==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-SEP-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION 09-SEP-11 3TQN . COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, GNTR FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: COXIELLA BURNETII; . AUTHOR M.RUDOLPH,J.CHEUNG,M.FRANKLIN,M.CASSIDY,E.GARY,F.BURSHTEYN,J . 314 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21173.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 202 64.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 6.4 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 . 2 0.6 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 . 1 0.3 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 . 9 2.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 24 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 125 39.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 4.5 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 1 0 1 2 1 0 0 1 0 2 1 1 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 2 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 X 0 0 119 0, 0.0 2,-0.5 0, 0.0 43,-0.1 0.000 360.0 360.0 360.0 -90.0 27.8 48.0 67.4 2 2 A X - 0 0 3 41,-0.2 2,-0.4 152,-0.0 11,-0.0 -0.945 360.0-129.4-117.7 107.4 27.5 44.8 69.4 3 3 A R + 0 0 216 -2,-0.5 2,-0.2 1,-0.1 3,-0.1 -0.403 48.0 139.5 -75.7 121.5 28.6 42.3 66.8 4 4 A W + 0 0 34 -2,-0.4 -1,-0.1 1,-0.1 3,-0.1 -0.582 30.9 117.0-149.6-162.0 26.1 39.4 66.6 5 5 A D + 0 0 138 3,-0.4 2,-0.2 1,-0.2 -1,-0.1 0.719 61.9 138.1 72.5 36.3 24.1 36.9 64.7 6 6 A D S S- 0 0 108 2,-0.2 -1,-0.2 -3,-0.1 7,-0.1 -0.260 81.2 -62.5 -82.5-169.4 26.2 34.5 66.6 7 7 A K S S+ 0 0 175 -2,-0.2 -3,-0.0 -3,-0.1 0, 0.0 0.586 111.5 81.6 -59.1 -10.5 24.3 31.5 67.9 8 8 A K S S- 0 0 76 1,-0.1 -3,-0.4 2,-0.0 -2,-0.2 -0.664 84.5-100.7-109.3 153.4 22.0 33.5 70.2 9 9 A P >> - 0 0 64 0, 0.0 4,-1.5 0, 0.0 3,-1.1 -0.366 40.0-118.7 -54.9 140.6 18.8 35.6 70.1 10 10 A I H 3> S+ 0 0 56 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.816 113.2 54.5 -58.3 -35.0 19.7 39.3 70.1 11 11 A Y H 3> S+ 0 0 57 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.782 106.9 52.6 -70.7 -25.7 17.8 40.0 73.3 12 12 A Q H <> S+ 0 0 69 -3,-1.1 4,-1.7 2,-0.2 -1,-0.2 0.807 107.9 50.3 -77.9 -31.6 19.8 37.2 75.0 13 13 A Q H X S+ 0 0 24 -4,-1.5 4,-0.9 2,-0.2 -2,-0.2 0.899 113.9 45.1 -71.2 -41.8 23.1 38.8 73.8 14 14 A L H >X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 3,-0.6 0.905 110.9 53.4 -65.1 -44.2 22.0 42.2 75.2 15 15 A R H 3X S+ 0 0 41 -4,-2.1 4,-1.9 1,-0.3 -2,-0.2 0.893 108.0 51.5 -58.4 -40.2 20.8 40.6 78.4 16 16 A D H 3X S+ 0 0 58 -4,-1.7 4,-1.8 1,-0.2 -1,-0.3 0.732 105.6 55.1 -70.3 -24.4 24.2 39.0 78.8 17 17 A K H S+ 0 0 0 -4,-1.5 5,-1.5 2,-0.2 6,-1.1 0.886 110.6 48.5 -63.5 -39.4 28.3 44.9 83.6 22 22 A I H ><5S+ 0 0 4 -4,-1.8 3,-0.6 4,-0.2 -2,-0.2 0.912 114.0 45.9 -65.6 -44.2 26.6 44.1 86.9 23 23 A I H 3<5S+ 0 0 15 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.850 109.3 54.2 -68.6 -36.3 29.1 41.3 87.7 24 24 A D H 3<5S- 0 0 48 -4,-2.5 94,-0.6 -5,-0.2 -1,-0.2 0.620 117.1-113.5 -75.1 -11.6 32.1 43.4 86.8 25 25 A G T <<5S+ 0 0 17 -4,-0.6 -3,-0.2 -3,-0.6 3,-0.1 0.416 83.0 124.5 95.9 -0.9 30.9 46.1 89.2 26 26 A S S - 0 0 82 -2,-0.4 3,-1.7 -3,-0.1 45,-0.4 -0.517 40.2 -61.4-111.7 179.8 26.0 47.9 91.8 29 29 A E T 3 S+ 0 0 105 1,-0.3 45,-0.2 -2,-0.2 46,-0.1 -0.411 121.8 15.4 -69.5 126.1 23.0 47.3 94.0 30 30 A G T 3 S+ 0 0 54 43,-2.5 -1,-0.3 1,-0.4 2,-0.1 0.178 97.5 125.1 98.3 -15.4 20.6 50.3 94.1 31 31 A E < - 0 0 52 -3,-1.7 42,-2.4 43,-0.1 2,-0.5 -0.418 63.6-113.8 -79.3 153.5 22.2 52.0 91.1 32 32 A X E -A 72 0A 96 40,-0.2 40,-0.3 -2,-0.1 3,-0.1 -0.765 24.7-151.9 -93.1 124.3 20.2 53.1 88.1 33 33 A I E -A 71 0A 1 38,-2.6 38,-0.5 -2,-0.5 -6,-0.0 -0.561 38.2 -78.2 -87.9 157.6 20.9 51.3 84.7 34 34 A P - 0 0 11 0, 0.0 -1,-0.2 0, 0.0 122,-0.0 -0.128 54.7-102.6 -53.2 148.9 20.3 53.1 81.4 35 35 A S > - 0 0 20 1,-0.1 4,-2.3 -3,-0.1 5,-0.2 -0.269 23.8-114.0 -69.5 159.0 16.7 53.3 80.2 36 36 A I H > S+ 0 0 44 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.894 121.2 52.6 -55.9 -40.4 15.3 51.0 77.5 37 37 A R H > S+ 0 0 168 2,-0.2 4,-2.2 1,-0.2 5,-0.3 0.857 106.6 50.7 -64.4 -40.1 15.0 54.2 75.4 38 38 A K H > S+ 0 0 71 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.946 112.8 46.0 -66.1 -47.7 18.6 55.2 75.9 39 39 A I H X S+ 0 0 3 -4,-2.3 4,-2.2 2,-0.2 6,-0.3 0.894 113.2 50.8 -59.4 -43.8 19.9 51.7 74.9 40 40 A S H X>S+ 0 0 12 -4,-2.3 5,-1.4 -5,-0.2 4,-0.8 0.967 116.8 36.7 -61.1 -56.8 17.6 51.6 71.9 41 41 A T H <5S+ 0 0 101 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.874 120.5 47.7 -65.7 -40.5 18.5 55.0 70.4 42 42 A E H <5S+ 0 0 65 -4,-2.4 -2,-0.2 -5,-0.3 -3,-0.2 0.963 124.4 27.9 -67.2 -54.2 22.2 54.8 71.3 43 43 A Y H <5S- 0 0 8 -4,-2.2 -1,-0.2 -5,-0.3 -2,-0.2 0.347 105.0-122.8 -93.8 4.8 23.0 51.2 70.1 44 44 A Q T <5 + 0 0 167 -4,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.918 56.2 154.0 55.3 52.0 20.3 51.3 67.4 45 45 A I < - 0 0 17 -5,-1.4 -1,-0.2 -6,-0.3 -2,-0.1 -0.826 54.6 -91.5-111.4 149.5 18.4 48.2 68.6 46 46 A N >> - 0 0 88 -2,-0.3 4,-2.3 1,-0.2 3,-0.5 -0.387 31.3-140.7 -57.0 123.5 14.7 47.3 68.2 47 47 A P H 3> S+ 0 0 71 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.874 101.6 57.3 -55.5 -40.8 12.8 48.7 71.2 48 48 A L H 3> S+ 0 0 133 1,-0.2 4,-1.4 2,-0.2 5,-0.1 0.870 109.0 46.1 -59.0 -39.0 10.7 45.6 71.3 49 49 A T H <> S+ 0 0 40 -3,-0.5 4,-1.9 2,-0.2 -1,-0.2 0.908 111.9 50.2 -69.8 -43.9 13.8 43.5 71.7 50 50 A V H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.925 110.4 49.9 -59.6 -46.5 15.3 45.8 74.3 51 51 A S H X S+ 0 0 44 -4,-2.9 4,-2.6 1,-0.2 -1,-0.2 0.857 108.7 53.8 -60.3 -37.0 12.1 45.7 76.3 52 52 A K H X S+ 0 0 108 -4,-1.4 4,-1.6 -5,-0.2 -1,-0.2 0.869 108.7 48.8 -64.7 -38.0 12.2 41.9 76.1 53 53 A A H X S+ 0 0 0 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.883 113.7 45.7 -70.3 -40.1 15.7 41.8 77.5 54 54 A Y H X S+ 0 0 4 -4,-2.3 4,-1.9 2,-0.2 -2,-0.2 0.893 109.9 53.7 -68.7 -41.9 14.8 44.1 80.4 55 55 A Q H X S+ 0 0 103 -4,-2.6 4,-2.9 1,-0.2 5,-0.2 0.887 105.5 55.4 -60.3 -39.4 11.6 42.2 81.1 56 56 A S H X S+ 0 0 23 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.883 109.1 46.4 -58.7 -41.1 13.7 39.0 81.4 57 57 A L H <>S+ 0 0 0 -4,-1.3 5,-2.6 2,-0.2 6,-1.2 0.782 111.5 52.7 -73.4 -28.3 15.9 40.7 84.0 58 58 A L H ><5S+ 0 0 41 -4,-1.9 3,-1.9 3,-0.2 -2,-0.2 0.947 108.0 49.2 -69.2 -50.3 12.8 41.9 85.8 59 59 A D H 3<5S+ 0 0 117 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.735 110.9 52.3 -60.1 -23.9 11.3 38.4 86.0 60 60 A D T 3<5S- 0 0 36 -4,-0.9 -1,-0.3 -5,-0.2 -2,-0.2 0.412 112.3-121.3 -94.0 0.5 14.7 37.2 87.3 61 61 A N T < 5S+ 0 0 81 -3,-1.9 -3,-0.2 2,-0.2 -2,-0.1 0.778 78.7 123.4 63.2 27.5 14.7 39.8 90.0 62 62 A V S -B 70 0A 111 4,-2.6 4,-1.4 -2,-0.5 -2,-0.0 -0.896 28.4 -98.3-124.2 160.2 11.0 52.3 90.4 67 67 A R T 4 S- 0 0 241 -2,-0.3 -1,-0.1 1,-0.2 4,-0.0 0.770 102.7 -15.4 -44.9 -73.5 8.8 55.3 90.5 68 68 A G T 4 S+ 0 0 79 1,-0.1 -1,-0.2 -3,-0.0 -3,-0.0 0.558 125.3 75.8-105.8 -11.8 10.7 58.3 89.2 69 69 A L T 4 S- 0 0 96 1,-0.3 2,-0.3 3,-0.0 -2,-0.2 0.652 88.2-139.2 -78.8 -18.6 14.2 56.8 89.4 70 70 A G E < - B 0 66A 28 -4,-1.4 -4,-2.6 -38,-0.1 2,-0.6 -0.671 57.0 -9.7 90.0-150.3 13.9 54.5 86.3 71 71 A X E S-AB 33 65A 23 -38,-0.5 -38,-2.6 -2,-0.3 2,-0.3 -0.770 70.3-171.4 -93.3 122.4 15.3 50.9 86.3 72 72 A L E -AB 32 64A 13 -8,-3.0 -8,-2.6 -2,-0.6 2,-0.5 -0.754 29.0-105.3-114.5 155.8 17.5 50.0 89.3 73 73 A V E - B 0 63A 2 -42,-2.4 -43,-2.5 -45,-0.4 -10,-0.3 -0.678 40.4-129.7 -78.8 121.8 19.7 47.0 90.2 74 74 A K > - 0 0 63 -12,-2.2 3,-1.1 -2,-0.5 4,-0.2 -0.246 31.2 -90.1 -69.7 158.9 18.0 44.8 92.8 75 75 A A T 3 S+ 0 0 65 1,-0.2 -1,-0.1 2,-0.1 -47,-0.0 -0.480 108.8 16.0 -77.6 138.7 19.8 43.8 96.0 76 76 A G T 3> S+ 0 0 26 -2,-0.2 4,-2.1 -3,-0.1 3,-0.5 0.364 87.5 129.4 82.7 -4.4 21.8 40.5 96.0 77 77 A A H <> + 0 0 0 -3,-1.1 4,-2.4 1,-0.2 5,-0.2 0.844 61.3 56.5 -49.9 -49.5 21.7 40.5 92.2 78 78 A R H > S+ 0 0 116 1,-0.2 4,-1.9 -4,-0.2 -1,-0.2 0.897 113.0 41.8 -56.7 -42.1 25.5 40.0 91.5 79 79 A Q H > S+ 0 0 112 -3,-0.5 4,-2.7 2,-0.2 5,-0.3 0.883 111.4 55.2 -72.1 -40.2 25.6 36.8 93.5 80 80 A R H X S+ 0 0 82 -4,-2.1 4,-1.7 1,-0.2 -2,-0.2 0.858 110.7 47.3 -59.5 -35.4 22.2 35.6 92.2 81 81 A L H X S+ 0 0 3 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.899 110.4 50.6 -72.7 -42.6 23.7 36.0 88.7 82 82 A L H X S+ 0 0 40 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.920 113.0 45.9 -61.3 -45.5 26.9 34.2 89.6 83 83 A T H X S+ 0 0 57 -4,-2.7 4,-3.2 2,-0.2 -1,-0.2 0.891 112.3 52.6 -63.8 -40.5 25.0 31.3 91.0 84 84 A Q H X S+ 0 0 55 -4,-1.7 4,-3.3 -5,-0.3 5,-0.3 0.934 109.1 48.5 -59.2 -48.9 22.8 31.3 88.0 85 85 A E H X S+ 0 0 55 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.942 113.7 47.7 -56.7 -48.0 25.7 31.1 85.6 86 86 A K H X S+ 0 0 80 -4,-2.4 4,-2.6 2,-0.2 -2,-0.2 0.950 114.6 45.5 -57.8 -52.1 27.2 28.3 87.7 87 87 A Q H X S+ 0 0 111 -4,-3.2 4,-2.4 1,-0.2 5,-0.4 0.922 111.3 51.2 -58.7 -49.8 23.9 26.4 87.7 88 88 A Y H X S+ 0 0 142 -4,-3.3 4,-1.6 1,-0.2 5,-0.3 0.902 112.2 48.2 -56.1 -42.6 23.1 26.9 84.0 89 89 A F H X>S+ 0 0 4 -4,-2.3 5,-3.4 -5,-0.3 4,-1.4 0.944 111.3 51.4 -61.7 -47.7 26.6 25.6 83.2 90 90 A L H <5S+ 0 0 59 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.944 123.2 23.3 -56.8 -58.2 26.2 22.6 85.5 91 91 A K H <5S+ 0 0 142 -4,-2.4 -3,-0.2 1,-0.1 -2,-0.2 0.931 132.4 34.4 -78.9 -47.1 22.9 21.2 84.3 92 92 A K H <5S+ 0 0 161 -4,-1.6 -3,-0.2 -5,-0.4 -2,-0.2 0.489 133.0 18.5 -92.5 -3.1 22.6 22.5 80.7 93 93 A Q T <5S+ 0 0 73 -4,-1.4 4,-0.4 -5,-0.3 -3,-0.2 0.653 106.2 65.1-126.8 -62.7 26.3 22.4 79.7 94 94 A W S > S+ 0 0 29 -3,-1.2 4,-1.3 -4,-0.4 3,-0.8 0.299 106.4 55.3-100.0 -1.0 30.7 17.6 77.5 98 98 A K T 34 S+ 0 0 75 1,-0.4 3,-0.1 2,-0.2 -4,-0.0 0.915 101.3 51.1 -77.3 -61.2 30.7 14.6 79.8 99 99 A N T 34 S+ 0 0 74 2,-0.3 -1,-0.4 1,-0.2 -5,-0.0 -0.819 103.7 62.3 83.0 -14.3 29.7 12.6 77.7 100 100 A K T <> S+ 0 0 71 -3,-0.8 4,-2.0 4,-0.1 -2,-0.2 0.303 101.5 47.0-129.2 -61.1 32.5 13.7 75.4 101 101 A L T < S+ 0 0 16 -4,-1.3 -2,-0.3 1,-0.2 -3,-0.1 0.540 112.0 59.3 -61.9 -7.4 35.5 12.8 77.5 102 102 A E T 4 S+ 0 0 126 3,-0.1 -1,-0.2 1,-0.1 -3,-0.1 0.915 99.7 50.5 -76.4 -61.9 33.6 9.6 77.8 103 103 A R T 4 S+ 0 0 120 1,-0.2 2,-0.4 2,-0.1 -2,-0.2 0.794 123.6 36.4 -48.7 -33.2 33.5 8.9 74.0 104 104 A L S < S- 0 0 6 -4,-2.0 -1,-0.2 190,-0.1 -4,-0.1 -0.995 108.5-101.2-122.1 128.7 37.2 9.5 74.2 105 105 A G + 0 0 49 -2,-0.4 2,-0.3 1,-0.0 -3,-0.1 0.005 57.9 142.2 -50.5 147.5 39.1 8.2 77.2 106 106 A I 0 0 66 -5,-0.1 -1,-0.0 -4,-0.1 189,-0.0 -0.982 360.0 360.0-175.9 164.0 40.0 10.8 79.9 107 107 A D 0 0 199 -2,-0.3 -6,-0.1 0, 0.0 -2,-0.0 -0.226 360.0 360.0 -51.4 360.0 40.3 11.6 83.6 108 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 109 1 B X 0 0 155 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 169.2 45.8 46.5 74.9 110 2 B X + 0 0 49 1,-0.2 41,-0.0 12,-0.0 0, 0.0 -0.640 360.0 170.7 