==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 05-MAR-10 2X83 . COMPND 2 MOLECULE: HIV-1 CAPSID; . SOURCE 2 ORGANISM_SCIENTIFIC: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1; . AUTHOR A.J.PRICE,L.C.JAMES . 618 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28818.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 396 64.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 104 16.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 5 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 26 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 58 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 174 28.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 2 0 0 2 4 2 0 0 2 1 1 0 0 1 0 0 1 2 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 4 0 7 5 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 401 A P 0 0 28 0, 0.0 12,-4.0 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 166.1 31.5 38.9 27.9 2 402 A I E +A 12 0A 42 44,-1.1 10,-0.2 10,-0.3 2,-0.2 -0.736 360.0 152.1 -82.6 133.4 31.5 37.8 31.5 3 403 A V E -A 11 0A 44 8,-3.0 8,-2.3 -2,-0.4 2,-0.4 -0.703 40.6 -96.3-147.0-178.0 34.7 35.8 32.1 4 404 A Q E -A 10 0A 116 6,-0.2 6,-0.2 -2,-0.2 2,-0.1 -0.963 24.5-139.6-118.5 145.7 37.1 34.9 34.9 5 405 A N > - 0 0 78 4,-3.2 3,-1.4 -2,-0.4 6,-0.0 -0.230 40.8 -89.1 -87.5-179.3 40.5 36.4 35.9 6 406 A L T 3 S+ 0 0 185 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.690 124.4 55.9 -68.9 -20.6 43.7 34.5 37.0 7 407 A Q T 3 S- 0 0 186 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.154 125.4 -97.2 -93.8 16.4 42.7 34.5 40.7 8 408 A G S < S+ 0 0 48 -3,-1.4 2,-0.3 1,-0.2 -2,-0.1 0.623 77.7 145.6 84.9 14.2 39.4 32.8 39.9 9 409 A Q - 0 0 41 1,-0.1 -4,-3.2 0, 0.0 -1,-0.2 -0.684 53.0-114.2-102.3 138.8 37.4 36.0 40.0 10 410 A M E +A 4 0A 106 -2,-0.3 2,-0.3 -6,-0.2 -6,-0.2 -0.462 44.5 165.3 -67.0 123.6 34.3 37.1 37.9 11 411 A V E -A 3 0A 52 -8,-2.3 -8,-3.0 -2,-0.2 2,-0.4 -0.993 37.7-121.8-139.9 138.7 35.1 39.9 35.6 12 412 A H E -A 2 0A 40 -2,-0.3 2,-0.5 -10,-0.2 -10,-0.3 -0.705 29.3-156.8 -74.0 140.2 33.4 41.5 32.5 13 413 A Q - 0 0 106 -12,-4.0 3,-0.1 -2,-0.4 -2,-0.0 -0.975 17.1-118.7-124.1 120.1 35.7 41.4 29.5 14 414 A A - 0 0 78 -2,-0.5 2,-0.0 1,-0.1 37,-0.0 -0.109 47.3 -84.0 -55.2 154.4 35.3 43.9 26.6 15 415 A I - 0 0 20 1,-0.1 -1,-0.1 2,-0.1 32,-0.0 -0.304 46.4-109.7 -68.6 136.3 34.5 42.3 23.2 16 416 A S >> - 0 0 63 1,-0.2 4,-2.3 -3,-0.1 3,-1.0 -0.560 16.6-143.3 -69.3 120.4 37.6 41.1 21.4 17 417 A P H 3> S+ 0 0 85 0, 0.0 4,-1.1 0, 0.0 -1,-0.2 0.510 102.7 62.4 -61.0 -0.3 38.0 43.4 18.4 18 418 A R H 3> S+ 0 0 217 2,-0.2 4,-2.1 3,-0.1 5,-0.1 0.819 102.1 45.3 -88.6 -40.6 39.2 40.2 16.7 19 419 A T H <> S+ 0 