==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-JAN-01 1HWK . COMPND 2 MOLECULE: HMG-COA REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.S.ISTVAN,J.DEISENHOFER . 1587 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 51850.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1166 73.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 34 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 263 16.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 11 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 3 0.2 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 . 106 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 161 10.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 525 33.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 39 2.5 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 6 4 8 0 1 5 1 6 10 7 0 1 0 0 4 0 0 0 0 0 0 0 0 4 0 0 0 RESIDUES PER ALPHA HELIX . 11 4 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 . 0 0 12 0 0 0 12 5 5 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 . 0 0 0 8 2 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 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 1 442 A P 0 0 135 0, 0.0 10,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 84.4 44.0 30.7 -10.0 2 443 A R - 0 0 123 1,-0.1 5,-0.1 2,-0.1 0, 0.0 -0.125 360.0 -91.7 -59.6 150.6 45.1 33.2 -7.3 3 444 A P > - 0 0 78 0, 0.0 4,-1.0 0, 0.0 3,-0.2 -0.091 37.3-108.8 -58.0 163.9 47.1 32.1 -4.2 4 445 A N T 4 S+ 0 0 59 1,-0.2 3,-0.3 2,-0.2 -2,-0.1 0.858 110.9 58.8 -67.0 -42.8 45.2 31.2 -1.0 5 446 A E T 4 S+ 0 0 198 1,-0.2 -1,-0.2 3,-0.1 -3,-0.0 0.861 107.8 50.6 -57.0 -35.5 46.1 34.2 1.3 6 447 A E T 4 S+ 0 0 115 -3,-0.2 2,-1.1 1,-0.1 -1,-0.2 0.831 84.7 98.2 -71.4 -34.2 44.5 36.5 -1.3 7 448 A C < 0 0 24 -4,-1.0 -1,-0.1 -3,-0.3 -3,-0.0 -0.432 360.0 360.0 -66.3 96.4 41.2 34.4 -1.6 8 449 A L 0 0 211 -2,-1.1 -1,-0.2 2,-0.0 -3,-0.1 0.101 360.0 360.0 -53.1 360.0 38.8 36.3 0.7 9 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 10 462 A L 0 0 155 0, 0.0 4,-0.1 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 150.5 35.1 33.8 -6.3 11 463 A S > - 0 0 52 3,-0.1 4,-1.7 2,-0.1 3,-0.3 0.693 360.0-123.9 80.7 121.4 36.0 31.3 -9.0 12 464 A D H > S+ 0 0 50 1,-0.2 4,-2.4 2,-0.2 3,-0.5 0.938 109.3 54.9 -57.3 -53.8 35.3 27.5 -8.7 13 465 A A H > S+ 0 0 57 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.830 110.0 49.5 -51.2 -34.2 39.0 26.4 -9.1 14 466 A E H > S+ 0 0 7 -3,-0.3 4,-1.6 2,-0.2 -1,-0.3 0.851 107.0 51.8 -76.0 -37.5 39.9 28.7 -6.3 15 467 A I H X S+ 0 0 15 -4,-1.7 4,-2.7 -3,-0.5 3,-0.2 0.938 108.6 53.0 -63.7 -44.1 37.3 27.5 -3.9 16 468 A I H X S+ 0 0 25 -4,-2.4 4,-2.5 1,-0.3 -1,-0.2 0.872 107.0 52.0 -57.8 -39.3 38.4 23.9 -4.5 17 469 A Q H X S+ 0 0 69 -4,-1.3 4,-2.3 -5,-0.2 -1,-0.3 0.856 111.0 47.4 -67.0 -35.6 42.0 25.0 -3.7 18 470 A L H X S+ 0 0 51 -4,-1.6 4,-2.7 -3,-0.2 6,-0.4 0.891 111.1 51.8 -71.1 -40.2 40.8 26.5 -0.4 19 471 A V H < S+ 0 0 20 -4,-2.7 4,-0.4 2,-0.2 5,-0.3 0.923 115.3 40.5 -61.8 -47.0 38.8 23.4 0.4 20 472 A N H < S+ 0 0 71 -4,-2.5 3,-0.2 -5,-0.2 -2,-0.2 0.938 119.7 44.5 -68.6 -47.1 41.7 21.1 -0.1 21 473 A A H < S+ 0 0 52 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.906 120.8 36.3 -66.2 -48.6 44.3 23.3 1.6 22 474 A K S < S- 0 0 142 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.460 99.3-138.3 -85.5 0.9 42.3 24.3 4.7 23 475 A H + 0 0 158 -4,-0.4 -3,-0.2 -3,-0.2 -4,-0.1 0.644 42.9 162.0 50.2 21.6 40.8 20.8 4.7 24 476 A I - 0 0 79 -6,-0.4 -1,-0.2 -5,-0.3 -2,-0.1 -0.600 44.6-103.4 -74.5 120.2 37.4 22.3 5.6 25 477 A P > - 0 0 60 0, 0.0 3,-1.1 0, 0.0 -1,-0.1 0.057 17.9-118.7 -43.7 150.1 34.8 19.6 4.8 26 478 A A G > S+ 0 0 31 1,-0.2 3,-1.3 2,-0.2 4,-0.2 0.718 108.9 64.4 -65.7 -27.3 32.5 19.7 1.7 27 479 A Y G 3 S+ 0 0 141 1,-0.3 3,-0.4 2,-0.1 -1,-0.2 0.690 89.9 67.7 -72.8 -14.3 29.3 19.9 3.7 28 480 A K G < S+ 0 0 111 -3,-1.1 -1,-0.3 1,-0.2 3,-0.2 0.337 79.8 94.9 -84.0 8.5 30.4 23.3 5.0 29 481 A L S X> S+ 0 0 3 -3,-1.3 4,-3.1 1,-0.2 3,-2.0 0.941 77.2 46.0 -68.6 -55.8 30.0 24.5 1.3 30 482 A E T 34 S+ 0 0 25 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.607 110.6 58.8 -66.5 -8.1 26.4 26.0 1.2 31 483 A T T 34 S+ 0 0 94 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.2 0.398 119.0 27.6 -97.6 -0.5 27.3 27.8 4.4 32 484 A L T <4 S+ 0 0 113 -3,-2.0 2,-0.2 -4,-0.0 -2,-0.2 0.529 109.4 78.3-129.8 -28.1 30.3 29.6 2.8 33 485 A I S < S- 0 0 13 -4,-3.1 6,-0.1 -5,-0.1 -1,-0.0 -0.607 78.7-122.3 -91.0 150.3 29.2 29.7 -0.9 34 