==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER LYASE 14-JUN-07 2Q9Y . COMPND 2 MOLECULE: TRICHODIENE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: FUSARIUM SPOROTRICHIOIDES; . AUTHOR L.S.VEDULA,Y.ZHAO,R.M.COATES,T.KOYAMA,D.E.CANE, . 704 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27932.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 534 75.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 22 3.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 95 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 400 56.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 1 5 3 0 5 1 0 1 0 1 1 1 1 5 1 1 2 1 1 1 0 0 1 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 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 3 A N 0 0 198 0, 0.0 3,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 162.9 -33.3 20.9 55.0 2 4 A F - 0 0 36 1,-0.1 2,-3.3 230,-0.0 3,-0.2 0.647 360.0-120.4 108.9 103.6 -35.5 22.3 52.1 3 5 A P > + 0 0 19 0, 0.0 4,-3.7 0, 0.0 5,-0.3 -0.220 45.7 160.0 -61.2 56.1 -34.4 24.7 49.3 4 6 A T H > S+ 0 0 30 -2,-3.3 4,-1.7 1,-0.2 5,-0.1 0.849 77.2 41.0 -50.3 -40.2 -36.9 27.5 50.2 5 7 A E H > S+ 0 0 154 -3,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.933 117.2 46.8 -74.6 -47.5 -34.9 30.0 48.2 6 8 A Y H > S+ 0 0 78 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.871 111.7 52.0 -62.3 -39.5 -34.1 27.8 45.3 7 9 A F H X S+ 0 0 8 -4,-3.7 4,-2.7 1,-0.2 5,-0.2 0.972 108.3 51.6 -61.1 -53.1 -37.7 26.7 45.1 8 10 A L H X S+ 0 0 3 -4,-1.7 4,-2.1 -5,-0.3 -2,-0.2 0.873 108.8 50.6 -50.8 -46.0 -38.9 30.3 45.0 9 11 A N H X S+ 0 0 52 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.959 112.4 45.7 -58.8 -52.5 -36.5 31.2 42.2 10 12 A T H X S+ 0 0 3 -4,-2.1 4,-2.6 1,-0.2 -2,-0.2 0.865 111.5 53.3 -59.0 -39.6 -37.7 28.2 40.0 11 13 A T H X S+ 0 0 4 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.889 110.2 46.1 -64.9 -40.5 -41.3 29.0 40.7 12 14 A V H X S+ 0 0 3 -4,-2.1 4,-2.2 -5,-0.2 -2,-0.2 0.881 112.3 51.1 -70.8 -37.5 -41.0 32.6 39.6 13 15 A R H X S+ 0 0 77 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.971 111.3 47.2 -62.4 -54.3 -39.1 31.6 36.5 14 16 A L H X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 6,-0.3 0.916 113.6 48.7 -52.7 -47.8 -41.7 29.1 35.5 15 17 A L H <>S+ 0 0 2 -4,-2.1 5,-2.3 -5,-0.2 -1,-0.2 0.856 112.4 49.3 -61.3 -37.0 -44.5 31.6 36.2 16 18 A E H ><5S+ 0 0 83 -4,-2.2 3,-2.3 3,-0.2 -2,-0.2 0.990 109.3 50.3 -64.9 -62.3 -42.7 34.2 34.1 17 19 A Y H 3<5S+ 0 0 84 -4,-2.8 -2,-0.2 1,-0.3 -3,-0.1 0.894 111.8 45.5 -40.7 -61.8 -42.1 32.0 31.1 18 20 A I T 3<5S- 0 0 0 -4,-2.0 -1,-0.3 -5,-0.2 3,-0.2 0.538 113.9-120.7 -65.5 -4.1 -45.7 30.8 30.7 19 21 A R T < 5 - 0 0 111 -3,-2.3 -3,-0.2 1,-0.2 -2,-0.1 0.764 30.1-154.8 71.0 26.2 -46.7 34.4 31.2 20 22 A Y < + 0 0 13 -5,-2.3 2,-0.2 -6,-0.3 -1,-0.2 -0.038 40.7 130.4 -36.8 110.5 -48.7 33.6 34.3 21 23 A R - 0 0 111 -3,-0.2 2,-0.4 308,-0.0 -1,-0.1 -0.761 52.5 -27.7-149.5-164.2 -51.2 36.5 34.2 22 24 A D - 0 0 126 -2,-0.2 2,-0.1 2,-0.1 308,-0.0 -0.417 51.3-156.4 -64.0 109.9 -54.6 38.0 34.3 23 25 A S - 0 0 45 -2,-0.4 -1,-0.0 2,-0.1 265,-0.0 -0.283 20.2-133.7 -78.1 170.0 -57.3 35.5 33.1 24 26 A N S S+ 0 0 155 2,-0.1 2,-0.9 -2,-0.1 -1,-0.1 0.244 72.6 118.3-106.7 9.1 -60.6 36.9 31.7 25 27 A Y - 0 0 23 49,-0.1 2,-0.2 4,-0.0 -2,-0.1 -0.677 61.4-141.7 -80.0 103.7 -62.3 34.2 33.9 26 28 A T >> - 0 0 53 -2,-0.9 4,-2.3 1,-0.1 3,-1.7 -0.465 13.5-126.1 -76.0 137.6 -64.5 36.1 36.4 27 29 A R H 3> S+ 0 0 79 1,-0.3 4,-1.6 2,-0.2 -1,-0.1 0.743 113.0 56.5 -49.3 -29.3 -64.8 34.8 40.0 28 30 A E H 3> S+ 0 0 134 2,-0.2 4,-1.1 1,-0.2 -1,-0.3 0.862 110.1 45.6 -72.8 -32.7 -68.6 34.8 39.6 29 31 A E H <> S+ 0 0 77 -3,-1.7 4,-2.5 2,-0.2 5,-0.3 0.884 106.0 58.7 -74.2 -42.0 -68.1 32.5 36.6 30 32 A R H X S+ 0 0 4 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.920 108.9 46.7 -52.3 -45.8 -65.6 30.3 38.4 31 33 A I H X S+ 0 0 34 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.810 106.6 57.0 -68.3 -31.2 -68.3 29.7 41.0 32 34 A E H X S+ 0 0 95 -4,-1.1 4,-1.9 2,-0.2 -1,-0.2 0.955 115.4 38.0 -63.0 -48.6 -71.0 28.9 38.4 33 35 A N H X S+ 0 0 20 -4,-2.5 4,-2.6 2,-0.2 5,-0.4 0.881 111.3 57.0 -69.9 -42.8 -68.8 26.2 37.0 34 36 A L H X S+ 0 0 2 -4,-2.9 4,-2.3 -5,-0.3 5,-0.2 0.950 113.5 41.5 -55.2 -48.3 -67.5 24.9 40.3 35 37 A H H X S+ 0 0 51 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.877 113.0 53.4 -68.9 -36.9 -71.1 24.3 41.4 36 38 A Y H X S+ 0 0 81 -4,-1.9 4,-2.1 -5,-0.2 -2,-0.2 0.953 115.6 38.4 -62.6 -50.5 -72.3 22.9 38.1 37 39 A A H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.979 116.7 49.8 -64.0 -58.4 -69.5 20.3 37.9 38 40 A Y H X S+ 0 0 0 -4,-2.3 4,-3.3 -5,-0.4 5,-0.3 0.929 111.6 51.7 -46.9 -50.9 -69.5 19.4 41.6 39 41 A N H X S+ 0 0 50 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.893 109.7 45.1 -55.6 -49.1 -73.3 19.0 41.5 40 42 A K H X S+ 0 0 52 -4,-2.1 4,-1.3 -5,-0.2 -1,-0.2 0.927 118.5 45.5 -63.0 -41.7 -73.6 16.6 38.5 41 43 A A H >X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 3,-0.6 0.953 109.6 51.4 -64.4 -56.4 -70.7 14.5 40.0 42 44 A A H 3X S+ 0 0 0 -4,-3.3 4,-1.0 -5,-0.3 -1,-0.2 0.910 111.3 50.4 -49.9 -43.5 -71.9 14.4 43.6 43 45 A H H 3< S+ 0 0 95 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.845 112.4 48.7 -63.9 -32.3 -75.3 13.2 42.2 44 46 A H H X< S+ 0 0 21 -4,-1.3 3,-2.4 -3,-0.6 6,-0.3 0.985 112.2 43.8 -69.0 -62.2 -73.4 10.6 40.2 45 47 A F H 3< S+ 0 0 3 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.601 107.1 63.9 -61.6 -11.3 -71.2 9.2 42.9 46 48 A A T 3< S+ 0 0 10 -4,-1.0 -1,-0.3 -5,-0.4 -2,-0.2 0.515 76.8 110.4 -89.9 -6.9 -74.2 9.2 45.3 47 49 A Q S <> S- 0 0 84 -3,-2.4 4,-2.9 -4,-0.1 5,-0.1 -0.361 78.1-123.4 -64.4 149.7 -76.0 6.7 43.1 48 50 A P H > S+ 0 0 101 0, 0.0 4,-2.8 0, 0.0 5,-0.3 0.936 108.7 52.3 -63.9 -46.9 -76.3 3.3 44.8 49 51 A R H > S+ 0 0 71 1,-0.2 4,-1.9 2,-0.2 3,-0.3 0.966 115.7 42.9 -51.9 -53.2 -74.5 1.2 42.1 50 52 A Q H > S+ 0 0 9 -6,-0.3 4,-2.0 1,-0.2 3,-0.5 0.956 112.7 54.8 -55.6 -50.7 -71.6 3.7 42.3 51 53 A Q H < S+ 0 0 84 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.821 114.4 38.3 -53.9 -35.9 -71.9 3.7 46.1 52 54 A Q H < S+ 0 0 132 -4,-2.8 -1,-0.2 -3,-0.3 -2,-0.2 0.670 118.3 45.6 -95.1 -14.9 -71.5 -0.1 46.4 53 55 A L H < S+ 0 0 37 -4,-1.9 2,-0.7 -3,-0.5 -2,-0.2 0.623 97.7 74.7-100.7 -14.0 -69.0 -0.8 43.7 54 56 A L < - 0 0 19 -4,-2.0 2,-1.2 -5,-0.2 -1,-0.1 -0.864 69.8-152.2-104.8 109.7 -66.5 2.0 44.4 55 57 A K + 0 0 158 -2,-0.7 2,-0.3 -3,-0.0 44,-0.1 -0.681 43.7 128.9 -84.8 99.6 -64.4 1.3 47.5 56 58 A V - 0 0 25 -2,-1.2 -2,-0.1 -5,-0.2 5,-0.0 -0.972 64.2-108.8-150.8 133.2 -63.5 4.7 48.9 57 59 A D >> - 0 0 87 -2,-0.3 4,-1.8 1,-0.1 3,-1.4 -0.483 36.1-124.0 -64.0 124.9 -63.8 6.1 52.4 58 60 A P H 3> S+ 0 0 86 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.769 107.3 53.0 -38.0 -44.2 -66.6 8.7 52.1 59 61 A K H 3> S+ 0 0 169 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.860 110.3 46.0 -67.0 -35.8 -64.4 11.6 53.4 60 62 A R H <> S+ 0 0 129 -3,-1.4 4,-2.9 2,-0.2 -1,-0.2 0.815 111.7 52.6 -75.8 -30.2 -61.6 11.0 50.9 61 63 A L H X S+ 0 0 13 -4,-1.8 4,-3.1 2,-0.2 5,-0.3 0.940 110.0 48.7 -67.2 -46.1 -64.1 10.7 48.1 62 64 A Q H X S+ 0 0 35 -4,-2.3 4,-1.6 -5,-0.2 -2,-0.2 0.943 116.2 42.9 -57.0 -50.5 -65.6 14.0 49.1 63 65 A A H X S+ 0 0 49 -4,-2.0 4,-2.7 1,-0.2 -2,-0.2 0.912 114.3 50.4 -64.4 -44.0 -62.2 15.6 49.3 64 66 A S H X S+ 0 0 12 -4,-2.9 4,-2.5 1,-0.2 -2,-0.2 0.929 107.9 51.5 -60.5 -49.6 -61.0 14.0 46.0 65 67 A L H X S+ 0 0 0 -4,-3.1 4,-2.8 1,-0.2 -1,-0.2 0.881 112.2 49.4 -56.7 -38.7 -64.0 15.1 44.0 66 68 A Q H X S+ 0 0 45 -4,-1.6 4,-2.4 -5,-0.3 5,-0.2 0.960 108.1 49.8 -67.5 -51.9 -63.5 18.6 45.2 67 69 A T H X S+ 0 0 14 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.914 115.9 47.1 -52.4 -41.3 -59.8 18.8 44.4 68 70 A I H X S+ 0 0 11 -4,-2.5 4,-3.3 2,-0.2 5,-0.2 0.955 107.1 51.4 -66.5 -55.8 -60.7 17.5 41.0 69 71 A V H X S+ 0 0 0 -4,-2.8 4,-2.6 1,-0.2 5,-0.4 0.914 113.1 50.2 -48.0 -44.2 -63.6 19.8 40.2 70 72 A G H X S+ 0 0 8 -4,-2.4 4,-2.1 -5,-0.2 -1,-0.2 0.954 110.8 47.6 -59.5 -50.2 -61.3 22.6 41.1 71 73 A M H X S+ 0 0 22 -4,-2.3 4,-0.9 -5,-0.2 -2,-0.2 0.922 117.4 42.3 -58.0 -46.6 -58.5 21.3 38.8 72 74 A V H >X S+ 0 0 0 -4,-3.3 4,-3.7 2,-0.2 3,-1.1 0.986 115.0 45.9 -65.9 -59.2 -60.9 20.8 35.9 73 75 A V H 3< S+ 0 0 0 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.841 116.2 47.0 -53.4 -39.4 -62.9 24.0 36.1 74 76 A Y H 3< S+ 0 0 14 -4,-2.1 -1,-0.3 -5,-0.4 -2,-0.2 0.669 123.6 32.1 -78.5 -17.6 -59.8 26.1 36.6 75 77 A S H << S+ 0 0 2 -3,-1.1 3,-0.2 -4,-0.9 -2,-0.2 0.726 113.7 52.4-111.3 -30.0 -57.9 24.5 33.7 76 78 A W S >< S+ 0 0 3 -4,-3.7 3,-2.7 -5,-0.2 -1,-0.1 -0.134 70.8 152.3 -98.4 37.0 -60.4 23.5 31.1 77 79 A A T 3 + 0 0 19 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.671 63.7 51.3 -38.0 -32.9 -61.6 27.1 31.2 78 80 A K T 3 S+ 0 0 78 -3,-0.2 -1,-0.3 207,-0.1 2,-0.2 0.427 89.2 92.7 -95.2 1.7 -62.9 27.1 