==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-MAR-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 19-JAN-10 3LG5 . COMPND 2 MOLECULE: EPI-ISOZIZAENE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES COELICOLOR; . AUTHOR J.A.AARON,X.LIN,D.E.CANE,D.W.CHRISTIANSON . 340 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14350.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 270 79.4 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 . 0 0.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 9 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 209 61.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.4 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 1 1 3 0 0 1 0 2 0 1 1 0 1 0 0 0 0 0 0 0 0 0 1 1 1 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 . 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 16 A A 0 0 155 0, 0.0 6,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.8 19.2 4.6 0.8 2 17 A V - 0 0 16 1,-0.1 5,-0.2 2,-0.1 314,-0.0 -0.619 360.0 -99.7 -78.2 133.3 17.7 1.8 2.7 3 18 A P >> - 0 0 59 0, 0.0 3,-2.1 0, 0.0 4,-1.3 -0.178 32.4-120.3 -49.3 138.2 20.2 -0.9 3.7 4 19 A P T 34 S+ 0 0 119 0, 0.0 3,-0.4 0, 0.0 -2,-0.1 0.845 110.8 57.9 -51.3 -36.6 20.0 -3.8 1.3 5 20 A S T 34 S+ 0 0 59 1,-0.2 257,-0.1 3,-0.0 -3,-0.0 0.667 117.4 34.2 -68.9 -14.9 19.1 -6.3 4.1 6 21 A L T <4 S+ 0 0 27 -3,-2.1 -1,-0.2 222,-0.0 2,-0.1 0.468 89.1 116.6-115.8 -11.4 16.0 -4.2 5.0 7 22 A R < - 0 0 126 -4,-1.3 308,-0.0 -3,-0.4 0, 0.0 -0.413 40.2-170.4 -72.2 137.1 15.0 -2.8 1.6 8 23 A L >> - 0 0 2 1,-0.1 4,-2.1 -2,-0.1 3,-0.6 -0.871 4.7-169.5-126.4 92.7 11.5 -3.8 0.3 9 24 A P H 3> S+ 0 0 72 0, 0.0 4,-2.4 0, 0.0 5,-0.3 0.842 85.2 60.5 -57.0 -30.4 11.2 -2.6 -3.3 10 25 A V H 3> S+ 0 0 63 2,-0.2 4,-2.7 1,-0.2 5,-0.3 0.886 106.7 45.9 -62.9 -42.7 7.4 -3.4 -3.3 11 26 A I H <> S+ 0 0 0 -3,-0.6 4,-1.7 1,-0.2 -1,-0.2 0.955 113.3 49.8 -62.4 -44.3 6.8 -1.0 -0.5 12 27 A E H < S+ 0 0 57 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.871 123.2 30.0 -66.1 -34.6 8.9 1.7 -2.2 13 28 A A H < S+ 0 0 87 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.869 130.5 29.1 -88.6 -42.4 7.2 1.3 -5.5 14 29 A A H < S+ 0 0 46 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.380 111.8 58.8-112.0 -0.8 3.6 0.3 -4.7 15 30 A F S < S- 0 0 3 -4,-1.7 -1,-0.2 -5,-0.3 -4,-0.0 -0.574 74.1-163.2-127.6 71.0 2.9 1.8 -1.3 16 31 A P - 0 0 93 0, 0.0 296,-0.1 0, 0.0 -3,-0.1 -0.278 25.6-107.9 -58.9 136.8 3.4 5.5 -1.8 17 32 A R - 0 0 106 -5,-0.1 2,-0.3 295,-0.1 292,-0.1 -0.298 32.3-163.5 -64.6 144.3 3.8 7.5 1.5 18 33 A Q - 0 0 105 42,-0.3 2,-0.4 291,-0.2 45,-0.0 -0.941 2.6-159.8-123.9 153.3 1.0 9.8 2.8 19 34 A L - 0 0 99 -2,-0.3 41,-0.2 41,-0.0 40,-0.1 -0.988 20.5-124.6-135.7 126.3 1.2 12.5 5.4 20 35 A H > - 0 0 7 39,-2.1 3,-1.8 -2,-0.4 43,-0.1 -0.378 22.6-127.0 -66.6 138.3 -1.7 13.9 7.4 21 36 A P T 3 S+ 0 0 116 0, 0.0 4,-0.3 0, 0.0 -1,-0.1 0.708 105.8 63.4 -62.5 -18.4 -1.9 17.7 7.1 22 37 A Y T >> S+ 0 0 41 1,-0.2 4,-2.8 2,-0.1 3,-0.6 0.556 73.8 104.1 -79.9 -3.2 -2.0 18.2 10.8 23 38 A W H <> S+ 0 0 47 -3,-1.8 4,-2.8 1,-0.2 5,-0.2 0.844 73.3 52.6 -53.2 -45.2 1.6 16.7 11.2 24 39 A P H 3> S+ 0 0 80 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.940 115.8 40.9 -60.1 -41.4 3.5 19.9 11.7 25 40 A K H <> S+ 0 0 127 -3,-0.6 4,-2.9 -4,-0.3 5,-0.2 0.935 113.5 55.9 -66.3 -44.8 1.2 21.0 14.6 26 41 A L H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.2 5,-0.3 0.882 102.3 55.6 -51.9 -48.9 1.2 17.4 15.8 27 42 A Q H X S+ 0 0 44 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.931 114.5 38.5 -53.2 -49.5 5.0 17.2 16.1 28 43 A E H X S+ 0 0 109 -4,-1.4 4,-2.5 -5,-0.2 -2,-0.2 0.898 113.9 53.8 -73.7 -37.7 5.2 20.3 18.3 29 44 A T H X S+ 0 0 39 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.907 111.2 45.5 -64.6 -39.6 2.0 19.5 20.4 30 45 A T H X S+ 0 0 3 -4,-2.8 4,-2.9 -5,-0.2 5,-0.2 0.917 111.3 53.2 -71.9 -38.5 3.2 16.0 21.3 31 46 A R H X S+ 0 0 41 -4,-1.7 4,-2.0 -5,-0.3 -2,-0.2 0.942 110.7 46.9 -54.3 -47.9 6.7 17.3 22.1 32 47 A T H X S+ 0 0 49 -4,-2.5 4,-3.2 1,-0.2 -1,-0.2 0.876 111.7 52.2 -62.4 -37.4 5.1 19.9 24.4 33 48 A W H X S+ 0 0 21 -4,-2.0 4,-2.8 2,-0.2 6,-0.2 0.926 105.8 52.3 -70.2 -42.0 2.9 17.1 26.0 34 49 A L H <>S+ 0 0 7 -4,-2.9 5,-2.3 1,-0.2 6,-0.7 0.932 114.8 45.5 -57.1 -43.1 5.9 14.9 26.7 35 50 A L H ><5S+ 0 0 67 -4,-2.0 3,-1.6 -5,-0.2 -2,-0.2 0.962 113.0 46.6 -62.8 -54.6 7.4 17.9 28.4 36 51 A E H 3<5S+ 0 0 152 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.834 115.5 46.3 -61.0 -33.9 4.4 18.9 30.4 37 52 A K T 3<5S- 0 0 56 -4,-2.8 -1,-0.3 -5,-0.2 89,-0.2 0.383 106.8-128.8 -85.4 -0.4 3.7 15.3 31.5 38 53 A R T < 5 + 0 0 175 -3,-1.6 -3,-0.2 -4,-0.2 84,-0.1 0.851 60.3 144.3 54.6 42.8 7.4 14.9 32.4 39 54 A L S - 0 0 50 0, 0.0 4,-2.5 0, 0.0 3,-0.4 -0.258 39.9-115.7 -54.4 145.4 13.7 14.9 30.9 42 57 A A H > S+ 0 0 70 1,-0.2 4,-2.5 2,-0.2 5,-0.1 0.858 114.6 51.1 -56.5 -38.0 13.7 18.4 29.2 43 58 A D H > S+ 0 0 107 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.836 111.3 47.2 -71.1 -32.2 17.2 18.0 27.8 44 59 A K H >>S+ 0 0 46 -3,-0.4 4,-2.7 2,-0.2 5,-0.8 0.853 111.0 52.2 -75.4 -35.4 16.4 14.6 26.2 45 60 A V H X>S+ 0 0 1 -4,-2.5 4,-1.3 3,-0.2 5,-0.5 0.952 112.8 46.2 -59.5 -46.6 13.1 16.0 24.8 46 61 A E H <5S+ 0 0 153 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.926 120.9 35.8 -62.6 -44.7 15.2 18.8 23.3 47 62 A E H <5S+ 0 0 131 -4,-2.0 -1,-0.2 -5,-0.1 -2,-0.2 0.871 134.3 13.8 -78.8 -36.3 17.9 16.7 21.8 48 63 A Y H X5S+ 0 0 59 -4,-2.7 4,-1.3 -5,-0.1 274,-0.2 0.695 95.0 86.5-119.8 -25.9 16.0 13.5 20.8 49 64 A A H >X4 S+ 0 0 14 -5,-0.5 4,-1.4 1,-0.2 5,-0.1 0.892 74.1 45.6 -66.2 -37.8 6.9 9.1 16.8 55 70 A T H > S+ 0 0 10 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.895 109.1 56.6 -70.6 -33.6 4.4 11.7 15.5 56 71 A D H > S+ 0 0 31 1,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.912 103.7 55.3 -63.3 -39.1 5.5 11.1 11.9 57 72 A L H < S+ 0 0 12 -4,-2.0 3,-0.3 1,-0.2 -1,-0.2 0.929 112.8 39.5 -61.9 -44.9 4.7 7.4 12.3 58 73 A M H >X S+ 0 0 2 -4,-1.4 4,-2.1 1,-0.2 3,-1.4 0.868 111.8 56.5 -76.2 -32.6 1.1 8.0 13.3 59 74 A A H 3< S+ 0 0 0 -4,-2.7 -39,-2.1 1,-0.3 -1,-0.2 0.694 105.5 52.9 -71.8 -15.8 0.6 10.9 10.9 60 75 A G T 3< S+ 0 0 5 -4,-1.4 253,-0.3 -3,-0.3 -42,-0.3 0.419 117.1 40.4 -88.7 0.4 1.6 8.5 8.0 61 76 A Y T <4 S+ 0 0 0 -3,-1.4 2,-1.9 -5,-0.1 248,-0.2 0.817 105.4 50.6-114.6 -60.5 -1.0 6.0 9.2 62 77 A Y S >< S+ 0 0 0 -4,-2.1 3,-1.7 247,-0.1 -1,-0.1 -0.398 71.1 176.8 -90.0 62.3 -4.3 7.5 10.4 63 78 A L T 3 + 0 0 23 -2,-1.9 243,-0.1 1,-0.2 -3,-0.1 -0.358 66.1 27.6 -62.7 146.0 -5.0 9.6 7.4 64 79 A G T 3 S+ 0 0 67 1,-0.3 -1,-0.2 242,-0.0 3,-0.1 0.325 85.8 142.4 87.9 -14.2 -8.4 11.4 7.5 65 80 A A < - 0 0 3 -3,-1.7 -1,-0.3 1,-0.1 130,-0.1 -0.343 61.0-105.2 -60.1 139.4 -8.4 11.5 11.3 66 81 A P >> - 0 0 67 0, 0.0 4,-2.8 0, 0.0 3,-0.6 -0.390 34.1-114.1 -55.4 150.4 -9.8 14.6 12.9 67 82 A D H 3> S+ 0 0 81 1,-0.3 4,-2.6 2,-0.2 5,-0.1 0.870 116.7 52.2 -59.1 -41.9 -7.0 16.6 14.3 68 83 A E H 3> S+ 0 0 147 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.847 111.1 47.5 -62.1 -35.7 -8.1 16.1 17.9 69 84 A V H <> S+ 0 0 7 -3,-0.6 4,-2.7 2,-0.2 5,-0.2 0.933 111.2 50.1 -72.3 -48.8 -8.2 12.3 17.4 70 85 A L H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.2 5,-0.2 0.912 109.4 53.1 -55.4 -42.4 -4.8 12.3 15.8 71 86 A Q H X S+ 0 0 10 -4,-2.6 4,-2.4 -5,-0.3 5,-0.2 0.931 110.0 45.7 -58.9 -45.7 -3.4 14.3 18.7 72 87 A A H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.916 114.5 49.8 -65.2 -40.7 -4.8 11.9 21.3 73 88 A I H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.942 111.8 47.2 -62.4 -43.4 -3.5 8.9 19.2 74 89 A A H X S+ 0 0 1 -4,-3.0 4,-2.7 2,-0.2 -1,-0.2 0.878 112.1 48.9 -71.1 -34.8 -0.0 10.5 18.9 75 90 A D H X S+ 0 0 2 -4,-2.4 4,-2.6 -5,-0.2 -1,-0.2 0.952 113.4 47.6 -68.3 -46.0 0.3 11.3 22.6 76 91 A Y H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 -2,-0.2 0.887 112.3 51.5 -56.3 -41.5 -0.8 7.8 23.4 77 92 A S H X S+ 0 0 1 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.933 109.8 47.0 -65.7 -41.5 1.7 6.4 20.9 78 93 A A H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.914 111.9 52.5 -66.0 -38.8 4.6 8.4 22.3 79 94 A W H X S+ 0 0 0 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.907 105.6 55.1 -56.5 -44.9 3.5 7.2 25.7 80 95 A F H X S+ 0 0 19 -4,-2.3 4,-2.5 1,-0.2 -1,-0.2 0.879 107.6 48.4 -62.3 -41.3 3.6 3.6 24.4 81 96 A F H X S+ 0 0 33 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.922 111.9 49.1 -62.2 -45.4 7.3 4.0 23.3 82 97 A V H X S+ 0 0 18 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.845 110.0 52.7 -65.2 -31.2 8.2 5.5 26.7 83 98 A W H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.913 105.9 52.1 -68.2 -42.8 6.5 2.6 28.3 84 99 A D H X S+ 0 0 33 