==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-DEC-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-MAY-12 4ASQ . COMPND 2 MOLECULE: ANGIOTENSIN-CONVERTING ENZYME; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR M.AKIF,G.MASUYER,E.D.STURROCK,R.E.ISAAC,K.R.ACHARYA . 601 2 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24263.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 432 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 8 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 1.3 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 1 0.2 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 . 23 3.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 70 11.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 294 48.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.3 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 2 0 4 0 1 1 0 2 0 1 1 3 1 1 0 0 4 0 0 0 1 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 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 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 17 A A > 0 0 115 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 131.9 14.4 37.4 -44.4 2 18 A L H > + 0 0 86 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.800 360.0 58.4 -72.8 -31.7 11.0 36.5 -43.1 3 19 A V H > S+ 0 0 117 2,-0.2 4,-1.1 1,-0.2 -1,-0.2 0.915 110.1 42.9 -63.7 -44.8 11.1 33.0 -44.6 4 20 A K H > S+ 0 0 136 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.887 114.1 51.4 -67.4 -41.1 14.3 32.2 -42.6 5 21 A E H X S+ 0 0 42 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.865 104.3 56.1 -66.8 -38.4 13.0 33.8 -39.4 6 22 A E H X S+ 0 0 35 -4,-2.2 4,-1.6 2,-0.2 -1,-0.2 0.840 106.8 51.2 -63.5 -34.3 9.7 31.9 -39.5 7 23 A I H X S+ 0 0 102 -4,-1.1 4,-1.4 2,-0.2 -1,-0.2 0.930 112.6 45.4 -64.3 -46.9 11.8 28.6 -39.6 8 24 A Q H X S+ 0 0 100 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.842 109.3 56.5 -64.2 -36.2 13.8 29.8 -36.6 9 25 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.861 103.1 54.0 -64.1 -38.4 10.5 30.9 -34.8 10 26 A K H X S+ 0 0 132 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.898 111.3 45.1 -62.0 -43.1 9.1 27.4 -35.2 11 27 A E H X S+ 0 0 117 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.854 111.7 53.7 -68.0 -37.8 12.2 26.0 -33.4 12 28 A Y H X S+ 0 0 51 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.917 110.0 47.5 -60.2 -46.3 12.0 28.8 -30.8 13 29 A L H X S+ 0 0 2 -4,-2.6 4,-3.0 2,-0.2 5,-0.2 0.885 108.4 53.0 -65.1 -42.8 8.3 27.8 -30.1 14 30 A E H X S+ 0 0 120 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.904 114.1 42.7 -63.1 -41.6 9.0 24.1 -29.7 15 31 A N H X S+ 0 0 100 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.902 116.1 48.2 -68.5 -43.5 11.7 24.6 -27.2 16 32 A L H X S+ 0 0 11 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.897 107.7 54.2 -66.3 -43.9 9.8 27.3 -25.3 17 33 A N H X S+ 0 0 8 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.913 110.6 47.4 -54.7 -44.9 6.6 25.3 -25.1 18 34 A K H X S+ 0 0 121 -4,-1.4 4,-1.7 -5,-0.2 -1,-0.2 0.870 112.7 49.3 -65.7 -38.1 8.6 22.4 -23.5 19 35 A E H X S+ 0 0 79 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.903 110.7 49.8 -65.4 -43.7 10.3 24.8 -21.1 20 36 A L H X S+ 0 0 1 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.869 108.7 52.8 -63.7 -38.7 6.9 26.4 -20.1 21 37 A A H X S+ 0 0 11 -4,-2.1 4,-1.8 -5,-0.2 -1,-0.2 0.920 111.4 46.2 -61.2 -44.6 5.4 22.9 -19.5 22 38 A K H X S+ 0 0 130 -4,-1.7 4,-1.2 2,-0.2 -2,-0.2 0.879 114.1 47.0 -67.9 -41.1 8.3 22.0 -17.2 23 