==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LIGASE/RNA 16-OCT-08 2ZUF . COMPND 2 MOLECULE: ARGINYL-TRNA SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR M.KONNO,T.SUMIDA,E.UCHIKAWA,Y.MORI,T.YANAGISAWA,S.SEKINE, . 628 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 29829.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 477 76.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 4.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 37 5.9 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 . 2 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 40 6.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 68 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 281 44.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 11 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 1 1 1 1 1 0 1 0 3 2 1 1 1 1 1 2 2 1 2 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 2 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 PARALLEL BRIDGES PER LADDER . 3 2 1 1 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 . 1 0 2 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 2 A L 0 0 160 0, 0.0 2,-0.7 0, 0.0 553,-0.1 0.000 360.0 360.0 360.0 152.8 -2.5 -7.8 32.4 2 3 A M > + 0 0 22 551,-0.3 3,-0.7 1,-0.2 4,-0.0 -0.412 360.0 140.3 -98.1 55.4 -3.2 -10.8 30.0 3 4 A E T >> + 0 0 89 -2,-0.7 3,-2.0 1,-0.2 4,-0.6 0.188 31.2 115.3 -83.0 19.0 -3.6 -13.3 32.8 4 5 A I H 3> + 0 0 31 1,-0.3 4,-1.4 2,-0.2 3,-0.4 0.688 63.7 73.4 -59.7 -16.3 -6.5 -14.8 30.7 5 6 A R H <> S+ 0 0 63 -3,-0.7 4,-1.7 1,-0.2 -1,-0.3 0.872 86.6 61.7 -64.1 -36.5 -4.1 -17.8 30.6 6 7 A E H <> S+ 0 0 81 -3,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.832 100.9 52.4 -58.5 -35.7 -5.1 -18.4 34.2 7 8 A S H X S+ 0 0 25 -4,-0.6 4,-2.5 -3,-0.4 -1,-0.2 0.919 108.0 49.4 -68.0 -45.1 -8.7 -18.9 33.3 8 9 A V H X S+ 0 0 1 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.802 112.4 50.4 -64.4 -29.9 -7.8 -21.5 30.6 9 10 A K H X S+ 0 0 32 -4,-1.7 4,-2.5 2,-0.2 5,-0.2 0.973 110.5 46.0 -71.7 -57.3 -5.7 -23.3 33.1 10 11 A E H X S+ 0 0 122 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.925 113.8 51.2 -50.9 -49.4 -8.3 -23.5 35.9 11 12 A R H >X S+ 0 0 55 -4,-2.5 4,-1.8 1,-0.2 3,-0.9 0.942 112.5 43.9 -53.5 -55.0 -10.9 -24.6 33.4 12 13 A I H 3X S+ 0 0 0 -4,-1.9 4,-1.6 1,-0.3 -1,-0.2 0.806 107.9 58.3 -63.7 -31.7 -8.7 -27.5 32.0 13 14 A E H 3X S+ 0 0 62 -4,-2.5 4,-1.0 2,-0.2 -1,-0.3 0.750 106.7 51.4 -70.2 -21.1 -7.6 -28.6 35.5 14 15 A E H < + 0 0 11 -4,-1.3 3,-1.8 -3,-0.4 -2,-0.2 -0.139 60.7 177.8 174.2 73.7 -8.8 -38.3 35.9 21 22 A P T 3 S+ 0 0 62 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 0.626 81.8 70.3 -62.1 -12.3 -9.4 -37.1 39.5 22 23 A Q T 3 S+ 0 0 165 -6,-0.2 2,-0.4 -5,-0.1 -5,-0.1 0.270 76.4 106.8 -89.3 10.2 -6.1 -38.8 40.4 23 24 A W < + 0 0 51 -3,-1.8 2,-0.4 -7,-0.2 -3,-0.1 -0.780 42.2 176.1 -94.4 133.7 -4.2 -36.1 38.4 24 25 A E + 0 0 170 -2,-0.4 2,-0.3 2,-0.1 -2,-0.0 -0.910 33.4 91.1-139.0 106.1 -2.2 -33.5 40.4 25 26 A G - 0 0 32 -2,-0.4 2,-0.4 -12,-0.1 -2,-0.0 -0.945 66.9 -79.8-170.5-170.2 -0.1 -31.1 38.5 26 27 A E - 0 0 157 -2,-0.3 2,-0.6 18,-0.0 -2,-0.1 -0.920 34.6-127.4-115.6 139.7 0.2 -27.7 36.7 27 28 A I - 0 0 5 -2,-0.4 2,-0.6 15,-0.0 -18,-0.1 -0.765 20.2-153.8 -88.5 119.3 -1.0 -26.9 33.2 28 29 A E - 0 0 118 -2,-0.6 2,-0.6 -19,-0.0 16,-0.3 -0.836 7.2-164.0 -95.3 119.8 1.7 -25.4 31.0 29 30 A L + 0 0 7 -2,-0.6 2,-0.3 13,-0.1 13,-0.2 -0.918 13.0 177.5-106.9 121.1 0.3 -23.2 28.3 30 31 A K E -A 41 0A 106 11,-3.0 11,-2.9 -2,-0.6 -2,-0.0 -0.873 35.6 -91.6-122.5 155.4 2.7 -22.4 25.5 31 32 A E E -A 40 0A 125 -2,-0.3 9,-0.3 9,-0.2 8,-0.1 -0.253 45.5-114.9 -61.0 150.5 2.4 -20.4 22.2 32 33 A T - 0 0 25 7,-1.2 -1,-0.1 6,-0.3 6,-0.1 -0.571 17.5-117.0 -89.3 153.2 1.4 -22.4 19.1 33 34 A P S S+ 0 0 123 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.782 97.7 15.8 -56.7 -31.7 3.7 -22.9 16.1 34 35 A D S >> S- 0 0 72 4,-0.1 3,-2.6 1,-0.1 4,-0.5 -0.997 74.4-119.2-149.6 142.8 1.2 -21.1 13.8 35 36 A P G >4 S+ 0 0 30 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.779 111.0 67.7 -47.7 -32.5 -1.8 -18.7 14.3 36 37 A K G 34 S+ 0 0 156 1,-0.3 3,-0.1 3,-0.1 507,-0.0 0.765 97.9 52.0 -61.3 -27.3 -3.9 -21.3 12.5 37 38 A L G <4 S- 0 0 58 -3,-2.6 -1,-0.3 1,-0.3 2,-0.2 0.594 123.3 -97.7 -85.9 -11.6 -3.5 -23.7 15.4 38 39 A G << - 0 0 1 -3,-1.2 -1,-0.3 -4,-0.5 -6,-0.3 -0.610 37.6 -72.2 120.7 177.6 -4.6 -21.1 17.9 39 40 A D S S- 0 0 32 48,-1.8 -7,-1.2 1,-0.3 2,-0.3 0.921 104.6 -14.4 -78.7 -44.9 -3.0 -18.6 20.2 40 41 A F E +AB 31 87A 12 47,-1.1 47,-2.4 -9,-0.3 -1,-0.3 -0.982 62.9 174.8-154.6 162.4 -1.7 -21.0 22.8 41 42 A G E -AB 30 86A 4 -11,-2.9 -11,-3.0 -2,-0.3 45,-0.2 -0.936 23.0-112.0-156.9-179.8 -2.1 -24.6 23.9 42 43 A T E - B 0 85A 1 43,-1.8 43,-2.0 -2,-0.3 3,-0.4 -0.949 5.5-153.1-129.2 146.2 -0.9 -27.4 26.2 43 44 A P >> + 0 0 13 0, 0.0 3,-1.6 0, 0.0 4,-0.7 0.183 64.2 119.5 -96.2 14.3 0.9 -30.7 25.8 44 45 A I H >> + 0 0 4 -16,-0.3 4,-1.7 1,-0.3 3,-1.1 0.821 59.9 66.6 -48.6 -41.7 -0.8 -32.0 28.9 45 46 A A H 3> S+ 0 0 0 38,-0.5 4,-2.4 -3,-0.4 -1,-0.3 0.843 95.7 57.6 -53.2 -36.0 -2.5 -34.8 27.1 46 47 A F H <> S+ 0 0 79 -3,-1.6 4,-0.6 37,-0.2 -1,-0.3 0.839 107.1 47.5 -65.0 -32.7 0.9 -36.5 26.5 47 48 A K H < S+ 0 0 166 -4,-0.6 3,-0.8 2,-0.2 -1,-0.2 0.941 110.4 43.2 -61.9 -52.8 0.6 -42.7 30.3 51 52 A L H 3< S+ 0 0 97 -4,-0.6 -2,-0.2 1,-0.2 -1,-0.1 0.986 119.2 41.4 -57.8 -62.9 -1.6 -42.9 33.4 52 53 A L T 3< S- 0 0 61 -4,-1.8 -1,-0.2 1,-0.1 -2,-0.2 0.422 101.2-133.5 -67.2 1.8 -4.9 -43.5 31.6 53 54 A K < + 0 0 197 -3,-0.8 -3,-0.2 -4,-0.4 -1,-0.1 0.567 66.0 128.2 55.3 7.1 -3.1 -45.9 29.2 54 55 A R - 0 0 114 -5,-0.4 -1,-0.2 -6,-0.3 -2,-0.1 -0.645 69.7 -97.6 -92.8 150.7 -5.0 -44.0 26.4 55 56 A P > - 0 0 71 0, 0.0 4,-1.8 0, 0.0 3,-0.4 -0.411 32.1-118.8 -67.1 140.5 -3.3 -42.4 23.4 56 57 A P H > S+ 0 0 38 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.888 111.8 55.1 -42.7 -55.1 -2.6 -38.7 23.7 57 58 A I H > S+ 0 0 75 1,-0.2 4,-2.3 2,-0.2 26,-0.2 0.907 107.0 50.3 -46.9 -52.7 -4.8 -37.8 20.7 58 59 A E H > S+ 0 0 86 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.930 113.2 44.7 -53.1 -53.0 -7.8 -39.5 22.3 59 60 A I H X S+ 0 0 3 -4,-1.8 4,-2.2 1,-0.2 5,-0.2 0.900 109.7 56.0 -59.6 -44.0 -7.4 -37.7 25.6 60 61 A A H X S+ 0 0 0 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.915 110.7 45.3 -54.9 -45.6 -6.7 -34.4 23.9 61 62 A E H X S+ 0 0 104 -4,-2.3 4,-1.8 -5,-0.2 -1,-0.2 0.836 109.0 55.5 -68.0 -36.1 -10.1 -34.7 22.1 62 63 A K H X S+ 0 0 71 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.878 109.6 45.8 -67.4 -37.1 -11.9 -35.8 25.2 63 64 A I H X S+ 0 0 1 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.861 111.0 52.0 -73.9 -35.2 -10.9 -32.7 27.1 64 65 A V H X S+ 0 0 8 -4,-1.7 4,-2.0 -5,-0.2 -2,-0.2 0.855 105.9 59.2 -66.5 -33.8 -11.7 -30.4 24.1 65 66 A E H >X S+ 0 0 109 -4,-1.8 4,-0.9 1,-0.2 3,-0.5 0.982 109.6 38.4 -56.8 -62.7 -15.1 -32.1 24.2 66 