==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-MAR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CHAPERONE 13-SEP-12 2LY8 . COMPND 2 MOLECULE: BUDDING YEAST CHAPERONE SCM3; . SOURCE 2 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE; . AUTHOR J.HONG,H.FENG,Z.ZHOU,R.GHIRLANDO,Y.BAI . 121 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 9518.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 88 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 1.7 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 . 7 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 9 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 67 55.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 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 L 0 0 176 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -75.7 -10.4 -27.3 -9.9 2 2 A I + 0 0 166 1,-0.2 3,-0.1 3,-0.1 0, 0.0 0.925 360.0 49.1 -62.0 -45.0 -11.0 -26.2 -13.4 3 3 A S S S+ 0 0 128 1,-0.2 2,-0.4 2,-0.0 -1,-0.2 0.882 128.8 18.6 -61.8 -39.4 -14.7 -26.9 -13.3 4 4 A K - 0 0 104 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 -0.997 61.1-169.3-138.8 132.4 -14.9 -25.1 -10.0 5 5 A I > + 0 0 79 -2,-0.4 4,-1.7 -3,-0.1 3,-0.4 -0.778 5.9 178.6-122.6 85.1 -12.6 -22.5 -8.4 6 6 A P H > S+ 0 0 71 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.839 80.2 59.7 -53.9 -38.2 -13.6 -21.8 -4.7 7 7 A F H > S+ 0 0 113 2,-0.2 4,-3.1 1,-0.2 5,-0.3 0.941 104.4 48.5 -59.8 -47.0 -10.7 -19.4 -4.2 8 8 A A H > S+ 0 0 5 -3,-0.4 4,-3.0 1,-0.2 -1,-0.2 0.903 112.4 50.4 -59.4 -39.5 -12.0 -17.1 -7.0 9 9 A R H X S+ 0 0 127 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.900 112.0 46.7 -65.1 -41.1 -15.4 -17.3 -5.4 10 10 A L H X S+ 0 0 111 -4,-2.7 4,-2.3 2,-0.2 -2,-0.2 0.917 115.8 43.9 -67.7 -43.4 -14.0 -16.4 -2.0 11 11 A V H X S+ 0 0 30 -4,-3.1 4,-2.6 1,-0.2 5,-0.2 0.936 116.5 47.7 -66.5 -44.5 -12.0 -13.6 -3.2 12 12 A K H X S+ 0 0 44 -4,-3.0 4,-3.0 -5,-0.3 -2,-0.2 0.869 109.1 55.4 -62.7 -37.9 -14.9 -12.4 -5.4 13 13 A E H X S+ 0 0 111 -4,-2.4 4,-1.8 2,-0.2 -2,-0.2 0.936 110.7 42.8 -63.6 -44.9 -17.2 -12.8 -2.4 14 14 A V H X S+ 0 0 73 -4,-2.3 4,-1.5 1,-0.2 -2,-0.2 0.941 118.3 46.1 -63.5 -46.9 -15.1 -10.5 -0.2 15 15 A T H X S+ 0 0 5 -4,-2.6 4,-3.4 1,-0.2 -2,-0.2 0.860 107.0 58.6 -63.8 -37.4 -14.7 -8.1 -3.0 16 16 A D H < S+ 0 0 50 -4,-3.0 6,-0.3 2,-0.2 -1,-0.2 0.895 102.4 53.7 -60.8 -38.9 -18.4 -8.3 -3.8 17 17 A E H >< S+ 0 0 124 -4,-1.8 3,-0.7 2,-0.2 -1,-0.2 0.902 113.6 42.7 -61.4 -39.2 -19.2 -7.1 -0.3 18 18 A F H >< S+ 0 0 26 -4,-1.5 3,-0.5 1,-0.2 -2,-0.2 0.904 117.6 45.3 -71.1 -41.3 -16.9 -4.2 -1.1 19 19 A T T 3< S+ 0 0 1 -4,-3.4 3,-0.5 1,-0.2 -1,-0.2 0.249 73.4 126.6 -84.1 11.9 -18.4 -3.9 -4.5 20 20 A T T < + 0 0 100 -3,-0.7 -1,-0.2 1,-0.3 2,-0.2 0.717 50.6 90.8 -44.6 -15.0 -21.8 -4.3 -2.9 21 21 A K < + 0 0 87 -3,-0.5 2,-2.7 1,-0.2 3,-0.5 0.142 46.6 133.4 -68.9 24.0 -22.3 -1.1 -4.8 22 22 A D + 0 0 83 -3,-0.5 -1,-0.2 1,-0.3 -2,-0.1 -0.103 16.1 142.4 -71.6 43.8 -23.5 -3.5 -7.5 23 23 A Q S S- 0 0 110 -2,-2.7 -1,-0.3 1,-0.2 -2,-0.1 0.733 95.3 -27.1 -57.9 -22.8 -26.4 -1.1 -7.9 24 24 A D S S+ 0 0 117 -3,-0.5 -1,-0.2 2,-0.0 -2,-0.1 0.246 105.8 131.0-172.1 -1.4 -26.1 -1.8 -11.6 25 25 A L - 0 0 11 -4,-0.4 2,-0.4 -6,-0.1 74,-0.3 -0.053 42.5-144.3 -62.5 167.4 -22.5 -2.8 -12.1 26 26 A R - 0 0 157 2,-0.0 74,-3.6 0, 0.0 2,-0.7 -1.000 6.0-135.5-139.4 136.4 -21.4 -5.9 -14.0 27 27 A W B -a 100 0A 60 -2,-0.4 2,-0.1 72,-0.2 74,-0.1 -0.827 21.5-162.3 -98.0 114.2 -18.5 -8.3 -13.5 28 28 A Q > - 0 0 67 72,-1.5 4,-1.0 -2,-0.7 3,-0.4 -0.419 35.4-107.2 -85.3 165.5 -16.6 -9.2 -16.6 29 29 A S H > S+ 0 0 88 1,-0.3 4,-1.7 2,-0.2 3,-0.4 0.870 122.6 59.8 -59.4 -35.5 -14.3 -12.2 -16.9 30 30 A M H > S+ 0 0 103 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.892 92.8 65.2 -60.4 -38.8 -11.5 -9.7 -16.9 31 31 A A H > S+ 0 0 0 69,-0.5 4,-1.0 -3,-0.4 -1,-0.2 0.924 105.1 44.8 -49.0 -46.4 -12.6 -8.5 -13.5 32 32 A I H X S+ 0 0 55 -4,-1.0 4,-1.6 -3,-0.4 3,-0.5 0.877 107.7 56.5 -65.3 -39.7 -11.7 -12.0 -12.2 33 33 A M H X S+ 0 0 94 -4,-1.7 4,-2.8 1,-0.3 -1,-0.2 0.892 100.7 60.9 -59.5 -35.0 -8.5 -11.9 -14.0 34 34 A A H X S+ 0 0 1 -4,-2.8 4,-2.8 1,-0.3 -1,-0.3 0.884 99.5 53.9 -58.9 -39.2 -7.9 -8.7 -12.1 35 35 A L H X S+ 0 0 15 -4,-1.0 4,-2.3 -3,-0.5 -1,-0.3 0.904 109.8 47.8 -62.4 -39.3 -8.1 -10.7 -8.9 36 36 A Q H X S+ 0 0 76 -4,-1.6 4,-2.2 1,-0.2 5,-0.3 0.915 112.7 