==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 01-APR-09 3GWW . COMPND 2 MOLECULE: TRANSPORTER; . SOURCE 2 ORGANISM_SCIENTIFIC: AQUIFEX AEOLICUS; . AUTHOR Z.ZHOU,J.ZHEN,N.K.KARPOWICH,C.J.LAW,M.E.A.REITH,D.N.WANG . 502 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19693.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 402 80.1 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 . 7 1.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 301 60.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 30 6.0 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 3 3 3 4 0 0 1 1 0 3 3 0 1 0 1 1 0 0 1 0 0 1 1 0 0 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 5 A R 0 0 103 0, 0.0 2,-0.2 0, 0.0 259,-0.0 0.000 360.0 360.0 360.0 147.9 31.1 56.1 22.3 2 6 A E - 0 0 51 259,-0.0 2,-0.3 257,-0.0 176,-0.0 -0.478 360.0-170.1 -65.0 141.2 31.8 53.7 19.4 3 7 A H - 0 0 54 -2,-0.2 2,-0.3 259,-0.0 177,-0.3 -0.952 30.1 -97.9-133.6 155.5 29.0 53.3 16.9 4 8 A W - 0 0 7 256,-1.5 258,-0.2 -2,-0.3 176,-0.1 -0.563 30.2-148.4 -68.1 132.3 28.2 51.0 14.0 5 9 A A S S+ 0 0 79 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.964 72.2 24.7 -69.5 -54.8 29.2 52.7 10.7 6 10 A T > - 0 0 56 1,-0.1 4,-1.6 174,-0.1 5,-0.1 -0.740 68.5-127.0-114.9 159.9 26.6 51.3 8.3 7 11 A R H > S+ 0 0 82 -2,-0.3 4,-2.1 2,-0.2 5,-0.1 0.920 114.0 47.2 -64.4 -48.5 23.1 49.9 8.6 8 12 A L H > S+ 0 0 111 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.859 109.2 55.5 -63.1 -37.6 24.0 46.7 6.7 9 13 A G H > S+ 0 0 0 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.886 107.8 48.9 -61.3 -42.1 27.1 46.4 8.9 10 14 A L H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.931 112.9 47.0 -60.6 -48.8 25.0 46.5 12.0 11 15 A I H X S+ 0 0 20 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.922 114.3 46.6 -61.1 -46.9 22.6 43.8 10.6 12 16 A L H X S+ 0 0 30 -4,-2.8 4,-1.9 2,-0.2 -1,-0.2 0.823 112.5 49.9 -68.1 -33.5 25.4 41.5 9.5 13 17 A A H X S+ 0 0 1 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.895 113.7 45.7 -70.1 -41.5 27.2 41.8 12.8 14 18 A M H X S+ 0 0 2 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.866 114.3 47.7 -68.2 -39.9 24.1 41.1 14.8 15 19 A A H X S+ 0 0 1 -4,-2.6 4,-3.6 2,-0.2 -2,-0.2 0.851 110.4 53.2 -67.5 -35.5 23.3 38.1 12.4 16 20 A G H < S+ 0 0 1 -4,-1.9 -2,-0.2 2,-0.2 -1,-0.2 0.813 105.4 55.5 -66.5 -33.5 26.9 37.0 12.9 17 21 A N H < S+ 0 0 0 -4,-1.6 -2,-0.2 1,-0.1 -1,-0.2 0.969 119.7 30.3 -56.6 -55.9 26.3 37.2 16.6 18 22 A A H < S+ 0 0 1 -4,-1.9 2,-1.0 229,-0.1 4,-0.2 0.937 104.3 75.7 -74.1 -51.6 23.3 34.8 16.3 19 23 A V S < S+ 0 0 5 -4,-3.6 2,-0.2 485,-0.1 327,-0.1 -0.524 75.9 116.8 -69.0 101.3 24.3 32.6 13.3 20 24 A G S >> S- 0 0 0 -2,-1.0 3,-1.1 226,-0.1 4,-0.7 -0.536 81.3 -48.3-142.7-155.0 26.9 30.4 14.9 21 25 A L H 3>>S+ 0 0 7 483,-0.5 4,-2.2 1,-0.2 5,-1.0 0.720 123.3 68.6 -63.7 -23.0 27.8 26.8 15.9 22 26 A G H 34>S+ 0 0 0 482,-2.7 5,-2.9 -4,-0.2 -1,-0.2 0.822 94.9 55.3 -64.6 -33.7 24.3 26.5 17.4 23 27 A N H <45S+ 0 0 0 -3,-1.1 -1,-0.2 -5,-0.2 -2,-0.2 0.820 121.0 26.2 -66.8 -34.5 22.8 26.6 13.9 24 28 A F H <5S+ 0 0 1 -4,-0.7 -2,-0.2 -3,-0.3 266,-0.2 0.607 135.6 22.2-111.4 -17.7 24.8 23.7 12.5 25 29 A L T X5S+ 0 0 14 -4,-2.2 4,-1.0 -5,-0.1 -3,-0.2 0.744 124.4 38.7-118.4 -47.4 25.7 21.6 15.6 26 30 A R H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.910 114.0 47.3 -58.6 -41.9 20.3 19.3 14.4 29 33 A V H X S+ 0 0 8 -4,-1.0 4,-2.2 2,-0.2 -2,-0.2 0.940 112.7 48.1 -63.1 -49.6 21.1 17.3 17.6 30 34 A Q H < S+ 0 0 35 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.895 115.6 44.9 -57.7 -44.1 18.2 18.8 19.6 31 35 A A H ><>S+ 0 0 0 -4,-2.6 5,-2.1 -5,-0.2 3,-0.9 0.921 112.8 49.3 -68.2 -46.5 15.7 18.2 16.7 32 36 A A H ><5S+ 0 0 2 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.865 111.9 49.5 -60.5 -39.5 16.8 14.6 16.0 33 37 A E T 3<5S+ 0 0 57 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.592 110.6 52.6 -74.3 -13.8 16.6 13.7 19.7 34 38 A N T < 5S- 0 0 17 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.2 -0.158 126.2 -85.2-121.6 37.3 13.1 15.2 20.0 35 39 A G T X 5 - 0 0 26 -3,-0.8 3,-2.6 3,-0.2 2,-0.7 0.785 53.4-112.0 68.6 32.7 11.2 13.5 17.2 36 40 A G T >> S+ 0 0 1 184,-1.4 4,-1.1 -2,-0.7 -1,-0.3 0.669 115.3 66.7 -72.5 -19.0 8.8 17.5 13.5 38 42 A A H <4 S+ 0 0 0 -3,-2.6 -1,-0.2 187,-0.2 -2,-0.2 0.758 104.4 45.5 -67.9 -28.1 7.7 16.9 17.1 39 43 A F H <> S+ 0 0 0 -3,-0.8 4,-2.0 -8,-0.2 -2,-0.2 0.812 103.3 64.9 -80.6 -35.5 10.4 19.4 18.1 40 44 A M H X S+ 0 0 5 -4,-1.0 4,-3.1 182,-0.2 5,-0.2 0.804 94.0 57.0 -65.4 -36.6 9.6 22.0 15.4 41 45 A I H X S+ 0 0 44 -4,-1.1 4,-2.6 2,-0.2 5,-0.2 0.977 112.3 40.6 -60.9 -57.7 6.1 22.9 16.7 42 46 A P H > S+ 0 0 0 0, 0.0 4,-2.9 0, 0.0 -2,-0.2 0.873 115.8 55.1 -53.7 -37.9 7.4 23.9 20.1 43 47 A Y H X S+ 0 0 4 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.920 110.2 42.5 -62.5 -49.3 10.4 25.5 18.4 44 48 A I H X S+ 0 0 74 -4,-3.1 4,-2.2 2,-0.2 5,-0.2 0.927 116.0 49.6 -62.8 -47.0 8.2 27.7 16.1 45 49 A I H X S+ 0 0 58 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.932 111.4 48.6 -57.3 -48.1 5.9 28.6 19.0 46 50 A A H X>S+ 0 0 0 -4,-2.9 4,-2.4 1,-0.2 5,-2.2 0.842 108.9 54.3 -63.2 -35.0 8.8 29.5 21.2 47 51 A F H <>S+ 0 0 32 -4,-1.9 5,-2.6 3,-0.2 -1,-0.2 0.917 114.2 40.4 -63.2 -43.8 10.3 31.6 18.4 48 52 A L H <5S+ 0 0 84 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.848 126.5 33.5 -73.2 -35.8 7.0 33.6 18.1 49 53 A L H <5S+ 0 0 58 -4,-2.6 -2,-0.2 -5,-0.2 -3,-0.2 0.635 137.4 11.2 -98.8 -19.0 6.3 33.9 21.9 50 54 A V T X5S+ 0 0 0 -4,-2.4 4,-2.0 -5,-0.3 5,-0.2 0.674 122.6 50.5-123.3 -52.7 9.8 34.1 23.4 51 55 A G H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -2,-0.2 0.891 114.4 47.4 -58.3 -42.5 9.8 39.6 22.0 54 58 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.789 106.2 59.3 -69.0 -30.2 13.1 39.2 23.9 55 59 A M H X S+ 0 0 2 -4,-1.6 4,-2.1 -3,-0.3 -1,-0.2 0.954 109.9 42.0 -59.4 -51.4 15.1 40.2 20.8 56 60 A W H X S+ 0 0 6 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.890 113.5 53.9 -62.5 -41.5 13.4 43.6 20.7 57 61 A I H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.896 110.4 45.9 -59.5 -43.4 13.7 43.9 24.5 58 62 A E H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.866 112.3 49.9 -70.6 -38.4 17.5 43.3 24.4 59 63 A W H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 5,-0.2 0.893 111.8 50.8 -61.4 -42.2 17.9 45.8 21.5 60 64 A A H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.942 111.3 45.8 -60.3 -51.2 15.9 48.3 23.5 61 65 A M H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.876 113.6 50.4 -61.6 -40.6 18.0 47.9 26.7 62 66 A G H X S+ 0 0 0 -4,-2.2 4,-3.3 2,-0.2 5,-0.2 0.954 113.0 43.0 -62.7 -55.0 21.2 48.1 24.7 63 67 A R H X S+ 0 0 0 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.883 115.3 50.7 -59.1 -42.7 20.4 51.3 22.8 64 68 A Y H < S+ 0 0 48 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.904 114.9 44.3 -59.9 -43.6 19.0 52.8 26.0 65 69 A G H ><>S+ 0 0 0 -4,-2.3 5,-2.3 -5,-0.2 3,-1.2 0.920 110.7 52.3 -67.0 -47.8 22.2 51.9 27.8 66 70 A G H ><5S+ 0 0 6 -4,-3.3 3,-1.6 1,-0.3 -1,-0.2 0.818 98.6 64.8 -60.3 -35.4 24.6 53.0 25.1 67 71 A A T 3<5S+ 0 0 53 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.769 108.8 41.2 -58.5 -27.6 23.0 56.5 24.9 68 72 A Q T < 5S- 0 0 90 -3,-1.2 -1,-0.3 -4,-0.5 -2,-0.2 0.268 127.8 -97.7-104.9 7.7 24.2 57.0 28.5 69 73 A G T < 5S+ 0 0 30 -3,-1.6 2,-0.5 1,-0.2 -3,-0.2 0.634 85.4 119.0 89.7 17.9 27.6 55.4 28.0 70 74 A H < + 0 0 43 -5,-2.3 -2,-0.2 -8,-0.1 -1,-0.2 -0.953 31.0 174.2-125.0 119.4 26.9 51.9 29.4 71 75 A G + 0 0 0 -2,-0.5 2,-0.2 286,-0.3 188,-0.2 0.634 59.2 63.0 -93.5 -16.4 27.1 48.7 27.3 72 76 A T S >> S- 0 0 1 285,-0.2 4,-2.3 -7,-0.1 3,-0.5 -0.740 80.9-110.6-122.4 163.8 26.6 45.9 29.9 73 77 A T H 3> S+ 0 0 1 -2,-0.2 4,-2.7 17,-0.2 5,-0.3 0.720 104.8 65.9 -67.8 -31.0 23.9 44.7 32.3 74 78 A P H 3> S+ 0 0 3 0, 0.0 4,-0.7 0, 0.0 -1,-0.2 0.957 117.5 29.6 -53.1 -47.9 25.4 45.6 35.7 75 79 A A H <> S+ 0 0 14 -3,-0.5 4,-2.0 2,-0.2 -2,-0.2 0.902 121.7 51.3 -75.8 -44.7 25.0 49.3 34.8 76 80 A I H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -3,-0.2 0.889 108.3 51.5 -62.7 -43.1 22.0 49.0 32.5 77 81 A F H X S+ 0 0 0 -4,-2.7 4,-1.3 1,-0.2 -1,-0.2 0.823 111.1 49.8 -60.3 -34.6 19.9 47.0 35.1 78 82 A Y H < S+ 0 0 59 -4,-0.7 -2,-0.2 -5,-0.3 -1,-0.2 0.847 106.9 54.1 -73.3 -36.9 20.7 49.8 37.6 79 83 A L H < S+ 0 0 20 -4,-2.0 3,-0.2 1,-0.2 -2,-0.2 0.859 115.3 40.1 -62.4 -37.4 19.6 52.4 35.1 80 84 A L H < S+ 0 0 9 -4,-1.8 2,-0.3 1,-0.3 -2,-0.2 0.702 132.3 25.1 -83.4 -24.2 16.3 50.6 34.7 81 85 A W S < S- 0 0 67 -4,-1.3 2,-3.0 -5,-0.2 -1,-0.3 -0.828 74.0-147.7-147.0 99.3 16.0 49.9 38.5 82 86 A R + 0 0 157 -2,-0.3 2,-0.3 -3,-0.2 -4,-0.1 -0.336 60.1 117.3 -71.2 67.6 17.9 52.2 40.9 83 87 A N S >> S- 0 0 62 -2,-3.0 3,-1.1 -6,-0.2 4,-0.9 -0.993 71.5-129.6-140.8 139.9 18.6 49.4 43.3 84 88 A R H >> S+ 0 0 131 -2,-0.3 4,-1.0 1,-0.3 3,-0.6 0.852 110.0 58.4 -53.7 -39.3 21.8 47.7 44.6 85 89 A F H 3> S+ 0 0 108 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.735 95.4 63.8 -67.4 -24.3 20.4 44.3 43.9 86 90 A A H <> S+ 0 0 0 -3,-1.1 4,-1.8 -5,-0.2 -1,-0.2 0.862 99.9 53.0 -66.8 -36.8 20.0 45.2 40.2 87 91 A K H < S+ 0 0 69 -4,-1.0 3,-1.0 2,-0.2 4,-0.5 0.913 111.8 47.3 -72.7 -45.1 24.2 42.0 41.3 89 93 A L H >< S+ 0 0 24 -4,-2.3 3,-1.2 1,-0.2 4,-0.4 0.852 105.2 63.8 -59.2 -35.4 21.6 40.5 39.0 90 94 A G H >< S+ 0 0 0 -4,-1.8 3,-1.0 1,-0.2 -1,-0.2 0.714 