==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PEPTIDE BINDING PROTEIN 30-SEP-10 3P1N . COMPND 2 MOLECULE: 14-3-3 PROTEIN SIGMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR C.ANDERS,Y.HIGUCHI,B.SCHUMACHER,P.THIEL,N.KATO,C.OTTMANN . 241 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13220.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 187 77.6 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 . 2 0.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 15 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 164 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 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 1 0 0 0 0 0 0 0 0 2 0 0 2 0 0 0 0 2 1 0 0 1 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 -3 A A 0 0 139 0, 0.0 3,-0.3 0, 0.0 27,-0.0 0.000 360.0 360.0 360.0 -13.4 -43.0 -9.3 -6.4 2 -2 A M > + 0 0 40 1,-0.2 3,-1.9 2,-0.1 8,-0.1 0.396 360.0 103.4 -93.2 7.3 -40.8 -11.8 -8.2 3 -1 A G T 3 S+ 0 0 65 1,-0.3 -1,-0.2 32,-0.0 0, 0.0 0.762 79.0 50.5 -60.9 -28.3 -43.6 -14.3 -8.9 4 0 A S T 3 S+ 0 0 123 -3,-0.3 2,-0.4 2,-0.1 -1,-0.3 0.509 92.9 91.6 -89.6 -2.8 -44.0 -13.2 -12.5 5 1 A M S < S- 0 0 37 -3,-1.9 5,-0.0 1,-0.1 -3,-0.0 -0.785 82.5-110.0 -93.4 137.8 -40.3 -13.6 -13.4 6 2 A E > - 0 0 143 -2,-0.4 4,-2.4 1,-0.1 3,-0.3 -0.247 24.4-121.9 -60.4 146.2 -38.8 -16.8 -14.8 7 3 A R H > S+ 0 0 53 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.912 112.9 49.9 -53.3 -48.2 -36.5 -18.7 -12.4 8 4 A A H > S+ 0 0 71 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.854 108.9 51.9 -66.9 -34.4 -33.6 -18.6 -14.9 9 5 A S H > S+ 0 0 42 -3,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.875 108.3 52.0 -69.8 -33.0 -34.1 -14.8 -15.4 10 6 A L H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.912 111.6 46.6 -64.1 -45.5 -34.0 -14.3 -11.6 11 7 A I H X S+ 0 0 13 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.935 113.2 49.3 -59.8 -46.8 -30.7 -16.3 -11.5 12 8 A Q H X S+ 0 0 123 -4,-2.5 4,-1.8 1,-0.2 -2,-0.2 0.920 113.2 46.3 -59.0 -44.7 -29.3 -14.3 -14.4 13 9 A K H X S+ 0 0 86 -4,-2.6 4,-3.0 1,-0.2 -1,-0.2 0.864 106.7 58.1 -71.8 -32.6 -30.3 -11.0 -12.8 14 10 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.919 107.8 48.1 -61.0 -38.9 -28.8 -12.1 -9.4 15 11 A K H X S+ 0 0 76 -4,-1.9 4,-2.0 2,-0.2 -2,-0.2 0.885 112.1 48.5 -69.5 -38.4 -25.4 -12.6 -11.2 16 12 A L H X S+ 0 0 95 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.922 