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.915 111.9 48.3 -55.6 -38.5 8.4 0.1 26.2 85 100 A D H X S+ 0 0 16 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.915 110.7 49.6 -70.4 -42.0 11.6 2.0 27.5 86 101 A R H X S+ 0 0 67 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.929 111.8 48.8 -60.0 -47.8 10.4 1.9 31.1 87 102 A H H X S+ 0 0 1 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.912 111.5 49.8 -55.3 -48.9 9.7 -1.9 30.9 88 103 A D H X S+ 0 0 23 -4,-2.2 4,-2.6 -5,-0.2 -1,-0.2 0.918 112.4 46.7 -59.3 -46.8 13.1 -2.4 29.3 89 104 A R H X S+ 0 0 8 -4,-2.5 4,-2.6 1,-0.2 6,-0.2 0.885 109.7 53.7 -66.4 -39.4 14.8 -0.4 32.1 90 105 A D H <>S+ 0 0 2 -4,-3.0 5,-2.5 2,-0.2 4,-0.3 0.864 112.4 45.3 -62.5 -36.6 12.9 -2.2 34.9 91 106 A I H ><5S+ 0 0 18 -4,-1.9 3,-1.4 -5,-0.2 -2,-0.2 0.958 113.2 48.2 -69.9 -48.8 14.0 -5.5 33.4 92 107 A V H 3<5S+ 0 0 70 -4,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.875 117.3 42.9 -62.0 -36.5 17.7 -4.5 33.0 93 108 A H T 3<5S- 0 0 83 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.386 110.3-120.1 -92.7 5.0 17.8 -3.1 36.6 94 109 A G T < 5 + 0 0 59 -3,-1.4 2,-1.7 -4,-0.3 3,-0.3 0.790 55.3 156.9 66.0 31.2 15.9 -6.0 38.1 95 110 A R >< + 0 0 89 -5,-2.5 4,-2.3 -6,-0.2 5,-0.2 -0.459 2.1 155.5 -89.5 66.0 13.1 -3.8 39.4 96 111 A A H > S+ 0 0 55 -2,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.859 72.3 48.3 -62.3 -37.5 10.5 -6.6 39.6 97 112 A G H > S+ 0 0 23 -3,-0.3 4,-2.6 2,-0.2 5,-0.2 0.915 110.0 50.5 -71.9 -41.5 8.4 -4.8 42.3 98 113 A A H > S+ 0 0 36 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.908 114.0 46.9 -61.7 -39.6 8.4 -1.4 40.5 99 114 A W H X S+ 0 0 2 -4,-2.3 4,-3.0 2,-0.2 5,-0.2 0.928 111.0 50.6 -68.1 -44.4 7.2 -3.3 37.3 100 115 A R H X S+ 0 0 139 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.925 112.1 47.3 -60.9 -40.3 4.6 -5.3 39.2 101 116 A R H X S+ 0 0 140 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.911 113.0 48.6 -69.1 -39.8 3.2 -2.1 40.8 102 117 A L H X S+ 0 0 3 -4,-2.2 4,-2.9 -5,-0.2 5,-0.2 0.934 108.6 54.0 -61.6 -45.8 3.2 -0.3 37.4 103 118 A R H X S+ 0 0 61 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.924 111.3 45.8 -53.0 -46.6 1.4 -3.3 35.7 104 119 A G H X S+ 0 0 33 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.909 111.6 50.6 -68.2 -40.5 -1.3 -3.1 38.3 105 120 A L H X S+ 0 0 50 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.869 108.7 52.5 -64.5 -38.3 -1.7 0.7 38.1 106 121 A L H X S+ 0 0 0 -4,-2.9 4,-2.0 2,-0.2 -2,-0.2 0.929 108.6 50.1 -67.6 -43.1 -2.0 0.6 34.3 107 122 A H H X S+ 0 0 39 -4,-2.1 4,-1.1 -5,-0.2 -2,-0.2 0.940 116.0 43.1 -55.0 -46.6 -4.8 -2.1 34.6 108 123 A T H X S+ 0 0 73 -4,-2.1 4,-1.6 1,-0.2 3,-0.3 0.936 115.0 47.6 -65.7 -43.4 -6.6 0.1 37.1 109 124 A A H < S+ 0 0 0 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.805 103.2 63.1 -64.7 -32.7 -6.1 3.4 35.2 110 125 A L H < S+ 0 0 0 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.904 110.7 39.1 -66.7 -34.0 -7.2 1.9 31.9 111 126 A D H < S+ 0 0 104 -4,-1.1 -1,-0.2 -3,-0.3 -2,-0.2 0.787 133.3 22.6 -82.6 -29.1 -10.6 1.3 33.5 112 127 A S S >< S+ 0 0 34 -4,-1.6 3,-0.6 1,-0.1 4,-0.3 -0.598 70.3 161.6-135.2 71.0 -10.8 4.6 35.4 113 128 A P G > + 0 0 9 0, 0.0 3,-2.4 0, 0.0 4,-0.3 0.897 69.0 61.1 -69.8 -36.9 -8.5 7.0 33.7 114 129 A G G > S+ 0 0 39 1,-0.3 3,-1.0 2,-0.2 4,-0.1 0.816 98.3 61.3 -58.9 -29.9 -9.8 10.3 35.1 115 130 A D G < S+ 0 0 137 -3,-0.6 -1,-0.3 1,-0.2 3,-0.1 0.568 107.2 44.9 -65.9 -13.5 -9.0 9.1 38.6 116 131 A H G X S+ 0 0 23 -3,-2.4 3,-1.9 -4,-0.3 12,-0.3 0.245 72.4 113.3-119.1 10.9 -5.3 8.9 37.7 117 132 A L T < S+ 0 0 38 -3,-1.0 -1,-0.1 1,-0.3 -2,-0.1 0.710 90.5 33.4 -59.3 -20.3 -4.7 12.2 35.8 118 133 A H T 3 S+ 0 0 173 -4,-0.1 -1,-0.3 -3,-0.1 7,-0.1 -0.023 84.8 153.0-129.6 32.4 -2.4 13.4 38.7 119 134 A H < - 0 0 45 -3,-1.9 6,-0.2 2,-0.1 -3,-0.1 -0.258 53.5-120.8 -63.2 145.8 -0.8 10.2 39.7 120 135 A E S S+ 0 0 178 4,-0.1 2,-0.8 2,-0.1 -1,-0.1 0.776 101.1 73.4 -60.0 -29.6 2.6 10.4 41.3 121 136 A D S >> S- 0 0 33 1,-0.2 4,-2.3 2,-0.0 3,-0.8 -0.811 76.1-154.7 -88.4 115.2 4.1 8.2 38.6 122 137 A T H 3> S+ 0 0 29 -2,-0.8 4,-2.6 1,-0.3 5,-0.2 0.802 92.2 60.5 -65.3 -25.7 4.2 10.5 35.6 123 138 A L H 3> S+ 0 0 2 2,-0.2 4,-1.9 1,-0.2 -1,-0.3 0.895 108.1 43.7 -67.8 -34.9 4.1 7.5 33.3 124 139 A V H <> S+ 0 0 0 -3,-0.8 4,-2.8 2,-0.2 -2,-0.2 0.915 113.9 50.5 -73.7 -40.5 0.7 6.5 34.8 125 140 A A H X S+ 0 0 