==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=8-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 26-FEB-08 3CCW . COMPND 2 MOLECULE: 3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.PAVLOVSKY,R.W.SARVER,M.S.HARRIS,B.C.FINZEL . 1650 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56268.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1201 72.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 252 15.3 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 . 12 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 . 89 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 163 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 559 33.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 49 3.0 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 7 4 8 0 2 6 3 4 12 6 1 1 0 0 4 0 0 0 0 0 0 0 2 2 0 0 0 RESIDUES PER ALPHA HELIX . 12 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 . 2 1 12 0 4 0 11 5 2 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 . 1 3 4 3 1 0 0 0 1 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 1 441 A E 0 0 209 0, 0.0 2,-0.1 0, 0.0 25,-0.0 0.000 360.0 360.0 360.0 -38.9 26.0 -33.3 45.3 2 442 A P - 0 0 53 0, 0.0 3,-0.1 0, 0.0 20,-0.0 -0.270 360.0-136.3 -55.6 118.4 25.0 -32.4 41.7 3 443 A R - 0 0 92 1,-0.1 5,-0.1 -2,-0.1 0, 0.0 -0.295 39.2 -70.1 -73.2 160.0 26.7 -34.7 39.2 4 444 A P >> - 0 0 69 0, 0.0 4,-1.3 0, 0.0 3,-0.5 0.017 44.1-108.7 -56.9 160.2 28.3 -33.2 36.0 5 445 A N H 3> S+ 0 0 39 1,-0.2 4,-1.4 2,-0.2 -2,-0.1 0.757 110.3 62.4 -60.1 -31.3 26.2 -31.8 33.1 6 446 A E H 3> S+ 0 0 145 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.897 104.5 44.1 -68.0 -45.2 26.9 -34.7 30.7 7 447 A E H <> S+ 0 0 98 -3,-0.5 4,-1.4 1,-0.2 -1,-0.2 0.851 110.6 57.2 -65.1 -37.3 25.3 -37.5 32.7 8 448 A C H X S+ 0 0 0 -4,-1.3 4,-1.2 1,-0.2 -1,-0.2 0.816 104.1 51.9 -65.6 -32.4 22.3 -35.3 33.5 9 449 A L H X S+ 0 0 60 -4,-1.4 4,-2.0 2,-0.2 -1,-0.2 0.798 106.3 53.5 -75.4 -31.7 21.5 -34.7 29.8 10 450 A Q H X S+ 0 0 149 -4,-1.1 4,-0.6 2,-0.2 -2,-0.2 0.825 110.1 47.6 -69.4 -34.6 21.6 -38.5 29.1 11 451 A I H < S+ 0 0 20 -4,-1.4 7,-1.3 2,-0.2 -2,-0.2 0.776 113.1 49.9 -74.0 -29.7 19.0 -39.0 31.9 12 452 A L H < S+ 0 0 24 -4,-1.2 -2,-0.2 1,-0.2 -1,-0.2 0.838 111.0 47.9 -75.0 -36.7 17.0 -36.1 30.4 13 453 A G H < S+ 0 0 69 -4,-2.0 2,-0.4 5,-0.1 -2,-0.2 0.597 91.1 99.8 -80.7 -13.9 17.1 -37.6 26.9 14 454 A N >X - 0 0 56 -4,-0.6 4,-1.3 1,-0.1 3,-1.3 -0.645 67.0-148.1 -77.8 126.4 16.1 -41.0 28.2 15 455 A A T 34 S+ 0 0 102 -2,-0.4 -1,-0.1 1,-0.2 -4,-0.0 0.839 95.5 50.3 -62.4 -37.5 12.3 -41.7 27.6 16 456 A E T 34 S+ 0 0 172 1,-0.1 -1,-0.2 2,-0.1 -2,-0.0 0.237 122.7 29.5 -91.6 15.0 11.9 -43.9 30.8 17 457 A K T X4 S+ 0 0 86 -3,-1.3 3,-0.6 -6,-0.2 4,-0.2 0.522 74.8 158.2-129.4 -70.7 13.6 -41.3 33.1 18 458 A G G >< S- 0 0 20 -4,-1.3 3,-0.7 -7,-1.3 4,-0.2 -0.337 72.2 -37.1 73.6-154.6 13.2 -37.6 32.0 19 459 A A G > S+ 0 0 3 25,-0.6 3,-1.4 1,-0.2 -1,-0.2 0.670 123.2 81.4 -79.8 -18.7 13.5 -34.7 34.4 20 460 A K G < S+ 0 0 148 -3,-0.6 -1,-0.2 1,-0.3 -2,-0.2 0.774 91.7 51.8 -54.0 -28.9 11.8 -36.7 37.2 21 461 A F G < S+ 0 0 99 -3,-0.7 -1,-0.3 -4,-0.2 2,-0.2 0.576 98.1 80.5 -89.2 -12.3 15.2 -38.3 37.9 22 462 A L S < S- 0 0 7 -3,-1.4 2,-0.1 -4,-0.2 3,-0.0 -0.577 78.6-118.9 -92.6 159.3 17.2 -35.1 38.1 23 463 A S > - 0 0 50 -2,-0.2 4,-2.0 1,-0.1 5,-0.2 -0.429 25.8-110.1 -87.4 166.2 17.4 -32.8 41.2 24 464 A D H > S+ 0 0 49 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.937 123.2 50.0 -58.2 -45.6 16.3 -29.1 41.3 25 465 A A H > S+ 0 0 45 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.853 108.7 51.0 -61.9 -38.1 20.0 -28.2 41.6 26 466 A E H > S+ 0 0 1 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.861 110.8 47.9 -69.7 -38.2 20.9 -30.4 38.5 27 467 A I H X S+ 0 0 0 -4,-2.0 4,-1.8 1,-0.2 -2,-0.2 0.921 113.3 49.3 -63.2 -44.2 18.1 -28.8 36.4 28 468 A I H X S+ 0 0 14 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.713 108.9 53.6 -67.1 -24.3 19.5 -25.4 37.6 29 469 A Q H < S+ 0 0 64 -4,-1.2 -1,-0.2 2,-0.2 -2,-0.2 0.891 106.6 50.1 -77.7 -42.8 23.0 -26.5 36.7 30 470 A L H < S+ 0 0 0 -4,-2.0 6,-0.8 1,-0.2 -2,-0.2 0.885 112.1 48.6 -62.0 -39.5 22.1 -27.4 33.1 31 471 A V H >< S+ 0 0 19 -4,-1.8 2,-1.5 1,-0.2 3,-1.2 0.954 101.0 66.9 -65.6 -49.3 20.4 -24.0 32.7 32 472 A N T 3< S+ 0 0 91 -4,-1.7 -1,-0.2 1,-0.3 -4,-0.0 -0.594 113.4 26.6 -74.5 89.7 23.4 -22.2 34.2 33 473 A A T 3 S- 0 0 62 -2,-1.5 -1,-0.3 3,-0.1 -2,-0.1 0.562 117.9-100.1 116.0 37.6 25.8 -23.0 31.2 34 474 A K S < S+ 0 0 169 -3,-1.2 2,-1.1 1,-0.1 0, 0.0 0.027 82.7 115.3 50.5-157.3 23.2 -23.5 28.4 35 475 A H S S+ 0 0 116 -26,-0.0 -4,-0.2 -3,-0.0 -1,-0.1 -0.375 96.3 37.2 86.4 -54.0 22.0 -26.9 27.1 36 476 A I S S- 0 0 3 -2,-1.1 -2,-0.1 -6,-0.8 -3,-0.1 -0.993 77.4-159.1-121.5 124.0 18.5 -25.9 28.4 37 477 A P - 0 0 63 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.917 40.0-108.3 -69.4 -46.7 17.7 -22.2 27.8 38 478 A A S > S+ 0 0 35 0, 0.0 3,-0.8 0, 0.0 4,-0.3 -0.192 108.1 71.4 144.3 -40.9 14.9 -21.8 30.4 39 479 A Y G > S+ 0 0 150 1,-0.2 3,-0.5 2,-0.2 4,-0.4 0.677 92.2 61.6 -75.2 -18.9 11.8 -21.5 28.2 40 480 A K G 3 S+ 0 0 96 1,-0.2 -1,-0.2 2,-0.2 5,-0.2 0.522 79.3 88.7 -82.1 -6.7 12.0 -25.2 27.4 41 481 A L G X> S+ 0 0 1 -3,-0.8 4,-2.1 1,-0.2 3,-0.7 0.861 84.3 54.5 -57.2 -39.0 11.6 -26.0 31.1 42 482 A E T <4 S+ 0 0 51 -3,-0.5 2,-1.2 -4,-0.3 -1,-0.2 0.959 110.5 46.0 -59.4 -50.2 7.8 -26.0 30.6 43 483 A T T 34 S+ 0 0 107 -4,-0.4 -1,-0.3 1,-0.1 -2,-0.1 -0.479 123.6 30.7 -93.1 64.9 8.2 -28.6 27.8 44 484 A L T <4 S+ 0 0 67 -2,-1.2 -25,-0.6 -3,-0.7 -2,-0.2 0.023 90.8 92.3-175.0 -55.5 10.7 -30.9 29.7 45 485 A I S < S- 0 0 10 -4,-2.1 -1,-0.5 -5,-0.2 6,-0.1 -0.347 79.5-117.1 -67.6 138.4 10.1 -30.9 33.4 46 486 A E S S+ 0 0 96 -3,-0.1 2,-0.3 4,-0.1 -1,-0.1 0.773 90.4 21.7 -39.6 -48.5 7.7 -33.5 34.9 47 487 A T > - 0 0 65 1,-0.1 4,-1.4 -27,-0.0 5,-0.1 -0.885 68.9-125.3-129.8 159.3 5.1 -31.1 36.2 48 488 A H H > S+ 0 0 68 -2,-0.3 4,-1.9 1,-0.2 5,-0.2 0.926 110.8 52.3 -65.7 -45.7 3.9 -27.5 35.6 49 489 A E H > S+ 0 0 57 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.799 108.1 50.7 -65.4 -31.4 4.3 -26.5 39.3 50 490 A R H > S+ 0 0 35 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.848 106.7 55.6 -73.3 -34.9 7.9 -27.8 39.4 51 491 A G H X S+ 0 0 0 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.906 109.9 46.1 -60.3 -42.6 8.7 -25.7 36.3 52 492 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.909 111.1 52.7 -63.9 -44.5 7.4 -22.6 38.1 53 493 A S H X S+ 0 0 19 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.925 110.8 46.3 -60.3 -46.0 9.4 -23.5 41.2 54 494 A I H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.933 111.9 52.0 -61.0 -46.4 12.6 -23.9 39.2 55 495 A R H X S+ 0 0 25 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.877 109.2 50.0 -57.3 -41.1 11.8 -20.6 37.4 56 496 A R H X S+ 0 0 29 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.873 109.9 50.5 -66.0 -38.7 11.4 -18.9 40.7 57 497 A Q H X S+ 0 0 69 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.906 111.6 47.4 -67.8 -42.3 14.7 -20.2 42.1 58 498 A L H X S+ 0 0 17 -4,-2.4 4,-0.9 1,-0.2 3,-0.4 0.932 114.0 47.7 -60.9 -48.4 16.6 -19.0 39.0 59 499 A L H >X S+ 0 0 6 -4,-2.2 4,-1.1 1,-0.2 3,-0.8 0.901 105.1 59.3 -59.5 -45.6 15.0 -15.6 39.2 60 500 A S H 3< S+ 0 0 24 -4,-2.3 3,-0.2 1,-0.3 -1,-0.2 0.808 99.4 56.8 -57.3 -36.8 15.7 -15.2 42.9 61 501 A K H 3< S+ 0 0 124 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.846 106.6 51.2 -60.9 -36.6 19.5 -15.5 42.4 62 502 A K H << S+ 0 0 140 -4,-0.9 -1,-0.2 -3,-0.8 -2,-0.2 0.758 94.6 90.5 -73.4 -27.5 19.3 -12.6 40.0 63 503 A L S < S- 0 0 15 -4,-1.1 739,-0.1 -3,-0.2 740,-0.1 -0.341 77.2-131.6 -75.8 151.9 17.4 -10.3 42.4 64 504 A S S S+ 0 0 114 738,-0.3 -1,-0.1 1,-0.3 738,-0.1 0.685 107.9 43.2 -76.4 -19.1 19.1 -7.9 44.8 65 505 A E S > S- 0 0 91 736,-0.2 3,-1.8 737,-0.1 -1,-0.3 -0.887 75.8-166.7-122.4 96.6 16.8 -9.2 47.5 66 506 A P T 3 S+ 0 0 83 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 0.728 85.4 58.4 -55.1 -27.2 16.7 -13.0 47.1 67 507 A S T > S+ 0 0 53 1,-0.2 3,-1.2 2,-0.1 4,-0.2 0.186 72.2 110.7 -87.8 17.2 13.6 -13.4 49.4 68 508 A S G X S+ 0 0 0 -3,-1.8 3,-0.5 1,-0.3 -1,-0.2 0.857 74.9 51.0 -60.1 -38.7 11.5 -11.1 47.2 69 509 A L G > S+ 0 0 5 -3,-0.5 3,-2.2 1,-0.2 -1,-0.3 0.528 76.7 109.1 -80.1 -8.9 9.2 -13.9 46.0 70 510 A Q G < S+ 0 0 130 -3,-1.2 -1,-0.2 1,-0.3 -2,-0.1 0.784 88.6 30.5 -33.1 -49.7 8.5 -15.2 49.5 71 511 A Y G < S+ 0 0 128 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.1 0.289 91.0 104.3-106.6 7.5 4.8 -14.0 49.6 72 512 A L S < S- 0 0 1 -3,-2.2 22,-0.1 726,-0.1 724,-0.0 -0.832 72.2-138.0 -82.2 109.9 4.1 -14.3 45.8 73 513 