==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER MEMBRANE PROTEIN 27-APR-10 3MPQ . COMPND 2 MOLECULE: TRANSPORTER; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR B.M.KRONCKE . 491 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19102.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 402 81.9 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 . 5 1.0 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 . 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 . 6 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 306 62.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 5.3 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 2 2 3 1 1 1 1 1 1 2 2 1 0 1 0 1 0 0 1 0 0 1 0 0 2 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 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 ANTIPARALLEL 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 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 4 A K 0 0 215 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -24.5 32.3 59.7 24.0 2 5 A R - 0 0 32 259,-0.0 2,-0.1 2,-0.0 259,-0.0 -0.951 360.0-109.1-157.3 148.1 31.5 56.2 22.5 3 6 A E - 0 0 51 -2,-0.3 2,-0.3 259,-0.0 176,-0.0 -0.473 39.6-163.4 -65.4 148.8 32.4 54.0 19.6 4 7 A H - 0 0 42 -2,-0.1 177,-0.2 258,-0.0 258,-0.2 -0.972 28.0-101.5-137.3 144.7 29.6 53.5 17.0 5 8 A W - 0 0 4 256,-1.5 258,-0.2 -2,-0.3 3,-0.1 -0.493 32.0-147.1 -56.8 136.8 28.7 51.2 14.2 6 9 A A S S+ 0 0 73 1,-0.1 2,-0.3 -2,-0.1 -1,-0.1 0.880 72.6 21.4 -79.2 -39.0 29.7 53.0 11.0 7 10 A T > - 0 0 55 1,-0.1 4,-2.4 174,-0.1 -1,-0.1 -0.894 66.4-127.6-137.6 155.1 26.9 51.6 8.8 8 11 A R H > S+ 0 0 72 -2,-0.3 4,-2.5 2,-0.2 5,-0.2 0.853 113.1 51.6 -66.3 -40.7 23.6 50.0 9.0 9 12 A L H > S+ 0 0 107 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.935 112.2 46.5 -64.7 -43.9 24.7 47.1 6.9 10 13 A G H > S+ 0 0 0 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.912 110.4 53.3 -64.0 -43.6 27.7 46.6 9.1 11 14 A L H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.963 113.6 42.5 -48.9 -57.7 25.6 46.8 12.2 12 15 A I H X S+ 0 0 16 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.830 114.9 48.3 -68.0 -38.5 23.2 44.1 10.9 13 16 A L H X S+ 0 0 31 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.878 111.7 51.5 -72.7 -35.1 26.0 41.8 9.5 14 17 A A H X S+ 0 0 2 -4,-2.9 4,-2.2 -5,-0.2 -2,-0.2 0.933 114.2 43.6 -58.7 -49.3 27.9 42.1 12.9 15 18 A M H X S+ 0 0 2 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.851 112.7 51.9 -66.5 -39.5 24.7 41.2 14.8 16 19 A A H X S+ 0 0 1 -4,-2.5 4,-3.3 2,-0.2 -1,-0.2 0.840 110.8 47.7 -61.8 -36.5 24.0 38.4 12.3 17 20 A G H < S+ 0 0 1 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.839 106.9 58.2 -74.4 -30.9 27.6 37.1 12.9 18 21 A N H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.983 118.9 30.5 -55.2 -52.9 26.9 37.4 16.6 19 22 A A H < S+ 0 0 0 -4,-2.2 2,-0.8 475,-0.1 4,-0.2 0.901 105.1 75.3 -74.8 -48.2 24.0 35.1 16.2 20 23 A V S < S+ 0 0 4 -4,-3.3 2,-0.2 474,-0.2 327,-0.1 -0.579 73.7 109.0 -81.2 108.2 25.0 32.9 13.3 21 24 A G S >> S- 0 0 0 -2,-0.8 3,-1.1 226,-0.1 4,-1.0 -0.597 84.0 -40.4-148.1-152.7 27.5 30.5 14.8 22 25 A L H 3>>S+ 0 0 10 472,-0.5 4,-2.5 1,-0.3 5,-1.7 0.686 122.9 70.3 -63.2 -21.4 28.2 27.0 15.9 23 26 A G H 34>S+ 0 0 0 471,-2.5 5,-3.0 -4,-0.2 -1,-0.3 0.895 99.5 48.3 -63.1 -34.8 24.7 26.9 17.3 24 27 A N H <45S+ 0 0 0 -3,-1.1 -2,-0.2 -5,-0.2 -1,-0.2 0.885 122.5 28.0 -72.2 -37.0 23.4 26.9 13.7 25 28 A F H <5S+ 0 0 0 -4,-1.0 266,-0.2 3,-0.1 -2,-0.2 0.744 135.2 21.2-104.8 -26.4 25.6 24.2 12.2 26 29 A L T X5S+ 0 0 15 -4,-2.5 4,-1.0 -5,-0.2 -3,-0.2 0.817 125.2 38.8-108.8 -48.4 26.4 21.9 15.2 27 30 A R H > S+ 0 0 1 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.891 114.5 44.0 -56.1 -42.1 21.0 19.6 13.9 30 33 A V H X S+ 0 0 8 -4,-1.0 4,-2.3 -3,-0.3 -2,-0.2 0.914 115.0 48.9 -69.0 -42.1 21.6 17.5 17.0 31 34 A Q H X S+ 0 0 31 -4,-2.8 4,-0.6 1,-0.2 6,-0.2 0.921 115.5 44.3 -63.2 -43.1 18.8 19.1 19.0 32 35 A A H ><>S+ 0 0 0 -4,-3.0 5,-2.4 -5,-0.2 3,-1.0 0.930 114.3 48.4 -68.9 -43.9 16.4 18.7 16.1 33 36 A A H ><5S+ 0 0 2 -4,-2.4 3,-0.9 -5,-0.3 -2,-0.2 0.894 110.0 51.3 -65.7 -44.0 17.4 15.1 15.4 34 37 A E H 3<5S+ 0 0 72 -4,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.610 108.8 54.0 -61.0 -19.8 17.2 14.0 19.0 35 38 A N T <<5S- 0 0 22 -3,-1.0 -1,-0.2 -4,-0.6 -2,-0.1 -0.185 126.8 -84.5-120.7 36.9 13.6 15.4 19.3 36 39 A G T X 5 - 0 0 32 -3,-0.9 2,-0.9 3,-0.2 3,-0.7 0.447 55.0-109.6 84.4 2.6 11.8 13.7 16.5 37 40 A G T >> S+ 0 0 2 184,-1.4 4,-1.1 -2,-0.9 -1,-0.2 0.692 115.0 69.6 -70.3 -20.2 9.5 18.0 12.7 39 42 A A H <4 S+ 0 0 0 -3,-0.7 -1,-0.3 186,-0.3 -3,-0.2 0.798 103.2 45.4 -57.5 -34.7 8.2 17.2 16.2 40 43 A F H <> S+ 0 0 0 -3,-1.2 4,-1.9 -8,-0.2 -2,-0.2 0.796 103.0 66.8 -72.8 -38.6 10.9 19.7 17.4 41 44 A M H X S+ 0 0 6 -4,-1.0 4,-2.9 182,-0.3 5,-0.2 0.806 91.8 56.4 -65.3 -32.6 10.1 22.2 14.8 42 45 A I H X S+ 0 0 51 -4,-1.1 4,-2.6 1,-0.2 5,-0.2 0.979 114.1 39.1 -65.9 -50.7 6.6 23.3 15.9 43 46 A P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.827 114.2 56.4 -63.6 -31.3 7.7 24.3 19.4 44 47 A Y H X S+ 0 0 3 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.935 109.1 45.5 -64.8 -49.3 10.9 25.7 18.0 45 48 A I H X S+ 0 0 72 -4,-2.9 4,-2.1 1,-0.2 5,-0.2 0.947 113.8 49.0 -60.4 -43.0 8.8 28.0 15.7 46 49 A I H X S+ 0 0 53 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.886 110.9 50.8 -63.7 -38.1 6.5 28.9 18.6 47 50 A A H X>S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 5,-2.0 0.912 106.9 53.5 -66.5 -41.7 9.5 29.7 20.8 48 51 A F H <>S+ 0 0 30 -4,-2.3 5,-2.6 3,-0.2 -1,-0.2 0.941 114.6 42.5 -54.4 -44.9 11.0 31.9 18.1 49 52 A L H <5S+ 0 0 81 -4,-2.1 -2,-0.2 3,-0.2 -1,-0.2 0.869 124.8 33.0 -73.7 -35.7 7.7 33.8 18.0 50 53 A L H <5S+ 0 0 43 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.708 138.1 10.5 -97.7 -19.9 7.1 34.0 21.8 51 54 A V T X5S+ 0 0 0 -4,-3.1 4,-2.9 -5,-0.2 5,-0.4 0.665 121.7 54.2-119.3 -56.7 10.6 34.3 23.2 52 55 A G H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -2,-0.2 0.941 114.1 47.1 -72.6 -40.2 10.5 39.7 21.8 55 58 A L H X S+ 0 0 0 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.907 109.1 56.9 -62.4 -32.8 13.7 39.1 23.9 56 59 A M H X S+ 0 0 1 -4,-2.4 4,-2.7 -5,-0.4 5,-0.3 0.962 109.4 45.1 -61.0 -46.3 15.8 40.2 20.9 57 60 A W H X S+ 0 0 7 -4,-2.2 4,-2.6 1,-0.2 5,-0.2 0.964 112.6 50.9 -62.9 -45.2 13.9 43.5 20.8 58 61 A I H X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 -1,-0.2 0.888 110.7 48.7 -59.8 -40.5 14.2 44.0 24.5 59 62 A E H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -1,-0.2 0.911 111.0 48.8 -71.6 -40.4 18.0 43.3 24.5 60 63 A W H X S+ 0 0 0 -4,-2.7 4,-2.7 -5,-0.2 5,-0.3 0.912 113.2 49.3 -59.8 -41.3 18.7 45.8 21.6 61 64 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.3 -2,-0.2 0.919 110.1 49.7 -66.5 -42.6 16.6 48.4 23.5 62 65 A M H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 5,-0.2 0.941 113.9 47.3 -61.6 -36.7 18.5 47.8 26.8 63 66 A G H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.938 111.1 47.4 -72.6 -50.5 21.8 48.1 25.0 64 67 A R H X S+ 0 0 1 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.924 113.7 51.1 -53.7 -42.5 21.0 51.3 23.0 65 68 A Y H X S+ 0 0 46 -4,-2.1 4,-0.9 -5,-0.3 -2,-0.2 0.930 112.7 43.1 -65.6 -45.3 19.7 52.8 26.1 66 69 A G H ><>S+ 0 0 0 -4,-2.5 5,-2.5 -5,-0.2 3,-0.5 0.915 111.2 57.0 -66.0 -36.5 22.7 52.0 28.2 67 70 A G H ><5S+ 0 0 4 -4,-2.7 3,-2.0 1,-0.3 -1,-0.2 0.853 97.5 59.2 -65.9 -37.3 25.0 53.1 25.4 68 71 A A H 3<5S+ 0 0 42 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.853 110.3 45.4 -58.7 -35.7 23.5 56.6 25.2 69 72 A Q T <<5S- 0 0 93 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.219 127.3 -99.3 -91.6 14.7 24.6 57.0 28.9 70 73 A G T < 5S+ 0 0 23 -3,-2.0 2,-0.5 1,-0.2 -3,-0.2 0.558 87.8 114.3 85.3 8.0 28.2 55.5 28.3 71 74 A H < + 0 0 15 -5,-2.5 -2,-0.2 -6,-0.1 -1,-0.2 -0.951 31.6 169.4-120.1 120.8 27.4 51.9 29.6 72 75 A G + 0 0 0 -2,-0.5 2,-0.3 286,-0.2 188,-0.2 0.533 58.0 68.2-105.1 -5.2 27.3 48.7 27.6 73 76 A T S >> S- 0 0 1 285,-0.2 4,-2.3 -7,-0.1 3,-0.5 -0.817 81.7-111.7-120.4 161.6 27.1 45.9 30.1 74 77 A T H 3> S+ 0 0 1 -2,-0.3 4,-2.3 20,-0.2 5,-0.3 0.608 103.8 67.1 -70.0 -20.0 24.4 44.8 32.5 75 78 A P H 3> S+ 0 0 4 0, 0.0 4,-0.9 0, 0.0 -1,-0.2 0.977 117.4 29.7 -62.9 -45.4 25.8 45.6 35.9 76 79 A A H <> S+ 0 0 16 -3,-0.5 4,-2.2 2,-0.2 3,-0.3 0.933 121.9 51.3 -69.3 -51.4 25.5 49.3 35.0 77 80 A I H X S+ 0 0 0 -4,-2.3 4,-1.5 1,-0.2 -3,-0.2 0.882 108.0 51.0 -62.0 -41.9 22.5 49.0 32.7 78 81 A F H X S+ 0 0 0 -4,-2.3 4,-1.1 1,-0.2 -1,-0.2 0.860 111.6 49.7 -60.0 -36.8 20.4 47.0 35.2 79 82 A Y H < S+ 0 0 45 -4,-0.9 -2,-0.2 -5,-0.3 -1,-0.2 0.845 105.4 55.9 -69.7 -37.5 21.1 49.7 37.8 80 83 A L H < S+ 0 0 26 -4,-2.2 3,-0.2 1,-0.2 -1,-0.2 0.842 115.4 39.5 -63.2 -33.5 20.1 52.5 35.3 81 84 A L H < S+ 0 0 10 -4,-1.5 2,-0.2 1,-0.3 -2,-0.2 0.606 131.7 23.7 -89.4 -18.8 16.7 50.7 35.0 82 85 A W S < S- 0 0 63 -4,-1.1 2,-2.2 -5,-0.1 -1,-0.3 -0.737 73.9-146.2-153.9 99.5 16.4 49.7 38.6 83 86 A R + 0 0 170 -2,-0.2 2,-0.3 -3,-0.2 -4,-0.1 -0.405 60.1 111.1 -77.2 76.3 18.2 51.8 41.3 84 87 A N S >> S- 0 