==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER VIRAL PROTEIN 29-FEB-12 4DYQ . COMPND 2 MOLECULE: GENE 1 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: SHIGELLA PHAGE SF6; . AUTHOR H.ZHAO,L.TANG . 253 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15634.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 182 71.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 4.3 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 . 2 0.8 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 . 14 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 131 51.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 1 0 0 0 0 3 0 1 0 0 0 0 0 0 0 0 2 0 0 0 0 0 2 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 0 0 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 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 . 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 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 10 A P 0 0 84 0, 0.0 32,-0.3 0, 0.0 35,-0.1 0.000 360.0 360.0 360.0 107.6 28.4 42.2 21.0 2 11 A S + 0 0 71 30,-0.1 2,-0.3 2,-0.1 3,-0.1 0.678 360.0 88.3-115.3 -34.0 26.4 40.0 18.5 3 12 A D S S- 0 0 105 1,-0.1 33,-0.0 37,-0.0 37,-0.0 -0.527 91.8 -95.5 -76.8 133.7 26.9 41.7 15.1 4 13 A Y - 0 0 32 -2,-0.3 -1,-0.1 1,-0.1 -2,-0.1 -0.159 43.7-169.1 -46.4 129.1 29.9 40.6 13.1 5 14 A M >> - 0 0 70 -3,-0.1 4,-2.3 -4,-0.1 2,-1.5 -0.937 17.0-148.6-131.6 109.2 32.8 43.0 13.7 6 15 A P T 34 S+ 0 0 91 0, 0.0 -2,-0.0 0, 0.0 41,-0.0 -0.606 95.1 41.0 -78.0 89.2 36.0 42.8 11.5 7 16 A E T 3> S+ 0 0 127 -2,-1.5 4,-1.1 0, 0.0 5,-0.0 -0.183 112.0 53.8 161.5 -42.7 38.6 44.0 14.1 8 17 A V H <> S+ 0 0 21 -3,-0.8 4,-2.3 2,-0.2 5,-0.1 0.876 111.9 47.3 -73.7 -41.5 37.2 42.0 17.0 9 18 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 5,-0.2 0.916 111.7 49.0 -64.6 -45.8 37.4 38.9 14.8 10 19 A D H > S+ 0 0 82 -5,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.871 110.9 53.0 -60.1 -35.0 40.9 39.8 13.8 11 20 A D H X S+ 0 0 58 -4,-1.1 4,-2.1 2,-0.2 -2,-0.2 0.910 106.2 51.6 -65.9 -43.7 41.6 40.2 17.5 12 21 A I H X S+ 0 0 0 -4,-2.3 4,-2.8 1,-0.2 5,-0.3 0.930 109.4 50.6 -60.0 -46.2 40.2 36.8 18.3 13 22 A C H X S+ 0 0 10 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.864 109.0 51.3 -58.9 -39.7 42.5 35.3 15.6 14 23 A S H X S+ 0 0 60 -4,-1.8 4,-1.2 2,-0.2 -1,-0.2 0.890 112.1 46.6 -66.4 -38.2 45.5 37.1 17.1 15 24 A L H <>S+ 0 0 27 -4,-2.1 5,-2.0 2,-0.2 3,-0.4 0.927 113.4 46.9 -71.9 -45.9 44.7 35.8 20.6 16 25 A L H ><5S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.2 -1,-0.2 0.906 109.5 56.9 -58.6 -41.1 44.2 32.2 19.4 17 26 A S H 3<5S+ 0 0 44 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.811 101.5 55.5 -61.6 -31.2 47.4 32.5 17.4 18 27 A S T 3<5S- 0 0 53 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.351 131.2 -92.7 -86.7 6.3 49.3 33.4 20.6 19 28 A G T < 5S+ 0 0 15 -3,-1.9 -3,-0.2 1,-0.3 -2,-0.1 0.277 80.5 138.5 106.7 -9.6 48.1 30.2 22.2 20 29 A E < - 0 0 30 -5,-2.0 -1,-0.3 -6,-0.2 2,-0.1 -0.423 49.7-125.7 -71.2 142.1 44.9 31.4 24.0 21 30 A S > - 0 0 31 -2,-0.1 4,-2.1 1,-0.1 5,-0.1 -0.369 19.5-112.9 -81.8 167.7 41.9 29.1 23.8 22 31 A L H > S+ 0 0 14 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.892 115.1 57.7 -68.4 -40.6 38.5 30.3 22.5 23 32 A L H > S+ 0 0 120 1,-0.2 4,-1.3 2,-0.2 -1,-0.2 0.898 110.6 43.2 -55.6 -43.5 36.9 29.9 25.9 24 33 A K H 4 S+ 0 0 134 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.901 111.3 53.8 -70.6 -41.9 39.4 32.4 27.4 25 34 A V H >< S+ 0 0 0 -4,-2.1 3,-0.5 1,-0.2 -2,-0.2 0.868 113.5 43.8 -59.4 -35.9 39.2 34.8 24.5 26 35 A C H 3< S+ 0 0 20 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.717 102.1 64.7 -85.8 -22.6 35.4 34.9 25.0 27 36 A K T 3< S+ 0 0 175 -4,-1.3 -1,-0.2 -5,-0.2 -2,-0.2 0.540 84.3 102.8 -77.0 -5.5 35.4 35.2 28.7 28 37 A R S X S- 0 0 118 -3,-0.5 3,-1.5 -4,-0.5 2,-0.1 -0.478 87.9 -94.1 -75.8 148.7 37.1 38.6 28.3 29 38 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 -0.414 108.3 16.6 -64.4 133.5 35.1 41.8 28.7 30 39 A G T 3 S+ 0 0 61 1,-0.3 -3,-0.1 -2,-0.1 -4,-0.0 0.359 97.6 122.4 88.2 -5.1 33.6 43.1 25.4 31 40 A M < - 0 0 30 -3,-1.5 -1,-0.3 -5,-0.2 -5,-0.1 -0.584 67.8-106.8 -88.7 152.6 34.1 39.9 23.5 32 41 A P - 0 0 0 0, 0.0 -4,-0.1 0, 0.0 -30,-0.1 -0.392 39.8-107.2 -68.5 154.4 31.4 37.9 21.8 33 42 A D >> - 0 0 94 -32,-0.3 4,-1.9 1,-0.1 3,-0.6 -0.339 36.7 -97.4 -76.6 168.0 30.3 34.7 23.5 34 43 A K H 3> S+ 0 0 90 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.869 123.1 55.4 -54.0 -42.1 31.3 31.4 21.9 35 44 A S H 3> S+ 0 0 78 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.865 108.6 48.6 -62.0 -37.0 28.0 30.9 20.1 36 45 A T H <> S+ 0 0 10 -3,-0.6 4,-2.6 2,-0.2 -1,-0.2 0.862 108.4 52.8 -71.4 -39.2 28.3 34.3 18.5 37 46 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.928 110.0 49.1 -60.9 -44.3 31.9 33.6 17.3 38 47 A F H X S+ 0 0 98 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.846 110.1 51.4 -65.3 -34.8 30.7 30.3 15.7 39 48 A R H X S+ 0 0 113 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.944 109.4 49.7 -66.2 -48.2 27.8 32.2 14.0 40 49 A W H X S+ 0 0 0 -4,-2.6 4,-0.9 1,-0.2 3,-0.3 0.950 110.7 50.4 -51.4 -54.8 30.3 34.8 12.6 41 50 A L H >< S+ 0 0 19 -4,-2.6 3,-0.8 1,-0.2 7,-0.3 0.904 109.8 51.4 -50.4 -45.2 32.5 31.9 11.4 42 51 A A H 3< S+ 0 0 70 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.864 116.3 38.5 -63.5 -37.0 29.5 30.3 9.7 43 52 A K H 3< S+ 0 0 112 -4,-2.0 2,-0.3 -3,-0.3 -1,-0.2 0.301 112.8 56.8-104.1 9.0 28.4 33.5 7.9 44 53 A H S+ 0 0 124 -2,-0.3 4,-1.5 1,-0.2 5,-0.1 0.807 88.7 59.1 -73.1 -30.8 34.3 33.0 4.8 46 55 A D H > S+ 0 0 93 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.881 109.4 43.6 -65.4 -38.4 37.1 35.5 5.4 47 56 A F H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.871 108.3 59.6 -73.0 -38.0 36.9 35.0 9.2 48 57 A R H X S+ 0 0 106 -4,-1.7 4,-1.4 -7,-0.3 -2,-0.2 0.859 109.2 44.6 -55.7 -36.7 36.6 31.2 8.7 49 58 A D H X S+ 0 0 89 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.932 113.2 45.3 -79.9 -49.0 40.0 31.2 7.0 50 59 A K H X S+ 0 0 48 -4,-1.8 4,-2.0 1,-0.2 -2,-0.2 0.833 114.4 52.7 -62.3 -31.5 42.0 