A P + 0 0 35 0, 0.0 20,-2.0 0, 0.0 -2,-0.1 -0.307 43.2 147.5 -73.6 157.0 2.0 -17.4 45.8 74 514 A Y > + 0 0 28 18,-0.2 3,-1.0 1,-0.0 18,-0.1 0.418 32.6 110.6-154.0 -31.0 2.3 -20.2 43.3 75 515 A R T 3 S+ 0 0 160 1,-0.2 3,-0.1 -23,-0.0 -1,-0.0 -0.219 84.2 6.4 -64.9 144.7 1.5 -23.7 44.8 76 516 A D T 3 S+ 0 0 149 1,-0.2 2,-0.4 0, 0.0 -1,-0.2 0.685 86.5 139.1 59.3 26.5 -1.6 -25.7 43.8 77 517 A Y < - 0 0 26 -3,-1.0 2,-1.7 1,-0.0 -1,-0.2 -0.790 64.5-111.0 -94.5 144.9 -2.8 -23.3 41.0 78 518 A N > + 0 0 69 -2,-0.4 3,-0.6 1,-0.2 4,-0.3 -0.546 47.2 165.0 -78.7 83.6 -4.1 -24.9 37.9 79 519 A Y G >> + 0 0 5 -2,-1.7 4,-1.9 1,-0.2 3,-0.9 0.632 55.7 84.3 -74.9 -14.8 -1.3 -24.0 35.5 80 520 A S G 34 S+ 0 0 61 1,-0.3 -1,-0.2 2,-0.2 -2,-0.1 0.857 93.0 45.3 -62.0 -35.9 -2.4 -26.5 32.8 81 521 A L G <4 S+ 0 0 67 -3,-0.6 -1,-0.3 1,-0.2 -2,-0.2 0.640 114.6 50.4 -80.3 -15.5 -4.9 -24.1 31.3 82 522 A V T X>>S+ 0 0 0 -3,-0.9 4,-1.9 -4,-0.3 5,-1.7 0.755 85.9 94.4 -91.0 -30.1 -2.4 -21.2 31.4 83 523 A M B 3<5S-a 87 0A 31 -4,-1.9 5,-0.1 1,-0.3 459,-0.0 -0.499 104.8 -3.2 -76.2 128.1 0.6 -22.7 29.7 84 524 A G T 345S+ 0 0 82 3,-0.7 -1,-0.3 -2,-0.3 4,-0.1 0.485 135.6 57.7 73.2 4.7 0.9 -22.0 26.0 85 525 A A T <45S+ 0 0 51 -3,-1.3 457,-0.6 2,-0.3 -2,-0.2 0.677 116.9 7.8-128.1 -52.4 -2.5 -20.1 26.1 86 526 A C T <5S+ 0 0 1 -4,-1.9 2,-0.3 1,-0.3 458,-0.2 0.671 118.1 12.1-113.9 -26.5 -2.6 -17.2 28.6 87 527 A C B < -a 83 0A 2 -5,-1.7 -3,-0.7 453,-0.1 -2,-0.3 -0.998 50.2-152.8-159.4 152.3 1.0 -16.6 30.0 88 528 A E S S+ 0 0 33 -2,-0.3 434,-0.4 1,-0.2 3,-0.2 -0.855 75.8 23.9-128.3 166.3 4.8 -17.3 29.7 89 529 A N S S- 0 0 33 -2,-0.3 433,-0.6 432,-0.2 2,-0.3 0.885 84.3-165.2 44.6 48.3 7.8 -17.3 32.1 90 530 A V E +B 521 0B 2 431,-0.2 431,-0.3 -3,-0.2 -1,-0.2 -0.436 29.4 169.6 -75.5 122.9 5.3 -18.0 34.9 91 531 A I E - 0 0 0 429,-2.1 2,-0.3 -2,-0.3 430,-0.1 0.289 62.8 -67.3-110.3 4.5 6.5 -17.5 38.4 92 532 A G E -B 520 0B 0 428,-0.9 428,-1.8 -18,-0.1 2,-0.3 -0.996 60.5 -66.0 153.0-144.0 3.1 -17.6 40.2 93 533 A Y E -B 519 0B 26 -20,-2.0 445,-0.0 -2,-0.3 -16,-0.0 -0.988 24.7-130.5-150.3 158.2 -0.1 -15.7 40.5 94 534 A M E -B 518 0B 0 424,-2.3 424,-1.7 -2,-0.3 2,-0.4 -0.941 23.2-140.5-113.2 110.5 -1.5 -12.4 41.8 95 535 A P E -B 517 0B 2 0, 0.0 701,-0.1 0, 0.0 -2,-0.0 -0.617 16.4-170.2 -71.4 126.6 -4.6 -12.6 44.0 96 536 A I E -B 516 0B 9 420,-1.1 420,-2.2 -2,-0.4 22,-0.1 -0.982 27.8-119.3-116.0 116.9 -7.1 -9.8 43.4 97 537 A P E -B 515 0B 0 0, 0.0 20,-1.5 0, 0.0 2,-0.5 -0.277 25.6-149.4 -56.9 140.2 -9.9 -9.7 46.0 98 538 A V E -BC 514 116B 0 416,-2.5 415,-2.3 18,-0.2 416,-0.6 -0.975 15.9-178.4-116.2 121.7 -13.3 -10.2 44.5 99 539 A G E -BC 512 115B 0 16,-2.6 16,-2.3 -2,-0.5 2,-0.4 -0.619 22.6-123.9-104.3 173.2 -16.4 -8.6 46.1 100 540 A V E - C 0 114B 12 411,-1.2 2,-0.5 410,-0.3 27,-0.1 -0.983 16.7-167.2-124.6 128.3 -20.0 -8.9 45.0 101 541 A A E - C 0 113B 0 12,-2.4 12,-2.4 -2,-0.4 3,-0.3 -0.973 37.8 -74.8-114.2 121.0 -22.3 -5.9 44.1 102 542 A G E - 0 0 10 -2,-0.5 10,-0.1 1,-0.3 2,-0.1 -0.911 43.8 -57.8 164.3 173.7 -26.0 -6.7 43.8 103 543 A P E - 0 0 56 0, 0.0 2,-0.8 0, 0.0 -1,-0.3 0.191 57.2-169.5 -77.2 132.8 -28.7 -7.4 43.3 104 544 A L E - C 0 111B 0 7,-2.8 7,-1.7 -3,-0.3 2,-0.8 -0.861 13.6-147.8 -86.1 112.7 -28.4 -5.4 40.1 105 545 A C E + C 0 110B 25 -2,-0.8 34,-2.4 25,-0.3 2,-0.4 -0.772 32.5 159.5 -87.7 112.3 -32.0 -5.2 38.8 106 546 A L E > -dC 139 109B 0 3,-1.7 3,-1.6 -2,-0.8 34,-0.2 -0.983 61.6 -14.1-142.3 122.2 -31.7 -5.2 35.0 107 547 A D T 3 S- 0 0 24 32,-2.8 33,-0.1 -2,-0.4 -1,-0.1 0.925 125.0 -54.7 51.4 51.7 -34.3 -6.0 32.4 108 548 A E T 3 S+ 0 0 204 31,-0.4 -1,-0.3 1,-0.2 2,-0.2 0.572 121.7 97.3 60.2 13.5 -36.6 -7.7 35.0 109 549 A K E < -C 106 0B 111 -3,-1.6 -3,-1.7 -5,-0.1 2,-0.4 -0.715 68.5-126.8-118.4 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-1,-0.2 1,-0.3 -2,-0.1 0.769 95.7 52.2 -54.7 -31.1 -18.4 -18.1 67.3 443 461 B F G < S+ 0 0 94 -3,-0.9 2,-0.3 -10,-0.1 -1,-0.3 0.313 101.0 76.4 -94.2 7.2 -20.9 -20.2 69.3 444 462 B L S < S- 0 0 6 -3,-2.0 2,-0.1 -5,-0.1 -14,-0.0 -0.856 81.0-119.5-111.4 153.9 -23.4 -20.6 66.4 445 463 B S > - 0 0 48 -2,-0.3 4,-2.0 1,-0.1 3,-0.3 -0.431 29.8-107.2 -82.3 161.6 -23.0 -22.9 63.4 446 464 B D H > S+ 0 0 48 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.923 122.8 54.3 -50.9 -47.0 -22.9 -21.6 59.8 447 465 B A H > S+ 0 0 57 