==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN TRANSPORT 16-DEC-11 4ACL . COMPND 2 MOLECULE: TSSL; . SOURCE 2 ORGANISM_SCIENTIFIC: FRANCISELLA NOVICIDA; . AUTHOR C.S.ROBB,F.E.NANO,A.B.BORASTON . 310 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 16397.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 235 75.8 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 . 2 0.6 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 . 8 2.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 32 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 186 60.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 2 0 0 0 0 3 1 0 2 0 0 1 1 0 0 0 0 0 1 3 0 0 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 . 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 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 2 A D 0 0 110 0, 0.0 2,-0.1 0, 0.0 3,-0.0 0.000 360.0 360.0 360.0-163.9 20.6 60.6 26.2 2 3 A F > + 0 0 46 2,-0.1 4,-0.8 1,-0.1 5,-0.0 -0.490 360.0 167.9-169.6 117.1 21.8 58.1 23.5 3 4 A K H > S+ 0 0 44 1,-0.2 4,-1.5 2,-0.1 5,-0.1 0.703 97.6 69.4 -67.4 -22.8 24.6 57.3 21.0 4 5 A E H > S+ 0 0 1 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.891 93.9 46.7 -59.2 -49.3 22.6 54.1 21.2 5 6 A I H > S+ 0 0 56 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.854 109.0 56.2 -71.8 -28.4 19.4 55.3 19.5 6 7 A E H X S+ 0 0 129 -4,-0.8 4,-1.6 2,-0.2 -1,-0.2 0.873 110.7 45.1 -63.1 -39.4 21.5 56.9 16.8 7 8 A I H X S+ 0 0 24 -4,-1.5 4,-1.7 2,-0.2 -2,-0.2 0.883 114.0 49.4 -68.4 -41.2 23.1 53.4 16.2 8 9 A I H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.943 111.6 47.3 -65.2 -48.0 19.7 51.7 16.3 9 10 A L H X S+ 0 0 85 -4,-3.0 4,-3.3 1,-0.2 -1,-0.2 0.907 112.5 51.2 -59.0 -41.5 18.1 54.1 13.9 10 11 A D H X S+ 0 0 62 -4,-1.6 4,-2.3 2,-0.2 -1,-0.2 0.795 108.3 50.0 -68.7 -33.7 21.1 53.7 11.6 11 12 A I H X S+ 0 0 1 -4,-1.7 4,-1.4 -3,-0.2 -2,-0.2 0.948 115.4 45.1 -67.4 -49.4 20.8 49.9 11.6 12 13 A I H X S+ 0 0 8 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.909 113.7 49.3 -56.2 -46.6 17.1 50.3 10.8 13 14 A K H X S+ 0 0 115 -4,-3.3 4,-2.2 1,-0.2 -2,-0.2 0.981 110.7 47.8 -61.1 -57.6 17.8 52.9 8.1 14 15 A T H X S+ 0 0 31 -4,-2.3 4,-1.2 1,-0.2 -1,-0.2 0.740 111.2 53.4 -54.7 -27.8 20.5 51.0 6.3 15 16 A T H X S+ 0 0 0 -4,-1.4 4,-1.6 2,-0.2 3,-0.2 0.932 106.6 49.9 -75.0 -49.7 18.3 47.8 6.4 16 17 A R H X S+ 0 0 119 -4,-2.2 4,-2.5 1,-0.2 -2,-0.2 0.887 108.8 54.8 -52.8 -43.8 15.3 49.5 4.8 17 18 A E H X S+ 0 0 94 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.860 105.1 53.8 -55.2 -42.9 17.7 50.8 2.0 18 19 A I H < S+ 0 0 14 -4,-1.2 -1,-0.2 -3,-0.2 -2,-0.2 0.862 111.7 43.2 -60.0 -44.3 18.8 47.2 1.3 19 20 A I H < S+ 0 0 60 -4,-1.6 -2,-0.2 1,-0.2 -1,-0.2 0.937 111.6 53.3 -69.6 -48.2 15.3 46.0 0.8 20 21 A E H < S+ 0 0 136 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.824 90.4 97.1 -54.7 -35.5 14.2 49.0 -1.3 21 22 A D < - 0 0 34 -4,-1.5 3,-0.2 -5,-0.2 -3,-0.0 -0.312 68.7-146.7 -63.0 134.2 17.2 48.5 -3.7 22 23 A N S S+ 0 0 106 1,-0.2 2,-0.7 -2,-0.0 -1,-0.1 0.987 80.3 34.7 -66.3 -63.4 16.4 46.5 -6.8 23 24 A D + 0 0 122 55,-0.0 2,-0.5 2,-0.0 -1,-0.2 -0.866 60.0 160.6-110.5 112.9 19.7 44.7 -7.3 24 25 A N - 0 0 6 -2,-0.7 2,-0.2 -3,-0.2 58,-0.1 -0.990 20.3-158.5-111.4 130.1 21.8 43.4 -4.5 25 26 A D >> - 0 0 91 -2,-0.5 4,-1.6 57,-0.0 3,-0.5 -0.579 41.7 -97.4 -85.8 169.2 24.4 40.7 -5.2 26 27 A N H 3> S+ 0 0 52 1,-0.2 4,-2.1 -2,-0.2 5,-0.2 0.740 122.6 66.7 -57.1 -23.3 25.6 38.6 -2.3 27 28 A E H 3> S+ 0 0 138 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.939 103.4 41.7 -58.7 -53.4 28.6 41.0 -2.1 28 29 A K H <> S+ 0 0 104 -3,-0.5 4,-1.9 2,-0.2 -2,-0.2 0.889 114.4 50.3 -67.0 -44.5 26.5 43.9 -1.0 29 30 A I H X S+ 0 0 2 -4,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.920 112.1 48.9 -60.1 -49.7 24.3 42.0 1.4 30 31 A S H X S+ 0 0 60 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.899 108.7 51.8 -54.8 -44.1 27.4 40.5 3.0 31 32 A Y H X S+ 0 0 156 -4,-2.0 4,-1.7 1,-0.2 -1,-0.2 0.893 112.3 48.7 -62.5 -35.2 29.0 44.0 3.2 32 33 A H H X S+ 0 0 12 -4,-1.9 4,-1.5 2,-0.2 -2,-0.2 0.806 106.9 53.6 -73.7 -35.8 25.8 45.1 5.0 33 34 A R H X S+ 0 0 29 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.900 109.5 49.1 -66.5 -40.8 25.7 42.2 7.4 34 35 A N H X S+ 0 0 71 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.883 108.3 53.1 -72.6 -35.9 29.2 43.0 8.5 35 36 A N H X S+ 0 0 64 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.858 108.4 50.7 -63.8 -35.2 28.4 46.7 9.0 36 37 A I H X S+ 0 0 3 -4,-1.5 4,-2.7 2,-0.2 -2,-0.2 0.940 108.6 52.4 -67.5 -38.6 25.5 45.7 11.2 37 38 A R H X S+ 0 0 93 -4,-2.0 4,-1.5 1,-0.2 -2,-0.2 0.867 108.9 49.9 -63.7 -39.9 27.9 43.5 13.2 38 39 A K H X S+ 0 0 141 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.907 112.8 47.3 -59.8 -46.2 30.3 46.4 13.7 39 40 A S H X S+ 0 0 26 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.889 106.0 57.3 -65.9 -40.4 27.4 48.6 14.9 40 41 A I H X S+ 0 0 2 -4,-2.7 4,-3.3 1,-0.2 -1,-0.2 0.889 104.5 52.8 -59.2 -41.0 26.0 46.0 17.3 41 42 A F H X S+ 0 0 103 -4,-1.5 4,-2.7 2,-0.2 -1,-0.2 0.880 111.6 44.8 -64.0 -42.1 29.4 45.8 19.1 42 43 A F H X S+ 0 0 101 -4,-1.5 4,-2.0 2,-0.2 -1,-0.2 0.829 113.1 53.2 -65.5 -31.1 29.4 49.6 19.6 43 44 A L H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.972 111.9 43.4 -69.0 -50.7 25.8 49.4 20.6 44 45 A Q H X S+ 0 0 50 -4,-3.3 4,-3.5 2,-0.2 5,-0.2 0.911 112.2 54.0 -57.5 -48.1 26.6 46.7 23.2 45 46 A E H X S+ 0 0 115 -4,-2.7 4,-0.6 2,-0.2 -1,-0.2 0.901 110.0 46.5 -49.5 -49.5 29.6 48.7 24.4 46 47 A E H >X S+ 0 0 61 -4,-2.0 3,-0.7 1,-0.2 4,-0.5 0.938 116.9 46.6 -63.7 -40.7 27.6 51.8 24.9 47 48 A L H >X S+ 0 0 0 -4,-2.5 4,-2.6 1,-0.2 3,-1.6 0.928 103.5 57.2 -70.4 -46.0 24.9 49.7 26.7 48 49 A L H 3< S+ 0 0 72 -4,-3.5 -1,-0.2 1,-0.3 -2,-0.2 0.612 94.6 69.3 -67.7 -8.4 27.0 47.6 29.1 49 50 A E H << S+ 0 0 72 -3,-0.7 -1,-0.3 -4,-0.6 162,-0.2 0.877 120.3 14.4 -69.5 -35.0 28.5 50.7 30.6 50 51 A K H << S+ 0 0 3 -3,-1.6 158,-1.0 -4,-0.5 2,-0.3 0.695 121.1 54.9-111.1 -27.0 25.1 51.6 32.2 51 52 A Y B < S-A 207 0A 17 -4,-2.6 156,-0.4 156,-0.4 158,-0.2 -0.790 75.3 -97.6-126.7 158.1 22.9 48.4 32.0 52 53 A S > - 0 0 12 154,-1.1 4,-1.4 -2,-0.3 156,-0.2 -0.065 38.4-110.0 -60.6 161.0 22.6 44.7 32.9 53 54 A E H > S+ 0 0 146 2,-0.2 4,-2.7 1,-0.2 3,-0.4 0.925 120.3 56.0 -54.0 -47.6 23.4 41.8 30.4 54 55 A T H > S+ 0 0 37 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.826 105.2 51.3 -60.4 -40.4 19.7 41.1 30.4 55 56 A V H > S+ 0 0 0 2,-0.2 4,-0.7 1,-0.2 -1,-0.3 0.814 108.3 50.6 -65.1 -38.0 18.9 44.6 29.3 56 57 A C H >X S+ 0 0 5 -4,-1.4 4,-3.5 -3,-0.4 3,-0.8 0.924 110.9 49.8 -65.3 -43.6 21.4 44.5 26.5 57 58 A K H 3X S+ 0 0 70 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.955 106.4 55.8 -54.9 -46.6 19.8 41.3 25.3 58 59 A Y H 3< S+ 0 0 18 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.703 118.8 34.2 -63.2 -16.8 16.4 42.9 25.5 59 60 A I H S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 -1,-0.3 0.861 111.4 54.6 -56.4 -31.9 14.9 42.3 18.9 63 64 A L H X S+ 0 0 1 -4,-0.9 4,-2.4 -3,-0.5 -2,-0.2 0.956 109.7 44.6 -66.3 -45.9 17.2 44.4 16.6 64 65 A L H X S+ 0 0 1 -4,-2.5 4,-3.2 2,-0.2 23,-0.3 0.934 113.9 51.4 -60.8 -43.2 18.9 41.3 15.2 65 66 A A H X S+ 0 0 2 -4,-2.7 4,-2.4 -5,-0.3 -2,-0.2 0.855 107.1 53.0 -64.6 -39.6 15.5 39.7 14.8 66 67 A Y H X S+ 0 0 3 -4,-2.7 4,-1.9 -5,-0.2 -1,-0.2 0.959 112.4 45.2 -56.9 -50.6 14.2 42.7 12.9 67 68 A V