==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=13-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 30-APR-98 1BFD . COMPND 2 MOLECULE: BENZOYLFORMATE DECARBOXYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA; . AUTHOR M.S.HASSON,A.MUSCATE,M.J.MCLEISH,L.S.POLOVNIKOVA,J.A.GERLT, . 523 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20991.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 366 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 83 15.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 1.1 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 . 1 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 . 43 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 153 29.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.7 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 3 0 2 4 1 1 1 5 0 3 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 5 3 4 3 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 . 3 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 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 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 A 0 0 103 0, 0.0 165,-2.8 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 156.5 50.0 35.8 147.2 2 3 A S B > -A 165 0A 40 163,-0.3 4,-2.4 1,-0.1 163,-0.2 -0.368 360.0-111.7 -80.0 165.9 52.2 38.8 148.0 3 4 A V H > S+ 0 0 0 161,-2.3 4,-2.7 159,-0.4 5,-0.2 0.906 119.7 57.9 -62.3 -37.2 56.0 39.0 147.3 4 5 A H H > S+ 0 0 19 158,-2.4 4,-2.1 160,-0.3 5,-0.2 0.965 110.6 39.3 -58.2 -58.2 56.4 38.9 151.1 5 6 A G H > S+ 0 0 32 157,-0.3 4,-2.1 1,-0.2 -1,-0.2 0.915 116.0 51.3 -61.4 -42.0 54.5 35.6 151.6 6 7 A T H X S+ 0 0 13 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.907 110.0 50.1 -61.6 -41.5 56.1 34.0 148.5 7 8 A T H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.907 109.9 48.2 -68.0 -43.3 59.6 34.9 149.6 8 9 A Y H X S+ 0 0 4 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.889 112.0 50.8 -66.6 -33.9 59.3 33.5 153.1 9 10 A E H X S+ 0 0 55 -4,-2.1 4,-2.9 -5,-0.2 -2,-0.2 0.914 109.5 51.2 -67.8 -40.8 57.8 30.3 151.6 10 11 A L H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.951 112.6 45.7 -59.2 -48.4 60.8 30.1 149.2 11 12 A L H <>S+ 0 0 0 -4,-2.6 5,-2.7 2,-0.2 3,-0.4 0.952 114.0 47.7 -59.8 -51.5 63.2 30.5 152.1 12 13 A R H ><5S+ 0 0 82 -4,-2.7 3,-1.8 1,-0.2 -1,-0.2 0.928 112.3 50.0 -56.0 -46.9 61.4 28.0 154.3 13 14 A R H 3<5S+ 0 0 104 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.774 109.1 52.4 -65.7 -26.3 61.3 25.5 151.4 14 15 A Q T 3<5S- 0 0 47 -4,-1.6 -1,-0.3 -3,-0.4 -2,-0.2 0.251 125.6-100.6 -93.6 11.0 65.0 25.9 150.7 15 16 A G T < 5S+ 0 0 53 -3,-1.8 2,-0.5 1,-0.3 -3,-0.2 0.570 77.8 134.0 86.4 11.5 65.9 25.2 154.4 16 17 A I < + 0 0 8 -5,-2.7 -1,-0.3 -6,-0.2 -2,-0.1 -0.824 10.0 151.4 -98.2 127.7 66.4 28.7 155.7 17 18 A D + 0 0 78 -2,-0.5 22,-1.5 1,-0.1 2,-0.4 0.272 53.0 70.3-135.3 6.9 64.7 29.4 159.0 18 19 A T E -b 39 0B 5 20,-0.2 47,-0.6 22,-0.0 2,-0.5 -0.992 55.1-161.1-134.3 138.9 66.9 32.1 160.6 19 20 A V E -bc 40 65B 0 20,-2.9 22,-3.0 -2,-0.4 2,-0.6 -0.977 5.5-160.6-120.6 123.3 67.5 35.7 159.8 20 21 A F E +bc 41 66B 2 45,-2.5 47,-2.3 -2,-0.5 2,-0.3 -0.912 37.8 127.5 -99.8 122.3 70.6 37.5 161.1 21 22 A G E -bc 42 67B 0 20,-2.3 22,-1.7 -2,-0.6 47,-0.2 -0.960 58.8-130.7-162.1-177.9 70.2 41.2 161.1 22 23 A N - 0 0 33 45,-1.4 47,-0.2 -2,-0.3 22,-0.1 -0.923 48.6-127.0-142.0 111.1 70.2 44.8 162.3 23 24 A P + 0 0 60 0, 0.0 2,-0.3 0, 0.0 46,-0.1 -0.240 30.5 172.3 -69.1 154.0 66.9 