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.823 107.4 49.1 -60.5 -35.5 -26.4 -22.9 59.4 448 466 B E H > S+ 0 0 3 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.868 109.9 50.0 -72.4 -37.8 -27.7 -21.0 62.4 449 467 B I H X S+ 0 0 4 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.911 113.2 47.2 -66.1 -40.2 -26.2 -17.7 61.2 450 468 B I H X S+ 0 0 15 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.834 107.7 56.4 -67.8 -36.1 -27.7 -18.2 57.8 451 469 B Q H X S+ 0 0 64 -4,-1.6 4,-1.4 -5,-0.2 -2,-0.2 0.921 109.1 47.0 -59.0 -45.3 -31.1 -19.1 59.5 452 470 B L H <>S+ 0 0 0 -4,-2.0 5,-2.6 2,-0.2 6,-0.8 0.862 111.9 50.1 -63.4 -40.7 -30.9 -15.7 61.2 453 471 B V H ><5S+ 0 0 14 -4,-1.8 3,-1.4 1,-0.2 -2,-0.2 0.916 110.4 49.0 -67.5 -42.6 -30.0 -13.8 58.0 454 472 B N H 3<5S+ 0 0 93 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.766 109.5 52.5 -70.5 -25.7 -32.9 -15.4 56.0 455 473 B A T 3<5S- 0 0 47 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.166 117.1-115.2 -93.9 16.2 -35.4 -14.5 58.8 456 474 B K T < 5S+ 0 0 176 -3,-1.4 -3,-0.2 2,-0.2 -2,-0.1 0.746 81.7 121.8 60.9 31.7 -34.2 -10.9 58.7 457 475 B H S - 0 0 52 0, 0.0 3,-1.0 0, 0.0 4,-0.3 -0.530 24.6-124.3 -64.4 140.5 -28.6 -7.5 58.0 460 478 B A G > S+ 0 0 52 1,-0.3 3,-1.0 2,-0.2 4,-0.2 0.773 107.6 57.9 -63.5 -31.2 -26.2 -9.3 55.5 461 479 B Y G > S+ 0 0 148 1,-0.2 3,-1.0 2,-0.1 -1,-0.3 0.789 96.7 63.8 -69.7 -27.9 -23.7 -6.4 55.5 462 480 B K G X> S+ 0 0 91 -3,-1.0 4,-1.3 1,-0.2 3,-0.7 0.571 76.2 89.5 -73.0 -11.1 -23.3 -6.6 59.3 463 481 B L H <> S+ 0 0 3 -3,-1.0 4,-2.4 -4,-0.3 -1,-0.2 0.838 77.5 66.5 -50.0 -37.0 -21.8 -10.2 58.9 464 482 B E H <4 S+ 0 0 39 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.891 109.9 31.1 -55.5 -46.9 -18.4 -8.5 58.6 465 483 B T H <4 S+ 0 0 120 -3,-0.7 -1,-0.2 -4,-0.2 -2,-0.2 0.597 119.6 53.0 -92.0 -13.1 -18.2 -7.2 62.2 466 484 B L H < S+ 0 0 66 -4,-1.3 -25,-0.6 -3,-0.1 2,-0.2 0.815 94.8 77.9 -88.3 -37.7 -20.3 -9.9 63.9 467 485 B I S < S- 0 0 8 -4,-2.4 6,-0.1 -5,-0.2 -27,-0.0 -0.532 72.1-146.8 -78.6 145.9 -18.2 -12.8 62.5 468 486 B E S S+ 0 0 86 -2,-0.2 2,-0.2 2,-0.0 -1,-0.1 0.993 79.4 40.1 -80.6 -66.4 -15.0 -13.5 64.3 469 487 B T S > S- 0 0 76 1,-0.1 4,-1.3 2,-0.0 -1,-0.0 -0.575 75.1-139.5 -87.9 145.1 -12.6 -14.8 61.6 470 488 B H H > S+ 0 0 74 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.922 101.4 58.6 -79.1 -38.5 -12.8 -13.1 58.2 471 489 B E H > S+ 0 0 52 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.830 105.4 52.5 -51.8 -37.2 -12.4 -16.2 56.2 472 490 B R H > S+ 0 0 36 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.876 106.6 52.4 -69.7 -38.7 -15.5 -17.4 58.0 473 491 B G H X S+ 0 0 0 -4,-1.3 4,-2.3 2,-0.2 -2,-0.2 0.921 111.0 47.0 -57.1 -46.3 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105.9 54.3 -72.0 -12.6 -28.4 -20.2 47.0 484 502 B K T <4 S+ 0 0 133 -3,-1.5 -1,-0.3 -4,-0.5 -2,-0.2 0.584 91.9 93.6 -88.7 -14.9 -29.4 -17.1 45.1 485 503 B L S << S- 0 0 15 -3,-1.2 -105,-0.1 -4,-0.6 -104,-0.1 -0.488 81.1-124.8 -85.8 151.8 -27.6 -18.2 41.8 486 504 B S S S+ 0 0 110 -106,-0.4 -1,-0.1 1,-0.2 -106,-0.1 0.839 111.3 37.0 -60.7 -34.2 -29.2 -20.0 38.9 487 505 B E S > S- 0 0 91 -108,-0.2 3,-1.5 -107,-0.1 -1,-0.2 -0.963 76.5-159.8-118.1 110.7 -26.5 -22.6 39.3 488 506 B P T 3 S+ 0 0 83 0, 0.0 3,-0.4 0, 0.0 -1,-0.1 0.728 88.4 56.4 -63.0 -24.5 -25.6 -23.2 43.0 489 507 B S T > S+ 0 0 57 1,-0.2 3,-1.6 2,-0.1 4,-0.3 0.260 71.7 109.0 -90.8 12.1 -22.2 -24.7 42.3 490 508 B S T < S+ 0 0 1 -3,-1.5 3,-0.4 1,-0.3 -111,-0.2 0.780 75.4 53.3 -63.7 -25.9 -20.9 -21.7 40.3 491 509 B L T > S+ 0 0 4 -3,-0.4 3,-1.7 1,-0.2 -1,-0.3 0.484 74.7 105.8 -87.6 -2.4 -18.4 -20.7 43.0 492 510 B Q T < S+ 0 0 129 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.858 89.1 34.8 -41.4 -49.9 -16.7 -24.1 43.3 493 511 B Y T 3 S+ 0 0 120 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65 -3,-1.0 -1,-0.2 1,-0.1 -2,-0.2 0.519 120.0 45.4 -88.6 -7.6 -4.9 -6.3 54.9 504 522 B V T X>>S+ 0 0 0 -3,-0.7 4,-2.8 -4,-0.3 5,-1.4 0.841 84.9 92.3 -99.9 -50.9 -8.0 -6.2 52.5 505 523 B M B 3<5S+t 509 0G 30 -4,-2.8 5,-0.1 1,-0.3 -385,-0.0 -0.283 107.7 0.7 -55.2 120.4 -11.0 -5.9 54.8 506 524 B G T 345S+ 0 0 78 3,-0.9 -1,-0.3 1,-0.1 4,-0.1 0.895 135.6 54.1 67.4 43.8 -11.9 -2.2 55.3 507 525 B A T <45S+ 0 0 53 -3,-1.3 -387,-0.7 2,-0.3 -2,-0.2 0.259 119.7 10.1-166.6 -47.3 -9.0 -1.0 53.1 508 526 B C T <5S+ 0 0 2 -4,-2.8 2,-0.3 1,-0.3 -386,-0.2 0.606 119.5 14.7-121.8 -26.6 -9.1 -2.6 49.6 509 527 B C B < -t 505 0G 1 -5,-1.4 -3,-0.9 -391,-0.1 -1,-0.3 -1.000 50.2-153.5-158.8 152.7 -12.5 -4.5 49.2 510 528 B E S S+ 0 0 31 -2,-0.3 -410,-0.3 1,-0.2 3,-0.2 -0.872 76.1 19.5-127.6 161.2 -16.0 -5.2 50.5 511 529 B N S S- 0 0 36 -2,-0.3 -411,-1.2 -412,-0.2 2,-0.3 0.898 84.4-164.1 44.8 51.9 -18.5 -8.0 50.4 512 530 B V E +B 99 0B 0 -413,-0.2 -413,-0.3 -3,-0.2 -1,-0.2 -0.474 29.4 171.8 -77.2 125.6 -15.6 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2,-0.4 -434,-0.4 27,-0.1 -0.986 14.8-171.0-136.0 123.6 8.5 -12.1 34.0 523 541 B A E - E 0 535B 0 12,-2.2 12,-2.2 -2,-0.4 3,-0.3 -0.945 38.5 -38.9-110.5 136.5 10.1 -10.2 31.1 524 542 B G E - 0 0 14 -2,-0.4 10,-0.2 1,-0.3 2,-0.1 -0.886 43.3 -89.5 153.9 174.6 13.7 -9.2 31.5 525 543 B P E - 0 0 53 0, 0.0 2,-0.7 0, 0.0 -1,-0.3 0.321 56.0-168.0 -69.8 132.8 16.4 -8.4 32.0 526 544 B L E - E 0 533B 0 7,-2.5 7,-1.6 -3,-0.3 2,-1.1 -0.862 13.1-147.4 -86.3 115.1 15.3 -4.9 31.1 527 545 B C E + E 0 532B 23 -2,-0.7 34,-2.8 25,-0.4 2,-0.4 -0.742 33.9 160.9 -92.4 97.3 18.5 -2.9 30.7 528 546 B L E > -fE 561 531B 0 3,-1.2 3,-1.5 -2,-1.1 34,-0.2 -0.983 60.9 -14.9-130.0 124.3 17.5 0.6 31.8 529 547 B D T 3 S- 0 0 28 32,-2.4 -1,-0.2 -2,-0.4 33,-0.1 0.910 127.1 -52.8 49.1 51.6 19.7 3.4 33.0 530 548 B E T 3 S+ 0 0 207 31,-0.4 -1,-0.3 1,-0.2 2,-0.2 0.601 122.6 98.8 61.7 17.1 22.7 1.1 33.5 531 549 B K E < -E 528 0B 107 -3,-1.5 -3,-1.2 -5,-0.0 2,-0.4 -0.683 67.4-127.3-121.2 176.5 20.7 -1.3 35.7 532 550 B E E -E 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787 805 B V B S+z 636 0J 56 -152,-0.9 -150,-0.6 19,-0.1 5,-0.1 -0.957 95.2 8.0-121.1 145.5 3.0 3.0 49.0 788 806 B G S > S+ 0 0 27 -2,-0.4 3,-1.8 1,-0.2 19,-0.1 0.073 94.7 45.7 80.9 171.2 -0.7 2.7 49.7 789 807 B G G > S- 0 0 47 1,-0.3 3,-1.1 2,-0.2 -1,-0.2 -0.316 126.7 -9.0 60.8-131.1 -3.7 1.1 47.9 790 808 B G G > S+ 0 0 2 -43,-0.9 3,-1.2 1,-0.3 -1,-0.3 0.589 123.0 77.7 -76.8 -12.0 -3.0 -2.4 46.5 791 809 B T G < S+ 0 0 4 -3,-1.8 -1,-0.3 -44,-0.5 -2,-0.2 0.403 81.2 71.6 -75.7 0.6 0.8 -2.0 47.3 792 810 B N G < S+ 0 0 80 -3,-1.1 2,-0.3 -45,-0.2 -1,-0.2 0.593 79.5 89.0 -85.1 -16.9 -0.2 -2.8 51.0 793 811 B L S <> S- 0 0 2 -3,-1.2 4,-1.9 1,-0.1 3,-0.2 -0.658 81.4-129.4 -86.9 142.5 -0.9 -6.4 50.1 794 812 B L H > S+ 0 0 54 -2,-0.3 4,-1.7 1,-0.2 -723,-0.2 0.853 101.9 51.8 -65.4 -43.6 2.0 -8.8 50.4 795 813 B P H > S+ 0 0 14 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.899 113.0 46.7 -59.4 -40.8 1.9 -10.6 47.0 796 814 B Q H > S+ 0 0 0 -6,-0.2 4,-1.7 1,-0.2 3,-0.2 0.875 109.6 55.2 -67.5 -37.9 1.8 -7.2 45.2 797 815 B Q H X S+ 0 0 34 -4,-1.9 4,-2.8 1,-0.2 -1,-0.2 0.824 100.1 60.4 -62.8 -32.0 4.7 -6.1 47.5 798 816 B A H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.889 105.6 47.1 -63.7 -39.2 6.7 -9.2 46.3 799 817 B C H X S+ 0 0 0 -4,-1.2 4,-1.0 -54,-0.4 -1,-0.2 0.864 111.9 50.2 -70.5 -35.8 6.5 -7.9 42.7 800 818 B L H >X>S+ 0 0 0 -4,-1.7 5,-2.0 -55,-0.2 4,-0.5 0.911 109.1 52.0 -64.9 -41.7 7.5 -4.4 43.9 801 819 B Q H ><5S+ 0 0 51 -4,-2.8 3,-1.0 1,-0.2 -2,-0.2 0.861 99.4 64.9 -61.5 -38.1 10.4 -6.0 45.8 802 820 B M H 3<5S+ 0 0 9 -4,-1.8 -268,-0.3 1,-0.3 -738,-0.3 0.887 108.9 39.0 -46.6 -46.1 11.4 -7.8 42.5 803 821 B L H <<5S- 0 0 8 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.469 113.9-117.5 -88.5 -5.3 12.2 -4.3 41.0 804 822 B G T <<5S+ 0 0 48 -3,-1.0 -3,-0.2 -4,-0.5 -2,-0.1 0.786 88.2 104.3 74.8 31.0 13.7 -2.9 44.3 805 823 B V < + 0 0 0 -5,-2.0 -4,-0.2 14,-0.0 15,-0.1 0.183 38.5 138.5-128.1 11.3 11.0 -0.2 44.6 806 824 B Q - 0 0 71 -6,-0.4 -19,-0.1 -9,-0.1 -20,-0.1 -0.359 63.4 -18.6 -67.7 140.0 8.7 -1.5 47.4 807 825 B G S S- 0 0 9 -21,-1.5 2,-0.2 -16,-0.2 -20,-0.1 -0.025 103.9 -20.6 65.6-162.9 7.4 1.1 49.9 808 826 B A - 0 0 61 8,-0.1 2,-0.8 -22,-0.1 -2,-0.1 -0.558 49.7-132.5 -88.2 142.6 8.8 4.5 50.7 809 827 B C - 0 0 23 -2,-0.2 6,-0.2 1,-0.2 5,-0.1 -0.848 20.3-163.7 -88.9 110.9 12.3 5.8 50.0 810 828 B K S S+ 0 0 190 -2,-0.8 -1,-0.2 1,-0.2 -2,-0.0 0.930 82.0 34.8 -63.5 -49.7 13.3 7.4 53.4 811 829 B D S S+ 0 0 140 1,-0.3 -1,-0.2 2,-0.0 -2,-0.0 0.880 129.0 30.2 -80.4 -42.8 16.3 9.5 52.2 812 830 B N S > S- 0 0 66 -4,-0.0 3,-1.8 0, 0.0 -1,-0.3 -0.815 86.6-147.8-117.5 87.2 15.1 10.5 48.7 813 831 B P T 3 S+ 0 0 60 0, 0.0 -179,-0.1 0, 