==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSPORT PROTEIN 28-DEC-12 4IKW . COMPND 2 MOLECULE: DI-TRIPEPTIDE ABC TRANSPORTER (PERMEASE); . SOURCE 2 ORGANISM_SCIENTIFIC: GEOBACILLUS KAUSTOPHILUS; . AUTHOR S.DOKI,H.E.KATO,R.ISHITANI,O.NUREKI . 492 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21561.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 403 81.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.2 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 . 2 0.4 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 . 55 11.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 319 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 1.4 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 0 0 1 0 2 0 0 0 0 0 0 0 0 1 0 1 2 0 0 0 0 3 0 2 4 1 0 RESIDUES PER ALPHA HELIX . 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 PARALLEL BRIDGES PER LADDER . 0 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 3 A S 0 0 110 0, 0.0 2,-0.4 0, 0.0 215,-0.1 0.000 360.0 360.0 360.0 166.8 26.2 30.7 28.9 2 4 A I - 0 0 56 213,-0.1 213,-0.1 209,-0.0 2,-0.0 -0.984 360.0-100.6-126.6 142.0 22.9 31.7 30.5 3 5 A D > - 0 0 98 -2,-0.4 4,-1.9 1,-0.1 3,-0.4 -0.336 29.0-122.5 -64.5 141.9 20.9 29.5 32.9 4 6 A K H > S+ 0 0 63 1,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.685 107.5 59.5 -60.8 -21.0 17.9 27.7 31.3 5 7 A Q H > S+ 0 0 107 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.936 106.0 43.6 -73.8 -49.1 15.5 29.3 33.8 6 8 A Q H > S+ 0 0 115 -3,-0.4 4,-1.1 2,-0.2 -2,-0.2 0.877 115.0 51.8 -64.5 -36.6 16.3 33.0 32.9 7 9 A I H >< S+ 0 0 6 -4,-1.9 3,-0.8 1,-0.2 204,-0.5 0.953 111.2 47.0 -60.5 -48.8 16.2 32.0 29.3 8 10 A A H >< S+ 0 0 10 -4,-2.0 3,-1.0 1,-0.3 -2,-0.2 0.851 107.6 56.5 -60.3 -36.9 12.8 30.4 29.8 9 11 A A H 3< S+ 0 0 79 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.761 105.3 52.9 -67.4 -24.3 11.6 33.4 31.7 10 12 A S T << S+ 0 0 35 -4,-1.1 -1,-0.3 -3,-0.8 -2,-0.2 0.530 98.8 77.0 -87.6 -9.6 12.4 35.5 28.7 11 13 A V S < S- 0 0 5 -3,-1.0 197,-0.1 -4,-0.5 198,-0.1 -0.907 83.5-123.4-108.4 125.5 10.4 33.4 26.3 12 14 A P - 0 0 44 0, 0.0 10,-0.4 0, 0.0 -2,-0.1 -0.343 13.5-153.7 -60.6 145.0 6.6 33.6 26.2 13 15 A Q + 0 0 50 7,-0.2 2,-0.2 8,-0.1 3,-0.1 0.416 69.5 52.0-103.7 0.1 4.9 30.2 26.8 14 16 A R + 0 0 184 1,-0.1 7,-2.1 6,-0.1 8,-0.2 -0.773 61.5 78.9-128.2 170.1 1.7 30.8 24.9 15 17 A G E S+A 20 0A 58 5,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.202 76.7 71.6 122.8 -16.5 0.5 32.0 21.5 16 18 A F E > S-A 19 0A 31 3,-2.7 3,-1.3 -3,-0.1 7,-0.1 -0.691 118.2 -52.0-137.6 83.9 0.7 29.1 19.0 17 19 A F T 3 S- 0 0 176 -2,-0.3 -3,-0.0 1,-0.3 0, 0.0 0.937 116.1 -41.1 51.4 55.9 -1.8 26.2 19.5 18 20 A G T 3 S+ 0 0 41 1,-0.3 -1,-0.3 0, 0.0 3,-0.1 0.343 127.3 97.2 79.9 -7.8 -1.1 25.7 23.2 19 21 A H E < S-A 16 0A 21 -3,-1.3 -3,-2.7 1,-0.1 -1,-0.3 -0.659 89.8 -78.7-108.9 163.3 2.6 26.1 22.5 20 22 A P E > -A 15 0A 0 0, 0.0 3,-2.1 0, 0.0 4,-0.5 -0.363 39.1-122.3 -57.9 141.6 4.9 29.1 22.9 21 23 A K T >> S+ 0 0 84 -7,-2.1 4,-1.4 1,-0.3 3,-0.9 0.713 109.0 75.1 -58.7 -20.7 4.6 31.6 20.0 22 24 A G H 3> S+ 0 0 0 -10,-0.4 4,-2.5 186,-0.4 -1,-0.3 0.822 84.5 64.0 -60.2 -30.7 8.3 31.1 19.4 23 25 A L H <> S+ 0 0 0 -3,-2.1 4,-3.0 1,-0.2 -1,-0.3 0.839 98.4 55.3 -61.9 -31.9 7.4 27.7 17.9 24 26 A F H <> S+ 0 0 73 -3,-0.9 4,-2.2 -4,-0.5 5,-0.3 0.946 107.9 48.0 -63.1 -48.7 5.6 29.7 15.2 25 27 A T H X S+ 0 0 0 -4,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.926 118.2 40.4 -56.3 -45.4 8.7 31.7 14.5 26 28 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 5,-0.3 0.878 112.7 53.3 -77.9 -38.4 10.8 28.4 14.3 27 29 A F H X S+ 0 0 30 -4,-3.0 4,-3.0 -5,-0.2 -2,-0.2 0.965 116.7 38.6 -56.6 -53.3 8.3 26.3 12.5 28 30 A F H X S+ 0 0 58 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.809 113.3 53.9 -75.9 -31.1 7.9 28.9 9.7 29 31 A T H X S+ 0 0 2 -4,-2.0 4,-1.8 -5,-0.3 -1,-0.2 0.964 118.2 37.5 -61.0 -50.6 11.6 29.9 9.5 30 32 A E H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.869 113.9 56.1 -72.1 -37.0 12.5 26.2 9.1 31 33 A F H X S+ 0 0 15 -4,-3.0 4,-3.2 -5,-0.3 -1,-0.2 0.948 110.6 44.3 -55.6 -52.1 9.5 25.4 6.9 32 34 A W H X S+ 0 0 60 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.857 112.6 51.7 -66.3 -36.3 10.4 28.1 4.4 33 35 A E H X S+ 0 0 0 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.950 114.9 42.2 -63.6 -48.3 14.1 27.2 4.4 34 36 A R H X S+ 0 0 10 -4,-2.7 4,-3.3 2,-0.2 5,-0.3 0.922 113.1 53.8 -63.4 -44.3 13.2 23.5 3.7 35 37 A F H X S+ 0 0 14 -4,-3.2 4,-2.4 -5,-0.2 5,-0.2 0.949 113.8 42.7 -51.6 -51.8 10.6 24.5 1.2 36 38 A S H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 5,-0.2 0.903 115.4 48.2 -66.0 -43.4 13.1 26.6 -0.7 37 39 A Y H X S+ 0 0 12 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.924 116.5 42.6 -61.8 -46.7 15.9 24.0 -0.4 38 40 A Y H X S+ 0 0 50 -4,-3.3 4,-2.3 2,-0.2 -2,-0.2 0.815 113.2 52.3 -73.2 -31.6 13.7 21.1 -1.6 39 41 A G H X S+ 0 0 0 -4,-2.4 4,-0.8 -5,-0.3 -2,-0.2 0.948 111.9 45.7 -67.0 -50.2 12.0 23.2 -4.4 40 42 A M H >X S+ 0 0 2 -4,-2.2 4,-1.5 -5,-0.2 3,-0.7 0.904 114.4 50.1 -57.4 -41.4 15.4 24.2 -5.7 41 43 A R H 3X S+ 0 0 53 -4,-1.9 4,-0.7 1,-0.2 -2,-0.2 0.886 99.5 63.5 -70.1 -36.8 16.6 20.6 -5.4 42 44 A A H 3< S+ 0 0 1 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.771 119.9 24.6 -58.7 -24.3 13.5 19.1 -7.2 43 45 A I H S+ 0 0 0 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.906 108.6 57.1 -66.2 -44.3 17.2 18.9 -14.7 47 49 A Y H < S+ 0 0 4 -4,-2.8 10,-2.3 1,-0.2 11,-0.3 0.877 109.3 48.2 -52.9 -37.7 18.4 22.5 -14.8 48 50 A M H < S+ 0 0 0 -4,-2.0 11,-2.9 8,-0.2 -2,-0.2 0.940 121.8 28.7 -71.6 -46.9 22.0 21.2 -15.1 49 51 A Y H < S+ 0 0 23 -4,-2.0 -2,-0.2 9,-0.2 -1,-0.2 0.528 90.9 104.5-100.8 -6.1 21.5 18.6 -17.9 50 52 A Y S < S- 0 0 54 -4,-2.7 8,-2.3 -5,-0.2 9,-0.3 -0.455 84.7 -90.9 -67.3 150.8 18.7 20.0 -19.9 51 53 A E > > - 0 0 118 6,-0.2 5,-2.1 7,-0.1 3,-1.8 -0.196 28.8-116.5 -62.9 152.9 19.8 21.5 -23.2 52 54 A V G > 5S+ 