33.5 9.3 51 60 A Y H X S+ 0 0 33 -4,-2.2 4,-1.9 2,-0.2 -1,-0.2 0.882 105.8 53.6 -70.6 -38.4 40.5 31.5 12.2 52 61 A A H X S+ 0 0 49 -4,-1.4 4,-1.5 -5,-0.2 -2,-0.2 0.893 111.5 44.8 -62.2 -40.4 41.7 28.3 10.6 53 62 A K H X S+ 0 0 141 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.863 110.9 53.1 -74.0 -35.1 45.2 29.6 10.4 54 63 A A H X S+ 0 0 0 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.843 106.7 55.3 -64.6 -31.9 45.0 31.0 13.9 55 64 A T H X S+ 0 0 22 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.873 105.2 50.8 -68.5 -38.5 43.9 27.4 14.9 56 65 A E H X S+ 0 0 87 -4,-1.5 4,-1.6 2,-0.2 -2,-0.2 0.905 110.9 48.9 -66.2 -38.0 47.1 26.0 13.3 57 66 A A H X S+ 0 0 30 -4,-2.0 4,-1.5 2,-0.2 -2,-0.2 0.922 109.4 52.2 -64.5 -43.3 49.2 28.5 15.3 58 67 A R H X S+ 0 0 67 -4,-2.4 4,-2.5 1,-0.2 3,-0.3 0.915 106.6 55.0 -56.4 -44.2 47.3 27.5 18.5 59 68 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.873 102.9 54.5 -58.2 -40.4 48.1 23.9 17.7 60 69 A D H X S+ 0 0 36 -4,-1.6 4,-0.9 1,-0.2 -1,-0.2 0.871 110.4 47.3 -65.4 -32.8 51.8 24.6 17.5 61 70 A S H >X S+ 0 0 2 -4,-1.5 4,-1.8 -3,-0.3 3,-0.6 0.924 110.5 51.1 -70.1 -46.0 51.6 26.1 21.0 62 71 A I H 3X S+ 0 0 14 -4,-2.5 4,-1.6 1,-0.2 -2,-0.2 0.856 101.6 63.1 -60.5 -35.5 49.7 23.2 22.3 63 72 A F H 3X S+ 0 0 13 -4,-2.3 4,-0.6 1,-0.2 -1,-0.2 0.878 107.1 42.6 -57.2 -40.0 52.3 20.8 20.9 64 73 A E H XX S+ 0 0 6 -4,-0.9 4,-1.1 -3,-0.6 3,-0.6 0.833 106.7 63.6 -78.0 -29.8 54.9 22.4 23.2 65 74 A E H 3X S+ 0 0 44 -4,-1.8 4,-2.5 1,-0.2 5,-0.2 0.859 92.5 62.9 -57.4 -38.9 52.4 22.4 26.1 66 75 A I H 3X S+ 0 0 0 -4,-1.6 4,-2.1 1,-0.2 -1,-0.2 0.858 99.3 53.9 -63.9 -31.3 52.2 18.6 26.2 67 76 A F H < S+ 0 0 0 -4,-2.1 3,-1.3 -5,-0.2 140,-0.2 0.958 118.0 44.5 -68.5 -52.1 53.9 15.4 31.2 71 80 A D H 3< S+ 0 0 29 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.789 118.0 43.8 -68.1 -28.4 57.3 16.4 32.5 72 81 A N T 3< S+ 0 0 98 -4,-2.3 -1,-0.3 -5,-0.2 -2,-0.2 0.191 80.1 137.1-104.8 16.0 56.0 18.6 35.4 73 82 A A < - 0 0 8 -3,-1.3 7,-0.1 1,-0.1 -3,-0.1 -0.364 63.2-111.4 -61.3 138.1 53.2 16.2 36.5 74 83 A I - 0 0 97 5,-0.1 2,-2.6 1,-0.1 9,-0.1 -0.592 30.0-121.2 -69.5 128.2 52.9 15.9 40.3 75 84 A P S S+ 0 0 61 0, 0.0 2,-0.3 0, 0.0 128,-0.2 -0.325 75.7 112.4 -76.7 62.5 54.0 12.4 41.2 76 85 A D S > S- 0 0 84 -2,-2.6 4,-2.8 126,-0.2 5,-0.3 -0.969 76.9-115.1-130.7 144.6 50.7 11.4 42.8 77 86 A A H > S+ 0 0 72 -2,-0.3 4,-2.2 1,-0.2 5,-0.1 0.890 112.3 38.5 -51.9 -52.2 48.4 8.8 41.3 78 87 A A H > S+ 0 0 69 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.856 115.4 52.6 -71.5 -34.8 45.4 11.1 40.6 79 88 A E H > S+ 0 0 79 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.882 110.6 48.2 -68.0 -37.0 47.5 14.0 39.5 80 89 A V H X S+ 0 0 7 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.913 111.2 50.7 -68.6 -40.2 49.4 11.8 37.0 81 90 A A H X S+ 0 0 60 -4,-2.2 4,-2.1 -5,-0.3 -2,-0.2 0.894 111.6 48.5 -61.9 -39.3 46.1 10.4 35.7 82 91 A K H X S+ 0 0 126 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.923 110.3 50.3 -65.3 -45.2 44.9 14.0 35.3 83 92 A A H X