==== 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 METAL BINDING PROTEIN 24-JUN-01 1JGC . COMPND 2 MOLECULE: BACTERIOFERRITIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RHODOBACTER CAPSULATUS; . AUTHOR D.COBESSI,L.-S.HUANG,M.BAN,N.G.PON,F.DALDAL,E.A.BERRY . 480 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23939.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 400 83.3 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 . 12 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 21 4.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 343 71.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 0 3 6 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 1 A M 0 0 27 0, 0.0 2,-0.2 0, 0.0 292,-0.0 0.000 360.0 360.0 360.0 117.2 -0.7 29.2 47.3 2 2 A K - 0 0 146 64,-0.1 64,-0.2 1,-0.1 2,-0.2 -0.437 360.0-152.4 -65.3 128.8 -2.9 31.5 49.4 3 3 A G - 0 0 12 62,-2.0 2,-0.4 -2,-0.2 -1,-0.1 -0.520 26.2 -81.7-102.3 169.8 -4.6 34.1 47.3 4 4 A D >> - 0 0 57 -2,-0.2 4,-2.0 1,-0.2 3,-1.3 -0.543 39.0-133.7 -68.3 121.6 -5.9 37.6 47.8 5 5 A A H 3> S+ 0 0 72 -2,-0.4 4,-1.5 1,-0.3 -1,-0.2 0.841 104.2 48.9 -45.3 -43.3 -9.4 37.3 49.3 6 6 A K H 3> S+ 0 0 96 2,-0.2 4,-2.2 1,-0.2 -1,-0.3 0.784 105.4 56.3 -73.8 -24.5 -10.9 39.9 47.0 7 7 A V H <> S+ 0 0 0 -3,-1.3 4,-2.7 2,-0.2 -1,-0.2 0.920 107.5 50.8 -68.9 -40.1 -9.3 38.3 43.9 8 8 A I H X S+ 0 0 20 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.867 107.7 53.0 -63.6 -35.7 -11.1 35.1 44.9 9 9 A E H X S+ 0 0 135 -4,-1.5 4,-1.7 -5,-0.2 -1,-0.2 0.941 110.3 47.2 -64.5 -46.6 -14.4 37.1 45.2 10 10 A F H X S+ 0 0 20 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.915 110.9 51.8 -60.8 -44.3 -13.9 38.5 41.7 11 11 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -1,-0.2 0.908 109.9 49.2 -59.8 -43.2 -13.2 35.0 40.3 12 12 A N H X S+ 0 0 29 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.813 111.2 50.1 -67.1 -29.3 -16.3 33.6 42.0 13 13 A A H X S+ 0 0 29 -4,-1.7 4,-2.2 2,-0.2 -2,-0.2 0.917 110.7 48.6 -74.3 -41.7 -18.4 36.4 40.5 14 14 A A H X S+ 0 0 0 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.896 110.1 53.6 -62.2 -38.6 -16.9 35.8 37.1 15 15 A L H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 5,-0.2 0.930 108.2 48.4 -60.9 -46.8 -17.7 32.1 37.6 16 16 A R H X S+ 0 0 63 -4,-1.9 4,-1.6 1,-0.2 59,-0.7 0.886 110.1 52.8 -61.5 -38.5 -21.3 32.9 38.3 17 17 A S H X S+ 0 0 17 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.927 112.0 45.7 -62.6 -44.0 -21.4 35.1 35.3 18 18 A E H X S+ 0 0 1 -4,-2.5 4,-3.0 2,-0.2 -2,-0.2 0.906 108.2 53.9 -66.8 -44.2 -20.1 32.2 33.2 19 19 A L H X S+ 0 0 25 -4,-3.0 4,-1.7 1,-0.2 -1,-0.2 0.854 110.2 51.3 -58.8 -32.5 -22.5 29.6 34.6 20 20 A T H X S+ 0 0 11 -4,-1.6 4,-2.4 -5,-0.2 -2,-0.2 0.945 109.6 47.6 -69.3 -48.6 -25.2 32.0 33.6 21 21 A A H X S+ 0 0 21 -4,-2.1 4,-3.0 1,-0.2 5,-0.3 0.908 107.6 57.5 -59.0 -43.3 -23.9 32.4 30.1 22 22 A I H X S+ 0 0 27 -4,-3.0 4,-2.2 1,-0.2 -1,-0.2 0.949 112.3 39.5 -53.4 -52.7 -23.6 28.6 29.7 23 23 A S H X S+ 0 0 46 -4,-1.7 4,-2.3 2,-0.2 5,-0.2 0.863 114.4 53.4 -68.1 -35.2 -27.3 28.0 30.5 24 24 A Q H X S+ 0 0 9 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.930 112.4 44.2 -66.1 -43.5 -28.5 31.0 28.5 25 25 A Y H X S+ 0 0 5 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.893 113.3 51.6 -67.3 -39.6 -26.6 29.8 25.4 26 26 A W H X S+ 0 0 83 -4,-2.2 4,-2.3 -5,-0.3 -1,-0.2 0.889 109.8 47.7 -66.9 -39.1 -27.8 26.3 25.8 27 27 A V H X S+ 0 0 56 -4,-2.3 4,-3.1 1,-0.2 -1,-0.2 0.918 112.2 51.1 -66.5 -40.6 -31.4 27.2 26.2 28 28 A H H X S+ 0 0 0 -4,-2.0 4,-3.1 -5,-0.2 5,-0.2 0.878 107.6 53.3 -62.8 -37.3 -31.1 29.4 23.1 29 29 A F H X S+ 0 0 11 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.971 113.0 42.8 -60.5 -53.0 -29.5 26.5 21.3 30 30 A R H X S+ 0 0 143 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.913 115.5 49.0 -59.6 -45.9 -32.5 24.3 22.1 31 31 A L H X S+ 0 0 51 -4,-3.1 4,-1.4 1,-0.2 -1,-0.2 0.949 112.6 47.1 -59.2 -51.8 -35.0 27.1 21.4 32 32 A Q H <>S+ 0 0 1 -4,-3.1 5,-2.4 1,-0.2 4,-0.5 0.838 109.4 55.6 -60.9 -32.6 -33.4 27.9 18.0 33 33 A E H ><5S+ 0 0 69 -4,-2.2 3,-1.1 -5,-0.2 -1,-0.2 0.929 107.3 48.2 -66.4 -44.1 -33.3 24.2 17.2 34 34 A D H 3<5S+ 0 0 140 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.745 106.6 58.1 -68.3 -23.3 -37.1 23.8 17.8 35 35 A W T 3<5S- 0 0 90 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.593 118.5-113.4 -80.6 -11.4 -37.7 26.9 15.6 36 36 A G T < 5S+ 0 0 36 -3,-1.1 119,-1.6 -4,-0.5 2,-0.9 0.606 80.3 127.8 89.2 12.4 -35.9 25.1 12.8 37 37 A L >>< + 0 0 10 -5,-2.4 4,-2.4 117,-0.2 3,-0.7 -0.494 25.0 162.6 -99.5 63.2 -33.0 27.5 12.7 38 38 A A H 3> + 0 0 8 -2,-0.9 4,-2.5 1,-0.2 -1,-0.2 0.829 69.5 52.7 -50.9 -42.3 -30.3 24.8 13.0 39 39 A K H 3> S+ 0 0 115 114,-1.2 4,-1.0 2,-0.2 -1,-0.2 0.857 111.7 45.6 -67.8 -33.9 -27.4 26.9 11.8 40 40 A M H <> S+ 0 0 12 113,-1.1 4,-1.7 -3,-0.7 -1,-0.2 0.894 112.4 54.4 -72.6 -38.1 -28.2 29.6 14.4 41 41 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 112,-0.3 -2,-0.2 0.898 102.7 54.2 -61.6 -44.3 -28.6 26.8 17.0 42 42 A K H X S+ 0 0 120 