0 0 109 1,-0.3 3,-1.6 3,-0.2 -1,-0.1 0.857 117.4 58.4 -56.1 -37.3 20.7 25.2 -23.3 53 55 A S G 3 5S+ 0 0 94 1,-0.3 -1,-0.3 2,-0.1 -2,-0.1 0.576 104.6 52.1 -71.9 -9.4 17.8 25.7 -25.8 54 56 A K G < 5S- 0 0 134 -3,-1.8 -1,-0.3 -7,-0.1 -2,-0.2 0.189 128.6 -93.7-110.1 14.1 15.5 24.3 -23.1 55 57 A G T < 5S+ 0 0 35 -3,-1.6 -3,-0.2 1,-0.3 -2,-0.1 0.255 90.6 117.9 95.1 -10.3 16.6 26.7 -20.4 56 58 A G S - 0 0 104 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.383 35.5-121.2 -58.3 140.6 26.3 15.9 -19.3 61 63 A E H > S+ 0 0 72 1,-0.2 4,-2.0 2,-0.2 5,-0.2 0.876 111.3 53.0 -54.1 -44.4 23.7 13.9 -17.3 62 64 A H H > S+ 0 0 50 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.904 108.2 49.5 -61.5 -42.2 26.4 12.0 -15.4 63 65 A L H > S+ 0 0 34 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.902 110.2 51.6 -63.9 -42.2 28.2 15.2 -14.3 64 66 A A H X S+ 0 0 0 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.881 111.4 46.8 -59.4 -42.6 24.9 16.7 -13.1 65 67 A L H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.922 112.2 49.9 -69.4 -43.0 24.1 13.6 -11.0 66 68 A A H X S+ 0 0 8 -4,-2.5 4,-2.3 2,-0.2 5,-0.2 0.951 110.9 49.2 -60.1 -50.9 27.6 13.6 -9.6 67 69 A I H X S+ 0 0 5 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.893 109.2 53.6 -53.3 -44.4 27.4 17.3 -8.6 68 70 A M H X S+ 0 0 7 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.880 109.7 47.6 -60.6 -38.2 24.0 16.7 -7.0 69 71 A S H X S+ 0 0 0 -4,-2.0 4,-2.0 -3,-0.2 -2,-0.2 0.914 111.8 47.9 -71.6 -42.7 25.4 13.9 -4.8 70 72 A I H X S+ 0 0 3 -4,-2.3 4,-2.9 2,-0.2 5,-0.2 0.863 107.8 60.0 -61.5 -37.4 28.4 16.0 -3.7 71 73 A Y H X S+ 0 0 7 -4,-2.2 4,-2.2 -5,-0.2 -2,-0.2 0.962 107.0 42.7 -56.1 -55.6 26.0 18.7 -3.0 72 74 A G H X S+ 0 0 4 -4,-1.9 4,-2.4 1,-0.2 -1,-0.2 0.888 113.8 52.9 -60.4 -40.4 24.0 16.7 -0.5 73 75 A A H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.943 110.1 47.3 -57.3 -50.6 27.2 15.3 1.1 74 76 A L H X S+ 0 0 43 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.854 109.9 53.6 -62.9 -37.5 28.6 18.9 1.5 75 77 A V H X S+ 0 0 17 -4,-2.2 4,-1.4 -5,-0.2 -1,-0.2 0.921 109.2 48.5 -62.7 -44.9 25.3 20.0 3.1 76 78 A Y H X S+ 0 0 69 -4,-2.4 4,-0.6 1,-0.2 3,-0.3 0.929 115.0 44.8 -61.4 -44.7 25.5 17.2 5.6 77 79 A M H >X S+ 0 0 51 -4,-2.4 4,-1.5 1,-0.2 3,-1.3 0.883 106.0 61.4 -62.5 -39.5 29.1 18.0 6.5 78 80 A S H 3X S+ 0 0 14 -4,-2.5 4,-3.5 1,-0.3 -1,-0.2 0.825 94.7 61.9 -62.3 -34.0 28.3 21.7 6.6 79 81 A G H 3X S+ 0 0 12 -4,-1.4 4,-1.8 -3,-0.3 -1,-0.3 0.770 101.4 53.5 -63.0 -28.3 25.9 21.2 9.5 80 82 A I H S+ 0 0 40 -4,-1.9 5,-3.3 2,-0.2 4,-1.7 0.874 111.9 43.9 -67.8 -39.2 30.1 28.0 14.8 86 88 A A H <>S+ 0 0 0 -4,-1.9 5,-2.3 4,-0.2 -2,-0.2 0.944 117.8 46.2 -64.9 -46.9 26.9 28.6 16.7 87 89 A D H <5S+ 0 0 63 -4,-2.2 131,-2.9 -5,-0.2 -2,-0.2 0.839 127.6 22.5 -68.0 -35.2 28.2 26.8 19.8 88 90 A R H <5S+ 0 0 40 -4,-2.5 132,-1.1 129,-0.2 -1,-0.2 0.565 136.3 11.0-114.5 -12.7 31.6 28.5 19.9 89 91 A V T <5S+ 0 0 52 -4,-1.7 -3,-0.2 -5,-0.3 -4,-0.1 0.656 126.3 23.2-135.8 -37.9 31.4 31.8 18.0 90 92 A F T < - 0 0 0 -5,-2.3 4,-1.0 -6,-0.5 125,-0.2 -0.244 37.9 -85.5 82.7 170.6 25.3 31.6 19.2 92 94 A T H > S+ 0 0 11 123,-0.4 4,-2.4 2,-0.2 5,-0.2 0.871 122.1 57.2 -86.2 -37.2 22.4 29.9 17.5 93 95 A S H > S+ 0 0 10 120,-2.0 4,-1.6 1,-0.2 -1,-0.2 0.887 112.4 42.8 -61.1 -39.7 20.0 32.8 16.9 94 96 A R H > S+ 0 0 111 119,-0.7 4,-2.5 -4,-0.4 5,-0.3 0.824 109.4 57.0 -78.7 -31.9 22.7 34.7 14.9 95 97 A A H X S+ 0 0 0 -4,-1.0 4,-2.8 118,-0.2 5,-0.2 0.934 107.4 50.2 -60.5 -43.8 23.8 31.5 13.1 96 98 A V H X S+ 0 0 2 -4,-2.4 4,-2.7 2,-0.2 -2,-0.2 0.917 111.2 48.5 -59.4 -46.5 20.2 31.2 11.8 97 99 A F H X S+ 0 0 50 -4,-1.6 4,-2.1 2,-0.2 -2,-0.2 0.942 115.9 40.6 -61.5 -52.9 20.1 34.8 10.7 98 100 A Y H X S+ 0 0 99 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.901 114.8 54.0 -65.2 -39.4 23.4 34.7 8.8 99 101 A G H X S+ 0 0 0 -4,-2.8 4,-2.7 -5,-0.3 5,-0.2 0.946 108.0 49.9 -57.1 -50.2 22.6 31.3 7.4 100 102 A G H X S+ 0 0 0 -4,-2.7 4,-2.8 -5,-0.2 -1,-0.2 0.904 110.0 50.1 -54.8 -47.2 19.3 32.5 6.1 101 103 A L H X S+ 0 0 70 -4,-2.1 4,-2.7 1,-0.2 -1,-0.2 0.938 112.4 47.3 -57.7 -49.2 20.9 35.5 4.4 102 104 A L H X S+ 0 0 47 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.865 112.5 49.6 -60.4 -40.7 23.5 33.3 2.7 103 105 A I H X S+ 0 0 1 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.905 110.6 49.8 -64.9 -43.9 20.8 30.8 1.6 104 106 A M H X S+ 0 0 40 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.943 110.3 50.0 -62.2 -45.5 18.7 33.6 0.2 105 107 A A H X S+ 0 0 38 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.861 108.1 55.3 -59.1 -36.4 21.7 35.0 -1.7 106 108 A G H X S+ 0 0 0 -4,-1.7 4,-0.7 1,-0.2 -1,-0.2 0.920 108.0 46.6 -64.5 -45.3 22.4 31.5 -3.0 107 109 A H H >X S+ 0 0 0 -4,-2.1 4,-1.6 1,-0.2 3,-0.7 0.871 109.3 54.8 -63.6 -39.6 18.9 31.2 -4.5 108 110 A I H 3X S+ 0 0 70 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.860 99.2 62.0 -61.9 -35.6 19.1 34.6 -6.1 109 111 A A H 3< S+ 0 0 15 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.796 112.1 38.2 -63.1 -27.4 22.3 33.5 -7.8 110 112 A L H << S+ 0 0 3 -4,-0.7 -1,-0.2 -3,-0.7 -2,-0.2 0.699 109.9 60.2 -89.5 -27.0 20.2 30.9 -9.6 111 113 A A H < S+ 0 0 26 -4,-1.6 77,-0.2 76,-0.3 -2,-0.2 0.817 95.8 70.5 -76.3 -30.9 17.1 33.1 -10.1 112 114 A I S < S- 0 0 89 -4,-2.0 2,-0.1 -5,-0.1 75,-0.0 -0.438 107.1 -82.7 -79.3 159.1 19.0 35.6 -12.2 113 115 A P S S+ 0 0 120 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.437 76.3 124.5 -62.7 134.0 20.1 34.8 -15.7 114 116 A G - 0 0 37 -4,-0.1 2,-0.1 -2,-0.1 -4,-0.0 -0.976 44.2-132.0-175.0 173.3 23.4 32.9 -15.5 115 117 A G > - 0 0 35 -2,-0.3 4,-1.1 -58,-0.0 -58,-0.1 0.019 61.0 -43.6-115.9-136.6 25.4 29.8 -16.4 116 118 A V H > S+ 0 0 64 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.800 128.1 57.7 -77.3 -30.6 27.6 27.2 -14.7 117 119 A A H > S+ 0 0 72 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.956 105.9 51.7 -60.5 -48.4 29.7 29.8 -12.7 118 