0 48 -3,-1.0 4,-2.3 2,-0.2 5,-0.1 0.924 114.7 53.6 -62.0 -39.1 35.8 38.5 17.1 20 420 A L H X S+ 0 0 21 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.892 107.6 46.9 -61.1 -47.4 34.3 41.9 15.9 21 421 A N H X S+ 0 0 107 -4,-1.1 4,-2.3 2,-0.2 -1,-0.2 0.959 110.5 53.2 -63.8 -42.9 36.4 42.0 12.8 22 422 A A H X S+ 0 0 45 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.934 113.1 45.2 -53.2 -49.8 35.5 38.3 12.0 23 423 A W H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.927 111.2 49.2 -58.1 -54.6 31.8 39.1 12.3 24 424 A V H X S+ 0 0 21 -4,-2.4 4,-1.8 1,-0.2 -1,-0.2 0.925 112.9 50.5 -56.4 -49.3 31.7 42.4 10.3 25 425 A K H X S+ 0 0 46 -4,-2.3 4,-3.6 2,-0.2 3,-0.4 0.920 106.8 53.0 -47.0 -62.9 33.6 40.6 7.6 26 426 A V H X S+ 0 0 14 -4,-2.4 4,-1.9 1,-0.3 5,-0.3 0.919 109.4 48.9 -39.0 -59.3 31.2 37.7 7.5 27 427 A V H < S+ 0 0 0 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.870 117.3 42.6 -56.6 -35.4 28.2 40.0 7.1 28 428 A E H < S+ 0 0 90 -4,-1.8 -2,-0.2 -3,-0.4 -1,-0.2 0.867 119.6 41.1 -83.0 -34.2 30.1 41.8 4.3 29 429 A E H < S+ 0 0 164 -4,-3.6 -3,-0.2 1,-0.2 -2,-0.2 0.991 127.2 31.6 -70.1 -63.6 31.5 38.6 2.5 30 430 A K S >< S- 0 0 89 -4,-1.9 3,-0.9 1,-0.3 2,-0.4 0.422 90.4-156.0 -71.0 3.1 28.4 36.5 2.7 31 431 A A T 3 S- 0 0 45 -5,-0.3 -1,-0.3 1,-0.2 -2,-0.1 -0.434 74.4 -33.4 43.5-109.6 26.1 39.6 2.5 32 432 A F T 3 S+ 0 0 4 -2,-0.4 -1,-0.2 -3,-0.1 113,-0.2 -0.526 91.1 152.2-135.1 66.9 23.2 37.8 4.3 33 433 A S X - 0 0 29 -3,-0.9 3,-2.3 -2,-0.1 4,-0.2 -0.625 64.0 -96.0 -80.7 156.6 23.6 34.2 3.2 34 434 A P T > S+ 0 0 55 0, 0.0 3,-1.6 0, 0.0 108,-0.1 0.762 116.6 73.0 -52.8 -30.0 22.3 31.6 5.7 35 435 A E T 3> S+ 0 0 106 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.595 76.7 77.2 -64.8 -10.3 25.7 31.0 7.2 36 436 A V H <> S+ 0 0 0 -3,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.784 88.3 61.1 -65.5 -24.3 25.8 34.4 9.0 37 437 A I H <> S+ 0 0 20 -3,-1.6 4,-2.5 -4,-0.2 5,-0.2 0.975 105.0 41.2 -72.5 -55.2 23.4 33.0 11.7 38 438 A P H > S+ 0 0 66 0, 0.0 4,-3.2 0, 0.0 -1,-0.2 0.904 115.2 55.8 -57.2 -39.5 25.6 30.2 13.1 39 439 A M H X S+ 0 0 60 -4,-1.4 4,-3.2 2,-0.2 -2,-0.2 0.942 106.5 48.7 -54.4 -49.4 28.5 32.6 12.8 40 440 A F H X S+ 0 0 0 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.933 113.0 46.9 -59.7 -46.8 26.7 35.1 15.0 41 441 A S H >< S+ 0 0 40 -4,-2.5 3,-0.6 2,-0.2 4,-0.3 0.964 114.2 48.4 -56.6 -51.8 25.9 32.5 17.6 42 442 A A H >< S+ 0 0 49 -4,-3.2 3,-1.1 1,-0.2 -2,-0.2 0.959 115.7 43.9 -49.7 -55.7 29.5 31.2 17.5 43 443 A L H 3< S+ 0 0 39 -4,-3.2 -1,-0.2 1,-0.2 -2,-0.2 0.639 111.4 53.5 -71.0 -17.2 30.9 34.7 17.8 44 444 A S T X< + 0 0 2 -4,-1.5 3,-2.2 -3,-0.6 -1,-0.2 0.175 67.8 145.9-109.8 16.8 28.6 36.0 