==== 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/TRANSFERASE INHIBITOR 14-APR-09 3H22 . COMPND 2 MOLECULE: DIHYDROPTEROATE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS ANTHRACIS STR. A2012; . AUTHOR M.-K.YUN,S.W.WHITE . 535 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 24321.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 70.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 64 12.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 44 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 47 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 190 35.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 2.4 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 0 0 0 2 1 5 0 0 0 2 0 2 0 2 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 3 4 7 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 . 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 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 K 0 0 169 0, 0.0 2,-0.5 0, 0.0 15,-0.1 0.000 360.0 360.0 360.0 -52.0 -90.1 70.6 76.5 2 3 A W - 0 0 32 1,-0.1 14,-0.1 2,-0.0 13,-0.0 -0.918 360.0-163.3 -94.6 134.8 -86.8 69.7 78.1 3 4 A D S S+ 0 0 151 -2,-0.5 2,-0.3 2,-0.0 -1,-0.1 0.319 70.6 43.8-102.4 6.5 -85.6 66.5 76.5 4 5 A Y S S- 0 0 33 164,-0.0 11,-0.5 3,-0.0 2,-0.3 -0.915 78.6-116.8-140.5 166.9 -83.1 65.9 79.3 5 6 A D - 0 0 73 -2,-0.3 2,-1.1 9,-0.1 9,-0.2 -0.724 33.9-106.0-101.6 152.0 -82.8 66.0 83.2 6 7 A L E -A 13 0A 1 7,-3.3 7,-2.8 -2,-0.3 2,-0.4 -0.708 40.8-148.5 -82.5 102.6 -80.6 68.3 85.3 7 8 A R E +A 12 0A 117 -2,-1.1 5,-0.2 5,-0.2 2,-0.2 -0.615 24.9 172.2 -77.8 123.9 -78.0 65.8 86.4 8 9 A C E > -A 11 0A 3 3,-2.0 3,-2.6 -2,-0.4 2,-0.3 -0.594 50.3-101.8-132.8 68.6 -76.5 66.5 89.9 9 10 A G T 3 S+ 0 0 59 1,-0.3 -1,-0.2 -2,-0.2 97,-0.0 -0.317 111.8 9.9 50.0-107.8 -74.3 63.5 90.9 10 11 A E T 3 S+ 0 0 115 -2,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.769 130.4 54.7 -67.4 -30.4 -76.6 61.7 93.4 11 12 A Y E < -A 8 0A 34 -3,-2.6 -3,-2.0 74,-0.0 2,-0.5 -0.861 63.9-157.9-112.1 138.4 -79.8 63.8 92.6 12 13 A T E -A 7 0A 66 -2,-0.4 2,-0.6 -5,-0.2 -5,-0.2 -0.971 7.1-151.0-113.3 133.8 -81.6 64.4 89.3 13 14 A L E -A 6 0A 17 -7,-2.8 -7,-3.3 -2,-0.5 2,-0.4 -0.879 8.8-147.3 -98.3 116.3 -83.9 67.4 88.7 14 15 A N - 0 0 51 -2,-0.6 4,-0.4 -9,-0.2 -9,-0.1 -0.706 7.4-159.4 -73.6 130.8 -86.7 66.8 86.1 15 16 A L S S+ 0 0 2 -11,-0.5 -1,-0.1 -2,-0.4 5,-0.1 0.370 79.5 53.8 -96.5 3.7 -87.3 70.2 84.5 16 17 A N S S+ 0 0 58 -14,-0.1 -1,-0.1 -15,-0.1 3,-0.1 0.771 94.1 60.5-107.0 -33.1 -90.7 69.4 83.1 17 18 A E S S- 0 0 107 1,-0.2 