486 A E S S+ 0 0 137 -2,-0.2 2,-0.1 -3,-0.1 -1,-0.1 0.974 87.3 28.1 -52.5 -80.8 26.7 32.2 -2.4 35 487 A T S > S- 0 0 68 1,-0.1 4,-0.8 0, 0.0 -2,-0.1 -0.456 74.0-125.9 -86.6 160.7 23.9 30.2 -4.0 36 488 A H H > S+ 0 0 78 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.935 107.6 56.1 -67.1 -45.0 22.7 26.7 -2.9 37 489 A E H > S+ 0 0 62 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.848 106.3 45.0 -57.4 -46.1 23.2 25.4 -6.5 38 490 A R H > S+ 0 0 47 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.741 106.4 65.0 -74.9 -15.7 26.9 26.3 -7.0 39 491 A G H X S+ 0 0 0 -4,-0.8 4,-1.6 -3,-0.4 -2,-0.2 0.918 107.6 38.5 -68.4 -41.2 27.5 24.9 -3.5 40 492 A V H X S+ 0 0 0 -4,-1.4 4,-3.2 2,-0.2 5,-0.2 0.884 111.9 60.3 -75.7 -35.0 26.5 21.4 -4.7 41 493 A S H X S+ 0 0 16 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.900 106.6 45.6 -55.7 -47.3 28.3 22.1 -8.0 42 494 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.915 112.0 53.3 -62.6 -43.7 31.6 22.6 -6.2 43 495 A R H X S+ 0 0 8 -4,-1.6 4,-2.9 2,-0.2 -2,-0.2 0.935 108.2 48.5 -58.6 -46.2 30.8 19.4 -4.1 44 496 A R H X S+ 0 0 23 -4,-3.2 4,-3.4 1,-0.2 -1,-0.2 0.902 112.1 50.7 -60.8 -39.8 30.2 17.4 -7.3 45 497 A Q H X S+ 0 0 73 -4,-2.1 4,-1.0 -5,-0.2 -1,-0.2 0.875 110.2 48.4 -65.4 -38.8 33.5 18.7 -8.6 46 498 A L H X S+ 0 0 15 -4,-2.5 4,-0.6 1,-0.2 3,-0.3 0.935 116.9 44.0 -66.0 -42.2 35.3 17.8 -5.4 47 499 A L H >X S+ 0 0 11 -4,-2.9 3,-1.2 1,-0.2 4,-0.6 0.899 103.8 63.3 -67.8 -45.2 33.7 14.3 -5.6 48 500 A S H >< S+ 0 0 26 -4,-3.4 3,-0.8 1,-0.3 -1,-0.2 0.794 98.1 56.7 -51.3 -35.4 34.3 13.8 -9.3 49 501 A K H 3< S+ 0 0 118 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.838 104.1 54.5 -66.6 -34.7 38.1 13.9 -8.8 50 502 A K H << S+ 0 0 150 -3,-1.2 -1,-0.2 -4,-0.6 -2,-0.2 0.546 90.0 95.9 -79.1 -10.7 37.9 11.1 -6.3 51 503 A L S << S- 0 0 16 -3,-0.8 713,-0.1 -4,-0.6 714,-0.1 -0.482 76.9-131.0 -84.5 152.7 36.0 8.6 -8.6 52 504 A S S S+ 0 0 112 1,-0.3 -1,-0.1 712,-0.3 712,-0.1 0.709 114.3 38.1 -70.1 -18.5 37.7 5.9 -10.7 53 505 A E S > S- 0 0 74 710,-0.1 3,-2.4 711,-0.1 -1,-0.3 -0.822 75.7-169.1-134.9 89.0 35.5 7.4 -13.5 54 506 A P T 3 S+ 0 0 78 0, 0.0 3,-0.3 0, 0.0 -4,-0.1 0.610 85.6 62.4 -53.9 -16.3 35.5 11.3 -13.0 55 507 A S T > S+ 0 0 53 1,-0.2 3,-1.6 2,-0.1 4,-0.2 0.447 70.8 105.7 -92.4 -1.4 32.7 11.5 -15.6 56 508 A S G X S+ 0 0 2 -3,-2.4 3,-0.6 1,-0.3 708,-0.2 0.804 76.5 51.3 -46.5 -44.9 30.2 9.4 -13.5 57 509 A L G > S+ 0 0 3 -3,-0.3 3,-3.5 1,-0.2 -1,-0.3 0.621 75.6 106.2 -74.1 -13.3 28.1 12.4 -12.4 58 510 A Q G < S+ 0 0 122 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.754 89.4 34.7 -34.8 -45.7 27.6 13.8 -15.9 59 511 A Y G < S+ 0 0 125 -3,-0.6 -1,-0.3 -4,-0.2 701,-0.1 0.261 89.1 106.2-100.0 10.8 23.9 12.6 -16.1 60 512 A L S < S- 0 0 3 -3,-3.5 22,-0.1 700,-0.1 -3,-0.0 -0.829 72.0-132.2 -91.4 109.8 23.1 13.1 -12.4 61 513 A P + 0 0 32 0, 0.0 20,-1.9 0, 0.0 -2,-0.1 -0.199 45.1 147.0 -60.0 149.6 20.8 16.2 -12.5 62 514 A Y + 0 0 29 18,-0.3 3,-0.3 1,-0.1 18,-0.1 0.441 39.4 94.8-154.7 -26.8 21.4 19.1 -10.0 63 515 A R S S+ 0 0 147 1,-0.2 -1,-0.1 -25,-0.0 -25,-0.0 -0.364 81.0 23.0 -77.3 156.2 20.4 22.4 -11.6 64 516 A D S S+ 0 0 154 1,-0.2 2,-0.3 -2,-0.1 -1,-0.2 0.929 88.5 127.6 55.9 54.0 17.1 24.2 -11.3 65 517 A Y - 0 0 31 -3,-0.3 2,-1.5 16,-0.0 -1,-0.2 -0.999 66.6-114.1-141.3 138.0 16.0 22.6 -8.0 66 518 A N > + 0 0 71 -2,-0.3 3,-0.6 1,-0.2 4,-0.4 -0.514 41.3 163.5 -74.3 86.0 14.8 24.1 -4.7 67 519 A Y T 3> + 0 0 4 -2,-1.5 4,-2.7 1,-0.2 3,-0.2 0.602 59.3 82.5 -77.9 -15.8 17.6 23.2 -2.3 68 520 A S T 34 S+ 0 0 54 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.881 95.3 44.3 -56.6 -40.2 16.5 25.7 0.3 69 521 A L T <4 S+ 0 0 63 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.740 114.9 49.6 -76.3 -24.0 13.8 23.3 1.6 70 522 A V T >>>S+ 0 0 0 -4,-0.4 4,-2.5 -3,-0.2 3,-1.7 0.844 89.8 92.7 -82.6 -38.5 16.2 20.3 1.5 71 523 A M T 3<5S- 0 0 53 -4,-2.7 5,-0.1 1,-0.3 433,-0.0 -0.365 103.7 -0.8 -63.0 131.7 19.1 22.0 3.4 72 524 A G T 345S+ 0 0 81 3,-0.5 -1,-0.3 1,-0.1 4,-0.1 0.694 136.1 54.8 62.2 20.0 19.1 21.4 7.2 73 525 A A T <45S+ 0 0 50 -3,-1.7 431,-0.7 2,-0.4 -2,-0.2 0.537 113.7 11.7-144.2 -47.9 15.9 19.4 6.8 74 526 A C T <5S+ 0 0 2 -4,-2.5 2,-0.3 1,-0.3 -3,-0.2 0.637 115.6 7.3-118.7 -19.7 15.9 16.4 4.4 75 527 A C < - 0 0 0 -5,-1.4 -3,-0.5 427,-0.1 -2,-0.4 -0.988 52.2-148.3-163.3 155.6 19.4 15.6 3.2 76 528 A E S S+ 0 0 33 -2,-0.3 408,-0.3 1,-0.2 3,-0.2 -0.866 76.7 25.2-126.9 164.5 23.1 16.3 3.7 77 529 A N S S- 0 0 15 -2,-0.3 407,-1.1 406,-0.2 -1,-0.2 0.881 84.1-163.0 48.4 44.7 26.2 16.3 1.4 78 530 A V E +A 483 0A 0 405,-0.2 405,-0.3 -3,-0.2 -1,-0.2 -0.365 29.3 168.9 -64.5 128.9 23.8 16.9 -1.5 79 531 A I E - 0 0 0 403,-2.6 2,-0.3 1,-0.3 404,-0.1 0.217 63.4 -63.6-122.1 9.8 25.2 16.3 -5.0 80 532 A G E -A 482 0A 0 402,-0.7 402,-2.4 -18,-0.1 2,-0.3 -0.985 61.5 -71.7 144.3-153.9 21.9 16.5 -6.9 81 533 A Y E -A 481 0A 19 -20,-1.9 419,-0.0 -2,-0.3 -16,-0.0 -0.975 25.1-129.0-145.2 154.5 18.6 14.7 -7.2 82 534 A M E -A 480 0A 0 398,-2.6 398,-1.7 -2,-0.3 2,-0.4 -0.921 22.5-142.8-108.6 113.5 17.2 11.4 -8.5 83 535 A P E -A 479 0A 2 0, 0.0 675,-0.1 0, 0.0 -2,-0.0 -0.615 14.3-167.7 -77.2 124.2 14.2 11.6 -10.8 84 536 A I E -A 478 0A 10 394,-1.8 394,-2.8 -2,-0.4 22,-0.1 -0.952 28.7-113.9-112.2 123.0 11.6 8.9 -10.3 85 537 A P E -A 477 0A 0 0, 0.0 20,-1.8 0, 0.0 2,-0.5 -0.233 28.5-150.2 -55.7 135.9 9.0 8.6 -13.0 86 538 A V E +AB 476 104A 0 390,-2.4 389,-2.6 18,-0.2 390,-0.7 -0.962 17.6 178.4-113.7 122.7 5.5 9.4 -11.7 87 539 A G E -AB 474 103A 0 16,-2.9 16,-2.7 -2,-0.5 2,-0.4 -0.720 21.3-125.8-114.6 168.4 2.5 7.7 -13.3 88 540 A V E - B 0 102A 12 385,-1.1 2,-0.4 384,-0.3 27,-0.1 -0.958 16.2-169.8-124.5 135.8 -1.2 8.0 -12.4 89 541 A A E - B 0 101A 0 12,-2.3 12,-2.7 -2,-0.4 3,-0.2 -0.988 37.2 -50.0-121.4 130.5 -3.7 5.3 -11.6 90 542 A G E - 0 0 18 -2,-0.4 10,-0.2 1,-0.3 2,-0.1 -0.917 44.5 -81.8 157.6-178.0 -7.4 6.1 -11.4 91 543 A P E - 0 0 49 0, 0.0 2,-0.7 0, 0.0 -1,-0.3 0.384 54.4-165.4 -71.9 145.0 -10.0 7.1 -10.9 92 544 A L E - B 0 99A 0 7,-2.6 7,-2.0 -3,-0.2 2,-1.1 -0.920 10.5-149.4-100.0 111.9 -10.1 5.2 -7.6 93 545 A C E + B 0 98A 25 -2,-0.7 34,-3.0 25,-0.3 2,-0.4 -0.750 32.4 160.8 -86.7 101.5 -13.7 5.2 -6.5 94 546 A L E > -cB 127 97A 0 3,-1.5 3,-1.0 -2,-1.1 34,-0.2 -0.978 62.2 -15.4-131.6 126.3 -13.4 5.1 -2.7 95 547 A D T 3 S- 0 0 29 32,-3.4 -1,-0.1 -2,-0.4 33,-0.1 0.904 126.1 -54.6 50.1 45.4 -16.1 6.1 -0.1 96 548 A E T 3 S+ 0 0 205 31,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.707 120.6 101.7 64.6 22.1 -18.1 7.9 -2.8 97 549 A K E < -B 94 0A 98 -3,-1.0 -3,-1.5 -5,-0.1 2,-0.4 -0.793 67.1-129.1-125.7 167.5 -15.2 10.0 -3.9 98 550 A E E -B 93 0A 138 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.991 22.1-168.3-125.0 126.3 -12.8 9.8 -6.9 99 551 A F E -B 92 0A 17 -7,-2.0 -7,-2.6 -2,-0.4 2,-0.7 -0.900 18.6-151.1-118.5 142.0 -9.1 9.8 -6.5 100 552 A Q E - 0 0 15 268,-0.4 -10,-0.2 -2,-0.4 -2,-0.0 -0.951 29.1-148.2-108.4 105.8 -6.3 10.2 -9.1 101 553 A V E -B 89 0A 0 -12,-2.7 -12,-2.3 -2,-0.7 2,-0.3 -0.710 3.4-146.4 -89.7 116.0 -3.4 8.3 -7.5 102 554 A P E -B 88 0A 0 0, 0.0 2,-0.4 0, 0.0 -14,-0.2 -0.574 17.1-172.3 -77.4 133.6 0.2 9.3 -8.1 103 555 A M E -B 87 0A 0 -16,-2.7 -16,-2.9 -2,-0.3 2,-0.8 -0.955 12.6-158.6-135.7 113.6 2.7 6.5 -8.2 104 556 A A E +B 86 0A 2 203,-2.4 2,-0.3 -2,-0.4 -18,-0.2 -0.819 39.7 133.4 -92.4 110.5 6.5 7.0 -8.4 105 557 A T - 0 0 17 -20,-1.8 -2,-0.1 -2,-0.8 606,-0.1 -0.969 53.2-153.8-154.7 164.2 8.0 3.8 -9.8 106 558 A T + 0 0 19 -2,-0.3 2,-0.7 604,-0.1 365,-0.2 0.163 66.9 109.7-122.2 10.4 10.5 2.3 -12.2 107 559 A E S > S- 0 0 62 644,-0.1 3,-1.6 196,-0.1 4,-0.4 -0.813 70.8-125.4 -94.1 114.2 8.7 -1.1 -12.5 108 560 A G T 3 S+ 0 0 26 361,-0.8 -2,-0.1 -2,-0.7 362,-0.1 -0.223 87.6 11.7 -58.8 140.0 7.1 -1.5 -15.9 109 561 A C T 3> S+ 0 0 90 1,-0.1 4,-3.0 4,-0.0 -1,-0.2 0.272 93.5 110.0 76.9 -6.6 3.4 -2.3 -16.0 110 562 A L H <> S+ 0 0 6 -3,-1.6 4,-2.4 2,-0.2 5,-0.2 0.937 82.8 40.3 -63.7 -50.6 2.8 -1.5 -12.3 111 563 A V H > S+ 0 0 0 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41.0 -77.9 -7.3 -2.9 -2.7 10.4 347 799 A S E + 0 0 0 -23,-0.4 2,-0.7 -98,-0.2 -23,-0.2 -0.251 58.2 159.0-146.6 59.4 0.2 -0.6 10.3 348 800 A I E -G 252 0B 0 -96,-2.6 -96,-3.1 -3,-0.5 2,-0.8 -0.709 24.7-159.4 -82.8 109.9 0.3 2.1 7.7 349 801 A E + 0 0 1 -2,-0.7 2,-0.3 -31,-0.3 -34,-0.2 -0.859 36.0 138.4 -94.6 110.0 2.9 4.7 8.9 350 802 A I - 0 0 1 -2,-0.8 2,-0.3 -147,-0.2 33,-0.1 -0.952 28.6-179.4-153.1 163.1 2.1 7.9 7.1 351 803 A G - 0 0 2 -2,-0.3 -149,-0.2 -148,-0.1 -150,-0.1 -0.989 25.4-151.7-162.8 159.9 1.7 11.6 7.3 352 804 A T S S+ 0 0 0 -151,-3.2 21,-1.6 -2,-0.3 2,-0.3 0.288 84.9 55.8-119.1 6.8 0.8 14.8 5.3 353 805 A V B S+n 202 0D 56 -152,-0.8 -150,-0.6 19,-0.1 3,-0.1 -0.992 92.6 18.1-138.3 142.3 3.0 17.2 7.2 354 806 A G S > S+ 0 0 29 -2,-0.3 3,-1.9 1,-0.2 4,-0.1 0.054 92.4 36.8 86.9 163.9 6.7 17.2 7.9 355 807 A G G > S- 0 0 45 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 -0.279 128.0 -6.8 58.0-135.7 9.7 15.4 6.5 356 808 A G G > S+ 0 