==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=24-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 19-FEB-97 1AD1 . COMPND 2 MOLECULE: DIHYDROPTEROATE SYNTHETASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR D.KOSTREWA,C.OEFNER,A.D'ARCY . 515 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21660.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 386 75.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 72 14.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 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 . 38 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 66 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 190 36.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.3 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 2 0 1 3 2 1 0 0 3 1 2 0 1 1 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 6 4 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 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 2 A T 0 0 174 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -16.7 36.5 -8.7 24.5 2 3 A K - 0 0 94 1,-0.1 2,-0.4 3,-0.0 248,-0.1 -0.231 360.0-100.4 -67.4 160.5 33.3 -8.3 26.7 3 4 A T - 0 0 5 246,-0.2 2,-0.3 243,-0.1 233,-0.2 -0.701 45.4-121.0 -79.1 134.0 32.4 -5.0 28.2 4 5 A K E -a 236 0A 65 231,-2.5 233,-2.2 -2,-0.4 2,-0.6 -0.624 16.0-144.5 -85.0 138.6 33.5 -5.2 31.8 5 6 A I E -a 237 0A 2 -2,-0.3 36,-2.9 34,-0.3 37,-1.9 -0.905 13.4-165.6-102.9 113.9 31.0 -4.7 34.6 6 7 A M E -ab 238 42A 3 231,-2.9 233,-2.1 -2,-0.6 37,-0.2 -0.895 8.7-152.7-104.8 111.6 32.4 -2.9 37.6 7 8 A G E -ab 239 43A 0 35,-3.1 37,-2.7 -2,-0.7 2,-0.5 -0.376 15.6-118.3 -79.2 162.4 30.2 -3.1 40.7 8 9 A I E + b 0 44A 25 231,-0.8 2,-0.5 35,-0.2 37,-0.2 -0.896 27.2 177.3-109.1 123.5 30.1 -0.4 43.4 9 10 A L E - b 0 45A 6 35,-2.9 37,-1.7 -2,-0.5 2,-0.5 -0.844 12.0-170.0-124.1 91.3 31.1 -1.2 47.0 10 11 A N E + b 0 46A 77 -2,-0.5 37,-0.2 35,-0.2 35,-0.1 -0.719 11.1 175.6 -82.8 122.0 31.0 2.1 48.9 11 12 A V + 0 0 3 35,-2.8 36,-0.2 -2,-0.5 -1,-0.1 0.146 33.0 127.5-114.8 18.8 32.5 1.7 52.4 12 13 A T > - 0 0 14 34,-0.4 3,-0.9 1,-0.1 4,-0.4 -0.612 64.6-127.6 -74.5 133.9 32.3 5.3 53.6 13 14 A P G > S+ 0 0 50 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.870 104.4 51.4 -47.3 -49.6 30.5 5.4 57.0 14 15 A D G 3 S+ 0 0 105 1,-0.3 5,-0.1 5,-0.0 6,-0.1 0.750 94.4 68.9 -66.0 -27.5 27.9 8.0 56.0 15 16 A S G < S+ 0 0 55 -3,-0.9 2,-0.5 5,-0.0 -1,-0.3 0.609 80.5 106.0 -68.9 -7.9 26.7 6.2 52.9 16 17 A F < - 0 0 31 -3,-1.3 3,-0.4 -4,-0.4 7,-0.1 -0.647 57.9-158.7 -83.8 122.7 25.3 3.5 55.2 17 18 A S S S+ 0 0 104 -2,-0.5 2,-2.5 1,-0.2 -1,-0.1 0.967 