60.2-112.6 44.4 47.7 78.2 111 3 B R + 0 0 142 -2,-0.7 -1,-0.2 0, 0.0 2,-0.0 0.990 17.4 149.3 65.2 69.3 44.4 44.4 80.1 112 4 B W + 0 0 49 2,-0.1 2,-0.2 4,-0.0 6,-0.0 0.028 10.9 126.0 -70.8-163.0 43.6 45.2 83.7 113 5 B D > + 0 0 73 3,-0.1 3,-0.6 -2,-0.0 2,-0.2 -0.712 29.5 105.0-118.0 -69.9 42.3 43.8 86.1 114 6 B D T 3 S+ 0 0 158 1,-0.2 -2,-0.1 -2,-0.2 0, 0.0 -0.493 91.3 4.8 65.9-131.0 43.7 43.3 89.6 115 7 B K T 3 S+ 0 0 216 -2,-0.2 -1,-0.2 2,-0.0 -3,-0.0 0.550 113.4 62.7 -64.2 -14.9 42.5 45.6 92.5 116 8 B K S < S- 0 0 82 -3,-0.6 -3,-0.1 1,-0.0 2,-0.1 -0.790 81.8 -97.6-128.2 155.8 39.7 47.6 90.8 117 9 B P >> - 0 0 44 0, 0.0 4,-1.1 0, 0.0 3,-1.0 -0.443 45.0-122.5 -56.4 139.1 36.3 47.7 89.1 118 10 B I H 3> S+ 0 0 25 -94,-0.6 4,-2.3 1,-0.3 3,-0.4 0.853 108.6 56.0 -58.9 -40.3 37.0 47.9 85.3 119 11 B Y H 3> S+ 0 0 33 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.754 104.9 54.0 -67.2 -24.0 35.2 51.2 84.7 120 12 B Q H <> S+ 0 0 59 -3,-1.0 4,-1.4 2,-0.2 -1,-0.2 0.789 108.8 49.1 -77.2 -29.1 37.3 52.9 87.4 121 13 B Q H X S+ 0 0 36 -4,-1.1 4,-1.6 -3,-0.4 -2,-0.2 0.881 112.3 46.2 -76.5 -41.1 40.4 51.7 85.6 122 14 B L H X S+ 0 0 7 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.902 111.4 53.8 -64.8 -41.1 39.2 53.0 82.2 123 15 B R H X S+ 0 0 52 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.878 107.9 50.6 -57.9 -40.5 38.2 56.2 84.0 124 16 B D H X S+ 0 0 46 -4,-1.4 4,-2.0 1,-0.2 -1,-0.2 0.828 105.5 55.6 -69.5 -33.0 41.8 56.5 85.3 125 17 B K H X S+ 0 0 84 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.892 108.5 48.2 -65.5 -39.1 43.2 56.0 81.8 126 18 B I H X S+ 0 0 14 -4,-1.8 4,-1.5 2,-0.2 -2,-0.2 0.882 109.9 50.9 -69.2 -40.9 41.2 58.9 80.5 127 19 B V H X S+ 0 0 1 -4,-1.8 4,-2.9 2,-0.2 5,-0.2 0.904 109.5 52.0 -61.7 -41.3 42.2 61.2 83.3 128 20 B E H X S+ 0 0 105 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.905 108.2 50.7 -61.0 -42.8 45.8 60.2 82.6 129 21 B A H <>S+ 0 0 19 -4,-1.9 5,-2.2 2,-0.2 6,-1.6 0.787 112.6 47.5 -65.7 -29.4 45.3 61.2 79.0 130 22 B I H ><5S+ 0 0 3 -4,-1.5 3,-0.8 4,-0.2 -2,-0.2 0.916 113.5 45.7 -76.6 -46.7 43.9 64.5 80.0 131 23 B I H 3<5S+ 0 0 24 -4,-2.9 -2,-0.2 1,-0.2 -3,-0.2 0.881 111.3 53.3 -62.5 -40.1 46.6 65.3 82.6 132 24 B D T 3<5S- 0 0 111 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.586 117.7-113.4 -75.0 -9.9 49.3 64.3 80.0 133 25 B G T < 5S+ 0 0 42 -3,-0.8 3,-0.2 -4,-0.3 -3,-0.2 0.630 82.7 121.2 90.6 14.7 47.9 66.7 77.5 134 26 B S S - 0 0 72 -2,-0.6 3,-1.7 -3,-0.2 45,-0.3 -0.438 32.7 -86.0 -80.7 156.1 43.1 69.3 75.6 137 29 B E T 3 S+ 0 0 84 1,-0.2 45,-0.2 -2,-0.1 -1,-0.1 -0.401 117.0 18.6 -60.5 132.2 40.4 71.3 77.2 138 30 B G T 3 S+ 0 0 53 43,-2.7 -1,-0.2 1,-0.4 2,-0.1 0.145 100.4 118.7 92.1 -19.5 37.6 72.1 74.6 139 31 B E < - 0 0 78 -3,-1.7 42,-1.6 1,-0.1 -1,-0.4 -0.443 69.4-107.7 -78.7 153.2 38.8 69.3 72.3 140 32 B X B -C 180 0B 102 40,-0.2 40,-0.2 -2,-0.1 -4,-0.1 -0.523 29.9-150.3 -78.9 146.9 36.6 66.3 71.4 141 33 B I - 0 0 10 38,-2.3 38,-0.4 -2,-0.2 -6,-0.0 -0.852 35.6 -74.6-116.7 156.5 37.4 62.9 72.9 142 34 B P - 0 0 39 0, 0.0 -1,-0.1 0, 0.0 5,-0.0 -0.083 55.3-107.5 -50.1 142.4 36.7 59.5 71.4 143 35 B S > - 0 0 64 1,-0.1 4,-2.1 -3,-0.1 5,-0.2 -0.262 23.3-112.9 -67.2 156.3 33.1 58.3 71.4 144 36 B I H > S+ 0 0 28 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.887 122.1 57.0 -52.9 -38.1 31.9 55.6 73.7 145 37 B R H > S+ 0 0 62 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.901 106.3 46.8 -60.9 -44.5 31.4 53.7 70.5 146 38 B K H > S+ 0 0 110 2,-0.2 4,-2.1 1,-0.2 5,-0.3 0.845 111.6 50.7 -68.9 -36.8 35.0 54.1 69.5 147 39 B I H X S+ 0 0 14 -4,-2.1 4,-2.0 1,-0.2 6,-0.3 0.956 113.1 43.6 -67.5 -51.8 36.4 53.1 72.9 148 40 B S H <>S+ 0 0 9 -4,-2.2 5,-0.9 1,-0.2 4,-0.4 0.824 115.1 52.8 -61.9 -33.0 34.4 49.9 73.2 149 41 B T H <5S+ 0 0 59 -4,-1.5 3,-0.3 -5,-0.2 -2,-0.2 0.958 116.4 32.1 -69.5 -53.8 35.2 49.0 69.6 150 42 B E H <5S+ 0 0 108 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.1 0.878 125.2 41.2 -76.4 -39.8 39.0 49.3 69.5 151 43 B Y T <5S- 0 0 80 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.372 104.8-122.8 -94.1 4.3 39.8 48.2 73.1 152 44 B Q T 5 + 0 0 149 -4,-0.4 2,-0.3 -3,-0.3 -3,-0.2 0.893 57.6 151.9 59.3 45.2 37.2 45.4 73.2 153 45 B I < - 0 0 16 -5,-0.9 -1,-0.2 -6,-0.3 -2,-0.1 -0.819 57.0 -97.2-108.9 146.5 35.4 46.7 76.2 154 46 B N >> - 0 0 16 -2,-0.3 4,-2.3 1,-0.2 3,-0.5 -0.461 31.5-141.4 -58.1 118.9 31.7 46.3 77.2 155 47 B P H 3> S+ 0 0 6 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.723 101.5 56.1 -60.9 -23.8 30.1 49.5 75.9 156 48 B L H 3> S+ 0 0 4 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.888 108.0 46.6 -72.5 -41.4 27.9 49.6 79.0 157 49 B T H <> S+ 0 0 2 -3,-0.5 4,-1.6 1,-0.2 -1,-0.2 0.873 112.4 52.6 -63.7 -36.9 31.0 49.5 81.2 158 50 B V H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.871 106.2 52.3 -66.1 -39.2 32.4 52.2 78.9 159 51 B S H X S+ 0 0 16 -4,-1.8 4,-2.7 1,-0.2 -2,-0.2 0.925 106.3 53.5 -62.8 -44.8 29.2 54.4 79.4 160 52 B K H X S+ 0 0 22 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.877 108.0 51.7 -56.2 -39.5 29.6 54.1 83.2 161 53 B A H X S+ 0 0 0 -4,-1.6 4,-1.0 1,-0.2 -1,-0.2 0.939 112.8 43.4 -63.5 -48.4 33.2 55.4 82.8 162 54 B Y H X S+ 0 0 5 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.837 111.7 56.2 -64.7 -35.0 32.1 58.4 80.7 163 55 B Q H X S+ 0 0 80 -4,-2.7 4,-2.9 2,-0.2 5,-0.2 0.929 103.9 50.3 -65.6 -47.6 29.1 59.0 83.1 164 56 B S H X S+ 0 0 17 -4,-2.2 4,-1.1 1,-0.2 -1,-0.2 0.768 111.5 51.5 -63.4 -24.9 31.2 59.3 86.2 165 57 B L H <>S+ 0 0 0 -4,-1.0 5,-2.5 2,-0.2 6,-0.8 0.864 108.8 49.3 -77.0 -38.9 33.4 61.8 84.3 166 58 B L H ><5S+ 0 0 36 -4,-2.0 3,-1.6 1,-0.2 -2,-0.2 0.930 110.1 52.1 -62.1 -46.2 30.3 63.8 83.3 167 59 B D H 3<5S+ 0 0 109 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.843 108.7 49.9 -58.6 -36.3 29.2 63.8 86.9 168 60 B D T 3<5S- 0 0 87 -4,-1.1 -1,-0.3 -5,-0.2 -2,-0.2 0.421 113.6-122.4 -84.0 2.1 32.6 65.1 88.0 169 61 B N T < 5S+ 0 0 88 -3,-1.6 -3,-0.2 -4,-0.1 -2,-0.1 0.752 77.2 125.8 62.7 26.1 32.3 67.8 85.3 170 62 B V S > -D 178 0B 121 4,-2.8 3,-1.3 -2,-0.5 4,-1.3 -0.967 35.4-111.6-134.5 119.5 27.5 68.8 73.1 175 67 B R T 34 S+ 0 0 231 -2,-0.4 4,-0.0 1,-0.3 -2,-0.0 -0.195 98.0 4.6 -56.3 126.2 25.2 67.8 70.3 176 68 B G T 34 S+ 0 0 67 1,-0.1 -1,-0.3 0, 0.0 3,-0.1 -0.014 126.5 64.3 89.5 -26.9 27.0 67.1 67.0 177 69 B L T <4 S- 0 0 66 -3,-1.3 2,-0.3 1,-0.3 -2,-0.2 0.538 92.3-153.9 -94.6 -10.7 30.4 67.5 68.6 178 70 B G E < + D 0 174B 38 -4,-1.3 -4,-2.8 -38,-0.1 2,-0.4 -0.554 54.6 0.9 70.7-134.5 29.8 64.5 70.8 179 71 B X E S- D 0 173B 20 -38,-0.4 -38,-2.3 -2,-0.3 2,-0.2 -0.759 70.8-174.6 -96.3 132.0 31.7 64.4 74.1 180 72 B L E -CD 140 172B 6 -8,-3.2 -8,-2.3 -2,-0.4 2,-0.6 -0.760 29.5-108.1-122.3 164.0 34.1 67.2 75.0 181 73 B V E - D 0 171B 2 -42,-1.6 -43,-2.7 -45,-0.3 -10,-0.3 -0.834 39.0-126.6 -91.8 119.5 36.7 68.1 77.7 182 74 B K > - 0 0 58 -12,-1.9 3,-1.8 -2,-0.6 4,-0.3 -0.347 31.5 -97.2 -66.4 143.1 35.4 70.9 80.0 183 75 B A T 3 S+ 0 0 77 1,-0.3 -1,-0.1 2,-0.1 -47,-0.0 -0.386 110.1 22.4 -62.0 130.1 37.6 73.9 80.5 184 76 B G T 3> S+ 0 0 26 -2,-0.1 4,-2.0 -3,-0.1 -1,-0.3 0.361 86.0 120.9 94.5 -4.0 39.7 73.7 83.7 185 77 B A H <> + 0 0 0 -3,-1.8 4,-2.7 1,-0.2 5,-0.2 0.921 67.9 55.1 -57.3 -50.6 39.4 69.9 83.8 186 78 B R H > S+ 0 0 100 -4,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.877 111.9 43.0 -54.4 -43.5 43.2 69.3 83.7 187 79 B Q H > S+ 0 0 98 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.881 112.4 54.0 -71.2 -37.6 43.9 71.5 86.7 188 80 B R H X S+ 0 0 105 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.887 112.5 44.3 -61.1 -41.4 41.0 70.0 88.6 189 81 B L H X S+ 0 0 14 -4,-2.7 4,-2.8 2,-0.2 5,-0.3 0.906 109.1 55.4 -71.5 -44.5 42.3 66.5 88.0 190 82 B L H X S+ 0 0 50 -4,-2.3 4,-2.6 -5,-0.2 5,-0.2 0.936 110.7 45.1 -53.6 -51.2 45.9 67.3 88.9 191 83 B T H X S+ 0 0 54 -4,-2.1 4,-2.8 2,-0.2 5,-0.3 0.907 112.5 51.6 -60.9 -44.9 44.9 68.7 92.3 192 84 B Q H X S+ 0 0 130 -4,-1.6 4,-1.9 -5,-0.2 -2,-0.2 0.946 116.4 39.6 -57.1 -51.0 42.6 65.8 93.0 193 85 B E H X S+ 0 0 90 -4,-2.8 4,-1.6 2,-0.2 -2,-0.2 0.819 118.2 47.8 -70.5 -33.4 45.3 63.2 92.2 194 86 B K H X S+ 0 0 84 -4,-2.6 4,-2.7 -5,-0.3 -2,-0.2 0.893 113.1 47.1 -74.8 -40.2 48.1 65.2 93.8 195 87 B Q H X S+ 0 0 117 -4,-2.8 4,-1.2 -5,-0.2 5,-0.3 0.876 111.3 50.7 -70.8 -39.6 46.2 65.9 97.1 196 88 B Y H X>S+ 0 0 106 -4,-1.9 4,-2.3 -5,-0.3 5,-0.6 0.953 114.8 44.5 -60.9 -49.0 45.0 62.3 97.4 197 89 B F H X>S+ 0 0 82 -4,-1.6 5,-5.1 1,-0.2 4,-0.8 0.897 112.7 50.3 -61.7 -43.9 48.6 61.1 97.0 198 90 B L H <5S+ 0 0 92 -4,-2.7 -1,-0.2 3,-0.2 -2,-0.2 0.694 125.0 29.2 -69.7 -17.3 50.0 63.7 99.3 199 91 B K H <5S+ 0 0 153 -4,-1.2 -2,-0.2 -3,-0.5 -3,-0.2 0.847 130.4 26.7-105.3 -65.1 47.5 62.8 102.0 200 92 B K H <5S+ 0 0 122 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.1 0.419 138.2 21.5 -85.9 1.1 46.4 59.1 101.8 201 93 B Q T <> S+ 0 0 99 5,-0.0 4,-2.9 0, 0.0 3,-0.5 -0.832 117.0 45.4 -67.9 -24.1 58.2 58.8 103.8 207 99 B N H 3> S+ 0 0 89 1,-0.3 4,-2.3 2,-0.2 3,-0.2 0.955 114.0 46.4 -50.8 -62.0 58.0 56.4 106.8 208 100 B K H 34 S+ 0 0 122 1,-0.2 -1,-0.3 2,-0.2 5,-0.1 0.757 115.4 51.1 -52.4 -26.7 59.4 53.4 105.0 209 101 B L H <4 S+ 0 0 70 -3,-0.5 -1,-0.2 1,-0.1 -2,-0.2 0.887 103.1 55.4 -77.4 -44.7 62.1 55.8 103.7 210 102 B E H < S+ 0 0 114 -4,-2.9 -2,-0.2 -3,-0.2 -3,-0.1 0.983 102.5 66.4 -47.3 -62.8 63.0 57.1 107.1 211 103 B R S < S- 0 0 155 -4,-2.3 -5,-0.0 -5,-0.1 2,-0.0 -0.349 120.1 -5.4 -54.6 144.2 63.6 53.5 108.0 212 104 B L S S- 0 0 143 2,-0.0 2,-0.1 0, 0.0 -3,-0.1 -0.315 117.4 -23.2 53.4-139.7 66.6 52.4 105.9 213 105 B G - 0 0 46 -5,-0.1 2,-0.3 -2,-0.0 3,-0.1 -0.367 52.8-158.7-104.8 173.9 67.9 54.9 103.4 214 106 B I + 0 0 119 1,-0.2 -2,-0.0 -2,-0.1 -4,-0.0 -0.969 47.3 24.8-144.8 161.5 66.8 58.0 101.4 215 107 B D 0 0 126 -2,-0.3 -1,-0.2 1,-0.1 -6,-0.0 0.916 360.0 360.0 56.8 72.0 67.4 60.2 98.4 216 108 B L 0 0 202 -3,-0.1 -1,-0.1 0, 0.0 0, 0.0 -0.131 360.0 360.0 -32.5 360.0 69.3 58.6 95.4 217 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 218 7 C K 0 0 185 0, 0.0 6,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 150.3 28.8 26.9 56.7 219 8 C K - 0 0 112 1,-0.1 2,-4.5 3,-0.1 3,-0.1 0.087 360.0 -57.7 77.8 155.6 32.4 25.8 56.7 220 9 C P S S- 0 0 86 0, 0.0 -1,-0.1 0, 0.0 4,-0.0 -0.143 73.6-115.9 -68.9 58.3 34.0 24.9 53.3 221 10 C I S S+ 0 0 95 -2,-4.5 2,-4.6 1,-0.2 3,-0.2 -0.253 103.5 71.9 45.3-146.0 31.4 22.3 52.7 222 11 C Y S S+ 0 0 81 1,-0.4 4,-0.3 38,-0.3 -1,-0.2 0.154 84.4 62.9 59.2 -19.6 33.6 19.4 52.6 223 12 C Q S > S+ 0 0 92 -2,-4.6 4,-3.3 3,-0.1 -1,-0.4 0.408 98.8 63.3 -98.9 -13.9 34.4 19.2 56.3 224 13 C Q H > S+ 0 0 30 -3,-0.2 4,-1.4 2,-0.2 -2,-0.2 0.865 111.0 33.4 -74.3 -39.5 30.6 18.7 56.6 225 14 C L H > S+ 0 0 18 2,-0.2 4,-2.6 3,-0.2 5,-0.3 0.914 121.4 51.4 -77.9 -46.7 30.9 15.4 54.6 226 15 C R H > S+ 0 0 50 -4,-0.3 4,-2.5 2,-0.2 -2,-0.2 0.925 116.4 38.6 -52.5 -53.5 34.3 14.7 56.1 227 16 C D H X S+ 0 0 47 -4,-3.3 4,-3.6 