110.5 51.6 -66.1 -41.4 -25.7 -9.1 -12.9 17 13 A A H <>S+ 0 0 7 -4,-3.0 5,-2.9 1,-0.2 4,-0.2 0.891 107.3 52.6 -62.7 -39.5 -26.6 -7.6 -9.5 18 14 A E H ><5S+ 0 0 71 -4,-2.2 3,-1.8 1,-0.2 -1,-0.2 0.946 109.1 49.7 -60.2 -42.7 -23.5 -9.2 -7.9 19 15 A Q H 3<5S+ 0 0 149 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.840 114.5 45.5 -63.2 -34.0 -21.3 -7.6 -10.7 20 16 A A T 3<5S- 0 0 66 -4,-1.9 -1,-0.3 -5,-0.1 -2,-0.2 0.360 112.2-122.5 -87.0 -0.5 -23.0 -4.2 -10.0 21 17 A E T < 5 + 0 0 143 -3,-1.8 2,-0.9 -4,-0.2 -3,-0.2 0.819 65.2 142.5 53.6 42.3 -22.5 -4.7 -6.2 22 18 A R >< + 0 0 145 -5,-2.9 4,-2.4 1,-0.2 -1,-0.2 -0.688 17.2 166.2-108.0 78.4 -26.3 -4.3 -5.8 23 19 A Y H > + 0 0 55 -2,-0.9 4,-2.6 2,-0.2 32,-0.2 0.821 68.5 57.8 -77.1 -29.6 -26.7 -6.8 -3.1 24 20 A E H > S+ 0 0 155 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.942 111.5 44.1 -60.1 -45.8 -30.2 -5.9 -1.9 25 21 A D H > S+ 0 0 52 2,-0.2 4,-2.7 1,-0.2 -2,-0.2 0.919 111.3 54.2 -64.4 -42.9 -31.4 -6.6 -5.5 26 22 A M H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.914 109.3 48.5 -59.0 -41.1 -29.3 -9.8 -5.6 27 23 A A H X S+ 0 0 5 -4,-2.6 4,-2.7 24,-0.2 -1,-0.2 0.892 110.3 49.9 -67.5 -41.2 -31.0 -11.0 -2.5 28 24 A A H X S+ 0 0 39 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.912 111.4 49.5 -67.2 -34.4 -34.5 -10.2 -3.7 29 25 A F H X S+ 0 0 32 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.921 113.2 46.5 -66.4 -43.9 -33.8 -12.0 -7.0 30 26 A M H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.851 109.9 53.0 -69.4 -34.8 -32.5 -15.1 -5.1 31 27 A K H X S+ 0 0 66 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.936 109.5 49.9 -61.4 -41.4 -35.4 -15.0 -2.7 32 28 A G H X S+ 0 0 3 -4,-2.3 4,-0.6 1,-0.2 -2,-0.2 0.905 110.5 50.7 -59.5 -43.0 -37.7 -15.0 -5.8 33 29 A A H >< S+ 0 0 0 -4,-2.2 3,-1.3 1,-0.2 5,-0.4 0.940 109.7 48.8 -63.1 -42.4 -35.7 -18.0 -7.2 34 30 A V H >< S+ 0 0 8 -4,-2.6 3,-2.3 1,-0.3 -2,-0.2 0.921 104.6 60.2 -63.2 -40.3 -36.0 -20.0 -4.0 35 31 A E H 3< S+ 0 0 108 -4,-2.6 -1,-0.3 1,-0.3 -2,-0.2 0.604 82.6 80.7 -73.2 -2.3 -39.8 -19.3 -3.9 36 32 A K T << S- 0 0 71 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.694 103.7-128.3 -68.0 -19.1 -40.2 -21.0 -7.2 37 33 A G < + 0 0 46 -3,-2.3 2,-0.2 1,-0.3 -2,-0.1 0.346 67.0 120.3 97.6 -10.3 -40.1 -24.2 -5.1 38 34 A E S S- 0 0 130 -5,-0.4 -1,-0.3 1,-0.1 -2,-0.1 -0.557 70.1 -98.8 -85.1 153.5 -37.3 -26.1 -6.9 