79.5 54.6 -56.8 -71.8 21.5 3.5 55.6 18 19 A D S > S- 0 0 103 1,-0.2 3,-2.5 2,-0.0 -1,-0.2 -0.301 128.8 -78.2 -71.5 57.4 20.7 1.6 58.9 19 20 A G T 3 S- 0 0 81 -2,-2.5 -1,-0.2 -3,-0.4 -2,-0.1 0.662 85.3 -64.1 56.8 18.4 22.9 3.8 61.1 20 21 A G T > S+ 0 0 26 -6,-0.1 3,-2.0 2,-0.0 -1,-0.3 0.629 96.0 141.9 80.4 14.8 25.9 1.9 59.9 21 22 A K T < S+ 0 0 152 -3,-2.5 -2,-0.1 1,-0.3 -4,-0.0 0.855 78.2 37.7 -54.8 -39.2 24.6 -1.3 61.5 22 23 A F T 3 S+ 0 0 98 -4,-0.1 2,-1.4 1,-0.1 -1,-0.3 -0.005 82.6 119.5-104.3 27.8 25.9 -3.3 58.5 23 24 A N < + 0 0 59 -3,-2.0 2,-0.3 -5,-0.1 -1,-0.1 -0.678 52.1 95.7 -94.8 82.6 29.1 -1.2 58.0 24 25 A N S > S- 0 0 74 -2,-1.4 4,-1.9 1,-0.1 3,-0.2 -0.944 87.7 -94.0-156.8 171.4 31.6 -4.0 58.5 25 26 A V H > S+ 0 0 44 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.863 117.9 56.1 -61.5 -41.3 33.7 -6.6 56.6 26 27 A E H > S+ 0 0 133 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.858 108.7 46.6 -63.9 -36.5 31.1 -9.4 56.8 27 28 A S H > S+ 0 0 17 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.930 111.0 52.4 -69.2 -44.8 28.3 -7.3 55.2 28 29 A A H X S+ 0 0 3 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.862 108.0 52.8 -57.9 -37.3 30.7 -6.1 52.5 29 30 A V H X S+ 0 0 10 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.886 108.0 49.3 -67.7 -38.5 31.5 -9.8 51.8 30 31 A T H X S+ 0 0 97 -4,-1.5 4,-1.8 2,-0.2 -2,-0.2 0.932 113.3 48.2 -64.9 -44.1 27.8 -10.7 51.4 31 32 A R H X S+ 0 0 92 -4,-2.5 4,-2.4 1,-0.2 -2,-0.2 0.929 111.0 49.1 -61.9 -47.4 27.5 -7.8 49.0 32 33 A V H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.884 108.9 53.1 -61.6 -40.2 30.5 -8.7 47.0 33 34 A K H X S+ 0 0 113 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.889 109.9 49.0 -62.4 -38.5 29.3 -12.3 46.7 34 35 A A H X S+ 0 0 42 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.933 111.0 49.3 -66.0 -45.6 26.0 -11.1 45.4 35 36 A M H <>S+ 0 0 18 -4,-2.4 5,-2.7 2,-0.2 4,-0.3 0.860 110.6 50.5 -62.2 -38.0 27.6 -8.8 42.8 36 37 A M H ><5S+ 0 0 52 -4,-2.3 3,-1.3 3,-0.2 -1,-0.2 0.926 110.3 49.8 -64.5 -44.6 29.9 -11.6 41.6 37 38 A D H 3<5S+ 0 0 148 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.868 108.2 53.8 -61.7 -37.9 26.8 -13.9 41.2 38 39 A E T 3<5S- 0 0 62 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.505 131.4 -91.2 -75.5 -6.1 25.1 -11.1 39.2 39 40 A G T < 5 + 0 0 27 -3,-1.3 -34,-0.3 -4,-0.3 -3,-0.2 0.611 64.4 163.2 109.8 12.9 28.0 -10.9 36.8 40 41 A A < - 0 0 10 -5,-2.7 -1,-0.2 1,-0.2 -34,-0.2 -0.434 19.4-173.6 -68.2 137.7 30.5 -8.3 38.1 41 42 A D S S+ 0 0 44 -36,-2.9 38,-2.6 1,-0.3 2,-0.3 0.683 76.1 26.0 -96.7 -29.2 34.0 -8.5 36.7 42 43 A