2,-0.3 2,-0.0 -2,-0.1 0.836 112.7 -9.5 -75.0 -35.0 -92.8 68.3 86.0 18 19 A K S S- 0 0 75 -4,-0.4 2,-0.4 245,-0.1 -1,-0.2 -0.991 73.1 -87.6-157.8 155.9 -92.7 71.3 88.3 19 20 A T - 0 0 3 -2,-0.3 2,-0.4 235,-0.2 222,-0.2 -0.653 51.3-130.4 -65.1 127.3 -91.1 74.7 89.0 20 21 A L E -b 241 0B 3 220,-2.5 222,-2.3 -2,-0.4 2,-0.5 -0.695 14.7-141.8 -90.5 131.4 -88.0 73.9 91.1 21 22 A I E -b 242 0B 3 -2,-0.4 35,-3.1 33,-0.3 36,-1.7 -0.822 8.2-159.6 -97.6 122.6 -87.6 75.9 94.3 22 23 A M E -bc 243 57B 0 220,-2.9 222,-2.5 -2,-0.5 2,-0.4 -0.927 14.1-145.2-103.7 120.9 -84.1 77.0 95.3 23 24 A G E -bc 244 58B 0 34,-3.1 36,-2.9 -2,-0.6 2,-0.8 -0.653 10.2-132.5 -85.5 132.0 -83.9 77.8 99.0 24 25 A I E - c 0 59B 16 220,-1.8 2,-0.4 -2,-0.4 36,-0.1 -0.775 23.9-134.4 -89.7 109.4 -81.6 80.7 100.0 25 26 A L E - c 0 60B 9 34,-2.5 36,-0.5 -2,-0.8 2,-0.5 -0.541 12.0-128.3 -72.6 129.6 -79.6 79.5 103.0 26 27 A N - 0 0 92 -2,-0.4 20,-0.1 16,-0.1 21,-0.1 -0.597 26.4-175.5 -74.5 114.5 -79.3 81.9 105.8 27 28 A V + 0 0 32 -2,-0.5 -1,-0.1 15,-0.0 16,-0.1 -0.033 8.7 170.9-117.2 33.6 -75.6 82.3 106.6 28 29 A T - 0 0 103 1,-0.1 15,-0.1 14,-0.0 14,-0.1 -0.192 30.7-140.9 -43.8 111.7 -75.3 84.5 109.7 29 30 A P - 0 0 78 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.306 5.4-116.3 -80.6 163.3 -71.5 84.2 110.6 30 31 A D - 0 0 51 2,-0.1 2,-1.9 6,-0.0 6,-0.1 -0.752 21.0-121.8 -88.5 143.6 -69.9 84.0 114.0 31 32 A S 0 0 136 -2,-0.3 -1,-0.0 0, 0.0 0, 0.0 -0.586 360.0 360.0 -79.8 72.7 -67.5 86.6 115.2 32 33 A F 0 0 107 -2,-1.9 -2,-0.1 4,-0.0 4,-0.0 -0.937 360.0 360.0 170.7 360.0 -64.8 83.9 115.6 33 ! 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 34 36 A G 0 0 49 0, 0.0 37,-0.2 0, 0.0 38,-0.1 0.000 360.0 360.0 360.0 172.9 -65.7 79.4 110.0 35 37 A G + 0 0 16 36,-0.3 278,-1.8 1,-0.2 279,-0.1 -0.023 360.0 140.3 90.0 -31.0 -66.5 75.9 111.3 36 38 A S B > -J 312 0C 22 276,-0.2 4,-1.5 277,-0.1 3,-0.3 0.030 60.9-110.7 -62.1 162.6 -67.7 76.9 114.8 37 39 A Y H > S+ 0 0 9 274,-2.3 4,-2.0 1,-0.2 5,-0.2 0.829 107.2 50.2 -67.4 -48.1 -70.7 75.1 116.4 38 40 A N H > S+ 0 0 105 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.844 112.1 46.5 -59.4 -37.5 -73.5 77.8 116.4 39 41 A E H > S+ 0 0 8 -3,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.882 116.4 41.7 -81.7 -34.3 -73.1 78.9 112.7 40 42 A V H X S+ 0 0 1 -4,-1.5 4,-2.8 2,-0.2 -2,-0.2 0.925 116.1 50.3 -72.9 -44.5 -73.0 75.4 111.2 41 43 A D H X S+ 0 0 15 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.877 112.6 47.0 -58.4 -37.3 -75.8 74.2 113.5 42 44 A A H X S+ 0 0 40 -4,-1.6 4,-1.4 1,-0.2 -1,-0.2 0.928 