==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 05-APR-02 1LC5 . COMPND 2 MOLECULE: L-THREONINE-O-3-PHOSPHATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA ENTERICA; . AUTHOR C.-G.CHEONG,J.ESCALANTE-SEMERENA,I.RAYMENT . 355 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15350.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 245 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 6.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 23 6.5 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 . 30 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 13.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 106 29.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 1 1 1 2 1 1 1 0 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 2 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 1 1 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 0 1 0 0 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 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 L 0 0 70 0, 0.0 2,-0.3 0, 0.0 15,-0.0 0.000 360.0 360.0 360.0 -50.5 -6.3 22.7 22.1 2 4 A F - 0 0 40 2,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.877 360.0-162.7-126.2 158.7 -5.9 26.5 21.5 3 5 A N + 0 0 102 -2,-0.3 -1,-0.1 322,-0.0 0, 0.0 0.241 50.3 133.4-119.5 6.0 -5.9 28.8 18.6 4 6 A T - 0 0 46 1,-0.1 321,-0.1 5,-0.1 -2,-0.1 -0.239 54.4-140.4 -62.3 144.2 -4.2 31.7 20.5 5 7 A A S S+ 0 0 53 1,-0.1 2,-0.3 2,-0.1 102,-0.2 0.875 77.8 26.1 -74.0 -37.0 -1.4 33.5 18.8 6 8 A H S S- 0 0 52 1,-0.1 3,-0.3 101,-0.0 23,-0.1 -0.830 81.8 -98.0-131.2 162.3 0.9 33.9 21.8 7 9 A G S S+ 0 0 25 -2,-0.3 22,-0.2 21,-0.2 -1,-0.1 -0.030 89.0 67.5 -68.8 177.8 1.7 32.4 25.2 8 10 A G + 0 0 31 1,-0.1 2,-2.0 21,-0.1 3,-0.3 0.590 55.8 146.6 85.6 11.9 0.3 33.6 28.5 9 11 A N + 0 0 24 -3,-0.3 5,-0.2 1,-0.2 -1,-0.1 -0.329 8.3 144.5 -80.9 56.7 -3.3 32.6 27.7 10 12 A I > + 0 0 58 -2,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.817 67.3 56.1 -65.8 -31.3 -4.2 31.7 31.2 11 13 A R H > S+ 0 0 177 -3,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.947 111.1 43.5 -66.4 -46.0 -7.8 32.9 30.8 12 14 A E H > S+ 0 0 52 1,-0.2 4,-1.3 2,-0.2 -2,-0.2 0.912 115.9 48.0 -63.5 -43.7 -8.4 30.6 27.8 13 15 A P H > S+ 0 0 0 0, 0.0 4,-1.5 0, 0.0 3,-0.3 0.898 108.8 53.4 -65.1 -41.0 -6.7 27.7 29.5 14 16 A A H X>S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 5,-2.0 0.875 104.7 56.4 -62.6 -36.2 -8.6 28.1 32.7 15 17 A T H <5S+ 0 0 90 -4,-1.8 -1,-0.2 1,-0.2 -3,-0.1 0.850 102.8 54.4 -65.6 -31.7 -11.8 28.0 30.8 16 18 A V H <5S+ 0 0 72 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.900 116.5 37.7 -67.7 -39.9 -10.9 24.6 29.3 17 19 A L H <5S- 0 0 62 -4,-1.5 -2,-0.2 2,-0.1 -1,-0.2 0.694 108.0-124.9 -83.6 -21.3 -10.4 23.2 32.9 18 20 A G T <5S+ 0 0 66 -4,-2.0 -3,-0.2 1,-0.3 2,-0.2 0.817 72.1 110.5 79.8 29.6 -13.3 25.2 34.4 19 21 A I S - 0 0 47 -2,-0.2 3,-2.1 1,-0.1 4,-0.3 -0.640 34.6-129.2 -84.3 139.8 -9.7 30.2 37.9 21 23 A P G > S+ 0 0 43 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.795 106.8 63.2 -57.3 -29.1 -6.9 31.6 35.8 22 24 A D G 3 S+ 0 0 133 1,-0.2 -11,-0.0 3,-0.0 -2,-0.0 0.540 92.0 66.1 -75.7 -3.0 -4.9 32.4 38.9 23 25 A Q G < S+ 0 0 72 -3,-2.1 2,-0.2 2,-0.1 -1,-0.2 0.516 83.5 94.9 -92.2 -7.0 -4.8 28.7 39.8 24 26 A L S < S- 0 0 18 -3,-1.3 2,-0.8 -4,-0.3 294,-0.2 -0.615 70.2-140.3 -86.9 144.4 -2.6 27.9 36.7 25 27 A L E -a 318 0A 12 292,-3.0 294,-2.2 -2,-0.2 2,-0.7 -0.921 29.3-146.2-100.2 108.4 1.2 27.6 36.9 26 28 A D E +a 319 0A 23 -2,-0.8 294,-0.1 292,-0.2 3,-0.1 -0.699 38.5 158.5 -90.9 114.1 2.1 29.4 33.6 27 29 A F + 0 0 0 292,-3.1 310,-1.6 -2,-0.7 294,-0.5 0.123 64.1 81.9-109.4 15.3 5.2 28.1 31.7 28 30 A S S S+ 0 0 0 292,-0.3 2,-0.4 291,-0.2 -21,-0.2 0.530 85.7 52.7-100.8 -7.7 3.9 29.6 28.4 29 31 A A S S- 0 0 27 -22,-0.2 2,-1.0 -3,-0.1 308,-0.1 -0.946 81.9-133.9-124.0 142.9 5.0 33.2 28.8 30 32 A N + 0 0 6 -2,-0.4 2,-0.4 307,-0.1 266,-0.1 -0.617 44.1 150.7-106.4 77.0 8.6 33.8 29.7 31 33 A I - 0 0 44 -2,-1.0 184,-0.1 186,-0.1 183,-0.1 -0.878 58.2 -96.4-108.6 137.3 8.5 36.3 32.5 32 34 A N > - 0 0 5 182,-2.6 3,-0.5 -2,-0.4 307,-0.1 -0.276 34.8-149.1 -45.3 126.5 11.2 36.6 35.2 33 35 A P T 3 S+ 0 0 22 0, 0.0 -1,-0.2 0, 0.0 307,-0.1 0.464 72.4 95.8 -85.0 0.7 9.6 34.6 38.1 34 36 A L T 3 S- 0 0 70 1,-0.1 2,-0.6 229,-0.1 -2,-0.1 0.355 91.2-114.8 -76.4 6.8 11.1 36.5 41.0 35 37 A G < - 0 0 48 -3,-0.5 -1,-0.1 2,-0.0 -3,-0.0 -0.888 60.2 -31.4 106.5-122.4 8.2 38.9 41.6 36 38 A M - 0 0 83 -2,-0.6 181,-0.1 -3,-0.1 182,-0.1 -0.997 65.1 -99.9-141.3 139.7 8.6 42.6 40.9 37 39 A P > - 0 0 0 0, 0.0 4,-2.3 0, 0.0 3,-0.2 -0.292 25.2-133.9 -58.7 140.5 