2,-0.2 5,-0.3 0.932 113.4 55.3 -67.4 -46.1 33.2 15.3 59.7 228 17 C K H X S+ 0 0 131 -4,-1.4 4,-1.3 -5,-0.3 -2,-0.2 0.888 113.1 43.0 -53.4 -42.7 29.8 13.6 59.2 229 18 C I H X S+ 0 0 9 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.934 113.0 52.4 -67.3 -48.0 31.6 10.5 58.0 230 19 C V H X S+ 0 0 9 -4,-2.5 4,-2.2 -5,-0.3 -2,-0.2 0.927 112.5 44.5 -52.6 -50.1 34.2 10.8 60.8 231 20 C E H X S+ 0 0 65 -4,-3.6 4,-1.8 1,-0.2 6,-0.3 0.794 108.2 60.3 -65.8 -28.4 31.4 10.9 63.4 232 21 C A H <>S+ 0 0 13 -4,-1.3 6,-2.1 -5,-0.3 5,-2.0 0.877 107.9 43.2 -67.0 -38.9 29.7 8.1 61.5 233 22 C I H ><5S+ 0 0 3 -4,-2.1 3,-1.2 -3,-0.2 -2,-0.2 0.938 114.5 50.1 -68.4 -47.6 32.7 5.8 62.1 234 23 C I H 3<5S+ 0 0 9 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.767 111.7 48.2 -64.3 -27.8 33.1 6.9 65.7 235 24 C D T 3<5S- 0 0 101 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.515 113.2-119.7 -89.4 -5.3 29.4 6.3 66.4 236 25 C G T < 5S+ 0 0 45 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.657 82.1 121.6 76.2 15.7 29.6 2.9 64.8 237 26 C S S - 0 0 73 -2,-0.5 3,-1.0 4,-0.2 43,-0.5 -0.707 22.0 -97.1-101.4 145.1 31.5 -0.3 60.7 240 29 C E B 3 S+e 282 0C 77 -2,-0.3 43,-0.2 1,-0.2 44,-0.2 -0.219 106.7 14.5 -56.6 142.2 35.2 -1.2 60.1 241 30 C G T 3 S+ 0 0 48 41,-3.0 2,-0.3 1,-0.2 -1,-0.2 0.826 104.5 115.4 60.3 34.4 35.9 -3.3 57.0 242 31 C E S < S- 0 0 112 -3,-1.0 40,-1.4 40,-0.2 -1,-0.2 -0.981 74.0 -91.8-134.3 148.6 32.4 -2.7 55.6 243 32 C X B -F 281 0C 111 -2,-0.3 38,-0.2 38,-0.2 -4,-0.2 -0.291 37.0-151.6 -57.2 130.5 31.1 -0.9 52.5 244 33 C I - 0 0 8 36,-2.8 36,-0.2 1,-0.2 2,-0.1 -0.341 37.7 -79.3 -83.1 177.0 30.3 2.8 52.9 245 34 C P - 0 0 30 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.465 54.0-120.5 -68.8 156.2 27.7 4.5 50.8 246 35 C S > - 0 0 48 -2,-0.1 4,-1.9 -3,-0.1 5,-0.2 -0.421 27.5 -92.9 -94.7 177.5 29.0 5.4 47.3 247 36 C I H > S+ 0 0 52 2,-0.2 4,-3.0 1,-0.2 5,-0.3 0.883 121.5 51.4 -56.6 -45.9 29.2 8.9 45.7 248 37 C R H > S+ 0 0 175 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.981 111.8 44.8 -56.1 -62.8 25.8 8.7 44.0 249 38 C K H > S+ 0 0 100 1,-0.2 4,-0.8 2,-0.2 -1,-0.2 0.790 116.3 48.6 -52.4 -33.4 23.9 7.8 47.1 250 39 C I H X S+ 0 0 13 -4,-1.9 4,-0.7 2,-0.2 -1,-0.2 0.911 111.4 46.6 -75.8 -44.5 25.8 10.4 49.1 251 40 C S H <>S+ 0 0 12 -4,-3.0 5,-1.3 1,-0.2 -2,-0.2 0.853 120.0 42.9 -62.8 -33.1 25.2 13.2 46.5 252 41 C T H <5S+ 0 0 92 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.718 89.9 94.3 -78.8 -22.0 21.6 12.0 46.6 253 42 C E H <5S- 0 0 128 -4,-0.8 -2,-0.2 -5,-0.3 -1,-0.1 0.862 124.9 -39.9 -43.1 -67.8 21.6 11.7 50.3 254 43 C Y T <5S- 0 0 185 -4,-0.7 2,-0.3 -3,-0.1 -3,-0.1 0.457 114.2 -52.6-113.1 -79.1 20.2 15.1 50.8 255 44 C Q T 5 + 0 0 161 -5,-0.1 2,-0.3 2,-0.0 -3,-0.2 -0.886 64.9 151.3-153.9 139.5 22.1 17.1 48.1 256 45 C I < - 0 0 42 -5,-1.3 5,-0.1 -2,-0.3 4,-0.1 -0.947 52.6 -99.1-153.9 146.6 25.7 17.5 47.2 257 46 C N - 0 0 103 -2,-0.3 4,-0.1 1,-0.2 -2,-0.0 -0.533 41.2-124.2 -58.6 121.8 27.7 18.1 44.1 258 47 C P S S+ 0 0 58 0, 0.0 2,-0.4 0, 0.0 3,-0.3 0.730 108.9 52.4 -49.2 -29.6 28.8 14.6 43.2 259 48 C L S S+ 0 0 107 1,-0.2 -2,-0.0 2,-0.2 0, 0.0 -0.922 96.5 55.9-101.5 143.3 32.3 16.1 43.2 260 49 C T S S+ 0 0 43 -2,-0.4 -38,-0.3 2,-0.4 -1,-0.2 0.120 93.4 76.8 90.5 -8.4 32.6 17.8 46.6 261 50 C V 0 0 0 -3,-0.3 4,-1.8 1,-0.1 -2,-0.2 0.251 360.0 360.0 -96.9 -0.7 31.7 14.3 47.5 262 51 C S 0 0 39 2,-0.3 -2,-0.4 3,-0.2 -1,-0.1 -0.962 360.0 360.0-116.3 360.0 35.4 14.0 46.6 263 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 264 53 C A > 0 0 0 0, 0.0 4,-1.4 0, 0.0 3,-0.3 0.000 360.0 360.0 360.0 -4.9 35.5 14.4 50.8 265 54 C Y H > + 0 0 