120 A A H > S+ 0 0 25 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.842 107.0 54.5 -56.9 -34.9 26.4 31.0 -11.1 119 121 A L H X S+ 0 0 1 -4,-1.1 4,-2.4 2,-0.2 -1,-0.2 0.922 107.4 48.8 -65.6 -45.1 25.6 27.5 -10.2 120 122 A F H X S+ 0 0 83 -4,-1.9 4,-1.9 2,-0.2 -2,-0.2 0.876 113.0 47.0 -63.8 -38.8 28.9 26.9 -8.3 121 123 A V H X S+ 0 0 80 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.896 111.1 53.1 -66.2 -41.0 28.5 30.2 -6.4 122 124 A S H X S+ 0 0 1 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.912 109.5 48.2 -60.3 -44.6 24.9 29.3 -5.6 123 125 A M H X S+ 0 0 14 -4,-2.4 4,-3.1 2,-0.2 5,-0.2 0.910 110.5 50.3 -62.6 -46.2 26.0 25.9 -4.2 124 126 A A H X S+ 0 0 60 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.935 112.7 47.0 -57.5 -49.3 28.7 27.3 -2.0 125 127 A L H X S+ 0 0 47 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.907 115.7 44.3 -61.7 -44.3 26.3 29.9 -0.6 126 128 A I H X S+ 0 0 0 -4,-2.5 4,-2.4 2,-0.2 5,-0.3 0.858 112.6 51.8 -70.8 -36.7 23.6 27.3 0.1 127 129 A V H X S+ 0 0 24 -4,-3.1 4,-1.5 -5,-0.2 -2,-0.2 0.967 115.9 41.0 -63.0 -50.4 26.1 24.8 1.6 128 130 A L H X S+ 0 0 85 -4,-2.7 4,-1.3 -5,-0.2 -2,-0.2 0.934 119.0 45.3 -59.4 -49.9 27.5 27.4 3.9 129 131 A G H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.845 111.3 49.6 -69.2 -38.6 24.2 28.9 4.9 130 132 A T H X S+ 0 0 3 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.849 107.2 58.0 -69.4 -33.2 22.3 25.7 5.4 131 133 A G H < S+ 0 0 0 -4,-1.5 -1,-0.2 -5,-0.3 -2,-0.2 0.895 112.7 40.2 -59.6 -39.1 25.1 24.6 7.6 132 134 A L H < S+ 0 0 8 -4,-1.3 4,-0.3 -5,-0.1 -2,-0.2 0.865 124.0 35.3 -79.6 -39.2 24.5 27.7 9.7 133 135 A L H X S+ 0 0 1 -4,-2.6 4,-2.4 3,-0.1 3,-0.5 0.962 107.7 56.9 -82.2 -54.6 20.7 27.7 9.8 134 136 A K H X S+ 0 0 65 -4,-1.7 4,-1.0 1,-0.3 -3,-0.1 0.863 110.7 35.9 -59.4 -52.7 19.5 24.1 9.8 135 137 A P H > S+ 0 0 38 0, 0.0 4,-0.7 0, 0.0 -1,-0.3 0.793 120.7 51.0 -69.3 -21.6 21.1 22.5 12.9 136 138 A N H > S+ 0 0 8 -3,-0.5 4,-1.4 -4,-0.3 -2,-0.2 0.797 99.5 57.5 -91.7 -31.0 20.8 25.7 14.9 137 139 A V H X S+ 0 0 0 -4,-2.4 4,-1.0 1,-0.2 3,-0.2 0.908 109.6 50.4 -59.8 -40.2 17.1 26.6 14.4 138 140 A S H X S+ 0 0 23 -4,-1.0 4,-0.9 -5,-0.3 -1,-0.2 0.800 103.8 58.2 -67.8 -31.4 16.3 23.2 15.9 139 141 A S H X S+ 0 0 54 -4,-0.7 4,-0.8 1,-0.2 3,-0.3 0.879 102.7 54.8 -65.4 -35.4 18.6 23.9 18.8 140 142 A I H < S+ 0 0 0 -4,-1.4 4,-0.5 1,-0.2 3,-0.2 0.806 95.4 66.0 -69.7 -29.8 16.6 27.0 19.7 141 143 A V H >X S+ 0 0 0 -4,-1.0 3,-1.2 1,-0.3 4,-0.6 0.891 98.4 52.5 -64.1 -38.3 13.3 25.1 19.9 142 144 A G H >< S+ 0 0 5 -4,-0.9 3,-0.8 -3,-0.3 -1,-0.3 0.870 101.7 64.4 -58.2 -35.2 14.4 23.1 22.9 143 145 A D T 3< S+ 0 0 43 -4,-0.8 -1,-0.2 -3,-0.2 -2,-0.2 0.626 92.0 61.8 -66.4 -16.8 15.3 26.5 24.5 144 146 A M T <4 S+ 0 0 0 -3,-1.2 2,-0.5 -4,-0.5 -1,-0.2 0.822 92.5 72.1 -81.4 -29.9 11.7 27.6 24.6 145 147 A Y S << S- 0 0 8 -3,-0.8 3,-0.1 -4,-0.6 -137,-0.1 -0.766 81.2-131.0 -92.0 124.9 10.4 24.9 26.9 146 148 A K > - 0 0 94 -2,-0.5 3,-2.0 1,-0.1 6,-0.1 -0.329 44.9 -83.4 -60.4 149.7 11.4 25.0 30.6 147 149 A P T 3 S+ 0 0 86 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.402 120.9 29.8 -56.9 130.0 12.8 21.7 31.9 148 150 A G T 3 S+ 0 0 86 1,-0.3 2,-0.6 -3,-0.1 -2,-0.1 0.350 80.5 142.6 100.7 -4.9 9.8 19.5 32.8 149 151 A D X - 0 0 13 -3,-2.0 3,-1.6 1,-0.2 -1,-0.3 -0.597 42.6-153.7 -74.8 117.1 7.5 21.0 30.2 150 152 A D T 3 S+ 0 0 148 -2,-0.6 4,-0.4 1,-0.3 3,-0.2 0.505 88.7 69.2 -68.6 -5.2 5.3 18.1 28.9 151 153 A R T 3> S+ 0 0 48 1,-0.2 4,-2.7 2,-0.1 -1,-0.3 0.575 74.0 90.4 -87.5 -11.1 4.8 20.0 25.6 152 154 A R H <> S+ 0 0 94 -3,-1.6 4,-1.7 1,-0.2 5,-0.2 0.900 85.8 45.4 -56.3 -52.7 8.4 19.6 24.6 153 155 A D H > S+ 0 0 131 -4,-0.2 4,-2.0 1,-0.2 3,-0.3 0.931 116.1 47.5 -57.7 -46.4 8.1 16.3 22.7 154 156 A A H > S+ 0 0 47 -4,-0.4 4,-2.5 1,-0.2 -1,-0.2 0.856 108.4 55.3 -62.3 -37.9 5.0 17.5 20.9 155 157 A G H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.820 108.7 47.8 -66.3 -31.5 6.7 20.8 20.1 156 158 A F H X S+ 0 0 42 -4,-1.7 4,-2.7 -3,-0.3 -1,-0.2 0.851 110.1 52.8 -75.6 -36.0 9.5 18.9 18.4 157 159 A S H X S+ 0 0 81 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.918 110.4 46.7 -63.4 -44.3 7.0 16.8 16.5 158 160 A I H X S+ 0 0 57 -4,-2.5 4,-1.3 2,-0.2 -2,-0.2 0.945 113.4 49.9 -62.2 -47.0 5.2 19.9 15.2 159 161 A F H >X S+ 0 0 0 -4,-1.9 4,-0.8 1,-0.2 3,-0.6 0.918 111.5 46.8 -56.5 -49.4 8.5 21.5 14.2 160 162 A Y H 3X S+ 0 0 108 -4,-2.7 4,-1.5 1,-0.2 3,-0.4 0.808 103.8 63.4 -66.6 -30.1 9.8 18.5 12.3 161 163 A M H 3X S+ 0 0 87 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.865 95.6 59.6 -60.3 -37.1 6.4 18.1 10.6 162 164 A G H X S+ 0 0 60 -4,-2.5 4,-1.6 1,-0.2 3,-0.9 0.851 101.7 70.5 -78.7 -36.6 4.8 21.0 -1.2 170 172 A A H >X>S+ 0 0 0 -4,-2.1 5,-1.7 -5,-0.3 4,-1.6 0.896 97.1 48.9 -54.2 -49.3 8.0 22.4 -2.8 171 173 A P H 345S+ 0 0 1 0, 0.0 5,-0.5 0, 0.0 -1,-0.3 0.812 112.7 51.1 -60.9 -26.1 8.2 20.0 -5.7 172 174 A L H <45S+ 0 0 64 -3,-0.9 -2,-0.2 -4,-0.5 -3,-0.1 0.771 123.8 27.4 -80.6 -25.4 4.5 20.8 -6.4 173 175 A V H S+ 0 0 45 -5,-0.5 4,-2.7 -6,-0.2 5,-0.4 0.940 117.4 46.5 -61.0 -49.4 5.7 22.9 -11.4 177 179 A A H X>S+ 0 0 11 -4,-2.3 4,-1.8 1,-0.2 5,-1.4 0.915 114.5 46.7 -61.2 -46.7 6.7 26.5 -12.0 178 180 A G H <5S+ 0 0 2 -4,-2.6 -1,-0.2 3,-0.2 -2,-0.2 0.887 119.4 38.1 -64.8 -42.9 10.3 25.7 -12.9 179 181 A M H <5S+ 0 0 46 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.867 121.8 40.7 -79.2 -39.2 9.5 22.8 -15.3 180 182 A K H <5S+ 0 0 75 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.781 133.4 12.8 -83.6 -26.9 6.4 24.2 -17.0 181 183 A Y T <5S- 0 0 187 -4,-1.8 2,-0.3 -5,-0.4 -3,-0.2 0.802 122.3 -35.3-112.0 -64.3 7.5 27.8 -17.4 182 184 A N >< - 0 0 77 -5,-1.4 4,-1.5 1,-0.1 -1,-0.2 -0.948 40.4-126.3-169.4 139.2 11.1 28.6 -16.8 183 185 A F H > S+ 0 0 9 -2,-0.3 4,-2.3 1,-0.2 3,-0.2 0.939 110.3 53.5 -61.5 -46.9 13.9 27.2 -14.5 184 186 A H H > S+ 0 0 38 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.815 103.2 57.2 -60.7 -33.2 14.8 30.7 -13.2 185 187 A L H > S+ 0 0 80 2,-0.2 4,-2.1 1,-0.2 -1,-0.3 0.942 107.6 49.7 -59.1 -46.4 11.2 31.3 -12.2 186 188 A G H X S+ 0 0 0 -4,-1.5 4,-1.8 -3,-0.2 3,-0.2 0.947 110.9 46.8 -54.6 -53.1 11.5 28.2 -10.1 187 189 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -76,-0.3 0.816 109.7 56.6 -63.0 -29.3 14.7 29.3 -8.5 188 190 A G H X S+ 0 0 19 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.875 104.2 50.8 -67.3 -41.7 13.0 32.7 -7.9 189 191 A L H X S+ 0 0 57 -4,-2.1 4,-2.3 -3,-0.2 -2,-0.2 0.857 109.4 52.1 -63.4 -35.1 10.1 31.1 -6.0 190 192 A A H X S+ 0 0 0 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.946 109.3 50.2 -64.3 -44.5 12.7 29.4 -3.9 191 193 A A H X S+ 0 0 12 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.898 110.3 48.5 -58.1 -45.4 14.3 32.7 -3.3 192 194 A V H X S+ 0 0 77 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.900 108.4 57.1 -62.2 -41.3 11.0 34.3 -2.2 193 195 A G H >X S+ 0 0 2 -4,-2.3 4,-1.8 1,-0.2 3,-0.5 0.967 108.4 43.5 -51.7 -61.1 10.5 31.3 0.0 194 196 A M H 3X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.861 109.9 58.8 -56.1 -35.9 13.7 31.8 2.0 195 197 A F H 3X S+ 0 0 107 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.906 104.4 49.7 -60.7 -41.5 12.9 35.5 2.1 196 198 A L H S+ 0 0 118 -4,-0.4 4,-1.1 3,-0.2 -1,-0.2 0.984 117.4 26.2 -63.5 -57.0 12.8 39.4 19.7 207 209 A K H 4 S+ 0 0 69 -4,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.874 127.5 45.8 -74.5 -36.1 9.5 39.0 21.5 208 210 A N H < S+ 0 0 15 -4,-2.4 -186,-0.4 1,-0.2 -3,-0.2 0.800 124.7 27.0 -81.2 -32.6 9.0 35.3 20.7 209 211 A L H >< S+ 0 0 1 -4,-1.7 3,-2.5 -5,-0.3 -3,-0.2 0.545 79.8 178.2-109.9 -10.4 12.5 33.9 21.5 210 212 A G T 3< S- 0 0 26 -4,-1.1 -1,-0.2 -5,-0.4 -199,-0.1 -0.184 74.3 -7.5 51.0-113.5 13.7 36.4 24.1 211 213 A L T > S+ 0 0 55 -204,-0.5 3,-2.1 -205,-0.2 -1,-0.3 0.606 100.1 124.9 -87.7 -13.2 17.1 35.3 25.3 212 214 A A T < S- 0 0 0 -3,-2.5 -72,-0.1 -205,-0.3 -3,-0.1 -0.223 85.5 -4.4 -59.6 128.6 17.2 32.0 23.4 213 215 A G T 3 S+ 0 0 2 -121,-0.1 -120,-2.0 1,-0.1 -119,-0.7 0.516 100.8 112.4 73.2 6.5 20.1 31.5 21.1 214 216 A T < + 0 0 62 -3,-2.1 2,-0.3 -121,-0.2 -2,-0.1 0.447 66.0 61.4 -93.6 1.9 21.4 35.0 21.8 215 217 A Y S S- 0 0 45 -4,-0.2 -123,-0.4 -213,-0.1 -122,-0.2 -0.808 86.4-109.3-125.2 162.9 24.5 34.0 23.7 216 218 A V - 0 0 35 -2,-0.3 -129,-0.1 1,-0.2 -128,-0.1 -0.826 27.3-164.4 -97.9 102.8 27.7 32.0 22.9 217 219 A P S S+ 0 0 37 0, 0.0 -1,-0.2 0, 0.0 -129,-0.2 0.829 83.8 17.9 -54.7 -43.3 27.4 28.7 24.9 218 220 A N S S- 0 0 71 -131,-2.9 -127,-0.0 -132,-0.2 -131,-0.0 -0.581 85.3-169.2-135.2 70.9 31.0 27.6 24.6 219 221 A P - 0 0 64 0, 0.0 2,-0.2 0, 0.0 -130,-0.2 -0.212 25.1-111.0 -66.1 147.9 33.1 30.7 23.6 220 222 A L - 0 0 18 -132,-1.1 -2,-0.0 1,-0.1 0, 0.0 -0.522 35.3-115.0 -69.9 143.7 36.8 30.5 22.4 221 223 A T > - 0 0 70 -2,-0.2 4,-2.5 1,-0.1 3,-0.3 -0.373 35.0 -97.7 -70.3 160.4 39.3 32.0 24.9 222 224 A P H > S+ 0 0 97 0, 0.0 4,-1.4 0, 0.0 5,-0.1 0.878 127.3 47.9 -45.0 -47.3 41.2 35.1 23.7 223 225 A A H > S+ 0 0 64 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.854 109.3 52.9 -66.3 -37.9 44.2 32.9 22.7 224 226 A E H > S+ 0 0 68 -3,-0.3 4,-3.4 2,-0.2 5,-0.3 0.900 104.4 56.9 -61.3 -41.8 41.9 30.5 20.9 225 227 A K H X S+ 0 0 116 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.861 109.6 44.5 -58.4 -39.0 40.5 33.4 18.9 226 228 A K H X S+ 0 0 151 -4,-1.4 4,-2.3 -5,-0.2 -1,-0.2 0.912 113.4 51.1 -71.5 -42.4 44.0 34.3 17.7 227 229 A K H X S+ 0 0 73 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.957 112.2 45.6 -56.3 -54.5 44.7 30.7 16.9 228 230 A A H X S+ 0 0 25 -4,-3.4 4,-2.7 1,-0.2 -1,-0.2 0.891 111.3 53.4 -56.2 -44.0 41.6 30.3 14.9 229 231 A A H X S+ 0 0 54 -4,-1.8 4,-2.4 -5,-0.3 -1,-0.2 0.908 111.5 45.4 -60.4 -44.0 42.2 33.6 13.1 230 232 A A H X S+ 0 0 52 -4,-2.3 4,-2.7 2,-0.2 5,-0.4 0.943 112.9 49.2 -65.1 -50.4 45.7 32.5 12.0 231 233 A I H X S+ 0 0 122 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.908 114.0 47.3 -54.9 -45.5 44.6 29.0 10.9 232 234 A M H X S+ 0 0 132 -4,-2.7 4,-3.1 -5,-0.2 -2,-0.2 0.952 113.8 45.7 -61.5 -52.9 41.7 30.5 8.9 233 235 A A H X S+ 0 0 57 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.939 117.3 43.0 -58.4 -53.1 43.8 33.2 7.2 234 236 A V H X S+ 0 0 92 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.896 115.7 51.1 -58.9 -42.2 46.7 30.9 6.4 235 237 A G H X S+ 0 0 32 -4,-2.4 4,-2.2 -5,-0.4 -2,-0.2 0.906 110.4 48.9 -61.2 -42.0 44.2 28.3 5.3 236 238 A A H X S+ 0 0 64 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.913 113.2 45.2 -66.5 -44.8 42.4 30.8 3.1 237 239 A V H X S+ 0 0 100 -4,-2.6 4,-2.2 2,-0.2 -1,-0.2 0.857 112.5 52.1 -68.3 -36.6 45.6 32.0 1.4 238 240 A V H X S+ 0 0 73 -4,-2.2 4,-1.7 -5,-0.2 -2,-0.2 0.897 110.8 46.2 -68.6 -42.3 46.9 28.4 0.9 239 241 A I H X S+ 0 0 102 -4,-2.2 4,-2.1 -5,-0.2 5,-0.2 0.949 113.5 51.8 -60.3 -46.8 43.6 27.2 -0.8 240 242 A A H X S+ 0 0 60 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.863 108.3 49.0 -58.9 -41.9 43.7 30.4 -2.9 241 243 A V H X S+ 0 0 71 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.873 109.6 51.7 -70.5 -37.2 47.3 29.9 -4.1 242 244 A L H >X S+ 0 0 86 -4,-1.7 4,-2.7 1,-0.2 3,-0.8 0.965 109.9 48.5 -60.8 -53.3 46.7 26.2 -5.1 243 245 A L H 3X S+ 0 0 74 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.787 102.3 65.4 -58.4 -31.1 43.7 27.1 -7.2 244 246 A A H 3< S+ 0 0 66 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.901 116.4 25.6 -59.9 -43.7 45.6 29.9 -8.9 245 247 A I H S+ 0 0 59 -4,-2.7 4,-2.1 3,-0.3 6,-1.8 0.905 97.8 58.4 -80.2 -45.3 45.6 24.5 -10.6 247 249 A I H <5S+ 0 0 63 -4,-2.3 -1,-0.2 4,-0.3 -3,-0.1 0.890 123.5 23.8 -56.8 -42.8 42.5 25.7 -12.3 248 250 A P H 45S+ 0 0 100 0, 0.0 -2,-0.2 0, 0.0 -1,-0.2 0.922 146.2 9.8 -84.7 -45.0 44.3 26.7 -15.4 249 251 A N H <5S+ 0 0 79 -4,-1.8 -3,-0.3 -5,-0.2 -2,-0.2 0.331 120.6 57.8-121.9 5.1 47.4 24.4 -15.3 250 252 A G T <5S- 0 0 46 -4,-2.1 -3,-0.1 -5,-0.2 -4,-0.1 0.991 99.6-121.9 -59.6 -73.2 46.9 21.9 -12.5 251 253 A W < + 0 0 64 -5,-0.6 2,-0.6 -4,-0.1 -4,-0.3 0.433 48.1 167.9-100.4 148.5 44.5 20.8 -13.6 252 254 A F + 0 0 58 -6,-1.8 2,-0.2 -9,-0.1 -2,-0.1 -0.954 19.6 160.0-112.6 113.0 41.8 21.3 -10.9 253 255 A T > - 0 0 59 -2,-0.6 4,-2.1 1,-0.0 5,-0.2 -0.642 59.5 -91.9-122.2 178.0 38.4 20.7 -12.3 254 256 A V H > S+ 0 0 34 1,-0.2 4,-2.4 -2,-0.2 5,-0.2 0.803 126.9 58.4 -60.2 -28.0 34.9 19.8 -11.0 255 257 A E H > S+ 0 0 101 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.914 104.5 48.6 -67.2 -44.5 36.0 16.2 -11.6 256 258 A T H > S+ 0 0 52 2,-0.2 4,-3.3 1,-0.2 -2,-0.2 0.918 112.6 48.8 -57.3 -46.3 38.9 16.6 -9.2 257 259 A F H X S+ 0 0 73 -4,-2.1 4,-2.6 2,-0.2 5,-0.2 0.912 110.5 49.5 -64.5 -44.4 36.6 18.2 -6.6 258 260 A I H X S+ 0 0 11 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.909 113.9 47.3 -59.2 -41.1 34.1 15.4 -7.0 259 261 A S H X S+ 0 0 59 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.927 109.8 53.0 -66.1 -45.1 36.9 12.9 -6.6 260 262 A L H X S+ 0 0 78 -4,-3.3 4,-2.8 1,-0.2 -2,-0.2 0.923 108.5 48.7 -54.4 -51.1 38.3 14.8 -3.6 261 263 A V H X S+ 0 0 12 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.882 110.4 53.2 -59.0 -38.2 34.9 14.7 -1.8 262 264 A G H X S+ 0 0 6 -4,-1.7 4,-0.7 2,-0.2 -2,-0.2 0.918 109.1 47.7 -61.2 -46.9 34.8 11.0 -2.6 263 265 A I H >X S+ 0 0 93 -4,-2.6 4,-2.6 1,-0.2 3,-1.4 0.949 112.8 49.3 -56.4 -51.0 38.2 10.4 -1.0 264 266 A L H 3X S+ 0 0 75 -4,-2.8 4,-2.4 1,-0.3 -1,-0.2 0.808 100.7 64.5 -61.0 -32.9 37.1 12.5 2.0 265 267 A G H 3< S+ 0 0 11 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.710 113.9 32.6 -66.5 -21.4 33.9 10.5 2.4 266 268 A I H S+ 0 0 11 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.905 112.0 52.9 -53.1 -40.5 34.8 8.2 9.0 270 272 A I H X S+ 0 0 95 -4,-1.4 4,-2.5 2,-0.2 -2,-0.2 0.937 109.8 46.4 -61.3 -48.1 38.0 6.1 9.3 271 273 A I H X S+ 0 0 93 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.923 111.2 52.4 -58.1 -47.6 39.8 8.8 11.2 272 274 A Y H X S+ 0 0 57 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.912 112.2 46.6 -53.7 -45.7 36.8 9.4 13.5 273 275 A F H X S+ 0 0 24 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.896 113.0 47.7 -67.3 -39.5 36.7 5.7 14.2 274 276 A V H X S+ 0 0 73 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.940 112.4 49.5 -67.2 -45.7 40.5 5.4 14.8 275 277 A V H X S+ 0 0 78 -4,-3.1 4,-1.0 2,-0.2 -2,-0.2 0.929 113.0 46.5 -59.0 -48.7 40.4 8.5 17.1 276 278 A M H >< S+ 0 0 4 -4,-2.4 3,-0.6 -5,-0.2 -1,-0.2 0.946 116.0 45.8 -58.6 -47.3 37.5 7.2 19.2 277 279 A Y H 3< S+ 0 0 108 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.869 117.7 40.9 -66.1 -38.2 39.1 3.7 19.4 278 280 A R H 3< S+ 0 0 195 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.506 85.6 129.1 -89.9 -5.1 42.6 4.9 20.4 279 281 A S X< - 0 0 13 -4,-1.0 3,-1.1 -3,-0.6 8,-0.1 -0.258 54.3-148.9 -59.5 128.6 41.4 7.6 22.7 280 282 A P T 3 S+ 0 0 124 0, 0.0 -1,-0.2 0, 0.0 -4,-0.1 0.573 95.2 68.9 -70.6 -7.1 43.0 7.6 26.2 281 283 A K T 3 S+ 0 0 166 -5,-0.1 148,-0.4 2,-0.1 2,-0.3 0.127 87.6 86.0 -96.0 19.4 39.7 9.1 27.5 282 284 A T S < S- 0 0 15 -3,-1.1 2,-0.2 146,-0.1 -5,-0.0 -0.841 70.6-127.9-120.5 154.1 37.8 5.8 26.8 283 285 A T > - 0 0 65 -2,-0.3 4,-2.1 1,-0.1 5,-0.2 -0.586 31.5-108.4 -93.1 164.0 37.2 2.6 28.8 284 286 A A H > S+ 0 0 68 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.849 122.2 53.1 -58.3 -34.8 37.8 -0.9 27.5 285 287 A E H > S+ 0 0 116 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.878 106.9 50.9 -68.3 -38.9 34.0 -1.3 27.4 286 288 A E H > S+ 0 0 25 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.883 106.0 56.6 -67.1 -36.2 33.5 1.8 25.3 287 289 A R H X S+ 0 0 86 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.885 105.0 50.6 -62.1 -38.7 36.2 0.6 22.9 288 290 A S H X S+ 0 0 66 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.850 109.2 52.9 -66.8 -33.3 34.2 -2.7 22.3 289 291 A R H X S+ 0 0 68 -4,-1.4 4,-1.7 2,-0.2 -2,-0.2 0.866 103.4 55.4 -70.5 -37.5 31.1 -0.5 21.6 290 292 A V H >X S+ 0 0 2 -4,-2.0 4,-1.0 2,-0.2 3,-0.5 0.953 110.2 46.9 -57.9 -47.6 32.9 1.6 19.1 291 293 A I H >< S+ 0 0 80 -4,-1.8 3,-1.0 1,-0.2 -2,-0.2 0.925 110.4 52.7 -57.8 -46.8 33.8 -1.7 17.2 292 294 A A H 3X S+ 0 0 12 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.784 103.9 58.6 -59.1 -27.0 30.2 -2.8 17.6 293 295 A Y H S+ 0 0 38 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.864 113.2 51.7 -62.8 -27.6 28.5 -2.5 11.2 296 298 A L H X S+ 0 0 0 -4,-0.6 4,-2.4 -3,-0.3 -2,-0.2 0.908 109.7 48.8 -68.4 -42.6 25.7 -0.1 12.1 297 299 A F H X S+ 0 0 16 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.903 113.6 47.1 -62.2 -41.2 27.6 2.8 10.6 298 300 A V H X S+ 0 0 65 -4,-2.8 4,-2.7 -5,-0.2 5,-0.2 0.916 111.6 50.1 -67.4 -40.9 28.2 0.8 7.4 299 301 A A H X S+ 0 0 2 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.888 111.5 49.7 -63.9 -39.7 24.5 -0.3 7.3 300 302 A S H X S+ 0 0 0 -4,-2.4 4,-3.0 2,-0.2 5,-0.3 0.963 110.1 49.4 -61.5 -52.4 23.5 3.3 7.7 301 303 A A H X S+ 0 0 17 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.931 112.9 47.5 -53.6 -48.4 25.8 4.5 4.9 302 304 A M H X S+ 0 0 44 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.914 113.1 49.4 -59.6 -44.7 24.5 1.7 2.5 303 305 A F H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.955 112.7 44.6 -60.5 -52.4 20.9 2.7 3.4 304 306 A W H X S+ 0 0 14 -4,-3.0 4,-3.8 1,-0.2 5,-0.3 0.826 105.6 64.1 -65.1 -29.6 21.3 6.4 2.8 305 307 A A H X S+ 0 0 12 -4,-2.2 4,-1.2 -5,-0.3 -1,-0.2 0.956 111.2 36.3 -56.7 -50.8 23.2 5.7 -0.4 306 308 A I H < S+ 0 0 3 -4,-1.7 3,-0.4 2,-0.2 4,-0.3 0.955 119.4 48.9 -66.4 -49.0 20.1 4.1 -1.8 307 309 A Q H >< S+ 0 0 24 -4,-2.8 3,-1.7 1,-0.2 4,-0.2 0.906 110.5 50.5 -60.4 -45.1 17.7 6.6 -0.1 308 310 A E H >< S+ 0 0 9 -4,-3.8 3,-1.6 1,-0.3 4,-0.3 0.770 96.7 68.6 -69.4 -23.5 19.6 9.6 -1.3 309 311 A Q G ><>S+ 0 0 0 -4,-1.2 5,-2.6 -3,-0.4 3,-0.7 0.641 79.7 82.6 -66.2 -9.2 19.7 8.3 -4.8 310 312 A G G < 5S+ 0 0 8 -3,-1.7 -1,-0.3 -4,-0.3 -2,-0.2 0.812 97.1 39.9 -60.8 -28.2 15.9 9.1 -4.7 311 313 A S G < 5S+ 0 0 8 -3,-1.6 -1,-0.2 -4,-0.2 -2,-0.2 0.452 129.8 26.4-100.5 -3.8 16.8 12.7 -5.5 312 314 A T T <>5S+ 0 0 1 -3,-0.7 4,-2.3 -4,-0.3 3,-0.3 0.575 128.0 23.9-119.6 -88.3 19.5 11.9 -8.0 313 315 A I H >5S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 -3,-0.2 0.909 128.4 46.1 -47.1 -51.5 19.4 8.6 -10.0 314 316 A L H > S+ 0 0 2 -6,-0.5 4,-1.3 -3,-0.3 -1,-0.2 0.932 109.7 45.6 -64.0 -45.5 15.0 11.9 -10.5 316 318 A N H X S+ 0 0 7 -4,-2.3 4,-2.3 2,-0.2 3,-0.4 0.930 112.1 53.2 -58.5 -44.3 16.9 11.1 -13.8 317 319 A Y H X>S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.3 5,-0.9 0.903 106.0 51.5 -59.5 -45.1 14.8 7.9 -14.0 318 320 A A H <5S+ 0 0 0 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.842 118.3 40.1 -57.2 -32.3 11.5 9.9 -13.6 319 321 A D H <5S+ 0 0 23 -4,-1.3 -2,-0.2 -3,-0.4 -1,-0.2 0.713 129.7 22.8 -93.1 -26.6 12.7 12.2 -16.4 320 322 A K H <5S+ 0 0 108 -4,-2.3 -3,-0.2 -5,-0.1 -2,-0.2 0.614 129.9 30.5-118.9 -16.3 14.2 9.8 -18.9 321 323 A R T <5S+ 0 0 36 -4,-2.4 74,-2.9 -5,-0.3 2,-0.4 0.467 97.1 88.7-125.2 -9.7 12.8 6.3 -18.3 322 324 A T B +C 329 0C 30 -2,-1.5 3,-2.2 3,-0.6 5,-0.0 -0.885 57.2 16.4-122.6 158.0 -0.7 9.0 -18.5 327 329 A A T 3 S- 0 0 97 -2,-0.3 -1,-0.2 1,-0.3 3,-0.1 0.837 127.8 -64.1 52.1 39.0 -4.4 9.6 -17.8 328 330 A G T 3 S+ 0 0 90 1,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.387 119.0 94.1 71.5 -3.7 -4.6 12.2 -20.5 329 331 A I E < S-C 326 0C 95 -3,-2.2 -3,-0.6 -5,-0.1 2,-0.5 -0.637 73.7-120.9-115.4 170.4 -2.2 14.4 -18.5 330 332 A H E -C 325 0C 115 -5,-0.2 2,-0.2 -2,-0.2 -5,-0.2 -0.953 24.6-147.5-114.4 114.7 1.5 15.1 -18.3 331 333 A L - 0 0 35 -7,-2.4 -7,-0.0 -2,-0.5 3,-0.0 -0.541 16.8-124.9 -74.3 138.4 3.2 14.5 -15.0 332 334 A S > - 0 0 12 -2,-0.2 3,-1.5 1,-0.1 4,-0.3 -0.740 12.7-139.0 -80.2 130.8 6.1 16.7 -14.0 333 335 A P G > S+ 0 0 7 0, 0.0 3,-1.3 0, 0.0 4,-0.3 0.817 102.1 63.5 -59.3 -29.3 9.2 14.5 -13.3 334 336 A A G > S+ 0 0 0 1,-0.2 3,-1.8 2,-0.2 4,-0.2 0.777 85.7 75.5 -64.7 -25.1 10.0 16.8 -10.3 335 337 A W G X S+ 0 0 80 -3,-1.5 3,-1.8 1,-0.3 -1,-0.2 0.728 78.9 71.1 -61.2 -23.0 6.7 15.8 -8.7 336 338 A F G X> S+ 0 0 14 -3,-1.3 3,-1.9 -4,-0.3 4,-0.5 0.787 82.9 71.6 -66.9 -22.7 8.2 12.4 -7.7 337 339 A Q G <4 S+ 0 0 25 -3,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.603 89.1 63.2 -66.5 -10.4 10.3 14.2 -5.1 338 340 A S G <> S+ 0 0 6 -3,-1.8 4,-1.8 -4,-0.2 -1,-0.3 0.585 86.4 76.0 -85.2 -10.7 7.0 14.7 -3.2 339 341 A L H <> S+ 0 0 27 -3,-1.9 4,-2.6 -4,-0.2 5,-0.3 0.934 88.2 52.7 -71.6 -46.7 6.6 10.9 -2.7 340 342 A N H X S+ 0 0 29 -4,-0.5 4,-1.8 1,-0.2 -1,-0.2 0.954 114.9 40.0 -55.5 -55.7 9.2 10.3 0.0 341 343 A P H > S+ 0 0 5 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.896 113.5 56.1 -61.9 -37.3 7.8 13.0 2.4 342 344 A L H X S+ 0 0 52 -4,-1.8 4,-2.1 1,-0.2 -2,-0.2 0.942 109.9 44.4 -56.1 -51.6 4.2 12.1 1.6 343 345 A F H X S+ 0 0 30 -4,-2.6 4,-3.0 1,-0.2 5,-0.3 0.813 112.2 53.9 -65.5 -31.0 4.7 8.5 2.5 344 346 A I H X S+ 0 0 17 -4,-1.8 4,-2.4 -5,-0.3 -1,-0.2 0.942 108.1 48.7 -66.7 -47.0 6.6 9.6 5.7 345 347 A I H < S+ 0 0 50 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.879 119.3 39.8 -59.8 -38.7 3.7 11.8 6.8 346 348 A I H X S+ 0 0 95 -4,-2.1 4,-0.5 -5,-0.2 -2,-0.2 0.940 122.8 36.2 -77.3 -48.2 1.3 9.0 6.2 347 349 A L H X S+ 0 0 26 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.736 95.3 80.0 -84.8 -25.5 3.2 6.0 7.5 348 350 A A H X S+ 0 0 37 -4,-2.4 4,-2.4 -5,-0.3 -1,-0.2 0.911 97.2 44.7 -50.3 -47.9 5.1 7.5 10.5 349 351 A P H > S+ 0 0 84 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.873 111.7 54.5 -68.6 -29.8 2.1 7.3 12.8 350 352 A V H X S+ 0 0 78 -4,-0.5 4,-2.0 -3,-0.2 -2,-0.2 0.947 110.5 44.9 -63.9 -49.8 1.3 3.8 11.6 351 353 A F H X S+ 0 0 21 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.914 110.9 54.6 -56.8 -47.9 4.9 2.6 12.4 352 354 A A H X S+ 0 0 53 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.939 110.2 45.5 -50.7 -55.7 4.8 4.3 15.8 353 355 A W H X S+ 0 0 163 -4,-2.3 4,-2.6 1,-0.2 -1,-0.2 0.859 110.6 56.4 -56.0 -38.1 1.6 2.6 16.8 354 356 A M H X S+ 0 0 63 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.942 106.6 46.8 -62.9 -48.1 3.1 -0.7 15.5 355 357 A W H X S+ 0 0 39 -4,-2.6 4,-1.9 1,-0.2 7,-0.2 0.894 112.7 51.4 -62.5 -38.5 6.2 -0.5 17.7 356 358 A V H < S+ 0 0 105 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.942 110.3 48.3 -61.4 -46.4 4.0 0.3 20.7 357 359 A K H < S+ 0 0 145 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.821 111.4 51.1 -64.3 -31.9 1.8 -2.7 20.0 358 360 A L H >< S+ 0 0 62 -4,-2.1 3,-2.7 -5,-0.2 -1,-0.2 0.840 79.6 158.9 -74.5 -34.2 4.8 -4.9 19.7 359 361 A G G >< S+ 0 0 33 -4,-1.9 3,-2.1 1,-0.3 -1,-0.2 -0.181 73.6 6.3 49.9-128.8 6.3 -3.8 23.0 360 362 A K G 3 S+ 0 0 103 1,-0.3 -1,-0.3 -4,-0.1 -2,-0.1 0.684 132.5 59.5 -52.1 -21.1 8.8 -6.4 24.3 361 363 A R G < S+ 0 0 216 -3,-2.7 -1,-0.3 -6,-0.1 -2,-0.2 0.550 79.6 112.0 -91.4 -6.9 8.4 -8.3 21.0 362 364 A Q S < S- 0 0 71 -3,-2.1 -7,-0.0 -7,-0.2 -6,-0.0 -0.219 79.7 -89.5 -67.3 155.3 9.5 -5.4 18.7 363 365 A P - 0 0 29 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.272 44.6-112.7 -61.7 151.5 12.8 -5.7 16.8 364 366 A T > - 0 0 59 -3,-0.1 4,-2.1 1,-0.1 5,-0.2 -0.225 34.7 -96.1 -74.1 173.9 15.9 -4.5 18.6 365 367 A I H > S+ 0 0 31 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.922 125.4 47.1 -60.5 -46.5 17.8 -1.4 17.3 366 368 A P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.859 111.7 53.3 -65.6 -31.3 20.4 -3.4 15.3 367 369 A Q H > S+ 0 0 61 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.887 106.0 51.9 -66.4 -38.0 17.5 -5.5 13.8 368 370 A K H X S+ 0 0 16 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.836 107.5 53.1 -66.9 -32.2 15.7 -2.3 12.7 369 371 A F H X S+ 0 0 0 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.959 110.0 48.7 -61.3 -50.7 18.9 -1.2 11.0 370 372 A A