==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-AUG-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 26-JUL-11 3T55 . COMPND 2 MOLECULE: INDOLE-3-GLYCEROL PHOSPHATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR M.C.M.REDDY,J.B.BRUNING,C.THURMAN,J.C.SACCHETTINI,TB STRUCTU . 258 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10130.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 195 75.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 38 14.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 1.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 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 . 20 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 25 9.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 93 36.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.9 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 1 1 0 0 4 3 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 2 3 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 PARALLEL BRIDGES PER LADDER . 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 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 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 5 A T > 0 0 80 0, 0.0 4,-1.7 0, 0.0 189,-0.2 0.000 360.0 360.0 360.0 3.7 -21.5 -7.4 -18.4 2 6 A V H > + 0 0 45 188,-2.3 4,-2.3 187,-0.2 188,-0.2 0.844 360.0 59.5 -59.4 -34.8 -21.0 -3.6 -17.9 3 7 A L H > S+ 0 0 18 186,-0.3 4,-2.9 2,-0.2 -1,-0.2 0.944 103.3 48.4 -56.1 -49.5 -17.4 -4.9 -17.5 4 8 A D H > S+ 0 0 103 1,-0.3 4,-2.2 2,-0.2 -1,-0.2 0.883 110.5 48.4 -68.1 -40.4 -17.5 -6.3 -21.0 5 9 A S H X S+ 0 0 51 -4,-1.7 4,-1.5 2,-0.2 -1,-0.3 0.886 113.5 49.5 -62.0 -39.6 -18.9 -3.2 -22.7 6 10 A I H X S+ 0 0 7 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.952 112.0 50.2 -63.0 -42.7 -16.2 -1.2 -20.8 7 11 A L H X S+ 0 0 9 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.792 105.0 53.0 -66.6 -35.8 -13.6 -3.7 -22.0 8 12 A E H X S+ 0 0 65 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.922 111.3 48.5 -68.6 -40.7 -14.5 -3.7 -25.8 9 13 A G H X S+ 0 0 4 -4,-1.5 4,-2.4 -5,-0.2 -2,-0.2 0.897 111.5 51.0 -57.3 -46.4 -14.2 0.1 -25.7 10 14 A V H X S+ 0 0 4 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.887 107.9 50.8 -61.2 -47.0 -10.8 -0.2 -23.9 11 15 A R H X S+ 0 0 121 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.917 113.0 46.3 -61.3 -42.8 -9.4 -2.7 -26.4 12 16 A A H X S+ 0 0 51 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.934 113.4 48.7 -61.8 -45.7 -10.3 -0.4 -29.3 13 17 A D H X S+ 0 0 36 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.896 112.2 48.5 -67.3 -40.3 -8.9 2.7 -27.5 14 18 A V H X S+ 0 0 0 -4,-2.7 4,-2.7 2,-0.2 -1,-0.2 0.908 111.1 50.2 -62.2 -47.6 -5.6 0.9 -26.7 15 19 A A H X S+ 0 0 52 -4,-2.3 4,-2.2 -5,-0.2 -2,-0.2 0.935 110.6 49.9 -57.1 -46.0 -5.2 -0.3 -30.3 16 20 A A H X S+ 0 0 67 -4,-2.5 4,-0.9 1,-0.2 -2,-0.2 0.939 113.5 46.0 -61.9 -43.0 -5.8 3.2 -31.6 17 21 A R H >X S+ 0 0 66 -4,-2.5 4,-2.3 1,-0.2 3,-0.8 0.907 110.0 53.5 -62.2 -41.7 -3.2 4.6 -29.1 18 22 A E H 3< S+ 0 0 59 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.843 100.6 61.2 -66.0 -33.3 -0.8 1.9 -30.0 19 23 A A H 3< S+ 0 0 91 -4,-2.2 -1,-0.3 1,-0.2 3,-0.2 0.790 115.1 34.3 -59.6 -29.8 -1.1 2.8 -33.7 20 24 A S H << S+ 0 0 90 -4,-0.9 2,-0.4 -3,-0.8 -2,-0.2 0.726 129.9 33.6 -98.3 -22.5 0.2 6.2 -32.9 21 25 A V S < S- 0 0 53 -4,-2.3 -1,-0.3 -5,-0.1 5,-0.1 -0.886 90.7-140.8-134.2 93.1 2.7 5.2 -30.1 22 26 A S > - 0 0 44 -2,-0.4 4,-2.0 -3,-0.2 