11.7 44.8 41.2 38 40 A V H > S+ 0 0 116 1,-0.2 4,-1.9 2,-0.2 5,-0.3 0.870 106.3 59.2 -63.8 -35.5 11.7 46.9 44.4 39 41 A S H > S+ 0 0 30 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.872 110.1 43.6 -61.5 -35.0 12.7 50.0 42.4 40 42 A V H > S+ 0 0 0 -3,-0.2 4,-2.6 2,-0.2 5,-0.3 0.932 110.7 50.2 -78.0 -47.3 9.5 49.6 40.4 41 43 A K H X S+ 0 0 121 -4,-2.3 4,-2.3 1,-0.2 5,-0.2 0.946 114.1 45.3 -58.2 -48.3 7.0 48.8 43.1 42 44 A R H X S+ 0 0 46 -4,-1.9 4,-2.9 2,-0.2 5,-0.2 0.938 112.6 50.6 -60.2 -50.4 8.0 51.7 45.3 43 45 A A H X S+ 0 0 13 -4,-1.4 4,-1.0 -5,-0.3 -1,-0.2 0.927 112.3 46.3 -55.7 -49.5 8.1 54.2 42.4 44 46 A L H < S+ 0 0 28 -4,-2.6 3,-0.5 1,-0.2 4,-0.3 0.929 115.2 46.3 -61.6 -45.7 4.6 53.3 41.1 45 47 A I H >< S+ 0 0 117 -4,-2.3 3,-0.8 -5,-0.3 -2,-0.2 0.940 114.7 45.7 -63.7 -45.6 3.1 53.4 44.6 46 48 A D H 3< S+ 0 0 123 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.581 122.6 35.6 -76.8 -7.1 4.7 56.7 45.6 47 49 A N T >< S+ 0 0 78 -4,-1.0 3,-2.4 -3,-0.5 -1,-0.2 0.108 71.6 126.3-133.0 23.6 3.8 58.4 42.3 48 50 A L G X + 0 0 88 -3,-0.8 3,-2.0 -4,-0.3 4,-0.1 0.816 65.8 69.2 -52.9 -34.1 0.5 57.0 41.3 49 51 A D G > S+ 0 0 117 1,-0.3 3,-2.1 -4,-0.2 -1,-0.3 0.632 75.4 84.7 -64.5 -11.1 -1.1 60.5 41.0 50 52 A C G X S+ 0 0 25 -3,-2.4 3,-1.6 1,-0.3 -1,-0.3 0.719 73.2 75.0 -65.3 -14.1 1.1 61.1 37.9 51 53 A I G < S+ 0 0 102 -3,-2.0 -1,-0.3 1,-0.3 -2,-0.2 0.645 76.9 77.0 -72.0 -9.2 -1.6 59.3 35.9 52 54 A E G < S+ 0 0 153 -3,-2.1 2,-0.3 -4,-0.1 -1,-0.3 0.558 96.5 51.6 -74.9 -6.3 -3.7 62.5 36.3 53 55 A R S < S- 0 0 170 -3,-1.6 195,-0.2 -4,-0.1 3,-0.1 -0.923 94.5-100.0-127.6 154.8 -1.6 64.1 33.6 54 56 A Y - 0 0 170 -2,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.364 47.0-106.2 -64.7 150.3 -0.6 63.1 30.1 55 57 A P - 0 0 27 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.396 50.9 -80.8 -71.5 160.9 3.0 61.7 29.9 56 58 A D > - 0 0 82 1,-0.2 3,-1.6 -3,-0.1 188,-0.1 -0.513 41.1-139.4 -60.7 119.4 5.5 64.1 28.4 57 59 A A T 3 S+ 0 0 59 -2,-0.4 187,-0.3 1,-0.3 -1,-0.2 0.767 103.1 45.9 -57.3 -24.7 4.9 63.6 24.6 58 60 A D T 3 S- 0 0 125 185,-0.1 -1,-0.3 186,-0.1 5,-0.1 0.552 96.1-144.4 -93.9 -10.9 8.6 63.7 24.0 59 61 A Y <> + 0 0 19 -3,-1.6 4,-2.7 1,-0.1 5,-0.3 0.859 35.2 164.9 48.8 44.7 9.5 61.4 26.9 60 62 A F H > + 0 0 110 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.933 69.3 44.7 -57.8 -51.1 12.6 63.3 27.6 61 63 A H H > S+ 0 0 122 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.912 114.6 48.7 -62.0 -41.6 13.3 61.9 31.0 62 64 A L H > S+ 0 0 1 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.948 113.8 45.2 -65.1 -46.1 12.6 58.3 30.0 63 65 A H H X S+ 0 0 8 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.864 111.4 53.3 -66.6 -34.9 14.8 58.5 27.0 64 66 A Q H X S+ 0 0 68 -4,-2.4 4,-2.9 -5,-0.3 5,-0.2 0.903 109.3 50.2 -65.1 -39.2 17.6 60.2 28.9 65 67 A A H X S+ 0 0 11 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.929 114.0 43.0 -65.3 -43.9 17.5 57.4 31.5 66 68 A L H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.904 115.8 50.5 -68.2 -39.3 17.7 54.7 28.8 67 69 A A H X>S+ 0 0 4 -4,-2.7 5,-1.9 2,-0.2 4,-1.3 0.900 108.7 49.9 -65.8 -41.3 20.4 56.7 27.0 68 70 A R H <5S+ 0 0 141 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.910 108.0 55.8 -65.6 -36.4 22.5 57.1 30.1 69 71 A H H <5S+ 0 0 87 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.916 118.7 31.2 -60.9 -43.2 22.2 53.4 30.8 70 72 A H H <5S- 0 0 37 -4,-1.8 -1,-0.2 2,-0.1 -2,-0.2 0.496 106.3-126.6 -93.2 -4.5 23.6 52.6 27.3 71 73 A Q T <5 + 0 0 159 -4,-1.3 -3,-0.2 1,-0.2 -4,-0.1 0.930 68.2 122.0 55.3 49.9 25.9 55.7 27.2 72 74 A V S - 0 0 63 0, 0.0 3,-1.8 0, 0.0 4,-0.2 -0.384 37.6-125.9 -64.2 146.4 22.7 60.0 22.8 74 76 A A G > S+ 0 0 35 1,-0.3 3,-1.8 2,-0.2 -8,-0.1 0.776 106.7 68.9 -65.1 -27.1 19.1 60.2 23.8 75 77 A S G 3 S+ 0 0 61 1,-0.3 -1,-0.3 3,-0.0 -11,-0.0 0.578 88.8 65.9 -69.1 -9.7 18.0 60.9 20.2 76 78 A W G < S+ 0 0 36 -3,-1.8 152,-2.0 -13,-0.1 2,-0.4 0.525 95.1 74.4 -85.9 -3.9 19.1 57.3 19.3 77 79 A I E < +B 227 0B 0 -3,-1.8 2,-0.4 150,-0.2 150,-0.2 -0.894 48.6 176.5-120.7 136.4 16.3 56.0 21.5 78 80 A L E -B 226 0B 11 148,-2.2 148,-2.1 -2,-0.4 2,-0.1 -0.924 22.0-146.7-133.0 110.3 12.5 55.7 21.1 79 81 A A E -B 225 0B 2 -2,-0.4 2,-0.3 146,-0.3 146,-0.3 -0.400 18.2-161.0 -72.1 151.3 10.6 53.9 23.9 80 82 A G E -B 224 0B 0 144,-2.9 2,-2.2 -2,-0.1 144,-2.1 -0.903 35.8 -95.8-132.9 163.5 7.5 52.0 22.9 81 83 A N S S- 0 0 59 -2,-0.3 4,-0.4 142,-0.2 142,-0.3 -0.514 108.8 -26.3 -75.6 76.7 4.3 50.5 24.5 82 84 A G S >> S- 0 0 0 -2,-2.2 4,-1.3 140,-0.3 3,-0.8 0.050 83.5 -88.0 84.8 153.2 6.1 47.2 24.8 83 85 A E H 