==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER ISOPRENOID SYNTHASE 19-JUN-97 5EAS . COMPND 2 MOLECULE: 5-EPI-ARISTOLOCHENE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NICOTIANA TABACUM; . AUTHOR C.M.STARKS,K.BACK,J.CHAPPELL,J.P.NOEL . 514 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22521.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 407 79.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 17 3.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 76 14.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 293 57.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.9 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 0 0 0 3 1 2 3 1 4 1 0 0 0 0 0 0 0 3 1 2 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 24 A L 0 0 211 0, 0.0 242,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 35.9 122.9 50.9 53.2 2 25 A W > + 0 0 26 240,-0.2 3,-1.0 1,-0.1 0, 0.0 0.782 360.0 179.8-100.4 -35.7 125.3 51.0 50.3 3 26 A G G > - 0 0 58 1,-0.2 3,-0.8 2,-0.1 -1,-0.1 -0.249 64.8 -22.8 65.5-153.0 125.5 54.6 49.4 4 27 A D G > S+ 0 0 125 1,-0.2 3,-0.7 2,-0.1 4,-0.4 0.200 102.0 112.8 -78.4 18.3 127.6 55.9 46.6 5 28 A Q G < S+ 0 0 104 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.706 91.6 25.0 -62.9 -19.1 129.8 52.8 47.0 6 29 A F G < S+ 0 0 20 -3,-0.8 219,-0.2 215,-0.1 -1,-0.2 0.229 84.0 111.9-131.0 11.1 128.5 51.8 43.5 7 30 A L S < S+ 0 0 60 -3,-0.7 2,-0.3 1,-0.2 219,-0.3 0.895 93.1 3.5 -51.7 -45.3 127.5 55.0 41.7 8 31 A S - 0 0 84 -4,-0.4 2,-0.4 217,-0.1 -1,-0.2 -0.998 59.1-162.5-148.2 143.9 130.4 54.6 39.2 9 32 A F - 0 0 67 -2,-0.3 2,-1.1 -3,-0.1 214,-0.1 -0.935 10.5-154.0-132.2 106.9 133.2 52.1 38.5 10 33 A S - 0 0 114 -2,-0.4 2,-0.5 2,-0.0 -2,-0.0 -0.692 20.0-145.3 -82.4 97.4 136.2 53.1 36.4 11 34 A I - 0 0 59 -2,-1.1 2,-2.1 1,-0.1 3,-0.1 -0.520 8.1-135.7 -68.0 113.5 137.3 49.8 34.8 12 35 A D >> - 0 0 85 -2,-0.5 3,-1.5 1,-0.2 4,-1.4 -0.522 16.4-160.2 -74.1 81.5 141.1 49.7 34.5 13 36 A N H 3> S+ 0 0 107 -2,-2.1 4,-2.7 1,-0.3 5,-0.2 0.676 82.9 64.7 -29.4 -35.8 141.2 48.3 31.0 14 37 A Q H 3> S+ 0 0 144 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.948 104.1 42.5 -62.0 -51.9 144.9 47.2 31.6 15 38 A V H <> S+ 0 0 51 -3,-1.5 4,-2.6 1,-0.2 -2,-0.2 0.911 115.2 52.2 -61.5 -42.3 144.1 44.7 34.3 16 39 A A H X S+ 0 0 13 -4,-1.4 4,-2.9 1,-0.2 -2,-0.2 0.933 109.9 47.3 -59.7 -49.2 141.1 43.5 32.4 17 40 A E H X S+ 0 0 117 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.859 111.4 51.1 -62.3 -37.5 143.1 42.9 29.2 18 41 A K H X S+ 0 0 135 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.960 112.0 47.4 -63.7 -49.6 145.8 41.1 31.1 19 42 A Y H X S+ 0 0 27 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.943 113.3 48.1 -54.7 -52.7 143.2 38.8 32.7 20 43 A A H X S+ 0 0 40 -4,-2.9 4,-2.2 1,-0.2 -1,-0.2 0.912 110.4 51.4 -55.9 -49.0 141.5 38.1 29.4 21 44 A Q H X S+ 0 0 150 -4,-2.6 4,-1.1 1,-0.2 -1,-0.2 0.932 116.1 39.7 -56.7 -50.0 144.8 37.4 27.6 22 45 A E H X S+ 0 0 59 -4,-2.4 4,-2.6 1,-0.2 3,-0.4 0.898 110.7 58.7 -68.3 -40.0 145.9 34.8 30.3 23 46 A I H X S+ 0 0 6 -4,-3.1 4,-3.0 -5,-0.3 -1,-0.2 0.889 101.1 57.5 -56.3 -38.3 142.4 33.4 30.6 24 47 A E H X S+ 0 0 112 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.890 108.4 45.5 -59.9 -40.2 142.5 32.6 26.9 25 48 A A H X S+ 0 0 58 -4,-1.1 4,-2.6 -3,-0.4 -2,-0.2 0.960 115.3 45.7 -66.6 -51.5 145.6 30.5 27.5 26 49 A L H X S+ 0 0 13 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.841 111.3 54.8 -60.5 -34.7 144.1 28.8 30.6 27 50 A K H X S+ 0 0 33 -4,-3.0 4,-2.3 -5,-0.2 -1,-0.2 0.945 110.7 43.0 -65.5 -50.0 140.9 28.2 28.7 28 51 A E H X S+ 0 0 107 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.907 114.8 51.8 -63.2 -39.4 142.5 26.4 25.8 29 52 A Q H X S+ 0 0 97 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.903 111.1 46.5 -64.0 -42.0 144.7 24.5 28.2 30 53 A T H X S+ 0 0 0 -4,-2.5 4,-1.8 2,-0.2 -1,-0.2 0.858 107.8 57.7 -69.0 -34.7 141.6 23.4 30.2 31 54 A R H X S+ 0 0 57 -4,-2.3 4,-1.7 1,-0.2 3,-0.2 0.946 104.8 50.9 -60.1 -47.2 139.8 22.5 27.0 32 55 A S H < S+ 0 0 70 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.832 105.0 57.8 -60.3 -33.1 142.6 20.1 26.2 33 56 A M H >< S+ 0 0 39 -4,-1.2 3,-1.3 1,-0.2 -1,-0.2 0.921 106.4 48.3 -62.5 -45.3 142.3 18.5 29.7 34 57 A L H 3< S+ 0 0 3 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.840 109.6 53.3 -64.0 -34.0 138.6 17.7 28.9 35 58 A L T 3< S+ 0 0 101 -4,-1.7 2,-0.4 -5,-0.2 -1,-0.3 0.245 75.8 134.3 -88.4 14.5 139.6 16.1 25.6 36 59 A A X - 0 0 42 -3,-1.3 3,-0.5 1,-0.1 -3,-0.1 -0.514 45.7-151.5 -69.1 122.9 142.2 13.8 27.1 37 60 A T T 3 S+ 0 0 149 -2,-0.4 2,-1.0 1,-0.2 -1,-0.1 0.900 79.7 49.9 -62.8 -54.2 141.7 10.3 25.6 38 61 A G T 3 S+ 0 0 78 2,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.316 77.2 133.3 -91.1 56.8 142.9 7.8 28.2 39 62 A R < - 0 0 67 -2,-1.0 2,-0.1 -3,-0.5 3,-0.0 -0.828 52.2-121.8-109.7 142.4 141.1 9.0 31.3 40 63 A K > - 0 0 158 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.440 27.7-111.7 -75.3 154.0 139.3 6.8 33.8 41 64 A L H > S+ 0 0 32 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.912 116.8 51.3 -49.6 -54.7 135.6 7.5 34.6 42 65 A A H > S+ 0 0 32 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.900 112.1 47.2 -51.6 -46.3 136.3 8.7 38.2 43 66 A D H > S+ 0 0 79 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.878 112.4 49.1 -64.7 -40.6 138.9 11.2 36.9 44 67 A T H X S+ 0 0 13 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.927 112.8 47.4 -65.9 -44.3 136.6 12.4 34.1 45 68 A L H X S+ 0 0 0 -4,-3.0 4,-2.9 -5,-0.2 -2,-0.2 0.938 112.7 48.4 -63.4 -46.3 133.7 12.9 36.5 46 69 A N H X S+ 0 0 67 -4,-2.6 4,-2.7 -5,-0.2 -1,-0.2 0.883 109.6 53.5 -62.6 -37.6 135.9 14.7 39.1 47 70 A L H X S+ 0 0 22 -4,-2.1 4,-2.4 2,-0.2 -1,-0.2 0.956 112.8 42.8 -61.5 -49.7 137.3 17.0 36.4 48 71 A I H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.917 113.7 51.4 -62.7 -44.9 133.8 18.0 35.2 49 72 A D H X S+ 0 0 14 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.927 112.0 47.5 -58.7 -45.3 132.6 18.4 38.8 50 73 A I H X S+ 0 0 38 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.927 110.4 49.8 -62.9 -48.4 135.6 20.7 39.7 51 74 A I H <>S+ 0 0 0 -4,-2.4 5,-1.8 1,-0.2 6,-0.8 0.870 114.4 47.2 -59.8 -36.9 135.3 22.9 36.6 52 75 A E H ><5S+ 0 0 36 -4,-2.1 3,-1.7 -5,-0.2 -2,-0.2 0.933 111.3 47.8 -70.7 -48.4 