==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 19-FEB-13 4JAT . COMPND 2 MOLECULE: ALPHA-PYRONE SYNTHESIS POLYKETIDE SYNTHASE-LIKE P . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR K.GOKULAN,J.C.SACCHETTINI,MYCOBACTERIUM TUBERCULOSIS STRUCTU . 1408 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 48677.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1064 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 85 6.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 211 15.0 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 . 4 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 70 5.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 190 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 443 31.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 23 1.6 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 2 5 10 7 5 1 2 1 1 0 0 4 0 0 0 0 0 0 0 2 2 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 1 9 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 PARALLEL BRIDGES PER LADDER . 6 0 1 3 0 4 4 8 4 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 . 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 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 2 A S 0 0 10 0, 0.0 211,-2.9 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 103.3 14.0 -11.2 52.0 2 3 A V E -AB 197 211A 2 195,-2.8 195,-2.8 209,-0.3 209,-0.2 -0.998 360.0-121.4-130.9 128.9 10.8 -13.2 51.4 3 4 A I E +A 196 0A 0 207,-2.6 193,-0.3 -2,-0.4 3,-0.1 -0.488 30.7 174.8 -68.2 132.5 8.8 -14.8 54.2 4 5 A A E + 0 0 7 191,-3.0 204,-0.4 1,-0.3 2,-0.3 0.602 62.2 15.5-114.0 -20.1 8.5 -18.6 53.7 5 6 A G E -A 195 0A 0 190,-2.0 190,-2.6 85,-0.1 -1,-0.3 -0.982 51.1-177.9-157.9 143.5 6.7 -19.7 56.8 6 7 A V E +A 194 0A 7 -2,-0.3 2,-0.3 188,-0.2 188,-0.2 -0.985 14.5 168.9-142.7 132.8 4.7 -18.3 59.7 7 8 A F E -A 193 0A 71 186,-2.1 186,-2.3 -2,-0.3 2,-0.4 -0.998 18.0-153.5-150.5 138.8 3.3 -20.3 62.6 8 9 A G E -A 192 0A 14 -2,-0.3 2,-0.4 184,-0.2 184,-0.3 -0.894 9.0-163.8-114.4 144.8 1.7 -19.6 66.0 9 10 A A E -A 191 0A 1 182,-2.3 182,-2.4 -2,-0.4 73,-0.1 -0.960 5.3-171.5-128.2 144.6 1.6 -21.8 69.1 10 11 A L - 0 0 54 -2,-0.4 180,-0.1 180,-0.2 4,-0.1 -0.977 28.9-105.4-136.7 148.1 -0.5 -21.7 72.2 11 12 A P - 0 0 3 0, 0.0 