I E -bc 6 79A 2 -37,-1.9 -35,-3.1 36,-0.2 2,-0.5 -0.971 64.6-149.4-137.8 148.2 35.3 -5.8 39.0 43 44 A I E -bc 7 80A 0 36,-2.2 38,-3.1 -2,-0.3 2,-0.8 -0.991 15.4-150.7-118.5 120.9 34.4 -4.6 42.5 44 45 A D E -bc 8 81A 1 -37,-2.7 -35,-2.9 -2,-0.5 2,-0.5 -0.837 13.0-166.5 -96.4 107.3 35.2 -0.9 43.0 45 46 A V E +bc 9 82A 0 36,-3.3 38,-2.9 -2,-0.8 2,-0.3 -0.811 13.6 170.2 -95.2 128.4 35.9 -0.3 46.8 46 47 A G E +bc 10 83A 4 -37,-1.7 -35,-2.8 -2,-0.5 -34,-0.4 -0.997 27.2 173.4-143.9 138.9 36.0 3.3 47.9 47 48 A G S S+ 0 0 0 36,-0.6 2,-0.3 -2,-0.3 -1,-0.1 0.351 71.3 50.4-121.4 2.7 36.1 5.1 51.3 48 49 A V - 0 0 18 35,-0.4 2,-0.4 -36,-0.1 8,-0.1 -0.952 59.9-153.4-139.4 157.8 36.5 8.8 50.1 49 50 A S - 0 0 32 6,-0.4 5,-0.1 -2,-0.3 -3,-0.0 -0.983 12.0-151.9-132.1 142.3 34.9 11.2 47.6 50 51 A T + 0 0 19 -2,-0.4 3,-0.1 2,-0.1 -1,-0.0 0.222 57.1 126.1 -96.8 13.2 36.4 14.1 45.9 51 52 A R S > S- 0 0 88 1,-0.1 3,-1.4 2,-0.1 -2,-0.1 -0.485 72.4 -97.4 -72.2 140.1 33.1 16.0 45.6 52 53 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.297 107.7 25.2 -59.2 136.8 33.1 19.5 47.1 53 54 A G T 3 S+ 0 0 89 1,-0.3 2,-0.1 -3,-0.1 3,-0.1 0.521 94.5 129.6 87.3 6.5 31.7 19.8 50.7 54 55 A H < - 0 0 84 -3,-1.4 -1,-0.3 1,-0.1 2,-0.1 -0.339 68.4 -75.3 -89.1 171.8 32.6 16.2 51.5 55 56 A E - 0 0 101 -2,-0.1 2,-0.7 -3,-0.1 -6,-0.4 -0.407 38.4-144.7 -66.9 138.0 34.5 14.8 54.5 56 57 A M - 0 0 170 -2,-0.1 2,-0.3 -3,-0.1 -1,-0.1 -0.934 27.5-176.8-107.1 111.2 38.3 15.2 54.4 57 58 A I - 0 0 20 -2,-0.7 2,-0.1 1,-0.1 -9,-0.0 -0.728 23.7-109.8-112.3 161.4 40.0 12.2 55.9 58 59 A T > - 0 0 79 -2,-0.3 4,-2.8 1,-0.1 5,-0.2 -0.294 29.9-112.3 -79.3 167.3 43.5 11.1 56.7 59 60 A V H > S+ 0 0 30 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.903 121.1 52.0 -64.7 -40.7 45.4 8.4 54.9 60 61 A E H > S+ 0 0 135 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.926 111.2 47.5 -61.2 -45.5 45.3 6.3 58.1 61 62 A E H > S+ 0 0 61 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.941 111.8 48.4 -62.4 -47.9 41.6 6.8 58.3 62 63 A E H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.3 0.944 111.8 50.9 -58.7 -45.0 41.0 5.9 54.6 63 64 A L H X S+ 0 0 34 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.884 105.4 56.9 -59.2 -37.8 43.2 2.8 55.1 64 65 A N H < S+ 0 0 88 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.896 112.5 41.7 -58.6 -42.0 41.0 1.9 58.2 65 66 A R H < S+ 0 0 29 -4,-1.9 4,-0.4 -3,-0.3 -2,-0.2 0.908 126.2 29.6 -71.7 -46.9 38.0 1.9 56.0 66 67 A V H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.2 3,-0.5 0.886 105.1 66.2 -85.6 -46.7 39.4 0.2 52.9 67 68 A L H X S+ 0 0 46 -4,-2.0 4,-2.8 -5,-0.3 