==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 09-JAN-01 1HW9 . COMPND 2 MOLECULE: HMG-COA REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.S.ISTVAN,J.DEISENHOFER . 1583 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 51596.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1169 73.8 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 . 262 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 . 4 0.3 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 . 113 7.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 163 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 517 32.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 38 2.4 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 8 4 8 0 1 4 1 8 8 7 0 1 0 0 4 0 0 0 0 0 0 0 2 2 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 6 4 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 0 143 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 83.1 44.0 31.0 -9.7 2 443 A R - 0 0 108 1,-0.1 5,-0.1 2,-0.1 0, 0.0 -0.206 360.0 -90.4 -63.2 150.4 45.1 33.3 -6.9 3 444 A P >> - 0 0 74 0, 0.0 4,-1.0 0, 0.0 3,-0.7 -0.104 40.1-105.8 -57.3 156.9 47.2 32.2 -3.9 4 445 A N T 34 S+ 0 0 65 1,-0.2 -2,-0.1 2,-0.2 3,-0.0 0.750 116.8 57.8 -59.2 -29.2 45.4 31.0 -0.8 5 446 A E T 34 S+ 0 0 201 1,-0.2 -1,-0.2 2,-0.2 -3,-0.0 0.858 104.4 52.2 -70.9 -34.5 46.1 34.1 1.3 6 447 A E T <4 0 0 130 -3,-0.7 -1,-0.2 1,-0.1 -2,-0.2 0.762 360.0 360.0 -71.5 -26.0 44.4 36.3 -1.3 7 448 A C < 0 0 49 -4,-1.0 -2,-0.2 -5,-0.1 -3,-0.1 0.873 360.0 360.0 -96.7 360.0 41.3 34.2 -1.2 8 ! 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 9 460 A K 0 0 189 0, 0.0 2,-1.1 0, 0.0 26,-0.2 0.000 360.0 360.0 360.0 -53.6 32.3 35.2 -1.3 10 461 A F + 0 0 158 24,-0.1 2,-0.1 25,-0.0 24,-0.0 -0.668 360.0 125.2 -80.9 98.1 32.3 35.5 -5.1 11 462 A L - 0 0 57 -2,-1.1 2,-0.3 1,-0.0 3,-0.1 -0.223 64.1 -61.7-124.1-145.5 35.6 34.0 -6.3 12 463 A S > - 0 0 44 1,-0.1 4,-1.7 -2,-0.1 3,-0.3 -0.855 33.9-127.4-112.0 148.6 36.4 31.2 -8.8 13 464 A D H >> S+ 0 0 48 -2,-0.3 4,-2.5 1,-0.2 3,-0.6 0.958 112.8 51.1 -56.7 -51.6 35.3 27.6 -8.5 14 465 A A H 3> S+ 0 0 57 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.781 109.6 52.9 -56.9 -29.0 38.9 26.3 -8.9 15 466 A E H 3> S+ 0 0 7 -3,-0.3 4,-1.3 2,-0.2 -1,-0.3 0.824 107.6 48.5 -77.0 -35.3 39.9 28.7 -6.1 16 467 A I H S+ 0 0 13 -4,-2.7 5,-1.1 1,-0.2 4,-0.3 0.922 111.5 48.4 -59.5 -47.4 39.0 23.3 0.5 21 472 A N H <5S+ 0 0 81 -4,-2.6 3,-0.3 3,-0.2 -1,-0.2 0.921 118.7 40.0 -60.0 -45.6 42.0 21.1 -0.2 22 473 A A H <5S+ 0 0 47 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.973 119.1 38.7 -71.2 -62.0 44.4 23.3 1.7 23 474 A K T <5S- 0 0 150 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.1 0.321 106.0-125.4 -75.5 12.5 42.5 24.5 4.8 24 475 A H T 5 + 0 0 165 -3,-0.3 -3,-0.2 -4,-0.3 -4,-0.1 0.839 45.3 175.1 44.3 44.7 41.1 21.0 5.0 25 476 A I < - 0 0 44 -5,-1.1 -1,-0.2 -6,-0.3 2,-0.1 -0.655 31.9-117.8 -81.9 127.9 37.5 22.4 5.0 26 477 A P > - 0 0 52 0, 0.0 3,-1.7 0, 0.0 4,-0.1 -0.432 17.7-124.2 -67.4 140.5 34.8 19.7 4.8 27 478 A A G > S+ 0 0 26 1,-0.3 3,-2.4 2,-0.2 4,-0.1 0.809 103.0 72.2 -54.0 -35.7 32.5 19.8 1.8 28 479 A Y G 3 S+ 0 0 135 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.510 86.3 66.8 -64.1 -0.9 29.3 20.1 3.9 29 480 A K G X S+ 0 0 110 -3,-1.7 3,-1.1 1,-0.2 -1,-0.3 0.498 71.8 95.7 -94.3 -5.8 30.2 23.7 4.8 30 481 A L G X> S+ 0 0 2 -3,-2.4 4,-1.2 1,-0.3 3,-0.6 0.619 77.5 58.9 -60.2 -15.8 29.8 24.8 1.2 31 482 A E G 34 S+ 0 0 31 