S+ 0 0 7 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.904 109.8 51.8 -58.3 -42.3 48.1 15.0 33.4 84 93 A R H X S+ 0 0 105 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.913 110.0 48.6 -60.7 -43.2 47.6 12.0 31.2 85 94 A L H X S+ 0 0 111 -4,-2.1 4,-2.5 1,-0.2 5,-0.2 0.921 111.1 50.5 -63.9 -42.0 44.0 13.0 30.4 86 95 A R H X S+ 0 0 107 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.899 115.0 43.2 -62.0 -41.9 45.2 16.6 29.7 87 96 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.928 113.4 50.3 -70.4 -45.9 47.9 15.3 27.3 88 97 A D H X S+ 0 0 59 -4,-3.0 4,-2.2 1,-0.2 5,-0.2 0.893 110.2 51.1 -61.4 -38.9 45.7 12.7 25.6 89 98 A T H X S+ 0 0 76 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.933 112.3 46.5 -64.8 -43.6 43.0 15.3 25.0 90 99 A R H X S+ 0 0 63 -4,-1.7 4,-2.7 -5,-0.2 -2,-0.2 0.904 110.1 52.8 -64.3 -42.7 45.5 17.7 23.5 91 100 A K H X S+ 0 0 34 -4,-2.8 4,-1.4 2,-0.2 -2,-0.2 0.933 112.0 46.1 -58.2 -46.2 47.1 14.9 21.3 92 101 A W H X S+ 0 0 161 -4,-2.2 4,-0.9 1,-0.2 3,-0.2 0.928 114.5 47.4 -62.6 -45.9 43.7 14.1 19.9 93 102 A A H >X S+ 0 0 30 -4,-2.3 4,-2.0 1,-0.2 3,-0.6 0.876 104.6 60.5 -65.1 -37.1 42.8 17.7 19.3 94 103 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.3 8,-0.3 0.883 99.2 56.4 -60.4 -41.0 46.1 18.5 17.6 95 104 A A H 3< S+ 0 0 19 -4,-1.4 -1,-0.3 7,-0.3 8,-0.2 0.831 111.8 43.2 -60.6 -33.1 45.4 16.0 14.9 96 105 A R H << S+ 0 0 140 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.792 110.6 54.2 -84.3 -27.3 42.2 17.7 14.0 97 106 A M H < S+ 0 0 29 -4,-2.0 -2,-0.2 1,-0.3 -3,-0.2 0.854 133.3 6.5 -75.1 -35.8 43.6 21.2 14.3 98 107 A N X + 0 0 18 -4,-2.3 4,-3.2 -5,-0.2 5,-0.4 -0.644 68.8 177.6-145.8 85.3 46.4 20.5 11.8 99 108 A P H > S+ 0 0 85 0, 0.0 4,-1.7 0, 0.0 -1,-0.1 0.859 80.8 55.2 -58.9 -37.8 46.0 17.0 10.2 100 109 A R H 4 S+ 0 0 219 1,-0.2 -5,-0.1 2,-0.2 -2,-0.0 0.894 120.6 30.2 -61.9 -39.6 49.0 17.3 7.9 101 110 A K H 4 S+ 0 0 92 -3,-0.4 -1,-0.2 -7,-0.1 -6,-0.1 0.882 133.1 25.9 -88.5 -43.6 51.3 18.1 10.8 102 111 A Y H < S+ 0 0 9 -4,-3.2 -7,-0.3 -8,-0.3 -2,-0.2 0.399 89.7 109.7-114.2 1.5 49.8 16.3 13.8 103 112 A G S < S- 0 0 13 -4,-1.7 -7,-0.0 -5,-0.4 -11,-0.0 -0.186 82.3 -74.5 -66.2 169.3 47.9 13.3 12.3 104 113 A D - 0 0 125 1,-0.0 2,-0.5 123,-0.0 -1,-0.1 -0.295 44.7-143.4 -64.7 152.8 49.1 9.8 12.8 105 114 A K + 0 0 40 121,-0.1 123,-2.7 -3,-0.1 2,-0.4 -0.985 25.0 167.0-126.6 121.8 52.1 8.7 10.7 106 115 A V E -a 228 0A 70 -2,-0.5 2,-0.5 121,-0.2 123,-0.2 -0.995 24.2-155.4-135.6 138.8 52.3 5.2 9.3 107 116 A T E -a 229 0A 70 121,-2.4 123,-2.4 -2,-0.4 2,-0.6 -0.982 17.3-163.0-109.9 118.6 54.6 3.6 6.7 108 117 A N E -a 230 0A 81 -2,-0.5 2,-0.8 121,-0.2 123,-0.2 -0.921 9.0-156.9-104.6 115.7 52.9 0.5 5.1 109 118 A E E -a 231 0A 114 121,-2.9 123,-2.4 -2,-0.6 2,-0.6 -0.845 19.4-155.4 -87.1 110.5 55.1 -1.9 3.2 110 119 A L E +a 232 0A 99 -2,-0.8 2,-0.3 121,-0.2 123,-0.2 -0.823 24.2 158.1 -97.6 119.5 52.6 -3.6 0.9 111 120 A V E -a 233 0A 29 121,-2.4 123,-3.2 -2,-0.6 6,-0.2 -0.816 31.0-119.3-130.8 170.6 53.5 -7.1 -0.3 112 121 A G > - 0 0 0 4,-2.8 