68 ILE CB C 46 41.940 64.863 -22.923 2
1 568 . 1 1 A 68 68 ILE N N 46 122.590 121.152 1.438 2
1 569 . 1 1 A 69 69 PHE H H 47 8.740 8.583 0.157 2
1 570 . 1 1 A 69 69 PHE N N 47 125.360 122.410 2.950 2
1 571 . 1 1 A 70 70 ALA HA H 48 3.600 4.012 -0.412 2
1 575 . 1 1 A 70 70 ALA C C 48 174.500 177.960 -3.460 2
1 576 . 1 1 A 70 70 ALA CA C 48 52.520 58.838 -6.318 2
1 577 . 1 1 A 70 70 ALA CB C 48 16.760 28.249 -11.489 2
1 578 . 1 1 A 71 71 GLY H H 49 8.210 7.669 0.541 2
1 581 . 1 1 A 71 71 GLY C C 49 170.850 178.096 -7.246 2
1 582 . 1 1 A 71 71 GLY CA C 49 45.380 57.611 -12.230 2
1 583 . 1 1 A 71 71 GLY N N 49 102.430 118.319 -15.889 2
1 584 . 1 1 A 72 72 LYS H H 50 7.840 8.147 -0.307 2
1 585 . 1 1 A 72 72 LYS HA H 50 4.530 4.063 0.467 2
1 594 . 1 1 A 72 72 LYS C C 50 171.800 177.727 -5.927 2
1 595 . 1 1 A 72 72 LYS CA C 50 54.630 61.134 -6.504 2
1 596 . 1 1 A 72 72 LYS CB C 50 34.630 39.014 -4.384 2
1 600 . 1 1 A 72 72 LYS N N 50 121.570 121.636 -0.066 2
1 601 . 1 1 A 73 73 ILE H H 51 8.250 8.190 0.060 2
1 602 . 1 1 A 73 73 ILE HA H 51 4.260 3.864 0.396 2
1 612 . 1 1 A 73 73 ILE C C 51 174.300 178.338 -4.038 2
1 613 . 1 1 A 73 73 ILE CA C 51 61.270 58.275 2.995 2
1 614 . 1 1 A 73 73 ILE CB C 51 38.150 31.239 6.911 2
1 618 . 1 1 A 73 73 ILE N N 51 122.710 118.014 4.696 2
1 619 . 1 1 A 74 74 LEU H H 52 8.540 8.257 0.283 2
1 620 . 1 1 A 74 74 LEU HA H 52 3.980 4.029 -0.049 2
1 630 . 1 1 A 74 74 LEU C C 52 173.440 179.178 -5.738 2
1 631 . 1 1 A 74 74 LEU CA C 52 54.660 59.230 -4.570 2
1 632 . 1 1 A 74 74 LEU CB C 52 41.790 29.258 12.532 2
1 636 . 1 1 A 74 74 LEU N N 52 128.360 119.053 9.307 2
1 637 . 1 1 A 75 75 LYS H H 53 8.100 7.761 0.339 2
1 638 . 1 1 A 75 75 LYS HA H 53 4.440 4.042 0.398 2
1 645 . 1 1 A 75 75 LYS C C 53 175.170 179.370 -4.200 2
1 646 . 1 1 A 75 75 LYS CA C 53 55.340 59.023 -3.683 2
1 647 . 1 1 A 75 75 LYS CB C 53 32.680 29.226 3.454 2
1 650 . 1 1 A 75 75 LYS N N 53 123.470 119.832 3.638 2
1 651 . 1 1 A 76 76 ASP H H 54 8.310 7.311 0.999 2
1 652 . 1 1 A 76 76 ASP HA H 54 4.110 3.808 0.302 2
1 655 . 1 1 A 76 76 ASP C C 54 174.270 178.052 -3.782 2
1 656 . 1 1 A 76 76 ASP CA C 54 58.140 64.978 -6.838 2
1 657 . 1 1 A 76 76 ASP CB C 54 40.760 37.268 3.492 2
1 658 . 1 1 A 76 76 ASP N N 54 121.080 121.226 -0.146 2
1 659 . 1 1 A 77 77 GLN H H 55 8.180 7.945 0.235 2
1 660 . 1 1 A 77 77 GLN HA H 55 4.360 4.301 0.059 2
1 667 . 1 1 A 77 77 GLN C C 55 173.710 176.523 -2.813 2