39 35 A E - 0 0 108 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.266 40.9-114.6 -61.8 159.5 -34.1 -27.2 -5.1 40 36 A L - 0 0 12 71,-0.1 -1,-0.1 1,-0.0 2,-0.1 -0.763 18.2-129.6-100.1 142.0 -31.0 -25.0 -5.7 41 37 A S > - 0 0 49 -2,-0.4 4,-2.8 1,-0.1 5,-0.2 -0.339 36.1 -98.3 -73.9 173.1 -27.8 -26.1 -7.4 42 38 A X H > S+ 0 0 95 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.929 126.2 47.6 -60.4 -44.5 -24.5 -25.5 -5.8 43 39 A E H > S+ 0 0 109 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.903 112.8 49.8 -59.3 -45.1 -23.9 -22.3 -7.7 44 40 A E H > S+ 0 0 29 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.899 107.5 53.1 -67.5 -36.6 -27.4 -21.1 -6.9 45 41 A R H X S+ 0 0 25 -4,-2.8 4,-2.4 1,-0.2 -1,-0.2 0.917 109.5 50.4 -65.1 -40.1 -26.9 -21.8 -3.1 46 42 A N H X S+ 0 0 64 -4,-2.1 4,-2.7 -5,-0.2 -1,-0.2 0.867 108.1 51.9 -69.7 -31.6 -23.7 -19.7 -3.2 47 43 A L H X S+ 0 0 11 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.905 110.1 49.5 -65.4 -42.5 -25.5 -16.8 -4.9 48 44 A L H X S+ 0 0 3 -4,-2.4 4,-2.1 2,-0.2 5,-0.3 0.933 114.5 44.0 -59.1 -46.7 -28.2 -16.9 -2.2 49 45 A S H X S+ 0 0 24 -4,-2.4 4,-2.6 1,-0.2 5,-0.2 0.919 112.3 50.7 -71.3 -36.9 -25.6 -16.9 0.6 50 46 A V H X S+ 0 0 43 -4,-2.7 4,-2.0 1,-0.2 5,-0.2 0.918 111.3 50.8 -64.6 -42.2 -23.4 -14.2 -1.0 51 47 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.2 -24,-0.2 0.976 116.4 37.3 -62.2 -53.3 -26.4 -11.9 -1.5 52 48 A Y H X S+ 0 0 13 -4,-2.1 4,-2.8 1,-0.2 5,-0.3 0.854 112.3 59.4 -72.1 -31.1 -27.8 -12.1 2.1 53 49 A K H X S+ 0 0 39 -4,-2.6 4,-2.1 -5,-0.3 -1,-0.2 0.919 110.1 43.4 -59.2 -47.6 -24.2 -12.2 3.6 54 50 A N H X S+ 0 0 72 -4,-2.0 4,-1.9 -5,-0.2 -2,-0.2 0.922 114.9 48.0 -68.8 -40.5 -23.6 -8.8 2.1 55 51 A V H X S+ 0 0 31 -4,-2.1 4,-1.8 -5,-0.2 3,-0.3 0.983 118.5 39.8 -63.6 -51.5 -27.0 -7.3 3.0 56 52 A V H X S+ 0 0 0 -4,-2.8 4,-3.0 1,-0.3 -1,-0.2 0.837 110.9 59.7 -70.9 -31.4 -26.8 -8.5 6.6 57 53 A G H X S+ 0 0 27 -4,-2.1 4,-2.4 -5,-0.3 -1,-0.3 0.900 105.5 48.0 -65.5 -38.1 -23.1 -7.6 6.8 58 54 A G H X S+ 0 0 47 -4,-1.9 4,-2.0 -3,-0.3 -1,-0.2 0.892 114.1 47.4 -64.9 -43.3 -23.9 -3.9 6.0 59 55 A Q H X S+ 0 0 12 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.908 111.9 49.1 -65.2 -42.6 -26.6 -3.9 8.6 60 56 A R H X S+ 0 0 8 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.906 110.9 49.7 -64.9 -42.5 -24.4 -5.6 11.3 61 57 A A H X S+ 0 0 42 -4,-2.4 4,-1.9 1,-0.2 -1,-0.2 