10 -4,-2.3 4,-1.8 -6,-0.2 -2,-0.2 0.896 110.8 49.2 -65.3 -35.3 -0.5 10.0 34.7 126 141 A G H X S+ 0 0 0 -4,-2.6 4,-2.1 2,-0.2 5,-0.2 0.916 111.2 49.8 -69.7 -41.3 0.5 10.4 31.1 127 142 A F H X S+ 0 0 0 -4,-1.9 4,-2.8 -5,-0.2 5,-0.3 0.953 110.5 50.5 -59.7 -47.5 -1.3 7.1 30.2 128 143 A A H X S+ 0 0 0 -4,-2.8 4,-2.6 -12,-0.3 -1,-0.2 0.873 108.9 51.1 -60.8 -41.2 -4.4 8.3 32.0 129 144 A D H X S+ 0 0 23 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.919 113.7 43.2 -61.9 -47.5 -4.5 11.6 30.2 130 145 A S H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.916 116.0 47.9 -68.9 -39.4 -4.2 10.0 26.7 131 146 A V H X S+ 0 0 0 -4,-2.8 4,-2.0 -5,-0.2 -2,-0.2 0.915 107.8 54.1 -69.0 -39.0 -6.7 7.3 27.5 132 147 A R H < S+ 0 0 109 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.934 111.7 46.8 -60.5 -37.1 -9.3 9.6 29.0 133 148 A R H >< S+ 0 0 49 -4,-1.8 3,-1.6 1,-0.2 -2,-0.2 0.918 109.8 52.3 -71.8 -37.6 -9.1 11.7 25.7 134 149 A L H >< S+ 0 0 0 -4,-2.4 3,-1.0 1,-0.3 4,-0.4 0.827 104.9 58.0 -64.0 -31.8 -9.3 8.5 23.5 135 150 A Y T 3< S+ 0 0 35 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.433 94.0 68.5 -78.7 2.5 -12.5 7.5 25.5 136 151 A A T < S+ 0 0 69 -3,-1.6 -1,-0.2 -4,-0.1 -2,-0.1 0.331 88.7 62.7-102.9 8.1 -14.3 10.7 24.5 137 152 A F S < S+ 0 0 56 -3,-1.0 -2,-0.1 2,-0.1 -1,-0.1 0.813 104.5 22.1-101.6 -37.5 -14.7 10.1 20.8 138 153 A L S S- 0 0 28 -4,-0.4 5,-0.1 1,-0.2 -1,-0.1 -0.737 93.9 -65.9-129.5 172.8 -16.9 7.0 20.5 139 154 A P >> - 0 0 72 0, 0.0 4,-1.8 0, 0.0 3,-1.3 -0.086 49.7-103.6 -64.5 164.2 -19.5 5.1 22.6 140 155 A A H 3> S+ 0 0 76 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.785 118.5 66.9 -56.5 -26.0 -18.6 3.3 25.8 141 156 A T H 3> S+ 0 0 91 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.872 102.9 45.3 -64.6 -37.2 -18.8 -0.0 23.8 142 157 A W H <> S+ 0 0 0 -3,-1.3 4,-2.7 2,-0.2 3,-0.3 0.926 111.7 53.2 -71.5 -44.6 -15.7 1.0 21.8 143 158 A N H X S+ 0 0 27 -4,-1.8 4,-2.5 1,-0.2 -2,-0.2 0.886 108.1 49.9 -52.9 -41.7 -14.0 2.2 25.1 144 159 A A H X S+ 0 0 61 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.827 109.9 50.8 -70.7 -31.3 -14.6 -1.2 26.7 145 160 A R H X S+ 0 0 9 -4,-1.2 4,-2.8 -3,-0.3 -2,-0.2 0.939 110.1 49.3 -70.6 -41.7 -13.2 -3.0 23.6 146 161 A F H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.932 113.7 47.6 -59.4 -45.2 -10.0 -0.8 23.7 147 162 A A H X S+ 0 0 7 -4,-2.5 4,-2.6 -5,-0.2 5,-0.2 0.929 109.6 51.2 -64.4 -46.4 -9.8 -1.6 27.4 148 163 A R H X S+ 0 0 136 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.941 113.4 47.4 -54.4 -46.3 -10.3 -5.3 26.9 149 164 A H H X S+ 0 0 29 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.874 112.5 47.0 -63.5 -42.3 -7.5 -5.2 24.3 150 165 A F H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.837 103.4 60.6 -78.7 -27.5 -5.1 -3.3 26.3 151 166 A H H X S+ 0 0 42 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.935 107.8 48.3 -54.2 -41.5 -5.5 -5.4 29.5 152 167 A T H X S+ 0 0 63 -4,-1.4 4,-1.8 -5,-0.2 -2,-0.2 0.883 109.3 53.0 -68.0 -38.5 -4.3 -8.2 27.3 153 168 A V H X S+ 0 0 4 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.929 106.1 51.5 -61.3 -44.8 -1.4 -6.1 26.1 154 169 A I H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.920 109.9 50.5 -59.7 -41.2 -0.2 -5.3 29.7 155 170 A E H X S+ 0 0 56 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.855 106.1 54.9 -68.2 -31.6 -0.2 -9.0 30.5 156 171 A A H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.889 106.9 50.6 -67.3 -39.0 1.9 -9.7 27.4 157 172 A Y H X S+ 0 0 6 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.894 108.2 53.8 -60.1 -38.3 4.4 -7.2 28.7 158 173 A D H X S+ 0 0 10 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.929 107.2 50.2 -62.3 -39.8 4.3 -9.0 32.0 159 174 A R H X S+ 0 0 106 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.900 109.2 51.7 -65.7 -38.8 5.1 -12.3 30.2 160 175 A E H X S+ 0 0 7 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.869 104.9 56.0 -62.1 -37.7 8.0 -10.6 28.5 161 176 A F H X S+ 0 0 5 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.950 111.5 44.6 -61.0 -45.6 9.4 -9.3 31.8 162 177 A H H X S+ 0 0 49 -4,-2.1 4,-2.7 1,-0.2 6,-0.3 0.906 111.3 51.5 -68.4 -37.0 9.4 -12.9 33.1 163 178 A N H X>S+ 0 0 20 -4,-2.5 5,-1.8 1,-0.2 4,-0.6 0.939 114.2 44.2 -63.6 -44.5 10.9 -14.4 29.9 164 179 A R H <5S+ 0 0 26 -4,-2.4 3,-0.4 2,-0.2 -1,-0.2 0.889 114.5 47.5 -71.5 -35.3 