47.8 -66.9 -41.8 -5.4 -13.0 -10.3 37 37 A E H X S+ 0 0 58 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.875 111.3 53.1 -64.0 -39.1 -3.3 -10.1 -11.3 38 38 A A H X S+ 0 0 9 -4,-2.8 4,-2.4 -5,-0.2 -2,-0.2 0.919 110.6 43.9 -63.8 -47.7 -3.8 -8.6 -7.9 39 39 A S H X S+ 0 0 44 -4,-2.3 4,-1.8 2,-0.2 -2,-0.2 0.939 120.3 40.3 -65.3 -47.8 -2.7 -11.6 -5.9 40 40 A E H X S+ 0 0 109 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.843 115.8 52.5 -70.2 -33.2 0.3 -12.3 -8.0 41 41 A A H X S+ 0 0 16 -4,-2.3 4,-2.3 -5,-0.3 -2,-0.2 0.901 108.5 49.6 -68.7 -41.0 1.2 -8.6 -8.3 42 42 A Y H X S+ 0 0 75 -4,-2.4 4,-2.3 -5,-0.2 -1,-0.2 0.909 112.9 48.5 -62.7 -42.6 1.1 -8.1 -4.6 43 43 A L H X S+ 0 0 92 -4,-1.8 4,-4.0 2,-0.2 5,-0.3 0.918 109.4 49.5 -64.8 -46.6 3.4 -11.1 -4.2 44 44 A V H X S+ 0 0 71 -4,-2.5 4,-3.3 1,-0.2 5,-0.3 0.925 113.5 48.9 -59.6 -41.2 5.9 -10.0 -6.8 45 45 A G H X S+ 0 0 10 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.889 114.9 44.2 -63.3 -40.7 5.9 -6.7 -5.0 46 46 A L H X S+ 0 0 69 -4,-2.3 4,-2.8 2,-0.2 -2,-0.2 0.929 116.5 46.0 -69.2 -46.6 6.3 -8.4 -1.7 47 47 A L H X S+ 0 0 105 -4,-4.0 4,-1.8 2,-0.2 -2,-0.2 0.943 116.5 44.2 -61.2 -50.0 9.0 -10.8 -3.0 48 48 A E H X S+ 0 0 103 -4,-3.3 4,-1.1 -5,-0.3 -1,-0.2 0.878 113.9 51.7 -63.8 -37.1 10.8 -8.0 -4.7 49 49 A H H X S+ 0 0 126 -4,-2.0 4,-0.9 -5,-0.3 3,-0.3 0.890 109.3 49.5 -66.7 -38.7 10.3 -5.8 -1.7 50 50 A T H X S+ 0 0 55 -4,-2.8 4,-1.1 1,-0.2 -1,-0.2 0.802 102.8 63.8 -69.1 -29.3 11.8 -8.6 0.5 51 51 A N H < S+ 0 0 89 -4,-1.8 4,-0.3 1,-0.2 -1,-0.2 0.864 98.0 53.5 -62.4 -39.5 14.7 -8.9 -1.9 52 52 A L H >< S+ 0 0 101 -4,-1.1 3,-1.9 -3,-0.3 4,-0.5 0.855 100.9 59.6 -66.7 -33.9 15.9 -5.4 -1.2 53 53 A L H >X S+ 0 0 72 -4,-0.9 4,-3.3 1,-0.3 3,-1.2 0.876 95.3 65.7 -59.8 -35.1 16.0 -6.1 2.6 54 54 A A T 3< S+ 0 0 65 -4,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.676 83.5 76.4 -59.7 -19.6 18.5 -8.8 1.6 55 55 A L T <4 S- 0 0 138 -3,-1.9 -1,-0.3 -4,-0.3 -2,-0.2 0.899 131.7 -21.2 -61.6 -41.0 20.9 -6.0 0.5 56 56 A H T <4 S+ 0 0 175 -3,-1.2 2,-0.2 -4,-0.5 -2,-0.2 0.452 126.1 74.8-142.0 -21.2 21.8 -5.2 4.2 57 57 A L < - 0 0 110 -4,-3.3 -1,-0.1 -5,-0.3 0, 0.0 -0.623 63.8-143.0-100.1 160.0 