==== 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 HYDROLASE 22-FEB-06 2G4K . COMPND 2 MOLECULE: ADP-RIBOSYLHYDROLASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.MUELLER-DIECKMANN,M.S.WEISS . 339 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14588.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 246 72.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 . 6 1.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 12.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 178 52.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.1 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 2 1 1 0 2 3 0 0 2 1 2 2 1 0 1 0 0 0 0 0 0 0 0 0 0 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 . 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 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 1 A M 0 0 124 0, 0.0 2,-0.1 0, 0.0 307,-0.0 0.000 360.0 360.0 360.0 154.3 35.4 24.5 27.3 2 2 A R >> - 0 0 66 1,-0.1 4,-1.2 4,-0.0 3,-0.7 -0.463 360.0-115.1 -81.0 153.5 37.5 26.1 24.5 3 3 A S H 3> S+ 0 0 43 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.789 114.4 63.1 -56.8 -32.0 39.3 24.2 21.8 4 4 A L H 3> S+ 0 0 54 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.902 100.1 52.8 -65.4 -36.8 42.7 25.2 23.2 5 5 A S H <> S+ 0 0 23 -3,-0.7 4,-2.7 1,-0.2 304,-0.4 0.887 109.6 50.2 -61.7 -36.8 41.9 23.3 26.4 6 6 A R H X S+ 0 0 30 -4,-1.2 4,-3.0 2,-0.2 -2,-0.2 0.872 109.0 49.6 -69.2 -40.2 41.1 20.3 24.2 7 7 A F H X S+ 0 0 2 -4,-2.2 4,-2.1 2,-0.2 5,-0.2 0.950 116.2 43.0 -62.3 -51.4 44.4 20.5 22.3 8 8 A R H X S+ 0 0 74 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.931 116.1 48.8 -60.7 -44.1 46.4 20.7 25.5 9 9 A G H X S+ 0 0 0 -4,-2.7 4,-3.0 -5,-0.3 296,-0.3 0.932 107.2 55.5 -64.9 -40.3 44.3 18.0 27.1 10 10 A C H X S+ 0 0 0 -4,-3.0 4,-2.3 294,-0.5 294,-0.2 0.958 112.9 39.6 -55.0 -56.4 44.7 15.7 24.1 11 11 A L H X S+ 0 0 16 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.877 116.8 50.5 -66.5 -35.6 48.5 15.8 24.1 12 12 A A H X S+ 0 0 4 -4,-2.4 4,-3.1 -5,-0.2 -1,-0.2 0.917 109.5 50.9 -62.3 -44.4 48.7 15.7 28.0 13 13 A G H X S+ 0 0 0 -4,-3.0 4,-2.5 287,-0.2 288,-0.4 0.910 111.8 47.6 -59.9 -44.1 46.3 12.7 28.1 14 14 A A H X S+ 0 0 11 -4,-2.3 4,-2.1 286,-0.4 -1,-0.2 0.918 112.6 49.6 -61.5 -48.7 48.5 10.8 25.5 15 15 A L H X S+ 0 0 4 -4,-2.2 4,-3.0 1,-0.2 5,-0.3 0.947 112.0 49.2 -56.8 -49.8 51.7 11.7 27.5 16 16 A L H X S+ 0 0 0 -4,-3.1 4,-3.2 2,-0.2 5,-0.4 0.906 108.6 50.5 -54.9 -49.3 50.1 10.4 30.7 17 17 A G H X S+ 0 0 0 -4,-2.5 4,-1.9 279,-0.3 280,-0.4 0.930 115.5 43.8 -65.6 -36.3 48.9 7.1 29.2 18 18 A D H X S+ 0 0 0 -4,-2.1 4,-2.7 278,-0.2 -2,-0.2 0.984 117.7 43.9 -68.6 -55.1 52.5 6.4 27.9 19 19 A C H < S+ 0 0 1 -4,-3.0 4,-0.4 1,-0.2 -2,-0.2 0.882 122.8 36.1 -55.7 -48.5 54.3 7.5 31.1 20 20 A V H < S+ 0 0 1 -4,-3.2 3,-0.4 -5,-0.3 -1,-0.2 0.810 119.8 48.6 -75.2 -35.5 52.0 5.8 33.5 21 21 A G H >< S+ 0 0 0 -4,-1.9 3,-1.7 -5,-0.4 272,-0.5 0.752 90.4 80.5 -83.3 -20.0 51.4 2.7 31.3 22 22 A S G >< S+ 0 0 42 -4,-2.7 3,-1.2 1,-0.3 -1,-0.2 0.833 81.4 64.9 -52.7 -37.2 55.1 2.1 30.5 23 23 A F G 3 S+ 0 0 122 -3,-0.4 -1,-0.3 -4,-0.4 -2,-0.1 0.797 110.8 38.5 -57.2 -31.4 55.7 0.3 33.9 24 24 A Y G X S+ 0 0 9 -3,-1.7 3,-2.1 -4,-0.2 268,-0.3 0.349 79.8 139.4-109.0 4.3 53.3 -2.6 32.8 25 25 A E T < S+ 0 0 60 -3,-1.2 266,-0.2 -4,-0.5 3,-0.1 -0.281 77.8 8.0 -60.1 137.4 54.0 -3.0 29.0 26 26 A A T 3 S+ 0 0 82 264,-2.3 2,-0.7 1,-0.2 -1,-0.3 0.550 91.1 135.6 66.8 13.0 54.0 -6.7 27.8 27 27 A H B < -A 290 0A 90 -3,-2.1 263,-2.2 263,-0.7 -1,-0.2 -0.832 48.3-152.5 -83.7 118.3 52.7 -7.8 31.3 28 28 A D S S+ 0 0 138 -2,-0.7 2,-0.4 261,-0.2 -1,-0.2 0.846 80.9 26.9 -62.6 -37.5 50.0 -10.4 30.4 29 29 A T - 0 0 119 260,-0.1 2,-0.5 -3,-0.1 -1,-0.1 -0.983 69.7-162.6-130.1 140.0 48.1 -9.6 33.7 30 30 A V - 0 0 22 257,-0.5 2,-0.6 -2,-0.4 3,-0.1 -0.968 20.7-130.4-122.9 130.5 48.1 -6.4 35.7 31 31 A D > - 0 0 104 -2,-0.5 4,-1.9 1,-0.1 3,-0.4 -0.743 12.6-149.9 -75.9 119.9 47.0 -6.2 39.3 32 32 A L H > S+ 0 0 26 -2,-0.6 4,-2.9 1,-0.2 5,-0.2 0.892 98.8 57.8 -61.7 -39.1 44.5 -3.2 39.5 33 33 A T H > S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.893 105.2 51.8 -55.9 -34.2 45.6 -2.6 43.2 34 34 A S H > S+ 0 0 42 -3,-0.4 4,-2.1 1,-0.2 -2,-0.2 0.930 109.4 48.3 -71.4 -39.9 49.2 -2.2 41.8 35 35 A V H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 5,-0.3 0.927 110.0 51.0 -67.5 -45.1 48.0 0.4 39.2 36 36 A L H X S+ 0 0 30 -4,-2.9 4,-2.7 1,-0.2 -1,-0.2 0.914 