131.6 23.3 37.3 53 76 A R H 3<5S+ 0 0 26 -4,-2.7 135,-0.3 1,-0.3 134,-0.2 0.788 107.5 59.0 -63.3 -26.8 132.1 24.1 41.0 54 77 A L T 3<5S- 0 0 1 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.470 112.5-122.7 -80.1 -3.9 134.8 26.6 40.0 55 78 A G T < 5S+ 0 0 3 -3,-1.7 -3,-0.2 -5,-0.1 3,-0.2 0.644 86.5 102.6 72.4 19.0 132.2 28.5 37.9 56 79 A I > < + 0 0 1 -5,-1.8 3,-1.7 1,-0.1 4,-0.3 0.376 43.2 100.0-113.1 5.1 134.1 28.2 34.6 57 80 A S G > + 0 0 24 -6,-0.8 3,-2.2 1,-0.3 7,-0.2 0.742 63.7 79.7 -64.7 -20.4 132.1 25.4 33.0 58 81 A Y G > S+ 0 0 33 1,-0.3 3,-0.5 2,-0.2 -1,-0.3 0.699 87.7 59.4 -61.3 -16.1 130.1 27.9 30.9 59 82 A H G < S+ 0 0 36 -3,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.662 109.3 43.1 -82.5 -19.4 133.2 28.0 28.6 60 83 A F G <> + 0 0 0 -3,-2.2 4,-2.7 -4,-0.3 5,-0.4 -0.094 66.0 133.1-122.2 39.1 132.9 24.3 27.9 61 84 A E H <> S+ 0 0 116 -3,-0.5 4,-2.1 1,-0.2 5,-0.2 0.933 81.1 42.0 -52.5 -53.3 129.1 23.6 27.4 62 85 A K H > S+ 0 0 138 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.930 115.5 48.2 -61.3 -50.7 129.7 21.5 24.2 63 86 A E H > S+ 0 0 24 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.932 113.8 45.9 -57.8 -50.7 132.7 19.6 25.5 64 87 A I H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.888 113.1 51.2 -62.4 -38.9 131.1 18.7 28.8 65 88 A D H X S+ 0 0 54 -4,-2.1 4,-2.6 -5,-0.4 -2,-0.2 0.954 110.5 47.2 -64.3 -49.2 127.9 17.7 27.1 66 89 A E H X S+ 0 0 90 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.858 114.5 47.6 -61.3 -36.0 129.6 15.4 24.6 67 90 A I H X S+ 0 0 19 -4,-2.1 4,-2.0 -5,-0.2 -1,-0.2 0.926 113.4 46.7 -71.0 -45.0 131.6 13.7 27.4 68 91 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.854 108.5 56.4 -65.2 -34.0 128.6 13.3 29.6 69 92 A D H X S+ 0 0 65 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.918 107.4 49.1 -63.1 -42.9 126.6 11.9 26.6 70 93 A Q H X S+ 0 0 124 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.898 111.3 49.1 -63.1 -42.1 129.3 9.2 26.2 71 94 A I H X S+ 0 0 6 -4,-2.0 4,-1.2 2,-0.2 5,-0.4 0.909 110.0 51.4 -64.5 -41.1 129.2 8.4 29.9 72 95 A Y H < S+ 0 0 80 -4,-2.6 3,-0.5 1,-0.2 -2,-0.2 0.945 113.1 46.4 -59.6 -47.3 125.4 8.1 29.7 73 96 A N H < S+ 0 0 104 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.820 109.0 52.1 -66.5 -36.6 125.7 5.7 26.7 74 97 A Q H < S- 0 0 110 -4,-2.2 -1,-0.2 -5,-0.1 -2,-0.2 0.697 82.0-161.8 -76.3 -19.7 128.4 3.5 28.1 75 98 A N < - 0 0 104 -4,-1.2 2,-0.2 -3,-0.5 -3,-0.1 0.816 17.9-176.7 39.5 49.0 126.5 2.8 31.4 76 99 A S - 0 0 39 -5,-0.4 2,-0.8 1,-0.1 -1,-0.2 -0.535 26.3-126.5 -78.3 138.0 129.6 1.5 33.2 77 100 A N - 0 0 115 -2,-0.2 -1,-0.1 1,-0.2 7,-0.0 -0.754 22.0-174.4 -86.7 109.9 129.3 0.2 36.7 78 101 A C - 0 0 30 -2,-0.8 -1,-0.2 2,-0.1 5,-0.1 0.744 20.0-151.0 -74.5 -26.5 131.8 2.1 38.9 79 102 A N + 0 0 121 23,-0.1 2,-0.4 1,-0.1 -1,-0.1 0.193 62.8 92.7 76.3 -17.7 131.0 -0.0 42.0 80 103 A D S > S- 0 0 67 1,-0.1 4,-2.4 43,-0.0 3,-0.3 -0.930 74.1-132.7-114.1 138.1 131.8 2.7 44.6 81 104 A L H > S+ 0 0 1 -2,-0.4 4,-3.0 1,-0.2 5,-0.4 0.867 100.9 58.8 -48.2 -50.0 129.3 5.1 46.1 82 105 A C H > S+ 0 0 24 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.917 114.3 34.3 -49.0 -55.8 131.4 8.2 45.6 83 106 A T H > S+ 0 0 9 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.875 117.4 54.2 -72.2 -37.6 131.7 7.9 41.8 84 107 A S H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.928 110.9 44.8 -62.1 -47.4 128.2 6.4 41.3 85 108 A A H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 -1,-0.2 0.891 114.7 48.7 -64.9 -40.8 126.4 9.2 43.1 86 109 A L H X S+ 0 0 0 -4,-1.7 4,-3.0 -5,-0.4 5,-0.3 0.941 111.2 50.1 -64.6 -45.9 128.5 11.9 41.3 87 110 A Q H X S+ 0 0 3 -4,-2.7 4,-2.0 2,-0.2 5,-0.2 0.909 112.3 48.4 -57.3 -45.6 127.8 10.2 38.0 88 111 A F H X S+ 0 0 0 -4,-2.4 4,-2.7 -5,-0.2 5,-0.2 0.968 113.4 46.7 -60.2 -53.1 124.1 10.1 38.8 89 112 A R H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.925 113.0 47.0 -57.1 -51.9 124.1 13.8 39.9 90 113 A L H X S+ 0 0 0 -4,-3.0 4,-1.0 2,-0.2 -1,-0.2 0.893 114.8 46.4 -60.1 -42.5 126.0 15.2 36.9 91 114 A L H ><>S+ 0 0 0 -4,-2.0 5,-2.3 -5,-0.3 3,-0.7 0.964 114.5 47.4 -65.2 -48.7 123.9 13.3 34.3 92 115 A R H ><5S+ 0 0 7 -4,-2.7 3,-2.1 1,-0.3 -2,-0.2 0.910 109.6 52.4 -58.5 -46.4 120.6 14.2 36.0 93 116 A Q H 3<5S+ 0 0 44 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.748 110.3 51.0 -63.0 -24.0 121.6 17.9 36.2 94 117 A H T <<5S- 0 0 49 -4,-1.0 -1,-0.3 -3,-0.7 -2,-0.2 0.214 125.0-101.6 -97.8 13.4 122.4 17.8 32.5 95 118 A G T < 5S+ 0 0 2 -3,-2.1 379,-2.6 1,-0.2 2,-0.6 0.347 76.5 136.7 87.9 -7.3 119.0 16.3 31.6 96 119 A F < - 0 0 7 -5,-2.3 2,-2.6 -6,-0.2 -1,-0.2 -0.661 52.1-140.7 -78.1 116.4 120.2 12.6 31.1 97 120 A N - 0 0 85 -2,-0.6 2,-0.2 377,-0.2 -1,-0.1 -0.415 30.1-179.9 -77.2 67.0 117.6 10.4 32.7 98 121 A I - 0 0 7 -2,-2.6 -26,-0.0 -10,-0.2 -3,-0.0 -0.508 33.4-107.3 -68.8 136.6 120.1 8.0 34.2 99 122 A S > - 0 0 66 -2,-0.2 3,-1.2 1,-0.1 -1,-0.1 -0.403 11.1-135.9 -67.5 141.5 118.3 5.2 36.1 100 123 A P G > S+ 0 0 18 0, 0.0 3,-1.9 0, 0.0 4,-0.2 0.443 88.1 97.8 -76.2 2.9 118.5 5.3 39.9 101 124 A E G > + 0 0 113 1,-0.3 3,-2.1 2,-0.2 4,-0.5 0.762 61.5 80.2 -61.6 -23.2 119.2 1.6 39.7 102 125 A I G < S+ 0 0 18 -3,-1.2 -1,-0.3 1,-0.3 3,-0.3 0.720 88.9 56.1 -57.7 -19.4 122.9 2.5 40.0 103 126 A F G X S+ 0 0 0 -3,-1.9 3,-1.9 1,-0.2 -1,-0.3 0.576 80.5 87.2 -90.7 -11.3 122.3 2.7 43.7 104 127 A S G X S+ 0 0 38 -3,-2.1 3,-2.2 1,-0.3 -1,-0.2 0.870 79.9 63.0 -57.3 -37.7 120.9 -0.8 44.2 105 128 A K G 3 S+ 0 0 61 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.594 102.4 51.8 -64.5 -9.8 124.3 -2.3 44.7 106 129 A F G < S+ 0 0 11 -3,-1.9 8,-2.8 2,-0.1 2,-0.3 0.232 102.4 77.8-108.6 10.3 124.7 -0.1 47.8 107 130 A Q B < S-A 113 0A 19 -3,-2.2 6,-0.2 6,-0.3 2,-0.1 -0.873 77.2-117.8-123.6 155.5 121.4 -1.2 49.4 108 131 A D > - 0 0 73 4,-2.8 3,-3.8 -2,-0.3 4,-0.1 -0.361 47.8 -88.6 -81.1 170.4 120.2 -4.3 51.2 109 132 A E T 3 S+ 0 0 216 1,-0.3 -1,-0.1 2,-0.1 -5,-0.0 0.438 130.4 62.5 -58.8 3.5 117.5 -6.6 49.9 110 133 A N T 3 S- 0 0 108 2,-0.2 -1,-0.3 0, 0.0 3,-0.1 0.470 115.2-115.8-105.5 -11.8 115.2 -4.2 51.7 111 134 A G S < S+ 0 0 36 -3,-3.8 2,-0.3 1,-0.3 -2,-0.1 0.496 75.0 129.1 85.6 2.0 116.2 -1.2 49.6 112 135 A K S S- 0 0 102 -4,-0.1 -4,-2.8 1,-0.1 -1,-0.3 -0.688 70.2 -96.8 -88.3 145.8 117.7 0.5 52.6 113 136 A F B -A 107 0A 8 -2,-0.3 2,-0.4 -6,-0.2 -6,-0.3 -0.394 43.9-101.4 -64.5 132.4 121.3 1.9 52.3 114 137 A K > - 0 0 93 -8,-2.8 3,-2.7 1,-0.2 4,-0.3 -0.402 26.3-145.6 -55.5 110.5 123.9 -0.5 53.6 115 138 A E G > S+ 0 0 125 -2,-0.4 3,-1.4 1,-0.3 -1,-0.2 0.658 93.2 78.0 -55.8 -13.5 124.7 1.1 57.0 116 139 A S G > S+ 0 0 89 1,-0.3 3,-0.8 2,-0.1 -1,-0.3 0.731 82.0 64.1 -67.9 -23.0 128.3 -0.1 56.4 117 140 A L G X S+ 0 0 29 -3,-2.7 3,-2.7 1,-0.2 -1,-0.3 0.574 74.2 98.4 -75.8 -9.8 128.8 2.8 54.0 118 141 A A G < S+ 0 0 26 -3,-1.4 -1,-0.2 1,-0.3 -2,-0.1 0.591 79.6 52.3 -54.7 -15.6 128.3 5.1 57.0 119 142 A S G < S+ 0 0 109 -3,-0.8 2,-1.1 1,-0.1 -1,-0.3 0.337 84.1 94.0-104.4 6.3 132.1 5.5 57.3 120 143 A D <> + 0 0 57 -3,-2.7 4,-2.8 1,-0.2 5,-0.2 -0.702 50.8 177.7-100.2 82.0 132.6 6.5 53.7 121 144 A V H > S+ 0 0 23 -2,-1.1 4,-2.6 1,-0.2 -1,-0.2 0.881 77.7 49.3 -52.9 -48.0 132.5 10.3 54.0 122 145 A L H > S+ 0 0 92 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.885 114.0 46.6 -62.3 -38.6 133.3 11.1 50.3 123 146 A G H > S+ 0 0 0 -3,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.929 112.3 50.4 -68.0 -43.9 130.6 8.6 49.2 124 147 A L H X S+ 0 0 0 -4,-2.8 4,-2.7 -7,-0.2 -2,-0.2 0.878 109.5 51.5 -60.4 -40.2 128.1 10.1 51.7 125 148 A L H X S+ 0 0 6 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.948 112.2 44.1 -64.4 -49.3 128.8 13.6 50.5 126 149 A N H X S+ 0 0 15 -4,-2.0 4,-2.1 1,-0.2 -1,-0.2 0.836 114.4 50.7 -65.7 -30.9 128.2 12.8 46.9 127 150 A L H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.905 108.7 52.7 -71.2 -41.0 125.1 10.8 47.8 128 151 A Y H X S+ 0 0 13 -4,-2.7 4,-0.7 1,-0.2 -2,-0.2 0.939 112.4 44.0 -57.8 -50.7 123.9 13.8 49.9 129 152 A E H >< S+ 0 0 5 -4,-2.4 3,-0.7 1,-0.2 -1,-0.2 0.887 114.1 50.9 -63.4 -38.3 124.3 16.1 46.9 130 153 A A H >< S+ 0 0 0 -4,-2.1 3,-1.9 1,-0.2 -2,-0.2 0.823 97.9 65.9 -69.9 -31.9 122.7 13.6 44.5 131 154 A S H >< S+ 0 0 0 -4,-2.4 3,-1.1 1,-0.3 -1,-0.2 0.794 93.9 62.8 -61.9 -25.1 119.7 13.1 46.8 132 155 A H T << S+ 0 0 19 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.484 97.7 54.7 -80.2 -3.0 118.8 16.7 46.0 133 156 A V T < S+ 0 0 4 -3,-1.9 -1,-0.2 -4,-0.1 -2,-0.2 0.234 82.3 128.9-110.7 12.6 118.3 16.1 42.3 134 157 A R < - 0 0 28 -3,-1.1 335,-0.2 -4,-0.1 2,-0.2 -0.263 43.1-151.6 -71.3 153.4 115.8 13.2 42.8 135 158 A T > - 0 0 8 334,-0.1 3,-1.0 333,-0.1 332,-0.1 -0.554 38.1 -89.6-111.8-178.9 112.4 13.1 41.0 136 159 A H T 3 S+ 0 0 78 1,-0.2 331,-0.1 330,-0.2 -2,-0.0 0.698 126.1 55.1 -67.6 -19.3 109.1 11.5 42.0 137 160 A A T 3 S+ 0 0 68 1,-0.2 2,-2.1 2,-0.1 3,-0.3 0.605 80.5 92.8 -88.5 -14.7 110.2 8.2 40.3 138 161 A D X + 0 0 7 -3,-1.0 3,-1.0 1,-0.2 -1,-0.2 -0.378 41.5 151.5 -82.7 66.4 113.4 7.9 42.3 139 162 A D G > + 0 0 116 -2,-2.1 3,-1.7 1,-0.3 4,-0.2 0.816 65.4 65.5 -64.8 -32.1 111.9 5.7 45.0 140 163 A I G 3 S+ 0 0 42 -3,-0.3 3,-0.4 1,-0.3 -1,-0.3 0.786 100.1 52.0 -62.6 -28.1 115.3 4.1 45.6 141 164 A L G X> S+ 0 0 0 -3,-1.0 3,-1.0 1,-0.2 4,-0.6 0.229 75.2 111.3 -95.7 15.1 116.7 7.5 46.8 142 165 A E T <4 S+ 0 0 101 -3,-1.7 4,-0.3 1,-0.2 3,-0.2 0.871 88.1 30.0 -56.3 -42.2 113.9 8.0 49.3 143 166 A D T 3> S+ 0 0 78 -3,-0.4 4,-2.1 -4,-0.2 -1,-0.2 0.292 92.9 98.6-105.8 14.1 116.1 7.6 52.4 144 167 A A H <> S+ 0 0 0 -3,-1.0 4,-2.5 2,-0.2 5,-0.3 0.887 82.3 49.8 -66.5 -42.0 119.3 8.9 50.8 145 168 A L H X S+ 0 0 48 -4,-0.6 4,-2.7 -3,-0.2 5,-0.2 0.964 114.4 41.6 -63.9 -55.4 119.0 12.4 52.3 146 169 A A H > S+ 0 0 63 -4,-0.3 4,-2.5 2,-0.2 5,-0.2 0.910 116.6 51.4 -59.5 -42.2 118.3 11.4 55.9 147 170 A F H X S+ 0 0 15 -4,-2.1 4,-1.7 2,-0.2 5,-0.2 0.969 115.6 37.7 -59.2 -60.3 121.0 8.6 55.6 148 171 A S H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 5,-0.3 0.887 116.0 56.0 -61.9 -38.5 123.8 10.8 54.3 149 172 A T H X S+ 0 0 37 -4,-2.7 4,-2.6 -5,-0.3 5,-0.2 0.958 107.7 44.8 -59.6 -55.5 122.7 13.7 56.5 150 173 A I H X S+ 0 0 100 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.864 117.8 44.4 -60.4 -37.8 122.9 12.0 59.8 151 174 A H H X S+ 0 0 36 -4,-1.7 4,-2.3 -5,-0.2 -1,-0.2 0.906 112.7 49.6 -75.7 -39.2 126.2 10.3 59.1 152 175 A L H X S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.2 -2,-0.2 0.912 109.2 53.7 -65.4 -39.1 127.9 13.4 57.7 153 176 A E H < S+ 0 0 114 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.864 111.2 47.0 -61.5 -36.8 126.7 15.4 60.7 154 177 A S H < S+ 0 0 91 -4,-1.2 -2,-0.2 -5,-0.2 -1,-0.2 0.880 117.7 39.8 -73.0 -39.4 128.4 12.7 62.9 155 178 A A H >< S+ 0 0 29 -4,-2.3 3,-1.9 1,-0.2 4,-0.3 0.823 94.9 83.8 -81.2 -31.4 131.7 12.6 61.0 156 179 A A G >< S+ 0 0 6 -4,-2.8 3,-1.8 1,-0.3 -1,-0.2 0.802 78.4 62.3 -41.8 -52.2 132.1 16.4 60.3 157 180 A P G 3 S+ 0 0 64 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.652 110.5 40.3 -54.3 -18.5 133.7 17.5 63.6 158 181 A H G < S+ 0 0 168 -3,-1.9 -2,-0.2 -4,-0.1 2,-0.2 0.294 87.3 113.7-117.4 11.8 136.8 15.4 63.0 159 182 A L < - 0 0 33 -3,-1.8 2,-0.1 -4,-0.3 6,-0.0 -0.498 67.3-110.9 -84.4 151.9 137.5 15.8 59.3 160 183 A K > - 0 0 161 -2,-0.2 4,-2.5 1,-0.1 5,-0.1 -0.314 53.7 -61.9 -74.0 163.8 140.6 17.5 57.9 161 184 A S T 4 S+ 0 0 76 1,-0.3 -1,-0.1 2,-0.2 30,-0.1 -0.703 112.4 14.2 -95.0 149.4 140.3 20.8 56.1 162 185 A P T >> S+ 0 0 4 0, 0.0 4,-2.2 0, 0.0 3,-0.5 -0.995 122.0 61.3 -85.5 1.5 139.0 21.8 53.7 163 186 A L H 3> S+ 0 0 26 1,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.894 103.1 54.7 -50.2 -45.4 136.9 18.7 53.5 164 187 A R H 3X S+ 0 0 102 -4,-2.5 4,-2.5 1,-0.2 -1,-0.3 0.883 109.1 46.2 -56.3 -44.1 135.3 19.5 56.9 165 188 A E H <> S+ 0 0 64 -3,-0.5 4,-2.1 2,-0.2 -1,-0.2 0.840 111.4 53.2 -69.2 -33.6 134.3 23.0 55.7 166 189 A Q H X S+ 0 0 30 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.922 112.5 43.4 -67.1 -43.9 132.9 21.5 52.5 167 190 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.951 114.6 48.9 -66.1 -50.9 130.7 19.0 54.4 168 191 A T H X S+ 0 0 59 -4,-2.5 4,-0.8 1,-0.2 -2,-0.2 0.885 114.4 46.7 -56.2 -41.7 129.6 21.5 57.0 169 192 A H H >X S+ 0 0 38 -4,-2.1 4,-2.6 -5,-0.2 3,-0.9 0.928 109.4 53.4 -67.4 -45.6 128.7 23.9 54.2 170 193 A A H 3< S+ 0 0 2 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.885 103.7 56.7 -56.4 -42.9 126.9 21.2 52.1 171 194 A L H 3< S+ 0 0 44 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.770 115.6 37.7 -60.7 -28.4 124.7 20.3 55.1 172 195 A E H << S+ 0 0 136 -3,-0.9 2,-0.3 -4,-0.8 -2,-0.2 0.744 135.6 15.3 -92.8 -29.7 123.5 24.0 55.3 173 196 A Q S < S- 0 