41,-0.1 0, 0.0 40,-0.1 -0.370 32.8-122.4 -70.1 152.2 -0.6 -23.4 75.5 12 13 A P S S+ 0 0 116 0, 0.0 2,-0.9 0, 0.0 40,-0.1 0.781 88.0 89.5 -74.6 -29.7 -3.3 -26.0 75.9 13 14 A H E +R 51 0B 71 38,-0.6 38,-2.7 2,-0.0 2,-0.4 -0.594 57.4 177.6 -72.5 105.4 -5.1 -24.4 78.9 14 15 A R E -R 50 0B 90 -2,-0.9 2,-0.4 36,-0.2 36,-0.2 -0.924 4.0-177.1-109.6 138.3 -7.7 -22.0 77.5 15 16 A Y E -R 49 0B 25 34,-2.1 34,-2.1 -2,-0.4 2,-0.0 -0.993 28.6-115.2-133.3 140.0 -10.1 -20.0 79.7 16 17 A S E > -R 48 0B 41 -2,-0.4 4,-2.0 32,-0.2 32,-0.3 -0.346 38.3-109.3 -64.9 155.3 -12.9 -17.7 78.9 17 18 A Q H > S+ 0 0 15 30,-2.3 4,-2.3 1,-0.2 5,-0.1 0.933 116.5 45.6 -57.2 -53.1 -12.3 -14.1 80.1 18 19 A S H > S+ 0 0 71 1,-0.2 4,-3.9 29,-0.2 -1,-0.2 0.797 107.0 60.4 -67.9 -27.8 -14.8 -14.0 82.9 19 20 A E H > S+ 0 0 90 2,-0.2 4,-1.9 1,-0.2 5,-0.3 0.972 107.4 46.1 -53.0 -56.3 -13.6 -17.4 84.1 20 21 A I H X S+ 0 0 11 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.943 116.4 45.1 -52.7 -50.3 -10.2 -15.9 84.6 21 22 A T H X S+ 0 0 6 -4,-2.3 4,-2.2 1,-0.2 5,-0.3 0.919 106.8 58.3 -61.4 -46.9 -11.7 -12.9 86.3 22 23 A D H < S+ 0 0 81 -4,-3.9 -1,-0.2 1,-0.2 -2,-0.2 0.861 115.7 35.7 -54.5 -38.8 -14.0 -15.0 88.5 23 24 A S H >< S+ 0 0 47 -4,-1.9 3,-1.3 -3,-0.2 4,-0.3 0.845 111.7 62.3 -79.5 -37.0 -11.0 -16.8 90.0 24 25 A F H >< S+ 0 0 8 -4,-2.4 3,-2.0 -5,-0.3 -2,-0.2 0.902 96.6 55.1 -60.0 -47.3 -8.7 -13.7 90.0 25 26 A V T 3< S+ 0 0 0 -4,-2.2 -1,-0.3 1,-0.3 8,-0.2 0.673 107.6 54.9 -60.8 -14.4 -10.8 -11.6 92.3 26 27 A E T < S+ 0 0 107 -3,-1.3 -1,-0.3 -5,-0.3 -2,-0.2 0.481 81.6 112.1 -97.8 -5.6 -10.5 -14.5 94.8 27 28 A F S X S- 0 0 18 -3,-2.0 3,-2.1 -4,-0.3 4,-0.5 -0.326 88.3 -75.0 -65.3 150.8 -6.7 -14.7 94.7 28 29 A P T 3 S+ 0 0 95 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.229 117.9 7.2 -49.7 127.3 -4.9 -13.8 97.9 29 30 A G T 3 S+ 0 0 46 -3,-0.1 -2,-0.1 -4,-0.1 -3,-0.1 0.472 109.5 90.1 83.5 3.4 -4.9 -10.0 98.5 30 31 A L X + 0 0 9 -3,-2.1 3,-1.7 -6,-0.1 7,-0.1 0.573 56.8 83.9-108.9 -13.6 -7.2 -9.2 95.5 31 32 A K G > S+ 0 0 107 -4,-0.5 3,-1.0 1,-0.3 4,-0.2 0.728 81.9 65.7 -66.2 -22.5 -10.7 -9.3 96.9 32 33 A E G 3 S+ 0 0 143 1,-0.2 -1,-0.3 2,-0.1 -2,-0.1 0.515 107.8 44.4 -72.7 -1.6 -10.5 -5.7 98.2 33 34 A H G <> + 0 0 53 -3,-1.7 4,-2.1 -8,-0.2 5,-0.3 