112.0 48.3 -57.6 -42.8 46.0 2.4 41.9 37 37 A R H X S+ 0 0 192 -4,-2.1 4,-1.2 -5,-0.2 -1,-0.2 0.867 109.3 53.4 -58.7 -41.2 49.2 2.4 44.0 38 38 A H H < S+ 0 0 24 -4,-2.1 4,-0.2 2,-0.2 -2,-0.2 0.881 114.7 39.7 -62.8 -44.0 51.3 3.5 41.1 39 39 A V H >< S+ 0 0 1 -4,-2.3 3,-1.5 1,-0.2 4,-0.2 0.852 111.4 56.1 -80.7 -34.4 49.1 6.5 40.3 40 40 A Q H >< S+ 0 0 106 -4,-2.7 3,-2.0 -5,-0.3 -1,-0.2 0.845 95.7 67.4 -60.0 -30.9 48.5 7.4 43.9 41 41 A S T 3< S+ 0 0 73 -4,-1.2 -1,-0.2 1,-0.3 -2,-0.2 0.672 87.9 69.3 -66.9 -13.6 52.3 7.6 44.3 42 42 A L T < S+ 0 0 16 -3,-1.5 -1,-0.3 1,-0.3 -2,-0.2 0.573 99.5 48.7 -77.5 -10.6 52.1 10.6 41.9 43 43 A E S < S+ 0 0 89 -3,-2.0 -1,-0.3 -4,-0.2 273,-0.0 -0.657 86.3 176.6-127.7 71.1 50.3 12.6 44.7 44 44 A P - 0 0 104 0, 0.0 -3,-0.1 0, 0.0 -2,-0.0 -0.108 35.7 -75.9 -77.4 174.9 52.6 12.0 47.7 45 45 A D 0 0 155 1,-0.1 -2,-0.0 0, 0.0 0, 0.0 -0.553 360.0 360.0 -78.3 127.5 52.5 13.3 51.3 46 46 A P 0 0 166 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.927 360.0 360.0 -37.1 360.0 53.5 16.9 52.1 47 ! 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 48 55 A E 0 0 208 0, 0.0 3,-0.0 0, 0.0 273,-0.0 0.000 360.0 360.0 360.0 154.1 62.3 11.3 39.2 49 56 A A - 0 0 41 1,-0.1 2,-0.6 271,-0.1 271,-0.2 -0.317 360.0-103.1 -68.6 154.6 59.8 12.0 36.4 50 57 A L B -b 320 0B 35 269,-3.2 271,-2.7 1,-0.0 2,-0.1 -0.751 43.3-130.0 -72.6 126.5 58.1 9.1 34.7 51 58 A Y - 0 0 118 -2,-0.6 -29,-0.1 269,-0.2 2,-0.1 -0.426 15.0-127.9 -83.5 148.0 60.0 8.8 31.4 52 59 A Y - 0 0 19 -2,-0.1 2,-0.2 1,-0.1 -1,-0.1 -0.368 21.6-143.5 -92.0 166.6 58.1 8.6 28.1 53 60 A T > - 0 0 13 39,-0.1 4,-2.0 240,-0.1 3,-0.5 -0.527 44.2 -64.0-112.2-164.1 58.6 5.9 25.6 54 61 A D H > S+ 0 0 12 37,-0.7 4,-2.8 1,-0.2 5,-0.3 0.745 125.4 66.2 -46.5 -38.5 58.6 5.6 21.8 55 62 A D H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.966 110.8 34.0 -50.4 -56.3 54.8 6.5 21.7 56 63 A T H > S+ 0 0 6 -3,-0.5 4,-3.0 2,-0.2 5,-0.2 0.844 115.3 56.9 -69.9 -42.8 55.6 10.0 22.9 57 64 A A H X S+ 0 0 1 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.949 114.5 39.1 -58.1 -40.9 58.9 10.3 21.1 58 65 A M H X S+ 0 0 2 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.843 113.4 54.9 -79.5 -34.2 57.2 9.6 17.8 59 66 A A H X S+ 0 0 23 -4,-2.0 4,-2.1 -5,-0.3 -2,-0.2 0.916 109.2 49.5 -62.5 -43.4 54.1 11.7 18.7 60 67 A R H X S+ 0 0 49 -4,-3.0 4,-3.0 1,-0.2 -2,-0.2 0.909 111.5 48.8 -56.6 -44.2 56.5 14.7 19.5 61 68 A A H X S+ 0 0 6 -4,-1.9 4,-2.5 -5,-0.2 -1,-0.2 0.886 109.3 51.6 -66.7 -40.8 58.3 14.2 16.1 62 69 A L H X S+ 0 0 0 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.961 113.9 44.3 -61.7 -48.0 55.0 14.0 14.2 63 70 A V H X S+ 0 0 4 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.914 112.1 51.5 -62.7 -44.0 53.8 17.3 15.8 64 71 A Q H X S+ 0 0 68 -4,-3.0 4,-2.6 2,-0.2 -1,-0.2 0.885 109.0 51.3 -63.1 -34.2 57.1 19.0 15.3 65 72 A S H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 6,-0.3 0.939 110.6 49.5 -66.4 -49.6 57.1 18.1 11.6 66 73 A L H X>S+ 0 0 0 -4,-2.3 4,-1.4 1,-0.2 5,-0.8 0.900 115.0 42.9 -52.8 -50.6 53.6 19.5 11.2 67 74 A L H <5S+ 0 0 32 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.885 112.4 53.2 -65.6 -40.9 54.5 22.7 12.9 68 75 A A H <5S+ 0 0 52 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.912 124.4 26.5 -65.6 -39.2 57.9 23.1 11.1 69 76 A K H <5S- 0 0 103 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.566 97.8-132.9-100.8 -8.2 56.4 22.7 7.7 70 77 A E T <5S+ 0 0 145 -4,-1.4 2,-0.3 -5,-0.3 -3,-0.2 0.773 85.9 45.5 62.3 29.7 52.8 24.0 8.6 71 78 A A S - 0 0 53 -2,-0.2 4,-3.1 1,-0.1 5,-0.2 -0.908 17.1-160.0-149.7 98.3 55.5 16.6 4.7 74 81 A E H > S+ 0 0 79 -2,-0.4 4,-2.4 1,-0.2 5,-0.2 0.849 90.3 48.5 -53.7 -38.2 56.4 12.9 4.3 75 82 A V H > S+ 0 0 69 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.952 113.9 44.6 -72.0 -50.2 60.1 13.6 3.8 76 83 A D H > S+ 0 0 27 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.946 115.2 48.0 -56.1 -52.2 60.5 16.0 6.8 77 84 A M H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -2,-0.2 0.898 110.8 50.3 -63.8 -45.5 58.5 13.7 9.1 78 85 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 -1,-0.2 0.915 111.2 49.9 -55.6 -41.2 60.4 10.5 8.1 79 86 A H H X S+ 0 0 98 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.877 111.1 48.9 -69.0 -35.5 63.7 12.3 8.7 80 87 A R H X S+ 0 0 86 -4,-2.1 4,-2.3 1,-0.2 5,-0.2 0.913 111.6 49.3 -74.4 -35.1 62.5 13.5 12.2 81 88 A F H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.936 