==== 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 OXIDOREDUCTASE 29-JUL-04 1WND . COMPND 2 MOLECULE: PUTATIVE BETAINE ALDEHYDE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR A.GRUEZ,V.ROIG-ZAMBONI,M.TEGONI,C.CAMBILLAU . 1896 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 59466.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1350 71.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 228 12.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 172 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 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 . 8 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 . 115 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 174 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 591 31.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 24 1.3 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 4 4 8 0 0 4 8 8 4 3 4 6 3 4 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 8 0 8 16 16 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 . 14 8 10 0 0 4 0 0 4 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 . 6 0 0 0 0 0 4 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A M 0 0 171 0, 0.0 2,-0.2 0, 0.0 178,-0.0 0.000 360.0 360.0 360.0 4.3 -26.0 63.3 104.5 2 2 A Q + 0 0 48 1,-0.1 180,-0.2 177,-0.1 181,-0.2 -0.533 360.0 157.7 -70.1 134.2 -23.0 60.8 104.9 3 3 A H + 0 0 80 -2,-0.2 11,-0.4 179,-0.1 2,-0.2 0.233 29.0 111.8-139.9 14.0 -21.7 59.9 101.4 4 4 A K - 0 0 74 178,-0.2 9,-0.2 9,-0.1 2,-0.2 -0.624 61.0-121.6 -96.9 152.9 -18.1 58.7 101.9 5 5 A L E -A 12 0A 0 7,-3.3 7,-2.6 -2,-0.2 2,-0.7 -0.538 18.5-129.8 -83.0 155.4 -16.8 55.2 101.3 6 6 A L E +AB 11 199A 4 193,-2.1 193,-2.0 5,-0.2 2,-0.4 -0.933 37.1 164.0-107.3 111.2 -15.0 53.3 104.1 7 7 A I E > -A 10 0A 19 3,-2.6 3,-1.7 -2,-0.7 191,-0.1 -0.978 66.7 -22.4-132.6 119.0 -11.7 52.0 102.8 8 8 A N T 3 S- 0 0 83 -2,-0.4 186,-0.2 1,-0.3 -1,-0.1 0.900 126.7 -47.5 53.9 46.1 -8.9 50.7 105.1 9 9 A G T 3 S+ 0 0 10 188,-0.5 2,-0.4 1,-0.2 -1,-0.3 0.491 118.7 103.0 78.4 4.8 -10.1 52.7 108.1 10 10 A E E < -A 7 0A 118 -3,-1.7 -3,-2.6 2,-0.0 2,-0.7 -0.922 67.4-132.2-121.8 146.7 -10.6 56.0 106.3 11 11 A L E +A 6 0A 45 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.866 39.3 170.0 -94.0 117.8 -13.7 57.8 105.0 12 12 A V E -A 5 0A 51 -7,-2.6 -7,-3.3 -2,-0.7 2,-0.1 -0.962 35.0-108.2-130.9 151.8 -13.0 58.9 101.4 13 13 A S - 0 0 56 -2,-0.3 -9,-0.1 -9,-0.2 22,-0.1 -0.459 41.7-104.7 -72.4 145.9 -15.1 60.3 98.6 14 14 A G - 0 0 10 20,-0.5 22,-0.3 -11,-0.4 21,-0.2 -0.342 22.7-155.2 -63.9 149.9 -15.8 58.0 95.6 15 15 A E + 0 0 132 20,-0.3 21,-0.2 19,-0.1 -1,-0.1 0.364 65.2 83.0-112.4 4.7 -13.7 58.9 92.6 16 16 A G S S- 0 0 29 19,-3.4 21,-0.2 1,-0.2 2,-0.1 -0.077 94.1 -48.9 -92.5-165.5 -16.1 57.5 89.9 17 17 A E - 0 0 131 19,-0.2 18,-2.0 17,-0.2 -1,-0.2 -0.394 61.4-106.5 -70.8 144.3 -19.2 59.0 88.3 18 18 A K E -H 34 0B 143 16,-0.3 16,-0.3 -2,-0.1 -1,-0.1 -0.393 35.0-161.9 -70.1 146.6 -21.9 60.6 90.4 19 19 A Q E -H 33 0B 34 14,-1.7 14,-2.9 -2,-0.1 2,-0.2 -0.994 15.4-121.3-136.3 134.6 -25.1 58.7 90.8 20 20 A P E -H 32 0B 47 0, 0.0 2,-0.5 0, 0.0 12,-0.2 -0.540 16.1-156.6 -79.8 141.2 -28.5 59.9 91.9 21 21 A V E -H 31 0B 1 10,-2.5 9,-3.5 -2,-0.2 10,-1.2 -0.980 18.3-150.5-117.3 127.4 -30.4 58.5 95.0 22 22 A Y E -H 29 0B 106 -2,-0.5 7,-0.2 154,-0.3 3,-0.0 -0.656 18.7-132.2-104.0 154.9 -34.1 59.0 95.0 23 23 A N E >>> -H 28 0B 26 5,-2.9 4,-3.0 -2,-0.2 3,-1.4 -0.922 21.8-157.6 -97.5 105.1 -36.8 59.4 97.6 24 24 A P T 345S+ 0 0 1 0, 0.0 334,-2.3 0, 0.0 298,-0.2 0.663 86.5 61.5 -60.9 -20.2 -39.4 56.8 96.3 25 25 A A T 345S+ 0 0 10 62,-0.3 334,-0.1 332,-0.2 63,-0.1 0.750 123.2 17.9 -80.1 -23.4 -42.3 58.5 98.1 26 26 A T T <45S- 0 0 54 -3,-1.4 331,-0.4 2,-0.2 -1,-0.1 0.580 93.9-126.4-118.6 -18.3 -41.9 61.8 96.2 27 27 A G T <5 + 0 0 24 -4,-3.0 2,-0.3 1,-0.3 298,-0.0 0.613 66.8 133.6 77.6 12.3 -39.8 60.8 93.2 28 28 A D E < -H 23 0B 110 -5,-0.7 -5,-2.9 1,-0.1 2,-0.4 -0.662 63.6-104.8 -96.1 153.6 -37.3 63.5 94.0 29 29 A V E -H 22 0B 74 -2,-0.3 -7,-0.3 -7,-0.2 3,-0.1 -0.602 23.2-168.5 -77.7 128.0 -33.5 63.2 94.1 30 30 A L E - 0 0 51 -9,-3.5 2,-0.3 -2,-0.4 -8,-0.2 0.880 65.7 -47.9 -82.9 -43.2 -32.1 63.0 97.7 31 31 A L E -H 21 0B 42 -10,-1.2 -10,-2.5 2,-0.0 2,-0.4 -0.959 47.6-104.7-177.5 169.7 -28.6 63.5 96.4 32 32 A E E -H 20 0B 117 -2,-0.3 2,-0.4 -12,-0.2 -14,-0.1 -0.905 33.7-166.2-106.6 133.6 -25.9 62.5 93.9 33 33 A I E -H 19 0B 2 -14,-2.9 -14,-1.7 -2,-0.4 2,-0.3 -0.986 21.4-123.8-125.0 131.7 -23.1 60.4 95.2 34 34 A A E -H 18 0B 22 -2,-0.4 -20,-0.5 -16,-0.3 -16,-0.3 -0.523 32.2-137.4 -68.8 129.2 -19.7 59.6 93.5 35 35 A E - 0 0 4 -18,-2.0 -19,-3.4 -2,-0.3 -20,-0.3 -0.333 30.4 -80.2 -84.6 170.5 -19.3 55.9 93.2 36 36 A A - 0 0 1 165,-2.5 -19,-0.2 -22,-0.3 -1,-0.1 -0.420 44.7-131.2 -66.9 141.7 -16.1 54.0 93.8 37 37 A S > - 0 0 9 -21,-0.2 4,-2.1 -2,-0.1 5,-0.2 -0.413 28.4-102.2 -83.8 171.6 -13.5 54.1 91.0 38 38 A A H > S+ 0 0 69 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.902 124.6 52.9 -59.7 -42.2 -11.9 50.9 89.7 39 39 A E H > S+ 0 0 102 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.856 107.7 51.2 -63.9 -35.5 -8.8 51.8 91.7 40 40 A Q H > S+ 0 0 14 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.884 106.8 52.6 -71.2 -37.2 -10.8 52.2 94.9 41 41 A V H X S+ 0 0 2 -4,-2.1 4,-2.1 2,-0.2 5,-0.2 0.972 112.8 46.1 -59.6 -49.1 -12.5 48.8 94.5 42 42 A D H X S+ 0 0 58 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.910 111.1 51.7 -60.3 -43.1 -9.0 47.3 94.1 43 43 A A H X S+ 0 0 29 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.860 107.9 52.8 -62.9 -33.9 -7.7 49.2 97.1 44 44 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.931 110.9 45.4 -68.8 -41.7 -10.5 48.0 99.2 45 45 A V H X S+ 0 0 0 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.932 113.6 49.9 -67.3 -42.5 -9.9 44.4 98.4 46 46 A R H X S+ 0 0 137 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.909 110.7 49.8 -62.4 -40.6 -6.1 44.8 99.0 47 47 A A H X S+ 0 0 9 -4,-2.3 4,-2.2 -5,-0.2 -1,-0.2 0.909 111.8 48.7 -65.2 -37.6 -6.7 46.5 102.4 48 48 A A H X S+ 0 0 0 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.942 111.5 49.2 -66.4 -44.7 -9.1 43.7 103.4 49 49 A D H X S+ 0 0 51 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.905 112.4 47.6 -61.0 -40.5 -6.6 41.0 102.3 50 50 A A H >< S+ 0 0 71 -4,-2.4 3,-0.6 1,-0.2 4,-0.4 0.885 111.2 51.0 -69.2 -38.6 -3.7 42.8 104.3 51 51 A A H >X S+ 0 0 16 -4,-2.2 4,-2.5 1,-0.2 3,-0.7 0.781 96.0 71.9 -68.7 -25.5 -5.9 43.1 107.4 52 52 A F H 3X S+ 0 0 26 -4,-1.7 4,-2.8 1,-0.2 5,-0.3 0.845 81.0 72.1 -59.8 -35.0 -6.8 39.4 107.2 53 53 A A H << S+ 0 0 63 -4,-0.7 -1,-0.2 -3,-0.6 -2,-0.2 0.897 115.8 21.7 -46.7 -47.2 -3.3 38.4 108.3 54 54 A E H X4 S+ 0 0 158 -3,-0.7 3,-1.4 -4,-0.4 4,-0.3 0.881 124.5 52.1 -88.5 -45.5 -4.0 39.6 111.9 55 55 A W H >< S+ 0 0 5 -4,-2.5 3,-1.7 1,-0.3 -3,-0.2 0.892 104.2 57.8 -59.6 -40.3 -7.8 39.6 112.0 56 56 A G T 3< S+ 0 0 19 -4,-2.8 -1,-0.3 1,-0.3 -2,-0.1 0.636 107.7 49.9 -66.0 -13.4 -8.0 36.0 110.8 57 57 A Q T < S+ 0 0 113 -3,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.359 84.6 114.0-104.2 -2.2 -5.9 35.1 113.8 58 58 A T S < S- 0 0 29 -3,-1.7 542,-0.1 -4,-0.3 544,-0.1 -0.261 71.0-106.5 -66.3 161.4 -8.0 36.9 116.5 59 59 A T > - 0 0 8 1,-0.1 4,-2.0 542,-0.1 5,-0.2 -0.497 24.8-114.8 -80.5 157.3 -9.8 34.9 119.2 60 60 A P H > S+ 0 0 12 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.854 116.2 60.7 -55.9 -38.3 -13.6 34.6 119.1 61 61 A K H > S+ 0 0 69 540,-0.3 4,-2.0 1,-0.2 5,-0.1 0.942 105.6 45.1 -56.5 -50.3 -13.7 36.6 122.4 62 62 A V