0 70 -2,-2.2 3,-1.1 -6,-0.1 4,-0.8 -0.983 72.5-127.1-149.9 142.4 19.0 49.1 43.7 85 88 A R H >> S+ 0 0 133 -2,-0.3 4,-1.3 1,-0.3 3,-0.5 0.832 110.8 63.6 -68.0 -30.5 22.3 47.4 44.6 86 89 A F H 3> S+ 0 0 110 1,-0.2 4,-2.7 2,-0.2 -1,-0.3 0.783 93.5 62.8 -61.3 -31.5 20.8 44.0 43.9 87 90 A A H <> S+ 0 0 0 -3,-1.1 4,-1.6 -5,-0.2 -1,-0.2 0.893 101.7 50.8 -58.0 -42.4 20.4 45.2 40.2 88 91 A K H X S+ 0 0 77 -4,-1.3 3,-1.9 1,-0.2 4,-0.5 0.957 110.7 46.1 -75.4 -52.4 24.6 42.0 41.4 90 93 A L H >< S+ 0 0 23 -4,-2.7 3,-1.2 1,-0.3 4,-0.3 0.852 106.4 65.5 -52.7 -32.4 22.1 40.3 39.1 91 94 A G H >< S+ 0 0 0 -4,-1.6 3,-1.5 -5,-0.3 -1,-0.3 0.719 82.5 74.2 -62.6 -26.2 23.9 42.3 36.4 92 95 A V H XX S+ 0 0 0 -3,-1.9 4,-2.7 -4,-0.5 3,-2.0 0.811 82.7 70.0 -62.5 -30.0 27.1 40.3 36.9 93 96 A F H S+ 0 0 1 -3,-2.0 4,-1.4 -22,-0.1 -2,-0.2 0.499 120.3 49.2-104.1 -35.8 29.4 39.5 32.2 96 99 A W H X S+ 0 0 19 -4,-2.7 4,-3.0 2,-0.2 5,-0.3 0.908 106.5 53.1 -73.7 -45.6 29.7 36.0 33.7 97 100 A I H X S+ 0 0 0 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.960 113.0 42.5 -54.6 -56.3 27.6 34.1 31.2 98 101 A P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.833 115.9 49.3 -61.4 -34.9 29.5 35.3 28.1 99 102 A L H X S+ 0 0 3 -4,-1.4 4,-2.0 2,-0.2 -2,-0.2 0.943 113.6 45.7 -68.6 -46.8 32.9 34.9 29.8 100 103 A V H X S+ 0 0 0 -4,-3.0 4,-1.2 1,-0.2 5,-0.2 0.918 116.2 45.6 -61.3 -41.1 32.0 31.4 30.9 101 104 A V H X S+ 0 0 0 -4,-2.9 4,-3.2 -5,-0.3 3,-0.4 0.935 108.5 56.5 -68.7 -39.8 30.7 30.6 27.5 102 105 A A H X S+ 0 0 0 -4,-2.5 4,-2.6 250,-0.3 5,-0.4 0.882 98.9 64.3 -57.0 -36.4 33.7 32.2 25.7 103 106 A I H X S+ 0 0 0 -4,-2.0 4,-0.7 1,-0.2 -1,-0.2 0.893 116.9 23.3 -61.3 -44.9 35.9 29.8 27.7 104 107 A Y H X S+ 0 0 5 -4,-1.2 4,-2.3 -3,-0.4 -1,-0.2 0.825 120.5 57.4 -90.2 -31.0 34.6 26.7 26.1 105 108 A Y H X S+ 0 0 4 -4,-3.2 4,-2.6 2,-0.2 -2,-0.2 0.837 104.1 52.0 -69.1 -43.4 33.3 28.1 22.8 106 109 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.919 110.2 51.1 -60.5 -33.9 36.6 29.5 21.8 107 110 A Y H X S+ 0 0 3 -4,-0.7 4,-1.6 -5,-0.4 -2,-0.2 0.948 110.8 45.8 -68.1 -49.6 38.1 26.1 22.4 108 111 A I H X S+ 0 0 14 -4,-2.3 4,-1.2 1,-0.2 3,-0.3 0.938 111.5 53.9 -58.0 -42.7 35.6 24.3 20.3 109 112 A E H >X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 3,-0.6 0.895 103.7 56.2 -53.9 -42.8 36.0 27.0 17.6 110 113 A S H 3X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.3 -1,-0.2 0.871 100.0 60.1 -62.6 -32.3 39.8 26.3 17.7 111 114 A W H 3X S+ 0 0 5 -4,-1.6 4,-2.6 -3,-0.3 -1,-0.3 0.851 102.2 51.8 -57.8 -40.6 39.0 22.7 16.9 112 115 A T H S+ 0 0 59 -4,-2.5 5,-1.3 1,-0.2 4,-0.4 0.838 113.0 50.1 -65.0 -34.7 44.5 19.3 8.7 119 122 A F H ><5S+ 0 0 5 -4,-2.4 3,-1.0 3,-0.2 -1,-0.2 0.942 109.6 50.6 -70.2 -44.0 41.8 18.7 6.1 120 123 A L H 3<5S+ 0 0 101 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.849 115.6 42.5 -55.9 -38.1 43.3 21.3 3.6 121 124 A V T 3<5S- 0 0 90 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.399 112.6-119.8 -97.1 -4.1 46.7 19.7 3.9 122 125 A G T < 5 + 0 0 34 -3,-1.0 2,-2.0 -4,-0.4 -3,-0.2 0.535 65.4 141.1 76.9 14.4 45.4 16.2 3.8 123 126 A L < + 0 0 112 -5,-1.3 -1,-0.2 -6,-0.2 -3,-0.1 -0.462 42.9 117.0 -82.9 68.8 46.7 14.9 7.1 124 127 A V S S- 0 0 20 -2,-2.0 13,-0.1 -5,-0.1 207,-0.0 -0.784 70.9 -82.8-132.6 166.4 43.4 13.0 7.7 125 128 A P - 0 0 26 0, 0.0 -1,-0.1 0, 0.0 12,-0.0 -0.327 30.9-146.8 -73.1 160.8 42.4 9.4 8.1 126 129 A E 0 0 164 10,-0.0 199,-0.0 -2,-0.0 0, 0.0 -1.000 360.0 360.0-120.2 123.0 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62.2-154.8 -81.7 120.3 6.4 16.1 25.7 234 241 A P H 3> S+ 0 0 76 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.814 90.5 64.5 -60.3 -32.8 7.9 18.8 27.9 235 242 A G H 3> S+ 0 0 33 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.872 99.5 52.1 -59.0 -40.7 11.5 17.8 27.0 236 243 A V H <> S+ 0 0 0 -3,-0.7 4,-3.1 -6,-0.2 -1,-0.2 0.883 110.7 48.5 -60.2 -42.2 10.9 18.8 23.4 237 244 A W H X S+ 0 0 66 -4,-1.1 4,-2.4 2,-0.2 -2,-0.2 0.902 112.7 47.3 -66.6 -43.3 9.7 22.3 24.6 238 245 A I H X S+ 0 0 73 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.896 114.2 47.6 -63.6 -40.3 12.7 22.7 26.9 239 246 A A H X S+ 0 0 16 -4,-2.4 4,-2.6 -5,-0.2 -2,-0.2 0.973 111.6 50.7 -68.9 -49.7 15.0 21.7 24.1 240 247 A A H X S+ 0 0 0 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.879 113.4 43.8 -53.4 -45.8 13.3 24.0 21.6 241 248 A V H X S+ 0 0 3 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.886 111.4 52.8 -70.7 -42.9 13.5 27.1 23.9 242 249 A G H X S+ 0 0 12 -4,-2.4 4,-2.4 -5,-0.2 5,-0.2 0.928 110.7 49.3 -55.6 -43.5 