==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 06-JUL-06 2IX4 . COMPND 2 MOLECULE: 3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ARABIDOPSIS THALIANA; . AUTHOR C.E.CHRISTENSEN,B.B.KRAGELUND,P.VON WETTSTEIN-KNOWLES, A.HEN . 862 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27258.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 613 71.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 54 6.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 110 12.8 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 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.5 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 . 2 0.2 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 . 58 6.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 246 28.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 18 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 5 4 2 0 0 5 3 0 2 0 2 5 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 2 4 0 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 PARALLEL BRIDGES PER LADDER . 4 6 2 0 0 0 0 8 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 2 0 0 0 0 0 0 0 2 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 31 A R 0 0 125 0, 0.0 2,-0.3 0, 0.0 195,-0.0 0.000 360.0 360.0 360.0 135.1 43.4 66.6 44.8 2 32 A R - 0 0 117 191,-0.1 258,-2.5 192,-0.0 2,-0.5 -0.684 360.0-141.7 -98.3 150.8 40.5 64.1 45.3 3 33 A V E -A 259 0A 1 271,-0.5 271,-2.5 -2,-0.3 2,-0.3 -0.950 19.7-178.2-119.8 124.4 40.7 60.4 44.7 4 34 A V E -AB 258 273A 0 254,-3.1 254,-2.5 -2,-0.5 2,-0.5 -0.792 27.3-118.8-119.7 162.9 37.9 58.3 43.2 5 35 A V E +AB 257 272A 0 267,-2.6 266,-3.0 -2,-0.3 267,-0.6 -0.899 33.7 163.4-104.4 123.2 37.4 54.6 42.4 6 36 A T E + 0 0 0 250,-2.4 2,-0.3 -2,-0.5 263,-0.2 0.447 61.9 35.9-119.1 -5.9 36.7 53.9 38.8 7 37 A G E -A 256 0A 0 249,-0.9 249,-2.4 96,-0.1 2,-0.4 -0.984 56.8-163.6-153.4 139.7 37.3 50.1 38.5 8 38 A L E +A 255 0A 1 -2,-0.3 2,-0.3 90,-0.2 10,-0.2 -0.967 13.9 167.7-124.6 140.4 36.8 47.0 40.7 9 39 A G E +A 254 0A 0 245,-1.9 245,-3.3 -2,-0.4 2,-0.3 -0.982 5.1 157.5-152.5 138.6 38.4 43.6 40.3 10 40 A M E -A 253 0A 0 -2,-0.3 7,-2.8 243,-0.2 2,-0.4 -0.996 28.0-160.7-159.2 154.6 38.6 40.5 42.5 11 41 A V E +AC 252 16A 0 241,-2.3 241,-2.4 -2,-0.3 5,-0.3 -0.955 36.3 155.9-136.5 117.8 39.1 36.7 42.8 12 42 A T E > - C 0 15A 0 3,-2.8 3,-2.1 -2,-0.4 239,-0.1 -0.775 60.7 -89.9-134.7 172.3 37.8 35.2 46.0 13 43 A P T 3 S+ 0 0 5 0, 0.0 51,-0.2 0, 0.0 3,-0.1 0.568 125.8 60.3 -62.7 -8.8 36.5 31.9 47.6 14 44 A L T 3 S- 0 0 0 1,-0.4 10,-0.2 49,-0.1 2,-0.2 0.268 125.4 -73.9 -98.1 7.0 33.1 33.1 46.4 15 45 A G E < -C 12 0A 0 -3,-2.1 -3,-2.8 9,-0.1 2,-0.5 -0.478 51.5 -66.5 128.0 166.1 34.3 33.1 42.8 16 46 A R E S+C 11 0A 81 56,-2.3 4,-0.3 -5,-0.3 -5,-0.2 -0.818 96.6 33.3 -89.5 126.3 36.4 34.9 40.2 17 47 A G S > S- 0 0 8 -7,-2.8 4,-2.0 -2,-0.5 5,-0.2 0.002 84.6 -99.1 107.1 147.3 35.0 38.3 39.3 18 48 A V H > S+ 0 0 18 -10,-0.2 4,-2.8 2,-0.2 5,-0.3 0.926 118.1 54.6 -62.6 -48.2 33.2 41.1 41.2 19 49 A E H > S+ 0 0 128 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.932 112.7 41.2 -52.2 -54.8 29.7 40.1 39.9 20 50 A T H > S+ 0 0 24 -4,-0.3 4,-2.1 2,-0.2 5,-0.2 0.904 117.0 47.7 -63.8 -45.5 30.0 36.5 41.1 21 51 A T H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.953 115.2 44.2 -61.2 -53.0 31.6 37.3 44.5 22 52 A W H X S+ 0 0 25 -4,-2.8 4,-2.4 2,-0.2 5,-0.2 0.872 113.0 51.4 -60.8 -42.4 29.1 40.1 45.4 23 53 A R H X S+ 0 0 109 -4,-2.3 4,-2.0 -5,-0.3 -1,-0.2 0.942 114.4 42.4 -61.2 -49.6 26.0 38.1 44.3 24 54 A R H <>S+ 0 0 56 -4,-2.1 5,-2.9 -10,-0.2 4,-0.3 0.836 112.8 54.3 -67.9 -34.2 27.0 35.0 46.4 25 55 A L H ><5S+ 0 0 4 -4,-2.3 3,-1.2 -5,-0.2 358,-0.3 0.941 111.4 43.7 -62.5 -49.7 28.0 37.2 49.3 26 56 A I H 3<5S+ 0 0 34 -4,-2.4 378,-0.3 1,-0.3 -2,-0.2 0.844 108.9 58.1 -66.4 -35.2 24.6 39.0 49.4 27 57 A D T 3<5S- 0 0 101 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.505 119.7-111.8 -72.7 -6.1 22.8 35.6 49.0 28 58 A G T < 5 + 0 0 24 -3,-1.2 -3,-0.2 -4,-0.3 -2,-0.1 0.746 61.4 156.9 83.5 26.9 24.6 34.4 52.1 29 59 A E < - 0 0 76 -5,-2.9 2,-0.4 -6,-0.1 -1,-0.2 -0.341 29.6-143.4 -84.1 166.6 26.9 31.8 50.6 30 60 A C - 0 0 12 2,-0.1 327,-0.2 -2,-0.1 326,-0.1 -0.997 12.5-159.8-138.5 132.7 30.1 30.6 52.1 31 61 A G + 0 0 12 325,-2.8 33,-1.1 -2,-0.4 2,-0.3 0.306 56.1 115.7 -95.9 8.3 33.4 29.6 50.4 32 62 A I