5,-0.2 0.001 22.3-110.1 -49.0 157.6 4.1 1.7 -31.0 23 27 A L H > S+ 0 0 55 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.865 119.6 55.7 -60.0 -37.2 4.7 -0.9 -28.3 24 28 A S H > S+ 0 0 92 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.886 108.3 47.1 -63.0 -40.0 8.5 -0.4 -28.9 25 29 A E H > S+ 0 0 111 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.890 113.9 46.6 -69.4 -38.5 8.2 3.3 -28.1 26 30 A I H X S+ 0 0 8 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.850 111.5 51.7 -74.9 -32.8 6.1 2.8 -25.0 27 31 A K H X S+ 0 0 84 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.943 112.2 47.0 -62.1 -44.6 8.5 0.0 -23.8 28 32 A A H X S+ 0 0 61 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.838 112.3 49.2 -65.8 -37.1 11.4 2.5 -24.3 29 33 A A H X S+ 0 0 42 -4,-2.2 4,-1.0 2,-0.2 -1,-0.2 0.865 112.4 48.2 -72.5 -32.4 9.5 5.2 -22.5 30 34 A A H >< S+ 0 0 3 -4,-2.0 3,-0.7 2,-0.2 -2,-0.2 0.943 112.9 48.0 -69.9 -50.7 8.7 2.9 -19.6 31 35 A A H 3< S+ 0 0 85 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.855 114.1 48.1 -56.2 -37.5 12.3 1.7 -19.4 32 36 A A H 3< S+ 0 0 84 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.686 90.1 102.3 -82.2 -17.0 13.4 5.3 -19.5 33 37 A A S << S- 0 0 21 -4,-1.0 96,-0.1 -3,-0.7 97,-0.1 -0.201 87.6 -89.9 -71.3 154.3 11.0 6.6 -16.8 34 38 A P - 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.440 61.6 -87.8 -65.5 142.6 12.3 7.3 -13.2 35 39 A P - 0 0 109 0, 0.0 123,-0.1 0, 0.0 -4,-0.0 0.011 48.5 -99.0 -59.2 155.0 11.9 4.1 -11.2 36 40 A P - 0 0 30 0, 0.0 97,-0.1 0, 0.0 2,-0.1 -0.331 37.8-106.0 -66.9 151.3 8.6 3.5 -9.4 37 41 A L - 0 0 64 1,-0.1 2,-1.4 75,-0.1 3,-0.1 -0.369 39.0 -98.3 -66.9 155.6 8.1 4.3 -5.8 38 42 A D > + 0 0 110 1,-0.2 4,-1.7 -2,-0.1 5,-0.1 -0.677 44.1 178.1 -82.3 87.7 8.0 1.4 -3.3 39 43 A V H > S+ 0 0 0 -2,-1.4 4,-2.7 94,-0.3 5,-0.2 0.855 75.0 60.1 -62.7 -37.5 4.2 1.1 -2.9 40 44 A M H > S+ 0 0 19 1,-0.2 4,-1.2 2,-0.2 -1,-0.2 0.947 105.3 49.5 -59.1 -43.4 4.5 -1.9 -0.5 41 45 A A H >> S+ 0 0 49 1,-0.2 3,-0.7 2,-0.2 4,-0.5 0.925 111.4 48.8 -60.7 -45.3 6.5 0.2 1.9 42 46 A A H >< S+ 0 0 10 -4,-1.7 3,-1.3 1,-0.3 -1,-0.2 0.924 110.1 51.8 -60.8 -39.7 3.8 3.0 1.7 43 47 A L H 3< S+ 0 0 4 -4,-2.7 -1,-0.3 1,-0.3 6,-0.2 0.714 106.1 56.6 -69.3 -18.8 1.0 0.5 2.3 44 48 A R H << S+ 0 0 157 -4,-1.2 -1,-0.3 -3,-0.7 -2,-0.2 0.483 79.9 117.4 -97.0 -1.6 2.8 -0.7 5.3 45 49 A E S << S- 0 0 100 -3,-1.3 4,-0.1 -4,-0.5 -3,-0.0 -0.234 79.5 -84.2 -60.9 151.8 3.0 2.6 7.1 46 50 A P S S+ 0 0 124 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.194 95.2 31.5 -54.8 145.7 1.2 3.0 10.4 47 51 A G S S- 0 0 57 -3,-0.1 2,-0.6 2,-0.1 209,-0.1 0.016 103.9 -59.8 89.8 157.4 -2.5 3.8 10.1 48 52 A I - 0 0 47 209,-0.2 186,-0.3 207,-0.2 2,-0.1 -0.664 60.9-127.6 -72.2 118.1 -5.1 2.9 7.6 49 53 A G E -a 234 0A 0 184,-2.5 186,-2.5 -2,-0.6 2,-0.6 -0.446 12.4-143.9 -71.5 141.7 -4.0 4.3 4.3 50 54 A V E -a 235 0A 1 31,-0.4 33,-2.5 184,-0.2 34,-1.4 -0.944 7.3-162.7-108.8 118.5 -6.3 6.5 2.2 51 55 A I E -ab 236 84A 0 184,-3.1 186,-2.8 -2,-0.6 2,-0.5 -0.938 16.6-156.7-100.6 110.0 -6.0 6.0 -1.5 52 56 A A E -ab 237 85A 0 32,-2.3 34,-2.3 -2,-0.8 2,-0.3 -0.789 8.1-139.7 -98.6 131.6 -7.6 9.1 -2.8 53 57 A E E - b 0 86A 0 184,-3.2 2,-0.6 -2,-0.5 34,-0.2 -0.721 13.4-151.4-108.6 141.6 -9.0 9.0 -6.3 54 58 A V E + b 0 87A 2 32,-3.0 34,-2.7 -2,-0.3 2,-0.3 -0.906 40.4 147.4 -99.1 112.1 -9.1 11.4 -9.3 55 59 A K - 0 0 18 -2,-0.6 40,-0.1 183,-0.2 12,-0.1 -0.893 32.3-170.7-157.1 121.4 -12.3 10.4 -11.2 56 