==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER METAL BINDING PROTEIN 25-APR-01 1IJ6 . COMPND 2 MOLECULE: PLASMODIAL SPECIFIC LAV1-2 PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: PHYSARUM POLYCEPHALUM; . AUTHOR W.IWASAKI,H.SASAKI,A.NAKAMURA,K.KOHAMA,M.TANOKURA . 305 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15192.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 233 76.4 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 . 6 2.0 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 . 14 4.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 162 53.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.3 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 2 2 1 2 2 2 0 0 0 0 0 0 0 1 0 0 0 1 0 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 2 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 . 2 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 33 A E 0 0 166 0, 0.0 2,-0.9 0, 0.0 122,-0.2 0.000 360.0 360.0 360.0 22.2 42.5 5.1 39.0 2 34 A I - 0 0 16 120,-1.2 2,-1.0 2,-0.0 120,-0.0 -0.816 360.0-170.9-103.8 88.2 39.2 3.4 38.6 3 35 A F + 0 0 183 -2,-0.9 2,-0.2 4,-0.1 119,-0.0 -0.708 28.5 134.4 -85.1 98.8 38.5 4.0 34.9 4 36 A S >> - 0 0 43 -2,-1.0 3,-2.0 1,-0.1 4,-1.7 -0.765 44.5-153.6-153.6 103.7 34.9 2.9 34.3 5 37 A Q H 3> S+ 0 0 117 1,-0.3 4,-3.8 -2,-0.2 5,-0.4 0.731 91.6 69.1 -44.3 -36.7 32.3 4.8 32.3 6 38 A E H 3> S+ 0 0 103 2,-0.2 4,-1.6 1,-0.2 -1,-0.3 0.901 112.6 34.7 -53.3 -38.0 29.3 3.3 34.1 7 39 A L H <> S+ 0 0 3 -3,-2.0 4,-2.9 2,-0.2 5,-0.3 0.953 116.2 52.1 -79.1 -56.6 30.5 5.3 37.1 8 40 A T H X S+ 0 0 50 -4,-1.7 4,-2.6 1,-0.2 -2,-0.2 0.907 112.1 49.1 -45.5 -48.5 31.8 8.4 35.2 9 41 A Q H X S+ 0 0 40 -4,-3.8 4,-2.1 1,-0.2 -1,-0.2 0.980 111.9 48.6 -54.1 -57.6 28.4 8.6 33.5 10 42 A R H X S+ 0 0 66 -4,-1.6 4,-1.7 -5,-0.4 -2,-0.2 0.797 112.2 47.6 -53.1 -37.7 26.7 8.3 36.9 11 43 A E H X S+ 0 0 50 -4,-2.9 4,-1.7 2,-0.2 -1,-0.2 0.903 108.5 55.6 -73.0 -41.0 28.8 11.0 38.5 12 44 A A H X S+ 0 0 57 -4,-2.6 4,-1.3 -5,-0.3 -2,-0.2 0.920 112.3 40.6 -57.8 -47.4 28.4 13.4 35.6 13 45 A N H X S+ 0 0 107 -4,-2.1 4,-1.9 2,-0.2 3,-0.4 0.947 108.0 56.9 -70.9 -48.5 24.6 13.3 35.7 14 46 A V H X S+ 0 0 3 -4,-1.7 4,-2.2 1,-0.3 -1,-0.2 0.885 106.1 56.6 -49.3 -36.8 24.1 13.4 39.5 15 47 A K H X S+ 0 0 98 -4,-1.7 4,-4.0 1,-0.2 5,-0.4 0.945 99.8 56.2 -59.8 -47.4 26.1 16.6 39.2 16 48 A K H X S+ 0 0 56 -4,-1.3 4,-1.3 -3,-0.4 -1,-0.2 0.927 107.6 49.5 -50.3 -46.9 23.6 18.0 36.7 17 49 A V H X S+ 0 0 7 -4,-1.9 4,-2.8 2,-0.2 -1,-0.2 0.914 116.3 42.3 -58.4 -44.2 20.9 17.4 39.4 18 50 A H H X S+ 0 0 36 -4,-2.2 4,-3.5 2,-0.2 