13.7 -11.9 30.0 165 180 A T H <5S+ 0 0 84 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.910 117.7 43.2 -70.4 -38.6 14.4 -12.2 33.7 166 181 A R H <5S- 0 0 169 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.442 111.3-121.3 -82.8 -1.5 14.4 -16.0 33.4 167 182 A G T <5 + 0 0 57 -4,-0.6 2,-0.3 -3,-0.4 -3,-0.2 0.632 59.5 151.5 68.4 15.5 16.5 -15.9 30.2 168 183 A I < - 0 0 79 -5,-1.8 -1,-0.2 -6,-0.3 -2,-0.1 -0.621 34.8-156.6 -82.8 132.3 13.8 -17.8 28.2 169 184 A V - 0 0 23 -2,-0.3 71,-0.1 76,-0.1 6,-0.1 -0.956 26.8-122.5-102.4 122.1 13.5 -17.2 24.5 170 185 A P - 0 0 0 0, 0.0 79,-0.1 0, 0.0 78,-0.1 -0.235 24.9-108.2 -62.6 155.1 10.0 -18.0 23.3 171 186 A G > - 0 0 22 1,-0.1 4,-3.7 77,-0.1 5,-0.2 -0.252 38.3 -98.0 -70.4 168.4 9.5 -20.6 20.6 172 187 A V H > S+ 0 0 16 73,-0.3 4,-2.9 1,-0.2 5,-0.2 0.938 122.0 37.1 -61.1 -53.6 8.4 -19.5 17.1 173 188 A E H > S+ 0 0 132 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.917 118.4 51.6 -64.2 -42.5 4.7 -20.1 17.4 174 189 A E H > S+ 0 0 96 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.947 113.5 46.5 -57.5 -48.2 4.7 -19.0 21.1 175 190 A Y H X S+ 0 0 0 -4,-3.7 4,-3.0 1,-0.2 -2,-0.2 0.924 109.2 52.7 -58.2 -49.8 6.5 -15.8 20.0 176 191 A L H X S+ 0 0 7 -4,-2.9 4,-1.0 -5,-0.2 -1,-0.2 0.874 111.9 46.8 -58.9 -37.2 4.2 -15.1 17.0 177 192 A E H < S+ 0 0 133 -4,-2.2 3,-0.4 2,-0.2 4,-0.3 0.927 114.2 46.4 -65.5 -48.2 1.2 -15.3 19.3 178 193 A L H >X S+ 0 0 9 -4,-2.3 4,-2.3 1,-0.2 3,-1.7 0.854 105.2 61.7 -63.7 -37.1 2.7 -13.1 21.9 179 194 A R H 3X S+ 0 0 28 -4,-3.0 4,-2.2 1,-0.3 6,-0.3 0.796 91.9 64.0 -68.1 -26.7 3.9 -10.5 19.3 180 195 A R H 3<>S+ 0 0 67 -4,-1.0 5,-1.2 -3,-0.4 6,-0.5 0.729 113.5 37.3 -60.6 -21.8 0.3 -9.8 18.3 181 196 A L H X45S+ 0 0 29 -3,-1.7 3,-0.7 -4,-0.3 -2,-0.2 0.834 115.1 49.0-100.1 -44.2 -0.1 -8.5 21.9 182 197 A T H 3<5S+ 0 0 3 -4,-2.3 -3,-0.2 1,-0.3 -2,-0.2 0.843 115.2 46.0 -70.8 -28.5 3.2 -6.8 22.5 183 198 A A T 3<5S- 0 0 21 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.1 0.528 110.3-130.8 -82.5 -8.6 3.0 -4.9 19.2 184 199 A A T X>5 + 0 0 1 -3,-0.7 4,-2.1 -5,-0.2 3,-0.8 0.834 39.4 172.5 60.3 43.3 -0.6 -4.1 20.2 185 200 A H H 3> S+ 0 0 70 -6,-0.5 4,-2.6 2,-0.2 -1,-0.2 0.760 107.1 56.5 -83.4 -23.4 -5.7 -4.9 18.1 187 202 A I H <> S+ 0 0 0 -3,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.950 110.7 43.8 -66.1 -50.9 -5.2 -1.5 19.7 188 203 A W H < S+ 0 0 20 -4,-2.1 4,-0.5 2,-0.2 -2,-0.2 0.908 114.9 50.7 -63.2 -33.3 -4.0 0.0 16.4 189 204 A T H >< S+ 0 0 13 -4,-1.8 3,-1.4 -5,-0.3 4,-0.5 0.945 109.3 50.5 -68.8 -41.9 -6.9 -1.8 14.7 190 205 A D H >< S+ 0 0 2 -4,-2.6 3,-1.6 1,-0.3 -1,-0.2 0.894 104.1 59.8 -58.9 -40.0 -9.4 -0.4 17.2 191 206 A L T 3X S+ 0 0 0 -4,-2.3 4,-1.2 1,-0.3 -1,-0.3 0.574 85.9 75.4 -71.5 -11.3 -8.0 3.2 16.7 192 207 A L H <> S+ 0 0 0 -3,-1.4 4,-1.1 -4,-0.5 -1,-0.3 0.852 91.8 60.2 -60.5 -29.4 -8.9 3.0 13.0 193 208 A E H X>>S+ 0 0 0 -3,-1.6 5,-2.2 -4,-0.5 3,-0.7 0.927 103.9 41.0 -76.0 -49.5 -12.5 3.6 14.1 194 209 A P H >45S+ 0 0 4 0, 0.0 3,-0.7 0, 0.0 -1,-0.2 0.862 111.1 63.8 -64.7 -25.9 -12.3 7.0 15.9 195 210 A S H 3<5S+ 0 0 1 -4,-1.2 -2,-0.2 1,-0.2 -3,-0.1 0.823 111.5 33.0 -64.2 -31.0 -10.0 8.0 13.1 196 211 A S H <<5S- 0 0 36 -4,-1.1 -1,-0.2 -3,-0.7 -3,-0.1 0.318 116.5-112.3-106.5 9.3 -12.8 7.6 10.5 197 212 A G T <<5S+ 0 0 49 -3,-0.7 2,-0.3 -4,-0.6 -4,-0.1 0.686 80.1 96.8 77.5 26.5 -15.6 8.6 13.0 198 213 A C < - 0 0 7 -5,-2.2 2,-0.7 -6,-0.1 -2,-0.2 -0.929 63.3-140.7-155.4 121.0 -17.5 5.4 13.4 199 214 A E - 0 0 45 -2,-0.3 100,-0.0 -5,-0.1 -9,-0.0 -0.717 37.8-137.1 -75.0 116.2 -17.6 2.5 15.8 200 215 A L - 0 0 1 -2,-0.7 -7,-0.0 1,-0.1 -1,-0.0 -0.584 15.4-113.3 -77.4 136.6 -18.0 -0.5 13.4 201 216 A P >> - 0 0 42 0, 0.0 4,-2.4 0, 0.0 3,-1.4 -0.317 28.6-111.9 -57.5 149.0 -20.5 -3.2 14.4 202 217 A D H 3> S+ 0 0 86 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.835 117.6 60.8 -49.5 -40.0 -19.0 -6.6 15.1 203 218 A A H 34 S+ 0 0 89 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.791 112.1 39.2 -64.1 -25.6 -20.6 -8.0 11.9 204 219 A V H X4 S+ 0 0 9 -3,-1.4 3,-1.4 2,-0.2 6,-0.2 0.909 118.1 43.3 -86.1 -52.3 -18.6 -5.5 9.9 205 220 A R H 3< S+ 0 0 19 -4,-2.4 -2,-0.2 1,-0.3 -3,-0.2 0.714 115.3 51.4 -74.4 -14.0 -15.3 -5.5 11.7 206 221 A K T 3< S+ 0 0 94 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.404 75.8 126.2 -99.5 2.7 -15.3 -9.3 12.0 207 222 A H S <> S- 0 0 53 -3,-1.4 4,-3.0 