3,-2.3 -2,-0.3 6,-0.3 -0.257 58.4 -36.0-100.9-170.1 51.6 -10.0 -1.7 113 122 A K G > S- 0 0 99 121,-0.5 3,-2.1 4,-0.4 -1,-0.2 -0.207 129.6 -1.8 -52.7 130.6 51.2 -13.6 -0.6 114 123 A D G 3 S- 0 0 142 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.672 130.7 -62.9 62.0 19.6 54.3 -15.1 1.0 115 124 A G G < S+ 0 0 55 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.519 110.2 120.0 83.3 4.3 56.2 -11.8 0.3 116 125 A G S < S- 0 0 39 -3,-2.1 -4,-2.8 1,-0.2 -1,-0.2 -0.011 76.0 -52.3 -79.7-166.5 55.8 -12.2 -3.4 117 126 A A - 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0 0 28 -5,-1.7 -1,-0.3 1,-0.1 2,-0.1 -0.458 50.8-119.0 -71.4 141.2 65.2 20.2 25.5 145 30 B S > - 0 0 9 -2,-0.1 4,-2.4 1,-0.1 3,-0.2 -0.435 20.6-115.6 -81.2 156.0 61.6 21.2 25.0 146 31 B L H > S+ 0 0 0 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.889 112.1 51.4 -61.9 -42.4 60.7 24.7 24.0 147 32 B L H 4 S+ 0 0 19 1,-0.2 4,-0.4 -83,-0.2 -1,-0.2 0.886 111.7 48.4 -66.2 -34.9 58.9 25.8 27.1 148 33 B K H >4 S+ 0 0 131 -3,-0.2 3,-1.3 1,-0.2 4,-0.3 0.916 110.5 51.4 -68.6 -41.9 61.8 24.6 29.2 149 34 B V H >< S+ 0 0 0 -4,-2.4 3,-1.9 1,-0.3 -2,-0.2 0.913 104.1 58.0 -58.0 -43.5 64.2 26.5 27.0 150 35 B C T 3< S+ 0 0 19 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.567 97.4 62.4 -70.7 -7.3 62.2 29.7 27.3 151 36 B K T < S+ 0 0 139 -3,-1.3 -1,-0.3 -4,-0.4 -2,-0.2 0.529 82.9 104.2 -89.5 -8.1 62.6 29.5 31.1 152 37 B R S X S- 0 0 109 -3,-1.9 3,-1.9 -4,-0.3 -3,-0.0 -0.328 90.7 -72.8 -72.2 156.8 66.4 29.9 30.9 153 38 B P T 3 S+ 0 0 129 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 -0.245 115.3 2.6 -51.5 125.7 68.1 33.2 31.7 154 39 B G T 3 S+ 0 0 61 1,-0.2 -3,-0.1 -3,-0.1 -2,-0.1 0.447 94.2 138.1 83.5 1.9 67.5 35.8 29.0 155 40 B M < - 0 0 31 -3,-1.9 -1,-0.2 -6,-0.1 2,-0.1 -0.491 54.0-115.5 -80.6 151.1 65.3 33.8 26.8 156 41 B P - 0 0 1 0, 0.0 -4,-0.1 0, 0.0 -30,-0.1 -0.405 38.0 -99.7 -72.1 158.6 62.1 35.1 25.0 157 42 B D > - 0 0 93 -32,-0.3 4,-1.9 1,-0.1 3,-0.4 -0.345 38.3-102.6 -74.5 165.1 58.8 33.7 26.0 158 43 B K H > S+ 0 0 40 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.868 120.6 57.8 -61.9 -38.4 57.3 31.0 23.7 159 44 B S H > S+ 0 0 47 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.913 108.0 48.3 -56.9 -41.9 54.8 33.4 22.1 160 45 B T H > S+ 0 0 21 -3,-0.4 4,-2.6 2,-0.2 -1,-0.2 0.886 108.1 54.2 -67.3 -40.0 57.7 35.6 21.1 161 46 B V H X S+ 0 0 0 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.941 108.8 48.5 -59.0 -46.0 59.6 32.6 19.7 162 47 B F H X S+ 0 0 42 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.852 110.5 52.0 -65.8 -31.2 56.7 31.7 17.5 163 48 B R H X S+ 0 0 80 -4,-1.7 4,-1.6 -5,-0.2 -1,-0.2 0.916 109.0 49.7 -68.4 -42.7 56.5 35.3 16.3 164 49 B W H X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.2 3,-0.3 0.926 110.8 50.6 -58.7 -47.4 60.2 35.2 15.4 165 50 B L H >< S+ 0 0 18 -4,-2.5 3,-0.5 1,-0.2 7,-0.3 0.928 107.5 53.9 -53.7 -48.8 59.6 32.0 13.5 166 51 B A H 3< S+ 0 0 70 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.835 118.5 33.0 -58.9 -35.5 56.6 33.5 11.6 167 