18.9 -6.5 6.3 58 58 A V - 0 0 125 -2,-0.2 -4,-0.1 -3,-0.1 -5,-0.0 -0.868 19.5-137.9-124.5 96.2 18.0 -10.1 7.2 59 59 A P - 0 0 72 0, 0.0 2,-1.7 0, 0.0 3,-0.2 -0.182 22.4-116.3 -52.3 140.4 14.2 -10.9 7.3 60 60 A R + 0 0 188 1,-0.2 -2,-0.0 3,-0.1 0, 0.0 -0.604 40.8 170.7 -83.2 84.8 13.1 -13.0 10.2 61 61 A G + 0 0 37 -2,-1.7 3,-0.4 3,-0.1 -1,-0.2 0.887 61.8 67.8 -61.3 -39.8 11.9 -16.1 8.4 62 62 A S S S+ 0 0 96 1,-0.2 3,-0.2 -3,-0.2 0, 0.0 -0.479 100.9 22.2 -81.3 153.7 11.6 -18.0 11.6 63 63 A K S S- 0 0 159 1,-0.2 2,-3.4 -2,-0.1 -1,-0.2 0.952 73.6-161.6 56.7 53.6 9.0 -17.0 14.2 64 64 A R + 0 0 158 -3,-0.4 2,-0.5 1,-0.1 5,-0.4 -0.319 40.6 136.2 -66.6 68.6 6.7 -15.2 11.7 65 65 A I + 0 0 137 -2,-3.4 -1,-0.1 -3,-0.2 -3,-0.0 -0.884 12.6 116.7-123.5 99.6 4.9 -13.4 14.5 66 66 A S S S- 0 0 86 -2,-0.5 -1,-0.1 0, 0.0 -2,-0.0 -0.400 100.7 -42.0-161.4 72.6 4.3 -9.7 13.8 67 67 A G S S- 0 0 51 4,-0.1 5,-0.4 5,-0.0 -2,-0.1 0.811 106.5 -72.4 70.4 30.1 0.6 -8.8 13.6 68 68 A L > - 0 0 101 3,-0.2 4,-2.8 2,-0.1 5,-0.2 0.890 42.9-140.2 48.0 106.3 -0.0 -11.9 11.6 69 69 A I H > S+ 0 0 53 -5,-0.4 4,-3.4 1,-0.2 5,-0.3 0.905 104.4 53.3 -59.6 -41.7 1.4 -11.6 8.1 70 70 A Y H > S+ 0 0 182 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.919 109.3 48.2 -61.1 -42.5 -1.6 -13.3 6.7 71 71 A E H > S+ 0 0 102 1,-0.2 4,-3.3 2,-0.2 5,-0.3 0.940 114.4 46.9 -62.3 -45.7 -3.9 -10.9 8.5 72 72 A E H X S+ 0 0 85 -4,-2.8 4,-2.7 -5,-0.4 5,-0.2 0.917 112.6 47.9 -61.8 -46.4 -1.8 -8.0 7.2 73 73 A V H X S+ 0 0 34 -4,-3.4 4,-2.5 2,-0.2 -1,-0.2 0.925 116.0 45.7 -62.2 -42.4 -1.7 -9.2 3.7 74 74 A R H X S+ 0 0 168 -4,-2.6 4,-2.7 -5,-0.3 -2,-0.2 0.943 116.0 43.3 -65.3 -49.8 -5.5 -9.8 3.8 75 75 A A H X S+ 0 0 47 -4,-3.3 4,-2.1 1,-0.2 -1,-0.2 0.852 115.0 51.5 -64.7 -34.4 -6.3 -6.5 5.4 76 76 A V H X S+ 0 0 64 -4,-2.7 4,-2.1 -5,-0.3 -2,-0.2 0.897 110.7 47.1 -69.9 -39.3 -3.9 -4.8 3.0 77 77 A L H X S+ 0 0 40 -4,-2.5 4,-3.9 -5,-0.2 5,-0.2 0.902 108.7 56.3 -67.3 -38.5 -5.5 -6.5 0.1 78 78 A K H X S+ 0 0 107 -4,-2.7 4,-3.6 2,-0.2 5,-0.3 0.919 106.2 49.6 -58.1 -43.9 -8.8 -5.5 1.5 79 79 A S H X S+ 0 0 79 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.932 113.2 47.5 -60.8 -44.2 -7.6 -1.9 1.4 80 80 A F