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.1 0.799 110.2 41.1 -83.0 -31.8 26.2 25.9 1.9 32 483 A T G <4 S+ 0 0 126 -3,-1.1 -1,-0.2 -4,-0.1 -2,-0.2 -0.210 121.9 42.0-107.3 39.1 27.3 28.3 4.6 33 484 A L T <4 S+ 0 0 69 -3,-0.6 2,-0.3 1,-0.3 -2,-0.2 0.386 102.6 68.3-152.5 -27.6 30.3 29.6 2.6 34 485 A I S < S- 0 0 8 -4,-1.2 -1,-0.3 -5,-0.2 6,-0.1 -0.796 72.4-128.4-109.9 148.4 29.1 29.9 -1.0 35 486 A E S S+ 0 0 71 -2,-0.3 2,-0.2 -26,-0.2 -1,-0.1 0.976 85.3 34.5 -52.9 -90.7 26.5 32.4 -2.5 36 487 A T S >> S- 0 0 73 1,-0.1 3,-1.4 2,-0.0 4,-1.0 -0.499 79.8-124.6 -75.2 143.2 23.8 30.6 -4.5 37 488 A H H >> S+ 0 0 72 1,-0.3 4,-1.2 2,-0.2 3,-0.6 0.876 108.0 56.4 -50.6 -47.9 22.6 27.2 -3.3 38 489 A E H 3> S+ 0 0 55 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.612 100.6 58.7 -63.1 -18.0 23.4 25.4 -6.6 39 490 A R H <> S+ 0 0 26 -3,-1.4 4,-2.7 2,-0.2 -1,-0.2 0.829 100.3 54.9 -81.7 -34.0 27.0 26.5 -6.5 40 491 A G H X S+ 0 0 16 -4,-2.9 3,-0.7 1,-0.2 4,-0.6 0.934 115.4 40.9 -62.7 -45.4 35.2 18.0 -5.3 48 499 A L H >X S+ 0 0 15 -4,-2.8 4,-0.8 1,-0.2 3,-0.7 0.807 100.1 74.0 -72.5 -32.5 33.9 14.4 -5.3 49 500 A S H 3< S+ 0 0 31 -4,-1.7 -1,-0.2 1,-0.2 3,-0.2 0.746 93.6 55.0 -53.7 -28.2 34.5 14.0 -9.1 50 501 A K H << S+ 0 0 110 -3,-0.7 -1,-0.2 -4,-0.7 -2,-0.2 0.864 99.8 57.5 -75.0 -40.0 38.2 13.7 -8.4 51 502 A K H << S+ 0 0 130 -3,-0.7 -1,-0.2 -4,-0.6 -2,-0.2 0.660 91.0 98.9 -65.0 -19.3 37.9 10.8 -5.9 52 503 A L S < S- 0 0 14 -4,-0.8 716,-0.1 -3,-0.2 717,-0.1 -0.412 72.4-142.2 -75.7 145.5 36.1 8.7 -8.6 53 504 A S S S+ 0 0 104 1,-0.3 -1,-0.1 715,-0.2 715,-0.1 0.623 108.0 42.7 -75.7 -15.5 37.8 6.1 -10.7 54 505 A E S > S- 0 0 65 713,-0.1 3,-1.9 714,-0.1 -1,-0.3 -0.863 74.5-170.4-132.4 91.3 35.5 7.5 -13.4 55 506 A P T 3 S+ 0 0 79 0, 0.0 3,-0.4 0, 0.0 4,-0.1 0.757 84.6 58.2 -54.7 -27.7 35.6 11.4 -13.1 56 507 A S T > S+ 0 0 78 1,-0.2 3,-0.9 2,-0.1 4,-0.2 0.301 73.0 106.0 -89.9 11.8 32.7 11.7 -15.6 57 508 A S G X S+ 0 0 1 -3,-1.9 3,-0.8 1,-0.2 -1,-0.2 0.921 77.4 50.6 -53.9 -51.4 30.3 9.5 -13.6 58 509 A L G > S+ 0 0 7 -3,-0.4 3,-3.4 1,-0.2 -1,-0.2 0.625 77.3 103.9 -64.7 -17.9 28.1 12.5 -12.4 59 510 A Q G < S+ 0 0 136 -3,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.742 89.1 37.4 -36.1 -39.5 27.6 13.9 -15.9 60 511 A Y G < S+ 0 0 124 -3,-0.8 -1,-0.3 -4,-0.2 -2,-0.1 0.324 90.1 103.2-101.2 6.9 24.0 12.6 -16.0 61 512 A L S < S- 0 0 3 -3,-3.4 22,-0.1 703,-0.1 701,-0.0 -0.821 72.7-130.2 -92.0 112.7 23.1 13.2 -12.4 62 513 A P + 0 0 32 0, 0.0 20,-2.0 0, 0.0 -2,-0.1 -0.150 45.6 146.2 -61.7 152.4 20.8 16.3 -12.3 63 514 A Y + 0 0 31 18,-0.3 3,-0.3 1,-0.1 18,-0.1 0.385 41.7 96.4-156.0 -28.8 21.4 19.2 -9.9 64 515 A R S S+ 0 0 153 1,-0.2 -1,-0.1 -22,-0.0 0, 0.0 -0.351 81.1 22.6 -75.7 152.6 20.4 22.4 -11.6 65 516 A D S S+ 0 0 150 1,-0.2 2,-0.4 -2,-0.1 -1,-0.2 0.918 88.4 129.9 59.7 51.5 17.0 24.2 -11.2 66 517 A Y - 0 0 24 -3,-0.3 2,-1.6 16,-0.0 -1,-0.2 -0.999 64.7-117.2-136.9 140.6 16.1 22.6 -7.8 67 518 A N >> + 0 0 66 -2,-0.4 3,-0.6 1,-0.2 4,-0.5 -0.543 39.4 165.8 -77.6 85.4 14.8 24.2 -4.6 68 519 A Y H 3> + 0 0 2 -2,-1.6 4,-2.8 1,-0.2 -1,-0.2 0.588 61.0 79.1 -77.2 -12.3 17.6 23.2 -2.2 69 520 A S H 34 S+ 0 0 62 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 0.871 95.6 45.6 -63.2 -39.0 16.5 25.7 0.5 70 521 A L H <4 S+ 0 0 61 -3,-0.6 -1,-0.2 1,-0.1 -2,-0.2 0.781 116.7 47.4 -73.6 -28.2 13.7 23.3 1.7 71 522 A V H >X>S+ 0 0 0 -4,-0.5 4,-2.9 3,-0.1 3,-1.8 0.903 89.3 90.9 -79.8 -49.1 16.2 20.4 1.6 72 523 A M B 3<5S+a 76 0A 47 -4,-2.8 5,-0.1 1,-0.3 436,-0.0 -0.311 104.2 2.1 -57.8 