39 A R H X S+ 0 0 84 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.847 111.6 51.2 -68.4 -36.4 8.2 25.3 -15.2 24 40 A T H X S+ 0 0 15 -4,-2.2 4,-3.0 1,-0.2 -2,-0.2 0.839 101.8 62.4 -70.9 -34.1 4.4 25.1 -14.9 25 41 A N H X S+ 0 0 20 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.917 104.3 48.0 -51.8 -47.5 4.8 21.5 -13.5 26 42 A V H X S+ 0 0 73 -4,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.906 113.2 46.5 -63.0 -46.1 6.8 23.0 -10.6 27 43 A E H X S+ 0 0 46 -4,-1.5 4,-2.1 1,-0.2 -2,-0.2 0.908 112.3 51.4 -61.3 -43.8 4.2 25.7 -9.9 28 44 A T H X S+ 0 0 15 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.877 106.9 53.2 -63.2 -40.5 1.4 23.2 -10.1 29 45 A E H X S+ 0 0 63 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.904 111.4 45.7 -61.1 -42.9 3.1 20.8 -7.6 30 46 A A H X S+ 0 0 13 -4,-1.7 4,-1.6 2,-0.2 16,-0.3 0.850 113.2 49.8 -67.9 -37.3 3.4 23.7 -5.1 31 47 A A H X S+ 0 0 17 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.880 111.0 50.2 -67.6 -40.0 -0.3 24.7 -5.7 32 48 A W H X S+ 0 0 24 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.910 108.7 51.9 -61.1 -45.8 -1.3 21.1 -5.2 33 49 A A H X S+ 0 0 36 -4,-2.2 4,-0.5 1,-0.2 -1,-0.2 0.853 113.0 45.2 -61.7 -37.8 0.6 20.8 -2.0 34 50 A Y H >< S+ 0 0 2 -4,-1.6 3,-0.6 8,-0.2 -2,-0.2 0.918 111.9 49.6 -72.1 -47.0 -1.1 24.0 -0.6 35 51 A G H 3< S+ 0 0 6 -4,-2.4 284,-2.6 1,-0.2 3,-0.3 0.783 116.2 43.1 -64.2 -29.7 -4.6 23.1 -1.7 36 52 A S H 3< S+ 0 0 10 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.564 131.3 22.8 -90.6 -11.6 -4.4 19.6 -0.1 37 53 A N S << S- 0 0 60 -3,-0.6 2,-0.7 -4,-0.5 -1,-0.3 -0.624 76.8-154.4-160.0 85.1 -2.6 20.9 3.0 38 54 A I + 0 0 9 279,-2.8 279,-0.4 -3,-0.3 2,-0.3 -0.565 35.2 140.5 -75.2 108.7 -3.2 24.6 3.9 39 55 A T > - 0 0 49 -2,-0.7 4,-2.0 277,-0.1 5,-0.2 -0.941 62.5-113.1-138.4 162.2 -0.3 26.0 6.0 40 56 A D H > S+ 0 0 128 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.863 118.8 52.4 -61.1 -37.3 1.7 29.3 6.1 41 57 A E H > S+ 0 0 124 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.909 110.7 45.4 -64.7 -46.1 4.8 27.4 4.9 42 58 A N H > S+ 0 0 24 2,-0.2 4,-2.3 1,-0.2 -8,-0.2 0.810 111.1 53.7 -69.7 -32.3 2.9 25.9 1.9 43 59 A E H X S+ 0 0 39 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.928 109.1 49.2 -63.0 -47.7 1.4 29.2 1.0 44 60 A K H X S+ 0 0 122 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.896 113.0 46.9 -58.8 -45.2 4.8 30.8 1.0 45 61 A K H X S+ 0 0 101 -4,-2.0 4,-1.9 2,-0.2 5,-0.2 0.920 112.8 48.7 -64.0 -47.9 6.2 28.1 -1.3 46 62 A K H X S+ 0 0 42 -4,-2.3 4,-1.7 -16,-0.3 -2,-0.2 0.915 115.6 43.6 -57.5 -48.0 3.3 28.2 -3.7 47 63 A N H X S+ 0 0 12 -4,-2.5 4,-1.7 2,-0.2 -1,-0.2 0.793 111.5 53.0 -73.1 -31.2 3.4 32.0 -4.0 48 64 A E H X S+ 0 0 109 -4,-1.9 4,-1.4 -5,-0.2 -1,-0.2 0.871 110.8 46.6 -71.8 -37.9 7.2 32.3 -4.3 49 65 A I H X S+ 0 0 45 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.865 111.0 52.9 -71.2 -36.6 7.3 29.8 -7.2 50 66 A S H X S+ 0 0 6 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.896 107.2 52.0 -62.6 -42.0 4.4 31.6 -8.9 51 67 A A H X S+ 0 0 35 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.864 109.1 51.3 -60.8 -38.4 6.4 34.8 -8.6 52 68 A E H X S+ 0 0 124 -4,-1.4 4,-1.6 2,-0.2 -2,-0.2 0.903 111.5 45.7 -65.6 -44.8 9.3 33.1 -10.3 53 69 A L H X S+ 0 0 17 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.890 109.9 54.6 -66.8 -40.2 7.2 31.8 -13.2 54 70 A A H X S+ 0 0 3 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.894 106.1 53.1 -57.8 -42.1 5.6 35.2 -13.6 55 71 A K H X S+ 0 0 118 -4,-1.8 4,-1.3 