60 A R S S- 0 0 47 38,-0.8 8,-3.2 -2,-0.3 9,-2.2 0.713 72.3 -11.1 -86.2 -32.5 -14.6 12.8 -13.2 57 61 A A E -I 63 0B 9 37,-0.9 6,-0.2 6,-0.3 -1,-0.2 -0.960 54.9-162.0-158.2 171.0 -17.4 10.4 -13.9 58 62 A S E > -I 62 0B 7 4,-1.5 4,-2.7 -2,-0.3 36,-0.1 -0.974 37.1-109.4-156.3 158.8 -18.6 6.7 -13.7 59 63 A P T 4 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.861 120.4 44.4 -54.5 -38.5 -21.3 4.5 -15.2 60 64 A S T 4 S+ 0 0 58 1,-0.1 133,-0.0 2,-0.1 0, 0.0 0.923 126.0 28.0 -77.2 -41.2 -22.9 4.3 -11.8 61 65 A A T 4 S- 0 0 43 1,-0.3 2,-0.2 0, 0.0 -1,-0.1 0.659 88.1-151.4 -94.8 -20.9 -22.7 8.0 -10.8 62 66 A G E < +I 58 0B 36 -4,-2.7 -4,-1.5 31,-0.1 -1,-0.3 -0.532 68.4 6.6 73.5-153.1 -22.7 9.9 -14.1 63 67 A A E +I 57 0B 97 -6,-0.2 -6,-0.3 1,-0.2 3,-0.1 -0.406 65.0 167.9 -64.1 125.5 -20.8 13.2 -14.0 64 68 A L - 0 0 34 -8,-3.2 2,-0.3 1,-0.4 -7,-0.2 0.777 61.5 -15.5-106.3 -51.5 -19.0 13.6 -10.7 65 69 A A - 0 0 26 -9,-2.2 -1,-0.4 1,-0.1 178,-0.1 -0.983 46.0-131.9-160.6 150.1 -16.7 16.5 -11.2 66 70 A T - 0 0 125 -2,-0.3 -1,-0.1 -3,-0.1 -10,-0.1 0.866 32.4-167.8 -77.1 -30.8 -15.2 18.5 -14.0 67 71 A I + 0 0 17 175,-0.2 -11,-0.1 1,-0.1 -2,-0.1 0.942 12.9 173.9 35.1 69.0 -11.6 18.3 -12.5 68 72 A A S S+ 0 0 102 1,-0.3 -1,-0.1 2,-0.1 4,-0.0 0.728 76.5 35.9 -67.5 -23.5 -10.1 20.9 -14.8 69 73 A D > + 0 0 75 1,-0.1 4,-1.7 2,-0.1 -1,-0.3 -0.693 63.1 170.6-137.6 78.8 -6.9 20.6 -12.7 70 74 A P H > S+ 0 0 9 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.844 80.2 59.9 -63.1 -33.1 -6.2 17.1 -11.6 71 75 A A H > S+ 0 0 17 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.947 105.9 48.7 -55.7 -51.1 -2.7 18.0 -10.4 72 76 A K H > S+ 0 0 132 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.877 110.9 50.5 -59.3 -39.9 -4.3 20.5 -8.0 73 77 A L H X S+ 0 0 20 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.950 110.5 48.9 -60.5 -46.0 -6.8 17.9 -6.7 74 78 A A H X S+ 0 0 0 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.850 107.4 56.4 -65.9 -35.9 -3.9 15.4 -6.1 75 79 A Q H X S+ 0 0 85 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.899 107.1 48.5 -55.9 -42.4 -2.0 18.2 -4.2 76 80 A A H X S+ 0 0 17 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.903 110.2 52.1 -61.8 -44.3 -5.0 18.6 -1.9 77 81 A Y H <>S+ 0 0 0 -4,-2.2 5,-2.3 2,-0.2 4,-0.4 0.946 111.5 45.0 -61.6 -49.7 -5.1 14.9 -1.4 78 82 A Q H ><5S+ 0 0 66 -4,-2.7 3,-1.8 1,-0.2 -2,-0.2 0.940 112.0 53.1 -58.3 -45.3 -1.4 14.7 -0.5 79 83 A D H 3<5S+ 0 0 127 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.801 106.6 54.7 -57.2 -36.1 -1.8 17.8 1.8 80 84 A G T 3<5S- 0 0 6 -4,-1.9 -1,-0.3 -3,-0.2 175,-0.3 0.488 127.7 -96.4 -79.2 -2.7 -4.6 15.9 3.5 81 85 A G T < 5 + 0 0 34 -3,-1.8 -31,-0.4 -4,-0.4 -3,-0.2 0.597 61.4 167.6 100.5 11.4 -2.5 12.9 4.3 82 86 A A < - 0 0 4 -5,-2.3 -1,-0.2 -6,-0.2 -31,-0.2 -0.371 26.7-153.7 -61.9 142.4 -3.5 10.6 1.4 83 87 A R S S+ 0 0 25 -33,-2.5 2,-0.3 1,-0.3 -32,-0.2 0.809 75.5 4.7 -83.6 -38.6 -1.1 7.5 1.1 84 88 A I E -b 51 0A 0 -34,-1.4 -32,-2.3 26,-0.2 2,-0.5 -0.991 67.2-133.0-143.9 148.4 -1.6 7.0 -2.6 85 89 A V E -bc 52 112A 0 26,-3.0 28,-3.2 -2,-0.3 2,-0.5 -0.931 15.5-154.7-110.7 129.0 -3.4 8.8 -5.4 86 90 A S E -bc 53 113A 0 -34,-2.3 -32,-3.0 -2,-0.5 2,-0.5 -0.857 8.5-166.3 -94.7 130.0 -5.5 6.8 -7.8 87 91 A V E -bc 54 114A 0 26,-2.5 28,-2.5 -2,-0.5 2,-0.4 -0.975 12.8-143.4-123.1 115.0 -6.0 8.3 -11.2 88 92 A V E + c 0 115A 8 -34,-2.7 9,-0.6 -2,-0.5 28,-0.2 -0.647 20.5 176.4 -77.2 128.7 -8.6 6.9 -13.4 89 93 A T + 0 0 5 26,-1.9 2,-0.5 -2,-0.4 9,-0.3 0.297 37.8 116.7-115.9 4.0 -7.5 6.9 -17.0 90 94 A E - 0 0 3 25,-0.5 6,-2.2 7,-0.1 4,-0.4 -0.732 46.0-164.5 -78.7 127.8 -10.4 5.3 -18.9 91 95 A Q S > S+ 0 0 45 -2,-0.5 4,-0.7 4,-0.3 -1,-0.1 0.779 70.2 52.8 -85.3 -38.1 -11.8 7.8 -21.3 92 96 A R T 4 S+ 0 0 119 2,-0.1 -1,-0.1 1,-0.1 -2,-0.0 0.814 124.5 16.1 -81.4 -36.0 -15.3 6.6 -22.4 93 97 A R T 4 S+ 0 0 70 -36,-0.1 -1,-0.1 -87,-0.1 -2,-0.1 0.662 137.6 33.7-105.1 -31.6 -17.1 5.9 -19.2 94 98 A F T 4 S- 0 0 27 -4,-0.4 -37,-0.9 -36,-0.1 -38,-0.8 0.536 91.8-133.1-106.7 -5.0 -14.9 7.8 -16.7 95 99 A Q < + 0 0 105 -4,-0.7 -4,-0.3 1,-0.2 2,-0.2 0.837 61.7 130.2 56.0 36.0 -13.7 10.7 -18.7 96 100 A G - 0 0 6 -6,-2.2 2,-0.3 -41,-0.1 -7,-0.3 -0.552 32.6-178.6-104.3-179.1 -10.1 10.2 -17.6 97 101 A S >> - 0 0 39 -9,-0.6 3,-1.1 -2,-0.2 4,-1.0 -0.981 45.7 -93.6-166.3 167.7 -7.0 10.0 -19.6 98 102 A L H 3> S+ 0 0 22 -2,-0.3 4,-2.4 -9,-0.3 5,-0.2 0.804 116.9 70.3 -56.3 -33.6 -3.2 9.5 -19.4 99 103 A D H 3> S+ 0 0 115 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.850 95.9 53.0 -53.2 -37.1 -2.9 13.3 -19.3 100 104 A D H <> S+ 0 0 10 -3,-1.1 4,-2.6 2,-0.2 -1,-0.2 0.897 107.8 50.4 -63.3 -41.5 -4.4 13.2 -15.8 101 105 A L H X S+ 0 0 0 -4,-1.0 4,-2.7 2,-0.2 -2,-0.2 0.929 111.0 48.4 -64.7 -44.8 -1.8 10.6 -14.8 102 106 A D H X S+ 0 0 65 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.922 112.9 49.0 -57.4 -44.2 1.1 12.8 -16.1 103 107 A A H X S+ 0 0 33 -4,-2.3 4,-0.8 1,-0.2 -2,-0.2 0.893 113.9 44.9 -66.1 -45.3 -0.4 15.9 -14.3 104 108 A V H >X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 3,-1.0 0.938 110.7 53.9 -66.7 -42.8 -0.7 14.0 -11.0 105 109 A R H 3< S+ 0 0 49 -4,-2.7 3,-0.2 1,-0.3 -2,-0.2 0.912 109.6 48.0 -58.6 -42.8 2.8 12.4 -11.2 106 110 A A H 3< S+ 0 0 94 -4,-2.0 -1,-0.3 1,-0.2 -2,-0.2 0.687 115.4 45.8 -71.4 -16.5 4.4 15.8 -11.7 107 111 A S H << S+ 0 0 28 -3,-1.0 2,-0.3 -4,-0.8 -1,-0.2 0.660 106.5 49.7-110.0 -19.6 2.5 17.3 -8.8 108 112 A V < - 0 0 12 -4,-1.7 -33,-0.1 -3,-0.2 4,-0.1 -0.804 52.7-152.1-122.3 165.4 2.7 14.8 -5.9 109 113 A S S S+ 0 0 96 -2,-0.3 -1,-0.1 2,-0.1 3,-0.1 0.581 73.2 91.8-105.0 -15.5 5.4 12.8 -4.0 110 114 A I S S- 0 0 29 1,-0.2 -26,-0.2 -28,-0.1 -2,-0.1 -0.332 91.8 -81.8 -81.0 160.7 3.0 10.0 -2.9 111 115 A P - 0 0 9 0, 0.0 -26,-3.0 0, 0.0 2,-0.5 -0.224 40.3-136.7 -64.7 156.6 2.7 6.9 -5.1 112 116 A V E -c 85 0A 0 19,-0.3 21,-3.3 -28,-0.2 22,-2.0 -0.956 9.0-157.5-121.1 125.1 0.3 6.9 -8.0 113 117 A L E -cd 86 134A 0 -28,-3.2 -26,-2.5 -2,-0.5 2,-0.7 -0.888 14.8-140.0 -96.9 124.4 -2.1 4.1 -8.9 114 118 A R E -cd 87 135A 0 20,-2.7 22,-2.1 -2,-0.5 2,-0.7 -0.813 17.8-160.8 -88.3 118.8 -3.2 3.9 -12.5 115 119 A K E +c 88 0A 30 -28,-2.5 -26,-1.9 -2,-0.7 -25,-0.5 -0.884 41.7 106.9-102.5 105.2 -6.9 2.9 -12.3 116 120 A D S S- 0 0 6 -2,-0.7 2,-1.0 -28,-0.2 -28,-0.0 -0.867 77.6 -78.1-162.2-175.9 -8.0 1.6 -15.7 117 121 A F - 0 0 19 -2,-0.3 2,-0.8 -111,-0.1 20,-0.1 -0.816 42.4-155.9-107.6 93.5 -9.0 -1.8 -17.2 118 122 A V + 0 0 2 -2,-1.0 20,-0.3 18,-0.5 23,-0.1 -0.601 34.8 146.5 -77.5 106.4 -5.7 -3.5 -18.0 119 123 A V + 0 0 12 -2,-0.8 -1,-0.2 1,-0.2 31,-0.0 0.600 61.0 36.8-110.0 -17.1 -6.4 -6.0 -20.8 120 124 A Q S >> S- 0 0 47 1,-0.1 3,-1.1 30,-0.0 4,-0.7 -0.972 77.4-114.2-141.6 154.4 -3.0 -6.0 -22.6 121 125 A P H >> S+ 0 0 53 0, 0.0 4,-1.7 0, 0.0 3,-1.2 0.831 108.9 69.9 -57.3 -34.0 0.7 -5.7 -22.0 122 126 A Y H 3> S+ 0 0 4 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.889 95.8 52.6 -47.7 -48.5 0.8 -2.3 -23.8 123 127 A Q H <> S+ 0 0 0 -3,-1.1 