127.7 19.2 21.9 3.5 73 524 A G T 345S+ 0 0 75 3,-0.6 -1,-0.3 1,-0.1 4,-0.1 0.696 135.6 53.1 68.5 21.7 19.2 21.3 7.2 74 525 A A T <45S+ 0 0 51 -3,-1.8 434,-0.8 2,-0.4 -2,-0.2 0.508 115.2 13.1-148.7 -46.4 16.0 19.3 6.9 75 526 A C T <5S+ 0 0 1 -4,-2.9 2,-0.3 1,-0.3 -3,-0.2 0.586 117.4 8.0-120.1 -15.1 15.9 16.4 4.4 76 527 A C B < -a 72 0A 0 -5,-1.2 -3,-0.6 430,-0.2 -2,-0.4 -0.985 51.2-149.1-167.2 153.4 19.4 15.6 3.3 77 528 A E S S+ 0 0 32 -2,-0.3 411,-0.3 1,-0.2 3,-0.2 -0.863 78.1 24.0-125.2 161.6 23.1 16.3 3.8 78 529 A N S S- 0 0 21 -2,-0.3 410,-0.9 409,-0.2 -1,-0.2 0.856 83.5-164.2 51.7 42.4 26.2 16.3 1.5 79 530 A V E +B 487 0B 0 408,-0.2 408,-0.3 -3,-0.2 -1,-0.2 -0.321 28.4 168.3 -63.9 129.2 23.8 17.0 -1.4 80 531 A I E - 0 0 0 406,-2.5 2,-0.3 1,-0.3 407,-0.1 0.156 63.5 -61.6-123.8 14.5 25.2 16.4 -4.9 81 532 A G E -B 486 0B 0 405,-0.7 405,-2.7 -18,-0.1 2,-0.3 -0.964 62.1 -71.3 141.4-157.6 22.0 16.5 -6.9 82 533 A Y E -B 485 0B 19 -20,-2.0 422,-0.1 -2,-0.3 -16,-0.0 -0.975 24.5-129.5-142.6 153.1 18.6 14.8 -7.1 83 534 A M E -B 484 0B 0 401,-2.9 401,-2.1 -2,-0.3 2,-0.5 -0.913 23.1-143.1-106.3 112.5 17.3 11.4 -8.4 84 535 A P E -B 483 0B 2 0, 0.0 678,-0.1 0, 0.0 -2,-0.0 -0.632 14.2-166.4 -76.9 121.2 14.3 11.7 -10.8 85 536 A I E -B 482 0B 7 397,-2.1 397,-2.9 -2,-0.5 22,-0.1 -0.939 27.8-113.7-110.6 122.0 11.7 8.9 -10.3 86 537 A P E -B 481 0B 0 0, 0.0 20,-2.1 0, 0.0 2,-0.5 -0.230 30.1-150.7 -53.4 128.3 9.0 8.6 -13.0 87 538 A V E +BC 480 105B 0 393,-2.5 392,-2.4 18,-0.2 393,-0.7 -0.938 17.4 179.2-108.8 125.6 5.6 9.4 -11.7 88 539 A G E -BC 478 104B 0 16,-2.6 16,-2.5 -2,-0.5 2,-0.4 -0.695 20.5-126.1-115.6 170.6 2.5 7.8 -13.2 89 540 A V E - C 0 103B 11 388,-0.9 2,-0.4 387,-0.3 27,-0.1 -0.977 16.0-170.0-127.1 134.7 -1.2 8.1 -12.4 90 541 A A E - C 0 102B 0 12,-2.4 12,-2.9 -2,-0.4 3,-0.2 -0.978 36.8 -49.8-120.6 133.1 -3.7 5.4 -11.6 91 542 A G E - 0 0 19 -2,-0.4 10,-0.2 1,-0.3 2,-0.1 -0.924 44.1 -84.3 154.8-176.2 -7.4 6.1 -11.4 92 543 A P E - 0 0 51 0, 0.0 2,-0.7 0, 0.0 -1,-0.3 0.459 54.7-162.7 -74.0 149.0 -10.0 7.1 -10.8 93 544 A L E - C 0 100B 0 7,-2.3 7,-1.6 -3,-0.2 2,-1.1 -0.914 8.8-148.8-101.3 113.8 -10.2 5.2 -7.6 94 545 A C E + C 0 99B 25 -2,-0.7 34,-2.9 25,-0.3 2,-0.4 -0.757 34.7 156.7 -86.5 101.6 -13.8 5.1 -6.4 95 546 A L E > -dC 128 98B 0 3,-1.6 3,-0.6 -2,-1.1 34,-0.2 -0.983 63.2 -13.3-135.7 125.8 -13.5 5.0 -2.6 96 547 A D T 3 S- 0 0 28 32,-3.3 33,-0.1 -2,-0.4 -1,-0.1 0.893 126.6 -55.3 52.2 43.8 -16.0 6.0 -0.0 97 548 A E T 3 S+ 0 0 207 31,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.795 120.4 99.2 61.9 32.3 -18.1 7.8 -2.7 98 549 A K E < -C 95 0B 100 -3,-0.6 -3,-1.6 -5,-0.1 2,-0.4 -0.864 67.4-127.1-136.2 168.1 -15.2 10.0 -3.9 99 550 A E E -C 94 0B 135 -2,-0.3 2,-0.4 -5,-0.2 -5,-0.2 -0.989 21.6-166.7-125.0 132.2 -12.8 9.7 -6.8 100 551 A F E -C 93 0B 17 -7,-1.6 -7,-2.3 -2,-0.4 2,-0.8 -0.939 18.4-151.6-123.8 138.6 -9.0 9.8 -6.5 101 552 A Q E - 0 0 14 268,-0.4 -10,-0.2 -2,-0.4 -2,-0.0 -0.937 30.0-149.2-105.0 105.4 -6.3 10.2 -9.1 102 553 A V E -C 90 0B 0 -12,-2.9 -12,-2.4 -2,-0.8 2,-0.3 -0.722 4.0-146.6 -91.1 116.8 -3.4 8.3 -7.4 103 554 A P E -C 89 0B 0 0, 0.0 2,-0.4 0, 0.0 -14,-0.2 -0.562 17.5-173.7 -76.5 133.1 0.2 9.4 -8.1 104 555 A M E -C 88 0B 0 -16,-2.5 -16,-2.6 -2,-0.3 2,-0.7 -0.937 12.9-156.6-137.6 114.1 2.8 6.5 -8.1 105 556 A A E +C 87 0B 1 203,-2.6 2,-0.3 -2,-0.4 -18,-0.2 -0.785 39.8 129.7 -90.4 114.9 6.5 7.0 -8.3 106 557 A T - 0 0 18 -20,-2.1 -2,-0.1 -2,-0.7 609,-0.1 -0.987 54.4-149.9-161.4 164.8 8.2 3.9 -9.7 107 558 A T + 0 0 18 -2,-0.3 2,-0.7 607,-0.1 368,-0.1 0.130 68.5 108.2-121.1 12.1 10.6 2.3 -12.2 108 559 A E > - 0 0 62 647,-0.1 3,-1.3 196,-0.1 4,-0.4 -0.849 68.3-128.4 -98.9 115.9 8.8 -1.0 -12.5 109 560 A G T 3 S+ 0 0 20 364,-0.7 365,-0.1 -2,-0.7 366,-0.1 -0.212 86.5 17.8 -61.4 146.6 7.0 -1.6 -15.7 110 561 A C T 3> S+ 0 0 90 1,-0.1 4,-3.2 4,-0.0 5,-0.2 0.099 94.3 104.7 80.5 -17.7 3.3 -2.7 -15.7 111 562 A L H <> S+ 0 0 5 -3,-1.3 4,-2.6 2,-0.2 5,-0.2 0.953 84.3 37.8 -58.0 -58.2 2.8 -1.5 -12.1 112 563 A V H > S+ 0 0 0 -4,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.914 119.8 49.0 -61.5 -42.7 0.8 1.7 -12.8 113 564 A A H > S+ 0 0 42 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.938 112.9 47.5 -61.4 -48.0 -1.0 0.0 -15.7 114 565 A S H X S+ 0 0 25 -4,-3.2 4,-1.7 1,-0.2 -2,-0.2 0.923 113.1 47.1 -59.4 -47.9 -1.9 -3.0 -13.6 115 566 A T H X S+ 0 0 0 -4,-2.6 4,-1.9 -5,-0.2 -1,-0.2 0.845 109.4 55.9 -62.5 -37.4 -3.1 -0.9 -10.7 116 567 A N H X S+ 0 0 26 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.928 105.4 50.8 -61.6 -44.0 -5.1 1.2 -13.1 117 568 A R H X S+ 0 0 73 -4,-2.3 4,-2.0 1,-0.2 -1,-0.2 0.878 108.4 53.8 -61.6 -37.6 -6.9 -1.9 -14.4 118 569 A G H X S+ 0 0 0 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.882 106.3 50.7 -64.0 -40.9 -7.7 -2.8 -10.8 119 570 A C H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 -25,-0.3 0.878 107.0 56.3 -63.6 -37.3 -9.2 0.7 -10.2 120 571 A R H X S+ 0 0 152 -4,-2.0 4,-2.4 1,-0.2 5,-0.2 0.943 106.1 48.7 -59.3 -49.8 -11.4 0.2 -13.3 121 572 A A H < S+ 0 0 0 -4,-2.0 4,-0.4 1,-0.2 -1,-0.2 0.840 111.9 50.3 -60.6 -34.9 -12.9 -3.1 -12.0 122 573 A 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-2,-0.4 -89,-0.2 -0.976 7.0 179.5-117.7 118.3 -6.7 -5.3 6.0 346 797 A M E -H 255 0C 0 -91,-2.9 -91,-3.0 -2,-0.5 3,-0.5 -0.898 4.1-177.3-122.4 100.5 -3.5 -3.2 6.7 347 798 A P E S+ 0 0 15 0, 0.0 -96,-1.2 0, 0.0 -1,-0.1 0.588 73.3 40.7 -74.5 -11.1 -2.9 -2.8 10.5 348 799 A S E + 0 0 0 -23,-0.4 2,-0.7 -98,-0.2 -23,-0.2 -0.277 58.0 159.1-145.1 62.7 0.2 -0.6 10.3 349 800 A I E -H 253 0C 0 -96,-2.6 -96,-3.1 -3,-0.5 2,-0.8 -0.706 24.3-159.3 -85.0 111.3 0.3 2.1 7.7 350 801 A E + 0 0 0 -2,-0.7 2,-0.3 -31,-0.3 -34,-0.2 -0.855 35.8 140.4 -95.1 109.2 2.9 4.7 8.9 351 802 A I + 0 0 2 -2,-0.8 2,-0.3 -147,-0.2 33,-0.1 -0.951 27.6 179.2-150.8 163.2 2.0 7.9 7.1 352 803 A G - 0 0 2 -2,-0.3 -149,-0.2 -148,-0.1 -150,-0.1 -0.985 24.8-153.9-163.1 159.0 1.7 11.7 7.3 353 804 A T S S+ 0 0 0 -151,-3.1 21,-1.6 -2,-0.3 2,-0.3 0.311 83.5 59.8-119.6 4.8 0.8 14.7 5.3 354 805 A V B S+o 203 0E 55 -152,-0.8 -150,-0.6 19,-0.1 3,-0.1 -0.989 92.7 10.5-135.1 138.9 2.9 17.2 7.3 355 806 A G S > S+ 0 0 28 -2,-0.3 3,-1.9 1,-0.2 5,-0.1 0.095 92.3 41.1 84.6 166.1 6.7 17.3 7.9 356 807 A G G > S- 0 0 43 1,-0.3 3,-1.6 2,-0.2 -1,-0.2 -0.326 127.4 -6.7 60.1-134.1 9.7 15.4 6.5 357 808 A G G > S+ 0 0 4 -43,-0.5 3,-1.3 1,-0.3 -1,-0.3 0.632 125.2 74.2 -68.2 -15.1 9.6 14.9 2.8 358 809 A T G < S+ 0 0 3 -3,-1.9 -1,-0.3 -44,-0.4 -2,-0.2 0.585 82.4 71.5 -74.7 -8.8 6.1 16.3 2.6 359 810 A N G < S+ 0 0 81 -3,-1.6 -1,-0.2 -45,-0.2 2,-0.2 0.562 80.0 93.5 -80.2 -11.6 7.6 19.7 3.1 360 811 A L S <> S- 0 0 1 -3,-1.3 4,-1.8 -5,-0.1 5,-0.1 -0.599 79.6-127.4 -84.8 146.6 9.1 19.7 -0.4 361 812 A L H > S+ 0 0 46 -2,-0.2 4,-1.7 2,-0.2 98,-0.2 0.890 101.7 52.0 -61.2 -47.9 7.1 21.2 -3.3 362 813 A P H > S+ 0 0 11 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.932 115.4 41.8 -59.4 -45.2 7.1 18.3 -5.8 363 814 A Q H > S+ 0 0 0 -6,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.846 