==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-APR-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 14-OCT-10 3P8J . COMPND 2 MOLECULE: PENTAERYTHRITOL TETRANITRATE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROBACTER CLOACAE; . AUTHOR H.S.TOOGOOD,N.S.SCRUTTON . 362 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13835.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 229 63.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 45 12.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 14 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 22 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 25.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 1.7 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 1 1 1 1 0 2 1 0 0 1 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 2 2 2 3 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 0 1 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 3 0 0 0 0 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 3 A E 0 0 147 0, 0.0 306,-0.0 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0 136.3 33.1 7.3 47.5 2 4 A K > + 0 0 43 1,-0.1 3,-1.7 2,-0.1 15,-0.1 0.497 360.0 90.1-112.1 -11.6 30.5 4.8 46.3 3 5 A L T 3 S+ 0 0 1 1,-0.3 14,-3.0 13,-0.1 15,-0.3 0.724 89.1 49.9 -60.7 -24.9 31.2 5.0 42.5 4 6 A F T 3 S+ 0 0 41 12,-0.2 -1,-0.3 13,-0.1 -2,-0.1 -0.009 91.3 98.7-107.7 29.2 33.8 2.2 42.7 5 7 A T S < S- 0 0 49 -3,-1.7 -3,-0.1 1,-0.1 9,-0.0 -0.846 79.6 -96.2-111.7 151.1 31.6 -0.2 44.6 6 8 A P - 0 0 84 0, 0.0 2,-0.3 0, 0.0 11,-0.1 -0.176 33.3-165.0 -68.0 161.8 29.7 -3.1 43.0 7 9 A L E -A 14 0A 18 7,-2.5 7,-2.9 9,-0.2 2,-0.5 -0.987 20.1-130.3-147.7 127.4 26.0 -3.0 42.1 8 10 A K E -A 13 0A 124 -2,-0.3 2,-0.6 5,-0.2 5,-0.2 -0.735 22.9-172.9 -78.1 122.8 23.6 -5.9 41.2 9 11 A V E > -A 12 0A 1 3,-3.3 3,-2.1 -2,-0.5 255,-0.1 -0.840 56.2 -74.5-119.1 89.2 21.9 -5.0 37.9 10 12 A G T 3 S- 0 0 20 -2,-0.6 217,-0.2 254,-0.4 -1,-0.1 -0.397 118.0 -1.5 54.5-124.4 19.2 -7.7 37.5 11 13 A A T 3 S+ 0 0 30 215,-2.6 2,-0.3 163,-0.1 -1,-0.3 0.555 128.3 62.8 -72.4 -12.8 21.1 -10.9 36.4 12 14 A V E < S-A 9 0A 19 -3,-2.1 -3,-3.3 214,-0.3 2,-0.6 -0.795 70.7-135.6-119.7 159.7 24.5 -9.3 36.3 13 15 A T E -A 8 0A 82 -2,-0.3 -5,-0.2 -5,-0.2 -2,-0.0 -0.957 15.1-153.7-113.6 115.6 26.8 -7.8 38.9 14 16 A A E -A 7 0A 1 -7,-2.9 -7,-2.5 -2,-0.6 36,-0.1 -0.724 9.9-145.7 -83.2 135.4 28.6 -4.6 37.9 15 17 A P S S+ 0 0 61 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.596 81.5 13.0 -77.4 -11.6 31.9 -4.0 39.7 16 18 A N S S- 0 0 10 -9,-0.1 -12,-0.2 2,-0.1 -9,-0.2 -0.925 72.9-117.6-154.1 172.1 31.4 -0.2 39.8 17 19 A R S S+ 0 0 35 -14,-3.0 301,-2.4 -2,-0.3 2,-0.8 0.155 78.0 107.2-103.2 13.6 28.7 2.4 39.1 18 20 A V E -b 318 0B 0 -15,-0.3 32,-2.4 299,-0.2 33,-0.5 -0.858 52.3-175.6 -99.9 100.8 30.4 4.2 36.2 19 21 A F E -bc 319 51B 0 299,-3.1 301,-2.7 -2,-0.8 2,-0.7 -0.726 28.3-122.4-103.6 151.2 28.4 3.1 33.1 20 22 A M E -bc 320 52B 1 31,-2.6 33,-2.0 -2,-0.3 301,-0.2 -0.836 32.8-135.5 -89.9 114.6 29.0 3.8 29.4 21 23 A A - 0 0 4 299,-2.3 2,-0.2 -2,-0.7 32,-0.1 -0.297 32.3 -87.3 -63.5 155.9 25.9 5.5 28.0 22 24 A P - 0 0 14 0, 0.0 2,-0.4 0, 0.0 33,-0.2 -0.465 51.2-172.1 -66.2 131.3 24.4 4.4 24.6 23 25 A L - 0 0 27 30,-0.3 2,-0.4 -2,-0.2 32,-0.3 -0.928 20.3-142.7-138.0 109.0 26.2 6.4 21.9 24 26 A T + 0 0 47 -2,-0.4 45,-0.1 1,-0.2 33,-0.0 -0.559 27.7 166.3 -67.8 120.7 25.2 6.4 18.2 25 27 A R - 0 0 1 -2,-0.4 325,-2.5 43,-0.1 -1,-0.2 0.497 33.9-141.0-119.8 -12.6 28.5 6.5 16.2 26 28 A L + 0 0 4 323,-0.2 325,-0.3 1,-0.1 43,-0.2 0.829 58.3 127.4 59.1 45.5 27.2 5.6 12.7 27 29 A R + 0 0 14 41,-0.4 42,-0.1 323,-0.2 12,-0.1 0.188 32.4 123.7-117.4 15.4 30.2 3.4 11.6 28 30 A S - 0 0 2 40,-2.4 2,-0.3 1,-0.1 5,-0.1 -0.331 66.3 -97.2 -76.7 160.6 28.4 0.2 10.6 29 31 A I B >> -K 34 0C 84 5,-2.7 5,-2.0 3,-0.1 4,-0.7 -0.579 39.0-127.6 -77.9 134.8 28.7 -1.4 7.1 30 32 A E T 45S+ 0 0 63 -2,-0.3 2,-0.1 2,-0.2 37,-0.0 -0.984 86.8 50.1-118.9 141.4 26.1 -0.7 4.4 31 33 A P T 45S+ 0 0 120 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 0.503 128.5 20.0 -70.6 154.5 24.6 -2.7 2.8 32 34 A G T 45S- 0 0 37 1,-0.2 39,-0.2 -2,-0.1 -2,-0.2 0.242 97.0-112.7 110.5 -11.0 23.3 -4.8 5.7 33 35 A D T <5 + 0 0 16 -4,-0.7 38,-2.2 1,-0.2 -3,-0.2 0.923 58.3 176.5 51.6 51.6 23.7 -2.4 8.7 34 36 A I B < -K 29 0C 41 -5,-2.0 -5,-2.7 -3,-0.2 -1,-0.2 -0.750 30.6-126.7-100.8 126.8 26.5 -4.7 10.0 35 37 A P - 0 0 4 0, 0.0 -7,-0.1 0, 0.0 46,-0.0 -0.285 32.3-144.1 -60.0 160.1 28.6 -4.1 13.1 36 38 A T > - 0 0 19 1,-0.1 4,-2.2 45,-0.0 5,-0.1 -0.783 25.9-109.4-128.8 160.9 32.4 -4.3 12.5 37 39 A P H > S+ 0 0 115 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.834 119.1 59.9 -56.8 -31.0 35.6 -5.5 14.2 38 40 A L H > S+ 0 0 47 2,-0.2 