52 B K H 3< S+ 0 0 135 -4,-1.6 2,-0.5 -3,-0.3 -1,-0.2 0.503 110.6 63.2-105.3 -5.3 58.6 36.5 10.4 168 53 B H S+ 0 0 124 -2,-0.5 4,-2.6 1,-0.2 5,-0.2 0.827 87.6 61.0 -68.8 -33.3 62.9 32.4 7.4 170 55 B D H > S+ 0 0 94 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.917 109.5 43.1 -56.7 -43.7 66.5 32.0 8.5 171 56 B F H > S+ 0 0 3 -3,-0.3 4,-2.7 2,-0.2 5,-0.2 0.919 111.2 54.3 -69.4 -44.4 65.2 31.1 11.9 172 57 B R H X S+ 0 0 99 -4,-2.2 4,-2.0 -7,-0.3 -2,-0.2 0.910 109.6 48.2 -55.9 -44.0 62.5 28.8 10.5 173 58 B D H X S+ 0 0 99 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.910 114.7 43.7 -64.1 -44.0 65.0 26.8 8.5 174 59 B K H X S+ 0 0 99 -4,-1.7 4,-2.2 -5,-0.2 -1,-0.2 0.832 112.2 54.3 -72.0 -29.8 67.4 26.4 11.4 175 60 B Y H X S+ 0 0 26 -4,-2.7 4,-1.6 2,-0.2 -2,-0.2 0.854 105.7 52.7 -71.7 -34.9 64.5 25.5 13.7 176 61 B A H X S+ 0 0 63 -4,-2.0 4,-1.6 -5,-0.2 -2,-0.2 0.916 110.4 47.7 -67.1 -40.9 63.4 22.8 11.4 177 62 B K H X S+ 0 0 136 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.920 111.0 51.8 -62.6 -42.1 66.9 21.4 11.5 178 63 B A H X S+ 0 0 2 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.798 105.1 56.3 -64.6 -29.3 66.9 21.6 15.3 179 64 B T H X S+ 0 0 29 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.881 105.3 50.6 -73.0 -38.2 63.6 19.8 15.4 180 65 B E H X S+ 0 0 100 -4,-1.6 4,-1.7 2,-0.2 -2,-0.2 0.920 114.4 44.7 -61.0 -43.4 65.1 16.8 13.5 181 66 B A H X S+ 0 0 33 -4,-1.9 4,-2.3 1,-0.2 -2,-0.2 0.894 108.9 56.6 -70.0 -40.0 68.0 16.8 15.9 182 67 B R H X S+ 0 0 2 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.908 106.5 51.0 -54.5 -44.7 65.6 17.2 18.9 183 68 B A H X S+ 0 0 0 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.915 108.8 49.4 -63.3 -44.1 63.8 14.1 17.8 184 69 B D H X S+ 0 0 54 -4,-1.7 4,-1.0 1,-0.2 -1,-0.2 0.882 112.4 49.6 -63.6 -35.0 67.0 12.0 17.5 185 70 B S H X S+ 0 0 41 -4,-2.3 4,-1.9 -44,-0.3 3,-0.5 0.928 110.6 48.8 -67.2 -46.1 68.0 13.2 21.0 186 71 B I H X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.2 -2,-0.2 0.836 101.6 64.6 -62.8 -34.2 64.6 12.3 22.5 187 72 B F H < S+ 0 0 76 -4,-2.0 4,-0.5 1,-0.2 -1,-0.2 0.883 108.1 40.9 -59.6 -37.3 64.7 8.8 20.9 188 73 B E H >X S+ 0 0 124 -4,-1.0 3,-0.9 -3,-0.5 4,-0.9 0.889 110.2 60.6 -74.7 -37.2 67.7 8.1 23.1 189 74 B E H 3X S+ 0 0 52 -4,-1.9 4,-2.3 1,-0.2 3,-0.2 0.810 91.2 66.0 -60.4 -35.0 66.1 9.8 26.1 190 75 B I H 3X S+ 0 0 24 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.855 97.4 54.8 -63.5 -31.4 63.1 7.5 26.2 191 76 B F H <> S+ 0 0 113 -3,-0.9 4,-2.7 -4,-0.5 -1,-0.2 0.915 110.0 47.2 -63.7 -41.0 65.2 4.5 27.1 192 77 B E H X S+ 0 0 121 -4,-0.9 4,-2.2 -3,-0.2 -2,-0.2 0.899 108.9 53.2 -69.2 -40.6 66.7 6.4 30.1 193 78 B I H < S+ 0 0 14 -4,-2.3 4,-0.3 1,-0.2 -1,-0.2 0.922 116.1 40.0 -62.1 -42.8 63.3 7.6 31.3 194 79 B A H >< S+ 0 0 57 -4,-1.9 3,-1.1 -5,-0.2 -2,-0.2 0.948 117.2 46.6 -69.2 -49.7 62.0 4.0 31.4 195 80 B D H 3< S+ 0 0 124 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.776 117.4 42.5 -68.5 -28.3 65.1 2.3 32.7 196 81 B N T 3< S+ 0 0 108 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.308 