111.7 50.6 -78.8 -38.4 -78.0 77.2 112.6 43 45 A A H X S+ 0 0 1 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.892 113.0 47.1 -58.4 -44.7 -77.3 76.7 108.9 44 46 A V H X S+ 0 0 2 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.954 109.7 50.9 -63.5 -51.9 -78.3 73.0 109.2 45 47 A R H X S+ 0 0 137 -4,-2.9 4,-1.8 1,-0.2 -1,-0.2 0.838 115.2 46.5 -54.8 -27.8 -81.5 73.6 111.2 46 48 A H H X S+ 0 0 32 -4,-1.4 4,-2.3 -5,-0.2 -1,-0.2 0.863 107.7 51.3 -91.2 -34.2 -82.4 76.0 108.4 47 49 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.865 113.1 50.8 -58.4 -35.3 -81.5 73.9 105.5 48 50 A K H X S+ 0 0 77 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.894 106.7 52.0 -73.6 -44.0 -83.8 71.3 107.2 49 51 A E H X S+ 0 0 101 -4,-1.8 4,-1.4 -5,-0.2 -2,-0.2 0.977 112.9 45.6 -53.8 -51.1 -86.6 73.7 107.6 50 52 A M H X>S+ 0 0 0 -4,-2.3 5,-2.1 2,-0.2 4,-0.6 0.889 109.4 53.7 -65.5 -40.9 -86.4 74.6 103.9 51 53 A R H ><5S+ 0 0 86 -4,-2.4 3,-1.4 1,-0.2 -1,-0.2 0.980 110.9 49.1 -51.9 -53.6 -86.2 70.9 102.9 52 54 A D H 3<5S+ 0 0 114 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.687 108.7 52.0 -60.8 -22.4 -89.4 70.3 104.9 53 55 A E H 3<5S- 0 0 57 -4,-1.4 -1,-0.2 -3,-0.4 198,-0.2 0.409 130.0 -79.9-102.8 10.6 -91.3 73.2 103.4 54 56 A G T <<5S+ 0 0 28 -3,-1.4 -33,-0.3 -4,-0.6 2,-0.2 0.539 73.2 149.5 120.3 17.0 -90.7 72.3 99.7 55 57 A A < - 0 0 6 -5,-2.1 -1,-0.3 -4,-0.1 -33,-0.2 -0.533 23.9-171.8 -81.3 144.2 -87.2 73.4 98.6 56 58 A H S S+ 0 0 39 -35,-3.1 2,-0.3 1,-0.3 -34,-0.2 0.612 73.9 29.3-107.8 -20.7 -85.4 71.3 95.9 57 59 A I E -c 22 0B 1 -36,-1.7 -34,-3.1 28,-0.2 2,-0.5 -0.981 69.2-143.0-134.5 144.4 -82.0 73.0 96.0 58 60 A I E -cd 23 87B 0 28,-2.5 30,-2.4 -2,-0.3 2,-0.5 -0.977 16.0-150.3-105.4 127.3 -80.2 74.7 98.9 59 61 A D E -cd 24 88B 1 -36,-2.9 -34,-2.5 -2,-0.5 2,-0.6 -0.862 9.8-163.6-100.5 118.1 -78.2 77.8 97.8 60 62 A I E -cd 25 89B 0 28,-2.2 30,-2.3 -2,-0.5 2,-0.3 -0.898 7.8-153.8-114.0 113.5 -75.1 78.4 100.1 61 63 A G E d 0 90B 17 -2,-0.6 30,-0.1 -36,-0.5 28,-0.0 -0.686 360.0 360.0 -99.8 133.7 -73.5 81.9 99.9 62 64 A G 0 0 52 28,-1.5 -1,-0.1 -2,-0.3 29,-0.1 0.773 360.0 360.0 -72.8 360.0 -69.9 83.0 100.5 63 ! 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 64 75 A S >> 0 0 99 0, 0.0 4,-2.3 0, 0.0 3,-0.7 0.000 360.0 360.0 360.0 106.4 -61.1 87.5 101.1 65 76 A V H 3> + 0 0 57 1,-0.3 4,-1.2 2,-0.2 28,-0.0 0.784 360.0 39.9 -62.8 -49.0 -60.6 84.3 99.3 66 77 A E H 3> S+ 0 0 132 1,-0.2 4,-1.5 2,-0.2 -1,-0.3 0.723 116.9 54.7 -72.2 -22.0 -59.2 81.7 101.9 67 78 A E H <> S+ 0 0 122 -3,-0.7 4,-1.9 2,-0.2 -2,-0.2 