109.5 58.9 -71.4 -28.2 5.8 15.8 -3.3 364 815 A Q H X S+ 0 0 33 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.849 101.6 57.2 -64.7 -32.0 3.3 18.4 -1.9 365 816 A A H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.895 106.1 47.5 -64.3 -43.5 1.9 18.5 -5.5 366 817 A C H X S+ 0 0 0 -4,-1.2 4,-0.8 -54,-0.3 -2,-0.2 0.886 112.1 49.8 -66.7 -38.1 1.2 14.8 -5.4 367 818 A L H ><>S+ 0 0 0 -4,-2.1 5,-2.3 1,-0.2 3,-0.6 0.884 109.6 51.8 -66.0 -38.6 -0.4 15.2 -2.0 368 819 A Q H ><5S+ 0 0 55 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.858 98.9 64.2 -64.3 -37.8 -2.5 18.1 -3.4 369 820 A M H 3<5S+ 0 0 8 -4,-1.9 -268,-0.4 1,-0.3 83,-0.3 0.836 110.1 39.6 -53.8 -34.1 -3.6 15.9 -6.3 370 821 A L T <<5S- 0 0 10 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.470 114.4-119.4 -94.6 -7.5 -5.3 13.7 -3.6 371 822 A G T < 5S+ 0 0 42 -3,-1.1 -3,-0.2 -4,-0.4 -2,-0.1 0.783 87.3 103.1 72.8 31.3 -6.5 16.7 -1.6 372 823 A V < + 0 0 0 -5,-2.3 -4,-0.2 14,-0.1 15,-0.1 0.202 39.1 138.7-128.1 15.3 -4.6 15.8 1.6 373 824 A Q - 0 0 69 -6,-0.4 -19,-0.1 -9,-0.1 -20,-0.1 -0.367 63.2 -16.8 -67.3 136.2 -1.6 18.2 1.5 374 825 A G S S- 0 0 10 -21,-1.6 -20,-0.1 -16,-0.1 9,-0.1 -0.023 103.9 -22.0 69.0-170.3 -0.6 19.7 4.9 375 826 A A - 0 0 44 8,-0.1 2,-0.8 5,-0.1 3,-0.1 -0.356 53.7-128.5 -75.8 149.6 -2.5 20.0 8.2 376 827 A C - 0 0 24 1,-0.2 6,-0.2 -2,-0.1 5,-0.1 -0.925 20.1-169.0 -99.3 110.0 -6.3 19.8 8.4 377 828 A K S S+ 0 0 171 -2,-0.8 -1,-0.2 1,-0.2 -2,-0.0 0.915 84.2 46.8 -66.7 -41.4 -7.2 22.9 10.4 378 829 A D S S+ 0 0 161 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.890 131.2 14.1 -67.5 -42.1 -10.9 21.8 10.9 379 830 A N S > S- 0 0 79 0, 0.0 3,-2.2 0, 0.0 4,-0.3 -0.752 82.3-139.1-142.2 88.9 -10.1 18.2 12.0 380 831 A P T 3 S+ 0 0 56 0, 0.0 -179,-0.2 0, 0.0 -3,-0.1 -0.229 88.8 19.7 -52.1 121.0 -6.4 17.4 12.9 381 832 A G T 3> S+ 0 0 1 -181,-0.1 4,-2.4 -5,-0.1 5,-0.2 0.054 90.4 108.3 105.6 -21.4 -5.4 14.1 11.5 382 833 A E H <> S+ 0 0 61 -3,-2.2 4,-2.3 1,-0.2 5,-0.1 0.816 76.9 52.9 -57.4 -38.0 -8.1 13.8 8.9 383 834 A N H > S+ 0 0 26 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.931 111.6 45.6 -65.7 -42.6 -5.7 14.4 6.0 384 835 A A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.870 113.4 49.6 -68.4 -37.9 -3.3 11.6 7.2 385 836 A R H X S+ 0 0 41 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.912 110.4 50.9 -66.7 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847 A M H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.933 109.8 49.4 -60.1 -42.3 -6.7 -3.5 -3.0 397 848 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.918 112.9 48.3 -61.2 -43.7 -6.9 -2.4 -6.7 398 849 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.859 110.5 50.4 -64.6 -38.6 -3.3 -3.6 -7.1 399 850 A E H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.890 108.7 52.8 -65.5 -42.7 -4.1 -7.0 -5.5 400 851 A L H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.948 112.0 45.2 -56.9 -50.3 -7.1 -7.5 -7.7 401 852 A S H X S+ 0 0 0 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.906 114.8 44.5 -64.4 -46.7 -5.1 -6.9 -10.9 402 853 A L H X S+ 0 0 45 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.889 112.2 52.6 -67.5 -39.9 -2.1 -9.1 -10.0 403 854 A M H X S+ 0 0 0 -4,-2.3 4,-2.4 -5,-0.2 -1,-0.2 0.902 109.4 50.7 -61.9 -38.0 -4.3 -11.9 -8.7 404 855 A A H X S+ 0 0 0 -4,-1.9 4,-3.0 -5,-0.2 5,-0.3 0.932 109.2 49.8 -64.8 -45.5 -6.2 -11.9 -12.0 405 856 A A H X S+ 0 0 47 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.836 113.4 47.1 -63.2 -32.4 -2.9 -12.0 -14.0 406 857 A L H < S+ 0 0 20 -4,-1.9 -1,-0.2 2,-0.1 -2,-0.2 0.886 114.9 46.0 -74.6 -40.3 -1.8 -15.0 -11.9 407 858 A A H < S+ 0 0 24 -4,-2.4 -2,-0.2 -5,-0.2 -3,-0.2 0.903 116.6 43.0 -68.1 -48.0 -5.1 -16.8 -12.3 408 859 A A H < 0 0 60 -4,-3.0 -3,-0.2 -138,-0.2 -2,-0.1 0.994 360.0 360.0 -65.2 -65.3 -5.6 -16.2 -16.0 409 860 A G < 0 0 91 -4,-1.2 222,-0.3 -5,-0.3 -1,-0.0 -0.180 360.0 360.0-165.4 360.0 -2.1 -17.0 -17.4 410 !