0.0 -3,-0.1 -0.324 80.0 21.5 -61.7 131.6 11.3 10.7 48.9 814 832 B G T 3> S+ 0 0 2 -5,-0.1 4,-2.6 -181,-0.1 3,-0.2 0.114 86.7 112.7 101.7 -17.1 9.6 9.8 45.6 815 833 B E H <> S+ 0 0 45 -3,-1.8 4,-2.2 1,-0.2 5,-0.1 0.800 75.2 52.1 -60.6 -34.6 12.5 7.8 44.1 816 834 B N H > S+ 0 0 23 -4,-0.3 4,-1.7 2,-0.2 -1,-0.2 0.892 113.2 42.2 -70.6 -42.7 10.6 4.4 44.3 817 835 B A H > S+ 0 0 0 -3,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.906 116.1 50.5 -68.3 -43.2 7.5 5.7 42.5 818 836 B R H X S+ 0 0 32 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.903 110.3 49.6 -57.7 -45.0 9.7 7.5 40.0 819 837 B Q H X S+ 0 0 13 -4,-2.2 4,-1.8 1,-0.2 -1,-0.2 0.858 109.5 51.1 -66.2 -37.9 11.8 4.4 39.4 820 838 B L H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.871 108.1 53.0 -65.8 -37.3 8.7 2.3 38.8 821 839 B A H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.889 108.6 49.6 -65.1 -40.7 7.4 4.9 36.3 822 840 B R H X S+ 0 0 43 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.867 110.5 50.8 -63.4 -38.2 10.7 4.6 34.4 823 841 B I H X S+ 0 0 0 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.840 109.6 50.5 -67.8 -34.8 10.4 0.8 34.4 824 842 B V H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.924 112.2 46.5 -69.0 -44.0 6.9 1.1 33.0 825 843 B C H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.894 114.1 47.6 -65.2 -43.0 8.0 3.4 30.2 826 844 B G H X S+ 0 0 0 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.839 111.6 49.8 -66.2 -36.1 11.0 1.2 29.4 827 845 B T H X S+ 0 0 0 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.879 108.2 54.2 -72.1 -38.0 8.9 -2.0 29.4 828 846 B V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.920 107.0 51.5 -56.1 -43.8 6.3 -0.3 27.1 829 847 B M H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.875 108.0 52.0 -65.4 -36.2 9.2 0.5 24.7 830 848 B A H X S+ 0 0 0 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.938 110.9 47.4 -62.0 -46.7 10.2 -3.2 24.8 831 849 B G H X S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-0.3 0.834 110.4 52.4 -62.7 -34.1 6.6 -4.2 23.9 832 850 B E H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.934 107.2 52.8 -69.3 -46.0 6.5 -1.6 21.1 833 851 B L H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.903 114.3 41.9 -50.5 -46.2 9.7 -3.0 19.6 834 852 B S H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.933 116.2 43.5 -79.0 -47.7 8.4 -6.5 19.5 835 853 B L H X S+ 0 0 49 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.899 114.9 50.8 -64.6 -41.6 4.8 -6.0 18.4 836 854 B M H X S+ 0 0 0 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.892 108.2 52.3 -65.0 -39.3 5.9 -3.5 15.7 837 855 B A H X S+ 0 0 1 -4,-1.7 4,-1.7 -5,-0.3 -1,-0.2 0.900 110.0 49.6 -60.2 -39.5 8.5 -6.0 14.4 838 856 B A H X S+ 0 0 48 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.847 111.7 47.5 -69.8 -35.7 5.8 -8.6 14.1 839 857 B L H < S+ 0 0 30 -4,-2.0 -596,-0.2 1,-0.2 -1,-0.2 0.804 111.5 52.9 -70.0 -30.9 3.5 -6.3 12.2 840 858 B A H < S+ 0 0 22 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.851 110.6 43.9 -75.7 -36.8 6.4 -5.3 9.9 841 859 B A H < S- 0 0 68 -4,-1.7 2,-0.3 1,-0.3 -1,-0.2 0.806 100.6-147.4 -79.2 -32.7 7.4 -8.8 8.9 842 860 B G < 0 0 38 -4,-1.3 -1,-0.3 -5,-0.2 -2,-0.1 -0.694 360.0 360.0 100.9-152.9 3.9 -10.0 8.3 843 861 B H 0 0 215 -2,-0.3 -4,-0.1 -4,-0.1 -1,-0.1 -0.386 360.0 360.0 62.0 360.0 2.5 -13.6 8.8 844 !* 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 0.0 845 444 C P > 0 0 101 0, 0.0 4,-1.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 134.5 6.7 48.2 -33.6 846 445 C N H > + 0 0 63 1,-0.2 4,-0.9 2,-0.2 3,-0.2 0.918 360.0 37.9 -57.3 -60.1 8.6 46.0 -31.1 847 446 C E H > S+ 0 0 144 1,-0.2 4,-1.0 2,-0.2 -1,-0.2 0.699 111.2 58.6 -77.4 -21.6 12.2 47.3 -31.0 848 447 C E H > S+ 0 0 127 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.887 105.6 51.4 -67.3 -40.5 11.2 51.0 -31.2 849 448 C C H X S+ 0 0 3 -4,-1.4 4,-1.0 -3,-0.2 -2,-0.2 0.758 102.4 60.2 -68.8 -27.4 9.1 50.5 -28.0 850 449 C L H X S+ 0 0 57 -4,-0.9 4,-1.0 1,-0.2 3,-0.3 0.872 101.4 53.0 -67.0 -39.7 12.1 48.9 -26.2 851 450 C Q H < S+ 0 0 147 -4,-1.0 4,-0.5 -3,-0.2 -1,-0.2 0.797 104.8 56.5 -65.0 -30.1 14.2 52.1 -26.6 852 451 C I H >< S+ 0 0 49 -4,-0.9 3,-0.5 1,-0.2 -1,-0.2 0.793 100.9 56.8 -74.4 -30.0 11.4 54.2 -25.1 853 452 C L H 3< S+ 0 0 39 -4,-1.0 5,-0.3 -3,-0.3 -1,-0.2 0.844 99.5 61.9 -64.8 -34.4 11.4 52.0 -21.9 854 453 C G T 3< 0 0 71 -4,-1.0 -1,-0.2 1,-0.2 -2,-0.2 0.698 360.0 360.0 -67.7 -23.1 15.1 52.9 -21.4 855 454 C N < 0 0 160 -3,-0.5 -1,-0.2 -4,-0.5 -2,-0.2 0.502 360.0 360.0 -86.8 360.0 14.5 56.6 -21.0 856 ! 