3> S+ 0 0 10 140,-0.4 4,-2.1 1,-0.2 5,-0.2 0.800 127.9 73.1 -61.0 -23.7 8.9 46.2 22.5 84 86 A T H 3> S+ 0 0 47 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.915 95.7 48.1 -57.3 -40.4 5.9 44.9 20.4 85 87 A E H <> S+ 0 0 32 -3,-0.8 4,-3.2 -4,-0.4 -1,-0.2 0.929 106.7 56.3 -65.9 -40.3 5.1 48.5 19.6 86 88 A S H X S+ 0 0 0 -4,-1.3 4,-2.7 1,-0.2 -1,-0.2 0.850 104.5 54.1 -58.0 -36.1 8.8 49.1 18.7 87 89 A I H X S+ 0 0 2 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.935 111.7 43.2 -62.2 -48.1 8.5 46.3 16.1 88 90 A F H X S+ 0 0 50 -4,-1.8 4,-2.6 2,-0.2 5,-0.2 0.910 114.3 52.2 -66.4 -37.8 5.5 47.9 14.5 89 91 A T H X S+ 0 0 6 -4,-3.2 4,-2.8 2,-0.2 5,-0.2 0.941 110.5 45.6 -63.5 -45.5 7.2 51.3 14.6 90 92 A V H X S+ 0 0 0 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.924 114.2 49.3 -68.6 -37.0 10.4 50.1 12.9 91 93 A A H X S+ 0 0 1 -4,-2.2 4,-1.7 -5,-0.2 -1,-0.2 0.947 116.6 41.0 -64.7 -46.0 8.5 48.2 10.2 92 94 A S H < S+ 0 0 36 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.868 116.1 49.7 -71.7 -34.3 6.2 51.2 9.4 93 95 A G H < S+ 0 0 5 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.773 116.1 41.5 -75.1 -29.2 9.0 53.7 9.7 94 96 A L H < S- 0 0 25 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.704 87.3-163.3 -87.6 -22.9 11.3 51.8 7.4 95 97 A K < - 0 0 58 -4,-1.7 -3,-0.1 -5,-0.2 -4,-0.1 0.889 15.9-159.1 41.2 54.7 8.4 50.9 5.0 96 98 A P - 0 0 4 0, 0.0 3,-0.2 0, 0.0 -1,-0.1 -0.307 22.7-159.5 -64.3 146.2 10.4 48.1 3.4 97 99 A R S S+ 0 0 152 1,-0.4 22,-2.7 21,-0.2 2,-0.4 0.759 87.3 19.0 -88.0 -36.2 9.4 46.9 -0.1 98 100 A R E S+c 119 0B 66 20,-0.2 48,-2.6 46,-0.1 49,-1.1 -0.998 76.0 171.0-136.9 131.3 11.2 43.6 0.4 99 101 A A E -cd 120 147B 0 20,-2.5 22,-3.0 -2,-0.4 2,-0.4 -0.982 22.1-140.6-142.1 153.2 12.2 42.1 3.8 100 102 A M E -cd 121 148B 10 47,-2.4 49,-2.4 -2,-0.3 2,-0.3 -0.949 16.4-176.1-118.1 134.0 13.6 38.9 5.1 101 103 A I E -c 122 0B 20 20,-2.4 22,-2.8 -2,-0.4 2,-0.5 -0.830 23.5-125.3-118.0 164.2 12.6 37.2 8.4 102 104 A V E -c 123 0B 14 47,-0.4 22,-0.2 -2,-0.3 20,-0.1 -0.947 35.6-111.2-115.8 126.9 14.0 34.0 9.9 103 105 A T E S+c 124 0B 6 20,-2.4 22,-3.2 -2,-0.5 2,-0.1 -0.873 93.7 39.6-116.4 144.3 11.7 31.2 10.8 104 106 A P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 53,-0.2 0.496 94.0 124.1 -73.0 148.2 10.8 30.0 13.3 105 107 A G - 0 0 10 -2,-0.1 -2,-0.1 222,-0.1 49,-0.0 -0.960 66.4 -51.5-161.8 173.5 10.5 33.4 14.9 106 108 A F > - 0 0 33 -2,-0.3 3,-1.2 49,-0.2 4,-0.5 -0.294 48.8-134.2 -57.2 132.1 8.1 35.7 16.8 107 109 A A T 3> S+ 0 0 51 1,-0.2 4,-1.7 -102,-0.2 3,-0.4 0.735 92.1 73.2 -64.6 -25.9 4.9 36.2 14.7 108 110 A E H 3> S+ 0 0 18 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.726 83.7 65.8 -68.9 -18.9 4.7 39.9 15.0 109 111 A Y H <> S+ 0 0 9 -3,-1.2 4,-2.4 1,-0.2 -1,-0.2 0.967 107.6 42.2 -62.8 -49.5 7.5 40.7 12.6 110 112 A G H > S+ 0 0 18 -4,-0.5 4,-2.5 -3,-0.4 -2,-0.2 0.875 114.0 51.9 -63.6 -38.5 5.5 39.2 9.7 111 113 A R H X S+ 0 0 121 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.936 111.5 46.2 -65.8 -42.6 2.3 40.8 10.9 112 114 A A H X S+ 0 0 4 -4,-2.6 4,-1.3 1,-0.2 -2,-0.2 0.915 113.9 48.3 -64.7 -42.9 3.9 44.3 11.1 113 115 A L H <>S+ 0 0 0 -4,-2.4 5,-2.2 -5,-0.2 3,-0.2 0.903 110.8 50.6 -65.6 -40.2 5.6 43.9 7.7 114 116 A A H ><5S+ 0 0 61 -4,-2.5 3,-1.7 1,-0.2 -1,-0.2 0.901 106.8 54.5 -64.5 -40.5 2.3 42.7 6.1 115 117 A Q H 3<5S+ 0 0 127 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.820 108.6 49.7 -63.1 -27.5 0.5 45.7 7.5 116 118 A S T 3<5S- 0 0 45 -4,-1.3 -1,-0.3 -3,-0.2 -2,-0.2 0.379 120.2-111.4 -91.4 3.7 3.1 47.9 5.8 117 119 A G T < 5 + 0 0 65 -3,-1.7 -3,-0.2 1,-0.2 -2,-0.1 0.582 59.7 160.2 80.1 15.5 2.6 46.1 2.5 118 120 A C < - 0 0 14 -5,-2.2 2,-0.6 1,-0.1 -20,-0.2 -0.345 46.1-122.0 -75.6 145.8 6.0 44.4 2.3 119 121 A E E -c 98 0B 94 -22,-2.7 -20,-2.5 -2,-0.1 2,-0.5 -0.788 37.5-148.4 -80.8 122.3 7.1 41.4 0.2 120 122 A I E -c 99 0B 62 -2,-0.6 2,-0.4 -22,-0.2 -20,-0.2 -0.849 15.7-170.1-105.1 124.8 8.3 38.9 2.9 121 123 A R E -c 100 0B 63 -22,-3.0 -20,-2.4 -2,-0.5 2,-0.5 -0.882 13.8-143.5-108.7 140.9 11.0 36.4 2.2 122 124 A R E -c 101 0B 127 -2,-0.4 2,-0.7 -22,-0.2 -20,-0.2 -0.923 8.1-158.2-111.6 130.1 11.8 33.7 4.7 123 125 A W E -c 102 0B 53 -22,-2.8 -20,-2.4 -2,-0.5 2,-0.6 -0.938 26.7-141.1 -99.0 119.0 15.1 32.3 5.6 124 126 A S E -c 103 0B 62 -2,-0.7 2,-0.1 -22,-0.2 204,-0.1 -0.731 3.3-143.8 -89.8 119.0 14.4 28.8 7.1 125 127 A L - 0 0 13 -22,-3.2 2,-0.4 -2,-0.6 8,-0.1 -0.432 26.0-129.5 -68.8 156.5 16.4 27.6 10.1 126 128 A R > > - 0 0 141 6,-0.5 5,-2.4 1,-0.1 3,-1.6 -0.919 15.6-142.9-119.9 139.6 17.0 23.9 9.9 127 129 A E G > 5S+ 0 0 88 -2,-0.4 3,-2.1 1,-0.3 -1,-0.1 0.845 105.0 64.9 -60.2 -32.9 16.6 21.1 12.3 128 130 A A G 3 5S+ 0 0 88 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.685 102.0 48.6 -63.9 -18.8 19.8 19.6 10.9 129 131 A D G X 5S- 0 0 49 -3,-1.6 3,-1.6 3,-0.1 -1,-0.3 0.140 124.0-104.8-102.6 15.0 21.6 22.7 12.3 130 132 A G T < 5 - 0 0 30 -3,-2.1 -3,-0.2 1,-0.3 -2,-0.1 0.737 68.3 -71.5 66.6 20.4 20.0 22.3 15.7 131 133 A W T 3 - 0 0 39 -2,-0.3 3,-1.8 27,-0.1 4,-0.2 -0.728 37.5 -99.5-122.1 172.6 24.3 29.7 10.2 135 137 A D T > S+ 0 0 113 1,-0.3 3,-1.4 -2,-0.2 4,-0.5 0.556 103.7 88.3 -68.9 -4.8 26.4 31.4 7.7 136 138 A A T 3> S+ 0 0 51 1,-0.3 4,-0.6 2,-0.2 3,-0.5 0.782 77.3 68.4 -62.6 -24.6 24.4 29.9 4.9 137 139 A I H X> S+ 0 0 0 -3,-1.8 3,-0.9 1,-0.2 4,-0.6 0.813 82.3 74.1 -65.3 -25.1 22.1 33.0 5.3 138 140 A L H X4 S+ 0 0 40 -3,-1.4 3,-1.5 1,-0.3 -1,-0.2 0.906 94.4 48.9 -55.8 -45.4 24.9 35.3 3.9 139 141 A E H 34 S+ 0 0 86 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.2 0.743 104.7 61.5 -66.0 -23.3 24.5 34.1 0.3 140 142 A A H << S+ 0 0 28 -3,-0.9 2,-0.6 -4,-0.6 -1,-0.3 0.565 81.4 97.4 -79.5 -10.0 20.7 34.7 0.6 141 143 A L << - 0 0 1 -3,-1.5 7,-0.0 -4,-0.6 37,-0.0 -0.724 57.6-178.5 -85.4 122.5 21.2 38.4 1.3 142 144 A T > - 0 0 48 -2,-0.6 3,-2.0 1,-0.1 -2,-0.1 -0.835 40.5-110.5-121.5 157.9 20.7 40.3 -1.9 143 145 A P T 3 S+ 0 0 96 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.774 112.3 64.2 -57.1 -27.9 20.9 43.9 -2.9 144 146 A D T 3 S+ 0 0 69 34,-0.0 2,-0.3 -47,-0.0 -46,-0.1 0.587 79.4 103.2 -77.5 -5.4 17.1 44.1 -3.4 145 147 A L < - 0 0 1 -3,-2.0 -46,-0.2 1,-0.1 3,-0.1 -0.545 48.4-172.2 -76.3 136.7 16.4 43.5 0.3 146 148 A D + 0 0 27 -48,-2.6 33,-2.7 1,-0.3 2,-0.3 0.765 68.8 10.6 -94.1 -33.2 15.5 46.5 2.4 147 149 A C E -de 99 179B 1 -49,-1.1 -47,-2.4 31,-0.2 2,-0.4 -0.996 51.5-160.7-148.4 154.0 15.5 44.8 5.8 148 150 A L E -de 100 180B 0 31,-2.5 33,-3.1 -2,-0.3 2,-0.5 -0.998 14.6-155.1-133.1 127.9 16.6 41.7 7.6 149 151 A F E + e 0 181B 4 -49,-2.4 -47,-0.4 -2,-0.4 2,-0.3 -0.933 16.5 174.1-108.6 121.8 15.1 40.8 11.0 150 152 A L E - e 0 182B 4 31,-2.8 33,-3.0 -2,-0.5 2,-0.5 -0.942 22.3-142.7-123.4 148.0 17.1 38.5 13.4 151 153 A C E - e 0 183B 13 -2,-0.3 3,-0.2 31,-0.2 33,-0.2 -0.955 16.4-142.1-115.0 126.8 16.2 37.6 16.9 152 154 A T S S+ 0 0 1 31,-2.6 35,-0.3 -2,-0.5 8,-0.2 -0.870 97.5 15.3-135.4 97.3 19.2 37.3 19.3 153 155 A P S S- 0 0 1 0, 0.0 -1,-0.4 0, 0.0 33,-0.3 0.563 111.8-121.5 -76.8 161.0 18.6 35.0 21.1 154 156 A N > - 0 0 15 5,-2.7 4,-2.6 -3,-0.2 -49,-0.1 -0.337 20.1-112.2 -75.3 148.2 15.8 33.5 19.0 155 157 A N T 4 S+ 0 0 15 1,-0.2 -49,-0.2 2,-0.2 -1,-0.0 -0.992 99.5 11.4-112.0 126.0 12.2 32.9 20.2 156 158 A P T 4 S+ 0 0 0 0, 0.0 -1,-0.2 0, 0.0 -51,-0.1 -0.957 128.4 50.8 -94.7 -0.9 11.3 30.0 20.4 157 159 A T T 4 S- 0 0 1 -53,-0.2 142,-0.5 -26,-0.1 -2,-0.2 0.739 82.7-142.4 -73.0 -25.1 14.7 28.2 20.2 158 160 A G < + 0 0 0 -4,-2.6 136,-2.7 1,-0.2 2,-0.3 0.434 51.9 140.4 76.7 1.7 16.5 30.2 22.8 159 161 A L - 0 0 13 134,-0.2 -5,-2.7 -28,-0.1 -1,-0.2 -0.571 44.9-146.8 -86.2 136.6 19.7 30.1 20.6 160 162 A L - 0 0 24 -2,-0.3 -8,-0.1 -7,-0.3 3,-0.1 -0.880 22.8-124.2 -98.3 122.7 22.0 33.1 20.3 161 163 A P - 0 0 7 0, 0.0 -27,-0.1 0, 0.0 5,-0.1 -0.370 42.3 -88.9 -62.3 149.9 23.7 33.3 16.9 162 164 A E > - 0 0 133 -29,-0.4 4,-2.4 1,-0.1 3,-0.4 -0.257 32.4-124.9 -58.6 142.9 27.5 33.4 17.1 163 165 A R H > S+ 0 0 88 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.920 109.6 51.8 -59.2 -45.8 28.9 36.9 17.5 164 166 A P H > S+ 0 0 98 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.851 109.7 51.6 -62.8 -28.1 31.3 36.6 14.5 165 167 A L H > S+ 0 0 15 -3,-0.4 4,-2.8 2,-0.2 -2,-0.2 0.936 109.7 48.5 -72.0 -43.1 28.3 35.5 12.4 166 168 A L H X S+ 0 0 8 -4,-2.4 4,-3.0 1,-0.2 5,-0.2 0.913 111.8 50.6 -62.9 -37.6 26.2 38.5 13.5 167 169 A Q H X S+ 0 0 65 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.912 110.1 49.3 -65.2 -41.7 29.2 40.7 12.7 168 170 A A H X S+ 0 0 38 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.909 112.7 47.8 -64.2 -41.1 29.5 39.1 9.2 169 171 A I H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 5,-0.2 0.940 110.8 50.8 -64.7 -45.6 25.8 39.6 8.6 170 172 A A H X S+ 0 0 0 -4,-3.0 4,-2.1 1,-0.2 -2,-0.2 0.917 112.0 48.0 -58.1 -42.1 26.0 43.2 9.8 171 173 A D H X S+ 0 0 74 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.897 111.7 48.5 -68.6 -38.3 28.9 43.9 7.5 172 174 A R H X S+ 0 0 82 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.916 111.2 50.7 -67.3 -41.7 27.2 42.3 4.5 173 175 A C H X>S+ 0 0 0 -4,-2.9 5,-3.0 2,-0.2 4,-0.5 0.890 108.2 53.4 -61.4 -38.2 24.1 44.3 5.2 174 176 A