==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-FEB-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 12-JAN-11 3QB9 . COMPND 2 MOLECULE: BACTERIOFERRITIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR L.M.MCMATH,C.W.GOULDING,TB STRUCTURAL GENOMICS CONSORTIUM (T . 954 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 41726.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 788 82.6 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 . 34 3.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 40 4.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 670 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.1 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 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 6 0 12 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 0 174 0, 0.0 2,-0.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 127.7 -52.2 -9.8 20.2 2 2 A Q - 0 0 141 64,-0.0 64,-0.2 1,-0.0 63,-0.1 -0.883 360.0-132.3-108.5 112.7 -51.1 -9.9 23.9 3 3 A G - 0 0 11 62,-1.8 110,-0.0 -2,-0.7 62,-0.0 -0.047 39.5 -76.4 -58.4 159.3 -53.4 -11.7 26.3 4 4 A D > - 0 0 44 1,-0.1 4,-2.6 107,-0.1 5,-0.2 -0.338 38.2-131.6 -61.3 133.0 -54.5 -10.2 29.7 5 5 A P H > S+ 0 0 82 0, 0.0 4,-1.3 0, 0.0 -1,-0.1 0.730 104.2 49.9 -60.6 -29.0 -51.7 -10.4 32.3 6 6 A D H > S+ 0 0 66 2,-0.2 4,-2.4 1,-0.1 5,-0.1 0.872 111.3 48.0 -79.3 -40.9 -53.9 -11.9 35.0 7 7 A V H > S+ 0 0 0 2,-0.2 4,-3.0 1,-0.2 5,-0.2 0.916 110.9 51.7 -59.9 -46.4 -55.4 -14.5 32.8 8 8 A L H X S+ 0 0 17 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.906 109.5 50.7 -60.2 -37.8 -51.8 -15.5 31.7 9 9 A R H X S+ 0 0 132 -4,-1.3 4,-2.2 -5,-0.2 -1,-0.2 0.936 111.2 48.0 -63.8 -44.9 -50.9 -15.7 35.3 10 10 A L H X S+ 0 0 16 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.933 110.9 51.0 -59.6 -45.6 -53.8 -18.0 36.0 11 11 A L H X S+ 0 0 0 -4,-3.0 4,-2.3 1,-0.2 -2,-0.2 0.885 110.8 48.2 -62.7 -40.0 -53.0 -20.1 32.9 12 12 A N H X S+ 0 0 24 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.858 110.5 52.5 -68.5 -33.1 -49.4 -20.5 34.1 13 13 A E H X S+ 0 0 85 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.942 110.7 45.6 -65.7 -47.7 -50.6 -21.4 37.5 14 14 A Q H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 -2,-0.2 0.914 111.2 55.2 -61.6 -39.0 -52.9 -24.1 36.2 15 15 A L H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.909 105.3 51.2 -58.4 -44.9 -50.0 -25.3 34.0 16 16 A T H X S+ 0 0 15 -4,-2.3 4,-2.4 1,-0.2 59,-0.5 0.940 111.0 49.5 -56.7 -45.3 -47.7 -25.7 37.0 17 17 A S H X S+ 0 0 10 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.863 108.8 51.5 -64.4 -37.2 -50.5 -27.8 38.6 18 18 A E H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.931 110.9 48.1 -65.5 -44.0 -50.9 -29.9 35.5 19 19 A L H X S+ 0 0 14 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.881 111.5 50.9 -61.5 -39.8 -47.1 -30.6 35.5 20 20 A T H X S+ 0 0 9 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.932 112.0 46.9 -60.6 -47.2 -47.3 -31.4 39.2 21 21 A A H X S+ 0 0 1 -4,-2.5 4,-3.0 1,-0.2 5,-0.3 0.859 107.8 56.6 -65.8 -37.3 -50.2 -33.8 38.6 22 22 A I H X S+ 0 0 18 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.951 112.3 40.8 -59.8 -51.4 -48.4 -35.5 35.6 23 23 A N H X S+ 0 0 28 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.935 117.4 47.5 -63.1 -47.8 -45.4 -36.4 37.7 24 24 A Q H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.937 115.4 44.1 -62.5 -46.7 -47.4 -37.4 40.8 25 25 A Y H X S+ 0 0 0 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.916 114.3 50.0 -66.1 -41.9 -49.8 -39.6 38.9 26 26 A F H X S+ 0 0 19 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.2 0.929 113.1 45.4 -62.0 -45.3 -47.2 -41.2 36.8 27 27 A L H X S+ 0 0 7 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.911 112.1 52.1 -66.3 -42.6 -45.0 -42.0 39.8 28 28 A H H X S+ 0 0 0 -4,-2.7 4,-3.0 -5,-0.2 -2,-0.2 0.934 108.4 52.0 -54.1 -46.4 -48.1 -43.3 41.6 29 29 A S H X S+ 0 0 2 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.907 110.2 48.2 -60.8 -40.3 -48.9 -45.6 38.6 30 30 A K H X S+ 0 0 11 -4,-2.1 4,-3.1 2,-0.2 -1,-0.2 0.909 112.7 47.5 -67.0 -42.4 -45.3 -47.0 38.6 31 31 A M H X S+ 0 0 16 -4,-2.6 4,-1.9 2,-0.2 6,-0.2 0.903 112.3 50.8 -63.6 -40.7 -45.4 -47.7 42.4 32 32 A Q H <>S+ 0 0 0 -4,-3.0 5,-1.6 -5,-0.2 4,-0.4 0.931 113.2 44.5 -61.3 -45.1 -48.8 -49.3 41.9 33 33 A D H ><5S+ 0 0 73 -4,-2.6 3,-1.8 1,-0.2 5,-0.2 0.958 112.0 53.5 -62.2 -47.6 -47.5 -51.5 39.1 34 34 A N H 3<5S+ 0 0 87 -4,-3.1 -1,-0.2 1,-0.3 -2,-0.2 0.812 106.2 53.7 -57.0 -33.4 -44.4 -52.2 41.1 35 35 A W T 3<5S- 0 0 92 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.457 124.0 -98.4 -80.7 -7.2 -46.5 -53.4 44.1 36 36 A G T < 5S+ 0 0 16 -3,-1.8 2,-1.8 -4,-0.4 119,-0.5 0.267 92.5 118.3 106.9 -12.5 -48.5 -55.9 42.1 37 37 A F >< + 0 0 37 -5,-1.6 4,-2.5 1,-0.2 117,-0.2 -0.349 28.2 151.6 -83.8 58.6 -51.6 -53.7 41.5 38 38 A T H > + 0 0 20 -2,-1.8 4,-1.8 -5,-0.2 -1,-0.2 0.821 65.7 55.8 -61.3 -31.8 -51.0 -53.8 37.8 39 39 A E H > S+ 0 0 105 114,-1.5 4,-0.9 -3,-0.3 -1,-0.2 0.951 111.4 40.8 -70.2 -48.6 -54.7 -53.4 37.0 40 40 A L H >> S+ 0 0 9 113,-1.1 4,-2.2 1,-0.2 3,-0.6 0.886 109.7 63.5 -63.1 -37.4 -55.1 -50.1 39.0 41 41 A A H 3X S+ 0 0 5 -4,-2.5 4,-2.9 112,-0.3 5,-0.2 0.923 96.8 54.5 -53.8 -50.2 -51.7 -49.0 37.6 42 42 A A H 3X S+ 0 0 65 -4,-1.8 4,-1.7 1,-0.2 -1,-0.2 0.837 110.4 47.5 -52.8 -37.0 -52.9 -48.9 34.0 43 43 A H H S+ 0 0 0 -4,-2.8 5,-3.2 1,-0.2 -2,-0.2 0.919 112.0 47.6 -54.4 -47.7 -50.5 -19.3 26.5 63 63 A L H ><5S+ 0 0 17 -4,-2.8 3,-2.0 1,-0.2 -1,-0.2 0.906 108.2 54.5 -63.2 -39.2 -48.5 -19.2 23.4 64 64 A L H 3<5S+ 0 0 81 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.860 108.2 50.6 -63.0 -31.5 -51.4 -17.9 21.4 65 65 A L T 3<5S- 0 0 8 -4,-1.8 -62,-1.8 -5,-0.2 -1,-0.3 0.223 121.4-111.7 -88.3 12.4 -51.7 -15.1 23.9 66 66 A D T < 5S+ 0 0 98 -3,-2.0 -3,-0.2 -64,-0.2 -2,-0.1 0.819 72.2 141.4 58.9 34.4 -48.0 -14.3 23.5 67 67 A G < - 0 0 8 -5,-3.2 -1,-0.2 -6,-0.2 -59,-0.0 -0.378 57.6-110.6 -94.5 178.2 -47.3 -15.6 27.0 68 68 A L - 0 0 139 -2,-0.1 2,-0.2 -3,-0.1 -5,-0.0 -0.915 27.8-140.6-111.4 105.5 -44.4 -17.6 28.4 69 69 A P - 0 0 13 0, 0.0 2,-0.8 0, 0.0 -57,-0.1 -0.508 17.9-133.4 -67.4 131.5 -45.4 -21.1 29.4 70 70 A N + 0 0 45 -2,-0.2 -11,-0.0 1,-0.1 -2,-0.0 -0.772 40.9 156.8 -90.0 109.7 -43.7 -21.9 32.6 71 71 A Y + 0 0 9 -2,-0.8 -1,-0.1 1,-0.1 112,-0.1 0.248 67.7 69.2-109.7 8.9 -42.1 -25.4 32.4 72 72 A Q S S+ 0 0 68 111,-0.1 2,-0.2 165,-0.0 162,-0.1 0.832 83.6 77.5 -94.0 -38.1 -39.6 -24.7 35.1 73 73 A R + 0 0 113 0, 0.0 2,-0.3 0, 0.0 -54,-0.1 -0.487 56.0 179.2 -80.8 139.8 -41.9 -24.4 38.1 74 74 A I - 0 0 46 -2,-0.2 -57,-0.1 -55,-0.1 -58,-0.1 -0.988 21.9-127.3-136.1 150.2 -43.3 -27.4 39.8 75 75 A G - 0 0 22 -59,-0.5 2,-0.6 -2,-0.3 -58,-0.0 -0.238 45.6 -78.6 -80.5 176.9 -45.6 -27.9 42.8 76 76 A S - 0 0 99 -2,-0.1 2,-0.1 1,-0.0 -1,-0.1 -0.709 47.1-133.3 -83.9 121.8 -44.9 -30.1 45.8 77 77 A L - 0 0 24 -2,-0.6 2,-0.6 1,-0.0 -56,-0.1 -0.449 8.0-152.4 -69.9 142.9 -45.5 -33.8 45.1 78 78 A R - 0 0 119 -2,-0.1 2,-0.7 8,-0.1 15,-0.1 -0.927 15.4-167.0-113.3 101.0 -47.5 -35.8 47.6 79 79 A I - 0 0 51 -2,-0.6 2,-0.1 10,-0.1 7,-0.1 -0.816 11.3-142.5 -96.3 116.5 -46.3 -39.4 47.1 80 80 A G - 0 0 4 -2,-0.7 6,-0.1 1,-0.1 3,-0.0 -0.458 11.1-158.9 -78.4 145.3 -48.5 -41.9 48.9 81 81 A Q S S+ 0 0 114 -2,-0.1 2,-0.3 -50,-0.0 -1,-0.1 0.511 80.4 37.3-100.2 -9.8 -47.0 -45.0 50.6 82 82 A T S > S- 0 0 63 1,-0.1 4,-2.6 0, 0.0 5,-0.2 -0.894 90.6-107.6-130.2 165.9 -50.3 -46.9 50.5 83 83 A L H > S+ 0 0 11 -2,-0.3 4,-2.3 1,-0.2 5,-0.2 0.949 123.7 49.0 -56.3 -47.9 -53.1 -47.2 48.0 84 84 A R H > S+ 0 0 57 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.919 110.5 50.6 -57.3 -44.3 -55.3 -45.1 50.3 85 85 A E H > S+ 0 0 89 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.911 108.9 51.8 -63.4 -38.9 -52.5 -42.5 50.7 86 86 A Q H X S+ 0 0 0 -4,-2.6 4,-2.9 2,-0.2 5,-0.2 0.929 109.3 49.2 -64.4 -42.7 -52.1 -42.3 46.9 87 87 A F H X S+ 0 0 2 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.919 113.0 46.9 -60.8 -45.4 -55.9 -41.7 46.4 88 88 A E H X S+ 0 0 90 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.891 112.6 50.9 -65.9 -36.7 -56.0 -39.0 49.1 89 89 A A H X S+ 0 0 10 -4,-2.4 4,-1.3 -5,-0.2 -2,-0.2 0.954 111.7 45.2 -67.3 -47.5 -52.8 -37.4 47.6 90 90 A D H X S+ 0 0 5 -4,-2.9 4,-1.7 1,-0.2 -1,-0.2 0.894 111.0 56.2 -62.2 -36.1 -54.2 -37.3 44.1 91 91 A L H X S+ 0 0 18 -4,-2.3 4,-2.1 -5,-0.2 -1,-0.2 0.893 99.7 58.6 -59.9 -44.0 -57.5 -35.9 45.5 92 92 A A H X S+ 0 0 33 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.878 105.6 49.6 -58.4 -39.0 -55.8 -33.0 47.2 93 93 A I H X S+ 0 0 5 -4,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.920 