27.6 79 81 A V S < S- 0 0 13 -3,-2.7 5,-0.1 1,-0.2 114,-0.0 -0.505 82.5 -89.9 -92.5 165.1 -65.0 23.9 27.5 80 82 A S > - 0 0 40 -2,-0.2 4,-1.9 1,-0.1 5,-0.2 -0.094 36.0-107.9 -66.1 169.3 -68.8 23.7 28.2 81 83 A K H > S+ 0 0 86 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.929 120.9 50.8 -64.7 -45.9 -70.3 23.1 31.6 82 84 A E H > S+ 0 0 62 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.952 108.2 53.9 -56.7 -47.0 -71.3 19.6 30.8 83 85 A C H > S+ 0 0 1 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.896 109.2 46.6 -53.8 -45.6 -67.7 18.9 29.6 84 86 A M H X S+ 0 0 2 -4,-1.9 4,-1.7 2,-0.2 -1,-0.2 0.909 113.8 51.1 -62.9 -41.6 -66.2 20.1 32.8 85 87 A A H X S+ 0 0 0 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.967 112.7 42.7 -59.5 -58.0 -68.8 18.0 34.7 86 88 A D H X S+ 0 0 1 -4,-3.1 4,-1.8 1,-0.2 -2,-0.2 0.867 114.7 49.5 -61.1 -38.2 -68.2 14.8 32.8 87 89 A L H X S+ 0 0 1 -4,-2.4 4,-2.3 -5,-0.3 -1,-0.2 0.820 106.5 58.8 -69.2 -29.5 -64.3 15.2 32.9 88 90 A S H X S+ 0 0 0 -4,-1.7 4,-1.1 -5,-0.2 -1,-0.2 0.855 106.1 47.7 -66.6 -34.7 -64.7 15.8 36.6 89 91 A I H X S+ 0 0 2 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.910 113.8 46.2 -71.8 -43.5 -66.3 12.4 37.1 90 92 A H H X S+ 0 0 1 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.841 114.1 47.5 -69.0 -36.2 -63.7 10.6 35.0 91 93 A Y H X S+ 0 0 7 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.774 108.8 54.2 -79.7 -21.8 -60.8 12.3 36.7 92 94 A T H X S+ 0 0 0 -4,-1.1 4,-2.2 -5,-0.2 -2,-0.2 0.894 106.3 53.8 -75.5 -37.2 -62.3 11.6 40.2 93 95 A Y H X S+ 0 0 0 -4,-1.9 4,-1.3 2,-0.2 -2,-0.2 0.975 109.4 47.3 -56.2 -57.4 -62.5 7.9 39.3 94 96 A T H >< S+ 0 0 4 -4,-1.8 3,-0.8 1,-0.2 4,-0.4 0.912 112.0 48.7 -50.9 -50.7 -58.8 7.8 38.4 95 97 A L H >< S+ 0 0 44 -4,-1.8 3,-1.2 1,-0.2 -1,-0.2 0.881 107.6 57.3 -59.4 -37.5 -57.7 9.6 41.5 96 98 A V H >< S+ 0 0 5 -4,-2.2 3,-1.6 1,-0.2 4,-0.4 0.775 91.4 70.7 -66.3 -25.7 -59.8 7.3 43.6 97 99 A L G X< S+ 0 0 11 -4,-1.3 3,-0.7 -3,-0.8 -1,-0.2 0.674 84.7 69.0 -66.9 -16.8 -58.0 4.2 42.3 98 100 A D G < S+ 0 0 76 -3,-1.2 -1,-0.3 -4,-0.4 -2,-0.2 0.627 89.9 62.7 -76.8 -11.4 -54.9 5.1 44.2 99 101 A D G < S+ 0 0 57 -3,-1.6 2,-0.3 -4,-0.2 -1,-0.2 0.697 85.4 95.0 -82.5 -19.5 -56.7 4.3 47.4 100 102 A S < + 0 0 38 -3,-0.7 -44,-0.0 -4,-0.4 -3,-0.0 -0.578 43.6 173.5 -77.8 130.0 -57.1 0.7 46.3 101 103 A K + 0 0 175 -2,-0.3 -1,-0.1 2,-0.1 2,-0.1 0.456 40.6 122.8-111.2 -8.2 -54.4 -1.6 47.6 102 104 A D S S- 0 0 112 1,-0.1 61,-0.1 2,-0.1 -2,-0.1 -0.299 71.6-105.8 -63.7 134.3 -56.0 -4.7 46.1 103 105 A D - 0 0 62 1,-0.1 4,-0.4 -2,-0.1 -1,-0.1 -0.418 21.2-155.4 -62.6 120.9 -54.1 -7.0 43.7 104 106 A P S >> S+ 0 0 5 0, 0.0 4,-2.5 0, 0.0 3,-0.5 0.703 75.0 90.2 -69.5 -21.7 -55.3 -6.5 40.1 105 107 A Y H 3> S+ 0 0 52 1,-0.2 4,-1.1 2,-0.2 3,-0.2 0.886 84.1 45.5 -42.8 -62.9 -54.0 -10.0 39.1 106 108 A P H 34 S+ 0 0 82 0, 0.0 4,-0.2 0, 0.0 -1,-0.2 0.828 120.4 40.7 -54.6 -36.6 -57.2 -12.1 39.9 107 109 A T H <4 S+ 0 0 36 -3,-0.5 15,-0.5 -4,-0.4 16,-0.4 0.732 113.3 53.5 -86.5 -23.8 -59.5 -9.6 38.2 108 110 A M H >< S+ 0 0 6 -4,-2.5 3,-1.7 -3,-0.2 4,-0.3 0.558 82.5 91.6 -86.7 -8.6 -57.2 -8.9 35.3 109 111 A V T 3< S+ 0 0 69 -4,-1.1 -1,-0.2 1,-0.3 -2,-0.1 0.840 100.7 27.4 -54.5 -39.7 -56.8 -12.6 34.4 110 112 A N T 3> S+ 0 0 86 -3,-0.4 4,-2.2 -4,-0.2 5,-0.4 0.010 85.9 124.5-113.3 28.3 -59.8 -12.5 32.0 111 113 A Y H <> S+ 0 0 19 -3,-1.7 4,-2.1 1,-0.2 5,-0.1 0.952 76.1 39.3 -50.0 -64.3 -59.5 -8.8 31.1 112 114 A F H > S+ 0 0 9 -4,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.820 115.2 51.2 -60.1 -36.4 -59.2 -9.2 27.3 113 115 A D H > S+ 0 0 70 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.910 111.6 44.5 -72.6 -40.3 -61.7 -12.0 26.9 114 116 A D H X>S+ 0 0 27 -4,-2.2 5,-2.7 2,-0.2 4,-1.4 0.930 115.3 52.2 -66.7 -41.2 -64.5 -10.4 28.8 115 117 A L H ><5S+ 0 0 18 -4,-2.1 3,-0.9 -5,-0.4 -2,-0.2 0.952 111.1 43.6 -56.3 -57.6 -63.7 -7.2 26.9 116 118 A Q H 3<5S+ 0 0 65 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.768 117.5 49.1 -62.1 -24.8 -63.8 -8.8 23.4 117 119 A A H 3<5S- 0 0 47 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.645 111.1-119.8 -89.4 -17.0 -67.0 -10.6 24.5 118 120 A G T <<5 + 0 0 31 -4,-1.4 2,-0.3 -3,-0.9 -3,-0.2 0.747 62.1 145.9 83.2 23.3 -68.7 -7.5 25.9 119 121 A R < - 0 0 135 -5,-2.7 -1,-0.3 -6,-0.2 -2,-0.1 -0.757 59.1 -94.6 -95.7 141.9 -69.0 -9.0 29.4 120 122 A E - 0 0 127 -2,-0.3 -1,-0.1 1,-0.1 7,-0.1 -0.241 49.1-105.9 -54.3 134.7 -68.8 -6.7 