84.8 74.3 -61.2 -23.8 23.4 42.4 36.2 91 95 A V T XX S+ 0 0 1 -3,-1.0 4,-3.1 -4,-0.5 3,-2.4 0.843 83.8 66.3 -60.1 -34.9 26.6 40.3 36.9 92 96 A F H <> S+ 0 0 47 -3,-1.2 4,-3.0 -4,-0.5 -1,-0.2 0.845 92.5 61.7 -54.9 -34.9 24.9 37.4 35.1 93 97 A G H <4 S+ 0 0 1 -3,-1.0 -1,-0.3 -4,-0.4 -20,-0.2 0.437 114.3 33.8 -74.3 -1.4 25.0 39.4 31.9 94 98 A L H <> S+ 0 0 2 -3,-2.4 4,-1.3 -4,-0.1 -2,-0.2 0.603 119.0 51.8-109.9 -38.8 28.8 39.4 32.2 95 99 A W H X S+ 0 0 18 -4,-3.1 4,-2.7 2,-0.2 5,-0.3 0.926 106.5 52.4 -64.4 -51.0 29.1 35.9 33.8 96 100 A I H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.946 112.7 41.9 -54.2 -57.0 27.0 34.1 31.2 97 101 A P H > S+ 0 0 1 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.788 115.6 52.0 -66.4 -26.1 28.9 35.3 28.1 98 102 A L H X S+ 0 0 0 -4,-1.3 4,-1.6 2,-0.2 -2,-0.2 0.957 113.2 41.9 -70.5 -52.5 32.3 34.8 29.8 99 103 A V H X S+ 0 0 0 -4,-2.7 4,-0.9 2,-0.2 5,-0.2 0.917 116.0 50.0 -60.1 -45.1 31.6 31.2 30.9 100 104 A V H >X S+ 0 0 0 -4,-2.7 4,-2.7 -5,-0.3 3,-0.9 0.931 108.9 52.6 -59.9 -45.3 30.1 30.4 27.5 101 105 A A H 3X S+ 0 0 0 -4,-1.8 4,-2.0 250,-0.3 5,-0.4 0.820 97.9 67.3 -56.8 -35.3 33.1 31.9 25.7 102 106 A I H 3< S+ 0 0 0 -4,-1.6 -1,-0.2 1,-0.2 4,-0.2 0.840 117.4 21.8 -60.7 -35.9 35.4 29.7 27.8 103 107 A Y H S+ 0 0 4 -5,-0.4 4,-1.2 2,-0.2 -2,-0.2 0.936 110.0 43.9 -68.5 -47.0 37.5 26.0 22.3 107 111 A I H >X S+ 0 0 12 -4,-2.1 4,-1.3 1,-0.2 3,-0.6 0.923 111.7 56.1 -60.8 -43.3 34.9 24.2 20.2 108 112 A E H 3X S+ 0 0 0 -4,-3.1 4,-1.3 1,-0.2 3,-0.3 0.873 103.4 54.5 -53.4 -41.1 35.5 26.9 17.6 109 113 A S H 3X S+ 0 0 0 -4,-1.8 4,-2.5 1,-0.2 -1,-0.2 0.794 100.0 60.3 -67.7 -28.4 39.2 26.0 17.5 110 114 A W H S+ 0 0 47 -4,-2.1 5,-1.9 1,-0.2 4,-0.4 0.815 114.0 47.9 -64.9 -32.4 43.8 18.8 8.5 118 122 A F H <5S+ 0 0 5 -4,-2.5 -1,-0.2 3,-0.2 -2,-0.2 0.847 110.8 50.6 -77.0 -35.4 41.1 18.3 5.9 119 123 A L H <5S+ 0 0 97 -4,-2.4 -2,-0.2 -5,-0.3 -1,-0.2 0.885 116.5 41.0 -64.7 -40.5 42.6 20.9 3.5 120 124 A V T <5S- 0 0 100 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.516 112.9-121.8 -88.1 -8.1 46.0 19.3 3.8 121 125 A G T 5 + 0 0 34 -4,-0.4 2,-1.8 -5,-0.2 -3,-0.2 0.672 63.4 143.9 75.7 18.4 44.5 15.8 3.7 122 126 A L < + 0 0 111 -5,-1.9 -1,-0.2 -6,-0.2 -3,-0.1 -0.496 40.7 118.5 -83.8 66.7 45.8 14.6 7.0 123 127 A V - 0 0 17 -2,-1.8 13,-0.1 -5,-0.1 207,-0.0 -0.885 68.8 -95.5-133.6 157.3 42.6 12.7 7.6 124 128 A P - 0 0 27 0, 0.0 -1,-0.0 0, 0.0 12,-0.0 -0.281 34.0-145.4 -71.8 163.4 41.7 9.0 8.1 125 129 A E - 0 0 153 200,-0.0 200,-0.1 10,-0.0 196,-0.0 -0.984 17.2-112.5-130.0 141.7 40.4 6.8 5.3 126 130 A P 0 0 32 0, 0.0 6,-0.1 0, 0.0 5,-0.0 -0.435 360.0 360.0 -67.3 146.0 37.8 4.0 5.2 127 131 A P 0 0 146 0, 0.0 4,-0.0 0, 0.0 0, 0.0 0.030 360.0 360.0 -71.8 360.0 39.3 0.5 4.6 128 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 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0, 0.0 5,-0.2 0.740 89.5 67.8 -65.7 -24.1 7.8 18.9 29.0 234 242 A G H 3> S+ 0 0 18 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.786 99.0 49.5 -65.8 -30.4 11.3 17.8 28.0 235 243 A V H <> S+ 0 0 0 -3,-0.9 4,-2.7 -6,-0.2 -1,-0.2 0.893 110.3 49.5 -74.0 -43.2 10.7 18.7 24.4 236 244 A W H X S+ 0 0 55 -4,-1.1 4,-2.0 2,-0.2 -2,-0.2 0.835 111.8 49.1 -65.3 -35.1 9.4 22.2 25.3 237 245 A I H X S+ 0 0 16 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.904 112.0 49.0 -68.0 -43.0 12.5 22.7 27.5 238 246 A A H X S+ 0 0 11 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.930 113.3 46.8 -60.1 -47.1 14.7 21.6 24.6 239 247 A A H X S+ 0 0 0 -4,-2.7 4,-2.1 2,-0.2 -2,-0.2 0.897 114.1 44.9 -64.5 -46.3 12.9 24.0 22.1 240 248 A V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.916 113.0 52.1 -67.1 -43.9 12.9 27.1 24.4 241 249 A G H X S+ 0 0 6 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.914 109.4 49.9 -54.4 -47.5 16.6 26.4 25.3 242 250 A Q H X S+ 0 0 0 -4,-2.3 4,-3.3 1,-0.2 5,-0.3 0.905 107.4 54.7 -59.3 -43.7 17.5 26.2 21.7 243 251 A I H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 6,-0.3 0.900 111.1 44.6 -56.9 -46.5 15.7 29.5 20.9 244 252 A F H X>S+ 0 0 0 -4,-2.1 5,-2.6 2,-0.2 4,-0.5 0.956 117.7 43.8 -61.2 -53.6 17.7 31.4 23.6 245 253 A F H ><5S+ 0 0 5 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.909 114.6 48.4 -59.4 -47.3 21.0 29.8 22.5 246 254 A T H 3<5S+ 0 0 0 -4,-3.3 -1,-0.2 258,-0.3 -2,-0.2 0.828 116.4 41.4 -68.3 -33.5 20.5 30.2 18.8 247 255 A L H 3<5S- 0 0 0 -4,-1.7 -1,-0.2 -5,-0.3 -2,-0.2 0.388 110.0-118.4 -92.8 1.3 19.4 33.9 19.0 248 256 A S T X<5 + 0 0 0 -3,-0.9 3,-0.7 -4,-0.5 6,-0.7 0.811 58.3 160.9 61.4 33.4 22.1 34.8 21.6 249 257 A L T 3 < + 0 0 0 -5,-2.6 -1,-0.2 -6,-0.3 159,-0.2 -0.689 58.6 17.4 -88.7 137.6 19.3 35.7 24.0 250 258 A G T 3 S+ 0 0 0 -2,-0.3 -1,-0.2 