0.177 69.8 123.5-129.0 17.7 -10.3 -4.9 94.5 34 35 A E H <> S+ 0 0 63 -3,-1.0 4,-2.7 1,-0.2 5,-0.2 0.891 76.3 52.1 -43.7 -47.0 -13.0 -7.0 92.9 35 36 A E H > S+ 0 0 123 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.928 111.0 40.8 -67.3 -49.7 -14.7 -4.0 91.5 36 37 A I H > S+ 0 0 39 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.810 116.8 53.4 -68.4 -25.9 -11.9 -2.3 89.6 37 38 A I H X S+ 0 0 0 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.924 108.2 47.3 -72.8 -46.6 -10.7 -5.7 88.5 38 39 A R H X S+ 0 0 82 -4,-2.7 4,-2.3 -5,-0.3 5,-0.2 0.933 115.1 47.1 -59.8 -47.4 -14.1 -6.7 87.0 39 40 A R H X S+ 0 0 130 -4,-2.2 4,-1.6 1,-0.2 -2,-0.2 0.966 113.6 46.0 -57.3 -58.6 -14.4 -3.4 85.2 40 41 A L H < S+ 0 0 30 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.820 115.4 48.3 -53.5 -36.6 -10.9 -3.4 83.8 41 42 A H H >< S+ 0 0 2 -4,-2.2 3,-0.8 1,-0.2 5,-0.4 0.853 111.7 47.9 -76.2 -35.8 -11.3 -7.1 82.7 42 43 A A H 3< S+ 0 0 88 -4,-2.3 3,-0.4 1,-0.2 -2,-0.2 0.700 110.6 52.7 -77.0 -20.5 -14.7 -6.5 81.0 43 44 A A T 3< S+ 0 0 65 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.353 87.4 83.7 -96.1 6.6 -13.4 -3.4 79.2 44 45 A A S < S- 0 0 4 -3,-0.8 -1,-0.2 2,-0.2 -2,-0.1 0.658 88.3-135.4 -85.0 -17.0 -10.4 -5.2 77.7 45 46 A K + 0 0 112 -3,-0.4 2,-0.4 1,-0.3 263,-0.1 0.801 60.0 133.4 62.1 31.6 -12.3 -6.7 74.8 46 47 A V - 0 0 6 -5,-0.4 -1,-0.3 139,-0.1 259,-0.2 -0.927 37.2-172.3-108.3 135.8 -10.6 -10.1 75.3 47 48 A N - 0 0 114 258,-3.0 -30,-2.3 -2,-0.4 2,-0.3 0.660 68.3 -11.3-103.2 -19.8 -12.9 -13.1 75.2 48 49 A G E -R 16 0B 0 257,-0.8 -1,-0.4 -32,-0.3 2,-0.3 -0.953 57.9-154.6-170.5 160.6 -10.4 -15.7 76.3 49 50 A R E -R 15 0B 11 -34,-2.1 -34,-2.1 -2,-0.3 2,-0.4 -0.987 20.1-122.4-143.6 150.0 -6.7 -16.3 76.9 50 51 A H E -R 14 0B 22 257,-0.4 139,-2.3 139,-0.3 2,-0.4 -0.826 26.3-159.5 -92.5 134.0 -4.4 -19.2 76.9 51 52 A L E -R 13 0B 11 -38,-2.7 -38,-0.6 -2,-0.4 4,-0.1 -0.941 19.3-146.2-116.4 137.5 -2.4 -19.7 80.1 52 53 A V S S+ 0 0 9 -2,-0.4 -1,-0.1 -40,-0.1 -38,-0.1 0.643 89.7 45.9 -76.4 -13.1 0.8 -21.8 80.4 53 54 A L S S- 0 0 4 -40,-0.1 2,-0.1 -42,-0.1 5,-0.1 -0.932 102.8 -89.8-127.4 151.2 -0.3 -22.9 83.8 54 55 A P >> - 0 0 39 0, 0.0 3,-3.0 0, 0.0 4,-0.6 -0.418 40.3-122.8 -57.2 127.3 -3.6 -24.2 85.2 55 56 A L G >4 