1,-0.2 -1,-0.2 0.897 110.2 47.1 -59.5 -43.8 9.1 36.7 -13.9 56 72 A F H X S+ 0 0 24 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.885 108.0 55.9 -65.8 -40.8 9.9 34.2 -16.7 57 73 A M H X S+ 0 0 37 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.884 103.4 55.5 -58.0 -42.2 6.6 34.9 -18.5 58 74 A K H X S+ 0 0 68 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.897 108.0 48.2 -55.2 -45.4 7.6 38.6 -18.6 59 75 A E H X S+ 0 0 103 -4,-1.3 4,-2.2 2,-0.2 -2,-0.2 0.873 110.9 51.5 -64.3 -39.7 10.8 37.7 -20.4 60 76 A V H X S+ 0 0 2 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.948 109.3 48.6 -60.7 -51.9 8.9 35.5 -22.8 61 77 A A H < S+ 0 0 17 -4,-2.8 4,-0.4 1,-0.2 -2,-0.2 0.859 112.9 49.2 -57.9 -38.6 6.4 38.3 -23.7 62 78 A S H >< S+ 0 0 68 -4,-1.9 3,-1.1 -5,-0.2 -1,-0.2 0.883 107.5 55.0 -66.1 -41.1 9.4 40.6 -24.2 63 79 A D H >< S+ 0 0 56 -4,-2.2 3,-1.5 1,-0.2 4,-0.3 0.748 93.5 69.3 -66.0 -26.6 11.1 38.1 -26.4 64 80 A T G >< S+ 0 0 5 -4,-1.5 3,-1.2 1,-0.3 5,-0.5 0.765 88.6 65.3 -63.8 -25.0 8.1 37.8 -28.8 65 81 A T G < S+ 0 0 104 -3,-1.1 -1,-0.3 -4,-0.4 -2,-0.2 0.653 89.8 66.1 -71.2 -16.2 8.8 41.4 -30.0 66 82 A K G < S+ 0 0 139 -3,-1.5 2,-0.4 -4,-0.2 -1,-0.3 0.621 96.1 69.2 -77.1 -15.0 12.1 40.0 -31.4 67 83 A F S < S- 0 0 33 -3,-1.2 2,-1.7 -4,-0.3 3,-0.3 -0.900 78.7-139.3-108.5 135.0 10.0 38.0 -33.9 68 84 A Q > + 0 0 102 -2,-0.4 3,-1.9 1,-0.2 4,-0.3 -0.322 46.5 154.9 -80.2 53.5 7.9 39.5 -36.7 69 85 A W G > + 0 0 17 -2,-1.7 3,-1.4 -5,-0.5 -1,-0.2 0.771 60.6 60.4 -63.3 -31.7 5.2 37.0 -35.8 70 86 A R G 3 S+ 0 0 181 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.677 103.0 56.0 -66.5 -17.0 2.2 39.0 -37.2 71 87 A S G < S+ 0 0 66 -3,-1.9 -1,-0.2 -69,-0.0 -2,-0.2 0.468 85.7 115.5 -91.9 -4.8 4.0 38.8 -40.6 72 88 A Y < - 0 0 5 -3,-1.4 -69,-0.1 -4,-0.3 6,-0.0 -0.235 63.1-139.8 -74.0 155.3 4.2 35.0 -40.7 73 89 A Q S S+ 0 0 164 -70,-0.0 2,-0.5 4,-0.0 -1,-0.1 0.857 79.5 86.4 -76.4 -40.0 2.5 32.7 -43.2 74 90 A S > - 0 0 36 1,-0.2 4,-2.1 2,-0.1 5,-0.2 -0.531 57.2-164.6 -74.4 116.4 1.6 30.0 -40.6 75 91 A E H > S+ 0 0 137 -2,-0.5 4,-2.0 1,-0.2 -1,-0.2 0.852 93.6 55.9 -61.5 -35.8 -1.7 30.6 -38.8 76 92 A D H > S+ 0 0 71 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.921 107.6 45.7 -62.9 -48.8 -0.6 28.0 -36.3 77 93 A L H > S+ 0 0 9 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.912 112.9 50.6 -62.3 -44.4 2.7 29.8 -35.5 78 94 A K H X S+ 0 0 47 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.874 108.5 52.8 -60.3 -40.2 0.9 33.2 -35.2 79 95 A R H X S+ 0 0 52 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.891 109.9 48.2 -64.0 -41.3 -1.7 31.7 -32.8 80 96 A Q H X S+ 0 0 10 -4,-1.9 4,-1.7 2,-0.2 -2,-0.2 0.921 112.6 47.8 -64.9 -46.8 1.1 30.3 -30.5 81 97 A F H X S+ 0 0 0 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.896 109.1 54.1 -60.8 -42.2 2.9 33.6 -30.5 82 98 A K H >X S+ 0 0 99 -4,-2.5 3,-0.8 1,-0.2 4,-0.8 0.921 106.6 52.1 -57.9 -45.5 -0.3 35.5 -29.7 83 99 A A H >< S+ 0 0 40 -4,-1.9 3,-0.7 1,-0.2 -1,-0.2 0.872 106.0 55.1 -57.1 -39.7 -0.9 33.2 -26.7 84 100 A L H 3< S+ 0 0 5 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.703 100.3 59.3 -68.8 -22.3 2.6 34.0 -25.4 85 101 A T H << S+ 0 0 43 -4,-1.0 2,-0.9 -3,-0.8 -1,-0.2 0.734 84.2 90.6 -77.5 -22.5 2.0 37.8 -25.5 86 102 A K << + 0 0 75 -4,-0.8 -1,-0.1 -3,-0.7 4,-0.1 -0.654 48.4 168.9 -83.0 103.6 -0.9 37.4 -23.0 87 103 A L > - 0 0 39 -2,-0.9 3,-1.5 1,-0.2 -1,-0.2 0.754 11.6-175.2 -87.0 -28.8 0.6 37.8 -19.6 88 104 A G G > S- 0 0 38 1,-0.3 3,-1.7 2,-0.2 -1,-0.2 -0.434 75.2 -7.2 61.0-134.6 -2.5 