* 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 75 0, 0.0 4,-2.0 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 163.9 -2.1 22.3 -31.1 412 464 B D H 3> + 0 0 46 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.873 360.0 57.8 -58.3 -40.7 -2.7 21.1 -27.5 413 465 B A H 3> S+ 0 0 77 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.855 109.3 46.4 -58.7 -35.5 -6.2 22.6 -27.4 414 466 B E H <> S+ 0 0 124 -3,-0.6 4,-1.5 2,-0.2 -1,-0.2 0.898 109.9 51.0 -73.1 -46.2 -7.1 20.4 -30.4 415 467 B I H X S+ 0 0 28 -4,-2.0 4,-1.0 1,-0.2 -2,-0.2 0.820 110.3 51.6 -62.7 -31.9 -5.6 17.2 -29.2 416 468 B I H X S+ 0 0 20 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.866 106.1 52.2 -74.0 -38.4 -7.5 17.6 -25.9 417 469 B Q H < S+ 0 0 134 -4,-1.3 -2,-0.2 1,-0.2 -1,-0.2 0.831 106.3 56.1 -67.1 -30.8 -10.9 18.1 -27.5 418 470 B L H ><>S+ 0 0 100 -4,-1.5 5,-1.0 1,-0.2 3,-0.7 0.844 109.2 46.3 -67.4 -36.9 -10.3 14.9 -29.5 419 471 B V H ><5S+ 0 0 14 -4,-1.0 3,-2.7 1,-0.2 2,-0.7 0.939 104.2 59.2 -72.1 -48.1 -9.8 13.0 -26.2 420 472 B N T 3<5S+ 0 0 94 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.1 0.101 95.0 68.6 -71.1 27.3 -12.9 14.6 -24.5 421 473 B A T < 5S- 0 0 47 -2,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.220 115.5-115.7-122.0 2.6 -14.8 13.0 -27.4 422 474 B K T < 5S+ 0 0 200 -3,-2.7 -3,-0.1 2,-0.2 -2,-0.1 0.492 84.7 118.5 71.3 10.6 -14.1 9.5 -26.0 423 475 B H S S+ 0 0 13 20,-0.0 3,-0.7 0, 0.0 20,-0.1 -0.143 106.6 75.9 128.9 -28.3 -5.5 9.3 -22.5 427 479 B Y T 3 S+ 0 0 117 1,-0.2 3,-0.2 2,-0.1 50,-0.2 0.285 78.9 73.9 -92.6 11.7 -2.7 6.7 -22.1 428 480 B K T >> + 0 0 101 1,-0.1 4,-2.1 2,-0.1 3,-0.6 0.365 66.9 103.4-100.6 2.1 -2.3 6.3 -25.9 429 481 B L H <> + 0 0 0 -3,-0.7 4,-3.6 1,-0.2 -1,-0.1 0.786 70.0 57.4 -55.9 -41.1 -0.6 9.7 -26.2 430 482 B E H 34 S+ 0 0 19 -3,-0.2 -1,-0.2 1,-0.2 -2,-0.1 0.866 117.2 34.9 -63.0 -35.7 3.0 8.6 -26.6 431 483 B T H <4 S+ 0 0 139 -3,-0.6 -2,-0.2 -4,-0.1 -1,-0.2 0.759 121.2 50.2 -85.9 -29.4 2.1 6.5 -29.7 432 484 B L H < S+ 0 0 88 -4,-2.1 -2,-0.2 2,-0.0 -3,-0.2 0.938 114.4 43.3 -72.2 -52.1 -0.5 9.1 -30.8 433 485 B I S < S- 0 0 17 -4,-3.6 3,-0.1 -5,-0.1 6,-0.0 -0.234 78.6-134.2 -84.6 177.6 1.8 12.1 -30.5 434 486 B E S S+ 0 0 185 1,-0.1 2,-0.2 -2,-0.1 -1,-0.1 0.851 82.9 60.4 -99.6 -59.0 5.4 12.3 -31.7 435 487 B T > - 0 0 70 1,-0.1 4,-1.1 2,-0.0 -1,-0.1 -0.500 68.8-146.8 -76.9 136.8 7.3 13.9 -28.8 436 488 B H H > S+ 0 0 60 -2,-0.2 4,-2.0 2,-0.2 3,-0.3 0.924 96.7 53.0 -66.1 -48.0 7.3 12.1 -25.4 437 489 B E H > S+ 0 0 55 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.855 108.2 51.1 -59.2 -36.9 7.5 15.3 -23.3 438 490 B R H > S+ 0 0 86 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.821 105.1 56.6 -71.1 -30.7 4.4 16.8 -25.1 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-1,-0.2 -138,-0.2 -2,-0.2 0.789 360.0 360.0 -68.9 -26.6 -22.0 -27.4 14.5 1199 860 C G < 0 0 99 -4,-1.0 -3,-0.2 -5,-0.3 -4,-0.1 0.979 360.0 360.0 61.8 360.0 -21.7 -25.0 17.4 1200 !