67 A K H 3< S+ 0 0 64 -4,-1.7 4,-0.3 1,-0.2 -1,-0.2 0.693 112.8 62.5 -64.4 -18.1 -16.0 -31.1 27.7 67 68 A L H >< S+ 0 0 1 -4,-1.2 3,-1.3 1,-0.2 -1,-0.2 0.881 95.3 55.7 -75.2 -40.4 -14.4 -27.7 27.1 68 69 A K H X< S+ 0 0 117 -4,-2.0 3,-0.6 -3,-0.5 -1,-0.2 0.807 100.1 62.0 -62.7 -27.6 -16.7 -26.6 24.3 69 70 A L T 3< S+ 0 0 146 -4,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.726 124.4 16.1 -69.9 -21.7 -19.6 -27.2 26.7 70 71 A N T < S- 0 0 82 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 -0.431 83.1-161.0-153.0 70.5 -18.1 -24.5 28.9 71 72 A L < - 0 0 49 -3,-0.6 3,-0.1 1,-0.1 -3,-0.1 -0.230 30.8-104.0 -56.2 135.6 -15.5 -22.4 27.1 72 73 A P > - 0 0 2 0, 0.0 3,-1.9 0, 0.0 2,-0.2 -0.235 50.6 -85.1 -57.9 151.1 -13.1 -20.4 29.4 73 74 A E T 3 S+ 0 0 166 1,-0.3 -66,-0.1 -3,-0.1 -65,-0.1 -0.415 118.1 21.3 -63.6 126.4 -13.9 -16.7 29.6 74 75 A G T 3 S+ 0 0 31 1,-0.3 16,-2.9 -2,-0.2 2,-0.5 0.455 97.1 119.5 95.0 2.2 -12.3 -14.8 26.8 75 76 A I E < -C 89 0A 9 -3,-1.9 -1,-0.3 14,-0.3 14,-0.3 -0.905 42.3-172.6-108.0 122.8 -12.0 -17.9 24.6 76 77 A K E - 0 0 136 12,-2.7 2,-0.3 -2,-0.5 13,-0.2 0.875 69.5 -21.0 -77.1 -41.7 -13.8 -18.1 21.3 77 78 A D E -C 88 0A 67 11,-1.4 11,-3.7 2,-0.0 2,-0.3 -0.988 53.6-141.7-164.6 162.4 -13.1 -21.7 20.6 78 79 A V E -C 87 0A 0 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.907 14.4-173.5-129.6 158.8 -10.8 -24.7 21.4 79 80 A K E -C 86 0A 121 7,-2.3 7,-2.0 -2,-0.3 2,-0.3 -0.908 19.9-135.4-159.9 127.1 -9.4 -27.5 19.2 80 81 A A E -C 85 0A 26 -2,-0.3 2,-0.4 5,-0.2 5,-0.2 -0.629 24.5-177.2 -81.9 137.4 -7.4 -30.7 19.8 81 82 A V E > -C 84 0A 30 3,-3.0 3,-2.8 -2,-0.3 -2,-0.0 -0.898 63.9 -37.0-142.7 109.3 -4.5 -31.2 17.4 82 83 A N T 3 S- 0 0 123 -2,-0.4 -25,-0.1 1,-0.3 3,-0.1 0.868 128.5 -37.2 44.6 48.1 -2.3 -34.4 17.5 83 84 A G T 3 S+ 0 0 0 1,-0.3 -38,-0.5 -26,-0.2 -1,-0.3 0.137 116.2 118.1 95.3 -21.9 -2.4 -34.5 21.3 84 85 A Y E < - C 0 81A 109 -3,-2.8 -3,-3.0 -39,-0.1 2,-0.8 -0.613 55.5-147.3 -85.4 139.7 -2.3 -30.7 21.8 85 86 A I E -BC 42 80A 0 -43,-2.0 -43,-1.8 -2,-0.3 2,-0.3 -0.899 27.9-176.4-104.9 104.3 -5.2 -28.8 23.4 86 87 A N E -BC 41 79A 7 -7,-2.0 -7,-2.3 -2,-0.8 2,-0.4 -0.705 11.2-156.8-105.6 155.8 -5.3 -25.4 21.7 87 88 A V E -BC 40 78A 2 -47,-2.4 -48,-1.8 -2,-0.3 -47,-1.1 -0.984 8.9-146.2-134.3 143.9 -7.4 -22.3 22.4 88 89 A F E - C 0 77A 52 -11,-3.7 -12,-2.7 -2,-0.4 -11,-1.4 -0.934 23.6-132.5-110.3 121.2 -8.5 -19.3 20.3 89 90 A I E - C 0 75A 3 -2,-0.5 2,-1.3 -14,-0.3 -14,-0.3 -0.259 18.9-117.0 -66.7 154.5 -8.9 -16.0 22.1 90 91 A D > - 0 0 66 -16,-2.9 4,-1.2 1,-0.2 3,-0.4 -0.725 39.9-175.0 -93.1 84.5 -12.1 -13.8 21.7 91 92 A Y H > + 0 0 16 -2,-1.3 4,-3.8 1,-0.2 5,-0.4 0.852 59.2 75.9 -50.6 -54.6 -10.1 -10.9 20.1 92 93 A P H > S+ 0 0 30 0, 0.0 4,-1.6 0, 0.0 -1,-0.2 0.794 110.5 27.2 -27.0 -65.6 -12.7 -8.1 19.7 93 94 A H H > S+ 0 0 132 -3,-0.4 4,-2.9 2,-0.2 5,-0.3 0.899 120.8 55.1 -71.9 -40.9 -12.9 -7.1 23.3 94 95 A F H X S+ 0 0 38 -4,-1.2 4,-2.2 1,-0.2 5,-0.2 0.946 110.3 46.9 -56.3 -49.5 -9.4 -8.2 24.2 95 96 A A H X S+ 0 0 0 -4,-3.8 4,-2.4 1,-0.2 -1,-0.2 0.886 114.4 47.6 -60.0 -41.5 -8.0 -6.1 21.5 96 97 A R H X S+ 0 0 67 -4,-1.6 4,-2.3 -5,-0.4 -2,-0.2 0.912 112.4 46.1 -67.7 -47.4 -10.1 -3.0 22.5 97 98 A I H X S+ 0 0 123 -4,-2.9 4,-1.6 2,-0.2 -2,-0.2 0.893 116.0 47.8 -63.9 -39.2 -9.3 -3.2 26.2 98 99 A L H X S+ 0 0 20 -4,-2.2 4,-2.4 -5,-0.3 -2,-0.2 0.948 112.7 46.0 -66.3 -52.2 -5.6 -3.7 25.5 99 100 A I H X S+ 0 0 0 