0 18 -4,-2.6 -1,-0.3 -5,-0.1 -2,-0.1 -0.846 73.3-147.1-150.6 107.5 123.4 24.5 51.5 174 197 A C - 0 0 5 -2,-0.3 4,-0.2 -3,-0.2 3,-0.2 -0.370 23.8-121.2 -71.4 155.3 123.4 21.7 48.9 175 198 A L S > S+ 0 0 33 1,-0.2 3,-1.6 2,-0.2 -1,-0.1 0.935 106.4 56.0 -62.9 -49.3 125.1 22.5 45.6 176 199 A H T 3 S+ 0 0 3 1,-0.3 -1,-0.2 -47,-0.2 315,-0.1 0.794 112.6 41.0 -56.1 -34.6 122.1 21.9 43.4 177 200 A K T 3 S+ 0 0 29 -3,-0.2 -1,-0.3 2,-0.1 2,-0.2 0.286 95.9 100.8-100.8 11.2 119.9 24.4 45.2 178 201 A G S < S- 0 0 1 -3,-1.6 314,-0.1 -4,-0.2 313,-0.1 -0.610 83.6 -98.0 -96.9 155.2 122.4 27.1 45.7 179 202 A V > - 0 0 0 312,-0.3 4,-2.5 -2,-0.2 5,-0.3 -0.579 37.2-128.8 -69.0 128.2 122.9 30.3 43.7 180 203 A P H > S+ 0 0 30 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.904 102.9 42.8 -43.6 -64.5 125.7 29.7 41.1 181 204 A R H > S+ 0 0 7 71,-0.2 4,-2.6 1,-0.2 5,-0.2 0.862 114.6 52.4 -55.5 -38.3 127.9 32.7 41.8 182 205 A V H > S+ 0 0 15 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.929 113.9 42.0 -64.3 -44.6 127.5 32.3 45.5 183 206 A E H X S+ 0 0 17 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.875 114.0 52.3 -70.2 -37.1 128.5 28.6 45.5 184 207 A T H X S+ 0 0 9 -4,-2.9 4,-2.9 -5,-0.3 5,-0.2 0.952 108.3 50.4 -62.7 -50.4 131.4 29.3 43.0 185 208 A R H X S+ 0 0 24 -4,-2.6 4,-2.0 1,-0.2 5,-0.4 0.912 113.3 47.3 -54.6 -45.3 132.8 32.1 45.2 186 209 A F H X>S+ 0 0 47 -4,-1.8 4,-2.3 -5,-0.2 5,-0.8 0.927 112.5 47.2 -63.3 -49.4 132.7 29.8 48.2 187 210 A F H X>S+ 0 0 16 -4,-2.6 5,-2.5 -134,-0.2 4,-1.3 0.938 114.4 47.5 -60.2 -47.3 134.3 26.8 46.5 188 211 A I H <>S+ 0 0 0 -4,-2.9 5,-1.9 -135,-0.3 -2,-0.2 0.983 124.0 26.9 -58.6 -62.6 137.1 28.8 45.0 189 212 A S H <5S+ 0 0 31 -4,-2.0 -2,-0.2 -5,-0.2 -3,-0.2 0.857 130.8 33.8 -73.4 -39.5 138.2 30.8 48.1 190 213 A S H <5S+ 0 0 36 -4,-2.3 -3,-0.2 -5,-0.4 -1,-0.2 0.747 131.0 15.1 -91.5 -24.2 137.2 28.4 50.9 191 214 A I T >< - 0 0 59 1,-0.2 4,-2.4 2,-0.0 5,-0.2 -0.873 19.6-155.2 -95.3 112.7 145.0 21.7 40.0 200 223 A N H > S+ 0 0 110 -2,-0.8 4,-2.6 1,-0.2 5,-0.3 0.803 90.1 56.0 -59.5 -33.8 146.8 25.0 39.7 201 224 A V H > S+ 0 0 33 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.958 112.1 43.5 -64.9 -45.4 145.7 25.7 36.1 202 225 A L H > S+ 0 0 2 2,-0.2 4,-3.0 1,-0.2 -2,-0.2 0.892 115.1 48.5 -66.3 -41.7 142.1 25.3 37.1 203 226 A L H X S+ 0 0 10 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.939 113.6 46.1 -64.5 -46.7 142.4 27.4 40.3 204 227 A R H X S+ 0 0 93 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.937 114.8 48.9 -59.9 -46.9 144.3 30.2 38.5 205 228 A F H X S+ 0 0 0 -4,-2.5 4,-2.7 -5,-0.3 5,-0.3 0.953 111.3 49.1 -56.8 -53.9 141.7 30.1 35.7 206 229 A A H X S+ 0 0 1 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.881 112.0 48.2 -56.0 -44.5 138.7 30.2 38.1 207 230 A K H X S+ 0 0 20 -4,-2.4 4,-2.3 2,-0.2 306,-0.3 0.932 114.3 44.2 -64.7 -48.0 140.1 33.1 40.1 208 231 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.938 114.7 49.4 -63.2 -46.4 140.9 35.3 37.0 209 232 A D H X S+ 0 0 6 -4,-2.7 4,-2.7 -5,-0.2 5,-0.2 0.920 111.1 48.9 -59.9 -46.4 137.6 34.5 35.4 210 233 A F H X S+ 0 0 6 -4,-2.3 4,-2.2 -5,-0.3 -1,-0.2 0.940 113.8 46.5 -59.2 -49.2 135.6 35.3 38.5 211 234 A N H X S+ 0 0 3 -4,-2.3 4,-1.4 2,-0.2 -1,-0.2 0.869 112.3 49.8 -62.6 -40.2 137.4 38.6 39.0 212 235 A L H >X S+ 0 0 44 -4,-2.6 4,-1.3 2,-0.2 3,-0.5 0.951 112.1 46.8 -65.0 -48.8 137.1 39.6 35.3 213 236 A L H 3X S+ 0 0 11 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.874 106.4 60.4 -59.9 -38.3 133.3 38.9 35.2 214 237 A Q H 3X S+ 0 0 5 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.874 98.7 57.1 -57.4 -38.0 133.0 40.8 38.5 215 238 A M H S+ 0 0 11 -4,-2.1 4,-0.8 1,-0.2 5,-0.6 0.886 107.4 52.5 -63.8 -43.6 117.9 54.9 39.6 229 252 A K H ><5S+ 0 0 75 -4,-2.0 3,-0.7 1,-0.2 -1,-0.2 0.877 104.7 57.3 -61.8 -37.1 119.2 58.2 40.7 230 253 A D H 3<5S+ 0 0 133 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.888 100.3 56.1 -61.2 -41.6 117.8 59.8 37.5 231 254 A L H 3<5S- 0 0 47 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.778 93.1-157.5 -60.1 -28.1 114.3 58.6 38.4 232 255 A D T XX5 + 0 0 76 -4,-0.8 4,-2.0 -3,-0.7 3,-1.0 0.766 35.6 153.0 53.7 35.7 114.8 60.5 41.7 233 256 A F H 3>< + 0 0 6 -5,-0.6 4,-2.6 1,-0.2 6,-0.2 0.757 58.1 77.6 -64.3 -22.6 112.3 58.4 43.5 234 257 A V H 34 S+ 0 0 96 1,-0.2 -1,-0.2 2,-0.2 6,-0.1 0.882 110.4 22.8 -54.0 -42.9 114.2 59.1 46.7 235 258 A T H <4 S+ 0 0 94 -3,-1.0 -2,-0.2 2,-0.1 -1,-0.2 0.842 128.0 46.0 -93.6 -40.4 112.7 62.5 46.9 236 259 A T H < S+ 0 0 62 -4,-2.0 -3,-0.2 1,-0.3 -2,-0.2 0.846 124.3 31.8 -72.7 -35.4 109.5 62.2 44.8 237 260 A L >< + 0 0 0 -4,-2.6 2,-1.8 -5,-0.3 3,-1.2 -0.656 67.8 177.9-125.3 77.4 108.4 58.9 46.4 238 261 A P T 3 + 0 0 100 0, 0.0 -4,-0.1 0, 0.0 3,-0.1 -0.101 69.5 72.0 -73.2 41.6 109.6 58.9 50.1 239 262 A Y T 3 S+ 0 0 41 -2,-1.8 2,-0.4 -6,-0.2 44,-0.1 0.230 84.7 70.0-137.0 10.2 108.0 55.5 50.8 240 263 A A S < S- 0 0 22 -3,-1.2 2,-0.2 -7,-0.2 -1,-0.1 -0.985 71.9-134.2-132.2 140.2 110.4 53.2 48.9 241 264 A R - 0 0 116 -2,-0.4 2,-2.1 -3,-0.1 -2,-0.0 -0.589 30.3 -99.2 -96.3 157.3 114.0 52.3 49.7 242 265 A D + 0 0 70 -2,-0.2 3,-0.4 1,-0.2 -240,-0.2 -0.517 57.1 154.5 -72.3 81.3 117.0 52.2 47.5 243 266 A R > + 0 0 62 -2,-2.1 4,-2.6 1,-0.2 3,-0.3 0.221 30.2 117.2 -95.9 16.5 116.9 48.4 47.1 244 267 A V H > S+ 0 0 2 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.854 72.3 51.5 -52.0 -44.9 118.8 48.6 43.7 245 268 A V H > S+ 0 0 3 -3,-0.4 4,-2.0 2,-0.2 -1,-0.2 0.921 111.9 47.1 -62.2 -41.5 121.8 46.6 44.9 246 269 A E H > S+ 0 0 32 -3,-0.3 4,-2.1 1,-0.2 -2,-0.2 0.917 111.2 51.9 -64.8 -42.8 119.6 43.8 46.2 247 270 A C H X S+ 0 0 1 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.863 108.9 51.0 -62.1 -36.4 117.6 43.8 42.9 248 271 A Y H X S+ 0 0 1 -4,-2.3 4,-2.7 -5,-0.2 -1,-0.2 0.886 104.8 56.2 -69.0 -38.7 120.9 43.5 41.1 249 272 A F H X S+ 0 0 1 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.943 106.9 50.8 -57.5 -46.1 121.9 40.5 43.2 250 273 A W H X S+ 0 0 28 -4,-2.1 4,-1.7 1,-0.2 3,-0.3 0.937 110.4 47.7 -56.5 -48.5 118.7 38.8 42.2 251 274 A A H X S+ 0 0 0 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.897 110.8 52.4 -60.4 -38.8 119.4 39.5 38.5 252 275 A L H < S+ 0 0 4 -4,-2.7 -71,-0.2 1,-0.2 -1,-0.2 0.814 105.9 55.0 -66.3 -31.6 122.9 38.2 39.0 253 276 A G H < S+ 0 0 3 -4,-2.0 -1,-0.2 -3,-0.3 -2,-0.2 0.859 104.3 53.7 -69.2 -35.4 121.5 35.0 40.6 254 277 A V H < S- 0 0 4 -4,-1.7 2,-0.2 1,-0.3 -2,-0.2 0.824 132.6 -13.0 -67.8 -36.1 119.3 34.4 37.4 255 278 A Y < + 0 0 5 -4,-1.4 -1,-0.3 233,-0.1 -2,-0.1 -0.838 49.6 178.8-169.3 133.2 122.4 34.6 35.1 256 279 A F + 0 0 20 -2,-0.2 -39,-0.1 -3,-0.2 -4,-0.1 0.517 47.1 117.3-112.2 -15.1 126.0 35.7 35.5 257 280 A E S > S- 0 0 30 1,-0.1 3,-1.5 -5,-0.1 -2,-0.0 -0.248 71.3-122.0 -58.2 146.4 127.5 35.0 32.1 258 281 A P G > S+ 0 0 57 0, 0.0 3,-1.7 0, 0.0 4,-0.2 0.828 108.6 65.3 -59.2 -33.8 128.7 38.0 30.0 259 282 A Q G 3 S+ 0 0 109 1,-0.3 3,-0.3 2,-0.1 134,-0.3 0.719 97.3 57.3 -62.9 -21.4 126.3 37.2 27.1 260 283 A Y G <> S+ 0 0 22 -3,-1.5 4,-2.7 1,-0.2 -1,-0.3 0.116 70.6 114.0 -98.3 23.0 123.4 38.0 29.4 261 284 A S H <> S+ 0 0 35 -3,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.937 80.2 42.9 -57.9 -51.5 124.6 41.5 30.2 262 285 A Q H > S+ 0 0 59 -3,-0.3 4,-2.4 1,-0.2 -1,-0.2 0.918 113.6 53.9 -62.1 -42.5 121.7 43.3 28.5 263 286 A A H > S+ 0 0 0 128,-0.6 4,-2.8 -4,-0.2 -2,-0.2 0.908 107.2 50.3 -58.7 -45.2 119.3 40.8 30.0 264 287 A R H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -1,-0.2 0.922 109.9 50.2 -60.8 -45.5 120.5 41.4 33.6 265 288 A V H X S+ 0 0 7 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.935 112.9 45.9 -60.0 -46.9 120.1 45.2 33.1 266 289 A M H X S+ 0 0 0 -4,-2.4 4,-1.7 1,-0.2 -2,-0.2 0.940 113.7 50.2 -61.4 -44.9 116.6 44.9 31.9 267 290 A L H X S+ 0 0 2 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.896 106.7 54.0 -61.3 -42.9 115.7 42.4 34.7 268 291 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.914 106.8 51.5 -58.9 -45.8 117.1 44.7 37.4 269 292 A K H X S+ 0 0 20 -4,-1.8 4,-2.9 1,-0.2 -1,-0.2 0.905 110.5 48.8 -59.8 -42.3 115.0 47.6 36.3 270 293 A T H X S+ 0 0 0 -4,-1.7 4,-3.0 2,-0.2 5,-0.3 0.937 110.9 49.4 -63.7 -47.3 111.8 45.5 36.4 271 294 A I H X S+ 0 0 10 -4,-2.4 4,-1.1 1,-0.2 -2,-0.2 0.907 114.0 47.1 -59.2 -40.6 112.6 44.1 39.9 272 295 A S H X S+ 0 0 2 -4,-2.5 4,-1.4 -5,-0.2 -2,-0.2 0.945 113.9 47.3 -65.1 -48.0 113.2 47.6 41.1 273 296 A M H >X S+ 0 0 2 -4,-2.9 4,-1.7 1,-0.2 3,-0.6 0.933 111.5 47.9 -60.8 -50.7 110.0 49.0 39.5 274 297 A I H 3X S+ 0 0 6 -4,-3.0 4,-2.4 1,-0.3 -1,-0.2 0.763 105.7 61.9 -64.8 -22.6 107.7 46.2 40.7 275 298 A S H 3X S+ 0 0 13 -4,-1.1 4,-2.0 -5,-0.3 -1,-0.3 0.891 101.8 51.0 -68.9 -39.5 109.2 46.7 44.2 276 299 A I H S+ 0 0 22 -4,-2.0 4,-2.4 2,-0.2 5,-0.5 0.907 107.4 55.9 -63.8 -42.4 105.4 49.1 48.5 280 303 A T H X>S+ 0 0 0 -4,-2.3 5,-2.5 1,-0.2 4,-1.5 0.946 112.6 39.8 -54.9 -54.3 102.5 51.2 47.2 281 304 A F H <5S+ 0 0 22 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.777 117.2 52.4 -67.4 -28.7 99.9 48.5 47.8 282 305 A D H <5S- 0 0 76 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.873 129.6 -4.8 -80.5 -40.5 101.5 47.4 51.1 283 306 A A H <5S+ 0 0 90 -4,-2.4 -3,-0.2 -5,-0.1 -2,-0.1 0.354 127.4 37.3-142.0 12.7 101.8 50.6 53.2 284 307 A Y T < - 0 0 71 1,-0.1 4,-2.8 -3,-0.1 5,-0.3 -0.542 33.9 -92.1 -89.5 163.5 94.3 53.6 50.3 287 310 A V H > S+ 0 0 81 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.830 126.9 39.5 -39.1 -52.4 91.4 51.3 49.3 288 311 A K H > S+ 0 0 152 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.915 113.9 52.3 -69.5 -45.1 90.2 53.7 46.6 289 312 A E H > S+ 0 0 50 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.900 109.8 50.0 -59.0 -43.0 93.6 54.8 45.3 290 313 A L H X S+ 0 0 2 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.926 108.3 51.7 -63.2 -44.8 94.8 51.2 44.9 291 314 A E H X S+ 0 0 90 -4,-1.7 4,-1.6 -5,-0.3 -1,-0.2 0.894 111.5 48.6 -59.4 -39.0 91.6 50.3 42.9 292 315 A A H X S+ 0 0 31 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.871 111.8 49.6 -67.9 -36.7 92.3 53.3 40.7 293 316 A Y H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.909 107.8 52.3 -68.9 -43.2 96.0 52.2 40.3 294 317 A T H X S+ 0 0 7 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.869 112.3 47.5 -60.8 -38.3 95.0 48.6 39.4 295 318 A D H X S+ 0 0 62 -4,-1.6 4,-2.4 -5,-0.2 5,-0.3 0.933 108.3 52.3 -68.7 -48.3 92.7 49.9 36.7 296 319 A A H X>S+ 0 0 3 -4,-2.3 4,-2.4 1,-0.2 5,-0.5 0.910 110.5 50.9 -54.9 -41.7 95.3 52.3 35.3 297 320 A I H <5S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.905 108.8 49.3 -63.2 -44.7 97.7 49.4 35.0 298 321 A Q H <5S+ 0 0 50 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.882 114.1 45.8 -63.2 -39.8 95.2 47.2 33.2 299 322 A R H <5S- 0 0 123 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.870 87.8-165.4 -69.4 -39.1 94.4 49.9 30.7 300 323 A W T <5 + 0 0 49 -4,-2.4 -3,-0.1 -5,-0.3 -4,-0.1 0.951 44.9 117.9 49.8 63.3 98.1 50.7 30.2 301 324 A D < - 0 0 76 -5,-0.5 -1,-0.1 1,-0.0 -4,-0.0 0.639 67.9-129.7-115.3 -88.3 97.5 54.0 28.5 302 325 A I S > S+ 0 0 76 -6,-0.0 3,-2.2 18,-0.0 4,-0.3 -0.253 96.6 78.7 153.0 -36.4 98.8 57.2 30.1 303 326 A N G > S+ 0 0 100 1,-0.3 3,-1.0 2,-0.2 4,-0.1 0.737 84.9 67.9 -64.8 -21.1 95.5 59.2 29.9 304 327 A E G > S+ 0 0 22 1,-0.2 3,-2.0 2,-0.1 -1,-0.3 0.667 76.5 84.5 -72.3 -15.9 94.6 57.1 33.0 305 328 A I G X S+ 0 0 29 -3,-2.2 3,-1.9 1,-0.3 -1,-0.2 0.818 76.8 68.0 -56.6 -31.5 97.2 59.1 34.9 306 329 A D G < S+ 0 0 122 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.681 95.9 54.3 -63.4 -21.4 94.7 61.8 35.5 307 330 A R G < S+ 0 0 173 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.478 96.9 85.3 -91.1 -4.2 92.7 59.5 37.8 308 331 A L S < S- 0 0 5 -3,-1.9 2,-0.1 -4,-0.3 5,-0.1 -0.777 84.5-112.2-103.1 141.1 95.7 58.8 39.9 309 332 A P >> - 0 0 36 0, 0.0 3,-1.6 0, 0.0 4,-1.4 -0.436 44.3 -96.6 -68.1 146.3 97.0 60.8 42.9 310 333 A D H 3> S+ 0 0 126 1,-0.3 4,-1.4 2,-0.2 3,-0.2 0.707 121.9 51.8 -29.9 -51.8 100.3 62.6 42.2 311 334 A Y H 3> S+ 0 0 31 1,-0.2 4,-1.4 2,-0.2 3,-0.4 0.910 111.7 47.5 -61.5 -38.3 102.6 60.0 43.9 312 335 A M H <> S+ 0 0 0 -3,-1.6 4,-2.8 1,-0.2 -1,-0.2 0.769 103.5 63.8 -72.3 -24.8 101.0 57.2 41.8 313 336 A K H X S+ 0 0 63 -4,-1.4 4,-2.2 -3,-0.2 -1,-0.2 0.870 101.9 49.8 -65.5 -36.5 101.4 59.3 38.7 314 337 A I H X S+ 0 0 54 -4,-1.4 4,-2.3 -3,-0.4 -2,-0.2 0.949 114.0 44.0 -66.5 -49.5 105.2 59.2 39.1 315 338 A S H X S+ 0 0 0 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.968 114.4 49.3 -58.9 -56.2 105.2 55.4 39.5 316 339 A Y H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.898 112.7 46.6 -51.6 -49.6 102.7 54.8 36.6 317 340 A K H X S+ 0 0 109 