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.844 106.2 53.0 -62.4 -33.4 -25.2 25.2 16.3 43 43 A K H X S+ 0 0 61 -4,-1.0 4,-2.5 2,-0.2 -1,-0.2 0.925 108.2 50.1 -67.9 -42.9 -23.5 28.5 17.0 44 44 A S H X S+ 0 0 4 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.886 108.8 52.6 -61.2 -39.3 -25.2 28.8 20.3 45 45 A R H X S+ 0 0 107 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.926 109.6 49.4 -63.3 -43.7 -24.1 25.3 21.3 46 46 A E H X S+ 0 0 109 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.939 110.8 48.6 -60.4 -48.7 -20.5 26.2 20.5 47 47 A E H X S+ 0 0 4 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.880 109.9 52.8 -60.5 -38.2 -20.6 29.4 22.5 48 48 A S H X S+ 0 0 0 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.914 109.9 48.0 -63.6 -43.0 -22.1 27.5 25.5 49 49 A I H X S+ 0 0 79 -4,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.776 107.7 56.5 -69.6 -25.4 -19.4 25.0 25.3 50 50 A E H X S+ 0 0 75 -4,-1.7 4,-1.7 2,-0.2 3,-0.3 0.949 107.1 48.6 -69.1 -46.3 -16.8 27.8 25.1 51 51 A E H X S+ 0 0 1 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.843 103.9 60.0 -61.5 -34.3 -18.1 29.2 28.4 52 52 A M H X S+ 0 0 71 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.925 105.3 50.4 -59.5 -40.5 -18.0 25.8 30.0 53 53 A G H X S+ 0 0 37 -4,-1.4 4,-2.4 -3,-0.3 -2,-0.2 0.904 109.4 49.4 -62.9 -42.9 -14.3 25.9 29.3 54 54 A H H X S+ 0 0 11 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.945 110.2 51.8 -60.6 -48.2 -13.9 29.3 30.9 55 55 A A H X S+ 0 0 5 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.918 110.2 47.8 -55.2 -48.3 -15.8 28.2 33.9 56 56 A D H X S+ 0 0 112 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.938 110.8 51.3 -59.5 -47.6 -13.6 25.2 34.4 57 57 A K H X S+ 0 0 91 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.903 112.5 47.1 -55.8 -43.5 -10.5 27.3 34.0 58 58 A I H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.856 108.0 53.8 -69.4 -37.6 -11.8 29.7 36.6 59 59 A I H X S+ 0 0 36 -4,-2.4 4,-2.2 1,-0.2 -1,-0.2 0.902 108.6 51.4 -64.4 -39.2 -12.7 27.0 39.1 60 60 A A H X S+ 0 0 55 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.900 108.7 49.7 -64.9 -40.4 -9.2 25.7 38.9 61 61 A R H X S+ 0 0 18 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.886 109.4 52.9 -66.4 -37.1 -7.6 29.0 39.5 62 62 A I H <>S+ 0 0 0 -4,-2.0 5,-2.8 2,-0.2 -2,-0.2 0.934 109.5 47.3 -64.0 -46.0 -9.9 29.5 42.6 63 63 A L H ><5S+ 0 0 99 -4,-2.2 3,-1.8 1,-0.2 -2,-0.2 0.908 109.7 53.7 -63.1 -40.8 -8.8 26.2 44.1 64 64 A F H 3<5S+ 0 0 16 