4,-2.3 1,-0.2 5,-0.1 0.936 105.3 47.5 -62.5 -45.4 36.5 -1.8 14.6 39 41 A M H > S+ 0 0 0 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.910 109.2 55.5 -58.2 -41.6 33.3 -1.3 16.6 40 42 A G H X S+ 0 0 12 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.906 107.1 48.8 -57.1 -42.6 34.4 -4.5 18.6 41 43 A E H X S+ 0 0 99 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.915 109.0 53.1 -63.5 -45.9 37.8 -2.8 19.4 42 44 A Y H X S+ 0 0 1 -4,-2.3 4,-0.6 1,-0.2 -2,-0.2 0.921 112.9 43.3 -55.1 -47.5 36.0 0.4 20.6 43 45 A Y H >< S+ 0 0 2 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.914 111.3 54.3 -67.9 -41.6 33.8 -1.5 23.0 44 46 A R H >< S+ 0 0 100 -4,-2.5 3,-1.6 1,-0.3 -2,-0.2 0.887 102.6 58.0 -58.5 -39.0 36.7 -3.8 24.2 45 47 A Q H 3< S+ 0 0 60 -4,-2.4 3,-0.3 1,-0.3 -1,-0.3 0.747 109.6 45.5 -58.8 -26.6 38.7 -0.7 25.0 46 48 A R T X< S+ 0 0 0 -3,-1.2 3,-2.2 -4,-0.6 -1,-0.3 0.214 75.7 116.6-104.0 13.6 35.8 0.4 27.4 47 49 A A T < + 0 0 4 -3,-1.6 47,-0.2 1,-0.3 -1,-0.2 0.589 60.5 73.2 -66.8 -13.7 35.3 -3.0 29.1 48 50 A S T 3 S+ 0 0 57 280,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.627 72.4 113.4 -74.6 -10.1 36.3 -1.7 32.5 49 51 A A S < S- 0 0 1 -3,-2.2 45,-0.4 279,-0.2 3,-0.2 -0.263 81.6-121.8 -52.6 143.7 32.9 0.2 32.6 50 52 A G S S- 0 0 0 -32,-2.4 2,-0.3 1,-0.3 -31,-0.2 0.901 98.9 -5.0 -52.6 -40.4 30.6 -1.1 35.3 51 53 A L E -c 19 0B 2 -33,-0.5 -31,-2.6 -37,-0.1 2,-0.5 -0.931 68.5-144.7-152.7 132.1 28.2 -1.7 32.3 52 54 A I E -cd 20 95B 0 42,-2.6 44,-3.1 -2,-0.3 2,-0.5 -0.878 12.3-161.2 -90.8 130.1 28.6 -0.8 28.6 53 55 A I E - d 0 96B 0 -33,-2.0 -30,-0.3 -2,-0.5 44,-0.2 -0.972 23.4-130.5-107.8 121.5 25.3 0.2 27.0 54 56 A S E - 0 0 0 42,-2.9 3,-0.1 -2,-0.5 -30,-0.1 -0.180 27.2 -82.7 -66.2 163.2 25.6 -0.1 23.2 55 57 A E E - 0 0 2 -32,-0.3 43,-0.5 -33,-0.2 -1,-0.2 -0.235 68.7 -75.4 -47.7 149.3 24.8 2.4 20.5 56 58 A A E - d 0 98B 1 41,-0.1 2,-0.4 -3,-0.1 43,-0.2 -0.293 57.5-161.0 -56.9 135.0 21.1 2.3 19.5 57 59 A T E - d 0 99B 0 41,-2.2 43,-2.2 -3,-0.1 14,-0.3 -0.974 18.2-109.3-131.7 130.2 20.5 -0.8 17.4 58 60 A Q E -ed 71 100B 0 12,-2.6 14,-2.4 -2,-0.4 43,-0.2 -0.345 11.3-158.5 -63.4 135.6 17.6 -1.6 15.0 59 61 A I S S- 0 0 4 41,-1.8 2,-0.3 12,-0.2 -1,-0.1 0.628 82.1 -4.5 -78.3 -16.8 15.0 -4.2 15.9 60 62 A S S S- 0 0 14 40,-0.3 4,-0.3 1,-0.1 3,-0.2 -0.953 80.1 -95.9-164.8 166.5 14.1 -4.5 12.2 61 63 A A S > S+ 0 0 44 -2,-0.3 3,-1.7 1,-0.2 -1,-0.1 0.900 124.1 57.3 -64.1 -38.7 14.9 -2.9 8.8 62 64 A Q T 3 S+ 0 0 46 1,-0.3 56,-0.2 49,-0.1 -1,-0.2 0.846 96.6 65.4 -59.9 -31.6 11.8 -0.7 9.2 63 65 A A T 3 S+ 0 0 0 -3,-0.2 39,-2.2 38,-0.1 -1,-0.3 0.662 78.1 113.2 -61.8 -20.3 13.3 0.5 12.5 64 66 A K < + 0 0 17 -3,-1.7 43,-0.3 -4,-0.3 46,-0.1 -0.370 23.2 151.3 -65.7 133.1 16.2 2.2 10.7 65 67 A G + 0 0 0 1,-0.2 2,-0.4 41,-0.2 65,-0.2 0.469 60.6 55.6-128.4 -13.3 16.4 6.0 10.8 66 68 A Y S > S- 0 0 11 63,-0.1 3,-1.6 44,-0.1 2,-0.3 -0.992 77.6-123.6-130.7 129.4 20.2 6.6 10.5 67 69 A A T 3 S+ 0 0 3 63,-2.3 -37,-0.1 -2,-0.4 -39,-0.0 -0.558 101.7 25.1 -68.3 128.7 22.7 5.5 7.8 68 70 A G T 3 S+ 0 0 0 1,-0.4 -40,-2.4 -2,-0.3 -41,-0.4 0.316 87.4 126.1 96.9 -7.8 25.5 3.6 9.6 69 71 A A < - 0 0 1 -3,-1.6 -1,-0.4 -43,-0.2 -12,-0.1 -0.682 60.0-120.7 -80.7 138.6 23.4 2.5 12.7 70 72 A P - 0 0 0 0, 0.0 -12,-2.6 0, 0.0 2,-0.2 -0.382 20.0-143.5 -80.2 159.7 23.6 -1.2 13.2 71 73 A G B -e 58 0B 0 -38,-2.2 -12,-0.2 -14,-0.3 -10,-0.1 -0.684 14.8-160.1-110.6 170.1 20.8 -3.8 13.3 72 74 A L S S+ 0 0 0 -14,-2.4 95,-0.2 -2,-0.2 96,-0.1 -0.205 75.3 84.2-139.0 40.5 20.1 -6.9 15.3 73 75 A H S S+ 0 0 58 94,-0.1 -14,-0.1 -13,-0.0 -12,-0.1 0.605 75.5 67.9-114.2 -22.6 17.5 -8.5 12.9 74 76 A S S > S- 0 0 19 -42,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.664 80.8-118.3-104.4 158.9 19.6 -10.4 10.3 75 77 A P H > S+ 0 0 100 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.897 116.0 52.4 -57.3 -40.3 21.9 -13.4 10.5 76 78 A E H > S+ 0 0 116 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.878 109.6 48.8 -67.5 -37.0 24.9 -11.4 9.5 77 79 A Q H > S+ 0 0 1 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.922 110.5 50.9 -65.4 -45.1 24.2 -8.8 12.2 78 80 A I H X S+ 0 0 19 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.941 111.2 48.8 -56.6 -46.8 23.8 -11.6 14.8 79 81 A A H X S+ 0 0 40 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.900 112.6 47.3 -61.4 -42.0 27.1 -13.1 13.8 80 82 A A H X S+ 0 0 16 -4,-2.0 4,-1.5 1,-0.2 3,-0.2 0.912 112.1 48.8 -69.0 -42.4 29.0 -9.8 13.9 81 83 A W H X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 5,-0.3 0.859 103.6 62.6 -65.5 -34.2 27.6 -8.8 17.3 82 84 A K H X S+ 0 0 82 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.891 104.6 47.3 -55.9 -41.1 28.6 -12.3 18.7 83 85 A K H X S+ 0 0 