38.1 -17.4 89 105 A Y G > S+ 0 0 54 1,-0.3 3,-2.1 2,-0.2 -1,-0.3 0.776 126.3 75.6 -60.3 -27.9 -1.6 38.8 -13.8 90 106 A A G < S+ 0 0 8 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.573 79.3 73.4 -63.9 -10.0 2.1 38.2 -14.7 91 107 A A G < S+ 0 0 16 -3,-1.7 -1,-0.3 -34,-0.0 -2,-0.2 0.684 77.8 101.5 -74.2 -19.9 2.1 41.7 -16.3 92 108 A L S < S- 0 0 0 -3,-2.1 5,-0.1 -4,-0.2 83,-0.0 -0.311 87.8 -93.6 -65.6 146.2 2.0 43.3 -12.9 93 109 A P > - 0 0 60 0, 0.0 4,-2.6 0, 0.0 3,-0.4 -0.238 45.8-100.6 -53.9 151.3 5.2 44.8 -11.3 94 110 A E H > S+ 0 0 139 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.841 122.2 43.7 -44.0 -51.1 7.1 42.3 -9.1 95 111 A D H > S+ 0 0 129 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.863 113.7 50.8 -67.3 -38.7 5.7 43.8 -5.8 96 112 A D H > S+ 0 0 24 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.862 109.6 50.5 -67.0 -38.7 2.1 44.1 -7.1 97 113 A Y H X S+ 0 0 25 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.895 110.3 50.1 -65.0 -41.5 2.1 40.5 -8.3 98 114 A A H X S+ 0 0 38 -4,-1.9 4,-1.9 -5,-0.3 -2,-0.2 0.886 111.0 49.4 -63.6 -40.7 3.4 39.3 -4.9 99 115 A E H X S+ 0 0 72 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.893 109.8 51.0 -65.3 -42.3 0.6 41.3 -3.1 100 116 A L H X S+ 0 0 0 -4,-2.2 4,-2.9 2,-0.2 -2,-0.2 0.915 109.6 50.0 -62.1 -44.6 -2.1 39.9 -5.4 101 117 A L H X S+ 0 0 15 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.888 111.4 49.2 -59.5 -41.3 -0.9 36.3 -4.7 102 118 A D H X S+ 0 0 86 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.863 112.8 48.5 -64.3 -37.8 -1.0 37.1 -0.9 103 119 A T H X S+ 0 0 14 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.916 111.6 48.6 -68.6 -45.2 -4.5 38.6 -1.4 104 120 A L H X S+ 0 0 31 -4,-2.9 4,-2.4 2,-0.2 5,-0.2 0.889 112.7 46.5 -63.5 -43.7 -5.8 35.5 -3.4 105 121 A S H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.860 109.2 56.6 -69.2 -33.6 -4.4 33.0 -0.9 106 122 A A H X S+ 0 0 29 -4,-1.6 4,-1.5 -5,-0.2 -2,-0.2 0.888 111.6 42.7 -61.4 -40.9 -5.9 35.0 2.0 107 123 A M H X S+ 0 0 0 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.904 116.2 46.1 -73.8 -43.6 -9.4 34.8 0.4 108 124 A E H X S+ 0 0 30 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.886 114.3 48.3 -68.0 -38.6 -9.2 31.1 -0.6 109 125 A S H X S+ 0 0 19 -4,-2.6 4,-1.8 2,-0.2 -1,-0.2 0.864 108.7 54.3 -69.3 -37.2 -7.8 30.1 2.8 110 126 A N H X S+ 0 0 46 -4,-1.5 4,-0.6 -5,-0.2 3,-0.2 0.955 111.1 45.4 -56.9 -52.7 -10.5 32.1 4.6 111 127 A F H >< S+ 0 0 19 -4,-2.0 3,-1.0 1,-0.2 -2,-0.2 0.910 114.3 48.3 -55.6 -48.0 -13.2 30.3 2.6 112 128 A A H 3< S+ 0 0 22 -4,-2.2 206,-0.3 1,-0.2 -1,-0.2 0.770 111.9 49.7 -67.6 -27.8 -11.6 26.9 3.2 113 129 A K H 3< S+ 0 0 88 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.438 77.7 131.4 -93.4 -1.8 -11.1 27.5 7.0 114 130 A V << + 0 0 10 -3,-1.0 15,-0.5 -4,-0.6 2,-0.4 -0.313 29.0 174.2 -57.8 125.2 -14.7 28.6 7.7 115 131 A K E -A 128 0A 76 13,-0.2 2,-0.3 37,-0.1 13,-0.2 -0.997 8.7-166.4-131.6 138.8 -16.2 26.8 10.7 116 132 A V E -A 127 0A 1 11,-2.6 11,-1.9 -2,-0.4 2,-0.3 -0.809 24.4-104.6-120.2 164.4 -19.6 27.5 12.4 117 133 A a - 0 0 34 -2,-0.3 8,-0.3 8,-0.2 5,-0.2 -0.641 43.4 -96.5 -87.9 145.5 -21.3 26.5 15.6 118 134 A D - 0 0 34 6,-3.0 6,-0.1 3,-0.8 -1,-0.1 -0.345 24.3-134.1 -59.6 134.3 -24.0 23.8 15.8 119 135 A Y S S+ 0 0 83 1,-0.2 3,-0.2 3,-0.1 -1,-0.1 0.824 108.6 33.6 -56.8 -35.3 -27.5 25.3 15.8 120 136 A K S S+ 0 0 152 1,-0.2 2,-0.4 4,-0.1 -1,-0.2 0.592 123.8 45.6 -97.9 -16.2 -28.5 22.9 18.6 121 137 A D > - 0 0 75 3,-0.2 3,-1.7 1,-0.1 -3,-0.8 -0.821 