0.885 102.4 54.3 -72.7 -45.1 -61.6 83.2 104.4 68 79 A E H X S+ 0 0 25 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.836 110.1 49.5 -56.0 -34.4 -64.6 82.6 102.1 69 80 A I H X S+ 0 0 15 -4,-1.2 4,-3.1 2,-0.2 -1,-0.2 0.920 107.6 50.7 -77.0 -45.5 -63.6 78.9 101.9 70 81 A K H < S+ 0 0 132 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.819 115.5 46.2 -57.3 -34.9 -63.1 78.4 105.7 71 82 A R H < S+ 0 0 43 -4,-1.9 4,-0.4 -37,-0.2 -36,-0.3 0.896 122.8 31.8 -72.3 -41.3 -66.6 80.0 106.1 72 83 A V H X S+ 0 0 1 -4,-1.8 4,-1.8 -5,-0.2 3,-0.3 0.817 104.6 66.4 -98.5 -31.7 -68.4 78.0 103.4 73 84 A V H X S+ 0 0 27 -4,-3.1 4,-2.4 1,-0.2 -3,-0.1 0.912 101.1 51.1 -57.6 -47.5 -66.7 74.6 103.2 74 85 A P H > S+ 0 0 27 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.811 109.4 51.1 -59.0 -33.1 -67.9 73.4 106.7 75 86 A M H > S+ 0 0 2 -4,-0.4 4,-2.1 -3,-0.3 5,-0.2 0.881 109.0 49.6 -74.6 -34.4 -71.5 74.4 105.9 76 87 A I H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 5,-0.3 0.894 112.8 48.4 -67.3 -43.0 -71.5 72.4 102.7 77 88 A Q H X S+ 0 0 96 -4,-2.4 4,-1.1 2,-0.2 -2,-0.2 0.953 116.3 41.2 -57.6 -54.0 -70.0 69.3 104.5 78 89 A A H X S+ 0 0 4 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.852 120.5 44.0 -66.1 -34.6 -72.6 69.5 107.4 79 90 A V H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.926 111.1 49.8 -78.9 -44.7 -75.5 70.3 105.1 80 91 A S H < S+ 0 0 24 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.777 116.6 47.8 -62.1 -24.9 -74.8 67.8 102.3 81 92 A K H < S+ 0 0 104 -4,-1.1 -1,-0.2 -5,-0.3 -2,-0.2 0.917 120.7 31.9 -76.8 -49.5 -74.5 65.2 105.1 82 93 A E H < S+ 0 0 49 -4,-1.8 2,-0.4 1,-0.1 -2,-0.2 0.598 118.1 51.0 -96.7 -15.2 -77.6 66.0 107.0 83 94 A V S < S- 0 0 1 -4,-2.7 2,-1.7 2,-0.1 -1,-0.1 -0.991 70.5-144.4-128.2 123.1 -80.0 67.2 104.2 84 95 A K + 0 0 131 -2,-0.4 -4,-0.1 -3,-0.1 -3,-0.1 -0.441 63.3 103.2 -91.4 66.9 -80.6 65.1 101.1 85 96 A L S S- 0 0 25 -2,-1.7 2,-0.2 -6,-0.2 -28,-0.2 -0.904 78.9 -92.9-136.0 153.2 -81.0 67.9 98.5 86 97 A P - 0 0 3 0, 0.0 -28,-2.5 0, 0.0 2,-0.5 -0.517 38.9-142.9 -68.4 148.8 -78.6 69.3 95.9 87 98 A I E -d 58 0B 1 17,-0.3 19,-2.9 -30,-0.2 20,-1.5 -0.948 8.7-159.8-115.9 128.9 -76.5 72.2 97.0 88 99 A S E -de 59 107B 0 -30,-2.4 -28,-2.2 -2,-0.5 2,-0.5 -0.780 14.8-137.9 -98.5 152.1 -75.6 75.1 94.8 89 100 A I E -de 60 108B 0 18,-2.5 20,-3.2 -2,-0.3 2,-1.1 -0.968 6.0-144.9-116.2 129.3 -72.6 77.3 95.7 90 101 A D E +de 61 109B 35 -30,-2.3 -28,-1.5 -2,-0.5 2,-0.3 -0.750 52.9 114.4 -97.7 85.2 -73.0 81.0 95.4 91 102 A T - 0 0 2 -2,-1.1 21,-0.2 18,-0.9 18,-0.1 -0.978 