==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-AUG-10 3OAB . COMPND 2 MOLECULE: GERANYL DIPHOSPHATE SYNTHASE LARGE SUBUNIT; . SOURCE 2 ORGANISM_SCIENTIFIC: MENTHA X PIPERITA; . AUTHOR F.-L.HSIEH,T.-H.CHANG,T.-P.KO,A.H.-J.WANG . 1065 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41913.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 837 78.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.6 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 0.2 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 . 1 0.1 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 . 29 2.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 116 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 649 60.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 22 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 3 2 0 1 2 2 1 5 5 2 6 3 2 1 3 2 2 1 3 2 2 1 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 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 ANTIPARALLEL 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 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 0 108 0, 0.0 2,-0.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0-178.9 11.5 52.8 11.2 2 2 A F - 0 0 195 1,-0.2 5,-0.1 2,-0.1 0, 0.0 -0.787 360.0 -6.8 -99.3 138.4 10.6 51.5 7.8 3 3 A D >> + 0 0 108 -2,-0.4 4,-2.1 1,-0.1 3,-0.6 0.897 64.5 173.9 48.3 53.8 7.2 49.9 7.0 4 4 A F H 3> S+ 0 0 26 -3,-0.3 4,-2.4 1,-0.2 5,-0.2 0.877 80.3 57.7 -58.0 -33.6 6.0 49.8 10.6 5 5 A D H 3> S+ 0 0 96 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.860 105.8 48.2 -63.5 -35.4 2.7 48.5 9.1 6 6 A G H <> S+ 0 0 14 -3,-0.6 4,-2.0 2,-0.2 -2,-0.2 0.825 109.6 53.0 -72.8 -35.2 4.5 45.6 7.5 7 7 A Y H X S+ 0 0 14 -4,-2.1 4,-2.3 2,-0.2 3,-0.4 0.988 111.9 44.5 -62.5 -53.8 6.2 44.8 10.8 8 8 A M H X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.907 111.4 55.0 -57.8 -40.8 2.9 44.7 12.6 9 9 A L H X S+ 0 0 111 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.877 108.2 47.9 -59.2 -40.1 1.3 42.6 9.8 10 10 A R H X S+ 0 0 141 -4,-2.0 4,-2.7 -3,-0.4 5,-0.2 0.898 111.8 49.0 -69.9 -43.7 4.1 40.0 10.1 11 11 A K H X S+ 0 0 17 -4,-2.3 4,-2.5 2,-0.2 5,-0.2 0.971 111.8 48.0 -61.0 -51.2 3.8 39.7 13.8 12 12 A A H X S+ 0 0 9 -4,-2.5 4,-3.3 2,-0.2 5,-0.2 0.916 113.2 50.1 -54.5 -45.6 -0.1 39.3 13.8 13 13 A K H X S+ 0 0 121 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.975 112.0 44.8 -55.9 -59.4 0.2 36.7 11.0 14 14 A S H X S+ 0 0 26 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.874 116.8 47.4 -58.0 -36.2 2.8 34.6 12.9 15 15 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.906 107.7 54.2 -69.7 -41.6 0.7 35.0 16.0 16 16 A N H X S+ 