58.2-173.8-136.3 94.9 -25.1 22.9 20.4 122 138 A S T 3 S+ 0 0 109 -2,-0.4 -1,-0.1 1,-0.3 -3,-0.1 0.561 86.7 58.8 -67.3 -8.8 -23.4 26.2 20.9 123 139 A T T 3 S+ 0 0 116 1,-0.1 2,-0.9 -6,-0.1 -1,-0.3 0.617 88.5 78.9 -92.7 -16.1 -20.2 24.5 22.3 124 140 A K < + 0 0 90 -3,-1.7 -6,-3.0 -6,-0.1 3,-0.2 -0.808 51.7 157.5 -96.3 99.3 -19.7 22.4 19.1 125 141 A a + 0 0 57 -2,-0.9 -8,-0.2 -8,-0.3 -1,-0.1 -0.194 40.6 95.3-120.5 41.3 -18.0 24.8 16.6 126 142 A D + 0 0 86 -11,-0.1 2,-0.7 2,-0.1 -1,-0.2 0.008 45.5 132.5-119.7 26.3 -16.2 22.6 14.1 127 143 A L E -A 116 0A 8 -11,-1.9 -11,-2.6 -3,-0.2 2,-0.2 -0.722 36.7-166.3 -85.1 114.9 -18.9 22.4 11.4 128 144 A A E > -A 115 0A 8 -2,-0.7 5,-2.6 -13,-0.2 6,-0.3 -0.594 32.8-112.4 -95.0 161.0 -17.4 23.1 8.0 129 145 A L T >S+ 0 0 19 -15,-0.5 5,-2.6 1,-0.2 6,-0.3 0.950 99.2 75.4 -54.5 -52.8 -19.3 23.8 4.8 130 146 A D T 5S- 0 0 27 1,-0.2 -1,-0.2 3,-0.2 190,-0.0 -0.930 121.1 -15.3-108.0 111.8 -18.2 20.5 3.3 131 147 A P T >5S+ 0 0 35 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 -0.997 134.4 49.5-104.7 -10.7 -19.8 18.3 4.5 132 148 A E H >5S+ 0 0 67 1,-0.2 4,-1.4 2,-0.2 -3,-0.2 0.900 115.3 35.1 -59.6 -55.3 -21.5 19.6 7.7 133 149 A I H > - 0 0 66 1,-0.1 4,-2.5 2,-0.0 3,-0.4 -0.872 57.2-158.8 -95.7 103.5 -36.7 23.8 9.5 143 159 A H H > S+ 0 0 68 -2,-0.8 4,-2.0 1,-0.2 -1,-0.1 0.792 89.2 50.0 -58.8 -33.1 -36.7 27.3 8.1 144 160 A E H > S+ 0 0 125 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.878 110.5 49.4 -73.7 -37.8 -35.2 28.9 11.2 145 161 A E H > S+ 0 0 22 -3,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.931 112.0 49.3 -61.8 -47.3 -32.4 26.3 11.3 146 162 A L H X S+ 0 0 3 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.906 110.4 50.6 -57.4 -44.7 -31.7 27.0 7.6 147 163 A A H X S+ 0 0 20 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.854 107.5 54.4 -64.2 -37.7 -31.7 30.7 8.2 148 164 A Y H X S+ 0 0 58 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.945 111.4 43.1 -59.6 -51.3 -29.2 30.3 11.1 149 165 A Y H X S+ 0 0 3 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.846 111.8 55.1 -67.8 -34.7 -26.7 28.4 9.0 150 166 A W H X S+ 0 0 2 -4,-2.2 4,-2.5 -5,-0.2 5,-0.2 0.959 112.1 42.9 -58.4 -52.7 -27.1 30.8 6.1 151 167 A R H X S+ 0 0 101 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.921 113.9 50.2 -62.6 -47.4 -26.3 33.8 8.2 152 168 A E H X S+ 0 0 49 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.913 114.8 43.8 -58.9 -45.5 -23.4 32.2 10.0 153 169 A F H X S+ 0 0 0 -4,-2.3 4,-3.2 2,-0.2 5,-0.5 0.929 114.1 47.3 -67.5 -48.4 -21.7 31.0 6.8 154 170 A Y H X>S+ 0 0 5 -4,-2.5 4,-1.8 1,-0.2 5,-1.5 0.871 111.0 52.7 -63.3 -38.0 -22.2 34.3 4.8 155 171 A D H <>S+ 0 0 54 -4,-2.3 5,-1.2 -5,-0.2 -1,-0.2 0.891 119.5 34.9 -61.0 -39.7 -20.9 36.4 7.7 156 172 A K H <5S+ 0 0 81 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.829 126.9 34.9 -87.1 -37.5 -17.7 34.2 7.9 157 173 A A H <5S+ 0 0 0 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.731 131.9 25.4 -90.9 -26.5 -17.1 33.3 4.2 158 174 A G T ><5S+ 0 0 0 -4,-1.8 3,-1.7 -5,-0.5 -3,-0.2 0.873 122.2 37.3 -99.0 -73.6 -18.3 36.6 2.7 159 175 A T G > S+ 0 0 1 -3,-1.7 4,-2.6 313,-0.3 -1,-0.3 0.216 73.5 112.4-113.9 12.6 -13.0 39.1 3.4 162 178 A R H <> S+ 0 0 48 -3,-1.8 4,-2.3 1,-0.2 5,-0.1 0.891 79.1 47.5 -55.4 -48.9 -14.3 42.5 2.1 163 179 A S H > S+ 0 0 79 -4,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.887 113.5 47.9 -64.8 -40.6 -11.0 44.4 2.4 164 180 A Q H > S+ 0 0 62 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.905 111.3 51.6 -63.3 -42.8 -9.0 41.7 0.6 165 181 A