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.936 110.9 52.1 -61.7 -46.3 104.6 57.0 34.2 318 341 A A H X S+ 0 0 14 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.894 109.1 51.1 -56.5 -43.2 108.0 55.5 35.1 319 342 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.964 111.8 45.4 -60.1 -52.8 106.5 52.0 34.4 320 343 A L H X S+ 0 0 14 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.897 114.2 50.2 -58.7 -41.3 105.2 52.9 31.0 321 344 A D H X S+ 0 0 73 -4,-2.8 4,-2.1 1,-0.2 3,-0.4 0.924 105.5 56.4 -63.4 -45.1 108.4 54.7 30.1 322 345 A L H X S+ 0 0 5 -4,-2.9 4,-2.2 1,-0.3 -1,-0.2 0.914 107.4 48.3 -53.8 -47.9 110.5 51.6 31.2 323 346 A Y H X S+ 0 0 2 -4,-2.0 4,-2.2 1,-0.2 -1,-0.3 0.803 107.1 56.3 -66.0 -26.6 108.7 49.4 28.8 324 347 A K H X S+ 0 0 120 -4,-1.3 4,-2.3 -3,-0.4 -1,-0.2 0.897 107.4 49.5 -69.8 -37.7 109.1 52.0 26.0 325 348 A D H X S+ 0 0 74 -4,-2.1 4,-3.2 2,-0.2 -2,-0.2 0.923 108.9 52.0 -64.9 -45.2 112.9 51.7 26.7 326 349 A Y H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -2,-0.2 0.925 110.4 48.3 -56.5 -46.8 112.7 47.9 26.5 327 350 A E H X S+ 0 0 55 -4,-2.2 4,-0.5 2,-0.2 9,-0.2 0.912 112.9 48.3 -60.7 -42.4 110.9 48.2 23.1 328 351 A K H >X S+ 0 0 151 -4,-2.3 3,-1.6 1,-0.2 4,-0.7 0.952 109.4 51.9 -62.8 -52.2 113.5 50.6 21.9 329 352 A E H 3< S+ 0 0 58 -4,-3.2 3,-0.3 1,-0.3 4,-0.2 0.839 113.7 44.3 -52.8 -40.3 116.5 48.5 23.0 330 353 A L H >X>S+ 0 0 2 -4,-2.0 5,-2.5 -5,-0.2 6,-0.6 0.498 90.7 88.8 -86.4 -3.2 115.1 45.4 21.2 331 354 A S H X<5S+ 0 0 55 -3,-1.6 3,-1.5 -4,-0.5 -1,-0.2 0.930 82.0 56.2 -59.0 -48.7 114.2 47.4 18.1 332 355 A S T 3<5S+ 0 0 118 -4,-0.7 -1,-0.2 -3,-0.3 -2,-0.1 0.776 114.5 39.9 -55.3 -30.6 117.6 46.9 16.5 333 356 A A T <45S- 0 0 69 -3,-0.5 -1,-0.3 -4,-0.2 -2,-0.2 0.428 110.3-120.2 -98.9 -2.7 117.1 43.1 16.8 334 357 A G T <<5S+ 0 0 44 -3,-1.5 -3,-0.2 -4,-0.6 3,-0.1 0.843 81.5 116.6 66.3 34.6 113.4 43.1 15.9 335 358 A R > < + 0 0 24 -5,-2.5 3,-2.2 -8,-0.1 4,-0.4 0.429 31.7 104.6-112.5 0.4 112.5 41.6 19.2 336 359 A S G > + 0 0 40 -6,-0.6 3,-1.1 1,-0.3 4,-0.4 0.742 67.2 75.7 -54.6 -22.9 110.4 44.5 20.6 337 360 A H G 3 S+ 0 0 103 1,-0.2 -1,-0.3 -7,-0.2 4,-0.1 0.506 88.2 59.1 -68.3 -6.7 107.2 42.4 19.8 338 361 A I G X> S+ 0 0 1 -3,-2.2 3,-1.9 1,-0.1 4,-0.6 0.694 80.0 83.7 -94.9 -21.7 107.9 40.2 22.8 339 362 A V H X> S+ 0 0 0 -3,-1.1 4,-1.8 -4,-0.4 3,-1.0 0.820 77.9 70.5 -50.9 -33.8 107.8 42.9 25.5 340 363 A C H 3> S+ 0 0 55 -4,-0.4 4,-2.7 1,-0.3 -1,-0.3 0.832 89.6 61.1 -55.4 -34.0 104.0 42.6 25.6 341 364 A H H <> S+ 0 0 38 -3,-1.9 4,-1.6 1,-0.2 -1,-0.3 0.883 105.4 47.1 -61.3 -38.5 104.3 39.2 27.3 342 365 A A H S+ 0 0 26 -4,-3.0 5,-2.5 1,-0.2 4,-1.0 0.882 110.0 50.7 -57.7 -40.6 91.1 40.1 51.1 360 383 A F H <5S+ 0 0 95 -4,-2.0 3,-0.4 2,-0.2 -1,-0.2 0.929 110.7 47.0 -63.1 -49.4 93.0 41.8 53.9 361 384 A I H <5S+ 0 0 91 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.872 114.5 47.0 -61.5 -40.6 90.5 44.6 54.3 362 385 A E H <5S- 0 0 135 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.651 107.6-125.4 -76.6 -16.8 87.6 42.1 54.4 363 386 A G T <5 + 0 0 32 -4,-1.0 2,-0.4 -3,-0.4 -3,-0.2 0.838 49.9 170.9 73.0 32.0 89.4 39.9 56.8 364 387 A Y < - 0 0 84 -5,-2.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.633 25.6-169.6 -83.3 131.8 88.9 37.0 54.4 365 388 A T - 0 0 30 -2,-0.4 71,-0.1 75,-0.1 3,-0.1 -0.823 17.2-165.2-120.4 85.4 90.7 33.7 55.0 366 389 A P - 0 0 1 0, 0.0 79,-0.2 0, 0.0 78,-0.1 -0.236 29.6 -93.2 -69.3 158.5 90.2 31.6 51.8 367 390 A P >> - 0 0 44 0, 0.0 4,-2.8 0, 0.0 3,-0.7 -0.390 45.9-100.0 -68.3 156.0 90.8 27.9 51.6 368 391 A V H 3> S+ 0 0 8 73,-0.4 4,-3.0 1,-0.2 5,-0.2 0.851 121.3 55.4 -43.8 -49.9 94.4 26.9 50.4 369 392 A S H 3> S+ 0 0 88 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.910 114.2 40.1 -52.6 -47.0 93.3 26.2 46.8 370 393 A E H <> S+ 0 0 63 -3,-0.7 4,-0.9 2,-0.2 5,-0.3 0.898 112.1 56.8 -70.8 -41.3 91.8 29.7 46.5 371 394 A Y H >X S+ 0 0 14 -4,-2.8 4,-3.4 1,-0.2 3,-1.1 0.953 109.7 45.7 -53.6 -51.6 94.7 31.3 48.4 372 395 A L H 3X S+ 0 0 26 -4,-3.0 4,-2.3 1,-0.2 5,-0.3 0.861 99.7 66.7 -61.7 -40.1 97.2 29.9 45.9 373 396 A S H 3< S+ 0 0 89 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.764 120.7 22.3 -55.6 -24.3 95.2 30.8 42.8 374 397 A N H XX S+ 0 0 13 -3,-1.1 4,-1.0 -4,-0.9 3,-0.5 0.792 121.4 55.6-106.3 -47.1 95.9 34.5 43.7 375 398 A A H 3< S+ 0 0 3 -4,-3.4 4,-0.3 -5,-0.3 -3,-0.2 0.708 94.9 67.8 -62.5 -25.6 99.0 34.3 46.0 376 399 A L T >< S+ 0 0 14 -4,-2.3 3,-1.3 -5,-0.2 5,-0.4 0.951 102.2 45.4 -62.9 -45.6 101.2 32.5 43.5 377 400 A A G X4 S+ 0 0 4 -3,-0.5 3,-2.1 -5,-0.3 6,-0.2 0.804 99.5 69.9 -68.4 -28.0 101.3 35.4 41.1 378 401 A T G 3< S+ 0 0 17 -4,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.597 84.0 70.8 -67.1 -8.5 102.0 37.9 43.9 379 402 A T G < S- 0 0 17 -3,-1.3 -1,-0.3 -4,-0.3 -2,-0.2 0.677 101.8-136.3 -75.6 -19.1 105.5 36.3 44.3 380 403 A T <> + 0 0 18 -3,-2.1 4,-3.2 -4,-0.2 5,-0.2 0.295 68.2 124.4 76.3 1.3 106.2 38.0 40.9 381 404 A Y H > + 0 0 0 -5,-0.4 4,-2.7 2,-0.2 5,-0.2 0.841 68.7 49.0 -59.3 -42.5 107.9 34.9 39.7 382 405 A Y H > S+ 0 0 12 -6,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.939 116.9 46.7 -60.1 -44.4 105.8 34.3 36.6 383 406 A Y H > S+ 0 0 1 -6,-0.2 4,-2.4 -38,-0.2 -2,-0.2 0.920 113.7 45.2 -62.1 -49.4 106.6 38.0 35.8 384 407 A L H X S+ 0 0 4 -4,-3.2 4,-2.6 2,-0.2 -2,-0.2 0.889 112.0 52.3 -66.0 -39.1 110.3 37.8 36.6 385 408 A A H X S+ 0 0 0 -4,-2.7 4,-0.8 -5,-0.2 -1,-0.2 0.919 111.5 47.1 -62.8 -42.9 110.7 34.6 34.6 386 409 A T H >X S+ 0 0 4 -4,-2.1 3,-0.8 -5,-0.2 4,-0.6 0.914 112.0 51.5 -64.4 -40.9 109.0 36.2 31.6 387 410 A T H >X S+ 0 0 0 -4,-2.4 3,-1.4 1,-0.2 4,-0.6 0.895 98.9 63.5 -64.2 -39.1 111.2 39.3 32.1 388 411 A S H 3< S+ 0 0 1 -4,-2.6 3,-0.2 1,-0.3 -1,-0.2 0.782 99.7 56.0 -57.6 -26.9 114.5 37.3 32.2 389 412 A Y H X< S+ 0 0 0 -4,-0.8 3,-1.7 -3,-0.8 6,-0.3 0.763 88.3 78.3 -75.8 -27.3 113.7 36.2 28.6 390 413 A L H << S+ 0 0 0 -3,-1.4 -1,-0.2 -4,-0.6 -2,-0.2 0.878 99.7 37.7 -49.8 -49.3 113.5 39.8 27.3 391 414 A G T 3< S+ 0 0 2 -4,-0.6 2,-0.9 -3,-0.2 -128,-0.6 0.315 90.2 106.0 -88.7 6.7 117.2 40.4 27.1 392 415 A M X - 0 0 1 -3,-1.7 3,-2.4 1,-0.1 -132,-0.1 -0.794 62.8-150.6 -91.8 106.9 118.0 36.9 25.9 393 416 A K T 3 S+ 0 0 149 -2,-0.9 -1,-0.1 1,-0.3 -4,-0.0 0.600 93.7 49.1 -49.8 -17.7 118.9 37.2 22.2 394 417 A S T 3 S+ 0 0 67 2,-0.1 2,-0.7 -5,-0.1 -1,-0.3 