5,-0.2 0.887 101.8 47.0 -48.7 -52.2 42.1 -2.2 54.0 68 69 A P H > S+ 0 0 57 0, 0.0 4,-1.4 0, 0.0 -1,-0.2 0.871 116.6 45.5 -62.0 -33.5 40.0 -4.7 56.0 69 70 A V H > S+ 0 0 8 -3,-0.5 4,-1.4 -4,-0.4 -2,-0.2 0.908 113.0 49.3 -73.9 -44.2 37.4 -4.9 53.2 70 71 A V H >X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 3,-0.6 0.956 110.3 51.4 -59.2 -50.6 40.0 -5.3 50.5 71 72 A E H 3< S+ 0 0 129 -4,-2.8 4,-0.4 -5,-0.2 -1,-0.2 0.873 109.3 50.8 -54.2 -41.5 41.8 -8.0 52.4 72 73 A A H 3< S+ 0 0 38 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.759 122.1 29.2 -69.1 -29.4 38.5 -10.0 52.9 73 74 A I H X< S+ 0 0 0 -4,-1.4 3,-1.9 -3,-0.6 5,-0.2 0.601 93.5 87.5-109.3 -14.7 37.5 -9.9 49.2 74 75 A V T 3< S+ 0 0 41 -4,-2.6 4,-0.2 1,-0.3 -3,-0.1 0.716 86.9 59.2 -60.0 -20.9 40.8 -9.8 47.3 75 76 A G T 3 S+ 0 0 71 -4,-0.4 -1,-0.3 -5,-0.2 -2,-0.1 0.669 86.3 100.6 -81.5 -17.2 40.9 -13.6 47.4 76 77 A F S < S- 0 0 57 -3,-1.9 2,-2.2 1,-0.1 -3,-0.0 -0.235 90.6-103.9 -66.5 155.9 37.6 -13.9 45.5 77 78 A D S S+ 0 0 169 2,-0.0 2,-0.3 0, 0.0 -1,-0.1 -0.441 93.2 87.8 -83.4 67.1 37.6 -14.7 41.8 78 79 A V S S- 0 0 18 -2,-2.2 2,-0.2 -5,-0.2 -36,-0.2 -0.959 83.4-103.1-155.6 150.6 36.8 -11.1 40.8 79 80 A K E -c 42 0A 57 -38,-2.6 -36,-2.2 -2,-0.3 2,-0.5 -0.574 32.9-139.3 -82.7 149.3 39.0 -8.1 40.1 80 81 A I E -c 43 0A 0 -38,-0.2 20,-2.5 17,-0.2 19,-2.0 -0.929 18.8-177.5-115.7 127.1 39.4 -5.5 42.8 81 82 A S E -cd 44 100A 0 -38,-3.1 -36,-3.3 -2,-0.5 2,-0.4 -0.897 11.3-153.1-116.5 147.5 39.5 -1.8 42.1 82 83 A V E -cd 45 101A 0 18,-2.0 20,-2.8 -2,-0.3 2,-1.2 -0.988 12.5-138.8-125.3 125.0 40.0 0.9 44.8 83 84 A D E +cd 46 102A 9 -38,-2.9 -36,-0.6 -2,-0.4 -35,-0.4 -0.698 53.9 130.4 -78.7 97.9 38.8 4.5 44.5 84 85 A T - 0 0 0 -2,-1.2 21,-0.1 18,-1.0 -2,-0.1 -0.992 44.7-166.8-151.0 147.4 41.7 6.5 45.9 85 86 A F S S+ 0 0 18 -2,-0.3 2,-0.5 18,-0.2 25,-0.3 0.217 70.2 87.4-115.5 9.4 43.7 9.5 44.8 86 87 A R >> - 0 0 28 1,-0.1 4,-2.3 23,-0.1 3,-0.9 -0.956 67.2-147.5-116.4 121.9 46.5 9.0 47.3 87 88 A S H 3> S+ 0 0 2 -2,-0.5 4,-3.4 1,-0.3 5,-0.2 0.765 97.0 59.5 -56.2 -32.0 49.5 6.8 46.5 88 89 A E H 3> S+ 0 0 100 2,-0.2 4,-1.5 1,-0.2 -1,-0.3 0.859 109.4 43.4 -67.5 -36.1 50.0 5.7 50.1 89 90 A V H <> S+ 0 0 0 -3,-0.9 4,-2.0 2,-0.2 -2,-0.2 0.917 115.0 51.3 -72.1 -43.5 46.5 4.3 50.2 90 91 A A H X S+ 0 0 0 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.931 108.8 49.9 -57.0 -50.7 47.1 2.8 46.7 91 92 A E H X S+ 0 0 37 -4,-3.4 4,-2.4 1,-0.2 -1,-0.2 0.901 108.4 51.2 -58.6 -45.5 50.3 1.0 47.7 92 93 A A H X S+ 0 0 25 -4,-1.5 4,-1.0 1,-0.2 -1,-0.2 0.935 114.6 44.6 -58.1 -45.3 49.0 -0.6 50.8 93 94 A C H <>S+ 0 0 0 -4,-2.0 