F H X S+ 0 0 1 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.892 107.0 53.4 -62.7 -40.4 -11.7 41.5 -2.1 166 182 A E H X S+ 0 0 48 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.887 110.9 45.7 -59.4 -43.0 -11.4 45.3 -2.6 167 183 A R H X S+ 0 0 74 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.858 110.0 55.4 -69.7 -37.0 -7.6 45.1 -3.1 168 184 A Y H X S+ 0 0 0 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.925 106.7 49.8 -58.5 -48.2 -8.1 42.1 -5.4 169 185 A V H X S+ 0 0 8 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.915 111.5 50.2 -56.3 -45.7 -10.4 44.1 -7.6 170 186 A E H X S+ 0 0 81 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.924 115.3 40.6 -58.7 -48.9 -7.8 46.9 -7.7 171 187 A L H X S+ 0 0 1 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.836 112.7 54.5 -73.9 -34.4 -4.9 44.7 -8.7 172 188 A N H X S+ 0 0 5 -4,-2.8 4,-2.2 -5,-0.2 -1,-0.2 0.903 110.9 47.1 -61.3 -43.0 -7.0 42.6 -11.2 173 189 A T H X S+ 0 0 30 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.911 111.1 50.5 -64.5 -45.4 -7.9 45.9 -12.9 174 190 A K H X S+ 0 0 95 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.907 111.4 49.2 -59.3 -44.1 -4.3 47.1 -12.9 175 191 A A H X S+ 0 0 1 -4,-2.4 4,-1.0 2,-0.2 -2,-0.2 0.919 109.9 50.8 -60.1 -48.3 -3.2 43.8 -14.4 176 192 A A H ><>S+ 0 0 4 -4,-2.2 5,-2.9 1,-0.2 3,-0.5 0.896 110.3 49.3 -57.4 -44.0 -5.9 43.9 -17.1 177 193 A K H ><5S+ 0 0 111 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.837 105.0 57.4 -68.5 -33.4 -4.9 47.5 -18.1 178 194 A L H 3<5S+ 0 0 88 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.726 108.3 47.9 -66.9 -23.3 -1.2 46.4 -18.3 179 195 A N T <<5S- 0 0 34 -4,-1.0 -1,-0.3 -3,-0.5 -2,-0.2 0.283 124.1-112.9 -92.8 6.5 -2.4 43.9 -20.9 180 196 A N T < 5S+ 0 0 153 -3,-1.4 2,-0.3 1,-0.3 -3,-0.2 0.699 73.8 133.7 63.8 24.7 -4.3 46.7 -22.6 181 197 A F < - 0 0 54 -5,-2.9 -1,-0.3 -6,-0.1 -2,-0.2 -0.737 64.9-124.1 -88.4 152.3 -7.8 45.3 -21.7 182 198 A T S S- 0 0 92 -2,-0.3 2,-0.3 1,-0.2 -5,-0.2 0.906 82.4 -27.7 -61.7 -41.9 -10.3 47.9 -20.3 183 199 A S S > S- 0 0 1 -7,-0.2 4,-1.8 -6,-0.0 3,-0.3 -0.914 76.1 -77.1-159.5 179.7 -10.8 45.7 -17.3 184 200 A G H > S+ 0 0 2 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.708 122.5 65.4 -61.9 -22.5 -10.8 42.1 -15.9 185 201 A A H > S+ 0 0 0 252,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.953 105.3 41.3 -62.4 -51.7 -14.1 41.6 -17.6 186 202 A E H > S+ 0 0 48 -3,-0.3 4,-1.6 2,-0.2 -2,-0.2 0.856 112.1 56.8 -66.2 -36.4 -12.5 42.0 -21.1 187 203 A A H < S+ 0 0 26 -4,-1.8 4,-0.4 2,-0.2 -1,-0.2 0.926 112.2 41.4 -58.7 -47.6 -9.5 39.9 -19.9 188 204 A W H >< S+ 0 0 35 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.916 113.0 53.5 -64.7 -45.0 -11.9 37.0 -19.0 189 205 A L H >< S+ 0 0 19 -4,-2.6 3,-1.8 1,-0.3 5,-0.4 0.738 92.4 73.9 -65.5 -24.3 -14.0 37.5 -22.2 190 206 A D G >< S+ 0 0 38 -4,-1.6 3,-1.6 1,-0.3 -1,-0.3 0.780 82.0 71.1 -57.8 -29.3 -10.9 37.3 -24.4 191 207 A E G < S+ 0 0 102 -3,-1.4 -1,-0.3 -4,-0.4 -2,-0.2 0.645 93.4 56.2 -63.1 -16.2 -10.8 33.5 -23.7 192 208 A Y G < S- 0 0 0 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.474 94.7-144.4 -97.9 -4.3 -13.9 33.1 -25.9 193 209 A E < + 0 0 82 -3,-1.6 2,-0.3 -4,-0.2 -3,-0.1 0.841 63.1 107.9 45.9 48.6 -12.3 34.8 -29.0 194 210 A D > - 0 0 49 -5,-0.4 3,-1.6 1,-0.0 4,-0.2 -0.841 57.2-156.4-159.0 113.0 -15.6 36.4 -30.0 195 211 A D T 3 S+ 0 0 159 -2,-0.3 4,-0.1 1,-0.3 3,-0.1 0.494 98.1 48.6 -75.8 -2.9 -16.3 40.2 -29.8 196 212 A T T 3> S+ 0 0 70 1,-0.1 4,-2.2 2,-0.1 -1,-0.3 0.147 77.2 113.9-113.3 