150 -4,-1.2 4,-2.0 -3,-0.2 -1,-0.2 0.897 112.0 50.8 -66.7 -40.4 32.2 -11.5 18.0 84 86 A I H X S+ 0 0 5 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.928 112.0 44.6 -64.3 -47.7 31.8 -8.1 19.6 85 87 A T H X S+ 0 0 5 -4,-2.9 4,-2.7 86,-0.3 5,-0.2 0.896 110.8 55.4 -66.8 -37.1 30.3 -9.4 22.8 86 88 A A H X S+ 0 0 55 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.912 107.9 50.0 -58.8 -41.9 32.8 -12.2 23.0 87 89 A G H X S+ 0 0 15 -4,-2.0 4,-0.9 2,-0.2 -2,-0.2 0.915 110.6 48.1 -63.9 -43.0 35.6 -9.6 22.8 88 90 A V H ><>S+ 0 0 0 -4,-2.1 5,-2.4 1,-0.2 3,-0.8 0.932 112.5 49.4 -62.0 -43.6 34.0 -7.5 25.7 89 91 A H H ><5S+ 0 0 72 -4,-2.7 3,-1.9 1,-0.3 -2,-0.2 0.850 102.9 60.3 -66.2 -33.0 33.7 -10.7 27.8 90 92 A A H 3<5S+ 0 0 67 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.757 106.2 49.3 -63.9 -24.5 37.3 -11.7 27.1 91 93 A E T <<5S- 0 0 95 -4,-0.9 -1,-0.3 -3,-0.8 -2,-0.2 0.122 123.5-107.3 -98.9 17.1 38.2 -8.4 28.8 92 94 A D T < 5S+ 0 0 130 -3,-1.9 -3,-0.2 1,-0.2 2,-0.1 0.774 74.8 137.9 64.7 30.6 35.9 -9.1 31.8 93 95 A G < - 0 0 5 -5,-2.4 2,-0.4 -8,-0.1 -1,-0.2 -0.455 47.4-136.2 -98.3 174.3 33.3 -6.5 30.7 94 96 A R - 0 0 28 -45,-0.4 -42,-2.6 -47,-0.2 2,-0.4 -0.994 20.2-168.0-130.5 137.8 29.4 -6.5 30.6 95 97 A I E -d 52 0B 0 -2,-0.4 79,-3.0 77,-0.2 80,-0.8 -0.990 10.1-165.9-138.5 128.4 27.5 -5.2 27.7 96 98 A A E -df 53 175B 0 -44,-3.1 -42,-2.9 -2,-0.4 2,-0.5 -0.834 21.1-133.0-100.3 144.0 23.8 -4.3 27.1 97 99 A V E - f 0 176B 0 78,-1.9 80,-3.0 -2,-0.3 2,-0.6 -0.888 12.3-141.5 -95.6 128.8 22.3 -3.7 23.7 98 100 A Q E -df 56 177B 4 -43,-0.5 -41,-2.2 -2,-0.5 2,-0.5 -0.827 20.9-158.2 -86.4 120.8 20.1 -0.7 23.3 99 101 A L E +df 57 178B 0 78,-2.6 80,-2.7 -2,-0.6 2,-0.3 -0.884 17.6 169.8-105.9 128.2 17.3 -1.6 21.0 100 102 A W E -d 58 0B 3 -43,-2.2 -41,-1.8 -2,-0.5 2,-0.4 -0.894 35.6-155.8-131.4 161.2 15.3 1.0 19.1 101 103 A H - 0 0 2 78,-0.3 84,-2.7 -2,-0.3 85,-0.4 -0.982 19.8-154.6-122.1 125.6 12.7 1.7 16.4 102 104 A T > - 0 0 0 -39,-2.2 3,-2.1 -2,-0.4 -38,-0.1 0.687 22.1-179.0 -75.9 -17.3 13.3 5.3 15.2 103 105 A G T 3 - 0 0 1 1,-0.3 16,-0.2 81,-0.1 -1,-0.2 -0.269 70.0 -1.1 51.9-130.1 9.8 5.8 14.0 104 106 A R T 3 S+ 0 0 11 1,-0.2 2,-1.6 79,-0.1 21,-0.5 0.541 113.1 87.0 -73.1 -7.4 9.4 9.3 12.5 105 107 A I S < S+ 0 0 1 -3,-2.1 2,-0.3 78,-0.1 -1,-0.2 -0.665 83.0 80.7 -89.0 80.6 13.0 10.3 13.1 106 108 A S S S- 0 0 0 -2,-1.6 38,-2.0 38,-0.2 2,-0.3 -0.913 74.2-117.5-166.8 179.4 14.0 8.7 9.8 107 109 A H > - 0 0 40 -43,-0.3 3,-1.9 -2,-0.3 4,-0.4 -0.999 20.2-127.2-142.9 139.3 14.0 9.3 6.0 108 110 A S G > S+ 0 0 33 -2,-0.3 3,-1.4 1,-0.3 6,-0.1 0.803 103.3 70.4 -57.5 -30.5 12.2 7.4 3.3 109 111 A S G 3 S+ 0 0 74 1,-0.3 -1,-0.3 5,-0.1 4,-0.1 0.663 105.6 38.9 -64.7 -17.4 15.4 6.8 1.3 110 112 A I G < S+ 0 0 31 -3,-1.9 -1,-0.3 5,-0.1 -2,-0.2 0.311 97.6 98.4-114.1 6.8 16.6 4.4 4.0 111 113 A Q S X S- 0 0 18 -3,-1.4 3,-2.3 -4,-0.4 -49,-0.1 -0.557 91.0 -83.2 -86.0 156.7 13.3 2.6 4.6 112 114 A P G > S+ 0 0 67 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.354 117.9 5.2 -55.9 133.5 12.3 -0.7 3.0 113 115 A G G 3 S- 0 0 71 1,-0.3 -4,-0.1 -4,-0.1 -5,-0.0 0.561 120.4 -83.6 68.8 7.9 10.9 0.0 -0.4 114 116 A G G < S+ 0 0 40 -3,-2.3 -1,-0.3 1,-0.2 2,-0.1 0.729 87.6 150.7 68.2 21.5 11.8 3.7 -0.1 115 117 A Q < - 0 0 133 -3,-1.5 -4,-0.2 1,-0.1 -1,-0.2 -0.390 54.5 -82.7 -88.8 162.8 8.5 4.3 1.8 116 118 A A - 0 0 37 -2,-0.1 -1,-0.1 1,-0.1 31,-0.1 -0.303 51.5-111.3 -55.7 142.4 7.6 6.8 4.5 117 119 A P - 0 0 1 0, 0.0 30,-2.6 0, 0.0 2,-0.2 -0.250 35.2-112.0 -70.6 168.5 8.7 5.8 8.0 118 120 A V E +l 147 0D 2 28,-0.3 2,-0.3 -56,-0.2 30,-0.2 -0.656 39.6 154.5-105.9 158.0 6.0 4.9 10.6 119 121 A S E -l 148 0D 0 28,-2.0 30,-2.8 -2,-0.2 3,-0.1 -0.917 57.8 -85.2-158.3-175.4 4.8 6.6 13.8 120 122 A A S S+ 0 0 1 -2,-0.3 2,-0.3 28,-0.2 75,-0.1 0.900 112.8 9.7 -65.0 -42.0 1.9 6.9 16.1 121 123 A S S S- 0 0 11 73,-0.4 2,-1.9 2,-0.2 -1,-0.2 -0.910 85.3-100.6-138.7 163.1 0.5 9.7 13.9 122 124 A A S S+ 0 0 61 -2,-0.3 2,-0.4 -3,-0.1 25,-0.1 -0.515 74.7 128.0 -88.0 67.1 1.2 11.3 10.5 123 125 A L - 0 0 49 -2,-1.9 -2,-0.2 71,-0.2 -3,-0.1 -0.996 61.4-118.4-128.0 124.6 3.1 14.3 11.9 124 126 A N - 0 0 41 -2,-0.4 21,-0.1 1,-0.1 -19,-0.1 -0.367 14.5-135.0 -62.1 140.1 6.6 15.3 10.8 125 127 A A - 0 0 2 -21,-0.5 -1,-0.1 19,-0.3 3,-0.1 0.673 27.5-143.1 -64.0 -22.0 9.3 15.2 13.5 126 128 A N + 0 0 127 1,-0.2 2,-0.2 17,-0.2 -1,-0.1 0.841 66.9 88.6 53.9 40.7 10.5 18.6 12.2 127 129 A T S S- 0 0 29 14,-0.1 16,-2.3 112,-0.0 2,-0.3 -0.637 75.7 -96.6-138.9-162.6 14.1 17.7 12.9 128 130 A R E -M 142 0E 126 14,-0.3 14,-0.2 -2,-0.2 2,-0.2 -0.883 20.8-162.4-122.9 157.1 17.0 16.0 11.1 129 131 A T E -M 141 0E 0 12,-2.7 12,-2.6 -2,-0.3 2,-0.6 -0.684 31.4-101.1-120.8 178.7 18.5 12.5 10.9 130 132 A S