0 0 44 -4,-3.3 4,-2.0 1,-0.2 -2,-0.2 0.838 107.9 53.4 -60.5 -32.9 -2.6 34.1 14.2 17 17 A K H X S+ 0 0 104 -4,-2.2 4,-1.8 -5,-0.2 -1,-0.2 0.952 110.8 43.9 -69.1 -46.0 -0.7 30.9 13.1 18 18 A A H X S+ 0 0 25 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.817 113.1 51.9 -67.2 -36.0 0.3 30.0 16.7 19 19 A L H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.915 108.1 50.8 -66.5 -45.8 -3.2 30.8 18.1 20 20 A E H < S+ 0 0 29 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.919 114.8 44.0 -58.8 -42.2 -4.9 28.6 15.5 21 21 A A H < S+ 0 0 69 -4,-1.8 3,-0.3 1,-0.2 -1,-0.2 0.813 113.8 50.2 -73.7 -35.2 -2.6 25.7 16.4 22 22 A A H < S+ 0 0 20 -4,-2.0 2,-0.7 1,-0.2 -2,-0.2 0.882 112.9 43.8 -72.1 -37.3 -2.9 26.2 20.2 23 23 A V S < S+ 0 0 4 -4,-2.3 -1,-0.2 -5,-0.1 2,-0.2 -0.781 79.2 176.4-115.6 85.1 -6.8 26.3 20.3 24 24 A Q - 0 0 57 -2,-0.7 2,-0.3 -3,-0.3 12,-0.1 -0.488 39.3 -96.3 -84.2 155.0 -8.0 23.5 18.1 25 25 A M + 0 0 9 -2,-0.2 2,-0.3 658,-0.1 4,-0.1 -0.574 65.5 138.8 -70.0 127.1 -11.6 22.4 17.6 26 26 A K - 0 0 62 -2,-0.3 6,-0.5 3,-0.2 7,-0.2 -0.987 44.0 -29.9-164.6 164.3 -12.4 19.5 20.0 27 27 A E S S+ 0 0 21 -2,-0.3 397,-0.1 1,-0.2 775,-0.1 -0.361 118.9 45.5 -62.7 134.0 -14.9 17.9 22.4 28 28 A P S >> S- 0 0 1 0, 0.0 3,-1.6 0, 0.0 4,-1.4 0.237 86.8-170.3 -75.7 110.8 -16.9 19.5 24.0 29 29 A L H 3> S+ 0 0 8 1,-0.3 4,-2.8 2,-0.2 5,-0.3 0.750 75.3 55.8 -42.8 -44.8 -17.3 21.2 20.5 30 30 A K H 3> S+ 0 0 88 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.820 107.7 50.4 -66.0 -25.6 -19.4 24.2 21.5 31 31 A I H <> S+ 0 0 0 -3,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.936 116.9 39.0 -76.4 -42.1 -16.9 25.3 24.1 32 32 A H H X S+ 0 0 3 -4,-1.4 4,-2.9 -6,-0.5 5,-0.2 0.898 113.9 53.7 -72.1 -37.5 -13.9 25.2 21.7 33 33 A E H X S+ 0 0 28 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.940 111.5 47.6 -59.5 -45.7 -15.9 26.5 18.8 34 34 A S H X S+ 0 0 0 -4,-1.5 4,-1.4 -5,-0.3 5,-0.2 0.884 110.5 50.5 -64.1 -49.1 -16.9 29.5 21.0 35 35 A M H X S+ 0 0 2 -4,-2.2 4,-2.3 1,-0.2 3,-0.2 0.942 114.3 45.3 -50.6 -52.1 -13.2 30.0 22.2 36 36 A R H X S+ 0 0 6 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.849 104.3 64.8 -62.7 -34.1 -12.0 30.0 18.6 37 37 A Y H < S+ 0 0 77 -4,-2.3 -1,-0.2 -5,-0.2 4,-0.2 0.895 116.2 25.9 -58.5 -50.0 -14.9 32.3 17.4 38 38 A S H < S+ 0 0 19 -4,-1.4 3,-0.4 -3,-0.2 -1,-0.2 0.814 122.4 53.4 -85.9 -31.0 -13.7 35.2 19.5 39 39 A L H < S+ 0 0 0 -4,-2.3 3,-0.2 -5,-0.2 -2,-0.2 0.864 115.7 38.5 -71.2 -35.5 -9.9 34.3 19.7 40 40 A L S < S+ 0 0 41 -4,-2.7 -1,-0.2 -5,-0.2 -3,-0.1 0.362 77.3 111.3 -97.4 1.0 -9.4 34.0 15.9 41 41 A A S S- 0 0 49 -3,-0.4 -1,-0.2 -4,-0.2 -2,-0.1 0.420 84.2-123.1 -55.6 5.7 -11.7 36.9 14.8 42 42 A G + 0 0 25 -3,-0.2 2,-0.3 -30,-0.1 -1,-0.1 0.333 46.3 158.9 63.3 153.9 -8.4 38.5 13.7 43 43 A G - 0 0 45 -3,-0.1 -1,-0.0 1,-0.0 -31,-0.0 -0.921 57.2 -68.4 177.1-166.4 -7.3 41.9 15.0 44 44 A K - 0 0 95 -2,-0.3 -32,-0.2 -32,-0.0 5,-0.1 0.742 49.6-148.1 -84.1 -19.9 -4.2 43.9 15.4 45 45 A R > + 0 0 8 1,-0.1 4,-2.3 3,-0.1 5,-0.2 0.848 35.5 159.4 57.7 37.3 -2.6 41.7 18.0 46 46 A V H > + 0 0 35 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.859 69.9 55.8 -59.3 -32.4 -0.8 44.6 19.7 47 47 A R H > S+ 0 0 44 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.937 108.9 43.0 -69.1 -45.1 -0.5 42.6 22.9 48 48 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.884 115.1 52.5 -65.4 -37.6 1.3 39.5 21.4 49 49 A M H X S+ 0 0 2 -4,-2.3 4,-3.0 1,-0.2 5,-0.3 0.913 106.7 51.9 -65.3 -43.3 3.5 42.0 19.4 50 50 A L H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.872 111.9 47.9 -60.0 -36.5 4.4 43.9 22.5 51 51 A C H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.937 115.7 41.8 -69.2 -47.7 5.4 40.6 24.1 52 52 A I H >X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 3,-0.6 0.972 115.0 51.1 -61.2 -54.5 7.5 39.3 21.1 53 53 A A H 3X S+ 0 0 3 -4,-3.0 4,-1.8 1,-0.3 -2,-0.2 0.876 109.8 50.6 -49.0 -51.0 9.1 42.8 20.6 54 54 A A H 3X S+ 0 0 0 -4,-2.0 4,-1.2 -5,-0.3 -1,-0.3 0.815 109.7 51.5 -59.9 -35.3 10.0 43.0 24.2 55 55 A C H X<>S+ 0 0 0 -4,-1.8 5,-2.6 -3,-0.6 3,-0.7 0.975 114.1 40.6 -67.1 -54.7 11.7 39.5 24.0 56 56 A E H ><5S+ 0 0 63 -4,-2.6 3,-0.9 1,-0.2 -2,-0.2 0.783 107.3 66.6 -66.2 -21.9 13.8 40.3 21.0 57 57 A L H 3<5S+ 0 0 1 -4,-1.8 204,-0.4 -5,-0.3 -1,-0.2 0.894 107.5 37.5 -64.5 -41.8 14.5 43.7 22.4 58 58 A V T <<5S- 0 0 17 -4,-1.2 -1,-0.2 -3,-0.7 -2,-0.2 0.241 133.1 -86.9 -92.6 9.6 16.5 42.1 25.3 59 59 A G T < 5S+ 0 0 52 -3,-0.9 -3,-0.2 -4,-0.3 -2,-0.1 0.366 86.8 124.3 105.8 -4.5 18.0 39.4 23.1 60 60 A G < - 0 0 17 -5,-2.6 2,-0.3 -6,-0.2 -1,-0.3 -0.159 57.3-115.3 -81.2 177.3 15.5 36.6 23.2 61 61 A D >> - 0 0 86 1,-0.1 3,-1.1 -4,-0.0 4,-1.0 -0.903 20.1-114.0-117.2 149.2 13.9 35.1 20.1 62 62 A E H >> S+ 0 0 55 -2,-0.3 4,-1.0 1,-0.3 3,-0.7 0.860 111.5 65.0 -41.1 -46.9 10.2 35.1 19.0 63 63 A S H >4 S+ 0 0 86 1,-0.2 3,-0.9 2,-0.2 -1,-0.3 0.888 100.8 48.8 -45.4 -51.1 10.0 31.4 19.4 64 64 A T H <4 S+ 0 0 14 -3,-1.1 4,-0.3 1,-0.2 -1,-0.2 0.803 115.1 42.2 -62.8 -35.3 10.5 31.6 23.2 65 65 A A H S+ 0 0 13 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.926 114.0 47.7 -60.6 -41.7 3.2 30.9 24.0 68 68 A A H > S+ 0 0 0 -4,-0.3 4,-2.2 1,-0.2 -2,-0.2 0.844 108.7 56.7 -64.7 -30.7 3.1 33.8 26.4 69 69 A A H X S+ 0 0 0 -4,-1.7 4,-1.1 1,-0.2 -1,-0.2 0.914 109.6 43.9 -64.9 -46.1 