46.5 161.2 24 25 A G >> - 0 0 15 44,-0.1 3,-1.0 1,-0.0 4,-0.7 -0.898 46.9 -94.9-147.2 174.0 66.2 49.7 159.3 25 26 A S G >4 S+ 0 0 64 -2,-0.3 3,-0.6 1,-0.3 -1,-0.0 0.840 120.5 55.7 -67.9 -34.2 63.2 51.5 157.8 26 27 A N G 34 S+ 0 0 1 1,-0.2 71,-0.3 70,-0.2 -1,-0.3 0.632 110.5 50.1 -71.0 -15.1 63.6 50.1 154.3 27 28 A E G X> S+ 0 0 1 -3,-1.0 4,-2.4 69,-0.2 3,-1.1 0.585 83.6 86.9 -99.6 -11.9 63.5 46.6 155.9 28 29 A L H < S+ 0 0 25 -4,-2.4 3,-0.7 3,-0.1 -3,-0.2 0.626 88.1 103.5 -79.8 -18.8 60.3 42.0 158.6 32 33 A K T 3< S+ 0 0 77 -4,-2.0 0, 0.0 1,-0.2 0, 0.0 -0.287 85.6 20.6 -63.7 154.9 56.6 42.7 159.5 33 34 A D T 3 S- 0 0 134 1,-0.2 -1,-0.2 2,-0.0 3,-0.1 0.881 91.1-161.0 52.4 37.7 54.4 39.6 160.1 34 35 A F < - 0 0 57 -3,-0.7 -1,-0.2 1,-0.1 -3,-0.1 -0.275 26.4-100.6 -51.0 127.7 57.7 37.8 160.7 35 36 A P > - 0 0 18 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 -0.228 20.7-134.7 -56.1 139.9 56.9 34.0 160.4 36 37 A E T 3 S+ 0 0 201 1,-0.3 -2,-0.1 -3,-0.1 -3,-0.0 0.659 104.9 56.7 -68.8 -21.0 56.4 32.2 163.7 37 38 A D T 3 S+ 0 0 87 2,-0.0 -1,-0.3 -19,-0.0 2,-0.2 0.380 97.2 83.4 -90.6 2.1 58.6 29.3 162.5 38 39 A F < - 0 0 17 -3,-1.5 2,-0.4 -20,-0.0 -20,-0.2 -0.658 67.4-144.6-100.4 171.4 61.5 31.7 161.8 39 40 A R E -b 18 0B 96 -22,-1.5 -20,-2.9 -2,-0.2 2,-0.5 -0.984 4.9-153.6-138.7 128.4 64.0 33.1 164.3 40 41 A Y E -b 19 0B 51 -2,-0.4 2,-0.7 -22,-0.2 -20,-0.2 -0.954 5.5-161.9-108.9 125.5 65.6 36.6 164.1 41 42 A I E -b 20 0B 6 -22,-3.0 -20,-2.3 -2,-0.5 2,-0.3 -0.917 11.9-154.7-109.8 109.9 69.0 37.1 165.6 42 43 A L E -b 21 0B 42 -2,-0.7 2,-0.3 -22,-0.2 -20,-0.2 -0.648 13.9-179.4 -86.8 137.8 69.8 40.7 166.4 43 44 A A - 0 0 1 -22,-1.7 393,-0.1 -2,-0.3 6,-0.1 -0.959 29.6-129.4-130.9 150.5 73.3 42.1 166.5 44 45 A L S S+ 0 0 72 -2,-0.3 2,-0.3 391,-0.3 -22,-0.1 0.544 88.6 28.4 -78.5 -15.5 74.2 45.8 167.3 45 46 A Q S >> S- 0 0 60 -24,-0.1 4,-1.9 388,-0.1 3,-0.7 -0.986 80.0-119.1-145.6 147.7 76.5 46.5 164.4 46 47 A E H 3> S+ 0 0 16 -2,-0.3 4,-2.5 1,-0.3 5,-0.2 0.761 110.5 57.9 -61.7 -32.9 76.6 45.0 160.9 47 48 A A H 3> S+ 0 0 19 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.893 110.9 47.3 -63.5 -35.3 80.2 43.6 161.0 48 49 A C H <> S+ 0 0 0 -3,-0.7 4,-2.5 2,-0.2 5,-0.2 0.921 109.1 53.2 -70.4 -43.2 78.8 41.6 164.1 49 50 A V H X S+ 0 0 2 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.953 114.8 40.5 -55.7 -53.3 75.7 40.6 162.2 50 51 A V H X S+ 0 0 0 -4,-2.5 4,-3.0 1,-0.2 -1,-0.2 0.906 112.5 55.5 -65.2 -40.3 77.7 39.1 159.3 51 52 A G H X S+ 0 0 3 -4,-2.3 4,-2.3 -5,-0.2 -1,-0.2 0.909 110.3 45.5 -58.8 -43.6 80.3 37.6 161.6 52 53 A I H X S+ 0 0 1 -4,-2.5 4,-2.6 2,-0.2 -1,-0.2 0.945 114.2 47.7 -64.8 -49.1 77.7 35.7 163.5 53 54 A A H X S+ 0 0 0 -4,-2.3 4,-2.8 -5,-0.2 -2,-0.2 0.899 111.1 53.9 -58.9 -39.9 75.9 34.5 160.3 54 55 A D H X S+ 0 0 2 -4,-3.0 4,-2.8 2,-0.2 5,-0.2 0.933 109.5 45.0 -61.1 -51.2 79.3 33.5 159.0 55 56 A G H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 5,-0.3 0.920 113.8 51.7 -59.4 -43.0 80.2 31.3 161.9 56 57 A Y H X S+ 0 0 25 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.934 112.9 44.4 -59.1 -47.3 76.8 29.8 161.8 57 58 A A H X>S+ 0 0 1 -4,-2.8 4,-1.9 2,-0.2 5,-1.0 0.900 113.7 48.9 -64.6 -47.4 77.1 29.0 158.1 58 59 A Q H <5S+ 0 0 8 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.924 117.0 41.4 -60.9 -43.1 80.6 27.6 158.3 59 60 A A H <5S+ 0 0 4 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.863 120.0 42.2 -73.7 -39.7 79.8 25.4 161.3 60 61 A S H <5S- 0 0 40 