==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=14-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 11-JUL-11 3STY . COMPND 2 MOLECULE: METHYLKETONE SYNTHASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: LYCOPERSICON HIRSUTUM F. GLABRATUM; . AUTHOR M.E.AULDRIDGE,M.B.AUSTIN,J.P.NOEL . 517 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21128.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 370 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 60 11.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 18 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 41 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 72 13.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 157 30.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 1.5 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 2 0 0 4 0 1 5 2 1 2 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 4 4 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 . 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 8 A F 0 0 176 0, 0.0 2,-0.5 0, 0.0 29,-0.0 0.000 360.0 360.0 360.0 114.9 -35.8 -36.2 -16.7 2 9 A V - 0 0 71 29,-0.0 2,-0.3 0, 0.0 29,-0.0 -0.916 360.0-126.0-106.7 125.5 -32.1 -35.8 -16.1 3 10 A K - 0 0 151 -2,-0.5 2,-0.3 28,-0.1 28,-0.1 -0.518 31.2-168.7 -71.4 130.7 -31.1 -32.7 -14.1 4 11 A K - 0 0 21 -2,-0.3 28,-2.6 28,-0.0 2,-0.5 -0.766 18.6-131.0-118.4 165.1 -28.5 -30.6 -15.9 5 12 A H E -a 32 0A 22 68,-0.3 70,-2.5 -2,-0.3 2,-0.4 -0.941 19.4-167.0-122.0 109.6 -26.3 -27.7 -14.8 6 13 A F E -ab 33 75A 0 26,-2.4 28,-2.7 -2,-0.5 2,-0.5 -0.804 2.7-163.6 -95.8 133.9 -26.2 -24.6 -17.0 7 14 A V E -ab 34 76A 0 68,-2.7 70,-2.9 -2,-0.4 2,-0.5 -0.979 11.0-158.3-119.8 117.0 -23.5 -21.9 -16.4 8 15 A L E -ab 35 77A 0 26,-2.7 28,-2.0 -2,-0.5 2,-0.5 -0.854 7.9-168.7-105.3 127.8 -24.3 -18.6 -18.1 9 16 A V E -ab 36 78A 0 68,-2.9 70,-2.3 -2,-0.5 73,-0.1 -0.961 16.4-141.0-119.6 119.4 -21.7 -16.0 -18.9 10 17 A H - 0 0 0 26,-0.6 3,-0.1 -2,-0.5 6,-0.1 -0.030 12.9-111.5 -72.3 172.4 -22.7 -12.5 -20.0 11 18 A A > - 0 0 1 1,-0.2 3,-1.3 4,-0.2 69,-0.1 -0.240 57.3 -48.1 -93.8-176.8 -21.4 -10.0 -22.6 12 19 A A T 3 S+ 0 0 16 1,-0.2 -1,-0.2 -2,-0.1 3,-0.1 -0.191 123.6 8.3 -55.4 146.1 -19.7 -6.7 -22.2 13 20 A F T 3 S+ 0 0 15 1,-0.2 161,-1.8 162,-0.1 29,-0.3 0.156 113.6 94.8 69.5 -18.5 -21.2 -4.2 -19.7 