K H ><5S+ 0 0 101 -4,-2.1 3,-0.9 -5,-0.2 -2,-0.2 0.946 111.2 45.9 -60.4 -46.3 26.1 47.5 5.4 175 177 A S H 3<5S+ 0 0 93 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.847 118.1 41.8 -65.4 -35.9 27.6 46.7 1.9 176 178 A L H 3<5S- 0 0 30 -4,-2.3 -1,-0.2 -5,-0.1 -2,-0.2 0.340 111.3-117.0 -94.9 4.7 24.3 45.9 0.4 177 179 A N T <<5 + 0 0 136 -3,-0.9 2,-0.5 -4,-0.5 -3,-0.2 0.929 61.6 151.3 59.5 47.6 22.4 48.7 2.1 178 180 A I < - 0 0 0 -5,-3.0 2,-0.4 -8,-0.1 -31,-0.2 -0.933 47.1-126.7-109.4 130.5 20.1 46.4 4.1 179 181 A N E -e 147 0B 41 -33,-2.7 -31,-2.5 -2,-0.5 2,-0.6 -0.651 22.7-150.2 -75.4 131.5 18.7 47.6 7.4 180 182 A L E -ef 148 206B 0 25,-2.4 27,-3.0 -2,-0.4 2,-0.6 -0.924 9.2-165.5-106.9 117.7 19.5 44.9 10.1 181 183 A I E -ef 149 207B 1 -33,-3.1 -31,-2.8 -2,-0.6 2,-0.6 -0.925 3.1-164.2-108.0 118.6 17.0 44.7 12.9 182 184 A L E -ef 150 208B 0 25,-3.2 27,-2.8 -2,-0.6 2,-1.0 -0.916 10.1-149.8-108.1 115.7 18.2 42.8 15.9 183 185 A D E +ef 151 209B 9 -33,-3.0 -31,-2.6 -2,-0.6 3,-0.3 -0.748 22.9 169.8 -85.6 100.4 15.6 41.7 18.4 184 186 A E > + 0 0 0 25,-2.4 3,-1.5 -2,-1.0 4,-0.5 -0.020 28.4 132.2-100.0 28.3 17.4 41.7 21.8 185 187 A A T 3 S+ 0 0 7 1,-0.3 30,-0.3 25,-0.2 29,-0.2 0.805 81.9 30.8 -48.7 -36.2 14.2 41.2 23.9 186 188 A F T > S+ 0 0 6 -3,-0.3 3,-1.5 -33,-0.3 -1,-0.3 0.373 88.3 101.0-106.7 6.0 15.9 38.4 25.9 187 189 A I G X + 0 0 7 -3,-1.5 3,-2.0 -35,-0.3 6,-0.3 0.757 67.3 73.3 -68.5 -22.0 19.5 39.5 25.8 188 190 A D G 3 S+ 0 0 20 -4,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.778 89.8 61.9 -59.4 -28.4 19.4 40.9 29.4 189 191 A F G < S+ 0 0 4 -3,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.579 91.3 69.5 -74.6 -10.3 19.3 37.3 30.7 190 192 A I S X S- 0 0 5 -3,-2.0 3,-2.1 -4,-0.2 -1,-0.2 -0.821 70.9-168.8-110.9 86.5 22.7 36.5 29.2 191 193 A P T 3 S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.749 80.3 51.7 -45.9 -39.2 25.1 38.7 31.4 192 194 A H T 3 S+ 0 0 175 2,-0.0 2,-0.6 0, 0.0 -2,-0.0 0.385 91.5 93.4 -86.6 7.4 28.2 38.4 29.4 193 195 A E < - 0 0 58 -3,-2.1 -3,-0.1 -6,-0.3 0, 0.0 -0.881 47.8-177.5-104.0 122.2 26.5 39.4 26.1 194 196 A T - 0 0 88 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.710 26.1-154.4 -88.5 -19.5 26.6 43.1 25.3 195 197 A G - 0 0 4 1,-0.2 -1,-0.2 2,-0.1 13,-0.0 -0.304 40.6 -61.5 73.5-167.4 24.5 42.9 22.1 196 198 A F S > S+ 0 0 3 1,-0.2 3,-1.9 2,-0.1 4,-0.3 0.491 104.2 96.0-100.0 -4.5 24.9 45.5 19.4 197 199 A I G > S+ 0 0 3 -3,-0.4 3,-1.5 1,-0.3 4,-0.3 0.900 83.3 58.0 -54.9 -36.6 24.1 48.8 21.0 198 200 A P G 3 S+ 0 0 99 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.637 107.5 49.6 -67.6 -11.6 27.8 49.5 21.7 199 201 A A G < S+ 0 0 31 -3,-1.9 3,-0.5 1,-0.1 -2,-0.2 0.308 81.4 93.9-107.8 8.0 28.4 49.2 18.0 200 202 A L X + 0 0 0 -3,-1.5 3,-2.1 -4,-0.3 29,-0.3 0.777 63.1 80.8 -73.6 -24.7 25.8 51.5 16.6 201 203 A K T 3 S+ 0 0 76 -4,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.880 106.3 28.8 -50.5 -44.6 27.9 54.7 16.4 202 204 A D T 3 S+ 0 0 67 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.151 116.4 65.2-104.8 23.9 29.4 53.6 13.1 203 205 A N X + 0 0 20 -3,-2.1 3,-1.9 3,-0.1 26,-0.3 -0.534 47.6 166.9-145.2 75.0 26.6 51.5 11.8 204 206 A P T 3 S+ 0 0 59 0, 0.0 26,-0.3 0, 0.0 -1,-0.1 0.541 75.3 68.7 -67.5 -6.7 23.4 53.5 11.1 205 207 A H T 3 S+ 0 0 21 24,-0.1 -25,-2.4 -26,-0.1 2,-0.4 0.507 84.0 88.6 -87.7 -6.5 21.9 50.6 9.2 206 208 A I E < -f 180 0B 0 -3,-1.9 2,-0.4 -27,-0.2 23,-0.4 -0.788 55.6-171.0 -99.4 136.2 21.5 48.6 12.5 207 209 A W E -f 181 0B 0 -27,-3.0 -25,-3.2 -2,-0.4 2,-0.5 -0.991 6.4-157.9-124.9 128.6 18.4 48.8 14.7 208 210 A V E -fG 182 227B 0 19,-2.5 19,-2.3 -2,-0.4 2,-0.4 -0.935 1.6-157.2-112.5 132.4 18.2 47.2 18.1 209 211 A L E -fG 183 226B 1 -27,-2.8 -25,-2.4 -2,-0.5 2,-0.3 -0.890 15.0-176.8-105.3 133.9 15.0 46.3 19.8 210 212 A R E - G 0 225B 17 15,-2.8 15,-2.4 -2,-0.4 2,-0.4 -0.938 10.3-161.4-130.0 153.7 14.9 46.0 23.6 211 213 A S E - G 0 224B 3 -27,-0.4 4,-0.3 -2,-0.3 13,-0.3 -0.991 15.5-171.2-133.3 142.5 12.2 45.0 26.1 212 214 A L S > S+ 0 0 2 11,-2.5 4,-1.9 -2,-0.4 6,-0.4 0.466 76.0 81.5-102.6 -5.5 12.0 45.6 29.9 213 215 A T T 4>S+ 0 0 4 10,-0.8 5,-1.1 2,-0.2 4,-0.5 0.898 91.5 41.3 -73.3 -39.0 9.0 43.3 30.3 214 216 A K T 45S+ 0 0 55 -29,-0.2 -182,-2.6 3,-0.2 3,-0.5 0.959 122.3 38.0 -70.9 -51.8 10.6 39.9 30.4 215 217 A F T 45S+ 0 0 1 -30,-0.3 -2,-0.2 -4,-0.3 -1,-0.1 0.849 125.1 36.3 -71.8 -36.3 13.6 40.7 32.6 216 218 A Y T <5S- 0 0 4 -4,-1.9 -1,-0.2 -180,-0.0 -2,-0.2 0.306 105.1-121.9-100.7 6.4 11.9 43.2 35.0 217 219 A A T 5S+ 0 0 17 -3,-0.5 -3,-0.2 -4,-0.5 -4,-0.2 0.887 73.8 123.4 55.3 46.4 8.5 41.4 35.2 218 220 A