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.900 112.4 51.7 -58.2 -43.9 -5.3 -0.8 23.0 100 101 A N H X S+ 0 0 79 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.866 110.3 49.2 -63.1 -36.3 -7.3 1.5 25.2 101 102 A D H X S+ 0 0 57 -4,-1.6 4,-2.4 2,-0.2 5,-0.3 0.908 109.5 51.1 -69.4 -41.8 -4.9 0.7 28.1 102 103 A I H X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 7,-0.3 0.922 114.1 44.8 -59.4 -44.5 -1.8 1.3 26.0 103 104 A L H < S+ 0 0 36 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.794 112.5 50.7 -70.9 -31.4 -3.2 4.7 24.9 104 105 A A H < S+ 0 0 80 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.895 116.3 40.4 -74.0 -40.9 -4.3 5.7 28.4 105 106 A K H >< S+ 0 0 98 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.843 87.1 171.3 -76.1 -34.4 -0.9 4.9 29.9 106 107 A G G >< S+ 0 0 13 -4,-2.2 3,-2.3 -5,-0.3 4,-0.2 -0.404 70.4 7.0 64.0-128.0 1.0 6.3 27.0 107 108 A D G 3 S+ 0 0 91 1,-0.3 -1,-0.3 -2,-0.2 3,-0.2 0.599 134.2 57.6 -63.1 -9.5 4.8 6.5 27.7 108 109 A R G X S+ 0 0 184 -3,-1.7 3,-2.4 -6,-0.2 -1,-0.3 0.407 71.2 114.7-100.4 2.9 4.0 4.6 30.9 109 110 A F T < S+ 0 0 8 -3,-2.3 -1,-0.1 1,-0.3 -2,-0.1 0.858 83.7 32.4 -42.5 -58.0 2.4 1.6 29.2 110 111 A G T 3 S+ 0 0 1 -4,-0.2 -1,-0.3 -3,-0.2 -2,-0.1 0.378 95.8 119.1 -85.5 10.9 4.9 -1.1 30.2 111 112 A S < - 0 0 51 -3,-2.4 2,-0.3 448,-0.0 43,-0.2 -0.175 40.6-171.1 -72.2 168.3 5.9 0.5 33.5 112 113 A S - 0 0 27 41,-2.0 3,-0.1 447,-0.1 -2,-0.0 -0.943 31.7-142.4-151.6 166.6 5.5 -1.1 36.9 113 114 A E > + 0 0 127 -2,-0.3 3,-2.2 1,-0.1 42,-0.1 0.155 67.7 115.4-118.3 14.1 5.7 -0.4 40.6 114 115 A I T 3 S+ 0 0 98 1,-0.3 41,-0.2 3,-0.0 -1,-0.1 0.740 80.8 46.3 -56.2 -23.6 7.2 -3.7 41.4 115 116 A G T > S+ 0 0 0 39,-2.3 3,-2.2 36,-0.1 42,-0.4 0.355 79.2 140.2-102.8 6.6 10.3 -1.9 42.5 116 117 A K T < S+ 0 0 131 -3,-2.2 40,-0.1 1,-0.3 3,-0.1 -0.225 73.5 15.7 -53.7 131.0 8.7 0.8 44.6 117 118 A G T 3 S+ 0 0 76 38,-0.4 2,-0.4 1,-0.3 -1,-0.3 0.397 101.8 113.3 86.2 -3.2 10.7 1.6 47.8 118 119 A K < - 0 0 101 -3,-2.2 39,-3.0 37,-0.3 2,-0.5 -0.852 54.3-148.9-106.6 138.6 13.8 -0.2 46.6 119 120 A K E -d 157 0B 17 -2,-0.4 257,-2.6 37,-0.2 258,-2.2 -0.909 10.5-167.1-109.3 128.3 17.0 1.5 45.8 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131.9 42.4 -25.4 49.1 316 317 A N - 0 0 88 -2,-0.4 -1,-0.2 1,-0.1 -2,-0.0 0.997 64.9-179.3 66.2 73.0 43.7 -22.0 50.4 317 318 A P + 0 0 16 0, 0.0 -10,-2.3 0, 0.0 2,-0.7 0.210 47.1 115.6 -84.3 13.9 40.4 -20.4 51.3 318 319 A I E -L 306 0D 19 -12,-0.2 2,-0.5 -11,-0.1 -12,-0.2 -0.794 42.1-178.9 -96.9 116.7 42.5 -17.4 52.3 319 320 A L E -L 305 0D 55 -14,-2.6 -14,-3.1 -2,-0.7 2,-0.5 -0.952 25.6-132.9-111.6 121.4 42.1 -14.1 50.4 320 321 A V E +L 304 0D 36 -2,-0.5 12,-0.4 -16,-0.2 11,-0.3 -0.633 27.0 174.6 -78.4 123.2 44.3 -11.3 51.6 321 322 A L E S+ 0 0 0 -18,-3.0 8,-2.8 -2,-0.5 2,-0.4 0.792 74.7 23.9 -94.5 -36.8 42.4 -8.0 52.1 322 323 A R E S-LM 303 328D 60 -19,-2.1 -19,-1.6 6,-0.2 -1,-0.3 -0.990 81.6-129.5-135.4 126.3 45.3 -6.1 53.5 323 324 A R > - 0 0 111 4,-3.4 3,-1.1 -2,-0.4 -20,-0.3 -0.040 28.8-108.1 -62.9 170.5 49.0 -6.8 53.0 324 325 A S T 3 S+ 0 0 78 1,-0.3 -1,-0.1 2,-0.1 -23,-0.0 0.839 119.4 61.9 -71.7 -32.5 51.5 -7.1 55.8 325 326 A D T 3 S- 0 0 118 1,-0.1 -1,-0.3 2,-0.1 -2,-0.1 0.389 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-299,-1.0 4,-0.0 -2,-0.2 0.092 58.6 129.6-128.6 20.7 37.9 2.1 16.8 435 436 A T B > S-J 134 0C 0 -301,-0.2 4,-2.7 1,-0.1 -301,-0.3 -0.406 71.0-113.6 -73.0 155.7 37.3 4.6 19.6 436 