0.913 113.6 46.6 -64.7 -42.8 -21.6 -3.1 10.7 62 58 A A H X S+ 0 0 40 -4,-2.0 4,-2.7 1,-0.2 5,-0.2 0.929 110.9 52.6 -65.6 -41.2 -24.1 -0.1 11.0 63 59 A W H X S+ 0 0 39 -4,-2.7 4,-3.1 1,-0.2 -2,-0.2 0.902 107.7 51.4 -62.3 -39.2 -25.6 -1.6 14.1 64 60 A R H X S+ 0 0 88 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.894 109.9 49.0 -68.4 -36.6 -22.2 -1.9 15.8 65 61 A V H X S+ 0 0 84 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.953 115.8 44.0 -66.4 -44.9 -21.4 1.7 15.0 66 62 A L H X S+ 0 0 26 -4,-2.7 4,-2.7 1,-0.2 -2,-0.2 0.892 112.0 51.7 -66.2 -39.4 -24.8 2.8 16.4 67 63 A S H X S+ 0 0 21 -4,-3.1 4,-2.7 -5,-0.2 -1,-0.2 0.886 109.6 50.7 -66.8 -36.7 -24.5 0.5 19.5 68 64 A S H X S+ 0 0 65 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.916 110.8 47.6 -70.7 -36.4 -21.1 1.9 20.3 69 65 A I H X S+ 0 0 79 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.920 113.5 49.3 -68.1 -42.8 -22.4 5.6 20.1 70 66 A E H X S+ 0 0 15 -4,-2.7 4,-0.9 2,-0.2 -2,-0.2 0.928 108.9 52.1 -63.7 -42.2 -25.4 4.6 22.3 71 67 A Q H >< S+ 0 0 111 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.936 109.7 49.6 -62.5 -43.5 -23.1 2.9 24.9 72 68 A K H >< S+ 0 0 142 -4,-2.4 3,-1.6 1,-0.2 -1,-0.2 0.888 105.5 56.5 -57.4 -41.2 -21.0 6.1 25.0 73 69 A S H 3< S+ 0 0 46 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.734 105.0 54.7 -63.0 -18.5 -24.1 8.2 25.5 74 70 A N T << S+ 0 0 115 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.314 85.5 106.8-101.4 9.2 -24.9 6.1 28.6 75 71 A E S X S- 0 0 127 -3,-1.6 3,-1.7 -4,-0.1 2,-0.1 -0.498 86.2 -84.3 -82.8 154.1 -21.5 6.6 30.3 76 72 A E T 3 S+ 0 0 114 1,-0.2 -1,-0.1 -2,-0.2 3,-0.1 -0.401 113.9 17.3 -59.2 128.6 -21.2 8.8 33.4 77 73 A G T 3 S+ 0 0 85 1,-0.4 -1,-0.2 -2,-0.1 2,-0.2 0.385 88.1 128.9 92.0 0.4 -20.9 12.5 32.4 78 74 A S < - 0 0 49 -3,-1.7 -1,-0.4 -6,-0.1 2,-0.1 -0.590 64.7-107.6 -77.6 146.2 -22.1 12.3 28.9 79 75 A E - 0 0 168 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.468 30.1-107.5 -71.3 152.4 -24.8 14.8 28.0 80 76 A E + 0 0 95 1,-0.1 -1,-0.1 -2,-0.1 -6,-0.1 -0.664 38.1 176.3 -75.6 125.0 -28.4 13.7 27.5 81 77 A K - 0 0 79 -2,-0.4 3,-0.4 1,-0.4 -1,-0.1 0.313 40.9-113.2-116.4 9.8 -29.1 13.9 23.8 82 78 A G - 0 0 54 1,-0.2 3,-0.4 2,-0.1 -1,-0.4 -0.370 47.9 -51.7 92.1-169.2 -32.6 12.4 23.8 83 79 A P S > S+ 0 0 56 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.491 101.9 98.2 -88.1 0.2 -34.0 9.3 22.4 84 80 