E +M 140 0E 5 -2,-0.2 -63,-2.3 10,-0.2 10,-0.2 -0.948 41.6 167.2-110.6 119.1 21.9 11.4 9.6 131 133 A L E -M 139 0E 13 8,-2.8 8,-2.1 -2,-0.6 2,-0.4 -0.393 33.9-109.3-106.0-173.0 22.2 9.8 6.2 132 134 A R E -M 138 0E 62 6,-0.2 6,-0.2 -2,-0.2 -64,-0.1 -0.984 23.3-137.8-122.2 140.7 25.4 9.1 4.2 133 135 A D > - 0 0 45 4,-2.4 3,-2.0 -2,-0.4 6,-0.0 -0.136 44.7 -79.9 -81.4-175.1 26.4 11.0 1.0 134 136 A E T 3 S+ 0 0 172 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.697 132.5 50.7 -64.1 -19.7 27.9 9.3 -2.1 135 137 A N T 3 S- 0 0 124 2,-0.1 -1,-0.3 0, 0.0 -2,-0.0 0.350 121.3-105.6 -96.9 2.0 31.3 9.1 -0.4 136 138 A G S < S+ 0 0 37 -3,-2.0 215,-0.4 1,-0.3 2,-0.3 0.564 73.4 139.6 86.3 11.0 29.9 7.4 2.7 137 139 A N - 0 0 86 213,-0.1 -4,-2.4 1,-0.1 -1,-0.3 -0.639 59.1-100.0 -90.1 146.1 30.2 10.5 5.0 138 140 A A E +M 132 0E 40 -2,-0.3 2,-0.3 211,-0.3 -6,-0.2 -0.369 43.0 178.7 -64.2 136.8 27.5 11.4 7.5 139 141 A I E -M 131 0E 68 -8,-2.1 -8,-2.8 -2,-0.1 2,-0.5 -0.996 27.6-123.4-139.2 142.3 25.1 14.2 6.4 140 142 A R E +M 130 0E 134 -2,-0.3 2,-0.4 -10,-0.2 -10,-0.2 -0.753 34.2 179.3 -90.3 129.7 22.2 15.8 8.3 141 143 A V E -M 129 0E 37 -12,-2.6 -12,-2.7 -2,-0.5 -14,-0.1 -0.984 33.3-100.5-136.1 137.8 18.9 15.6 6.4 142 144 A D E -M 128 0E 100 -2,-0.4 -14,-0.3 -14,-0.2 2,-0.0 -0.268 47.6-104.6 -57.1 140.4 15.3 16.7 7.2 143 145 A T - 0 0 8 -16,-2.3 2,-0.3 1,-0.1 -36,-0.2 -0.290 29.8-116.6 -69.7 148.1 13.0 13.9 8.4 144 146 A T - 0 0 31 -38,-2.0 -19,-0.3 -40,-0.1 -38,-0.2 -0.636 33.8-102.1 -83.4 139.4 10.3 12.5 6.2 145 147 A T - 0 0 76 -2,-0.3 -21,-0.1 -21,-0.1 -1,-0.1 -0.400 48.1-131.0 -60.1 129.4 6.6 12.8 7.2 146 148 A P - 0 0 6 0, 0.0 2,-0.4 0, 0.0 -28,-0.3 -0.348 1.3-121.4 -85.2 166.2 5.5 9.5 8.6 147 149 A R E -l 118 0D 99 -30,-2.6 -28,-2.0 -25,-0.1 2,-0.3 -0.871 33.8-115.6 -95.6 134.6 2.6 7.2 8.1 148 150 A A E -l 119 0D 35 -2,-0.4 -28,-0.2 -30,-0.2 -27,-0.1 -0.557 34.5-112.3 -69.7 130.4 0.5 6.4 11.2 149 151 A L - 0 0 4 -30,-2.8 2,-0.2 -2,-0.3 -1,-0.1 -0.367 28.9-122.5 -59.5 137.6 0.6 2.8 12.1 150 152 A E >> - 0 0 117 1,-0.1 3,-2.1 -2,-0.1 4,-0.6 -0.519 23.9-112.7 -74.3 152.0 -2.7 0.9 11.6 151 153 A L G >4 S+ 0 0 91 1,-0.3 3,-1.4 2,-0.2 -1,-0.1 0.895 118.4 56.1 -52.9 -41.0 -4.1 -0.8 14.7 152 154 A D G 34 S+ 0 0 137 1,-0.3 -1,-0.3 2,-0.1 4,-0.3 0.543 99.4 61.4 -76.1 -3.1 -3.4 -4.2 13.1 153 155 A E G <> S+ 0 0 50 -3,-2.1 4,-1.5 2,-0.1 -1,-0.3 0.579 83.4 81.6 -88.8 -13.9 0.3 -3.3 12.7 154 156 A I H S+ 0 0 89 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.876 105.9 55.7 -55.7 -35.0 1.3 -6.6 17.2 156 158 A G H > S+ 0 0 34 -4,-0.3 4,-2.1 -3,-0.2 -2,-0.2 0.888 105.8 50.2 -62.8 -40.5 4.0 -6.8 14.6 157 159 A I H X S+ 0 0 4 -4,-1.5 4,-2.0 -3,-0.4 -1,-0.2 0.929 111.0 49.0 -62.9 -46.1 6.0 -4.0 16.2 158 160 A V H X S+ 0 0 20 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.938 111.6 50.0 -57.8 -45.8 5.7 -5.8 19.6 159 161 A N H X S+ 0 0 71 -4,-2.7 4,-3.2 1,-0.2 -1,-0.2 0.858 105.4 56.8 -61.9 -36.3 6.9 -9.0 17.9 160 162 A D H X S+ 0 0 46 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.913 108.9 46.1 -63.6 -41.6 9.9 -7.2 16.3 161 163 A F H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.935 114.1 49.0 -61.8 -46.0 11.1 -6.1 19.8 162 164 A R H X S+ 0 0 58 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.934 112.7 47.3 -57.1 -49.1 10.6 -9.6 21.1 163 165 A Q H X S+ 0 0 78 -4,-3.2 4,-2.5 1,-0.2 -1,-0.2 0.893 109.4 53.0 -60.6 -43.8 12.5 -11.1 18.1 164 166 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.858 108.3 51.8 -63.4 -34.4 15.3 -8.6 18.5 165 167 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.902 107.7 50.7 -68.2 -41.9 15.6 -9.7 22.2 166 168 A A H X S+ 0 0 23 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.940 113.7 46.7 -55.4 -44.8 15.8 -13.4 21.2 167 169 A N H X S+ 0 0 16 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.882 110.9 51.7 -65.6 -38.5 18.5 -12.3 18.8 168 170 A A H <>S+ 0 0 0 -4,-2.3 5,-2.0 2,-0.2 4,-0.4 0.892 108.8 50.1 -65.2 -44.0 20.3 -10.2 21.4 169 171 A R H ><5S+ 0 0 128 -4,-2.6 3,-1.4 1,-0.2 -2,-0.2 0.947 113.4 46.6 -59.1 -48.3 20.3 -13.1 23.9 170 172 A E H 3<5S+ 0 0 116 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.892 105.7 60.1 -59.3 -40.9 21.8 -15.3 21.2 171 173 A A T 3<5S- 0 0 1 -4,-2.3 -86,-0.3 -5,-0.2 -1,-0.3 0.531 120.2-108.3 -71.1 -5.1 24.4 -12.6 20.3 172 174 A G T < 5 + 0 0 26 -3,-1.4 -77,-0.2 -4,-0.4 -3,-0.2 0.549 62.1 155.2 94.3 9.4 25.7 -12.8 23.9 173 175 A F < - 0 0 5 -5,-2.0 -1,-0.3 1,-0.1 -77,-0.2 -0.416 38.9-145.1 -64.3 148.2 24.5 -9.5 25.3 174 176 A D S S- 0 0 27 -79,-3.0 2,-0.3 1,-0.2 -78,-0.2 0.763 77.7 -0.7 -84.1 -30.3 24.2 -9.5 29.1 175 177 A L E -f 96 0B 0 -80,-0.8 -78,-1.9 -7,-0.1 2,-0.4 -0.940 65.8-129.7-147.7 166.7 21.1 -7.2 29.2 176 178 A V