E +K 63 0B 4 323,-0.2 2,-0.3 31,-0.2 31,-0.2 -0.608 33.9 160.6 -83.7 135.6 34.8 27.4 53.3 33 63 A R E -K 62 0B 99 29,-2.6 29,-2.3 -2,-0.3 2,-0.1 -0.926 42.4 -81.8-141.9 169.3 35.4 23.7 52.9 34 64 A G E -K 61 0B 28 -2,-0.3 27,-0.3 27,-0.2 2,-0.1 -0.408 49.3-106.0 -70.9 147.7 37.4 20.9 54.6 35 65 A L - 0 0 17 25,-2.9 2,-0.2 -2,-0.1 -1,-0.1 -0.425 33.9-169.3 -70.8 146.4 41.1 20.4 53.8 36 66 A T > - 0 0 64 -2,-0.1 3,-0.6 1,-0.0 4,-0.3 -0.742 40.6 -97.4-121.7 177.4 42.3 17.5 51.6 37 67 A L G > S+ 0 0 43 -2,-0.2 3,-1.3 1,-0.2 5,-0.5 0.849 122.1 59.2 -63.0 -36.3 45.8 16.2 50.9 38 68 A D G > S+ 0 0 127 1,-0.2 3,-1.2 2,-0.2 -1,-0.2 0.781 94.6 65.3 -62.1 -29.0 45.9 18.2 47.6 39 69 A D G < S+ 0 0 12 -3,-0.6 -1,-0.2 1,-0.2 -2,-0.2 0.616 83.9 74.1 -72.5 -13.5 45.4 21.4 49.6 40 70 A L G < S- 0 0 3 -3,-1.3 172,-2.3 -4,-0.3 173,-0.3 0.679 95.6-136.5 -70.7 -19.0 48.8 21.0 51.3 41 71 A K < + 0 0 62 -3,-1.2 3,-0.2 -4,-0.2 -2,-0.1 0.831 60.6 135.3 60.5 38.1 50.6 22.0 48.1 42 72 A M > + 0 0 6 -5,-0.5 3,-2.0 1,-0.2 8,-0.1 -0.254 5.4 139.3-111.2 44.6 53.1 19.1 48.6 43 73 A K T 3 S+ 0 0 162 1,-0.3 -1,-0.2 -5,-0.1 4,-0.1 0.758 72.1 58.2 -59.0 -26.3 53.3 17.6 45.1 44 74 A S T 3 S+ 0 0 45 -3,-0.2 2,-0.3 2,-0.1 -1,-0.3 0.436 96.5 78.9 -85.2 -1.0 57.1 17.1 45.6 45 75 A F S < S- 0 0 14 -3,-2.0 -3,-0.0 1,-0.1 2,-0.0 -0.748 86.3-105.3-105.8 155.4 56.6 15.0 48.7 46 76 A D > - 0 0 95 -2,-0.3 4,-2.2 1,-0.1 3,-0.4 -0.298 34.0-106.7 -74.0 163.5 55.7 11.3 48.9 47 77 A E H > S+ 0 0 105 1,-0.2 4,-3.1 2,-0.2 5,-0.2 0.847 118.0 56.7 -61.0 -37.7 52.2 10.2 50.0 48 78 A E H > S+ 0 0 134 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.866 109.6 46.0 -62.1 -38.4 53.4 9.0 53.5 49 79 A T H > S+ 0 0 8 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.896 112.7 50.6 -70.5 -42.6 54.8 12.5 54.2 50 80 A K H X S+ 0 0 24 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.946 112.3 46.9 -55.1 -53.2 51.6 14.1 52.9 51 81 A L H X S+ 0 0 84 -4,-3.1 4,-1.7 1,-0.2 -2,-0.2 0.922 113.9 47.2 -58.1 -48.9 49.4 11.8 55.1 52 82 A Y H X S+ 0 0 47 -4,-2.2 4,-0.7 -5,-0.2 -1,-0.2 0.915 112.7 49.8 -56.9 -47.1 51.6 12.5 58.2 53 83 A T H >< S+ 0 0 0 -4,-2.6 3,-1.3 1,-0.2 4,-0.4 0.916 106.8 53.9 -63.2 -46.3 51.6 16.3 57.6 54 84 A F H >< S+ 0 0 37 -4,-2.6 3,-1.6 1,-0.3 -1,-0.2 0.894 104.8 55.8 -52.2 -45.4 47.8 16.5 57.2 55 85 A D H 3< S+ 0 0 113 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.689 99.7 60.9 -63.4 -20.1 47.4 14.8 60.6 56 86 A Q T << S+ 0 0 80 -3,-1.3 2,-0.7 -4,-0.7 -1,-0.3 0.546 82.2 100.8 -85.3 -7.1 49.5 17.4 62.2 57 87 A L < - 0 0 2 -3,-1.6 159,-0.1 -4,-0.4 155,-0.0 -0.713 50.9-170.3 -87.9 114.1 47.1 20.2 61.2 58 88 A S S S+ 0 0 67 -2,-0.7 2,-0.6 157,-0.1 -1,-0.2 0.897 80.7 57.1 -64.1 -43.0 44.8 21.4 64.0 59 89 A S + 0 0 0 156,-0.2 167,-0.2 1,-0.1 -1,-0.1 -0.839 59.0 172.6 -96.1 120.4 42.8 23.4 61.6 60 90 A K + 0 0 57 -2,-0.6 -25,-2.9 165,-0.2 2,-0.3 -0.135 51.9 85.6-120.2 34.6 41.4 21.4 58.6 61 91 A V E +K 34 0B 4 164,-0.3 187,-0.4 -27,-0.3 2,-0.3 -0.972 45.7 158.9-133.7 148.1 39.2 24.0 57.0 62 92 A A E -K 33 0B 0 -29,-2.3 -29,-2.6 -2,-0.3 2,-0.6 -0.981 38.5-115.0-162.1 161.8 40.0 26.8 54.5 63 93 A A E -Kl 32 249B 0 185,-2.4 187,-0.9 -2,-0.3 2,-0.3 -0.927 38.0-163.4-110.0 115.8 38.4 29.1 51.9 64 94 A F - 0 0 19 -33,-1.1 -52,-0.1 -2,-0.6 185,-0.0 -0.764 22.9-121.4-108.6 140.0 39.5 28.3 48.3 65 95 A V - 0 0 5 -2,-0.3 2,-0.5 -54,-0.1 186,-0.1 -0.597 40.0-117.8 -65.7 128.5 39.4 30.2 45.0 66 96 A P - 0 0 38 0, 0.0 8,-3.6 0, 0.0 2,-0.2 -0.639 30.3-153.5 -74.0 123.0 37.5 28.0 42.6 67 97 A Y B +m 74 0C 75 -2,-0.5 8,-0.2 6,-0.3 2,-0.2 -0.652 37.6 96.1 -93.7 152.1 39.7 27.0 39.6 68 98 A G S S- 0 0 17 6,-1.8 5,-0.1 -2,-0.2 4,-0.0 -0.789 73.4 -95.9 149.7 170.5 38.4 26.2 36.1 69 99 A S S S+ 0 0 100 -2,-0.2 6,-0.1 6,-0.1 -1,-0.1 0.267 89.5 93.5 -99.3 9.4 37.7 27.4 32.6 70 100 A N S > S- 0 0 97 1,-0.2 3,-1.7 4,-0.1 5,-0.0 -0.529 91.1 -70.4 -98.4 164.4 34.0 28.1 33.2 71 101 A P T 3 S+ 0 0 122 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 -0.252 120.2 20.2 -53.7 139.8 32.3 31.4 34.3 72 102 A G T 3 S+ 0 0 12 1,-0.3 -56,-2.3 -56,-0.2 2,-0.3 0.485 104.5 110.2 78.4 4.8 33.1 32.5 37.8 73 103 A E S < S- 0 0 52 -3,-1.7 2,-0.7 -58,-0.2 -1,-0.3 -0.844 71.5-118.9-114.8 149.6 36.2 30.3 38.0 74 104 A F B -m 67 0C 0 -8,-3.6 -6,-1.8 -2,-0.3 2,-0.9 -0.776 25.0-147.9 -88.3 115.1 39.9 31.2 38.1 75 105 A D >> - 0 