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 0.0 857 458 C G > 0 0 35 0, 0.0 3,-1.3 0, 0.0 -3,-0.1 0.000 360.0 360.0 360.0-158.9 9.7 55.7 -20.0 858 459 C A G > + 0 0 8 25,-0.4 3,-1.5 -5,-0.3 -5,-0.1 0.732 360.0 70.1 -66.7 -24.5 6.7 53.2 -19.8 859 460 C K G 3 S+ 0 0 168 1,-0.3 -1,-0.3 -6,-0.1 -6,-0.1 0.751 91.0 61.5 -63.2 -25.1 4.2 56.1 -19.6 860 461 C F G < S+ 0 0 166 -3,-1.3 2,-0.3 -8,-0.2 -1,-0.3 0.356 95.5 74.9 -87.2 4.5 5.0 56.9 -23.3 861 462 C L S < S- 0 0 6 -3,-1.5 2,-0.1 -9,-0.1 -12,-0.0 -0.884 79.4-122.6-113.1 150.7 3.7 53.4 -24.5 862 463 C S > - 0 0 56 -2,-0.3 4,-1.8 1,-0.1 3,-0.3 -0.396 30.5-103.5 -82.3 165.0 0.1 52.1 -24.8 863 464 C D H > S+ 0 0 51 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.896 121.6 52.0 -49.2 -48.0 -1.3 49.1 -23.0 864 465 C A H > S+ 0 0 65 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.831 106.2 52.7 -64.2 -36.1 -1.1 47.1 -26.3 865 466 C E H > S+ 0 0 61 -3,-0.3 4,-1.5 2,-0.2 -1,-0.2 0.869 110.2 47.3 -71.9 -38.0 2.5 47.9 -26.9 866 467 C I H X S+ 0 0 6 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.882 113.5 49.3 -64.7 -40.7 3.6 46.7 -23.4 867 468 C I H X S+ 0 0 17 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.866 110.1 49.8 -67.6 -39.2 1.5 43.5 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47.4 14.5 1205 806 C G S > S+ 0 0 29 -2,-0.4 3,-1.4 1,-0.2 2,-0.2 0.133 94.2 34.5 89.7 156.3 -1.2 45.6 11.7 1206 807 C G G > S- 0 0 42 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 -0.417 127.7 -7.0 72.2-135.8 -2.3 43.3 8.9 1207 808 C G G > S+ 0 0 2 -43,-0.9 3,-1.5 1,-0.3 -1,-0.3 0.665 125.2 74.6 -67.2 -18.5 -5.7 44.1 7.3 1208 809 C T G < S+ 0 0 3 -3,-1.4 -1,-0.3 -44,-0.7 -2,-0.2 0.558 83.7 67.8 -73.0 -8.8 -6.3 46.7 10.0 1209 810 C N G < S+ 0 0 78 -3,-1.4 -1,-0.3 -45,-0.2 2,-0.2 0.561 83.6 90.9 -80.0 -12.4 -3.8 48.9 8.2 1210 811 C L S <> S- 0 0 3 -3,-1.5 4,-1.8 -4,-0.1 5,-0.1 -0.630 80.7-129.2 -86.8 148.2 -6.3 49.3 5.3 1211 812 C L H > S+ 0 0 59 -2,-0.2 4,-1.8 2,-0.2 96,-0.2 0.856 102.5 50.2 -73.3 -42.2 -8.7 52.2 5.4 1212 813 C P H > S+ 0 0 14 0, 0.0 4,-1.3 0, 0.0 -1,-0.2 0.907 114.4 47.5 -59.7 -39.8 -12.1 50.5 4.8 1213 814 C Q H > S+ 0 0 0 -6,-0.3 4,-1.7 1,-0.2 -2,-0.2 0.859 109.0 54.5 -67.6 -36.4 -11.2 48.0 7.6 1214 815 C Q H X S+ 0 0 34 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.835 102.2 58.5 -64.7 -32.4 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0.857 113.1 49.7 -69.0 -38.5 -7.5 44.7 21.1 1235 836 C R H X S+ 0 0 28 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.863 110.5 51.3 -65.4 -38.0 -9.0 43.5 24.5 1236 837 C Q H X S+ 0 0 8 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.883 109.5 48.3 -67.8 -42.4 -12.1 45.6 23.8 1237 838 C L H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.932 108.8 54.7 -63.7 -45.0 -12.6 44.1 20.3 1238 839 C A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.884 109.2 48.1 -52.8 -41.1 -12.2 40.6 21.8 1239 840 C R H X S+ 0 0 45 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.844 110.4 51.0 -69.5 -36.5 -15.0 41.5 24.3 1240 841 C I H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.878 109.7 51.0 -64.5 -42.4 -17.2 42.8 21.5 1241 842 C V H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.950 112.5 45.5 -59.4 -51.3 -16.6 39.5 19.5 1242 843 C C H X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 -2,-0.2 0.867 115.0 47.2 -64.4 -38.3 -17.5 37.4 22.5 1243 844 C G H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.878 112.9 48.3 -70.1 -38.8 -20.6 39.5 23.3 1244 845 C T H X S+ 0 0 0 -4,-2.6 4,-2.2 2,-0.2 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4,-2.0 -5,-0.2 -1,-0.2 0.926 108.2 49.3 -63.2 -45.9 -34.3 30.3 20.0 1255 856 C A H X S+ 0 0 51 -4,-2.1 4,-0.8 1,-0.2 -2,-0.2 0.843 111.3 49.8 -63.5 -34.3 -35.2 29.5 16.4 1256 857 C L H < S+ 0 0 20 -4,-1.9 223,-0.2 2,-0.2 -1,-0.2 0.854 110.1 50.3 -73.0 -34.5 -34.1 25.8 16.9 1257 858 C A H < S+ 0 0 24 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.876 109.8 49.4 -70.1 -38.9 -36.1 25.5 20.1 1258 859 C A H < 0 0 60 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.686 360.0 360.0 -74.7 -20.4 -39.3 26.9 18.4 1259 860 C G < 0 0 100 -4,-0.8 -1,-0.2 -5,-0.2 -2,-0.1 -0.127 360.0 360.0 62.0 360.0 -38.7 24.4 15.6 1260 !