H > S+ 0 0 47 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.920 115.3 47.1 -62.3 -40.9 -12.1 39.6 120.7 63 63 A R H X S+ 0 0 22 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.938 110.1 53.0 -66.1 -44.0 -14.3 39.4 117.6 64 64 A A H X S+ 0 0 5 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.881 106.5 54.0 -56.8 -39.8 -17.4 39.0 119.8 65 65 A E H X S+ 0 0 77 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.889 108.0 49.3 -64.4 -39.9 -16.4 42.2 121.7 66 66 A C H X S+ 0 0 17 -4,-1.7 4,-2.3 1,-0.2 -2,-0.2 0.944 110.8 50.7 -63.1 -44.9 -16.2 44.1 118.4 67 67 A L H X S+ 0 0 1 -4,-2.5 4,-2.5 1,-0.2 -2,-0.2 0.876 108.9 50.6 -62.4 -38.7 -19.6 42.8 117.4 68 68 A L H X S+ 0 0 39 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.904 109.4 51.5 -67.5 -38.3 -21.2 43.8 120.7 69 69 A K H X S+ 0 0 102 -4,-2.0 4,-2.1 2,-0.2 -2,-0.2 0.918 110.3 48.5 -62.2 -42.0 -19.7 47.3 120.3 70 70 A L H X S+ 0 0 3 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.934 109.2 53.3 -64.4 -43.6 -21.2 47.6 116.8 71 71 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.920 109.1 49.2 -56.0 -46.0 -24.5 46.4 118.1 72 72 A D H X S+ 0 0 74 -4,-2.3 4,-2.8 2,-0.2 -1,-0.2 0.893 110.1 50.7 -59.9 -42.2 -24.5 49.2 120.8 73 73 A V H X S+ 0 0 26 -4,-2.1 4,-1.5 2,-0.2 -2,-0.2 0.896 111.8 47.2 -63.1 -42.7 -23.6 51.9 118.2 74 74 A I H < S+ 0 0 0 -4,-2.5 3,-0.3 2,-0.2 7,-0.2 0.961 113.5 48.6 -63.8 -47.8 -26.4 50.8 115.9 75 75 A E H >< S+ 0 0 98 -4,-2.5 3,-1.7 1,-0.2 4,-0.2 0.926 109.8 51.0 -58.2 -47.4 -28.9 50.8 118.8 76 76 A E H 3< S+ 0 0 156 -4,-2.8 3,-0.3 1,-0.3 -1,-0.2 0.836 116.2 42.3 -59.6 -32.2 -27.8 54.2 120.1 77 77 A N T 3X S+ 0 0 42 -4,-1.5 4,-2.4 -3,-0.3 -1,-0.3 0.103 79.1 123.7-102.2 22.1 -28.3 55.6 116.6 78 78 A G H <> S+ 0 0 3 -3,-1.7 4,-2.6 1,-0.2 -1,-0.2 0.858 70.5 49.2 -50.0 -47.7 -31.5 53.7 116.0 79 79 A Q H > S+ 0 0 105 -3,-0.3 4,-2.4 -4,-0.2 -1,-0.2 0.899 111.1 49.8 -63.3 -43.5 -33.7 56.8 115.2 80 80 A V H > S+ 0 0 54 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.928 112.4 47.9 -60.5 -47.5 -31.2 58.2 112.7 81 81 A F H X S+ 0 0 1 -4,-2.4 4,-2.3 -7,-0.2 5,-0.2 0.915 111.4 50.1 -62.0 -43.1 -30.9 54.8 110.9 82 82 A A H X S+ 0 0 0 -4,-2.6 4,-2.1 -5,-0.2 -1,-0.2 0.897 110.8 50.1 -64.0 -38.9 -34.7 54.5 110.8 83 83 A E H X S+ 0 0 96 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.924 111.0 48.2 -63.3 -45.9 -35.1 58.0 109.3 84 84 A L H X S+ 0 0 14 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.932 113.1 47.5 -60.2 -45.4 -32.5 57.4 106.6 85 85 A E H X S+ 0 0 5 -4,-2.3 4,-2.5 1,-0.2 6,-0.6 0.879 111.9 50.1 -67.4 -37.0 -34.1 54.1 105.6 86 86 A S H X S+ 0 0 1 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.893 113.6 45.8 -68.5 -37.7 -37.5 55.6 105.5 87 87 A R H < S+ 0 0 98 -4,-2.4 -62,-0.3 -5,-0.2 -2,-0.2 0.916 119.6 39.6 -69.7 -42.2 -36.3 58.5 103.4 88 88 A N H < S+ 0 0 5 -4,-2.7 -2,-0.2 -5,-0.2 -3,-0.2 0.799 130.6 25.9 -77.2 -31.9 -34.4 56.2 101.0 89 89 A C H < S- 0 0 11 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.538 95.7-122.7-112.7 -13.5 -36.9 53.3 100.8 90 90 A G < + 0 0 1 -4,-1.7 -4,-0.2 -5,-0.3 -3,-0.1 0.574 54.5 155.3 79.7 9.1 -40.2 54.8 101.5 91 91 A K - 0 0 6 -6,-0.6 -1,-0.3 229,-0.1 -2,-0.1 -0.469 57.5 -95.9 -71.3 141.4 -40.9 52.5 104.5 92 92 A P >> - 0 0 8 0, 0.0 4,-2.2 0, 0.0 3,-0.6 -0.347 34.9-132.0 -51.3 130.1 -43.3 53.8 107.1 93 93 A L H 3> S+ 0 0 41 219,-2.8 4,-2.6 1,-0.2 5,-0.2 0.864 103.3 56.8 -59.7 -40.0 -41.1 55.3 109.7 94 94 A H H 3> S+ 0 0 63 218,-0.4 4,-2.5 1,-0.2 5,-0.3 0.848 109.5 46.4 -62.3 -33.6 -42.8 53.6 112.6 95 95 A S H <>>S+ 0 0 17 -3,-0.6 4,-2.3 2,-0.2 5,-1.4 0.905 110.8 50.8 -74.3 -43.8 -42.2 50.2 111.0 96 96 A A H <>S+ 0 0 1 -4,-2.2 5,-1.7 3,-0.2 -2,-0.2 0.917 119.3 37.6 -60.5 -42.3 -38.6 50.9 110.2 97 97 A F H <5S+ 0 0 68 -4,-2.6 -2,-0.2 3,-0.2 -1,-0.2 0.945 122.7 38.5 -76.5 -48.7 -38.0 52.0 113.8 98 98 A N H <5S+ 0 0 103 -4,-2.5 -3,-0.2 -5,-0.2 -2,-0.2 0.813 131.1 23.2 -75.2 -32.0 -40.2 49.6 115.8 99 99 A D T X5S+ 0 0 81 -4,-2.3 4,-1.2 -5,-0.3 -3,-0.2 0.885 125.5 37.2 -99.3 -54.2 -39.5 46.4 113.7 100 100 A E H > S+ 0 0 68 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.882 113.9 51.2 -60.8 -36.7 -34.3 46.0 117.1 103 103 A A H X S+ 0 0 36 -4,-1.2 4,-1.6 2,-0.2 -2,-0.2 0.891 110.5 48.5 -66.3 -40.3 -33.9 43.1 114.7 104 104 A I H X S+ 0 0 1 -4,-2.5 4,-1.4 2,-0.2 -1,-0.2 0.920 111.4 48.5 -65.3 -46.9 -30.8 44.5 113.3 105 105 A V H X S+ 0 0 3 -4,-2.5 4,-2.0 1,-0.2 3,-0.3 0.937 110.8 53.3 -58.6 -44.8 -29.2 45.2 116.7 106 106 A D H X S+ 0 0 16 -4,-2.3 4,-3.1 -5,-0.2 -1,-0.2 0.813 100.3 59.9 -61.8 -32.4 -30.1 41.7 117.7 107 107 A V H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -1,-0.2 0.924 108.5 44.8 -61.5 -43.2 -28.4 40.1 114.6 108 108 A F H X S+ 0 0 0 -4,-1.4 4,-1.4 -3,-0.3 -2,-0.2 0.890 114.8 47.5 -68.7 -40.7 -25.1 41.6 115.8 109 109 A R H X S+ 0 0 48 -4,-2.0 4,-1.6 2,-0.2 -2,-0.2 0.909 111.6 51.5 -67.9 -39.2 -25.6 40.6 119.4 110 110 A F H X S+ 0 0 4 -4,-3.1 4,-2.4 1,-0.2 -2,-0.2 0.939 111.9 45.1 -60.7 -48.8 -26.6 37.1 118.4 111 111 A F H X S+ 0 0 1 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.719 104.6 62.6 -71.3 -21.9 -23.6 36.5 116.2 112 112 A A H < S+ 0 0 2 -4,-1.4 4,-0.4 2,-0.2 -1,-0.2 0.932 111.2 39.9 -63.4 -43.2 -21.3 38.0 118.9 113 113 A G H >< S+ 0 0 10 -4,-1.6 3,-1.3 -3,-0.2 -2,-0.2 0.912 114.1 53.1 -70.7 -41.7 -22.5 35.1 121.1 114 114 A A H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.3 -1,-0.2 0.780 93.2 71.0 -65.7 -32.3 -22.4 32.5 118.2 115 115 A A T 3< S+ 0 0 2 -4,-1.7 3,-0.3 1,-0.3 -1,-0.3 0.786 103.0 45.1 -53.6 -28.4 -18.8 33.4 117.3 116 116 A R T < S+ 0 0 15 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.337 105.4 62.8 -98.7 5.8 -17.8 31.7 120.6 117 117 A C < + 0 0 2 -3,-1.9 2,-0.3 -4,-0.1 -1,-0.2 -0.116 63.3 151.8-124.7 35.1 -20.0 28.6 120.3 118 118 A L - 0 0 16 -3,-0.3 479,-2.8 479,-0.1 2,-0.1 -0.535 32.4-143.4 -78.4 128.1 -18.8 26.7 117.2 119 119 A N E +I 596 0C 20 -2,-0.3 477,-0.3 477,-0.3 2,-0.2 -0.345 26.5 157.2 -80.7 167.8 -19.3 22.9 117.1 120 120 A G E -I 595 0C 0 475,-2.9 475,-2.9 477,-0.1 2,-0.3 -0.850 45.6 -68.9-164.7-165.7 -17.0 20.3 115.6 121 121 A L E -I 594 0C 12 473,-0.3 13,-0.5 -2,-0.2 473,-0.3 -0.787 60.4 -91.2-101.3 151.1 -16.2 16.6 115.9 122 122 A A - 0 0 4 471,-2.3 488,-0.2 -2,-0.3 2,-0.2 -0.313 40.8-122.2 -60.1 137.3 -14.6 15.2 119.0 123 123 A A B +j 610 0D 5 486,-3.4 488,-0.7 473,-0.1 2,-0.3 -0.521 58.8 106.4 -75.4 149.4 -10.8 15.2 118.9 124 124 A G E S-T 132 0E 8 8,-2.0 8,-3.1 -2,-0.2 2,-0.9 -0.987 73.4 -52.1 166.4-172.4 -9.2 11.7 119.4 125 125 A E E + 0 0 38 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.814 47.9 157.9 -97.3 102.1 -7.5 8.7 117.8 126 126 A Y E S+ 0 0 17 -2,-0.9 2,-0.4 4,-0.5 410,-0.3 0.656 78.6 40.8 -94.8 -18.6 -9.6 7.6 114.8 127 127 A L E > S-T 130 0E 53 3,-0.7 3,-1.8 -3,-0.2 -1,-0.3 -0.996 111.1 -96.3-122.4 128.8 -6.5 5.9 113.4 128 128 A E T 3 S+ 0 0 135 -2,-0.4 -2,-0.1 1,-0.3 3,-0.1 -0.146 107.8 10.3 -45.8 131.9 -4.3 4.1 115.9 129 129 A G T 3 S+ 0 0 30 1,-0.1 345,-2.9 344,-0.1 2,-0.4 0.674 108.6 97.4 74.6 15.3 -1.4 6.3 117.0 130 130 A H E < -TU 127 473E 19 -3,-1.8 -3,-0.7 343,-0.2 2,-0.6 -0.986 59.8-148.1-137.2 129.4 -2.7 9.5 115.4 131 131 A T E - U 0 472E 2 341,-2.7 341,-3.3 -2,-0.4 2,-0.4 -0.859 18.7-166.3 -98.1 127.3 -4.6 12.3 117.1 132 132 A S E +TU 124 471E 0 -8,-3.1 -8,-2.0 -2,-0.6 2,-0.3 -0.858 8.9 177.5-108.8 145.6 -7.1 14.1 114.9 133 133 A M E - U 0 470E 3 337,-2.5 337,-2.7 -2,-0.4 2,-0.5 -0.977 20.7-135.6-140.6 157.9 -8.9 17.4 115.6 134 134 A I E - U 0 469E 2 -13,-0.5 464,-3.4 -2,-0.3 2,-0.3 -0.955 21.7-177.4-114.9 