32.5 121 123 A Q - 0 0 14 1,-0.1 -1,-0.1 2,-0.1 6,-0.1 -0.183 14.3-133.4 -62.1 156.8 -65.2 -6.5 33.9 122 124 A A S S+ 0 0 56 -15,-0.5 -14,-0.1 4,-0.0 -1,-0.1 0.937 90.2 75.9 -75.7 -52.5 -64.3 -8.3 37.1 123 125 A H S >> S- 0 0 18 -16,-0.4 4,-1.8 1,-0.2 3,-0.8 -0.493 79.6-144.3 -64.4 115.9 -62.4 -5.4 38.6 124 126 A P H 3> S+ 0 0 50 0, 0.0 4,-2.3 0, 0.0 5,-0.3 0.811 96.3 61.7 -52.1 -36.9 -65.2 -3.0 39.8 125 127 A W H 3> S+ 0 0 6 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.919 107.5 45.2 -58.5 -42.7 -63.2 0.1 38.9 126 128 A W H <> S+ 0 0 6 -3,-0.8 4,-3.1 2,-0.2 5,-0.4 0.936 108.6 56.2 -65.7 -45.1 -63.2 -1.0 35.3 127 129 A A H X S+ 0 0 7 -4,-1.8 4,-0.8 1,-0.2 -2,-0.2 0.897 115.5 37.4 -53.4 -44.7 -66.9 -1.9 35.4 128 130 A L H X S+ 0 0 0 -4,-2.3 4,-1.9 2,-0.2 5,-0.2 0.952 118.3 48.1 -73.0 -51.8 -67.8 1.7 36.5 129 131 A V H X S+ 0 0 0 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.904 114.2 45.3 -58.0 -46.8 -65.2 3.5 34.4 130 132 A N H < S+ 0 0 9 -4,-3.1 -1,-0.2 -5,-0.2 -2,-0.2 0.775 112.9 51.9 -70.1 -24.6 -66.0 1.7 31.2 131 133 A E H < S+ 0 0 87 -4,-0.8 -1,-0.2 -5,-0.4 -2,-0.2 0.799 115.8 40.2 -80.1 -29.6 -69.7 2.1 31.8 132 134 A H H >< S+ 0 0 14 -4,-1.9 3,-1.5 1,-0.1 4,-0.3 0.737 92.2 87.9 -89.1 -27.5 -69.4 5.8 32.3 133 135 A F T >X S+ 0 0 2 -4,-2.1 4,-3.0 1,-0.3 3,-2.7 0.788 78.5 61.6 -43.0 -45.1 -66.8 6.6 29.6 134 136 A P H 3> S+ 0 0 45 0, 0.0 4,-2.1 0, 0.0 -1,-0.3 0.908 96.6 62.5 -51.3 -39.9 -69.4 7.1 26.8 135 137 A N H <4 S+ 0 0 54 -3,-1.5 -2,-0.2 1,-0.2 -49,-0.1 0.641 114.8 33.7 -56.2 -19.8 -70.7 10.0 28.9 136 138 A V H X4 S+ 0 0 1 -3,-2.7 3,-1.7 -4,-0.3 -1,-0.2 0.793 112.8 55.4-104.9 -47.6 -67.2 11.5 28.4 137 139 A L H >< S+ 0 0 13 -4,-3.0 3,-2.7 1,-0.3 -2,-0.2 0.772 89.8 75.9 -61.9 -27.4 -66.1 10.5 25.0 138 140 A R T 3< S+ 0 0 115 -4,-2.1 -1,-0.3 -5,-0.3 -3,-0.1 0.656 88.3 63.0 -59.2 -16.0 -69.2 11.9 23.3 139 141 A H T < S+ 0 0 10 -3,-1.7 57,-2.6 -5,-0.1 58,-0.5 0.592 104.0 57.2 -84.1 -12.0 -67.6 15.3 23.8 140 142 A F S < S- 0 0 8 -3,-2.7 52,-0.1 55,-0.3 51,-0.0 -0.765 79.7-112.4-123.6 166.4 -64.7 14.3 21.5 141 143 A G > - 0 0 6 53,-0.4 4,-2.1 -2,-0.3 5,-0.2 -0.265 47.8 -92.2 -81.3 175.7 -63.9 13.2 18.0 142 144 A P H > S+ 0 0 12 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.943 121.8 49.7 -58.4 -51.7 -62.5 9.7 17.3 143 145 A F H > S+ 0 0 1 1,-0.2 4,-1.8 2,-0.2 3,-0.5 0.972 113.2 45.4 -51.1 -63.6 -58.8 10.6 17.5 144 146 A C H > S+ 0 0 0 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.840 111.4 55.0 -49.0 -37.8 -59.1 12.4 20.8 145 147 A S H X S+ 0 0 17 -4,-2.1 4,-2.8 1,-0.2 -1,-0.2 0.932 102.3 54.8 -64.3 -45.0 -61.2 9.6 22.2 146 148 A L H X S+ 0 0 2 -4,-2.5 4,-2.8 -3,-0.5 -1,-0.2 0.929 106.6 53.6 -53.3 -45.2 -58.5 6.9 21.4 147 149 A N H X S+ 0 0 0 -4,-1.8 4,-2.6 -5,-0.2 -1,-0.2 0.910 109.7 45.8 -57.0 -46.4 -56.0 9.0 23.3 148 150 A L H X S+ 0 0 0 -4,-1.6 4,-2.5 2,-0.2 5,-0.3 0.947 111.8 51.8 -62.0 -49.7 -58.3 9.1 26.4 149 151 A I H X S+ 0 0 17 -4,-2.8 4,-1.4 1,-0.2 -2,-0.2 0.910 113.3 45.9 -52.6 -46.6 -59.0 5.4 26.2 150 152 A R H X S+ 0 0 2 -4,-2.8 4,-2.5 -5,-0.2 5,-0.3 0.945 111.6 48.5 -65.0 -50.9 -55.3 4.6 26.0 151 153 A S H X S+ 0 0 7 -4,-2.6 4,-3.0 1,-0.2 34,-0.2 0.927 109.2 52.9 -57.6 -46.5 -54.1 6.9 28.8 152 154 A T H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.880 111.6 47.9 -55.6 -38.5 -56.8 5.6 31.2 153 155 A L H X S+ 0 0 9 -4,-1.4 4,-1.7 -5,-0.3 -1,-0.2 0.897 111.8 47.8 -69.1 -41.5 -55.5 2.1 30.4 154 156 A D H X S+ 0 0 23 -4,-2.5 4,-2.2 1,-0.2 -2,-0.2 0.860 108.9 57.5 -66.3 -33.4 -51.9 3.1 30.9 155 157 A F H X S+ 0 0 10 -4,-3.0 4,-1.9 -5,-0.3 -2,-0.2 0.919 102.0 53.2 -62.7 -43.4 -53.1 4.6 34.1 156 158 A F H X S+ 0 0 4 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.902 110.0 47.6 -58.6 -45.3 -54.5 1.3 35.4 157 159 A E H X S+ 0 0 0 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.898 108.2 54.9 -64.5 -42.1 -51.2 -0.4 34.8 158 160 A G H X S+ 0 0 0 -4,-2.2 4,-3.0 24,-0.4 -1,-0.2 0.869 106.1 51.4 -60.1 -36.6 -49.2 2.3 36.6 159 161 A C H X S+ 0 0 14 -4,-1.9 4,-1.0 2,-0.2 -1,-0.2 0.946 109.0 52.6 -63.2 -44.1 -51.4 2.0 39.6 160 162 A W H >< S+ 0 0 4 -4,-1.7 3,-0.8 1,-0.2 4,-0.2 0.921 112.6 43.4 -53.4 -53.7 -50.7 -1.8 39.5 161 163 A I H >< S+ 0 0 0 -4,-2.5 3,-2.2 1,-0.2 5,-0.4 0.914 108.6 58.1 -61.1 -46.1 -46.9 -1.1 39.4 162 164 A E H >< S+ 0 0 55 -4,-3.0 3,-1.7 1,-0.3 -1,-0.2 0.701 89.0 74.7 -60.8 -18.2 -47.1 1.5 42.1 163 165 A Q T << S+ 0 0 68 -4,-1.0 -1,-0.3 -3,-0.8 -2,-0.2 0.685 88.7 62.0 -67.1 -17.2 -48.7 -1.1 44.4 164 166 A Y T < S- 0 0 83 -3,-2.2 -1,-0.3 -4,-0.2 -2,-0.2 0.366 99.2-135.5 -89.9 1.3 -45.1 -2.5 44.7 165 167 A N < + 0 0 79 -3,-1.7 2,-0.6 1,-0.2 -3,-0.1 0.836 49.9 157.5 44.9 40.8 -43.7 0.7 46.2 166 168 A F - 0 0 23 -5,-0.4 -1,-0.2 1,-0.1 -2,-0.1 -0.848 32.2-176.0-102.9 116.8 -40.7 0.2 43.8 167 169 A G - 0 0 14 -2,-0.6 81,-0.4 1,-0.2 80,-0.1 0.400 56.6 -89.5 -90.9 5.0 -38.6 3.2 42.9 168 170 A G - 0 0 6 79,-0.1 -1,-0.2 7,-0.1 5,-0.1 0.032 43.4 -69.4 104.5 148.8 -36.4 1.3 40.4 169 171 A F > - 0 0 27 390,-0.1 3,-3.3 1,-0.1 6,-0.2 -0.544 62.2 -97.5 -73.2 134.3 -33.2 -0.7 40.3 170 172 A P T 3 S+ 0 0 72 0, 0.0 78,-0.2 0, 0.0 79,-0.2 -0.330 117.0 23.8 -53.2 122.0 -30.1 1.4 40.9 171 173 A G T 3 S+ 0 0 2 77,-3.4 2,-1.7 76,-0.3 456,-0.2 0.308 85.3 119.7 102.2 -8.9 -28.9 2.1 37.3 172 174 A S X + 0 0 0 -3,-3.3 3,-2.4 1,-0.2 77,-0.1 -0.429 35.4 168.9 -86.8 62.2 -32.3 1.6 35.8 173 175 A H T 3 + 0 0 43 -2,-1.7 4,-0.4 1,-0.3 -1,-0.2 0.720 66.5 59.2 -48.6 -30.6 -32.2 5.2 34.5 174 176 A D T 3> S+ 0 0 31 -3,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.463 85.8 83.3 -82.2 -0.0 -35.3 4.7 32.2 175 177 A Y H <> S+ 0 0 0 -3,-2.4 4,-2.5 2,-0.2 5,-0.2 0.914 82.3 52.2 -74.0 -45.0 -37.6 3.7 35.0 176 178 A P H > S+ 0 0 0 0, 0.0 4,-3.0 0, 0.0 5,-0.3 0.926 113.2 43.2 -59.1 -48.1 -38.7 7.1 36.5 177 179 A Q H > S+ 0 0 44 -4,-0.4 4,-2.4 1,-0.2 5,-0.2 0.903 114.0 54.1 -61.6 -42.3 -39.9 8.6 33.1 178 180 A F H X S+ 0 0 3 -4,-1.2 4,-1.8 2,-0.2 -1,-0.2 0.905 115.1 38.3 -55.6 -49.0 -41.5 5.3 32.3 179 181 A L H X S+ 0 0 3 -4,-2.5 4,-2.1 2,-0.2 5,-0.2 0.945 114.9 50.8 -71.4 -51.7 -43.5 5.2 35.5 180 182 A R H X S+ 0 0 39 -4,-3.0 4,-0.5 1,-0.3 -2,-0.2 0.888 114.6 46.7 -55.1 -39.6 -44.4 8.9 35.7 181 183 A R H >X S+ 0 0 43 -4,-2.4 3,-0.7 -5,-0.3 4,-0.5 0.902 106.3 59.7 -68.8 -40.7 -45.6 8.6 32.1 182 184 A M H 3< S+ 0 0 6 -4,-1.8 -24,-0.4 1,-0.2 -2,-0.2 0.867 122.1 21.6 -56.5 -42.5 -47.5 5.4 33.0 183 185 A N H 3< S+ 0 0 18 -4,-2.1 -1,-0.2 -25,-0.2 -2,-0.2 0.213 97.3 96.2-113.4 16.8 -49.7 7.1 35.6 184 186 A G H << S- 0 0 9 -3,-0.7 -2,-0.1 -4,-0.5 -3,-0.1 0.744 75.2-144.5 -75.5 -23.4 -49.4 10.7 34.5 185 187 A L >X + 0 0 18 -4,-0.5 4,-2.3 -34,-0.2 3,-0.7 0.687 48.6 147.1 65.3 18.6 -52.6 10.6 32.5 186 188 A G H 3> + 0 0 1 -5,-0.3 4,-2.7 1,-0.2 5,-0.3 0.942 63.1 45.0 -49.7 -69.1 -50.8 12.9 30.0 187 189 A H H 3> S+ 0 0 16 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.670 113.8 55.4 -54.6 -15.8 -52.3 11.9 26.7 188 190 A C H <> S+ 0 0 0 -3,-0.7 4,-1.5 2,-0.2 -1,-0.2 0.935 111.9 39.8 -79.7 -51.8 -55.7 11.9 28.4 189 191 A V H >< S+ 0 0 8 -4,-2.3 3,-0.6 -3,-0.3 4,-0.5 0.963 117.1 49.8 -58.4 -58.2 -55.4 15.5 29.6 190 192 A G H >< S+ 0 0 0 -4,-2.7 3,-0.8 1,-0.3 -1,-0.2 0.878 114.6 43.9 -51.6 -44.0 -53.8 16.7 26.4 191 193 A A H >< S+ 0 0 0 -4,-1.1 3,-0.9 -5,-0.3 -1,-0.3 0.733 105.5 62.0 -77.7 -20.7 -56.5 15.1 24.3 192 194 A S T << S+ 0 0 0 -4,-1.5 -1,-0.2 -3,-0.6 -2,-0.2 0.459 85.1 77.5 -84.7 0.5 -59.4 16.3 26.5 193 195 A L T < S+ 0 0 2 -3,-0.8 -1,-0.2 -4,-0.5 -2,-0.1 0.435 86.8 65.0 -85.9 -1.3 -58.6 19.9 25.9 194 196 A W < - 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0 0 37 -3,-1.4 2,-0.1 -4,-0.3 -44,-0.0 -0.594 53.8-154.9-106.6 164.2 -49.8 0.8 4.9 454 103 B K + 0 0 173 -2,-0.2 -1,-0.1 2,-0.1 62,-0.1 0.200 38.7 119.4 -98.6-139.1 -51.9 3.9 4.2 455 104 B D - 0 0 110 61,-0.1 61,-0.1 1,-0.1 -2,-0.0 0.582 65.7 -96.7 78.3 130.4 -55.7 4.1 4.5 456 105 B D - 0 0 57 1,-0.1 4,-0.3 2,-0.0 -1,-0.1 -0.699 26.5-168.5 -86.6 123.4 -57.5 6.5 6.8 457 106 B P >> + 0 0 8 0, 0.0 4,-1.5 0, 0.0 3,-1.2 0.818 69.2 87.9 -72.5 -39.1 -58.6 5.0 10.2 458 107 B Y G >4 S+ 0 0 39 1,-0.3 3,-0.7 2,-0.2 4,-0.5 0.793 84.2 49.8 -30.7 -63.3 -60.9 7.9 11.1 459 108 B P G >4 S+ 0 0 82 0, 0.0 3,-0.5 0, 0.0 -1,-0.3 0.864 118.7 38.9 -50.2 -42.5 -64.1 6.8 9.4 460 109 B T G <4 S+ 0 0 39 -3,-1.2 16,-0.5 -4,-0.3 15,-0.4 0.607 110.0 59.6 -87.6 -12.5 -63.9 3.3 11.0 461 110 B M G X< S+ 0 0 5 -4,-1.5 3,-0.9 -3,-0.7 4,-0.3 0.313 76.8 96.2 -96.6 7.0 -62.7 4.4 14.5 462 111 B V T < S+ 0 0 67 -3,-0.5 -1,-0.2 -4,-0.5 -2,-0.1 0.752 95.8 28.4 -68.7 -28.8 -65.7 6.7 15.2 463 112 B N T >> S+ 0 0 89 -3,-0.3 4,-2.4 -4,-0.1 3,-0.5 -0.000 84.4 127.7-120.6 25.7 -67.6 4.1 17.2 464 113 B Y H <> S+ 0 0 18 -3,-0.9 4,-2.2 1,-0.2 -2,-0.1 0.932 74.2 40.4 -46.7 -64.9 -64.5 2.2 18.5 465 114 B F H 3> S+ 0 0 11 -4,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.674 114.2 52.7 -64.7 -19.8 -65.3 2.3 22.2 466 115 B D H <> S+ 0 0 