49.7-161.4-145.5 157.0 -69.5 82.3 94.3 92 103 A Y S S+ 0 0 75 -2,-0.3 2,-0.4 18,-0.2 25,-0.3 0.380 70.7 99.9-111.8 -3.7 -67.8 83.9 91.3 93 104 A K > - 0 0 34 1,-0.1 4,-2.2 23,-0.1 5,-0.1 -0.672 65.9-148.8 -86.3 128.2 -64.3 82.9 92.5 94 105 A A H > S+ 0 0 12 -2,-0.4 4,-2.8 1,-0.2 -1,-0.1 0.915 97.5 49.9 -66.4 -42.4 -62.9 79.8 90.7 95 106 A E H > S+ 0 0 88 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.862 110.4 50.0 -62.2 -39.5 -60.9 78.6 93.8 96 107 A V H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.910 112.2 48.6 -66.7 -39.1 -64.0 79.0 96.0 97 108 A A H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 5,-0.3 0.932 108.1 53.5 -66.2 -44.4 -66.0 77.0 93.5 98 109 A K H X S+ 0 0 78 -4,-2.8 4,-1.4 1,-0.2 3,-0.3 0.956 112.0 45.6 -52.7 -55.0 -63.4 74.2 93.3 99 110 A Q H X S+ 0 0 59 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.837 108.4 56.4 -56.0 -43.3 -63.4 73.8 97.1 100 111 A A H <>S+ 0 0 0 -4,-2.0 5,-2.7 2,-0.2 4,-0.4 0.878 109.0 43.8 -60.2 -44.2 -67.2 73.8 97.4 101 112 A I H <5S+ 0 0 25 -4,-1.8 -1,-0.2 -3,-0.3 -2,-0.2 0.773 113.0 53.2 -72.0 -29.1 -67.8 70.9 95.0 102 113 A E H <5S+ 0 0 116 -4,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.757 108.4 51.0 -70.1 -31.4 -64.9 69.0 96.6 103 114 A A T <5S- 0 0 14 -4,-1.4 -2,-0.2 -5,-0.2 -1,-0.2 0.548 138.4 -82.6 -84.9 -9.4 -66.7 69.6 99.9 104 115 A G T 5S+ 0 0 24 -4,-0.4 -17,-0.3 1,-0.3 -3,-0.3 0.495 78.3 144.0 121.0 7.9 -70.0 68.2 98.5 105 116 A A < - 0 0 4 -5,-2.7 -1,-0.3 -8,-0.1 -17,-0.2 -0.588 29.4-164.2 -82.0 145.3 -71.7 71.1 96.4 106 117 A H + 0 0 15 -19,-2.9 2,-0.3 -2,-0.2 -18,-0.2 0.644 63.8 34.6-103.3 -21.2 -73.6 70.2 93.2 107 118 A I E -e 88 0B 2 -20,-1.5 -18,-2.5 22,-0.2 2,-0.5 -0.982 66.7-133.3-142.3 142.9 -74.2 73.4 91.2 108 119 A I E -ef 89 131B 0 22,-2.5 24,-3.1 -2,-0.3 2,-0.6 -0.885 14.0-163.4-100.5 135.0 -72.2 76.5 90.7 109 120 A N E -ef 90 132B 3 -20,-3.2 -18,-0.9 -2,-0.5 2,-0.7 -0.898 12.7-174.9-117.2 98.6 -74.2 79.7 91.1 110 121 A D E > - f 0 133B 0 22,-2.1 24,-2.0 -2,-0.6 3,-1.3 -0.827 18.3-171.0-107.4 111.9 -72.2 82.5 89.4 111 122 A I T 3 S+ 0 0 38 -2,-0.7 -1,-0.1 1,-0.3 -19,-0.1 0.564 90.9 49.9 -78.6 -7.6 -73.4 86.1 89.7 112 123 A W T > S- 0 0 68 -21,-0.2 3,-1.8 5,-0.1 4,-0.3 0.350 105.0-128.7-110.2 6.9 -70.8 87.3 87.3 113 124 A G T < - 0 0 0 -3,-1.3 46,-0.1 1,-0.3 47,-0.1 0.864 67.7 -53.2 52.8 48.1 -71.5 84.7 84.7 114 125 A A T 3 S+ 0 0 0 3,-0.1 -1,-0.3 1,-0.1 7,-0.2 0.509 123.4 99.5 70.4 7.6 -68.0 83.5 84.2 115 126 A K S < S+ 0 0 70 -3,-1.8 -2,-0.2 2,-0.1 -1,-0.1 0.855 73.0 56.4 -91.3 -40.2 -66.8 87.0 83.5 116 127 