==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=10-MAY-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN/PEPTIDE 21-FEB-13 4JC3 . COMPND 2 MOLECULE: 14-3-3 PROTEIN SIGMA; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR D.BIER,C.OTTMANN . 241 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13250.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 191 79.3 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 . 3 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 18 7.5 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 -4 A G > 0 0 91 0, 0.0 3,-1.7 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 100.6 43.7 12.2 -4.2 2 -3 A A T 3 + 0 0 99 1,-0.2 3,-0.4 2,-0.1 27,-0.0 0.692 360.0 54.8 -55.1 -17.8 42.8 9.2 -6.3 3 -2 A M T > S+ 0 0 39 1,-0.2 3,-1.5 2,-0.1 -1,-0.2 0.330 75.0 105.2-103.1 5.6 40.7 11.8 -8.3 4 -1 A G T < S+ 0 0 51 -3,-1.7 -1,-0.2 1,-0.3 -2,-0.1 0.763 79.2 48.4 -56.2 -34.0 43.7 14.1 -8.8 5 0 A S T 3 S+ 0 0 123 -3,-0.4 2,-0.4 -4,-0.2 -1,-0.3 0.445 93.6 94.0 -89.3 -6.8 44.0 13.2 -12.5 6 1 A M S < S- 0 0 40 -3,-1.5 5,-0.1 1,-0.1 -3,-0.0 -0.764 81.8-107.4 -91.5 134.0 40.2 13.6 -13.4 7 2 A E > - 0 0 141 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.206 23.6-124.3 -47.2 136.0 38.7 16.8 -14.9 8 3 A R H > S+ 0 0 55 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.930 113.7 47.9 -51.0 -46.8 36.6 18.8 -12.5 9 4 A A H > S+ 0 0 70 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.878 110.3 52.2 -68.0 -34.1 33.6 18.6 -15.0 10 5 A S H > S+ 0 0 42 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.890 107.8 52.0 -67.7 -36.8 34.1 14.8 -15.4 11 6 A L H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -2,-0.2 0.919 112.4 45.2 -61.5 -46.4 34.0 14.4 -11.6 12 7 A I H X S+ 0 0 11 -4,-2.2 4,-1.9 -5,-0.2 -2,-0.2 0.922 112.1 52.0 -65.4 -42.9 30.7 16.3 -11.4 13 8 A Q H X S+ 0 0 125 -4,-2.8 4,-1.9 -5,-0.2 -2,-0.2 0.941 113.0 44.5 -54.7 -46.9 29.4 14.3 -14.4 14 9 A K H X S+ 0 0 85 -4,-2.5 4,-2.9 1,-0.2 5,-0.3 0.879 106.4 60.9 -71.5 -32.0 30.2 11.0 -12.7 15 10 A A H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.917 107.2 45.8 -55.8 -45.1 28.8 12.2 -9.4 16 11 A K H X S+ 0 0 73 -4,-1.9 4,-1.9 1,-0.2 -1,-0.2 0.881 112.0 51.0 -69.9 -38.6 25.4 12.6 -11.2 17 12 A L H X S+ 0 0 97 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.895 110.2 49.1 -56.8 -46.1 25.8 9.1 -12.8 18 13 A A H <>S+ 0 0 7 -4,-2.9 5,-3.2 2,-0.2 4,-0.3 0.900 107.8 55.7 -65.6 -40.0 26.6 7.5 -9.4 19 14 A E H ><5S+ 0 0 71 -4,-2.3 3,-2.0 -5,-0.3 -1,-0.2 0.964 108.8 46.6 -55.9 -46.6 23.6 9.2 -7.9 20 15 A Q H 3<5S+ 0 0 149 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.849 114.1 48.2 -67.4 -29.0 21.3 7.7 -10.7 21 16 A A T 3<5S- 0 0 67 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.380 113.4-121.5 -88.6 6.1 22.9 4.3 -10.0 22 17 A E T < 5 + 0 0 146 -3,-2.0 2,-0.8 -4,-0.3 -3,-0.2 0.836 66.0 142.6 49.3 40.3 22.4 4.7 -6.3 23 18 A R >< + 