0 3 -43,-0.5 3,-1.3 1,-0.3 -1,-0.3 0.619 124.1 75.3 -67.3 -13.7 9.6 14.9 2.7 357 809 A T G < S+ 0 0 5 -3,-1.9 -1,-0.3 -44,-0.5 -2,-0.2 0.553 82.5 70.5 -75.4 -7.1 6.1 16.3 2.6 358 810 A N G < S+ 0 0 78 -3,-1.7 2,-0.3 -45,-0.2 -1,-0.3 0.583 80.7 94.1 -81.8 -12.7 7.6 19.7 3.1 359 811 A L S <> S- 0 0 1 -3,-1.3 4,-2.2 -4,-0.1 5,-0.2 -0.620 79.3-128.4 -85.1 142.5 9.0 19.7 -0.4 360 812 A L H > S+ 0 0 48 -2,-0.3 4,-1.9 1,-0.2 95,-0.2 0.872 102.7 51.2 -56.6 -49.3 7.1 21.2 -3.3 361 813 A P H > S+ 0 0 12 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.933 114.7 44.2 -59.3 -42.8 7.1 18.3 -5.8 362 814 A Q H > S+ 0 0 1 -6,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.877 109.0 56.7 -70.8 -30.6 5.8 15.9 -3.2 363 815 A Q H X S+ 0 0 37 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.860 102.2 58.8 -65.4 -31.0 3.2 18.5 -2.0 364 816 A A H X S+ 0 0 1 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.908 106.1 45.9 -62.7 -45.2 2.0 18.5 -5.6 365 817 A C H X S+ 0 0 0 -4,-1.3 4,-0.8 -54,-0.3 -1,-0.2 0.877 113.4 49.9 -67.1 -35.6 1.2 14.8 -5.4 366 818 A L H ><>S+ 0 0 0 -4,-2.1 5,-2.1 1,-0.2 3,-0.9 0.911 109.5 51.4 -67.7 -40.1 -0.5 15.2 -2.0 367 819 A Q H ><5S+ 0 0 58 -4,-2.9 3,-1.5 1,-0.3 -2,-0.2 0.889 99.6 64.1 -62.9 -38.2 -2.6 18.1 -3.4 368 820 A M H 3<5S+ 0 0 7 -4,-2.0 -268,-0.4 1,-0.3 80,-0.3 0.810 109.9 39.9 -52.7 -34.3 -3.6 15.9 -6.3 369 821 A L T <<5S- 0 0 9 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.446 114.4-119.1 -95.0 -5.8 -5.3 13.7 -3.6 370 822 A G T < 5S+ 0 0 42 -3,-1.5 -3,-0.2 -4,-0.4 -2,-0.1 0.760 87.6 101.8 73.3 28.9 -6.6 16.7 -1.6 371 823 A V < + 0 0 1 -5,-2.1 -4,-0.2 -8,-0.1 15,-0.1 0.221 39.9 140.0-128.3 16.4 -4.6 15.8 1.5 372 824 A Q - 0 0 61 -6,-0.3 -19,-0.1 -9,-0.1 -20,-0.1 -0.361 63.5 -19.3 -68.0 136.8 -1.6 18.2 1.5 373 825 A G S S- 0 0 10 -21,-1.6 -20,-0.1 -16,-0.1 9,-0.1 -0.022 107.0 -16.2 66.2-166.7 -0.6 19.7 4.9 374 826 A A - 0 0 56 8,-0.1 2,-0.9 1,-0.1 3,-0.1 -0.298 56.2-128.1 -72.3 147.9 -2.6 20.0 8.0 375 827 A C - 0 0 26 1,-0.2 6,-0.2 3,-0.1 3,-0.1 -0.914 22.8-163.6 -96.5 104.3 -6.4 19.6 8.1 376 828 A K S S+ 0 0 183 -2,-0.9 -1,-0.2 1,-0.2 -2,-0.0 0.939 83.5 42.9 -52.8 -55.9 -7.3 22.9 9.9 377 829 A D S S+ 0 0 165 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.712 130.7 19.5 -67.6 -25.9 -10.9 21.9 10.9 378 830 A N S > S- 0 0 75 -3,-0.1 3,-2.1 0, 0.0 4,-0.3 -0.658 82.0-138.7-151.6 89.2 -10.1 18.3 11.9 379 831 A P T 3 S+ 0 0 60 0, 0.0 -179,-0.2 0, 0.0 -3,-0.1 -0.206 88.7 19.5 -52.0 124.4 -6.4 17.5 12.8 380 832 A G T 3> S+ 0 0 1 -181,-0.1 4,-2.6 -5,-0.1 5,-0.2 0.086 90.8 108.3 101.1 -19.3 -5.3 14.1 11.5 381 833 A E H <> S+ 0 0 48 -3,-2.1 4,-2.2 1,-0.2 5,-0.1 0.797 76.8 52.1 -61.6 -33.5 -8.1 13.8 8.9 382 834 A N H > S+ 0 0 25 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.937 112.4 45.6 -68.6 -44.4 -5.7 14.4 5.9 383 835 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.896 113.4 49.9 -65.4 -40.0 -3.3 11.6 7.1 384 836 A R H X S+ 0 0 47 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.921 110.5 50.2 -65.0 -40.9 -6.3 9.3 7.8 385 837 A Q H X S+ 0 0 11 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.901 109.2 51.5 -64.1 -41.1 -7.6 10.0 4.3 386 838 A L H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.908 108.4 51.5 -62.9 -38.4 -4.2 9.3 2.8 387 839 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.870 109.0 50.7 -65.5 -39.1 -4.1 5.9 4.6 388 840 A R H X S+ 0 0 46 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.914 109.6 50.8 -64.3 -42.2 -7.5 5.0 3.2 389 841 A I H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.888 110.0 50.1 -61.9 -41.7 -6.3 5.9 -0.3 390 842 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.951 111.6 47.1 -63.6 -47.6 -3.3 3.7 0.2 391 843 A C H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.890 114.2 48.7 -62.0 -37.5 -5.4 0.7 1.4 392 844 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.902 111.6 47.7 -69.0 -41.1 -7.8 1.2 -1.5 393 845 A T H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.875 109.3 55.1 -68.1 -36.0 -5.0 1.4 -4.1 394 846 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.930 107.4 49.6 -60.8 -46.3 -3.4 -1.7 -2.6 395 847 A M H X S+ 0 0 0 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.934 109.7 51.4 -60.7 -41.2 -6.7 -3.5 -3.1 396 848 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.921 112.3 47.1 -60.3 -42.5 -6.9 -2.3 -6.7 397 849 A G H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-0.3 0.866 111.2 50.6 -67.1 -38.3 -3.3 -3.7 -7.2 398 850 A E