126.5 -11.4 19.6 113.6 135 135 A R E -vU 598 468E 9 333,-2.6 333,-2.5 -2,-0.5 2,-0.5 -0.771 21.2-142.1-114.6 162.6 -11.0 23.4 113.4 136 136 A R E + U 0 467E 37 462,-0.6 331,-0.2 -2,-0.3 -18,-0.1 -0.918 29.2 179.1-125.1 103.1 -13.2 26.0 111.7 137 137 A D E - U 0 466E 23 329,-2.4 329,-3.4 -2,-0.5 29,-0.1 -0.683 29.6-101.6-103.2 159.7 -11.1 28.7 110.1 138 138 A P E - U 0 465E 17 0, 0.0 327,-0.2 0, 0.0 -1,-0.1 -0.289 19.7-136.2 -73.2 163.5 -12.0 31.8 108.2 139 139 A L - 0 0 5 325,-0.7 2,-0.4 1,-0.2 326,-0.1 0.850 40.1-118.7 -88.5 -42.3 -11.8 32.0 104.4 140 140 A G S S+ 0 0 3 28,-0.1 28,-2.2 -88,-0.0 2,-0.5 -0.940 75.0 21.7 140.5-118.5 -10.2 35.4 103.9 141 141 A V E -cd 168 217A 0 75,-0.7 77,-2.5 -2,-0.4 78,-1.2 -0.795 62.6-163.8 -94.4 125.0 -11.9 38.3 102.0 142 142 A V E -cd 169 219A 0 26,-2.9 28,-2.6 -2,-0.5 2,-0.5 -0.912 6.8-152.9-106.9 130.5 -15.7 38.1 101.6 143 143 A A E -cd 170 220A 0 76,-2.7 78,-2.8 -2,-0.4 2,-0.5 -0.922 16.4-165.3-100.3 124.6 -17.4 40.4 99.0 144 144 A S E -cd 171 221A 0 26,-2.6 28,-2.9 -2,-0.5 2,-0.5 -0.947 10.4-166.5-117.1 134.6 -21.0 41.1 100.1 145 145 A I E -cd 172 222A 19 76,-2.7 78,-1.5 -2,-0.5 26,-0.1 -0.961 11.5-160.1-120.4 112.3 -23.7 42.5 97.8 146 146 A A - 0 0 6 26,-2.2 2,-0.1 -2,-0.5 6,-0.0 -0.683 11.6-129.8 -95.5 148.2 -26.8 43.8 99.6 147 147 A P - 0 0 17 0, 0.0 27,-0.4 0, 0.0 7,-0.1 -0.259 19.4-115.0 -86.8 178.8 -30.2 44.4 97.9 148 148 A W S S+ 0 0 58 1,-0.1 76,-0.0 25,-0.1 -2,-0.0 0.580 97.4 75.1 -93.9 -8.7 -32.4 47.5 98.0 149 149 A N S S+ 0 0 11 1,-0.3 -1,-0.1 2,-0.1 129,-0.1 0.897 118.2 7.6 -75.3 -38.3 -35.5 46.1 99.9 150 150 A Y S > S+ 0 0 12 1,-0.1 4,-2.6 -3,-0.1 5,-0.3 -0.636 77.7 173.8-137.2 76.0 -34.0 46.0 103.5 151 151 A P H > S+ 0 0 5 0, 0.0 4,-1.9 0, 0.0 5,-0.1 0.918 76.1 35.9 -56.2 -55.0 -30.6 47.8 103.0 152 152 A L H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 5,-0.1 0.905 118.4 50.4 -68.3 -42.9 -29.4 48.0 106.6 153 153 A M H > S+ 0 0 24 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.939 113.4 44.9 -59.8 -46.7 -30.8 44.6 107.7 154 154 A M H X S+ 0 0 9 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.854 110.4 54.7 -68.9 -33.3 -29.3 42.7 104.7 155 155 A A H >X S+ 0 0 2 -4,-1.9 4,-3.0 -5,-0.3 3,-0.5 0.950 110.3 47.5 -62.4 -44.8 -26.0 44.6 105.3 156 156 A A H 3X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.925 107.2 55.6 -59.4 -46.7 -26.2 43.2 108.9 157 157 A W H 3< S+ 0 0 6 -4,-2.8 299,-0.3 1,-0.2 -1,-0.2 0.783 116.2 37.6 -58.3 -27.1 -27.0 39.7 107.8 158 158 A K H S+ 0 0 2 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.926 116.8 53.5 -65.9 -42.8 -21.5 36.2 110.4 162 162 A A H <>S+ 0 0 0 -4,-1.2 5,-2.4 1,-0.2 4,-0.3 0.922 115.5 40.0 -57.2 -45.7 -18.6 37.0 108.1 163 163 A L H ><5S+ 0 0 1 -4,-2.6 3,-1.6 1,-0.2 -1,-0.2 0.900 111.8 55.9 -69.3 -43.7 -16.9 39.1 110.7 164 164 A A H 3<5S+ 0 0 1 -4,-2.5 -1,-0.2 -5,-0.3 -2,-0.2 0.857 105.1 54.9 -57.6 -32.9 -17.8 36.7 113.6 165 165 A A T 3<5S- 0 0 3 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.593 124.4-103.6 -78.2 -11.5 -16.1 34.0 111.6 166 166 A G T < 5S+ 0 0 0 -3,-1.6 -3,-0.2 -4,-0.3 2,-0.2 0.626 75.8 133.5 97.8 13.3 -12.8 36.0 111.4 167 167 A N < - 0 0 0 -5,-2.4 2,-0.3 -6,-0.2 -1,-0.3 -0.553 53.9-124.0 -91.1 162.2 -13.1 37.2 107.7 168 168 A C E -c 141 0A 0 -28,-2.2 -26,-2.9 -2,-0.2 2,-0.4 -0.795 31.6-146.3 -98.1 151.1 -12.5 40.6 106.3 169 169 A V E -ce 142 197A 0 27,-2.9 29,-1.7 -2,-0.3 2,-0.5 -0.940 23.2-168.0-128.7 137.0 -15.4 42.1 104.4 170 170 A V E -ce 143 198A 0 -28,-2.6 -26,-2.6 -2,-0.4 2,-0.4 -0.972 26.3-164.1-116.1 113.7 -15.9 44.4 101.4 171 171 A L E -ce 144 199A 0 27,-3.0 29,-2.9 -2,-0.5 -26,-0.2 -0.811 13.8-172.0-104.7 134.8 -19.6 45.4 101.3 172 172 A K E -c 145 0A 5 -28,-2.9 -26,-2.2 -2,-0.4 29,-0.2 -0.972 11.2-157.6-123.0 116.3 -21.5 47.0 