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.891 106.3 51.7 -60.2 -40.3 -5.2 26.9 43.5 65 65 A L T 3<5S- 0 0 0 -4,-1.9 -62,-2.0 -5,-0.1 -1,-0.3 0.286 121.7-114.3 -78.6 10.8 -5.6 30.2 45.3 66 66 A E T < 5S+ 0 0 104 -3,-1.8 -3,-0.2 -64,-0.2 -2,-0.1 0.746 74.1 130.2 61.6 29.6 -7.1 28.1 48.1 67 67 A G < - 0 0 7 -5,-2.8 -1,-0.2 -6,-0.2 -62,-0.0 -0.344 61.6-106.3 -98.3-175.8 -10.5 29.6 47.8 68 68 A H - 0 0 154 -2,-0.1 2,-0.2 -3,-0.1 -5,-0.0 -0.953 25.3-133.8-120.7 115.9 -13.8 27.8 47.4 69 69 A P - 0 0 42 0, 0.0 2,-0.6 0, 0.0 -10,-0.0 -0.461 18.5-156.5 -67.1 134.3 -15.6 27.7 44.0 70 70 A N + 0 0 68 -2,-0.2 3,-0.3 1,-0.1 -54,-0.0 -0.906 28.4 159.4-119.2 102.6 -19.3 28.5 44.4 71 71 A L + 0 0 86 -2,-0.6 -1,-0.1 1,-0.2 3,-0.0 0.028 44.3 109.6-108.0 27.0 -21.6 27.2 41.6 72 72 A Q S S+ 0 0 155 1,-0.0 2,-0.3 2,-0.0 -1,-0.2 0.781 77.8 29.6 -74.2 -26.5 -24.7 27.4 43.7 73 73 A K - 0 0 140 -3,-0.3 2,-0.3 0, 0.0 -54,-0.1 -0.916 60.1-149.6-136.5 160.5 -26.4 30.3 41.9 74 74 A L - 0 0 67 -2,-0.3 -57,-0.1 -55,-0.1 3,-0.1 -0.871 28.2-112.3-122.2 156.6 -26.6 32.0 38.5 75 75 A D - 0 0 66 -59,-0.7 -1,-0.0 -2,-0.3 2,-0.0 -0.292 65.6 -58.1 -75.6 172.6 -27.2 35.7 37.7 76 76 A P - 0 0 113 0, 0.0 -1,-0.2 0, 0.0 2,-0.1 -0.322 59.1-130.6 -58.4 130.8 -30.6 36.5 36.0 77 77 A L - 0 0 80 -3,-0.1 2,-0.5 -2,-0.0 -56,-0.1 -0.476 9.3-149.7 -79.2 152.1 -31.1 34.6 32.8 78 78 A R - 0 0 89 -2,-0.1 2,-0.7 8,-0.1 15,-0.1 -0.833 16.3-176.5-126.1 93.2 -32.1 36.4 29.6 79 79 A I - 0 0 70 -2,-0.5 7,-0.1 10,-0.1 -54,-0.0 -0.805 16.0-145.2 -95.4 110.7 -34.2 34.1 27.4 80 80 A G - 0 0 4 -2,-0.7 6,-0.1 1,-0.1 -2,-0.0 -0.336 4.3-148.2 -68.9 152.6 -35.2 35.7 24.0 81 81 A E S S+ 0 0 184 1,-0.0 -1,-0.1 -2,-0.0 3,-0.1 0.328 78.1 23.9-104.1 8.5 -38.6 34.6 22.7 82 82 A G S > S- 0 0 6 1,-0.1 4,-2.2 0, 0.0 5,-0.2 -0.974 93.3 -85.9-159.9 169.2 -37.5 35.0 19.1 83 83 A P H > S+ 0 0 33 0, 0.0 4,-1.3 0, 0.0 3,-0.3 0.932 123.9 39.0 -46.2 -60.7 -34.4 34.9 16.7 84 84 A R H > S+ 0 0 62 1,-0.2 4,-2.1 2,-0.2 3,-0.2 0.880 112.5 56.5 -62.7 -39.2 -33.5 38.6 17.1 85 85 A E H > S+ 0 0 94 1,-0.2 4,-3.5 2,-0.2 -1,-0.2 0.872 102.8 54.7 -61.2 -38.8 -34.3 38.7 20.9 86 86 A T H X S+ 0 0 0 -4,-2.2 4,-2.6 -3,-0.3 -1,-0.2 0.881 107.9 49.8 -63.6 -36.2 -31.9 35.9 21.6 87 87 A L H X S+ 0 0 11 -4,-1.3 4,-2.5 -5,-0.2 -1,-0.2 0.924 113.2 47.7 -65.7 -42.1 -29.1 37.8 19.9 88 88 A E H X S+ 0 0 71 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.929 112.1 48.1 -63.8 -47.2 -30.1 40.8 22.0 89 89 A C H X S+ 0 0 26 -4,-3.5 4,-2.1 2,-0.2 -1,-0.2 0.911 112.7 48.0 -62.5 -41.3 -30.1 38.9 25.2 