A E H > S+ 0 0 111 -3,-0.4 4,-2.5 1,-0.2 5,-0.2 0.818 80.4 49.1 -67.7 -39.6 -32.7 9.6 18.8 85 81 A V H > S+ 0 0 44 -3,-0.4 4,-2.9 2,-0.2 5,-0.2 0.952 116.4 43.5 -66.9 -43.8 -29.6 7.3 19.1 86 82 A R H > S+ 0 0 103 -4,-0.3 4,-2.8 1,-0.2 -2,-0.2 0.942 114.2 51.7 -64.8 -43.8 -31.6 4.5 20.7 87 83 A E H X S+ 0 0 96 -4,-2.8 4,-1.8 1,-0.2 -1,-0.2 0.921 113.3 43.1 -60.9 -43.8 -34.5 5.0 18.2 88 84 A Y H X S+ 0 0 119 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.889 112.1 51.9 -73.3 -38.5 -32.2 4.8 15.2 89 85 A R H X S+ 0 0 33 -4,-2.9 4,-2.9 1,-0.2 -2,-0.2 0.927 111.7 50.3 -60.4 -39.0 -30.2 1.8 16.6 90 86 A E H X S+ 0 0 71 -4,-2.8 4,-2.6 -5,-0.2 -2,-0.2 0.872 107.8 52.7 -60.4 -40.5 -33.6 0.2 17.0 91 87 A K H X S+ 0 0 136 -4,-1.8 4,-2.0 2,-0.2 -1,-0.2 0.956 113.5 42.1 -63.0 -50.1 -34.6 1.0 13.5 92 88 A V H X S+ 0 0 12 -4,-2.5 4,-2.6 1,-0.2 -2,-0.2 0.933 114.4 53.0 -66.6 -37.6 -31.4 -0.6 12.1 93 89 A E H X S+ 0 0 24 -4,-2.9 4,-2.8 1,-0.2 5,-0.2 0.895 108.7 48.6 -64.0 -41.0 -31.8 -3.6 14.5 94 90 A T H X S+ 0 0 89 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.903 111.3 50.3 -70.8 -34.6 -35.4 -4.2 13.4 95 91 A E H X S+ 0 0 116 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.908 111.8 48.0 -63.9 -44.4 -34.3 -4.1 9.7 96 92 A L H X S+ 0 0 1 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.915 110.3 51.6 -65.8 -42.8 -31.5 -6.6 10.4 97 93 A Q H X S+ 0 0 59 -4,-2.8 4,-2.7 1,-0.2 -1,-0.2 0.879 107.9 53.7 -61.4 -37.1 -33.9 -8.9 12.3 98 94 A G H X S+ 0 0 31 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.910 107.1 49.5 -67.8 -36.1 -36.2 -8.8 9.4 99 95 A V H X S+ 0 0 23 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.948 112.8 48.4 -67.7 -40.5 -33.5 -9.9 7.0 100 96 A C H X S+ 0 0 0 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.927 110.9 49.6 -64.7 -41.7 -32.6 -12.7 9.3 101 97 A D H X S+ 0 0 95 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.878 109.0 53.8 -63.3 -34.9 -36.2 -13.8 9.7 102 98 A T H X S+ 0 0 52 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.929 112.8 43.0 -62.3 -51.1 -36.5 -13.7 5.8 103 99 A V H X S+ 0 0 2 -4,-2.5 4,-2.4 2,-0.2 -2,-0.2 0.952 114.6 49.0 -62.9 -44.9 -33.5 -16.1 5.4 104 100 A L H X S+ 0 0 18 -4,-3.0 4,-2.1 1,-0.2 -1,-0.2 0.876 109.7 53.7 -63.2 -33.2 -34.6 -18.3 8.2 105 101 A G H X S+ 0 0 35 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.881 107.3 49.8 -70.2 -34.3 -38.1 -18.4 6.7 106 102 A