20.6 45 445 A E T < S+ 0 0 117 -3,-1.1 -3,-0.0 -4,-0.3 -4,-0.0 -0.299 79.1 4.3 -55.6 130.9 28.9 33.3 23.3 46 446 A G T 3 S+ 0 0 35 1,-0.2 -44,-1.1 -45,-0.1 -1,-0.3 0.520 94.8 162.1 69.8 8.6 28.6 34.8 26.8 47 447 A A < - 0 0 2 -3,-2.2 -1,-0.2 -46,-0.2 84,-0.1 -0.216 32.8-142.4 -67.8 141.2 27.8 38.3 25.3 48 448 A T > - 0 0 0 1,-0.1 4,-2.3 79,-0.1 5,-0.2 -0.602 34.4-104.2 -83.1 161.8 26.2 41.1 27.3 49 449 A P H > S+ 0 0 0 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.899 124.5 56.6 -53.9 -40.7 23.7 43.3 25.6 50 450 A Q H > S+ 0 0 83 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.950 107.7 48.0 -53.4 -49.2 26.4 46.0 25.4 51 451 A D H > S+ 0 0 3 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.902 109.5 53.4 -59.4 -42.5 28.7 43.6 23.6 52 452 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.918 108.8 48.7 -57.8 -47.0 25.9 42.6 21.2 53 453 A N H X S+ 0 0 35 -4,-2.4 4,-3.5 2,-0.2 5,-0.2 0.894 106.9 55.7 -63.0 -35.5 25.3 46.2 20.3 54 454 A T H X S+ 0 0 50 -4,-2.0 4,-1.2 1,-0.2 -2,-0.2 0.954 108.9 49.6 -62.5 -42.4 29.0 46.8 19.7 55 455 A M H >< S+ 0 0 2 -4,-2.3 3,-0.6 1,-0.2 4,-0.4 0.945 115.7 40.4 -55.4 -54.7 28.7 43.9 17.2 56 456 A L H >< S+ 0 0 17 -4,-2.3 3,-1.5 1,-0.2 -2,-0.2 0.887 109.0 59.4 -67.0 -39.0 25.7 45.3 15.4 57 457 A N H 3< S+ 0 0 128 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.738 99.4 60.2 -64.1 -24.5 26.9 48.9 15.5 58 458 A T T << S+ 0 0 59 -4,-1.2 2,-0.3 -3,-0.6 -1,-0.3 0.633 72.7 113.9 -77.6 -16.5 30.1 47.9 13.5 59 459 A V < - 0 0 15 -3,-1.5 2,-0.5 -4,-0.4 -34,-0.0 -0.445 65.8-137.7 -67.9 120.2 28.2 46.6 10.5 60 460 A G - 0 0 41 -2,-0.3 2,-0.1 -36,-0.1 -1,-0.1 -0.704 57.8 -35.1 -94.9 124.1 29.1 48.9 7.7 61 461 A G S S+ 0 0 54 -2,-0.5 5,-0.1 1,-0.1 -2,-0.0 -0.419 78.5 125.3 58.3-136.2 26.3 50.0 5.5 62 462 A H > + 0 0 69 -2,-0.1 4,-2.9 3,-0.1 5,-0.3 0.873 39.1 165.7 46.7 41.0 23.7 47.3 4.8 63 463 A Q H > + 0 0 167 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.866 65.6 49.4 -54.6 -46.4 21.4 50.1 6.1 64 464 A A H > S+ 0 0 62 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.909 113.8 45.7 -60.4 -46.9 18.2 48.5 4.8 65 465 A A H > S+ 0 0 1 2,-0.2 4,-2.3 1,-0.2 3,-0.3 0.934 112.1 50.5 -63.9 -47.9 19.0 45.1 6.4 66 466 A M H X S+ 0 0 25 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.872 108.4 54.0 -60.9 -32.4 20.1 46.7 9.7 67 467 A Q H X S+ 0 0 82 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.877 106.1 51.3 -69.3 -36.2 16.9 48.6 9.8 68 468 A M H X S+ 0 0 29 -4,-1.6 4,-1.9 -3,-0.3 -2,-0.2 0.893 111.6 50.0 -61.6 -41.3 14.9 45.2 9.4 69 469 A L H X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.933 108.8 49.5 -68.1 -44.8 16.9 43.9 12.2 70 470 A K H X S+ 0 0 119 -4,-2.7 