14 21 A H < - 0 0 3 -3,-1.3 28,-0.4 159,-0.2 2,-0.3 0.013 52.5-165.7 -91.4-163.3 -23.7 -6.7 -18.5 15 22 A G > - 0 0 0 26,-0.2 3,-1.8 -3,-0.1 4,-0.3 -0.931 49.4 -63.6-165.4-175.1 -23.8 -9.2 -15.6 16 23 A A G > S+ 0 0 6 -2,-0.3 3,-1.8 1,-0.3 21,-0.1 0.816 119.7 72.8 -53.2 -33.0 -25.6 -12.2 -14.2 17 24 A W G > S+ 0 0 0 1,-0.3 3,-1.7 414,-0.3 -1,-0.3 0.764 81.7 68.2 -55.4 -30.3 -28.8 -10.1 -14.0 18 25 A C G < S+ 0 0 0 -3,-1.8 3,-0.4 1,-0.3 -1,-0.3 0.728 95.5 56.3 -67.3 -18.1 -29.3 -10.1 -17.8 19 26 A W G X> S+ 0 0 0 -3,-1.8 4,-3.1 -4,-0.3 3,-0.7 0.300 71.1 117.1 -92.3 7.8 -30.1 -13.8 -17.7 20 27 A Y H <> S+ 0 0 8 -3,-1.7 4,-2.0 1,-0.3 -1,-0.2 0.813 74.4 49.0 -48.6 -39.6 -32.9 -13.4 -15.2 21 28 A K H 3> S+ 0 0 31 -3,-0.4 4,-1.7 218,-0.2 -1,-0.3 0.903 115.8 44.0 -68.5 -38.0 -35.7 -14.7 -17.6 22 29 A I H <> S+ 0 0 0 -3,-0.7 4,-2.4 2,-0.2 -2,-0.2 0.895 111.0 53.8 -71.1 -42.8 -33.6 -17.7 -18.5 23 30 A V H X S+ 0 0 7 -4,-3.1 4,-2.4 1,-0.2 5,-0.2 0.907 109.0 49.9 -58.6 -42.1 -32.6 -18.4 -14.9 24 31 A A H X S+ 0 0 7 -4,-2.0 4,-2.2 -5,-0.3 -1,-0.2 0.909 110.9 48.4 -64.5 -42.7 -36.3 -18.4 -13.9 25 32 A L H X S+ 0 0 39 -4,-1.7 4,-0.9 1,-0.2 -1,-0.2 0.873 113.5 47.5 -65.6 -38.0 -37.2 -20.8 -16.7 26 33 A M H <>S+ 0 0 0 -4,-2.4 5,-2.2 2,-0.2 4,-0.4 0.920 113.1 46.6 -70.9 -44.1 -34.4 -23.2 -15.8 27 34 A R H ><5S+ 0 0 126 -4,-2.4 3,-1.2 1,-0.2 -2,-0.2 0.898 111.8 50.2 -65.9 -41.2 -35.0 -23.2 -12.1 28 35 A S H 3<5S+ 0 0 82 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.752 108.2 55.6 -69.4 -21.2 -38.8 -23.7 -12.5 29 36 A S T 3<5S- 0 0 39 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.508 122.4-104.7 -88.0 -5.7 -38.0 -26.6 -14.9 30 37 A G T < 5S+ 0 0 36 -3,-1.2 -3,-0.2 -4,-0.4 2,-0.2 0.431 77.8 126.0 100.0 -1.5 -35.9 -28.4 -12.3 31 38 A H < - 0 0 15 -5,-2.2 2,-0.4 -6,-0.2 -1,-0.3 -0.506 59.8-117.7 -90.4 159.8 -32.4 -27.7 -13.6 32 39 A N E -a 5 0A 71 -28,-2.6 -26,-2.4 -2,-0.2 2,-0.4 -0.750 34.6-174.9 -93.4 141.8 -29.5 -26.1 -11.8 33 40 A V E -a 6 0A 4 -2,-0.4 2,-0.5 -28,-0.2 -26,-0.2 -0.997 16.9-168.2-144.3 137.4 -28.3 -22.8 -13.1 34 41 A T E -a 7 0A 32 -28,-2.7 -26,-2.7 -2,-0.4 2,-0.6 -0.977 4.0-171.2-125.5 114.1 -25.4 -20.5 -12.3 35 42 A A E -a 8 0A 28 -2,-0.5 2,-0.2 -28,-0.2 -26,-0.2 -0.943 19.6-156.9-105.5 118.0 -25.3 -17.0 -13.8 36 43 A L E -a 9 0A 26 -28,-2.0 -26,-0.6 -2,-0.6 