5,-1.7 1,-0.2 3,-0.3 0.883 110.8 53.4 -66.9 -39.2 46.0 -2.0 48.8 94 95 A L H ><5S+ 0 0 9 -4,-2.7 3,-1.7 1,-0.2 -1,-0.2 0.877 104.5 55.6 -64.3 -37.0 48.3 -3.1 45.9 95 96 A K H 3<5S+ 0 0 146 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.808 104.9 54.1 -63.3 -29.6 50.5 -5.0 48.4 96 97 A L T 3<5S- 0 0 52 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.442 129.3-100.8 -81.9 -2.2 47.2 -6.8 49.4 97 98 A G T < 5 + 0 0 39 -3,-1.7 -3,-0.2 1,-0.2 -17,-0.2 0.696 61.2 162.0 94.8 19.8 46.7 -7.7 45.8 98 99 A V < - 0 0 9 -5,-1.7 -1,-0.2 -8,-0.2 -17,-0.2 -0.367 28.5-149.8 -69.8 157.8 44.2 -5.3 44.3 99 100 A D + 0 0 59 -19,-2.0 24,-2.1 1,-0.2 2,-0.3 0.810 68.5 33.5 -96.7 -34.5 44.1 -5.0 40.5 100 101 A I E -de 81 123A 2 -20,-2.5 -18,-2.0 22,-0.2 2,-0.6 -0.954 54.7-152.7-131.8 144.0 43.0 -1.5 39.8 101 102 A I E -de 82 124A 0 22,-2.0 24,-2.5 -2,-0.3 2,-1.0 -0.973 13.4-158.0-114.7 116.0 43.5 2.0 41.3 102 103 A N E -de 83 125A 3 -20,-2.8 -18,-1.0 -2,-0.6 2,-0.9 -0.812 12.9-165.9 -96.9 95.5 40.5 4.3 40.4 103 104 A D E > - e 0 126A 0 22,-1.9 3,-2.2 -2,-1.0 24,-1.8 -0.739 14.8-165.0 -91.0 101.2 42.1 7.7 40.8 104 105 A Q T 3 S+ 0 0 18 -2,-0.9 -1,-0.1 1,-0.3 -19,-0.1 0.557 93.3 47.6 -60.3 -8.8 39.4 10.5 40.9 105 106 A W T > S- 0 0 64 -21,-0.1 3,-1.9 5,-0.1 -1,-0.3 0.392 105.0-126.5-111.7 0.6 42.1 13.0 40.3 106 107 A A T < S- 0 0 1 -3,-2.2 20,-0.1 19,-0.3 -2,-0.1 0.861 74.1 -54.8 56.5 38.5 43.9 11.3 37.5 107 108 A G T 3 S+ 0 0 1 1,-0.1 -1,-0.3 6,-0.0 6,-0.2 0.489 115.3 116.4 74.7 4.2 47.2 11.5 39.4 108 109 A L S < S+ 0 0 94 -3,-1.9 3,-0.2 1,-0.2 -2,-0.1 0.768 75.0 48.2 -75.2 -25.9 46.8 15.3 39.8 109 110 A Y S S+ 0 0 123 1,-0.3 2,-0.4 -24,-0.1 -1,-0.2 0.918 131.1 12.8 -78.5 -45.6 46.5 15.1 43.5 110 111 A D > - 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0 0 2 -5,-2.7 -1,-0.2 1,-0.1 -38,-0.2 -0.395 32.7-147.7 -66.4 154.6 14.0 1.2 14.0 487 236 B R + 0 0 123 -40,-2.5 -218,-2.6 1,-0.2 2,-0.3 0.562 67.9 17.0-105.0 -8.0 10.9 3.2 14.9 488 237 B A E -ip 269 448B 1 -41,-1.4 -39,-2.5 -220,-0.2 2,-0.4 -0.985 58.9-146.6-158.4 155.9 9.1 0.9 17.3 489 238 B V E -ip 270 449B 3 -220,-2.1 -218,-3.3 -2,-0.3 2,-0.7 -0.993 11.2-144.8-129.5 135.3 9.7 -2.2 19.4 490 239 B R E +i 271 0B 41 -41,-2.4 -38,-0.7 -2,-0.4 -39,-0.3 -0.907 38.2 166.3-101.5 114.7 7.2 -4.9 20.1 491 240 B V E -i 272 0B 2 -220,-2.7 -218,-2.1 -2,-0.7 3,-0.2 -0.898 48.1-150.8-136.0 158.6 7.8 -6.1 23.7 492 241 B H S S+ 0 0 54 -2,-0.3 2,-1.4 1,-0.2 3,-0.2 0.880 97.1 58.1 -87.5 -48.6 6.4 -8.1 26.6 493 242 B N > + 0 0 44 1,-0.2 4,-1.7 2,-0.1 5,-0.2 -0.667 67.3 174.3 -86.0 89.8 8.2 -6.1 29.3 494 243 B V H > S+ 0 0 0 -2,-1.4 