108.8 51.9 -62.9 -44.6 -54.4 -31.8 43.8 94 94 A E H X S+ 0 0 0 -4,-1.7 4,-1.9 1,-0.2 -2,-0.2 0.868 109.0 50.4 -65.8 -33.4 -57.8 -32.0 42.1 95 95 A Y H X S+ 0 0 94 -4,-2.1 4,-2.8 2,-0.2 -1,-0.2 0.889 107.2 54.0 -71.9 -37.2 -59.4 -30.0 44.9 96 96 A D H X S+ 0 0 69 -4,-1.8 4,-1.8 -5,-0.2 -2,-0.2 0.921 106.4 53.0 -60.1 -41.5 -56.7 -27.3 44.5 97 97 A V H X S+ 0 0 1 -4,-2.2 4,-2.8 1,-0.2 5,-0.2 0.937 110.7 46.7 -60.3 -46.4 -57.5 -27.1 40.8 98 98 A L H X S+ 0 0 17 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.952 109.6 52.9 -60.5 -48.6 -61.2 -26.6 41.5 99 99 A N H < S+ 0 0 113 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.828 116.8 40.6 -58.2 -29.3 -60.5 -23.9 44.2 100 100 A R H X S+ 0 0 38 -4,-1.8 4,-1.0 -5,-0.2 -1,-0.2 0.884 116.0 45.4 -85.3 -40.5 -58.3 -22.1 41.7 101 101 A L H X S+ 0 0 0 -4,-2.8 4,-3.3 -5,-0.2 5,-0.2 0.807 98.3 69.1 -80.8 -29.1 -60.3 -22.4 38.5 102 102 A K H X S+ 0 0 104 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.947 112.8 29.4 -57.9 -56.2 -63.8 -21.5 39.8 103 103 A P H > S+ 0 0 81 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.801 118.0 63.2 -69.7 -26.6 -63.1 -17.9 40.5 104 104 A G H X S+ 0 0 7 -4,-1.0 4,-2.6 2,-0.2 -2,-0.2 0.901 100.0 50.2 -64.0 -41.3 -60.6 -18.0 37.7 105 105 A I H X S+ 0 0 21 -4,-3.3 4,-2.1 2,-0.2 -1,-0.2 0.924 110.4 49.6 -64.2 -44.2 -63.2 -18.8 35.1 106 106 A V H X S+ 0 0 79 -4,-1.2 4,-2.2 -5,-0.2 -1,-0.2 0.906 110.6 51.5 -60.6 -42.7 -65.4 -15.9 36.2 107 107 A M H X S+ 0 0 42 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.958 107.6 51.8 -58.9 -52.0 -62.4 -13.6 36.0 108 108 A C H <>S+ 0 0 0 -4,-2.6 5,-2.9 1,-0.2 -1,-0.2 0.881 110.8 48.3 -51.6 -43.3 -61.6 -14.7 32.5 109 109 A R H ><5S+ 0 0 108 -4,-2.1 3,-1.2 3,-0.2 -1,-0.2 0.884 108.4 53.5 -71.0 -34.8 -65.1 -13.9 31.4 110 110 A E H 3<5S+ 0 0 143 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.899 108.6 49.7 -62.6 -40.1 -65.0 -10.5 33.1 111 111 A K T 3<5S- 0 0 84 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.389 120.1-116.3 -79.0 3.4 -61.8 -9.7 31.1 112 112 A Q T < 5S+ 0 0 180 -3,-1.2 2,-0.5 -5,-0.2 -3,-0.2 0.860 73.1 134.0 65.0 38.4 -63.7 -10.9 28.0 113 113 A D >< + 0 0 21 -5,-2.9 4,-1.7 -6,-0.1 -1,-0.2 -0.755 18.6 163.3-115.3 80.7 -61.5 -13.9 27.3 114 114 A T H > + 0 0 75 -2,-0.5 4,-3.1 2,-0.2 5,-0.2 0.781 69.3 60.0 -73.6 -27.3 -64.0 -16.6 26.6 115 115 A T H > S+ 0 0 82 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.945 108.9 44.0 -67.2 -43.9 -61.6 -19.0 24.9 116 116 A S H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.917 114.9 50.9 -63.6 -39.4 -59.4 -19.1 28.0 117 117 A A H X S+ 0 0 0 -4,-1.7 4,-2.9 1,-0.2 -2,-0.2 0.942 108.2 50.6 -63.3 -47.9 -62.6 -19.5 30.1 118 118 A V H X S+ 0 0 50 -4,-3.1 4,-2.0 1,-0.2 -1,-0.2 0.866 108.7 52.9 -58.8 -37.3 -63.9 -22.3 28.0 119 119 A L H X S+ 0 0 18 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.928 111.7 45.3 -64.5 -42.5 -60.6 -24.2 28.3 120 120 A L H X S+ 0 0 0 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.905 109.7 54.9 -67.0 -39.7 -60.8 -23.8 32.1 121 121 A E H X S+ 0 0 74 -4,-2.9 4,-2.4 1,-0.2 -1,-0.2 0.896 107.8 50.7 -58.1 -41.9 -64.5 -24.9 32.2 122 122 A K H X S+ 0 0 123 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.897 110.6 48.8 -61.3 -43.1 -63.4 -28.1 30.3 123 123 A I H X S+ 0 0 1 -4,-1.7 4,-2.8 2,-0.2 5,-0.2 0.907 109.0 52.4 -66.9 -42.0 -60.7 -28.8 32.8 124 124 A V H X S+ 0 0 14 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.967 108.5 50.7 -56.4 -52.8 -63.1 -28.3 35.7 125 125 A A H X S+ 0 0 44 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.909 112.8 46.5 -52.8 -43.5 -65.5 -30.8 34.2 126 126 A D H X S+ 0 0 76 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.912 113.0 48.8 -65.7 -40.6 -62.7 -33.3 33.8 127 127 A E H X S+ 0 0 3 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.880 106.5 56.3 -69.4 -38.2 -61.3 -32.7 37.3 128 128 A E H X S+ 0 0 89 -4,-3.0 4,-2.4 -5,-0.2 -1,-0.2 0.925 109.1 47.5 -56.5 -43.2 -64.8 -33.1 38.9 129 129 A E H X S+ 0 0 143 -4,-1.6 4,-2.1 -5,-0.2 -2,-0.2 0.876 111.1 49.8 -70.4 -36.7 -65.1 -36.5 37.3 130 130 A H H X S+ 0 0 11 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.923 110.5 51.1 -64.9 -41.3 -61.6 -37.5 38.4 131 131 A I H X S+ 0 0 7 -4,-3.0 4,-3.1 2,-0.2 5,-0.3 0.935 108.1 51.9 -60.5 -45.8 -62.5 -36.4 42.0 132 