17.1 26.4 25.0 243 250 A Q H X S+ 0 0 0 -4,-2.6 4,-3.6 2,-0.2 5,-0.4 0.939 107.6 54.3 -62.7 -43.4 18.1 26.2 21.3 244 251 A I H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 6,-0.3 0.945 111.5 45.1 -55.0 -48.8 16.3 29.5 20.6 245 252 A F H X>S+ 0 0 0 -4,-2.4 5,-1.9 1,-0.2 4,-1.0 0.965 115.8 45.7 -60.4 -51.4 18.2 31.3 23.3 246 253 A F H ><5S+ 0 0 11 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.938 114.7 46.4 -56.9 -51.1 21.6 29.8 22.2 247 254 A T H 3<5S+ 0 0 0 -4,-3.6 -1,-0.2 247,-0.3 -2,-0.2 0.873 116.6 42.8 -68.7 -32.1 21.1 30.4 18.6 248 255 A L H 3<5S- 0 0 0 -4,-2.3 -1,-0.2 -5,-0.4 -2,-0.2 0.569 107.1-122.5 -89.3 -0.0 19.9 34.0 18.9 249 256 A S T X<5 + 0 0 0 -4,-1.0 3,-0.9 -3,-0.8 6,-0.7 0.772 54.0 163.1 64.3 30.9 22.5 34.8 21.6 250 257 A L T 3 < + 0 0 0 -5,-1.9 -1,-0.2 -6,-0.3 159,-0.2 -0.612 59.7 15.7 -85.3 136.1 19.7 35.8 24.0 251 258 A G T 3 S+ 0 0 0 -2,-0.3 -1,-0.2 157,-0.1 157,-0.1 0.591 97.0 99.2 82.1 13.3 20.7 36.0 27.7 252 259 A F S < S- 0 0 0 -3,-0.9 -2,-0.1 -7,-0.1 -151,-0.1 0.247 90.5-121.7-109.0 6.8 24.4 36.1 27.1 253 260 A G S > S+ 0 0 1 1,-0.1 4,-1.5 -156,-0.1 -3,-0.1 0.507 88.2 105.6 65.9 3.2 24.7 39.9 27.4 254 261 A A H > S+ 0 0 0 -5,-0.4 4,-2.3 2,-0.2 5,-0.2 0.860 73.3 49.5 -87.0 -41.9 26.2 40.0 23.9 255 262 A I H > S+ 0 0 1 -6,-0.7 4,-2.8 2,-0.2 5,-0.2 0.946 113.4 50.4 -60.0 -44.5 23.2 41.4 22.0 256 263 A I H > S+ 0 0 0 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.928 110.1 48.8 -58.8 -47.2 23.0 44.2 24.7 257 264 A T H < S+ 0 0 1 -4,-1.5 3,-0.3 1,-0.2 -1,-0.2 0.926 112.4 46.9 -65.4 -46.8 26.6 45.0 24.4 258 265 A Y H >< S+ 0 0 1 -4,-2.3 3,-1.8 1,-0.2 -1,-0.2 0.897 110.0 54.9 -57.0 -40.9 26.5 45.2 20.6 259 266 A A H >< S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.3 -2,-0.2 0.817 93.2 71.3 -65.9 -25.2 23.3 47.4 20.8 260 267 A S T 3< S+ 0 0 1 -4,-1.8 -1,-0.3 -3,-0.3 -2,-0.2 0.569 93.2 55.9 -68.2 -9.0 25.2 49.8 23.1 261 268 A Y T < S+ 0 0 3 -3,-1.8 -256,-1.5 -4,-0.2 2,-0.4 0.359 84.4 104.4 -98.5 0.9 27.2 51.0 20.1 262 269 A V S < S- 0 0 3 -3,-2.1 -194,-0.1 -4,-0.2 -195,-0.1 -0.695 85.4-104.6 -78.2 129.6 24.1 51.8 18.2 263 270 A R > - 0 0 146 -2,-0.4 3,-1.7 -258,-0.2 -2,-0.1 -0.228 34.8-106.0 -53.0 141.0 23.4 55.6 18.0 264 271 A K T 3 S+ 0 0 123 1,-0.3 -1,-0.1 -4,-0.1 -196,-0.1 0.661 115.0 30.1 -41.5 -36.8 20.7 56.8 20.4 265 272 A D T 3 S+ 0 0 99 2,-0.1 -1,-0.3 167,-0.1 3,-0.1 0.441 89.3 117.3-114.9 2.2 18.1 57.4 17.7 266 273 A Q S < S- 0 0 46 -3,-1.7 167,-0.1 1,-0.1 -4,-0.0 -0.371 76.0 -93.6 -67.5 142.4 19.0 54.8 15.1 267 274 A D + 0 0 6 1,-0.1 166,-0.1 165,-0.1 -1,-0.1 -0.309 42.5 170.3 -57.6 139.3 16.3 52.1 14.5 268 275 A I > + 0 0 0 161,-0.4 4,-1.9 163,-0.2 5,-0.2 0.476 67.5 71.8-118.0 -12.8 16.5 48.8 16.5 269 276 A V H > S+ 0 0 0 160,-0.2 4,-1.8 166,-0.2 5,-0.1 0.965 108.7 28.8 -71.4 -49.7 13.0 47.4 15.5 270 277 A L H > S+ 0 0 60 2,-0.2 4,-2.6 165,-0.2 5,-0.2 0.947 123.2 50.2 -75.4 -50.5 13.7 46.5 11.9 271 278 A S H > S+ 0 0 2 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.918 112.1 50.2 -49.9 -46.3 17.5 45.9 12.4 272 279 A G H X S+ 0 0 0 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.932 112.5 44.6 -60.7 -47.0 16.6 43.6 15.3 273 280 A L H X S+ 0 0 53 -4,-1.8 4,-2.7 -5,-0.2 -1,-0.2 0.880 111.4 54.1 -66.7 -36.5 14.1 41.6 13.4 274 281 A T H X S+ 0 0 55 -4,-2.6 4,-3.4 2,-0.2 5,-0.2 0.942 110.3 46.7 -66.7 -45.5 16.5 41.3 10.3 275 282 A A H X S+ 0 0 2 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.954 113.9 47.9 -57.4 -50.1 19.3 39.9 12.4 276 283 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 -5,-0.2 -2,-0.2 0.936 115.2 46.1 -56.2 -44.8 16.9 37.5 14.1 277 284 A T H X S+ 0 0 46 -4,-2.7 4,-2.0 1,-0.2 -2,-0.2 0.863 108.9 53.5 -73.9 -37.9 15.6 36.5 10.7 278 285 A L H X S+ 0 0 68 -4,-3.4 4,-2.4 2,-0.2 -1,-0.2 0.911 110.5 49.3 -59.4 -43.5 18.9 36.1 9.1 279 286 A N H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.2 -2,-0.2 0.922 108.8 50.9 -60.8 -47.9 19.9 33.8 11.9 280 287 A E H X S+ 0 0 17 -4,-2.4 4,-2.8 2,-0.2 5,-0.4 0.892 110.5 49.2 -59.2 -38.8 16.8 31.7 11.6 281 288 A K H X>S+ 0 0 117 -4,-2.0 4,-2.1 2,-0.2 5,-1.5 0.964 112.1 48.3 -64.9 -45.5 17.3 31.2 7.8 282 289 A A H <>S+ 0 0 9 -4,-2.4 5,-3.3 3,-0.2 6,-0.3 0.914 116.6 45.8 -59.1 -40.1 21.0 30.2 8.4 283 290 A E H <>S+ 0 0 0 -4,-2.9 5,-1.7 3,-0.2 -2,-0.2 0.983 123.7 26.8 -68.0 -55.3 19.8 27.8 11.1 284 291 A V H <5S+ 0 0 22 -4,-2.8 -3,-0.2 3,-0.2 -2,-0.2 0.877 131.2 33.0 -87.6 -35.1 16.8 26.1 9.4 285 292 A I T X5S+ 0 0 93 -4,-2.1 4,-0.9 -5,-0.4 -3,-0.2 0.950 134.1 23.9 -81.2 -52.2 17.6 26.3 5.7 286 293 A L H >> S+ 0 0 3 -5,-0.4 4,-3.1 -4,-0.3 5,-0.3 0.964 115.2 47.4 -59.9 -51.6 21.0 15.7 9.0 293 300 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -2,-0.2 0.872 113.6 47.9 -57.4 -35.7 20.4 15.1 5.3 294 301 A A H X S+ 0 0 0 -4,-1.5 4,-1.9 2,-0.2 -2,-0.2 0.929 114.3 46.8 -70.8 -46.3 23.9 13.8 4.7 295 302 A A H X S+ 0 0 1 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.900 114.8 46.2 -60.0 -42.4 23.7 11.5 7.7 296 303 A V H X S+ 0 0 1 -4,-3.1 4,-2.7 1,-0.2 -2,-0.2 0.924 108.3 55.8 -70.3 -40.6 20.3 10.2 6.7 297 304 A A H < S+ 0 0 0 -4,-2.6 -84,-0.4 -5,-0.3 -86,-0.4 0.902 117.3 35.4 -59.4 -42.5 21.3 9.7 3.0 298 305 A F H < S+ 0 0 41 -4,-1.9 -1,-0.2 -5,-0.1 -2,-0.2 0.765 135.8 17.8 -81.5 -29.8 24.2 7.4 4.1 299 306 A F H < S- 0 0 31 -4,-2.2 4,-0.4 -5,-0.2 -3,-0.2 0.535 99.7-114.8-121.1 -8.8 22.6 5.6 7.2 300 307 A G X - 0 0 17 -4,-2.7 4,-1.9 -5,-0.3 3,-0.3 0.007 43.7 -73.0 84.1 158.4 18.9 6.0 7.1 301 308 A V H > S+ 0 0 54 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.939 125.9 54.6 -54.9 -52.9 16.9 7.9 9.7 302 309 A A H > S+ 0 0 81 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.843 112.5 44.1 -59.2 -34.5 17.1 5.6 12.7 303 310 A N H > S+ 0 0 94 -4,-0.4 4,-2.1 -3,-0.3 -1,-0.3 0.847 110.4 54.1 -78.4 -35.4 20.9 5.5 12.5 304 311 A A H X S+ 0 0 3 -4,-1.9 4,-2.9 -3,-0.2 -2,-0.2 0.908 110.3 48.3 -61.3 -43.4 21.2 9.3 12.0 305 312 A V H X S+ 0 0 27 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.965 110.6 49.6 -61.4 -52.2 19.1 9.8 15.1 306 313 A A H X S+ 0 0 56 -4,-2.2 4,-0.9 -5,-0.3 -2,-0.2 0.865 111.1 51.9 -56.2 -33.8 21.2 7.3 17.2 307 314 A I H >X S+ 0 0 22 -4,-2.1 3,-1.1 2,-0.2 4,-0.7 0.966 108.3 49.5 -66.4 -51.9 24.3 9.2 15.9 308 315 A A H >< S+ 0 0 0 -4,-2.9 3,-0.7 1,-0.3 -2,-0.2 0.915 111.2 50.3 -49.7 -47.3 22.8 12.6 17.0 309 316 A K H 3< S+ 0 0 131 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.686 95.9 74.9 -64.7 -21.4 22.1 11.1 20.4 310 317 A A H << S- 0 0 65 -3,-1.1 2,-0.3 -4,-0.9 -1,-0.2 0.828 112.5 -30.8 -64.5 -39.7 25.7 9.8 20.7 311 318 A G << - 0 0 22 -3,-0.7 4,-0.5 -4,-0.7 3,-0.3 -0.973 53.9-105.1-170.7 161.7 27.4 13.1 21.5 312 319 A A S S+ 0 0 62 -2,-0.3 4,-0.3 1,-0.2 -282,-0.1 0.835 121.7 34.8 -61.9 -25.2 27.3 16.8 20.9 313 320 A F S > S+ 0 0 43 1,-0.1 4,-2.2 2,-0.1 5,-0.5 0.443 88.7 92.2-116.9 -2.9 30.2 16.4 18.4 314 321 A N H >>S+ 0 0 27 -3,-0.3 5,-3.1 -7,-0.2 4,-1.3 0.897 91.5 44.4 -62.2 -43.9 29.7 13.1 16.8 315 322 A L H 4>S+ 0 0 4 -4,-0.5 5,-2.6 3,-0.2 -1,-0.2 0.920 120.8 34.9 -70.4 -48.8 27.8 14.5 13.9 316 323 A G H 45S+ 0 0 1 -4,-0.3 -2,-0.2 3,-0.2 -1,-0.2 0.774 129.6 28.5 -81.3 -32.7 29.8 17.5 13.0 317 324 A F H <5S+ 0 0 0 -4,-2.2 -3,-0.2 3,-0.1 -2,-0.2 0.582 134.1 20.7-108.2 -16.3 33.4 16.3 13.8 318 325 A I T X5S+ 0 0 2 -4,-1.3 4,-1.7 -5,-0.5 -3,-0.2 0.727 123.3 36.6-116.7 -68.7 33.1 12.6 13.1 319 326 A T H > S+ 0 0 2 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.859 111.7 55.6 -64.0 -31.5 33.8 14.1 7.5 322 329 A A H < S+ 0 0 1 -4,-1.7 4,-0.5 2,-0.2 -2,-0.2 0.936 110.6 45.2 -61.5 -45.9 33.5 10.3 7.4 323 330 A I H >< S+ 0 0 3 -4,-2.8 3,-1.9 1,-0.2 -1,-0.2 0.938 111.2 51.6 -61.2 -52.6 30.7 10.6 4.9 324 331 A F H >< S+ 0 0 0 -4,-2.8 3,-2.4 1,-0.3 -1,-0.2 0.892 99.2 66.2 -53.2 -36.0 32.6 13.3 2.9 325 332 A S T 3< S+ 0 0 30 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.729 93.8 60.2 -61.0 -21.1 35.6 10.9 2.8 326 333 A Q T < S+ 0 0 96 -3,-1.9 2,-0.3 -4,-0.5 -1,-0.3 0.268 98.6 73.0 -88.0 12.3 33.5 8.5 0.6 327 334 A T S X S- 0 0 23 -3,-2.4 3,-2.1 -4,-0.1 4,-0.2 -0.910 96.4 -90.1-127.8 156.0 33.0 11.2 -2.1 328 335 A A T 3 S+ 0 0 100 -2,-0.3 -2,-0.1 1,-0.3 -3,-0.0 -0.444 116.8 10.6 -69.0 130.3 35.4 12.6 -4.7 329 336 A G T 3> S+ 0 0 55 -2,-0.2 4,-2.0 -4,-0.1 -1,-0.3 0.729 86.8 146.2 70.6 24.0 37.2 15.6 -3.2 330 337 A G H <> + 0 0 3 -3,-2.1 4,-2.5 1,-0.2 -5,-0.2 0.796 63.5 56.5 -63.5 -33.7 35.8 14.7 0.2 331 338 A T H > S+ 0 0 50 2,-0.2 4,-2.0 -4,-0.2 -1,-0.2 0.880 109.3 46.5 -63.2 -42.1 38.8 15.9 2.1 332 339 A F H > S+ 0 0 111 2,-0.2 4,-2.1 -3,-0.2 -2,-0.2 0.855 109.8 53.2 -67.2 -40.8 38.5 19.3 0.6 333 340 A L H X S+ 0 0 11 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.947 108.0 52.4 -55.3 -45.9 34.7 19.3 1.3 334 341 A G H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.947 108.1 51.9 -52.0 -48.9 35.7 18.5 4.9 335 342 A F H X S+ 0 0 31 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.862 109.0 48.4 -53.7 -44.1 38.0 21.5 4.8 336 343 A L H X S+ 0 0 19 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.901 110.9 50.9 -71.1 -42.4 35.2 23.8 3.6 337 344 A W