0.543 76.2 116.5-102.2 -9.6 117.7 33.7 21.5 395 418 A A < - 0 0 2 -3,-2.4 2,-0.1 -6,-0.3 -57,-0.1 -0.484 49.8-167.8 -65.7 106.9 114.3 33.9 23.2 396 419 A T > - 0 0 68 -2,-0.7 4,-1.5 1,-0.1 3,-0.5 -0.412 37.1 -99.6 -90.9 171.5 111.8 33.4 20.4 397 420 A E H > S+ 0 0 49 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.879 123.0 57.8 -56.8 -40.3 108.0 34.0 20.3 398 421 A Q H > S+ 0 0 119 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.870 102.5 54.1 -59.5 -38.3 107.5 30.2 20.7 399 422 A D H > S+ 0 0 16 -3,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.901 109.9 46.5 -64.7 -40.0 109.5 30.3 24.0 400 423 A F H X S+ 0 0 2 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.857 110.1 53.8 -69.9 -36.0 107.3 33.0 25.3 401 424 A E H X S+ 0 0 97 -4,-2.2 4,-0.7 2,-0.2 -2,-0.2 0.890 108.6 49.2 -65.3 -39.6 104.1 31.1 24.2 402 425 A W H >< S+ 0 0 44 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.943 111.0 50.5 -63.3 -45.5 105.4 28.0 26.1 403 426 A L H >< S+ 0 0 2 -4,-2.0 3,-1.5 1,-0.2 -2,-0.2 0.833 101.8 61.1 -63.1 -33.9 106.0 30.2 29.2 404 427 A S H 3< S+ 0 0 67 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.717 91.3 68.0 -68.1 -19.5 102.5 31.7 29.1 405 428 A K T << S- 0 0 177 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.404 112.8-116.1 -79.3 3.0 100.9 28.3 29.5 406 429 A N < - 0 0 51 -3,-1.5 -2,-0.1 1,-0.1 -3,-0.1 0.979 36.1-144.2 58.0 61.7 102.3 28.2 33.1 407 430 A P >> - 0 0 15 0, 0.0 4,-2.8 0, 0.0 3,-0.6 -0.181 18.6-112.1 -54.3 146.9 104.6 25.2 32.5 408 431 A K H 3> S+ 0 0 139 1,-0.3 4,-2.9 2,-0.2 5,-0.2 0.861 117.3 55.4 -51.3 -41.7 105.0 22.8 35.4 409 432 A I H 3> S+ 0 0 7 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.911 112.1 42.7 -60.8 -40.7 108.7 23.8 35.9 410 433 A L H <> S+ 0 0 0 -3,-0.6 4,-2.6 2,-0.2 -2,-0.2 0.942 112.6 53.4 -68.7 -46.6 107.7 27.4 36.2 411 434 A E H X S+ 0 0 52 -4,-2.8 4,-2.8 1,-0.2 -2,-0.2 0.907 109.6 49.1 -53.4 -46.1 104.7 26.6 38.4 412 435 A A H X S+ 0 0 1 -4,-2.9 4,-2.6 -5,-0.2 -1,-0.2 0.908 109.1 51.5 -62.5 -43.8 107.0 24.6 40.8 413 436 A S H X S+ 0 0 0 -4,-1.9 4,-1.9 -5,-0.2 -1,-0.2 0.923 112.6 46.8 -59.6 -43.9 109.5 27.5 41.0 414 437 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.928 110.6 51.5 -64.3 -46.4 106.6 29.8 41.9 415 438 A I H X S+ 0 0 34 -4,-2.8 4,-2.8 1,-0.2 5,-0.4 0.914 107.0 54.3 -57.1 -45.6 105.2 27.4 44.5 416 439 A I H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 5,-0.3 0.937 110.4 45.9 -55.6 -49.1 108.6 27.1 46.1 417 440 A C H X S+ 0 0 6 -4,-1.9 4,-2.5 -5,-0.2 -1,-0.2 0.939 115.3 48.5 -60.2 -46.1 108.9 30.9 46.5 418 441 A R H X S+ 0 0 19 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.963 114.2 40.2 -59.5 -62.0 105.3 31.1 47.8 419 442 A V H X S+ 0 0 0 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.850 118.5 47.9 -60.9 -35.7 105.3 28.4 50.5 420 443 A I H X S+ 0 0 34 -4,-1.9 4,-2.2 -5,-0.4 -1,-0.2 0.924 112.4 49.0 -71.6 -42.7 108.8 29.3 51.7 421 444 A D H X S+ 0 0 26 -4,-2.5 4,-3.2 -5,-0.3 5,-0.3 0.961 112.3 48.8 -59.5 -49.7 108.0 33.0 51.9 422 445 A D H X S+ 0 0 1 -4,-2.9 4,-0.8 1,-0.2 -1,-0.2 0.860 109.9 51.4 -58.5 -39.8 104.7 32.2 53.8 423 446 A T H < S+ 0 0 44 -4,-1.9 4,-0.3 -5,-0.2 -1,-0.2 0.906 117.4 39.7 -65.1 -39.8 106.6 29.9 56.2 424 447 A A H < S+ 0 0 57 -4,-2.2 3,-0.4 1,-0.2 4,-0.3 0.950 120.6 39.2 -75.6 -52.2 109.2 32.6 56.9 425 448 A T H X S+ 0 0 39 -4,-3.2 4,-2.5 1,-0.2 5,-0.3 0.423 86.0 103.4 -82.5 4.6 107.0 35.8 57.0 426 449 A Y H X S+ 0 0 3 -4,-0.8 4,-2.3 -5,-0.3 5,-0.2 0.918 79.7 47.0 -51.9 -56.1 104.1 34.2 58.9 427 450 A E H > S+ 0 0 122 -3,-0.4 4,-1.9 -4,-0.3 -1,-0.2 0.917 115.1 45.0 -54.1 -50.2 104.8 35.7 62.3 428 451 A V H > S+ 0 0 77 -4,-0.3 4,-0.6 1,-0.2 -1,-0.2 0.917 114.4 48.4 -62.1 -46.5 105.4 39.2 61.1 429 452 A E H <>S+ 0 0 32 -4,-2.5 5,-2.1 1,-0.2 3,-0.3 0.832 109.4 53.6 -66.3 -31.5 102.3 39.2 58.8 430 453 A K H ><5S+ 0 0 98 -4,-2.3 3,-1.9 -5,-0.3 -1,-0.2 0.923 105.9 50.8 -70.6 -43.1 100.0 37.8 61.5 431 454 A S H 3<5S+ 0 0 107 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.633 106.4 59.0 -68.2 -11.8 100.9 40.5 64.0 432 455 A R T 3<5S- 0 0 143 -4,-0.6 -1,-0.3 -3,-0.3 -2,-0.2 0.398 121.3-109.3 -92.9 -3.6 100.1 43.0 61.2 433 456 A G T < 5S+ 0 0 37 -3,-1.9 2,-2.5 1,-0.2 -3,-0.2 0.416 70.3 144.9 90.2 -1.2 96.6 41.6 61.0 434 457 A Q > < + 0 0 24 -5,-2.1 3,-1.0 1,-0.2 -1,-0.2 -0.415 14.0 167.3 -71.8 75.0 97.1 39.8 57.6 435 458 A I T 3 + 0 0 66 -2,-2.5 -1,-0.2 1,-0.3 -5,-0.1 0.497 64.6 76.8 -69.8 -0.5 94.9 36.9 58.4 436 459 A A T 3 + 0 0 15 -7,-0.1 -1,-0.3 -71,-0.1 2,-0.2 0.061 67.7 135.7 -95.7 22.4 95.0 35.9 54.7 437 460 A T X> - 0 0 4 -3,-1.0 4,-2.4 1,-0.1 3,-0.7 -0.484 67.2-116.2 -72.6 144.0 98.5 34.5 55.2 438 461 A G H 3> S+ 0 0 0 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.869 115.8 48.4 -44.4 -50.9 99.3 31.2 53.5 439 462 A I H 3> S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.863 110.8 52.4 -61.8 -35.5 99.9 29.4 56.8 440 463 A E H <> S+ 0 0 24 -3,-0.7 4,-2.4 2,-0.2 5,-0.2 0.963 110.9 45.5 -64.4 -52.5 96.7 30.8 58.3 441 464 A C H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -73,-0.4 0.902 112.6 53.4 -56.5 -43.1 94.6 29.6 55.3 442 465 A C H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.3 5,-0.3 0.922 108.5 48.3 -59.7 -46.8 96.3 26.3 55.6 443 466 A M H X>S+ 0 0 20 -4,-2.4 4,-2.2 2,-0.2 5,-1.6 0.937 117.4 40.0 -60.9 -50.8 95.5 25.9 59.3 444 467 A R H <5S+ 0 0 186 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.936 113.9 52.7 -65.5 -47.6 91.8 26.7 58.9 445 468 A D H <5S+ 0 0 74 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.870 125.5 25.1 -57.1 -41.8 91.3 24.8 55.7 446 469 A Y H <5S- 0 0 122 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.616 103.6-123.2 -98.7 -16.9 92.8 21.6 57.0 447 470 A G T <5 + 0 0 64 -4,-2.2 2,-0.3 -5,-0.3 -3,-0.2 0.973 63.4 133.5 71.0 57.1 92.1 22.1 60.7 448 471 A I < - 0 0 32 -5,-1.6 -1,-0.2 -6,-0.1 -2,-0.1 -0.873 58.0 -91.1-136.2 165.8 95.7 21.8 61.9 449 472 A S > - 0 0 67 -2,-0.3 4,-2.6 1,-0.1 3,-0.2 -0.364 40.1-109.3 -74.0 157.1 98.4 23.4 64.1 450 473 A T H > S+ 0 0 48 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.903 121.7 54.5 -51.2 -44.4 100.8 26.1 62.8 451 474 A K H > S+ 0 0 179 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.921 110.7 44.4 -56.5 -46.1 103.6 23.5 63.1 452 475 A E H > S+ 0 0 107 2,-0.2 4,-1.9 -3,-0.2 -1,-0.2 0.837 111.7 53.7 -69.9 -32.9 101.6 21.0 60.9 453 476 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.936 110.3 46.0 -67.0 -46.3 100.7 23.7 58.4 454 477 A M H X S+ 0 0 45 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.868 110.1 55.0 -64.5 -35.3 104.3 24.7 57.9 455 478 A A H X S+ 0 0 43 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.902 108.6 48.2 -64.5 -39.4 105.2 21.0 57.6 456 479 A K H X S+ 0 0 66 -4,-1.9 4,-1.7 1,-0.2 -2,-0.2 0.895 110.4 51.7 -67.4 -39.3 102.6 20.7 54.9 457 480 A F H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.884 107.8 51.5 -65.2 -38.0 104.1 23.8 53.2 458 481 A Q H X S+ 0 0 110 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.921 107.0 54.0 -65.8 -39.9 107.6 22.4 53.3 459 482 A N H X S+ 0 0 84 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.871 106.5 52.5 -60.3 -37.0 106.3 19.1 51.7 460 483 A M H X S+ 0 0 49 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.902 108.8 49.2 -65.8 -40.1 104.8 21.2 48.9 461 484 A A H X S+ 0 0 5 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.904 111.4 49.9 -64.9 -40.3 108.2 22.9 48.3 462 485 A E H X S+ 0 0 68 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.902 110.8 48.9 -64.2 -42.9 109.9 19.4 48.3 463 486 A T H X S+ 0 0 64 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.911 110.1 52.5 -62.6 -42.4 107.3 18.2 45.7 464 487 A A H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.893 105.6 53.7 -62.2 -41.9 108.0 21.3 43.7 465 488 A W H X S+ 0 0 6 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.919 107.4 50.8 -61.2 -41.3 111.7 20.7 43.7 466 489 A K H X S+ 0 0 34 -4,-1.8 4,-2.2 1,-0.2 -1,-0.2 0.884 109.2 52.4 -63.0 -37.0 111.2 17.2 42.3 467 490 A D H X S+ 0 0 22 -4,-1.8 4,-2.5 2,-0.2 -1,-0.2 0.901 108.3 49.8 -65.0 -41.1 109.0 18.7 39.6 468 491 A I H X S+ 0 0 0 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.950 109.7 51.6 -62.1 -45.6 111.8 21.1 38.7 469 492 A N H >< S+ 0 0 11 -4,-2.6 3,-0.6 1,-0.2 4,-0.4 0.889 112.0 46.4 -58.6 -40.1 114.2 18.2 38.5 470 493 A E H >< S+ 0 0 65 -4,-2.2 3,-1.3 1,-0.2 -1,-0.2 0.886 106.3 59.2 -69.6 -38.3 111.8 16.3 36.2 471 494 A G H 3< S+ 0 0 24 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.680 100.6 57.2 -64.0 -19.2 111.3 19.5 34.1 472 495 A L T << S+ 0 0 14 -4,-1.0 -1,-0.3 -3,-0.6 -2,-0.2 0.632 84.4 105.7 -86.5 -14.9 115.0 19.5 33.4 473 496 A L S < S- 0 0 25 -3,-1.3 -377,-0.2 -4,-0.4 -378,-0.1 -0.406 77.7 -70.3 -72.5 139.4 115.1 16.0 31.9 474 497 A R S S+ 0 0 100 -379,-2.6 -377,-0.2 1,-0.1 -1,-0.1 -0.417 112.8 49.6 -70.6 144.8 115.4 15.5 28.1 475 498 A P S S- 0 0 131 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.394 80.6-169.1 -81.7 131.3 113.6 16.0 25.9 476 499 A T - 0 0 35 -4,-0.1 -4,-0.1 1,-0.1 -2,-0.1 -0.588 27.3-128.5 -85.3 146.5 112.9 19.5 27.2 477 500 A P S S+ 0 0 86 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.801 94.3 14.0 -61.8 -33.1 110.1 21.6 25.7 478 501 A V S S- 0 0 13 1,-0.1 5,-0.1 -76,-0.0 -2,-0.1 -0.851 108.7 -66.3-133.6 169.8 112.4 24.5 25.1 479 502 A S > - 0 0 73 -2,-0.3 3,-2.6 1,-0.1 4,-0.5 -0.288 44.9-117.0 -60.1 145.9 116.2 24.8 25.1 480 503 A T G >> S+ 0 0 74 1,-0.3 4,-2.2 2,-0.2 3,-1.5 0.796 112.2 74.6 -52.8 -29.5 117.8 24.3 28.5 481 504 A E G 34 S+ 0 0 51 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.816 98.8 44.8 -54.5 -29.6 119.0 27.9 28.2 482 505 A F G <4 S+ 0 0 4 -3,-2.6 4,-0.4 2,-0.1 -1,-0.3 0.538 109.9 54.0 -94.8 -6.5 115.4 28.9 29.0 483 506 A L T <> S+ 0 0 0 -3,-1.5 4,-2.2 -4,-0.5 3,-0.5 0.793 94.6 68.7 -93.1 -34.4 114.9 26.5 31.9 484 507 A T H X S+ 0 0 48 -4,-2.2 4,-3.3 1,-0.2 5,-0.2 0.865 94.2 55.2 -53.9 -42.9 118.0 27.7 33.8 485 508 A P H > S+ 0 0 3 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.902 110.1 47.0 -59.5 -38.9 116.5 31.1 34.7 486 509 A I H > S+ 0 0 0 -3,-0.5 4,-1.6 -4,-0.4 -2,-0.2 0.913 113.5 48.1 -67.1 -43.7 113.4 29.4 36.2 487 510 A L H X S+ 0 0 11 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.916 111.4 51.1 -62.4 -43.3 115.7 27.0 38.1 488 511 A N H X S+ 0 0 7 -4,-3.3 4,-2.5 1,-0.2 -2,-0.2 0.856 103.8 57.3 -65.6 -33.7 117.8 29.9 39.3 489 512 A L H X S+ 0 0 2 -4,-2.0 4,-1.2 1,-0.2 -1,-0.2 0.904 108.2 47.6 -63.1 -39.3 114.8 31.8 40.5 490 513 A A H X S+ 0 0 0 -4,-1.6 4,-1.5 1,-0.2 3,-0.3 0.897 109.6 53.6 -67.5 -39.5 114.0 28.8 42.8 491 514 A R H X S+ 0 0 32 -4,-2.0 4,-1.7 1,-0.2 -312,-0.3 0.914 102.2 58.0 -61.3 -41.5 117.6 28.8 43.9 492 515 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.870 101.3 57.4 -56.9 -36.6 117.4 32.4 44.9 493 516 A V H X S+ 0 0 0 -4,-1.2 4,-2.0 -3,-0.3 -1,-0.2 0.952 103.6 51.7 -58.0 -51.4 114.5 31.5 47.2 494 517 A E H < S+ 0 0 44 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.860 114.4 43.7 -54.9 -38.4 116.7 29.0 49.1 495 518 A V H >< S+ 0 0 4 -4,-1.7 3,-0.6 1,-0.2 -1,-0.2 0.839 112.2 51.0 -77.8 -36.3 119.3 31.7 49.6 496 519 A T H 3< S+ 0 0 25 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.747 117.4 39.1 -74.5 -23.9 116.9 34.5 50.6 497 520 A Y T 3< 0 0 63 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.1 -0.355 360.0 360.0-125.4 54.5 115.1 32.4 53.2 498 521 A I < 0 0 146 -3,-0.6 -1,-0.1 2,-0.0 -2,-0.1 0.878 360.0 360.0 -84.5 360.0 117.7 30.3 55.1 499 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 500 533 A V 0 0 120 0, 0.0 4,-0.4 0, 0.0 -3,-0.0 0.000 360.0 360.0 360.0 -41.8 120.5 38.6 54.7 501 534 A L >> + 0 0 11 1,-0.1 4,-2.4 2,-0.1 3,-0.6 0.752 360.0 89.5 -86.2 -22.7 121.8 39.5 51.2 502 535 A K H 3> S+ 0 0 135 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.848 85.4 48.3 -41.1 -58.2 124.6 41.7 52.5 503 536 A P H 3> S+ 0 0 64 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.899 114.5 47.3 -55.3 -40.3 127.3 39.0 52.8 504 537 A H H <> S+ 0 0 38 -3,-0.6 4,-2.7 -4,-0.4 5,-0.3 0.899 110.4 51.2 -68.2 -40.8 126.6 37.7 49.3 505 538 A I H X>S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.6 0.889 112.5 47.9 -62.7 -39.5 126.6 41.2 47.8 506 539 A I H X>S+ 0 0 47 -4,-2.5 5,-2.9 -5,-0.3 4,-1.3 0.937 115.7 42.9 -66.6 -46.4 130.0 41.8 49.5 507 540 A N H <5S+ 0 0 63 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.817 125.5 34.4 -71.2 -33.9 131.4 38.5 48.3 508 541 A L H <5S+ 0 0 3 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.853 133.9 17.9 -90.6 -37.8 130.0 38.8 44.8 509 542 A L H <5S+ 0 0 0 -4,-3.1 -3,-0.2 -5,-0.3 -2,-0.2 0.497 128.7 35.3-114.5 -9.3 130.1 42.6 44.0 510 543 A V T <