4,-2.3 2,-0.2 -1,-0.3 0.761 104.8 56.5 -63.3 -27.5 -1.1 -0.7 -21.0 124 128 A I H S+ 0 0 0 -4,-2.3 5,-2.4 2,-0.2 3,-0.4 0.957 113.1 45.7 -53.0 -51.5 1.3 2.9 -17.1 128 132 A R H ><5S+ 0 0 7 -4,-2.1 3,-1.4 1,-0.2 -2,-0.2 0.887 109.8 54.4 -61.5 -43.0 5.1 2.8 -16.2 129 133 A A H 3<5S+ 0 0 24 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.799 108.3 49.6 -57.8 -36.2 5.9 5.3 -19.0 130 134 A H T 3<5S- 0 0 46 -4,-1.6 -1,-0.3 -3,-0.4 -25,-0.2 0.320 126.3 -97.2 -94.0 10.4 3.4 7.7 -17.6 131 135 A G T < 5 + 0 0 6 -3,-1.4 -19,-0.3 1,-0.2 -3,-0.2 0.520 65.1 157.0 96.9 6.5 4.7 7.5 -14.0 132 136 A A < - 0 0 0 -5,-2.4 -1,-0.2 -6,-0.2 -19,-0.2 -0.368 20.7-176.4 -69.0 141.5 2.4 4.9 -12.3 133 137 A D S S+ 0 0 1 -21,-3.3 27,-2.0 1,-0.3 2,-0.4 0.558 74.9 35.6-103.1 -21.4 3.8 3.1 -9.3 134 138 A M E S-de 113 160A 0 -22,-2.0 -20,-2.7 25,-0.2 2,-0.4 -0.971 71.1-159.8-137.8 142.6 0.8 0.9 -8.8 135 139 A L E -de 114 161A 0 25,-2.6 27,-2.6 -2,-0.4 2,-0.5 -0.994 17.1-126.8-131.2 132.7 -1.4 -0.6 -11.4 136 140 A L E - e 0 162A 6 -22,-2.1 -18,-0.5 -2,-0.4 2,-0.4 -0.654 22.7-176.6 -76.5 132.7 -4.8 -2.0 -11.1 137 141 A L E - e 0 163A 0 25,-2.2 27,-3.0 -2,-0.5 2,-0.7 -0.995 15.2-150.4-121.7 126.9 -5.4 -5.6 -12.4 138 142 A I E >> - e 0 164A 7 -2,-0.4 3,-1.6 -20,-0.3 4,-0.7 -0.888 4.1-158.6-104.7 111.5 -9.1 -6.8 -12.3 139 143 A V G >4 S+ 0 0 0 25,-2.0 3,-1.4 -2,-0.7 -1,-0.2 0.897 93.6 57.0 -54.2 -42.6 -9.5 -10.6 -11.7 140 144 A A G 34 S+ 0 0 60 24,-0.4 -1,-0.3 1,-0.3 25,-0.1 0.641 109.0 48.6 -64.0 -15.9 -13.1 -10.6 -13.2 141 145 A A G <4 S+ 0 0 22 -3,-1.6 2,-0.5 1,-0.1 -1,-0.3 0.596 107.2 64.6 -89.7 -16.0 -11.6 -9.1 -16.3 142 146 A L S << S- 0 0 8 -3,-1.4 2,-0.1 -4,-0.7 -1,-0.1 -0.939 73.8-130.5-129.1 126.9 -8.8 -11.5 -16.8 143 147 A E >> - 0 0 113 -2,-0.5 4,-3.0 1,-0.1 3,-1.0 -0.463 42.7-108.0 -63.7 141.4 -8.5 -15.2 -17.5 144 148 A Q H 3> S+ 0 0 47 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.805 116.3 49.9 -47.2 -44.3 -6.0 -16.7 -14.9 145 149 A S H 3> S+ 0 0 77 2,-0.2 4,-1.8 1,-0.2 -1,-0.3 0.892 114.8 45.9 -66.6 -35.2 -3.0 -17.3 -17.3 146 150 A V H <> S+ 0 0 57 -3,-1.0 4,-2.9 2,-0.2 5,-0.3 0.924 111.7 53.3 -69.9 -44.4 -3.3 -13.7 -18.5 147 151 A L H X S+ 0 0 0 -4,-3.0 4,-3.1 1,-0.2 5,-0.3 0.968 108.0 50.0 -51.4 -56.9 -3.7 -12.5 -14.9 148 152 A V H X S+ 0 0 61 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.891 114.7 42.8 -52.3 -45.4 -0.5 -14.3 -13.9 149 153 A S H X S+ 0 0 59 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.854 113.0 50.9 -75.5 -37.6 1.5 -12.8 -16.8 150 154 A M H X S+ 0 0 2 -4,-2.9 4,-2.7 2,-0.2 -1,-0.2 0.914 113.0 48.1 -60.6 -42.5 0.1 -9.3 -16.4 151 155 A L H X S+ 0 0 4 -4,-3.1 4,-2.2 -5,-0.3 5,-0.2 0.953 113.2 47.4 -61.0 -49.4 1.0 -9.5 -12.7 152 156 A D H X S+ 0 0 108 -4,-2.4 4,-1.9 -5,-0.3 -2,-0.2 0.905 113.1 47.7 -58.4 -44.6 4.5 -10.8 -13.5 153 157 A R H X S+ 0 0 81 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.906 109.7 53.5 -68.3 -43.0 5.0 -8.1 -16.1 154 158 A T H ><>S+ 0 0 0 -4,-2.7 5,-1.6 1,-0.2 3,-0.6 0.920 112.8 43.2 -49.0 -51.8 3.8 -5.3 -13.8 155 159 A E H ><5S+ 0 0 63 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.843 105.4 61.9 -72.4 -28.2 6.2 -6.4 -11.0 156 160 A S H 3<5S+ 0 0 84 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.731 103.3 52.8 -69.9 -18.7 9.1 -6.8 -13.5 157 161 A L T <<5S- 0 0 34 -4,-0.9 -1,-0.3 -3,-0.6 -2,-0.2 0.353 124.9-106.5 -90.5 3.0 8.6 -3.0 -14.2 158 162 A G T < 5S+ 0 0 42 -3,-1.7 -3,-0.2 1,-0.3 2,-0.1 0.314 79.8 130.2 87.5 -7.2 8.9 -2.3 -10.5 159 