90 90 A D H X S+ 0 0 2 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.925 112.5 49.2 -65.8 -41.2 -26.8 37.3 24.5 91 91 A L H X S+ 0 0 21 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.901 108.9 53.6 -63.4 -39.2 -25.3 40.6 23.6 92 92 A A H X S+ 0 0 32 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.908 108.5 49.7 -61.8 -41.7 -26.7 42.1 26.8 93 93 A G H X S+ 0 0 21 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.830 107.2 54.9 -66.8 -31.6 -25.1 39.3 28.8 94 94 A E H X S+ 0 0 6 -4,-1.8 4,-3.2 2,-0.2 5,-0.2 0.922 105.5 51.7 -67.9 -43.6 -21.7 40.0 27.2 95 95 A H H X S+ 0 0 82 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.890 110.4 48.2 -61.0 -41.2 -21.7 43.6 28.1 96 96 A D H X S+ 0 0 80 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.935 113.2 48.6 -64.6 -44.8 -22.4 42.8 31.7 97 97 A A H X S+ 0 0 3 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.928 110.6 49.7 -61.3 -46.6 -19.6 40.2 31.7 98 98 A L H X S+ 0 0 1 -4,-3.2 4,-2.6 2,-0.2 5,-0.3 0.909 109.1 53.4 -58.8 -41.0 -17.1 42.6 30.1 99 99 A K H X S+ 0 0 138 -4,-2.1 4,-1.4 -5,-0.2 -1,-0.2 0.960 112.4 44.2 -57.3 -51.6 -18.0 45.2 32.7 100 100 A L H X S+ 0 0 34 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.878 113.4 50.3 -61.8 -41.5 -17.3 42.8 35.5 101 101 A Y H X S+ 0 0 0 -4,-2.8 4,-2.9 2,-0.2 -1,-0.2 0.865 107.2 52.3 -68.3 -37.7 -14.1 41.5 33.9 102 102 A R H X S+ 0 0 78 -4,-2.6 4,-2.0 -5,-0.2 -1,-0.2 0.856 112.7 47.7 -65.4 -32.8 -12.5 44.9 33.3 103 103 A E H X S+ 0 0 95 -4,-1.4 4,-2.2 -5,-0.3 -2,-0.2 0.954 114.3 43.7 -71.0 -53.6 -13.2 45.7 37.0 104 104 A A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.928 112.2 55.8 -58.3 -44.9 -11.7 42.4 38.3 105 105 A R H X S+ 0 0 31 -4,-2.9 4,-2.1 1,-0.2 -1,-0.2 0.922 106.2 49.0 -56.0 -48.4 -8.8 42.8 35.9 106 106 A D H X S+ 0 0 89 -4,-2.0 4,-2.5 1,-0.2 -1,-0.2 0.929 111.5 50.5 -58.6 -44.2 -7.9 46.2 37.3 107 107 A Y H X S+ 0 0 42 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.893 107.3 52.6 -62.3 -40.4 -8.1 44.9 40.8 108 108 A C H X>S+ 0 0 0 -4,-2.5 5,-2.0 1,-0.2 4,-0.9 0.910 110.7 48.8 -61.3 -40.8 -5.8 42.0 40.0 109 109 A A H ><5S+ 0 0 38 -4,-2.1 3,-0.8 -5,-0.2 -2,-0.2 0.946 110.5 50.2 -62.3 -49.2 -3.3 44.4 38.5 110 110 A E H 3<5S+ 0 0 160 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.907 114.4 43.6 -56.7 -45.2 -3.4 46.7 41.6 111 111 A V H 3<5S- 0 0 57 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.583 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14.2 51.9 243 82 B G S > S- 0 0 7 1,-0.1 4,-2.2 0, 0.0 5,-0.2 -0.975 