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.712 99.3-136.7 -80.0 -18.4 76.4 24.2 160.0 61 62 A R T <5S+ 0 0 78 -4,-1.9 -3,-0.2 1,-0.3 -4,-0.1 0.883 70.7 96.5 63.2 39.3 77.7 23.8 156.4 62 63 A K S - d 0 96B 33 -2,-0.3 4,-2.8 26,-0.2 5,-0.5 -0.781 57.7 -79.6 -99.6 108.8 70.0 48.4 156.1 70 71 A S H > S- 0 0 4 -2,-0.8 4,-1.7 26,-0.7 5,-0.1 0.062 89.5 -31.6 42.7-145.4 70.6 50.0 152.8 71 72 A A H > S+ 0 0 34 2,-0.2 4,-3.5 3,-0.2 5,-0.2 0.906 138.3 50.6 -72.6 -44.1 74.1 51.3 151.9 72 73 A A H > S+ 0 0 70 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.912 113.9 44.7 -63.0 -43.0 75.3 52.3 155.4 73 74 A G H X S+ 0 0 1 -4,-2.8 4,-0.8 2,-0.2 -1,-0.2 0.934 116.8 46.1 -66.5 -44.6 74.3 48.9 156.8 74 75 A T H >< S+ 0 0 1 -4,-1.7 3,-1.1 -5,-0.5 4,-0.4 0.940 111.9 51.8 -62.3 -46.0 75.9 47.1 153.9 75 76 A G H >< S+ 0 0 32 -4,-3.5 3,-1.5 1,-0.3 4,-0.3 0.887 103.5 57.1 -58.7 -42.7 79.0 49.2 154.1 76 77 A N H 3< S+ 0 0 81 -4,-2.3 3,-0.3 1,-0.3 -1,-0.3 0.739 108.8 49.5 -61.1 -22.1 79.5 48.5 157.8 77 78 A A T S+ 0 0 34 -3,-1.5 4,-1.1 -4,-0.4 -1,-0.2 0.785 79.9 55.4 -67.2 -27.1 82.1 44.9 154.0 79 80 A G H > S+ 0 0 48 -4,-0.3 4,-1.2 -3,-0.3 3,-0.5 0.929 109.2 49.5 -67.8 -41.2 85.2 44.1 156.1 80 81 A A H > S+ 0 0 13 1,-0.2 4,-2.1 -4,-0.2 -2,-0.2 0.854 105.7 57.4 -64.5 -35.0 83.3 40.9 157.3 81 82 A L H X S+ 0 0 1 -4,-1.7 4,-2.4 1,-0.2 -1,-0.2 0.815 96.8 62.8 -67.7 -26.7 82.5 40.1 153.6 82 83 A S H X S+ 0 0 35 -4,-1.1 4,-1.7 -3,-0.5 -1,-0.2 0.946 107.1 43.4 -64.3 -41.5 86.3 40.1 152.8 83 84 A N H X S+ 0 0 5 -4,-1.2 4,-1.8 1,-0.2 -2,-0.2 0.935 111.7 54.3 -66.1 -44.5 86.7 37.2 155.2 84 85 A A H X>S+ 0 0 0 -4,-2.1 5,-2.2 1,-0.2 4,-0.5 0.861 104.9 54.3 -58.3 -37.7 83.6 35.4 153.9 85 86 A W H ><5S+ 0 0 75 -4,-2.4 3,-1.2 1,-0.2 -1,-0.2 0.959 110.9 44.8 -59.8 -51.4 84.9 35.6 150.3 86 87 A N H 3<5S+ 0 0 31 -4,-1.7 -1,-0.2 1,-0.2 -2,-0.2 0.752 114.3 49.0 -66.1 -26.7 88.2 33.9 151.3 87 88 A S H 3<5S- 0 0 5 -4,-1.8 -1,-0.2 -5,-0.1 -2,-0.2 0.414 105.9-124.0 -94.1 2.4 86.4 31.2 153.3 88 89 A H T <<5 + 0 0 16 -3,-1.2 63,-0.2 -4,-0.5 -3,-0.2 0.897 44.9 179.7 56.1 41.9 83.9 30.4 150.6 89 90 A S < - 0 0 1 -5,-2.2 2,-1.7 -6,-0.1 -1,-0.2 -0.615 30.7-130.6 -79.6 126.1 81.1 31.1 153.1 90 91 A P + 0 0 4 0, 0.0 -26,-2.0 0, 0.0 2,-0.5 -0.557 44.6 163.3 -77.4 86.4 77.6 30.6 151.7 91 92 A L E -d 64 0B 0 -2,-1.7 62,-2.5 -28,-0.2 2,-0.8 -0.922 31.1-157.5-113.8 129.8 76.1 33.9 152.8 92 93 A I E -de 65 153B 0 -28,-3.0 -26,-3.3 -2,-0.5 2,-0.6 -0.877 17.4-169.8-103.2 102.4 72.9 35.5 151.4 93 94 A V E -de 66 154B 1 60,-2.4 62,-2.4 -2,-0.8 2,-0.4 -0.845 5.7-179.1 -97.8 118.5 73.1 39.2 152.1 94 95 A T E -de 67 155B 7 -28,-2.5 -26,-2.9 -2,-0.6 2,-0.4 -0.923 3.2-172.2-115.9 144.5 69.9 41.2 151.5 95 96 A A E -de 68 156B 2 60,-2.2 62,-2.3 -2,-0.4 2,-0.3 -0.987 24.6-117.1-135.0 142.0 69.6 45.0 152.1 96 97 A G E -de 69 157B 4 -28,-1.5 -26,-0.7 -2,-0.4 2,-0.2 -0.650 28.1-160.1 -81.7 141.5 66.5 47.2 151.9 97 98 A Q E - e 0 158B 2 60,-2.5 62,-2.2 -71,-0.3 13,-0.1 -0.703 28.2 -89.4-114.3 162.0 66.3 49.9 149.3 98 99 A Q - 0 0 17 -2,-0.2 62,-0.2 11,-0.2 -1,-0.2 -0.135 61.1 -74.2 -64.0 167.1 64.2 53.0 149.2 99 100 A T >> - 0 0 20 59,-0.2 3,-2.3 60,-0.1 4,-0.7 -0.404 43.6-119.1 -63.7 140.8 60.7 52.9 147.6 100 101 A R H >> S+ 0 0 72 1,-0.3 3,-0.9 2,-0.2 4,-0.6 0.855 112.1 65.7 -51.9 -32.3 61.0 52.8 143.8 101 102 A A H 34 S+ 0 0 89 1,-0.2 -1,-0.3 2,-0.1 4,-0.2 0.711 111.0 33.6 -64.1 -22.3 59.1 56.1 143.6 102 103 A M H <>>S+ 0 0 76 -3,-2.3 5,-1.4 2,-0.1 4,-0.6 0.386 87.8 94.3-117.6 5.9 62.0 