98.4 173 173 A P - 0 0 4 0, 0.0 29,-0.4 0, 0.0 -25,-0.1 -0.315 40.4 -77.2 -79.5 171.2 -25.0 48.2 99.0 174 174 A S > - 0 0 8 -27,-0.4 3,-0.6 3,-0.3 29,-0.1 -0.424 35.1-124.9 -65.1 147.5 -27.5 48.5 96.1 175 175 A E T 3 S+ 0 0 53 1,-0.2 -1,-0.1 27,-0.2 28,-0.1 0.760 111.8 57.1 -64.0 -23.8 -27.0 51.7 94.0 176 176 A I T 3 S+ 0 0 64 1,-0.2 -154,-0.3 26,-0.1 -1,-0.2 0.803 117.5 27.0 -74.3 -36.1 -30.6 52.5 94.8 177 177 A T < + 0 0 2 -3,-0.6 -3,-0.3 1,-0.1 4,-0.3 -0.454 67.2 133.2-134.4 67.0 -30.3 52.5 98.6 178 178 A P > + 0 0 0 0, 0.0 4,-2.2 0, 0.0 5,-0.3 0.559 46.0 95.8 -90.3 -8.3 -26.9 53.3 100.0 179 179 A L H > S+ 0 0 17 1,-0.2 4,-1.9 2,-0.2 5,-0.2 0.899 86.5 42.4 -55.3 -50.3 -27.8 55.8 102.7 180 180 A T H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.864 113.7 53.1 -67.2 -32.0 -27.8 53.6 105.7 181 181 A A H > S+ 0 0 4 -4,-0.3 4,-1.9 -3,-0.2 -1,-0.2 0.886 109.5 48.0 -69.7 -37.2 -24.7 51.7 104.7 182 182 A L H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.814 110.9 50.8 -71.7 -31.2 -22.8 55.0 104.3 183 183 A K H X S+ 0 0 40 -4,-1.9 4,-2.4 -5,-0.3 -2,-0.2 0.902 110.2 50.9 -68.0 -40.2 -24.0 56.2 107.7 184 184 A L H X S+ 0 0 3 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.889 104.8 57.4 -62.4 -38.0 -22.8 52.8 109.1 185 185 A A H X S+ 0 0 0 -4,-1.9 4,-0.9 1,-0.2 -1,-0.2 0.914 108.9 45.9 -58.0 -44.0 -19.5 53.4 107.4 186 186 A E H >< S+ 0 0 66 -4,-1.5 3,-0.6 1,-0.2 4,-0.2 0.954 117.5 42.4 -63.2 -49.8 -19.1 56.6 109.4 187 187 A L H 3< S+ 0 0 41 -4,-2.4 3,-0.3 1,-0.2 -2,-0.2 0.803 118.4 43.3 -69.5 -30.1 -20.2 55.1 112.7 188 188 A A H >X S+ 0 0 10 -4,-2.6 3,-1.7 -5,-0.2 4,-0.8 0.489 78.6 108.3 -99.0 -2.3 -18.3 51.9 112.4 189 189 A K T << S+ 0 0 55 -4,-0.9 -1,-0.2 -3,-0.6 8,-0.1 0.760 88.0 32.0 -44.9 -38.3 -15.0 53.3 111.1 190 190 A D T 34 S+ 0 0 131 -3,-0.3 -1,-0.3 -4,-0.2 -2,-0.1 0.355 97.1 82.7-110.5 7.2 -13.0 52.7 114.3 191 191 A I T <4 S+ 0 0 19 -3,-1.7 -2,-0.1 2,-0.1 -1,-0.1 0.864 95.5 37.8 -80.0 -34.9 -14.6 49.7 115.8 192 192 A F S < S- 0 0 10 -4,-0.8 3,-0.1 1,-0.1 5,-0.1 -0.787 101.7 -88.5-111.8 155.8 -12.7 47.1 113.8 193 193 A P > - 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0 0 11 20,-0.5 22,-0.3 -11,-0.4 21,-0.2 -0.378 22.4-153.8 -64.2 150.2 -21.0 -19.3 140.0 490 15 B E + 0 0 127 20,-0.2 21,-0.2 19,-0.1 -1,-0.1 0.372 66.8 82.3-108.4 0.8 -19.3 -20.2 143.3 491 16 B G S S- 0 0 28 19,-3.4 21,-0.2 1,-0.2 2,-0.1 -0.067 93.3 -49.4 -91.7-165.3 -22.1 -18.8 145.5 492 17 B E - 0 0 135 19,-0.2 18,-2.0 17,-0.2 -1,-0.2 -0.372 60.4-105.7 -73.9 147.1 -25.4 -20.1 146.7 493 18 B K E -Y 509 0L 147 16,-0.2 16,-0.3 -3,-0.1 -1,-0.1 -0.448 35.9-164.0 -72.9 142.5 -27.9 -21.7 144.3 494 19 B Q E -Y 508 0L 35 14,-1.9 14,-2.8 -2,-0.1 2,-0.2 -0.984 15.9-121.8-132.7 135.7 -30.9 -19.6 143.4 495 20 B P E -Y 507 0L 47 0, 0.0 2,-0.5 0, 0.0 12,-0.2 -0.561 15.7-156.7 -80.4 142.9 -34.2 -20.6 141.8 496 21 B V E -Y 506 0L 1 10,-2.6 9,-3.6 -2,-0.2 10,-1.3 -0.981 18.1-150.4-118.4 126.7 -35.5 -19.1 138.5 497 22 B Y E -Y 504 0L 102 -2,-0.5 7,-0.2 154,-0.3 3,-0.0 -0.684 19.0-132.9-104.3 153.2 -39.2 -19.4 137.9 498 23 B N E >>> -Y 503 0L 25 5,-2.8 4,-3.0 -2,-0.3 3,-1.4 -0.909 22.3-157.2 -97.5 106.4 -41.5 -19.6 134.9 499 24 B P T 345S+ 0 0 2 0, 0.0 334,-2.3 0, 0.0 298,-0.2 0.642 86.5 63.2 -64.0 -16.5 -44.1 -17.0 135.9 500 25 B A T 345S+ 0 0 8 62,-0.3 334,-0.1 332,-0.2 63,-0.1 0.752 122.4 16.8 -80.4 -24.2 -46.8 -18.6 133.7 501 26 B T T <45S- 0 0 50 -3,-1.4 331,-0.5 2,-0.2 -1,-0.1 0.564 93.8-126.2-120.0 -19.5 -46.8 -21.8 135.7 502 27 B G T <5 + 0 0 25 -4,-3.0 2,-0.3 1,-0.3 298,-0.0 0.628 67.1 132.3 78.2 11.2 -45.1 -20.9 138.9 503 28 B D E < -Y 498 0L 105 -5,-0.7 -5,-2.8 1,-0.0 2,-0.3 -0.668 64.4-104.1 -96.0 154.4 -42.7 -23.8 138.4 504 29 B V E -Y 497 0L 72 -2,-0.3 -7,-0.3 -7,-0.2 3,-0.1 -0.592 23.0-168.5 -75.7 