2.2 36.0 23.4 70 70 A C H X S+ 0 0 0 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.833 108.6 61.9 -65.9 -33.8 -0.8 33.9 22.6 71 71 A A H X S+ 0 0 0 -4,-2.4 4,-2.3 -5,-0.2 3,-0.3 0.960 102.5 46.4 -60.7 -52.2 -1.6 33.9 26.3 72 72 A V H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.795 111.7 52.2 -61.1 -28.4 -2.1 37.6 26.7 73 73 A E H X S+ 0 0 10 -4,-1.1 4,-2.6 2,-0.2 -1,-0.2 0.846 107.7 52.7 -74.2 -33.8 -4.3 37.6 23.5 74 74 A M H X S+ 0 0 0 -4,-1.9 4,-2.6 -3,-0.3 -2,-0.2 0.931 110.9 47.1 -59.7 -51.0 -6.4 34.8 25.1 75 75 A I H X S+ 0 0 2 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.892 112.3 49.2 -57.2 -48.7 -6.8 36.9 28.2 76 76 A H H X S+ 0 0 35 -4,-2.0 4,-1.3 -5,-0.2 -2,-0.2 0.911 110.6 52.4 -58.6 -46.3 -7.7 40.0 26.1 77 77 A T H >X S+ 0 0 9 -4,-2.6 4,-2.8 1,-0.2 3,-0.7 0.951 110.7 44.3 -56.5 -53.7 -10.2 37.9 24.1 78 78 A M H 3X S+ 0 0 6 -4,-2.6 4,-2.2 1,-0.3 5,-0.2 0.790 108.3 58.0 -65.4 -28.4 -12.1 36.5 27.2 79 79 A S H 3X S+ 0 0 18 -4,-2.0 4,-1.2 -5,-0.2 -1,-0.3 0.846 112.2 42.5 -69.3 -30.9 -12.2 39.9 28.9 80 80 A L H <>S- 0 0 4 -4,-0.6 3,-2.3 -3,-0.5 5,-2.2 0.010 79.5-106.2 -47.0 148.3 -22.4 39.6 28.1 86 86 A P T 3 5S+ 0 0 40 0, 0.0 -1,-0.1 0, 0.0 288,-0.1 0.820 120.9 50.8 -43.9 -45.8 -26.1 40.7 28.9 87 87 A C T 3 5S+ 0 0 42 2,-0.1 287,-0.3 286,-0.1 -2,-0.1 0.585 119.0 40.5 -72.9 -12.0 -25.3 41.5 32.5 88 88 A M T < 5S- 0 0 22 -3,-2.3 -4,-0.2 -6,-0.1 -5,-0.1 0.544 137.9 -30.0-102.2-108.6 -22.3 43.6 31.4 89 89 A D T 5S- 0 0 58 -6,-2.3 -5,-0.2 -7,-0.2 -4,-0.1 0.563 74.0-145.4 -91.2 -12.2 -22.5 45.9 28.4 90 90 A N < + 0 0 94 -5,-2.2 2,-0.3 -7,-0.3 -5,-0.2 0.939 32.1 169.6 47.5 71.6 -25.0 43.7 26.6 91 91 A D - 0 0 71 -7,-1.7 -1,-0.2 1,-0.1 11,-0.1 -0.870 35.2-161.1-115.9 147.8 -23.9 44.2 23.0 92 92 A D S S+ 0 0 105 -2,-0.3 7,-2.3 6,-0.1 2,-0.3 0.662 78.7 43.1 -95.9 -25.9 -25.0 42.3 19.9 93 93 A L E +A 98 0A 96 5,-0.3 2,-0.2 -9,-0.0 -1,-0.1 -0.857 46.7 170.8-125.0 161.5 -22.0 43.4 17.9 94 94 A R E > S-A 97 0A 72 3,-1.9 3,-1.2 -2,-0.3 -10,-0.0 -0.789 87.0 -1.0-161.4 115.9 -18.2 43.8 18.2 95 95 A R T 3 S- 0 0 125 1,-0.3 -2,-0.0 -2,-0.2 0, 0.0 0.883 129.5 -62.1 66.2 40.8 -16.2 44.6 15.0 96 96 A G T 3 S+ 0 0 56 1,-0.2 -1,-0.3 0, 0.0 -3,-0.0 0.229 118.8 100.0 73.5 -16.0 -19.4 44.4 13.0 97 97 A K E < S-A 94 0A 134 -3,-1.2 -3,-1.9 1,-0.1 -1,-0.2 -0.714 83.8 -84.4-106.1 154.6 -20.0 40.7 13.9 98 98 A P E -A 93 0A 65 0, 0.0 -5,-0.3 0, 0.0 -1,-0.1 -0.188 49.6-108.7 -54.5 136.5 -22.4 39.1 16.5 99 99 A T >> - 0 0 3 -7,-2.3 4,-1.0 1,-0.1 3,-1.0 -0.151 33.6-100.5 -64.5 164.5 -21.0 38.9 20.0 100 100 A N H >> S+ 0 0 3 1,-0.3 4,-1.7 2,-0.2 3,-0.6 0.880 120.0 47.7 -57.1 -45.6 -20.0 35.5 21.4 101 