==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 12-AUG-94 1RLR . COMPND 2 MOLECULE: RIBONUCLEOTIDE REDUCTASE PROTEIN R1; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR U.UHLIN,H.EKLUND . 737 2 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28933.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 500 67.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 39 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 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 . 2 0.3 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 . 2 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 . 33 4.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 258 35.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.8 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 4 2 2 2 2 1 3 4 0 6 0 1 0 0 2 0 0 0 0 0 0 0 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 0 1 2 2 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 PARALLEL BRIDGES PER LADDER . 3 3 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 1 1 0 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 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 10 A R 0 0 141 0, 0.0 3,-0.1 0, 0.0 44,-0.0 0.000 360.0 360.0 360.0-162.2 65.4 71.3 81.6 2 11 A D + 0 0 166 1,-0.2 2,-0.1 43,-0.0 43,-0.0 0.685 360.0 9.4-134.0 -57.5 62.4 69.4 83.4 3 12 A G S > S+ 0 0 53 3,-0.0 3,-0.8 0, 0.0 -1,-0.2 -0.293 134.0 23.1-130.2-123.5 60.6 66.1 81.5 4 13 A S T 3 + 0 0 83 1,-0.2 41,-0.0 2,-0.1 39,-0.0 0.458 62.7 137.1-124.9 122.9 62.5 65.4 78.9 5 14 A T T 3 + 0 0 14 1,-0.4 -1,-0.2 2,-0.2 0, 0.0 0.089 51.9 110.0 -48.6 10.0 66.1 66.7 79.3 6 15 A E S < S- 0 0 114 -3,-0.8 -1,-0.4 37,-0.0 38,-0.2 0.562 83.3-151.1 -73.1 20.7 66.6 63.5 77.9 7 16 A R - 0 0 96 36,-0.1 -2,-0.2 1,-0.1 42,-0.1 0.168 6.4 -23.9-150.1-121.6 67.5 65.7 75.4 8 17 A I S S- 0 0 51 41,-0.0 5,-0.2 1,-0.0 -1,-0.1 0.886 73.2-125.6 71.6 69.2 68.4 68.1 72.1 9 18 A N > - 0 0 110 1,-0.1 3,-1.3 3,-0.1 4,-0.2 -0.267 30.2 -95.7 -53.8 137.8 68.9 64.5 69.8 10 19 A L T 3> S+ 0 0 75 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.393 110.8 69.6 -38.7 -32.4 72.4 64.6 68.1 11 20 A D H 3> S+ 0 0 121 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.933 101.3 54.7 -58.2 -36.0 72.1 66.1 64.4 12 21 A K H <> S+ 0 0 99 -3,-1.3 4,-2.5 2,-0.2 -1,-0.2 0.874 103.7 54.6 -61.2 -40.4 71.4 69.4 66.1 13 22 A I H > S+ 0 0 2 1,-0.2 4,-2.5 -4,-0.2 5,-0.2 0.960 107.6 49.6 -58.8 -50.5 74.7 69.0 68.0 14 23 A H H X S+ 0 0 77 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.843 109.7 51.2 -60.9 -33.5 76.6 68.6 64.8 15 24 A R H X S+ 0 0 152 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.926 109.5 48.7 -72.6 -44.2 75.0 71.7 63.3 16 25 A V H X S+ 0 0 33 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.911 114.2 48.3 -60.3 -34.8 75.9 73.9 66.3 17 26 A L H X S+ 0 0 0 -4,-2.5 4,-1.5 -5,-0.2 -2,-0.2 0.919 109.5 52.0 -74.6 -36.5 79.4 72.4 65.9 18 27 A D H X S+ 0 0 100 -4,-2.6 4,-0.6 -5,-0.2 -2,-0.2 0.952 111.5 47.3 -54.9 -50.6 79.4 73.2 62.2 19 28 A W H >< S+ 0 0 91 -4,-2.4 3,-1.3 1,-0.2 -2,-0.2 0.943 111.6 49.4 -57.5 -50.7 78.4 76.9 62.9 20 29 A A H 3< S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.844 107.9 56.9 -65.0 -28.3 81.0 77.4 65.6 21 30 A A H >< S+ 0 0 15 -4,-1.5 3,-1.8 -5,-0.2 -1,-0.3 0.614 76.3 125.7 -83.9 -7.6 83.7 76.0 63.3 22 31 A E T << S+ 0 0 146 -3,-1.3 3,-0.1 -4,-0.6 -3,-0.1 -0.151 80.6 5.9 -56.9 126.0 83.2 78.4 60.5 23 32 A G T 3 S+ 0 0 53 1,-0.3 -1,-0.3 0, 0.0 2,-0.1 0.324 101.8 122.5 90.7 -12.1 86.2 80.2 59.4 24 33 A L < - 0 0 25 -3,-1.8 2,-0.4 -4,-0.1 -1,-0.3 -0.355 48.9-147.4 -80.4 160.6 88.5 78.2 61.6 25 34 A H S S+ 0 0 117 1,-0.1 42,-0.3 -3,-0.1 3,-0.1 -0.937 70.1 16.1-131.3 149.7 91.4 76.1 60.5 26 35 A N S S+ 0 0 122 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.639 86.3 132.2 64.5 21.6 92.8 72.9 61.7 27 36 A V - 0 0 30 -6,-0.1 2,-0.8 -3,-0.1 -1,-0.2 -0.858 46.0-148.7-110.0 133.9 89.8 72.0 63.8 28 37 A S > - 0 0 36 -2,-0.4 4,-1.6 1,-0.2 3,-0.3 -0.822 8.0-170.1-103.6 106.9 88.2 68.6 63.8 29 38 A I H > S+ 0 0 28 -2,-0.8 4,-2.1 1,-0.2 -1,-0.2 0.871 89.5 53.7 -59.7 -38.5 84.4 68.6 64.4 30 39 A S H > S+ 0 0 62 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.857 101.9 54.7 -76.8 -25.6 84.4 64.9 64.8 31 40 A Q H > S+ 0 0 89 -3,-0.3 4,-2.0 2,-0.2 5,-0.3 0.963 109.7 48.9 -62.8 -44.0 87.1 64.6 67.4 32 41 A V H X S+ 0 0 0 -4,-1.6 4,-1.7 1,-0.2 5,-0.3 0.940 114.7 47.1 -53.3 -47.5 85.1 67.0 69.5 33 42 A E H X S+ 0 0 34 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.898 109.8 50.4 -62.1 -44.7 82.0 64.7 68.8 34 43 A L H X S+ 0 0 132 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.981 115.3 43.4 -58.5 -50.9 83.8 61.4 69.5 35 44 A R H < S+ 0 0 107 -4,-2.0 4,-0.2 1,-0.2 -2,-0.2 0.749 119.4 40.8 -63.5 -36.9 85.1 62.6 72.9 36 45 A S H >< S+ 0 0 0 -4,-1.7 3,-0.8 -5,-0.3 -1,-0.2 0.869 108.6 60.9 -88.9 -29.5 82.0 64.3 74.1 37 46 A H H >< S+ 0 0 52 -4,-2.3 3,-2.1 -5,-0.3 -2,-0.2 0.921 96.6 55.4 -69.4 -41.1 79.6 61.6 72.9 38 47 A I T 3< S+ 0 0 147 -4,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.635 103.4 63.4 -62.8 -7.5 80.9 58.6 75.0 39 48 A Q T < S+ 0 0 102 -3,-0.8 -1,-0.3 -4,-0.2 2,-0.2 0.481 85.0 94.7 -87.3 -4.3 80.3 60.9 77.9 40 49 A F < - 0 0 41 -3,-2.1 2,-0.3 -4,-0.2 3,-0.1 -0.578 50.4-178.1 -89.5 156.3 76.5 61.1 77.4 41 50 A Y > - 0 0 139 -2,-0.2 3,-2.5 1,-0.1 -2,-0.0 -0.989 41.1 -91.7-150.0 155.9 73.9 59.0 79.1 42 51 A D T 3 S+ 0 0 135 -2,-0.3 -1,-0.1 1,-0.3 -2,-0.0 0.839 120.5 43.1 -31.0 -63.5 70.1 58.5 79.1 43 52 A G T 3 S+ 0 0 57 -3,-0.1 -1,-0.3 -37,-0.0 -36,-0.1 0.441 85.2 146.3 -69.2 1.6 69.3 61.0 81.9 44 53 A I < - 0 0 10 -3,-2.5 2,-0.1 -38,-0.2 5,-0.1 0.011 48.1-122.6 -66.6 133.5 71.6 63.9 80.8 45 54 A K >> - 0 0 92 1,-0.2 4,-2.5 -39,-0.1 3,-0.7 -0.421 14.1-133.0 -60.6 132.3 70.9 67.6 81.2 46 55 A T H 3> S+ 0 0 20 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.874 111.8 57.9 -53.3 -32.1 70.9 69.7 78.0 47 56 A S H 3> S+ 0 0 40 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.890 107.0 45.0 -66.7 -32.9 73.0 72.1 80.0 48 57 A D H <> S+ 0 0 