L H <>S+ 0 0 10 -4,-1.9 5,-1.9 2,-0.2 -1,-0.2 0.902 111.1 50.3 -65.5 -41.8 -36.6 -19.6 3.3 107 103 A L H <>S+ 0 0 3 -4,-2.4 5,-2.5 1,-0.2 6,-0.4 0.889 115.7 41.8 -63.8 -39.6 -34.7 -22.3 5.0 108 104 A D H <5S+ 0 0 100 -4,-2.1 2,-0.2 1,-0.2 -2,-0.2 0.710 106.6 66.8 -80.7 -16.9 -37.8 -23.5 6.9 109 105 A S T <5S- 0 0 65 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.1 -0.669 132.1 -54.2-141.0 79.0 -40.1 -23.2 3.9 110 106 A H T >5S+ 0 0 97 -3,-0.3 4,-1.4 -2,-0.2 -3,-0.2 -0.733 110.4 94.6-145.9 37.1 -38.7 -25.4 2.4 111 107 A L H >4 S- 0 0 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A E H 3< S+ 0 0 44 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.748 114.5 30.4 -61.5 -25.9 -25.6 -10.6 18.4 138 134 A V H << S+ 0 0 2 -3,-1.3 -1,-0.2 -4,-0.6 -2,-0.2 0.390 93.2 115.2-111.8 -2.9 -28.5 -8.1 19.0 139 135 A A < + 0 0 15 -4,-0.9 -3,-0.0 -3,-0.4 -4,-0.0 -0.431 21.6 154.8 -78.7 136.3 -30.6 -10.1 21.4 140 136 A T + 0 0 132 -2,-0.1 -1,-0.1 0, 0.0 2,-0.1 0.357 49.8 75.3-139.5 1.0 -31.0 -8.6 24.9 141 137 A G S > S- 0 0 52 0, 0.0 3,-1.5 0, 0.0 4,-0.3 -0.077 97.5 -63.8-109.2-158.2 -34.4 -10.1 26.1 142 138 A D T 3 S+ 0 0 157 1,-0.3 4,-0.2 2,-0.1 3,-0.2 0.562 126.3 52.9 -67.3 -24.6 -36.2 -13.2 27.4 143 139 A D T 3> S+ 0 0 92 1,-0.1 4,-2.4 2,-0.1 3,-0.3 0.455 77.2 99.4 -90.1 -2.0 -35.6 -15.1 24.2 144 140 A K H <> S+ 0 0 72 -3,-1.5 4,-2.7 1,-0.3 5,-0.2 0.881 83.4 48.6 -56.4 -45.4 -31.8 -14.6 24.0 145 141 A K H > S+ 0 0 174 -4,-0.3 4,-2.4 1,-0.2 -1,-0.3 0.905 112.4 47.8 -64.3 -40.7 -31.1 -18.1 25.4 146 142 A R H > S+ 0 0 168 -3,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.874 110.7 51.6 -71.7 -33.0 -33.4 -19.8 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-0.934 78.2-107.8-128.6 151.2 -17.5 -35.0 3.9 167 163 A P > - 0 0 64 0, 0.0 3,-2.1 0, 0.0 6,-0.2 -0.403 37.6-108.8 -69.1 160.7 -13.7 -35.0 4.0 168 164 A P T 3 S+ 0 0 33 0, 0.0 37,-0.2 0, 0.0 38,-0.1 0.641 117.1 55.0 -71.1 -10.2 -12.0 -32.7 6.5 169 165 A T T 3 S+ 0 0 3 35,-0.1 55,-0.1 36,-0.1 36,-0.1 0.438 73.0 125.8 -96.5 -1.8 -10.8 -30.4 3.7 170 166 A N <> - 0 0 30 -3,-2.1 4,-2.7 1,-0.1 5,-0.2 -0.392 62.3-136.1 -60.1 130.6 -14.2 -29.8 2.2 171 167 A P H > S+ 0 0 48 0, 0.0 4,-2.5 0, 0.0 -1,-0.1 0.804 102.3 52.4 -62.9 -27.5 -14.6 -26.0 2.1 172 168 A I H > S+ 0 0 40 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.934 110.8 48.5 -71.4 -43.7 -18.2 -26.0 3.4 173 169 A R H > S+ 0 0 29 