5,-0.3 0.939 111.4 51.8 -69.9 -48.1 23.1 19.2 42.0 19 51 A E H X S+ 0 0 145 -4,-4.0 4,-1.3 2,-0.2 -1,-0.2 0.756 114.4 49.8 -60.6 -19.8 24.3 22.0 39.7 20 52 A N H X S+ 0 0 76 -4,-1.3 4,-3.2 -5,-0.4 -2,-0.2 0.968 112.8 40.7 -78.3 -69.8 20.5 22.4 39.1 21 53 A L H X S+ 0 0 11 -4,-2.8 4,-3.0 1,-0.2 5,-0.3 0.882 114.7 55.4 -42.1 -50.1 19.3 22.4 42.7 22 54 A E H X S+ 0 0 118 -4,-3.5 4,-2.2 1,-0.2 -1,-0.2 0.958 113.7 39.3 -49.1 -59.9 22.3 24.6 43.6 23 55 A E H X S+ 0 0 59 -4,-1.3 4,-0.9 -5,-0.3 -1,-0.2 0.846 113.5 56.7 -60.5 -38.5 21.4 27.2 41.0 24 56 A L H >X S+ 0 0 31 -4,-3.2 3,-1.6 1,-0.2 4,-0.9 0.985 110.1 42.4 -58.9 -58.9 17.7 26.8 41.8 25 57 A Q H 3X S+ 0 0 54 -4,-3.0 4,-2.4 1,-0.3 -1,-0.2 0.868 98.2 75.8 -57.3 -37.3 18.0 27.6 45.5 26 58 A K H 3< S+ 0 0 141 -4,-2.2 -1,-0.3 -5,-0.3 -2,-0.2 0.848 97.9 49.4 -41.4 -39.3 20.5 30.5 44.6 27 59 A K H X< S+ 0 0 31 -3,-1.6 3,-4.4 -4,-0.9 -1,-0.2 1.000 105.0 51.9 -63.4 -70.9 17.3 32.3 43.5 28 60 A L H >< S+ 0 0 36 -4,-0.9 3,-1.3 1,-0.3 -2,-0.2 0.817 100.0 68.5 -34.2 -43.9 15.2 31.8 46.6 29 61 A D T 3< S+ 0 0 122 -4,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.583 115.5 22.3 -60.5 -10.0 18.1 33.1 48.7 30 62 A H T < S+ 0 0 129 -3,-4.4 2,-0.5 -4,-0.1 -1,-0.3 -0.123 86.3 116.0-153.1 51.4 17.6 36.5 47.2 31 63 A T S < S- 0 0 62 -3,-1.3 -4,-0.0 3,-0.0 0, 0.0 -0.993 78.2-102.6-117.7 118.1 14.1 36.9 46.0 32 64 A S - 0 0 83 -2,-0.5 2,-5.9 1,-0.2 -2,-0.1 -0.083 42.1 -97.4 -41.1 139.9 12.4 39.6 48.0 33 65 A F S S+ 0 0 221 2,-0.0 -1,-0.2 -3,-0.0 2,-0.1 -0.027 74.1 157.5 -60.2 47.3 10.1 37.9 50.6 34 66 A A 0 0 82 -2,-5.9 -3,-0.0 1,-0.1 0, 0.0 -0.430 360.0 360.0 -74.9 149.2 7.3 38.6 48.0 35 67 A H 0 0 148 -2,-0.1 -1,-0.1 2,-0.0 -2,-0.0 0.820 360.0 360.0 -34.0 360.0 4.1 36.5 48.1 36 ! 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 37 72 A D > 0 0 126 0, 0.0 4,-1.4 0, 0.0 -2,-0.0 0.000 360.0 360.0 360.0 -20.4 8.2 29.2 47.8 38 73 A R H > + 0 0 210 2,-0.3 4,-4.1 1,-0.2 5,-0.3 0.906 360.0 54.7 -70.0 -38.5 7.7 27.0 44.8 39 74 A L H > S+ 0 0 35 1,-0.3 4,-4.6 2,-0.3 5,-0.2 0.980 104.9 51.3 -52.1 -53.8 11.5 27.3 44.6 40 75 A E H > S+ 0 0 108 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.842 112.7 48.0 -50.3 -33.1 11.3 25.9 48.2 41 76 A A H X S+ 0 0 54 -4,-1.4 4,-2.0 2,-0.2 -2,-0.3 0.979 114.1 42.5 -71.2 -58.5 9.1 23.3 46.6 42 77 A Q H X S+ 0 0 71 -4,-4.1 4,-3.9 2,-0.2 5,-0.4 0.904 110.9 57.8 -54.8 -44.4 11.5 22.5 43.7 43 78 A I H X S+ 0 0 6 -4,-4.6 4,-1.3 -5,-0.3 -1,-0.2 0.976 108.7 44.8 -48.1 -65.6 14.4 22.7 46.1 44 79 A A H X S+ 0 0 56 -4,-1.8 4,-0.8 1,-0.2 -1,-0.3 0.810 116.4 50.3 -46.6 -35.2 12.9 19.9 48.2 