10 -4,-1.8 4,-1.1 1,-0.2 -3,-0.2 0.706 360.0 68.7 -56.1 -19.1 36.3 10.8 50.0 266 55 C Q H >> S+ 0 0 82 2,-0.2 4,-2.3 1,-0.2 3,-1.3 0.997 99.1 43.3 -57.8 -67.7 39.6 12.2 48.8 267 56 C S H 3> S+ 0 0 18 -3,-0.3 4,-2.9 1,-0.3 -2,-0.2 0.807 110.8 55.6 -51.8 -37.4 40.9 13.1 52.2 268 57 C L H 3<>S+ 0 0 1 -4,-1.4 5,-2.2 2,-0.2 6,-1.7 0.797 108.8 48.2 -70.7 -27.4 39.7 9.9 53.9 269 58 C L H X<5S+ 0 0 77 -3,-1.3 3,-1.1 -4,-1.1 -2,-0.2 0.930 115.0 45.1 -70.5 -48.7 41.7 8.0 51.3 270 59 C D H 3<5S+ 0 0 111 -4,-2.3 -2,-0.2 1,-0.2 -3,-0.2 0.874 115.4 47.9 -58.7 -39.9 44.8 10.2 51.9 271 60 C D T 3<5S- 0 0 71 -4,-2.9 -1,-0.2 -5,-0.2 -2,-0.2 0.353 110.6-120.3 -90.4 4.7 44.2 9.9 55.7 272 61 C N T < 5S+ 0 0 91 -3,-1.1 -3,-0.2 2,-0.2 -4,-0.1 0.768 78.6 121.8 61.9 28.6 43.8 6.1 55.6 273 62 C V S - 0 0 56 -10,-3.5 3,-1.0 -2,-0.3 2,-0.4 -0.299 26.3-102.1 -68.6 159.5 39.8 0.6 57.2 284 75 C A T 3 S+ 0 0 73 1,-0.2 -1,-0.1 -44,-0.2 -10,-0.0 -0.714 111.9 26.6 -81.4 136.3 40.5 -1.5 60.2 285 76 C G T 3> S+ 0 0 29 -2,-0.4 4,-1.7 -3,-0.0 -1,-0.2 0.412 91.2 118.6 88.6 -0.3 42.1 0.6 63.0 286 77 C A H <> + 0 0 1 -3,-1.0 4,-2.2 1,-0.2 5,-0.2 0.904 66.6 50.7 -64.0 -48.3 40.3 3.6 61.6 287 78 C R H > S+ 0 0 83 -4,-0.3 4,-2.5 1,-0.2 -1,-0.2 0.884 111.2 48.6 -63.0 -39.7 38.1 4.5 64.5 288 79 C Q H > S+ 0 0 108 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.920 109.6 51.2 -67.9 -44.6 41.0 4.4 67.0 289 80 C R H X S+ 0 0 92 -4,-1.7 4,-1.7 1,-0.2 -2,-0.2 0.924 113.6 46.5 -55.6 -45.7 43.2 6.6 64.8 290 81 C L H X S+ 0 0 8 -4,-2.2 4,-1.4 2,-0.2 -2,-0.2 0.898 110.7 52.8 -63.1 -43.3 40.3 9.1 64.5 291 82 C L H X S+ 0 0 13 -4,-2.5 4,-2.3 2,-0.2 3,-0.4 0.936 110.7 43.9 -60.6 -51.1 39.6 9.0 68.3 292 83 C T H X S+ 0 0 70 -4,-2.5 4,-2.6 1,-0.3 -1,-0.2 0.890 110.7 57.3 -61.9 -37.4 43.2 9.8 69.4 293 84 C Q H X S+ 0 0 112 -4,-1.7 4,-1.5 -5,-0.3 -1,-0.3 0.815 108.2 47.9 -61.6 -31.0 43.2 12.4 66.7 294 85 C E H X S+ 0 0 56 -4,-1.4 4,-2.8 -3,-0.4 5,-0.2 0.872 108.1 53.3 -76.6 -40.5 40.1 13.9 68.4 295 86 C K H X S+ 0 0 83 -4,-2.3 4,-3.2 2,-0.2 5,-0.3 0.950 107.7 51.9 -57.7 -51.0 41.7 13.8 71.9 296 87 C Q H X S+ 0 0 116 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.962 114.8 41.1 -48.0 -63.9 44.7 15.7 70.6 297 88 C Y H X>S+ 0 0 135 -4,-1.5 4,-2.6 2,-0.2 5,-0.7 0.960 116.4 48.1 -48.3 -63.8 42.6 18.5 69.1 298 89 C F H X>S+ 0 0 9 -4,-2.8 5,-4.1 1,-0.2 4,-1.9 0.903 113.8 46.2 -49.2 -51.8 40.1 18.7 72.0 299 90 C L H <5S+ 0 0 74 -4,-3.2 -1,-0.2 -5,-0.2 -2,-0.2 0.938 121.1 40.0 -57.8 -48.4 42.8 18.8 74.7 300 91 C K H <5S+ 0 0 156 -4,-2.8 -2,-0.2 -5,-0.3 -3,-0.2 0.996 133.8 13.8 -59.8 -70.5 44.8 21.4 72.7 301 92 C K H <5S+ 0 0 135 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.451 136.3 30.4 -94.0 -4.6 42.2 23.8 71.3 302 93 C Q T < S+ 0 0 21 3,-0.1 4,-0.5 2,-0.1 3,-0.4 0.717 105.9 42.0 -84.6 -42.5 35.4 26.0 85.5 311 102 C E T 4 S+ 0 0 138 1,-0.2 -3,-0.1 2,-0.1 4,-0.1 0.817 106.4 62.9 -67.3 -34.7 37.6 27.8 88.0 312 103 C R T 4 S+ 0 0 141 2,-0.1 -1,-0.2 1,-0.0 -2,-0.1 0.841 125.7 9.8 -58.9 -32.5 36.0 31.1 87.1 313 104 C L T 4 S- 0 0 31 -3,-0.4 2,-0.3 1,-0.3 -2,-0.1 0.778 125.4 -23.0-112.9 -79.8 32.7 29.7 88.4 314 105 C G < + 0 0 9 -4,-0.5 -1,-0.3 -5,-0.2 2,-0.2 -0.974 61.1 169.7-145.6 156.8 32.5 26.4 90.4 315 106 C I + 0 0 93 -2,-0.3 -4,-0.1 1,-0.1 3,-0.0 -0.673 36.6 84.9-152.5-171.3 34.8 23.4 90.6 316 107 C D S S- 0 0 136 -2,-0.2 -1,-0.1 1,-0.1 -5,-0.0 0.998 78.2-112.0 60.0 74.8 35.9 20.1 92.1 317 108 C L 0 0 111 1,-0.1 -1,-0.1 -3,-0.1 -2,-0.0 -0.040 360.0 360.0 -47.6 140.7 33.6 17.7 90.2 318 109 C K 0 0 159 -3,-0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.741 360.0 360.0-135.5 360.0 31.3 16.4 92.8