0 0 144 -5,-3.2 4,-2.3 1,-0.2 -1,-0.2 -0.677 17.0 166.5-103.5 80.2 26.2 4.4 -5.8 24 19 A Y H > + 0 0 55 -2,-0.8 4,-2.4 2,-0.2 32,-0.2 0.744 69.4 55.9 -75.0 -28.3 26.6 7.0 -3.0 25 20 A E H > S+ 0 0 143 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.930 112.8 43.6 -63.5 -49.0 30.2 6.0 -1.9 26 21 A D H > S+ 0 0 59 2,-0.2 4,-2.8 1,-0.2 -2,-0.2 0.914 113.0 52.9 -55.9 -44.8 31.3 6.6 -5.5 27 22 A M H X S+ 0 0 0 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.916 110.8 46.9 -57.4 -47.8 29.2 9.8 -5.6 28 23 A A H X S+ 0 0 5 -4,-2.4 4,-2.2 24,-0.2 -1,-0.2 0.905 111.4 50.5 -59.4 -45.7 30.9 11.0 -2.4 29 24 A A H X S+ 0 0 38 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.897 110.6 49.8 -62.6 -41.7 34.4 10.1 -3.7 30 25 A F H X S+ 0 0 32 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.920 112.7 46.3 -63.3 -43.2 33.7 12.0 -7.0 31 26 A M H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.823 109.1 54.2 -72.1 -29.4 32.5 15.1 -5.1 32 27 A K H X S+ 0 0 65 -4,-2.2 4,-2.5 2,-0.2 -1,-0.2 0.926 109.4 50.0 -65.3 -42.3 35.5 15.0 -2.7 33 28 A G H X S+ 0 0 3 -4,-2.0 4,-0.6 1,-0.2 -2,-0.2 0.919 111.1 49.2 -59.7 -45.7 37.7 15.0 -5.8 34 29 A A H >< S+ 0 0 0 -4,-2.4 3,-1.2 2,-0.2 5,-0.4 0.912 110.0 49.1 -60.3 -46.3 35.7 18.0 -7.2 35 30 A V H >< S+ 0 0 7 -4,-2.5 3,-2.2 1,-0.2 -2,-0.2 0.930 105.0 60.2 -60.4 -41.7 36.0 20.0 -4.0 36 31 A E H 3< S+ 0 0 93 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.607 82.3 80.8 -67.1 -10.4 39.8 19.3 -3.9 37 32 A K T << S- 0 0 74 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.709 104.1-126.8 -61.5 -18.6 40.1 21.1 -7.3 38 33 A G < + 0 0 67 -3,-2.2 2,-0.2 1,-0.3 -2,-0.1 0.313 68.1 121.3 94.6 -12.1 40.1 24.2 -5.2 39 34 A E S S- 0 0 134 -5,-0.4 -1,-0.3 1,-0.1 -2,-0.1 -0.556 70.4-101.3 -83.7 151.6 37.3 26.1 -7.0 40 35 A E - 0 0 116 -2,-0.2 2,-0.4 -3,-0.1 -1,-0.1 -0.240 40.9-115.9 -61.2 157.7 34.1 27.2 -5.1 41 36 A L - 0 0 9 71,-0.1 -1,-0.1 1,-0.1 2,-0.0 -0.814 20.3-128.6 -97.8 145.2 31.0 25.0 -5.7 42 37 A S > - 0 0 55 -2,-0.4 4,-2.5 1,-0.1 5,-0.2 -0.242 37.6 -93.3 -76.0 178.0 27.9 26.2 -7.4 43 38 A C H > S+ 0 0 64 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.924 127.7 45.8 -58.9 -48.0 24.5 25.7 -5.8 44 39 A E H > S+ 0 0 110 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.904 111.8 51.8 -63.2 -41.5 23.9 22.4 -7.7 45 40 A E H > S+ 0 0 29 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.872 106.9 53.5 -65.7 -39.4 27.4 21.1 -6.9 46 41 A R H X S+ 0 0 23 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.886 108.9 50.3 -59.7 -39.5 26.9 21.8 -3.1 47 42 A N H X S+ 0 0 68 -4,-1.7 4,-2.6 -5,-0.2 -2,-0.2 0.848 107.1 52.6 -70.8 -34.2 23.8 19.8 -3.3 48 43 A L H X S+ 0 0 11 -4,-1.9 4,-2.4 2,-0.2 -2,-0.2 0.934 110.9 49.7 -60.2 -43.9 25.5 16.9 -5.0 49 44 A L H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 5,-0.2 0.923 114.3 42.2 -58.4 -53.8 28.1 17.0 -2.2 50 45 A S H X S+ 0 0 28 