45 80 A Q H >X S+ 0 0 114 -4,-2.0 4,-1.3 1,-0.2 3,-1.0 0.959 108.6 45.9 -72.2 -53.9 12.1 18.1 44.9 46 81 A K H 3X S+ 0 0 23 -4,-3.9 4,-0.8 1,-0.2 -1,-0.2 0.598 109.5 64.9 -66.2 -6.4 15.6 18.3 43.3 47 82 A E H 3X S+ 0 0 37 -4,-1.3 4,-1.1 -5,-0.4 -1,-0.2 0.751 97.6 46.4 -88.1 -29.6 16.8 17.1 46.7 48 83 A Q H X S+ 0 0 4 -4,-3.1 4,-2.4 2,-0.2 3,-1.7 0.973 114.8 44.7 -65.5 -54.8 40.1 -5.9 47.0 70 105 A R H >X S+ 0 0 170 -4,-2.7 4,-2.3 1,-0.3 3,-0.6 0.980 110.5 55.6 -50.5 -59.2 39.6 -9.5 46.0 71 106 A A H 3X S+ 0 0 36 -4,-2.7 4,-1.0 -5,-0.3 -1,-0.3 0.668 110.7 47.8 -48.6 -17.0 41.7 -8.8 42.9 72 107 A E H <> S+ 0 0 20 -3,-1.7 4,-2.1 -4,-0.5 -1,-0.3 0.836 104.2 55.2 -93.2 -40.5 44.4 -7.6 45.3 73 108 A R H X S+ 0 0 139 -4,-2.3 4,-2.0 1,-0.2 3,-0.6 0.990 105.5 48.8 -52.7 -72.9 44.9 -12.7 44.6 75 110 A R H 3X S+ 0 0 142 -4,-1.0 4,-1.1 1,-0.3 -1,-0.2 0.799 108.9 56.6 -35.8 -43.2 48.0 -10.9 43.5 76 111 A E H >< S+ 0 0 33 -4,-2.1 3,-1.1 2,-0.2 -1,-0.3 0.972 109.9 42.1 -57.8 -57.0 49.3 -11.2 47.1 77 112 A A H << S+ 0 0 36 -4,-2.3 -2,-0.2 -3,-0.6 -1,-0.2 0.978 104.7 64.0 -53.1 -60.8 49.0 -15.0 47.1 78 113 A A H 3< S+ 0 0 91 -4,-2.0 -1,-0.3 -5,-0.1 -2,-0.2 0.765 112.2 43.4 -32.3 -34.3 50.4 -15.2 43.6 79 114 A R S << S- 0 0 77 -3,-1.1 3,-0.2 -4,-1.1 -3,-0.1 0.416 122.2 -12.3 -84.3-130.6 53.5 -13.8 45.4 80 115 A G S S- 0 0 50 1,-0.2 2,-0.2 2,-0.1 -1,-0.1 0.298 107.2 -26.7 -59.8-170.5 54.5 -15.2 48.8 81 116 A D > - 0 0 62 1,-0.2 3,-1.0 3,-0.1 4,-0.4 -0.177 49.3-147.8 -48.7 107.0 52.6 -17.5 51.2 82 117 A A T 3 S+ 0 0 68 1,-0.3 4,-0.4 -3,-0.2 -1,-0.2 0.598 102.9 37.6 -52.1 -14.8 48.9 -17.2 50.8 83 118 A A T 3> S+ 0 0 72 2,-0.2 4,-1.6 3,-0.1 -1,-0.3 0.571 98.8 73.4-111.8 -19.3 48.5 -17.9 54.5 84 119 A A T <4 S+ 0 0 69 -3,-1.0 4,-0.3 1,-0.2 -2,-0.2 0.454 112.0 35.7 -72.5 2.1 51.6 -15.9 55.6 85 120 A E T > S+ 0 0 41 -4,-0.4 4,-1.9 2,-0.1 5,-0.3 0.596 101.7 68.8-121.8 -35.9 49.3 -13.1 54.8 86 121 A K H > S+ 0 0 63 -4,-0.4 4,-1.4 -5,-0.3 -2,-0.2 0.886 106.6 48.5 -53.2 -35.0 45.9 -14.4 55.9 87 122 A Q H X S+ 0 0 55 -4,-1.6 4,-4.2 2,-0.2 3,-0.3 0.976 101.7 56.9 -68.8 -61.8 47.4 -14.1 59.4 88 123 A R H > S+ 0 0 68 1,-0.3 4,-3.7 -4,-0.3 5,-0.3 0.884 110.1 47.8 -39.2 -51.6 48.8 -10.6 59.3 89 124 A L H X S+ 0 0 18 -4,-1.9 4,-3.6 1,-0.2 -1,-0.3 0.931 116.8 41.9 -58.4 -46.3 45.4 -9.2 58.4 90 125 A A H X S+ 0 0 61 -4,-1.4 4,-0.5 -3,-0.3 -2,-0.2 0.858 115.6 50.1 -70.3 -34.3 43.7 -11.3 61.2 91 126 A S H >X S+ 0 0 73 -4,-4.2 3,-0.8 2,-0.2 4,-0.6 0.979 119.2 37.9 -66.0 -52.7 46.6 -10.4 63.6 92 127 A L H >< S+ 0 0 12 -4,-3.7 3,-2.1 -5,-0.3 -2,-0.2 0.970 112.9 54.8 -60.4 -57.2 46.2 -6.7 62.7 93 128 A L H >< S+ 0 0 30 -4,-3.6 3,-0.8 -5,-0.3 -1,-0.2 0.638 96.9 71.9 -52.5 -13.4 42.4 -6.7 62.5 94 129 A K H X< S+ 0 0 54 -3,-0.8 3,-3.2 -4,-0.5 -1,-0.3 0.847 76.1 76.0 -72.9 -34.3 42.5 -8.2 66.0 95 130 A D T << S+ 0 0 91 -3,-2.1 -1,-0.2 -4,-0.6 -2,-0.1 0.533 84.8 66.3 -55.9 -6.5 43.6 -4.9 67.6 96 131 A L T < 0 0 13 -3,-0.8 -1,-0.3 -4,-0.2 6,-0.3 0.559 360.0 360.0 -92.0 -6.9 40.0 -3.7 67.2 97 132 A E < 0 0 119 -3,-3.2 -1,-0.2 2,-0.1 -2,-0.1 0.834 360.0 360.0 -49.2 360.0 38.9 -6.3 69.7 98 ! 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 99 145 A K 0 0 100 0, 0.0 2,-0.1 0, 0.0 -2,-0.1 0.000 360.0 360.0 360.0 148.4 36.7 0.1 71.4 100 146 A P - 0 0 20 0, 0.0 2,-1.0 0, 0.0 37,-0.1 -0.389 360.0 -75.2-113.8-164.9 33.1 -0.3 70.0 101 147 A M + 0 0 147 -2,-0.1 2,-0.5 35,-0.1 -4,-0.1 -0.422 57.1 176.9 -92.2 58.5 30.8 -3.1 68.7 102 148 A L - 0 0 31 -2,-1.0 2,-0.2 -6,-0.3 31,-0.0 -0.511 10.9-160.0 -73.3 118.4 32.5 -3.7 65.4 103 149 A S > - 0 0 55 -2,-0.5 4,-3.6 1,-0.1 5,-0.3 -0.499 36.5 -96.6 -93.4 163.0 30.9 -6.6 63.5 104 150 A E H > S+ 0 0 154 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.907 126.4 55.1 -38.0 -55.4 32.2 -8.8 60.7 105 151 A E H > S+ 0 0 100 1,-0.2 4,-1.5 2,-0.2 -1,-0.2 0.924 114.1 36.4 -44.4 -63.1 30.4 -6.4 58.4 106 152 A D H > S+ 0 0 18 1,-0.2 4,-2.0 2,-0.2 5,-0.3 0.893 113.0 58.6 -62.0 -42.4 32.1 -3.2 59.7 107 153 A T H X S+ 0 0 28 -4,-3.6 4,-1.9 1,-0.2 -1,-0.2 0.892 104.7 51.4 -56.4 -39.6 35.4 -4.9 60.2 108 154 A N H X S+ 0 0 50 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.901 106.0 54.7 -64.3 -39.8 35.5 -5.8 56.5 109 155 A I H X S+ 0 0 7 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.869 112.8 43.2 -59.6 -38.6 34.8 -2.2 55.6 110 156 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.775 108.7 58.2 -77.2 -29.3 37.8 -1.2 57.7 111 157 A R H X S+ 0 0 53 -4,-1.9 4,-0.8 -5,-0.3 -2,-0.2 0.872 111.5 42.7 -66.0 -36.3 39.8 -4.1 56.2 112 158 A Q H < S+ 0 0 8 -4,-2.1 7,-0.6 2,-0.2 6,-0.4 0.898 120.7 39.9 -75.9 -45.6 39.1 -2.6 52.8 113 159 A L H < S+ 0 0 5 -4,-2.1 3,-0.4 -5,-0.2 7,-0.2 0.970 132.3 21.9 -70.0 -55.1 39.8 1.0 53.8 114 160 A F H < S+ 0 0 1 -4,-2.5 66,-2.1 1,-0.2 67,-0.2 0.293 126.2 45.9-101.8 11.2 42.7 0.5 56.1 115 161 A L S < S+ 0 0 0 -4,-0.8 2,-0.3 64,-0.2 -1,-0.2 -0.165 111.1 26.3-145.7 45.7 44.1 -2.9 55.0 116 162 A S S S- 0 0 0 -3,-0.4 4,-0.5 -4,-0.2 3,-0.4 -0.903 74.3-110.6 172.2 167.0 44.3 -2.8 51.2 117 163 A S S S+ 0 0 33 -2,-0.3 -4,-0.1 1,-0.2 -5,-0.1 0.122 80.0 111.0-105.3 23.1 44.6 -0.4 48.2 118 164 A A S S+ 0 0 2 -6,-0.4 -1,-0.2 1,-0.2 -5,-0.1 0.805 98.5 14.8 -64.9 -31.6 41.0 -0.9 47.0 119 165 A V S > S+ 0 0 0 -7,-0.6 3,-2.2 -3,-0.4 4,-0.5 0.725 99.3 107.1-110.8 -37.8 40.0 2.6 48.0 120 166 A S T 3 S- 0 0 30 -4,-0.5 55,-0.2 1,-0.3 58,-0.1 -0.186 107.2 -15.4 -45.8 112.9 43.4 4.1 48.6 121 167 A G T 3 S+ 0 0 40 53,-2.0 -1,-0.3 56,-0.2 54,-0.1 0.859 96.2 126.6 54.6 42.3 43.8 6.4 45.6 122 168 A S S < S- 0 0 0 -3,-2.2 -120,-1.2 2,-0.3 -2,-0.1 0.570 74.7-123.6 -99.5 -14.8 41.0 4.9 43.5 123 169 A G S S+ 0 0 12 -4,-0.5 2,-0.3 1,-0.3 48,-0.1 0.345 81.0 89.6 87.7 -4.9 39.4 8.3 43.1 124 170 A K + 0 0 27 -5,-0.3 -2,-0.3 47,-0.1 -1,-0.3 -0.791 46.2 174.1-122.2 164.6 36.2 7.1 44.6 125 171 A F - 0 0 3 -2,-0.3 2,-0.5 41,-0.2 45,-0.1 -0.957 20.9-135.1-163.1 152.0 34.7 6.8 48.1 126 172 A S > - 0 0 4 -2,-0.3 4,-1.7 1,-0.2 3,-0.2 -0.966 6.3-160.4-123.3 126.3 31.3 5.8 49.5 127 173 A F H > S+ 0 0 8 -2,-0.5 4,-3.9 35,-0.3 5,-0.3 0.929 93.0 65.5 -63.0 -44.1 29.3 7.7 52.2 128 174 A Q H > S+ 0 0 92 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.855 105.4 41.8 -45.1 -47.8 27.3 4.5 52.9 129 175 A D H > S+ 0 0 13 -3,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.912 117.8 47.6 -69.1 -41.4 30.4 2.7 54.2 130 176 A L H X S+ 0 0 0 -4,-1.7 4,-2.0 1,-0.2 5,-0.3 0.840 108.8 53.7 -68.3 -35.2 31.6 5.8 56.1 131 177 A K H X S+ 0 0 87 -4,-3.9 4,-1.8 1,-0.2 -1,-0.2 0.928 107.4 52.2 -65.2 -43.0 28.2 6.4 57.6 132 178 A Q H X S+ 0 0 66 -4,-1.6 4,-1.5 -5,-0.3 -2,-0.2 0.930 112.7 42.6 -59.4 -50.7 28.1 2.9 58.9 133 179 A V H < S+ 0 0 1 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.956 112.1 50.4 -64.2 -54.0 31.5 3.0 60.7 134 180 A L H >X S+ 0 0 2 -4,-2.0 4,-2.0 1,-0.2 3,-1.7 0.887 105.2 63.8 -51.2 -37.5 31.2 6.5 62.2 135 181 A A H >X S+ 0 0 40 -4,-1.8 2,-0.9 1,-0.3 3,-0.7 0.968 106.8 38.7 -49.1 -64.5 27.8 5.2 63.5 136 182 A K H 3< S+ 0 0 23 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 -0.131 118.0 53.4 -82.1 40.6 29.4 2.5 65.7 137 183 A Y H <> S+ 0 0 7 -3,-1.7 4,-1.1 -2,-0.9 -1,-0.2 0.482 82.2 79.1-140.9 -29.2 32.3 4.8 66.7 138 184 A A H X< S+ 0 0 8 -4,-2.0 3,-2.8 -3,-0.7 -2,-0.1 0.961 90.5 58.4 -48.1 -61.2 30.7 8.0 68.0 139 185 A D T 3< S+ 0 0 102 -4,-0.5 -1,-0.2 1,-0.3 -3,-0.1 0.878 96.0 61.5 -33.1 -64.0 30.0 6.4 71.4 140 186 A T T 34 S+ 0 0 52 2,-0.0 -1,-0.3 7,-0.0 -2,-0.2 0.836 96.3 75.4 -32.9 -43.3 33.7 5.7 71.8 141 187 A I S << S- 0 0 12 -3,-2.8 3,-0.1 -4,-1.1 -4,-0.0 -0.618 93.9-123.2 -77.8 124.4 33.9 9.4 71.7 142 188 A P - 0 0 105 0, 0.0 5,-0.4 0, 0.0 -1,-0.1 -0.255 41.1 -84.7 -61.8 154.4 32.7 11.0 74.9 143 189 A E S S+ 0 0 138 4,-0.1 3,-0.1 3,-0.1 -4,-0.0 -0.200 89.2 85.9 -55.0 156.7 29.9 13.6 74.6 144 190 A G S S- 0 0 24 1,-0.2 