1,-0.1 5,-0.3 -0.372 73.2-120.2 -52.2 135.4 -16.0 -9.8 8.3 208 223 A P H > S+ 0 0 99 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.833 110.7 50.1 -62.8 -28.2 -13.2 -12.2 7.3 209 224 A A H > S+ 0 0 8 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.889 113.4 45.5 -73.5 -38.3 -11.8 -9.8 4.7 210 225 A Y H > S+ 0 0 3 -3,-0.3 4,-2.6 -6,-0.2 5,-0.2 0.960 115.4 48.0 -65.9 -44.7 -11.7 -6.9 7.2 211 226 A R H X S+ 0 0 112 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.915 115.1 44.3 -61.0 -44.5 -10.2 -9.1 9.8 212 227 A R H X S+ 0 0 101 -4,-2.3 4,-2.6 -5,-0.3 -1,-0.2 0.893 113.0 48.9 -73.9 -39.5 -7.6 -10.6 7.6 213 228 A A H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.933 113.7 49.3 -63.2 -40.2 -6.6 -7.2 6.0 214 229 A A H X S+ 0 0 2 -4,-2.6 4,-1.7 -5,-0.3 -2,-0.2 0.925 111.9 48.3 -64.2 -43.5 -6.3 -5.8 9.6 215 230 A L H X S+ 0 0 46 -4,-2.4 4,-2.6 -5,-0.2 5,-0.2 0.933 110.9 49.4 -63.1 -47.5 -4.2 -8.7 10.8 216 231 A L H X S+ 0 0 6 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.873 105.9 55.8 -63.8 -35.8 -1.8 -8.6 7.9 217 232 A S H X S+ 0 0 1 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.922 113.6 42.5 -61.1 -43.4 -1.2 -4.9 8.2 218 233 A Q H X S+ 0 0 4 -4,-1.7 4,-2.8 2,-0.2 5,-0.2 0.868 109.8 54.7 -73.6 -37.6 -0.2 -5.4 11.8 219 234 A E H X S+ 0 0 6 -4,-2.6 4,-3.0 2,-0.2 5,-0.4 0.931 109.9 49.7 -58.0 -42.9 1.9 -8.6 11.2 220 235 A F H X S+ 0 0 0 -4,-2.5 4,-2.8 -5,-0.2 5,-0.4 0.960 110.8 48.7 -59.0 -49.3 3.9 -6.6 8.7 221 236 A A H X S+ 0 0 11 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.934 116.6 42.5 -56.6 -46.4 4.4 -3.7 11.2 222 237 A A H X S+ 0 0 3 -4,-2.8 4,-2.1 2,-0.2 -1,-0.2 0.922 117.5 43.8 -68.7 -48.0 5.5 -6.1 14.0 223 238 A W H X S+ 0 0 28 -4,-3.0 4,-2.4 -5,-0.2 -1,-0.2 0.855 112.2 52.0 -72.8 -30.6 7.8 -8.3 11.9 224 239 A Y H X S+ 0 0 0 -4,-2.8 4,-2.4 -5,-0.4 5,-0.3 0.900 108.5 52.9 -72.9 -35.3 9.4 -5.4 10.0 225 240 A N H X S+ 0 0 22 -4,-2.1 4,-3.1 -5,-0.4 5,-0.2 0.952 108.2 51.2 -59.4 -39.3 10.1 -3.9 13.4 226 241 A D H X S+ 0 0 0 -4,-2.1 4,-1.1 1,-0.2 -2,-0.2 0.938 110.2 48.8 -61.1 -43.6 11.7 -7.2 14.3 227 242 A L H < S+ 0 0 7 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.918 120.4 35.8 -62.3 -42.8 13.9 -7.1 11.2 228 243 A C H < S+ 0 0 14 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.788 119.0 47.4 -84.9 -28.6 15.0 -3.5 11.7 229 244 A S H X S+ 0 0 0 -4,-3.1 4,-2.4 -5,-0.3 5,-0.2 0.488 82.7 98.5 -92.2 -4.3 15.3 -3.5 15.5 230 245 A L H X S+ 0 0 8 -4,-1.1 4,-3.0 -5,-0.2 5,-0.2 0.899 81.2 50.4 -52.8 -47.1 17.2 -6.7 15.7 231 246 A P H > S+ 0 0 62 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.934 113.3 44.9 -61.0 -43.9 20.7 -5.1 16.0 232 247 A K H > S+ 0 0 28 -4,-0.3 4,-1.4 2,-0.2 -2,-0.2 0.874 115.1 50.4 -60.4 -37.7 19.5 -2.7 18.9 233 248 A E H <>S+ 0 0 14 -4,-2.4 5,-2.3 2,-0.2 4,-0.3 0.921 108.8 49.1 -74.0 -41.9 17.8 -5.7 20.5 234 249 A I H ><5S+ 0 0 87 -4,-3.0 3,-1.5 1,-0.2 -1,-0.2 0.947 112.3 49.7 -57.8 -46.6 20.8 -8.0 20.3 235 250 A A H 3<5S+ 0 0 25 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.788 114.4 46.1 -63.2 -28.7 23.0 -5.2 21.8 236 251 A G T 3<5S- 0 0 14 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.259 111.5-114.6-100.2 10.4 20.4 -4.7 24.6 237 252 A D T < 5 + 0 0 133 -3,-1.5 2,-0.3 -4,-0.3 -3,-0.2 0.771 58.7 158.8 59.1 26.8 19.9 -8.3 25.5 238 253 A E < - 0 0 19 -5,-2.3 -1,-0.2 -6,-0.2 -2,-0.1 -0.616 24.1-169.5 -72.6 135.3 16.3 -8.2 24.4 239 254 A V + 0 0 23 -2,-0.3 2,-0.9 -79,-0.1 -1,-0.1 0.495 57.1 94.3-104.2 -8.1 15.0 -11.7 23.7 240 255 A H + 0 0 6 -71,-0.1 2,-0.3 4,-0.1 3,-0.1 -0.791 51.4 104.8 -96.5 106.6 11.8 -10.9 21.9 241 256 A N S > S- 0 0 1 -2,-0.9 4,-2.1 1,-0.1 5,-0.2 -0.823 70.6-124.0-176.0 130.0 12.2 -10.9 18.1 242 257 A L H > S+ 0 0 0 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.887 114.0 56.2 -51.4 -37.9 11.2 -13.4 15.5 243 258 A G H > S+ 0 0 1 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.913 106.7 48.0 -61.1 -47.2 14.9 -13.6 14.4 244 259 A I H > S+ 0 0 13 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.866 107.5 54.4 -63.4 -37.6 16.1 -14.5 17.9 245 260 A S H X S+ 0 0 0 -4,-2.1 4,-1.8 1,-0.2 -73,-0.3 0.841 113.4 45.7 -65.3 -30.4 13.4 -17.2 18.2 246 261 A L H X S+ 0 0 3 -4,-1.5 6,-1.6 -5,-0.2 4,-1.4 0.849 113.8 45.5 -78.9 -40.1 14.9 -18.6 14.9 247 262 A I H X S+ 0 0 55 -4,-2.5 4,-0.5 4,-0.2 -2,-0.2 0.929 120.5 42.1 -64.8 -43.2 18.5 -18.3 15.8 