71 -3,-0.7 4,-2.2 2,-0.2 -2,-0.2 0.854 104.7 60.6 -84.2 -28.0 75.5 69.3 80.6 49 58 A I H X S+ 0 0 6 -4,-2.5 4,-2.0 1,-0.2 5,-0.2 0.976 109.1 48.1 -52.7 -46.4 75.4 68.3 76.9 50 59 A H H X S+ 0 0 18 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.869 108.3 50.2 -58.0 -51.4 76.6 71.9 76.4 51 60 A E H X S+ 0 0 67 -4,-1.7 4,-2.6 2,-0.2 5,-0.3 0.910 109.3 54.2 -55.5 -41.7 79.4 71.8 79.0 52 61 A T H X S+ 0 0 23 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.938 108.6 45.4 -63.8 -47.0 80.8 68.5 77.5 53 62 A I H X S+ 0 0 4 -4,-2.0 4,-2.5 -5,-0.2 5,-0.2 0.968 115.1 50.8 -64.2 -37.5 81.1 69.8 73.9 54 63 A I H X S+ 0 0 12 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.959 115.2 39.3 -64.3 -50.7 82.8 73.0 75.3 55 64 A K H X S+ 0 0 81 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.924 112.5 57.9 -69.7 -32.7 85.3 71.3 77.4 56 65 A A H < S+ 0 0 4 -4,-2.5 4,-0.5 -5,-0.3 -1,-0.2 0.925 113.0 40.8 -62.4 -38.4 85.8 68.7 74.7 57 66 A A H >< S+ 0 0 0 -4,-2.5 3,-0.6 -5,-0.2 15,-0.3 0.865 112.4 54.5 -78.4 -32.7 86.7 71.6 72.4 58 67 A A H >< S+ 0 0 2 -4,-2.9 3,-0.8 -5,-0.2 -2,-0.2 0.751 101.3 60.6 -71.8 -19.7 88.8 73.4 75.1 59 68 A D T 3< S+ 0 0 51 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.726 97.0 58.6 -76.2 -22.8 90.9 70.3 75.7 60 69 A L T < S+ 0 0 29 -3,-0.6 2,-0.4 -4,-0.5 8,-0.2 0.284 75.5 124.7 -88.7 13.0 92.2 70.2 72.1 61 70 A I < + 0 0 6 -3,-0.8 2,-0.3 7,-0.2 584,-0.1 -0.620 32.5 145.7 -80.9 127.3 93.7 73.8 72.4 62 71 A S - 0 0 40 3,-0.6 6,-0.2 -2,-0.4 3,-0.2 -0.969 64.0-115.3-157.0 155.7 97.3 73.6 71.5 63 72 A R S S+ 0 0 119 -2,-0.3 4,-0.1 1,-0.2 -1,-0.1 0.859 118.9 61.9 -69.4 -29.4 99.8 75.7 69.7 64 73 A D S S+ 0 0 149 1,-0.3 -1,-0.2 2,-0.1 -3,-0.1 0.905 128.4 11.1 -65.3 -27.2 99.8 73.0 67.0 65 74 A A S > S+ 0 0 13 -3,-0.2 3,-0.8 -5,-0.1 -3,-0.6 -0.525 73.0 161.7-149.1 76.7 96.2 73.9 66.5 66 75 A P T > + 0 0 20 0, 0.0 3,-2.0 0, 0.0 4,-0.3 0.487 59.1 86.7 -71.0 -9.2 95.0 77.2 68.4 67 76 A D T >> S+ 0 0 35 -42,-0.3 3,-2.3 1,-0.3 4,-1.8 0.789 72.2 76.0 -68.8 -18.5 91.8 77.8 66.4 68 77 A Y H <> S+ 0 0 11 -3,-0.8 4,-2.6 1,-0.3 5,-0.3 0.676 80.3 72.9 -60.6 -21.4 90.1 75.5 68.9 69 78 A Q H <> S+ 0 0 8 -3,-2.0 67,-1.9 2,-0.2 4,-0.5 0.808 103.8 39.1 -56.4 -34.6 90.4 78.6 71.2 70 79 A Y H <> S+ 0 0 52 -3,-2.3 4,-2.9 -4,-0.3 5,-0.3 0.835 113.3 53.4 -88.1 -40.1 87.6 80.1 69.0 71 80 A L H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 5,-0.2 0.965 113.4 43.2 -59.2 -50.3 85.6 76.8 68.6 72 81 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 -15,-0.3 -1,-0.2 0.908 117.0 50.2 -61.7 -37.1 85.4 76.3 72.5 73 82 A A H X S+ 0 0 1 -4,-0.5 4,-3.1 -5,-0.3 -2,-0.2 0.972 107.6 49.2 -63.1 -55.1 84.7 80.0 72.8 74 83 A R H X S+ 0 0 29 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.904 113.0 49.5 -54.0 -42.7 81.8 80.2 70.2 75 84 A L H X S+ 0 0 3 -4,-2.0 4,-2.0 -5,-0.3 5,-0.2 0.959 110.1 50.0 -62.9 -49.7 80.2 77.2 71.9 76 85 A A H X S+ 0 0 5 -4,-2.2 4,-2.8 -5,-0.2 3,-0.3 0.970 109.9 51.7 -51.7 -49.7 80.5 78.9 75.4 77 86 A I H X S+ 0 0 8 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.922 108.8 51.6 -51.2 -51.8 79.0 82.1 74.0 78 87 A F H X S+ 0 0 29 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.825 111.9 44.7 -51.5 -48.5 76.0 80.1 72.6 79 88 A H H X S+ 0 0 8 -4,-2.0 4,-2.9 -3,-0.3 -1,-0.2 0.920 111.4 53.0 -64.8 -50.4 75.3 78.3 75.9 80 89 A L H X S+ 0 0 12 -4,-2.8 4,-1.8 -5,-0.2 5,-0.3 0.939 108.6 52.4 -53.6 -40.8 75.6 81.6 77.9 81 90 A R H X S+ 0 0 4 -4,-2.7 4,-2.7 -5,-0.3 6,-0.6 0.943 111.4 43.4 -63.9 -42.0 73.1 83.1 75.5 82 91 A K H X S+ 0 0 84 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.937 114.6 54.7 -66.4 -32.8 70.5 80.3 76.0 83 92 A K H < S+ 0 0 85 -4,-2.9 73,-0.3 1,-0.2 -1,-0.2 0.733 120.6 27.2 -73.9 -28.9 71.4 80.6 79.8 84 93 A A H < S+ 0 0 21 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.705 135.8 25.4-100.2 -29.4 70.6 84.3 80.0 85 94 A Y H < S- 0 0 24 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.492 89.9-124.5-114.8 -4.2 68.0 84.8 77.2 86 95 A G S < S+ 0 0 60 -4,-1.9 2,-0.3 -5,-0.4 -4,-0.2 0.358 93.3 47.0 73.7 -16.9 66.3 81.5 76.7 87 96 A Q S S- 0 0 110 -6,-0.6 -2,-0.3 2,-0.2 -3,-0.2 -0.922 93.2-106.8-141.4 173.2 67.3 81.7 73.0 88 97 A F S S+ 0 0 42 -2,-0.3 -2,-0.1 -3,-0.1 -1,-0.1 0.877 96.0 84.6 -71.7 -32.0 70.5 82.5 71.0 89 98 A E S S- 0 0 122 -4,-0.1 -2,-0.2 1,-0.1 0, 0.0 -0.519 81.4-124.8 -77.0 125.3 69.2 85.9 69.9 90 99 A P - 0 0 17 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.430 24.0-114.4 -63.8 143.4 69.6 88.9 72.4 91 100 A P - 0 0 38 0, 0.0 2,-0.2 0, 0.0 3,-0.0 -0.036 46.7 -79.6 -60.7 170.8 66.5 90.9 73.5 92 101 A A > - 0 0 37 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.537 42.0-116.5 -72.2 149.3 66.3 94.6 72.5 93 102 A L H > S+ 0 0 0 2,-0.2 4,-3.1 26,-0.2 3,-0.3 0.942 114.0 49.2 -48.4 -51.9 68.4 96.9 74.7 94 103 A Y H > S+ 0 0 66 1,-0.3 4,-2.6 2,-0.2 5,-0.3 0.916 112.5 47.0 -58.3 -47.9 65.3 98.8 76.1 95 104 A D H > S+ 0 0 101 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.798 115.3 46.1 -64.4 -36.8 63.5 95.6 76.9 96 105 A H H X S+ 0 0 0 -4,-2.3 4,-2.6 -3,-0.3 -2,-0.2 0.933 112.7 49.0 -74.0 -47.5 66.5 94.1 78.6 97 106 A V H X S+ 0 0 0 -4,-3.1 4,-3.2 -5,-0.2 5,-0.2 0.937 112.0 48.7 -59.0 -46.5 67.4 97.3 80.6 98 107 A V H X S+ 0 0 35 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.951 114.1 47.8 -56.5 -47.8 63.7 97.6 82.0 99 108 A K H X S+ 0 0 82 -4,-1.3 4,-1.2 -5,-0.3 -1,-0.2 0.931 116.7 41.6 -58.1 -47.0 63.8 94.0 82.9 100 109 A M H <>S+ 0 0 0 -4,-2.6 5,-1.8 2,-0.2 6,-1.5 0.864 112.5 54.2 -75.2 -32.6 67.1 94.3 84.7 101 110 A V H ><5S+ 0 0 26 -4,-3.2 3,-1.7 1,-0.2 -2,-0.2 0.971 111.4 45.2 -68.7 -51.7 66.3 97.7 86.3 102 111 A E H 3<5S+ 0 0 149 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.756 108.3 58.2 -68.0 -15.9 63.2 96.3 87.9 103 112 A M T 3<5S- 0 0 63 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.501 113.5-114.6 -84.4 -0.1 65.1 93.1 89.0 104 113 A G T < 5S+ 0 0 47 -3,-1.7 -3,-0.2 -4,-0.2 -2,-0.1 0.522 92.3 102.7 86.3 6.6 67.6 95.2 91.0 105 114 A K S - 0 0 10 100,-2.3 3,-2.0 -2,-0.3 4,-0.4 -0.542 