4,-3.0 1,-0.2 5,-0.2 0.947 71.8 51.1 -63.1 -50.8 6.7 -2.7 28.5 495 244 B E H > S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 5,-0.3 0.917 110.5 47.0 -55.4 -50.7 8.2 -0.8 31.5 496 245 B L H > S+ 0 0 14 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.949 118.9 40.2 -57.7 -51.7 11.8 -2.0 31.0 497 246 B N H X S+ 0 0 0 -4,-1.7 4,-2.8 1,-0.2 5,-0.3 0.834 112.7 55.5 -69.1 -33.0 11.8 -1.2 27.3 498 247 B A H X S+ 0 0 14 -4,-3.0 4,-2.1 -5,-0.2 -1,-0.2 0.926 113.1 40.9 -65.6 -44.8 9.9 2.0 27.6 499 248 B K H X S+ 0 0 42 -4,-2.3 4,-1.7 -5,-0.2 -2,-0.2 0.887 118.8 45.9 -70.5 -40.1 12.4 3.5 30.1 500 249 B L H X S+ 0 0 1 -4,-2.1 4,-2.4 -5,-0.3 -2,-0.2 0.928 113.7 48.4 -69.1 -45.3 15.4 2.2 28.2 501 250 B A H X S+ 0 0 1 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.920 109.7 53.5 -60.2 -44.0 14.1 3.3 24.8 502 251 B K H X S+ 0 0 89 -4,-2.1 4,-2.1 -5,-0.3 -1,-0.2 0.889 110.2 48.3 -57.5 -40.8 13.3 6.7 26.4 503 252 B G H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.898 111.8 47.0 -67.5 -42.9 16.9 6.9 27.5 504 253 B I H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.921 110.9 53.2 -65.5 -43.0 18.4 5.9 24.2 505 254 B D H X S+ 0 0 28 -4,-2.9 4,-2.7 1,-0.2 5,-0.2 0.939 109.8 48.9 -55.4 -48.6 16.1 8.4 22.4 506 255 B F H X S+ 0 0 77 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.874 111.4 49.2 -59.4 -40.9 17.4 11.2 24.7 507 256 B L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.882 112.2 47.0 -70.3 -37.5 21.0 10.2 24.1 508 257 B K H X S+ 0 0 59 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.927 115.0 46.1 -69.3 -44.6 20.6 10.2 20.3 509 258 B E H X S+ 0 0 112 -4,-2.7 4,-3.1 -5,-0.2 -2,-0.2 0.874 113.0 50.0 -64.9 -37.2 18.8 13.5 20.3 510 259 B N H X S+ 0 0 12 -4,-2.1 4,-2.7 -5,-0.2 5,-0.2 0.922 109.1 52.2 -66.0 -42.9 21.4 15.0 22.7 511 260 B E H X S+ 0 0 29 -4,-2.2 4,-0.8 1,-0.2 -2,-0.2 0.912 112.2 46.4 -60.0 -41.3 24.2 13.7 20.4 512 261 B N H >X>S+ 0 0 43 -4,-2.2 5,-2.1 2,-0.2 4,-1.2 0.948 110.6 52.7 -64.7 -49.3 22.4 15.4 17.5 513 262 B A H ><5S+ 0 0 39 -4,-3.1 3,-1.0 1,-0.2 -2,-0.2 0.936 110.1 46.2 -51.8 -55.1 21.9 18.6 19.4 514 263 B R H 3<5S+ 0 0 86 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.644 120.0 41.0 -66.3 -15.8 25.6 19.0 20.4 515 264 B H H <<5S- 0 0 44 -3,-0.8 -1,-0.2 -4,-0.8 -2,-0.2 0.458 106.3-122.7-108.1 -4.6 26.8 18.2 16.9 516 265 B N T <<5 + 0 0 152 -4,-1.2 2,-0.4 -3,-1.0 -3,-0.2 0.908 54.1 163.0 60.7 42.5 24.1 20.2 15.0 517 266 B F < 0 0 105 -5,-2.1 -1,-0.2 1,-0.2 -2,-0.1 -0.761 360.0 360.0 -93.4 141.7 23.0 17.1 13.2 518 267 B S 0 0 177 -2,-0.4 -1,-0.2 -5,-0.0 -5,-0.1 0.685 360.0 360.0 53.4 360.0 19.6 17.1 11.4