0 44 -2,-0.7 3,-1.7 -8,-0.2 4,-1.7 -0.733 11.8-170.2 -89.8 103.2 41.7 29.7 35.0 76 106 A E H 3> S+ 0 0 85 -2,-0.9 4,-1.9 1,-0.3 -1,-0.2 0.751 85.8 64.9 -61.4 -25.6 45.3 28.8 36.0 77 107 A A H 34 S+ 0 0 71 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.668 110.5 37.2 -69.8 -18.2 46.1 28.2 32.3 78 108 A L H <4 S+ 0 0 103 -3,-1.7 3,-0.2 2,-0.1 -2,-0.2 0.757 129.8 26.5-101.6 -34.1 45.5 31.9 31.6 79 109 A W H < S+ 0 0 36 -4,-1.7 -3,-0.2 1,-0.2 -2,-0.2 0.609 122.8 45.8-111.5 -18.9 46.9 33.6 34.8 80 110 A L S < S+ 0 0 36 -4,-1.9 -1,-0.2 -5,-0.3 -4,-0.1 -0.342 72.6 123.5-119.8 49.4 49.6 31.1 35.9 81 111 A N + 0 0 122 -3,-0.2 2,-0.3 9,-0.0 -1,-0.1 0.043 56.6 72.5-101.7 23.6 51.2 30.5 32.5 82 112 A S S > S- 0 0 62 3,-0.2 3,-1.1 -3,-0.1 -3,-0.0 -0.978 76.5-128.0-139.9 151.0 54.8 31.4 33.4 83 113 A K T 3 S+ 0 0 162 -2,-0.3 69,-0.1 1,-0.2 -1,-0.1 0.726 109.8 52.6 -69.2 -23.4 57.6 29.9 35.5 84 114 A A T 3 S+ 0 0 3 67,-0.1 2,-0.8 1,-0.1 -1,-0.2 0.424 88.2 98.0 -92.5 -0.4 58.1 33.2 37.5 85 115 A V < - 0 0 23 -3,-1.1 -3,-0.2 4,-0.1 2,-0.1 -0.800 52.9-169.8-100.4 103.9 54.4 33.4 38.5 86 116 A A >> - 0 0 3 -2,-0.8 4,-1.8 66,-0.1 3,-0.8 -0.434 42.4 -97.7 -76.6 164.7 53.4 32.2 41.9 87 117 A N H 3> S+ 0 0 50 1,-0.3 4,-2.2 2,-0.2 5,-0.2 0.853 122.7 55.7 -57.2 -40.8 49.7 31.9 42.8 88 118 A F H 3> S+ 0 0 1 120,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.853 107.9 50.8 -61.0 -33.9 49.5 35.2 44.6 89 119 A I H <> S+ 0 0 0 -3,-0.8 4,-2.2 2,-0.2 -1,-0.2 0.913 109.5 49.6 -68.4 -43.8 50.9 36.9 41.5 90 120 A G H X S+ 0 0 0 -4,-1.8 4,-2.4 1,-0.2 -2,-0.2 0.859 108.7 52.6 -63.5 -38.8 48.3 35.3 39.2 91 121 A Y H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 -1,-0.2 0.919 111.0 47.1 -61.3 -45.6 45.4 36.3 41.5 92 122 A A H X S+ 0 0 0 -4,-1.6 4,-3.0 2,-0.2 -2,-0.2 0.891 112.4 48.5 -65.3 -43.1 46.5 39.9 41.4 93 123 A V H X S+ 0 0 16 -4,-2.2 4,-2.4 2,-0.2 -1,-0.2 0.923 112.3 49.9 -64.2 -44.3 47.0 40.0 37.6 94 124 A C H X S+ 0 0 5 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.937 116.0 41.9 -56.2 -51.0 43.5 38.4 37.2 95 125 A A H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.872 113.4 52.7 -65.8 -40.2 41.9 40.9 39.5 96 126 A A H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 5,-0.2 0.879 106.7 53.4 -64.4 -38.9 43.9 43.8 38.1 97 127 A D H X S+ 0 0 21 -4,-2.4 4,-1.7 2,-0.2 -1,-0.2 0.876 110.9 46.0 -63.3 -40.9 42.8 42.9 34.5 98 128 A E H X S+ 0 0 54 -4,-1.5 4,-2.5 2,-0.2 -90,-0.2 0.934 113.7 48.9 -65.3 -48.6 39.1 43.0 35.6 99 129 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.906 112.5 47.4 -57.5 -46.5 39.5 46.3 37.5 100 130 A L H <>S+ 0 0 0 -4,-2.7 5,-3.0 2,-0.2 4,-0.4 0.858 113.4 47.0 -67.1 -37.7 41.3 48.0 34.5 101 131 A R H <5S+ 0 0 149 -4,-1.7 3,-0.4 3,-0.2 -1,-0.2 0.873 111.7 52.0 -71.3 -36.7 38.7 46.8 32.0 102 132 A D H <5S+ 0 0 46 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.906 114.2 42.9 -59.1 -44.9 36.0 47.9 34.4 103 133 A A T <5S- 0 0 4 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.534 108.0-130.1 -76.9 -8.4 37.7 51.3 34.5 104 134 A E T 5 + 0 0 162 -4,-0.4 2,-0.6 -3,-0.4 -3,-0.2 0.886 60.1 144.4 53.0 42.3 38.2 51.2 30.8 105 135 A W < + 0 0 11 -5,-3.0 -1,-0.2 -6,-0.1 -2,-0.1 -0.774 5.7 127.3-115.8 85.2 41.9 52.1 31.5 106 136 A L - 0 0 73 -2,-0.6 -1,-0.1 -3,-0.1 7,-0.1 -0.585 43.6-165.4-129.9 68.6 44.2 50.4 29.1 107 137 A P - 0 0 13 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.224 21.9-173.4 -65.3 144.7 46.2 53.4 27.8 108 138 A T + 0 0 115 5,-0.0 2,-0.2 4,-0.0 3,-0.0 0.622 61.6 91.9-102.2 -23.4 48.4 53.1 24.7 109 139 A E S > S- 0 0 124 1,-0.1 4,-2.2 4,-0.0 3,-0.3 -0.550 73.6-138.2 -79.9 136.5 50.0 56.5 25.0 110 140 A E H > S+ 0 0 84 -2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.833 101.7 61.7 -62.1 -34.4 53.3 56.8 26.9 111 141 A E H > S+ 0 0 156 2,-0.2 4,-0.6 1,-0.2 -1,-0.2 0.906 110.5 38.0 -56.5 -47.2 52.1 60.0 28.7 112 142 A E H 4 S+ 0 0 72 -3,-0.3 3,-0.4 2,-0.2 -2,-0.2 0.866 115.0 54.4 -73.3 -40.3 49.2 58.2 30.4 113 143 A K H >< S+ 0 0 42 -4,-2.2 56,-2.1 1,-0.2 3,-1.1 0.879 107.0 51.4 -59.9 -42.3 51.2 55.0 31.0 114 144 A E H 3< S+ 0 0 51 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.713 108.3 52.8 -68.5 -23.1 53.8 57.0 32.8 115 145 A R T 3< S+ 0 0 67 -4,-0.6 84,-2.6 -3,-0.4 85,-1.8 0.359 96.0 84.3 -94.1 4.0 51.1 58.6 35.0 116 146 A T E < +d 200 0A 0 -3,-1.1 54,-3.0 -4,-0.2 85,-0.2 -0.936 