H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.943 114.5 44.4 -51.2 -53.4 32.8 22.5 6.3 338 345 A F H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 -222,-0.2 0.870 112.9 49.8 -64.0 -34.0 35.5 23.2 9.0 339 346 A F H X S+ 0 0 57 -4,-2.4 4,-2.1 -5,-0.3 5,-0.2 0.885 109.6 52.2 -72.9 -40.5 36.3 26.5 7.5 340 347 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.969 111.5 47.6 -52.1 -52.5 32.5 27.3 7.5 341 348 A L H X S+ 0 0 0 -4,-2.8 4,-3.5 1,-0.2 5,-0.2 0.900 109.0 55.6 -58.0 -39.2 32.4 26.3 11.3 342 349 A F H X S+ 0 0 8 -4,-2.4 4,-3.3 -230,-0.2 -1,-0.2 0.938 110.6 40.4 -63.9 -49.6 35.4 28.4 12.0 343 350 A F H X S+ 0 0 30 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.831 115.3 54.1 -68.5 -35.0 34.1 31.7 10.6 344 351 A A H X S+ 0 0 0 -4,-2.2 4,-0.9 -5,-0.2 -2,-0.2 0.949 114.4 40.8 -55.8 -52.0 30.8 30.9 12.1 345 352 A G H >X S+ 0 0 0 -4,-3.5 4,-3.1 -324,-0.2 3,-1.2 0.970 113.9 53.0 -60.1 -53.1 32.5 30.4 15.5 346 353 A L H 3X S+ 0 0 2 -4,-3.3 4,-1.8 1,-0.3 5,-0.2 0.885 105.5 51.7 -56.4 -45.2 34.8 33.4 15.1 347 354 A T H 3< S+ 0 0 3 -4,-2.1 4,-0.3 1,-0.2 -1,-0.3 0.791 117.3 42.8 -63.8 -21.6 32.0 35.9 14.4 348 355 A S H S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.944 105.9 44.0 -61.0 -44.7 31.0 42.4 27.0 356 363 A M H > S+ 0 0 4 -3,-0.5 4,-2.2 -4,-0.2 -2,-0.2 0.917 115.9 49.8 -63.6 -40.2 34.0 41.9 29.3 357 364 A I H X S+ 0 0 1 -4,-1.7 4,-2.9 2,-0.2 5,-0.2 0.937 110.9 48.2 -58.3 -48.7 35.9 44.4 27.1 358 365 A A H X S+ 0 0 0 -4,-3.2 4,-3.4 1,-0.2 5,-0.4 0.905 111.3 51.8 -66.3 -38.5 33.1 47.0 27.2 359 366 A F H X>S+ 0 0 2 -4,-2.6 4,-2.2 -5,-0.2 5,-1.0 0.924 111.5 45.6 -61.3 -47.4 32.9 46.6 31.0 360 367 A L H X5S+ 0 0 8 -4,-2.2 6,-2.3 3,-0.2 4,-0.6 0.919 120.0 40.4 -67.1 -41.3 36.6 47.2 31.4 361 368 A E H X5S+ 0 0 31 -4,-2.9 4,-0.8 4,-0.2 -2,-0.2 0.952 123.6 38.1 -65.1 -51.2 36.5 50.2 29.0 362 369 A D H <5S+ 0 0 17 -4,-3.4 -3,-0.2 -5,-0.2 -2,-0.2 0.941 129.9 24.0 -73.5 -47.1 33.2 51.7 30.3 363 370 A E H <5S+ 0 0 12 -4,-2.2 -3,-0.2 -5,-0.4 -1,-0.1 0.781 134.5 29.7 -97.0 -30.1 33.4 51.0 34.0 364 371 A L H < - 0 0 56 -2,-0.2 4,-2.4 1,-0.1 5,-0.2 -0.333 32.9-105.4 -61.4 158.6 42.0 51.6 27.1 368 375 A R H > S+ 0 0 95 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.908 118.8 55.3 -51.9 -48.5 40.7 49.3 24.3 369 376 A K H > S+ 0 0 129 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.946 113.0 39.7 -49.7 -57.6 44.2 47.6 24.0 370 377 A H H > S+ 0 0 97 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.851 114.2 53.9 -65.8 -35.2 44.4 46.7 27.6 371 378 A A H X S+ 0 0 0 -4,-2.4 4,-1.8 2,-0.2 -1,-0.2 0.902 111.6 45.5 -68.4 -39.1 40.7 45.7 27.9 372 379 A V H X S+ 0 0 2 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.933 115.0 48.3 -70.4 -40.8 41.1 43.3 25.0 373 380 A L H X S+ 0 0 77 -4,-2.3 4,-2.2 -5,-0.3 -2,-0.2 0.882 111.6 46.5 -69.7 -44.3 44.4 41.9 26.3 374 381 A W H X S+ 0 0 161 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.894 113.6 51.1 -62.5 -39.2 43.2 41.3 29.9 375 382 A T H X S+ 0 0 1 -4,-1.8 4,-2.8 -5,-0.2 5,-0.2 0.937 110.3 47.8 -63.0 -48.3 40.1 39.7 28.5 376 383 A A H X S+ 0 0 14 -4,-2.5 4,-3.1 1,-0.2 5,-0.3 0.900 111.6 53.0 -59.5 -39.2 42.1 37.4 26.2 377 384 A A H X S+ 0 0 44 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.894 109.9 45.8 -65.8 -40.9 44.3 36.5 29.2 378 385 A I H X S+ 0 0 27 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.939 116.7 44.8 -66.4 -45.8 41.4 35.6 31.4 379 386 A V H X S+ 0 0 0 -4,-2.8 4,-1.7 2,-0.2 -2,-0.2 0.949 115.8 47.0 -65.1 -46.3 39.7 33.5 28.7 380 387 A F H X S+ 0 0 57 -4,-3.1 4,-0.7 -5,-0.2 -2,-0.2 0.945 114.6 46.7 -58.0 -52.8 43.1 31.8 27.7 381 388 A F H >< S+ 0 0 132 -4,-2.3 3,-1.5 -5,-0.3 4,-0.3 0.962 113.5 47.0 -51.5 -56.4 44.0 31.1 31.3 382 389 A S H >X S+ 0 0 2 -4,-2.5 3,-1.5 1,-0.3 4,-0.6 0.744 97.5 71.8 -63.3 -28.7 40.6 29.6 32.2 383 390 A A H 3X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.3 -1,-0.3 0.713 78.0 78.0 -67.8 -18.7 40.4 27.5 29.1 384 391 A H H S+ 0 0 37 -3,-1.5 4,-2.4 -4,-0.3 7,-0.3 0.961 110.9 41.3 -65.9 -48.8 40.3 23.7 32.7 386 393 A V H < S+ 0 0 2 -4,-0.6 7,-0.3 2,-0.2 -2,-0.2 0.857 115.8 51.0 -66.6 -36.3 38.2 22.9 29.6 387 394 A M H < S+ 0 0 0 -4,-2.8 -2,-0.2 1,-0.1 -1,-0.2 0.873 124.5 25.6 -68.3 -36.7 41.3 21.6 27.7 388 395 A F H < S+ 0 0 82 -4,-2.3 -233,-2.5 -5,-0.2 2,-0.6 0.587 105.4 71.9-108.7 -15.0 42.4 19.3 30.5 389 396 A L B >< S-A 154 0A 14 -4,-2.4 3,-1.9 -235,-0.2 4,-0.5 -0.909 80.1-126.3-113.1 111.2 39.5 18.2 32.7 390 397 A N T 3 S+ 0 0 30 -237,-2.1 -3,-0.1 -2,-0.6 -2,-0.1 -0.360 92.0 8.0 -58.0 134.3 37.2 15.8 31.0 391 398 A