93.2 -86.0-160.7 168.8 14.7 12.4 51.3 244 83 B P H > S+ 0 0 31 0, 0.0 4,-1.3 0, 0.0 3,-0.3 0.929 124.0 39.3 -46.2 -60.6 11.5 12.2 49.1 245 84 B R H > S+ 0 0 60 1,-0.2 4,-2.0 2,-0.2 3,-0.2 0.881 112.5 56.3 -62.7 -39.5 9.5 14.8 51.1 246 85 B E H > S+ 0 0 95 1,-0.2 4,-3.4 2,-0.2 -1,-0.2 0.870 102.9 55.0 -60.7 -38.4 12.4 17.1 51.7 247 86 B T H X S+ 0 0 0 -4,-2.2 4,-2.5 -3,-0.3 -1,-0.2 0.877 107.6 50.0 -64.3 -35.8 13.2 17.4 48.0 248 87 B L H X S+ 0 0 10 -4,-1.3 4,-2.4 -5,-0.2 -1,-0.2 0.918 113.1 47.5 -66.1 -41.8 9.6 18.5 47.4 249 88 B E H X S+ 0 0 71 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.925 112.2 48.2 -64.6 -46.4 10.0 21.0 50.2 250 89 B C H X S+ 0 0 28 -4,-3.4 4,-2.1 2,-0.2 -2,-0.2 0.911 112.7 48.0 -62.6 -41.8 13.4 22.3 48.8 251 90 B D H X S+ 0 0 2 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.926 112.6 48.9 -65.0 -42.1 12.0 22.7 45.3 252 91 B L H X S+ 0 0 19 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.896 108.9 53.8 -63.1 -39.3 8.9 24.5 46.6 253 92 B A H X S+ 0 0 30 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.903 108.5 49.7 -61.7 -41.1 11.2 26.8 48.7 254 93 B G H X S+ 0 0 22 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.825 107.2 54.9 -67.4 -31.7 13.2 27.6 45.5 255 94 B E H X S+ 0 0 5 -4,-1.7 4,-3.1 2,-0.2 5,-0.2 0.915 105.6 51.5 -67.4 -43.7 10.0 28.4 43.6 256 95 B H H X S+ 0 0 81 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.894 110.4 48.5 -61.8 -40.7 8.8 30.9 46.2 257 96 B D H X S+ 0 0 80 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.932 113.2 48.3 -64.9 -43.8 12.1 32.8 46.1 258 97 B A H X S+ 0 0 3 -4,-2.1 4,-2.8 1,-0.2 -2,-0.2 0.936 110.6 49.8 -62.1 -47.8 12.0 32.8 42.3 259 98 B L H X S+ 0 0 0 -4,-3.1 4,-2.7 1,-0.2 5,-0.3 0.909 109.1 53.4 -57.7 -41.9 8.4 34.1 42.1 260 99 B K H X S+ 0 0 134 -4,-2.1 4,-1.4 1,-0.2 -1,-0.2 0.958 112.5 44.2 -56.8 -51.2 9.4 36.8 44.6 261 100 B L H X S+ 0 0 36 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.871 113.5 50.3 -62.3 -40.1 12.2 37.9 42.4 262 101 B Y H X S+ 0 0 0 -4,-2.8 4,-3.0 2,-0.2 -1,-0.2 0.885 107.2 52.0 -69.1 -39.5 10.2 37.7 39.2 263 102 B R H X S+ 0 0 74 -4,-2.7 4,-2.0 -5,-0.2 -1,-0.2 0.854 112.8 48.0 -64.0 -32.8 7.3 39.8 40.5 264 103 B E H X S+ 0 0 97 -4,-1.4 4,-2.1 -5,-0.3 -2,-0.2 0.952 114.1 43.8 -70.9 -53.5 9.8 42.4 41.5 265 104 B A H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.930 112.3 55.6 -58.1 -45.0 11.6 42.4 38.1 266 105 B R H X S+ 0 0 31 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.926 106.0 49.3 -55.4 -49.8 8.3 42.4 36.3 267 106 B D H