58.2 178.1-110.6 124.0 49.7 55.2 36.0 117 147 A G E -d 201 0A 1 83,-2.7 85,-2.4 -2,-0.5 2,-0.4 -0.579 19.7-131.7-115.0-179.6 51.3 53.3 38.9 118 148 A V E +de 202 172A 1 53,-2.7 55,-3.0 83,-0.2 85,-0.2 -1.000 19.3 173.3-138.0 133.2 50.7 50.0 40.8 119 149 A S E +de 203 173A 0 83,-2.8 85,-2.2 -2,-0.4 2,-0.5 -0.680 22.5 145.8-139.3 82.4 50.5 49.2 44.5 120 150 A I E -d 204 0A 0 53,-0.9 39,-0.7 83,-0.3 85,-0.2 -0.954 25.7-168.9-123.0 109.8 49.5 45.6 45.1 121 151 A G E -d 205 0A 0 83,-1.7 85,-1.9 -2,-0.5 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107.9 49.8 -64.2 -44.8 59.3 24.6 51.2 132 162 A E H X S+ 0 0 47 -4,-2.0 4,-0.9 1,-0.2 -2,-0.2 0.893 113.1 46.9 -60.0 -42.1 60.0 22.9 47.8 133 163 A A H X S+ 0 0 4 -4,-1.7 4,-1.0 1,-0.2 3,-0.5 0.887 109.7 52.6 -67.2 -41.2 63.4 24.6 47.7 134 164 A A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 3,-0.2 0.815 102.2 60.6 -65.1 -31.3 64.2 23.7 51.3 135 165 A Q H X S+ 0 0 4 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.839 97.8 59.1 -62.4 -34.9 63.4 20.0 50.5 136 166 A L H <>S+ 0 0 17 -4,-0.9 5,-3.1 -3,-0.5 4,-0.4 0.848 105.9 48.4 -62.6 -36.4 66.2 20.2 47.9 137 167 A I H ><5S+ 0 0 0 -4,-1.0 3,-0.8 3,-0.2 -2,-0.2 0.947 113.2 46.6 -65.7 -49.5 68.6 21.0 50.8 138 168 A C H 3<5S+ 0 0 27 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.850 120.5 38.0 -61.5 -37.6 67.3 18.1 52.9 139 169 A E T 3<5S- 0 0 89 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.385 110.0-119.4 -97.8 2.0 67.4 15.6 50.1 140 170 A K T < 5S+ 0 0 65 -3,-0.8 -3,-0.2 -4,-0.4 -4,-0.1 0.933 74.9 125.7 56.6 53.0 70.7 17.0 48.6 141 171 A R > < + 0 0 88 -5,-3.1 3,-1.5 -6,-0.1 4,-0.2 -0.237 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50.5 -55.6 -32.6 61.6 36.3 41.7 152 182 A K H 3< S+ 0 0 27 -4,-1.7 -2,-0.2 -3,-0.2 -63,-0.2 0.548 109.0 49.3 -88.1 -5.3 58.5 34.2 42.6 153 183 A I H << S+ 0 0 11 -3,-1.3 -27,-0.4 -4,-0.6 2,-0.4 0.536 81.4 108.3-105.7 -9.4 58.8 34.5 46.4 154 184 A L >< - 0 0 9 -4,-0.9 3,-2.0 -3,-0.2 4,-0.2 -0.577 64.5-142.6 -77.6 125.1 59.2 38.3 46.7 155 185 A V T 3 S+ 0 0 7 -2,-0.4 -33,-1.0 400,-0.4 3,-0.2 0.520 96.6 57.7 -68.8 -7.6 56.0 39.9 48.1 156 186 A N T >> S+ 0 0 0 399,-0.2 4,-1.1 1,-0.1 3,-0.8 0.497 78.8 94.1 -94.2 -6.3 56.3 43.0 45.8 157 187 A M H <> + 0 0 0 -3,-2.0 4,-2.5 1,-0.2 5,-0.2 0.657 69.0 68.5 -70.7 -19.6 56.2 41.0 42.6 158 188 A A H 3> S+ 0 0 0 -3,-0.2 4,-2.1 -38,-0.2 -1,-0.2 0.927 103.2 47.2 -61.5 -44.4 52.5 41.3 42.0 159 189 A S H <> S+ 0 0 0 -3,-0.8 4,-2.6 -39,-0.7 5,-0.2 0.880 110.9 53.2 -58.9 -42.5 53.0 45.1 41.3 160 190 A G H X S+ 0 0 0 -4,-1.1 4,-2.1 1,-0.2 -2,-0.2 0.921 111.1 44.1 -59.6 -48.0 56.0 44.2 39.0 161 191 A H H X S+ 0 0 25 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.845 114.7 49.1 -69.5 -36.5 53.9 41.8 36.9 162 192 A V H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 6,-0.3 0.953 112.4 47.2 -66.0 -50.7 50.9 44.1 36.7 163 193 A S H X>S+ 0 0 1 -4,-2.6 5,-1.9 1,-0.2 4,-1.5 0.896 113.3 49.8 -57.7 -43.6 53.1 47.1 35.7 164 194 A M H <5S+ 0 0 58 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.887 107.3 53.9 -60.2 -44.2 54.9 45.0 33.1 165 195 A K H <5S+ 0 0 116 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.873 122.7 26.4 -62.1 -38.5 51.7 43.7 31.5 166 196 A Y H <5S- 0 0 26 -4,-1.7 -1,-0.2 -5,-0.1 -2,-0.2 0.468 106.8-114.1-108.3 -4.7 50.2 47.1 30.9 167 197 A G T <5 + 0 0 11 -4,-1.5 2,-0.6 1,-0.2 -3,-0.2 0.802 50.6 172.2 75.8 31.2 53.3 49.2 30.6 168 198 A F < + 0 0 1 -5,-1.9 -1,-0.2 -6,-0.3 -54,-0.2 -0.648 11.2 174.1 -81.3 117.0 52.5 51.2 33.7 169 199 A Q + 0 0 14 -56,-2.1 544,-0.9 -2,-0.6 -55,-0.2 0.191 43.8 100.1-115.0 13.2 55.5 53.4 34.6 170 200 A G S S- 0 0 0 -54,-3.0 -52,-0.2 -57,-0.6 28,-0.1 -0.056 94.0 -28.1 -75.6-168.9 54.2 55.4 37.5 171 201 A P - 0 0 1 0, 0.0 -53,-2.7 0, 0.0 2,-0.7 -0.197 57.9-155.0 -48.8 126.3 55.1 54.5 41.1 172 202 A N E +e 118 0A 1 540,-0.6 2,-0.3 683,-0.3 -53,-0.2 -0.937 38.5 151.4-107.2 106.2 55.8 50.7 41.4 173 203 A H E -e 119 0A 0 -55,-3.0 -53,-0.9 -2,-0.7 2,-0.3 -0.805 35.5-169.2-139.5 160.8 55.0 50.0 45.0 174 204 A A - 0 0 0 -2,-0.3 434,-2.3 -55,-0.2 2,-0.5 -0.869 9.9-156.9-155.9 130.2 53.8 47.6 47.7 175 205 A A B -N 607 0D 0 -2,-0.3 2,-0.5 432,-0.3 432,-0.3 -0.914 13.1-167.5 -98.4 133.1 52.9 48.1 51.3 176 206 A V + 0 0 0 430,-2.5 3,-0.1 -2,-0.5 -53,-0.1 -0.952 26.2 147.4-127.6 112.2 53.2 45.0 53.4 177 207 A T > - 