437 A V H > S+ 0 0 0 -303,-2.4 4,-3.1 1,-0.2 5,-0.2 0.919 117.7 57.1 -56.4 -44.7 33.7 5.3 20.4 437 438 A D H > S+ 0 0 17 -304,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.888 111.3 43.4 -54.3 -41.8 34.2 8.9 19.2 438 439 A E H > S+ 0 0 16 -3,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.885 111.9 51.1 -73.6 -39.9 35.4 7.6 15.8 439 440 A V H X S+ 0 0 1 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.916 110.1 53.0 -65.1 -36.3 32.7 5.0 15.5 440 441 A I H X S+ 0 0 12 -4,-3.1 4,-2.3 -5,-0.2 5,-0.3 0.924 108.6 46.6 -62.8 -47.1 30.1 7.7 16.2 441 442 A Q H X S+ 0 0 84 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.895 113.7 49.6 -65.4 -35.3 31.3 10.1 13.6 442 443 A E H X S+ 0 0 61 -4,-2.0 4,-1.2 2,-0.2 -1,-0.2 0.834 113.2 46.1 -71.1 -33.5 31.5 7.3 11.0 443 444 A A H X S+ 0 0 1 -4,-1.9 4,-2.4 2,-0.2 5,-0.2 0.888 113.6 46.0 -77.3 -41.5 27.9 6.1 11.8 444 445 A V H X S+ 0 0 31 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.867 111.3 54.2 -69.8 -34.5 26.2 9.4 11.8 445 446 A K H X S+ 0 0 89 -4,-1.7 4,-2.1 -5,-0.3 -1,-0.2 0.861 110.3 46.9 -65.6 -37.7 28.0 10.4 8.6 446 447 A R H X S+ 0 0 85 -4,-1.2 4,-2.5 2,-0.2 -2,-0.2 0.937 112.2 47.4 -69.6 -49.6 26.7 7.2 6.9 447 448 A A H X S+ 0 0 5 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.859 111.1 56.5 -58.9 -33.0 23.1 7.7 8.2 448 449 A R H X S+ 0 0 55 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.936 107.1 44.9 -63.9 -48.9 23.7 11.3 6.9 449 450 A E H X S+ 0 0 98 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.883 113.2 54.5 -62.9 -35.3 24.5 10.1 3.4 450 451 A L H X S+ 0 0 59 -4,-2.5 4,-2.5 1,-0.2 3,-0.3 0.934 105.5 49.0 -64.3 -48.6 21.5 7.8 3.6 451 452 A I H X S+ 0 0 10 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.842 108.9 54.7 -61.7 -34.4 19.0 10.4 4.5 452 453 A E H < S+ 0 0 77 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.850 113.4 42.3 -66.4 -35.2 20.2 12.6 1.6 453 454 A E H < S+ 0 0 148 -4,-1.4 -2,-0.2 -3,-0.3 -1,-0.2 0.849 124.6 33.0 -79.9 -38.1 19.7 9.7 -0.8 454 455 A K H < S+ 0 0 142 -4,-2.5 -3,-0.2 1,-0.2 -2,-0.2 0.845 135.4 14.5 -90.8 -38.5 16.3 8.5 0.6 455 456 A N >< + 0 0 44 -4,-2.4 3,-1.1 -5,-0.3 -1,-0.2 -0.381 64.9 158.0-138.5 60.1 14.5 11.7 1.8 456 457 A P T 3 + 0 0 73 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.594 62.8 80.2 -58.6 -13.6 16.4 14.7 0.3 457 458 A A T 3 S+ 0 0 91 -3,-0.1 -5,-0.1 2,-0.0 -2,-0.0 0.888 71.9 90.5 -63.0 -44.5 13.3 16.8 0.8 458 459 A L S < S- 0 0 16 -3,-1.1 2,-0.1 -7,-0.2 -3,-0.0 0.049 87.0 -96.3 -50.2 161.2 13.8 17.5 4.5 459 460 A S > - 0 0 60 1,-0.1 4,-2.7 4,-0.0 5,-0.2 -0.416 32.4-108.6 -79.8 160.0 15.7 20.5 5.8 460 461 A D H > S+ 0 0 114 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.905 118.6 57.7 -52.3 -46.2 19.4 20.3 6.7 461 462 A E H > S+ 0 0 140 1,-0.2 4,-2.0 2,-0.2 3,-0.3 0.940 111.0 39.6 -49.9 -58.2 18.5 20.7 10.3 462 463 A E H > S+ 0 0 38 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.885 112.1 57.0 -63.4 -39.5 16.1 17.7 10.4 463 464 A K H X S+ 0 0 11 -4,-2.7 4,-1.5 1,-0.2 -1,-0.2 0.843 109.3 46.0 -62.8 -30.8 18.5 15.6 8.2 464 465 A A H X S+ 0 0 49 -4,-2.2 4,-1.9 -3,-0.3 -1,-0.2 0.866 110.9 54.5 -77.1 -36.1 21.2 16.1 10.8 465 466 A E H X S+ 0 0 88 -4,-2.0 4,-2.3 -5,-0.2 -2,-0.2 0.932 112.1 41.2 -60.6 -50.1 18.8 15.3 13.6 466 467 A V H X S+ 0 0 7 -4,-2.6 4,-3.1 2,-0.2 5,-0.3 0.875 109.3 59.5 -68.4 -37.3 17.8 12.0 12.1 467 468 A A H X S+ 0 0 1 -4,-1.5 4,-3.2 -5,-0.3 5,-0.2 0.917 110.5 42.9 -57.2 -43.6 21.3 11.1 11.1 468 469 A E H X>S+ 0 0 76 -4,-1.9 4,-2.6 2,-0.2 5,-0.6 0.933 113.8 50.3 -68.9 -44.9 22.4 11.3 14.7 469 470 A K H X5S+ 0 0 46 -4,-2.3 4,-1.1 1,-0.2 154,-0.3 0.881 119.1 38.8 -59.8 -38.5 19.3 9.5 16.0 470 471 A V H X5S+ 0 0 13 -4,-3.1 4,-2.2 3,-0.2 -2,-0.2 0.897 118.5 46.4 -78.0 -45.9 19.9 6.7 13.5 471 472 A G H X5S+ 0 0 0 -4,-3.2 4,-1.5 -5,-0.3 -3,-0.2 0.941 119.3 38.6 -64.3 -49.5 23.7 6.6 13.7 472 473 A I H X5S+ 0 0 14 -4,-2.6 4,-2.7 -5,-0.2 5,-0.2 0.923 116.0 53.4 -66.5 -47.1 23.9 6.7 17.5 473 474 A G H XX S+ 0 0 0 -4,-2.7 4,-0.9 1,-0.2 3,-0.9 0.970 112.9 49.4 -62.1 -51.6 23.6 1.4 20.9 477 478 A Y H >X S+ 0 0 5 -4,-2.9 4,-2.0 1,-0.2 3,-0.9 0.882 106.0 55.1 -55.4 -46.0 21.4 -1.4 19.5 478 479 A N H 3< S+ 0 0 14 -4,-2.1 4,-0.3 1,-0.2 -1,-0.2 0.799 105.4 54.8 -61.1 -27.2 24.3 -3.4 18.1 479 480 A L H << S+ 0 0 5 -4,-1.2 -1,-0.2 -3,-0.9 -2,-0.2 0.739 120.0 28.2 -78.7 -22.6 25.9 -3.5 21.5 480 481 A I H << S+ 0 0 2 -4,-0.9 92,-0.2 -3,-0.9 -2,-0.2 0.514 91.6 92.1-116.0 -7.9 22.9 -4.9 23.3 481 482 A K S < S+ 0 0 56 -4,-2.0 2,-0.3 -5,-0.2 -3,-0.1 0.776 88.7 44.7 -62.5 -28.2 21.0 -6.9 20.8 482 483 A Y S S- 0 0 83 -4,-0.3 87,-0.1 1,-0.1 88,-0.1 -0.771 105.4 -75.3-114.1 163.0 22.7 -10.3 21.6 483 484 A S > - 0 0 30 -2,-0.3 3,-1.8 1,-0.2 -1,-0.1 -0.210 35.0-130.6 -55.2 136.3 23.5 -11.9 24.9 484 485 A P T 3 S+ 0 0 16 0, 0.0 -69,-2.8 0, 0.0 -1,-0.2 0.660 101.2 79.2 -63.6 -11.2 26.5 -10.3 26.7 485 486 A D T 3 S+ 0 0 103 -71,-0.2 2,-0.4 2,-0.0 -71,-0.1 0.489 85.3 70.6 -74.2 -3.7 27.8 -13.8 27.1 486 487 A K S < S- 0 0 143 -3,-1.8 -71,-0.2 -71,-0.1 -4,-0.1 -0.952 85.4-122.4-117.7 136.2 29.0 -13.8 23.5 487 488 A K - 0 0 112 -2,-0.4 2,-0.5 -73,-0.1 -70,-0.2 -0.177 21.7-132.6 -65.8 166.0 31.9 -11.7 22.2 488 489 A I E -n 417 0E 18 -72,-1.9 -70,-3.0 -4,-0.1 2,-1.1 -0.975 5.1-151.0-126.2 116.9 31.3 -9.2 19.4 489 490 A I E -n 418 0E 73 -2,-0.5 2,-0.2 -72,-0.2 -70,-0.2 -0.767 26.0-136.6 -87.9 102.1 33.7 -9.1 16.5 490 491 A F + 0 0 9 -72,-3.1 2,-0.4 -2,-1.1 3,-0.1 -0.409 30.6 172.4 -63.2 124.8 33.4 -5.5 15.4 491 492 A R > - 0 0 94 -2,-0.2 3,-1.3 1,-0.1 4,-0.2 -0.998 35.9-133.1-136.2 130.0 33.2 -5.0 11.7 492 493 A W T >> S+ 0 0 56 -2,-0.4 3,-2.7 1,-0.3 4,-0.5 0.863 106.5 59.9 -47.1 -45.8 32.5 -1.7 10.0 493 494 A E H >> S+ 0 0 126 1,-0.3 3,-1.1 2,-0.2 4,-0.8 0.866 97.3 62.9 -52.3 -37.0 29.8 -3.2 7.7 494 495 A D H <4 S+ 0 0 73 -3,-1.3 -1,-0.3 1,-0.2 -2,-0.2 0.477 112.2 34.8 -69.6 -2.3 28.0 -4.2 10.9 495 496 A V H <4 S+ 0 0 8 -3,-2.7 -1,-0.2 -4,-0.2 -2,-0.2 0.232 116.4 51.1-133.8 8.5 27.6 -0.5 11.8 496 497 A L H << S+ 0 0 40 -3,-1.1 2,-0.7 -4,-0.5 -2,-0.2 0.259 93.5 87.3-122.2 0.0 27.2 1.0 8.4 497 498 A N < + 0 0 76 -4,-0.8 -1,-0.0 -5,-0.3 -51,-0.0 -0.910 50.7 176.5-105.3 109.1 24.4 -1.5 7.6 498 499 A F + 0 0 19 -2,-0.7 2,-0.3 4,-0.1 4,-0.1 -0.057 53.4 86.5-105.2 31.8 21.1 -0.1 8.7 499 500 A E S S+ 0 0 143 2,-0.1 2,-0.3 5,-0.1 4,-0.1 -0.926 76.6 24.4-126.3 153.2 19.0 -3.0 7.4 500 501 A G S S+ 0 0 42 -2,-0.3 2,-2.3 2,-0.1 5,-0.1 -0.720 124.3 1.2 96.3-147.8 18.2 -6.3 9.1 501 502 A E S S+ 0 0 130 -2,-0.3 2,-0.3 4,-0.1 -2,-0.1 -0.499 103.5 124.0 -79.8 75.8 18.3 -6.7 12.9 502 503 A S S > S- 0 0 2 -2,-2.3 4,-1.1 -4,-0.1 5,-0.1 -0.801 75.4-110.3-130.4 170.3 19.2 -3.0 13.5 503 504 A A H > S+ 0 0 0 -2,-0.3 4,-3.0 1,-0.2 3,-0.5 0.925 116.1 55.9 -67.7 -46.0 18.0 0.1 15.3 504 505 A P H > S+ 0 0 8 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.837 100.6 60.8 -56.7 -32.7 17.0 1.9 12.1 505 