H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 5,-0.3 0.941 113.3 49.1 -63.0 -48.8 17.1 42.5 10.5 68 69 A D H X S+ 0 0 2 -4,-3.2 4,-2.4 1,-0.2 5,-0.2 0.909 108.8 53.8 -56.6 -42.3 16.8 38.7 10.0 69 70 A E H X S+ 0 0 35 -4,-2.4 4,-1.4 1,-0.2 -1,-0.2 0.948 113.0 41.6 -60.1 -47.6 13.1 39.0 9.3 70 71 A K H X S+ 0 0 17 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.831 116.0 47.9 -71.1 -34.1 13.5 41.6 6.6 71 72 A L H X S+ 0 0 2 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.833 109.8 53.7 -77.0 -30.1 16.5 40.0 4.9 72 73 A M H X S+ 0 0 47 -4,-2.4 4,-1.4 -5,-0.3 -2,-0.2 0.841 109.5 49.2 -70.7 -30.5 14.7 36.6 5.0 73 74 A L H X S+ 0 0 91 -4,-1.4 4,-2.4 -5,-0.2 5,-0.2 0.921 112.8 46.5 -69.0 -44.8 11.8 38.2 3.2 74 75 A L H X S+ 0 0 22 -4,-2.0 4,-2.8 1,-0.2 -2,-0.2 0.894 109.0 54.9 -67.1 -38.6 14.1 39.8 0.6 75 76 A R H < S+ 0 0 110 -4,-2.5 -1,-0.2 1,-0.2 7,-0.2 0.867 111.4 45.3 -64.7 -34.5 15.9 36.5 0.2 76 77 A E H < S+ 0 0 141 -4,-1.4 -2,-0.2 1,-0.1 -1,-0.2 0.935 117.5 41.0 -72.3 -52.3 12.7 34.7 -0.6 77 78 A K H < S+ 0 0 91 -4,-2.4 -2,-0.2 -5,-0.1 -3,-0.2 0.918 94.2 110.4 -57.5 -44.0 11.2 37.3 -3.0 78 79 A S < - 0 0 31 -4,-2.8 4,-0.1 -5,-0.2 -55,-0.0 0.014 58.0-154.1 -52.2 126.5 14.6 37.9 -4.7 79 80 A A S S+ 0 0 109 2,-0.1 -1,-0.1 0, 0.0 -4,-0.0 0.997 84.9 70.5 -52.8 -69.9 15.2 36.8 -8.3 80 81 A S S S- 0 0 42 1,-0.1 2,-1.2 -56,-0.1 -55,-0.0 -0.070 98.6-115.5 -40.0 146.2 19.0 36.6 -7.6 81 82 A N + 0 0 99 2,-0.0 2,-0.2 0, 0.0 -1,-0.1 -0.550 47.8 175.7 -96.4 69.7 19.8 33.7 -5.2 82 83 A I - 0 0 6 -2,-1.2 2,-0.4 -7,-0.2 -57,-0.0 -0.467 18.9-138.5 -77.7 144.0 21.1 35.7 -2.2 83 84 A S - 0 0 79 -2,-0.2 2,-0.4 2,-0.0 -1,-0.0 -0.854 16.3-174.6-113.5 139.4 22.1 34.1 1.0 84 85 A W - 0 0 18 -2,-0.4 2,-0.5 -12,-0.0 -54,-0.0 -0.985 10.9-159.0-134.0 121.3 21.5 35.1 4.6 85 86 A S - 0 0 87 -2,-0.4 2,-0.1 1,-0.0 -2,-0.0 -0.864 39.4-104.6 -93.7 129.2 22.9 33.5 7.8 86 87 A L > - 0 0 34 -2,-0.5 4,-2.6 1,-0.2 -21,-0.1 -0.316 20.5-157.2 -65.2 125.9 20.7 34.5 10.8 87 88 A L H > S+ 0 0 0 -23,-0.3 4,-3.5 2,-0.2 5,-0.3 0.840 96.2 60.4 -62.5 -37.2 22.3 37.0 13.1 88 89 A Q H > S+ 0 0 11 2,-0.2 4,-1.7 -24,-0.2 6,-1.1 0.857 106.7 46.9 -68.5 -27.5 20.1 35.8 15.9 89 90 A L H > S+ 0 0 74 4,-0.2 4,-2.2 3,-0.2 -2,-0.2 0.954 112.3 50.9 -71.7 -48.5 21.9 32.4 15.4 90 91 A E H < S+ 0 0 78 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.899 122.2 29.5 -54.3 -44.6 25.2 34.1 15.4 91 92 A Y H < S+ 0 0 63 -4,-3.5 -1,-0.2 3,-0.1 -2,-0.2 0.792 140.6 11.3 -87.9 -24.4 24.6 36.1 18.6 92 93 A Y H < S- 0 0 57 -4,-1.7 -3,-0.2 -5,-0.3 -2,-0.2 0.298 88.1-122.0-143.1 5.8 22.3 33.9 20.6 93 94 A D S < S+ 0 0 144 -4,-2.2 2,-0.3 -6,-0.2 -4,-0.2 0.817 77.0 106.6 48.1 40.2 22.1 30.4 19.0 94 95 A R - 0 0 75 -6,-1.1 -2,-0.2 -8,-0.1 -1,-0.2 -0.981 48.3-170.4-141.8 154.5 18.4 30.5 18.5 95 96 A K + 0 0 161 -2,-0.3 3,-0.4 1,-0.1 -6,-0.1 0.237 65.4 93.2-124.8 10.9 16.2 31.1 15.5 96 97 A D >> + 0 0 58 1,-0.2 4,-2.3 2,-0.1 3,-2.0 -0.069 40.2 128.9 -99.9 31.3 12.7 31.5 17.1 97 98 A G H 3> + 0 0 0 1,-0.3 4,-2.2 2,-0.3 5,-0.3 0.725 59.3 74.3 -63.2 -23.1 12.9 35.4 17.3 98 99 A G H 34 S+ 0 0 27 -3,-0.4 35,-2.4 34,-0.2 -1,-0.3 0.814 114.9 26.1 -52.1 -30.9 9.5 35.7 15.6 99 100 A E H X> S+ 0 0 118 -3,-2.0 4,-1.3 33,-0.2 3,-0.9 0.840 116.4 61.5 -95.4 -43.8 8.3 34.5 19.0 100 101 A Y H 3X S+ 0 0 13 -4,-2.3 4,-2.4 1,-0.3 5,-0.2 0.783 93.0 63.7 -66.6 -30.4 11.1 35.7 21.3 101 102 A V H 3X S+ 0 0 0 -4,-2.2 4,-2.8 1,-0.2 -1,-0.3 0.964 106.3 47.5 -51.8 -46.8 10.6 39.4 20.5 102 103 A F H <> S+ 0 0 2 -3,-0.9 4,-2.8 -5,-0.3 -2,-0.2 0.821 107.5 52.8 -71.9 -30.9 7.2 39.0 22.1 103 104 A E H X S+ 0 0 108 -4,-1.3 4,-2.3 2,-0.2 -1,-0.2 0.921 113.0 46.3 -62.7 -41.2 8.4 37.2 25.2 104 105 A I H X S+ 0 0 0 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.946 