27.4-131.2 -74.4 131.4 71.1 101.0 88.3 108 117 A N T >> S+ 0 0 83 -2,-0.3 3,-0.6 1,-0.3 4,-0.6 0.711 98.1 76.1 -61.4 -19.1 67.7 102.7 87.9 109 118 A H H >> S+ 0 0 58 1,-0.2 4,-2.7 2,-0.2 3,-0.9 0.796 77.1 72.1 -63.2 -24.2 69.3 105.9 86.6 110 119 A L H <> S+ 0 0 4 -3,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.927 101.1 47.5 -56.2 -35.8 69.9 104.3 83.1 111 120 A L H <4 S+ 0 0 55 -3,-0.6 -1,-0.2 -4,-0.4 -2,-0.2 0.651 112.9 48.1 -78.9 -17.4 66.1 104.6 82.7 112 121 A E H << S+ 0 0 123 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.2 0.828 113.1 44.9 -81.7 -47.4 66.1 108.3 83.9 113 122 A D H < S+ 0 0 51 -4,-2.7 2,-0.4 1,-0.1 -2,-0.2 0.770 113.9 48.3 -77.3 -24.8 69.0 109.5 81.7 114 123 A Y S < S- 0 0 5 -4,-1.6 2,-0.2 -5,-0.3 -1,-0.1 -0.956 75.5-136.7-120.1 138.3 68.0 107.9 78.5 115 124 A T >> - 0 0 66 -2,-0.4 3,-1.9 1,-0.1 4,-1.9 -0.517 35.0-102.9 -76.2 153.0 64.6 107.9 76.8 116 125 A E H 3> S+ 0 0 110 1,-0.3 4,-2.2 2,-0.2 -22,-0.2 0.832 125.0 51.2 -43.4 -37.9 63.2 104.7 75.2 117 126 A E H 3> S+ 0 0 142 2,-0.2 4,-0.8 1,-0.2 -1,-0.3 0.652 102.4 56.4 -83.7 -15.8 64.1 106.1 71.8 118 127 A E H <> S+ 0 0 22 -3,-1.9 4,-1.5 2,-0.1 -2,-0.2 0.858 111.4 47.7 -72.6 -28.9 67.7 106.8 72.8 119 128 A F H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.934 106.1 54.9 -72.0 -42.2 67.7 103.0 73.8 120 129 A K H X S+ 0 0 145 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.834 112.5 46.7 -53.4 -34.9 66.2 101.8 70.4 121 130 A Q H < S+ 0 0 90 -4,-0.8 4,-0.3 2,-0.2 -1,-0.2 0.803 106.0 53.8 -73.9 -44.7 69.0 103.7 68.8 122 131 A M H >X S+ 0 0 0 -4,-1.5 3,-2.0 2,-0.2 4,-1.1 0.903 104.9 58.4 -61.2 -32.6 71.9 102.4 70.9 123 132 A D H >< S+ 0 0 48 -4,-2.3 3,-1.2 1,-0.3 -2,-0.2 0.969 96.0 61.4 -61.2 -44.8 70.6 99.0 69.9 124 133 A T T 3< S+ 0 0 114 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.634 105.0 51.1 -44.9 -25.7 71.2 100.1 66.3 125 134 A F T <4 S+ 0 0 30 -3,-2.0 -1,-0.3 -4,-0.3 -2,-0.2 0.720 89.2 93.0 -86.2 -32.6 74.9 100.4 67.4 126 135 A I << - 0 0 19 -3,-1.2 2,-0.5 -4,-1.1 3,-0.1 -0.367 53.8-163.7 -69.1 137.1 75.4 96.9 69.0 127 136 A D > - 0 0 64 1,-0.1 3,-2.8 -2,-0.1 4,-0.3 -0.756 2.1-171.0-120.7 92.8 76.7 94.2 67.0 128 137 A H G > S+ 0 0 32 -2,-0.5 3,-1.7 1,-0.3 -1,-0.1 0.798 80.3 71.3 -51.0 -24.1 76.0 91.0 68.9 129 138 A D G > S+ 0 0 99 1,-0.3 3,-1.8 2,-0.2 -1,-0.3 0.652 76.2 79.4 -67.7 -14.3 78.1 89.0 66.5 130 139 A R G X S+ 0 0 49 -3,-2.8 3,-2.0 1,-0.3 -1,-0.3 0.753 76.2 75.7 -67.4 -10.9 81.2 90.6 67.9 131 140 A D G X S+ 0 0 2 -3,-1.7 3,-0.6 -4,-0.3 -1,-0.3 0.697 81.5 70.0 -68.6 -14.5 80.8 88.1 70.7 132 141 A M G < S+ 0 0 24 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.336 85.8 66.3 -83.3 7.0 82.1 85.6 68.2 133 142 A T G < S+ 0 0 70 -3,-2.0 2,-0.2 -60,-0.1 -1,-0.2 0.376 76.2 105.2-107.9 4.1 85.7 87.2 68.4 134 143 A F < - 0 0 2 -3,-0.6 2,-0.2 -4,-0.2 -60,-0.1 -0.529 65.4-135.9 -79.8 144.3 86.4 86.2 72.0 135 144 A S >> - 0 0 1 484,-0.3 4,-2.0 483,-0.3 3,-0.6 -0.620 32.2 -97.5 -96.2 167.3 88.8 83.4 72.6 136 145 A Y H 3> S+ 0 0 7 -67,-1.9 4,-2.3 1,-0.3 5,-0.2 0.924 123.2 48.9 -53.7 -54.9 87.9 80.7 75.3 137 146 A A H 3> S+ 0 0 2 507,-0.5 4,-1.7 1,-0.2 -1,-0.3 0.863 110.5 56.5 -51.5 -32.7 89.9 82.1 78.2 138 147 A A H <> S+ 0 0 0 -3,-0.6 4,-2.3 2,-0.2 -2,-0.2 0.973 106.7 46.1 -63.8 -49.6 88.2 85.4 77.3 139 148 A V H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.878 111.0 53.4 -60.9 -37.2 84.7 83.9 77.7 140 149 A K H X S+ 0 0 28 -4,-2.3 4,-2.7 1,-0.2 5,-0.2 0.922 109.9 47.2 -71.1 -34.6 85.6 82.2 81.0 141 150 A Q H X>S+ 0 0 23 -4,-1.7 4,-1.7 -5,-0.2 5,-0.8 0.869 112.7 49.0 -70.5 -38.4 86.8 85.5 82.6 142 151 A L H X>S+ 0 0 2 -4,-2.3 5,-2.9 3,-0.2 4,-1.9 0.982 118.4 41.7 -59.5 -45.1 83.7 87.3 81.3 143 152 A E H <5S+ 0 0 30 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.892 120.6 38.5 -71.2 -45.7 81.5 84.6 82.8 144 153 A G H <5S+ 0 0 56 -4,-2.7 -1,-0.2 -5,-0.2 -3,-0.2 0.706 138.1 9.5 -80.7 -16.2 83.3 84.0 86.1 145 154 A K H <5S+ 0 0 94 -4,-1.7 -3,-0.2 -5,-0.2 -2,-0.2 0.631 126.3 36.5-135.4 -14.0 84.1 87.7 86.8 146 155 A Y T < S- 0 0 114 1,-0.1 3,-1.1 2,-0.1 -1,-0.3 -0.439 136.8-107.1 -59.1 72.3 69.4 81.9 92.2 153 162 A T T 3 S+ 0 0 115 -2,-5.3 -2,-0.1 -3,-0.4 -1,-0.1 0.275 102.6 35.0 -21.1 113.5 73.1 81.5 92.6 154 163 A G T 3 S+ 0 0 39 1,-0.3 -1,-0.3 0, 0.0 2,-0.2 -0.076 82.4 127.9 125.1 -22.3 74.6 80.5 89.2 155 164 A E < - 0 0 82 -3,-1.1 -5,-2.2 -6,-0.1 2,-0.4 -0.439 46.4-150.0 -69.9 133.3 72.3 82.5 86.8 156 165 A I B -A 149 0A 6 -73,-0.3 -7,-0.2 -7,-0.2 -8,-0.1 -0.882 11.1-172.9 -99.8 126.2 73.9 84.7 84.2 157 166 A Y + 0 0 24 -9,-3.2 2,-0.3 -2,-0.4 -8,-0.1 0.592 57.4 21.3 -98.7 -11.8 71.7 87.8 83.3 158 167 A E - 0 0 1 -10,-0.7 2,-0.3 -68,-0.0 -73,-0.1 -0.914 64.1-122.2-146.9 176.8 73.5 89.5 80.4 159 168 A S >> - 0 0 9 -2,-0.3 4,-1.6 -75,-0.1 3,-0.8 -0.813 38.5 -95.9-125.7 162.2 75.8 89.1 77.5 160 169 A A H 3> S+ 0 0 4 -2,-0.3 4,-2.3 1,-0.3 5,-0.2 0.795 117.6 53.7 -52.3 -35.9 79.1 90.9 76.6 161 170 A Q H 3> S+ 0 0 1 1,-0.2 4,-2.3 2,-0.2 5,-0.3 0.925 108.4 49.6 -74.3 -30.8 77.7 93.4 74.2 162 171 A F H <> S+ 0 0 0 -3,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.915 109.3 54.3 -68.3 -35.7 75.1 94.7 76.8 163 172 A L H X S+ 0 0 0 -4,-1.6 4,-1.9 1,-0.2 -2,-0.2 0.987 113.7 42.9 -50.9 -55.8 78.0 95.0 79.3 164 173 A Y H X S+ 0 0 10 -4,-2.3 4,-1.5 2,-0.2 -2,-0.2 0.819 115.6 43.5 -68.2 -38.1 79.9 97.2 76.8 165 174 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.2 -1,-0.2 0.905 115.9 51.7 -74.1 -29.6 77.1 99.5 75.5 166 175 A L H X S+ 0 0 0 -4,-1.9 4,-1.9 -5,-0.3 -2,-0.2 0.799 106.6 49.3 -83.3 -25.1 75.9 99.9 79.0 167 176 A V H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.2 0.919 113.3 48.9 -77.0 -34.7 79.2 100.9 80.6 168 177 A A H X S+ 0 0 0 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.970 111.4 49.8 -60.3 -54.6 79.7 103.5 77.7 169 178 A A H X S+ 0 0 0 -4,-2.8 4,-0.7 1,-0.2 3,-0.2 0.964 112.3 47.6 -51.8 -51.1 76.1 104.9 78.3 170 179 A C H >< S+ 0 0 5 -4,-1.9 3,-0.9 1,-0.2 4,-0.3 0.959 113.8 46.5 -61.8 -42.7 76.8 105.2 82.1 171 180 A L H 3< S+ 0 0 5 -4,-2.3 3,-0.2 