157,-0.2 157,-0.1 0.535 97.7 100.0 81.5 8.4 20.1 35.9 27.7 251 259 A F S < S- 0 0 0 -3,-0.7 -2,-0.1 -7,-0.1 -151,-0.1 0.292 88.5-127.7-101.2 4.9 23.8 36.1 27.0 252 260 A G S > S+ 0 0 1 1,-0.1 4,-1.5 152,-0.1 -3,-0.1 0.500 85.3 108.4 56.6 4.5 24.0 39.9 27.4 253 261 A A H > S+ 0 0 0 -5,-0.4 4,-2.0 2,-0.2 5,-0.1 0.874 73.0 47.2 -80.3 -41.5 25.7 39.8 24.0 254 262 A I H > S+ 0 0 2 -6,-0.7 4,-2.7 2,-0.2 5,-0.2 0.911 111.5 53.6 -62.7 -44.8 22.8 41.3 22.0 255 263 A I H > S+ 0 0 0 1,-0.2 4,-0.9 2,-0.2 -2,-0.2 0.918 108.9 48.4 -55.7 -47.5 22.4 44.1 24.6 256 264 A T H >< S+ 0 0 0 -4,-1.5 3,-0.5 2,-0.2 -1,-0.2 0.899 112.1 47.9 -63.2 -43.8 26.1 45.0 24.3 257 265 A Y H >< S+ 0 0 1 -4,-2.0 3,-1.6 1,-0.2 -1,-0.2 0.913 109.8 53.8 -60.8 -43.5 26.0 45.1 20.5 258 266 A A H >< S+ 0 0 0 -4,-2.7 3,-1.3 1,-0.3 -1,-0.2 0.677 93.0 72.5 -66.1 -18.1 22.8 47.3 20.7 259 267 A S T << S+ 0 0 0 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.551 93.3 55.6 -75.7 -7.3 24.7 49.7 22.9 260 268 A Y T < S+ 0 0 1 -3,-1.6 -256,-1.5 -4,-0.2 2,-0.4 0.326 85.5 101.9-103.0 2.7 26.6 50.9 19.9 261 269 A V S < S- 0 0 2 -3,-1.3 -195,-0.1 -258,-0.2 -194,-0.1 -0.760 85.3-104.3 -83.8 132.5 23.4 51.6 18.0 262 270 A R - 0 0 126 -2,-0.4 3,-0.4 -258,-0.2 -1,-0.1 -0.198 27.9-110.2 -60.1 147.2 22.7 55.4 18.0 263 271 A K S S+ 0 0 118 1,-0.2 -1,-0.1 -4,-0.1 -196,-0.1 0.722 115.8 36.0 -49.5 -30.0 19.9 56.7 20.3 264 272 A D S S+ 0 0 101 2,-0.1 -1,-0.2 167,-0.0 -2,-0.0 0.754 90.1 109.0 -99.0 -32.3 17.6 57.5 17.4 265 273 A Q S S- 0 0 41 -3,-0.4 167,-0.1 1,-0.1 2,-0.1 -0.088 76.6 -95.8 -53.8 145.0 18.2 54.6 15.0 266 274 A D + 0 0 5 165,-0.2 166,-0.1 1,-0.1 -1,-0.1 -0.324 39.2 170.5 -64.4 140.1 15.6 51.9 14.4 267 275 A I > + 0 0 0 161,-0.4 4,-1.7 163,-0.2 5,-0.2 0.453 67.2 73.3-121.6 -12.4 15.8 48.6 16.4 268 276 A V H > S+ 0 0 0 166,-0.2 4,-1.8 2,-0.2 5,-0.1 0.968 108.1 27.3 -70.6 -56.9 12.4 47.2 15.5 269 277 A L H > S+ 0 0 63 2,-0.2 4,-2.7 165,-0.2 5,-0.2 0.908 122.9 53.0 -73.3 -43.1 13.0 46.2 11.8 270 278 A S H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.928 111.7 46.4 -54.5 -49.6 16.7 45.7 12.4 271 279 A G H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.902 113.2 48.3 -60.1 -46.2 16.0 43.3 15.3 272 280 A L H X S+ 0 0 51 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.880 111.7 50.7 -62.6 -41.1 13.4 41.4 13.4 273 281 A T H X S+ 0 0 52 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.934 110.3 48.4 -62.8 -49.4 15.7 41.0 10.3 274 282 A A H X S+ 0 0 3 -4,-2.5 4,-1.4 1,-0.2 -1,-0.2 0.872 114.1 47.3 -59.0 -39.9 18.6 39.7 12.4 275 283 A A H X S+ 0 0 0 -4,-2.0 4,-1.6 2,-0.2 -1,-0.2 0.880 114.1 46.2 -69.5 -39.4 16.3 37.2 14.2 276 284 A T H X S+ 0 0 46 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.852 108.3 56.1 -73.9 -36.4 14.7 36.1 10.9 277 285 A L H X S+ 0 0 69 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.886 108.3 49.7 -58.2 -41.5 18.2 35.7 9.2 278 286 A N H X S+ 0 0 0 -4,-1.4 4,-1.6 -5,-0.2 -2,-0.2 0.896 108.9 50.3 -64.5 -44.2 19.2 33.4 12.0 279 287 A E H X>S+ 0 0 16 -4,-1.6 4,-3.2 2,-0.2 5,-0.5 0.853 110.3 49.8 -66.0 -37.0 16.1 31.2 11.7 280 288 A K H X>S+ 0 0 120 -4,-2.0 5,-1.6 2,-0.2 4,-1.5 0.931 113.0 46.7 -64.2 -46.3 16.5 30.8 7.9 281 289 A A H <>S+ 0 0 9 -4,-2.0 5,-2.9 3,-0.2 -2,-0.2 0.772 118.8 44.9 -63.5 -26.8 20.2 29.8 8.5 282 290 A E H <>S+ 0 0 0 -4,-1.6 5,-1.4 3,-0.2 -2,-0.2 0.957 123.9 25.3 -83.2 -57.9 19.0 27.5 11.3 283 291 A V H <5S+ 0 0 22 -4,-3.2 -3,-0.2 3,-0.2 -2,-0.1 0.858 132.5 33.9 -82.2 -34.9 16.0 25.6 9.8 284 292 A I T < > S+ 0 0 1 -3,-0.8 4,-1.5 -4,-0.5 5,-0.2 0.896 110.3 29.6-100.1 -69.1 23.1 19.5 6.2 290 298 A S H X S+ 0 0 3 -4,-0.7 4,-2.1 -266,-0.2 5,-0.2 0.939 122.8 40.5 -62.5 -57.6 23.7 17.1 9.1 291 299 A I H > S+ 0 0 3 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.947 114.7 48.1 -62.6 -55.6 20.4 15.2 9.5 292 300 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -74,-0.2 0.883 114.0 48.8 -56.7 -39.8 19.6 14.6 5.8 293 301 A A H X S+ 0 0 0 -4,-1.5 4,-1.4 2,-0.2 -2,-0.2 0.923 114.0 45.6 -62.2 -46.4 23.1 13.4 5.1 294 302 A A H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 5,-0.4 0.890 114.8 47.0 -64.0 -43.1 23.0 11.0 8.1 295 303 A V H X S+ 0 0 3 -4,-3.1 4,-2.1 3,-0.2 -1,-0.2 0.865 107.7 57.8 -66.7 -37.9 19.5 9.7 7.2 296 304 A A H < S+ 0 0 0 -4,-2.3 -86,-0.5 -5,-0.3 -83,-0.4 0.844 117.6 31.4 -61.1 -36.9 20.6 9.2 3.6 297 305 A F H < S+ 0 0 34 -4,-1.4 -2,-0.2 -85,-0.2 -1,-0.2 0.776 137.4 19.0 -92.0 -30.7 23.5 6.9 4.6 298 306 A F H < S- 0 0 21 -4,-2.2 4,-0.5 -5,-0.2 -3,-0.2 0.585 99.8-118.6-119.5 -15.9 22.1 5.2 7.7 299 307 A G X - 0 0 15 -4,-2.1 4,-2.0 -5,-0.4 5,-0.2 -0.124 40.7 -70.6 87.1 167.4 18.3 5.6 7.7 300 308 A V H > S+ 0 0 58 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.929 