2,-0.5 -0.656 16.1-138.3-100.6 153.0 -22.0 -15.4 -13.1 37 44 A D - 0 0 27 -2,-0.2 3,-0.1 -22,-0.2 -22,-0.1 -0.929 24.1-147.3-102.1 125.6 -20.8 -11.8 -12.9 38 45 A L > - 0 0 0 -2,-0.5 3,-1.6 1,-0.2 6,-0.2 -0.253 51.2 -46.8 -80.4-178.8 -17.4 -11.4 -14.5 39 46 A G T 3 S- 0 0 2 18,-2.5 -1,-0.2 1,-0.3 3,-0.1 -0.211 127.6 -3.4 -53.8 134.2 -15.0 -8.8 -13.1 40 47 A A T 3 S+ 0 0 3 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.791 107.3 123.8 52.4 34.1 -16.5 -5.4 -12.4 41 48 A S S X S- 0 0 4 -3,-1.6 3,-2.7 16,-0.1 -1,-0.2 -0.924 74.0 -24.6-122.5 147.6 -19.8 -6.6 -13.9 42 49 A G T 3 S- 0 0 1 -28,-0.4 390,-0.1 -2,-0.3 -27,-0.1 -0.300 131.9 -19.7 53.2-124.0 -23.2 -6.7 -12.2 43 50 A I T 3 S+ 0 0 44 388,-0.3 -1,-0.3 390,-0.0 -28,-0.0 0.132 93.5 137.5-102.4 20.8 -22.5 -6.7 -8.4 44 51 A N < - 0 0 28 -3,-2.7 -6,-0.1 -6,-0.2 -5,-0.0 -0.460 58.0-130.9 -61.6 137.1 -19.0 -8.0 -8.6 45 52 A P S S+ 0 0 72 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.713 76.5 94.7 -67.7 -21.5 -17.1 -5.8 -6.1 46 53 A K - 0 0 106 -5,-0.1 2,-0.3 2,-0.0 -2,-0.0 -0.378 67.7-138.6 -72.3 150.4 -14.2 -4.8 -8.3 47 54 A Q > - 0 0 53 1,-0.1 3,-2.1 -2,-0.1 4,-0.5 -0.774 29.3-106.5-103.3 153.7 -14.3 -1.6 -10.2 48 55 A A G > S+ 0 0 13 -2,-0.3 3,-1.6 1,-0.3 -1,-0.1 0.846 118.2 56.2 -48.5 -43.6 -13.0 -1.5 -13.9 49 56 A L G 3 S+ 0 0 87 1,-0.3 -1,-0.3 2,-0.1 -3,-0.0 0.665 101.4 59.9 -65.9 -15.1 -9.8 0.3 -13.0 50 57 A Q G < S+ 0 0 108 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.560 103.4 51.5 -89.2 -8.8 -8.9 -2.4 -10.5 51 58 A I < + 0 0 6 -3,-1.6 -1,-0.2 -4,-0.5 6,-0.2 -0.433 57.4 147.7-127.3 61.7 -9.0 -5.2 -13.2 52 59 A P + 0 0 49 0, 0.0 2,-0.4 0, 0.0 128,-0.4 0.574 58.0 78.4 -69.7 -11.6 -6.7 -4.0 -16.1 53 60 A N S >> S- 0 0 84 1,-0.1 3,-1.5 -3,-0.1 4,-1.2 -0.860 80.1-135.9-102.1 135.5 -5.6 -7.5 -16.9 54 61 A F H 3> S+ 0 0 3 -2,-0.4 4,-2.1 1,-0.3 5,-0.2 0.839 106.9 63.2 -58.1 -33.0 -8.0 -9.7 -18.9 55 62 A S H 3> S+ 0 0 44 1,-0.2 4,-1.0 2,-0.2 -1,-0.3 0.845 99.8 54.5 -60.2 -31.3 -7.2 -12.6 -16.4 56 63 A D H <4 S+ 0 0 53 -3,-1.5 -1,-0.2 2,-0.2 -2,-0.2 0.881 106.5 50.9 -68.0 -39.5 -8.8 -10.3 -13.7 57 64 A Y H < S+ 0 0 5 -4,-1.2 -18,-2.5 1,-0.2 4,-0.2 0.894 114.1 43.5 -65.1 -39.6 -12.0 -10.0 -15.8 58 65 A L H >X S+ 0 0 2 -4,-2.1 4,-2.1 1,-0.2 3,-1.1 0.616 85.4 101.4 -82.3 -12.7 -12.3 -13.8 -16.3 59 66 A S H 