E -fg 97 228B 0 51,-2.5 53,-3.2 -2,-0.3 2,-0.5 -0.983 11.9-155.7-123.0 141.0 18.9 -5.3 26.8 177 179 A E E -fg 98 229B 0 -80,-3.0 -78,-2.6 -2,-0.4 2,-0.4 -0.969 13.9-141.4-112.7 118.1 17.9 -1.6 27.1 178 180 A L E -fg 99 230B 0 51,-2.7 53,-2.9 -2,-0.5 2,-1.5 -0.664 16.5-131.6 -76.6 129.1 14.6 -0.6 25.4 179 181 A H E + g 0 231B 7 -80,-2.7 7,-0.5 -2,-0.4 -78,-0.3 -0.635 46.9 151.2 -86.2 89.6 15.0 2.8 23.8 180 182 A S E + g 0 232B 1 51,-1.8 53,-0.5 -2,-1.5 2,-0.2 0.019 52.4 75.2-105.2 28.4 11.9 4.6 25.1 181 183 A A > + 0 0 0 51,-0.2 3,-2.0 1,-0.1 6,-0.3 -0.585 65.2 43.2-127.0 178.0 13.5 8.0 25.0 182 184 A H T 3 S- 0 0 35 1,-0.3 -1,-0.1 -2,-0.2 50,-0.0 0.626 117.0 -63.6 59.3 25.8 14.6 10.9 22.8 183 185 A G T 3 S+ 0 0 0 1,-0.2 -1,-0.3 -3,-0.1 -78,-0.1 0.618 94.7 137.0 78.4 14.2 11.6 11.1 20.5 184 186 A Y S <> S- 0 0 15 -3,-2.0 4,-2.7 -80,-0.1 -82,-0.2 -0.055 73.8 -70.3 -84.0-170.8 12.0 7.7 18.9 185 187 A L H > S+ 0 0 0 -84,-2.7 4,-1.6 1,-0.2 5,-0.2 0.886 131.5 45.4 -59.4 -47.5 9.1 5.3 18.3 186 188 A L H > S+ 0 0 3 -7,-0.5 4,-2.0 -85,-0.4 3,-0.3 0.929 117.1 45.9 -61.1 -41.9 8.2 4.3 21.9 187 189 A H H > S+ 0 0 2 -6,-0.3 4,-2.4 -8,-0.3 -1,-0.2 0.838 104.5 62.9 -68.4 -33.4 8.5 7.9 23.0 188 190 A Q H < S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.872 108.7 42.2 -58.8 -36.8 6.4 9.0 20.0 189 191 A F H < S+ 0 0 1 -4,-1.6 -2,-0.2 -3,-0.3 -1,-0.2 0.879 113.1 53.0 -73.8 -40.7 3.5 6.9 21.4 190 192 A L H < S+ 0 0 23 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.850 97.9 75.3 -61.9 -37.7 4.2 8.1 25.0 191 193 A S >X - 0 0 0 -4,-2.4 4,-1.5 1,-0.1 3,-0.9 -0.652 67.1-150.4 -87.2 130.4 4.0 11.8 24.2 192 194 A P T 34 S+ 0 0 40 0, 0.0 -1,-0.1 0, 0.0 51,-0.1 0.761 96.9 66.3 -62.4 -22.7 0.7 13.7 23.5 193 195 A S T 34 S+ 0 0 43 49,-0.3 3,-0.1 1,-0.2 50,-0.1 0.804 115.5 25.4 -67.7 -31.7 2.7 16.0 21.3 194 196 A S T <4 S+ 0 0 0 -3,-0.9 2,-0.6 -7,-0.2 -73,-0.4 0.525 114.3 71.5-108.2 -12.2 3.5 13.3 18.8 195 197 A N < + 0 0 7 -4,-1.5 8,-0.3 -75,-0.1 -1,-0.1 -0.915 40.4 154.4-115.6 104.9 0.5 11.0 19.5 196 198 A Q + 0 0 128 -2,-0.6 -1,-0.1 6,-0.1 6,-0.1 0.071 31.3 139.4-111.0 20.2 -2.9 12.2 18.3 197 199 A R - 0 0 25 4,-0.2 -76,-0.1 1,-0.1 -2,-0.1 -0.290 41.2-161.1 -65.4 150.9 -4.4 8.7 18.0 198 200 A T + 0 0 144 5,-0.1 2,-0.1 4,-0.1 -1,-0.1 0.082 65.4 83.0-121.6 21.0 -8.0 8.2 19.1 199 201 A D S > S- 0 0 46 8,-0.0 3,-1.9 4,-0.0 8,-0.0 -0.291 107.3 -68.1-104.4-164.5 -7.8 4.3 19.4 200 202 A Q T 3 S+ 0 0 112 1,-0.3 10,-0.2 -2,-0.1 3,-0.0 0.534 130.3 59.4 -69.1 -3.7 -6.5 2.2 22.4 201 203 A Y T 3 S+ 0 0 25 9,-0.1 2,-0.3 8,-0.1 -1,-0.3 0.266 107.5 41.9-108.9 11.9 -2.9 3.5 21.7 202 204 A G S < S+ 0 0 2 -3,-1.9 2,-0.8 -6,-0.1 -6,-0.1 -0.938 87.2 41.5-146.3 171.9 -3.6 7.2 22.2 203 205 A G S S+ 0 0 50 -8,-0.3 -5,-0.1 -2,-0.3 -3,-0.1 -0.836 96.6 52.6 99.8-103.6 -5.5 9.7 24.4 204 206 A S S > S- 0 0 50 -2,-0.8 4,-2.7 1,-0.1 5,-0.2 -0.196 87.9-113.4 -63.1 158.4 -5.2 8.7 28.0 205 207 A V H > S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.888 119.5 58.2 -61.9 -35.9 -1.7 8.1 29.6 206 208 A E H 4 S+ 0 0 96 1,-0.2 4,-0.5 2,-0.2 -1,-0.2 0.940 110.6 42.2 -56.6 -46.1 -2.8 4.4 30.0 207 209 A N H >> S+ 0 0 22 1,-0.2 3,-0.6 2,-0.2 4,-0.5 0.887 113.0 52.2 -68.7 -39.0 -3.3 4.2 26.2 208 210 A R H 3< S+ 0 0 24 -4,-2.7 4,-0.4 1,-0.2 3,-0.3 0.844 114.5 42.9 -66.8 -34.3 -0.1 6.2 25.4 209 211 A A T 3X S+ 0 0 0 -4,-2.5 4,-2.4 -5,-0.2 5,-0.2 0.501 90.3 94.4 -85.1 -5.0 2.0 3.9 27.5 210 212 A R H <> S+ 0 0 77 -3,-0.6 4,-2.4 -4,-0.5 5,-0.2 0.900 83.3 47.3 -59.3 -47.3 0.2 0.8 26.2 211 213 A L H X S+ 0 0 0 -4,-0.5 4,-2.5 -3,-0.3 -1,-0.2 0.945 112.5 47.8 -60.6 -49.9 2.7 0.0 23.4 212 214 A V H > S+ 0 0 1 -4,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.914 113.5 48.2 -62.8 -37.5 5.8 0.4 25.6 213 215 A L H X S+ 0 0 10 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.879 109.8 52.0 -71.2 -34.9 4.3 -1.8 28.3 214 216 A E H X S+ 0 0 59 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.898 111.7 48.4 -61.0 -41.5 3.3 -4.5 25.7 215 217 A V H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 5,-0.3 0.946 110.7 49.8 -63.6 -48.9 6.9 -4.4 24.6 216 218 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 5,-0.2 0.941 112.8 47.2 -55.0 -48.1 8.2 -4.7 28.1 217 219 A D H X S+ 0 0 69 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.918 112.0 50.4 -61.9 -41.3 5.9 -7.7 28.8 218 220 A A H X S+ 0 0 20 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.896 113.5 44.1 -64.6 -41.4 6.9 -9.4 25.5 219 221 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.856 110.9 53.4 -77.6 -31.8 10.6 -9.1 26.1 220 222 A C H < S+ 0 0 22 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.899 112.1 47.0 -62.3 -40.4 10.4 -10.2 29.8 221 223 A N H < S+ 0 0 140 