I >>< + 0 0 10 -5,-1.1 3,-1.7 -6,-0.4 4,-1.3 -0.093 13.9 133.4-125.2 39.3 6.5 44.3 33.9 219 221 A P T 34 S+ 0 0 46 0, 0.0 -1,-0.1 0, 0.0 -6,-0.1 0.795 74.1 58.1 -60.2 -27.0 4.6 42.8 30.9 220 222 A G T 34 S+ 0 0 73 1,-0.2 -2,-0.1 -3,-0.1 -7,-0.0 0.693 104.5 50.9 -75.3 -18.2 1.4 44.3 32.1 221 223 A L T <4 S- 0 0 31 -3,-1.7 26,-0.3 28,-0.1 29,-0.2 0.795 103.3-137.2 -85.1 -30.5 2.9 47.8 32.1 222 224 A R < + 0 0 75 -4,-1.3 2,-0.3 1,-0.2 -140,-0.3 0.949 36.2 159.7 72.5 96.7 4.2 47.6 28.5 223 225 A L + 0 0 0 -142,-0.3 -11,-2.5 -5,-0.1 -10,-0.8 -0.904 6.1 129.9-152.9 123.1 7.7 48.9 27.9 224 226 A G E -BG 80 211B 0 -144,-2.1 -144,-2.9 -142,-0.5 2,-0.3 -0.837 30.0-147.7-146.4-174.7 10.3 48.4 25.3 225 227 A Y E -BG 79 210B 2 -15,-2.4 -15,-2.8 -146,-0.3 2,-0.4 -0.995 10.3-132.6-162.4 160.3 12.5 50.6 23.1 226 228 A L E -BG 78 209B 1 -148,-2.1 -148,-2.2 -2,-0.3 2,-0.4 -0.923 19.8-163.8-114.3 140.0 14.2 51.0 19.7 227 229 A V E +BG 77 208B 0 -19,-2.3 -19,-2.5 -2,-0.4 2,-0.3 -0.993 22.0 142.7-130.7 133.1 17.9 52.1 19.3 228 230 A N - 0 0 0 -152,-2.0 -21,-0.1 -2,-0.4 -27,-0.1 -0.952 40.7-140.4-165.7 146.3 19.5 53.4 16.1 229 231 A S + 0 0 15 -23,-0.4 2,-0.7 -26,-0.3 3,-0.1 0.284 66.2 109.2 -98.8 8.8 22.1 56.1 15.2 230 232 A D > - 0 0 58 -26,-0.3 4,-2.4 1,-0.2 5,-0.3 -0.767 55.4-157.0 -86.5 113.1 20.7 57.5 12.0 231 233 A D H > S+ 0 0 117 -2,-0.7 4,-2.1 1,-0.2 -1,-0.2 0.951 88.4 43.2 -56.6 -52.0 19.5 61.0 12.9 232 234 A A H > S+ 0 0 65 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.899 113.8 50.2 -63.2 -41.0 16.9 61.4 10.1 233 235 A A H > S+ 0 0 3 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.923 111.2 48.1 -68.4 -42.5 15.5 57.9 10.4 234 236 A M H X S+ 0 0 2 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.899 108.9 54.4 -65.1 -36.3 15.0 58.1 14.2 235 237 A A H X S+ 0 0 40 -4,-2.1 4,-1.2 -5,-0.3 -1,-0.2 0.928 108.9 48.9 -61.1 -40.1 13.3 61.5 13.7 236 238 A R H X S+ 0 0 98 -4,-2.1 4,-2.3 1,-0.2 3,-0.4 0.903 106.8 56.2 -65.2 -39.6 10.9 59.8 11.3 237 239 A M H X S+ 0 0 0 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.891 102.3 55.8 -59.3 -39.2 10.3 57.0 13.8 238 240 A R H < S+ 0 0 81 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.836 110.6 45.2 -63.6 -31.1 9.2 59.5 16.4 239 241 A R H < S+ 0 0 181 -4,-1.2 -2,-0.2 -3,-0.4 -1,-0.2 0.843 111.0 53.8 -79.0 -32.2 6.6 60.9 13.9 240 242 A Q H < S+ 0 0 96 -4,-2.3 2,-0.2 -5,-0.1 -2,-0.2 0.861 93.3 80.4 -70.3 -37.2 5.4 57.4 12.9 241 243 A Q S < S- 0 0 18 -4,-2.2 3,-0.1 -5,-0.2 4,-0.1 -0.512 94.2-100.7 -75.7 139.4 4.7 56.2 16.4 242 244 A M > - 0 0 127 -2,-0.2 3,-1.1 1,-0.1 -1,-0.1 -0.222 43.2 -97.6 -57.7 142.5 1.4 57.2 17.9 243 245 A P T 3 S+ 0 0 89 0, 0.0 -1,-0.1 0, 0.0 -185,-0.1 -0.277 101.6 5.3 -61.9 144.3 1.4 60.2 20.4 244 246 A W T 3 S+ 0 0 128 -187,-0.3 4,-0.1 1,-0.1 -2,-0.1 0.765 80.7 146.1 56.3 36.0 1.5 59.3 24.2 245 247 A S < + 0 0 16 -3,-1.1 2,-0.6 -188,-0.1 -1,-0.1 0.754 52.4 70.6 -76.6 -22.8 1.8 55.6 23.5 246 248 A V S S- 0 0 0 -167,-0.1 -23,-0.1 -189,-0.1 -165,-0.1 -0.830 86.1-131.3 -94.5 122.7 3.9 54.9 26.5 247 249 A N > - 0 0 57 -2,-0.6 4,-2.1 -26,-0.3 5,-0.2 -0.299 18.1-112.9 -73.7 161.3 1.9 55.3 29.7 248 250 A A H > S+ 0 0 20 1,-0.2 4,-1.9 2,-0.2 -1,-0.1 0.821 114.7 49.1 -62.8 -34.7 3.2 57.3 32.7 249 251 A L H > S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.880 109.0 52.5 -74.4 -38.6 3.7 54.3 35.0 250 252 A A H > S+ 0 0 0 -29,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.920 109.9 50.2 -59.6 -42.3 5.6 52.4 32.4 251 253 A A H X S+ 0 0 9 -4,-2.1 4,-0.8 2,-0.2 -2,-0.2 0.917 108.5 51.8 -64.0 -42.7 7.9 55.4 31.9 252 254 A L H >X S+ 0 0 28 -4,-1.9 3,-0.7 1,-0.2 4,-0.6 0.923 110.7 48.3 -60.6 -42.3 8.4 55.7 35.7 253 255 A A H >X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 3,-1.2 0.925 108.7 53.2 -65.1 -39.9 9.4 52.0 35.8 254 256 A G H 3< S+ 0 0 1 -4,-2.4 4,-0.3 1,-0.2 -1,-0.2 0.645 103.3 60.5 -68.7 -12.0 11.8 52.4 32.9 255 257 A E H << S+ 0 0 68 -4,-0.8 -1,-0.2 -3,-0.7 -2,-0.2 0.637 120.3 20.0 -89.4 -15.8 13.5 55.2 34.7 256 258 A V H X< S+ 0 0 44 -3,-1.2 3,-1.7 -4,-0.6 -2,-0.2 0.644 103.8 77.7-124.0 -28.1 14.5 53.2 37.7 257 259 A A G >< S+ 0 0 0 -4,-2.8 3,-2.1 1,-0.3 -3,-0.1 0.859 88.4 59.9 -56.6 -40.6 14.6 49.5 36.7 258 260 A L G 3 S+ 0 0 17 -4,-0.3 -1,-0.3 1,-0.3 -4,-0.1 0.632 105.6 51.4 -66.5 -10.2 17.9 49.6 34.8 259 261 A Q G < S+ 0 0 86 -3,-1.7 2,-1.5 1,-0.1 -1,-0.3 0.167 77.6 112.0-106.9 12.3 19.6 50.8 38.0 260 262 A D <> + 0 0 17 -3,-2.1 4,-2.2 1,-0.2 3,-0.2 -0.621 36.5 169.6 -91.0 81.0 18.1 48.0 40.2 261 263 A S H > S+ 0 0 58 -2,-1.5 4,-2.8 1,-0.2 5,-0.3 0.859 72.8 58.4 -58.8 -39.9 21.3 46.0 40.9 262 264 A