248 263 A T H < S+ 0 0 69 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.875 128.4 23.4 -72.9 -41.7 17.8 -19.8 19.3 249 264 A H H < S+ 0 0 92 -4,-1.8 -3,-0.2 -5,-0.3 -1,-0.2 0.545 129.0 37.9-111.5 -12.1 15.4 -22.6 18.4 250 265 A H H < S- 0 0 99 -4,-1.4 -3,-0.1 -5,-0.2 -2,-0.1 0.193 97.8-123.8-123.0 9.2 16.1 -23.4 14.7 251 266 A S < + 0 0 107 -4,-0.5 -4,-0.2 1,-0.2 2,-0.2 0.750 53.6 158.0 54.6 27.4 19.9 -23.0 14.8 252 267 A L - 0 0 40 -6,-1.6 -1,-0.2 -9,-0.1 -2,-0.1 -0.544 42.4-119.1 -72.7 148.8 19.8 -20.5 12.0 253 268 A T > - 0 0 60 -2,-0.2 4,-3.0 1,-0.1 5,-0.2 -0.367 32.8-100.6 -72.8 166.8 22.7 -18.1 11.7 254 269 A L H > S+ 0 0 75 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.924 127.2 50.7 -54.9 -43.0 22.1 -14.4 12.1 255 270 A E H > S+ 0 0 136 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.903 111.0 45.7 -63.0 -43.8 22.3 -14.3 8.3 256 271 A E H > S+ 0 0 107 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.902 113.6 51.0 -68.1 -39.9 19.8 -17.1 7.7 257 272 A A H X S+ 0 0 0 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.900 107.4 50.8 -63.7 -45.1 17.5 -15.6 10.3 258 273 A I H X S+ 0 0 46 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.913 111.7 51.3 -59.0 -40.6 17.5 -12.1 8.8 259 274 A G H X S+ 0 0 38 -4,-1.9 4,-2.3 -5,-0.2 -2,-0.2 0.881 109.9 46.6 -63.2 -42.5 16.6 -13.8 5.5 260 275 A E H X S+ 0 0 45 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.898 112.2 50.6 -71.3 -39.1 13.7 -15.8 6.8 261 276 A V H X S+ 0 0 2 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.949 111.1 49.0 -62.1 -48.4 12.3 -12.8 8.6 262 277 A R H X S+ 0 0 55 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.914 109.8 51.5 -54.4 -45.8 12.5 -10.7 5.4 263 278 A R H X S+ 0 0 105 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.920 110.3 49.2 -58.9 -44.2 10.8 -13.5 3.4 264 279 A R H X S+ 0 0 55 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.900 112.4 48.5 -60.8 -41.4 8.0 -13.6 6.0 265 280 A V H X S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 -2,-0.2 0.942 110.8 50.0 -65.3 -47.6 7.6 -9.8 5.7 266 281 A E H X S+ 0 0 77 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.888 109.3 51.3 -58.6 -41.1 7.6 -9.8 1.9 267 282 A E H X S+ 0 0 83 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.822 103.1 60.2 -68.0 -33.4 4.9 -12.5 1.9 268 283 A C H X S+ 0 0 3 -4,-1.6 4,-2.3 -5,-0.2 -1,-0.2 0.894 103.5 52.7 -54.8 -41.7 2.8 -10.4 4.2 269 284 A I H X S+ 0 0 3 -4,-1.4 4,-2.1 2,-0.2 -2,-0.2 0.948 111.8 41.7 -65.8 -47.4 2.8 -7.7 1.7 270 285 A T H X S+ 0 0 81 -4,-1.6 4,-1.5 1,-0.2 -1,-0.2 0.822 113.4 53.3 -76.1 -25.4 1.5 -9.8 -1.2 271 286 A E H X S+ 0 0 65 -4,-2.2 4,-2.3 2,-0.2 5,-0.2 0.890 109.5 51.1 -68.3 -40.3 -1.0 -11.6 1.0 272 287 A F H X S+ 0 0 0 -4,-2.3 4,-3.0 -5,-0.2 -2,-0.2 0.921 104.7 55.3 -60.9 -41.9 -2.3 -8.2 2.0 273 288 A L H X S+ 0 0 55 -4,-2.1 4,-1.0 1,-0.2 -1,-0.2 0.898 110.2 47.5 -60.6 -38.0 -2.6 -7.1 -1.7 274 289 A A H >X S+ 0 0 57 -4,-1.5 4,-0.9 1,-0.2 3,-0.5 0.948 115.9 41.1 -67.6 -47.1 -4.8 -10.1 -2.3 275 290 A V H 3X S+ 0 0 9 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.836 104.2 67.5 -74.3 -28.7 -7.1 -9.7 0.7 276 291 A E H 3X S+ 0 0 22 -4,-3.0 4,-2.3 1,-0.2 -1,-0.2 0.881 96.3 55.9 -56.3 -34.9 -7.2 -5.9 0.2 277 292 A R H < S+ 0 0 92 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.902 108.2 53.8 -61.1 -45.1 -18.5 -1.5 -2.0 285 300 A E H 3< S+ 0 0 120 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.841 101.4 59.9 -61.1 -32.7 -21.2 -4.0 -0.9 286 301 A L H 3< S+ 0 0 30 -4,-2.0 2,-1.9 1,-0.2 -1,-0.2 0.783 84.5 82.2 -68.4 -24.2 -22.0 -2.1 2.2 287 302 A A << + 0 0 51 -3,-1.0 -1,-0.2 -4,-0.7 7,-0.1 -0.589 54.8 154.4 -81.5 84.6 -23.0 0.9 0.1 288 303 A D S S- 0 0 108 -2,-1.9 -1,-0.2 2,-0.1 3,-0.1 0.266 71.8 -88.5-103.4 10.6 -26.4 -0.4 -0.6 289 304 A G S S+ 0 0 80 1,-0.4 2,-0.1 -3,-0.1 -2,-0.1 0.180 94.2 113.9 99.9 -11.2 -28.1 2.9 -1.2 290 305 A T S > S- 0 0 71 1,-0.1 4,-2.1 0, 0.0 -1,-0.4 -0.457 75.0-119.1 -87.6 160.6 -29.0 3.6 2.4 291 306 A V H > S+ 0 0 130 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.964 116.9 44.9 -60.5 -50.7 -27.7 6.3 4.7 292 307 A R H > S+ 0 0 118 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.895 111.5 53.3 -58.2 -45.0 -26.3 3.8 7.2 293 308 A G H > S+ 0 0 4 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.888 108.7 49.0 -59.8 -41.0 -24.8 1.7 4.4 294 309 A K H X S+ 0 0 