163 A M < - 0 0 2 -5,-1.6 2,-0.4 -6,-0.2 -1,-0.3 -0.424 56.4-127.0 -80.2 155.7 5.2 -1.6 -10.1 160 164 A T E -e 134 0A 17 -27,-2.0 -25,-2.6 -2,-0.1 2,-0.5 -0.813 20.6-135.1 -99.2 134.6 2.9 -3.1 -7.5 161 165 A A E -e 135 0A 3 -2,-0.4 2,-0.8 -27,-0.2 20,-0.4 -0.803 5.3-154.7 -88.7 132.0 -0.2 -4.8 -8.8 162 166 A L E -e 136 0A 0 -27,-2.6 -25,-2.2 -2,-0.5 2,-0.7 -0.947 19.2-158.8-102.2 97.3 -3.4 -4.0 -6.9 163 167 A V E -ef 137 182A 0 18,-2.1 20,-2.7 -2,-0.8 2,-0.4 -0.766 6.5-150.2 -88.1 115.0 -5.2 -7.1 -7.8 164 168 A E E +ef 138 183A 7 -27,-3.0 -25,-2.0 -2,-0.7 -24,-0.4 -0.755 18.2 178.0 -97.8 131.5 -9.0 -6.4 -7.4 165 169 A V E - f 0 184A 0 18,-3.2 20,-2.0 -2,-0.4 3,-0.1 -0.891 23.1-173.5-126.7 153.0 -11.4 -9.3 -6.4 166 170 A H S S+ 0 0 36 -2,-0.3 2,-0.3 18,-0.2 -1,-0.1 0.433 72.9 37.8-119.0 -6.2 -15.1 -9.4 -5.8 167 171 A T S > S- 0 0 37 1,-0.1 4,-2.5 35,-0.0 -1,-0.2 -0.946 81.4-111.2-145.0 159.5 -15.5 -13.0 -4.5 168 172 A E H > S+ 0 0 58 -2,-0.3 4,-2.8 2,-0.2 5,-0.2 0.901 120.8 54.7 -62.6 -34.1 -13.7 -15.5 -2.4 169 173 A Q H > S+ 0 0 127 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.940 108.4 47.7 -66.6 -42.4 -13.1 -17.5 -5.6 170 174 A E H > S+ 0 0 30 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.888 110.7 53.8 -58.6 -41.4 -11.5 -14.4 -7.3 171 175 A A H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -2,-0.2 0.950 108.2 47.6 -56.4 -55.5 -9.4 -14.0 -4.1 172 176 A D H X S+ 0 0 93 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.935 112.1 51.0 -51.6 -47.7 -8.2 -17.5 -4.3 173 177 A R H X S+ 0 0 76 -4,-2.7 4,-2.1 1,-0.2 -2,-0.2 0.914 110.9 48.5 -53.5 -49.0 -7.4 -16.9 -8.0 174 178 A A H <>S+ 0 0 0 -4,-2.8 5,-2.4 2,-0.2 4,-0.4 0.878 111.1 49.6 -57.4 -45.3 -5.5 -13.6 -7.0 175 179 A L H ><5S+ 0 0 44 -4,-2.9 3,-1.9 1,-0.2 -2,-0.2 0.947 110.2 50.1 -62.2 -45.3 -3.5 -15.4 -4.3 176 180 A K H 3<5S+ 0 0 83 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.868 104.9 59.6 -65.3 -33.3 -2.5 -18.2 -6.8 177 181 A A T 3<5S- 0 0 12 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.624 124.6-103.5 -64.2 -14.9 -1.4 -15.6 -9.2 178 182 A G T < 5 + 0 0 30 -3,-1.9 -3,-0.2 -4,-0.4 -2,-0.1 0.572 56.6 174.3 94.2 15.2 1.1 -14.3 -6.7 179 183 A A < - 0 0 8 -5,-2.4 -1,-0.2 1,-0.2 3,-0.1 -0.269 18.6-179.7 -56.4 136.5 -0.8 -11.1 -5.6 180 184 A K S S+ 0 0 91 -19,-0.3 31,-2.9 1,-0.3 2,-0.4 0.537 76.8 42.8-105.1 -23.7 0.8 -9.2 -2.7 181 185 A V E S- g 0 211A 0 -20,-0.4 -18,-2.1 29,-0.2 2,-0.5 -0.996 71.1-171.5-129.5 123.3 -2.0 -6.6 -2.6 182 186 A I E -fg 163 212A 0 29,-2.8 31,-2.3 -2,-0.4 2,-0.4 -0.974 5.0-161.6-122.5 126.0 -5.6 -7.5 -2.9 183 187 A G E -fg 164 213A 0 -20,-2.7 -18,-3.2 -2,-0.5 2,-0.6 -0.893 6.6-151.7-107.4 137.9 -8.4 -5.1 -3.2 184 188 A V E -fg 165 214A 2 29,-2.5 31,-2.6 -2,-0.4 2,-0.7 -0.954 9.6-154.6-113.6 112.8 -11.9 -6.0 -2.5 185 189 A N E - g 0 215A 8 -20,-2.0 31,-0.2 -2,-0.6 10,-0.1 -0.833 9.7-159.3 -90.6 118.4 -14.4 -4.0 -4.5 186 190 A A S S+ 0 0 1 29,-1.8 9,-2.5 -2,-0.7 2,-0.3 0.782 76.3 85.0 -63.1 -26.8 -17.8 -3.8 -2.8 187 191 A R B S-J 194 0C 35 7,-0.3 2,-0.7 28,-0.2 7,-0.3 -0.602 79.4-136.8 -82.0 136.1 -19.0 -3.0 -6.3 188 192 A D > - 0 0 46 5,-2.9 4,-3.1 -2,-0.3 5,-0.3 -0.826 12.7-156.7 -89.4 115.0 -19.9 -5.8 -8.7 189 193 A L T 4 S+ 0 0 31 -2,-0.7 -186,-0.3 2,-0.2 -187,-0.2 0.742 89.4 57.2 -73.6 -24.1 -18.4 -4.7 -12.0 190 194 A M T 4 S+ 0 0 36 -188,-0.2 -188,-2.3 -189,-0.2 -1,-0.2 0.989 128.9 12.9 -62.2 -54.9 -20.8 -6.8 -14.1 191 195 A T T 4 S- 0 0 89 -190,-0.1 -2,-0.2 2,-0.1 -1,-0.1 0.394 