113.3 49.7 -62.7 -45.9 10.9 40.0 25.7 105 106 A T H X S+ 0 0 0 -4,-2.8 4,-2.3 -5,-0.2 -2,-0.2 0.932 109.8 49.9 -58.1 -46.6 8.1 42.5 25.1 106 107 A D H X S+ 0 0 35 -4,-2.8 4,-3.2 1,-0.2 5,-0.4 0.893 112.5 48.3 -62.5 -37.2 5.8 40.7 27.6 107 108 A N H X>S+ 0 0 46 -4,-2.3 4,-1.5 2,-0.2 5,-0.5 0.922 108.6 52.8 -66.6 -44.7 8.7 40.8 30.2 108 109 A I H <5S+ 0 0 0 -4,-2.8 6,-0.4 1,-0.2 4,-0.3 0.883 118.3 38.1 -57.5 -39.5 9.3 44.5 29.5 109 110 A L H <5S+ 0 0 40 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.871 130.5 24.8 -81.6 -37.7 5.6 45.1 30.1 110 111 A S H <5S+ 0 0 90 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.920 115.7 53.2 -92.4 -49.6 4.9 42.7 33.0 111 112 A E T <5S- 0 0 63 -4,-1.5 2,-0.3 -5,-0.4 -3,-0.2 0.506 113.5 -40.9 -78.0 -12.9 8.1 42.0 34.9 112 113 A N < - 0 0 37 -5,-0.5 2,-0.6 -4,-0.3 -1,-0.0 -0.972 60.9 -79.0 176.3 176.0 9.4 45.5 35.8 113 114 A I - 0 0 74 -2,-0.3 3,-0.1 44,-0.1 -4,-0.1 -0.953 54.9-172.3-100.6 104.3 10.0 49.1 34.7 114 115 A Y - 0 0 12 -2,-0.6 5,-0.1 -6,-0.4 92,-0.1 -0.432 38.5 -65.9 -89.4 167.3 13.2 48.8 32.6 115 116 A P >> - 0 0 13 0, 0.0 3,-2.3 0, 0.0 4,-0.7 -0.262 50.7-111.0 -57.1 147.0 15.1 51.7 31.2 116 117 A Q H 3> S+ 0 0 94 1,-0.3 4,-2.5 2,-0.2 3,-0.5 0.798 111.5 72.1 -51.7 -35.4 13.3 53.7 28.6 117 118 A I H 3> S+ 0 0 0 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.770 91.2 58.8 -57.0 -26.0 15.6 52.5 25.8 118 119 A C H <> S+ 0 0 0 -3,-2.3 4,-2.0 2,-0.2 5,-0.2 0.948 109.4 43.1 -68.6 -46.1 14.0 49.0 26.0 119 120 A Y H X S+ 0 0 2 -4,-0.7 4,-3.0 -3,-0.5 -2,-0.2 0.959 113.1 52.1 -63.8 -49.5 10.5 50.4 25.2 120 121 A Q H X S+ 0 0 53 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.873 109.3 51.4 -53.8 -38.9 11.9 52.7 22.5 121 122 A T H X S+ 0 0 0 -4,-1.9 4,-2.2 -5,-0.2 -1,-0.2 0.929 112.2 42.5 -71.2 -46.8 13.6 49.8 20.8 122 123 A I H X S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.2 0.960 114.6 54.1 -59.6 -50.1 10.6 47.5 20.6 123 124 A S H X S+ 0 0 17 -4,-3.0 4,-3.5 -5,-0.2 -2,-0.2 0.918 108.5 48.6 -50.2 -51.1 8.5 50.5 19.6 124 125 A L H < S+ 0 0 45 -4,-2.7 -1,-0.2 2,-0.2 4,-0.2 0.876 111.3 47.7 -55.8 -47.8 10.9 51.4 16.7 125 126 A I H ><>S+ 0 0 0 -4,-2.2 5,-1.6 2,-0.2 3,-1.5 0.945 114.1 48.2 -62.2 -42.1 11.0 47.9 15.3 126 127 A L H ><5S+ 0 0 3 -4,-2.7 3,-2.6 1,-0.3 -2,-0.2 0.950 106.0 55.9 -65.1 -46.0 7.2 47.7 15.5 127 128 A H T 3<5S+ 0 0 75 -4,-3.5 -1,-0.3 1,-0.3 -2,-0.2 0.526 107.6 55.2 -59.7 -5.8 6.8 51.1 13.8 128 129 A N T < 5S- 0 0 31 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.063 124.5 -99.4-117.4 19.9 8.9 49.5 11.1 129 130 A D T < 5 + 0 0 88 -3,-2.6 2,-0.6 1,-0.3 -3,-0.2 0.730 57.1 165.5 77.6 23.9 6.6 46.5 10.5 130 131 A F < + 0 0 2 -5,-1.6 -1,-0.3 1,-0.2 -64,-0.1 -0.674 4.4 169.9 -66.9 122.7 8.4 43.7 12.4 131 132 A Y > + 0 0 62 -2,-0.6 3,-2.4 1,-0.1 -1,-0.2 0.696 2.4 171.9-108.1 -30.7 5.7 41.1 12.5 132 133 A G G > S+ 0 0 7 1,-0.3 3,-1.8 2,-0.2 -34,-0.2 -0.240 77.9 0.4 48.5-132.6 7.4 38.0 13.9 133 134 A K G 3 S+ 0 0 97 -35,-2.4 -1,-0.3 1,-0.3 3,-0.2 0.490 132.1 62.3 -64.2 -4.4 4.8 35.3 14.6 134 135 A Y G X + 0 0 10 -3,-2.4 3,-1.1 -36,-0.2 -1,-0.3 0.181 62.2 118.6-103.1 12.9 2.0 37.6 13.4 135 136 A Y T < S+ 0 0 160 -3,-1.8 3,-0.3 1,-0.3 -1,-0.1 0.858 84.7 40.7 -51.9 -37.1 3.2 37.9 9.8 136 137 A D T 3 S+ 0 0 117 -3,-0.2 2,-0.3 1,-0.2 -1,-0.3 0.758 120.5 44.5 -80.9 -19.6 0.0 36.3 8.6 137 138 A N X + 0 0 79 -3,-1.1 3,-2.3 1,-0.1 -1,-0.2 -0.578 55.7 169.4-132.5 70.8 -2.3 38.1 11.1 138 139 A I T 3 S+ 0 0 60 -3,-0.3 -1,-0.1 -2,-0.3 -3,-0.1 0.668 82.9 50.9 -52.6 -24.2 -1.5 41.9 11.3 139 140 A Y T 3 S+ 0 0 191 4,-0.1 -1,-0.3 -5,-0.1 2,-0.2 0.127 71.8 142.1-107.5 17.1 -4.7 42.4 13.4 140 141 A N <> - 0 0 39 -3,-2.3 4,-2.5 -6,-0.2 3,-0.4 -0.436 55.8-130.6 -55.9 128.2 -4.1 39.8 15.9 141 142 A H H > S+ 0 0 159 1,-0.3 4,-2.5 2,-0.2 -1,-0.1 0.871 107.0 50.8 -55.5 -44.0 -5.5 41.3 19.2 142 143 A S H > S+ 0 0 47 2,-0.2 4,-2.4 1,-0.2 -1,-0.3 0.923 111.1 50.6 -54.3 -42.0 -2.3 40.4 21.2 143 144 A F H > S+ 0 0 2 -3,-0.4 4,-1.9 1,-0.2 -2,-0.2 0.933 112.4 44.8 -67.6 -47.9 -0.2 42.0 18.5 144 145 A L H X S+ 0 0 83 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.831 110.5 56.1 -60.3 -34.6 -2.3 45.2 18.5 145 146 A A H X S+ 0 0 50 -4,-2.5 4,-3.5 -5,-0.2 -2,-0.2 0.942 105.8 51.5 -62.7 -45.6 -2.1 45.1 22.4 146 147 A Y H X S+ 0 0 44 -4,-2.4 4,-2.7 1,-0.2 5,-0.3 0.918 109.9 48.3 -57.4 -51.7 1.7 45.0 22.3 147 148 A K H X S+ 0 0 68 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.966 116.2 42.4 -52.7 -58.7 1.9 48.0 20.0 148 149 A K H X S+ 0 0 142 -4,-2.3 4,-1.2 1,-0.2 -2,-0.2 0.943 116.8 49.1 -56.6 -51.7 -0.6 50.1 22.1 149 150 A E H < S+ 0 0 75 -4,-3.5 3,-0.2 1,-0.2 -1,-0.2 0.836 111.4 44.5 -60.8 -45.3 1.0 49.0 25.4 150 151 A I H >< S+ 0 0 1 -4,-2.7 3,-2.2 -5,-0.2 4,-0.4 0.934 110.6 56.2 -67.5 -39.6 4.7 49.7 24.6 151 152 A D H >< S+ 0 0 87 -4,-2.1 3,-1.1 -5,-0.3 -1,-0.2 0.761 96.7 64.1 -62.2 -25.7 3.9 53.1 23.0 152 153 A K T 3< S+ 0 0 128 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.478 96.5 60.3 -76.0 -3.6 2.2 54.1 26.2 153 154 A H T < S+ 0 0 59 -3,-2.2 -1,-0.2 -4,-0.1 2,-0.2 0.597 96.7 73.3 -95.1 -13.7 5.7 53.8 27.8 154 155 A I < 0 0 51 -3,-1.1 -38,-0.0 -4,-0.4 0, 0.0 -0.660 360.0 360.0-106.0 158.0 7.3 56.4 25.6 155 156 A E 0 0 140 -2,-0.2 -1,-0.1 0, 0.0 -3,-0.1 0.444 360.0 360.0 -80.5 360.0 7.1 60.3 25.4 156 !* 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 0.0 157 2 B D 0 0 157 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 124.9 10.3 55.1 38.7 158 3 B F - 0 0 46 1,-0.1 4,-0.2 2,-0.0 0, 0.0 -0.972 360.0-168.4-152.6 136.9 12.0 53.1 41.5 159 4 B K S > S+ 0 0 103 -2,-0.3 4,-1.7 2,-0.1 3,-0.2 0.577 102.4 66.8 -69.7 -22.0 11.4 50.7 44.5 160 5 B E H > S+ 0 0 1 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.828 87.2 58.2 -78.6 -32.2 15.0 51.7 45.0 161 6 B I H > S+ 0 0 51 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.752 106.8 53.1 -69.7 -19.5 14.6 55.3 45.8 162 7 B E H >> S+ 0 0 130 -3,-0.2 4,-2.4 -4,-0.2 3,-0.6 0.965 108.6 47.0 -67.9 -59.1 12.4 54.0 48.7 163 8 B I H 3X S+ 0 0 25 -4,-1.7 4,-2.4 1,-0.3 -2,-0.2 0.907 112.9 51.4 -50.0 -48.7 15.1 51.7 50.0 164 9 B I H 3X S+ 0 0 2 -4,-2.6 4,-1.3 1,-0.2 -1,-0.3 0.845 109.8 48.1 -54.2 -41.3 17.6 54.6 49.7 165 10 B L H S+ 0 0 0 -4,-0.4 4,-2.6 -5,-0.3 -1,-0.2 0.833 108.6 47.7 -90.5 -44.0 20.5 56.6 60.0 172 17 B R H X S+ 0 0 85 -4,-2.1 4,-0.7 1,-0.2 -2,-0.2 0.569 109.9 58.5 -69.7 -6.2 19.0 59.9 61.2 173 18 B E H X S+ 0 0 104 -4,-0.9 4,-1.8 2,-0.2 -1,-0.2 0.868 107.6 43.0 -80.6 -47.5 17.2 57.5 63.6 174 19 B I H < S+ 0 0 3 -4,-0.8 -2,-0.2 1,-0.2 -3,-0.1 0.925 115.0 49.8 -62.7 -47.1 20.4 56.2 65.0 175 20 B I H < S+ 0 0 63 -4,-2.6 -1,-0.2 1,-0.2 -3,-0.2 0.799 113.6 45.8 -67.4 -31.3 22.0 59.7 65.2 176 21 B E H < S+ 0 0 169 -4,-0.7 -1,-0.2 -5,-0.2 -2,-0.2 0.946 81.3 101.3 -75.9 -49.1 19.0 61.3 67.0 177 22 B D < - 0 0 46 -4,-1.8 3,-0.3 1,-0.1 -4,-0.0 -0.131 59.7-152.0 -56.3 109.6 18.2 58.8 69.8 178 23 B N S S+ 0 0 115 1,-0.2 2,-0.8 -2,-0.1 -1,-0.1 0.813 87.5 47.4 -46.9 -45.0 19.6 60.2 73.1 179 24 B D S S+ 0 0 75 2,-0.0 2,-0.6 0, 0.0 -1,-0.2 -0.700 72.8 160.0-105.9 76.4 20.1 56.7 74.7 180 25 B N - 0 0 27 -2,-0.8 2,-0.2 -3,-0.3 56,-0.1 -0.881 12.6-178.2 -99.2 113.0 21.8 54.4 72.1 181 26 B D > - 0 0 81 -2,-0.6 4,-1.8 57,-0.0 3,-0.4 -0.446 44.0 -97.7 -90.0 178.1 23.6 51.3 73.3 182 27 B N H > S+ 0 0 63 1,-0.2 4,-1.2 2,-0.2 -2,-0.0 0.462 117.7 62.5 -83.5 -2.2 25.5 49.0 71.0 183 28 B E H > S+ 0 0 145 2,-0.2 4,-1.2 3,-0.1 -1,-0.2 0.790 107.8 44.7 -81.3 -35.0 22.6 46.4 70.6 184 29 B K H > S+ 0 0 98 -3,-0.4 4,-1.6 2,-0.2 3,-0.4 0.965 116.0 46.1 -67.3 -55.4 20.5 49.1 69.0 185 30 B I H >X S+ 0 0 2 -4,-1.8 4,-2.5 1,-0.3 3,-0.7 0.933 113.2 50.0 -50.8 -51.4 23.4 50.3 66.8 186 31 B S H 3X S+ 0 0 47 -4,-1.2 4,-1.2 1,-0.2 -1,-0.3 0.815 108.7 53.8 -58.2 -32.9 24.2 46.7 65.9 187 32 B Y H 3X S+ 0 0 138 -4,-1.2 4,-0.6 -3,-0.4 -1,-0.2 0.779 109.7 46.9 -72.5 -30.0 20.5 46.1 65.0 188 33 B H H X S+ 0 0 47 -4,-2.5 3,-1.1 1,-0.2 4,-0.6 0.984 116.0 48.6 -60.7 -57.5 16.6 45.4 42.3 203 48 B L H >X S+ 0 0 0 -4,-2.7 4,-2.9 1,-0.2 3,-1.6 0.850 104.0 59.2 -53.3 -45.2 19.5 47.4 40.6 204 49 B L H 3< S+ 0 0 69 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.803 93.7 64.6 -65.0 -25.2 21.3 44.4 39.1 205 50 B E H << S+ 0 0 73 -3,-1.1 -1,-0.3 -4,-1.0 -2,-0.2 0.811 123.5 17.1 -62.7 -26.8 18.2 43.4 37.1 206 51 B K H << S+ 0 0 3 -3,-1.6 -154,-1.1 -4,-0.6 2,-0.3 0.670 118.6 61.8-112.0 -30.0 18.5 46.8 35.1 207 52 B Y B < S-A 51 0A 13 -4,-2.9 -156,-0.4 -156,-0.4 -154,-0.2 -0.801 74.7-106.3-119.8 146.5 22.1 48.2 35.7 208 53 B S > - 0 0 11 -158,-1.0 4,-2.4 -2,-0.3 3,-0.3 -0.219 41.5-106.6 -52.5 149.4 25.8 47.5 35.2 209 54 B E H > S+ 0 0 143 1,-0.2 4,-2.3 2,-0.2 5,-0.1 0.839 122.3 56.9 -39.3 -42.7 28.0 46.4 38.2 210 55 B T H > S+ 0 0 42 1,-0.2 4,-3.5 2,-0.2 -1,-0.2 0.889 104.9 47.8 -66.8 -45.1 29.4 50.0 37.9 211 56 B V H > S+ 0 0 0 -3,-0.3 4,-1.6 2,-0.2 5,-0.3 0.921 108.3 55.9 -62.8 -39.7 26.1 51.7 38.3 212 57 B C H X S+ 0 0 1 -4,-2.4 4,-3.2 1,-0.2 3,-0.5 0.955 113.2 42.4 -57.5 -47.9 25.4 49.4 41.3 213 58 B K H X S+ 0 0 59 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.926 107.2 58.8 -59.9 -49.7 28.6 50.7 42.9 214 59 B Y H < S+ 0 0 18 -4,-3.5 -1,-0.2 1,-0.2 -2,-0.2 0.833 118.5 33.0 -56.0 -23.5 28.1 54.3 41.9 215 60 B I H X S+ 0 0 0 -4,-1.6 4,-1.1 -3,-0.5 -2,-0.2 0.874 122.6 43.8 -96.2 -42.4 24.8 54.1 43.9 216 61 B V H X S+ 0 0 0 -4,-3.2 4,-2.1 -5,-0.3 -3,-0.2 0.885 107.1 54.8 -79.0 -38.7 25.6 51.8 46.7 217 62 B F H X S+ 0 0 0 -4,-2.2 4,-3.2 1,-0.2 5,-0.2 0.892 106.0 49.8 -65.7 -42.1 29.1 52.9 47.7 218 63 B P H > S+ 0 0 0 0, 0.0 4,-2.5 0, 0.0 -1,-0.2 0.902 110.6 53.9 -68.5 -25.7 28.2 56.5 48.4 219 64 B L H X S+ 0 0 0 -4,-1.1 4,-2.0 2,-0.2 -2,-0.2 0.922 110.9 43.5 -62.8 -48.5 25.3 55.2 50.5 220 65 B L H X S+ 0 0 0 -4,-2.1 4,-3.0 1,-0.2 23,-0.3 0.916 114.3 51.4 -64.6 -44.6 27.5 53.1 52.6 221 66 B A H X S+ 0 0 2 -4,-3.2 4,-2.4 1,-0.2 -2,-0.2 0.833 108.1 51.9 -56.7 -39.7 30.0 55.9 52.8 222 67 B Y H X S+ 0 0 4 -4,-2.5 4,-1.8 -5,-0.2 -1,-0.2 0.925 112.4 46.1 -63.2 -43.7 27.3 58.3 53.9 223 68 B V H X S+ 0 0 2 -4,-2.0 4,-1.9 2,-0.2 5,-0.2 0.965 113.5 47.1 -64.2 -57.1 26.3 55.9 56.7 224 69 B D H X S+ 0 0 1 -4,-3.0 4,-2.6 1,-0.2 3,-0.5 0.955 110.0 55.6 -47.0 -53.1 29.8 55.2 57.9 225 70 B E H X S+ 0 0 31 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.886 109.4 44.7 -50.1 -47.5 30.6 58.9 57.9 226 71 B K H X S+ 0 0 31 -4,-1.8 4,-1.3 2,-0.2 -1,-0.2 0.824 112.7 50.7 -71.7 -31.3 27.6 59.7 60.2 227 72 B L H X S+ 0 0 0 -4,-1.9 4,-2.4 -3,-0.5 -2,-0.2 0.836 110.3 50.0 -74.1 -38.6 28.4 56.8 62.6 228 73 B M H X S+ 0 0 52 -4,-2.6 4,-2.4 2,-0.2 5,-0.3 0.944 108.3 52.2 -60.1 -50.4 32.0 57.9 62.9 229 74 B L H X S+ 0 0 89 -4,-2.3 4,-1.1 -5,-0.3 -2,-0.2 0.865 111.2 49.2 -54.8 -35.0 31.0 61.5 63.7 230 75 B L H < S+ 0 0 23 -4,-1.3 3,-0.3 2,-0.2 -1,-0.2 0.901 105.3 57.6 -70.1 -41.4 28.7 59.9 66.4 231 76 B R H >< S+ 0 0 103 -4,-2.4 3,-1.1 1,-0.2 -2,-0.2 0.970 111.4 41.5 -48.9 -57.8 31.7 57.9 67.7 232 77 B E H 3< S+ 0 0 132 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.721 119.8 43.4 -65.1 -24.4 33.7 61.1 68.3 233 78 B K T 3< S+ 0 0 88 -4,-1.1 -1,-0.2 -3,-0.3 2,-0.2 0.040 99.7 92.7-113.1 30.3 30.9 