57.9 145.3 103 104 A I H X<5S+ 0 0 44 -3,-0.9 3,-1.4 -4,-0.7 -2,-0.1 0.944 84.9 55.9 -61.7 -43.9 65.1 56.1 144.0 104 105 A G T 3<5S+ 0 0 74 -4,-0.6 -1,-0.2 1,-0.3 -2,-0.1 0.840 107.7 45.4 -57.9 -41.7 65.5 58.7 141.2 105 106 A V T 345S- 0 0 115 -4,-0.2 -1,-0.3 -3,-0.1 -2,-0.2 0.541 108.3-126.1 -81.4 -3.7 65.6 61.7 143.5 106 107 A E T <<5 - 0 0 123 -3,-1.4 -3,-0.2 -4,-0.6 -2,-0.1 0.971 34.1-166.8 56.5 57.7 68.0 59.9 145.8 107 108 A A > < - 0 0 24 -5,-1.4 3,-1.6 1,-0.2 -9,-0.1 -0.260 41.4 -68.6 -64.7 162.2 66.0 60.4 149.0 108 109 A L T 3 S+ 0 0 146 1,-0.3 -1,-0.2 3,-0.0 3,-0.1 -0.257 125.6 29.0 -53.1 143.8 67.8 59.7 152.3 109 110 A L T 3 S+ 0 0 58 1,-0.3 2,-0.4 -3,-0.1 -1,-0.3 0.529 82.6 143.4 78.8 7.6 68.5 55.9 152.6 110 111 A T < - 0 0 19 -3,-1.6 2,-1.0 -13,-0.1 -1,-0.3 -0.677 48.1-141.0 -78.3 131.1 68.7 55.4 148.9 111 112 A N > - 0 0 3 -2,-0.4 3,-1.0 -3,-0.1 2,-0.3 -0.833 24.1-147.2 -93.2 97.6 71.4 52.8 148.1 112 113 A V T 3 S- 0 0 79 -2,-1.0 5,-0.1 1,-0.3 4,-0.0 -0.541 74.3 -5.3 -73.3 131.5 72.9 54.3 144.9 113 114 A D T >> S- 0 0 110 -2,-0.3 3,-1.6 3,-0.1 4,-0.7 0.911 86.9-175.4 51.5 46.3 74.2 51.9 142.3 114 115 A A G X4 + 0 0 5 -3,-1.0 3,-1.2 1,-0.3 -2,-0.1 0.772 68.4 56.6 -41.7 -53.8 73.5 49.2 144.8 115 116 A A G 3> S+ 0 0 21 1,-0.3 4,-0.5 2,-0.1 -1,-0.3 0.778 105.6 53.5 -57.0 -28.4 74.9 46.1 143.0 116 117 A N G <4 S+ 0 0 73 -3,-1.6 -1,-0.3 2,-0.1 -2,-0.2 0.707 90.3 78.7 -80.6 -19.6 78.3 47.8 142.7 117 118 A L T << S+ 0 0 64 -3,-1.2 -2,-0.1 -4,-0.7 -1,-0.1 0.967 99.2 35.6 -54.9 -58.9 78.6 48.5 146.5 118 119 A P T >4 S+ 0 0 0 0, 0.0 3,-2.3 0, 0.0 -1,-0.2 0.679 97.4 142.2 -71.6 -19.7 79.6 45.0 147.7 119 120 A R T 3< + 0 0 124 -4,-0.5 4,-0.1 1,-0.3 -3,-0.0 -0.421 55.7 27.2 -62.9 147.1 81.7 44.2 144.6 120 121 A P T 3 S+ 0 0 109 0, 0.0 -1,-0.3 0, 0.0 -3,-0.1 -0.911 114.9 64.5 -92.7 24.9 84.3 42.8 144.3 121 122 A L S < S+ 0 0 39 -3,-2.3 2,-0.3 30,-0.0 -2,-0.2 0.220 92.8 72.0 -92.1 17.2 83.6 40.7 147.5 122 123 A V - 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0 0 2 -6,-1.2 -66,-0.1 -63,-0.2 -60,-0.1 -0.983 48.4 -62.9-177.1 170.8 80.5 32.4 148.6 152 153 A P - 0 0 0 0, 0.0 -29,-3.2 0, 0.0 -28,-0.5 -0.397 42.2-170.0 -73.2 146.7 78.6 35.5 149.6 153 154 A V E -ef 92 124B 0 -62,-2.5 -60,-2.4 -31,-0.2 2,-0.4 -0.909 9.4-142.1-129.9 162.9 75.9 37.1 147.3 154 155 A Y E -ef 93 125B 0 -30,-2.4 -28,-1.8 -2,-0.3 2,-0.4 -0.990 14.5-179.8-136.2 134.5 74.0 40.3 147.5 155 156 A L E -ef 94 126B 1 -62,-2.4 -60,-2.2 -2,-0.4 2,-0.5 -0.996 9.7-161.2-135.2 124.9 70.4 41.3 146.8 156 157 A S E -e 95 0B 0 -30,-2.4 -60,-0.2 -2,-0.4 -41,-0.1 -0.923 11.8-170.3-105.4 130.4 68.9 44.9 147.2 157 158 A V E -e 96 0B 3 -62,-2.3 -60,-2.5 -2,-0.5 5,-0.1 -0.959 22.8-128.5-130.2 117.4 65.1 45.1 147.4 158 159 A P E > -e 97 0B 0 0, 0.0 3,-1.9 0, 0.0 4,-0.4 -0.388 27.5-126.5 -58.0 134.5 63.0 48.4 147.3 159 160 A Y G > S+ 0 0 77 -62,-2.2 3,-0.6 1,-0.3 4,-0.3 0.726 103.7 63.3 -60.9 -23.1 60.7 48.3 150.3 160 161 A D G 3 S+ 0 0 34 1,-0.2 3,-0.3 -62,-0.2 4,-0.3 0.608 87.2 74.6 -78.3 -8.9 57.5 48.8 148.3 161 162 A D G X S+ 0 0 0 -3,-1.9 3,-1.3 1,-0.2 -158,-0.4 0.827 79.4 72.1 -70.2 -34.1 58.0 45.5 146.5 162 163 A W T < S+ 0 0 10 -3,-0.6 -158,-2.4 -4,-0.4 -159,-0.4 0.840 97.2 45.5 -54.8 -39.2 57.0 43.3 149.4 163 164 A D T 3 S+ 0 0 96 -3,-0.3 -1,-0.3 -4,-0.3 -2,-0.1 0.519 93.5 100.0 -85.2 -5.0 53.3 44.1 149.4 164 165 A K S < S- 0 0 94 -3,-1.3 -161,-2.3 -4,-0.3 -160,-0.3 -0.295 85.6 -89.0 -76.5 166.6 52.9 43.7 145.7 165 166 A D B -A 2 0A 129 -163,-0.2 -163,-0.3 -162,-0.1 2,-0.2 -0.521 39.7-135.3 -75.4 140.8 51.5 40.5 144.0 166 167 A A - 0 0 13 -165,-2.8 -34,-0.1 -2,-0.2 -33,-0.1 -0.572 31.9 -91.6 -93.1 157.4 54.0 37.8 143.1 167 168 A D > - 0 0 77 -35,-0.6 3,-2.3 -2,-0.2 4,-0.2 -0.553 32.2-136.5 -63.6 128.4 54.0 36.0 139.8 168 169 A P G > S+ 0 0 109 0, 0.0 3,-1.1 0, 0.0 -1,-0.2 0.773 103.1 66.5 -62.5 -20.6 51.8 32.9 140.4 169 170 A Q G > S+ 0 0 106 1,-0.2 3,-1.8 2,-0.1 4,-0.2 0.561 73.7 92.0 -76.7 -3.1 54.4 30.9 138.4 170 171 A S G X> + 0 0 9 -3,-2.3 3,-2.2 1,-0.3 4,-0.5 0.717 63.9 81.7 -63.4 -18.5 56.9 31.6 141.3 171 172 A H G X4 S+ 0 0 97 -3,-1.1 3,-0.9 1,-0.3 4,-0.5 0.774 77.6 70.4 -59.5 -23.1 55.7 28.3 142.9 172 173 A H G <4 S+ 0 0 110 -3,-1.8 -1,-0.3 1,-0.2 3,-0.2 0.723 91.7 59.4 -65.3 -22.0 58.2 26.6 140.5 173 174 A L G X4 S+ 0 0 19 -3,-2.2 3,-1.2 -4,-0.2 -1,-0.2 0.752 84.6 81.5 -78.2 -26.8 61.0 28.0 142.5 174 175 A F T << S+ 0 0 27 -3,-0.9 -1,-0.2 -4,-0.5 -2,-0.1 0.874 101.9 25.6 -49.3 -51.8 60.1 26.4 145.8 175 176 A D T 3 S+ 0 0 111 -4,-0.5 -1,-0.2 -3,-0.2 -2,-0.1 0.173 81.0 142.6-106.3 21.2 61.5 22.9 145.4 176 177 A R < - 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n 0 373D 32 -159,-1.6 2,-0.2 -2,-0.4 -22,-0.1 -0.986 51.7 -83.5-146.2 138.3 90.5 32.0 161.9 397 398 A C > - 0 0 1 -24,-0.6 3,-1.7 -2,-0.3 5,-0.1 -0.218 38.9-150.3 -48.4 109.9 89.7 35.0 159.7 398 399 A A T 3 S+ 0 0 10 1,-0.3 -1,-0.2 -2,-0.2 -315,-0.1 0.642 94.1 36.4 -59.9 -25.2 90.3 33.8 156.2 399 400 A A T 3 S- 0 0 41 2,-0.1 -1,-0.3 -162,-0.1 3,-0.1 0.269 116.0-108.6-110.8 8.4 91.3 37.2 154.8 400 401 A G < + 0 0 48 -3,-1.7 2,-0.8 1,-0.2 -2,-0.1 0.693 68.4 151.6 73.3 16.1 93.1 38.3 157.9 401 402 A G - 0 0 20 -322,-0.1 3,-0.5 -321,-0.1 -1,-0.2 -0.741 39.5-139.1 -86.1 112.5 90.3 40.8 158.7 402 403 A L S S+ 0 0 53 -2,-0.8 -319,-0.1 1,-0.2 28,-0.1 -0.269 80.8 61.7 -68.0 155.5 90.1 41.3 162.4 403 404 A G S S+ 0 0 10 -29,-0.1 -1,-0.2 26,-0.1 -352,-0.1 0.450 80.4 98.0 103.3 7.0 86.6 41.5 164.0 404 405 A F > + 0 0 8 -3,-0.5 4,-2.7 2,-0.1 5,-0.3 0.919 69.7 53.9 -89.5 -56.0 85.7 37.9 162.9 405 406 A A H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 5,-0.2 0.852 102.1 54.8 -55.1 -44.3 86.3 35.6 165.8 406 407 A L H > S+ 0 0 3 2,-0.2 4,-0.9 1,-0.2 -1,-0.2 0.977 119.5 30.8 -59.8 -57.2 84.2 37.3 168.5 407 408 A P H >> S+ 0 0 0 0, 0.0 4,-1.7 0, 0.0 3,-0.7 0.927 118.7 56.0 -68.4 -37.9 80.9 37.4 166.6 408 409 A A H 3X S+ 0 0 0 -4,-2.7 4,-3.0 1,-0.3 5,-0.2 0.862 99.9 60.2 -60.4 -34.9 81.7 34.2 164.7 409 410 A A H 3X S+ 0 0 0 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.3 0.856 104.7 49.6 -60.2 -36.6 82.2 32.3 168.0 410 411 A I H < + 0 0 58 -4,-2.3 3,-1.9 3,-0.1 -1,-0.3 -0.633 65.3 169.6-125.0 75.3 76.7 23.5 167.6 417 418 A P T 3 S+ 0 0 94 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.752 77.5 53.5 -59.1 -22.5 74.9 23.7 171.0 418 419 A E T 3 S+ 0 0 173 2,-0.1 2,-0.5 1,-0.0 -50,-0.1 0.373 95.9 73.2 -97.3 7.1 76.6 20.6 172.3 419 420 A R S < S- 0 0 31 -3,-1.9 2,-0.4 -6,-0.2 -50,-0.1 -0.982 84.5-121.7-121.6 125.6 80.2 21.5 171.6 420 421 A Q - 0 0 39 -2,-0.5 -50,-2.4 27,-0.1 2,-0.4 -0.513 24.7-148.6 -69.4 121.9 81.8 24.1 173.9 421 422 A V E -m 370 0D 0 -2,-0.4 27,-2.1 25,-0.2 2,-0.4 -0.761 15.0-175.5 -94.0 133.4 83.1 27.1 171.8 422 423 A I E -mo 371 448D 1 -52,-2.8 -50,-1.8 -2,-0.4 2,-0.5 -0.972 7.4-161.6-132.0 112.9 86.2 28.9 173.1 423 424 A A E -mo 372 449D 0 25,-2.8 27,-3.6 -2,-0.4 2,-0.7 -0.871 2.9-159.1 -99.0 123.8 87.4 32.0 171.3 424 425 A V E +mo 373 450D 0 -52,-3.0 -50,-2.9 -2,-0.5 