80.7 135.4-102.6 6.6 65.7 4.8 35.5 197 82 B A < - 0 0 32 -3,-1.1 7,-0.1 -4,-0.3 -3,-0.1 -0.282 64.4-111.5 -56.8 136.2 62.0 5.2 36.7 198 83 B I - 0 0 99 5,-0.1 2,-2.6 1,-0.1 9,-0.1 -0.570 30.4-120.1 -66.3 129.5 61.6 5.1 40.4 199 84 B P S S+ 0 0 129 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.341 75.8 114.9 -78.3 64.5 59.8 1.8 41.2 200 85 B D S > S- 0 0 82 -2,-2.6 4,-2.7 1,-0.1 5,-0.3 -0.973 75.3-118.3-128.2 142.1 56.8 3.6 42.8 201 86 B A H > S+ 0 0 86 -2,-0.4 4,-2.1 1,-0.2 5,-0.1 0.894 111.9 41.2 -51.1 -51.0 53.4 3.4 41.3 202 87 B A H > S+ 0 0 12 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.863 115.1 51.0 -68.7 -37.0 52.9 7.1 40.7 203 88 B E H > S+ 0 0 57 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.866 110.8 48.3 -69.4 -37.6 56.5 7.6 39.5 204 89 B V H X S+ 0 0 71 -4,-2.7 4,-2.7 2,-0.2 -2,-0.2 0.906 110.4 52.1 -67.8 -40.1 56.3 4.8 37.0 205 90 B A H X S+ 0 0 42 -4,-2.1 4,-2.1 -5,-0.3 -2,-0.2 0.893 111.0 47.9 -61.7 -39.3 52.9 6.2 35.7 206 91 B K H X S+ 0 0 33 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.916 110.3 51.0 -66.7 -44.2 54.6 9.6 35.3 207 92 B A H X S+ 0 0 10 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.907 109.9 51.1 -58.1 -43.7 57.6 8.0 33.5 208 93 B R H X S+ 0 0 136 -4,-2.7 4,-3.1 2,-0.2 5,-0.2 0.909 109.8 49.1 -59.5 -45.5 55.1 6.2 31.2 209 94 B L H X S+ 0 0 6 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.918 111.3 50.0 -60.1 -43.1 53.3 9.5 30.4 210 95 B R H X S+ 0 0 63 -4,-2.6 4,-1.7 -140,-0.2 -2,-0.2 0.904 115.1 43.3 -63.8 -40.4 56.7 11.2 29.7 211 96 B V H X S+ 0 0 19 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.930 113.6 50.1 -71.2 -45.0 57.7 8.3 27.3 212 97 B D H X S+ 0 0 40 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.880 109.9 51.4 -62.5 -37.7 54.3 8.1 25.6 213 98 B T H X S+ 0 0 0 -4,-2.4 4,-2.4 -5,-0.2 -1,-0.2 0.935 112.3 46.4 -64.3 -44.6 54.3 11.8 25.0 214 99 B R H X S+ 0 0 8 -4,-1.7 4,-2.8 -5,-0.2 -2,-0.2 0.901 110.1 52.8 -64.0 -41.8 57.7 11.6 23.4 215 100 B K H X S+ 0 0 109 -4,-2.8 4,-1.4 2,-0.2 -1,-0.2 0.929 111.8 46.3 -59.6 -46.3 56.8 8.6 21.3 216 101 B W H X S+ 0 0 35 -4,-2.1 4,-0.9 1,-0.2 3,-0.3 0.942 114.9 46.7 -61.1 -48.4 53.8 10.5 19.9 217 102 B A H >X S+ 0 0 0 -4,-2.4 4,-2.2 1,-0.2 3,-0.7 0.878 104.5 60.6 -64.7 -37.6 55.7 13.6 19.3 218 103 B L H 3X S+ 0 0 5 -4,-2.8 4,-2.3 1,-0.3 8,-0.3 0.882 99.5 56.4 -59.5 -38.9 58.7 11.9 17.6 219 104 B A H 3< S+ 0 0 7 -4,-1.4 -1,-0.3 -3,-0.3 8,-0.2 0.829 112.4 42.6 -64.1 -30.9 56.4 10.5 14.9 220 105 B R H << S+ 0 0 26 -4,-0.9 -1,-0.2 -3,-0.7 -2,-0.2 0.802 110.7 54.1 -83.5 -31.3 55.4 14.1 14.1 221 106 B M H < S+ 0 0 25 -4,-2.2 -2,-0.2 1,-0.3 -3,-0.2 0.855 133.9 6.4 -70.5 -35.8 58.8 15.6 14.3 222 107 B N X + 0 0 23 -4,-2.3 4,-3.1 -5,-0.2 5,-0.4 -0.642 69.3 176.8-147.2 84.8 60.2 13.1 11.8 223 108 B P H > S+ 0 0 53 0, 0.0 4,-1.8 0, 0.0 -1,-0.1 0.847 79.9 55.8 -61.1 -36.7 57.5 10.9 10.3 224 109 B R H 4 S+ 0 0 218 1,-0.2 -5,-0.1 2,-0.2 -117,-0.0 0.891 120.2 30.0 -65.1 -38.7 59.8 9.1 7.9 225 110 B K H 4 S+ 0 0 104 -3,-0.3 -1,-0.2 -7,-0.1 -6,-0.1 0.884 133.0 26.7 -87.3 -42.6 62.0 7.9 10.7 226 111 B Y H < S+ 0 0 31 -4,-3.1 -7,-0.2 -8,-0.3 -2,-0.2 0.381 89.2 110.7-114.9 3.4 59.7 7.6 13.7 227 112 B G S < S- 0 0 6 -4,-1.8 -121,-0.2 -5,-0.4 -123,-0.0 -0.197 82.5 -75.1 -63.8 168.5 56.3 6.9 12.3 228 113 B D E -a 106 0A 99 -123,-2.7 -121,-2.4 1,-0.0 2,-0.5 -0.311 44.8-143.1 -65.0 154.1 54.7 3.5 12.8 229 114 B K E +a 107 0A 118 -123,-0.2 2,-0.4 -3,-0.1 -121,-0.2 -0.987 25.2 167.6-127.0 120.7 56.0 0.7 10.6 230 115 B V E -a 108 0A 59 -123,-2.4 -121,-2.9 -2,-0.5 2,-0.5 -0.997 24.2-154.9-135.1 137.4 53.7 -2.0 9.3 231 116 B T E -a 109 0A 87 -2,-0.4 2,-0.6 -123,-0.2 -121,-0.2 -0.980 16.9-161.9-107.5 118.8 54.2 -4.7 6.6 232 117 B N E -a 110 0A 52 -123,-2.4 -121,-2.4 -2,-0.5 2,-0.8 -0.916 7.8-156.8-104.5 113.5 50.8 -5.7 5.1 233 118 B E E -a 111 0A 106 -2,-0.6 2,-0.6 -123,-0.2 -121,-0.2 -0.829 20.1-154.0 -84.1 110.8 50.7 -9.0 3.3 234 119 B L + 0 0 60 -123,-3.2 -121,-0.5 -2,-0.8 -115,-0.4 -0.809 24.6 158.3 -98.2 121.0 47.8 -8.5 0.9 235 120 B V - 0 0 63 -2,-0.6 6,-0.2 -123,-0.2 2,-0.1 -0.821 27.1-128.0-130.9 171.3 45.8 -11.6 -0.3 236 121 B G > - 0 0 17 4,-3.0 3,-2.3 -2,-0.3 6,-0.3 -0.315 55.6 -26.8-110.7-165.7 42.4 -12.2 -1.7 237 122 B K G > S- 0 0 132 4,-0.5 3,-1.9 1,-0.3 -1,-0.2 -0.135 129.9 -3.2 -51.3 127.7 39.4 -14.4 -1.0 238 123 B D G 3 S- 0 0 156 1,-0.3 -1,-0.3 -3,-0.1 3,-0.1 0.727 130.4 -62.6 62.7 24.4 40.4 -17.7 0.6 239 124 B G G < S+ 0 0 22 -3,-2.3 -1,-0.3 1,-0.2 -2,-0.2 0.549 113.4 111.2 77.9 7.7 44.1 -16.7 0.4 240 125 B G S < S- 0 0 39 -3,-1.9 -4,-3.0 1,-0.3 -1,-0.2 0.075 78.3 -41.4 -87.2-154.8 44.0 -16.6 -3.4 241 126 B A - 0 0 17 -6,-0.2 -4,-0.5 1,-0.1 2,-0.4 -0.371 66.5 -97.4 -71.0 151.9 44.3 -13.6 -5.7 242 127 B I E -b 120 0B 41 -123,-3.1 -121,-3.0 -6,-0.3 2,-0.6 -0.609 41.9-139.3 -68.2 123.3 42.5 -10.3 -4.9 243 128 B Q E -b 121 0B 127 -2,-0.4 2,-0.4 -123,-0.2 -121,-0.2 -0.801 24.3-179.8 -96.0 121.3 39.3 -10.4 -6.9 244 129 B I E -b 122 0B 70 -123,-2.6 -121,-1.8 -2,-0.6 2,-0.5 -0.979 10.6-169.7-126.5 129.4 38.3 -7.2 -8.6 245 130 B E - 0 0 149 -2,-0.4 2,-0.4 -123,-0.2 -123,-0.1 -0.979 9.5-159.4-116.9 122.6 35.3 -6.6 -10.8 246 131 B T + 0 0 106 -2,-0.5 -2,-0.0 -123,-0.0 -124,-0.0 -0.812 13.8 176.7-102.5 145.0 35.0 -3.3 -12.7 247 132 B S - 0 0 90 -2,-0.4 3,-0.1 1,-0.0 -2,-0.0 -0.953 37.6 -85.7-142.0 158.4 31.7 -1.9 -13.9 248 133 B P - 0 0 120 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.289 62.8 -86.5 -59.4 150.3 30.4 1.2 -15.7 249 134 B M - 0 0 108 1,-0.1 3,-0.1 3,-0.0 0, 0.0 -0.347 37.8-167.5 -60.6 140.7 29.5 4.0 -13.4 250 135 B S S S+ 0 0 119 1,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.430 70.1 34.7-112.1 -5.1 25.9 3.6 -12.1 251 136 B T S S- 0 0 90 0, 0.0 2,-1.6 0, 0.0 3,-0.2 -0.957 92.1 -98.1-140.8 164.4 25.6 7.1 -10.6 252 137 B L + 0 0 179 -2,-0.3 -3,-0.0 1,-0.2 0, 0.0 -0.583 62.0 141.6 -83.5 82.4 26.9 10.6 -11.5 253 138 B F 0 0 152 -2,-1.6 -1,-0.2 0, 0.0 0, 0.0 0.426 360.0 360.0-106.9 0.2 30.0 10.8 -9.2 254 139 B G 0 0 110 -3,-0.2 -2,-0.0 0, 0.0 0, 0.0 -0.056 360.0 360.0 -67.8 360.0 32.4 12.6 -11.4