K T 3> S+ 0 0 126 -5,-0.1 4,-1.7 1,-0.1 -1,-0.3 0.399 90.2 115.9 68.9 2.6 33.5 17.1 31.1 392 399 A S H <> S+ 0 0 1 -3,-1.9 4,-2.5 -7,-0.3 5,-0.2 0.928 77.2 54.0 -57.4 -44.6 34.4 20.5 32.5 393 400 A L H > S+ 0 0 23 -4,-0.5 4,-2.5 -7,-0.3 -1,-0.2 0.914 106.3 50.5 -54.7 -44.7 33.1 21.9 29.1 394 401 A D H > S+ 0 0 78 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.868 109.9 51.5 -63.7 -39.9 29.7 20.2 29.6 395 402 A E H X S+ 0 0 18 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.900 111.8 44.6 -65.0 -46.9 29.5 21.6 33.1 396 403 A M H X>S+ 0 0 0 -4,-2.5 4,-2.2 1,-0.2 5,-1.1 0.868 111.6 54.0 -64.3 -39.5 30.1 25.2 32.0 397 404 A D H <5S+ 0 0 41 -4,-2.5 5,-0.2 -5,-0.2 -2,-0.2 0.857 110.9 47.5 -62.3 -36.6 27.7 24.8 29.0 398 405 A F H X>S+ 0 0 87 -4,-1.7 5,-2.1 3,-0.2 4,-1.0 0.972 117.4 37.4 -68.3 -56.5 25.0 23.7 31.4 399 406 A W H <>S+ 0 0 94 -4,-2.3 5,-1.5 4,-0.2 -2,-0.2 0.904 135.3 18.6 -68.4 -42.9 25.3 26.4 34.1 400 407 A A T <>S+ 0 0 0 -4,-2.2 5,-0.9 -5,-0.2 -3,-0.2 0.919 129.9 40.2 -92.7 -53.0 26.1 29.3 31.9 401 408 A G T 4S+ 0 0 50 -4,-2.7 5,-2.5 1,-0.2 4,-1.8 0.924 115.6 50.8 -60.3 -47.3 11.3 41.6 34.6 415 422 A I H <>S+ 0 0 2 -4,-2.8 5,-2.4 -5,-0.3 -1,-0.2 0.936 122.2 29.6 -58.4 -45.0 13.9 44.3 35.1 416 423 A F H <5S+ 0 0 0 -4,-2.3 9,-0.2 3,-0.2 -2,-0.2 0.904 129.8 32.7 -86.5 -39.8 13.1 46.1 31.9 417 424 A F H <5S+ 0 0 0 -4,-3.3 -3,-0.2 -5,-0.3 5,-0.2 0.659 130.4 25.2-100.0 -18.9 9.4 45.5 31.3 418 425 A W T <5S+ 0 0 129 -4,-1.8 4,-0.4 -5,-0.5 -3,-0.2 0.794 128.5 31.4-108.2 -52.2 8.0 45.2 34.8 419 426 A I T - 0 0 19 -5,-0.2 4,-3.0 -6,-0.2 5,-0.2 0.148 21.1-131.6 129.4 112.7 8.1 50.2 33.4 422 429 A A H > S+ 0 0 8 -4,-0.4 4,-2.9 1,-0.2 5,-0.1 0.886 111.4 43.8 -51.3 -42.1 6.2 48.3 30.7 423 430 A D H > S+ 0 0 106 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.862 114.1 48.1 -78.6 -35.6 5.2 51.6 28.9 424 431 A K H > S+ 0 0 125 2,-0.2 4,-2.0 3,-0.2 -2,-0.2 0.870 113.4 49.2 -68.7 -37.0 8.6 53.2 29.2 425 432 A A H X S+ 0 0 0 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.973 112.2 48.9 -63.4 -50.7 10.1 49.9 27.9 426 433 A W H X S+ 0 0 48 -4,-2.9 4,-2.4 1,-0.2 5,-0.2 0.931 113.1 46.3 -51.5 -53.4 7.6 49.9 25.0 427 434 A E H X S+ 0 0 129 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.887 112.3 50.8 -57.1 -41.9 8.4 53.5 24.2 428 435 A E H < S+ 0 0 23 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.894 109.7 50.4 -70.8 -36.4 12.1 52.9 24.4 429 436 A I H < S+ 0 0 0 -4,-2.8 -161,-0.4 1,-0.2 -1,-0.2 0.919 116.9 40.1 -61.9 -46.1 12.0 49.9 22.1 430 437 A N H >< S+ 0 0 22 -4,-2.4 3,-3.2 -5,-0.2 -2,-0.2 0.767 83.4 115.2 -82.0 -24.8 10.0 51.8 19.4 431 438 A R T 3< S+ 0 0 63 -4,-2.2 -163,-0.2 1,-0.3 -162,-0.1 -0.220 92.6 7.6 -51.1 124.3 11.8 55.1 19.6 432 439 A G T 3 S+ 0 0 37 1,-0.3 -1,-0.3 -165,-0.1 -165,-0.1 0.427 93.1 163.2 78.5 3.1 13.5 55.7 16.2 433 440 A G < - 0 0 31 -3,-3.2 -1,-0.3 1,-0.2 3,-0.1 -0.240 38.5-158.6 -54.0 135.4 11.8 52.6 14.8 434 441 A I S S+ 0 0 108 1,-0.2 2,-0.3 -168,-0.0 -1,-0.2 0.719 94.6 17.0 -80.6 -30.1 11.8 52.4 11.0 435 442 A I S S- 0 0 70 -5,-0.1 2,-0.3 -3,-0.0 -166,-0.2 -0.898 90.1-118.8-126.0 166.9 8.8 50.1 11.8 436 443 A K - 0 0 172 -2,-0.3 3,-0.1 -3,-0.1 -6,-0.0 -0.786 31.4-105.4 -98.1 149.5 6.8 49.8 15.0 437 444 A V - 0 0 6 -2,-0.3 5,-0.1 -11,-0.1 -7,-0.0 -0.535 48.3 -98.1 -65.6 131.8 6.6 46.6 17.0 438 445 A P > - 0 0 67 0, 0.0 3,-1.3 0, 0.0 4,-0.4 -0.304 31.0-125.4 -50.6 138.8 3.2 45.0 16.4 439 446 A R T >> S+ 0 0 176 1,-0.3 3,-1.5 2,-0.2 4,-0.7 0.793 106.2 65.1 -60.6 -38.4 0.9 45.9 19.3 440 447 A I H >> S+ 0 0 114 1,-0.2 4,-1.8 2,-0.2 3,-0.8 0.844 93.8 67.5 -51.9 -30.4 -0.0 42.3 20.3 441 448 A Y H <> S+ 0 0 34 -3,-1.3 4,-3.5 1,-0.3 5,-0.3 0.796 86.3 65.8 -66.5 -26.0 3.7 42.0 21.2 442 449 A Y H <> S+ 0 0 25 -3,-1.5 4,-2.2 -4,-0.4 -1,-0.3 0.929 106.7 41.6 -58.5 -41.7 3.3 44.5 24.0 443 450 A Y H S+ 0 0 95 -3,-0.8 4,-2.7 -4,-0.7 5,-1.3 0.890 112.9 54.1 -74.3 -37.1 1.1 41.8 25.7 444 451 A V H <>S+ 0 0 12 -4,-1.8 5,-2.4 3,-0.2 4,-0.5 0.968 113.1 43.2 -59.5 -49.0 3.5 39.0 24.7 445 452 A M H <5S+ 0 0 0 -4,-3.5 -2,-0.2 1,-0.2 -1,-0.2 0.863 119.2 41.2 -65.6 -40.9 6.4 40.8 26.3 446 453 A R H <5S+ 0 0 82 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.890 137.6 2.5 -76.2 -37.8 4.6 41.9 29.5 447 454 A Y T X5S+ 0 0 118 -4,-2.7 4,-1.4 -5,-0.2 -3,-0.2 0.804 125.5 46.5-117.9 -43.6 2.6 38.7 30.2 448 455 A I H > S+ 0 0 7 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.901 116.5 45.0 -57.1 -36.6 7.6 35.9 31.3 451 458 A A H X S+ 0 0 53 -4,-1.4 4,-2.9 2,-0.2 5,-0.2 0.960 112.0 51.5 -68.7 -52.2 4.9 