115.1 44.2 -62.2 -52.8 61.3 10.0 13.1 82 89 A A H X S+ 0 0 2 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.872 114.6 47.3 -61.9 -43.0 64.6 8.4 12.1 83 90 A Q H X S+ 0 0 101 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.854 109.3 54.3 -69.6 -33.5 66.8 11.1 13.7 84 91 A E H X S+ 0 0 33 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.926 112.0 46.3 -65.7 -44.8 64.7 10.9 17.0 85 92 A Y H < S+ 0 0 27 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.924 109.5 52.1 -56.7 -52.8 65.4 7.2 17.0 86 93 A K H < S+ 0 0 133 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.891 113.3 45.9 -53.6 -41.5 69.1 7.5 16.2 87 94 A K H < S+ 0 0 170 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.835 131.9 15.5 -76.8 -29.9 69.5 10.0 19.1 88 95 A D >< + 0 0 45 -4,-1.8 3,-0.8 -5,-0.1 -1,-0.3 -0.628 69.8 159.3-147.4 70.7 67.6 8.0 21.7 89 96 A P T 3 + 0 0 45 0, 0.0 3,-0.4 0, 0.0 4,-0.4 0.572 62.6 69.9 -80.2 -1.9 67.1 4.5 20.6 90 97 A D T 3 + 0 0 146 1,-0.2 -5,-0.0 2,-0.1 -36,-0.0 0.138 60.0 109.2-105.6 23.8 66.4 2.9 24.0 91 98 A R S < S- 0 0 42 -3,-0.8 -37,-0.7 -6,-0.1 -1,-0.2 0.547 102.1 -86.0 -77.5 -3.9 63.0 4.4 24.6 92 99 A G + 0 0 37 -3,-0.4 -2,-0.1 -39,-0.2 2,-0.1 0.727 64.6 171.8 106.6 31.4 61.2 1.1 24.1 93 100 A Y - 0 0 25 -4,-0.4 -1,-0.2 1,-0.1 2,-0.1 -0.422 38.3-107.0 -64.6 147.7 60.6 0.9 20.3 94 101 A G > - 0 0 44 1,-0.1 4,-1.3 -2,-0.1 3,-0.3 -0.411 25.8-118.8 -71.5 149.8 59.3 -2.4 18.9 95 102 A A H > S+ 0 0 88 1,-0.2 4,-1.2 2,-0.2 -1,-0.1 0.843 108.2 61.8 -61.7 -33.8 61.9 -4.4 17.0 96 103 A G H >> S+ 0 0 29 1,-0.2 4,-0.8 2,-0.2 3,-0.6 0.958 104.1 44.2 -59.6 -46.8 59.8 -4.2 13.8 97 104 A V H 3> S+ 0 0 20 -3,-0.3 4,-2.3 1,-0.3 3,-0.4 0.822 101.1 68.8 -73.1 -27.1 59.9 -0.5 13.4 98 105 A V H 3X S+ 0 0 26 -4,-1.3 4,-2.2 1,-0.2 -1,-0.3 0.916 94.0 58.7 -55.2 -39.8 63.6 -0.3 14.2 99 106 A T H < S+ 0 0 112 -4,-1.3 3,-1.2 -5,-0.2 6,-0.2 0.874 108.0 54.7 -75.9 -40.2 66.8 2.0 6.2 104 111 A L H 3< S+ 0 0 12 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.820 102.2 62.9 -60.2 -31.3 65.4 5.5 6.3 105 112 A L T 3< S+ 0 0 50 -4,-1.9 -1,-0.3 -5,-0.3 -2,-0.2 0.715 78.1 101.9 -71.1 -18.3 68.8 6.4 7.7 106 113 A N S X S- 0 0 77 -3,-1.2 3,-1.7 -4,-0.4 -3,-0.0 -0.496 71.6-140.7 -63.6 128.7 70.5 5.3 4.4 107 114 A P T 3 S+ 0 0 128 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.675 101.5 64.2 -64.4 -17.2 71.4 8.4 2.3 108 115 A K T 3 S+ 0 0 163 1,-0.1 2,-1.3 2,-0.0 -2,-0.1 0.690 74.0 110.5 -76.8 -16.8 70.4 6.5 -0.8 109 116 A C < + 0 0 33 -3,-1.7 3,-0.1 -6,-0.2 -1,-0.1 -0.429 31.6 157.2 -64.7 96.4 66.9 6.4 0.5 110 117 A R + 0 0 237 -2,-1.3 -1,-0.2 1,-0.2 2,-0.2 -0.122 63.9 57.7-110.6 20.0 65.0 8.7 -1.9 111 118 A D > - 0 0 85 -36,-0.0 3,-1.7 -7,-0.0 -1,-0.2 -0.654 65.5-167.2-144.2 103.2 61.5 7.2 -1.3 112 119 A V T 3 S+ 0 0 9 1,-0.3 4,-0.4 -2,-0.2 -8,-0.1 0.652 85.2 56.7 -73.3 -9.1 60.6 7.4 2.4 113 120 A F T 3> S+ 0 0 40 1,-0.1 4,-1.9 2,-0.1 -1,-0.3 0.643 87.6 81.0 -89.5 -13.6 57.6 5.1 2.0 114 121 A E H <> S+ 0 0 96 -3,-1.7 4,-2.4 2,-0.2 5,-0.2 0.868 85.2 53.0 -65.7 -45.1 59.7 2.2 0.5 115 122 A P H > S+ 0 0 8 0, 0.0 4,-1.0 0, 0.0 -1,-0.2 0.956 115.2 41.6 -54.7 -45.9 61.2 0.7 3.8 116 123 A A H >4 S+ 0 0 0 -4,-0.4 3,-0.5 41,-0.3 44,-0.5 0.884 114.2 52.6 -64.9 -40.8 57.8 0.4 5.4 117 124 A R H 3< S+ 0 0 90 -4,-1.9 7,-0.2 1,-0.2 -1,-0.2 0.907 110.0 48.9 -67.7 -35.5 56.2 -0.9 2.1 118 125 A A H 3X S+ 0 0 37 -4,-2.4 4,-1.4 -5,-0.2 3,-0.3 0.684 86.1 114.0 -74.2 -23.4 58.9 -3.6 1.8 119 126 A Q T <<>S+ 0 0 17 -4,-1.0 5,-2.7 -3,-0.5 3,-0.4 -0.143 76.4 16.5 -55.4 150.6 58.6 -4.9 5.3 120 127 A F T >45S- 0 0 105 1,-0.2 3,-1.9 3,-0.2 -1,-0.2 0.932 140.3 -50.5 48.9 55.6 57.3 -8.5 5.9 121 128 A N T 345S- 0 0 168 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.2 0.802 110.1 -52.6 58.9 31.3 57.8 -9.6 2.4 122 129 A G T 3<5S+ 0 0 33 -4,-1.4 -1,-0.3 -3,-0.4 -3,-0.2 0.347 119.8 103.7 88.2 -1.0 56.0 -6.5 1.1 123 130 A K T < 5S- 0 0 79 -3,-1.9 -3,-0.2 -4,-0.3 39,-0.2 0.668 76.4-139.7 -82.1 -23.1 52.8 -7.0 3.2 124 131 A G < - 0 0 3 -5,-2.7 2,-0.3 -7,-0.2 -7,-0.1 0.097 25.6 -63.6 84.0 162.9 53.8 -4.2 5.6 125 132 A S - 0 0 17 33,-0.3 36,-1.4 -9,-0.3 39,-0.3 -0.682 32.8-167.5 -79.0 141.7 53.5 -4.0 9.5 126 133 A Y + 0 0 88 -2,-0.3 124,-2.7 37,-0.1 125,-0.4 0.153 47.6 125.7-110.0 20.2 50.0 -4.0 11.0 127 134 A G B > S-C 249 0C 8 122,-0.3 3,-0.6 123,-0.1 122,-0.3 -0.099 74.4-110.2 -67.6 172.5 51.2 -3.0 14.5 128 135 A N T 3> S+ 0 0 7 120,-1.8 4,-2.4 1,-0.2 5,-0.2 