3X S+ 0 0 40 -4,-1.0 4,-2.9 1,-0.3 5,-0.3 0.820 74.7 55.7 -41.3 -51.6 -11.4 -14.6 -12.6 60 67 A P H 3> S+ 0 0 24 0, 0.0 4,-1.6 0, 0.0 -1,-0.3 0.884 112.4 42.6 -54.5 -40.6 -15.0 -15.3 -11.5 61 68 A L H <> S+ 0 0 0 -3,-1.1 4,-3.1 -4,-0.2 -2,-0.2 0.927 115.1 48.8 -71.8 -44.3 -15.6 -17.9 -14.2 62 69 A M H X S+ 0 0 37 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.863 111.4 49.8 -64.8 -34.8 -12.2 -19.5 -13.7 63 70 A E H X S+ 0 0 128 -4,-2.9 4,-1.2 -5,-0.3 -1,-0.2 0.893 113.2 47.4 -69.5 -39.1 -12.6 -19.6 -9.9 64 71 A F H < S+ 0 0 32 -4,-1.6 3,-0.5 -5,-0.3 4,-0.4 0.939 111.3 49.9 -65.8 -47.5 -16.0 -21.2 -10.4 65 72 A M H >< S+ 0 0 0 -4,-3.1 3,-1.0 1,-0.2 -2,-0.2 0.859 108.8 53.3 -59.5 -37.0 -14.7 -23.8 -12.9 66 73 A A H 3< S+ 0 0 61 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.809 103.2 57.7 -68.6 -30.2 -11.9 -24.7 -10.6 67 74 A S T 3< S+ 0 0 79 -4,-1.2 -1,-0.2 -3,-0.5 -2,-0.2 0.510 85.8 100.4 -79.0 -5.9 -14.4 -25.4 -7.7 68 75 A L S < S- 0 0 12 -3,-1.0 2,-0.0 -4,-0.4 28,-0.0 -0.704 76.1-126.8 -87.8 123.2 -16.2 -28.0 -9.8 69 76 A P > - 0 0 55 0, 0.0 3,-2.1 0, 0.0 -2,-0.1 -0.434 29.9-115.3 -62.5 142.5 -15.5 -31.7 -9.1 70 77 A A T 3 S+ 0 0 59 1,-0.3 -2,-0.0 -2,-0.0 3,-0.0 0.727 113.0 59.7 -52.6 -26.5 -14.6 -33.2 -12.5 71 78 A N T 3 S+ 0 0 126 1,-0.2 2,-1.4 2,-0.1 -1,-0.3 0.667 85.2 83.0 -78.7 -16.6 -17.7 -35.5 -12.4 72 79 A E S < S- 0 0 92 -3,-2.1 -1,-0.2 25,-0.0 24,-0.0 -0.620 71.4-167.5 -91.4 80.3 -20.1 -32.5 -12.3 73 80 A K - 0 0 88 -2,-1.4 -68,-0.3 24,-0.1 2,-0.3 -0.256 2.2-161.3 -67.4 151.8 -20.3 -31.6 -16.0 74 81 A I E - c 0 97A 0 22,-1.9 24,-2.1 -70,-0.1 25,-1.0 -0.880 25.5-125.0-133.8 163.6 -21.9 -28.4 -17.2 75 82 A I E -bc 6 99A 6 -70,-2.5 -68,-2.7 -2,-0.3 2,-0.6 -0.961 35.0-153.8-105.7 112.2 -23.4 -26.8 -20.2 76 83 A L E -bc 7 100A 0 23,-1.9 25,-3.4 -2,-0.7 2,-0.5 -0.831 11.2-170.2 -98.3 117.2 -21.3 -23.6 -20.6 77 84 A V E -bc 8 101A 0 -70,-2.9 -68,-2.9 -2,-0.6 2,-0.4 -0.915 3.3-174.3-111.6 125.5 -23.1 -20.7 -22.4 78 85 A G E -bc 9 102A 0 23,-3.0 25,-2.5 -2,-0.5 2,-0.5 -0.970 10.0-153.5-122.8 130.8 -21.3 -17.5 -23.4 79 86 A H E > - c 0 103A 0 -70,-2.3 3,-2.9 -2,-0.4 25,-0.2 -0.878 56.3 -52.7-105.6 127.4 -22.9 -14.4 -24.9 80 87 A A T > S+ 0 0 10 23,-1.9 3,-2.7 -2,-0.5 26,-2.6 -0.224 136.6 12.8 49.6-119.0 -21.0 -12.1 -27.2 81 88 A L T >> S+ 0 0 28 1,-0.3 