127.8 51.8 -62.4 -51.1 16.1 7.5 10.3 301 309 A A H > S+ 0 0 83 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.887 114.5 43.2 -56.1 -44.3 16.5 5.0 13.2 302 310 A N H > S+ 0 0 91 -4,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.884 111.1 53.7 -69.3 -41.8 20.3 5.0 13.0 303 311 A A H X S+ 0 0 3 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.882 110.9 46.7 -61.9 -41.4 20.7 8.7 12.5 304 312 A V H X S+ 0 0 30 -4,-2.3 4,-1.2 2,-0.2 -1,-0.2 0.908 111.7 51.3 -64.1 -44.9 18.6 9.4 15.7 305 313 A A H X S+ 0 0 55 -4,-1.8 4,-1.5 -5,-0.2 -2,-0.2 0.839 110.8 48.2 -62.0 -37.2 20.7 6.8 17.6 306 314 A I H < S+ 0 0 25 -4,-2.2 4,-0.3 1,-0.2 -1,-0.2 0.906 110.3 51.7 -68.2 -43.7 23.9 8.4 16.5 307 315 A A H < S+ 0 0 0 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.712 111.3 49.3 -63.8 -24.5 22.6 11.9 17.5 308 316 A K H < S+ 0 0 128 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.811 103.8 55.6 -85.4 -35.4 21.7 10.5 21.0 309 317 A A S < S- 0 0 84 -4,-1.5 2,-0.3 1,-0.2 -1,-0.2 0.399 127.0 -4.5 -80.4 3.2 25.0 8.8 21.8 310 318 A G - 0 0 21 -4,-0.3 -1,-0.2 -3,-0.2 4,-0.1 -0.908 48.6-144.5 177.0 158.9 26.8 12.1 21.3 311 319 A A S S+ 0 0 48 -2,-0.3 4,-0.4 2,-0.1 -282,-0.1 0.554 107.7 44.4-112.7 -18.0 26.3 15.7 20.1 312 320 A F S >>S+ 0 0 59 2,-0.1 4,-1.8 1,-0.1 5,-0.5 0.352 93.8 86.4-100.6 -0.7 29.7 16.2 18.4 313 321 A N H >>S+ 0 0 30 3,-0.2 5,-3.4 -7,-0.2 4,-0.7 0.859 90.5 45.9 -58.9 -39.5 29.1 12.8 16.8 314 322 A L H 4>S+ 0 0 6 3,-0.2 5,-2.2 4,-0.2 -1,-0.1 0.944 120.9 31.8 -75.2 -50.7 27.1 14.4 14.0 315 323 A G H 45S+ 0 0 0 -4,-0.4 -2,-0.2 3,-0.2 -1,-0.1 0.791 131.0 29.1 -81.5 -31.5 29.3 17.3 13.0 316 324 A F H <5S+ 0 0 1 -4,-1.8 -3,-0.2 3,-0.1 -2,-0.1 0.609 133.5 20.5-107.9 -17.8 32.8 16.0 13.8 317 325 A I T X S+ 0 0 1 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.870 113.0 54.7 -58.0 -34.6 33.2 13.9 7.6 321 329 A A H < S+ 0 0 0 -4,-1.6 4,-0.3 2,-0.2 -2,-0.2 0.907 110.2 45.5 -61.4 -43.8 32.8 10.1 7.6 322 330 A I H >< S+ 0 0 2 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.931 111.1 52.9 -63.9 -47.7 30.0 10.4 5.0 323 331 A F H >< S+ 0 0 2 -4,-2.7 3,-2.3 1,-0.3 6,-0.3 0.865 98.6 63.5 -57.4 -40.1 31.9 12.9 2.9 324 332 A S T 3< S+ 0 0 33 -4,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.636 93.8 63.9 -62.0 -15.6 35.0 10.7 2.7 325 333 A Q T < S+ 0 0 90 -3,-1.6 -1,-0.3 -4,-0.3 2,-0.3 0.387 99.5 68.4 -86.3 1.2 32.8 8.2 0.8 326 334 A T S X S- 0 0 28 -3,-2.3 3,-1.9 -4,-0.1 2,-0.3 -0.782 98.6 -81.6-122.2 163.4 32.4 10.7 -2.0 327 335 A A T 3 S+ 0 0 100 1,-0.3 -2,-0.1 -2,-0.3 -3,-0.0 -0.485 117.7 1.9 -67.7 123.0 34.6 12.3 -4.7 328 336 A G T >> S+ 0 0 51 -2,-0.3 4,-1.8 -4,-0.1 3,-0.6 0.697 86.4 147.5 69.9 22.2 36.5 15.2 -3.2 329 337 A G H <> + 0 0 4 -3,-1.9 4,-2.8 -6,-0.3 -5,-0.2 0.821 65.3 59.5 -56.8 -36.9 35.0 14.4 0.2 330 338 A T H 3> S+ 0 0 50 -4,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.879 108.6 43.9 -58.6 -41.9 38.1 15.6 2.0 331 339 A F H <> S+ 0 0 111 -3,-0.6 4,-2.1 2,-0.2 -1,-0.2 0.817 111.0 55.2 -72.2 -32.9 37.7 19.1 0.5 332 340 A L H X S+ 0 0 12 -4,-1.8 4,-2.0 2,-0.2 -2,-0.2 0.896 106.1 51.8 -65.2 -41.5 34.0 18.9 1.3 333 341 A G H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.926 107.6 53.0 -56.0 -47.5 35.0 18.2 4.9 334 342 A F H X S+ 0 0 29 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.908 107.6 49.7 -55.3 -47.0 37.2 21.3 4.7 335 343 A L H X S+ 0 0 18 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.868 110.7 51.4 -62.7 -38.6 34.3 23.5 3.5 336 344 A W H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.947 114.7 41.2 -58.7 -52.6 32.1 22.2 6.3 337 345 A F H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -222,-0.2 0.781 114.0 52.4 -72.6 -26.9 34.7 23.0 9.0 338 346 A F H X S+ 0 0 58 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.876 110.0 49.4 -71.9 -40.8 35.6 26.3 7.4 339 347 A L H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -2,-0.2 0.930 112.1 48.5 -58.4 -48.9 31.9 27.2 7.4 340 348 A L H X S+ 0 0 0 -4,-2.4 4,-2.9 1,-0.2 -2,-0.2 0.893 108.1 55.0 -60.4 -40.5 31.7 26.2 11.1 341 349 A F H X S+ 0 0 8 -4,-2.0 4,-2.8 1,-0.2 -1,-0.2 0.894 111.5 42.6 -60.9 -42.9 34.8 28.2 11.9 342 350 A F H X S+ 0 0 26 -4,-1.8 4,-1.4 2,-0.2 -1,-0.2 0.781 112.8 54.3 -75.7 -29.1 33.3 31.4 10.5 343 351 A A H X S+ 0 0 0 -4,-2.1 4,-0.6 -5,-0.2 -322,-0.2 0.940 115.5 39.7 -62.6 -48.7 30.0 30.6 12.2 344 352 A G H >X S+ 0 0 0 -4,-2.9 4,-2.6 -324,-0.3 3,-0.9 0.920 112.0 55.5 -67.3 -46.7 31.8 30.3 15.5 345 353 A L H 3X S+ 0 0 2 -4,-2.8 4,-1.7 1,-0.3 -1,-0.2 0.862 104.9 51.0 -58.6 -42.9 34.2 33.2 15.0 346 354 A T H 3< S+ 0 0 2 -4,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.725 117.3 42.5 -68.5 -21.4 31.4 35.8 14.4 347 