1,-0.2 -1,-0.2 0.838 120.5 38.1 -67.0 -28.5 80.2 107.1 81.6 172 181 A F H >< S+ 0 0 0 -4,-2.0 3,-1.3 -5,-0.2 -1,-0.2 0.361 84.8 108.7-104.8 11.0 78.9 109.5 79.0 173 182 A S T << S+ 0 0 9 -3,-0.9 -1,-0.1 -4,-0.7 -2,-0.1 0.825 73.3 55.5 -55.3 -36.8 75.4 110.0 80.6 174 183 A N T 3 S+ 0 0 139 -4,-0.3 -1,-0.2 -3,-0.2 -2,-0.1 0.160 88.3 115.4 -87.4 24.3 76.0 113.6 81.8 175 184 A Y S < S- 0 0 24 -3,-1.3 6,-0.1 1,-0.1 -3,-0.0 -0.657 77.5 -87.8 -89.8 142.5 76.9 114.7 78.3 176 185 A P >> - 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0 0 75 -5,-2.6 44,-1.9 -6,-0.3 45,-0.4 -0.010 50.8 -85.8 -91.0-172.5 131.4 104.1 101.8 343 352 A D E - L 0 385D 50 42,-0.2 2,-0.5 43,-0.1 42,-0.2 -0.757 24.5-146.2 -96.9 142.2 129.1 104.1 104.9 344 353 A I E - L 0 384D 0 40,-3.6 40,-2.6 -2,-0.3 2,-0.5 -0.946 19.6-140.8-104.0 129.6 125.4 104.6 104.9 345 354 A T E - L 0 383D 0 -2,-0.5 2,-0.5 38,-0.2 38,-0.2 -0.811 8.2-142.5-100.6 130.6 124.2 106.4 108.1 346 355 A L E + L 0 382D 0 36,-3.0 36,-1.4 -2,-0.5 2,-0.3 -0.744 23.1 175.3 -90.2 119.5 121.0 105.4 109.7 347 356 A F E -kL 301 381D 0 -47,-1.8 -45,-2.1 -2,-0.5 -44,-0.2 -0.886 32.8-122.7-120.2 151.6 118.7 108.1 111.2 348 357 A S >> - 0 0 5 32,-0.6 4,-1.1 -2,-0.3 3,-1.1 -0.861 30.7-131.9 -85.8 125.5 115.2 108.0 112.8 349 358 A P T 34 S+ 0 0 12 0, 0.0 3,-0.5 0, 0.0 7,-0.2 0.899 96.9 49.1 -52.5 -53.3 112.9 110.4 110.8 350 359 A S T 34 S+ 0 0 70 -99,-0.5 -97,-0.1 1,-0.2 -98,-0.1 0.650 112.5 56.4 -70.3 -1.9 111.0 112.7 113.5 351 360 A D T <4 S+ 0 0 63 -3,-1.1 -1,-0.2 1,-0.1 -98,-0.0 0.817 93.1 62.8 -85.4 -54.5 114.4 113.2 115.0 352 361 A V S >< S- 0 0 1 -4,-1.1 3,-1.9 -3,-0.5 4,-0.3 -0.485 86.8-139.1 -86.7 82.3 116.6 114.7 112.0 353 362 A P T 3 S+ 0 0 110 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.383 77.7 7.8 -41.3 -51.0 114.7 118.0 111.3 354 363 A G T 3> S+ 0 0 29 1,-0.1 4,-1.7 2,-0.1 15,-0.1 0.493 99.8 96.0-109.1 4.7 114.3 118.6 107.5 355 364 A L H <> S+ 0 0 0 -3,-1.9 4,-2.0 1,-0.2 5,-0.2 0.860 75.7 56.2 -60.9 -48.7 115.7 115.4 105.9 356 365 A Y H > S+ 0 0 16 -4,-0.3 4,-0.9 -7,-0.2 3,-0.3 0.949 112.9 43.0 -55.7 -46.7 112.6 113.3 105.2 357 366 A D H >> S+ 0 0 91 1,-0.2 4,-3.0 2,-0.2 3,-0.7 0.945 113.7 53.9 -63.1 -42.7 111.0 116.1 103.1 358 367 A A H 3X S+ 0 0 5 -4,-1.7 4,-1.9 1,-0.2 8,-0.5 0.751 96.5 65.0 -54.8 -38.7 114.4 116.7 101.5 359 368 A F H 3< S+ 0 0 0 -4,-2.0 -1,-0.2 -3,-0.3 -2,-0.2 0.900 117.2 27.3 -57.0 -40.7 114.8 113.0 100.4 360 369 A F H << S+ 0 0 0 -4,-0.9 -2,-0.2 -3,-0.7 3,-0.2 0.902 130.3 35.3 -90.3 -47.5 111.8 113.4 98.1 361 370 A A H < S+ 0 0 33 -4,-3.0 2,-0.2 1,-0.2 -3,-0.2 0.639 121.3 14.8 -92.9 -9.8 111.8 117.1 97.2 362 371 A D X - 0 0 84 -4,-1.9 4,-2.8 -5,-0.2 -1,-0.2 -0.659 50.0-166.2-167.6 106.8 115.3 118.4 96.9 363 372 A Q H > S+ 0 0 34 2,-0.2 4,-2.1 -2,-0.2 5,-0.1 0.739 89.7 53.7 -77.7 -19.4 118.4 116.4 96.7 364 373 A E H > S+ 0 0 126 2,-0.2 4,-2.9 3,-0.2 -1,-0.2 0.929 111.3 47.6 -78.0 -37.8 121.0 119.1 97.3 365 374 A E H > S+ 0 0 73 2,-0.2 4,-2.3 1,-0.2 5,-0.5 0.951 110.1 54.0 -61.1 -47.2 119.1 119.9 100.5 366 375 A F H X S+ 0 0 1 -4,-2.8 4,-1.8 -8,-0.5 -2,-0.2 0.905 112.2 44.2 -53.6 -43.7 119.1 116.1 101.2 367 376 A E H X S+ 0 0 88 -4,-2.1 4,-2.2 2,-0.2 5,-0.4 0.963 115.4 48.2 -62.8 -48.3 123.0 116.0 100.7 368 377 A R H >X S+ 0 0 121 -4,-2.9 4,-2.0 1,-0.2 3,-0.8 0.989 118.5 37.6 -57.1 -68.7 123.4 119.2 102.9 369 378 A L H 3X S+ 0 0 10 -4,-2.3 4,-2.7 1,-0.2 5,-0.3 0.864 116.1 57.0 -57.7 -30.6 121.2 118.1 105.8 370 379 A Y H 3X S+ 0 0 0 -4,-1.8 4,-1.7 -5,-0.5 -1,-0.2 0.867 111.4 37.8 -72.8 -36.6 122.5 114.4 105.5 371 380 A T H X S+ 0 0 81 -4,-2.0 4,-2.0 -5,-0.4 3,-1.7 0.990 113.6 42.0 -53.5 -60.9 125.6 117.8 108.5 373 382 A Y H 3< S+ 0 0 12 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.837 105.0 62.6 -64.9 -32.2 123.5 115.3 110.6 374 383 A E H 3< S+ 0 0 23 -4,-1.7 -1,-0.3 -5,-0.3 -2,-0.2 0.755 114.9 38.9 -59.3 -19.9 125.9 112.3 110.0 375 384 A K H << S+ 0 0 145 -3,-1.7 2,-1.4 -4,-0.8 -2,-0.2 0.887 84.6 102.7 -90.0 -51.3 128.3 114.7 111.9 376 385 A D >< - 0 0 62 -4,-2.0 3,-2.1 1,-0.2 -1,-0.1 -0.108 60.0-156.0 -44.7 75.9 126.1 116.3 114.6 377 386 A D T 3 S+ 0 0 158 -2,-1.4 -1,-0.2 1,-0.3 4,-0.1 0.575 82.2 66.8 -24.7 -31.6 127.3 114.3 117.6 378 387 A S T 3 S+ 0 0 104 2,-0.1 -1,-0.3 0, 0.0 2,-0.2 0.694 83.1 86.7 -78.0 -7.7 124.1 114.9 119.6 379 388 A I S < S- 0 0 26 -3,-2.1 2,-0.6 -6,-0.2 -27,-0.0 -0.389 83.1-111.8 -95.1 141.1 121.7 112.9 117.3 380 389 A R + 0 0 86 -2,-0.2 -32,-0.6 -32,-0.1 2,-0.3 -0.724 55.7 149.9 -70.9 116.2 120.9 109.1 117.6 381 390 A K E -L 347 0D 52 -2,-0.6 2,-0.3 -34,-0.1 -34,-0.2 -0.911 31.9-152.4-141.1 170.4 122.3 107.5 114.4 382 391 A Q E -L 346 0D 79 -36,-1.4 -36,-3.0 -2,-0.3 2,-0.5 -0.995 15.6-133.2-142.5 142.9 123.8 104.1 113.4 383 392 A R E +L 345 0D 131 -2,-0.3 2,-0.4 -38,-0.2 -38,-0.2 -0.835 24.4 172.8-109.5 132.6 126.5 103.2 110.7 384 393 A V E -L 344 0D 16 -40,-2.6 -40,-3.6 -2,-0.5 2,-0.5 -0.978 38.1-106.7-129.5 143.5 126.1 100.4 108.2 385 394 A K E >> -L 343 0D 92 -2,-0.4 4,-2.5 -42,-0.2 3,-1.4 -0.589 22.4-135.9 -69.5 123.8 128.3 99.6 105.2 386 395 A A H 3> S+ 0 0 0 -44,-1.9 4,-2.9 -2,-0.5 5,-0.2 0.865 107.3 53.5 -47.3 -38.1 126.5 100.5 101.9 387 396 A V H 3> S+ 0 0 33 -45,-0.4 4,-1.8 1,-0.2 -1,-0.3 0.841 112.2 44.8 -61.3 -39.8 127.7 97.2 100.4 388 397 A E H <> S+ 0 0 95 -3,-1.4 4,-1.5 2,-0.2 -2,-0.2 0.849 113.6 47.1 -76.7 -41.9 126.2 95.4 103.4 389 398 A L H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.926 115.2 46.7 -67.5 -43.7 122.9 97.2 103.4 390 399 A F H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.3 -2,-0.2 0.883 111.3 49.1 -69.5 -38.5 122.4 96.8 99.6 391 400 A S H X S+ 0 0 23 -4,-1.8 4,-2.1 -5,-0.2 -1,-0.2 0.869 109.7 53.2 -69.1 -27.4 123.3 93.1 99.5 392 401 A L H X S+ 0 0 32 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.926 110.6 47.8 -68.4 -37.5 120.8 92.4 102.4 393 402 A M H X S+ 0 0 0 -4,-1.8 4,-2.8 1,-0.2 -2,-0.2 0.929 115.7 44.1 -64.0 -46.6 118.1 94.2 100.5 394 403 A M H X S+ 0 0 4 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.786 107.1 57.3 -75.8 -23.5 118.9 92.3 97.3 