1 668 . 1 1 A 77 77 GLN CA C 55 56.350 61.502 -5.152 2
1 669 . 1 1 A 77 77 GLN CB C 55 28.090 62.718 -34.628 2
1 671 . 1 1 A 77 77 GLN N N 55 113.190 115.915 -2.725 2
1 673 . 1 1 A 78 78 ASP H H 56 7.770 7.847 -0.077 2
1 674 . 1 1 A 78 78 ASP HA H 56 4.700 4.083 0.617 2
1 677 . 1 1 A 78 78 ASP C C 56 173.500 178.769 -5.269 2
1 678 . 1 1 A 78 78 ASP CA C 56 54.140 58.887 -4.747 2
1 679 . 1 1 A 78 78 ASP CB C 56 42.020 31.823 10.197 2
1 680 . 1 1 A 78 78 ASP N N 56 121.910 119.640 2.270 2
1 681 . 1 1 A 79 79 THR H H 57 8.490 7.758 0.732 2
1 682 . 1 1 A 79 79 THR HA H 57 4.700 4.005 0.695 2
1 687 . 1 1 A 79 79 THR C C 57 172.840 177.919 -5.079 2
1 688 . 1 1 A 79 79 THR CA C 57 59.980 58.960 1.020 2
1 689 . 1 1 A 79 79 THR CB C 57 70.640 30.519 40.121 2
1 691 . 1 1 A 79 79 THR N N 57 108.860 119.697 -10.837 2
1 692 . 1 1 A 80 80 LEU H H 58 7.700 7.938 -0.238 2
1 693 . 1 1 A 80 80 LEU HA H 58 3.880 4.606 -0.726 2
1 703 . 1 1 A 80 80 LEU C C 58 177.370 174.797 2.573 2
1 704 . 1 1 A 80 80 LEU CA C 58 58.450 57.463 0.987 2
1 705 . 1 1 A 80 80 LEU CB C 58 39.500 39.130 0.370 2
1 709 . 1 1 A 80 80 LEU N N 58 118.820 116.141 2.679 2
1 710 . 1 1 A 81 81 SER H H 59 8.810 7.752 1.058 2
1 711 . 1 1 A 81 81 SER HA H 59 4.050 3.871 0.179 2
1 714 . 1 1 A 81 81 SER C C 59 176.150 174.654 1.496 2
1 715 . 1 1 A 81 81 SER CA C 59 61.190 57.327 3.863 2
1 716 . 1 1 A 81 81 SER CB C 59 62.490 29.236 33.254 2
1 717 . 1 1 A 81 81 SER N N 59 114.240 116.775 -2.535 2
1 718 . 1 1 A 82 82 GLN H H 60 7.950 7.706 0.244 2
1 719 . 1 1 A 82 82 GLN HA H 60 4.090 4.867 -0.777 2
1 726 . 1 1 A 82 82 GLN C C 60 173.930 173.186 0.744 2
1 727 . 1 1 A 82 82 GLN CA C 60 58.080 57.271 0.809 2
1 728 . 1 1 A 82 82 GLN CB C 60 28.460 65.671 -37.211 2
1 730 . 1 1 A 82 82 GLN N N 60 122.620 114.037 8.583 2
1 732 . 1 1 A 83 83 HIS H H 61 6.990 8.686 -1.696 2
1 733 . 1 1 A 83 83 HIS HA H 61 4.490 4.689 -0.198 2
1 736 . 1 1 A 83 83 HIS C C 61 172.260 176.933 -4.673 2
1 737 . 1 1 A 83 83 HIS CA C 61 57.110 56.412 0.698 2
1 738 . 1 1 A 83 83 HIS CB C 61 32.780 30.883 1.897 2
1 739 . 1 1 A 83 83 HIS N N 61 116.940 123.189 -6.249 2
1 740 . 1 1 A 84 84 GLY H H 62 7.870 8.969 -1.099 2
1 743 . 1 1 A 84 84 GLY C C 62 171.040 176.148 -5.108 2
1 744 . 1 1 A 84 84 GLY CA C 62 45.390 65.797 -20.407 2
1 745 . 1 1 A 84 84 GLY N N 62 106.740 118.154 -11.414 2
1 746 . 1 1 A 85 85 ILE H H 63 6.810 8.237 -1.427 2
1 747 . 1 1 A 85 85 ILE HA H 63 3.050 4.405 -1.355 2