0 0 0 -2,-0.5 3,-1.9 1,-0.4 2,-0.1 -0.296 58.1-111.3-141.0 44.9 51.6 45.1 56.8 178 208 A A G > S- 0 0 6 1,-0.3 3,-1.5 -55,-0.2 -1,-0.4 -0.356 96.1 -0.8 56.7-123.5 50.4 41.5 57.5 179 209 A C G 3 S+ 0 0 12 1,-0.3 186,-0.4 2,-0.1 -1,-0.3 0.479 135.6 57.0 -80.0 0.4 46.6 41.3 57.4 180 210 A A G X> S+ 0 0 0 -3,-1.9 4,-2.4 236,-0.1 3,-0.9 0.341 75.8 108.5-100.7 3.2 46.3 45.1 56.8 181 211 A T H <> S+ 0 0 0 -3,-1.5 4,-2.2 1,-0.3 -6,-0.2 0.857 76.4 47.4 -50.0 -50.5 48.4 44.7 53.6 182 212 A G H 3> S+ 0 0 0 180,-0.8 4,-1.3 179,-0.3 -1,-0.3 0.788 113.6 49.4 -64.5 -29.2 45.6 45.3 51.1 183 213 A A H <> S+ 0 0 0 -3,-0.9 4,-2.8 2,-0.2 -2,-0.2 0.948 112.4 44.4 -76.6 -51.1 44.4 48.4 53.1 184 214 A H H X S+ 0 0 0 -4,-2.4 4,-3.2 2,-0.2 5,-0.3 0.841 110.6 56.5 -60.6 -36.2 47.8 50.1 53.4 185 215 A S H X S+ 0 0 0 -4,-2.2 4,-1.6 -5,-0.3 -1,-0.2 0.923 112.3 41.4 -62.5 -44.2 48.5 49.4 49.7 186 216 A I H X S+ 0 0 0 -4,-1.3 4,-1.8 2,-0.2 -2,-0.2 0.908 117.0 49.5 -66.2 -44.6 45.3 51.2 48.7 187 217 A G H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.901 110.0 48.9 -63.5 -45.2 45.9 53.9 51.2 188 218 A D H X S+ 0 0 6 -4,-3.2 4,-1.7 1,-0.2 -1,-0.2 0.884 110.1 52.7 -61.3 -40.8 49.5 54.6 50.1 189 219 A A H X S+ 0 0 0 -4,-1.6 4,-1.8 -5,-0.3 -1,-0.2 0.850 107.1 52.9 -63.2 -37.7 48.4 54.7 46.5 190 220 A T H X S+ 0 0 0 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.939 106.9 51.5 -60.5 -50.1 45.8 57.3 47.4 191 221 A R H X S+ 0 0 10 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.851 108.2 53.7 -54.8 -38.2 48.5 59.5 49.1 192 222 A M H X>S+ 0 0 2 -4,-1.7 5,-2.3 2,-0.2 4,-1.5 0.891 110.3 44.5 -65.9 -43.1 50.5 59.2 45.9 193 223 A I H <5S+ 0 0 0 -4,-1.8 -2,-0.2 4,-0.2 -1,-0.2 0.911 113.3 52.7 -65.9 -42.2 47.6 60.5 43.7 194 224 A Q H <5S+ 0 0 44 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.919 112.8 43.2 -57.6 -47.9 46.9 63.2 46.3 195 225 A F H <5S- 0 0 87 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.761 119.7-109.0 -71.5 -27.5 50.5 64.4 46.3 196 226 A G T <5S+ 0 0 22 -4,-1.5 -3,-0.2 2,-0.3 -4,-0.1 0.521 81.2 126.4 108.7 10.0 50.8 64.2 42.4 197 227 A D S S- 0 0 5 -2,-1.0 4,-2.6 1,-0.1 5,-0.3 -0.954 80.2 -83.0-161.0 168.9 49.6 25.1 52.3 212 242 A A H > S+ 0 0 4 -172,-2.3 4,-2.6 -2,-0.3 5,-0.2 0.868 122.6 38.9 -47.8 -55.9 51.1 22.7 54.8 213 243 A L H > S+ 0 0 1 -173,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.831 115.0 52.7 -72.6 -34.2 53.5 25.1 56.6 214 244 A S H > S+ 0 0 0 2,-0.2 4,-2.6 3,-0.2 5,-0.2 0.941 114.0 42.6 -63.7 -49.3 51.1 28.1 56.5 215 245 A V H X S+ 0 0 5 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.935 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33,-1.1 -2,-0.3 2,-0.4 0.253 56.8 116.4-100.9 11.5 83.1 44.5 55.0 464 62 B I E +C 495 0J 2 324,-0.2 2,-0.3 31,-0.2 31,-0.2 -0.673 33.9 162.3 -87.8 131.7 83.2 41.5 52.6 465 63 B R E -C 494 0J 99 29,-2.6 29,-2.3 -2,-0.4 2,-0.2 -0.850 42.4 -77.5-134.3 174.4 84.7 38.2 53.7 466 64 B G E -C 493 0J 27 -2,-0.3 27,-0.3 27,-0.2 2,-0.2 -0.473 48.5-109.0 -75.2 144.4 84.7 34.5 52.5 467 65 B L - 0 0 16 25,-2.8 2,-0.2 -2,-0.2 -1,-0.1 -0.466 34.7-169.3 -69.5 140.8 81.7 32.3 53.3 468 66 B T - 0 0 64 -2,-0.2 3,-0.4 1,-0.0 4,-0.3 -0.695 38.9-100.5-117.3 177.7 82.1 29.5 55.9 469 67 B L S > S+ 0 0 42 -2,-0.2 3,-1.6 1,-0.2 5,-0.4 0.885 121.4 58.5 -63.3 -41.3 79.9 26.5 56.9 470 68 B D G > S+ 0 0 134 1,-0.3 3,-1.0 2,-0.2 -1,-0.2 0.750 96.1 64.4 -58.6 -27.2 78.7 28.4 59.9 471 69 B D G 3 S+ 0 0 18 -3,-0.4 -1,-0.3 1,-0.2 -2,-0.2 0.606 82.8 75.8 -75.6 -13.5 77.4 31.2 57.6 472 70 B L G < S- 0 0 4 -3,-1.6 172,-2.5 -4,-0.3 -1,-0.2 0.695 95.7-135.8 -69.6 -19.0 74.8 28.8 56.0 473 71 B K < + 0 0 65 -3,-1.0 3,-0.2 -4,-0.3 -2,-0.1 0.867 59.5 138.0 62.3 41.3 72.7 29.1 59.2 474 72 B M > + 0 0 6 -5,-0.4 3,-1.8 1,-0.2 -1,-0.1 -0.320 5.3 141.5-113.3 46.3 72.1 25.3 59.0 475 73 B K T 3 S+ 0 0 194 1,-0.3 -1,-0.2 -5,-0.1 -2,-0.0 0.725 72.4 55.5 -60.3 -24.7 72.4 24.5 62.7 476 74 B S T 3 S+ 0 0 39 -3,-0.2 2,-0.3 2,-0.1 -1,-0.3 0.397 97.1 82.2 -91.0 2.1 69.6 21.9 62.5 477 75 B F S < S- 0 0 17 -3,-1.8 -3,-0.1 1,-0.1 -339,-0.0 -0.764 82.4-109.5-108.0 152.5 71.3 20.0 59.7 478 76 B D > - 0 0 95 -2,-0.3 4,-1.9 1,-0.1 3,-0.3 -0.255 34.2-103.8 -75.7 168.6 74.1 17.4 59.9 479 77 B E H > S+ 0 0 105 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.838 117.6 57.0 -65.3 -36.2 77.6 18.0 58.7 480 78 B E H > S+ 0 0 135 