68 -3,-0.5 4,-1.0 2,-0.2 -1,-0.2 0.921 111.3 44.0 -82.4 -42.1 -69.0 1.6 21.8 467 116 B D H X>S+ 0 0 29 -4,-2.4 5,-2.3 2,-0.2 4,-1.1 0.875 114.5 54.3 -65.8 -36.0 -68.6 -1.4 19.7 468 117 B L H ><5S+ 0 0 14 -4,-2.2 3,-1.3 -5,-0.3 -2,-0.2 0.983 108.3 45.0 -59.6 -61.3 -65.9 -2.5 22.1 469 118 B Q H 3<5S+ 0 0 73 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.651 118.5 45.6 -58.9 -17.0 -68.0 -2.2 25.3 470 119 B A H 3<5S- 0 0 48 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.537 112.4-113.6-104.9 -10.6 -70.9 -4.0 23.6 471 120 B G T <<5 + 0 0 35 -3,-1.3 2,-0.4 -4,-1.1 -3,-0.2 0.969 62.7 146.1 75.8 55.7 -68.9 -6.9 22.0 472 121 B R < - 0 0 128 -5,-2.3 -1,-0.2 -6,-0.0 -2,-0.1 -0.995 58.0 -96.7-127.7 128.7 -69.4 -5.9 18.3 473 122 B E - 0 0 121 -2,-0.4 7,-0.1 1,-0.1 6,-0.0 -0.075 50.6-101.3 -41.9 132.6 -66.8 -6.6 15.7 474 123 B Q - 0 0 13 1,-0.1 6,-0.2 2,-0.1 -1,-0.1 -0.254 17.8-130.2 -61.1 145.2 -64.7 -3.5 15.1 475 124 B A S S+ 0 0 58 -15,-0.4 -14,-0.1 -3,-0.1 -1,-0.1 0.888 92.7 79.8 -62.6 -39.4 -65.5 -1.4 12.0 476 125 B H S > S- 0 0 10 -16,-0.5 4,-2.4 1,-0.2 5,-0.1 -0.570 78.7-144.1 -73.6 125.0 -61.8 -1.4 11.1 477 126 B P H > S+ 0 0 44 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.874 98.8 56.3 -56.1 -39.1 -60.9 -4.7 9.4 478 127 B W H >> S+ 0 0 7 1,-0.2 4,-2.9 2,-0.2 3,-0.6 0.988 108.9 44.3 -57.3 -61.3 -57.5 -4.7 11.1 479 128 B W H 3> S+ 0 0 5 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.888 110.1 58.1 -50.8 -41.3 -58.9 -4.4 14.6 480 129 B A H 3X S+ 0 0 6 -4,-2.4 4,-0.6 1,-0.2 -1,-0.2 0.899 114.5 35.4 -57.1 -43.5 -61.5 -7.1 13.6 481 130 B L H < S+ 0 0 7 -4,-1.9 3,-3.2 1,-0.2 4,-0.4 0.839 90.7 90.6 -83.1 -35.7 -56.6 -13.6 17.0 486 135 B F T >X S+ 0 0 2 -4,-3.0 3,-2.9 1,-0.3 4,-2.5 0.733 74.5 68.0 -29.6 -49.4 -55.2 -11.9 20.1 487 136 B P H 3> S+ 0 0 36 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.760 93.9 58.7 -49.3 -29.2 -56.3 -14.8 22.5 488 137 B N H <4 S+ 0 0 71 -3,-3.2 -2,-0.2 2,-0.2 -49,-0.1 0.637 111.9 40.2 -78.1 -12.4 -53.8 -17.1 20.9 489 138 B V H X4 S+ 0 0 0 -3,-2.9 3,-1.7 -4,-0.4 4,-0.2 0.836 113.9 52.9 -94.3 -50.2 -51.0 -14.8 21.8 490 139 B L H >< S+ 0 0 15 -4,-2.5 3,-2.0 1,-0.3 -2,-0.2 0.727 92.4 71.8 -58.0 -29.0 -52.3 -14.0 25.3 491 140 B R T 3< S+ 0 0 104 -4,-1.5 -1,-0.3 1,-0.3 -3,-0.1 0.795 91.9 60.4 -59.4 -28.0 -52.7 -17.6 26.4 492 141 B H T < S+ 0 0 8 -3,-1.7 57,-2.6 -4,-0.1 58,-0.4 0.568 104.9 62.4 -76.3 -7.9 -48.9 -17.7 26.6 493 142 B F S < S- 0 0 7 -3,-2.0 52,-0.1 55,-0.2 51,-0.0 -0.785 77.6-118.2-124.6 162.8 -48.9 -15.0 29.2 494 143 B G > - 0 0 7 53,-0.4 4,-1.3 -2,-0.3 -1,-0.1 -0.298 49.7 -91.3 -80.2 175.3 -50.0 -14.1 32.6 495 144 B P H > S+ 0 0 10 0, 0.0 4,-2.3 0, 0.0 3,-0.2 0.926 120.1 49.5 -56.3 -53.5 -52.4 -11.1 33.1 496 145 B F H > S+ 0 0 0 1,-0.2 4,-2.0 2,-0.2 3,-0.3 0.952 111.3 46.9 -53.7 -59.0 -49.8 -8.3 33.6 497 146 B C H > S+ 0 0 0 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.829 111.6 56.2 -53.9 -29.8 -47.7 -9.1 30.6 498 147 B S H X S+ 0 0 16 -4,-1.3 4,-3.0 2,-0.2 -1,-0.2 0.928 101.9 52.9 -68.9 -46.0 -51.0 -9.3 28.7 499 148 B L H X S+ 0 0 2 -4,-2.3 4,-2.9 -3,-0.3 5,-0.3 0.937 109.7 50.8 -53.6 -46.7 -52.1 -5.8 29.7 500 149 B N H X S+ 0 0 0 -4,-2.0 4,-2.3 1,-0.2 5,-0.2 0.925 109.9 48.6 -58.0 -47.0 -48.7 -4.6 28.3 501 150 B L H X S+ 0 0 1 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.943 114.3 46.5 -58.7 -49.1 -49.2 -6.4 25.0 502 151 B I H X S+ 0 0 16 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.956 113.7 46.0 -57.8 -57.2 -52.7 -5.1 24.6 503 152 B R H X S+ 0 0 1 -4,-2.9 4,-2.9 1,-0.2 5,-0.2 0.944 114.1 48.7 -49.5 -58.1 -51.9 -1.4 25.5 504 153 B S H X S+ 0 0 5 -4,-2.3 4,-3.0 -5,-0.3 34,-0.3 0.871 109.0 51.1 -52.7 -46.6 -48.8 -1.4 23.3 505 154 B T H X S+ 0 0 0 -4,-2.3 4,-1.2 -5,-0.2 -1,-0.2 0.929 113.2 48.7 -59.1 -42.1 -50.6 -2.9 20.3 506 155 B L H X S+ 0 0 7 -4,-2.4 4,-1.4 2,-0.2 3,-0.3 0.922 111.7 46.9 -61.3 -49.7 -53.2 -0.1 20.8 507 156 B D H >X S+ 0 0 17 -4,-2.9 4,-2.7 1,-0.2 3,-0.7 0.946 108.5 56.0 -57.0 -50.7 -50.6 2.7 21.1 508 157 B F H 3X S+ 0 0 5 -4,-3.0 4,-2.1 1,-0.3 -1,-0.2 0.820 102.8 57.2 -51.7 -33.5 -48.9 1.4 18.0 509 158 B F H 3X S+ 0 0 3 -4,-1.2 4,-1.2 -3,-0.3 -1,-0.3 0.892 107.9 45.7 -67.4 -40.0 -52.2 1.7 16.2 510 159 B E H XX S+ 0 0 0 -4,-1.4 4,-2.7 -3,-0.7 3,-0.8 0.973 109.2 56.3 -65.9 -52.6 -52.3 5.4 17.1 511 160 B G H 3X S+ 0 0 0 -4,-2.7 4,-3.0 24,-0.6 -2,-0.2 0.871 105.9 49.2 -44.1 -51.1 -48.7 5.9 16.0 512 161 B C H 3X S+ 0 0 4 -4,-2.1 4,-0.8 2,-0.2 -1,-0.3 0.853 112.1 51.0 -58.6 -36.3 -49.3 4.5 12.5 513 162 B W H X< S+ 0 0 3 -4,-1.2 3,-1.7 -3,-0.8 -2,-0.2 0.978 110.8 45.8 -64.5 -58.6 -52.3 6.9 12.3 514 163 B I H >< S+ 0 0 2 -4,-2.7 3,-1.3 1,-0.3 5,-0.3 0.912 108.2 60.2 -51.1 -44.4 -50.3 9.9 13.3 515 164 B E H >< S+ 0 0 22 -4,-3.0 3,-2.0 -5,-0.3 -1,-0.3 0.745 85.8 76.7 -57.1 -25.4 -47.6 8.8 10.9 516 165 B Q T << S+ 0 0 57 -3,-1.7 -1,-0.3 -4,-0.8 -2,-0.1 0.317 87.6 59.3 -73.0 12.4 -50.1 9.0 8.0 517 166 B Y T < S- 0 0 80 -3,-1.3 -1,-0.3 2,-0.1 -2,-0.1 0.183 100.1-135.2-118.5 8.9 -49.7 12.8 8.0 518 167 B N < + 0 0 79 -3,-2.0 2,-0.4 1,-0.2 -3,-0.1 0.846 48.3 159.1 29.8 60.4 -46.0 12.6 7.4 519 168 B F - 0 0 20 -5,-0.3 -1,-0.2 1,-0.1 -2,-0.1 -0.938 31.8-172.5-112.6 128.7 -45.5 15.3 10.1 520 169 B G - 0 0 10 -2,-0.4 81,-0.5 1,-0.1 -1,-0.1 0.350 54.1 -92.4-102.8 5.7 -42.1 15.6 11.8 521 170 B G - 0 0 2 79,-0.1 -1,-0.1 7,-0.1 3,-0.1 0.402 44.2 -70.8 93.3 133.7 -43.2 18.2 14.3 522 171 B F > - 0 0 25 -316,-0.2 3,-1.8 1,-0.1 6,-0.1 -0.313 67.6 -93.1 -54.6 129.7 -43.2 22.0 14.6 523 172 B P T 3 S+ 0 0 76 0, 0.0 78,-0.2 0, 0.0 79,-0.2 -0.220 116.9 28.7 -50.2 123.2 -39.6 23.2 14.9 524 173 B G T 3 S+ 0 0 5 77,-3.3 2,-0.9 76,-0.2 3,-0.2 0.480 79.7 122.8 101.5 5.0 -38.9 23.5 18.6 525 174 B S X + 0 0 0 -3,-1.8 3,-1.3 76,-0.2 77,-0.2 -0.434 34.4 170.9 -93.3 54.6 -41.4 20.8 19.6 526 175 B H T 3 S+ 0 0 52 -2,-0.9 4,-0.4 75,-0.3 -1,-0.2 0.731 70.5 53.9 -36.7 -37.6 -38.4 19.0 21.3 527 176 B D T 3> S+ 0 0 34 -3,-0.2 4,-1.9 1,-0.2 3,-0.3 0.895 89.2 76.7 -69.5 -44.0 -40.9 16.5 22.9 528 177 B Y H <> S+ 0 0 0 -3,-1.3 4,-2.9 1,-0.2 5,-0.3 0.800 85.2 61.0 -34.4 -57.9 -42.6 15.4 19.7 529 178 B P H > S+ 0 0 1 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.905 113.8 31.7 -39.6 -69.5 -39.8 13.1 18.3 530 179 B Q H > S+ 0 0 54 -4,-0.4 4,-2.7 -3,-0.3 5,-0.3 0.833 113.9 64.3 -63.1 -32.9 -39.7 10.5 21.2 531 180 B F H X S+ 0 0 5 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.969 111.2 36.7 -52.0 -54.8 -43.4 11.0 21.8 532 181 B L H X S+ 0 0 3 -4,-2.9 4,-1.1 1,-0.2 -2,-0.2 0.877 115.5 52.9 -68.0 -40.7 -44.0 9.6 18.3 533 182 B R H X S+ 0 0 35 -4,-2.5 4,-0.9 -5,-0.3 3,-0.4 0.893 109.1 49.6 -63.9 -39.9 -41.3 7.0 18.4 534 183 B R H < S+ 0 0 49 -4,-2.7 3,-0.5 1,-0.2 5,-0.5 0.887 107.4 56.7 -64.2 -40.1 -42.5 5.5 21.7 535 184 B M H < S+ 0 0 8 -4,-1.5 -24,-0.6 -5,-0.3 -1,-0.2 0.740 117.4 31.0 -66.3 -25.3 -46.0 5.3 20.3 536 185 B N H < S+ 0 0 16 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.383 96.3 85.6-117.0 5.2 -45.1 3.2 17.3 537 186 B G S < S- 0 0 9 -4,-0.9 5,-0.1 -3,-0.5 -2,-0.1 0.404 82.8-136.2 -86.6 2.7 -42.2 1.2 18.6 538 187 B L > + 0 0 21 -34,-0.3 4,-2.5 -4,-0.2 3,-0.5 0.776 47.9 157.1 46.9 30.9 -44.3 -1.6 20.2 539 188 B G H > + 0 0 1 -5,-0.5 4,-2.7 1,-0.2 5,-0.2 0.927 66.9 38.4 -49.2 -63.4 -41.9 -1.3 23.2 540 189 B H H > S+ 0 0 15 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.642 114.8 57.9 -67.6 -14.4 -44.0 -2.8 26.0 541 190 B C H > S+ 0 0 0 -3,-0.5 4,-1.8 2,-0.2 -1,-0.2 0.894 111.5 39.0 -82.0 -41.9 -45.3 -5.4 23.6 542 191 B V H < S+ 0 0 10 -4,-2.5 4,-0.5 2,-0.2 -2,-0.2 0.959 116.9 50.7 -69.8 -51.1 -41.9 -6.8 22.7 543 192 B G H >< S+ 0 0 0 -4,-2.7 3,-0.5 -5,-0.3 -1,-0.2 0.851 115.1 42.2 -56.7 -37.9 -40.6 -6.5 26.3 544 193 B A H >< S+ 0 0 0 -4,-1.1 3,-1.8 -5,-0.2 -1,-0.2 0.874 104.9 61.4 -80.1 -36.0 -43.6 -8.3 27.8 545 194 B S T 3< S+ 0 0 0 -4,-1.8 -1,-0.2 1,-0.3 -2,-0.2 0.501 88.2 78.2 -69.1 -0.3 -43.9 -11.0 25.2 546 195 B L T < S+ 0 0 3 -3,-0.5 -1,-0.3 -4,-0.5 -2,-0.1 0.435 86.3 64.6 -84.5 -1.5 -40.4 -12.0 26.2 547 196 B W < - 0 0 4 -3,-1.8 -53,-0.4 -53,-0.1 -1,-0.2 -0.569 66.3-172.2-129.1 74.2 -41.8 -13.8 29.3 548 197 B P >> - 0 0 4 0, 0.0 4,-1.8 0, 0.0 3,-0.9 -0.273 27.5-131.3 -60.1 145.2 -44.1 -16.8 28.7 549 198 B K T 34 S+ 0 0 119 -57,-2.6 -56,-0.1 1,-0.3 -57,-0.1 0.727 105.8 66.3 -73.8 -19.8 -45.8 -18.1 31.8 550 199 B E T 34 S+ 0 0 131 -58,-0.4 -1,-0.3 1,-0.2 3,-0.1 0.763 118.9 25.6 -69.4 -21.7 -44.8 -21.7 31.0 551 200 B Q T <4 S+ 0 0 57 -3,-0.9 2,-0.3 1,-0.2 -2,-0.2 0.533 126.1 39.5-116.7 -14.4 -41.2 -20.4 31.6 552 201 B F < - 0 0 18 -4,-1.8 2,-0.8 -5,-0.1 -1,-0.2 -0.978 64.7-133.6-140.0 154.5 -41.7 -17.4 34.0 553 202 B N >> - 0 0 85 -2,-0.3 4,-2.6 1,-0.2 3,-1.1 -0.846 13.1-159.9-112.3 96.5 -43.7 -16.4 37.0 554 203 B E T 34 S+ 0 0 14 -2,-0.8 7,-0.2 1,-0.3 -1,-0.2 0.812 93.1 46.5 -34.5 -51.7 -45.1 -12.9 36.5 555 204 B R T >4 S+ 0 0 117 1,-0.2 3,-0.5 2,-0.2 -1,-0.3 0.828 114.0 47.3 -68.8 -33.1 -45.7 -12.5 40.2 556 205 B S T <4 S+ 0 0 84 -3,-1.1 -2,-0.2 1,-0.2 -1,-0.2 0.821 124.7 30.9 -78.5 -31.2 -42.3 -13.8 41.2 557 206 B L T 3X S+ 0 0 18 -4,-2.6 4,-2.8 1,-0.1 5,-0.3 -0.096 79.3 126.3-118.0 33.7 -40.4 -11.7 38.7 558 207 B F H <> S+ 0 0 6 -3,-0.5 4,-2.5 1,-0.2 5,-0.2 0.934 76.2 46.5 -56.1 -50.1 -42.7 -8.7 38.6 559 208 B L H > S+ 0 0 50 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.899 114.9 44.5 -64.2 -41.9 -39.9 -6.2 39.4 560 209 B E H > S+ 0 0 30 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.934 115.0 49.0 -70.3 -40.8 -37.4 -7.6 36.9 561 210 B I H X S+ 0 0 2 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.884 112.1 48.0 -64.3 -38.7 -40.0 -8.0 34.2 562 211 B T H X S+ 0 0 1 -4,-2.5 4,-2.4 -5,-0.3 -1,-0.2 0.915 112.9 48.6 -67.1 -42.1 -41.2 -4.4 34.7 563 212 B S H X S+ 0 0 0 -4,-2.1 4,-2.4 -5,-0.2 5,-0.3 0.884 109.8 52.7 -64.9 -38.0 -37.7 -3.1 34.6 564 213 B A H X S+ 0 0 4 -4,-2.5 4,-3.0 2,-0.2 5,-0.3 0.928 108.5 50.4 -64.1 -42.1 -37.0 -5.1 31.5 565 214 B I H X S+ 0 0 1 -4,-2.2 4,-1.3 1,-0.2 -2,-0.2 0.936 113.0 46.1 -60.9 -46.1 -40.1 -3.5 29.8 566 215 B A H X S+ 0 0 1 -4,-2.4 4,-0.7 2,-0.2 -1,-0.2 0.898 122.0 34.6 -64.6 -42.5 -39.0 0.0 30.8 567 216 B Q H X S+ 0 0 2 -4,-2.4 4,-1.7 1,-0.2 3,-0.4 0.901 115.6 52.6 -81.5 -43.1 -35.4 -0.4 29.7 568 217 B M H X S+ 0 0 3 -4,-3.0 4,-2.3 -5,-0.3 5,-0.3 0.755 96.2 71.6 -66.1 -23.4 -35.8 -2.7 26.7 569 218 B E H X S+ 0 0 12 -4,-1.3 4,-1.8 -5,-0.3 -1,-0.2 0.962 106.6 34.6 -57.1 -51.8 -38.3 -0.3 25.2 570 219 B N H X S+ 0 0 13 -4,-0.7 4,-2.5 -3,-0.4 5,-0.3 0.883 118.7 50.5 -72.4 -39.6 -35.7 2.3 24.4 571 220 B W H X S+ 0 0 0 -4,-1.7 4,-2.5 2,-0.2 5,-0.3 0.996 111.5 48.5 -59.8 -60.8 -32.9 -0.2 23.5 572 221 B M H X S+ 0 0 10 -4,-2.3 4,-1.1 1,-0.2 -2,-0.2 0.877 116.9 41.7 -44.6 -50.6 -35.0 -2.2 21.2 573 222 B V H X S+ 0 0 4 -4,-1.8 4,-2.5 -5,-0.3 -1,-0.2 0.872 113.8 48.4 -71.9 -39.1 -36.3 0.9 19.3 574 223 B W H X S+ 0 0 17 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.896 107.0 56.8 -69.4 -38.8 -33.1 2.9 19.0 575 224 B V H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.3 5,-0.2 0.871 112.6 42.9 -58.5 -37.0 -31.1 -0.1 17.8 576 225 B N H X S+ 0 0 18 -4,-1.1 4,-2.3 -5,-0.3 -2,-0.2 0.898 108.1 57.5 -75.6 -40.0 -33.7 -0.3 15.0 577 226 B D H < S+ 0 0 5 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.840 117.1 38.2 -56.6 -30.2 -33.7 3.5 14.5 578 227 B L H >< S+ 0 0 2 -4,-2.0 3,-2.6 2,-0.1 4,-0.4 0.968 116.1 44.8 -82.4 -68.3 -30.0 3.0 13.8 579 228 B M H >< S+ 0 0 1 -4,-2.5 3,-0.5 1,-0.3 4,-0.3 0.802 119.3 44.4 -47.8 -38.8 -29.6 -0.3 11.9 580 229 B S T 3X S+ 0 0 0 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.3 0.233 78.4 105.2 -95.5 15.4 -32.5 0.7 9.6 581 230 B F T <4 S+ 0 0 3 -3,-2.6 -1,-0.2 2,-0.2 -2,-0.1 0.853 82.3 53.6 -60.7 -31.2 -31.4 4.2 9.1 582 231 B Y T X4 S+ 0 0 31 -3,-0.5 3,-2.3 -4,-0.4 4,-0.4 0.995 109.3 40.4 -65.6 -68.1 -30.3 3.0 5.7 583 232 B K T 34 S+ 0 0 11 73,-0.3 -1,-0.2 -4,-0.3 -2,-0.2 0.724 115.8 53.6 -56.6 -24.3 -33.5 1.4 4.3 584 233 B E T 3< S+ 0 0 26 -4,-1.7 -1,-0.3 1,-0.1 3,-0.3 0.300 88.7 89.8 -94.1 9.1 -35.6 4.3 5.7 585 234 B F S < S+ 0 0 12 -3,-2.3 -2,-0.1 1,-0.2 -1,-0.1 1.000 99.8 13.4 -70.1 -71.6 -33.5 6.9 4.0 586 235 B D S S+ 0 0 122 -4,-0.4 2,-0.4 2,-0.0 -1,-0.2 -0.135 102.7 110.4-100.6 39.7 -35.1 7.6 0.6 587 236 B D - 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0 0 57 1,-0.1 4,-1.9 3,-0.1 3,-0.8 0.069 55.1-137.8 -31.1 116.0 -31.8 -13.7 38.1 633 282 B P H 3> S+ 0 0 106 0, 0.0 4,-2.5 0, 0.0 5,-0.1 0.875 100.8 57.9 -49.2 -45.1 -29.6 -15.6 35.6 634 283 B Q H 3> S+ 0 0 89 2,-0.2 4,-1.5 1,-0.2 5,-0.1 0.877 106.6 48.2 -55.8 -41.5 -32.6 -16.9 33.7 635 284 B V H X> S+ 0 0 1 -3,-0.8 4,-2.1 2,-0.2 3,-0.7 0.981 111.0 49.9 -62.2 -56.5 -33.8 -13.3 33.1 636 285 B M H 3X S+ 0 0 36 -4,-1.9 4,-3.2 1,-0.3 -2,-0.2 0.857 105.9 58.9 -48.2 -42.7 -30.4 -12.1 31.9 637 286 B D H 3X S+ 0 0 68 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.3 0.894 108.2 43.5 -55.6 -46.4 -30.2 -15.1 29.6 638 287 B T H X S+ 0 0 9 -4,-2.1 4,-2.6 1,-0.2 3,-1.1 0.856 108.3 53.3 -64.0 -38.5 -31.8 -10.4 12.2 650 299 B H H 3< S+ 0 0 1 -4,-1.4 8,-0.3 1,-0.3 -1,-0.2 0.845 109.8 48.3 -66.4 -34.7 -31.1 -6.7 11.3 651 300 B L T 3< S+ 0 0 3 -4,-1.9 -1,-0.3 1,-0.1 33,-0.2 0.357 121.8 35.7 -87.9 7.2 -27.9 -7.7 9.5 652 301 B C T <4 S+ 0 0 41 -3,-1.1 2,-0.2 -5,-0.1 -2,-0.2 0.624 87.5 94.9-131.3 -24.8 -29.7 -10.5 7.6 653 302 B D >< - 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