506 A Y H > S+ 0 0 57 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.932 111.8 37.7 -59.4 -47.1 14.7 -1.1 11.3 506 507 A I H X S+ 0 0 0 -4,-1.1 4,-2.1 -3,-0.5 -1,-0.2 0.925 115.2 53.6 -70.4 -45.4 12.7 -0.5 14.4 507 508 A Q H X S+ 0 0 0 -4,-3.0 4,-3.0 1,-0.2 -2,-0.2 0.874 107.8 52.8 -56.9 -38.0 13.0 3.3 14.1 508 509 A Y H X S+ 0 0 103 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.897 105.8 51.3 -65.7 -43.3 11.5 3.0 10.6 509 510 A A H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 -1,-0.2 0.901 113.3 48.1 -61.7 -37.9 8.5 1.0 11.7 510 511 A H H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 3,-0.3 0.964 110.5 47.8 -66.4 -52.6 7.9 3.7 14.3 511 512 A A H X S+ 0 0 5 -4,-3.0 4,-2.5 1,-0.2 -2,-0.2 0.857 107.8 58.7 -57.0 -33.3 8.3 6.6 11.8 512 513 A R H X S+ 0 0 54 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.927 107.7 46.4 -60.4 -45.4 5.9 4.6 9.5 513 514 A C H X S+ 0 0 0 -4,-1.7 4,-2.1 -3,-0.3 5,-0.2 0.961 111.6 49.7 -61.3 -53.7 3.3 4.7 12.3 514 515 A S H X S+ 0 0 7 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.894 111.0 50.4 -53.5 -43.7 3.8 8.4 13.1 515 516 A S H X S+ 0 0 38 -4,-2.5 4,-3.5 2,-0.2 5,-0.3 0.914 106.1 53.8 -64.6 -43.4 3.5 9.3 9.4 516 517 A I H X S+ 0 0 19 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.950 114.6 42.2 -55.7 -47.7 0.2 7.3 8.9 517 518 A L H X S+ 0 0 20 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.861 114.3 51.0 -66.6 -36.8 -1.3 9.2 11.8 518 519 A R H X S+ 0 0 61 -4,-2.4 4,-2.5 -5,-0.2 -2,-0.2 0.944 110.2 49.2 -65.8 -48.0 0.2 12.5 10.7 519 520 A K H X S+ 0 0 94 -4,-3.5 4,-0.9 1,-0.2 -2,-0.2 0.890 110.0 53.9 -57.1 -41.0 -1.2 12.0 7.2 520 521 A A H ><>S+ 0 0 0 -4,-2.1 5,-2.0 -5,-0.3 3,-0.9 0.958 109.8 44.6 -61.1 -51.8 -4.5 11.2 8.8 521 522 A E H ><5S+ 0 0 124 -4,-2.4 3,-2.4 1,-0.3 -2,-0.2 0.957 108.5 56.2 -57.2 -54.4 -4.7 14.4 10.8 522 523 A E H 3<5S+ 0 0 145 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.693 108.1 51.8 -52.6 -20.4 -3.6 16.7 8.0 523 524 A E T <<5S- 0 0 104 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.145 120.9-100.0-107.3 20.3 -6.5 15.3 5.9 524 525 A G T < 5S+ 0 0 63 -3,-2.4 2,-0.4 1,-0.2 -3,-0.2 0.499 71.1 145.4 80.8 2.4 -9.4 15.9 8.4 525 526 A I < - 0 0 48 -5,-2.0 2,-0.5 -6,-0.2 -1,-0.2 -0.641 53.8-121.6 -77.9 126.4 -9.6 12.3 9.7 526 527 A K + 0 0 143 -2,-0.4 -1,-0.1 1,-0.2 -5,-0.1 -0.550 36.7 172.1 -68.2 117.2 -10.6 12.4 13.4 527 528 A V + 0 0 27 -2,-0.5 -1,-0.2 4,-0.1 -6,-0.1 0.347 31.0 125.0-110.0 3.6 -7.8 10.6 15.3 528 529 A D > - 0 0 53 1,-0.1 4,-2.3 4,-0.0 3,-0.3 -0.475 69.2-124.2 -66.1 131.7 -8.8 11.2 18.8 529 530 A P H > S+ 0 0 35 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.808 107.6 59.7 -44.1 -38.7 -9.1 7.9 20.7 530 531 A E H > S+ 0 0 136 2,-0.2 4,-1.8 1,-0.2 3,-0.1 0.974 110.1 37.8 -57.8 -59.8 -12.7 8.8 21.7 531 532 A T H > S+ 0 0 50 -3,-0.3 4,-1.6 1,-0.2 5,-0.2 0.889 116.1 54.2 -60.5 -42.0 -14.0 9.1 18.1 532 533 A L H X S+ 0 0 3 -4,-2.3 4,-1.5 1,-0.2 -1,-0.2 0.865 109.3 45.9 -63.4 -38.5 -11.9 6.2 16.9 533 534 A F H < S+ 0 0 25 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.848 106.1 62.4 -73.0 -30.9 -13.2 3.8 19.4 534 535 A K H < S+ 0 0 158 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.907 120.3 22.3 -60.3 -42.3 -16.8 4.9 18.8 535 536 A N H < S+ 0 0 81 -4,-1.6 -1,-0.2 62,-0.0 -2,-0.2 0.517 93.1 119.7-105.5 -5.0 -16.6 3.8 15.2 536 537 A A < - 0 0 9 -4,-1.5 62,-0.2 -5,-0.2 60,-0.1 -0.323 44.2-162.2 -62.5 141.0 -13.9 1.2 15.3 