132 A D H X S+ 0 0 104 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.927 111.5 48.5 -55.4 -48.0 -65.7 -38.4 41.9 133 133 A Y H X S+ 0 0 51 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.947 112.6 45.9 -55.4 -55.1 -63.7 -41.5 40.8 134 134 A L H X S+ 0 0 2 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.891 113.9 49.3 -59.9 -40.1 -61.0 -41.0 43.5 135 135 A E H X S+ 0 0 61 -4,-3.1 4,-2.1 -5,-0.2 -1,-0.2 0.898 108.6 53.1 -68.0 -36.9 -63.7 -40.5 46.2 136 136 A T H X S+ 0 0 48 -4,-2.3 4,-2.7 -5,-0.3 -2,-0.2 0.909 105.9 54.0 -63.4 -40.5 -65.6 -43.6 45.1 137 137 A Q H X S+ 0 0 29 -4,-2.3 4,-1.8 1,-0.2 -1,-0.2 0.905 107.6 50.1 -60.7 -39.5 -62.5 -45.6 45.4 138 138 A L H X S+ 0 0 22 -4,-1.6 4,-1.2 1,-0.2 -1,-0.2 0.899 110.8 49.4 -67.1 -38.3 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114.2 49.7 -66.6 -37.4 -60.5 -57.2 49.5 149 149 A Y H >< S+ 0 0 9 -4,-2.6 3,-1.1 1,-0.2 4,-0.3 0.926 108.8 52.8 -65.1 -44.8 -60.3 -53.9 47.6 150 150 A S H >< S+ 0 0 26 -4,-2.7 3,-1.7 1,-0.3 4,-0.3 0.843 100.8 61.8 -57.9 -35.4 -56.6 -54.4 46.9 151 151 A A H >< S+ 0 0 49 -4,-1.7 3,-0.9 1,-0.3 -1,-0.3 0.776 96.5 58.9 -66.1 -24.5 -57.4 -57.8 45.4 152 152 A Q T << S+ 0 0 122 -3,-1.1 -1,-0.3 -4,-0.7 -2,-0.2 0.563 100.4 59.5 -78.9 -6.7 -59.6 -56.2 42.8 153 153 A C T < S+ 0 0 9 -3,-1.7 -114,-1.5 -4,-0.3 -113,-1.1 0.462 93.7 76.7-102.3 -3.4 -56.5 -54.2 41.7 154 154 A V S < S- 0 0 40 -3,-0.9 -117,-0.1 -4,-0.3 2,-0.1 -0.703 77.6-119.9-102.3 160.7 -54.3 -57.3 40.9 155 155 A S - 0 0 17 -119,-0.5 -2,-0.1 -2,-0.3 -1,-0.1 -0.401 44.1 -76.6 -87.5 170.9 -54.5 -59.5 37.8 156 156 A R S S+ 0 0 246 1,-0.2 3,-0.0 -2,-0.1 -1,-0.0 -0.921 128.1 11.7-115.0 105.4 -55.1 -63.3 37.8 157 157 A P S S- 0 0 97 0, 0.0 -1,-0.2 0, 0.0 -2,-0.1 0.692 111.5-107.0 -83.3 175.2 -52.6 -64.3 38.7 158 158 A P 0 0 87 0, 0.0 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109.4 50.5 -53.7 -42.7 -29.0 -45.2 43.2 169 9 B R H X S+ 0 0 136 -4,-2.2 4,-2.3 -5,-0.2 -1,-0.2 0.916 110.3 50.2 -64.4 -43.5 -27.9 -41.5 43.5 170 10 B L H X S+ 0 0 12 -4,-2.6 4,-2.7 2,-0.2 -2,-0.2 0.933 109.6 50.6 -57.8 -48.4 -26.4 -41.6 40.0 171 11 B L H X S+ 0 0 0 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.932 111.1 48.2 -57.9 -46.4 -29.7 -43.0 38.6 172 12 B N H X S+ 0 0 25 -4,-2.4 4,-2.2 2,-0.2 -1,-0.2 0.880 109.8 53.1 -63.2 -35.7 -31.7 -40.3 40.3 173 13 B E H X S+ 0 0 69 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.934 110.9 46.6 -62.7 -45.0 -29.3 -37.7 38.9 174 14 B Q H X S+ 0 0 0 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.909 109.5 54.2 -63.2 -40.7 -29.8 -39.1 35.4 175 15 B L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 5,-0.2 0.908 106.4 52.0 -60.2 -41.8 -33.6 -39.1 36.0 176 16 B T H X S+ 0 0 15 -4,-2.2 4,-2.1 1,-0.2 59,-0.6 0.911 109.4 50.3 -57.6 -42.8 -33.5 -35.4 36.9 177 17 B S H X S+ 0 0 11 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.882 110.2 49.9 -67.5 -37.2 -31.6 -34.8 33.7 178 18 B E H X S+ 0 0 1 -4,-2.3 4,-2.9 2,-0.2 -2,-0.2 0.941 110.4 48.7 -61.9 -49.9 -34.2 -36.7 31.7 179 19 B L H X S+ 0 0 13 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.881 111.3 51.1 -60.9 -36.8 -37.2 -34.9 33.2 180 20 B T H X S+ 0 0 10 -4,-2.1 4,-2.6 -5,-0.2 -1,-0.2 0.913 111.0 48.6 -62.0 -44.8 -35.4 -31.6 32.5 181 21 B A H X S+ 0 0 1 -4,-1.9 4,-3.3 2,-0.2 5,-0.4 0.899 106.7 56.0 -66.2 -42.2 -34.8 -32.7 28.9 182 22 B I H X S+ 0 0 20 -4,-2.9 4,-2.8 2,-0.2 5,-0.2 0.960 113.0 40.5 -52.0 -55.1 -38.5 -33.7 28.4 183 23 B N H X S+ 0 0 28 -4,-1.9 4,-2.6 2,-0.2 5,-0.3 0.929 117.5 48.7 -62.7 -46.0 -39.7 -30.2 29.4 184 24 B Q H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.941 116.0 41.6 -61.7 -49.9 -37.0 -28.4 27.5 185 25 B Y H X S+ 0 0 0 -4,-3.3 4,-2.2 2,-0.2 -1,-0.2 0.924 114.7 51.8 -64.8 -44.1 -37.5 -30.3 24.3 186 26 B F H X S+ 0 0 17 -4,-2.8 4,-1.9 -5,-0.4 -2,-0.2 0.964 112.9 44.0 -58.4 -51.8 -41.2 -30.3 24.5 187 27 B L H X S+ 0 0 6 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.893 111.0 54.9 -60.2 -41.6 -41.4 -26.5 25.0 188 28 B H H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.3 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4,-1.6 1,-0.2 -1,-0.2 0.795 65.9 52.7 -68.0 -32.5 -43.7 -27.3 11.8 199 39 B E H > S+ 0 0 68 114,-1.6 4,-1.0 -3,-0.3 -1,-0.2 0.946 113.7 43.0 -72.3 -46.9 -41.5 -29.9 10.2 200 40 B L H >> S+ 0 0 0 113,-1.2 