H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.896 110.0 50.4 -56.1 -45.1 18.9 -4.5 9.2 371 373 A L H X S+ 0 0 48 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.901 107.8 53.8 -62.7 -40.6 15.2 -4.2 8.2 372 374 A G H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.937 110.9 46.7 -57.7 -45.5 15.9 -0.7 6.8 373 375 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.890 109.4 52.8 -64.6 -43.7 18.7 -2.1 4.7 374 376 A L H X S+ 0 0 36 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.918 112.2 45.5 -60.0 -44.4 16.6 -5.1 3.4 375 377 A F H X S+ 0 0 66 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.893 110.8 52.9 -67.5 -41.2 13.8 -2.7 2.3 376 378 A A H X S+ 0 0 0 -4,-2.4 4,-1.2 -5,-0.2 -2,-0.2 0.930 111.6 46.6 -58.8 -43.8 16.3 -0.3 0.7 377 379 A G H >X S+ 0 0 0 -4,-2.5 4,-1.5 1,-0.2 3,-0.6 0.927 110.5 52.7 -65.2 -43.1 17.8 -3.2 -1.3 378 380 A L H 3X S+ 0 0 73 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.855 101.3 61.1 -58.9 -35.7 14.3 -4.4 -2.2 379 381 A S H 3X S+ 0 0 2 -4,-2.1 4,-1.3 1,-0.2 -1,-0.2 0.853 106.3 46.3 -65.4 -32.4 13.4 -1.0 -3.6 380 382 A F H < S+ 0 0 23 -4,-2.4 3,-0.5 1,-0.2 -2,-0.2 0.895 108.0 53.3 -57.0 -42.5 11.8 -3.6 -7.8 383 385 A I H 3X S+ 0 0 0 -4,-1.3 4,-0.6 1,-0.2 -1,-0.2 0.839 104.2 54.0 -72.1 -30.6 12.9 -0.7 -9.9 384 386 A L H 3X S+ 0 0 21 -4,-1.5 4,-1.7 1,-0.2 -1,-0.2 0.788 93.1 79.1 -71.7 -25.1 15.1 -2.8 -12.2 385 387 A V H S+ 0 0 11 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.903 114.9 47.3 -65.4 -38.8 10.1 -3.1 -15.6 387 389 A G H < S+ 0 0 17 -4,-0.6 -2,-0.2 1,-0.2 -3,-0.1 0.818 114.9 49.6 -67.3 -29.8 13.0 -2.0 -17.7 388 390 A H H < S+ 0 0 116 -4,-1.7 -1,-0.2 1,-0.2 -3,-0.2 0.856 113.4 44.2 -74.5 -38.1 14.3 -5.6 -17.6 389 391 A L H < S+ 0 0 127 -4,-2.5 -2,-0.2 -5,-0.2 2,-0.2 0.796 104.9 72.6 -79.5 -29.3 10.9 -7.0 -18.7 390 392 A S S < S- 0 0 41 -4,-2.3 3,-0.1 -5,-0.2 5,-0.0 -0.547 80.1-133.9 -82.9 152.9 10.3 -4.5 -21.4 391 393 A G S S- 0 0 98 1,-0.2 2,-0.3 -2,-0.2 -1,-0.1 0.766 76.1 -61.6 -70.6 -24.9 12.2 -4.6 -24.7 392 394 A G S S+ 0 0 49 2,-0.1 -1,-0.2 -3,-0.0 -4,-0.0 -0.974 87.2 89.8 168.2-169.0 12.7 -0.8 -24.2 393 395 A G S S- 0 0 55 -2,-0.3 -3,-0.1 -3,-0.1 2,-0.1 -0.031 82.0 -32.7 79.5 177.2 10.8 2.4 -24.0 394 396 A L - 0 0 103 -72,-0.1 -72,-0.3 1,-0.1 2,-0.3 -0.388 60.2-136.0 -71.3 146.8 9.4 4.3 -21.0 395 397 A V B -b 322 0B 8 -74,-2.9 -72,-3.4 1,-0.1 5,-0.1 -0.706 31.4 -86.7-101.7 156.3 8.0 2.2 -18.1 396 398 A H > - 0 0 92 -2,-0.3 3,-1.5 -74,-0.2 4,-0.5 -0.361 33.5-128.2 -60.4 136.9 4.8 2.8 -16.1 397 399 A P T >> S+ 0 0 11 0, 0.0 4,-2.2 0, 0.0 3,-0.5 0.699 98.2 81.4 -61.5 -20.1 5.2 5.4 -13.3 398 400 A I H 3> S+ 0 0 94 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.786 87.2 57.8 -56.5 -28.2 3.6 2.9 -10.8 399 401 A W H <> S+ 0 0 83 -3,-1.5 4,-1.8 2,-0.2 -1,-0.2 0.890 106.2 46.1 -70.4 -42.4 7.0 1.2 -10.5 400 402 A L H <> S+ 0 0 1 -3,-0.5 4,-2.3 -4,-0.5 5,-0.2 0.932 111.3 53.1 -66.3 -44.8 8.8 4.3 -9.4 401 403 A V H X S+ 0 0 41 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.932 109.7 49.1 -52.4 -47.5 6.0 5.0 -6.9 402 404 A L H X S+ 0 0 73 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.863 108.3 52.9 -63.3 -36.8 6.4 1.5 -5.5 403 405 A S H X S+ 0 0 0 -4,-1.8 4,-1.9 2,-0.2 -1,-0.2 0.913 111.4 45.8 -66.9 -41.4 10.2 1.9 -5.2 404 406 A Y H X S+ 0 0 5 -4,-2.3 4,-1.7 2,-0.2 -2,-0.2 0.875 111.7 52.9 -66.6 -40.7 9.8 5.2 -3.2 405 407 A F H X S+ 0 0 69 -4,-2.5 4,-1.7 -5,-0.2 -2,-0.2 0.942 109.7 48.5 -57.1 -47.8 7.1 3.6 -1.0 406 408 A I H X S+ 0 0 13 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.885 107.2 53.3 -64.2 -41.4 9.4 0.6 -0.2 407 409 A V H X S+ 0 0 10 -4,-1.9 4,-2.6 1,-0.2 -1,-0.2 0.892 106.5 55.1 -64.3 -34.8 12.4 2.8 0.7 408 410 A V H X S+ 0 0 0 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.892 101.4 56.7 -61.9 -40.6 10.1 4.6 3.1 409 411 A L H < S+ 0 0 35 -4,-1.7 4,-0.4 1,-0.2 -1,-0.2 0.932 112.4 43.6 -54.9 -42.2 9.2 1.4 4.8 410 412 A G H >X S+ 0 0 0 -4,-1.7 4,-2.3 1,-0.2 3,-0.9 0.876 109.6 55.4 -69.2 -40.0 13.0 1.0 5.3 411 413 A E H 3X S+ 0 0 23 -4,-2.6 4,-1.8 1,-0.3 -1,-0.2 0.887 104.0 53.6 -63.0 -38.7 13.5 4.6 6.4 412 414 A L H 3< S+ 0 0 18 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.622 111.6 48.0 -76.5 -10.5 10.9 4.3 9.2 413 415 A C H <4 S+ 0 0 4 -3,-0.9 4,-0.3 -4,-0.4 -2,-0.2 0.907 125.0 23.4 -83.8 -54.3 12.8 1.2 10.5 414 416 A L H >< S+ 0 0 0 -4,-2.3 3,-1.2 -45,-0.2 4,-0.4 0.907 114.1 58.7 -84.0 -49.9 16.3 2.6 10.5 415 417 A S G >X S+ 0 0 37 -4,-1.8 3,-1.7 -5,-0.3 4,-0.6 0.879 98.0 56.5 -56.8 -46.8 16.2 6.4 10.7 416 418 A P G 34 S+ 0 0 83 0, 0.0 4,-0.3 0, 0.0 -1,-0.2 0.696 115.7 38.8 -65.0 -15.1 14.2 6.9 14.0 417 419 A V G <> S+ 0 0 18 -3,-1.2 4,-2.8 -4,-0.3 -2,-0.2 0.285 89.9 95.1-112.5 7.2 16.8 4.8 16.0 418 420 A G H <> S+ 0 0 0 -3,-1.7 4,-1.9 -4,-0.4 5,-0.1 0.938 89.9 40.2 -63.3 -49.9 19.9 6.1 14.2 419 421 A L H X S+ 0 0 51 -4,-0.6 4,-2.7 2,-0.2 5,-0.2 0.938 115.9 52.6 -62.5 -47.2 20.7 8.8 16.7 420 422 A S H > S+ 0 0 43 -4,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.917 109.3 48.6 -56.6 -47.3 19.8 6.5 19.6 421 423 A A H X S+ 0 0 0 -4,-2.8 4,-0.9 1,-0.2 -1,-0.2 0.905 111.6 50.4 -58.9 -42.6 22.2 3.7 18.2 422 424 A T H >X S+ 0 0 0 -4,-1.9 4,-1.2 1,-0.2 3,-0.6 0.920 112.1 45.6 -65.9 -43.9 25.0 6.2 17.8 423 425 A T H 3< S+ 0 0 67 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.871 110.0 54.9 -68.3 -36.2 24.7 7.6 21.4 424 426 A K H 3< S+ 0 0 51 -4,-2.2 67,-0.9 -5,-0.2 -1,-0.2 0.699 117.9 34.5 -69.9 -18.2 24.4 4.2 22.9 425 427 A L H << S+ 0 0 0 -4,-0.9 -132,-0.2 -3,-0.6 -1,-0.2 0.474 96.3 92.3-119.3 -6.7 27.6 3.0 21.4 426 428 A A S < S- 0 0 19 -4,-1.2 5,-0.1 -3,-0.2 -139,-0.1 -0.665 84.1-100.7 -88.2 147.5 29.8 6.2 21.3 427 429 A P > - 0 0 1 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 -0.307 27.0-117.0 -64.5 149.8 32.2 6.8 24.3 428 430 A A G > S+ 0 0 68 1,-0.3 3,-1.7 2,-0.2 4,-0.2 0.857 115.2 61.0 -56.4 -37.2 31.1 9.3 27.0 429 431 A A G 3 S+ 0 0 48 -148,-0.4 -1,-0.3 1,-0.3 3,-0.2 0.729 108.8 43.7 -60.8 -21.9 34.0 11.6 26.1 430 432 A F G X S+ 0 0 27 -3,-1.6 3,-1.5 1,-0.2 -1,-0.3 0.158 76.2 116.4-110.9 17.5 32.6 11.9 22.5 431 433 A S G X S+ 0 0 79 -3,-1.7 3,-0.9 1,-0.3 4,-0.2 0.795 74.6 55.4 -58.0 -30.8 29.0 12.4 23.6 432 434 A A G 3 S+ 0 0 89 -3,-0.2 3,-0.4 1,-0.2 -1,-0.3 0.707 101.5 57.4 -75.3 -21.2 29.0 15.9 22.0 433 435 A Q G <> S+ 0 0 72 -3,-1.5 4,-1.9 1,-0.2 -1,-0.2 0.176 77.9 105.5 -91.5 17.2 30.1 14.5 18.6 434 436 A T H <> S+ 0 0 20 -3,-0.9 4,-1.7 2,-0.2 -1,-0.2 0.862 76.5 45.2 -74.9 -37.6 27.1 12.3 18.5 435 437 A M H > S+ 0 0 113 -3,-0.4 4,-2.8 2,-0.2 5,-0.2 0.899 112.8 52.8 -71.1 -39.8 25.0 14.1 15.9 436 438 A S H > S+ 0 0 21 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.902 107.0 52.2 -58.7 -44.3 28.0 14.6 13.7 437 439 A L H X S+ 0 0 1 -4,-1.9 4,-0.9 2,-0.2 -1,-0.2 0.926 112.4 45.1 -62.5 -43.2 28.8 10.9 13.7 438 440 A W H >X S+ 0 0 22 -4,-1.7 4,-0.8 1,-0.2 3,-0.7 0.920 114.2 48.0 -66.5 -44.7 25.2 10.1 12.7 439 441 A F H 3X S+ 0 0 55 -4,-2.8 4,-2.4 1,-0.2 3,-0.3 0.815 102.8 66.6 -62.0 -30.1 25.1 12.7 10.0 440 442 A L H 3X S+ 0 0 3 -4,-2.1 4,-2.9 1,-0.2 -1,-0.2 0.817 91.3 59.1 -65.8 -32.4 28.5 11.5 8.8 441 443 A S H X S+ 0 0 64 -4,-2.0 3,-1.7 1,-0.2 4,-0.8 0.902 105.0 63.2 -69.4 -40.3 30.2 7.6 -2.6 449 451 A N H >X S+ 0 0 1 -4,-2.6 3,-1.4 1,-0.3 4,-0.8 0.888 97.0 59.5 -50.8 -41.6 27.0 8.0 -4.6 450 452 A A H 3< S+ 0 0 6 -4,-1.7 -1,-0.3 1,-0.3 4,-0.2 0.755 103.9 49.7 -60.9 -27.4 28.8 10.6 -6.7 451 453 A Q H <4 S+ 0 0 61 -3,-1.7 -1,-0.3 -4,-0.5 3,-0.3 0.595 106.4 57.2 -86.4 -10.8 31.5 8.1 -7.7 452 454 A L H X< S+ 0 0 45 -3,-1.4 3,-1.9 -4,-0.8 4,-0.4 0.580 80.2 90.1 -93.6 -14.0 28.9 5.5 -8.7 453 455 A V G >< S+ 0 0 4 -4,-0.8 3,-1.4 1,-0.3 -1,-0.2 0.787 75.2 65.1 -57.6 -34.1 27.2 7.7 -11.3 454 456 A R G 3 S+ 0 0 114 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.768 97.0 58.2 -61.3 -23.2 29.3 6.6 -14.2 455 457 A F G < S+ 0 0 112 -3,-1.9 2,-1.0 -4,-0.1 -1,-0.3 0.636 84.3 93.0 -83.3 -14.2 27.8 3.1 -13.8 456 458 A Y < + 0 0 7 -3,-1.4 5,-0.1 -4,-0.4 -1,-0.1 -0.705 51.9 132.0 -86.4 101.3 24.3 4.4 -14.3 457 459 A T - 0 0 39 -2,-1.0 7,-0.2 1,-0.1 4,-0.2 -0.957 68.1-108.4-139.6 159.5 23.4 4.1 -18.1 458 460 A P S > S+ 0 0 109 0, 0.0 3,-0.9 0, 0.0 4,-0.3 0.900 118.7 53.3 -52.8 -41.1 20.4 2.8 -20.0 459 461 A E T 3 S+ 0 0 101 1,-0.2 3,-0.2 2,-0.1 4,-0.2 0.862 119.4 30.1 -66.1 -40.9 22.6 -0.2 -21.1 460 462 A N T 3> S+ 0 0 53 1,-0.2 4,-1.8 -3,-0.1 -1,-0.2 -0.023 80.3 120.2-111.7 37.6 23.7 -1.3 -17.6 461 463 A E H <> S+ 0 0 8 -3,-0.9 4,-2.6 2,-0.2 5,-0.4 0.922 77.3 49.9 -58.9 -47.0 20.6 -0.2 -15.7 462 464 A T H > S+ 0 0 58 -4,-0.3 4,-2.3 1,-0.2 5,-0.3 0.916 110.8 47.2 -62.3 -47.2 20.0 -3.7 -14.5 463 465 A A H > S+ 0 0 52 3,-0.2 4,-1.9 2,-0.2 5,-0.3 0.836 113.6 53.2 -61.8 -30.7 23.5 -4.3 -13.3 464 466 A Y H X S+ 0 0 8 -4,-1.8 4,-2.0 2,-0.2 5,-0.3 0.986 117.0 31.0 -71.0 -61.4 23.3 -0.9 -11.6 465 467 A F H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.868 122.3 53.4 -64.0 -36.1 20.1 -1.3 -9.6 466 468 A G H X S+ 0 0 22 -4,-2.3 4,-2.1 -5,-0.4 -2,-0.2 0.898 110.1 44.2 -68.5 -42.0 20.8 -5.1 -9.2 467 469 A T H X S+ 0 0 103 -4,-1.9 4,-2.2 -5,-0.3 -2,-0.2 0.944 119.0 41.8 -70.2 -45.6 24.3 -4.8 -7.8 468 470 A I H X S+ 0 0 23 -4,-2.0 4,-1.8 -5,-0.3 -2,-0.2 0.922 118.5 45.7 -66.7 -45.9 23.5 -2.0 -5.4 469 471 A G H X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.880 113.6 50.3 -63.1 -38.8 20.2 -3.5 -4.3 470 472 A G H X S+ 0 0 26 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.873 107.7 53.3 -67.8 -38.2 21.9 -6.9 -4.0 471 473 A A H X S+ 0 0 34 -4,-2.2 4,-2.8 2,-0.2 -1,-0.2 0.897 109.5 48.9 -60.3 -43.1 24.7 -5.5 -1.9 472 474 A A H X S+ 0 0 0 -4,-1.8 4,-3.0 2,-0.2 -2,-0.2 0.930 110.9 49.2 -67.7 -44.6 22.1 -4.0 0.5 473 475 A L H X S+ 0 0 53 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.889 113.3 48.0 -58.4 -41.8 20.2 -7.3 0.8 474 476 A V H X S+ 0 0 82 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.950 114.0 45.2 -66.2 -48.1 23.5 -9.1 1.5 475 477 A L H X S+ 0 0 50 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.893 110.6 54.8 -61.8 -41.0 24.6 -6.6 4.1 476 478 A G H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.855 108.4 48.8 -60.5 -36.7 21.1 -6.6 5.6 477 479 A L H X S+ 0 0 106 -4,-1.7 4,-1.7 2,-0.2 -1,-0.2 0.896 111.5 48.3 -70.0 -42.4 21.3 -10.4 6.0 478 480 A I H X S+ 0 0 97 -4,-2.1 4,-1.7 2,-0.2 5,-0.2 0.924 112.0 50.0 -64.1 -42.4 24.7 -10.3 7.6 479 481 A L H X S+ 0 0 6 -4,-2.7 4,-1.5 1,-0.2 -2,-0.2 0.906 107.0 54.3 -63.7 -42.3 23.6 -7.5 10.0 480 482 A L H < S+ 0 0 62 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.899 108.8 51.2 -53.6 -41.8 20.5 -9.6 10.9 481 483 A A H < S+ 0 0 75 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.851 117.6 34.9 -67.8 -38.0 22.8 -12.4 11.8 482 484 A I H X S+ 0 0 71 -4,-1.7 4,-1.7 1,-0.2 3,-0.2 0.466 93.2 94.7 -97.8 -3.9 25.2 -10.4 14.1 483 485 A A H X S+ 0 0 0 -4,-1.5 4,-2.7 -5,-0.2 5,-0.2 0.831 72.9 65.4 -54.4 -38.5 22.4 -8.2 15.4 484 486 A P H > S+ 0 0 63 0, 0.0 4,-2.0 0, 0.0 -1,-0.2 0.953 107.8 38.0 -53.8 -53.2 21.8 -10.4 18.5 485 487 A R H > S+ 0 0 165 -3,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.881 113.8 55.1 -66.9 -38.5 25.2 -9.7 20.1 486 488 A I H < S+ 0 0 11 -4,-1.7 4,-0.5 1,-0.2 -1,-0.2 0.931 109.4 49.9 -58.9 -43.4 25.2 -6.0 19.0 487 489 A G H >< S+ 0 0 20 -4,-2.7 3,-1.6 1,-0.2 -2,-0.2 0.927 109.0 48.3 -58.8 -52.0 21.9 -5.6 20.8 488 490 A R H 3< S+ 0 0 187 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.845 109.1 57.2 -59.0 -33.0 23.0 -7.2 24.1 489 491 A L T 3< S+ 0 0 50 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.599 81.4 115.6 -73.2 -13.5 26.1 -5.0 23.9 490 492 A M < - 0 0 30 -3,-1.6 -65,-0.1 -4,-0.5 -69,-0.0 -0.379 64.4-137.0 -68.3 136.2 24.0 -1.7 23.8 491 493 A K 0 0 60 -67,-0.9 -1,-0.1 1,-0.2 -66,-0.1 0.944 360.0 360.0 -57.8 -62.0 24.4 0.6 26.7 492 494 A G 0 0 90 0, 0.0 -1,-0.2 0, 0.0 -2,-0.0 -0.527 360.0 360.0 97.3 360.0 20.8 1.7 27.4