A H > S+ 0 0 75 1,-0.2 4,-2.1 -3,-0.2 -1,-0.2 0.923 109.4 44.0 -58.6 -45.6 19.7 43.8 43.5 263 265 A W H > S+ 0 0 20 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.926 113.7 50.0 -67.1 -44.4 17.1 42.6 40.9 264 266 A Q H X S+ 0 0 27 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.941 112.9 45.8 -59.6 -48.4 19.7 42.1 38.2 265 267 A Q H X S+ 0 0 118 -4,-2.8 4,-2.2 1,-0.2 5,-0.2 0.902 112.8 49.8 -62.4 -42.5 22.1 40.1 40.4 266 268 A A H X S+ 0 0 48 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.876 111.8 50.6 -64.6 -35.4 19.3 37.9 41.8 267 269 A T H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.948 111.2 45.2 -69.6 -47.7 18.1 37.2 38.3 268 270 A W H X S+ 0 0 65 -4,-2.7 4,-2.3 1,-0.2 5,-0.2 0.895 114.0 49.8 -65.2 -36.0 21.5 36.2 36.9 269 271 A H H X S+ 0 0 111 -4,-2.2 4,-2.3 -5,-0.2 5,-0.3 0.945 112.0 48.8 -65.5 -47.3 22.3 34.0 39.9 270 272 A W H X>S+ 0 0 22 -4,-2.1 4,-2.2 -5,-0.2 5,-0.9 0.945 113.6 45.4 -57.3 -49.5 18.9 32.3 39.6 271 273 A L H X5S+ 0 0 17 -4,-2.6 4,-0.9 3,-0.2 5,-0.5 0.901 112.3 50.0 -66.5 -40.0 19.2 31.6 35.9 272 274 A R H X5S+ 0 0 201 -4,-2.3 4,-0.9 -5,-0.2 -1,-0.2 0.934 122.6 32.1 -62.0 -47.7 22.7 30.3 36.0 273 275 A E H X5S+ 0 0 95 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.977 130.8 30.1 -74.4 -62.7 22.0 27.9 38.9 274 276 A E H X5S+ 0 0 27 -4,-2.2 4,-2.7 -5,-0.3 5,-0.3 0.863 116.0 60.2 -69.6 -36.1 18.4 26.9 38.3 275 277 A G H X< S+ 0 0 17 -4,-2.4 3,-1.0 1,-0.2 4,-0.5 0.929 111.0 48.8 -62.1 -45.7 16.8 17.4 34.2 282 284 A L H >< S+ 0 0 0 -4,-2.6 3,-1.4 1,-0.2 -1,-0.2 0.876 103.5 61.8 -61.9 -38.1 14.7 17.8 31.0 283 285 A C H 3< S+ 0 0 45 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.726 95.4 62.9 -61.0 -22.4 17.5 16.3 28.9 284 286 A Q T << S+ 0 0 132 -3,-1.0 -1,-0.3 -4,-0.8 -2,-0.2 0.726 80.0 103.7 -77.0 -19.7 17.3 13.1 30.8 285 287 A L S X S- 0 0 18 -3,-1.4 3,-1.4 -4,-0.5 67,-0.0 -0.389 74.9-117.8 -72.9 135.0 13.7 12.3 29.7 286 288 A P T 3 S+ 0 0 80 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.259 96.0 20.1 -65.5 152.0 13.1 9.8 27.0 287 289 A L T 3 S+ 0 0 40 1,-0.2 16,-3.9 15,-0.1 2,-0.4 0.417 101.9 111.4 71.1 -4.6 11.5 10.9 23.7 288 290 A L E < -H 302 0C 17 -3,-1.4 2,-0.4 14,-0.2 14,-0.2 -0.838 47.5-168.0-105.2 142.1 12.5 14.5 24.5 289 291 A T E -H 301 0C 52 12,-2.0 12,-2.6 -2,-0.4 2,-0.5 -0.993 14.6-163.2-120.3 129.1 15.1 16.6 22.6 290 292 A V E -H 300 0C 16 -2,-0.4 10,-0.2 10,-0.2 -2,-0.0 -0.970 8.7-142.6-119.5 126.9 15.9 19.8 24.5 291 293 A Y - 0 0 15 8,-2.4 2,-2.2 -2,-0.5 8,-0.3 -0.670 28.4-108.1 -88.8 147.4 17.7 22.7 22.7 292 294 A P - 0 0 69 0, 0.0 -1,-0.1 0, 0.0 6,-0.1 -0.427 41.8-167.7 -77.6 76.5 20.2 24.7 24.7 293 295 A G - 0 0 19 -2,-2.2 -134,-0.2 6,-0.1 -135,-0.2 -0.323 15.0-155.3 -64.5 146.3 18.4 27.9 25.3 294 296 A R S S+ 0 0 117 -136,-2.7 -1,-0.1 2,-0.0 -135,-0.1 0.545 72.4 40.6-100.8 -11.0 20.4 30.8 26.6 295 297 A A S S- 0 0 2 2,-0.4 2,-0.6 -137,-0.2 -108,-0.1 -0.157 114.1 -51.9-115.8-147.2 17.7 32.9 28.3 296 298 A N S S+ 0 0 0 -266,-0.1 42,-2.1 -110,-0.1 2,-0.3 -0.154 109.5 54.5 -91.6 40.8 14.7 32.0 30.5 297 299 A Y E - I 0 337C 0 -2,-0.6 -2,-0.4 40,-0.3 2,-0.4 -0.982 61.3-147.1-161.3 161.8 13.0 29.4 28.3 298 300 A L E - I 0 336C 3 38,-2.7 38,-2.4 -2,-0.3 2,-0.4 -0.997 13.1-135.9-138.3 138.0 13.7 26.2 26.5 299 301 A L E - I 0 335C 0 -142,-0.5 -8,-2.4 -2,-0.4 2,-0.4 -0.801 25.8-166.1 -90.3 133.3 12.4 24.6 23.3 300 302 A L E -HI 290 334C 1 34,-3.4 34,-2.5 -2,-0.4 2,-0.5 -0.929 12.4-158.2-121.4 142.8 11.4 20.9 23.5 301 303 A R E -HI 289 333C 49 -12,-2.6 -12,-2.0 -2,-0.4 2,-0.6 -0.991 11.0-152.3-120.9 121.3 10.8 18.4 20.8 302 304 A C E -H 288 0C 0 30,-2.9 -14,-0.2 -2,-0.5 -15,-0.1 -0.846 6.5-149.0 -95.0 121.9 8.7 15.3 21.8 303 305 A E S S+ 0 0 53 -16,-3.9 2,-0.9 -2,-0.6 -1,-0.1 0.842 83.0 72.6 -56.6 -37.8 9.5 12.3 19.6 304 306 A R > - 0 0 131 -17,-0.2 3,-1.6 1,-0.2 -1,-0.1 -0.716 62.0-170.7 -85.8 103.5 6.0 10.9 19.9 305 307 A E T 3 S+ 0 0 63 -2,-0.9 -1,-0.2 1,-0.3 -2,-0.1 0.775 83.3 64.9 -64.7 -25.4 3.7 13.1 17.7 306 308 A D T 3 S+ 0 0 111 -3,-0.1 2,-0.6 2,-0.1 -1,-0.3 0.564 86.4 84.6 -74.5 -8.2 0.7 11.3 19.2 307 309 A I < - 0 0 25 -3,-1.6 2,-1.1 -5,-0.1 3,-0.1 -0.860 66.1-157.0-100.9 118.3 1.4 12.6 22.6 308 310 A D > - 0 0 54 -2,-0.6 4,-2.7 1,-0.2 5,-0.2 -0.763 10.3-177.1 -95.5 95.8 0.1 16.1 23.3 309 311 A L H > S+ 0 0 0 -2,-1.1 4,-2.6 1,-0.2 5,-0.2 0.837 81.1 56.0 -61.9 -34.4 2.3 17.4 26.1 310 312 A Q H > S+ 0 0 12 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.942 111.0 43.3 -64.5 -43.5 0.3 20.6 26.4 311 313 A R H > S+ 0 0 136 2,-0.2 4,-1.2 1,-0.2 -2,-0.2 0.948 115.2 49.6 -65.7 -44.7 -2.9 18.8 26.9 312 314 