101 A H H 3> S+ 0 0 4 -20,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.683 104.2 63.3 -71.6 -15.7 -23.2 34.9 23.5 102 102 A M H <4 S+ 0 0 92 -3,-1.0 -1,-0.2 2,-0.2 -2,-0.2 0.783 113.6 32.8 -76.8 -30.3 -25.4 35.8 20.6 103 103 A A H << S+ 0 0 53 -4,-1.0 -2,-0.2 -3,-0.6 -1,-0.2 0.684 138.0 21.3 -99.6 -14.6 -24.1 32.9 18.5 104 104 A F H < S- 0 0 17 -4,-1.7 4,-0.4 -5,-0.2 -3,-0.2 0.520 107.5-109.4-126.7 -12.9 -23.5 30.5 21.4 105 105 A G X - 0 0 31 -4,-1.6 4,-1.9 -5,-0.3 5,-0.2 -0.005 34.6 -79.4 94.8 154.8 -25.6 31.6 24.2 106 106 A E H > S+ 0 0 103 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.903 123.8 52.2 -55.8 -51.6 -24.8 33.1 27.5 107 107 A S H > S+ 0 0 39 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.922 111.4 44.7 -55.1 -53.8 -23.8 30.0 29.3 108 108 A V H > S+ 0 0 8 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.832 113.3 51.8 -61.8 -34.6 -21.3 28.8 26.7 109 109 A A H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.927 109.5 48.7 -71.5 -44.1 -19.8 32.3 26.3 110 110 A V H X S+ 0 0 14 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.965 118.0 40.9 -57.3 -51.7 -19.3 32.6 30.0 111 111 A L H X S+ 0 0 14 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.850 111.2 55.6 -68.3 -33.8 -17.6 29.2 30.2 112 112 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.942 108.8 50.0 -62.1 -46.0 -15.6 29.7 26.9 113 113 A G H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.900 108.7 51.0 -56.1 -49.0 -14.2 32.8 28.4 114 114 A D H X S+ 0 0 26 -4,-2.1 4,-2.2 1,-0.2 5,-0.2 0.888 108.5 53.7 -59.7 -35.6 -13.2 30.9 31.6 115 115 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 -1,-0.2 0.894 106.5 50.1 -64.6 -42.6 -11.6 28.3 29.4 116 116 A L H X S+ 0 0 0 -4,-1.9 4,-1.2 2,-0.2 -1,-0.2 0.842 109.7 54.0 -62.1 -38.0 -9.4 30.9 27.6 117 117 A L H X S+ 0 0 5 -4,-1.9 4,-0.8 2,-0.2 -2,-0.2 0.921 115.5 35.5 -65.5 -45.5 -8.4 32.3 31.0 118 118 A S H >X S+ 0 0 8 -4,-2.2 4,-2.1 1,-0.2 3,-0.5 0.889 114.0 57.1 -80.9 -32.6 -7.2 29.1 32.5 119 119 A F H 3X S+ 0 0 26 -4,-2.8 4,-2.9 -5,-0.2 -1,-0.2 0.750 97.1 65.3 -62.4 -26.6 -5.8 27.7 29.2 120 120 A A H 3X S+ 0 0 0 -4,-1.2 4,-2.0 2,-0.2 -1,-0.2 0.900 107.0 41.2 -63.3 -40.6 -3.6 30.8 28.9 121 121 A F H > - 0 0 47 0, 0.0 4,-1.7 0, 0.0 3,-1.2 -0.309 35.8-110.6 -67.2 155.6 14.4 27.8 33.2 133 133 A P H 3> S+ 0 0 38 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.840 116.4 55.4 -54.8 -42.8 11.4 26.9 35.4 134 134 A E H 3> S+ 0 0 96 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.739 108.1 52.8 -67.2 -18.2 11.8 29.8 37.8 135 135 A R H <> S+ 0 0 87 -3,-1.2 4,-1.7 2,-0.2 -1,-0.2 0.907 111.0 43.1 -81.0 -44.9 11.7 32.1 34.8 136 136 A I H X S+ 