* 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 1201 464 D D > 0 0 69 0, 0.0 4,-0.7 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 -36.3 -17.4 -62.0 31.2 1202 465 D A T >4 + 0 0 88 1,-0.2 3,-0.8 2,-0.2 4,-0.1 0.898 360.0 1.8 -38.5 -95.4 -18.6 -64.9 29.1 1203 466 D E G >4 S+ 0 0 145 1,-0.2 3,-0.7 2,-0.2 -1,-0.2 0.147 105.8 97.5 -88.5 18.4 -21.5 -63.9 26.9 1204 467 D I G 34 S+ 0 0 73 -3,-0.4 -1,-0.2 1,-0.2 -2,-0.2 0.776 75.7 66.5 -72.1 -24.2 -21.3 -60.3 28.3 1205 468 D I G << 0 0 63 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.740 360.0 360.0 -65.8 -22.0 -19.4 -59.8 25.1 1206 469 D Q < 0 0 181 -3,-0.7 -1,-0.2 -4,-0.1 -2,-0.2 0.822 360.0 360.0 -68.7 360.0 -22.7 -60.5 23.3 1207 ! 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 1208 478 D A 0 0 92 0, 0.0 20,-0.1 0, 0.0 3,-0.1 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25.1-151.3-163.6 159.8 -4.0 -24.8 37.3 1534 804 D T S S+ 0 0 1 -151,-3.4 21,-1.5 -2,-0.3 2,-0.3 0.307 83.7 54.3-118.6 1.8 -4.3 -26.7 40.6 1535 805 D V B S+w 1384 0Q 44 -152,-0.9 -150,-0.5 19,-0.1 3,-0.1 -0.979 94.0 16.4-133.7 147.9 -8.0 -27.7 40.4 1536 806 D G S > S+ 0 0 30 -2,-0.3 3,-2.0 1,-0.2 5,-0.1 0.114 92.6 42.3 80.9 166.9 -9.8 -29.6 37.7 1537 807 D G G > S- 0 0 45 1,-0.3 3,-1.4 2,-0.2 -1,-0.2 -0.328 128.7 -10.1 61.3-136.3 -8.7 -31.8 34.8 1538 808 D G G > S+ 0 0 3 -43,-0.6 3,-1.1 1,-0.3 -1,-0.3 0.592 125.9 75.5 -70.5 -11.4 -5.9 -34.2 35.6 1539 809 D T G < S+ 0 0 4 -3,-2.0 -1,-0.3 -44,-0.4 -2,-0.2 0.550 82.0 70.6 -76.5 -7.5 -5.4 -32.4 39.0 1540 810 D N G < S+ 0 0 82 -3,-1.4 -1,-0.2 -45,-0.1 2,-0.2 0.566 81.0 93.0 -81.3 -12.4 -8.6 -34.2 40.2 1541 811 D L S <> S- 0 0 1 -3,-1.1 4,-1.8 -5,-0.1 5,-0.1 -0.596 79.8-127.6 -84.1 146.4 -6.8 -37.5 40.3 1542 812 D L H > S+ 0 0 54 -2,-0.2 4,-1.7 2,-0.2 -692,-0.2 0.890 102.5 51.3 -62.4 -46.5 -5.1 -38.7 43.5 1543 813 D P H > S+ 0 0 13 0, 0.0 4,-1.2 0, 0.0 -1,-0.2 0.937 115.1 43.2 -60.8 -42.0 -1.6 -39.5 42.2 1544 814 D Q H > S+ 0 0 0 -6,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.838 109.7 57.6 -71.3 -29.8 -1.2 -36.1 40.6 1545 815 D Q H X S+ 0 0 33 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.835 101.5 57.7 -66.4 -31.6 -2.7 -34.4 43.7 1546 816 D A H X S+ 0 0 1 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.897 106.2 47.5 -64.9 -42.4 0.1 -36.1 45.7 1547 817 D C H X S+ 0 0 0 -4,-1.2 4,-0.7 -54,-0.3 -2,-0.2 0.887 112.1 49.8 -66.9 -38.5 2.7 -34.3 43.5 1548 818 D L H ><>S+ 0 0 0 -4,-1.9 5,-2.2 1,-0.2 3,-0.7 0.884 108.8 52.7 -65.8 -39.1 0.8 -31.0 43.9 1549 819 D Q H ><5S+ 0 0 42 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.850 99.0 64.3 -64.3 -35.3 0.7 -31.6 47.7 1550 820 D M H 3<5S+ 0 0 7 -4,-1.7 -268,-0.4 1,-0.3 -1,-0.2 0.804 109.6 39.6 -55.3 -34.4 4.4 -32.1 47.7 1551 821 D L T <<5S- 0 0 8 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.484 114.7-119.0 -93.8 -8.4 4.6 -28.4 46.6 1552 822 D G T < 5S+ 0 0 37 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.766 87.3 103.1 74.5 30.1 1.9 -27.3 48.9 1553 823 D V < + 0 0 0 -5,-2.2 -4,-0.2 14,-0.1 15,-0.1 0.189 40.2 141.0-128.3 17.4 -0.4 -26.1 46.0 1554 824 D Q - 0 0 65 -6,-0.4 -19,-0.1 -9,-0.1 -20,-0.1 -0.366 61.8 -19.6 -68.8 136.3 -3.0 -28.8 45.7 1555 825 D G S S- 0 0 8 -21,-1.5 2,-0.2 -16,-0.1 -20,-0.1 -0.051 106.3 -18.5 68.0-166.4 -6.6 -27.8 45.0 1556 826 D A - 0 0 64 8,-0.1 2,-1.1 1,-0.1 3,-0.1 -0.486 53.4-132.3 -78.4 139.6 -8.2 -24.4 45.5 1557 827 D C - 0 0 26 1,-0.2 6,-0.2 -2,-0.2 5,-0.1 -0.834 21.8-163.6 -91.0 97.9 -6.7 -21.8 47.8 1558 828 D K S S+ 0 0 197 -2,-1.1 -1,-0.2 1,-0.2 -3,-0.0 0.908 81.5 50.9 -50.3 -48.6 -9.9 -20.9 49.7 1559 829 D D S S+ 0 0 168 