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.875 109.3 45.7 -62.1 -40.8 77.3 16.0 55.4 481 79 B T H > S+ 0 0 10 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.860 111.0 53.3 -72.1 -38.2 74.3 18.2 54.3 482 80 B K H X S+ 0 0 27 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.943 111.6 45.6 -57.6 -50.4 76.2 21.4 55.3 483 81 B L H X S+ 0 0 100 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.887 112.8 49.9 -63.9 -42.9 79.2 20.4 53.2 484 82 B Y H X S+ 0 0 54 -4,-2.1 4,-1.1 2,-0.2 -1,-0.2 0.948 113.0 46.6 -58.1 -51.3 77.1 19.4 50.2 485 83 B T H >X S+ 0 0 0 -4,-2.4 4,-0.7 1,-0.2 3,-0.6 0.904 110.9 51.5 -60.3 -46.5 75.2 22.7 50.3 486 84 B F H >< S+ 0 0 41 -4,-2.5 3,-1.0 1,-0.2 -1,-0.2 0.889 108.1 52.6 -58.0 -42.3 78.3 24.8 50.7 487 85 B D H 3< S+ 0 0 114 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.759 104.4 58.0 -64.3 -27.0 79.9 23.0 47.7 488 86 B Q H << S+ 0 0 79 -4,-1.1 2,-0.6 -3,-0.6 -1,-0.2 0.632 84.0 97.1 -80.4 -15.1 76.8 23.8 45.6 489 87 B L << - 0 0 4 -3,-1.0 159,-0.1 -4,-0.7 158,-0.0 -0.668 52.8-168.5 -83.1 117.6 77.1 27.6 46.1 490 88 B S S S+ 0 0 56 -2,-0.6 2,-0.5 157,-0.1 -1,-0.2 0.828 78.6 61.5 -73.2 -32.4 78.8 29.3 43.2 491 89 B S + 0 0 1 156,-0.2 167,-0.2 1,-0.1 160,-0.1 -0.863 56.8 171.3 -96.3 123.0 79.2 32.6 45.2 492 90 B K + 0 0 55 -2,-0.5 -25,-2.8 165,-0.2 2,-0.3 -0.116 49.8 89.5-124.2 35.6 81.3 32.2 48.4 493 91 B V E +C 466 0J 4 164,-0.3 187,-0.4 -27,-0.3 2,-0.3 -0.978 44.4 160.6-130.6 143.3 81.5 35.8 49.5 494 92 B A E -C 465 0J 0 -29,-2.3 -29,-2.6 -2,-0.3 2,-0.6 -0.985 37.0-118.4-156.6 161.0 79.3 37.9 51.7 495 93 B A E -Cd 464 681J 0 185,-2.6 187,-1.0 -2,-0.3 2,-0.3 -0.918 36.1-165.4-110.0 114.3 79.2 41.1 53.8 496 94 B F - 0 0 24 -33,-1.1 -52,-0.1 -2,-0.6 187,-0.0 -0.779 24.0-120.0-108.2 141.2 78.6 40.4 57.5 497 95 B V - 0 0 5 -2,-0.3 2,-0.5 -54,-0.1 8,-0.1 -0.593 40.4-116.7 -66.8 128.1 77.7 42.6 60.5 498 96 B P - 0 0 36 0, 0.0 8,-3.3 0, 0.0 2,-0.2 -0.629 31.9-152.2 -74.8 121.9 80.5 42.3 63.1 499 97 B Y B +e 506 0K 75 -2,-0.5 2,-0.2 6,-0.3 8,-0.2 -0.617 38.3 89.2 -93.2 151.3 79.1 40.8 66.3 500 98 B G S S- 0 0 26 6,-2.1 5,-0.1 -2,-0.2 4,-0.0 -0.792 75.2 -90.0 147.0 174.1 80.5 41.4 69.8 501 99 B S S S+ 0 0 97 -2,-0.2 6,-0.1 6,-0.1 -1,-0.1 0.269 89.3 94.4 -99.4 7.8 80.4 43.4 73.0 502 100 B N S > S- 0 0 90 1,-0.1 3,-1.8 4,-0.1 5,-0.0 -0.550 90.8 -71.6 -96.9 162.0 83.1 45.9 71.9 503 101 B P T 3 S+ 0 0 120 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.245 121.5 21.4 -48.0 135.8 82.8 49.4 70.3 504 102 B G T 3 S+ 0 0 7 1,-0.3 -56,-2.3 -56,-0.2 2,-0.3 0.448 104.8 110.6 82.5 2.1 81.6 49.1 66.6 505 103 B E S < S- 0 0 54 -3,-1.8 2,-0.7 -58,-0.2 -6,-0.3 -0.842 71.6-117.0-116.3 148.1 80.2 45.7 67.2 506 104 B F B -e 499 0K 0 -8,-3.3 -6,-2.1 -2,-0.3 2,-1.0 -0.724 23.0-147.6 -85.1 112.7 76.6 44.3 67.3 507 105 B D >> - 0 0 51 -2,-0.7 4,-1.5 -8,-0.2 3,-1.0 -0.697 11.7-171.3 -84.2 100.5 75.8 42.9 70.7 508 106 B E H 3> S+ 0 0 107 -2,-1.0 4,-1.7 1,-0.3 -1,-0.2 0.729 81.6 64.9 -67.0 -23.1 73.3 40.0 70.0 509 107 B A H 34 S+ 0 0 80 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.816 106.8 43.3 -66.9 -32.2 72.6 39.6 73.7 510 108 B L H <4 S+ 0 0 109 -3,-1.0 3,-0.3 1,-0.1 -2,-0.2 0.916 127.3 24.4 -76.3 -47.4 71.0 43.0 73.7 511 109 B W H < S+ 0 0 38 -4,-1.5 2,-1.2 1,-0.2 3,-0.2 0.804 115.7 56.8 -99.9 -33.8 69.0 43.0 70.5 512 110 B L S < S+ 0 0 37 -4,-1.7 -1,-0.2 -5,-0.2 7,-0.1 -0.529 72.3 139.0 -93.5 66.3 68.3 39.3 69.8 513 111 B N + 0 0 120 -2,-1.2 2,-0.3 -3,-0.3 -1,-0.2 0.415 53.3 38.1-100.0 -3.2 66.7 39.0 73.2 514 112 B S S > S- 0 0 60 -3,-0.2 3,-1.4 3,-0.1 -3,-0.0 -0.954 80.0-110.3-144.2 165.2 63.6 36.9 72.6 515 113 B K T 3 S+ 0 0 162 -2,-0.3 65,-0.1 1,-0.3 69,-0.1 0.664 114.9 60.7 -67.5 -18.5 62.5 33.8 70.5 516 114 B A T 3 S+ 0 0 5 1,-0.1 2,-0.9 67,-0.0 -1,-0.3 0.476 83.9 96.2 -87.3 -4.3 60.3 36.1 68.3 517 115 B V < - 0 0 14 -3,-1.4 2,-0.1 4,-0.1 -3,-0.1 -0.785 53.9-170.9 -98.2 101.2 63.3 38.2 67.2 518 116 B A >> - 0 0 3 -2,-0.9 4,-2.1 66,-0.1 3,-0.6 -0.412 42.7 -98.8 -73.3 163.9 64.7 37.2 63.8 519 117 B N H 3> S+ 0 0 37 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.876 122.6 54.7 -55.4 -43.4 68.0 38.9 62.8 520 118 B F H 3> S+ 0 0 1 120,-0.3 4,-1.5 37,-0.2 -1,-0.2 0.833 109.5 48.8 -62.2 -33.0 66.4 41.5 60.6 521 119 B I H <> S+ 0 0 0 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.926 110.9 50.1 -69.8 -47.8 