S+ 0 0 10 1,-0.3 3,-0.7 2,-0.2 -3,-0.0 0.758 110.3 60.8 -41.5 -33.1 -5.6 -21.1 86.4 56 57 A Q G 34 S+ 0 0 135 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.611 96.9 59.3 -77.7 -13.4 -5.8 -22.7 89.9 57 58 A Q G X4 S+ 0 0 77 -3,-3.0 3,-1.1 1,-0.2 -1,-0.2 0.654 81.2 84.4 -90.1 -17.3 -2.0 -22.7 90.3 58 59 A Y G X< S+ 0 0 9 -3,-0.7 3,-1.8 -4,-0.6 -1,-0.2 0.810 79.2 61.6 -61.4 -35.0 -1.3 -19.0 89.9 59 60 A P G 3 S+ 0 0 36 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.814 103.8 52.0 -64.0 -24.4 -1.9 -17.9 93.6 60 61 A S G < S+ 0 0 84 -3,-1.1 2,-1.2 -4,-0.2 3,-0.3 0.404 86.3 91.9 -88.4 2.0 0.9 -20.1 94.7 61 62 A L < + 0 0 5 -3,-1.8 -1,-0.2 -4,-0.2 -3,-0.0 -0.598 43.9 127.3 -97.1 73.1 3.3 -18.5 92.2 62 63 A T + 0 0 107 -2,-1.2 2,-0.6 109,-0.1 -1,-0.2 0.520 45.3 86.3-106.6 -10.9 4.7 -15.8 94.4 63 64 A D > - 0 0 58 -3,-0.3 4,-2.4 1,-0.1 3,-0.3 -0.836 63.3-151.4 -99.0 124.9 8.4 -16.5 94.0 64 65 A F H > S+ 0 0 13 -2,-0.6 4,-2.9 169,-0.4 5,-0.2 0.915 97.4 52.7 -57.8 -46.5 10.2 -14.8 91.1 65 66 A G H > S+ 0 0 9 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.840 109.2 48.9 -57.9 -38.8 12.8 -17.6 90.9 66 67 A D H > S+ 0 0 94 -3,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.961 113.9 47.1 -61.4 -52.1 10.1 -20.3 90.7 67 68 A A H X S+ 0 0 3 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.870 111.9 48.8 -59.9 -42.9 8.3 -18.4 88.0 68 69 A N H X S+ 0 0 4 -4,-2.9 4,-2.2 2,-0.2 -1,-0.2 0.848 109.0 53.8 -67.6 -34.1 11.4 -17.7 85.9 69 70 A E H X S+ 0 0 92 -4,-1.5 4,-1.5 -5,-0.2 -2,-0.2 0.930 110.3 45.9 -66.9 -46.7 12.5 -21.3 86.1 70 71 A I H X S+ 0 0 35 -4,-2.2 4,-2.8 1,-0.2 5,-0.4 0.931 109.4 57.1 -57.7 -47.9 9.1 -22.4 84.8 71 72 A F H X S+ 0 0 1 -4,-2.5 4,-3.2 1,-0.2 5,-0.4 0.927 103.6 52.9 -45.5 -52.5 9.3 -19.7 82.1 72 73 A I H X S+ 0 0 22 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.873 114.7 41.5 -58.0 -38.5 12.6 -21.2 80.9 73 74 A E H X S+ 0 0 110 -4,-1.5 4,-1.7 -3,-0.3 -2,-0.2 0.971 121.6 37.3 -73.6 -57.9 11.1 -24.6 80.5 74 75 A K H X S+ 0 0 55 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.940 112.4 59.2 -58.3 -49.3 7.7 -23.7 79.0 75 76 A A H X S+ 0 0 0 -4,-3.2 4,-2.4 -5,-0.4 -1,-0.2 0.890 107.5 46.9 -49.8 -43.7 9.2 -20.9 76.9 76 77 A V H X S+ 0 0 10 -4,-1.1 4,-2.0 -5,-0.4 -1,-0.2 