H X S+ 0 0 24 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.953 115.4 43.8 -61.3 -52.0 -6.5 -2.4 -2.2 81 81 A L H X S+ 0 0 19 -4,-3.9 4,-2.1 2,-0.2 -2,-0.2 0.951 114.8 49.6 -60.2 -48.5 -9.8 -4.0 -3.2 82 82 A E H X S+ 0 0 65 -4,-3.6 4,-1.9 1,-0.2 -2,-0.2 0.933 114.1 45.0 -56.3 -47.6 -11.8 -1.4 -1.3 83 83 A S H X S+ 0 0 38 -4,-2.9 4,-3.0 -5,-0.3 5,-0.3 0.886 109.0 58.4 -62.4 -38.9 -9.9 1.4 -2.9 84 84 A V H X S+ 0 0 6 -4,-2.7 4,-2.9 -5,-0.2 -1,-0.2 0.877 105.1 49.0 -59.2 -39.7 -10.2 -0.4 -6.2 85 85 A I H X S+ 0 0 6 -4,-2.1 4,-3.5 2,-0.2 5,-0.4 0.914 111.9 49.3 -66.6 -41.6 -14.0 -0.3 -6.0 86 86 A R H X S+ 0 0 157 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.905 117.6 40.2 -63.2 -41.0 -13.8 3.4 -5.1 87 87 A D H X S+ 0 0 13 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.825 117.6 49.9 -74.3 -34.2 -11.5 4.0 -8.1 88 88 A S H X S+ 0 0 2 -4,-2.9 4,-3.2 -5,-0.3 5,-0.3 0.917 112.3 44.2 -71.6 -46.6 -13.5 1.6 -10.3 89 89 A V H X S+ 0 0 18 -4,-3.5 4,-3.8 1,-0.2 5,-0.3 0.897 115.0 53.2 -65.0 -37.6 -16.8 3.1 -9.6 90 90 A T H X S+ 0 0 76 -4,-1.4 4,-2.2 -5,-0.4 -2,-0.2 0.931 114.5 38.0 -62.0 -49.6 -15.2 6.4 -10.0 91 91 A Y H X S+ 0 0 93 -4,-2.6 4,-1.8 2,-0.2 -2,-0.2 0.870 120.3 47.7 -72.0 -36.3 -13.7 5.6 -13.4 92 92 A T H <>S+ 0 0 8 -4,-3.2 5,-4.8 2,-0.2 -2,-0.2 0.963 115.1 44.8 -69.1 -46.8 -16.8 3.7 -14.4 93 93 A E H ><5S+ 0 0 101 -4,-3.8 3,-2.5 3,-0.3 -2,-0.2 0.876 108.3 58.3 -61.9 -34.9 -19.0 6.5 -13.2 94 94 A H H 3<5S+ 0 0 163 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.908 115.5 35.6 -59.4 -37.7 -16.6 8.9 -14.9 95 95 A A T 3<5S- 0 0 40 -4,-1.8 -1,-0.3 -3,-0.2 -2,-0.2 -0.052 115.1-123.3-101.2 26.5 -17.6 6.9 -18.0 96 96 A K T < 5 + 0 0 159 -3,-2.5 -3,-0.3 -6,-0.2 2,-0.2 0.757 66.3 147.1 32.5 35.3 -21.1 6.6 -16.6 97 97 A R < - 0 0 135 -5,-4.8 2,-0.3 -6,-0.2 -1,-0.2 -0.600 47.9-153.0 -97.1 159.2 -20.4 2.9 -17.0 98 98 A K + 0 0 113 -2,-0.2 2,-0.3 -3,-0.1 -9,-0.1 -0.712 58.6 91.3-131.8 77.2 -21.6 0.1 -14.8 99 99 A T - 0 0 26 -2,-0.3 2,-0.5 -74,-0.3 -72,-0.2 -0.946 63.0-129.4-167.2 147.3 -19.0 -2.7 -15.1 100 100 A V B +a 27 0A 7 -74,-3.6 -72,-1.5 -2,-0.3 -69,-0.5 -0.914 31.8 178.1-107.5 122.6 -15.8 -3.9 -13.4 101 101 A T > - 