93.3-127.1-106.9 -4.8 -23.9 -5.2 -12.5 192 196 A L < + 0 0 47 -4,-3.1 2,-0.2 1,-0.2 -3,-0.1 0.463 57.6 144.4 69.6 5.3 -22.6 -2.0 -10.7 193 197 A D - 0 0 58 -5,-0.3 -5,-2.9 -6,-0.1 2,-0.8 -0.508 47.3-135.7 -75.2 139.7 -24.3 -3.0 -7.4 194 198 A V B -J 187 0C 50 -7,-0.3 2,-0.7 -2,-0.2 -7,-0.3 -0.838 19.8-172.4-102.2 94.4 -22.3 -2.0 -4.2 195 199 A D > - 0 0 47 -9,-2.5 3,-1.0 -2,-0.8 4,-0.3 -0.775 4.6-170.0 -83.7 109.2 -22.4 -4.9 -1.7 196 200 A R T > S+ 0 0 90 -2,-0.7 3,-0.8 1,-0.2 4,-0.5 0.831 79.3 67.4 -73.3 -27.3 -20.7 -3.6 1.5 197 201 A D T 3> S+ 0 0 110 1,-0.2 4,-1.9 2,-0.1 -1,-0.2 0.615 79.0 87.8 -71.6 -15.5 -20.6 -7.1 3.1 198 202 A C H <> S+ 0 0 0 -3,-1.0 4,-2.7 2,-0.2 5,-0.3 0.868 83.3 49.5 -41.2 -59.2 -18.0 -8.2 0.5 199 203 A F H <> S+ 0 0 3 -3,-0.8 4,-4.5 -4,-0.3 -1,-0.2 0.915 114.2 45.3 -58.1 -44.0 -14.8 -7.1 2.3 200 204 A A H 4 S+ 0 0 52 -4,-0.5 -1,-0.2 1,-0.2 -2,-0.2 0.754 113.0 50.8 -76.7 -29.8 -15.8 -8.7 5.5 201 205 A R H < S+ 0 0 159 -4,-1.9 4,-0.3 2,-0.1 -1,-0.2 0.888 126.5 26.5 -60.5 -45.7 -16.9 -12.0 3.7 202 206 A I H >< S+ 0 0 2 -4,-2.7 3,-0.8 -5,-0.2 4,-0.5 0.852 107.6 66.6 -90.8 -44.4 -13.5 -12.0 1.9 203 207 A A G >< S+ 0 0 0 -4,-4.5 3,-1.7 -5,-0.3 -3,-0.2 0.870 96.5 56.7 -55.8 -45.7 -10.9 -10.3 4.0 204 208 A P G 3 S+ 0 0 89 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.893 101.3 61.2 -52.0 -38.9 -10.9 -12.8 6.8 205 209 A G G < S+ 0 0 49 -3,-0.8 -2,-0.2 -4,-0.3 -3,-0.1 0.679 87.8 95.0 -60.7 -17.9 -10.0 -15.5 4.2 206 210 A L S < S- 0 0 9 -3,-1.7 6,-0.0 -4,-0.5 -34,-0.0 -0.496 83.6-102.4 -87.3 147.9 -6.7 -13.8 3.2 207 211 A P - 0 0 64 0, 0.0 3,-0.5 0, 0.0 -1,-0.1 -0.177 30.9-124.8 -52.2 156.0 -3.2 -14.6 4.4 208 212 A S S S+ 0 0 115 1,-0.2 4,-0.1 3,-0.0 -2,-0.1 0.759 107.7 64.6 -80.1 -22.9 -2.0 -12.0 6.9 209 213 A S S S+ 0 0 95 2,-0.1 2,-0.3 0, 0.0 -1,-0.2 0.739 86.9 87.5 -74.5 -20.0 1.1 -11.3 4.8 210 214 A V S S- 0 0 14 -3,-0.5 2,-0.3 1,-0.1 -29,-0.2 -0.571 83.9-122.3 -81.2 133.8 -1.2 -10.0 1.9 211 215 A I E -g 181 0A 8 -31,-2.9 -29,-2.8 -2,-0.3 2,-0.5 -0.620 24.8-148.1 -78.2 134.0 -2.1 -6.3 2.1 212 216 A R E -g 182 0A 34 -2,-0.3 21,-3.8 19,-0.3 22,-1.0 -0.928 14.8-175.3-112.4 125.6 -5.9 -5.7 2.1 213 217 A I E -gh 183 234A 0 -31,-2.3 -29,-2.5 -2,-0.5 2,-0.7 -0.953 17.4-144.5-118.3 131.9 -7.5 -2.7 0.5 214 218 A A E -gh 184 235A 0 20,-2.4 22,-2.5 -2,-0.4 2,-0.4 -0.913 18.3-163.8 -94.8 116.3 -11.2 -1.9 0.6 215 219 A E E +gh 185 236A 1 -31,-2.6 -29,-1.8 -2,-0.7 -28,-0.2 -0.851 48.1 3.0 -99.4 133.8 -12.3 -0.4 -2.6 216 220 A S S S+ 0 0 17 20,-1.0 3,-0.1 -2,-0.4 20,-0.1 0.379 88.5 68.5 82.1 156.8 -15.6 1.5 -2.7 217 221 A G + 0 0 13 1,-0.2 2,-0.8 -32,-0.0 20,-0.1 0.434 57.8 141.7 80.5 2.1 -18.4 2.4 -0.3 218 222 A V + 0 0 13 18,-0.4 22,-0.4 1,-0.2 -1,-0.2 -0.682 7.9 155.3 -86.5 106.8 -16.4 5.0 1.8 219 223 A R - 0 0 168 -2,-0.8 2,-0.3 1,-0.3 -1,-0.2 0.616 67.8 -35.5 -99.3 -14.0 -18.7 8.0 2.6 220 224 A G S > S- 0 0 21 1,-0.0 4,-2.0 34,-0.0 3,-0.3 -0.952 86.8 -50.3 172.7-170.6 -16.8 9.1 5.7 221 225 A T H > S+ 0 0 45 -2,-0.3 4,-3.0 1,-0.2 5,-0.2 0.844 122.4 61.1 -63.1 -32.3 -14.9 8.0 8.7 222 226 A A H > S+ 0 0 73 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.945 107.0 44.5 -65.9 -43.5 -17.4 5.4 9.8 223 227 A D H > S+ 0 0 28 -3,-0.3 4,-1.9 1,-0.2 -1,-0.2 0.894 113.8 51.6 -64.5 -39.6 -17.1 3.4 6.6 224 228 A L H X S+ 0 0 2 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.947 111.2 47.2 -59.5 -47.0 -13.3 3.7 6.8 225 229 A L H X S+ 0 0 75 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.877 