4,-2.8 1,-0.2 -1,-0.2 0.901 108.0 54.8 -59.8 -41.6 16.2 46.9 14.4 71 471 A E H X S+ 0 0 86 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.926 109.0 48.9 -59.0 -39.3 12.5 46.7 13.7 72 472 A T H X S+ 0 0 9 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.937 109.7 49.8 -65.6 -46.7 12.6 43.1 14.9 73 473 A I H X S+ 0 0 12 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.922 111.2 50.7 -52.9 -48.5 14.4 43.9 18.1 74 474 A N H X S+ 0 0 103 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.904 109.5 49.3 -60.9 -41.4 11.8 46.7 18.8 75 475 A E H X S+ 0 0 111 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.905 113.4 47.3 -65.7 -39.0 8.8 44.3 18.2 76 476 A E H X S+ 0 0 61 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.868 109.3 53.1 -71.4 -36.6 10.4 41.7 20.5 77 477 A A H X S+ 0 0 12 -4,-2.5 4,-2.3 2,-0.2 24,-0.4 0.900 109.6 49.4 -64.9 -39.7 11.2 44.3 23.2 78 478 A A H X S+ 0 0 56 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.912 110.4 50.2 -65.3 -39.1 7.6 45.5 23.2 79 479 A E H X S+ 0 0 75 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.887 107.6 53.6 -64.6 -39.0 6.4 41.9 23.5 80 480 A W H X S+ 0 0 33 -4,-2.1 4,-1.3 2,-0.2 -1,-0.2 0.951 109.8 47.8 -60.6 -48.1 8.7 41.3 26.4 81 481 A D H >< S+ 0 0 56 -4,-2.3 3,-0.8 1,-0.2 -2,-0.2 0.938 109.6 53.3 -57.1 -45.0 7.2 44.4 28.2 82 482 A R H 3< S+ 0 0 139 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.856 114.6 41.5 -57.6 -41.7 3.6 43.2 27.4 83 483 A L H 3< S+ 0 0 101 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.531 115.5 51.0 -82.4 -12.3 4.4 39.8 29.0 84 484 A H S << S- 0 0 64 -4,-1.3 -1,-0.2 -3,-0.8 -2,-0.1 -0.615 73.9-172.3-130.2 70.8 6.4 41.1 32.0 85 485 A P - 0 0 93 0, 0.0 2,-0.2 0, 0.0 -3,-0.1 -0.386 30.6-107.7 -64.9 142.7 4.3 43.9 33.7 86 486 A V - 0 0 64 163,-0.2 2,-0.2 1,-0.1 11,-0.0 -0.491 25.4-126.7 -73.7 134.9 6.1 45.8 36.5 87 487 A H - 0 0 114 -2,-0.2 132,-0.1 1,-0.1 2,-0.1 -0.569 34.1-109.0 -74.4 144.3 5.1 45.1 40.1 88 488 A A S S+ 0 0 14 130,-1.4 161,-0.3 -2,-0.2 160,-0.2 -0.469 71.6 51.6 -74.0 150.7 4.3 48.4 42.0 89 489 A G S S- 0 0 11 159,-3.0 158,-0.1 158,-0.6 2,-0.1 -0.251 86.5 -48.6 111.4 164.7 6.5 49.8 44.7 90 490 A P - 0 0 0 0, 0.0 2,-0.2 0, 0.0 117,-0.1 -0.343 61.0-100.9 -75.5 145.4 10.1 50.8 45.4 91 491 A I - 0 0 76 1,-0.1 6,-0.1 -2,-0.1 3,-0.1 -0.492 43.6-123.4 -67.9 127.3 13.0 48.5 44.6 92 492 A A > - 0 0 7 -2,-0.2 3,-1.7 1,-0.1 -1,-0.1 -0.325 35.0 -80.5 -76.5 154.9 14.2 46.7 47.7 93 493 A P T 3 S+ 0 0 65 0, 0.0 202,-0.2 0, 0.0 -1,-0.1 -0.247 117.3 13.9 -50.8 134.6 17.7 46.9 49.1 94 494 A G T 3 S+ 0 0 80 1,-0.2 2,-0.3 -3,-0.1 -2,-0.1 0.706 109.5 100.5 63.1 24.2 20.0 44.4 47.3 95 495 A Q < - 0 0 100 -3,-1.7 2,-0.3 -4,-0.0 -1,-0.2 -0.917 60.9-138.6-126.4 160.1 17.5 43.8 44.4 96 496 A M - 0 0 55 -2,-0.3 -4,-0.1 -3,-0.1 2,-0.0 -0.810 30.1 -95.0-112.0 159.4 17.3 45.2 40.9 97 497 A R - 0 0 69 -2,-0.3 -1,-0.1 1,-0.1 3,-0.0 -0.360 50.9 -99.8 -57.4 150.3 14.4 46.4 38.9 98 498 A E - 0 0 65 -11,-0.1 -1,-0.1 1,-0.1 2,-0.1 -0.643 51.1-100.8 -75.9 135.3 13.0 43.8 36.6 99 499 A P - 0 0 4 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.333 30.9-147.4 -63.6 138.2 14.4 44.4 33.2 100 500 A R >> - 0 0 53 -2,-0.1 4,-2.3 1,-0.1 3,-0.7 -0.495 35.1 -98.8 -90.2 167.1 12.3 46.1 30.5 101 501 A G H 3> S+ 0 0 0 -24,-0.4 4,-2.1 1,-0.3 5,-0.1 0.896 127.2 51.1 -53.5 -42.2 12.6 45.2 26.9 102 502 A S H 34>S+ 0 0 46 1,-0.2 6,-1.5 2,-0.2 5,-1.1 0.737 107.0 54.7 -69.3 -25.0 14.8 48.3 26.3 103 503 A D H X45S+ 0 0 2 -3,-0.7 3,-1.1 5,-0.2 -1,-0.2 0.883 108.7 48.1 -68.5 -44.4 17.0 47.1 29.3 104 504 A I H 3<5S+ 0 0 0 -4,-2.3 -2,-0.2 1,-0.2 26,-0.2 0.885 109.5 51.9 -63.6 -40.0 17.4 43.8 27.6 105 505 A A T 3<5S- 0 0 5 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.422 116.3-116.8 -77.7 1.8 18.3 45.4 24.3 106 506 A G T < 5S+ 0 0 14 -3,-1.1 3,-0.5 -5,-0.1 -3,-0.2 0.225 85.0 110.5 89.3 -10.8 20.9 47.6 26.1 107 507 A T S - 0 0 68 -2,-0.4 4,-2.7 1,-0.1 5,-0.1 -0.475 28.4-111.1 -84.7 159.3 24.1 49.9 32.1 111 511 A L H > S+ 0 0 22 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.910 120.1 53.2 -49.0 -44.4 26.7 47.2 31.7 112 512 A Q H > S+ 0 0 131 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.896 108.3 47.3 -70.6 -38.1 26.7 46.8 35.5 113 513 A E H > S+ 0 0 55 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.911 111.4 53.7 -61.9 -42.6 22.9 46.2 35.6 114 514 A Q H X S+ 0 0 2 -4,-2.7 4,-2.1 1,-0.2 12,-0.3 0.956 110.3 46.0 -53.6 -53.0 23.3 43.7 32.7 115 515 A I H X S+ 0 0 23 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.838 109.6 55.3 -60.2 -40.6 25.9 41.8 34.6 116 516 A G H < S+ 0 0 24 -4,-2.1 -1,-0.2 2,-0.2 -2,-0.2 0.891 110.7 43.9 -57.5 -44.5 23.8 41.9 37.8 117 517 A W H >< S+ 0 0 5 -4,-2.2 7,-3.0 -3,-0.2 3,-0.7 0.902 116.2 48.2 -67.5 -41.3 20.8 40.3 36.0 118 518 A M H 3< S+ 0 0 38 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.811 116.8 39.7 -68.4 -35.6 23.0 37.7 34.2 119 519 A T T 3< S+ 0 0 68 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.115 91.7 113.7-105.8 13.5 25.0 36.6 37.3 120 520 A H S < S- 0 0 82 -3,-0.7 -3,-0.0 -4,-0.2 -4,-0.0 -0.485 74.0-104.3 -87.0 155.4 22.0 36.6 39.7 121 521 A N S S+ 0 0 111 1,-0.4 -2,-0.1 -2,-0.2 -3,-0.0 -0.962 121.5 25.7-126.6 106.1 20.7 33.4 41.2 122 522 A P S S- 0 0 86 0, 0.0 -1,-0.4 0, 0.0 2,-0.1 0.540 111.1-146.5 -78.8 148.5 18.3 32.8 39.8 123 523 A P - 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