395 404 A Q H X S+ 0 0 104 -4,-2.1 4,-3.1 2,-0.2 5,-0.2 0.986 115.5 40.6 -60.8 -47.4 119.2 88.9 99.1 396 405 A E H X S+ 0 0 10 -4,-1.8 4,-2.0 2,-0.2 5,-0.4 0.861 114.0 50.3 -71.6 -44.1 115.6 89.5 100.3 397 406 A R H X S+ 0 0 4 -4,-2.8 4,-3.4 3,-0.2 326,-0.2 0.984 115.6 45.4 -54.6 -52.0 114.4 90.9 97.0 398 407 A A H < S+ 0 0 27 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.948 114.3 46.9 -64.2 -45.8 115.9 87.8 95.3 399 408 A S H < S+ 0 0 93 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.847 131.0 20.4 -56.6 -42.2 114.5 85.2 97.9 400 409 A T H < S- 0 0 42 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.681 84.8-143.3-102.1 -18.9 111.0 86.6 98.0 401 410 A G S < S+ 0 0 7 -4,-3.4 322,-1.0 -5,-0.4 -4,-0.1 0.410 81.7 96.0 64.3 -1.0 110.9 88.5 94.7 402 411 A R + 0 0 91 -6,-0.4 -76,-1.6 -5,-0.2 2,-0.5 0.094 45.9 92.4-119.1 24.5 108.8 90.9 96.8 403 412 A I E -i 326 0C 1 -78,-0.2 2,-0.2 -6,-0.1 -76,-0.2 -0.978 64.3-164.5-113.8 117.6 111.1 93.7 98.2 404 413 A Y E -i 327 0C 1 -78,-2.8 -76,-2.5 -2,-0.5 2,-0.4 -0.611 13.6-127.2-108.5 169.7 110.8 96.5 95.6 405 414 A I E -iJ 328 720C 1 315,-1.6 315,-2.2 -78,-0.2 2,-0.5 -0.902 15.6-174.5-123.6 135.2 112.7 99.6 94.8 406 415 A Q E -iJ 329 719C 1 -78,-2.2 -76,-2.3 -2,-0.4 2,-1.1 -0.965 15.8-150.9-130.4 118.4 111.5 103.1 94.4 407 416 A N E > -i 330 0C 1 311,-3.1 4,-1.8 -2,-0.5 -76,-0.2 -0.765 14.0-172.7 -85.6 99.6 113.9 105.8 93.3 408 417 A V H > S+ 0 0 0 -78,-1.4 4,-0.9 -2,-1.1 16,-0.2 0.834 80.0 56.0 -66.6 -36.9 112.5 108.9 95.0 409 418 A D H > S+ 0 0 6 -79,-0.7 4,-2.8 1,-0.2 3,-0.5 0.942 111.3 45.9 -56.8 -41.1 114.8 111.5 93.3 410 419 A H H > S+ 0 0 13 1,-0.2 4,-1.1 2,-0.2 -2,-0.2 0.873 107.6 56.0 -70.2 -42.6 113.6 110.2 89.8 411 420 A C H < S+ 0 0 1 -4,-1.8 -1,-0.2 307,-0.2 -2,-0.2 0.709 119.6 33.8 -61.8 -21.8 109.9 110.2 90.9 412 421 A N H < S+ 0 0 7 -4,-0.9 3,-0.4 -3,-0.5 -2,-0.2 0.700 115.3 48.9-107.8 -27.8 110.3 113.9 91.7 413 422 A T H < S+ 0 0 89 -4,-2.8 2,-0.3 1,-0.3 -3,-0.2 0.717 121.8 38.4 -83.7 -17.3 112.8 115.4 89.2 414 423 A H S < S+ 0 0 18 -4,-1.1 -1,-0.3 -5,-0.3 161,-0.1 -0.625 96.6 114.4-127.6 82.0 111.0 113.9 86.3 415 424 A S S S- 0 0 18 -3,-0.4 148,-0.2 -2,-0.3 267,-0.1 -0.943 74.3-122.3-140.2 155.6 107.3 114.2 87.4 416 425 A P S S+ 0 0 3 0, 0.0 147,-1.3 0, 0.0 148,-0.6 0.456 96.6 82.1 -71.3 0.9 104.0 116.1 86.4 417 426 A F B S-M 562 0E 1 145,-0.3 145,-0.2 146,-0.1 -2,-0.2 -0.880 82.0-128.8-119.7 138.8 104.3 117.4 89.9 418 427 A D >> - 0 0 30 143,-2.3 4,-2.5 -2,-0.4 3,-1.8 -0.695 20.9-148.1 -77.5 114.2 106.2 120.2 91.6 419 428 A P T 34 S+ 0 0 30 0, 0.0 -1,-0.1 0, 0.0 -58,-0.1 0.480 92.4 58.3 -68.5 -8.6 108.0 118.6 94.6 420 429 A A T 34 S+ 0 0 87 2,-0.2 -59,-0.1 141,-0.1 -2,-0.0 0.669 119.7 26.3 -91.6 -25.9 107.8 121.7 96.7 421 430 A I T <4 S+ 0 0 79 -3,-1.8 140,-0.1 140,-0.2 141,-0.1 0.782 145.5 5.4-100.5 -55.8 104.0 122.0 96.6 422 431 A A S < S- 0 0 0 -4,-2.5 -2,-0.2 139,-0.3 -1,-0.1 -0.583 73.3-173.1-136.4 76.7 103.2 118.3 96.1 423 432 A P - 0 0 17 0, 0.0 2,-0.7 0, 0.0 14,-0.4 -0.215 29.1-120.5 -63.6 158.6 106.1 115.8 96.2 424 433 A V + 0 0 0 -16,-0.2 -13,-0.1 -64,-0.2 3,-0.1 -0.908 37.1 171.2 -98.3 117.2 105.5 112.1 95.3 425 434 A R + 0 0 23 -2,-0.7 2,-0.3 10,-0.4 -1,-0.1 0.445 55.4 4.5-107.8 -0.5 106.5 110.2 98.4 426 435 A Q - 0 0 0 9,-0.3 9,-0.4 -178,-0.1 2,-0.2 -0.985 58.7-126.0-162.0-180.0 105.4 106.7 97.6 427 436 A S - 0 0 0 -2,-0.3 7,-0.1 7,-0.1 -131,-0.1 -0.537 27.4-108.1-127.5-166.2 103.9 104.2 95.1 428 437 A N > - 0 0 0 5,-0.3 3,-0.9 -2,-0.2 -1,-0.1 -0.246 51.9 -68.2-110.1-157.9 100.9 101.7 95.1 429 438 A L T 3 S+ 0 0 34 1,-0.2 -136,-0.1 -185,-0.2 -184,-0.1 0.973 130.9 32.5 -62.0 -51.2 100.6 98.0 95.2 430 439 A C T 3 S- 0 0 27 182,-0.1 -1,-0.2 291,-0.1 291,-0.1 0.097 108.2-116.8 -95.1 22.3 102.2 97.2 91.7 431 440 A L S < S+ 0 0 0 -3,-0.9 253,-0.3 1,-0.1 255,-0.2 0.633 86.9 101.5 47.9 33.5 104.6 100.1 91.7 432 441 A E + 0 0 4 251,-0.2 251,-2.5 253,-0.1 2,-0.3 0.547 59.2 82.5-109.5 -13.9 103.3 102.0 88.6 433 442 A I + 0 0 1 249,-0.2 -5,-0.3 176,-0.1 2,-0.3 -0.724 48.2 177.1 -98.3 135.0 101.3 104.9 90.3 434 443 A A + 0 0 4 -2,-0.3 -7,-0.1 -7,-0.1 -10,-0.1 -0.671 23.8 138.3-143.4 92.3 103.2 108.0 91.6 435 444 A L - 0 0 3 -9,-0.4 -10,-0.4 -2,-0.3 -9,-0.3 -0.915 51.5 -88.1-132.4 155.7 100.9 110.7 93.0 436 445 A P + 0 0 2 0, 0.0 2,-0.3 0, 0.0 -12,-0.1 -0.229 40.6 177.7 -68.7 156.8 100.9 113.1 96.1 437 446 A T - 0 0 3 -14,-0.4 13,-0.2 13,-0.1 -218,-0.1 -0.957 15.9-156.5-150.1 156.1 99.5 112.2 99.4 438 447 A K B -N 449 0F 66 11,-2.5 11,-1.3 -2,-0.3 -218,-0.4 -0.994 33.1-103.4-142.0 139.0 99.2 113.9 102.9 439 448 A P - 0 0 26 0, 0.0 2,-0.3 0, 0.0 -218,-0.2 -0.227 32.9-130.6 -61.1 150.0 98.8 112.1 106.3 440 449 A L - 0 0 2 -220,-0.6 -218,-0.4 -213,-0.1 -209,-0.3 -0.829 13.3-163.7-105.4 142.0 95.4 112.0 107.9 441 450 A N S S+ 0 0 100 -2,-0.3 2,-0.2 1,-0.3 -1,-0.1 0.415 83.3 8.0 -99.4 -10.0 94.8 112.9 111.5 442 451 A D S > S- 0 0 89 -215,-0.1 3,-2.4 -213,-0.1 -1,-0.3 -0.870 85.0-103.3-161.8 143.8 91.4 111.3 111.6 443 452 A V T 3 S+ 0 0 31 1,-0.3 50,-0.3 -2,-0.2 -216,-0.0 0.764 125.3 41.7 -43.8 -30.0 89.5 109.0 109.1 444 453 A N T 3 S+ 0 0 83 47,-0.1 2,-0.4 48,-0.1 -1,-0.3 0.329 78.3 137.6-108.5 12.5 87.4 112.0 108.3 445 454 A D X - 0 0 27 -3,-2.4 3,-1.0 1,-0.2 48,-0.4 -0.380 40.0-159.1 -55.8 114.2 90.1 114.7 108.1 446 455 A E T 3 S+ 0 0 125 -2,-0.4 -1,-0.2 1,-0.2 -3,-0.0 0.370 85.1 63.8 -84.8 12.4 89.3 116.8 105.1 447 456 A N T 3 S+ 0 0 123 2,-0.0 2,-0.3 -8,-0.0 -1,-0.2 0.229 84.1 90.9-113.7 7.1 93.0 118.1 105.0 448 457 A G < - 0 0 0 -3,-1.0 2,-0.4 -6,-0.1 48,-0.2 -0.686 66.9-146.7 -92.6 159.2 94.5 114.8 104.3 449 458 A E B -N 438 0F 2 -11,-1.3 -11,-2.5 -2,-0.3 2,-0.4 -0.986 13.6-176.1-134.7 128.3 95.0 113.6 100.7 450 459 A I - 0 0 1 43,-2.0 47,-0.4 -2,-0.4 2,-0.4 -0.978 21.9-138.9-118.9 130.0 94.7 110.0 99.6 451 460 A A E -F 218 0C 4 -233,-1.5 -233,-2.1 -2,-0.4 2,-0.4 -0.764 15.0-149.5 -95.5 139.7 95.5 109.3 96.0 452 461 A L E -F 217 0C 3 -2,-0.4 2,-1.1 -235,-0.2 -235,-0.2 -0.885 15.1-124.3-113.4 134.6 93.4 106.9 93.8 453 462 A a + 0 0 7 -237,-3.0 2,-0.9 -2,-0.4 -238,-0.8 -0.536 27.3 177.7 -64.2 90.3 94.3 104.6 90.8 454 463 A T E + c 0 504B 8 -2,-1.1 51,-2.0 49,-0.6 2,-0.2 -0.854 27.5 177.8 -91.3 107.1 91.9 105.5 87.9 455 464 A L E + c 0 505B 17 -2,-0.9 2,-0.3 49,-0.2 51,-0.2 -0.683 23.5 145.6-117.4 158.4 93.3 103.1 85.3 456 465 A S E - c 0 506B 6 49,-2.0 51,-2.4 -2,-0.2 2,-0.3 -0.955 26.0-135.6-169.1 174.8 92.8 101.9 81.7 457 466 A A E -Bc 197 507B 7 -260,-2.5 -260,-2.8 -2,-0.3 2,-0.4 -0.992 9.0-129.0-148.0 149.0 94.8 100.7 78.8 458 467 A F E -Bc 196 508B 0 49,-3.2 51,-3.2 -2,-0.3 2,-1.2 -0.698 25.4-133.9 -84.1 135.8 95.5 100.9 75.0 459 468 A N E > - c 0 509B 6 -264,-2.9 3,-2.4 -2,-0.4 4,-0.4 -0.663 17.7-169.9 -93.9 99.3 95.7 97.7 73.1 460 469 A L T 3 S+ 0 0 0 49,-1.8 3,-0.2 -2,-1.2 -1,-0.2 0.573 82.0 57.3 -64.8 -8.6 98.8 98.1 70.9 461 470 A G T 3 S+ 0 0 13 1,-0.2 -1,-0.3 48,-0.1 49,-0.1 0.597 101.8 55.9 -96.3 -9.9 98.1 95.0 68.8 462 471 A A S < S+ 0 0 27 -3,-2.4 2,-0.4 -268,-0.2 -2,-0.2 0.359 90.7 84.8-101.8 4.8 94.6 96.2 67.7 463 472 A I - 0 0 10 -4,-0.4 3,-0.1 -3,-0.2 -5,-0.0 -0.863 56.4-164.8-104.8 132.1 95.7 99.5 66.2 464 473 A N S S+ 0 0 139 -2,-0.4 2,-0.3 1,-0.2 -1,-0.2 0.892 76.6 21.2 -85.0 -36.9 96.9 99.6 62.7 465 474 A N S > S- 0 0 110 1,-0.1 3,-1.4 0, 0.0 4,-0.3 -0.913 74.8-121.8-126.5 157.6 98.6 103.1 62.8 466 475 A L G > S+ 0 0 28 -2,-0.3 3,-0.7 1,-0.3 -1,-0.1 0.690 109.0 63.9 -67.0 -14.1 99.9 105.3 65.7 467 476 A D G > S+ 0 0 85 1,-0.2 3,-1.7 2,-0.2 4,-0.5 0.604 80.3 80.5 -85.5 -6.8 97.6 108.2 64.8 468 477 A E G <> S+ 0 0 46 -3,-1.4 4,-1.7 1,-0.3 3,-0.3 0.744 80.8 69.8 -65.0 -25.2 94.6 105.9 65.5 469 478 A L H <> S+ 0 0 0 -3,-0.7 4,-2.5 -4,-0.3 -1,-0.3 0.657 76.1 78.4 -65.3 -16.6 95.4 107.0 69.1 470 479 A D H <> S+ 0 0 61 -3,-1.7 4,-1.0 2,-0.2 -1,-0.2 0.984 109.6 30.5 -52.3 -48.9 94.2 110.7 68.5 471 480 A E H > S+ 0 0 73 -4,-0.5 4,-2.6 -3,-0.3 5,-0.2 0.880 117.3 54.0 -80.3 -47.6 90.7 109.3 68.9 472 481 A L H X S+ 0 0 9 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.871 110.2 50.8 -59.1 -33.1 91.4 106.4 71.3 473 482 A A H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 5,-0.3 0.857 108.5 51.4 -67.1 -33.4 93.0 109.0 73.6 474 483 A I H X S+ 0 0 22 -4,-1.0 4,-2.2 -5,-0.2 5,-0.2 0.975 114.3 43.7 -67.1 -52.8 90.0 111.3 73.4 475 484 A L H X S+ 0 0 2 -4,-2.6 4,-2.2 2,-0.2 5,-0.3 0.934 114.3 47.0 -60.1 -48.9 87.7 108.4 74.3 476 485 A A H X S+ 0 0 2 -4,-2.5 4,-2.3 -5,-0.2 5,-0.3 0.974 115.1 47.2 -63.7 -44.3 89.9 106.9 77.2 477 486 A V H X S+ 0 0 0 -4,-2.2 4,-2.3 1,-0.2 5,-0.3 0.884 114.5 46.7 -64.6 -36.3 90.4 110.4 78.8 478 487 A R H X S+ 0 0 7 -4,-2.2 4,-2.0 -5,-0.3 -1,-0.2 0.926 113.8 45.7 -75.2 -35.0 86.8 111.4 78.5 479 488 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.2 -2,-0.2 0.962 118.1 43.3 -70.6 -48.7 85.4 108.1 79.9 480 489 A L H X S+ 0 0 1 -4,-2.3 4,-1.7 -5,-0.3 -1,-0.2 0.843 112.8 50.7 -63.7 -44.4 87.8 108.0 82.7 481 490 A D H X S+ 0 0 2 -4,-2.3 4,-0.7 -5,-0.3 -2,-0.2 0.932 112.7 48.6 -60.3 -40.4 87.5 111.8 83.6 482 491 A A H >X S+ 0 0 21 -4,-2.0 3,-1.9 -5,-0.3 4,-1.4 0.976 105.9 57.5 -63.6 -48.2 83.6 111.3 83.6 483 492 A L H >X S+ 0 0 2 -4,-2.6 4,-1.9 1,-0.3 3,-0.9 0.904 93.7 67.5 -51.5 -40.1 83.9 108.2 85.9 484 493 A L H 3< S+ 0 0 1 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.837 107.8 38.5 -52.6 -29.2 85.8 110.3 88.5 485 494 A D H << S+ 0 0 90 -3,-1.9 -1,-0.3 -4,-0.7 -2,-0.2 0.712 112.4 58.3 -91.0 -19.1 82.5 112.2 89.1 486 495 A Y H << S+ 0 0 28 -4,-1.4 -2,-0.2 -3,-0.9 -3,-0.2 0.837 95.6 78.2 -78.4 -30.7 80.3 109.1 88.8 487 496 A Q S < S- 0 0 12 -4,-1.9 2,-0.3 1,-0.1 -275,-0.2 -0.295 77.0-111.2 -90.9 165.4 81.9 107.2 91.6 488 497 A D - 0 0 93 -277,-3.2 -275,-0.3 -2,-0.1 -274,-0.2 -0.640 14.8-154.7 -89.1 148.4 81.8 107.2 95.4 489 498 A Y - 0 0 29 -2,-0.3 -277,-0.0 1,-0.1 4,-0.0 -0.952 6.2-172.8-119.4 112.8 84.5 108.2 97.8 490 499 A P S S+ 0 0 42 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.892 77.3 49.4 -72.5 -35.9 84.3 106.6 101.3 491 500 A I S >> S- 0 0 2 1,-0.1 3,-2.3 -257,-0.0 4,-1.3 -0.882 84.8-133.3-105.4 121.6 87.2 108.7 102.9 492 501 A P H 3> S+ 0 0 32 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.841 103.3 53.7 -42.9 -48.7 86.9 112.5 102.4 493 502 A A H 3> S+ 0 0 0 -48,-0.4 -43,-2.0 -50,-0.3 4,-1.7 0.653 101.2 59.1 -67.7 -15.2 90.7 112.9 101.3 494 503 A A H <> S+ 0 0 0 -3,-2.3 4,-2.2 -45,-0.2 3,-0.4 0.970 108.3 46.7 -74.2 -51.9 90.3 110.2 98.6 495 504 A K H X S+ 0 0 100 -4,-1.3 4,-2.8 1,-0.2 5,-0.3 0.838 112.1 51.9 -50.7 -40.3 87.6 112.5 97.2 496 505 A R H X S+ 0 0 76 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.855 109.3 46.8 -64.8 -42.1 90.0 115.5 97.6 497 506 A G H X S+ 0 0 2 -4,-1.7 4,-2.5 -3,-0.4 5,-0.3 0.981 118.0 43.9 -67.7 -44.4 92.9 114.0 95.8 498 507 A A H X S+ 0 0 2 -4,-2.2 4,-2.3 -48,-0.3 5,-0.2 0.964 119.1 39.9 -62.9 -57.6 90.6 112.8 92.9 499 508 A M H < S+ 0 0 41 -4,-2.8 -1,-0.2 1,-0.2 -3,-0.2 0.862 118.2 50.1 -64.7 -36.1 88.6 116.0 92.5 500 509 A G H < S+ 0 0 3 -4,-2.0 58,-2.8 -5,-0.3 -1,-0.2 0.905 128.8 15.8 -69.0 -42.9 91.7 118.2 93.0 501 510 A R H < S- 0 0 3 -4,-2.5 104,-2.5 -5,-0.2 105,-0.4 0.472 80.6-147.6-116.2 9.0 94.1 116.6 90.5 502 511 A R < - 0 0 10 -4,-2.3 2,-0.4 -5,-0.3 104,-0.2 0.835 31.2-169.2 20.5 53.3 91.7 114.5 88.4 503 512 A T - 0 0 7 -6,-0.2 -49,-0.6 -5,-0.2 104,-0.2 -0.590 11.4-172.6 -76.2 119.0 94.6 111.9 87.9 504 513 A L E -c 454 0B 0 102,-2.2 2,-0.3 -2,-0.4 -49,-0.2 -0.534 16.4-150.7-107.5 167.0 94.3 109.0 85.3 505 514 A G E +c 455 0B 0 -51,-2.0 -49,-2.0 -2,-0.2 2,-0.7 -0.634 21.4 172.8-140.6 77.6 96.6 105.9 84.6 506 515 A I E +cd 456 608B 1 101,-2.1 103,-0.6 -2,-0.3 -49,-0.3 -0.814 10.7 162.3 -97.7 118.6 96.5 104.8 81.0 507 516 A G E -c 457 0B 1 -51,-2.4 -49,-3.2 -2,-0.7 2,-0.4 -0.340 32.3 -94.9-111.8-153.1 98.9 102.2 80.0 508 517 A V E -c 458 0B 3 -51,-0.3 2,-0.3 103,-0.2 -49,-0.2 -0.928 20.1-163.7-136.0 135.1 99.4 99.7 77.3 509 518 A I E S+c 459 0B 1 -51,-3.2 -49,-1.8 -2,-0.4 115,-0.2 -0.778 70.9 30.2-107.7 172.9 98.5 96.0 76.6 510 519 A N > + 0 0 6 113,-2.1 4,-2.5 -2,-0.3 5,-0.2 0.632 63.6 142.4 61.5 37.7 100.0 93.7 73.9 