63.1 69.7 234 79 B S < - 0 0 55 -3,-1.1 -3,-0.0 -4,-0.2 3,-0.0 -0.714 61.8-137.5-127.7 166.6 29.2 60.6 72.0 235 80 B A S S+ 0 0 97 -2,-0.2 -1,-0.2 2,-0.0 3,-0.0 0.915 86.5 56.3 -81.9 -87.8 29.0 59.2 75.6 236 81 B S S S- 0 0 58 1,-0.2 2,-2.2 -56,-0.1 -56,-0.0 -0.209 103.1-103.1 -50.9 135.7 28.7 55.3 75.5 237 82 B N - 0 0 95 1,-0.0 -1,-0.2 -5,-0.0 -6,-0.1 -0.394 47.4-156.7 -75.7 78.8 31.8 54.1 73.6 238 83 B I - 0 0 8 -2,-2.2 2,-0.4 -7,-0.2 -4,-0.1 -0.154 4.3-153.3 -65.4 141.8 30.0 53.3 70.3 239 84 B S + 0 0 83 2,-0.0 2,-0.4 -8,-0.0 -1,-0.1 -0.962 16.5 171.6-128.0 136.3 31.5 50.8 67.9 240 85 B W - 0 0 23 -2,-0.4 2,-0.4 -51,-0.0 -54,-0.0 -0.962 22.8-150.5-148.5 114.5 31.1 50.5 64.2 241 86 B S - 0 0 79 -2,-0.4 2,-0.4 1,-0.1 -2,-0.0 -0.732 44.7-101.1 -75.0 140.7 32.8 48.4 61.5 242 87 B L > - 0 0 27 -2,-0.4 4,-1.9 1,-0.2 3,-0.3 -0.523 18.9-151.2 -68.0 117.2 32.8 50.3 58.2 243 88 B L H > S+ 0 0 0 -2,-0.4 4,-2.1 -23,-0.3 5,-0.2 0.749 99.2 55.6 -52.6 -26.3 30.2 49.2 55.8 244 89 B Q H > S+ 0 0 12 -24,-0.2 4,-2.2 2,-0.2 6,-1.1 0.851 104.1 50.5 -83.5 -35.4 32.6 50.3 53.0 245 90 B L H > S+ 0 0 74 -3,-0.3 4,-2.4 4,-0.2 -2,-0.2 1.000 114.1 47.5 -53.1 -66.4 35.4 48.1 54.2 246 91 B E H < S+ 0 0 86 -4,-1.9 -2,-0.2 1,-0.2 -3,-0.1 0.839 123.5 28.4 -40.5 -58.2 33.0 45.2 54.3 247 92 B Y H < S+ 0 0 66 -4,-2.1 -1,-0.2 1,-0.2 -3,-0.2 0.862 135.6 19.3 -83.5 -38.1 31.5 45.7 50.9 248 93 B Y H < S- 0 0 54 -4,-2.2 -2,-0.2 2,-0.2 -3,-0.2 0.216 92.4-120.1-125.4 17.7 34.1 47.4 48.7 249 94 B D S < S+ 0 0 148 -4,-2.4 2,-0.3 -5,-0.2 -4,-0.2 0.761 78.2 97.2 47.2 37.2 37.5 46.7 50.5 250 95 B R - 0 0 73 -6,-1.1 -2,-0.2 -5,-0.1 -1,-0.2 -0.949 51.4-167.0-143.9 165.6 38.3 50.4 50.9 251 96 B K + 0 0 159 -2,-0.3 3,-0.3 -3,-0.1 2,-0.1 0.181 66.9 98.1-137.5 14.7 38.1 53.2 53.5 252 97 B D >> + 0 0 61 1,-0.2 4,-3.5 2,-0.1 3,-1.3 -0.228 41.2 130.7 -93.9 41.9 38.7 56.3 51.4 253 98 B G H 3> + 0 0 1 1,-0.3 4,-2.1 2,-0.3 5,-0.3 0.871 62.7 64.6 -68.5 -40.2 35.0 57.1 51.0 254 99 B G H 34 S+ 0 0 26 -3,-0.3 35,-2.5 34,-0.2 -1,-0.3 0.685 120.2 29.1 -49.5 -20.1 35.4 60.7 52.0 255 100 B E H X> S+ 0 0 118 -3,-1.3 4,-1.5 33,-0.2 3,-1.1 0.802 114.3 56.6-108.0 -53.6 37.4 60.7 48.7 256 101 B Y H 3X S+ 0 0 9 -4,-3.5 4,-3.1 1,-0.3 5,-0.2 0.810 98.6 63.8 -52.0 -34.7 35.9 58.0 46.5 257 102 B V H 3X S+ 0 0 1 -4,-2.1 4,-1.9 1,-0.3 -1,-0.3 0.871 107.1 44.1 -61.0 -36.9 32.4 59.5 46.6 258 103 B F H <> S+ 0 0 1 -3,-1.1 4,-2.4 -5,-0.3 -1,-0.3 0.795 109.4 54.1 -81.9 -27.1 33.8 62.6 44.8 259 104 B E H X S+ 0 0 97 -4,-1.5 4,-2.4 2,-0.2 -2,-0.2 0.942 111.5 47.4 -65.5 -40.0 35.7 60.5 42.4 260 105 B I H X S+ 0 0 0 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.878 110.3 52.2 -65.6 -39.7 32.4 58.8 41.6 261 106 B T H X S+ 0 0 0 -4,-1.9 4,-1.7 -5,-0.2 -1,-0.2 0.883 108.1 51.3 -64.5 -39.5 30.7 62.1 41.4 262 107 B D H X S+ 0 0 71 -4,-2.4 4,-1.4 2,-0.2 5,-0.3 0.962 111.1 48.0 -56.2 -51.9 33.4 63.3 38.9 263 108 B N H X S+ 0 0 47 -4,-2.4 4,-2.7 1,-0.3 5,-0.4 0.859 112.7 48.0 -57.9 -44.3 32.9 60.2 36.7 264 109 B I H < S+ 0 0 1 -4,-2.2 6,-0.4 1,-0.2 4,-0.3 0.794 116.0 44.2 -64.5 -34.5 29.1 60.6 36.7 265 110 B L H < S+ 0 0 47 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.689 130.9 20.1 -84.5 -15.2 29.4 64.3 35.8 266 111 B S H < S+ 0 0 86 -4,-1.4 -3,-0.2 -3,-0.2 -2,-0.2 0.738 114.3 55.9-126.6 -39.0 32.1 63.8 33.1 267 112 B E S < S- 0 0 66 -4,-2.7 2,-0.3 -5,-0.3 -3,-0.2 0.559 111.8 -31.9 -84.6 -11.3 32.3 60.3 31.7 268 113 B N - 0 0 47 -5,-0.4 2,-0.7 -4,-0.3 -1,-0.1 -0.985 63.1 -80.9 178.6 174.6 28.7 59.7 30.5 269 114 B I - 0 0 45 -2,-0.3 3,-0.1 -3,-0.1 -4,-0.1 -0.888 57.9-172.6-106.5 95.5 24.9 60.3 30.8 270 115 B Y - 0 0 17 -2,-0.7 5,-0.1 -6,-0.4 -220,-0.1 -0.291 36.7 -67.6 -88.0 163.1 24.2 57.7 33.6 271 116 B