3,-1.8 24,-0.2 4,-0.8 0.789 118.3 76.0 -56.1 -26.3 -17.7 -11.1 -25.5 82 89 A G H <> S+ 0 0 0 -3,-2.9 4,-2.3 1,-0.3 -1,-0.3 0.677 77.1 77.0 -58.8 -16.3 -18.6 -13.9 -23.0 83 90 A G H <> S+ 0 0 0 -3,-2.7 4,-1.7 1,-0.2 -1,-0.3 0.871 89.7 53.3 -62.7 -36.7 -17.4 -16.2 -25.8 84 91 A L H <> S+ 0 0 0 -3,-1.8 4,-1.8 -4,-0.3 -1,-0.2 0.893 108.2 51.1 -65.1 -39.1 -13.8 -15.3 -24.9 85 92 A A H X S+ 0 0 1 -4,-0.8 4,-2.1 1,-0.2 -2,-0.2 0.943 111.7 44.3 -64.2 -49.4 -14.4 -16.3 -21.3 86 93 A I H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.815 109.2 59.2 -68.3 -25.4 -15.9 -19.6 -22.0 87 94 A S H X S+ 0 0 0 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.913 106.6 46.7 -66.4 -42.0 -13.1 -20.3 -24.6 88 95 A K H X S+ 0 0 44 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.913 111.9 50.7 -64.9 -42.3 -10.5 -19.9 -21.8 89 96 A A H X S+ 0 0 0 -4,-2.1 4,-3.1 1,-0.2 -2,-0.2 0.875 108.3 53.6 -63.1 -36.0 -12.6 -22.2 -19.6 90 97 A M H < S+ 0 0 0 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.870 109.7 47.0 -65.9 -37.9 -12.7 -24.7 -22.4 91 98 A E H < S+ 0 0 25 -4,-1.8 -1,-0.2 2,-0.2 -2,-0.2 0.838 120.3 38.8 -72.7 -32.2 -8.9 -24.7 -22.8 92 99 A T H < S+ 0 0 45 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.2 0.871 133.1 18.2 -86.9 -41.4 -8.4 -25.0 -19.0 93 100 A F S >< S+ 0 0 45 -4,-3.1 3,-1.1 -5,-0.2 4,-0.3 -0.446 71.4 153.0-130.2 59.4 -11.1 -27.4 -17.9 94 101 A P G > S+ 0 0 11 0, 0.0 3,-0.9 0, 0.0 -1,-0.1 0.824 71.4 55.4 -58.0 -35.9 -12.2 -29.1 -21.2 95 102 A E G 3 S+ 0 0 132 1,-0.2 -5,-0.1 -3,-0.1 -2,-0.0 0.689 98.3 61.2 -74.3 -19.1 -13.4 -32.3 -19.4 96 103 A K G < S+ 0 0 29 -3,-1.1 -22,-1.9 -23,-0.1 2,-0.6 0.508 91.6 81.7 -85.4 -3.3 -15.8 -30.6 -17.1 97 104 A I E < -c 74 0A 8 -3,-0.9 102,-0.3 -4,-0.3 -22,-0.2 -0.894 53.1-172.4-111.3 115.2 -17.8 -29.2 -20.0 98 105 A S E S- 0 0 28 -24,-2.1 101,-0.5 -2,-0.6 2,-0.3 0.939 80.4 -15.2 -64.8 -46.7 -20.4 -31.4 -21.7 99 106 A V E -c 75 0A 0 -25,-1.0 -23,-1.9 99,-0.1 2,-0.4 -0.975 61.0-138.5-159.2 143.5 -20.9 -28.8 -24.4 100 107 A A E -cd 76 200A 0 99,-2.7 101,-2.7 -2,-0.3 2,-0.5 -0.898 17.9-157.1-106.7 136.4 -20.1 -25.1 -24.9 101 108 A V E -cd 77 201A 0 -25,-3.4 -23,-3.0 -2,-0.4 2,-0.8 -0.961 4.7-159.7-120.0 123.1 -22.6 -22.8 -26.4 102 109 A F E -cd 78 202A 0 99,-3.0 101,-3.1 -2,-0.5 2,-1.1 -0.877 5.0-162.8-103.0 104.9 -21.7 -19.5 -28.2 103 110 A L E S-cd 79 203A 0 -25,-2.5 -23,-1.9 -2,-0.8 101,-0.1 -0.781 82.8 -40.1 -88.2 100.5 -24.8 -17.3 -28.3 104 111 A S S S+ 0 0 5 99,-2.3 -1,-0.3 -2,-1.1 2,-0.2 0.858 110.4 163.6 45.8 34.2 -23.7 -14.8 -31.0 105 112 A G - 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0 0 74 -3,-2.0 3,-2.6 2,-0.0 21,-0.3 -0.702 69.9 -56.5 -86.2 128.7 -21.2 4.2 -31.7 129 136 A L T 3 S- 0 0 99 -2,-0.5 -4,-0.0 1,-0.3 -2,-0.0 -0.104 121.3 -10.1 42.1-121.8 -23.9 6.7 -30.9 130 137 A D T 3 S+ 0 0 52 19,-0.1 -1,-0.3 2,-0.0 2,-0.1 0.163 97.5 126.2 -93.7 19.9 -23.6 7.9 -27.3 131 138 A N < - 0 0 15 -3,-2.6 2,-0.3 -6,-0.2 17,-0.2 -0.450 39.5-174.7 -71.5 151.7 -21.0 5.3 -26.2 132 139 A C E -G 147 0C 67 15,-1.9 15,-3.3 -2,-0.1 2,-0.3 -0.953 18.5-136.8-145.8 166.1 -17.9 7.0 -24.7 133 140 A V E -G 146 0C 49 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.846 12.3-141.6-122.5 159.7 -14.5 6.3 -23.3 134 141 A T E -G 145 0C 29 11,-2.1 10,-2.4 -2,-0.3 11,-0.7 -0.795 5.2-146.6-116.7 160.8 -12.6 7.4 -20.3 135 142 A Y > + 0 0 116 -2,-0.3 3,-1.7 8,-0.3 5,-0.1 -0.541 31.4 156.4-127.7 66.8 -8.9 8.3 -19.9 136 143 A E T 3 S+ 0 0 86 1,-0.3 -1,-0.1 -2,-0.2 -87,-0.0 0.551 77.5 55.2 -68.2 -7.4 -7.9 7.3 -16.3 137 144 A N T 3 S- 0 0 84 1,-0.4 -1,-0.3 5,-0.3 3,-0.2 0.131 123.4 -89.9-111.0 19.4 -4.3 7.0 -17.4 138 145 A G X - 0 0 26 -3,-1.7 3,-1.3 1,-0.1 -1,-0.4 -0.009 41.3 -78.4 93.2 160.2 -4.1 10.5 -18.8 139 146 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.691 124.6 61.6 -69.1 -20.0 -4.8 12.0 -22.3 140 147 A T T 3 S+ 0 0 129 -3,-0.2 -2,-0.1 -5,-0.1 -5,-0.0 0.312 99.0 68.9 -90.1 8.7 -1.5 10.8 -23.6 141 148 A N S < S- 0 0 80 -3,-1.3 3,-0.1 1,-0.1 -4,-0.1 -0.845 97.7 -84.3-122.8 161.2 -2.5 7.2 -23.1 142 149 A P - 0 0 89 0, 0.0 -5,-0.3 0, 0.0 -1,-0.1 -0.190 62.6 -82.6 -58.5 155.7 -5.0 4.9 -24.7 143 150 A P - 0 0 42 0, 0.0 -8,-0.3 0, 0.0 3,-0.1 -0.328 38.6-152.1 -60.4 146.3 -8.6 5.2 -23.3 144 151 A T + 0 0 2 -10,-2.4 34,-2.8 1,-0.2 2,-0.3 0.842 66.0 17.8 -91.4 -39.9 -9.0 3.1 -20.2 145 152 A T E -GH 134 177C 6 -11,-0.7 -11,-2.1 32,-0.3 2,-0.4 -0.953 59.7-140.1-137.5 158.6 -12.7 2.2 -20.2 146 153 A L E -GH 133 176C 8 30,-2.6 30,-2.4 -2,-0.3 2,-0.5 -0.952 15.4-159.1-117.5 132.9 -15.7 2.0 -22.5 147 154 A I E -G 132 0C 59 -15,-3.3 -15,-1.9 -2,-0.4 2,-0.4 -0.961 15.1-133.3-119.5 123.2 -19.2 3.1 -21.3 