H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 5,-0.2 0.911 108.5 52.6 -65.6 -44.5 -4.2 -7.0 -5.5 399 851 A L H X S+ 0 0 0 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.951 113.5 42.5 -55.8 -50.7 -7.3 -7.5 -7.7 400 852 A S H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.942 116.6 43.9 -66.7 -50.1 -5.3 -6.9 -11.0 401 853 A L H X S+ 0 0 48 -4,-2.2 4,-2.2 1,-0.2 5,-0.2 0.912 113.7 52.2 -63.6 -41.1 -2.2 -9.0 -10.2 402 854 A M H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.907 109.5 49.6 -62.3 -37.1 -4.3 -11.8 -8.7 403 855 A A H X S+ 0 0 0 -4,-2.0 4,-3.1 -5,-0.2 5,-0.2 0.934 110.0 51.0 -66.9 -41.6 -6.4 -11.9 -11.9 404 856 A A H X S+ 0 0 47 -4,-2.4 4,-1.1 1,-0.2 -1,-0.2 0.857 112.7 45.7 -64.3 -35.4 -3.3 -12.0 -14.1 405 857 A L H < S+ 0 0 15 -4,-2.2 -1,-0.2 -5,-0.2 222,-0.2 0.880 115.1 48.0 -73.2 -38.2 -1.9 -14.9 -12.0 406 858 A A H < S+ 0 0 19 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.905 118.8 38.2 -67.0 -46.3 -5.2 -16.7 -12.1 407 859 A A H < S+ 0 0 51 -4,-3.1 2,-0.8 -138,-0.2 -3,-0.2 0.997 112.1 51.1 -70.1 -72.7 -5.7 -16.3 -15.9 408 860 A G < 0 0 48 -4,-1.1 219,-0.3 1,-0.3 -1,-0.2 -0.595 360.0 360.0 -75.6 110.1 -2.3 -16.7 -17.4 409 861 A H 0 0 81 -2,-0.8 -1,-0.3 217,-0.1 -2,-0.1 0.803 360.0 360.0 64.8 360.0 -0.8 -20.0 -16.1 410 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 411 463 B S > 0 0 76 0, 0.0 4,-2.1 0, 0.0 3,-0.5 0.000 360.0 360.0 360.0 153.4 -2.4 22.5 -30.9 412 464 B D H > + 0 0 45 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.922 360.0 58.1 -51.5 -44.3 -2.7 21.2 -27.3 413 465 B A H > S+ 0 0 72 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.861 109.2 41.3 -53.2 -48.0 -6.2 22.6 -27.2 414 466 B E H > S+ 0 0 123 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.813 112.4 53.8 -74.3 -31.4 -7.5 20.7 -30.2 415 467 B I H X S+ 0 0 26 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.929 109.3 51.0 -67.1 -40.0 -5.8 17.4 -29.2 416 468 B I H X S+ 0 0 25 -4,-2.6 4,-2.0 -5,-0.2 -2,-0.2 0.900 108.2 49.9 -63.1 -44.3 -7.5 17.8 -25.8 417 469 B Q H < S+ 0 0 130 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.882 108.1 56.2 -63.3 -34.7 -11.0 18.3 -27.4 418 470 B L H < S+ 0 0 126 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.935 111.4 40.1 -60.7 -51.3 -10.3 15.2 -29.6 419 471 B V H < 0 0 32 -4,-2.0 -1,-0.2 1,-0.1 -2,-0.2 0.830 360.0 360.0 -67.2 -29.2 -9.7 13.0 -26.5 420 472 B N < 0 0 142 -4,-2.0 -1,-0.1 -5,-0.2 -2,-0.1 -0.091 360.0 360.0 88.3 360.0 -12.6 14.8 -24.9 421 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 422 478 B A 0 0 77 0, 0.0 3,-0.2 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 159.3 -7.3 7.8 -23.0 423 479 B Y + 0 0 164 1,-0.1 50,-0.3 2,-0.1 3,-0.2 -0.112 360.0 97.0-117.8 32.2 -3.7 6.7 -22.0 424 480 B K > + 0 0 114 1,-0.2 4,-3.0 2,-0.1 3,-0.5 0.058 43.9 123.4-107.4 21.6 -2.4 6.3 -25.6 425 481 B L H > + 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.827 68.4 51.4 -53.0 -45.7 -0.8 9.8 -25.7 426 482 B E H 4 S+ 0 0 29 -3,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.857 117.6 39.0 -64.1 -36.6 2.7 8.7 -26.5 427 483 B T H 4 S+ 0 0 110 -3,-0.5 -2,-0.2 1,-0.1 -1,-0.2 0.922 113.8 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0.592 80.7 93.6 -78.1 -15.4 18.5 1.3 -17.5 755 811 B L S <> S- 0 0 2 -3,-1.3 4,-2.2 -4,-0.1 5,-0.2 -0.614 79.3-129.0 -84.1 142.2 17.9 5.0 -16.8 756 812 B L H > S+ 0 0 46 -2,-0.3 4,-1.9 1,-0.2 -697,-0.2 0.869 102.7 51.1 -57.7 -47.9 20.7 7.6 -17.1 757 813 B P H > S+ 0 0 13 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.940 114.7 44.3 -60.3 -42.5 20.5 9.3 -13.7 758 814 B Q H > S+ 0 0 0 -6,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.879 109.0 56.7 -70.3 -31.7 20.5 6.0 -11.8 759 815 B Q H X S+ 0 0 32 -4,-2.2 4,-2.9 1,-0.2 -1,-0.2 0.854 102.0 58.9 -64.9 -30.9 23.3 4.7 -14.1 760 816 B A H X S+ 0 0 0 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.908 106.1 45.9 -63.8 -43.1 25.3 7.8 -12.9 761 817 B C H X S+ 0 0 0 -4,-1.3 4,-0.7 -54,-0.3 -1,-0.2 0.878 113.2 50.1 -68.1 -35.1 25.0 6.7 -9.2 762 818 B L H ><>S+ 0 0 0 -4,-2.0 5,-2.1 1,-0.2 3,-0.9 0.913 109.5 51.4 -67.8 -39.9 25.9 3.1 -10.2 763 819 B Q H ><5S+ 0 0 51 -4,-2.9 3,-1.5 1,-0.3 -2,-0.2 0.883 99.6 63.9 -63.0 -38.5 29.0 4.5 -12.1 764 820 B M H 3<5S+ 0 0 7 -4,-2.0 -268,-0.4 1,-0.3 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107.9 48.3 -62.2 -41.1 32.9 -20.0 43.1 1449 716 D V H <>>S+ 0 0 5 -3,-0.9 4,-2.6 2,-0.2 5,-1.5 0.888 109.6 51.8 -67.1 -38.1 29.6 -21.9 42.7 1450 717 D V H <5S+ 0 0 