1 757 . 1 1 A 85 85 ILE C C 63 170.130 178.013 -7.883 2
1 758 . 1 1 A 85 85 ILE CA C 63 62.440 57.244 5.196 2
1 759 . 1 1 A 85 85 ILE CB C 63 36.110 40.999 -4.889 2
1 763 . 1 1 A 85 85 ILE N N 63 118.920 121.880 -2.960 2
1 764 . 1 1 A 86 86 HIS H H 64 6.020 7.666 -1.646 2
1 765 . 1 1 A 86 86 HIS HA H 64 5.030 4.345 0.685 2
1 768 . 1 1 A 86 86 HIS C C 64 170.090 175.919 -5.829 2
1 769 . 1 1 A 86 86 HIS CA C 64 53.500 56.820 -3.320 2
1 770 . 1 1 A 86 86 HIS CB C 64 31.860 29.268 2.592 2
1 771 . 1 1 A 86 86 HIS N N 64 122.440 116.270 6.170 2
1 772 . 1 1 A 87 87 ASP H H 65 8.340 7.388 0.952 2
1 773 . 1 1 A 87 87 ASP HA H 65 4.320 4.695 -0.375 2
1 776 . 1 1 A 87 87 ASP C C 65 174.370 175.782 -1.412 2
1 777 . 1 1 A 87 87 ASP CA C 65 56.440 53.608 2.832 2
1 778 . 1 1 A 87 87 ASP CB C 65 43.150 42.730 0.420 2
1 779 . 1 1 A 87 87 ASP N N 65 116.230 119.649 -3.419 2
1 780 . 1 1 A 88 88 GLY H H 66 9.330 8.701 0.629 2
1 783 . 1 1 A 88 88 GLY C C 66 172.330 174.526 -2.196 2
1 784 . 1 1 A 88 88 GLY CA C 66 45.270 60.020 -14.750 2
1 785 . 1 1 A 88 88 GLY N N 66 112.300 119.520 -7.220 2
1 786 . 1 1 A 89 89 LEU H H 67 7.640 8.873 -1.233 2
1 787 . 1 1 A 89 89 LEU HA H 67 4.720 4.772 -0.052 2
1 797 . 1 1 A 89 89 LEU C C 67 172.460 176.030 -3.570 2
1 798 . 1 1 A 89 89 LEU CA C 67 54.420 54.150 0.270 2
1 799 . 1 1 A 89 89 LEU CB C 67 42.260 42.731 -0.471 2
1 803 . 1 1 A 89 89 LEU N N 67 120.310 127.094 -6.784 2
1 804 . 1 1 A 90 90 THR H H 68 8.110 8.803 -0.693 2
1 805 . 1 1 A 90 90 THR HA H 68 5.300 5.320 -0.020 2
1 810 . 1 1 A 90 90 THR C C 68 170.900 174.880 -3.980 2
1 811 . 1 1 A 90 90 THR CA C 68 61.870 60.105 1.765 2
1 812 . 1 1 A 90 90 THR CB C 68 71.320 40.892 30.428 2
1 814 . 1 1 A 90 90 THR N N 68 115.300 122.281 -6.981 2
1 815 . 1 1 A 91 91 VAL H H 69 9.290 9.064 0.226 2
1 816 . 1 1 A 91 91 VAL HA H 69 4.540 4.780 -0.240 2
1 824 . 1 1 A 91 91 VAL C C 69 170.890 174.662 -3.772 2
1 825 . 1 1 A 91 91 VAL CA C 69 60.310 57.823 2.487 2
1 826 . 1 1 A 91 91 VAL CB C 69 34.680 42.602 -7.923 2
1 829 . 1 1 A 91 91 VAL N N 69 124.200 126.722 -2.522 2
1 830 . 1 1 A 92 92 HIS H H 70 8.750 8.501 0.249 2
1 831 . 1 1 A 92 92 HIS HA H 70 5.020 3.830 1.190 2
1 835 . 1 1 A 92 92 HIS C C 70 170.890 177.143 -6.253 2
1 836 . 1 1 A 92 92 HIS CA C 70 56.750 53.212 3.538 2
1 837 . 1 1 A 92 92 HIS CB C 70 32.220 17.923 14.297 2
1 839 . 1 1 A 92 92 HIS N N 70 125.250 129.111 -3.861 2
1 840 . 1 1 A 93 93 LEU H H 71 8.290 8.478 -0.188 2