X S+ 0 0 86 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.927 111.4 50.3 -57.5 -43.8 7.1 45.5 38.1 268 107 B Y H X S+ 0 0 43 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.898 107.3 52.7 -63.2 -40.2 10.3 47.3 37.3 269 108 B C H X>S+ 0 0 0 -4,-2.5 5,-2.0 2,-0.2 4,-0.9 0.913 110.9 48.7 -61.0 -41.1 10.1 46.4 33.6 270 109 B A H ><5S+ 0 0 40 -4,-2.1 3,-0.8 2,-0.2 -2,-0.2 0.947 110.5 50.0 -62.2 -50.2 6.6 47.8 33.5 271 110 B E H 3<5S+ 0 0 157 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.909 114.6 43.8 -56.1 -44.3 7.6 51.0 35.2 272 111 B V H 3<5S- 0 0 56 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.597 113.5-119.3 -79.4 -9.7 10.5 51.5 32.8 273 112 B G T <<5 + 0 0 28 -4,-0.9 2,-1.7 -3,-0.8 -3,-0.2 0.644 61.2 147.6 83.4 13.3 8.3 50.6 29.8 274 113 B D >< + 0 0 17 -5,-2.0 4,-2.0 -6,-0.2 -1,-0.2 -0.639 21.5 178.5 -84.0 85.8 10.3 47.5 28.6 275 114 B I H > S+ 0 0 4 -2,-1.7 4,-2.3 2,-0.2 -1,-0.2 0.906 72.4 47.1 -55.4 -53.2 7.2 45.7 27.3 276 115 B V H > S+ 0 0 17 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.940 113.5 47.2 -60.3 -48.3 8.9 42.6 26.0 277 116 B S H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.870 110.0 56.2 -61.9 -33.5 11.1 42.0 29.0 278 117 B K H X S+ 0 0 5 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.946 106.3 48.4 -61.7 -49.1 8.0 42.5 31.2 279 118 B N H X S+ 0 0 47 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.806 104.5 60.3 -63.6 -28.9 6.1 39.8 29.4 280 119 B I H X S+ 0 0 23 -4,-1.7 4,-2.7 1,-0.2 -1,-0.2 0.939 107.8 45.0 -64.3 -43.1 9.0 37.4 29.8 281 120 B F H X S+ 0 0 0 -4,-1.7 4,-2.8 2,-0.2 -2,-0.2 0.824 111.3 52.5 -69.7 -29.0 8.7 37.8 33.5 282 121 B E H X S+ 0 0 10 -4,-1.7 4,-2.2 2,-0.2 -1,-0.2 0.878 110.8 48.8 -72.2 -33.6 4.9 37.4 33.3 283 122 B S H X S+ 0 0 48 -4,-2.4 4,-2.4 2,-0.2 -2,-0.2 0.935 113.3 45.9 -68.2 -44.8 5.6 34.2 31.3 284 123 B L H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.931 111.6 51.9 -63.5 -44.2 8.1 33.0 33.9 285 124 B I H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 5,-0.2 0.928 110.0 50.1 -57.5 -44.6 5.7 33.9 36.8 286 125 B T H X S+ 0 0 58 -4,-2.2 4,-1.4 2,-0.2 -1,-0.2 0.923 112.0 46.1 -61.3 -45.9 3.0 31.9 35.1 287 126 B D H X S+ 0 0 54 -4,-2.4 4,-1.9 1,-0.2 -2,-0.2 0.923 112.5 50.9 -63.6 -43.4 5.2 28.8 34.6 288 127 B E H X S+ 0 0 0 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.877 106.6 52.7 -64.7 -36.5 6.5 29.0 38.2 289 128 B E H X S+ 0 0 5 -4,-2.3 4,-2.5 -5,-0.2 -1,-0.2 0.859 106.8 56.5 -66.5 -29.1 3.0 29.2 39.6 290 129 B G H X S+ 0 0 37 -4,-1.4 4,-2.1 -5,-0.2 -2,-0.2 0.937 108.3 44.5 -64.4 -46.6 2.3 26.1 37.6 291 130 B H H X S+ 0 0 11 -4,-1.9 4,-3.1 2,-0.2 5,-0.2 0.890 112.1 53.3 -64.4 -40.4 5.2 24.3 39.3 292 131 B V H X S+ 0 0 0 -4,-2.6 4,-2.8 2,-0.2 5,-0.3 0.932 107.4 51.5 -59.7 -45.7 4.0 25.6 42.7 293 132 B D H X S+ 0 0 69 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.939 113.2 45.2 -55.2 -49.7 0.5 24.2 42.0 294 133 B F H X S+ 0 0 68 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.941 113.4 48.0 -60.2 -52.8 2.0 20.8 41.1 295 134 B L H X S+ 0 0 2 -4,-3.1 4,-2.7 1,-0.2 5,-0.2 0.884 110.9 51.6 -58.8 -40.7 4.4 20.6 44.1 296 135 B E H X S+ 0 0 48 -4,-2.8 4,-2.3 -5,-0.2 -1,-0.2 0.908 110.7 48.6 -64.6 -39.3 1.6 21.7 46.6 297 136 B T H X S+ 0 0 77 -4,-2.0 4,-2.2 -5,-0.3 -2,-0.2 0.901 113.3 47.6 -66.4 -39.1 -0.6 19.0 45.2 298 137 B Q H X S+ 0 0 33 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.876 111.5 49.0 -69.7 -37.3 2.2 16.4 45.5 299 138 B I H X S+ 0 0 17 -4,-2.7 4,-2.0 2,-0.2 -2,-0.2 0.909 112.4 49.3 -68.3 -39.8 3.1 17.5 49.1 300 139 B S H X S+ 0 0 60 -4,-2.3 4,-2.0 -5,-0.2 -2,-0.2 0.907 112.2 47.6 -63.5 -42.1 -0.6 17.2 50.0 301 140 B L H X S+ 0 0 48 -4,-2.2 4,-2.6 1,-0.2 5,-0.3 0.819 107.3 58.6 -68.3 -30.5 -0.8 13.8 48.4 302 141 B Y H X S+ 0 0 22 -4,-1.9 4,-2.7 2,-0.2 8,-0.3 0.931 108.6 42.9 -64.8 -46.2 2.4 12.8 50.2 303 142 B D H < S+ 0 0 95 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.884 115.2 50.3 -68.5 -37.1 0.9 13.5 53.6 304 143 B R H < S+ 0 0 190 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.917 119.1 36.0 -67.1 -43.5 -2.4 11.9 52.7 305 144 B L H < S- 0 0 72 -4,-2.6 4,-0.4 -5,-0.1 -2,-0.2 0.860 108.5-132.1 -77.4 -38.0 -0.7 8.7 51.4 306 145 B G X - 0 0 19 -4,-2.7 4,-2.9 -5,-0.3 5,-0.3 -0.039 32.4 -69.0 98.5 154.9 2.1 8.6 54.0 307 146 B P H > S+ 0 0 86 0, 0.0 4,-2.0 0, 0.0 5,-0.2 0.887 133.5 40.6 -44.1 -54.3 5.8 8.1 53.4 308 147 B Q H > S+ 0 0 175 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.917 115.7 49.9 -65.7 -44.8 5.6 4.5 52.4 309 148 B G H > S+ 0 0 29 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.902 112.3 46.7 -62.2 -41.9 2.5 4.9 50.3 310 149 B F H X S+ 0 0 3 -4,-2.9 4,-1.4 -8,-0.3 -1,-0.2 0.903 112.0 50.8 -66.8 -41.0 3.9 7.9 48.3 311 150 B A H < S+ 0 0 28 -4,-2.0 4,-0.4 -5,-0.3 3,-0.3 0.907 109.7 51.5 -62.8 -41.1 7.2 6.0 47.8 312 151 B L H >< S+ 0 0 137 -4,-2.5 3,-1.4 1,-0.2 -2,-0.2 0.944 107.4 51.8 -60.2 -49.1 5.2 3.0 46.5 313 152 B L H 3< S+ 0 0 89 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.766 117.9 38.5 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