2,-0.4 -0.911 23.9 172.9-104.8 110.0 91.0 33.0 171.9 425 426 A I E -mo 374 451D 0 25,-2.8 27,-2.7 -2,-0.7 -50,-0.3 -0.949 29.9-124.1-127.8 136.6 91.2 36.7 171.0 426 427 A G E > - o 0 452D 9 -52,-2.5 4,-2.0 -2,-0.4 27,-0.2 -0.285 30.4-113.4 -71.5 157.6 94.0 39.3 171.3 427 428 A D H > S+ 0 0 3 25,-1.8 4,-0.6 2,-0.2 26,-0.1 0.834 117.9 49.7 -62.2 -30.2 93.3 42.6 173.2 428 429 A G H >4 S+ 0 0 5 28,-0.4 3,-1.0 1,-0.2 4,-0.4 0.971 112.2 45.6 -71.8 -50.6 93.7 44.5 169.9 429 430 A S H >> S+ 0 0 7 -55,-0.3 3,-0.9 1,-0.2 4,-0.5 0.783 98.8 72.5 -61.0 -31.7 91.3 42.3 167.9 430 431 A A H 3< S+ 0 0 0 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.829 91.5 58.5 -55.8 -33.0 88.7 42.2 170.7 431 432 A N T X< S+ 0 0 56 -3,-1.0 3,-1.1 -4,-0.6 -1,-0.2 0.763 86.1 74.2 -71.2 -29.1 87.7 45.8 169.9 432 433 A Y T <4 S+ 0 0 119 -3,-0.9 -1,-0.2 -4,-0.4 -2,-0.1 0.850 119.2 11.3 -56.4 -37.9 86.7 45.5 166.3 433 434 A S T >< S+ 0 0 5 -4,-0.5 3,-1.8 -3,-0.5 -1,-0.3 -0.175 81.7 140.9-135.1 41.6 83.4 43.7 167.0 434 435 A I G X + 0 0 33 -3,-1.1 3,-1.8 1,-0.3 4,-0.2 0.826 63.5 67.0 -56.7 -36.2 83.1 44.2 170.7 435 436 A S G > S+ 0 0 16 1,-0.3 3,-1.4 -4,-0.2 4,-0.5 0.658 78.4 82.1 -64.3 -12.8 79.3 44.8 170.6 436 437 A A G X> S+ 0 0 0 -3,-1.8 4,-1.2 1,-0.3 3,-1.1 0.801 74.1 76.6 -60.9 -27.1 78.7 41.2 169.5 437 438 A L H <> S+ 0 0 0 -3,-1.8 4,-2.0 1,-0.3 -1,-0.3 0.873 85.3 63.1 -50.3 -37.2 79.0 40.3 173.2 438 439 A W H <> S+ 0 0 61 -3,-1.4 4,-3.0 1,-0.2 -1,-0.3 0.878 97.8 54.3 -57.1 -41.5 75.5 41.7 173.6 439 440 A T H <> S+ 0 0 0 -3,-1.1 4,-2.1 -4,-0.5 -1,-0.2 0.896 106.9 50.8 -62.4 -40.9 74.0 39.0 171.3 440 441 A A H X>S+ 0 0 0 -4,-1.2 5,-2.0 -3,-0.2 4,-0.6 0.921 113.8 45.8 -62.2 -43.0 75.5 36.2 173.3 441 442 A A H ><5S+ 0 0 22 -4,-2.0 3,-0.5 48,-0.2 -2,-0.2 0.950 112.9 49.2 -65.8 -48.1 74.1 37.7 176.5 442 443 A Q H 3<5S+ 0 0 115 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.826 122.3 30.6 -63.1 -39.2 70.6 38.3 175.1 443 444 A Y H 3<5S- 0 0 93 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.372 107.4-122.6-100.4 2.8 70.1 34.9 173.5 444 445 A N T <<5 + 0 0 95 -4,-0.6 -3,-0.2 -3,-0.5 -4,-0.1 0.943 43.6 173.3 54.3 54.5 72.2 33.2 176.2 445 446 A I < - 0 0 8 -5,-2.0 2,-2.0 -6,-0.2 -1,-0.2 -0.859 30.0-137.5 -94.2 110.7 74.6 31.6 173.8 446 447 A P + 0 0 45 0, 0.0 -25,-0.2 0, 0.0 68,-0.1 -0.135 44.0 152.0 -67.0 44.7 77.3 30.0 176.1 447 448 A T - 0 0 0 -2,-2.0 69,-1.9 -27,-0.1 2,-0.5 -0.421 37.9-140.2 -75.0 146.3 80.5 31.0 174.2 448 449 A I E -op 422 516D 1 -27,-2.1 -25,-2.8 67,-0.2 2,-0.5 -0.953 14.3-160.5-108.5 127.2 83.6 31.4 176.3 449 450 A F E -op 423 517D 0 67,-3.1 69,-3.2 -2,-0.5 2,-0.6 -0.952 3.8-165.8-112.4 122.2 85.8 34.3 175.2 450 451 A V E -op 424 518D 2 -27,-3.6 -25,-2.8 -2,-0.5 2,-0.6 -0.927 8.1-158.0-108.7 111.8 89.5 34.3 176.3 451 452 A I E -op 425 519D 0 67,-3.0 69,-3.2 -2,-0.6 2,-1.1 -0.829 6.6-149.9 -94.5 120.0 91.1 37.7 175.8 452 453 A M E -op 426 520D 4 -27,-2.7 -25,-1.8 -2,-0.6 2,-0.9 -0.780 18.8-164.6 -88.9 97.1 94.9 37.6 175.6 453 454 A N E + p 0 521D 25 67,-3.1 69,-2.0 -2,-1.1 -27,-0.1 -0.765 35.7 140.8 -93.5 105.1 95.8 41.0 177.0 454 455 A N - 0 0 47 -2,-0.9 -1,-0.2 2,-0.3 67,-0.1 0.242 63.1-121.0-119.2 7.1 99.4 42.0 176.3 455 456 A G S S+ 0 0 21 22,-0.2 22,-1.9 1,-0.1 2,-0.3 0.469 79.1 74.7 68.5 8.9 98.6 45.7 175.7 456 457 A T B S-S 476 0F 22 20,-0.3 2,-1.7 21,-0.1 -28,-0.4 -0.924 89.5-104.6-148.2 163.7 100.0 45.9 172.2 457 458 A Y > - 0 0 66 18,-3.1 4,-2.0 -2,-0.3 3,-0.5 -0.697 49.6-179.1 -86.7 77.6 99.4 44.9 168.5 