537 538 A D + 0 0 49 60,-2.1 61,-0.1 1,-0.1 -1,-0.1 0.914 15.6 171.2 -86.1 -83.1 -15.0 -2.4 14.3 538 539 A F + 0 0 5 -443,-0.0 3,-0.5 1,-0.0 -443,-0.1 0.382 53.3 97.1 85.5 -3.1 -12.4 -5.0 15.5 539 540 A T S S+ 0 0 98 1,-0.2 -448,-0.1 -448,-0.1 -446,-0.0 0.468 78.4 59.6 -94.2 0.2 -14.5 -8.1 14.6 540 541 A K S S+ 0 0 103 -448,-0.0 -1,-0.2 2,-0.0 2,-0.2 -0.085 71.5 158.0-116.9 33.3 -12.6 -8.5 11.3 541 542 A L - 0 0 19 -3,-0.5 2,-0.1 4,-0.1 -450,-0.1 -0.396 30.3-145.2 -64.3 127.9 -9.1 -8.9 12.6 542 543 A S > - 0 0 31 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.332 33.1 -94.5 -82.5 170.7 -6.7 -10.7 10.2 543 544 A E H > S+ 0 0 62 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.933 124.4 50.0 -53.0 -52.4 -4.0 -13.0 11.4 544 545 A R H > S+ 0 0 69 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.927 109.2 50.8 -51.7 -52.4 -1.3 -10.3 11.4 545 546 A E H > S+ 0 0 2 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.854 111.6 49.5 -56.6 -35.6 -3.5 -7.9 13.4 546 547 A R H X S+ 0 0 71 -4,-1.9 4,-2.2 2,-0.2 5,-0.3 0.916 109.7 49.4 -70.3 -43.3 -4.0 -10.6 15.9 547 548 A E H X S+ 0 0 57 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.885 110.0 54.2 -61.6 -37.5 -0.3 -11.4 16.2 548 549 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 -5,-0.2 -1,-0.2 0.877 109.0 46.1 -65.3 -39.1 0.2 -7.7 16.6 549 550 A V H X S+ 0 0 1 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.891 113.8 47.0 -73.2 -38.8 -2.2 -7.4 19.6 550 551 A I H X S+ 0 0 18 -4,-2.2 4,-0.6 2,-0.2 -2,-0.2 0.907 113.5 50.3 -66.4 -40.8 -0.9 -10.5 21.4 551 552 A M H >X S+ 0 0 10 -4,-2.3 3,-2.2 -5,-0.3 4,-0.6 0.976 109.9 49.9 -59.1 -54.6 2.6 -9.2 20.8 552 553 A L H >< S+ 0 0 0 -4,-2.6 3,-1.1 1,-0.3 -1,-0.2 0.855 105.5 57.6 -52.6 -39.2 1.6 -5.8 22.2 553 554 A S H 3< S+ 0 0 2 -4,-2.0 4,-0.3 1,-0.2 -551,-0.3 0.637 100.0 60.0 -69.2 -12.8 0.1 -7.5 25.3 554 555 A K H S+ 0 0 21 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.929 112.6 45.5 -59.7 -41.8 4.8 -5.4 30.2 557 558 A R H > S+ 0 0 70 -4,-0.3 4,-2.5 -3,-0.3 -2,-0.2 0.835 110.1 55.6 -68.7 -31.6 6.0 -8.9 31.1 558 559 A I H X S+ 0 0 17 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.893 107.7 49.2 -66.0 -40.0 9.0 -8.6 28.8 559 560 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.924 112.4 47.0 -65.5 -43.7 10.0 -5.4 30.7 560 561 A E H X S+ 0 0 64 -4,-2.0 4,-3.2 1,-0.2 5,-0.3 0.915 112.9 49.8 -64.4 -40.6 9.7 -7.1 34.0 561 562 A Q H X S+ 0 0 68 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.893 109.6 50.7 -63.8 -42.8 11.6 -10.2 32.8 562 563 A A H <>S+ 0 0 0 -4,-2.4 5,-2.4 2,-0.2 4,-0.3 0.869 115.6 44.0 -64.1 -36.8 14.4 -8.0 31.4 563 564 A G H <5S+ 0 0 6 -4,-2.0 3,-0.4 3,-0.2 -2,-0.2 0.955 118.1 39.6 -74.2 -51.4 14.7 -6.2 34.7 564 565 A K H <5S+ 0 0 122 -4,-3.2 -2,-0.2 1,-0.2 -3,-0.2 0.889 123.2 40.7 -67.6 -38.8 14.5 -9.2 37.1 565 566 A D T <5S- 0 0 72 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.476 107.3-127.4 -87.0 -2.8 16.7 -11.4 34.9 566 567 A V T 5 + 0 0 23 -3,-0.4 -3,-0.2 -4,-0.3 -4,-0.1 0.968 59.9 142.0 55.8 57.4 19.0 -8.5 34.1 567 568 A K > < + 0 0 91 -5,-2.4 3,-1.9 -6,-0.2 4,-0.4 -0.718 28.5 176.3-134.7 86.0 18.7 -9.0 30.4 568 569 A P T >> S+ 0 0 1 0, 0.0 3,-1.7 0, 0.0 4,-1.0 0.813 78.7 71.1 -56.4 -30.7 18.6 -5.9 28.2 569 570 A H H 3> S+ 0 0 41 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.690 83.6 69.2 -63.2 -17.1 18.6 -8.0 25.1 570 571 A L H <> S+ 0 0 23 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