4,-0.4 -3,-0.1 162,-0.0 -0.986 92.6 -45.6 145.7-156.0 31.3 17.0 73.7 145 191 A P S >> S+ 0 0 30 0, 0.0 4,-2.0 0, 0.0 3,-1.7 0.962 125.1 53.2 -79.0 -52.9 32.4 18.9 70.6 146 192 A L H 3> S+ 0 0 19 1,-0.3 4,-1.8 2,-0.2 -3,-0.1 0.829 107.9 53.3 -51.9 -34.9 34.4 16.4 68.7 147 193 A K H 3> S+ 0 0 38 -5,-0.4 4,-2.5 2,-0.2 -1,-0.3 0.738 106.7 54.0 -73.6 -21.4 31.5 13.9 68.9 148 194 A K H <> S+ 0 0 60 -3,-1.7 4,-2.0 -4,-0.4 -2,-0.2 0.934 105.8 49.5 -76.1 -48.3 29.2 16.5 67.4 149 195 A L H X S+ 0 0 0 -4,-2.0 4,-1.1 1,-0.2 -2,-0.2 0.922 113.8 51.3 -54.0 -42.2 31.5 17.2 64.4 150 196 A F H >X S+ 0 0 4 -4,-1.8 4,-1.0 -5,-0.3 3,-0.9 0.967 111.6 42.2 -58.8 -58.4 31.4 13.4 64.1 151 197 A V H 3X S+ 0 0 43 -4,-2.5 4,-2.5 1,-0.3 -1,-0.2 0.663 104.7 66.5 -67.4 -16.0 27.6 12.9 64.2 152 198 A M H 3X S+ 0 0 25 -4,-2.0 4,-0.6 1,-0.2 5,-0.5 0.881 103.0 47.1 -70.3 -34.9 27.1 15.9 62.0 153 199 A V H << S+ 0 0 0 -4,-1.1 -2,-0.2 -3,-0.9 -1,-0.2 0.799 115.4 46.9 -72.6 -30.5 28.7 13.9 59.2 154 200 A E H < S+ 0 0 46 -4,-1.0 -2,-0.2 1,-0.2 -1,-0.1 0.906 99.0 61.4 -82.1 -48.3 26.6 10.8 60.0 155 201 A N H < S- 0 0 100 -4,-2.5 -1,-0.2 1,-0.1 4,-0.2 0.830 88.0-158.3 -49.3 -27.2 23.2 12.3 60.3 156 202 A D >< - 0 0 21 -4,-0.6 3,-2.1 1,-0.2 2,-0.3 0.913 8.6-148.6 45.1 60.0 23.7 13.3 56.6 157 203 A T G > S- 0 0 96 -5,-0.5 3,-1.3 1,-0.3 -1,-0.2 -0.393 74.6 -12.1 -66.0 115.2 21.1 16.1 56.6 158 204 A K G 3 S- 0 0 33 -2,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.737 114.5 -82.3 69.5 15.9 19.4 16.5 53.1 159 205 A G G <> S+ 0 0 1 -3,-2.1 4,-2.2 -4,-0.2 -1,-0.2 0.651 95.4 135.2 56.4 16.3 22.2 14.2 51.8 160 206 A R H <> S+ 0 0 119 -3,-1.3 4,-1.1 1,-0.2 -1,-0.1 0.760 75.6 46.7 -65.0 -24.0 24.5 17.2 51.6 161 207 A M H > S+ 0 0 2 2,-0.2 4,-1.8 1,-0.1 -1,-0.2 0.858 107.8 56.8 -82.6 -37.7 27.2 15.0 53.2 162 208 A S H > S+ 0 0 17 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.867 107.6 47.7 -60.1 -41.2 26.4 12.2 50.9 163 209 A Y H X>S+ 0 0 28 -4,-2.2 4,-2.8 1,-0.2 5,-1.4 0.925 109.3 51.8 -67.7 -45.9 27.1 14.3 47.8 164 210 A I H <>S+ 0 0 16 -4,-1.1 5,-3.3 3,-0.2 -2,-0.2 0.836 114.5 44.8 -60.5 -33.8 30.4 15.8 49.1 165 211 A T H <5S+ 0 0 0 -4,-1.8 -2,-0.2 3,-0.2 8,-0.2 0.949 121.6 33.8 -76.0 -51.3 31.7 12.2 49.8 166 212 A L H <5S+ 0 0 3 -4,-2.1 -41,-0.2 -5,-0.2 -2,-0.2 0.871 139.0 6.8 -73.9 -42.4 30.6 10.5 46.6 167 213 A V T <5S+ 0 0 10 -4,-2.8 3,-0.4 -5,-0.3 4,-0.3 0.850 123.4 46.6-107.1 -64.2 31.0 13.4 44.1 168 214 A A T S+ 0 0 4 -3,-0.4 4,-1.8 1,-0.2 -47,-0.2 0.859 78.2 54.5 -59.3 -39.7 35.9 11.6 46.8 171 217 A N H > S+ 0 0 110 -4,-0.3 4,-0.5 1,-0.2 -48,-0.2 0.886 112.3 45.4 -62.8 -37.0 39.2 11.9 45.1 172 218 A D H > S+ 0 0 70 -3,-0.2 4,-0.8 1,-0.2 -2,-0.2 0.785 108.4 54.9 -76.7 -30.7 40.5 13.6 48.2 173 219 A L H X S+ 0 0 0 -4,-1.8 4,-0.5 1,-0.2 3,-0.3 0.829 105.8 53.3 -72.1 -32.1 38.9 11.2 50.7 174 220 A A H < S+ 0 0 0 -4,-1.8 -53,-2.0 1,-0.2 -1,-0.2 0.678 104.4 55.7 -76.5 -18.9 40.7 8.3 49.0 175 221 A A H < S+ 0 0 54 -4,-0.5 -1,-0.2 -55,-0.2 -2,-0.2 0.719 101.8 55.8 -85.0 -22.7 44.1 10.0 49.3 176 222 A L H < S+ 0 0 20 -4,-0.8 2,-0.2 -3,-0.3 -1,-0.2 0.665 100.2 78.2 -80.2 -18.0 43.7 10.4 53.1 177 223 A V < + 0 0 3 -4,-0.5 2,-0.3 -58,-0.1 -56,-0.2 -0.610 58.9 160.9 -92.2 150.4 43.2 6.6 53.3 178 224 A A - 0 0 13 -2,-0.2 2,-0.8 -65,-0.2 -61,-0.1 -0.989 44.8 -91.0-164.5 160.9 46.0 4.0 53.0 179 225 A D >> - 0 0 6 -2,-0.3 3,-3.0 1,-0.2 4,-1.3 -0.697 29.6-145.9 -83.1 110.1 46.9 0.4 53.8 180 226 A F H 3> S+ 0 0 0 -66,-2.1 4,-3.0 -2,-0.8 -1,-0.2 0.783 95.4 65.1 -42.3 -37.3 48.4 0.2 57.2 181 227 A R H 34 S+ 0 0 27 1,-0.2 -1,-0.3 -67,-0.2 6,-0.2 0.689 102.8 46.6 -64.7 -18.4 50.8 -2.6 56.1 182 228 A K H <4 S+ 0 0 143 -3,-3.0 -1,-0.2 1,-0.1 -2,-0.2 0.743 111.5 50.9 -94.9 -26.4 52.5 -0.3 53.7 183 229 A I H < S+ 0 0 11 -4,-1.3 2,-2.0 1,-0.2 -2,-0.2 0.986 97.0 69.5 -67.9 -59.5 52.8 2.3 56.2 184 230 A D >< - 0 0 2 -4,-3.0 3,-1.2 1,-0.2 -1,-0.2 -0.375 69.6-176.7 -60.1 82.0 54.3 -0.0 58.7 185 231 A T T 3 S+ 0 0 104 -2,-2.0 -1,-0.2 1,-0.2 -4,-0.1 0.321 77.2 45.4 -70.1 10.7 57.6 -0.4 56.8 186 232 A N T 3 S- 0 0 76 2,-0.2 -1,-0.2 4,-0.1 3,-0.1 0.297 105.7-122.4-136.5 5.6 59.0 -3.0 59.3 187 233 A S < + 0 0 72 -3,-1.2 2,-0.4 1,-0.2 -2,-0.1 0.689 67.4 127.9 58.4 27.9 56.0 -5.2 59.6 188 234 A N S S- 0 0 73 2,-0.2 2,-2.0 -7,-0.0 -2,-0.2 -0.915 77.2-103.2 -98.3 145.7 55.4 -5.1 63.4 189 235 A G S S+ 0 0 34 -2,-0.4 39,-0.8 -3,-0.1 2,-0.3 0.082 96.1 76.8 -62.7 29.7 51.8 -4.1 64.1 190 236 A T E S-A 227 0A 43 -2,-2.0 2,-0.3 37,-0.2 37,-0.3 -0.969 72.2-133.0-148.2 133.0 52.7 -0.5 65.1 191 237 A L E -A 226 0A 0 35,-4.2 35,-3.1 -2,-0.3 2,-0.1 -0.622 30.4-138.3 -78.9 132.6 53.7 2.7 63.2 192 238 A S > - 0 0 37 -2,-0.3 4,-2.9 33,-0.2 5,-0.2 -0.300 26.6-101.8 -84.2 174.6 56.8 4.3 64.6 193 239 A R H > S+ 0 0 66 31,-0.5 4,-1.8 1,-0.2 5,-0.2 0.859 125.1 48.9 -65.7 -32.9 57.2 8.1 65.1 194 240 A K H > S+ 0 0 153 2,-0.2 4,-2.7 3,-0.1 -1,-0.2 0.957 114.1 42.4 -71.0 -51.2 59.3 8.0 62.0 195 241 A E H > S+ 0 0 18 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.941 112.4 54.7 -59.6 -50.7 56.9 6.1 59.8 196 242 A F H >X S+ 0 0 1 -4,-2.9 4,-2.8 2,-0.2 3,-0.7 0.961 113.7 41.4 -45.1 -66.2 53.9 8.0 61.1 197 243 A R H 3X S+ 0 0 56 -4,-1.8 4,-2.2 1,-0.3 5,-0.3 0.945 