458 459 A G H > S+ 0 0 19 -2,-1.7 4,-2.0 1,-0.2 -1,-0.2 0.827 71.1 53.2 -49.2 -51.4 102.0 42.2 169.0 459 460 A A H > S+ 0 0 14 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.864 111.6 49.1 -56.9 -36.2 102.0 40.7 165.5 460 461 A L H > S+ 0 0 87 -3,-0.5 4,-3.4 2,-0.2 5,-0.2 0.880 106.4 53.2 -72.2 -41.4 102.6 44.2 164.1 461 462 A R H X S+ 0 0 111 -4,-2.0 4,-1.0 1,-0.2 -1,-0.2 0.896 110.3 52.6 -60.4 -32.8 105.5 45.0 166.5 462 463 A W H >X S+ 0 0 154 -4,-2.0 4,-2.1 2,-0.2 3,-0.5 0.956 111.2 41.4 -67.9 -53.0 106.9 41.8 165.2 463 464 A F H 3X S+ 0 0 59 -4,-2.2 4,-2.0 1,-0.3 5,-0.4 0.954 111.4 58.1 -59.9 -40.7 106.7 42.7 161.5 464 465 A A H 3<>S+ 0 0 15 -4,-3.4 5,-3.1 1,-0.3 -1,-0.3 0.829 107.9 50.4 -58.1 -24.3 107.9 46.2 162.5 465 466 A G H X<5S+ 0 0 50 -4,-1.0 3,-0.6 -3,-0.5 -1,-0.3 0.923 109.1 46.3 -80.8 -44.7 110.8 44.3 163.8 466 467 A V H 3<5S+ 0 0 82 -4,-2.1 -2,-0.2 1,-0.3 -3,-0.1 0.992 112.9 48.3 -61.8 -58.9 111.6 42.2 160.7 467 468 A L T 3<5S- 0 0 130 -4,-2.0 -1,-0.3 1,-0.1 -2,-0.2 0.595 110.0-128.4 -52.9 -16.2 111.4 45.2 158.3 468 469 A E T < 5 + 0 0 151 -3,-0.6 2,-0.4 -5,-0.4 -3,-0.2 0.989 48.9 169.8 58.2 61.6 113.6 46.9 160.8 469 470 A A < - 0 0 38 -5,-3.1 2,-0.3 -6,-0.1 3,-0.2 -0.951 13.3-166.3-107.3 137.9 111.1 49.7 160.8 470 471 A E + 0 0 145 -2,-0.4 -5,-0.0 1,-0.2 -3,-0.0 -0.827 58.0 25.5-127.9 160.5 111.4 52.4 163.4 471 472 A N S S+ 0 0 160 -2,-0.3 -1,-0.2 1,-0.2 0, 0.0 0.873 71.8 164.4 58.9 41.6 109.3 55.2 164.8 472 473 A V - 0 0 67 -3,-0.2 3,-0.4 -11,-0.0 -1,-0.2 -0.803 25.8-145.4 -91.0 120.0 106.1 53.5 163.7 473 474 A P + 0 0 112 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.354 67.5 34.3 -82.0 167.3 103.1 55.1 165.5 474 475 A G + 0 0 62 1,-0.1 -2,-0.0 -2,-0.1 0, 0.0 0.671 69.6 123.3 65.3 33.3 99.9 53.4 166.8 475 476 A L + 0 0 16 -3,-0.4 -18,-3.1 -19,-0.1 2,-0.4 0.597 57.3 71.8 -99.7 -11.3 101.2 50.0 167.9 476 477 A D B -S 456 0F 85 -20,-0.2 -20,-0.3 -19,-0.0 -21,-0.1 -0.867 50.5-172.3-111.0 144.6 100.1 50.0 171.5 477 478 A V + 0 0 23 -22,-1.9 3,-0.3 -2,-0.4 -22,-0.2 -0.553 25.2 162.8-129.4 64.4 96.6 49.7 172.9 478 479 A P + 0 0 99 0, 0.0 -2,-0.0 0, 0.0 -22,-0.0 -0.297 46.6 45.6 -79.1 167.4 96.8 50.4 176.7 479 480 A G + 0 0 88 1,-0.2 2,-0.5 -2,-0.0 0, 0.0 0.808 68.1 135.8 74.5 34.3 94.0 51.3 179.0 480 481 A I - 0 0 46 -3,-0.3 2,-0.9 4,-0.0 -1,-0.2 -0.965 37.7-159.8-118.6 124.8 91.3 48.8 178.1 481 482 A D > - 0 0 85 -2,-0.5 4,-1.7 1,-0.2 3,-0.3 -0.853 7.3-175.3-102.7 100.0 89.3 47.1 180.9 482 483 A F H > S+ 0 0 0 -2,-0.9 4,-2.3 1,-0.2 -1,-0.2 0.770 80.9 59.3 -68.5 -26.7 87.8 44.0 179.2 483 484 A R H > S+ 0 0 110 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.917 106.6 48.5 -68.0 -38.0 85.8 43.0 182.3 484 485 A A H > S+ 0 0 50 -3,-0.3 4,-2.8 2,-0.2 -2,-0.2 0.910 110.0 51.6 -66.9 -41.8 84.1 46.4 182.3 485 486 A L H X S+ 0 0 59 -4,-1.7 4,-1.4 2,-0.2 -2,-0.2 0.934 110.8 47.9 -60.8 -44.4 83.3 46.0 178.6 486 487 A A H <>S+ 0 0 0 -4,-2.3 5,-2.8 1,-0.2 3,-0.4 0.920 111.7 50.2 -62.4 -43.0 81.8 42.5 179.2 487 488 A K H ><5S+ 0 0 170 -4,-2.4 3,-1.9 1,-0.2 -2,-0.2 0.915 104.4 59.1 -60.4 -44.4 79.7 43.9 182.1 488 489 A G H 3<5S+ 0 0 65 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.857 111.5 40.6 -52.8 -38.2 78.5 46.7 179.9 489 490 A Y T 3<5S- 0 0 74 -4,-1.4 -1,-0.3 -3,-0.4 -48,-0.2 0.267 121.5-102.9 -97.7 12.5 77.0 44.1 177.5 490 491 A G T < 5S+ 0 0 60 -3,-1.9 2,-0.4 1,-0.2 -3,-0.2 0.640 75.1 135.2 79.2 19.0 75.7 41.7 180.2 491 492 A V < - 0 0 4 -5,-2.8 -1,-0.2 -6,-0.2 25,-0.1 -0.839 