4,-1.9 1,-0.2 3,-1.2 0.953 108.6 61.4 -56.7 -48.1 -38.7 -29.3 12.6 201 41 B A H 3X S+ 0 0 5 -4,-2.9 4,-2.8 112,-0.3 -2,-0.2 0.849 98.4 55.5 -51.1 -42.1 -41.2 -29.2 15.5 202 42 B A H 3X S+ 0 0 65 -4,-1.6 4,-1.7 1,-0.2 -1,-0.3 0.849 108.6 49.0 -59.3 -37.3 -42.3 -32.8 14.9 203 43 B H H S+ 0 0 0 -4,-2.8 5,-3.1 1,-0.2 -2,-0.2 0.935 112.6 48.1 -55.9 -47.3 -34.6 -47.4 40.6 223 63 B L H ><5S+ 0 0 16 -4,-2.8 3,-1.7 1,-0.2 -1,-0.2 0.888 109.2 54.0 -61.7 -36.9 -37.8 -49.0 41.8 224 64 B L H 3<5S+ 0 0 80 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.866 107.2 51.0 -64.7 -34.8 -36.3 -52.5 41.1 225 65 B L T 3<5S- 0 0 9 -4,-2.0 -62,-2.3 -3,-0.2 -1,-0.3 0.196 121.4-111.6 -85.8 12.9 -33.3 -51.5 43.3 226 66 B D T < 5S+ 0 0 97 -3,-1.7 -3,-0.2 -64,-0.2 -2,-0.1 0.728 73.9 136.8 63.8 23.1 -35.7 -50.4 46.0 227 67 B G < - 0 0 10 -5,-3.1 -1,-0.2 -6,-0.2 -58,-0.0 -0.309 59.9-107.8 -91.4-179.4 -34.8 -46.8 45.5 228 68 B L - 0 0 137 -2,-0.1 2,-0.1 -3,-0.1 -5,-0.0 -0.912 28.6-135.4-114.5 105.9 -37.1 -43.7 45.4 229 69 B P - 0 0 13 0, 0.0 2,-0.9 0, 0.0 3,-0.1 -0.373 19.3-131.1 -60.9 132.9 -37.4 -42.2 41.9 230 70 B N + 0 0 43 1,-0.2 -11,-0.0 -2,-0.1 -2,-0.0 -0.752 43.1 154.5 -91.6 102.8 -37.1 -38.4 42.2 231 71 B Y + 0 0 8 -2,-0.9 -1,-0.2 1,-0.1 -208,-0.1 0.313 64.5 71.2-104.9 7.3 -40.0 -36.7 40.3 232 72 B Q S S+ 0 0 67 -209,-0.1 2,-0.3 -3,-0.1 -1,-0.1 0.792 83.2 76.1 -89.7 -33.3 -39.8 -33.5 42.3 233 73 B R + 0 0 109 0, 0.0 2,-0.4 0, 0.0 -54,-0.1 -0.622 51.4 177.9 -95.0 134.9 -36.6 -32.1 41.1 234 74 B I - 0 0 35 -2,-0.3 -57,-0.1 -162,-0.1 3,-0.1 -0.999 21.4-134.1-133.3 136.2 -36.0 -30.4 37.8 235 75 B G - 0 0 27 -59,-0.6 2,-0.6 -2,-0.4 -58,-0.0 0.057 47.0 -64.9 -71.3-172.4 -32.8 -28.8 36.5 236 76 B S - 0 0 99 1,-0.0 -1,-0.1 2,-0.0 2,-0.1 -0.688 49.2-137.9 -82.8 122.0 -32.5 -25.4 34.9 237 77 B L - 0 0 25 -2,-0.6 2,-0.6 -3,-0.1 -56,-0.1 -0.472 6.4-154.9 -67.8 142.5 -34.2 -25.1 31.6 238 78 B R - 0 0 108 -2,-0.1 2,-0.6 8,-0.1 15,-0.1 -0.949 15.2-165.7-114.6 104.7 -32.4 -23.2 28.8 239 79 B I - 0 0 54 -2,-0.6 2,-0.3 10,-0.1 7,-0.1 -0.836 11.9-138.8 -95.0 123.4 -35.2 -22.0 26.5 240 80 B G - 0 0 2 -2,-0.6 3,-0.1 1,-0.1 -49,-0.0 -0.580 13.0-161.5 -82.7 141.4 -33.9 -20.8 23.2 241 81 B Q S S+ 0 0 107 -2,-0.3 2,-0.3 1,-0.1 -1,-0.1 0.474 81.2 33.5 -97.8 -5.8 -35.3 -17.7 21.5 242 82 B T S > S- 0 0 67 1,-0.1 4,-2.8 0, 0.0 5,-0.2 -0.960 89.7-107.8-140.0 161.0 -34.0 -18.7 18.1 243 83 B L H > S+ 0 0 11 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.905 121.5 52.3 -54.7 -42.0 -33.6 -22.0 16.3 244 84 B R H > S+ 0 0 58 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.947 110.8 46.1 -58.3 -51.0 -29.8 -21.6 16.7 245 85 B E H > S+ 0 0 89 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.896 110.5 53.2 -58.7 -45.0 -30.1 -21.0 20.5 246 86 B Q H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 5,-0.2 0.899 110.2 47.3 -59.0 -42.3 -32.5 -23.9 21.0 247 87 B F H X S+ 0 0 2 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.909 114.2 47.5 -66.9 -41.4 -30.1 -26.3 19.2 248 88 B E H X S+ 0 0 92 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.872 112.6 50.2 -65.6 -32.8 -27.3 -24.9 21.4 249 89 B A H X S+ 0 0 9 -4,-2.7 4,-1.3 2,-0.2 -2,-0.2 0.938 113.1 43.3 -73.3 -45.0 -29.5 -25.3 24.5 250 90 B D H X S+ 0 0 4 -4,-2.8 4,-1.7 1,-0.2 3,-0.2 0.894 111.5 57.3 -64.2 -39.0 -30.5 -28.8 23.8 251 91 B L H X S+ 0 0 23 -4,-2.4 4,-1.8 -5,-0.2 -2,-0.2 0.898 101.9 55.1 -58.5 -42.8 -26.8 -29.6 22.9 252 92 B A H X S+ 0 0 28 -4,-1.9 4,-1.5 1,-0.2 -1,-0.2 0.868 104.9 52.9 -62.3 -37.8 -25.6 -28.3 26.3 253 93 B I H X S+ 0 0 9 -4,-1.3 4,-1.8 -3,-0.2 3,-0.2 0.940 106.9 51.1 -61.6 -49.7 -27.9 -30.8 28.2 254 94 B E H X S+ 0 0 1 -4,-1.7 4,-2.2 1,-0.2 5,-0.2 0.887 105.6 55.4 -58.6 -40.5 -26.7 -33.8 26.3 255 95 B Y H X S+ 0 0 56 -4,-1.8 4,-2.7 1,-0.2 -1,-0.2 0.902 104.5 54.7 -60.6 -37.4 -23.1 -33.0 27.0 256 96 B D H X S+ 0 0 72 -4,-1.5 4,-2.3 -3,-0.2 -1,-0.2 0.922 105.7 53.2 -58.0 -44.7 -23.9 -32.9 30.7 257 97 B V H X S+ 0 0 1 -4,-1.8 4,-3.5 2,-0.2 5,-0.3 0.942 111.2 44.9 -53.5 -53.3 -25.3 -36.4 30.3 258 98 B L H X S+ 0 0 8 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.926 111.1 54.0 -58.0 -46.9 -22.1 -37.7 28.8 259 99 B N H < S+ 0 0 119 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.874 117.6 36.9 -57.9 -37.6 -20.0 -35.9 31.3 260 100 B R H X S+ 0 0 64 -4,-2.3 