17.5 -20.1 39.6 -29.8 197 213 A F H <> S+ 0 0 2 -3,-1.6 4,-1.8 1,-0.2 5,-0.1 0.866 73.6 50.0 -62.2 -42.4 -20.0 36.9 -27.1 198 214 A E H > S+ 0 0 69 -4,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.910 112.2 47.8 -61.3 -45.6 -21.9 38.8 -24.3 199 215 A Q H > S+ 0 0 113 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.880 108.1 55.8 -64.3 -38.8 -24.7 39.7 -26.7 200 216 A Q H X S+ 0 0 41 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.894 109.9 46.0 -58.0 -43.3 -24.9 36.1 -27.9 201 217 A L H X S+ 0 0 1 -4,-1.8 4,-2.9 2,-0.2 -2,-0.2 0.867 109.6 53.7 -69.6 -38.5 -25.4 35.0 -24.3 202 218 A E H X S+ 0 0 59 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.916 110.8 48.1 -58.4 -44.2 -28.0 37.7 -23.6 203 219 A D H X S+ 0 0 87 -4,-2.4 4,-1.3 2,-0.2 -2,-0.2 0.920 114.1 44.4 -64.1 -47.0 -29.9 36.4 -26.7 204 220 A I H X S+ 0 0 15 -4,-2.2 4,-1.4 2,-0.2 3,-0.3 0.919 113.9 50.6 -64.2 -44.3 -29.8 32.8 -25.6 205 221 A F H X S+ 0 0 9 -4,-2.9 4,-2.3 1,-0.2 3,-0.3 0.900 105.9 55.8 -60.6 -42.4 -30.7 33.7 -22.0 206 222 A A H < S+ 0 0 57 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.827 106.6 51.7 -58.4 -34.4 -33.7 35.7 -23.2 207 223 A D H < S+ 0 0 127 -4,-1.3 4,-0.3 -3,-0.3 -1,-0.2 0.841 116.8 37.5 -70.9 -35.8 -35.0 32.7 -25.0 208 224 A I H >X S+ 0 0 11 -4,-1.4 4,-1.7 -3,-0.3 3,-0.7 0.683 95.6 85.3 -90.4 -21.7 -34.8 30.4 -21.9 209 225 A R H 3X S+ 0 0 70 -4,-2.3 4,-2.2 1,-0.2 5,-0.2 0.835 83.0 57.4 -52.3 -42.8 -35.8 33.0 -19.4 210 226 A P H 3> S+ 0 0 74 0, 0.0 4,-1.5 0, 0.0 -1,-0.2 0.889 106.2 50.7 -58.5 -38.9 -39.6 32.4 -19.8 211 227 A L H <> S+ 0 0 19 -3,-0.7 4,-2.1 -4,-0.3 -2,-0.2 0.912 108.5 52.2 -62.4 -43.4 -39.1 28.7 -18.9 212 228 A Y H X S+ 0 0 2 -4,-1.7 4,-3.2 1,-0.2 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378 A Y H >< S+ 0 0 2 -4,-1.8 3,-1.9 -5,-0.2 -1,-0.2 0.295 82.6 107.8-108.9 11.4 -4.5 17.1 -25.5 363 379 A Q T 3< S+ 0 0 42 -4,-0.5 -1,-0.1 -3,-0.5 -2,-0.1 0.669 76.9 60.3 -65.5 -15.4 -1.3 16.2 -23.6 364 380 A H T 3 S+ 0 0 127 -3,-0.2 -1,-0.3 -4,-0.2 -2,-0.1 0.601 88.3 96.9 -83.4 -15.3 0.5 15.7 -27.0 365 381 A Q S < S- 0 0 35 -3,-1.9 5,-0.1 1,-0.1 178,-0.0 -0.295 92.4 -85.5 -70.1 156.6 -0.2 19.4 -28.0 366 382 A P >> - 0 0 44 0, 0.0 3,-2.1 0, 0.0 4,-0.5 -0.351 51.1-103.0 -54.4 146.7 2.3 22.2 -27.6 367 383 A F G >4 S+ 0 0 38 1,-0.3 3,-1.8 2,-0.2 -2,-0.1 0.823 120.3 55.7 -43.8 -48.4 2.0 23.7 -24.1 368 384 A V G 34 S+ 0 0 25 1,-0.3 -1,-0.3 2,-0.0 -3,-0.0 0.735 109.0 49.1 -63.0 -21.4 0.1 26.8 -25.1 369 385 A Y G <4 S+ 0 0 6 -3,-2.1 175,-2.3 1,-0.1 2,-2.1 0.453 81.3 102.4 -93.8 -3.6 -2.6 24.5 -26.7 370 386 A R S << S+ 0 0 19 -3,-1.8 2,-0.3 -4,-0.5 -1,-0.1 -0.394 70.3 72.2 -82.7 62.4 -2.9 22.3 -23.6 371 387 A T S S- 0 0 69 -2,-2.1 174,-0.1 -13,-0.1 -3,-0.0 -0.932 92.9 -63.5-159.0 173.4 -6.1 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107.7 50.9 -65.8 -29.1 -29.4 4.0 -13.3 396 412 A E H ><5S+ 0 0 93 -4,-2.1 3,-1.1 -5,-0.2 -1,-0.2 0.854 105.7 56.7 -70.2 -37.9 -31.4 0.8 -13.9 397 413 A K H 3<5S+ 0 0 121 -4,-1.2 -2,-0.2 1,-0.3 -1,-0.2 0.867 110.1 43.8 -60.5 -39.2 -28.4 -0.7 -15.8 398 414 A I T 3<5S- 0 0 47 -4,-1.7 -1,-0.3 1,-0.0 -2,-0.2 0.276 115.5-116.1 -93.4 9.9 -26.1 -0.2 -12.8 399 415 A G T < 5S+ 0 0 21 -3,-1.1 -3,-0.2 2,-0.2 -2,-0.1 0.653 84.6 115.7 68.9 19.6 -28.8 -1.5 -10.4 400 416 A L S - 0 0 51 -2,-1.7 4,-1.9 1,-0.0 5,-0.1 -0.285 66.2 -84.8 -89.9-175.6 -44.9 6.5 -17.5 408 424 A D H > S+ 0 0 141 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.862 128.2 47.8 -59.2 -39.3 -45.9 10.1 -18.5 409 425 A E H > S+ 0 0 73 2,-0.2 4,-2.2 