1 -4,-2.1 6,-1.9 3,-0.2 -2,-0.2 0.899 115.5 44.6 -63.8 -37.7 29.7 -21.6 38.9 1451 718 D R H <5S+ 0 0 137 -4,-2.2 4,-0.5 -5,-0.2 -2,-0.2 0.958 124.4 29.4 -70.4 -51.4 33.2 -23.0 39.1 1452 719 D E H <5S+ 0 0 103 -4,-3.1 -3,-0.2 2,-0.1 -2,-0.2 0.818 131.3 28.9 -84.7 -36.3 32.6 -25.9 41.5 1453 720 D V T <5S+ 0 0 22 -4,-2.6 -3,-0.2 -5,-0.3 -2,-0.1 0.895 131.2 33.8 -90.5 -44.1 29.0 -26.9 41.0 1454 721 D L S - 0 0 72 -2,-0.2 4,-2.0 -3,-0.1 5,-0.2 -0.825 26.4-118.3-120.4 162.3 32.9 -19.9 34.2 1458 725 D T H > S+ 0 0 10 64,-0.3 4,-2.4 -2,-0.3 5,-0.2 0.920 115.4 53.8 -62.6 -41.2 30.5 -16.9 34.1 1459 726 D E H > S+ 0 0 136 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.898 108.9 47.3 -60.7 -44.9 32.1 -15.6 31.0 1460 727 D A H > S+ 0 0 31 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.896 111.3 51.2 -65.8 -40.5 31.7 -19.0 29.1 1461 728 D M H X S+ 0 0 0 -4,-2.0 4,-2.7 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-4,-1.8 -436,-2.2 -5,-0.2 -1,-0.3 0.524 115.7-115.8 -79.2 -8.2 16.4 -20.4 13.3 1477 744 D G T < 5 + 0 0 2 -3,-1.2 -438,-1.9 -4,-0.3 2,-0.3 0.922 52.8 173.9 72.6 44.0 13.4 -18.0 12.9 1478 745 D S < - 0 0 0 -5,-2.2 2,-0.6 -440,-0.2 -1,-0.2 -0.628 26.8-162.6 -88.5 141.5 12.1 -18.6 16.4 1479 746 D I S S- 0 0 17 -2,-0.3 -52,-0.1 -442,-0.2 -389,-0.1 -0.976 85.2 -10.3-119.4 109.5 9.2 -16.7 18.0 1480 747 D G S S+ 0 0 0 -2,-0.6 30,-2.2 -795,-0.3 2,-0.1 0.458 103.3 108.8 84.5 0.2 9.3 -17.2 21.7 1481 748 D G E +q 1510 0O 0 -444,-0.2 2,-1.1 28,-0.2 30,-0.1 -0.264 27.8 134.2-106.9 48.1 12.0 -19.9 21.8 1482 749 D Y E +q 1511 0O 1 28,-0.8 30,-2.8 -2,-0.1 2,-0.3 -0.388 54.8 78.0 -91.3 56.8 14.9 -18.0 23.3 1483 750 D N S S- 0 0 2 -2,-1.1 27,-0.0 28,-0.2 28,-0.0 -0.917 78.7-119.3-153.9 171.7 15.9 -20.7 25.8 1484 751 D A S S- 0 0 4 -2,-0.3 -1,-0.1 1,-0.0 -450,-0.1 0.934 91.6 -23.4 -88.8 -51.8 17.7 -24.0 25.9 1485 752 D H S >> S+ 0 0 10 94,-0.1 3,-1.3 2,-0.1 4,-1.0 0.023 71.7 142.5-158.3 43.8 15.1 -26.5 27.1 1486 753 D A H 3> S+ 0 0 0 1,-0.3 4,-2.9 2,-0.2 3,-0.3 0.872 76.4 65.0 -53.4 -36.7 12.2 -24.9 29.1 1487 754 D A H 3> S+ 0 0 0 -452,-0.4 4,-2.6 1,-0.2 -1,-0.3 0.841 94.8 57.6 -57.8 -34.6 10.0 -27.4 27.4 1488 755 D N H <> S+ 0 0 10 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.929 113.4 39.1 -61.3 -45.4 11.7 -30.3 29.2 1489 756 D I H X S+ 0 0 0 -4,-1.0 4,-2.3 -3,-0.3 5,-0.3 0.924 116.1 49.7 -70.6 -49.0 10.9 -28.8 32.6 1490 757 D V H X S+ 0 0 0 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.955 113.5 47.3 -56.3 -45.7 7.5 -27.6 31.8 1491 758 D T H X S+ 0 0 8 -4,-2.6 4,-2.4 -5,-0.2 5,-0.2 0.911 111.6 48.8 -64.0 -45.8 6.5 -31.0 30.3 1492 759 D A H X S+ 0 0 1 -4,-1.9 -203,-2.4 -5,-0.2 4,-1.7 0.898 116.0 42.5 -63.1 -42.9 7.9 -33.1 33.2 1493 760 D I H X S+ 0 0 0 -4,-2.3 4,-2.4 -205,-0.2 -1,-0.2 0.900 112.6 54.8 -70.4 -40.4 6.1 -30.9 35.9 1494 761 D Y H <>S+ 0 0 0 -4,-2.7 5,-2.7 -5,-0.3 4,-0.2 0.917 109.8 45.6 -58.4 -45.4 2.9 -30.8 33.8 1495 762 D I H ><5S+ 0 0 12 -4,-2.4 3,-0.9 -206,-0.2 -1,-0.2 0.923 114.7 47.5 -66.7 -41.7 2.6 -34.6 33.6 1496 763 D A H 3<5S+ 0 0 0 -4,-1.7 54,-0.3 1,-0.2 -2,-0.2 0.851 116.0 44.8 -67.9 -32.5 3.4 -35.1 37.3 1497 764 D C T 3<5S- 0 0 0 -4,-2.4 -1,-0.2 53,-0.1 -2,-0.2 0.174 113.8-107.8-100.0 15.1 0.9 -32.4 38.4 1498 765 D G T < 5 + 0 0 6 -3,-0.9 43,-0.5 -4,-0.2 44,-0.5 0.786 67.2 146.9 67.4 28.2 -2.1 -33.3 36.2 1499 766 D Q < - 0 0 12 -5,-2.7 2,-1.0 -6,-0.2 -1,-0.2 -0.342 64.2 -88.7 -85.2 174.0 -1.8 -30.3 33.8 1500 767 D D > - 0 0 29 34,-0.2 3,-1.7 1,-0.2 34,-0.1 -0.775 39.1-163.1 -86.4 103.2 -2.7 -30.4 30.2 1501 768 D A G > S+ 0 0 11 -2,-1.0 3,-1.5 1,-0.3 -1,-0.2 0.725 83.8 67.6 -61.7 -24.1 0.6 -31.5 28.6 1502 769 D A G > S+ 0 0 2 1,-0.3 3,-1.3 2,-0.2 -1,-0.3 0.734 87.6 69.2 -68.3 -21.9 -0.4 -30.4 25.1 1503 770 D Q G <> S+ 0 0 2 -3,-1.7 4,-2.5 1,-0.3 3,-0.4 0.449 70.7 92.9 -76.2 3.6 -0.3 -26.9 26.5 1504 771 D N H <> S+ 0 0 0 -3,-1.5 4,-1.6 1,-0.2 -1,-0.3 0.776 70.0 75.7 -63.1 -24.4 3.5 -27.3 26.7 1505 772 D V H <4 S+ 0 0 3 -3,-1.3 -1,-0.2 1,-0.2 -2,-0.1 0.948 115.0 13.4 -55.5 -55.1 3.4 -25.7 23.2 1506 773 D G H >4 S+ 0 0 2 -3,-0.4 3,-1.9 -4,-0.2 26,-0.2 0.786 119.9 67.9 -92.9 -28.3 2.8 -22.2 24.4 1507 774 D S H 3< S+ 0 0 0 -4,-2.5 25,-0.2 1,-0.3 -3,-0.2 0.773 94.9 60.1 -61.5 -27.0 3.6 -22.7 28.1 1508 775 D S T 3< S+ 0 0 6 -4,-1.6 -1,-0.3 -5,-0.2 -21,-0.2 0.360 71.3 127.5 -79.8 -5.3 7.2 -23.3 27.3 1509 776 D N < + 0 0 7 -3,-1.9 23,-0.4 23,-0.2 2,-0.3 -0.407 36.9 154.0 -53.7 133.9 7.7 -19.9 25.7 1510 777 D C E -q 1481 0O 0 -30,-2.2 -28,-0.8 20,-0.2 2,-0.5 -0.955 42.1-152.5-169.7 138.3 10.8 -18.4 27.4 1511 778 D I E -qR14821529O 0 18,-2.0 18,-1.7 -2,-0.3 2,-0.5 -0.987 19.7-160.4-116.0 115.9 13.6 -15.9 27.1 1512 779 D T E - R 01528O 0 -30,-2.8 2,-0.4 -2,-0.5 16,-0.2 -0.909 10.4-171.7 -97.0 123.8 16.7 -16.9 29.2 1513 780 D L E - R 01527O 21 14,-2.9 14,-2.4 -2,-0.5 2,-0.4 -0.941 6.1-170.0-121.4 140.8 19.1 -14.0 29.9 1514 781 D M E + R 01526O 16 -2,-0.4 2,-0.3 12,-0.2 12,-0.2 -0.990 9.5 172.7-131.5 137.5 22.6 -14.2 31.5 1515 782 D E E - R 01525O 45 10,-2.6 10,-3.5 -2,-0.4 2,-0.3 -0.962 36.9-103.0-143.5 154.6 24.8 -11.3 32.6 1516 783 D A E + R 01524O 36 -2,-0.3 2,-0.2 8,-0.2 8,-0.2 -0.610 49.0 175.9 -77.9 133.8 28.1 -10.6 34.5 1517 784 D S E + R 01523O 31 6,-3.2 6,-2.0 -2,-0.3 5,-0.5 -0.788 21.9 47.2-132.1 175.5 27.4 -9.5 38.0 1518 785 D G S > S- 0 0 31 -2,-0.2 3,-0.8 3,-0.2 7,-0.0 -0.040 92.8 -52.1 86.3 176.1 29.1 -8.5 41.3 1519 786 D P T 3 S+ 0 0 132 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 0.885 139.8 26.9 -56.1 -45.2 32.1 -6.4 42.5 1520 787 D T T 3 S- 0 0 100 -3,-0.1 -2,-0.1 0, 0.0 -3,-0.0 0.253 110.3-113.6-105.0 11.7 34.5 -8.0 40.0 1521 788 D N S < S+ 0 0 94 -3,-0.8 -3,-0.2 1,-0.1 -5,-0.0 0.845 86.6 114.9 60.4 33.3 31.9 -8.9 37.3 1522 789 D E + 0 0 118 -5,-0.5 -64,-0.3 -6,-0.1 2,-0.2 0.546 46.9 90.0-108.1 -13.3 32.6 -12.6 38.0 1523 790 D D E S- R 01517O 39 -6,-2.0 -6,-3.2 -77,-0.1 2,-0.6 -0.617 77.1-120.7 -85.0 148.0 29.2 -13.7 39.4 1524 791 D L E -PR14451516O 0 -79,-2.9 -79,-2.9 -2,-0.2 2,-0.5 -0.781 19.6-162.9 -95.3 113.4 26.4 -14.9 37.0 1525 792 D Y E -PR14441515O 9 -10,-3.5 -10,-2.6 -2,-0.6 2,-0.4 -0.820 17.2-179.0 -90.2 133.7 23.1 -13.1 36.9 1526 793 D I E +PR14431514O 0 -83,-2.6 -83,-1.8 -2,-0.5 2,-0.3 -0.997 10.1 177.4-137.1 140.2 20.4 -15.1 35.3 1527 794 D S E -PR14421513O 1 -14,-2.4 -14,-2.9 -2,-0.4 2,-0.4 -0.995 12.0-161.9-139.9 147.1 16.7 -14.5 34.5 1528 795 D C E -PR14411512O 0 -87,-1.9 -87,-2.1 -2,-0.3 2,-0.5 -0.998 7.2-165.9-127.2 128.3 13.9 -16.5 32.8 1529 796 D T E +PR14401511O 4 -18,-1.7 -18,-2.0 -2,-0.4 -89,-0.2 -0.989 7.3 179.3-119.6 121.5 10.8 -14.7 31.5 1530 797 D M E -P 1439 0O 0 -91,-3.2 -91,-2.8 -2,-0.5 3,-0.5 -0.886 4.4-178.8-125.7 100.3 7.8 -16.9 30.6 1531 798 D P E S+ 0 0 15 0, 0.0 -96,-1.3 0, 0.0 -1,-0.1 0.570 73.3 42.3 -78.5 -6.5 4.8 -14.9 29.4 1532 799 D S E + 0 0 0 -23,-0.4 2,-0.7 -98,-0.2 -23,-0.2 -0.285 58.2 158.4-144.3 58.7 2.4 -17.7 28.8 1533 800 D I E -P 1437 0O 0 -96,-2.7 -96,-3.1 -3,-0.5 2,-0.8 -0.714 24.8-159.6 -83.3 110.6 2.2 -20.4 31.5 1534 801 D E + 0 0 1 -2,-0.7 2,-0.3 -31,-0.3 -34,-0.2 -0.867 35.9 139.5 -94.2 111.5 -1.2 -22.1 31.1 1535 802 D I - 0 0 1 -2,-0.8 2,-0.3 -147,-0.1 33,-0.1 -0.960 28.4-179.8-154.8 161.6 -1.7 -23.9 34.4 1536 803 D G - 0 0 2 -2,-0.3 -149,-0.2 -148,-0.1 -150,-0.1 -0.989 25.0-151.8-162.1 159.6 -4.1 -24.8 37.2 1537 804 D T S S+ 0 0 0 -151,-3.3 21,-1.6 -2,-0.3 2,-0.3 0.283 84.9 52.6-119.2 5.0 -4.5 -26.6 40.5 1538 805 D V B S+w 1387 0Q 56 -152,-0.9 -150,-0.6 19,-0.1 3,-0.1 -0.989 93.1 21.8-140.2 143.6 -8.2 -27.5 40.3 1539 806 D G S > S+ 0 0 30 -2,-0.3 3,-1.8 1,-0.2 4,-0.1 0.051 92.5 36.8 88.9 164.6 -10.0 -29.4 37.5 1540 807 D G G > S- 0 0 45 1,-0.3 3,-1.5 2,-0.2 -1,-0.2 -0.271 127.9 -8.7 59.7-136.0 -9.0 -31.7 34.7 1541 808 D G G > S+ 0 0 2 -43,-0.5 3,-1.3 1,-0.3 -1,-0.3 0.595 124.3 75.0 -69.5 -13.4 -6.2 -34.1 35.6 1542 809 D T G < S+ 0 0 4 -3,-1.8 -1,-0.3 -44,-0.5 -2,-0.2 0.539 82.7 71.1 -76.0 -6.4 -5.6 -32.4 38.9 1543 810 D N G < S+ 0 0 75 -3,-1.5 2,-0.3 -45,-0.2 -1,-0.2 0.581 80.7 93.2 -81.7 -10.9 -8.8 -34.0 40.1 1544 811 D L S <> S- 0 0 0 -3,-1.3 4,-2.2 -4,-0.1 5,-0.2 -0.625 80.2-127.6 -85.1 143.7 -7.0 -37.4 40.2 1545 812 D L H > S+ 0 0 51 -2,-0.3 4,-1.9 1,-0.2 -690,-0.2 0.874 102.9 51.4 -59.1 -48.0 -5.3 -38.6 43.4 1546 813 D P H > S+ 0 0 14 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.939 114.6 44.2 -60.3 -41.0 -1.8 -39.4 42.2 1547 814 D Q H > S+ 0 0 0 -6,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.880 109.0 56.9 -71.2 -31.7 -1.5 -36.0 40.6 1548 815 D Q H X S+ 0 0 34 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.857 102.0 58.6 -64.2 -31.1 -3.0 -34.3 43.6 1549 816 D A H X S+ 0 0 1 -4,-1.9 4,-2.0 2,-0.2 -1,-0.2 0.907 106.1 46.1 -64.2 -43.4 -0.2 -36.0 45.6 1550 817 D C H X S+ 0 0 0 -4,-1.3 4,-0.7 -54,-0.3 -1,-0.2 0.881 113.1 49.8 -67.7 -36.1 2.5 -34.2 43.5 1551 818 D L H ><>S+ 0 0 0 -4,-2.1 5,-2.1 1,-0.2 3,-0.9 0.913 109.3 52.0 -67.4 -39.1 0.6 -30.9 43.8 1552 819 D Q H ><5S+ 0 0 59 -4,-2.8 3,-1.7 1,-0.3 -2,-0.2 0.892 99.5 64.1 -64.2 -38.2 