33.2 32.1 452 459 A F H X S+ 0 0 52 -4,-3.2 4,-2.1 1,-0.2 5,-0.2 0.931 115.5 43.0 -44.0 -54.3 6.2 30.9 29.3 453 460 A L H X S+ 0 0 0 -4,-2.8 4,-2.2 -5,-0.3 -1,-0.2 0.826 111.8 51.1 -70.2 -34.6 9.7 31.2 30.8 454 461 A A H X S+ 0 0 41 -4,-2.0 4,-2.3 -5,-0.3 -1,-0.2 0.928 110.9 49.9 -71.1 -37.5 8.8 30.9 34.4 455 462 A V H X S+ 0 0 95 -4,-2.9 4,-2.1 1,-0.2 3,-0.2 0.984 112.9 45.6 -61.1 -56.1 6.8 27.7 33.7 456 463 A L H < S+ 0 0 29 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.874 111.4 53.4 -50.1 -47.1 9.7 26.1 31.7 457 464 A L H < S+ 0 0 56 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.921 104.7 53.8 -61.2 -43.2 12.2 27.1 34.4 458 465 A V H < 0 0 130 -4,-2.3 -2,-0.2 -3,-0.2 -1,-0.2 0.967 360.0 360.0 -56.9 -51.8 10.1 25.4 37.2 459 466 A V < 0 0 119 -4,-2.1 -3,-0.1 -5,-0.2 -2,-0.1 0.788 360.0 360.0 -79.5 360.0 10.1 22.2 35.2 460 ! 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 0.0 461 479 A T 0 0 152 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 176.5 27.7 13.1 38.3 462 480 A H > - 0 0 94 1,-0.1 3,-1.6 3,-0.0 4,-0.2 -0.323 360.0-112.7 -64.9 151.6 31.5 12.5 38.9 463 481 A W T > S+ 0 0 170 1,-0.3 3,-1.5 2,-0.2 4,-0.3 0.695 108.6 74.8 -66.4 -23.5 33.1 14.4 41.8 464 482 A T T >> S+ 0 0 10 1,-0.3 3,-1.2 2,-0.2 4,-1.1 0.718 74.3 78.8 -65.5 -21.3 35.3 16.5 39.3 465 483 A V H <> S+ 0 0 13 -3,-1.6 4,-2.4 1,-0.2 -1,-0.3 0.824 86.3 63.9 -49.0 -34.5 32.2 18.6 38.3 466 484 A W H <> S+ 0 0 159 -3,-1.5 4,-2.6 -4,-0.2 -1,-0.2 0.805 92.9 60.3 -64.0 -31.0 33.0 20.4 41.6 467 485 A I H <> S+ 0 0 60 -3,-1.2 4,-2.1 -4,-0.3 -1,-0.2 0.966 111.2 40.7 -57.6 -45.2 36.4 21.6 40.2 468 486 A T H X S+ 0 0 0 -4,-1.1 4,-2.9 2,-0.2 5,-0.3 0.929 114.9 49.3 -74.5 -44.7 34.5 23.4 37.5 469 487 A R H X S+ 0 0 49 -4,-2.4 4,-2.4 1,-0.2 5,-0.3 0.961 112.1 50.6 -56.5 -47.0 31.6 24.7 39.7 470 488 A F H X S+ 0 0 159 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.948 112.2 45.9 -59.3 -45.6 34.2 25.9 42.2 471 489 A Y H X S+ 0 0 61 -4,-2.1 4,-2.3 -5,-0.2 -1,-0.2 0.920 114.0 46.3 -67.4 -43.0 36.2 27.8 39.5 472 490 A I H X S+ 0 0 4 -4,-2.9 4,-1.3 2,-0.2 -1,-0.2 0.799 110.6 53.3 -78.3 -21.7 33.3 29.4 37.8 473 491 A I H X S+ 0 0 92 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.910 107.7 52.5 -66.7 -42.0 31.8 30.5 41.1 474 492 A G H X S+ 0 0 35 -4,-2.3 4,-2.5 -5,-0.3 -2,-0.2 0.932 106.2 54.1 -57.2 -43.5 35.2 32.0 41.8 475 493 A L H X S+ 0 0 9 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.882 106.7 50.8 -55.6 -42.4 34.8 33.8 38.4 476 494 A F H X S+ 0 0 35 -4,-1.3 4,-2.4 1,-0.2 -2,-0.2 0.938 111.1 48.4 -65.3 -41.3 31.4 35.2 39.6 477 495 A L H X S+ 0 0 115 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.878 110.5 51.8 -65.0 -38.8 33.0 36.5 42.8 478 496 A F H X S+ 0 0 79 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.914 112.2 44.8 -63.9 -43.8 35.9 38.1 40.9 479 497 A L H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.876 110.4 54.7 -70.7 -36.0 33.6 39.9 38.5 480 498 A T H X S+ 0 0 43 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.920 108.1 51.0 -61.1 -39.5 31.4 41.0 41.5 481 499 A F H X S+ 0 0 114 -4,-2.4 4,-2.1 1,-0.2 -1,-0.2 0.851 106.9 53.0 -62.7 -36.8 34.6 42.4 43.0 482 500 A L H X S+ 0 0 18 -4,-1.4 4,-1.8 2,-0.2 -1,-0.2 0.870 107.6 51.4 -72.3 -32.5 35.3 44.3 39.8 483 501 A V H X S+ 0 0 13 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.927 108.2 52.5 -64.4 -42.7 31.9 45.9 39.9 484 502 A F H X S+ 0 0 88 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.917 110.4 47.3 -59.8 -44.7 32.6 46.9 43.5 485 503 A L H X S+ 0 0 69 -4,-2.1 4,-1.7 1,-0.2 -1,-0.2 0.845 110.1 53.8 -64.8 -32.4 35.8 48.6 42.3 486 504 A A H X S+ 0 0 6 -4,-1.8 4,-1.4 2,-0.2 -2,-0.2 0.920 108.3 48.0 -70.3 -43.4 34.0 50.3 39.5 487 505 A E H X S+ 0 0 32 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.841 111.7 51.0 -67.3 -30.7 31.4 51.7 41.8 488 506 A R H X S+ 0 0 109 -4,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.806 104.5 56.9 -76.8 -27.9 34.2 53.0 44.2 489 507 A R H < S+ 0 0 88 -4,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.872 103.5 55.7 -68.8 -30.9 35.9 54.6 41.2 490 508 A R H < S+ 0 0 150 -4,-1.4 -2,-0.2 2,-0.2 -1,-0.2 0.926 105.5 51.3 -60.5 -46.8 32.6 56.6 40.6 491 509 A N H < 0 0 129 -4,-1.3 -2,-0.2 1,-0.3 -1,-0.2 0.963 360.0 360.0 -58.3 -58.2 32.7 58.0 44.2 492 510 A H < 0 0 201 -4,-1.8 -1,-0.3 0, 0.0 -2,-0.2 0.513 360.0 360.0 -56.9 360.0 36.4 59.2 43.8 493 ! 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 0.0 494 601 A L 0 0 0 0, 0.0 -471,-2.5 0, 0.0 -472,-0.5 0.000 360.0 360.0 360.0 360.0 25.7 31.8 18.8