129.5 -38.9 -23.6 138.8 505 30 B L E - 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0 0 8 1,-0.1 4,-1.8 -408,-0.1 -408,-0.2 -0.504 24.5-115.7 -83.9 158.7 -10.5 3.4 117.7 535 60 B P H > S+ 0 0 12 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.855 116.6 59.8 -56.9 -40.3 -14.2 3.9 117.2 536 61 B K H > S+ 0 0 73 -410,-0.3 4,-2.0 2,-0.2 5,-0.1 0.933 105.8 47.1 -55.5 -49.0 -14.0 2.0 114.0 537 62 B V H > S+ 0 0 55 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.917 114.8 45.7 -60.1 -42.8 -12.7 -1.1 115.9 538 63 B R H X S+ 0 0 21 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.923 109.9 54.7 -67.9 -41.9 -15.4 -0.9 118.6 539 64 B A H X S+ 0 0 4 -4,-3.2 4,-2.3 1,-0.2 -1,-0.2 0.882 106.2 52.7 -56.0 -42.5 -18.1 -0.3 115.9 540 65 B E H X S+ 0 0 71 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.907 107.8 50.2 -64.6 -40.9 -17.0 -3.5 114.2 541 66 B C H X S+ 0 0 20 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.930 111.1 49.9 -60.9 -42.5 -17.3 -5.5 117.5 542 67 B L H X S+ 0 0 0 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.876 108.9 51.5 -64.9 -37.6 -20.8 -4.0 118.0 543 68 B L H X S+ 0 0 33 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.903 109.1 50.4 -66.2 -40.7 -21.9 -5.0 114.5 544 69 B K H X S+ 0 0 116 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.921 110.2 49.9 -64.1 -37.9 -20.8 -8.5 115.0 545 70 B L H X S+ 0 0 4 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.926 109.2 51.9 -65.7 -43.1 -22.7 -8.8 118.3 546 71 B A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.924 109.7 50.3 -55.2 -44.0 -25.8 -7.4 116.6 547 72 B D H X S+ 0 0 67 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.881 110.0 49.7 -62.5 -40.9 -25.4 -10.1 113.9 548 73 B V H X S+ 0 0 30 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.905 112.1 47.2 -67.0 -44.3 -25.0 -12.9 116.6 549 74 B I H < S+ 0 0 0 -4,-2.5 7,-0.2 2,-0.2 -2,-0.2 0.938 112.8 50.1 -60.3 -46.1 -28.1 -11.8 118.4 550 75 B E H >< S+ 0 0 101 -4,-2.5 3,-1.5 -5,-0.2 -2,-0.2 0.911 109.3 49.9 -60.3 -45.6 -30.1 -11.5 115.2 551 76 B E H 3< S+ 0 0 164 -4,-2.3 3,-0.3 1,-0.3 -1,-0.2 0.877 115.8 43.9 -61.1 -36.5 -29.0 -15.0 114.0 552 77 B N T 3X S+ 0 0 37 -4,-1.8 4,-2.5 1,-0.2 -1,-0.3 0.062 78.8 125.1 -96.4 22.9 -30.1 -16.4 117.5 553 78 B G H <> S+ 0 0 3 -3,-1.5 4,-2.7 1,-0.2 -1,-0.2 0.866 70.2 47.6 -51.0 -48.4 -33.3 -14.4 117.5 554 79 B Q H > S+ 0 0 90 -3,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.873 111.6 50.4 -63.6 -40.9 -35.7 -17.3 118.1 555 80 B V H > S+ 0 0 56 -3,-0.2 4,-2.6 2,-0.2 5,-0.2 0.956 112.4 47.2 -63.2 -48.7 -33.7 -18.8 120.9 556 81 B F H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 5,-0.2 0.923 112.0 50.3 -59.5 -45.2 -33.5 -15.5 122.7 557 82 B A H X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.899 110.6 49.6 -59.2 -42.0 -37.2 -14.9 122.2 558 83 B E H X S+ 0 0 98 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.915 111.0 48.8 -65.9 -42.9 -38.1 -18.4 123.6 559 84 B L H X S+ 0 0 17 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.928 112.9 47.2 -61.2 -45.2 -35.8 -17.9 126.7 560 85 B E H X S+ 0 0 5 -4,-2.3 4,-2.7 -5,-0.2 6,-0.6 0.902 112.3 50.4 -66.0 -39.7 -37.3 -14.5 127.4 561 86 B S H X S+ 0 0 8 -4,-2.3 4,-1.9 -5,-0.2 -1,-0.2 0.896 113.5 45.0 -63.6 -41.2 -40.9 -15.8 127.0 562 87 B R H < S+ 0 0 123 -4,-2.4 -62,-0.3 1,-0.2 -2,-0.2 0.896 119.7 41.0 -70.6 -39.8 -40.2 -18.8 129.3 563 88 B N H < S+ 0 0 4 -4,-2.6 -2,-0.2 -5,-0.2 -1,-0.2 0.822 129.6 25.8 -78.1 -33.1 -38.5 -16.6 132.0 564 89 B C H < S- 0 0 13 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.574 95.9-122.9-109.8 -11.8 -40.8 -13.6 131.8 565 90 B G < + 0 0 1 -4,-1.9 -4,-0.2 -5,-0.3 -3,-0.1 0.593 54.9 156.0 78.8 9.9 -44.1 -15.0 130.6 566 91 B K - 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0 