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.911 113.3 53.2 -65.6 -41.7 25.6 17.0 0.6 51 46 A V H X S+ 0 0 45 -4,-2.6 4,-2.0 -5,-0.2 5,-0.2 0.946 110.4 48.6 -55.2 -47.3 23.4 14.3 -1.1 52 47 A A H X S+ 0 0 0 -4,-2.4 4,-2.1 1,-0.2 3,-0.2 0.980 117.7 37.4 -58.9 -61.4 26.4 11.9 -1.5 53 48 A Y H X S+ 0 0 14 -4,-2.2 4,-2.6 1,-0.2 5,-0.4 0.866 111.3 60.0 -65.8 -31.2 27.7 12.2 2.1 54 49 A K H X S+ 0 0 65 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.2 0.923 109.8 43.8 -59.1 -47.0 24.2 12.3 3.6 55 50 A N H X S+ 0 0 71 -4,-2.0 4,-1.9 -3,-0.2 -1,-0.2 0.858 114.4 48.8 -66.4 -43.2 23.4 8.9 2.1 56 51 A V H X S+ 0 0 21 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.982 118.2 38.1 -60.4 -56.0 26.8 7.3 3.0 57 52 A V H X S+ 0 0 0 -4,-2.6 4,-3.1 1,-0.2 -2,-0.2 0.826 111.1 62.7 -68.5 -26.8 26.7 8.4 6.7 58 53 A G H X S+ 0 0 28 -4,-1.6 4,-2.0 -5,-0.4 -1,-0.2 0.941 105.9 44.4 -63.9 -46.1 23.0 7.7 6.7 59 54 A G H X S+ 0 0 45 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.883 113.7 50.7 -62.1 -38.6 23.7 4.0 6.1 60 55 A Q H X S+ 0 0 14 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.900 110.1 50.1 -65.3 -42.0 26.5 4.0 8.6 61 56 A R H X S+ 0 0 11 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.903 109.8 50.1 -61.2 -44.7 24.3 5.6 11.3 62 57 A A H X S+ 0 0 54 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.896 114.0 45.4 -61.0 -45.5 21.5 3.0 10.6 63 58 A A H X S+ 0 0 39 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.925 110.3 54.1 -61.7 -46.4 24.0 0.1 11.0 64 59 A W H X S+ 0 0 43 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.890 109.1 48.9 -56.2 -40.9 25.6 1.7 14.1 65 60 A R H X S+ 0 0 94 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.913 109.6 50.8 -66.6 -42.6 22.2 1.9 15.8 66 61 A V H X S+ 0 0 89 -4,-1.8 4,-2.1 2,-0.2 -2,-0.2 0.959 114.9 43.9 -55.9 -52.8 21.4 -1.7 14.9 67 62 A L H X S+ 0 0 25 -4,-2.8 4,-3.0 1,-0.2 -2,-0.2 0.879 111.8 53.3 -65.6 -38.1 24.7 -2.8 16.4 68 63 A S H X S+ 0 0 12 -4,-2.9 4,-2.8 2,-0.2 -1,-0.2 0.864 108.4 50.0 -58.1 -41.7 24.4 -0.6 19.5 69 64 A S H X S+ 0 0 54 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.922 112.1 47.2 -69.7 -43.7 21.0 -2.0 20.3 70 65 A I H X S+ 0 0 83 -4,-2.1 4,-2.3 1,-0.2 -2,-0.2 0.961 113.1 49.5 -58.9 -46.3 22.4 -5.6 20.0 71 66 A E H X S+ 0 0 26 -4,-3.0 4,-0.6 1,-0.2 -2,-0.2 0.925 109.4 50.8 -63.9 -42.9 25.4 -4.6 22.2 72 67 A Q H >< S+ 0 0 124 -4,-2.8 3,-0.8 1,-0.2 -1,-0.2 0.896 109.4 52.3 -62.8 -39.5 23.1 -3.0 24.9 73 68 A K H >< S+ 0 0 139 -4,-2.3 3,-1.6 1,-0.2 -1,-0.2 0.871 102.2 56.2 -57.8 -44.1 21.1 -6.2 25.0 74 69 A S H 3< S+ 0 0 39 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.649 105.7 57.2 -66.6 -10.0 24.1 -8.5 25.5 75 70 A N T << S+ 0 0 121 -3,-0.8 -1,-0.2 -4,-0.6 -2,-0.2 0.454 81.9 109.7 -97.7 -1.9 24.7 -6.2 28.5 76 71 A E S X S- 0 0 74 -3,-1.6 3,-2.0 -4,-0.1 2,-0.1 -0.409 85.8 -89.8 -68.4 144.8 21.3 -6.8 30.2 77 72 A E T 3 S+ 0 0 112 1,-0.2 -1,-0.1 -2,-0.1 3,-0.1 -0.383 117.1 22.4 -46.6 123.0 21.1 -8.9 33.5 78 73 A G T 3 S+ 0 0 88 1,-0.3 -1,-0.2 -2,-0.1 2,-0.2 0.479 88.0 133.1 91.0 0.7 20.7 -12.6 32.4 79 74 A S < - 0 0 45 -3,-2.0 2,-0.6 -5,-0.1 -1,-0.3 -0.604 63.7-109.2 -76.3 146.4 22.1 -12.2 28.8 80 75 A E - 0 0 146 -2,-0.2 -1,-0.1 -3,-0.1 -3,-0.0 -0.700 34.8-108.4 -82.1 120.7 24.5 -14.9 27.8 81 76 A E - 0 0 137 -2,-0.6 -1,-0.1 1,-0.1 -6,-0.1 -0.159 36.9-179.1 -41.2 125.6 28.1 -13.7 27.6 82 77 A K - 0 0 133 1,-0.3 3,-0.4 -8,-0.1 -1,-0.1 0.505 35.1-119.1-111.8 -3.7 29.1 -13.6 23.9 83 78 A G > - 0 0 33 1,-0.2 3,-0.5 2,-0.1 4,-0.3 -0.423 51.4 -50.1 88.5-166.2 32.7 -12.4 24.0 84 79 A P T 3> S+ 0 0 53 0, 0.0 4,-3.0 0, 0.0 5,-0.2 0.462 103.7 97.5 -89.9 1.7 34.1 -9.2 22.4 85 80 A E H 3> S+ 0 0 112 -3,-0.4 4,-2.5 1,-0.2 5,-0.2 0.830 81.6 49.9 -66.2 -39.6 32.7 -9.5 18.8 86 81 A V H <> S+ 0 0 39 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.967 115.8 43.1 -65.2 -48.8 29.6 -7.3 19.2 87 82 A R H > S+ 0 0 103 -4,-0.3 4,-2.6 1,-0.2 -2,-0.2 0.923 114.8 52.2 -60.5 -46.1 31.6 -4.5 20.7 88 83 A E H X S+ 0 0 97 -4,-3.0 4,-1.8 1,-0.2 -1,-0.2 0.919 112.5 42.8 -55.6 -48.1 34.4 -5.0 18.1 89 84 A Y H X S+ 0 0 127 -4,-2.5 4,-2.6 2,-0.2 5,-0.2 0.903 112.6 52.1 -72.3 -39.7 32.2 -4.9 15.1 90 85 A R H X S+ 0 0 35 -4,-2.5 4,-3.3 -5,-0.2 -2,-0.2 0.921 111.6 49.7 -53.1 -47.2 30.2 -1.8 16.5 91 86 A E H X S+ 0 0 73 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.833 108.6 52.8 -60.1 -38.1 33.6 -0.1 17.0 92 87 A K H X S+ 0 0 134 -4,-1.8 4,-1.9 2,-0.2 -2,-0.2 0.957 114.5 40.3 -64.6 -53.1 34.5 -1.0 13.4 93 88 A V H X S+ 0 0 11 -4,-2.6 4,-2.9 1,-0.2 -2,-0.2 0.957 115.9 52.3 -61.0 -45.5 31.3 0.6 12.0 94 89 A E H X S+ 0 0 28 -4,-3.3 4,-2.4 1,-0.2 -1,-0.2 0.878 109.0 49.3 -55.8 -44.4 31.7 3.5 14.5 95 90 A T H X S+ 0 0 89 -4,-2.3 4,-1.8 2,-0.2 -1,-0.2 0.898 110.7 49.7 -64.0 -41.9 35.3 4.2 13.4 96 91 A E H X S+ 0 0 101 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.922 109.9 51.7 -65.7 -46.8 34.4 4.2 9.7 97 92 A L H X S+ 0 0 1 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.926 110.1 49.0 -48.8 -50.6 31.4 6.6 10.5 98 93 A Q H X S+ 0 0 59 -4,-2.4 4,-2.9 1,-0.2 -1,-0.2 0.856 108.0 54.8 -62.8 -35.0 33.8 9.0 12.3 99 94 A G H X S+ 0 0 31 -4,-1.8 4,-2.2 2,-0.2 -1,-0.2 0.913 107.8 48.3 -69.8 -41.0 36.2 8.8 9.4 100 95 A V H X S+ 0 0 24 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.954 113.7 47.6 -58.2 -45.6 33.5 9.9 7.0 101 96 A C H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.933 111.7 49.9 -62.1 -44.0 32.5 12.8 9.3 102 97 A D H X S+ 0 0 94 -4,-2.9 4,-2.0 1,-0.2 -1,-0.2 0.873 109.0 53.4 -60.7 -37.8 36.1 13.8 9.7 103 98 A T H X S+ 0 0 52 -4,-2.2 4,-1.7 2,-0.2 -2,-0.2 0.929 111.3 44.4 -61.9 -44.4 36.5 13.7 5.9 104 99 A V H X S+ 0 0 2 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.938 114.2 48.9 -66.8 -44.9 33.5 16.1 5.4 105 100 A L H X S+ 0 0 16 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.842 