1,-0.2 -148,-0.2 0.908 110.2 49.6 -72.8 -43.6 -45.9 11.3 -14.9 410 426 A A H > S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.844 109.7 54.5 -61.2 -34.7 -42.6 9.7 -13.9 411 427 A R H X S+ 0 0 68 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.911 107.2 48.9 -65.6 -44.5 -41.1 11.4 -17.0 412 428 A I H X S+ 0 0 15 -4,-1.7 4,-2.6 2,-0.2 5,-0.2 0.901 109.4 53.6 -60.5 -43.6 -42.3 14.8 -16.0 413 429 A N H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.911 112.2 44.3 -53.2 -46.8 -40.8 14.2 -12.5 414 430 A Q H X S+ 0 0 4 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.879 113.3 49.2 -70.8 -41.8 -37.4 13.4 -14.1 415 431 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.905 113.4 47.7 -61.4 -43.4 -37.5 16.3 -16.5 416 432 A F H X S+ 0 0 3 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.911 109.6 52.7 -65.2 -44.3 -38.4 18.7 -13.6 417 433 A L H X S+ 0 0 17 -4,-2.3 4,-0.5 1,-0.2 -2,-0.2 0.906 111.7 46.5 -54.9 -45.8 -35.6 17.2 -11.5 418 434 A T H >X S+ 0 0 10 -4,-2.2 4,-2.7 1,-0.2 3,-1.1 0.894 110.5 52.8 -64.2 -41.5 -33.1 17.9 -14.3 419 435 A A H 3X>S+ 0 0 0 -4,-2.3 5,-2.1 1,-0.3 4,-1.6 0.834 98.8 63.0 -64.3 -35.4 -34.5 21.4 -14.8 420 436 A L H 3<5S+ 0 0 0 -4,-2.2 -169,-2.7 1,-0.2 -168,-0.4 0.723 116.7 32.5 -60.7 -22.5 -34.0 22.2 -11.1 421 437 A D H <<5S+ 0 0 22 -3,-1.1 4,-0.3 -4,-0.5 -2,-0.2 0.783 130.0 31.4 -96.8 -40.7 -30.3 21.6 -11.8 422 438 A K H <5S+ 0 0 20 -4,-2.7 4,-0.4 2,-0.1 -3,-0.2 0.840 125.2 32.7 -97.1 -38.6 -30.0 22.8 -15.4 423 439 A I T ><5S+ 0 0 2 -4,-1.6 3,-1.1 -5,-0.2 -3,-0.2 0.902 116.5 54.0 -85.5 -46.9 -32.5 25.7 -16.1 424 440 A V T 3> S+ 0 0 0 -6,-0.3 4,-3.0 -4,-0.3 -1,-0.2 0.767 88.0 75.8 -65.3 -30.3 -28.7 27.4 -12.8 426 442 A L H <> S+ 0 0 6 -3,-1.1 4,-2.2 -4,-0.4 -1,-0.2 0.917 98.4 39.6 -57.5 -54.0 -28.6 29.7 -15.9 427 443 A P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.897 116.0 54.3 -63.7 -36.1 -29.6 33.0 -14.3 428 444 A F H X S+ 0 0 3 -4,-0.9 4,-1.5 2,-0.2 -2,-0.2 0.955 109.6 45.9 -56.7 -53.0 -27.4 32.2 -11.3 429 445 A A H X S+ 0 0 0 -4,-3.0 4,-1.1 1,-0.2 3,-0.3 0.893 110.9 53.1 -59.7 -42.8 -24.4 31.6 -13.4 430 446 A F H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 3,-0.2 0.901 107.7 51.7 -58.9 -42.6 -25.0 34.8 -15.5 431 447 A T H X S+ 0 0 1 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.781 97.8 65.5 -69.1 -30.1 -25.2 36.9 -12.3 432 448 A M H X S+ 0 0 1 -4,-1.5 4,-1.6 -3,-0.3 -1,-0.2 0.938 115.3 29.5 -57.1 -47.7 -21.9 35.7 -10.8 433 449 A D H X S+ 0 0 0 -4,-1.1 4,-3.3 -3,-0.2 5,-0.2 0.817 114.0 60.8 -86.5 -29.7 -20.0 37.3 -13.7 434 450 A K H X S+ 0 0 33 -4,-2.4 4,-1.7 -5,-0.2 -2,-0.2 0.907 110.2 46.7 -56.8 -39.9 -22.4 40.2 -14.4 435 451 A Y H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.970 115.7 41.5 -64.3 -56.6 -21.6 41.2 -10.8 436 452 A R H X S+ 0 0 0 -4,-1.6 4,-2.9 1,-0.2 5,-0.2 0.879 112.6 55.5 -63.4 -38.9 -17.8 40.8 -11.0 437 453 A W H X S+ 0 0 8 -4,-3.3 4,-2.8 1,-0.2 -252,-0.2 0.920 105.9 52.2 -54.9 -46.6 -17.8 42.5 -14.5 438 454 A S H <>S+ 0 0 15 -4,-1.7 5,-2.8 -5,-0.2 6,-0.8 0.840 113.1 43.9 -63.3 -34.9 -19.6 45.5 -13.1 439 455 A L H ><5S+ 0 0 5 -4,-1.6 3,-1.1 3,-0.2 -1,-0.2 0.916 114.2 49.5 -72.7 -45.6 -17.0 45.9 -10.3 440 456 A F H 3<5S+ 0 0 4 -4,-2.9 -2,-0.2 1,-0.2 -256,-0.2 0.877 111.0 50.4 -58.3 -41.1 -14.1 45.3 -12.7 441 457 A R T 3<5S- 0 0 65 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.483 113.7-118.1 -78.8 -4.4 -15.4 47.9 -15.1 442 458 A G T < 5S+ 0 0 62 -3,-1.1 -3,-0.2 -4,-0.2 -2,-0.1 0.793 74.2 132.1 71.5 30.4 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