0.227 88.8 105.9 -94.6 12.9 49.8 0.0 16.3 129 136 A G H 3> S+ 0 0 9 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.842 81.3 53.5 -63.1 -28.5 53.0 2.2 16.0 130 137 A G H <4 S+ 0 0 0 -3,-0.6 3,-0.3 1,-0.2 -1,-0.2 0.906 114.9 38.9 -70.5 -38.4 51.2 4.2 13.3 131 138 A A H >4 S+ 0 0 2 -4,-0.2 3,-1.2 1,-0.2 4,-0.3 0.812 101.9 70.7 -79.8 -28.5 48.2 4.9 15.6 132 139 A M H 3< S+ 0 0 13 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.1 0.775 111.4 31.3 -60.6 -25.3 50.2 5.4 18.8 133 140 A R T >< S+ 0 0 2 -4,-0.6 3,-0.6 -3,-0.3 -1,-0.3 0.332 94.3 95.1-113.3 -0.6 51.5 8.8 17.4 134 141 A V T X> + 0 0 0 -3,-1.2 3,-2.0 1,-0.2 4,-0.6 0.581 50.4 94.1 -83.2 -17.6 48.7 10.0 15.3 135 142 A A H >> S+ 0 0 9 -4,-0.3 3,-1.3 1,-0.3 4,-0.6 0.825 76.8 63.0 -46.5 -44.1 46.7 12.2 17.5 136 143 A G H X> S+ 0 0 2 -3,-0.6 4,-2.6 1,-0.3 3,-0.7 0.759 91.5 67.2 -55.4 -27.5 48.4 15.4 16.4 137 144 A I H <> S+ 0 0 0 -3,-2.0 4,-2.2 1,-0.2 -1,-0.3 0.871 99.6 50.5 -60.4 -41.2 47.1 15.0 12.8 138 145 A S H << S+ 0 0 2 -3,-1.3 -1,-0.2 -4,-0.6 -2,-0.2 0.625 111.1 49.4 -72.8 -14.2 43.5 15.5 14.2 139 146 A L H << S+ 0 0 2 -3,-0.7 -2,-0.2 -4,-0.6 -1,-0.2 0.751 114.8 43.7 -91.0 -34.4 44.7 18.7 15.9 140 147 A A H < S+ 0 0 9 -4,-2.6 2,-0.6 1,-0.2 -2,-0.2 0.868 116.9 46.8 -73.9 -35.5 46.5 20.0 12.7 141 148 A Y < - 0 0 31 -4,-2.2 -1,-0.2 -5,-0.2 6,-0.1 -0.916 58.2-174.5-119.1 107.8 43.6 19.1 10.3 142 149 A S + 0 0 89 -2,-0.6 -1,-0.1 195,-0.2 2,-0.1 0.844 60.9 83.0 -73.6 -28.7 40.0 20.0 11.2 143 150 A S S > S- 0 0 50 1,-0.1 4,-2.1 4,-0.0 5,-0.1 -0.452 75.6-133.9 -84.3 146.0 38.2 18.3 8.2 144 151 A V H > S+ 0 0 43 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.861 105.8 57.4 -65.1 -30.2 37.4 14.6 8.4 145 152 A Q H > S+ 0 0 133 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.936 110.4 43.8 -66.7 -38.5 38.7 14.1 4.8 146 153 A D H > S+ 0 0 59 1,-0.2 4,-2.6 2,-0.2 5,-0.4 0.851 108.4 57.8 -78.0 -32.8 42.1 15.5 5.8 147 154 A V H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 5,-0.3 0.966 111.4 41.6 -56.3 -55.1 42.2 13.5 9.0 148 155 A Q H X S+ 0 0 12 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.940 116.4 51.0 -62.8 -42.5 41.8 10.2 7.1 149 156 A K H X S+ 0 0 107 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.885 119.1 33.0 -58.3 -49.6 44.3 11.3 4.3 150 157 A F H X S+ 0 0 25 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.739 115.1 57.0 -88.3 -25.6 47.2 12.4 6.6 151 158 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.4 -2,-0.2 0.946 112.2 45.3 -61.4 -50.0 46.5 9.8 9.3 152 159 A R H X S+ 0 0 61 -4,-2.4 4,-2.1 -5,-0.3 -2,-0.2 0.961 116.9 43.6 -55.4 -55.5 46.9 7.2 6.5 153 160 A L H X S+ 0 0 39 -4,-1.9 4,-0.7 2,-0.2 -2,-0.2 0.873 113.2 49.2 -60.8 -45.4 50.1 8.9 5.1 154 161 A S H >< S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.2 4,-0.2 0.910 113.4 50.0 -64.3 -36.4 51.8 9.6 8.4 155 162 A A H >X S+ 0 0 0 -4,-2.1 4,-2.9 -5,-0.3 3,-2.1 0.897 100.8 62.2 -64.8 -41.9 51.1 5.9 9.3 156 163 A Q H 3< S+ 0 0 46 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.609 83.5 77.5 -65.1 -15.1 52.5 4.6 6.0 157 164 A L T << S+ 0 0 0 -3,-0.8 -1,-0.3 -4,-0.7 -41,-0.3 0.742 123.6 3.1 -63.0 -26.1 56.0 5.9 6.8 158 165 A T T <4 S+ 0 0 0 -3,-2.1 2,-0.5 -4,-0.2 -33,-0.3 0.501 134.1 50.5-128.7 -21.5 56.4 3.0 9.2 159 166 A H < + 0 0 11 -4,-2.9 6,-0.2 -5,-0.1 -1,-0.1 -0.796 52.5 166.1-128.6 92.1 53.2 0.8 8.9 160 167 A A + 0 0 6 -2,-0.5 2,-0.3 -44,-0.5 -34,-0.1 0.511 45.7 97.6 -88.9 -12.7 52.3 -0.1 5.3 161 168 A S S >> S- 0 0 4 -36,-1.4 4,-2.6 1,-0.1 3,-1.0 -0.640 77.7-129.0 -71.8 145.2 49.7 -2.9 5.8 162 169 A S H 3> S+ 0 0 0 -2,-0.3 4,-2.5 1,-0.3 5,-0.3 0.766 112.3 65.0 -61.2 -27.0 46.1 -1.5 5.6 163 170 A L H 3> S+ 0 0 4 2,-0.2 4,-0.6 1,-0.2 -1,-0.3 0.861 109.6 39.2 -65.8 -32.3 45.6 -3.3 8.9 164 171 A G H <> S+ 0 0 1 -3,-1.0 4,-1.6 -39,-0.3 3,-0.3 0.944 118.9 41.5 -76.2 -56.9 48.2 -0.9 10.2 165 172 A Y H X S+ 0 0 27 -4,-2.6 4,-2.3 1,-0.2 -3,-0.2 0.839 111.2 58.3 -68.8 -31.6 47.3 2.4 8.5 166 173 A N H X S+ 0 0 4 -4,-2.5 4,-2.5 -5,-0.3 -1,-0.2 0.856 104.6 51.2 -62.8 -39.6 43.5 1.7 9.0 167 174 A G H X S+ 0 0 0 -4,-0.6 4,-2.5 -3,-0.3 -1,-0.2 0.884 109.1 51.0 -58.3 -45.0 44.1 1.5 12.8 168 175 A A H X S+ 0 0 0 -4,-1.6 4,-2.3 2,-0.2 -2,-0.2 0.918 110.2 49.1 -55.9 -42.8 45.9 4.8 12.6 169 176 A I H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.922 111.5 50.9 -66.0 -45.9 42.9 6.4 10.6 170 177 A L H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.915 110.9 47.1 -56.1 -50.9 40.5 4.9 13.3 171 178 A Q H X S+ 0 0 2 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.895 113.3 47.7 -59.0 -46.5 42.5 6.4 16.2 172 179 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.863 110.9 51.8 -63.9 -39.9 42.7 9.8 14.5 173 180 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.864 108.1 52.4 -61.4 -43.6 39.0 9.8 13.7 174 181 A A H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.918 111.9 45.5 -58.1 -48.0 38.3 9.0 17.4 175 182 A V H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.949 111.6 52.7 -61.3 -50.1 40.4 12.0 18.3 176 183 A H H < S+ 0 0 21 -4,-3.1 4,-0.4 1,-0.2 -2,-0.2 0.891 112.2 44.7 -45.4 -47.6 38.7 14.2 15.7 177 184 A L H >< S+ 0 0 10 -4,-2.5 3,-1.9 1,-0.2 4,-0.2 0.926 105.4 60.6 -74.2 -41.4 35.3 13.3 17.0 178 185 A A H >< S+ 0 0 0 -4,-2.6 3,-1.7 1,-0.3 -1,-0.2 0.798 95.9 64.4 -51.8 -27.6 36.3 13.8 20.7 179 186 A L T 3< S+ 0 0 39 -4,-1.6 -1,-0.3 1,-0.3 -2,-0.2 0.728 92.0 61.3 -74.0 -16.7 37.1 17.5 19.8 180 187 A Q T < S- 0 0 112 -3,-1.9 -1,-0.3 -4,-0.4 -2,-0.2 0.531 102.3-156.2 -83.6 -8.4 33.4 18.0 19.0 181 188 A G < + 0 0 5 -3,-1.7 -1,-0.2 -4,-0.2 126,-0.1 -0.279 52.1 51.3 66.6-141.8 32.9 17.1 22.8 182 189 A E + 0 0 189 124,-0.1 2,-0.3 -3,-0.1 125,-0.0 0.089 65.2 153.5 -53.3 127.5 29.8 15.7 24.4 183 190 A S - 0 0 27 -5,-0.0 2,-0.1 4,-0.0 -1,-0.1 -0.986 46.9-112.1-142.5 147.2 28.4 12.7 22.6 184 191 A S > - 0 0 73 -2,-0.3 4,-2.0 1,-0.1 5,-0.1 -0.508 34.2-122.1 -65.5 154.0 26.4 9.6 23.3 185 192 A S H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.896 114.4 56.9 -67.5 -34.4 28.6 6.5 23.0 186 193 A E H > S+ 0 0 146 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.892 108.9 43.6 -62.4 -42.6 26.0 5.3 20.4 187 194 A H H > S+ 0 0 94 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.903 111.5 54.4 -69.9 -40.4 26.5 8.4 18.2 188 195 A F H X S+ 0 0 4 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.969 113.6 42.5 -58.2 -53.0 30.3 8.3 18.6 189 196 A L H X S+ 0 0 14 -4,-2.4 4,-3.2 1,-0.2 -1,-0.2 0.807 108.7 56.3 -58.6 -41.3 30.5 4.7 17.4 190 197 A K H X S+ 0 0 160 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.883 108.9 48.9 -60.6 -42.7 28.0 5.1 14.5 191 198 A Q H X S+ 0 0 56 -4,-1.9 4,-1.2 2,-0.2 -2,-0.2 0.943 114.2 44.3 -62.9 -45.7 30.2 7.9 13.1 192 199 A L H X S+ 0 0 0 -4,-1.9 4,-2.7 1,-0.2 3,-0.4 0.918 112.2 54.5 -65.9 -44.6 33.4 5.8 13.4 193 200 A L H X S+ 0 0 35 -4,-3.2 4,-2.9 1,-0.2 5,-0.3 0.887 103.4 54.6 -57.3 -43.0 31.6 2.8 12.0 194 201 A G H X S+ 0 0 50 -4,-2.0 4,-0.9 1,-0.2 -1,-0.2 0.834 111.1 45.2 -63.9 -34.1 30.5 4.6 8.9 195 202 A H H X S+ 0 0 48 -4,-1.2 4,-2.3 -3,-0.4 -2,-0.2 0.947 116.2 44.9 -74.4 -46.5 34.0 5.6 8.1 196 203 A M H X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.2 5,-0.2 0.862 106.6 56.4 -69.1 -41.6 35.5 2.2 8.7 197 204 A E H < S+ 0 0 68 -4,-2.9 4,-0.4 -5,-0.2 -1,-0.2 0.899 112.9 45.3 -55.6 -34.8 32.9 0.1 6.9 198 205 A D H >< S+ 0 0 100 -4,-0.9 3,-1.6 -5,-0.3 4,-0.4 0.990 115.5 44.7 -66.4 -57.1 33.7 2.3 3.8 199 206 A L H >< S+ 0 0 4 -4,-2.3 3,-1.7 1,-0.3 6,-0.3 0.887 109.3 56.1 -57.2 -48.1 37.6 2.0 4.3 200 207 A E T 3< S+ 0 0 10 -4,-3.0 -1,-0.3 1,-0.3 17,-0.2 0.549 97.5 66.3 -64.1 -11.2 37.5 -1.8 5.0 201 208 A G T < S+ 0 0 35 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.628 74.3 107.5 -80.6 -14.7 35.7 -2.3 1.7 202 209 A D S X> S- 0 0 83 -3,-1.7 4,-2.3 -4,-0.4 3,-0.7 -0.406 83.0-115.3 -60.9 153.0 38.7 -1.1 -0.4 203 210 A A H 3> S+ 0 0 69 1,-0.3 4,-3.3 2,-0.2 5,-0.2 0.833 114.2 51.3 -59.6 -45.8 40.5 -4.1 -2.2 204 211 A Q H 3> S+ 0 0 82 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.863 109.1 51.7 -62.9 -36.3 43.7 -3.7 -0.3 205 212 A S H <> S+ 0 0 8 -3,-0.7 4,-2.4 -6,-0.3 -2,-0.2 0.959 113.9 42.9 -64.6 -49.3 41.9 -3.8 3.0 206 213 A V H X S+ 0 0 33 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.946 115.6 49.0 -62.3 -47.2 40.0 -6.9 2.1 207 214 A L H X S+ 0 0 103 -4,-3.3 4,-2.3 1,-0.2 -1,-0.2 0.891 110.1 50.4 -63.5 -46.0 43.1 -8.6 0.6 208 215 A D H X S+ 0 0 7 -4,-2.8 4,-1.5 2,-0.2 -1,-0.2 0.912 113.8 46.5 -57.2 -44.6 45.3 -7.8 3.7 209 216 A A H <>S+ 0 0 2 -4,-2.4 5,-2.0 1,-0.2 3,-0.4 0.941 111.9 50.0 -63.2 -48.6 42.6 -9.2 6.1 210 217 A R H ><5S+ 0 0 151 -4,-2.8 3,-2.0 1,-0.3 -1,-0.2 0.882 105.9 55.9 -55.9 -44.6 42.2 -12.3 4.0 211 218 A E H 3<5S+ 0 0 116 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.850 108.6 48.5 -58.3 -38.1 45.9 -12.9 3.9 212 219 A L T 3<5S- 0 0 67 -4,-1.5 -1,-0.3 -3,-0.4 -2,-0.2 0.369 113.0-124.3 -81.9 3.1 45.7 -12.8 7.8 213 220 A G T < 5 + 0 0 66 -3,-2.0 -3,-0.2 -4,-0.1 -2,-0.1 0.707 62.0 145.1 68.0 25.9 42.9 -15.3 7.6 214 221 A M < - 0 0 38 -5,-2.0 -4,-0.1 1,-0.1 -1,-0.1 0.135 64.8-119.2 -93.4 17.9 40.6 -12.9 9.6 215 222 A E - 0 0 152 -5,-0.1 -1,-0.1 -6,-0.1 -5,-0.1 0.633 65.6-109.6 38.0 17.2 37.0 -13.3 8.3 216 223 A E S S+ 0 0 62 -7,-0.2 5,-0.1 -10,-0.1 -10,-0.1 0.384 93.1 74.2 69.9 171.5 37.6 -9.6 7.5 217 224 A R > + 0 0 95 -17,-0.2 4,-2.5 1,-0.1 5,-0.3 0.919 49.2 169.1 36.4 59.0 36.4 -6.2 8.7 218 225 A P H > S+ 0 0 5 0, 0.0 4,-0.7 0, 0.0 -1,-0.1 0.758 75.0 42.5 -60.3 -26.5 38.4 -6.5 11.9 219 226 A Y H > S+ 0 0 0 2,-0.2 4,-2.5 3,-0.1 5,-0.2 0.922 116.6 44.1 -87.5 -49.1 37.7 -2.8 12.7 220 227 A S H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.872 113.7 51.4 -57.2 -44.4 34.0 -2.6 11.8 221 228 A S H X S+ 0 0 42 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.916 112.5 47.0 -67.8 -36.9 33.3 -6.0 13.6 222 229 A R H X S+ 0 0 42 -4,-0.7 4,-2.3 -5,-0.3 -2,-0.2 0.893 109.3 52.7 -73.3 -35.4 35.1 -4.7 16.8 223 230 A L H X S+ 0 0 4 -4,-2.5 4,-1.5 2,-0.2 -1,-0.2 0.913 110.1 49.2 -61.2 -41.7 33.3 -1.3 16.7 224 231 A K H X S+ 0 0 104 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.939 112.2 49.6 -60.6 -46.1 30.0 -3.3 16.5 225 232 A K H X S+ 0 0 76 -4,-2.3 4,-3.1 1,-0.2 -2,-0.2 0.838 102.7 59.1 -63.1 -37.0 31.2 -5.4 19.5 226 233 A I H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.912 106.6 49.1 -56.2 -46.9 32.2 -2.3 21.6 227 234 A G H X S+ 0 0 20 -4,-1.5 4,-0.9 2,-0.2 -2,-0.2 0.946 111.3 48.8 -61.8 -44.0 28.5 -1.2 21.3 228 235 A E H >< S+ 0 0 126 -4,-1.7 3,-0.9 1,-0.2 4,-0.3 0.944 112.5 48.3 -58.0 -51.2 27.4 -4.7 22.4 229 236 A L H >< S+ 0 0 4 -4,-3.1 3,-1.4 1,-0.2 -2,-0.2 0.866 106.0 57.6 -57.8 -40.5 29.9 -4.6 25.4 230 237 A L H 3< S+ 0 0 44 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.741 105.1 52.7 -64.9 -19.8 28.7 -1.1 26.4 231 238 A D T << S+ 0 0 128 -4,-0.9 2,-0.3 -3,-0.9 -1,-0.3 0.557 89.6 97.8 -89.6 -8.4 25.1 -2.5 26.8 232 239 A Q S < S- 0 0 87 -3,-1.4 3,-0.1 -4,-0.3 -3,-0.0 -0.691 75.1-131.0 -90.1 138.9 26.2 -5.4 29.1 233 240 A A S S+ 0 0 111 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.923 91.7 6.4 -49.0 -62.3 25.7 -5.1 32.9 234 241 A S - 0 0 95 -3,-0.0 2,-0.5 2,-0.0 -1,-0.2 -0.992 64.0-171.9-134.6 141.4 29.2 -6.3 33.6 235 242 A V - 0 0 14 -2,-0.4 2,-0.1 -3,-0.1 -6,-0.0 -0.998 19.6-140.9-127.3 123.3 32.0 -7.0 31.3 236 243 A T > - 0 0 71 -2,-0.5 4,-2.4 1,-0.1 5,-0.2 -0.459 23.4-114.2 -83.0 164.1 35.2 -8.6 32.7 237 244 A R H > S+ 0 0 46 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.916 118.9 57.4 -60.4 -37.3 38.7 -7.8 31.6 238 245 A E H > S+ 0 0 141 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.908 106.9 49.4 -59.5 -37.9 39.0 -11.4 30.1 239 246 A E H > S+ 0 0 49 2,-0.2 4,-2.7 1,-0.2 5,-0.4 0.938 111.7 47.1 -66.6 -47.0 36.0 -10.6 27.9 240 247 A V H X>S+ 0 0 0 -4,-2.4 4,-3.3 1,-0.2 5,-2.0 0.951 115.0 47.4 -62.4 -46.6 37.5 -7.3 26.7 241 248 A V H <5S+ 0 0 43 -4,-3.0 -1,-0.2 3,-0.2 -2,-0.2 0.880 116.2 42.2 -64.8 -39.3 40.8 -9.0 26.0 242 249 A S H <5S+ 0 0 87 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.870 123.2 38.5 -75.9 -34.1 39.3 -12.0 24.2 243 250 A E H <5S+ 0 0 80 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.892 138.3 8.7 -85.7 -42.7 36.7 -9.9 22.2 244 251 A L T <5S- 0 0 0 -4,-3.3 -3,-0.2 -5,-0.4 12,-0.2 0.819 99.4-136.9-110.9 -51.3 38.7 -6.7 21.4 245 252 A G < - 0 0 7 -5,-2.0 -3,-0.1 -6,-0.1 -2,-0.1 -0.344 14.6-129.5 123.1 175.6 42.3 -7.6 22.4 246 253 A N + 0 0 28 -5,-0.2 45,-2.3 -2,-0.1 7,-0.2 -0.165 65.6 119.1-149.5 37.7 45.2 -5.8 24.3 247 254 A G S S- 0 0 13 5,-1.7 5,-0.1 2,-0.2 -119,-0.0 -0.477 76.8-104.0-108.6-179.3 48.0 -6.5 21.8 248 255 A I S S+ 0 0 115 -2,-0.2 -120,-1.8 -121,-0.1 5,-0.1 0.830 89.6 98.3 -74.9 -31.1 50.5 -4.8 19.5 249 256 A A B > S-C 127 0C 12 -122,-0.3 3,-1.3 1,-0.2 -122,-0.3 -0.333 83.0-127.5 -57.1 136.2 48.4 -5.5 16.3 250 257 A A G >> S+ 0 0 0 -124,-2.7 4,-2.6 1,-0.3 3,-1.2 0.868 109.4 55.0 -61.0 -33.2 46.5 -2.2 15.7 251 258 A F G 34 S+ 0 0 11 -125,-0.4 -1,-0.3 1,-0.3 5,-0.1 0.663 107.3 51.4 -78.6 -13.0 43.2 -4.1 15.4 252 259 A E G <4 S+ 0 0 78 -3,-1.3 -5,-1.7 -5,-0.1 -1,-0.3 0.225 123.8 26.0 -97.8 4.1 43.9 -5.6 18.9 253 260 A S T <> S+ 0 0 0 -3,-1.2 4,-2.7 -7,-0.2 -2,-0.2 0.533 109.4 60.2-132.8 -43.3 44.6 -2.1 20.5 254 261 A V H X S+ 0 0 0 -4,-2.6 4,-2.0 -5,-0.2 5,-0.2 0.984 110.4 41.9 -62.8 -54.6 42.8 0.8 18.7 255 262 A P H > S+ 0 