148 155 A A - 0 0 9 -2,-0.5 -17,-0.1 -17,-0.2 25,-0.0 -0.586 26.2-140.9 -74.3 124.6 -22.4 1.9 -23.1 149 156 A G > - 0 0 5 -2,-0.4 4,-2.4 -21,-0.3 5,-0.2 -0.509 16.3-116.2 -87.7 156.8 -24.7 4.9 -23.6 150 157 A P H > S+ 0 0 83 0, 0.0 4,-2.4 0, 0.0 5,-0.1 0.867 114.9 47.9 -54.7 -45.8 -28.6 4.9 -23.3 151 158 A K H > S+ 0 0 144 2,-0.2 4,-2.8 1,-0.2 5,-0.3 0.903 110.8 51.6 -66.3 -40.5 -29.2 5.6 -26.9 152 159 A F H >>S+ 0 0 12 2,-0.2 4,-2.7 1,-0.2 5,-1.0 0.932 111.3 47.6 -62.0 -44.6 -26.8 2.9 -28.0 153 160 A L H X>S+ 0 0 2 -4,-2.4 5,-3.6 1,-0.2 4,-0.9 0.930 115.1 45.9 -61.7 -43.6 -28.5 0.4 -25.8 154 161 A A H <5S+ 0 0 37 -4,-2.4 -2,-0.2 3,-0.2 -1,-0.2 0.881 123.8 31.7 -67.1 -39.5 -31.9 1.4 -27.1 155 162 A T H <5S+ 0 0 85 -4,-2.8 -2,-0.2 -5,-0.1 -3,-0.2 0.861 132.0 22.9 -89.4 -40.2 -31.0 1.5 -30.8 156 163 A N H <5S+ 0 0 56 -4,-2.7 80,-0.3 -5,-0.3 -3,-0.2 0.661 130.8 25.8-104.3 -19.3 -28.3 -1.2 -31.2 157 164 A V T < > - 0 0 46 0, 0.0 3,-1.1 0, 0.0 4,-1.1 -0.256 41.8-120.0 -55.6 144.9 -39.5 -5.1 -23.9 163 170 A I H 3> S+ 0 0 87 1,-0.3 4,-1.8 2,-0.2 5,-0.1 0.798 111.8 62.0 -60.5 -28.0 -39.0 -1.4 -23.0 164 171 A E H 3> S+ 0 0 72 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.834 98.9 55.8 -68.7 -28.4 -38.8 -2.3 -19.3 165 172 A D H <> S+ 0 0 0 -3,-1.1 4,-2.5 2,-0.2 -1,-0.2 0.854 104.7 52.4 -70.9 -32.9 -35.7 -4.4 -20.1 166 173 A L H X S+ 0 0 44 -4,-1.1 4,-2.6 2,-0.2 -2,-0.2 0.925 110.1 49.1 -65.3 -42.5 -34.0 -1.4 -21.6 167 174 A A H X S+ 0 0 6 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.920 110.2 50.8 -61.2 -43.9 -34.8 0.5 -18.4 168 175 A L H X S+ 0 0 0 -4,-2.3 4,-0.5 1,-0.2 3,-0.5 0.932 111.3 48.3 -58.2 -48.4 -33.4 -2.3 -16.4 169 176 A A H >X S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 3,-1.5 0.904 105.3 57.1 -61.8 -43.0 -30.2 -2.3 -18.5 170 177 A T H 3< S+ 0 0 41 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.828 109.2 47.5 -60.7 -27.5 -29.7 1.5 -18.2 171 178 A A H 3< S+ 0 0 21 -4,-1.3 132,-0.3 -3,-0.5 -1,-0.3 0.559 123.1 32.5 -88.2 -7.1 -29.7 1.1 -14.4 172 179 A L H << S+ 0 0 0 -3,-1.5 -130,-0.3 -4,-0.5 -2,-0.2 0.643 79.3 111.6-124.9 -21.5 -27.2 -1.7 -14.5 173 180 A V < - 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0 0 14 -3,-2.4 2,-0.3 -6,-0.2 17,-0.2 -0.488 38.7-174.6 -70.9 143.3 -31.1 -13.9 6.5 392 139 B C E -O 407 0F 66 15,-1.8 15,-3.0 -2,-0.1 2,-0.3 -0.951 17.9-140.4-140.6 160.3 -27.7 -13.7 8.1 393 140 B V E -O 406 0F 50 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.800 13.2-141.4-116.8 160.7 -25.3 -11.2 9.7 394 141 B T E -O 405 0F 30 11,-1.8 10,-2.4 -2,-0.3 11,-0.7 -0.828 4.7-147.8-119.0 159.1 -21.5 -10.8 9.5 395 142 B Y > + 0 0 121 -2,-0.3 3,-1.4 8,-0.3 5,-0.1 -0.608 31.9 155.1-127.1 71.3 -19.0 -9.8 12.1 396 143 B E T 3 S+ 0 0 108 1,-0.3 -1,-0.1 -2,-0.2 -87,-0.0 0.672 78.1 51.6 -70.8 -17.4 -16.2 -8.0 10.3 397 144 B N T 3 S- 0 0 87 1,-0.3 -1,-0.3 5,-0.3 4,-0.2 0.187 120.5-100.3-104.3 15.5 -15.3 -6.1 13.5 398 145 B G X - 0 0 24 -3,-1.4 3,-1.1 1,-0.2 -1,-0.3 0.019 40.5 -70.5 88.3 163.4 -15.1 -9.1 15.6 399 146 B P T 3 S+ 0 0 123 0, 0.0 -1,-0.2 0, 0.0 -3,-0.1 0.660 124.9 64.8 -66.4 -18.6 -17.5 -10.8 18.2 400 147 B T T 3 S+ 0 0 130 -3,-0.2 -2,-0.1 -5,-0.1 -5,-0.0 0.747 100.2 61.9 -77.3 -22.1 -17.0 -8.0 20.7 401 148 B N S < S- 0 0 78 -3,-1.1 3,-0.1 -4,-0.2 -4,-0.1 -0.551 98.9 -86.2-101.5 166.2 -18.6 -5.5 18.3 402 149 B P - 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0 0 48 0, 0.0 3,-1.1 0, 0.0 4,-1.0 -0.294 41.3-120.9 -56.8 144.3 -43.3 -13.1 -11.3 423 170 B I H 3> S+ 0 0 98 1,-0.3 4,-1.9 2,-0.2 5,-0.1 0.774 111.6 63.0 -61.1 -25.7 -40.7 -15.7 -10.6 424 171 B E H 3> S+ 0 0 74 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.837 98.4 55.7 -68.6 -30.0 -38.3 -14.0 -13.0 425 172 B D H <> S+ 0 0 0 -3,-1.1 4,-2.6 2,-0.2 -1,-0.2 0.845 105.5 51.3 -70.3 -31.9 -38.3 -11.0 -10.7 426 173 B L H X S+ 0 0 43 -4,-1.0 4,-2.5 2,-0.2 -2,-0.2 0.920 110.3 49.1 -67.6 -42.9 -37.2 -13.2 -7.8 427 174 B A H X S+ 0 0 4 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.917 111.0 50.8 -60.9 -43.1 -34.4 -14.5 -10.0 428 175 B L H >X S+ 0 0 0 -4,-2.5 3,-0.6 1,-0.2 4,-0.6 0.953 111.3 47.5 -59.3 -50.7 -33.5 -10.9 -10.9 429 176 B A H >X S+ 0 0 0 -4,-2.6 4,-2.9 1,-0.2 3,-1.2 0.882 106.5 56.5 -60.4 -39.6 -33.4 -9.9 -7.2 430 177 B T H 3< S+ 0 0 42 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.824 108.6 48.4 -64.5 -27.2 -31.3 -12.9 -6.2 431 178 B A H << S+ 0 0 24 -4,-1.3 -388,-0.3 -3,-0.6 -1,-0.3 0.550 123.2 31.5 -87.3 -6.9 -28.7 -11.9 -8.7 432 179 B L H << S+ 0 0 1 -3,-1.2 -130,-0.3 -4,-0.6 -2,-0.2 0.639 79.9 112.6-126.2 -21.4 -28.6 -8.3 -7.6 433 180 B V < - 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