355 A S H S+ 0 0 3 -4,-0.5 4,-1.8 -3,-0.2 3,-0.4 0.617 95.7 73.3-103.0 -23.3 33.6 38.4 24.6 353 361 A Q H X S+ 0 0 3 -4,-0.9 4,-2.9 1,-0.2 5,-0.2 0.790 87.2 60.9 -62.9 -33.9 32.6 42.0 23.7 354 362 A P H > S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 -1,-0.2 0.897 107.4 45.4 -61.5 -38.9 30.4 42.4 26.9 355 363 A M H > S+ 0 0 4 -3,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.928 114.3 49.1 -66.2 -45.3 33.4 41.8 29.1 356 364 A I H X S+ 0 0 1 -4,-1.8 4,-1.9 1,-0.2 -1,-0.2 0.905 111.4 49.5 -55.9 -46.1 35.5 44.2 26.9 357 365 A A H X S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 5,-0.3 0.816 108.3 53.3 -67.8 -33.7 32.7 46.8 27.1 358 366 A F H X>S+ 0 0 2 -4,-1.7 4,-2.6 2,-0.2 5,-1.1 0.952 110.0 47.3 -63.0 -49.9 32.5 46.5 30.9 359 367 A L H <5S+ 0 0 9 -4,-2.2 6,-2.9 3,-0.2 4,-0.3 0.843 118.5 42.3 -61.8 -35.3 36.2 47.2 31.3 360 368 A E H <5S+ 0 0 22 -4,-1.9 4,-0.4 4,-0.2 -2,-0.2 0.939 122.2 36.3 -74.6 -50.9 36.0 50.1 28.9 361 369 A D H <5S+ 0 0 16 -4,-2.9 -3,-0.2 -5,-0.1 -2,-0.2 0.929 131.2 22.7 -71.5 -48.0 32.8 51.7 30.2 362 370 A E T <5S+ 0 0 33 -4,-2.6 -3,-0.2 -5,-0.3 -1,-0.1 0.774 132.5 33.7-100.0 -32.1 33.0 51.1 33.9 363 371 A L S - 0 0 57 -2,-0.2 4,-2.5 1,-0.1 5,-0.2 -0.288 31.3-107.8 -66.7 161.8 41.5 51.4 26.9 367 375 A R H > S+ 0 0 94 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.901 118.5 56.1 -58.5 -42.6 40.3 49.0 24.1 368 376 A K H > S+ 0 0 125 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.931 113.9 37.6 -55.1 -51.8 43.7 47.4 23.9 369 377 A H H > S+ 0 0 97 2,-0.2 4,-2.4 1,-0.2 5,-0.3 0.843 114.9 54.5 -73.2 -35.4 43.9 46.5 27.6 370 378 A A H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.910 113.5 42.8 -62.7 -42.6 40.2 45.6 27.8 371 379 A V H X S+ 0 0 2 -4,-2.7 4,-2.6 -5,-0.2 -2,-0.2 0.928 116.0 46.8 -68.9 -47.6 40.6 43.1 24.9 372 380 A L H X S+ 0 0 79 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.904 114.4 46.3 -65.0 -43.7 44.0 41.6 26.1 373 381 A W H X S+ 0 0 155 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.870 113.1 50.5 -64.7 -38.8 42.8 41.2 29.7 374 382 A T H X S+ 0 0 1 -4,-1.6 4,-2.3 -5,-0.3 -2,-0.2 0.921 112.4 46.9 -63.4 -45.4 39.5 39.6 28.4 375 383 A A H X S+ 0 0 13 -4,-2.6 4,-3.4 2,-0.2 -2,-0.2 0.899 111.1 52.1 -62.0 -42.8 41.5 37.3 26.2 376 384 A A H X S+ 0 0 44 -4,-2.5 4,-2.5 2,-0.2 5,-0.2 0.894 110.3 48.0 -60.3 -43.7 43.8 36.4 29.1 377 385 A I H X S+ 0 0 30 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.933 116.6 42.8 -62.8 -47.8 40.9 35.5 31.3 378 386 A V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.929 114.8 50.2 -64.9 -47.0 39.2 33.4 28.7 379 387 A F H < S+ 0 0 57 -4,-3.4 4,-0.4 2,-0.2 -2,-0.2 0.943 114.4 43.6 -57.2 -52.9 42.5 31.7 27.6 380 388 A F H >< S+ 0 0 132 -4,-2.5 3,-1.9 -5,-0.2 4,-0.2 0.963 114.4 49.0 -56.4 -55.5 43.5 30.8 31.2 381 389 A S H >X S+ 0 0 2 -4,-2.3 3,-1.9 1,-0.3 4,-0.5 0.789 97.6 69.2 -58.1 -34.2 40.0 29.6 32.2 382 390 A A H 3X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.3 -1,-0.3 0.607 79.0 79.9 -64.2 -13.5 39.6 27.4 29.1 383 391 A H H <> S+ 0 0 48 -3,-1.9 4,-1.6 -4,-0.4 -1,-0.3 0.781 89.2 55.7 -63.3 -26.7 42.4 25.1 30.5 384 392 A L H <> S+ 0 0 36 -3,-1.9 4,-2.0 -4,-0.2 -1,-0.2 0.901 109.3 44.9 -68.4 -43.1 39.6 23.6 32.7 385 393 A V H < S+ 0 0 4 -4,-0.5 7,-0.3 1,-0.2 -2,-0.2 0.842 114.6 50.0 -67.8 -35.7 37.5 22.8 29.6 386 394 A M H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.834 124.3 24.7 -71.3 -35.0 40.6 21.4 27.7 387 395 A F H < S+ 0 0 81 -4,-1.6 -233,-2.4 -5,-0.2 2,-0.6 0.612 106.6 73.7-113.0 -17.7 41.8 19.1 30.5 388 396 A L B >< S-A 153 0A 14 -4,-2.0 3,-1.5 -235,-0.2 4,-0.4 -0.902 76.3-128.9-109.1 119.1 38.8 18.2 32.7 389 397 A N T 3 S+ 0 0 37 -237,-2.3 -3,-0.1 -2,-0.6 -2,-0.1 -0.384 90.8 12.1 -65.6 137.2 36.2 15.8 31.3 390 398 A K T 3> S+ 0 0 106 -5,-0.1 4,-1.3 -2,-0.1 -1,-0.2 0.487 92.3 113.1 71.0 7.0 32.5 16.9 31.5 391 399 A S H <> S+ 0 0 1 -3,-1.5 4,-2.0 -7,-0.2 5,-0.2 0.868 75.1 53.9 -68.9 -39.3 33.7 20.5 32.4 392 400 A L H > S+ 0 0 24 -4,-0.4 4,-2.2 -7,-0.3 -1,-0.2 0.907 108.0 48.6 -59.0 -46.8 32.3 21.6 29.0 393 401 A D H > S+ 0 0 85 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.838 110.1 52.3 -63.7 -36.6 28.9 20.1 29.7 394 402 A E H X S+ 0 0 9 -4,-1.3 4,-2.6 2,-0.2 5,-0.3 0.910 112.8 42.8 -68.7 -45.0 28.7 21.8 33.1 395 403 A M H X>S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 5,-1.2 0.873 113.5 53.0 -66.9 -39.3 29.5 25.3 31.8 396 404 A D H <5S+ 0 0 27 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.826 114.5 42.8 -67.3 -33.7 27.1 24.8 28.9 397 405 A F H X>S+ 0 0 24 -4,-1.8 5,-2.8 3,-0.2 4,-1.0 0.968 118.7 39.7 -73.8 -57.5 24.3 23.8 31.3 398 406 A W H <>S+ 0 0 54 -4,-2.6 5,-0.5 3,-0.2 -2,-0.2 0.858 135.0 17.1 -66.4 -38.7 