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.878 111.1 51.3 -68.6 -38.4 8.5 -13.3 28.6 222 224 A E H < S- 0 0 56 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.920 136.5 -5.7 -64.2 -45.8 11.1 -13.9 25.8 223 225 A W S < S- 0 0 36 -4,-2.3 2,-0.3 -5,-0.1 -3,-0.1 0.456 107.6 -67.2-112.9-103.9 14.1 -13.7 28.2 224 226 A S > - 0 0 48 -5,-0.2 3,-2.1 1,-0.1 4,-0.2 -0.970 30.9-117.5-157.3 146.9 13.6 -12.7 31.9 225 227 A A G > S+ 0 0 23 -2,-0.3 3,-1.8 1,-0.3 39,-1.4 0.854 113.4 63.8 -58.2 -34.2 12.6 -9.5 33.6 226 228 A D G 3 S+ 0 0 64 1,-0.3 -215,-2.6 37,-0.2 -214,-0.3 0.412 99.8 54.5 -73.8 6.4 16.1 -9.4 35.3 227 229 A R G < S+ 0 0 64 -3,-2.1 -51,-2.5 -217,-0.2 2,-0.5 0.359 93.9 88.8-109.6 -0.3 17.6 -9.0 31.8 228 230 A I E < +g 176 0B 0 -3,-1.8 36,-1.7 -4,-0.2 37,-1.1 -0.888 44.5 169.8-114.0 125.1 15.5 -6.0 30.7 229 231 A G E -gh 177 265B 0 -53,-3.2 -51,-2.7 -2,-0.5 2,-0.4 -0.814 16.2-151.2-116.1 168.4 16.2 -2.3 31.2 230 232 A I E -gh 178 266B 1 35,-1.3 37,-3.0 -2,-0.3 2,-0.5 -0.999 4.4-147.7-142.6 136.5 14.5 0.7 29.8 231 233 A R E +gh 179 267B 17 -53,-2.9 -51,-1.8 -2,-0.4 2,-0.3 -0.920 23.1 175.5-104.8 128.8 15.7 4.2 28.9 232 234 A V E -gh 180 268B 3 35,-2.6 37,-2.8 -2,-0.5 -51,-0.2 -0.905 27.5-167.2-125.3 156.8 13.2 7.1 29.3 233 235 A S + 0 0 0 -53,-0.5 -50,-0.1 -2,-0.3 37,-0.1 -0.630 32.3 153.7-136.6 68.2 13.5 10.9 28.9 234 236 A P + 0 0 12 0, 0.0 2,-0.4 0, 0.0 17,-0.2 0.438 50.2 64.3 -92.0 -1.0 10.1 11.7 30.5 235 237 A I S S- 0 0 27 34,-0.3 2,-0.2 16,-0.1 44,-0.1 -0.993 101.3 -2.3-125.6 122.3 10.7 15.3 31.8 236 238 A G S S- 0 0 27 -2,-0.4 2,-0.4 8,-0.2 7,-0.2 -0.526 94.4 -49.8 97.5-165.9 11.4 18.1 29.3 237 239 A T - 0 0 79 5,-0.2 2,-0.4 -2,-0.2 35,-0.3 -0.926 43.7-178.0-118.0 135.5 11.8 18.2 25.5 238 240 A F B > S-N 241 0F 5 3,-2.4 3,-2.4 -2,-0.4 -5,-0.0 -0.988 73.5 -18.2-136.3 121.9 14.0 16.0 23.4 239 241 A Q T 3 S- 0 0 54 -2,-0.4 -1,-0.1 1,-0.3 3,-0.1 0.886 128.9 -51.3 46.0 47.6 14.4 16.3 19.6 240 242 A N T 3 S+ 0 0 91 1,-0.2 2,-0.7 -114,-0.0 -1,-0.3 0.434 114.4 117.6 71.5 5.6 11.1 18.3 19.5 241 243 A V B < -N 238 0F 1 -3,-2.4 -3,-2.4 -47,-0.0 -1,-0.2 -0.900 43.8-173.0-102.6 109.3 9.1 15.8 21.5 242 244 A D - 0 0 66 -2,-0.7 -49,-0.3 -5,-0.3 -48,-0.2 -0.308 31.4-118.0 -85.5-178.8 7.9 17.2 24.8 243 245 A N - 0 0 15 1,-0.3 3,-0.4 -7,-0.2 7,-0.1 0.223 52.7-114.1-111.9 16.6 6.2 15.1 27.5 244 246 A G > - 0 0 20 1,-0.2 3,-0.8 -53,-0.1 -1,-0.3 -0.109 44.2 -54.6 81.8-180.0 2.9 16.9 27.5 245 247 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.459 133.2 40.4 -80.3 -2.2 1.1 19.0 30.1 246 248 A N T 3> S+ 0 0 97 -3,-0.4 4,-2.6 1,-0.1 5,-0.3 -0.280 70.4 148.0-135.0 46.2 1.2 16.4 32.9 247 249 A E H <> + 0 0 61 -3,-0.8 4,-2.2 1,-0.2 5,-0.2 0.842 69.2 48.1 -59.8 -39.5 4.7 15.1 32.4 248 250 A E H > S+ 0 0 73 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.964 115.0 43.3 -68.0 -51.4 5.4 14.3 36.1 249 251 A A H > S+ 0 0 63 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.907 115.6 50.0 -59.2 -42.9 2.2 12.4 36.8 250 252 A D H X S+ 0 0 25 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.884 109.9 50.9 -65.5 -37.7 2.4 10.6 33.5 251 253 A A H X S+ 0 0 5 -4,-2.2 4,-2.6 -5,-0.3 -2,-0.2 0.907 109.8 49.8 -63.4 -43.5 6.1 9.6 34.2 252 254 A L H X S+ 0 0 16 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.867 108.1 53.6 -67.2 -35.2 5.1 8.3 37.7 253 255 A Y H X S+ 0 0 59 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.955 111.5 45.3 -58.6 -51.8 2.3 6.2 36.2 254 256 A L H X S+ 0 0 10 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.922 113.2 50.1 -59.4 -44.4 4.7 4.6 33.7 255 257 A I H X S+ 0 0 2 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.911 108.8 50.9 -66.7 -40.5 7.3 4.0 36.4 256 258 A E H X S+ 0 0 89 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.894 112.2 48.8 -61.1 -38.3 4.8 2.3 38.8 257 259 A E H X S+ 0 0 32 -4,-2.1 4,-0.6 -5,-0.2 3,-0.4 0.927 110.1 50.1 -65.8 -44.4 3.7 0.1 35.8 258 260 A L H ><>S+ 0 0 0 -4,-2.7 3,-1.3 1,-0.2 5,-0.8 0.891 104.6 59.5 -60.1 -39.7 7.3 -0.8 35.0 259 261 A A H ><5S+ 0 0 21 -4,-2.3 3,-1.5 1,-0.3 -1,-0.2 0.856 94.8 63.4 -58.8 -35.0 7.9 -1.7 38.7 260 262 A K H 3<5S+ 0 0 149 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.786 99.2 55.1 -61.1 -26.7 5.2 -4.3 38.6 261 263 A R T <<5S- 0 0 62 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.576 102.6-132.6 -84.5 -11.7 7.3 -6.2 36.0 262 264 A G T < 5 + 0 0 51 -3,-1.5 -3,-0.1 -4,-0.5 -2,-0.1 0.855 39.1 179.9 65.6 35.0 10.4 -6.4 38.2 263 265 A I < - 0 0 5 -5,-0.8 -37,-0.2 1,-0.1 -34,-0.2 -0.187 36.7-112.2 -69.8 162.0 12.7 -5.3 35.4 264 266 A A S S- 0 0 5 -36,-1.7 30,-2.1 -39,-1.4 -254,-0.4 0.889 82.1 -7.9 -63.5 -45.0 16.4 -4.8 36.0 265 267 A Y E -hi 229 294B 0 -37,-1.1 -35,-1.3 28,-0.2 2,-0.5 -0.999 42.9-140.4-158.8 158.3 