64.2 42.6 63.5 522 120 B G H X S+ 0 0 0 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.890 110.4 49.1 -56.4 -45.5 67.1 42.8 65.9 523 121 B Y H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.895 111.3 50.4 -61.8 -42.9 69.2 44.9 63.5 524 122 B A H X S+ 0 0 0 -4,-1.5 4,-2.6 -5,-0.2 -2,-0.2 0.898 111.4 46.7 -62.6 -45.3 66.2 47.3 62.9 525 123 B V H X S+ 0 0 17 -4,-2.3 4,-2.6 2,-0.2 -2,-0.2 0.917 113.2 50.0 -64.0 -44.1 65.6 47.8 66.7 526 124 B C H X S+ 0 0 7 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.938 114.9 43.6 -56.7 -50.7 69.4 48.3 67.2 527 125 B A H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.859 113.1 52.1 -64.0 -38.4 69.4 50.9 64.4 528 126 B A H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.895 106.9 52.8 -66.9 -41.1 66.2 52.5 65.6 529 127 B D H X S+ 0 0 21 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.922 111.1 46.6 -59.7 -47.3 67.5 52.9 69.2 530 128 B E H X S+ 0 0 53 -4,-1.8 4,-1.8 1,-0.2 -90,-0.2 0.926 113.6 49.1 -58.5 -47.8 70.6 54.7 67.9 531 129 B A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.864 113.1 46.0 -61.6 -40.3 68.5 56.9 65.6 532 130 B L H <>S+ 0 0 0 -4,-2.6 5,-3.0 2,-0.2 4,-0.5 0.852 112.9 48.3 -75.5 -36.6 66.0 57.9 68.3 533 131 B R H <5S+ 0 0 151 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.795 112.6 51.0 -71.6 -27.8 68.7 58.6 70.9 534 132 B D H <5S+ 0 0 47 -4,-1.8 -2,-0.2 -5,-0.2 167,-0.2 0.912 113.5 43.3 -70.5 -45.6 70.5 60.7 68.2 535 133 B A T <5S- 0 0 4 -4,-2.3 -2,-0.2 -5,-0.1 -1,-0.2 0.554 108.5-129.5 -72.5 -9.4 67.2 62.6 67.5 536 134 B E T 5 + 0 0 163 -4,-0.5 2,-0.6 1,-0.2 -3,-0.2 0.905 60.6 144.2 53.3 45.8 66.7 62.8 71.3 537 135 B W < + 0 0 16 -5,-3.0 -1,-0.2 -6,-0.1 -2,-0.1 -0.797 6.1 125.9-121.2 87.1 63.2 61.5 70.7 538 136 B L - 0 0 74 -2,-0.6 -1,-0.1 -3,-0.1 7,-0.1 -0.548 43.3-167.8-132.5 66.7 62.0 59.2 73.4 539 137 B P - 0 0 15 0, 0.0 -2,-0.1 0, 0.0 -3,-0.0 -0.222 23.0-169.0 -65.3 145.0 58.7 60.9 74.4 540 138 B T + 0 0 117 5,-0.0 2,-0.2 4,-0.0 3,-0.0 0.630 61.7 98.6 -97.3 -21.4 56.7 59.9 77.5 541 139 B E S > S- 0 0 93 1,-0.1 4,-2.3 4,-0.0 5,-0.2 -0.486 71.0-140.6 -75.0 132.6 53.6 61.9 76.5 542 140 B E H > S+ 0 0 86 -2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.857 102.9 58.5 -57.6 -38.1 50.7 60.0 74.9 543 141 B E H > S+ 0 0 128 2,-0.2 4,-1.0 1,-0.2 -1,-0.2 0.939 110.6 39.9 -54.7 -53.9 50.2 62.9 72.5 544 142 B E H 4 S+ 0 0 32 1,-0.2 -2,-0.2 2,-0.2 -1,-0.2 0.854 115.1 52.4 -68.3 -36.8 53.8 62.7 71.1 545 143 B K H >< S+ 0 0 41 -4,-2.3 56,-2.4 1,-0.2 3,-1.0 0.877 108.7 50.6 -65.1 -39.6 53.8 58.9 71.1 546 144 B E H 3< S+ 0 0 49 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.734 109.4 52.0 -69.1 -24.6 50.5 58.9 69.1 547 145 B R T 3< S+ 0 0 59 -4,-1.0 84,-2.6 -5,-0.2 85,-2.0 0.358 96.0 84.7 -94.2 4.1 52.0 61.3 66.6 548 146 B T E < +v 632 0I 0 -3,-1.0 54,-2.8 83,-0.2 85,-0.2 -0.934 58.3 178.3-109.9 124.1 55.1 59.1 66.1 549 147 B G E -v 633 0I 1 83,-2.9 85,-2.4 -2,-0.5 2,-0.4 -0.564 19.9-132.1-114.8-178.3 55.0 56.3 63.5 550 148 B V E +vw 634 604I 1 53,-2.6 55,-3.0 83,-0.2 2,-0.2 -0.996 19.2 173.4-141.4 129.5 57.3 53.6 62.2 551 149 B S E +vw 635 605I 0 83,-3.0 85,-2.1 -2,-0.4 2,-0.5 -0.677 22.5 146.6-136.6 80.1 58.0 52.6 58.6 552 150 B I E -v 636 0I 0 53,-0.9 39,-0.7 83,-0.3 38,-0.3 -0.936 27.0-164.5-121.4 106.7 60.8 50.0 58.5 553 151 B G E -v 637 0I 0 83,-1.8 85,-1.7 -2,-0.5 2,-0.4 -0.518 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58.9-155.2 -51.5 124.0 51.2 54.9 61.4 604 202 B N E +w 550 0I 2 -324,-0.7 2,-0.3 -181,-0.3 -324,-0.2 -0.927 38.9 150.1-103.6 107.2 52.6 51.4 61.7 605 203 B H E -w 551 0I 0 -55,-3.0 -53,-0.9 -2,-0.7 2,-0.3 -0.847 36.9-166.6-143.4 159.4 53.8 50.7 58.2 606 204 B A - 0 0 0 -2,-0.3 -430,-2.5 -55,-0.2 2,-0.5 -0.900 9.7-156.4-153.5 130.3 56.2 48.9 55.8 607 205 B A B -N 175 0D 0 -2,-0.3 2,-0.5 -432,-0.3 -432,-0.3 -0.906 14.5-168.1 -95.1 131.3 56.9 49.4 52.1 608 206 B V + 0 0 0 -434,-2.3 3,-0.1 -2,-0.5 -53,-0.1 -0.937 25.3 148.4-125.1 108.5 58.4 46.2 50.6 609 207 B T > - 0 0 0 -2,-0.5 3,-2.1 1,-0.5 4,-0.1 -0.352 57.6-111.1-137.3 49.9 59.8 46.7 47.1 610 208 B A G > S- 0 0 5 1,-0.3 3,-1.5 -55,-0.2 -1,-0.5 -0.320 96.2 -2.5 55.8-125.5 62.7 44.3 46.9 611 209 B C G 3 S+ 0 0 14 1,-0.3 186,-0.3 2,-0.1 -1,-0.3 0.431 135.4 58.9 -79.5 2.9 66.1 46.1 46.8 612 210 B A G X> S+ 0 0 0 -3,-2.1 4,-2.5 236,-0.1 3,-0.8 0.353 74.9 107.4-102.4 