0 2 -4,-1.6 2,-1.3 1,-0.1 -28,-0.1 -0.472 62.5-141.6 -68.5 134.4 -1.9 26.7 106.8 1851 426 D Q + 0 0 51 -2,-0.2 2,-0.3 -22,-0.1 21,-0.2 -0.456 63.7 111.8 -94.4 62.2 -4.7 27.4 104.4 1852 427 D Y S S- 0 0 2 -2,-1.3 -21,-0.3 -21,-0.1 -20,-0.1 -0.987 73.9-124.6-136.7 141.7 -5.4 23.8 103.5 1853 428 D G S S+ 0 0 0 -23,-2.3 -1384,-2.4 -2,-0.3 2,-0.4 0.763 98.5 27.9 -59.1 -28.8 -8.3 21.5 104.3 1854 429 D C E -wc 4691832E 4 -23,-0.8 -21,-0.6 -1386,-0.2 2,-0.4 -0.995 62.1-173.7-134.1 141.8 -6.1 19.0 105.9 1855 430 D T E -wc 4701833E 0 -1386,-2.4 -1384,-2.2 -2,-0.4 2,-0.3 -0.955 8.4-164.1-132.5 117.1 -2.7 19.3 107.7 1856 431 D W E -wc 4711834E 0 -23,-2.5 -21,-2.2 -2,-0.4 2,-0.5 -0.771 10.7-145.3 -93.8 147.6 -0.8 16.1 108.8 1857 432 D V E S-wc 4721835E 0 -1386,-2.7 -1384,-2.3 -2,-0.3 -21,-0.2 -0.959 78.7 -11.4-116.1 121.3 2.0 16.5 111.3 1858 433 D N S S+ 0 0 23 -23,-2.6 2,-0.3 -2,-0.5 -1,-0.2 0.772 133.3 48.7 62.3 27.7 4.9 14.1 111.0 1859 434 D T - 0 0 9 -24,-0.3 2,-0.3 -1388,-0.1 -1,-0.2 -0.910 66.8-156.8-165.3-170.6 3.1 12.0 108.4 1860 435 D H + 0 0 1 -2,-0.3 -26,-0.1 -3,-0.1 -153,-0.1 -0.956 61.3 35.5-166.4 161.5 1.1 12.6 105.3 1861 436 D F + 0 0 28 -2,-0.3 2,-0.6 -155,-0.2 -155,-0.1 0.480 69.3 138.1 73.9 3.0 -1.6 10.9 103.2 1862 437 D M + 0 0 51 -1391,-0.1 2,-0.4 -1735,-0.0 -1,-0.2 -0.778 25.4 178.0 -91.9 123.8 -3.7 9.2 105.9 1863 438 D L - 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0 0 14 -2,-0.3 2,-0.3 -7,-0.3 -7,-0.3 -0.007 69.9-100.7 92.7 154.5 -17.5 20.7 100.1 1879 454 D K - 0 0 14 5,-0.3 2,-0.4 -9,-0.1 -9,-0.2 -0.851 16.0-149.2-115.9 147.6 -16.3 17.7 102.1 1880 455 D D B S+J 1869 0b 1 -11,-3.2 -11,-1.9 -2,-0.3 5,-0.1 -0.875 71.3 6.3-105.2 150.8 -15.9 14.0 101.3 1881 456 D M S > S+ 0 0 10 -2,-0.4 4,-0.7 -299,-0.3 -12,-0.3 0.191 94.6 67.4 59.0 169.1 -16.2 11.6 104.2 1882 457 D S H >> S- 0 0 0 -17,-2.4 4,-1.1 2,-0.2 3,-0.8 0.205 102.2 -69.5 72.9 168.4 -17.3 12.5 107.8 1883 458 D L H 3> S+ 0 0 7 -17,-0.5 4,-2.4 1,-0.2 3,-0.2 0.806 134.0 62.2 -58.8 -29.3 -20.6 13.8 109.0 1884 459 D Y H 3> S+ 0 0 18 1,-0.2 4,-1.7 2,-0.2 -5,-0.3 0.850 97.8 56.6 -67.9 -30.3 -19.9 17.0 107.1 1885 460 D G H << S+ 0 0 0 -3,-0.8 4,-0.2 -4,-0.7 -1,-0.2 0.851 109.3 46.5 -66.9 -31.5 -19.8 15.0 103.9 1886 461 D L H >< S+ 0 0 0 -4,-1.1 3,-2.0 -3,-0.2 -2,-0.2 0.937 107.7 55.7 -73.9 -46.7 -23.3 13.8 104.8 1887 462 D E H >< S+ 0 0 37 -4,-2.4 3,-1.9 1,-0.3 -2,-0.2 0.808 95.1 67.7 -53.3 -38.2 -24.5 17.3 105.7 1888 463 D D T 3< S+ 0 0 51 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.684 97.4 55.0 -57.3 -21.0 -23.5 18.6 102.2 1889 464 D Y T < S+ 0 0 0 -3,-2.0 -325,-0.7 -4,-0.2 2,-0.3 0.150 102.9 64.0-102.6 19.2 -26.2 16.5 100.6 1890 465 D T E < S- M 01563F 9 -3,-1.9 2,-0.4 -327,-0.2 -299,-0.1 -0.862 71.7-130.1-132.0 166.3 -29.1 17.9 102.7 1891 466 D V E - M 01562F 3 -329,-3.3 -329,-2.3 -2,-0.3 2,-0.3 -0.979 23.2-128.5-118.4 134.0 -30.9 21.2 103.1 1892 467 D V E - M 01561F 9 -2,-0.4 2,-0.4 -331,-0.2 -331,-0.2 -0.639 29.8-166.5 -76.9 136.0 -31.5 22.6 106.6 1893 468 D R E - M 01560F 1 -333,-2.7 -333,-2.3 -2,-0.3 2,-0.5 -0.982 14.6-147.3-127.5 142.2 -35.2 23.6 107.1 1894 469 D H E -jM 4291559F 2 -1466,-2.8 -1464,-2.5 -2,-0.4 2,-0.5 -0.920 13.2-172.4-107.6 122.4 -36.9 25.6 109.8 1895 470 D V E -jM 4301558F 2 -337,-2.8 -337,-2.2 -2,-0.5 2,-0.5 -0.976 5.3-173.5-113.5 128.3 -40.5 24.7 110.8 1896 471 D M E -jM 4311557F 0 -1466,-2.5 -1464,-3.0 -2,-0.5 2,-0.6 -0.979 6.4-161.9-130.5 118.7 -42.2 27.1 113.2 1897 472 D V E -jM 4321556F 2 -341,-3.0 -341,-2.3 -2,-0.5 2,-0.3 -0.886 12.7-141.8-105.2 119.9 -45.6 26.3 114.7 1898 473 D K E M 01555F 92 -1466,-2.6 -343,-0.2 -2,-0.6 -1004,-0.1 -0.592 360.0 360.0 -75.7 132.2 -47.7 29.1 116.2 1899 474 D H 0 0 47 -345,-2.8 -1,-0.2 -2,-0.3 -344,-0.1 0.524 360.0 360.0-136.1 360.0 -49.4 27.9 119.2