511 520 A F H > S+ 0 0 0 114,-1.8 4,-3.1 112,-0.2 5,-0.3 0.930 70.0 56.3 -77.4 -31.7 103.6 95.2 73.6 512 521 A A H > S+ 0 0 4 113,-0.4 4,-2.6 115,-0.3 -1,-0.2 0.932 113.4 42.0 -64.6 -39.0 105.3 91.9 73.1 513 522 A Y H > S+ 0 0 31 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.920 111.3 54.4 -73.0 -45.0 103.0 91.2 70.1 514 523 A Y H X S+ 0 0 12 -4,-2.5 4,-0.5 2,-0.2 -2,-0.2 0.921 115.2 42.2 -51.3 -46.0 103.3 94.8 68.8 515 524 A L H ><>S+ 0 0 1 -4,-3.1 3,-1.7 -5,-0.2 5,-1.6 0.980 110.6 54.4 -70.0 -48.4 107.1 94.3 68.8 516 525 A A H ><5S+ 0 0 5 -4,-2.6 3,-1.2 1,-0.3 -2,-0.2 0.889 109.3 48.9 -57.4 -36.5 107.1 90.7 67.4 517 526 A K H 3<5S+ 0 0 80 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.644 110.9 50.3 -80.9 -4.9 105.0 91.9 64.4 518 527 A H T <<5S- 0 0 90 -3,-1.7 -1,-0.3 -4,-0.5 -2,-0.2 0.266 116.4-115.8-102.0 7.8 107.4 94.7 63.8 519 528 A G T < 5S+ 0 0 53 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.553 72.7 128.5 76.1 4.6 110.4 92.4 63.9 520 529 A K < - 0 0 78 -5,-1.6 2,-0.3 -6,-0.2 -1,-0.2 -0.384 42.4-151.8 -88.4 174.6 111.9 93.9 67.0 521 530 A R - 0 0 68 1,-0.1 6,-0.6 -2,-0.1 4,-0.3 -0.879 20.9-123.7-136.3 163.4 113.0 92.0 70.2 522 531 A Y S S+ 0 0 6 -2,-0.3 3,-0.4 1,-0.1 150,-0.2 0.936 105.1 40.3 -75.0 -44.8 113.3 92.9 74.0 523 532 A S S S+ 0 0 33 1,-0.2 145,-0.2 145,-0.2 -1,-0.1 0.584 101.9 69.2 -82.6 -15.7 117.1 92.0 74.5 524 533 A D S S- 0 0 109 144,-0.1 -1,-0.2 143,-0.1 -2,-0.1 0.752 96.0-118.4 -60.9 -44.8 118.7 93.3 71.3 525 534 A G S > S+ 0 0 30 -3,-0.4 3,-1.2 -4,-0.3 4,-0.4 0.175 84.7 117.7 93.4 -3.9 118.5 97.0 71.5 526 535 A S T 3 + 0 0 38 1,-0.3 4,-0.4 2,-0.1 3,-0.2 0.786 68.4 47.2 -73.1 -23.7 116.3 96.6 68.3 527 536 A A T 3> S+ 0 0 0 -6,-0.6 4,-2.8 1,-0.1 5,-0.3 0.536 83.0 104.1 -93.2 -1.0 113.0 98.0 69.6 528 537 A N H <> S+ 0 0 11 -3,-1.2 4,-2.1 1,-0.2 -1,-0.1 0.914 87.6 33.0 -52.3 -54.1 114.7 101.1 71.1 529 538 A N H > S+ 0 0 51 -4,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.909 116.2 55.7 -76.5 -31.6 113.7 103.6 68.5 530 539 A L H > S+ 0 0 17 -4,-0.4 4,-1.8 2,-0.2 -2,-0.2 0.907 110.9 49.1 -57.7 -33.5 110.3 101.9 67.6 531 540 A T H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 5,-0.3 0.938 105.0 55.8 -74.6 -43.1 109.6 102.3 71.4 532 541 A H H X S+ 0 0 6 -4,-2.1 4,-1.2 -5,-0.3 -1,-0.2 0.933 113.0 42.0 -55.4 -43.8 110.6 105.9 71.5 533 542 A K H X S+ 0 0 67 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.806 113.2 52.7 -78.6 -22.8 108.0 106.7 68.7 534 543 A T H X S+ 0 0 0 -4,-1.8 4,-2.0 -5,-0.2 3,-0.2 0.981 114.1 40.7 -68.3 -56.9 105.3 104.5 70.2 535 544 A F H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 5,-0.2 0.747 111.0 56.8 -66.9 -23.0 105.4 106.1 73.6 536 545 A E H X S+ 0 0 0 -4,-1.2 4,-3.0 -5,-0.3 -1,-0.2 0.942 108.2 49.1 -69.0 -43.8 105.8 109.7 72.3 537 546 A A H X S+ 0 0 0 -4,-1.4 4,-2.1 -3,-0.2 5,-0.3 0.901 110.4 50.1 -60.9 -43.5 102.5 109.2 70.3 538 547 A I H X S+ 0 0 4 -4,-2.0 4,-1.6 2,-0.2 5,-0.2 0.931 116.4 40.4 -64.2 -42.7 100.7 107.9 73.4 539 548 A Q H X S+ 0 0 0 -4,-1.6 4,-3.1 -5,-0.2 5,-0.3 0.971 115.5 50.3 -75.2 -44.1 101.8 110.8 75.6 540 549 A Y H X S+ 0 0 35 -4,-3.0 4,-2.8 1,-0.2 -2,-0.2 0.965 116.0 42.2 -55.8 -58.0 101.3 113.5 72.9 541 550 A Y H X S+ 0 0 21 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.766 116.9 48.0 -59.8 -28.0 97.7 112.3 72.0 542 551 A L H X S+ 0 0 0 -4,-1.6 4,-2.3 -5,-0.3 5,-0.2 0.920 113.8 46.4 -76.3 -43.7 96.8 111.8 75.8 543 552 A L H X S+ 0 0 0 -4,-3.1 4,-2.6 -5,-0.2 -2,-0.2 0.964 113.9 50.4 -62.4 -40.7 98.2 115.3 76.6 544 553 A K H X S+ 0 0 52 -4,-2.8 4,-2.6 -5,-0.3 5,-0.3 0.974 111.4 47.6 -62.8 -52.6 96.3 116.7 73.5 545 554 A A H X S+ 0 0 1 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.865 113.1 47.1 -60.6 -34.3 93.0 115.0 74.6 546 555 A S H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 57,-1.0 0.892 110.6 53.0 -75.8 -35.4 93.3 116.2 78.1 547 556 A N H X S+ 0 0 8 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.965 109.5 48.2 -60.6 -49.3 94.2 119.7 76.9 548 557 A E H X S+ 0 0 70 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.878 109.2 53.6 -60.7 -37.4 91.0 119.8 74.7 549 558 A L H X>S+ 0 0 0 -4,-1.9 4,-3.0 -5,-0.3 5,-0.5 0.922 107.7 52.2 -62.5 -40.2 88.9 118.6 77.7 550 559 A A H X5S+ 0 0 4 -4,-2.4 4,-2.1 51,-0.2 -2,-0.2 0.929 105.6 51.5 -65.3 -41.1 90.4 121.5 79.7 551 560 A K H <5S+ 0 0 118 -4,-2.2 -2,-0.2 50,-0.2 -1,-0.2 0.951 119.4 42.0 -54.2 -39.9 89.4 124.1 77.0 552 561 A E H <5S+ 0 0 108 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.818 135.0 7.3 -73.4 -48.1 85.9 122.5 77.2 553 562 A Q H <5S- 0 0 81 -4,-3.0 -3,-0.2 1,-0.2 -2,-0.2 0.411 110.1 -89.1-124.3 0.9 85.3 121.9 80.9 554 563 A G << - 0 0 32 -4,-2.1 -1,-0.2 -5,-0.5 -3,-0.1 -0.003 42.3 -78.6 102.0 135.8 88.1 123.6 82.8 555 564 A A - 0 0 40 -5,-0.2 48,-0.3 1,-0.1 46,-0.1 -0.299 65.3 -81.9 -58.7 154.4 91.5 122.6 83.9 556 565 A C > - 0 0 3 46,-2.3 3,-2.5 -55,-0.1 4,-0.2 -0.432 44.7-109.3 -67.8 148.2 91.6 120.5 87.1 557 566 A P T 3 S+ 0 0 79 0, 0.0 3,-0.5 0, 0.0 -56,-0.2 0.835 114.8 36.8 -46.4 -52.0 91.4 122.5 90.4 558 567 A W T > S+ 0 0 58 -58,-2.8 3,-2.3 1,-0.2 4,-0.2 0.087 73.0 126.8 -99.4 34.1 94.9 122.0 91.5 559 568 A F G X + 0 0 25 -3,-2.5 3,-2.1 1,-0.3 6,-0.4 0.840 62.7 75.2 -54.6 -27.1 96.5 122.2 88.1 560 569 A N G 3 S+ 0 0 95 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.762 86.2 59.4 -59.8 -21.1 98.8 124.9 89.6 561 570 A E G < S+ 0 0 30 -3,-2.3 -143,-2.3 -140,-0.1 -139,-0.3 0.477 89.7 93.9 -91.6 6.1 100.8 122.4 91.5 562 571 A T B X> S-M 417 0E 0 -3,-2.1 3,-1.1 -145,-0.2 4,-0.6 -0.657 77.3-132.8 -96.2 148.4 101.8 120.6 88.3 563 572 A T G >4>S+ 0 0 22 -147,-1.3 5,-2.1 -2,-0.3 3,-0.8 0.819 106.2 70.0 -68.3 -23.7 105.0 121.3 86.3 564 573 A Y G >45S+ 0 0 3 -148,-0.6 3,-1.3 1,-0.3 -1,-0.2 0.796 89.9 62.6 -62.2 -29.3 102.8 121.4 83.2 565 574 A A G <45S+ 0 0 31 -3,-1.1 -1,-0.3 -6,-0.4 -2,-0.2 0.876 99.7 52.4 -62.6 -33.4 101.4 124.6 84.6 566 575 A K G <<5S- 0 0 93 -3,-0.8 -1,-0.3 -4,-0.6 -2,-0.2 0.200 127.1-103.0 -85.9 18.7 104.9 126.1 84.3 567 576 A G T < 5S+ 0 0 5 -3,-1.3 2,-0.5 1,-0.2 -3,-0.2 0.701 76.4 145.1 64.6 13.6 105.0 125.0 80.7 568 577 A I < - 0 0 60 -5,-2.1 -1,-0.2 -6,-0.1 -2,-0.1 -0.799 27.8-170.4 -86.1 124.9 107.3 122.1 81.6 569 578 A L >> - 0 0 3 -2,-0.5 3,-1.7 -3,-0.1 4,-0.6 -0.667 37.1-104.2-106.8 166.0 106.7 118.8 79.5 570 579 A P H >> S+ 0 0 9 0, 0.0 3,-1.9 0, 0.0 4,-0.8 0.960 118.2 62.9 -60.5 -40.5 108.1 115.1 79.9 571 580 A I H 34 S+ 0 0 22 1,-0.3 108,-0.1 2,-0.2 107,-0.0 0.596 100.8 54.5 -61.2 -10.4 110.5 115.7 77.0 572 581 A D H <4 S+ 0 0 72 -3,-1.7 -1,-0.3 1,-0.1 -4,-0.0 0.635 113.5 35.3 -90.2 -23.1 112.3 118.5 79.1 573 582 A T H << S+ 0 0 48 -3,-1.9 -2,-0.2 -4,-0.6 3,-0.1 0.363 80.1 123.4-119.6 11.0 113.1 116.5 82.3 574 583 A Y S < S- 0 0 49 -4,-0.8 2,-0.4 1,-0.1 104,-0.1 -0.255 77.8 -85.6 -71.9 162.6 113.9 113.0 81.3 575 584 A K > - 0 0 43 140,-0.2 3,-2.0 1,-0.2 4,-0.2 -0.504 38.4-144.7 -70.0 121.1 117.2 111.3 82.4 576 585 A K G >> S+ 0 0 144 -2,-0.4 3,-2.1 1,-0.3 4,-0.5 0.708 89.4 84.5 -72.0 -10.1 119.5 112.5 79.6 577 586 A D G >4 S+ 0 0 23 1,-0.3 3,-0.8 137,-0.2 -1,-0.3 0.790 77.0 74.9 -52.4 -26.0 121.4 109.2 79.7 578 587 A L G X> S+ 0 0 5 -3,-2.0 4,-1.7 1,-0.2 3,-1.4 0.784 79.8 69.1 -56.0 -27.8 118.5 108.2 77.4 579 588 A D G <4 S+ 0 0 89 -3,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.850 91.3 61.7 -62.4 -36.6 120.1 110.1 74.5 580 589 A T G << S+ 0 0 112 -3,-0.8 -1,-0.3 -4,-0.5 -2,-0.2 0.679 114.2 30.9 -53.9 -29.0 122.9 107.6 74.4 581 590 A I T <4 S+ 0 0 32 -3,-1.4 2,-0.4 -4,-0.3 -2,-0.2 0.543 117.4 46.7-117.8 -17.4 120.5 104.6 73.6 582 591 A A < + 0 0 13 -4,-1.7 -1,-0.3 1,-0.1 -53,-0.0 -0.953 51.5 172.0-134.9 120.7 117.7 106.0 71.6 583 592 A N + 0 0 144 -2,-0.4 -1,-0.1 -3,-0.1 -4,-0.0 0.832 36.4 120.1 -96.9 -42.6 118.4 108.4 68.5 584 593 A E - 0 0 45 1,-0.1 3,-0.1 3,-0.0 -2,-0.0 0.175 60.3-119.6 -29.1 127.2 114.8 108.8 66.8 585 594 A P - 0 0 80 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.182 27.8 -93.7 -69.6 167.7 113.4 112.3 66.6 586 595 A L - 0 0 72 1,-0.1 -53,-0.1 -50,-0.0 -54,-0.0 -0.624 35.0-167.2 -78.8 131.2 110.2 113.6 68.0 587 596 A H + 0 0 99 -2,-0.3 2,-0.3 -54,-0.1 -1,-0.1 0.416 61.3 68.0-103.1 0.2 107.6 113.3 65.4 588 597 A Y S S- 0 0 47 0, 0.0 2,-1.4 0, 0.0 -2,-0.0 -0.859 92.1-101.4-121.2 151.7 104.9 115.4 66.9 589 598 A D > + 0 0 99 -2,-0.3 4,-1.1 1,-0.2 5,-0.1 -0.534 42.6 171.5 -77.8 100.5 104.8 119.2 67.4 590 599 A W H > + 0 0 7 -2,-1.4 4,-2.4 1,-0.2 -1,-0.2 0.744 69.3 58.0 -81.3 -22.4 105.5 119.5 71.2 591 600 A E H > S+ 0 0 104 2,-0.2 4,-2.1 3,-0.2 5,-0.2 0.836 102.5 52.2 -82.0 -29.7 105.9 123.3 71.4 592 601 A A H > S+ 0 0 53 2,-0.2 4,-2.3 1,-0.2 3,-0.3 1.000 115.6 43.2 -60.4 -60.3 102.4 124.2 70.0 593 602 A L H X S+ 0 0 8 -4,-1.1 4,-2.3 2,-0.2 5,-0.3 0.899 109.1 58.9 -41.9 -52.3 101.0 121.8 72.7 594 603 A R H X S+ 0 0 28 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.930 110.1 42.8 -45.1 -51.9 103.5 123.3 75.3 595 604 A E H X S+ 0 0 95 -4,-2.1 4,-1.9 -3,-0.3 5,-0.3 0.875 112.0 53.7 -63.4 -40.8 101.9 126.7 74.7 596 605 A S H X S+ 0 0 21 -4,-2.3 4,-2.7 -5,-0.2 5,-0.5 0.864 108.8 48.9 -67.5 -29.5 98.3 125.3 74.7 597 606 A I H X S+ 0 0 0 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.956 109.4 53.1 -70.5 -46.8 98.9 123.6 78.1 598 607 A K H < S+ 0 0 95 -4,-2.1 -2,-0.2 -5,-0.3 -1,-0.2 0.891 123.4 27.8 -53.4 -36.9 100.3 126.9 79.6 599 608 A T H < S+ 0 0 101 -4,-1.9 -2,-0.2 -5,-0.1 -3,-0.2 0.905 134.0 28.2-101.0 -46.1 97.2 128.8 78.5 600 609 A H H < S- 0 0 83 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.633 95.2-151.1 -88.9 -9.8 94.4 126.3 78.4 601 610 A G < - 0 0 4 -4,-2.0 2,-0.4 -5,-0.5 -51,-0.2 -0.053 20.1 -75.8 75.3-177.5 95.6 123.9 81.1 602 611 A L - 0 0 0 -46,-0.2 -46,-2.3 -52,-0.1 -55,-0.2 -0.972 17.7-146.6-119.5 137.7 95.0 120.1 81.6 603 612 A R S S+ 0 0 26 -57,-1.0 2,-0.4 -2,-0.4 -1,-0.1 0.748 93.2 42.3 -67.4 -18.5 91.9 118.5 82.8 604 613 A N - 0 0 0 -61,-0.1 -102,-0.2 1,-0.1 -101,-0.2 -0.990 65.8-153.5-136.2 125.2 94.1 115.8 84.4 605 614 A S S S+ 0 0 0 -104,-2.5 2,-0.3 -2,-0.4 -41,-0.1 0.787 90.8 32.3 -63.3 -30.3 97.4 116.2 86.3 606 615 A T + 0 0 0 -105,-0.4 -102,-2.2 -104,-0.2 -1,-0.1 -0.976 57.7 166.5-128.9 140.8 98.4 112.7 85.4 607 616 A L + 0 0 0 -2,-0.3 -101,-2.1 1,-0.3 2,-0.3 0.663 58.0 42.3-126.9 -31.4 97.6 110.7 82.2 608 617 A S B +d 506 0B 0 -103,-0.3 74,-1.7 71,-0.1 73,-0.3 -0.941 42.1 155.6-134.5 145.6 99.8 107.6 81.8 609 618 A A - 0 0 0 -103,-0.6 2,-0.8 -2,-0.3 75,-0.2 -0.933 37.1-129.2-154.3 135.7 101.1 104.7 84.0 610 619 A L B -o 684 0G 4 73,-2.7 75,-2.5 -2,-0.3 -153,-0.1 -0.810 34.9-173.0-105.8 108.2 102.1 101.2 82.7 611 620 A M - 0 0 22 -2,-0.8 15,-0.2 -155,-0.2 2,-0.2 -0.528 30.2-103.7 -94.8 162.3 100.3 98.7 84.9 612 621 A P - 0 0 57 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.568 40.8-165.5 -64.2 142.0 100.5 94.9 85.1 613 622 A S + 0 0 13 -2,-0.2 12,-0.0 1,-0.1 -105,-0.0 -0.993 28.3 149.1-129.6 135.1 97.5 93.4 83.4 614 623 A E S > S+ 0 0 122 -2,-0.4 4,-1.4 10,-0.1 -1,-0.1 0.632 76.6 32.5-119.6 -52.6 96.4 89.9 83.7 615 624 A T H > S+ 0 0 18 2,-0.2 4,-1.6 1,-0.2 -474,-0.1 0.952 120.7 45.8 -70.5 -53.2 92.6 89.7 83.4 616 625 A S H > S+ 0 0 21 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.918 109.6 59.1 -52.8 -44.1 91.9 92.5 80.9 617 626 A S H >4>S+ 0 0 0 1,-0.2 5,-2.2 2,-0.2 3,-0.6 0.951 105.8 47.2 -52.3 -48.3 94.8 91.3 78.8 618 627 A Q H ><5S+ 0 0 9 -4,-1.4 3,-0.9 1,-0.2 -483,-0.3 0.826 100.0 63.3 -78.6 -20.3 93.2 87.9 78.4 619 628 A I H 3<5S+ 0 0 10 -4,-1.6 -484,-0.3 1,-0.2 -1,-0.2 0.884 112.9 38.7 -61.8 -33.2 89.7 89.1 77.4 620 629 A S T <<5S- 0 0 17 -4,-1.3 -1,-0.2 -3,-0.6 -2,-0.2 0.436 114.6-119.2 -92.5 4.1 91.4 90.7 74.3 621 630 A N T < 5 + 0 0 14 -3,-0.9 2,-0.3 -4,-0.3 -3,-0.2 0.991 64.5 151.4 52.4 60.7 93.7 87.7 73.9 622 631 A A < - 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0 0 46 -3,-1.9 2,-0.7 -4,-0.5 -397,-0.0 -0.107 60.5-142.9 -58.0 126.3 130.1 102.9 87.0 737 747 A Q 0 0 159 1,-0.1 -1,-0.1 0, 0.0 -2,-0.0 -0.820 360.0 360.0 -93.9 110.3 128.6 106.3 86.0 738 748 A L 0 0 29 -2,-0.7 -1,-0.1 -406,-0.1 -161,-0.1 -0.083 360.0 360.0 -71.0 360.0 125.0 106.9 87.3