108.7 54.4 -62.6 -41.7 -13.3 2.5 10.4 226 230 A A H X S+ 0 0 64 -4,-2.5 4,-1.1 2,-0.2 -1,-0.2 0.894 111.5 44.2 -57.0 -46.8 -15.6 -0.4 9.6 227 231 A Y H ><>S+ 0 0 18 -4,-1.9 5,-2.6 1,-0.2 3,-0.7 0.927 112.7 53.6 -67.0 -39.8 -13.3 -1.6 6.8 228 232 A A H ><5S+ 0 0 26 -4,-2.8 3,-1.5 1,-0.2 -2,-0.2 0.904 106.6 51.7 -56.7 -41.2 -10.5 -1.0 9.3 229 233 A G H 3<5S+ 0 0 72 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.709 108.1 52.7 -72.9 -19.8 -12.3 -3.2 11.8 230 234 A A T <<5S- 0 0 32 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.249 132.6 -84.4 -97.2 9.3 -12.6 -6.0 9.2 231 235 A G T < 5S+ 0 0 26 -3,-1.5 -19,-0.3 1,-0.2 -3,-0.2 0.349 71.3 156.6 107.9 -4.1 -8.9 -6.1 8.4 232 236 A A < - 0 0 5 -5,-2.6 -1,-0.2 1,-0.2 -19,-0.2 -0.187 25.0-170.3 -53.9 135.9 -8.4 -3.3 5.8 233 237 A D S S+ 0 0 59 -21,-3.8 -184,-2.5 1,-0.4 2,-0.3 0.532 76.8 0.2 -96.3 -16.9 -4.9 -1.9 5.6 234 238 A A E -ah 49 213A 0 -22,-1.0 -20,-2.4 -186,-0.3 -1,-0.4 -0.970 64.9-142.9-165.8 156.5 -6.1 0.9 3.3 235 239 A V E -ah 50 214A 0 -186,-2.5 -184,-3.1 -2,-0.3 2,-0.5 -0.980 12.9-136.5-131.9 144.1 -9.3 2.2 1.7 236 240 A L E -ah 51 215A 6 -22,-2.5 -20,-1.0 -2,-0.4 -18,-0.4 -0.902 24.3-178.2-102.6 132.5 -9.8 3.7 -1.7 237 241 A V E +a 52 0A 6 -186,-2.8 -184,-3.2 -2,-0.5 -151,-0.2 -0.998 21.0 138.3-138.0 127.3 -12.1 6.7 -1.9 238 242 A G >> + 0 0 6 -2,-0.4 4,-2.8 -186,-0.2 3,-1.3 0.577 64.8 53.0-133.0 -66.9 -13.2 8.7 -4.9 239 243 A E H 3> S+ 0 0 69 1,-0.3 4,-1.3 2,-0.2 5,-0.1 0.881 111.6 47.6 -51.1 -50.1 -16.8 9.8 -5.2 240 244 A G H 34 S+ 0 0 39 -22,-0.4 -1,-0.3 1,-0.2 -21,-0.1 0.730 117.9 43.0 -66.9 -19.8 -16.8 11.6 -1.8 241 245 A L H X4 S+ 0 0 3 -3,-1.3 3,-1.7 2,-0.1 -2,-0.2 0.905 110.6 50.5 -88.9 -43.5 -13.5 13.4 -2.5 242 246 A V H 3< S+ 0 0 13 -4,-2.8 -175,-0.2 1,-0.3 -2,-0.2 0.772 112.5 48.1 -66.4 -24.9 -14.0 14.5 -6.1 243 247 A T T 3< S+ 0 0 83 -4,-1.3 -1,-0.3 -5,-0.3 2,-0.1 0.406 92.1 111.6 -98.2 3.1 -17.3 16.0 -5.3 244 248 A S < - 0 0 40 -3,-1.7 -3,-0.1 1,-0.1 4,-0.0 -0.453 61.1-150.2 -81.8 149.4 -15.9 17.8 -2.3 245 249 A G S S+ 0 0 86 1,-0.2 -1,-0.1 -2,-0.1 3,-0.1 0.501 102.9 32.7 -87.1 -8.0 -15.5 21.6 -2.0 246 250 A D > + 0 0 84 -5,-0.1 4,-2.3 1,-0.1 -1,-0.2 -0.515 69.2 169.7-147.1 66.4 -12.5 21.0 0.3 247 251 A P H > S+ 0 0 26 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.833 78.1 56.7 -58.4 -25.8 -10.9 17.8 -0.8 248 252 A R H > S+ 0 0 116 1,-0.2 4,-2.9 2,-0.2 5,-0.1 0.973 110.1 43.3 -72.8 -43.0 -7.9 18.3 1.4 249 253 A A H > S+ 0 0 33 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.865 113.1 53.5 -61.2 -38.2 -10.1 18.6 4.6 250 254 A A H X S+ 0 0 27 -4,-2.3 4,-1.5 2,-0.2 -1,-0.2 0.926 112.8 43.7 -65.3 -44.2 -12.2 15.6 3.4 251 255 A V H X S+ 0 0 0 -4,-2.6 4,-3.0 -5,-0.2 5,-0.2 0.950 111.0 54.2 -62.5 -48.3 -9.0 13.5 3.0 252 256 A A H X S+ 0 0 21 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.855 105.1 53.8 -58.6 -38.2 -7.6 14.8 6.3 253 257 A D H < S+ 0 0 83 -4,-2.4 4,-0.3 2,-0.2 -1,-0.2 0.910 113.6 43.2 -58.0 -45.7 -10.8 13.7 8.2 254 258 A L H >< S+ 0 0 8 -4,-1.5 3,-1.2 -3,-0.2 -2,-0.2 0.918 111.4 53.3 -67.0 -42.0 -10.4 10.2 6.8 255 259 A V H 3< S+ 0 0 54 -4,-3.0 -2,-0.2 1,-0.3 -207,-0.2 0.917 116.4 39.5 -63.6 -38.6 -6.7 10.0 7.4 256 260 A T T 3< S+ 0 0 109 -4,-2.4 -1,-0.3 -5,-0.2 -2,-0.2 0.428 85.6 140.0 -92.4 5.0 -7.2 10.9 11.0 257 261 A A < 0 0 23 -3,-1.2 -209,-0.2 -4,-0.3 -3,-0.1 -0.217 360.0 360.0 -55.6 129.6 -10.3 8.7 11.4 258 262 A G 0 0 104 0, 0.0 -1,-0.2 0, 0.0 -4,-0.0 0.644 360.0 360.0 121.8 360.0 -10.4 6.9 14.8