112.9 53.1 -44.4 -67.0 55.6 11.3 60.1 198 244 A E H 3< S+ 0 0 129 -4,-2.7 4,-0.4 1,-0.2 -1,-0.3 0.773 113.8 44.1 -41.8 -38.6 56.9 10.0 56.8 199 245 A H H X< S+ 0 0 36 -4,-2.7 3,-1.8 -3,-0.7 -1,-0.2 0.979 116.5 44.2 -73.1 -57.3 53.4 8.8 55.9 200 246 A F H ><>S+ 0 0 4 -4,-2.8 5,-1.2 1,-0.3 3,-1.0 0.603 101.5 67.4 -64.6 -13.1 51.6 11.9 57.0 201 247 A V G ><5S+ 0 0 67 -4,-2.2 3,-0.6 -5,-0.3 -1,-0.3 0.750 98.5 55.8 -76.9 -21.9 54.1 14.3 55.5 202 248 A R G < 5S+ 0 0 78 -3,-1.8 -1,-0.2 -4,-0.4 -2,-0.2 0.023 99.9 58.2 -97.4 25.1 52.9 13.0 52.1 203 249 A L G < 5S- 0 0 44 -3,-1.0 -1,-0.2 -27,-0.0 -2,-0.2 0.234 132.3 -77.8-131.2 5.2 49.3 13.9 52.8 204 250 A G T < 5S+ 0 0 45 -3,-0.6 2,-0.5 -4,-0.1 -3,-0.2 0.669 96.5 118.9 103.9 23.5 49.9 17.6 53.3 205 251 A F < + 0 0 1 -5,-1.2 -3,-0.1 1,-0.1 -1,-0.1 -0.722 16.1 143.3-122.7 81.9 51.2 17.6 56.8 206 252 A D + 0 0 105 -2,-0.5 2,-0.5 -3,-0.1 -1,-0.1 0.588 43.2 101.0 -92.9 -14.2 54.7 19.1 56.7 207 253 A K > - 0 0 90 1,-0.2 4,-2.3 -3,-0.2 3,-0.3 -0.631 59.3-156.5 -76.8 121.5 54.5 21.0 60.0 208 254 A K H > S+ 0 0 156 -2,-0.5 4,-2.6 1,-0.2 5,-0.4 0.959 96.4 58.1 -58.5 -50.9 56.3 19.1 62.9 209 255 A S H 4 S+ 0 0 77 1,-0.3 4,-0.5 2,-0.2 -1,-0.2 0.810 111.3 41.7 -47.7 -36.8 54.0 21.0 65.3 210 256 A V H > S+ 0 0 9 -3,-0.3 4,-1.7 2,-0.2 -1,-0.3 0.824 110.7 55.3 -83.5 -33.9 51.0 19.6 63.5 211 257 A Q H >X S+ 0 0 10 -4,-2.3 4,-2.9 2,-0.2 3,-0.6 0.965 106.8 49.2 -62.8 -51.8 52.4 16.1 63.1 212 258 A D H 3X S+ 0 0 51 -4,-2.6 4,-2.4 1,-0.3 -1,-0.2 0.803 107.5 59.9 -55.5 -29.1 53.1 15.6 66.8 213 259 A A H 3> S+ 0 0 9 -4,-0.5 4,-0.8 -5,-0.4 -1,-0.3 0.915 108.3 41.3 -65.2 -45.1 49.5 16.9 67.2 214 260 A L H XX S+ 0 0 0 -4,-1.7 4,-2.6 -3,-0.6 3,-0.8 0.936 114.5 50.7 -68.9 -47.7 48.2 14.0 65.2 215 261 A F H 3X S+ 0 0 0 -4,-2.9 4,-1.8 1,-0.3 -2,-0.2 0.892 110.4 51.1 -56.7 -40.2 50.5 11.4 66.8 216 262 A R H 3< S+ 0 0 164 -4,-2.4 -1,-0.3 -5,-0.3 -2,-0.2 0.757 111.3 49.8 -68.5 -23.5 49.3 12.8 70.2 217 263 A Y H << S+ 0 0 22 -4,-0.8 -2,-0.2 -3,-0.8 -1,-0.2 0.948 116.4 37.5 -79.2 -52.4 45.8 12.3 69.0 218 264 A A H < S+ 0 0 5 -4,-2.6 2,-1.5 1,-0.2 -2,-0.2 0.982 100.4 75.2 -61.8 -65.5 46.0 8.7 67.8 219 265 A D < + 0 0 18 -4,-1.8 3,-0.3 -5,-0.2 -1,-0.2 -0.327 55.7 160.1 -58.9 85.5 48.4 7.3 70.4 220 266 A E + 0 0 70 -2,-1.5 -1,-0.2 1,-0.2 -2,-0.1 0.966 67.8 53.2 -76.4 -58.5 46.0 6.9 73.4 221 267 A D S S- 0 0 113 1,-0.1 -1,-0.2 2,-0.1 -2,-0.1 0.455 114.4-119.4 -61.9 6.9 47.6 4.4 75.7 222 268 A E + 0 0 171 -3,-0.3 2,-0.4 1,-0.2 -2,-0.1 0.947 61.4 142.2 56.3 66.7 50.6 6.8 75.3 223 269 A S - 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