24.8 26.4 34.0 399 407 A A T <>S+ 0 0 0 -4,-2.1 5,-0.7 -5,-0.3 -3,-0.2 0.883 131.8 38.6 -97.4 -52.5 25.6 29.4 31.8 400 408 A G T 4S+ 0 0 49 -4,-2.5 4,-2.2 3,-0.2 5,-1.7 0.924 114.8 46.7 -62.9 -47.4 10.8 41.5 34.6 414 422 A I H <>S+ 0 0 3 -4,-2.5 5,-3.0 3,-0.2 4,-0.4 0.939 120.2 38.2 -61.6 -47.3 13.3 44.4 35.2 415 423 A F H <5S+ 0 0 0 -4,-2.1 5,-0.3 3,-0.2 9,-0.2 0.900 130.2 27.0 -72.7 -43.7 12.4 46.1 31.8 416 424 A F H <>S+ 0 0 1 -4,-2.7 5,-0.6 -5,-0.2 -3,-0.2 0.714 131.5 29.9 -96.6 -24.0 8.7 45.4 31.7 417 425 A W T <5S+ 0 0 133 -4,-2.2 -3,-0.2 -5,-0.4 4,-0.2 0.771 130.5 26.6-106.7 -35.7 7.6 45.1 35.3 418 426 A I T 5 - 0 0 22 -5,-0.3 4,-2.9 -6,-0.3 -3,-0.2 0.197 17.3-124.1 123.3 121.4 7.5 50.1 33.6 421 429 A A H > S+ 0 0 117 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.875 114.4 47.1 -67.3 -40.3 4.5 51.6 29.0 423 431 A K H > S+ 0 0 123 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.887 113.4 49.7 -66.1 -40.4 8.0 53.1 29.3 424 432 A A H X S+ 0 0 0 -4,-2.9 4,-2.0 -9,-0.2 -2,-0.2 0.922 110.8 49.0 -62.3 -48.3 9.5 49.9 28.0 425 433 A W H X S+ 0 0 47 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.913 111.4 49.3 -58.4 -48.9 7.1 49.7 25.0 426 434 A E H X S+ 0 0 122 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.917 110.6 50.9 -54.8 -47.7 7.8 53.4 24.1 427 435 A E H < S+ 0 0 18 -4,-2.1 -2,-0.2 2,-0.2 -1,-0.2 0.829 110.6 49.4 -64.7 -34.7 11.6 52.7 24.3 428 436 A I H < S+ 0 0 0 -4,-2.0 -161,-0.4 1,-0.2 -2,-0.2 0.968 118.0 38.1 -63.6 -54.2 11.2 49.7 22.0 429 437 A N H >< S+ 0 0 14 -4,-2.5 3,-2.3 -5,-0.1 2,-0.2 0.659 86.0 117.8 -76.4 -18.5 9.2 51.5 19.3 430 438 A R T 3< S- 0 0 65 -4,-2.0 -163,-0.2 1,-0.3 -162,-0.1 -0.325 91.5 -0.7 -58.4 115.5 11.0 54.8 19.6 431 439 A G T 3 S+ 0 0 45 1,-0.2 -1,-0.3 -2,-0.2 -165,-0.2 0.437 94.3 154.8 86.4 1.8 12.6 55.6 16.2 432 440 A G < - 0 0 24 -3,-2.3 -1,-0.2 -166,-0.1 3,-0.1 -0.309 47.4-143.8 -66.8 142.1 11.4 52.3 14.6 433 441 A I S S+ 0 0 110 1,-0.1 2,-0.3 -2,-0.0 -1,-0.1 0.862 96.4 15.3 -69.8 -38.7 10.9 52.1 10.8 434 442 A I S S- 0 0 74 -5,-0.0 2,-0.3 -3,-0.0 -166,-0.2 -0.851 90.0-117.2-121.7 165.3 7.9 49.9 11.6 435 443 A K - 0 0 164 -2,-0.3 3,-0.1 -167,-0.1 -6,-0.0 -0.789 29.1-105.0-102.5 150.6 6.1 49.5 14.9 436 444 A V - 0 0 6 -2,-0.3 5,-0.1 -11,-0.1 -7,-0.1 -0.556 49.8 -96.9 -67.7 131.2 5.8 46.3 17.0 437 445 A P > - 0 0 66 0, 0.0 3,-1.6 0, 0.0 4,-0.4 -0.224 29.4-122.1 -50.5 139.3 2.3 44.9 16.7 438 446 A R T >> S+ 0 0 191 1,-0.3 3,-1.1 2,-0.2 4,-0.6 0.748 108.2 68.4 -59.7 -27.4 0.1 45.9 19.6 439 447 A I H >> S+ 0 0 114 1,-0.2 4,-1.3 2,-0.2 3,-0.6 0.823 88.3 66.1 -59.3 -33.5 -0.5 42.2 20.5 440 448 A Y H <> S+ 0 0 37 -3,-1.6 4,-2.9 1,-0.2 -1,-0.2 0.694 87.6 66.7 -69.0 -20.5 3.2 41.9 21.5 441 449 A Y H <> S+ 0 0 30 -3,-1.1 4,-1.7 -4,-0.4 -1,-0.2 0.946 105.4 43.4 -57.8 -49.0 2.7 44.2 24.5 442 450 A Y H S+ 0 0 116 -4,-0.6 4,-1.9 -3,-0.6 5,-1.3 0.802 114.2 50.9 -69.7 -31.8 0.4 41.7 26.1 443 451 A V H <>S+ 0 0 11 -4,-1.3 5,-3.0 3,-0.2 -2,-0.2 0.957 111.9 46.4 -66.1 -53.4 2.8 38.8 25.1 444 452 A M H <5S+ 0 0 0 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.787 121.3 38.1 -59.1 -32.2 5.8 40.6 26.6 445 453 A R H <5S+ 0 0 80 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.766 135.8 5.5 -95.9 -28.2 4.0 41.5 29.8 446 454 A Y T X5S+ 0 0 117 -4,-1.9 4,-1.1 -5,-0.2 -3,-0.2 0.724 126.5 43.4-125.6 -45.5 1.8 38.4 30.6 447 455 A I H > S+ 0 0 3 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.884 115.1 47.2 -64.9 -37.7 7.0 35.9 31.7 450 458 A A H X S+ 0 0 54 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.890 113.0 50.1 -67.8 -39.4 4.4 33.3 32.8 451 459 A F H X S+ 0 0 54 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.905 113.5 44.0 -65.1 -44.4 5.6 30.8 30.2 452 460 A L H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.865 113.1 51.7 -69.7 -38.0 9.3 31.2 31.2 453 461 A A H X S+ 0 0 42 -4,-2.1 4,-1.4 -5,-0.2 -2,-0.2 0.905 112.2 45.7 -64.3 -44.2 8.4 31.0 35.0 454 462 A V H X S+ 0 0 95 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.921 113.2 50.9 -62.9 -45.3 6.4 27.8 34.5 455 463 A L H X S+ 0 0 12 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.880 110.0 49.0 -60.7 -42.6 9.2 26.3 32.4 456 464 A L H X S+ 0 0 27 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.783 109.4 52.3 -69.5 -30.4 11.9 27.1 35.0 457 465 A V H X S+ 0 0 68 -4,-1.4 4,-0.7 2,-0.2 -2,-0.2 0.918 112.2 44.0 -72.7 -45.5 9.8 25.6 37.8 458 466 A V H >X S+ 0 0 49 -4,-2.1 4,-2.3 1,-0.2 3,-0.8 0.913 114.3 52.9 -60.9 -43.8 9.3 22.3 36.0 459 467 A W H 3X>S+ 0 0 10 -4,-2.1 4,-1.7 1,-0.2 5,-1.7 0.911 109.2 47.0 -56.5 -48.8 13.0 22.4 35.0 460 468 A A H 3<5S+ 0 0 49 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.546 119.4 39.6 -76.6 -8.3 14.3 22.9 