1 851 . 1 1 A 93 93 LEU C C 71 172.570 173.610 -1.040 2
1 852 . 1 1 A 93 93 LEU CA C 71 52.820 45.447 7.373 2
1 857 . 1 1 A 93 93 LEU N N 71 123.360 102.901 20.459 2
1 858 . 1 1 A 94 94 VAL H H 72 9.110 7.339 1.771 2
1 859 . 1 1 A 94 94 VAL HA H 72 4.080 4.854 -0.774 2
1 864 . 1 1 A 94 94 VAL C C 72 171.160 175.325 -4.165 2
1 865 . 1 1 A 94 94 VAL CA C 72 61.350 54.442 6.908 2
1 866 . 1 1 A 94 94 VAL CB C 72 34.640 35.525 -0.885 2
1 868 . 1 1 A 94 94 VAL N N 72 128.650 115.488 13.162 2
1 869 . 1 1 A 95 95 ILE H H 73 8.150 8.250 -0.100 2
1 870 . 1 1 A 95 95 ILE HA H 73 4.500 4.565 -0.065 2
1 880 . 1 1 A 95 95 ILE C C 73 174.320 175.702 -1.382 2
1 881 . 1 1 A 95 95 ILE CA C 73 60.170 60.794 -0.625 2
1 882 . 1 1 A 95 95 ILE CB C 73 38.120 38.598 -0.478 2
1 886 . 1 1 A 95 95 ILE N N 73 125.560 119.138 6.422 2
1 887 . 1 1 A 96 96 LYS H H 74 9.280 8.766 0.514 2
1 888 . 1 1 A 96 96 LYS HA H 74 4.240 4.433 -0.193 2
1 891 . 1 1 A 96 96 LYS C C 74 173.510 176.414 -2.904 2
1 892 . 1 1 A 96 96 LYS CA C 74 56.730 54.440 2.290 2
1 893 . 1 1 A 96 96 LYS CB C 74 33.100 41.494 -8.394 2
1 894 . 1 1 A 96 96 LYS N N 74 129.290 127.659 1.631 2
1 895 . 1 1 A 97 97 THR H H 75 8.040 8.801 -0.761 2
1 896 . 1 1 A 97 97 THR HA H 75 4.230 4.631 -0.401 2
1 901 . 1 1 A 97 97 THR C C 75 171.800 177.439 -5.639 2
1 902 . 1 1 A 97 97 THR CA C 75 61.760 54.815 6.945 2
1 903 . 1 1 A 97 97 THR CB C 75 69.830 34.397 35.433 2
1 905 . 1 1 A 97 97 THR N N 75 114.420 124.146 -9.726 2
1 906 . 1 1 A 98 98 GLN H H 76 8.400 8.944 -0.544 2
1 907 . 1 1 A 98 98 GLN HA H 76 4.210 4.381 -0.171 2
1 914 . 1 1 A 98 98 GLN CA C 76 55.880 56.731 -0.851 2
1 915 . 1 1 A 98 98 GLN CB C 76 29.700 40.022 -10.322 2
1 917 . 1 1 A 98 98 GLN N N 76 122.370 121.414 0.956 2
1 919 . 1 1 A 99 99 ASN HA H 77 4.590 4.204 0.386 2
1 924 . 1 1 A 99 99 ASN C C 77 171.780 175.821 -4.041 2
1 925 . 1 1 A 99 99 ASN CA C 77 53.300 57.601 -4.301 2
1 926 . 1 1 A 99 99 ASN CB C 77 38.920 27.999 10.921 2
1 928 . 1 1 A 100 100 ARG H H 78 8.160 7.774 0.386 2
1 929 . 1 1 A 100 100 ARG HA H 78 4.560 4.973 -0.413 2
1 936 . 1 1 A 100 100 ARG CA C 78 53.860 53.174 0.686 2
1 937 . 1 1 A 100 100 ARG CB C 78 30.210 42.394 -12.184 2
1 940 . 1 1 A 100 100 ARG N N 78 122.840 120.161 2.679 2
1 941 . 1 1 A 101 101 PRO HA H 79 4.150 4.893 -0.743 2
1 948 . 1 1 A 101 101 PRO CA C 79 64.770 59.601 5.169 2
1 949 . 1 1 A 101 101 PRO CB C 79 32.040 71.572 -39.532 2
stop_
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