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.0 0.928 128.5 11.9 -57.2 -56.9 -8.5 -17.7 51.2 1560 830 D N S > S- 0 0 84 -178,-0.0 3,-2.4 0, 0.0 4,-0.3 -0.807 83.2-136.9-130.5 91.2 -7.2 -16.1 47.9 1561 831 D P T 3 S+ 0 0 50 0, 0.0 -179,-0.3 0, 0.0 -3,-0.1 -0.202 90.2 26.1 -48.8 116.5 -8.4 -17.9 44.8 1562 832 D G T 3> S+ 0 0 0 -181,-0.1 4,-2.4 -5,-0.1 5,-0.2 0.080 87.2 104.8 115.0 -22.6 -5.5 -18.2 42.3 1563 833 D E H <> S+ 0 0 61 -3,-2.4 4,-2.4 -6,-0.2 5,-0.2 0.849 81.1 51.4 -60.6 -36.8 -2.6 -18.1 44.8 1564 834 D N H > S+ 0 0 25 -4,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.929 112.7 45.4 -66.3 -43.0 -2.0 -21.9 44.5 1565 835 D A H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.857 113.4 49.8 -68.4 -37.0 -1.9 -21.6 40.7 1566 836 D R H X S+ 0 0 37 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.912 110.5 50.6 -67.0 -41.9 0.4 -18.6 40.8 1567 837 D Q H X S+ 0 0 16 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.927 110.0 50.0 -61.7 -43.7 2.7 -20.4 43.2 1568 838 D L H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.902 109.6 50.9 -62.8 -39.8 2.8 -23.3 40.9 1569 839 D A H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.883 109.8 50.1 -64.7 -39.4 3.7 -21.1 37.9 1570 840 D R H X S+ 0 0 42 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.911 109.6 51.9 -65.1 -38.5 6.5 -19.4 40.0 1571 841 D I H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.900 109.4 49.7 -64.9 -41.2 7.8 -22.9 40.8 1572 842 D V H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.907 111.0 48.3 -63.8 -44.0 7.8 -23.9 37.1 1573 843 D C H X S+ 0 0 0 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.913 113.4 48.6 -64.1 -39.4 9.7 -20.7 36.1 1574 844 D G H X S+ 0 0 0 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.917 111.4 48.4 -66.1 -43.6 12.2 -21.4 38.9 1575 845 D T H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.886 109.4 53.8 -65.1 -37.9 12.7 -25.0 38.0 1576 846 D V H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -1,-0.2 0.927 107.4 51.2 -61.3 -45.5 13.2 -23.9 34.3 1577 847 D M H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.938 109.9 48.9 -58.7 -43.1 15.9 -21.5 35.4 1578 848 D A H X S+ 0 0 0 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.920 113.1 48.5 -60.8 -42.9 17.7 -24.3 37.4 1579 849 D G H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.862 110.5 50.0 -64.9 -39.0 17.4 -26.5 34.2 1580 850 D E H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 5,-0.2 0.884 109.0 52.9 -65.9 -42.5 18.7 -23.7 32.0 1581 851 D L H X S+ 0 0 0 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.950 112.0 45.2 -56.3 -50.5 21.7 -23.2 34.3 1582 852 D S H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.906 114.9 44.5 -63.7 -47.7 22.7 -26.8 34.3 1583 853 D L H X S+ 0 0 45 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.889 112.2 52.4 -67.7 -39.4 22.3 -27.4 30.5 1584 854 D M H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.900 109.6 50.9 -62.5 -37.7 24.2 -24.2 29.6 1585 855 D A H X S+ 0 0 0 -4,-1.9 4,-2.7 -5,-0.2 -2,-0.2 0.944 109.1 49.6 -64.4 -46.1 27.0 -25.3 31.9 1586 856 D A H < S+ 0 0 59 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.836 113.7 46.9 -62.7 -32.2 27.2 -28.7 30.2 1587 857 D L H < S+ 0 0 27 -4,-1.9 -1,-0.2 2,-0.2 -2,-0.2 0.882 112.4 48.8 -76.2 -39.1 27.3 -27.0 26.8 1588 858 D A H < 0 0 28 -4,-2.5 -2,-0.2 1,-0.3 -3,-0.2 0.881 360.0 360.0 -67.8 -37.3 29.9 -24.5 27.9 1589 859 D A < 0 0 90 -4,-2.7 -1,-0.3 -5,-0.2 -2,-0.2 0.345 360.0 360.0 -87.7 360.0 32.1 -27.3 29.4