16.7 -1.1 35.6 266 268 A L E -hi 230 295B 0 28,-2.7 30,-2.6 -2,-0.3 2,-0.6 -0.995 23.0-162.6-119.6 119.5 15.3 2.3 34.8 267 269 A H E -hi 231 296B 0 -37,-3.0 -35,-2.6 -2,-0.5 2,-0.7 -0.942 5.3-159.5-111.9 114.6 17.7 4.7 32.9 268 270 A M E -hi 232 297B 7 28,-3.0 30,-1.6 -2,-0.6 2,-0.8 -0.880 9.0-159.0-103.9 114.6 16.7 8.3 33.0 269 271 A S E - i 0 298B 5 -37,-2.8 -34,-0.3 -2,-0.7 30,-0.2 -0.841 15.9-172.1 -87.1 109.0 18.1 10.6 30.4 270 272 A E - 0 0 14 28,-2.6 2,-0.3 -2,-0.8 29,-0.2 0.734 54.7 -2.3 -86.3 -26.2 17.6 13.9 32.2 271 273 A T - 0 0 29 27,-0.3 -1,-0.2 -35,-0.1 29,-0.1 -0.979 65.6-114.7-158.0 156.1 18.4 16.6 29.6 272 274 A D > - 0 0 66 -35,-0.3 3,-1.4 -2,-0.3 4,-0.1 -0.232 52.8 -84.2 -85.5-175.1 19.6 16.9 26.1 273 275 A L T 3 S+ 0 0 132 1,-0.3 3,-0.1 -2,-0.1 -1,-0.0 0.734 127.7 58.4 -68.7 -22.9 23.0 18.5 25.2 274 276 A A T 3 S- 0 0 97 1,-0.2 -1,-0.3 0, 0.0 0, 0.0 0.610 104.1-142.5 -80.4 -12.9 21.6 22.1 25.3 275 277 A G < - 0 0 42 -3,-1.4 2,-0.3 2,-0.0 -1,-0.2 -0.044 25.8-175.7 83.1 177.3 20.5 21.5 28.9 276 278 A G - 0 0 63 -3,-0.1 -6,-0.0 -5,-0.1 -40,-0.0 -0.974 43.8 -19.6 173.5-169.9 17.5 22.6 30.9 277 279 A K - 0 0 195 -2,-0.3 3,-0.1 1,-0.1 -2,-0.0 -0.279 67.8-119.4 -57.5 133.0 15.9 22.6 34.3 278 280 A P - 0 0 109 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.340 33.8 -91.3 -68.9 155.9 17.3 20.0 36.7 279 281 A Y - 0 0 17 1,-0.1 2,-0.1 -44,-0.1 -9,-0.0 -0.447 46.2-117.0 -56.6 137.1 15.1 17.2 38.1 280 282 A S > - 0 0 57 1,-0.1 4,-2.3 -2,-0.1 5,-0.2 -0.469 14.0-125.4 -72.5 150.3 13.6 18.3 41.5 281 283 A E H > S+ 0 0 96 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.890 112.8 59.3 -65.9 -31.8 14.7 16.3 44.5 282 284 A A H > S+ 0 0 54 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.911 106.4 46.8 -59.2 -44.4 10.9 15.8 45.2 283 285 A F H > S+ 0 0 4 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.932 110.5 52.0 -64.0 -44.6 10.5 14.2 41.8 284 286 A R H X S+ 0 0 18 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.893 110.0 50.0 -57.3 -40.2 13.6 12.0 42.3 285 287 A Q H X S+ 0 0 105 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.894 108.8 51.6 -64.6 -42.0 12.1 10.8 45.6 286 288 A K H X S+ 0 0 74 -4,-2.1 4,-0.7 1,-0.2 -2,-0.2 0.893 112.5 46.1 -63.1 -39.6 8.7 10.0 44.0 287 289 A V H >X S+ 0 0 3 -4,-2.4 4,-1.3 1,-0.2 3,-1.0 0.947 111.6 52.0 -64.2 -47.8 10.5 7.9 41.4 288 290 A R H 3< S+ 0 0 59 -4,-2.5 3,-0.3 1,-0.3 -2,-0.2 0.857 107.2 50.8 -61.6 -39.5 12.7 6.2 44.0 289 291 A E H 3< S+ 0 0 124 -4,-2.2 -1,-0.3 1,-0.2 -2,-0.2 0.687 114.1 46.7 -72.3 -17.7 9.7 5.1 46.2 290 292 A R H << S+ 0 0 64 -3,-1.0 2,-0.4 -4,-0.7 -1,-0.2 0.641 105.8 59.5 -98.2 -16.9 7.9 3.6 43.2 291 293 A F < - 0 0 4 -4,-1.3 -1,-0.1 -3,-0.3 -35,-0.1 -0.956 51.4-173.8-124.2 134.5 10.7 1.6 41.5 292 294 A H + 0 0 159 -2,-0.4 2,-0.2 -29,-0.1 -1,-0.1 0.099 62.2 77.1-119.0 16.9 12.7 -1.2 43.1 293 295 A G S S- 0 0 22 1,-0.1 -28,-0.2 -284,-0.0 2,-0.2 -0.451 98.0 -57.8-104.2-169.9 15.3 -2.0 40.5 294 296 A V E -i 265 0B 10 -30,-2.1 -28,-2.7 -2,-0.2 2,-0.5 -0.469 46.2-150.0 -70.7 140.0 18.4 -0.0 39.6 295 297 A I E -i 266 0B 4 -30,-0.2 21,-2.9 -2,-0.2 22,-1.6 -0.970 10.0-166.5-113.1 123.8 18.1 3.7 38.7 296 298 A I E -ij 267 317B 0 -30,-2.6 -28,-3.0 -2,-0.5 2,-0.3 -0.941 5.7-155.5-108.5 126.9 20.7 5.1 36.3 297 299 A G E +ij 268 318B 0 20,-2.4 22,-2.5 -2,-0.5 2,-0.3 -0.799 17.3 171.8 -99.6 147.5 21.0 8.8 35.9 298 300 A A E +ij 269 319B 2 -30,-1.6 -28,-2.6 -2,-0.3 -27,-0.3 -0.993 26.5 90.2-150.7 154.0 22.4 10.5 32.8 299 301 A G S S- 0 0 20 20,-0.6 -27,-0.1 -2,-0.3 -1,-0.1 0.531 102.7 -22.0 122.0 94.5 22.9 13.9 31.2 300 302 A A S S+ 0 0 74 1,-0.1 20,-0.1 -29,-0.1 -2,-0.0 0.802 88.7 168.9 52.3 37.7 25.9 16.2 31.8 301 303 A Y - 0 0 13 18,-0.3 2,-0.3 -4,-0.1 -1,-0.1 -0.258 24.5-153.2 -68.6 158.8 26.7 14.4 35.0 302 304 A T > - 0 0 71 1,-0.1 4,-2.4 18,-0.0 5,-0.2 -0.902 30.9-112.8-116.3 162.5 29.9 14.8 36.9 303 305 A A H > S+ 0 0 10 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.906 119.7 55.0 -56.7 -40.2 31.4 12.2 39.2 304 306 A E H > S+ 0 0 121 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.908 107.3 47.7 -64.5 -41.7 30.6 14.5 42.1 305 307 A K H > S+ 0 0 69 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.918 111.9 51.1 -64.1 -41.8 26.9 14.8 41.2 306 308 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.944 110.6 47.9 -60.6 -47.5 26.7 11.1 40.9 307 309 A E H X S+ 0 0 36 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.904 111.0 52.5 -59.2 -42.0 28.3 10.6 44.3 308 310 A D H X S+ 0 0 77 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.939 113.7 41.2 -59.2 -48.3 25.9 13.1 45.8 309 311 A L H <>S+ 0 0 7 -4,-2.5 5,-2.4 2,-0.2 6,-0.9 0.851 114.6 50.8 -74.3 -33.8 22.8 11.5 44.4 310 312 A I H ><5S+ 0 0 18 -4,-2.7 3,-1.5 -5,-0.2 -1,-0.2 0.926 111.0 50.5 -63.8 -43.5 24.0 7.9 45.2 311 313 A G H 3<5S+ 0 0 63 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.792 106.3 54.8 -64.5 -30.3 24.7 9.1 48.8 312 314 A K T 3<5S- 0 0 89 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.456 115.0-119.2 -79.6 -4.6 21.2 10.6 49.0 313 315 A G T < 5S+ 0 0 36 -3,-1.5 -3,-0.2 2,-0.2 -2,-0.1 0.725 83.5 113.9 75.0 24.6 19.8 7.2 48.1 314 316 A L S > S+ 0 0 21 -2,-0.4 4,-1.8 -301,-0.2 3,-1.1 0.838 75.0 26.2 -96.6 -80.9 28.2 9.7 27.2 322 324 A R H 3> S+ 0 0 84 1,-0.3 4,-1.9 2,-0.2 5,-0.2 0.855 119.2 57.1 -62.4 -35.6 30.8 12.1 25.8 323 325 A D H 3> S+ 0 0 45 1,-0.2 4,-1.1 2,-0.2 -1,-0.3 0.829 108.6 49.5 -64.0 -29.3 33.4 11.4 28.6 324 326 A Y H <4 S+ 0 0 0 -3,-1.1 -2,-0.2 2,-0.2 -1,-0.2 0.812 103.7 58.3 -77.0 -32.5 33.2 7.7 27.5 325 327 A I H < S+ 0 0 4 -4,-1.8 -2,-0.2 1,-0.2 34,-0.2 0.951 119.0 31.8 -52.3 -47.4 33.7 8.6 23.8 326 328 A A H < S+ 0 0 0 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.586 118.8 50.9 -93.2 -12.4 37.0 10.3 24.8 327 329 A N >< - 0 0 0 -4,-1.1 3,-1.5 -5,-0.2 -1,-0.2 -0.848 50.2-179.2-133.6 95.1 38.2 8.1 27.8 328 330 A P T 3 S+ 0 0 2 0, 0.0 -280,-0.3 0, 0.0 3,-0.3 0.885 93.1 43.5 -62.9 -33.3 38.3 4.4 27.3 329 331 A D T 3> S+ 0 0 17 31,-0.2 4,-2.3 1,-0.2 5,-0.2 -0.261 71.4 141.5-101.4 42.9 39.5 4.1 30.9 330 332 A L H <> + 0 0 0 -3,-1.5 4,-2.8 1,-0.2 5,-0.3 0.868 68.5 59.5 -53.5 -39.7 37.1 6.6 32.4 331 333 A V H > S+ 0 0 13 -3,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.965 108.4 42.7 -55.5 -52.6 36.7 4.4 35.5 332 334 A A H > S+ 0 0 25 1,-0.2 4,-2.5 2,-0.2 6,-0.2 0.893 113.7 52.8 -61.4 -40.4 40.4 4.6 36.3 333 335 A R H X>S+ 0 0 11 -4,-2.3 5,-2.3 1,-0.2 4,-1.0 0.925 112.1 44.0 -63.8 -43.7 40.6 8.3 35.5 334 336 A L H <5S+ 0 0 23 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.881 114.1 51.0 -68.4 -34.9 37.6 9.1 37.9 335 337 A Q H <5S+ 0 0 100 -4,-2.5 -2,-0.2 -5,-0.3 -1,-0.2 0.911 118.4 37.2 -66.5 -41.5 39.1 6.8 40.6 336 338 A K H <5S- 0 0 140 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.491 107.0-122.4 -87.3 -7.9 42.5 8.5 40.4 337 339 A K T <5 + 0 0 115 -4,-1.0 -3,-0.2 -3,-0.2 2,-0.2 0.865 56.5 161.5 60.7 40.0 41.1 12.1 39.8 338 340 A A < - 0 0 33 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.0 -0.477 45.3 -91.1 -82.9 158.1 43.1 12.2 36.5 339 341 A E - 0 0 175 -2,-0.2 2,-0.4 1,-0.1 -1,-0.1 -0.275 40.7-121.0 -61.9 155.7 42.4 14.7 33.7 340 342 A L - 0 0 64 1,-0.1 3,-0.1 -6,-0.0 -13,-0.1 -0.825 30.2-101.2-103.0 140.6 40.1 13.6 31.0 341 343 A N - 0 0 27 -2,-0.4 2,-0.3 19,-0.2 -15,-0.1 -0.220 44.3 -97.0 -58.1 147.5 41.1 13.5 27.3 342 344 A P - 0 0 107 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.478 41.3-125.9 -68.0 128.2 40.1 16.4 25.1 343 345 A Q - 0 0 69 -2,-0.3 -20,-0.1 -3,-0.1 -21,-0.0 -0.474 12.7-154.8 -75.7 147.6 37.0 15.5 23.1 344 346 A R > - 0 0 67 -2,-0.2 3,-1.9 1,-0.1 4,-0.1 -0.793 11.8-177.8-121.3 83.1 36.9 15.8 19.3 345 347 A P G > S+ 0 0 79 0, 0.0 3,-1.8 0, 0.0 4,-0.5 0.747 72.7 73.1 -59.8 -24.9 33.2 16.3 18.4 346 348 A E G 3 S+ 0 0 165 1,-0.3 3,-0.2 2,-0.1 -2,-0.0 0.740 102.3 44.0 -62.2 -21.2 33.8 16.4 14.6 347 349 A S G < S+ 0 0 18 -3,-1.9 -1,-0.3 1,-0.1 3,-0.1 0.206 83.1 96.4-110.1 16.3 34.4 12.6 14.7 348 350 A F S < S+ 0 0 36 -3,-1.8 2,-0.6 1,-0.2 -1,-0.1 0.943 86.1 47.9 -62.2 -45.3 31.5 11.7 17.0 349 351 A S S S- 0 0 67 -4,-0.5 -211,-0.3 -3,-0.2 -323,-0.2 -0.878 114.3 -27.3-111.9 116.9 29.3 10.8 14.0 350 352 A G S S+ 0 0 6 -325,-2.5 2,-0.3 -2,-0.6 -323,-0.2 -0.136 84.0 87.5 79.4-177.1 30.5 8.6 11.1 351 353 A G S S- 0 0 56 -215,-0.4 2,-0.1 -325,-0.3 -1,-0.1 -0.659 70.4 -81.9 91.4-142.2 34.0 8.0 9.7 352 354 A G S S- 0 0 31 2,-0.4 5,-0.1 -2,-0.3 -2,-0.0 -0.304 72.3 -31.1-140.7-142.3 36.5 5.4 10.9 353 355 A A S >>>S+ 0 0 47 3,-0.2 3,-2.3 -2,-0.1 4,-2.0 0.823 101.8 95.0 -63.1 -34.6 39.1 4.7 13.5 354 356 A E T 345S+ 0 0 145 1,-0.3 -2,-0.4 2,-0.2 5,-0.0 -0.429 101.9 7.8 -65.6 128.2 40.1 8.4 13.9 355 357 A G T 345S+ 0 0 0 -2,-0.2 -1,-0.3 1,-0.1 -11,-0.1 0.619 130.0 64.6 74.1 17.2 38.1 9.9 16.9 356 358 A Y T <45S+ 0 0 0 -3,-2.3 3,-0.2 -30,-0.0 -2,-0.2 0.609 115.7 8.2-131.5 -64.1 36.8 6.4 17.7 357 359 A T T <5S+ 0 0 18 -4,-2.0 -3,-0.1 1,-0.1 -4,-0.1 0.306 112.8 78.5-109.0 6.4 39.5 3.9 18.8 358 360 A D < + 0 0 72 -5,-0.8 -1,-0.1 2,-0.1 -4,-0.1 0.212 57.7 110.4-107.2 14.1 42.4 6.4 19.0 359 361 A Y - 0 0 7 -3,-0.2 2,-0.1 -34,-0.2 -32,-0.0 -0.795 68.0-129.7 -84.9 126.9 41.7 8.1 22.4 360 362 A P - 0 0 75 0, 0.0 -31,-0.2 0, 0.0 -19,-0.2 -0.355 5.2-128.2 -80.9 155.0 44.4 6.9 24.8 361 363 A S 0 0 64 -33,-0.1 -31,-0.0 -34,-0.1 -316,-0.0 -0.391 360.0 360.0 -76.6 170.7 44.3 5.4 28.2 362 364 A L 0 0 136 -2,-0.1 -1,-0.1 -33,-0.1 -35,-0.0 0.733 360.0 360.0 -58.7 360.0 46.3 6.8 31.1