108.6 55.9 -63.5 -32.7 34.6 18.4 8.2 106 101 A G H X S+ 0 0 35 -4,-2.0 4,-1.7 -5,-0.2 -1,-0.2 0.883 106.8 49.1 -66.4 -38.4 38.0 18.4 6.6 107 102 A L H <>S+ 0 0 9 -4,-1.7 5,-1.8 2,-0.2 -2,-0.2 0.873 111.7 48.4 -68.3 -39.8 36.6 19.6 3.3 108 103 A L H <>S+ 0 0 2 -4,-2.1 5,-2.6 1,-0.2 6,-0.5 0.866 116.1 43.3 -63.3 -39.8 34.6 22.4 5.0 109 104 A D H <5S+ 0 0 100 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.727 106.4 67.9 -79.2 -25.2 37.6 23.5 6.9 110 105 A S T <5S- 0 0 61 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.1 -0.601 132.5 -54.5-131.0 79.5 39.9 23.2 3.8 111 106 A H T >5S+ 0 0 111 -3,-0.4 4,-1.4 -2,-0.2 -3,-0.2 -0.750 112.1 94.4-143.8 36.4 38.7 25.4 2.3 112 107 A L H >4 S- 0 0 124 1,-0.1 4,-3.1 4,-0.0 5,-0.3 -0.585 82.5-123.6 -80.2 147.3 27.2 34.6 -0.1 119 114 A A H > S+ 0 0 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-1,-0.2 -4,-0.6 -2,-0.2 0.375 94.4 113.9-109.3 -0.9 28.4 8.1 18.9 140 135 A A << + 0 0 14 -4,-0.7 -3,-0.0 -3,-0.7 -4,-0.0 -0.480 22.6 154.2 -74.4 138.6 30.6 10.1 21.3 141 136 A T + 0 0 133 -2,-0.2 -1,-0.1 0, 0.0 2,-0.1 0.215 49.0 79.3-144.9 16.1 31.0 8.8 24.9 142 137 A G S > S- 0 0 48 1,-0.0 3,-1.6 0, 0.0 4,-0.4 -0.242 97.8 -63.9-118.4-166.7 34.3 10.3 26.0 143 138 A D T 3 S+ 0 0 159 1,-0.2 4,-0.2 2,-0.1 3,-0.2 0.672 129.3 51.7 -46.6 -25.9 36.4 13.2 27.3 144 139 A D T 3> S+ 0 0 90 1,-0.2 4,-2.3 2,-0.1 3,-0.3 0.486 77.3 96.8-100.8 -7.6 35.5 14.9 24.0 145 140 A K H <> S+ 0 0 83 -3,-1.6 4,-2.3 1,-0.2 5,-0.2 0.870 85.5 48.5 -56.7 -41.6 31.7 14.5 23.9 146 141 A K H > S+ 0 0 179 -4,-0.4 4,-2.2 1,-0.2 -1,-0.2 0.891 112.5 47.5 -66.6 -37.4 31.0 18.0 25.3 147 142 A R H > S+ 0 0 166 -3,-0.3 4,-2.0 -4,-0.2 -1,-0.2 0.832 110.2 52.4 -75.6 -31.4 33.3 19.7 23.0 148 143 A I H X S+ 0 0 31 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.931 111.2 48.2 -67.2 -46.6 31.9 17.9 20.0 149 144 A I H X S+ 0 0 35 -4,-2.3 4,-2.9 -5,-0.2 -2,-0.2 0.933 111.6 49.2 -56.6 -45.5 28.4 19.0 21.0 150 145 A D H X S+ 0 0 85 -4,-2.2 4,-2.8 1,-0.2 -1,-0.2 0.846 107.5 55.1 -66.9 -33.7 29.6 22.5 21.4 151 146 A S H X S+ 0 0 44 -4,-2.0 4,-2.0 2,-0.2 -1,-0.2 0.922 110.4 46.1 -62.0 -43.0 31.2 22.4 18.0 152 147 A A H X S+ 0 0 0 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.971 115.1 47.3 -59.1 -52.5 27.8 21.3 16.5 153 148 A R H X S+ 0 0 89 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.904 110.9 50.8 -55.5 -49.5 26.0 24.1 18.5 154 149 A S H X S+ 0 0 55 -4,-2.8 4,-2.0 -5,-0.2 -1,-0.2 0.912 112.1 46.1 -59.8 -39.4 28.5 26.7 17.5 155 150 A A H X S+ 0 0 5 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.954 114.2 47.6 -70.6 -48.6 28.3 25.9 13.7 156 151 A Y H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.895 111.7 52.0 -53.1 -43.5 24.4 25.8 13.8 157 152 A Q H X S+ 0 0 64 -4,-2.6 4,-3.0 -5,-0.2 -2,-0.2 0.894 109.6 46.7 -65.8 -44.4 24.3 29.1 15.7 158 153 A E H X S+ 0 0 80 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.921 