59.5-113.7-105.9 134.3 78.4 39.0 180.0 492 493 A Q E -q 516 0D 78 23,-0.9 25,-2.5 -2,-0.4 2,-0.4 -0.349 38.1-157.4 -60.5 137.5 80.0 37.5 183.2 493 494 A A E -q 517 0D 31 23,-0.2 2,-0.3 25,-0.0 25,-0.2 -0.963 15.8-179.9-128.2 143.5 83.7 38.4 183.3 494 495 A L E -q 518 0D 23 23,-2.6 25,-2.8 -2,-0.4 2,-0.4 -0.884 16.0-139.7-132.2 161.2 86.7 36.9 185.1 495 496 A K E -q 519 0D 73 -2,-0.3 2,-0.4 23,-0.2 25,-0.2 -0.959 8.4-167.5-127.7 144.2 90.3 37.8 185.2 496 497 A A E +q 520 0D 0 23,-3.0 25,-2.7 -2,-0.4 -144,-0.2 -0.937 16.6 163.0-133.1 106.3 93.5 35.7 185.1 497 498 A D S S+ 0 0 61 -2,-0.4 2,-0.3 23,-0.2 -1,-0.1 0.558 72.4 9.4 -96.6 -12.6 96.8 37.3 186.1 498 499 A N S > S- 0 0 37 -147,-0.1 4,-2.3 1,-0.1 5,-0.1 -0.938 89.5 -84.9-155.1 176.1 98.7 34.0 186.7 499 500 A L H > S+ 0 0 46 -149,-0.3 4,-2.5 -151,-0.3 5,-0.2 0.867 121.4 53.6 -57.6 -44.8 98.4 30.3 186.2 500 501 A E H > S+ 0 0 164 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.936 113.6 43.3 -57.8 -46.2 96.5 29.6 189.4 501 502 A Q H > S+ 0 0 76 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.854 110.2 57.3 -68.0 -36.0 93.9 32.1 188.5 502 503 A L H X S+ 0 0 3 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.933 108.7 45.2 -60.1 -49.3 93.8 30.9 184.9 503 504 A K H X S+ 0 0 74 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.902 115.2 47.7 -62.0 -42.7 92.9 27.3 186.0 504 505 A G H X S+ 0 0 31 -4,-1.9 4,-2.4 -5,-0.2 -2,-0.2 0.942 111.6 49.3 -64.7 -47.3 90.3 28.6 188.4 505 506 A S H X S+ 0 0 12 -4,-3.2 4,-3.1 1,-0.2 -2,-0.2 0.885 111.1 50.3 -59.6 -41.0 88.7 30.9 185.9 506 507 A L H X S+ 0 0 4 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.897 107.8 53.1 -65.7 -40.3 88.5 28.1 183.3 507 508 A Q H X S+ 0 0 118 -4,-2.1 4,-1.1 2,-0.2 -2,-0.2 0.960 114.2 42.7 -59.1 -49.5 86.9 25.8 185.8 508 509 A E H >X S+ 0 0 104 -4,-2.4 4,-1.0 1,-0.2 3,-0.9 0.959 114.0 50.5 -61.9 -49.3 84.3 28.4 186.5 509 510 A A H >< S+ 0 0 3 -4,-3.1 3,-0.9 1,-0.3 -1,-0.2 0.899 108.6 52.1 -56.0 -45.3 83.8 29.3 182.8 510 511 A L H 3< S+ 0 0 49 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.750 112.2 46.5 -65.1 -24.4 83.3 25.7 181.8 511 512 A S H << S+ 0 0 89 -4,-1.1 -1,-0.3 -3,-0.9 -2,-0.2 0.548 90.0 113.4 -94.1 -8.5 80.7 25.2 184.4 512 513 A A << - 0 0 25 -4,-1.0 4,-0.1 -3,-0.9 -3,-0.0 -0.129 61.3-145.0 -62.2 156.4 78.8 28.4 183.5 513 514 A K S S+ 0 0 182 2,-0.1 -1,-0.1 -68,-0.0 -3,-0.1 0.144 80.5 30.1-110.0 21.8 75.3 28.4 182.1 514 515 A G S S- 0 0 13 -5,-0.2 -73,-0.1 -68,-0.1 -2,-0.1 -0.904 105.0 -50.3-159.2-178.7 75.9 31.4 179.9 515 516 A P - 0 0 8 0, 0.0 -23,-0.9 0, 0.0 2,-0.4 -0.357 52.7-168.0 -65.9 146.0 78.6 33.3 178.0 516 517 A V E -pq 448 492D 0 -69,-1.9 -67,-3.1 -25,-0.1 2,-0.4 -0.997 12.0-155.7-138.6 140.5 81.8 34.1 179.9 517 518 A L E -pq 449 493D 1 -25,-2.5 -23,-2.6 -2,-0.4 2,-0.5 -0.964 7.7-166.8-117.7 131.2 84.7 36.4 179.2 518 519 A I E -pq 450 494D 0 -69,-3.2 -67,-3.0 -2,-0.4 2,-0.7 -0.979 9.5-151.8-120.5 118.9 88.1 35.8 180.8 519 520 A E E -pq 451 495D 10 -25,-2.8 -23,-3.0 -2,-0.5 2,-0.5 -0.840 16.6-164.4 -91.1 118.8 90.7 38.5 180.6 520 521 A V E -pq 452 496D 0 -69,-3.2 -67,-3.1 -2,-0.7 2,-0.9 -0.904 16.2-137.3-108.2 127.9 94.2 36.9 180.7 521 522 A S E -p 453 0D 8 -25,-2.7 -169,-2.4 -2,-0.5 2,-0.2 -0.749 32.9-174.7 -84.3 109.6 97.3 38.9 181.4 522 523 A T B r 352 0E 4 -69,-2.0 -169,-0.2 -2,-0.9 -171,-0.1 -0.686 360.0 360.0-108.4 158.7 99.9 37.7 178.9 523 524 A V 0 0 85 -171,-2.1 -1,-0.1 -2,-0.2 -69,-0.0 -0.348 360.0 360.0 -65.4 360.0 103.6 38.4 178.5