162 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.903 111.7 50.2 -66.4 -40.8 -23.0 4.8 3.0 295 310 A E H X S+ 0 0 92 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.956 114.8 42.9 -60.3 -49.9 -21.7 5.6 6.5 296 311 A L H X S+ 0 0 15 -4,-3.0 4,-2.8 1,-0.2 5,-0.2 0.907 113.9 50.6 -66.3 -45.1 -20.4 2.0 7.0 297 312 A S H X S+ 0 0 9 -4,-2.9 4,-2.8 -11,-0.2 5,-0.2 0.921 111.2 49.2 -54.6 -48.7 -19.0 1.8 3.5 298 313 A G H X S+ 0 0 39 -4,-2.5 4,-2.3 -5,-0.2 -2,-0.2 0.909 113.3 46.4 -60.6 -42.3 -17.1 5.1 3.9 299 314 A A H X S+ 0 0 5 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.940 113.8 47.0 -69.1 -44.8 -15.7 4.0 7.3 300 315 A V H X S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 5,-0.3 0.947 112.7 49.8 -62.8 -46.4 -14.6 0.6 6.1 301 316 A R H X S+ 0 0 102 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.938 113.1 46.8 -59.3 -42.1 -13.0 2.1 2.9 302 317 A A H X S+ 0 0 41 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.940 113.5 49.1 -65.7 -40.6 -11.1 4.7 5.0 303 318 A N H X S+ 0 0 0 -4,-3.0 4,-2.2 2,-0.2 -2,-0.2 0.931 111.2 47.3 -65.3 -43.8 -10.0 2.0 7.5 304 319 A V H X S+ 0 0 0 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.870 110.0 55.5 -66.5 -34.5 -8.7 -0.4 4.8 305 320 A G H X S+ 0 0 26 -4,-2.3 4,-1.9 -5,-0.3 -1,-0.2 0.895 109.7 45.7 -61.2 -38.9 -6.9 2.6 3.2 306 321 A N H X S+ 0 0 6 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.832 104.4 60.5 -77.8 -28.2 -5.2 3.2 6.5 307 322 A M H X S+ 0 0 1 -4,-2.2 4,-0.6 1,-0.2 -1,-0.2 0.890 109.7 45.4 -60.3 -36.1 -4.3 -0.5 6.9 308 323 A R H >X S+ 0 0 57 -4,-1.6 3,-1.0 1,-0.2 4,-0.9 0.892 108.4 55.3 -69.8 -45.1 -2.4 0.1 3.6 309 324 A N H 3X S+ 0 0 7 -4,-1.9 4,-2.6 1,-0.2 5,-0.2 0.826 94.6 68.6 -60.6 -27.9 -0.8 3.3 4.9 310 325 A W H 3X S+ 0 0 14 -4,-1.9 4,-2.8 1,-0.2 5,-0.3 0.857 93.9 59.1 -60.7 -34.4 0.6 1.5 7.9 311 326 A F H X S+ 0 0 61 -4,-2.3 4,-1.9 1,-0.2 3,-0.9 0.870 109.2 63.0 -71.1 -37.2 10.1 4.6 6.5 317 332 A F H 3X S+ 0 0 5 -4,-2.4 4,-2.9 -5,-0.3 -1,-0.2 0.897 99.7 55.1 -50.5 -42.2 9.8 5.2 10.2 318 333 A H H 3< S+ 0 0 15 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.807 112.9 41.8 -69.5 -22.0 12.4 2.5 10.9 319 334 A H H << S+ 0 0 45 -3,-0.9 -1,-0.2 -4,-0.7 -2,-0.2 0.700 122.2 39.6 -92.4 -19.6 14.9 4.2 8.5 320 335 A E H < S+ 0 0 76 -4,-1.9 -2,-0.2 -268,-0.1 2,-0.2 0.754 92.5 94.9 -97.2 -33.0 14.1 7.7 9.8 321 336 A S >< - 0 0 0 -4,-2.9 3,-1.2 -5,-0.3 -269,-0.3 -0.442 64.2-143.8 -73.1 137.1 13.8 7.3 13.5 322 337 A G G > S+ 0 0 20 -271,-2.9 3,-1.4 1,-0.2 -270,-0.2 0.673 89.9 85.7 -58.9 -19.5 16.6 7.9 16.0 323 338 A R G 3 S+ 0 0 5 -272,-0.3 -1,-0.2 1,-0.3 -271,-0.1 0.856 96.0 35.2 -58.6 -28.1 15.1 5.0 18.0 324 339 A Y G < S+ 0 0 26 -3,-1.2 2,-2.0 -6,-0.1 3,-0.3 0.347 81.5 111.0-110.3 7.1 17.0 2.4 16.0 325 340 A M X + 0 0 86 -3,-1.4 3,-1.8 1,-0.2 4,-0.2 -0.361 30.1 151.9 -82.8 59.7 20.3 4.1 15.2 326 341 A V G > + 0 0 5 -2,-2.0 3,-2.0 1,-0.3 -1,-0.2 0.833 63.5 67.0 -63.8 -32.4 22.4 1.9 17.5 327 342 A D G 3 S+ 0 0 141 -3,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.745 98.9 55.0 -59.2 -20.8 25.5 2.5 15.3 328 343 A S G < S+ 0 0 86 -3,-1.8 2,-0.3 4,-0.1 -1,-0.3 0.494 88.8 96.7 -91.0 -5.0 25.4 6.1 16.5 329 344 A W < - 0 0 23 -3,-2.0 3,-0.2 -4,-0.2 4,-0.0 -0.687 66.7-144.0 -92.5 141.6 25.4 5.3 20.3 330 345 A D S S+ 0 0 178 -2,-0.3 2,-0.6 1,-0.3 -1,-0.1 0.902 102.0 34.2 -65.2 -41.0 28.5 5.3 22.5 331 346 A D S > S- 0 0 80 3,-0.3 3,-1.6 1,-0.1 -1,-0.3 -0.951 75.2-161.4-117.3 108.2 27.1 2.4 24.4 332 347 A R T 3 S+ 0 0 100 -2,-0.6 -1,-0.1 1,-0.3 -97,-0.1 0.681 88.8 56.3 -62.4 -24.6 25.1 0.1 22.1 333 348 A S T 3 S+ 0 0 43 1,-0.2 -1,-0.3 -97,-0.1 -7,-0.0 0.557 105.5 54.3 -82.5 -9.9 23.2 -1.5 25.1 334 349 A T S < S- 0 0 32 -3,-1.6 -3,-0.3 -8,-0.1 -1,-0.2 -0.814 78.1-147.5-129.9 90.7 21.9 1.9 26.4 335 350 A P > - 0 0 13 0, 0.0 3,-1.7 0, 0.0 -3,-0.1 -0.336 18.8-128.6 -60.2 141.5 20.0 4.0 24.0 336 351 A P T 3 S+ 0 0 35 0, 0.0 4,-0.1 0, 0.0 -288,-0.1 0.687 103.7 58.9 -65.0 -22.8 20.6 7.7 24.8 337 352 A Y T 3 S+ 0 0 8 -15,-0.1 2,-0.2 -14,-0.1 -289,-0.1 0.500 88.1 93.7 -87.7 -6.4 16.9 8.6 24.8 338 353 A V S < S- 0 0 4 -3,-1.7 2,-0.9 -298,-0.1 -298,-0.0 -0.598 81.8-115.5 -88.2 150.7 16.0 6.1 27.6 339 354 A N 0 0 114 -2,-0.2 -2,-0.1 1,-0.1 -250,-0.0 -0.764 360.0 360.0 -86.8 104.9 15.9 7.0 31.4 340 355 A N 0 0 101 -2,-0.9 -1,-0.1 -4,-0.1 -251,-0.0 0.094 360.0 360.0-103.4 360.0 18.7 5.0 32.9