0 0 46 -2,-0.5 4,-1.8 -71,-0.1 3,-0.4 -0.922 41.3-126.0-125.0 151.0 -12.8 -4.5 -15.8 102 102 A S H > S+ 0 0 7 -2,-0.3 4,-2.3 1,-0.2 5,-0.1 0.737 112.0 64.4 -62.5 -20.9 -9.3 -5.6 -15.1 103 103 A L H > S+ 0 0 91 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.937 101.1 45.3 -68.2 -48.0 -8.4 -2.5 -17.0 104 104 A D H > S+ 0 0 8 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.876 112.3 54.0 -63.8 -34.4 -9.9 -0.2 -14.4 105 105 A V H X S+ 0 0 9 -4,-1.8 4,-2.9 2,-0.2 -1,-0.2 0.929 108.1 49.1 -63.5 -43.3 -8.1 -2.3 -11.8 106 106 A V H X S+ 0 0 57 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.895 109.7 51.4 -61.7 -40.5 -4.9 -1.7 -13.7 107 107 A Y H X S+ 0 0 110 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.913 110.8 48.8 -62.6 -41.3 -5.7 2.0 -13.7 108 108 A A H X S+ 0 0 0 -4,-2.6 4,-1.2 1,-0.2 -2,-0.2 0.914 112.0 48.4 -63.9 -42.8 -6.2 1.8 -10.0 109 109 A L H <>S+ 0 0 26 -4,-2.9 5,-1.5 1,-0.2 4,-0.4 0.863 106.7 57.7 -64.3 -38.1 -2.9 -0.1 -9.6 110 110 A K H ><5S+ 0 0 89 -4,-2.7 3,-1.1 1,-0.2 4,-0.4 0.919 110.9 40.7 -59.8 -46.3 -1.1 2.4 -11.7 111 111 A R H 3<5S+ 0 0 147 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.706 101.7 72.3 -75.5 -19.1 -2.1 5.3 -9.4 112 112 A Q T 3<5S- 0 0 102 -4,-1.2 -1,-0.3 -5,-0.2 -2,-0.2 0.647 133.0 -87.7 -68.4 -13.2 -1.4 3.0 -6.5 113 113 A G T < 5S+ 0 0 45 -3,-1.1 2,-0.3 -4,-0.4 -3,-0.2 0.612 86.3 135.7 112.3 24.3 2.2 3.6 -7.5 114 114 A R > < + 0 0 99 -5,-1.5 3,-0.6 -4,-0.4 -1,-0.3 -0.696 65.6 17.1-102.0 155.2 2.6 0.8 -10.0 115 115 A T G > S- 0 0 80 -2,-0.3 3,-2.5 1,-0.3 5,-0.2 0.142 89.0-132.0 73.5 -22.6 4.4 1.0 -13.4 116 116 A L G > - 0 0 99 1,-0.3 3,-3.9 -6,-0.3 4,-0.4 0.746 47.1 -89.7 47.4 23.8 5.9 4.2 -12.0 117 117 A Y G < S- 0 0 172 -3,-0.6 -1,-0.3 1,-0.3 -2,-0.1 0.655 75.0 -69.4 50.6 12.7 4.8 5.7 -15.3 118 118 A G G < S+ 0 0 60 -3,-2.5 -1,-0.3 2,-0.1 -2,-0.2 0.488 109.2 123.8 85.4 3.9 8.3 4.5 -16.4 119 119 A F < + 0 0 178 -3,-3.9 2,-1.0 1,-0.1 -2,-0.1 0.892 59.0 72.2 -62.8 -39.4 9.9 7.2 -14.3 120 120 A G 0 0 44 -4,-0.4 -1,-0.1 -5,-0.2 -2,-0.1 -0.688 360.0 360.0 -83.7 104.7 11.9 4.5 -12.4 121 121 A G 0 0 149 -2,-1.0 -3,-0.1 0, 0.0 -2,-0.1 0.054 360.0 360.0 -44.7 360.0 14.5 3.3 -14.9