A A S S+ 0 0 41 -4,-0.3 -1,-0.1 1,-0.3 -23,-0.1 0.952 134.3 1.1 -49.9 -58.5 -65.4 87.8 87.0 117 128 A E > - 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0 0 63 -5,-0.5 -1,-0.2 -6,-0.2 -2,-0.1 -0.960 58.6-113.2-133.1 141.1 -59.7 41.7 129.2 497 230 B P > - 0 0 65 0, 0.0 3,-2.7 0, 0.0 -11,-0.0 -0.246 43.9 -87.9 -76.0 170.8 -59.1 45.1 127.3 498 231 B V G > S+ 0 0 73 1,-0.3 3,-1.1 2,-0.2 -12,-0.0 0.790 126.0 51.4 -46.2 -44.9 -61.1 48.3 127.8 499 232 B E G 3 S+ 0 0 141 1,-0.2 -1,-0.3 2,-0.1 3,-0.2 0.584 107.9 56.7 -71.4 -6.8 -63.8 47.5 125.2 500 233 B E G < S+ 0 0 97 -3,-2.7 -1,-0.2 1,-0.1 4,-0.2 -0.025 80.6 91.5-109.8 24.6 -64.3 44.1 126.9 501 234 B R <> + 0 0 32 -3,-1.1 4,-2.1 1,-0.1 -15,-0.4 0.122 46.2 107.6-109.1 22.1 -65.1 45.3 130.4 502 235 B L H > S+ 0 0 41 -3,-0.2 4,-2.0 2,-0.2 -1,-0.1 0.915 84.3 42.0 -68.4 -43.5 -68.9 45.7 130.4 503 236 B E H > S+ 0 0 128 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.878 115.2 49.8 -73.8 -42.7 -69.6 42.6 132.6 504 237 B G H > S+ 0 0 10 -4,-0.2 4,-1.6 2,-0.2 3,-0.2 0.904 111.0 50.3 -53.4 -47.1 -66.8 43.4 135.0 505 238 B T H X S+ 0 0 0 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.911 107.7 55.3 -62.6 -43.8 -68.1 47.1 135.3 506 239 B G H X S+ 0 0 2 -4,-2.0 4,-2.4 2,-0.2 -1,-0.2 0.817 103.1 54.4 -52.4 -39.1 -71.6 45.7 135.9 507 240 B A H X S+ 0 0 63 -4,-1.4 4,-2.5 -3,-0.2 -1,-0.2 0.920 109.7 46.3 -67.5 -41.8 -70.3 43.6 138.8 508 241 B T H X S+ 0 0 15 -4,-1.6 4,-3.1 2,-0.2 5,-0.2 0.904 112.0 51.8 -63.8 -42.9 -68.8 46.8 140.5 509 242 B V H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 5,-0.2 0.973 112.7 46.4 -59.0 -47.9 -72.0 48.8 139.9 510 243 B C H X S+ 0 0 35 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.949 115.3 44.1 -56.7 -51.5 -74.0 46.0 141.5 511 244 B L H X S+ 0 0 71 -4,-2.5 4,-1.0 1,-0.2 -1,-0.2 0.907 112.2 53.6 -65.2 -38.5 -71.7 45.6 144.5 512 245 B G H <>S+ 0 0 0 -4,-3.1 5,-1.9 1,-0.2 -1,-0.2 0.829 110.9 45.8 -66.0 -33.6 -71.5 49.4 144.9 513 246 B I H ><5S+ 0 0 1 -4,-2.0 3,-2.2 -5,-0.2 -1,-0.2 0.881 108.4 54.3 -73.3 -45.5 -75.3 49.8 145.0 514 247 B E H 3<5S+ 0 0 111 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.744 107.2 55.7 -59.3 -20.2 -75.8 46.9 147.4 515 248 B K T 3<5S- 0 0 36 -4,-1.0 -1,-0.3 -5,-0.2 -2,-0.2 0.403 127.0 -98.5 -95.3 5.7 -73.3 48.8 149.6 516 249 B G T < 5 + 0 0 23 -3,-2.2 -36,-0.3 1,-0.2 -3,-0.2 0.604 63.7 156.6 95.0 17.3 -75.4 52.0 149.6 517 250 B C < - 0 0 2 -5,-1.9 -1,-0.2 1,-0.1 -36,-0.2 -0.369 29.7-155.1 -77.2 155.8 -73.9 54.2 147.0 518 251 B E S S+ 0 0 16 -38,-2.9 -218,-2.4 1,-0.2 2,-0.3 0.776 