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.933 113.2 48.5 -59.3 -43.0 -17.1 -28.2 6.4 174 170 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.925 112.3 46.3 -64.6 -42.4 -14.2 -25.8 7.0 175 171 A G H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 67,-0.3 0.867 110.4 54.2 -70.8 -33.0 -16.3 -22.7 6.9 176 172 A L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 5,-0.2 0.918 110.9 46.1 -57.2 -51.3 -18.9 -24.3 9.1 177 173 A A H X S+ 0 0 1 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.906 110.5 53.5 -60.2 -43.0 -16.2 -25.0 11.7 178 174 A L H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.948 113.6 41.8 -54.9 -47.0 -14.8 -21.5 11.4 179 175 A N H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.888 113.0 52.2 -75.4 -33.1 -18.3 -20.0 12.1 180 176 A F H X S+ 0 0 6 -4,-2.8 4,-2.6 2,-0.2 -1,-0.2 0.907 108.7 52.4 -68.1 -34.2 -19.2 -22.4 14.9 181 177 A S H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.934 109.1 48.6 -66.9 -40.9 -15.9 -21.6 16.5 182 178 A V H X>S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 5,-0.5 0.925 108.6 55.0 -62.5 -40.7 -16.8 -17.8 16.3 183 179 A F H X>S+ 0 0 0 -4,-2.6 5,-2.5 1,-0.2 4,-2.2 0.940 110.4 46.3 -53.0 -49.4 -20.2 -18.7 17.8 184 180 A H H <5S+ 0 0 9 -4,-2.6 6,-3.3 3,-0.2 -1,-0.2 0.913 117.5 42.2 -60.9 -40.6 -18.4 -20.3 20.7 185 181 A Y H <5S+ 0 0 85 -4,-2.4 -2,-0.2 4,-0.2 -1,-0.2 0.920 129.2 22.6 -70.7 -45.2 -16.0 -17.5 21.2 186 182 A E H <5S+ 0 0 75 -4,-3.2 -3,-0.2 -5,-0.2 -2,-0.2 0.656 133.6 27.3-102.2 -33.1 -18.3 -14.4 20.8 187 183 A I T < + 0 0 41 -6,-3.3 4,-2.2 -7,-0.2 3,-0.2 -0.546 20.5 160.2-129.1 64.8 -16.8 -20.5 25.4 191 187 A P H > S+ 0 0 51 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.844 75.4 55.1 -60.9 -37.5 -13.4 -19.3 24.1 192 188 A E H > S+ 0 0 169 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.916 108.7 47.7 -64.0 -38.5 -11.7 -22.6 25.0 193 189 A E H > S+ 0 0 102 -3,-0.2 4,-2.7 2,-0.2 5,-0.2 0.917 111.3 52.3 -65.9 -40.6 -14.2 -24.5 22.9 194 190 A A H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.926 112.3 43.9 -59.0 -44.4 -13.7 -22.0 20.1 195 191 A I H X S+ 0 0 29 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.936 113.7 50.6 -71.9 -40.6 -9.9 -22.5 20.1 196 192 A S H X S+ 0 0 60 -4,-2.7 4,-2.8 1,-0.2 5,-0.3 0.930 112.1 47.3 -61.7 -45.5 -10.2 -26.3 20.4 197 193 A L H X S+ 0 0 20 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.943 113.3 47.3 -66.8 -42.5 -12.6 -26.5 17.4 198 194 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 -5,-0.2 -2,-0.2 0.907 115.5 46.5 -64.8 -41.0 -10.4 -24.2 15.2 199 195 A K H X S+ 0 0 100 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.938 114.5 45.3 -63.7 -50.5 -7.2 -26.2 16.1 200 196 A T H X S+ 0 0 55 -4,-2.8 4,-2.6 -5,-0.3 5,-0.2 0.919 113.7 49.7 -62.2 -42.7 -8.7 -29.6 15.6 201 197 A T H X S+ 0 0 16 -4,-2.4 4,-2.1 -5,-0.3 -1,-0.2 0.944 112.4 48.0 -63.6 -45.7 -10.4 -28.5 12.3 202 198 A F H X S+ 0 0 19 -4,-2.6 4,-2.7 -5,-0.2 -2,-0.2 0.938 113.3 47.4 -61.0 -43.7 -7.1 -27.0 11.0 203 199 A D H X S+ 0 0 101 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.899 111.2 49.3 -70.0 -36.9 -5.0 -30.0 11.9 204 200 A E H < S+ 0 0 88 -4,-2.6 4,-0.5 -5,-0.2 -1,-0.2 0.862 112.3 48.7 -72.7 -34.0 -7.4 -32.5 10.4 205 201 A A H >X S+ 0 0 0 -4,-2.1 3,-1.5 -5,-0.2 4,-1.0 0.923 106.7 56.4 -68.2 -43.2 -7.6 -30.6 7.2 206 202 A M H >< S+ 0 0 86 -4,-2.7 3,-0.9 1,-0.3 4,-0.3 0.904 105.3 52.4 -53.8 -42.9 -3.7 -30.3 7.0 207 203 A A T 3< S+ 0 0 73 -4,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.621 111.2 47.2 -69.4 -11.4 -3.5 -34.1 7.2 208 204 A D T X4 S+ 0 0 29 -3,-1.5 3,-1.8 -4,-0.5 -1,-0.2 0.518 83.4 92.2-106.7 -8.3 -5.9 -34.5 4.3 209 205 A L G X< S+ 0 0 11 -4,-1.0 3,-2.0 -3,-0.9 -2,-0.1 0.806 73.2 70.2 -59.2 -30.7 -4.4 -31.9 1.9 210 206 A H G 3 S+ 0 0 159 -4,-0.3 -1,-0.3 1,-0.3 -2,-0.1 0.670 92.6 59.3 -63.8 -15.3 -2.2 -34.6 0.2 211 207 A T G < S+ 0 0 81 -3,-1.8 -1,-0.3 2,-0.0 2,-0.2 0.539 93.0 94.4 -87.2 -10.4 -5.4 -36.1 -1.4 212 208 A L S < S- 0 0 47 -3,-2.0 2,-0.0 -4,-0.2 -3,-0.0 -0.558 71.2-122.6 -93.6 153.1 -6.3 -32.9 -3.3 213 209 A S > - 0 0 69 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.240 43.1 -98.4 -71.6 167.0 -5.7 -31.4 -6.7 214 210 A E H > S+ 0 0 160 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.909 125.0 48.1 -58.0 -41.2 -4.0 -28.0 -7.0 215 211 A D H > S+ 0 0 113 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.905 112.9 47.2 -70.9 -38.9 -7.4 -26.2 -7.3 216 212 A S H > S+ 0 0 47 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.888 109.7 55.0 -65.3 -36.9 -9.0 -28.0 -4.3 217 213 A Y H X S+ 0 0 113 -4,-2.8 4,-2.7 1,-0.2 5,-0.2 0.901 106.8 49.6 -65.3 -40.9 -5.9 -27.3 -2.3 218 214 A K H X S+ 0 0 66 -4,-2.0 4,-1.8 1,-0.2 -1,-0.2 0.928 111.4 49.9 -61.4 -42.9 -6.1 -23.6 -3.0 219 215 A 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