0.4 -31.5 47.7 1553 820 D M H 3<5S+ 0 0 6 -4,-2.0 -268,-0.4 1,-0.3 -1,-0.3 0.804 109.6 39.7 -51.8 -35.3 4.2 -32.0 47.6 1554 821 D L T <<5S- 0 0 7 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.414 114.4-118.9 -94.3 -5.9 4.4 -28.4 46.5 1555 822 D G T < 5S+ 0 0 46 -3,-1.7 -3,-0.2 -4,-0.4 -2,-0.1 0.763 87.5 102.2 73.2 29.3 1.6 -27.2 48.8 1556 823 D V < + 0 0 0 -5,-2.1 -4,-0.2 -8,-0.1 2,-0.1 0.200 39.9 139.7-128.5 16.5 -0.6 -26.0 46.0 1557 824 D Q - 0 0 62 -6,-0.3 -19,-0.1 -9,-0.1 -20,-0.1 -0.383 62.7 -17.3 -68.6 135.2 -3.3 -28.7 45.6 1558 825 D G S S- 0 0 8 -21,-1.6 -20,-0.1 -16,-0.1 2,-0.1 -0.104 105.5 -19.5 71.6-166.1 -6.8 -27.6 45.0 1559 826 D A - 0 0 65 8,-0.1 2,-1.0 1,-0.1 3,-0.1 -0.386 50.9-131.0 -80.1 148.4 -8.4 -24.2 45.5 1560 827 D C - 0 0 28 1,-0.2 6,-0.2 -2,-0.1 -1,-0.1 -0.912 23.8-164.4 -96.5 96.4 -6.9 -21.6 47.7 1561 828 D K S S+ 0 0 192 -2,-1.0 -1,-0.2 1,-0.2 -3,-0.0 0.900 82.7 49.4 -50.4 -44.8 -10.2 -20.8 49.5 1562 829 D D S S+ 0 0 161 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.945 128.8 12.8 -62.2 -54.7 -8.9 -17.5 50.9 1563 830 D N S > S- 0 0 83 -178,-0.0 3,-2.2 0, 0.0 4,-0.3 -0.832 82.8-138.0-131.3 90.9 -7.5 -16.0 47.7 1564 831 D P T 3 S+ 0 0 50 0, 0.0 -179,-0.3 0, 0.0 -3,-0.1 -0.259 89.4 27.3 -51.9 118.7 -8.7 -17.8 44.5 1565 832 D G T 3> S+ 0 0 0 -181,-0.1 4,-3.0 -182,-0.1 5,-0.2 -0.006 87.8 104.0 115.9 -24.2 -5.8 -18.1 42.1 1566 833 D E H <> S+ 0 0 66 -3,-2.2 4,-2.7 1,-0.2 5,-0.2 0.869 81.1 50.1 -59.7 -40.7 -2.9 -18.1 44.6 1567 834 D N H > S+ 0 0 27 -4,-0.3 4,-2.3 2,-0.2 -1,-0.2 0.935 114.3 45.3 -63.6 -44.9 -2.2 -21.8 44.4 1568 835 D A H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.879 113.3 50.1 -65.5 -39.0 -2.1 -21.6 40.6 1569 836 D R H X S+ 0 0 27 -4,-3.0 4,-2.0 2,-0.2 -2,-0.2 0.922 110.5 50.1 -65.6 -40.4 0.1 -18.5 40.7 1570 837 D Q H X S+ 0 0 23 -4,-2.7 4,-2.1 -5,-0.2 -2,-0.2 0.896 109.3 51.5 -64.7 -40.1 2.4 -20.3 43.1 1571 838 D L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.903 108.4 51.4 -65.1 -37.8 2.6 -23.3 40.8 1572 839 D A H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.875 109.1 51.0 -66.2 -37.6 3.5 -21.0 37.8 1573 840 D R H X S+ 0 0 37 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.922 109.6 50.4 -64.9 -40.9 6.3 -19.4 39.9 1574 841 D I H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.885 110.2 50.2 -64.6 -40.1 7.7 -22.9 40.8 1575 842 D V H X S+ 0 0 0 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.950 111.6 47.0 -63.3 -47.5 7.6 -23.8 37.1 1576 843 D C H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.894 114.4 48.4 -62.4 -37.7 9.5 -20.7 36.1 1577 844 D G H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.900 111.5 48.1 -69.1 -41.4 12.0 -21.2 38.9 1578 845 D T H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.880 109.4 54.4 -66.8 -37.6 12.5 -24.9 38.0 1579 846 D V H X S+ 0 0 0 -4,-2.6 4,-3.0 2,-0.2 -2,-0.2 0.934 107.6 49.9 -59.6 -46.9 13.0 -23.9 34.3 1580 847 D M H X S+ 0 0 0 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.937 109.8 51.2 -59.4 -41.7 15.7 -21.4 35.4 1581 848 D A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.921 112.7 46.3 -59.2 -44.1 17.4 -24.2 37.3 1582 849 D G H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 5,-0.3 0.875 111.3 51.3 -66.0 -39.6 17.2 -26.4 34.2 1583 850 D E H X S+ 0 0 0 -4,-3.0 4,-2.3 2,-0.2 5,-0.3 0.912 108.6 52.1 -63.0 -46.2 18.6 -23.6 32.0 1584 851 D L H X S+ 0 0 0 -4,-2.7 4,-2.0 -5,-0.2 -2,-0.2 0.959 113.6 42.8 -54.7 -52.1 21.5 -23.0 34.4 1585 852 D S H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.933 116.6 43.5 -64.3 -51.6 22.6 -26.7 34.4 1586 853 D L H X S+ 0 0 45 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.909 113.7 52.1 -63.6 -41.2 22.2 -27.5 30.7 1587 854 D M H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.3 -1,-0.2 0.912 109.8 49.7 -61.6 -38.5 23.9 -24.2 29.7 1588 855 D A H X S+ 0 0 0 -4,-2.0 4,-2.8 -5,-0.3 5,-0.3 0.935 110.1 50.8 -65.0 -42.6 26.8 -25.0 32.0 1589 856 D A H X S+ 0 0 45 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.852 112.5 46.1 -63.4 -35.9 27.1 -28.5 30.4 1590 857 D L H < S+ 0 0 23 -4,-2.2 -563,-0.2 2,-0.2 -1,-0.2 0.874 114.0 48.3 -73.7 -38.9 27.1 -27.0 26.9 1591 858 D A H < S+ 0 0 26 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.868 116.8 42.3 -68.0 -38.8 29.7 -24.4 27.9 1592 859 D A H < 0 0 57 -4,-2.8 -2,-0.2 -5,-0.2 -1,-0.2 0.784 360.0 360.0 -78.9 -28.2 31.9 -26.9 29.6 1593 860 D G < 0 0 101 -4,-1.7 -3,-0.1 -5,-0.3 -4,-0.1 0.454 360.0 360.0 80.9 360.0 31.6 -29.5 26.8