71.2 27.5-104.9 -27.7 -76.2 56.9 145.5 519 252 B F E -mt 300 481F 2 -39,-1.9 -37,-2.4 -220,-0.2 2,-0.4 -0.951 59.7-158.1-128.4 148.3 -74.7 57.6 142.0 520 253 B V E -mt 301 482F 1 -220,-2.1 -218,-3.1 -2,-0.3 2,-0.6 -1.000 13.1-143.5-124.7 139.0 -72.7 55.5 139.6 521 254 B R E +m 302 0F 44 -39,-2.4 -36,-1.0 -2,-0.4 -37,-0.5 -0.874 36.3 166.9-101.3 114.0 -70.5 57.2 136.9 522 255 B V E -m 303 0F 0 -220,-2.4 -218,-2.0 -2,-0.6 3,-0.2 -0.936 45.9-157.5-138.2 144.0 -70.7 55.0 133.7 523 256 B H S S+ 0 0 60 -2,-0.3 2,-1.4 -220,-0.2 3,-0.2 0.786 93.7 62.4 -80.1 -36.1 -69.9 54.9 130.0 524 257 B D > + 0 0 24 1,-0.2 4,-2.6 2,-0.1 5,-0.3 -0.596 64.3 170.0 -96.4 74.9 -72.5 52.2 129.2 525 258 B V H > S+ 0 0 0 -2,-1.4 4,-1.9 1,-0.2 -1,-0.2 0.895 70.0 48.7 -56.0 -47.2 -75.6 54.0 130.2 526 259 B K H > S+ 0 0 92 1,-0.2 4,-1.6 -3,-0.2 -1,-0.2 0.918 116.3 39.4 -61.7 -49.4 -78.1 51.5 128.8 527 260 B E H > S+ 0 0 73 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.941 117.8 48.0 -67.1 -49.1 -76.7 48.3 130.2 528 261 B M H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.740 108.7 56.2 -69.3 -24.7 -75.8 49.9 133.7 529 262 B S H X S+ 0 0 19 -4,-1.9 4,-2.0 -5,-0.3 -1,-0.2 0.879 107.1 47.2 -69.7 -46.5 -79.3 51.5 134.0 530 263 B R H X S+ 0 0 171 -4,-1.6 4,-1.9 2,-0.2 -2,-0.2 0.880 115.2 47.9 -57.3 -44.1 -81.1 48.2 133.6 531 264 B M H X S+ 0 0 59 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.906 112.2 46.8 -65.6 -46.1 -78.6 46.7 136.2 532 265 B A H X S+ 0 0 2 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.878 111.2 54.8 -62.1 -38.5 -79.1 49.6 138.6 533 266 B K H X S+ 0 0 168 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.912 109.9 45.0 -61.7 -42.1 -82.9 49.3 138.1 534 267 B M H X S+ 0 0 115 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.931 112.7 51.1 -76.6 -41.0 -82.9 45.6 139.0 535 268 B M H X S+ 0 0 22 -4,-2.5 4,-3.0 2,-0.2 5,-0.5 0.975 108.0 52.5 -48.2 -66.7 -80.6 46.1 142.1 536 269 B D H X>S+ 0 0 14 -4,-2.6 4,-1.5 1,-0.2 5,-1.5 0.873 110.0 50.0 -35.8 -46.7 -82.8 49.0 143.5 537 270 B A H <5S+ 0 0 74 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.949 115.8 41.0 -70.0 -39.8 -85.8 46.6 143.2 538 271 B M H <5S+ 0 0 122 -4,-2.2 -2,-0.2 1,-0.2 -3,-0.2 0.977 117.5 43.8 -68.9 -53.0 -84.0 43.8 145.0 539 272 B I H <5S- 0 0 75 -4,-3.0 -1,-0.2 -5,-0.1 -3,-0.2 0.722 117.0-113.7 -69.8 -18.8 -82.3 45.8 147.8 540 273 B G T <5 0 0 62 -4,-1.5 -3,-0.2 -5,-0.5 -4,-0.1 0.628 360.0 360.0 104.5 20.1 -85.6 47.7 148.2 541 274 B K < 0 0 73 -5,-1.5 -1,-0.2 -6,-0.2 -242,-0.1 -0.432 360.0 360.0 -63.7 360.0 -84.7 51.3 147.1