A R H < S+ 0 0 120 -4,-2.7 4,-0.4 1,-0.2 3,-0.3 0.893 113.7 44.7 -61.9 -42.4 -1.3 16.3 29.4 313 315 A L H ><>S+ 0 0 1 -4,-2.6 5,-2.1 1,-0.2 3,-1.3 0.831 102.8 64.9 -73.6 -30.8 0.3 19.0 31.5 314 316 A L H ><5S+ 0 0 5 -4,-1.9 3,-2.2 1,-0.3 -1,-0.2 0.863 91.7 65.0 -60.1 -31.7 -2.8 21.2 31.5 315 317 A T T 3<5S+ 0 0 96 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.825 102.6 48.4 -56.9 -31.7 -4.5 18.5 33.5 316 318 A Q T < 5S- 0 0 109 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.157 126.6-102.8 -94.9 16.6 -1.9 19.2 36.3 317 319 A R T < 5S+ 0 0 104 -3,-2.2 -292,-3.0 1,-0.2 2,-0.6 0.722 82.1 132.5 68.8 25.7 -2.7 23.0 36.0 318 320 A I E < -a 25 0A 2 -5,-2.1 2,-0.6 -294,-0.2 -1,-0.2 -0.938 41.7-158.8-112.8 119.2 0.5 23.6 34.1 319 321 A L E +a 26 0A 0 -294,-2.2 -292,-3.1 -2,-0.6 2,-0.3 -0.851 14.9 175.3-100.7 122.1 0.3 25.7 30.9 320 322 A I - 0 0 2 -2,-0.6 2,-0.5 -10,-0.2 -292,-0.3 -0.749 34.1-101.9-117.4 167.9 3.0 25.4 28.3 321 323 A R E -J 335 0C 13 14,-2.3 14,-2.3 -294,-0.5 2,-0.5 -0.788 24.4-148.9 -91.4 126.9 3.4 26.9 24.9 322 324 A S E -J 334 0C 28 -2,-0.5 3,-0.5 12,-0.2 12,-0.2 -0.850 4.0-159.7 -89.9 131.2 2.6 24.7 21.8 323 325 A C > + 0 0 0 10,-2.8 3,-1.8 -2,-0.5 6,-0.2 0.200 61.0 110.4 -97.9 17.9 4.9 25.8 19.0 324 326 A A T 3 S+ 0 0 47 9,-0.3 -1,-0.2 1,-0.3 7,-0.1 0.824 72.7 60.5 -60.3 -30.0 2.7 24.3 16.3 325 327 A N T 3 S+ 0 0 80 -3,-0.5 -1,-0.3 -321,-0.1 -2,-0.1 0.376 82.2 96.5 -83.1 8.0 1.8 27.8 15.1 326 328 A Y S X S- 0 0 9 -3,-1.8 3,-2.0 4,-0.1 2,-0.1 -0.828 84.2-115.9 -94.6 129.9 5.4 28.8 14.3 327 329 A P T 3 S+ 0 0 61 0, 0.0 -222,-0.1 0, 0.0 3,-0.1 -0.419 103.9 29.4 -62.3 134.0 6.2 28.3 10.6 328 330 A G T 3 S+ 0 0 45 1,-0.4 2,-0.2 -4,-0.1 -4,-0.1 0.076 109.5 81.4 103.9 -24.6 9.0 25.7 10.4 329 331 A L < - 0 0 15 -3,-2.0 -1,-0.4 -6,-0.2 2,-0.2 -0.653 59.2-158.8-111.5 166.9 7.8 23.8 13.5 330 332 A D > - 0 0 60 -2,-0.2 3,-2.1 -3,-0.1 -7,-0.2 -0.705 44.5 -71.8-133.0-174.3 5.1 21.2 14.1 331 333 A S T 3 S+ 0 0 63 1,-0.3 -7,-0.2 -2,-0.2 -8,-0.1 0.522 118.3 71.9 -64.2 -6.7 3.0 19.8 16.9 332 334 A R T 3 S+ 0 0 63 -9,-0.1 -30,-2.9 -24,-0.1 2,-0.4 0.619 85.3 87.2 -80.7 -12.1 6.0 17.9 18.4 333 335 A Y E < +I 301 0C 1 -3,-2.1 -10,-2.8 -32,-0.2 2,-0.3 -0.745 50.0 166.9 -99.1 135.9 7.5 21.2 19.5 334 336 A Y E -IJ 300 322C 6 -34,-2.5 -34,-3.4 -2,-0.4 2,-0.4 -0.945 21.3-145.3-137.5 156.6 6.8 23.0 22.8 335 337 A R E -IJ 299 321C 11 -14,-2.3 -14,-2.3 -2,-0.3 2,-0.4 -0.986 13.2-171.0-127.9 137.5 8.4 25.8 24.7 336 338 A V E -I 298 0C 0 -38,-2.4 -38,-2.7 -2,-0.4 -308,-0.2 -0.979 20.2-127.2-127.5 139.6 8.6 26.1 28.5 337 339 A A E -I 297 0C 1 -310,-1.6 2,-0.6 -2,-0.4 -40,-0.3 -0.330 24.5-119.4 -71.5 160.8 9.7 29.1 30.6 338 340 A I + 0 0 5 -42,-2.1 2,-0.1 -2,-0.0 -63,-0.1 -0.952 47.4 165.9-101.3 123.4 12.4 28.6 33.2 339 341 A R - 0 0 53 -2,-0.6 -305,-0.1 1,-0.3 -307,-0.0 -0.245 41.1 -40.5-119.0-154.9 10.8 29.5 36.6 340 342 A S > - 0 0 33 -307,-0.1 4,-3.4 -2,-0.1 -1,-0.3 -0.322 60.0-106.5 -69.9 163.4 11.7 29.0 40.3 341 343 A A H > S+ 0 0 55 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.916 121.6 46.7 -55.3 -46.1 13.2 25.7 41.5 342 344 A A H > S+ 0 0 73 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.897 114.0 47.3 -64.2 -40.5 9.9 24.7 43.1 343 345 A Q H > S+ 0 0 51 1,-0.2 4,-1.7 2,-0.2 3,-0.2 0.935 111.6 50.6 -67.6 -42.8 7.8 25.7 40.1 344 346 A N H X S+ 0 0 0 -4,-3.4 4,-2.7 1,-0.2 -1,-0.2 0.873 105.6 57.2 -62.0 -36.2 10.2 23.9 37.8 345 347 A E H X S+ 0 0 93 -4,-2.1 4,-2.9 -5,-0.3 -1,-0.2 0.888 102.9 54.1 -63.1 -38.2 10.0 20.8 39.9 346 348 A R H X S+ 0 0 111 -4,-1.5 4,-1.7 -3,-0.2 -1,-0.2 0.928 110.9 46.0 -62.1 -41.4 6.2 20.7 39.5 347 349 A L H X S+ 0 0 0 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.936 113.2 48.7 -67.5 -43.8 6.6 20.7 35.7 348 350 A L H X S+ 0 0 6 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.924 108.7 53.7 -60.0 -45.4 9.3 18.0 35.8 349 351 A A H X S+ 0 0 42 -4,-2.9 4,-1.1 1,-0.2 -1,-0.2 0.865 111.7 46.5 -57.6 -38.1 7.2 15.8 38.1 350 352 A A H X S+ 0 0 9 -4,-1.7 4,-0.6 -5,-0.2 -2,-0.2 0.915 112.6 47.6 -71.8 -45.3 4.4 16.1 35.5 351 353 A L H >X S+ 0 0 2 -4,-2.6 4,-2.7 1,-0.2 3,-1.0 0.884 107.1 56.7 -63.8 -40.4 6.5 15.4 32.4 352 354 A R H 3< S+ 0 0 105 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.881 104.0 53.9 -59.8 -37.1 8.2 12.4 34.0 353 355 A N H 3< S+ 0 0 143 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.670 113.8 42.6 -71.7 -16.7 4.8 10.8 34.6 354 356 A V H << 0 0 25 -3,-1.0 -2,-0.2 -4,-0.6 -1,-0.2 0.808 360.0 360.0 -94.1 -40.9 3.9 11.3 30.9 355 357 A L < 0 0 50 -4,-2.7 -3,-0.2 0, 0.0 -2,-0.2 0.844 360.0 360.0 -98.3 360.0 7.3 10.2 29.4