4,-1.3 -5,-0.2 -2,-0.2 0.916 118.1 46.3 -80.0 -46.8 -22.0 -37.6 34.1 261 101 B L H X S+ 0 0 0 -4,-3.5 4,-2.7 -5,-0.2 5,-0.2 0.733 97.0 71.0 -76.4 -22.1 -22.5 -41.1 32.7 262 102 B K H X S+ 0 0 49 -4,-2.2 4,-1.2 -5,-0.3 -1,-0.2 0.974 114.3 26.1 -59.5 -56.0 -19.0 -41.8 31.4 263 103 B P H > S+ 0 0 61 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.788 116.8 68.3 -73.9 -23.1 -17.5 -42.2 34.9 264 104 B G H X S+ 0 0 5 -4,-1.3 4,-2.5 1,-0.2 -2,-0.2 0.928 100.4 45.8 -56.8 -46.3 -20.9 -43.2 36.0 265 105 B I H X S+ 0 0 4 -4,-2.7 4,-2.4 2,-0.2 -1,-0.2 0.920 109.5 52.9 -67.8 -45.0 -20.8 -46.5 34.0 266 106 B V H X S+ 0 0 50 -4,-1.2 4,-2.0 -5,-0.2 -1,-0.2 0.899 111.7 48.7 -55.0 -41.4 -17.3 -47.4 35.1 267 107 B M H X S+ 0 0 43 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.935 107.0 53.8 -65.6 -50.3 -18.5 -46.9 38.7 268 108 B C H <>S+ 0 0 0 -4,-2.5 5,-2.6 1,-0.2 -1,-0.2 0.908 110.1 48.9 -49.0 -45.1 -21.6 -49.1 38.2 269 109 B R H ><5S+ 0 0 82 -4,-2.4 3,-1.7 1,-0.2 -1,-0.2 0.910 108.2 52.0 -69.0 -40.4 -19.4 -51.9 36.9 270 110 B E H 3<5S+ 0 0 149 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.874 107.8 52.8 -58.3 -38.5 -17.0 -51.6 39.9 271 111 B K T 3<5S- 0 0 78 -4,-2.4 -1,-0.3 -5,-0.1 -2,-0.2 0.268 119.2-118.5 -79.8 11.3 -20.0 -51.9 42.2 272 112 B Q T < 5S+ 0 0 175 -3,-1.7 2,-0.6 -5,-0.2 -3,-0.2 0.833 73.0 133.4 53.1 41.0 -20.8 -55.0 40.2 273 113 B D >< + 0 0 20 -5,-2.6 4,-1.7 -6,-0.2 -1,-0.2 -0.784 19.2 163.1-116.5 83.5 -24.2 -53.6 39.0 274 114 B T H > + 0 0 75 -2,-0.6 4,-2.9 1,-0.2 5,-0.2 0.827 69.2 59.7 -75.4 -30.0 -24.0 -54.5 35.3 275 115 B T H > S+ 0 0 82 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.921 108.2 44.4 -64.7 -43.9 -27.7 -54.0 34.6 276 116 B S H > S+ 0 0 0 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.938 114.4 51.6 -63.0 -46.8 -27.7 -50.4 35.7 277 117 B A H X S+ 0 0 0 -4,-1.7 4,-2.7 1,-0.2 -2,-0.2 0.897 107.0 51.6 -54.2 -48.0 -24.5 -50.0 33.7 278 118 B V H X S+ 0 0 53 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.865 108.2 53.3 -61.5 -35.9 -26.0 -51.4 30.6 279 119 B L H X S+ 0 0 17 -4,-1.8 4,-1.6 -5,-0.2 -1,-0.2 0.924 111.7 44.6 -63.5 -42.4 -28.9 -49.0 30.9 280 120 B L H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.874 109.4 55.5 -73.5 -34.6 -26.6 -46.1 31.1 281 121 B E H X S+ 0 0 15 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.889 107.0 51.4 -60.8 -38.2 -24.5 -47.4 28.2 282 122 B K H X S+ 0 0 120 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.897 110.4 49.0 -64.0 -39.0 -27.6 -47.5 26.1 283 123 B I H X S+ 0 0 0 -4,-1.6 4,-2.2 1,-0.2 -2,-0.2 0.916 107.9 52.5 -69.6 -42.5 -28.4 -43.9 27.1 284 124 B V H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.903 108.6 52.8 -57.8 -43.2 -24.8 -42.7 26.2 285 125 B A H X S+ 0 0 25 -4,-2.0 4,-1.6 1,-0.2 -2,-0.2 0.927 111.6 43.8 -59.6 -48.6 -25.2 -44.3 22.8 286 126 B D H X S+ 0 0 73 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.820 112.8 53.1 -64.8 -34.2 -28.5 -42.5 22.0 287 127 B E H X S+ 0 0 1 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.904 104.9 53.5 -72.7 -42.0 -27.2 -39.2 23.4 288 128 B E H X S+ 0 0 6 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.929 109.7 49.5 -54.1 -46.2 -24.1 -39.3 21.2 289 129 B E H X S+ 0 0 126 -4,-1.6 4,-2.5 1,-0.2 -2,-0.2 0.933 112.2 47.2 -60.5 -45.3 -26.4 -39.7 18.2 290 130 B H H X S+ 0 0 10 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.867 110.2 52.5 -64.9 -38.8 -28.6 -36.8 19.2 291 131 B I H X S+ 0 0 0 -4,-3.0 4,-2.9 2,-0.2 5,-0.3 0.896 109.5 50.8 -59.3 -40.3 -25.5 -34.7 19.9 292 132 B D H X S+ 0 0 36 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.946 110.0 48.6 -65.4 -49.5 -24.3 -35.5 16.3 293 133 B Y H X S+ 0 0 30 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.945 114.5 45.7 -52.3 -52.5 -27.7 -34.6 14.8 294 134 B L H X S+ 0 0 2 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.932 113.6 47.5 -63.2 -46.8 -27.8 -31.3 16.7 295 135 B E H X S+ 0 0 40 -4,-2.9 4,-1.9 1,-0.2 -1,-0.2 0.890 112.5 51.7 -58.2 -38.4 -24.1 -30.3 15.9 296 136 B T H X S+ 0 0 8 -4,-2.6 4,-2.5 -5,-0.3 -2,-0.2 0.908 105.2 55.1 -66.6 -41.2 -24.9 -31.3 12.3 297 137 B Q H X S+ 0 0 0 -4,-2.6 4,-1.6 1,-0.2 -1,-0.2 0.878 108.2 49.7 -56.5 -37.4 -27.9 -29.0 12.3 298 138 B L H X S+ 0 0 24 -4,-1.7 4,-1.1 2,-0.2 -1,-0.2 0.881 109.6 49.8 -73.0 -39.0 -25.7 -26.1 13.4 299 139 B