P >> - 0 0 14 0, 0.0 3,-2.3 0, 0.0 4,-0.6 -0.316 49.0-114.8 -60.1 135.0 20.8 56.6 34.9 272 117 B Q H 3> S+ 0 0 74 1,-0.3 4,-2.2 2,-0.2 3,-0.3 0.698 110.9 71.2 -32.8 -31.7 19.1 59.4 36.7 273 118 B I H 3> S+ 0 0 1 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.826 89.6 58.9 -70.7 -30.3 19.3 57.4 39.9 274 119 B C H <> S+ 0 0 1 -3,-2.3 4,-1.7 2,-0.2 -1,-0.2 0.908 110.0 44.5 -51.2 -51.1 23.1 57.9 40.2 275 120 B Y H X S+ 0 0 4 -4,-0.6 4,-2.1 -3,-0.3 -2,-0.2 0.841 112.4 51.0 -66.6 -40.2 22.4 61.7 40.3 276 121 B Q H X S+ 0 0 58 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.850 108.3 53.0 -67.9 -35.8 19.5 61.4 42.8 277 122 B T H X S+ 0 0 1 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.938 111.7 43.4 -65.4 -50.0 21.6 59.3 45.1 278 123 B I H X S+ 0 0 2 -4,-1.7 4,-2.5 1,-0.2 5,-0.3 0.956 114.9 50.9 -58.1 -52.8 24.6 61.8 45.3 279 124 B S H X S+ 0 0 21 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.872 108.0 53.0 -48.2 -45.7 22.2 64.7 45.6 280 125 B L H X S+ 0 0 42 -4,-1.8 4,-0.6 2,-0.2 -1,-0.2 0.925 110.4 45.1 -65.1 -44.1 20.4 63.0 48.4 281 126 B I H ><>S+ 0 0 0 -4,-1.9 5,-1.9 2,-0.2 3,-0.9 0.938 113.6 49.7 -66.9 -46.3 23.5 62.4 50.5 282 127 B L H ><5S+ 0 0 4 -4,-2.5 3,-2.2 1,-0.2 -2,-0.2 0.918 108.2 55.1 -48.7 -49.5 24.8 65.9 49.9 283 128 B H H 3<5S+ 0 0 68 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.675 106.2 53.0 -61.6 -16.4 21.3 67.2 51.0 284 129 B N T <<5S- 0 0 35 -3,-0.9 -1,-0.3 -4,-0.6 -2,-0.2 0.208 127.3 -98.9-106.5 22.3 21.8 65.2 54.1 285 130 B D T < 5 + 0 0 91 -3,-2.2 2,-0.3 1,-0.2 -3,-0.2 0.768 56.7 169.5 74.7 29.3 25.1 66.9 54.9 286 131 B F < + 0 0 2 -5,-1.9 -1,-0.2 1,-0.1 -64,-0.1 -0.573 2.8 173.6 -62.2 134.1 27.7 64.3 53.6 287 132 B Y > + 0 0 61 -2,-0.3 3,-2.7 1,-0.1 -1,-0.1 0.628 2.4 173.9-117.3 -26.6 31.1 66.1 53.7 288 133 B G G > S- 0 0 6 1,-0.3 3,-1.4 2,-0.2 -34,-0.2 -0.240 79.1 -3.6 45.9-124.4 33.6 63.4 52.8 289 134 B K G 3 S+ 0 0 88 -35,-2.5 3,-0.4 1,-0.3 -1,-0.3 0.558 129.1 70.2 -75.1 -10.1 37.1 65.1 52.4 290 135 B Y G X + 0 0 17 -3,-2.7 3,-1.1 -36,-0.2 -1,-0.3 0.340 61.3 114.5 -86.7 7.7 35.5 68.5 53.0 291 136 B Y T < S+ 0 0 176 -3,-1.4 3,-0.2 1,-0.3 -1,-0.2 0.816 74.9 51.7 -48.3 -40.3 34.8 67.9 56.7 292 137 B D T 3 S+ 0 0 142 -3,-0.4 2,-0.3 1,-0.2 -1,-0.3 0.839 123.3 22.4 -68.9 -34.6 37.2 70.6 57.9 293 138 B N X - 0 0 81 -3,-1.1 3,-1.2 -4,-0.1 -1,-0.2 -0.845 54.4-175.7-148.0 109.2 35.8 73.3 55.6 294 139 B I T 3 S+ 0 0 55 -2,-0.3 -1,-0.1 1,-0.3 -3,-0.1 0.434 82.6 68.8 -81.7 -2.6 32.3 73.3 54.2 295 140 B Y T 3 + 0 0 178 -5,-0.1 -1,-0.3 4,-0.1 5,-0.1 0.442 65.4 136.4-100.0 -4.9 32.9 76.5 52.2 296 141 B N <> - 0 0 59 -3,-1.2 4,-2.0 -6,-0.2 5,-0.1 -0.147 54.4-137.9 -47.0 134.7 35.3 74.8 49.8 297 142 B H H > S+ 0 0 162 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.929 101.8 49.8 -70.5 -49.3 34.5 76.0 46.3 298 143 B S H >> S+ 0 0 71 2,-0.2 4,-2.0 1,-0.2 3,-0.6 0.924 109.3 55.5 -47.1 -51.9 34.9 72.6 44.6 299 144 B F H 3> S+ 0 0 6 1,-0.3 4,-1.4 2,-0.2 3,-0.2 0.936 110.4 42.9 -50.5 -53.0 32.6 71.1 47.3 300 145 B L H 3X S+ 0 0 83 -4,-2.0 4,-1.9 1,-0.2 -1,-0.3 0.685 108.1 61.2 -66.6 -22.2 29.9 73.6 46.5 301 146 B A H < S+ 0 0 1 -4,-2.3 3,-1.4 -3,-0.2 4,-0.3 0.946 107.1 55.8 -66.3 -44.9 24.4 67.2 40.4 307 152 B D H >< S+ 0 0 94 -4,-1.6 3,-1.3 1,-0.3 -2,-0.2 0.796 96.3 66.0 -57.6 -32.6 21.1 69.2 40.9 308 153 B K T 3< S+ 0 0 76 -4,-1.3 -1,-0.3 1,-0.2 -2,-0.1 0.121 102.8 49.1 -75.3 21.3 21.3 70.4 37.3 309 154 B H T < S+ 0 0 70 -3,-1.4 2,-0.4 -34,-0.1 -1,-0.2 0.322 90.4 102.8-129.6 -8.2 20.8 66.8 36.3 310 155 B I < 0 0 51 -3,-1.3 -37,-0.0 -4,-0.3 -3,-0.0 -0.733 360.0 360.0 -97.2 128.3 17.8 66.0 38.5 311 156 B E 0 0 130 -2,-0.4 0, 0.0 -39,-0.0 0, 0.0 0.403 360.0 360.0 66.9 360.0 14.1 65.9 37.1