114.2 49.3 -65.9 -39.5 26.5 31.0 13.3 159 154 A A H X S+ 0 0 0 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.914 111.4 49.6 -65.7 -46.3 24.5 29.6 10.4 160 155 A M H X S+ 0 0 11 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.927 110.2 50.5 -53.0 -49.5 21.2 30.6 12.2 161 156 A D H X S+ 0 0 80 -4,-3.0 4,-1.7 1,-0.2 -2,-0.2 0.924 114.3 42.8 -60.9 -44.9 22.5 34.2 12.8 162 157 A I H X S+ 0 0 32 -4,-2.3 4,-2.8 1,-0.2 5,-0.2 0.911 113.7 52.3 -66.7 -41.3 23.5 34.7 9.1 163 158 A S H X S+ 0 0 0 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.896 109.7 48.8 -65.4 -35.1 20.2 33.0 7.9 164 159 A K H < S+ 0 0 119 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.870 117.3 41.5 -70.4 -37.0 18.1 35.3 10.0 165 160 A K H < S+ 0 0 154 -4,-1.7 -2,-0.2 -5,-0.2 -1,-0.2 0.882 127.8 26.7 -73.6 -39.0 19.9 38.4 8.8 166 161 A E H < S+ 0 0 114 -4,-2.8 -2,-0.2 -5,-0.2 -3,-0.2 0.516 109.2 56.1-111.3 -10.7 20.2 37.5 5.1 167 162 A M S < S- 0 0 13 -4,-2.1 -1,-0.0 -5,-0.2 0, 0.0 -0.942 79.3-105.2-127.7 154.3 17.5 35.1 3.9 168 163 A P > - 0 0 65 0, 0.0 3,-1.9 0, 0.0 6,-0.2 -0.332 39.9-107.9 -68.9 154.9 13.6 35.2 3.9 169 164 A P T 3 S+ 0 0 29 0, 0.0 37,-0.2 0, 0.0 38,-0.1 0.692 118.9 53.9 -60.9 -18.6 11.9 33.0 6.6 170 165 A T T 3 S+ 0 0 4 35,-0.1 55,-0.1 36,-0.1 36,-0.1 0.464 72.5 127.7 -92.9 -5.1 10.7 30.6 3.7 171 166 A N <> - 0 0 17 -3,-1.9 4,-2.4 1,-0.1 5,-0.2 -0.377 61.5-135.7 -53.5 124.0 14.2 30.0 2.2 172 167 A P H > S+ 0 0 49 0, 0.0 4,-2.4 0, 0.0 5,-0.2 0.807 103.5 51.1 -55.7 -31.4 14.6 26.1 2.1 173 168 A I H > S+ 0 0 30 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.947 111.0 47.6 -72.0 -49.0 18.2 26.3 3.4 174 169 A R H > S+ 0 0 25 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.927 115.2 46.9 -52.5 -45.3 17.1 28.4 6.3 175 170 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.901 112.8 47.7 -65.0 -42.8 14.2 26.0 7.0 176 171 A G H X S+ 0 0 2 -4,-2.4 4,-2.4 2,-0.2 66,-0.4 0.865 111.4 51.3 -70.2 -33.4 16.3 22.9 6.7 177 172 A L H X S+ 0 0 0 -4,-2.4 4,-2.9 2,-0.2 5,-0.2 0.935 111.2 47.6 -69.0 -44.6 18.9 24.4 9.0 178 173 A A H X S+ 0 0 1 -4,-2.4 4,-2.7 -5,-0.2 -2,-0.2 0.933 110.8 52.3 -59.8 -46.2 16.2 25.2 11.6 179 174 A L H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.929 114.5 41.8 -52.5 -53.4 14.7 21.7 11.3 180 175 A N H X S+ 0 0 0 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.905 114.2 50.0 -65.8 -40.7 18.2 20.1 12.0 181 176 A F H X S+ 0 0 8 -4,-2.9 4,-2.3 2,-0.2 -2,-0.2 0.895 108.9 53.3 -66.5 -35.2 19.2 22.5 14.7 182 177 A S H X S+ 0 0 0 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.931 109.8 48.0 -63.2 -42.9 15.8 21.9 16.4 183 178 A V H X>S+ 0 0 4 -4,-2.0 4,-3.5 1,-0.2 5,-0.6 0.886 107.4 57.5 -62.1 -37.3 16.6 18.0 16.2 184 179 A F H X>S+ 0 0 2 -4,-2.3 4,-2.2 1,-0.2 5,-2.2 0.949 107.8 46.8 -58.2 -50.1 20.1 18.8 17.7 185 180 A H H <5S+ 0 0 18 -4,-2.3 6,-3.5 3,-0.2 -1,-0.2 0.900 118.6 40.3 -59.1 -41.0 18.4 20.4 20.7 186 