E H X S+ 0 0 83 -4,-1.9 4,-2.4 1,-0.2 3,-0.4 0.887 108.7 53.8 -61.1 -42.6 -23.2 -26.8 10.7 300 140 B L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.3 5,-0.4 0.848 102.0 58.3 -63.9 -33.9 -26.0 -26.9 8.2 301 141 B M H X S+ 0 0 4 -4,-1.6 4,-1.4 -5,-0.2 -1,-0.3 0.860 109.4 45.6 -61.7 -33.4 -27.1 -23.5 9.4 302 142 B D H < S+ 0 0 107 -4,-1.1 -2,-0.2 -3,-0.4 -1,-0.2 0.930 116.4 42.9 -77.1 -45.7 -23.6 -22.2 8.5 303 143 B K H < S+ 0 0 78 -4,-2.4 -2,-0.2 1,-0.2 -3,-0.2 0.938 125.7 32.9 -64.2 -48.7 -23.4 -23.8 5.1 304 144 B L H < S- 0 0 4 -4,-2.9 4,-0.3 -5,-0.2 -3,-0.2 0.795 111.2-118.7 -79.8 -26.3 -27.0 -23.0 4.0 305 145 B G X - 0 0 27 -4,-1.4 4,-3.1 -5,-0.4 5,-0.3 -0.008 30.9 -83.8 91.4 150.9 -27.4 -19.7 5.8 306 146 B E H > S+ 0 0 90 1,-0.2 4,-2.7 2,-0.2 5,-0.1 0.919 127.3 43.6 -55.7 -54.0 -29.9 -19.0 8.5 307 147 B E H > S+ 0 0 151 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.924 116.3 47.6 -58.9 -48.0 -32.9 -18.1 6.3 308 148 B L H > S+ 0 0 38 -4,-0.3 4,-0.9 1,-0.2 -1,-0.2 0.911 113.0 47.3 -65.4 -44.1 -32.2 -21.0 3.9 309 149 B Y H >< S+ 0 0 0 -4,-3.1 3,-1.0 -8,-0.2 -1,-0.2 0.942 112.0 52.3 -59.1 -44.4 -31.8 -23.5 6.7 310 150 B S H >< S+ 0 0 24 -4,-2.7 3,-2.2 -5,-0.3 4,-0.3 0.881 100.7 59.9 -64.3 -38.3 -35.0 -22.2 8.3 311 151 B A H >< S+ 0 0 40 -4,-2.5 3,-0.9 1,-0.3 -1,-0.3 0.774 96.5 61.8 -61.9 -25.1 -37.0 -22.5 5.1 312 152 B Q T << S+ 0 0 6 -3,-1.0 -1,-0.3 -4,-0.9 -2,-0.2 0.544 99.5 59.6 -73.8 -4.8 -36.3 -26.3 5.1 313 153 B C T < S+ 0 0 0 -3,-2.2 -114,-1.6 -4,-0.2 -113,-1.2 0.480 92.5 74.9-103.8 -6.4 -38.1 -26.4 8.5 314 154 B V S < S- 0 0 25 -3,-0.9 -117,-0.1 -4,-0.3 2,-0.1 -0.702 77.6-121.4-103.9 157.6 -41.5 -25.1 7.3 315 155 B S - 0 0 20 -119,-0.5 -1,-0.1 -2,-0.3 -2,-0.1 -0.246 42.5 -75.2 -83.1-178.5 -44.1 -27.0 5.3 316 156 B R S S+ 0 0 167 1,-0.1 3,-0.0 2,-0.1 -1,-0.0 -0.943 127.1 15.5-129.5 109.1 -45.5 -26.0 1.9 317 157 B P S S- 0 0 97 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.671 113.3-106.4 -76.2 177.3 -47.3 -23.9 2.2 318 158 B P 0 0 95 0, 0.0 -2,-0.1 0, 0.0 -121,-0.1 -0.498 360.0 360.0 -65.2 131.8 -46.3 -22.8 5.7 319 159 B T 0 0 124 -123,-0.3 -121,-0.1 -2,-0.2 0, 0.0 0.037 360.0 360.0-117.3 360.0 -49.0 -23.9 8.3 320 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 321 1 C M 0 0 179 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 125.3 -10.5 -72.1 -22.2 322 2 C Q - 0 0 137 64,-0.0 64,-0.2 0, 0.0 2,-0.1 -0.943 360.0-131.7-124.0 132.4 -7.9 -69.4 -21.8 323 3 C G - 0 0 8 62,-2.8 110,-0.0 -2,-0.4 59,-0.0 -0.453 34.3 -94.9 -81.0 148.3 -8.1 -65.7 -22.2 324 4 C D > - 0 0 52 -2,-0.1 4,-2.7 1,-0.1 5,-0.2 -0.419 35.7-132.6 -56.3 128.5 -5.8 -63.4 -24.2 325 5 C P H > S+ 0 0 94 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.799 104.0 48.7 -64.9 -30.9 -3.3 -62.2 -21.6 326 6 C D H > S+ 0 0 76 2,-0.2 4,-2.4 1,-0.2 5,-0.1 0.877 110.5 50.5 -73.1 -41.2 -3.5 -58.5 -22.7 327 7 C V H > S+ 0 0 0 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.940 111.2 50.4 -55.1 -48.0 -7.3 -58.6 -22.6 328 8 C L H X S+ 0 0 18 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.850 108.8 50.8 -60.9 -36.0 -6.9 -60.1 -19.1 329 9 C R H X S+ 0 0 97 -4,-1.6 4,-2.2 -5,-0.2 -1,-0.2 0.915 111.1 49.5 -65.6 -41.2 -4.5 -57.3 -18.1 330 10 C L H X S+ 0 0 6 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.915 110.7 48.8 -62.6 -45.1 -7.1 -54.8 -19.4 331 11 C L H X S+ 0 0 0 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.938 111.5 49.8 -64.2 -44.6 -9.9 -56.4 -17.4 332 12 C N H X S+ 0 0 24 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.882 108.0 52.8 -62.8 -40.0 -7.8 -56.4 -14.2 333 13 C E H X S+ 0 0 71 -4,-2.2 4,-1.7 2,-0.2 -1,-0.2 0.907 112.4 45.7 -57.8 -42.4 -6.9 -52.8 -14.6 334 14 C Q H X S+ 0 0 0 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.886 107.9 57.3 -71.0 -37.6 -10.6 -51.9 -14.9 335 15 C L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.942 106.4 49.5 -54.3 -47.9 -11.3 -54.2 -12.0 336 16 C T H X S+ 0 0 14 -4,-2.4 4,-2.6 1,-0.2 59,-0.5 0.886 109.1 52.9 -60.0 -40.3 -8.9 -52.1 -9.9 337 17 C S H X S+ 0 0 16 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.921 108.9 49.2 -62.0 -44.5 -10.7 -49.0 -11.1 338 18 C E H X S+ 0 0 0 -4,-2.7 4,-2.9 2,-0.2 -2,-0.2 0.947 111.3 48.6 -59.0 -49.6 -14.1 -50.4 -10.0 339 19 C L H X S+ 0 0 12 -4,-2.6 4,-2.0 1,-0.2 5,-0.2 0.918 111.7 49.8 -58.1 -44.7 -12.8 -51.3 -6.5 340 20 C T H X S+ 0 0 11 -4,-2.6 4,-2.3 -5,-0.2 -1,-0.2 0.925 112.4 48.8 -56.1 -45.3 -11.3 -47.8 -6.2 341 21 C A H X S+ 0 0 0 -4,-2.4 4,-3.1 2,-0.2 5,-0.4 0.894 106.5 55.6 -63.5 -43.6 -14.6 -46.4 -7.3 342 22 C I H X S+ 0 0 25 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.952 113.1 41.5 -55.1 -52.4 -16.6 -48.5 -4.8 343 23 C N H X S+ 0 0 28 -4,-2.0 4,-2.6 2,-0.2 5,-0.2 0.918 116.3 48.3 -61.6 -45.1 -14.6 -47.2 -1.9 344 24 C Q H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.914 115.4 43.4 -68.2 -40.6 -14.5 -43.6 -3.0 345 25 C Y H X S+ 0 0 0 -4,-3.1 4,-1.9 2,-0.2 -1,-0.2 0.883 113.2 52.0 -72.7 -37.8 -18.2 -43.4 -3.7 346 26 C F H X S+ 0 0 21 -4,-2.3 4,-2.2 -5,-0.4 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1,-0.2 5,-0.2 0.864 105.1 57.1 -71.1 -34.2 -53.5 -21.2 -25.9 928 128 F E H X S+ 0 0 92 -4,-2.6 4,-2.4 -5,-0.2 -1,-0.2 0.938 108.4 46.5 -62.4 -44.1 -54.8 -18.5 -23.7 929 129 F E H X S+ 0 0 139 -4,-1.6 4,-2.4 2,-0.2 -1,-0.2 0.912 112.8 49.8 -63.2 -41.3 -54.3 -20.6 -20.6 930 130 F H H X S+ 0 0 11 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.909 110.6 50.0 -63.3 -41.1 -50.9 -21.7 -21.8 931 131 F I H X S+ 0 0 9 -4,-2.8 4,-2.5 1,-0.2 -1,-0.2 0.911 109.4 51.9 -63.2 -41.1 -49.9 -18.1 -22.4 932 132 F D H X S+ 0 0 97 -4,-2.4 4,-2.4 -5,-0.2 -2,-0.2 0.924 109.1 50.1 -63.1 -41.4 -51.2 -17.1 -18.9 933 133 F Y H X S+ 0 0 50 -4,-2.4 4,-2.4 1,-0.2 -1,-0.2 0.921 110.4 49.4 -63.2 -41.5 -49.0 -19.9 -17.4 934 134 F L H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.914 110.9 50.2 -63.2 -41.1 -46.0 -18.7 -19.3 935 135 F E H X S+ 0 0 65 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.899 109.4 51.1 -63.2 -40.9 -46.6 -15.1 -18.1 936 136 F T H X S+ 0 0 48 -4,-2.4 4,-3.2 1,-0.2 -1,-0.2 0.900 108.8 51.5 -63.1 -40.9 -47.0 -16.3 -14.6 937 137 F Q H X S+ 0 0 26 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.907 109.8 49.3 -63.0 -40.8 -43.7 -18.2 -14.8 938 138 F L H X S+ 0 0 23 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.918 113.7 47.2 -63.9 -42.0 -42.0 -15.0 -16.1 939 139 F E H X S+ 0 0 101 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.912 108.7 53.3 -62.8 -46.9 -43.5 -13.1 -13.2 940 140 F L H X S+ 0 0 60 -4,-3.2 4,-3.9 1,-0.2 5,-0.4 0.890 104.1 57.3 -57.8 -40.3 -42.5 -15.7 -10.6 941 141 F M H X S+ 0 0 8 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.914 109.7 45.2 -55.5 -43.5 -38.9 -15.4 -11.9 942 142 F D H < S+ 0 0 113 -4,-1.3 -2,-0.2 2,-0.2 -1,-0.2 0.921 118.0 42.2 -66.7 -45.3 -39.0 -11.7 -11.1 943 143 F K H < S+ 0 0 162 -4,-2.5 -2,-0.2 1,-0.2 -3,-0.2 0.914 124.7 34.1 -68.9 -45.2 -40.6 -12.1 -7.7 944 144 F L H < S- 0 0 68 -4,-3.9 4,-0.3 -5,-0.2 -3,-0.2 0.731 111.2-114.6 -84.3 -19.7 -38.5 -15.1 -6.6 945 145 F G X - 0 0 28 -4,-1.8 4,-2.5 -5,-0.4 5,-0.2 0.029 31.8 -90.1 87.0 149.5 -35.3 -14.2 -8.3 946 146 F E H > S+ 0 0 95 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.919 123.6 45.9 -64.3 -48.1 -33.9 -16.4 -11.0 947 147 F E H > S+ 0 0 99 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.958 115.4 46.7 -59.6 -53.1 -31.8 -18.8 -8.9 948 148 F L H > S+ 0 0 70 -4,-0.3 4,-0.8 1,-0.2 -1,-0.2 0.912 113.3 50.1 -55.8 -44.5 -34.5 -19.3 -6.4 949 149 F Y H >< S+ 0 0 8 -4,-2.5 3,-1.5 1,-0.2 -1,-0.2 0.938 108.7 51.6 -60.5 -45.3 -37.0 -19.8 -9.2 950 150 F S H >< S+ 0 0 15 -4,-2.8 3,-2.1 1,-0.3 4,-0.5 0.863 101.1 62.4 -61.1 -36.1 -34.7 -22.4 -10.8 951 151 F A H >< S+ 0 0 1 -4,-2.2 3,-0.5 1,-0.3 -1,-0.3 0.742 94.0 62.0 -64.0 -22.2 -34.5 -24.3 -7.6 952 152 F Q T << S+ 0 0 73 -3,-1.5 -1,-0.3 -4,-0.8 -2,-0.2 0.358 101.1 56.6 -81.5 6.1 -38.2 -24.9 -7.7 953 153 F C T < S+ 0 0 7 -3,-2.1 -114,-2.4 -114,-0.1 -113,-1.0 0.535 91.6 78.2-115.8 -13.0 -37.6 -26.8 -10.9 954 154 F V S < S- 0 0 8 -3,-0.5 -117,-0.1 -4,-0.5 2,-0.1 -0.573 78.1-121.9 -89.6 159.1 -35.1 -29.4 -9.7 955 155 F S - 0 0 18 -119,-0.5 -1,-0.1 -2,-0.2 -2,-0.1 -0.410 41.7 -77.3 -89.3 176.0 -36.1 -32.5 -7.7 956 156 F R S S+ 0 0 76 1,-0.3 -483,-0.1 -2,-0.1 -484,-0.0 -0.917 128.2 17.8-120.7 104.0 -34.8 -33.4 -4.3 957 157 F P S S- 0 0 20 0, 0.0 -1,-0.3 0, 0.0 2,-0.2 0.613 110.3-108.9 -84.7 170.0 -32.2 -34.4 -4.8 958 158 F P 0 0 0 0, 0.0 -2,-0.1 0, 0.0 -121,-0.1 -0.424 360.0 360.0 -56.9 119.9 -31.4 -33.1 -8.3 959 159 F T 0 0 89 -123,-0.3 -121,-0.1 -2,-0.2 -4,-0.0 0.080 360.0 360.0-108.2 360.0 -31.5 -36.1 -10.7