0.880 110.8 51.7 -68.9 -38.5 11.5 -23.4 75.2 77 78 A D H X S+ 0 0 71 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.948 114.8 41.5 -58.0 -52.3 8.7 -26.0 74.6 78 79 A L H X S+ 0 0 10 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.896 113.7 52.5 -66.4 -41.7 6.4 -23.4 72.9 79 80 A G H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.857 110.4 48.5 -63.3 -38.1 9.2 -21.8 71.0 80 81 A V H X S+ 0 0 9 -4,-2.0 4,-2.9 2,-0.2 5,-0.3 0.949 110.3 51.0 -65.7 -48.7 10.2 -25.2 69.6 81 82 A E H X S+ 0 0 93 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.914 112.3 47.4 -52.9 -46.2 6.6 -26.0 68.6 82 83 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.959 112.7 47.0 -63.3 -52.5 6.3 -22.6 66.8 83 84 A L H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.899 111.6 51.3 -56.8 -45.0 9.6 -22.9 64.9 84 85 A L H X S+ 0 0 83 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.899 112.4 47.6 -58.5 -42.8 8.8 -26.5 63.9 85 86 A G H X S+ 0 0 10 -4,-2.0 4,-2.4 -5,-0.3 -2,-0.2 0.912 110.7 48.9 -64.1 -47.4 5.4 -25.4 62.6 86 87 A A H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -1,-0.2 0.824 110.7 52.2 -64.1 -32.5 6.8 -22.4 60.6 87 88 A L H <>S+ 0 0 4 -4,-2.1 5,-2.8 -5,-0.2 4,-0.5 0.834 107.6 52.2 -69.0 -36.6 9.4 -24.7 59.1 88 89 A D H ><5S+ 0 0 125 -4,-1.5 3,-1.1 3,-0.2 -2,-0.2 0.941 108.8 50.1 -62.3 -49.6 6.6 -27.1 58.1 89 90 A D H 3<5S+ 0 0 93 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.861 115.7 42.5 -55.1 -39.3 4.8 -24.2 56.4 90 91 A A T 3<5S- 0 0 9 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.527 107.0-129.7 -84.2 -4.4 8.0 -23.3 54.6 91 92 A N T < 5 + 0 0 140 -3,-1.1 -3,-0.2 -4,-0.5 2,-0.2 0.874 66.4 129.0 52.3 39.2 8.7 -27.0 53.9 92 93 A L < - 0 0 24 -5,-2.8 -1,-0.2 -6,-0.1 -2,-0.1 -0.665 52.2-124.4-116.5 174.6 12.2 -26.4 55.3 93 94 A R > - 0 0 157 -2,-0.2 3,-2.1 -3,-0.1 4,-0.4 -0.864 23.1-113.5-122.8 154.2 14.4 -28.2 57.8 94 95 A P G > S+ 0 0 33 0, 0.0 3,-1.8 0, 0.0 30,-0.4 0.870 114.7 60.9 -49.5 -42.1 16.2 -27.2 61.0 95 96 A S G 3 S+ 0 0 46 1,-0.3 29,-0.1 28,-0.2 27,-0.0 0.709 94.8 64.9 -60.7 -19.5 19.6 -27.9 59.4 96 97 A D G < S+ 0 0 41 -3,-2.1 62,-0.5 61,-0.0 2,-0.4 0.612 76.4 107.4 -79.9 -13.3 18.8 -25.2 56.8 97 98 A I < + 0 0 0 -3,-1.8 27,-0.3 -4,-0.4 62,-0.2 -0.530 36.7 172.8 -75.4 124.3 18.8 -22.3 59.3 98 99 A D S S+ 0 0 21 60,-2.8 30,-2.6 -2,-0.4 2,-0.3 0.635 71.0 22.8-100.5 -20.4 21.8 -20.0 59.1 99 100 A M E -cd 128 159A 3 59,-1.1 61,-2.2 28,-0.2 2,-0.4 -0.989 62.7-169.5-151.6 134.2 20.6 -17.4 61.7 100 101 A I E -cd 129 160A 0 28,-3.1 30,-1.4 -2,-0.3 2,-0.4 -0.995 2.6-170.4-129.6 138.2 18.1 -17.5 64.5 101 102 A A E -cd 130 161A 0 59,-2.0 61,-2.7 -2,-0.4 2,-0.4 -0.968 4.9-162.0-124.0 141.3 16.7 -14.6 66.5 102 103 A T E -cd 131 162A 6 28,-1.6 30,-2.9 -2,-0.4 2,-0.4 -0.970 2.5-167.0-124.1 144.3 14.6 -14.8 69.7 103 104 A A E +cd 132 163A 1 59,-2.5 61,-1.7 -2,-0.4 2,-0.3 -0.995 23.3 134.7-128.5 133.1 12.4 -12.2 71.3 104 105 A T - 0 0 14 28,-1.0 32,-0.4 -2,-0.4 31,-0.3 -0.949 24.2-178.7-157.6 163.0 10.9 -12.2 74.7 105 106 A V S S+ 0 0 10 59,-0.3 60,-0.1 -2,-0.3 28,-0.1 0.228 76.3 75.5-140.3 4.3 10.5 -9.7 77.5 106 107 A T S S+ 0 0 6 58,-0.4 2,-0.3 30,-0.1 130,-0.1 0.360 97.1 34.2-106.3 3.7 8.8 -12.0 80.0 107 108 A G - 0 0 1 26,-0.1 2,-0.5 -36,-0.1 -3,-0.1 -0.991 65.7-131.6-154.8 158.3 11.7 -14.1 81.2 108 109 A V + 0 0 2 -2,-0.3 2,-0.4 829,-0.1 829,-0.2 -0.964 31.2 172.9-117.2 118.3 15.4 -13.9 81.9 109 110 A A - 0 0 10 -2,-0.5 4,-0.2 730,-0.1 827,-0.1 -0.984 16.7-161.2-132.5 125.0 17.5 -16.7 80.3 110 111 A V S S+ 0 0 3 -2,-0.4 825,-1.5 825,-0.3 2,-0.2 -0.875 95.2 42.4-142.7 111.2 21.3 -17.2 80.2 111 112 A P S S- 0 0 0 0, 0.0 -1,-0.2 0, 0.0 730,-0.1 0.449 117.6-117.9 -61.5 157.3 22.0 -19.1 78.1 112 113 A S >> - 0 0 3 728,-0.8 4,-1.6 934,-0.2 3,-0.6 -0.064 19.9-101.2 -68.1 166.0 19.5 -17.4 75.9 113 114 A L H 3> S+ 0 0 6 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.834 120.2 58.7 -60.0 -33.5 16.4 -19.0 74.4 114 115 A D H 3> S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.868 103.5 51.4 -65.9 -35.5 18.1 -19.4 71.0 115 116 A A H <> S+ 0 0 1 -3,-0.6 4,-1.0 2,-0.2 -1,-0.2 0.911 116.9 39.5 -64.8 -43.2 20.8 -21.5 72.5 116 117 A R H X S+ 0 0 35 -4,-1.6 4,-2.3 2,-0.2 3,-0.2 0.930 117.1 48.9 -72.6 -46.3 18.3 -23.8 74.1 117 118 A I H X S+ 0 0 0 -4,-3.2 4,-1.7 1,-0.2 -2,-0.2 0.939 112.1 49.1 -58.8 -47.4 15.9 -23.8 71.2 118 119 A A H X>S+ 0 0 4 -4,-2.8 5,-2.0 -5,-0.2 4,-0.5 0.748 109.4 54.6 -64.2 -25.3 18.8 -24.6 68.8 119 120 A G H <5S+ 0 0 55 -4,-1.0 3,-0.4 -3,-0.2 -1,-0.2 0.903 109.2 46.1 -73.6 -41.8 19.9 -27.4 71.1 120 121 A R H <5S+ 0 0 132 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.785 115.2 45.8 -69.0 -30.1 16.4 -29.0 71.1 121 122 A L H <5S- 0 0 26 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.479 107.4-117.0 -98.6 -4.7 16.0 -28.8 67.3 122 123 A G T <5 - 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0 0 38 -3,-2.0 41,-2.4 -6,-0.2 2,-0.5 -0.379 64.2-133.1 -95.2 166.7 20.5 -17.9 53.5 158 159 A V E - F 0 197A 0 -62,-0.5 -60,-2.8 39,-0.2 -59,-1.1 -0.979 26.3-176.4-113.4 125.2 17.6 -18.9 55.7 159 160 A A E -dF 99 196A 0 37,-2.8 37,-3.1 -2,-0.5 2,-0.3 -0.948 5.4-162.2-123.7 146.2 16.8 -16.9 58.9 160 161 A V E -dF 100 195A 0 -61,-2.2 -59,-2.0 -2,-0.4 2,-0.4 -0.918 8.7-157.2-126.3 149.5 14.2 -17.4 61.6 161 162 A L E -dF 101 194A 0 33,-2.2 33,-2.5 -2,-0.3 2,-0.4 -0.997 11.1-168.5-120.2 131.3 12.6 -15.3 64.3 162 163 A V E -dF 102 193A 0 -61,-2.7 -59,-2.5 -2,-0.4 2,-0.5 -0.983 0.5-169.1-121.1 128.9 11.1 -16.9 67.3 163 164 A S E +dF 103 192A 0 29,-3.2 29,-1.4 -2,-0.4 2,-0.5 -0.922 6.7 177.3-122.8 109.8 8.9 -15.0 69.7 164 165 A V E + F 0 191A 1 -61,-1.7 2,-0.4 -2,-0.5 -58,-0.4 -0.943 1.3 174.7-113.7 127.5 7.9 -16.4 73.1 165 166 A E E + F 0 190A 0 25,-2.4 25,-1.9 -2,-0.5 2,-0.5 -0.958 10.6 175.9-133.1 116.0 5.9 -14.5 75.6 166 167 A L E > + F 0 189A 0 -2,-0.4 3,-1.2 23,-0.2 4,-0.2 -0.677 11.1 165.7-117.4 75.7 4.6 -16.0 78.7 167 168 A C G > + 0 0 15 21,-1.0 3,-1.7 -2,-0.5 -1,-0.2 0.796 68.0 66.6 -63.6 -35.2 3.0 -13.0 80.4 168 169 A S G > S+ 0 0 17 1,-0.3 3,-1.2 2,-0.1 -1,-0.3 0.792 92.3 65.5 -57.8 -26.5 1.0 -15.0 83.0 169 170 A L G < S+ 0 0 5 -3,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.663 83.5 71.7 -74.4 -16.3 4.4 -16.1 84.5 170 171 A T G X + 0 0 26 -3,-1.7 3,-1.8 -4,-0.2 -1,-0.3 0.383 66.4 115.3 -77.8 8.1 5.2 -12.5 85.6 171 172 A Y G X + 0 0 34 -3,-1.2 3,-2.6 1,-0.3 -1,-0.2 0.787 54.9 71.2 -51.6 -39.1 2.5 -12.9 88.2 172 173 A P G 3 S+ 0 0 21 0, 0.0 -1,-0.3 0, 0.0 63,-0.1 0.822 100.2 49.4 -49.0 -31.7 4.9 -12.7 91.3 173 174 A A G < S+ 0 0 2 -3,-1.8 2,-0.3 63,-0.3 -2,-0.2 0.462 83.7 119.6 -88.5 -0.5 5.3 -8.9 90.6 174 175 A V < + 0 0 40 -3,-2.6 63,-0.1 -4,-0.2 7,-0.0 -0.494 37.5 178.2 -76.5 129.1 1.6 -8.2 90.2 175 176 A K - 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