0 0 6 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.898 115.8 50.1 -67.9 -38.0 8.4 30.7 33.5 137 137 A V H X S+ 0 0 3 -4,-3.0 4,-2.6 1,-0.2 5,-0.2 0.960 107.8 52.2 -65.7 -45.9 6.9 30.6 37.0 138 138 A R H X S+ 0 0 93 -4,-1.4 4,-1.7 -5,-0.3 -1,-0.2 0.889 110.3 49.7 -55.6 -39.8 8.0 34.2 37.6 139 139 A V H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.838 106.7 54.3 -69.0 -34.8 6.2 35.1 34.3 140 140 A L H X S+ 0 0 0 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.908 108.2 51.6 -66.3 -35.8 3.0 33.2 35.3 141 141 A G H X S+ 0 0 10 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.904 108.9 49.2 -66.4 -42.2 3.0 35.3 38.4 142 142 A E H X S+ 0 0 39 -4,-1.7 4,-1.8 -5,-0.2 -1,-0.2 0.805 110.4 50.5 -64.7 -34.3 3.4 38.5 36.4 143 143 A L H X S+ 0 0 0 -4,-1.8 4,-1.0 2,-0.2 -2,-0.2 0.938 111.0 49.5 -68.4 -43.0 0.5 37.5 34.1 144 144 A A H >X S+ 0 0 0 -4,-2.4 4,-1.2 1,-0.2 3,-0.5 0.886 110.3 50.6 -65.9 -37.7 -1.7 36.8 37.1 145 145 A V H 3< S+ 0 0 49 -4,-2.3 3,-0.5 1,-0.2 5,-0.5 0.941 109.1 50.0 -67.2 -44.2 -0.9 40.1 38.7 146 146 A S H 3< S+ 0 0 9 -4,-1.8 6,-2.0 1,-0.2 -1,-0.2 0.622 116.0 41.1 -71.4 -11.7 -1.7 42.1 35.6 147 147 A I H << S+ 0 0 5 -4,-1.0 6,-1.6 -3,-0.5 -1,-0.2 0.585 105.8 64.4-112.9 -6.7 -5.1 40.5 35.0 148 148 A G S >< S- 0 0 4 -4,-1.2 3,-2.6 -3,-0.5 6,-1.5 0.205 107.7 -41.1 -94.8-147.9 -6.6 40.1 38.5 149 149 A S T 3 S+ 0 0 13 233,-0.4 161,-0.1 1,-0.3 -4,-0.1 0.440 139.3 40.3 -62.3 -4.8 -7.9 42.3 41.4 150 150 A E T 3 S+ 0 0 101 -5,-0.5 -1,-0.3 232,-0.1 2,-0.1 0.116 127.7 27.7-124.5 11.4 -4.9 44.7 41.0 151 151 A G S <> S- 0 0 0 -3,-2.6 4,-1.7 -7,-0.1 3,-0.4 -0.190 122.4 -10.5-136.9-128.6 -5.0 44.6 37.2 152 152 A L H >> S+ 0 0 18 -6,-2.0 4,-2.6 1,-0.2 3,-0.7 0.943 127.7 50.3 -46.0 -65.6 -7.6 44.1 34.4 153 153 A V H 3> S+ 0 0 7 -6,-1.6 4,-3.2 1,-0.3 -1,-0.2 0.843 108.3 54.7 -45.4 -41.5 -10.5 42.8 36.5 154 154 A A H 3> S+ 0 0 0 -6,-1.5 4,-3.3 -3,-0.4 5,-0.3 0.924 108.8 47.8 -62.9 -43.0 -10.2 45.8 39.0 155 155 A G H < S+ 0 0 46 -4,-1.9 3,-1.9 -5,-0.3 -2,-0.2 0.960 107.6 51.9 -69.6 -50.4 -15.8 50.8 35.7 160 160 A V H >< S+ 0 0 18 -4,-2.2 3,-0.6 1,-0.3 -2,-0.2 0.833 112.1 45.7 -54.2 -35.8 -19.0 48.7 36.3 161 161 A C T 3< S+ 0 0 54 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.332 108.6 58.7 -90.7 4.7 -19.7 50.4 39.7 162 162 A S T < S+ 0 0 20 -3,-1.9 -1,-0.2 -4,-0.1 -2,-0.2 0.080 76.8 89.8-119.8 19.6 -19.0 54.0 38.3 163 163 A E S < S+ 0 0 127 -3,-0.6 -2,-0.1 1,-0.2 -1,-0.1 0.538 91.4 43.6 -95.0 -9.2 -21.6 54.1 35.5 164 164 A G S S+ 0 0 86 1,-0.1 2,-0.9 -3,-0.1 -1,-0.2 0.403 97.4 82.4-109.7 -2.7 -24.4 55.6 37.6 165 165 A M - 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