181 A Y H <5S+ 0 0 74 -4,-1.8 -2,-0.2 4,-0.2 -1,-0.2 0.949 128.2 26.9 -75.0 -46.8 16.0 17.5 21.2 187 182 A E H <5S+ 0 0 101 -4,-3.5 -3,-0.2 -5,-0.2 -2,-0.2 0.784 134.2 21.3 -92.3 -31.4 18.2 14.6 20.5 188 183 A I T < + 0 0 43 -6,-3.5 4,-2.2 -7,-0.2 3,-0.3 -0.595 23.0 164.7-129.5 72.3 16.7 20.6 25.4 192 187 A P H > S+ 0 0 55 0, 0.0 4,-2.2 0, 0.0 5,-0.2 0.845 75.9 56.1 -63.3 -29.3 13.3 19.4 24.2 193 188 A E H > S+ 0 0 164 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.891 107.8 46.7 -66.9 -42.2 11.8 22.8 25.0 194 189 A E H > S+ 0 0 103 -3,-0.3 4,-3.0 2,-0.2 5,-0.2 0.921 111.8 53.0 -60.9 -44.5 14.3 24.7 22.8 195 190 A A H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.902 113.0 44.0 -52.9 -45.2 13.7 22.1 20.0 196 191 A I H X S+ 0 0 45 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.934 114.1 47.9 -71.3 -50.5 9.9 22.7 20.2 197 192 A S H X S+ 0 0 63 -4,-2.6 4,-2.7 1,-0.2 5,-0.3 0.923 112.8 49.2 -56.7 -45.3 10.1 26.5 20.4 198 193 A L H X S+ 0 0 24 -4,-3.0 4,-2.5 -5,-0.2 5,-0.2 0.942 112.9 45.8 -65.7 -43.8 12.5 26.7 17.5 199 194 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 -5,-0.2 -1,-0.2 0.913 115.4 47.8 -63.6 -43.0 10.4 24.4 15.2 200 195 A K H X S+ 0 0 101 -4,-2.6 4,-2.6 2,-0.2 5,-0.2 0.961 114.7 44.2 -63.1 -52.4 7.2 26.2 16.1 201 196 A T H X S+ 0 0 68 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.899 114.6 49.6 -59.5 -45.7 8.6 29.8 15.6 202 197 A T H X S+ 0 0 16 -4,-2.5 4,-2.2 -5,-0.3 -1,-0.2 0.928 112.7 48.1 -56.7 -46.4 10.3 28.7 12.3 203 198 A F H X S+ 0 0 28 -4,-2.3 4,-2.8 -5,-0.2 -2,-0.2 0.948 113.8 46.2 -61.6 -47.4 7.1 27.1 11.1 204 199 A D H X S+ 0 0 69 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.914 112.2 48.8 -70.2 -40.0 5.0 30.2 11.9 205 200 A E H < S+ 0 0 89 -4,-2.7 4,-0.3 -5,-0.2 -1,-0.2 0.884 112.7 48.6 -66.8 -36.4 7.3 32.8 10.4 206 201 A A H >X S+ 0 0 0 -4,-2.2 3,-2.2 -5,-0.3 4,-1.0 0.953 107.1 56.9 -64.1 -47.5 7.6 30.7 7.2 207 202 A M H >< S+ 0 0 91 -4,-2.8 3,-0.9 1,-0.3 4,-0.4 0.909 105.4 50.7 -46.2 -48.6 3.7 30.5 7.1 208 203 A A T 3< S+ 0 0 71 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.516 111.7 48.0 -72.6 -5.7 3.4 34.3 7.1 209 204 A D T X4 S+ 0 0 30 -3,-2.2 3,-1.8 -4,-0.3 4,-0.3 0.458 82.7 91.3-112.0 -6.2 5.9 34.7 4.2 210 205 A L G X< S+ 0 0 17 -4,-1.0 3,-2.2 -3,-0.9 -2,-0.1 0.840 74.7 71.2 -57.9 -31.5 4.4 32.0 1.8 211 206 A H G 3 S+ 0 0 157 -4,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.741 92.0 57.7 -62.1 -19.6 2.2 34.7 0.2 212 207 A T G < S+ 0 0 80 -3,-1.8 -1,-0.3 2,-0.0 2,-0.2 0.565 92.9 94.6 -86.4 -8.5 5.3 36.2 -1.4 213 208 A L S < S- 0 0 46 -3,-2.2 2,-0.1 -4,-0.3 -3,-0.0 -0.554 71.8-121.5 -90.8 151.6 6.3 33.0 -3.2 214 209 A S > - 0 0 70 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.324 45.2 -98.1 -64.1 165.0 5.7 31.6 -6.7 215 210 A E H > S+ 0 0 142 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.874 124.3 48.9 -59.1 -37.4 4.0 28.2 -6.9 216 211 A D H > S+ 0 0 115 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.874 113.1 45.8 -72.7 -34.4 7.3 26.3 -7.2 217 212 A S H > S+ 0 0 49 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.867 109.9 56.6 -73.0 -38.0 9.0 28.2 -4.3 218 213 A Y H X S+ 0 0 101 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.936 107.1 49.2 -57.2 -48.3 5.8 27.5 -2.3 219 214 A K H X S+ 0 0 100 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.925 110.8 48.4 -53.9 -52.1 6.2 23.8 -3.0 220 215 A D H X S+ 0 0 90 -4,-1.9 4,-1.1 1,-0.2 -2,-0.2 0.915 116.5 44.4 -56.9 -45.3 9.9 23.8 -1.9 221 216 A S H X S+ 0 0 3 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.930 112.6 47.4 -67.5 -47.3 9.0 25.7 1.3 222 217 A T H X S+ 0 0 40 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.798 104.0 64.3 -67.7 -28.4 5.9 23.8 2.4 223 218 A L H X S+ 0 0 121 -4,-1.7 4,-0.9 -5,-0.3 -1,-0.2 0.969 110.2 37.1 -55.5 -52.3 7.7 20.5 1.9 224 219 A I H X S+ 0 0 16 -4,-1.1 4,-1.9 1,-0.2 3,-0.4 0.870 111.3 59.8 -73.2 -32.0 10.2 21.4 4.7 225 220 A M H X S+ 0 0 5 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.873 100.6 57.2 -60.4 -37.2 7.5 23.1 6.8 226 221 A Q H X S+ 0 0 103 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.853 103.8 52.4 -61.2 -35.6 5.7 19.7 6.8 227 222 A L H X S+ 0 0 41 -4,-0.9 4,-2.4 -3,-0.4 13,-0.3 0.910 107.8 51.5 -68.4 -40.1 8.8 18.1 8.4 228 223 A L H X S+ 0 0 1 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.926 112.7 45.5 -57.9 -48.8 8.8 20.8 11.1 229 224 A R H X S+ 0 0 86 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.896 109.3 55.0 -64.3 -38.1 5.2 20.0 11.8 230 225 A D H X S+ 0 0 69 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.926 110.2 47.3 -63.1 -40.4 5.8 16.2 11.7 231 226 A N H X S+ 0 0 2 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.953 110.0 51.8 -64.1 -49.3 8.6 16.7 14.4 232 227 A L H X S+ 0 0 8 -4,-2.6 4,-1.0 2,-0.2 -1,-0.2 0.861 110.2 49.7 -51.2 -40.3 6.3 18.9 16.5 233 228 A T H < S+ 0 0 92 -4,-2.3 3,-0.4 2,-0.2 -1,-0.2 0.887 110.6 50.4 -66.2 -41.2 3.6 16.1 16.4 234 229 A L H < S+ 0 0 109 -4,-2.0 -2,-0.2 1,-0.2 -1,-0.2 0.891 117.2 40.9 -62.9 -36.7 6.2 13.6 17.4 235 230 A W H < 0 0 24 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.503 360.0 360.0 -95.8 -6.3 7.2 15.8 20.3 236 231 A T < 0 0 131 -4,-1.0 0, 0.0 -3,-0.4 0, 0.0 -0.608 360.0 360.0-129.6 360.0 3.9 17.1 21.7 237 !* 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 0.0 238 591 B F 0 0 201 0, 0.0 2,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 145.6 13.7 9.1 14.8 239 592 B P - 0 0 10 0, 0.0 2,-0.2 0, 0.0 -12,-0.0 -0.376 360.0 -92.2 -80.4 162.3 12.7 12.8 13.9 240 593 B A + 0 0 26 -13,-0.3 2,-0.3 -2,-0.1 -57,-0.1 -0.530 45.7 168.3 -78.2 139.0 13.1 14.3 10.4 241 594 B X 0 0 34 -2,-0.2 -64,-0.1 -58,-0.1 -65,-0.1 -0.890 360.0 360.0-136.4 160.9 16.3 16.1 9.3 242 595 B V 0 0 59 -66,-0.4 -62,-0.1 -2,-0.3 -18,-0.0 -0.915 360.0 360.0-127.0 360.0 17.3 17.2 5.8