0 0 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.889 115.0 54.2 -55.4 -40.9 39.2 -0.5 19.2 256 263 A T H > S+ 0 0 0 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.917 107.1 50.2 -60.3 -46.4 40.2 -1.5 22.8 257 264 A A H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.899 111.0 48.2 -52.1 -49.2 41.4 2.1 23.5 258 265 A I H X S+ 0 0 0 -4,-2.0 4,-2.6 2,-0.2 -1,-0.2 0.850 110.2 52.5 -59.8 -45.7 38.2 3.5 22.2 259 266 A Y H X S+ 0 0 4 -4,-2.3 4,-3.1 2,-0.2 5,-0.3 0.932 107.6 51.6 -55.9 -49.2 36.2 0.9 24.4 260 267 A C H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.935 111.8 48.8 -58.1 -40.7 38.2 2.1 27.5 261 268 A F H < S+ 0 0 0 -4,-2.0 4,-0.3 1,-0.2 -1,-0.2 0.942 116.9 39.4 -64.9 -53.3 37.2 5.8 26.6 262 269 A L H >< S+ 0 0 6 -4,-2.6 3,-0.9 1,-0.2 -1,-0.2 0.904 117.3 48.2 -64.9 -44.6 33.6 5.0 26.1 263 270 A R H >< S+ 0 0 55 -4,-3.1 3,-1.3 1,-0.2 -2,-0.2 0.893 105.6 59.1 -61.0 -43.2 33.2 2.6 29.1 264 271 A C T 3< S+ 0 0 2 -4,-2.3 -1,-0.2 1,-0.3 17,-0.2 0.348 79.1 88.1 -79.0 2.5 35.1 5.0 31.6 265 272 A M T < S+ 0 0 41 -3,-0.9 -1,-0.3 -4,-0.3 -2,-0.1 0.699 90.7 57.4 -59.8 -23.4 32.5 7.8 31.0 266 273 A E S < S- 0 0 131 -3,-1.3 0, 0.0 -4,-0.1 0, 0.0 -0.742 102.4 -89.1-114.8 154.6 30.7 6.1 33.8 267 274 A P - 0 0 109 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.195 31.6-150.3 -57.9 149.2 31.7 5.3 37.3 268 275 A D > - 0 0 17 3,-0.3 3,-2.0 -4,-0.1 -4,-0.0 -0.972 8.5-149.0-122.8 117.8 33.5 2.0 38.1 269 276 A P T 3 S+ 0 0 136 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 0.722 98.4 56.6 -56.3 -27.1 33.0 0.5 41.6 270 277 A E T 3 S+ 0 0 114 2,-0.1 3,-0.0 -3,-0.0 0, 0.0 0.530 98.8 66.1 -79.7 -14.6 36.5 -1.0 41.5 271 278 A I S < S- 0 0 6 -3,-2.0 -3,-0.3 4,-0.0 9,-0.1 -0.950 99.9-103.4-111.6 123.8 38.2 2.4 40.9 272 279 A P > - 0 0 64 0, 0.0 3,-1.8 0, 0.0 -2,-0.1 -0.120 23.8-121.9 -52.3 147.0 38.0 4.9 43.8 273 280 A S T 3 S+ 0 0 129 1,-0.3 -3,-0.0 -4,-0.1 -2,-0.0 0.698 103.4 76.2 -63.3 -23.6 35.5 7.7 43.4 274 281 A A T 3 S+ 0 0 89 2,-0.0 2,-0.3 0, 0.0 -1,-0.3 0.731 78.2 87.3 -58.5 -28.1 38.2 10.3 43.8 275 282 A F S < S- 0 0 16 -3,-1.8 -4,-0.0 1,-0.1 2,-0.0 -0.603 74.0-136.5 -78.2 140.4 39.4 9.7 40.3 276 283 A N > - 0 0 44 -2,-0.3 4,-2.8 35,-0.1 5,-0.2 -0.183 33.8 -88.2 -83.2-176.7 37.8 11.6 37.4 277 284 A S H > S+ 0 0 21 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.920 126.1 47.1 -64.2 -40.3 36.8 10.3 34.0 278 285 A L H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.911 114.0 47.5 -68.4 -42.0 40.1 10.8 32.3 279 286 A Q H > S+ 0 0 13 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.927 111.6 50.7 -64.2 -46.3 42.0 9.3 35.2 280 287 A R H X S+ 0 0 23 -4,-2.8 4,-3.1 1,-0.2 5,-0.3 0.902 106.7 57.3 -53.9 -44.2 39.6 6.3 35.3 281 288 A T H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.921 110.7 40.7 -56.1 -49.1 40.2 5.8 31.6 282 289 A L H X S+ 0 0 1 -4,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.900 115.6 50.5 -68.9 -41.5 43.9 5.5 32.0 283 290 A I H X S+ 0 0 1 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.964 113.6 45.6 -57.4 -55.2 43.7 3.3 35.1 284 291 A Y H < S+ 0 0 1 -4,-3.1 4,-0.4 2,-0.2 -2,-0.2 0.924 112.2 50.2 -57.8 -48.7 41.2 1.0 33.5 285 292 A S H >< S+ 0 0 1 -4,-2.4 3,-1.7 -5,-0.3 4,-0.4 0.943 112.6 47.0 -59.4 -49.8 43.2 0.7 30.1 286 293 A I H >< S+ 0 0 1 -4,-2.4 3,-1.8 1,-0.3 -1,-0.2 0.871 103.6 63.9 -53.9 -37.4 46.4 -0.1 32.0 287 294 A S T 3< S+ 0 0 3 -4,-2.1 -257,-0.5 1,-0.3 -1,-0.3 0.560 89.8 68.5 -66.1 -12.7 44.5 -2.6 34.1 288 295 A L T < S- 0 0 7 -3,-1.7 -1,-0.3 -4,-0.4 -2,-0.2 0.656 93.6-151.8 -82.9 -17.1 43.9 -4.7 30.9 289 296 A G < + 0 0 0 -3,-1.8 2,-0.3 -4,-0.4 -261,-0.2 -0.296 55.5 81.3 75.5-172.3 47.6 -5.6 30.5 290 297 A G B S+A 27 0A 12 -263,-2.2 -264,-2.3 -266,-0.2 2,-1.9 -0.541 108.6 9.5 74.7-123.3 49.3 -6.4 27.2 291 298 A D S > S+ 0 0 5 -45,-2.3 4,-2.9 -2,-0.3 5,-0.3 -0.442 81.6 160.2 -89.9 62.4 50.4 -3.3 25.3 292 299 A T H > + 0 0 0 -2,-1.9 4,-2.1 -268,-0.3 -1,-0.2 0.839 64.8 50.7 -62.3 -46.5 49.5 -1.0 28.3 293 300 A D H > S+ 0 0 0 -272,-0.5 4,-2.1 -3,-0.2 -1,-0.2 0.907 117.4 40.8 -55.5 -42.1 51.6 2.1 27.3 294 301 A T H > S+ 0 0 2 2,-0.2 4,-1.7 -3,-0.2 -2,-0.2 0.886 115.4 47.1 -84.0 -42.3 50.2 2.2 23.8 295 302 A I H X S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 5,-0.3 0.950 117.0 46.8 -60.9 -44.1 46.6 1.4 24.6 296 303 A A H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.3 -279,-0.3 0.901 109.8 52.2 -70.1 -34.4 46.7 4.0 27.4 297 304 A T H X S+ 