38.6 461 469 A R H <<5S+ 0 0 185 -3,-0.8 -2,-0.2 -4,-0.7 -1,-0.2 0.687 125.6 29.2-111.0 -27.2 12.1 20.1 40.0 462 470 A E H <5S+ 0 0 115 -4,-2.3 -3,-0.2 -5,-0.2 -2,-0.2 0.634 131.6 22.7-108.5 -20.2 12.2 17.4 37.4 463 471 A Y T X5S+ 0 0 71 -4,-1.7 4,-1.1 -5,-0.4 3,-0.3 0.745 109.1 59.9-123.2 -38.0 15.6 17.8 35.7 464 472 A I H > S+ 0 0 57 0, 0.0 4,-1.7 0, 0.0 5,-0.3 0.912 102.1 50.7 -57.1 -40.2 18.1 17.0 40.7 466 474 A K H > S+ 0 0 128 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.899 114.0 42.8 -60.6 -45.2 19.5 14.4 38.3 467 475 A I H < S+ 0 0 47 -4,-1.1 4,-0.3 1,-0.2 -1,-0.2 0.865 115.1 49.6 -72.9 -38.2 22.4 16.7 37.2 468 476 A M H < S+ 0 0 86 -4,-2.6 -1,-0.2 1,-0.1 -2,-0.2 0.811 128.1 21.1 -66.2 -32.3 23.1 17.9 40.8 469 477 A E H < S+ 0 0 145 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.817 118.0 52.7-110.1 -42.4 23.2 14.4 42.2 470 478 A E S < S+ 0 0 147 -4,-2.6 2,-0.2 -5,-0.3 -3,-0.1 0.059 87.7 96.4 -95.7 25.8 23.9 11.7 39.5 471 479 A T S S- 0 0 58 -4,-0.3 -4,-0.0 1,-0.1 2,-0.0 -0.686 83.4 -85.0-108.1 165.5 27.0 13.2 38.0 472 480 A H > - 0 0 90 -2,-0.2 3,-1.7 1,-0.1 4,-0.2 -0.317 40.2-113.3 -65.1 150.4 30.7 12.5 38.6 473 481 A W T > S+ 0 0 171 1,-0.3 3,-1.8 2,-0.1 4,-0.3 0.741 107.8 76.5 -59.0 -25.3 32.4 14.4 41.5 474 482 A T T >> S+ 0 0 4 1,-0.3 4,-1.1 2,-0.2 3,-1.0 0.647 74.8 77.7 -64.7 -15.3 34.6 16.3 39.1 475 483 A V H <> S+ 0 0 3 -3,-1.7 4,-2.7 1,-0.2 -1,-0.3 0.778 85.2 64.6 -61.4 -26.6 31.7 18.6 38.1 476 484 A W H <> S+ 0 0 136 -3,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.727 93.6 58.4 -71.3 -25.5 32.3 20.4 41.5 477 485 A I H <> S+ 0 0 61 -3,-1.0 4,-2.6 -4,-0.3 -1,-0.2 0.952 111.8 41.6 -62.9 -50.1 35.7 21.6 40.3 478 486 A T H X S+ 0 0 1 -4,-1.1 4,-2.7 2,-0.2 5,-0.2 0.915 115.9 48.8 -63.8 -46.4 33.9 23.3 37.4 479 487 A R H X S+ 0 0 10 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.946 111.9 49.9 -58.4 -49.7 31.1 24.6 39.6 480 488 A F H X S+ 0 0 163 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.942 112.7 46.9 -51.8 -52.8 33.6 25.9 42.1 481 489 A Y H X S+ 0 0 59 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.910 113.6 46.1 -61.7 -44.9 35.6 27.7 39.4 482 490 A I H X S+ 0 0 3 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.831 110.8 52.6 -71.5 -31.0 32.5 29.3 37.7 483 491 A I H X S+ 0 0 95 -4,-2.5 4,-1.9 -5,-0.2 -1,-0.2 0.898 108.7 53.0 -63.4 -40.3 31.1 30.4 41.1 484 492 A G H X S+ 0 0 34 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.870 105.1 53.6 -59.0 -40.4 34.5 31.9 41.7 485 493 A L H X S+ 0 0 11 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.858 106.9 52.3 -62.9 -38.1 34.2 33.8 38.3 486 494 A F H X S+ 0 0 33 -4,-1.6 4,-2.6 2,-0.2 -2,-0.2 0.921 110.2 47.1 -62.6 -46.1 30.9 35.2 39.5 487 495 A L H X S+ 0 0 111 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.890 111.3 52.0 -64.0 -40.7 32.4 36.5 42.7 488 496 A F H X S+ 0 0 78 -4,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.888 112.4 45.2 -59.9 -42.1 35.3 38.0 40.8 489 497 A L H X S+ 0 0 0 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.870 110.3 53.8 -72.7 -36.5 32.9 39.8 38.5 490 498 A T H X S+ 0 0 44 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.879 108.6 51.8 -58.7 -38.8 30.8 40.9 41.5 491 499 A F H X S+ 0 0 115 -4,-2.1 4,-1.9 1,-0.2 -2,-0.2 0.872 105.9 52.5 -67.9 -39.8 34.0 42.4 42.9 492 500 A L H X S+ 0 0 19 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.841 107.9 51.8 -65.2 -34.8 34.8 44.3 39.7 493 501 A V H X S+ 0 0 13 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.913 108.2 51.9 -66.1 -43.6 31.3 45.9 39.8 494 502 A F H X S+ 0 0 90 -4,-1.8 4,-1.3 1,-0.2 -2,-0.2 0.868 112.0 46.1 -57.3 -41.7 32.0 46.9 43.4 495 503 A L H X S+ 0 0 68 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.819 106.9 59.7 -70.7 -32.6 35.3 48.5 42.2 496 504 A A H X S+ 0 0 11 -4,-1.8 4,-1.2 2,-0.2 -2,-0.2 0.875 107.4 43.8 -64.9 -41.3 33.5 50.2 39.3 497 505 A E H X S+ 0 0 27 -4,-1.8 4,-1.1 2,-0.2 -1,-0.2 0.841 113.1 52.4 -73.6 -34.1 31.1 52.1 41.5 498 506 A R H X S+ 0 0 108 -4,-1.3 4,-1.6 1,-0.2 -2,-0.2 0.882 109.4 49.4 -64.3 -40.9 33.9 53.0 43.9 499 507 A R H < S+ 0 0 144 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.803 105.7 58.0 -67.9 -31.7 36.0 54.4 41.0 500 508 A R H < S+ 0 0 194 -4,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.816 108.2 46.0 -67.4 -33.6 33.0 56.4 39.8 501 509 A N H < 0 0 120 -4,-1.1 -2,-0.2 -3,-0.2 -1,-0.2 0.815 360.0 360.0 -78.1 -34.3 32.9 58.2 43.2 502 510 A H < 0 0 207 -4,-1.6 -3,-0.1 -5,-0.1 -4,-0.0 0.396 360.0 360.0 -95.7 360.0 36.6 58.9 43.3 503 ! 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 0.0 504 601 A L 0 0 0 0, 0.0 -482,-2.7 0, 0.0 -483,-0.5 0.000 360.0 360.0 360.0 360.0 25.2 31.5 18.9