* 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 1261 458 D G > 0 0 77 0, 0.0 3,-0.6 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 -93.6 -43.8 58.6 -2.8 1262 459 D A G > + 0 0 16 18,-0.5 3,-1.0 1,-0.2 8,-0.1 0.676 360.0 70.6 -75.4 -19.6 -40.4 58.6 -1.1 1263 460 D K G 3 S+ 0 0 159 1,-0.2 -1,-0.2 18,-0.0 18,-0.0 0.762 93.1 55.6 -68.8 -27.2 -38.8 60.2 -4.2 1264 461 D F G < S+ 0 0 174 -3,-0.6 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3.1-179.6-125.0 99.6 -9.0 16.9 3.0 1594 798 D P E S+ 0 0 11 0, 0.0 -96,-1.3 0, 0.0 -1,-0.1 0.568 72.7 41.4 -81.3 -8.0 -12.1 14.9 4.1 1595 799 D S E + 0 0 0 -23,-0.4 2,-0.8 -26,-0.3 -23,-0.3 -0.392 60.9 160.5-145.2 60.4 -14.6 17.7 4.7 1596 800 D I E -S 1500 0R 0 -96,-2.8 -96,-2.9 -3,-0.4 2,-0.7 -0.766 24.0-158.0 -88.9 111.8 -14.5 20.5 2.1 1597 801 D E + 0 0 0 -2,-0.8 2,-0.3 -31,-0.3 -34,-0.2 -0.811 34.4 143.3 -97.7 112.1 -17.9 22.3 2.2 1598 802 D I + 0 0 1 -2,-0.7 2,-0.3 -147,-0.2 33,-0.1 -0.974 26.8 175.7-157.3 153.9 -18.3 24.0 -1.1 1599 803 D G - 0 0 2 -2,-0.3 -149,-0.2 31,-0.1 -150,-0.1 -0.984 24.4-155.2-164.1 153.4 -20.6 25.2 -3.9 1600 804 D T S S+ 0 0 1 -151,-2.6 21,-1.6 -2,-0.3 2,-0.3 0.370 85.4 54.3-115.6 -2.2 -20.7 27.1 -7.2 1601 805 D V B S+a 1450 0U 47 -152,-1.0 -150,-0.6 20,-0.1 3,-0.1 -0.980 95.1 21.1-126.6 148.2 -24.4 28.1 -7.0 1602 806 D G S > S+ 0 0 31 -2,-0.3 3,-1.6 1,-0.2 4,-0.1 -0.021 94.9 36.7 87.8 167.4 -26.3 29.9 -4.2 1603 807 D G G > S- 0 0 43 1,-0.3 3,-1.6 2,-0.2 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-64.2 -46.9 -16.5 18.9 -7.4 1633 837 D Q H X S+ 0 0 15 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.885 110.0 52.0 -59.0 -41.6 -14.0 20.6 -9.6 1634 838 D L H X S+ 0 0 0 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.877 107.2 52.3 -67.0 -36.9 -13.7 23.5 -7.2 1635 839 D A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.910 108.9 50.7 -61.7 -43.5 -13.1 21.2 -4.3 1636 840 D R H X S+ 0 0 31 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.929 109.2 51.0 -61.2 -44.6 -10.2 19.6 -6.3 1637 841 D I H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.896 109.9 50.2 -60.1 -41.2 -8.8 23.1 -7.0 1638 842 D V H X S+ 0 0 0 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.911 112.1 46.5 -62.4 -43.5 -8.9 23.9 -3.3 1639 843 D C H X S+ 0 0 0 -4,-2.3 4,-1.6 1,-0.2 -2,-0.2 0.915 114.7 48.2 -68.8 -40.4 -7.2 20.7 -2.3 1640 844 D G H X S+ 0 0 0 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.880 112.2 47.2 -62.6 -43.1 -4.6 21.3 -5.0 1641 845 D T H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.834 108.8 55.6 -72.1 -33.6 -3.9 24.9 -4.0 1642 846 D V H X S+ 0 0 0 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.884 105.6 52.7 -60.6 -40.3 -3.7 23.9 -0.4 1643 847 D M H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.914 107.1 51.4 -65.5 -41.7 -0.9 21.4 -1.4 1644 848 D A H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.914 110.6 49.5 -55.0 -46.5 1.0 24.2 -3.2 1645 849 D G H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 5,-0.3 0.879 109.2 51.4 -61.8 -40.5 0.7 26.3 -0.0 1646 850 D E H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 5,-0.3 0.906 108.3 52.7 -63.6 -42.8 2.0 23.4 2.1 1647 851 D L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.959 113.2 42.0 -56.4 -54.7 5.0 22.9 -0.1 1648 852 D S H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.885 117.5 42.8 -65.7 -46.5 6.1 26.5 -0.0 1649 853 D L H X S+ 0 0 49 -4,-2.1 4,-1.7 2,-0.2 -1,-0.2 0.903 114.3 51.1 -69.7 -41.6 5.6 27.3 3.7 1650 854 D M H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.902 109.6 51.4 -61.7 -40.4 7.1 23.9 4.8 1651 855 D A H X S+ 0 0 0 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.903 107.4 52.8 -61.1 -42.2 10.1 24.6 2.6 1652 856 D A H < S+ 0 0 59 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.839 111.1 47.7 -62.3 -34.2 10.5 28.1 4.2 1653 857 D L H < S+ 0 0 27 -4,-1.7 -571,-0.2 1,-0.1 -1,-0.2 0.856 110.5 49.5 -74.6 -39.1 10.5 26.4 7.7 1654 858 D A H < 0 0 27 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.1 0.910 360.0 360.0 -68.5 -45.4 13.0 23.7 6.9 1655 859 D A < 0 0 84 -4,-2.1 -1,-0.3 -138,-0.2 -574,-0.1 -0.351 360.0 360.0 -79.9 360.0 15.5 26.2 5.4