0 0 2 -4,-2.1 4,-1.8 -280,-0.4 -1,-0.2 0.899 114.2 43.9 -67.1 -31.9 48.4 6.7 25.2 298 305 A M H X S+ 0 0 1 -4,-1.7 4,-1.7 2,-0.2 -2,-0.2 0.940 115.9 45.5 -84.0 -41.3 45.6 6.3 22.6 299 306 A A H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.890 113.7 53.4 -61.7 -35.0 42.8 6.2 25.1 300 307 A G H X S+ 0 0 0 -4,-2.4 4,-2.9 -5,-0.3 -286,-0.4 0.870 104.5 52.5 -70.3 -38.4 44.4 9.2 26.8 301 308 A A H X S+ 0 0 2 -4,-1.8 4,-2.2 -288,-0.4 -1,-0.2 0.925 114.7 42.5 -62.1 -50.9 44.6 11.2 23.5 302 309 A I H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.959 117.8 45.1 -61.9 -52.6 40.8 10.7 23.0 303 310 A A H X>S+ 0 0 0 -4,-2.8 4,-3.1 2,-0.2 5,-0.5 0.918 112.7 52.0 -58.1 -49.8 39.9 11.3 26.6 304 311 A G H X5S+ 0 0 0 -4,-2.9 4,-2.1 -294,-0.2 -294,-0.5 0.927 111.2 46.4 -54.8 -43.9 42.1 14.3 26.8 305 312 A A H <5S+ 0 0 0 -4,-2.2 -1,-0.2 -296,-0.3 -2,-0.2 0.839 117.6 45.4 -65.3 -35.7 40.5 15.9 23.7 306 313 A Y H <5S+ 0 0 21 -4,-1.9 -2,-0.2 -5,-0.2 -1,-0.2 0.850 125.5 26.4 -75.6 -45.7 37.1 15.1 25.1 307 314 A Y H <5S- 0 0 24 -4,-3.1 3,-0.4 -5,-0.1 -3,-0.2 0.650 94.8-158.6 -95.2 -28.3 37.4 16.2 28.6 308 315 A G ><< - 0 0 0 -4,-2.1 3,-1.8 -5,-0.5 4,-0.2 -0.040 48.1 -40.7 75.7-173.3 40.2 18.9 28.2 309 316 A M G > S+ 0 0 42 -304,-0.4 3,-1.7 1,-0.3 -1,-0.2 0.760 120.6 79.4 -65.1 -22.4 42.6 20.3 30.8 310 317 A D G 3 S+ 0 0 147 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.713 104.1 38.3 -59.2 -17.1 39.9 20.5 33.6 311 318 A Q G < S+ 0 0 42 -3,-1.8 -1,-0.3 -7,-0.1 -2,-0.2 0.312 89.3 98.3-112.8 3.0 40.5 16.7 34.0 312 319 A V S < S- 0 0 10 -3,-1.7 2,-0.3 -4,-0.2 -299,-0.0 -0.866 76.4-134.5 -87.9 110.5 44.2 16.5 33.5 313 320 A P > - 0 0 18 0, 0.0 4,-2.9 0, 0.0 5,-0.2 -0.577 0.5-142.3 -71.9 130.5 45.5 16.4 37.1 314 321 A E H > S+ 0 0 140 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.853 101.4 55.2 -57.3 -43.0 48.5 18.8 37.7 315 322 A S H > S+ 0 0 34 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.944 113.5 40.3 -59.5 -45.1 50.1 16.2 40.1 316 323 A W H >4 S+ 0 0 1 2,-0.2 3,-1.0 1,-0.2 4,-0.5 0.951 116.6 49.1 -69.9 -42.1 50.0 13.5 37.4 317 324 A Q H >< S+ 0 0 20 -4,-2.9 3,-1.7 1,-0.3 6,-0.2 0.929 108.8 52.8 -63.5 -40.1 51.0 15.9 34.5 318 325 A Q H 3< S+ 0 0 102 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.2 0.624 101.0 63.0 -72.7 -18.2 53.9 17.3 36.4 319 326 A S T << S+ 0 0 24 -3,-1.0 -269,-3.2 -4,-0.6 2,-0.5 0.568 88.0 92.3 -77.4 -16.6 55.2 13.7 37.0 320 327 A C B X S-b 50 0B 2 -3,-1.7 3,-1.6 -4,-0.5 -269,-0.2 -0.724 83.4-113.1 -90.4 135.3 55.7 13.2 33.3 321 328 A E T 3 S+ 0 0 46 -271,-2.7 -302,-0.1 -2,-0.5 -2,-0.1 -0.297 99.0 8.1 -54.3 126.2 58.9 13.8 31.4 322 329 A G T 3> S+ 0 0 13 -4,-0.1 4,-2.9 -2,-0.1 -1,-0.3 0.632 78.4 142.5 78.4 17.2 58.5 16.7 29.0 323 330 A Y H <> S+ 0 0 59 -3,-1.6 4,-2.6 1,-0.2 5,-0.1 0.844 72.5 50.3 -63.2 -31.2 55.1 17.8 30.1 324 331 A E H > S+ 0 0 127 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.909 112.1 47.9 -76.2 -37.0 55.9 21.5 29.6 325 332 A E H > S+ 0 0 102 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.944 110.9 51.2 -65.8 -45.9 57.3 20.9 26.1 326 333 A T H X S+ 0 0 10 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.914 109.8 50.2 -53.7 -46.1 54.2 18.8 25.3 327 334 A D H X S+ 0 0 21 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.840 109.5 51.0 -64.7 -38.8 52.0 21.7 26.4 328 335 A I H X S+ 0 0 96 -4,-1.8 4,-2.3 2,-0.2 -1,-0.2 0.913 110.2 48.8 -66.3 -40.8 54.0 24.2 24.3 329 336 A L H X S+ 0 0 25 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.898 110.8 51.2 -67.2 -37.2 53.5 22.0 21.2 330 337 A A H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.922 112.2 46.2 -65.0 -44.3 49.8 21.7 21.9 331 338 A Q H X S+ 0 0 69 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.892 111.9 51.9 -59.6 -44.0 49.5 25.5 22.2 332 339 A S H X S+ 0 0 22 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.915 106.8 52.3 -61.7 -45.3 51.5 25.8 19.0 333 340 A L H X>S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 5,-0.7 0.943 112.5 47.1 -55.3 -47.1 49.2 23.4 17.1 334 341 A H H X>S+ 0 0 31 -4,-2.1 5,-2.8 1,-0.2 4,-1.3 0.893 114.0 46.7 -63.1 -43.0 46.3 25.5 18.2 335 342 A R H <5S+ 0 0 144 -4,-2.5 5,-0.3 3,-0.2 -1,-0.2 0.889 120.7 37.3 -61.7 -43.6 48.0 28.8 17.2 336 343 A V H <5S+ 0 0 41 -4,-2.7 -2,-0.2 -5,-0.1 -3,-0.2 0.900 131.9 19.2 -85.4 -45.0 49.1 27.6 13.8 337 344 A F H <5S+ 0 0 43 -4,-2.9 -3,-0.2 -5,-0.3 -195,-0.2 0.699 128.6 35.0-100.2 -26.8 46.3 25.4 12.6 338 345 A Q T <