1.5 64.2 49.5 46.9 613 211 B T H <> S+ 0 0 0 -3,-1.5 4,-2.4 1,-0.3 -6,-0.2 0.857 75.8 48.7 -49.9 -51.1 62.5 48.6 50.2 614 212 B G H 3> S+ 0 0 0 180,-0.7 4,-1.4 179,-0.3 -1,-0.3 0.823 114.3 47.9 -61.1 -33.1 64.6 51.0 52.4 615 213 B A H <> S+ 0 0 0 -3,-0.8 4,-2.8 2,-0.2 -2,-0.2 0.938 112.8 44.9 -74.7 -50.5 64.0 53.9 50.0 616 214 B H H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 5,-0.2 0.842 111.0 55.4 -63.1 -35.6 60.2 53.4 49.6 617 215 B S H X S+ 0 0 0 -4,-2.4 4,-1.7 -5,-0.3 -1,-0.2 0.912 113.1 41.4 -63.0 -43.5 59.8 52.9 53.4 618 216 B I H X S+ 0 0 0 -4,-1.4 4,-1.7 -5,-0.2 -2,-0.2 0.901 117.2 48.8 -67.7 -43.4 61.6 56.3 54.0 619 217 B G H X S+ 0 0 0 -4,-2.8 4,-2.0 2,-0.2 -2,-0.2 0.893 110.2 49.8 -65.3 -43.3 59.7 57.9 51.1 620 218 B D H X S+ 0 0 5 -4,-3.1 4,-1.8 1,-0.2 -1,-0.2 0.921 109.5 52.1 -59.9 -46.7 56.3 56.6 52.2 621 219 B A H X S+ 0 0 0 -4,-1.7 4,-2.0 -5,-0.2 -1,-0.2 0.851 106.4 55.0 -58.0 -38.3 56.9 57.9 55.8 622 220 B T H X S+ 0 0 0 -4,-1.7 4,-2.9 1,-0.2 -1,-0.2 0.940 106.4 50.4 -59.0 -49.6 57.8 61.3 54.3 623 221 B R H X S+ 0 0 9 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.846 108.2 54.2 -56.7 -38.1 54.4 61.4 52.5 624 222 B M H X>S+ 0 0 1 -4,-1.8 5,-2.6 2,-0.2 4,-1.8 0.905 111.4 42.9 -65.8 -44.5 52.7 60.6 55.8 625 223 B I H <5S+ 0 0 0 -4,-2.0 -2,-0.2 4,-0.2 -1,-0.2 0.920 113.3 53.9 -65.5 -43.5 54.3 63.5 57.6 626 224 B Q H <5S+ 0 0 43 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.896 113.1 42.4 -55.5 -44.2 53.7 65.8 54.6 627 225 B F H <5S- 0 0 91 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.798 119.8-107.2 -75.4 -31.4 49.9 64.9 54.6 628 226 B G T <5S+ 0 0 25 -4,-1.8 -3,-0.2 2,-0.2 -4,-0.1 0.528 82.0 125.5 112.8 12.6 49.6 65.1 58.4 629 227 B D S S- 0 0 4 -2,-0.9 4,-2.5 1,-0.1 5,-0.3 -0.948 80.5 -82.2-156.8 170.3 71.9 31.7 54.6 644 242 B A H > S+ 0 0 3 -172,-2.5 4,-2.6 -2,-0.3 5,-0.2 0.881 122.8 37.8 -44.4 -59.9 72.0 28.5 52.5 645 243 B L H > S+ 0 0 1 -173,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.825 114.6 53.5 -71.3 -34.8 68.8 29.0 50.4 646 244 B S H > S+ 0 0 2 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.942 114.6 41.4 -63.6 -48.4 69.3 32.8 49.9 647 245 B V H X S+ 0 0 5 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 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-165,-0.2 -0.552 44.0 158.5 -71.5 131.0 79.8 37.5 42.2 658 256 B T > + 0 0 56 -2,-0.3 3,-1.0 18,-0.3 -1,-0.1 0.628 57.5 71.1-124.1 -31.5 81.6 34.2 41.7 659 257 B K T 3 S+ 0 0 126 1,-0.3 3,-0.3 2,-0.1 -2,-0.1 0.655 97.0 52.4 -67.3 -20.9 85.0 35.0 40.1 660 258 B F T > + 0 0 32 1,-0.2 3,-0.6 2,-0.1 6,-0.3 -0.043 64.2 121.9-112.2 31.2 86.5 36.6 43.2 661 259 B N T < S+ 0 0 47 -3,-1.0 -1,-0.2 1,-0.2 -2,-0.1 0.795 78.5 50.9 -63.2 -29.4 85.9 33.9 45.8 662 260 B S T 3 S+ 0 0 122 -3,-0.3 -1,-0.2 1,-0.3 -2,-0.1 0.693 118.5 38.0 -79.8 -21.4 89.7 33.7 46.5 663 261 B S S X S+ 0 0 65 -3,-0.6 3,-1.7 1,-0.1 4,-0.3 -0.697 70.1 173.7-129.9 77.2 89.9 37.5 47.0 664 262 B P G > S+ 0 0 32 0, 0.0 3,-1.8 0, 0.0 4,-0.4 0.838 75.1 59.8 -56.7 -41.8 86.7 38.5 48.9 665 263 B Q G 3 S+ 0 0 101 1,-0.3 -201,-0.1 2,-0.1 3,-0.1 0.594 107.9 49.1 -64.8 -9.8 87.6 42.2 49.5 666 264 B E G < S+ 0 0 85 -3,-1.7 -1,-0.3 -6,-0.3 -5,-0.1 0.454 86.6 90.9-103.4 -5.7 87.8 42.5 45.7 667 265 B A S < S+ 0 0 0 -3,-1.8 2,-0.7 -4,-0.3 9,-0.4 0.793 76.1 61.0 -68.3 -35.6 84.5 40.9 44.9 668 266 B S + 0 0 1 -4,-0.4 87,-0.1 119,-0.3 -1,-0.1 -0.863 59.1 155.2-100.4 113.1 82.2 44.0 44.9 669 267 B R > - 0 0 8 -2,-0.7 3,-1.7 8,-0.2 6,-0.2 -0.606 24.5-160.3-140.4 73.5 83.4 46.4 42.2 670 268 B P T 3 S+ 0 0 0 0, 0.0 114,-0.1 0, 0.0 3,-0.1 -0.301 79.6 6.6 -61.7 137.3 80.6 48.8 41.0 671 269 B F T 3 S+ 0 0 0 1,-0.2 152,-2.3 85,-0.2 2,-0.2 0.299 98.5 129.5 76.3 -7.7 81.3 50.4 37.6 672 270 B D B X -G 822 0M 0 -3,-1.7 3,-1.6 150,-0.2 -1,-0.2 -0.545 66.5-125.9 -81.7 145.4 84.5 48.3 37.1 673 271 B C T 3 S+ 0 0 64 148,-3.1 -1,-0.1 1,-0.3 146,-0.1 0.681 108.3 52.6 -60.7 -21.7 85.1 46.3 33.8 674 272 B D T 3 S+ 0 0 68 147,-0.2 -1,-0.3 -5,-0.1 2,-0.0 0.234 75.9 132.4-103.7 12.6 85.6 43.0 35.7 675 273 B R < + 0 0 18 -3,-1.6 81,-0.1 -6,-0.2 3,-0.1 -0.364 27.4 177.3 -62.3 141.0 82.4 43.1 37.8 676 274 B D - 0 0 24 1,-0.5 -18,-0.3 -9,-0.4 80,-0.2 0.105 55.8 -45.0-138.9 25.7 80.5 39.8 37.8 677 275 B G S S- 0 0 3 78,-2.5 -1,-0.5 -20,-0.1 -21,-0.3 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